A0A077ZCK5_TRITR Loading...

Niemann Pick C1 protein

AlphaFold DB , UniProt , Accession A0A077ZCK5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,161 aa.

						>A0A077ZCK5_TRITR|A0A077ZCK5
MWSLVNHGWSSGLQDDACTMTDWLRFMGDITENPMAPFQINFVVHDENEPSLIDVGIRPMNLSTFSCAVGIDDNTLPCSCQDCPAACHNVVPYPSEEKTECRLGNMECAVFVSSVACCGLCAVIVILVSAHYVIVGTPLAKTVVTVGVGGNEPYATSRNAPTALLDPDDVSIYTRMGFWLDTKLQDGFHRWGIICTRHPVLIFLAGFLVSVACCCGLFYMEITTDPVQIWSAPGSRARREKQFFDSHFQPFYRIEQLIIVPNNQSAFEATDPMDSAKILLGPVFRKEFLQDVLQLQESIRNLVTYSNNQTITLGDVCVKPLAPEKDECLVQSVLGYFQTNETTLDREEYEYGFLIANWISHLRSCLKNPMQVMDTTPMGMSCLSEYGGPVFPYVALGGFNGTDYFSSTALVVTYMVENYDNPEKNLAAMDWEAKFIEFVNGYRHPNMTISFKAERSIEDEIRRASHGDVATILISYCVMFVYIAVALGQYDVYNDNLVSIFVRSKILLGLLGVLVVFLSVLSSLGFYAFLGIPTTLISIEVVPFLVLAVGVDNIFILIQTFQRRRSKAPELLEEQVARITAEVVPTMLLSSFSEGFCFFLGALSSMPAVKIFSLYAALAIFFDFFLQVTCFLAMFTIDLRREMSGRLEVCCCVTVAPDNTESVGFLQCLIRDYYTPFLLWKPVRVIVLLVFCVWCCSSLAVVNKLDLGLDEKLSMPQDSYMQDYFHAFNKYLAVGPPVYFVVQGDYDYSDPKKQNKICGSTGCDEDSLYGQVYRASLYPNRSYIAAPVSSWLDDYFDWLRPVGKTPCCRFFAHNDTFCPSYVVSTDCHTCVSSFVSGRPDATSFSDYIGVFLMDNPSITCSKGGHGAYQKSVLLSVESKVISSNFATYHSVLKNSSDYIAALINARAIAANITAAINVGSADSQVQVFPYSIFYVFYEQYLTLAWDATMQLLLSLAAIFIVSAILMGLDVWSSCIIVCVISAILFNLMGLMFWWNIAFNAVSLVNLVMVLVSAGTFPHLAVGISVEFCAHITRAFASSVCPTRLERSQEALETVGASVLSGITLTKFGGIVVLAFSHSQIFQVFYFRMYLGIVLFGAAHGLVFLPVFLSFVGPPLNKLKIYQKQCCDIYNAQRQLAGTEQISPSLDNVQYPSFDHSFNVAT
					

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(Predicted Aligned Error values between residue pairs)

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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	27	Very low	34.5	Very low	179 Å²	179	72.4 Å²	72.4	88%	0.882	36%	0.364	S	S	*	.				0	-64.9	0	-117.8	171.8	-178	0	0	110.7	S3 L4 V5	M1-S3 PolarHBondContact O-N 3.01Å; M1-L4 WeakPolarHBondContact O-CA 3.17Å; M1-L4 VanDerWaalsContact O-CB 3.28Å; M1-L4 WeakPolarHBondContact O-CB 3.43Å; M1-L4 PolarHBondContact O-N 3Å; M1-V5 PolarHBondContact O-N 2.95Å
2	W	25.7	Very low	35.2	Very low	128 Å²	128	69 Å²	69	49%	0.485	36%	0.361	S	S	.	.	H	α-helix	trans	-55.7	-43.7	176.4	-103.9	73.6	0	0	0	114.1	L4 V5 N6 C67	W2-L4 PolarHBondContact O-N 2.89Å; W2-L4 VanDerWaalsContact O-N 3.14Å; W2-V5 WeakPolarHBondContact O-CB 3.4Å; W2-V5 PolarHBondContact O-N 3.49Å; W2-N6 PolarHBondContact O-N 3.22Å; W2-C67 HydrophobicContact CE3-CB 4.3Å; W2-C67 HydrophobicContact CH2-CB 3.52Å; W2-C67 WeakPolarHBondContact CH2-SG 3.28Å; W2-C67 HydrophobicContact CZ2-CB 3.77Å; W2-C67 HydrophobicContact CZ3-CB 3.79Å
3	S	26.2	Very low	35.5	Very low	62 Å²	62	68.4 Å²	68.4	43%	0.434	36%	0.358	S	S	.	.	H	α-helix	trans	-66.8	-9.1	173	58.8	0	0	0	0	115.6	M1 W9	M1-S3 PolarHBondContact O-N 3.01Å; S3-W9 PolarHBondContact O-NE1 2.82Å
4	L	32	Very low	36.2	Very low	73 Å²	73	69 Å²	69	38%	0.382	36%	0.358	S	S	.	.	H	α-helix	trans	-86.5	-21.4	169.2	-60.8	170.8	0	0	0	111.9	M1 W2 W9 S10	M1-L4 WeakPolarHBondContact O-CA 3.17Å; M1-L4 VanDerWaalsContact O-CB 3.28Å; M1-L4 WeakPolarHBondContact O-CB 3.43Å; M1-L4 PolarHBondContact O-N 3Å; W2-L4 PolarHBondContact O-N 2.89Å; W2-L4 VanDerWaalsContact O-N 3.14Å; L4-W9 HydrophobicContact CB-CB 3.97Å; L4-W9 HydrophobicContact CB-CG 4.44Å; L4-W9 HydrophobicContact CD2-CB 3.58Å; L4-W9 HydrophobicContact CD2-CD2 3.99Å; L4-W9 HydrophobicContact CD2-CE3 4.29Å; L4-W9 HydrophobicContact CD2-CG 3.69Å; L4-W9 HydrophobicContact CG-CB 4.39Å; L4-W9 WeakPolarHBondContact O-CB 3.18Å; L4-W9 PolarHBondContact O-N 3.34Å; L4-W9 VanDerWaalsContact O-N 3.14Å; L4-S10 PolarHBondContact O-N 3.39Å; L4-S10 PolarHBondContact O-OG 3.08Å
5	V	32.4	Very low	37	Very low	56 Å²	56	70 Å²	70	34%	0.339	36%	0.364	S	S	.	.	H	α-helix	trans	-88.9	-44.1	-177.5	178.1	0	0	0	0	111.1	M1 W2 H7 W23	M1-V5 PolarHBondContact O-N 2.95Å; W2-V5 WeakPolarHBondContact O-CB 3.4Å; W2-V5 PolarHBondContact O-N 3.49Å; V5-H7 PolarHBondContact O-N 2.94Å; V5-H7 VanDerWaalsContact O-N 3.1Å; V5-W23 HydrophobicContact CG2-CZ2 4.04Å
6	N	31.4	Very low	37.8	Very low	59 Å²	59	74.4 Å²	74.4	32%	0.316	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	4.1	-179.4	-69.8	-3.7	0	0	0	115.4	W2 D82	W2-N6 PolarHBondContact O-N 3.22Å; N6-D82 PolarHBondContact ND2-O 3.31Å
7	H	36.9	Very low	38.6	Very low	112 Å²	112	73.2 Å²	73.2	52%	0.519	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-149.3	27.5	-170.7	-71.4	-41.7	0	0	0	111.4	V5 W9 D15	V5-H7 PolarHBondContact O-N 2.94Å; V5-H7 VanDerWaalsContact O-N 3.1Å; H7-W9 AromaticContact CG-NE1 3.98Å; H7-W9 PolarHBondContact O-N 2.79Å; H7-D15 WeakPolarHBondContact CA-OD1 3.46Å; H7-D15 PolarHBondContact N-OD1 3.18Å
8	G	37.8	Very low	39.9	Very low	13 Å²	13	71.2 Å²	71.2	13%	0.134	38%	0.384	C	S	.	.	S	Bend	trans	67.3	-9.4	170.6	0	0	0	0	0	118.2	S10 S11 D15	G8-S10 PolarHBondContact O-N 3.35Å; G8-S11 PolarHBondContact O-N 3.38Å; G8-S11 VanDerWaalsContact O-N 3.12Å; G8-D15 WeakPolarHBondContact CA-OD1 3Å; G8-D15 PolarHBondContact N-OD1 3.23Å
9	W	44.5	Very low	41.7	Very low	89 Å²	89	70.9 Å²	70.9	34%	0.337	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.1	-24.8	-173.5	-53.6	74.2	0	0	0	114.5	S3 L4 H7 N368 M370	S3-W9 PolarHBondContact O-NE1 2.82Å; L4-W9 HydrophobicContact CB-CB 3.97Å; L4-W9 HydrophobicContact CB-CG 4.44Å; L4-W9 HydrophobicContact CD2-CB 3.58Å; L4-W9 HydrophobicContact CD2-CD2 3.99Å; L4-W9 HydrophobicContact CD2-CE3 4.29Å; L4-W9 HydrophobicContact CD2-CG 3.69Å; L4-W9 HydrophobicContact CG-CB 4.39Å; L4-W9 WeakPolarHBondContact O-CB 3.18Å; L4-W9 PolarHBondContact O-N 3.34Å; L4-W9 VanDerWaalsContact O-N 3.14Å; H7-W9 AromaticContact CG-NE1 3.98Å; H7-W9 PolarHBondContact O-N 2.79Å; W9-N368 VanDerWaalsContact CE2-ND2 3.32Å; W9-N368 WeakPolarHBondContact CH2-ND2 3.48Å; W9-N368 WeakPolarHBondContact CZ2-ND2 3.31Å; W9-N368 WeakPolarHBondContact CZ3-ND2 3.32Å; W9-M370 HydrophobicContact CH2-CB 4.11Å
10	S	44.1	Very low	43.6	Very low	20 Å²	20	72.9 Å²	72.9	14%	0.14	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115	19.6	-176.6	57.3	0	0	0	0	115.6	L4 G8 W23 F26	L4-S10 PolarHBondContact O-N 3.39Å; L4-S10 PolarHBondContact O-OG 3.08Å; G8-S10 PolarHBondContact O-N 3.35Å; S10-W23 PolarHBondContact OG-NE1 2.84Å; S10-F26 VanDerWaalsContact C-CD1 3.4Å; S10-F26 WeakPolarHBondContact O-CD1 3.33Å
11	S	41	Very low	45.4	Very low	5 Å²	5	73.1 Å²	73.1	4%	0.035	40%	0.397	C	S	.	.	T	Hydrogen-bonded Turn	trans	-135.6	-11.2	174.5	64.4	0	0	0	0	115.5	G8 L13 C18	G8-S11 PolarHBondContact O-N 3.38Å; G8-S11 VanDerWaalsContact O-N 3.12Å; S11-L13 PolarHBondContact O-N 2.72Å; S11-L13 PolarHBondContact OG-N 3.47Å; S11-C18 WeakPolarHBondContact CB-SG 3.33Å; S11-C18 PolarHBondContact OG-SG 3.18Å
12	G	43.4	Very low	47.6	Very low	32 Å²	32	67 Å²	67	33%	0.33	37%	0.368	S	S	.	.	S	Bend	trans	64.6	5.3	-174.1	0	0	0	0	0	114.2	K367	G12-K367 PolarHBondContact O-NZ 3.1Å
13	L	39.5	Very low	49.9	Very low	61 Å²	61	64.3 Å²	64.3	32%	0.319	36%	0.357	S	S	.	.	S	Bend	trans	-117.4	170.8	-174.1	-75.7	160.9	0	0	0	111.2	S11 D22	S11-L13 PolarHBondContact O-N 2.72Å; S11-L13 PolarHBondContact OG-N 3.47Å; L13-D22 HydrophobicContact CD1-CB 3.63Å
14	Q	44.7	Very low	52.8	Low	77 Å²	77	62.7 Å²	62.7	36%	0.36	34%	0.344	S	S	.	.			trans	-74.6	142.4	-177.6	-171.8	171.2	5.3	0	0	110.3	D16 A17 C18	Q14-D16 PolarHBondContact O-N 3.44Å; Q14-A17 HydrophobicContact CB-CB 4.21Å; Q14-A17 CarbonylContact O-C 3.58Å; Q14-A17 WeakPolarHBondContact O-CA 3.44Å; Q14-A17 PolarHBondContact O-N 3.44Å; Q14-C18 PolarHBondContact O-N 3.25Å
15	D	47.9	Very low	55.2	Low	84 Å²	84	66 Å²	66	45%	0.449	35%	0.351	S	S	.	.	G	3₁₀ helix	trans	-51	-51.6	-172.4	-71	-43.7	0	0	0	113.2	H7 G8 A17 C18	H7-D15 WeakPolarHBondContact CA-OD1 3.46Å; H7-D15 PolarHBondContact N-OD1 3.18Å; G8-D15 WeakPolarHBondContact CA-OD1 3Å; G8-D15 PolarHBondContact N-OD1 3.23Å; D15-A17 PolarHBondContact O-N 3.26Å; D15-C18 PolarHBondContact O-N 2.84Å
16	D	50.3	Low	57.3	Low	141 Å²	141	64 Å²	64	75%	0.754	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-68.5	-12.9	179.7	-59.6	-53.3	0	0	0	114.3	Q14	Q14-D16 PolarHBondContact O-N 3.44Å
17	A	52.2	Low	59.7	Low	53 Å²	53	64 Å²	64	44%	0.438	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-109.4	-7.5	-176.6	0	0	0	0	0	113.6	Q14 D15 T19	Q14-A17 HydrophobicContact CB-CB 4.21Å; Q14-A17 CarbonylContact O-C 3.58Å; Q14-A17 WeakPolarHBondContact O-CA 3.44Å; Q14-A17 PolarHBondContact O-N 3.44Å; D15-A17 PolarHBondContact O-N 3.26Å; A17-T19 PolarHBondContact O-N 3.5Å; A17-T19 VanDerWaalsContact O-N 3.09Å
18	C	61.4	Low	62	Low	38 Å²	38	58.7 Å²	58.7	26%	0.257	31%	0.312	S	S	.	.			trans	-73.1	96.7	-177.8	-176.8	0	0	0	0	110.8	S11 Q14 D15	S11-C18 WeakPolarHBondContact CB-SG 3.33Å; S11-C18 PolarHBondContact OG-SG 3.18Å; Q14-C18 PolarHBondContact O-N 3.25Å; D15-C18 PolarHBondContact O-N 2.84Å
19	T	74	Confident	63.9	Low	65 Å²	65	59 Å²	59	40%	0.399	31%	0.31	S	S	.	.			trans	-78.2	157.9	172.3	75.6	0	0	0	0	111	A17 T21 D22 W23	A17-T19 PolarHBondContact O-N 3.5Å; A17-T19 VanDerWaalsContact O-N 3.09Å; T19-T21 PolarHBondContact O-N 3.22Å; T19-T21 PolarHBondContact OG1-N 2.77Å; T19-T21 PolarHBondContact OG1-OG1 3.37Å; T19-D22 VanDerWaalsContact CB-OD2 3.27Å; T19-D22 WeakPolarHBondContact CB-OD2 3.15Å; T19-D22 WeakPolarHBondContact CG2-OD2 3.25Å; T19-D22 PolarHBondContact N-OD2 2.73Å; T19-D22 PolarHBondContact O-N 2.85Å; T19-D22 PolarHBondContact OG1-N 2.79Å; T19-D22 PolarHBondContact OG1-OD2 3.3Å; T19-W23 PolarHBondContact O-N 3Å
20	M	78.9	Confident	65.5	Low	111 Å²	111	58.8 Å²	58.8	55%	0.547	32%	0.315	S	S	.	.	H	α-helix	trans	-54.9	-35	173.1	-172.2	-167.9	76	0	0	111.9	L24 V44	M20-L24 HydrophobicContact CE-CD1 4.03Å; M20-L24 HydrophobicContact CG-CD1 4.05Å; M20-L24 WeakPolarHBondContact O-CB 3.46Å; M20-L24 WeakPolarHBondContact O-CD1 3.45Å; M20-L24 VanDerWaalsContact O-CG 3.22Å; M20-L24 WeakPolarHBondContact O-CG 3.35Å; M20-L24 PolarHBondContact O-N 3.14Å; M20-V44 HydrophobicContact CE-CB 4.38Å; M20-V44 HydrophobicContact CE-CG1 3.67Å; M20-V44 HydrophobicContact CE-CG2 3.73Å
21	T	81.2	Confident	66.6	Low	78 Å²	78	63.5 Å²	63.5	48%	0.479	34%	0.343	S	S	.	.	H	α-helix	trans	-66	-39.3	175.4	22.7	0	0	0	0	113	T19 R25 V44	T19-T21 PolarHBondContact O-N 3.22Å; T19-T21 PolarHBondContact OG1-N 2.77Å; T19-T21 PolarHBondContact OG1-OG1 3.37Å; T21-R25 WeakPolarHBondContact O-CB 2.94Å; T21-R25 PolarHBondContact O-N 3.25Å; T21-V44 HydrophobicContact CG2-CB 4.39Å; T21-V44 HydrophobicContact CG2-CG2 3.92Å
22	D	74.4	Confident	67.7	Low	50 Å²	50	66 Å²	66	27%	0.267	35%	0.354	S	S	.	.	H	α-helix	trans	-72	-40	177.3	-51.3	-50.1	0	0	0	111.4	L13 T19 R25 F26	L13-D22 HydrophobicContact CD1-CB 3.63Å; T19-D22 VanDerWaalsContact CB-OD2 3.27Å; T19-D22 WeakPolarHBondContact CB-OD2 3.15Å; T19-D22 WeakPolarHBondContact CG2-OD2 3.25Å; T19-D22 PolarHBondContact N-OD2 2.73Å; T19-D22 PolarHBondContact O-N 2.85Å; T19-D22 PolarHBondContact OG1-N 2.79Å; T19-D22 PolarHBondContact OG1-OD2 3.3Å; D22-R25 WeakPolarHBondContact O-CB 3.32Å; D22-R25 PolarHBondContact O-N 3.33Å; D22-F26 PolarHBondContact O-N 2.78Å
23	W	74.9	Confident	68.8	Low	72 Å²	72	65.5 Å²	65.5	27%	0.273	34%	0.344	S	S	.	.	H	α-helix	trans	-61.1	-46.3	174.4	179.6	60.7	0	0	0	112.3	V5 S10 T19 F26 M27	V5-W23 HydrophobicContact CG2-CZ2 4.04Å; S10-W23 PolarHBondContact OG-NE1 2.84Å; T19-W23 PolarHBondContact O-N 3Å; W23-F26 PolarHBondContact O-N 3.37Å; W23-M27 HydrophobicContact CD2-CE 3.63Å; W23-M27 HydrophobicContact CD2-SD 4.38Å; W23-M27 HydrophobicContact CE3-CE 3.69Å; W23-M27 HydrophobicContact CG-CE 4.41Å; W23-M27 HydrophobicContact CH2-CE 3.58Å; W23-M27 HydrophobicContact CH2-SD 4.19Å; W23-M27 HydrophobicContact CZ2-CE 3.5Å; W23-M27 VanDerWaalsContact CZ2-CE 3.5Å; W23-M27 HydrophobicContact CZ2-SD 3.59Å; W23-M27 VanDerWaalsContact CZ2-SD 3.59Å; W23-M27 HydrophobicContact CZ3-CE 3.68Å; W23-M27 WeakPolarHBondContact O-CG 3.16Å; W23-M27 PolarHBondContact O-N 3.36Å
24	L	86.2	Confident	69.8	Low	28 Å²	28	67 Å²	67	15%	0.147	36%	0.358	C	S	.	.	H	α-helix	trans	-63.1	-43.6	175	-73.6	168.4	0	0	0	111.4	M20 M27 G28 F42 V44	M20-L24 HydrophobicContact CE-CD1 4.03Å; M20-L24 HydrophobicContact CG-CD1 4.05Å; M20-L24 WeakPolarHBondContact O-CB 3.46Å; M20-L24 WeakPolarHBondContact O-CD1 3.45Å; M20-L24 VanDerWaalsContact O-CG 3.22Å; M20-L24 WeakPolarHBondContact O-CG 3.35Å; M20-L24 PolarHBondContact O-N 3.14Å; L24-M27 HydrophobicContact CD2-CE 3.85Å; L24-M27 PolarHBondContact O-N 2.94Å; L24-G28 PolarHBondContact O-N 2.95Å; L24-F42 HydrophobicContact CB-CB 3.9Å; L24-F42 HydrophobicContact CB-CD2 4.09Å; L24-F42 HydrophobicContact CB-CG 3.94Å; L24-F42 HydrophobicContact CD2-CD1 3.92Å; L24-F42 HydrophobicContact CD2-CE1 4.11Å; L24-F42 HydrophobicContact CD2-CG 4.19Å; L24-F42 WeakPolarHBondContact O-CD2 3.39Å; L24-F42 WeakPolarHBondContact O-CE2 3.48Å; L24-V44 HydrophobicContact CD1-CG2 3.83Å
25	R	81.4	Confident	70.9	Confident	141 Å²	141	71.2 Å²	71.2	53%	0.532	38%	0.38	S	S	.	.	H	α-helix	trans	-54.8	-55.8	173.8	173.3	-176.1	170.1	142.2	-0.4	111	T21 D22 M27 G28 D29 E32	T21-R25 WeakPolarHBondContact O-CB 2.94Å; T21-R25 PolarHBondContact O-N 3.25Å; D22-R25 WeakPolarHBondContact O-CB 3.32Å; D22-R25 PolarHBondContact O-N 3.33Å; R25-M27 VanDerWaalsContact C-N 3.29Å; R25-M27 PolarHBondContact O-N 2.77Å; R25-G28 CarbonylContact O-C 3.57Å; R25-G28 WeakPolarHBondContact O-CA 3.3Å; R25-G28 PolarHBondContact O-N 3.19Å; R25-D29 WeakPolarHBondContact O-CB 3.29Å; R25-D29 PolarHBondContact O-N 2.59Å; R25-E32 IonicContact CZ-OE1 3.52Å; R25-E32 IonicContact NE-OE1 2.66Å; R25-E32 PolarHBondContact NE-OE1 3.11Å; R25-E32 IonicContact NE-OE2 2.94Å; R25-E32 PolarHBondContact NE-OE2 2.82Å; R25-E32 IonicContact NH2-OE1 3.75Å; R25-E32 PolarHBondContact NH2-OE1 2.86Å
26	F	76.6	Confident	72.2	Confident	14 Å²	14	67.9 Å²	67.9	6%	0.061	36%	0.363	C	S	.	.	H	α-helix	trans	-59.6	-36.7	-178.9	-177.4	-87.1	0	0	0	112.8	S10 D22 W23 G28 E32 N33	S10-F26 VanDerWaalsContact C-CD1 3.4Å; S10-F26 WeakPolarHBondContact O-CD1 3.33Å; D22-F26 PolarHBondContact O-N 2.78Å; W23-F26 PolarHBondContact O-N 3.37Å; F26-G28 PolarHBondContact O-N 2.68Å; F26-E32 HydrophobicContact CD2-CB 3.96Å; F26-E32 HydrophobicContact CE2-CB 4.29Å; F26-E32 WeakPolarHBondContact CE2-O 3.4Å; F26-N33 HydrophobicContact CD1-CB 4.07Å; F26-N33 HydrophobicContact CD2-CB 4.37Å; F26-N33 HydrophobicContact CE1-CB 3.79Å; F26-N33 HydrophobicContact CE2-CB 4.1Å; F26-N33 HydrophobicContact CG-CB 4.36Å; F26-N33 HydrophobicContact CZ-CB 3.81Å; F26-N33 WeakPolarHBondContact O-CB 3.44Å; F26-N33 PolarHBondContact O-ND2 2.78Å
27	M	83.2	Confident	73.9	Confident	61 Å²	61	66.6 Å²	66.6	30%	0.3	36%	0.363	S	S	.	.	H	α-helix	trans	-67.3	-21.3	174.1	-74.2	-165.4	-61.5	0	0	113.9	W23 L24 R25	W23-M27 HydrophobicContact CD2-CE 3.63Å; W23-M27 HydrophobicContact CD2-SD 4.38Å; W23-M27 HydrophobicContact CE3-CE 3.69Å; W23-M27 HydrophobicContact CG-CE 4.41Å; W23-M27 HydrophobicContact CH2-CE 3.58Å; W23-M27 HydrophobicContact CH2-SD 4.19Å; W23-M27 HydrophobicContact CZ2-CE 3.5Å; W23-M27 VanDerWaalsContact CZ2-CE 3.5Å; W23-M27 HydrophobicContact CZ2-SD 3.59Å; W23-M27 VanDerWaalsContact CZ2-SD 3.59Å; W23-M27 HydrophobicContact CZ3-CE 3.68Å; W23-M27 WeakPolarHBondContact O-CG 3.16Å; W23-M27 PolarHBondContact O-N 3.36Å; L24-M27 HydrophobicContact CD2-CE 3.85Å; L24-M27 PolarHBondContact O-N 2.94Å; R25-M27 VanDerWaalsContact C-N 3.29Å; R25-M27 PolarHBondContact O-N 2.77Å
28	G	84.2	Confident	75.6	Confident	0 Å²	0	70.3 Å²	70.3	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-105.2	-14	-179.6	0	0	0	0	0	115.5	L24 R25 F26 Q39 I40	L24-G28 PolarHBondContact O-N 2.95Å; R25-G28 CarbonylContact O-C 3.57Å; R25-G28 WeakPolarHBondContact O-CA 3.3Å; R25-G28 PolarHBondContact O-N 3.19Å; F26-G28 PolarHBondContact O-N 2.68Å; G28-Q39 CarbonylContact O-C 3.02Å; G28-Q39 VanDerWaalsContact O-CA 3.31Å; G28-Q39 WeakPolarHBondContact O-CA 3.27Å; G28-Q39 PolarHBondContact O-OE1 3.33Å; G28-I40 WeakPolarHBondContact CA-O 3.45Å; G28-I40 PolarHBondContact O-N 3.08Å
29	D	78.9	Confident	76.9	Confident	18 Å²	18	72.1 Å²	72.1	10%	0.096	37%	0.374	C	S	.	.			trans	-93.6	117.8	-171.7	-160.2	-71.3	0	0	0	112.7	R25 T31 E32 N33 Q39	R25-D29 WeakPolarHBondContact O-CB 3.29Å; R25-D29 PolarHBondContact O-N 2.59Å; D29-T31 PolarHBondContact O-N 3.49Å; D29-T31 WeakPolarHBondContact OD1-CA 3.28Å; D29-T31 WeakPolarHBondContact OD1-CB 3.08Å; D29-T31 PolarHBondContact OD1-N 2.86Å; D29-T31 PolarHBondContact OD1-OG1 3.34Å; D29-E32 HydrophobicContact CB-CB 4.18Å; D29-E32 HydrophobicContact CB-CG 4.32Å; D29-E32 PolarHBondContact OD1-N 2.87Å; D29-N33 WeakPolarHBondContact O-CB 3.3Å; D29-N33 PolarHBondContact O-N 3.22Å; D29-Q39 PolarHBondContact OD2-NE2 3.36Å
30	I	77.4	Confident	77.7	Confident	85 Å²	85	72 Å²	72	44%	0.436	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-11.2	-177.5	66	-179.1	0	0	0	114	A36	I30-A36 HydrophobicContact CG2-CB 4.13Å
31	T	67.5	Low	78.2	Confident	119 Å²	119	72.7 Å²	72.7	73%	0.73	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.9	-34.4	178.5	70.3	0	0	0	0	111.5	D29	D29-T31 PolarHBondContact O-N 3.49Å; D29-T31 WeakPolarHBondContact OD1-CA 3.28Å; D29-T31 WeakPolarHBondContact OD1-CB 3.08Å; D29-T31 PolarHBondContact OD1-N 2.86Å; D29-T31 PolarHBondContact OD1-OG1 3.34Å
32	E	63	Low	78.5	Confident	57 Å²	57	73.4 Å²	73.4	27%	0.266	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-27.9	176.2	-61.1	171.9	-174.2	0	0	112.5	R25 F26 D29	R25-E32 IonicContact CZ-OE1 3.52Å; R25-E32 IonicContact NE-OE1 2.66Å; R25-E32 PolarHBondContact NE-OE1 3.11Å; R25-E32 IonicContact NE-OE2 2.94Å; R25-E32 PolarHBondContact NE-OE2 2.82Å; R25-E32 IonicContact NH2-OE1 3.75Å; R25-E32 PolarHBondContact NH2-OE1 2.86Å; F26-E32 HydrophobicContact CD2-CB 3.96Å; F26-E32 HydrophobicContact CE2-CB 4.29Å; F26-E32 WeakPolarHBondContact CE2-O 3.4Å; D29-E32 HydrophobicContact CB-CB 4.18Å; D29-E32 HydrophobicContact CB-CG 4.32Å; D29-E32 PolarHBondContact OD1-N 2.87Å
33	N	66.8	Low	78.9	Confident	22 Å²	22	76.2 Å²	76.2	12%	0.118	39%	0.391	C	S	.	.			trans	-133.2	100.6	-173	177	5	0	0	0	112.1	F26 D29 M35 A36	F26-N33 HydrophobicContact CD1-CB 4.07Å; F26-N33 HydrophobicContact CD2-CB 4.37Å; F26-N33 HydrophobicContact CE1-CB 3.79Å; F26-N33 HydrophobicContact CE2-CB 4.1Å; F26-N33 HydrophobicContact CG-CB 4.36Å; F26-N33 HydrophobicContact CZ-CB 3.81Å; F26-N33 WeakPolarHBondContact O-CB 3.44Å; F26-N33 PolarHBondContact O-ND2 2.78Å; D29-N33 WeakPolarHBondContact O-CB 3.3Å; D29-N33 PolarHBondContact O-N 3.22Å; N33-M35 PolarHBondContact O-N 3.15Å; N33-M35 WeakPolarHBondContact OD1-CB 3.41Å; N33-M35 PolarHBondContact OD1-N 3.03Å; N33-A36 HydrophobicContact CB-CB 4.44Å; N33-A36 WeakPolarHBondContact O-CB 3.24Å; N33-A36 PolarHBondContact O-N 3.19Å
34	P	60.9	Low	79.2	Confident	93 Å²	93	75.9 Å²	75.9	60%	0.604	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-2.6	-178.9	27.9	-35.3	0	0	0	114.6
35	M	69	Low	78.7	Confident	166 Å²	166	77.3 Å²	77.3	82%	0.818	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	-10.4	171.4	-56	-67.9	166	0	0	112.8	N33 P37	N33-M35 PolarHBondContact O-N 3.15Å; N33-M35 WeakPolarHBondContact OD1-CB 3.41Å; N33-M35 PolarHBondContact OD1-N 3.03Å; M35-P37 WeakPolarHBondContact O-CD 3.46Å
36	A	74.9	Confident	78.3	Confident	13 Å²	13	76.5 Å²	76.5	11%	0.107	41%	0.409	C	S	.	.			trans	-74.4	119.3	174.9	0	0	0	0	0	110.1	I30 N33 F38	I30-A36 HydrophobicContact CG2-CB 4.13Å; N33-A36 HydrophobicContact CB-CB 4.44Å; N33-A36 WeakPolarHBondContact O-CB 3.24Å; N33-A36 PolarHBondContact O-N 3.19Å; A36-F38 VanDerWaalsContact C-N 3.34Å; A36-F38 PolarHBondContact O-N 2.75Å
37	P	84.4	Confident	77.9	Confident	114 Å²	114	83.9 Å²	83.9	74%	0.74	44%	0.444	S	S	*	.	S	Bend	trans	-78.3	-15.8	-172.7	30.3	-35.5	0	0	0	114.2	M35	M35-P37 WeakPolarHBondContact O-CD 3.46Å
38	F	89.4	Confident	76.9	Confident	132 Å²	132	88.2 Å²	88.2	58%	0.579	47%	0.469	S	S	*	.	S	Bend	trans	-166.9	159	175.3	56.4	-90.2	0	0	0	109.3	A36 I40	A36-F38 VanDerWaalsContact C-N 3.34Å; A36-F38 PolarHBondContact O-N 2.75Å; F38-I40 HydrophobicContact CD2-CD1 4.46Å; F38-I40 HydrophobicContact CD2-CG1 3.87Å; F38-I40 HydrophobicContact CE2-CD1 3.82Å; F38-I40 HydrophobicContact CE2-CG1 3.57Å; F38-I40 HydrophobicContact CZ-CD1 4.13Å; F38-I40 HydrophobicContact CZ-CG1 4.37Å; F38-I40 PolarHBondContact O-N 2.75Å
39	Q	88	Confident	75.8	Confident	75 Å²	75	93 Å²	93	35%	0.35	49%	0.491	S	S	.	.			trans	-66	129.1	-177.4	-170.7	72.4	14.5	0	0	112	G28 D29 N41	G28-Q39 CarbonylContact O-C 3.02Å; G28-Q39 VanDerWaalsContact O-CA 3.31Å; G28-Q39 WeakPolarHBondContact O-CA 3.27Å; G28-Q39 PolarHBondContact O-OE1 3.33Å; D29-Q39 PolarHBondContact OD2-NE2 3.36Å; Q39-N41 WeakPolarHBondContact CG-OD1 3.18Å; Q39-N41 PolarHBondContact NE2-OD1 3.45Å; Q39-N41 VanDerWaalsContact NE2-OD1 3.11Å
40	I	90.6	Very high	74.8	Confident	62 Å²	62	97.5 Å²	97.5	32%	0.318	52%	0.521	S	S	.	.			trans	-125.1	102.7	173.9	-52.9	177	0	0	0	109.2	G28 F38 F42	G28-I40 WeakPolarHBondContact CA-O 3.45Å; G28-I40 PolarHBondContact O-N 3.08Å; F38-I40 HydrophobicContact CD2-CD1 4.46Å; F38-I40 HydrophobicContact CD2-CG1 3.87Å; F38-I40 HydrophobicContact CE2-CD1 3.82Å; F38-I40 HydrophobicContact CE2-CG1 3.57Å; F38-I40 HydrophobicContact CZ-CD1 4.13Å; F38-I40 HydrophobicContact CZ-CG1 4.37Å; F38-I40 PolarHBondContact O-N 2.75Å; I40-F42 HydrophobicContact CB-CD2 4.33Å; I40-F42 HydrophobicContact CB-CE2 3.84Å; I40-F42 HydrophobicContact CB-CZ 4.27Å; I40-F42 HydrophobicContact CG2-CD1 4.35Å; I40-F42 HydrophobicContact CG2-CD2 3.88Å; I40-F42 HydrophobicContact CG2-CE1 4.03Å; I40-F42 HydrophobicContact CG2-CE2 3.54Å; I40-F42 HydrophobicContact CG2-CG 4.29Å; I40-F42 HydrophobicContact CG2-CZ 3.62Å; I40-F42 VanDerWaalsContact O-CD2 3.3Å; I40-F42 WeakPolarHBondContact O-CD2 3.38Å; I40-F42 PolarHBondContact O-N 2.88Å; I40-F42 VanDerWaalsContact O-N 3.16Å
41	N	89	Confident	73.8	Confident	127 Å²	127	96.7 Å²	96.7	68%	0.679	52%	0.523	S	S	*	.			trans	-82.8	94.1	175.3	-66.4	-8.7	0	0	0	109.7	Q39 V43	Q39-N41 WeakPolarHBondContact CG-OD1 3.18Å; Q39-N41 PolarHBondContact NE2-OD1 3.45Å; Q39-N41 VanDerWaalsContact NE2-OD1 3.11Å; N41-V43 PolarHBondContact O-N 3.29Å
42	F	87.3	Confident	73.3	Confident	92 Å²	92	93.2 Å²	93.2	40%	0.404	50%	0.499	S	S	.	.			trans	-70	124.5	175.8	-66.9	-89.6	0	0	0	111.1	L24 I40	L24-F42 HydrophobicContact CB-CB 3.9Å; L24-F42 HydrophobicContact CB-CD2 4.09Å; L24-F42 HydrophobicContact CB-CG 3.94Å; L24-F42 HydrophobicContact CD2-CD1 3.92Å; L24-F42 HydrophobicContact CD2-CE1 4.11Å; L24-F42 HydrophobicContact CD2-CG 4.19Å; L24-F42 WeakPolarHBondContact O-CD2 3.39Å; L24-F42 WeakPolarHBondContact O-CE2 3.48Å; I40-F42 HydrophobicContact CB-CD2 4.33Å; I40-F42 HydrophobicContact CB-CE2 3.84Å; I40-F42 HydrophobicContact CB-CZ 4.27Å; I40-F42 HydrophobicContact CG2-CD1 4.35Å; I40-F42 HydrophobicContact CG2-CD2 3.88Å; I40-F42 HydrophobicContact CG2-CE1 4.03Å; I40-F42 HydrophobicContact CG2-CE2 3.54Å; I40-F42 HydrophobicContact CG2-CG 4.29Å; I40-F42 HydrophobicContact CG2-CZ 3.62Å; I40-F42 VanDerWaalsContact O-CD2 3.3Å; I40-F42 WeakPolarHBondContact O-CD2 3.38Å; I40-F42 PolarHBondContact O-N 2.88Å; I40-F42 VanDerWaalsContact O-N 3.16Å
43	V	83.9	Confident	73	Confident	109 Å²	109	96.4 Å²	96.4	66%	0.661	52%	0.517	S	S	*	.			trans	-111	117.2	174	-170.2	0	0	0	0	108.6	N41 H45	N41-V43 PolarHBondContact O-N 3.29Å; V43-H45 WeakPolarHBondContact CG1-NE2 3.44Å
44	V	81	Confident	72.5	Confident	65 Å²	65	103.2 Å²	103.2	39%	0.394	55%	0.553	S	S	.	*			trans	-93.1	136.1	176.8	-177.9	0	0	0	0	108.5	M20 T21 L24	M20-V44 HydrophobicContact CE-CB 4.38Å; M20-V44 HydrophobicContact CE-CG1 3.67Å; M20-V44 HydrophobicContact CE-CG2 3.73Å; T21-V44 HydrophobicContact CG2-CB 4.39Å; T21-V44 HydrophobicContact CG2-CG2 3.92Å; L24-V44 HydrophobicContact CD1-CG2 3.83Å
45	H	76.2	Confident	72.7	Confident	58 Å²	58	103.8 Å²	103.8	27%	0.269	56%	0.555	S	S	.	*			trans	-128.2	136	174.2	-72.8	-73.5	0	0	0	110.3	V43 E49 L52	V43-H45 WeakPolarHBondContact CG1-NE2 3.44Å; H45-E49 IonicContact CE1-OE2 2.7Å; H45-E49 IonicContact CG-OE2 3.38Å; H45-E49 IonicContact ND1-OE2 3.27Å; H45-E49 PolarHBondContact ND1-OE2 2.8Å; H45-L52 WeakPolarHBondContact CE1-CD1 3.48Å; H45-L52 WeakPolarHBondContact NE2-CD1 3.31Å
46	D	72.9	Confident	72.9	Confident	125 Å²	125	98.8 Å²	98.8	67%	0.668	55%	0.546	S	S	*	.			trans	-70	146.4	169.9	-71.3	-33.1	0	0	0	110.6	N48 E49	D46-N48 PolarHBondContact O-N 3.42Å; D46-E49 PolarHBondContact O-N 3.33Å; D46-E49 VanDerWaalsContact O-N 3.08Å
47	E	66.7	Low	72.8	Confident	169 Å²	169	102.8 Å²	102.8	79%	0.79	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.6	-11.6	-179.4	-61.2	-165.4	132	0	0	114.4	N61	E47-N61 PolarHBondContact OE1-ND2 3.14Å
48	N	63	Low	72.3	Confident	152 Å²	152	107.8 Å²	107.8	81%	0.813	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.4	-4.4	-178.8	-64.7	-66.2	0	0	0	114.4	D46 P50	D46-N48 PolarHBondContact O-N 3.42Å; N48-P50 VanDerWaalsContact O-CD 3.28Å; N48-P50 WeakPolarHBondContact O-CD 3.4Å
49	E	62	Low	71.8	Confident	101 Å²	101	105.7 Å²	105.7	47%	0.472	57%	0.569	S	S	.	*			trans	-80.8	115.8	176.5	-75.5	-149.9	117.9	0	0	112.2	H45 D46 S51	H45-E49 IonicContact CE1-OE2 2.7Å; H45-E49 IonicContact CG-OE2 3.38Å; H45-E49 IonicContact ND1-OE2 3.27Å; H45-E49 PolarHBondContact ND1-OE2 2.8Å; D46-E49 PolarHBondContact O-N 3.33Å; D46-E49 VanDerWaalsContact O-N 3.08Å; E49-S51 PolarHBondContact O-N 3.47Å; E49-S51 VanDerWaalsContact O-N 3.11Å
50	P	57.8	Low	71.5	Confident	111 Å²	111	110 Å²	110	72%	0.721	59%	0.591	S	S	*	*			trans	-77.7	6	-175.4	-16.6	33.3	0	0	0	115.4	N48	N48-P50 VanDerWaalsContact O-CD 3.28Å; N48-P50 WeakPolarHBondContact O-CD 3.4Å
51	S	56.4	Low	71	Confident	68 Å²	68	113.1 Å²	113.1	48%	0.476	61%	0.608	S	S	.	*	S	Bend	trans	-87.5	-21.2	-150.3	49.8	0	0	0	0	116.7	E49	E49-S51 PolarHBondContact O-N 3.47Å; E49-S51 VanDerWaalsContact O-N 3.11Å
52	L	56.3	Low	70.8	Confident	46 Å²	46	112.7 Å²	112.7	24%	0.241	61%	0.605	C	S	.	*	S	Bend	trans	-103.3	-12.8	-176.9	-82.4	82.3	0	0	0	115.3	H45 D54 V55 G56 I57	H45-L52 WeakPolarHBondContact CE1-CD1 3.48Å; H45-L52 WeakPolarHBondContact NE2-CD1 3.31Å; L52-D54 VanDerWaalsContact C-N 3.28Å; L52-D54 PolarHBondContact O-N 3.22Å; L52-V55 PolarHBondContact O-N 2.79Å; L52-G56 PolarHBondContact O-N 3.32Å; L52-I57 HydrophobicContact CD2-CB 4.36Å; L52-I57 HydrophobicContact CD2-CG2 4.18Å
53	I	55.8	Low	70.6	Confident	125 Å²	125	113.3 Å²	113.3	64%	0.641	62%	0.621	S	S	*	*	G	3₁₀ helix	trans	-62.4	-37.1	-175.8	-59.8	178.9	0	0	0	111.2	V55 G56	I53-V55 PolarHBondContact O-N 2.85Å; I53-G56 PolarHBondContact O-N 3.37Å; I53-G56 VanDerWaalsContact O-N 3.07Å
54	D	57.3	Low	70.7	Confident	164 Å²	164	114.6 Å²	114.6	88%	0.877	63%	0.629	S	S	*	*	G	3₁₀ helix	trans	-66.8	-16.6	175.9	-79.3	-15	0	0	0	113.9	L52	L52-D54 VanDerWaalsContact C-N 3.28Å; L52-D54 PolarHBondContact O-N 3.22Å
55	V	64.7	Low	70.9	Confident	105 Å²	105	116.9 Å²	116.9	64%	0.636	63%	0.634	S	S	*	*	G	3₁₀ helix	trans	-93.3	-4.3	175.7	-161.7	0	0	0	0	111.4	L52 I53 I57	L52-V55 PolarHBondContact O-N 2.79Å; I53-V55 PolarHBondContact O-N 2.85Å; V55-I57 HydrophobicContact CG1-CD1 4.24Å; V55-I57 HydrophobicContact CG1-CG1 4.46Å; V55-I57 PolarHBondContact O-N 2.82Å
56	G	72.9	Confident	71.4	Confident	62 Å²	62	117.3 Å²	117.3	64%	0.639	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	75.3	1.1	-179.2	0	0	0	0	0	114.9	L52 I53	L52-G56 PolarHBondContact O-N 3.32Å; I53-G56 PolarHBondContact O-N 3.37Å; I53-G56 VanDerWaalsContact O-N 3.07Å
57	I	73.6	Confident	72.1	Confident	97 Å²	97	112.1 Å²	112.1	50%	0.497	62%	0.617	S	S	.	*			trans	-81.4	132.7	174.4	-60.2	174.8	0	0	0	108.3	L52 V55	L52-I57 HydrophobicContact CD2-CB 4.36Å; L52-I57 HydrophobicContact CD2-CG2 4.18Å; V55-I57 HydrophobicContact CG1-CD1 4.24Å; V55-I57 HydrophobicContact CG1-CG1 4.46Å; V55-I57 PolarHBondContact O-N 2.82Å
58	R	74.5	Confident	73	Confident	219 Å²	219	106 Å²	106	83%	0.826	60%	0.595	S	S	*	*			trans	-120.2	127.9	175	-65.3	-174.6	178.9	-164	-2.2	109.4
59	P	77.8	Confident	74.1	Confident	88 Å²	88	102.9 Å²	102.9	57%	0.571	58%	0.581	S	S	*	*			trans	-56.6	151.6	171.1	-25.6	35.3	0	0	0	112.2	N61	P59-N61 PolarHBondContact O-N 3.37Å
60	M	82	Confident	75	Confident	166 Å²	166	99.1 Å²	99.1	82%	0.818	57%	0.569	S	S	*	*			trans	-78.6	103	175.7	-176.4	-178.4	-66	0	0	110	L62	M60-L62 HydrophobicContact CG-CD1 3.95Å; M60-L62 HydrophobicContact CG-CG 3.84Å; M60-L62 HydrophobicContact SD-CD1 3.67Å; M60-L62 HydrophobicContact SD-CG 4.26Å
61	N	81.1	Confident	76.3	Confident	126 Å²	126	99.4 Å²	99.4	67%	0.674	56%	0.564	S	S	*	*			trans	-108.6	93	170.1	-167.9	-23.6	0	0	0	108.5	E47 P59	E47-N61 PolarHBondContact OE1-ND2 3.14Å; P59-N61 PolarHBondContact O-N 3.37Å
62	L	83.6	Confident	77.4	Confident	119 Å²	119	99.9 Å²	99.9	62%	0.623	56%	0.561	S	S	*	*			trans	-104.2	153.1	174.9	-71.9	175.6	0	0	0	109.8	M60 T64	M60-L62 HydrophobicContact CG-CD1 3.95Å; M60-L62 HydrophobicContact CG-CG 3.84Å; M60-L62 HydrophobicContact SD-CD1 3.67Å; M60-L62 HydrophobicContact SD-CG 4.26Å; L62-T64 PolarHBondContact O-N 2.89Å; L62-T64 VanDerWaalsContact O-N 3.12Å
63	S	84	Confident	78.2	Confident	105 Å²	105	106.1 Å²	106.1	73%	0.734	59%	0.594	S	S	*	*			trans	-61.2	113.1	174.6	53.2	0	0	0	0	111.3
64	T	84.6	Confident	78.9	Confident	135 Å²	135	106.2 Å²	106.2	83%	0.828	60%	0.596	S	S	*	*			trans	-88.9	155	170.6	53.1	0	0	0	0	110.8	L62	L62-T64 PolarHBondContact O-N 2.89Å; L62-T64 VanDerWaalsContact O-N 3.12Å
65	F	85.4	Confident	79.9	Confident	113 Å²	113	101.2 Å²	101.2	50%	0.496	57%	0.572	S	S	.	*			trans	-107.5	137.5	173.1	-65.4	-97.5	0	0	0	108.9	I71	F65-I71 HydrophobicContact CD2-CG2 4.43Å; F65-I71 HydrophobicContact CE1-CG2 4.28Å; F65-I71 HydrophobicContact CE2-CG2 4.03Å; F65-I71 HydrophobicContact CG-CG1 4.36Å; F65-I71 HydrophobicContact CZ-CG2 3.94Å
66	S	87.1	Confident	80.6	Confident	67 Å²	67	100.7 Å²	100.7	47%	0.469	57%	0.565	S	S	.	*			trans	-72.4	142.3	168.2	176.2	0	0	0	0	109.3	A68 V69	S66-A68 PolarHBondContact O-N 2.85Å; S66-A68 PolarHBondContact OG-N 3.11Å; S66-V69 PolarHBondContact O-N 2.83Å
67	C	87.1	Confident	81.1	Confident	17 Å²	17	100.4 Å²	100.4	12%	0.115	55%	0.552	C	S	.	*	T	Hydrogen-bonded Turn	trans	-60.9	-18	177.3	57.5	0	0	0	0	113.6	W2 V69 C78 C83	W2-C67 HydrophobicContact CE3-CB 4.3Å; W2-C67 HydrophobicContact CH2-CB 3.52Å; W2-C67 WeakPolarHBondContact CH2-SG 3.28Å; W2-C67 HydrophobicContact CZ2-CB 3.77Å; W2-C67 HydrophobicContact CZ3-CB 3.79Å; C67-V69 PolarHBondContact O-N 3.35Å; C67-C78 HydrophobicContact CB-CB 4Å; C67-C78 WeakPolarHBondContact O-CB 3.38Å; C67-C78 PolarHBondContact O-N 3.32Å; C67-C83 HydrophobicContact CB-CB 3.63Å; C67-C83 WeakPolarHBondContact CB-SG 3.36Å; C67-C83 WeakPolarHBondContact SG-CB 3.39Å; C67-C83 CovalentContact SG-SG 2.03Å; C67-C83 PolarHBondContact SG-SG 2.81Å
68	A	86	Confident	81.6	Confident	39 Å²	39	97.2 Å²	97.2	32%	0.322	54%	0.538	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	3.4	172.3	0	0	0	0	0	114.5	S66 A86	S66-A68 PolarHBondContact O-N 2.85Å; S66-A68 PolarHBondContact OG-N 3.11Å; A68-A86 HydrophobicContact CB-CB 4.02Å
69	V	86.3	Confident	82.1	Confident	88 Å²	88	87.5 Å²	87.5	53%	0.533	50%	0.503	S	S	.	.	S	Bend	trans	-134.8	139.5	-175.8	-168.2	0	0	0	0	110.1	S66 C67	S66-V69 PolarHBondContact O-N 2.83Å; C67-V69 PolarHBondContact O-N 3.35Å
70	G	81.6	Confident	82.2	Confident	21 Å²	21	83.9 Å²	83.9	22%	0.216	48%	0.48	C	S	.	.			trans	-64.6	158.6	171	0	0	0	0	0	112.9	T75	G70-T75 WeakPolarHBondContact CA-O 3.34Å
71	I	84.1	Confident	82.1	Confident	118 Å²	118	77.6 Å²	77.6	61%	0.605	45%	0.449	S	S	*	.	S	Bend	trans	-84	-34.2	177.6	-57.5	174.7	0	0	0	110.3	F65 T75	F65-I71 HydrophobicContact CD2-CG2 4.43Å; F65-I71 HydrophobicContact CE1-CG2 4.28Å; F65-I71 HydrophobicContact CE2-CG2 4.03Å; F65-I71 HydrophobicContact CG-CG1 4.36Å; F65-I71 HydrophobicContact CZ-CG2 3.94Å; I71-T75 WeakPolarHBondContact CB-OG1 3.33Å; I71-T75 PolarHBondContact N-OG1 3.1Å
72	D	78.7	Confident	82	Confident	78 Å²	78	74 Å²	74	42%	0.417	43%	0.43	S	S	.	.	S	Bend	trans	-148.5	176.9	177.2	77.4	-26.6	0	0	0	110.2	N74 T75	D72-N74 PolarHBondContact O-N 2.9Å; D72-N74 PolarHBondContact OD1-N 3.23Å; D72-N74 PolarHBondContact OD2-ND2 2.78Å; D72-T75 PolarHBondContact N-OG1 3.35Å; D72-T75 PolarHBondContact O-N 3.23Å; D72-T75 PolarHBondContact O-OG1 3.12Å; D72-T75 WeakPolarHBondContact OD1-CB 3.44Å; D72-T75 WeakPolarHBondContact OD1-CG2 3.27Å; D72-T75 PolarHBondContact OD1-N 3.46Å; D72-T75 PolarHBondContact OD1-OG1 2.88Å
73	D	73.8	Confident	82	Confident	176 Å²	176	68.4 Å²	68.4	94%	0.941	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-9.1	179.9	-63.2	-44.4	0	0	0	114.3
74	N	71.3	Confident	81.8	Confident	127 Å²	127	68 Å²	68	68%	0.679	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102	-18.4	179.4	-56.8	-66.9	0	0	0	113.5	D72	D72-N74 PolarHBondContact O-N 2.9Å; D72-N74 PolarHBondContact OD1-N 3.23Å; D72-N74 PolarHBondContact OD2-ND2 2.78Å
75	T	77.3	Confident	81.8	Confident	60 Å²	60	65.1 Å²	65.1	37%	0.368	39%	0.385	S	S	.	.	P	Polyproline II helix	trans	-100.5	116.7	-176.2	43.6	0	0	0	0	111.2	G70 I71 D72	G70-T75 WeakPolarHBondContact CA-O 3.34Å; I71-T75 WeakPolarHBondContact CB-OG1 3.33Å; I71-T75 PolarHBondContact N-OG1 3.1Å; D72-T75 PolarHBondContact N-OG1 3.35Å; D72-T75 PolarHBondContact O-N 3.23Å; D72-T75 PolarHBondContact O-OG1 3.12Å; D72-T75 WeakPolarHBondContact OD1-CB 3.44Å; D72-T75 WeakPolarHBondContact OD1-CG2 3.27Å; D72-T75 PolarHBondContact OD1-N 3.46Å; D72-T75 PolarHBondContact OD1-OG1 2.88Å
76	L	80	Confident	81.7	Confident	93 Å²	93	60.6 Å²	60.6	49%	0.487	37%	0.368	S	S	.	.	P	Polyproline II helix	trans	-71.7	149.6	175.7	-61.9	172.2	0	0	0	110.5
77	P	83.6	Confident	81.3	Confident	56 Å²	56	58.9 Å²	58.9	36%	0.364	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-63.2	165	173.7	28.9	-36.1	0	0	0	111.7
78	C	84.6	Confident	80.5	Confident	30 Å²	30	64.9 Å²	64.9	20%	0.203	38%	0.382	C	S	.	.	P	Polyproline II helix	trans	-60.8	149.3	170.9	-67.1	0	0	0	0	110.8	C67 D82 C83	C67-C78 HydrophobicContact CB-CB 4Å; C67-C78 WeakPolarHBondContact O-CB 3.38Å; C67-C78 PolarHBondContact O-N 3.32Å; C78-D82 HydrophobicContact CB-CB 4.02Å; C78-C83 HydrophobicContact CB-CB 3.51Å
79	S	83.2	Confident	79.5	Confident	15 Å²	15	70.7 Å²	70.7	11%	0.105	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-68.1	159.3	172.5	81.5	0	0	0	0	110.3	Q81 D82 C83 G759	S79-Q81 PolarHBondContact O-N 2.77Å; S79-Q81 PolarHBondContact OG-N 3.19Å; S79-D82 PolarHBondContact O-N 3.32Å; S79-D82 VanDerWaalsContact O-N 3.11Å; S79-D82 PolarHBondContact OG-N 2.86Å; S79-C83 WeakPolarHBondContact O-CB 3.28Å; S79-C83 PolarHBondContact O-N 3.39Å; S79-G759 WeakPolarHBondContact CB-O 3.01Å; S79-G759 PolarHBondContact OG-O 3.32Å
80	C	80.3	Confident	78.2	Confident	12 Å²	12	68.8 Å²	68.8	8%	0.081	40%	0.396	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-23.1	173.5	163	0	0	0	0	113	C83 C87	C80-C83 CarbonylContact O-C 3.59Å; C80-C87 WeakPolarHBondContact CA-SG 3.33Å; C80-C87 HydrophobicContact CB-CB 3.93Å; C80-C87 WeakPolarHBondContact CB-SG 3.48Å; C80-C87 PolarHBondContact O-SG 2.61Å; C80-C87 WeakPolarHBondContact SG-CB 3.43Å; C80-C87 CovalentContact SG-SG 2.04Å; C80-C87 PolarHBondContact SG-SG 3.12Å
81	Q	80	Confident	77.2	Confident	35 Å²	35	72.7 Å²	72.7	16%	0.164	42%	0.416	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-42.1	178.1	-55.4	137.3	40.2	0	0	111.6	S79 C83 G759 Y769 Y773	S79-Q81 PolarHBondContact O-N 2.77Å; S79-Q81 PolarHBondContact OG-N 3.19Å; Q81-C83 VanDerWaalsContact C-N 3.31Å; Q81-G759 VanDerWaalsContact OE1-C 3.28Å; Q81-G759 PolarHBondContact OE1-O 2.85Å; Q81-Y769 VanDerWaalsContact CD-CD1 3.43Å; Q81-Y769 HydrophobicContact CG-CD1 4.24Å; Q81-Y769 HydrophobicContact CG-CE1 4.14Å; Q81-Y773 HydrophobicContact CB-CD1 4.42Å; Q81-Y773 HydrophobicContact CB-CD2 4.31Å; Q81-Y773 HydrophobicContact CB-CE1 4.28Å; Q81-Y773 HydrophobicContact CB-CE2 4.17Å; Q81-Y773 HydrophobicContact CB-CG 4.44Å; Q81-Y773 HydrophobicContact CG-CD1 3.64Å; Q81-Y773 HydrophobicContact CG-CD2 3.99Å; Q81-Y773 HydrophobicContact CG-CE1 3.96Å; Q81-Y773 HydrophobicContact CG-CE2 4.28Å; Q81-Y773 HydrophobicContact CG-CG 3.67Å
82	D	79.7	Confident	76	Confident	51 Å²	51	69.9 Å²	69.9	27%	0.273	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-19.4	173.4	-74.4	-40	0	0	0	113	N6 C78 S79	N6-D82 PolarHBondContact ND2-O 3.31Å; C78-D82 HydrophobicContact CB-CB 4.02Å; S79-D82 PolarHBondContact O-N 3.32Å; S79-D82 VanDerWaalsContact O-N 3.11Å; S79-D82 PolarHBondContact OG-N 2.86Å
83	C	84.3	Confident	75.2	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	39%	0.393	C	S	.	.			trans	-148.8	95.4	-172	177.6	0	0	0	0	110.2	C67 C78 S79 C80 Q81 A85 A86	C67-C83 HydrophobicContact CB-CB 3.63Å; C67-C83 WeakPolarHBondContact CB-SG 3.36Å; C67-C83 WeakPolarHBondContact SG-CB 3.39Å; C67-C83 CovalentContact SG-SG 2.03Å; C67-C83 PolarHBondContact SG-SG 2.81Å; C78-C83 HydrophobicContact CB-CB 3.51Å; S79-C83 WeakPolarHBondContact O-CB 3.28Å; S79-C83 PolarHBondContact O-N 3.39Å; C80-C83 CarbonylContact O-C 3.59Å; Q81-C83 VanDerWaalsContact C-N 3.31Å; C83-A85 PolarHBondContact O-N 3.46Å; C83-A86 HydrophobicContact CB-CB 3.92Å; C83-A86 WeakPolarHBondContact O-CB 3.46Å; C83-A86 PolarHBondContact O-N 3.33Å; C83-A86 PolarHBondContact SG-N 2.9Å; C83-A86 VanDerWaalsContact SG-N 3.39Å
84	P	79.2	Confident	74.5	Confident	96 Å²	96	61.4 Å²	61.4	62%	0.623	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-56.5	-25.5	175.3	-28.4	36.4	0	0	0	113.7	A86 C87	P84-A86 VanDerWaalsContact C-N 3.3Å; P84-A86 PolarHBondContact O-N 2.85Å; P84-C87 WeakPolarHBondContact O-CB 3.46Å; P84-C87 PolarHBondContact O-N 3.46Å
85	A	84	Confident	73.7	Confident	75 Å²	75	60 Å²	60	62%	0.62	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-74.8	-13.1	174.6	0	0	0	0	0	114.5	C83	C83-A85 PolarHBondContact O-N 3.46Å
86	A	83.6	Confident	72.6	Confident	18 Å²	18	64.8 Å²	64.8	15%	0.149	38%	0.377	C	S	.	.	G	3₁₀ helix	trans	-87.7	-15	172.5	0	0	0	0	0	112.7	A68 C83 P84 H88	A68-A86 HydrophobicContact CB-CB 4.02Å; C83-A86 HydrophobicContact CB-CB 3.92Å; C83-A86 WeakPolarHBondContact O-CB 3.46Å; C83-A86 PolarHBondContact O-N 3.33Å; C83-A86 PolarHBondContact SG-N 2.9Å; C83-A86 VanDerWaalsContact SG-N 3.39Å; P84-A86 VanDerWaalsContact C-N 3.3Å; P84-A86 PolarHBondContact O-N 2.85Å; A86-H88 PolarHBondContact O-N 3.2Å
87	C	77.6	Confident	71.4	Confident	31 Å²	31	67 Å²	67	21%	0.209	39%	0.385	C	S	.	.			trans	-66.9	118.1	-178.7	-61.1	0	0	0	0	112.4	C80 P84 N89 V90	C80-C87 WeakPolarHBondContact CA-SG 3.33Å; C80-C87 HydrophobicContact CB-CB 3.93Å; C80-C87 WeakPolarHBondContact CB-SG 3.48Å; C80-C87 PolarHBondContact O-SG 2.61Å; C80-C87 WeakPolarHBondContact SG-CB 3.43Å; C80-C87 CovalentContact SG-SG 2.04Å; C80-C87 PolarHBondContact SG-SG 3.12Å; P84-C87 WeakPolarHBondContact O-CB 3.46Å; P84-C87 PolarHBondContact O-N 3.46Å; C87-N89 PolarHBondContact O-N 3.07Å; C87-V90 HydrophobicContact CB-CG2 3.77Å
88	H	72	Confident	70	Confident	144 Å²	144	73 Å²	73	67%	0.667	41%	0.406	S	S	*	.			trans	-74.5	122.2	169	-68.1	-51	0	0	0	111.3	A86 V90 E765	A86-H88 PolarHBondContact O-N 3.2Å; H88-V90 PolarHBondContact O-N 3.05Å; H88-V90 VanDerWaalsContact O-N 3.08Å; H88-E765 IonicContact CD2-OE1 3.47Å; H88-E765 PolarHBondContact N-OE1 2.84Å
89	N	63.5	Low	68.4	Low	160 Å²	160	78 Å²	78	86%	0.856	44%	0.435	S	S	*	.			trans	22.1	71.5	169.7	-74.8	-12.9	0	0	0	115.3	C87 V91	C87-N89 PolarHBondContact O-N 3.07Å; N89-V91 PolarHBondContact O-N 2.92Å
90	V	59.7	Low	67.3	Low	49 Å²	49	83 Å²	83	30%	0.297	46%	0.457	S	S	.	.			trans	-60.2	106.5	-177.2	-174.6	0	0	0	0	110.3	C87 H88	C87-V90 HydrophobicContact CB-CG2 3.77Å; H88-V90 PolarHBondContact O-N 3.05Å; H88-V90 VanDerWaalsContact O-N 3.08Å
91	V	59.8	Low	66.7	Low	103 Å²	103	86.6 Å²	86.6	62%	0.624	48%	0.481	S	S	*	.			trans	-68.4	128.6	172.7	-178.7	0	0	0	0	108	N89 Y93	N89-V91 PolarHBondContact O-N 2.92Å; V91-Y93 PolarHBondContact O-N 3.21Å
92	P	59.6	Low	66.1	Low	59 Å²	59	92.6 Å²	92.6	38%	0.383	50%	0.503	S	S	.	.			trans	-56	127.3	176.7	-26.1	35	0	0	0	111	P94	P92-P94 CarbonylContact O-C 3.53Å
93	Y	61.3	Low	65.7	Low	40 Å²	40	94.8 Å²	94.8	16%	0.157	51%	0.514	C	S	.	.	S	Bend	trans	-107.8	135	-173.4	-163.5	-78.5	0	0	0	111.4	V91 A775 I908 N911	V91-Y93 PolarHBondContact O-N 3.21Å; Y93-A775 HydrophobicContact CD1-CB 4.34Å; Y93-I908 HydrophobicContact CD1-CG1 4.44Å; Y93-I908 HydrophobicContact CE1-CD1 4.13Å; Y93-I908 HydrophobicContact CE1-CG1 3.44Å; Y93-I908 VanDerWaalsContact CE1-CG1 3.44Å; Y93-N911 PolarHBondContact OH-ND2 2.83Å
94	P	60.3	Low	65.4	Low	35 Å²	35	97.8 Å²	97.8	23%	0.227	55%	0.545	C	S	.	.	S	Bend	cis	-69	159	-11.3	31.4	-37.5	0	0	0	112.7	P92 E96	P92-P94 CarbonylContact O-C 3.53Å; P94-E96 PolarHBondContact O-N 3Å
95	S	54.6	Low	65.3	Low	98 Å²	98	101.9 Å²	101.9	69%	0.685	56%	0.561	S	S	*	*			trans	-80.6	-3.6	-170	55.7	0	0	0	0	116.1
96	E	54.8	Low	64.5	Low	161 Å²	161	102.2 Å²	102.2	75%	0.752	55%	0.551	S	S	*	*			trans	-127.1	109	-175.9	-66.4	-169.8	162.8	0	0	112.2	P94	P94-E96 PolarHBondContact O-N 3Å
97	E	53.6	Low	64	Low	140 Å²	140	103.6 Å²	103.6	65%	0.654	55%	0.554	S	S	*	*			trans	-72.3	121.6	151.8	-75.6	-177.7	164.1	0	0	107.9	T99 R781	E97-T99 PolarHBondContact O-N 2.83Å; E97-R781 IonicContact OE1-CZ 2.67Å; E97-R781 IonicContact OE1-NE 2.64Å; E97-R781 IonicContact OE1-NH2 3.65Å; E97-R781 PolarHBondContact OE1-NH2 2.68Å
98	K	54.4	Low	64	Low	181 Å²	181	103.5 Å²	103.5	79%	0.787	55%	0.554	S	S	*	*			trans	-62.1	101.2	174.9	-74.6	-179.8	178.7	173.5	0	109.2	E100	K98-E100 PolarHBondContact O-N 3.29Å
99	T	50.3	Low	64	Low	135 Å²	135	98.4 Å²	98.4	83%	0.828	54%	0.537	S	S	*	.			trans	-64.7	104.8	178.9	55.8	0	0	0	0	109.9	E97 C101	E97-T99 PolarHBondContact O-N 2.83Å; T99-C101 PolarHBondContact O-N 3.38Å
100	E	61.1	Low	64.5	Low	119 Å²	119	92.8 Å²	92.8	56%	0.556	51%	0.508	S	S	*	.			trans	-53.9	133.3	172.3	-67.5	-179.6	179.5	0	0	110.6	K98 R102	K98-E100 PolarHBondContact O-N 3.29Å; E100-R102 HydrophobicContact CB-CG 4.25Å; E100-R102 PolarHBondContact O-N 3.09Å; E100-R102 IonicContact OE1-NH2 2.75Å; E100-R102 IonicContact OE2-CZ 3.71Å; E100-R102 IonicContact OE2-NE 3.94Å; E100-R102 PolarHBondContact OE2-NE 3.07Å; E100-R102 IonicContact OE2-NH2 3.83Å; E100-R102 PolarHBondContact OE2-NH2 3.43Å
101	C	66.9	Low	65.4	Low	88 Å²	88	94.4 Å²	94.4	60%	0.595	51%	0.511	S	S	*	.			trans	-67.7	102.2	175.2	-168.7	0	0	0	0	109.4	T99 E107 C108	T99-C101 PolarHBondContact O-N 3.38Å; C101-E107 WeakPolarHBondContact O-CA 3.12Å; C101-C108 HydrophobicContact CB-CB 3.67Å; C101-C108 WeakPolarHBondContact CB-SG 3.16Å; C101-C108 PolarHBondContact O-N 3.26Å; C101-C108 PolarHBondContact O-SG 2.89Å; C101-C108 WeakPolarHBondContact SG-CB 3.44Å; C101-C108 CovalentContact SG-SG 2.04Å; C101-C108 PolarHBondContact SG-SG 3.37Å
102	R	68.5	Low	66.2	Low	162 Å²	162	94.1 Å²	94.1	61%	0.611	51%	0.51	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.1	126.5	176.1	-63.8	-178.3	-179.1	-168	1.8	109.9	E100 M106 E107	E100-R102 HydrophobicContact CB-CG 4.25Å; E100-R102 PolarHBondContact O-N 3.09Å; E100-R102 IonicContact OE1-NH2 2.75Å; E100-R102 IonicContact OE2-CZ 3.71Å; E100-R102 IonicContact OE2-NE 3.94Å; E100-R102 PolarHBondContact OE2-NE 3.07Å; E100-R102 IonicContact OE2-NH2 3.83Å; E100-R102 PolarHBondContact OE2-NH2 3.43Å; R102-M106 CarbonylContact C-O 3.25Å; R102-M106 WeakPolarHBondContact CA-O 3.17Å; R102-E107 HydrophobicContact CG-CG 4.44Å
103	L	71.3	Confident	66.9	Low	96 Å²	96	91.6 Å²	91.6	50%	0.503	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	88.9	176.9	-161.9	74.9	0	0	0	108.4	M106 F111	L103-M106 PolarHBondContact N-O 3.04Å; L103-F111 HydrophobicContact CD2-CD1 3.54Å; L103-F111 HydrophobicContact CD2-CD2 4.02Å; L103-F111 HydrophobicContact CD2-CE1 3.57Å; L103-F111 HydrophobicContact CD2-CE2 4.05Å; L103-F111 HydrophobicContact CD2-CG 3.77Å; L103-F111 HydrophobicContact CD2-CZ 3.83Å
104	G	77.9	Confident	67.4	Low	64 Å²	64	92 Å²	92	66%	0.66	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	67	-131.4	-164.9	0	0	0	0	0	110.7	M106	G104-M106 VanDerWaalsContact C-N 3.31Å; G104-M106 PolarHBondContact O-N 2.97Å
105	N	77.1	Confident	68.3	Low	181 Å²	181	94.2 Å²	94.2	97%	0.968	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	3.4	-179.6	-67.3	9.2	0	0	0	114
106	M	66.7	Low	69.4	Low	82 Å²	82	91.4 Å²	91.4	40%	0.404	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	142.6	-180	-66.8	-178.6	68.9	0	0	111.2	R102 L103 G104 V110	R102-M106 CarbonylContact C-O 3.25Å; R102-M106 WeakPolarHBondContact CA-O 3.17Å; L103-M106 PolarHBondContact N-O 3.04Å; G104-M106 VanDerWaalsContact C-N 3.31Å; G104-M106 PolarHBondContact O-N 2.97Å; M106-V110 HydrophobicContact CE-CB 4.38Å; M106-V110 HydrophobicContact CE-CG1 3.73Å
107	E	73.8	Confident	70.6	Confident	47 Å²	47	84.8 Å²	84.8	22%	0.22	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	146.1	169.2	-72.3	151.9	-120.1	0	0	111.6	C101 R102 A109 V110 F111 K704	C101-E107 WeakPolarHBondContact O-CA 3.12Å; R102-E107 HydrophobicContact CG-CG 4.44Å; E107-A109 VanDerWaalsContact C-N 3.26Å; E107-A109 PolarHBondContact O-N 2.92Å; E107-V110 HydrophobicContact CB-CG2 4.19Å; E107-V110 PolarHBondContact O-N 3.17Å; E107-V110 VanDerWaalsContact O-N 3.15Å; E107-F111 PolarHBondContact O-N 2.74Å; E107-K704 IonicContact OE1-NZ 3.27Å; E107-K704 PolarHBondContact OE1-NZ 3.31Å; E107-K704 WeakPolarHBondContact OE2-CE 3.3Å; E107-K704 IonicContact OE2-NZ 3.66Å; E107-K704 PolarHBondContact OE2-NZ 3.12Å
108	C	76.7	Confident	71.8	Confident	29 Å²	29	82.3 Å²	82.3	20%	0.196	47%	0.466	C	S	.	.	H	α-helix	trans	-57.5	-36	-178.7	-64	0	0	0	0	112.8	C101 F111 V112	C101-C108 HydrophobicContact CB-CB 3.67Å; C101-C108 WeakPolarHBondContact CB-SG 3.16Å; C101-C108 PolarHBondContact O-N 3.26Å; C101-C108 PolarHBondContact O-SG 2.89Å; C101-C108 WeakPolarHBondContact SG-CB 3.44Å; C101-C108 CovalentContact SG-SG 2.04Å; C101-C108 PolarHBondContact SG-SG 3.37Å; C108-F111 PolarHBondContact O-N 3.09Å; C108-V112 WeakPolarHBondContact O-CB 3.36Å; C108-V112 VanDerWaalsContact O-CG2 3.27Å; C108-V112 WeakPolarHBondContact O-CG2 3.23Å; C108-V112 PolarHBondContact O-N 3.16Å
109	A	71.8	Confident	72.9	Confident	37 Å²	37	75.4 Å²	75.4	31%	0.306	45%	0.446	S	S	.	.	H	α-helix	trans	-65.1	-45.2	177.2	0	0	0	0	0	112.4	E107 F111 V112 S113 N703	E107-A109 VanDerWaalsContact C-N 3.26Å; E107-A109 PolarHBondContact O-N 2.92Å; A109-F111 VanDerWaalsContact C-N 3.35Å; A109-V112 PolarHBondContact O-N 2.83Å; A109-S113 WeakPolarHBondContact O-CB 3.24Å; A109-S113 PolarHBondContact O-N 3.48Å; A109-N703 HydrophobicContact CB-CB 4.23Å; A109-N703 VanDerWaalsContact CB-OD1 3.29Å; A109-N703 WeakPolarHBondContact CB-OD1 3.22Å
110	V	75	Confident	74.2	Confident	42 Å²	42	73.3 Å²	73.3	26%	0.255	43%	0.429	S	S	.	.	H	α-helix	trans	-66.1	-38.9	176.7	-173.6	0	0	0	0	110.7	M106 E107 S114	M106-V110 HydrophobicContact CE-CB 4.38Å; M106-V110 HydrophobicContact CE-CG1 3.73Å; E107-V110 HydrophobicContact CB-CG2 4.19Å; E107-V110 PolarHBondContact O-N 3.17Å; E107-V110 VanDerWaalsContact O-N 3.15Å; V110-S114 WeakPolarHBondContact O-CB 3.29Å; V110-S114 PolarHBondContact O-N 3.15Å; V110-S114 PolarHBondContact O-OG 2.5Å
111	F	77.9	Confident	75	Confident	84 Å²	84	68.9 Å²	68.9	37%	0.368	41%	0.411	S	S	.	.	H	α-helix	trans	-64	-51.6	174.4	-177.9	-96.9	0	0	0	111.9	L103 E107 C108 A109 S113 S114 V115	L103-F111 HydrophobicContact CD2-CD1 3.54Å; L103-F111 HydrophobicContact CD2-CD2 4.02Å; L103-F111 HydrophobicContact CD2-CE1 3.57Å; L103-F111 HydrophobicContact CD2-CE2 4.05Å; L103-F111 HydrophobicContact CD2-CG 3.77Å; L103-F111 HydrophobicContact CD2-CZ 3.83Å; E107-F111 PolarHBondContact O-N 2.74Å; C108-F111 PolarHBondContact O-N 3.09Å; A109-F111 VanDerWaalsContact C-N 3.35Å; F111-S113 PolarHBondContact O-N 3.38Å; F111-S114 PolarHBondContact O-N 2.79Å; F111-S114 PolarHBondContact O-OG 2.75Å; F111-V115 HydrophobicContact CD1-CG2 4.31Å; F111-V115 HydrophobicContact CE1-CG2 3.89Å; F111-V115 HydrophobicContact CE2-CG2 4.21Å; F111-V115 HydrophobicContact CZ-CG2 3.83Å; F111-V115 WeakPolarHBondContact O-CG2 3.36Å; F111-V115 PolarHBondContact O-N 3.37Å
112	V	77.8	Confident	75.5	Confident	97 Å²	97	66.9 Å²	66.9	59%	0.588	40%	0.401	S	S	*	.	H	α-helix	trans	-60.9	-43.4	179.1	169.2	0	0	0	0	111.4	C108 A109 V115 A116	C108-V112 WeakPolarHBondContact O-CB 3.36Å; C108-V112 VanDerWaalsContact O-CG2 3.27Å; C108-V112 WeakPolarHBondContact O-CG2 3.23Å; C108-V112 PolarHBondContact O-N 3.16Å; A109-V112 PolarHBondContact O-N 2.83Å; V112-V115 PolarHBondContact O-N 2.85Å; V112-A116 WeakPolarHBondContact O-CB 3.35Å; V112-A116 PolarHBondContact O-N 2.9Å
113	S	72.6	Confident	75.9	Confident	5 Å²	5	62.9 Å²	62.9	4%	0.035	39%	0.394	C	S	.	.	H	α-helix	trans	-65.9	-39.2	176.7	-170.5	0	0	0	0	112.5	A109 F111 A116 C117 C696	A109-S113 WeakPolarHBondContact O-CB 3.24Å; A109-S113 PolarHBondContact O-N 3.48Å; F111-S113 PolarHBondContact O-N 3.38Å; S113-A116 PolarHBondContact O-N 3.46Å; S113-C117 VanDerWaalsContact O-CB 3.25Å; S113-C117 WeakPolarHBondContact O-CB 3.24Å; S113-C117 PolarHBondContact O-N 2.84Å; S113-C696 PolarHBondContact OG-O 2.89Å
114	S	72.4	Confident	75.9	Confident	48 Å²	48	60 Å²	60	34%	0.336	38%	0.379	S	S	.	.	H	α-helix	trans	-67.9	-38.4	177.1	64.9	0	0	0	0	112.5	V110 F111 C117 C118	V110-S114 WeakPolarHBondContact O-CB 3.29Å; V110-S114 PolarHBondContact O-N 3.15Å; V110-S114 PolarHBondContact O-OG 2.5Å; F111-S114 PolarHBondContact O-N 2.79Å; F111-S114 PolarHBondContact O-OG 2.75Å; S114-C117 WeakPolarHBondContact O-CB 3.42Å; S114-C117 PolarHBondContact O-N 2.83Å; S114-C118 PolarHBondContact O-N 3.39Å; S114-C118 PolarHBondContact O-SG 3.43Å; S114-C118 VanDerWaalsContact O-SG 3.34Å
115	V	79.9	Confident	75.8	Confident	82 Å²	82	60.7 Å²	60.7	50%	0.497	37%	0.37	S	S	.	.	H	α-helix	trans	-64.2	-43.7	171.6	172.7	0	0	0	0	111.5	F111 V112 C118 G119	F111-V115 HydrophobicContact CD1-CG2 4.31Å; F111-V115 HydrophobicContact CE1-CG2 3.89Å; F111-V115 HydrophobicContact CE2-CG2 4.21Å; F111-V115 HydrophobicContact CZ-CG2 3.83Å; F111-V115 WeakPolarHBondContact O-CG2 3.36Å; F111-V115 PolarHBondContact O-N 3.37Å; V112-V115 PolarHBondContact O-N 2.85Å; V115-C118 PolarHBondContact O-N 3.25Å; V115-G119 PolarHBondContact O-N 3.33Å
116	A	77.8	Confident	75.9	Confident	39 Å²	39	57.1 Å²	57.1	32%	0.322	35%	0.35	S	S	.	.	H	α-helix	trans	-62.6	-41.5	175.4	0	0	0	0	0	112.1	V112 S113 G119 L120	V112-A116 WeakPolarHBondContact O-CB 3.35Å; V112-A116 PolarHBondContact O-N 2.9Å; S113-A116 PolarHBondContact O-N 3.46Å; A116-G119 PolarHBondContact O-N 3.13Å; A116-L120 WeakPolarHBondContact O-CB 3.48Å; A116-L120 WeakPolarHBondContact O-CG 3.45Å; A116-L120 PolarHBondContact O-N 2.67Å
117	C	78.8	Confident	76.1	Confident	22 Å²	22	58.8 Å²	58.8	15%	0.149	36%	0.36	C	S	.	.	H	α-helix	trans	-59.6	-52.3	174.4	-171.1	0	0	0	0	111.6	S113 S114 G119 L120 C121 C696	S113-C117 VanDerWaalsContact O-CB 3.25Å; S113-C117 WeakPolarHBondContact O-CB 3.24Å; S113-C117 PolarHBondContact O-N 2.84Å; S114-C117 WeakPolarHBondContact O-CB 3.42Å; S114-C117 PolarHBondContact O-N 2.83Å; C117-G119 VanDerWaalsContact C-N 3.28Å; C117-G119 PolarHBondContact O-N 3.36Å; C117-L120 PolarHBondContact O-N 3.32Å; C117-C121 WeakPolarHBondContact O-CB 3.35Å; C117-C121 PolarHBondContact O-N 2.84Å; C117-C121 PolarHBondContact O-SG 2.89Å; C117-C121 VanDerWaalsContact O-SG 3.34Å; C117-C696 HydrophobicContact CB-CB 3.52Å
118	C	78.8	Confident	75.8	Confident	89 Å²	89	57.4 Å²	57.4	60%	0.601	36%	0.355	S	S	*	.	H	α-helix	trans	-59.6	-39.9	176.6	-70.3	0	0	0	0	111.9	S114 V115 A122	S114-C118 PolarHBondContact O-N 3.39Å; S114-C118 PolarHBondContact O-SG 3.43Å; S114-C118 VanDerWaalsContact O-SG 3.34Å; V115-C118 PolarHBondContact O-N 3.25Å; C118-A122 WeakPolarHBondContact O-CB 3.28Å; C118-A122 PolarHBondContact O-N 2.95Å
119	G	78.3	Confident	75.5	Confident	36 Å²	36	58.7 Å²	58.7	37%	0.371	36%	0.364	S	S	.	.	H	α-helix	trans	-62.7	-50.2	174.6	0	0	0	0	0	113.1	V115 A116 C117 A122 V123	V115-G119 PolarHBondContact O-N 3.33Å; A116-G119 PolarHBondContact O-N 3.13Å; C117-G119 VanDerWaalsContact C-N 3.28Å; C117-G119 PolarHBondContact O-N 3.36Å; G119-A122 PolarHBondContact O-N 3.16Å; G119-V123 WeakPolarHBondContact O-CB 3.19Å; G119-V123 WeakPolarHBondContact O-CG2 3.5Å; G119-V123 PolarHBondContact O-N 3.47Å
120	L	77.1	Confident	75.4	Confident	91 Å²	91	58.7 Å²	58.7	48%	0.476	36%	0.364	S	S	.	.	H	α-helix	trans	-65	-45.3	178.9	-73.4	169.2	0	0	0	111.9	A116 C117 A122 V123 I124	A116-L120 WeakPolarHBondContact O-CB 3.48Å; A116-L120 WeakPolarHBondContact O-CG 3.45Å; A116-L120 PolarHBondContact O-N 2.67Å; C117-L120 PolarHBondContact O-N 3.32Å; L120-A122 VanDerWaalsContact C-N 3.34Å; L120-A122 PolarHBondContact O-N 2.91Å; L120-V123 PolarHBondContact O-N 3.06Å; L120-I124 WeakPolarHBondContact O-CB 3.3Å; L120-I124 VanDerWaalsContact O-CG1 3.29Å; L120-I124 WeakPolarHBondContact O-CG1 3.32Å; L120-I124 PolarHBondContact O-N 2.85Å
121	C	77.3	Confident	74.9	Confident	25 Å²	25	61.5 Å²	61.5	17%	0.169	37%	0.374	C	S	.	.	H	α-helix	trans	-61.8	-40.9	174.5	-68.7	0	0	0	0	111.7	C117 I124 V125 L689	C117-C121 WeakPolarHBondContact O-CB 3.35Å; C117-C121 PolarHBondContact O-N 2.84Å; C117-C121 PolarHBondContact O-SG 2.89Å; C117-C121 VanDerWaalsContact O-SG 3.34Å; C121-I124 PolarHBondContact O-N 3.24Å; C121-V125 WeakPolarHBondContact O-CB 3.14Å; C121-V125 VanDerWaalsContact O-CG2 3.29Å; C121-V125 WeakPolarHBondContact O-CG2 3.29Å; C121-V125 PolarHBondContact O-N 3.38Å; C121-L689 HydrophobicContact CB-CD2 4.49Å
122	A	77.4	Confident	74.3	Confident	46 Å²	46	63.2 Å²	63.2	38%	0.38	38%	0.379	S	S	.	.	H	α-helix	trans	-63.6	-43.8	173.9	0	0	0	0	0	111.8	C118 G119 L120 V125 I126	C118-A122 WeakPolarHBondContact O-CB 3.28Å; C118-A122 PolarHBondContact O-N 2.95Å; G119-A122 PolarHBondContact O-N 3.16Å; L120-A122 VanDerWaalsContact C-N 3.34Å; L120-A122 PolarHBondContact O-N 2.91Å; A122-V125 PolarHBondContact O-N 3.23Å; A122-I126 VanDerWaalsContact O-CB 3.3Å; A122-I126 WeakPolarHBondContact O-CB 3.33Å; A122-I126 WeakPolarHBondContact O-CD1 3.32Å; A122-I126 WeakPolarHBondContact O-CG1 3.49Å; A122-I126 PolarHBondContact O-N 3.14Å
123	V	78.3	Confident	73.9	Confident	78 Å²	78	63.1 Å²	63.1	47%	0.473	38%	0.379	S	S	.	.	H	α-helix	trans	-63.4	-41.9	175.9	168.5	0	0	0	0	111.5	G119 L120 I126 L127	G119-V123 WeakPolarHBondContact O-CB 3.19Å; G119-V123 WeakPolarHBondContact O-CG2 3.5Å; G119-V123 PolarHBondContact O-N 3.47Å; L120-V123 PolarHBondContact O-N 3.06Å; V123-I126 PolarHBondContact O-N 2.77Å; V123-L127 HydrophobicContact CG1-CD1 3.79Å; V123-L127 HydrophobicContact CG1-CG 4.25Å; V123-L127 WeakPolarHBondContact O-CB 3.39Å; V123-L127 VanDerWaalsContact O-CG 3.28Å; V123-L127 WeakPolarHBondContact O-CG 3.39Å; V123-L127 PolarHBondContact O-N 3.06Å
124	I	70.8	Confident	73.4	Confident	36 Å²	36	67.6 Å²	67.6	19%	0.185	40%	0.401	C	S	.	.	H	α-helix	trans	-61.1	-47.7	174.2	-69.9	163.9	0	0	0	110.1	L120 C121 I126 L127 V128 L689 C692	L120-I124 WeakPolarHBondContact O-CB 3.3Å; L120-I124 VanDerWaalsContact O-CG1 3.29Å; L120-I124 WeakPolarHBondContact O-CG1 3.32Å; L120-I124 PolarHBondContact O-N 2.85Å; C121-I124 PolarHBondContact O-N 3.24Å; I124-I126 VanDerWaalsContact C-N 3.35Å; I124-I126 PolarHBondContact O-N 3.13Å; I124-L127 PolarHBondContact O-N 2.86Å; I124-V128 HydrophobicContact CG2-CG2 4.31Å; I124-V128 VanDerWaalsContact O-CB 3.24Å; I124-V128 WeakPolarHBondContact O-CB 3.34Å; I124-V128 WeakPolarHBondContact O-CG2 3.27Å; I124-V128 PolarHBondContact O-N 3.08Å; I124-L689 HydrophobicContact CG2-CD2 4.17Å; I124-C692 HydrophobicContact CD1-CB 4Å
125	V	75.5	Confident	72.7	Confident	79 Å²	79	69.3 Å²	69.3	48%	0.479	41%	0.409	S	S	.	.	H	α-helix	trans	-65.2	-36.3	178	171	0	0	0	0	111.8	C121 A122 S129 L689	C121-V125 WeakPolarHBondContact O-CB 3.14Å; C121-V125 VanDerWaalsContact O-CG2 3.29Å; C121-V125 WeakPolarHBondContact O-CG2 3.29Å; C121-V125 PolarHBondContact O-N 3.38Å; A122-V125 PolarHBondContact O-N 3.23Å; V125-S129 WeakPolarHBondContact O-CB 3.49Å; V125-S129 PolarHBondContact O-N 3.36Å; V125-S129 PolarHBondContact O-OG 3.39Å; V125-L689 HydrophobicContact CG2-CD2 4.42Å
126	I	78.4	Confident	71.5	Confident	106 Å²	106	68.1 Å²	68.1	54%	0.544	41%	0.413	S	S	.	.	H	α-helix	trans	-68.7	-45.2	175.3	-72	164	0	0	0	110.8	A122 V123 I124 S129 A130	A122-I126 VanDerWaalsContact O-CB 3.3Å; A122-I126 WeakPolarHBondContact O-CB 3.33Å; A122-I126 WeakPolarHBondContact O-CD1 3.32Å; A122-I126 WeakPolarHBondContact O-CG1 3.49Å; A122-I126 PolarHBondContact O-N 3.14Å; V123-I126 PolarHBondContact O-N 2.77Å; I124-I126 VanDerWaalsContact C-N 3.35Å; I124-I126 PolarHBondContact O-N 3.13Å; I126-S129 WeakPolarHBondContact CA-OG 3.44Å; I126-S129 PolarHBondContact O-OG 3.22Å; I126-A130 WeakPolarHBondContact O-CB 3.45Å; I126-A130 PolarHBondContact O-N 3.45Å
127	L	71.3	Confident	70.3	Confident	116 Å²	116	68.6 Å²	68.6	61%	0.607	41%	0.412	S	S	*	.	H	α-helix	trans	-67.2	-40.2	177.5	-71	173	0	0	0	111.9	V123 I124 H131	V123-L127 HydrophobicContact CG1-CD1 3.79Å; V123-L127 HydrophobicContact CG1-CG 4.25Å; V123-L127 WeakPolarHBondContact O-CB 3.39Å; V123-L127 VanDerWaalsContact O-CG 3.28Å; V123-L127 WeakPolarHBondContact O-CG 3.39Å; V123-L127 PolarHBondContact O-N 3.06Å; I124-L127 PolarHBondContact O-N 2.86Å; L127-H131 VanDerWaalsContact O-CB 3.24Å; L127-H131 WeakPolarHBondContact O-CB 3.44Å; L127-H131 PolarHBondContact O-N 3.44Å
128	V	68.2	Low	68.9	Low	19 Å²	19	72.4 Å²	72.4	12%	0.115	44%	0.437	C	S	.	.	H	α-helix	trans	-67.7	-45.3	175.8	168.2	0	0	0	0	110.9	I124 H131 Y132 V685	I124-V128 HydrophobicContact CG2-CG2 4.31Å; I124-V128 VanDerWaalsContact O-CB 3.24Å; I124-V128 WeakPolarHBondContact O-CB 3.34Å; I124-V128 WeakPolarHBondContact O-CG2 3.27Å; I124-V128 PolarHBondContact O-N 3.08Å; V128-H131 PolarHBondContact O-N 3.04Å; V128-Y132 HydrophobicContact CG1-CD2 3.67Å; V128-Y132 HydrophobicContact CG1-CE2 3.54Å; V128-Y132 WeakPolarHBondContact O-CD2 3.41Å; V128-Y132 PolarHBondContact O-N 2.89Å; V128-V685 HydrophobicContact CG1-CG1 4.36Å; V128-V685 HydrophobicContact CG1-CG2 3.95Å
129	S	70.3	Confident	67.2	Low	55 Å²	55	74.1 Å²	74.1	39%	0.385	44%	0.439	S	S	.	.	H	α-helix	trans	-69.2	-38.1	177	60.4	0	0	0	0	112.4	V125 I126 Y132 V133	V125-S129 WeakPolarHBondContact O-CB 3.49Å; V125-S129 PolarHBondContact O-N 3.36Å; V125-S129 PolarHBondContact O-OG 3.39Å; I126-S129 WeakPolarHBondContact CA-OG 3.44Å; I126-S129 PolarHBondContact O-OG 3.22Å; S129-Y132 CarbonylContact O-C 3.55Å; S129-Y132 PolarHBondContact O-N 3.45Å; S129-V133 WeakPolarHBondContact O-CB 3.44Å; S129-V133 WeakPolarHBondContact O-CG2 3.33Å; S129-V133 PolarHBondContact O-N 3.37Å
130	A	69.1	Low	65.6	Low	38 Å²	38	73.2 Å²	73.2	31%	0.314	43%	0.428	S	S	.	.	H	α-helix	trans	-61.5	-43	170.6	0	0	0	0	0	111.2	I126 Y132 V133 I134	I126-A130 WeakPolarHBondContact O-CB 3.45Å; I126-A130 PolarHBondContact O-N 3.45Å; A130-Y132 PolarHBondContact O-N 3.37Å; A130-V133 PolarHBondContact O-N 2.82Å; A130-I134 VanDerWaalsContact O-CB 3.25Å; A130-I134 WeakPolarHBondContact O-CB 3.42Å; A130-I134 WeakPolarHBondContact O-CD1 3.24Å; A130-I134 WeakPolarHBondContact O-CG1 3.47Å; A130-I134 PolarHBondContact O-N 3.09Å
131	H	66.1	Low	64	Low	100 Å²	100	75.6 Å²	75.6	46%	0.463	44%	0.435	S	S	.	.	H	α-helix	trans	-63.3	-39.8	173.5	-175.3	-59.8	0	0	0	111.9	L127 V128 V135	L127-H131 VanDerWaalsContact O-CB 3.24Å; L127-H131 WeakPolarHBondContact O-CB 3.44Å; L127-H131 PolarHBondContact O-N 3.44Å; V128-H131 PolarHBondContact O-N 3.04Å; H131-V135 WeakPolarHBondContact O-CB 3.33Å; H131-V135 WeakPolarHBondContact O-CG2 3.41Å; H131-V135 PolarHBondContact O-N 3.15Å
132	Y	65.2	Low	62.3	Low	121 Å²	121	77.6 Å²	77.6	48%	0.475	45%	0.446	S	S	.	.	H	α-helix	trans	-66.2	-40.6	174	-85.5	-64	0	0	0	112.7	V128 S129 A130 G136	V128-Y132 HydrophobicContact CG1-CD2 3.67Å; V128-Y132 HydrophobicContact CG1-CE2 3.54Å; V128-Y132 WeakPolarHBondContact O-CD2 3.41Å; V128-Y132 PolarHBondContact O-N 2.89Å; S129-Y132 CarbonylContact O-C 3.55Å; S129-Y132 PolarHBondContact O-N 3.45Å; A130-Y132 PolarHBondContact O-N 3.37Å; Y132-G136 VanDerWaalsContact O-CA 3.29Å; Y132-G136 WeakPolarHBondContact O-CA 3.26Å; Y132-G136 PolarHBondContact O-N 3.27Å
133	V	67.5	Low	60.5	Low	95 Å²	95	80.1 Å²	80.1	58%	0.576	46%	0.457	S	S	*	.	H	α-helix	trans	-68.4	-48	176.6	168.7	0	0	0	0	110.3	S129 A130 G136 T137	S129-V133 WeakPolarHBondContact O-CB 3.44Å; S129-V133 WeakPolarHBondContact O-CG2 3.33Å; S129-V133 PolarHBondContact O-N 3.37Å; A130-V133 PolarHBondContact O-N 2.82Å; V133-G136 PolarHBondContact O-N 3.23Å; V133-T137 HydrophobicContact CG1-CG2 4.17Å; V133-T137 WeakPolarHBondContact O-CG2 3.09Å; V133-T137 PolarHBondContact O-N 3.22Å
134	I	62.5	Low	58.7	Low	99 Å²	99	81.3 Å²	81.3	51%	0.508	46%	0.464	S	S	.	.	H	α-helix	trans	-56.4	-64.9	176.3	-70.3	165.2	0	0	0	108.9	A130 G136 T137 A140	A130-I134 VanDerWaalsContact O-CB 3.25Å; A130-I134 WeakPolarHBondContact O-CB 3.42Å; A130-I134 WeakPolarHBondContact O-CD1 3.24Å; A130-I134 WeakPolarHBondContact O-CG1 3.47Å; A130-I134 PolarHBondContact O-N 3.09Å; I134-G136 PolarHBondContact O-N 2.99Å; I134-G136 VanDerWaalsContact O-N 3.14Å; I134-T137 PolarHBondContact O-N 2.86Å; I134-T137 PolarHBondContact O-OG1 3.42Å; I134-A140 HydrophobicContact CG2-CB 3.6Å; I134-A140 WeakPolarHBondContact O-CB 3.38Å
135	V	57.8	Low	57	Low	84 Å²	84	83.3 Å²	83.3	51%	0.509	48%	0.478	S	S	.	.	H	α-helix	trans	-64.5	-23.2	-176.7	178	0	0	0	0	113.1	H131	H131-V135 WeakPolarHBondContact O-CB 3.33Å; H131-V135 WeakPolarHBondContact O-CG2 3.41Å; H131-V135 PolarHBondContact O-N 3.15Å
136	G	54.9	Low	55.1	Low	56 Å²	56	84.5 Å²	84.5	58%	0.577	49%	0.485	S	S	*	.	H	α-helix	trans	-78.4	-30.2	172.7	0	0	0	0	0	114.3	Y132 V133 I134	Y132-G136 VanDerWaalsContact O-CA 3.29Å; Y132-G136 WeakPolarHBondContact O-CA 3.26Å; Y132-G136 PolarHBondContact O-N 3.27Å; V133-G136 PolarHBondContact O-N 3.23Å; I134-G136 PolarHBondContact O-N 2.99Å; I134-G136 VanDerWaalsContact O-N 3.14Å
137	T	52.8	Low	53	Low	50 Å²	50	83 Å²	83	31%	0.307	50%	0.496	S	S	.	.	S	Bend	trans	-65.8	144.2	177.6	63	0	0	0	0	111	V133 I134 L139 A140	V133-T137 HydrophobicContact CG1-CG2 4.17Å; V133-T137 WeakPolarHBondContact O-CG2 3.09Å; V133-T137 PolarHBondContact O-N 3.22Å; I134-T137 PolarHBondContact O-N 2.86Å; I134-T137 PolarHBondContact O-OG1 3.42Å; T137-L139 PolarHBondContact O-N 3.1Å; T137-A140 PolarHBondContact O-N 3.31Å; T137-A140 PolarHBondContact OG1-N 3.27Å
138	P	49.8	Very low	51.4	Low	101 Å²	101	82.3 Å²	82.3	66%	0.656	50%	0.496	S	S	*	.	H	α-helix	trans	-59.2	-30.4	167.9	25.8	-33.5	0	0	0	110.9	A140 K141 T142	P138-A140 PolarHBondContact O-N 3.26Å; P138-K141 WeakPolarHBondContact O-CB 3.42Å; P138-K141 PolarHBondContact O-N 2.99Å; P138-T142 PolarHBondContact O-N 3.5Å; P138-T142 PolarHBondContact O-OG1 3Å
139	L	42.9	Very low	49.5	Very low	125 Å²	125	85 Å²	85	65%	0.654	53%	0.528	S	S	*	.	H	α-helix	trans	-64.3	-37.9	-177.4	-145.3	82.2	0	0	0	113.5	T137 T142 V143	T137-L139 PolarHBondContact O-N 3.1Å; L139-T142 CarbonylContact O-C 3.54Å; L139-T142 WeakPolarHBondContact O-CB 3.4Å; L139-T142 PolarHBondContact O-N 2.81Å; L139-V143 WeakPolarHBondContact O-CG2 3.22Å; L139-V143 PolarHBondContact O-N 3.1Å
140	A	44.8	Very low	47.5	Very low	17 Å²	17	85 Å²	85	14%	0.14	54%	0.537	C	S	.	.	H	α-helix	trans	-74.3	-32.5	175.6	0	0	0	0	0	112.5	I134 T137 P138 T142 V143 V144	I134-A140 HydrophobicContact CG2-CB 3.6Å; I134-A140 WeakPolarHBondContact O-CB 3.38Å; T137-A140 PolarHBondContact O-N 3.31Å; T137-A140 PolarHBondContact OG1-N 3.27Å; P138-A140 PolarHBondContact O-N 3.26Å; A140-T142 VanDerWaalsContact C-N 3.28Å; A140-T142 PolarHBondContact O-N 2.83Å; A140-V143 PolarHBondContact O-N 3.09Å; A140-V144 WeakPolarHBondContact O-CB 3.09Å; A140-V144 WeakPolarHBondContact O-CG2 3.42Å; A140-V144 PolarHBondContact O-N 3.23Å
141	K	43.3	Very low	45.6	Very low	141 Å²	141	91.2 Å²	91.2	61%	0.613	57%	0.565	S	S	*	*	H	α-helix	trans	-59.1	-44.5	166.8	-67.6	-176.6	178.6	178.9	0	109.9	P138 V144 T145	P138-K141 WeakPolarHBondContact O-CB 3.42Å; P138-K141 PolarHBondContact O-N 2.99Å; K141-V144 PolarHBondContact O-N 2.69Å; K141-T145 WeakPolarHBondContact O-CG2 3.19Å; K141-T145 PolarHBondContact O-N 3.09Å; K141-T145 PolarHBondContact O-OG1 2.87Å
142	T	41.3	Very low	44	Very low	67 Å²	67	94.8 Å²	94.8	41%	0.411	58%	0.582	S	S	.	*	H	α-helix	trans	-62.9	-42.6	174.8	-54.5	0	0	0	0	112.7	P138 L139 A140 V144 T145 V146	P138-T142 PolarHBondContact O-N 3.5Å; P138-T142 PolarHBondContact O-OG1 3Å; L139-T142 CarbonylContact O-C 3.54Å; L139-T142 WeakPolarHBondContact O-CB 3.4Å; L139-T142 PolarHBondContact O-N 2.81Å; A140-T142 VanDerWaalsContact C-N 3.28Å; A140-T142 PolarHBondContact O-N 2.83Å; T142-V144 PolarHBondContact O-N 2.79Å; T142-T145 CarbonylContact O-C 3.14Å; T142-T145 WeakPolarHBondContact O-CA 3.36Å; T142-T145 PolarHBondContact O-N 3.38Å; T142-T145 VanDerWaalsContact O-N 3.08Å; T142-T145 PolarHBondContact O-OG1 3.34Å; T142-V146 HydrophobicContact CG2-CG2 3.78Å; T142-V146 WeakPolarHBondContact O-CB 3.06Å; T142-V146 WeakPolarHBondContact O-CG2 3.32Å; T142-V146 PolarHBondContact O-N 3.49Å
143	V	40.2	Very low	42.3	Very low	99 Å²	99	94.4 Å²	94.4	60%	0.6	59%	0.594	S	S	*	*	H	α-helix	trans	-65.4	-39.7	177.3	170.5	0	0	0	0	111.2	L139 A140 T145 V146 G147	L139-V143 WeakPolarHBondContact O-CG2 3.22Å; L139-V143 PolarHBondContact O-N 3.1Å; A140-V143 PolarHBondContact O-N 3.09Å; V143-T145 VanDerWaalsContact C-N 3.26Å; V143-T145 PolarHBondContact O-N 2.59Å; V143-V146 PolarHBondContact O-N 2.94Å; V143-G147 PolarHBondContact O-N 3.3Å
144	V	39.6	Very low	40.5	Very low	103 Å²	103	101.3 Å²	101.3	62%	0.624	61%	0.611	S	S	*	*	H	α-helix	trans	-64.5	-29	172	173.2	0	0	0	0	111.9	A140 K141 T142 V148	A140-V144 WeakPolarHBondContact O-CB 3.09Å; A140-V144 WeakPolarHBondContact O-CG2 3.42Å; A140-V144 PolarHBondContact O-N 3.23Å; K141-V144 PolarHBondContact O-N 2.69Å; T142-V144 PolarHBondContact O-N 2.79Å; V144-V148 VanDerWaalsContact O-CB 3.31Å; V144-V148 WeakPolarHBondContact O-CB 3.34Å; V144-V148 WeakPolarHBondContact O-CG2 3.36Å; V144-V148 PolarHBondContact O-N 3.28Å
145	T	36.6	Very low	39.1	Very low	79 Å²	79	100.1 Å²	100.1	49%	0.485	62%	0.616	S	S	.	*	T	Hydrogen-bonded Turn	trans	-102.6	21.7	173.2	69.3	0	0	0	0	114.6	K141 T142 V143 V148	K141-T145 WeakPolarHBondContact O-CG2 3.19Å; K141-T145 PolarHBondContact O-N 3.09Å; K141-T145 PolarHBondContact O-OG1 2.87Å; T142-T145 CarbonylContact O-C 3.14Å; T142-T145 WeakPolarHBondContact O-CA 3.36Å; T142-T145 PolarHBondContact O-N 3.38Å; T142-T145 VanDerWaalsContact O-N 3.08Å; T142-T145 PolarHBondContact O-OG1 3.34Å; V143-T145 VanDerWaalsContact C-N 3.26Å; V143-T145 PolarHBondContact O-N 2.59Å; T145-V148 CarbonylContact C-O 3.53Å; T145-V148 VanDerWaalsContact C-O 3.25Å; T145-V148 VanDerWaalsContact O-O 3.13Å
146	V	35.4	Very low	37.8	Very low	104 Å²	104	103.6 Å²	103.6	63%	0.63	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129.4	-28.7	173.4	166.9	0	0	0	0	110.7	T142 V143	T142-V146 HydrophobicContact CG2-CG2 3.78Å; T142-V146 WeakPolarHBondContact O-CB 3.06Å; T142-V146 WeakPolarHBondContact O-CG2 3.32Å; T142-V146 PolarHBondContact O-N 3.49Å; V143-V146 PolarHBondContact O-N 2.94Å
147	G	34.3	Very low	36.7	Very low	75 Å²	75	106.1 Å²	106.1	77%	0.773	65%	0.647	S	S	*	*	S	Bend	trans	-67.6	-20.6	150.8	0	0	0	0	0	112.7	V143	V143-G147 PolarHBondContact O-N 3.3Å
148	V	37.3	Very low	35.6	Very low	100 Å²	100	114.5 Å²	114.5	61%	0.606	67%	0.673	S	S	*	*	S	Bend	trans	-119.5	73.7	169.3	-172.8	0	0	0	0	108.5	V144 T145 G150	V144-V148 VanDerWaalsContact O-CB 3.31Å; V144-V148 WeakPolarHBondContact O-CB 3.34Å; V144-V148 WeakPolarHBondContact O-CG2 3.36Å; V144-V148 PolarHBondContact O-N 3.28Å; T145-V148 CarbonylContact C-O 3.53Å; T145-V148 VanDerWaalsContact C-O 3.25Å; T145-V148 VanDerWaalsContact O-O 3.13Å; V148-G150 PolarHBondContact O-N 3Å
149	G	27.1	Very low	34.7	Very low	76 Å²	76	117.6 Å²	117.6	78%	0.784	68%	0.684	S	S	*	*			trans	-74.2	84.4	178.9	0	0	0	0	0	112.4
150	G	28.2	Very low	34.2	Very low	55 Å²	55	115.7 Å²	115.7	57%	0.567	69%	0.686	S	S	*	*			trans	179.1	110	175.8	0	0	0	0	0	113.2	V148 E152	V148-G150 PolarHBondContact O-N 3Å; G150-E152 PolarHBondContact O-N 2.99Å; G150-E152 VanDerWaalsContact O-N 3.1Å
151	N	29.2	Very low	33.9	Very low	169 Å²	169	121 Å²	121	90%	0.904	72%	0.719	S	S	*	*			trans	-80.4	77.9	174.5	-78.9	-31.7	0	0	0	111.2
152	E	32.8	Very low	33.8	Very low	175 Å²	175	118.3 Å²	118.3	82%	0.818	72%	0.715	S	S	*	*			trans	-132.6	140.2	158	-71.6	-156.9	143	0	0	111.1	G150	G150-E152 PolarHBondContact O-N 2.99Å; G150-E152 VanDerWaalsContact O-N 3.1Å
153	P	30.3	Very low	34	Very low	113 Å²	113	119.4 Å²	119.4	73%	0.734	73%	0.73	S	S	*	*			trans	-68.8	149.1	173	30.9	-34.4	0	0	0	110	A155	P153-A155 PolarHBondContact O-N 3.19Å
154	Y	29.9	Very low	34.6	Very low	240 Å²	240	119 Å²	119	94%	0.941	72%	0.724	S	S	*	*			trans	-71.9	62.1	172.9	-113.2	-92.1	0	0	0	111.6
155	A	32.1	Very low	35.4	Very low	73 Å²	73	116.5 Å²	116.5	60%	0.603	71%	0.707	S	S	*	*			trans	-85.1	143.3	168.2	0	0	0	0	0	109.4	P153 S157	P153-A155 PolarHBondContact O-N 3.19Å; A155-S157 PolarHBondContact O-N 3.15Å
156	T	30.2	Very low	36.3	Very low	157 Å²	157	118.8 Å²	118.8	96%	0.963	72%	0.716	S	S	*	*			trans	-64.9	92.2	-176.8	48.5	0	0	0	0	112.2
157	S	31.8	Very low	37.2	Very low	110 Å²	110	116.8 Å²	116.8	77%	0.769	71%	0.705	S	S	*	*			trans	-116.8	116.8	170.7	-167.7	0	0	0	0	110	A155	A155-S157 PolarHBondContact O-N 3.15Å
158	R	30.1	Very low	38.3	Very low	225 Å²	225	119.4 Å²	119.4	85%	0.849	70%	0.702	S	S	*	*			trans	-76.6	152.4	168.1	-62.8	174.9	179.5	169.7	-1.9	108.2
159	N	32.1	Very low	39.4	Very low	166 Å²	166	119.9 Å²	119.9	89%	0.888	70%	0.701	S	S	*	*			trans	95.7	25.2	171.4	-44	-20.4	0	0	0	118.1
160	A	31.2	Very low	41.2	Very low	85 Å²	85	117.2 Å²	117.2	70%	0.702	67%	0.669	S	S	*	*			trans	-117.9	125.4	157.4	0	0	0	0	0	109.5	T162	A160-T162 PolarHBondContact O-N 2.86Å
161	P	38.6	Very low	43.1	Very low	128 Å²	128	117.5 Å²	117.5	83%	0.831	66%	0.663	S	S	*	*			trans	-72.6	112.2	173.3	29.2	-31.4	0	0	0	109	A163	P161-A163 PolarHBondContact O-N 2.77Å
162	T	41.6	Very low	45.2	Very low	86 Å²	86	116 Å²	116	53%	0.528	65%	0.653	S	S	.	*	P	Polyproline II helix	trans	-54.8	128.3	162.2	45.1	0	0	0	0	108.3	A160 L164	A160-T162 PolarHBondContact O-N 2.86Å; T162-L164 PolarHBondContact O-N 2.89Å; T162-L164 VanDerWaalsContact O-N 3.11Å
163	A	45	Very low	46.9	Very low	89 Å²	89	115.9 Å²	115.9	74%	0.736	65%	0.647	S	S	*	*	P	Polyproline II helix	trans	-52.6	121.5	177.3	0	0	0	0	0	109.6	P161	P161-A163 PolarHBondContact O-N 2.77Å
164	L	53.5	Low	48.8	Very low	91 Å²	91	113 Å²	113	48%	0.476	63%	0.627	S	S	.	*	P	Polyproline II helix	trans	-60.4	139.2	173.6	-118.3	69.5	0	0	0	108.1	T162 D166 Y1121 I1128	T162-L164 PolarHBondContact O-N 2.89Å; T162-L164 VanDerWaalsContact O-N 3.11Å; L164-D166 PolarHBondContact O-N 3.43Å; L164-Y1121 HydrophobicContact CD2-CE2 3.85Å; L164-Y1121 HydrophobicContact CG-CE2 4.03Å; L164-I1128 HydrophobicContact CD1-CD1 4.31Å
165	L	57.1	Low	50.9	Low	51 Å²	51	106.2 Å²	106.2	27%	0.267	60%	0.6	S	S	.	*	P	Polyproline II helix	trans	-67.2	119.9	173.2	-121.4	79	0	0	0	109	K1117 Y1121	L165-K1117 HydrophobicContact CD2-CB 3.52Å; L165-K1117 HydrophobicContact CD2-CD 3.66Å; L165-K1117 HydrophobicContact CD2-CG 3.54Å; L165-Y1121 HydrophobicContact CB-CD2 4.3Å; L165-Y1121 WeakPolarHBondContact O-CD2 3.34Å
166	D	54.4	Low	53.2	Low	126 Å²	126	107.7 Å²	107.7	67%	0.674	60%	0.596	S	S	*	*	P	Polyproline II helix	trans	-63.3	126.9	176.7	-94.7	-45.6	0	0	0	110.2	L164 D168 D169	L164-D166 PolarHBondContact O-N 3.43Å; D166-D168 PolarHBondContact O-N 2.89Å; D166-D169 WeakPolarHBondContact O-CB 3.4Å; D166-D169 PolarHBondContact O-N 3.43Å; D166-D169 VanDerWaalsContact O-N 3.15Å
167	P	55.6	Low	55.4	Low	62 Å²	62	100.3 Å²	100.3	40%	0.403	55%	0.551	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70.6	-15.8	-170.6	28	-35.7	0	0	0	113.6	R175	P167-R175 PolarHBondContact O-NH2 3.37Å
168	D	57.4	Low	57.6	Low	130 Å²	130	97.3 Å²	97.3	70%	0.695	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-9.8	176.8	-67	-37.8	0	0	0	113.6	D166 V170 R175	D166-D168 PolarHBondContact O-N 2.89Å; D168-V170 PolarHBondContact O-N 3.44Å; D168-R175 IonicContact OD1-CZ 3.18Å; D168-R175 IonicContact OD1-NH1 2.76Å; D168-R175 IonicContact OD1-NH2 2.71Å; D168-R175 PolarHBondContact OD1-NH2 3.35Å
169	D	60.5	Low	60.1	Low	110 Å²	110	93 Å²	93	59%	0.588	51%	0.508	S	S	*	.	S	Bend	trans	-81.1	27.8	175.5	-155.7	50.5	0	0	0	112.2	D166 K1117	D166-D169 WeakPolarHBondContact O-CB 3.4Å; D166-D169 PolarHBondContact O-N 3.43Å; D166-D169 VanDerWaalsContact O-N 3.15Å; D169-K1117 PolarHBondContact O-NZ 2.75Å; D169-K1117 IonicContact OD2-NZ 3.79Å; D169-K1117 PolarHBondContact OD2-NZ 2.9Å
170	V	64.4	Low	62.7	Low	20 Å²	20	87.1 Å²	87.1	12%	0.121	48%	0.476	C	S	.	.	S	Bend	trans	-140.4	128.4	-163.7	-178.1	0	0	0	0	110.3	D168 T174 K1117 L1118	D168-V170 PolarHBondContact O-N 3.44Å; V170-T174 WeakPolarHBondContact CG1-OG1 3.28Å; V170-K1117 HydrophobicContact CG2-CB 4.36Å; V170-K1117 HydrophobicContact CG2-CD 4.11Å; V170-L1118 HydrophobicContact CG1-CD1 3.84Å; V170-L1118 HydrophobicContact CG1-CD2 4.31Å; V170-L1118 HydrophobicContact CG1-CG 3.92Å
171	S	68.5	Low	65	Low	62 Å²	62	83.5 Å²	83.5	43%	0.434	45%	0.445	S	S	.	.			trans	-70.5	149.3	-172.5	77.4	0	0	0	0	113.1	Y173 T174 R175	S171-Y173 PolarHBondContact O-N 2.83Å; S171-T174 PolarHBondContact N-OG1 2.95Å; S171-T174 PolarHBondContact O-N 3.29Å; S171-T174 PolarHBondContact O-OG1 3.31Å; S171-T174 PolarHBondContact OG-N 2.81Å; S171-T174 PolarHBondContact OG-OG1 3.4Å; S171-T174 VanDerWaalsContact OG-OG1 3.09Å; S171-R175 PolarHBondContact O-N 3.35Å
172	I	71.9	Confident	67.2	Low	137 Å²	137	78.4 Å²	78.4	70%	0.703	41%	0.412	S	S	*	.	H	α-helix	trans	-52.7	-42.2	179.1	-59.5	174.8	0	0	0	111.3	T174 R175 M176	I172-T174 PolarHBondContact O-N 2.83Å; I172-R175 PolarHBondContact O-N 3.38Å; I172-M176 WeakPolarHBondContact O-CB 3.46Å; I172-M176 PolarHBondContact O-N 3.49Å
173	Y	68.8	Low	69.4	Low	172 Å²	172	79.2 Å²	79.2	68%	0.675	41%	0.408	S	S	*	.	H	α-helix	trans	-60.4	-45.6	176.5	-57.8	-72.2	0	0	0	112.6	S171 M176 G177	S171-Y173 PolarHBondContact O-N 2.83Å; Y173-M176 PolarHBondContact O-N 3.27Å; Y173-G177 PolarHBondContact O-N 3.42Å
174	T	70.7	Confident	71.3	Confident	54 Å²	54	76.5 Å²	76.5	33%	0.331	38%	0.381	S	S	.	.	H	α-helix	trans	-69.8	-31.8	176.9	54.6	0	0	0	0	113	V170 S171 I172 F178 L1118	V170-T174 WeakPolarHBondContact CG1-OG1 3.28Å; S171-T174 PolarHBondContact N-OG1 2.95Å; S171-T174 PolarHBondContact O-N 3.29Å; S171-T174 PolarHBondContact O-OG1 3.31Å; S171-T174 PolarHBondContact OG-N 2.81Å; S171-T174 PolarHBondContact OG-OG1 3.4Å; S171-T174 VanDerWaalsContact OG-OG1 3.09Å; I172-T174 PolarHBondContact O-N 2.83Å; T174-F178 WeakPolarHBondContact O-CB 3.43Å; T174-F178 PolarHBondContact O-N 3.32Å; T174-L1118 WeakPolarHBondContact O-CD1 3.36Å
175	R	74.2	Confident	73	Confident	97 Å²	97	75.2 Å²	75.2	37%	0.366	37%	0.372	S	S	.	.	H	α-helix	trans	-67	-43.3	173.5	-165.5	-178.4	-78.5	-169.8	-5.9	111.3	P167 D168 S171 I172 W179	P167-R175 PolarHBondContact O-NH2 3.37Å; D168-R175 IonicContact OD1-CZ 3.18Å; D168-R175 IonicContact OD1-NH1 2.76Å; D168-R175 IonicContact OD1-NH2 2.71Å; D168-R175 PolarHBondContact OD1-NH2 3.35Å; S171-R175 PolarHBondContact O-N 3.35Å; I172-R175 PolarHBondContact O-N 3.38Å; R175-W179 PolarHBondContact O-N 2.83Å; R175-W179 VanDerWaalsContact O-N 3.1Å
176	M	79.5	Confident	74.5	Confident	103 Å²	103	74 Å²	74	51%	0.507	37%	0.366	S	S	.	.	H	α-helix	trans	-69.9	-39.2	175.4	-174.7	160.1	75.9	0	0	112.5	I172 Y173 W179 L180 L968	I172-M176 WeakPolarHBondContact O-CB 3.46Å; I172-M176 PolarHBondContact O-N 3.49Å; Y173-M176 PolarHBondContact O-N 3.27Å; M176-W179 WeakPolarHBondContact O-CB 3.41Å; M176-W179 PolarHBondContact O-N 3.44Å; M176-L180 PolarHBondContact O-N 3.16Å; M176-L968 HydrophobicContact CB-CD1 4.12Å; M176-L968 HydrophobicContact CE-CD1 3.45Å; M176-L968 VanDerWaalsContact CE-CD1 3.45Å; M176-L968 HydrophobicContact CG-CD1 4.03Å
177	G	77.6	Confident	76.3	Confident	3 Å²	3	69.8 Å²	69.8	3%	0.031	35%	0.353	C	S	.	.	H	α-helix	trans	-62.8	-43.5	175.3	0	0	0	0	0	113.3	Y173 L180 D181 G967	Y173-G177 PolarHBondContact O-N 3.42Å; G177-L180 PolarHBondContact O-N 3.08Å; G177-D181 PolarHBondContact O-N 3.43Å; G177-G967 VanDerWaalsContact CA-C 3.49Å; G177-G967 WeakPolarHBondContact CA-O 3.49Å
178	F	77.4	Confident	78	Confident	46 Å²	46	68.4 Å²	68.4	20%	0.202	34%	0.34	C	S	.	.	H	α-helix	trans	-64.3	-41.1	173.2	-179.5	-95.1	0	0	0	112.4	T174 L180 T182 L1118 K1119 Q1122	T174-F178 WeakPolarHBondContact O-CB 3.43Å; T174-F178 PolarHBondContact O-N 3.32Å; F178-L180 VanDerWaalsContact C-N 3.32Å; F178-L180 PolarHBondContact O-N 3.34Å; F178-T182 WeakPolarHBondContact O-CB 3.39Å; F178-T182 PolarHBondContact O-N 3.46Å; F178-T182 PolarHBondContact O-OG1 2.65Å; F178-L1118 HydrophobicContact CB-CB 4.43Å; F178-L1118 HydrophobicContact CB-CD1 3.54Å; F178-L1118 HydrophobicContact CD1-CD1 4.33Å; F178-L1118 HydrophobicContact CD2-CB 3.75Å; F178-L1118 HydrophobicContact CD2-CD1 4.4Å; F178-L1118 HydrophobicContact CE2-CB 4.14Å; F178-L1118 HydrophobicContact CG-CB 4.02Å; F178-L1118 HydrophobicContact CG-CD1 3.85Å; F178-K1119 HydrophobicContact CD2-CG 4.44Å; F178-K1119 HydrophobicContact CE2-CG 4.37Å; F178-Q1122 HydrophobicContact CZ-CB 4.43Å
179	W	83.3	Confident	79.7	Confident	135 Å²	135	63.7 Å²	63.7	51%	0.511	31%	0.314	S	S	.	.	H	α-helix	trans	-58.2	-43.9	173.3	176.8	96.6	0	0	0	111.6	R175 M176 T182 K183	R175-W179 PolarHBondContact O-N 2.83Å; R175-W179 VanDerWaalsContact O-N 3.1Å; M176-W179 WeakPolarHBondContact O-CB 3.41Å; M176-W179 PolarHBondContact O-N 3.44Å; W179-T182 PolarHBondContact O-N 2.93Å; W179-K183 HydrophobicContact CD2-CG 4.11Å; W179-K183 HydrophobicContact CZ2-CG 4.12Å; W179-K183 WeakPolarHBondContact O-CB 3.27Å; W179-K183 VanDerWaalsContact O-CG 3.26Å; W179-K183 WeakPolarHBondContact O-CG 3.41Å; W179-K183 PolarHBondContact O-N 3.38Å
180	L	84.8	Confident	81.2	Confident	43 Å²	43	66 Å²	66	23%	0.225	31%	0.314	C	S	.	.	H	α-helix	trans	-66.9	-47.7	179.7	-178.3	60.3	0	0	0	112.4	M176 G177 F178 T182 K183 L184 I964	M176-L180 PolarHBondContact O-N 3.16Å; G177-L180 PolarHBondContact O-N 3.08Å; F178-L180 VanDerWaalsContact C-N 3.32Å; F178-L180 PolarHBondContact O-N 3.34Å; L180-T182 VanDerWaalsContact C-N 3.32Å; L180-T182 PolarHBondContact O-N 3.48Å; L180-K183 PolarHBondContact O-N 3.26Å; L180-L184 HydrophobicContact CD1-CD1 4.38Å; L180-L184 HydrophobicContact CD1-CG 4.41Å; L180-L184 HydrophobicContact CG-CD1 4.25Å; L180-L184 WeakPolarHBondContact O-CG 3.29Å; L180-L184 PolarHBondContact O-N 2.92Å; L180-I964 HydrophobicContact CD2-CG2 4.09Å; L180-I964 VanDerWaalsContact CD2-O 3.26Å; L180-I964 WeakPolarHBondContact CD2-O 3.41Å
181	D	81	Confident	82.6	Confident	9 Å²	9	69.4 Å²	69.4	5%	0.048	33%	0.325	C	S	.	.	H	α-helix	trans	-60.1	-42.2	176.6	-170.4	30.1	0	0	0	111.1	G177 L184 Q185 R1033 K1119	G177-D181 PolarHBondContact O-N 3.43Å; D181-L184 PolarHBondContact O-N 3.41Å; D181-Q185 WeakPolarHBondContact O-CB 3.33Å; D181-Q185 VanDerWaalsContact O-CG 3.23Å; D181-Q185 WeakPolarHBondContact O-CG 3.4Å; D181-Q185 PolarHBondContact O-N 3.34Å; D181-Q185 PolarHBondContact O-NE2 3.23Å; D181-Q185 PolarHBondContact OD1-NE2 2.94Å; D181-Q185 PolarHBondContact OD2-NE2 3.41Å; D181-R1033 IonicContact OD1-NH2 3.36Å; D181-R1033 PolarHBondContact OD1-NH2 3.34Å; D181-K1119 WeakPolarHBondContact OD2-CE 3.43Å; D181-K1119 IonicContact OD2-NZ 2.59Å; D181-K1119 PolarHBondContact OD2-NZ 3Å
182	T	83.7	Confident	83.7	Confident	20 Å²	20	66.4 Å²	66.4	12%	0.123	31%	0.305	C	S	.	.	H	α-helix	trans	-63.3	-43.7	174.7	-51.9	0	0	0	0	111.8	F178 W179 L180 Q185 D186	F178-T182 WeakPolarHBondContact O-CB 3.39Å; F178-T182 PolarHBondContact O-N 3.46Å; F178-T182 PolarHBondContact O-OG1 2.65Å; W179-T182 PolarHBondContact O-N 2.93Å; L180-T182 VanDerWaalsContact C-N 3.32Å; L180-T182 PolarHBondContact O-N 3.48Å; T182-Q185 PolarHBondContact O-N 3.38Å; T182-D186 WeakPolarHBondContact O-CB 3.34Å; T182-D186 VanDerWaalsContact O-CG 3.27Å; T182-D186 PolarHBondContact O-N 3.02Å
183	K	87.7	Confident	84.7	Confident	103 Å²	103	61.5 Å²	61.5	45%	0.448	28%	0.279	S	S	.	.	H	α-helix	trans	-70.9	-31.2	-178.7	-71.9	-72.1	156.3	-130.2	0	113.4	W179 L180 D186 G187	W179-K183 HydrophobicContact CD2-CG 4.11Å; W179-K183 HydrophobicContact CZ2-CG 4.12Å; W179-K183 WeakPolarHBondContact O-CB 3.27Å; W179-K183 VanDerWaalsContact O-CG 3.26Å; W179-K183 WeakPolarHBondContact O-CG 3.41Å; W179-K183 PolarHBondContact O-N 3.38Å; L180-K183 PolarHBondContact O-N 3.26Å; K183-D186 IonicContact NZ-OD2 2.86Å; K183-D186 PolarHBondContact NZ-OD2 3.48Å; K183-G187 PolarHBondContact O-N 3.12Å; K183-G187 VanDerWaalsContact O-N 3.09Å
184	L	86.5	Confident	85.8	Confident	33 Å²	33	57.2 Å²	57.2	17%	0.173	27%	0.267	C	S	.	.	H	α-helix	trans	-65.6	-47	169.5	-70.2	169	0	0	0	110.5	L180 D181 G187 F188 L588 L965	L180-L184 HydrophobicContact CD1-CD1 4.38Å; L180-L184 HydrophobicContact CD1-CG 4.41Å; L180-L184 HydrophobicContact CG-CD1 4.25Å; L180-L184 WeakPolarHBondContact O-CG 3.29Å; L180-L184 PolarHBondContact O-N 2.92Å; D181-L184 PolarHBondContact O-N 3.41Å; L184-G187 PolarHBondContact O-N 2.95Å; L184-F188 HydrophobicContact CD2-CE2 4.34Å; L184-F188 WeakPolarHBondContact O-CD2 3.35Å; L184-F188 PolarHBondContact O-N 3.03Å; L184-L588 HydrophobicContact CD2-CD2 4.31Å; L184-L965 HydrophobicContact CD1-CD2 4.04Å
185	Q	87.4	Confident	86.9	Confident	63 Å²	63	54.7 Å²	54.7	29%	0.294	25%	0.252	S	S	.	.	H	α-helix	trans	-61.3	-46.6	176.9	-69.5	169.6	38.4	0	0	112	D181 T182 G187 F188 H189 A581	D181-Q185 WeakPolarHBondContact O-CB 3.33Å; D181-Q185 VanDerWaalsContact O-CG 3.23Å; D181-Q185 WeakPolarHBondContact O-CG 3.4Å; D181-Q185 PolarHBondContact O-N 3.34Å; D181-Q185 PolarHBondContact O-NE2 3.23Å; D181-Q185 PolarHBondContact OD1-NE2 2.94Å; D181-Q185 PolarHBondContact OD2-NE2 3.41Å; T182-Q185 PolarHBondContact O-N 3.38Å; Q185-G187 VanDerWaalsContact C-N 3.27Å; Q185-G187 PolarHBondContact O-N 2.75Å; Q185-F188 PolarHBondContact O-N 3.35Å; Q185-H189 VanDerWaalsContact O-CB 3.25Å; Q185-H189 WeakPolarHBondContact O-CB 3.3Å; Q185-H189 PolarHBondContact O-N 2.91Å; Q185-A581 HydrophobicContact CB-CB 4.49Å
186	D	89.6	Confident	87.6	Confident	25 Å²	25	50.1 Å²	50.1	13%	0.134	23%	0.234	C	C	.	.	H	α-helix	trans	-53.7	-43.6	173.1	-74.2	-22.4	0	0	0	111.8	T182 K183 R190	T182-D186 WeakPolarHBondContact O-CB 3.34Å; T182-D186 VanDerWaalsContact O-CG 3.27Å; T182-D186 PolarHBondContact O-N 3.02Å; K183-D186 IonicContact NZ-OD2 2.86Å; K183-D186 PolarHBondContact NZ-OD2 3.48Å; D186-R190 WeakPolarHBondContact O-CD 3.26Å; D186-R190 VanDerWaalsContact O-CG 3.24Å; D186-R190 WeakPolarHBondContact O-CG 3.38Å; D186-R190 PolarHBondContact O-N 2.9Å
187	G	91.2	Very high	88.2	Confident	38 Å²	38	51.5 Å²	51.5	39%	0.392	23%	0.234	S	C	.	.	H	α-helix	trans	-67	-50	-178.8	0	0	0	0	0	112.6	K183 L184 Q185 R190 W191	K183-G187 PolarHBondContact O-N 3.12Å; K183-G187 VanDerWaalsContact O-N 3.09Å; L184-G187 PolarHBondContact O-N 2.95Å; Q185-G187 VanDerWaalsContact C-N 3.27Å; Q185-G187 PolarHBondContact O-N 2.75Å; G187-R190 PolarHBondContact O-N 3.38Å; G187-W191 PolarHBondContact O-N 2.9Å
188	F	92.9	Very high	89	Confident	34 Å²	34	56.7 Å²	56.7	15%	0.149	26%	0.257	C	S	.	.	H	α-helix	trans	-73.4	-27.1	-179.8	-70	-63.6	0	0	0	113.3	L184 Q185 W191 G192 T580 V584 P585 L588	L184-F188 HydrophobicContact CD2-CE2 4.34Å; L184-F188 WeakPolarHBondContact O-CD2 3.35Å; L184-F188 PolarHBondContact O-N 3.03Å; Q185-F188 PolarHBondContact O-N 3.35Å; F188-W191 PolarHBondContact O-N 2.9Å; F188-G192 PolarHBondContact O-N 2.77Å; F188-T580 PolarHBondContact O-OG1 3.4Å; F188-V584 HydrophobicContact CB-CB 4.42Å; F188-V584 HydrophobicContact CD1-CB 3.93Å; F188-V584 HydrophobicContact CD1-CG1 3.49Å; F188-V584 VanDerWaalsContact CD1-CG1 3.49Å; F188-V584 HydrophobicContact CD2-CB 4.45Å; F188-V584 HydrophobicContact CD2-CG1 4.42Å; F188-V584 HydrophobicContact CE1-CB 4.3Å; F188-V584 HydrophobicContact CE1-CG1 3.41Å; F188-V584 VanDerWaalsContact CE1-CG1 3.41Å; F188-V584 HydrophobicContact CE2-CG1 4.34Å; F188-V584 HydrophobicContact CG-CB 4.02Å; F188-V584 HydrophobicContact CG-CG1 4.02Å; F188-V584 HydrophobicContact CZ-CG1 3.86Å; F188-P585 HydrophobicContact CD2-CG 3.8Å; F188-P585 HydrophobicContact CE2-CG 4.3Å; F188-L588 HydrophobicContact CE2-CD2 4.11Å; F188-L588 HydrophobicContact CZ-CD2 4.12Å
189	H	92.3	Very high	89.7	Confident	31 Å²	31	54.8 Å²	54.8	14%	0.144	25%	0.25	C	C	.	.	H	α-helix	trans	-59.6	-53.6	168.2	-176.6	-90.8	0	0	0	111.1	Q185 W191 G192 I193 E574 A577 A581	Q185-H189 VanDerWaalsContact O-CB 3.25Å; Q185-H189 WeakPolarHBondContact O-CB 3.3Å; Q185-H189 PolarHBondContact O-N 2.91Å; H189-W191 VanDerWaalsContact C-N 3.3Å; H189-W191 PolarHBondContact O-N 3.29Å; H189-G192 PolarHBondContact O-N 2.98Å; H189-G192 VanDerWaalsContact O-N 3.1Å; H189-I193 PolarHBondContact O-N 2.97Å; H189-E574 IonicContact CD2-OE1 2.65Å; H189-E574 IonicContact CE1-OE1 2.89Å; H189-E574 PolarHBondContact CE1-OE1 2.99Å; H189-E574 IonicContact CE1-OE2 2.75Å; H189-E574 IonicContact NE2-OE1 3.79Å; H189-E574 PolarHBondContact NE2-OE1 3.38Å; H189-E574 IonicContact NE2-OE2 3.74Å; H189-A577 WeakPolarHBondContact O-CB 3.46Å; H189-A581 HydrophobicContact CB-CB 3.88Å
190	R	93.1	Very high	90.1	Very high	157 Å²	157	52.8 Å²	52.8	59%	0.592	25%	0.252	S	S	*	.	H	α-helix	trans	-59.6	-40	176.6	-68.8	167.2	-176.6	-162.9	-2	111.9	D186 G187 I193 I194	D186-R190 WeakPolarHBondContact O-CD 3.26Å; D186-R190 VanDerWaalsContact O-CG 3.24Å; D186-R190 WeakPolarHBondContact O-CG 3.38Å; D186-R190 PolarHBondContact O-N 2.9Å; G187-R190 PolarHBondContact O-N 3.38Å; R190-I193 PolarHBondContact O-N 2.74Å; R190-I194 VanDerWaalsContact O-CG1 3.32Å; R190-I194 WeakPolarHBondContact O-CG1 3.25Å; R190-I194 PolarHBondContact O-N 2.97Å
191	W	92.8	Very high	90.6	Very high	92 Å²	92	56.3 Å²	56.3	35%	0.348	27%	0.27	S	S	.	.	H	α-helix	trans	-63	-41.8	174.9	-170.4	-104.8	0	0	0	112.4	G187 F188 H189 I193 I194 C195 V628 T629	G187-W191 PolarHBondContact O-N 2.9Å; F188-W191 PolarHBondContact O-N 2.9Å; H189-W191 VanDerWaalsContact C-N 3.3Å; H189-W191 PolarHBondContact O-N 3.29Å; W191-I193 PolarHBondContact O-N 3.2Å; W191-I194 PolarHBondContact O-N 3.33Å; W191-C195 WeakPolarHBondContact O-CB 3.15Å; W191-C195 PolarHBondContact O-N 3.3Å; W191-V628 PolarHBondContact NE1-O 3.12Å; W191-T629 HydrophobicContact CZ2-CG2 4.13Å
192	G	91.1	Very high	91.2	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-58.9	-42.7	173.1	0	0	0	0	0	113	F188 H189 C195 T196	F188-G192 PolarHBondContact O-N 2.77Å; H189-G192 PolarHBondContact O-N 2.98Å; H189-G192 VanDerWaalsContact O-N 3.1Å; G192-C195 PolarHBondContact O-N 2.9Å; G192-T196 VanDerWaalsContact O-CB 3.29Å; G192-T196 WeakPolarHBondContact O-CB 3.35Å; G192-T196 WeakPolarHBondContact O-CG2 3.29Å; G192-T196 PolarHBondContact O-N 3.41Å; G192-T196 PolarHBondContact O-OG1 2.65Å
193	I	93	Very high	91.7	Very high	33 Å²	33	58.6 Å²	58.6	17%	0.169	28%	0.279	C	S	.	.	H	α-helix	trans	-62.2	-44	173.7	-63.2	180	0	0	0	111.2	H189 R190 W191 T196 R197 A577	H189-I193 PolarHBondContact O-N 2.97Å; R190-I193 PolarHBondContact O-N 2.74Å; W191-I193 PolarHBondContact O-N 3.2Å; I193-T196 WeakPolarHBondContact CA-OG1 3.4Å; I193-T196 PolarHBondContact O-N 3.01Å; I193-T196 PolarHBondContact O-OG1 3.46Å; I193-R197 WeakPolarHBondContact O-CB 3.32Å; I193-R197 WeakPolarHBondContact O-CG 3.3Å; I193-R197 PolarHBondContact O-N 3.33Å; I193-A577 HydrophobicContact CD1-CB 4.44Å; I193-A577 HydrophobicContact CG1-CB 3.63Å
194	I	92.9	Very high	92	Very high	83 Å²	83	57.8 Å²	57.8	43%	0.426	28%	0.279	S	S	.	.	H	α-helix	trans	-65.2	-45.4	-179.8	-68.8	164.1	0	0	0	110.9	R190 W191 R197 H198 I202	R190-I194 VanDerWaalsContact O-CG1 3.32Å; R190-I194 WeakPolarHBondContact O-CG1 3.25Å; R190-I194 PolarHBondContact O-N 2.97Å; W191-I194 PolarHBondContact O-N 3.33Å; I194-R197 PolarHBondContact O-N 2.73Å; I194-H198 PolarHBondContact O-N 2.96Å; I194-H198 VanDerWaalsContact O-N 3.11Å; I194-I202 HydrophobicContact CG2-CD1 3.91Å
195	C	92.2	Very high	92.3	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-64.4	-42.1	177.3	-164.9	0	0	0	0	112.4	W191 G192 R197 P199 I202 L632	W191-C195 WeakPolarHBondContact O-CB 3.15Å; W191-C195 PolarHBondContact O-N 3.3Å; G192-C195 PolarHBondContact O-N 2.9Å; C195-R197 VanDerWaalsContact C-N 3.35Å; C195-R197 PolarHBondContact O-N 3.28Å; C195-P199 WeakPolarHBondContact O-CA 3.44Å; C195-P199 WeakPolarHBondContact O-CD 3.32Å; C195-I202 HydrophobicContact CB-CD1 4.35Å; C195-L632 HydrophobicContact CB-CD2 3.76Å; C195-L632 HydrophobicContact CB-CG 4.12Å; C195-L632 VanDerWaalsContact SG-CG 3.57Å
196	T	90.2	Very high	92.6	Very high	1 Å²	1	55.7 Å²	55.7	1%	0.006	28%	0.278	C	S	.	.	H	α-helix	trans	-70.9	-28.5	-179.1	53.8	0	0	0	0	113.4	G192 I193 E573 V576 T636 R640	G192-T196 VanDerWaalsContact O-CB 3.29Å; G192-T196 WeakPolarHBondContact O-CB 3.35Å; G192-T196 WeakPolarHBondContact O-CG2 3.29Å; G192-T196 PolarHBondContact O-N 3.41Å; G192-T196 PolarHBondContact O-OG1 2.65Å; I193-T196 WeakPolarHBondContact CA-OG1 3.4Å; I193-T196 PolarHBondContact O-N 3.01Å; I193-T196 PolarHBondContact O-OG1 3.46Å; T196-E573 WeakPolarHBondContact OG1-CA 3.24Å; T196-V576 HydrophobicContact CG2-CB 3.53Å; T196-V576 HydrophobicContact CG2-CG1 3.43Å; T196-V576 VanDerWaalsContact CG2-CG1 3.43Å; T196-V576 HydrophobicContact CG2-CG2 4.19Å; T196-T636 HydrophobicContact CG2-CG2 4.24Å; T196-R640 PolarHBondContact O-NH2 3.21Å
197	R	92.1	Very high	92.8	Very high	132 Å²	132	58.5 Å²	58.5	50%	0.498	29%	0.288	S	S	.	.	H	α-helix	trans	-75.1	-47.2	173.7	-77.9	177.6	179.5	168.4	10.1	113.1	I193 I194 C195 P199 E573	I193-R197 WeakPolarHBondContact O-CB 3.32Å; I193-R197 WeakPolarHBondContact O-CG 3.3Å; I193-R197 PolarHBondContact O-N 3.33Å; I194-R197 PolarHBondContact O-N 2.73Å; C195-R197 VanDerWaalsContact C-N 3.35Å; C195-R197 PolarHBondContact O-N 3.28Å; R197-P199 VanDerWaalsContact O-CD 3.29Å; R197-P199 WeakPolarHBondContact O-CD 3.49Å; R197-E573 HydrophobicContact CG-CG 4.46Å; R197-E573 VanDerWaalsContact CG-OE1 3.23Å; R197-E573 WeakPolarHBondContact CG-OE1 2.82Å; R197-E573 IonicContact CZ-OE2 3.15Å; R197-E573 IonicContact NE-OE1 2.71Å; R197-E573 IonicContact NE-OE2 2.79Å; R197-E573 PolarHBondContact NE-OE2 3.42Å; R197-E573 IonicContact NH2-OE2 3.2Å; R197-E573 PolarHBondContact NH2-OE2 3.06Å
198	H	93.1	Very high	92.9	Very high	113 Å²	113	62 Å²	62	52%	0.523	30%	0.298	S	S	.	.	S	Bend	trans	-120.4	49.8	-171.4	-58.3	-63	0	0	0	114.2	I194 V200 L201 I202	I194-H198 PolarHBondContact O-N 2.96Å; I194-H198 VanDerWaalsContact O-N 3.11Å; H198-V200 VanDerWaalsContact C-N 3.35Å; H198-V200 PolarHBondContact O-N 3.48Å; H198-L201 HydrophobicContact CB-CB 4.34Å; H198-L201 PolarHBondContact O-N 3.43Å; H198-L201 VanDerWaalsContact O-N 3.16Å; H198-I202 HydrophobicContact CB-CD1 4.5Å; H198-I202 PolarHBondContact O-N 2.59Å
199	P	92.5	Very high	93	Very high	6 Å²	6	63.8 Å²	63.8	4%	0.039	31%	0.311	C	S	.	.	H	α-helix	trans	-61.4	-39.7	-170.3	24.4	-34.2	0	0	0	112.8	C195 R197 L201 I202 F203 A633 T636 I637	C195-P199 WeakPolarHBondContact O-CA 3.44Å; C195-P199 WeakPolarHBondContact O-CD 3.32Å; R197-P199 VanDerWaalsContact O-CD 3.29Å; R197-P199 WeakPolarHBondContact O-CD 3.49Å; P199-L201 VanDerWaalsContact C-N 3.34Å; P199-L201 PolarHBondContact O-N 2.82Å; P199-I202 PolarHBondContact O-N 3.33Å; P199-F203 WeakPolarHBondContact O-CB 3.33Å; P199-F203 PolarHBondContact O-N 2.93Å; P199-A633 HydrophobicContact CB-CB 3.83Å; P199-A633 VanDerWaalsContact O-CB 3.31Å; P199-A633 WeakPolarHBondContact O-CB 3.47Å; P199-T636 HydrophobicContact CB-CG2 4.36Å; P199-T636 HydrophobicContact CG-CG2 4.21Å; P199-I637 HydrophobicContact CB-CD1 4.19Å; P199-I637 HydrophobicContact CB-CG1 4.15Å; P199-I637 HydrophobicContact CG-CD1 4.44Å; P199-I637 HydrophobicContact CG-CG1 4.12Å
200	V	92.9	Very high	93	Very high	92 Å²	92	62.3 Å²	62.3	56%	0.558	31%	0.305	S	S	*	.	H	α-helix	trans	-62.9	-39	179.9	-178.2	0	0	0	0	112	H198 L204 I637	H198-V200 VanDerWaalsContact C-N 3.35Å; H198-V200 PolarHBondContact O-N 3.48Å; V200-L204 HydrophobicContact CG1-CD1 4.11Å; V200-L204 WeakPolarHBondContact O-CB 3.3Å; V200-L204 VanDerWaalsContact O-CG 3.25Å; V200-L204 WeakPolarHBondContact O-CG 3.28Å; V200-L204 PolarHBondContact O-N 3.42Å; V200-I637 HydrophobicContact CG2-CD1 4.47Å
201	L	94.3	Very high	92.9	Very high	117 Å²	117	57.7 Å²	57.7	61%	0.613	29%	0.293	S	S	*	.	H	α-helix	trans	-68.6	-41.3	179.4	-176.6	152.5	0	0	0	111.1	H198 P199 L204 A205	H198-L201 HydrophobicContact CB-CB 4.34Å; H198-L201 PolarHBondContact O-N 3.43Å; H198-L201 VanDerWaalsContact O-N 3.16Å; P199-L201 VanDerWaalsContact C-N 3.34Å; P199-L201 PolarHBondContact O-N 2.82Å; L201-L204 PolarHBondContact O-N 3.48Å; L201-A205 WeakPolarHBondContact O-CB 3.48Å; L201-A205 PolarHBondContact O-N 2.99Å
202	I	93.9	Very high	93	Very high	14 Å²	14	56.1 Å²	56.1	7%	0.072	30%	0.3	C	S	.	.	H	α-helix	trans	-74.5	-37.3	-177.8	-72	157.2	0	0	0	111.5	I194 C195 H198 P199 A205 G206 T629	I194-I202 HydrophobicContact CG2-CD1 3.91Å; C195-I202 HydrophobicContact CB-CD1 4.35Å; H198-I202 HydrophobicContact CB-CD1 4.5Å; H198-I202 PolarHBondContact O-N 2.59Å; P199-I202 PolarHBondContact O-N 3.33Å; I202-A205 PolarHBondContact O-N 2.78Å; I202-G206 PolarHBondContact O-N 3.19Å; I202-T629 HydrophobicContact CG2-CG2 4.31Å
203	F	94	Very high	93.1	Very high	63 Å²	63	57 Å²	57	28%	0.276	31%	0.306	S	S	.	.	H	α-helix	trans	-58.3	-49.9	168.5	177	-92.5	0	0	0	111.4	P199 A205 G206 F207 C630 A633 M634	P199-F203 WeakPolarHBondContact O-CB 3.33Å; P199-F203 PolarHBondContact O-N 2.93Å; F203-A205 VanDerWaalsContact C-N 3.33Å; F203-A205 PolarHBondContact O-N 3.23Å; F203-G206 PolarHBondContact O-N 2.96Å; F203-F207 WeakPolarHBondContact O-CB 3.43Å; F203-F207 PolarHBondContact O-N 3.05Å; F203-C630 HydrophobicContact CD2-CB 4.01Å; F203-C630 HydrophobicContact CE2-CB 4.42Å; F203-A633 HydrophobicContact CB-CB 4.06Å; F203-M634 HydrophobicContact CD2-CG 3.91Å; F203-M634 HydrophobicContact CD2-SD 4.24Å; F203-M634 HydrophobicContact CE2-CG 3.99Å; F203-M634 HydrophobicContact CE2-SD 3.72Å
204	L	94.4	Very high	93.1	Very high	87 Å²	87	56.7 Å²	56.7	46%	0.455	31%	0.307	S	S	.	.	H	α-helix	trans	-62.1	-39.6	178.1	-73	170.8	0	0	0	112.2	V200 L201 L208	V200-L204 HydrophobicContact CG1-CD1 4.11Å; V200-L204 WeakPolarHBondContact O-CB 3.3Å; V200-L204 VanDerWaalsContact O-CG 3.25Å; V200-L204 WeakPolarHBondContact O-CG 3.28Å; V200-L204 PolarHBondContact O-N 3.42Å; L201-L204 PolarHBondContact O-N 3.48Å; L204-L208 VanDerWaalsContact O-CB 3.31Å; L204-L208 WeakPolarHBondContact O-CB 3.21Å; L204-L208 WeakPolarHBondContact O-CD1 3.48Å; L204-L208 WeakPolarHBondContact O-CG 3.35Å; L204-L208 PolarHBondContact O-N 3.43Å
205	A	93.1	Very high	93.2	Very high	50 Å²	50	55.5 Å²	55.5	41%	0.413	31%	0.305	S	S	.	.	H	α-helix	trans	-63.8	-50.5	177.8	0	0	0	0	0	112.4	L201 I202 F203 L208 V209	L201-A205 WeakPolarHBondContact O-CB 3.48Å; L201-A205 PolarHBondContact O-N 2.99Å; I202-A205 PolarHBondContact O-N 2.78Å; F203-A205 VanDerWaalsContact C-N 3.33Å; F203-A205 PolarHBondContact O-N 3.23Å; A205-L208 PolarHBondContact O-N 3.18Å; A205-V209 WeakPolarHBondContact O-CG2 3.41Å; A205-V209 PolarHBondContact O-N 3.06Å
206	G	92.7	Very high	93.1	Very high	2 Å²	2	55.5 Å²	55.5	2%	0.021	31%	0.305	C	S	.	.	H	α-helix	trans	-65.2	-39.9	178.1	0	0	0	0	0	112.7	I202 F203 V209 S210	I202-G206 PolarHBondContact O-N 3.19Å; F203-G206 PolarHBondContact O-N 2.96Å; G206-V209 PolarHBondContact O-N 2.86Å; G206-S210 PolarHBondContact O-N 3.44Å; G206-S210 VanDerWaalsContact O-N 3.1Å
207	F	93.2	Very high	93.2	Very high	83 Å²	83	58.1 Å²	58.1	36%	0.364	32%	0.319	S	S	.	.	H	α-helix	trans	-64.4	-42.7	176.7	-174.4	-103.8	0	0	0	112.5	F203 S210 V211 L518	F203-F207 WeakPolarHBondContact O-CB 3.43Å; F203-F207 PolarHBondContact O-N 3.05Å; F207-S210 PolarHBondContact O-N 3.39Å; F207-V211 HydrophobicContact CD1-CG2 4.05Å; F207-V211 HydrophobicContact CE1-CG2 3.68Å; F207-V211 HydrophobicContact CE2-CG2 4.2Å; F207-V211 HydrophobicContact CG-CG2 4.47Å; F207-V211 HydrophobicContact CZ-CG2 3.75Å; F207-V211 WeakPolarHBondContact O-CG2 3.08Å; F207-V211 PolarHBondContact O-N 3.3Å; F207-L518 HydrophobicContact CD2-CD2 3.89Å; F207-L518 HydrophobicContact CE2-CD2 4.16Å
208	L	94.8	Very high	93.2	Very high	113 Å²	113	60.8 Å²	60.8	59%	0.592	33%	0.334	S	S	*	.	H	α-helix	trans	-64.9	-39.6	177.4	-76.3	169.4	0	0	0	112.8	L204 A205 S210 A212	L204-L208 VanDerWaalsContact O-CB 3.31Å; L204-L208 WeakPolarHBondContact O-CB 3.21Å; L204-L208 WeakPolarHBondContact O-CD1 3.48Å; L204-L208 WeakPolarHBondContact O-CG 3.35Å; L204-L208 PolarHBondContact O-N 3.43Å; A205-L208 PolarHBondContact O-N 3.18Å; L208-S210 VanDerWaalsContact C-N 3.35Å; L208-A212 WeakPolarHBondContact O-CB 3.2Å; L208-A212 PolarHBondContact O-N 3.18Å
209	V	93.5	Very high	93.1	Very high	70 Å²	70	63.2 Å²	63.2	42%	0.424	34%	0.34	S	S	.	.	H	α-helix	trans	-60.1	-47.1	173.9	169.5	0	0	0	0	110.4	A205 G206 A212 C213 F625	A205-V209 WeakPolarHBondContact O-CG2 3.41Å; A205-V209 PolarHBondContact O-N 3.06Å; G206-V209 PolarHBondContact O-N 2.86Å; V209-A212 PolarHBondContact O-N 2.95Å; V209-C213 PolarHBondContact O-N 3.05Å; V209-C213 PolarHBondContact O-SG 2.71Å; V209-F625 HydrophobicContact CG1-CE1 4.42Å
210	S	92.9	Very high	92.9	Very high	1 Å²	1	66.4 Å²	66.4	1%	0.007	36%	0.355	C	S	.	.	H	α-helix	trans	-63.9	-46.8	178.3	172.3	0	0	0	0	113	G206 F207 L208 A212 C213 C214 L518 S522	G206-S210 PolarHBondContact O-N 3.44Å; G206-S210 VanDerWaalsContact O-N 3.1Å; F207-S210 PolarHBondContact O-N 3.39Å; L208-S210 VanDerWaalsContact C-N 3.35Å; S210-A212 PolarHBondContact O-N 3.02Å; S210-C213 WeakPolarHBondContact O-CB 3.15Å; S210-C213 PolarHBondContact O-N 3.35Å; S210-C214 PolarHBondContact O-N 3.2Å; S210-C214 PolarHBondContact O-SG 2.98Å; S210-L518 WeakPolarHBondContact OG-CD1 3.45Å; S210-L518 WeakPolarHBondContact OG-CG 3.5Å; S210-S522 WeakPolarHBondContact CB-OG 3.13Å; S210-S522 PolarHBondContact OG-OG 2.92Å
211	V	92.4	Very high	92.7	Very high	59 Å²	59	68.5 Å²	68.5	36%	0.358	36%	0.359	S	S	.	.	H	α-helix	trans	-58	-39.9	177	169.1	0	0	0	0	111	F207 C213 C214 C215	F207-V211 HydrophobicContact CD1-CG2 4.05Å; F207-V211 HydrophobicContact CE1-CG2 3.68Å; F207-V211 HydrophobicContact CE2-CG2 4.2Å; F207-V211 HydrophobicContact CG-CG2 4.47Å; F207-V211 HydrophobicContact CZ-CG2 3.75Å; F207-V211 WeakPolarHBondContact O-CG2 3.08Å; F207-V211 PolarHBondContact O-N 3.3Å; V211-C213 VanDerWaalsContact C-N 3.34Å; V211-C213 PolarHBondContact O-N 3.41Å; V211-C214 PolarHBondContact O-N 3.02Å; V211-C215 PolarHBondContact O-N 2.82Å; V211-C215 VanDerWaalsContact O-N 3.13Å; V211-C215 PolarHBondContact O-SG 3.26Å
212	A	93.6	Very high	92.4	Very high	60 Å²	60	66.8 Å²	66.8	50%	0.496	35%	0.35	S	S	.	.	H	α-helix	trans	-62	-38.1	175.6	0	0	0	0	0	112.7	L208 V209 S210 F529	L208-A212 WeakPolarHBondContact O-CB 3.2Å; L208-A212 PolarHBondContact O-N 3.18Å; V209-A212 PolarHBondContact O-N 2.95Å; S210-A212 PolarHBondContact O-N 3.02Å; A212-F529 WeakPolarHBondContact O-CE2 3.18Å
213	C	93.5	Very high	91.9	Very high	18 Å²	18	67 Å²	67	12%	0.122	35%	0.351	C	S	.	.	H	α-helix	trans	-69.6	-44.6	173.2	-63.2	0	0	0	0	112.3	V209 S210 V211 C215 G216 G525 F622	V209-C213 PolarHBondContact O-N 3.05Å; V209-C213 PolarHBondContact O-SG 2.71Å; S210-C213 WeakPolarHBondContact O-CB 3.15Å; S210-C213 PolarHBondContact O-N 3.35Å; V211-C213 VanDerWaalsContact C-N 3.34Å; V211-C213 PolarHBondContact O-N 3.41Å; C213-C215 PolarHBondContact O-N 3.47Å; C213-G216 PolarHBondContact O-N 3.45Å; C213-G525 CarbonylContact O-C 3.58Å; C213-G525 WeakPolarHBondContact O-CA 3.2Å; C213-F622 HydrophobicContact CB-CZ 4.37Å
214	C	93.1	Very high	91.1	Very high	26 Å²	26	68.2 Å²	68.2	18%	0.176	36%	0.364	C	S	.	.	H	α-helix	trans	-59.9	-24.9	178.9	-68.7	0	0	0	0	113.6	S210 V211 G216 L217	S210-C214 PolarHBondContact O-N 3.2Å; S210-C214 PolarHBondContact O-SG 2.98Å; V211-C214 PolarHBondContact O-N 3.02Å; C214-G216 PolarHBondContact O-N 3.45Å; C214-G216 VanDerWaalsContact O-N 3.12Å; C214-L217 WeakPolarHBondContact O-CB 3.23Å; C214-L217 WeakPolarHBondContact O-CD1 3.31Å; C214-L217 VanDerWaalsContact O-CG 3.26Å; C214-L217 WeakPolarHBondContact O-CG 3.23Å; C214-L217 PolarHBondContact O-N 3.47Å; C214-L217 VanDerWaalsContact O-N 3.16Å
215	C	93.9	Very high	90.2	Very high	59 Å²	59	66.3 Å²	66.3	40%	0.399	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-58	-21	172.6	-72.5	0	0	0	0	113.9	V211 C213 L217 F218 F529	V211-C215 PolarHBondContact O-N 2.82Å; V211-C215 VanDerWaalsContact O-N 3.13Å; V211-C215 PolarHBondContact O-SG 3.26Å; C213-C215 PolarHBondContact O-N 3.47Å; C215-L217 PolarHBondContact O-N 3.5Å; C215-F218 WeakPolarHBondContact O-CD2 3.5Å; C215-F529 HydrophobicContact CB-CE2 4.22Å; C215-F529 HydrophobicContact CB-CZ 3.91Å
216	G	91.6	Very high	89.6	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	-70.8	-15.9	178.5	0	0	0	0	0	114	C213 C214 F218 Y219 G525 A528 F529	C213-G216 PolarHBondContact O-N 3.45Å; C214-G216 PolarHBondContact O-N 3.45Å; C214-G216 VanDerWaalsContact O-N 3.12Å; G216-F218 PolarHBondContact O-N 2.97Å; G216-F218 VanDerWaalsContact O-N 3.08Å; G216-Y219 PolarHBondContact O-N 3.48Å; G216-G525 WeakPolarHBondContact CA-O 3.39Å; G216-A528 WeakPolarHBondContact O-CB 3.46Å; G216-F529 VanDerWaalsContact CA-CD2 3.41Å
217	L	91.2	Very high	89.1	Confident	55 Å²	55	67.2 Å²	67.2	29%	0.288	36%	0.356	S	S	.	.	G	3₁₀ helix	trans	-60.2	-19.8	178.7	-65.2	170.9	0	0	0	113.6	C214 C215 Y219 M220 L521 L524	C214-L217 WeakPolarHBondContact O-CB 3.23Å; C214-L217 WeakPolarHBondContact O-CD1 3.31Å; C214-L217 VanDerWaalsContact O-CG 3.26Å; C214-L217 WeakPolarHBondContact O-CG 3.23Å; C214-L217 PolarHBondContact O-N 3.47Å; C214-L217 VanDerWaalsContact O-N 3.16Å; C215-L217 PolarHBondContact O-N 3.5Å; L217-Y219 PolarHBondContact O-N 2.71Å; L217-M220 HydrophobicContact CD2-SD 4.33Å; L217-M220 WeakPolarHBondContact O-CB 3.47Å; L217-M220 PolarHBondContact O-N 2.72Å; L217-L521 HydrophobicContact CD1-CB 4.4Å; L217-L521 HydrophobicContact CD1-CD2 4.06Å; L217-L524 HydrophobicContact CD2-CB 3.66Å
218	F	91.8	Very high	88.7	Confident	188 Å²	188	68.3 Å²	68.3	83%	0.825	36%	0.362	S	S	*	.	G	3₁₀ helix	trans	-68.1	-15.3	171.4	-69.5	-65.6	0	0	0	114.1	C215 G216	C215-F218 WeakPolarHBondContact O-CD2 3.5Å; G216-F218 PolarHBondContact O-N 2.97Å; G216-F218 VanDerWaalsContact O-N 3.08Å
219	Y	91.2	Very high	88.2	Confident	164 Å²	164	64 Å²	64	64%	0.643	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-109.2	15.6	177.2	-57	-77.1	0	0	0	112.4	G216 L217 E221 F529	G216-Y219 PolarHBondContact O-N 3.48Å; L217-Y219 PolarHBondContact O-N 2.71Å; Y219-E221 PolarHBondContact O-N 2.66Å; Y219-F529 HydrophobicContact CD2-CD1 4.1Å; Y219-F529 HydrophobicContact CD2-CE1 4.05Å; Y219-F529 HydrophobicContact CE2-CD1 4.34Å; Y219-F529 AromaticContact CE2-CE1 3.94Å; Y219-F529 HydrophobicContact CE2-CE1 3.94Å
220	M	88.9	Confident	87.7	Confident	73 Å²	73	63.4 Å²	63.4	36%	0.36	33%	0.329	S	S	.	.			trans	-76.3	112.3	-176.5	-174.6	-174.9	70.7	0	0	111.8	L217 I222 A528 T534	L217-M220 HydrophobicContact CD2-SD 4.33Å; L217-M220 WeakPolarHBondContact O-CB 3.47Å; L217-M220 PolarHBondContact O-N 2.72Å; M220-I222 HydrophobicContact CE-CD1 4.1Å; M220-I222 HydrophobicContact CE-CG1 4.26Å; M220-A528 HydrophobicContact CB-CB 4.13Å; M220-T534 HydrophobicContact CG-CG2 3.84Å; M220-T534 HydrophobicContact SD-CG2 3.92Å
221	E	89.2	Confident	87.4	Confident	137 Å²	137	63.6 Å²	63.6	64%	0.64	33%	0.33	S	S	*	.			trans	-94.7	143.1	168.7	-173	171.1	-169.9	0	0	110.7	Y219 P533 T534	Y219-E221 PolarHBondContact O-N 2.66Å; E221-P533 HydrophobicContact CB-CB 4.34Å; E221-P533 HydrophobicContact CG-CB 4.47Å; E221-P533 WeakPolarHBondContact O-CA 3.32Å; E221-T534 PolarHBondContact O-N 3.1Å
222	I	87.3	Confident	87.2	Confident	81 Å²	81	61.6 Å²	61.6	42%	0.415	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	118.8	179.5	-52.1	177.6	0	0	0	108.9	M220 T534 I539	M220-I222 HydrophobicContact CE-CD1 4.1Å; M220-I222 HydrophobicContact CE-CG1 4.26Å; I222-T534 WeakPolarHBondContact CA-O 3.19Å; I222-T534 HydrophobicContact CB-CG2 4.49Å; I222-T534 HydrophobicContact CG1-CG2 3.9Å; I222-I539 HydrophobicContact CD1-CD1 4.18Å
223	T	84.2	Confident	86.9	Confident	17 Å²	17	63.6 Å²	63.6	10%	0.104	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	123	174	-52.5	0	0	0	0	110.5	Q228 I229 T534	T223-Q228 HydrophobicContact CG2-CB 3.64Å; T223-I229 HydrophobicContact CG2-CG1 4.03Å; T223-T534 PolarHBondContact N-O 3.13Å
224	T	76.5	Confident	86.6	Confident	90 Å²	90	64.8 Å²	64.8	55%	0.552	34%	0.344	S	S	*	.			trans	-101.6	-29.7	169.3	66.3	0	0	0	0	113.4	P226 E458	T224-P226 WeakPolarHBondContact O-CD 3.44Å; T224-P226 VanDerWaalsContact O-N 3.11Å; T224-E458 VanDerWaalsContact CB-OE1 3.25Å; T224-E458 WeakPolarHBondContact CB-OE1 3.27Å; T224-E458 PolarHBondContact OG1-OE1 3Å
225	D	76.3	Confident	86.6	Confident	47 Å²	47	64.6 Å²	64.6	25%	0.251	34%	0.342	S	S	.	.			trans	-52.6	112.9	-178.4	171.1	10.4	0	0	0	111.8	V227 Q228 I229	D225-V227 PolarHBondContact O-N 2.79Å; D225-V227 WeakPolarHBondContact OD1-CA 3.22Å; D225-V227 VanDerWaalsContact OD1-CB 3.26Å; D225-V227 WeakPolarHBondContact OD1-CB 3.39Å; D225-V227 VanDerWaalsContact OD1-CG2 3.29Å; D225-V227 WeakPolarHBondContact OD1-CG2 3.38Å; D225-V227 PolarHBondContact OD1-N 2.85Å; D225-Q228 HydrophobicContact CB-CB 4.12Å; D225-Q228 HydrophobicContact CB-CG 4.31Å; D225-Q228 PolarHBondContact O-N 2.94Å; D225-Q228 PolarHBondContact OD1-N 3.23Å; D225-Q228 WeakPolarHBondContact OD2-CG 3.23Å; D225-Q228 PolarHBondContact OD2-N 3.42Å; D225-Q228 PolarHBondContact OD2-NE2 2.9Å; D225-I229 WeakPolarHBondContact O-CG1 3.23Å; D225-I229 PolarHBondContact O-N 2.86Å; D225-I229 VanDerWaalsContact O-N 3.09Å
226	P	79.9	Confident	86.5	Confident	47 Å²	47	67 Å²	67	31%	0.305	34%	0.343	S	S	.	.	H	α-helix	trans	-63.8	-27.1	-178.7	27.2	-34.8	0	0	0	112.1	T224 Q228 I229 W230 F936	T224-P226 WeakPolarHBondContact O-CD 3.44Å; T224-P226 VanDerWaalsContact O-N 3.11Å; P226-Q228 VanDerWaalsContact C-N 3.34Å; P226-I229 PolarHBondContact O-N 3.04Å; P226-W230 WeakPolarHBondContact O-CB 3.39Å; P226-W230 PolarHBondContact O-N 3.28Å; P226-F936 HydrophobicContact CB-CE1 4.09Å; P226-F936 HydrophobicContact CG-CE1 4.34Å; P226-F936 HydrophobicContact CG-CZ 4.45Å
227	V	82.9	Confident	86.6	Confident	24 Å²	24	67.1 Å²	67.1	15%	0.145	34%	0.344	C	S	.	.	H	α-helix	trans	-70.5	-33.6	177.2	-156.8	0	0	0	0	110.3	D225 S231 R238 V935 F936	D225-V227 PolarHBondContact O-N 2.79Å; D225-V227 WeakPolarHBondContact OD1-CA 3.22Å; D225-V227 VanDerWaalsContact OD1-CB 3.26Å; D225-V227 WeakPolarHBondContact OD1-CB 3.39Å; D225-V227 VanDerWaalsContact OD1-CG2 3.29Å; D225-V227 WeakPolarHBondContact OD1-CG2 3.38Å; D225-V227 PolarHBondContact OD1-N 2.85Å; V227-S231 WeakPolarHBondContact O-CB 3.43Å; V227-S231 PolarHBondContact O-N 3.4Å; V227-S231 PolarHBondContact O-OG 3.09Å; V227-R238 VanDerWaalsContact CG1-CZ 3.46Å; V227-R238 PolarHBondContact O-NH2 3.45Å; V227-V935 HydrophobicContact CG1-CB 4.06Å; V227-V935 HydrophobicContact CG1-CG2 3.72Å; V227-F936 HydrophobicContact CB-CE1 4.28Å; V227-F936 HydrophobicContact CG2-CE1 3.84Å; V227-F936 HydrophobicContact CG2-CZ 3.7Å
228	Q	84.7	Confident	86.7	Confident	105 Å²	105	66.3 Å²	66.3	49%	0.491	34%	0.337	S	S	.	.	H	α-helix	trans	-74.9	-33.9	173.4	-81.7	170.9	70.5	0	0	112.7	T223 D225 P226 P607	T223-Q228 HydrophobicContact CG2-CB 3.64Å; D225-Q228 HydrophobicContact CB-CB 4.12Å; D225-Q228 HydrophobicContact CB-CG 4.31Å; D225-Q228 PolarHBondContact O-N 2.94Å; D225-Q228 PolarHBondContact OD1-N 3.23Å; D225-Q228 WeakPolarHBondContact OD2-CG 3.23Å; D225-Q228 PolarHBondContact OD2-N 3.42Å; D225-Q228 PolarHBondContact OD2-NE2 2.9Å; P226-Q228 VanDerWaalsContact C-N 3.34Å; Q228-P607 WeakPolarHBondContact O-CB 3.31Å; Q228-P607 WeakPolarHBondContact O-CG 3.38Å
229	I	83.9	Confident	86.8	Confident	22 Å²	22	65 Å²	65	11%	0.113	33%	0.327	C	S	.	.	H	α-helix	trans	-71.8	-45.2	179.6	-64.5	166.3	0	0	0	111.3	T223 D225 P226 T535 A608	T223-I229 HydrophobicContact CG2-CG1 4.03Å; D225-I229 WeakPolarHBondContact O-CG1 3.23Å; D225-I229 PolarHBondContact O-N 2.86Å; D225-I229 VanDerWaalsContact O-N 3.09Å; P226-I229 PolarHBondContact O-N 3.04Å; I229-T535 HydrophobicContact CG1-CG2 4.36Å; I229-A608 HydrophobicContact CG2-CB 3.75Å; I229-A608 WeakPolarHBondContact O-CB 3.35Å; I229-A608 PolarHBondContact O-N 3.35Å
230	W	83.8	Confident	87	Confident	59 Å²	59	57.7 Å²	57.7	22%	0.223	30%	0.298	C	S	.	.	H	α-helix	trans	-101.5	-20.4	-167.8	-59.7	119.4	0	0	0	115.9	P226 I537 A608 F936 A1000 V1001	P226-W230 WeakPolarHBondContact O-CB 3.39Å; P226-W230 PolarHBondContact O-N 3.28Å; W230-I537 HydrophobicContact CH2-CD1 3.69Å; W230-I537 HydrophobicContact CZ2-CD1 3.94Å; W230-A608 HydrophobicContact CE3-CB 4.06Å; W230-A608 HydrophobicContact CH2-CB 4.3Å; W230-A608 HydrophobicContact CZ3-CB 3.74Å; W230-F936 HydrophobicContact CB-CD1 4.49Å; W230-A1000 HydrophobicContact CE3-CB 4.11Å; W230-A1000 HydrophobicContact CZ3-CB 3.74Å; W230-V1001 HydrophobicContact CH2-CG2 3.65Å; W230-V1001 HydrophobicContact CZ2-CG2 4.49Å; W230-V1001 HydrophobicContact CZ3-CG2 4.3Å
231	S	86.4	Confident	87.2	Confident	4 Å²	4	56 Å²	56	3%	0.028	29%	0.289	C	S	.	.	S	Bend	trans	-110.2	130.6	-179.3	79.3	0	0	0	0	112.2	V227 R238 P607 V935	V227-S231 WeakPolarHBondContact O-CB 3.43Å; V227-S231 PolarHBondContact O-N 3.4Å; V227-S231 PolarHBondContact O-OG 3.09Å; S231-R238 WeakPolarHBondContact OG-CG 3.2Å; S231-R238 PolarHBondContact OG-NE 3.47Å; S231-P607 WeakPolarHBondContact O-CG 3.39Å; S231-V935 WeakPolarHBondContact CB-O 3.15Å
232	A	87.8	Confident	87.4	Confident	18 Å²	18	54.4 Å²	54.4	15%	0.149	28%	0.282	C	S	.	.			trans	-64.9	130.5	178.9	0	0	0	0	0	110.2	G234 S235 R238 S605	A232-G234 PolarHBondContact O-N 3.27Å; A232-S235 VanDerWaalsContact O-CB 3.26Å; A232-S235 WeakPolarHBondContact O-CB 3.33Å; A232-S235 PolarHBondContact O-N 2.95Å; A232-R238 WeakPolarHBondContact O-CG 3.01Å; A232-S605 WeakPolarHBondContact CB-O 3.39Å
233	P	87.1	Confident	87.7	Confident	101 Å²	101	52.2 Å²	52.2	66%	0.656	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-21.7	-175	23.3	-34.1	0	0	0	113.8
234	G	88	Confident	88.2	Confident	44 Å²	44	51.9 Å²	51.9	45%	0.454	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.3	5.5	174.2	0	0	0	0	0	115.6	A232 R239	A232-G234 PolarHBondContact O-N 3.27Å; G234-R239 PolarHBondContact O-NE 2.93Å; G234-R239 VanDerWaalsContact O-NE 3.14Å; G234-R239 PolarHBondContact O-NH2 3.5Å
235	S	91.4	Very high	88.9	Confident	21 Å²	21	48.3 Å²	48.3	15%	0.147	24%	0.244	C	C	.	.	S	Bend	trans	-65.5	166.3	-174.4	101	0	0	0	0	113	A232 A237 R238 R239 E938	A232-S235 VanDerWaalsContact O-CB 3.26Å; A232-S235 WeakPolarHBondContact O-CB 3.33Å; A232-S235 PolarHBondContact O-N 2.95Å; S235-A237 PolarHBondContact OG-N 3.16Å; S235-R238 PolarHBondContact OG-N 3.08Å; S235-R239 WeakPolarHBondContact O-CG 3.39Å; S235-R239 PolarHBondContact O-N 3.03Å; S235-E938 WeakPolarHBondContact CB-OE2 3.4Å; S235-E938 PolarHBondContact OG-OE2 2.96Å
236	R	93.6	Very high	89.6	Confident	111 Å²	111	50 Å²	50	42%	0.419	26%	0.259	S	S	.	.	H	α-helix	trans	-68.6	-48.3	176.6	174.9	-175.3	163.5	158.1	5.4	110.2	R238 R239 E240 E938	R236-R238 VanDerWaalsContact C-N 3.3Å; R236-R238 PolarHBondContact O-N 2.94Å; R236-R239 PolarHBondContact O-N 3.14Å; R236-R239 VanDerWaalsContact O-N 3.13Å; R236-E240 HydrophobicContact CG-CG 4.32Å; R236-E240 IonicContact CZ-OE1 2.87Å; R236-E240 IonicContact NE-OE1 2.83Å; R236-E240 PolarHBondContact NE-OE1 3.02Å; R236-E240 IonicContact NE-OE2 3.91Å; R236-E240 IonicContact NH2-OE1 3.97Å; R236-E240 PolarHBondContact NH2-OE1 2.82Å; R236-E240 WeakPolarHBondContact O-CG 3.27Å; R236-E240 PolarHBondContact O-N 2.9Å; R236-E938 WeakPolarHBondContact CB-OE1 3.26Å; R236-E938 PolarHBondContact N-OE2 3.14Å
237	A	93.5	Very high	90.2	Very high	2 Å²	2	50.5 Å²	50.5	2%	0.017	26%	0.257	C	S	.	.	H	α-helix	trans	-61.7	-34.7	177.7	0	0	0	0	0	112.9	S235 E240 K241 V935 E938	S235-A237 PolarHBondContact OG-N 3.16Å; A237-E240 PolarHBondContact O-N 3.16Å; A237-K241 WeakPolarHBondContact O-CB 3.33Å; A237-K241 PolarHBondContact O-N 3.31Å; A237-V935 HydrophobicContact CB-CG1 4.07Å; A237-E938 HydrophobicContact CB-CB 4.03Å; A237-E938 HydrophobicContact CB-CG 4.42Å; A237-E938 VanDerWaalsContact CB-OE2 3.29Å; A237-E938 WeakPolarHBondContact CB-OE2 3.27Å; A237-E938 PolarHBondContact N-OE1 2.7Å; A237-E938 PolarHBondContact N-OE2 2.78Å
238	R	92.6	Very high	90.5	Very high	38 Å²	38	50 Å²	50	14%	0.143	25%	0.253	C	S	.	.	H	α-helix	trans	-64.2	-39.5	173.6	-95.2	-69.1	-165.4	171.5	4.7	112.9	V227 S231 A232 S235 R236 Q242	V227-R238 VanDerWaalsContact CG1-CZ 3.46Å; V227-R238 PolarHBondContact O-NH2 3.45Å; S231-R238 WeakPolarHBondContact OG-CG 3.2Å; S231-R238 PolarHBondContact OG-NE 3.47Å; A232-R238 WeakPolarHBondContact O-CG 3.01Å; S235-R238 PolarHBondContact OG-N 3.08Å; R236-R238 VanDerWaalsContact C-N 3.3Å; R236-R238 PolarHBondContact O-N 2.94Å; R238-Q242 WeakPolarHBondContact O-CB 3.38Å; R238-Q242 VanDerWaalsContact O-CG 3.26Å; R238-Q242 WeakPolarHBondContact O-CG 3.23Å; R238-Q242 PolarHBondContact O-N 3.18Å
239	R	94.2	Very high	90.7	Very high	161 Å²	161	49.7 Å²	49.7	61%	0.608	25%	0.252	S	S	*	.	H	α-helix	trans	-70.2	-40.7	174.5	-65.1	176.2	-148.1	-163.3	3.7	112.1	G234 S235 R236 K241 Q242 F243	G234-R239 PolarHBondContact O-NE 2.93Å; G234-R239 VanDerWaalsContact O-NE 3.14Å; G234-R239 PolarHBondContact O-NH2 3.5Å; S235-R239 WeakPolarHBondContact O-CG 3.39Å; S235-R239 PolarHBondContact O-N 3.03Å; R236-R239 PolarHBondContact O-N 3.14Å; R236-R239 VanDerWaalsContact O-N 3.13Å; R239-K241 VanDerWaalsContact C-N 3.32Å; R239-K241 PolarHBondContact O-N 2.87Å; R239-Q242 PolarHBondContact O-N 3.43Å; R239-F243 WeakPolarHBondContact O-CB 3.33Å; R239-F243 PolarHBondContact O-N 3.29Å
240	E	94.6	Very high	91	Very high	9 Å²	9	49.6 Å²	49.6	4%	0.042	25%	0.253	C	S	.	.	H	α-helix	trans	-60.6	-41.8	175.1	-70.8	171.3	151.2	0	0	110.7	R236 A237 F244 R906 F928	R236-E240 HydrophobicContact CG-CG 4.32Å; R236-E240 IonicContact CZ-OE1 2.87Å; R236-E240 IonicContact NE-OE1 2.83Å; R236-E240 PolarHBondContact NE-OE1 3.02Å; R236-E240 IonicContact NE-OE2 3.91Å; R236-E240 IonicContact NH2-OE1 3.97Å; R236-E240 PolarHBondContact NH2-OE1 2.82Å; R236-E240 WeakPolarHBondContact O-CG 3.27Å; R236-E240 PolarHBondContact O-N 2.9Å; A237-E240 PolarHBondContact O-N 3.16Å; E240-F244 PolarHBondContact O-N 3.44Å; E240-F244 VanDerWaalsContact O-N 3.1Å; E240-R906 IonicContact OE2-CZ 3.86Å; E240-R906 IonicContact OE2-NE 3.68Å; E240-R906 IonicContact OE2-NH2 3.24Å; E240-R906 PolarHBondContact OE2-NH2 3.1Å; E240-F928 HydrophobicContact CB-CD2 3.72Å; E240-F928 HydrophobicContact CB-CE2 3.65Å; E240-F928 HydrophobicContact CB-CZ 4.42Å; E240-F928 HydrophobicContact CG-CB 4.32Å; E240-F928 HydrophobicContact CG-CD2 3.57Å; E240-F928 HydrophobicContact CG-CE2 3.92Å; E240-F928 HydrophobicContact CG-CG 3.94Å; E240-F928 WeakPolarHBondContact OE1-CB 3.33Å
241	K	93.7	Very high	91.3	Very high	39 Å²	39	47.3 Å²	47.3	17%	0.17	24%	0.244	C	C	.	.	H	α-helix	trans	-62.6	-53.7	171.6	-161.7	-150.8	-176.2	-67	0	111.8	A237 R239 F243 F244 D245 Y930 V935	A237-K241 WeakPolarHBondContact O-CB 3.33Å; A237-K241 PolarHBondContact O-N 3.31Å; R239-K241 VanDerWaalsContact C-N 3.32Å; R239-K241 PolarHBondContact O-N 2.87Å; K241-F243 VanDerWaalsContact C-N 3.26Å; K241-F243 PolarHBondContact O-N 3.03Å; K241-F244 WeakPolarHBondContact O-CA 3.41Å; K241-F244 WeakPolarHBondContact O-CB 3.31Å; K241-F244 PolarHBondContact O-N 2.88Å; K241-D245 WeakPolarHBondContact CD-OD2 3.47Å; K241-D245 WeakPolarHBondContact CG-OD2 3.42Å; K241-D245 IonicContact NZ-OD1 3.92Å; K241-D245 PolarHBondContact NZ-OD1 2.81Å; K241-D245 IonicContact NZ-OD2 3.25Å; K241-D245 PolarHBondContact NZ-OD2 2.9Å; K241-D245 PolarHBondContact O-N 3.41Å; K241-Y930 HydrophobicContact CB-CE2 3.89Å; K241-Y930 HydrophobicContact CG-CE2 3.68Å; K241-Y930 WeakPolarHBondContact CG-OH 3.17Å; K241-V935 HydrophobicContact CB-CG1 4.12Å; K241-V935 HydrophobicContact CD-CG1 4.48Å
242	Q	93.1	Very high	91.6	Very high	103 Å²	103	49.5 Å²	49.5	48%	0.481	25%	0.252	S	S	.	.	H	α-helix	trans	-58	-36.1	-179.2	-76.9	169.8	-20.4	0	0	112.9	R238 R239 S246	R238-Q242 WeakPolarHBondContact O-CB 3.38Å; R238-Q242 VanDerWaalsContact O-CG 3.26Å; R238-Q242 WeakPolarHBondContact O-CG 3.23Å; R238-Q242 PolarHBondContact O-N 3.18Å; R239-Q242 PolarHBondContact O-N 3.43Å; Q242-S246 WeakPolarHBondContact O-CB 3.31Å; Q242-S246 PolarHBondContact O-N 3.15Å; Q242-S246 PolarHBondContact O-OG 3.37Å
243	F	93.8	Very high	91.9	Very high	35 Å²	35	49.9 Å²	49.9	15%	0.154	25%	0.25	C	C	.	.	H	α-helix	trans	-65.9	-48.4	172.5	-173.1	-83	0	0	0	111	R239 K241 S246 H247 V741 Q743 F928	R239-F243 WeakPolarHBondContact O-CB 3.33Å; R239-F243 PolarHBondContact O-N 3.29Å; K241-F243 VanDerWaalsContact C-N 3.26Å; K241-F243 PolarHBondContact O-N 3.03Å; F243-S246 PolarHBondContact O-N 3.48Å; F243-S246 PolarHBondContact O-OG 2.87Å; F243-S246 VanDerWaalsContact O-OG 3.1Å; F243-H247 AromaticContact CD2-CE1 3.68Å; F243-H247 HydrophobicContact CE1-CB 4.41Å; F243-H247 AromaticContact CE1-CG 3.96Å; F243-H247 AromaticContact CE2-CE1 3.45Å; F243-H247 VanDerWaalsContact CE2-CE1 3.45Å; F243-H247 WeakPolarHBondContact CE2-CE1 3.27Å; F243-H247 AromaticContact CE2-ND1 3.99Å; F243-H247 AromaticContact CE2-NE2 3.47Å; F243-H247 WeakPolarHBondContact CE2-NE2 3.16Å; F243-H247 AromaticContact CZ-CD2 3.64Å; F243-H247 AromaticContact CZ-CE1 3.8Å; F243-H247 AromaticContact CZ-CG 3.97Å; F243-H247 AromaticContact CZ-NE2 3.54Å; F243-H247 WeakPolarHBondContact O-CB 3.41Å; F243-H247 PolarHBondContact O-N 3.15Å; F243-H247 PolarHBondContact O-ND1 3.07Å; F243-V741 HydrophobicContact CD1-CG1 4.15Å; F243-V741 HydrophobicContact CE1-CG1 3.88Å; F243-Q743 HydrophobicContact CD2-CG 4.44Å; F243-Q743 HydrophobicContact CE1-CB 4.4Å; F243-Q743 HydrophobicContact CE1-CG 4.36Å; F243-Q743 HydrophobicContact CE2-CG 3.76Å; F243-Q743 HydrophobicContact CZ-CB 4.15Å; F243-Q743 HydrophobicContact CZ-CG 3.72Å; F243-F928 HydrophobicContact CB-CZ 4.12Å; F243-F928 AromaticContact CD1-CE1 3.94Å; F243-F928 HydrophobicContact CD1-CE1 3.94Å; F243-F928 AromaticContact CD1-CZ 3.67Å; F243-F928 HydrophobicContact CD1-CZ 3.67Å; F243-F928 HydrophobicContact CE1-CE1 4.44Å; F243-F928 HydrophobicContact CE1-CZ 4.48Å; F243-F928 HydrophobicContact CG-CE1 4.33Å; F243-F928 HydrophobicContact CG-CZ 4.13Å
244	F	94.1	Very high	92.2	Very high	10 Å²	10	46.7 Å²	46.7	4%	0.044	23%	0.227	C	C	.	.	H	α-helix	trans	-59.2	-53.1	178.6	-172.6	-82.3	0	0	0	112	E240 K241 S246 H247 F248 Q249 Y739 V741 Y930	E240-F244 PolarHBondContact O-N 3.44Å; E240-F244 VanDerWaalsContact O-N 3.1Å; K241-F244 WeakPolarHBondContact O-CA 3.41Å; K241-F244 WeakPolarHBondContact O-CB 3.31Å; K241-F244 PolarHBondContact O-N 2.88Å; F244-S246 VanDerWaalsContact C-N 3.27Å; F244-S246 PolarHBondContact O-N 2.95Å; F244-H247 PolarHBondContact O-N 3.37Å; F244-H247 VanDerWaalsContact O-N 3.16Å; F244-F248 HydrophobicContact CD1-CB 4.47Å; F244-F248 AromaticContact CD2-CD2 3.74Å; F244-F248 HydrophobicContact CD2-CD2 3.74Å; F244-F248 HydrophobicContact CD2-CE2 4.47Å; F244-F248 HydrophobicContact CE1-CB 4.16Å; F244-F248 HydrophobicContact CE2-CB 4.3Å; F244-F248 AromaticContact CE2-CD2 3.95Å; F244-F248 HydrophobicContact CE2-CD2 3.95Å; F244-F248 HydrophobicContact CE2-CG 4.43Å; F244-F248 HydrophobicContact CG-CD2 4.2Å; F244-F248 HydrophobicContact CZ-CB 4.08Å; F244-F248 PolarHBondContact O-N 2.61Å; F244-Q249 WeakPolarHBondContact CE1-O 3.26Å; F244-Y739 HydrophobicContact CE2-CD1 4.17Å; F244-Y739 HydrophobicContact CE2-CD2 4.09Å; F244-Y739 AromaticContact CE2-CG 3.78Å; F244-Y739 HydrophobicContact CE2-CG 3.78Å; F244-Y739 HydrophobicContact CZ-CD1 4.34Å; F244-Y739 HydrophobicContact CZ-CD2 4.19Å; F244-Y739 HydrophobicContact CZ-CE2 4.42Å; F244-Y739 HydrophobicContact CZ-CG 4.16Å; F244-V741 HydrophobicContact CD2-CG2 3.89Å; F244-V741 HydrophobicContact CE2-CG2 4.46Å; F244-Y930 HydrophobicContact CB-CD1 3.91Å; F244-Y930 HydrophobicContact CB-CD2 4.44Å; F244-Y930 HydrophobicContact CB-CE1 4.07Å; F244-Y930 HydrophobicContact CB-CG 4.09Å; F244-Y930 AromaticContact CD1-CD1 3.72Å; F244-Y930 HydrophobicContact CD1-CD1 3.72Å; F244-Y930 AromaticContact CD1-CE1 3.38Å; F244-Y930 HydrophobicContact CD1-CE1 3.38Å; F244-Y930 AromaticContact CD2-CD1 3.32Å; F244-Y930 HydrophobicContact CD2-CD1 3.32Å; F244-Y930 AromaticContact CD2-CE1 3.93Å; F244-Y930 HydrophobicContact CD2-CE1 3.93Å; F244-Y930 AromaticContact CD2-CG 3.95Å; F244-Y930 HydrophobicContact CD2-CG 3.95Å; F244-Y930 HydrophobicContact CE1-CD1 4.05Å; F244-Y930 AromaticContact CE1-CE1 3.73Å; F244-Y930 HydrophobicContact CE1-CE1 3.73Å; F244-Y930 AromaticContact CE2-CD1 3.68Å; F244-Y930 HydrophobicContact CE2-CD1 3.68Å; F244-Y930 HydrophobicContact CE2-CE1 4.22Å; F244-Y930 AromaticContact CG-CD1 3.34Å; F244-Y930 HydrophobicContact CG-CD1 3.34Å; F244-Y930 AromaticContact CG-CE1 3.5Å; F244-Y930 HydrophobicContact CG-CE1 3.5Å; F244-Y930 VanDerWaalsContact CG-CE1 3.5Å; F244-Y930 AromaticContact CG-CG 3.99Å; F244-Y930 HydrophobicContact CG-CG 3.99Å; F244-Y930 HydrophobicContact CZ-CD1 4.02Å; F244-Y930 HydrophobicContact CZ-CE1 4.13Å
245	D	92	Very high	92.6	Very high	15 Å²	15	44.6 Å²	44.6	8%	0.08	21%	0.205	C	C	.	.	H	α-helix	trans	-53.9	-44.4	-178.5	-59.9	-34.3	0	0	0	111.6	K241 Q249 P250	K241-D245 WeakPolarHBondContact CD-OD2 3.47Å; K241-D245 WeakPolarHBondContact CG-OD2 3.42Å; K241-D245 IonicContact NZ-OD1 3.92Å; K241-D245 PolarHBondContact NZ-OD1 2.81Å; K241-D245 IonicContact NZ-OD2 3.25Å; K241-D245 PolarHBondContact NZ-OD2 2.9Å; K241-D245 PolarHBondContact O-N 3.41Å; D245-Q249 CarbonylContact O-C 3.58Å; D245-Q249 WeakPolarHBondContact O-CA 3.24Å; D245-Q249 PolarHBondContact O-N 3.32Å; D245-P250 HydrophobicContact CB-CG 4.33Å
246	S	91.3	Very high	92.8	Very high	83 Å²	83	44.6 Å²	44.6	58%	0.58	20%	0.203	S	C	*	.	H	α-helix	trans	-77.7	-17.9	-176.5	56.8	0	0	0	0	115.3	Q242 F243 F244	Q242-S246 WeakPolarHBondContact O-CB 3.31Å; Q242-S246 PolarHBondContact O-N 3.15Å; Q242-S246 PolarHBondContact O-OG 3.37Å; F243-S246 PolarHBondContact O-N 3.48Å; F243-S246 PolarHBondContact O-OG 2.87Å; F243-S246 VanDerWaalsContact O-OG 3.1Å; F244-S246 VanDerWaalsContact C-N 3.27Å; F244-S246 PolarHBondContact O-N 2.95Å
247	H	91.3	Very high	92.9	Very high	56 Å²	56	39.4 Å²	39.4	26%	0.259	18%	0.183	S	C	.	.	H	α-helix	trans	-109.2	-28.7	-177.6	-67.8	64.7	0	0	0	113.4	F243 F244 L873	F243-H247 AromaticContact CD2-CE1 3.68Å; F243-H247 HydrophobicContact CE1-CB 4.41Å; F243-H247 AromaticContact CE1-CG 3.96Å; F243-H247 AromaticContact CE2-CE1 3.45Å; F243-H247 VanDerWaalsContact CE2-CE1 3.45Å; F243-H247 WeakPolarHBondContact CE2-CE1 3.27Å; F243-H247 AromaticContact CE2-ND1 3.99Å; F243-H247 AromaticContact CE2-NE2 3.47Å; F243-H247 WeakPolarHBondContact CE2-NE2 3.16Å; F243-H247 AromaticContact CZ-CD2 3.64Å; F243-H247 AromaticContact CZ-CE1 3.8Å; F243-H247 AromaticContact CZ-CG 3.97Å; F243-H247 AromaticContact CZ-NE2 3.54Å; F243-H247 WeakPolarHBondContact O-CB 3.41Å; F243-H247 PolarHBondContact O-N 3.15Å; F243-H247 PolarHBondContact O-ND1 3.07Å; F244-H247 PolarHBondContact O-N 3.37Å; F244-H247 VanDerWaalsContact O-N 3.16Å; H247-L873 HydrophobicContact CB-CD2 4.22Å
248	F	90.4	Very high	93	Very high	15 Å²	15	39.3 Å²	39.3	7%	0.066	18%	0.183	C	C	.	.	H	α-helix	trans	-126.9	8.5	-173.4	-53.9	-65	0	0	0	114	F244 V741 K870 S871 N884	F244-F248 HydrophobicContact CD1-CB 4.47Å; F244-F248 AromaticContact CD2-CD2 3.74Å; F244-F248 HydrophobicContact CD2-CD2 3.74Å; F244-F248 HydrophobicContact CD2-CE2 4.47Å; F244-F248 HydrophobicContact CE1-CB 4.16Å; F244-F248 HydrophobicContact CE2-CB 4.3Å; F244-F248 AromaticContact CE2-CD2 3.95Å; F244-F248 HydrophobicContact CE2-CD2 3.95Å; F244-F248 HydrophobicContact CE2-CG 4.43Å; F244-F248 HydrophobicContact CG-CD2 4.2Å; F244-F248 HydrophobicContact CZ-CB 4.08Å; F244-F248 PolarHBondContact O-N 2.61Å; F248-V741 HydrophobicContact CE2-CG1 3.85Å; F248-V741 HydrophobicContact CE2-CG2 4.36Å; F248-V741 HydrophobicContact CZ-CG1 4.43Å; F248-K870 WeakPolarHBondContact CD1-O 3.42Å; F248-S871 WeakPolarHBondContact CE1-O 3.49Å; F248-N884 WeakPolarHBondContact CD1-ND2 3.48Å; F248-N884 HydrophobicContact CE2-CB 4.16Å; F248-N884 WeakPolarHBondContact CG-ND2 3.36Å; F248-N884 HydrophobicContact CZ-CB 4.18Å
249	Q	87.7	Confident	93.2	Very high	98 Å²	98	37.5 Å²	37.5	46%	0.458	18%	0.176	S	C	.	.			trans	70.6	157	-167.1	-50.4	-178.6	-33.2	0	0	113.1	F244 D245	F244-Q249 WeakPolarHBondContact CE1-O 3.26Å; D245-Q249 CarbonylContact O-C 3.58Å; D245-Q249 WeakPolarHBondContact O-CA 3.24Å; D245-Q249 PolarHBondContact O-N 3.32Å
250	P	89.8	Confident	93.2	Very high	20 Å²	20	30.3 Å²	30.3	13%	0.13	15%	0.15	C	C	.	.	P	Polyproline II helix	trans	-59.4	146.2	174.1	-24.8	35.7	0	0	0	112.3	D245 Y252 N418 D420	D245-P250 HydrophobicContact CB-CG 4.33Å; P250-Y252 PolarHBondContact O-N 2.63Å; P250-N418 HydrophobicContact CB-CB 4.26Å; P250-D420 WeakPolarHBondContact CG-OD1 3.36Å
251	F	91.2	Very high	93.2	Very high	11 Å²	11	30 Å²	30	5%	0.048	15%	0.149	C	C	.	.	P	Polyproline II helix	trans	-58.1	134.9	175.4	-176.5	-93.1	0	0	0	111.2	I254 N418 P737 Y739 Y930 I932	F251-I254 HydrophobicContact CE1-CD1 3.73Å; F251-I254 HydrophobicContact CE1-CG1 4.29Å; F251-I254 HydrophobicContact CZ-CD1 3.92Å; F251-N418 VanDerWaalsContact O-CB 3.24Å; F251-N418 WeakPolarHBondContact O-CB 3.03Å; F251-N418 PolarHBondContact O-ND2 3.42Å; F251-P737 HydrophobicContact CE2-CG 3.54Å; F251-P737 HydrophobicContact CZ-CG 3.6Å; F251-Y739 AromaticContact CD2-CE2 3.86Å; F251-Y739 HydrophobicContact CD2-CE2 3.86Å; F251-Y739 AromaticContact CE2-CE2 3.81Å; F251-Y739 HydrophobicContact CE2-CE2 3.81Å; F251-Y930 HydrophobicContact CB-CE1 4.43Å; F251-I932 HydrophobicContact CD1-CB 4.34Å; F251-I932 HydrophobicContact CD1-CD1 3.95Å; F251-I932 HydrophobicContact CE1-CD1 4.3Å
252	Y	92.2	Very high	93.1	Very high	50 Å²	50	32 Å²	32	20%	0.196	16%	0.161	C	C	.	.	P	Polyproline II helix	trans	-64	157.3	-172.8	50	-97.7	0	0	0	113.5	P250 I254 M415 V416	P250-Y252 PolarHBondContact O-N 2.63Å; Y252-I254 HydrophobicContact CD2-CD1 4.22Å; Y252-I254 HydrophobicContact CD2-CG1 3.73Å; Y252-I254 HydrophobicContact CE2-CD1 3.75Å; Y252-I254 HydrophobicContact CE2-CG1 3.73Å; Y252-M415 HydrophobicContact CD2-CB 4.14Å; Y252-M415 HydrophobicContact CD2-CG 4.13Å; Y252-M415 HydrophobicContact CD2-SD 3.54Å; Y252-M415 VanDerWaalsContact CD2-SD 3.54Å; Y252-M415 HydrophobicContact CE2-CE 3.87Å; Y252-M415 HydrophobicContact CE2-CG 4.17Å; Y252-M415 HydrophobicContact CE2-SD 3.3Å; Y252-M415 WeakPolarHBondContact CE2-SD 3.34Å; Y252-M415 HydrophobicContact CG-CB 4.46Å; Y252-V416 WeakPolarHBondContact CB-O 3.39Å
253	R	94	Very high	93.1	Very high	25 Å²	25	31 Å²	31	9%	0.094	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	146.9	174.2	-53.7	178.7	66.2	73.8	3.9	108.8	V416 N418 E432 E454	R253-V416 HydrophobicContact CB-CB 4.05Å; R253-V416 HydrophobicContact CB-CG1 4.26Å; R253-V416 PolarHBondContact N-O 2.77Å; R253-V416 PolarHBondContact O-N 2.89Å; R253-N418 HydrophobicContact CG-CB 3.9Å; R253-E432 IonicContact CZ-OE1 2.66Å; R253-E432 IonicContact CZ-OE2 3.51Å; R253-E432 IonicContact NE-OE1 2.85Å; R253-E432 PolarHBondContact NE-OE1 3.38Å; R253-E432 IonicContact NE-OE2 3.45Å; R253-E432 VanDerWaalsContact NH2-CD 3.25Å; R253-E432 IonicContact NH2-OE1 2.84Å; R253-E432 PolarHBondContact NH2-OE1 2.88Å; R253-E432 IonicContact NH2-OE2 3.85Å; R253-E432 PolarHBondContact NH2-OE2 3.16Å; R253-E454 HydrophobicContact CB-CB 4.07Å; R253-E454 HydrophobicContact CB-CG 4.44Å
254	I	93.5	Very high	92.7	Very high	34 Å²	34	33.1 Å²	33.1	17%	0.174	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	110.7	-168.3	-60.9	-175.9	0	0	0	110.5	F251 Y252 Q256 T413 M415	F251-I254 HydrophobicContact CE1-CD1 3.73Å; F251-I254 HydrophobicContact CE1-CG1 4.29Å; F251-I254 HydrophobicContact CZ-CD1 3.92Å; Y252-I254 HydrophobicContact CD2-CD1 4.22Å; Y252-I254 HydrophobicContact CD2-CG1 3.73Å; Y252-I254 HydrophobicContact CE2-CD1 3.75Å; Y252-I254 HydrophobicContact CE2-CG1 3.73Å; I254-Q256 HydrophobicContact CG2-CB 4.2Å; I254-T413 HydrophobicContact CG2-CG2 3.62Å; I254-M415 HydrophobicContact CG1-SD 4.12Å
255	E	96.1	Very high	92.6	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	102.9	172.9	-73.6	61.4	-119.4	0	0	108.3	Y414 V416 W431 E432 F435 K452 A453 E454	E255-Y414 PolarHBondContact N-O 2.94Å; E255-Y414 VanDerWaalsContact N-O 3.16Å; E255-Y414 PolarHBondContact O-N 3.11Å; E255-V416 WeakPolarHBondContact OE2-CG2 3.37Å; E255-W431 HydrophobicContact CG-CZ3 4.12Å; E255-E432 HydrophobicContact CG-CG 4.18Å; E255-F435 HydrophobicContact CB-CE1 4.03Å; E255-F435 HydrophobicContact CB-CZ 4.18Å; E255-F435 HydrophobicContact CG-CD1 4.19Å; E255-F435 HydrophobicContact CG-CE1 4.12Å; E255-K452 CarbonylContact C-O 3.59Å; E255-K452 WeakPolarHBondContact CA-O 3.47Å; E255-A453 HydrophobicContact CG-CB 3.8Å; E255-E454 PolarHBondContact OE1-N 2.79Å
256	Q	95.5	Very high	92.4	Very high	22 Å²	22	37.1 Å²	37.1	10%	0.103	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	135.5	-172.2	-176	167.9	92.3	0	0	111.7	I254 V411 V412 T413 F451 K452 Y724	I254-Q256 HydrophobicContact CG2-CB 4.2Å; Q256-V411 HydrophobicContact CG-CG1 3.84Å; Q256-V412 CarbonylContact C-O 3.31Å; Q256-V412 WeakPolarHBondContact CA-O 3.47Å; Q256-T413 HydrophobicContact CB-CG2 4.26Å; Q256-T413 PolarHBondContact NE2-OG1 2.94Å; Q256-F451 CarbonylContact O-C 3.16Å; Q256-F451 VanDerWaalsContact O-CA 3.26Å; Q256-F451 WeakPolarHBondContact O-CA 3.4Å; Q256-K452 PolarHBondContact N-O 3.44Å; Q256-K452 PolarHBondContact O-N 3.44Å; Q256-Y724 PolarHBondContact OE1-OH 3.3Å
257	L	96.4	Very high	92.4	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.005	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	127.2	172.6	-54.2	83.9	0	0	0	109	I259 L295 I299 V411 V412 Y414 F435 V439 I449 F451	L257-I259 HydrophobicContact CB-CD1 4.4Å; L257-I259 HydrophobicContact CB-CG1 4.08Å; L257-L295 HydrophobicContact CD2-CD2 4.4Å; L257-I299 HydrophobicContact CD2-CD1 3.86Å; L257-V411 WeakPolarHBondContact O-CA 3.24Å; L257-V412 HydrophobicContact CB-CB 4.44Å; L257-V412 HydrophobicContact CD1-CB 4.31Å; L257-V412 HydrophobicContact CD1-CG1 4.44Å; L257-V412 PolarHBondContact N-O 2.82Å; L257-V412 PolarHBondContact O-N 3Å; L257-Y414 HydrophobicContact CD1-CD2 4.04Å; L257-Y414 HydrophobicContact CD1-CE2 3.67Å; L257-F435 HydrophobicContact CD1-CE2 3.92Å; L257-F435 HydrophobicContact CD1-CZ 3.71Å; L257-F435 HydrophobicContact CD2-CE2 4.45Å; L257-F435 HydrophobicContact CD2-CZ 4.47Å; L257-F435 HydrophobicContact CG-CE2 4.46Å; L257-F435 HydrophobicContact CG-CZ 4.09Å; L257-V439 HydrophobicContact CD2-CG1 4.29Å; L257-V439 HydrophobicContact CD2-CG2 4.23Å; L257-I449 HydrophobicContact CB-CG2 4.38Å; L257-I449 HydrophobicContact CD2-CG2 4.05Å; L257-F451 HydrophobicContact CG-CB 4.24Å
258	I	96	Very high	92.3	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	109	169.4	-52.7	168.9	0	0	0	106.1	V260 A409 S450 Y724 A727 F728 Y731 L732	I258-V260 HydrophobicContact CG2-CG2 4.39Å; I258-A409 HydrophobicContact CG2-CB 4.18Å; I258-S450 PolarHBondContact N-O 2.96Å; I258-S450 PolarHBondContact O-N 3.13Å; I258-Y724 HydrophobicContact CD1-CD2 4.17Å; I258-Y724 HydrophobicContact CD1-CE2 4.01Å; I258-Y724 HydrophobicContact CG1-CE2 4.45Å; I258-A727 HydrophobicContact CB-CB 4.25Å; I258-A727 HydrophobicContact CD1-CB 3.84Å; I258-A727 HydrophobicContact CG2-CB 4.12Å; I258-F728 HydrophobicContact CD1-CB 4.24Å; I258-Y731 HydrophobicContact CG2-CD2 4.09Å; I258-L732 HydrophobicContact CD1-CD1 3.56Å; I258-L732 HydrophobicContact CG1-CD1 3.84Å
259	I	96.1	Very high	92.1	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.005	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	125.3	-173.4	-49	172.4	0	0	0	108.9	L257 F288 V292 L295 L410 V412 M447 T448 I449	L257-I259 HydrophobicContact CB-CD1 4.4Å; L257-I259 HydrophobicContact CB-CG1 4.08Å; I259-F288 HydrophobicContact CB-CZ 4.4Å; I259-F288 HydrophobicContact CG2-CE2 4.01Å; I259-F288 HydrophobicContact CG2-CZ 3.77Å; I259-V292 HydrophobicContact CD1-CG1 3.76Å; I259-V292 HydrophobicContact CD1-CG2 4.13Å; I259-V292 HydrophobicContact CG2-CG2 3.96Å; I259-L295 HydrophobicContact CD1-CD2 3.88Å; I259-L410 PolarHBondContact N-O 3.32Å; I259-L410 PolarHBondContact O-N 2.67Å; I259-V412 HydrophobicContact CD1-CG2 3.98Å; I259-M447 HydrophobicContact CG2-CB 3.99Å; I259-M447 HydrophobicContact CG2-CG 4.38Å; I259-M447 HydrophobicContact CG2-SD 3.63Å; I259-T448 WeakPolarHBondContact CA-O 3.12Å; I259-I449 HydrophobicContact CG1-CG1 4.48Å; I259-I449 HydrophobicContact CG2-CG1 4.26Å
260	V	95.1	Very high	92	Very high	9 Å²	9	36.9 Å²	36.9	6%	0.055	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	122.1	-171.3	-176.8	0	0	0	0	109.4	I258 N262 A409 M447 T448 Y731	I258-V260 HydrophobicContact CG2-CG2 4.39Å; V260-N262 PolarHBondContact O-N 3.09Å; V260-A409 HydrophobicContact CG2-CB 4.01Å; V260-M447 CarbonylContact O-C 3.03Å; V260-M447 WeakPolarHBondContact O-CA 3.45Å; V260-T448 PolarHBondContact N-O 3.49Å; V260-T448 PolarHBondContact O-N 3.32Å; V260-T448 PolarHBondContact O-OG1 3.22Å; V260-Y731 HydrophobicContact CG2-CD2 4.06Å; V260-Y731 HydrophobicContact CG2-CE2 3.56Å
261	P	94.9	Very high	91.7	Very high	4 Å²	4	36 Å²	36	3%	0.026	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	132.5	174.4	25	-31	0	0	0	110.5	N263 Q264 P282 V283 F288 T408	P261-N263 PolarHBondContact O-N 3.22Å; P261-Q264 PolarHBondContact O-NE2 2.93Å; P261-P282 HydrophobicContact CB-CB 4.38Å; P261-P282 HydrophobicContact CG-CB 3.68Å; P261-P282 HydrophobicContact CG-CG 3.89Å; P261-V283 HydrophobicContact CG-CG2 4.29Å; P261-F288 HydrophobicContact CB-CD2 3.7Å; P261-F288 HydrophobicContact CB-CE2 3.66Å; P261-F288 HydrophobicContact CB-CG 4.32Å; P261-F288 HydrophobicContact CB-CZ 4.27Å; P261-F288 HydrophobicContact CG-CE2 4.21Å; P261-F288 HydrophobicContact CG-CZ 4.33Å; P261-T408 WeakPolarHBondContact CD-O 3.39Å
262	N	91.6	Very high	91.2	Very high	79 Å²	79	36.7 Å²	36.7	42%	0.422	20%	0.199	S	C	.	.	S	Bend	trans	-66.5	-29.1	179.9	-68.6	-22.6	0	0	0	111.7	V260 Q264 P445 N446 M447 T448	V260-N262 PolarHBondContact O-N 3.09Å; N262-Q264 PolarHBondContact O-N 3.47Å; N262-P445 PolarHBondContact ND2-O 3.29Å; N262-N446 PolarHBondContact N-O 3.37Å; N262-M447 PolarHBondContact ND2-N 3.35Å; N262-M447 PolarHBondContact ND2-O 3.03Å; N262-T448 WeakPolarHBondContact OD1-CG2 3.39Å; N262-T448 PolarHBondContact OD1-N 3.11Å; N262-T448 PolarHBondContact OD1-OG1 3.21Å
263	N	91.3	Very high	90.3	Very high	84 Å²	84	38.8 Å²	38.8	45%	0.449	21%	0.212	S	C	.	.			trans	-87.1	92	168.1	-179	7.6	0	0	0	110.7	P261 S265 P282	P261-N263 PolarHBondContact O-N 3.22Å; N263-S265 PolarHBondContact ND2-OG 3.38Å; N263-S265 PolarHBondContact O-N 2.99Å; N263-S265 WeakPolarHBondContact OD1-CB 3.49Å; N263-S265 PolarHBondContact OD1-N 2.81Å; N263-S265 VanDerWaalsContact OD1-N 3.15Å; N263-S265 PolarHBondContact OD1-OG 2.74Å; N263-P282 WeakPolarHBondContact O-CB 3.19Å
264	Q	87	Confident	89.3	Confident	79 Å²	79	41.1 Å²	41.1	37%	0.369	23%	0.226	S	C	.	.			trans	-76.7	9.5	179.4	-72.7	-74.8	-62.3	0	0	115	P261 N262 A266 T408	P261-Q264 PolarHBondContact O-NE2 2.93Å; N262-Q264 PolarHBondContact O-N 3.47Å; Q264-A266 PolarHBondContact O-N 3.35Å; Q264-T408 PolarHBondContact NE2-O 3.47Å
265	S	91	Very high	88.4	Confident	57 Å²	57	43.8 Å²	43.8	40%	0.399	25%	0.248	S	C	.	.			trans	-74.7	124.2	174.4	61	0	0	0	0	111.6	N263 R285	N263-S265 PolarHBondContact ND2-OG 3.38Å; N263-S265 PolarHBondContact O-N 2.99Å; N263-S265 WeakPolarHBondContact OD1-CB 3.49Å; N263-S265 PolarHBondContact OD1-N 2.81Å; N263-S265 VanDerWaalsContact OD1-N 3.15Å; N263-S265 PolarHBondContact OD1-OG 2.74Å; S265-R285 PolarHBondContact O-NH2 3.5Å; S265-R285 PolarHBondContact OG-NH2 2.91Å; S265-R285 VanDerWaalsContact OG-NH2 3.1Å
266	A	89	Confident	87.4	Confident	51 Å²	51	45.2 Å²	45.2	42%	0.421	26%	0.26	S	S	.	.			trans	-61.4	156.1	163.5	0	0	0	0	0	110.5	Q264 L279 L280	Q264-A266 PolarHBondContact O-N 3.35Å; A266-L279 HydrophobicContact CB-CD1 3.85Å; A266-L279 HydrophobicContact CB-CG 4.2Å; A266-L280 CarbonylContact C-O 3.21Å; A266-L280 VanDerWaalsContact CA-O 3.24Å; A266-L280 WeakPolarHBondContact CA-O 3.36Å; A266-L280 WeakPolarHBondContact CB-O 2.98Å
267	F	91.3	Very high	86.8	Confident	41 Å²	41	50.4 Å²	50.4	18%	0.18	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	144.2	-179	66.4	-76.7	0	0	0	111.5	A269 L280 G281 F284 R285 W358	F267-A269 HydrophobicContact CD2-CB 4.2Å; F267-A269 HydrophobicContact CE2-CB 3.96Å; F267-L280 HydrophobicContact CD1-CB 4.14Å; F267-L280 WeakPolarHBondContact CD1-O 3.3Å; F267-L280 HydrophobicContact CE1-CB 3.65Å; F267-L280 HydrophobicContact CE2-CB 4.13Å; F267-L280 HydrophobicContact CE2-CD1 3.89Å; F267-L280 HydrophobicContact CZ-CB 3.65Å; F267-L280 HydrophobicContact CZ-CD1 3.7Å; F267-L280 HydrophobicContact CZ-CG 4.32Å; F267-L280 PolarHBondContact N-O 2.99Å; F267-L280 PolarHBondContact O-N 2.86Å; F267-G281 WeakPolarHBondContact CE1-O 3.4Å; F267-F284 HydrophobicContact CE1-CB 4.45Å; F267-F284 HydrophobicContact CZ-CB 4.33Å; F267-F284 WeakPolarHBondContact CZ-O 3.17Å; F267-R285 HydrophobicContact CD1-CG 3.83Å; F267-R285 HydrophobicContact CE1-CB 4.43Å; F267-R285 HydrophobicContact CE1-CG 3.53Å; F267-R285 HydrophobicContact CZ-CG 4.18Å; F267-W358 HydrophobicContact CZ-CH2 4.48Å
268	E	89.3	Confident	86.2	Confident	123 Å²	123	51.3 Å²	51.3	58%	0.575	29%	0.287	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.1	123.8	173.3	-168.9	-174.7	-128	0	0	108.4	K277	E268-K277 HydrophobicContact CG-CB 4.21Å; E268-K277 HydrophobicContact CG-CD 3.89Å; E268-K277 WeakPolarHBondContact OE1-CD 3.24Å; E268-K277 IonicContact OE1-NZ 3.14Å; E268-K277 PolarHBondContact OE1-NZ 3.5Å; E268-K277 WeakPolarHBondContact OE2-CD 3.1Å; E268-K277 IonicContact OE2-NZ 2.67Å; E268-K277 PolarHBondContact OE2-NZ 3.36Å
269	A	85.8	Confident	85.8	Confident	11 Å²	11	57 Å²	57	9%	0.091	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	149.1	174.9	0	0	0	0	0	109.8	F267 K277 I278 L280 I359	F267-A269 HydrophobicContact CD2-CB 4.2Å; F267-A269 HydrophobicContact CE2-CB 3.96Å; A269-K277 WeakPolarHBondContact O-CA 3.24Å; A269-I278 PolarHBondContact N-O 3.11Å; A269-I278 PolarHBondContact O-N 2.61Å; A269-L280 HydrophobicContact CB-CD1 3.76Å; A269-L280 HydrophobicContact CB-CG 4.33Å; A269-I359 HydrophobicContact CB-CD1 3.93Å
270	T	85.4	Confident	85.5	Confident	73 Å²	73	57 Å²	57	45%	0.448	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	123.6	175.8	-50.9	0	0	0	0	108.7	A276	T270-A276 WeakPolarHBondContact CA-O 3.38Å
271	D	82.3	Confident	85.4	Confident	1 Å²	1	56.6 Å²	56.6	1%	0.005	32%	0.315	C	S	.	.			trans	-74.7	122.9	171.2	-171.3	-21.4	0	0	0	108.5	M273 S275 A276 I278 I359 S360 R363	D271-M273 PolarHBondContact O-N 2.86Å; D271-M273 WeakPolarHBondContact OD1-CB 3.28Å; D271-M273 PolarHBondContact OD1-N 2.9Å; D271-M273 VanDerWaalsContact OD1-N 3.11Å; D271-S275 WeakPolarHBondContact O-CA 3.37Å; D271-S275 PolarHBondContact O-N 2.75Å; D271-A276 PolarHBondContact N-O 3.33Å; D271-I278 HydrophobicContact CB-CD1 4.03Å; D271-I359 HydrophobicContact CB-CG2 4.37Å; D271-S360 WeakPolarHBondContact OD1-CB 3.36Å; D271-S360 PolarHBondContact OD1-OG 2.97Å; D271-R363 WeakPolarHBondContact OD2-CD 3.41Å; D271-R363 IonicContact OD2-CZ 2.66Å; D271-R363 IonicContact OD2-NE 3.13Å; D271-R363 IonicContact OD2-NH1 2.73Å; D271-R363 PolarHBondContact OD2-NH1 3.48Å
272	P	80.9	Confident	85.3	Confident	25 Å²	25	56.5 Å²	56.5	16%	0.162	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-23.9	-179.4	24.9	-35.3	0	0	0	113.6	L354 N357	P272-L354 HydrophobicContact CB-CD2 4.02Å; P272-L354 HydrophobicContact CB-CG 3.92Å; P272-L354 WeakPolarHBondContact CB-O 3.33Å; P272-L354 HydrophobicContact CG-CD2 4.12Å; P272-L354 HydrophobicContact CG-CG 4.15Å; P272-N357 HydrophobicContact CG-CB 4.39Å
273	M	74.2	Confident	85.3	Confident	94 Å²	94	52.8 Å²	52.8	46%	0.463	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-43.7	-171.8	-169	-177.2	75.1	0	0	113.3	D271 I355	D271-M273 PolarHBondContact O-N 2.86Å; D271-M273 WeakPolarHBondContact OD1-CB 3.28Å; D271-M273 PolarHBondContact OD1-N 2.9Å; D271-M273 VanDerWaalsContact OD1-N 3.11Å; M273-I355 WeakPolarHBondContact CA-O 3.26Å; M273-I355 PolarHBondContact N-O 3.44Å
274	D	73.1	Confident	85.4	Confident	74 Å²	74	48.8 Å²	48.8	40%	0.396	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.4	2.1	179.7	65.1	-10.2	0	0	0	113.4	A276 R363	D274-A276 VanDerWaalsContact CG-CB 3.41Å; D274-A276 PolarHBondContact O-N 3.47Å; D274-A276 VanDerWaalsContact O-N 3.12Å; D274-A276 WeakPolarHBondContact OD1-CB 3.31Å; D274-A276 PolarHBondContact OD1-N 2.87Å; D274-A276 VanDerWaalsContact OD2-CB 3.28Å; D274-A276 WeakPolarHBondContact OD2-CB 3.26Å; D274-R363 IonicContact OD1-CZ 2.67Å; D274-R363 IonicContact OD1-NH1 3.33Å; D274-R363 PolarHBondContact OD1-NH1 3.4Å; D274-R363 IonicContact OD1-NH2 2.88Å; D274-R363 IonicContact OD2-CZ 2.71Å; D274-R363 VanDerWaalsContact OD2-CZ 3.25Å; D274-R363 IonicContact OD2-NH1 3.54Å; D274-R363 PolarHBondContact OD2-NH1 3.41Å; D274-R363 IonicContact OD2-NH2 2.8Å; D274-R363 PolarHBondContact OD2-NH2 3.04Å
275	S	74	Confident	85.7	Confident	90 Å²	90	47.8 Å²	47.8	63%	0.629	27%	0.265	S	S	*	.			trans	55	18.4	-169.5	-62.3	0	0	0	0	114.2	D271	D271-S275 WeakPolarHBondContact O-CA 3.37Å; D271-S275 PolarHBondContact O-N 2.75Å
276	A	75.4	Confident	85.6	Confident	30 Å²	30	47.5 Å²	47.5	25%	0.248	26%	0.257	C	S	.	.			trans	-71.1	140.1	177.2	0	0	0	0	0	110.5	T270 D271 D274	T270-A276 WeakPolarHBondContact CA-O 3.38Å; D271-A276 PolarHBondContact N-O 3.33Å; D274-A276 VanDerWaalsContact CG-CB 3.41Å; D274-A276 PolarHBondContact O-N 3.47Å; D274-A276 VanDerWaalsContact O-N 3.12Å; D274-A276 WeakPolarHBondContact OD1-CB 3.31Å; D274-A276 PolarHBondContact OD1-N 2.87Å; D274-A276 VanDerWaalsContact OD2-CB 3.28Å; D274-A276 WeakPolarHBondContact OD2-CB 3.26Å
277	K	82.3	Confident	85.7	Confident	131 Å²	131	51.6 Å²	51.6	57%	0.57	27%	0.267	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.5	119.5	172.6	-64.5	-149.9	-175.4	-175.7	0	110	E268 A269	E268-K277 HydrophobicContact CG-CB 4.21Å; E268-K277 HydrophobicContact CG-CD 3.89Å; E268-K277 WeakPolarHBondContact OE1-CD 3.24Å; E268-K277 IonicContact OE1-NZ 3.14Å; E268-K277 PolarHBondContact OE1-NZ 3.5Å; E268-K277 WeakPolarHBondContact OE2-CD 3.1Å; E268-K277 IonicContact OE2-NZ 2.67Å; E268-K277 PolarHBondContact OE2-NZ 3.36Å; A269-K277 WeakPolarHBondContact O-CA 3.24Å
278	I	83.5	Confident	85.9	Confident	21 Å²	21	50 Å²	50	11%	0.108	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	131.5	-177.8	-52.6	177.1	0	0	0	108.1	A269 D271 L280 I359 R363 F405	A269-I278 PolarHBondContact N-O 3.11Å; A269-I278 PolarHBondContact O-N 2.61Å; D271-I278 HydrophobicContact CB-CD1 4.03Å; I278-L280 HydrophobicContact CG2-CD2 3.84Å; I278-L280 HydrophobicContact CG2-CG 4.28Å; I278-L280 PolarHBondContact O-N 3.25Å; I278-I359 HydrophobicContact CD1-CG2 4.45Å; I278-R363 HydrophobicContact CD1-CG 4.41Å; I278-F405 HydrophobicContact CG2-CD1 4.41Å; I278-F405 HydrophobicContact CG2-CG 4.49Å
279	L	88.5	Confident	86.1	Confident	118 Å²	118	44.2 Å²	44.2	62%	0.618	23%	0.233	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-83.8	110.2	170.3	-176.2	65.4	0	0	0	108.5	A266	A266-L279 HydrophobicContact CB-CD1 3.85Å; A266-L279 HydrophobicContact CB-CG 4.2Å
280	L	90.4	Very high	86.4	Confident	1 Å²	1	46.1 Å²	46.1	1%	0.005	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	134.8	179.3	-67	179.6	0	0	0	111.2	A266 F267 A269 I278 F284 W358 F405	A266-L280 CarbonylContact C-O 3.21Å; A266-L280 VanDerWaalsContact CA-O 3.24Å; A266-L280 WeakPolarHBondContact CA-O 3.36Å; A266-L280 WeakPolarHBondContact CB-O 2.98Å; F267-L280 HydrophobicContact CD1-CB 4.14Å; F267-L280 WeakPolarHBondContact CD1-O 3.3Å; F267-L280 HydrophobicContact CE1-CB 3.65Å; F267-L280 HydrophobicContact CE2-CB 4.13Å; F267-L280 HydrophobicContact CE2-CD1 3.89Å; F267-L280 HydrophobicContact CZ-CB 3.65Å; F267-L280 HydrophobicContact CZ-CD1 3.7Å; F267-L280 HydrophobicContact CZ-CG 4.32Å; F267-L280 PolarHBondContact N-O 2.99Å; F267-L280 PolarHBondContact O-N 2.86Å; A269-L280 HydrophobicContact CB-CD1 3.76Å; A269-L280 HydrophobicContact CB-CG 4.33Å; I278-L280 HydrophobicContact CG2-CD2 3.84Å; I278-L280 HydrophobicContact CG2-CG 4.28Å; I278-L280 PolarHBondContact O-N 3.25Å; L280-F284 HydrophobicContact CB-CB 4.3Å; L280-F284 HydrophobicContact CB-CD2 4.4Å; L280-F284 HydrophobicContact CD1-CB 4.26Å; L280-F284 HydrophobicContact CD2-CD2 4.22Å; L280-W358 HydrophobicContact CD1-CH2 4.07Å; L280-F405 HydrophobicContact CD2-CB 4.27Å; L280-F405 HydrophobicContact CD2-CD1 3.82Å; L280-F405 HydrophobicContact CD2-CG 4.5Å
281	G	91.4	Very high	86.8	Confident	2 Å²	2	44 Å²	44	2%	0.021	23%	0.226	C	C	.	.			trans	-62.5	156.4	169.9	0	0	0	0	0	111.8	F267 V283 F284 F405 S407	F267-G281 WeakPolarHBondContact CE1-O 3.4Å; G281-V283 PolarHBondContact O-N 3.38Å; G281-F284 PolarHBondContact O-N 3.28Å; G281-F284 VanDerWaalsContact O-N 3.08Å; G281-F405 PolarHBondContact N-O 3.32Å; G281-S407 CarbonylContact C-O 3.56Å; G281-S407 WeakPolarHBondContact CA-O 3.45Å
282	P	92.8	Very high	87.4	Confident	2 Å²	2	44 Å²	44	1%	0.013	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-62.6	-19.2	-168.8	27.5	-37.9	0	0	0	114.2	P261 N263 F284 R285 S407	P261-P282 HydrophobicContact CB-CB 4.38Å; P261-P282 HydrophobicContact CG-CB 3.68Å; P261-P282 HydrophobicContact CG-CG 3.89Å; N263-P282 WeakPolarHBondContact O-CB 3.19Å; P282-F284 VanDerWaalsContact C-N 3.3Å; P282-F284 PolarHBondContact O-N 2.94Å; P282-R285 WeakPolarHBondContact O-CG 3.39Å; P282-S407 WeakPolarHBondContact CD-O 3.32Å
283	V	93	Very high	88.1	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-62.6	-33.4	175.5	166.9	0	0	0	0	112.7	P261 G281 R285 F288 L289 L396 T408 A409 L410	P261-V283 HydrophobicContact CG-CG2 4.29Å; G281-V283 PolarHBondContact O-N 3.38Å; V283-R285 PolarHBondContact O-N 3.19Å; V283-F288 HydrophobicContact CB-CE1 4.47Å; V283-F288 HydrophobicContact CG1-CE1 4.23Å; V283-F288 WeakPolarHBondContact O-CD1 3.25Å; V283-L289 WeakPolarHBondContact O-CD2 3.43Å; V283-L396 HydrophobicContact CG1-CD2 4.04Å; V283-T408 VanDerWaalsContact CG2-C 3.44Å; V283-A409 VanDerWaalsContact CG2-C 3.42Å; V283-L410 HydrophobicContact CG1-CB 3.87Å; V283-L410 HydrophobicContact CG1-CD1 3.98Å; V283-L410 HydrophobicContact CG1-CG 4.33Å
284	F	93	Very high	89	Confident	0 Å²	0	44 Å²	44	0%	0	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-85	11.8	-174.5	-55.8	-62.7	0	0	0	113.4	F267 L280 G281 P282 K286 W358 L362 L366 L396 Y404 F405	F267-F284 HydrophobicContact CE1-CB 4.45Å; F267-F284 HydrophobicContact CZ-CB 4.33Å; F267-F284 WeakPolarHBondContact CZ-O 3.17Å; L280-F284 HydrophobicContact CB-CB 4.3Å; L280-F284 HydrophobicContact CB-CD2 4.4Å; L280-F284 HydrophobicContact CD1-CB 4.26Å; L280-F284 HydrophobicContact CD2-CD2 4.22Å; G281-F284 PolarHBondContact O-N 3.28Å; G281-F284 VanDerWaalsContact O-N 3.08Å; P282-F284 VanDerWaalsContact C-N 3.3Å; P282-F284 PolarHBondContact O-N 2.94Å; F284-K286 PolarHBondContact O-N 2.85Å; F284-W358 HydrophobicContact CB-CZ3 4.32Å; F284-W358 WeakPolarHBondContact O-CH2 3.41Å; F284-W358 WeakPolarHBondContact O-CZ3 3.36Å; F284-L362 HydrophobicContact CB-CD2 4.31Å; F284-L362 HydrophobicContact CD1-CD1 4.34Å; F284-L362 HydrophobicContact CD1-CD2 3.44Å; F284-L362 VanDerWaalsContact CD1-CD2 3.44Å; F284-L362 HydrophobicContact CD1-CG 4.47Å; F284-L362 HydrophobicContact CE1-CD1 4.09Å; F284-L362 HydrophobicContact CE1-CD2 3.87Å; F284-L362 HydrophobicContact CE1-CG 4.49Å; F284-L362 HydrophobicContact CG-CD2 3.93Å; F284-L366 HydrophobicContact CE1-CD1 4.24Å; F284-L366 HydrophobicContact CZ-CD1 4Å; F284-L396 HydrophobicContact CE1-CD1 4.35Å; F284-L396 HydrophobicContact CE1-CD2 3.94Å; F284-L396 HydrophobicContact CZ-CD1 3.8Å; F284-L396 HydrophobicContact CZ-CD2 3.75Å; F284-L396 HydrophobicContact CZ-CG 4.46Å; F284-Y404 WeakPolarHBondContact CE2-O 2.79Å; F284-F405 WeakPolarHBondContact CE2-O 3.15Å
285	R	92	Very high	90	Very high	59 Å²	59	40.6 Å²	40.6	22%	0.223	21%	0.205	C	C	.	.			trans	-66	120.7	172.1	-69.3	175.6	178.1	-77	-4.5	108.6	S265 F267 P282 V283 E287 F288 L289	S265-R285 PolarHBondContact O-NH2 3.5Å; S265-R285 PolarHBondContact OG-NH2 2.91Å; S265-R285 VanDerWaalsContact OG-NH2 3.1Å; F267-R285 HydrophobicContact CD1-CG 3.83Å; F267-R285 HydrophobicContact CE1-CB 4.43Å; F267-R285 HydrophobicContact CE1-CG 3.53Å; F267-R285 HydrophobicContact CZ-CG 4.18Å; P282-R285 WeakPolarHBondContact O-CG 3.39Å; V283-R285 PolarHBondContact O-N 3.19Å; R285-E287 VanDerWaalsContact C-N 3.26Å; R285-E287 PolarHBondContact O-N 2.89Å; R285-F288 HydrophobicContact CB-CB 4.2Å; R285-F288 WeakPolarHBondContact O-CA 3.45Å; R285-F288 WeakPolarHBondContact O-CB 3.27Å; R285-F288 PolarHBondContact O-N 3.07Å; R285-L289 PolarHBondContact O-N 3.33Å
286	K	90.6	Very high	91	Very high	50 Å²	50	36.7 Å²	36.7	22%	0.217	18%	0.177	C	C	.	.	H	α-helix	trans	-52	-42.6	-175.4	-165.4	179.4	-177.8	-172.3	0	113.2	F284 F288 L289 Q290 L344 D345 W358	F284-K286 PolarHBondContact O-N 2.85Å; K286-F288 VanDerWaalsContact C-N 3.35Å; K286-F288 PolarHBondContact O-N 3.49Å; K286-L289 PolarHBondContact O-N 3.35Å; K286-L289 VanDerWaalsContact O-N 3.15Å; K286-Q290 WeakPolarHBondContact O-CG 3.21Å; K286-Q290 PolarHBondContact O-N 2.95Å; K286-L344 WeakPolarHBondContact CE-O 3.47Å; K286-D345 WeakPolarHBondContact CE-OD1 3.19Å; K286-D345 IonicContact NZ-OD1 3.18Å; K286-D345 PolarHBondContact NZ-OD1 3.44Å; K286-W358 HydrophobicContact CB-CZ2 4.35Å
287	E	91.3	Very high	91.9	Very high	137 Å²	137	39 Å²	39	64%	0.64	18%	0.183	S	C	*	.	H	α-helix	trans	-55	-44.8	173.5	-60.9	169.9	168.2	0	0	112.5	R285 Q290 D291	R285-E287 VanDerWaalsContact C-N 3.26Å; R285-E287 PolarHBondContact O-N 2.89Å; E287-Q290 PolarHBondContact O-N 3.43Å; E287-D291 VanDerWaalsContact O-CG 3.23Å; E287-D291 PolarHBondContact O-N 2.93Å
288	F	93.7	Very high	92.4	Very high	8 Å²	8	34.7 Å²	34.7	4%	0.035	17%	0.168	C	C	.	.	H	α-helix	trans	-70.9	-34.5	177.7	172.6	-88.2	0	0	0	112	I259 P261 V283 R285 K286 Q290 D291 V292 L410 M447	I259-F288 HydrophobicContact CB-CZ 4.4Å; I259-F288 HydrophobicContact CG2-CE2 4.01Å; I259-F288 HydrophobicContact CG2-CZ 3.77Å; P261-F288 HydrophobicContact CB-CD2 3.7Å; P261-F288 HydrophobicContact CB-CE2 3.66Å; P261-F288 HydrophobicContact CB-CG 4.32Å; P261-F288 HydrophobicContact CB-CZ 4.27Å; P261-F288 HydrophobicContact CG-CE2 4.21Å; P261-F288 HydrophobicContact CG-CZ 4.33Å; V283-F288 HydrophobicContact CB-CE1 4.47Å; V283-F288 HydrophobicContact CG1-CE1 4.23Å; V283-F288 WeakPolarHBondContact O-CD1 3.25Å; R285-F288 HydrophobicContact CB-CB 4.2Å; R285-F288 WeakPolarHBondContact O-CA 3.45Å; R285-F288 WeakPolarHBondContact O-CB 3.27Å; R285-F288 PolarHBondContact O-N 3.07Å; K286-F288 VanDerWaalsContact C-N 3.35Å; K286-F288 PolarHBondContact O-N 3.49Å; F288-Q290 VanDerWaalsContact C-N 3.34Å; F288-D291 PolarHBondContact O-N 2.79Å; F288-V292 HydrophobicContact CD1-CG2 4.19Å; F288-V292 HydrophobicContact CE1-CG2 3.84Å; F288-V292 HydrophobicContact CE2-CG2 4.2Å; F288-V292 HydrophobicContact CZ-CG2 3.86Å; F288-V292 WeakPolarHBondContact O-CB 3.24Å; F288-V292 VanDerWaalsContact O-CG2 3.28Å; F288-V292 WeakPolarHBondContact O-CG2 3.37Å; F288-V292 PolarHBondContact O-N 2.72Å; F288-L410 HydrophobicContact CE1-CB 4.35Å; F288-L410 HydrophobicContact CE1-CD1 4.37Å; F288-M447 HydrophobicContact CD2-CB 4.31Å; F288-M447 HydrophobicContact CE2-CB 3.79Å
289	L	93.6	Very high	93	Very high	1 Å²	1	33.7 Å²	33.7	1%	0.005	16%	0.164	C	C	.	.	H	α-helix	trans	-66.5	-37.2	173.8	-65.2	176.8	0	0	0	111.6	V283 R285 K286 L293 L334 L344 W358 L410	V283-L289 WeakPolarHBondContact O-CD2 3.43Å; R285-L289 PolarHBondContact O-N 3.33Å; K286-L289 PolarHBondContact O-N 3.35Å; K286-L289 VanDerWaalsContact O-N 3.15Å; L289-L293 VanDerWaalsContact O-CB 3.32Å; L289-L293 WeakPolarHBondContact O-CB 3.29Å; L289-L293 PolarHBondContact O-N 2.88Å; L289-L334 HydrophobicContact CB-CD2 4.23Å; L289-L334 HydrophobicContact CD2-CD2 4.32Å; L289-L344 HydrophobicContact CB-CD2 3.93Å; L289-L344 HydrophobicContact CD1-CD1 4.25Å; L289-W358 HydrophobicContact CD1-CZ3 4.44Å; L289-L410 HydrophobicContact CD2-CD1 3.98Å
290	Q	93.8	Very high	93.1	Very high	51 Å²	51	32.3 Å²	32.3	24%	0.238	15%	0.15	C	C	.	.	H	α-helix	trans	-67	-44.8	171.8	-72.7	168.2	-46.1	0	0	111.7	K286 E287 F288 V292 L293 Q294 L344 D345	K286-Q290 WeakPolarHBondContact O-CG 3.21Å; K286-Q290 PolarHBondContact O-N 2.95Å; E287-Q290 PolarHBondContact O-N 3.43Å; F288-Q290 VanDerWaalsContact C-N 3.34Å; Q290-V292 VanDerWaalsContact C-N 3.32Å; Q290-V292 PolarHBondContact O-N 3.4Å; Q290-L293 PolarHBondContact O-N 3.21Å; Q290-Q294 PolarHBondContact O-N 2.99Å; Q290-L344 HydrophobicContact CG-CD2 3.99Å; Q290-D345 PolarHBondContact NE2-OD1 3.17Å; Q290-D345 PolarHBondContact NE2-OD2 2.69Å
291	D	93.8	Very high	93.3	Very high	28 Å²	28	37.9 Å²	37.9	15%	0.15	18%	0.18	C	C	.	.	H	α-helix	trans	-56.2	-44.7	173.9	-69.8	-21	0	0	0	111.8	E287 F288 L295 H444 N446 M447	E287-D291 VanDerWaalsContact O-CG 3.23Å; E287-D291 PolarHBondContact O-N 2.93Å; F288-D291 PolarHBondContact O-N 2.79Å; D291-L295 PolarHBondContact O-N 3.48Å; D291-H444 IonicContact OD1-CE1 3.81Å; D291-H444 PolarHBondContact OD1-CE1 2.96Å; D291-H444 IonicContact OD2-CE1 3.71Å; D291-H444 PolarHBondContact OD2-CE1 3.02Å; D291-H444 VanDerWaalsContact OD2-CE1 3.23Å; D291-H444 IonicContact OD2-ND1 2.8Å; D291-N446 VanDerWaalsContact OD2-CB 3.29Å; D291-N446 WeakPolarHBondContact OD2-CB 3.46Å; D291-N446 PolarHBondContact OD2-ND2 3.4Å; D291-M447 HydrophobicContact CB-CE 3.8Å
292	V	94.8	Very high	93.4	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.006	18%	0.183	C	C	.	.	H	α-helix	trans	-72.3	-32.6	179.2	173.8	0	0	0	0	112	I259 F288 Q290 L295 Q296 L334 L410 V412 M447	I259-V292 HydrophobicContact CD1-CG1 3.76Å; I259-V292 HydrophobicContact CD1-CG2 4.13Å; I259-V292 HydrophobicContact CG2-CG2 3.96Å; F288-V292 HydrophobicContact CD1-CG2 4.19Å; F288-V292 HydrophobicContact CE1-CG2 3.84Å; F288-V292 HydrophobicContact CE2-CG2 4.2Å; F288-V292 HydrophobicContact CZ-CG2 3.86Å; F288-V292 WeakPolarHBondContact O-CB 3.24Å; F288-V292 VanDerWaalsContact O-CG2 3.28Å; F288-V292 WeakPolarHBondContact O-CG2 3.37Å; F288-V292 PolarHBondContact O-N 2.72Å; Q290-V292 VanDerWaalsContact C-N 3.32Å; Q290-V292 PolarHBondContact O-N 3.4Å; V292-L295 WeakPolarHBondContact O-CB 3.1Å; V292-L295 PolarHBondContact O-N 3.16Å; V292-Q296 PolarHBondContact O-N 3.44Å; V292-L334 HydrophobicContact CB-CD1 4.37Å; V292-L334 HydrophobicContact CG1-CD1 3.89Å; V292-L410 HydrophobicContact CG1-CD1 4.45Å; V292-L410 HydrophobicContact CG1-CD2 4.27Å; V292-V412 HydrophobicContact CG1-CG2 4.48Å; V292-M447 HydrophobicContact CG2-SD 4.39Å
293	L	94.4	Very high	93.5	Very high	7 Å²	7	41.6 Å²	41.6	4%	0.037	20%	0.202	C	C	.	.	H	α-helix	trans	-64	-45.7	174.2	-179.8	62.4	0	0	0	111.2	L289 Q290 L295 Q296 E297 L334 T339 E341	L289-L293 VanDerWaalsContact O-CB 3.32Å; L289-L293 WeakPolarHBondContact O-CB 3.29Å; L289-L293 PolarHBondContact O-N 2.88Å; Q290-L293 PolarHBondContact O-N 3.21Å; L293-L295 PolarHBondContact O-N 2.95Å; L293-Q296 PolarHBondContact O-N 2.85Å; L293-Q296 VanDerWaalsContact O-N 3.09Å; L293-E297 PolarHBondContact O-N 3.31Å; L293-L334 HydrophobicContact CB-CD1 3.83Å; L293-L334 HydrophobicContact CD1-CD1 4.09Å; L293-T339 HydrophobicContact CD1-CG2 3.7Å; L293-E341 HydrophobicContact CD2-CB 3.77Å
294	Q	93.8	Very high	93.4	Very high	113 Å²	113	42.7 Å²	42.7	53%	0.528	21%	0.208	S	C	.	.	H	α-helix	trans	-59.6	-36.4	175	-175	179.5	79.9	0	0	112	Q290 S298	Q290-Q294 PolarHBondContact O-N 2.99Å; Q294-S298 WeakPolarHBondContact O-CB 3.47Å; Q294-S298 PolarHBondContact O-N 3.44Å; Q294-S298 PolarHBondContact O-OG 2.04Å
295	L	94.5	Very high	93.2	Very high	2 Å²	2	51 Å²	51	1%	0.01	24%	0.241	C	C	.	.	H	α-helix	trans	-65.6	-45.4	172.8	175.4	63	0	0	0	111.9	L257 I259 D291 V292 L293 S298 I299 F438 Y442 M447 I449	L257-L295 HydrophobicContact CD2-CD2 4.4Å; I259-L295 HydrophobicContact CD1-CD2 3.88Å; D291-L295 PolarHBondContact O-N 3.48Å; V292-L295 WeakPolarHBondContact O-CB 3.1Å; V292-L295 PolarHBondContact O-N 3.16Å; L293-L295 PolarHBondContact O-N 2.95Å; L295-S298 PolarHBondContact O-N 3.18Å; L295-I299 HydrophobicContact CD1-CD1 3.98Å; L295-I299 HydrophobicContact CD1-CG1 4.4Å; L295-I299 HydrophobicContact CG-CD1 4Å; L295-I299 WeakPolarHBondContact O-CG1 3.42Å; L295-I299 PolarHBondContact O-N 3.23Å; L295-F438 HydrophobicContact CD1-CE1 3.86Å; L295-F438 HydrophobicContact CD1-CZ 4.45Å; L295-Y442 HydrophobicContact CD1-CD1 3.96Å; L295-Y442 HydrophobicContact CD1-CD2 4.11Å; L295-Y442 HydrophobicContact CD1-CE1 3.92Å; L295-Y442 HydrophobicContact CD1-CE2 4.08Å; L295-Y442 HydrophobicContact CD1-CG 4.05Å; L295-Y442 HydrophobicContact CD2-CE1 4.49Å; L295-M447 HydrophobicContact CD2-SD 4.25Å; L295-I449 HydrophobicContact CD2-CD1 3.67Å; L295-I449 HydrophobicContact CD2-CG1 4.38Å
296	Q	94.7	Very high	92.7	Very high	9 Å²	9	48.6 Å²	48.6	4%	0.042	23%	0.233	C	C	.	.	H	α-helix	trans	-63.2	-41.2	177.9	179.3	165.4	-27.2	0	0	111.8	V292 L293 I299 R300 S332 T339	V292-Q296 PolarHBondContact O-N 3.44Å; L293-Q296 PolarHBondContact O-N 2.85Å; L293-Q296 VanDerWaalsContact O-N 3.09Å; Q296-I299 PolarHBondContact O-N 3.3Å; Q296-R300 WeakPolarHBondContact O-CB 3.39Å; Q296-R300 PolarHBondContact O-N 3.46Å; Q296-S332 PolarHBondContact OE1-OG 3.05Å; Q296-T339 HydrophobicContact CG-CG2 4.02Å; Q296-T339 VanDerWaalsContact NE2-CG2 3.28Å; Q296-T339 PolarHBondContact NE2-OG1 2.95Å
297	E	93.3	Very high	92.3	Very high	79 Å²	79	52.5 Å²	52.5	37%	0.369	26%	0.256	S	S	.	.	H	α-helix	trans	-64.7	-40.2	172.3	-68.4	-155.4	125.7	0	0	112.8	L293 I299 R300 N301	L293-E297 PolarHBondContact O-N 3.31Å; E297-I299 VanDerWaalsContact C-N 3.29Å; E297-I299 PolarHBondContact O-N 3.02Å; E297-R300 PolarHBondContact O-N 3.1Å; E297-R300 IonicContact OE1-NH2 2.7Å; E297-R300 PolarHBondContact OE1-NH2 3.45Å; E297-N301 WeakPolarHBondContact O-CB 3.45Å; E297-N301 VanDerWaalsContact O-CG 3.32Å; E297-N301 PolarHBondContact O-N 3.14Å; E297-N301 PolarHBondContact O-ND2 3.04Å
298	S	94	Very high	91.9	Very high	39 Å²	39	54.1 Å²	54.1	27%	0.273	27%	0.269	S	S	.	.	H	α-helix	trans	-63.5	-36.7	177.5	-60	0	0	0	0	112	Q294 L295 F438	Q294-S298 WeakPolarHBondContact O-CB 3.47Å; Q294-S298 PolarHBondContact O-N 3.44Å; Q294-S298 PolarHBondContact O-OG 2.04Å; L295-S298 PolarHBondContact O-N 3.18Å; S298-F438 VanDerWaalsContact CB-CZ 3.44Å
299	I	94.9	Very high	91.6	Very high	1 Å²	1	60.1 Å²	60.1	1%	0.005	30%	0.297	C	S	.	.	H	α-helix	trans	-70.5	-43.2	174.1	-67	161	0	0	0	111.1	L257 L295 Q296 E297 N301 L302 Y414 W431 F435 F438 V439	L257-I299 HydrophobicContact CD2-CD1 3.86Å; L295-I299 HydrophobicContact CD1-CD1 3.98Å; L295-I299 HydrophobicContact CD1-CG1 4.4Å; L295-I299 HydrophobicContact CG-CD1 4Å; L295-I299 WeakPolarHBondContact O-CG1 3.42Å; L295-I299 PolarHBondContact O-N 3.23Å; Q296-I299 PolarHBondContact O-N 3.3Å; E297-I299 VanDerWaalsContact C-N 3.29Å; E297-I299 PolarHBondContact O-N 3.02Å; I299-N301 PolarHBondContact O-N 3.34Å; I299-L302 HydrophobicContact CG2-CD1 4.39Å; I299-L302 WeakPolarHBondContact O-CB 3.36Å; I299-L302 WeakPolarHBondContact O-CG 3.34Å; I299-L302 PolarHBondContact O-N 3.12Å; I299-L302 VanDerWaalsContact O-N 3.12Å; I299-Y414 HydrophobicContact CD1-CE2 4.27Å; I299-Y414 HydrophobicContact CG2-CE1 4.03Å; I299-Y414 HydrophobicContact CG2-CE2 3.91Å; I299-W431 HydrophobicContact CG2-CH2 4.27Å; I299-W431 HydrophobicContact CG2-CZ2 4.13Å; I299-F435 HydrophobicContact CD1-CE2 4.14Å; I299-F435 HydrophobicContact CG1-CD2 4.47Å; I299-F435 HydrophobicContact CG1-CE2 4.42Å; I299-F435 HydrophobicContact CG2-CD2 3.98Å; I299-F435 HydrophobicContact CG2-CE2 4.18Å; I299-F438 HydrophobicContact CG1-CD1 4.06Å; I299-F438 HydrophobicContact CG1-CE1 3.85Å; I299-V439 HydrophobicContact CD1-CG2 4.45Å
300	R	92.3	Very high	91.5	Very high	88 Å²	88	64.1 Å²	64.1	33%	0.332	32%	0.322	S	S	.	.	H	α-helix	trans	-57.4	-36.4	175.4	178.1	165	67.8	178.3	-4.3	112.2	Q296 E297 L302 E385	Q296-R300 WeakPolarHBondContact O-CB 3.39Å; Q296-R300 PolarHBondContact O-N 3.46Å; E297-R300 PolarHBondContact O-N 3.1Å; E297-R300 IonicContact OE1-NH2 2.7Å; E297-R300 PolarHBondContact OE1-NH2 3.45Å; R300-L302 VanDerWaalsContact C-N 3.31Å; R300-L302 PolarHBondContact O-N 3.12Å; R300-E385 IonicContact CZ-OE1 3.83Å; R300-E385 IonicContact NH1-OE1 3.46Å; R300-E385 PolarHBondContact NH1-OE1 2.83Å; R300-E385 IonicContact NH1-OE2 3.98Å; R300-E385 PolarHBondContact NH1-OE2 3.09Å
301	N	93.3	Very high	91.5	Very high	118 Å²	118	62.3 Å²	62.3	63%	0.631	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	7.9	-180	-68.9	-40.4	0	0	0	114.6	E297 I299 V303	E297-N301 WeakPolarHBondContact O-CB 3.45Å; E297-N301 VanDerWaalsContact O-CG 3.32Å; E297-N301 PolarHBondContact O-N 3.14Å; E297-N301 PolarHBondContact O-ND2 3.04Å; I299-N301 PolarHBondContact O-N 3.34Å; N301-V303 PolarHBondContact O-N 3.19Å
302	L	94.3	Very high	91.5	Very high	16 Å²	16	63.2 Å²	63.2	8%	0.084	32%	0.32	C	S	.	.			trans	-70.8	123.2	175.6	-68.9	176.1	0	0	0	111.8	I299 R300 F435 F438	I299-L302 HydrophobicContact CG2-CD1 4.39Å; I299-L302 WeakPolarHBondContact O-CB 3.36Å; I299-L302 WeakPolarHBondContact O-CG 3.34Å; I299-L302 PolarHBondContact O-N 3.12Å; I299-L302 VanDerWaalsContact O-N 3.12Å; R300-L302 VanDerWaalsContact C-N 3.31Å; R300-L302 PolarHBondContact O-N 3.12Å; L302-F435 HydrophobicContact CD1-CB 4.24Å; L302-F438 HydrophobicContact CD1-CB 4.2Å; L302-F438 HydrophobicContact CD1-CD1 4.36Å; L302-F438 HydrophobicContact CD1-CG 4.35Å; L302-F438 HydrophobicContact CD2-CB 4.01Å; L302-F438 HydrophobicContact CD2-CD2 4.08Å; L302-F438 HydrophobicContact CD2-CG 3.94Å
303	V	93.7	Very high	91.4	Very high	67 Å²	67	63.5 Å²	63.5	41%	0.406	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	132.4	173.3	-173	0	0	0	0	109.3	N301 T310 T312	N301-V303 PolarHBondContact O-N 3.19Å; V303-T310 HydrophobicContact CG1-CG2 4.27Å; V303-T312 HydrophobicContact CG2-CG2 4.32Å
304	T	92	Very high	91.3	Very high	22 Å²	22	64.4 Å²	64.4	14%	0.135	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	170.9	171.4	-164.5	0	0	0	0	110.6	I311 D430 W431	T304-I311 HydrophobicContact CG2-CB 3.77Å; T304-I311 HydrophobicContact CG2-CG2 4.29Å; T304-I311 PolarHBondContact N-O 2.9Å; T304-I311 PolarHBondContact O-N 2.93Å; T304-D430 HydrophobicContact CG2-CB 4.24Å; T304-D430 PolarHBondContact OG1-O 3.11Å; T304-D430 VanDerWaalsContact OG1-O 3.12Å; T304-W431 HydrophobicContact CG2-CB 4.09Å
305	Y	88.3	Confident	91.2	Very high	176 Å²	176	63.9 Å²	63.9	69%	0.69	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.8	108.3	179.3	-68.4	-85.3	0	0	0	110.3	Q309 T310	Y305-Q309 WeakPolarHBondContact CA-O 3.14Å; Y305-T310 HydrophobicContact CD1-CG2 4.02Å; Y305-T310 HydrophobicContact CE1-CG2 3.51Å
306	S	81.5	Confident	91.1	Very high	7 Å²	7	64.5 Å²	64.5	5%	0.049	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	131.9	175.1	-165	0	0	0	0	109.5	N308 Q309 D430	S306-N308 VanDerWaalsContact C-N 3.25Å; S306-N308 PolarHBondContact O-N 3.14Å; S306-N308 VanDerWaalsContact O-N 3.11Å; S306-Q309 PolarHBondContact N-O 3.35Å; S306-Q309 PolarHBondContact O-N 3.1Å; S306-D430 WeakPolarHBondContact CB-OD2 3.46Å; S306-D430 PolarHBondContact OG-OD2 3.47Å
307	N	81.7	Confident	91.1	Very high	133 Å²	133	64.4 Å²	64.4	71%	0.711	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.6	39.3	179.5	-65.8	-46.7	0	0	0	115.3	Q309	N307-Q309 PolarHBondContact O-N 3.07Å
308	N	83.2	Confident	91.1	Very high	171 Å²	171	61.6 Å²	61.6	91%	0.914	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.4	12.3	-173.3	-63.1	-31.5	0	0	0	116	S306	S306-N308 VanDerWaalsContact C-N 3.25Å; S306-N308 PolarHBondContact O-N 3.14Å; S306-N308 VanDerWaalsContact O-N 3.11Å
309	Q	88	Confident	91	Very high	133 Å²	133	62.4 Å²	62.4	62%	0.621	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.5	143.8	170.1	-62.8	-177.2	-11.6	0	0	110.1	Y305 S306 N307 I311	Y305-Q309 WeakPolarHBondContact CA-O 3.14Å; S306-Q309 PolarHBondContact N-O 3.35Å; S306-Q309 PolarHBondContact O-N 3.1Å; N307-Q309 PolarHBondContact O-N 3.07Å; Q309-I311 HydrophobicContact CB-CD1 4.27Å
310	T	92.4	Very high	90.8	Very high	85 Å²	85	63.1 Å²	63.1	52%	0.521	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	121	167.2	45.4	0	0	0	0	108.6	V303 Y305	V303-T310 HydrophobicContact CG1-CG2 4.27Å; Y305-T310 HydrophobicContact CD1-CG2 4.02Å; Y305-T310 HydrophobicContact CE1-CG2 3.51Å
311	I	92.8	Very high	90.6	Very high	14 Å²	14	59.5 Å²	59.5	7%	0.072	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	129.3	176.1	-53.9	-59.3	0	0	0	108.4	T304 Q309 D315 V316 A427	T304-I311 HydrophobicContact CG2-CB 3.77Å; T304-I311 HydrophobicContact CG2-CG2 4.29Å; T304-I311 PolarHBondContact N-O 2.9Å; T304-I311 PolarHBondContact O-N 2.93Å; Q309-I311 HydrophobicContact CB-CD1 4.27Å; I311-D315 HydrophobicContact CG2-CB 4.39Å; I311-V316 HydrophobicContact CG2-CG1 3.69Å; I311-A427 HydrophobicContact CD1-CB 4.15Å; I311-A427 HydrophobicContact CG1-CB 4.11Å; I311-A427 HydrophobicContact CG2-CB 4.22Å
312	T	93.6	Very high	90.3	Very high	47 Å²	47	55.5 Å²	55.5	29%	0.288	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	168.5	174.2	74.7	0	0	0	0	110.1	V303 G314 D315	V303-T312 HydrophobicContact CG2-CG2 4.32Å; T312-G314 PolarHBondContact O-N 3.36Å; T312-G314 PolarHBondContact OG1-N 3.13Å; T312-D315 WeakPolarHBondContact CA-OD2 3.26Å; T312-D315 WeakPolarHBondContact CB-OD2 2.25Å; T312-D315 PolarHBondContact N-OD2 2.75Å; T312-D315 PolarHBondContact O-N 3.41Å; T312-D315 VanDerWaalsContact O-N 3.09Å; T312-D315 PolarHBondContact OG1-OD2 3.31Å
313	L	93.1	Very high	89.8	Confident	6 Å²	6	60.1 Å²	60.1	3%	0.031	33%	0.33	C	S	.	.	H	α-helix	trans	-54.8	-36.1	170.8	175.7	58.6	0	0	0	111.7	D315 V316 C317 Y414 V416 W431	L313-D315 PolarHBondContact O-N 3.46Å; L313-D315 VanDerWaalsContact O-N 3.17Å; L313-V316 PolarHBondContact O-N 3.15Å; L313-C317 HydrophobicContact CD1-CB 3.9Å; L313-C317 HydrophobicContact CG-CB 4.33Å; L313-C317 VanDerWaalsContact O-CB 3.24Å; L313-C317 WeakPolarHBondContact O-CB 3.16Å; L313-C317 PolarHBondContact O-N 3.49Å; L313-C317 PolarHBondContact O-SG 3.22Å; L313-C317 VanDerWaalsContact O-SG 3.35Å; L313-Y414 HydrophobicContact CD2-CD1 3.81Å; L313-Y414 HydrophobicContact CD2-CE1 3.97Å; L313-V416 HydrophobicContact CD1-CG2 4.46Å; L313-W431 HydrophobicContact CB-CZ2 3.92Å; L313-W431 HydrophobicContact CD1-CH2 3.77Å; L313-W431 HydrophobicContact CD1-CZ2 3.78Å; L313-W431 HydrophobicContact CD1-CZ3 4.21Å; L313-W431 HydrophobicContact CD2-CZ2 4.27Å; L313-W431 HydrophobicContact CG-CZ2 4.19Å
314	G	92	Very high	89.4	Confident	26 Å²	26	63.8 Å²	63.8	27%	0.268	34%	0.343	S	S	.	.	H	α-helix	trans	-66.5	-11.2	179.3	0	0	0	0	0	115.5	T312 K319	T312-G314 PolarHBondContact O-N 3.36Å; T312-G314 PolarHBondContact OG1-N 3.13Å; G314-K319 WeakPolarHBondContact O-CE 3.36Å; G314-K319 PolarHBondContact O-NZ 2.95Å
315	D	91.9	Very high	89	Confident	103 Å²	103	66.7 Å²	66.7	55%	0.551	35%	0.354	S	S	*	.	H	α-helix	trans	-98.5	-14.5	178	-54.9	-67.3	0	0	0	113.1	I311 T312 L313	I311-D315 HydrophobicContact CG2-CB 4.39Å; T312-D315 WeakPolarHBondContact CA-OD2 3.26Å; T312-D315 WeakPolarHBondContact CB-OD2 2.25Å; T312-D315 PolarHBondContact N-OD2 2.75Å; T312-D315 PolarHBondContact O-N 3.41Å; T312-D315 VanDerWaalsContact O-N 3.09Å; T312-D315 PolarHBondContact OG1-OD2 3.31Å; L313-D315 PolarHBondContact O-N 3.46Å; L313-D315 VanDerWaalsContact O-N 3.17Å
316	V	93.4	Very high	89	Confident	14 Å²	14	62.9 Å²	62.9	9%	0.085	35%	0.345	C	S	.	.	H	α-helix	trans	-125.1	-14.4	-173.7	-60.2	0	0	0	0	114.3	I311 L313 V416 E417 A427 W431	I311-V316 HydrophobicContact CG2-CG1 3.69Å; L313-V316 PolarHBondContact O-N 3.15Å; V316-V416 HydrophobicContact CB-CG1 4.2Å; V316-V416 HydrophobicContact CG2-CG1 4.31Å; V316-V416 HydrophobicContact CG2-CG2 4.31Å; V316-E417 PolarHBondContact O-N 3.36Å; V316-A427 HydrophobicContact CG1-CB 4.25Å; V316-W431 HydrophobicContact CG2-CG 4.43Å
317	C	94.5	Very high	89.5	Confident	7 Å²	7	66.3 Å²	66.3	5%	0.047	36%	0.361	C	S	.	.	B	Isolated β-bridge	trans	-73.4	153.4	-178.6	69.5	0	0	0	0	113.6	L313 K319 C328 M415	L313-C317 HydrophobicContact CD1-CB 3.9Å; L313-C317 HydrophobicContact CG-CB 4.33Å; L313-C317 VanDerWaalsContact O-CB 3.24Å; L313-C317 WeakPolarHBondContact O-CB 3.16Å; L313-C317 PolarHBondContact O-N 3.49Å; L313-C317 PolarHBondContact O-SG 3.22Å; L313-C317 VanDerWaalsContact O-SG 3.35Å; C317-K319 PolarHBondContact O-N 3.37Å; C317-C328 HydrophobicContact CB-CB 3.52Å; C317-C328 WeakPolarHBondContact CB-SG 3.27Å; C317-C328 WeakPolarHBondContact SG-CA 3.4Å; C317-C328 WeakPolarHBondContact SG-CB 3.42Å; C317-C328 CovalentContact SG-SG 2.03Å; C317-C328 PolarHBondContact SG-SG 2.97Å; C317-M415 WeakPolarHBondContact CA-O 3.43Å
318	V	93	Very high	90.1	Very high	20 Å²	20	61 Å²	61	12%	0.121	33%	0.334	C	S	.	.			trans	-68.6	125.8	170.1	179	0	0	0	0	109.7	L329 M415 E417	V318-L329 HydrophobicContact CB-CB 4.44Å; V318-L329 WeakPolarHBondContact O-CB 3.29Å; V318-L329 PolarHBondContact O-N 3.34Å; V318-M415 HydrophobicContact CB-CB 4.21Å; V318-M415 HydrophobicContact CG2-CB 3.92Å; V318-M415 PolarHBondContact N-O 3.03Å; V318-E417 HydrophobicContact CG2-CG 4.01Å
319	K	92.3	Very high	90.5	Very high	57 Å²	57	54.1 Å²	54.1	25%	0.248	30%	0.297	C	S	.	.			trans	-117.6	103	177.9	-58.9	-179.1	-179.5	-157.8	0	110.4	G314 C317 A322 D326	G314-K319 WeakPolarHBondContact O-CE 3.36Å; G314-K319 PolarHBondContact O-NZ 2.95Å; C317-K319 PolarHBondContact O-N 3.37Å; K319-A322 HydrophobicContact CB-CB 3.86Å; K319-D326 HydrophobicContact CD-CB 4.35Å; K319-D326 VanDerWaalsContact CD-O 3.31Å; K319-D326 WeakPolarHBondContact CD-O 3.02Å; K319-D326 WeakPolarHBondContact CE-O 3.38Å; K319-D326 PolarHBondContact NZ-O 2.93Å
320	P	88.8	Confident	90.9	Very high	16 Å²	16	48.6 Å²	48.6	10%	0.104	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-12.2	-168.3	33.2	-37.3	0	0	0	114.8	L329 Y386	P320-L329 HydrophobicContact CB-CD1 4.45Å; P320-L329 HydrophobicContact CG-CD1 4.14Å; P320-Y386 HydrophobicContact CG-CD2 3.54Å; P320-Y386 HydrophobicContact CG-CE2 4.16Å; P320-Y386 HydrophobicContact CG-CG 4.39Å
321	L	88.5	Confident	90.9	Very high	11 Å²	11	45.6 Å²	45.6	6%	0.058	25%	0.252	C	S	.	.	B	Isolated β-bridge	trans	-122.2	13.3	-179.3	-59.1	-175.1	0	0	0	112.7	E324 K325 Y386 N855 H865 G866	L321-E324 PolarHBondContact O-N 3.42Å; L321-K325 CarbonylContact C-O 3.51Å; L321-K325 HydrophobicContact CB-CB 4Å; L321-K325 PolarHBondContact O-N 3.09Å; L321-Y386 VanDerWaalsContact CD1-O 3.29Å; L321-Y386 WeakPolarHBondContact CD1-O 3.38Å; L321-N855 WeakPolarHBondContact CD2-OD1 3.47Å; L321-H865 HydrophobicContact CD2-CB 4.22Å; L321-G866 VanDerWaalsContact CD2-CA 3.44Å
322	A	86.7	Confident	91	Very high	34 Å²	34	44.9 Å²	44.9	28%	0.281	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	140.4	176.9	0	0	0	0	0	110.5	K319 K325 D326	K319-A322 HydrophobicContact CB-CB 3.86Å; A322-K325 PolarHBondContact N-O 3.5Å; A322-D326 WeakPolarHBondContact CB-OD1 3.09Å
323	P	85.1	Confident	91	Very high	113 Å²	113	42.7 Å²	42.7	73%	0.734	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	cis	-95.3	7.9	10.1	38.5	-37.3	0	0	0	114.8
324	E	83.9	Confident	91	Very high	144 Å²	144	42.5 Å²	42.5	67%	0.673	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-28.9	177	-73.6	-168.5	-157.9	0	0	112.3	L321 N855	L321-E324 PolarHBondContact O-N 3.42Å; E324-N855 VanDerWaalsContact CD-ND2 3.31Å; E324-N855 PolarHBondContact OE2-ND2 3.12Å
325	K	85.3	Confident	91	Very high	83 Å²	83	41.3 Å²	41.3	36%	0.361	22%	0.222	S	C	.	.	B	Isolated β-bridge	trans	-143.4	107.5	173.6	-157.5	-180	-159.4	-175.6	0	111.2	L321 A322 E327 E385	L321-K325 CarbonylContact C-O 3.51Å; L321-K325 HydrophobicContact CB-CB 4Å; L321-K325 PolarHBondContact O-N 3.09Å; A322-K325 PolarHBondContact N-O 3.5Å; K325-E327 HydrophobicContact CD-CG 4.42Å; K325-E327 HydrophobicContact CG-CB 4.29Å; K325-E327 HydrophobicContact CG-CG 3.98Å; K325-E327 PolarHBondContact O-N 3.31Å; K325-E327 VanDerWaalsContact O-N 3.14Å; K325-E385 WeakPolarHBondContact CE-O 3.09Å; K325-E385 PolarHBondContact NZ-O 3.3Å
326	D	88.4	Confident	91.1	Very high	96 Å²	96	36.4 Å²	36.4	51%	0.513	20%	0.195	S	C	.	.			trans	-83	24.2	-175.9	-75.1	-27	0	0	0	114.4	K319 A322	K319-D326 HydrophobicContact CD-CB 4.35Å; K319-D326 VanDerWaalsContact CD-O 3.31Å; K319-D326 WeakPolarHBondContact CD-O 3.02Å; K319-D326 WeakPolarHBondContact CE-O 3.38Å; K319-D326 PolarHBondContact NZ-O 2.93Å; A322-D326 WeakPolarHBondContact CB-OD1 3.09Å
327	E	91.4	Very high	91.1	Very high	79 Å²	79	35.9 Å²	35.9	37%	0.369	19%	0.192	S	C	.	.			trans	-85.5	144.7	-177.2	-67.4	-59	161.5	0	0	113	K325 E385	K325-E327 HydrophobicContact CD-CG 4.42Å; K325-E327 HydrophobicContact CG-CB 4.29Å; K325-E327 HydrophobicContact CG-CG 3.98Å; K325-E327 PolarHBondContact O-N 3.31Å; K325-E327 VanDerWaalsContact O-N 3.14Å; E327-E385 HydrophobicContact CG-CG 4.47Å
328	C	93.3	Very high	90.9	Very high	22 Å²	22	38 Å²	38	15%	0.149	20%	0.201	C	C	.	.			trans	-75.4	136.7	-177	-64.3	0	0	0	0	113.2	C317 V330 Y386	C317-C328 HydrophobicContact CB-CB 3.52Å; C317-C328 WeakPolarHBondContact CB-SG 3.27Å; C317-C328 WeakPolarHBondContact SG-CA 3.4Å; C317-C328 WeakPolarHBondContact SG-CB 3.42Å; C317-C328 CovalentContact SG-SG 2.03Å; C317-C328 PolarHBondContact SG-SG 2.97Å; C328-V330 HydrophobicContact CB-CG2 4.26Å; C328-V330 PolarHBondContact O-N 3.36Å; C328-Y386 WeakPolarHBondContact O-CB 3.35Å
329	L	93.3	Very high	90.8	Very high	27 Å²	27	37.3 Å²	37.3	14%	0.141	20%	0.197	C	C	.	.			trans	-69.4	101.7	170.8	-163.1	159.6	0	0	0	110.4	V318 P320 Q331 Y386 M415	V318-L329 HydrophobicContact CB-CB 4.44Å; V318-L329 WeakPolarHBondContact O-CB 3.29Å; V318-L329 PolarHBondContact O-N 3.34Å; P320-L329 HydrophobicContact CB-CD1 4.45Å; P320-L329 HydrophobicContact CG-CD1 4.14Å; L329-Q331 HydrophobicContact CD2-CG 3.9Å; L329-Y386 HydrophobicContact CB-CG 4.42Å; L329-Y386 HydrophobicContact CD1-CD2 4.49Å; L329-Y386 HydrophobicContact CD1-CE2 4.07Å; L329-Y386 HydrophobicContact CD2-CE1 4.43Å; L329-Y386 HydrophobicContact CG-CD1 4.21Å; L329-Y386 HydrophobicContact CG-CD2 4.16Å; L329-Y386 HydrophobicContact CG-CE1 3.98Å; L329-Y386 HydrophobicContact CG-CE2 3.91Å; L329-Y386 HydrophobicContact CG-CG 4.29Å; L329-M415 HydrophobicContact CD2-CB 4.41Å; L329-M415 HydrophobicContact CD2-CG 3.69Å; L329-M415 PolarHBondContact O-N 3.41Å
330	V	94.6	Very high	90.7	Very high	16 Å²	16	37.9 Å²	37.9	10%	0.097	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	124.2	172.8	-173	0	0	0	0	109.2	C328 V412 Y414	C328-V330 HydrophobicContact CB-CG2 4.26Å; C328-V330 PolarHBondContact O-N 3.36Å; V330-V412 HydrophobicContact CG1-CG1 4.17Å; V330-Y414 HydrophobicContact CB-CD1 4.38Å; V330-Y414 HydrophobicContact CG1-CD1 3.92Å; V330-Y414 HydrophobicContact CG1-CE1 3.88Å; V330-Y414 HydrophobicContact CG1-CG 4.46Å; V330-Y414 HydrophobicContact CG2-CD1 3.57Å; V330-Y414 HydrophobicContact CG2-CE1 3.91Å
331	Q	93.6	Very high	90.8	Very high	22 Å²	22	42.1 Å²	42.1	10%	0.103	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	107.5	174.8	-63.4	-176.2	-26.9	0	0	108.6	L329 V394 V412 T413	L329-Q331 HydrophobicContact CD2-CG 3.9Å; Q331-V394 HydrophobicContact CB-CG2 4.43Å; Q331-V412 CarbonylContact O-C 3.54Å; Q331-V412 WeakPolarHBondContact O-CA 3.49Å; Q331-T413 PolarHBondContact N-O 3.01Å; Q331-T413 PolarHBondContact O-N 3.48Å
332	S	94.1	Very high	90.9	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.248	C	C	.	.			trans	-157.9	145.2	-177.5	175.5	0	0	0	0	108.9	Q296 L334 G335	Q296-S332 PolarHBondContact OE1-OG 3.05Å; S332-L334 PolarHBondContact O-N 3.19Å; S332-L334 PolarHBondContact OG-N 3.29Å; S332-G335 PolarHBondContact O-N 3Å
333	V	93.3	Very high	91.1	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-61.9	-26.4	175.2	-178.6	0	0	0	0	111.5	G335 Y336 L362 A395 L396 L410	V333-G335 PolarHBondContact O-N 2.78Å; V333-Y336 HydrophobicContact CG1-CD2 3.92Å; V333-Y336 HydrophobicContact CG1-CE2 4.01Å; V333-Y336 WeakPolarHBondContact O-CD2 3.08Å; V333-Y336 PolarHBondContact O-N 3.39Å; V333-L362 HydrophobicContact CG1-CD1 3.91Å; V333-A395 HydrophobicContact CG2-CB 3.83Å; V333-L396 HydrophobicContact CG2-CD1 4.45Å; V333-L396 HydrophobicContact CG2-CD2 3.69Å; V333-L396 HydrophobicContact CG2-CG 3.76Å; V333-L410 HydrophobicContact CB-CD1 4.42Å; V333-L410 HydrophobicContact CG2-CG 4.46Å
334	L	94	Very high	91.4	Very high	2 Å²	2	40.7 Å²	40.7	1%	0.01	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-65.9	-13.3	173.6	-61.2	175.3	0	0	0	113.1	L289 V292 L293 S332 Y336 F337 Q338 T339	L289-L334 HydrophobicContact CB-CD2 4.23Å; L289-L334 HydrophobicContact CD2-CD2 4.32Å; V292-L334 HydrophobicContact CB-CD1 4.37Å; V292-L334 HydrophobicContact CG1-CD1 3.89Å; L293-L334 HydrophobicContact CB-CD1 3.83Å; L293-L334 HydrophobicContact CD1-CD1 4.09Å; S332-L334 PolarHBondContact O-N 3.19Å; S332-L334 PolarHBondContact OG-N 3.29Å; L334-Y336 VanDerWaalsContact C-N 3.3Å; L334-Y336 PolarHBondContact O-N 3.36Å; L334-F337 CarbonylContact O-C 3.53Å; L334-F337 VanDerWaalsContact O-C 3.31Å; L334-F337 WeakPolarHBondContact O-CA 3.44Å; L334-F337 PolarHBondContact O-N 2.94Å; L334-F337 VanDerWaalsContact O-N 3.1Å; L334-Q338 PolarHBondContact O-N 3.49Å; L334-T339 PolarHBondContact O-N 2.78Å
335	G	92.4	Very high	91.8	Very high	1 Å²	1	37 Å²	37	1%	0.01	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-63.5	-32	171.6	0	0	0	0	0	113.3	S332 V333 F337 Q338 S384	S332-G335 PolarHBondContact O-N 3Å; V333-G335 PolarHBondContact O-N 2.78Å; G335-F337 PolarHBondContact O-N 2.85Å; G335-Q338 PolarHBondContact O-N 3.2Å; G335-Q338 PolarHBondContact O-NE2 3.43Å; G335-S384 WeakPolarHBondContact O-CA 3.47Å
336	Y	92.7	Very high	92	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-31.4	172.1	-55.8	-33.8	0	0	0	111.6	V333 L334 Q338 H361 L362 C365 L366 P369 S381 C382 V390	V333-Y336 HydrophobicContact CG1-CD2 3.92Å; V333-Y336 HydrophobicContact CG1-CE2 4.01Å; V333-Y336 WeakPolarHBondContact O-CD2 3.08Å; V333-Y336 PolarHBondContact O-N 3.39Å; L334-Y336 VanDerWaalsContact C-N 3.3Å; L334-Y336 PolarHBondContact O-N 3.36Å; Y336-Q338 VanDerWaalsContact C-N 3.33Å; Y336-Q338 PolarHBondContact O-NE2 3.18Å; Y336-H361 PolarHBondContact O-NE2 2.84Å; Y336-H361 VanDerWaalsContact O-NE2 3.11Å; Y336-L362 HydrophobicContact CD2-CD1 4.2Å; Y336-L362 HydrophobicContact CE2-CD1 4.43Å; Y336-C365 HydrophobicContact CD1-CB 3.8Å; Y336-C365 HydrophobicContact CD2-CB 3.83Å; Y336-C365 HydrophobicContact CE1-CB 4Å; Y336-C365 HydrophobicContact CE2-CB 4.03Å; Y336-C365 HydrophobicContact CG-CB 3.71Å; Y336-L366 HydrophobicContact CE2-CD2 3.84Å; Y336-L366 HydrophobicContact CE2-CG 4.35Å; Y336-P369 HydrophobicContact CE1-CB 4.16Å; Y336-S381 VanDerWaalsContact O-O 3.14Å; Y336-C382 VanDerWaalsContact CD1-O 3.31Å; Y336-C382 WeakPolarHBondContact CD1-O 3.3Å; Y336-V390 HydrophobicContact CE1-CB 4.25Å; Y336-V390 PolarHBondContact OH-O 3.03Å
337	F	93.8	Very high	92.2	Very high	3 Å²	3	36.1 Å²	36.1	1%	0.013	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.4	26.6	175.2	-55.6	-82.3	0	0	0	112	L334 G335 T339 N340 T343 L344 W358 H361 L362	L334-F337 CarbonylContact O-C 3.53Å; L334-F337 VanDerWaalsContact O-C 3.31Å; L334-F337 WeakPolarHBondContact O-CA 3.44Å; L334-F337 PolarHBondContact O-N 2.94Å; L334-F337 VanDerWaalsContact O-N 3.1Å; G335-F337 PolarHBondContact O-N 2.85Å; F337-T339 PolarHBondContact O-N 3.07Å; F337-N340 PolarHBondContact O-N 2.94Å; F337-T343 PolarHBondContact O-OG1 2.98Å; F337-L344 HydrophobicContact CB-CB 4.36Å; F337-L344 HydrophobicContact CD1-CB 4.26Å; F337-L344 HydrophobicContact CD1-CD1 4Å; F337-L344 HydrophobicContact CD2-CD1 4.02Å; F337-L344 HydrophobicContact CE1-CD1 3.96Å; F337-L344 HydrophobicContact CE2-CD1 3.98Å; F337-L344 HydrophobicContact CG-CB 4.31Å; F337-L344 HydrophobicContact CG-CD1 4.02Å; F337-L344 HydrophobicContact CZ-CD1 3.95Å; F337-W358 HydrophobicContact CE1-CB 3.75Å; F337-W358 HydrophobicContact CZ-CB 4.01Å; F337-H361 AromaticContact CD1-CD2 4Å; F337-H361 HydrophobicContact CE1-CB 4.33Å; F337-H361 AromaticContact CE1-CD2 3.64Å; F337-L362 HydrophobicContact CZ-CB 4.31Å
338	Q	90.6	Very high	92	Very high	52 Å²	52	35.3 Å²	35.3	24%	0.243	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	41.6	36.9	179.7	-69.8	75.7	65.5	0	0	114.7	L334 G335 Y336 N340 S381 L383	L334-Q338 PolarHBondContact O-N 3.49Å; G335-Q338 PolarHBondContact O-N 3.2Å; G335-Q338 PolarHBondContact O-NE2 3.43Å; Y336-Q338 VanDerWaalsContact C-N 3.33Å; Y336-Q338 PolarHBondContact O-NE2 3.18Å; Q338-N340 PolarHBondContact O-N 3.32Å; Q338-S381 PolarHBondContact NE2-O 2.92Å; Q338-L383 PolarHBondContact NE2-O 3.36Å
339	T	89.9	Confident	91.7	Very high	6 Å²	6	40.1 Å²	40.1	4%	0.037	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.6	35.9	-175.9	-36.2	0	0	0	0	113.9	L293 Q296 L334 F337 E385	L293-T339 HydrophobicContact CD1-CG2 3.7Å; Q296-T339 HydrophobicContact CG-CG2 4.02Å; Q296-T339 VanDerWaalsContact NE2-CG2 3.28Å; Q296-T339 PolarHBondContact NE2-OG1 2.95Å; L334-T339 PolarHBondContact O-N 2.78Å; F337-T339 PolarHBondContact O-N 3.07Å; T339-E385 WeakPolarHBondContact CB-OE2 3.44Å; T339-E385 PolarHBondContact OG1-OE2 2.68Å
340	N	91.6	Very high	91.2	Very high	69 Å²	69	43.8 Å²	43.8	37%	0.369	21%	0.211	S	C	.	.			trans	-134.6	117.5	-171.4	-176.4	-15.3	0	0	0	113.1	F337 Q338 T342 T343 L344	F337-N340 PolarHBondContact O-N 2.94Å; Q338-N340 PolarHBondContact O-N 3.32Å; N340-T342 VanDerWaalsContact C-N 3.25Å; N340-T342 VanDerWaalsContact CG-OG1 3.31Å; N340-T342 PolarHBondContact ND2-OG1 2.92Å; N340-T342 PolarHBondContact O-N 2.86Å; N340-T342 PolarHBondContact OD1-N 2.87Å; N340-T342 PolarHBondContact OD1-OG1 3.27Å; N340-T343 HydrophobicContact CB-CG2 4.14Å; N340-T343 PolarHBondContact O-N 2.8Å; N340-T343 PolarHBondContact O-OG1 3.43Å; N340-L344 PolarHBondContact O-N 2.71Å
341	E	89.9	Confident	90.7	Very high	105 Å²	105	52.9 Å²	52.9	49%	0.491	25%	0.246	S	C	.	.	H	α-helix	trans	-53	-41.6	-179.1	-173.8	176.4	-136.6	0	0	111.9	L293 T343 L344 D345	L293-E341 HydrophobicContact CD2-CB 3.77Å; E341-T343 PolarHBondContact O-N 2.84Å; E341-T343 VanDerWaalsContact O-N 3.12Å; E341-L344 PolarHBondContact O-N 2.89Å; E341-L344 VanDerWaalsContact O-N 3.15Å; E341-D345 WeakPolarHBondContact O-CB 3.47Å; E341-D345 PolarHBondContact O-N 3.04Å
342	T	91.8	Very high	90.2	Very high	100 Å²	100	55 Å²	55	61%	0.613	27%	0.273	S	S	*	.	H	α-helix	trans	-65.5	-17.7	-178.9	64.8	0	0	0	0	114.3	N340	N340-T342 VanDerWaalsContact C-N 3.25Å; N340-T342 VanDerWaalsContact CG-OG1 3.31Å; N340-T342 PolarHBondContact ND2-OG1 2.92Å; N340-T342 PolarHBondContact O-N 2.86Å; N340-T342 PolarHBondContact OD1-N 2.87Å; N340-T342 PolarHBondContact OD1-OG1 3.27Å
343	T	90.5	Very high	89.7	Confident	26 Å²	26	62.4 Å²	62.4	16%	0.16	31%	0.305	C	S	.	.	H	α-helix	trans	-94.6	-32.1	174.8	73.8	0	0	0	0	112.1	F337 N340 E341 D345 R346	F337-T343 PolarHBondContact O-OG1 2.98Å; N340-T343 HydrophobicContact CB-CG2 4.14Å; N340-T343 PolarHBondContact O-N 2.8Å; N340-T343 PolarHBondContact O-OG1 3.43Å; E341-T343 PolarHBondContact O-N 2.84Å; E341-T343 VanDerWaalsContact O-N 3.12Å; T343-D345 VanDerWaalsContact C-N 3.29Å; T343-R346 VanDerWaalsContact O-CB 3.31Å; T343-R346 WeakPolarHBondContact O-CB 3.42Å; T343-R346 PolarHBondContact O-N 3.22Å
344	L	91.3	Very high	89.3	Confident	1 Å²	1	65 Å²	65	1%	0.005	32%	0.319	C	S	.	.	H	α-helix	trans	-68.1	-30.7	170	-179.3	63.5	0	0	0	111.9	K286 L289 Q290 F337 N340 E341 W358	K286-L344 WeakPolarHBondContact CE-O 3.47Å; L289-L344 HydrophobicContact CB-CD2 3.93Å; L289-L344 HydrophobicContact CD1-CD1 4.25Å; Q290-L344 HydrophobicContact CG-CD2 3.99Å; F337-L344 HydrophobicContact CB-CB 4.36Å; F337-L344 HydrophobicContact CD1-CB 4.26Å; F337-L344 HydrophobicContact CD1-CD1 4Å; F337-L344 HydrophobicContact CD2-CD1 4.02Å; F337-L344 HydrophobicContact CE1-CD1 3.96Å; F337-L344 HydrophobicContact CE2-CD1 3.98Å; F337-L344 HydrophobicContact CG-CB 4.31Å; F337-L344 HydrophobicContact CG-CD1 4.02Å; F337-L344 HydrophobicContact CZ-CD1 3.95Å; N340-L344 PolarHBondContact O-N 2.71Å; E341-L344 PolarHBondContact O-N 2.89Å; E341-L344 VanDerWaalsContact O-N 3.15Å; L344-W358 HydrophobicContact CD1-CB 4.28Å
345	D	91.3	Very high	88.9	Confident	68 Å²	68	66.8 Å²	66.8	36%	0.364	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-0.1	172.3	-83	-34.2	0	0	0	114.2	K286 Q290 E341 T343	K286-D345 WeakPolarHBondContact CE-OD1 3.19Å; K286-D345 IonicContact NZ-OD1 3.18Å; K286-D345 PolarHBondContact NZ-OD1 3.44Å; Q290-D345 PolarHBondContact NE2-OD1 3.17Å; Q290-D345 PolarHBondContact NE2-OD2 2.69Å; E341-D345 WeakPolarHBondContact O-CB 3.47Å; E341-D345 PolarHBondContact O-N 3.04Å; T343-D345 VanDerWaalsContact C-N 3.29Å
346	R	91.3	Very high	88.6	Confident	85 Å²	85	66.8 Å²	66.8	32%	0.321	33%	0.328	S	S	.	.			trans	-72.5	135.3	-178.8	-172.3	175.1	171	-150.6	-8.2	112	T343 E348 M378 M380	T343-R346 VanDerWaalsContact O-CB 3.31Å; T343-R346 WeakPolarHBondContact O-CB 3.42Å; T343-R346 PolarHBondContact O-N 3.22Å; R346-E348 IonicContact NH2-OE1 3.89Å; R346-M378 VanDerWaalsContact CZ-O 3.25Å; R346-M378 PolarHBondContact NH1-O 3.23Å; R346-M378 PolarHBondContact NH2-O 2.82Å; R346-M380 VanDerWaalsContact NH1-CG 3.29Å; R346-M380 PolarHBondContact NH1-SD 3.38Å
347	E	91.2	Very high	88.5	Confident	75 Å²	75	67.4 Å²	67.4	35%	0.35	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	141.5	175.9	-71.8	-175.1	173	0	0	109.2	Y349 L354 N357	E347-Y349 HydrophobicContact CB-CD2 4.23Å; E347-Y349 HydrophobicContact CB-CE2 3.56Å; E347-Y349 PolarHBondContact OE2-OH 2.78Å; E347-L354 HydrophobicContact CB-CD1 3.63Å; E347-L354 HydrophobicContact CG-CD1 3.95Å; E347-N357 HydrophobicContact CG-CB 4.02Å
348	E	88.2	Confident	88.3	Confident	62 Å²	62	68.2 Å²	68.2	29%	0.29	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	138.3	179.7	-107.7	-60.9	168.5	0	0	111	R346 I355 A356 P377 M378	R346-E348 IonicContact NH2-OE1 3.89Å; E348-I355 HydrophobicContact CB-CD1 4.44Å; E348-I355 HydrophobicContact CB-CG1 4.1Å; E348-I355 WeakPolarHBondContact O-CG1 3.23Å; E348-I355 PolarHBondContact O-N 3.27Å; E348-A356 HydrophobicContact CB-CB 4.07Å; E348-A356 PolarHBondContact N-O 3.42Å; E348-A356 PolarHBondContact O-N 2.88Å; E348-P377 HydrophobicContact CB-CB 4.43Å; E348-P377 HydrophobicContact CG-CB 4.42Å; E348-M378 HydrophobicContact CB-CG 4.21Å; E348-M378 HydrophobicContact CG-CG 4.06Å
349	Y	86.8	Confident	88.3	Confident	123 Å²	123	66.3 Å²	66.3	48%	0.482	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	111.5	-165.3	-77.6	-90.4	0	0	0	112.6	E347 F353 L354	E347-Y349 HydrophobicContact CB-CD2 4.23Å; E347-Y349 HydrophobicContact CB-CE2 3.56Å; E347-Y349 PolarHBondContact OE2-OH 2.78Å; Y349-F353 CarbonylContact C-O 3.57Å; Y349-F353 VanDerWaalsContact CA-O 3.26Å; Y349-F353 WeakPolarHBondContact CA-O 3.36Å; Y349-L354 HydrophobicContact CD1-CB 4.24Å; Y349-L354 HydrophobicContact CD2-CD1 4.32Å; Y349-L354 HydrophobicContact CE1-CB 3.86Å; Y349-L354 HydrophobicContact CE1-CD1 4.11Å; Y349-L354 HydrophobicContact CE2-CD1 3.85Å
350	E	82.4	Confident	88.2	Confident	103 Å²	103	66.1 Å²	66.1	48%	0.481	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	130.4	174.4	-155.8	-171.7	175.8	0	0	110.8	G352 F353 I355	E350-G352 PolarHBondContact O-N 2.85Å; E350-F353 PolarHBondContact N-O 2.92Å; E350-F353 PolarHBondContact O-N 2.97Å; E350-I355 HydrophobicContact CB-CD1 3.84Å; E350-I355 HydrophobicContact CB-CG1 4.24Å; E350-I355 HydrophobicContact CB-CG2 3.8Å
351	Y	84.1	Confident	88.1	Confident	208 Å²	208	62.9 Å²	62.9	82%	0.816	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.5	17.2	-176.1	-57.7	-67.7	0	0	0	115.9
352	G	82.7	Confident	88.2	Confident	65 Å²	65	58 Å²	58	67%	0.67	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.9	3.1	-176.6	0	0	0	0	0	115.1	E350	E350-G352 PolarHBondContact O-N 2.85Å
353	F	83	Confident	87.9	Confident	156 Å²	156	54.5 Å²	54.5	68%	0.684	26%	0.26	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.1	139	169.6	-60.3	-84.2	0	0	0	109.8	Y349 E350 I355	Y349-F353 CarbonylContact C-O 3.57Å; Y349-F353 VanDerWaalsContact CA-O 3.26Å; Y349-F353 WeakPolarHBondContact CA-O 3.36Å; E350-F353 PolarHBondContact N-O 2.92Å; E350-F353 PolarHBondContact O-N 2.97Å; F353-I355 PolarHBondContact O-N 3.41Å
354	L	86.4	Confident	87.7	Confident	54 Å²	54	53.9 Å²	53.9	28%	0.283	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	119.7	170.2	-179.6	74	0	0	0	108.3	P272 E347 Y349 N357	P272-L354 HydrophobicContact CB-CD2 4.02Å; P272-L354 HydrophobicContact CB-CG 3.92Å; P272-L354 WeakPolarHBondContact CB-O 3.33Å; P272-L354 HydrophobicContact CG-CD2 4.12Å; P272-L354 HydrophobicContact CG-CG 4.15Å; E347-L354 HydrophobicContact CB-CD1 3.63Å; E347-L354 HydrophobicContact CG-CD1 3.95Å; Y349-L354 HydrophobicContact CD1-CB 4.24Å; Y349-L354 HydrophobicContact CD2-CD1 4.32Å; Y349-L354 HydrophobicContact CE1-CB 3.86Å; Y349-L354 HydrophobicContact CE1-CD1 4.11Å; Y349-L354 HydrophobicContact CE2-CD1 3.85Å; L354-N357 HydrophobicContact CD1-CB 4.41Å; L354-N357 HydrophobicContact CD2-CB 4.47Å
355	I	84.7	Confident	87.6	Confident	41 Å²	41	53.9 Å²	53.9	21%	0.21	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	-26.3	-179.6	53	158.6	0	0	0	113	M273 E348 E350 F353 P377	M273-I355 WeakPolarHBondContact CA-O 3.26Å; M273-I355 PolarHBondContact N-O 3.44Å; E348-I355 HydrophobicContact CB-CD1 4.44Å; E348-I355 HydrophobicContact CB-CG1 4.1Å; E348-I355 WeakPolarHBondContact O-CG1 3.23Å; E348-I355 PolarHBondContact O-N 3.27Å; E350-I355 HydrophobicContact CB-CD1 3.84Å; E350-I355 HydrophobicContact CB-CG1 4.24Å; E350-I355 HydrophobicContact CB-CG2 3.8Å; F353-I355 PolarHBondContact O-N 3.41Å; I355-P377 HydrophobicContact CD1-CB 3.68Å; I355-P377 HydrophobicContact CD1-CG 3.81Å; I355-P377 HydrophobicContact CG1-CB 4.45Å; I355-P377 HydrophobicContact CG1-CG 4.49Å
356	A	85.8	Confident	87.4	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	146.3	178.1	0	0	0	0	0	111.4	E348 P377 M378	E348-A356 HydrophobicContact CB-CB 4.07Å; E348-A356 PolarHBondContact N-O 3.42Å; E348-A356 PolarHBondContact O-N 2.88Å; A356-P377 HydrophobicContact CB-CB 4.09Å; A356-P377 HydrophobicContact CB-CG 4.06Å; A356-M378 HydrophobicContact CB-CE 3.91Å; A356-M378 HydrophobicContact CB-CG 4.04Å; A356-M378 HydrophobicContact CB-SD 4.2Å
357	N	90.2	Very high	86.9	Confident	13 Å²	13	50.1 Å²	50.1	7%	0.07	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	-174.6	174.1	69.7	14.8	0	0	0	111.2	P272 E347 L354 I359 S360 H361 M378	P272-N357 HydrophobicContact CG-CB 4.39Å; E347-N357 HydrophobicContact CG-CB 4.02Å; L354-N357 HydrophobicContact CD1-CB 4.41Å; L354-N357 HydrophobicContact CD2-CB 4.47Å; N357-I359 PolarHBondContact O-N 2.97Å; N357-I359 VanDerWaalsContact OD1-CB 3.24Å; N357-I359 WeakPolarHBondContact OD1-CB 3.45Å; N357-I359 WeakPolarHBondContact OD1-CG1 3.41Å; N357-I359 PolarHBondContact OD1-N 3.2Å; N357-S360 PolarHBondContact N-OG 3.33Å; N357-S360 WeakPolarHBondContact O-CB 3.39Å; N357-S360 PolarHBondContact O-N 3.47Å; N357-H361 PolarHBondContact O-N 3.03Å; N357-H361 VanDerWaalsContact O-N 3.13Å; N357-M378 VanDerWaalsContact O-CE 3.29Å; N357-M378 WeakPolarHBondContact O-CE 3.23Å
358	W	90.8	Very high	86.3	Confident	20 Å²	20	47 Å²	47	8%	0.076	23%	0.225	C	C	.	.	H	α-helix	trans	-49.9	-27.3	178	71.4	-89.4	0	0	0	115.2	F267 L280 F284 K286 L289 F337 L344 L362	F267-W358 HydrophobicContact CZ-CH2 4.48Å; L280-W358 HydrophobicContact CD1-CH2 4.07Å; F284-W358 HydrophobicContact CB-CZ3 4.32Å; F284-W358 WeakPolarHBondContact O-CH2 3.41Å; F284-W358 WeakPolarHBondContact O-CZ3 3.36Å; K286-W358 HydrophobicContact CB-CZ2 4.35Å; L289-W358 HydrophobicContact CD1-CZ3 4.44Å; F337-W358 HydrophobicContact CE1-CB 3.75Å; F337-W358 HydrophobicContact CZ-CB 4.01Å; L344-W358 HydrophobicContact CD1-CB 4.28Å; W358-L362 HydrophobicContact CE3-CD2 4.3Å; W358-L362 HydrophobicContact CZ3-CD2 3.92Å; W358-L362 WeakPolarHBondContact O-CB 3.24Å; W358-L362 PolarHBondContact O-N 3.1Å
359	I	90.2	Very high	86.1	Confident	13 Å²	13	44.7 Å²	44.7	7%	0.067	22%	0.216	C	C	.	.	H	α-helix	trans	-68.9	-49.2	175.2	-55.1	168.9	0	0	0	109.8	A269 D271 I278 N357 H361 L362 R363	A269-I359 HydrophobicContact CB-CD1 3.93Å; D271-I359 HydrophobicContact CB-CG2 4.37Å; I278-I359 HydrophobicContact CD1-CG2 4.45Å; N357-I359 PolarHBondContact O-N 2.97Å; N357-I359 VanDerWaalsContact OD1-CB 3.24Å; N357-I359 WeakPolarHBondContact OD1-CB 3.45Å; N357-I359 WeakPolarHBondContact OD1-CG1 3.41Å; N357-I359 PolarHBondContact OD1-N 3.2Å; I359-H361 VanDerWaalsContact C-N 3.28Å; I359-H361 PolarHBondContact O-N 3.03Å; I359-L362 PolarHBondContact O-N 2.85Å; I359-R363 WeakPolarHBondContact O-CB 3.19Å; I359-R363 PolarHBondContact O-N 3.35Å
360	S	88.1	Confident	85.7	Confident	2 Å²	2	42.4 Å²	42.4	1%	0.014	21%	0.21	C	C	.	.	H	α-helix	trans	-59.2	-41.8	178.5	-37.6	0	0	0	0	110.7	D271 N357 S364	D271-S360 WeakPolarHBondContact OD1-CB 3.36Å; D271-S360 PolarHBondContact OD1-OG 2.97Å; N357-S360 PolarHBondContact N-OG 3.33Å; N357-S360 WeakPolarHBondContact O-CB 3.39Å; N357-S360 PolarHBondContact O-N 3.47Å; S360-S364 PolarHBondContact O-N 2.75Å; S360-S364 VanDerWaalsContact O-N 3.13Å
361	H	89.6	Confident	85.5	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-63.9	-53.9	176	-171.3	57.3	0	0	0	111.9	Y336 F337 N357 I359 R363 S364 C365 D374 M378 M380	Y336-H361 PolarHBondContact O-NE2 2.84Å; Y336-H361 VanDerWaalsContact O-NE2 3.11Å; F337-H361 AromaticContact CD1-CD2 4Å; F337-H361 HydrophobicContact CE1-CB 4.33Å; F337-H361 AromaticContact CE1-CD2 3.64Å; N357-H361 PolarHBondContact O-N 3.03Å; N357-H361 VanDerWaalsContact O-N 3.13Å; I359-H361 VanDerWaalsContact C-N 3.28Å; I359-H361 PolarHBondContact O-N 3.03Å; H361-R363 PolarHBondContact O-N 3.06Å; H361-S364 WeakPolarHBondContact O-CA 3.44Å; H361-S364 WeakPolarHBondContact O-CB 3.29Å; H361-S364 PolarHBondContact O-N 2.76Å; H361-C365 PolarHBondContact CE1-SG 3.38Å; H361-C365 PolarHBondContact NE2-SG 3.31Å; H361-C365 VanDerWaalsContact NE2-SG 3.38Å; H361-C365 PolarHBondContact O-N 3.05Å; H361-D374 IonicContact CE1-OD2 2.63Å; H361-D374 IonicContact CG-OD2 2.77Å; H361-D374 IonicContact ND1-OD2 3.42Å; H361-D374 PolarHBondContact ND1-OD2 3.22Å; H361-M378 HydrophobicContact CB-CE 3.56Å; H361-M378 HydrophobicContact CB-SD 4.41Å; H361-M380 HydrophobicContact CB-CE 4.06Å
362	L	90.9	Very high	85.3	Confident	2 Å²	2	30.8 Å²	30.8	1%	0.01	17%	0.166	C	C	.	.	H	α-helix	trans	-55.6	-40.9	178.2	177.9	69.1	0	0	0	111.4	F284 V333 Y336 F337 W358 I359 S364 C365 L366	F284-L362 HydrophobicContact CB-CD2 4.31Å; F284-L362 HydrophobicContact CD1-CD1 4.34Å; F284-L362 HydrophobicContact CD1-CD2 3.44Å; F284-L362 VanDerWaalsContact CD1-CD2 3.44Å; F284-L362 HydrophobicContact CD1-CG 4.47Å; F284-L362 HydrophobicContact CE1-CD1 4.09Å; F284-L362 HydrophobicContact CE1-CD2 3.87Å; F284-L362 HydrophobicContact CE1-CG 4.49Å; F284-L362 HydrophobicContact CG-CD2 3.93Å; V333-L362 HydrophobicContact CG1-CD1 3.91Å; Y336-L362 HydrophobicContact CD2-CD1 4.2Å; Y336-L362 HydrophobicContact CE2-CD1 4.43Å; F337-L362 HydrophobicContact CZ-CB 4.31Å; W358-L362 HydrophobicContact CE3-CD2 4.3Å; W358-L362 HydrophobicContact CZ3-CD2 3.92Å; W358-L362 WeakPolarHBondContact O-CB 3.24Å; W358-L362 PolarHBondContact O-N 3.1Å; I359-L362 PolarHBondContact O-N 2.85Å; L362-S364 VanDerWaalsContact C-N 3.3Å; L362-S364 PolarHBondContact O-N 3.49Å; L362-C365 PolarHBondContact O-N 3.4Å; L362-L366 HydrophobicContact CD1-CD1 3.76Å; L362-L366 HydrophobicContact CD1-CD2 4.39Å; L362-L366 HydrophobicContact CD1-CG 3.83Å; L362-L366 HydrophobicContact CD2-CD1 4.38Å; L362-L366 HydrophobicContact CG-CD1 3.76Å; L362-L366 HydrophobicContact CG-CG 4.16Å; L362-L366 VanDerWaalsContact O-CB 3.29Å; L362-L366 WeakPolarHBondContact O-CB 3.18Å; L362-L366 VanDerWaalsContact O-CG 3.28Å; L362-L366 WeakPolarHBondContact O-CG 3.49Å; L362-L366 PolarHBondContact O-N 3.29Å
363	R	87.3	Confident	85.1	Confident	28 Å²	28	32.5 Å²	32.5	11%	0.106	16%	0.158	C	C	.	.	H	α-helix	trans	-67.3	-27	177.3	-171.4	-172.3	-176.6	-164.3	-1.6	112.8	D271 D274 I278 I359 H361 K367 F405	D271-R363 WeakPolarHBondContact OD2-CD 3.41Å; D271-R363 IonicContact OD2-CZ 2.66Å; D271-R363 IonicContact OD2-NE 3.13Å; D271-R363 IonicContact OD2-NH1 2.73Å; D271-R363 PolarHBondContact OD2-NH1 3.48Å; D274-R363 IonicContact OD1-CZ 2.67Å; D274-R363 IonicContact OD1-NH1 3.33Å; D274-R363 PolarHBondContact OD1-NH1 3.4Å; D274-R363 IonicContact OD1-NH2 2.88Å; D274-R363 IonicContact OD2-CZ 2.71Å; D274-R363 VanDerWaalsContact OD2-CZ 3.25Å; D274-R363 IonicContact OD2-NH1 3.54Å; D274-R363 PolarHBondContact OD2-NH1 3.41Å; D274-R363 IonicContact OD2-NH2 2.8Å; D274-R363 PolarHBondContact OD2-NH2 3.04Å; I278-R363 HydrophobicContact CD1-CG 4.41Å; I359-R363 WeakPolarHBondContact O-CB 3.19Å; I359-R363 PolarHBondContact O-N 3.35Å; H361-R363 PolarHBondContact O-N 3.06Å; R363-K367 VanDerWaalsContact O-CD 3.24Å; R363-K367 WeakPolarHBondContact O-CD 3.32Å; R363-K367 WeakPolarHBondContact O-CE 3.31Å; R363-K367 VanDerWaalsContact O-CG 3.28Å; R363-K367 WeakPolarHBondContact O-CG 3.32Å; R363-F405 HydrophobicContact CB-CE1 4.19Å; R363-F405 HydrophobicContact CB-CZ 4.33Å; R363-F405 HydrophobicContact CG-CE1 4.14Å; R363-F405 HydrophobicContact CG-CZ 3.9Å
364	S	85.2	Confident	84.9	Confident	13 Å²	13	25.4 Å²	25.4	9%	0.091	13%	0.127	C	C	.	.	H	α-helix	trans	-75.3	-53	169.7	-155.9	0	0	0	0	110.7	S360 H361 L362 L366 K367 N368 Q371	S360-S364 PolarHBondContact O-N 2.75Å; S360-S364 VanDerWaalsContact O-N 3.13Å; H361-S364 WeakPolarHBondContact O-CA 3.44Å; H361-S364 WeakPolarHBondContact O-CB 3.29Å; H361-S364 PolarHBondContact O-N 2.76Å; L362-S364 VanDerWaalsContact C-N 3.3Å; L362-S364 PolarHBondContact O-N 3.49Å; S364-L366 PolarHBondContact O-N 3.27Å; S364-K367 WeakPolarHBondContact O-CB 3.49Å; S364-K367 PolarHBondContact O-N 2.94Å; S364-K367 VanDerWaalsContact O-N 3.11Å; S364-N368 PolarHBondContact O-N 2.84Å; S364-Q371 PolarHBondContact OG-OE1 2.98Å
365	C	88.8	Confident	84.3	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-69.4	-31.8	-174.2	-56.8	0	0	0	0	114.4	Y336 H361 L362 K367 N368 P369 C382	Y336-C365 HydrophobicContact CD1-CB 3.8Å; Y336-C365 HydrophobicContact CD2-CB 3.83Å; Y336-C365 HydrophobicContact CE1-CB 4Å; Y336-C365 HydrophobicContact CE2-CB 4.03Å; Y336-C365 HydrophobicContact CG-CB 3.71Å; H361-C365 PolarHBondContact CE1-SG 3.38Å; H361-C365 PolarHBondContact NE2-SG 3.31Å; H361-C365 VanDerWaalsContact NE2-SG 3.38Å; H361-C365 PolarHBondContact O-N 3.05Å; L362-C365 PolarHBondContact O-N 3.4Å; C365-K367 VanDerWaalsContact C-N 3.29Å; C365-K367 PolarHBondContact O-N 2.67Å; C365-N368 CarbonylContact O-C 3.31Å; C365-N368 VanDerWaalsContact O-C 3.22Å; C365-N368 PolarHBondContact O-N 3.08Å; C365-P369 WeakPolarHBondContact O-CA 3.21Å; C365-P369 VanDerWaalsContact O-N 3.09Å; C365-C382 WeakPolarHBondContact CA-SG 3.25Å; C365-C382 HydrophobicContact CB-CB 3.59Å; C365-C382 WeakPolarHBondContact CB-SG 3.2Å; C365-C382 WeakPolarHBondContact SG-CA 3.36Å; C365-C382 WeakPolarHBondContact SG-CB 3.35Å; C365-C382 CovalentContact SG-SG 2.04Å; C365-C382 PolarHBondContact SG-SG 3.36Å
366	L	88.1	Confident	84	Confident	5 Å²	5	24.1 Å²	24.1	3%	0.026	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-25.4	172.5	-71.4	178.9	0	0	0	113.2	F284 Y336 L362 S364 P392 L396 F405	F284-L366 HydrophobicContact CE1-CD1 4.24Å; F284-L366 HydrophobicContact CZ-CD1 4Å; Y336-L366 HydrophobicContact CE2-CD2 3.84Å; Y336-L366 HydrophobicContact CE2-CG 4.35Å; L362-L366 HydrophobicContact CD1-CD1 3.76Å; L362-L366 HydrophobicContact CD1-CD2 4.39Å; L362-L366 HydrophobicContact CD1-CG 3.83Å; L362-L366 HydrophobicContact CD2-CD1 4.38Å; L362-L366 HydrophobicContact CG-CD1 3.76Å; L362-L366 HydrophobicContact CG-CG 4.16Å; L362-L366 VanDerWaalsContact O-CB 3.29Å; L362-L366 WeakPolarHBondContact O-CB 3.18Å; L362-L366 VanDerWaalsContact O-CG 3.28Å; L362-L366 WeakPolarHBondContact O-CG 3.49Å; L362-L366 PolarHBondContact O-N 3.29Å; S364-L366 PolarHBondContact O-N 3.27Å; L366-P392 HydrophobicContact CD2-CB 4.09Å; L366-P392 HydrophobicContact CD2-CG 3.99Å; L366-L396 HydrophobicContact CD2-CD1 3.65Å; L366-F405 HydrophobicContact CB-CZ 4.41Å; L366-F405 HydrophobicContact CD1-CD1 4.07Å; L366-F405 HydrophobicContact CD1-CE1 3.84Å; L366-F405 HydrophobicContact CD1-CZ 4.43Å
367	K	79.4	Confident	83.8	Confident	69 Å²	69	27.1 Å²	27.1	30%	0.3	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-39.7	170.2	-67.5	170.7	-169.5	160.5	0	111	G12 R363 S364 C365	G12-K367 PolarHBondContact O-NZ 3.1Å; R363-K367 VanDerWaalsContact O-CD 3.24Å; R363-K367 WeakPolarHBondContact O-CD 3.32Å; R363-K367 WeakPolarHBondContact O-CE 3.31Å; R363-K367 VanDerWaalsContact O-CG 3.28Å; R363-K367 WeakPolarHBondContact O-CG 3.32Å; S364-K367 WeakPolarHBondContact O-CB 3.49Å; S364-K367 PolarHBondContact O-N 2.94Å; S364-K367 VanDerWaalsContact O-N 3.11Å; C365-K367 VanDerWaalsContact C-N 3.29Å; C365-K367 PolarHBondContact O-N 2.67Å
368	N	79.1	Confident	83.5	Confident	11 Å²	11	26.8 Å²	26.8	6%	0.059	14%	0.141	C	C	.	.			trans	-143.3	90.8	-176.3	-167.7	-28.8	0	0	0	112.6	W9 S364 C365 M370 Q371	W9-N368 VanDerWaalsContact CE2-ND2 3.32Å; W9-N368 WeakPolarHBondContact CH2-ND2 3.48Å; W9-N368 WeakPolarHBondContact CZ2-ND2 3.31Å; W9-N368 WeakPolarHBondContact CZ3-ND2 3.32Å; S364-N368 PolarHBondContact O-N 2.84Å; C365-N368 CarbonylContact O-C 3.31Å; C365-N368 VanDerWaalsContact O-C 3.22Å; C365-N368 PolarHBondContact O-N 3.08Å; N368-M370 PolarHBondContact O-N 3.25Å; N368-M370 VanDerWaalsContact O-N 3.16Å; N368-M370 PolarHBondContact OD1-N 2.83Å; N368-M370 VanDerWaalsContact OD1-N 3.11Å; N368-Q371 HydrophobicContact CB-CG 3.98Å; N368-Q371 PolarHBondContact O-N 2.94Å; N368-Q371 PolarHBondContact OD1-N 3.04Å
369	P	84.4	Confident	83.1	Confident	13 Å²	13	27.4 Å²	27.4	8%	0.084	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-0.8	-178.9	31.6	-37.7	0	0	0	113.7	Y336 C365 P389 V390 F391	Y336-P369 HydrophobicContact CE1-CB 4.16Å; C365-P369 WeakPolarHBondContact O-CA 3.21Å; C365-P369 VanDerWaalsContact O-N 3.09Å; P369-P389 HydrophobicContact CB-CB 4.42Å; P369-P389 WeakPolarHBondContact O-CB 3.33Å; P369-V390 WeakPolarHBondContact CB-O 3.34Å; P369-F391 HydrophobicContact CG-CD1 3.87Å; P369-F391 HydrophobicContact CG-CE1 4.28Å
370	M	79.2	Confident	82.9	Confident	75 Å²	75	27.5 Å²	27.5	37%	0.369	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.5	4.6	179.1	-58.8	-169.6	78.9	0	0	113	W9 N368 V372 P389	W9-M370 HydrophobicContact CH2-CB 4.11Å; N368-M370 PolarHBondContact O-N 3.25Å; N368-M370 VanDerWaalsContact O-N 3.16Å; N368-M370 PolarHBondContact OD1-N 2.83Å; N368-M370 VanDerWaalsContact OD1-N 3.11Å; M370-V372 PolarHBondContact O-N 2.82Å; M370-P389 HydrophobicContact CE-CG 4.44Å; M370-P389 HydrophobicContact CG-CB 3.89Å; M370-P389 HydrophobicContact CG-CG 4.22Å
371	Q	77.2	Confident	82.9	Confident	27 Å²	27	29 Å²	29	13%	0.126	16%	0.164	C	C	.	.			trans	-68.9	116.6	174.3	-76.8	178.7	-7.8	0	0	111.4	S364 N368 M373 C382	S364-Q371 PolarHBondContact OG-OE1 2.98Å; N368-Q371 HydrophobicContact CB-CG 3.98Å; N368-Q371 PolarHBondContact O-N 2.94Å; N368-Q371 PolarHBondContact OD1-N 3.04Å; Q371-M373 PolarHBondContact O-N 3.14Å; Q371-C382 HydrophobicContact CB-CB 4.04Å; Q371-C382 WeakPolarHBondContact O-CA 3.36Å; Q371-C382 WeakPolarHBondContact O-CB 3.3Å; Q371-C382 PolarHBondContact O-N 3.43Å
372	V	79.1	Confident	82.8	Confident	39 Å²	39	29 Å²	29	24%	0.236	16%	0.164	C	C	.	.	S	Bend	trans	-69.5	-23.2	172	-167.9	0	0	0	0	111.5	M370 S381 L383 I858	M370-V372 PolarHBondContact O-N 2.82Å; V372-S381 WeakPolarHBondContact O-CA 3.5Å; V372-S381 WeakPolarHBondContact O-CB 3.39Å; V372-L383 HydrophobicContact CG1-CD1 4.47Å; V372-L383 HydrophobicContact CG2-CD1 4.11Å; V372-I858 HydrophobicContact CB-CB 4.45Å; V372-I858 HydrophobicContact CG1-CB 4.03Å
373	M	80.5	Confident	82.7	Confident	101 Å²	101	29.7 Å²	29.7	50%	0.498	17%	0.168	S	C	.	.	S	Bend	trans	-149.9	130.9	174	178.3	174.9	-77.3	0	0	107.1	Q371 M380 I858	Q371-M373 PolarHBondContact O-N 3.14Å; M373-M380 CarbonylContact C-O 3.46Å; M373-M380 WeakPolarHBondContact CA-O 3.4Å; M373-I858 HydrophobicContact CB-CD1 3.94Å; M373-I858 HydrophobicContact CE-CD1 3.77Å; M373-I858 HydrophobicContact SD-CD1 3.9Å
374	D	78	Confident	82.8	Confident	8 Å²	8	28.6 Å²	28.6	4%	0.043	17%	0.165	C	C	.	.			trans	-73.4	158.3	175.8	71.8	-18.8	0	0	0	111.9	H361 T376 G379 M380	H361-D374 IonicContact CE1-OD2 2.63Å; H361-D374 IonicContact CG-OD2 2.77Å; H361-D374 IonicContact ND1-OD2 3.42Å; H361-D374 PolarHBondContact ND1-OD2 3.22Å; D374-T376 HydrophobicContact CB-CG2 4.39Å; D374-T376 VanDerWaalsContact CG-OG1 3.26Å; D374-T376 PolarHBondContact O-N 2.88Å; D374-T376 PolarHBondContact OD1-OG1 3.3Å; D374-T376 WeakPolarHBondContact OD2-CB 3.32Å; D374-T376 VanDerWaalsContact OD2-CG2 3.23Å; D374-T376 WeakPolarHBondContact OD2-CG2 3.4Å; D374-T376 PolarHBondContact OD2-OG1 2.89Å; D374-G379 VanDerWaalsContact OD1-CA 3.24Å; D374-G379 WeakPolarHBondContact OD1-CA 3.42Å; D374-G379 PolarHBondContact OD1-N 2.95Å; D374-G379 VanDerWaalsContact OD1-N 3.1Å; D374-M380 PolarHBondContact N-O 3.13Å; D374-M380 PolarHBondContact OD1-N 2.82Å
375	T	73.5	Confident	83	Confident	56 Å²	56	30.3 Å²	30.3	34%	0.344	17%	0.171	S	C	.	.	S	Bend	trans	-83.5	6.5	177.9	58.6	0	0	0	0	112.8
376	T	79.7	Confident	83	Confident	11 Å²	11	31 Å²	31	7%	0.067	17%	0.174	C	C	.	.	S	Bend	trans	-82.8	161.9	179.1	83.6	0	0	0	0	110.7	D374 M378 G379	D374-T376 HydrophobicContact CB-CG2 4.39Å; D374-T376 VanDerWaalsContact CG-OG1 3.26Å; D374-T376 PolarHBondContact O-N 2.88Å; D374-T376 PolarHBondContact OD1-OG1 3.3Å; D374-T376 WeakPolarHBondContact OD2-CB 3.32Å; D374-T376 VanDerWaalsContact OD2-CG2 3.23Å; D374-T376 WeakPolarHBondContact OD2-CG2 3.4Å; D374-T376 PolarHBondContact OD2-OG1 2.89Å; T376-M378 HydrophobicContact CG2-CE 4.3Å; T376-M378 PolarHBondContact O-N 2.8Å; T376-M378 WeakPolarHBondContact OG1-CE 3.36Å; T376-M378 PolarHBondContact OG1-N 2.76Å; T376-G379 PolarHBondContact O-N 3.45Å
377	P	81	Confident	82.8	Confident	64 Å²	64	31.3 Å²	31.3	42%	0.416	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-16	172.6	-29.3	35.9	0	0	0	116	E348 I355 A356	E348-P377 HydrophobicContact CB-CB 4.43Å; E348-P377 HydrophobicContact CG-CB 4.42Å; I355-P377 HydrophobicContact CD1-CB 3.68Å; I355-P377 HydrophobicContact CD1-CG 3.81Å; I355-P377 HydrophobicContact CG1-CB 4.45Å; I355-P377 HydrophobicContact CG1-CG 4.49Å; A356-P377 HydrophobicContact CB-CB 4.09Å; A356-P377 HydrophobicContact CB-CG 4.06Å
378	M	82.9	Confident	83	Confident	6 Å²	6	28.5 Å²	28.5	3%	0.03	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-29.4	-179.8	-64.6	166.6	-65.7	0	0	113	R346 E348 A356 N357 H361 T376 M380	R346-M378 VanDerWaalsContact CZ-O 3.25Å; R346-M378 PolarHBondContact NH1-O 3.23Å; R346-M378 PolarHBondContact NH2-O 2.82Å; E348-M378 HydrophobicContact CB-CG 4.21Å; E348-M378 HydrophobicContact CG-CG 4.06Å; A356-M378 HydrophobicContact CB-CE 3.91Å; A356-M378 HydrophobicContact CB-CG 4.04Å; A356-M378 HydrophobicContact CB-SD 4.2Å; N357-M378 VanDerWaalsContact O-CE 3.29Å; N357-M378 WeakPolarHBondContact O-CE 3.23Å; H361-M378 HydrophobicContact CB-CE 3.56Å; H361-M378 HydrophobicContact CB-SD 4.41Å; T376-M378 HydrophobicContact CG2-CE 4.3Å; T376-M378 PolarHBondContact O-N 2.8Å; T376-M378 WeakPolarHBondContact OG1-CE 3.36Å; T376-M378 PolarHBondContact OG1-N 2.76Å; M378-M380 HydrophobicContact CB-CE 4.13Å; M378-M380 HydrophobicContact CB-CG 3.98Å; M378-M380 HydrophobicContact CB-SD 4.32Å; M378-M380 PolarHBondContact O-N 2.93Å; M378-M380 HydrophobicContact SD-CE 4.02Å
379	G	82.7	Confident	83.4	Confident	33 Å²	33	29.5 Å²	29.5	34%	0.34	18%	0.177	S	C	.	.			trans	60.1	42.7	178.4	0	0	0	0	0	114.1	D374 T376	D374-G379 VanDerWaalsContact OD1-CA 3.24Å; D374-G379 WeakPolarHBondContact OD1-CA 3.42Å; D374-G379 PolarHBondContact OD1-N 2.95Å; D374-G379 VanDerWaalsContact OD1-N 3.1Å; T376-G379 PolarHBondContact O-N 3.45Å
380	M	86.7	Confident	83.7	Confident	15 Å²	15	28.9 Å²	28.9	7%	0.074	17%	0.172	C	C	.	.			trans	-102.1	157	-176.2	-61.2	-168.9	-50.1	0	0	112.1	R346 H361 M373 D374 M378	R346-M380 VanDerWaalsContact NH1-CG 3.29Å; R346-M380 PolarHBondContact NH1-SD 3.38Å; H361-M380 HydrophobicContact CB-CE 4.06Å; M373-M380 CarbonylContact C-O 3.46Å; M373-M380 WeakPolarHBondContact CA-O 3.4Å; D374-M380 PolarHBondContact N-O 3.13Å; D374-M380 PolarHBondContact OD1-N 2.82Å; M378-M380 HydrophobicContact CB-CE 4.13Å; M378-M380 HydrophobicContact CB-CG 3.98Å; M378-M380 HydrophobicContact CB-SD 4.32Å; M378-M380 PolarHBondContact O-N 2.93Å; M378-M380 HydrophobicContact SD-CE 4.02Å
381	S	87.5	Confident	84.2	Confident	32 Å²	32	28.7 Å²	28.7	22%	0.224	17%	0.17	C	C	.	.			trans	-80.7	134.1	-178.2	166.1	0	0	0	0	111.7	Y336 Q338 V372 L383	Y336-S381 VanDerWaalsContact O-O 3.14Å; Q338-S381 PolarHBondContact NE2-O 2.92Å; V372-S381 WeakPolarHBondContact O-CA 3.5Å; V372-S381 WeakPolarHBondContact O-CB 3.39Å; S381-L383 VanDerWaalsContact C-N 3.34Å; S381-L383 WeakPolarHBondContact OG-CA 3.22Å; S381-L383 WeakPolarHBondContact OG-CB 3.26Å; S381-L383 PolarHBondContact OG-N 3.12Å; S381-L383 PolarHBondContact OG-O 3.02Å
382	C	88.2	Confident	84.8	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	17%	0.165	C	C	.	.	S	Bend	trans	-86	-6.7	165.8	-61.3	0	0	0	0	113	Y336 C365 Q371	Y336-C382 VanDerWaalsContact CD1-O 3.31Å; Y336-C382 WeakPolarHBondContact CD1-O 3.3Å; C365-C382 WeakPolarHBondContact CA-SG 3.25Å; C365-C382 HydrophobicContact CB-CB 3.59Å; C365-C382 WeakPolarHBondContact CB-SG 3.2Å; C365-C382 WeakPolarHBondContact SG-CA 3.36Å; C365-C382 WeakPolarHBondContact SG-CB 3.35Å; C365-C382 CovalentContact SG-SG 2.04Å; C365-C382 PolarHBondContact SG-SG 3.36Å; Q371-C382 HydrophobicContact CB-CB 4.04Å; Q371-C382 WeakPolarHBondContact O-CA 3.36Å; Q371-C382 WeakPolarHBondContact O-CB 3.3Å; Q371-C382 PolarHBondContact O-N 3.43Å
383	L	87.4	Confident	85.3	Confident	17 Å²	17	28.2 Å²	28.2	9%	0.089	16%	0.163	C	C	.	.	B	Isolated β-bridge	trans	-74.9	143.6	166.9	-53.1	179.3	0	0	0	110.3	Q338 V372 S381 P389	Q338-L383 PolarHBondContact NE2-O 3.36Å; V372-L383 HydrophobicContact CG1-CD1 4.47Å; V372-L383 HydrophobicContact CG2-CD1 4.11Å; S381-L383 VanDerWaalsContact C-N 3.34Å; S381-L383 WeakPolarHBondContact OG-CA 3.22Å; S381-L383 WeakPolarHBondContact OG-CB 3.26Å; S381-L383 PolarHBondContact OG-N 3.12Å; S381-L383 PolarHBondContact OG-O 3.02Å; L383-P389 HydrophobicContact CD2-CB 4.1Å
384	S	89.8	Confident	85.8	Confident	6 Å²	6	24 Å²	24	4%	0.042	14%	0.143	C	C	.	.			trans	-71	172.1	-178.5	-171.5	0	0	0	0	113.2	G335 Y386 G387 G388	G335-S384 WeakPolarHBondContact O-CA 3.47Å; S384-Y386 PolarHBondContact O-N 3.48Å; S384-Y386 VanDerWaalsContact O-N 3.13Å; S384-G387 WeakPolarHBondContact O-CA 3.36Å; S384-G387 PolarHBondContact O-N 3.13Å; S384-G388 PolarHBondContact N-O 3.05Å
385	E	89.1	Confident	86.6	Confident	49 Å²	49	23.7 Å²	23.7	23%	0.229	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.2	-35.3	176.1	-166.1	170.8	-158.3	0	0	111.9	R300 K325 E327 T339 G387	R300-E385 IonicContact CZ-OE1 3.83Å; R300-E385 IonicContact NH1-OE1 3.46Å; R300-E385 PolarHBondContact NH1-OE1 2.83Å; R300-E385 IonicContact NH1-OE2 3.98Å; R300-E385 PolarHBondContact NH1-OE2 3.09Å; K325-E385 WeakPolarHBondContact CE-O 3.09Å; K325-E385 PolarHBondContact NZ-O 3.3Å; E327-E385 HydrophobicContact CG-CG 4.47Å; T339-E385 WeakPolarHBondContact CB-OE2 3.44Å; T339-E385 PolarHBondContact OG1-OE2 2.68Å; E385-G387 VanDerWaalsContact C-N 3.33Å; E385-G387 PolarHBondContact O-N 2.88Å
386	Y	89.3	Confident	87.5	Confident	13 Å²	13	21 Å²	21	5%	0.051	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-6.6	175	75.3	-95.5	0	0	0	115.9	P320 L321 C328 L329 S384 G388 P389 V390	P320-Y386 HydrophobicContact CG-CD2 3.54Å; P320-Y386 HydrophobicContact CG-CE2 4.16Å; P320-Y386 HydrophobicContact CG-CG 4.39Å; L321-Y386 VanDerWaalsContact CD1-O 3.29Å; L321-Y386 WeakPolarHBondContact CD1-O 3.38Å; C328-Y386 WeakPolarHBondContact O-CB 3.35Å; L329-Y386 HydrophobicContact CB-CG 4.42Å; L329-Y386 HydrophobicContact CD1-CD2 4.49Å; L329-Y386 HydrophobicContact CD1-CE2 4.07Å; L329-Y386 HydrophobicContact CD2-CE1 4.43Å; L329-Y386 HydrophobicContact CG-CD1 4.21Å; L329-Y386 HydrophobicContact CG-CD2 4.16Å; L329-Y386 HydrophobicContact CG-CE1 3.98Å; L329-Y386 HydrophobicContact CG-CE2 3.91Å; L329-Y386 HydrophobicContact CG-CG 4.29Å; S384-Y386 PolarHBondContact O-N 3.48Å; S384-Y386 VanDerWaalsContact O-N 3.13Å; Y386-G388 VanDerWaalsContact CE2-CA 3.4Å; Y386-P389 PolarHBondContact OH-O 3.45Å; Y386-P389 VanDerWaalsContact OH-O 3.12Å; Y386-V390 HydrophobicContact CE1-CG2 4.29Å
387	G	83.5	Confident	88.1	Confident	12 Å²	12	20.5 Å²	20.5	12%	0.124	12%	0.122	C	C	.	.	S	Bend	trans	89.4	10.5	176.6	0	0	0	0	0	116.6	S384 E385	S384-G387 WeakPolarHBondContact O-CA 3.36Å; S384-G387 PolarHBondContact O-N 3.13Å; E385-G387 VanDerWaalsContact C-N 3.33Å; E385-G387 PolarHBondContact O-N 2.88Å
388	G	84.5	Confident	88.6	Confident	11 Å²	11	18.7 Å²	18.7	11%	0.113	12%	0.115	C	C	.	.	S	Bend	trans	-119.1	168.3	172.2	0	0	0	0	0	113.7	S384 Y386	S384-G388 PolarHBondContact N-O 3.05Å; Y386-G388 VanDerWaalsContact CE2-CA 3.4Å
389	P	87.4	Confident	88.9	Confident	32 Å²	32	19.9 Å²	19.9	21%	0.208	12%	0.12	C	C	.	.	B	Isolated β-bridge	trans	-75.7	142	-178.7	32.2	-36.1	0	0	0	111.7	P369 M370 L383 Y386 F391	P369-P389 HydrophobicContact CB-CB 4.42Å; P369-P389 WeakPolarHBondContact O-CB 3.33Å; M370-P389 HydrophobicContact CE-CG 4.44Å; M370-P389 HydrophobicContact CG-CB 3.89Å; M370-P389 HydrophobicContact CG-CG 4.22Å; L383-P389 HydrophobicContact CD2-CB 4.1Å; Y386-P389 PolarHBondContact OH-O 3.45Å; Y386-P389 VanDerWaalsContact OH-O 3.12Å; P389-F391 HydrophobicContact CG-CE2 4.36Å; P389-F391 HydrophobicContact CG-CZ 4.2Å
390	V	90	Very high	88.9	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	14%	0.139	C	C	.	.			trans	-104.4	112.1	168.3	174.3	0	0	0	0	107.8	Y336 P369 Y386 A395	Y336-V390 HydrophobicContact CE1-CB 4.25Å; Y336-V390 PolarHBondContact OH-O 3.03Å; P369-V390 WeakPolarHBondContact CB-O 3.34Å; Y386-V390 HydrophobicContact CE1-CG2 4.29Å; V390-A395 HydrophobicContact CG1-CB 3.57Å
391	F	89.5	Confident	88.5	Confident	70 Å²	70	27.2 Å²	27.2	31%	0.307	17%	0.167	S	C	.	.			trans	-73.8	137.7	179.4	-63.3	-74.9	0	0	0	111.2	P369 P389 Y393 V394 A395	P369-F391 HydrophobicContact CG-CD1 3.87Å; P369-F391 HydrophobicContact CG-CE1 4.28Å; P389-F391 HydrophobicContact CG-CE2 4.36Å; P389-F391 HydrophobicContact CG-CZ 4.2Å; F391-Y393 HydrophobicContact CB-CD1 3.95Å; F391-Y393 HydrophobicContact CB-CD2 4.48Å; F391-Y393 HydrophobicContact CB-CE1 3.51Å; F391-Y393 HydrophobicContact CB-CE2 4.1Å; F391-Y393 HydrophobicContact CB-CG 4.4Å; F391-Y393 HydrophobicContact CD1-CE1 4.13Å; F391-Y393 AromaticContact CG-CE1 3.88Å; F391-Y393 HydrophobicContact CG-CE1 3.88Å; F391-Y393 AromaticContact CG-CZ 3.8Å; F391-Y393 PolarHBondContact O-N 2.8Å; F391-Y393 VanDerWaalsContact O-N 3.13Å; F391-V394 HydrophobicContact CB-CG2 4.34Å; F391-V394 WeakPolarHBondContact O-CG2 3.25Å; F391-V394 PolarHBondContact O-N 3.33Å; F391-V394 VanDerWaalsContact O-N 3.09Å; F391-A395 PolarHBondContact O-N 2.88Å
392	P	91	Very high	88	Confident	4 Å²	4	29.4 Å²	29.4	3%	0.026	18%	0.18	C	C	.	.	H	α-helix	trans	-52	-39.9	180	-30	35	0	0	0	113.7	L366 V394 A395 L396 Y404	L366-P392 HydrophobicContact CD2-CB 4.09Å; L366-P392 HydrophobicContact CD2-CG 3.99Å; P392-V394 VanDerWaalsContact C-N 3.28Å; P392-V394 PolarHBondContact O-N 2.94Å; P392-A395 PolarHBondContact O-N 3.18Å; P392-L396 HydrophobicContact CB-CD1 4.39Å; P392-L396 WeakPolarHBondContact O-CB 3.27Å; P392-L396 PolarHBondContact O-N 2.92Å; P392-Y404 HydrophobicContact CB-CD1 3.61Å; P392-Y404 HydrophobicContact CB-CD2 3.65Å; P392-Y404 HydrophobicContact CB-CE1 3.75Å; P392-Y404 HydrophobicContact CB-CE2 3.78Å; P392-Y404 HydrophobicContact CB-CG 3.57Å; P392-Y404 HydrophobicContact CG-CD2 3.88Å; P392-Y404 HydrophobicContact CG-CE2 3.89Å; P392-Y404 HydrophobicContact CG-CG 4.3Å
393	Y	89.5	Confident	87.9	Confident	53 Å²	53	32.6 Å²	32.6	21%	0.208	20%	0.196	C	C	.	.	H	α-helix	trans	-70.6	-11.6	-177	61.9	-104.3	0	0	0	115.6	F391 V734 Y888	F391-Y393 HydrophobicContact CB-CD1 3.95Å; F391-Y393 HydrophobicContact CB-CD2 4.48Å; F391-Y393 HydrophobicContact CB-CE1 3.51Å; F391-Y393 HydrophobicContact CB-CE2 4.1Å; F391-Y393 HydrophobicContact CB-CG 4.4Å; F391-Y393 HydrophobicContact CD1-CE1 4.13Å; F391-Y393 AromaticContact CG-CE1 3.88Å; F391-Y393 HydrophobicContact CG-CE1 3.88Å; F391-Y393 AromaticContact CG-CZ 3.8Å; F391-Y393 PolarHBondContact O-N 2.8Å; F391-Y393 VanDerWaalsContact O-N 3.13Å; Y393-V734 HydrophobicContact CD2-CG1 3.58Å; Y393-V734 HydrophobicContact CD2-CG2 4.14Å; Y393-V734 HydrophobicContact CE2-CG1 4.29Å; Y393-V734 HydrophobicContact CG-CG1 4.23Å; Y393-Y888 AromaticContact CE2-CD2 3.95Å; Y393-Y888 HydrophobicContact CE2-CD2 3.95Å; Y393-Y888 HydrophobicContact CE2-CE2 4.06Å
394	V	91	Very high	88	Confident	13 Å²	13	34.2 Å²	34.2	8%	0.079	20%	0.202	C	C	.	.	H	α-helix	trans	-99.3	-18.9	171.1	-60.9	0	0	0	0	113.7	Q331 F391 P392 V734 Y888	Q331-V394 HydrophobicContact CB-CG2 4.43Å; F391-V394 HydrophobicContact CB-CG2 4.34Å; F391-V394 WeakPolarHBondContact O-CG2 3.25Å; F391-V394 PolarHBondContact O-N 3.33Å; F391-V394 VanDerWaalsContact O-N 3.09Å; P392-V394 VanDerWaalsContact C-N 3.28Å; P392-V394 PolarHBondContact O-N 2.94Å; V394-V734 HydrophobicContact CG1-CG2 4.16Å; V394-Y888 HydrophobicContact CG1-CE1 4.17Å; V394-Y888 HydrophobicContact CG1-CE2 4.39Å
395	A	93.4	Very high	87.9	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-111.6	-9	-174.6	0	0	0	0	0	114.3	V333 V390 F391 P392 V411	V333-A395 HydrophobicContact CG2-CB 3.83Å; V390-A395 HydrophobicContact CG1-CB 3.57Å; F391-A395 PolarHBondContact O-N 2.88Å; P392-A395 PolarHBondContact O-N 3.18Å; A395-V411 WeakPolarHBondContact CA-O 3.09Å; A395-V411 PolarHBondContact O-N 3.45Å
396	L	94.2	Very high	88	Confident	1 Å²	1	34.2 Å²	34.2	1%	0.005	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	158.6	177.1	-69.8	169.2	0	0	0	111.3	V283 F284 V333 L366 P392 F399	V283-L396 HydrophobicContact CG1-CD2 4.04Å; F284-L396 HydrophobicContact CE1-CD1 4.35Å; F284-L396 HydrophobicContact CE1-CD2 3.94Å; F284-L396 HydrophobicContact CZ-CD1 3.8Å; F284-L396 HydrophobicContact CZ-CD2 3.75Å; F284-L396 HydrophobicContact CZ-CG 4.46Å; V333-L396 HydrophobicContact CG2-CD1 4.45Å; V333-L396 HydrophobicContact CG2-CD2 3.69Å; V333-L396 HydrophobicContact CG2-CG 3.76Å; L366-L396 HydrophobicContact CD2-CD1 3.65Å; P392-L396 HydrophobicContact CB-CD1 4.39Å; P392-L396 WeakPolarHBondContact O-CB 3.27Å; P392-L396 PolarHBondContact O-N 2.92Å; L396-F399 HydrophobicContact CB-CD1 4.12Å; L396-F399 HydrophobicContact CB-CE1 4.04Å
397	G	92.5	Very high	88.2	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	156.9	178.9	0	0	0	0	0	114.5	F399 T408 A409 Y731	G397-F399 VanDerWaalsContact C-N 3.34Å; G397-F399 PolarHBondContact O-N 2.91Å; G397-T408 PolarHBondContact O-N 3.34Å; G397-A409 PolarHBondContact N-O 3.35Å; G397-A409 PolarHBondContact O-N 3.45Å; G397-Y731 CarbonylContact C-O 3.54Å; G397-Y731 VanDerWaalsContact C-O 3.3Å; G397-Y731 WeakPolarHBondContact CA-O 3.33Å
398	G	90	Very high	88.7	Confident	26 Å²	26	34.6 Å²	34.6	27%	0.268	21%	0.205	S	C	.	.	S	Bend	trans	69.2	25.9	175.9	0	0	0	0	0	114.9	T408 Y731	G398-T408 WeakPolarHBondContact CA-OG1 3.29Å; G398-T408 PolarHBondContact O-OG1 3.36Å; G398-Y731 PolarHBondContact N-O 2.71Å
399	F	89.6	Confident	89.2	Confident	30 Å²	30	34 Å²	34	13%	0.132	20%	0.2	C	C	.	.			trans	-88.1	163.5	168.2	56.4	-96.7	0	0	0	111.8	L396 G397 G401 D403 Y404 S406 S407 A733	L396-F399 HydrophobicContact CB-CD1 4.12Å; L396-F399 HydrophobicContact CB-CE1 4.04Å; G397-F399 VanDerWaalsContact C-N 3.34Å; G397-F399 PolarHBondContact O-N 2.91Å; F399-G401 WeakPolarHBondContact CD2-O 3.27Å; F399-G401 VanDerWaalsContact CE2-O 3.29Å; F399-G401 WeakPolarHBondContact CE2-O 3.36Å; F399-D403 WeakPolarHBondContact CB-O 3.07Å; F399-Y404 HydrophobicContact CD1-CD1 4.18Å; F399-Y404 AromaticContact CD2-CD1 3.94Å; F399-Y404 HydrophobicContact CD2-CD1 3.94Å; F399-Y404 HydrophobicContact CD2-CE1 4.21Å; F399-Y404 AromaticContact CE1-CD1 3.97Å; F399-Y404 HydrophobicContact CE1-CD1 3.97Å; F399-Y404 HydrophobicContact CE1-CE1 4.3Å; F399-Y404 AromaticContact CE2-CD1 3.73Å; F399-Y404 HydrophobicContact CE2-CD1 3.73Å; F399-Y404 AromaticContact CE2-CE1 3.58Å; F399-Y404 HydrophobicContact CE2-CE1 3.58Å; F399-Y404 HydrophobicContact CG-CD1 4.17Å; F399-Y404 AromaticContact CZ-CD1 3.74Å; F399-Y404 HydrophobicContact CZ-CD1 3.74Å; F399-Y404 AromaticContact CZ-CE1 3.63Å; F399-Y404 HydrophobicContact CZ-CE1 3.63Å; F399-S406 WeakPolarHBondContact CA-OG 3.45Å; F399-S406 WeakPolarHBondContact CB-OG 3.48Å; F399-S407 WeakPolarHBondContact CD1-OG 3.46Å; F399-A733 HydrophobicContact CE1-CB 3.81Å; F399-A733 HydrophobicContact CE2-CB 4.05Å; F399-A733 HydrophobicContact CZ-CB 3.32Å
400	N	83.2	Confident	89.6	Confident	137 Å²	137	32.5 Å²	32.5	73%	0.733	19%	0.19	S	C	*	.	B	Isolated β-bridge	trans	-104	121.4	175.9	-71.1	-53.9	0	0	0	111.6	T402 D403 S406	N400-T402 PolarHBondContact O-N 2.94Å; N400-D403 PolarHBondContact O-N 2.99Å; N400-D403 VanDerWaalsContact O-N 3.12Å; N400-S406 PolarHBondContact N-OG 3.48Å
401	G	77.5	Confident	89.8	Confident	66 Å²	66	32.7 Å²	32.7	68%	0.68	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.8	-120.5	175.9	0	0	0	0	0	112.3	F399	F399-G401 WeakPolarHBondContact CD2-O 3.27Å; F399-G401 VanDerWaalsContact CE2-O 3.29Å; F399-G401 WeakPolarHBondContact CE2-O 3.36Å
402	T	77.7	Confident	90.1	Very high	78 Å²	78	29.5 Å²	29.5	48%	0.479	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.5	0.3	178	48.4	0	0	0	0	113.8	N400 Y404	N400-T402 PolarHBondContact O-N 2.94Å; T402-Y404 VanDerWaalsContact C-N 3.31Å; T402-Y404 PolarHBondContact O-N 2.84Å
403	D	85.4	Confident	90.4	Very high	66 Å²	66	29.4 Å²	29.4	35%	0.353	18%	0.177	S	C	.	.	B	Isolated β-bridge	trans	-81.1	72.4	-178.5	-179.3	14.8	0	0	0	112.3	F399 N400 F405 S406	F399-D403 WeakPolarHBondContact CB-O 3.07Å; N400-D403 PolarHBondContact O-N 2.99Å; N400-D403 VanDerWaalsContact O-N 3.12Å; D403-F405 PolarHBondContact O-N 2.71Å; D403-F405 VanDerWaalsContact O-N 3.12Å; D403-F405 WeakPolarHBondContact OD1-CB 3.35Å; D403-F405 PolarHBondContact OD1-N 2.93Å; D403-S406 WeakPolarHBondContact O-CB 3.48Å; D403-S406 PolarHBondContact O-N 3.5Å; D403-S406 VanDerWaalsContact O-N 3.08Å; D403-S406 PolarHBondContact O-OG 3.23Å; D403-S406 PolarHBondContact OD1-N 2.68Å; D403-S406 WeakPolarHBondContact OD2-CB 3.48Å
404	Y	89.2	Confident	90.7	Very high	51 Å²	51	27.1 Å²	27.1	20%	0.2	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	-59.4	-21	177.6	-53.5	-54.2	0	0	0	113.6	F284 P392 F399 T402 S406 S407	F284-Y404 WeakPolarHBondContact CE2-O 2.79Å; P392-Y404 HydrophobicContact CB-CD1 3.61Å; P392-Y404 HydrophobicContact CB-CD2 3.65Å; P392-Y404 HydrophobicContact CB-CE1 3.75Å; P392-Y404 HydrophobicContact CB-CE2 3.78Å; P392-Y404 HydrophobicContact CB-CG 3.57Å; P392-Y404 HydrophobicContact CG-CD2 3.88Å; P392-Y404 HydrophobicContact CG-CE2 3.89Å; P392-Y404 HydrophobicContact CG-CG 4.3Å; F399-Y404 HydrophobicContact CD1-CD1 4.18Å; F399-Y404 AromaticContact CD2-CD1 3.94Å; F399-Y404 HydrophobicContact CD2-CD1 3.94Å; F399-Y404 HydrophobicContact CD2-CE1 4.21Å; F399-Y404 AromaticContact CE1-CD1 3.97Å; F399-Y404 HydrophobicContact CE1-CD1 3.97Å; F399-Y404 HydrophobicContact CE1-CE1 4.3Å; F399-Y404 AromaticContact CE2-CD1 3.73Å; F399-Y404 HydrophobicContact CE2-CD1 3.73Å; F399-Y404 AromaticContact CE2-CE1 3.58Å; F399-Y404 HydrophobicContact CE2-CE1 3.58Å; F399-Y404 HydrophobicContact CG-CD1 4.17Å; F399-Y404 AromaticContact CZ-CD1 3.74Å; F399-Y404 HydrophobicContact CZ-CD1 3.74Å; F399-Y404 AromaticContact CZ-CE1 3.63Å; F399-Y404 HydrophobicContact CZ-CE1 3.63Å; T402-Y404 VanDerWaalsContact C-N 3.31Å; T402-Y404 PolarHBondContact O-N 2.84Å; Y404-S406 VanDerWaalsContact C-N 3.25Å; Y404-S406 PolarHBondContact O-N 3.23Å; Y404-S407 WeakPolarHBondContact O-CB 3.39Å; Y404-S407 PolarHBondContact O-N 2.66Å; Y404-S407 PolarHBondContact O-OG 3.03Å
405	F	89.2	Confident	90.8	Very high	26 Å²	26	27 Å²	27	11%	0.114	17%	0.166	C	C	.	.	G	3₁₀ helix	trans	-68	-25.5	176.9	-59.4	-75.9	0	0	0	112.2	I278 L280 G281 F284 R363 L366 D403 S407	I278-F405 HydrophobicContact CG2-CD1 4.41Å; I278-F405 HydrophobicContact CG2-CG 4.49Å; L280-F405 HydrophobicContact CD2-CB 4.27Å; L280-F405 HydrophobicContact CD2-CD1 3.82Å; L280-F405 HydrophobicContact CD2-CG 4.5Å; G281-F405 PolarHBondContact N-O 3.32Å; F284-F405 WeakPolarHBondContact CE2-O 3.15Å; R363-F405 HydrophobicContact CB-CE1 4.19Å; R363-F405 HydrophobicContact CB-CZ 4.33Å; R363-F405 HydrophobicContact CG-CE1 4.14Å; R363-F405 HydrophobicContact CG-CZ 3.9Å; L366-F405 HydrophobicContact CB-CZ 4.41Å; L366-F405 HydrophobicContact CD1-CD1 4.07Å; L366-F405 HydrophobicContact CD1-CE1 3.84Å; L366-F405 HydrophobicContact CD1-CZ 4.43Å; D403-F405 PolarHBondContact O-N 2.71Å; D403-F405 VanDerWaalsContact O-N 3.12Å; D403-F405 WeakPolarHBondContact OD1-CB 3.35Å; D403-F405 PolarHBondContact OD1-N 2.93Å; F405-S407 PolarHBondContact O-N 3.25Å
406	S	90.5	Very high	90.9	Very high	30 Å²	30	27 Å²	27	21%	0.21	17%	0.166	C	C	.	.	G	3₁₀ helix	trans	-73.3	-4.3	176.8	68	0	0	0	0	115.9	F399 N400 D403 Y404	F399-S406 WeakPolarHBondContact CA-OG 3.45Å; F399-S406 WeakPolarHBondContact CB-OG 3.48Å; N400-S406 PolarHBondContact N-OG 3.48Å; D403-S406 WeakPolarHBondContact O-CB 3.48Å; D403-S406 PolarHBondContact O-N 3.5Å; D403-S406 VanDerWaalsContact O-N 3.08Å; D403-S406 PolarHBondContact O-OG 3.23Å; D403-S406 PolarHBondContact OD1-N 2.68Å; D403-S406 WeakPolarHBondContact OD2-CB 3.48Å; Y404-S406 VanDerWaalsContact C-N 3.25Å; Y404-S406 PolarHBondContact O-N 3.23Å
407	S	93.5	Very high	90.8	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	18%	0.177	C	C	.	.			trans	-54.5	135.1	-167.5	-62.6	0	0	0	0	115.8	G281 P282 F399 Y404 F405	G281-S407 CarbonylContact C-O 3.56Å; G281-S407 WeakPolarHBondContact CA-O 3.45Å; P282-S407 WeakPolarHBondContact CD-O 3.32Å; F399-S407 WeakPolarHBondContact CD1-OG 3.46Å; Y404-S407 WeakPolarHBondContact O-CB 3.39Å; Y404-S407 PolarHBondContact O-N 2.66Å; Y404-S407 PolarHBondContact O-OG 3.03Å; F405-S407 PolarHBondContact O-N 3.25Å
408	T	93.7	Very high	90.8	Very high	32 Å²	32	31.2 Å²	31.2	20%	0.196	19%	0.187	C	C	.	.			trans	-109.8	-11.6	-175.2	58.4	0	0	0	0	114.6	P261 Q264 V283 G397 G398	P261-T408 WeakPolarHBondContact CD-O 3.39Å; Q264-T408 PolarHBondContact NE2-O 3.47Å; V283-T408 VanDerWaalsContact CG2-C 3.44Å; G397-T408 PolarHBondContact O-N 3.34Å; G398-T408 WeakPolarHBondContact CA-OG1 3.29Å; G398-T408 PolarHBondContact O-OG1 3.36Å
409	A	94.8	Very high	90.8	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	151.7	172.8	0	0	0	0	0	111.5	I258 V260 V283 G397 Y731	I258-A409 HydrophobicContact CG2-CB 4.18Å; V260-A409 HydrophobicContact CG2-CB 4.01Å; V283-A409 VanDerWaalsContact CG2-C 3.42Å; G397-A409 PolarHBondContact N-O 3.35Å; G397-A409 PolarHBondContact O-N 3.45Å; A409-Y731 HydrophobicContact CB-CD1 3.9Å; A409-Y731 HydrophobicContact CB-CD2 4.23Å; A409-Y731 HydrophobicContact CB-CG 3.74Å
410	L	95.4	Very high	90.5	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	134.6	171.9	-168.3	156.1	0	0	0	108.2	I259 V283 F288 L289 V292 V333 V412	I259-L410 PolarHBondContact N-O 3.32Å; I259-L410 PolarHBondContact O-N 2.67Å; V283-L410 HydrophobicContact CG1-CB 3.87Å; V283-L410 HydrophobicContact CG1-CD1 3.98Å; V283-L410 HydrophobicContact CG1-CG 4.33Å; F288-L410 HydrophobicContact CE1-CB 4.35Å; F288-L410 HydrophobicContact CE1-CD1 4.37Å; L289-L410 HydrophobicContact CD2-CD1 3.98Å; V292-L410 HydrophobicContact CG1-CD1 4.45Å; V292-L410 HydrophobicContact CG1-CD2 4.27Å; V333-L410 HydrophobicContact CB-CD1 4.42Å; V333-L410 HydrophobicContact CG2-CG 4.46Å; L410-V412 HydrophobicContact CD2-CG2 3.42Å; L410-V412 VanDerWaalsContact CD2-CG2 3.42Å
411	V	95.7	Very high	90.7	Very high	3 Å²	3	34.6 Å²	34.6	2%	0.018	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	120	177.2	-175.3	0	0	0	0	108.6	Q256 L257 A395 L732	Q256-V411 HydrophobicContact CG-CG1 3.84Å; L257-V411 WeakPolarHBondContact O-CA 3.24Å; A395-V411 WeakPolarHBondContact CA-O 3.09Å; A395-V411 PolarHBondContact O-N 3.45Å; V411-L732 HydrophobicContact CG2-CD1 3.85Å
412	V	95.9	Very high	90.9	Very high	4 Å²	4	35.6 Å²	35.6	2%	0.024	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	125.3	170	-177.4	0	0	0	0	107.4	Q256 L257 I259 V292 V330 Q331 L410 Y414	Q256-V412 CarbonylContact C-O 3.31Å; Q256-V412 WeakPolarHBondContact CA-O 3.47Å; L257-V412 HydrophobicContact CB-CB 4.44Å; L257-V412 HydrophobicContact CD1-CB 4.31Å; L257-V412 HydrophobicContact CD1-CG1 4.44Å; L257-V412 PolarHBondContact N-O 2.82Å; L257-V412 PolarHBondContact O-N 3Å; I259-V412 HydrophobicContact CD1-CG2 3.98Å; V292-V412 HydrophobicContact CG1-CG2 4.48Å; V330-V412 HydrophobicContact CG1-CG1 4.17Å; Q331-V412 CarbonylContact O-C 3.54Å; Q331-V412 WeakPolarHBondContact O-CA 3.49Å; L410-V412 HydrophobicContact CD2-CG2 3.42Å; L410-V412 VanDerWaalsContact CD2-CG2 3.42Å; V412-Y414 HydrophobicContact CG1-CD2 4.21Å; V412-Y414 HydrophobicContact CG1-CE2 3.59Å
413	T	95.8	Very high	91.4	Very high	2 Å²	2	38.4 Å²	38.4	1%	0.012	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	120.4	175.5	-46.9	0	0	0	0	110.4	I254 Q256 Q331 M415	I254-T413 HydrophobicContact CG2-CG2 3.62Å; Q256-T413 HydrophobicContact CB-CG2 4.26Å; Q256-T413 PolarHBondContact NE2-OG1 2.94Å; Q331-T413 PolarHBondContact N-O 3.01Å; Q331-T413 PolarHBondContact O-N 3.48Å; T413-M415 HydrophobicContact CG2-CE 3.54Å; T413-M415 HydrophobicContact CG2-SD 3.73Å
414	Y	95.8	Very high	91.4	Very high	4 Å²	4	41.2 Å²	41.2	2%	0.016	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	139.1	168.6	-55.8	-95.5	0	0	0	108.7	E255 L257 I299 L313 V330 V412	E255-Y414 PolarHBondContact N-O 2.94Å; E255-Y414 VanDerWaalsContact N-O 3.16Å; E255-Y414 PolarHBondContact O-N 3.11Å; L257-Y414 HydrophobicContact CD1-CD2 4.04Å; L257-Y414 HydrophobicContact CD1-CE2 3.67Å; I299-Y414 HydrophobicContact CD1-CE2 4.27Å; I299-Y414 HydrophobicContact CG2-CE1 4.03Å; I299-Y414 HydrophobicContact CG2-CE2 3.91Å; L313-Y414 HydrophobicContact CD2-CD1 3.81Å; L313-Y414 HydrophobicContact CD2-CE1 3.97Å; V330-Y414 HydrophobicContact CB-CD1 4.38Å; V330-Y414 HydrophobicContact CG1-CD1 3.92Å; V330-Y414 HydrophobicContact CG1-CE1 3.88Å; V330-Y414 HydrophobicContact CG1-CG 4.46Å; V330-Y414 HydrophobicContact CG2-CD1 3.57Å; V330-Y414 HydrophobicContact CG2-CE1 3.91Å; V412-Y414 HydrophobicContact CG1-CD2 4.21Å; V412-Y414 HydrophobicContact CG1-CE2 3.59Å
415	M	94.2	Very high	91.5	Very high	10 Å²	10	39.5 Å²	39.5	5%	0.049	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	121.8	175.1	-52.1	-54.7	-174.1	0	0	110.2	Y252 I254 C317 V318 L329 T413	Y252-M415 HydrophobicContact CD2-CB 4.14Å; Y252-M415 HydrophobicContact CD2-CG 4.13Å; Y252-M415 HydrophobicContact CD2-SD 3.54Å; Y252-M415 VanDerWaalsContact CD2-SD 3.54Å; Y252-M415 HydrophobicContact CE2-CE 3.87Å; Y252-M415 HydrophobicContact CE2-CG 4.17Å; Y252-M415 HydrophobicContact CE2-SD 3.3Å; Y252-M415 WeakPolarHBondContact CE2-SD 3.34Å; Y252-M415 HydrophobicContact CG-CB 4.46Å; I254-M415 HydrophobicContact CG1-SD 4.12Å; C317-M415 WeakPolarHBondContact CA-O 3.43Å; V318-M415 HydrophobicContact CB-CB 4.21Å; V318-M415 HydrophobicContact CG2-CB 3.92Å; V318-M415 PolarHBondContact N-O 3.03Å; L329-M415 HydrophobicContact CD2-CB 4.41Å; L329-M415 HydrophobicContact CD2-CG 3.69Å; L329-M415 PolarHBondContact O-N 3.41Å; T413-M415 HydrophobicContact CG2-CE 3.54Å; T413-M415 HydrophobicContact CG2-SD 3.73Å
416	V	94.7	Very high	91.6	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	141.9	-179	165.9	0	0	0	0	109.9	Y252 R253 E255 L313 V316 A428 W431	Y252-V416 WeakPolarHBondContact CB-O 3.39Å; R253-V416 HydrophobicContact CB-CB 4.05Å; R253-V416 HydrophobicContact CB-CG1 4.26Å; R253-V416 PolarHBondContact N-O 2.77Å; R253-V416 PolarHBondContact O-N 2.89Å; E255-V416 WeakPolarHBondContact OE2-CG2 3.37Å; L313-V416 HydrophobicContact CD1-CG2 4.46Å; V316-V416 HydrophobicContact CB-CG1 4.2Å; V316-V416 HydrophobicContact CG2-CG1 4.31Å; V316-V416 HydrophobicContact CG2-CG2 4.31Å; V416-A428 HydrophobicContact CG1-CB 3.65Å; V416-W431 HydrophobicContact CG2-CE3 4.44Å; V416-W431 HydrophobicContact CG2-CZ3 4.23Å
417	E	92.6	Very high	91.6	Very high	49 Å²	49	41.4 Å²	41.4	23%	0.229	21%	0.212	C	C	.	.			trans	-65.8	151.1	-178	-66.3	-149.4	131.9	0	0	112.3	V316 V318 Y419 K870	V316-E417 PolarHBondContact O-N 3.36Å; V318-E417 HydrophobicContact CG2-CG 4.01Å; E417-Y419 HydrophobicContact CB-CE2 3.88Å; E417-Y419 PolarHBondContact OE2-OH 3.3Å; E417-K870 IonicContact OE1-NZ 2.66Å; E417-K870 PolarHBondContact OE1-NZ 3.04Å
418	N	92.3	Very high	91.6	Very high	41 Å²	41	41.7 Å²	41.7	22%	0.219	21%	0.214	C	C	.	.			trans	-131.6	136.3	-177.8	-159.4	9.9	0	0	0	110.4	P250 F251 R253 N425	P250-N418 HydrophobicContact CB-CB 4.26Å; F251-N418 VanDerWaalsContact O-CB 3.24Å; F251-N418 WeakPolarHBondContact O-CB 3.03Å; F251-N418 PolarHBondContact O-ND2 3.42Å; R253-N418 HydrophobicContact CG-CB 3.9Å; N418-N425 PolarHBondContact OD1-ND2 2.92Å
419	Y	90.7	Very high	91.5	Very high	88 Å²	88	42.3 Å²	42.3	35%	0.345	22%	0.216	S	C	.	.			trans	-127.9	145.8	-175.7	-65.8	-88.3	0	0	0	111.5	E417 N421 K424 N425	E417-Y419 HydrophobicContact CB-CE2 3.88Å; E417-Y419 PolarHBondContact OE2-OH 3.3Å; Y419-N421 VanDerWaalsContact C-N 3.26Å; Y419-N421 PolarHBondContact O-N 2.84Å; Y419-K424 HydrophobicContact CD1-CD 3.53Å; Y419-K424 HydrophobicContact CD2-CB 3.97Å; Y419-K424 HydrophobicContact CD2-CD 4.28Å; Y419-K424 HydrophobicContact CE1-CD 4.06Å; Y419-K424 HydrophobicContact CG-CB 3.87Å; Y419-K424 HydrophobicContact CG-CD 3.65Å; Y419-K424 HydrophobicContact CG-CG 4.45Å; Y419-N425 WeakPolarHBondContact CB-OD1 3.44Å; Y419-N425 PolarHBondContact N-OD1 3.02Å; Y419-N425 PolarHBondContact O-ND2 3.39Å
420	D	83.8	Confident	91.5	Very high	109 Å²	109	45 Å²	45	58%	0.583	23%	0.23	S	C	*	.	S	Bend	trans	-67.3	-23.3	176.4	-67.9	-51.8	0	0	0	113.6	P250 P422	P250-D420 WeakPolarHBondContact CG-OD1 3.36Å; D420-P422 WeakPolarHBondContact O-CD 3.44Å
421	N	87	Confident	91.4	Very high	67 Å²	67	45 Å²	45	36%	0.358	23%	0.23	S	C	.	.	S	Bend	trans	-86	114.3	170.6	-178.7	-0.9	0	0	0	109.4	Y419 E423 K424	Y419-N421 VanDerWaalsContact C-N 3.26Å; Y419-N421 PolarHBondContact O-N 2.84Å; N421-E423 PolarHBondContact ND2-OE2 3.38Å; N421-E423 PolarHBondContact O-N 3.22Å; N421-E423 VanDerWaalsContact O-N 3.15Å; N421-E423 WeakPolarHBondContact OD1-CB 3.2Å; N421-E423 WeakPolarHBondContact OD1-CG 3.34Å; N421-E423 PolarHBondContact OD1-N 2.86Å; N421-K424 PolarHBondContact O-N 2.81Å; N421-K424 VanDerWaalsContact O-N 3.07Å
422	P	82.1	Confident	91.4	Very high	87 Å²	87	44.9 Å²	44.9	57%	0.565	23%	0.229	S	C	*	.	H	α-helix	trans	-60	-25.3	179.4	25.3	-35.4	0	0	0	113.9	D420 K424 N425 L426	D420-P422 WeakPolarHBondContact O-CD 3.44Å; P422-K424 VanDerWaalsContact C-N 3.25Å; P422-K424 PolarHBondContact O-N 3.27Å; P422-N425 PolarHBondContact O-N 2.65Å; P422-N425 VanDerWaalsContact O-N 3.11Å; P422-L426 PolarHBondContact O-N 2.89Å
423	E	86.6	Confident	91.4	Very high	138 Å²	138	46.5 Å²	46.5	65%	0.645	24%	0.243	S	C	*	.	H	α-helix	trans	-60.8	-33.9	175.8	-61.5	176.2	139.2	0	0	112.4	N421 N425 L426	N421-E423 PolarHBondContact ND2-OE2 3.38Å; N421-E423 PolarHBondContact O-N 3.22Å; N421-E423 VanDerWaalsContact O-N 3.15Å; N421-E423 WeakPolarHBondContact OD1-CB 3.2Å; N421-E423 WeakPolarHBondContact OD1-CG 3.34Å; N421-E423 PolarHBondContact OD1-N 2.86Å; E423-N425 VanDerWaalsContact C-N 3.34Å; E423-L426 WeakPolarHBondContact O-CB 3.13Å; E423-L426 WeakPolarHBondContact O-CD1 3.46Å; E423-L426 WeakPolarHBondContact O-CG 3.27Å
424	K	87.1	Confident	91.3	Very high	124 Å²	124	49.6 Å²	49.6	54%	0.539	26%	0.256	S	S	.	.	H	α-helix	trans	-71.2	-32	176.4	-72.4	-170.3	169.2	-166	0	112.3	Y419 N421 P422 L426	Y419-K424 HydrophobicContact CD1-CD 3.53Å; Y419-K424 HydrophobicContact CD2-CB 3.97Å; Y419-K424 HydrophobicContact CD2-CD 4.28Å; Y419-K424 HydrophobicContact CE1-CD 4.06Å; Y419-K424 HydrophobicContact CG-CB 3.87Å; Y419-K424 HydrophobicContact CG-CD 3.65Å; Y419-K424 HydrophobicContact CG-CG 4.45Å; N421-K424 PolarHBondContact O-N 2.81Å; N421-K424 VanDerWaalsContact O-N 3.07Å; P422-K424 VanDerWaalsContact C-N 3.25Å; P422-K424 PolarHBondContact O-N 3.27Å; K424-L426 PolarHBondContact O-N 3.49Å
425	N	90.2	Very high	91.3	Very high	16 Å²	16	49.4 Å²	49.4	9%	0.086	26%	0.256	C	S	.	.	H	α-helix	trans	-76.4	-8.3	-178.8	-59.4	-24.9	0	0	0	112.6	N418 Y419 P422 E423 A427 A428 M429	N418-N425 PolarHBondContact OD1-ND2 2.92Å; Y419-N425 WeakPolarHBondContact CB-OD1 3.44Å; Y419-N425 PolarHBondContact N-OD1 3.02Å; Y419-N425 PolarHBondContact O-ND2 3.39Å; P422-N425 PolarHBondContact O-N 2.65Å; P422-N425 VanDerWaalsContact O-N 3.11Å; E423-N425 VanDerWaalsContact C-N 3.34Å; N425-A427 VanDerWaalsContact C-N 3.34Å; N425-A427 PolarHBondContact O-N 3.33Å; N425-A428 PolarHBondContact O-N 3Å; N425-M429 HydrophobicContact CB-CE 4.06Å; N425-M429 WeakPolarHBondContact O-CB 3.49Å; N425-M429 WeakPolarHBondContact O-CG 3.48Å; N425-M429 PolarHBondContact O-N 2.9Å
426	L	90.5	Very high	91.4	Very high	72 Å²	72	50 Å²	50	38%	0.377	26%	0.259	S	S	.	.	H	α-helix	trans	-56.2	-45.2	178.4	-69.4	172.2	0	0	0	112.2	P422 E423 K424 A428 M429 D430	P422-L426 PolarHBondContact O-N 2.89Å; E423-L426 WeakPolarHBondContact O-CB 3.13Å; E423-L426 WeakPolarHBondContact O-CD1 3.46Å; E423-L426 WeakPolarHBondContact O-CG 3.27Å; K424-L426 PolarHBondContact O-N 3.49Å; L426-A428 VanDerWaalsContact C-N 3.34Å; L426-A428 PolarHBondContact O-N 3.34Å; L426-M429 HydrophobicContact CD2-CE 4.04Å; L426-M429 PolarHBondContact O-N 3.5Å; L426-D430 WeakPolarHBondContact O-CB 3.35Å; L426-D430 VanDerWaalsContact O-CG 3.3Å; L426-D430 PolarHBondContact O-N 3.35Å
427	A	92	Very high	91.4	Very high	24 Å²	24	55.6 Å²	55.6	20%	0.198	29%	0.285	C	S	.	.	H	α-helix	trans	-63.2	-38.5	179	0	0	0	0	0	112.8	I311 V316 N425 W431	I311-A427 HydrophobicContact CD1-CB 4.15Å; I311-A427 HydrophobicContact CG1-CB 4.11Å; I311-A427 HydrophobicContact CG2-CB 4.22Å; V316-A427 HydrophobicContact CG1-CB 4.25Å; N425-A427 VanDerWaalsContact C-N 3.34Å; N425-A427 PolarHBondContact O-N 3.33Å; A427-W431 PolarHBondContact O-N 3.13Å
428	A	92.9	Very high	91.5	Very high	5 Å²	5	55.8 Å²	55.8	4%	0.041	29%	0.285	C	S	.	.	H	α-helix	trans	-65.9	-48.8	173.4	0	0	0	0	0	111.3	V416 N425 L426 D430 W431 E432	V416-A428 HydrophobicContact CG1-CB 3.65Å; N425-A428 PolarHBondContact O-N 3Å; L426-A428 VanDerWaalsContact C-N 3.34Å; L426-A428 PolarHBondContact O-N 3.34Å; A428-D430 VanDerWaalsContact C-N 3.32Å; A428-D430 PolarHBondContact O-N 3.43Å; A428-W431 CarbonylContact O-C 3.55Å; A428-W431 WeakPolarHBondContact O-CA 3.22Å; A428-W431 WeakPolarHBondContact O-CB 3.23Å; A428-W431 PolarHBondContact O-N 3.34Å; A428-E432 WeakPolarHBondContact O-CG 3.45Å; A428-E432 PolarHBondContact O-N 3.18Å
429	M	92.3	Very high	91.7	Very high	46 Å²	46	54 Å²	54	23%	0.227	28%	0.276	C	S	.	.	H	α-helix	trans	-63.9	-33.5	180	-71.7	-173.6	-69	0	0	113.3	N425 L426 W431 A433 R455	N425-M429 HydrophobicContact CB-CE 4.06Å; N425-M429 WeakPolarHBondContact O-CB 3.49Å; N425-M429 WeakPolarHBondContact O-CG 3.48Å; N425-M429 PolarHBondContact O-N 2.9Å; L426-M429 HydrophobicContact CD2-CE 4.04Å; L426-M429 PolarHBondContact O-N 3.5Å; M429-W431 VanDerWaalsContact C-N 3.35Å; M429-A433 WeakPolarHBondContact O-CB 3.24Å; M429-A433 PolarHBondContact O-N 2.82Å; M429-R455 PolarHBondContact O-NH1 3.49Å
430	D	93	Very high	91.8	Very high	56 Å²	56	54.6 Å²	54.6	30%	0.299	29%	0.285	S	S	.	.	H	α-helix	trans	-72.5	-26.9	173.8	-73	-25.5	0	0	0	112.4	T304 S306 L426 A428	T304-D430 HydrophobicContact CG2-CB 4.24Å; T304-D430 PolarHBondContact OG1-O 3.11Å; T304-D430 VanDerWaalsContact OG1-O 3.12Å; S306-D430 WeakPolarHBondContact CB-OD2 3.46Å; S306-D430 PolarHBondContact OG-OD2 3.47Å; L426-D430 WeakPolarHBondContact O-CB 3.35Å; L426-D430 VanDerWaalsContact O-CG 3.3Å; L426-D430 PolarHBondContact O-N 3.35Å; A428-D430 VanDerWaalsContact C-N 3.32Å; A428-D430 PolarHBondContact O-N 3.43Å
431	W	95.2	Very high	92.2	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-78.8	-46	172.5	-177.1	87.2	0	0	0	111.1	E255 I299 T304 L313 V316 V416 A427 A428 M429 A433 K434 F435	E255-W431 HydrophobicContact CG-CZ3 4.12Å; I299-W431 HydrophobicContact CG2-CH2 4.27Å; I299-W431 HydrophobicContact CG2-CZ2 4.13Å; T304-W431 HydrophobicContact CG2-CB 4.09Å; L313-W431 HydrophobicContact CB-CZ2 3.92Å; L313-W431 HydrophobicContact CD1-CH2 3.77Å; L313-W431 HydrophobicContact CD1-CZ2 3.78Å; L313-W431 HydrophobicContact CD1-CZ3 4.21Å; L313-W431 HydrophobicContact CD2-CZ2 4.27Å; L313-W431 HydrophobicContact CG-CZ2 4.19Å; V316-W431 HydrophobicContact CG2-CG 4.43Å; V416-W431 HydrophobicContact CG2-CE3 4.44Å; V416-W431 HydrophobicContact CG2-CZ3 4.23Å; A427-W431 PolarHBondContact O-N 3.13Å; A428-W431 CarbonylContact O-C 3.55Å; A428-W431 WeakPolarHBondContact O-CA 3.22Å; A428-W431 WeakPolarHBondContact O-CB 3.23Å; A428-W431 PolarHBondContact O-N 3.34Å; M429-W431 VanDerWaalsContact C-N 3.35Å; W431-A433 VanDerWaalsContact C-N 3.27Å; W431-A433 PolarHBondContact O-N 3.36Å; W431-K434 CarbonylContact O-C 3.4Å; W431-K434 WeakPolarHBondContact O-CA 3.45Å; W431-K434 PolarHBondContact O-N 2.84Å; W431-F435 HydrophobicContact CH2-CB 4.32Å; W431-F435 HydrophobicContact CH2-CD2 4.21Å; W431-F435 HydrophobicContact CH2-CG 4.39Å; W431-F435 HydrophobicContact CZ3-CB 4.32Å; W431-F435 HydrophobicContact CZ3-CG 4.49Å; W431-F435 PolarHBondContact O-N 2.96Å
432	E	95.7	Very high	92.5	Very high	0 Å²	0	51 Å²	51	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-54.9	-41.2	173	-74.4	167.2	-112.5	0	0	112	R253 E255 A428 K434 F435 I436 A453 R455	R253-E432 IonicContact CZ-OE1 2.66Å; R253-E432 IonicContact CZ-OE2 3.51Å; R253-E432 IonicContact NE-OE1 2.85Å; R253-E432 PolarHBondContact NE-OE1 3.38Å; R253-E432 IonicContact NE-OE2 3.45Å; R253-E432 VanDerWaalsContact NH2-CD 3.25Å; R253-E432 IonicContact NH2-OE1 2.84Å; R253-E432 PolarHBondContact NH2-OE1 2.88Å; R253-E432 IonicContact NH2-OE2 3.85Å; R253-E432 PolarHBondContact NH2-OE2 3.16Å; E255-E432 HydrophobicContact CG-CG 4.18Å; A428-E432 WeakPolarHBondContact O-CG 3.45Å; A428-E432 PolarHBondContact O-N 3.18Å; E432-K434 VanDerWaalsContact C-N 3.3Å; E432-K434 PolarHBondContact O-N 3.18Å; E432-F435 WeakPolarHBondContact O-CB 3.19Å; E432-F435 PolarHBondContact O-N 3.48Å; E432-I436 VanDerWaalsContact O-CG1 3.32Å; E432-I436 WeakPolarHBondContact O-CG1 3.26Å; E432-I436 PolarHBondContact O-N 3.28Å; E432-A453 HydrophobicContact CB-CB 4.21Å; E432-A453 HydrophobicContact CG-CB 4.23Å; E432-R455 VanDerWaalsContact CB-CD 3.48Å; E432-R455 HydrophobicContact CB-CG 3.83Å; E432-R455 VanDerWaalsContact OE2-CB 3.31Å; E432-R455 WeakPolarHBondContact OE2-CB 3.3Å; E432-R455 VanDerWaalsContact OE2-CG 3.24Å; E432-R455 WeakPolarHBondContact OE2-CG 3.26Å; E432-R455 PolarHBondContact OE2-N 3.38Å
433	A	94.3	Very high	92.8	Very high	39 Å²	39	57.8 Å²	57.8	32%	0.322	29%	0.291	S	S	.	.	H	α-helix	trans	-61.1	-40.3	175.9	0	0	0	0	0	111.8	M429 W431 E437	M429-A433 WeakPolarHBondContact O-CB 3.24Å; M429-A433 PolarHBondContact O-N 2.82Å; W431-A433 VanDerWaalsContact C-N 3.27Å; W431-A433 PolarHBondContact O-N 3.36Å; A433-E437 PolarHBondContact O-N 3.12Å
434	K	94.6	Very high	92.9	Very high	66 Å²	66	53.7 Å²	53.7	29%	0.287	27%	0.272	S	S	.	.	H	α-helix	trans	-74.1	-33	177.8	-167.9	49.6	164.1	-178.7	0	112.6	W431 E432 E437 F438	W431-K434 CarbonylContact O-C 3.4Å; W431-K434 WeakPolarHBondContact O-CA 3.45Å; W431-K434 PolarHBondContact O-N 2.84Å; E432-K434 VanDerWaalsContact C-N 3.3Å; E432-K434 PolarHBondContact O-N 3.18Å; K434-E437 HydrophobicContact CD-CB 4.4Å; K434-E437 VanDerWaalsContact CD-OE2 3.28Å; K434-E437 WeakPolarHBondContact CD-OE2 3.4Å; K434-E437 IonicContact NZ-OE1 3.23Å; K434-E437 PolarHBondContact NZ-OE1 2.81Å; K434-E437 IonicContact NZ-OE2 2.73Å; K434-E437 PolarHBondContact NZ-OE2 3.02Å; K434-E437 PolarHBondContact O-N 3Å; K434-F438 VanDerWaalsContact O-CB 3.32Å; K434-F438 WeakPolarHBondContact O-CB 3.31Å; K434-F438 PolarHBondContact O-N 3Å
435	F	96.1	Very high	93.1	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-62.1	-48.1	170	166.3	-98.9	0	0	0	111.7	E255 L257 I299 L302 W431 E432 E437 F438 V439 A453	E255-F435 HydrophobicContact CB-CE1 4.03Å; E255-F435 HydrophobicContact CB-CZ 4.18Å; E255-F435 HydrophobicContact CG-CD1 4.19Å; E255-F435 HydrophobicContact CG-CE1 4.12Å; L257-F435 HydrophobicContact CD1-CE2 3.92Å; L257-F435 HydrophobicContact CD1-CZ 3.71Å; L257-F435 HydrophobicContact CD2-CE2 4.45Å; L257-F435 HydrophobicContact CD2-CZ 4.47Å; L257-F435 HydrophobicContact CG-CE2 4.46Å; L257-F435 HydrophobicContact CG-CZ 4.09Å; I299-F435 HydrophobicContact CD1-CE2 4.14Å; I299-F435 HydrophobicContact CG1-CD2 4.47Å; I299-F435 HydrophobicContact CG1-CE2 4.42Å; I299-F435 HydrophobicContact CG2-CD2 3.98Å; I299-F435 HydrophobicContact CG2-CE2 4.18Å; L302-F435 HydrophobicContact CD1-CB 4.24Å; W431-F435 HydrophobicContact CH2-CB 4.32Å; W431-F435 HydrophobicContact CH2-CD2 4.21Å; W431-F435 HydrophobicContact CH2-CG 4.39Å; W431-F435 HydrophobicContact CZ3-CB 4.32Å; W431-F435 HydrophobicContact CZ3-CG 4.49Å; W431-F435 PolarHBondContact O-N 2.96Å; E432-F435 WeakPolarHBondContact O-CB 3.19Å; E432-F435 PolarHBondContact O-N 3.48Å; F435-E437 PolarHBondContact O-N 3.38Å; F435-F438 PolarHBondContact O-N 2.99Å; F435-V439 HydrophobicContact CD2-CG2 3.94Å; F435-V439 HydrophobicContact CE2-CG2 3.67Å; F435-V439 HydrophobicContact CZ-CG2 4.06Å; F435-V439 WeakPolarHBondContact O-CG2 3.36Å; F435-V439 PolarHBondContact O-N 3.45Å; F435-A453 HydrophobicContact CD1-CB 4.04Å; F435-A453 HydrophobicContact CE1-CB 4.15Å
436	I	95.5	Very high	93.1	Very high	22 Å²	22	55.4 Å²	55.4	11%	0.113	29%	0.292	C	S	.	.	H	α-helix	trans	-58.8	-47.1	174.6	-68.3	163.4	0	0	0	110.9	E432 F438 N440 F451 A453 R455	E432-I436 VanDerWaalsContact O-CG1 3.32Å; E432-I436 WeakPolarHBondContact O-CG1 3.26Å; E432-I436 PolarHBondContact O-N 3.28Å; I436-F438 VanDerWaalsContact C-N 3.33Å; I436-F438 PolarHBondContact O-N 3.01Å; I436-N440 WeakPolarHBondContact O-CB 3.33Å; I436-N440 PolarHBondContact O-N 2.7Å; I436-F451 HydrophobicContact CG1-CE2 4.47Å; I436-F451 HydrophobicContact CG2-CE2 4.29Å; I436-A453 HydrophobicContact CD1-CB 4.04Å; I436-A453 HydrophobicContact CG1-CB 4.04Å; I436-R455 HydrophobicContact CD1-CG 3.82Å
437	E	94.8	Very high	93.2	Very high	119 Å²	119	52.3 Å²	52.3	56%	0.556	28%	0.276	S	S	*	.	H	α-helix	trans	-57.9	-45.8	177.7	-168.4	-152.2	123.6	0	0	111.5	A433 K434 F435 G441	A433-E437 PolarHBondContact O-N 3.12Å; K434-E437 HydrophobicContact CD-CB 4.4Å; K434-E437 VanDerWaalsContact CD-OE2 3.28Å; K434-E437 WeakPolarHBondContact CD-OE2 3.4Å; K434-E437 IonicContact NZ-OE1 3.23Å; K434-E437 PolarHBondContact NZ-OE1 2.81Å; K434-E437 IonicContact NZ-OE2 2.73Å; K434-E437 PolarHBondContact NZ-OE2 3.02Å; K434-E437 PolarHBondContact O-N 3Å; F435-E437 PolarHBondContact O-N 3.38Å; E437-G441 PolarHBondContact O-N 3.11Å; E437-G441 VanDerWaalsContact O-N 3.15Å
438	F	95.7	Very high	93.3	Very high	52 Å²	52	54.6 Å²	54.6	23%	0.228	29%	0.288	C	S	.	.	H	α-helix	trans	-65.5	-53.3	179.9	175.1	-98.8	0	0	0	112.4	L295 S298 I299 L302 K434 F435 I436 N440 G441 Y442	L295-F438 HydrophobicContact CD1-CE1 3.86Å; L295-F438 HydrophobicContact CD1-CZ 4.45Å; S298-F438 VanDerWaalsContact CB-CZ 3.44Å; I299-F438 HydrophobicContact CG1-CD1 4.06Å; I299-F438 HydrophobicContact CG1-CE1 3.85Å; L302-F438 HydrophobicContact CD1-CB 4.2Å; L302-F438 HydrophobicContact CD1-CD1 4.36Å; L302-F438 HydrophobicContact CD1-CG 4.35Å; L302-F438 HydrophobicContact CD2-CB 4.01Å; L302-F438 HydrophobicContact CD2-CD2 4.08Å; L302-F438 HydrophobicContact CD2-CG 3.94Å; K434-F438 VanDerWaalsContact O-CB 3.32Å; K434-F438 WeakPolarHBondContact O-CB 3.31Å; K434-F438 PolarHBondContact O-N 3Å; F435-F438 PolarHBondContact O-N 2.99Å; I436-F438 VanDerWaalsContact C-N 3.33Å; I436-F438 PolarHBondContact O-N 3.01Å; F438-N440 PolarHBondContact O-N 2.71Å; F438-G441 CarbonylContact O-C 3.36Å; F438-G441 PolarHBondContact O-N 3.49Å; F438-G441 VanDerWaalsContact O-N 3.12Å; F438-Y442 HydrophobicContact CE1-CD2 4.24Å; F438-Y442 HydrophobicContact CE2-CD2 4.37Å; F438-Y442 AromaticContact CZ-CD2 3.72Å; F438-Y442 HydrophobicContact CZ-CD2 3.72Å; F438-Y442 HydrophobicContact CZ-CE2 4.34Å; F438-Y442 HydrophobicContact CZ-CG 4.5Å; F438-Y442 WeakPolarHBondContact O-CB 3.33Å; F438-Y442 PolarHBondContact O-N 3.34Å
439	V	95.1	Very high	93.4	Very high	5 Å²	5	56 Å²	56	3%	0.03	29%	0.294	C	S	.	.	H	α-helix	trans	-67.4	-35.9	-174.9	-178.6	0	0	0	0	111.6	L257 I299 F435 G441 Y442 I449 F451	L257-V439 HydrophobicContact CD2-CG1 4.29Å; L257-V439 HydrophobicContact CD2-CG2 4.23Å; I299-V439 HydrophobicContact CD1-CG2 4.45Å; F435-V439 HydrophobicContact CD2-CG2 3.94Å; F435-V439 HydrophobicContact CE2-CG2 3.67Å; F435-V439 HydrophobicContact CZ-CG2 4.06Å; F435-V439 WeakPolarHBondContact O-CG2 3.36Å; F435-V439 PolarHBondContact O-N 3.45Å; V439-G441 VanDerWaalsContact C-N 3.32Å; V439-G441 PolarHBondContact O-N 3.03Å; V439-Y442 PolarHBondContact O-N 3.26Å; V439-I449 HydrophobicContact CG1-CG2 3.82Å; V439-F451 HydrophobicContact CB-CD1 4.33Å; V439-F451 HydrophobicContact CB-CD2 4.33Å; V439-F451 HydrophobicContact CB-CE1 4.46Å; V439-F451 HydrophobicContact CB-CE2 4.46Å; V439-F451 HydrophobicContact CB-CG 4.27Å; V439-F451 HydrophobicContact CG1-CB 4.07Å; V439-F451 HydrophobicContact CG1-CD1 3.46Å; V439-F451 VanDerWaalsContact CG1-CD1 3.46Å; V439-F451 HydrophobicContact CG1-CD2 4.17Å; V439-F451 HydrophobicContact CG1-CE1 3.91Å; V439-F451 HydrophobicContact CG1-CG 3.62Å; V439-F451 HydrophobicContact CG1-CZ 4.44Å
440	N	92.4	Very high	93.5	Very high	100 Å²	100	54.8 Å²	54.8	54%	0.535	29%	0.29	S	S	.	.	H	α-helix	trans	-68.5	-30.2	174.1	-166.2	14.1	0	0	0	112.6	I436 F438 F451	I436-N440 WeakPolarHBondContact O-CB 3.33Å; I436-N440 PolarHBondContact O-N 2.7Å; F438-N440 PolarHBondContact O-N 2.71Å; N440-F451 HydrophobicContact CB-CZ 4.01Å
441	G	92.4	Very high	93.7	Very high	58 Å²	58	52.6 Å²	52.6	60%	0.598	28%	0.278	S	S	*	.	H	α-helix	trans	-76.7	-26	172.5	0	0	0	0	0	114.2	E437 F438 V439 R443	E437-G441 PolarHBondContact O-N 3.11Å; E437-G441 VanDerWaalsContact O-N 3.15Å; F438-G441 CarbonylContact O-C 3.36Å; F438-G441 PolarHBondContact O-N 3.49Å; F438-G441 VanDerWaalsContact O-N 3.12Å; V439-G441 VanDerWaalsContact C-N 3.32Å; V439-G441 PolarHBondContact O-N 3.03Å; G441-R443 PolarHBondContact O-N 2.91Å
442	Y	93.3	Very high	93.7	Very high	43 Å²	43	54 Å²	54	17%	0.169	28%	0.284	C	S	.	.			trans	-77.1	118.4	-173.4	-170.8	-86.2	0	0	0	111.8	L295 F438 V439 H444 M447 I449	L295-Y442 HydrophobicContact CD1-CD1 3.96Å; L295-Y442 HydrophobicContact CD1-CD2 4.11Å; L295-Y442 HydrophobicContact CD1-CE1 3.92Å; L295-Y442 HydrophobicContact CD1-CE2 4.08Å; L295-Y442 HydrophobicContact CD1-CG 4.05Å; L295-Y442 HydrophobicContact CD2-CE1 4.49Å; F438-Y442 HydrophobicContact CE1-CD2 4.24Å; F438-Y442 HydrophobicContact CE2-CD2 4.37Å; F438-Y442 AromaticContact CZ-CD2 3.72Å; F438-Y442 HydrophobicContact CZ-CD2 3.72Å; F438-Y442 HydrophobicContact CZ-CE2 4.34Å; F438-Y442 HydrophobicContact CZ-CG 4.5Å; F438-Y442 WeakPolarHBondContact O-CB 3.33Å; F438-Y442 PolarHBondContact O-N 3.34Å; V439-Y442 PolarHBondContact O-N 3.26Å; Y442-H444 HydrophobicContact CE1-CB 3.95Å; Y442-M447 HydrophobicContact CE1-CE 4.04Å; Y442-I449 HydrophobicContact CD1-CD1 3.68Å; Y442-I449 HydrophobicContact CE1-CD1 4.07Å
443	R	88.6	Confident	93.7	Very high	228 Å²	228	54 Å²	54	86%	0.86	28%	0.284	S	S	*	.			trans	-127.6	123	-179.9	-65	-175.9	178.6	-164.6	-2.4	110.7	G441	G441-R443 PolarHBondContact O-N 2.91Å
444	H	90.2	Very high	93.5	Very high	53 Å²	53	54.5 Å²	54.5	25%	0.245	28%	0.28	C	S	.	.			trans	-127.4	140.4	-179.5	-155.5	-109.1	0	0	0	111.2	D291 Y442 N446 M447	D291-H444 IonicContact OD1-CE1 3.81Å; D291-H444 PolarHBondContact OD1-CE1 2.96Å; D291-H444 IonicContact OD2-CE1 3.71Å; D291-H444 PolarHBondContact OD2-CE1 3.02Å; D291-H444 VanDerWaalsContact OD2-CE1 3.23Å; D291-H444 IonicContact OD2-ND1 2.8Å; Y442-H444 HydrophobicContact CE1-CB 3.95Å; H444-N446 VanDerWaalsContact C-N 3.34Å; H444-N446 PolarHBondContact O-N 2.94Å; H444-M447 HydrophobicContact CB-CE 3.92Å; H444-M447 HydrophobicContact CB-CG 3.8Å
445	P	89.9	Confident	93.4	Very high	101 Å²	101	53.9 Å²	53.9	66%	0.656	28%	0.275	S	S	*	.	S	Bend	trans	-71	-25.7	-177.7	27.8	-35.6	0	0	0	113.9	N262	N262-P445 PolarHBondContact ND2-O 3.29Å
446	N	90.2	Very high	93.2	Very high	74 Å²	74	53.9 Å²	53.9	40%	0.396	28%	0.275	S	S	.	.	S	Bend	trans	-88.4	-19.6	-171.8	-64.2	-13.7	0	0	0	114.2	N262 D291 H444	N262-N446 PolarHBondContact N-O 3.37Å; D291-N446 VanDerWaalsContact OD2-CB 3.29Å; D291-N446 WeakPolarHBondContact OD2-CB 3.46Å; D291-N446 PolarHBondContact OD2-ND2 3.4Å; H444-N446 VanDerWaalsContact C-N 3.34Å; H444-N446 PolarHBondContact O-N 2.94Å
447	M	92.9	Very high	92.8	Very high	8 Å²	8	55 Å²	55	4%	0.039	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	157	-171.8	61.6	171	123	0	0	112.9	I259 V260 N262 F288 D291 V292 L295 Y442 H444 I449	I259-M447 HydrophobicContact CG2-CB 3.99Å; I259-M447 HydrophobicContact CG2-CG 4.38Å; I259-M447 HydrophobicContact CG2-SD 3.63Å; V260-M447 CarbonylContact O-C 3.03Å; V260-M447 WeakPolarHBondContact O-CA 3.45Å; N262-M447 PolarHBondContact ND2-N 3.35Å; N262-M447 PolarHBondContact ND2-O 3.03Å; F288-M447 HydrophobicContact CD2-CB 4.31Å; F288-M447 HydrophobicContact CE2-CB 3.79Å; D291-M447 HydrophobicContact CB-CE 3.8Å; V292-M447 HydrophobicContact CG2-SD 4.39Å; L295-M447 HydrophobicContact CD2-SD 4.25Å; Y442-M447 HydrophobicContact CE1-CE 4.04Å; H444-M447 HydrophobicContact CB-CE 3.92Å; H444-M447 HydrophobicContact CB-CG 3.8Å; M447-I449 HydrophobicContact CG-CG1 4.38Å; M447-I449 HydrophobicContact SD-CD1 3.89Å; M447-I449 HydrophobicContact SD-CG1 3.89Å
448	T	93.8	Very high	92.4	Very high	72 Å²	72	53.5 Å²	53.5	44%	0.442	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	140.7	161.6	33.1	0	0	0	0	108.8	I259 V260 N262	I259-T448 WeakPolarHBondContact CA-O 3.12Å; V260-T448 PolarHBondContact N-O 3.49Å; V260-T448 PolarHBondContact O-N 3.32Å; V260-T448 PolarHBondContact O-OG1 3.22Å; N262-T448 WeakPolarHBondContact OD1-CG2 3.39Å; N262-T448 PolarHBondContact OD1-N 3.11Å; N262-T448 PolarHBondContact OD1-OG1 3.21Å
449	I	95.2	Very high	92	Very high	35 Å²	35	53.4 Å²	53.4	18%	0.179	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	123.6	-176.1	-56.9	164.3	0	0	0	107.6	L257 I259 L295 V439 Y442 M447 F451	L257-I449 HydrophobicContact CB-CG2 4.38Å; L257-I449 HydrophobicContact CD2-CG2 4.05Å; I259-I449 HydrophobicContact CG1-CG1 4.48Å; I259-I449 HydrophobicContact CG2-CG1 4.26Å; L295-I449 HydrophobicContact CD2-CD1 3.67Å; L295-I449 HydrophobicContact CD2-CG1 4.38Å; V439-I449 HydrophobicContact CG1-CG2 3.82Å; Y442-I449 HydrophobicContact CD1-CD1 3.68Å; Y442-I449 HydrophobicContact CE1-CD1 4.07Å; M447-I449 HydrophobicContact CG-CG1 4.38Å; M447-I449 HydrophobicContact SD-CD1 3.89Å; M447-I449 HydrophobicContact SD-CG1 3.89Å; I449-F451 HydrophobicContact CG2-CB 4.45Å; I449-F451 HydrophobicContact CG2-CD1 4.49Å
450	S	95.6	Very high	91.7	Very high	19 Å²	19	53.9 Å²	53.9	13%	0.133	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	122.1	171	-54.8	0	0	0	0	108.3	I258	I258-S450 PolarHBondContact N-O 2.96Å; I258-S450 PolarHBondContact O-N 3.13Å
451	F	96	Very high	91.3	Very high	11 Å²	11	52.2 Å²	52.2	5%	0.048	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	152.8	-164.3	66.2	-83.1	0	0	0	113.2	Q256 L257 I436 V439 N440 I449 Y720 M721	Q256-F451 CarbonylContact O-C 3.16Å; Q256-F451 VanDerWaalsContact O-CA 3.26Å; Q256-F451 WeakPolarHBondContact O-CA 3.4Å; L257-F451 HydrophobicContact CG-CB 4.24Å; I436-F451 HydrophobicContact CG1-CE2 4.47Å; I436-F451 HydrophobicContact CG2-CE2 4.29Å; V439-F451 HydrophobicContact CB-CD1 4.33Å; V439-F451 HydrophobicContact CB-CD2 4.33Å; V439-F451 HydrophobicContact CB-CE1 4.46Å; V439-F451 HydrophobicContact CB-CE2 4.46Å; V439-F451 HydrophobicContact CB-CG 4.27Å; V439-F451 HydrophobicContact CG1-CB 4.07Å; V439-F451 HydrophobicContact CG1-CD1 3.46Å; V439-F451 VanDerWaalsContact CG1-CD1 3.46Å; V439-F451 HydrophobicContact CG1-CD2 4.17Å; V439-F451 HydrophobicContact CG1-CE1 3.91Å; V439-F451 HydrophobicContact CG1-CG 3.62Å; V439-F451 HydrophobicContact CG1-CZ 4.44Å; N440-F451 HydrophobicContact CB-CZ 4.01Å; I449-F451 HydrophobicContact CG2-CB 4.45Å; I449-F451 HydrophobicContact CG2-CD1 4.49Å; F451-Y720 HydrophobicContact CD2-CD2 4.12Å; F451-Y720 HydrophobicContact CD2-CE2 4.09Å; F451-Y720 HydrophobicContact CE1-CD2 4.01Å; F451-Y720 HydrophobicContact CE1-CG 4.48Å; F451-Y720 AromaticContact CE2-CD2 3.5Å; F451-Y720 HydrophobicContact CE2-CD2 3.5Å; F451-Y720 VanDerWaalsContact CE2-CD2 3.5Å; F451-Y720 AromaticContact CE2-CE2 3.45Å; F451-Y720 HydrophobicContact CE2-CE2 3.45Å; F451-Y720 VanDerWaalsContact CE2-CE2 3.45Å; F451-Y720 HydrophobicContact CE2-CG 4.43Å; F451-Y720 AromaticContact CZ-CD2 3.43Å; F451-Y720 HydrophobicContact CZ-CD2 3.43Å; F451-Y720 VanDerWaalsContact CZ-CD2 3.43Å; F451-Y720 AromaticContact CZ-CE2 3.84Å; F451-Y720 HydrophobicContact CZ-CE2 3.84Å; F451-Y720 AromaticContact CZ-CG 3.98Å; F451-Y720 HydrophobicContact CZ-CG 3.98Å; F451-M721 WeakPolarHBondContact O-CE 3.41Å
452	K	95.1	Very high	90.9	Very high	30 Å²	30	56.9 Å²	56.9	13%	0.13	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	140.5	170.5	177.1	-171.1	171.2	-146.7	0	109.3	E255 Q256 E454 M721 Y724	E255-K452 CarbonylContact C-O 3.59Å; E255-K452 WeakPolarHBondContact CA-O 3.47Å; Q256-K452 PolarHBondContact N-O 3.44Å; Q256-K452 PolarHBondContact O-N 3.44Å; K452-E454 IonicContact NZ-OE2 3.77Å; K452-E454 PolarHBondContact NZ-OE2 2.86Å; K452-M721 HydrophobicContact CB-CE 3.84Å; K452-M721 HydrophobicContact CG-CE 4.1Å; K452-M721 HydrophobicContact CG-SD 4.4Å; K452-Y724 HydrophobicContact CB-CD1 4.1Å; K452-Y724 HydrophobicContact CB-CD2 3.86Å; K452-Y724 HydrophobicContact CB-CE1 3.9Å; K452-Y724 HydrophobicContact CB-CE2 3.63Å; K452-Y724 HydrophobicContact CB-CG 4.08Å; K452-Y724 HydrophobicContact CD-CE1 4.04Å; K452-Y724 HydrophobicContact CG-CE1 4.44Å
453	A	95.1	Very high	90.6	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	28%	0.277	C	S	.	.			trans	-111.4	161.5	152.6	0	0	0	0	0	109.6	E255 E432 F435 I436 R455 S456	E255-A453 HydrophobicContact CG-CB 3.8Å; E432-A453 HydrophobicContact CB-CB 4.21Å; E432-A453 HydrophobicContact CG-CB 4.23Å; F435-A453 HydrophobicContact CD1-CB 4.04Å; F435-A453 HydrophobicContact CE1-CB 4.15Å; I436-A453 HydrophobicContact CD1-CB 4.04Å; I436-A453 HydrophobicContact CG1-CB 4.04Å; A453-R455 VanDerWaalsContact C-N 3.31Å; A453-R455 HydrophobicContact CB-CG 4.46Å; A453-R455 PolarHBondContact O-N 2.78Å; A453-S456 PolarHBondContact N-OG 2.75Å; A453-S456 VanDerWaalsContact N-OG 3.16Å; A453-S456 VanDerWaalsContact O-CB 3.23Å; A453-S456 WeakPolarHBondContact O-CB 3.5Å; A453-S456 PolarHBondContact O-N 2.98Å; A453-S456 PolarHBondContact O-OG 3.15Å
454	E	91.9	Very high	90.2	Very high	49 Å²	49	49.1 Å²	49.1	23%	0.229	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-37.4	-176.4	-174.8	62.1	-177.8	0	0	112.4	R253 E255 K452 S456	R253-E454 HydrophobicContact CB-CB 4.07Å; R253-E454 HydrophobicContact CB-CG 4.44Å; E255-E454 PolarHBondContact OE1-N 2.79Å; K452-E454 IonicContact NZ-OE2 3.77Å; K452-E454 PolarHBondContact NZ-OE2 2.86Å; E454-S456 VanDerWaalsContact C-N 3.29Å; E454-S456 PolarHBondContact O-N 3.32Å
455	R	91.2	Very high	89.7	Confident	52 Å²	52	47.3 Å²	47.3	20%	0.196	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-18.1	173.4	69.4	177.8	-70.4	141.1	15.7	115.8	M429 E432 I436 A453 I457 E458 D459	M429-R455 PolarHBondContact O-NH1 3.49Å; E432-R455 VanDerWaalsContact CB-CD 3.48Å; E432-R455 HydrophobicContact CB-CG 3.83Å; E432-R455 VanDerWaalsContact OE2-CB 3.31Å; E432-R455 WeakPolarHBondContact OE2-CB 3.3Å; E432-R455 VanDerWaalsContact OE2-CG 3.24Å; E432-R455 WeakPolarHBondContact OE2-CG 3.26Å; E432-R455 PolarHBondContact OE2-N 3.38Å; I436-R455 HydrophobicContact CD1-CG 3.82Å; A453-R455 VanDerWaalsContact C-N 3.31Å; A453-R455 HydrophobicContact CB-CG 4.46Å; A453-R455 PolarHBondContact O-N 2.78Å; R455-I457 PolarHBondContact O-N 3.41Å; R455-E458 PolarHBondContact O-N 3.38Å; R455-E458 VanDerWaalsContact O-N 3.11Å; R455-D459 IonicContact CZ-OD1 2.82Å; R455-D459 IonicContact CZ-OD2 2.67Å; R455-D459 VanDerWaalsContact CZ-OD2 3.3Å; R455-D459 IonicContact NE-OD1 2.63Å; R455-D459 IonicContact NE-OD2 2.67Å; R455-D459 PolarHBondContact NE-OD2 3.25Å; R455-D459 IonicContact NH2-OD1 3.42Å; R455-D459 PolarHBondContact NH2-OD1 2.98Å; R455-D459 IonicContact NH2-OD2 3.14Å; R455-D459 PolarHBondContact NH2-OD2 3.01Å; R455-D459 PolarHBondContact O-N 2.97Å
456	S	92	Very high	89.3	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-55.8	-32	-173	-70.9	0	0	0	0	113.5	A453 E454 E460 Y720	A453-S456 PolarHBondContact N-OG 2.75Å; A453-S456 VanDerWaalsContact N-OG 3.16Å; A453-S456 VanDerWaalsContact O-CB 3.23Å; A453-S456 WeakPolarHBondContact O-CB 3.5Å; A453-S456 PolarHBondContact O-N 2.98Å; A453-S456 PolarHBondContact O-OG 3.15Å; E454-S456 VanDerWaalsContact C-N 3.29Å; E454-S456 PolarHBondContact O-N 3.32Å; S456-E460 WeakPolarHBondContact O-CB 3.42Å; S456-E460 WeakPolarHBondContact O-CG 3.3Å; S456-E460 PolarHBondContact O-N 3.11Å; S456-E460 VanDerWaalsContact O-N 3.17Å; S456-Y720 VanDerWaalsContact CB-OH 3.24Å; S456-Y720 WeakPolarHBondContact CB-OH 3.37Å; S456-Y720 PolarHBondContact OG-OH 2.92Å
457	I	87.6	Confident	88.9	Confident	47 Å²	47	46.6 Å²	46.6	24%	0.241	23%	0.23	C	C	.	.	H	α-helix	trans	-70	-43.3	-179	-66.9	175.8	0	0	0	111.5	R455 I461 M715	R455-I457 PolarHBondContact O-N 3.41Å; I457-I461 HydrophobicContact CG2-CD1 3.97Å; I457-I461 WeakPolarHBondContact O-CB 3.05Å; I457-I461 WeakPolarHBondContact O-CD1 3.38Å; I457-I461 VanDerWaalsContact O-CG1 3.26Å; I457-I461 WeakPolarHBondContact O-CG1 3Å; I457-I461 PolarHBondContact O-N 3.27Å; I457-M715 HydrophobicContact CB-CE 4.12Å; I457-M715 HydrophobicContact CG1-CE 3.87Å; I457-M715 HydrophobicContact CG2-CE 3.95Å
458	E	85.5	Confident	88.4	Confident	87 Å²	87	46.2 Å²	46.2	41%	0.407	23%	0.228	S	C	.	.	H	α-helix	trans	-71.4	-42.8	179.4	-173	173.1	-170.4	0	0	111.3	T224 R455 E460 I461 R462	T224-E458 VanDerWaalsContact CB-OE1 3.25Å; T224-E458 WeakPolarHBondContact CB-OE1 3.27Å; T224-E458 PolarHBondContact OG1-OE1 3Å; R455-E458 PolarHBondContact O-N 3.38Å; R455-E458 VanDerWaalsContact O-N 3.11Å; E458-E460 PolarHBondContact O-N 3.49Å; E458-I461 PolarHBondContact O-N 3.18Å; E458-R462 VanDerWaalsContact O-CB 3.28Å; E458-R462 WeakPolarHBondContact O-CB 3.36Å; E458-R462 PolarHBondContact O-N 3.12Å
459	D	88.7	Confident	87.9	Confident	50 Å²	50	45.9 Å²	45.9	27%	0.267	23%	0.225	S	C	.	.	H	α-helix	trans	-61.8	-42.2	178.7	-73.2	-38.7	0	0	0	112.3	R455 R462 R463	R455-D459 IonicContact CZ-OD1 2.82Å; R455-D459 IonicContact CZ-OD2 2.67Å; R455-D459 VanDerWaalsContact CZ-OD2 3.3Å; R455-D459 IonicContact NE-OD1 2.63Å; R455-D459 IonicContact NE-OD2 2.67Å; R455-D459 PolarHBondContact NE-OD2 3.25Å; R455-D459 IonicContact NH2-OD1 3.42Å; R455-D459 PolarHBondContact NH2-OD1 2.98Å; R455-D459 IonicContact NH2-OD2 3.14Å; R455-D459 PolarHBondContact NH2-OD2 3.01Å; R455-D459 PolarHBondContact O-N 2.97Å; D459-R462 PolarHBondContact O-N 3.09Å; D459-R463 WeakPolarHBondContact O-CB 3.31Å; D459-R463 PolarHBondContact O-N 2.89Å
460	E	88.2	Confident	87.5	Confident	14 Å²	14	47 Å²	47	7%	0.065	24%	0.24	C	C	.	.	H	α-helix	trans	-73.7	-36.2	-179.5	-76.9	-67.5	111	0	0	113.2	S456 E458 R462 R463 A464 M715 S719 Y720 M721	S456-E460 WeakPolarHBondContact O-CB 3.42Å; S456-E460 WeakPolarHBondContact O-CG 3.3Å; S456-E460 PolarHBondContact O-N 3.11Å; S456-E460 VanDerWaalsContact O-N 3.17Å; E458-E460 PolarHBondContact O-N 3.49Å; E460-R462 VanDerWaalsContact C-N 3.31Å; E460-R463 PolarHBondContact O-N 3.06Å; E460-R463 IonicContact OE1-CZ 2.73Å; E460-R463 IonicContact OE1-NE 2.75Å; E460-R463 PolarHBondContact OE1-NE 3.27Å; E460-R463 IonicContact OE1-NH2 4Å; E460-R463 IonicContact OE2-CZ 2.8Å; E460-R463 IonicContact OE2-NE 3.19Å; E460-R463 PolarHBondContact OE2-NE 2.88Å; E460-R463 IonicContact OE2-NH2 3.84Å; E460-R463 PolarHBondContact OE2-NH2 3.27Å; E460-A464 PolarHBondContact O-N 3.23Å; E460-M715 HydrophobicContact CB-SD 3.79Å; E460-S719 VanDerWaalsContact CD-OG 3.31Å; E460-S719 WeakPolarHBondContact OE2-CB 3.38Å; E460-S719 PolarHBondContact OE2-OG 3.03Å; E460-Y720 HydrophobicContact CG-CE1 3.83Å; E460-M721 HydrophobicContact CG-CG 4.17Å
461	I	83.4	Confident	87	Confident	65 Å²	65	46.9 Å²	46.9	33%	0.333	24%	0.238	S	C	.	.	H	α-helix	trans	-64.1	-40.1	171.5	-70.6	169.9	0	0	0	110.2	I457 E458 A464 S465	I457-I461 HydrophobicContact CG2-CD1 3.97Å; I457-I461 WeakPolarHBondContact O-CB 3.05Å; I457-I461 WeakPolarHBondContact O-CD1 3.38Å; I457-I461 VanDerWaalsContact O-CG1 3.26Å; I457-I461 WeakPolarHBondContact O-CG1 3Å; I457-I461 PolarHBondContact O-N 3.27Å; E458-I461 PolarHBondContact O-N 3.18Å; I461-A464 WeakPolarHBondContact O-CB 3.2Å; I461-A464 PolarHBondContact O-N 3.31Å; I461-S465 PolarHBondContact O-N 3.28Å
462	R	83.7	Confident	86.5	Confident	157 Å²	157	47.5 Å²	47.5	59%	0.592	24%	0.242	S	C	*	.	H	α-helix	trans	-66.7	-38.7	174.9	-174.3	175.9	-179.8	173.8	2.5	112.3	E458 D459 E460 A464 H466	E458-R462 VanDerWaalsContact O-CB 3.28Å; E458-R462 WeakPolarHBondContact O-CB 3.36Å; E458-R462 PolarHBondContact O-N 3.12Å; D459-R462 PolarHBondContact O-N 3.09Å; E460-R462 VanDerWaalsContact C-N 3.31Å; R462-A464 VanDerWaalsContact C-N 3.32Å; R462-A464 PolarHBondContact O-N 3.43Å; R462-H466 PolarHBondContact O-CD2 2.98Å; R462-H466 VanDerWaalsContact O-CD2 3.25Å; R462-H466 PolarHBondContact O-N 3.38Å
463	R	87.1	Confident	86.1	Confident	96 Å²	96	51 Å²	51	36%	0.362	26%	0.261	S	S	.	.	H	α-helix	trans	-59.9	-41.8	172.2	-172.2	171.8	74.3	90.3	-0.1	111.2	D459 E460 G467 D718	D459-R463 WeakPolarHBondContact O-CB 3.31Å; D459-R463 PolarHBondContact O-N 2.89Å; E460-R463 PolarHBondContact O-N 3.06Å; E460-R463 IonicContact OE1-CZ 2.73Å; E460-R463 IonicContact OE1-NE 2.75Å; E460-R463 PolarHBondContact OE1-NE 3.27Å; E460-R463 IonicContact OE1-NH2 4Å; E460-R463 IonicContact OE2-CZ 2.8Å; E460-R463 IonicContact OE2-NE 3.19Å; E460-R463 PolarHBondContact OE2-NE 2.88Å; E460-R463 IonicContact OE2-NH2 3.84Å; E460-R463 PolarHBondContact OE2-NH2 3.27Å; R463-G467 PolarHBondContact O-N 2.66Å; R463-D718 IonicContact CZ-OD1 2.9Å; R463-D718 IonicContact CZ-OD2 2.67Å; R463-D718 VanDerWaalsContact NH1-CG 3.34Å; R463-D718 IonicContact NH1-OD1 3.73Å; R463-D718 PolarHBondContact NH1-OD1 2.96Å; R463-D718 VanDerWaalsContact NH1-OD1 3.15Å; R463-D718 IonicContact NH1-OD2 3.2Å; R463-D718 PolarHBondContact NH1-OD2 3.09Å; R463-D718 IonicContact NH2-OD1 2.7Å; R463-D718 PolarHBondContact NH2-OD1 2.95Å; R463-D718 IonicContact NH2-OD2 3.18Å
464	A	81.4	Confident	85.9	Confident	12 Å²	12	55.6 Å²	55.6	10%	0.099	29%	0.285	C	S	.	.	H	α-helix	trans	-60.9	-57.6	178.5	0	0	0	0	0	112.4	E460 I461 R462 H466 G467 D468 P716	E460-A464 PolarHBondContact O-N 3.23Å; I461-A464 WeakPolarHBondContact O-CB 3.2Å; I461-A464 PolarHBondContact O-N 3.31Å; R462-A464 VanDerWaalsContact C-N 3.32Å; R462-A464 PolarHBondContact O-N 3.43Å; A464-H466 PolarHBondContact O-N 3.26Å; A464-G467 PolarHBondContact O-N 2.86Å; A464-D468 PolarHBondContact O-N 3.45Å; A464-D468 VanDerWaalsContact O-N 3.13Å; A464-P716 HydrophobicContact CB-CG 3.95Å
465	S	79.9	Confident	85.7	Confident	15 Å²	15	53.4 Å²	53.4	11%	0.105	28%	0.275	C	S	.	.	H	α-helix	trans	-58.9	-44.6	-178.4	170.1	0	0	0	0	111.9	I461 G467 D468 V469 E540	I461-S465 PolarHBondContact O-N 3.28Å; S465-G467 PolarHBondContact O-N 2.85Å; S465-D468 PolarHBondContact O-N 3.13Å; S465-V469 WeakPolarHBondContact O-CG2 3.34Å; S465-V469 PolarHBondContact O-N 2.93Å; S465-E540 PolarHBondContact OG-OE1 3.34Å
466	H	82.1	Confident	85.5	Confident	123 Å²	123	52 Å²	52	57%	0.569	27%	0.27	S	S	*	.	H	α-helix	trans	-59.1	-31.6	176.4	-76.5	-44.1	0	0	0	113.5	R462 A464	R462-H466 PolarHBondContact O-CD2 2.98Å; R462-H466 VanDerWaalsContact O-CD2 3.25Å; R462-H466 PolarHBondContact O-N 3.38Å; A464-H466 PolarHBondContact O-N 3.26Å
467	G	81	Confident	85.4	Confident	37 Å²	37	55.5 Å²	55.5	38%	0.381	29%	0.293	S	S	.	.	H	α-helix	trans	-70.6	-40.2	173.1	0	0	0	0	0	113.4	R463 A464 S465	R463-G467 PolarHBondContact O-N 2.66Å; A464-G467 PolarHBondContact O-N 2.86Å; S465-G467 PolarHBondContact O-N 2.85Å
468	D	81.8	Confident	85.5	Confident	0 Å²	0	56 Å²	56	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-76.2	-23.1	-175.1	-74.1	-46.4	0	0	0	114.4	A464 S465 A470 T471 I472 S1076 H1077 S1078 F1081	A464-D468 PolarHBondContact O-N 3.45Å; A464-D468 VanDerWaalsContact O-N 3.13Å; S465-D468 PolarHBondContact O-N 3.13Å; D468-A470 PolarHBondContact O-N 3.49Å; D468-A470 VanDerWaalsContact O-N 3.07Å; D468-T471 PolarHBondContact O-N 3.39Å; D468-T471 PolarHBondContact O-OG1 2.8Å; D468-I472 HydrophobicContact CB-CD1 4.48Å; D468-I472 PolarHBondContact O-N 3.19Å; D468-S1076 WeakPolarHBondContact OD1-CA 3.46Å; D468-S1076 WeakPolarHBondContact OD1-CB 3.43Å; D468-S1076 PolarHBondContact OD1-OG 2.99Å; D468-S1076 PolarHBondContact OD2-OG 3.23Å; D468-H1077 PolarHBondContact OD1-N 2.94Å; D468-S1078 WeakPolarHBondContact OD2-CB 3.4Å; D468-S1078 PolarHBondContact OD2-N 3.4Å; D468-F1081 HydrophobicContact CB-CD2 4.17Å; D468-F1081 HydrophobicContact CB-CE2 4.22Å; D468-F1081 WeakPolarHBondContact OD2-CD2 3.06Å
469	V	83	Confident	85.6	Confident	65 Å²	65	51.9 Å²	51.9	39%	0.394	28%	0.28	S	S	.	.	H	α-helix	trans	-47.5	-40.1	175.9	170.9	0	0	0	0	112.3	S465 T471 I472 L473	S465-V469 WeakPolarHBondContact O-CG2 3.34Å; S465-V469 PolarHBondContact O-N 2.93Å; V469-T471 PolarHBondContact O-N 3.18Å; V469-I472 PolarHBondContact O-N 2.74Å; V469-L473 HydrophobicContact CG1-CD1 3.96Å; V469-L473 HydrophobicContact CG1-CG 4.36Å; V469-L473 WeakPolarHBondContact O-CG 3.38Å; V469-L473 PolarHBondContact O-N 3.4Å
470	A	86.6	Confident	85.5	Confident	58 Å²	58	51.8 Å²	51.8	48%	0.479	28%	0.277	S	S	.	.	H	α-helix	trans	-63.8	-41	178.6	0	0	0	0	0	112.6	D468 L473 I474	D468-A470 PolarHBondContact O-N 3.49Å; D468-A470 VanDerWaalsContact O-N 3.07Å; A470-L473 PolarHBondContact O-N 2.68Å; A470-I474 VanDerWaalsContact O-CG1 3.3Å; A470-I474 WeakPolarHBondContact O-CG1 3.21Å; A470-I474 PolarHBondContact O-N 3.19Å; A470-I474 VanDerWaalsContact O-N 3.12Å
471	T	86.7	Confident	85.6	Confident	16 Å²	16	55.9 Å²	55.9	10%	0.098	30%	0.303	C	S	.	.	H	α-helix	trans	-70.3	-37.4	178.6	74	0	0	0	0	111.6	D468 V469 I474 S475 V1072	D468-T471 PolarHBondContact O-N 3.39Å; D468-T471 PolarHBondContact O-OG1 2.8Å; V469-T471 PolarHBondContact O-N 3.18Å; T471-I474 PolarHBondContact O-N 3.34Å; T471-S475 PolarHBondContact O-N 3.42Å; T471-V1072 WeakPolarHBondContact O-CG1 3.46Å
472	I	83.8	Confident	85.9	Confident	24 Å²	24	55.9 Å²	55.9	12%	0.123	30%	0.299	C	S	.	.	H	α-helix	trans	-64.1	-44.5	175.6	-66.9	168.9	0	0	0	110.4	D468 V469 I474 S475 Y476 L1073 F1081	D468-I472 HydrophobicContact CB-CD1 4.48Å; D468-I472 PolarHBondContact O-N 3.19Å; V469-I472 PolarHBondContact O-N 2.74Å; I472-I474 VanDerWaalsContact C-N 3.35Å; I472-I474 PolarHBondContact O-N 3.49Å; I472-S475 WeakPolarHBondContact O-CB 3.47Å; I472-S475 PolarHBondContact O-N 3.09Å; I472-Y476 HydrophobicContact CG2-CD2 3.78Å; I472-Y476 HydrophobicContact CG2-CE2 3.42Å; I472-Y476 VanDerWaalsContact CG2-CE2 3.42Å; I472-Y476 WeakPolarHBondContact O-CD2 3.29Å; I472-Y476 PolarHBondContact O-N 2.77Å; I472-L1073 HydrophobicContact CG1-CD2 4.26Å; I472-F1081 HydrophobicContact CD1-CE1 4.17Å; I472-F1081 HydrophobicContact CD1-CZ 4.02Å
473	L	87.7	Confident	86	Confident	103 Å²	103	48.6 Å²	48.6	54%	0.539	27%	0.272	S	S	.	.	H	α-helix	trans	-62.2	-38.9	174.7	-72.9	171.2	0	0	0	112.6	V469 A470 Y476 C477	V469-L473 HydrophobicContact CG1-CD1 3.96Å; V469-L473 HydrophobicContact CG1-CG 4.36Å; V469-L473 WeakPolarHBondContact O-CG 3.38Å; V469-L473 PolarHBondContact O-N 3.4Å; A470-L473 PolarHBondContact O-N 2.68Å; L473-Y476 PolarHBondContact O-N 2.85Å; L473-C477 PolarHBondContact O-N 3.07Å; L473-C477 PolarHBondContact O-SG 2.96Å; L473-C477 VanDerWaalsContact O-SG 3.34Å
474	I	90.1	Very high	86	Confident	98 Å²	98	44.4 Å²	44.4	50%	0.503	26%	0.258	S	S	.	.	H	α-helix	trans	-65	-41.4	174.3	-65.4	163.6	0	0	0	110.7	A470 T471 I472 Y476 C477 V478 V1072	A470-I474 VanDerWaalsContact O-CG1 3.3Å; A470-I474 WeakPolarHBondContact O-CG1 3.21Å; A470-I474 PolarHBondContact O-N 3.19Å; A470-I474 VanDerWaalsContact O-N 3.12Å; T471-I474 PolarHBondContact O-N 3.34Å; I472-I474 VanDerWaalsContact C-N 3.35Å; I472-I474 PolarHBondContact O-N 3.49Å; I474-Y476 PolarHBondContact O-N 3.16Å; I474-C477 PolarHBondContact O-N 3.29Å; I474-V478 HydrophobicContact CG2-CG2 4.47Å; I474-V478 WeakPolarHBondContact O-CG2 3.36Å; I474-V478 PolarHBondContact O-N 2.85Å; I474-V1072 HydrophobicContact CB-CG1 4.08Å; I474-V1072 HydrophobicContact CG2-CG1 3.82Å
475	S	87.6	Confident	86.1	Confident	3 Å²	3	47.2 Å²	47.2	2%	0.021	27%	0.273	C	S	.	.	H	α-helix	trans	-58.2	-46.9	175.6	-177.4	0	0	0	0	111.7	T471 I472 V478 M479 G1069	T471-S475 PolarHBondContact O-N 3.42Å; I472-S475 WeakPolarHBondContact O-CB 3.47Å; I472-S475 PolarHBondContact O-N 3.09Å; S475-V478 PolarHBondContact O-N 3.37Å; S475-M479 PolarHBondContact O-N 3.28Å; S475-G1069 VanDerWaalsContact OG-C 3.26Å; S475-G1069 VanDerWaalsContact OG-CA 3.28Å; S475-G1069 WeakPolarHBondContact OG-CA 3.01Å; S475-G1069 PolarHBondContact OG-O 3.39Å
476	Y	87.4	Confident	86.3	Confident	22 Å²	22	48 Å²	48	9%	0.086	28%	0.281	C	S	.	.	H	α-helix	trans	-60.7	-47.8	174	-77.8	-59	0	0	0	112.4	I472 L473 I474 V478 M479 F480 F517 F544 L547	I472-Y476 HydrophobicContact CG2-CD2 3.78Å; I472-Y476 HydrophobicContact CG2-CE2 3.42Å; I472-Y476 VanDerWaalsContact CG2-CE2 3.42Å; I472-Y476 WeakPolarHBondContact O-CD2 3.29Å; I472-Y476 PolarHBondContact O-N 2.77Å; L473-Y476 PolarHBondContact O-N 2.85Å; I474-Y476 PolarHBondContact O-N 3.16Å; Y476-V478 VanDerWaalsContact C-N 3.33Å; Y476-V478 PolarHBondContact O-N 2.9Å; Y476-M479 HydrophobicContact CD1-CE 3.62Å; Y476-M479 HydrophobicContact CE1-CE 3.96Å; Y476-M479 HydrophobicContact CG-CE 4.32Å; Y476-M479 PolarHBondContact O-N 3.02Å; Y476-M479 VanDerWaalsContact O-N 3.16Å; Y476-F480 HydrophobicContact CD1-CE1 4.03Å; Y476-F480 HydrophobicContact CD1-CZ 4.04Å; Y476-F480 HydrophobicContact CG-CE1 4.49Å; Y476-F480 HydrophobicContact CG-CZ 4.12Å; Y476-F480 WeakPolarHBondContact O-CD1 3.14Å; Y476-F480 WeakPolarHBondContact O-CD2 3.12Å; Y476-F480 WeakPolarHBondContact O-CG 3.45Å; Y476-F480 PolarHBondContact O-N 3.39Å; Y476-F517 HydrophobicContact CD1-CZ 4.03Å; Y476-F517 HydrophobicContact CE1-CZ 4.11Å; Y476-F544 WeakPolarHBondContact OH-CA 3.27Å; Y476-F544 WeakPolarHBondContact OH-CB 3.47Å; Y476-F544 PolarHBondContact OH-N 3.45Å; Y476-L547 HydrophobicContact CD1-CD2 3.64Å; Y476-L547 HydrophobicContact CE1-CD2 3.72Å
477	C	89.6	Confident	86.3	Confident	73 Å²	73	42.3 Å²	42.3	49%	0.493	25%	0.254	S	S	.	.	H	α-helix	trans	-57.4	-42.1	176.2	-74.7	0	0	0	0	113	L473 I474 F480 V481	L473-C477 PolarHBondContact O-N 3.07Å; L473-C477 PolarHBondContact O-SG 2.96Å; L473-C477 VanDerWaalsContact O-SG 3.34Å; I474-C477 PolarHBondContact O-N 3.29Å; C477-F480 PolarHBondContact O-N 2.87Å; C477-V481 WeakPolarHBondContact O-CG2 3.19Å; C477-V481 PolarHBondContact O-N 3.43Å
478	V	90.4	Very high	86	Confident	59 Å²	59	41.2 Å²	41.2	36%	0.358	24%	0.243	S	C	.	.	H	α-helix	trans	-63	-44.5	175.7	169.3	0	0	0	0	111.2	I474 S475 Y476 V481 Y482 V1072	I474-V478 HydrophobicContact CG2-CG2 4.47Å; I474-V478 WeakPolarHBondContact O-CG2 3.36Å; I474-V478 PolarHBondContact O-N 2.85Å; S475-V478 PolarHBondContact O-N 3.37Å; Y476-V478 VanDerWaalsContact C-N 3.33Å; Y476-V478 PolarHBondContact O-N 2.9Å; V478-V481 PolarHBondContact O-N 3.44Å; V478-Y482 PolarHBondContact O-N 3.19Å; V478-V1072 HydrophobicContact CB-CG2 4.44Å; V478-V1072 HydrophobicContact CG2-CG2 4.12Å
479	M	86.5	Confident	85.5	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-62.6	-42.3	175.4	-71.8	-174.6	-71.5	0	0	112	S475 Y476 Y482 I483 F544 L547 T1065 K1066	S475-M479 PolarHBondContact O-N 3.28Å; Y476-M479 HydrophobicContact CD1-CE 3.62Å; Y476-M479 HydrophobicContact CE1-CE 3.96Å; Y476-M479 HydrophobicContact CG-CE 4.32Å; Y476-M479 PolarHBondContact O-N 3.02Å; Y476-M479 VanDerWaalsContact O-N 3.16Å; M479-Y482 WeakPolarHBondContact O-CB 3.22Å; M479-Y482 PolarHBondContact O-N 3.26Å; M479-I483 WeakPolarHBondContact O-CB 3.48Å; M479-I483 WeakPolarHBondContact O-CD1 3.34Å; M479-I483 WeakPolarHBondContact O-CG1 3.07Å; M479-I483 PolarHBondContact O-N 3.02Å; M479-F544 HydrophobicContact CE-CD2 3.9Å; M479-F544 HydrophobicContact CE-CE2 3.98Å; M479-F544 HydrophobicContact SD-CD2 4.39Å; M479-F544 HydrophobicContact SD-CE2 3.99Å; M479-L547 HydrophobicContact CE-CD2 3.83Å; M479-L547 HydrophobicContact SD-CD2 4.14Å; M479-T1065 HydrophobicContact CB-CG2 4.32Å; M479-T1065 HydrophobicContact CG-CG2 4.21Å; M479-T1065 HydrophobicContact SD-CG2 4.49Å; M479-K1066 HydrophobicContact SD-CD 4.46Å
480	F	88.3	Confident	85	Confident	48 Å²	48	44.7 Å²	44.7	21%	0.211	25%	0.251	C	S	.	.	H	α-helix	trans	-66.4	-41	-179.7	-54.3	-17.6	0	0	0	112.3	Y476 C477 Y482 I483 A484 V513 F517 L547	Y476-F480 HydrophobicContact CD1-CE1 4.03Å; Y476-F480 HydrophobicContact CD1-CZ 4.04Å; Y476-F480 HydrophobicContact CG-CE1 4.49Å; Y476-F480 HydrophobicContact CG-CZ 4.12Å; Y476-F480 WeakPolarHBondContact O-CD1 3.14Å; Y476-F480 WeakPolarHBondContact O-CD2 3.12Å; Y476-F480 WeakPolarHBondContact O-CG 3.45Å; Y476-F480 PolarHBondContact O-N 3.39Å; C477-F480 PolarHBondContact O-N 2.87Å; F480-Y482 VanDerWaalsContact C-N 3.34Å; F480-I483 PolarHBondContact O-N 2.8Å; F480-A484 VanDerWaalsContact O-CB 3.3Å; F480-A484 WeakPolarHBondContact O-CB 3.31Å; F480-A484 PolarHBondContact O-N 3.3Å; F480-V513 HydrophobicContact CD1-CB 4.44Å; F480-V513 HydrophobicContact CD1-CG1 3.54Å; F480-V513 HydrophobicContact CD1-CG2 4.04Å; F480-V513 HydrophobicContact CE1-CG1 3.44Å; F480-V513 VanDerWaalsContact CE1-CG1 3.44Å; F480-V513 HydrophobicContact CE2-CG1 4.45Å; F480-V513 HydrophobicContact CG-CG1 4.12Å; F480-V513 HydrophobicContact CZ-CG1 3.93Å; F480-F517 AromaticContact CE1-CE2 3.66Å; F480-F517 HydrophobicContact CE1-CE2 3.66Å; F480-F517 HydrophobicContact CE1-CZ 4.2Å; F480-F517 HydrophobicContact CE2-CE2 4.47Å; F480-F517 HydrophobicContact CZ-CD2 4.47Å; F480-F517 AromaticContact CZ-CE2 3.37Å; F480-F517 HydrophobicContact CZ-CE2 3.37Å; F480-F517 AromaticContact CZ-CZ 3.72Å; F480-F517 HydrophobicContact CZ-CZ 3.72Å; F480-L547 HydrophobicContact CE1-CD1 4.49Å; F480-L547 HydrophobicContact CE1-CD2 3.92Å
481	V	88.6	Confident	84	Confident	100 Å²	100	44.4 Å²	44.4	61%	0.606	24%	0.242	S	C	*	.	H	α-helix	trans	-63.4	-41.3	174.2	171.2	0	0	0	0	110.5	C477 V478 V485	C477-V481 WeakPolarHBondContact O-CG2 3.19Å; C477-V481 PolarHBondContact O-N 3.43Å; V478-V481 PolarHBondContact O-N 3.44Å; V481-V485 WeakPolarHBondContact O-CB 3.34Å; V481-V485 VanDerWaalsContact O-CG2 3.29Å; V481-V485 WeakPolarHBondContact O-CG2 3.49Å; V481-V485 PolarHBondContact O-N 3.38Å
482	Y	90.4	Very high	82.8	Confident	65 Å²	65	47.3 Å²	47.3	26%	0.255	26%	0.259	S	S	.	.	H	α-helix	trans	-60.6	-49.8	173.8	-178.5	-95.6	0	0	0	112	V478 M479 F480 V485 A486 F555 S1060 L1064 T1065	V478-Y482 PolarHBondContact O-N 3.19Å; M479-Y482 WeakPolarHBondContact O-CB 3.22Å; M479-Y482 PolarHBondContact O-N 3.26Å; F480-Y482 VanDerWaalsContact C-N 3.34Å; Y482-V485 PolarHBondContact O-N 3.44Å; Y482-A486 HydrophobicContact CD1-CB 4.36Å; Y482-A486 HydrophobicContact CE1-CB 3.85Å; Y482-A486 HydrophobicContact CE2-CB 4.09Å; Y482-A486 VanDerWaalsContact O-CB 3.3Å; Y482-A486 WeakPolarHBondContact O-CB 3.29Å; Y482-A486 PolarHBondContact O-N 3.31Å; Y482-F555 HydrophobicContact CE1-CZ 4.3Å; Y482-S1060 WeakPolarHBondContact CE1-O 3.42Å; Y482-S1060 PolarHBondContact OH-O 3.32Å; Y482-L1064 HydrophobicContact CE1-CB 4.24Å; Y482-L1064 HydrophobicContact CE2-CB 4.15Å; Y482-L1064 WeakPolarHBondContact OH-CB 3.38Å; Y482-L1064 WeakPolarHBondContact OH-CD1 3.06Å; Y482-T1065 HydrophobicContact CD1-CG2 4.33Å; Y482-T1065 WeakPolarHBondContact CD1-OG1 3.38Å; Y482-T1065 VanDerWaalsContact CE1-OG1 3.25Å; Y482-T1065 WeakPolarHBondContact CE1-OG1 3.36Å
483	I	86.6	Confident	81.7	Confident	4 Å²	4	48.2 Å²	48.2	2%	0.021	26%	0.262	C	S	.	.	H	α-helix	trans	-61.1	-49.2	-178.5	-69.7	159.9	0	0	0	111.6	M479 F480 V485 L487 V513 L547 V551 F555 T1065	M479-I483 WeakPolarHBondContact O-CB 3.48Å; M479-I483 WeakPolarHBondContact O-CD1 3.34Å; M479-I483 WeakPolarHBondContact O-CG1 3.07Å; M479-I483 PolarHBondContact O-N 3.02Å; F480-I483 PolarHBondContact O-N 2.8Å; I483-V485 PolarHBondContact O-N 2.92Å; I483-L487 HydrophobicContact CG2-CD1 4.05Å; I483-L487 WeakPolarHBondContact O-CG 3.35Å; I483-L487 PolarHBondContact O-N 3.18Å; I483-V513 HydrophobicContact CB-CG2 4.5Å; I483-V513 HydrophobicContact CD1-CG2 3.84Å; I483-V513 HydrophobicContact CG2-CG2 4.04Å; I483-L547 HydrophobicContact CD1-CD1 4.48Å; I483-V551 HydrophobicContact CD1-CB 4.4Å; I483-V551 HydrophobicContact CD1-CG1 3.85Å; I483-V551 HydrophobicContact CD1-CG2 3.6Å; I483-V551 HydrophobicContact CG1-CG1 3.76Å; I483-V551 HydrophobicContact CG1-CG2 4.41Å; I483-F555 HydrophobicContact CB-CE2 4.45Å; I483-F555 HydrophobicContact CG1-CE2 4.26Å; I483-F555 HydrophobicContact CG2-CE2 4.2Å; I483-T1065 HydrophobicContact CD1-CG2 4.1Å; I483-T1065 HydrophobicContact CG1-CG2 4.07Å
484	A	85.7	Confident	80.4	Confident	8 Å²	8	49.6 Å²	49.6	7%	0.066	27%	0.269	C	S	.	.	H	α-helix	trans	-65.2	-27.5	-178.2	0	0	0	0	0	112.7	F480 I506 L510	F480-A484 VanDerWaalsContact O-CB 3.3Å; F480-A484 WeakPolarHBondContact O-CB 3.31Å; F480-A484 PolarHBondContact O-N 3.3Å; A484-I506 HydrophobicContact CB-CG2 4.21Å; A484-I506 WeakPolarHBondContact O-CA 3.39Å; A484-I506 WeakPolarHBondContact O-CG1 3.41Å; A484-L510 HydrophobicContact CB-CD2 4.46Å; A484-L510 HydrophobicContact CB-CG 4.29Å
485	V	84.5	Confident	79	Confident	70 Å²	70	52.4 Å²	52.4	42%	0.424	29%	0.286	S	S	.	.	H	α-helix	trans	-81.8	-58.7	172.8	173.2	0	0	0	0	111.2	V481 Y482 I483 L487 G488 Y490	V481-V485 WeakPolarHBondContact O-CB 3.34Å; V481-V485 VanDerWaalsContact O-CG2 3.29Å; V481-V485 WeakPolarHBondContact O-CG2 3.49Å; V481-V485 PolarHBondContact O-N 3.38Å; Y482-V485 PolarHBondContact O-N 3.44Å; I483-V485 PolarHBondContact O-N 2.92Å; V485-L487 PolarHBondContact O-N 3.05Å; V485-G488 PolarHBondContact O-N 3.48Å; V485-Y490 WeakPolarHBondContact CA-OH 3.18Å; V485-Y490 HydrophobicContact CG1-CE2 3.87Å; V485-Y490 VanDerWaalsContact O-CE2 3.26Å; V485-Y490 WeakPolarHBondContact O-CE2 3.35Å; V485-Y490 PolarHBondContact O-OH 2.88Å
486	A	84.4	Confident	77.9	Confident	32 Å²	32	56.9 Å²	56.9	26%	0.264	31%	0.31	S	S	.	.	H	α-helix	trans	-69	-8	-166.2	0	0	0	0	0	115.7	Y482 F555	Y482-A486 HydrophobicContact CD1-CB 4.36Å; Y482-A486 HydrophobicContact CE1-CB 3.85Å; Y482-A486 HydrophobicContact CE2-CB 4.09Å; Y482-A486 VanDerWaalsContact O-CB 3.3Å; Y482-A486 WeakPolarHBondContact O-CB 3.29Å; Y482-A486 PolarHBondContact O-N 3.31Å; A486-F555 HydrophobicContact CB-CE1 3.9Å; A486-F555 HydrophobicContact CB-CZ 3.9Å
487	L	81.8	Confident	77.2	Confident	3 Å²	3	61.5 Å²	61.5	2%	0.016	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-18.2	168.6	-70.5	174.9	0	0	0	114	I483 V485 K505 I554 F555 I558 Q562	I483-L487 HydrophobicContact CG2-CD1 4.05Å; I483-L487 WeakPolarHBondContact O-CG 3.35Å; I483-L487 PolarHBondContact O-N 3.18Å; V485-L487 PolarHBondContact O-N 3.05Å; L487-K505 HydrophobicContact CB-CB 4.05Å; L487-I554 HydrophobicContact CD1-CG2 4.08Å; L487-I554 HydrophobicContact CD2-CG2 4.45Å; L487-F555 HydrophobicContact CD1-CE2 4.22Å; L487-F555 HydrophobicContact CD2-CB 4.47Å; L487-F555 HydrophobicContact CD2-CD1 4Å; L487-F555 HydrophobicContact CD2-CD2 3.5Å; L487-F555 HydrophobicContact CD2-CE1 4.05Å; L487-F555 HydrophobicContact CD2-CE2 3.59Å; L487-F555 HydrophobicContact CD2-CG 3.72Å; L487-F555 HydrophobicContact CD2-CZ 3.86Å; L487-F555 HydrophobicContact CG-CD2 4.12Å; L487-F555 HydrophobicContact CG-CE1 4.43Å; L487-F555 HydrophobicContact CG-CE2 3.69Å; L487-F555 HydrophobicContact CG-CZ 3.85Å; L487-I558 HydrophobicContact CD1-CD1 4.01Å; L487-I558 HydrophobicContact CD2-CB 4.27Å; L487-I558 HydrophobicContact CD2-CD1 3.79Å; L487-I558 HydrophobicContact CD2-CG2 4.29Å; L487-I558 HydrophobicContact CG-CD1 4.37Å; L487-Q562 PolarHBondContact O-NE2 3.18Å
488	G	74	Confident	76.4	Confident	14 Å²	14	61.2 Å²	61.2	14%	0.144	33%	0.331	C	S	.	.	S	Bend	trans	-85.1	151.5	-177.7	0	0	0	0	0	114.3	V485	V485-G488 PolarHBondContact O-N 3.48Å
489	Q	72.5	Confident	75.5	Confident	42 Å²	42	59.2 Å²	59.2	20%	0.196	32%	0.319	C	S	.	.			trans	-99.3	123.6	166.7	-66.2	-176.5	-12.1	0	0	109.3	Q562	Q489-Q562 VanDerWaalsContact NE2-CD 3.32Å
490	Y	72.3	Confident	75	Confident	96 Å²	96	60.6 Å²	60.6	38%	0.376	33%	0.327	S	S	.	.			trans	-106.5	30.9	-169.1	-70.8	-74.9	0	0	0	114.1	V485 I500	V485-Y490 WeakPolarHBondContact CA-OH 3.18Å; V485-Y490 HydrophobicContact CG1-CE2 3.87Å; V485-Y490 VanDerWaalsContact O-CE2 3.26Å; V485-Y490 WeakPolarHBondContact O-CE2 3.35Å; V485-Y490 PolarHBondContact O-OH 2.88Å; Y490-I500 HydrophobicContact CD1-CG2 3.55Å; Y490-I500 HydrophobicContact CE1-CG2 3.92Å
491	D	65.8	Low	74.5	Confident	52 Å²	52	63.5 Å²	63.5	28%	0.278	34%	0.339	S	S	.	.			trans	-75.6	130.3	178.8	-58.3	-80.6	0	0	0	111.4	Y493 S662	D491-Y493 HydrophobicContact CB-CD2 4.24Å; D491-Y493 HydrophobicContact CB-CE1 4.22Å; D491-Y493 HydrophobicContact CB-CE2 3.43Å; D491-Y493 VanDerWaalsContact CB-CE2 3.43Å; D491-Y493 VanDerWaalsContact CB-CZ 3.42Å; D491-Y493 WeakPolarHBondContact CB-OH 3.5Å; D491-S662 VanDerWaalsContact CG-OG 3.23Å; D491-S662 WeakPolarHBondContact OD1-CB 3.31Å; D491-S662 PolarHBondContact OD1-OG 3.4Å; D491-S662 VanDerWaalsContact OD2-CB 3.28Å; D491-S662 WeakPolarHBondContact OD2-CB 3.28Å; D491-S662 PolarHBondContact OD2-OG 3.48Å
492	V	60.9	Low	73.9	Confident	77 Å²	77	59.4 Å²	59.4	47%	0.467	31%	0.314	S	S	.	.			trans	-91.9	114.2	177.3	-176.2	0	0	0	0	109.1	L497 I500	V492-L497 HydrophobicContact CG1-CD2 4.28Å; V492-L497 HydrophobicContact CG2-CD2 4.23Å; V492-I500 HydrophobicContact CG2-CD1 4.13Å; V492-I500 HydrophobicContact CG2-CG1 4.45Å
493	Y	61.5	Low	73.2	Confident	43 Å²	43	58.1 Å²	58.1	17%	0.169	31%	0.309	C	S	.	.			trans	-107	138.1	178.8	-60.6	-72.2	0	0	0	111.9	D491 D495 N496 S499 R503 T660	D491-Y493 HydrophobicContact CB-CD2 4.24Å; D491-Y493 HydrophobicContact CB-CE1 4.22Å; D491-Y493 HydrophobicContact CB-CE2 3.43Å; D491-Y493 VanDerWaalsContact CB-CE2 3.43Å; D491-Y493 VanDerWaalsContact CB-CZ 3.42Å; D491-Y493 WeakPolarHBondContact CB-OH 3.5Å; Y493-D495 VanDerWaalsContact C-N 3.28Å; Y493-D495 PolarHBondContact O-N 2.94Å; Y493-N496 PolarHBondContact O-N 2.82Å; Y493-S499 PolarHBondContact N-OG 3.07Å; Y493-R503 VanDerWaalsContact CE2-NH1 3.33Å; Y493-R503 PolarHBondContact OH-NH1 3.05Å; Y493-T660 WeakPolarHBondContact CD1-OG1 3.47Å; Y493-T660 WeakPolarHBondContact CE1-OG1 3.14Å; Y493-T660 PolarHBondContact OH-O 2.83Å
494	N	59.2	Low	73	Confident	132 Å²	132	58 Å²	58	71%	0.706	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.4	41.4	176	-58.9	-44.5	0	0	0	114	N496	N494-N496 PolarHBondContact O-N 3.47Å; N494-N496 PolarHBondContact O-ND2 2.56Å
495	D	61.5	Low	73	Confident	158 Å²	158	57.9 Å²	57.9	85%	0.845	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.5	8.3	-174.7	-61.5	-33	0	0	0	116	Y493 L497	Y493-D495 VanDerWaalsContact C-N 3.28Å; Y493-D495 PolarHBondContact O-N 2.94Å; D495-L497 PolarHBondContact O-N 3.13Å
496	N	65	Low	73	Confident	97 Å²	97	57.3 Å²	57.3	52%	0.519	30%	0.3	S	S	.	.			trans	-93.3	93.1	-176.3	-84.2	-83.6	0	0	0	110.2	Y493 N494 V498 S499	Y493-N496 PolarHBondContact O-N 2.82Å; N494-N496 PolarHBondContact O-N 3.47Å; N494-N496 PolarHBondContact O-ND2 2.56Å; N496-V498 PolarHBondContact O-N 2.85Å; N496-S499 VanDerWaalsContact O-CB 3.3Å; N496-S499 WeakPolarHBondContact O-CB 3.25Å; N496-S499 PolarHBondContact O-N 3.08Å; N496-S499 PolarHBondContact O-OG 2.99Å
497	L	71.5	Confident	73.2	Confident	119 Å²	119	59.8 Å²	59.8	62%	0.623	31%	0.309	S	S	*	.	G	3₁₀ helix	trans	-52.1	-24.9	173.5	-67.2	172.2	0	0	0	113.6	V492 D495 S499 I500	V492-L497 HydrophobicContact CG1-CD2 4.28Å; V492-L497 HydrophobicContact CG2-CD2 4.23Å; D495-L497 PolarHBondContact O-N 3.13Å; L497-S499 PolarHBondContact O-N 3.43Å; L497-I500 HydrophobicContact CD2-CD1 4.32Å; L497-I500 WeakPolarHBondContact O-CB 3.49Å; L497-I500 WeakPolarHBondContact O-CG1 3.27Å; L497-I500 PolarHBondContact O-N 3.27Å
498	V	73.7	Confident	73.6	Confident	67 Å²	67	59.8 Å²	59.8	41%	0.406	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-65.2	-24.9	175.7	-177.2	0	0	0	0	112.6	N496 I500 F501 L647 V655	N496-V498 PolarHBondContact O-N 2.85Å; V498-I500 PolarHBondContact O-N 2.99Å; V498-F501 PolarHBondContact O-N 3.13Å; V498-F501 VanDerWaalsContact O-N 3.13Å; V498-L647 HydrophobicContact CG1-CD1 4.03Å; V498-L647 HydrophobicContact CG1-CD2 3.91Å; V498-V655 HydrophobicContact CG1-CG2 4.36Å
499	S	71.3	Confident	74.3	Confident	16 Å²	16	59.1 Å²	59.1	11%	0.112	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-60.9	-30.3	177.7	61.9	0	0	0	0	113.2	Y493 N496 L497 F501 V502	Y493-S499 PolarHBondContact N-OG 3.07Å; N496-S499 VanDerWaalsContact O-CB 3.3Å; N496-S499 WeakPolarHBondContact O-CB 3.25Å; N496-S499 PolarHBondContact O-N 3.08Å; N496-S499 PolarHBondContact O-OG 2.99Å; L497-S499 PolarHBondContact O-N 3.43Å; S499-F501 VanDerWaalsContact C-N 3.28Å; S499-F501 PolarHBondContact O-N 3.48Å; S499-V502 WeakPolarHBondContact O-CB 2.97Å; S499-V502 PolarHBondContact O-N 3.03Å; S499-V502 VanDerWaalsContact O-N 3.08Å
500	I	76.2	Confident	75.1	Confident	30 Å²	30	60.9 Å²	60.9	15%	0.154	31%	0.312	C	S	.	.	H	α-helix	trans	-54.2	-45.9	174.3	-58.1	172	0	0	0	110.4	Y490 V492 L497 V498 V502 R503 S504	Y490-I500 HydrophobicContact CD1-CG2 3.55Å; Y490-I500 HydrophobicContact CE1-CG2 3.92Å; V492-I500 HydrophobicContact CG2-CD1 4.13Å; V492-I500 HydrophobicContact CG2-CG1 4.45Å; L497-I500 HydrophobicContact CD2-CD1 4.32Å; L497-I500 WeakPolarHBondContact O-CB 3.49Å; L497-I500 WeakPolarHBondContact O-CG1 3.27Å; L497-I500 PolarHBondContact O-N 3.27Å; V498-I500 PolarHBondContact O-N 2.99Å; I500-V502 PolarHBondContact O-N 3.11Å; I500-V502 VanDerWaalsContact O-N 3.13Å; I500-R503 PolarHBondContact O-N 3.39Å; I500-S504 WeakPolarHBondContact O-CB 3.41Å; I500-S504 PolarHBondContact O-N 3.12Å; I500-S504 PolarHBondContact O-OG 3.06Å
501	F	78.4	Confident	76	Confident	108 Å²	108	59 Å²	59	47%	0.474	31%	0.309	S	S	.	.	H	α-helix	trans	-73.4	-1	-177	-66.8	-73.1	0	0	0	114.4	V498 S499 S504 L647 E648	V498-F501 PolarHBondContact O-N 3.13Å; V498-F501 VanDerWaalsContact O-N 3.13Å; S499-F501 VanDerWaalsContact C-N 3.28Å; S499-F501 PolarHBondContact O-N 3.48Å; F501-S504 WeakPolarHBondContact CA-OG 3.22Å; F501-L647 HydrophobicContact CB-CD2 3.97Å; F501-L647 WeakPolarHBondContact O-CA 3.32Å; F501-E648 PolarHBondContact O-N 2.93Å; F501-E648 VanDerWaalsContact O-N 3.13Å
502	V	76	Confident	77.2	Confident	14 Å²	14	56.6 Å²	56.6	9%	0.085	30%	0.296	C	S	.	.	H	α-helix	trans	-87.2	-50.2	168	-172	0	0	0	0	110	S499 I500 R641 L647 V655	S499-V502 WeakPolarHBondContact O-CB 2.97Å; S499-V502 PolarHBondContact O-N 3.03Å; S499-V502 VanDerWaalsContact O-N 3.08Å; I500-V502 PolarHBondContact O-N 3.11Å; I500-V502 VanDerWaalsContact O-N 3.13Å; V502-R641 PolarHBondContact O-NH1 2.88Å; V502-R641 PolarHBondContact O-NH2 3.07Å; V502-L647 HydrophobicContact CG2-CD2 3.62Å; V502-V655 HydrophobicContact CG2-CB 3.87Å; V502-V655 HydrophobicContact CG2-CG2 3.91Å
503	R	74.7	Confident	78.6	Confident	39 Å²	39	53.3 Å²	53.3	15%	0.147	28%	0.276	C	S	.	.	H	α-helix	trans	-86.8	-9.9	-177.2	-71.3	-169	-179.9	179.9	6.2	114.2	Y493 I500 D658 T660	Y493-R503 VanDerWaalsContact CE2-NH1 3.33Å; Y493-R503 PolarHBondContact OH-NH1 3.05Å; I500-R503 PolarHBondContact O-N 3.39Å; R503-D658 PolarHBondContact NH2-O 2.97Å; R503-T660 VanDerWaalsContact CZ-O 3.3Å; R503-T660 PolarHBondContact NH1-O 3.1Å; R503-T660 PolarHBondContact NH2-O 2.88Å
504	S	81.8	Confident	80.1	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	30%	0.296	C	S	.	.			trans	-59	151.3	170.8	62.6	0	0	0	0	111.5	I500 F501 R641 E648	I500-S504 WeakPolarHBondContact O-CB 3.41Å; I500-S504 PolarHBondContact O-N 3.12Å; I500-S504 PolarHBondContact O-OG 3.06Å; F501-S504 WeakPolarHBondContact CA-OG 3.22Å; S504-R641 PolarHBondContact O-NH2 3.36Å; S504-R641 VanDerWaalsContact O-NH2 3.09Å; S504-E648 VanDerWaalsContact C-CD 3.49Å; S504-E648 VanDerWaalsContact C-OE2 3.22Å; S504-E648 WeakPolarHBondContact CB-OE2 3.4Å; S504-E648 PolarHBondContact OG-OE2 3.42Å
505	K	85.5	Confident	81.7	Confident	6 Å²	6	50.6 Å²	50.6	3%	0.026	26%	0.264	C	S	.	.			trans	-127.8	27.6	-176.9	-58	-66.9	169.1	170	0	110.7	L487 L508 G509 D638 E642 E648	L487-K505 HydrophobicContact CB-CB 4.05Å; K505-L508 HydrophobicContact CB-CB 4.33Å; K505-L508 HydrophobicContact CD-CD2 4.08Å; K505-L508 PolarHBondContact O-N 3.2Å; K505-G509 PolarHBondContact O-N 3.32Å; K505-D638 VanDerWaalsContact CD-OD2 3.22Å; K505-D638 WeakPolarHBondContact CD-OD2 3.41Å; K505-D638 WeakPolarHBondContact CE-OD2 3.34Å; K505-D638 IonicContact NZ-OD2 2.66Å; K505-D638 PolarHBondContact NZ-OD2 3.04Å; K505-E642 WeakPolarHBondContact CE-OE2 3.47Å; K505-E642 IonicContact NZ-OE2 3.53Å; K505-E642 PolarHBondContact NZ-OE2 3.37Å; K505-E648 VanDerWaalsContact C-OE1 3.22Å; K505-E648 WeakPolarHBondContact CA-OE1 3.48Å; K505-E648 PolarHBondContact N-OE2 2.83Å
506	I	86.4	Confident	83.2	Confident	59 Å²	59	43.1 Å²	43.1	30%	0.303	22%	0.224	S	C	.	.	H	α-helix	trans	-63.5	-44.6	-174.7	-65.7	166.4	0	0	0	109.7	A484 G509 L510 E648	A484-I506 HydrophobicContact CB-CG2 4.21Å; A484-I506 WeakPolarHBondContact O-CA 3.39Å; A484-I506 WeakPolarHBondContact O-CG1 3.41Å; I506-G509 PolarHBondContact O-N 3.38Å; I506-L510 HydrophobicContact CG2-CD1 4.33Å; I506-L510 WeakPolarHBondContact O-CG 3.45Å; I506-L510 PolarHBondContact O-N 2.74Å; I506-L510 VanDerWaalsContact O-N 3.1Å; I506-E648 WeakPolarHBondContact CB-OE2 3.1Å; I506-E648 PolarHBondContact N-OE1 3.14Å; I506-E648 PolarHBondContact N-OE2 3.39Å
507	L	88.1	Confident	84.5	Confident	83 Å²	83	41.2 Å²	41.2	44%	0.435	21%	0.211	S	C	.	.	H	α-helix	trans	-68.7	-41.1	178.1	-178.7	59.6	0	0	0	110.8	L510 L511 E648	L507-L510 PolarHBondContact O-N 3.03Å; L507-L511 HydrophobicContact CD1-CD1 4.16Å; L507-L511 HydrophobicContact CD1-CG 4.3Å; L507-L511 HydrophobicContact CG-CD1 3.96Å; L507-L511 WeakPolarHBondContact O-CB 3.47Å; L507-L511 VanDerWaalsContact O-CG 3.25Å; L507-L511 WeakPolarHBondContact O-CG 3.3Å; L507-L511 PolarHBondContact O-N 3.13Å; L507-E648 WeakPolarHBondContact CB-OE1 3.37Å; L507-E648 PolarHBondContact N-OE1 3.09Å
508	L	90.4	Very high	85.6	Confident	3 Å²	3	37.2 Å²	37.2	2%	0.016	19%	0.19	C	C	.	.	H	α-helix	trans	-64	-39.5	176.9	-176.6	65.4	0	0	0	112	K505 L511 G512 I558 F631 F635 D638	K505-L508 HydrophobicContact CB-CB 4.33Å; K505-L508 HydrophobicContact CD-CD2 4.08Å; K505-L508 PolarHBondContact O-N 3.2Å; L508-L511 PolarHBondContact O-N 3.39Å; L508-G512 PolarHBondContact O-N 2.95Å; L508-I558 HydrophobicContact CD2-CD1 3.67Å; L508-I558 HydrophobicContact CD2-CG1 4.39Å; L508-I558 HydrophobicContact CG-CD1 4.33Å; L508-F631 HydrophobicContact CD1-CE2 3.78Å; L508-F631 HydrophobicContact CD1-CZ 3.91Å; L508-F631 HydrophobicContact CD2-CZ 4.41Å; L508-F631 HydrophobicContact CG-CE2 4.12Å; L508-F631 HydrophobicContact CG-CZ 3.99Å; L508-F635 HydrophobicContact CD1-CB 4.41Å; L508-F635 HydrophobicContact CD2-CD2 3.74Å; L508-F635 HydrophobicContact CD2-CE2 4.38Å; L508-D638 HydrophobicContact CD1-CB 4.46Å
509	G	88.3	Confident	86.6	Confident	1 Å²	1	34 Å²	34	1%	0.01	17%	0.171	C	C	.	.	H	α-helix	trans	-64.1	-45.9	175.2	0	0	0	0	0	112.7	K505 I506 L511 G512 V513	K505-G509 PolarHBondContact O-N 3.32Å; I506-G509 PolarHBondContact O-N 3.38Å; G509-L511 PolarHBondContact O-N 3.41Å; G509-G512 PolarHBondContact O-N 3.09Å; G509-V513 WeakPolarHBondContact O-CG2 3.35Å; G509-V513 PolarHBondContact O-N 3.3Å
510	L	89	Confident	87.7	Confident	78 Å²	78	33.5 Å²	33.5	41%	0.408	17%	0.167	S	C	.	.	H	α-helix	trans	-63.9	-39.2	175.6	-69	171.1	0	0	0	112.4	A484 I506 L507 V513 L514	A484-L510 HydrophobicContact CB-CD2 4.46Å; A484-L510 HydrophobicContact CB-CG 4.29Å; I506-L510 HydrophobicContact CG2-CD1 4.33Å; I506-L510 WeakPolarHBondContact O-CG 3.45Å; I506-L510 PolarHBondContact O-N 2.74Å; I506-L510 VanDerWaalsContact O-N 3.1Å; L507-L510 PolarHBondContact O-N 3.03Å; L510-V513 PolarHBondContact O-N 2.67Å; L510-L514 WeakPolarHBondContact O-CG 3.07Å; L510-L514 PolarHBondContact O-N 3.07Å
511	L	91.4	Very high	88.5	Confident	57 Å²	57	35.6 Å²	35.6	30%	0.298	18%	0.178	S	C	.	.	H	α-helix	trans	-68.4	-33.6	174.1	-72.3	170.8	0	0	0	112.5	L507 L508 G509 L514 V515 M634	L507-L511 HydrophobicContact CD1-CD1 4.16Å; L507-L511 HydrophobicContact CD1-CG 4.3Å; L507-L511 HydrophobicContact CG-CD1 3.96Å; L507-L511 WeakPolarHBondContact O-CB 3.47Å; L507-L511 VanDerWaalsContact O-CG 3.25Å; L507-L511 WeakPolarHBondContact O-CG 3.3Å; L507-L511 PolarHBondContact O-N 3.13Å; L508-L511 PolarHBondContact O-N 3.39Å; G509-L511 PolarHBondContact O-N 3.41Å; L511-L514 HydrophobicContact CD2-CD1 4.37Å; L511-L514 PolarHBondContact O-N 3.27Å; L511-V515 PolarHBondContact O-N 3.29Å; L511-M634 HydrophobicContact CB-CE 3.96Å; L511-M634 HydrophobicContact CB-SD 3.89Å; L511-M634 HydrophobicContact CD1-SD 3.99Å; L511-M634 HydrophobicContact CD2-SD 4.14Å; L511-M634 HydrophobicContact CG-SD 4.23Å
512	G	90.9	Very high	89.3	Confident	1 Å²	1	30.5 Å²	30.5	1%	0.01	16%	0.156	C	C	.	.	H	α-helix	trans	-63	-48.2	171.3	0	0	0	0	0	112.4	L508 G509 L514 V515 V516	L508-G512 PolarHBondContact O-N 2.95Å; G509-G512 PolarHBondContact O-N 3.09Å; G512-L514 VanDerWaalsContact C-N 3.31Å; G512-L514 PolarHBondContact O-N 2.94Å; G512-V515 WeakPolarHBondContact O-CB 3.3Å; G512-V515 PolarHBondContact O-N 3.26Å; G512-V515 VanDerWaalsContact O-N 3.13Å; G512-V516 PolarHBondContact O-N 2.83Å; G512-V516 VanDerWaalsContact O-N 3.1Å
513	V	90.2	Very high	90.2	Very high	9 Å²	9	29.9 Å²	29.9	6%	0.055	15%	0.152	C	C	.	.	H	α-helix	trans	-57.9	-43.1	173	169.7	0	0	0	0	111.3	F480 I483 G509 L510 V515 V516 F517 L547	F480-V513 HydrophobicContact CD1-CB 4.44Å; F480-V513 HydrophobicContact CD1-CG1 3.54Å; F480-V513 HydrophobicContact CD1-CG2 4.04Å; F480-V513 HydrophobicContact CE1-CG1 3.44Å; F480-V513 VanDerWaalsContact CE1-CG1 3.44Å; F480-V513 HydrophobicContact CE2-CG1 4.45Å; F480-V513 HydrophobicContact CG-CG1 4.12Å; F480-V513 HydrophobicContact CZ-CG1 3.93Å; I483-V513 HydrophobicContact CB-CG2 4.5Å; I483-V513 HydrophobicContact CD1-CG2 3.84Å; I483-V513 HydrophobicContact CG2-CG2 4.04Å; G509-V513 WeakPolarHBondContact O-CG2 3.35Å; G509-V513 PolarHBondContact O-N 3.3Å; L510-V513 PolarHBondContact O-N 2.67Å; V513-V515 VanDerWaalsContact C-N 3.31Å; V513-V515 PolarHBondContact O-N 3.38Å; V513-V516 WeakPolarHBondContact O-CB 3.12Å; V513-V516 PolarHBondContact O-N 3.4Å; V513-V516 VanDerWaalsContact O-N 3.16Å; V513-F517 HydrophobicContact CG1-CD2 3.86Å; V513-F517 HydrophobicContact CG1-CE2 3.82Å; V513-F517 WeakPolarHBondContact O-CD2 3.34Å; V513-F517 PolarHBondContact O-N 3.06Å; V513-L547 HydrophobicContact CG1-CD1 4.46Å; V513-L547 HydrophobicContact CG2-CD1 4.39Å
514	L	92.4	Very high	91.1	Very high	111 Å²	111	29 Å²	29	58%	0.581	15%	0.15	S	C	*	.	H	α-helix	trans	-61.9	-36	176.1	-81.2	164	0	0	0	113	L510 L511 G512 F517 L518	L510-L514 WeakPolarHBondContact O-CG 3.07Å; L510-L514 PolarHBondContact O-N 3.07Å; L511-L514 HydrophobicContact CD2-CD1 4.37Å; L511-L514 PolarHBondContact O-N 3.27Å; G512-L514 VanDerWaalsContact C-N 3.31Å; G512-L514 PolarHBondContact O-N 2.94Å; L514-F517 PolarHBondContact O-N 3.24Å; L514-L518 WeakPolarHBondContact O-CB 3.32Å; L514-L518 PolarHBondContact O-N 2.88Å
515	V	94	Very high	91.7	Very high	7 Å²	7	29 Å²	29	4%	0.042	15%	0.15	C	C	.	.	H	α-helix	trans	-63.4	-42.2	172.6	161.6	0	0	0	0	111.6	L511 G512 V513 L518 S519 L626 C630 M634	L511-V515 PolarHBondContact O-N 3.29Å; G512-V515 WeakPolarHBondContact O-CB 3.3Å; G512-V515 PolarHBondContact O-N 3.26Å; G512-V515 VanDerWaalsContact O-N 3.13Å; V513-V515 VanDerWaalsContact C-N 3.31Å; V513-V515 PolarHBondContact O-N 3.38Å; V515-L518 WeakPolarHBondContact O-CB 3.33Å; V515-L518 PolarHBondContact O-N 3.32Å; V515-S519 PolarHBondContact O-N 3.23Å; V515-L626 HydrophobicContact CG1-CB 3.68Å; V515-C630 HydrophobicContact CG2-CB 4.33Å; V515-M634 HydrophobicContact CG2-CE 3.56Å
516	V	92.7	Very high	92.1	Very high	1 Å²	1	32.6 Å²	32.6	1%	0.006	17%	0.166	C	C	.	.	H	α-helix	trans	-59.4	-51.3	175.1	174.7	0	0	0	0	110.7	G512 V513 L518 S519 V520 V546 L547	G512-V516 PolarHBondContact O-N 2.83Å; G512-V516 VanDerWaalsContact O-N 3.1Å; V513-V516 WeakPolarHBondContact O-CB 3.12Å; V513-V516 PolarHBondContact O-N 3.4Å; V513-V516 VanDerWaalsContact O-N 3.16Å; V516-L518 VanDerWaalsContact C-N 3.28Å; V516-L518 PolarHBondContact O-N 2.88Å; V516-S519 WeakPolarHBondContact O-CB 3.44Å; V516-S519 PolarHBondContact O-N 3.39Å; V516-S519 VanDerWaalsContact O-N 3.15Å; V516-S519 PolarHBondContact O-OG 2.87Å; V516-V520 PolarHBondContact O-N 3.03Å; V516-V546 HydrophobicContact CG1-CB 4.44Å; V516-V546 HydrophobicContact CG1-CG1 4.12Å; V516-L547 HydrophobicContact CB-CD1 4.27Å; V516-L547 HydrophobicContact CG1-CB 4.06Å; V516-L547 HydrophobicContact CG1-CD1 3.92Å; V516-L547 HydrophobicContact CG2-CD1 4.47Å
517	F	92.1	Very high	92.5	Very high	57 Å²	57	30.4 Å²	30.4	25%	0.25	15%	0.154	C	C	.	.	H	α-helix	trans	-61	-37.6	177.5	-84	-80.1	0	0	0	113	Y476 F480 V513 L514 S519 V520 L521 P543	Y476-F517 HydrophobicContact CD1-CZ 4.03Å; Y476-F517 HydrophobicContact CE1-CZ 4.11Å; F480-F517 AromaticContact CE1-CE2 3.66Å; F480-F517 HydrophobicContact CE1-CE2 3.66Å; F480-F517 HydrophobicContact CE1-CZ 4.2Å; F480-F517 HydrophobicContact CE2-CE2 4.47Å; F480-F517 HydrophobicContact CZ-CD2 4.47Å; F480-F517 AromaticContact CZ-CE2 3.37Å; F480-F517 HydrophobicContact CZ-CE2 3.37Å; F480-F517 AromaticContact CZ-CZ 3.72Å; F480-F517 HydrophobicContact CZ-CZ 3.72Å; V513-F517 HydrophobicContact CG1-CD2 3.86Å; V513-F517 HydrophobicContact CG1-CE2 3.82Å; V513-F517 WeakPolarHBondContact O-CD2 3.34Å; V513-F517 PolarHBondContact O-N 3.06Å; L514-F517 PolarHBondContact O-N 3.24Å; F517-S519 VanDerWaalsContact C-N 3.3Å; F517-S519 PolarHBondContact O-N 3.16Å; F517-V520 PolarHBondContact O-N 2.85Å; F517-L521 WeakPolarHBondContact O-CG 3.34Å; F517-L521 PolarHBondContact O-N 2.66Å; F517-P543 HydrophobicContact CE1-CB 4.12Å
518	L	94.5	Very high	92.7	Very high	34 Å²	34	26.8 Å²	26.8	18%	0.178	14%	0.136	C	C	.	.	H	α-helix	trans	-63.7	-34.4	177.7	-175.5	61.5	0	0	0	111.9	F207 S210 L514 V515 V516 S522 L626	F207-L518 HydrophobicContact CD2-CD2 3.89Å; F207-L518 HydrophobicContact CE2-CD2 4.16Å; S210-L518 WeakPolarHBondContact OG-CD1 3.45Å; S210-L518 WeakPolarHBondContact OG-CG 3.5Å; L514-L518 WeakPolarHBondContact O-CB 3.32Å; L514-L518 PolarHBondContact O-N 2.88Å; V515-L518 WeakPolarHBondContact O-CB 3.33Å; V515-L518 PolarHBondContact O-N 3.32Å; V516-L518 VanDerWaalsContact C-N 3.28Å; V516-L518 PolarHBondContact O-N 2.88Å; L518-S522 WeakPolarHBondContact O-CB 3.47Å; L518-S522 PolarHBondContact O-N 3.27Å; L518-S522 PolarHBondContact O-OG 2.98Å; L518-L626 HydrophobicContact CG-CD1 4.3Å
519	S	94.9	Very high	92.9	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-65	-41.7	172.6	78.5	0	0	0	0	113	V515 V516 F517 S522 S523	V515-S519 PolarHBondContact O-N 3.23Å; V516-S519 WeakPolarHBondContact O-CB 3.44Å; V516-S519 PolarHBondContact O-N 3.39Å; V516-S519 VanDerWaalsContact O-N 3.15Å; V516-S519 PolarHBondContact O-OG 2.87Å; F517-S519 VanDerWaalsContact C-N 3.3Å; F517-S519 PolarHBondContact O-N 3.16Å; S519-S522 WeakPolarHBondContact O-CB 3.21Å; S519-S522 PolarHBondContact O-N 3.26Å; S519-S523 PolarHBondContact O-N 3.39Å
520	V	93.1	Very high	93.1	Very high	5 Å²	5	36.6 Å²	36.6	3%	0.03	18%	0.183	C	C	.	.	H	α-helix	trans	-67.2	-44.1	-179.6	178.9	0	0	0	0	110.6	V516 F517 S522 S523 L524 V542 P543 V546	V516-V520 PolarHBondContact O-N 3.03Å; F517-V520 PolarHBondContact O-N 2.85Å; V520-S522 VanDerWaalsContact C-N 3.29Å; V520-S522 PolarHBondContact O-N 2.8Å; V520-S523 PolarHBondContact O-N 2.69Å; V520-L524 HydrophobicContact CG1-CD1 4Å; V520-L524 WeakPolarHBondContact O-CG 3.42Å; V520-L524 PolarHBondContact O-N 3.02Å; V520-V542 HydrophobicContact CG1-CG1 4.24Å; V520-P543 HydrophobicContact CG1-CB 4.25Å; V520-P543 HydrophobicContact CG1-CG 4.05Å; V520-P543 HydrophobicContact CG2-CB 4.48Å; V520-V546 HydrophobicContact CG2-CB 3.9Å; V520-V546 HydrophobicContact CG2-CG1 4.19Å; V520-V546 HydrophobicContact CG2-CG2 4.07Å
521	L	94.3	Very high	93.2	Very high	75 Å²	75	35.9 Å²	35.9	39%	0.393	20%	0.195	S	C	.	.	H	α-helix	trans	-63.8	-33.6	173.6	-66.8	173.9	0	0	0	112.4	L217 F517 L524 G525	L217-L521 HydrophobicContact CD1-CB 4.4Å; L217-L521 HydrophobicContact CD1-CD2 4.06Å; F517-L521 WeakPolarHBondContact O-CG 3.34Å; F517-L521 PolarHBondContact O-N 2.66Å; L521-L524 HydrophobicContact CD2-CD1 4.33Å; L521-G525 PolarHBondContact O-N 3.06Å
522	S	94.9	Very high	93.1	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-66.2	-41.2	174.6	-56	0	0	0	0	111.8	S210 L518 S519 V520 F526	S210-S522 WeakPolarHBondContact CB-OG 3.13Å; S210-S522 PolarHBondContact OG-OG 2.92Å; L518-S522 WeakPolarHBondContact O-CB 3.47Å; L518-S522 PolarHBondContact O-N 3.27Å; L518-S522 PolarHBondContact O-OG 2.98Å; S519-S522 WeakPolarHBondContact O-CB 3.21Å; S519-S522 PolarHBondContact O-N 3.26Å; V520-S522 VanDerWaalsContact C-N 3.29Å; V520-S522 PolarHBondContact O-N 2.8Å; S522-F526 VanDerWaalsContact O-CB 3.28Å; S522-F526 WeakPolarHBondContact O-CB 3.38Å; S522-F526 PolarHBondContact O-N 2.86Å
523	S	94.2	Very high	93	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.007	21%	0.205	C	C	.	.	H	α-helix	trans	-65.1	-50	174.8	-175	0	0	0	0	112.1	S519 V520 G525 F526 Y527 Y615 A619	S519-S523 PolarHBondContact O-N 3.39Å; V520-S523 PolarHBondContact O-N 2.69Å; S523-G525 PolarHBondContact O-N 3.03Å; S523-F526 PolarHBondContact O-N 2.92Å; S523-Y527 WeakPolarHBondContact O-CD2 3.5Å; S523-Y527 PolarHBondContact O-N 2.97Å; S523-Y527 VanDerWaalsContact O-N 3.15Å; S523-Y615 PolarHBondContact OG-O 3.29Å; S523-A619 PolarHBondContact OG-N 3.15Å
524	L	93.5	Very high	92.9	Very high	21 Å²	21	37.1 Å²	37.1	11%	0.11	20%	0.203	C	C	.	.	H	α-helix	trans	-55.8	-47.6	176.4	-74.4	160	0	0	0	111.8	L217 V520 L521 A528 Y615	L217-L524 HydrophobicContact CD2-CB 3.66Å; V520-L524 HydrophobicContact CG1-CD1 4Å; V520-L524 WeakPolarHBondContact O-CG 3.42Å; V520-L524 PolarHBondContact O-N 3.02Å; L521-L524 HydrophobicContact CD2-CD1 4.33Å; L524-A528 WeakPolarHBondContact O-CB 3.43Å; L524-A528 PolarHBondContact O-N 3.38Å; L524-A528 VanDerWaalsContact O-N 3.11Å; L524-Y615 HydrophobicContact CD2-CD1 3.75Å; L524-Y615 HydrophobicContact CD2-CE1 3.85Å; L524-Y615 HydrophobicContact CG-CD1 4.29Å
525	G	94.5	Very high	92.5	Very high	0 Å²	0	32 Å²	32	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-67.5	-38.8	178.5	0	0	0	0	0	113.5	C213 G216 L521 S523 Y527 A528 F529	C213-G525 CarbonylContact O-C 3.58Å; C213-G525 WeakPolarHBondContact O-CA 3.2Å; G216-G525 WeakPolarHBondContact CA-O 3.39Å; L521-G525 PolarHBondContact O-N 3.06Å; S523-G525 PolarHBondContact O-N 3.03Å; G525-Y527 PolarHBondContact O-N 3.16Å; G525-A528 PolarHBondContact O-N 2.75Å; G525-F529 WeakPolarHBondContact O-CD2 3.33Å; G525-F529 PolarHBondContact O-N 2.95Å
526	F	94.6	Very high	91.8	Very high	82 Å²	82	35 Å²	35	36%	0.36	19%	0.191	S	C	.	.	H	α-helix	trans	-62.4	-43.6	177.7	-178.7	-89.5	0	0	0	112.5	S522 S523 F529 L530 L618 F622	S522-F526 VanDerWaalsContact O-CB 3.28Å; S522-F526 WeakPolarHBondContact O-CB 3.38Å; S522-F526 PolarHBondContact O-N 2.86Å; S523-F526 PolarHBondContact O-N 2.92Å; F526-F529 WeakPolarHBondContact O-CB 3.4Å; F526-F529 PolarHBondContact O-N 2.91Å; F526-L530 HydrophobicContact CD1-CD1 4.1Å; F526-L530 HydrophobicContact CE1-CD1 3.58Å; F526-L530 HydrophobicContact CE1-CG 4.43Å; F526-L530 HydrophobicContact CZ-CD1 4.23Å; F526-L530 PolarHBondContact O-N 3.37Å; F526-L618 HydrophobicContact CB-CD2 3.84Å; F526-L618 HydrophobicContact CD1-CD2 3.28Å; F526-L618 HydrophobicContact CE1-CD2 3.99Å; F526-L618 HydrophobicContact CG-CD2 3.73Å; F526-F622 HydrophobicContact CB-CE2 4.46Å
527	Y	93.8	Very high	90.9	Very high	13 Å²	13	36.5 Å²	36.5	5%	0.051	20%	0.199	C	C	.	.	H	α-helix	trans	-74.2	-31.5	177.6	-73.3	-61.6	0	0	0	113.5	S523 G525 F529 L530 G531 I532 L614 Y615 L618	S523-Y527 WeakPolarHBondContact O-CD2 3.5Å; S523-Y527 PolarHBondContact O-N 2.97Å; S523-Y527 VanDerWaalsContact O-N 3.15Å; G525-Y527 PolarHBondContact O-N 3.16Å; Y527-F529 VanDerWaalsContact C-N 3.32Å; Y527-F529 PolarHBondContact O-N 2.85Å; Y527-L530 HydrophobicContact CD1-CD1 4.13Å; Y527-L530 CarbonylContact O-C 3.59Å; Y527-L530 WeakPolarHBondContact O-CA 3.36Å; Y527-L530 WeakPolarHBondContact O-CB 3.25Å; Y527-L530 PolarHBondContact O-N 3.18Å; Y527-G531 PolarHBondContact O-N 2.97Å; Y527-I532 HydrophobicContact CD1-CD1 4.01Å; Y527-I532 PolarHBondContact O-N 3Å; Y527-I532 VanDerWaalsContact O-N 3.15Å; Y527-L614 HydrophobicContact CE1-CB 4.27Å; Y527-L614 HydrophobicContact CE1-CD2 4.4Å; Y527-L614 VanDerWaalsContact CE2-C 3.46Å; Y527-L614 HydrophobicContact CE2-CB 4.24Å; Y527-L614 WeakPolarHBondContact CE2-O 3.24Å; Y527-L614 VanDerWaalsContact CZ-O 3.31Å; Y527-L614 PolarHBondContact OH-O 2.98Å; Y527-Y615 WeakPolarHBondContact CB-OH 3.32Å; Y527-Y615 AromaticContact CD2-CD1 3.94Å; Y527-Y615 HydrophobicContact CD2-CD1 3.94Å; Y527-Y615 AromaticContact CD2-CD2 3.67Å; Y527-Y615 HydrophobicContact CD2-CD2 3.67Å; Y527-Y615 HydrophobicContact CD2-CE1 4.09Å; Y527-Y615 AromaticContact CD2-CE2 3.85Å; Y527-Y615 HydrophobicContact CD2-CE2 3.85Å; Y527-Y615 AromaticContact CD2-CG 3.77Å; Y527-Y615 HydrophobicContact CD2-CG 3.77Å; Y527-Y615 HydrophobicContact CE2-CD2 4.14Å; Y527-Y615 HydrophobicContact CE2-CG 4.25Å; Y527-Y615 HydrophobicContact CG-CD2 4.14Å; Y527-Y615 HydrophobicContact CG-CE1 4.35Å; Y527-Y615 AromaticContact CG-CE2 3.84Å; Y527-Y615 HydrophobicContact CG-CE2 3.84Å; Y527-Y615 AromaticContact CG-CZ 3.98Å; Y527-L618 HydrophobicContact CD2-CD2 3.95Å; Y527-L618 HydrophobicContact CE2-CB 3.72Å; Y527-L618 HydrophobicContact CE2-CD2 3.42Å; Y527-L618 VanDerWaalsContact CE2-CD2 3.42Å; Y527-L618 HydrophobicContact CE2-CG 4.21Å
528	A	93.4	Very high	90.3	Very high	6 Å²	6	33.9 Å²	33.9	5%	0.05	19%	0.187	C	C	.	.	H	α-helix	trans	-61.8	-38.1	170.3	0	0	0	0	0	112.1	G216 M220 L524 G525 L530 G531	G216-A528 WeakPolarHBondContact O-CB 3.46Å; M220-A528 HydrophobicContact CB-CB 4.13Å; L524-A528 WeakPolarHBondContact O-CB 3.43Å; L524-A528 PolarHBondContact O-N 3.38Å; L524-A528 VanDerWaalsContact O-N 3.11Å; G525-A528 PolarHBondContact O-N 2.75Å; A528-L530 PolarHBondContact O-N 3.38Å; A528-G531 PolarHBondContact O-N 3.21Å; A528-G531 VanDerWaalsContact O-N 3.09Å
529	F	93.2	Very high	89.7	Confident	104 Å²	104	35.2 Å²	35.2	46%	0.456	19%	0.194	S	C	.	.	H	α-helix	trans	-62.6	-24.1	170.5	-86.9	-52.5	0	0	0	114.2	A212 C215 G216 Y219 G525 F526 Y527 G531	A212-F529 WeakPolarHBondContact O-CE2 3.18Å; C215-F529 HydrophobicContact CB-CE2 4.22Å; C215-F529 HydrophobicContact CB-CZ 3.91Å; G216-F529 VanDerWaalsContact CA-CD2 3.41Å; Y219-F529 HydrophobicContact CD2-CD1 4.1Å; Y219-F529 HydrophobicContact CD2-CE1 4.05Å; Y219-F529 HydrophobicContact CE2-CD1 4.34Å; Y219-F529 AromaticContact CE2-CE1 3.94Å; Y219-F529 HydrophobicContact CE2-CE1 3.94Å; G525-F529 WeakPolarHBondContact O-CD2 3.33Å; G525-F529 PolarHBondContact O-N 2.95Å; F526-F529 WeakPolarHBondContact O-CB 3.4Å; F526-F529 PolarHBondContact O-N 2.91Å; Y527-F529 VanDerWaalsContact C-N 3.32Å; Y527-F529 PolarHBondContact O-N 2.85Å; F529-G531 VanDerWaalsContact C-N 3.35Å
530	L	93.1	Very high	88.9	Confident	107 Å²	107	36.6 Å²	36.6	56%	0.56	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89	0.5	175.8	-64.7	177.8	0	0	0	113.2	F526 Y527 A528 I532	F526-L530 HydrophobicContact CD1-CD1 4.1Å; F526-L530 HydrophobicContact CE1-CD1 3.58Å; F526-L530 HydrophobicContact CE1-CG 4.43Å; F526-L530 HydrophobicContact CZ-CD1 4.23Å; F526-L530 PolarHBondContact O-N 3.37Å; Y527-L530 HydrophobicContact CD1-CD1 4.13Å; Y527-L530 CarbonylContact O-C 3.59Å; Y527-L530 WeakPolarHBondContact O-CA 3.36Å; Y527-L530 WeakPolarHBondContact O-CB 3.25Å; Y527-L530 PolarHBondContact O-N 3.18Å; A528-L530 PolarHBondContact O-N 3.38Å; L530-I532 VanDerWaalsContact C-N 3.27Å; L530-I532 HydrophobicContact CB-CG1 4.41Å; L530-I532 PolarHBondContact O-N 3.09Å
531	G	90.7	Very high	88.1	Confident	63 Å²	63	36.6 Å²	36.6	65%	0.649	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	67.9	24.7	-176.7	0	0	0	0	0	113.7	Y527 A528 F529	Y527-G531 PolarHBondContact O-N 2.97Å; A528-G531 PolarHBondContact O-N 3.21Å; A528-G531 VanDerWaalsContact O-N 3.09Å; F529-G531 VanDerWaalsContact C-N 3.35Å
532	I	89.8	Confident	87.6	Confident	54 Å²	54	33.3 Å²	33.3	28%	0.277	18%	0.183	S	C	.	.	P	Polyproline II helix	trans	-88.3	123.1	170.6	-61.9	-175.3	0	0	0	107.6	Y527 L530 Y615	Y527-I532 HydrophobicContact CD1-CD1 4.01Å; Y527-I532 PolarHBondContact O-N 3Å; Y527-I532 VanDerWaalsContact O-N 3.15Å; L530-I532 VanDerWaalsContact C-N 3.27Å; L530-I532 HydrophobicContact CB-CG1 4.41Å; L530-I532 PolarHBondContact O-N 3.09Å; I532-Y615 HydrophobicContact CG2-CE2 4.01Å; I532-Y615 PolarHBondContact O-OH 2.7Å
533	P	88.8	Confident	87.1	Confident	38 Å²	38	34.1 Å²	34.1	25%	0.247	19%	0.189	C	C	.	.	P	Polyproline II helix	trans	-74.5	148.5	178	31.2	-35.1	0	0	0	110.8	E221	E221-P533 HydrophobicContact CB-CB 4.34Å; E221-P533 HydrophobicContact CG-CB 4.47Å; E221-P533 WeakPolarHBondContact O-CA 3.32Å
534	T	88.3	Confident	86.3	Confident	1 Å²	1	34.7 Å²	34.7	1%	0.006	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	160.3	174.7	-167.9	0	0	0	0	111.5	M220 E221 I222 T223 I539	M220-T534 HydrophobicContact CG-CG2 3.84Å; M220-T534 HydrophobicContact SD-CG2 3.92Å; E221-T534 PolarHBondContact O-N 3.1Å; I222-T534 WeakPolarHBondContact CA-O 3.19Å; I222-T534 HydrophobicContact CB-CG2 4.49Å; I222-T534 HydrophobicContact CG1-CG2 3.9Å; T223-T534 PolarHBondContact N-O 3.13Å; T534-I539 HydrophobicContact CG2-CD1 3.86Å; T534-I539 HydrophobicContact CG2-CG1 4.23Å
535	T	84.8	Confident	85.7	Confident	2 Å²	2	33.7 Å²	33.7	1%	0.012	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	152.1	173.6	61.7	0	0	0	0	110.6	I229 I537 S538 I539 I611	I229-T535 HydrophobicContact CG1-CG2 4.36Å; T535-I537 VanDerWaalsContact C-N 3.27Å; T535-I537 PolarHBondContact O-N 3.23Å; T535-S538 WeakPolarHBondContact O-CA 3.37Å; T535-S538 WeakPolarHBondContact O-CB 3.47Å; T535-S538 PolarHBondContact O-N 3.42Å; T535-S538 PolarHBondContact OG1-N 3.4Å; T535-S538 PolarHBondContact OG1-OG 3.39Å; T535-I539 PolarHBondContact O-N 2.76Å; T535-I611 HydrophobicContact CG2-CD1 4.06Å; T535-I611 HydrophobicContact CG2-CG2 4.32Å
536	L	78.1	Confident	85.4	Confident	72 Å²	72	33.7 Å²	33.7	38%	0.377	19%	0.186	S	C	.	.	H	α-helix	trans	-53.1	-44.6	177.4	-177.1	57.6	0	0	0	112.3	S538 I539 E540	L536-S538 VanDerWaalsContact C-N 3.26Å; L536-S538 PolarHBondContact O-N 2.66Å; L536-I539 PolarHBondContact O-N 3.23Å; L536-I539 VanDerWaalsContact O-N 3.09Å; L536-E540 HydrophobicContact CD1-CG 4.38Å; L536-E540 WeakPolarHBondContact O-CG 3.19Å; L536-E540 PolarHBondContact O-N 2.86Å
537	I	73.9	Confident	85	Confident	32 Å²	32	29.8 Å²	29.8	16%	0.164	17%	0.169	C	C	.	.	H	α-helix	trans	-54.4	-40.2	173.7	-65.6	166.2	0	0	0	111.9	W230 T535 E540 V541	W230-I537 HydrophobicContact CH2-CD1 3.69Å; W230-I537 HydrophobicContact CZ2-CD1 3.94Å; T535-I537 VanDerWaalsContact C-N 3.27Å; T535-I537 PolarHBondContact O-N 3.23Å; I537-E540 PolarHBondContact O-N 2.86Å; I537-V541 HydrophobicContact CG2-CG2 4.2Å; I537-V541 VanDerWaalsContact O-CB 3.32Å; I537-V541 WeakPolarHBondContact O-CB 3.48Å; I537-V541 WeakPolarHBondContact O-CG2 3.47Å; I537-V541 PolarHBondContact O-N 3.04Å
538	S	79.1	Confident	84.3	Confident	1 Å²	1	29.6 Å²	29.6	1%	0.007	17%	0.17	C	C	.	.	H	α-helix	trans	-68.5	-39.3	179.1	-55.8	0	0	0	0	111.8	T535 L536 V542 F612	T535-S538 WeakPolarHBondContact O-CA 3.37Å; T535-S538 WeakPolarHBondContact O-CB 3.47Å; T535-S538 PolarHBondContact O-N 3.42Å; T535-S538 PolarHBondContact OG1-N 3.4Å; T535-S538 PolarHBondContact OG1-OG 3.39Å; L536-S538 VanDerWaalsContact C-N 3.26Å; L536-S538 PolarHBondContact O-N 2.66Å; S538-V542 VanDerWaalsContact O-CB 3.24Å; S538-V542 WeakPolarHBondContact O-CB 3.39Å; S538-V542 WeakPolarHBondContact O-CG2 3.36Å; S538-V542 PolarHBondContact O-N 2.82Å; S538-F612 WeakPolarHBondContact OG-CA 3.43Å
539	I	83.2	Confident	83.8	Confident	62 Å²	62	29.4 Å²	29.4	32%	0.318	17%	0.168	S	C	.	.	H	α-helix	trans	-66.7	-38.3	176.8	-63.3	169	0	0	0	111	I222 T534 T535 L536 P543	I222-I539 HydrophobicContact CD1-CD1 4.18Å; T534-I539 HydrophobicContact CG2-CD1 3.86Å; T534-I539 HydrophobicContact CG2-CG1 4.23Å; T535-I539 PolarHBondContact O-N 2.76Å; L536-I539 PolarHBondContact O-N 3.23Å; L536-I539 VanDerWaalsContact O-N 3.09Å; I539-P543 WeakPolarHBondContact O-CD 3.35Å; I539-P543 WeakPolarHBondContact O-CG 3.33Å
540	E	76.6	Confident	83.6	Confident	30 Å²	30	24.4 Å²	24.4	14%	0.14	15%	0.146	C	C	.	.	H	α-helix	trans	-77.9	-43.6	-178.2	-68.5	169.8	161.6	0	0	112.7	S465 L536 I537	S465-E540 PolarHBondContact OG-OE1 3.34Å; L536-E540 HydrophobicContact CD1-CG 4.38Å; L536-E540 WeakPolarHBondContact O-CG 3.19Å; L536-E540 PolarHBondContact O-N 2.86Å; I537-E540 PolarHBondContact O-N 2.86Å
541	V	77.4	Confident	83.3	Confident	5 Å²	5	19.5 Å²	19.5	3%	0.03	12%	0.121	C	C	.	.	H	α-helix	trans	-89.7	-41.3	-170.4	179.5	0	0	0	0	113.8	I537 P543 F544 L545 F612 Y1085 Y1089	I537-V541 HydrophobicContact CG2-CG2 4.2Å; I537-V541 VanDerWaalsContact O-CB 3.32Å; I537-V541 WeakPolarHBondContact O-CB 3.48Å; I537-V541 WeakPolarHBondContact O-CG2 3.47Å; I537-V541 PolarHBondContact O-N 3.04Å; V541-P543 VanDerWaalsContact C-CD 3.48Å; V541-F544 PolarHBondContact O-N 3.49Å; V541-F544 VanDerWaalsContact O-N 3.13Å; V541-L545 PolarHBondContact O-N 2.96Å; V541-F612 HydrophobicContact CB-CE2 4.04Å; V541-F612 HydrophobicContact CG1-CE2 3.62Å; V541-F612 HydrophobicContact CG1-CZ 4.11Å; V541-Y1085 HydrophobicContact CG2-CE1 3.64Å; V541-Y1089 VanDerWaalsContact CG1-OH 3.3Å; V541-Y1089 WeakPolarHBondContact CG1-OH 3.36Å
542	V	83.9	Confident	83	Confident	5 Å²	5	16.5 Å²	16.5	3%	0.03	9%	0.09	C	C	.	.	H	α-helix	trans	-59.1	-42.5	-174.4	177.9	0	0	0	0	112.9	V520 S538 F544 L545 V546 F612 A616 A619	V520-V542 HydrophobicContact CG1-CG1 4.24Å; S538-V542 VanDerWaalsContact O-CB 3.24Å; S538-V542 WeakPolarHBondContact O-CB 3.39Å; S538-V542 WeakPolarHBondContact O-CG2 3.36Å; S538-V542 PolarHBondContact O-N 2.82Å; V542-F544 VanDerWaalsContact C-N 3.3Å; V542-F544 PolarHBondContact O-N 2.68Å; V542-L545 PolarHBondContact O-N 3.5Å; V542-V546 HydrophobicContact CG1-CG2 4.02Å; V542-V546 WeakPolarHBondContact O-CG2 3.45Å; V542-V546 PolarHBondContact O-N 3.46Å; V542-F612 HydrophobicContact CG2-CD2 3.78Å; V542-F612 HydrophobicContact CG2-CE2 3.82Å; V542-A616 HydrophobicContact CG2-CB 4.32Å; V542-A619 HydrophobicContact CG1-CB 4.09Å
543	P	84.5	Confident	83	Confident	18 Å²	18	14 Å²	14	12%	0.117	8%	0.077	C	C	.	.	H	α-helix	trans	-66	-32.4	178.2	-6.6	18.1	0	0	0	112.6	F517 V520 I539 V541 L547	F517-P543 HydrophobicContact CE1-CB 4.12Å; V520-P543 HydrophobicContact CG1-CB 4.25Å; V520-P543 HydrophobicContact CG1-CG 4.05Å; V520-P543 HydrophobicContact CG2-CB 4.48Å; I539-P543 WeakPolarHBondContact O-CD 3.35Å; I539-P543 WeakPolarHBondContact O-CG 3.33Å; V541-P543 VanDerWaalsContact C-CD 3.48Å; P543-L547 WeakPolarHBondContact O-CB 3.41Å; P543-L547 PolarHBondContact O-N 2.93Å; P543-L547 VanDerWaalsContact O-N 3.09Å
544	F	78	Confident	83	Confident	13 Å²	13	12.4 Å²	12.4	6%	0.057	7%	0.066	C	C	.	.	H	α-helix	trans	-69	-39.8	175.3	179.7	-94.6	0	0	0	111.1	Y476 M479 V541 V542 A548 M1008 K1066 I1070 Y1089	Y476-F544 WeakPolarHBondContact OH-CA 3.27Å; Y476-F544 WeakPolarHBondContact OH-CB 3.47Å; Y476-F544 PolarHBondContact OH-N 3.45Å; M479-F544 HydrophobicContact CE-CD2 3.9Å; M479-F544 HydrophobicContact CE-CE2 3.98Å; M479-F544 HydrophobicContact SD-CD2 4.39Å; M479-F544 HydrophobicContact SD-CE2 3.99Å; V541-F544 PolarHBondContact O-N 3.49Å; V541-F544 VanDerWaalsContact O-N 3.13Å; V542-F544 VanDerWaalsContact C-N 3.3Å; V542-F544 PolarHBondContact O-N 2.68Å; F544-A548 PolarHBondContact O-N 3.42Å; F544-M1008 HydrophobicContact CD1-CE 4.06Å; F544-M1008 HydrophobicContact CE1-CE 4.35Å; F544-K1066 HydrophobicContact CE1-CD 4.35Å; F544-K1066 HydrophobicContact CE2-CD 4.15Å; F544-K1066 HydrophobicContact CZ-CD 3.74Å; F544-K1066 PolarHBondContact O-NZ 3.29Å; F544-I1070 HydrophobicContact CZ-CD1 4.28Å; F544-I1070 HydrophobicContact CZ-CG1 3.81Å; F544-Y1089 HydrophobicContact CD1-CD2 4.22Å; F544-Y1089 AromaticContact CD1-CE2 3.77Å; F544-Y1089 HydrophobicContact CD1-CE2 3.77Å; F544-Y1089 AromaticContact CE1-CD2 3.66Å; F544-Y1089 HydrophobicContact CE1-CD2 3.66Å; F544-Y1089 AromaticContact CE1-CE2 3.71Å; F544-Y1089 HydrophobicContact CE1-CE2 3.71Å; F544-Y1089 HydrophobicContact CE1-CG 4.41Å; F544-Y1089 HydrophobicContact CZ-CD2 4.16Å; F544-Y1089 HydrophobicContact CZ-CE2 4.49Å
545	L	80.2	Confident	83	Confident	0 Å²	0	12.4 Å²	12.4	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-63.8	-52.9	177.9	-168.1	160.2	0	0	0	111.2	V541 V542 L547 A548 V549 F598 F612 A616 I620 M1008	V541-L545 PolarHBondContact O-N 2.96Å; V542-L545 PolarHBondContact O-N 3.5Å; L545-L547 VanDerWaalsContact C-N 3.3Å; L545-L547 PolarHBondContact O-N 3.1Å; L545-A548 WeakPolarHBondContact O-CA 3.29Å; L545-A548 WeakPolarHBondContact O-CB 3.32Å; L545-A548 PolarHBondContact O-N 3.47Å; L545-V549 HydrophobicContact CD2-CG2 4.4Å; L545-F598 HydrophobicContact CD1-CE1 3.99Å; L545-F598 HydrophobicContact CD1-CE2 4.36Å; L545-F598 HydrophobicContact CD1-CZ 3.74Å; L545-F598 HydrophobicContact CD2-CE2 4.07Å; L545-F598 HydrophobicContact CD2-CZ 4.2Å; L545-F598 HydrophobicContact CG-CZ 4.48Å; L545-F612 HydrophobicContact CD1-CE2 4.28Å; L545-F612 HydrophobicContact CD1-CZ 3.68Å; L545-A616 HydrophobicContact CD1-CB 4.45Å; L545-I620 HydrophobicContact CD2-CD1 3.85Å; L545-I620 HydrophobicContact CD2-CG1 4.41Å; L545-M1008 HydrophobicContact CB-CE 3.76Å; L545-M1008 HydrophobicContact CD1-CE 3.97Å; L545-M1008 HydrophobicContact CD1-CG 3.98Å; L545-M1008 HydrophobicContact CG-CE 3.74Å; L545-M1008 HydrophobicContact CG-CG 4.42Å
546	V	87.9	Confident	83	Confident	0 Å²	0	12.9 Å²	12.9	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-68.8	-31.1	-176.7	-173.1	0	0	0	0	111.4	V516 V520 V542 A548 V549 G550 A619 I620 D623	V516-V546 HydrophobicContact CG1-CB 4.44Å; V516-V546 HydrophobicContact CG1-CG1 4.12Å; V520-V546 HydrophobicContact CG2-CB 3.9Å; V520-V546 HydrophobicContact CG2-CG1 4.19Å; V520-V546 HydrophobicContact CG2-CG2 4.07Å; V542-V546 HydrophobicContact CG1-CG2 4.02Å; V542-V546 WeakPolarHBondContact O-CG2 3.45Å; V542-V546 PolarHBondContact O-N 3.46Å; V546-A548 PolarHBondContact O-N 2.84Å; V546-V549 PolarHBondContact O-N 3.32Å; V546-G550 PolarHBondContact O-N 3.35Å; V546-A619 HydrophobicContact CG2-CB 3.65Å; V546-I620 HydrophobicContact CG2-CG1 4.28Å; V546-D623 HydrophobicContact CG1-CB 3.67Å
547	L	86	Confident	83.5	Confident	0 Å²	0	9.8 Å²	9.8	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-69	-2.3	167.8	-166.2	72.6	0	0	0	113.7	Y476 M479 F480 I483 V513 V516 P543 L545 V551	Y476-L547 HydrophobicContact CD1-CD2 3.64Å; Y476-L547 HydrophobicContact CE1-CD2 3.72Å; M479-L547 HydrophobicContact CE-CD2 3.83Å; M479-L547 HydrophobicContact SD-CD2 4.14Å; F480-L547 HydrophobicContact CE1-CD1 4.49Å; F480-L547 HydrophobicContact CE1-CD2 3.92Å; I483-L547 HydrophobicContact CD1-CD1 4.48Å; V513-L547 HydrophobicContact CG1-CD1 4.46Å; V513-L547 HydrophobicContact CG2-CD1 4.39Å; V516-L547 HydrophobicContact CB-CD1 4.27Å; V516-L547 HydrophobicContact CG1-CB 4.06Å; V516-L547 HydrophobicContact CG1-CD1 3.92Å; V516-L547 HydrophobicContact CG2-CD1 4.47Å; P543-L547 WeakPolarHBondContact O-CB 3.41Å; P543-L547 PolarHBondContact O-N 2.93Å; P543-L547 VanDerWaalsContact O-N 3.09Å; L545-L547 VanDerWaalsContact C-N 3.3Å; L545-L547 PolarHBondContact O-N 3.1Å; L547-V551 HydrophobicContact CD1-CG2 3.61Å; L547-V551 HydrophobicContact CG-CG2 3.97Å; L547-V551 WeakPolarHBondContact O-CG2 3.35Å
548	A	78.9	Confident	84.2	Confident	9 Å²	9	8.3 Å²	8.3	7%	0.074	5%	0.045	C	C	.	.	H	α-helix	trans	-79.5	-62.1	162.2	0	0	0	0	0	110	F544 L545 V546 V551 D552 I1023	F544-A548 PolarHBondContact O-N 3.42Å; L545-A548 WeakPolarHBondContact O-CA 3.29Å; L545-A548 WeakPolarHBondContact O-CB 3.32Å; L545-A548 PolarHBondContact O-N 3.47Å; V546-A548 PolarHBondContact O-N 2.84Å; A548-V551 PolarHBondContact O-N 3.49Å; A548-D552 PolarHBondContact O-N 3.45Å; A548-I1023 HydrophobicContact CB-CD1 4.11Å
549	V	83.6	Confident	84.5	Confident	1 Å²	1	9.2 Å²	9.2	1%	0.006	5%	0.049	C	C	.	.	H	α-helix	trans	-57.4	-56.6	-172.6	-162.9	0	0	0	0	110.6	L545 V546 V551 D552 N553 E594 I620	L545-V549 HydrophobicContact CD2-CG2 4.4Å; V546-V549 PolarHBondContact O-N 3.32Å; V549-V551 VanDerWaalsContact C-N 3.3Å; V549-V551 PolarHBondContact O-N 3.42Å; V549-D552 PolarHBondContact O-N 3.45Å; V549-N553 WeakPolarHBondContact O-CB 3.22Å; V549-N553 PolarHBondContact O-N 3.36Å; V549-E594 VanDerWaalsContact CG1-OE2 3.32Å; V549-E594 WeakPolarHBondContact CG1-OE2 3.37Å; V549-E594 WeakPolarHBondContact CG2-OE2 3.35Å; V549-I620 HydrophobicContact CG2-CD1 4.41Å; V549-I620 HydrophobicContact CG2-CG1 4.31Å
550	G	88.3	Confident	84.6	Confident	0 Å²	0	7.3 Å²	7.3	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-69.7	-28	-172.6	0	0	0	0	0	114.2	V546 I554 D623	V546-G550 PolarHBondContact O-N 3.35Å; G550-I554 VanDerWaalsContact O-CB 3.32Å; G550-I554 WeakPolarHBondContact O-CB 3.43Å; G550-I554 VanDerWaalsContact O-CD1 3.3Å; G550-I554 WeakPolarHBondContact O-CD1 3.48Å; G550-I554 WeakPolarHBondContact O-CG1 3.38Å; G550-I554 PolarHBondContact O-N 3.03Å; G550-D623 WeakPolarHBondContact CA-OD2 3.44Å; G550-D623 PolarHBondContact N-OD2 3.35Å
551	V	87.5	Confident	85.1	Confident	4 Å²	4	6.3 Å²	6.3	2%	0.024	4%	0.036	C	C	.	.	H	α-helix	trans	-72.2	-44.3	175.2	177.2	0	0	0	0	110.7	I483 L547 A548 V549 I554 F555 T1065	I483-V551 HydrophobicContact CD1-CB 4.4Å; I483-V551 HydrophobicContact CD1-CG1 3.85Å; I483-V551 HydrophobicContact CD1-CG2 3.6Å; I483-V551 HydrophobicContact CG1-CG1 3.76Å; I483-V551 HydrophobicContact CG1-CG2 4.41Å; L547-V551 HydrophobicContact CD1-CG2 3.61Å; L547-V551 HydrophobicContact CG-CG2 3.97Å; L547-V551 WeakPolarHBondContact O-CG2 3.35Å; A548-V551 PolarHBondContact O-N 3.49Å; V549-V551 VanDerWaalsContact C-N 3.3Å; V549-V551 PolarHBondContact O-N 3.42Å; V551-I554 PolarHBondContact O-N 3.36Å; V551-F555 HydrophobicContact CG1-CD2 3.71Å; V551-F555 HydrophobicContact CG1-CE2 3.72Å; V551-F555 WeakPolarHBondContact O-CB 3.47Å; V551-F555 VanDerWaalsContact O-CD2 3.27Å; V551-F555 WeakPolarHBondContact O-CD2 3.11Å; V551-F555 PolarHBondContact O-N 2.86Å; V551-T1065 HydrophobicContact CG1-CG2 4.25Å
552	D	84.8	Confident	85.4	Confident	0 Å²	0	8.3 Å²	8.3	0%	0	5%	0.045	C	C	.	.	H	α-helix	trans	-66	-44	178.5	-159.8	49	0	0	0	111.7	A548 V549 I554 F555 I556 H1030 G1061 I1062	A548-D552 PolarHBondContact O-N 3.45Å; V549-D552 PolarHBondContact O-N 3.45Å; D552-I554 VanDerWaalsContact C-N 3.3Å; D552-I554 PolarHBondContact O-N 2.81Å; D552-F555 PolarHBondContact O-N 3.44Å; D552-F555 VanDerWaalsContact O-N 3.09Å; D552-I556 WeakPolarHBondContact O-CB 3.33Å; D552-I556 WeakPolarHBondContact O-CG1 3.17Å; D552-I556 PolarHBondContact O-N 2.87Å; D552-I556 WeakPolarHBondContact OD2-CD1 3.31Å; D552-H1030 IonicContact OD2-CD2 2.96Å; D552-G1061 WeakPolarHBondContact OD1-CA 3.48Å; D552-I1062 HydrophobicContact CB-CG1 3.85Å; D552-I1062 WeakPolarHBondContact OD1-CG1 3.48Å; D552-I1062 PolarHBondContact OD1-N 3.11Å; D552-I1062 VanDerWaalsContact OD2-CG1 3.24Å; D552-I1062 WeakPolarHBondContact OD2-CG1 3.31Å
553	N	88.4	Confident	85.1	Confident	0 Å²	0	11.6 Å²	11.6	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-51	-46.2	170.6	-90.2	-11.7	0	0	0	112.7	V549 L557 M587 S591 Q627	V549-N553 WeakPolarHBondContact O-CB 3.22Å; V549-N553 PolarHBondContact O-N 3.36Å; N553-L557 WeakPolarHBondContact O-CB 3.49Å; N553-L557 PolarHBondContact O-N 3.18Å; N553-L557 VanDerWaalsContact O-N 3.13Å; N553-M587 HydrophobicContact CB-CE 3.73Å; N553-M587 HydrophobicContact CB-CG 4.4Å; N553-M587 WeakPolarHBondContact OD1-CB 2.98Å; N553-M587 VanDerWaalsContact OD1-CG 3.32Å; N553-M587 WeakPolarHBondContact OD1-CG 3.3Å; N553-S591 PolarHBondContact ND2-OG 3.49Å; N553-S591 VanDerWaalsContact ND2-OG 3.13Å; N553-Q627 PolarHBondContact ND2-OE1 3.26Å
554	I	89.7	Confident	84.8	Confident	6 Å²	6	16.7 Å²	16.7	3%	0.031	7%	0.073	C	C	.	.	H	α-helix	trans	-65.2	-45	175.9	-75.9	167.6	0	0	0	111.7	L487 G550 V551 D552 L557 I558 F631	L487-I554 HydrophobicContact CD1-CG2 4.08Å; L487-I554 HydrophobicContact CD2-CG2 4.45Å; G550-I554 VanDerWaalsContact O-CB 3.32Å; G550-I554 WeakPolarHBondContact O-CB 3.43Å; G550-I554 VanDerWaalsContact O-CD1 3.3Å; G550-I554 WeakPolarHBondContact O-CD1 3.48Å; G550-I554 WeakPolarHBondContact O-CG1 3.38Å; G550-I554 PolarHBondContact O-N 3.03Å; V551-I554 PolarHBondContact O-N 3.36Å; D552-I554 VanDerWaalsContact C-N 3.3Å; D552-I554 PolarHBondContact O-N 2.81Å; I554-L557 PolarHBondContact O-N 3.45Å; I554-I558 HydrophobicContact CG2-CD1 3.96Å; I554-I558 WeakPolarHBondContact O-CG1 3.4Å; I554-I558 PolarHBondContact O-N 3.08Å; I554-F631 HydrophobicContact CB-CE1 4.29Å; I554-F631 HydrophobicContact CB-CZ 4.25Å; I554-F631 HydrophobicContact CD1-CD2 4.1Å; I554-F631 HydrophobicContact CD1-CE2 4.01Å; I554-F631 HydrophobicContact CD1-CG 4.42Å; I554-F631 HydrophobicContact CD1-CZ 4.26Å; I554-F631 HydrophobicContact CG1-CD1 3.99Å; I554-F631 HydrophobicContact CG1-CD2 4.3Å; I554-F631 HydrophobicContact CG1-CE1 3.8Å; I554-F631 HydrophobicContact CG1-CE2 4.13Å; I554-F631 HydrophobicContact CG1-CG 4.24Å; I554-F631 HydrophobicContact CG1-CZ 3.88Å; I554-F631 HydrophobicContact CG2-CE1 3.97Å; I554-F631 HydrophobicContact CG2-CE2 4.19Å; I554-F631 HydrophobicContact CG2-CZ 3.54Å
555	F	88.2	Confident	84.7	Confident	0 Å²	0	20 Å²	20	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-63.1	-44	179.3	-94.8	-112.4	0	0	0	112	Y482 I483 A486 L487 V551 D552 Q559	Y482-F555 HydrophobicContact CE1-CZ 4.3Å; I483-F555 HydrophobicContact CB-CE2 4.45Å; I483-F555 HydrophobicContact CG1-CE2 4.26Å; I483-F555 HydrophobicContact CG2-CE2 4.2Å; A486-F555 HydrophobicContact CB-CE1 3.9Å; A486-F555 HydrophobicContact CB-CZ 3.9Å; L487-F555 HydrophobicContact CD1-CE2 4.22Å; L487-F555 HydrophobicContact CD2-CB 4.47Å; L487-F555 HydrophobicContact CD2-CD1 4Å; L487-F555 HydrophobicContact CD2-CD2 3.5Å; L487-F555 HydrophobicContact CD2-CE1 4.05Å; L487-F555 HydrophobicContact CD2-CE2 3.59Å; L487-F555 HydrophobicContact CD2-CG 3.72Å; L487-F555 HydrophobicContact CD2-CZ 3.86Å; L487-F555 HydrophobicContact CG-CD2 4.12Å; L487-F555 HydrophobicContact CG-CE1 4.43Å; L487-F555 HydrophobicContact CG-CE2 3.69Å; L487-F555 HydrophobicContact CG-CZ 3.85Å; V551-F555 HydrophobicContact CG1-CD2 3.71Å; V551-F555 HydrophobicContact CG1-CE2 3.72Å; V551-F555 WeakPolarHBondContact O-CB 3.47Å; V551-F555 VanDerWaalsContact O-CD2 3.27Å; V551-F555 WeakPolarHBondContact O-CD2 3.11Å; V551-F555 PolarHBondContact O-N 2.86Å; D552-F555 PolarHBondContact O-N 3.44Å; D552-F555 VanDerWaalsContact O-N 3.09Å; F555-Q559 VanDerWaalsContact O-CB 3.25Å; F555-Q559 WeakPolarHBondContact O-CB 3.07Å; F555-Q559 VanDerWaalsContact O-CG 3.29Å; F555-Q559 WeakPolarHBondContact O-CG 3.33Å; F555-Q559 PolarHBondContact O-N 2.97Å
556	I	85.3	Confident	83.9	Confident	13 Å²	13	21.7 Å²	21.7	7%	0.067	10%	0.097	C	C	.	.	H	α-helix	trans	-66.2	-43.3	179.5	-67.4	170.4	0	0	0	110.6	D552 T560 V583 H1030	D552-I556 WeakPolarHBondContact O-CB 3.33Å; D552-I556 WeakPolarHBondContact O-CG1 3.17Å; D552-I556 PolarHBondContact O-N 2.87Å; D552-I556 WeakPolarHBondContact OD2-CD1 3.31Å; I556-T560 VanDerWaalsContact O-CB 3.23Å; I556-T560 WeakPolarHBondContact O-CB 3.47Å; I556-T560 PolarHBondContact O-N 2.85Å; I556-T560 PolarHBondContact O-OG1 3.5Å; I556-T560 VanDerWaalsContact O-OG1 3.07Å; I556-V583 HydrophobicContact CG2-CG1 3.84Å; I556-H1030 VanDerWaalsContact CD1-CD2 3.42Å; I556-H1030 WeakPolarHBondContact CD1-CD2 3.49Å
557	L	89	Confident	82.6	Confident	6 Å²	6	29.8 Å²	29.8	3%	0.031	13%	0.132	C	C	.	.	H	α-helix	trans	-61.2	-48.3	176.8	-176.9	63.9	0	0	0	111.9	N553 I554 F561 I579 T580 V583 F631	N553-L557 WeakPolarHBondContact O-CB 3.49Å; N553-L557 PolarHBondContact O-N 3.18Å; N553-L557 VanDerWaalsContact O-N 3.13Å; I554-L557 PolarHBondContact O-N 3.45Å; L557-F561 WeakPolarHBondContact O-CB 3.23Å; L557-F561 PolarHBondContact O-N 2.93Å; L557-F561 VanDerWaalsContact O-N 3.13Å; L557-I579 HydrophobicContact CD1-CG2 4.26Å; L557-T580 HydrophobicContact CD1-CG2 4.48Å; L557-V583 HydrophobicContact CB-CG1 4.38Å; L557-V583 HydrophobicContact CD1-CB 4.23Å; L557-V583 HydrophobicContact CD1-CG1 4.24Å; L557-F631 HydrophobicContact CD2-CD1 4.32Å; L557-F631 HydrophobicContact CD2-CE1 4.38Å
558	I	88.6	Confident	81.5	Confident	1 Å²	1	32.2 Å²	32.2	1%	0.005	15%	0.153	C	C	.	.	H	α-helix	trans	-67.2	-48	-180	-71.9	172.5	0	0	0	111.3	L487 L508 I554 F561 Q562 F631 F635	L487-I558 HydrophobicContact CD1-CD1 4.01Å; L487-I558 HydrophobicContact CD2-CB 4.27Å; L487-I558 HydrophobicContact CD2-CD1 3.79Å; L487-I558 HydrophobicContact CD2-CG2 4.29Å; L487-I558 HydrophobicContact CG-CD1 4.37Å; L508-I558 HydrophobicContact CD2-CD1 3.67Å; L508-I558 HydrophobicContact CD2-CG1 4.39Å; L508-I558 HydrophobicContact CG-CD1 4.33Å; I554-I558 HydrophobicContact CG2-CD1 3.96Å; I554-I558 WeakPolarHBondContact O-CG1 3.4Å; I554-I558 PolarHBondContact O-N 3.08Å; I558-F561 PolarHBondContact O-N 3.01Å; I558-Q562 HydrophobicContact CG2-CG 4.37Å; I558-Q562 WeakPolarHBondContact O-CG 3.44Å; I558-Q562 PolarHBondContact O-N 3.25Å; I558-F631 HydrophobicContact CD1-CE1 4.41Å; I558-F631 HydrophobicContact CD1-CZ 3.97Å; I558-F635 HydrophobicContact CG1-CD2 4.46Å; I558-F635 HydrophobicContact CG1-CE2 4.11Å
559	Q	84.9	Confident	80.9	Confident	20 Å²	20	38.6 Å²	38.6	9%	0.093	19%	0.193	C	C	.	.	H	α-helix	trans	-69.9	-35.8	-176.6	-69.9	-175.6	11.6	0	0	112.5	F555 Q562 R563 S1057 S1060	F555-Q559 VanDerWaalsContact O-CB 3.25Å; F555-Q559 WeakPolarHBondContact O-CB 3.07Å; F555-Q559 VanDerWaalsContact O-CG 3.29Å; F555-Q559 WeakPolarHBondContact O-CG 3.33Å; F555-Q559 PolarHBondContact O-N 2.97Å; Q559-Q562 PolarHBondContact O-N 2.75Å; Q559-R563 WeakPolarHBondContact O-CB 3.29Å; Q559-R563 VanDerWaalsContact O-CG 3.31Å; Q559-R563 WeakPolarHBondContact O-CG 3.3Å; Q559-R563 PolarHBondContact O-N 3.45Å; Q559-S1057 VanDerWaalsContact OE1-CA 3.29Å; Q559-S1057 PolarHBondContact OE1-OG 3.32Å; Q559-S1060 PolarHBondContact NE2-OG 3.2Å
560	T	84.3	Confident	80.5	Confident	23 Å²	23	41.5 Å²	41.5	14%	0.141	21%	0.206	C	C	.	.	H	α-helix	trans	-66.6	-39	173.4	-63.8	0	0	0	0	111.1	I556 R563 R564 I579 V583	I556-T560 VanDerWaalsContact O-CB 3.23Å; I556-T560 WeakPolarHBondContact O-CB 3.47Å; I556-T560 PolarHBondContact O-N 2.85Å; I556-T560 PolarHBondContact O-OG1 3.5Å; I556-T560 VanDerWaalsContact O-OG1 3.07Å; T560-R563 PolarHBondContact O-N 3.34Å; T560-R564 WeakPolarHBondContact O-CB 3.26Å; T560-R564 PolarHBondContact O-N 3.39Å; T560-I579 HydrophobicContact CG2-CD1 4.33Å; T560-I579 HydrophobicContact CG2-CG2 4.24Å; T560-V583 HydrophobicContact CG2-CG2 3.68Å
561	F	87.3	Confident	80.3	Confident	9 Å²	9	47.2 Å²	47.2	4%	0.039	24%	0.236	C	C	.	.	H	α-helix	trans	-60.6	-48	171.4	-177.4	-86.8	0	0	0	111.8	L557 I558 R563 R564 R565 Q575 V576 I579 F635 L639	L557-F561 WeakPolarHBondContact O-CB 3.23Å; L557-F561 PolarHBondContact O-N 2.93Å; L557-F561 VanDerWaalsContact O-N 3.13Å; I558-F561 PolarHBondContact O-N 3.01Å; F561-R563 VanDerWaalsContact C-N 3.34Å; F561-R563 PolarHBondContact O-N 2.99Å; F561-R564 CarbonylContact O-C 3.59Å; F561-R564 PolarHBondContact O-N 3.41Å; F561-R565 PolarHBondContact O-N 3.19Å; F561-R565 VanDerWaalsContact O-N 3.09Å; F561-Q575 HydrophobicContact CE2-CB 4.47Å; F561-V576 HydrophobicContact CD2-CG2 4.38Å; F561-V576 HydrophobicContact CE2-CG2 3.82Å; F561-I579 HydrophobicContact CB-CG2 4.2Å; F561-I579 HydrophobicContact CD2-CG1 4.07Å; F561-F635 HydrophobicContact CB-CE1 4.35Å; F561-F635 HydrophobicContact CB-CZ 3.85Å; F561-F635 AromaticContact CD1-CZ 3.95Å; F561-F635 HydrophobicContact CD1-CZ 3.95Å; F561-F635 HydrophobicContact CD2-CE1 4.27Å; F561-F635 HydrophobicContact CD2-CZ 4.13Å; F561-F635 HydrophobicContact CG-CE1 4.24Å; F561-F635 AromaticContact CG-CZ 3.69Å; F561-F635 HydrophobicContact CG-CZ 3.69Å; F561-L639 HydrophobicContact CD1-CD2 4.09Å; F561-L639 HydrophobicContact CD2-CD1 4.37Å; F561-L639 HydrophobicContact CE1-CD1 4.03Å; F561-L639 HydrophobicContact CE1-CD2 3.39Å; F561-L639 HydrophobicContact CE1-CG 4.38Å; F561-L639 HydrophobicContact CE2-CD1 3.78Å; F561-L639 HydrophobicContact CZ-CD1 3.6Å; F561-L639 HydrophobicContact CZ-CD2 3.73Å; F561-L639 HydrophobicContact CZ-CG 4.3Å
562	Q	83.3	Confident	80.2	Confident	47 Å²	47	48.2 Å²	48.2	22%	0.22	24%	0.242	C	C	.	.	H	α-helix	trans	-59.7	-40.8	177.6	-73.5	178.3	11.6	0	0	112.4	L487 Q489 I558 Q559	L487-Q562 PolarHBondContact O-NE2 3.18Å; Q489-Q562 VanDerWaalsContact NE2-CD 3.32Å; I558-Q562 HydrophobicContact CG2-CG 4.37Å; I558-Q562 WeakPolarHBondContact O-CG 3.44Å; I558-Q562 PolarHBondContact O-N 3.25Å; Q559-Q562 PolarHBondContact O-N 2.75Å
563	R	78.6	Confident	80.4	Confident	74 Å²	74	50.6 Å²	50.6	28%	0.279	25%	0.253	S	S	.	.	H	α-helix	trans	-73.6	-24	179	-73.3	177.6	-171.7	124.9	27.2	114.4	Q559 T560 F561 T1053 S1057	Q559-R563 WeakPolarHBondContact O-CB 3.29Å; Q559-R563 VanDerWaalsContact O-CG 3.31Å; Q559-R563 WeakPolarHBondContact O-CG 3.3Å; Q559-R563 PolarHBondContact O-N 3.45Å; T560-R563 PolarHBondContact O-N 3.34Å; F561-R563 VanDerWaalsContact C-N 3.34Å; F561-R563 PolarHBondContact O-N 2.99Å; R563-T1053 PolarHBondContact NH1-O 3.42Å; R563-S1057 PolarHBondContact NH1-OG 2.63Å; R563-S1057 PolarHBondContact NH2-OG 2.68Å
564	R	78.7	Confident	80.4	Confident	125 Å²	125	54.2 Å²	54.2	47%	0.472	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.4	22.5	-173.5	-67.2	-168.8	171.6	-157.4	10.6	113.9	T560 F561 S566 I579 E582	T560-R564 WeakPolarHBondContact O-CB 3.26Å; T560-R564 PolarHBondContact O-N 3.39Å; F561-R564 CarbonylContact O-C 3.59Å; F561-R564 PolarHBondContact O-N 3.41Å; R564-S566 PolarHBondContact O-N 2.9Å; R564-I579 HydrophobicContact CB-CD1 3.64Å; R564-E582 WeakPolarHBondContact CD-OE2 3.04Å; R564-E582 VanDerWaalsContact CZ-CD 3.45Å; R564-E582 IonicContact CZ-OE1 2.69Å; R564-E582 IonicContact CZ-OE2 2.78Å; R564-E582 IonicContact NE-OE1 3.6Å; R564-E582 IonicContact NE-OE2 3.69Å; R564-E582 IonicContact NH1-OE1 3.61Å; R564-E582 PolarHBondContact NH1-OE1 3.06Å; R564-E582 IonicContact NH1-OE2 3.71Å; R564-E582 PolarHBondContact NH1-OE2 3.43Å; R564-E582 IonicContact NH2-OE1 3.76Å; R564-E582 PolarHBondContact NH2-OE1 3.36Å; R564-E582 IonicContact NH2-OE2 3.78Å
565	R	76.4	Confident	80.3	Confident	83 Å²	83	54.9 Å²	54.9	31%	0.313	27%	0.272	S	S	.	.			trans	-58	121.5	169.4	-167.5	-178.8	-165.5	129.3	-0.8	109.1	F561 E642	F561-R565 PolarHBondContact O-N 3.19Å; F561-R565 VanDerWaalsContact O-N 3.09Å; R565-E642 IonicContact CZ-OE1 2.81Å; R565-E642 VanDerWaalsContact CZ-OE1 3.24Å; R565-E642 IonicContact NH1-OE1 2.79Å; R565-E642 PolarHBondContact NH1-OE1 3.29Å; R565-E642 IonicContact NH2-OE1 3.42Å; R565-E642 PolarHBondContact NH2-OE1 3.46Å
566	S	62.8	Low	80.4	Confident	34 Å²	34	55 Å²	55	24%	0.238	27%	0.273	C	S	.	.			trans	-82.3	137.2	-177.2	-170	0	0	0	0	110.9	R564 A568 E570	R564-S566 PolarHBondContact O-N 2.9Å; S566-A568 VanDerWaalsContact C-N 3.29Å; S566-A568 PolarHBondContact OG-N 3.44Å; S566-E570 VanDerWaalsContact CB-OE1 3.29Å; S566-E570 WeakPolarHBondContact CB-OE1 3.18Å; S566-E570 WeakPolarHBondContact CB-OE2 3.27Å; S566-E570 PolarHBondContact OG-OE1 3.19Å; S566-E570 PolarHBondContact OG-OE2 2.79Å
567	K	59.8	Low	80.7	Confident	170 Å²	170	54.3 Å²	54.3	74%	0.739	27%	0.27	S	S	*	.	S	Bend	trans	-83.1	-8.8	173.8	-64.6	-179.9	179.6	172.6	0	112.7	E661	K567-E661 WeakPolarHBondContact CE-OE2 3.11Å; K567-E661 IonicContact NZ-OE2 2.72Å; K567-E661 PolarHBondContact NZ-OE2 3.15Å
568	A	63.5	Low	80.7	Confident	52 Å²	52	58.2 Å²	58.2	43%	0.43	28%	0.284	S	S	.	.	S	Bend	trans	-79.6	152.2	171.5	0	0	0	0	0	110.7	S566 E570	S566-A568 VanDerWaalsContact C-N 3.29Å; S566-A568 PolarHBondContact OG-N 3.44Å; A568-E570 HydrophobicContact CB-CG 4.36Å; A568-E570 PolarHBondContact O-N 3.3Å
569	P	66.5	Low	80.8	Confident	142 Å²	142	58.4 Å²	58.4	92%	0.922	29%	0.285	S	S	*	.			trans	-72.6	73.2	175.9	31.3	-36	0	0	0	111.5
570	E	74.9	Confident	81.1	Confident	62 Å²	62	57.5 Å²	57.5	29%	0.29	28%	0.281	S	S	.	.			trans	-89.9	150.2	171.5	-64.7	168.4	-175.3	0	0	110.4	S566 A568 Q575 R578	S566-E570 VanDerWaalsContact CB-OE1 3.29Å; S566-E570 WeakPolarHBondContact CB-OE1 3.18Å; S566-E570 WeakPolarHBondContact CB-OE2 3.27Å; S566-E570 PolarHBondContact OG-OE1 3.19Å; S566-E570 PolarHBondContact OG-OE2 2.79Å; A568-E570 HydrophobicContact CB-CG 4.36Å; A568-E570 PolarHBondContact O-N 3.3Å; E570-Q575 HydrophobicContact CB-CG 3.78Å; E570-Q575 WeakPolarHBondContact OE2-CG 3.42Å; E570-R578 IonicContact OE1-CZ 3.66Å; E570-R578 IonicContact OE1-NH1 2.7Å; E570-R578 PolarHBondContact OE1-NH1 3.16Å; E570-R578 IonicContact OE1-NH2 3.64Å; E570-R578 IonicContact OE2-CZ 3.84Å; E570-R578 VanDerWaalsContact OE2-CZ 3.27Å; E570-R578 IonicContact OE2-NH1 2.97Å; E570-R578 PolarHBondContact OE2-NH1 3.33Å; E570-R578 IonicContact OE2-NH2 3.14Å; E570-R578 PolarHBondContact OE2-NH2 3.02Å
571	L	84.4	Confident	81.3	Confident	120 Å²	120	57 Å²	57	63%	0.628	28%	0.279	S	S	*	.			trans	-69.9	142.7	172.4	-69.9	165.6	0	0	0	110.3	E573 E574 Q575	L571-E573 PolarHBondContact O-N 3.37Å; L571-E574 HydrophobicContact CB-CB 4.44Å; L571-E574 PolarHBondContact O-N 3.33Å; L571-Q575 PolarHBondContact O-N 3.46Å
572	L	85.5	Confident	81.2	Confident	26 Å²	26	59.8 Å²	59.8	14%	0.136	29%	0.292	C	S	.	.	H	α-helix	trans	-52.4	-39.5	174.7	179.7	72.3	0	0	0	112	E574 Q575 V576 L639 R640 M643	L572-E574 VanDerWaalsContact C-N 3.31Å; L572-E574 PolarHBondContact O-N 2.91Å; L572-Q575 PolarHBondContact O-N 3.1Å; L572-V576 HydrophobicContact CD1-CG2 4.09Å; L572-V576 HydrophobicContact CG-CG2 4.37Å; L572-V576 WeakPolarHBondContact O-CG2 3.42Å; L572-V576 PolarHBondContact O-N 3.47Å; L572-L639 HydrophobicContact CD1-CB 3.94Å; L572-L639 HydrophobicContact CD1-CD1 4.03Å; L572-L639 HydrophobicContact CD2-CB 4.45Å; L572-R640 HydrophobicContact CD2-CG 3.8Å; L572-M643 HydrophobicContact CB-CE 4.08Å; L572-M643 HydrophobicContact CD1-CE 3.86Å; L572-M643 HydrophobicContact CD1-SD 4.35Å; L572-M643 HydrophobicContact CD2-CE 3.72Å; L572-M643 HydrophobicContact CG-CE 4.08Å
573	E	87.6	Confident	81.4	Confident	50 Å²	50	57.8 Å²	57.8	23%	0.234	28%	0.283	C	S	.	.	H	α-helix	trans	-55.9	-46.9	177.3	-56.7	-177.7	172.1	0	0	111.3	T196 R197 L571 A577	T196-E573 WeakPolarHBondContact OG1-CA 3.24Å; R197-E573 HydrophobicContact CG-CG 4.46Å; R197-E573 VanDerWaalsContact CG-OE1 3.23Å; R197-E573 WeakPolarHBondContact CG-OE1 2.82Å; R197-E573 IonicContact CZ-OE2 3.15Å; R197-E573 IonicContact NE-OE1 2.71Å; R197-E573 IonicContact NE-OE2 2.79Å; R197-E573 PolarHBondContact NE-OE2 3.42Å; R197-E573 IonicContact NH2-OE2 3.2Å; R197-E573 PolarHBondContact NH2-OE2 3.06Å; L571-E573 PolarHBondContact O-N 3.37Å; E573-A577 WeakPolarHBondContact O-CB 3.32Å; E573-A577 PolarHBondContact O-N 3.39Å
574	E	89	Confident	82	Confident	75 Å²	75	54.5 Å²	54.5	35%	0.35	27%	0.271	S	S	.	.	H	α-helix	trans	-73.7	-37.9	-179.2	-169.2	58.2	-139.9	0	0	111.9	H189 L571 L572 A577 R578	H189-E574 IonicContact CD2-OE1 2.65Å; H189-E574 IonicContact CE1-OE1 2.89Å; H189-E574 PolarHBondContact CE1-OE1 2.99Å; H189-E574 IonicContact CE1-OE2 2.75Å; H189-E574 IonicContact NE2-OE1 3.79Å; H189-E574 PolarHBondContact NE2-OE1 3.38Å; H189-E574 IonicContact NE2-OE2 3.74Å; L571-E574 HydrophobicContact CB-CB 4.44Å; L571-E574 PolarHBondContact O-N 3.33Å; L572-E574 VanDerWaalsContact C-N 3.31Å; L572-E574 PolarHBondContact O-N 2.91Å; E574-A577 PolarHBondContact O-N 2.93Å; E574-R578 WeakPolarHBondContact O-CB 3.31Å; E574-R578 PolarHBondContact O-N 3.05Å
575	Q	88.5	Confident	82.4	Confident	20 Å²	20	48.6 Å²	48.6	9%	0.093	25%	0.249	C	C	.	.	H	α-helix	trans	-59.9	-50.3	174.5	-72.5	-172.4	-12.9	0	0	111.4	F561 E570 L571 L572 R578 I579	F561-Q575 HydrophobicContact CE2-CB 4.47Å; E570-Q575 HydrophobicContact CB-CG 3.78Å; E570-Q575 WeakPolarHBondContact OE2-CG 3.42Å; L571-Q575 PolarHBondContact O-N 3.46Å; L572-Q575 PolarHBondContact O-N 3.1Å; Q575-R578 PolarHBondContact O-N 3.46Å; Q575-I579 WeakPolarHBondContact O-CG1 3.08Å; Q575-I579 PolarHBondContact O-N 3.14Å
576	V	89.8	Confident	82.9	Confident	2 Å²	2	45.2 Å²	45.2	1%	0.012	24%	0.238	C	C	.	.	H	α-helix	trans	-71.5	-35.9	179.2	173.8	0	0	0	0	111.2	T196 F561 L572 R578 I579 T580 L632 L639	T196-V576 HydrophobicContact CG2-CB 3.53Å; T196-V576 HydrophobicContact CG2-CG1 3.43Å; T196-V576 VanDerWaalsContact CG2-CG1 3.43Å; T196-V576 HydrophobicContact CG2-CG2 4.19Å; F561-V576 HydrophobicContact CD2-CG2 4.38Å; F561-V576 HydrophobicContact CE2-CG2 3.82Å; L572-V576 HydrophobicContact CD1-CG2 4.09Å; L572-V576 HydrophobicContact CG-CG2 4.37Å; L572-V576 WeakPolarHBondContact O-CG2 3.42Å; L572-V576 PolarHBondContact O-N 3.47Å; V576-R578 PolarHBondContact O-N 3.04Å; V576-I579 PolarHBondContact O-N 3Å; V576-T580 HydrophobicContact CG1-CG2 4.21Å; V576-T580 WeakPolarHBondContact O-CB 3.32Å; V576-T580 WeakPolarHBondContact O-CG2 3.42Å; V576-T580 PolarHBondContact O-N 3.27Å; V576-T580 PolarHBondContact O-OG1 3.42Å; V576-L632 HydrophobicContact CG1-CD1 3.93Å; V576-L639 HydrophobicContact CG2-CD1 3.68Å
577	A	90.6	Very high	84.1	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-60.2	-43	173.5	0	0	0	0	0	112.8	H189 I193 E573 E574 T580 A581	H189-A577 WeakPolarHBondContact O-CB 3.46Å; I193-A577 HydrophobicContact CD1-CB 4.44Å; I193-A577 HydrophobicContact CG1-CB 3.63Å; E573-A577 WeakPolarHBondContact O-CB 3.32Å; E573-A577 PolarHBondContact O-N 3.39Å; E574-A577 PolarHBondContact O-N 2.93Å; A577-T580 WeakPolarHBondContact CA-OG1 3.32Å; A577-T580 PolarHBondContact O-OG1 3.43Å; A577-T580 VanDerWaalsContact O-OG1 3.07Å; A577-A581 VanDerWaalsContact O-CB 3.27Å; A577-A581 WeakPolarHBondContact O-CB 2.84Å; A577-A581 PolarHBondContact O-N 3.26Å
578	R	89.7	Confident	85.5	Confident	88 Å²	88	36.4 Å²	36.4	33%	0.332	20%	0.196	S	C	.	.	H	α-helix	trans	-63.1	-43.2	175.1	-177.3	176	62.2	-141.4	-10.2	112.4	E570 E574 Q575 V576 E582	E570-R578 IonicContact OE1-CZ 3.66Å; E570-R578 IonicContact OE1-NH1 2.7Å; E570-R578 PolarHBondContact OE1-NH1 3.16Å; E570-R578 IonicContact OE1-NH2 3.64Å; E570-R578 IonicContact OE2-CZ 3.84Å; E570-R578 VanDerWaalsContact OE2-CZ 3.27Å; E570-R578 IonicContact OE2-NH1 2.97Å; E570-R578 PolarHBondContact OE2-NH1 3.33Å; E570-R578 IonicContact OE2-NH2 3.14Å; E570-R578 PolarHBondContact OE2-NH2 3.02Å; E574-R578 WeakPolarHBondContact O-CB 3.31Å; E574-R578 PolarHBondContact O-N 3.05Å; Q575-R578 PolarHBondContact O-N 3.46Å; V576-R578 PolarHBondContact O-N 3.04Å; R578-E582 PolarHBondContact O-N 2.98Å
579	I	90.2	Very high	86.7	Confident	4 Å²	4	34 Å²	34	2%	0.021	18%	0.176	C	C	.	.	H	α-helix	trans	-72.4	-37.2	-179.8	-59.2	-61.2	0	0	0	111.7	L557 T560 F561 R564 Q575 V576 E582 V583	L557-I579 HydrophobicContact CD1-CG2 4.26Å; T560-I579 HydrophobicContact CG2-CD1 4.33Å; T560-I579 HydrophobicContact CG2-CG2 4.24Å; F561-I579 HydrophobicContact CB-CG2 4.2Å; F561-I579 HydrophobicContact CD2-CG1 4.07Å; R564-I579 HydrophobicContact CB-CD1 3.64Å; Q575-I579 WeakPolarHBondContact O-CG1 3.08Å; Q575-I579 PolarHBondContact O-N 3.14Å; V576-I579 PolarHBondContact O-N 3Å; I579-E582 PolarHBondContact O-N 2.57Å; I579-V583 HydrophobicContact CG2-CG2 4Å; I579-V583 WeakPolarHBondContact O-CB 2.94Å; I579-V583 WeakPolarHBondContact O-CG2 3.03Å; I579-V583 PolarHBondContact O-N 2.92Å
580	T	91.3	Very high	87.6	Confident	2 Å²	2	27.3 Å²	27.3	1%	0.012	13%	0.132	C	C	.	.	H	α-helix	trans	-67.5	-37.8	174.2	47	0	0	0	0	112.2	F188 L557 V576 A577 E582 V584 L632	F188-T580 PolarHBondContact O-OG1 3.4Å; L557-T580 HydrophobicContact CD1-CG2 4.48Å; V576-T580 HydrophobicContact CG1-CG2 4.21Å; V576-T580 WeakPolarHBondContact O-CB 3.32Å; V576-T580 WeakPolarHBondContact O-CG2 3.42Å; V576-T580 PolarHBondContact O-N 3.27Å; V576-T580 PolarHBondContact O-OG1 3.42Å; A577-T580 WeakPolarHBondContact CA-OG1 3.32Å; A577-T580 PolarHBondContact O-OG1 3.43Å; A577-T580 VanDerWaalsContact O-OG1 3.07Å; T580-E582 VanDerWaalsContact C-N 3.28Å; T580-E582 PolarHBondContact O-N 2.98Å; T580-V584 HydrophobicContact CG2-CG2 4.21Å; T580-V584 VanDerWaalsContact O-CB 3.24Å; T580-V584 WeakPolarHBondContact O-CB 2.88Å; T580-V584 VanDerWaalsContact O-CG2 3.29Å; T580-V584 WeakPolarHBondContact O-CG2 2.84Å; T580-V584 PolarHBondContact O-N 3.31Å; T580-L632 HydrophobicContact CG2-CD1 3.56Å; T580-L632 HydrophobicContact CG2-CD2 3.82Å; T580-L632 HydrophobicContact CG2-CG 4.36Å
581	A	89.1	Confident	88.2	Confident	11 Å²	11	24.4 Å²	24.4	9%	0.091	12%	0.119	C	C	.	.	H	α-helix	trans	-60	-35	171.6	0	0	0	0	0	113.2	Q185 H189 A577 P585	Q185-A581 HydrophobicContact CB-CB 4.49Å; H189-A581 HydrophobicContact CB-CB 3.88Å; A577-A581 VanDerWaalsContact O-CB 3.27Å; A577-A581 WeakPolarHBondContact O-CB 2.84Å; A577-A581 PolarHBondContact O-N 3.26Å; A581-P585 WeakPolarHBondContact O-CD 3.44Å; A581-P585 WeakPolarHBondContact O-CG 3.27Å
582	E	85	Confident	88.3	Confident	68 Å²	68	21.6 Å²	21.6	32%	0.318	10%	0.102	S	C	.	.	H	α-helix	trans	-82	-44.4	178.8	-178.5	165.2	-143.3	0	0	113.3	R564 R578 I579 T580	R564-E582 WeakPolarHBondContact CD-OE2 3.04Å; R564-E582 VanDerWaalsContact CZ-CD 3.45Å; R564-E582 IonicContact CZ-OE1 2.69Å; R564-E582 IonicContact CZ-OE2 2.78Å; R564-E582 IonicContact NE-OE1 3.6Å; R564-E582 IonicContact NE-OE2 3.69Å; R564-E582 IonicContact NH1-OE1 3.61Å; R564-E582 PolarHBondContact NH1-OE1 3.06Å; R564-E582 IonicContact NH1-OE2 3.71Å; R564-E582 PolarHBondContact NH1-OE2 3.43Å; R564-E582 IonicContact NH2-OE1 3.76Å; R564-E582 PolarHBondContact NH2-OE1 3.36Å; R564-E582 IonicContact NH2-OE2 3.78Å; R578-E582 PolarHBondContact O-N 2.98Å; I579-E582 PolarHBondContact O-N 2.57Å; T580-E582 VanDerWaalsContact C-N 3.28Å; T580-E582 PolarHBondContact O-N 2.98Å
583	V	88.3	Confident	88.2	Confident	6 Å²	6	20.4 Å²	20.4	4%	0.036	10%	0.095	C	C	.	.	H	α-helix	trans	-86.7	-44.4	-171.1	178.9	0	0	0	0	112.6	I556 L557 T560 I579 T586 M587	I556-V583 HydrophobicContact CG2-CG1 3.84Å; L557-V583 HydrophobicContact CB-CG1 4.38Å; L557-V583 HydrophobicContact CD1-CB 4.23Å; L557-V583 HydrophobicContact CD1-CG1 4.24Å; T560-V583 HydrophobicContact CG2-CG2 3.68Å; I579-V583 HydrophobicContact CG2-CG2 4Å; I579-V583 WeakPolarHBondContact O-CB 2.94Å; I579-V583 WeakPolarHBondContact O-CG2 3.03Å; I579-V583 PolarHBondContact O-N 2.92Å; V583-T586 WeakPolarHBondContact O-CA 3.01Å; V583-T586 VanDerWaalsContact O-CB 3.27Å; V583-T586 WeakPolarHBondContact O-CB 3.38Å; V583-T586 PolarHBondContact O-N 3.22Å; V583-T586 PolarHBondContact O-OG1 3.42Å; V583-M587 HydrophobicContact CG1-CG 4Å; V583-M587 HydrophobicContact CG1-SD 3.85Å; V583-M587 PolarHBondContact O-N 3.22Å; V583-M587 VanDerWaalsContact O-N 3.16Å
584	V	90.8	Very high	87.8	Confident	4 Å²	4	18 Å²	18	2%	0.024	8%	0.084	C	C	.	.	H	α-helix	trans	-64.8	-33.8	-171	-174.6	0	0	0	0	113.7	F188 T580 T586 M587 L588 F624 V628	F188-V584 HydrophobicContact CB-CB 4.42Å; F188-V584 HydrophobicContact CD1-CB 3.93Å; F188-V584 HydrophobicContact CD1-CG1 3.49Å; F188-V584 VanDerWaalsContact CD1-CG1 3.49Å; F188-V584 HydrophobicContact CD2-CB 4.45Å; F188-V584 HydrophobicContact CD2-CG1 4.42Å; F188-V584 HydrophobicContact CE1-CB 4.3Å; F188-V584 HydrophobicContact CE1-CG1 3.41Å; F188-V584 VanDerWaalsContact CE1-CG1 3.41Å; F188-V584 HydrophobicContact CE2-CG1 4.34Å; F188-V584 HydrophobicContact CG-CB 4.02Å; F188-V584 HydrophobicContact CG-CG1 4.02Å; F188-V584 HydrophobicContact CZ-CG1 3.86Å; T580-V584 HydrophobicContact CG2-CG2 4.21Å; T580-V584 VanDerWaalsContact O-CB 3.24Å; T580-V584 WeakPolarHBondContact O-CB 2.88Å; T580-V584 VanDerWaalsContact O-CG2 3.29Å; T580-V584 WeakPolarHBondContact O-CG2 2.84Å; T580-V584 PolarHBondContact O-N 3.31Å; V584-T586 PolarHBondContact O-N 3.03Å; V584-T586 VanDerWaalsContact O-N 3.11Å; V584-M587 HydrophobicContact CB-SD 4.39Å; V584-M587 HydrophobicContact CG2-SD 3.96Å; V584-M587 PolarHBondContact O-N 2.64Å; V584-L588 VanDerWaalsContact O-CB 3.25Å; V584-L588 WeakPolarHBondContact O-CB 3.44Å; V584-L588 PolarHBondContact O-N 3.33Å; V584-F624 HydrophobicContact CG1-CE2 4.21Å; V584-F624 HydrophobicContact CG1-CZ 4.22Å; V584-V628 HydrophobicContact CG1-CG1 4.46Å; V584-V628 HydrophobicContact CG1-CG2 3.72Å
585	P	87.6	Confident	87.5	Confident	1 Å²	1	14.5 Å²	14.5	1%	0.006	7%	0.068	C	C	.	.	H	α-helix	trans	-58.2	-21.5	168.4	-25.9	34.4	0	0	0	114.6	F188 A581 L589	F188-P585 HydrophobicContact CD2-CG 3.8Å; F188-P585 HydrophobicContact CE2-CG 4.3Å; A581-P585 WeakPolarHBondContact O-CD 3.44Å; A581-P585 WeakPolarHBondContact O-CG 3.27Å; P585-L589 WeakPolarHBondContact O-CB 3.1Å; P585-L589 PolarHBondContact O-N 3Å
586	T	85.3	Confident	87.2	Confident	13 Å²	13	16.5 Å²	16.5	8%	0.08	8%	0.076	C	C	.	.	H	α-helix	trans	-88.6	-42.4	178.4	-37.9	0	0	0	0	111.5	V583 V584 L588 L589 S590 H1030 R1033	V583-T586 WeakPolarHBondContact O-CA 3.01Å; V583-T586 VanDerWaalsContact O-CB 3.27Å; V583-T586 WeakPolarHBondContact O-CB 3.38Å; V583-T586 PolarHBondContact O-N 3.22Å; V583-T586 PolarHBondContact O-OG1 3.42Å; V584-T586 PolarHBondContact O-N 3.03Å; V584-T586 VanDerWaalsContact O-N 3.11Å; T586-L588 PolarHBondContact O-N 3.26Å; T586-L589 WeakPolarHBondContact O-CB 3.26Å; T586-L589 PolarHBondContact O-N 3.18Å; T586-L589 VanDerWaalsContact O-N 3.14Å; T586-S590 PolarHBondContact O-N 3.36Å; T586-H1030 WeakPolarHBondContact CB-CE1 3.39Å; T586-H1030 WeakPolarHBondContact CG2-CE1 3.2Å; T586-H1030 WeakPolarHBondContact CG2-ND1 3.5Å; T586-R1033 WeakPolarHBondContact OG1-CD 3.05Å; T586-R1033 PolarHBondContact OG1-NE 2.88Å
587	M	88.4	Confident	86.3	Confident	3 Å²	3	16.4 Å²	16.4	2%	0.015	8%	0.075	C	C	.	.	H	α-helix	trans	-59	-39.3	169	-55.5	163.7	73.2	0	0	110.8	N553 V583 V584 S590 S591 F624 Q627	N553-M587 HydrophobicContact CB-CE 3.73Å; N553-M587 HydrophobicContact CB-CG 4.4Å; N553-M587 WeakPolarHBondContact OD1-CB 2.98Å; N553-M587 VanDerWaalsContact OD1-CG 3.32Å; N553-M587 WeakPolarHBondContact OD1-CG 3.3Å; V583-M587 HydrophobicContact CG1-CG 4Å; V583-M587 HydrophobicContact CG1-SD 3.85Å; V583-M587 PolarHBondContact O-N 3.22Å; V583-M587 VanDerWaalsContact O-N 3.16Å; V584-M587 HydrophobicContact CB-SD 4.39Å; V584-M587 HydrophobicContact CG2-SD 3.96Å; V584-M587 PolarHBondContact O-N 2.64Å; M587-S590 PolarHBondContact O-OG 3.15Å; M587-S591 VanDerWaalsContact O-CB 3.27Å; M587-S591 WeakPolarHBondContact O-CB 3.37Å; M587-S591 PolarHBondContact O-N 3.01Å; M587-S591 PolarHBondContact O-OG 2.94Å; M587-S591 VanDerWaalsContact O-OG 3.13Å; M587-F624 HydrophobicContact CB-CD2 4.34Å; M587-F624 HydrophobicContact CB-CE2 4.1Å; M587-Q627 HydrophobicContact CE-CB 4.25Å
588	L	90.3	Very high	85.6	Confident	16 Å²	16	16.4 Å²	16.4	8%	0.084	8%	0.075	C	C	.	.	H	α-helix	trans	-62.3	-45.2	174	-177.1	77.5	0	0	0	110.9	L184 F188 V584 T586 F592 F624 L965	L184-L588 HydrophobicContact CD2-CD2 4.31Å; F188-L588 HydrophobicContact CE2-CD2 4.11Å; F188-L588 HydrophobicContact CZ-CD2 4.12Å; V584-L588 VanDerWaalsContact O-CB 3.25Å; V584-L588 WeakPolarHBondContact O-CB 3.44Å; V584-L588 PolarHBondContact O-N 3.33Å; T586-L588 PolarHBondContact O-N 3.26Å; L588-F592 HydrophobicContact CD1-CD1 3.57Å; L588-F592 HydrophobicContact CD1-CD2 4.41Å; L588-F592 HydrophobicContact CD1-CE1 3.37Å; L588-F592 HydrophobicContact CD1-CE2 4.24Å; L588-F592 HydrophobicContact CD1-CG 4.12Å; L588-F592 HydrophobicContact CD1-CZ 3.74Å; L588-F592 HydrophobicContact CG-CD1 4.3Å; L588-F592 WeakPolarHBondContact O-CB 3.22Å; L588-F592 PolarHBondContact O-N 2.95Å; L588-F624 HydrophobicContact CB-CE2 4.01Å; L588-F624 HydrophobicContact CB-CZ 3.97Å; L588-F624 HydrophobicContact CD1-CE1 3.75Å; L588-F624 HydrophobicContact CD1-CE2 4.2Å; L588-F624 HydrophobicContact CD1-CZ 3.46Å; L588-F624 VanDerWaalsContact CD1-CZ 3.46Å; L588-F624 HydrophobicContact CG-CZ 4.35Å; L588-L965 HydrophobicContact CD2-CD1 4.42Å; L588-L965 HydrophobicContact CD2-CD2 4.12Å; L588-L965 HydrophobicContact CG-CD1 4.35Å
589	L	87.3	Confident	85.1	Confident	2 Å²	2	15.6 Å²	15.6	1%	0.01	7%	0.074	C	C	.	.	H	α-helix	trans	-59.5	-46.1	178.6	163.9	63.8	0	0	0	111.8	P585 T586 S593 V961 L965 M966 A1029	P585-L589 WeakPolarHBondContact O-CB 3.1Å; P585-L589 PolarHBondContact O-N 3Å; T586-L589 WeakPolarHBondContact O-CB 3.26Å; T586-L589 PolarHBondContact O-N 3.18Å; T586-L589 VanDerWaalsContact O-N 3.14Å; L589-S593 WeakPolarHBondContact O-CB 3.47Å; L589-S593 PolarHBondContact O-N 3.13Å; L589-S593 PolarHBondContact O-OG 3.04Å; L589-V961 HydrophobicContact CD1-CG1 4.44Å; L589-L965 HydrophobicContact CB-CB 4.27Å; L589-L965 HydrophobicContact CB-CD1 4.33Å; L589-L965 HydrophobicContact CD1-CB 4Å; L589-L965 HydrophobicContact CD1-CD1 4.48Å; L589-M966 HydrophobicContact CD2-CE 3.86Å; L589-M966 HydrophobicContact CD2-CG 4.09Å; L589-A1029 HydrophobicContact CD2-CB 4.17Å
590	S	85.5	Confident	84.2	Confident	0 Å²	0	15.4 Å²	15.4	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-72.1	-59.6	177.8	63.4	0	0	0	0	111.5	T586 M587 F592 S593 E594 E1026	T586-S590 PolarHBondContact O-N 3.36Å; M587-S590 PolarHBondContact O-OG 3.15Å; S590-F592 PolarHBondContact O-N 3.33Å; S590-F592 VanDerWaalsContact O-N 3.08Å; S590-S593 CarbonylContact O-C 3.59Å; S590-S593 WeakPolarHBondContact O-CA 3.5Å; S590-S593 WeakPolarHBondContact O-CB 3.34Å; S590-S593 PolarHBondContact O-N 3.29Å; S590-E594 WeakPolarHBondContact O-CG 3.35Å; S590-E594 PolarHBondContact O-N 2.96Å; S590-E1026 WeakPolarHBondContact CB-OE1 3.19Å; S590-E1026 WeakPolarHBondContact CB-OE2 3.21Å; S590-E1026 VanDerWaalsContact OG-CD 3.25Å; S590-E1026 PolarHBondContact OG-OE1 2.93Å; S590-E1026 PolarHBondContact OG-OE2 3.41Å
591	S	87.9	Confident	83.1	Confident	1 Å²	1	15.3 Å²	15.3	1%	0.007	7%	0.073	C	C	.	.	H	α-helix	trans	-62.7	-22.2	-174.9	-54.1	0	0	0	0	114.1	N553 M587 G595 I620	N553-S591 PolarHBondContact ND2-OG 3.49Å; N553-S591 VanDerWaalsContact ND2-OG 3.13Å; M587-S591 VanDerWaalsContact O-CB 3.27Å; M587-S591 WeakPolarHBondContact O-CB 3.37Å; M587-S591 PolarHBondContact O-N 3.01Å; M587-S591 PolarHBondContact O-OG 2.94Å; M587-S591 VanDerWaalsContact O-OG 3.13Å; S591-G595 WeakPolarHBondContact O-CA 3.4Å; S591-G595 PolarHBondContact O-N 3.05Å; S591-I620 WeakPolarHBondContact O-CG2 3.35Å
592	F	87.3	Confident	82.5	Confident	62 Å²	62	15.6 Å²	15.6	27%	0.272	8%	0.075	S	C	.	.	H	α-helix	trans	-81.4	-35.2	167.7	-83.5	40.8	0	0	0	112.5	L588 S590 E594 F596 F621 F624 V961	L588-F592 HydrophobicContact CD1-CD1 3.57Å; L588-F592 HydrophobicContact CD1-CD2 4.41Å; L588-F592 HydrophobicContact CD1-CE1 3.37Å; L588-F592 HydrophobicContact CD1-CE2 4.24Å; L588-F592 HydrophobicContact CD1-CG 4.12Å; L588-F592 HydrophobicContact CD1-CZ 3.74Å; L588-F592 HydrophobicContact CG-CD1 4.3Å; L588-F592 WeakPolarHBondContact O-CB 3.22Å; L588-F592 PolarHBondContact O-N 2.95Å; S590-F592 PolarHBondContact O-N 3.33Å; S590-F592 VanDerWaalsContact O-N 3.08Å; F592-E594 VanDerWaalsContact C-N 3.31Å; F592-F596 HydrophobicContact CB-CD2 4.35Å; F592-F596 HydrophobicContact CB-CE2 4.23Å; F592-F596 AromaticContact CD2-CE2 3.87Å; F592-F596 HydrophobicContact CD2-CE2 3.87Å; F592-F596 HydrophobicContact CD2-CZ 4.23Å; F592-F596 HydrophobicContact CG-CE2 4.44Å; F592-F596 WeakPolarHBondContact O-CB 3.46Å; F592-F596 WeakPolarHBondContact O-CD2 3.34Å; F592-F596 WeakPolarHBondContact O-CG 3.45Å; F592-F596 PolarHBondContact O-N 2.76Å; F592-F621 HydrophobicContact CD1-CD1 4.35Å; F592-F621 AromaticContact CD1-CE1 3.78Å; F592-F621 HydrophobicContact CD1-CE1 3.78Å; F592-F621 HydrophobicContact CD2-CE1 4.38Å; F592-F621 HydrophobicContact CE1-CD1 4.06Å; F592-F621 AromaticContact CE1-CE1 3.77Å; F592-F621 HydrophobicContact CE1-CE1 3.77Å; F592-F621 HydrophobicContact CE2-CE1 4.39Å; F592-F621 HydrophobicContact CG-CE1 4.08Å; F592-F621 HydrophobicContact CZ-CE1 4.08Å; F592-F624 HydrophobicContact CE1-CD1 4.18Å; F592-F624 HydrophobicContact CE1-CE1 4.16Å; F592-V961 HydrophobicContact CB-CG1 4.42Å
593	S	82.4	Confident	81.9	Confident	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-60.7	-46	171.2	-57.6	0	0	0	0	110	L589 S590 C597 V961 A1020 V1021	L589-S593 WeakPolarHBondContact O-CB 3.47Å; L589-S593 PolarHBondContact O-N 3.13Å; L589-S593 PolarHBondContact O-OG 3.04Å; S590-S593 CarbonylContact O-C 3.59Å; S590-S593 WeakPolarHBondContact O-CA 3.5Å; S590-S593 WeakPolarHBondContact O-CB 3.34Å; S590-S593 PolarHBondContact O-N 3.29Å; S593-C597 WeakPolarHBondContact O-CB 3.34Å; S593-C597 PolarHBondContact O-N 2.98Å; S593-V961 VanDerWaalsContact OG-CG1 3.3Å; S593-V961 WeakPolarHBondContact OG-CG1 3.48Å; S593-A1020 CarbonylContact O-C 3.52Å; S593-A1020 WeakPolarHBondContact O-CB 3.42Å; S593-V1021 CarbonylContact C-O 3.55Å; S593-V1021 WeakPolarHBondContact CB-O 3.43Å; S593-V1021 CarbonylContact O-C 3.6Å; S593-V1021 PolarHBondContact O-N 3.15Å
594	E	79.4	Confident	81.2	Confident	1 Å²	1	15.6 Å²	15.6	1%	0.005	8%	0.077	C	C	.	.	H	α-helix	trans	-74.5	-46.3	-179.8	-50.3	-151.3	125.1	0	0	111.9	V549 S590 F592 F596 C597 F598 I620 V1021 I1023	V549-E594 VanDerWaalsContact CG1-OE2 3.32Å; V549-E594 WeakPolarHBondContact CG1-OE2 3.37Å; V549-E594 WeakPolarHBondContact CG2-OE2 3.35Å; S590-E594 WeakPolarHBondContact O-CG 3.35Å; S590-E594 PolarHBondContact O-N 2.96Å; F592-E594 VanDerWaalsContact C-N 3.31Å; E594-F596 VanDerWaalsContact C-N 3.28Å; E594-F596 PolarHBondContact O-N 2.98Å; E594-C597 WeakPolarHBondContact O-CA 3.18Å; E594-C597 WeakPolarHBondContact O-CB 3.4Å; E594-C597 PolarHBondContact O-N 2.99Å; E594-F598 HydrophobicContact CB-CE2 4.38Å; E594-F598 WeakPolarHBondContact O-CD2 3.43Å; E594-F598 PolarHBondContact O-N 3.4Å; E594-I620 HydrophobicContact CB-CD1 3.94Å; E594-I620 HydrophobicContact CB-CG2 4.43Å; E594-V1021 WeakPolarHBondContact CA-O 3.41Å; E594-V1021 PolarHBondContact N-O 3.16Å; E594-V1021 VanDerWaalsContact N-O 3.11Å; E594-I1023 VanDerWaalsContact OE1-CA 3.27Å; E594-I1023 WeakPolarHBondContact OE1-CA 3.43Å; E594-I1023 PolarHBondContact OE1-N 2.95Å
595	G	82.2	Confident	80.5	Confident	0 Å²	0	18.2 Å²	18.2	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-57	-41.5	177.6	0	0	0	0	0	112.1	S591 A617 F621	S591-G595 WeakPolarHBondContact O-CA 3.4Å; S591-G595 PolarHBondContact O-N 3.05Å; G595-A617 WeakPolarHBondContact O-CB 3.46Å; G595-F621 VanDerWaalsContact CA-CE2 3.46Å; G595-F621 WeakPolarHBondContact O-CE2 3.42Å
596	F	81.8	Confident	79.9	Confident	62 Å²	62	18.4 Å²	18.4	27%	0.272	10%	0.097	S	C	.	.	H	α-helix	trans	-69.7	-41.5	171.5	-67.7	-51.8	0	0	0	112.5	F592 E594 F598 F599 L600 F621 V961 L1019 A1020	F592-F596 HydrophobicContact CB-CD2 4.35Å; F592-F596 HydrophobicContact CB-CE2 4.23Å; F592-F596 AromaticContact CD2-CE2 3.87Å; F592-F596 HydrophobicContact CD2-CE2 3.87Å; F592-F596 HydrophobicContact CD2-CZ 4.23Å; F592-F596 HydrophobicContact CG-CE2 4.44Å; F592-F596 WeakPolarHBondContact O-CB 3.46Å; F592-F596 WeakPolarHBondContact O-CD2 3.34Å; F592-F596 WeakPolarHBondContact O-CG 3.45Å; F592-F596 PolarHBondContact O-N 2.76Å; E594-F596 VanDerWaalsContact C-N 3.28Å; E594-F596 PolarHBondContact O-N 2.98Å; F596-F598 PolarHBondContact O-N 3.41Å; F596-F599 CarbonylContact O-C 3.54Å; F596-F599 VanDerWaalsContact O-CA 3.3Å; F596-F599 WeakPolarHBondContact O-CA 3.46Å; F596-F599 WeakPolarHBondContact O-CB 3.25Å; F596-F599 PolarHBondContact O-N 2.66Å; F596-L600 PolarHBondContact O-N 3.49Å; F596-F621 HydrophobicContact CD1-CZ 4.03Å; F596-F621 HydrophobicContact CE1-CZ 4.09Å; F596-F621 HydrophobicContact CG-CZ 4.36Å; F596-F621 HydrophobicContact CZ-CZ 4.48Å; F596-V961 HydrophobicContact CD2-CG2 4.09Å; F596-L1019 VanDerWaalsContact C-C 3.49Å; F596-L1019 CarbonylContact C-O 3.6Å; F596-L1019 HydrophobicContact CB-CB 3.53Å; F596-L1019 HydrophobicContact CD2-CB 4.11Å; F596-L1019 HydrophobicContact CD2-CD1 3.84Å; F596-L1019 HydrophobicContact CE2-CD1 4.08Å; F596-L1019 HydrophobicContact CG-CB 3.9Å; F596-L1019 HydrophobicContact CG-CD1 4.28Å; F596-L1019 CarbonylContact O-C 3.3Å; F596-A1020 VanDerWaalsContact C-N 3.3Å; F596-A1020 HydrophobicContact CB-CB 4.25Å
597	C	72.9	Confident	79.8	Confident	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-38.8	-50.3	177.3	-177.6	0	0	0	0	113.5	S593 E594 F599 G601 L1010 V1011 S1012 A1020 V1021	S593-C597 WeakPolarHBondContact O-CB 3.34Å; S593-C597 PolarHBondContact O-N 2.98Å; E594-C597 WeakPolarHBondContact O-CA 3.18Å; E594-C597 WeakPolarHBondContact O-CB 3.4Å; E594-C597 PolarHBondContact O-N 2.99Å; C597-F599 VanDerWaalsContact C-N 3.35Å; C597-G601 PolarHBondContact O-N 3.46Å; C597-L1010 PolarHBondContact SG-O 2.97Å; C597-V1011 WeakPolarHBondContact SG-CA 3.42Å; C597-S1012 PolarHBondContact O-N 2.99Å; C597-A1020 VanDerWaalsContact CA-C 3.46Å; C597-A1020 VanDerWaalsContact CA-N 3.27Å; C597-V1021 VanDerWaalsContact SG-CA 3.6Å
598	F	75.7	Confident	79.3	Confident	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-80.9	-16.4	-175.9	-57.3	-71.1	0	0	0	112.2	L545 E594 F596 G601 F612 S613 A616 A617 I620 S1012	L545-F598 HydrophobicContact CD1-CE1 3.99Å; L545-F598 HydrophobicContact CD1-CE2 4.36Å; L545-F598 HydrophobicContact CD1-CZ 3.74Å; L545-F598 HydrophobicContact CD2-CE2 4.07Å; L545-F598 HydrophobicContact CD2-CZ 4.2Å; L545-F598 HydrophobicContact CG-CZ 4.48Å; E594-F598 HydrophobicContact CB-CE2 4.38Å; E594-F598 WeakPolarHBondContact O-CD2 3.43Å; E594-F598 PolarHBondContact O-N 3.4Å; F596-F598 PolarHBondContact O-N 3.41Å; F598-G601 CarbonylContact O-C 3.54Å; F598-G601 VanDerWaalsContact O-CA 3.23Å; F598-G601 WeakPolarHBondContact O-CA 3.12Å; F598-G601 PolarHBondContact O-N 3.48Å; F598-F612 HydrophobicContact CD1-CE1 4.35Å; F598-F612 HydrophobicContact CE1-CE1 4.33Å; F598-S613 VanDerWaalsContact CB-O 3.26Å; F598-S613 WeakPolarHBondContact CB-O 3.13Å; F598-S613 CarbonylContact O-C 3.04Å; F598-S613 VanDerWaalsContact O-C 3.31Å; F598-S613 WeakPolarHBondContact O-CB 3.34Å; F598-A616 HydrophobicContact CB-CB 4.03Å; F598-A616 HydrophobicContact CD1-CB 4.05Å; F598-A616 HydrophobicContact CD2-CB 4.21Å; F598-A616 HydrophobicContact CG-CB 3.83Å; F598-A617 HydrophobicContact CB-CB 3.71Å; F598-I620 HydrophobicContact CD2-CD1 3.58Å; F598-I620 HydrophobicContact CE2-CD1 3.57Å; F598-S1012 WeakPolarHBondContact CD1-OG 3.21Å
599	F	79	Confident	78.7	Confident	71 Å²	71	18 Å²	18	31%	0.311	10%	0.096	S	C	.	.	H	α-helix	trans	-78.7	-36.1	166.5	-81	-44.8	0	0	0	114.5	F596 C597 G601 A602 L614 A617 F621	F596-F599 CarbonylContact O-C 3.54Å; F596-F599 VanDerWaalsContact O-CA 3.3Å; F596-F599 WeakPolarHBondContact O-CA 3.46Å; F596-F599 WeakPolarHBondContact O-CB 3.25Å; F596-F599 PolarHBondContact O-N 2.66Å; C597-F599 VanDerWaalsContact C-N 3.35Å; F599-G601 PolarHBondContact O-N 2.85Å; F599-G601 VanDerWaalsContact O-N 3.11Å; F599-A602 WeakPolarHBondContact O-CB 3.34Å; F599-A602 PolarHBondContact O-N 3.33Å; F599-L614 HydrophobicContact CD1-CD2 4.25Å; F599-L614 HydrophobicContact CE1-CD2 4.23Å; F599-A617 HydrophobicContact CB-CB 4.41Å; F599-A617 HydrophobicContact CD1-CB 3.66Å; F599-A617 HydrophobicContact CD2-CB 3.82Å; F599-A617 HydrophobicContact CE1-CB 3.76Å; F599-A617 HydrophobicContact CE2-CB 3.94Å; F599-A617 HydrophobicContact CG-CB 3.67Å; F599-A617 HydrophobicContact CZ-CB 3.89Å; F599-F621 HydrophobicContact CD2-CD2 4.34Å; F599-F621 AromaticContact CD2-CE2 3.67Å; F599-F621 HydrophobicContact CD2-CE2 3.67Å; F599-F621 AromaticContact CE2-CD2 3.68Å; F599-F621 HydrophobicContact CE2-CD2 3.68Å; F599-F621 AromaticContact CE2-CE2 3.44Å; F599-F621 HydrophobicContact CE2-CE2 3.44Å; F599-F621 VanDerWaalsContact CE2-CE2 3.44Å
600	L	70.6	Confident	78.5	Confident	1 Å²	1	21.9 Å²	21.9	1%	0.005	11%	0.113	C	C	.	.	H	α-helix	trans	-53.3	-28.6	160.3	-102.3	179.3	0	0	0	110.2	F596 A602 L603 L953 V1011 S1012 A1013 G1014 F1016 L1019	F596-L600 PolarHBondContact O-N 3.49Å; L600-A602 VanDerWaalsContact C-N 3.3Å; L600-A602 PolarHBondContact O-N 3.45Å; L600-L603 HydrophobicContact CD2-CD1 3.61Å; L600-L603 WeakPolarHBondContact O-CB 3.34Å; L600-L603 VanDerWaalsContact O-CD1 3.3Å; L600-L603 WeakPolarHBondContact O-CD1 3.4Å; L600-L603 VanDerWaalsContact O-CG 3.27Å; L600-L603 WeakPolarHBondContact O-CG 3.35Å; L600-L953 HydrophobicContact CD1-CB 3.76Å; L600-L953 HydrophobicContact CD2-CB 4.22Å; L600-L953 HydrophobicContact CD2-CD1 4.35Å; L600-V1011 HydrophobicContact CD1-CG1 4.33Å; L600-S1012 CarbonylContact C-O 3.54Å; L600-A1013 CarbonylContact O-C 3.53Å; L600-G1014 PolarHBondContact O-N 2.94Å; L600-F1016 WeakPolarHBondContact CD2-O 3.39Å; L600-L1019 WeakPolarHBondContact CB-O 3.28Å; L600-L1019 VanDerWaalsContact CD1-C 3.47Å; L600-L1019 WeakPolarHBondContact CD1-O 3.44Å; L600-L1019 WeakPolarHBondContact CG-O 3.49Å; L600-L1019 PolarHBondContact N-O 2.92Å
601	G	68.4	Low	78.6	Confident	0 Å²	0	23 Å²	23	0%	0	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-16.1	174.2	0	0	0	0	0	119.2	C597 F598 F599 L603 K610 S1012 A1013	C597-G601 PolarHBondContact O-N 3.46Å; F598-G601 CarbonylContact O-C 3.54Å; F598-G601 VanDerWaalsContact O-CA 3.23Å; F598-G601 WeakPolarHBondContact O-CA 3.12Å; F598-G601 PolarHBondContact O-N 3.48Å; F599-G601 PolarHBondContact O-N 2.85Å; F599-G601 VanDerWaalsContact O-N 3.11Å; G601-L603 PolarHBondContact O-N 3.45Å; G601-K610 WeakPolarHBondContact O-CA 3.22Å; G601-S1012 WeakPolarHBondContact CA-O 3.46Å; G601-S1012 PolarHBondContact N-O 2.73Å; G601-A1013 CarbonylContact C-O 3.52Å; G601-A1013 VanDerWaalsContact C-O 3.31Å; G601-A1013 WeakPolarHBondContact CA-O 3.43Å; G601-A1013 WeakPolarHBondContact O-CB 3.5Å
602	A	76.1	Confident	78.4	Confident	16 Å²	16	23 Å²	23	13%	0.132	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-2.6	178.9	0	0	0	0	0	112.8	F599 L600 K610 L614	F599-A602 WeakPolarHBondContact O-CB 3.34Å; F599-A602 PolarHBondContact O-N 3.33Å; L600-A602 VanDerWaalsContact C-N 3.3Å; L600-A602 PolarHBondContact O-N 3.45Å; A602-K610 WeakPolarHBondContact O-CD 3.28Å; A602-K610 WeakPolarHBondContact O-CE 3.5Å; A602-K610 WeakPolarHBondContact O-CG 3.19Å; A602-K610 PolarHBondContact O-NZ 2.69Å; A602-L614 HydrophobicContact CB-CD1 4.34Å; A602-L614 HydrophobicContact CB-CD2 3.54Å; A602-L614 HydrophobicContact CB-CG 3.74Å
603	L	73.9	Confident	78.1	Confident	65 Å²	65	20 Å²	20	34%	0.34	11%	0.105	S	C	.	.	S	Bend	trans	-98.2	-26.4	-161.3	-60.6	172.9	0	0	0	113.9	L600 G601 A1013 G1014 T1015 F1016	L600-L603 HydrophobicContact CD2-CD1 3.61Å; L600-L603 WeakPolarHBondContact O-CB 3.34Å; L600-L603 VanDerWaalsContact O-CD1 3.3Å; L600-L603 WeakPolarHBondContact O-CD1 3.4Å; L600-L603 VanDerWaalsContact O-CG 3.27Å; L600-L603 WeakPolarHBondContact O-CG 3.35Å; G601-L603 PolarHBondContact O-N 3.45Å; L603-A1013 CarbonylContact C-O 3.39Å; L603-A1013 WeakPolarHBondContact CA-O 3.3Å; L603-A1013 WeakPolarHBondContact CB-O 3.39Å; L603-A1013 PolarHBondContact N-O 3.2Å; L603-G1014 CarbonylContact C-O 3.55Å; L603-G1014 VanDerWaalsContact CB-C 3.44Å; L603-G1014 WeakPolarHBondContact CB-O 3.18Å; L603-T1015 VanDerWaalsContact CB-O 3.31Å; L603-T1015 WeakPolarHBondContact CB-O 3.38Å; L603-T1015 WeakPolarHBondContact CD1-O 3.42Å; L603-F1016 VanDerWaalsContact CD1-O 3.32Å; L603-F1016 WeakPolarHBondContact CD1-O 3.39Å
604	S	73.1	Confident	78.4	Confident	9 Å²	9	21.3 Å²	21.3	6%	0.063	11%	0.112	C	C	.	.	S	Bend	trans	-67.8	158.5	-172.3	79.1	0	0	0	0	112.6	M606 A1013 G1014	S604-M606 VanDerWaalsContact C-N 3.27Å; S604-M606 PolarHBondContact O-N 2.99Å; S604-M606 PolarHBondContact OG-N 3.16Å; S604-A1013 VanDerWaalsContact CB-CB 3.45Å; S604-A1013 WeakPolarHBondContact CB-O 3.35Å; S604-A1013 PolarHBondContact N-O 3.11Å; S604-A1013 VanDerWaalsContact OG-CB 3.24Å; S604-A1013 WeakPolarHBondContact OG-CB 3.1Å; S604-G1014 WeakPolarHBondContact CA-O 3.49Å; S604-G1014 PolarHBondContact N-O 2.99Å
605	S	75.9	Confident	78.9	Confident	59 Å²	59	21.4 Å²	21.4	41%	0.413	11%	0.113	S	C	.	.	S	Bend	trans	-58.6	-35	171.1	49.4	0	0	0	0	113.1	A232 P607	A232-S605 WeakPolarHBondContact CB-O 3.39Å; S605-P607 VanDerWaalsContact O-CD 3.28Å; S605-P607 WeakPolarHBondContact O-CD 3.34Å
606	M	75.3	Confident	79.1	Confident	6 Å²	6	21.4 Å²	21.4	3%	0.03	11%	0.113	C	C	.	.			trans	-75.2	113	-170.3	-67.1	167.7	-177.9	0	0	112	S604 A608 V609 K610 Q939 L943 A1000 L1003	S604-M606 VanDerWaalsContact C-N 3.27Å; S604-M606 PolarHBondContact O-N 2.99Å; S604-M606 PolarHBondContact OG-N 3.16Å; M606-A608 PolarHBondContact O-N 3.48Å; M606-V609 HydrophobicContact CB-CB 4.33Å; M606-V609 HydrophobicContact CB-CG2 3.83Å; M606-V609 PolarHBondContact O-N 3.44Å; M606-V609 HydrophobicContact SD-CG2 4.32Å; M606-K610 WeakPolarHBondContact O-CB 3.19Å; M606-K610 PolarHBondContact O-N 3.09Å; M606-Q939 HydrophobicContact CE-CB 3.92Å; M606-Q939 HydrophobicContact CE-CG 4.44Å; M606-L943 HydrophobicContact CE-CB 4.25Å; M606-L943 HydrophobicContact CE-CD1 3.52Å; M606-L943 HydrophobicContact CE-CG 4.47Å; M606-L943 HydrophobicContact SD-CD1 4.21Å; M606-A1000 HydrophobicContact SD-CB 4.07Å; M606-L1003 HydrophobicContact SD-CD2 4.4Å
607	P	83.1	Confident	79.4	Confident	16 Å²	16	18.5 Å²	18.5	10%	0.104	10%	0.1	C	C	.	.	H	α-helix	trans	-60.9	-43.9	-174.6	-24.6	35.5	0	0	0	113.4	Q228 S231 S605 V609 K610 I611	Q228-P607 WeakPolarHBondContact O-CB 3.31Å; Q228-P607 WeakPolarHBondContact O-CG 3.38Å; S231-P607 WeakPolarHBondContact O-CG 3.39Å; S605-P607 VanDerWaalsContact O-CD 3.28Å; S605-P607 WeakPolarHBondContact O-CD 3.34Å; P607-V609 VanDerWaalsContact C-N 3.33Å; P607-V609 PolarHBondContact O-N 2.88Å; P607-K610 PolarHBondContact O-N 3.21Å; P607-I611 WeakPolarHBondContact O-CB 3.27Å; P607-I611 WeakPolarHBondContact O-CG1 3.45Å; P607-I611 PolarHBondContact O-N 3.2Å
608	A	78.3	Confident	80.3	Confident	5 Å²	5	19.6 Å²	19.6	4%	0.041	11%	0.106	C	C	.	.	H	α-helix	trans	-51.3	-49.9	176.6	0	0	0	0	0	112.8	I229 W230 M606 F612	I229-A608 HydrophobicContact CG2-CB 3.75Å; I229-A608 WeakPolarHBondContact O-CB 3.35Å; I229-A608 PolarHBondContact O-N 3.35Å; W230-A608 HydrophobicContact CE3-CB 4.06Å; W230-A608 HydrophobicContact CH2-CB 4.3Å; W230-A608 HydrophobicContact CZ3-CB 3.74Å; M606-A608 PolarHBondContact O-N 3.48Å; A608-F612 VanDerWaalsContact O-CB 3.27Å; A608-F612 WeakPolarHBondContact O-CB 3.41Å; A608-F612 PolarHBondContact O-N 2.93Å; A608-F612 VanDerWaalsContact O-N 3.07Å
609	V	76.5	Confident	81.2	Confident	1 Å²	1	19.6 Å²	19.6	1%	0.006	11%	0.106	C	C	.	.	H	α-helix	trans	-71.2	-44.2	-178.4	-162.9	0	0	0	0	110.1	M606 P607 I611 F612 S613 A1000 V1004 A1013	M606-V609 HydrophobicContact CB-CB 4.33Å; M606-V609 HydrophobicContact CB-CG2 3.83Å; M606-V609 PolarHBondContact O-N 3.44Å; M606-V609 HydrophobicContact SD-CG2 4.32Å; P607-V609 VanDerWaalsContact C-N 3.33Å; P607-V609 PolarHBondContact O-N 2.88Å; V609-I611 PolarHBondContact O-N 3.09Å; V609-F612 PolarHBondContact O-N 3.43Å; V609-S613 WeakPolarHBondContact O-CB 3.18Å; V609-S613 PolarHBondContact O-N 3.3Å; V609-S613 PolarHBondContact O-OG 2.96Å; V609-A1000 HydrophobicContact CG2-CB 4.47Å; V609-V1004 HydrophobicContact CB-CG2 4.22Å; V609-V1004 HydrophobicContact CG1-CG2 3.82Å; V609-V1004 HydrophobicContact CG2-CG2 3.8Å; V609-A1013 HydrophobicContact CB-CB 4.07Å; V609-A1013 HydrophobicContact CG1-CB 3.43Å; V609-A1013 VanDerWaalsContact CG1-CB 3.43Å
610	K	83.5	Confident	81.8	Confident	85 Å²	85	16.2 Å²	16.2	37%	0.37	9%	0.091	S	C	.	.	H	α-helix	trans	-56.9	-47	178	174.4	169.3	-177.9	123.1	0	112.9	G601 A602 M606 P607 L614	G601-K610 WeakPolarHBondContact O-CA 3.22Å; A602-K610 WeakPolarHBondContact O-CD 3.28Å; A602-K610 WeakPolarHBondContact O-CE 3.5Å; A602-K610 WeakPolarHBondContact O-CG 3.19Å; A602-K610 PolarHBondContact O-NZ 2.69Å; M606-K610 WeakPolarHBondContact O-CB 3.19Å; M606-K610 PolarHBondContact O-N 3.09Å; P607-K610 PolarHBondContact O-N 3.21Å; K610-L614 HydrophobicContact CG-CD1 4.38Å; K610-L614 WeakPolarHBondContact O-CG 3.4Å; K610-L614 PolarHBondContact O-N 2.8Å; K610-L614 VanDerWaalsContact O-N 3.16Å
611	I	86.5	Confident	82.8	Confident	23 Å²	23	18.2 Å²	18.2	12%	0.118	10%	0.099	C	C	.	.	H	α-helix	trans	-65.7	-55.5	177.9	-67.8	167.6	0	0	0	109.6	T535 P607 V609 S613 L614 Y615	T535-I611 HydrophobicContact CG2-CD1 4.06Å; T535-I611 HydrophobicContact CG2-CG2 4.32Å; P607-I611 WeakPolarHBondContact O-CB 3.27Å; P607-I611 WeakPolarHBondContact O-CG1 3.45Å; P607-I611 PolarHBondContact O-N 3.2Å; V609-I611 PolarHBondContact O-N 3.09Å; I611-S613 PolarHBondContact O-N 3.34Å; I611-L614 PolarHBondContact O-N 2.95Å; I611-Y615 HydrophobicContact CG2-CD2 4.02Å; I611-Y615 HydrophobicContact CG2-CE2 3.78Å; I611-Y615 WeakPolarHBondContact O-CD2 3.19Å; I611-Y615 PolarHBondContact O-N 3.31Å
612	F	83.8	Confident	84	Confident	1 Å²	1	19.4 Å²	19.4	0%	0.004	11%	0.105	C	C	.	.	H	α-helix	trans	-46.6	-44.9	177.9	162.5	-105.8	0	0	0	112.5	S538 V541 V542 L545 F598 A608 V609 Y615 A616 V1004 V1007	S538-F612 WeakPolarHBondContact OG-CA 3.43Å; V541-F612 HydrophobicContact CB-CE2 4.04Å; V541-F612 HydrophobicContact CG1-CE2 3.62Å; V541-F612 HydrophobicContact CG1-CZ 4.11Å; V542-F612 HydrophobicContact CG2-CD2 3.78Å; V542-F612 HydrophobicContact CG2-CE2 3.82Å; L545-F612 HydrophobicContact CD1-CE2 4.28Å; L545-F612 HydrophobicContact CD1-CZ 3.68Å; F598-F612 HydrophobicContact CD1-CE1 4.35Å; F598-F612 HydrophobicContact CE1-CE1 4.33Å; A608-F612 VanDerWaalsContact O-CB 3.27Å; A608-F612 WeakPolarHBondContact O-CB 3.41Å; A608-F612 PolarHBondContact O-N 2.93Å; A608-F612 VanDerWaalsContact O-N 3.07Å; V609-F612 PolarHBondContact O-N 3.43Å; F612-Y615 PolarHBondContact O-N 2.99Å; F612-A616 HydrophobicContact CE2-CB 4.48Å; F612-A616 HydrophobicContact CZ-CB 4.44Å; F612-A616 WeakPolarHBondContact O-CB 3.38Å; F612-A616 PolarHBondContact O-N 3.27Å; F612-V1004 HydrophobicContact CD1-CG1 4.07Å; F612-V1004 HydrophobicContact CD1-CG2 4.43Å; F612-V1004 HydrophobicContact CE1-CG1 3.89Å; F612-V1004 HydrophobicContact CZ-CG1 4.24Å; F612-V1007 HydrophobicContact CE1-CG1 4.36Å
613	S	81.4	Confident	84.8	Confident	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-76	-39.1	-173	-45.8	0	0	0	0	112.9	F598 V609 I611 Y615 A616 A617 S1012	F598-S613 VanDerWaalsContact CB-O 3.26Å; F598-S613 WeakPolarHBondContact CB-O 3.13Å; F598-S613 CarbonylContact O-C 3.04Å; F598-S613 VanDerWaalsContact O-C 3.31Å; F598-S613 WeakPolarHBondContact O-CB 3.34Å; V609-S613 WeakPolarHBondContact O-CB 3.18Å; V609-S613 PolarHBondContact O-N 3.3Å; V609-S613 PolarHBondContact O-OG 2.96Å; I611-S613 PolarHBondContact O-N 3.34Å; S613-Y615 VanDerWaalsContact C-N 3.28Å; S613-Y615 PolarHBondContact O-N 2.73Å; S613-A616 PolarHBondContact O-N 3.27Å; S613-A617 VanDerWaalsContact O-CB 3.29Å; S613-A617 WeakPolarHBondContact O-CB 3.11Å; S613-A617 PolarHBondContact O-N 3.43Å; S613-S1012 VanDerWaalsContact CB-CB 3.47Å; S613-S1012 WeakPolarHBondContact CB-OG 3.49Å; S613-S1012 WeakPolarHBondContact OG-CB 3.35Å; S613-S1012 PolarHBondContact OG-OG 2.63Å
614	L	88.4	Confident	85.8	Confident	27 Å²	27	16.6 Å²	16.6	14%	0.141	9%	0.087	C	C	.	.	H	α-helix	trans	-55.5	-45.7	171	-80.5	167.4	0	0	0	111.4	Y527 F599 A602 K610 I611 L618	Y527-L614 HydrophobicContact CE1-CB 4.27Å; Y527-L614 HydrophobicContact CE1-CD2 4.4Å; Y527-L614 VanDerWaalsContact CE2-C 3.46Å; Y527-L614 HydrophobicContact CE2-CB 4.24Å; Y527-L614 WeakPolarHBondContact CE2-O 3.24Å; Y527-L614 VanDerWaalsContact CZ-O 3.31Å; Y527-L614 PolarHBondContact OH-O 2.98Å; F599-L614 HydrophobicContact CD1-CD2 4.25Å; F599-L614 HydrophobicContact CE1-CD2 4.23Å; A602-L614 HydrophobicContact CB-CD1 4.34Å; A602-L614 HydrophobicContact CB-CD2 3.54Å; A602-L614 HydrophobicContact CB-CG 3.74Å; K610-L614 HydrophobicContact CG-CD1 4.38Å; K610-L614 WeakPolarHBondContact O-CG 3.4Å; K610-L614 PolarHBondContact O-N 2.8Å; K610-L614 VanDerWaalsContact O-N 3.16Å; I611-L614 PolarHBondContact O-N 2.95Å; L614-L618 PolarHBondContact O-N 3.15Å
615	Y	90.7	Very high	86.8	Confident	3 Å²	3	20.3 Å²	20.3	1%	0.012	10%	0.102	C	C	.	.	H	α-helix	trans	-70.8	-40.6	-178.7	-75.8	-116.3	0	0	0	112	S523 L524 Y527 I532 I611 F612 S613 A619	S523-Y615 PolarHBondContact OG-O 3.29Å; L524-Y615 HydrophobicContact CD2-CD1 3.75Å; L524-Y615 HydrophobicContact CD2-CE1 3.85Å; L524-Y615 HydrophobicContact CG-CD1 4.29Å; Y527-Y615 WeakPolarHBondContact CB-OH 3.32Å; Y527-Y615 AromaticContact CD2-CD1 3.94Å; Y527-Y615 HydrophobicContact CD2-CD1 3.94Å; Y527-Y615 AromaticContact CD2-CD2 3.67Å; Y527-Y615 HydrophobicContact CD2-CD2 3.67Å; Y527-Y615 HydrophobicContact CD2-CE1 4.09Å; Y527-Y615 AromaticContact CD2-CE2 3.85Å; Y527-Y615 HydrophobicContact CD2-CE2 3.85Å; Y527-Y615 AromaticContact CD2-CG 3.77Å; Y527-Y615 HydrophobicContact CD2-CG 3.77Å; Y527-Y615 HydrophobicContact CE2-CD2 4.14Å; Y527-Y615 HydrophobicContact CE2-CG 4.25Å; Y527-Y615 HydrophobicContact CG-CD2 4.14Å; Y527-Y615 HydrophobicContact CG-CE1 4.35Å; Y527-Y615 AromaticContact CG-CE2 3.84Å; Y527-Y615 HydrophobicContact CG-CE2 3.84Å; Y527-Y615 AromaticContact CG-CZ 3.98Å; I532-Y615 HydrophobicContact CG2-CE2 4.01Å; I532-Y615 PolarHBondContact O-OH 2.7Å; I611-Y615 HydrophobicContact CG2-CD2 4.02Å; I611-Y615 HydrophobicContact CG2-CE2 3.78Å; I611-Y615 WeakPolarHBondContact O-CD2 3.19Å; I611-Y615 PolarHBondContact O-N 3.31Å; F612-Y615 PolarHBondContact O-N 2.99Å; S613-Y615 VanDerWaalsContact C-N 3.28Å; S613-Y615 PolarHBondContact O-N 2.73Å; Y615-A619 VanDerWaalsContact O-CB 3.23Å; Y615-A619 WeakPolarHBondContact O-CB 3.44Å; Y615-A619 PolarHBondContact O-N 3.27Å
616	A	86.8	Confident	87.7	Confident	0 Å²	0	17.6 Å²	17.6	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-64.3	-45.5	175.4	0	0	0	0	0	112.7	V542 L545 F598 F612 S613 A619 I620	V542-A616 HydrophobicContact CG2-CB 4.32Å; L545-A616 HydrophobicContact CD1-CB 4.45Å; F598-A616 HydrophobicContact CB-CB 4.03Å; F598-A616 HydrophobicContact CD1-CB 4.05Å; F598-A616 HydrophobicContact CD2-CB 4.21Å; F598-A616 HydrophobicContact CG-CB 3.83Å; F612-A616 HydrophobicContact CE2-CB 4.48Å; F612-A616 HydrophobicContact CZ-CB 4.44Å; F612-A616 WeakPolarHBondContact O-CB 3.38Å; F612-A616 PolarHBondContact O-N 3.27Å; S613-A616 PolarHBondContact O-N 3.27Å; A616-A619 PolarHBondContact O-N 3.41Å; A616-I620 WeakPolarHBondContact O-CG1 3.15Å; A616-I620 PolarHBondContact O-N 2.96Å
617	A	88.1	Confident	88.6	Confident	0 Å²	0	17.4 Å²	17.4	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-55.4	-56.2	178.6	0	0	0	0	0	111.5	G595 F598 F599 S613 A619 I620 F621	G595-A617 WeakPolarHBondContact O-CB 3.46Å; F598-A617 HydrophobicContact CB-CB 3.71Å; F599-A617 HydrophobicContact CB-CB 4.41Å; F599-A617 HydrophobicContact CD1-CB 3.66Å; F599-A617 HydrophobicContact CD2-CB 3.82Å; F599-A617 HydrophobicContact CE1-CB 3.76Å; F599-A617 HydrophobicContact CE2-CB 3.94Å; F599-A617 HydrophobicContact CG-CB 3.67Å; F599-A617 HydrophobicContact CZ-CB 3.89Å; S613-A617 VanDerWaalsContact O-CB 3.29Å; S613-A617 WeakPolarHBondContact O-CB 3.11Å; S613-A617 PolarHBondContact O-N 3.43Å; A617-A619 VanDerWaalsContact C-N 3.31Å; A617-A619 PolarHBondContact O-N 2.87Å; A617-I620 PolarHBondContact O-N 2.74Å; A617-F621 WeakPolarHBondContact O-CD2 3.29Å; A617-F621 PolarHBondContact O-N 2.88Å; A617-F621 VanDerWaalsContact O-N 3.13Å
618	L	92.2	Very high	89.1	Confident	24 Å²	24	17.4 Å²	17.4	13%	0.126	8%	0.081	C	C	.	.	H	α-helix	trans	-66.9	-33.2	-177.2	-178.2	62.7	0	0	0	112.1	F526 Y527 L614 F621 F622	F526-L618 HydrophobicContact CB-CD2 3.84Å; F526-L618 HydrophobicContact CD1-CD2 3.28Å; F526-L618 HydrophobicContact CE1-CD2 3.99Å; F526-L618 HydrophobicContact CG-CD2 3.73Å; Y527-L618 HydrophobicContact CD2-CD2 3.95Å; Y527-L618 HydrophobicContact CE2-CB 3.72Å; Y527-L618 HydrophobicContact CE2-CD2 3.42Å; Y527-L618 VanDerWaalsContact CE2-CD2 3.42Å; Y527-L618 HydrophobicContact CE2-CG 4.21Å; L614-L618 PolarHBondContact O-N 3.15Å; L618-F621 PolarHBondContact O-N 3.04Å; L618-F622 HydrophobicContact CD1-CD2 4.02Å; L618-F622 HydrophobicContact CD1-CE2 3.72Å; L618-F622 HydrophobicContact CD1-CZ 4.35Å; L618-F622 HydrophobicContact CD2-CE2 3.93Å; L618-F622 HydrophobicContact CG-CD2 3.8Å; L618-F622 HydrophobicContact CG-CE2 3.61Å; L618-F622 VanDerWaalsContact O-CD2 3.31Å; L618-F622 WeakPolarHBondContact O-CD2 3.31Å; L618-F622 PolarHBondContact O-N 3.3Å
619	A	93.3	Very high	89.8	Confident	0 Å²	0	17.7 Å²	17.7	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-64.9	-41.9	175.3	0	0	0	0	0	111.7	S523 V542 V546 Y615 A616 A617 F622 D623	S523-A619 PolarHBondContact OG-N 3.15Å; V542-A619 HydrophobicContact CG1-CB 4.09Å; V546-A619 HydrophobicContact CG2-CB 3.65Å; Y615-A619 VanDerWaalsContact O-CB 3.23Å; Y615-A619 WeakPolarHBondContact O-CB 3.44Å; Y615-A619 PolarHBondContact O-N 3.27Å; A616-A619 PolarHBondContact O-N 3.41Å; A617-A619 VanDerWaalsContact C-N 3.31Å; A617-A619 PolarHBondContact O-N 2.87Å; A619-F622 PolarHBondContact O-N 3.31Å; A619-D623 VanDerWaalsContact O-CB 3.26Å; A619-D623 WeakPolarHBondContact O-CB 3.27Å; A619-D623 PolarHBondContact O-N 3.18Å
620	I	91.2	Very high	90.6	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-64.6	-39.9	175.4	-67.2	164.2	0	0	0	111.6	L545 V546 V549 S591 E594 F598 A616 A617 D623 F624	L545-I620 HydrophobicContact CD2-CD1 3.85Å; L545-I620 HydrophobicContact CD2-CG1 4.41Å; V546-I620 HydrophobicContact CG2-CG1 4.28Å; V549-I620 HydrophobicContact CG2-CD1 4.41Å; V549-I620 HydrophobicContact CG2-CG1 4.31Å; S591-I620 WeakPolarHBondContact O-CG2 3.35Å; E594-I620 HydrophobicContact CB-CD1 3.94Å; E594-I620 HydrophobicContact CB-CG2 4.43Å; F598-I620 HydrophobicContact CD2-CD1 3.58Å; F598-I620 HydrophobicContact CE2-CD1 3.57Å; A616-I620 WeakPolarHBondContact O-CG1 3.15Å; A616-I620 PolarHBondContact O-N 2.96Å; A617-I620 PolarHBondContact O-N 2.74Å; I620-D623 PolarHBondContact O-N 3.43Å; I620-F624 PolarHBondContact O-N 2.88Å
621	F	91.8	Very high	91.2	Very high	42 Å²	42	13.7 Å²	13.7	18%	0.184	7%	0.065	C	C	.	.	H	α-helix	trans	-65.3	-38.9	174.8	-76.5	-66.3	0	0	0	112.6	F592 G595 F596 F599 A617 L618 F625	F592-F621 HydrophobicContact CD1-CD1 4.35Å; F592-F621 AromaticContact CD1-CE1 3.78Å; F592-F621 HydrophobicContact CD1-CE1 3.78Å; F592-F621 HydrophobicContact CD2-CE1 4.38Å; F592-F621 HydrophobicContact CE1-CD1 4.06Å; F592-F621 AromaticContact CE1-CE1 3.77Å; F592-F621 HydrophobicContact CE1-CE1 3.77Å; F592-F621 HydrophobicContact CE2-CE1 4.39Å; F592-F621 HydrophobicContact CG-CE1 4.08Å; F592-F621 HydrophobicContact CZ-CE1 4.08Å; G595-F621 VanDerWaalsContact CA-CE2 3.46Å; G595-F621 WeakPolarHBondContact O-CE2 3.42Å; F596-F621 HydrophobicContact CD1-CZ 4.03Å; F596-F621 HydrophobicContact CE1-CZ 4.09Å; F596-F621 HydrophobicContact CG-CZ 4.36Å; F596-F621 HydrophobicContact CZ-CZ 4.48Å; F599-F621 HydrophobicContact CD2-CD2 4.34Å; F599-F621 AromaticContact CD2-CE2 3.67Å; F599-F621 HydrophobicContact CD2-CE2 3.67Å; F599-F621 AromaticContact CE2-CD2 3.68Å; F599-F621 HydrophobicContact CE2-CD2 3.68Å; F599-F621 AromaticContact CE2-CE2 3.44Å; F599-F621 HydrophobicContact CE2-CE2 3.44Å; F599-F621 VanDerWaalsContact CE2-CE2 3.44Å; A617-F621 WeakPolarHBondContact O-CD2 3.29Å; A617-F621 PolarHBondContact O-N 2.88Å; A617-F621 VanDerWaalsContact O-N 3.13Å; L618-F621 PolarHBondContact O-N 3.04Å; F621-F625 VanDerWaalsContact O-CB 3.27Å; F621-F625 WeakPolarHBondContact O-CB 3.25Å; F621-F625 PolarHBondContact O-N 3.3Å; F621-F625 VanDerWaalsContact O-N 3.09Å
622	F	94	Very high	91.5	Very high	26 Å²	26	12.8 Å²	12.8	11%	0.114	6%	0.061	C	C	.	.	H	α-helix	trans	-66.9	-37.3	171.2	-81.8	-55.5	0	0	0	112.5	C213 F526 L618 A619 F625 L626	C213-F622 HydrophobicContact CB-CZ 4.37Å; F526-F622 HydrophobicContact CB-CE2 4.46Å; L618-F622 HydrophobicContact CD1-CD2 4.02Å; L618-F622 HydrophobicContact CD1-CE2 3.72Å; L618-F622 HydrophobicContact CD1-CZ 4.35Å; L618-F622 HydrophobicContact CD2-CE2 3.93Å; L618-F622 HydrophobicContact CG-CD2 3.8Å; L618-F622 HydrophobicContact CG-CE2 3.61Å; L618-F622 VanDerWaalsContact O-CD2 3.31Å; L618-F622 WeakPolarHBondContact O-CD2 3.31Å; L618-F622 PolarHBondContact O-N 3.3Å; A619-F622 PolarHBondContact O-N 3.31Å; F622-F625 PolarHBondContact O-N 2.94Å; F622-L626 WeakPolarHBondContact O-CB 3.33Å; F622-L626 VanDerWaalsContact O-CG 3.24Å; F622-L626 WeakPolarHBondContact O-CG 3.34Å; F622-L626 PolarHBondContact O-N 3.41Å
623	D	94	Very high	92	Very high	0 Å²	0	12.7 Å²	12.7	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-65.3	-50.9	-179.5	-172.7	42.3	0	0	0	111	V546 G550 A619 I620 F625 L626 Q627	V546-D623 HydrophobicContact CG1-CB 3.67Å; G550-D623 WeakPolarHBondContact CA-OD2 3.44Å; G550-D623 PolarHBondContact N-OD2 3.35Å; A619-D623 VanDerWaalsContact O-CB 3.26Å; A619-D623 WeakPolarHBondContact O-CB 3.27Å; A619-D623 PolarHBondContact O-N 3.18Å; I620-D623 PolarHBondContact O-N 3.43Å; D623-F625 VanDerWaalsContact C-N 3.34Å; D623-F625 PolarHBondContact O-N 2.94Å; D623-L626 PolarHBondContact O-N 2.88Å; D623-Q627 WeakPolarHBondContact O-CB 3.46Å; D623-Q627 VanDerWaalsContact O-CG 3.22Å; D623-Q627 WeakPolarHBondContact O-CG 3.19Å; D623-Q627 PolarHBondContact O-N 3.17Å; D623-Q627 PolarHBondContact O-NE2 2.92Å; D623-Q627 PolarHBondContact OD1-NE2 2.91Å; D623-Q627 PolarHBondContact OD2-NE2 3.41Å
624	F	93.4	Very high	92.5	Very high	22 Å²	22	13.8 Å²	13.8	10%	0.096	7%	0.065	C	C	.	.	H	α-helix	trans	-56.6	-45.6	171.7	174.4	-97.1	0	0	0	112.1	V584 M587 L588 F592 I620 Q627 V628	V584-F624 HydrophobicContact CG1-CE2 4.21Å; V584-F624 HydrophobicContact CG1-CZ 4.22Å; M587-F624 HydrophobicContact CB-CD2 4.34Å; M587-F624 HydrophobicContact CB-CE2 4.1Å; L588-F624 HydrophobicContact CB-CE2 4.01Å; L588-F624 HydrophobicContact CB-CZ 3.97Å; L588-F624 HydrophobicContact CD1-CE1 3.75Å; L588-F624 HydrophobicContact CD1-CE2 4.2Å; L588-F624 HydrophobicContact CD1-CZ 3.46Å; L588-F624 VanDerWaalsContact CD1-CZ 3.46Å; L588-F624 HydrophobicContact CG-CZ 4.35Å; F592-F624 HydrophobicContact CE1-CD1 4.18Å; F592-F624 HydrophobicContact CE1-CE1 4.16Å; I620-F624 PolarHBondContact O-N 2.88Å; F624-Q627 PolarHBondContact O-N 3.03Å; F624-V628 HydrophobicContact CD2-CG2 4.23Å; F624-V628 HydrophobicContact CE1-CG2 4.3Å; F624-V628 HydrophobicContact CE2-CG2 3.79Å; F624-V628 HydrophobicContact CZ-CG2 3.82Å; F624-V628 WeakPolarHBondContact O-CG2 3.44Å; F624-V628 PolarHBondContact O-N 3.49Å
625	F	94	Very high	92.8	Very high	87 Å²	87	12.7 Å²	12.7	38%	0.382	6%	0.06	S	C	.	.	H	α-helix	trans	-61.7	-46.1	178.3	174.7	-100.1	0	0	0	112.3	V209 F621 F622 D623 Q627 V628 T629	V209-F625 HydrophobicContact CG1-CE1 4.42Å; F621-F625 VanDerWaalsContact O-CB 3.27Å; F621-F625 WeakPolarHBondContact O-CB 3.25Å; F621-F625 PolarHBondContact O-N 3.3Å; F621-F625 VanDerWaalsContact O-N 3.09Å; F622-F625 PolarHBondContact O-N 2.94Å; D623-F625 VanDerWaalsContact C-N 3.34Å; D623-F625 PolarHBondContact O-N 2.94Å; F625-Q627 VanDerWaalsContact C-N 3.33Å; F625-V628 PolarHBondContact O-N 2.88Å; F625-T629 HydrophobicContact CD2-CG2 4.43Å; F625-T629 HydrophobicContact CE2-CG2 4.05Å; F625-T629 HydrophobicContact CZ-CG2 4.12Å; F625-T629 WeakPolarHBondContact O-CB 3.36Å; F625-T629 WeakPolarHBondContact O-CG2 3.23Å; F625-T629 PolarHBondContact O-N 3.41Å; F625-T629 VanDerWaalsContact O-N 3.07Å; F625-T629 PolarHBondContact O-OG1 3.08Å
626	L	95	Very high	92.8	Very high	1 Å²	1	12.5 Å²	12.5	1%	0.005	6%	0.059	C	C	.	.	H	α-helix	trans	-72.7	-24.5	179.6	-67.7	172.5	0	0	0	112.5	V515 L518 F622 D623 T629 C630 F631	V515-L626 HydrophobicContact CG1-CB 3.68Å; L518-L626 HydrophobicContact CG-CD1 4.3Å; F622-L626 WeakPolarHBondContact O-CB 3.33Å; F622-L626 VanDerWaalsContact O-CG 3.24Å; F622-L626 WeakPolarHBondContact O-CG 3.34Å; F622-L626 PolarHBondContact O-N 3.41Å; D623-L626 PolarHBondContact O-N 2.88Å; L626-T629 WeakPolarHBondContact CA-OG1 3.26Å; L626-C630 WeakPolarHBondContact O-CA 3.42Å; L626-C630 WeakPolarHBondContact O-CB 3.25Å; L626-C630 PolarHBondContact O-N 3.24Å; L626-F631 PolarHBondContact O-N 3.11Å
627	Q	94.3	Very high	93	Very high	3 Å²	3	16.1 Å²	16.1	1%	0.014	8%	0.078	C	C	.	.	I	π-helix	trans	-70.4	-50.2	170.7	-75.4	159.6	28.1	0	0	112	N553 M587 D623 F624 F625 T629 F631 L632	N553-Q627 PolarHBondContact ND2-OE1 3.26Å; M587-Q627 HydrophobicContact CE-CB 4.25Å; D623-Q627 WeakPolarHBondContact O-CB 3.46Å; D623-Q627 VanDerWaalsContact O-CG 3.22Å; D623-Q627 WeakPolarHBondContact O-CG 3.19Å; D623-Q627 PolarHBondContact O-N 3.17Å; D623-Q627 PolarHBondContact O-NE2 2.92Å; D623-Q627 PolarHBondContact OD1-NE2 2.91Å; D623-Q627 PolarHBondContact OD2-NE2 3.41Å; F624-Q627 PolarHBondContact O-N 3.03Å; F625-Q627 VanDerWaalsContact C-N 3.33Å; Q627-T629 PolarHBondContact O-N 3.35Å; Q627-F631 HydrophobicContact CB-CB 4.48Å; Q627-F631 WeakPolarHBondContact O-CB 3.5Å; Q627-L632 PolarHBondContact O-N 3.28Å
628	V	93	Very high	93.1	Very high	15 Å²	15	16.8 Å²	16.8	9%	0.091	8%	0.081	C	C	.	.	I	π-helix	trans	-71.6	-12.1	-178.9	176.9	0	0	0	0	112.3	W191 V584 F624 F625	W191-V628 PolarHBondContact NE1-O 3.12Å; V584-V628 HydrophobicContact CG1-CG1 4.46Å; V584-V628 HydrophobicContact CG1-CG2 3.72Å; F624-V628 HydrophobicContact CD2-CG2 4.23Å; F624-V628 HydrophobicContact CE1-CG2 4.3Å; F624-V628 HydrophobicContact CE2-CG2 3.79Å; F624-V628 HydrophobicContact CZ-CG2 3.82Å; F624-V628 WeakPolarHBondContact O-CG2 3.44Å; F624-V628 PolarHBondContact O-N 3.49Å; F625-V628 PolarHBondContact O-N 2.88Å
629	T	93.7	Very high	92.9	Very high	11 Å²	11	15.9 Å²	15.9	7%	0.067	8%	0.076	C	C	.	.	I	π-helix	trans	-109.4	-81.5	172.8	56.5	0	0	0	0	112.7	W191 I202 F625 L626 Q627 A633	W191-T629 HydrophobicContact CZ2-CG2 4.13Å; I202-T629 HydrophobicContact CG2-CG2 4.31Å; F625-T629 HydrophobicContact CD2-CG2 4.43Å; F625-T629 HydrophobicContact CE2-CG2 4.05Å; F625-T629 HydrophobicContact CZ-CG2 4.12Å; F625-T629 WeakPolarHBondContact O-CB 3.36Å; F625-T629 WeakPolarHBondContact O-CG2 3.23Å; F625-T629 PolarHBondContact O-N 3.41Å; F625-T629 VanDerWaalsContact O-N 3.07Å; F625-T629 PolarHBondContact O-OG1 3.08Å; L626-T629 WeakPolarHBondContact CA-OG1 3.26Å; Q627-T629 PolarHBondContact O-N 3.35Å; T629-A633 WeakPolarHBondContact O-CB 3.44Å; T629-A633 PolarHBondContact O-N 3.04Å
630	C	94.6	Very high	92.6	Very high	2 Å²	2	21.2 Å²	21.2	1%	0.014	10%	0.096	C	C	.	.	I	π-helix	trans	-65.7	-45.7	-171.9	-64.8	0	0	0	0	113.1	F203 V515 L626 A633 M634	F203-C630 HydrophobicContact CD2-CB 4.01Å; F203-C630 HydrophobicContact CE2-CB 4.42Å; V515-C630 HydrophobicContact CG2-CB 4.33Å; L626-C630 WeakPolarHBondContact O-CA 3.42Å; L626-C630 WeakPolarHBondContact O-CB 3.25Å; L626-C630 PolarHBondContact O-N 3.24Å; C630-A633 PolarHBondContact O-N 3.4Å; C630-M634 WeakPolarHBondContact O-CG 3.39Å; C630-M634 PolarHBondContact O-N 3.07Å
631	F	94.6	Very high	92.5	Very high	1 Å²	1	22.7 Å²	22.7	0%	0.004	10%	0.102	C	C	.	.	I	π-helix	trans	-67.6	-45.5	-179.7	-171.1	-100.7	0	0	0	111.9	L508 I554 L557 I558 L626 Q627 A633 M634 F635	L508-F631 HydrophobicContact CD1-CE2 3.78Å; L508-F631 HydrophobicContact CD1-CZ 3.91Å; L508-F631 HydrophobicContact CD2-CZ 4.41Å; L508-F631 HydrophobicContact CG-CE2 4.12Å; L508-F631 HydrophobicContact CG-CZ 3.99Å; I554-F631 HydrophobicContact CB-CE1 4.29Å; I554-F631 HydrophobicContact CB-CZ 4.25Å; I554-F631 HydrophobicContact CD1-CD2 4.1Å; I554-F631 HydrophobicContact CD1-CE2 4.01Å; I554-F631 HydrophobicContact CD1-CG 4.42Å; I554-F631 HydrophobicContact CD1-CZ 4.26Å; I554-F631 HydrophobicContact CG1-CD1 3.99Å; I554-F631 HydrophobicContact CG1-CD2 4.3Å; I554-F631 HydrophobicContact CG1-CE1 3.8Å; I554-F631 HydrophobicContact CG1-CE2 4.13Å; I554-F631 HydrophobicContact CG1-CG 4.24Å; I554-F631 HydrophobicContact CG1-CZ 3.88Å; I554-F631 HydrophobicContact CG2-CE1 3.97Å; I554-F631 HydrophobicContact CG2-CE2 4.19Å; I554-F631 HydrophobicContact CG2-CZ 3.54Å; L557-F631 HydrophobicContact CD2-CD1 4.32Å; L557-F631 HydrophobicContact CD2-CE1 4.38Å; I558-F631 HydrophobicContact CD1-CE1 4.41Å; I558-F631 HydrophobicContact CD1-CZ 3.97Å; L626-F631 PolarHBondContact O-N 3.11Å; Q627-F631 HydrophobicContact CB-CB 4.48Å; Q627-F631 WeakPolarHBondContact O-CB 3.5Å; F631-A633 VanDerWaalsContact C-N 3.26Å; F631-A633 PolarHBondContact O-N 3.01Å; F631-M634 HydrophobicContact CD2-CE 4.2Å; F631-M634 PolarHBondContact O-N 3.22Å; F631-M634 VanDerWaalsContact O-N 3.15Å; F631-F635 HydrophobicContact CE1-CB 4.5Å; F631-F635 WeakPolarHBondContact O-CB 3.49Å; F631-F635 PolarHBondContact O-N 3.34Å
632	L	93.3	Very high	92.1	Very high	3 Å²	3	21.5 Å²	21.5	2%	0.016	10%	0.097	C	C	.	.	H	α-helix	trans	-60	-36	176.1	-176	61.2	0	0	0	112.5	C195 V576 T580 Q627 F635 T636	C195-L632 HydrophobicContact CB-CD2 3.76Å; C195-L632 HydrophobicContact CB-CG 4.12Å; C195-L632 VanDerWaalsContact SG-CG 3.57Å; V576-L632 HydrophobicContact CG1-CD1 3.93Å; T580-L632 HydrophobicContact CG2-CD1 3.56Å; T580-L632 HydrophobicContact CG2-CD2 3.82Å; T580-L632 HydrophobicContact CG2-CG 4.36Å; Q627-L632 PolarHBondContact O-N 3.28Å; L632-F635 HydrophobicContact CD1-CD1 4.37Å; L632-T636 WeakPolarHBondContact O-CB 3.21Å; L632-T636 PolarHBondContact O-N 3.43Å; L632-T636 PolarHBondContact O-OG1 2.66Å
633	A	93.9	Very high	91.5	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-66.3	-45.6	172.8	0	0	0	0	0	112.6	P199 F203 T629 C630 F631 T636 I637	P199-A633 HydrophobicContact CB-CB 3.83Å; P199-A633 VanDerWaalsContact O-CB 3.31Å; P199-A633 WeakPolarHBondContact O-CB 3.47Å; F203-A633 HydrophobicContact CB-CB 4.06Å; T629-A633 WeakPolarHBondContact O-CB 3.44Å; T629-A633 PolarHBondContact O-N 3.04Å; C630-A633 PolarHBondContact O-N 3.4Å; F631-A633 VanDerWaalsContact C-N 3.26Å; F631-A633 PolarHBondContact O-N 3.01Å; A633-T636 WeakPolarHBondContact O-CB 3.24Å; A633-T636 PolarHBondContact O-N 3.02Å; A633-I637 WeakPolarHBondContact O-CG1 3.3Å; A633-I637 PolarHBondContact O-N 3Å; A633-I637 VanDerWaalsContact O-N 3.11Å
634	M	93	Very high	90.9	Very high	22 Å²	22	26.8 Å²	26.8	11%	0.108	13%	0.129	C	C	.	.	H	α-helix	trans	-65	-41	175.8	-69.8	-172.8	-60.5	0	0	112	F203 L511 V515 C630 F631 T636 I637 D638	F203-M634 HydrophobicContact CD2-CG 3.91Å; F203-M634 HydrophobicContact CD2-SD 4.24Å; F203-M634 HydrophobicContact CE2-CG 3.99Å; F203-M634 HydrophobicContact CE2-SD 3.72Å; L511-M634 HydrophobicContact CB-CE 3.96Å; L511-M634 HydrophobicContact CB-SD 3.89Å; L511-M634 HydrophobicContact CD1-SD 3.99Å; L511-M634 HydrophobicContact CD2-SD 4.14Å; L511-M634 HydrophobicContact CG-SD 4.23Å; V515-M634 HydrophobicContact CG2-CE 3.56Å; C630-M634 WeakPolarHBondContact O-CG 3.39Å; C630-M634 PolarHBondContact O-N 3.07Å; F631-M634 HydrophobicContact CD2-CE 4.2Å; F631-M634 PolarHBondContact O-N 3.22Å; F631-M634 VanDerWaalsContact O-N 3.15Å; M634-T636 PolarHBondContact O-N 2.94Å; M634-I637 PolarHBondContact O-N 2.69Å; M634-I637 VanDerWaalsContact O-N 3.12Å; M634-D638 PolarHBondContact O-N 2.78Å
635	F	92.9	Very high	90.1	Very high	4 Å²	4	25.8 Å²	25.8	2%	0.018	12%	0.124	C	C	.	.	H	α-helix	trans	-60.9	-43	174.6	179.6	-132.3	0	0	0	111.8	L508 I558 F561 F631 L632 I637 D638 L639	L508-F635 HydrophobicContact CD1-CB 4.41Å; L508-F635 HydrophobicContact CD2-CD2 3.74Å; L508-F635 HydrophobicContact CD2-CE2 4.38Å; I558-F635 HydrophobicContact CG1-CD2 4.46Å; I558-F635 HydrophobicContact CG1-CE2 4.11Å; F561-F635 HydrophobicContact CB-CE1 4.35Å; F561-F635 HydrophobicContact CB-CZ 3.85Å; F561-F635 AromaticContact CD1-CZ 3.95Å; F561-F635 HydrophobicContact CD1-CZ 3.95Å; F561-F635 HydrophobicContact CD2-CE1 4.27Å; F561-F635 HydrophobicContact CD2-CZ 4.13Å; F561-F635 HydrophobicContact CG-CE1 4.24Å; F561-F635 AromaticContact CG-CZ 3.69Å; F561-F635 HydrophobicContact CG-CZ 3.69Å; F631-F635 HydrophobicContact CE1-CB 4.5Å; F631-F635 WeakPolarHBondContact O-CB 3.49Å; F631-F635 PolarHBondContact O-N 3.34Å; L632-F635 HydrophobicContact CD1-CD1 4.37Å; F635-I637 VanDerWaalsContact C-N 3.3Å; F635-I637 PolarHBondContact O-N 3.25Å; F635-D638 PolarHBondContact O-N 2.96Å; F635-L639 HydrophobicContact CD1-CD1 4.21Å; F635-L639 HydrophobicContact CD2-CD1 4.28Å; F635-L639 HydrophobicContact CD2-CG 4.15Å; F635-L639 HydrophobicContact CE1-CD1 3.87Å; F635-L639 HydrophobicContact CE2-CD1 3.96Å; F635-L639 HydrophobicContact CE2-CD2 3.97Å; F635-L639 HydrophobicContact CE2-CG 3.91Å; F635-L639 HydrophobicContact CG-CD1 4.42Å; F635-L639 HydrophobicContact CZ-CD1 3.74Å; F635-L639 HydrophobicContact CZ-CD2 4.26Å; F635-L639 HydrophobicContact CZ-CG 4.2Å; F635-L639 WeakPolarHBondContact O-CG 3.38Å; F635-L639 PolarHBondContact O-N 3.26Å
636	T	91.5	Very high	89.7	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-57.2	-43.2	172.1	-61.9	0	0	0	0	111.6	T196 P199 L632 A633 M634 R640	T196-T636 HydrophobicContact CG2-CG2 4.24Å; P199-T636 HydrophobicContact CB-CG2 4.36Å; P199-T636 HydrophobicContact CG-CG2 4.21Å; L632-T636 WeakPolarHBondContact O-CB 3.21Å; L632-T636 PolarHBondContact O-N 3.43Å; L632-T636 PolarHBondContact O-OG1 2.66Å; A633-T636 WeakPolarHBondContact O-CB 3.24Å; A633-T636 PolarHBondContact O-N 3.02Å; M634-T636 PolarHBondContact O-N 2.94Å; T636-R640 VanDerWaalsContact O-CG 3.3Å; T636-R640 WeakPolarHBondContact O-CG 3.32Å; T636-R640 PolarHBondContact O-N 3.01Å; T636-R640 VanDerWaalsContact O-N 3.09Å
637	I	91	Very high	89	Confident	76 Å²	76	28.3 Å²	28.3	39%	0.39	13%	0.132	S	C	.	.	H	α-helix	trans	-67.8	-39.3	179	-67.5	164.9	0	0	0	111	P199 V200 A633 M634 F635 R640 R641	P199-I637 HydrophobicContact CB-CD1 4.19Å; P199-I637 HydrophobicContact CB-CG1 4.15Å; P199-I637 HydrophobicContact CG-CD1 4.44Å; P199-I637 HydrophobicContact CG-CG1 4.12Å; V200-I637 HydrophobicContact CG2-CD1 4.47Å; A633-I637 WeakPolarHBondContact O-CG1 3.3Å; A633-I637 PolarHBondContact O-N 3Å; A633-I637 VanDerWaalsContact O-N 3.11Å; M634-I637 PolarHBondContact O-N 2.69Å; M634-I637 VanDerWaalsContact O-N 3.12Å; F635-I637 VanDerWaalsContact C-N 3.3Å; F635-I637 PolarHBondContact O-N 3.25Å; I637-R640 WeakPolarHBondContact O-CB 3.16Å; I637-R640 PolarHBondContact O-N 3.07Å; I637-R641 PolarHBondContact O-N 2.9Å
638	D	90	Very high	88.1	Confident	14 Å²	14	28.6 Å²	28.6	8%	0.075	13%	0.134	C	C	.	.	H	α-helix	trans	-67.3	-38.4	176	-173.8	66.7	0	0	0	112.9	K505 L508 M634 F635 R640 R641 E642	K505-D638 VanDerWaalsContact CD-OD2 3.22Å; K505-D638 WeakPolarHBondContact CD-OD2 3.41Å; K505-D638 WeakPolarHBondContact CE-OD2 3.34Å; K505-D638 IonicContact NZ-OD2 2.66Å; K505-D638 PolarHBondContact NZ-OD2 3.04Å; L508-D638 HydrophobicContact CD1-CB 4.46Å; M634-D638 PolarHBondContact O-N 2.78Å; F635-D638 PolarHBondContact O-N 2.96Å; D638-R640 VanDerWaalsContact C-N 3.32Å; D638-R640 PolarHBondContact O-N 2.81Å; D638-R641 WeakPolarHBondContact O-CA 3.38Å; D638-R641 WeakPolarHBondContact O-CB 3.31Å; D638-R641 PolarHBondContact O-N 3.15Å; D638-R641 VanDerWaalsContact O-N 3.13Å; D638-R641 IonicContact OD1-CZ 2.72Å; D638-R641 IonicContact OD1-NE 2.75Å; D638-R641 PolarHBondContact OD1-NE 3.48Å; D638-R641 IonicContact OD1-NH2 3Å; D638-R641 PolarHBondContact OD1-NH2 2.85Å; D638-R641 IonicContact OD2-NH2 2.65Å; D638-E642 PolarHBondContact O-N 3.46Å
639	L	88.1	Confident	87.1	Confident	4 Å²	4	34.3 Å²	34.3	2%	0.021	17%	0.168	C	C	.	.	H	α-helix	trans	-63.9	-37.4	172.1	-68.2	174	0	0	0	111.8	F561 L572 V576 F635 E642 M643	F561-L639 HydrophobicContact CD1-CD2 4.09Å; F561-L639 HydrophobicContact CD2-CD1 4.37Å; F561-L639 HydrophobicContact CE1-CD1 4.03Å; F561-L639 HydrophobicContact CE1-CD2 3.39Å; F561-L639 HydrophobicContact CE1-CG 4.38Å; F561-L639 HydrophobicContact CE2-CD1 3.78Å; F561-L639 HydrophobicContact CZ-CD1 3.6Å; F561-L639 HydrophobicContact CZ-CD2 3.73Å; F561-L639 HydrophobicContact CZ-CG 4.3Å; L572-L639 HydrophobicContact CD1-CB 3.94Å; L572-L639 HydrophobicContact CD1-CD1 4.03Å; L572-L639 HydrophobicContact CD2-CB 4.45Å; V576-L639 HydrophobicContact CG2-CD1 3.68Å; F635-L639 HydrophobicContact CD1-CD1 4.21Å; F635-L639 HydrophobicContact CD2-CD1 4.28Å; F635-L639 HydrophobicContact CD2-CG 4.15Å; F635-L639 HydrophobicContact CE1-CD1 3.87Å; F635-L639 HydrophobicContact CE2-CD1 3.96Å; F635-L639 HydrophobicContact CE2-CD2 3.97Å; F635-L639 HydrophobicContact CE2-CG 3.91Å; F635-L639 HydrophobicContact CG-CD1 4.42Å; F635-L639 HydrophobicContact CZ-CD1 3.74Å; F635-L639 HydrophobicContact CZ-CD2 4.26Å; F635-L639 HydrophobicContact CZ-CG 4.2Å; F635-L639 WeakPolarHBondContact O-CG 3.38Å; F635-L639 PolarHBondContact O-N 3.26Å; L639-E642 PolarHBondContact O-N 3.36Å; L639-M643 WeakPolarHBondContact O-CG 3.19Å; L639-M643 PolarHBondContact O-N 3.44Å
640	R	88.2	Confident	86	Confident	113 Å²	113	37 Å²	37	43%	0.426	19%	0.187	S	C	.	.	H	α-helix	trans	-64.8	-36.5	171.2	-68.2	170	-180	-154.3	3.6	111.9	T196 L572 T636 I637 D638 S644	T196-R640 PolarHBondContact O-NH2 3.21Å; L572-R640 HydrophobicContact CD2-CG 3.8Å; T636-R640 VanDerWaalsContact O-CG 3.3Å; T636-R640 WeakPolarHBondContact O-CG 3.32Å; T636-R640 PolarHBondContact O-N 3.01Å; T636-R640 VanDerWaalsContact O-N 3.09Å; I637-R640 WeakPolarHBondContact O-CB 3.16Å; I637-R640 PolarHBondContact O-N 3.07Å; D638-R640 VanDerWaalsContact C-N 3.32Å; D638-R640 PolarHBondContact O-N 2.81Å; R640-S644 WeakPolarHBondContact O-CB 3.46Å; R640-S644 PolarHBondContact O-N 3.32Å; R640-S644 PolarHBondContact O-OG 2.91Å
641	R	88	Confident	84.8	Confident	30 Å²	30	40.8 Å²	40.8	11%	0.113	21%	0.212	C	C	.	.	H	α-helix	trans	-62	-53.5	171.7	176	-163.7	62.6	87	-8.4	110.8	V502 S504 I637 D638 M643 S644 G645 R646 E648	V502-R641 PolarHBondContact O-NH1 2.88Å; V502-R641 PolarHBondContact O-NH2 3.07Å; S504-R641 PolarHBondContact O-NH2 3.36Å; S504-R641 VanDerWaalsContact O-NH2 3.09Å; I637-R641 PolarHBondContact O-N 2.9Å; D638-R641 WeakPolarHBondContact O-CA 3.38Å; D638-R641 WeakPolarHBondContact O-CB 3.31Å; D638-R641 PolarHBondContact O-N 3.15Å; D638-R641 VanDerWaalsContact O-N 3.13Å; D638-R641 IonicContact OD1-CZ 2.72Å; D638-R641 IonicContact OD1-NE 2.75Å; D638-R641 PolarHBondContact OD1-NE 3.48Å; D638-R641 IonicContact OD1-NH2 3Å; D638-R641 PolarHBondContact OD1-NH2 2.85Å; D638-R641 IonicContact OD2-NH2 2.65Å; R641-M643 PolarHBondContact O-N 3.18Å; R641-S644 CarbonylContact O-C 3.41Å; R641-S644 WeakPolarHBondContact O-CA 3.28Å; R641-S644 WeakPolarHBondContact O-CB 3.37Å; R641-S644 PolarHBondContact O-N 3.09Å; R641-S644 PolarHBondContact O-OG 3.45Å; R641-G645 PolarHBondContact O-N 2.92Å; R641-R646 HydrophobicContact CG-CB 3.93Å; R641-R646 PolarHBondContact NH1-O 3.49Å; R641-R646 PolarHBondContact O-N 2.93Å; R641-E648 VanDerWaalsContact CZ-CG 3.4Å
642	E	82.9	Confident	83.8	Confident	18 Å²	18	46.9 Å²	46.9	8%	0.084	25%	0.254	C	S	.	.	H	α-helix	trans	-58	-49.1	-176.5	-171	-161	118.5	0	0	111.6	K505 R565 D638 L639 S644 G645	K505-E642 WeakPolarHBondContact CE-OE2 3.47Å; K505-E642 IonicContact NZ-OE2 3.53Å; K505-E642 PolarHBondContact NZ-OE2 3.37Å; R565-E642 IonicContact CZ-OE1 2.81Å; R565-E642 VanDerWaalsContact CZ-OE1 3.24Å; R565-E642 IonicContact NH1-OE1 2.79Å; R565-E642 PolarHBondContact NH1-OE1 3.29Å; R565-E642 IonicContact NH2-OE1 3.42Å; R565-E642 PolarHBondContact NH2-OE1 3.46Å; D638-E642 PolarHBondContact O-N 3.46Å; L639-E642 PolarHBondContact O-N 3.36Å; E642-S644 PolarHBondContact O-N 2.92Å; E642-G645 PolarHBondContact O-N 2.93Å
643	M	81.2	Confident	82.9	Confident	89 Å²	89	50 Å²	50	44%	0.438	27%	0.273	S	S	.	.	H	α-helix	trans	-64.8	-23.5	176.6	-67.9	-170.9	-57.1	0	0	113.5	L572 L639 R641 G645	L572-M643 HydrophobicContact CB-CE 4.08Å; L572-M643 HydrophobicContact CD1-CE 3.86Å; L572-M643 HydrophobicContact CD1-SD 4.35Å; L572-M643 HydrophobicContact CD2-CE 3.72Å; L572-M643 HydrophobicContact CG-CE 4.08Å; L639-M643 WeakPolarHBondContact O-CG 3.19Å; L639-M643 PolarHBondContact O-N 3.44Å; R641-M643 PolarHBondContact O-N 3.18Å; M643-G645 VanDerWaalsContact C-N 3.25Å
644	S	82.7	Confident	81.9	Confident	48 Å²	48	54.5 Å²	54.5	34%	0.336	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	2.1	171.9	77.2	0	0	0	0	114	R640 R641 E642 R646	R640-S644 WeakPolarHBondContact O-CB 3.46Å; R640-S644 PolarHBondContact O-N 3.32Å; R640-S644 PolarHBondContact O-OG 2.91Å; R641-S644 CarbonylContact O-C 3.41Å; R641-S644 WeakPolarHBondContact O-CA 3.28Å; R641-S644 WeakPolarHBondContact O-CB 3.37Å; R641-S644 PolarHBondContact O-N 3.09Å; R641-S644 PolarHBondContact O-OG 3.45Å; E642-S644 PolarHBondContact O-N 2.92Å; S644-R646 VanDerWaalsContact C-N 3.28Å; S644-R646 PolarHBondContact O-N 3.26Å; S644-R646 WeakPolarHBondContact OG-CD 3.43Å; S644-R646 WeakPolarHBondContact OG-CG 3.49Å
645	G	77.2	Confident	81	Confident	1 Å²	1	55.7 Å²	55.7	1%	0.01	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	72.5	13.2	176.5	0	0	0	0	0	115.2	R641 E642 M643 T654 V655	R641-G645 PolarHBondContact O-N 2.92Å; E642-G645 PolarHBondContact O-N 2.93Å; M643-G645 VanDerWaalsContact C-N 3.25Å; G645-T654 CarbonylContact O-C 3.49Å; G645-T654 WeakPolarHBondContact O-CA 3.08Å; G645-V655 VanDerWaalsContact CA-O 3.23Å; G645-V655 WeakPolarHBondContact CA-O 3.49Å; G645-V655 PolarHBondContact O-N 2.94Å
646	R	83.7	Confident	79.7	Confident	122 Å²	122	59.7 Å²	59.7	46%	0.46	34%	0.343	S	S	.	.	B	Isolated β-bridge	trans	-87.9	138.6	-171.7	-67.8	177.1	-169.6	-178.6	2	113	R641 S644 T654	R641-R646 HydrophobicContact CG-CB 3.93Å; R641-R646 PolarHBondContact NH1-O 3.49Å; R641-R646 PolarHBondContact O-N 2.93Å; S644-R646 VanDerWaalsContact C-N 3.28Å; S644-R646 PolarHBondContact O-N 3.26Å; S644-R646 WeakPolarHBondContact OG-CD 3.43Å; S644-R646 WeakPolarHBondContact OG-CG 3.49Å; R646-T654 HydrophobicContact CG-CG2 3.88Å
647	L	80.3	Confident	78.2	Confident	18 Å²	18	64 Å²	64	9%	0.094	37%	0.37	C	S	.	.			trans	-63.6	149.1	173	-52	-177	0	0	0	111.6	V498 F501 V502 C650 V653 V655	V498-L647 HydrophobicContact CG1-CD1 4.03Å; V498-L647 HydrophobicContact CG1-CD2 3.91Å; F501-L647 HydrophobicContact CB-CD2 3.97Å; F501-L647 WeakPolarHBondContact O-CA 3.32Å; V502-L647 HydrophobicContact CG2-CD2 3.62Å; L647-C650 HydrophobicContact CB-CB 4.33Å; L647-C650 HydrophobicContact CD1-CB 4.15Å; L647-V653 HydrophobicContact CD1-CB 3.75Å; L647-V653 HydrophobicContact CD1-CG1 3.92Å; L647-V653 HydrophobicContact CD1-CG2 4.38Å; L647-V653 HydrophobicContact CG-CB 4.11Å; L647-V653 HydrophobicContact CG-CG1 4.31Å; L647-V653 PolarHBondContact N-O 3.06Å; L647-V655 HydrophobicContact CD2-CG2 4.38Å
648	E	75.7	Confident	76.7	Confident	10 Å²	10	63.7 Å²	63.7	5%	0.047	37%	0.37	C	S	.	.	S	Bend	trans	-58.3	-54.7	177.7	-77.5	-169.3	109.3	0	0	113	F501 S504 K505 I506 L507 R641	F501-E648 PolarHBondContact O-N 2.93Å; F501-E648 VanDerWaalsContact O-N 3.13Å; S504-E648 VanDerWaalsContact C-CD 3.49Å; S504-E648 VanDerWaalsContact C-OE2 3.22Å; S504-E648 WeakPolarHBondContact CB-OE2 3.4Å; S504-E648 PolarHBondContact OG-OE2 3.42Å; K505-E648 VanDerWaalsContact C-OE1 3.22Å; K505-E648 WeakPolarHBondContact CA-OE1 3.48Å; K505-E648 PolarHBondContact N-OE2 2.83Å; I506-E648 WeakPolarHBondContact CB-OE2 3.1Å; I506-E648 PolarHBondContact N-OE1 3.14Å; I506-E648 PolarHBondContact N-OE2 3.39Å; L507-E648 WeakPolarHBondContact CB-OE1 3.37Å; L507-E648 PolarHBondContact N-OE1 3.09Å; R641-E648 VanDerWaalsContact CZ-CG 3.4Å
649	V	72.7	Confident	75.2	Confident	134 Å²	134	70 Å²	70	81%	0.812	40%	0.403	S	S	*	.	S	Bend	trans	-86.7	-29.3	-172.6	-176.1	0	0	0	0	112.3
650	C	71.3	Confident	73.7	Confident	69 Å²	69	72.5 Å²	72.5	47%	0.466	42%	0.419	S	S	.	.			trans	-119.2	72.1	-170.4	-70.1	0	0	0	0	111.5	L647 C652 V653	L647-C650 HydrophobicContact CB-CB 4.33Å; L647-C650 HydrophobicContact CD1-CB 4.15Å; C650-C652 PolarHBondContact O-N 2.83Å; C650-V653 PolarHBondContact O-N 2.99Å; C650-V653 VanDerWaalsContact O-N 3.08Å
651	C	67.9	Low	72.3	Confident	80 Å²	80	71.1 Å²	71.1	54%	0.541	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.9	-15.6	-176.5	-69.3	0	0	0	0	116.6
652	C	75	Confident	70.8	Confident	130 Å²	130	71.3 Å²	71.3	88%	0.878	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	-13.8	-179.9	-56.6	0	0	0	0	114.3	C650	C650-C652 PolarHBondContact O-N 2.83Å
653	V	73.4	Confident	69.9	Low	67 Å²	67	74 Å²	74	41%	0.406	44%	0.441	S	S	.	.			trans	-104.8	128.4	-178.4	-178.6	0	0	0	0	110	L647 C650	L647-V653 HydrophobicContact CD1-CB 3.75Å; L647-V653 HydrophobicContact CD1-CG1 3.92Å; L647-V653 HydrophobicContact CD1-CG2 4.38Å; L647-V653 HydrophobicContact CG-CB 4.11Å; L647-V653 HydrophobicContact CG-CG1 4.31Å; L647-V653 PolarHBondContact N-O 3.06Å; C650-V653 PolarHBondContact O-N 2.99Å; C650-V653 VanDerWaalsContact O-N 3.08Å
654	T	74.3	Confident	69.3	Low	95 Å²	95	71.7 Å²	71.7	58%	0.583	44%	0.44	S	S	*	.	B	Isolated β-bridge	trans	-115.6	131.2	175.9	51.8	0	0	0	0	111.1	G645 R646	G645-T654 CarbonylContact O-C 3.49Å; G645-T654 WeakPolarHBondContact O-CA 3.08Å; R646-T654 HydrophobicContact CG-CG2 3.88Å
655	V	72.2	Confident	69.1	Low	47 Å²	47	77.3 Å²	77.3	29%	0.285	46%	0.459	S	S	.	.			trans	-110.7	143.7	169.8	-175.8	0	0	0	0	107.9	V498 V502 G645 L647	V498-V655 HydrophobicContact CG1-CG2 4.36Å; V502-V655 HydrophobicContact CG2-CB 3.87Å; V502-V655 HydrophobicContact CG2-CG2 3.91Å; G645-V655 VanDerWaalsContact CA-O 3.23Å; G645-V655 WeakPolarHBondContact CA-O 3.49Å; G645-V655 PolarHBondContact O-N 2.94Å; L647-V655 HydrophobicContact CD2-CG2 4.38Å
656	A	66.3	Low	69.2	Low	89 Å²	89	79.6 Å²	79.6	74%	0.736	47%	0.47	S	S	*	.			trans	-63	132	178.6	0	0	0	0	0	110.7	D658	A656-D658 PolarHBondContact O-N 2.95Å
657	P	60.1	Low	69	Low	89 Å²	89	75.8 Å²	75.8	58%	0.578	46%	0.458	S	S	*	.			trans	-70.6	127.4	177.1	28.6	-33.5	0	0	0	110.3
658	D	60.4	Low	69.1	Low	71 Å²	71	76.5 Å²	76.5	38%	0.38	46%	0.464	S	S	.	.			trans	-104	145.8	172.1	-172.6	21.3	0	0	0	111.1	R503 A656 T660	R503-D658 PolarHBondContact NH2-O 2.97Å; A656-D658 PolarHBondContact O-N 2.95Å; D658-T660 WeakPolarHBondContact OD2-CB 3.18Å; D658-T660 VanDerWaalsContact OD2-CG2 3.24Å; D658-T660 WeakPolarHBondContact OD2-CG2 3.35Å; D658-T660 PolarHBondContact OD2-OG1 3.08Å
659	N	58.2	Low	69.7	Low	145 Å²	145	79.5 Å²	79.5	78%	0.775	48%	0.48	S	S	*	.			trans	-94.4	12.3	-174.3	-66.8	-38.8	0	0	0	113.1
660	T	57.1	Low	70.4	Confident	58 Å²	58	73.4 Å²	73.4	36%	0.356	44%	0.442	S	S	.	.	P	Polyproline II helix	trans	-76.8	118.2	174.7	48.7	0	0	0	0	110.8	Y493 R503 D658	Y493-T660 WeakPolarHBondContact CD1-OG1 3.47Å; Y493-T660 WeakPolarHBondContact CE1-OG1 3.14Å; Y493-T660 PolarHBondContact OH-O 2.83Å; R503-T660 VanDerWaalsContact CZ-O 3.3Å; R503-T660 PolarHBondContact NH1-O 3.1Å; R503-T660 PolarHBondContact NH2-O 2.88Å; D658-T660 WeakPolarHBondContact OD2-CB 3.18Å; D658-T660 VanDerWaalsContact OD2-CG2 3.24Å; D658-T660 WeakPolarHBondContact OD2-CG2 3.35Å; D658-T660 PolarHBondContact OD2-OG1 3.08Å
661	E	57.5	Low	71.2	Confident	83 Å²	83	74.2 Å²	74.2	39%	0.388	44%	0.436	S	S	.	.	P	Polyproline II helix	trans	-101.1	132.9	176	-69.1	168	157.6	0	0	109.8	K567	K567-E661 WeakPolarHBondContact CE-OE2 3.11Å; K567-E661 IonicContact NZ-OE2 2.72Å; K567-E661 PolarHBondContact NZ-OE2 3.15Å
662	S	56.9	Low	72.2	Confident	34 Å²	34	74.2 Å²	74.2	24%	0.238	43%	0.431	C	S	.	.	P	Polyproline II helix	trans	-87	156.4	162.9	66	0	0	0	0	110.1	D491	D491-S662 VanDerWaalsContact CG-OG 3.23Å; D491-S662 WeakPolarHBondContact OD1-CB 3.31Å; D491-S662 PolarHBondContact OD1-OG 3.4Å; D491-S662 VanDerWaalsContact OD2-CB 3.28Å; D491-S662 WeakPolarHBondContact OD2-CB 3.28Å; D491-S662 PolarHBondContact OD2-OG 3.48Å
663	V	63.7	Low	72.9	Confident	75 Å²	75	76.6 Å²	76.6	46%	0.455	42%	0.422	S	S	.	.	P	Polyproline II helix	trans	-99.4	119.4	162.6	-176.7	0	0	0	0	106.6	F665 Q667 C668	V663-F665 PolarHBondContact O-N 2.95Å; V663-Q667 HydrophobicContact CG1-CB 4.23Å; V663-Q667 HydrophobicContact CG1-CG 4.26Å; V663-C668 VanDerWaalsContact CG1-SG 3.53Å
664	G	69.9	Low	73.9	Confident	40 Å²	40	76.8 Å²	76.8	41%	0.412	42%	0.416	S	S	.	.	P	Polyproline II helix	trans	-55.3	135.7	-174.4	0	0	0	0	0	112.5	L666 Q667 C668	G664-L666 VanDerWaalsContact C-N 3.25Å; G664-L666 PolarHBondContact O-N 2.94Å; G664-Q667 WeakPolarHBondContact O-CB 3.46Å; G664-Q667 PolarHBondContact O-N 3.5Å; G664-C668 PolarHBondContact O-N 3.45Å
665	F	77.8	Confident	74.6	Confident	167 Å²	167	72.3 Å²	72.3	73%	0.732	39%	0.388	S	S	*	.	H	α-helix	trans	-45.7	-45	-173.1	173.9	-98.7	0	0	0	114.1	V663 Q667 C668 L669	V663-F665 PolarHBondContact O-N 2.95Å; F665-Q667 VanDerWaalsContact C-N 3.31Å; F665-Q667 PolarHBondContact O-N 3.27Å; F665-C668 PolarHBondContact O-N 3.38Å; F665-L669 HydrophobicContact CE1-CD1 4.11Å; F665-L669 HydrophobicContact CZ-CD1 4.25Å; F665-L669 PolarHBondContact O-N 2.57Å
666	L	78.6	Confident	75.5	Confident	48 Å²	48	73.3 Å²	73.3	25%	0.251	40%	0.396	S	S	.	.	H	α-helix	trans	-63.3	-34.3	-179.5	-167.4	63.8	0	0	0	113.1	G664 I670 A1056 L1059	G664-L666 VanDerWaalsContact C-N 3.25Å; G664-L666 PolarHBondContact O-N 2.94Å; L666-I670 HydrophobicContact CG-CD1 4.19Å; L666-I670 WeakPolarHBondContact O-CB 3.35Å; L666-I670 WeakPolarHBondContact O-CG1 3.33Å; L666-I670 PolarHBondContact O-N 2.89Å; L666-A1056 WeakPolarHBondContact CD2-O 3.16Å; L666-L1059 HydrophobicContact CD1-CD2 3.92Å; L666-L1059 HydrophobicContact CD2-CB 4.47Å; L666-L1059 HydrophobicContact CD2-CD2 4.31Å; L666-L1059 HydrophobicContact CD2-CG 4.43Å; L666-L1059 HydrophobicContact CG-CD2 4.42Å
667	Q	79.5	Confident	76.8	Confident	43 Å²	43	75.3 Å²	75.3	20%	0.201	39%	0.388	C	S	.	.	H	α-helix	trans	-73.5	-39	178.2	-172.8	177.2	-8.7	0	0	111.5	V663 G664 F665 I670 R671 A1056	V663-Q667 HydrophobicContact CG1-CB 4.23Å; V663-Q667 HydrophobicContact CG1-CG 4.26Å; G664-Q667 WeakPolarHBondContact O-CB 3.46Å; G664-Q667 PolarHBondContact O-N 3.5Å; F665-Q667 VanDerWaalsContact C-N 3.31Å; F665-Q667 PolarHBondContact O-N 3.27Å; Q667-I670 PolarHBondContact O-N 2.82Å; Q667-R671 VanDerWaalsContact O-CB 3.28Å; Q667-R671 WeakPolarHBondContact O-CB 3.42Å; Q667-R671 PolarHBondContact O-N 2.89Å; Q667-A1056 HydrophobicContact CB-CB 4.23Å
668	C	83.8	Confident	78.4	Confident	33 Å²	33	71.3 Å²	71.3	22%	0.223	36%	0.362	C	S	.	.	H	α-helix	trans	-62.6	-44.4	170.8	-66.4	0	0	0	0	111.3	V663 G664 F665 I670 R671 D672	V663-C668 VanDerWaalsContact CG1-SG 3.53Å; G664-C668 PolarHBondContact O-N 3.45Å; F665-C668 PolarHBondContact O-N 3.38Å; C668-I670 VanDerWaalsContact C-N 3.32Å; C668-I670 PolarHBondContact O-N 3.05Å; C668-R671 PolarHBondContact O-N 3.07Å; C668-D672 VanDerWaalsContact O-CB 3.22Å; C668-D672 WeakPolarHBondContact O-CB 3.45Å; C668-D672 VanDerWaalsContact O-CG 3.28Å; C668-D672 PolarHBondContact O-N 3.12Å
669	L	88	Confident	79.9	Confident	72 Å²	72	68.7 Å²	68.7	38%	0.377	35%	0.348	S	S	.	.	H	α-helix	trans	-58.6	-43.1	175.6	-172.1	154.2	0	0	0	112	F665 Y673 Y674	F665-L669 HydrophobicContact CE1-CD1 4.11Å; F665-L669 HydrophobicContact CZ-CD1 4.25Å; F665-L669 PolarHBondContact O-N 2.57Å; L669-Y673 PolarHBondContact O-N 3.4Å; L669-Y674 PolarHBondContact O-N 3.49Å; L669-Y674 VanDerWaalsContact O-N 3.12Å
670	I	87.6	Confident	81.5	Confident	6 Å²	6	69.4 Å²	69.4	3%	0.031	34%	0.34	C	S	.	.	I	π-helix	trans	-71.1	-41.2	-179.5	-74.9	168.5	0	0	0	112.6	L666 Q667 C668 T675 A1056 L1059	L666-I670 HydrophobicContact CG-CD1 4.19Å; L666-I670 WeakPolarHBondContact O-CB 3.35Å; L666-I670 WeakPolarHBondContact O-CG1 3.33Å; L666-I670 PolarHBondContact O-N 2.89Å; Q667-I670 PolarHBondContact O-N 2.82Å; C668-I670 VanDerWaalsContact C-N 3.32Å; C668-I670 PolarHBondContact O-N 3.05Å; I670-T675 VanDerWaalsContact O-CB 3.3Å; I670-T675 WeakPolarHBondContact O-CB 3.48Å; I670-T675 PolarHBondContact O-N 2.99Å; I670-T675 PolarHBondContact O-OG1 2.74Å; I670-A1056 VanDerWaalsContact CD1-CA 3.49Å; I670-A1056 HydrophobicContact CD1-CB 3.85Å; I670-L1059 HydrophobicContact CD1-CD2 4.05Å
671	R	87.6	Confident	82.8	Confident	87 Å²	87	73 Å²	73	33%	0.328	35%	0.351	S	S	.	.	I	π-helix	trans	-71.6	-48.9	178.5	-176.4	-170.8	67.9	-139.5	-15.2	112.6	Q667 C668 P676 E1052	Q667-R671 VanDerWaalsContact O-CB 3.28Å; Q667-R671 WeakPolarHBondContact O-CB 3.42Å; Q667-R671 PolarHBondContact O-N 2.89Å; C668-R671 PolarHBondContact O-N 3.07Å; R671-P676 WeakPolarHBondContact O-CD 3.28Å; R671-P676 WeakPolarHBondContact O-CG 3.5Å; R671-E1052 HydrophobicContact CB-CG 4.22Å; R671-E1052 HydrophobicContact CG-CG 4.2Å
672	D	88.2	Confident	84.3	Confident	80 Å²	80	71.6 Å²	71.6	43%	0.428	35%	0.349	S	S	.	.	I	π-helix	trans	-87.9	-22.7	-165.8	-55.6	-34	0	0	0	112.9	C668	C668-D672 VanDerWaalsContact O-CB 3.22Å; C668-D672 WeakPolarHBondContact O-CB 3.45Å; C668-D672 VanDerWaalsContact O-CG 3.28Å; C668-D672 PolarHBondContact O-N 3.12Å
673	Y	90.7	Very high	86	Confident	179 Å²	179	71 Å²	71	70%	0.702	34%	0.343	S	S	*	.	I	π-helix	trans	-124.8	-54.2	-177.2	-63.1	-90.4	0	0	0	113.9	L669 F677	L669-Y673 PolarHBondContact O-N 3.4Å; Y673-F677 WeakPolarHBondContact O-CB 3.47Å; Y673-F677 PolarHBondContact O-N 3.45Å
674	Y	92.8	Very high	87.3	Confident	72 Å²	72	68.6 Å²	68.6	28%	0.282	33%	0.326	S	S	.	.	I	π-helix	trans	-68.9	-51.8	-170.5	-175.2	-104.8	0	0	0	113.1	L669 F677 L678 L1051 L1101 V1102	L669-Y674 PolarHBondContact O-N 3.49Å; L669-Y674 VanDerWaalsContact O-N 3.12Å; Y674-F677 PolarHBondContact O-N 3.21Å; Y674-L678 HydrophobicContact CE1-CD2 3.95Å; Y674-L678 WeakPolarHBondContact O-CB 3.04Å; Y674-L678 PolarHBondContact O-N 3.38Å; Y674-L1051 HydrophobicContact CD1-CD2 4.09Å; Y674-L1051 HydrophobicContact CE1-CD1 4.38Å; Y674-L1051 HydrophobicContact CE1-CD2 4.01Å; Y674-L1101 PolarHBondContact OH-O 3.14Å; Y674-V1102 WeakPolarHBondContact OH-CG2 2.98Å
675	T	90.7	Very high	88.1	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-65.8	-44.2	-174.7	-55.4	0	0	0	0	112.7	I670 F677 L678 L679 Q1048 L1051 E1052	I670-T675 VanDerWaalsContact O-CB 3.3Å; I670-T675 WeakPolarHBondContact O-CB 3.48Å; I670-T675 PolarHBondContact O-N 2.99Å; I670-T675 PolarHBondContact O-OG1 2.74Å; T675-F677 VanDerWaalsContact C-N 3.3Å; T675-F677 PolarHBondContact O-N 3.14Å; T675-L678 PolarHBondContact O-N 3.17Å; T675-L679 HydrophobicContact CG2-CD1 3.7Å; T675-L679 HydrophobicContact CG2-CG 4.3Å; T675-L679 WeakPolarHBondContact O-CB 3.28Å; T675-L679 PolarHBondContact O-N 3.22Å; T675-Q1048 HydrophobicContact CG2-CB 4.21Å; T675-Q1048 HydrophobicContact CG2-CG 3.79Å; T675-L1051 HydrophobicContact CG2-CB 4.42Å; T675-L1051 HydrophobicContact CG2-CD2 4.03Å; T675-E1052 HydrophobicContact CG2-CG 4.19Å
676	P	91.2	Very high	88.8	Confident	68 Å²	68	64.8 Å²	64.8	44%	0.442	30%	0.304	S	S	.	.	H	α-helix	trans	-61.5	-34.9	174	-24.9	35.6	0	0	0	113.5	R671 W680	R671-P676 WeakPolarHBondContact O-CD 3.28Å; R671-P676 WeakPolarHBondContact O-CG 3.5Å; P676-W680 PolarHBondContact O-N 2.8Å
677	F	93.5	Very high	89.4	Confident	131 Å²	131	63.3 Å²	63.3	58%	0.575	30%	0.297	S	S	*	.	H	α-helix	trans	-71.2	-50.7	176.4	174.8	-100.3	0	0	0	112.1	Y673 Y674 T675 L679 W680 V683	Y673-F677 WeakPolarHBondContact O-CB 3.47Å; Y673-F677 PolarHBondContact O-N 3.45Å; Y674-F677 PolarHBondContact O-N 3.21Å; T675-F677 VanDerWaalsContact C-N 3.3Å; T675-F677 PolarHBondContact O-N 3.14Å; F677-L679 PolarHBondContact O-N 2.75Å; F677-W680 VanDerWaalsContact O-CB 3.24Å; F677-W680 WeakPolarHBondContact O-CB 3.33Å; F677-W680 PolarHBondContact O-N 3.39Å; F677-V683 HydrophobicContact CE2-CG2 4.38Å; F677-V683 HydrophobicContact CZ-CG2 4.41Å
678	L	93	Very high	89.9	Confident	6 Å²	6	62 Å²	62	3%	0.031	29%	0.291	C	S	.	.	H	α-helix	trans	-62.8	-41.4	-177.5	-179.9	61.9	0	0	0	112.2	Y674 T675 W680 R684 V687 L1051 L1101 V1102 P1105 V1106	Y674-L678 HydrophobicContact CE1-CD2 3.95Å; Y674-L678 WeakPolarHBondContact O-CB 3.04Å; Y674-L678 PolarHBondContact O-N 3.38Å; T675-L678 PolarHBondContact O-N 3.17Å; L678-W680 VanDerWaalsContact C-N 3.25Å; L678-W680 PolarHBondContact O-N 2.92Å; L678-R684 WeakPolarHBondContact O-CG 3.37Å; L678-V687 HydrophobicContact CD1-CG2 4.22Å; L678-L1051 HydrophobicContact CD2-CD2 3.81Å; L678-L1101 VanDerWaalsContact CD2-O 3.31Å; L678-L1101 WeakPolarHBondContact CD2-O 3.02Å; L678-V1102 HydrophobicContact CD1-CG1 3.73Å; L678-P1105 HydrophobicContact CD2-CB 4.47Å; L678-V1106 HydrophobicContact CD1-CG2 3.67Å; L678-V1106 HydrophobicContact CD2-CG2 4.43Å; L678-V1106 HydrophobicContact CG-CG2 3.84Å
679	L	91.2	Very high	90.1	Very high	15 Å²	15	63 Å²	63	8%	0.079	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-0.1	-178.8	-63.2	-178.9	0	0	0	113.7	T675 F677 R684 L1044 Q1048	T675-L679 HydrophobicContact CG2-CD1 3.7Å; T675-L679 HydrophobicContact CG2-CG 4.3Å; T675-L679 WeakPolarHBondContact O-CB 3.28Å; T675-L679 PolarHBondContact O-N 3.22Å; F677-L679 PolarHBondContact O-N 2.75Å; L679-R684 WeakPolarHBondContact O-CD 3.38Å; L679-R684 PolarHBondContact O-NE 3.4Å; L679-R684 VanDerWaalsContact O-NE 3.12Å; L679-L1044 HydrophobicContact CB-CD1 4.08Å; L679-L1044 HydrophobicContact CD1-CD1 4.35Å; L679-L1044 HydrophobicContact CD2-CD1 4.41Å; L679-Q1048 HydrophobicContact CD1-CB 3.77Å
680	W	91.2	Very high	90.3	Very high	160 Å²	160	63.3 Å²	63.3	61%	0.606	30%	0.299	S	S	*	.	S	Bend	trans	-61.9	136.6	176.5	-170.2	41.9	0	0	0	111.7	P676 F677 L678 P682 V683 R684	P676-W680 PolarHBondContact O-N 2.8Å; F677-W680 VanDerWaalsContact O-CB 3.24Å; F677-W680 WeakPolarHBondContact O-CB 3.33Å; F677-W680 PolarHBondContact O-N 3.39Å; L678-W680 VanDerWaalsContact C-N 3.25Å; L678-W680 PolarHBondContact O-N 2.92Å; W680-P682 HydrophobicContact CD2-CG 3.71Å; W680-P682 HydrophobicContact CE3-CG 3.75Å; W680-P682 HydrophobicContact CG-CG 4.35Å; W680-P682 HydrophobicContact CH2-CG 4.01Å; W680-P682 HydrophobicContact CZ2-CG 3.99Å; W680-P682 HydrophobicContact CZ3-CG 3.89Å; W680-V683 HydrophobicContact CB-CB 4.45Å; W680-V683 HydrophobicContact CB-CG2 4.28Å; W680-V683 HydrophobicContact CE3-CG2 3.69Å; W680-V683 HydrophobicContact CZ3-CG2 4.46Å; W680-V683 PolarHBondContact O-N 2.96Å; W680-V683 VanDerWaalsContact O-N 3.07Å; W680-R684 PolarHBondContact O-N 3.34Å
681	K	86.1	Confident	90.5	Very high	134 Å²	134	64 Å²	64	58%	0.583	30%	0.302	S	S	*	.	H	α-helix	trans	-50.8	-45.5	-167.4	-67	-176.6	-179	177.4	0	115.9
682	P	88.5	Confident	90.5	Very high	54 Å²	54	60.6 Å²	60.6	35%	0.351	29%	0.291	S	S	.	.	H	α-helix	trans	-73.5	-39.9	177	28.4	-33.6	0	0	0	112.5	W680 R684 V685 I686	W680-P682 HydrophobicContact CD2-CG 3.71Å; W680-P682 HydrophobicContact CE3-CG 3.75Å; W680-P682 HydrophobicContact CG-CG 4.35Å; W680-P682 HydrophobicContact CH2-CG 4.01Å; W680-P682 HydrophobicContact CZ2-CG 3.99Å; W680-P682 HydrophobicContact CZ3-CG 3.89Å; P682-R684 VanDerWaalsContact C-N 3.31Å; P682-R684 PolarHBondContact O-N 3.45Å; P682-V685 PolarHBondContact O-N 2.87Å; P682-V685 VanDerWaalsContact O-N 3.08Å; P682-I686 WeakPolarHBondContact O-CG1 3.28Å; P682-I686 PolarHBondContact O-N 2.89Å
683	V	92.2	Very high	90.5	Very high	20 Å²	20	60.3 Å²	60.3	12%	0.121	29%	0.292	C	S	.	.	H	α-helix	trans	-57.9	-44.8	-179.6	176	0	0	0	0	110.6	F677 W680 V685 I686 V687	F677-V683 HydrophobicContact CE2-CG2 4.38Å; F677-V683 HydrophobicContact CZ-CG2 4.41Å; W680-V683 HydrophobicContact CB-CB 4.45Å; W680-V683 HydrophobicContact CB-CG2 4.28Å; W680-V683 HydrophobicContact CE3-CG2 3.69Å; W680-V683 HydrophobicContact CZ3-CG2 4.46Å; W680-V683 PolarHBondContact O-N 2.96Å; W680-V683 VanDerWaalsContact O-N 3.07Å; V683-V685 VanDerWaalsContact C-N 3.28Å; V683-V685 PolarHBondContact O-N 3.38Å; V683-I686 PolarHBondContact O-N 2.9Å; V683-I686 VanDerWaalsContact O-N 3.13Å; V683-V687 HydrophobicContact CG1-CG2 4.16Å; V683-V687 WeakPolarHBondContact O-CG2 3.45Å; V683-V687 PolarHBondContact O-N 3.17Å
684	R	90.9	Very high	90.6	Very high	25 Å²	25	54.6 Å²	54.6	9%	0.094	27%	0.269	C	S	.	.	H	α-helix	trans	-55.8	-37.2	176	-69.4	-162.4	-64.5	137.3	10.8	114	L678 L679 W680 P682 L688 V1106 S1109 F1110	L678-R684 WeakPolarHBondContact O-CG 3.37Å; L679-R684 WeakPolarHBondContact O-CD 3.38Å; L679-R684 PolarHBondContact O-NE 3.4Å; L679-R684 VanDerWaalsContact O-NE 3.12Å; W680-R684 PolarHBondContact O-N 3.34Å; P682-R684 VanDerWaalsContact C-N 3.31Å; P682-R684 PolarHBondContact O-N 3.45Å; R684-L688 WeakPolarHBondContact O-CG 3.43Å; R684-L688 PolarHBondContact O-N 3.33Å; R684-V1106 HydrophobicContact CB-CG1 3.84Å; R684-V1106 HydrophobicContact CG-CG1 4.1Å; R684-V1106 HydrophobicContact CG-CG2 4.17Å; R684-V1106 VanDerWaalsContact O-CG1 3.24Å; R684-V1106 WeakPolarHBondContact O-CG1 3.35Å; R684-S1109 WeakPolarHBondContact CD-OG 3.35Å; R684-S1109 PolarHBondContact NH1-OG 2.98Å; R684-F1110 HydrophobicContact CB-CE2 3.95Å; R684-F1110 HydrophobicContact CB-CZ 4.26Å
685	V	87.6	Confident	90.3	Very high	26 Å²	26	52.4 Å²	52.4	16%	0.158	26%	0.264	C	S	.	.	H	α-helix	trans	-76.1	-40	177.8	-178.2	0	0	0	0	110.9	V128 P682 V683 L688 L689 F1110	V128-V685 HydrophobicContact CG1-CG1 4.36Å; V128-V685 HydrophobicContact CG1-CG2 3.95Å; P682-V685 PolarHBondContact O-N 2.87Å; P682-V685 VanDerWaalsContact O-N 3.08Å; V683-V685 VanDerWaalsContact C-N 3.28Å; V683-V685 PolarHBondContact O-N 3.38Å; V685-L688 PolarHBondContact O-N 3.14Å; V685-L689 HydrophobicContact CG1-CD1 4.17Å; V685-L689 WeakPolarHBondContact O-CG 3.48Å; V685-L689 PolarHBondContact O-N 3.44Å; V685-L689 VanDerWaalsContact O-N 3.12Å; V685-F1110 HydrophobicContact CG2-CZ 4.44Å
686	I	91.1	Very high	90.1	Very high	101 Å²	101	52.7 Å²	52.7	52%	0.518	27%	0.266	S	S	.	.	H	α-helix	trans	-61.6	-45.2	176.7	-65.4	164.9	0	0	0	110.6	P682 V683 L688 L689 V690	P682-I686 WeakPolarHBondContact O-CG1 3.28Å; P682-I686 PolarHBondContact O-N 2.89Å; V683-I686 PolarHBondContact O-N 2.9Å; V683-I686 VanDerWaalsContact O-N 3.13Å; I686-L688 PolarHBondContact O-N 3.03Å; I686-L689 PolarHBondContact O-N 3.42Å; I686-V690 HydrophobicContact CG2-CG2 4.16Å; I686-V690 WeakPolarHBondContact O-CB 3.47Å; I686-V690 WeakPolarHBondContact O-CG2 3.31Å; I686-V690 PolarHBondContact O-N 3.01Å
687	V	92.5	Very high	89.9	Confident	17 Å²	17	51.7 Å²	51.7	10%	0.103	26%	0.261	C	S	.	.	H	α-helix	trans	-57.7	-49.4	177.1	167.8	0	0	0	0	111.2	L678 V683 L689 V690 F691 V1102 V1106	L678-V687 HydrophobicContact CD1-CG2 4.22Å; V683-V687 HydrophobicContact CG1-CG2 4.16Å; V683-V687 WeakPolarHBondContact O-CG2 3.45Å; V683-V687 PolarHBondContact O-N 3.17Å; V687-L689 VanDerWaalsContact C-N 3.33Å; V687-L689 PolarHBondContact O-N 3.27Å; V687-V690 PolarHBondContact O-N 2.71Å; V687-F691 HydrophobicContact CG1-CD2 3.96Å; V687-F691 HydrophobicContact CG1-CE2 4.1Å; V687-F691 WeakPolarHBondContact O-CD2 3.39Å; V687-F691 PolarHBondContact O-N 2.84Å; V687-V1102 HydrophobicContact CG1-CG1 4.08Å; V687-V1102 HydrophobicContact CG2-CG1 4.12Å; V687-V1106 HydrophobicContact CB-CG1 4.28Å; V687-V1106 HydrophobicContact CB-CG2 4.36Å; V687-V1106 HydrophobicContact CG1-CB 4.14Å; V687-V1106 HydrophobicContact CG1-CG1 4.16Å; V687-V1106 HydrophobicContact CG1-CG2 4.06Å
688	L	88.8	Confident	89.6	Confident	17 Å²	17	45.5 Å²	45.5	9%	0.089	23%	0.234	C	C	.	.	H	α-helix	trans	-60.6	-41	178.5	-69.7	-178.9	0	0	0	112.6	R684 V685 I686 C692 F1103 V1106 F1107 F1110	R684-L688 WeakPolarHBondContact O-CG 3.43Å; R684-L688 PolarHBondContact O-N 3.33Å; V685-L688 PolarHBondContact O-N 3.14Å; I686-L688 PolarHBondContact O-N 3.03Å; L688-C692 WeakPolarHBondContact O-CB 3.35Å; L688-C692 PolarHBondContact O-N 3.4Å; L688-F1103 HydrophobicContact CD2-CD2 4.21Å; L688-F1103 HydrophobicContact CD2-CE2 3.64Å; L688-F1103 HydrophobicContact CD2-CZ 4.28Å; L688-V1106 HydrophobicContact CD2-CG1 4.12Å; L688-V1106 HydrophobicContact CG-CG1 3.95Å; L688-F1107 HydrophobicContact CD2-CB 4.44Å; L688-F1107 HydrophobicContact CD2-CD2 4.13Å; L688-F1110 HydrophobicContact CD1-CD2 3.66Å; L688-F1110 HydrophobicContact CD1-CE2 3.6Å; L688-F1110 HydrophobicContact CD1-CZ 4.48Å; L688-F1110 HydrophobicContact CG-CE2 4.49Å
689	L	88.6	Confident	89.2	Confident	52 Å²	52	48.4 Å²	48.4	27%	0.272	25%	0.249	S	C	.	.	H	α-helix	trans	-68.3	-43.4	178.5	-69.4	173.3	0	0	0	112.2	C121 I124 V125 V685 I686 V687 C692 V693	C121-L689 HydrophobicContact CB-CD2 4.49Å; I124-L689 HydrophobicContact CG2-CD2 4.17Å; V125-L689 HydrophobicContact CG2-CD2 4.42Å; V685-L689 HydrophobicContact CG1-CD1 4.17Å; V685-L689 WeakPolarHBondContact O-CG 3.48Å; V685-L689 PolarHBondContact O-N 3.44Å; V685-L689 VanDerWaalsContact O-N 3.12Å; I686-L689 PolarHBondContact O-N 3.42Å; V687-L689 VanDerWaalsContact C-N 3.33Å; V687-L689 PolarHBondContact O-N 3.27Å; L689-C692 PolarHBondContact O-N 3.23Å; L689-V693 WeakPolarHBondContact O-CB 3.2Å; L689-V693 WeakPolarHBondContact O-CG2 3.34Å; L689-V693 PolarHBondContact O-N 2.93Å
690	V	92.5	Very high	88.9	Confident	80 Å²	80	48.4 Å²	48.4	49%	0.485	25%	0.251	S	S	.	.	H	α-helix	trans	-62.7	-48.6	179	169.2	0	0	0	0	111.3	I686 V687 C692 V693 W694	I686-V690 HydrophobicContact CG2-CG2 4.16Å; I686-V690 WeakPolarHBondContact O-CB 3.47Å; I686-V690 WeakPolarHBondContact O-CG2 3.31Å; I686-V690 PolarHBondContact O-N 3.01Å; V687-V690 PolarHBondContact O-N 2.71Å; V690-C692 VanDerWaalsContact C-N 3.35Å; V690-C692 PolarHBondContact O-N 2.88Å; V690-V693 PolarHBondContact O-N 3.29Å; V690-W694 WeakPolarHBondContact O-CB 3.37Å; V690-W694 PolarHBondContact O-N 2.76Å
691	F	91.9	Very high	88.7	Confident	20 Å²	20	41.8 Å²	41.8	9%	0.088	23%	0.228	C	C	.	.	H	α-helix	trans	-67.9	-33.1	178.4	-82.4	-102.4	0	0	0	112.5	V687 W694 C695 A1098 H1099 V1102 F1103	V687-F691 HydrophobicContact CG1-CD2 3.96Å; V687-F691 HydrophobicContact CG1-CE2 4.1Å; V687-F691 WeakPolarHBondContact O-CD2 3.39Å; V687-F691 PolarHBondContact O-N 2.84Å; F691-W694 HydrophobicContact CD1-CE3 4.49Å; F691-W694 HydrophobicContact CE1-CZ3 4.36Å; F691-C695 WeakPolarHBondContact O-CB 3.44Å; F691-C695 PolarHBondContact O-N 2.7Å; F691-A1098 HydrophobicContact CE1-CB 4.36Å; F691-A1098 HydrophobicContact CZ-CB 4.13Å; F691-H1099 AromaticContact CD1-CD2 3.88Å; F691-H1099 AromaticContact CD1-CE1 3.94Å; F691-H1099 AromaticContact CD1-NE2 3.64Å; F691-H1099 AromaticContact CE1-CD2 3.98Å; F691-H1099 AromaticContact CE1-CE1 3.78Å; F691-H1099 AromaticContact CE1-CG 3.92Å; F691-H1099 AromaticContact CE1-ND1 3.8Å; F691-H1099 AromaticContact CE1-NE2 3.89Å; F691-V1102 HydrophobicContact CE2-CB 4.38Å; F691-V1102 HydrophobicContact CE2-CG1 4.15Å; F691-V1102 HydrophobicContact CZ-CB 4.21Å; F691-V1102 HydrophobicContact CZ-CG1 4.47Å; F691-F1103 HydrophobicContact CB-CD2 3.48Å; F691-F1103 VanDerWaalsContact CB-CD2 3.48Å; F691-F1103 HydrophobicContact CB-CE2 3.71Å; F691-F1103 HydrophobicContact CB-CG 4.34Å; F691-F1103 HydrophobicContact CD1-CB 3.82Å; F691-F1103 AromaticContact CD1-CD2 3.96Å; F691-F1103 HydrophobicContact CD1-CD2 3.96Å; F691-F1103 HydrophobicContact CD1-CG 4.01Å; F691-F1103 HydrophobicContact CD2-CB 4.36Å; F691-F1103 HydrophobicContact CD2-CD2 4.11Å; F691-F1103 HydrophobicContact CE1-CB 3.78Å; F691-F1103 HydrophobicContact CE1-CG 4.47Å; F691-F1103 HydrophobicContact CE2-CB 4.32Å; F691-F1103 HydrophobicContact CG-CB 4.1Å; F691-F1103 AromaticContact CG-CD2 3.59Å; F691-F1103 HydrophobicContact CG-CD2 3.59Å; F691-F1103 HydrophobicContact CG-CE2 4.34Å; F691-F1103 HydrophobicContact CG-CG 4.1Å; F691-F1103 HydrophobicContact CZ-CB 4.03Å
692	C	87.4	Confident	88.5	Confident	16 Å²	16	37.4 Å²	37.4	11%	0.108	21%	0.212	C	C	.	.	H	α-helix	trans	-65.8	-46.7	173.8	-173.6	0	0	0	0	112	I124 L688 L689 V690 W694 C695 C696	I124-C692 HydrophobicContact CD1-CB 4Å; L688-C692 WeakPolarHBondContact O-CB 3.35Å; L688-C692 PolarHBondContact O-N 3.4Å; L689-C692 PolarHBondContact O-N 3.23Å; V690-C692 VanDerWaalsContact C-N 3.35Å; V690-C692 PolarHBondContact O-N 2.88Å; C692-W694 VanDerWaalsContact C-N 3.34Å; C692-W694 PolarHBondContact O-N 2.8Å; C692-C695 PolarHBondContact O-N 2.87Å; C692-C696 PolarHBondContact O-N 2.91Å; C692-C696 VanDerWaalsContact O-N 3.08Å; C692-C696 PolarHBondContact O-SG 3.25Å
693	V	89.1	Confident	88.2	Confident	74 Å²	74	38.9 Å²	38.9	45%	0.448	22%	0.217	S	C	.	.	H	α-helix	trans	-64.1	-39.8	177.6	169.5	0	0	0	0	111	L689 V690 C696 S697	L689-V693 WeakPolarHBondContact O-CB 3.2Å; L689-V693 WeakPolarHBondContact O-CG2 3.34Å; L689-V693 PolarHBondContact O-N 2.93Å; V690-V693 PolarHBondContact O-N 3.29Å; V693-C696 PolarHBondContact O-N 3.13Å; V693-S697 WeakPolarHBondContact O-CB 3.29Å; V693-S697 PolarHBondContact O-N 2.57Å; V693-S697 PolarHBondContact O-OG 2.91Å
694	W	91.4	Very high	87.8	Confident	58 Å²	58	41.2 Å²	41.2	22%	0.22	23%	0.226	C	C	.	.	H	α-helix	trans	-62.9	-51.6	174.9	-172.2	0.7	0	0	0	111.7	V690 F691 C692 C696 S697 S698 N986 W993 F1095	V690-W694 WeakPolarHBondContact O-CB 3.37Å; V690-W694 PolarHBondContact O-N 2.76Å; F691-W694 HydrophobicContact CD1-CE3 4.49Å; F691-W694 HydrophobicContact CE1-CZ3 4.36Å; C692-W694 VanDerWaalsContact C-N 3.34Å; C692-W694 PolarHBondContact O-N 2.8Å; W694-C696 PolarHBondContact O-N 3.34Å; W694-S697 PolarHBondContact O-N 3.05Å; W694-S697 VanDerWaalsContact O-N 3.14Å; W694-S697 PolarHBondContact O-OG 2.71Å; W694-S698 PolarHBondContact O-N 3.26Å; W694-S698 PolarHBondContact O-OG 3.47Å; W694-N986 VanDerWaalsContact C-OD1 3.3Å; W694-N986 PolarHBondContact NE1-OD1 2.87Å; W694-N986 PolarHBondContact O-OD1 3.12Å; W694-W993 AromaticContact NE1-CZ3 3.97Å; W694-F1095 AromaticContact CH2-CD1 3.79Å; W694-F1095 HydrophobicContact CH2-CD1 3.79Å; W694-F1095 AromaticContact CH2-CE1 3.81Å; W694-F1095 HydrophobicContact CH2-CE1 3.81Å; W694-F1095 HydrophobicContact CH2-CG 4.3Å; W694-F1095 HydrophobicContact CH2-CZ 4.31Å; W694-F1095 AromaticContact CZ2-CD1 3.9Å; W694-F1095 HydrophobicContact CZ2-CD1 3.9Å; W694-F1095 HydrophobicContact CZ2-CD2 4.26Å; W694-F1095 AromaticContact CZ2-CE1 3.56Å; W694-F1095 HydrophobicContact CZ2-CE1 3.56Å; W694-F1095 AromaticContact CZ2-CE2 3.94Å; W694-F1095 HydrophobicContact CZ2-CE2 3.94Å; W694-F1095 HydrophobicContact CZ2-CG 4.26Å; W694-F1095 AromaticContact CZ2-CZ 3.6Å; W694-F1095 HydrophobicContact CZ2-CZ 3.6Å
695	C	86	Confident	87.5	Confident	26 Å²	26	41.2 Å²	41.2	18%	0.176	23%	0.228	C	C	.	.	H	α-helix	trans	-56.2	-38.5	178.5	-170.3	0	0	0	0	112.2	F691 C692 L699 N986	F691-C695 WeakPolarHBondContact O-CB 3.44Å; F691-C695 PolarHBondContact O-N 2.7Å; C692-C695 PolarHBondContact O-N 2.87Å; C695-L699 VanDerWaalsContact O-CB 3.3Å; C695-L699 WeakPolarHBondContact O-CB 3.41Å; C695-L699 PolarHBondContact O-N 3.02Å; C695-N986 VanDerWaalsContact CA-OD1 3.27Å; C695-N986 WeakPolarHBondContact CA-OD1 3.26Å; C695-N986 PolarHBondContact N-OD1 3.32Å
696	C	86.7	Confident	87.4	Confident	7 Å²	7	45.2 Å²	45.2	5%	0.047	25%	0.248	C	C	.	.	H	α-helix	trans	-78	-35.6	178.8	-58.7	0	0	0	0	113.3	S113 C117 C692 V693 W694 S698 L699 A700	S113-C696 PolarHBondContact OG-O 2.89Å; C117-C696 HydrophobicContact CB-CB 3.52Å; C692-C696 PolarHBondContact O-N 2.91Å; C692-C696 VanDerWaalsContact O-N 3.08Å; C692-C696 PolarHBondContact O-SG 3.25Å; V693-C696 PolarHBondContact O-N 3.13Å; W694-C696 PolarHBondContact O-N 3.34Å; C696-S698 VanDerWaalsContact C-N 3.29Å; C696-S698 PolarHBondContact O-N 2.9Å; C696-L699 PolarHBondContact O-N 3.11Å; C696-A700 WeakPolarHBondContact O-CB 3.1Å; C696-A700 PolarHBondContact O-N 3.49Å
697	S	87.2	Confident	87.3	Confident	47 Å²	47	43.8 Å²	43.8	33%	0.329	24%	0.241	S	C	.	.	H	α-helix	trans	-66.7	-34.8	174.8	71.4	0	0	0	0	111.4	V693 W694	V693-S697 WeakPolarHBondContact O-CB 3.29Å; V693-S697 PolarHBondContact O-N 2.57Å; V693-S697 PolarHBondContact O-OG 2.91Å; W694-S697 PolarHBondContact O-N 3.05Å; W694-S697 VanDerWaalsContact O-N 3.14Å; W694-S697 PolarHBondContact O-OG 2.71Å
698	S	87.9	Confident	86.9	Confident	0 Å²	0	43 Å²	43	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-70.6	-43.6	171.4	-59.2	0	0	0	0	112.5	W694 C696 A700 V701 V702 F985 N986	W694-S698 PolarHBondContact O-N 3.26Å; W694-S698 PolarHBondContact O-OG 3.47Å; C696-S698 VanDerWaalsContact C-N 3.29Å; C696-S698 PolarHBondContact O-N 2.9Å; S698-A700 PolarHBondContact O-N 3.04Å; S698-V701 VanDerWaalsContact O-CG2 3.24Å; S698-V701 WeakPolarHBondContact O-CG2 3.18Å; S698-V701 PolarHBondContact O-N 2.93Å; S698-V701 VanDerWaalsContact O-N 3.09Å; S698-V702 WeakPolarHBondContact O-CG2 3.25Å; S698-V702 PolarHBondContact O-N 3.15Å; S698-F985 WeakPolarHBondContact CB-O 3.43Å; S698-N986 PolarHBondContact OG-OD1 3.01Å
699	L	85	Confident	86.8	Confident	68 Å²	68	43.7 Å²	43.7	36%	0.356	24%	0.24	S	C	.	.	H	α-helix	trans	-57.6	-33.1	173.4	-172.6	69.2	0	0	0	112.6	C695 C696 V701 F985	C695-L699 VanDerWaalsContact O-CB 3.3Å; C695-L699 WeakPolarHBondContact O-CB 3.41Å; C695-L699 PolarHBondContact O-N 3.02Å; C696-L699 PolarHBondContact O-N 3.11Å; L699-V701 PolarHBondContact O-N 3.38Å; L699-F985 HydrophobicContact CD1-CD1 3.69Å; L699-F985 HydrophobicContact CD1-CE1 3.72Å; L699-F985 HydrophobicContact CD1-CG 4.27Å; L699-F985 HydrophobicContact CD1-CZ 4.31Å
700	A	84.5	Confident	86.6	Confident	14 Å²	14	42.6 Å²	42.6	12%	0.116	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-8.8	179	0	0	0	0	0	114.9	C696 S698 N703	C696-A700 WeakPolarHBondContact O-CB 3.1Å; C696-A700 PolarHBondContact O-N 3.49Å; S698-A700 PolarHBondContact O-N 3.04Å; A700-N703 PolarHBondContact O-OD1 3.12Å
701	V	87	Confident	86.2	Confident	21 Å²	21	41.5 Å²	41.5	13%	0.127	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-120.2	-3.8	-179.4	-59.9	0	0	0	0	114.3	S698 L699 N703 K704 F992	S698-V701 VanDerWaalsContact O-CG2 3.24Å; S698-V701 WeakPolarHBondContact O-CG2 3.18Å; S698-V701 PolarHBondContact O-N 2.93Å; S698-V701 VanDerWaalsContact O-N 3.09Å; L699-V701 PolarHBondContact O-N 3.38Å; V701-N703 PolarHBondContact O-N 3.13Å; V701-K704 WeakPolarHBondContact O-CB 3.11Å; V701-K704 PolarHBondContact O-N 3.17Å; V701-F992 HydrophobicContact CB-CB 4.31Å; V701-F992 HydrophobicContact CB-CD1 3.49Å; V701-F992 VanDerWaalsContact CB-CD1 3.49Å; V701-F992 HydrophobicContact CB-CE1 3.94Å; V701-F992 HydrophobicContact CB-CG 3.91Å; V701-F992 HydrophobicContact CG1-CD1 3.74Å; V701-F992 HydrophobicContact CG1-CE1 3.77Å; V701-F992 HydrophobicContact CG2-CB 3.98Å; V701-F992 HydrophobicContact CG2-CD1 3.7Å; V701-F992 HydrophobicContact CG2-CG 4.07Å
702	V	81.7	Confident	85.8	Confident	42 Å²	42	43.4 Å²	43.4	26%	0.255	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-57.4	-33.8	178.7	-176.3	0	0	0	0	111.9	S698 K704 L705 M988	S698-V702 WeakPolarHBondContact O-CG2 3.25Å; S698-V702 PolarHBondContact O-N 3.15Å; V702-K704 PolarHBondContact O-N 3.31Å; V702-L705 HydrophobicContact CG1-CD1 4.34Å; V702-L705 PolarHBondContact O-N 3.28Å; V702-M988 HydrophobicContact CG1-CB 4.43Å; V702-M988 HydrophobicContact CG1-SD 3.85Å; V702-M988 HydrophobicContact CG2-CB 4Å
703	N	82.2	Confident	85.7	Confident	85 Å²	85	44.6 Å²	44.6	46%	0.455	24%	0.237	S	C	.	.	G	3₁₀ helix	trans	-74.1	1.5	177.3	75	-75.4	0	0	0	114.5	A109 A700 V701	A109-N703 HydrophobicContact CB-CB 4.23Å; A109-N703 VanDerWaalsContact CB-OD1 3.29Å; A109-N703 WeakPolarHBondContact CB-OD1 3.22Å; A700-N703 PolarHBondContact O-OD1 3.12Å; V701-N703 PolarHBondContact O-N 3.13Å
704	K	84	Confident	85.4	Confident	70 Å²	70	41.9 Å²	41.9	30%	0.304	22%	0.222	S	C	.	.	G	3₁₀ helix	trans	-116.7	13.5	-179.4	-58.4	-179.3	175	-93.7	0	112.8	E107 V701 V702 D706 F992	E107-K704 IonicContact OE1-NZ 3.27Å; E107-K704 PolarHBondContact OE1-NZ 3.31Å; E107-K704 WeakPolarHBondContact OE2-CE 3.3Å; E107-K704 IonicContact OE2-NZ 3.66Å; E107-K704 PolarHBondContact OE2-NZ 3.12Å; V701-K704 WeakPolarHBondContact O-CB 3.11Å; V701-K704 PolarHBondContact O-N 3.17Å; V702-K704 PolarHBondContact O-N 3.31Å; K704-D706 PolarHBondContact O-N 3.44Å; K704-F992 HydrophobicContact CB-CD2 3.86Å; K704-F992 HydrophobicContact CB-CE2 3.55Å; K704-F992 HydrophobicContact CB-CZ 4.19Å; K704-F992 HydrophobicContact CD-CE2 4.24Å; K704-F992 HydrophobicContact CD-CZ 4.05Å; K704-F992 WeakPolarHBondContact O-CD2 3.4Å
705	L	84.8	Confident	85.1	Confident	24 Å²	24	39.1 Å²	39.1	13%	0.126	21%	0.211	C	C	.	.	P	Polyproline II helix	trans	-72.2	118.4	173.2	-71.3	171.6	0	0	0	109.8	V702 L707 M988 M991 F992 F998	V702-L705 HydrophobicContact CG1-CD1 4.34Å; V702-L705 PolarHBondContact O-N 3.28Å; L705-L707 PolarHBondContact O-N 2.72Å; L705-M988 HydrophobicContact CD1-CB 4.18Å; L705-M988 HydrophobicContact CD1-CG 4.37Å; L705-M991 HydrophobicContact CD2-CB 3.61Å; L705-F992 HydrophobicContact CD2-CB 3.89Å; L705-F998 HydrophobicContact CB-CB 4.32Å
706	D	86	Confident	85.1	Confident	110 Å²	110	38.3 Å²	38.3	59%	0.588	21%	0.205	S	C	*	.	P	Polyproline II helix	trans	-59.5	128.5	176	-62.9	-55.2	0	0	0	110.4	K704 A997 F998	K704-D706 PolarHBondContact O-N 3.44Å; D706-A997 HydrophobicContact CB-CB 4.44Å; D706-A997 CarbonylContact O-C 3.58Å; D706-A997 WeakPolarHBondContact O-CA 3.48Å; D706-F998 PolarHBondContact O-N 3.24Å
707	L	87.1	Confident	84.9	Confident	71 Å²	71	43.5 Å²	43.5	37%	0.372	23%	0.229	S	C	.	.	B	Isolated β-bridge	trans	-89.9	118.7	-179.4	-67.3	171.9	0	0	0	110.2	L705 I899 F998	L705-L707 PolarHBondContact O-N 2.72Å; L707-I899 HydrophobicContact CB-CD1 4.27Å; L707-I899 WeakPolarHBondContact O-CD1 3.21Å; L707-F998 HydrophobicContact CD2-CB 4.29Å; L707-F998 HydrophobicContact CD2-CD1 3.73Å; L707-F998 HydrophobicContact CD2-CG 4.47Å
708	G	85.5	Confident	85	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.244	C	C	.	.	S	Bend	trans	141	179.3	174	0	0	0	0	0	116.5	A997 F998 N999	G708-A997 WeakPolarHBondContact O-CB 3.39Å; G708-F998 PolarHBondContact N-O 2.95Å; G708-N999 WeakPolarHBondContact O-CB 3.38Å; G708-N999 PolarHBondContact O-ND2 3.36Å
709	L	86	Confident	85.1	Confident	32 Å²	32	47 Å²	47	17%	0.168	25%	0.245	C	C	.	.			trans	-132.8	117.2	163.4	176.9	63	0	0	0	106.5	L713 Y940 N999 F1084	L709-L713 HydrophobicContact CD1-CB 4.34Å; L709-L713 HydrophobicContact CD1-CD1 4.43Å; L709-Y940 PolarHBondContact N-OH 3.27Å; L709-N999 HydrophobicContact CB-CB 4.13Å; L709-F1084 HydrophobicContact CD1-CE2 3.52Å; L709-F1084 HydrophobicContact CD1-CZ 3.65Å
710	D	84	Confident	85.5	Confident	30 Å²	30	45.5 Å²	45.5	16%	0.16	23%	0.234	C	C	.	.			trans	-77	128.5	175.1	-68.8	-14.5	0	0	0	109.8	K712 L713 S895	D710-K712 HydrophobicContact CB-CD 4.16Å; D710-K712 HydrophobicContact CB-CG 4Å; D710-K712 PolarHBondContact O-N 3.31Å; D710-K712 VanDerWaalsContact O-N 3.1Å; D710-K712 WeakPolarHBondContact OD2-CE 3.46Å; D710-K712 IonicContact OD2-NZ 3.3Å; D710-K712 PolarHBondContact OD2-NZ 3.44Å; D710-L713 HydrophobicContact CB-CD1 4.27Å; D710-L713 HydrophobicContact CB-CG 4.28Å; D710-L713 VanDerWaalsContact O-CB 3.31Å; D710-L713 WeakPolarHBondContact O-CB 3.43Å; D710-L713 PolarHBondContact O-N 3.01Å; D710-S895 VanDerWaalsContact OD1-CB 3.27Å; D710-S895 WeakPolarHBondContact OD1-CB 3.34Å; D710-S895 PolarHBondContact OD1-N 2.83Å; D710-S895 PolarHBondContact OD1-OG 2.9Å
711	E	83.8	Confident	85.8	Confident	57 Å²	57	44.9 Å²	44.9	27%	0.266	23%	0.229	S	C	.	.	G	3₁₀ helix	trans	-57.3	-30.3	-174	-66.6	165.5	-153.6	0	0	113.8	L713 S714 F725 Y937	E711-L713 PolarHBondContact O-N 3.34Å; E711-S714 PolarHBondContact O-N 3.41Å; E711-S714 VanDerWaalsContact O-N 3.08Å; E711-S714 PolarHBondContact O-OG 2.6Å; E711-F725 HydrophobicContact CB-CE1 4.22Å; E711-F725 HydrophobicContact CB-CE2 4.42Å; E711-F725 HydrophobicContact CB-CZ 3.74Å; E711-Y937 PolarHBondContact OE1-OH 2.83Å
712	K	84.9	Confident	86	Confident	59 Å²	59	46 Å²	46	26%	0.257	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-56.7	-27.9	172	70.3	-155.4	174.8	-146.4	0	114	D710 M715 Q722 F725 N894	D710-K712 HydrophobicContact CB-CD 4.16Å; D710-K712 HydrophobicContact CB-CG 4Å; D710-K712 PolarHBondContact O-N 3.31Å; D710-K712 VanDerWaalsContact O-N 3.1Å; D710-K712 WeakPolarHBondContact OD2-CE 3.46Å; D710-K712 IonicContact OD2-NZ 3.3Å; D710-K712 PolarHBondContact OD2-NZ 3.44Å; K712-M715 PolarHBondContact O-N 3.04Å; K712-Q722 PolarHBondContact O-NE2 3.19Å; K712-F725 HydrophobicContact CB-CD2 4.15Å; K712-F725 HydrophobicContact CB-CG 4.44Å; K712-N894 PolarHBondContact NZ-OD1 2.87Å
713	L	84.5	Confident	86.6	Confident	41 Å²	41	48.9 Å²	48.9	22%	0.215	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-80.1	-15.6	179.4	-59.3	176.3	0	0	0	113.3	L709 D710 E711 I1080	L709-L713 HydrophobicContact CD1-CB 4.34Å; L709-L713 HydrophobicContact CD1-CD1 4.43Å; D710-L713 HydrophobicContact CB-CD1 4.27Å; D710-L713 HydrophobicContact CB-CG 4.28Å; D710-L713 VanDerWaalsContact O-CB 3.31Å; D710-L713 WeakPolarHBondContact O-CB 3.43Å; D710-L713 PolarHBondContact O-N 3.01Å; E711-L713 PolarHBondContact O-N 3.34Å; L713-I1080 WeakPolarHBondContact O-CG1 3.32Å
714	S	82.6	Confident	87.1	Confident	17 Å²	17	45.7 Å²	45.7	12%	0.119	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-84.4	-11.4	172.1	39.7	0	0	0	0	114	E711	E711-S714 PolarHBondContact O-N 3.41Å; E711-S714 VanDerWaalsContact O-N 3.08Å; E711-S714 PolarHBondContact O-OG 2.6Å
715	M	85	Confident	87.5	Confident	1 Å²	1	43.4 Å²	43.4	1%	0.005	22%	0.219	C	C	.	.	S	Bend	trans	-91.5	145.3	180	-57.9	-57.2	165.5	0	0	111.7	I457 E460 K712 M721 Q722 F725	I457-M715 HydrophobicContact CB-CE 4.12Å; I457-M715 HydrophobicContact CG1-CE 3.87Å; I457-M715 HydrophobicContact CG2-CE 3.95Å; E460-M715 HydrophobicContact CB-SD 3.79Å; K712-M715 PolarHBondContact O-N 3.04Å; M715-M721 HydrophobicContact CB-CB 4.35Å; M715-M721 HydrophobicContact CE-CG 4.38Å; M715-M721 HydrophobicContact CG-CB 3.76Å; M715-M721 HydrophobicContact CG-CG 4.44Å; M715-M721 HydrophobicContact SD-CB 3.98Å; M715-M721 HydrophobicContact SD-CG 4.01Å; M715-Q722 PolarHBondContact O-NE2 3.06Å; M715-F725 HydrophobicContact CE-CE2 4.22Å; M715-F725 HydrophobicContact CG-CE2 3.94Å
716	P	85.9	Confident	87.9	Confident	8 Å²	8	48.3 Å²	48.3	5%	0.052	24%	0.241	C	C	.	.			trans	-53.5	156.7	166.4	-27.8	36.6	0	0	0	113.3	A464 D718 S719 Q722	A464-P716 HydrophobicContact CB-CG 3.95Å; P716-D718 VanDerWaalsContact C-N 3.27Å; P716-D718 WeakPolarHBondContact CB-OD1 3.47Å; P716-D718 PolarHBondContact O-N 3.26Å; P716-S719 VanDerWaalsContact O-CB 3.27Å; P716-S719 WeakPolarHBondContact O-CB 3.35Å; P716-S719 PolarHBondContact O-N 3.4Å; P716-Q722 VanDerWaalsContact O-CG 3.3Å; P716-Q722 WeakPolarHBondContact O-CG 3.37Å; P716-Q722 PolarHBondContact O-NE2 2.04Å; P716-Q722 VanDerWaalsContact O-NE2 3.11Å
717	Q	84.3	Confident	88.3	Confident	117 Å²	117	43.1 Å²	43.1	55%	0.547	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-19.4	178.8	-56.7	-166.3	7.3	0	0	113.5	Q1079	Q717-Q1079 HydrophobicContact CG-CG 3.92Å
718	D	88.2	Confident	88.5	Confident	118 Å²	118	40.8 Å²	40.8	63%	0.631	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.2	8.8	176.9	69.6	-24.8	0	0	0	112.7	R463 P716	R463-D718 IonicContact CZ-OD1 2.9Å; R463-D718 IonicContact CZ-OD2 2.67Å; R463-D718 VanDerWaalsContact NH1-CG 3.34Å; R463-D718 IonicContact NH1-OD1 3.73Å; R463-D718 PolarHBondContact NH1-OD1 2.96Å; R463-D718 VanDerWaalsContact NH1-OD1 3.15Å; R463-D718 IonicContact NH1-OD2 3.2Å; R463-D718 PolarHBondContact NH1-OD2 3.09Å; R463-D718 IonicContact NH2-OD1 2.7Å; R463-D718 PolarHBondContact NH2-OD1 2.95Å; R463-D718 IonicContact NH2-OD2 3.18Å; P716-D718 VanDerWaalsContact C-N 3.27Å; P716-D718 WeakPolarHBondContact CB-OD1 3.47Å; P716-D718 PolarHBondContact O-N 3.26Å
719	S	89.9	Confident	88.8	Confident	3 Å²	3	42.7 Å²	42.7	2%	0.021	21%	0.211	C	C	.	.			trans	-80.3	135.7	-173.8	-172.8	0	0	0	0	112.7	E460 P716 M721 Q722	E460-S719 VanDerWaalsContact CD-OG 3.31Å; E460-S719 WeakPolarHBondContact OE2-CB 3.38Å; E460-S719 PolarHBondContact OE2-OG 3.03Å; P716-S719 VanDerWaalsContact O-CB 3.27Å; P716-S719 WeakPolarHBondContact O-CB 3.35Å; P716-S719 PolarHBondContact O-N 3.4Å; S719-M721 PolarHBondContact O-N 3.16Å; S719-M721 VanDerWaalsContact O-N 3.14Å; S719-M721 WeakPolarHBondContact OG-CB 3.2Å; S719-M721 PolarHBondContact OG-N 3.4Å; S719-Q722 WeakPolarHBondContact O-CB 3.26Å; S719-Q722 PolarHBondContact O-N 3.39Å
720	Y	92.7	Very high	89.1	Confident	36 Å²	36	46.9 Å²	46.9	14%	0.141	23%	0.227	C	C	.	.	H	α-helix	trans	-58.7	-21.2	168.3	67	-80.3	0	0	0	112.9	F451 S456 E460 Q722 D723 Y724	F451-Y720 HydrophobicContact CD2-CD2 4.12Å; F451-Y720 HydrophobicContact CD2-CE2 4.09Å; F451-Y720 HydrophobicContact CE1-CD2 4.01Å; F451-Y720 HydrophobicContact CE1-CG 4.48Å; F451-Y720 AromaticContact CE2-CD2 3.5Å; F451-Y720 HydrophobicContact CE2-CD2 3.5Å; F451-Y720 VanDerWaalsContact CE2-CD2 3.5Å; F451-Y720 AromaticContact CE2-CE2 3.45Å; F451-Y720 HydrophobicContact CE2-CE2 3.45Å; F451-Y720 VanDerWaalsContact CE2-CE2 3.45Å; F451-Y720 HydrophobicContact CE2-CG 4.43Å; F451-Y720 AromaticContact CZ-CD2 3.43Å; F451-Y720 HydrophobicContact CZ-CD2 3.43Å; F451-Y720 VanDerWaalsContact CZ-CD2 3.43Å; F451-Y720 AromaticContact CZ-CE2 3.84Å; F451-Y720 HydrophobicContact CZ-CE2 3.84Å; F451-Y720 AromaticContact CZ-CG 3.98Å; F451-Y720 HydrophobicContact CZ-CG 3.98Å; S456-Y720 VanDerWaalsContact CB-OH 3.24Å; S456-Y720 WeakPolarHBondContact CB-OH 3.37Å; S456-Y720 PolarHBondContact OG-OH 2.92Å; E460-Y720 HydrophobicContact CG-CE1 3.83Å; Y720-Q722 VanDerWaalsContact C-N 3.28Å; Y720-Q722 PolarHBondContact O-N 2.85Å; Y720-D723 PolarHBondContact O-N 3.13Å; Y720-Y724 PolarHBondContact O-N 3.04Å; Y720-Y724 VanDerWaalsContact O-N 3.08Å
721	M	92.6	Very high	89.5	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-64.6	-28.4	170.5	-70	-75.1	94	0	0	113	F451 K452 E460 M715 S719 Y724 F725	F451-M721 WeakPolarHBondContact O-CE 3.41Å; K452-M721 HydrophobicContact CB-CE 3.84Å; K452-M721 HydrophobicContact CG-CE 4.1Å; K452-M721 HydrophobicContact CG-SD 4.4Å; E460-M721 HydrophobicContact CG-CG 4.17Å; M715-M721 HydrophobicContact CB-CB 4.35Å; M715-M721 HydrophobicContact CE-CG 4.38Å; M715-M721 HydrophobicContact CG-CB 3.76Å; M715-M721 HydrophobicContact CG-CG 4.44Å; M715-M721 HydrophobicContact SD-CB 3.98Å; M715-M721 HydrophobicContact SD-CG 4.01Å; S719-M721 PolarHBondContact O-N 3.16Å; S719-M721 VanDerWaalsContact O-N 3.14Å; S719-M721 WeakPolarHBondContact OG-CB 3.2Å; S719-M721 PolarHBondContact OG-N 3.4Å; M721-Y724 HydrophobicContact CE-CD1 4.46Å; M721-Y724 HydrophobicContact CE-CG 4.34Å; M721-Y724 PolarHBondContact O-N 3.49Å; M721-F725 HydrophobicContact CB-CD2 4.44Å; M721-F725 HydrophobicContact CB-CE2 4.35Å; M721-F725 WeakPolarHBondContact O-CB 3.33Å; M721-F725 WeakPolarHBondContact O-CD2 3.27Å; M721-F725 WeakPolarHBondContact O-CG 3.35Å; M721-F725 PolarHBondContact O-N 2.66Å
722	Q	91.3	Very high	89.9	Confident	43 Å²	43	45.3 Å²	45.3	20%	0.201	22%	0.219	C	C	.	.	H	α-helix	trans	-66.8	-43.2	175.4	-61.3	-68.5	-1.2	0	0	111	K712 M715 P716 S719 Y720 F725 H726	K712-Q722 PolarHBondContact O-NE2 3.19Å; M715-Q722 PolarHBondContact O-NE2 3.06Å; P716-Q722 VanDerWaalsContact O-CG 3.3Å; P716-Q722 WeakPolarHBondContact O-CG 3.37Å; P716-Q722 PolarHBondContact O-NE2 2.04Å; P716-Q722 VanDerWaalsContact O-NE2 3.11Å; S719-Q722 WeakPolarHBondContact O-CB 3.26Å; S719-Q722 PolarHBondContact O-N 3.39Å; Y720-Q722 VanDerWaalsContact C-N 3.28Å; Y720-Q722 PolarHBondContact O-N 2.85Å; Q722-F725 PolarHBondContact O-N 3.28Å; Q722-H726 WeakPolarHBondContact O-CB 3.43Å; Q722-H726 PolarHBondContact O-N 3.2Å
723	D	92.6	Very high	90	Very high	104 Å²	104	44.2 Å²	44.2	56%	0.556	22%	0.221	S	C	*	.	H	α-helix	trans	-64.5	-41.6	175.4	-70.6	-38	0	0	0	111.2	Y720 H726 A727	Y720-D723 PolarHBondContact O-N 3.13Å; D723-H726 PolarHBondContact O-N 2.84Å; D723-A727 WeakPolarHBondContact O-CB 3.12Å; D723-A727 PolarHBondContact O-N 3.28Å
724	Y	94.5	Very high	90.2	Very high	17 Å²	17	43 Å²	43	7%	0.067	22%	0.215	C	C	.	.	H	α-helix	trans	-59.4	-50	171.9	175	-95.4	0	0	0	112.3	Q256 I258 K452 Y720 M721 H726 A727 F728	Q256-Y724 PolarHBondContact OE1-OH 3.3Å; I258-Y724 HydrophobicContact CD1-CD2 4.17Å; I258-Y724 HydrophobicContact CD1-CE2 4.01Å; I258-Y724 HydrophobicContact CG1-CE2 4.45Å; K452-Y724 HydrophobicContact CB-CD1 4.1Å; K452-Y724 HydrophobicContact CB-CD2 3.86Å; K452-Y724 HydrophobicContact CB-CE1 3.9Å; K452-Y724 HydrophobicContact CB-CE2 3.63Å; K452-Y724 HydrophobicContact CB-CG 4.08Å; K452-Y724 HydrophobicContact CD-CE1 4.04Å; K452-Y724 HydrophobicContact CG-CE1 4.44Å; Y720-Y724 PolarHBondContact O-N 3.04Å; Y720-Y724 VanDerWaalsContact O-N 3.08Å; M721-Y724 HydrophobicContact CE-CD1 4.46Å; M721-Y724 HydrophobicContact CE-CG 4.34Å; M721-Y724 PolarHBondContact O-N 3.49Å; Y724-H726 VanDerWaalsContact C-N 3.29Å; Y724-H726 PolarHBondContact O-N 2.89Å; Y724-A727 PolarHBondContact O-N 3.14Å; Y724-F728 WeakPolarHBondContact O-CB 3.33Å; Y724-F728 PolarHBondContact O-N 2.8Å
725	F	92.3	Very high	90.7	Very high	22 Å²	22	42.7 Å²	42.7	10%	0.096	21%	0.214	C	C	.	.	H	α-helix	trans	-63.1	-33.6	177.7	-76.6	-56.6	0	0	0	112.7	E711 K712 M715 M721 Q722 N729	E711-F725 HydrophobicContact CB-CE1 4.22Å; E711-F725 HydrophobicContact CB-CE2 4.42Å; E711-F725 HydrophobicContact CB-CZ 3.74Å; K712-F725 HydrophobicContact CB-CD2 4.15Å; K712-F725 HydrophobicContact CB-CG 4.44Å; M715-F725 HydrophobicContact CE-CE2 4.22Å; M715-F725 HydrophobicContact CG-CE2 3.94Å; M721-F725 HydrophobicContact CB-CD2 4.44Å; M721-F725 HydrophobicContact CB-CE2 4.35Å; M721-F725 WeakPolarHBondContact O-CB 3.33Å; M721-F725 WeakPolarHBondContact O-CD2 3.27Å; M721-F725 WeakPolarHBondContact O-CG 3.35Å; M721-F725 PolarHBondContact O-N 2.66Å; Q722-F725 PolarHBondContact O-N 3.28Å; F725-N729 WeakPolarHBondContact O-CB 3.31Å; F725-N729 PolarHBondContact O-N 3.13Å; F725-N729 VanDerWaalsContact O-N 3.08Å; F725-N729 PolarHBondContact O-ND2 3.09Å
726	H	93.3	Very high	91	Very high	127 Å²	127	43.8 Å²	43.8	59%	0.588	22%	0.222	S	C	*	.	H	α-helix	trans	-69.8	-44.2	174.2	177.8	-103.1	0	0	0	112.1	Q722 D723 Y724 N729 K730	Q722-H726 WeakPolarHBondContact O-CB 3.43Å; Q722-H726 PolarHBondContact O-N 3.2Å; D723-H726 PolarHBondContact O-N 2.84Å; Y724-H726 VanDerWaalsContact C-N 3.29Å; Y724-H726 PolarHBondContact O-N 2.89Å; H726-N729 PolarHBondContact O-N 3Å; H726-K730 WeakPolarHBondContact O-CB 3.41Å; H726-K730 PolarHBondContact O-N 3.19Å
727	A	93.3	Very high	91.4	Very high	2 Å²	2	44 Å²	44	2%	0.017	22%	0.223	C	C	.	.	H	α-helix	trans	-63.6	-45.3	175.6	0	0	0	0	0	111.9	I258 D723 Y724 N729 K730 Y731	I258-A727 HydrophobicContact CB-CB 4.25Å; I258-A727 HydrophobicContact CD1-CB 3.84Å; I258-A727 HydrophobicContact CG2-CB 4.12Å; D723-A727 WeakPolarHBondContact O-CB 3.12Å; D723-A727 PolarHBondContact O-N 3.28Å; Y724-A727 PolarHBondContact O-N 3.14Å; A727-N729 PolarHBondContact O-N 3.37Å; A727-K730 PolarHBondContact O-N 2.98Å; A727-Y731 HydrophobicContact CB-CD2 4.1Å; A727-Y731 HydrophobicContact CB-CE2 4.4Å; A727-Y731 WeakPolarHBondContact O-CB 3.37Å; A727-Y731 VanDerWaalsContact O-CD2 3.3Å; A727-Y731 WeakPolarHBondContact O-CD2 3.47Å; A727-Y731 PolarHBondContact O-N 2.74Å
728	F	92.4	Very high	91.9	Very high	21 Å²	21	38.4 Å²	38.4	9%	0.092	20%	0.197	C	C	.	.	H	α-helix	trans	-52.5	-54	173.4	171.3	-89	0	0	0	111.5	I258 Y724 K730 L732 V891 L892	I258-F728 HydrophobicContact CD1-CB 4.24Å; Y724-F728 WeakPolarHBondContact O-CB 3.33Å; Y724-F728 PolarHBondContact O-N 2.8Å; F728-K730 PolarHBondContact O-N 2.9Å; F728-L732 HydrophobicContact CD2-CD2 3.78Å; F728-L732 HydrophobicContact CE2-CD2 3.96Å; F728-L732 PolarHBondContact O-N 3.05Å; F728-V891 HydrophobicContact CE1-CG1 4.28Å; F728-V891 HydrophobicContact CZ-CG1 4.43Å; F728-L892 WeakPolarHBondContact CE1-O 3.35Å
729	N	91	Very high	92.3	Very high	41 Å²	41	34 Å²	34	22%	0.219	17%	0.171	C	C	.	.	H	α-helix	trans	-65.9	-20.5	-178.5	-85.5	-68.1	0	0	0	114.2	F725 H726 A727 K893	F725-N729 WeakPolarHBondContact O-CB 3.31Å; F725-N729 PolarHBondContact O-N 3.13Å; F725-N729 VanDerWaalsContact O-N 3.08Å; F725-N729 PolarHBondContact O-ND2 3.09Å; H726-N729 PolarHBondContact O-N 3Å; A727-N729 PolarHBondContact O-N 3.37Å; N729-K893 PolarHBondContact O-NZ 3.39Å; N729-K893 WeakPolarHBondContact OD1-CA 2.97Å; N729-K893 WeakPolarHBondContact OD1-CB 3.44Å; N729-K893 WeakPolarHBondContact OD1-CD 3.49Å; N729-K893 WeakPolarHBondContact OD1-CG 3.3Å
730	K	92	Very high	92.6	Very high	119 Å²	119	33.9 Å²	33.9	52%	0.517	17%	0.17	S	C	.	.	H	α-helix	trans	-97.6	-39.2	-177.5	-174.1	-178.3	171.6	-159.5	0	113.5	H726 A727 F728	H726-K730 WeakPolarHBondContact O-CB 3.41Å; H726-K730 PolarHBondContact O-N 3.19Å; A727-K730 PolarHBondContact O-N 2.98Å; F728-K730 PolarHBondContact O-N 2.9Å
731	Y	93.2	Very high	92.8	Very high	27 Å²	27	32.1 Å²	32.1	11%	0.106	16%	0.164	C	C	.	.	H	α-helix	trans	-114	-31.8	-165.1	-59.1	-64.4	0	0	0	115.4	I258 V260 G397 G398 A409 A727	I258-Y731 HydrophobicContact CG2-CD2 4.09Å; V260-Y731 HydrophobicContact CG2-CD2 4.06Å; V260-Y731 HydrophobicContact CG2-CE2 3.56Å; G397-Y731 CarbonylContact C-O 3.54Å; G397-Y731 VanDerWaalsContact C-O 3.3Å; G397-Y731 WeakPolarHBondContact CA-O 3.33Å; G398-Y731 PolarHBondContact N-O 2.71Å; A409-Y731 HydrophobicContact CB-CD1 3.9Å; A409-Y731 HydrophobicContact CB-CD2 4.23Å; A409-Y731 HydrophobicContact CB-CG 3.74Å; A727-Y731 HydrophobicContact CB-CD2 4.1Å; A727-Y731 HydrophobicContact CB-CE2 4.4Å; A727-Y731 WeakPolarHBondContact O-CB 3.37Å; A727-Y731 VanDerWaalsContact O-CD2 3.3Å; A727-Y731 WeakPolarHBondContact O-CD2 3.47Å; A727-Y731 PolarHBondContact O-N 2.74Å
732	L	91	Very high	92.8	Very high	28 Å²	28	32.1 Å²	32.1	15%	0.147	16%	0.164	C	C	.	.			trans	-65.7	145.4	-177.6	-100.9	68.6	0	0	0	111.5	I258 V411 F728 V891	I258-L732 HydrophobicContact CD1-CD1 3.56Å; I258-L732 HydrophobicContact CG1-CD1 3.84Å; V411-L732 HydrophobicContact CG2-CD1 3.85Å; F728-L732 HydrophobicContact CD2-CD2 3.78Å; F728-L732 HydrophobicContact CE2-CD2 3.96Å; F728-L732 PolarHBondContact O-N 3.05Å; L732-V891 VanDerWaalsContact O-CG2 3.24Å; L732-V891 WeakPolarHBondContact O-CG2 3.37Å
733	A	87.1	Confident	92.8	Very high	36 Å²	36	33 Å²	33	30%	0.298	17%	0.168	S	C	.	.	S	Bend	trans	-98.2	-28.6	178.7	0	0	0	0	0	113.3	F399 V891	F399-A733 HydrophobicContact CE1-CB 3.81Å; F399-A733 HydrophobicContact CE2-CB 4.05Å; F399-A733 HydrophobicContact CZ-CB 3.32Å; A733-V891 WeakPolarHBondContact O-CG2 3.34Å
734	V	89.8	Confident	92.3	Very high	15 Å²	15	29.6 Å²	29.6	9%	0.091	16%	0.157	C	C	.	.			trans	-121.3	157.6	175.8	-62.9	0	0	0	0	111.5	Y393 V394 A785 Y888	Y393-V734 HydrophobicContact CD2-CG1 3.58Å; Y393-V734 HydrophobicContact CD2-CG2 4.14Å; Y393-V734 HydrophobicContact CE2-CG1 4.29Å; Y393-V734 HydrophobicContact CG-CG1 4.23Å; V394-V734 HydrophobicContact CG1-CG2 4.16Å; V734-A785 HydrophobicContact CG1-CB 4.13Å; V734-Y888 HydrophobicContact CB-CG 4.48Å; V734-Y888 HydrophobicContact CG2-CD1 4.12Å; V734-Y888 HydrophobicContact CG2-CG 4.43Å
735	G	91.7	Very high	91.7	Very high	10 Å²	10	35.2 Å²	35.2	10%	0.103	19%	0.188	C	C	.	.			trans	-95.1	-160.2	172	0	0	0	0	0	112.5	H889 S890	G735-H889 PolarHBondContact N-O 3.08Å; G735-S890 WeakPolarHBondContact CA-O 3.07Å
736	P	92.8	Very high	91.5	Very high	25 Å²	25	34.8 Å²	34.8	16%	0.162	19%	0.186	C	C	.	.			trans	-64.1	152	179.1	27.5	-36.1	0	0	0	112.7	H889 L892 F933	P736-H889 WeakPolarHBondContact O-CB 3.37Å; P736-H889 PolarHBondContact O-N 3.44Å; P736-L892 HydrophobicContact CG-CD1 4.05Å; P736-F933 HydrophobicContact CB-CD1 4.3Å; P736-F933 HydrophobicContact CB-CE1 4.35Å; P736-F933 HydrophobicContact CG-CD1 3.68Å; P736-F933 HydrophobicContact CG-CE1 3.45Å; P736-F933 VanDerWaalsContact CG-CE1 3.45Å; P736-F933 HydrophobicContact CG-CZ 4.5Å
737	P	93.9	Very high	91.2	Very high	11 Å²	11	31.4 Å²	31.4	7%	0.071	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	153.8	173.8	29.3	-35.2	0	0	0	111.9	F251 Y739 T887 Y888 S931	F251-P737 HydrophobicContact CE2-CG 3.54Å; F251-P737 HydrophobicContact CZ-CG 3.6Å; P737-Y739 HydrophobicContact CB-CE2 4.13Å; P737-Y739 HydrophobicContact CG-CE2 4.27Å; P737-T887 CarbonylContact C-O 3.6Å; P737-T887 WeakPolarHBondContact CA-O 3.29Å; P737-Y888 HydrophobicContact CB-CD1 4.2Å; P737-Y888 HydrophobicContact CB-CE1 4.11Å; P737-S931 VanDerWaalsContact O-CB 3.3Å; P737-S931 WeakPolarHBondContact O-CB 3.12Å; P737-S931 PolarHBondContact O-OG 2.8Å
738	V	95.2	Very high	91	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	135.7	173.3	57.4	0	0	0	0	110	F740 I784 T887 P929 Y930 Y934	V738-F740 HydrophobicContact CG1-CE2 4.38Å; V738-I784 HydrophobicContact CG1-CD1 3.97Å; V738-T887 HydrophobicContact CG1-CG2 3.63Å; V738-T887 PolarHBondContact N-O 3.19Å; V738-T887 PolarHBondContact O-N 2.56Å; V738-P929 HydrophobicContact CG2-CB 4.04Å; V738-Y930 CarbonylContact C-O 3.42Å; V738-Y930 WeakPolarHBondContact CA-O 3.38Å; V738-Y934 VanDerWaalsContact CG2-OH 3.26Å; V738-Y934 WeakPolarHBondContact CG2-OH 3.47Å
739	Y	95.8	Very high	90.7	Very high	26 Å²	26	31.9 Å²	31.9	10%	0.102	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	115.5	-176.6	-59.4	-90.6	0	0	0	109.3	F244 F251 P737 V741 F885 A886 P929 Y930	F244-Y739 HydrophobicContact CE2-CD1 4.17Å; F244-Y739 HydrophobicContact CE2-CD2 4.09Å; F244-Y739 AromaticContact CE2-CG 3.78Å; F244-Y739 HydrophobicContact CE2-CG 3.78Å; F244-Y739 HydrophobicContact CZ-CD1 4.34Å; F244-Y739 HydrophobicContact CZ-CD2 4.19Å; F244-Y739 HydrophobicContact CZ-CE2 4.42Å; F244-Y739 HydrophobicContact CZ-CG 4.16Å; F251-Y739 AromaticContact CD2-CE2 3.86Å; F251-Y739 HydrophobicContact CD2-CE2 3.86Å; F251-Y739 AromaticContact CE2-CE2 3.81Å; F251-Y739 HydrophobicContact CE2-CE2 3.81Å; P737-Y739 HydrophobicContact CB-CE2 4.13Å; P737-Y739 HydrophobicContact CG-CE2 4.27Å; Y739-V741 PolarHBondContact O-N 3.18Å; Y739-F885 CarbonylContact C-O 3.22Å; Y739-F885 WeakPolarHBondContact CA-O 3.41Å; Y739-A886 HydrophobicContact CD1-CB 3.77Å; Y739-A886 HydrophobicContact CE1-CB 3.74Å; Y739-P929 CarbonylContact O-C 3.38Å; Y739-P929 WeakPolarHBondContact O-CA 3.19Å; Y739-Y930 HydrophobicContact CD2-CD1 4.1Å; Y739-Y930 PolarHBondContact N-O 3.18Å; Y739-Y930 PolarHBondContact O-N 3.3Å
740	F	96.4	Very high	90.6	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	104.1	169.1	-68.4	-86.8	0	0	0	108.3	V738 V772 I784 V788 N884 F885 T887 I908 A909 I912 V927 P929	V738-F740 HydrophobicContact CG1-CE2 4.38Å; F740-V772 HydrophobicContact CD2-CG2 4.01Å; F740-V772 HydrophobicContact CE1-CG2 4.4Å; F740-V772 HydrophobicContact CE2-CG1 3.89Å; F740-V772 HydrophobicContact CE2-CG2 3.79Å; F740-V772 HydrophobicContact CG-CG2 4.4Å; F740-V772 HydrophobicContact CZ-CG1 4.47Å; F740-V772 HydrophobicContact CZ-CG2 4Å; F740-I784 HydrophobicContact CZ-CD1 4.49Å; F740-V788 HydrophobicContact CD2-CG2 4.44Å; F740-N884 WeakPolarHBondContact O-CA 3.41Å; F740-F885 HydrophobicContact CB-CB 4.29Å; F740-F885 PolarHBondContact N-O 3.22Å; F740-F885 PolarHBondContact O-N 3.36Å; F740-T887 HydrophobicContact CD2-CG2 4.37Å; F740-T887 HydrophobicContact CE2-CG2 3.93Å; F740-I908 HydrophobicContact CE1-CB 4.19Å; F740-I908 HydrophobicContact CE1-CG2 3.69Å; F740-I908 HydrophobicContact CZ-CB 4.46Å; F740-I908 HydrophobicContact CZ-CG2 3.91Å; F740-A909 HydrophobicContact CD1-CB 4.24Å; F740-A909 HydrophobicContact CE1-CB 4.28Å; F740-I912 HydrophobicContact CD1-CD1 4.48Å; F740-V927 HydrophobicContact CB-CG1 4.35Å; F740-V927 HydrophobicContact CD1-CG1 4.48Å; F740-P929 HydrophobicContact CD1-CB 4.23Å; F740-P929 HydrophobicContact CE1-CB 4.06Å
741	V	95.8	Very high	90.3	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	127.1	-178.3	-178.9	0	0	0	0	109.4	F243 F244 F248 Y739 N884 V927 F928	F243-V741 HydrophobicContact CD1-CG1 4.15Å; F243-V741 HydrophobicContact CE1-CG1 3.88Å; F244-V741 HydrophobicContact CD2-CG2 3.89Å; F244-V741 HydrophobicContact CE2-CG2 4.46Å; F248-V741 HydrophobicContact CE2-CG1 3.85Å; F248-V741 HydrophobicContact CE2-CG2 4.36Å; F248-V741 HydrophobicContact CZ-CG1 4.43Å; Y739-V741 PolarHBondContact O-N 3.18Å; V741-N884 HydrophobicContact CG2-CB 4.12Å; V741-V927 VanDerWaalsContact O-CA 3.3Å; V741-V927 WeakPolarHBondContact O-CA 3.43Å; V741-F928 HydrophobicContact CB-CD1 4.22Å; V741-F928 HydrophobicContact CB-CD2 4.25Å; V741-F928 HydrophobicContact CB-CE1 3.87Å; V741-F928 HydrophobicContact CB-CE2 3.9Å; V741-F928 HydrophobicContact CB-CG 4.41Å; V741-F928 HydrophobicContact CB-CZ 3.71Å; V741-F928 HydrophobicContact CG1-CD1 4.45Å; V741-F928 HydrophobicContact CG1-CE1 3.73Å; V741-F928 HydrophobicContact CG1-CE2 4.38Å; V741-F928 HydrophobicContact CG1-CZ 3.7Å; V741-F928 HydrophobicContact CG2-CD2 4.44Å; V741-F928 HydrophobicContact CG2-CE2 3.88Å; V741-F928 HydrophobicContact CG2-CZ 4Å; V741-F928 PolarHBondContact N-O 3.47Å; V741-F928 PolarHBondContact O-N 2.6Å
742	V	94.4	Very high	90	Very high	1 Å²	1	35.5 Å²	35.5	1%	0.006	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	118.9	169.9	-173.3	0	0	0	0	108.7	Y748 I757 L768 S883 F885 V925 V927	V742-Y748 WeakPolarHBondContact CB-OH 3.47Å; V742-Y748 WeakPolarHBondContact CG1-OH 3.49Å; V742-I757 HydrophobicContact CG2-CD1 4.46Å; V742-L768 HydrophobicContact CG2-CD1 3.69Å; V742-S883 PolarHBondContact N-O 2.9Å; V742-F885 HydrophobicContact CG2-CD2 4.14Å; V742-F885 HydrophobicContact CG2-CE2 3.93Å; V742-V925 HydrophobicContact CG1-CG1 3.76Å; V742-V927 HydrophobicContact CG2-CG2 4.16Å
743	Q	90.1	Very high	89.9	Confident	62 Å²	62	37 Å²	37	29%	0.29	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	129.5	-177.7	177.4	-177.4	13.7	0	0	111	F243 Q926 F928	F243-Q743 HydrophobicContact CD2-CG 4.44Å; F243-Q743 HydrophobicContact CE1-CB 4.4Å; F243-Q743 HydrophobicContact CE1-CG 4.36Å; F243-Q743 HydrophobicContact CE2-CG 3.76Å; F243-Q743 HydrophobicContact CZ-CB 4.15Å; F243-Q743 HydrophobicContact CZ-CG 3.72Å; Q743-Q926 PolarHBondContact N-O 2.84Å; Q743-Q926 PolarHBondContact O-N 3.06Å; Q743-F928 HydrophobicContact CB-CD1 4.47Å; Q743-F928 HydrophobicContact CB-CE1 4.16Å
744	G	82.9	Confident	90	Very high	31 Å²	31	35.3 Å²	35.3	32%	0.32	19%	0.191	S	C	.	.	S	Bend	trans	125.3	176.3	176	0	0	0	0	0	111.9	Y746	G744-Y746 VanDerWaalsContact C-N 3.27Å; G744-Y746 PolarHBondContact O-N 3.21Å
745	D	82.4	Confident	90	Very high	136 Å²	136	36.4 Å²	36.4	73%	0.727	20%	0.196	S	C	*	.			trans	-73.7	82.4	177.3	-167.4	5.5	0	0	0	110.1
746	Y	86.9	Confident	89.9	Confident	13 Å²	13	37.7 Å²	37.7	5%	0.051	20%	0.198	C	C	.	.			trans	-102.4	110	174.5	-160	-102.3	0	0	0	110.1	G744 Y748 K753 I757 I916 V925	G744-Y746 VanDerWaalsContact C-N 3.27Å; G744-Y746 PolarHBondContact O-N 3.21Å; Y746-Y748 HydrophobicContact CD1-CD1 4.11Å; Y746-Y748 AromaticContact CD1-CD2 3.94Å; Y746-Y748 HydrophobicContact CD1-CD2 3.94Å; Y746-Y748 AromaticContact CD1-CE1 3.95Å; Y746-Y748 HydrophobicContact CD1-CE1 3.95Å; Y746-Y748 AromaticContact CD1-CE2 3.77Å; Y746-Y748 HydrophobicContact CD1-CE2 3.77Å; Y746-Y748 HydrophobicContact CD1-CG 4.09Å; Y746-Y748 AromaticContact CD1-CZ 3.77Å; Y746-Y748 HydrophobicContact CE1-CD1 4.42Å; Y746-Y748 HydrophobicContact CE1-CE1 4.39Å; Y746-Y748 HydrophobicContact CG-CE2 4.34Å; Y746-Y748 WeakPolarHBondContact O-CD2 2.93Å; Y746-Y748 WeakPolarHBondContact O-CE2 3.3Å; Y746-Y748 PolarHBondContact O-N 3.48Å; Y746-Y748 VanDerWaalsContact O-N 3.13Å; Y746-K753 HydrophobicContact CE1-CB 3.83Å; Y746-K753 HydrophobicContact CE2-CB 4.31Å; Y746-K753 HydrophobicContact CE2-CG 4.44Å; Y746-K753 VanDerWaalsContact OH-C 3.29Å; Y746-K753 VanDerWaalsContact OH-CA 3.29Å; Y746-K753 WeakPolarHBondContact OH-CA 3.47Å; Y746-K753 WeakPolarHBondContact OH-CB 3.48Å; Y746-K753 PolarHBondContact OH-O 3.03Å; Y746-I757 HydrophobicContact CD1-CD1 3.73Å; Y746-I757 HydrophobicContact CE1-CD1 3.29Å; Y746-I757 HydrophobicContact CE1-CG1 4.04Å; Y746-I916 HydrophobicContact CD2-CG2 4.2Å; Y746-I916 HydrophobicContact CE2-CG2 3.68Å; Y746-V925 HydrophobicContact CD2-CB 4.22Å; Y746-V925 HydrophobicContact CD2-CG1 3.91Å; Y746-V925 HydrophobicContact CD2-CG2 3.99Å; Y746-V925 HydrophobicContact CG-CG1 4.34Å
747	D	87.2	Confident	89.9	Confident	56 Å²	56	36.5 Å²	36.5	30%	0.299	19%	0.191	S	C	.	.			trans	-77.8	96.8	177.3	161	31.8	0	0	0	110.5	S749 K753	D747-S749 PolarHBondContact O-N 3.08Å; D747-S749 WeakPolarHBondContact OD1-CA 3.4Å; D747-S749 VanDerWaalsContact OD1-CB 3.31Å; D747-S749 WeakPolarHBondContact OD1-CB 3.34Å; D747-S749 PolarHBondContact OD1-N 3.33Å; D747-S749 PolarHBondContact OD1-OG 2.76Å; D747-K753 HydrophobicContact CB-CD 3.97Å; D747-K753 WeakPolarHBondContact O-CB 3.42Å; D747-K753 WeakPolarHBondContact O-CD 3.3Å; D747-K753 IonicContact OD2-NZ 2.76Å; D747-K753 PolarHBondContact OD2-NZ 2.96Å
748	Y	89.2	Confident	89.8	Confident	7 Å²	7	36 Å²	36	3%	0.027	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71	-4.9	175.9	-67.5	-97.5	0	0	0	113.7	V742 Y746 Q754 I757 W791 V880 S883	V742-Y748 WeakPolarHBondContact CB-OH 3.47Å; V742-Y748 WeakPolarHBondContact CG1-OH 3.49Å; Y746-Y748 HydrophobicContact CD1-CD1 4.11Å; Y746-Y748 AromaticContact CD1-CD2 3.94Å; Y746-Y748 HydrophobicContact CD1-CD2 3.94Å; Y746-Y748 AromaticContact CD1-CE1 3.95Å; Y746-Y748 HydrophobicContact CD1-CE1 3.95Å; Y746-Y748 AromaticContact CD1-CE2 3.77Å; Y746-Y748 HydrophobicContact CD1-CE2 3.77Å; Y746-Y748 HydrophobicContact CD1-CG 4.09Å; Y746-Y748 AromaticContact CD1-CZ 3.77Å; Y746-Y748 HydrophobicContact CE1-CD1 4.42Å; Y746-Y748 HydrophobicContact CE1-CE1 4.39Å; Y746-Y748 HydrophobicContact CG-CE2 4.34Å; Y746-Y748 WeakPolarHBondContact O-CD2 2.93Å; Y746-Y748 WeakPolarHBondContact O-CE2 3.3Å; Y746-Y748 PolarHBondContact O-N 3.48Å; Y746-Y748 VanDerWaalsContact O-N 3.13Å; Y748-Q754 WeakPolarHBondContact O-CG 3.39Å; Y748-Q754 PolarHBondContact O-NE2 2.92Å; Y748-I757 HydrophobicContact CD1-CD1 4.27Å; Y748-I757 HydrophobicContact CE1-CD1 3.48Å; Y748-I757 VanDerWaalsContact CE1-CD1 3.48Å; Y748-W791 AromaticContact CD1-CH2 3.71Å; Y748-W791 HydrophobicContact CD1-CH2 3.71Å; Y748-W791 AromaticContact CD1-CZ2 3.68Å; Y748-W791 HydrophobicContact CD1-CZ2 3.68Å; Y748-W791 HydrophobicContact CE1-CH2 4.07Å; Y748-W791 AromaticContact CE1-CZ2 3.53Å; Y748-W791 HydrophobicContact CE1-CZ2 3.53Å; Y748-W791 HydrophobicContact CG-CH2 4.14Å; Y748-W791 HydrophobicContact CG-CZ2 4.37Å; Y748-V880 HydrophobicContact CD2-CB 3.6Å; Y748-V880 HydrophobicContact CD2-CG1 3.82Å; Y748-V880 HydrophobicContact CD2-CG2 4.23Å; Y748-V880 HydrophobicContact CE2-CB 3.89Å; Y748-V880 HydrophobicContact CE2-CG1 3.55Å; Y748-V880 HydrophobicContact CG-CB 4.36Å; Y748-S883 PolarHBondContact OH-OG 3.47Å; Y748-S883 VanDerWaalsContact OH-OG 3.06Å
749	S	86.8	Confident	89.4	Confident	26 Å²	26	36.1 Å²	36.1	18%	0.182	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-22.4	-178.2	80.5	0	0	0	0	113.5	D747 P751 Q754	D747-S749 PolarHBondContact O-N 3.08Å; D747-S749 WeakPolarHBondContact OD1-CA 3.4Å; D747-S749 VanDerWaalsContact OD1-CB 3.31Å; D747-S749 WeakPolarHBondContact OD1-CB 3.34Å; D747-S749 PolarHBondContact OD1-N 3.33Å; D747-S749 PolarHBondContact OD1-OG 2.76Å; S749-P751 WeakPolarHBondContact O-CD 3.35Å; S749-Q754 PolarHBondContact O-NE2 3.19Å
750	D	88.1	Confident	88.8	Confident	47 Å²	47	35.5 Å²	35.5	25%	0.251	19%	0.189	S	C	.	.	S	Bend	trans	-77.5	119.2	174.9	175.6	2.8	0	0	0	111.3	K752 K753 Q754	D750-K752 PolarHBondContact O-N 3.23Å; D750-K752 VanDerWaalsContact O-N 3.09Å; D750-K752 WeakPolarHBondContact OD1-CB 3.49Å; D750-K752 PolarHBondContact OD1-N 3.11Å; D750-K753 HydrophobicContact CB-CB 4.17Å; D750-K753 HydrophobicContact CB-CD 3.89Å; D750-K753 HydrophobicContact CB-CG 4.06Å; D750-K753 WeakPolarHBondContact O-CA 3.49Å; D750-K753 WeakPolarHBondContact O-CB 3.46Å; D750-K753 PolarHBondContact O-N 3.13Å; D750-K753 VanDerWaalsContact OD2-CE 3.29Å; D750-K753 WeakPolarHBondContact OD2-CE 3.38Å; D750-K753 IonicContact OD2-NZ 3.63Å; D750-Q754 WeakPolarHBondContact O-CG 3.28Å; D750-Q754 PolarHBondContact O-N 2.8Å
751	P	86.2	Confident	88.2	Confident	55 Å²	55	37.4 Å²	37.4	36%	0.357	20%	0.2	S	C	.	.	H	α-helix	trans	-53.6	-29.7	176.7	-29.8	38.2	0	0	0	115.1	S749 K753 Q754 N755 R838	S749-P751 WeakPolarHBondContact O-CD 3.35Å; P751-K753 VanDerWaalsContact C-N 3.33Å; P751-Q754 PolarHBondContact O-N 3.22Å; P751-N755 PolarHBondContact O-N 3.43Å; P751-N755 VanDerWaalsContact O-N 3.16Å; P751-N755 PolarHBondContact O-OD1 2.81Å; P751-R838 HydrophobicContact CB-CG 4.33Å
752	K	86.8	Confident	87.5	Confident	161 Å²	161	38.4 Å²	38.4	70%	0.7	21%	0.211	S	C	*	.	H	α-helix	trans	-71.8	-28.5	176.5	-63.9	178.6	179.3	176.6	0	112.6	D750	D750-K752 PolarHBondContact O-N 3.23Å; D750-K752 VanDerWaalsContact O-N 3.09Å; D750-K752 WeakPolarHBondContact OD1-CB 3.49Å; D750-K752 PolarHBondContact OD1-N 3.11Å
753	K	88.7	Confident	87.2	Confident	60 Å²	60	39.3 Å²	39.3	26%	0.261	22%	0.217	S	C	.	.	H	α-helix	trans	-83.3	-35	175	-67	175.4	-158.8	157.7	0	110.7	Y746 D747 D750 P751 N755 K756	Y746-K753 HydrophobicContact CE1-CB 3.83Å; Y746-K753 HydrophobicContact CE2-CB 4.31Å; Y746-K753 HydrophobicContact CE2-CG 4.44Å; Y746-K753 VanDerWaalsContact OH-C 3.29Å; Y746-K753 VanDerWaalsContact OH-CA 3.29Å; Y746-K753 WeakPolarHBondContact OH-CA 3.47Å; Y746-K753 WeakPolarHBondContact OH-CB 3.48Å; Y746-K753 PolarHBondContact OH-O 3.03Å; D747-K753 HydrophobicContact CB-CD 3.97Å; D747-K753 WeakPolarHBondContact O-CB 3.42Å; D747-K753 WeakPolarHBondContact O-CD 3.3Å; D747-K753 IonicContact OD2-NZ 2.76Å; D747-K753 PolarHBondContact OD2-NZ 2.96Å; D750-K753 HydrophobicContact CB-CB 4.17Å; D750-K753 HydrophobicContact CB-CD 3.89Å; D750-K753 HydrophobicContact CB-CG 4.06Å; D750-K753 WeakPolarHBondContact O-CA 3.49Å; D750-K753 WeakPolarHBondContact O-CB 3.46Å; D750-K753 PolarHBondContact O-N 3.13Å; D750-K753 VanDerWaalsContact OD2-CE 3.29Å; D750-K753 WeakPolarHBondContact OD2-CE 3.38Å; D750-K753 IonicContact OD2-NZ 3.63Å; P751-K753 VanDerWaalsContact C-N 3.33Å; K753-N755 VanDerWaalsContact C-N 3.32Å; K753-N755 PolarHBondContact O-N 2.91Å; K753-K756 PolarHBondContact O-N 3.29Å
754	Q	89.7	Confident	87	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-55.3	-47.1	171.3	-68.6	168.3	3.1	0	0	111.5	Y748 S749 D750 P751 K756 I757 C758 F796	Y748-Q754 WeakPolarHBondContact O-CG 3.39Å; Y748-Q754 PolarHBondContact O-NE2 2.92Å; S749-Q754 PolarHBondContact O-NE2 3.19Å; D750-Q754 WeakPolarHBondContact O-CG 3.28Å; D750-Q754 PolarHBondContact O-N 2.8Å; P751-Q754 PolarHBondContact O-N 3.22Å; Q754-K756 PolarHBondContact O-N 3.46Å; Q754-I757 PolarHBondContact O-N 3.18Å; Q754-C758 PolarHBondContact O-N 3.18Å; Q754-C758 VanDerWaalsContact O-N 3.08Å; Q754-C758 PolarHBondContact O-SG 3.35Å; Q754-F796 HydrophobicContact CB-CZ 3.9Å; Q754-F796 HydrophobicContact CG-CZ 3.84Å
755	N	89.3	Confident	87	Confident	37 Å²	37	41.2 Å²	41.2	20%	0.198	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-30.5	-179.2	-78.9	5.1	0	0	0	115	P751 K753 I757 G762 D764 S767 R838	P751-N755 PolarHBondContact O-N 3.43Å; P751-N755 VanDerWaalsContact O-N 3.16Å; P751-N755 PolarHBondContact O-OD1 2.81Å; K753-N755 VanDerWaalsContact C-N 3.32Å; K753-N755 PolarHBondContact O-N 2.91Å; N755-I757 VanDerWaalsContact C-N 3.27Å; N755-I757 PolarHBondContact O-N 3.35Å; N755-G762 PolarHBondContact ND2-O 3.43Å; N755-G762 PolarHBondContact OD1-O 2.79Å; N755-D764 PolarHBondContact O-N 3.31Å; N755-S767 WeakPolarHBondContact O-CB 3.19Å; N755-R838 PolarHBondContact OD1-NE 3.15Å; N755-R838 PolarHBondContact OD1-NH2 3.04Å
756	K	90.1	Very high	87.1	Confident	37 Å²	37	38.4 Å²	38.4	16%	0.161	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-4.3	177.1	-60.8	-161.4	-178.8	-168.9	0	114.8	K753 Q754 D764 S767 L768 A915 I916 V918	K753-K756 PolarHBondContact O-N 3.29Å; Q754-K756 PolarHBondContact O-N 3.46Å; K756-D764 WeakPolarHBondContact CG-OD2 3.41Å; K756-S767 CarbonylContact O-C 3.54Å; K756-S767 WeakPolarHBondContact O-CA 3.41Å; K756-S767 WeakPolarHBondContact O-CB 3.42Å; K756-L768 PolarHBondContact O-N 2.89Å; K756-A915 PolarHBondContact NZ-O 2.83Å; K756-I916 HydrophobicContact CB-CG1 4.37Å; K756-I916 PolarHBondContact NZ-O 3.19Å; K756-V918 PolarHBondContact NZ-O 3.06Å
757	I	92.1	Very high	87.3	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117	-43.3	179.7	-68.1	-173.7	0	0	0	111.7	V742 Y746 Y748 Q754 N755 L768 Y769 L792 F885 I916	V742-I757 HydrophobicContact CG2-CD1 4.46Å; Y746-I757 HydrophobicContact CD1-CD1 3.73Å; Y746-I757 HydrophobicContact CE1-CD1 3.29Å; Y746-I757 HydrophobicContact CE1-CG1 4.04Å; Y748-I757 HydrophobicContact CD1-CD1 4.27Å; Y748-I757 HydrophobicContact CE1-CD1 3.48Å; Y748-I757 VanDerWaalsContact CE1-CD1 3.48Å; Q754-I757 PolarHBondContact O-N 3.18Å; N755-I757 VanDerWaalsContact C-N 3.27Å; N755-I757 PolarHBondContact O-N 3.35Å; I757-L768 HydrophobicContact CB-CB 4.47Å; I757-L768 HydrophobicContact CG1-CB 4.46Å; I757-L768 HydrophobicContact CG2-CB 4.37Å; I757-Y769 WeakPolarHBondContact O-CB 3.39Å; I757-Y769 PolarHBondContact O-N 2.79Å; I757-Y769 VanDerWaalsContact O-N 3.1Å; I757-L792 HydrophobicContact CB-CD2 3.98Å; I757-L792 HydrophobicContact CG2-CD2 3.77Å; I757-F885 HydrophobicContact CG2-CE1 4.01Å; I757-F885 HydrophobicContact CG2-CE2 3.84Å; I757-F885 HydrophobicContact CG2-CZ 3.32Å; I757-I916 HydrophobicContact CG1-CD1 4.44Å
758	C	91.2	Very high	87.6	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.188	C	C	.	.			trans	-71.8	164.8	-170.9	63.5	0	0	0	0	114.8	Q754 C763 S767 L792 D793 F796 R838	Q754-C758 PolarHBondContact O-N 3.18Å; Q754-C758 VanDerWaalsContact O-N 3.08Å; Q754-C758 PolarHBondContact O-SG 3.35Å; C758-C763 HydrophobicContact CB-CB 4.21Å; C758-C763 WeakPolarHBondContact CB-SG 3.43Å; C758-C763 WeakPolarHBondContact O-CB 3.26Å; C758-C763 PolarHBondContact O-SG 3.06Å; C758-C763 WeakPolarHBondContact SG-CB 3.41Å; C758-C763 CovalentContact SG-SG 2.03Å; C758-C763 PolarHBondContact SG-SG 2.94Å; C758-S767 VanDerWaalsContact O-CB 3.32Å; C758-S767 WeakPolarHBondContact O-CB 3.39Å; C758-S767 PolarHBondContact O-OG 2.89Å; C758-L792 HydrophobicContact CB-CD2 4.06Å; C758-L792 HydrophobicContact CB-CG 4.46Å; C758-D793 WeakPolarHBondContact CA-OD2 3.36Å; C758-D793 WeakPolarHBondContact CB-OD1 3.07Å; C758-F796 HydrophobicContact CB-CE2 4.12Å; C758-R838 PolarHBondContact SG-NH2 2.61Å
759	G	86.9	Confident	87.7	Confident	4 Å²	4	36.9 Å²	36.9	4%	0.041	20%	0.195	C	C	.	.			trans	-106.3	-20.9	176.1	0	0	0	0	0	115.5	S79 Q81 D793	S79-G759 WeakPolarHBondContact CB-O 3.01Å; S79-G759 PolarHBondContact OG-O 3.32Å; Q81-G759 VanDerWaalsContact OE1-C 3.28Å; Q81-G759 PolarHBondContact OE1-O 2.85Å; G759-D793 PolarHBondContact N-OD1 3.16Å; G759-D793 VanDerWaalsContact N-OD1 3.14Å; G759-D793 PolarHBondContact N-OD2 2.86Å
760	S	83.4	Confident	87.8	Confident	13 Å²	13	35.8 Å²	35.8	9%	0.091	19%	0.187	C	C	.	.	S	Bend	trans	-61.4	173.2	-177	49.9	0	0	0	0	115.6	G762 C763 D793 R838	S760-G762 PolarHBondContact O-N 2.68Å; S760-C763 PolarHBondContact N-SG 2.96Å; S760-C763 VanDerWaalsContact N-SG 3.35Å; S760-C763 WeakPolarHBondContact O-CB 3.29Å; S760-C763 PolarHBondContact O-N 2.99Å; S760-C763 VanDerWaalsContact O-N 3.09Å; S760-C763 PolarHBondContact O-SG 3.29Å; S760-C763 PolarHBondContact OG-SG 3.1Å; S760-C763 VanDerWaalsContact OG-SG 3.42Å; S760-D793 WeakPolarHBondContact CB-OD1 3.41Å; S760-D793 PolarHBondContact N-OD1 3.09Å; S760-D793 PolarHBondContact OG-OD1 3.38Å; S760-R838 PolarHBondContact OG-NH1 3.49Å
761	T	83.7	Confident	87.9	Confident	39 Å²	39	34.5 Å²	34.5	24%	0.239	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-42.9	126.1	171.7	51.3	0	0	0	0	112.3	R838	T761-R838 PolarHBondContact O-NH2 3.06Å
762	G	82.3	Confident	88.2	Confident	22 Å²	22	31.9 Å²	31.9	23%	0.227	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.8	4	177.5	0	0	0	0	0	116.5	N755 S760	N755-G762 PolarHBondContact ND2-O 3.43Å; N755-G762 PolarHBondContact OD1-O 2.79Å; S760-G762 PolarHBondContact O-N 2.68Å
763	C	87.2	Confident	88.3	Confident	20 Å²	20	26.5 Å²	26.5	14%	0.135	14%	0.138	C	C	.	.			trans	-74.4	160	165.1	-50.2	0	0	0	0	111	C758 S760 R838	C758-C763 HydrophobicContact CB-CB 4.21Å; C758-C763 WeakPolarHBondContact CB-SG 3.43Å; C758-C763 WeakPolarHBondContact O-CB 3.26Å; C758-C763 PolarHBondContact O-SG 3.06Å; C758-C763 WeakPolarHBondContact SG-CB 3.41Å; C758-C763 CovalentContact SG-SG 2.03Å; C758-C763 PolarHBondContact SG-SG 2.94Å; S760-C763 PolarHBondContact N-SG 2.96Å; S760-C763 VanDerWaalsContact N-SG 3.35Å; S760-C763 WeakPolarHBondContact O-CB 3.29Å; S760-C763 PolarHBondContact O-N 2.99Å; S760-C763 VanDerWaalsContact O-N 3.09Å; S760-C763 PolarHBondContact O-SG 3.29Å; S760-C763 PolarHBondContact OG-SG 3.1Å; S760-C763 VanDerWaalsContact OG-SG 3.42Å; C763-R838 PolarHBondContact SG-NH2 3.31Å
764	D	86.2	Confident	88.3	Confident	60 Å²	60	25.8 Å²	25.8	32%	0.321	13%	0.134	S	C	.	.			trans	-76.5	146.2	-178.2	-59	-45.2	0	0	0	111.3	N755 K756 D766 S767	N755-D764 PolarHBondContact O-N 3.31Å; K756-D764 WeakPolarHBondContact CG-OD2 3.41Å; D764-D766 PolarHBondContact O-N 3.05Å; D764-S767 VanDerWaalsContact O-CB 3.23Å; D764-S767 WeakPolarHBondContact O-CB 3.34Å; D764-S767 PolarHBondContact O-N 3.49Å; D764-S767 PolarHBondContact O-OG 3.34Å
765	E	81.7	Confident	88.3	Confident	72 Å²	72	25.8 Å²	25.8	34%	0.336	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-25.5	-179.1	-87.4	-152.9	159.7	0	0	113.7	H88 R774	H88-E765 IonicContact CD2-OE1 3.47Å; H88-E765 PolarHBondContact N-OE1 2.84Å; E765-R774 PolarHBondContact O-NH1 2.89Å; E765-R774 IonicContact OE1-NH2 2.71Å; E765-R774 PolarHBondContact OE1-NH2 2.85Å; E765-R774 IonicContact OE2-CZ 3.89Å; E765-R774 IonicContact OE2-NH1 3.68Å; E765-R774 IonicContact OE2-NH2 2.8Å; E765-R774 PolarHBondContact OE2-NH2 2.83Å
766	D	85.9	Confident	88.3	Confident	78 Å²	78	24.8 Å²	24.8	42%	0.417	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.9	19.6	176.1	66.1	-33.3	0	0	0	112.8	D764 Q771 A915	D764-D766 PolarHBondContact O-N 3.05Å; D766-Q771 PolarHBondContact O-NE2 2.93Å; D766-A915 HydrophobicContact CB-CB 4.4Å; D766-A915 WeakPolarHBondContact OD2-CB 3.4Å
767	S	90.7	Very high	88	Confident	1 Å²	1	27.1 Å²	27.1	1%	0.007	14%	0.144	C	C	.	.	S	Bend	trans	-60.1	162	172.8	80.2	0	0	0	0	113	N755 K756 C758 D764 Y769 G770 Q771	N755-S767 WeakPolarHBondContact O-CB 3.19Å; K756-S767 CarbonylContact O-C 3.54Å; K756-S767 WeakPolarHBondContact O-CA 3.41Å; K756-S767 WeakPolarHBondContact O-CB 3.42Å; C758-S767 VanDerWaalsContact O-CB 3.32Å; C758-S767 WeakPolarHBondContact O-CB 3.39Å; C758-S767 PolarHBondContact O-OG 2.89Å; D764-S767 VanDerWaalsContact O-CB 3.23Å; D764-S767 WeakPolarHBondContact O-CB 3.34Å; D764-S767 PolarHBondContact O-N 3.49Å; D764-S767 PolarHBondContact O-OG 3.34Å; S767-Y769 VanDerWaalsContact C-N 3.28Å; S767-Y769 PolarHBondContact O-N 2.89Å; S767-G770 PolarHBondContact O-N 3.1Å; S767-G770 VanDerWaalsContact O-N 3.1Å; S767-G770 PolarHBondContact OG-N 2.96Å; S767-Q771 WeakPolarHBondContact O-CG 3.17Å; S767-Q771 PolarHBondContact O-N 3.43Å
768	L	92.8	Very high	87.8	Confident	1 Å²	1	31.1 Å²	31.1	1%	0.005	16%	0.16	C	C	.	.	H	α-helix	trans	-49.3	-50.1	173.3	-174.4	155	0	0	0	111.3	V742 K756 I757 V772 V788 F885 I912	V742-L768 HydrophobicContact CG2-CD1 3.69Å; K756-L768 PolarHBondContact O-N 2.89Å; I757-L768 HydrophobicContact CB-CB 4.47Å; I757-L768 HydrophobicContact CG1-CB 4.46Å; I757-L768 HydrophobicContact CG2-CB 4.37Å; L768-V772 WeakPolarHBondContact O-CG2 3.38Å; L768-V772 PolarHBondContact O-N 3.39Å; L768-V788 HydrophobicContact CD2-CG1 4.48Å; L768-F885 HydrophobicContact CD1-CD2 3.72Å; L768-F885 HydrophobicContact CD1-CE2 4Å; L768-F885 HydrophobicContact CD1-CG 4.38Å; L768-F885 HydrophobicContact CD2-CB 3.88Å; L768-F885 HydrophobicContact CD2-CD1 4.09Å; L768-F885 HydrophobicContact CD2-CD2 3.87Å; L768-F885 HydrophobicContact CD2-CE2 4.46Å; L768-F885 HydrophobicContact CD2-CG 3.67Å; L768-F885 HydrophobicContact CG-CD2 4.5Å; L768-I912 HydrophobicContact CB-CG2 3.88Å; L768-I912 HydrophobicContact CD1-CG2 4.21Å; L768-I912 HydrophobicContact CG-CD1 4.3Å; L768-I912 HydrophobicContact CG-CG2 4.02Å
769	Y	92.6	Very high	87.6	Confident	42 Å²	42	33.2 Å²	33.2	17%	0.165	17%	0.173	C	C	.	.	H	α-helix	trans	-63.6	-48.6	176	-163.7	-72	0	0	0	111.9	Q81 I757 S767 Q771 V772 Y773 V788	Q81-Y769 VanDerWaalsContact CD-CD1 3.43Å; Q81-Y769 HydrophobicContact CG-CD1 4.24Å; Q81-Y769 HydrophobicContact CG-CE1 4.14Å; I757-Y769 WeakPolarHBondContact O-CB 3.39Å; I757-Y769 PolarHBondContact O-N 2.79Å; I757-Y769 VanDerWaalsContact O-N 3.1Å; S767-Y769 VanDerWaalsContact C-N 3.28Å; S767-Y769 PolarHBondContact O-N 2.89Å; Y769-Q771 VanDerWaalsContact C-N 3.33Å; Y769-Q771 PolarHBondContact O-N 2.9Å; Y769-V772 PolarHBondContact O-N 2.94Å; Y769-Y773 HydrophobicContact CE1-CD2 4.29Å; Y769-Y773 HydrophobicContact CE1-CG 4.5Å; Y769-Y773 WeakPolarHBondContact O-CB 3.2Å; Y769-Y773 PolarHBondContact O-N 3.3Å; Y769-V788 HydrophobicContact CD2-CB 4.31Å; Y769-V788 HydrophobicContact CD2-CG1 4.12Å; Y769-V788 HydrophobicContact CE2-CB 4.42Å; Y769-V788 HydrophobicContact CE2-CG1 4.43Å; Y769-V788 WeakPolarHBondContact CE2-O 3.34Å
770	G	89.2	Confident	87.6	Confident	2 Å²	2	40.3 Å²	40.3	2%	0.021	21%	0.21	C	C	.	.	H	α-helix	trans	-58.4	-41.7	-176.5	0	0	0	0	0	113.1	S767 R774	S767-G770 PolarHBondContact O-N 3.1Å; S767-G770 VanDerWaalsContact O-N 3.1Å; S767-G770 PolarHBondContact OG-N 2.96Å; G770-R774 WeakPolarHBondContact O-CB 3.25Å; G770-R774 WeakPolarHBondContact O-CD 3.47Å; G770-R774 WeakPolarHBondContact O-CG 3.31Å; G770-R774 PolarHBondContact O-N 3.34Å
771	Q	89.8	Confident	87.7	Confident	21 Å²	21	44.7 Å²	44.7	10%	0.098	23%	0.225	C	C	.	.	H	α-helix	trans	-68.4	-42.9	176.9	-66.8	-167.3	46.8	0	0	112.6	D766 S767 Y769 R774 A775 N911 I912	D766-Q771 PolarHBondContact O-NE2 2.93Å; S767-Q771 WeakPolarHBondContact O-CG 3.17Å; S767-Q771 PolarHBondContact O-N 3.43Å; Y769-Q771 VanDerWaalsContact C-N 3.33Å; Y769-Q771 PolarHBondContact O-N 2.9Å; Q771-R774 PolarHBondContact O-N 3.08Å; Q771-A775 PolarHBondContact O-N 3.33Å; Q771-N911 PolarHBondContact NE2-O 3.2Å; Q771-I912 HydrophobicContact CB-CD1 4.21Å; Q771-I912 HydrophobicContact CB-CG1 3.88Å; Q771-I912 HydrophobicContact CG-CG1 4.18Å
772	V	91.7	Very high	87.9	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-74	-35	-179.5	-172.6	0	0	0	0	111.8	F740 L768 Y769 A775 S776 I784 V788 T887 I908 I912	F740-V772 HydrophobicContact CD2-CG2 4.01Å; F740-V772 HydrophobicContact CE1-CG2 4.4Å; F740-V772 HydrophobicContact CE2-CG1 3.89Å; F740-V772 HydrophobicContact CE2-CG2 3.79Å; F740-V772 HydrophobicContact CG-CG2 4.4Å; F740-V772 HydrophobicContact CZ-CG1 4.47Å; F740-V772 HydrophobicContact CZ-CG2 4Å; L768-V772 WeakPolarHBondContact O-CG2 3.38Å; L768-V772 PolarHBondContact O-N 3.39Å; Y769-V772 PolarHBondContact O-N 2.94Å; V772-A775 WeakPolarHBondContact O-CB 3.41Å; V772-A775 PolarHBondContact O-N 2.81Å; V772-S776 PolarHBondContact O-N 2.76Å; V772-I784 HydrophobicContact CG1-CG2 4.11Å; V772-V788 HydrophobicContact CB-CG2 3.87Å; V772-V788 HydrophobicContact CG1-CG2 3.62Å; V772-V788 HydrophobicContact CG2-CG2 4.22Å; V772-T887 HydrophobicContact CG1-CG2 4.08Å; V772-I908 HydrophobicContact CG2-CG2 3.97Å; V772-I912 HydrophobicContact CG2-CD1 3.92Å
773	Y	90.1	Very high	88.4	Confident	47 Å²	47	44 Å²	44	18%	0.184	21%	0.211	C	C	.	.	H	α-helix	trans	-59.5	-48.2	169.6	175.5	-90.9	0	0	0	111.5	Q81 Y769 A775 S776 L777 P787	Q81-Y773 HydrophobicContact CB-CD1 4.42Å; Q81-Y773 HydrophobicContact CB-CD2 4.31Å; Q81-Y773 HydrophobicContact CB-CE1 4.28Å; Q81-Y773 HydrophobicContact CB-CE2 4.17Å; Q81-Y773 HydrophobicContact CB-CG 4.44Å; Q81-Y773 HydrophobicContact CG-CD1 3.64Å; Q81-Y773 HydrophobicContact CG-CD2 3.99Å; Q81-Y773 HydrophobicContact CG-CE1 3.96Å; Q81-Y773 HydrophobicContact CG-CE2 4.28Å; Q81-Y773 HydrophobicContact CG-CG 3.67Å; Y769-Y773 HydrophobicContact CE1-CD2 4.29Å; Y769-Y773 HydrophobicContact CE1-CG 4.5Å; Y769-Y773 WeakPolarHBondContact O-CB 3.2Å; Y769-Y773 PolarHBondContact O-N 3.3Å; Y773-A775 PolarHBondContact O-N 2.84Å; Y773-S776 PolarHBondContact O-N 3.32Å; Y773-S776 PolarHBondContact O-OG 3.22Å; Y773-L777 HydrophobicContact CD1-CD1 4.44Å; Y773-L777 HydrophobicContact CE1-CD1 3.99Å; Y773-L777 HydrophobicContact CE1-CD2 4.43Å; Y773-L777 HydrophobicContact CE1-CG 4.35Å; Y773-L777 PolarHBondContact O-N 3.3Å; Y773-P787 HydrophobicContact CD2-CB 4.26Å
774	R	87.7	Confident	88.7	Confident	45 Å²	45	43 Å²	43	17%	0.17	21%	0.205	C	C	.	.	H	α-helix	trans	-59.5	-33.4	175.1	-76.7	167.2	166.7	-178.3	-13.8	112.3	E765 G770 Q771	E765-R774 PolarHBondContact O-NH1 2.89Å; E765-R774 IonicContact OE1-NH2 2.71Å; E765-R774 PolarHBondContact OE1-NH2 2.85Å; E765-R774 IonicContact OE2-CZ 3.89Å; E765-R774 IonicContact OE2-NH1 3.68Å; E765-R774 IonicContact OE2-NH2 2.8Å; E765-R774 PolarHBondContact OE2-NH2 2.83Å; G770-R774 WeakPolarHBondContact O-CB 3.25Å; G770-R774 WeakPolarHBondContact O-CD 3.47Å; G770-R774 WeakPolarHBondContact O-CG 3.31Å; G770-R774 PolarHBondContact O-N 3.34Å; Q771-R774 PolarHBondContact O-N 3.08Å
775	A	89.2	Confident	88.8	Confident	0 Å²	0	42 Å²	42	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-70.5	-38.9	172.4	0	0	0	0	0	112.8	Y93 Q771 V772 Y773 L777 Y778 S782 I784 I908	Y93-A775 HydrophobicContact CD1-CB 4.34Å; Q771-A775 PolarHBondContact O-N 3.33Å; V772-A775 WeakPolarHBondContact O-CB 3.41Å; V772-A775 PolarHBondContact O-N 2.81Å; Y773-A775 PolarHBondContact O-N 2.84Å; A775-L777 PolarHBondContact O-N 3.5Å; A775-Y778 PolarHBondContact O-N 3.06Å; A775-Y778 VanDerWaalsContact O-N 3.14Å; A775-S782 VanDerWaalsContact O-CB 3.25Å; A775-S782 WeakPolarHBondContact O-CB 3.37Å; A775-S782 PolarHBondContact O-OG 3.48Å; A775-I784 HydrophobicContact CB-CB 4.47Å; A775-I784 HydrophobicContact CB-CG1 4.35Å; A775-I908 HydrophobicContact CB-CD1 3.7Å; A775-I908 HydrophobicContact CB-CG1 4.46Å
776	S	89	Confident	89	Confident	16 Å²	16	38.9 Å²	38.9	11%	0.112	19%	0.191	C	C	.	.	H	α-helix	trans	-68.3	-19.1	-179.6	65.8	0	0	0	0	114.4	V772 Y773 Y778 P779 A786	V772-S776 PolarHBondContact O-N 2.76Å; Y773-S776 PolarHBondContact O-N 3.32Å; Y773-S776 PolarHBondContact O-OG 3.22Å; S776-Y778 PolarHBondContact O-N 3.44Å; S776-P779 WeakPolarHBondContact O-CD 3.45Å; S776-A786 VanDerWaalsContact CB-C 3.43Å; S776-A786 VanDerWaalsContact CB-O 3.29Å; S776-A786 WeakPolarHBondContact CB-O 3.39Å
777	L	85.3	Confident	89.1	Confident	86 Å²	86	38.1 Å²	38.1	45%	0.45	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-17.2	172.2	-63	176.8	0	0	0	113.5	Y773 A775 P779	Y773-L777 HydrophobicContact CD1-CD1 4.44Å; Y773-L777 HydrophobicContact CE1-CD1 3.99Å; Y773-L777 HydrophobicContact CE1-CD2 4.43Å; Y773-L777 HydrophobicContact CE1-CG 4.35Å; Y773-L777 PolarHBondContact O-N 3.3Å; A775-L777 PolarHBondContact O-N 3.5Å; L777-P779 VanDerWaalsContact C-CD 3.47Å
778	Y	87.4	Confident	89.2	Confident	85 Å²	85	38.4 Å²	38.4	33%	0.333	19%	0.192	S	C	.	.			trans	-128.1	56.8	-176.6	-60.5	-66.9	0	0	0	112.5	A775 S776 N780 R781 S782	A775-Y778 PolarHBondContact O-N 3.06Å; A775-Y778 VanDerWaalsContact O-N 3.14Å; S776-Y778 PolarHBondContact O-N 3.44Å; Y778-N780 PolarHBondContact O-N 2.03Å; Y778-N780 VanDerWaalsContact O-N 3.14Å; Y778-R781 PolarHBondContact O-N 2.86Å; Y778-S782 PolarHBondContact O-N 3.19Å; Y778-S782 PolarHBondContact O-OG 3.06Å; Y778-S782 VanDerWaalsContact O-OG 3.09Å
779	P	87.3	Confident	88.9	Confident	44 Å²	44	40.6 Å²	40.6	29%	0.286	21%	0.207	S	C	.	.	H	α-helix	trans	-57.8	-36.3	-170.3	24	-34.5	0	0	0	112.8	S776 L777 R781 Y783 I784	S776-P779 WeakPolarHBondContact O-CD 3.45Å; L777-P779 VanDerWaalsContact C-CD 3.47Å; P779-R781 PolarHBondContact O-N 3.05Å; P779-Y783 VanDerWaalsContact O-CA 3.26Å; P779-Y783 WeakPolarHBondContact O-CA 3.19Å; P779-Y783 PolarHBondContact O-N 2.64Å; P779-I784 WeakPolarHBondContact CA-O 3.47Å; P779-I784 WeakPolarHBondContact CB-O 3.26Å
780	N	86.3	Confident	88.9	Confident	152 Å²	152	39 Å²	39	81%	0.813	20%	0.202	S	C	*	.	H	α-helix	trans	-65.3	-7.7	178.1	-62.7	-11.6	0	0	0	114.7	Y778	Y778-N780 PolarHBondContact O-N 2.03Å; Y778-N780 VanDerWaalsContact O-N 3.14Å
781	R	85.2	Confident	89.1	Confident	106 Å²	106	38.9 Å²	38.9	40%	0.4	20%	0.201	S	C	.	.	H	α-helix	trans	-125.4	-39.7	177	-72.5	-176.5	166.4	175.1	-2.7	113	E97 Y778 P779 N904	E97-R781 IonicContact OE1-CZ 2.67Å; E97-R781 IonicContact OE1-NE 2.64Å; E97-R781 IonicContact OE1-NH2 3.65Å; E97-R781 PolarHBondContact OE1-NH2 2.68Å; Y778-R781 PolarHBondContact O-N 2.86Å; P779-R781 PolarHBondContact O-N 3.05Å; R781-N904 PolarHBondContact O-ND2 3.11Å
782	S	89.3	Confident	89.2	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-79.6	-23.9	178.7	66.9	0	0	0	0	113.3	A775 Y778 I784 N904	A775-S782 VanDerWaalsContact O-CB 3.25Å; A775-S782 WeakPolarHBondContact O-CB 3.37Å; A775-S782 PolarHBondContact O-OG 3.48Å; Y778-S782 PolarHBondContact O-N 3.19Å; Y778-S782 PolarHBondContact O-OG 3.06Å; Y778-S782 VanDerWaalsContact O-OG 3.09Å; S782-I784 PolarHBondContact O-N 2.81Å; S782-I784 PolarHBondContact OG-N 2.77Å; S782-I784 VanDerWaalsContact OG-N 3.09Å; S782-N904 WeakPolarHBondContact O-CB 3.42Å
783	Y	92.8	Very high	89.1	Confident	46 Å²	46	38.8 Å²	38.8	18%	0.18	20%	0.201	C	C	.	.			trans	57.6	23.4	-166.3	-65.4	-100.1	0	0	0	114.1	P779 H889 S890 L892 D897 A900 A901	P779-Y783 VanDerWaalsContact O-CA 3.26Å; P779-Y783 WeakPolarHBondContact O-CA 3.19Å; P779-Y783 PolarHBondContact O-N 2.64Å; Y783-H889 CarbonylContact O-C 2.86Å; Y783-H889 WeakPolarHBondContact O-CA 3.42Å; Y783-H889 WeakPolarHBondContact O-CB 3.18Å; Y783-H889 PolarHBondContact O-ND1 2.67Å; Y783-S890 WeakPolarHBondContact CA-OG 3.28Å; Y783-S890 WeakPolarHBondContact CD1-OG 3.49Å; Y783-S890 PolarHBondContact O-N 2.66Å; Y783-L892 HydrophobicContact CD1-CD2 3.53Å; Y783-L892 HydrophobicContact CE1-CD2 4.21Å; Y783-L892 HydrophobicContact CG-CD2 4.4Å; Y783-D897 HydrophobicContact CD1-CB 4.43Å; Y783-D897 HydrophobicContact CE1-CB 3.66Å; Y783-D897 PolarHBondContact OH-OD1 3.08Å; Y783-A900 HydrophobicContact CD2-CB 4.1Å; Y783-A900 HydrophobicContact CE2-CB 3.48Å; Y783-A900 VanDerWaalsContact CE2-CB 3.48Å; Y783-A901 HydrophobicContact CD1-CB 4.38Å; Y783-A901 HydrophobicContact CG-CB 4.1Å
784	I	92.4	Very high	89.2	Confident	0 Å²	0	38 Å²	38	0%	0	20%	0.2	C	C	.	.	B	Isolated β-bridge	trans	-106.9	127.6	170	-57.8	-61.4	0	0	0	108.4	V738 F740 V772 A775 P779 S782 A786 T887 I908	V738-I784 HydrophobicContact CG1-CD1 3.97Å; F740-I784 HydrophobicContact CZ-CD1 4.49Å; V772-I784 HydrophobicContact CG1-CG2 4.11Å; A775-I784 HydrophobicContact CB-CB 4.47Å; A775-I784 HydrophobicContact CB-CG1 4.35Å; P779-I784 WeakPolarHBondContact CA-O 3.47Å; P779-I784 WeakPolarHBondContact CB-O 3.26Å; S782-I784 PolarHBondContact O-N 2.81Å; S782-I784 PolarHBondContact OG-N 2.77Å; S782-I784 VanDerWaalsContact OG-N 3.09Å; I784-A786 WeakPolarHBondContact CG2-O 3.44Å; I784-T887 HydrophobicContact CG2-CG2 4.14Å; I784-I908 HydrophobicContact CG1-CD1 4.05Å
785	A	89.4	Confident	89.3	Confident	37 Å²	37	35.9 Å²	35.9	31%	0.306	19%	0.192	S	C	.	.			trans	-100.7	-19.3	-173.2	0	0	0	0	0	114.9	V734 Y888	V734-A785 HydrophobicContact CG1-CB 4.13Å; A785-Y888 PolarHBondContact N-O 3.22Å
786	A	85.8	Confident	89.4	Confident	7 Å²	7	35.9 Å²	35.9	6%	0.058	19%	0.192	C	C	.	.	S	Bend	trans	-138.1	157.4	-173	0	0	0	0	0	111.8	S776 I784 T887	S776-A786 VanDerWaalsContact CB-C 3.43Å; S776-A786 VanDerWaalsContact CB-O 3.29Å; S776-A786 WeakPolarHBondContact CB-O 3.39Å; I784-A786 WeakPolarHBondContact CG2-O 3.44Å; A786-T887 PolarHBondContact O-OG1 3.28Å
787	P	88.3	Confident	89.2	Confident	63 Å²	63	37.5 Å²	37.5	41%	0.409	20%	0.199	S	C	.	.	P	Polyproline II helix	trans	-64	170	165.1	30.5	-36.6	0	0	0	111.3	Y773 T887	Y773-P787 HydrophobicContact CD2-CB 4.26Å; P787-T887 WeakPolarHBondContact O-CB 3.28Å; P787-T887 PolarHBondContact O-OG1 3.12Å
788	V	91.2	Very high	89.5	Confident	6 Å²	6	33.4 Å²	33.4	4%	0.036	18%	0.178	C	C	.	.	P	Polyproline II helix	trans	-82	143	178.5	148.8	0	0	0	0	111.6	F740 L768 Y769 V772 F885 A886 T887	F740-V788 HydrophobicContact CD2-CG2 4.44Å; L768-V788 HydrophobicContact CD2-CG1 4.48Å; Y769-V788 HydrophobicContact CD2-CB 4.31Å; Y769-V788 HydrophobicContact CD2-CG1 4.12Å; Y769-V788 HydrophobicContact CE2-CB 4.42Å; Y769-V788 HydrophobicContact CE2-CG1 4.43Å; Y769-V788 WeakPolarHBondContact CE2-O 3.34Å; V772-V788 HydrophobicContact CB-CG2 3.87Å; V772-V788 HydrophobicContact CG1-CG2 3.62Å; V772-V788 HydrophobicContact CG2-CG2 4.22Å; V788-F885 HydrophobicContact CG1-CB 3.73Å; V788-F885 HydrophobicContact CG1-CD1 3.75Å; V788-F885 HydrophobicContact CG1-CG 4.18Å; V788-A886 WeakPolarHBondContact CA-O 3.44Å; V788-T887 HydrophobicContact CG2-CG2 4.11Å
789	S	88	Confident	89.6	Confident	48 Å²	48	29.5 Å²	29.5	34%	0.336	16%	0.163	S	C	.	.	P	Polyproline II helix	trans	-76.9	120.7	162.4	59.8	0	0	0	0	110.2	A886	S789-A886 PolarHBondContact N-O 2.74Å; S789-A886 PolarHBondContact OG-O 3.2Å
790	S	91.5	Very high	89.4	Confident	7 Å²	7	31.5 Å²	31.5	5%	0.049	17%	0.165	C	C	.	.			trans	-111.7	98.3	-172.6	-172.1	0	0	0	0	111.4	L792 D793 D794 Y868	S790-L792 PolarHBondContact O-N 2.95Å; S790-D793 WeakPolarHBondContact CB-OD2 3.26Å; S790-D793 PolarHBondContact O-N 3.24Å; S790-D793 PolarHBondContact OG-N 3.06Å; S790-D793 PolarHBondContact OG-OD2 3.48Å; S790-D794 WeakPolarHBondContact O-CB 3.47Å; S790-D794 PolarHBondContact O-N 2.83Å; S790-Y868 PolarHBondContact N-OH 2.89Å
791	W	93.1	Very high	89.2	Confident	1 Å²	1	27.2 Å²	27.2	0%	0.004	15%	0.145	C	C	.	.	H	α-helix	trans	-56.5	-30.9	171.8	71.2	-98.6	0	0	0	112.1	Y748 Y795 F844 I848 Y868 V872 V880 S883 F885	Y748-W791 AromaticContact CD1-CH2 3.71Å; Y748-W791 HydrophobicContact CD1-CH2 3.71Å; Y748-W791 AromaticContact CD1-CZ2 3.68Å; Y748-W791 HydrophobicContact CD1-CZ2 3.68Å; Y748-W791 HydrophobicContact CE1-CH2 4.07Å; Y748-W791 AromaticContact CE1-CZ2 3.53Å; Y748-W791 HydrophobicContact CE1-CZ2 3.53Å; Y748-W791 HydrophobicContact CG-CH2 4.14Å; Y748-W791 HydrophobicContact CG-CZ2 4.37Å; W791-Y795 WeakPolarHBondContact O-CB 3.2Å; W791-Y795 PolarHBondContact O-N 3.46Å; W791-F844 HydrophobicContact CH2-CZ 4.15Å; W791-F844 HydrophobicContact CZ3-CZ 4.15Å; W791-I848 HydrophobicContact CE3-CD1 4.45Å; W791-I848 HydrophobicContact CH2-CD1 4.08Å; W791-I848 HydrophobicContact CZ3-CD1 3.6Å; W791-Y868 HydrophobicContact CB-CD1 3.59Å; W791-Y868 HydrophobicContact CB-CD2 3.82Å; W791-Y868 HydrophobicContact CB-CE1 4.01Å; W791-Y868 HydrophobicContact CB-CE2 4.25Å; W791-Y868 HydrophobicContact CB-CG 3.47Å; W791-Y868 VanDerWaalsContact CB-CG 3.47Å; W791-V872 HydrophobicContact CB-CG2 4.13Å; W791-V872 HydrophobicContact CD2-CG2 3.52Å; W791-V872 HydrophobicContact CE3-CG2 4.05Å; W791-V872 HydrophobicContact CG-CG2 3.55Å; W791-V872 HydrophobicContact CZ2-CG2 4.4Å; W791-V880 HydrophobicContact CH2-CG2 3.96Å; W791-V880 HydrophobicContact CZ2-CG1 4.49Å; W791-V880 HydrophobicContact CZ2-CG2 4.5Å; W791-S883 VanDerWaalsContact NE1-CB 3.25Å; W791-S883 PolarHBondContact NE1-OG 2.94Å; W791-S883 VanDerWaalsContact NE1-OG 3.13Å; W791-F885 AromaticContact CD1-CE1 3.64Å; W791-F885 AromaticContact CD1-CZ 3.71Å; W791-F885 AromaticContact NE1-CE1 3.66Å; W791-F885 AromaticContact NE1-CE2 3.75Å; W791-F885 AromaticContact NE1-CZ 3.2Å
792	L	92.3	Very high	88.9	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-73.9	-43.4	-176.6	-176.2	61.8	0	0	0	112.1	I757 C758 S790 F796 F844	I757-L792 HydrophobicContact CB-CD2 3.98Å; I757-L792 HydrophobicContact CG2-CD2 3.77Å; C758-L792 HydrophobicContact CB-CD2 4.06Å; C758-L792 HydrophobicContact CB-CG 4.46Å; S790-L792 PolarHBondContact O-N 2.95Å; L792-F796 HydrophobicContact CD1-CE1 3.94Å; L792-F796 HydrophobicContact CD1-CE2 4.06Å; L792-F796 HydrophobicContact CD1-CZ 3.56Å; L792-F796 HydrophobicContact CD2-CE2 4.37Å; L792-F796 HydrophobicContact CD2-CZ 4.37Å; L792-F796 HydrophobicContact CG-CD2 4.48Å; L792-F796 HydrophobicContact CG-CE2 3.77Å; L792-F796 HydrophobicContact CG-CZ 3.79Å; L792-F796 VanDerWaalsContact O-CD2 3.3Å; L792-F796 WeakPolarHBondContact O-CD2 3.49Å; L792-F796 VanDerWaalsContact O-CG 3.26Å; L792-F796 WeakPolarHBondContact O-CG 3.06Å; L792-F796 PolarHBondContact O-N 3.03Å; L792-F844 HydrophobicContact CD1-CE2 3.74Å; L792-F844 HydrophobicContact CD1-CZ 3.99Å
793	D	90.7	Very high	88	Confident	18 Å²	18	30.4 Å²	30.4	10%	0.096	19%	0.19	C	C	.	.	H	α-helix	trans	-72	-39	176.1	-66.8	-79.8	0	0	0	111.6	C758 G759 S760 S790 Y795 F796 D797	C758-D793 WeakPolarHBondContact CA-OD2 3.36Å; C758-D793 WeakPolarHBondContact CB-OD1 3.07Å; G759-D793 PolarHBondContact N-OD1 3.16Å; G759-D793 VanDerWaalsContact N-OD1 3.14Å; G759-D793 PolarHBondContact N-OD2 2.86Å; S760-D793 WeakPolarHBondContact CB-OD1 3.41Å; S760-D793 PolarHBondContact N-OD1 3.09Å; S760-D793 PolarHBondContact OG-OD1 3.38Å; S790-D793 WeakPolarHBondContact CB-OD2 3.26Å; S790-D793 PolarHBondContact O-N 3.24Å; S790-D793 PolarHBondContact OG-N 3.06Å; S790-D793 PolarHBondContact OG-OD2 3.48Å; D793-Y795 VanDerWaalsContact C-N 3.32Å; D793-Y795 PolarHBondContact O-N 3.17Å; D793-F796 PolarHBondContact O-N 3.11Å; D793-D797 PolarHBondContact O-N 3.25Å
794	D	90.2	Very high	86.9	Confident	31 Å²	31	38.3 Å²	38.3	17%	0.166	23%	0.225	C	C	.	.	H	α-helix	trans	-65.7	-34.1	174	-76.7	-22.8	0	0	0	112.4	S790 D797 W798 F851 K862 Y868	S790-D794 WeakPolarHBondContact O-CB 3.47Å; S790-D794 PolarHBondContact O-N 2.83Å; D794-D797 PolarHBondContact O-N 2.89Å; D794-W798 WeakPolarHBondContact O-CB 3.35Å; D794-W798 PolarHBondContact O-N 3.22Å; D794-F851 HydrophobicContact CB-CZ 4.12Å; D794-K862 HydrophobicContact CB-CD 4.36Å; D794-K862 WeakPolarHBondContact OD1-CD 3.32Å; D794-K862 WeakPolarHBondContact OD1-CE 3.07Å; D794-K862 IonicContact OD1-NZ 2.77Å; D794-K862 PolarHBondContact OD1-NZ 3.29Å; D794-Y868 HydrophobicContact CB-CE2 3.85Å; D794-Y868 WeakPolarHBondContact OD2-CE2 3.19Å; D794-Y868 VanDerWaalsContact OD2-CZ 3.29Å; D794-Y868 PolarHBondContact OD2-OH 2.7Å
795	Y	91.8	Very high	86.2	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-67.9	-43	172.6	177.9	-132.2	0	0	0	112.1	W791 D793 D797 W798 L799 F844 Y847 I848 F851	W791-Y795 WeakPolarHBondContact O-CB 3.2Å; W791-Y795 PolarHBondContact O-N 3.46Å; D793-Y795 VanDerWaalsContact C-N 3.32Å; D793-Y795 PolarHBondContact O-N 3.17Å; Y795-D797 VanDerWaalsContact C-N 3.33Å; Y795-D797 PolarHBondContact O-N 2.85Å; Y795-W798 AromaticContact CD2-CE3 3.99Å; Y795-W798 HydrophobicContact CD2-CE3 3.99Å; Y795-W798 HydrophobicContact CD2-CZ3 4.42Å; Y795-W798 AromaticContact CE2-CE3 3.97Å; Y795-W798 HydrophobicContact CE2-CE3 3.97Å; Y795-W798 AromaticContact CE2-CZ3 3.98Å; Y795-W798 HydrophobicContact CE2-CZ3 3.98Å; Y795-W798 PolarHBondContact O-N 3.41Å; Y795-L799 HydrophobicContact CD1-CD1 4.42Å; Y795-L799 HydrophobicContact CD2-CD1 4.3Å; Y795-L799 HydrophobicContact CD2-CG 4.1Å; Y795-L799 HydrophobicContact CE1-CD1 3.9Å; Y795-L799 HydrophobicContact CE2-CD1 3.75Å; Y795-L799 HydrophobicContact CE2-CD2 4.07Å; Y795-L799 HydrophobicContact CE2-CG 3.7Å; Y795-L799 WeakPolarHBondContact O-CB 3.45Å; Y795-L799 WeakPolarHBondContact O-CG 3.39Å; Y795-L799 PolarHBondContact O-N 2.96Å; Y795-F844 HydrophobicContact CD1-CD2 4.26Å; Y795-F844 AromaticContact CD1-CE2 3.8Å; Y795-F844 HydrophobicContact CD1-CE2 3.8Å; Y795-F844 HydrophobicContact CD1-CZ 4.28Å; Y795-F844 AromaticContact CE1-CD2 3.67Å; Y795-F844 HydrophobicContact CE1-CD2 3.67Å; Y795-F844 AromaticContact CE1-CE2 3.6Å; Y795-F844 HydrophobicContact CE1-CE2 3.6Å; Y795-F844 HydrophobicContact CE1-CG 4.18Å; Y795-F844 HydrophobicContact CE1-CZ 4.05Å; Y795-F844 PolarHBondContact OH-O 3.35Å; Y795-Y847 VanDerWaalsContact OH-C 3.31Å; Y795-I848 HydrophobicContact CE1-CB 4.15Å; Y795-I848 HydrophobicContact CE1-CG1 4.38Å; Y795-I848 HydrophobicContact CE2-CB 4.39Å; Y795-I848 WeakPolarHBondContact OH-CA 3.41Å; Y795-I848 PolarHBondContact OH-N 3Å; Y795-F851 HydrophobicContact CD2-CB 3.55Å; Y795-F851 AromaticContact CD2-CD1 3.75Å; Y795-F851 HydrophobicContact CD2-CD1 3.75Å; Y795-F851 HydrophobicContact CD2-CD2 4.03Å; Y795-F851 HydrophobicContact CD2-CE1 4.44Å; Y795-F851 AromaticContact CD2-CG 3.5Å; Y795-F851 HydrophobicContact CD2-CG 3.5Å; Y795-F851 VanDerWaalsContact CD2-CG 3.5Å; Y795-F851 HydrophobicContact CE2-CB 3.76Å; Y795-F851 HydrophobicContact CE2-CG 4.23Å; Y795-F851 HydrophobicContact CG-CD1 4.1Å; Y795-F851 HydrophobicContact CG-CE1 4.44Å; Y795-F851 HydrophobicContact CG-CG 4.28Å
796	F	89.4	Confident	86	Confident	1 Å²	1	39.4 Å²	39.4	0%	0.004	23%	0.228	C	C	.	.	H	α-helix	trans	-59.4	-44.6	172.8	-65.5	-31.5	0	0	0	111.3	Q754 C758 L792 D793 L799 R800 P839 F844	Q754-F796 HydrophobicContact CB-CZ 3.9Å; Q754-F796 HydrophobicContact CG-CZ 3.84Å; C758-F796 HydrophobicContact CB-CE2 4.12Å; L792-F796 HydrophobicContact CD1-CE1 3.94Å; L792-F796 HydrophobicContact CD1-CE2 4.06Å; L792-F796 HydrophobicContact CD1-CZ 3.56Å; L792-F796 HydrophobicContact CD2-CE2 4.37Å; L792-F796 HydrophobicContact CD2-CZ 4.37Å; L792-F796 HydrophobicContact CG-CD2 4.48Å; L792-F796 HydrophobicContact CG-CE2 3.77Å; L792-F796 HydrophobicContact CG-CZ 3.79Å; L792-F796 VanDerWaalsContact O-CD2 3.3Å; L792-F796 WeakPolarHBondContact O-CD2 3.49Å; L792-F796 VanDerWaalsContact O-CG 3.26Å; L792-F796 WeakPolarHBondContact O-CG 3.06Å; L792-F796 PolarHBondContact O-N 3.03Å; D793-F796 PolarHBondContact O-N 3.11Å; F796-L799 PolarHBondContact O-N 3.32Å; F796-R800 WeakPolarHBondContact O-CG 3.38Å; F796-R800 PolarHBondContact O-N 3.5Å; F796-P839 HydrophobicContact CD1-CG 4.43Å; F796-P839 HydrophobicContact CE1-CG 4.34Å; F796-F844 HydrophobicContact CE1-CD2 4.3Å; F796-F844 HydrophobicContact CE1-CE2 4.08Å
797	D	86.7	Confident	86.1	Confident	49 Å²	49	40 Å²	40	26%	0.262	23%	0.232	S	C	.	.	H	α-helix	trans	-59.2	-45.8	175.6	-87	4.6	0	0	0	112.9	D793 D794 Y795 L799 R800 K862	D793-D797 PolarHBondContact O-N 3.25Å; D794-D797 PolarHBondContact O-N 2.89Å; Y795-D797 VanDerWaalsContact C-N 3.33Å; Y795-D797 PolarHBondContact O-N 2.85Å; D797-L799 VanDerWaalsContact C-N 3.33Å; D797-L799 PolarHBondContact O-N 3.25Å; D797-R800 PolarHBondContact O-N 2.8Å; D797-R800 IonicContact OD1-CZ 3.88Å; D797-R800 IonicContact OD1-NE 3.18Å; D797-R800 PolarHBondContact OD1-NE 3.25Å; D797-R800 IonicContact OD1-NH2 3.53Å; D797-R800 PolarHBondContact OD1-NH2 3.34Å; D797-K862 HydrophobicContact CB-CD 4.42Å; D797-K862 HydrophobicContact CB-CG 4.23Å; D797-K862 VanDerWaalsContact OD2-CE 3.28Å; D797-K862 WeakPolarHBondContact OD2-CE 3.33Å; D797-K862 IonicContact OD2-NZ 2.74Å; D797-K862 PolarHBondContact OD2-NZ 3.04Å
798	W	89.7	Confident	86.2	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-64.6	-33.8	178.3	179.2	88.3	0	0	0	113.3	D794 Y795 C807 C808 F817 V850 F851 D854 K862	D794-W798 WeakPolarHBondContact O-CB 3.35Å; D794-W798 PolarHBondContact O-N 3.22Å; Y795-W798 AromaticContact CD2-CE3 3.99Å; Y795-W798 HydrophobicContact CD2-CE3 3.99Å; Y795-W798 HydrophobicContact CD2-CZ3 4.42Å; Y795-W798 AromaticContact CE2-CE3 3.97Å; Y795-W798 HydrophobicContact CE2-CE3 3.97Å; Y795-W798 AromaticContact CE2-CZ3 3.98Å; Y795-W798 HydrophobicContact CE2-CZ3 3.98Å; Y795-W798 PolarHBondContact O-N 3.41Å; W798-C807 HydrophobicContact CG-CB 3.94Å; W798-C807 WeakPolarHBondContact O-CB 3.36Å; W798-C808 HydrophobicContact CD2-CB 4.21Å; W798-C808 HydrophobicContact CE3-CB 3.9Å; W798-C808 HydrophobicContact CH2-CB 3.82Å; W798-C808 WeakPolarHBondContact CH2-SG 3.42Å; W798-C808 HydrophobicContact CZ2-CB 4.11Å; W798-C808 HydrophobicContact CZ3-CB 3.7Å; W798-C808 WeakPolarHBondContact CZ3-SG 3.36Å; W798-C808 PolarHBondContact O-N 3.08Å; W798-F817 HydrophobicContact CH2-CE2 4.28Å; W798-F817 AromaticContact CZ2-CE2 3.71Å; W798-F817 HydrophobicContact CZ2-CE2 3.71Å; W798-F817 AromaticContact CZ2-CZ 3.93Å; W798-F817 HydrophobicContact CZ2-CZ 3.93Å; W798-V850 HydrophobicContact CH2-CB 4.13Å; W798-V850 HydrophobicContact CH2-CG1 3.96Å; W798-V850 HydrophobicContact CZ2-CG1 4.23Å; W798-F851 HydrophobicContact CB-CD2 3.89Å; W798-F851 HydrophobicContact CB-CE2 4.02Å; W798-F851 HydrophobicContact CD2-CB 4.2Å; W798-F851 AromaticContact CD2-CD2 3.76Å; W798-F851 HydrophobicContact CD2-CD2 3.76Å; W798-F851 HydrophobicContact CD2-CG 4.44Å; W798-F851 HydrophobicContact CE3-CB 3.84Å; W798-F851 HydrophobicContact CE3-CD2 4.07Å; W798-F851 HydrophobicContact CE3-CG 4.36Å; W798-F851 AromaticContact CG-CD2 3.7Å; W798-F851 HydrophobicContact CG-CD2 3.7Å; W798-F851 HydrophobicContact CG-CE2 4.23Å; W798-F851 HydrophobicContact CH2-CB 4.1Å; W798-F851 HydrophobicContact CZ2-CB 4.43Å; W798-F851 HydrophobicContact CZ3-CB 3.79Å; W798-D854 HydrophobicContact CZ2-CB 4.15Å; W798-D854 PolarHBondContact NE1-OD2 2.88Å; W798-K862 HydrophobicContact CB-CB 4.3Å; W798-K862 VanDerWaalsContact CD1-O 3.31Å
799	L	89.6	Confident	86.1	Confident	4 Å²	4	37.6 Å²	37.6	2%	0.021	21%	0.214	C	C	.	.	H	α-helix	trans	-76	-19.1	175.6	-77.8	-177.3	0	0	0	114.2	Y795 F796 D797 P801 C808 V831 F834 P839 Y847	Y795-L799 HydrophobicContact CD1-CD1 4.42Å; Y795-L799 HydrophobicContact CD2-CD1 4.3Å; Y795-L799 HydrophobicContact CD2-CG 4.1Å; Y795-L799 HydrophobicContact CE1-CD1 3.9Å; Y795-L799 HydrophobicContact CE2-CD1 3.75Å; Y795-L799 HydrophobicContact CE2-CD2 4.07Å; Y795-L799 HydrophobicContact CE2-CG 3.7Å; Y795-L799 WeakPolarHBondContact O-CB 3.45Å; Y795-L799 WeakPolarHBondContact O-CG 3.39Å; Y795-L799 PolarHBondContact O-N 2.96Å; F796-L799 PolarHBondContact O-N 3.32Å; D797-L799 VanDerWaalsContact C-N 3.33Å; D797-L799 PolarHBondContact O-N 3.25Å; L799-P801 WeakPolarHBondContact O-CD 3.4Å; L799-C808 HydrophobicContact CD2-CB 4.09Å; L799-V831 HydrophobicContact CD2-CG2 4.29Å; L799-F834 HydrophobicContact CB-CE2 3.86Å; L799-F834 HydrophobicContact CB-CZ 3.57Å; L799-F834 VanDerWaalsContact O-CE2 3.31Å; L799-F834 WeakPolarHBondContact O-CE2 3.37Å; L799-P839 HydrophobicContact CD1-CB 4.04Å; L799-P839 HydrophobicContact CD1-CG 3.94Å; L799-Y847 HydrophobicContact CD2-CD2 4.04Å; L799-Y847 HydrophobicContact CD2-CG 4.29Å
800	R	84.4	Confident	86.2	Confident	85 Å²	85	36.7 Å²	36.7	32%	0.321	20%	0.204	S	C	.	.			trans	-61.1	125.2	-175	-58.5	-173.3	-161.4	-128.3	6.9	110.3	F796 D797 V802 F834	F796-R800 WeakPolarHBondContact O-CG 3.38Å; F796-R800 PolarHBondContact O-N 3.5Å; D797-R800 PolarHBondContact O-N 2.8Å; D797-R800 IonicContact OD1-CZ 3.88Å; D797-R800 IonicContact OD1-NE 3.18Å; D797-R800 PolarHBondContact OD1-NE 3.25Å; D797-R800 IonicContact OD1-NH2 3.53Å; D797-R800 PolarHBondContact OD1-NH2 3.34Å; R800-V802 HydrophobicContact CB-CB 4.46Å; R800-V802 HydrophobicContact CB-CG2 4.02Å; R800-V802 PolarHBondContact O-N 2.85Å; R800-F834 HydrophobicContact CG-CE1 4.45Å
801	P	82.5	Confident	86.1	Confident	62 Å²	62	38.3 Å²	38.3	40%	0.403	21%	0.211	S	C	.	.			trans	-78.3	62.4	177.3	32.9	-36.4	0	0	0	111.4	L799 F834	L799-P801 WeakPolarHBondContact O-CD 3.4Å; P801-F834 HydrophobicContact CG-CD2 4.41Å
802	V	77.6	Confident	85.8	Confident	107 Å²	107	41.3 Å²	41.3	65%	0.648	24%	0.236	S	C	*	.			trans	-123.3	142.1	-172.9	178.1	0	0	0	0	110.6	R800	R800-V802 HydrophobicContact CB-CB 4.46Å; R800-V802 HydrophobicContact CB-CG2 4.02Å; R800-V802 PolarHBondContact O-N 2.85Å
803	G	71.3	Confident	85.5	Confident	66 Å²	66	47.6 Å²	47.6	68%	0.68	27%	0.265	S	S	*	.	S	Bend	trans	95.4	178	-178.2	0	0	0	0	0	113.6
804	K	69.9	Low	85.4	Confident	212 Å²	212	50.4 Å²	50.4	92%	0.922	28%	0.28	S	S	*	.	S	Bend	trans	-74.3	-29.3	178.2	-66.7	179.4	-178.2	172.5	0	112.6
805	T	77	Confident	85.1	Confident	47 Å²	47	54.4 Å²	54.4	29%	0.288	30%	0.302	S	S	.	.	S	Bend	trans	-135.9	81.8	-179.3	47.2	0	0	0	0	107.6
806	P	84.3	Confident	85	Confident	14 Å²	14	57.6 Å²	57.6	9%	0.091	32%	0.321	C	S	.	.			trans	-62.3	155.3	175.4	26.5	-33.9	0	0	0	110.5	R809 T829	P806-R809 HydrophobicContact CG-CG 4.24Å; P806-R809 WeakPolarHBondContact O-CD 3.33Å; P806-R809 WeakPolarHBondContact O-CG 3.42Å; P806-R809 PolarHBondContact O-NE 3.36Å; P806-T829 HydrophobicContact CG-CG2 3.5Å
807	C	87.9	Confident	84.9	Confident	19 Å²	19	59.6 Å²	59.6	13%	0.128	33%	0.33	C	S	.	.	S	Bend	trans	-69	-58.6	-172	-46.8	0	0	0	0	111.9	W798 R809 C860	W798-C807 HydrophobicContact CG-CB 3.94Å; W798-C807 WeakPolarHBondContact O-CB 3.36Å; C807-R809 PolarHBondContact O-N 3.18Å; C807-R809 VanDerWaalsContact O-N 3.16Å; C807-C860 HydrophobicContact CB-CB 3.77Å; C807-C860 WeakPolarHBondContact CB-SG 3.35Å; C807-C860 WeakPolarHBondContact SG-CB 3.47Å; C807-C860 CovalentContact SG-SG 2.02Å; C807-C860 PolarHBondContact SG-SG 3.45Å
808	C	90.4	Very high	85.1	Confident	5 Å²	5	57.2 Å²	57.2	3%	0.034	32%	0.317	C	S	.	.	S	Bend	trans	-72	108.4	177.3	-163.9	0	0	0	0	111.3	W798 L799 C830	W798-C808 HydrophobicContact CD2-CB 4.21Å; W798-C808 HydrophobicContact CE3-CB 3.9Å; W798-C808 HydrophobicContact CH2-CB 3.82Å; W798-C808 WeakPolarHBondContact CH2-SG 3.42Å; W798-C808 HydrophobicContact CZ2-CB 4.11Å; W798-C808 HydrophobicContact CZ3-CB 3.7Å; W798-C808 WeakPolarHBondContact CZ3-SG 3.36Å; W798-C808 PolarHBondContact O-N 3.08Å; L799-C808 HydrophobicContact CD2-CB 4.09Å; C808-C830 VanDerWaalsContact CA-SG 3.52Å; C808-C830 HydrophobicContact CB-CB 3.81Å; C808-C830 WeakPolarHBondContact CB-SG 3.47Å; C808-C830 PolarHBondContact O-N 3.17Å; C808-C830 PolarHBondContact O-SG 3.31Å; C808-C830 WeakPolarHBondContact SG-CB 3.27Å; C808-C830 CovalentContact SG-SG 2.03Å; C808-C830 PolarHBondContact SG-SG 3.16Å
809	R	89.9	Confident	85	Confident	13 Å²	13	58.5 Å²	58.5	5%	0.049	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	155.5	174.3	-62.6	-179.1	-57.6	153	6.2	112	P806 C807 F817 C818 P819 S820 V822 C827 H828 C830	P806-R809 HydrophobicContact CG-CG 4.24Å; P806-R809 WeakPolarHBondContact O-CD 3.33Å; P806-R809 WeakPolarHBondContact O-CG 3.42Å; P806-R809 PolarHBondContact O-NE 3.36Å; C807-R809 PolarHBondContact O-N 3.18Å; C807-R809 VanDerWaalsContact O-N 3.16Å; R809-F817 WeakPolarHBondContact O-CD2 3.07Å; R809-C818 HydrophobicContact CB-CB 4.08Å; R809-C818 PolarHBondContact NH2-O 2.57Å; R809-C818 PolarHBondContact O-N 3.45Å; R809-P819 PolarHBondContact NH2-O 3.2Å; R809-S820 PolarHBondContact NH2-O 2.79Å; R809-V822 PolarHBondContact NH1-O 3.14Å; R809-V822 PolarHBondContact NH2-O 2.73Å; R809-C827 HydrophobicContact CB-CB 4.35Å; R809-H828 CarbonylContact C-O 3.34Å; R809-H828 WeakPolarHBondContact CA-O 3.3Å; R809-H828 VanDerWaalsContact CB-O 3.28Å; R809-H828 WeakPolarHBondContact CB-O 3.35Å; R809-C830 PolarHBondContact N-SG 3.42Å
810	F	89.6	Confident	84.7	Confident	29 Å²	29	58.3 Å²	58.3	13%	0.127	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	145.7	175	-80.6	-100.8	0	0	0	111.6	A812 D815 T816 F817 C827 H828 C830 Y847 V850	F810-A812 PolarHBondContact O-N 3.02Å; F810-D815 VanDerWaalsContact CD1-O 3.3Å; F810-D815 WeakPolarHBondContact CD1-O 3.45Å; F810-T816 WeakPolarHBondContact CA-O 3.18Å; F810-F817 HydrophobicContact CE1-CB 4.37Å; F810-F817 HydrophobicContact CE2-CD2 4.46Å; F810-F817 HydrophobicContact CZ-CB 4.5Å; F810-C827 CarbonylContact O-C 3.56Å; F810-C827 VanDerWaalsContact O-CA 3.3Å; F810-C827 WeakPolarHBondContact O-CA 3.48Å; F810-H828 PolarHBondContact N-O 3.4Å; F810-H828 PolarHBondContact O-N 3.21Å; F810-H828 PolarHBondContact O-ND1 2.86Å; F810-C830 WeakPolarHBondContact CD2-SG 3.24Å; F810-C830 WeakPolarHBondContact CE2-SG 3.38Å; F810-Y847 HydrophobicContact CD2-CE1 4.11Å; F810-Y847 AromaticContact CE2-CD1 3.55Å; F810-Y847 HydrophobicContact CE2-CD1 3.55Å; F810-Y847 AromaticContact CE2-CE1 3.4Å; F810-Y847 HydrophobicContact CE2-CE1 3.4Å; F810-Y847 AromaticContact CZ-CD1 3.89Å; F810-Y847 HydrophobicContact CZ-CD1 3.89Å; F810-Y847 AromaticContact CZ-CE1 3.85Å; F810-Y847 HydrophobicContact CZ-CE1 3.85Å; F810-V850 HydrophobicContact CZ-CG2 4.23Å
811	F	90.5	Very high	84.7	Confident	41 Å²	41	61.1 Å²	61.1	18%	0.18	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	116.8	173.8	-78.2	-75.9	0	0	0	110.5	H813 N814 D815 T816 F817 C818 V822 C827	F811-H813 AromaticContact CD1-CE1 3.81Å; F811-H813 AromaticContact CG-CE1 3.95Å; F811-H813 PolarHBondContact O-N 3.42Å; F811-N814 WeakPolarHBondContact CB-OD1 3.48Å; F811-N814 PolarHBondContact O-N 3.47Å; F811-N814 PolarHBondContact O-OD1 3.41Å; F811-D815 PolarHBondContact O-N 2.77Å; F811-T816 PolarHBondContact N-O 3.12Å; F811-F817 WeakPolarHBondContact CD2-O 3.46Å; F811-C818 HydrophobicContact CD1-CB 4.37Å; F811-C818 HydrophobicContact CD2-CB 3.64Å; F811-C818 HydrophobicContact CE1-CB 4.45Å; F811-C818 HydrophobicContact CE2-CB 3.73Å; F811-C818 HydrophobicContact CG-CB 3.99Å; F811-C818 HydrophobicContact CZ-CB 4.15Å; F811-V822 HydrophobicContact CE1-CG1 4.43Å; F811-V822 HydrophobicContact CZ-CG1 4.07Å; F811-C827 WeakPolarHBondContact CD1-SG 3.43Å; F811-C827 WeakPolarHBondContact CE1-SG 3.38Å
812	A	86.3	Confident	84.9	Confident	65 Å²	65	60 Å²	60	54%	0.537	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	10.1	-174.2	0	0	0	0	0	115.7	F810 D826	F810-A812 PolarHBondContact O-N 3.02Å; A812-D826 WeakPolarHBondContact CB-O 3.26Å; A812-D826 PolarHBondContact N-O 2.9Å
813	H	86.9	Confident	85.1	Confident	132 Å²	132	61.5 Å²	61.5	61%	0.611	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.3	-14.6	-178.7	72.6	-93.6	0	0	0	113.9	F811	F811-H813 AromaticContact CD1-CE1 3.81Å; F811-H813 AromaticContact CG-CE1 3.95Å; F811-H813 PolarHBondContact O-N 3.42Å
814	N	87.5	Confident	85.6	Confident	77 Å²	77	60.1 Å²	60.1	41%	0.412	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-149.9	-0.2	-176.3	70.6	-14.3	0	0	0	114	F811 T816	F811-N814 WeakPolarHBondContact CB-OD1 3.48Å; F811-N814 PolarHBondContact O-N 3.47Å; F811-N814 PolarHBondContact O-OD1 3.41Å; N814-T816 VanDerWaalsContact CG-OG1 3.28Å; N814-T816 WeakPolarHBondContact ND2-CG2 3.43Å; N814-T816 PolarHBondContact ND2-OG1 3.37Å; N814-T816 PolarHBondContact O-N 2.87Å; N814-T816 VanDerWaalsContact O-N 3.14Å; N814-T816 PolarHBondContact OD1-N 3.08Å; N814-T816 VanDerWaalsContact OD1-N 3.15Å; N814-T816 PolarHBondContact OD1-OG1 2.87Å
815	D	83.3	Confident	86.2	Confident	115 Å²	115	56.8 Å²	56.8	62%	0.615	32%	0.315	S	S	*	.			trans	51.4	33.1	-178.2	-54.4	-40.5	0	0	0	114.4	F810 F811	F810-D815 VanDerWaalsContact CD1-O 3.3Å; F810-D815 WeakPolarHBondContact CD1-O 3.45Å; F811-D815 PolarHBondContact O-N 2.77Å
816	T	89.7	Confident	86.7	Confident	67 Å²	67	58.8 Å²	58.8	41%	0.411	32%	0.324	S	S	.	.			trans	-89.4	150.1	164.7	61.6	0	0	0	0	111.2	F810 F811 N814	F810-T816 WeakPolarHBondContact CA-O 3.18Å; F811-T816 PolarHBondContact N-O 3.12Å; N814-T816 VanDerWaalsContact CG-OG1 3.28Å; N814-T816 WeakPolarHBondContact ND2-CG2 3.43Å; N814-T816 PolarHBondContact ND2-OG1 3.37Å; N814-T816 PolarHBondContact O-N 2.87Å; N814-T816 VanDerWaalsContact O-N 3.14Å; N814-T816 PolarHBondContact OD1-N 3.08Å; N814-T816 VanDerWaalsContact OD1-N 3.15Å; N814-T816 PolarHBondContact OD1-OG1 2.87Å
817	F	89	Confident	86.8	Confident	42 Å²	42	59.1 Å²	59.1	18%	0.184	33%	0.326	C	S	.	.	B	Isolated β-bridge	trans	-52.5	139	173.2	179.4	-118.7	0	0	0	111.7	W798 R809 F810 F811 P819 V850 D854	W798-F817 HydrophobicContact CH2-CE2 4.28Å; W798-F817 AromaticContact CZ2-CE2 3.71Å; W798-F817 HydrophobicContact CZ2-CE2 3.71Å; W798-F817 AromaticContact CZ2-CZ 3.93Å; W798-F817 HydrophobicContact CZ2-CZ 3.93Å; R809-F817 WeakPolarHBondContact O-CD2 3.07Å; F810-F817 HydrophobicContact CE1-CB 4.37Å; F810-F817 HydrophobicContact CE2-CD2 4.46Å; F810-F817 HydrophobicContact CZ-CB 4.5Å; F811-F817 WeakPolarHBondContact CD2-O 3.46Å; F817-P819 HydrophobicContact CD1-CG 4.09Å; F817-P819 HydrophobicContact CE1-CB 4.2Å; F817-P819 HydrophobicContact CE1-CG 4.07Å; F817-P819 WeakPolarHBondContact O-CD 3.34Å; F817-V850 HydrophobicContact CB-CG1 3.92Å; F817-V850 HydrophobicContact CD1-CG1 4Å; F817-V850 HydrophobicContact CD2-CG1 3.46Å; F817-V850 VanDerWaalsContact CD2-CG1 3.46Å; F817-V850 HydrophobicContact CE1-CG1 4.38Å; F817-V850 HydrophobicContact CE2-CG1 3.9Å; F817-V850 HydrophobicContact CG-CG1 3.52Å; F817-V850 HydrophobicContact CZ-CG1 4.35Å; F817-D854 HydrophobicContact CE1-CB 4.23Å; F817-D854 WeakPolarHBondContact CE1-OD1 3.39Å; F817-D854 HydrophobicContact CZ-CB 4.18Å
818	C	89.7	Confident	86.7	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	34%	0.339	C	S	.	.			trans	-112.3	95.3	178.2	175.1	0	0	0	0	109.4	R809 F811 C827	R809-C818 HydrophobicContact CB-CB 4.08Å; R809-C818 PolarHBondContact NH2-O 2.57Å; R809-C818 PolarHBondContact O-N 3.45Å; F811-C818 HydrophobicContact CD1-CB 4.37Å; F811-C818 HydrophobicContact CD2-CB 3.64Å; F811-C818 HydrophobicContact CE1-CB 4.45Å; F811-C818 HydrophobicContact CE2-CB 3.73Å; F811-C818 HydrophobicContact CG-CB 3.99Å; F811-C818 HydrophobicContact CZ-CB 4.15Å; C818-C827 HydrophobicContact CB-CB 3.74Å; C818-C827 WeakPolarHBondContact CB-SG 3.42Å; C818-C827 WeakPolarHBondContact SG-CB 3.06Å; C818-C827 CovalentContact SG-SG 2.03Å; C818-C827 PolarHBondContact SG-SG 2.87Å
819	P	87.1	Confident	86.5	Confident	26 Å²	26	64.9 Å²	64.9	17%	0.169	36%	0.355	C	S	.	.			trans	-52.5	144.7	-172.9	-28.3	34.8	0	0	0	113	R809 F817 Y821 V822	R809-P819 PolarHBondContact NH2-O 3.2Å; F817-P819 HydrophobicContact CD1-CG 4.09Å; F817-P819 HydrophobicContact CE1-CB 4.2Å; F817-P819 HydrophobicContact CE1-CG 4.07Å; F817-P819 WeakPolarHBondContact O-CD 3.34Å; P819-Y821 HydrophobicContact CB-CD1 3.84Å; P819-Y821 HydrophobicContact CB-CE1 3.33Å; P819-Y821 HydrophobicContact CB-CE2 4.42Å; P819-Y821 HydrophobicContact CG-CE1 4.24Å; P819-Y821 PolarHBondContact O-N 2.88Å; P819-V822 HydrophobicContact CB-CG2 4.32Å; P819-V822 WeakPolarHBondContact O-CB 3.48Å; P819-V822 PolarHBondContact O-N 3.15Å
820	S	85.2	Confident	86.3	Confident	1 Å²	1	65 Å²	65	1%	0.007	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.9	-33.5	-171.5	48.9	0	0	0	0	114.7	R809 V822 S857 T859	R809-S820 PolarHBondContact NH2-O 2.79Å; S820-V822 VanDerWaalsContact C-N 3.34Å; S820-V822 PolarHBondContact O-N 2.75Å; S820-S857 PolarHBondContact OG-OG 2.94Å; S820-T859 PolarHBondContact O-OG1 2.64Å
821	Y	83.3	Confident	85.6	Confident	143 Å²	143	63.8 Å²	63.8	56%	0.561	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-11.5	179.2	61.4	-95.9	0	0	0	114.9	P819 V823 T859	P819-Y821 HydrophobicContact CB-CD1 3.84Å; P819-Y821 HydrophobicContact CB-CE1 3.33Å; P819-Y821 HydrophobicContact CB-CE2 4.42Å; P819-Y821 HydrophobicContact CG-CE1 4.24Å; P819-Y821 PolarHBondContact O-N 2.88Å; Y821-V823 PolarHBondContact O-N 2.9Å; Y821-T859 WeakPolarHBondContact CA-OG1 3.36Å; Y821-T859 PolarHBondContact N-OG1 3.32Å
822	V	86.6	Confident	84.3	Confident	40 Å²	40	67.7 Å²	67.7	24%	0.242	39%	0.385	C	S	.	.			trans	-83	109.9	-178.6	-178	0	0	0	0	110.9	R809 F811 P819 S820 S824	R809-V822 PolarHBondContact NH1-O 3.14Å; R809-V822 PolarHBondContact NH2-O 2.73Å; F811-V822 HydrophobicContact CE1-CG1 4.43Å; F811-V822 HydrophobicContact CZ-CG1 4.07Å; P819-V822 HydrophobicContact CB-CG2 4.32Å; P819-V822 WeakPolarHBondContact O-CB 3.48Å; P819-V822 PolarHBondContact O-N 3.15Å; S820-V822 VanDerWaalsContact C-N 3.34Å; S820-V822 PolarHBondContact O-N 2.75Å; V822-S824 PolarHBondContact O-N 2.89Å
823	V	81.8	Confident	83.6	Confident	137 Å²	137	67.7 Å²	67.7	83%	0.83	38%	0.381	S	S	*	.			trans	-87.4	81.8	175.8	-171.4	0	0	0	0	110	Y821	Y821-V823 PolarHBondContact O-N 2.9Å
824	S	82	Confident	83	Confident	38 Å²	38	63.8 Å²	63.8	27%	0.266	36%	0.362	S	S	.	.			trans	-121.5	146.1	169	-179.3	0	0	0	0	111.5	V822 D826	V822-S824 PolarHBondContact O-N 2.89Å; S824-D826 PolarHBondContact OG-N 3.09Å; S824-D826 PolarHBondContact OG-OD2 2.86Å
825	T	82.6	Confident	82.2	Confident	141 Å²	141	64.8 Å²	64.8	87%	0.865	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-15.7	169.4	46.6	0	0	0	0	113.3	C827	T825-C827 PolarHBondContact O-N 3.34Å
826	D	86.5	Confident	81.6	Confident	90 Å²	90	62.9 Å²	62.9	48%	0.481	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	1.1	-178.6	-51	-38.4	0	0	0	112.8	A812 S824	A812-D826 WeakPolarHBondContact CB-O 3.26Å; A812-D826 PolarHBondContact N-O 2.9Å; S824-D826 PolarHBondContact OG-N 3.09Å; S824-D826 PolarHBondContact OG-OD2 2.86Å
827	C	87.1	Confident	80.8	Confident	21 Å²	21	60.6 Å²	60.6	14%	0.142	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	121.1	-179.1	-60.6	0	0	0	0	111.7	R809 F810 F811 C818 T825	R809-C827 HydrophobicContact CB-CB 4.35Å; F810-C827 CarbonylContact O-C 3.56Å; F810-C827 VanDerWaalsContact O-CA 3.3Å; F810-C827 WeakPolarHBondContact O-CA 3.48Å; F811-C827 WeakPolarHBondContact CD1-SG 3.43Å; F811-C827 WeakPolarHBondContact CE1-SG 3.38Å; C818-C827 HydrophobicContact CB-CB 3.74Å; C818-C827 WeakPolarHBondContact CB-SG 3.42Å; C818-C827 WeakPolarHBondContact SG-CB 3.06Å; C818-C827 CovalentContact SG-SG 2.03Å; C818-C827 PolarHBondContact SG-SG 2.87Å; T825-C827 PolarHBondContact O-N 3.34Å
828	H	86.6	Confident	80.5	Confident	84 Å²	84	59.3 Å²	59.3	39%	0.389	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	162	177.3	69.8	-83.7	0	0	0	111.4	R809 F810	R809-H828 CarbonylContact C-O 3.34Å; R809-H828 WeakPolarHBondContact CA-O 3.3Å; R809-H828 VanDerWaalsContact CB-O 3.28Å; R809-H828 WeakPolarHBondContact CB-O 3.35Å; F810-H828 PolarHBondContact N-O 3.4Å; F810-H828 PolarHBondContact O-N 3.21Å; F810-H828 PolarHBondContact O-ND1 2.86Å
829	T	86.3	Confident	80.2	Confident	61 Å²	61	59.5 Å²	59.5	37%	0.374	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	141.7	-178.4	54.5	0	0	0	0	111.8	P806	P806-T829 HydrophobicContact CG-CG2 3.5Å
830	C	84	Confident	80	Confident	16 Å²	16	61 Å²	61	11%	0.108	36%	0.358	C	S	.	.	S	Bend	trans	-59.7	-60.3	-178.7	-61.8	0	0	0	0	113.2	C808 R809 F810 Y847	C808-C830 VanDerWaalsContact CA-SG 3.52Å; C808-C830 HydrophobicContact CB-CB 3.81Å; C808-C830 WeakPolarHBondContact CB-SG 3.47Å; C808-C830 PolarHBondContact O-N 3.17Å; C808-C830 PolarHBondContact O-SG 3.31Å; C808-C830 WeakPolarHBondContact SG-CB 3.27Å; C808-C830 CovalentContact SG-SG 2.03Å; C808-C830 PolarHBondContact SG-SG 3.16Å; R809-C830 PolarHBondContact N-SG 3.42Å; F810-C830 WeakPolarHBondContact CD2-SG 3.24Å; F810-C830 WeakPolarHBondContact CE2-SG 3.38Å; C830-Y847 HydrophobicContact CB-CD1 4.45Å; C830-Y847 HydrophobicContact CB-CD2 4.05Å; C830-Y847 HydrophobicContact CB-CE1 4.13Å; C830-Y847 HydrophobicContact CB-CE2 3.71Å; C830-Y847 HydrophobicContact CB-CG 4.42Å; C830-Y847 PolarHBondContact O-OH 2.84Å
831	V	76.4	Confident	80	Confident	3 Å²	3	63.2 Å²	63.2	2%	0.018	38%	0.376	C	S	.	.			trans	-107.7	123.4	-171.9	-175.6	0	0	0	0	109.9	L799 S833 F834 Y847	L799-V831 HydrophobicContact CD2-CG2 4.29Å; V831-S833 WeakPolarHBondContact CG1-O 3.3Å; V831-F834 HydrophobicContact CB-CD2 4.06Å; V831-F834 HydrophobicContact CB-CE2 3.94Å; V831-F834 HydrophobicContact CG1-CD2 3.65Å; V831-F834 HydrophobicContact CG1-CE2 3.88Å; V831-F834 HydrophobicContact CG2-CE2 4.33Å; V831-Y847 HydrophobicContact CG2-CD2 4.1Å; V831-Y847 HydrophobicContact CG2-CE2 3.9Å
832	S	62.2	Low	80	Confident	122 Å²	122	60.9 Å²	60.9	85%	0.853	38%	0.377	S	S	*	.	S	Bend	trans	-93.6	-13	176.3	57.9	0	0	0	0	113.9
833	S	71.1	Confident	79.9	Confident	65 Å²	65	59.8 Å²	59.8	46%	0.455	37%	0.371	S	S	.	.			trans	-131.3	96.5	-174.7	170.1	0	0	0	0	111.1	V831	V831-S833 WeakPolarHBondContact CG1-O 3.3Å
834	F	74.4	Confident	80.2	Confident	51 Å²	51	53.5 Å²	53.5	22%	0.224	33%	0.332	C	S	.	.			trans	-101.2	113	170.1	-110.3	-98.7	0	0	0	109.5	L799 R800 P801 V831 G837 P839	L799-F834 HydrophobicContact CB-CE2 3.86Å; L799-F834 HydrophobicContact CB-CZ 3.57Å; L799-F834 VanDerWaalsContact O-CE2 3.31Å; L799-F834 WeakPolarHBondContact O-CE2 3.37Å; R800-F834 HydrophobicContact CG-CE1 4.45Å; P801-F834 HydrophobicContact CG-CD2 4.41Å; V831-F834 HydrophobicContact CB-CD2 4.06Å; V831-F834 HydrophobicContact CB-CE2 3.94Å; V831-F834 HydrophobicContact CG1-CD2 3.65Å; V831-F834 HydrophobicContact CG1-CE2 3.88Å; V831-F834 HydrophobicContact CG2-CE2 4.33Å; F834-G837 WeakPolarHBondContact CE1-O 3.23Å; F834-P839 HydrophobicContact CE2-CB 4.49Å; F834-P839 HydrophobicContact CZ-CB 4.36Å
835	V	72.2	Confident	80.4	Confident	98 Å²	98	52.9 Å²	52.9	59%	0.594	33%	0.328	S	S	*	.	B	Isolated β-bridge	trans	-102	120.2	-179.5	-177.8	0	0	0	0	108.8	G837 R838	V835-G837 PolarHBondContact O-N 3.08Å; V835-R838 PolarHBondContact N-O 3.17Å; V835-R838 VanDerWaalsContact N-O 3.08Å; V835-R838 PolarHBondContact O-N 2.99Å
836	S	69.2	Low	80.6	Confident	75 Å²	75	51.2 Å²	51.2	52%	0.524	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.4	30.6	180	-56.1	0	0	0	0	114.8
837	G	73.2	Confident	80.7	Confident	19 Å²	19	48.9 Å²	48.9	20%	0.196	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.2	8	-179.4	0	0	0	0	0	115.9	F834 V835	F834-G837 WeakPolarHBondContact CE1-O 3.23Å; V835-G837 PolarHBondContact O-N 3.08Å
838	R	82.2	Confident	80.9	Confident	14 Å²	14	47.9 Å²	47.9	5%	0.053	29%	0.292	C	S	.	.	B	Isolated β-bridge	trans	-115.9	149	175.6	-52.8	-58.5	-177.6	-130.5	-12.2	112.3	P751 N755 C758 S760 T761 C763 V835	P751-R838 HydrophobicContact CB-CG 4.33Å; N755-R838 PolarHBondContact OD1-NE 3.15Å; N755-R838 PolarHBondContact OD1-NH2 3.04Å; C758-R838 PolarHBondContact SG-NH2 2.61Å; S760-R838 PolarHBondContact OG-NH1 3.49Å; T761-R838 PolarHBondContact O-NH2 3.06Å; C763-R838 PolarHBondContact SG-NH2 3.31Å; V835-R838 PolarHBondContact N-O 3.17Å; V835-R838 VanDerWaalsContact N-O 3.08Å; V835-R838 PolarHBondContact O-N 2.99Å
839	P	83.9	Confident	81.1	Confident	5 Å²	5	45.2 Å²	45.2	3%	0.032	29%	0.287	C	S	.	.			trans	-74.8	168.7	165.4	34.7	-36.2	0	0	0	111.1	F796 L799 F834 F844	F796-P839 HydrophobicContact CD1-CG 4.43Å; F796-P839 HydrophobicContact CE1-CG 4.34Å; L799-P839 HydrophobicContact CD1-CB 4.04Å; L799-P839 HydrophobicContact CD1-CG 3.94Å; F834-P839 HydrophobicContact CE2-CB 4.49Å; F834-P839 HydrophobicContact CZ-CB 4.36Å; P839-F844 HydrophobicContact CG-CB 4.32Å; P839-F844 HydrophobicContact CG-CD2 4.14Å
840	D	83.4	Confident	81.3	Confident	58 Å²	58	44 Å²	44	31%	0.31	28%	0.28	S	S	.	.			trans	-73	158.4	164	64.6	-79.9	0	0	0	112	T842 S843 F844	D840-T842 VanDerWaalsContact C-N 3.25Å; D840-T842 PolarHBondContact O-N 3.2Å; D840-T842 WeakPolarHBondContact OD2-CB 3.43Å; D840-T842 PolarHBondContact OD2-N 3.09Å; D840-T842 PolarHBondContact OD2-OG1 3.05Å; D840-S843 VanDerWaalsContact CG-OG 3.29Å; D840-S843 PolarHBondContact O-N 3.28Å; D840-S843 WeakPolarHBondContact OD1-CB 3.32Å; D840-S843 PolarHBondContact OD1-OG 3.48Å; D840-S843 PolarHBondContact OD2-N 2.03Å; D840-S843 PolarHBondContact OD2-OG 3.42Å; D840-F844 PolarHBondContact O-N 3.14Å
841	A	84.1	Confident	81.7	Confident	46 Å²	46	43.2 Å²	43.2	38%	0.38	27%	0.274	S	S	.	.	H	α-helix	trans	-60.5	-31.2	-175.5	0	0	0	0	0	113.8	S845	A841-S845 PolarHBondContact O-N 3.34Å
842	T	84.5	Confident	82.4	Confident	95 Å²	95	43.6 Å²	43.6	58%	0.583	28%	0.276	S	S	*	.	H	α-helix	trans	-70.9	-55.7	175.9	17.9	0	0	0	0	111.2	D840 F844 S845 D846	D840-T842 VanDerWaalsContact C-N 3.25Å; D840-T842 PolarHBondContact O-N 3.2Å; D840-T842 WeakPolarHBondContact OD2-CB 3.43Å; D840-T842 PolarHBondContact OD2-N 3.09Å; D840-T842 PolarHBondContact OD2-OG1 3.05Å; T842-F844 PolarHBondContact O-N 3.27Å; T842-F844 VanDerWaalsContact O-N 3.13Å; T842-S845 PolarHBondContact O-N 3.39Å; T842-D846 PolarHBondContact O-N 3.1Å
843	S	84.8	Confident	83.7	Confident	16 Å²	16	42.4 Å²	42.4	11%	0.112	26%	0.258	C	S	.	.	H	α-helix	trans	-54.6	-33.8	174.6	-63.8	0	0	0	0	112.9	D840 Y847	D840-S843 VanDerWaalsContact CG-OG 3.29Å; D840-S843 PolarHBondContact O-N 3.28Å; D840-S843 WeakPolarHBondContact OD1-CB 3.32Å; D840-S843 PolarHBondContact OD1-OG 3.48Å; D840-S843 PolarHBondContact OD2-N 2.03Å; D840-S843 PolarHBondContact OD2-OG 3.42Å; S843-Y847 WeakPolarHBondContact O-CD2 3.45Å; S843-Y847 PolarHBondContact O-N 2.91Å
844	F	88.5	Confident	84.6	Confident	5 Å²	5	39.8 Å²	39.8	2%	0.022	24%	0.239	C	C	.	.	H	α-helix	trans	-59.5	-47.7	175.7	-174.1	-81.1	0	0	0	112.1	W791 L792 Y795 F796 P839 D840 T842 I848	W791-F844 HydrophobicContact CH2-CZ 4.15Å; W791-F844 HydrophobicContact CZ3-CZ 4.15Å; L792-F844 HydrophobicContact CD1-CE2 3.74Å; L792-F844 HydrophobicContact CD1-CZ 3.99Å; Y795-F844 HydrophobicContact CD1-CD2 4.26Å; Y795-F844 AromaticContact CD1-CE2 3.8Å; Y795-F844 HydrophobicContact CD1-CE2 3.8Å; Y795-F844 HydrophobicContact CD1-CZ 4.28Å; Y795-F844 AromaticContact CE1-CD2 3.67Å; Y795-F844 HydrophobicContact CE1-CD2 3.67Å; Y795-F844 AromaticContact CE1-CE2 3.6Å; Y795-F844 HydrophobicContact CE1-CE2 3.6Å; Y795-F844 HydrophobicContact CE1-CG 4.18Å; Y795-F844 HydrophobicContact CE1-CZ 4.05Å; Y795-F844 PolarHBondContact OH-O 3.35Å; F796-F844 HydrophobicContact CE1-CD2 4.3Å; F796-F844 HydrophobicContact CE1-CE2 4.08Å; P839-F844 HydrophobicContact CG-CB 4.32Å; P839-F844 HydrophobicContact CG-CD2 4.14Å; D840-F844 PolarHBondContact O-N 3.14Å; T842-F844 PolarHBondContact O-N 3.27Å; T842-F844 VanDerWaalsContact O-N 3.13Å; F844-I848 HydrophobicContact CE1-CD1 4.07Å; F844-I848 HydrophobicContact CZ-CD1 4.22Å; F844-I848 WeakPolarHBondContact O-CB 3.2Å
845	S	85.7	Confident	85.2	Confident	25 Å²	25	38.7 Å²	38.7	18%	0.175	24%	0.236	C	C	.	.	H	α-helix	trans	-75.5	-32.6	179.2	-77.6	0	0	0	0	113.4	A841 T842 S878	A841-S845 PolarHBondContact O-N 3.34Å; T842-S845 PolarHBondContact O-N 3.39Å; S845-S878 WeakPolarHBondContact O-CB 3.4Å
846	D	86.1	Confident	85.6	Confident	106 Å²	106	36 Å²	36	57%	0.567	22%	0.22	S	C	*	.	H	α-helix	trans	-71.2	-36.4	-176.9	-68.1	-26.8	0	0	0	112.6	T842	T842-D846 PolarHBondContact O-N 3.1Å
847	Y	89.5	Confident	86.1	Confident	42 Å²	42	33 Å²	33	17%	0.165	20%	0.2	C	C	.	.	H	α-helix	trans	-101.9	-10.4	-171.8	-56.4	-52.1	0	0	0	115.8	Y795 L799 F810 C830 V831 S843 G849 V850 F851	Y795-Y847 VanDerWaalsContact OH-C 3.31Å; L799-Y847 HydrophobicContact CD2-CD2 4.04Å; L799-Y847 HydrophobicContact CD2-CG 4.29Å; F810-Y847 HydrophobicContact CD2-CE1 4.11Å; F810-Y847 AromaticContact CE2-CD1 3.55Å; F810-Y847 HydrophobicContact CE2-CD1 3.55Å; F810-Y847 AromaticContact CE2-CE1 3.4Å; F810-Y847 HydrophobicContact CE2-CE1 3.4Å; F810-Y847 AromaticContact CZ-CD1 3.89Å; F810-Y847 HydrophobicContact CZ-CD1 3.89Å; F810-Y847 AromaticContact CZ-CE1 3.85Å; F810-Y847 HydrophobicContact CZ-CE1 3.85Å; C830-Y847 HydrophobicContact CB-CD1 4.45Å; C830-Y847 HydrophobicContact CB-CD2 4.05Å; C830-Y847 HydrophobicContact CB-CE1 4.13Å; C830-Y847 HydrophobicContact CB-CE2 3.71Å; C830-Y847 HydrophobicContact CB-CG 4.42Å; C830-Y847 PolarHBondContact O-OH 2.84Å; V831-Y847 HydrophobicContact CG2-CD2 4.1Å; V831-Y847 HydrophobicContact CG2-CE2 3.9Å; S843-Y847 WeakPolarHBondContact O-CD2 3.45Å; S843-Y847 PolarHBondContact O-N 2.91Å; Y847-G849 PolarHBondContact O-N 3.47Å; Y847-V850 WeakPolarHBondContact O-CB 3.46Å; Y847-V850 PolarHBondContact O-N 3.32Å; Y847-V850 VanDerWaalsContact O-N 3.08Å; Y847-F851 PolarHBondContact O-N 2.93Å; Y847-F851 VanDerWaalsContact O-N 3.08Å
848	I	91.1	Very high	86.3	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-64.8	-38.3	-175.4	-171.4	169.2	0	0	0	112.7	W791 Y795 F844 V850 F851 L852 V872 L874 S878 V880	W791-I848 HydrophobicContact CE3-CD1 4.45Å; W791-I848 HydrophobicContact CH2-CD1 4.08Å; W791-I848 HydrophobicContact CZ3-CD1 3.6Å; Y795-I848 HydrophobicContact CE1-CB 4.15Å; Y795-I848 HydrophobicContact CE1-CG1 4.38Å; Y795-I848 HydrophobicContact CE2-CB 4.39Å; Y795-I848 WeakPolarHBondContact OH-CA 3.41Å; Y795-I848 PolarHBondContact OH-N 3Å; F844-I848 HydrophobicContact CE1-CD1 4.07Å; F844-I848 HydrophobicContact CZ-CD1 4.22Å; F844-I848 WeakPolarHBondContact O-CB 3.2Å; I848-V850 PolarHBondContact O-N 3.2Å; I848-F851 PolarHBondContact O-N 2.65Å; I848-L852 HydrophobicContact CG1-CD1 4.37Å; I848-L852 WeakPolarHBondContact O-CG 3.26Å; I848-L852 PolarHBondContact O-N 2.89Å; I848-L852 VanDerWaalsContact O-N 3.13Å; I848-V872 HydrophobicContact CD1-CG1 4.38Å; I848-L874 HydrophobicContact CD1-CD2 4.13Å; I848-L874 HydrophobicContact CG1-CD2 4.39Å; I848-L874 HydrophobicContact CG2-CD1 4.2Å; I848-L874 HydrophobicContact CG2-CD2 4.08Å; I848-S878 WeakPolarHBondContact CG2-O 3.49Å; I848-V880 HydrophobicContact CD1-CG2 3.53Å
849	G	90.3	Very high	86.3	Confident	28 Å²	28	39.4 Å²	39.4	29%	0.289	23%	0.231	S	C	.	.	H	α-helix	trans	-66	-23	175.8	0	0	0	0	0	113.6	Y847 M853	Y847-G849 PolarHBondContact O-N 3.47Å; G849-M853 WeakPolarHBondContact O-CG 3.36Å
850	V	91.1	Very high	86.2	Confident	35 Å²	35	39.5 Å²	39.5	21%	0.212	23%	0.232	C	C	.	.	H	α-helix	trans	-81.8	-43.9	175.2	-177.3	0	0	0	0	110.4	W798 F810 F817 Y847 I848 L852 M853 D854	W798-V850 HydrophobicContact CH2-CB 4.13Å; W798-V850 HydrophobicContact CH2-CG1 3.96Å; W798-V850 HydrophobicContact CZ2-CG1 4.23Å; F810-V850 HydrophobicContact CZ-CG2 4.23Å; F817-V850 HydrophobicContact CB-CG1 3.92Å; F817-V850 HydrophobicContact CD1-CG1 4Å; F817-V850 HydrophobicContact CD2-CG1 3.46Å; F817-V850 VanDerWaalsContact CD2-CG1 3.46Å; F817-V850 HydrophobicContact CE1-CG1 4.38Å; F817-V850 HydrophobicContact CE2-CG1 3.9Å; F817-V850 HydrophobicContact CG-CG1 3.52Å; F817-V850 HydrophobicContact CZ-CG1 4.35Å; Y847-V850 WeakPolarHBondContact O-CB 3.46Å; Y847-V850 PolarHBondContact O-N 3.32Å; Y847-V850 VanDerWaalsContact O-N 3.08Å; I848-V850 PolarHBondContact O-N 3.2Å; V850-L852 VanDerWaalsContact C-N 3.32Å; V850-L852 PolarHBondContact O-N 2.88Å; V850-M853 CarbonylContact O-C 3.31Å; V850-M853 PolarHBondContact O-N 3.24Å; V850-D854 PolarHBondContact O-N 3.27Å
851	F	92.5	Very high	86	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-54.5	-45.5	174.4	167.5	-109.1	0	0	0	112.6	D794 Y795 W798 Y847 I848 M853 D854 G864 Y868	D794-F851 HydrophobicContact CB-CZ 4.12Å; Y795-F851 HydrophobicContact CD2-CB 3.55Å; Y795-F851 AromaticContact CD2-CD1 3.75Å; Y795-F851 HydrophobicContact CD2-CD1 3.75Å; Y795-F851 HydrophobicContact CD2-CD2 4.03Å; Y795-F851 HydrophobicContact CD2-CE1 4.44Å; Y795-F851 AromaticContact CD2-CG 3.5Å; Y795-F851 HydrophobicContact CD2-CG 3.5Å; Y795-F851 VanDerWaalsContact CD2-CG 3.5Å; Y795-F851 HydrophobicContact CE2-CB 3.76Å; Y795-F851 HydrophobicContact CE2-CG 4.23Å; Y795-F851 HydrophobicContact CG-CD1 4.1Å; Y795-F851 HydrophobicContact CG-CE1 4.44Å; Y795-F851 HydrophobicContact CG-CG 4.28Å; W798-F851 HydrophobicContact CB-CD2 3.89Å; W798-F851 HydrophobicContact CB-CE2 4.02Å; W798-F851 HydrophobicContact CD2-CB 4.2Å; W798-F851 AromaticContact CD2-CD2 3.76Å; W798-F851 HydrophobicContact CD2-CD2 3.76Å; W798-F851 HydrophobicContact CD2-CG 4.44Å; W798-F851 HydrophobicContact CE3-CB 3.84Å; W798-F851 HydrophobicContact CE3-CD2 4.07Å; W798-F851 HydrophobicContact CE3-CG 4.36Å; W798-F851 AromaticContact CG-CD2 3.7Å; W798-F851 HydrophobicContact CG-CD2 3.7Å; W798-F851 HydrophobicContact CG-CE2 4.23Å; W798-F851 HydrophobicContact CH2-CB 4.1Å; W798-F851 HydrophobicContact CZ2-CB 4.43Å; W798-F851 HydrophobicContact CZ3-CB 3.79Å; Y847-F851 PolarHBondContact O-N 2.93Å; Y847-F851 VanDerWaalsContact O-N 3.08Å; I848-F851 PolarHBondContact O-N 2.65Å; F851-M853 PolarHBondContact O-N 3.41Å; F851-M853 VanDerWaalsContact O-N 3.12Å; F851-D854 PolarHBondContact O-N 3.33Å; F851-G864 WeakPolarHBondContact O-CA 3.39Å; F851-G864 PolarHBondContact O-N 3.32Å; F851-Y868 HydrophobicContact CE1-CD2 4.22Å; F851-Y868 AromaticContact CZ-CD2 3.96Å; F851-Y868 HydrophobicContact CZ-CD2 3.96Å; F851-Y868 HydrophobicContact CZ-CE2 4.45Å
852	L	91.5	Very high	85.8	Confident	10 Å²	10	40.5 Å²	40.5	5%	0.052	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-5.4	179.3	-64.5	175.4	0	0	0	114.4	I848 V850 H865 V872 L874	I848-L852 HydrophobicContact CG1-CD1 4.37Å; I848-L852 WeakPolarHBondContact O-CG 3.26Å; I848-L852 PolarHBondContact O-N 2.89Å; I848-L852 VanDerWaalsContact O-N 3.13Å; V850-L852 VanDerWaalsContact C-N 3.32Å; V850-L852 PolarHBondContact O-N 2.88Å; L852-H865 WeakPolarHBondContact O-CA 3.41Å; L852-V872 HydrophobicContact CD1-CB 3.81Å; L852-V872 HydrophobicContact CD1-CG1 3.96Å; L852-V872 HydrophobicContact CD2-CB 4.13Å; L852-V872 HydrophobicContact CD2-CG2 4.1Å; L852-L874 HydrophobicContact CD1-CD1 3.92Å; L852-L874 HydrophobicContact CD1-CD2 4.47Å; L852-L874 HydrophobicContact CD1-CG 4.07Å
853	M	89.5	Confident	85.7	Confident	98 Å²	98	36.7 Å²	36.7	48%	0.483	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-117.4	-8.8	174.1	-62.5	-57.8	-53.2	0	0	113.2	G849 V850 F851 H865 Q869	G849-M853 WeakPolarHBondContact O-CG 3.36Å; V850-M853 CarbonylContact O-C 3.31Å; V850-M853 PolarHBondContact O-N 3.24Å; F851-M853 PolarHBondContact O-N 3.41Å; F851-M853 VanDerWaalsContact O-N 3.12Å; M853-H865 PolarHBondContact O-ND1 2.93Å; M853-Q869 HydrophobicContact SD-CG 4.46Å; M853-Q869 PolarHBondContact SD-NE2 3.14Å
854	D	89.7	Confident	85.8	Confident	9 Å²	9	35.9 Å²	35.9	5%	0.048	21%	0.207	C	C	.	.	P	Polyproline II helix	trans	-77.3	136.4	-179.8	-168	27.1	0	0	0	111.7	W798 F817 V850 F851 G863 G864 H865	W798-D854 HydrophobicContact CZ2-CB 4.15Å; W798-D854 PolarHBondContact NE1-OD2 2.88Å; F817-D854 HydrophobicContact CE1-CB 4.23Å; F817-D854 WeakPolarHBondContact CE1-OD1 3.39Å; F817-D854 HydrophobicContact CZ-CB 4.18Å; V850-D854 PolarHBondContact O-N 3.27Å; F851-D854 PolarHBondContact O-N 3.33Å; D854-G863 CarbonylContact O-C 3.32Å; D854-G863 WeakPolarHBondContact O-CA 3.43Å; D854-G864 PolarHBondContact O-N 3.16Å; D854-H865 WeakPolarHBondContact O-CB 3.36Å; D854-H865 PolarHBondContact O-N 3.17Å
855	N	86.5	Confident	85.8	Confident	29 Å²	29	36 Å²	36	16%	0.155	21%	0.207	C	C	.	.	P	Polyproline II helix	trans	-96.2	133.2	-173.7	-83.6	-18.7	0	0	0	111	L321 E324 S857 H865	L321-N855 WeakPolarHBondContact CD2-OD1 3.47Å; E324-N855 VanDerWaalsContact CD-ND2 3.31Å; E324-N855 PolarHBondContact OE2-ND2 3.12Å; N855-S857 PolarHBondContact O-N 2.67Å; N855-H865 WeakPolarHBondContact OD1-CB 3.46Å; N855-H865 PolarHBondContact OD1-ND1 2.75Å
856	P	80.9	Confident	85.7	Confident	40 Å²	40	36.4 Å²	36.4	26%	0.26	22%	0.215	S	C	.	.	P	Polyproline II helix	trans	-61.9	132.8	179.5	26.7	-34.4	0	0	0	110.7
857	S	79.6	Confident	85.7	Confident	14 Å²	14	34.2 Å²	34.2	10%	0.098	21%	0.212	C	C	.	.			trans	-132.6	166.7	-175.5	83.2	0	0	0	0	111.9	S820 N855 T859 C860 S861	S820-S857 PolarHBondContact OG-OG 2.94Å; N855-S857 PolarHBondContact O-N 2.67Å; S857-T859 PolarHBondContact O-N 2.79Å; S857-T859 PolarHBondContact OG-N 3.4Å; S857-T859 PolarHBondContact OG-OG1 2.94Å; S857-C860 PolarHBondContact N-O 3.09Å; S857-C860 CarbonylContact O-C 3.54Å; S857-C860 PolarHBondContact O-N 2.76Å; S857-C860 VanDerWaalsContact O-N 3.11Å; S857-C860 PolarHBondContact OG-N 3.46Å; S857-S861 PolarHBondContact O-N 3.24Å
858	I	77.2	Confident	85.7	Confident	110 Å²	110	33 Å²	33	56%	0.564	21%	0.207	S	C	*	.	S	Bend	trans	-63	-24.9	175.8	-165	168.5	0	0	0	112.9	V372 M373	V372-I858 HydrophobicContact CB-CB 4.45Å; V372-I858 HydrophobicContact CG1-CB 4.03Å; M373-I858 HydrophobicContact CB-CD1 3.94Å; M373-I858 HydrophobicContact CE-CD1 3.77Å; M373-I858 HydrophobicContact SD-CD1 3.9Å
859	T	81.3	Confident	85.6	Confident	56 Å²	56	36.1 Å²	36.1	34%	0.344	22%	0.222	S	C	.	.	S	Bend	trans	-86.2	-22.6	174.8	37.4	0	0	0	0	113.8	S820 Y821 S857	S820-T859 PolarHBondContact O-OG1 2.64Å; Y821-T859 WeakPolarHBondContact CA-OG1 3.36Å; Y821-T859 PolarHBondContact N-OG1 3.32Å; S857-T859 PolarHBondContact O-N 2.79Å; S857-T859 PolarHBondContact OG-N 3.4Å; S857-T859 PolarHBondContact OG-OG1 2.94Å
860	C	82.6	Confident	85.5	Confident	8 Å²	8	38.9 Å²	38.9	5%	0.054	23%	0.226	C	C	.	.			trans	-151.2	106.7	172.8	-176.6	0	0	0	0	110.8	C807 S857 K862	C807-C860 HydrophobicContact CB-CB 3.77Å; C807-C860 WeakPolarHBondContact CB-SG 3.35Å; C807-C860 WeakPolarHBondContact SG-CB 3.47Å; C807-C860 CovalentContact SG-SG 2.02Å; C807-C860 PolarHBondContact SG-SG 3.45Å; S857-C860 PolarHBondContact N-O 3.09Å; S857-C860 CarbonylContact O-C 3.54Å; S857-C860 PolarHBondContact O-N 2.76Å; S857-C860 VanDerWaalsContact O-N 3.11Å; S857-C860 PolarHBondContact OG-N 3.46Å; C860-K862 VanDerWaalsContact C-N 3.28Å; C860-K862 PolarHBondContact O-N 2.97Å; C860-K862 PolarHBondContact SG-O 2.96Å
861	S	78.8	Confident	85.5	Confident	62 Å²	62	38 Å²	38	43%	0.434	22%	0.221	S	C	.	.			trans	-76.7	-11.4	-179.4	53.5	0	0	0	0	114.3	S857	S857-S861 PolarHBondContact O-N 3.24Å
862	K	81	Confident	85.6	Confident	63 Å²	63	38.4 Å²	38.4	27%	0.274	22%	0.224	S	C	.	.			trans	-88.5	123	172.8	-57.7	-69.3	-169.3	169.2	0	108.6	D794 D797 W798 C860	D794-K862 HydrophobicContact CB-CD 4.36Å; D794-K862 WeakPolarHBondContact OD1-CD 3.32Å; D794-K862 WeakPolarHBondContact OD1-CE 3.07Å; D794-K862 IonicContact OD1-NZ 2.77Å; D794-K862 PolarHBondContact OD1-NZ 3.29Å; D797-K862 HydrophobicContact CB-CD 4.42Å; D797-K862 HydrophobicContact CB-CG 4.23Å; D797-K862 VanDerWaalsContact OD2-CE 3.28Å; D797-K862 WeakPolarHBondContact OD2-CE 3.33Å; D797-K862 IonicContact OD2-NZ 2.74Å; D797-K862 PolarHBondContact OD2-NZ 3.04Å; W798-K862 HydrophobicContact CB-CB 4.3Å; W798-K862 VanDerWaalsContact CD1-O 3.31Å; C860-K862 VanDerWaalsContact C-N 3.28Å; C860-K862 PolarHBondContact O-N 2.97Å; C860-K862 PolarHBondContact SG-O 2.96Å
863	G	82.6	Confident	85.6	Confident	14 Å²	14	40.7 Å²	40.7	14%	0.144	24%	0.236	C	C	.	.			trans	-158.7	136	174.6	0	0	0	0	0	109.2	D854	D854-G863 CarbonylContact O-C 3.32Å; D854-G863 WeakPolarHBondContact O-CA 3.43Å
864	G	86.3	Confident	85.6	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	23%	0.225	C	C	.	.	S	Bend	trans	-81.3	-19.5	-170	0	0	0	0	0	114.4	F851 D854 Y868 Q869	F851-G864 WeakPolarHBondContact O-CA 3.39Å; F851-G864 PolarHBondContact O-N 3.32Å; D854-G864 PolarHBondContact O-N 3.16Å; G864-Y868 CarbonylContact O-C 3.51Å; G864-Y868 WeakPolarHBondContact O-CA 3.26Å; G864-Y868 WeakPolarHBondContact O-CB 3.41Å; G864-Y868 PolarHBondContact O-N 3.04Å; G864-Q869 PolarHBondContact O-N 2.87Å; G864-Q869 VanDerWaalsContact O-N 3.11Å
865	H	88.7	Confident	85.5	Confident	6 Å²	6	40 Å²	40	3%	0.028	24%	0.237	C	C	.	.	H	α-helix	trans	-58.7	-63.2	-169.9	-164.6	176.8	0	0	0	112.8	L321 L852 M853 D854 N855 A867 Q869	L321-H865 HydrophobicContact CD2-CB 4.22Å; L852-H865 WeakPolarHBondContact O-CA 3.41Å; M853-H865 PolarHBondContact O-ND1 2.93Å; D854-H865 WeakPolarHBondContact O-CB 3.36Å; D854-H865 PolarHBondContact O-N 3.17Å; N855-H865 WeakPolarHBondContact OD1-CB 3.46Å; N855-H865 PolarHBondContact OD1-ND1 2.75Å; H865-A867 PolarHBondContact O-N 2.91Å; H865-A867 VanDerWaalsContact O-N 3.15Å; H865-Q869 PolarHBondContact CD2-NE2 3.44Å; H865-Q869 PolarHBondContact NE2-NE2 2.99Å; H865-Q869 VanDerWaalsContact O-CB 3.27Å; H865-Q869 WeakPolarHBondContact O-CB 3.35Å
866	G	83.2	Confident	85.4	Confident	34 Å²	34	45.9 Å²	45.9	35%	0.351	27%	0.274	S	S	.	.	H	α-helix	trans	-72.9	-5.8	-172.4	0	0	0	0	0	116.6	L321	L321-G866 VanDerWaalsContact CD2-CA 3.44Å
867	A	85.2	Confident	85.4	Confident	61 Å²	61	50 Å²	50	50%	0.504	29%	0.289	S	S	.	.	H	α-helix	trans	-126.5	-32.1	-174.9	0	0	0	0	0	114.2	H865	H865-A867 PolarHBondContact O-N 2.91Å; H865-A867 VanDerWaalsContact O-N 3.15Å
868	Y	91	Very high	85.6	Confident	15 Å²	15	51.4 Å²	51.4	6%	0.059	30%	0.3	C	S	.	.	H	α-helix	trans	-129.8	-9.7	-166.2	-55.7	-53.1	0	0	0	115.2	S790 W791 D794 F851 G864 K870 S871 V872	S790-Y868 PolarHBondContact N-OH 2.89Å; W791-Y868 HydrophobicContact CB-CD1 3.59Å; W791-Y868 HydrophobicContact CB-CD2 3.82Å; W791-Y868 HydrophobicContact CB-CE1 4.01Å; W791-Y868 HydrophobicContact CB-CE2 4.25Å; W791-Y868 HydrophobicContact CB-CG 3.47Å; W791-Y868 VanDerWaalsContact CB-CG 3.47Å; D794-Y868 HydrophobicContact CB-CE2 3.85Å; D794-Y868 WeakPolarHBondContact OD2-CE2 3.19Å; D794-Y868 VanDerWaalsContact OD2-CZ 3.29Å; D794-Y868 PolarHBondContact OD2-OH 2.7Å; F851-Y868 HydrophobicContact CE1-CD2 4.22Å; F851-Y868 AromaticContact CZ-CD2 3.96Å; F851-Y868 HydrophobicContact CZ-CD2 3.96Å; F851-Y868 HydrophobicContact CZ-CE2 4.45Å; G864-Y868 CarbonylContact O-C 3.51Å; G864-Y868 WeakPolarHBondContact O-CA 3.26Å; G864-Y868 WeakPolarHBondContact O-CB 3.41Å; G864-Y868 PolarHBondContact O-N 3.04Å; Y868-K870 VanDerWaalsContact C-N 3.3Å; Y868-K870 PolarHBondContact O-N 3.02Å; Y868-S871 WeakPolarHBondContact O-CA 3.04Å; Y868-S871 WeakPolarHBondContact O-CB 3.06Å; Y868-S871 PolarHBondContact O-N 3.09Å; Y868-V872 PolarHBondContact O-N 3.41Å
869	Q	89	Confident	86	Confident	67 Å²	67	51.6 Å²	51.6	31%	0.313	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-44.5	177.3	-174.1	-161.9	65.2	0	0	112.4	M853 G864 H865 S871	M853-Q869 HydrophobicContact SD-CG 4.46Å; M853-Q869 PolarHBondContact SD-NE2 3.14Å; G864-Q869 PolarHBondContact O-N 2.87Å; G864-Q869 VanDerWaalsContact O-N 3.11Å; H865-Q869 PolarHBondContact CD2-NE2 3.44Å; H865-Q869 PolarHBondContact NE2-NE2 2.99Å; H865-Q869 VanDerWaalsContact O-CB 3.27Å; H865-Q869 WeakPolarHBondContact O-CB 3.35Å; Q869-S871 VanDerWaalsContact C-N 3.3Å; Q869-S871 PolarHBondContact O-N 3.18Å
870	K	87.9	Confident	86.4	Confident	86 Å²	86	49.6 Å²	49.6	37%	0.374	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	2.3	175	-61.2	-166.6	-178.5	-168.5	0	113.9	F248 E417 Y868	F248-K870 WeakPolarHBondContact CD1-O 3.42Å; E417-K870 IonicContact OE1-NZ 2.66Å; E417-K870 PolarHBondContact OE1-NZ 3.04Å; Y868-K870 VanDerWaalsContact C-N 3.3Å; Y868-K870 PolarHBondContact O-N 3.02Å
871	S	91.6	Very high	86.6	Confident	15 Å²	15	53.2 Å²	53.2	11%	0.105	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.7	-12.6	-179.3	-69	0	0	0	0	115	F248 Y868 Q869 S883 N884	F248-S871 WeakPolarHBondContact CE1-O 3.49Å; Y868-S871 WeakPolarHBondContact O-CA 3.04Å; Y868-S871 WeakPolarHBondContact O-CB 3.06Å; Y868-S871 PolarHBondContact O-N 3.09Å; Q869-S871 VanDerWaalsContact C-N 3.3Å; Q869-S871 PolarHBondContact O-N 3.18Å; S871-S883 CarbonylContact O-C 3.45Å; S871-S883 WeakPolarHBondContact O-CA 3.3Å; S871-S883 WeakPolarHBondContact O-CB 3.29Å; S871-N884 WeakPolarHBondContact CB-OD1 3.25Å; S871-N884 PolarHBondContact O-N 3.11Å; S871-N884 PolarHBondContact OG-OD1 2.83Å
872	V	92.9	Very high	87.3	Confident	9 Å²	9	50.3 Å²	50.3	6%	0.055	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	112.3	-177.1	-176.1	0	0	0	0	109.8	W791 I848 L852 Y868 L874 V880	W791-V872 HydrophobicContact CB-CG2 4.13Å; W791-V872 HydrophobicContact CD2-CG2 3.52Å; W791-V872 HydrophobicContact CE3-CG2 4.05Å; W791-V872 HydrophobicContact CG-CG2 3.55Å; W791-V872 HydrophobicContact CZ2-CG2 4.4Å; I848-V872 HydrophobicContact CD1-CG1 4.38Å; L852-V872 HydrophobicContact CD1-CB 3.81Å; L852-V872 HydrophobicContact CD1-CG1 3.96Å; L852-V872 HydrophobicContact CD2-CB 4.13Å; L852-V872 HydrophobicContact CD2-CG2 4.1Å; Y868-V872 PolarHBondContact O-N 3.41Å; V872-L874 HydrophobicContact CG1-CD2 4.03Å; V872-V880 HydrophobicContact CG1-CB 4.45Å; V872-V880 HydrophobicContact CG1-CG1 3.94Å; V872-V880 HydrophobicContact CG1-CG2 3.78Å
873	L	91.5	Very high	87.9	Confident	58 Å²	58	47.3 Å²	47.3	30%	0.304	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	114.9	177	-176	66.5	0	0	0	110.2	H247 I881 S882	H247-L873 HydrophobicContact CB-CD2 4.22Å; L873-I881 HydrophobicContact CD2-CB 4.27Å; L873-I881 HydrophobicContact CD2-CD1 4.46Å; L873-I881 HydrophobicContact CD2-CG2 4.32Å; L873-I881 HydrophobicContact CG-CB 4.4Å; L873-I881 HydrophobicContact CG-CD1 4.47Å; L873-I881 PolarHBondContact O-N 2.93Å; L873-S882 PolarHBondContact N-O 2.88Å
874	L	90.3	Very high	88.5	Confident	50 Å²	50	46.8 Å²	46.8	26%	0.262	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	142.2	176	-61.7	-175.5	0	0	0	112.5	I848 L852 V872 V880	I848-L874 HydrophobicContact CD1-CD2 4.13Å; I848-L874 HydrophobicContact CG1-CD2 4.39Å; I848-L874 HydrophobicContact CG2-CD1 4.2Å; I848-L874 HydrophobicContact CG2-CD2 4.08Å; L852-L874 HydrophobicContact CD1-CD1 3.92Å; L852-L874 HydrophobicContact CD1-CD2 4.47Å; L852-L874 HydrophobicContact CD1-CG 4.07Å; V872-L874 HydrophobicContact CG1-CD2 4.03Å; L874-V880 HydrophobicContact CD2-CG2 3.79Å
875	S	86.8	Confident	88.9	Confident	43 Å²	43	46.9 Å²	46.9	30%	0.301	26%	0.263	S	S	.	.			trans	-73.7	165.9	164	-175.6	0	0	0	0	111.2	E877 S878 K879	S875-E877 PolarHBondContact O-N 3.01Å; S875-E877 VanDerWaalsContact O-N 3.13Å; S875-S878 PolarHBondContact O-N 3.19Å; S875-K879 WeakPolarHBondContact CB-O 3.38Å; S875-K879 PolarHBondContact N-O 3.29Å
876	V	84.5	Confident	89.1	Confident	153 Å²	153	47.6 Å²	47.6	93%	0.927	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-22.8	171.8	-173.5	0	0	0	0	112
877	E	81.8	Confident	89.5	Confident	125 Å²	125	46.2 Å²	46.2	58%	0.584	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.6	20.2	174.4	-57.1	-176	161.6	0	0	113.6	S875 K879	S875-E877 PolarHBondContact O-N 3.01Å; S875-E877 VanDerWaalsContact O-N 3.13Å; E877-K879 HydrophobicContact CB-CD 4.29Å; E877-K879 HydrophobicContact CB-CG 4.43Å; E877-K879 PolarHBondContact O-N 2.91Å; E877-K879 WeakPolarHBondContact OE2-CE 3.29Å; E877-K879 IonicContact OE2-NZ 2.66Å; E877-K879 PolarHBondContact OE2-NZ 3.22Å
878	S	82.6	Confident	89.9	Confident	45 Å²	45	45.3 Å²	45.3	32%	0.315	24%	0.239	S	C	.	.	S	Bend	trans	55.6	14.4	-175.1	-57.8	0	0	0	0	116.1	S845 I848 S875	S845-S878 WeakPolarHBondContact O-CB 3.4Å; I848-S878 WeakPolarHBondContact CG2-O 3.49Å; S875-S878 PolarHBondContact O-N 3.19Å
879	K	86.6	Confident	90.1	Very high	113 Å²	113	44.6 Å²	44.6	49%	0.491	24%	0.236	S	C	.	.			trans	-80.6	135.1	173.4	-67.8	169.4	-178	165.1	0	110.5	S875 E877 I881	S875-K879 WeakPolarHBondContact CB-O 3.38Å; S875-K879 PolarHBondContact N-O 3.29Å; E877-K879 HydrophobicContact CB-CD 4.29Å; E877-K879 HydrophobicContact CB-CG 4.43Å; E877-K879 PolarHBondContact O-N 2.91Å; E877-K879 WeakPolarHBondContact OE2-CE 3.29Å; E877-K879 IonicContact OE2-NZ 2.66Å; E877-K879 PolarHBondContact OE2-NZ 3.22Å; K879-I881 PolarHBondContact O-N 2.95Å
880	V	88.9	Confident	90.2	Very high	15 Å²	15	42.2 Å²	42.2	9%	0.091	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	120.6	173.6	-179.2	0	0	0	0	109.5	Y748 W791 I848 V872 L874	Y748-V880 HydrophobicContact CD2-CB 3.6Å; Y748-V880 HydrophobicContact CD2-CG1 3.82Å; Y748-V880 HydrophobicContact CD2-CG2 4.23Å; Y748-V880 HydrophobicContact CE2-CB 3.89Å; Y748-V880 HydrophobicContact CE2-CG1 3.55Å; Y748-V880 HydrophobicContact CG-CB 4.36Å; W791-V880 HydrophobicContact CH2-CG2 3.96Å; W791-V880 HydrophobicContact CZ2-CG1 4.49Å; W791-V880 HydrophobicContact CZ2-CG2 4.5Å; I848-V880 HydrophobicContact CD1-CG2 3.53Å; V872-V880 HydrophobicContact CG1-CB 4.45Å; V872-V880 HydrophobicContact CG1-CG1 3.94Å; V872-V880 HydrophobicContact CG1-CG2 3.78Å; L874-V880 HydrophobicContact CD2-CG2 3.79Å
881	I	88.2	Confident	90.4	Very high	83 Å²	83	39.4 Å²	39.4	43%	0.426	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	-41.8	176	-61.5	174.8	0	0	0	110.3	L873 K879	L873-I881 HydrophobicContact CD2-CB 4.27Å; L873-I881 HydrophobicContact CD2-CD1 4.46Å; L873-I881 HydrophobicContact CD2-CG2 4.32Å; L873-I881 HydrophobicContact CG-CB 4.4Å; L873-I881 HydrophobicContact CG-CD1 4.47Å; L873-I881 PolarHBondContact O-N 2.93Å; K879-I881 PolarHBondContact O-N 2.95Å
882	S	92.2	Very high	90.4	Very high	1 Å²	1	38.7 Å²	38.7	1%	0.007	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.4	147.6	179.5	55.6	0	0	0	0	109.4	L873	L873-S882 PolarHBondContact N-O 2.88Å
883	S	94.3	Very high	90.2	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	152.7	171.3	69.6	0	0	0	0	111.8	V742 Y748 W791 S871 F885	V742-S883 PolarHBondContact N-O 2.9Å; Y748-S883 PolarHBondContact OH-OG 3.47Å; Y748-S883 VanDerWaalsContact OH-OG 3.06Å; W791-S883 VanDerWaalsContact NE1-CB 3.25Å; W791-S883 PolarHBondContact NE1-OG 2.94Å; W791-S883 VanDerWaalsContact NE1-OG 3.13Å; S871-S883 CarbonylContact O-C 3.45Å; S871-S883 WeakPolarHBondContact O-CA 3.3Å; S871-S883 WeakPolarHBondContact O-CB 3.29Å; S883-F885 WeakPolarHBondContact OG-CE2 3.39Å
884	N	94.4	Very high	90.1	Very high	4 Å²	4	43.3 Å²	43.3	2%	0.021	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	152	170.4	70.1	66.5	0	0	0	112.3	F248 F740 V741 S871	F248-N884 WeakPolarHBondContact CD1-ND2 3.48Å; F248-N884 HydrophobicContact CE2-CB 4.16Å; F248-N884 WeakPolarHBondContact CG-ND2 3.36Å; F248-N884 HydrophobicContact CZ-CB 4.18Å; F740-N884 WeakPolarHBondContact O-CA 3.41Å; V741-N884 HydrophobicContact CG2-CB 4.12Å; S871-N884 WeakPolarHBondContact CB-OD1 3.25Å; S871-N884 PolarHBondContact O-N 3.11Å; S871-N884 PolarHBondContact OG-OD1 2.83Å
885	F	94.8	Very high	90	Very high	1 Å²	1	41.4 Å²	41.4	0%	0.004	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	113.2	-178.6	-73.6	-83.6	0	0	0	108.5	Y739 F740 V742 I757 L768 V788 W791 S883	Y739-F885 CarbonylContact C-O 3.22Å; Y739-F885 WeakPolarHBondContact CA-O 3.41Å; F740-F885 HydrophobicContact CB-CB 4.29Å; F740-F885 PolarHBondContact N-O 3.22Å; F740-F885 PolarHBondContact O-N 3.36Å; V742-F885 HydrophobicContact CG2-CD2 4.14Å; V742-F885 HydrophobicContact CG2-CE2 3.93Å; I757-F885 HydrophobicContact CG2-CE1 4.01Å; I757-F885 HydrophobicContact CG2-CE2 3.84Å; I757-F885 HydrophobicContact CG2-CZ 3.32Å; L768-F885 HydrophobicContact CD1-CD2 3.72Å; L768-F885 HydrophobicContact CD1-CE2 4Å; L768-F885 HydrophobicContact CD1-CG 4.38Å; L768-F885 HydrophobicContact CD2-CB 3.88Å; L768-F885 HydrophobicContact CD2-CD1 4.09Å; L768-F885 HydrophobicContact CD2-CD2 3.87Å; L768-F885 HydrophobicContact CD2-CE2 4.46Å; L768-F885 HydrophobicContact CD2-CG 3.67Å; L768-F885 HydrophobicContact CG-CD2 4.5Å; V788-F885 HydrophobicContact CG1-CB 3.73Å; V788-F885 HydrophobicContact CG1-CD1 3.75Å; V788-F885 HydrophobicContact CG1-CG 4.18Å; W791-F885 AromaticContact CD1-CE1 3.64Å; W791-F885 AromaticContact CD1-CZ 3.71Å; W791-F885 AromaticContact NE1-CE1 3.66Å; W791-F885 AromaticContact NE1-CE2 3.75Å; W791-F885 AromaticContact NE1-CZ 3.2Å; S883-F885 WeakPolarHBondContact OG-CE2 3.39Å
886	A	93	Very high	90.2	Very high	22 Å²	22	42.4 Å²	42.4	18%	0.182	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	143.6	-169.3	0	0	0	0	0	112.6	Y739 V788 S789	Y739-A886 HydrophobicContact CD1-CB 3.77Å; Y739-A886 HydrophobicContact CE1-CB 3.74Å; V788-A886 WeakPolarHBondContact CA-O 3.44Å; S789-A886 PolarHBondContact N-O 2.74Å; S789-A886 PolarHBondContact OG-O 3.2Å
887	T	92.6	Very high	90.5	Very high	4 Å²	4	36.3 Å²	36.3	3%	0.025	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	-177.1	165.6	-178.4	0	0	0	0	109.5	P737 V738 F740 V772 I784 A786 P787 V788	P737-T887 CarbonylContact C-O 3.6Å; P737-T887 WeakPolarHBondContact CA-O 3.29Å; V738-T887 HydrophobicContact CG1-CG2 3.63Å; V738-T887 PolarHBondContact N-O 3.19Å; V738-T887 PolarHBondContact O-N 2.56Å; F740-T887 HydrophobicContact CD2-CG2 4.37Å; F740-T887 HydrophobicContact CE2-CG2 3.93Å; V772-T887 HydrophobicContact CG1-CG2 4.08Å; I784-T887 HydrophobicContact CG2-CG2 4.14Å; A786-T887 PolarHBondContact O-OG1 3.28Å; P787-T887 WeakPolarHBondContact O-CB 3.28Å; P787-T887 PolarHBondContact O-OG1 3.12Å; V788-T887 HydrophobicContact CG2-CG2 4.11Å
888	Y	93.1	Very high	91	Very high	42 Å²	42	31.5 Å²	31.5	17%	0.165	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	140.9	178.4	-68.5	-91.1	0	0	0	111.8	Y393 V394 V734 P737 A785	Y393-Y888 AromaticContact CE2-CD2 3.95Å; Y393-Y888 HydrophobicContact CE2-CD2 3.95Å; Y393-Y888 HydrophobicContact CE2-CE2 4.06Å; V394-Y888 HydrophobicContact CG1-CE1 4.17Å; V394-Y888 HydrophobicContact CG1-CE2 4.39Å; V734-Y888 HydrophobicContact CB-CG 4.48Å; V734-Y888 HydrophobicContact CG2-CD1 4.12Å; V734-Y888 HydrophobicContact CG2-CG 4.43Å; P737-Y888 HydrophobicContact CB-CD1 4.2Å; P737-Y888 HydrophobicContact CB-CE1 4.11Å; A785-Y888 PolarHBondContact N-O 3.22Å
889	H	95.1	Very high	91.5	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.158	C	C	.	.	B	Isolated β-bridge	trans	-68.1	160.3	163.8	-81.3	-64.1	0	0	0	111.1	G735 P736 Y783 L892 F933 Y934	G735-H889 PolarHBondContact N-O 3.08Å; P736-H889 WeakPolarHBondContact O-CB 3.37Å; P736-H889 PolarHBondContact O-N 3.44Å; Y783-H889 CarbonylContact O-C 2.86Å; Y783-H889 WeakPolarHBondContact O-CA 3.42Å; Y783-H889 WeakPolarHBondContact O-CB 3.18Å; Y783-H889 PolarHBondContact O-ND1 2.67Å; H889-L892 HydrophobicContact CB-CD1 4.4Å; H889-F933 AromaticContact CD2-CE1 3.73Å; H889-F933 AromaticContact CD2-CZ 3.88Å; H889-F933 AromaticContact NE2-CZ 3.87Å; H889-Y934 AromaticContact NE2-CE1 3.76Å; H889-Y934 AromaticContact NE2-CZ 3.74Å; H889-Y934 PolarHBondContact NE2-OH 3.33Å
890	S	92	Very high	91.8	Very high	18 Å²	18	26 Å²	26	13%	0.126	14%	0.144	C	C	.	.	P	Polyproline II helix	trans	-65.9	167.1	162.7	64.3	0	0	0	0	111	G735 Y783 L892	G735-S890 WeakPolarHBondContact CA-O 3.07Å; Y783-S890 WeakPolarHBondContact CA-OG 3.28Å; Y783-S890 WeakPolarHBondContact CD1-OG 3.49Å; Y783-S890 PolarHBondContact O-N 2.66Å; S890-L892 WeakPolarHBondContact O-CD2 3.1Å; S890-L892 WeakPolarHBondContact O-CG 3.42Å; S890-L892 PolarHBondContact O-N 3.36Å
891	V	91.2	Very high	92	Very high	26 Å²	26	25.3 Å²	25.3	16%	0.158	14%	0.14	C	C	.	.	P	Polyproline II helix	trans	-59.6	121.8	174.4	-168.8	0	0	0	0	109.9	F728 L732 A733 K893	F728-V891 HydrophobicContact CE1-CG1 4.28Å; F728-V891 HydrophobicContact CZ-CG1 4.43Å; L732-V891 VanDerWaalsContact O-CG2 3.24Å; L732-V891 WeakPolarHBondContact O-CG2 3.37Å; A733-V891 WeakPolarHBondContact O-CG2 3.34Å; V891-K893 HydrophobicContact CG1-CG 4.07Å
892	L	91.8	Very high	92.3	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.12	C	C	.	.	P	Polyproline II helix	trans	-102.2	119.7	-180	-48.8	179.7	0	0	0	107.6	F728 P736 Y783 H889 S890 D897 Y898 A901 F933	F728-L892 WeakPolarHBondContact CE1-O 3.35Å; P736-L892 HydrophobicContact CG-CD1 4.05Å; Y783-L892 HydrophobicContact CD1-CD2 3.53Å; Y783-L892 HydrophobicContact CE1-CD2 4.21Å; Y783-L892 HydrophobicContact CG-CD2 4.4Å; H889-L892 HydrophobicContact CB-CD1 4.4Å; S890-L892 WeakPolarHBondContact O-CD2 3.1Å; S890-L892 WeakPolarHBondContact O-CG 3.42Å; S890-L892 PolarHBondContact O-N 3.36Å; L892-D897 HydrophobicContact CB-CB 4.04Å; L892-D897 HydrophobicContact CD2-CB 4.15Å; L892-Y898 HydrophobicContact CB-CD1 3.95Å; L892-Y898 HydrophobicContact CB-CD2 3.95Å; L892-Y898 HydrophobicContact CB-CE1 3.81Å; L892-Y898 HydrophobicContact CB-CE2 3.76Å; L892-Y898 HydrophobicContact CB-CG 4.05Å; L892-Y898 HydrophobicContact CD1-CD1 3.45Å; L892-Y898 VanDerWaalsContact CD1-CD1 3.45Å; L892-Y898 HydrophobicContact CD1-CE1 3.75Å; L892-Y898 HydrophobicContact CD1-CG 4.04Å; L892-Y898 HydrophobicContact CG-CD1 4.33Å; L892-Y898 HydrophobicContact CG-CE1 4.38Å; L892-A901 HydrophobicContact CD1-CB 4.14Å; L892-A901 HydrophobicContact CD2-CB 3.88Å; L892-F933 HydrophobicContact CD1-CE1 3.89Å; L892-F933 HydrophobicContact CD1-CE2 4.14Å; L892-F933 HydrophobicContact CD1-CZ 3.52Å
893	K	88.3	Confident	92.3	Very high	92 Å²	92	24.6 Å²	24.6	40%	0.4	14%	0.136	S	C	.	.			trans	-111.1	-38.7	-165.5	-59.5	-158.5	-178.2	-165.2	0	113.7	N729 V891 D897	N729-K893 PolarHBondContact O-NZ 3.39Å; N729-K893 WeakPolarHBondContact OD1-CA 2.97Å; N729-K893 WeakPolarHBondContact OD1-CB 3.44Å; N729-K893 WeakPolarHBondContact OD1-CD 3.49Å; N729-K893 WeakPolarHBondContact OD1-CG 3.3Å; V891-K893 HydrophobicContact CG1-CG 4.07Å; K893-D897 PolarHBondContact N-OD2 2.75Å
894	N	88.9	Confident	92.3	Very high	72 Å²	72	25.7 Å²	25.7	39%	0.385	14%	0.142	S	C	.	.	S	Bend	trans	-120.6	159.7	175.9	-55.8	-51.4	0	0	0	109.7	K712 S896 D897 Y898	K712-N894 PolarHBondContact NZ-OD1 2.87Å; N894-S896 PolarHBondContact O-N 2.81Å; N894-D897 PolarHBondContact N-OD2 3.24Å; N894-D897 WeakPolarHBondContact O-CB 3.42Å; N894-D897 PolarHBondContact O-N 2.95Å; N894-Y898 WeakPolarHBondContact O-CD2 3.29Å
895	S	89.8	Confident	92.2	Very high	11 Å²	11	25.5 Å²	25.5	8%	0.077	14%	0.141	C	C	.	.	H	α-helix	trans	-50.7	-30.6	175.2	43	0	0	0	0	114.3	D710 D897 Y898 I899	D710-S895 VanDerWaalsContact OD1-CB 3.27Å; D710-S895 WeakPolarHBondContact OD1-CB 3.34Å; D710-S895 PolarHBondContact OD1-N 2.83Å; D710-S895 PolarHBondContact OD1-OG 2.9Å; S895-D897 VanDerWaalsContact C-N 3.31Å; S895-D897 PolarHBondContact O-N 3.28Å; S895-Y898 PolarHBondContact O-N 3.02Å; S895-I899 WeakPolarHBondContact O-CD1 3.35Å; S895-I899 VanDerWaalsContact O-CG1 3.26Å; S895-I899 WeakPolarHBondContact O-CG1 3.4Å; S895-I899 PolarHBondContact O-N 3.49Å; S895-I899 VanDerWaalsContact O-N 3.07Å
896	S	89.4	Confident	92.2	Very high	64 Å²	64	26.9 Å²	26.9	45%	0.448	15%	0.146	S	C	.	.	H	α-helix	trans	-57.4	-38.4	171.1	58.2	0	0	0	0	113.8	N894 I899 A900	N894-S896 PolarHBondContact O-N 2.81Å; S896-I899 PolarHBondContact O-N 2.85Å; S896-A900 VanDerWaalsContact O-CB 3.31Å; S896-A900 WeakPolarHBondContact O-CB 3.47Å; S896-A900 PolarHBondContact O-N 2.87Å
897	D	91.7	Very high	92.2	Very high	25 Å²	25	27.7 Å²	27.7	13%	0.134	15%	0.153	C	C	.	.	H	α-helix	trans	-71.7	-42.7	-178.4	-59.8	-42.3	0	0	0	111	Y783 L892 K893 N894 S895 I899 A900 A901	Y783-D897 HydrophobicContact CD1-CB 4.43Å; Y783-D897 HydrophobicContact CE1-CB 3.66Å; Y783-D897 PolarHBondContact OH-OD1 3.08Å; L892-D897 HydrophobicContact CB-CB 4.04Å; L892-D897 HydrophobicContact CD2-CB 4.15Å; K893-D897 PolarHBondContact N-OD2 2.75Å; N894-D897 PolarHBondContact N-OD2 3.24Å; N894-D897 WeakPolarHBondContact O-CB 3.42Å; N894-D897 PolarHBondContact O-N 2.95Å; S895-D897 VanDerWaalsContact C-N 3.31Å; S895-D897 PolarHBondContact O-N 3.28Å; D897-I899 VanDerWaalsContact C-N 3.33Å; D897-I899 PolarHBondContact O-N 3.31Å; D897-A900 PolarHBondContact O-N 3.32Å; D897-A901 WeakPolarHBondContact O-CB 3.48Å; D897-A901 PolarHBondContact O-N 3.47Å
898	Y	93.1	Very high	92.2	Very high	24 Å²	24	27.5 Å²	27.5	9%	0.094	15%	0.152	C	C	.	.	H	α-helix	trans	-62.2	-40.7	174.4	-66.5	-89.9	0	0	0	111.6	L892 N894 S895 L902 F933 Y937	L892-Y898 HydrophobicContact CB-CD1 3.95Å; L892-Y898 HydrophobicContact CB-CD2 3.95Å; L892-Y898 HydrophobicContact CB-CE1 3.81Å; L892-Y898 HydrophobicContact CB-CE2 3.76Å; L892-Y898 HydrophobicContact CB-CG 4.05Å; L892-Y898 HydrophobicContact CD1-CD1 3.45Å; L892-Y898 VanDerWaalsContact CD1-CD1 3.45Å; L892-Y898 HydrophobicContact CD1-CE1 3.75Å; L892-Y898 HydrophobicContact CD1-CG 4.04Å; L892-Y898 HydrophobicContact CG-CD1 4.33Å; L892-Y898 HydrophobicContact CG-CE1 4.38Å; N894-Y898 WeakPolarHBondContact O-CD2 3.29Å; S895-Y898 PolarHBondContact O-N 3.02Å; Y898-L902 WeakPolarHBondContact O-CB 3.29Å; Y898-L902 PolarHBondContact O-N 2.89Å; Y898-L902 VanDerWaalsContact O-N 3.07Å; Y898-F933 HydrophobicContact CD1-CB 4.34Å; Y898-F933 HydrophobicContact CD1-CD1 4.31Å; Y898-F933 AromaticContact CD1-CD2 3.55Å; Y898-F933 HydrophobicContact CD1-CD2 3.55Å; Y898-F933 HydrophobicContact CD1-CE1 4.5Å; Y898-F933 AromaticContact CD1-CE2 3.74Å; Y898-F933 HydrophobicContact CD1-CE2 3.74Å; Y898-F933 AromaticContact CD1-CG 3.82Å; Y898-F933 HydrophobicContact CD1-CG 3.82Å; Y898-F933 HydrophobicContact CD1-CZ 4.19Å; Y898-F933 HydrophobicContact CE1-CD2 4.5Å; Y898-F933 HydrophobicContact CE1-CG 4.36Å; Y898-F933 HydrophobicContact CG-CD2 4.29Å; Y898-F933 HydrophobicContact CG-CE2 4.34Å; Y898-Y937 HydrophobicContact CD1-CD2 4.37Å; Y898-Y937 AromaticContact CD1-CE2 3.95Å; Y898-Y937 HydrophobicContact CD1-CE2 3.95Å; Y898-Y937 HydrophobicContact CD2-CE1 4.23Å; Y898-Y937 HydrophobicContact CD2-CE2 4.46Å; Y898-Y937 AromaticContact CD2-CZ 3.93Å; Y898-Y937 HydrophobicContact CG-CD1 4.46Å; Y898-Y937 HydrophobicContact CG-CD2 4.31Å; Y898-Y937 HydrophobicContact CG-CE1 4.07Å; Y898-Y937 AromaticContact CG-CE2 3.9Å; Y898-Y937 HydrophobicContact CG-CE2 3.9Å; Y898-Y937 AromaticContact CG-CZ 3.76Å
899	I	92.6	Very high	92.2	Very high	18 Å²	18	25.5 Å²	25.5	9%	0.092	14%	0.144	C	C	.	.	H	α-helix	trans	-66	-44.6	175.2	-65.3	164	0	0	0	110.9	L707 S895 S896 D897 L902 I903 Y937 Y940 L941	L707-I899 HydrophobicContact CB-CD1 4.27Å; L707-I899 WeakPolarHBondContact O-CD1 3.21Å; S895-I899 WeakPolarHBondContact O-CD1 3.35Å; S895-I899 VanDerWaalsContact O-CG1 3.26Å; S895-I899 WeakPolarHBondContact O-CG1 3.4Å; S895-I899 PolarHBondContact O-N 3.49Å; S895-I899 VanDerWaalsContact O-N 3.07Å; S896-I899 PolarHBondContact O-N 2.85Å; D897-I899 VanDerWaalsContact C-N 3.33Å; D897-I899 PolarHBondContact O-N 3.31Å; I899-L902 PolarHBondContact O-N 3.36Å; I899-I903 HydrophobicContact CG2-CD1 3.89Å; I899-I903 VanDerWaalsContact O-CG1 3.29Å; I899-I903 WeakPolarHBondContact O-CG1 3.43Å; I899-I903 PolarHBondContact O-N 2.86Å; I899-Y937 HydrophobicContact CG1-CD1 4.16Å; I899-Y940 HydrophobicContact CD1-CD2 3.98Å; I899-Y940 HydrophobicContact CD1-CG 3.81Å; I899-Y940 HydrophobicContact CG1-CD2 4.12Å; I899-Y940 HydrophobicContact CG1-CG 4.3Å; I899-L941 HydrophobicContact CG2-CD2 4.16Å
900	A	91.6	Very high	92.1	Very high	24 Å²	24	28.1 Å²	28.1	20%	0.198	17%	0.166	C	C	.	.	H	α-helix	trans	-65	-43.9	178.5	0	0	0	0	0	112.3	Y783 S896 D897 L902 I903 N904	Y783-A900 HydrophobicContact CD2-CB 4.1Å; Y783-A900 HydrophobicContact CE2-CB 3.48Å; Y783-A900 VanDerWaalsContact CE2-CB 3.48Å; S896-A900 VanDerWaalsContact O-CB 3.31Å; S896-A900 WeakPolarHBondContact O-CB 3.47Å; S896-A900 PolarHBondContact O-N 2.87Å; D897-A900 PolarHBondContact O-N 3.32Å; A900-L902 PolarHBondContact O-N 2.84Å; A900-I903 PolarHBondContact O-N 3.35Å; A900-N904 WeakPolarHBondContact O-CB 3.47Å; A900-N904 PolarHBondContact O-N 3.43Å; A900-N904 PolarHBondContact O-ND2 2.67Å; A900-N904 VanDerWaalsContact O-ND2 3.15Å
901	A	93.9	Very high	92	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-59.3	-43.5	175.6	0	0	0	0	0	112.2	Y783 L892 D897 N904 A905 F933	Y783-A901 HydrophobicContact CD1-CB 4.38Å; Y783-A901 HydrophobicContact CG-CB 4.1Å; L892-A901 HydrophobicContact CD1-CB 4.14Å; L892-A901 HydrophobicContact CD2-CB 3.88Å; D897-A901 WeakPolarHBondContact O-CB 3.48Å; D897-A901 PolarHBondContact O-N 3.47Å; A901-N904 PolarHBondContact O-N 3.33Å; A901-A905 VanDerWaalsContact O-CB 3.25Å; A901-A905 WeakPolarHBondContact O-CB 3.44Å; A901-A905 PolarHBondContact O-N 3.18Å; A901-F933 HydrophobicContact CB-CZ 4.27Å
902	L	94.3	Very high	92.1	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-62.6	-43.5	174.6	174	59.8	0	0	0	112.3	Y898 I899 A900 R906 Y934 E938 L941	Y898-L902 WeakPolarHBondContact O-CB 3.29Å; Y898-L902 PolarHBondContact O-N 2.89Å; Y898-L902 VanDerWaalsContact O-N 3.07Å; I899-L902 PolarHBondContact O-N 3.36Å; A900-L902 PolarHBondContact O-N 2.84Å; L902-R906 HydrophobicContact CD1-CG 4.21Å; L902-R906 WeakPolarHBondContact O-CB 3.39Å; L902-R906 WeakPolarHBondContact O-CG 3.48Å; L902-R906 PolarHBondContact O-N 3.21Å; L902-R906 VanDerWaalsContact O-N 3.11Å; L902-Y934 HydrophobicContact CB-CD1 4.41Å; L902-Y934 HydrophobicContact CB-CE1 4.39Å; L902-Y934 HydrophobicContact CD1-CD1 3.76Å; L902-Y934 HydrophobicContact CD1-CD2 3.76Å; L902-Y934 HydrophobicContact CD1-CE1 4.06Å; L902-Y934 HydrophobicContact CD1-CE2 4.07Å; L902-Y934 HydrophobicContact CD1-CG 3.6Å; L902-E938 HydrophobicContact CD2-CB 4.3Å; L902-L941 HydrophobicContact CD2-CD1 3.89Å; L902-L941 HydrophobicContact CD2-CG 4.33Å; L902-L941 HydrophobicContact CG-CD1 4.29Å
903	I	93.5	Very high	92.1	Very high	69 Å²	69	31.1 Å²	31.1	35%	0.354	18%	0.181	S	C	.	.	H	α-helix	trans	-63.4	-49	177.4	-69.7	166.7	0	0	0	110.5	I899 A900 R906 A907 L941	I899-I903 HydrophobicContact CG2-CD1 3.89Å; I899-I903 VanDerWaalsContact O-CG1 3.29Å; I899-I903 WeakPolarHBondContact O-CG1 3.43Å; I899-I903 PolarHBondContact O-N 2.86Å; A900-I903 PolarHBondContact O-N 3.35Å; I903-R906 PolarHBondContact O-N 3.43Å; I903-A907 PolarHBondContact O-N 2.63Å; I903-L941 HydrophobicContact CD1-CD2 3.81Å; I903-L941 HydrophobicContact CG1-CD2 3.56Å
904	N	92.5	Very high	92.2	Very high	23 Å²	23	29.4 Å²	29.4	12%	0.123	18%	0.184	C	C	.	.	H	α-helix	trans	-66.4	-44.7	-177.3	-74.4	-38.1	0	0	0	112.3	R781 S782 A900 A901 R906 A907 I908	R781-N904 PolarHBondContact O-ND2 3.11Å; S782-N904 WeakPolarHBondContact O-CB 3.42Å; A900-N904 WeakPolarHBondContact O-CB 3.47Å; A900-N904 PolarHBondContact O-N 3.43Å; A900-N904 PolarHBondContact O-ND2 2.67Å; A900-N904 VanDerWaalsContact O-ND2 3.15Å; A901-N904 PolarHBondContact O-N 3.33Å; N904-R906 VanDerWaalsContact C-N 3.31Å; N904-R906 PolarHBondContact O-N 2.85Å; N904-A907 PolarHBondContact O-N 3.4Å; N904-A907 VanDerWaalsContact O-N 3.17Å; N904-I908 VanDerWaalsContact O-CG1 3.29Å; N904-I908 WeakPolarHBondContact O-CG1 3.45Å; N904-I908 PolarHBondContact O-N 3.46Å
905	A	94.2	Very high	92.2	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-61.1	-40.1	175.5	0	0	0	0	0	111.8	A901 I908 A909 P929 Y934	A901-A905 VanDerWaalsContact O-CB 3.25Å; A901-A905 WeakPolarHBondContact O-CB 3.44Å; A901-A905 PolarHBondContact O-N 3.18Å; A905-I908 PolarHBondContact O-N 2.97Å; A905-A909 WeakPolarHBondContact O-CB 3.03Å; A905-A909 PolarHBondContact O-N 3.13Å; A905-P929 HydrophobicContact CB-CB 3.88Å; A905-P929 HydrophobicContact CB-CG 3.98Å; A905-Y934 WeakPolarHBondContact CB-OH 3.18Å
906	R	94.3	Very high	92.2	Very high	30 Å²	30	26 Å²	26	11%	0.113	17%	0.166	C	C	.	.	H	α-helix	trans	-68.4	-32.7	175.3	-77.4	179.5	162.7	-177.3	-3.7	112.9	E240 L902 I903 N904 A910 P929 E938	E240-R906 IonicContact OE2-CZ 3.86Å; E240-R906 IonicContact OE2-NE 3.68Å; E240-R906 IonicContact OE2-NH2 3.24Å; E240-R906 PolarHBondContact OE2-NH2 3.1Å; L902-R906 HydrophobicContact CD1-CG 4.21Å; L902-R906 WeakPolarHBondContact O-CB 3.39Å; L902-R906 WeakPolarHBondContact O-CG 3.48Å; L902-R906 PolarHBondContact O-N 3.21Å; L902-R906 VanDerWaalsContact O-N 3.11Å; I903-R906 PolarHBondContact O-N 3.43Å; N904-R906 VanDerWaalsContact C-N 3.31Å; N904-R906 PolarHBondContact O-N 2.85Å; R906-A910 VanDerWaalsContact O-CB 3.28Å; R906-A910 WeakPolarHBondContact O-CB 3.11Å; R906-A910 PolarHBondContact O-N 2.79Å; R906-P929 HydrophobicContact CG-CG 3.79Å; R906-E938 IonicContact CZ-OE1 2.7Å; R906-E938 IonicContact NH1-OE1 3.04Å; R906-E938 PolarHBondContact NH1-OE1 2.8Å; R906-E938 IonicContact NH2-OE1 3.86Å; R906-E938 PolarHBondContact NH2-OE1 3.24Å
907	A	92.5	Very high	92.1	Very high	39 Å²	39	25 Å²	25	32%	0.322	16%	0.155	S	C	.	.	H	α-helix	trans	-68.6	-43.4	172.2	0	0	0	0	0	112.2	I903 N904 A910 N911	I903-A907 PolarHBondContact O-N 2.63Å; N904-A907 PolarHBondContact O-N 3.4Å; N904-A907 VanDerWaalsContact O-N 3.17Å; A907-A910 PolarHBondContact O-N 2.96Å; A907-N911 PolarHBondContact O-N 2.58Å
908	I	92.2	Very high	91.7	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-57.4	-53.3	172.8	-67.7	163.1	0	0	0	110.1	Y93 F740 V772 A775 I784 N904 A905 A910 N911 I912	Y93-I908 HydrophobicContact CD1-CG1 4.44Å; Y93-I908 HydrophobicContact CE1-CD1 4.13Å; Y93-I908 HydrophobicContact CE1-CG1 3.44Å; Y93-I908 VanDerWaalsContact CE1-CG1 3.44Å; F740-I908 HydrophobicContact CE1-CB 4.19Å; F740-I908 HydrophobicContact CE1-CG2 3.69Å; F740-I908 HydrophobicContact CZ-CB 4.46Å; F740-I908 HydrophobicContact CZ-CG2 3.91Å; V772-I908 HydrophobicContact CG2-CG2 3.97Å; A775-I908 HydrophobicContact CB-CD1 3.7Å; A775-I908 HydrophobicContact CB-CG1 4.46Å; I784-I908 HydrophobicContact CG1-CD1 4.05Å; N904-I908 VanDerWaalsContact O-CG1 3.29Å; N904-I908 WeakPolarHBondContact O-CG1 3.45Å; N904-I908 PolarHBondContact O-N 3.46Å; A905-I908 PolarHBondContact O-N 2.97Å; I908-A910 VanDerWaalsContact C-N 3.28Å; I908-A910 PolarHBondContact O-N 3.27Å; I908-N911 PolarHBondContact O-N 2.93Å; I908-N911 VanDerWaalsContact O-N 3.15Å; I908-I912 HydrophobicContact CG2-CD1 3.6Å; I908-I912 HydrophobicContact CG2-CG1 4.42Å; I908-I912 VanDerWaalsContact O-CG1 3.3Å; I908-I912 WeakPolarHBondContact O-CG1 3.35Å; I908-I912 PolarHBondContact O-N 2.93Å
909	A	93.5	Very high	90.9	Very high	1 Å²	1	31.5 Å²	31.5	1%	0.008	22%	0.215	C	C	.	.	H	α-helix	trans	-62.6	-32.5	179.6	0	0	0	0	0	113.3	F740 A905 T913 V927 P929	F740-A909 HydrophobicContact CD1-CB 4.24Å; F740-A909 HydrophobicContact CE1-CB 4.28Å; A905-A909 WeakPolarHBondContact O-CB 3.03Å; A905-A909 PolarHBondContact O-N 3.13Å; A909-T913 VanDerWaalsContact O-CB 3.28Å; A909-T913 WeakPolarHBondContact O-CB 3.45Å; A909-T913 PolarHBondContact O-N 2.84Å; A909-T913 PolarHBondContact O-OG1 3.1Å; A909-V927 HydrophobicContact CB-CG1 4.29Å; A909-P929 HydrophobicContact CB-CG 4.16Å
910	A	92.7	Very high	89.8	Confident	55 Å²	55	33 Å²	33	46%	0.455	23%	0.227	S	C	.	.	H	α-helix	trans	-68.8	-40.7	173.7	0	0	0	0	0	112.5	R906 A907 I908 T913 A914	R906-A910 VanDerWaalsContact O-CB 3.28Å; R906-A910 WeakPolarHBondContact O-CB 3.11Å; R906-A910 PolarHBondContact O-N 2.79Å; A907-A910 PolarHBondContact O-N 2.96Å; I908-A910 VanDerWaalsContact C-N 3.28Å; I908-A910 PolarHBondContact O-N 3.27Å; A910-T913 WeakPolarHBondContact O-CB 3.38Å; A910-T913 PolarHBondContact O-N 2.88Å; A910-A914 WeakPolarHBondContact O-CB 3.46Å; A910-A914 PolarHBondContact O-N 2.9Å
911	N	91	Very high	88.6	Confident	76 Å²	76	36.3 Å²	36.3	41%	0.406	25%	0.254	S	S	.	.	H	α-helix	trans	-68.4	-38.3	175.5	-74.2	-19.5	0	0	0	112.1	Y93 Q771 A907 I908 A914 A915	Y93-N911 PolarHBondContact OH-ND2 2.83Å; Q771-N911 PolarHBondContact NE2-O 3.2Å; A907-N911 PolarHBondContact O-N 2.58Å; I908-N911 PolarHBondContact O-N 2.93Å; I908-N911 VanDerWaalsContact O-N 3.15Å; N911-A914 PolarHBondContact O-N 3.02Å; N911-A915 WeakPolarHBondContact O-CB 3.48Å; N911-A915 PolarHBondContact O-N 2.98Å
912	I	91.7	Very high	87	Confident	1 Å²	1	44.3 Å²	44.3	1%	0.005	30%	0.298	C	S	.	.	H	α-helix	trans	-64.3	-44.5	172.1	-63.2	165	0	0	0	110.3	F740 L768 Q771 V772 I908 A914 A915 I916 V927	F740-I912 HydrophobicContact CD1-CD1 4.48Å; L768-I912 HydrophobicContact CB-CG2 3.88Å; L768-I912 HydrophobicContact CD1-CG2 4.21Å; L768-I912 HydrophobicContact CG-CD1 4.3Å; L768-I912 HydrophobicContact CG-CG2 4.02Å; Q771-I912 HydrophobicContact CB-CD1 4.21Å; Q771-I912 HydrophobicContact CB-CG1 3.88Å; Q771-I912 HydrophobicContact CG-CG1 4.18Å; V772-I912 HydrophobicContact CG2-CD1 3.92Å; I908-I912 HydrophobicContact CG2-CD1 3.6Å; I908-I912 HydrophobicContact CG2-CG1 4.42Å; I908-I912 VanDerWaalsContact O-CG1 3.3Å; I908-I912 WeakPolarHBondContact O-CG1 3.35Å; I908-I912 PolarHBondContact O-N 2.93Å; I912-A914 VanDerWaalsContact C-N 3.31Å; I912-A914 PolarHBondContact O-N 2.96Å; I912-A915 PolarHBondContact O-N 2.98Å; I912-I916 HydrophobicContact CG2-CD1 3.75Å; I912-I916 HydrophobicContact CG2-CG1 4.36Å; I912-I916 WeakPolarHBondContact O-CB 3.13Å; I912-I916 WeakPolarHBondContact O-CG1 3.37Å; I912-I916 PolarHBondContact O-N 2.63Å; I912-V927 HydrophobicContact CG2-CB 4.25Å; I912-V927 HydrophobicContact CG2-CG1 4.27Å; I912-V927 HydrophobicContact CG2-CG2 3.9Å
913	T	92.3	Very high	85.4	Confident	29 Å²	29	46.3 Å²	46.3	18%	0.178	31%	0.312	C	S	.	.	H	α-helix	trans	-58.4	-42.4	174	-62	0	0	0	0	111.5	A909 A910 N917 V927	A909-T913 VanDerWaalsContact O-CB 3.28Å; A909-T913 WeakPolarHBondContact O-CB 3.45Å; A909-T913 PolarHBondContact O-N 2.84Å; A909-T913 PolarHBondContact O-OG1 3.1Å; A910-T913 WeakPolarHBondContact O-CB 3.38Å; A910-T913 PolarHBondContact O-N 2.88Å; T913-N917 PolarHBondContact O-N 3.13Å; T913-N917 PolarHBondContact O-ND2 2.87Å; T913-V927 PolarHBondContact OG1-N 2.67Å; T913-V927 PolarHBondContact OG1-O 2.63Å
914	A	90.1	Very high	84.6	Confident	56 Å²	56	52 Å²	52	46%	0.463	34%	0.336	S	S	.	.	H	α-helix	trans	-62	-54.3	176.4	0	0	0	0	0	111.1	A910 N911 I912 I916 N917 V918	A910-A914 WeakPolarHBondContact O-CB 3.46Å; A910-A914 PolarHBondContact O-N 2.9Å; N911-A914 PolarHBondContact O-N 3.02Å; I912-A914 VanDerWaalsContact C-N 3.31Å; I912-A914 PolarHBondContact O-N 2.96Å; A914-I916 PolarHBondContact O-N 3.02Å; A914-N917 PolarHBondContact O-N 2.9Å; A914-V918 WeakPolarHBondContact O-CG2 3.49Å; A914-V918 PolarHBondContact O-N 2.62Å; A914-V918 VanDerWaalsContact O-N 3.14Å
915	A	88.9	Confident	84.4	Confident	10 Å²	10	51 Å²	51	8%	0.083	33%	0.331	C	S	.	.	H	α-helix	trans	-54.9	-47.2	179.4	0	0	0	0	0	112.6	K756 D766 N911 I912 N917 V918	K756-A915 PolarHBondContact NZ-O 2.83Å; D766-A915 HydrophobicContact CB-CB 4.4Å; D766-A915 WeakPolarHBondContact OD2-CB 3.4Å; N911-A915 WeakPolarHBondContact O-CB 3.48Å; N911-A915 PolarHBondContact O-N 2.98Å; I912-A915 PolarHBondContact O-N 2.98Å; A915-N917 VanDerWaalsContact C-N 3.35Å; A915-N917 PolarHBondContact O-N 3.18Å; A915-V918 PolarHBondContact O-N 3.3Å
916	I	89.6	Confident	84.3	Confident	3 Å²	3	55.1 Å²	55.1	2%	0.015	35%	0.35	C	S	.	.	H	α-helix	trans	-56.5	-46.3	177.3	-76.1	174.9	0	0	0	111.6	Y746 K756 I757 I912 A914 V918 V925 V927	Y746-I916 HydrophobicContact CD2-CG2 4.2Å; Y746-I916 HydrophobicContact CE2-CG2 3.68Å; K756-I916 HydrophobicContact CB-CG1 4.37Å; K756-I916 PolarHBondContact NZ-O 3.19Å; I757-I916 HydrophobicContact CG1-CD1 4.44Å; I912-I916 HydrophobicContact CG2-CD1 3.75Å; I912-I916 HydrophobicContact CG2-CG1 4.36Å; I912-I916 WeakPolarHBondContact O-CB 3.13Å; I912-I916 WeakPolarHBondContact O-CG1 3.37Å; I912-I916 PolarHBondContact O-N 2.63Å; A914-I916 PolarHBondContact O-N 3.02Å; I916-V918 PolarHBondContact O-N 3.37Å; I916-V925 HydrophobicContact CG2-CB 4.18Å; I916-V925 HydrophobicContact CG2-CG1 4.08Å; I916-V927 HydrophobicContact CD1-CG2 3.68Å
917	N	88.5	Confident	84.3	Confident	41 Å²	41	53.8 Å²	53.8	22%	0.219	35%	0.346	C	S	.	.	H	α-helix	trans	-80.2	-7.6	-177.8	-66.4	-68.7	0	0	0	114.6	T913 A914 A915 G919 S920 S923 V925	T913-N917 PolarHBondContact O-N 3.13Å; T913-N917 PolarHBondContact O-ND2 2.87Å; A914-N917 PolarHBondContact O-N 2.9Å; A915-N917 VanDerWaalsContact C-N 3.35Å; A915-N917 PolarHBondContact O-N 3.18Å; N917-G919 PolarHBondContact O-N 3.44Å; N917-S920 PolarHBondContact O-N 2.95Å; N917-S923 PolarHBondContact OD1-O 3.43Å; N917-V925 PolarHBondContact ND2-O 3.16Å; N917-V925 PolarHBondContact OD1-N 3.25Å; N917-V925 VanDerWaalsContact OD1-N 3.16Å
918	V	83.8	Confident	84.4	Confident	103 Å²	103	52 Å²	52	62%	0.624	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	111.4	174	177	0	0	0	0	110.4	K756 A914 A915 I916	K756-V918 PolarHBondContact NZ-O 3.06Å; A914-V918 WeakPolarHBondContact O-CG2 3.49Å; A914-V918 PolarHBondContact O-N 2.62Å; A914-V918 VanDerWaalsContact O-N 3.14Å; A915-V918 PolarHBondContact O-N 3.3Å; I916-V918 PolarHBondContact O-N 3.37Å
919	G	75	Confident	84.6	Confident	83 Å²	83	52 Å²	52	86%	0.856	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.2	-5.3	179.9	0	0	0	0	0	115.6	N917	N917-G919 PolarHBondContact O-N 3.44Å
920	S	70.5	Confident	84.8	Confident	49 Å²	49	52.1 Å²	52.1	34%	0.343	33%	0.331	S	S	.	.			trans	-101	108.3	177.7	-62.1	0	0	0	0	110.4	N917	N917-S920 PolarHBondContact O-N 2.95Å
921	A	64.8	Low	84.9	Confident	94 Å²	94	49.6 Å²	49.6	78%	0.777	31%	0.31	S	S	*	.	S	Bend	trans	-87.8	-32.5	179.5	0	0	0	0	0	113.6
922	D	61.4	Low	84.9	Confident	169 Å²	169	48.7 Å²	48.7	90%	0.904	30%	0.304	S	S	*	.	S	Bend	trans	-99.1	-16	-163.4	-61.4	-52	0	0	0	115.2
923	S	61	Low	85	Confident	42 Å²	42	49.1 Å²	49.1	29%	0.294	31%	0.306	S	S	.	.			trans	-128.2	122.7	172.7	62	0	0	0	0	111.8	N917 V925	N917-S923 PolarHBondContact OD1-O 3.43Å; S923-V925 PolarHBondContact O-N 3.34Å
924	Q	75.5	Confident	85.1	Confident	188 Å²	188	47.9 Å²	47.9	88%	0.879	30%	0.298	S	S	*	.			trans	-89.8	97.6	172.5	-69.7	-172.1	-6.8	0	0	108.9
925	V	88.1	Confident	85.2	Confident	3 Å²	3	45.5 Å²	45.5	2%	0.018	28%	0.278	C	S	.	.			trans	-95.7	126.8	177.8	169.9	0	0	0	0	108.6	V742 Y746 I916 N917 S923	V742-V925 HydrophobicContact CG1-CG1 3.76Å; Y746-V925 HydrophobicContact CD2-CB 4.22Å; Y746-V925 HydrophobicContact CD2-CG1 3.91Å; Y746-V925 HydrophobicContact CD2-CG2 3.99Å; Y746-V925 HydrophobicContact CG-CG1 4.34Å; I916-V925 HydrophobicContact CG2-CB 4.18Å; I916-V925 HydrophobicContact CG2-CG1 4.08Å; N917-V925 PolarHBondContact ND2-O 3.16Å; N917-V925 PolarHBondContact OD1-N 3.25Å; N917-V925 VanDerWaalsContact OD1-N 3.16Å; S923-V925 PolarHBondContact O-N 3.34Å
926	Q	92.1	Very high	85.3	Confident	85 Å²	85	47.6 Å²	47.6	40%	0.397	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	132.5	-176.9	-177.4	178.9	-37.5	0	0	109.7	Q743	Q743-Q926 PolarHBondContact N-O 2.84Å; Q743-Q926 PolarHBondContact O-N 3.06Å
927	V	94.2	Very high	85.4	Confident	2 Å²	2	47.8 Å²	47.8	1%	0.012	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	133.4	165.6	-177.7	0	0	0	0	108.9	F740 V741 V742 A909 I912 T913 I916	F740-V927 HydrophobicContact CB-CG1 4.35Å; F740-V927 HydrophobicContact CD1-CG1 4.48Å; V741-V927 VanDerWaalsContact O-CA 3.3Å; V741-V927 WeakPolarHBondContact O-CA 3.43Å; V742-V927 HydrophobicContact CG2-CG2 4.16Å; A909-V927 HydrophobicContact CB-CG1 4.29Å; I912-V927 HydrophobicContact CG2-CB 4.25Å; I912-V927 HydrophobicContact CG2-CG1 4.27Å; I912-V927 HydrophobicContact CG2-CG2 3.9Å; T913-V927 PolarHBondContact OG1-N 2.67Å; T913-V927 PolarHBondContact OG1-O 2.63Å; I916-V927 HydrophobicContact CD1-CG2 3.68Å
928	F	96.1	Very high	85.5	Confident	1 Å²	1	47.2 Å²	47.2	0%	0.004	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	148.2	172.3	69	-95.8	0	0	0	111.5	E240 F243 V741 Q743	E240-F928 HydrophobicContact CB-CD2 3.72Å; E240-F928 HydrophobicContact CB-CE2 3.65Å; E240-F928 HydrophobicContact CB-CZ 4.42Å; E240-F928 HydrophobicContact CG-CB 4.32Å; E240-F928 HydrophobicContact CG-CD2 3.57Å; E240-F928 HydrophobicContact CG-CE2 3.92Å; E240-F928 HydrophobicContact CG-CG 3.94Å; E240-F928 WeakPolarHBondContact OE1-CB 3.33Å; F243-F928 HydrophobicContact CB-CZ 4.12Å; F243-F928 AromaticContact CD1-CE1 3.94Å; F243-F928 HydrophobicContact CD1-CE1 3.94Å; F243-F928 AromaticContact CD1-CZ 3.67Å; F243-F928 HydrophobicContact CD1-CZ 3.67Å; F243-F928 HydrophobicContact CE1-CE1 4.44Å; F243-F928 HydrophobicContact CE1-CZ 4.48Å; F243-F928 HydrophobicContact CG-CE1 4.33Å; F243-F928 HydrophobicContact CG-CZ 4.13Å; V741-F928 HydrophobicContact CB-CD1 4.22Å; V741-F928 HydrophobicContact CB-CD2 4.25Å; V741-F928 HydrophobicContact CB-CE1 3.87Å; V741-F928 HydrophobicContact CB-CE2 3.9Å; V741-F928 HydrophobicContact CB-CG 4.41Å; V741-F928 HydrophobicContact CB-CZ 3.71Å; V741-F928 HydrophobicContact CG1-CD1 4.45Å; V741-F928 HydrophobicContact CG1-CE1 3.73Å; V741-F928 HydrophobicContact CG1-CE2 4.38Å; V741-F928 HydrophobicContact CG1-CZ 3.7Å; V741-F928 HydrophobicContact CG2-CD2 4.44Å; V741-F928 HydrophobicContact CG2-CE2 3.88Å; V741-F928 HydrophobicContact CG2-CZ 4Å; V741-F928 PolarHBondContact N-O 3.47Å; V741-F928 PolarHBondContact O-N 2.6Å; Q743-F928 HydrophobicContact CB-CD1 4.47Å; Q743-F928 HydrophobicContact CB-CE1 4.16Å
929	P	96.4	Very high	85.8	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	140	174.3	37.5	-30.1	0	0	0	108.9	V738 Y739 F740 A905 R906 A909 Y934	V738-P929 HydrophobicContact CG2-CB 4.04Å; Y739-P929 CarbonylContact O-C 3.38Å; Y739-P929 WeakPolarHBondContact O-CA 3.19Å; F740-P929 HydrophobicContact CD1-CB 4.23Å; F740-P929 HydrophobicContact CE1-CB 4.06Å; A905-P929 HydrophobicContact CB-CB 3.88Å; A905-P929 HydrophobicContact CB-CG 3.98Å; R906-P929 HydrophobicContact CG-CG 3.79Å; A909-P929 HydrophobicContact CB-CG 4.16Å; P929-Y934 HydrophobicContact CB-CE2 3.83Å; P929-Y934 HydrophobicContact CG-CE2 3.88Å; P929-Y934 WeakPolarHBondContact O-CD2 3.39Å; P929-Y934 VanDerWaalsContact O-CE2 3.31Å; P929-Y934 WeakPolarHBondContact O-CE2 3.33Å
930	Y	96.3	Very high	86.4	Confident	5 Å²	5	40.1 Å²	40.1	2%	0.02	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	131	172.8	174.1	-110.8	0	0	0	110.7	K241 F244 F251 V738 Y739	K241-Y930 HydrophobicContact CB-CE2 3.89Å; K241-Y930 HydrophobicContact CG-CE2 3.68Å; K241-Y930 WeakPolarHBondContact CG-OH 3.17Å; F244-Y930 HydrophobicContact CB-CD1 3.91Å; F244-Y930 HydrophobicContact CB-CD2 4.44Å; F244-Y930 HydrophobicContact CB-CE1 4.07Å; F244-Y930 HydrophobicContact CB-CG 4.09Å; F244-Y930 AromaticContact CD1-CD1 3.72Å; F244-Y930 HydrophobicContact CD1-CD1 3.72Å; F244-Y930 AromaticContact CD1-CE1 3.38Å; F244-Y930 HydrophobicContact CD1-CE1 3.38Å; F244-Y930 AromaticContact CD2-CD1 3.32Å; F244-Y930 HydrophobicContact CD2-CD1 3.32Å; F244-Y930 AromaticContact CD2-CE1 3.93Å; F244-Y930 HydrophobicContact CD2-CE1 3.93Å; F244-Y930 AromaticContact CD2-CG 3.95Å; F244-Y930 HydrophobicContact CD2-CG 3.95Å; F244-Y930 HydrophobicContact CE1-CD1 4.05Å; F244-Y930 AromaticContact CE1-CE1 3.73Å; F244-Y930 HydrophobicContact CE1-CE1 3.73Å; F244-Y930 AromaticContact CE2-CD1 3.68Å; F244-Y930 HydrophobicContact CE2-CD1 3.68Å; F244-Y930 HydrophobicContact CE2-CE1 4.22Å; F244-Y930 AromaticContact CG-CD1 3.34Å; F244-Y930 HydrophobicContact CG-CD1 3.34Å; F244-Y930 AromaticContact CG-CE1 3.5Å; F244-Y930 HydrophobicContact CG-CE1 3.5Å; F244-Y930 VanDerWaalsContact CG-CE1 3.5Å; F244-Y930 AromaticContact CG-CG 3.99Å; F244-Y930 HydrophobicContact CG-CG 3.99Å; F244-Y930 HydrophobicContact CZ-CD1 4.02Å; F244-Y930 HydrophobicContact CZ-CE1 4.13Å; F251-Y930 HydrophobicContact CB-CE1 4.43Å; V738-Y930 CarbonylContact C-O 3.42Å; V738-Y930 WeakPolarHBondContact CA-O 3.38Å; Y739-Y930 HydrophobicContact CD2-CD1 4.1Å; Y739-Y930 PolarHBondContact N-O 3.18Å; Y739-Y930 PolarHBondContact O-N 3.3Å
931	S	95.4	Very high	87.3	Confident	2 Å²	2	41.1 Å²	41.1	1%	0.014	22%	0.22	C	C	.	.			trans	-148.6	150.8	166.6	-171.1	0	0	0	0	109	P737 F933 Y934	P737-S931 VanDerWaalsContact O-CB 3.3Å; P737-S931 WeakPolarHBondContact O-CB 3.12Å; P737-S931 PolarHBondContact O-OG 2.8Å; S931-F933 PolarHBondContact O-N 2.94Å; S931-F933 VanDerWaalsContact O-N 3.08Å; S931-F933 WeakPolarHBondContact OG-CD1 3.45Å; S931-F933 WeakPolarHBondContact OG-CE1 3.49Å; S931-Y934 WeakPolarHBondContact O-CB 3.44Å; S931-Y934 PolarHBondContact O-N 3.14Å
932	I	91.5	Very high	88.4	Confident	56 Å²	56	39.8 Å²	39.8	29%	0.287	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.3	-34.7	-172.1	-172.3	170.9	0	0	0	113.5	F251 V935	F251-I932 HydrophobicContact CD1-CB 4.34Å; F251-I932 HydrophobicContact CD1-CD1 3.95Å; F251-I932 HydrophobicContact CE1-CD1 4.3Å; I932-V935 WeakPolarHBondContact O-CG2 3.23Å
933	F	92.5	Very high	89.5	Confident	10 Å²	10	31.7 Å²	31.7	4%	0.044	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-13.6	-176.3	70.2	-88.8	0	0	0	114.6	P736 H889 L892 Y898 A901 S931 V935 F936 Y937	P736-F933 HydrophobicContact CB-CD1 4.3Å; P736-F933 HydrophobicContact CB-CE1 4.35Å; P736-F933 HydrophobicContact CG-CD1 3.68Å; P736-F933 HydrophobicContact CG-CE1 3.45Å; P736-F933 VanDerWaalsContact CG-CE1 3.45Å; P736-F933 HydrophobicContact CG-CZ 4.5Å; H889-F933 AromaticContact CD2-CE1 3.73Å; H889-F933 AromaticContact CD2-CZ 3.88Å; H889-F933 AromaticContact NE2-CZ 3.87Å; L892-F933 HydrophobicContact CD1-CE1 3.89Å; L892-F933 HydrophobicContact CD1-CE2 4.14Å; L892-F933 HydrophobicContact CD1-CZ 3.52Å; Y898-F933 HydrophobicContact CD1-CB 4.34Å; Y898-F933 HydrophobicContact CD1-CD1 4.31Å; Y898-F933 AromaticContact CD1-CD2 3.55Å; Y898-F933 HydrophobicContact CD1-CD2 3.55Å; Y898-F933 HydrophobicContact CD1-CE1 4.5Å; Y898-F933 AromaticContact CD1-CE2 3.74Å; Y898-F933 HydrophobicContact CD1-CE2 3.74Å; Y898-F933 AromaticContact CD1-CG 3.82Å; Y898-F933 HydrophobicContact CD1-CG 3.82Å; Y898-F933 HydrophobicContact CD1-CZ 4.19Å; Y898-F933 HydrophobicContact CE1-CD2 4.5Å; Y898-F933 HydrophobicContact CE1-CG 4.36Å; Y898-F933 HydrophobicContact CG-CD2 4.29Å; Y898-F933 HydrophobicContact CG-CE2 4.34Å; A901-F933 HydrophobicContact CB-CZ 4.27Å; S931-F933 PolarHBondContact O-N 2.94Å; S931-F933 VanDerWaalsContact O-N 3.08Å; S931-F933 WeakPolarHBondContact OG-CD1 3.45Å; S931-F933 WeakPolarHBondContact OG-CE1 3.49Å; F933-V935 PolarHBondContact O-N 3.42Å; F933-F936 PolarHBondContact O-N 3.39Å; F933-Y937 HydrophobicContact CB-CD2 4.01Å; F933-Y937 HydrophobicContact CB-CE2 4.22Å; F933-Y937 AromaticContact CD2-CD2 3.77Å; F933-Y937 HydrophobicContact CD2-CD2 3.77Å; F933-Y937 HydrophobicContact CD2-CE2 4.42Å; F933-Y937 HydrophobicContact CD2-CG 4.37Å; F933-Y937 HydrophobicContact CG-CD2 4.38Å; F933-Y937 WeakPolarHBondContact O-CD2 3.46Å; F933-Y937 PolarHBondContact O-N 3.19Å; F933-Y937 VanDerWaalsContact O-N 3.13Å
934	Y	95.2	Very high	90.5	Very high	4 Å²	4	32.2 Å²	32.2	2%	0.016	17%	0.166	C	C	.	.	H	α-helix	trans	-61.3	-32.6	-172.6	-71.6	2.3	0	0	0	113	V738 H889 L902 A905 P929 S931 F936 E938	V738-Y934 VanDerWaalsContact CG2-OH 3.26Å; V738-Y934 WeakPolarHBondContact CG2-OH 3.47Å; H889-Y934 AromaticContact NE2-CE1 3.76Å; H889-Y934 AromaticContact NE2-CZ 3.74Å; H889-Y934 PolarHBondContact NE2-OH 3.33Å; L902-Y934 HydrophobicContact CB-CD1 4.41Å; L902-Y934 HydrophobicContact CB-CE1 4.39Å; L902-Y934 HydrophobicContact CD1-CD1 3.76Å; L902-Y934 HydrophobicContact CD1-CD2 3.76Å; L902-Y934 HydrophobicContact CD1-CE1 4.06Å; L902-Y934 HydrophobicContact CD1-CE2 4.07Å; L902-Y934 HydrophobicContact CD1-CG 3.6Å; A905-Y934 WeakPolarHBondContact CB-OH 3.18Å; P929-Y934 HydrophobicContact CB-CE2 3.83Å; P929-Y934 HydrophobicContact CG-CE2 3.88Å; P929-Y934 WeakPolarHBondContact O-CD2 3.39Å; P929-Y934 VanDerWaalsContact O-CE2 3.31Å; P929-Y934 WeakPolarHBondContact O-CE2 3.33Å; S931-Y934 WeakPolarHBondContact O-CB 3.44Å; S931-Y934 PolarHBondContact O-N 3.14Å; Y934-F936 VanDerWaalsContact C-N 3.29Å; Y934-F936 PolarHBondContact O-N 2.89Å; Y934-E938 VanDerWaalsContact O-CB 3.26Å; Y934-E938 WeakPolarHBondContact O-CB 3.36Å; Y934-E938 PolarHBondContact O-N 2.9Å
935	V	92.2	Very high	90.9	Very high	5 Å²	5	31.3 Å²	31.3	3%	0.03	15%	0.154	C	C	.	.	H	α-helix	trans	-65	-29.6	176	-67.5	0	0	0	0	113.2	V227 S231 A237 K241 I932 F933	V227-V935 HydrophobicContact CG1-CB 4.06Å; V227-V935 HydrophobicContact CG1-CG2 3.72Å; S231-V935 WeakPolarHBondContact CB-O 3.15Å; A237-V935 HydrophobicContact CB-CG1 4.07Å; K241-V935 HydrophobicContact CB-CG1 4.12Å; K241-V935 HydrophobicContact CD-CG1 4.48Å; I932-V935 WeakPolarHBondContact O-CG2 3.23Å; F933-V935 PolarHBondContact O-N 3.42Å
936	F	90.4	Very high	90.4	Very high	55 Å²	55	32.3 Å²	32.3	24%	0.241	16%	0.16	C	C	.	.	H	α-helix	trans	-85	-41.3	177.8	-55	-62.9	0	0	0	112.1	P226 V227 W230 F933 Y934 Q939	P226-F936 HydrophobicContact CB-CE1 4.09Å; P226-F936 HydrophobicContact CG-CE1 4.34Å; P226-F936 HydrophobicContact CG-CZ 4.45Å; V227-F936 HydrophobicContact CB-CE1 4.28Å; V227-F936 HydrophobicContact CG2-CE1 3.84Å; V227-F936 HydrophobicContact CG2-CZ 3.7Å; W230-F936 HydrophobicContact CB-CD1 4.49Å; F933-F936 PolarHBondContact O-N 3.39Å; Y934-F936 VanDerWaalsContact C-N 3.29Å; Y934-F936 PolarHBondContact O-N 2.89Å; F936-Q939 WeakPolarHBondContact O-CG 3.47Å; F936-Q939 PolarHBondContact O-NE2 3.03Å
937	Y	92	Very high	89.7	Confident	7 Å²	7	28.3 Å²	28.3	3%	0.027	14%	0.141	C	C	.	.	H	α-helix	trans	-89.9	-12.8	-172.8	-70.1	-90.1	0	0	0	114.6	E711 Y898 I899 F933 Q939 Y940	E711-Y937 PolarHBondContact OE1-OH 2.83Å; Y898-Y937 HydrophobicContact CD1-CD2 4.37Å; Y898-Y937 AromaticContact CD1-CE2 3.95Å; Y898-Y937 HydrophobicContact CD1-CE2 3.95Å; Y898-Y937 HydrophobicContact CD2-CE1 4.23Å; Y898-Y937 HydrophobicContact CD2-CE2 4.46Å; Y898-Y937 AromaticContact CD2-CZ 3.93Å; Y898-Y937 HydrophobicContact CG-CD1 4.46Å; Y898-Y937 HydrophobicContact CG-CD2 4.31Å; Y898-Y937 HydrophobicContact CG-CE1 4.07Å; Y898-Y937 AromaticContact CG-CE2 3.9Å; Y898-Y937 HydrophobicContact CG-CE2 3.9Å; Y898-Y937 AromaticContact CG-CZ 3.76Å; I899-Y937 HydrophobicContact CG1-CD1 4.16Å; F933-Y937 HydrophobicContact CB-CD2 4.01Å; F933-Y937 HydrophobicContact CB-CE2 4.22Å; F933-Y937 AromaticContact CD2-CD2 3.77Å; F933-Y937 HydrophobicContact CD2-CD2 3.77Å; F933-Y937 HydrophobicContact CD2-CE2 4.42Å; F933-Y937 HydrophobicContact CD2-CG 4.37Å; F933-Y937 HydrophobicContact CG-CD2 4.38Å; F933-Y937 WeakPolarHBondContact O-CD2 3.46Å; F933-Y937 PolarHBondContact O-N 3.19Å; F933-Y937 VanDerWaalsContact O-N 3.13Å; Y937-Q939 PolarHBondContact O-N 2.83Å; Y937-Y940 AromaticContact CD1-CD2 3.8Å; Y937-Y940 HydrophobicContact CD1-CD2 3.8Å; Y937-Y940 AromaticContact CD1-CE2 3.69Å; Y937-Y940 HydrophobicContact CD1-CE2 3.69Å; Y937-Y940 HydrophobicContact CE1-CE2 4.2Å; Y937-Y940 HydrophobicContact CG-CD2 4.37Å; Y937-Y940 HydrophobicContact CG-CE2 4.34Å; Y937-Y940 WeakPolarHBondContact O-CD2 3.24Å; Y937-Y940 PolarHBondContact O-N 3.1Å
938	E	92	Very high	89	Confident	28 Å²	28	31.6 Å²	31.6	13%	0.131	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-34.8	173	169.9	163.5	-99.1	0	0	113	S235 R236 A237 L902 R906 Y934 Y940 L941	S235-E938 WeakPolarHBondContact CB-OE2 3.4Å; S235-E938 PolarHBondContact OG-OE2 2.96Å; R236-E938 WeakPolarHBondContact CB-OE1 3.26Å; R236-E938 PolarHBondContact N-OE2 3.14Å; A237-E938 HydrophobicContact CB-CB 4.03Å; A237-E938 HydrophobicContact CB-CG 4.42Å; A237-E938 VanDerWaalsContact CB-OE2 3.29Å; A237-E938 WeakPolarHBondContact CB-OE2 3.27Å; A237-E938 PolarHBondContact N-OE1 2.7Å; A237-E938 PolarHBondContact N-OE2 2.78Å; L902-E938 HydrophobicContact CD2-CB 4.3Å; R906-E938 IonicContact CZ-OE1 2.7Å; R906-E938 IonicContact NH1-OE1 3.04Å; R906-E938 PolarHBondContact NH1-OE1 2.8Å; R906-E938 IonicContact NH2-OE1 3.86Å; R906-E938 PolarHBondContact NH2-OE1 3.24Å; Y934-E938 VanDerWaalsContact O-CB 3.26Å; Y934-E938 WeakPolarHBondContact O-CB 3.36Å; Y934-E938 PolarHBondContact O-N 2.9Å; E938-Y940 PolarHBondContact O-N 3.35Å; E938-Y940 VanDerWaalsContact O-N 3.14Å; E938-L941 WeakPolarHBondContact O-CB 3.5Å; E938-L941 WeakPolarHBondContact O-CG 3.49Å; E938-L941 PolarHBondContact O-N 3.13Å
939	Q	88.3	Confident	88.2	Confident	19 Å²	19	34 Å²	34	9%	0.089	17%	0.173	C	C	.	.	H	α-helix	trans	-57.7	-31.8	-177.3	77.5	-175.1	-76	0	0	113	M606 F936 Y937 L941 T942 L943	M606-Q939 HydrophobicContact CE-CB 3.92Å; M606-Q939 HydrophobicContact CE-CG 4.44Å; F936-Q939 WeakPolarHBondContact O-CG 3.47Å; F936-Q939 PolarHBondContact O-NE2 3.03Å; Y937-Q939 PolarHBondContact O-N 2.83Å; Q939-L941 PolarHBondContact O-N 3.5Å; Q939-T942 PolarHBondContact O-N 2.96Å; Q939-L943 WeakPolarHBondContact O-CB 3.42Å; Q939-L943 PolarHBondContact O-N 3.16Å
940	Y	89.5	Confident	87	Confident	19 Å²	19	34 Å²	34	8%	0.075	17%	0.173	C	C	.	.	H	α-helix	trans	-72.7	-16.1	-178.4	-57.8	-68.2	0	0	0	113.3	L709 I899 Y937 E938 L943 N999	L709-Y940 PolarHBondContact N-OH 3.27Å; I899-Y940 HydrophobicContact CD1-CD2 3.98Å; I899-Y940 HydrophobicContact CD1-CG 3.81Å; I899-Y940 HydrophobicContact CG1-CD2 4.12Å; I899-Y940 HydrophobicContact CG1-CG 4.3Å; Y937-Y940 AromaticContact CD1-CD2 3.8Å; Y937-Y940 HydrophobicContact CD1-CD2 3.8Å; Y937-Y940 AromaticContact CD1-CE2 3.69Å; Y937-Y940 HydrophobicContact CD1-CE2 3.69Å; Y937-Y940 HydrophobicContact CE1-CE2 4.2Å; Y937-Y940 HydrophobicContact CG-CD2 4.37Å; Y937-Y940 HydrophobicContact CG-CE2 4.34Å; Y937-Y940 WeakPolarHBondContact O-CD2 3.24Å; Y937-Y940 PolarHBondContact O-N 3.1Å; E938-Y940 PolarHBondContact O-N 3.35Å; E938-Y940 VanDerWaalsContact O-N 3.14Å; Y940-L943 HydrophobicContact CD1-CD2 3.69Å; Y940-L943 HydrophobicContact CE1-CD2 4.15Å; Y940-N999 HydrophobicContact CE1-CB 3.77Å
941	L	88.9	Confident	86	Confident	70 Å²	70	35 Å²	35	37%	0.366	18%	0.178	S	C	.	.	H	α-helix	trans	-70.7	-31	177.9	-56.9	-179.4	0	0	0	112.4	I899 L902 I903 E938 Q939	I899-L941 HydrophobicContact CG2-CD2 4.16Å; L902-L941 HydrophobicContact CD2-CD1 3.89Å; L902-L941 HydrophobicContact CD2-CG 4.33Å; L902-L941 HydrophobicContact CG-CD1 4.29Å; I903-L941 HydrophobicContact CD1-CD2 3.81Å; I903-L941 HydrophobicContact CG1-CD2 3.56Å; E938-L941 WeakPolarHBondContact O-CB 3.5Å; E938-L941 WeakPolarHBondContact O-CG 3.49Å; E938-L941 PolarHBondContact O-N 3.13Å; Q939-L941 PolarHBondContact O-N 3.5Å
942	T	86.5	Confident	85.2	Confident	65 Å²	65	39.7 Å²	39.7	40%	0.399	20%	0.203	S	C	.	.	H	α-helix	trans	-110.8	-17.3	177.8	63.5	0	0	0	0	113.6	Q939 A944 W945 D946	Q939-T942 PolarHBondContact O-N 2.96Å; T942-A944 VanDerWaalsContact C-N 3.27Å; T942-A944 PolarHBondContact O-N 2.83Å; T942-W945 WeakPolarHBondContact O-CA 3.42Å; T942-W945 WeakPolarHBondContact O-CB 3.42Å; T942-W945 PolarHBondContact O-N 3.27Å; T942-D946 WeakPolarHBondContact CB-OD2 3.35Å; T942-D946 PolarHBondContact O-N 3.32Å; T942-D946 PolarHBondContact OG1-OD2 3.21Å
943	L	84.7	Confident	84.5	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-41.7	-46.9	-175.8	178.6	68.3	0	0	0	114.3	M606 Q939 Y940 A947 F998 L1003	M606-L943 HydrophobicContact CE-CB 4.25Å; M606-L943 HydrophobicContact CE-CD1 3.52Å; M606-L943 HydrophobicContact CE-CG 4.47Å; M606-L943 HydrophobicContact SD-CD1 4.21Å; Q939-L943 WeakPolarHBondContact O-CB 3.42Å; Q939-L943 PolarHBondContact O-N 3.16Å; Y940-L943 HydrophobicContact CD1-CD2 3.69Å; Y940-L943 HydrophobicContact CE1-CD2 4.15Å; L943-A947 WeakPolarHBondContact O-CB 3.41Å; L943-A947 PolarHBondContact O-N 2.9Å; L943-F998 HydrophobicContact CD1-CE1 4.43Å; L943-F998 HydrophobicContact CD2-CD1 3.59Å; L943-F998 HydrophobicContact CD2-CE1 3.89Å; L943-F998 WeakPolarHBondContact CD2-O 3.39Å; L943-F998 HydrophobicContact CG-CD1 3.97Å; L943-F998 HydrophobicContact CG-CE1 3.71Å; L943-L1003 HydrophobicContact CD1-CB 4.46Å; L943-L1003 HydrophobicContact CD1-CD2 3.61Å
944	A	81.9	Confident	83.6	Confident	52 Å²	52	39.1 Å²	39.1	43%	0.43	20%	0.201	S	C	.	.	H	α-helix	trans	-68.5	-36.2	-179	0	0	0	0	0	113.5	T942 T948	T942-A944 VanDerWaalsContact C-N 3.27Å; T942-A944 PolarHBondContact O-N 2.83Å; A944-T948 WeakPolarHBondContact O-CB 3.49Å; A944-T948 PolarHBondContact O-N 3.07Å; A944-T948 PolarHBondContact O-OG1 3.41Å
945	W	84.1	Confident	82.8	Confident	169 Å²	169	40.2 Å²	40.2	64%	0.64	21%	0.207	S	C	*	.	H	α-helix	trans	-72.4	-48.8	174.2	175.2	-95.6	0	0	0	111	T942 A947 T948 M949	T942-W945 WeakPolarHBondContact O-CA 3.42Å; T942-W945 WeakPolarHBondContact O-CB 3.42Å; T942-W945 PolarHBondContact O-N 3.27Å; W945-A947 VanDerWaalsContact C-N 3.3Å; W945-A947 PolarHBondContact O-N 2.98Å; W945-T948 PolarHBondContact O-N 2.9Å; W945-M949 HydrophobicContact CD2-CE 4.43Å; W945-M949 HydrophobicContact CD2-CG 4.33Å; W945-M949 HydrophobicContact CE3-CE 4.33Å; W945-M949 HydrophobicContact CH2-CE 3.77Å; W945-M949 HydrophobicContact CH2-SD 4.24Å; W945-M949 HydrophobicContact CZ2-CE 3.87Å; W945-M949 HydrophobicContact CZ2-CG 4.05Å; W945-M949 HydrophobicContact CZ2-SD 3.78Å; W945-M949 HydrophobicContact CZ3-CE 4.02Å; W945-M949 WeakPolarHBondContact O-CG 3.48Å; W945-M949 PolarHBondContact O-N 3.04Å
946	D	79	Confident	82.3	Confident	25 Å²	25	42.5 Å²	42.5	13%	0.134	23%	0.226	C	C	.	.	H	α-helix	trans	-59.7	-43.8	-179.9	-64.6	-23.5	0	0	0	110.4	T942 M949 Q950	T942-D946 WeakPolarHBondContact CB-OD2 3.35Å; T942-D946 PolarHBondContact O-N 3.32Å; T942-D946 PolarHBondContact OG1-OD2 3.21Å; D946-M949 PolarHBondContact O-N 3.12Å; D946-Q950 WeakPolarHBondContact O-CB 3.44Å; D946-Q950 VanDerWaalsContact O-CD 3.31Å; D946-Q950 WeakPolarHBondContact O-CG 3.47Å; D946-Q950 PolarHBondContact O-N 3.47Å; D946-Q950 PolarHBondContact O-NE2 2.89Å
947	A	77.1	Confident	81.9	Confident	1 Å²	1	40 Å²	40	1%	0.008	22%	0.216	C	C	.	.	H	α-helix	trans	-63.3	-44.1	172.3	0	0	0	0	0	111.9	L943 W945 M949 Q950 L951 F998 L1003	L943-A947 WeakPolarHBondContact O-CB 3.41Å; L943-A947 PolarHBondContact O-N 2.9Å; W945-A947 VanDerWaalsContact C-N 3.3Å; W945-A947 PolarHBondContact O-N 2.98Å; A947-M949 VanDerWaalsContact C-N 3.33Å; A947-M949 PolarHBondContact O-N 3.34Å; A947-Q950 VanDerWaalsContact O-CB 3.31Å; A947-Q950 WeakPolarHBondContact O-CB 3.39Å; A947-Q950 PolarHBondContact O-N 3.11Å; A947-L951 WeakPolarHBondContact O-CB 3.45Å; A947-L951 WeakPolarHBondContact O-CG 3.5Å; A947-L951 PolarHBondContact O-N 2.91Å; A947-F998 HydrophobicContact CB-CE1 4.27Å; A947-F998 HydrophobicContact CB-CZ 3.75Å; A947-L1003 HydrophobicContact CB-CD1 3.69Å; A947-L1003 HydrophobicContact CB-CD2 4.31Å
948	T	79.7	Confident	81.4	Confident	70 Å²	70	39.8 Å²	39.8	43%	0.429	22%	0.215	S	C	.	.	H	α-helix	trans	-61.3	-42.2	178	-58.6	0	0	0	0	111.8	A944 W945 L951 L952	A944-T948 WeakPolarHBondContact O-CB 3.49Å; A944-T948 PolarHBondContact O-N 3.07Å; A944-T948 PolarHBondContact O-OG1 3.41Å; W945-T948 PolarHBondContact O-N 2.9Å; T948-L951 PolarHBondContact O-N 2.83Å; T948-L952 HydrophobicContact CG2-CD1 4.26Å; T948-L952 WeakPolarHBondContact O-CG 3.06Å; T948-L952 PolarHBondContact O-N 3.31Å
949	M	78.5	Confident	81.1	Confident	51 Å²	51	41.6 Å²	41.6	25%	0.251	22%	0.223	S	C	.	.	H	α-helix	trans	-65.4	-38.8	175.7	-66.6	-58.3	104.2	0	0	112	W945 D946 A947 L952 L953	W945-M949 HydrophobicContact CD2-CE 4.43Å; W945-M949 HydrophobicContact CD2-CG 4.33Å; W945-M949 HydrophobicContact CE3-CE 4.33Å; W945-M949 HydrophobicContact CH2-CE 3.77Å; W945-M949 HydrophobicContact CH2-SD 4.24Å; W945-M949 HydrophobicContact CZ2-CE 3.87Å; W945-M949 HydrophobicContact CZ2-CG 4.05Å; W945-M949 HydrophobicContact CZ2-SD 3.78Å; W945-M949 HydrophobicContact CZ3-CE 4.02Å; W945-M949 WeakPolarHBondContact O-CG 3.48Å; W945-M949 PolarHBondContact O-N 3.04Å; D946-M949 PolarHBondContact O-N 3.12Å; A947-M949 VanDerWaalsContact C-N 3.33Å; A947-M949 PolarHBondContact O-N 3.34Å; M949-L952 HydrophobicContact CE-CD1 4.23Å; M949-L952 PolarHBondContact O-N 3.43Å; M949-L953 VanDerWaalsContact O-CG 3.31Å; M949-L953 WeakPolarHBondContact O-CG 3.43Å; M949-L953 PolarHBondContact O-N 2.92Å
950	Q	72.1	Confident	81.1	Confident	2 Å²	2	44.5 Å²	44.5	1%	0.009	24%	0.238	C	C	.	.	H	α-helix	trans	-56.1	-57.7	169.8	-72.1	161.8	55.9	0	0	110.7	D946 A947 L952 L953 S954 V1011 A1013	D946-Q950 WeakPolarHBondContact O-CB 3.44Å; D946-Q950 VanDerWaalsContact O-CD 3.31Å; D946-Q950 WeakPolarHBondContact O-CG 3.47Å; D946-Q950 PolarHBondContact O-N 3.47Å; D946-Q950 PolarHBondContact O-NE2 2.89Å; A947-Q950 VanDerWaalsContact O-CB 3.31Å; A947-Q950 WeakPolarHBondContact O-CB 3.39Å; A947-Q950 PolarHBondContact O-N 3.11Å; Q950-L952 PolarHBondContact O-N 3.05Å; Q950-L953 PolarHBondContact O-N 3.31Å; Q950-L953 VanDerWaalsContact O-N 3.12Å; Q950-S954 PolarHBondContact O-N 3.48Å; Q950-S954 PolarHBondContact O-OG 2.69Å; Q950-V1011 VanDerWaalsContact C-CG2 3.44Å; Q950-V1011 HydrophobicContact CB-CB 4.1Å; Q950-V1011 HydrophobicContact CB-CG1 4.14Å; Q950-V1011 HydrophobicContact CB-CG2 3.95Å; Q950-V1011 WeakPolarHBondContact O-CG1 3.29Å; Q950-V1011 VanDerWaalsContact O-CG2 3.31Å; Q950-V1011 WeakPolarHBondContact O-CG2 3.24Å; Q950-A1013 VanDerWaalsContact CD-CA 3.41Å
951	L	74.2	Confident	80.9	Confident	24 Å²	24	44 Å²	44	13%	0.126	24%	0.236	C	C	.	.	H	α-helix	trans	-63.1	-13.4	-171.7	-61.3	169.9	0	0	0	112.8	A947 T948 S954 L955 L984 L1010 V1011	A947-L951 WeakPolarHBondContact O-CB 3.45Å; A947-L951 WeakPolarHBondContact O-CG 3.5Å; A947-L951 PolarHBondContact O-N 2.91Å; T948-L951 PolarHBondContact O-N 2.83Å; L951-S954 PolarHBondContact O-OG 2.88Å; L951-L955 VanDerWaalsContact O-CD1 3.26Å; L951-L955 WeakPolarHBondContact O-CD1 3.15Å; L951-L955 WeakPolarHBondContact O-CG 3.05Å; L951-L984 HydrophobicContact CD2-CD1 3.75Å; L951-L984 HydrophobicContact CD2-CD2 4.36Å; L951-L1010 HydrophobicContact CB-CD2 4Å; L951-L1010 HydrophobicContact CD2-CB 4.15Å; L951-L1010 HydrophobicContact CD2-CD2 3.83Å; L951-L1010 WeakPolarHBondContact O-CD2 3.47Å; L951-V1011 HydrophobicContact CB-CG2 4.49Å; L951-V1011 HydrophobicContact CD2-CG2 3.78Å; L951-V1011 HydrophobicContact CG-CG2 4.36Å
952	L	78.8	Confident	80.7	Confident	101 Å²	101	40.7 Å²	40.7	53%	0.529	22%	0.219	S	C	.	.	H	α-helix	trans	-94.6	-41.7	173.4	-65.8	171.6	0	0	0	113.4	T948 M949 Q950 S954 L955 A956	T948-L952 HydrophobicContact CG2-CD1 4.26Å; T948-L952 WeakPolarHBondContact O-CG 3.06Å; T948-L952 PolarHBondContact O-N 3.31Å; M949-L952 HydrophobicContact CE-CD1 4.23Å; M949-L952 PolarHBondContact O-N 3.43Å; Q950-L952 PolarHBondContact O-N 3.05Å; L952-S954 VanDerWaalsContact C-N 3.26Å; L952-S954 PolarHBondContact O-N 2.98Å; L952-L955 PolarHBondContact O-N 2.88Å; L952-A956 VanDerWaalsContact O-CB 3.31Å; L952-A956 WeakPolarHBondContact O-CB 3.16Å; L952-A956 PolarHBondContact O-N 3.06Å
953	L	76.3	Confident	80.7	Confident	55 Å²	55	38.1 Å²	38.1	29%	0.288	21%	0.205	S	C	.	.	H	α-helix	trans	-63.1	-31.5	-178	-73.4	167.9	0	0	0	113.1	L600 M949 Q950 A957	L600-L953 HydrophobicContact CD1-CB 3.76Å; L600-L953 HydrophobicContact CD2-CB 4.22Å; L600-L953 HydrophobicContact CD2-CD1 4.35Å; M949-L953 VanDerWaalsContact O-CG 3.31Å; M949-L953 WeakPolarHBondContact O-CG 3.43Å; M949-L953 PolarHBondContact O-N 2.92Å; Q950-L953 PolarHBondContact O-N 3.31Å; Q950-L953 VanDerWaalsContact O-N 3.12Å; L953-A957 WeakPolarHBondContact O-CB 3.36Å
954	S	74.3	Confident	80.8	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-70.7	-52.5	172.8	33.6	0	0	0	0	114.1	Q950 L951 L952 A956 A957 I958 L1010 V1011 A1020 V1021	Q950-S954 PolarHBondContact O-N 3.48Å; Q950-S954 PolarHBondContact O-OG 2.69Å; L951-S954 PolarHBondContact O-OG 2.88Å; L952-S954 VanDerWaalsContact C-N 3.26Å; L952-S954 PolarHBondContact O-N 2.98Å; S954-A956 VanDerWaalsContact C-N 3.28Å; S954-A956 PolarHBondContact O-N 3.43Å; S954-A957 CarbonylContact O-C 3.59Å; S954-A957 WeakPolarHBondContact O-CA 3.47Å; S954-A957 VanDerWaalsContact O-CB 3.32Å; S954-A957 WeakPolarHBondContact O-CB 3.37Å; S954-A957 PolarHBondContact O-N 2.91Å; S954-I958 PolarHBondContact O-N 3.44Å; S954-L1010 WeakPolarHBondContact CB-O 3.39Å; S954-L1010 VanDerWaalsContact OG-CD2 3.29Å; S954-L1010 WeakPolarHBondContact OG-CD2 3.49Å; S954-V1011 WeakPolarHBondContact OG-CG1 3.38Å; S954-V1011 WeakPolarHBondContact OG-CG2 3.42Å; S954-A1020 WeakPolarHBondContact CA-O 3.48Å; S954-A1020 VanDerWaalsContact CB-O 3.22Å; S954-A1020 WeakPolarHBondContact CB-O 3.47Å; S954-V1021 WeakPolarHBondContact O-CG2 3.31Å
955	L	78.1	Confident	80.9	Confident	26 Å²	26	40.4 Å²	40.4	14%	0.136	21%	0.209	C	C	.	.	H	α-helix	trans	-60.9	-41.5	179.5	-73.8	173.5	0	0	0	110.7	L951 L952 A957 I958 F959 V977 I980 S981 L1010	L951-L955 VanDerWaalsContact O-CD1 3.26Å; L951-L955 WeakPolarHBondContact O-CD1 3.15Å; L951-L955 WeakPolarHBondContact O-CG 3.05Å; L952-L955 PolarHBondContact O-N 2.88Å; L955-A957 PolarHBondContact O-N 3.15Å; L955-I958 HydrophobicContact CD2-CD1 4.49Å; L955-F959 WeakPolarHBondContact O-CB 3.35Å; L955-F959 PolarHBondContact O-N 3.27Å; L955-V977 HydrophobicContact CB-CG1 4.15Å; L955-V977 HydrophobicContact CD2-CG1 4.06Å; L955-V977 WeakPolarHBondContact O-CG2 3.39Å; L955-I980 HydrophobicContact CD2-CG2 4.22Å; L955-S981 WeakPolarHBondContact CD1-OG 3.34Å; L955-L1010 HydrophobicContact CD1-CD2 4.17Å; L955-L1010 HydrophobicContact CD2-CD1 3.66Å; L955-L1010 HydrophobicContact CD2-CD2 4.1Å; L955-L1010 HydrophobicContact CD2-CG 4.41Å; L955-L1010 HydrophobicContact CG-CD1 4.2Å; L955-L1010 HydrophobicContact CG-CD2 3.69Å; L955-L1010 HydrophobicContact CG-CG 4.44Å
956	A	82.8	Confident	80.7	Confident	54 Å²	54	33.5 Å²	33.5	45%	0.446	18%	0.184	S	C	.	.	H	α-helix	trans	-59.4	-8.4	171.4	0	0	0	0	0	113.7	L952 S954 I960	L952-A956 VanDerWaalsContact O-CB 3.31Å; L952-A956 WeakPolarHBondContact O-CB 3.16Å; L952-A956 PolarHBondContact O-N 3.06Å; S954-A956 VanDerWaalsContact C-N 3.28Å; S954-A956 PolarHBondContact O-N 3.43Å; A956-I960 WeakPolarHBondContact O-CD1 3.3Å; A956-I960 VanDerWaalsContact O-CG1 3.32Å; A956-I960 WeakPolarHBondContact O-CG1 3.48Å
957	A	81.2	Confident	80.7	Confident	2 Å²	2	33 Å²	33	2%	0.017	18%	0.184	C	C	.	.	H	α-helix	trans	-126.3	-25.9	-167.3	0	0	0	0	0	116.6	L953 S954 L955 F959 I960 V961 L1019 A1020	L953-A957 WeakPolarHBondContact O-CB 3.36Å; S954-A957 CarbonylContact O-C 3.59Å; S954-A957 WeakPolarHBondContact O-CA 3.47Å; S954-A957 VanDerWaalsContact O-CB 3.32Å; S954-A957 WeakPolarHBondContact O-CB 3.37Å; S954-A957 PolarHBondContact O-N 2.91Å; L955-A957 PolarHBondContact O-N 3.15Å; A957-F959 PolarHBondContact O-N 3.47Å; A957-I960 PolarHBondContact O-N 3.46Å; A957-V961 WeakPolarHBondContact O-CB 3.26Å; A957-V961 WeakPolarHBondContact O-CG2 3.2Å; A957-V961 PolarHBondContact O-N 3.24Å; A957-L1019 VanDerWaalsContact CB-CA 3.44Å; A957-L1019 HydrophobicContact CB-CB 4.01Å; A957-L1019 HydrophobicContact CB-CD2 3.42Å; A957-L1019 VanDerWaalsContact CB-CD2 3.42Å; A957-L1019 HydrophobicContact CB-CG 4.29Å; A957-A1020 HydrophobicContact CB-CB 3.82Å
958	I	81.1	Confident	80.8	Confident	2 Å²	2	35.5 Å²	35.5	1%	0.01	20%	0.197	C	C	.	.	H	α-helix	trans	-53.6	-44.1	148.7	-52.5	154	0	0	0	106.7	S954 L955 I960 V961 S962 I976 V977 I980 V1021 V1025	S954-I958 PolarHBondContact O-N 3.44Å; L955-I958 HydrophobicContact CD2-CD1 4.49Å; I958-I960 VanDerWaalsContact C-N 3.29Å; I958-I960 PolarHBondContact O-N 3.08Å; I958-V961 PolarHBondContact O-N 3.28Å; I958-S962 WeakPolarHBondContact O-CA 3.46Å; I958-S962 WeakPolarHBondContact O-CB 3.4Å; I958-S962 PolarHBondContact O-N 3.45Å; I958-S962 PolarHBondContact O-OG 3Å; I958-I976 HydrophobicContact CD1-CG2 4.49Å; I958-I976 HydrophobicContact CG2-CG2 3.73Å; I958-V977 HydrophobicContact CB-CG2 4.12Å; I958-V977 HydrophobicContact CD1-CG2 4.23Å; I958-I980 HydrophobicContact CD1-CB 4.39Å; I958-I980 HydrophobicContact CD1-CD1 3.62Å; I958-I980 HydrophobicContact CD1-CG2 4.17Å; I958-V1021 HydrophobicContact CD1-CB 3.77Å; I958-V1021 HydrophobicContact CD1-CG1 4.06Å; I958-V1021 HydrophobicContact CD1-CG2 3.45Å; I958-V1021 VanDerWaalsContact CD1-CG2 3.45Å; I958-V1021 HydrophobicContact CG1-CB 3.38Å; I958-V1021 HydrophobicContact CG1-CG1 4.18Å; I958-V1021 HydrophobicContact CG1-CG2 3.25Å; I958-V1025 HydrophobicContact CD1-CG2 4.14Å; I958-V1025 HydrophobicContact CG1-CG2 3.92Å; I958-V1025 HydrophobicContact CG2-CG2 4.42Å
959	F	86	Confident	80.8	Confident	67 Å²	67	34 Å²	34	29%	0.294	19%	0.187	S	C	.	.	H	α-helix	trans	-51.9	-50.4	-178.5	-175.3	-106.3	0	0	0	111.1	L955 A957 S962 A963 V970 V977	L955-F959 WeakPolarHBondContact O-CB 3.35Å; L955-F959 PolarHBondContact O-N 3.27Å; A957-F959 PolarHBondContact O-N 3.47Å; F959-S962 PolarHBondContact O-OG 2.73Å; F959-A963 WeakPolarHBondContact O-CB 3.21Å; F959-A963 PolarHBondContact O-N 2.9Å; F959-V970 HydrophobicContact CE2-CG1 4.02Å; F959-V970 HydrophobicContact CZ-CG1 3.85Å; F959-V977 HydrophobicContact CB-CG2 4.03Å
960	I	88.1	Confident	81.1	Confident	79 Å²	79	35.2 Å²	35.2	41%	0.405	20%	0.197	S	C	.	.	H	α-helix	trans	-66.7	-52.5	176.5	-67	162.1	0	0	0	112.4	A956 A957 I958 A963 I964 L1019	A956-I960 WeakPolarHBondContact O-CD1 3.3Å; A956-I960 VanDerWaalsContact O-CG1 3.32Å; A956-I960 WeakPolarHBondContact O-CG1 3.48Å; A957-I960 PolarHBondContact O-N 3.46Å; I958-I960 VanDerWaalsContact C-N 3.29Å; I958-I960 PolarHBondContact O-N 3.08Å; I960-A963 PolarHBondContact O-N 3.26Å; I960-I964 HydrophobicContact CG2-CD1 3.79Å; I960-I964 VanDerWaalsContact O-CG1 3.31Å; I960-I964 WeakPolarHBondContact O-CG1 3.18Å; I960-I964 PolarHBondContact O-N 3.45Å; I960-L1019 HydrophobicContact CB-CD2 3.78Å; I960-L1019 HydrophobicContact CD1-CD2 3.89Å; I960-L1019 HydrophobicContact CG1-CD2 4.44Å; I960-L1019 HydrophobicContact CG2-CD2 3.87Å
961	V	86.3	Confident	81.7	Confident	8 Å²	8	41.3 Å²	41.3	5%	0.048	22%	0.22	C	C	.	.	H	α-helix	trans	-64.6	-45.5	-174.7	177.7	0	0	0	0	111.4	L589 F592 S593 F596 A957 I958 I964 L965 L1019 A1020	L589-V961 HydrophobicContact CD1-CG1 4.44Å; F592-V961 HydrophobicContact CB-CG1 4.42Å; S593-V961 VanDerWaalsContact OG-CG1 3.3Å; S593-V961 WeakPolarHBondContact OG-CG1 3.48Å; F596-V961 HydrophobicContact CD2-CG2 4.09Å; A957-V961 WeakPolarHBondContact O-CB 3.26Å; A957-V961 WeakPolarHBondContact O-CG2 3.2Å; A957-V961 PolarHBondContact O-N 3.24Å; I958-V961 PolarHBondContact O-N 3.28Å; V961-I964 PolarHBondContact O-N 2.67Å; V961-L965 HydrophobicContact CG1-CD1 3.86Å; V961-L965 WeakPolarHBondContact O-CB 3.09Å; V961-L965 PolarHBondContact O-N 3.24Å; V961-L1019 HydrophobicContact CG2-CB 4.37Å; V961-L1019 HydrophobicContact CG2-CD1 3.8Å; V961-L1019 HydrophobicContact CG2-CD2 4.29Å; V961-L1019 HydrophobicContact CG2-CG 4.37Å; V961-A1020 HydrophobicContact CG2-CB 4.01Å
962	S	83.7	Confident	82.2	Confident	1 Å²	1	40.2 Å²	40.2	1%	0.007	21%	0.214	C	C	.	.	H	α-helix	trans	-66.9	-41.4	175	69	0	0	0	0	112.4	I958 F959 I964 L965 M966 S973	I958-S962 WeakPolarHBondContact O-CA 3.46Å; I958-S962 WeakPolarHBondContact O-CB 3.4Å; I958-S962 PolarHBondContact O-N 3.45Å; I958-S962 PolarHBondContact O-OG 3Å; F959-S962 PolarHBondContact O-OG 2.73Å; S962-I964 VanDerWaalsContact C-N 3.27Å; S962-I964 PolarHBondContact O-N 3.34Å; S962-L965 PolarHBondContact O-N 3.48Å; S962-M966 WeakPolarHBondContact O-CB 3.35Å; S962-M966 VanDerWaalsContact O-CG 3.3Å; S962-M966 WeakPolarHBondContact O-CG 3.2Å; S962-M966 PolarHBondContact O-N 2.81Å; S962-S973 VanDerWaalsContact OG-CB 3.27Å; S962-S973 WeakPolarHBondContact OG-CB 3.42Å; S962-S973 PolarHBondContact OG-OG 2.91Å
963	A	85.8	Confident	82.5	Confident	11 Å²	11	35.4 Å²	35.4	9%	0.091	19%	0.189	C	C	.	.	H	α-helix	trans	-62.9	-38.8	178.6	0	0	0	0	0	110.5	F959 I960 L968 S973	F959-A963 WeakPolarHBondContact O-CB 3.21Å; F959-A963 PolarHBondContact O-N 2.9Å; I960-A963 PolarHBondContact O-N 3.26Å; A963-L968 WeakPolarHBondContact O-CA 3.42Å; A963-L968 PolarHBondContact O-N 3.35Å; A963-S973 WeakPolarHBondContact CA-OG 3.28Å; A963-S973 PolarHBondContact N-OG 2.95Å
964	I	87.1	Confident	83	Confident	80 Å²	80	35.7 Å²	35.7	41%	0.41	20%	0.195	S	C	.	.	H	α-helix	trans	-66.8	-58.9	174.1	-65.7	167.1	0	0	0	110.3	L180 I960 V961 S962 M966 G967	L180-I964 HydrophobicContact CD2-CG2 4.09Å; L180-I964 VanDerWaalsContact CD2-O 3.26Å; L180-I964 WeakPolarHBondContact CD2-O 3.41Å; I960-I964 HydrophobicContact CG2-CD1 3.79Å; I960-I964 VanDerWaalsContact O-CG1 3.31Å; I960-I964 WeakPolarHBondContact O-CG1 3.18Å; I960-I964 PolarHBondContact O-N 3.45Å; V961-I964 PolarHBondContact O-N 2.67Å; S962-I964 VanDerWaalsContact C-N 3.27Å; S962-I964 PolarHBondContact O-N 3.34Å; I964-M966 PolarHBondContact O-N 3.47Å; I964-G967 PolarHBondContact O-N 2.97Å
965	L	85.5	Confident	83.6	Confident	21 Å²	21	36 Å²	36	11%	0.11	20%	0.196	C	C	.	.	H	α-helix	trans	-79.8	-9.3	-168.7	-64.4	176.7	0	0	0	115.3	L184 L588 L589 V961 S962 R1033	L184-L965 HydrophobicContact CD1-CD2 4.04Å; L588-L965 HydrophobicContact CD2-CD1 4.42Å; L588-L965 HydrophobicContact CD2-CD2 4.12Å; L588-L965 HydrophobicContact CG-CD1 4.35Å; L589-L965 HydrophobicContact CB-CB 4.27Å; L589-L965 HydrophobicContact CB-CD1 4.33Å; L589-L965 HydrophobicContact CD1-CB 4Å; L589-L965 HydrophobicContact CD1-CD1 4.48Å; V961-L965 HydrophobicContact CG1-CD1 3.86Å; V961-L965 WeakPolarHBondContact O-CB 3.09Å; V961-L965 PolarHBondContact O-N 3.24Å; S962-L965 PolarHBondContact O-N 3.48Å; L965-R1033 PolarHBondContact O-NH1 2.97Å
966	M	80	Confident	84	Confident	24 Å²	24	34.8 Å²	34.8	12%	0.118	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	0.7	165.4	-65.5	-167.3	152.6	0	0	113.4	L589 S962 I964 I976 T1032 R1033	L589-M966 HydrophobicContact CD2-CE 3.86Å; L589-M966 HydrophobicContact CD2-CG 4.09Å; S962-M966 WeakPolarHBondContact O-CB 3.35Å; S962-M966 VanDerWaalsContact O-CG 3.3Å; S962-M966 WeakPolarHBondContact O-CG 3.2Å; S962-M966 PolarHBondContact O-N 2.81Å; I964-M966 PolarHBondContact O-N 3.47Å; M966-I976 HydrophobicContact CE-CD1 3.57Å; M966-I976 HydrophobicContact SD-CD1 3.95Å; M966-T1032 HydrophobicContact CE-CG2 4.13Å; M966-R1033 HydrophobicContact CE-CB 3.94Å
967	G	77.2	Confident	84.1	Confident	13 Å²	13	33.4 Å²	33.4	13%	0.134	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.6	49.8	179.6	0	0	0	0	0	113.1	G177 I964 D969	G177-G967 VanDerWaalsContact CA-C 3.49Å; G177-G967 WeakPolarHBondContact CA-O 3.49Å; I964-G967 PolarHBondContact O-N 2.97Å; G967-D969 PolarHBondContact O-N 2.78Å
968	L	81	Confident	84.4	Confident	54 Å²	54	36.6 Å²	36.6	28%	0.283	20%	0.197	S	C	.	.	S	Bend	trans	62	20	174.3	-55.2	171.3	0	0	0	115.2	M176 A963 V970	M176-L968 HydrophobicContact CB-CD1 4.12Å; M176-L968 HydrophobicContact CE-CD1 3.45Å; M176-L968 VanDerWaalsContact CE-CD1 3.45Å; M176-L968 HydrophobicContact CG-CD1 4.03Å; A963-L968 WeakPolarHBondContact O-CA 3.42Å; A963-L968 PolarHBondContact O-N 3.35Å; L968-V970 VanDerWaalsContact C-N 3.28Å; L968-V970 PolarHBondContact O-N 3.08Å
969	D	79.1	Confident	84.7	Confident	40 Å²	40	36.5 Å²	36.5	21%	0.214	20%	0.197	C	C	.	.			trans	-78	77.4	169.4	-174.3	8.3	0	0	0	111.6	G967 W971 S972 S973 P1113	G967-D969 PolarHBondContact O-N 2.78Å; D969-W971 PolarHBondContact O-N 3.34Å; D969-W971 VanDerWaalsContact O-N 3.09Å; D969-W971 WeakPolarHBondContact OD1-CB 3.49Å; D969-W971 PolarHBondContact OD1-N 3.46Å; D969-W971 VanDerWaalsContact OD1-N 3.1Å; D969-S972 PolarHBondContact O-N 2.93Å; D969-S972 PolarHBondContact OD1-N 3.35Å; D969-S972 VanDerWaalsContact OD2-CB 3.28Å; D969-S972 WeakPolarHBondContact OD2-CB 3.44Å; D969-S972 PolarHBondContact OD2-OG 2.94Å; D969-S973 PolarHBondContact O-N 3Å; D969-S973 PolarHBondContact O-OG 2.85Å; D969-P1113 WeakPolarHBondContact OD2-CB 3.06Å
970	V	84.3	Confident	84.7	Confident	75 Å²	75	33.3 Å²	33.3	46%	0.455	18%	0.183	S	C	.	.	H	α-helix	trans	-49.8	-31.2	172.5	170	0	0	0	0	112.5	F959 L968 S973 C974	F959-V970 HydrophobicContact CE2-CG1 4.02Å; F959-V970 HydrophobicContact CZ-CG1 3.85Å; L968-V970 VanDerWaalsContact C-N 3.28Å; L968-V970 PolarHBondContact O-N 3.08Å; V970-S973 PolarHBondContact O-N 3.24Å; V970-C974 PolarHBondContact O-N 3.31Å; V970-C974 PolarHBondContact O-SG 3Å; V970-C974 VanDerWaalsContact O-SG 3.33Å
971	W	84.6	Confident	84.6	Confident	131 Å²	131	30.7 Å²	30.7	50%	0.496	17%	0.172	S	C	.	.	H	α-helix	trans	-72.4	-42.3	-177.4	-169.6	-91	0	0	0	111.8	D969 S973 C974 I975 V1111	D969-W971 PolarHBondContact O-N 3.34Å; D969-W971 VanDerWaalsContact O-N 3.09Å; D969-W971 WeakPolarHBondContact OD1-CB 3.49Å; D969-W971 PolarHBondContact OD1-N 3.46Å; D969-W971 VanDerWaalsContact OD1-N 3.1Å; W971-S973 VanDerWaalsContact C-N 3.33Å; W971-C974 PolarHBondContact O-N 3.27Å; W971-I975 WeakPolarHBondContact O-CG1 3.43Å; W971-I975 PolarHBondContact O-N 3.49Å; W971-I975 VanDerWaalsContact O-N 3.09Å; W971-V1111 HydrophobicContact CZ2-CG1 3.87Å; W971-V1111 PolarHBondContact NE1-O 2.67Å
972	S	85.2	Confident	84.6	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-61	-41.7	170.6	-73.2	0	0	0	0	112	D969 I975 I976 P1113	D969-S972 PolarHBondContact O-N 2.93Å; D969-S972 PolarHBondContact OD1-N 3.35Å; D969-S972 VanDerWaalsContact OD2-CB 3.28Å; D969-S972 WeakPolarHBondContact OD2-CB 3.44Å; D969-S972 PolarHBondContact OD2-OG 2.94Å; S972-I975 PolarHBondContact O-N 3.11Å; S972-I976 WeakPolarHBondContact O-CG1 3.41Å; S972-I976 PolarHBondContact O-N 2.82Å; S972-P1113 WeakPolarHBondContact OG-CG 3.33Å
973	S	85.3	Confident	84.8	Confident	0 Å²	0	31 Å²	31	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-61.7	-43.1	175.6	-61.7	0	0	0	0	113.1	S962 A963 D969 V970 W971 I975 I976 V977	S962-S973 VanDerWaalsContact OG-CB 3.27Å; S962-S973 WeakPolarHBondContact OG-CB 3.42Å; S962-S973 PolarHBondContact OG-OG 2.91Å; A963-S973 WeakPolarHBondContact CA-OG 3.28Å; A963-S973 PolarHBondContact N-OG 2.95Å; D969-S973 PolarHBondContact O-N 3Å; D969-S973 PolarHBondContact O-OG 2.85Å; V970-S973 PolarHBondContact O-N 3.24Å; W971-S973 VanDerWaalsContact C-N 3.33Å; S973-I975 VanDerWaalsContact C-N 3.31Å; S973-I975 PolarHBondContact O-N 2.83Å; S973-I976 PolarHBondContact O-N 3.47Å; S973-V977 WeakPolarHBondContact O-CB 3.24Å; S973-V977 VanDerWaalsContact O-CG2 3.31Å; S973-V977 WeakPolarHBondContact O-CG2 3.5Å; S973-V977 PolarHBondContact O-N 3.47Å
974	C	86.5	Confident	84.7	Confident	61 Å²	61	30.8 Å²	30.8	41%	0.412	17%	0.173	S	C	.	.	H	α-helix	trans	-60.3	-39	173.1	-74.2	0	0	0	0	112.4	V970 W971 C978	V970-C974 PolarHBondContact O-N 3.31Å; V970-C974 PolarHBondContact O-SG 3Å; V970-C974 VanDerWaalsContact O-SG 3.33Å; W971-C974 PolarHBondContact O-N 3.27Å; C974-C978 VanDerWaalsContact O-CB 3.23Å; C974-C978 WeakPolarHBondContact O-CB 3.45Å; C974-C978 PolarHBondContact O-N 3.29Å
975	I	87.8	Confident	84.7	Confident	6 Å²	6	30.4 Å²	30.4	3%	0.031	17%	0.168	C	C	.	.	H	α-helix	trans	-65	-47.7	177.7	-71.1	172.2	0	0	0	110.9	W971 S972 S973 V977 C978 V979 L1104 F1107 L1108	W971-I975 WeakPolarHBondContact O-CG1 3.43Å; W971-I975 PolarHBondContact O-N 3.49Å; W971-I975 VanDerWaalsContact O-N 3.09Å; S972-I975 PolarHBondContact O-N 3.11Å; S973-I975 VanDerWaalsContact C-N 3.31Å; S973-I975 PolarHBondContact O-N 2.83Å; I975-V977 PolarHBondContact O-N 3.07Å; I975-C978 PolarHBondContact O-N 3.15Å; I975-V979 WeakPolarHBondContact O-CG2 3.3Å; I975-V979 PolarHBondContact O-N 3.42Å; I975-L1104 HydrophobicContact CG2-CD1 3.88Å; I975-F1107 HydrophobicContact CB-CE1 4.48Å; I975-F1107 HydrophobicContact CG1-CE1 4.1Å; I975-F1107 HydrophobicContact CG2-CD1 3.97Å; I975-F1107 HydrophobicContact CG2-CE1 4.03Å; I975-L1108 HydrophobicContact CD1-CD2 4.04Å; I975-L1108 HydrophobicContact CG2-CD2 4.15Å
976	I	85.4	Confident	84.9	Confident	1 Å²	1	29.4 Å²	29.4	1%	0.005	16%	0.163	C	C	.	.	H	α-helix	trans	-58.6	-49.5	178.6	-67.7	166.2	0	0	0	110.5	I958 M966 S972 S973 C978 V979 I980 C1028 T1032	I958-I976 HydrophobicContact CD1-CG2 4.49Å; I958-I976 HydrophobicContact CG2-CG2 3.73Å; M966-I976 HydrophobicContact CE-CD1 3.57Å; M966-I976 HydrophobicContact SD-CD1 3.95Å; S972-I976 WeakPolarHBondContact O-CG1 3.41Å; S972-I976 PolarHBondContact O-N 2.82Å; S973-I976 PolarHBondContact O-N 3.47Å; I976-C978 VanDerWaalsContact C-N 3.33Å; I976-C978 PolarHBondContact O-N 2.9Å; I976-V979 PolarHBondContact O-N 2.63Å; I976-I980 HydrophobicContact CG2-CD1 3.65Å; I976-I980 HydrophobicContact CG2-CG1 4.48Å; I976-I980 WeakPolarHBondContact O-CB 3.5Å; I976-I980 WeakPolarHBondContact O-CG1 3.49Å; I976-I980 PolarHBondContact O-N 3.15Å; I976-C1028 HydrophobicContact CG1-CB 4.5Å; I976-C1028 HydrophobicContact CG2-CB 4.19Å; I976-T1032 HydrophobicContact CD1-CG2 4.01Å; I976-T1032 HydrophobicContact CG1-CG2 4.03Å
977	V	85.7	Confident	85.3	Confident	26 Å²	26	28.6 Å²	28.6	16%	0.158	16%	0.159	C	C	.	.	H	α-helix	trans	-61.1	-40.2	178.5	169.2	0	0	0	0	111.9	L955 I958 F959 S973 I975 S981	L955-V977 HydrophobicContact CB-CG1 4.15Å; L955-V977 HydrophobicContact CD2-CG1 4.06Å; L955-V977 WeakPolarHBondContact O-CG2 3.39Å; I958-V977 HydrophobicContact CB-CG2 4.12Å; I958-V977 HydrophobicContact CD1-CG2 4.23Å; F959-V977 HydrophobicContact CB-CG2 4.03Å; S973-V977 WeakPolarHBondContact O-CB 3.24Å; S973-V977 VanDerWaalsContact O-CG2 3.31Å; S973-V977 WeakPolarHBondContact O-CG2 3.5Å; S973-V977 PolarHBondContact O-N 3.47Å; I975-V977 PolarHBondContact O-N 3.07Å; V977-S981 WeakPolarHBondContact O-CB 3.2Å; V977-S981 PolarHBondContact O-N 2.97Å; V977-S981 PolarHBondContact O-OG 3.33Å
978	C	86.3	Confident	85.7	Confident	68 Å²	68	28.7 Å²	28.7	46%	0.459	16%	0.156	S	C	.	.	H	α-helix	trans	-65.3	-43.2	177.3	-173.7	0	0	0	0	112.6	C974 I975 I976 A982	C974-C978 VanDerWaalsContact O-CB 3.23Å; C974-C978 WeakPolarHBondContact O-CB 3.45Å; C974-C978 PolarHBondContact O-N 3.29Å; I975-C978 PolarHBondContact O-N 3.15Å; I976-C978 VanDerWaalsContact C-N 3.33Å; I976-C978 PolarHBondContact O-N 2.9Å; C978-A982 PolarHBondContact O-N 2.98Å
979	V	88.3	Confident	86.1	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-67.4	-43.5	178.5	174	0	0	0	0	110.7	I975 I976 S981 A982 I983 H1099 F1103 L1104 F1107	I975-V979 WeakPolarHBondContact O-CG2 3.3Å; I975-V979 PolarHBondContact O-N 3.42Å; I976-V979 PolarHBondContact O-N 2.63Å; V979-S981 VanDerWaalsContact C-N 3.34Å; V979-S981 PolarHBondContact O-N 3.11Å; V979-A982 WeakPolarHBondContact O-CB 3.24Å; V979-A982 PolarHBondContact O-N 2.9Å; V979-A982 VanDerWaalsContact O-N 3.14Å; V979-I983 HydrophobicContact CG1-CD1 4.42Å; V979-I983 WeakPolarHBondContact O-CG1 3.42Å; V979-I983 PolarHBondContact O-N 3.19Å; V979-H1099 HydrophobicContact CG1-CB 4Å; V979-F1103 HydrophobicContact CG1-CD1 4.44Å; V979-F1103 HydrophobicContact CG2-CD1 4.11Å; V979-F1103 HydrophobicContact CG2-CE1 4.02Å; V979-L1104 HydrophobicContact CG2-CD1 4.1Å; V979-F1107 HydrophobicContact CG2-CD1 4.43Å
980	I	86.2	Confident	86.7	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-67.7	-34.9	179.6	-70	176.5	0	0	0	111.7	L955 I958 I976 A982 I983 L984 L1010 V1021 V1025 C1028	L955-I980 HydrophobicContact CD2-CG2 4.22Å; I958-I980 HydrophobicContact CD1-CB 4.39Å; I958-I980 HydrophobicContact CD1-CD1 3.62Å; I958-I980 HydrophobicContact CD1-CG2 4.17Å; I976-I980 HydrophobicContact CG2-CD1 3.65Å; I976-I980 HydrophobicContact CG2-CG1 4.48Å; I976-I980 WeakPolarHBondContact O-CB 3.5Å; I976-I980 WeakPolarHBondContact O-CG1 3.49Å; I976-I980 PolarHBondContact O-N 3.15Å; I980-A982 VanDerWaalsContact C-N 3.32Å; I980-A982 PolarHBondContact O-N 2.87Å; I980-I983 HydrophobicContact CG1-CD1 4.45Å; I980-I983 PolarHBondContact O-N 3.39Å; I980-L984 PolarHBondContact O-N 3.27Å; I980-L984 VanDerWaalsContact O-N 3.12Å; I980-L1010 HydrophobicContact CG2-CD1 3.23Å; I980-V1021 HydrophobicContact CG2-CG1 4.48Å; I980-V1025 HydrophobicContact CD1-CG2 3.74Å; I980-C1028 HydrophobicContact CD1-CB 4.36Å
981	S	84.7	Confident	86.9	Confident	25 Å²	25	21.4 Å²	21.4	18%	0.175	12%	0.115	C	C	.	.	H	α-helix	trans	-60.9	-40	170.4	-57.4	0	0	0	0	112.1	L955 V977 V979 L984 F985	L955-S981 WeakPolarHBondContact CD1-OG 3.34Å; V977-S981 WeakPolarHBondContact O-CB 3.2Å; V977-S981 PolarHBondContact O-N 2.97Å; V977-S981 PolarHBondContact O-OG 3.33Å; V979-S981 VanDerWaalsContact C-N 3.34Å; V979-S981 PolarHBondContact O-N 3.11Å; S981-L984 WeakPolarHBondContact O-CB 3.16Å; S981-L984 PolarHBondContact O-N 3.35Å; S981-F985 WeakPolarHBondContact O-CD2 3.49Å; S981-F985 PolarHBondContact O-N 3.45Å; S981-F985 VanDerWaalsContact O-N 3.12Å
982	A	86.7	Confident	87.2	Confident	16 Å²	16	18.5 Å²	18.5	13%	0.132	11%	0.105	C	C	.	.	H	α-helix	trans	-67.9	-37.7	176.7	0	0	0	0	0	112.6	C978 V979 I980 L984 F985 N986	C978-A982 PolarHBondContact O-N 2.98Å; V979-A982 WeakPolarHBondContact O-CB 3.24Å; V979-A982 PolarHBondContact O-N 2.9Å; V979-A982 VanDerWaalsContact O-N 3.14Å; I980-A982 VanDerWaalsContact C-N 3.32Å; I980-A982 PolarHBondContact O-N 2.87Å; A982-L984 VanDerWaalsContact C-N 3.3Å; A982-L984 PolarHBondContact O-N 2.88Å; A982-F985 PolarHBondContact O-N 3.27Å; A982-N986 WeakPolarHBondContact O-CB 3.31Å; A982-N986 PolarHBondContact O-N 3.22Å; A982-N986 VanDerWaalsContact O-N 3.1Å; A982-N986 PolarHBondContact O-ND2 3.42Å
983	I	87.9	Confident	87.4	Confident	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-57.5	-46	172.5	-64.5	166.6	0	0	0	110	V979 I980 N986 L987 V1009 F1095 H1099	V979-I983 HydrophobicContact CG1-CD1 4.42Å; V979-I983 WeakPolarHBondContact O-CG1 3.42Å; V979-I983 PolarHBondContact O-N 3.19Å; I980-I983 HydrophobicContact CG1-CD1 4.45Å; I980-I983 PolarHBondContact O-N 3.39Å; I983-N986 PolarHBondContact O-N 3.11Å; I983-L987 HydrophobicContact CG2-CD1 3.89Å; I983-L987 HydrophobicContact CG2-CG 4.4Å; I983-L987 WeakPolarHBondContact O-CG 3.47Å; I983-L987 PolarHBondContact O-N 3.36Å; I983-V1009 HydrophobicContact CG2-CG1 4.12Å; I983-F1095 HydrophobicContact CG2-CB 4.5Å; I983-H1099 HydrophobicContact CD1-CB 3.7Å; I983-H1099 HydrophobicContact CG1-CB 3.5Å; I983-H1099 VanDerWaalsContact CG1-CB 3.5Å
984	L	84.1	Confident	87.7	Confident	6 Å²	6	29.5 Å²	29.5	3%	0.031	15%	0.147	C	C	.	.	H	α-helix	trans	-61.4	-49.2	178.6	-97.3	-169.6	0	0	0	114.2	L951 I980 S981 A982 N986 L987 M988 L1006 V1009 L1010	L951-L984 HydrophobicContact CD2-CD1 3.75Å; L951-L984 HydrophobicContact CD2-CD2 4.36Å; I980-L984 PolarHBondContact O-N 3.27Å; I980-L984 VanDerWaalsContact O-N 3.12Å; S981-L984 WeakPolarHBondContact O-CB 3.16Å; S981-L984 PolarHBondContact O-N 3.35Å; A982-L984 VanDerWaalsContact C-N 3.3Å; A982-L984 PolarHBondContact O-N 2.88Å; L984-N986 PolarHBondContact O-N 2.6Å; L984-L987 PolarHBondContact O-N 2.88Å; L984-L987 VanDerWaalsContact O-N 3.12Å; L984-M988 HydrophobicContact CB-CE 4.24Å; L984-M988 PolarHBondContact O-N 2.92Å; L984-L1006 HydrophobicContact CD2-CD2 4.11Å; L984-V1009 HydrophobicContact CD2-CG1 4.36Å; L984-L1010 HydrophobicContact CD1-CB 3.82Å; L984-L1010 HydrophobicContact CD1-CD1 3.8Å; L984-L1010 HydrophobicContact CD1-CD2 3.24Å; L984-L1010 HydrophobicContact CD1-CG 3.76Å; L984-L1010 HydrophobicContact CD2-CB 4.2Å; L984-L1010 HydrophobicContact CG-CB 4.17Å; L984-L1010 HydrophobicContact CG-CD1 4.15Å; L984-L1010 HydrophobicContact CG-CD2 4.37Å; L984-L1010 HydrophobicContact CG-CG 4.43Å
985	F	86.8	Confident	87.8	Confident	72 Å²	72	32.9 Å²	32.9	32%	0.316	16%	0.161	S	C	.	.	H	α-helix	trans	-60.1	-40.6	179	-68.2	-56.7	0	0	0	110.7	S698 L699 S981 A982 L987 M988 G989	S698-F985 WeakPolarHBondContact CB-O 3.43Å; L699-F985 HydrophobicContact CD1-CD1 3.69Å; L699-F985 HydrophobicContact CD1-CE1 3.72Å; L699-F985 HydrophobicContact CD1-CG 4.27Å; L699-F985 HydrophobicContact CD1-CZ 4.31Å; S981-F985 WeakPolarHBondContact O-CD2 3.49Å; S981-F985 PolarHBondContact O-N 3.45Å; S981-F985 VanDerWaalsContact O-N 3.12Å; A982-F985 PolarHBondContact O-N 3.27Å; F985-L987 PolarHBondContact O-N 3.48Å; F985-M988 HydrophobicContact CD1-CE 3.77Å; F985-M988 HydrophobicContact CE1-CE 4.14Å; F985-M988 PolarHBondContact O-N 2.81Å; F985-G989 PolarHBondContact O-N 3.04Å
986	N	89.7	Confident	87.8	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-64.5	-35.9	175.1	-71.3	-36.8	0	0	0	113.1	W694 C695 S698 A982 I983 L984 G989 L990 F1095 H1099	W694-N986 VanDerWaalsContact C-OD1 3.3Å; W694-N986 PolarHBondContact NE1-OD1 2.87Å; W694-N986 PolarHBondContact O-OD1 3.12Å; C695-N986 VanDerWaalsContact CA-OD1 3.27Å; C695-N986 WeakPolarHBondContact CA-OD1 3.26Å; C695-N986 PolarHBondContact N-OD1 3.32Å; S698-N986 PolarHBondContact OG-OD1 3.01Å; A982-N986 WeakPolarHBondContact O-CB 3.31Å; A982-N986 PolarHBondContact O-N 3.22Å; A982-N986 VanDerWaalsContact O-N 3.1Å; A982-N986 PolarHBondContact O-ND2 3.42Å; I983-N986 PolarHBondContact O-N 3.11Å; L984-N986 PolarHBondContact O-N 2.6Å; N986-G989 PolarHBondContact O-N 3.35Å; N986-L990 PolarHBondContact O-N 3.16Å; N986-F1095 HydrophobicContact CB-CD2 4.04Å; N986-F1095 HydrophobicContact CB-CE2 4.27Å; N986-F1095 WeakPolarHBondContact O-CE2 3.22Å; N986-H1099 PolarHBondContact ND2-CE1 3.03Å; N986-H1099 VanDerWaalsContact ND2-CE1 3.29Å; N986-H1099 PolarHBondContact ND2-NE2 2.96Å
987	L	87.8	Confident	88	Confident	7 Å²	7	33.5 Å²	33.5	4%	0.037	17%	0.167	C	C	.	.	H	α-helix	trans	-69.9	-39.4	174.2	-72.5	169.2	0	0	0	113.2	I983 L984 F985 G989 L990 M991 L1006 V1009 I1092 F1095	I983-L987 HydrophobicContact CG2-CD1 3.89Å; I983-L987 HydrophobicContact CG2-CG 4.4Å; I983-L987 WeakPolarHBondContact O-CG 3.47Å; I983-L987 PolarHBondContact O-N 3.36Å; L984-L987 PolarHBondContact O-N 2.88Å; L984-L987 VanDerWaalsContact O-N 3.12Å; F985-L987 PolarHBondContact O-N 3.48Å; L987-G989 VanDerWaalsContact C-N 3.27Å; L987-G989 PolarHBondContact O-N 3.12Å; L987-L990 HydrophobicContact CD2-CD2 4.4Å; L987-L990 WeakPolarHBondContact O-CB 3.37Å; L987-L990 PolarHBondContact O-N 3.31Å; L987-M991 PolarHBondContact O-N 3.03Å; L987-L1006 HydrophobicContact CB-CD2 3.93Å; L987-V1009 HydrophobicContact CD1-CB 4.23Å; L987-V1009 HydrophobicContact CD1-CG1 3.88Å; L987-V1009 HydrophobicContact CD1-CG2 3.67Å; L987-I1092 HydrophobicContact CD1-CG1 4.06Å; L987-I1092 HydrophobicContact CD2-CG1 4.09Å; L987-F1095 HydrophobicContact CD2-CD2 3.59Å; L987-F1095 HydrophobicContact CD2-CE2 4.03Å; L987-F1095 HydrophobicContact CD2-CG 4.34Å; L987-F1095 HydrophobicContact CG-CD2 3.92Å
988	M	87	Confident	88.1	Confident	15 Å²	15	33 Å²	33	7%	0.074	16%	0.163	C	C	.	.	H	α-helix	trans	-63.5	-34.8	170.7	-73.4	-177.4	-84.1	0	0	111.3	V702 L705 L984 F985 M991 F992 L1006	V702-M988 HydrophobicContact CG1-CB 4.43Å; V702-M988 HydrophobicContact CG1-SD 3.85Å; V702-M988 HydrophobicContact CG2-CB 4Å; L705-M988 HydrophobicContact CD1-CB 4.18Å; L705-M988 HydrophobicContact CD1-CG 4.37Å; L984-M988 HydrophobicContact CB-CE 4.24Å; L984-M988 PolarHBondContact O-N 2.92Å; F985-M988 HydrophobicContact CD1-CE 3.77Å; F985-M988 HydrophobicContact CE1-CE 4.14Å; F985-M988 PolarHBondContact O-N 2.81Å; M988-M991 PolarHBondContact O-N 2.85Å; M988-F992 PolarHBondContact O-N 3Å; M988-L1006 HydrophobicContact CG-CD1 4.2Å; M988-L1006 HydrophobicContact CG-CD2 4.22Å
989	G	89.1	Confident	88	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-63.3	-42.1	169.3	0	0	0	0	0	113.8	F985 N986 L987 F992 W993	F985-G989 PolarHBondContact O-N 3.04Å; N986-G989 PolarHBondContact O-N 3.35Å; L987-G989 VanDerWaalsContact C-N 3.27Å; L987-G989 PolarHBondContact O-N 3.12Å; G989-F992 PolarHBondContact O-N 3.29Å; G989-W993 PolarHBondContact O-N 3.34Å
990	L	90.4	Very high	87.6	Confident	13 Å²	13	30 Å²	30	7%	0.068	14%	0.142	C	C	.	.	H	α-helix	trans	-63.2	-40.4	175.3	177.7	66.4	0	0	0	112.1	N986 L987 F992 W993 W994 F1095	N986-L990 PolarHBondContact O-N 3.16Å; L987-L990 HydrophobicContact CD2-CD2 4.4Å; L987-L990 WeakPolarHBondContact O-CB 3.37Å; L987-L990 PolarHBondContact O-N 3.31Å; L990-F992 VanDerWaalsContact C-N 3.28Å; L990-F992 PolarHBondContact O-N 2.95Å; L990-W993 PolarHBondContact O-N 2.87Å; L990-W994 HydrophobicContact CD1-CD2 3.61Å; L990-W994 HydrophobicContact CD1-CE3 3.74Å; L990-W994 HydrophobicContact CD1-CG 3.94Å; L990-W994 HydrophobicContact CD1-CZ3 4.27Å; L990-W994 HydrophobicContact CD2-CE3 4.29Å; L990-W994 HydrophobicContact CD2-CZ3 4.45Å; L990-W994 HydrophobicContact CG-CD2 4.39Å; L990-W994 HydrophobicContact CG-CE3 4.14Å; L990-W994 WeakPolarHBondContact O-CB 3.36Å; L990-W994 PolarHBondContact O-N 3.06Å; L990-F1095 HydrophobicContact CB-CE2 3.77Å; L990-F1095 HydrophobicContact CB-CZ 3.97Å; L990-F1095 HydrophobicContact CD1-CZ 4.2Å; L990-F1095 HydrophobicContact CD2-CE2 3.91Å; L990-F1095 HydrophobicContact CD2-CZ 3.77Å; L990-F1095 HydrophobicContact CG-CE2 4.37Å; L990-F1095 HydrophobicContact CG-CZ 4.2Å
991	M	89.9	Confident	87.3	Confident	3 Å²	3	30.4 Å²	30.4	2%	0.015	15%	0.145	C	C	.	.	H	α-helix	trans	-57.3	-43.6	176.1	-75.3	-179.2	60.9	0	0	111.5	L705 L987 M988 N995 I996 F998 L1006 M1088	L705-M991 HydrophobicContact CD2-CB 3.61Å; L987-M991 PolarHBondContact O-N 3.03Å; M988-M991 PolarHBondContact O-N 2.85Å; M991-N995 PolarHBondContact O-N 3.28Å; M991-N995 VanDerWaalsContact O-N 3.16Å; M991-I996 HydrophobicContact CB-CB 4.13Å; M991-I996 HydrophobicContact CE-CG2 4.22Å; M991-I996 WeakPolarHBondContact CE-O 3.28Å; M991-I996 HydrophobicContact CG-CB 4.11Å; M991-I996 HydrophobicContact CG-CG2 4.35Å; M991-I996 PolarHBondContact O-N 3.46Å; M991-F998 HydrophobicContact CE-CB 4.33Å; M991-F998 HydrophobicContact CE-CD2 3.95Å; M991-L1006 HydrophobicContact SD-CD1 3.68Å; M991-L1006 HydrophobicContact SD-CD2 4.05Å; M991-L1006 HydrophobicContact SD-CG 3.91Å; M991-M1088 HydrophobicContact CG-CE 4.08Å; M991-M1088 HydrophobicContact SD-CE 3.64Å
992	F	90.5	Very high	87.2	Confident	69 Å²	69	29.2 Å²	29.2	30%	0.303	14%	0.136	S	C	.	.	H	α-helix	trans	-64.6	-47.2	173.5	179.7	-108	0	0	0	112.1	V701 K704 L705 M988 G989 L990 W994 N995	V701-F992 HydrophobicContact CB-CB 4.31Å; V701-F992 HydrophobicContact CB-CD1 3.49Å; V701-F992 VanDerWaalsContact CB-CD1 3.49Å; V701-F992 HydrophobicContact CB-CE1 3.94Å; V701-F992 HydrophobicContact CB-CG 3.91Å; V701-F992 HydrophobicContact CG1-CD1 3.74Å; V701-F992 HydrophobicContact CG1-CE1 3.77Å; V701-F992 HydrophobicContact CG2-CB 3.98Å; V701-F992 HydrophobicContact CG2-CD1 3.7Å; V701-F992 HydrophobicContact CG2-CG 4.07Å; K704-F992 HydrophobicContact CB-CD2 3.86Å; K704-F992 HydrophobicContact CB-CE2 3.55Å; K704-F992 HydrophobicContact CB-CZ 4.19Å; K704-F992 HydrophobicContact CD-CE2 4.24Å; K704-F992 HydrophobicContact CD-CZ 4.05Å; K704-F992 WeakPolarHBondContact O-CD2 3.4Å; L705-F992 HydrophobicContact CD2-CB 3.89Å; M988-F992 PolarHBondContact O-N 3Å; G989-F992 PolarHBondContact O-N 3.29Å; L990-F992 VanDerWaalsContact C-N 3.28Å; L990-F992 PolarHBondContact O-N 2.95Å; F992-W994 VanDerWaalsContact C-N 3.27Å; F992-W994 PolarHBondContact O-N 3.19Å; F992-N995 PolarHBondContact O-N 2.84Å; F992-N995 PolarHBondContact O-OD1 3.42Å
993	W	90.4	Very high	86.7	Confident	128 Å²	128	28.5 Å²	28.5	49%	0.485	13%	0.13	S	C	.	.	H	α-helix	trans	-68.3	-20.6	-178.4	-63.7	-15.2	0	0	0	114.9	W694 G989 L990	W694-W993 AromaticContact NE1-CZ3 3.97Å; G989-W993 PolarHBondContact O-N 3.34Å; L990-W993 PolarHBondContact O-N 2.87Å
994	W	90.9	Very high	86	Confident	103 Å²	103	28.8 Å²	28.8	39%	0.39	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.8	15.5	178.9	-82.4	2.6	0	0	0	113.8	L990 F992 I996 R1087 L1090	L990-W994 HydrophobicContact CD1-CD2 3.61Å; L990-W994 HydrophobicContact CD1-CE3 3.74Å; L990-W994 HydrophobicContact CD1-CG 3.94Å; L990-W994 HydrophobicContact CD1-CZ3 4.27Å; L990-W994 HydrophobicContact CD2-CE3 4.29Å; L990-W994 HydrophobicContact CD2-CZ3 4.45Å; L990-W994 HydrophobicContact CG-CD2 4.39Å; L990-W994 HydrophobicContact CG-CE3 4.14Å; L990-W994 WeakPolarHBondContact O-CB 3.36Å; L990-W994 PolarHBondContact O-N 3.06Å; F992-W994 VanDerWaalsContact C-N 3.27Å; F992-W994 PolarHBondContact O-N 3.19Å; W994-I996 VanDerWaalsContact C-N 3.32Å; W994-I996 HydrophobicContact CB-CD1 4.16Å; W994-I996 HydrophobicContact CB-CG1 4.08Å; W994-I996 PolarHBondContact O-N 3.4Å; W994-R1087 HydrophobicContact CE3-CB 3.67Å; W994-R1087 HydrophobicContact CE3-CG 3.69Å; W994-R1087 HydrophobicContact CZ3-CB 3.81Å; W994-R1087 HydrophobicContact CZ3-CG 3.86Å; W994-R1087 PolarHBondContact O-NH1 2.63Å; W994-L1090 HydrophobicContact CH2-CD2 4.19Å
995	N	89.2	Confident	85.7	Confident	132 Å²	132	28.5 Å²	28.5	71%	0.706	13%	0.131	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.6	48.6	178.8	-58.3	-3	0	0	0	112.7	M991 F992	M991-N995 PolarHBondContact O-N 3.28Å; M991-N995 VanDerWaalsContact O-N 3.16Å; F992-N995 PolarHBondContact O-N 2.84Å; F992-N995 PolarHBondContact O-OD1 3.42Å
996	I	87.9	Confident	85	Confident	4 Å²	4	25.2 Å²	25.2	2%	0.021	12%	0.116	C	C	.	.			trans	-98.9	103.9	176.5	-49.3	178.6	0	0	0	107.6	M991 W994 V1083 F1084 R1087 M1088	M991-I996 HydrophobicContact CB-CB 4.13Å; M991-I996 HydrophobicContact CE-CG2 4.22Å; M991-I996 WeakPolarHBondContact CE-O 3.28Å; M991-I996 HydrophobicContact CG-CB 4.11Å; M991-I996 HydrophobicContact CG-CG2 4.35Å; M991-I996 PolarHBondContact O-N 3.46Å; W994-I996 VanDerWaalsContact C-N 3.32Å; W994-I996 HydrophobicContact CB-CD1 4.16Å; W994-I996 HydrophobicContact CB-CG1 4.08Å; W994-I996 PolarHBondContact O-N 3.4Å; I996-V1083 HydrophobicContact CG1-CG1 4.43Å; I996-F1084 HydrophobicContact CG2-CD1 3.65Å; I996-F1084 HydrophobicContact CG2-CE1 3.68Å; I996-R1087 HydrophobicContact CD1-CB 3.89Å; I996-M1088 HydrophobicContact CD1-CG 3.84Å; I996-M1088 HydrophobicContact CG2-CG 4.31Å; I996-M1088 HydrophobicContact CG2-SD 4Å
997	A	88.3	Confident	83.7	Confident	16 Å²	16	25.2 Å²	25.2	13%	0.132	12%	0.116	C	C	.	.			trans	-63.5	149.1	-179.2	0	0	0	0	0	112.3	D706 G708 N999 S1002	D706-A997 HydrophobicContact CB-CB 4.44Å; D706-A997 CarbonylContact O-C 3.58Å; D706-A997 WeakPolarHBondContact O-CA 3.48Å; G708-A997 WeakPolarHBondContact O-CB 3.39Å; A997-N999 PolarHBondContact O-N 2.94Å; A997-N999 PolarHBondContact O-ND2 2.95Å; A997-S1002 WeakPolarHBondContact O-CB 3.41Å; A997-S1002 PolarHBondContact O-OG 3.13Å
998	F	88.1	Confident	82.6	Confident	17 Å²	17	25 Å²	25	8%	0.075	12%	0.115	C	C	.	.	B	Isolated β-bridge	trans	-88.6	105.9	-178.1	-168.4	-103.5	0	0	0	110.7	L705 D706 L707 G708 L943 A947 M991 S1002 L1006	L705-F998 HydrophobicContact CB-CB 4.32Å; D706-F998 PolarHBondContact O-N 3.24Å; L707-F998 HydrophobicContact CD2-CB 4.29Å; L707-F998 HydrophobicContact CD2-CD1 3.73Å; L707-F998 HydrophobicContact CD2-CG 4.47Å; G708-F998 PolarHBondContact N-O 2.95Å; L943-F998 HydrophobicContact CD1-CE1 4.43Å; L943-F998 HydrophobicContact CD2-CD1 3.59Å; L943-F998 HydrophobicContact CD2-CE1 3.89Å; L943-F998 WeakPolarHBondContact CD2-O 3.39Å; L943-F998 HydrophobicContact CG-CD1 3.97Å; L943-F998 HydrophobicContact CG-CE1 3.71Å; A947-F998 HydrophobicContact CB-CE1 4.27Å; A947-F998 HydrophobicContact CB-CZ 3.75Å; M991-F998 HydrophobicContact CE-CB 4.33Å; M991-F998 HydrophobicContact CE-CD2 3.95Å; F998-S1002 WeakPolarHBondContact CA-OG 3.43Å; F998-L1006 HydrophobicContact CD2-CD1 4.2Å; F998-L1006 HydrophobicContact CE2-CD1 3.68Å
999	N	85.3	Confident	81.1	Confident	2 Å²	2	24.3 Å²	24.3	1%	0.011	11%	0.111	C	C	.	.	S	Bend	trans	-142.3	-177.9	179.9	56.3	60.1	0	0	0	111.7	G708 L709 Y940 A997 V1001 S1002 L1003 F1084	G708-N999 WeakPolarHBondContact O-CB 3.38Å; G708-N999 PolarHBondContact O-ND2 3.36Å; L709-N999 HydrophobicContact CB-CB 4.13Å; Y940-N999 HydrophobicContact CE1-CB 3.77Å; A997-N999 PolarHBondContact O-N 2.94Å; A997-N999 PolarHBondContact O-ND2 2.95Å; N999-V1001 VanDerWaalsContact C-N 3.28Å; N999-V1001 PolarHBondContact O-N 3.49Å; N999-V1001 WeakPolarHBondContact OD1-CA 3.48Å; N999-V1001 WeakPolarHBondContact OD1-CB 3.32Å; N999-V1001 PolarHBondContact OD1-N 3.38Å; N999-S1002 PolarHBondContact N-OG 3.45Å; N999-S1002 PolarHBondContact O-N 3.46Å; N999-S1002 PolarHBondContact O-OG 3.16Å; N999-S1002 PolarHBondContact OD1-N 2.83Å; N999-L1003 WeakPolarHBondContact O-CB 3.35Å; N999-L1003 PolarHBondContact O-N 2.96Å; N999-F1084 VanDerWaalsContact ND2-CE1 3.28Å; N999-F1084 WeakPolarHBondContact ND2-CE1 3.42Å; N999-F1084 WeakPolarHBondContact ND2-CZ 3.38Å
1000	A	78.9	Confident	79.4	Confident	1 Å²	1	24.3 Å²	24.3	1%	0.008	11%	0.111	C	C	.	.	H	α-helix	trans	-59.7	-29.9	-179.5	0	0	0	0	0	114.5	W230 M606 V609 V1004	W230-A1000 HydrophobicContact CE3-CB 4.11Å; W230-A1000 HydrophobicContact CZ3-CB 3.74Å; M606-A1000 HydrophobicContact SD-CB 4.07Å; V609-A1000 HydrophobicContact CG2-CB 4.47Å; A1000-V1004 VanDerWaalsContact O-CG2 3.25Å; A1000-V1004 WeakPolarHBondContact O-CG2 3.24Å; A1000-V1004 PolarHBondContact O-N 2.83Å
1001	V	79.5	Confident	77.4	Confident	10 Å²	10	23.7 Å²	23.7	6%	0.061	11%	0.108	C	C	.	.	H	α-helix	trans	-78	-44.9	176.9	-176.1	0	0	0	0	111	W230 N999 L1003 V1004 N1005 F1084 Y1085	W230-V1001 HydrophobicContact CH2-CG2 3.65Å; W230-V1001 HydrophobicContact CZ2-CG2 4.49Å; W230-V1001 HydrophobicContact CZ3-CG2 4.3Å; N999-V1001 VanDerWaalsContact C-N 3.28Å; N999-V1001 PolarHBondContact O-N 3.49Å; N999-V1001 WeakPolarHBondContact OD1-CA 3.48Å; N999-V1001 WeakPolarHBondContact OD1-CB 3.32Å; N999-V1001 PolarHBondContact OD1-N 3.38Å; V1001-L1003 PolarHBondContact O-N 3.26Å; V1001-V1004 WeakPolarHBondContact O-CA 3.34Å; V1001-V1004 WeakPolarHBondContact O-CB 3.38Å; V1001-V1004 PolarHBondContact O-N 3.34Å; V1001-V1004 VanDerWaalsContact O-N 3.16Å; V1001-N1005 PolarHBondContact O-N 2.95Å; V1001-F1084 HydrophobicContact CG1-CB 3.94Å; V1001-F1084 HydrophobicContact CG1-CG 4.37Å; V1001-Y1085 HydrophobicContact CG1-CE1 4.35Å
1002	S	82.8	Confident	75.1	Confident	0 Å²	0	23.5 Å²	23.5	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-64.3	-33	172.7	71.5	0	0	0	0	111.5	A997 F998 N999 N1005 L1006 M1088	A997-S1002 WeakPolarHBondContact O-CB 3.41Å; A997-S1002 PolarHBondContact O-OG 3.13Å; F998-S1002 WeakPolarHBondContact CA-OG 3.43Å; N999-S1002 PolarHBondContact N-OG 3.45Å; N999-S1002 PolarHBondContact O-N 3.46Å; N999-S1002 PolarHBondContact O-OG 3.16Å; N999-S1002 PolarHBondContact OD1-N 2.83Å; S1002-N1005 PolarHBondContact O-N 3.35Å; S1002-L1006 PolarHBondContact O-N 2.99Å; S1002-M1088 WeakPolarHBondContact O-CE 3.37Å
1003	L	77.4	Confident	72.8	Confident	1 Å²	1	20.2 Å²	20.2	1%	0.005	9%	0.093	C	C	.	.	H	α-helix	trans	-59.7	-57.7	169.9	-177.3	57	0	0	0	107.9	M606 L943 A947 N999 V1001 N1005 L1006 V1007	M606-L1003 HydrophobicContact SD-CD2 4.4Å; L943-L1003 HydrophobicContact CD1-CB 4.46Å; L943-L1003 HydrophobicContact CD1-CD2 3.61Å; A947-L1003 HydrophobicContact CB-CD1 3.69Å; A947-L1003 HydrophobicContact CB-CD2 4.31Å; N999-L1003 WeakPolarHBondContact O-CB 3.35Å; N999-L1003 PolarHBondContact O-N 2.96Å; V1001-L1003 PolarHBondContact O-N 3.26Å; L1003-N1005 PolarHBondContact O-N 2.98Å; L1003-L1006 CarbonylContact O-C 3.56Å; L1003-L1006 PolarHBondContact O-N 3.23Å; L1003-V1007 VanDerWaalsContact C-CG2 3.4Å; L1003-V1007 HydrophobicContact CD1-CG2 3.84Å; L1003-V1007 HydrophobicContact CG-CG2 3.75Å; L1003-V1007 WeakPolarHBondContact O-CA 3.18Å; L1003-V1007 WeakPolarHBondContact O-CB 3.5Å; L1003-V1007 WeakPolarHBondContact O-CG2 3.46Å; L1003-V1007 PolarHBondContact O-N 3.12Å
1004	V	72.5	Confident	70.2	Confident	6 Å²	6	14.2 Å²	14.2	4%	0.036	7%	0.07	C	C	.	.	H	α-helix	trans	-46.2	-31.2	173.8	166	0	0	0	0	114.1	V609 F612 A1000 V1001 V1007 M1008	V609-V1004 HydrophobicContact CB-CG2 4.22Å; V609-V1004 HydrophobicContact CG1-CG2 3.82Å; V609-V1004 HydrophobicContact CG2-CG2 3.8Å; F612-V1004 HydrophobicContact CD1-CG1 4.07Å; F612-V1004 HydrophobicContact CD1-CG2 4.43Å; F612-V1004 HydrophobicContact CE1-CG1 3.89Å; F612-V1004 HydrophobicContact CZ-CG1 4.24Å; A1000-V1004 VanDerWaalsContact O-CG2 3.25Å; A1000-V1004 WeakPolarHBondContact O-CG2 3.24Å; A1000-V1004 PolarHBondContact O-N 2.83Å; V1001-V1004 WeakPolarHBondContact O-CA 3.34Å; V1001-V1004 WeakPolarHBondContact O-CB 3.38Å; V1001-V1004 PolarHBondContact O-N 3.34Å; V1001-V1004 VanDerWaalsContact O-N 3.16Å; V1004-V1007 VanDerWaalsContact O-CB 3.27Å; V1004-V1007 WeakPolarHBondContact O-CB 3.21Å; V1004-V1007 WeakPolarHBondContact O-CG1 3.28Å; V1004-M1008 PolarHBondContact O-N 2.67Å
1005	N	77.9	Confident	67.5	Low	0 Å²	0	12.7 Å²	12.7	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-88.9	-34.9	178.9	-66.2	-16	0	0	0	114	V1001 S1002 L1003 V1007 F1084 Y1085 M1088 I1092	V1001-N1005 PolarHBondContact O-N 2.95Å; S1002-N1005 PolarHBondContact O-N 3.35Å; L1003-N1005 PolarHBondContact O-N 2.98Å; N1005-V1007 PolarHBondContact O-N 3.09Å; N1005-F1084 PolarHBondContact ND2-O 2.9Å; N1005-Y1085 WeakPolarHBondContact ND2-CD1 3.29Å; N1005-M1088 HydrophobicContact CB-CB 4.16Å; N1005-M1088 HydrophobicContact CB-CE 3.68Å; N1005-M1088 HydrophobicContact CB-SD 3.65Å; N1005-I1092 WeakPolarHBondContact O-CD1 3.28Å
1006	L	72.6	Confident	64.9	Low	2 Å²	2	14.1 Å²	14.1	1%	0.01	7%	0.073	C	C	.	.	H	α-helix	trans	-65.7	-30.1	163.2	-70.1	170.9	0	0	0	111.5	L984 L987 M988 M991 F998 S1002 L1003 V1009 L1010 M1088	L984-L1006 HydrophobicContact CD2-CD2 4.11Å; L987-L1006 HydrophobicContact CB-CD2 3.93Å; M988-L1006 HydrophobicContact CG-CD1 4.2Å; M988-L1006 HydrophobicContact CG-CD2 4.22Å; M991-L1006 HydrophobicContact SD-CD1 3.68Å; M991-L1006 HydrophobicContact SD-CD2 4.05Å; M991-L1006 HydrophobicContact SD-CG 3.91Å; F998-L1006 HydrophobicContact CD2-CD1 4.2Å; F998-L1006 HydrophobicContact CE2-CD1 3.68Å; S1002-L1006 PolarHBondContact O-N 2.99Å; L1003-L1006 CarbonylContact O-C 3.56Å; L1003-L1006 PolarHBondContact O-N 3.23Å; L1006-V1009 WeakPolarHBondContact O-CB 3.39Å; L1006-V1009 PolarHBondContact O-N 2.93Å; L1006-L1010 PolarHBondContact O-N 2.84Å; L1006-M1088 HydrophobicContact CD2-CE 4.41Å; L1006-M1088 HydrophobicContact CG-CE 4.05Å
1007	V	62.3	Low	62.1	Low	0 Å²	0	17.7 Å²	17.7	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-66.2	-45.2	177	141.9	0	0	0	0	110.7	F612 L1003 V1004 N1005 V1009 L1010 V1011 S1012	F612-V1007 HydrophobicContact CE1-CG1 4.36Å; L1003-V1007 VanDerWaalsContact C-CG2 3.4Å; L1003-V1007 HydrophobicContact CD1-CG2 3.84Å; L1003-V1007 HydrophobicContact CG-CG2 3.75Å; L1003-V1007 WeakPolarHBondContact O-CA 3.18Å; L1003-V1007 WeakPolarHBondContact O-CB 3.5Å; L1003-V1007 WeakPolarHBondContact O-CG2 3.46Å; L1003-V1007 PolarHBondContact O-N 3.12Å; V1004-V1007 VanDerWaalsContact O-CB 3.27Å; V1004-V1007 WeakPolarHBondContact O-CB 3.21Å; V1004-V1007 WeakPolarHBondContact O-CG1 3.28Å; N1005-V1007 PolarHBondContact O-N 3.09Å; V1007-V1009 PolarHBondContact O-N 2.7Å; V1007-V1009 VanDerWaalsContact O-N 3.11Å; V1007-L1010 CarbonylContact O-C 3.58Å; V1007-L1010 PolarHBondContact O-N 2.85Å; V1007-V1011 CarbonylContact C-O 3.49Å; V1007-V1011 WeakPolarHBondContact CA-O 3.44Å; V1007-V1011 WeakPolarHBondContact CB-O 2.99Å; V1007-V1011 WeakPolarHBondContact CG1-O 3.34Å; V1007-V1011 WeakPolarHBondContact CG2-O 3.42Å; V1007-V1011 CarbonylContact O-C 3.52Å; V1007-V1011 PolarHBondContact O-N 2.94Å; V1007-S1012 WeakPolarHBondContact CG1-OG 3.48Å
1008	M	64	Low	59.6	Low	3 Å²	3	23.7 Å²	23.7	2%	0.015	12%	0.121	C	C	.	.	H	α-helix	trans	-56.1	-27.3	173	-164.8	-165.7	-151.3	0	0	112.6	F544 L545 V1004 I1023 Y1089	F544-M1008 HydrophobicContact CD1-CE 4.06Å; F544-M1008 HydrophobicContact CE1-CE 4.35Å; L545-M1008 HydrophobicContact CB-CE 3.76Å; L545-M1008 HydrophobicContact CD1-CE 3.97Å; L545-M1008 HydrophobicContact CD1-CG 3.98Å; L545-M1008 HydrophobicContact CG-CE 3.74Å; L545-M1008 HydrophobicContact CG-CG 4.42Å; V1004-M1008 PolarHBondContact O-N 2.67Å; M1008-I1023 HydrophobicContact CE-CD1 3.83Å; M1008-I1023 HydrophobicContact CG-CD1 3.99Å; M1008-I1023 PolarHBondContact O-N 2.66Å; M1008-I1023 HydrophobicContact SD-CD1 3.98Å; M1008-Y1089 HydrophobicContact CE-CE1 4.23Å; M1008-Y1089 HydrophobicContact SD-CD1 4.06Å; M1008-Y1089 HydrophobicContact SD-CE1 3.52Å; M1008-Y1089 VanDerWaalsContact SD-CE1 3.52Å
1009	V	55.1	Low	56.8	Low	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-83.7	-35.6	173.9	-177.1	0	0	0	0	112.3	I983 L984 L987 L1006 V1007 V1021 I1092	I983-V1009 HydrophobicContact CG2-CG1 4.12Å; L984-V1009 HydrophobicContact CD2-CG1 4.36Å; L987-V1009 HydrophobicContact CD1-CB 4.23Å; L987-V1009 HydrophobicContact CD1-CG1 3.88Å; L987-V1009 HydrophobicContact CD1-CG2 3.67Å; L1006-V1009 WeakPolarHBondContact O-CB 3.39Å; L1006-V1009 PolarHBondContact O-N 2.93Å; V1007-V1009 PolarHBondContact O-N 2.7Å; V1007-V1009 VanDerWaalsContact O-N 3.11Å; V1009-V1021 VanDerWaalsContact O-CG1 3.27Å; V1009-V1021 WeakPolarHBondContact O-CG1 3.42Å; V1009-I1092 HydrophobicContact CG2-CB 4.18Å; V1009-I1092 HydrophobicContact CG2-CD1 3.52Å; V1009-I1092 HydrophobicContact CG2-CG1 3.43Å; V1009-I1092 VanDerWaalsContact CG2-CG1 3.43Å; V1009-I1092 HydrophobicContact CG2-CG2 3.74Å
1010	L	54	Low	54.5	Low	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.125	C	C	.	.	S	Bend	trans	-126.8	-62.6	-170.3	-152	82.7	0	0	0	117	C597 L951 S954 L955 I980 L984 L1006 V1007 V1021	C597-L1010 PolarHBondContact SG-O 2.97Å; L951-L1010 HydrophobicContact CB-CD2 4Å; L951-L1010 HydrophobicContact CD2-CB 4.15Å; L951-L1010 HydrophobicContact CD2-CD2 3.83Å; L951-L1010 WeakPolarHBondContact O-CD2 3.47Å; S954-L1010 WeakPolarHBondContact CB-O 3.39Å; S954-L1010 VanDerWaalsContact OG-CD2 3.29Å; S954-L1010 WeakPolarHBondContact OG-CD2 3.49Å; L955-L1010 HydrophobicContact CD1-CD2 4.17Å; L955-L1010 HydrophobicContact CD2-CD1 3.66Å; L955-L1010 HydrophobicContact CD2-CD2 4.1Å; L955-L1010 HydrophobicContact CD2-CG 4.41Å; L955-L1010 HydrophobicContact CG-CD1 4.2Å; L955-L1010 HydrophobicContact CG-CD2 3.69Å; L955-L1010 HydrophobicContact CG-CG 4.44Å; I980-L1010 HydrophobicContact CG2-CD1 3.23Å; L984-L1010 HydrophobicContact CD1-CB 3.82Å; L984-L1010 HydrophobicContact CD1-CD1 3.8Å; L984-L1010 HydrophobicContact CD1-CD2 3.24Å; L984-L1010 HydrophobicContact CD1-CG 3.76Å; L984-L1010 HydrophobicContact CD2-CB 4.2Å; L984-L1010 HydrophobicContact CG-CB 4.17Å; L984-L1010 HydrophobicContact CG-CD1 4.15Å; L984-L1010 HydrophobicContact CG-CD2 4.37Å; L984-L1010 HydrophobicContact CG-CG 4.43Å; L1006-L1010 PolarHBondContact O-N 2.84Å; V1007-L1010 CarbonylContact O-C 3.58Å; V1007-L1010 PolarHBondContact O-N 2.85Å; L1010-V1021 HydrophobicContact CD1-CG1 4.12Å; L1010-V1021 HydrophobicContact CD1-CG2 4.05Å; L1010-V1021 HydrophobicContact CG-CG2 4.09Å; L1010-V1021 VanDerWaalsContact O-CA 3.25Å; L1010-V1021 WeakPolarHBondContact O-CA 3.47Å; L1010-V1021 WeakPolarHBondContact O-CB 3.49Å; L1010-V1021 WeakPolarHBondContact O-CG1 3.48Å; L1010-V1021 WeakPolarHBondContact O-CG2 3.34Å
1011	V	47.7	Very low	52.5	Low	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.124	C	C	.	.			trans	-145.9	144.4	-167.1	-142.5	0	0	0	0	105.3	C597 L600 Q950 L951 S954 V1007	C597-V1011 WeakPolarHBondContact SG-CA 3.42Å; L600-V1011 HydrophobicContact CD1-CG1 4.33Å; Q950-V1011 VanDerWaalsContact C-CG2 3.44Å; Q950-V1011 HydrophobicContact CB-CB 4.1Å; Q950-V1011 HydrophobicContact CB-CG1 4.14Å; Q950-V1011 HydrophobicContact CB-CG2 3.95Å; Q950-V1011 WeakPolarHBondContact O-CG1 3.29Å; Q950-V1011 VanDerWaalsContact O-CG2 3.31Å; Q950-V1011 WeakPolarHBondContact O-CG2 3.24Å; L951-V1011 HydrophobicContact CB-CG2 4.49Å; L951-V1011 HydrophobicContact CD2-CG2 3.78Å; L951-V1011 HydrophobicContact CG-CG2 4.36Å; S954-V1011 WeakPolarHBondContact OG-CG1 3.38Å; S954-V1011 WeakPolarHBondContact OG-CG2 3.42Å; V1007-V1011 CarbonylContact C-O 3.49Å; V1007-V1011 WeakPolarHBondContact CA-O 3.44Å; V1007-V1011 WeakPolarHBondContact CB-O 2.99Å; V1007-V1011 WeakPolarHBondContact CG1-O 3.34Å; V1007-V1011 WeakPolarHBondContact CG2-O 3.42Å; V1007-V1011 CarbonylContact O-C 3.52Å; V1007-V1011 PolarHBondContact O-N 2.94Å
1012	S	42.8	Very low	51.3	Low	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.122	C	C	.	.			trans	-87.8	138.4	140	-76.5	0	0	0	0	110.8	C597 F598 L600 G601 S613 V1007 G1014	C597-S1012 PolarHBondContact O-N 2.99Å; F598-S1012 WeakPolarHBondContact CD1-OG 3.21Å; L600-S1012 CarbonylContact C-O 3.54Å; G601-S1012 WeakPolarHBondContact CA-O 3.46Å; G601-S1012 PolarHBondContact N-O 2.73Å; S613-S1012 VanDerWaalsContact CB-CB 3.47Å; S613-S1012 WeakPolarHBondContact CB-OG 3.49Å; S613-S1012 WeakPolarHBondContact OG-CB 3.35Å; S613-S1012 PolarHBondContact OG-OG 2.63Å; V1007-S1012 WeakPolarHBondContact CG1-OG 3.48Å; S1012-G1014 PolarHBondContact O-N 3.39Å; S1012-G1014 VanDerWaalsContact O-N 3.12Å
1013	A	40.6	Very low	50.5	Low	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.125	C	C	.	.	S	Bend		42.9	52.2	126.2	0	0	0	0	0	121.7	L600 G601 L603 S604 V609 Q950	L600-A1013 CarbonylContact O-C 3.53Å; G601-A1013 CarbonylContact C-O 3.52Å; G601-A1013 VanDerWaalsContact C-O 3.31Å; G601-A1013 WeakPolarHBondContact CA-O 3.43Å; G601-A1013 WeakPolarHBondContact O-CB 3.5Å; L603-A1013 CarbonylContact C-O 3.39Å; L603-A1013 WeakPolarHBondContact CA-O 3.3Å; L603-A1013 WeakPolarHBondContact CB-O 3.39Å; L603-A1013 PolarHBondContact N-O 3.2Å; S604-A1013 VanDerWaalsContact CB-CB 3.45Å; S604-A1013 WeakPolarHBondContact CB-O 3.35Å; S604-A1013 PolarHBondContact N-O 3.11Å; S604-A1013 VanDerWaalsContact OG-CB 3.24Å; S604-A1013 WeakPolarHBondContact OG-CB 3.1Å; V609-A1013 HydrophobicContact CB-CB 4.07Å; V609-A1013 HydrophobicContact CG1-CB 3.43Å; V609-A1013 VanDerWaalsContact CG1-CB 3.43Å; Q950-A1013 VanDerWaalsContact CD-CA 3.41Å
1014	G	37.2	Very low	50.4	Low	1 Å²	1	24.3 Å²	24.3	1%	0.01	13%	0.125	C	C	.	.				81.4	106.6	99.5	0	0	0	0	0	122.7	L600 L603 S604 S1012	L600-G1014 PolarHBondContact O-N 2.94Å; L603-G1014 CarbonylContact C-O 3.55Å; L603-G1014 VanDerWaalsContact CB-C 3.44Å; L603-G1014 WeakPolarHBondContact CB-O 3.18Å; S604-G1014 WeakPolarHBondContact CA-O 3.49Å; S604-G1014 PolarHBondContact N-O 2.99Å; S1012-G1014 PolarHBondContact O-N 3.39Å; S1012-G1014 VanDerWaalsContact O-N 3.12Å
1015	T	33.4	Very low	50.6	Low	71 Å²	71	24 Å²	24	44%	0.436	12%	0.123	S	C	.	.	S	Bend	trans	98.6	121.7	158.1	-40.9	0	0	0	0	116.9	L603	L603-T1015 VanDerWaalsContact CB-O 3.31Å; L603-T1015 WeakPolarHBondContact CB-O 3.38Å; L603-T1015 WeakPolarHBondContact CD1-O 3.42Å
1016	F	34.6	Very low	50.7	Low	163 Å²	163	24.4 Å²	24.4	72%	0.715	13%	0.125	S	C	*	.	S	Bend	trans	80.2	153.2	-157.4	-71.4	-88.2	0	0	0	113	L600 L603	L600-F1016 WeakPolarHBondContact CD2-O 3.39Å; L603-F1016 VanDerWaalsContact CD1-O 3.32Å; L603-F1016 WeakPolarHBondContact CD1-O 3.39Å
1017	P	29.7	Very low	51.2	Low	78 Å²	78	24.3 Å²	24.3	51%	0.506	12%	0.124	S	C	.	.	S	Bend	trans	-82.4	175.5	-164.6	32.1	-35.5	0	0	0	114
1018	H	35.5	Very low	52.3	Low	143 Å²	143	24.3 Å²	24.3	66%	0.662	12%	0.124	S	C	*	.			trans	106	62.6	167.1	-52	-62.4	0	0	0	119.2
1019	L	28.6	Very low	53.3	Low	30 Å²	30	24.2 Å²	24.2	16%	0.157	12%	0.124	C	C	.	.			trans	72.6	155.3	145.9	-45.2	173.8	0	0	0	118.4	F596 L600 A957 I960 V961	F596-L1019 VanDerWaalsContact C-C 3.49Å; F596-L1019 CarbonylContact C-O 3.6Å; F596-L1019 HydrophobicContact CB-CB 3.53Å; F596-L1019 HydrophobicContact CD2-CB 4.11Å; F596-L1019 HydrophobicContact CD2-CD1 3.84Å; F596-L1019 HydrophobicContact CE2-CD1 4.08Å; F596-L1019 HydrophobicContact CG-CB 3.9Å; F596-L1019 HydrophobicContact CG-CD1 4.28Å; F596-L1019 CarbonylContact O-C 3.3Å; L600-L1019 WeakPolarHBondContact CB-O 3.28Å; L600-L1019 VanDerWaalsContact CD1-C 3.47Å; L600-L1019 WeakPolarHBondContact CD1-O 3.44Å; L600-L1019 WeakPolarHBondContact CG-O 3.49Å; L600-L1019 PolarHBondContact N-O 2.92Å; A957-L1019 VanDerWaalsContact CB-CA 3.44Å; A957-L1019 HydrophobicContact CB-CB 4.01Å; A957-L1019 HydrophobicContact CB-CD2 3.42Å; A957-L1019 VanDerWaalsContact CB-CD2 3.42Å; A957-L1019 HydrophobicContact CB-CG 4.29Å; I960-L1019 HydrophobicContact CB-CD2 3.78Å; I960-L1019 HydrophobicContact CD1-CD2 3.89Å; I960-L1019 HydrophobicContact CG1-CD2 4.44Å; I960-L1019 HydrophobicContact CG2-CD2 3.87Å; V961-L1019 HydrophobicContact CG2-CB 4.37Å; V961-L1019 HydrophobicContact CG2-CD1 3.8Å; V961-L1019 HydrophobicContact CG2-CD2 4.29Å; V961-L1019 HydrophobicContact CG2-CG 4.37Å
1020	A	37.2	Very low	54.6	Low	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.127	C	C	.	.			cis	-147	-120.7	-17.1	0	0	0	0	0	112.9	S593 F596 C597 S954 A957 V961	S593-A1020 CarbonylContact O-C 3.52Å; S593-A1020 WeakPolarHBondContact O-CB 3.42Å; F596-A1020 VanDerWaalsContact C-N 3.3Å; F596-A1020 HydrophobicContact CB-CB 4.25Å; C597-A1020 VanDerWaalsContact CA-C 3.46Å; C597-A1020 VanDerWaalsContact CA-N 3.27Å; S954-A1020 WeakPolarHBondContact CA-O 3.48Å; S954-A1020 VanDerWaalsContact CB-O 3.22Å; S954-A1020 WeakPolarHBondContact CB-O 3.47Å; A957-A1020 HydrophobicContact CB-CB 3.82Å; V961-A1020 HydrophobicContact CG2-CB 4.01Å
1021	V	37.3	Very low	56.3	Low	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.127	C	C	.	.			trans	-154.7	148.7	-175.5	179.3	0	0	0	0	109.2	S593 E594 C597 S954 I958 I980 V1009 L1010 V1025	S593-V1021 CarbonylContact C-O 3.55Å; S593-V1021 WeakPolarHBondContact CB-O 3.43Å; S593-V1021 CarbonylContact O-C 3.6Å; S593-V1021 PolarHBondContact O-N 3.15Å; E594-V1021 WeakPolarHBondContact CA-O 3.41Å; E594-V1021 PolarHBondContact N-O 3.16Å; E594-V1021 VanDerWaalsContact N-O 3.11Å; C597-V1021 VanDerWaalsContact SG-CA 3.6Å; S954-V1021 WeakPolarHBondContact O-CG2 3.31Å; I958-V1021 HydrophobicContact CD1-CB 3.77Å; I958-V1021 HydrophobicContact CD1-CG1 4.06Å; I958-V1021 HydrophobicContact CD1-CG2 3.45Å; I958-V1021 VanDerWaalsContact CD1-CG2 3.45Å; I958-V1021 HydrophobicContact CG1-CB 3.38Å; I958-V1021 HydrophobicContact CG1-CG1 4.18Å; I958-V1021 HydrophobicContact CG1-CG2 3.25Å; I980-V1021 HydrophobicContact CG2-CG1 4.48Å; V1009-V1021 VanDerWaalsContact O-CG1 3.27Å; V1009-V1021 WeakPolarHBondContact O-CG1 3.42Å; L1010-V1021 HydrophobicContact CD1-CG1 4.12Å; L1010-V1021 HydrophobicContact CD1-CG2 4.05Å; L1010-V1021 HydrophobicContact CG-CG2 4.09Å; L1010-V1021 VanDerWaalsContact O-CA 3.25Å; L1010-V1021 WeakPolarHBondContact O-CA 3.47Å; L1010-V1021 WeakPolarHBondContact O-CB 3.49Å; L1010-V1021 WeakPolarHBondContact O-CG1 3.48Å; L1010-V1021 WeakPolarHBondContact O-CG2 3.34Å; V1021-V1025 HydrophobicContact CB-CG2 3.85Å; V1021-V1025 HydrophobicContact CG1-CG2 3.68Å
1022	G	54.5	Low	58.3	Low	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.127	C	C	.	.			cis	119.1	144.7	17.7	0	0	0	0	0	110.1	S1024 V1025	G1022-S1024 PolarHBondContact O-N 3.02Å; G1022-V1025 WeakPolarHBondContact O-CB 3.16Å; G1022-V1025 WeakPolarHBondContact O-CG2 3.45Å; G1022-V1025 PolarHBondContact O-N 3.21Å
1023	I	66.3	Low	60.3	Low	13 Å²	13	26.2 Å²	26.2	7%	0.067	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50	-29.5	-157.1	-75.9	-179.9	0	0	0	116.2	A548 E594 M1008 V1025 E1026 F1027 I1092	A548-I1023 HydrophobicContact CB-CD1 4.11Å; E594-I1023 VanDerWaalsContact OE1-CA 3.27Å; E594-I1023 WeakPolarHBondContact OE1-CA 3.43Å; E594-I1023 PolarHBondContact OE1-N 2.95Å; M1008-I1023 HydrophobicContact CE-CD1 3.83Å; M1008-I1023 HydrophobicContact CG-CD1 3.99Å; M1008-I1023 PolarHBondContact O-N 2.66Å; M1008-I1023 HydrophobicContact SD-CD1 3.98Å; I1023-V1025 PolarHBondContact O-N 3.29Å; I1023-E1026 PolarHBondContact O-N 2.92Å; I1023-F1027 HydrophobicContact CG2-CE2 4.25Å; I1023-I1092 HydrophobicContact CG2-CG2 4.41Å
1024	S	75.2	Confident	62.5	Low	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-68.5	-12	176.6	-68.8	0	0	0	0	114.3	G1022 C1028	G1022-S1024 PolarHBondContact O-N 3.02Å; S1024-C1028 PolarHBondContact O-N 3.12Å; S1024-C1028 PolarHBondContact O-SG 3.18Å
1025	V	77.2	Confident	65	Low	1 Å²	1	26.9 Å²	26.9	1%	0.006	14%	0.137	C	C	.	.	H	α-helix	trans	-65.2	-44.5	172.1	169	0	0	0	0	111	I958 I980 V1021 G1022 I1023 F1027 C1028 A1029	I958-V1025 HydrophobicContact CD1-CG2 4.14Å; I958-V1025 HydrophobicContact CG1-CG2 3.92Å; I958-V1025 HydrophobicContact CG2-CG2 4.42Å; I980-V1025 HydrophobicContact CD1-CG2 3.74Å; V1021-V1025 HydrophobicContact CB-CG2 3.85Å; V1021-V1025 HydrophobicContact CG1-CG2 3.68Å; G1022-V1025 WeakPolarHBondContact O-CB 3.16Å; G1022-V1025 WeakPolarHBondContact O-CG2 3.45Å; G1022-V1025 PolarHBondContact O-N 3.21Å; I1023-V1025 PolarHBondContact O-N 3.29Å; V1025-F1027 PolarHBondContact O-N 2.93Å; V1025-C1028 PolarHBondContact O-N 3.38Å; V1025-A1029 HydrophobicContact CG1-CB 3.96Å; V1025-A1029 WeakPolarHBondContact O-CB 3.4Å; V1025-A1029 PolarHBondContact O-N 3.39Å
1026	E	78.9	Confident	67.5	Low	7 Å²	7	24.6 Å²	24.6	3%	0.033	13%	0.126	C	C	.	.	H	α-helix	trans	-59	-48.3	-179.3	-62.4	-66.7	-163	0	0	111.5	S590 I1023 C1028 H1030 I1062	S590-E1026 WeakPolarHBondContact CB-OE1 3.19Å; S590-E1026 WeakPolarHBondContact CB-OE2 3.21Å; S590-E1026 VanDerWaalsContact OG-CD 3.25Å; S590-E1026 PolarHBondContact OG-OE1 2.93Å; S590-E1026 PolarHBondContact OG-OE2 3.41Å; I1023-E1026 PolarHBondContact O-N 2.92Å; E1026-C1028 PolarHBondContact O-N 2.98Å; E1026-C1028 VanDerWaalsContact O-N 3.14Å; E1026-H1030 PolarHBondContact O-CD2 2.78Å; E1026-H1030 IonicContact OE2-CD2 3.38Å; E1026-H1030 IonicContact OE2-NE2 2.73Å; E1026-H1030 PolarHBondContact OE2-NE2 3.24Å; E1026-I1062 HydrophobicContact CB-CD1 3.52Å
1027	F	82.2	Confident	69.7	Low	0 Å²	0	19.4 Å²	19.4	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-55.1	-32.5	174.2	-74.1	-73.8	0	0	0	114.1	I1023 V1025 V1058 I1062 T1063 A1097	I1023-F1027 HydrophobicContact CG2-CE2 4.25Å; V1025-F1027 PolarHBondContact O-N 2.93Å; F1027-V1058 HydrophobicContact CD1-CG1 3.58Å; F1027-V1058 HydrophobicContact CE1-CG1 4.07Å; F1027-V1058 HydrophobicContact CG-CG1 4.46Å; F1027-I1062 HydrophobicContact CD1-CD1 4Å; F1027-I1062 HydrophobicContact CD2-CD1 4.1Å; F1027-I1062 HydrophobicContact CE1-CB 4.19Å; F1027-I1062 HydrophobicContact CE1-CD1 4.05Å; F1027-I1062 HydrophobicContact CE1-CG2 4.3Å; F1027-I1062 HydrophobicContact CE2-CB 4.49Å; F1027-I1062 HydrophobicContact CE2-CD1 4.17Å; F1027-I1062 HydrophobicContact CE2-CG2 3.76Å; F1027-I1062 HydrophobicContact CG-CD1 4.03Å; F1027-I1062 HydrophobicContact CZ-CB 3.95Å; F1027-I1062 HydrophobicContact CZ-CD1 4.15Å; F1027-I1062 HydrophobicContact CZ-CG2 3.56Å; F1027-T1063 WeakPolarHBondContact CE1-OG1 3.41Å; F1027-A1097 HydrophobicContact CD1-CB 4.44Å; F1027-A1097 VanDerWaalsContact CE1-CA 3.46Å; F1027-A1097 HydrophobicContact CE1-CB 3.71Å; F1027-A1097 HydrophobicContact CZ-CB 4.17Å
1028	C	86.4	Confident	72.3	Confident	0 Å²	0	16.2 Å²	16.2	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-100	-36.7	-173.1	-62.5	0	0	0	0	113.9	I976 I980 S1024 V1025 E1026 T1032 L1104	I976-C1028 HydrophobicContact CG1-CB 4.5Å; I976-C1028 HydrophobicContact CG2-CB 4.19Å; I980-C1028 HydrophobicContact CD1-CB 4.36Å; S1024-C1028 PolarHBondContact O-N 3.12Å; S1024-C1028 PolarHBondContact O-SG 3.18Å; V1025-C1028 PolarHBondContact O-N 3.38Å; E1026-C1028 PolarHBondContact O-N 2.98Å; E1026-C1028 VanDerWaalsContact O-N 3.14Å; C1028-T1032 VanDerWaalsContact O-CB 3.23Å; C1028-T1032 WeakPolarHBondContact O-CB 3.01Å; C1028-T1032 PolarHBondContact O-N 3.23Å; C1028-T1032 PolarHBondContact O-OG1 2.6Å; C1028-L1104 HydrophobicContact CB-CD2 4.2Å
1029	A	84.1	Confident	74.5	Confident	2 Å²	2	11.6 Å²	11.6	2%	0.017	7%	0.071	C	C	.	.	H	α-helix	trans	-74.1	-45.2	-169.3	0	0	0	0	0	111.8	L589 V1025 I1031 T1032 R1033	L589-A1029 HydrophobicContact CD2-CB 4.17Å; V1025-A1029 HydrophobicContact CG1-CB 3.96Å; V1025-A1029 WeakPolarHBondContact O-CB 3.4Å; V1025-A1029 PolarHBondContact O-N 3.39Å; A1029-I1031 PolarHBondContact O-N 3.4Å; A1029-T1032 PolarHBondContact O-N 3.33Å; A1029-R1033 VanDerWaalsContact O-CB 3.23Å; A1029-R1033 WeakPolarHBondContact O-CB 3.21Å; A1029-R1033 PolarHBondContact O-N 3.29Å
1030	H	84.1	Confident	77.2	Confident	11 Å²	11	12 Å²	12	5%	0.051	8%	0.076	C	C	.	.	H	α-helix	trans	-61.9	-46	179.1	-58.4	-54.7	0	0	0	111.8	D552 I556 T586 E1026 R1033 A1034 V1054 V1058	D552-H1030 IonicContact OD2-CD2 2.96Å; I556-H1030 VanDerWaalsContact CD1-CD2 3.42Å; I556-H1030 WeakPolarHBondContact CD1-CD2 3.49Å; T586-H1030 WeakPolarHBondContact CB-CE1 3.39Å; T586-H1030 WeakPolarHBondContact CG2-CE1 3.2Å; T586-H1030 WeakPolarHBondContact CG2-ND1 3.5Å; E1026-H1030 PolarHBondContact O-CD2 2.78Å; E1026-H1030 IonicContact OE2-CD2 3.38Å; E1026-H1030 IonicContact OE2-NE2 2.73Å; E1026-H1030 PolarHBondContact OE2-NE2 3.24Å; H1030-R1033 PolarHBondContact O-N 2.63Å; H1030-A1034 WeakPolarHBondContact O-CB 3.49Å; H1030-A1034 PolarHBondContact O-N 2.88Å; H1030-V1054 HydrophobicContact CB-CG1 3.54Å; H1030-V1058 HydrophobicContact CB-CG2 4.35Å
1031	I	88.8	Confident	79.1	Confident	1 Å²	1	17 Å²	17	1%	0.005	11%	0.108	C	C	.	.	H	α-helix	trans	-68.2	-42.2	-179.4	-63.7	175	0	0	0	110.8	A1029 A1034 F1035 V1054 G1100 L1101 L1104 L1108	A1029-I1031 PolarHBondContact O-N 3.4Å; I1031-A1034 PolarHBondContact O-N 3.23Å; I1031-F1035 PolarHBondContact O-N 3.24Å; I1031-V1054 HydrophobicContact CG1-CG1 3.89Å; I1031-G1100 WeakPolarHBondContact CD1-O 3.3Å; I1031-L1101 HydrophobicContact CD1-CD2 3.89Å; I1031-L1104 HydrophobicContact CB-CD2 3.95Å; I1031-L1104 HydrophobicContact CG2-CD2 3.92Å; I1031-L1104 HydrophobicContact CG2-CG 4.26Å; I1031-L1108 HydrophobicContact CG2-CD1 4.28Å
1032	T	89	Confident	81.5	Confident	0 Å²	0	20.1 Å²	20.1	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-67.9	-39.9	176.9	-54.1	0	0	0	0	111.7	M966 I976 C1028 A1029 A1034 F1035 A1036	M966-T1032 HydrophobicContact CE-CG2 4.13Å; I976-T1032 HydrophobicContact CD1-CG2 4.01Å; I976-T1032 HydrophobicContact CG1-CG2 4.03Å; C1028-T1032 VanDerWaalsContact O-CB 3.23Å; C1028-T1032 WeakPolarHBondContact O-CB 3.01Å; C1028-T1032 PolarHBondContact O-N 3.23Å; C1028-T1032 PolarHBondContact O-OG1 2.6Å; A1029-T1032 PolarHBondContact O-N 3.33Å; T1032-A1034 PolarHBondContact O-N 2.89Å; T1032-F1035 PolarHBondContact O-N 2.99Å; T1032-A1036 WeakPolarHBondContact O-CB 3.31Å; T1032-A1036 PolarHBondContact O-N 3.02Å
1033	R	86.1	Confident	83	Confident	30 Å²	30	24.7 Å²	24.7	11%	0.113	15%	0.145	C	C	.	.	H	α-helix	trans	-63.9	-41.1	175.9	-165.6	-179.4	178.2	95.1	11.8	111.4	D181 T586 L965 M966 A1029 H1030 A1036 S1037	D181-R1033 IonicContact OD1-NH2 3.36Å; D181-R1033 PolarHBondContact OD1-NH2 3.34Å; T586-R1033 WeakPolarHBondContact OG1-CD 3.05Å; T586-R1033 PolarHBondContact OG1-NE 2.88Å; L965-R1033 PolarHBondContact O-NH1 2.97Å; M966-R1033 HydrophobicContact CE-CB 3.94Å; A1029-R1033 VanDerWaalsContact O-CB 3.23Å; A1029-R1033 WeakPolarHBondContact O-CB 3.21Å; A1029-R1033 PolarHBondContact O-N 3.29Å; H1030-R1033 PolarHBondContact O-N 2.63Å; R1033-A1036 PolarHBondContact O-N 3.13Å; R1033-S1037 WeakPolarHBondContact O-CB 3.43Å; R1033-S1037 PolarHBondContact O-N 2.95Å; R1033-S1037 PolarHBondContact O-OG 2.99Å
1034	A	85.9	Confident	84.2	Confident	14 Å²	14	27.1 Å²	27.1	12%	0.116	16%	0.157	C	C	.	.	H	α-helix	trans	-64.4	-39.1	174.8	0	0	0	0	0	112.6	H1030 I1031 T1032 S1037 S1038 A1050 V1054	H1030-A1034 WeakPolarHBondContact O-CB 3.49Å; H1030-A1034 PolarHBondContact O-N 2.88Å; I1031-A1034 PolarHBondContact O-N 3.23Å; T1032-A1034 PolarHBondContact O-N 2.89Å; A1034-S1037 PolarHBondContact O-N 3.13Å; A1034-S1037 PolarHBondContact O-OG 3.25Å; A1034-S1038 VanDerWaalsContact O-CB 3.32Å; A1034-S1038 WeakPolarHBondContact O-CB 3.31Å; A1034-S1038 PolarHBondContact O-N 2.77Å; A1034-A1050 HydrophobicContact CB-CB 3.85Å; A1034-V1054 HydrophobicContact CB-CG2 3.78Å
1035	F	89.9	Confident	84.9	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-64.9	-37.9	173.5	-175	-81.8	0	0	0	112.9	I1031 T1032 R1043 R1046 A1050 L1108 P1113	I1031-F1035 PolarHBondContact O-N 3.24Å; T1032-F1035 PolarHBondContact O-N 2.99Å; F1035-R1043 WeakPolarHBondContact CE2-O 3.05Å; F1035-R1043 HydrophobicContact CZ-CB 4.22Å; F1035-R1043 HydrophobicContact CZ-CG 4.22Å; F1035-R1046 HydrophobicContact CD2-CB 3.84Å; F1035-R1046 VanDerWaalsContact CE1-NH1 3.34Å; F1035-R1046 HydrophobicContact CE2-CB 3.72Å; F1035-R1046 HydrophobicContact CG-CB 4.38Å; F1035-R1046 HydrophobicContact CZ-CB 4.14Å; F1035-R1046 PolarHBondContact O-NH1 3.29Å; F1035-R1046 VanDerWaalsContact O-NH1 3.16Å; F1035-A1050 HydrophobicContact CB-CB 4.22Å; F1035-L1108 HydrophobicContact CB-CD1 3.99Å; F1035-L1108 HydrophobicContact CD1-CD2 4.02Å; F1035-L1108 HydrophobicContact CD2-CB 3.82Å; F1035-L1108 HydrophobicContact CD2-CD1 4.09Å; F1035-L1108 HydrophobicContact CD2-CD2 4.43Å; F1035-L1108 HydrophobicContact CD2-CG 4.35Å; F1035-L1108 HydrophobicContact CE1-CD2 4.35Å; F1035-L1108 HydrophobicContact CE2-CB 3.77Å; F1035-L1108 HydrophobicContact CG-CB 4.31Å; F1035-L1108 HydrophobicContact CG-CD1 4.05Å; F1035-L1108 HydrophobicContact CG-CD2 4.08Å; F1035-L1108 HydrophobicContact CG-CG 4.39Å; F1035-L1108 HydrophobicContact CZ-CB 4.25Å; F1035-L1108 WeakPolarHBondContact CZ-O 3.31Å; F1035-P1113 HydrophobicContact CD1-CG 3.88Å; F1035-P1113 HydrophobicContact CE1-CG 3.9Å
1036	A	85.8	Confident	85.5	Confident	24 Å²	24	31.1 Å²	31.1	20%	0.198	18%	0.176	C	C	.	.	H	α-helix	trans	-78.6	-25	179.9	0	0	0	0	0	113.4	T1032 R1033	T1032-A1036 WeakPolarHBondContact O-CB 3.31Å; T1032-A1036 PolarHBondContact O-N 3.02Å; R1033-A1036 PolarHBondContact O-N 3.13Å
1037	S	80.8	Confident	86.2	Confident	54 Å²	54	30.8 Å²	30.8	38%	0.378	18%	0.175	S	C	.	.	H	α-helix	trans	-86.5	-26.4	173.7	66.9	0	0	0	0	113.6	R1033 A1034	R1033-S1037 WeakPolarHBondContact O-CB 3.43Å; R1033-S1037 PolarHBondContact O-N 2.95Å; R1033-S1037 PolarHBondContact O-OG 2.99Å; A1034-S1037 PolarHBondContact O-N 3.13Å; A1034-S1037 PolarHBondContact O-OG 3.25Å
1038	S	84.2	Confident	86.7	Confident	11 Å²	11	34.3 Å²	34.3	8%	0.077	19%	0.191	C	C	.	.			trans	-58.5	141.1	178.8	174.9	0	0	0	0	113.1	A1034 C1040 R1046 E1049	A1034-S1038 VanDerWaalsContact O-CB 3.32Å; A1034-S1038 WeakPolarHBondContact O-CB 3.31Å; A1034-S1038 PolarHBondContact O-N 2.77Å; S1038-C1040 PolarHBondContact OG-N 3.39Å; S1038-R1046 VanDerWaalsContact O-CD 3.28Å; S1038-R1046 WeakPolarHBondContact O-CD 3.32Å; S1038-R1046 VanDerWaalsContact OG-CG 3.3Å; S1038-R1046 WeakPolarHBondContact OG-CG 3.41Å; S1038-E1049 VanDerWaalsContact CB-OE2 3.27Å; S1038-E1049 WeakPolarHBondContact CB-OE2 3.49Å; S1038-E1049 PolarHBondContact OG-OE2 2.87Å
1039	V	83.1	Confident	86.9	Confident	45 Å²	45	38 Å²	38	27%	0.273	21%	0.208	S	C	.	.			trans	-110.5	13.1	-178.1	-153	0	0	0	0	111.8	L1115 I1120 K1123	V1039-L1115 HydrophobicContact CG1-CD2 4.29Å; V1039-I1120 HydrophobicContact CG1-CG1 4.36Å; V1039-K1123 HydrophobicContact CB-CD 4.13Å; V1039-K1123 HydrophobicContact CG1-CD 4.1Å; V1039-K1123 HydrophobicContact CG2-CD 4.19Å
1040	C	83.4	Confident	87.2	Confident	39 Å²	39	38 Å²	38	26%	0.264	21%	0.208	S	C	.	.			trans	-70.3	138.8	175	-68.2	0	0	0	0	111.4	S1038 T1042 E1045 R1046 E1049 L1115	S1038-C1040 PolarHBondContact OG-N 3.39Å; C1040-T1042 PolarHBondContact O-N 3.25Å; C1040-E1045 HydrophobicContact CB-CB 3.64Å; C1040-R1046 HydrophobicContact CB-CG 3.88Å; C1040-R1046 WeakPolarHBondContact O-CD 3.39Å; C1040-R1046 WeakPolarHBondContact O-CG 3.28Å; C1040-E1049 PolarHBondContact SG-OE2 3.44Å; C1040-E1049 VanDerWaalsContact SG-OE2 3.39Å; C1040-L1115 WeakPolarHBondContact O-CD1 3.44Å
1041	P	78.6	Confident	87.5	Confident	105 Å²	105	37.6 Å²	37.6	68%	0.682	21%	0.206	S	C	*	.	S	Bend	trans	-68.1	-32.2	-162.5	24.3	-32.6	0	0	0	114.5	E1045	P1041-E1045 WeakPolarHBondContact CD-OE2 3.46Å; P1041-E1045 WeakPolarHBondContact CG-OE2 3.4Å
1042	T	86.9	Confident	87.6	Confident	65 Å²	65	39.4 Å²	39.4	40%	0.399	22%	0.215	S	C	.	.	S	Bend	trans	-101.9	153.2	179.1	73.8	0	0	0	0	113.2	C1040 L1044 E1045 R1046	C1040-T1042 PolarHBondContact O-N 3.25Å; T1042-L1044 PolarHBondContact O-N 3.08Å; T1042-L1044 PolarHBondContact OG1-N 3.3Å; T1042-E1045 VanDerWaalsContact CB-OE2 3.23Å; T1042-E1045 WeakPolarHBondContact CB-OE2 3.18Å; T1042-E1045 VanDerWaalsContact CG2-OE2 3.3Å; T1042-E1045 WeakPolarHBondContact CG2-OE2 3.36Å; T1042-E1045 PolarHBondContact N-OE2 3.46Å; T1042-E1045 PolarHBondContact O-N 3.08Å; T1042-E1045 WeakPolarHBondContact OG1-CG 3.43Å; T1042-E1045 PolarHBondContact OG1-N 2.81Å; T1042-E1045 PolarHBondContact OG1-OE2 3.35Å; T1042-R1046 WeakPolarHBondContact O-CG 3.13Å; T1042-R1046 PolarHBondContact O-N 3.13Å; T1042-R1046 VanDerWaalsContact O-N 3.1Å
1043	R	86.8	Confident	87.3	Confident	97 Å²	97	42 Å²	42	37%	0.366	23%	0.231	S	C	.	.	H	α-helix	trans	-56	-29.1	169.9	-73.4	-176.3	167.3	145.8	0.9	112.9	F1035 S1047 S1109 F1110 G1112	F1035-R1043 WeakPolarHBondContact CE2-O 3.05Å; F1035-R1043 HydrophobicContact CZ-CB 4.22Å; F1035-R1043 HydrophobicContact CZ-CG 4.22Å; R1043-S1047 WeakPolarHBondContact O-CB 3.24Å; R1043-S1047 PolarHBondContact O-N 2.91Å; R1043-S1047 VanDerWaalsContact O-N 3.14Å; R1043-S1109 WeakPolarHBondContact CB-O 3.28Å; R1043-F1110 WeakPolarHBondContact CD-O 3.16Å; R1043-F1110 PolarHBondContact NH1-O 3.33Å; R1043-G1112 PolarHBondContact NE-O 3.2Å; R1043-G1112 PolarHBondContact NH2-O 3.42Å
1044	L	90.4	Very high	87.3	Confident	63 Å²	63	41.9 Å²	41.9	33%	0.33	23%	0.233	S	C	.	.	H	α-helix	trans	-71	-49.1	-179.5	-173.1	63.3	0	0	0	111	L679 T1042 S1047 Q1048	L679-L1044 HydrophobicContact CB-CD1 4.08Å; L679-L1044 HydrophobicContact CD1-CD1 4.35Å; L679-L1044 HydrophobicContact CD2-CD1 4.41Å; T1042-L1044 PolarHBondContact O-N 3.08Å; T1042-L1044 PolarHBondContact OG1-N 3.3Å; L1044-S1047 PolarHBondContact O-N 3.35Å; L1044-Q1048 PolarHBondContact O-N 3.02Å
1045	E	90.6	Very high	87.3	Confident	78 Å²	78	41.2 Å²	41.2	36%	0.364	23%	0.228	S	C	.	.	H	α-helix	trans	-66.1	-37.7	178.8	-64.1	150.7	146.3	0	0	111.8	C1040 P1041 T1042 S1047 Q1048 E1049	C1040-E1045 HydrophobicContact CB-CB 3.64Å; P1041-E1045 WeakPolarHBondContact CD-OE2 3.46Å; P1041-E1045 WeakPolarHBondContact CG-OE2 3.4Å; T1042-E1045 VanDerWaalsContact CB-OE2 3.23Å; T1042-E1045 WeakPolarHBondContact CB-OE2 3.18Å; T1042-E1045 VanDerWaalsContact CG2-OE2 3.3Å; T1042-E1045 WeakPolarHBondContact CG2-OE2 3.36Å; T1042-E1045 PolarHBondContact N-OE2 3.46Å; T1042-E1045 PolarHBondContact O-N 3.08Å; T1042-E1045 WeakPolarHBondContact OG1-CG 3.43Å; T1042-E1045 PolarHBondContact OG1-N 2.81Å; T1042-E1045 PolarHBondContact OG1-OE2 3.35Å; E1045-S1047 VanDerWaalsContact C-N 3.33Å; E1045-S1047 PolarHBondContact O-N 3.18Å; E1045-Q1048 WeakPolarHBondContact O-CB 3.03Å; E1045-Q1048 PolarHBondContact O-N 3.36Å; E1045-Q1048 VanDerWaalsContact O-N 3.16Å; E1045-E1049 PolarHBondContact O-N 3.21Å
1046	R	90.4	Very high	87.1	Confident	7 Å²	7	41.3 Å²	41.3	3%	0.026	23%	0.229	C	C	.	.	H	α-helix	trans	-64.7	-36.1	173.7	-64	-159.7	-81.2	137.6	-3.4	112.9	F1035 S1038 C1040 T1042 Q1048 A1050 P1113	F1035-R1046 HydrophobicContact CD2-CB 3.84Å; F1035-R1046 VanDerWaalsContact CE1-NH1 3.34Å; F1035-R1046 HydrophobicContact CE2-CB 3.72Å; F1035-R1046 HydrophobicContact CG-CB 4.38Å; F1035-R1046 HydrophobicContact CZ-CB 4.14Å; F1035-R1046 PolarHBondContact O-NH1 3.29Å; F1035-R1046 VanDerWaalsContact O-NH1 3.16Å; S1038-R1046 VanDerWaalsContact O-CD 3.28Å; S1038-R1046 WeakPolarHBondContact O-CD 3.32Å; S1038-R1046 VanDerWaalsContact OG-CG 3.3Å; S1038-R1046 WeakPolarHBondContact OG-CG 3.41Å; C1040-R1046 HydrophobicContact CB-CG 3.88Å; C1040-R1046 WeakPolarHBondContact O-CD 3.39Å; C1040-R1046 WeakPolarHBondContact O-CG 3.28Å; T1042-R1046 WeakPolarHBondContact O-CG 3.13Å; T1042-R1046 PolarHBondContact O-N 3.13Å; T1042-R1046 VanDerWaalsContact O-N 3.1Å; R1046-Q1048 VanDerWaalsContact C-N 3.33Å; R1046-A1050 VanDerWaalsContact O-CB 3.26Å; R1046-A1050 WeakPolarHBondContact O-CB 3.42Å; R1046-A1050 PolarHBondContact O-N 3.44Å; R1046-P1113 PolarHBondContact NH1-O 2.77Å; R1046-P1113 PolarHBondContact NH2-O 3.19Å
1047	S	92.3	Very high	87	Confident	1 Å²	1	40.3 Å²	40.3	1%	0.007	22%	0.22	C	C	.	.	H	α-helix	trans	-69.8	-31.5	172.5	-177.2	0	0	0	0	112.7	R1043 L1044 E1045 L1051 P1105	R1043-S1047 WeakPolarHBondContact O-CB 3.24Å; R1043-S1047 PolarHBondContact O-N 2.91Å; R1043-S1047 VanDerWaalsContact O-N 3.14Å; L1044-S1047 PolarHBondContact O-N 3.35Å; E1045-S1047 VanDerWaalsContact C-N 3.33Å; E1045-S1047 PolarHBondContact O-N 3.18Å; S1047-L1051 WeakPolarHBondContact O-CB 3.42Å; S1047-L1051 PolarHBondContact O-N 3.12Å; S1047-P1105 WeakPolarHBondContact OG-CA 3.44Å; S1047-P1105 WeakPolarHBondContact OG-CB 3.45Å; S1047-P1105 PolarHBondContact OG-O 3.1Å
1048	Q	93.1	Very high	87.2	Confident	73 Å²	73	37.8 Å²	37.8	34%	0.341	20%	0.202	S	C	.	.	H	α-helix	trans	-69.5	-54.3	175.1	176.8	164.7	1.6	0	0	110.5	T675 L679 L1044 E1045 R1046 A1050 L1051 E1052	T675-Q1048 HydrophobicContact CG2-CB 4.21Å; T675-Q1048 HydrophobicContact CG2-CG 3.79Å; L679-Q1048 HydrophobicContact CD1-CB 3.77Å; L1044-Q1048 PolarHBondContact O-N 3.02Å; E1045-Q1048 WeakPolarHBondContact O-CB 3.03Å; E1045-Q1048 PolarHBondContact O-N 3.36Å; E1045-Q1048 VanDerWaalsContact O-N 3.16Å; R1046-Q1048 VanDerWaalsContact C-N 3.33Å; Q1048-A1050 VanDerWaalsContact C-N 3.33Å; Q1048-A1050 PolarHBondContact O-N 2.03Å; Q1048-L1051 PolarHBondContact O-N 2.97Å; Q1048-L1051 VanDerWaalsContact O-N 3.16Å; Q1048-E1052 HydrophobicContact CG-CG 4.29Å; Q1048-E1052 WeakPolarHBondContact CG-OE1 3.5Å; Q1048-E1052 PolarHBondContact NE2-OE1 2.87Å; Q1048-E1052 WeakPolarHBondContact O-CB 3.38Å; Q1048-E1052 WeakPolarHBondContact O-CG 3.21Å; Q1048-E1052 PolarHBondContact O-N 3.44Å
1049	E	90.2	Very high	87.4	Confident	78 Å²	78	39.4 Å²	39.4	36%	0.364	21%	0.21	S	C	.	.	H	α-helix	trans	-57.3	-44.3	178.3	-174.8	177.4	-153	0	0	111.8	S1038 C1040 E1045 L1051 E1052 T1053	S1038-E1049 VanDerWaalsContact CB-OE2 3.27Å; S1038-E1049 WeakPolarHBondContact CB-OE2 3.49Å; S1038-E1049 PolarHBondContact OG-OE2 2.87Å; C1040-E1049 PolarHBondContact SG-OE2 3.44Å; C1040-E1049 VanDerWaalsContact SG-OE2 3.39Å; E1045-E1049 PolarHBondContact O-N 3.21Å; E1049-L1051 PolarHBondContact O-N 3.22Å; E1049-E1052 PolarHBondContact O-N 3.43Å; E1049-T1053 HydrophobicContact CG-CG2 4.08Å; E1049-T1053 VanDerWaalsContact O-CB 3.3Å; E1049-T1053 WeakPolarHBondContact O-CB 3.32Å; E1049-T1053 VanDerWaalsContact O-CG2 3.26Å; E1049-T1053 WeakPolarHBondContact O-CG2 3.18Å; E1049-T1053 PolarHBondContact O-N 2.64Å; E1049-T1053 PolarHBondContact O-OG1 2.91Å
1050	A	90.5	Very high	87.5	Confident	2 Å²	2	37.7 Å²	37.7	2%	0.017	20%	0.2	C	C	.	.	H	α-helix	trans	-60	-43.9	177.2	0	0	0	0	0	112.6	A1034 F1035 R1046 Q1048 T1053 V1054	A1034-A1050 HydrophobicContact CB-CB 3.85Å; F1035-A1050 HydrophobicContact CB-CB 4.22Å; R1046-A1050 VanDerWaalsContact O-CB 3.26Å; R1046-A1050 WeakPolarHBondContact O-CB 3.42Å; R1046-A1050 PolarHBondContact O-N 3.44Å; Q1048-A1050 VanDerWaalsContact C-N 3.33Å; Q1048-A1050 PolarHBondContact O-N 2.03Å; A1050-T1053 PolarHBondContact O-OG1 3.04Å; A1050-V1054 WeakPolarHBondContact O-CB 3.5Å; A1050-V1054 PolarHBondContact O-N 3.35Å; A1050-V1054 VanDerWaalsContact O-N 3.08Å
1051	L	91.6	Very high	87.3	Confident	2 Å²	2	35.9 Å²	35.9	1%	0.01	19%	0.188	C	C	.	.	H	α-helix	trans	-72	-38.6	-179.8	-173.3	58.3	0	0	0	112.3	Y674 T675 L678 S1047 Q1048 E1049 G1055 L1101 P1105	Y674-L1051 HydrophobicContact CD1-CD2 4.09Å; Y674-L1051 HydrophobicContact CE1-CD1 4.38Å; Y674-L1051 HydrophobicContact CE1-CD2 4.01Å; T675-L1051 HydrophobicContact CG2-CB 4.42Å; T675-L1051 HydrophobicContact CG2-CD2 4.03Å; L678-L1051 HydrophobicContact CD2-CD2 3.81Å; S1047-L1051 WeakPolarHBondContact O-CB 3.42Å; S1047-L1051 PolarHBondContact O-N 3.12Å; Q1048-L1051 PolarHBondContact O-N 2.97Å; Q1048-L1051 VanDerWaalsContact O-N 3.16Å; E1049-L1051 PolarHBondContact O-N 3.22Å; L1051-G1055 VanDerWaalsContact O-CA 3.3Å; L1051-G1055 WeakPolarHBondContact O-CA 3.45Å; L1051-G1055 PolarHBondContact O-N 3.31Å; L1051-L1101 HydrophobicContact CD1-CD2 4.35Å; L1051-P1105 HydrophobicContact CD1-CG 4.08Å; L1051-P1105 HydrophobicContact CD2-CB 4.23Å; L1051-P1105 HydrophobicContact CD2-CG 4.21Å
1052	E	89.4	Confident	87.4	Confident	39 Å²	39	31.2 Å²	31.2	18%	0.182	16%	0.158	C	C	.	.	H	α-helix	trans	-70.6	-33.7	178.1	-69.9	-179.9	-173.4	0	0	113.3	R671 T675 Q1048 E1049	R671-E1052 HydrophobicContact CB-CG 4.22Å; R671-E1052 HydrophobicContact CG-CG 4.2Å; T675-E1052 HydrophobicContact CG2-CG 4.19Å; Q1048-E1052 HydrophobicContact CG-CG 4.29Å; Q1048-E1052 WeakPolarHBondContact CG-OE1 3.5Å; Q1048-E1052 PolarHBondContact NE2-OE1 2.87Å; Q1048-E1052 WeakPolarHBondContact O-CB 3.38Å; Q1048-E1052 WeakPolarHBondContact O-CG 3.21Å; Q1048-E1052 PolarHBondContact O-N 3.44Å; E1049-E1052 PolarHBondContact O-N 3.43Å
1053	T	83.9	Confident	87.3	Confident	55 Å²	55	28.8 Å²	28.8	34%	0.337	14%	0.143	S	C	.	.	H	α-helix	trans	-87	-34.8	-177.7	55.6	0	0	0	0	113.7	R563 E1049 A1050	R563-T1053 PolarHBondContact NH1-O 3.42Å; E1049-T1053 HydrophobicContact CG-CG2 4.08Å; E1049-T1053 VanDerWaalsContact O-CB 3.3Å; E1049-T1053 WeakPolarHBondContact O-CB 3.32Å; E1049-T1053 VanDerWaalsContact O-CG2 3.26Å; E1049-T1053 WeakPolarHBondContact O-CG2 3.18Å; E1049-T1053 PolarHBondContact O-N 2.64Å; E1049-T1053 PolarHBondContact O-OG1 2.91Å; A1050-T1053 PolarHBondContact O-OG1 3.04Å
1054	V	85	Confident	87.4	Confident	27 Å²	27	27.7 Å²	27.7	16%	0.164	14%	0.143	C	C	.	.	H	α-helix	trans	-112.2	-34.3	-173.5	172.2	0	0	0	0	113.4	H1030 I1031 A1034 A1050 A1056 S1057 V1058	H1030-V1054 HydrophobicContact CB-CG1 3.54Å; I1031-V1054 HydrophobicContact CG1-CG1 3.89Å; A1034-V1054 HydrophobicContact CB-CG2 3.78Å; A1050-V1054 WeakPolarHBondContact O-CB 3.5Å; A1050-V1054 PolarHBondContact O-N 3.35Å; A1050-V1054 VanDerWaalsContact O-N 3.08Å; V1054-A1056 PolarHBondContact O-N 3.13Å; V1054-A1056 VanDerWaalsContact O-N 3.15Å; V1054-S1057 WeakPolarHBondContact O-CA 3.1Å; V1054-S1057 WeakPolarHBondContact O-CB 3.44Å; V1054-S1057 PolarHBondContact O-N 3.2Å; V1054-V1058 HydrophobicContact CG1-CG2 3.76Å; V1054-V1058 PolarHBondContact O-N 2.97Å; V1054-V1058 VanDerWaalsContact O-N 3.15Å
1055	G	86.6	Confident	87.1	Confident	1 Å²	1	24.8 Å²	24.8	1%	0.01	13%	0.128	C	C	.	.	H	α-helix	trans	-58.8	-33.6	-172.9	0	0	0	0	0	114.1	L1051 S1057 L1059	L1051-G1055 VanDerWaalsContact O-CA 3.3Å; L1051-G1055 WeakPolarHBondContact O-CA 3.45Å; L1051-G1055 PolarHBondContact O-N 3.31Å; G1055-S1057 VanDerWaalsContact C-N 3.33Å; G1055-S1057 PolarHBondContact O-N 2.82Å; G1055-L1059 VanDerWaalsContact O-CB 3.24Å; G1055-L1059 WeakPolarHBondContact O-CB 3.48Å; G1055-L1059 PolarHBondContact O-N 3.39Å
1056	A	85.5	Confident	86.7	Confident	2 Å²	2	21.3 Å²	21.3	2%	0.017	11%	0.112	C	C	.	.	H	α-helix	trans	-65	-33.9	173.9	0	0	0	0	0	113.2	L666 Q667 I670 V1054 S1060	L666-A1056 WeakPolarHBondContact CD2-O 3.16Å; Q667-A1056 HydrophobicContact CB-CB 4.23Å; I670-A1056 VanDerWaalsContact CD1-CA 3.49Å; I670-A1056 HydrophobicContact CD1-CB 3.85Å; V1054-A1056 PolarHBondContact O-N 3.13Å; V1054-A1056 VanDerWaalsContact O-N 3.15Å; A1056-S1060 WeakPolarHBondContact O-CB 3.31Å; A1056-S1060 PolarHBondContact O-N 3.38Å; A1056-S1060 PolarHBondContact O-OG 2.87Å
1057	S	84.6	Confident	86.5	Confident	3 Å²	3	25.6 Å²	25.6	2%	0.021	13%	0.131	C	C	.	.	H	α-helix	trans	-71.6	-55.1	175.6	-63.4	0	0	0	0	110.9	Q559 R563 V1054 G1055 L1059 S1060 G1061	Q559-S1057 VanDerWaalsContact OE1-CA 3.29Å; Q559-S1057 PolarHBondContact OE1-OG 3.32Å; R563-S1057 PolarHBondContact NH1-OG 2.63Å; R563-S1057 PolarHBondContact NH2-OG 2.68Å; V1054-S1057 WeakPolarHBondContact O-CA 3.1Å; V1054-S1057 WeakPolarHBondContact O-CB 3.44Å; V1054-S1057 PolarHBondContact O-N 3.2Å; G1055-S1057 VanDerWaalsContact C-N 3.33Å; G1055-S1057 PolarHBondContact O-N 2.82Å; S1057-L1059 PolarHBondContact O-N 2.04Å; S1057-S1060 PolarHBondContact O-N 3.23Å; S1057-S1060 PolarHBondContact O-OG 3.05Å; S1057-S1060 VanDerWaalsContact O-OG 3.07Å; S1057-G1061 PolarHBondContact O-N 2.89Å
1058	V	84.7	Confident	86.2	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-57.6	-34.3	-179.8	173.5	0	0	0	0	112.9	F1027 H1030 V1054 I1062 T1063 L1101	F1027-V1058 HydrophobicContact CD1-CG1 3.58Å; F1027-V1058 HydrophobicContact CE1-CG1 4.07Å; F1027-V1058 HydrophobicContact CG-CG1 4.46Å; H1030-V1058 HydrophobicContact CB-CG2 4.35Å; V1054-V1058 HydrophobicContact CG1-CG2 3.76Å; V1054-V1058 PolarHBondContact O-N 2.97Å; V1054-V1058 VanDerWaalsContact O-N 3.15Å; V1058-I1062 HydrophobicContact CG1-CD1 3.94Å; V1058-I1062 PolarHBondContact O-N 3.04Å; V1058-T1063 PolarHBondContact O-N 2.9Å; V1058-T1063 PolarHBondContact O-OG1 2.82Å; V1058-L1101 HydrophobicContact CB-CD2 4.39Å; V1058-L1101 HydrophobicContact CG1-CD2 4.2Å
1059	L	88.4	Confident	85.7	Confident	46 Å²	46	23.3 Å²	23.3	24%	0.241	13%	0.127	C	C	.	.	I	π-helix	trans	-70.8	-39.2	174.5	-175.7	60.8	0	0	0	112.6	L666 I670 G1055 S1057 T1063 L1064 L1101	L666-L1059 HydrophobicContact CD1-CD2 3.92Å; L666-L1059 HydrophobicContact CD2-CB 4.47Å; L666-L1059 HydrophobicContact CD2-CD2 4.31Å; L666-L1059 HydrophobicContact CD2-CG 4.43Å; L666-L1059 HydrophobicContact CG-CD2 4.42Å; I670-L1059 HydrophobicContact CD1-CD2 4.05Å; G1055-L1059 VanDerWaalsContact O-CB 3.24Å; G1055-L1059 WeakPolarHBondContact O-CB 3.48Å; G1055-L1059 PolarHBondContact O-N 3.39Å; S1057-L1059 PolarHBondContact O-N 2.04Å; L1059-T1063 HydrophobicContact CD1-CG2 4.15Å; L1059-T1063 WeakPolarHBondContact O-CB 3.12Å; L1059-L1064 WeakPolarHBondContact O-CG 3.47Å; L1059-L1064 PolarHBondContact O-N 2.99Å; L1059-L1064 VanDerWaalsContact O-N 3.11Å; L1059-L1101 HydrophobicContact CB-CD1 4.11Å; L1059-L1101 HydrophobicContact CD1-CD1 3.95Å
1060	S	85.1	Confident	85.5	Confident	8 Å²	8	19.6 Å²	19.6	6%	0.056	11%	0.11	C	C	.	.	I	π-helix	trans	-81.8	-48.8	-179.5	58.8	0	0	0	0	113.7	Y482 Q559 A1056 S1057 T1065	Y482-S1060 WeakPolarHBondContact CE1-O 3.42Å; Y482-S1060 PolarHBondContact OH-O 3.32Å; Q559-S1060 PolarHBondContact NE2-OG 3.2Å; A1056-S1060 WeakPolarHBondContact O-CB 3.31Å; A1056-S1060 PolarHBondContact O-N 3.38Å; A1056-S1060 PolarHBondContact O-OG 2.87Å; S1057-S1060 PolarHBondContact O-N 3.23Å; S1057-S1060 PolarHBondContact O-OG 3.05Å; S1057-S1060 VanDerWaalsContact O-OG 3.07Å; S1060-T1065 PolarHBondContact O-OG1 2.86Å
1061	G	79.1	Confident	85.4	Confident	2 Å²	2	22.3 Å²	22.3	2%	0.021	13%	0.126	C	C	.	.	I	π-helix	trans	-65.7	-66.7	-179.5	0	0	0	0	0	112.2	D552 S1057 T1065	D552-G1061 WeakPolarHBondContact OD1-CA 3.48Å; S1057-G1061 PolarHBondContact O-N 2.89Å; G1061-T1065 WeakPolarHBondContact O-CB 3.41Å; G1061-T1065 PolarHBondContact O-OG1 3.35Å
1062	I	80.6	Confident	85.3	Confident	7 Å²	7	23.3 Å²	23.3	4%	0.036	13%	0.132	C	C	.	.	I	π-helix	trans	-72.2	-63.3	179.6	-35.7	178	0	0	0	112.1	D552 E1026 F1027 V1058 K1066	D552-I1062 HydrophobicContact CB-CG1 3.85Å; D552-I1062 WeakPolarHBondContact OD1-CG1 3.48Å; D552-I1062 PolarHBondContact OD1-N 3.11Å; D552-I1062 VanDerWaalsContact OD2-CG1 3.24Å; D552-I1062 WeakPolarHBondContact OD2-CG1 3.31Å; E1026-I1062 HydrophobicContact CB-CD1 3.52Å; F1027-I1062 HydrophobicContact CD1-CD1 4Å; F1027-I1062 HydrophobicContact CD2-CD1 4.1Å; F1027-I1062 HydrophobicContact CE1-CB 4.19Å; F1027-I1062 HydrophobicContact CE1-CD1 4.05Å; F1027-I1062 HydrophobicContact CE1-CG2 4.3Å; F1027-I1062 HydrophobicContact CE2-CB 4.49Å; F1027-I1062 HydrophobicContact CE2-CD1 4.17Å; F1027-I1062 HydrophobicContact CE2-CG2 3.76Å; F1027-I1062 HydrophobicContact CG-CD1 4.03Å; F1027-I1062 HydrophobicContact CZ-CB 3.95Å; F1027-I1062 HydrophobicContact CZ-CD1 4.15Å; F1027-I1062 HydrophobicContact CZ-CG2 3.56Å; V1058-I1062 HydrophobicContact CG1-CD1 3.94Å; V1058-I1062 PolarHBondContact O-N 3.04Å; I1062-K1066 WeakPolarHBondContact O-CB 3.4Å; I1062-K1066 WeakPolarHBondContact O-CG 3.29Å; I1062-K1066 PolarHBondContact O-N 3.47Å
1063	T	85.3	Confident	85.1	Confident	14 Å²	14	22 Å²	22	9%	0.086	13%	0.126	C	C	.	.	I	π-helix	trans	-68.5	-50.6	-156.1	-45.8	0	0	0	0	112.1	F1027 V1058 L1059 F1067 V1093 A1097	F1027-T1063 WeakPolarHBondContact CE1-OG1 3.41Å; V1058-T1063 PolarHBondContact O-N 2.9Å; V1058-T1063 PolarHBondContact O-OG1 2.82Å; L1059-T1063 HydrophobicContact CD1-CG2 4.15Å; L1059-T1063 WeakPolarHBondContact O-CB 3.12Å; T1063-F1067 VanDerWaalsContact O-CB 3.26Å; T1063-F1067 WeakPolarHBondContact O-CB 3.27Å; T1063-F1067 PolarHBondContact O-N 3.2Å; T1063-V1093 HydrophobicContact CG2-CG1 4.17Å; T1063-A1097 HydrophobicContact CG2-CB 3.72Å
1064	L	87.8	Confident	85.3	Confident	73 Å²	73	21 Å²	21	38%	0.382	12%	0.124	S	C	.	.	I	π-helix	trans	-73.2	-41.5	-177	-69.9	176.1	0	0	0	112.5	Y482 L1059 K1066 F1067 G1068	Y482-L1064 HydrophobicContact CE1-CB 4.24Å; Y482-L1064 HydrophobicContact CE2-CB 4.15Å; Y482-L1064 WeakPolarHBondContact OH-CB 3.38Å; Y482-L1064 WeakPolarHBondContact OH-CD1 3.06Å; L1059-L1064 WeakPolarHBondContact O-CG 3.47Å; L1059-L1064 PolarHBondContact O-N 2.99Å; L1059-L1064 VanDerWaalsContact O-N 3.11Å; L1064-K1066 VanDerWaalsContact C-N 3.34Å; L1064-K1066 PolarHBondContact O-N 3.47Å; L1064-F1067 PolarHBondContact O-N 2.99Å; L1064-G1068 PolarHBondContact O-N 3.35Å
1065	T	84.4	Confident	85.4	Confident	2 Å²	2	27.1 Å²	27.1	1%	0.012	15%	0.148	C	C	.	.	H	α-helix	trans	-55.8	-49.3	173.7	-52.4	0	0	0	0	110.9	M479 Y482 I483 V551 S1060 G1061 G1068 G1069	M479-T1065 HydrophobicContact CB-CG2 4.32Å; M479-T1065 HydrophobicContact CG-CG2 4.21Å; M479-T1065 HydrophobicContact SD-CG2 4.49Å; Y482-T1065 HydrophobicContact CD1-CG2 4.33Å; Y482-T1065 WeakPolarHBondContact CD1-OG1 3.38Å; Y482-T1065 VanDerWaalsContact CE1-OG1 3.25Å; Y482-T1065 WeakPolarHBondContact CE1-OG1 3.36Å; I483-T1065 HydrophobicContact CD1-CG2 4.1Å; I483-T1065 HydrophobicContact CG1-CG2 4.07Å; V551-T1065 HydrophobicContact CG1-CG2 4.25Å; S1060-T1065 PolarHBondContact O-OG1 2.86Å; G1061-T1065 WeakPolarHBondContact O-CB 3.41Å; G1061-T1065 PolarHBondContact O-OG1 3.35Å; T1065-G1068 PolarHBondContact O-N 3.29Å; T1065-G1069 PolarHBondContact O-N 3.19Å
1066	K	82.2	Confident	85.3	Confident	5 Å²	5	27.2 Å²	27.2	2%	0.022	15%	0.149	C	C	.	.	H	α-helix	trans	-72	-38.9	-178.3	-69.3	-50.4	-162.1	-172	0	113.5	M479 F544 I1062 L1064 G1068 G1069 I1070 V1093	M479-K1066 HydrophobicContact SD-CD 4.46Å; F544-K1066 HydrophobicContact CE1-CD 4.35Å; F544-K1066 HydrophobicContact CE2-CD 4.15Å; F544-K1066 HydrophobicContact CZ-CD 3.74Å; F544-K1066 PolarHBondContact O-NZ 3.29Å; I1062-K1066 WeakPolarHBondContact O-CB 3.4Å; I1062-K1066 WeakPolarHBondContact O-CG 3.29Å; I1062-K1066 PolarHBondContact O-N 3.47Å; L1064-K1066 VanDerWaalsContact C-N 3.34Å; L1064-K1066 PolarHBondContact O-N 3.47Å; K1066-G1068 VanDerWaalsContact C-N 3.29Å; K1066-G1068 PolarHBondContact O-N 2.64Å; K1066-G1069 PolarHBondContact O-N 3.12Å; K1066-I1070 HydrophobicContact CB-CD1 4.09Å; K1066-I1070 WeakPolarHBondContact O-CB 3.48Å; K1066-I1070 WeakPolarHBondContact O-CD1 3.02Å; K1066-I1070 WeakPolarHBondContact O-CG1 3.49Å; K1066-I1070 PolarHBondContact O-N 3.43Å; K1066-V1093 HydrophobicContact CB-CG1 4.22Å; K1066-V1093 HydrophobicContact CB-CG2 3.75Å; K1066-V1093 HydrophobicContact CG-CG2 4.4Å
1067	F	87.3	Confident	85	Confident	98 Å²	98	33.9 Å²	33.9	43%	0.43	18%	0.18	S	C	.	.	H	α-helix	trans	-57.4	-44.3	173.6	-174.7	-98.5	0	0	0	111.4	T1063 L1064 G1069 I1070 V1071 L1090	T1063-F1067 VanDerWaalsContact O-CB 3.26Å; T1063-F1067 WeakPolarHBondContact O-CB 3.27Å; T1063-F1067 PolarHBondContact O-N 3.2Å; L1064-F1067 PolarHBondContact O-N 2.99Å; F1067-G1069 PolarHBondContact O-N 3.29Å; F1067-I1070 PolarHBondContact O-N 3.4Å; F1067-V1071 HydrophobicContact CD1-CG2 4.19Å; F1067-V1071 HydrophobicContact CD2-CG2 4.25Å; F1067-V1071 HydrophobicContact CE1-CG2 3.86Å; F1067-V1071 HydrophobicContact CE2-CG2 3.92Å; F1067-V1071 HydrophobicContact CG-CG2 4.38Å; F1067-V1071 HydrophobicContact CZ-CG2 3.72Å; F1067-V1071 WeakPolarHBondContact O-CB 3.24Å; F1067-V1071 VanDerWaalsContact O-CG2 3.27Å; F1067-V1071 WeakPolarHBondContact O-CG2 3.34Å; F1067-V1071 PolarHBondContact O-N 2.94Å; F1067-V1071 VanDerWaalsContact O-N 3.07Å; F1067-L1090 HydrophobicContact CD2-CD1 4.22Å; F1067-L1090 HydrophobicContact CE2-CD1 4.13Å
1068	G	84.4	Confident	84.8	Confident	25 Å²	25	34 Å²	34	26%	0.258	18%	0.18	S	C	.	.	H	α-helix	trans	-58.8	-45.4	175.9	0	0	0	0	0	113.6	L1064 T1065 K1066	L1064-G1068 PolarHBondContact O-N 3.35Å; T1065-G1068 PolarHBondContact O-N 3.29Å; K1066-G1068 VanDerWaalsContact C-N 3.29Å; K1066-G1068 PolarHBondContact O-N 2.64Å
1069	G	83.1	Confident	84.8	Confident	0 Å²	0	36 Å²	36	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-68.2	-44.6	176.8	0	0	0	0	0	113.8	S475 T1065 K1066 F1067 V1072	S475-G1069 VanDerWaalsContact OG-C 3.26Å; S475-G1069 VanDerWaalsContact OG-CA 3.28Å; S475-G1069 WeakPolarHBondContact OG-CA 3.01Å; S475-G1069 PolarHBondContact OG-O 3.39Å; T1065-G1069 PolarHBondContact O-N 3.19Å; K1066-G1069 PolarHBondContact O-N 3.12Å; F1067-G1069 PolarHBondContact O-N 3.29Å; G1069-V1072 PolarHBondContact O-N 3.11Å
1070	I	86.1	Confident	84.6	Confident	1 Å²	1	35.6 Å²	35.6	1%	0.005	19%	0.187	C	C	.	.	H	α-helix	trans	-68.8	-37.9	-174.6	-66.8	161	0	0	0	111.6	F544 K1066 F1067 V1072 L1073 F1086 L1090 V1093	F544-I1070 HydrophobicContact CZ-CD1 4.28Å; F544-I1070 HydrophobicContact CZ-CG1 3.81Å; K1066-I1070 HydrophobicContact CB-CD1 4.09Å; K1066-I1070 WeakPolarHBondContact O-CB 3.48Å; K1066-I1070 WeakPolarHBondContact O-CD1 3.02Å; K1066-I1070 WeakPolarHBondContact O-CG1 3.49Å; K1066-I1070 PolarHBondContact O-N 3.43Å; F1067-I1070 PolarHBondContact O-N 3.4Å; I1070-V1072 PolarHBondContact O-N 2.81Å; I1070-L1073 WeakPolarHBondContact O-CB 3.43Å; I1070-L1073 PolarHBondContact O-N 2.86Å; I1070-F1086 HydrophobicContact CG2-CD2 3.77Å; I1070-F1086 HydrophobicContact CG2-CE2 4.15Å; I1070-F1086 WeakPolarHBondContact O-CD2 3.37Å; I1070-L1090 HydrophobicContact CG2-CB 4.02Å; I1070-V1093 HydrophobicContact CD1-CB 4.3Å; I1070-V1093 HydrophobicContact CD1-CG2 3.59Å
1071	V	89.4	Confident	84.3	Confident	58 Å²	58	36.2 Å²	36.2	35%	0.352	19%	0.189	S	C	.	.	H	α-helix	trans	-61.6	-26.6	178.9	168.5	0	0	0	0	112.4	F1067 A1074	F1067-V1071 HydrophobicContact CD1-CG2 4.19Å; F1067-V1071 HydrophobicContact CD2-CG2 4.25Å; F1067-V1071 HydrophobicContact CE1-CG2 3.86Å; F1067-V1071 HydrophobicContact CE2-CG2 3.92Å; F1067-V1071 HydrophobicContact CG-CG2 4.38Å; F1067-V1071 HydrophobicContact CZ-CG2 3.72Å; F1067-V1071 WeakPolarHBondContact O-CB 3.24Å; F1067-V1071 VanDerWaalsContact O-CG2 3.27Å; F1067-V1071 WeakPolarHBondContact O-CG2 3.34Å; F1067-V1071 PolarHBondContact O-N 2.94Å; F1067-V1071 VanDerWaalsContact O-N 3.07Å; V1071-A1074 VanDerWaalsContact O-CB 3.31Å; V1071-A1074 WeakPolarHBondContact O-CB 3.39Å; V1071-A1074 PolarHBondContact O-N 3.19Å
1072	V	88.4	Confident	84.6	Confident	23 Å²	23	38.7 Å²	38.7	14%	0.139	20%	0.2	C	C	.	.	H	α-helix	trans	-69	-35	173	-179.5	0	0	0	0	111.9	T471 I474 V478 G1069 I1070 A1074 F1075	T471-V1072 WeakPolarHBondContact O-CG1 3.46Å; I474-V1072 HydrophobicContact CB-CG1 4.08Å; I474-V1072 HydrophobicContact CG2-CG1 3.82Å; V478-V1072 HydrophobicContact CB-CG2 4.44Å; V478-V1072 HydrophobicContact CG2-CG2 4.12Å; G1069-V1072 PolarHBondContact O-N 3.11Å; I1070-V1072 PolarHBondContact O-N 2.81Å; V1072-A1074 PolarHBondContact O-N 3.33Å; V1072-F1075 PolarHBondContact O-N 3.49Å; V1072-F1075 VanDerWaalsContact O-N 3.09Å
1073	L	84.7	Confident	84.9	Confident	11 Å²	11	39.2 Å²	39.2	6%	0.058	20%	0.203	C	C	.	.	H	α-helix	trans	-68	-14.7	180	-57	174.4	0	0	0	112.8	I472 I1070 F1075 S1076 F1086 Y1089	I472-L1073 HydrophobicContact CG1-CD2 4.26Å; I1070-L1073 WeakPolarHBondContact O-CB 3.43Å; I1070-L1073 PolarHBondContact O-N 2.86Å; L1073-F1075 PolarHBondContact O-N 2.83Å; L1073-S1076 WeakPolarHBondContact O-CB 3.49Å; L1073-S1076 PolarHBondContact O-N 2.62Å; L1073-F1086 HydrophobicContact CB-CB 4.22Å; L1073-Y1089 HydrophobicContact CD1-CD2 4.42Å
1074	A	88	Confident	84.9	Confident	36 Å²	36	38.6 Å²	38.6	30%	0.298	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-19.6	170.2	0	0	0	0	0	113.4	V1071 V1072 F1086	V1071-A1074 VanDerWaalsContact O-CB 3.31Å; V1071-A1074 WeakPolarHBondContact O-CB 3.39Å; V1071-A1074 PolarHBondContact O-N 3.19Å; V1072-A1074 PolarHBondContact O-N 3.33Å; A1074-F1086 HydrophobicContact CB-CD1 4.34Å; A1074-F1086 HydrophobicContact CB-CD2 3.97Å; A1074-F1086 HydrophobicContact CB-CE1 4.06Å; A1074-F1086 HydrophobicContact CB-CE2 3.67Å; A1074-F1086 HydrophobicContact CB-CG 4.3Å; A1074-F1086 HydrophobicContact CB-CZ 3.72Å
1075	F	88.5	Confident	84.7	Confident	154 Å²	154	35.4 Å²	35.4	68%	0.675	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.1	12.8	-179.9	-56.5	-81.5	0	0	0	113.4	V1072 L1073	V1072-F1075 PolarHBondContact O-N 3.49Å; V1072-F1075 VanDerWaalsContact O-N 3.09Å; L1073-F1075 PolarHBondContact O-N 2.83Å
1076	S	83.6	Confident	84.9	Confident	3 Å²	3	37.2 Å²	37.2	2%	0.021	19%	0.19	C	C	.	.			trans	-61.1	149.8	168.7	163.5	0	0	0	0	111.6	D468 L1073 S1078 F1081 Q1082	D468-S1076 WeakPolarHBondContact OD1-CA 3.46Å; D468-S1076 WeakPolarHBondContact OD1-CB 3.43Å; D468-S1076 PolarHBondContact OD1-OG 2.99Å; D468-S1076 PolarHBondContact OD2-OG 3.23Å; L1073-S1076 WeakPolarHBondContact O-CB 3.49Å; L1073-S1076 PolarHBondContact O-N 2.62Å; S1076-S1078 PolarHBondContact OG-N 2.66Å; S1076-F1081 WeakPolarHBondContact OG-CB 3.43Å; S1076-Q1082 PolarHBondContact O-NE2 2.99Å
1077	H	80.4	Confident	85.2	Confident	143 Å²	143	40.8 Å²	40.8	66%	0.662	20%	0.204	S	C	*	.	S	Bend	trans	-84.8	-25.3	177.1	-74.2	-85	0	0	0	113.3	D468	D468-H1077 PolarHBondContact OD1-N 2.94Å
1078	S	80.5	Confident	85.2	Confident	4 Å²	4	36.5 Å²	36.5	3%	0.028	19%	0.185	C	C	.	.			trans	-80.6	136.5	-179.7	177.2	0	0	0	0	113.2	D468 S1076 I1080 F1081 Q1082	D468-S1078 WeakPolarHBondContact OD2-CB 3.4Å; D468-S1078 PolarHBondContact OD2-N 3.4Å; S1076-S1078 PolarHBondContact OG-N 2.66Å; S1078-I1080 VanDerWaalsContact C-N 3.26Å; S1078-I1080 PolarHBondContact O-N 3.1Å; S1078-I1080 PolarHBondContact OG-N 3.03Å; S1078-I1080 VanDerWaalsContact OG-N 3.15Å; S1078-F1081 PolarHBondContact O-N 3.39Å; S1078-Q1082 WeakPolarHBondContact O-CG 3.39Å; S1078-Q1082 PolarHBondContact O-N 3.42Å; S1078-Q1082 VanDerWaalsContact O-N 3.09Å
1079	Q	84.1	Confident	85.3	Confident	43 Å²	43	35.7 Å²	35.7	20%	0.201	17%	0.174	C	C	.	.	H	α-helix	trans	-63.5	-31.6	171.1	-70.2	-171.3	-5.5	0	0	112.2	Q717 F1081 Q1082 V1083	Q717-Q1079 HydrophobicContact CG-CG 3.92Å; Q1079-F1081 PolarHBondContact O-N 3.31Å; Q1079-Q1082 PolarHBondContact O-N 2.8Å; Q1079-V1083 VanDerWaalsContact O-CB 3.28Å; Q1079-V1083 WeakPolarHBondContact O-CB 3.02Å; Q1079-V1083 VanDerWaalsContact O-CG2 3.31Å; Q1079-V1083 WeakPolarHBondContact O-CG2 3.47Å; Q1079-V1083 PolarHBondContact O-N 3.01Å
1080	I	82.9	Confident	85.5	Confident	38 Å²	38	36.9 Å²	36.9	20%	0.195	18%	0.18	C	C	.	.	H	α-helix	trans	-60.2	-49	175.8	-53.2	-179.4	0	0	0	110.1	L713 S1078 V1083 F1084 Y1085	L713-I1080 WeakPolarHBondContact O-CG1 3.32Å; S1078-I1080 VanDerWaalsContact C-N 3.26Å; S1078-I1080 PolarHBondContact O-N 3.1Å; S1078-I1080 PolarHBondContact OG-N 3.03Å; S1078-I1080 VanDerWaalsContact OG-N 3.15Å; I1080-V1083 PolarHBondContact O-N 2.89Å; I1080-F1084 HydrophobicContact CG2-CD2 4.05Å; I1080-F1084 WeakPolarHBondContact O-CB 3.16Å; I1080-F1084 PolarHBondContact O-N 3.34Å; I1080-Y1085 HydrophobicContact CG2-CD2 4.47Å; I1080-Y1085 HydrophobicContact CG2-CE2 4.24Å; I1080-Y1085 PolarHBondContact O-N 2.87Å
1081	F	79.8	Confident	85.6	Confident	20 Å²	20	36.9 Å²	36.9	9%	0.088	18%	0.181	C	C	.	.	I	π-helix	trans	-68.3	-38	-179	-85.3	-75.5	0	0	0	112.6	D468 I472 S1076 S1078 Q1079 Y1085 F1086	D468-F1081 HydrophobicContact CB-CD2 4.17Å; D468-F1081 HydrophobicContact CB-CE2 4.22Å; D468-F1081 WeakPolarHBondContact OD2-CD2 3.06Å; I472-F1081 HydrophobicContact CD1-CE1 4.17Å; I472-F1081 HydrophobicContact CD1-CZ 4.02Å; S1076-F1081 WeakPolarHBondContact OG-CB 3.43Å; S1078-F1081 PolarHBondContact O-N 3.39Å; Q1079-F1081 PolarHBondContact O-N 3.31Å; F1081-Y1085 AromaticContact CD1-CD2 3.38Å; F1081-Y1085 HydrophobicContact CD1-CD2 3.38Å; F1081-Y1085 HydrophobicContact CD1-CE2 4.17Å; F1081-Y1085 HydrophobicContact CD1-CG 4.01Å; F1081-Y1085 AromaticContact CE1-CD2 3.54Å; F1081-Y1085 HydrophobicContact CE1-CD2 3.54Å; F1081-Y1085 AromaticContact CE1-CE2 3.92Å; F1081-Y1085 HydrophobicContact CE1-CE2 3.92Å; F1081-Y1085 HydrophobicContact CE1-CG 4.25Å; F1081-Y1085 AromaticContact CG-CD2 3.99Å; F1081-Y1085 HydrophobicContact CG-CD2 3.99Å; F1081-Y1085 HydrophobicContact CZ-CD2 4.27Å; F1081-Y1085 HydrophobicContact CZ-CE2 4.27Å; F1081-Y1085 PolarHBondContact O-N 3.43Å; F1081-F1086 WeakPolarHBondContact O-CB 3.48Å; F1081-F1086 PolarHBondContact O-N 3.13Å
1082	Q	85.7	Confident	85.4	Confident	54 Å²	54	34.3 Å²	34.3	25%	0.252	17%	0.165	S	C	.	.	I	π-helix	trans	-66.8	-41.9	173.8	-68	-179.4	9.6	0	0	113.2	S1076 S1078 Q1079 R1087	S1076-Q1082 PolarHBondContact O-NE2 2.99Å; S1078-Q1082 WeakPolarHBondContact O-CG 3.39Å; S1078-Q1082 PolarHBondContact O-N 3.42Å; S1078-Q1082 VanDerWaalsContact O-N 3.09Å; Q1079-Q1082 PolarHBondContact O-N 2.8Å; Q1082-R1087 WeakPolarHBondContact O-CG 3.38Å; Q1082-R1087 PolarHBondContact O-N 3.02Å
1083	V	86.8	Confident	85.3	Confident	18 Å²	18	33.7 Å²	33.7	11%	0.109	16%	0.161	C	C	.	.	I	π-helix	trans	-91.7	-44.8	-170	177.9	0	0	0	0	113.3	I996 Q1079 I1080 R1087	I996-V1083 HydrophobicContact CG1-CG1 4.43Å; Q1079-V1083 VanDerWaalsContact O-CB 3.28Å; Q1079-V1083 WeakPolarHBondContact O-CB 3.02Å; Q1079-V1083 VanDerWaalsContact O-CG2 3.31Å; Q1079-V1083 WeakPolarHBondContact O-CG2 3.47Å; Q1079-V1083 PolarHBondContact O-N 3.01Å; I1080-V1083 PolarHBondContact O-N 2.89Å; V1083-R1087 WeakPolarHBondContact O-CB 3.36Å
1084	F	85	Confident	85.5	Confident	1 Å²	1	37 Å²	37	0%	0.004	18%	0.179	C	C	.	.	I	π-helix	trans	-94.2	-37.8	-176.3	-63.1	-72.7	0	0	0	112.8	L709 I996 N999 V1001 N1005 I1080 M1088	L709-F1084 HydrophobicContact CD1-CE2 3.52Å; L709-F1084 HydrophobicContact CD1-CZ 3.65Å; I996-F1084 HydrophobicContact CG2-CD1 3.65Å; I996-F1084 HydrophobicContact CG2-CE1 3.68Å; N999-F1084 VanDerWaalsContact ND2-CE1 3.28Å; N999-F1084 WeakPolarHBondContact ND2-CE1 3.42Å; N999-F1084 WeakPolarHBondContact ND2-CZ 3.38Å; V1001-F1084 HydrophobicContact CG1-CB 3.94Å; V1001-F1084 HydrophobicContact CG1-CG 4.37Å; N1005-F1084 PolarHBondContact ND2-O 2.9Å; I1080-F1084 HydrophobicContact CG2-CD2 4.05Å; I1080-F1084 WeakPolarHBondContact O-CB 3.16Å; I1080-F1084 PolarHBondContact O-N 3.34Å; F1084-M1088 WeakPolarHBondContact O-CB 3.42Å; F1084-M1088 WeakPolarHBondContact O-CG 3.39Å; F1084-M1088 VanDerWaalsContact O-SD 3.4Å
1085	Y	83.4	Confident	85.7	Confident	6 Å²	6	36.4 Å²	36.4	2%	0.024	17%	0.17	C	C	.	.	I	π-helix	trans	-89.7	-64.6	-178.6	-66.5	-60.7	0	0	0	113	V541 V1001 N1005 I1080 F1081 R1087 M1088 Y1089	V541-Y1085 HydrophobicContact CG2-CE1 3.64Å; V1001-Y1085 HydrophobicContact CG1-CE1 4.35Å; N1005-Y1085 WeakPolarHBondContact ND2-CD1 3.29Å; I1080-Y1085 HydrophobicContact CG2-CD2 4.47Å; I1080-Y1085 HydrophobicContact CG2-CE2 4.24Å; I1080-Y1085 PolarHBondContact O-N 2.87Å; F1081-Y1085 AromaticContact CD1-CD2 3.38Å; F1081-Y1085 HydrophobicContact CD1-CD2 3.38Å; F1081-Y1085 HydrophobicContact CD1-CE2 4.17Å; F1081-Y1085 HydrophobicContact CD1-CG 4.01Å; F1081-Y1085 AromaticContact CE1-CD2 3.54Å; F1081-Y1085 HydrophobicContact CE1-CD2 3.54Å; F1081-Y1085 AromaticContact CE1-CE2 3.92Å; F1081-Y1085 HydrophobicContact CE1-CE2 3.92Å; F1081-Y1085 HydrophobicContact CE1-CG 4.25Å; F1081-Y1085 AromaticContact CG-CD2 3.99Å; F1081-Y1085 HydrophobicContact CG-CD2 3.99Å; F1081-Y1085 HydrophobicContact CZ-CD2 4.27Å; F1081-Y1085 HydrophobicContact CZ-CE2 4.27Å; F1081-Y1085 PolarHBondContact O-N 3.43Å; Y1085-R1087 PolarHBondContact O-N 2.7Å; Y1085-M1088 PolarHBondContact O-N 3.35Å; Y1085-Y1089 HydrophobicContact CD1-CE1 4.04Å; Y1085-Y1089 HydrophobicContact CD1-CE2 4.05Å; Y1085-Y1089 AromaticContact CD1-CZ 3.57Å; Y1085-Y1089 WeakPolarHBondContact CD1-OH 3.23Å; Y1085-Y1089 WeakPolarHBondContact O-CB 3.31Å; Y1085-Y1089 PolarHBondContact O-N 3.43Å
1086	F	87.9	Confident	85.6	Confident	41 Å²	41	29.1 Å²	29.1	18%	0.18	14%	0.137	C	C	.	.	I	π-helix	trans	-54.9	-55.9	-177.4	164.3	-111.9	0	0	0	112.6	I1070 L1073 A1074 F1081 M1088 L1090	I1070-F1086 HydrophobicContact CG2-CD2 3.77Å; I1070-F1086 HydrophobicContact CG2-CE2 4.15Å; I1070-F1086 WeakPolarHBondContact O-CD2 3.37Å; L1073-F1086 HydrophobicContact CB-CB 4.22Å; A1074-F1086 HydrophobicContact CB-CD1 4.34Å; A1074-F1086 HydrophobicContact CB-CD2 3.97Å; A1074-F1086 HydrophobicContact CB-CE1 4.06Å; A1074-F1086 HydrophobicContact CB-CE2 3.67Å; A1074-F1086 HydrophobicContact CB-CG 4.3Å; A1074-F1086 HydrophobicContact CB-CZ 3.72Å; F1081-F1086 WeakPolarHBondContact O-CB 3.48Å; F1081-F1086 PolarHBondContact O-N 3.13Å; F1086-M1088 PolarHBondContact O-N 3.31Å; F1086-L1090 HydrophobicContact CE2-CD2 3.99Å; F1086-L1090 HydrophobicContact CZ-CD2 3.79Å; F1086-L1090 WeakPolarHBondContact O-CB 3.48Å; F1086-L1090 PolarHBondContact O-N 2.03Å
1087	R	90.2	Very high	85.9	Confident	79 Å²	79	29.5 Å²	29.5	30%	0.298	14%	0.141	S	C	.	.	H	α-helix	trans	-59.7	-47.9	-179.1	-79	-179.9	-158.6	-175.9	6.5	112.6	W994 I996 Q1082 V1083 Y1085 G1091	W994-R1087 HydrophobicContact CE3-CB 3.67Å; W994-R1087 HydrophobicContact CE3-CG 3.69Å; W994-R1087 HydrophobicContact CZ3-CB 3.81Å; W994-R1087 HydrophobicContact CZ3-CG 3.86Å; W994-R1087 PolarHBondContact O-NH1 2.63Å; I996-R1087 HydrophobicContact CD1-CB 3.89Å; Q1082-R1087 WeakPolarHBondContact O-CG 3.38Å; Q1082-R1087 PolarHBondContact O-N 3.02Å; V1083-R1087 WeakPolarHBondContact O-CB 3.36Å; Y1085-R1087 PolarHBondContact O-N 2.7Å; R1087-G1091 PolarHBondContact O-N 3.27Å; R1087-G1091 VanDerWaalsContact O-N 3.07Å
1088	M	86.8	Confident	86.4	Confident	8 Å²	8	23.7 Å²	23.7	4%	0.039	12%	0.118	C	C	.	.	H	α-helix	trans	-69.1	-48.4	-178.4	-59.5	-172.7	71.6	0	0	111	M991 I996 S1002 N1005 L1006 F1084 Y1085 F1086 L1090 G1091 I1092	M991-M1088 HydrophobicContact CG-CE 4.08Å; M991-M1088 HydrophobicContact SD-CE 3.64Å; I996-M1088 HydrophobicContact CD1-CG 3.84Å; I996-M1088 HydrophobicContact CG2-CG 4.31Å; I996-M1088 HydrophobicContact CG2-SD 4Å; S1002-M1088 WeakPolarHBondContact O-CE 3.37Å; N1005-M1088 HydrophobicContact CB-CB 4.16Å; N1005-M1088 HydrophobicContact CB-CE 3.68Å; N1005-M1088 HydrophobicContact CB-SD 3.65Å; L1006-M1088 HydrophobicContact CD2-CE 4.41Å; L1006-M1088 HydrophobicContact CG-CE 4.05Å; F1084-M1088 WeakPolarHBondContact O-CB 3.42Å; F1084-M1088 WeakPolarHBondContact O-CG 3.39Å; F1084-M1088 VanDerWaalsContact O-SD 3.4Å; Y1085-M1088 PolarHBondContact O-N 3.35Å; F1086-M1088 PolarHBondContact O-N 3.31Å; M1088-L1090 VanDerWaalsContact C-N 3.28Å; M1088-L1090 PolarHBondContact O-N 3.28Å; M1088-G1091 CarbonylContact O-C 3.55Å; M1088-G1091 WeakPolarHBondContact O-CA 3.45Å; M1088-G1091 PolarHBondContact O-N 2.96Å; M1088-I1092 WeakPolarHBondContact O-CG1 3.49Å; M1088-I1092 PolarHBondContact O-N 3.33Å
1089	Y	85.6	Confident	87	Confident	9 Å²	9	23.6 Å²	23.6	4%	0.035	12%	0.117	C	C	.	.	H	α-helix	trans	-59.2	-38.6	178.9	-67.9	-5	0	0	0	112.3	V541 F544 M1008 L1073 Y1085 I1092 V1093	V541-Y1089 VanDerWaalsContact CG1-OH 3.3Å; V541-Y1089 WeakPolarHBondContact CG1-OH 3.36Å; F544-Y1089 HydrophobicContact CD1-CD2 4.22Å; F544-Y1089 AromaticContact CD1-CE2 3.77Å; F544-Y1089 HydrophobicContact CD1-CE2 3.77Å; F544-Y1089 AromaticContact CE1-CD2 3.66Å; F544-Y1089 HydrophobicContact CE1-CD2 3.66Å; F544-Y1089 AromaticContact CE1-CE2 3.71Å; F544-Y1089 HydrophobicContact CE1-CE2 3.71Å; F544-Y1089 HydrophobicContact CE1-CG 4.41Å; F544-Y1089 HydrophobicContact CZ-CD2 4.16Å; F544-Y1089 HydrophobicContact CZ-CE2 4.49Å; M1008-Y1089 HydrophobicContact CE-CE1 4.23Å; M1008-Y1089 HydrophobicContact SD-CD1 4.06Å; M1008-Y1089 HydrophobicContact SD-CE1 3.52Å; M1008-Y1089 VanDerWaalsContact SD-CE1 3.52Å; L1073-Y1089 HydrophobicContact CD1-CD2 4.42Å; Y1085-Y1089 HydrophobicContact CD1-CE1 4.04Å; Y1085-Y1089 HydrophobicContact CD1-CE2 4.05Å; Y1085-Y1089 AromaticContact CD1-CZ 3.57Å; Y1085-Y1089 WeakPolarHBondContact CD1-OH 3.23Å; Y1085-Y1089 WeakPolarHBondContact O-CB 3.31Å; Y1085-Y1089 PolarHBondContact O-N 3.43Å; Y1089-I1092 HydrophobicContact CD1-CD1 4.16Å; Y1089-I1092 PolarHBondContact O-N 2.02Å; Y1089-V1093 WeakPolarHBondContact O-CG2 3.08Å; Y1089-V1093 PolarHBondContact O-N 3.46Å
1090	L	88.5	Confident	87.2	Confident	24 Å²	24	21.5 Å²	21.5	13%	0.126	11%	0.107	C	C	.	.	H	α-helix	trans	-61.8	-45.4	173.3	-177.7	61	0	0	0	111.3	W994 F1067 I1070 F1086 M1088 L1094	W994-L1090 HydrophobicContact CH2-CD2 4.19Å; F1067-L1090 HydrophobicContact CD2-CD1 4.22Å; F1067-L1090 HydrophobicContact CE2-CD1 4.13Å; I1070-L1090 HydrophobicContact CG2-CB 4.02Å; F1086-L1090 HydrophobicContact CE2-CD2 3.99Å; F1086-L1090 HydrophobicContact CZ-CD2 3.79Å; F1086-L1090 WeakPolarHBondContact O-CB 3.48Å; F1086-L1090 PolarHBondContact O-N 2.03Å; M1088-L1090 VanDerWaalsContact C-N 3.28Å; M1088-L1090 PolarHBondContact O-N 3.28Å; L1090-L1094 HydrophobicContact CD1-CD1 3.73Å; L1090-L1094 HydrophobicContact CD1-CG 4.06Å; L1090-L1094 HydrophobicContact CG-CD1 3.91Å; L1090-L1094 VanDerWaalsContact O-CB 3.31Å; L1090-L1094 WeakPolarHBondContact O-CB 3.34Å; L1090-L1094 VanDerWaalsContact O-CG 3.24Å; L1090-L1094 WeakPolarHBondContact O-CG 3.42Å; L1090-L1094 PolarHBondContact O-N 3.46Å
1091	G	87.3	Confident	87.6	Confident	2 Å²	2	20.3 Å²	20.3	2%	0.021	10%	0.101	C	C	.	.	H	α-helix	trans	-58.9	-46.6	172.6	0	0	0	0	0	113	R1087 M1088 V1093 L1094 F1095	R1087-G1091 PolarHBondContact O-N 3.27Å; R1087-G1091 VanDerWaalsContact O-N 3.07Å; M1088-G1091 CarbonylContact O-C 3.55Å; M1088-G1091 WeakPolarHBondContact O-CA 3.45Å; M1088-G1091 PolarHBondContact O-N 2.96Å; G1091-V1093 PolarHBondContact O-N 2.75Å; G1091-L1094 PolarHBondContact O-N 3.03Å; G1091-F1095 WeakPolarHBondContact O-CB 3.41Å; G1091-F1095 WeakPolarHBondContact O-CD1 3.29Å; G1091-F1095 WeakPolarHBondContact O-CG 3.42Å; G1091-F1095 PolarHBondContact O-N 3.11Å
1092	I	85.7	Confident	88.3	Confident	4 Å²	4	21.2 Å²	21.2	2%	0.021	11%	0.108	C	C	.	.	H	α-helix	trans	-59	-50.2	-179.6	-68.1	169.4	0	0	0	111	L987 N1005 V1009 I1023 M1088 Y1089 G1096	L987-I1092 HydrophobicContact CD1-CG1 4.06Å; L987-I1092 HydrophobicContact CD2-CG1 4.09Å; N1005-I1092 WeakPolarHBondContact O-CD1 3.28Å; V1009-I1092 HydrophobicContact CG2-CB 4.18Å; V1009-I1092 HydrophobicContact CG2-CD1 3.52Å; V1009-I1092 HydrophobicContact CG2-CG1 3.43Å; V1009-I1092 VanDerWaalsContact CG2-CG1 3.43Å; V1009-I1092 HydrophobicContact CG2-CG2 3.74Å; I1023-I1092 HydrophobicContact CG2-CG2 4.41Å; M1088-I1092 WeakPolarHBondContact O-CG1 3.49Å; M1088-I1092 PolarHBondContact O-N 3.33Å; Y1089-I1092 HydrophobicContact CD1-CD1 4.16Å; Y1089-I1092 PolarHBondContact O-N 2.02Å; I1092-G1096 WeakPolarHBondContact O-CA 3.41Å; I1092-G1096 PolarHBondContact O-N 2.83Å
1093	V	85.4	Confident	88.7	Confident	9 Å²	9	19.8 Å²	19.8	6%	0.055	10%	0.101	C	C	.	.	H	α-helix	trans	-70.2	-43	-177.8	173.9	0	0	0	0	111.3	T1063 K1066 I1070 Y1089 G1091 A1097	T1063-V1093 HydrophobicContact CG2-CG1 4.17Å; K1066-V1093 HydrophobicContact CB-CG1 4.22Å; K1066-V1093 HydrophobicContact CB-CG2 3.75Å; K1066-V1093 HydrophobicContact CG-CG2 4.4Å; I1070-V1093 HydrophobicContact CD1-CB 4.3Å; I1070-V1093 HydrophobicContact CD1-CG2 3.59Å; Y1089-V1093 WeakPolarHBondContact O-CG2 3.08Å; Y1089-V1093 PolarHBondContact O-N 3.46Å; G1091-V1093 PolarHBondContact O-N 2.75Å; V1093-A1097 WeakPolarHBondContact O-CB 3.41Å; V1093-A1097 PolarHBondContact O-N 2.85Å
1094	L	90.3	Very high	88.9	Confident	81 Å²	81	18.9 Å²	18.9	42%	0.424	10%	0.096	S	C	.	.	H	α-helix	trans	-68	-41.3	179	-68.7	177.7	0	0	0	112.1	L1090 G1091 A1098	L1090-L1094 HydrophobicContact CD1-CD1 3.73Å; L1090-L1094 HydrophobicContact CD1-CG 4.06Å; L1090-L1094 HydrophobicContact CG-CD1 3.91Å; L1090-L1094 VanDerWaalsContact O-CB 3.31Å; L1090-L1094 WeakPolarHBondContact O-CB 3.34Å; L1090-L1094 VanDerWaalsContact O-CG 3.24Å; L1090-L1094 WeakPolarHBondContact O-CG 3.42Å; L1090-L1094 PolarHBondContact O-N 3.46Å; G1091-L1094 PolarHBondContact O-N 3.03Å; L1094-A1098 WeakPolarHBondContact O-CB 2.92Å; L1094-A1098 PolarHBondContact O-N 3.48Å
1095	F	90.6	Very high	89.3	Confident	24 Å²	24	18.9 Å²	18.9	11%	0.105	10%	0.096	C	C	.	.	H	α-helix	trans	-77.1	-37.7	-179.1	-63.5	4.4	0	0	0	111	W694 I983 N986 L987 L990 G1091 A1098 H1099	W694-F1095 AromaticContact CH2-CD1 3.79Å; W694-F1095 HydrophobicContact CH2-CD1 3.79Å; W694-F1095 AromaticContact CH2-CE1 3.81Å; W694-F1095 HydrophobicContact CH2-CE1 3.81Å; W694-F1095 HydrophobicContact CH2-CG 4.3Å; W694-F1095 HydrophobicContact CH2-CZ 4.31Å; W694-F1095 AromaticContact CZ2-CD1 3.9Å; W694-F1095 HydrophobicContact CZ2-CD1 3.9Å; W694-F1095 HydrophobicContact CZ2-CD2 4.26Å; W694-F1095 AromaticContact CZ2-CE1 3.56Å; W694-F1095 HydrophobicContact CZ2-CE1 3.56Å; W694-F1095 AromaticContact CZ2-CE2 3.94Å; W694-F1095 HydrophobicContact CZ2-CE2 3.94Å; W694-F1095 HydrophobicContact CZ2-CG 4.26Å; W694-F1095 AromaticContact CZ2-CZ 3.6Å; W694-F1095 HydrophobicContact CZ2-CZ 3.6Å; I983-F1095 HydrophobicContact CG2-CB 4.5Å; N986-F1095 HydrophobicContact CB-CD2 4.04Å; N986-F1095 HydrophobicContact CB-CE2 4.27Å; N986-F1095 WeakPolarHBondContact O-CE2 3.22Å; L987-F1095 HydrophobicContact CD2-CD2 3.59Å; L987-F1095 HydrophobicContact CD2-CE2 4.03Å; L987-F1095 HydrophobicContact CD2-CG 4.34Å; L987-F1095 HydrophobicContact CG-CD2 3.92Å; L990-F1095 HydrophobicContact CB-CE2 3.77Å; L990-F1095 HydrophobicContact CB-CZ 3.97Å; L990-F1095 HydrophobicContact CD1-CZ 4.2Å; L990-F1095 HydrophobicContact CD2-CE2 3.91Å; L990-F1095 HydrophobicContact CD2-CZ 3.77Å; L990-F1095 HydrophobicContact CG-CE2 4.37Å; L990-F1095 HydrophobicContact CG-CZ 4.2Å; G1091-F1095 WeakPolarHBondContact O-CB 3.41Å; G1091-F1095 WeakPolarHBondContact O-CD1 3.29Å; G1091-F1095 WeakPolarHBondContact O-CG 3.42Å; G1091-F1095 PolarHBondContact O-N 3.11Å; F1095-A1098 PolarHBondContact O-N 3.06Å; F1095-H1099 WeakPolarHBondContact O-CB 3.43Å; F1095-H1099 PolarHBondContact O-N 3.38Å; F1095-H1099 PolarHBondContact O-ND1 2.74Å
1096	G	87.2	Confident	89.7	Confident	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-58.8	-49.7	171.4	0	0	0	0	0	111.8	I1092 A1098 H1099 G1100	I1092-G1096 WeakPolarHBondContact O-CA 3.41Å; I1092-G1096 PolarHBondContact O-N 2.83Å; G1096-A1098 PolarHBondContact O-N 2.75Å; G1096-H1099 PolarHBondContact O-N 2.81Å; G1096-G1100 PolarHBondContact O-N 3.43Å
1097	A	89.1	Confident	89.9	Confident	11 Å²	11	18.5 Å²	18.5	9%	0.091	9%	0.094	C	C	.	.	H	α-helix	trans	-62.9	-41.8	175.2	0	0	0	0	0	112.5	F1027 T1063 V1093 L1101	F1027-A1097 HydrophobicContact CD1-CB 4.44Å; F1027-A1097 VanDerWaalsContact CE1-CA 3.46Å; F1027-A1097 HydrophobicContact CE1-CB 3.71Å; F1027-A1097 HydrophobicContact CZ-CB 4.17Å; T1063-A1097 HydrophobicContact CG2-CB 3.72Å; V1093-A1097 WeakPolarHBondContact O-CB 3.41Å; V1093-A1097 PolarHBondContact O-N 2.85Å; A1097-L1101 HydrophobicContact CB-CD1 4.46Å; A1097-L1101 VanDerWaalsContact O-CB 3.26Å; A1097-L1101 WeakPolarHBondContact O-CB 3.49Å; A1097-L1101 PolarHBondContact O-N 3.22Å
1098	A	92.6	Very high	89.9	Confident	22 Å²	22	14.8 Å²	14.8	18%	0.182	8%	0.08	C	C	.	.	I	π-helix	trans	-63.9	-43.6	177	0	0	0	0	0	112.2	F691 L1094 F1095 G1096 V1102 F1103	F691-A1098 HydrophobicContact CE1-CB 4.36Å; F691-A1098 HydrophobicContact CZ-CB 4.13Å; L1094-A1098 WeakPolarHBondContact O-CB 2.92Å; L1094-A1098 PolarHBondContact O-N 3.48Å; F1095-A1098 PolarHBondContact O-N 3.06Å; G1096-A1098 PolarHBondContact O-N 2.75Å; A1098-V1102 WeakPolarHBondContact O-CA 3.06Å; A1098-V1102 WeakPolarHBondContact O-CB 3Å; A1098-V1102 PolarHBondContact O-N 3.28Å; A1098-F1103 PolarHBondContact O-N 2.86Å; A1098-F1103 VanDerWaalsContact O-N 3.16Å
1099	H	91.2	Very high	90	Very high	1 Å²	1	14.9 Å²	14.9	1%	0.005	8%	0.082	C	C	.	.	I	π-helix	trans	-72.9	-40.6	179.2	-72.4	75.6	0	0	0	111.8	F691 V979 I983 N986 F1095 G1096 F1103 L1104	F691-H1099 AromaticContact CD1-CD2 3.88Å; F691-H1099 AromaticContact CD1-CE1 3.94Å; F691-H1099 AromaticContact CD1-NE2 3.64Å; F691-H1099 AromaticContact CE1-CD2 3.98Å; F691-H1099 AromaticContact CE1-CE1 3.78Å; F691-H1099 AromaticContact CE1-CG 3.92Å; F691-H1099 AromaticContact CE1-ND1 3.8Å; F691-H1099 AromaticContact CE1-NE2 3.89Å; V979-H1099 HydrophobicContact CG1-CB 4Å; I983-H1099 HydrophobicContact CD1-CB 3.7Å; I983-H1099 HydrophobicContact CG1-CB 3.5Å; I983-H1099 VanDerWaalsContact CG1-CB 3.5Å; N986-H1099 PolarHBondContact ND2-CE1 3.03Å; N986-H1099 VanDerWaalsContact ND2-CE1 3.29Å; N986-H1099 PolarHBondContact ND2-NE2 2.96Å; F1095-H1099 WeakPolarHBondContact O-CB 3.43Å; F1095-H1099 PolarHBondContact O-N 3.38Å; F1095-H1099 PolarHBondContact O-ND1 2.74Å; G1096-H1099 PolarHBondContact O-N 2.81Å; H1099-F1103 PolarHBondContact O-N 2.81Å; H1099-L1104 VanDerWaalsContact O-CB 3.23Å; H1099-L1104 WeakPolarHBondContact O-CB 3.4Å; H1099-L1104 PolarHBondContact O-N 3.09Å
1100	G	89.2	Confident	90.1	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.089	C	C	.	.	I	π-helix	trans	-71.4	-41.8	179.1	0	0	0	0	0	114.5	I1031 G1096 P1105	I1031-G1100 WeakPolarHBondContact CD1-O 3.3Å; G1096-G1100 PolarHBondContact O-N 3.43Å; G1100-P1105 WeakPolarHBondContact O-CD 3.38Å
1101	L	92.1	Very high	89.9	Confident	13 Å²	13	17.6 Å²	17.6	7%	0.068	10%	0.097	C	C	.	.	I	π-helix	trans	-98	-27	-173.6	-59.4	170.6	0	0	0	114	Y674 L678 I1031 L1051 V1058 L1059 A1097	Y674-L1101 PolarHBondContact OH-O 3.14Å; L678-L1101 VanDerWaalsContact CD2-O 3.31Å; L678-L1101 WeakPolarHBondContact CD2-O 3.02Å; I1031-L1101 HydrophobicContact CD1-CD2 3.89Å; L1051-L1101 HydrophobicContact CD1-CD2 4.35Å; V1058-L1101 HydrophobicContact CB-CD2 4.39Å; V1058-L1101 HydrophobicContact CG1-CD2 4.2Å; L1059-L1101 HydrophobicContact CB-CD1 4.11Å; L1059-L1101 HydrophobicContact CD1-CD1 3.95Å; A1097-L1101 HydrophobicContact CB-CD1 4.46Å; A1097-L1101 VanDerWaalsContact O-CB 3.26Å; A1097-L1101 WeakPolarHBondContact O-CB 3.49Å; A1097-L1101 PolarHBondContact O-N 3.22Å
1102	V	94.3	Very high	89.7	Confident	38 Å²	38	17.5 Å²	17.5	23%	0.23	10%	0.096	C	C	.	.	I	π-helix	trans	-102.6	-56.1	179.8	-167.3	0	0	0	0	111.6	Y674 L678 V687 F691 A1098 V1106	Y674-V1102 WeakPolarHBondContact OH-CG2 2.98Å; L678-V1102 HydrophobicContact CD1-CG1 3.73Å; V687-V1102 HydrophobicContact CG1-CG1 4.08Å; V687-V1102 HydrophobicContact CG2-CG1 4.12Å; F691-V1102 HydrophobicContact CE2-CB 4.38Å; F691-V1102 HydrophobicContact CE2-CG1 4.15Å; F691-V1102 HydrophobicContact CZ-CB 4.21Å; F691-V1102 HydrophobicContact CZ-CG1 4.47Å; A1098-V1102 WeakPolarHBondContact O-CA 3.06Å; A1098-V1102 WeakPolarHBondContact O-CB 3Å; A1098-V1102 PolarHBondContact O-N 3.28Å; V1102-V1106 VanDerWaalsContact O-CG2 3.29Å; V1102-V1106 WeakPolarHBondContact O-CG2 3.42Å
1103	F	93.5	Very high	89.4	Confident	24 Å²	24	17.4 Å²	17.4	11%	0.105	10%	0.095	C	C	.	.	I	π-helix	trans	-76.4	-49.8	-171.9	-179.2	-104.3	0	0	0	113	L688 F691 V979 A1098 H1099 V1106 F1107	L688-F1103 HydrophobicContact CD2-CD2 4.21Å; L688-F1103 HydrophobicContact CD2-CE2 3.64Å; L688-F1103 HydrophobicContact CD2-CZ 4.28Å; F691-F1103 HydrophobicContact CB-CD2 3.48Å; F691-F1103 VanDerWaalsContact CB-CD2 3.48Å; F691-F1103 HydrophobicContact CB-CE2 3.71Å; F691-F1103 HydrophobicContact CB-CG 4.34Å; F691-F1103 HydrophobicContact CD1-CB 3.82Å; F691-F1103 AromaticContact CD1-CD2 3.96Å; F691-F1103 HydrophobicContact CD1-CD2 3.96Å; F691-F1103 HydrophobicContact CD1-CG 4.01Å; F691-F1103 HydrophobicContact CD2-CB 4.36Å; F691-F1103 HydrophobicContact CD2-CD2 4.11Å; F691-F1103 HydrophobicContact CE1-CB 3.78Å; F691-F1103 HydrophobicContact CE1-CG 4.47Å; F691-F1103 HydrophobicContact CE2-CB 4.32Å; F691-F1103 HydrophobicContact CG-CB 4.1Å; F691-F1103 AromaticContact CG-CD2 3.59Å; F691-F1103 HydrophobicContact CG-CD2 3.59Å; F691-F1103 HydrophobicContact CG-CE2 4.34Å; F691-F1103 HydrophobicContact CG-CG 4.1Å; F691-F1103 HydrophobicContact CZ-CB 4.03Å; V979-F1103 HydrophobicContact CG1-CD1 4.44Å; V979-F1103 HydrophobicContact CG2-CD1 4.11Å; V979-F1103 HydrophobicContact CG2-CE1 4.02Å; A1098-F1103 PolarHBondContact O-N 2.86Å; A1098-F1103 VanDerWaalsContact O-N 3.16Å; H1099-F1103 PolarHBondContact O-N 2.81Å; F1103-V1106 PolarHBondContact O-N 3.17Å; F1103-F1107 HydrophobicContact CD1-CB 4.48Å; F1103-F1107 HydrophobicContact CE1-CB 4.25Å; F1103-F1107 HydrophobicContact CE1-CD2 4.44Å; F1103-F1107 HydrophobicContact CE1-CG 4.22Å; F1103-F1107 HydrophobicContact CZ-CB 4.45Å; F1103-F1107 HydrophobicContact CZ-CD2 4.13Å; F1103-F1107 HydrophobicContact CZ-CG 4.34Å; F1103-F1107 WeakPolarHBondContact O-CB 3.44Å; F1103-F1107 PolarHBondContact O-N 2.68Å
1104	L	91.5	Very high	88.9	Confident	0 Å²	0	21.7 Å²	21.7	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-59.4	-45.1	-173.9	171.8	66.8	0	0	0	113.5	I975 V979 C1028 I1031 H1099 V1106 F1107 L1108	I975-L1104 HydrophobicContact CG2-CD1 3.88Å; V979-L1104 HydrophobicContact CG2-CD1 4.1Å; C1028-L1104 HydrophobicContact CB-CD2 4.2Å; I1031-L1104 HydrophobicContact CB-CD2 3.95Å; I1031-L1104 HydrophobicContact CG2-CD2 3.92Å; I1031-L1104 HydrophobicContact CG2-CG 4.26Å; H1099-L1104 VanDerWaalsContact O-CB 3.23Å; H1099-L1104 WeakPolarHBondContact O-CB 3.4Å; H1099-L1104 PolarHBondContact O-N 3.09Å; L1104-V1106 PolarHBondContact O-N 2.84Å; L1104-F1107 PolarHBondContact O-N 3.21Å; L1104-L1108 HydrophobicContact CD1-CD1 3.72Å; L1104-L1108 HydrophobicContact CD1-CD2 4.46Å; L1104-L1108 HydrophobicContact CD1-CG 3.81Å; L1104-L1108 HydrophobicContact CG-CD1 3.84Å; L1104-L1108 HydrophobicContact CG-CG 4.35Å; L1104-L1108 WeakPolarHBondContact O-CB 3.16Å; L1104-L1108 VanDerWaalsContact O-CG 3.27Å; L1104-L1108 WeakPolarHBondContact O-CG 3.04Å; L1104-L1108 PolarHBondContact O-N 2.92Å
1105	P	93	Very high	88.1	Confident	1 Å²	1	19.9 Å²	19.9	1%	0.006	11%	0.114	C	C	.	.	H	α-helix	trans	-63.5	-43.6	176.4	-22.2	35.1	0	0	0	111.5	L678 S1047 L1051 G1100 F1107 L1108 S1109	L678-P1105 HydrophobicContact CD2-CB 4.47Å; S1047-P1105 WeakPolarHBondContact OG-CA 3.44Å; S1047-P1105 WeakPolarHBondContact OG-CB 3.45Å; S1047-P1105 PolarHBondContact OG-O 3.1Å; L1051-P1105 HydrophobicContact CD1-CG 4.08Å; L1051-P1105 HydrophobicContact CD2-CB 4.23Å; L1051-P1105 HydrophobicContact CD2-CG 4.21Å; G1100-P1105 WeakPolarHBondContact O-CD 3.38Å; P1105-F1107 VanDerWaalsContact C-N 3.34Å; P1105-F1107 PolarHBondContact O-N 2.64Å; P1105-L1108 PolarHBondContact O-N 2.91Å; P1105-S1109 WeakPolarHBondContact O-CB 3.44Å; P1105-S1109 PolarHBondContact O-N 3.42Å
1106	V	92.7	Very high	87.2	Confident	0 Å²	0	21 Å²	21	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-59.4	-46.3	176	173.4	0	0	0	0	110.9	L678 R684 V687 L688 V1102 F1103 L1104 S1109 F1110	L678-V1106 HydrophobicContact CD1-CG2 3.67Å; L678-V1106 HydrophobicContact CD2-CG2 4.43Å; L678-V1106 HydrophobicContact CG-CG2 3.84Å; R684-V1106 HydrophobicContact CB-CG1 3.84Å; R684-V1106 HydrophobicContact CG-CG1 4.1Å; R684-V1106 HydrophobicContact CG-CG2 4.17Å; R684-V1106 VanDerWaalsContact O-CG1 3.24Å; R684-V1106 WeakPolarHBondContact O-CG1 3.35Å; V687-V1106 HydrophobicContact CB-CG1 4.28Å; V687-V1106 HydrophobicContact CB-CG2 4.36Å; V687-V1106 HydrophobicContact CG1-CB 4.14Å; V687-V1106 HydrophobicContact CG1-CG1 4.16Å; V687-V1106 HydrophobicContact CG1-CG2 4.06Å; L688-V1106 HydrophobicContact CD2-CG1 4.12Å; L688-V1106 HydrophobicContact CG-CG1 3.95Å; V1102-V1106 VanDerWaalsContact O-CG2 3.29Å; V1102-V1106 WeakPolarHBondContact O-CG2 3.42Å; F1103-V1106 PolarHBondContact O-N 3.17Å; L1104-V1106 PolarHBondContact O-N 2.84Å; V1106-S1109 PolarHBondContact O-N 3.28Å; V1106-S1109 PolarHBondContact O-OG 3.11Å; V1106-F1110 HydrophobicContact CG1-CE2 4.32Å; V1106-F1110 VanDerWaalsContact O-CD2 3.32Å; V1106-F1110 WeakPolarHBondContact O-CD2 3.45Å
1107	F	91	Very high	86.4	Confident	39 Å²	39	24.7 Å²	24.7	17%	0.171	14%	0.137	C	C	.	.	H	α-helix	trans	-64.2	-46.6	178.4	-170.7	-115.9	0	0	0	112.2	L688 I975 V979 F1103 L1104 P1105 S1109 F1110 V1111	L688-F1107 HydrophobicContact CD2-CB 4.44Å; L688-F1107 HydrophobicContact CD2-CD2 4.13Å; I975-F1107 HydrophobicContact CB-CE1 4.48Å; I975-F1107 HydrophobicContact CG1-CE1 4.1Å; I975-F1107 HydrophobicContact CG2-CD1 3.97Å; I975-F1107 HydrophobicContact CG2-CE1 4.03Å; V979-F1107 HydrophobicContact CG2-CD1 4.43Å; F1103-F1107 HydrophobicContact CD1-CB 4.48Å; F1103-F1107 HydrophobicContact CE1-CB 4.25Å; F1103-F1107 HydrophobicContact CE1-CD2 4.44Å; F1103-F1107 HydrophobicContact CE1-CG 4.22Å; F1103-F1107 HydrophobicContact CZ-CB 4.45Å; F1103-F1107 HydrophobicContact CZ-CD2 4.13Å; F1103-F1107 HydrophobicContact CZ-CG 4.34Å; F1103-F1107 WeakPolarHBondContact O-CB 3.44Å; F1103-F1107 PolarHBondContact O-N 2.68Å; L1104-F1107 PolarHBondContact O-N 3.21Å; P1105-F1107 VanDerWaalsContact C-N 3.34Å; P1105-F1107 PolarHBondContact O-N 2.64Å; F1107-S1109 VanDerWaalsContact C-N 3.3Å; F1107-S1109 PolarHBondContact O-N 2.78Å; F1107-F1110 PolarHBondContact O-N 3Å; F1107-F1110 VanDerWaalsContact O-N 3.13Å; F1107-V1111 HydrophobicContact CD2-CG2 4.14Å; F1107-V1111 HydrophobicContact CE2-CB 4.41Å; F1107-V1111 HydrophobicContact CE2-CG2 3.89Å; F1107-V1111 HydrophobicContact CZ-CB 4.35Å; F1107-V1111 HydrophobicContact CZ-CG1 4.29Å; F1107-V1111 HydrophobicContact CZ-CG2 4.26Å; F1107-V1111 PolarHBondContact O-N 3.38Å
1108	L	89.9	Confident	85.5	Confident	1 Å²	1	25.2 Å²	25.2	1%	0.005	14%	0.138	C	C	.	.	H	α-helix	trans	-58.6	-38.4	173.9	-75.1	169.7	0	0	0	112.3	I975 I1031 F1035 L1104 P1105 F1110 V1111 G1112	I975-L1108 HydrophobicContact CD1-CD2 4.04Å; I975-L1108 HydrophobicContact CG2-CD2 4.15Å; I1031-L1108 HydrophobicContact CG2-CD1 4.28Å; F1035-L1108 HydrophobicContact CB-CD1 3.99Å; F1035-L1108 HydrophobicContact CD1-CD2 4.02Å; F1035-L1108 HydrophobicContact CD2-CB 3.82Å; F1035-L1108 HydrophobicContact CD2-CD1 4.09Å; F1035-L1108 HydrophobicContact CD2-CD2 4.43Å; F1035-L1108 HydrophobicContact CD2-CG 4.35Å; F1035-L1108 HydrophobicContact CE1-CD2 4.35Å; F1035-L1108 HydrophobicContact CE2-CB 3.77Å; F1035-L1108 HydrophobicContact CG-CB 4.31Å; F1035-L1108 HydrophobicContact CG-CD1 4.05Å; F1035-L1108 HydrophobicContact CG-CD2 4.08Å; F1035-L1108 HydrophobicContact CG-CG 4.39Å; F1035-L1108 HydrophobicContact CZ-CB 4.25Å; F1035-L1108 WeakPolarHBondContact CZ-O 3.31Å; L1104-L1108 HydrophobicContact CD1-CD1 3.72Å; L1104-L1108 HydrophobicContact CD1-CD2 4.46Å; L1104-L1108 HydrophobicContact CD1-CG 3.81Å; L1104-L1108 HydrophobicContact CG-CD1 3.84Å; L1104-L1108 HydrophobicContact CG-CG 4.35Å; L1104-L1108 WeakPolarHBondContact O-CB 3.16Å; L1104-L1108 VanDerWaalsContact O-CG 3.27Å; L1104-L1108 WeakPolarHBondContact O-CG 3.04Å; L1104-L1108 PolarHBondContact O-N 2.92Å; P1105-L1108 PolarHBondContact O-N 2.91Å; L1108-F1110 PolarHBondContact O-N 3.44Å; L1108-F1110 VanDerWaalsContact O-N 3.15Å; L1108-V1111 PolarHBondContact O-N 3.5Å; L1108-G1112 WeakPolarHBondContact O-CA 3.48Å; L1108-G1112 PolarHBondContact O-N 2.77Å
1109	S	90.3	Very high	84.4	Confident	9 Å²	9	26.1 Å²	26.1	6%	0.063	14%	0.138	C	C	.	.	H	α-helix	trans	-62.7	-21	178.5	83.2	0	0	0	0	114	R684 R1043 P1105 V1106 F1107	R684-S1109 WeakPolarHBondContact CD-OG 3.35Å; R684-S1109 PolarHBondContact NH1-OG 2.98Å; R1043-S1109 WeakPolarHBondContact CB-O 3.28Å; P1105-S1109 WeakPolarHBondContact O-CB 3.44Å; P1105-S1109 PolarHBondContact O-N 3.42Å; V1106-S1109 PolarHBondContact O-N 3.28Å; V1106-S1109 PolarHBondContact O-OG 3.11Å; F1107-S1109 VanDerWaalsContact C-N 3.3Å; F1107-S1109 PolarHBondContact O-N 2.78Å
1110	F	86.3	Confident	83.5	Confident	42 Å²	42	28.4 Å²	28.4	18%	0.184	15%	0.15	C	C	.	.	H	α-helix	trans	-99.7	-50.3	171.7	-70.8	-77.1	0	0	0	112.4	R684 V685 L688 R1043 V1106 F1107 L1108	R684-F1110 HydrophobicContact CB-CE2 3.95Å; R684-F1110 HydrophobicContact CB-CZ 4.26Å; V685-F1110 HydrophobicContact CG2-CZ 4.44Å; L688-F1110 HydrophobicContact CD1-CD2 3.66Å; L688-F1110 HydrophobicContact CD1-CE2 3.6Å; L688-F1110 HydrophobicContact CD1-CZ 4.48Å; L688-F1110 HydrophobicContact CG-CE2 4.49Å; R1043-F1110 WeakPolarHBondContact CD-O 3.16Å; R1043-F1110 PolarHBondContact NH1-O 3.33Å; V1106-F1110 HydrophobicContact CG1-CE2 4.32Å; V1106-F1110 VanDerWaalsContact O-CD2 3.32Å; V1106-F1110 WeakPolarHBondContact O-CD2 3.45Å; F1107-F1110 PolarHBondContact O-N 3Å; F1107-F1110 VanDerWaalsContact O-N 3.13Å; L1108-F1110 PolarHBondContact O-N 3.44Å; L1108-F1110 VanDerWaalsContact O-N 3.15Å
1111	V	85.2	Confident	82.5	Confident	48 Å²	48	32.1 Å²	32.1	29%	0.291	16%	0.164	S	C	.	.	H	α-helix	trans	-107.3	-13.9	-161.7	-170.8	0	0	0	0	113.3	W971 F1107 L1108	W971-V1111 HydrophobicContact CZ2-CG1 3.87Å; W971-V1111 PolarHBondContact NE1-O 2.67Å; F1107-V1111 HydrophobicContact CD2-CG2 4.14Å; F1107-V1111 HydrophobicContact CE2-CB 4.41Å; F1107-V1111 HydrophobicContact CE2-CG2 3.89Å; F1107-V1111 HydrophobicContact CZ-CB 4.35Å; F1107-V1111 HydrophobicContact CZ-CG1 4.29Å; F1107-V1111 HydrophobicContact CZ-CG2 4.26Å; F1107-V1111 PolarHBondContact O-N 3.38Å; L1108-V1111 PolarHBondContact O-N 3.5Å
1112	G	81.6	Confident	81.4	Confident	0 Å²	0	35 Å²	35	0%	0	18%	0.178	C	C	.	.	P	Polyproline II helix	trans	-54.3	158.4	-170.6	0	0	0	0	0	115.6	R1043 L1108	R1043-G1112 PolarHBondContact NE-O 3.2Å; R1043-G1112 PolarHBondContact NH2-O 3.42Å; L1108-G1112 WeakPolarHBondContact O-CA 3.48Å; L1108-G1112 PolarHBondContact O-N 2.77Å
1113	P	80.3	Confident	80.3	Confident	3 Å²	3	38.2 Å²	38.2	2%	0.019	19%	0.188	C	C	.	.	P	Polyproline II helix	trans	-52.6	151.1	-174.6	24.8	-39	0	0	0	113.2	D969 S972 F1035 R1046	D969-P1113 WeakPolarHBondContact OD2-CB 3.06Å; S972-P1113 WeakPolarHBondContact OG-CG 3.33Å; F1035-P1113 HydrophobicContact CD1-CG 3.88Å; F1035-P1113 HydrophobicContact CE1-CG 3.9Å; R1046-P1113 PolarHBondContact NH1-O 2.77Å; R1046-P1113 PolarHBondContact NH2-O 3.19Å
1114	P	76	Confident	79.2	Confident	99 Å²	99	39.3 Å²	39.3	64%	0.643	19%	0.194	S	C	*	.	P	Polyproline II helix	trans	-59.1	163	169.7	29.1	-35.3	0	0	0	110.9
1115	L	73.2	Confident	78.2	Confident	42 Å²	42	41.6 Å²	41.6	22%	0.22	21%	0.209	C	C	.	.	P	Polyproline II helix	trans	-76.5	131.5	-176.4	-155.2	147.5	0	0	0	110.4	V1039 C1040 K1117 I1120	V1039-L1115 HydrophobicContact CG1-CD2 4.29Å; C1040-L1115 WeakPolarHBondContact O-CD1 3.44Å; L1115-K1117 PolarHBondContact O-N 3.1Å; L1115-K1117 VanDerWaalsContact O-N 3.07Å; L1115-I1120 HydrophobicContact CD2-CD1 3.58Å; L1115-I1120 HydrophobicContact CD2-CG1 3.29Å
1116	N	71.1	Confident	77	Confident	49 Å²	49	44.5 Å²	44.5	26%	0.262	23%	0.229	S	C	.	.			trans	-72	105.9	-174.6	-173.7	-24.3	0	0	0	111.1	L1118 K1119 I1120	N1116-L1118 PolarHBondContact O-N 2.86Å; N1116-L1118 VanDerWaalsContact O-N 3.12Å; N1116-L1118 PolarHBondContact OD1-N 2.82Å; N1116-K1119 HydrophobicContact CB-CB 4.38Å; N1116-K1119 HydrophobicContact CB-CG 4.36Å; N1116-K1119 PolarHBondContact O-N 2.68Å; N1116-I1120 PolarHBondContact O-N 2.96Å
1117	K	69.5	Low	76	Confident	77 Å²	77	48.6 Å²	48.6	34%	0.335	25%	0.251	S	S	.	.	H	α-helix	trans	-42.2	-44.5	176.5	-78.3	-166.9	172.2	-176.2	0	113.5	L165 D169 V170 L1115 I1120 Y1121	L165-K1117 HydrophobicContact CD2-CB 3.52Å; L165-K1117 HydrophobicContact CD2-CD 3.66Å; L165-K1117 HydrophobicContact CD2-CG 3.54Å; D169-K1117 PolarHBondContact O-NZ 2.75Å; D169-K1117 IonicContact OD2-NZ 3.79Å; D169-K1117 PolarHBondContact OD2-NZ 2.9Å; V170-K1117 HydrophobicContact CG2-CB 4.36Å; V170-K1117 HydrophobicContact CG2-CD 4.11Å; L1115-K1117 PolarHBondContact O-N 3.1Å; L1115-K1117 VanDerWaalsContact O-N 3.07Å; K1117-I1120 WeakPolarHBondContact O-CB 3.31Å; K1117-I1120 PolarHBondContact O-N 3.46Å; K1117-Y1121 PolarHBondContact O-N 2.96Å; K1117-Y1121 VanDerWaalsContact O-N 3.08Å
1118	L	70.3	Confident	75.1	Confident	22 Å²	22	50.1 Å²	50.1	12%	0.115	26%	0.26	C	S	.	.	H	α-helix	trans	-70.3	-32	-177.2	-70.8	167.5	0	0	0	113	V170 T174 F178 N1116 Y1121 Q1122	V170-L1118 HydrophobicContact CG1-CD1 3.84Å; V170-L1118 HydrophobicContact CG1-CD2 4.31Å; V170-L1118 HydrophobicContact CG1-CG 3.92Å; T174-L1118 WeakPolarHBondContact O-CD1 3.36Å; F178-L1118 HydrophobicContact CB-CB 4.43Å; F178-L1118 HydrophobicContact CB-CD1 3.54Å; F178-L1118 HydrophobicContact CD1-CD1 4.33Å; F178-L1118 HydrophobicContact CD2-CB 3.75Å; F178-L1118 HydrophobicContact CD2-CD1 4.4Å; F178-L1118 HydrophobicContact CE2-CB 4.14Å; F178-L1118 HydrophobicContact CG-CB 4.02Å; F178-L1118 HydrophobicContact CG-CD1 3.85Å; N1116-L1118 PolarHBondContact O-N 2.86Å; N1116-L1118 VanDerWaalsContact O-N 3.12Å; N1116-L1118 PolarHBondContact OD1-N 2.82Å; L1118-Y1121 PolarHBondContact O-N 2.88Å; L1118-Q1122 WeakPolarHBondContact O-CB 3.26Å; L1118-Q1122 PolarHBondContact O-N 3.15Å
1119	K	71	Confident	74	Confident	40 Å²	40	54.8 Å²	54.8	17%	0.174	28%	0.278	C	S	.	.	H	α-helix	trans	-74.9	-28.1	175.7	-66.4	-168.3	173.7	-174.6	0	112.2	F178 D181 N1116 K1123	F178-K1119 HydrophobicContact CD2-CG 4.44Å; F178-K1119 HydrophobicContact CE2-CG 4.37Å; D181-K1119 WeakPolarHBondContact OD2-CE 3.43Å; D181-K1119 IonicContact OD2-NZ 2.59Å; D181-K1119 PolarHBondContact OD2-NZ 3Å; N1116-K1119 HydrophobicContact CB-CB 4.38Å; N1116-K1119 HydrophobicContact CB-CG 4.36Å; N1116-K1119 PolarHBondContact O-N 2.68Å; K1119-K1123 WeakPolarHBondContact O-CB 3.24Å; K1119-K1123 PolarHBondContact O-N 3.12Å; K1119-K1123 VanDerWaalsContact O-N 3.09Å
1120	I	71.3	Confident	72.9	Confident	49 Å²	49	57.9 Å²	57.9	25%	0.251	29%	0.294	S	S	.	.	H	α-helix	trans	-62.3	-52.6	165.1	-46.5	173.5	0	0	0	109.6	V1039 L1115 N1116 K1117 Q1122 K1123 Q1124	V1039-I1120 HydrophobicContact CG1-CG1 4.36Å; L1115-I1120 HydrophobicContact CD2-CD1 3.58Å; L1115-I1120 HydrophobicContact CD2-CG1 3.29Å; N1116-I1120 PolarHBondContact O-N 2.96Å; K1117-I1120 WeakPolarHBondContact O-CB 3.31Å; K1117-I1120 PolarHBondContact O-N 3.46Å; I1120-Q1122 PolarHBondContact O-N 2.99Å; I1120-K1123 PolarHBondContact O-N 3.22Å; I1120-K1123 VanDerWaalsContact O-N 3.14Å; I1120-Q1124 HydrophobicContact CG2-CG 4.16Å; I1120-Q1124 WeakPolarHBondContact O-CB 3.44Å; I1120-Q1124 WeakPolarHBondContact O-CG 3.3Å; I1120-Q1124 PolarHBondContact O-N 3.28Å
1121	Y	68.2	Low	72	Confident	78 Å²	78	58.1 Å²	58.1	31%	0.306	30%	0.303	S	S	.	.	H	α-helix	trans	-57.9	-47.4	-177.4	-177.1	-85.4	0	0	0	111.6	L164 L165 K1117 L1118 K1123 Q1124 C1125	L164-Y1121 HydrophobicContact CD2-CE2 3.85Å; L164-Y1121 HydrophobicContact CG-CE2 4.03Å; L165-Y1121 HydrophobicContact CB-CD2 4.3Å; L165-Y1121 WeakPolarHBondContact O-CD2 3.34Å; K1117-Y1121 PolarHBondContact O-N 2.96Å; K1117-Y1121 VanDerWaalsContact O-N 3.08Å; L1118-Y1121 PolarHBondContact O-N 2.88Å; Y1121-K1123 PolarHBondContact O-N 3.46Å; Y1121-Q1124 PolarHBondContact O-N 3.21Å; Y1121-C1125 VanDerWaalsContact CE1-SG 3.51Å; Y1121-C1125 PolarHBondContact O-N 2.85Å; Y1121-C1125 PolarHBondContact O-SG 2.93Å; Y1121-C1125 VanDerWaalsContact O-SG 3.36Å
1122	Q	70.1	Confident	71.1	Confident	74 Å²	74	61.4 Å²	61.4	35%	0.346	32%	0.316	S	S	.	.	H	α-helix	trans	-58.3	-46.8	174.9	-174	-177.6	9.3	0	0	111.7	F178 L1118 I1120 C1125 C1126	F178-Q1122 HydrophobicContact CZ-CB 4.43Å; L1118-Q1122 WeakPolarHBondContact O-CB 3.26Å; L1118-Q1122 PolarHBondContact O-N 3.15Å; I1120-Q1122 PolarHBondContact O-N 2.99Å; Q1122-C1125 PolarHBondContact O-N 2.99Å; Q1122-C1126 PolarHBondContact O-N 3.16Å; Q1122-C1126 PolarHBondContact O-SG 2.82Å; Q1122-C1126 VanDerWaalsContact O-SG 3.37Å
1123	K	70.4	Confident	69.8	Low	106 Å²	106	67 Å²	67	46%	0.461	34%	0.337	S	S	.	.	H	α-helix	trans	-63.1	-43.6	177.5	-175.9	171.6	-179.5	177.1	0	111.9	V1039 K1119 I1120 Y1121 C1125 C1126 D1127	V1039-K1123 HydrophobicContact CB-CD 4.13Å; V1039-K1123 HydrophobicContact CG1-CD 4.1Å; V1039-K1123 HydrophobicContact CG2-CD 4.19Å; K1119-K1123 WeakPolarHBondContact O-CB 3.24Å; K1119-K1123 PolarHBondContact O-N 3.12Å; K1119-K1123 VanDerWaalsContact O-N 3.09Å; I1120-K1123 PolarHBondContact O-N 3.22Å; I1120-K1123 VanDerWaalsContact O-N 3.14Å; Y1121-K1123 PolarHBondContact O-N 3.46Å; K1123-C1125 PolarHBondContact O-N 2.71Å; K1123-C1126 PolarHBondContact O-N 2.87Å; K1123-D1127 WeakPolarHBondContact CG-OD2 3.12Å; K1123-D1127 WeakPolarHBondContact O-CB 3.49Å; K1123-D1127 VanDerWaalsContact O-CG 3.29Å; K1123-D1127 PolarHBondContact O-N 3.46Å
1124	Q	69.3	Low	69	Low	47 Å²	47	74.8 Å²	74.8	22%	0.22	37%	0.373	C	S	.	.	H	α-helix	trans	-59	-45.1	174.6	-75.1	174.8	-30.3	0	0	111.6	I1120 Y1121 D1127 I1128	I1120-Q1124 HydrophobicContact CG2-CG 4.16Å; I1120-Q1124 WeakPolarHBondContact O-CB 3.44Å; I1120-Q1124 WeakPolarHBondContact O-CG 3.3Å; I1120-Q1124 PolarHBondContact O-N 3.28Å; Y1121-Q1124 PolarHBondContact O-N 3.21Å; Q1124-D1127 PolarHBondContact O-N 3.33Å; Q1124-I1128 VanDerWaalsContact O-CB 3.31Å; Q1124-I1128 WeakPolarHBondContact O-CB 3.46Å; Q1124-I1128 WeakPolarHBondContact O-CD1 3.48Å; Q1124-I1128 WeakPolarHBondContact O-CG1 3.16Å; Q1124-I1128 PolarHBondContact O-N 2.9Å
1125	C	70.8	Confident	68.3	Low	48 Å²	48	77.4 Å²	77.4	32%	0.324	38%	0.381	S	S	.	.	H	α-helix	trans	-62	-42.3	174.8	-70.4	0	0	0	0	112.4	Y1121 Q1122 K1123 Y1129	Y1121-C1125 VanDerWaalsContact CE1-SG 3.51Å; Y1121-C1125 PolarHBondContact O-N 2.85Å; Y1121-C1125 PolarHBondContact O-SG 2.93Å; Y1121-C1125 VanDerWaalsContact O-SG 3.36Å; Q1122-C1125 PolarHBondContact O-N 2.99Å; K1123-C1125 PolarHBondContact O-N 2.71Å; C1125-Y1129 VanDerWaalsContact O-CB 3.28Å; C1125-Y1129 WeakPolarHBondContact O-CB 3.36Å; C1125-Y1129 PolarHBondContact O-N 3.04Å
1126	C	68.9	Low	67.6	Low	62 Å²	62	78.5 Å²	78.5	42%	0.419	40%	0.396	S	S	.	.	H	α-helix	trans	-65.7	-41.6	175.1	-70.4	0	0	0	0	112.6	Q1122 K1123 Y1129 N1130	Q1122-C1126 PolarHBondContact O-N 3.16Å; Q1122-C1126 PolarHBondContact O-SG 2.82Å; Q1122-C1126 VanDerWaalsContact O-SG 3.37Å; K1123-C1126 PolarHBondContact O-N 2.87Å; C1126-Y1129 PolarHBondContact O-N 3.01Å; C1126-N1130 VanDerWaalsContact O-CB 3.27Å; C1126-N1130 WeakPolarHBondContact O-CB 3.28Å; C1126-N1130 PolarHBondContact O-N 2.89Å; C1126-N1130 PolarHBondContact O-ND2 2.83Å; C1126-N1130 VanDerWaalsContact O-ND2 3.11Å
1127	D	71.4	Confident	66.5	Low	85 Å²	85	79.2 Å²	79.2	46%	0.455	42%	0.415	S	S	.	.	H	α-helix	trans	-68.5	-38.8	178.6	-71.5	-20.9	0	0	0	111.1	K1123 Q1124 A1131	K1123-D1127 WeakPolarHBondContact CG-OD2 3.12Å; K1123-D1127 WeakPolarHBondContact O-CB 3.49Å; K1123-D1127 VanDerWaalsContact O-CG 3.29Å; K1123-D1127 PolarHBondContact O-N 3.46Å; Q1124-D1127 PolarHBondContact O-N 3.33Å; D1127-A1131 VanDerWaalsContact O-CB 3.27Å; D1127-A1131 WeakPolarHBondContact O-CB 3.35Å; D1127-A1131 PolarHBondContact O-N 3.37Å
1128	I	71.4	Confident	65.5	Low	71 Å²	71	80 Å²	80	36%	0.364	43%	0.426	S	S	.	.	H	α-helix	trans	-63.1	-47	171.3	-70.8	164.2	0	0	0	110.6	L164 Q1124 A1131 Q1132	L164-I1128 HydrophobicContact CD1-CD1 4.31Å; Q1124-I1128 VanDerWaalsContact O-CB 3.31Å; Q1124-I1128 WeakPolarHBondContact O-CB 3.46Å; Q1124-I1128 WeakPolarHBondContact O-CD1 3.48Å; Q1124-I1128 WeakPolarHBondContact O-CG1 3.16Å; Q1124-I1128 PolarHBondContact O-N 2.9Å; I1128-A1131 PolarHBondContact O-N 2.75Å; I1128-Q1132 HydrophobicContact CG2-CG 4.5Å; I1128-Q1132 WeakPolarHBondContact O-CB 3.46Å; I1128-Q1132 VanDerWaalsContact O-CG 3.3Å; I1128-Q1132 WeakPolarHBondContact O-CG 3.15Å; I1128-Q1132 PolarHBondContact O-N 3.44Å
1129	Y	67	Low	64	Low	100 Å²	100	87.7 Å²	87.7	39%	0.392	46%	0.461	S	S	.	.	H	α-helix	trans	-63.7	-41.7	178.2	-179.1	-98.2	0	0	0	112	C1125 C1126 Q1132 R1133	C1125-Y1129 VanDerWaalsContact O-CB 3.28Å; C1125-Y1129 WeakPolarHBondContact O-CB 3.36Å; C1125-Y1129 PolarHBondContact O-N 3.04Å; C1126-Y1129 PolarHBondContact O-N 3.01Å; Y1129-Q1132 PolarHBondContact O-N 3.36Å; Y1129-R1133 WeakPolarHBondContact O-CB 3.38Å; Y1129-R1133 PolarHBondContact O-N 2.89Å
1130	N	67.7	Low	62.3	Low	74 Å²	74	94 Å²	94	40%	0.396	49%	0.492	S	S	.	.	H	α-helix	trans	-66.5	-39.2	175.7	-75	-33.4	0	0	0	111.9	C1126 R1133 Q1134	C1126-N1130 VanDerWaalsContact O-CB 3.27Å; C1126-N1130 WeakPolarHBondContact O-CB 3.28Å; C1126-N1130 PolarHBondContact O-N 2.89Å; C1126-N1130 PolarHBondContact O-ND2 2.83Å; C1126-N1130 VanDerWaalsContact O-ND2 3.11Å; N1130-R1133 PolarHBondContact O-N 3.01Å; N1130-Q1134 WeakPolarHBondContact O-CG 3.3Å; N1130-Q1134 PolarHBondContact O-N 3.28Å
1131	A	66.6	Low	60.8	Low	46 Å²	46	98.8 Å²	98.8	38%	0.38	52%	0.516	S	S	.	.	H	α-helix	trans	-64.9	-42.6	173.1	0	0	0	0	0	111.9	D1127 I1128 Q1134 L1135	D1127-A1131 VanDerWaalsContact O-CB 3.27Å; D1127-A1131 WeakPolarHBondContact O-CB 3.35Å; D1127-A1131 PolarHBondContact O-N 3.37Å; I1128-A1131 PolarHBondContact O-N 2.75Å; A1131-Q1134 PolarHBondContact O-N 3.21Å; A1131-L1135 WeakPolarHBondContact O-CB 3.44Å; A1131-L1135 VanDerWaalsContact O-CG 3.28Å; A1131-L1135 WeakPolarHBondContact O-CG 3.44Å; A1131-L1135 PolarHBondContact O-N 3.44Å
1132	Q	66.6	Low	59.3	Low	118 Å²	118	99.7 Å²	99.7	55%	0.551	53%	0.534	S	S	*	.	H	α-helix	trans	-61	-42.3	172.8	-74.7	173.7	-6.5	0	0	111.6	I1128 Y1129 L1135 A1136	I1128-Q1132 HydrophobicContact CG2-CG 4.5Å; I1128-Q1132 WeakPolarHBondContact O-CB 3.46Å; I1128-Q1132 VanDerWaalsContact O-CG 3.3Å; I1128-Q1132 WeakPolarHBondContact O-CG 3.15Å; I1128-Q1132 PolarHBondContact O-N 3.44Å; Y1129-Q1132 PolarHBondContact O-N 3.36Å; Q1132-L1135 CarbonylContact O-C 3.52Å; Q1132-L1135 PolarHBondContact O-N 2.9Å; Q1132-A1136 WeakPolarHBondContact O-CB 3.46Å; Q1132-A1136 PolarHBondContact O-N 2.82Å
1133	R	54.8	Low	57.6	Low	116 Å²	116	98.8 Å²	98.8	44%	0.438	53%	0.534	S	S	.	.	H	α-helix	trans	-64.2	-40.7	176.4	-171.9	178	-178.2	-173.6	2	112.4	Y1129 N1130 L1135 A1136 G1137	Y1129-R1133 WeakPolarHBondContact O-CB 3.38Å; Y1129-R1133 PolarHBondContact O-N 2.89Å; N1130-R1133 PolarHBondContact O-N 3.01Å; R1133-L1135 VanDerWaalsContact C-N 3.35Å; R1133-A1136 PolarHBondContact O-N 3.44Å; R1133-G1137 PolarHBondContact O-N 2.89Å
1134	Q	62.4	Low	55.9	Low	167 Å²	167	96.9 Å²	96.9	78%	0.78	53%	0.534	S	S	*	.	H	α-helix	trans	-66	-35.3	173.3	-74.7	-179.4	1.3	0	0	112.4	N1130 A1131	N1130-Q1134 WeakPolarHBondContact O-CG 3.3Å; N1130-Q1134 PolarHBondContact O-N 3.28Å; A1131-Q1134 PolarHBondContact O-N 3.21Å
1135	L	63	Low	54.4	Low	155 Å²	155	98.8 Å²	98.8	81%	0.812	55%	0.546	S	S	*	.	H	α-helix	trans	-73.8	-28.7	174.8	-72.3	165.9	0	0	0	113.2	A1131 Q1132 R1133	A1131-L1135 WeakPolarHBondContact O-CB 3.44Å; A1131-L1135 VanDerWaalsContact O-CG 3.28Å; A1131-L1135 WeakPolarHBondContact O-CG 3.44Å; A1131-L1135 PolarHBondContact O-N 3.44Å; Q1132-L1135 CarbonylContact O-C 3.52Å; Q1132-L1135 PolarHBondContact O-N 2.9Å; R1133-L1135 VanDerWaalsContact C-N 3.35Å
1136	A	58.3	Low	52.7	Low	64 Å²	64	102.3 Å²	102.3	53%	0.529	56%	0.561	S	S	.	*	H	α-helix	trans	-77.1	-20.4	-178.4	0	0	0	0	0	114.1	Q1132 R1133 T1138	Q1132-A1136 WeakPolarHBondContact O-CB 3.46Å; Q1132-A1136 PolarHBondContact O-N 2.82Å; R1133-A1136 PolarHBondContact O-N 3.44Å; A1136-T1138 PolarHBondContact O-N 3.01Å; A1136-T1138 VanDerWaalsContact O-N 3.12Å
1137	G	48.4	Very low	51	Low	64 Å²	64	105.5 Å²	105.5	66%	0.66	57%	0.574	S	S	*	*			trans	67.9	7.6	173.8	0	0	0	0	0	116.2	R1133 E1139	R1133-G1137 PolarHBondContact O-N 2.89Å; G1137-E1139 PolarHBondContact O-N 3.35Å
1138	T	47.2	Very low	49.3	Very low	94 Å²	94	105.1 Å²	105.1	58%	0.577	58%	0.575	S	S	*	*			trans	-85.3	92.2	-175.5	51.8	0	0	0	0	112.6	A1136 Q1140	A1136-T1138 PolarHBondContact O-N 3.01Å; A1136-T1138 VanDerWaalsContact O-N 3.12Å; T1138-Q1140 PolarHBondContact O-N 3.37Å
1139	E	40.1	Very low	47.3	Very low	183 Å²	183	111 Å²	111	86%	0.855	60%	0.6	S	S	*	*			trans	-76	87	162.4	-70.5	-167.3	144.3	0	0	111.2	G1137	G1137-E1139 PolarHBondContact O-N 3.35Å
1140	Q	34.8	Very low	45.7	Very low	173 Å²	173	111.8 Å²	111.8	81%	0.808	60%	0.604	S	S	*	*			trans	173.5	165.9	146.3	-96.6	155.6	46.2	0	0	111	T1138	T1138-Q1140 PolarHBondContact O-N 3.37Å
1141	I	39.6	Very low	43.9	Very low	150 Å²	150	112.8 Å²	112.8	77%	0.769	61%	0.614	S	S	*	*			trans	66.6	108.7	-178.4	-49.8	176.1	0	0	0	113.5
1142	S	36.2	Very low	42.1	Very low	97 Å²	97	115 Å²	115	68%	0.678	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-72.4	121.6	160.7	48.6	0	0	0	0	109.6
1143	P	33.9	Very low	40.8	Very low	54 Å²	54	114.6 Å²	114.6	35%	0.351	62%	0.624	S	S	.	*	P	Polyproline II helix	trans	-69	141.4	167.4	30.6	-33.3	0	0	0	109.4	N1147	P1143-N1147 HydrophobicContact CB-CB 4.22Å
1144	S	35.1	Very low	39.8	Very low	66 Å²	66	115.8 Å²	115.8	46%	0.462	64%	0.638	S	S	.	*	P	Polyproline II helix	trans	-68.7	164.6	158.8	56.5	0	0	0	0	110	D1146 N1147	S1144-D1146 WeakPolarHBondContact CB-OD2 3.05Å; S1144-D1146 PolarHBondContact O-N 3.15Å; S1144-D1146 PolarHBondContact OG-OD2 3.14Å; S1144-N1147 PolarHBondContact O-N 2.99Å
1145	L	37.8	Very low	38.5	Very low	88 Å²	88	115.8 Å²	115.8	46%	0.461	64%	0.638	S	S	.	*	G	3₁₀ helix	trans	-57.1	-20.2	-179.5	-124.8	73.1	0	0	0	113.5	N1147 V1148	L1145-N1147 PolarHBondContact O-N 2.89Å; L1145-V1148 PolarHBondContact O-N 3.4Å
1146	D	35.1	Very low	37.2	Very low	122 Å²	122	112.3 Å²	112.3	65%	0.652	63%	0.627	S	S	*	*	G	3₁₀ helix	trans	-65	-22.2	-176.9	-41.2	-70.4	0	0	0	114	S1144	S1144-D1146 WeakPolarHBondContact CB-OD2 3.05Å; S1144-D1146 PolarHBondContact O-N 3.15Å; S1144-D1146 PolarHBondContact OG-OD2 3.14Å
1147	N	33.3	Very low	36.1	Very low	129 Å²	129	118 Å²	118	69%	0.69	64%	0.64	S	S	*	*	G	3₁₀ helix	trans	-89.8	-2.9	-178.4	-79.3	-31.8	0	0	0	114.3	P1143 S1144 L1145 Q1149	P1143-N1147 HydrophobicContact CB-CB 4.22Å; S1144-N1147 PolarHBondContact O-N 2.99Å; L1145-N1147 PolarHBondContact O-N 2.89Å; N1147-Q1149 PolarHBondContact O-N 2.88Å
1148	V	36.4	Very low	35.6	Very low	77 Å²	77	122.2 Å²	122.2	47%	0.467	65%	0.648	S	S	.	*	S	Bend	trans	-84.4	105.1	162.2	177.5	0	0	0	0	106.7	L1145 Y1150	L1145-V1148 PolarHBondContact O-N 3.4Å; V1148-Y1150 VanDerWaalsContact C-N 3.26Å; V1148-Y1150 HydrophobicContact CB-CE2 4.17Å; V1148-Y1150 HydrophobicContact CG1-CD2 4.48Å; V1148-Y1150 HydrophobicContact CG1-CE2 4.21Å; V1148-Y1150 WeakPolarHBondContact O-CD2 3.47Å; V1148-Y1150 PolarHBondContact O-N 2.88Å
1149	Q	28.2	Very low	35.2	Very low	193 Å²	193	124 Å²	124	90%	0.902	66%	0.658	S	S	*	*			trans	-75	79.3	-176	-165	170.7	9.3	0	0	111	N1147	N1147-Q1149 PolarHBondContact O-N 2.88Å
1150	Y	34.2	Very low	34.8	Very low	118 Å²	118	119.6 Å²	119.6	46%	0.463	65%	0.653	S	S	.	*			trans	-51.8	143.1	167.5	-63.6	-90	0	0	0	109.8	V1148 S1152	V1148-Y1150 VanDerWaalsContact C-N 3.26Å; V1148-Y1150 HydrophobicContact CB-CE2 4.17Å; V1148-Y1150 HydrophobicContact CG1-CD2 4.48Å; V1148-Y1150 HydrophobicContact CG1-CE2 4.21Å; V1148-Y1150 WeakPolarHBondContact O-CD2 3.47Å; V1148-Y1150 PolarHBondContact O-N 2.88Å; Y1150-S1152 PolarHBondContact O-N 2.03Å
1151	P	29.5	Very low	34.6	Very low	95 Å²	95	121.6 Å²	121.6	62%	0.617	68%	0.677	S	S	*	*			trans	-58.8	126.9	172.2	25.9	-33.4	0	0	0	109	F1153	P1151-F1153 HydrophobicContact CG-CE2 4.03Å; P1151-F1153 HydrophobicContact CG-CZ 4.39Å; P1151-F1153 WeakPolarHBondContact O-CD2 3.05Å; P1151-F1153 PolarHBondContact O-N 3.21Å
1152	S	29.9	Very low	34.4	Very low	92 Å²	92	120.2 Å²	120.2	64%	0.643	67%	0.673	S	S	*	*			trans	-67.8	100.6	-177.4	55.5	0	0	0	0	110.5	Y1150 D1154	Y1150-S1152 PolarHBondContact O-N 2.03Å; S1152-D1154 PolarHBondContact O-N 3.37Å; S1152-D1154 VanDerWaalsContact O-N 3.15Å
1153	F	38.3	Very low	34.3	Very low	110 Å²	110	121.4 Å²	121.4	48%	0.482	67%	0.672	S	S	.	*	G	3₁₀ helix	trans	-67	-10.2	-174.2	-82.1	-86.5	0	0	0	115	P1151 H1155	P1151-F1153 HydrophobicContact CG-CE2 4.03Å; P1151-F1153 HydrophobicContact CG-CZ 4.39Å; P1151-F1153 WeakPolarHBondContact O-CD2 3.05Å; P1151-F1153 PolarHBondContact O-N 3.21Å; F1153-H1155 PolarHBondContact O-N 3.06Å; F1153-H1155 VanDerWaalsContact O-N 3.09Å
1154	D	34.6	Very low	34.3	Very low	140 Å²	140	125.2 Å²	125.2	75%	0.749	69%	0.69	S	S	*	*	G	3₁₀ helix	trans	-69.4	-6.9	-171.5	-58.3	-51.4	0	0	0	115.4	S1152	S1152-D1154 PolarHBondContact O-N 3.37Å; S1152-D1154 VanDerWaalsContact O-N 3.15Å
1155	H	33.9	Very low	34.3	Very low	167 Å²	167	128.6 Å²	128.6	77%	0.773	70%	0.704	S	S	*	*	G	3₁₀ helix	trans	-102.3	-7.4	-172.9	-99.4	-60.2	0	0	0	116.8	F1153	F1153-H1155 PolarHBondContact O-N 3.06Å; F1153-H1155 VanDerWaalsContact O-N 3.09Å
1156	S	37	Very low	34.1	Very low	83 Å²	83	131.2 Å²	131.2	58%	0.58	72%	0.719	S	S	*	*	S	Bend	trans	-106.4	-15.5	-175.1	54.2	0	0	0	0	115.7	N1158	S1156-N1158 VanDerWaalsContact C-N 3.34Å; S1156-N1158 PolarHBondContact O-N 3.31Å
1157	F	35	Very low	34	Very low	184 Å²	184	131.8 Å²	131.8	81%	0.807	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79	-8.2	-176.9	-104.9	-82.5	0	0	0	115.5
1158	N	37.4	Very low	34	Very low	152 Å²	152	132 Å²	132	81%	0.813	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.5	15.4	-175.9	-74.4	-41.7	0	0	0	114.5	S1156	S1156-N1158 VanDerWaalsContact C-N 3.34Å; S1156-N1158 PolarHBondContact O-N 3.31Å
1159	V	38.1	Very low	33.9	Very low	130 Å²	130	136.2 Å²	136.2	79%	0.788	75%	0.746	S	S	*	*	S	Bend	trans	-126.7	1.2	-173	-167.9	0	0	0	0	113.3
1160	A	33	Very low	34.3	Very low	91 Å²	91	131.5 Å²	131.5	75%	0.752	73%	0.733	S	S	*	*			trans	-137.1	95.5	176.2	0	0	0	0	0	111.3
1161	T	31.1	Very low	34.3	Very low	216 Å²	216	132.7 Å²	132.7	100%	1.325	76%	0.757	S	S	*	*			trans	-86.7	0	161.9	53.4	0	0	0	0	110.3

Retrieved 1,161 of 1,161 residues in 475.3 ms (Link to these results)

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