A0A077ZM23_TRITR Loading...

Zinc knuckle protein

AlphaFold DB , UniProt , Accession A0A077ZM23, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,388 aa.

						>A0A077ZM23_TRITR|A0A077ZM23
MTKEVEVASLTRKRANHQSKITLVIKRLDGLVEGKANRCVVEEEMLRLEAYLAKCQEVQEDLECLLKDGEKLQSEIESWMAFESSVMDVKVKAKHYLQQHKDTETLEAKYPAPVGPNLPRWTLPQFSGDVLQFASFWDQFEAAVDCRTDLSNVTKMVYLQSALGGEALDAIRGFTVTNANYPIVIDILRERFGRHDAVVEAHVLSLLKADRWEKNSDGKLRELYDQLNGHIRALSVIGKDISKRELSAEDILLVLFKQRLPYQVRKRWEQKMLTDGRNCDHRLDLFFEFLRVEVEIEECTKSAPSLGRHKDSPNVNSRKASQSIMRERRADIQPRDEKRSTAAALQAVVSKDQRQPKDEKCGMTPSRIATGPNGRLVTASSRREADPPAERQCLVCGRHTLLCPTFIATPVEQRWKKCKETRLCFRCLRVGHLVKHCKSDDGCTHQGCGRDHHELLHREENAEGIQVGMLRSSKQAAVMLQTAQARLYGADGASVVVTCLFDAGSQRSFICKRIADNMRLQGNTECVTIHAFGSSLAKPTRCRRVTFALGPIFTGGSYQQMEALCVPKICSVLESNDAIRESWTHVQGLTLADKFPRSRVSVDVLIGLDHYYDFVTEEMKRGESEQPVAIRSSLGWIICGRTSEPADSASRVLMVTTEESTEMALRRLWELDAIGITDDGAKDTSASLQLKRLQETFSYNGNRYTVRLPWKAEKSLPNNHGQAFRRLIRLEDQMSAKTEEAFAYECGMEEYISNGWVERANHPASVGAEWYLPHHAVIRHDKTTTKCRIVFDGSSRYKGVALNDLLEAGPPLQADLVGILLRFRRFKVAVQADIEKMFMQILLHEEDRDFVRYLWRGFDRDITPSVWRFTRHAEDNADAYKQGAAAVRQNMYVDDLVSSYCTLEEAISVSDEARKLLKSGGFDLKKWTSNCPEAVARFSDDKERNHPNVVMTLGIAWRVKDDTLSLHSMWPTEPDNTFSEDVSYERGKTIFANVLQVGNDFGRLAPERFAQFERLIRVTALCLRFVYNARRESQERRRGDLTVEELLQAECSWLQIVQRRHFGAEIERILSHKPLQTDSRIRQFDPFIGNDNLLRVGGQNTRSQLDYEAQHQILLPNNDHVVTLLLRDLHERKLHAPTEATLAAARQKFWIIKGRAAVKRVLRNCVICKKIHSVAYQSKMAELPKERVTEASPFQRTGVDFAGPLFVRRRQNPAKVYVCLFTCMVSRAIHLELVPSLTTQNFLLAFRRFVARRGRPDCMQSDNFRSFRTADQELNELFNKENRTLMKKELSKDRITWTFITPRAPWCGGYWERLVGSVKTALKKALGHAYIEAQINARPLTFLSADPKDMECLTPFHFLTGRAYRHIPYLTEVGAKPQQLSGSELRRK
					

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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	52.8	Low	79.3	Confident	200 Å²	200	88.3 Å²	88.3	99%	0.985	48%	0.481	S	S	*	.				0	138.6	0	-79.1	175.4	140.2	0	0	107.1	V5	M1-V5 HydrophobicContact CB-CB 4.5Å; M1-V5 HydrophobicContact CB-CG1 4.47Å; M1-V5 HydrophobicContact CE-CG1 3.89Å; M1-V5 HydrophobicContact CG-CG1 4.34Å; M1-V5 HydrophobicContact SD-CG1 4.29Å
2	T	70.1	Confident	80.1	Confident	88 Å²	88	98 Å²	98	54%	0.54	51%	0.505	S	S	.	.			trans	-65.8	148	173.2	45.7	0	0	0	0	109	E4 V5 E6	T2-E4 PolarHBondContact O-N 3.43Å; T2-V5 PolarHBondContact O-N 3.04Å; T2-V5 WeakPolarHBondContact OG1-CG2 3.35Å; T2-E6 PolarHBondContact O-N 2.88Å
3	K	73.3	Confident	80.9	Confident	124 Å²	124	98.5 Å²	98.5	54%	0.539	50%	0.501	S	S	.	.	H	α-helix	trans	-49	-35.9	176.8	-84.1	-174.7	172.1	-173.4	0	112.6	V5 E6 V7	K3-V5 PolarHBondContact O-N 3.14Å; K3-E6 PolarHBondContact O-N 3.29Å; K3-V7 VanDerWaalsContact O-CG2 3.32Å; K3-V7 WeakPolarHBondContact O-CG2 3.22Å; K3-V7 PolarHBondContact O-N 3.05Å
4	E	76.8	Confident	81.7	Confident	158 Å²	158	92.8 Å²	92.8	74%	0.738	47%	0.47	S	S	*	.	H	α-helix	trans	-61.4	-38.4	177.5	-64.7	179.9	163.7	0	0	113.5	T2 A8	T2-E4 PolarHBondContact O-N 3.43Å; E4-A8 WeakPolarHBondContact O-CB 3.3Å; E4-A8 PolarHBondContact O-N 3.12Å
5	V	78.3	Confident	82.2	Confident	67 Å²	67	89.5 Å²	89.5	41%	0.406	46%	0.463	S	S	.	.	H	α-helix	trans	-70.1	-37.1	178.2	173.1	0	0	0	0	111	M1 T2 K3 S9	M1-V5 HydrophobicContact CB-CB 4.5Å; M1-V5 HydrophobicContact CB-CG1 4.47Å; M1-V5 HydrophobicContact CE-CG1 3.89Å; M1-V5 HydrophobicContact CG-CG1 4.34Å; M1-V5 HydrophobicContact SD-CG1 4.29Å; T2-V5 PolarHBondContact O-N 3.04Å; T2-V5 WeakPolarHBondContact OG1-CG2 3.35Å; K3-V5 PolarHBondContact O-N 3.14Å; V5-S9 WeakPolarHBondContact O-CB 3.37Å; V5-S9 PolarHBondContact O-N 3.41Å
6	E	83.5	Confident	82.7	Confident	96 Å²	96	88.8 Å²	88.8	45%	0.449	46%	0.46	S	S	.	.	H	α-helix	trans	-70.1	-44.9	179.1	-165.9	163.1	-153.6	0	0	111.5	T2 K3 A8 S9 L10 L65	T2-E6 PolarHBondContact O-N 2.88Å; K3-E6 PolarHBondContact O-N 3.29Å; E6-A8 PolarHBondContact O-N 2.82Å; E6-S9 WeakPolarHBondContact O-CB 3.33Å; E6-S9 PolarHBondContact O-N 2.83Å; E6-L10 HydrophobicContact CG-CD1 4.49Å; E6-L10 PolarHBondContact O-N 3.13Å; E6-L65 HydrophobicContact CG-CD1 4.04Å
7	V	86.5	Confident	83.2	Confident	31 Å²	31	85 Å²	85	19%	0.188	44%	0.44	C	S	.	.	H	α-helix	trans	-57	-50.7	171.5	171.9	0	0	0	0	110.3	K3 S9 L10 T11 L62 L65 L66	K3-V7 VanDerWaalsContact O-CG2 3.32Å; K3-V7 WeakPolarHBondContact O-CG2 3.22Å; K3-V7 PolarHBondContact O-N 3.05Å; V7-S9 VanDerWaalsContact C-N 3.28Å; V7-S9 PolarHBondContact O-N 3.18Å; V7-L10 PolarHBondContact O-N 2.79Å; V7-T11 WeakPolarHBondContact O-CB 3.22Å; V7-T11 PolarHBondContact O-N 2.96Å; V7-T11 PolarHBondContact O-OG1 2.93Å; V7-L62 HydrophobicContact CG1-CD2 4.09Å; V7-L65 HydrophobicContact CG2-CB 3.98Å; V7-L65 HydrophobicContact CG2-CD1 4.29Å; V7-L66 HydrophobicContact CG1-CD2 4.34Å
8	A	85.5	Confident	83.8	Confident	60 Å²	60	82.1 Å²	82.1	50%	0.496	42%	0.424	S	S	.	.	H	α-helix	trans	-59.7	-36.9	179.2	0	0	0	0	0	113.4	E4 E6 R12	E4-A8 WeakPolarHBondContact O-CB 3.3Å; E4-A8 PolarHBondContact O-N 3.12Å; E6-A8 PolarHBondContact O-N 2.82Å; A8-R12 WeakPolarHBondContact O-CB 3.08Å; A8-R12 PolarHBondContact O-N 2.88Å; A8-R12 VanDerWaalsContact O-N 3.12Å
9	S	86.6	Confident	84.2	Confident	75 Å²	75	81.6 Å²	81.6	52%	0.524	43%	0.428	S	S	.	.	H	α-helix	trans	-64.5	-48.8	175.7	179.8	0	0	0	0	111.8	V5 E6 V7 R12 K13	V5-S9 WeakPolarHBondContact O-CB 3.37Å; V5-S9 PolarHBondContact O-N 3.41Å; E6-S9 WeakPolarHBondContact O-CB 3.33Å; E6-S9 PolarHBondContact O-N 2.83Å; V7-S9 VanDerWaalsContact C-N 3.28Å; V7-S9 PolarHBondContact O-N 3.18Å; S9-R12 PolarHBondContact O-N 2.87Å; S9-K13 PolarHBondContact O-N 2.85Å
10	L	90.2	Very high	84.6	Confident	22 Å²	22	81.6 Å²	81.6	12%	0.115	43%	0.425	C	S	.	.	H	α-helix	trans	-67.4	-40.6	179.5	-68.8	166.5	0	0	0	111.8	E6 V7 R12 K13 R14 V58 D61 L62 L65	E6-L10 HydrophobicContact CG-CD1 4.49Å; E6-L10 PolarHBondContact O-N 3.13Å; V7-L10 PolarHBondContact O-N 2.79Å; L10-R12 VanDerWaalsContact C-N 3.29Å; L10-R12 PolarHBondContact O-N 3.26Å; L10-K13 WeakPolarHBondContact O-CB 3.42Å; L10-K13 PolarHBondContact O-N 2.87Å; L10-R14 WeakPolarHBondContact O-CB 3.34Å; L10-R14 PolarHBondContact O-N 3.32Å; L10-V58 HydrophobicContact CB-CG1 4.36Å; L10-V58 HydrophobicContact CD2-CG1 4.13Å; L10-V58 WeakPolarHBondContact O-CG1 3.43Å; L10-D61 HydrophobicContact CD1-CB 4.01Å; L10-D61 HydrophobicContact CD2-CB 4.21Å; L10-L62 HydrophobicContact CB-CD1 4.13Å; L10-L62 HydrophobicContact CB-CD2 3.92Å; L10-L62 HydrophobicContact CB-CG 3.69Å; L10-L65 HydrophobicContact CD1-CD1 3.35Å
11	T	88.6	Confident	85.1	Confident	50 Å²	50	77.7 Å²	77.7	31%	0.307	40%	0.404	S	S	.	.	H	α-helix	trans	-58.1	-42.2	174.5	-51.1	0	0	0	0	111.2	V7 A15	V7-T11 WeakPolarHBondContact O-CB 3.22Å; V7-T11 PolarHBondContact O-N 2.96Å; V7-T11 PolarHBondContact O-OG1 2.93Å; T11-A15 WeakPolarHBondContact O-CB 3.22Å; T11-A15 PolarHBondContact O-N 2.87Å
12	R	89	Confident	87	Confident	205 Å²	205	71 Å²	71	77%	0.774	37%	0.374	S	S	*	.	H	α-helix	trans	-65.8	-39.6	174.9	180	178.2	-93.8	-172.8	-5.1	112	A8 S9 L10 A15 N16	A8-R12 WeakPolarHBondContact O-CB 3.08Å; A8-R12 PolarHBondContact O-N 2.88Å; A8-R12 VanDerWaalsContact O-N 3.12Å; S9-R12 PolarHBondContact O-N 2.87Å; L10-R12 VanDerWaalsContact C-N 3.29Å; L10-R12 PolarHBondContact O-N 3.26Å; R12-A15 PolarHBondContact O-N 3.09Å; R12-N16 PolarHBondContact O-N 3.08Å; R12-N16 VanDerWaalsContact O-N 3.13Å
13	K	90	Very high	88.1	Confident	104 Å²	104	72.7 Å²	72.7	45%	0.452	38%	0.38	S	S	.	.	H	α-helix	trans	-65.5	-44.9	178.1	-167.3	-178.7	175.6	-164.8	0	111.1	S9 L10 N16 H17 V58	S9-K13 PolarHBondContact O-N 2.85Å; L10-K13 WeakPolarHBondContact O-CB 3.42Å; L10-K13 PolarHBondContact O-N 2.87Å; K13-N16 WeakPolarHBondContact O-CB 3.38Å; K13-N16 PolarHBondContact O-N 2.83Å; K13-H17 PolarHBondContact O-CD2 3.37Å; K13-H17 PolarHBondContact O-N 3.19Å; K13-V58 HydrophobicContact CB-CG1 4.14Å; K13-V58 HydrophobicContact CD-CG1 4.37Å; K13-V58 HydrophobicContact CD-CG2 3.83Å; K13-V58 HydrophobicContact CG-CG1 4.36Å; K13-V58 HydrophobicContact CG-CG2 4.14Å
14	R	92.1	Very high	89	Confident	19 Å²	19	67.3 Å²	67.3	7%	0.072	36%	0.357	C	S	.	.	H	α-helix	trans	-57.9	-49.4	173.2	-173.6	-165.6	65.1	171.7	-12.8	111.4	L10 N16 H17 Q18 V58 L62 E75	L10-R14 WeakPolarHBondContact O-CB 3.34Å; L10-R14 PolarHBondContact O-N 3.32Å; R14-N16 PolarHBondContact O-N 3.02Å; R14-H17 PolarHBondContact O-N 2.93Å; R14-Q18 HydrophobicContact CG-CG 4.33Å; R14-Q18 WeakPolarHBondContact O-CG 3.32Å; R14-Q18 PolarHBondContact O-N 3.03Å; R14-V58 HydrophobicContact CB-CG1 3.93Å; R14-L62 HydrophobicContact CB-CD1 4.15Å; R14-E75 IonicContact CZ-OE1 2.82Å; R14-E75 IonicContact CZ-OE2 3.7Å; R14-E75 IonicContact NE-OE1 3.91Å; R14-E75 IonicContact NH1-OE1 3.18Å; R14-E75 PolarHBondContact NH1-OE1 2.71Å; R14-E75 IonicContact NH1-OE2 3.64Å; R14-E75 PolarHBondContact NH1-OE2 3.15Å; R14-E75 IonicContact NH2-OE1 2.6Å; R14-E75 PolarHBondContact NH2-OE1 3.17Å; R14-E75 IonicContact NH2-OE2 3.75Å; R14-E75 PolarHBondContact NH2-OE2 2.81Å; R14-E75 VanDerWaalsContact NH2-OE2 3.1Å
15	A	89.7	Confident	89.7	Confident	43 Å²	43	60.7 Å²	60.7	36%	0.355	33%	0.327	S	S	.	.	H	α-helix	trans	-58.3	-34.4	178.6	0	0	0	0	0	112.8	T11 R12 S19	T11-A15 WeakPolarHBondContact O-CB 3.22Å; T11-A15 PolarHBondContact O-N 2.87Å; R12-A15 PolarHBondContact O-N 3.09Å; A15-S19 WeakPolarHBondContact O-CB 3.1Å; A15-S19 PolarHBondContact O-N 2.9Å; A15-S19 PolarHBondContact O-OG 3.38Å
16	N	90.3	Very high	90.3	Very high	79 Å²	79	64.9 Å²	64.9	42%	0.422	34%	0.34	S	S	.	.	H	α-helix	trans	-66.2	-43.9	174.3	-168.9	-82.4	0	0	0	112.3	R12 K13 R14 S19 K20	R12-N16 PolarHBondContact O-N 3.08Å; R12-N16 VanDerWaalsContact O-N 3.13Å; K13-N16 WeakPolarHBondContact O-CB 3.38Å; K13-N16 PolarHBondContact O-N 2.83Å; R14-N16 PolarHBondContact O-N 3.02Å; N16-S19 PolarHBondContact O-N 3.19Å; N16-K20 WeakPolarHBondContact O-CG 3.37Å; N16-K20 PolarHBondContact O-N 3.17Å; N16-K20 VanDerWaalsContact OD1-CE 3.23Å; N16-K20 WeakPolarHBondContact OD1-CE 3.45Å; N16-K20 PolarHBondContact OD1-NZ 3.44Å
17	H	91.9	Very high	90.6	Very high	24 Å²	24	67.1 Å²	67.1	11%	0.111	34%	0.344	C	S	.	.	H	α-helix	trans	-66	-44.9	176.4	-72.7	-65.1	0	0	0	111.6	K13 R14 S19 K20 I21 C55	K13-H17 PolarHBondContact O-CD2 3.37Å; K13-H17 PolarHBondContact O-N 3.19Å; R14-H17 PolarHBondContact O-N 2.93Å; H17-S19 VanDerWaalsContact C-N 3.32Å; H17-S19 PolarHBondContact O-N 3.27Å; H17-K20 WeakPolarHBondContact O-CB 3.37Å; H17-K20 PolarHBondContact O-N 3.27Å; H17-K20 VanDerWaalsContact O-N 3.12Å; H17-I21 WeakPolarHBondContact O-CG1 3.25Å; H17-I21 PolarHBondContact O-N 3.34Å; H17-C55 HydrophobicContact CB-CB 3.79Å; H17-C55 VanDerWaalsContact CB-SG 3.58Å
18	Q	92.7	Very high	90.8	Very high	32 Å²	32	65.7 Å²	65.7	15%	0.15	34%	0.335	C	S	.	.	H	α-helix	trans	-55.7	-46.1	173.6	-71.8	178.7	-39.2	0	0	111.4	R14 K20 I21 T22 F82	R14-Q18 HydrophobicContact CG-CG 4.33Å; R14-Q18 WeakPolarHBondContact O-CG 3.32Å; R14-Q18 PolarHBondContact O-N 3.03Å; Q18-K20 VanDerWaalsContact C-N 3.3Å; Q18-K20 PolarHBondContact O-N 3.13Å; Q18-I21 PolarHBondContact O-N 3.36Å; Q18-I21 VanDerWaalsContact O-N 3.17Å; Q18-T22 PolarHBondContact O-N 3.44Å; Q18-T22 PolarHBondContact O-OG1 3.45Å; Q18-F82 HydrophobicContact CB-CE1 4.48Å; Q18-F82 HydrophobicContact CB-CE2 3.9Å; Q18-F82 HydrophobicContact CB-CZ 3.86Å; Q18-F82 HydrophobicContact CG-CD1 4.15Å; Q18-F82 HydrophobicContact CG-CD2 4.25Å; Q18-F82 HydrophobicContact CG-CE1 3.83Å; Q18-F82 HydrophobicContact CG-CE2 3.93Å; Q18-F82 HydrophobicContact CG-CG 4.35Å; Q18-F82 HydrophobicContact CG-CZ 3.71Å
19	S	91.6	Very high	91.1	Very high	74 Å²	74	64.4 Å²	64.4	52%	0.517	32%	0.32	S	S	.	.	H	α-helix	trans	-59.1	-39.4	177.4	-61	0	0	0	0	113	A15 N16 H17 L23	A15-S19 WeakPolarHBondContact O-CB 3.1Å; A15-S19 PolarHBondContact O-N 2.9Å; A15-S19 PolarHBondContact O-OG 3.38Å; N16-S19 PolarHBondContact O-N 3.19Å; H17-S19 VanDerWaalsContact C-N 3.32Å; H17-S19 PolarHBondContact O-N 3.27Å; S19-L23 PolarHBondContact O-N 2.85Å
20	K	93.1	Very high	91.1	Very high	81 Å²	81	62.8 Å²	62.8	35%	0.352	32%	0.315	S	S	.	.	H	α-helix	trans	-68.1	-43	176	-73	169.7	175.7	156.8	0	111.8	N16 H17 Q18 L23 V24 Y51	N16-K20 WeakPolarHBondContact O-CG 3.37Å; N16-K20 PolarHBondContact O-N 3.17Å; N16-K20 VanDerWaalsContact OD1-CE 3.23Å; N16-K20 WeakPolarHBondContact OD1-CE 3.45Å; N16-K20 PolarHBondContact OD1-NZ 3.44Å; H17-K20 WeakPolarHBondContact O-CB 3.37Å; H17-K20 PolarHBondContact O-N 3.27Å; H17-K20 VanDerWaalsContact O-N 3.12Å; Q18-K20 VanDerWaalsContact C-N 3.3Å; Q18-K20 PolarHBondContact O-N 3.13Å; K20-L23 WeakPolarHBondContact O-CB 3.09Å; K20-L23 PolarHBondContact O-N 2.75Å; K20-V24 WeakPolarHBondContact O-CG2 3.4Å; K20-V24 PolarHBondContact O-N 2.92Å; K20-V24 VanDerWaalsContact O-N 3.09Å; K20-Y51 HydrophobicContact CD-CD1 4.48Å; K20-Y51 HydrophobicContact CD-CE1 4.06Å
21	I	95.5	Very high	91	Very high	0 Å²	0	63.3 Å²	63.3	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-61.3	-45.4	176.3	-70	167.2	0	0	0	110.3	H17 Q18 L23 V24 I25 L48 L52 C55 F82 V86	H17-I21 WeakPolarHBondContact O-CG1 3.25Å; H17-I21 PolarHBondContact O-N 3.34Å; Q18-I21 PolarHBondContact O-N 3.36Å; Q18-I21 VanDerWaalsContact O-N 3.17Å; I21-L23 VanDerWaalsContact C-N 3.27Å; I21-L23 PolarHBondContact O-N 3.1Å; I21-V24 CarbonylContact O-C 3.58Å; I21-V24 PolarHBondContact O-N 3.22Å; I21-I25 HydrophobicContact CG2-CD1 3.81Å; I21-I25 HydrophobicContact CG2-CG1 4.31Å; I21-I25 WeakPolarHBondContact O-CG1 3.49Å; I21-I25 PolarHBondContact O-N 2.79Å; I21-L48 HydrophobicContact CG2-CD1 3.84Å; I21-L52 HydrophobicContact CD1-CD1 4.4Å; I21-C55 HydrophobicContact CD1-CB 3.76Å; I21-F82 HydrophobicContact CB-CZ 3.81Å; I21-F82 HydrophobicContact CD1-CE1 3.91Å; I21-F82 HydrophobicContact CD1-CZ 3.99Å; I21-F82 HydrophobicContact CG2-CE1 4.14Å; I21-F82 HydrophobicContact CG2-CE2 4.42Å; I21-F82 HydrophobicContact CG2-CZ 3.52Å; I21-V86 HydrophobicContact CG2-CG2 3.7Å
22	T	92.4	Very high	90.9	Very high	58 Å²	58	62.1 Å²	62.1	36%	0.356	31%	0.31	S	S	.	.	H	α-helix	trans	-59.7	-36.3	177.3	-54.5	0	0	0	0	112.6	Q18 K26	Q18-T22 PolarHBondContact O-N 3.44Å; Q18-T22 PolarHBondContact O-OG1 3.45Å; T22-K26 WeakPolarHBondContact O-CG 3.23Å; T22-K26 PolarHBondContact O-N 2.7Å; T22-K26 VanDerWaalsContact O-N 3.1Å
23	L	91.6	Very high	90.7	Very high	125 Å²	125	59.5 Å²	59.5	65%	0.654	31%	0.307	S	S	*	.	H	α-helix	trans	-66	-42.7	173.2	-87.6	156.2	0	0	0	112.3	S19 K20 I21 R27	S19-L23 PolarHBondContact O-N 2.85Å; K20-L23 WeakPolarHBondContact O-CB 3.09Å; K20-L23 PolarHBondContact O-N 2.75Å; I21-L23 VanDerWaalsContact C-N 3.27Å; I21-L23 PolarHBondContact O-N 3.1Å; L23-R27 PolarHBondContact O-N 2.99Å
24	V	92.4	Very high	90.4	Very high	11 Å²	11	57.3 Å²	57.3	7%	0.067	31%	0.314	C	S	.	.	H	α-helix	trans	-67.5	-41.5	177.2	177.5	0	0	0	0	110.8	K20 I21 K26 R27 L28 R47 L48 Y51	K20-V24 WeakPolarHBondContact O-CG2 3.4Å; K20-V24 PolarHBondContact O-N 2.92Å; K20-V24 VanDerWaalsContact O-N 3.09Å; I21-V24 CarbonylContact O-C 3.58Å; I21-V24 PolarHBondContact O-N 3.22Å; V24-K26 PolarHBondContact O-N 2.92Å; V24-R27 PolarHBondContact O-N 2.96Å; V24-R27 VanDerWaalsContact O-N 3.16Å; V24-L28 WeakPolarHBondContact O-CB 3.46Å; V24-L28 PolarHBondContact O-N 2.82Å; V24-R47 HydrophobicContact CG2-CG 4.43Å; V24-L48 HydrophobicContact CB-CD1 4.29Å; V24-L48 HydrophobicContact CG1-CB 3.84Å; V24-L48 HydrophobicContact CG1-CD1 4.05Å; V24-Y51 HydrophobicContact CG2-CD2 4.03Å; V24-Y51 HydrophobicContact CG2-CE2 4.1Å
25	I	92.9	Very high	89.9	Confident	19 Å²	19	64.2 Å²	64.2	10%	0.097	34%	0.344	C	S	.	.	H	α-helix	trans	-54.7	-53.3	174.1	-78.6	171.4	0	0	0	111.1	I21 R27 L28 D29 L48 V86 V89	I21-I25 HydrophobicContact CG2-CD1 3.81Å; I21-I25 HydrophobicContact CG2-CG1 4.31Å; I21-I25 WeakPolarHBondContact O-CG1 3.49Å; I21-I25 PolarHBondContact O-N 2.79Å; I25-R27 PolarHBondContact O-N 3.19Å; I25-L28 PolarHBondContact O-N 2.93Å; I25-L28 VanDerWaalsContact O-N 3.09Å; I25-D29 PolarHBondContact O-N 3.41Å; I25-L48 HydrophobicContact CG1-CD1 4.06Å; I25-V86 HydrophobicContact CD1-CB 4.33Å; I25-V86 HydrophobicContact CD1-CG2 3.87Å; I25-V89 HydrophobicContact CG1-CB 4.44Å; I25-V89 HydrophobicContact CG1-CG1 4.38Å; I25-V89 HydrophobicContact CG1-CG2 4.39Å; I25-V89 HydrophobicContact CG2-CB 4.41Å; I25-V89 HydrophobicContact CG2-CG1 4.3Å; I25-V89 HydrophobicContact CG2-CG2 3.62Å
26	K	90.9	Very high	89.4	Confident	155 Å²	155	63.3 Å²	63.3	67%	0.674	34%	0.337	S	S	*	.	H	α-helix	trans	-58.3	-36.8	178.9	-77.3	-176	178	-176	0	112.4	T22 V24 G30	T22-K26 WeakPolarHBondContact O-CG 3.23Å; T22-K26 PolarHBondContact O-N 2.7Å; T22-K26 VanDerWaalsContact O-N 3.1Å; V24-K26 PolarHBondContact O-N 2.92Å; K26-G30 PolarHBondContact O-N 2.83Å; K26-G30 VanDerWaalsContact O-N 3.14Å
27	R	90	Very high	88.9	Confident	143 Å²	143	65 Å²	65	54%	0.54	35%	0.346	S	S	.	.	H	α-helix	trans	-70.2	-43.5	176.3	-178	179	-91.4	-173.4	-6	111.2	L23 V24 I25 G30 L31 E44	L23-R27 PolarHBondContact O-N 2.99Å; V24-R27 PolarHBondContact O-N 2.96Å; V24-R27 VanDerWaalsContact O-N 3.16Å; I25-R27 PolarHBondContact O-N 3.19Å; R27-G30 PolarHBondContact O-N 3.04Å; R27-L31 HydrophobicContact CG-CD1 4.02Å; R27-L31 HydrophobicContact CG-CG 4.38Å; R27-L31 WeakPolarHBondContact O-CB 3.04Å; R27-L31 WeakPolarHBondContact O-CG 3.41Å; R27-L31 PolarHBondContact O-N 2.91Å; R27-E44 WeakPolarHBondContact CD-OE1 3.47Å; R27-E44 IonicContact CZ-OE1 3Å; R27-E44 IonicContact NE-OE1 3.85Å; R27-E44 IonicContact NH1-OE1 3.29Å; R27-E44 PolarHBondContact NH1-OE1 3.24Å
28	L	90.3	Very high	88.4	Confident	0 Å²	0	68.9 Å²	68.9	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-64.1	-46	-179.9	-150	84.4	0	0	0	111.3	V24 I25 G30 L31 V32 E44 M45 L48 V89 A93	V24-L28 WeakPolarHBondContact O-CB 3.46Å; V24-L28 PolarHBondContact O-N 2.82Å; I25-L28 PolarHBondContact O-N 2.93Å; I25-L28 VanDerWaalsContact O-N 3.09Å; L28-G30 PolarHBondContact O-N 2.94Å; L28-L31 PolarHBondContact O-N 2.83Å; L28-V32 WeakPolarHBondContact O-CG2 3.49Å; L28-V32 PolarHBondContact O-N 3.39Å; L28-E44 HydrophobicContact CD1-CB 3.37Å; L28-M45 HydrophobicContact CD1-CG 4.23Å; L28-M45 HydrophobicContact CD2-CG 4.05Å; L28-L48 HydrophobicContact CD2-CD2 4.29Å; L28-V89 HydrophobicContact CB-CG1 3.98Å; L28-V89 HydrophobicContact CD2-CG1 3.7Å; L28-V89 HydrophobicContact CG-CG1 4.41Å; L28-A93 HydrophobicContact CD2-CB 3.41Å; L28-A93 VanDerWaalsContact CD2-CB 3.41Å; L28-A93 HydrophobicContact CG-CB 4.11Å
29	D	90.4	Very high	87.7	Confident	34 Å²	34	71 Å²	71	18%	0.182	38%	0.377	C	S	.	.	H	α-helix	trans	-58.9	-47.4	174.3	-95	-21.4	0	0	0	110.6	I25 L31 V32 E33 K92	I25-D29 PolarHBondContact O-N 3.41Å; D29-L31 VanDerWaalsContact C-N 3.28Å; D29-L31 PolarHBondContact O-N 3.44Å; D29-V32 PolarHBondContact O-N 3.34Å; D29-E33 WeakPolarHBondContact O-CB 3.4Å; D29-E33 WeakPolarHBondContact O-CG 3.43Å; D29-E33 PolarHBondContact O-N 3.37Å; D29-K92 IonicContact OD1-NZ 3.06Å
30	G	86.6	Confident	87.3	Confident	40 Å²	40	70.6 Å²	70.6	41%	0.412	37%	0.371	S	S	.	.	H	α-helix	trans	-61.9	-33	176.7	0	0	0	0	0	113.9	K26 R27 L28 G34	K26-G30 PolarHBondContact O-N 2.83Å; K26-G30 VanDerWaalsContact O-N 3.14Å; R27-G30 PolarHBondContact O-N 3.04Å; L28-G30 PolarHBondContact O-N 2.94Å; G30-G34 WeakPolarHBondContact O-CA 3.44Å; G30-G34 PolarHBondContact O-N 3.38Å
31	L	88.2	Confident	87	Confident	33 Å²	33	66.8 Å²	66.8	17%	0.173	36%	0.355	C	S	.	.	H	α-helix	trans	-71.3	-41	174.5	-72.6	167.9	0	0	0	111.8	R27 L28 D29 K35 A36 V40 V41 E44	R27-L31 HydrophobicContact CG-CD1 4.02Å; R27-L31 HydrophobicContact CG-CG 4.38Å; R27-L31 WeakPolarHBondContact O-CB 3.04Å; R27-L31 WeakPolarHBondContact O-CG 3.41Å; R27-L31 PolarHBondContact O-N 2.91Å; L28-L31 PolarHBondContact O-N 2.83Å; D29-L31 VanDerWaalsContact C-N 3.28Å; D29-L31 PolarHBondContact O-N 3.44Å; L31-K35 PolarHBondContact O-N 3.34Å; L31-A36 HydrophobicContact CB-CB 3.89Å; L31-A36 HydrophobicContact CD2-CB 3.45Å; L31-A36 VanDerWaalsContact CD2-CB 3.45Å; L31-A36 HydrophobicContact CG-CB 4.28Å; L31-A36 VanDerWaalsContact O-CB 3.25Å; L31-A36 WeakPolarHBondContact O-CB 3.49Å; L31-A36 PolarHBondContact O-N 3.05Å; L31-V40 HydrophobicContact CD1-CG1 3.88Å; L31-V40 HydrophobicContact CD2-CG1 3.81Å; L31-V41 HydrophobicContact CB-CG2 4.13Å; L31-E44 HydrophobicContact CD1-CB 4.27Å; L31-E44 HydrophobicContact CD1-CG 3.82Å
32	V	87.8	Confident	86.6	Confident	25 Å²	25	70 Å²	70	15%	0.152	37%	0.37	C	S	.	.	H	α-helix	trans	-69.2	-46.1	178.2	171.8	0	0	0	0	110.7	L28 D29 G34 K35 V41 A93 Y96	L28-V32 WeakPolarHBondContact O-CG2 3.49Å; L28-V32 PolarHBondContact O-N 3.39Å; D29-V32 PolarHBondContact O-N 3.34Å; V32-G34 VanDerWaalsContact C-N 3.34Å; V32-K35 PolarHBondContact O-N 3.01Å; V32-V41 HydrophobicContact CG2-CG1 4.28Å; V32-A93 HydrophobicContact CG2-CB 4.12Å; V32-Y96 HydrophobicContact CG1-CD2 4.08Å; V32-Y96 HydrophobicContact CG1-CG 4.14Å; V32-Y96 HydrophobicContact CG2-CG 4.31Å
33	E	84.7	Confident	86.2	Confident	151 Å²	151	73 Å²	73	71%	0.706	38%	0.38	S	S	*	.	H	α-helix	trans	-64.5	-38.6	175.4	-71.7	180	173.5	0	0	111.9	D29 K35	D29-E33 WeakPolarHBondContact O-CB 3.4Å; D29-E33 WeakPolarHBondContact O-CG 3.43Å; D29-E33 PolarHBondContact O-N 3.37Å; E33-K35 PolarHBondContact O-N 3.29Å
34	G	83.6	Confident	86.1	Confident	58 Å²	58	67.8 Å²	67.8	60%	0.598	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	2.1	176.9	0	0	0	0	0	114.9	G30 V32 A36	G30-G34 WeakPolarHBondContact O-CA 3.44Å; G30-G34 PolarHBondContact O-N 3.38Å; V32-G34 VanDerWaalsContact C-N 3.34Å; G34-A36 VanDerWaalsContact C-N 3.25Å; G34-A36 PolarHBondContact O-N 3.43Å
35	K	81.6	Confident	86	Confident	163 Å²	163	68.1 Å²	68.1	71%	0.709	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.3	45.8	-175	-59	-176.3	-179.5	-178.4	0	112.7	L31 V32 E33 Y96	L31-K35 PolarHBondContact O-N 3.34Å; V32-K35 PolarHBondContact O-N 3.01Å; E33-K35 PolarHBondContact O-N 3.29Å; K35-Y96 VanDerWaalsContact CA-OH 3.24Å; K35-Y96 WeakPolarHBondContact CA-OH 3.37Å; K35-Y96 PolarHBondContact O-OH 3.15Å
36	A	79.8	Confident	85.8	Confident	24 Å²	24	72.7 Å²	72.7	20%	0.198	38%	0.377	C	S	.	.			trans	-66.4	161.6	-179.1	0	0	0	0	0	112.4	L31 G34 R38 Y96	L31-A36 HydrophobicContact CB-CB 3.89Å; L31-A36 HydrophobicContact CD2-CB 3.45Å; L31-A36 VanDerWaalsContact CD2-CB 3.45Å; L31-A36 HydrophobicContact CG-CB 4.28Å; L31-A36 VanDerWaalsContact O-CB 3.25Å; L31-A36 WeakPolarHBondContact O-CB 3.49Å; L31-A36 PolarHBondContact O-N 3.05Å; G34-A36 VanDerWaalsContact C-N 3.25Å; G34-A36 PolarHBondContact O-N 3.43Å; A36-R38 PolarHBondContact O-N 2.91Å; A36-Y96 PolarHBondContact N-OH 2.81Å; A36-Y96 WeakPolarHBondContact O-CE1 3.48Å; A36-Y96 PolarHBondContact O-OH 3.27Å
37	N	79.2	Confident	85.8	Confident	114 Å²	114	69.8 Å²	69.8	61%	0.61	36%	0.362	S	S	*	.			trans	-56.1	134.4	177.9	-175.3	-40.8	0	0	0	111.2	C39 V40 V41	N37-C39 PolarHBondContact O-N 2.75Å; N37-C39 VanDerWaalsContact O-N 3.16Å; N37-C39 PolarHBondContact OD1-N 3Å; N37-V40 HydrophobicContact CB-CG2 4.23Å; N37-V40 WeakPolarHBondContact O-CB 3.36Å; N37-V40 PolarHBondContact O-N 2.76Å; N37-V41 PolarHBondContact O-N 3.25Å
38	R	81.9	Confident	86	Confident	107 Å²	107	63.1 Å²	63.1	40%	0.404	34%	0.337	S	S	.	.	H	α-helix	trans	-44.1	-46	177.8	-173.2	-172.6	161.6	180	-10	113.2	A36 V40 V41 E42 L97	A36-R38 PolarHBondContact O-N 2.91Å; R38-V40 VanDerWaalsContact C-N 3.27Å; R38-V40 PolarHBondContact O-N 3.23Å; R38-V41 PolarHBondContact O-N 2.85Å; R38-V41 VanDerWaalsContact O-N 3.14Å; R38-E42 IonicContact CZ-OE1 3.57Å; R38-E42 VanDerWaalsContact CZ-OE1 3.23Å; R38-E42 IonicContact NE-OE1 3.91Å; R38-E42 PolarHBondContact NE-OE1 3.48Å; R38-E42 IonicContact NH2-OE1 2.93Å; R38-E42 PolarHBondContact NH2-OE1 3.48Å; R38-E42 PolarHBondContact O-N 3.19Å; R38-L97 HydrophobicContact CB-CD2 4.33Å; R38-L97 HydrophobicContact CG-CD2 3.38Å
39	C	77.3	Confident	86	Confident	77 Å²	77	66.5 Å²	66.5	52%	0.52	35%	0.353	S	S	.	.	H	α-helix	trans	-62.7	-35	-176.8	-163.6	0	0	0	0	112.1	N37 E42 E43	N37-C39 PolarHBondContact O-N 2.75Å; N37-C39 VanDerWaalsContact O-N 3.16Å; N37-C39 PolarHBondContact OD1-N 3Å; C39-E42 PolarHBondContact O-N 2.68Å; C39-E43 PolarHBondContact O-N 2.92Å
40	V	82.7	Confident	86.1	Confident	65 Å²	65	67.4 Å²	67.4	39%	0.394	37%	0.365	S	S	.	.	H	α-helix	trans	-70.4	-37.9	178	-175	0	0	0	0	110.6	L31 N37 R38 E44	L31-V40 HydrophobicContact CD1-CG1 3.88Å; L31-V40 HydrophobicContact CD2-CG1 3.81Å; N37-V40 HydrophobicContact CB-CG2 4.23Å; N37-V40 WeakPolarHBondContact O-CB 3.36Å; N37-V40 PolarHBondContact O-N 2.76Å; R38-V40 VanDerWaalsContact C-N 3.27Å; R38-V40 PolarHBondContact O-N 3.23Å; V40-E44 WeakPolarHBondContact O-CG 3.45Å; V40-E44 PolarHBondContact O-N 3.2Å; V40-E44 VanDerWaalsContact O-N 3.12Å
41	V	87.5	Confident	86.3	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-68.5	-41	175.8	-179.4	0	0	0	0	111.1	L31 V32 N37 R38 M45 A93 Y96 L97	L31-V41 HydrophobicContact CB-CG2 4.13Å; V32-V41 HydrophobicContact CG2-CG1 4.28Å; N37-V41 PolarHBondContact O-N 3.25Å; R38-V41 PolarHBondContact O-N 2.85Å; R38-V41 VanDerWaalsContact O-N 3.14Å; V41-M45 WeakPolarHBondContact O-CB 3.43Å; V41-M45 WeakPolarHBondContact O-CG 3.42Å; V41-M45 PolarHBondContact O-N 3.12Å; V41-A93 HydrophobicContact CG1-CB 4.01Å; V41-Y96 HydrophobicContact CB-CD1 4.48Å; V41-Y96 HydrophobicContact CG1-CD1 4.28Å; V41-Y96 HydrophobicContact CG2-CD1 4.06Å; V41-Y96 HydrophobicContact CG2-CE1 3.88Å; V41-L97 HydrophobicContact CB-CD2 4.01Å; V41-L97 HydrophobicContact CG1-CD1 4.44Å; V41-L97 HydrophobicContact CG1-CD2 3.99Å; V41-L97 HydrophobicContact CG1-CG 4.12Å
42	E	86.3	Confident	86.5	Confident	68 Å²	68	67.6 Å²	67.6	32%	0.318	35%	0.352	S	S	.	.	H	α-helix	trans	-62.4	-44	175.7	-75.5	179.3	173.7	0	0	112.3	R38 C39 M45 L46 L97	R38-E42 IonicContact CZ-OE1 3.57Å; R38-E42 VanDerWaalsContact CZ-OE1 3.23Å; R38-E42 IonicContact NE-OE1 3.91Å; R38-E42 PolarHBondContact NE-OE1 3.48Å; R38-E42 IonicContact NH2-OE1 2.93Å; R38-E42 PolarHBondContact NH2-OE1 3.48Å; R38-E42 PolarHBondContact O-N 3.19Å; C39-E42 PolarHBondContact O-N 2.68Å; E42-M45 WeakPolarHBondContact O-CB 3.28Å; E42-M45 PolarHBondContact O-N 3.42Å; E42-L46 PolarHBondContact O-N 3.05Å; E42-L97 HydrophobicContact CG-CD1 3.73Å; E42-L97 HydrophobicContact CG-CD2 3.67Å; E42-L97 HydrophobicContact CG-CG 4.36Å
43	E	85.6	Confident	86.7	Confident	122 Å²	122	69 Å²	69	57%	0.57	37%	0.366	S	S	*	.	H	α-helix	trans	-70.1	-38.8	-179	-165.6	170.9	175.4	0	0	112.5	C39 M45 L46 R47	C39-E43 PolarHBondContact O-N 2.92Å; E43-M45 VanDerWaalsContact C-N 3.33Å; E43-L46 PolarHBondContact O-N 2.89Å; E43-R47 PolarHBondContact O-N 3.43Å; E43-R47 VanDerWaalsContact O-N 3.11Å
44	E	88.7	Confident	87	Confident	15 Å²	15	67 Å²	67	7%	0.07	36%	0.355	C	S	.	.	H	α-helix	trans	-70.2	-29.8	172.8	-70.3	-68.4	174.3	0	0	112	R27 L28 L31 V40 R47 L48	R27-E44 WeakPolarHBondContact CD-OE1 3.47Å; R27-E44 IonicContact CZ-OE1 3Å; R27-E44 IonicContact NE-OE1 3.85Å; R27-E44 IonicContact NH1-OE1 3.29Å; R27-E44 PolarHBondContact NH1-OE1 3.24Å; L28-E44 HydrophobicContact CD1-CB 3.37Å; L31-E44 HydrophobicContact CD1-CB 4.27Å; L31-E44 HydrophobicContact CD1-CG 3.82Å; V40-E44 WeakPolarHBondContact O-CG 3.45Å; V40-E44 PolarHBondContact O-N 3.2Å; V40-E44 VanDerWaalsContact O-N 3.12Å; E44-R47 PolarHBondContact O-N 3.1Å; E44-R47 IonicContact OE1-CZ 2.72Å; E44-R47 IonicContact OE1-NH1 3.27Å; E44-R47 PolarHBondContact OE1-NH1 2.96Å; E44-R47 IonicContact OE2-CZ 3.13Å; E44-R47 IonicContact OE2-NE 3.9Å; E44-R47 IonicContact OE2-NH1 2.95Å; E44-R47 PolarHBondContact OE2-NH1 2.91Å; E44-L48 PolarHBondContact O-N 3.26Å
45	M	89.4	Confident	87.4	Confident	18 Å²	18	64.2 Å²	64.2	9%	0.089	33%	0.327	C	S	.	.	H	α-helix	trans	-62.5	-46.2	169.7	-90.6	-169.1	59.2	0	0	112.2	L28 V41 E42 E43 R47 L48 E49 K90 A93 K94 L97	L28-M45 HydrophobicContact CD1-CG 4.23Å; L28-M45 HydrophobicContact CD2-CG 4.05Å; V41-M45 WeakPolarHBondContact O-CB 3.43Å; V41-M45 WeakPolarHBondContact O-CG 3.42Å; V41-M45 PolarHBondContact O-N 3.12Å; E42-M45 WeakPolarHBondContact O-CB 3.28Å; E42-M45 PolarHBondContact O-N 3.42Å; E43-M45 VanDerWaalsContact C-N 3.33Å; M45-R47 VanDerWaalsContact C-N 3.27Å; M45-R47 PolarHBondContact O-N 3.35Å; M45-L48 WeakPolarHBondContact O-CB 3.4Å; M45-L48 PolarHBondContact O-N 2.96Å; M45-E49 WeakPolarHBondContact O-CG 3.31Å; M45-E49 PolarHBondContact O-N 3.1Å; M45-K90 HydrophobicContact CE-CG 4.33Å; M45-A93 HydrophobicContact CG-CB 3.95Å; M45-A93 HydrophobicContact SD-CB 3.72Å; M45-K94 HydrophobicContact CE-CD 4.43Å; M45-K94 HydrophobicContact CE-CG 3.66Å; M45-K94 HydrophobicContact SD-CG 4.23Å; M45-L97 HydrophobicContact SD-CD1 3.47Å; M45-L97 WeakPolarHBondContact SD-CD1 3.27Å
46	L	89	Confident	87.9	Confident	115 Å²	115	59.4 Å²	59.4	60%	0.602	31%	0.307	S	S	*	.	H	α-helix	trans	-60.7	-38.2	176	-75.9	167.9	0	0	0	111.8	E42 E43 E49 A50	E42-L46 PolarHBondContact O-N 3.05Å; E43-L46 PolarHBondContact O-N 2.89Å; L46-E49 PolarHBondContact O-N 3.12Å; L46-A50 PolarHBondContact O-N 3.16Å
47	R	92	Very high	88.5	Confident	94 Å²	94	64 Å²	64	36%	0.355	32%	0.324	S	S	.	.	H	α-helix	trans	-66	-40	175.9	-171.7	178.9	-68	150.9	2.6	112.2	V24 E43 E44 M45 A50 Y51	V24-R47 HydrophobicContact CG2-CG 4.43Å; E43-R47 PolarHBondContact O-N 3.43Å; E43-R47 VanDerWaalsContact O-N 3.11Å; E44-R47 PolarHBondContact O-N 3.1Å; E44-R47 IonicContact OE1-CZ 2.72Å; E44-R47 IonicContact OE1-NH1 3.27Å; E44-R47 PolarHBondContact OE1-NH1 2.96Å; E44-R47 IonicContact OE2-CZ 3.13Å; E44-R47 IonicContact OE2-NE 3.9Å; E44-R47 IonicContact OE2-NH1 2.95Å; E44-R47 PolarHBondContact OE2-NH1 2.91Å; M45-R47 VanDerWaalsContact C-N 3.27Å; M45-R47 PolarHBondContact O-N 3.35Å; R47-A50 PolarHBondContact O-N 2.99Å; R47-Y51 HydrophobicContact CG-CD2 4Å; R47-Y51 HydrophobicContact CG-CE2 3.68Å; R47-Y51 WeakPolarHBondContact O-CD2 3.28Å; R47-Y51 PolarHBondContact O-N 3.3Å; R47-Y51 VanDerWaalsContact O-N 3.17Å
48	L	93.5	Very high	89.1	Confident	2 Å²	2	58.6 Å²	58.6	1%	0.01	30%	0.295	C	S	.	.	H	α-helix	trans	-60.1	-47.4	174.7	-177	63.3	0	0	0	110.9	I21 V24 I25 L28 E44 M45 A50 Y51 L52 V86	I21-L48 HydrophobicContact CG2-CD1 3.84Å; V24-L48 HydrophobicContact CB-CD1 4.29Å; V24-L48 HydrophobicContact CG1-CB 3.84Å; V24-L48 HydrophobicContact CG1-CD1 4.05Å; I25-L48 HydrophobicContact CG1-CD1 4.06Å; L28-L48 HydrophobicContact CD2-CD2 4.29Å; E44-L48 PolarHBondContact O-N 3.26Å; M45-L48 WeakPolarHBondContact O-CB 3.4Å; M45-L48 PolarHBondContact O-N 2.96Å; L48-A50 PolarHBondContact O-N 3.03Å; L48-Y51 PolarHBondContact O-N 2.69Å; L48-L52 WeakPolarHBondContact O-CB 3.07Å; L48-L52 PolarHBondContact O-N 3.26Å; L48-V86 HydrophobicContact CD1-CG1 4.12Å; L48-V86 HydrophobicContact CD2-CG1 4.14Å; L48-V86 HydrophobicContact CG-CG1 4.19Å
49	E	90.9	Very high	89.6	Confident	72 Å²	72	53.7 Å²	53.7	34%	0.336	28%	0.277	S	S	.	.	H	α-helix	trans	-61.7	-42.9	179	-70.1	-176.7	157.7	0	0	112.3	M45 L46 Y51 L52 A53 K90	M45-E49 WeakPolarHBondContact O-CG 3.31Å; M45-E49 PolarHBondContact O-N 3.1Å; L46-E49 PolarHBondContact O-N 3.12Å; E49-Y51 VanDerWaalsContact C-N 3.34Å; E49-Y51 PolarHBondContact O-N 3.03Å; E49-L52 PolarHBondContact O-N 3.03Å; E49-A53 PolarHBondContact O-N 3.15Å; E49-K90 WeakPolarHBondContact OE1-CE 3.31Å; E49-K90 IonicContact OE1-NZ 3.27Å; E49-K90 PolarHBondContact OE1-NZ 3Å
50	A	91.1	Very high	90.2	Very high	53 Å²	53	55.8 Å²	55.8	44%	0.438	28%	0.279	S	S	.	.	H	α-helix	trans	-65.2	-33.9	178.2	0	0	0	0	0	113.4	L46 R47 L48 K54	L46-A50 PolarHBondContact O-N 3.16Å; R47-A50 PolarHBondContact O-N 2.99Å; L48-A50 PolarHBondContact O-N 3.03Å; A50-K54 WeakPolarHBondContact O-CG 3.42Å
51	Y	92.1	Very high	90.5	Very high	67 Å²	67	56.2 Å²	56.2	26%	0.263	28%	0.279	S	S	.	.	H	α-helix	trans	-77.5	-35.7	174.5	-74.9	-47.9	0	0	0	112.7	K20 V24 R47 L48 E49 K54 C55	K20-Y51 HydrophobicContact CD-CD1 4.48Å; K20-Y51 HydrophobicContact CD-CE1 4.06Å; V24-Y51 HydrophobicContact CG2-CD2 4.03Å; V24-Y51 HydrophobicContact CG2-CE2 4.1Å; R47-Y51 HydrophobicContact CG-CD2 4Å; R47-Y51 HydrophobicContact CG-CE2 3.68Å; R47-Y51 WeakPolarHBondContact O-CD2 3.28Å; R47-Y51 PolarHBondContact O-N 3.3Å; R47-Y51 VanDerWaalsContact O-N 3.17Å; L48-Y51 PolarHBondContact O-N 2.69Å; E49-Y51 VanDerWaalsContact C-N 3.34Å; E49-Y51 PolarHBondContact O-N 3.03Å; Y51-K54 PolarHBondContact O-N 2.64Å; Y51-C55 WeakPolarHBondContact O-CB 3.3Å; Y51-C55 PolarHBondContact O-N 3.2Å; Y51-C55 VanDerWaalsContact O-N 3.08Å
52	L	91.9	Very high	90.5	Very high	9 Å²	9	56.2 Å²	56.2	5%	0.047	28%	0.279	C	S	.	.	H	α-helix	trans	-61.2	-47	176.4	-175.5	64.5	0	0	0	111.2	I21 L48 E49 K54 C55 Q56 W79 V86	I21-L52 HydrophobicContact CD1-CD1 4.4Å; L48-L52 WeakPolarHBondContact O-CB 3.07Å; L48-L52 PolarHBondContact O-N 3.26Å; E49-L52 PolarHBondContact O-N 3.03Å; L52-K54 VanDerWaalsContact C-N 3.33Å; L52-K54 PolarHBondContact O-N 3.06Å; L52-C55 WeakPolarHBondContact O-CA 3.28Å; L52-C55 WeakPolarHBondContact O-CB 3.3Å; L52-C55 PolarHBondContact O-N 3.09Å; L52-Q56 PolarHBondContact O-N 2.76Å; L52-W79 HydrophobicContact CD1-CH2 4.22Å; L52-W79 HydrophobicContact CD1-CZ2 4.37Å; L52-V86 HydrophobicContact CD1-CG1 4.3Å; L52-V86 HydrophobicContact CD1-CG2 4.37Å; L52-V86 HydrophobicContact CD2-CG1 4.14Å
53	A	91.5	Very high	90.5	Very high	54 Å²	54	55.8 Å²	55.8	45%	0.446	28%	0.277	S	S	.	.	H	α-helix	trans	-57.9	-43.2	178.1	0	0	0	0	0	112.5	E49 C55 Q56 E57	E49-A53 PolarHBondContact O-N 3.15Å; A53-C55 VanDerWaalsContact C-N 3.27Å; A53-C55 PolarHBondContact O-N 3.25Å; A53-Q56 PolarHBondContact O-N 2.72Å; A53-E57 PolarHBondContact O-N 3.28Å; A53-E57 VanDerWaalsContact O-N 3.12Å
54	K	91	Very high	90.5	Very high	110 Å²	110	54.9 Å²	54.9	48%	0.478	28%	0.283	S	S	.	.	H	α-helix	trans	-66	-29.7	175.4	-70.3	176.3	-178.6	175.6	0	113.2	A50 Y51 L52 V58	A50-K54 WeakPolarHBondContact O-CG 3.42Å; Y51-K54 PolarHBondContact O-N 2.64Å; L52-K54 VanDerWaalsContact C-N 3.33Å; L52-K54 PolarHBondContact O-N 3.06Å; K54-V58 WeakPolarHBondContact O-CG2 3.34Å
55	C	93.7	Very high	90.3	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-77.9	-37.2	178.9	-158.2	0	0	0	0	111.2	H17 I21 Y51 L52 A53 V58 Q59 W79	H17-C55 HydrophobicContact CB-CB 3.79Å; H17-C55 VanDerWaalsContact CB-SG 3.58Å; I21-C55 HydrophobicContact CD1-CB 3.76Å; Y51-C55 WeakPolarHBondContact O-CB 3.3Å; Y51-C55 PolarHBondContact O-N 3.2Å; Y51-C55 VanDerWaalsContact O-N 3.08Å; L52-C55 WeakPolarHBondContact O-CA 3.28Å; L52-C55 WeakPolarHBondContact O-CB 3.3Å; L52-C55 PolarHBondContact O-N 3.09Å; A53-C55 VanDerWaalsContact C-N 3.27Å; A53-C55 PolarHBondContact O-N 3.25Å; C55-V58 PolarHBondContact O-N 2.89Å; C55-Q59 WeakPolarHBondContact O-CB 3.42Å; C55-Q59 PolarHBondContact O-N 3.45Å; C55-W79 HydrophobicContact CB-CH2 3.95Å; C55-W79 HydrophobicContact CB-CZ3 4.26Å; C55-W79 VanDerWaalsContact SG-CZ3 3.54Å
56	Q	91.3	Very high	90	Very high	62 Å²	62	56.7 Å²	56.7	29%	0.29	29%	0.293	S	S	.	.	H	α-helix	trans	-61	-46.6	173.5	-77.5	171.5	-27.8	0	0	111.4	L52 A53 V58 Q59 E60 W79 E83	L52-Q56 PolarHBondContact O-N 2.76Å; A53-Q56 PolarHBondContact O-N 2.72Å; Q56-V58 VanDerWaalsContact C-N 3.3Å; Q56-V58 PolarHBondContact O-N 3.25Å; Q56-Q59 WeakPolarHBondContact O-CA 3.43Å; Q56-Q59 WeakPolarHBondContact O-CB 3.2Å; Q56-Q59 PolarHBondContact O-N 3.42Å; Q56-E60 WeakPolarHBondContact O-CG 3.33Å; Q56-E60 PolarHBondContact O-N 3.45Å; Q56-W79 HydrophobicContact CB-CZ2 4.43Å; Q56-W79 HydrophobicContact CG-CH2 4.04Å; Q56-W79 HydrophobicContact CG-CZ2 3.43Å; Q56-W79 VanDerWaalsContact CG-CZ2 3.43Å; Q56-E83 PolarHBondContact NE2-OE1 2.99Å
57	E	91.8	Very high	89	Confident	120 Å²	120	59.1 Å²	59.1	56%	0.561	30%	0.299	S	S	*	.	H	α-helix	trans	-55.7	-43.5	177	-171.1	-176.2	-172.2	0	0	112.2	A53 Q59 D61	A53-E57 PolarHBondContact O-N 3.28Å; A53-E57 VanDerWaalsContact O-N 3.12Å; E57-Q59 VanDerWaalsContact C-N 3.34Å; E57-Q59 PolarHBondContact O-N 2.83Å; E57-D61 PolarHBondContact O-N 2.91Å
58	V	92.1	Very high	88.1	Confident	1 Å²	1	59.1 Å²	59.1	1%	0.006	31%	0.306	C	S	.	.	H	α-helix	trans	-71.7	-29.6	177.9	179.5	0	0	0	0	112.4	L10 K13 R14 K54 C55 Q56 L62	L10-V58 HydrophobicContact CB-CG1 4.36Å; L10-V58 HydrophobicContact CD2-CG1 4.13Å; L10-V58 WeakPolarHBondContact O-CG1 3.43Å; K13-V58 HydrophobicContact CB-CG1 4.14Å; K13-V58 HydrophobicContact CD-CG1 4.37Å; K13-V58 HydrophobicContact CD-CG2 3.83Å; K13-V58 HydrophobicContact CG-CG1 4.36Å; K13-V58 HydrophobicContact CG-CG2 4.14Å; R14-V58 HydrophobicContact CB-CG1 3.93Å; K54-V58 WeakPolarHBondContact O-CG2 3.34Å; C55-V58 PolarHBondContact O-N 2.89Å; Q56-V58 VanDerWaalsContact C-N 3.3Å; Q56-V58 PolarHBondContact O-N 3.25Å; V58-L62 PolarHBondContact O-N 2.78Å
59	Q	92	Very high	87.1	Confident	3 Å²	3	61.5 Å²	61.5	1%	0.014	33%	0.331	C	S	.	.	H	α-helix	trans	-70.8	-44.2	176.2	178	67.9	26.7	0	0	110.9	C55 Q56 E57 D61 L62 E63 W79	C55-Q59 WeakPolarHBondContact O-CB 3.42Å; C55-Q59 PolarHBondContact O-N 3.45Å; Q56-Q59 WeakPolarHBondContact O-CA 3.43Å; Q56-Q59 WeakPolarHBondContact O-CB 3.2Å; Q56-Q59 PolarHBondContact O-N 3.42Å; E57-Q59 VanDerWaalsContact C-N 3.34Å; E57-Q59 PolarHBondContact O-N 2.83Å; Q59-D61 VanDerWaalsContact C-N 3.3Å; Q59-D61 PolarHBondContact O-N 3.15Å; Q59-L62 WeakPolarHBondContact O-CB 3.43Å; Q59-L62 PolarHBondContact O-N 3.47Å; Q59-L62 VanDerWaalsContact O-N 3.09Å; Q59-E63 WeakPolarHBondContact CG-OE1 3.47Å; Q59-E63 PolarHBondContact NE2-OE1 3.05Å; Q59-E63 WeakPolarHBondContact O-CG 3.17Å; Q59-E63 PolarHBondContact O-N 2.79Å; Q59-W79 HydrophobicContact CB-CD2 4.19Å; Q59-W79 HydrophobicContact CB-CE3 4.14Å; Q59-W79 HydrophobicContact CB-CZ3 4.41Å; Q59-W79 HydrophobicContact CG-CB 4.19Å; Q59-W79 HydrophobicContact CG-CD2 3.62Å; Q59-W79 HydrophobicContact CG-CE3 3.94Å; Q59-W79 HydrophobicContact CG-CG 3.69Å
60	E	89.8	Confident	86.7	Confident	121 Å²	121	66.6 Å²	66.6	57%	0.565	36%	0.355	S	S	*	.	H	α-helix	trans	-59.2	-40.9	175.1	-70.4	173.7	-175.1	0	0	111.5	Q56 L62 E63 C64	Q56-E60 WeakPolarHBondContact O-CG 3.33Å; Q56-E60 PolarHBondContact O-N 3.45Å; E60-L62 VanDerWaalsContact C-N 3.35Å; E60-L62 PolarHBondContact O-N 3.17Å; E60-E63 PolarHBondContact O-N 3.27Å; E60-C64 PolarHBondContact O-N 2.9Å; E60-C64 PolarHBondContact O-SG 3.23Å
61	D	90.4	Very high	86.1	Confident	74 Å²	74	70.1 Å²	70.1	40%	0.396	36%	0.36	S	S	.	.	H	α-helix	trans	-61.2	-40.1	173.8	-75.8	-21	0	0	0	112.4	L10 E57 Q59 L65	L10-D61 HydrophobicContact CD1-CB 4.01Å; L10-D61 HydrophobicContact CD2-CB 4.21Å; E57-D61 PolarHBondContact O-N 2.91Å; Q59-D61 VanDerWaalsContact C-N 3.3Å; Q59-D61 PolarHBondContact O-N 3.15Å; D61-L65 WeakPolarHBondContact O-CG 3.35Å; D61-L65 PolarHBondContact O-N 2.96Å
62	L	87.4	Confident	85.8	Confident	0 Å²	0	69.1 Å²	69.1	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-67.2	-44.9	177.3	-92.1	159.8	0	0	0	112	V7 L10 R14 V58 Q59 E60 C64 L65 L66	V7-L62 HydrophobicContact CG1-CD2 4.09Å; L10-L62 HydrophobicContact CB-CD1 4.13Å; L10-L62 HydrophobicContact CB-CD2 3.92Å; L10-L62 HydrophobicContact CB-CG 3.69Å; R14-L62 HydrophobicContact CB-CD1 4.15Å; V58-L62 PolarHBondContact O-N 2.78Å; Q59-L62 WeakPolarHBondContact O-CB 3.43Å; Q59-L62 PolarHBondContact O-N 3.47Å; Q59-L62 VanDerWaalsContact O-N 3.09Å; E60-L62 VanDerWaalsContact C-N 3.35Å; E60-L62 PolarHBondContact O-N 3.17Å; L62-C64 VanDerWaalsContact C-N 3.3Å; L62-C64 PolarHBondContact O-N 2.85Å; L62-L65 PolarHBondContact O-N 3.09Å; L62-L65 VanDerWaalsContact O-N 3.08Å; L62-L66 WeakPolarHBondContact O-CG 3.32Å; L62-L66 PolarHBondContact O-N 3.14Å
63	E	86.3	Confident	85.4	Confident	60 Å²	60	74.3 Å²	74.3	28%	0.28	38%	0.383	S	S	.	.	H	α-helix	trans	-62.4	-38.2	178.3	-71.5	175	-167.2	0	0	111.4	Q59 E60 L65 L72 I76	Q59-E63 WeakPolarHBondContact CG-OE1 3.47Å; Q59-E63 PolarHBondContact NE2-OE1 3.05Å; Q59-E63 WeakPolarHBondContact O-CG 3.17Å; Q59-E63 PolarHBondContact O-N 2.79Å; E60-E63 PolarHBondContact O-N 3.27Å; E63-L65 PolarHBondContact O-N 2.9Å; E63-L72 HydrophobicContact CB-CD1 3.9Å; E63-L72 HydrophobicContact CG-CD1 3.93Å; E63-I76 HydrophobicContact CG-CG1 4.31Å
64	C	84.7	Confident	85.1	Confident	102 Å²	102	75.3 Å²	75.3	69%	0.689	39%	0.387	S	S	*	.	H	α-helix	trans	-63	-27.8	174	-73.4	0	0	0	0	113.5	E60 L62	E60-C64 PolarHBondContact O-N 2.9Å; E60-C64 PolarHBondContact O-SG 3.23Å; L62-C64 VanDerWaalsContact C-N 3.3Å; L62-C64 PolarHBondContact O-N 2.85Å
65	L	84.9	Confident	84.8	Confident	44 Å²	44	71.2 Å²	71.2	23%	0.23	37%	0.37	C	S	.	.	H	α-helix	trans	-90.2	-32.5	-178.1	-70.7	171	0	0	0	113.3	E6 V7 L10 D61 L62 E63 K67	E6-L65 HydrophobicContact CG-CD1 4.04Å; V7-L65 HydrophobicContact CG2-CB 3.98Å; V7-L65 HydrophobicContact CG2-CD1 4.29Å; L10-L65 HydrophobicContact CD1-CD1 3.35Å; D61-L65 WeakPolarHBondContact O-CG 3.35Å; D61-L65 PolarHBondContact O-N 2.96Å; L62-L65 PolarHBondContact O-N 3.09Å; L62-L65 VanDerWaalsContact O-N 3.08Å; E63-L65 PolarHBondContact O-N 2.9Å; L65-K67 PolarHBondContact O-N 2.89Å
66	L	82.3	Confident	84.5	Confident	27 Å²	27	74 Å²	74	14%	0.141	38%	0.384	C	S	.	.			trans	-80.2	91	178.4	-68.2	171.2	0	0	0	110.3	V7 L62 K71 L72 E75	V7-L66 HydrophobicContact CG1-CD2 4.34Å; L62-L66 WeakPolarHBondContact O-CG 3.32Å; L62-L66 PolarHBondContact O-N 3.14Å; L66-K71 HydrophobicContact CD2-CB 4.39Å; L66-L72 HydrophobicContact CB-CB 4.27Å; L66-L72 HydrophobicContact CB-CD1 4.18Å; L66-E75 HydrophobicContact CD1-CB 3.89Å; L66-E75 HydrophobicContact CD1-CG 3.86Å
67	K	69	Low	84.4	Confident	166 Å²	166	76 Å²	76	72%	0.722	39%	0.393	S	S	*	.			trans	-81.3	-15.5	176.4	-65.2	-167.3	175.1	-166.2	0	114.4	L65	L65-K67 PolarHBondContact O-N 2.89Å
68	D	71.8	Confident	84.2	Confident	94 Å²	94	73 Å²	73	50%	0.503	39%	0.386	S	S	.	.	S	Bend	trans	-78.7	123.9	-176.5	-66.2	-20.3	0	0	0	110.6	E70 K71 L72	D68-E70 PolarHBondContact O-N 3.08Å; D68-K71 HydrophobicContact CB-CB 4.3Å; D68-K71 HydrophobicContact CB-CD 4.36Å; D68-K71 HydrophobicContact CB-CG 4.49Å; D68-K71 PolarHBondContact O-N 3.37Å; D68-K71 IonicContact OD2-NZ 3.23Å; D68-K71 PolarHBondContact OD2-NZ 3.29Å; D68-L72 VanDerWaalsContact O-CB 3.29Å; D68-L72 WeakPolarHBondContact O-CB 3.3Å; D68-L72 PolarHBondContact O-N 2.94Å
69	G	74.1	Confident	84.2	Confident	53 Å²	53	73.9 Å²	73.9	55%	0.546	39%	0.389	S	S	.	.	H	α-helix	trans	-54.1	-47.5	-173.5	0	0	0	0	0	114.7	Q73	G69-Q73 WeakPolarHBondContact O-CB 3.35Å; G69-Q73 PolarHBondContact O-N 3.16Å
70	E	80.9	Confident	84.1	Confident	178 Å²	178	78.6 Å²	78.6	83%	0.832	41%	0.412	S	S	*	.	H	α-helix	trans	-68.6	-41.3	-179	-71.7	-175	166.6	0	0	113	D68 S74	D68-E70 PolarHBondContact O-N 3.08Å; E70-S74 WeakPolarHBondContact O-CB 3.3Å; E70-S74 PolarHBondContact O-N 2.87Å
71	K	80.1	Confident	84.1	Confident	127 Å²	127	76.1 Å²	76.1	55%	0.552	41%	0.412	S	S	*	.	H	α-helix	trans	-71.2	-42.3	-179.4	-70.8	178.8	-174.2	156.6	0	111.6	L66 D68 Q73 E75	L66-K71 HydrophobicContact CD2-CB 4.39Å; D68-K71 HydrophobicContact CB-CB 4.3Å; D68-K71 HydrophobicContact CB-CD 4.36Å; D68-K71 HydrophobicContact CB-CG 4.49Å; D68-K71 PolarHBondContact O-N 3.37Å; D68-K71 IonicContact OD2-NZ 3.23Å; D68-K71 PolarHBondContact OD2-NZ 3.29Å; K71-Q73 VanDerWaalsContact C-N 3.33Å; K71-E75 WeakPolarHBondContact O-CB 3.46Å; K71-E75 PolarHBondContact O-N 2.83Å
72	L	84.5	Confident	84.1	Confident	46 Å²	46	73.9 Å²	73.9	24%	0.241	40%	0.399	C	S	.	.	H	α-helix	trans	-61.6	-45.6	174.9	178.8	62.8	0	0	0	110.1	E63 L66 D68 E75 I76	E63-L72 HydrophobicContact CB-CD1 3.9Å; E63-L72 HydrophobicContact CG-CD1 3.93Å; L66-L72 HydrophobicContact CB-CB 4.27Å; L66-L72 HydrophobicContact CB-CD1 4.18Å; D68-L72 VanDerWaalsContact O-CB 3.29Å; D68-L72 WeakPolarHBondContact O-CB 3.3Å; D68-L72 PolarHBondContact O-N 2.94Å; L72-E75 PolarHBondContact O-N 2.94Å; L72-I76 HydrophobicContact CD1-CD1 3.99Å; L72-I76 HydrophobicContact CD1-CG1 4.28Å; L72-I76 HydrophobicContact CG-CD1 3.85Å; L72-I76 HydrophobicContact CG-CG1 4.5Å; L72-I76 VanDerWaalsContact O-CG1 3.31Å; L72-I76 WeakPolarHBondContact O-CG1 3.3Å; L72-I76 PolarHBondContact O-N 3Å
73	Q	83.4	Confident	84.3	Confident	119 Å²	119	76.2 Å²	76.2	56%	0.556	41%	0.41	S	S	*	.	H	α-helix	trans	-65	-43.9	-179.7	-173.3	149.1	-8	0	0	112.4	G69 K71 E75 I76 E77	G69-Q73 WeakPolarHBondContact O-CB 3.35Å; G69-Q73 PolarHBondContact O-N 3.16Å; K71-Q73 VanDerWaalsContact C-N 3.33Å; Q73-E75 VanDerWaalsContact C-N 3.28Å; Q73-E75 PolarHBondContact O-N 2.87Å; Q73-I76 PolarHBondContact O-N 2.92Å; Q73-E77 WeakPolarHBondContact O-CB 3.5Å; Q73-E77 WeakPolarHBondContact O-CG 3.28Å; Q73-E77 PolarHBondContact O-N 3.03Å
74	S	84.8	Confident	84.4	Confident	75 Å²	75	76.5 Å²	76.5	52%	0.524	42%	0.418	S	S	.	.	H	α-helix	trans	-60.5	-37	173.3	176.3	0	0	0	0	112.5	E70 S78	E70-S74 WeakPolarHBondContact O-CB 3.3Å; E70-S74 PolarHBondContact O-N 2.87Å; S74-S78 WeakPolarHBondContact O-CB 3.18Å; S74-S78 PolarHBondContact O-N 2.7Å
75	E	86.3	Confident	84.6	Confident	24 Å²	24	74 Å²	74	11%	0.112	40%	0.402	C	S	.	.	H	α-helix	trans	-70.9	-40.7	178.2	-172.5	74.3	153.3	0	0	112	R14 L66 K71 L72 Q73 S78 W79	R14-E75 IonicContact CZ-OE1 2.82Å; R14-E75 IonicContact CZ-OE2 3.7Å; R14-E75 IonicContact NE-OE1 3.91Å; R14-E75 IonicContact NH1-OE1 3.18Å; R14-E75 PolarHBondContact NH1-OE1 2.71Å; R14-E75 IonicContact NH1-OE2 3.64Å; R14-E75 PolarHBondContact NH1-OE2 3.15Å; R14-E75 IonicContact NH2-OE1 2.6Å; R14-E75 PolarHBondContact NH2-OE1 3.17Å; R14-E75 IonicContact NH2-OE2 3.75Å; R14-E75 PolarHBondContact NH2-OE2 2.81Å; R14-E75 VanDerWaalsContact NH2-OE2 3.1Å; L66-E75 HydrophobicContact CD1-CB 3.89Å; L66-E75 HydrophobicContact CD1-CG 3.86Å; K71-E75 WeakPolarHBondContact O-CB 3.46Å; K71-E75 PolarHBondContact O-N 2.83Å; L72-E75 PolarHBondContact O-N 2.94Å; Q73-E75 VanDerWaalsContact C-N 3.28Å; Q73-E75 PolarHBondContact O-N 2.87Å; E75-S78 PolarHBondContact O-N 2.84Å; E75-W79 WeakPolarHBondContact O-CB 3.46Å; E75-W79 PolarHBondContact O-N 3.02Å
76	I	86.8	Confident	85	Confident	59 Å²	59	71.9 Å²	71.9	30%	0.303	39%	0.391	S	S	.	.	H	α-helix	trans	-64.3	-44.6	174.6	-68	168.7	0	0	0	110.4	E63 L72 Q73 S78 W79 M80	E63-I76 HydrophobicContact CG-CG1 4.31Å; L72-I76 HydrophobicContact CD1-CD1 3.99Å; L72-I76 HydrophobicContact CD1-CG1 4.28Å; L72-I76 HydrophobicContact CG-CD1 3.85Å; L72-I76 HydrophobicContact CG-CG1 4.5Å; L72-I76 VanDerWaalsContact O-CG1 3.31Å; L72-I76 WeakPolarHBondContact O-CG1 3.3Å; L72-I76 PolarHBondContact O-N 3Å; Q73-I76 PolarHBondContact O-N 2.92Å; I76-S78 VanDerWaalsContact C-N 3.35Å; I76-S78 PolarHBondContact O-N 2.95Å; I76-W79 PolarHBondContact O-N 3.05Å; I76-M80 HydrophobicContact CG2-CE 3.98Å; I76-M80 HydrophobicContact CG2-CG 4.37Å; I76-M80 HydrophobicContact CG2-SD 4.3Å; I76-M80 WeakPolarHBondContact O-CG 3.31Å; I76-M80 PolarHBondContact O-N 2.93Å
77	E	89	Confident	85.3	Confident	104 Å²	104	74.2 Å²	74.2	49%	0.486	40%	0.402	S	S	.	.	H	α-helix	trans	-60.9	-42.9	176.9	-75.1	173.8	-172.1	0	0	112.1	Q73 M80 A81	Q73-E77 WeakPolarHBondContact O-CB 3.5Å; Q73-E77 WeakPolarHBondContact O-CG 3.28Å; Q73-E77 PolarHBondContact O-N 3.03Å; E77-M80 HydrophobicContact CG-CE 4.27Å; E77-M80 PolarHBondContact O-N 2.92Å; E77-A81 PolarHBondContact O-N 2.78Å
78	S	87.8	Confident	86.3	Confident	57 Å²	57	71 Å²	71	40%	0.399	39%	0.393	S	S	.	.	H	α-helix	trans	-61.4	-43.9	174.5	178.7	0	0	0	0	112.1	S74 E75 I76 A81 F82	S74-S78 WeakPolarHBondContact O-CB 3.18Å; S74-S78 PolarHBondContact O-N 2.7Å; E75-S78 PolarHBondContact O-N 2.84Å; I76-S78 VanDerWaalsContact C-N 3.35Å; I76-S78 PolarHBondContact O-N 2.95Å; S78-A81 PolarHBondContact O-N 3.13Å; S78-F82 PolarHBondContact O-N 3.09Å; S78-F82 VanDerWaalsContact O-N 3.11Å
79	W	91.4	Very high	87.2	Confident	18 Å²	18	66.9 Å²	66.9	7%	0.068	37%	0.371	C	S	.	.	H	α-helix	trans	-64.6	-46.6	177	177	-104.2	0	0	0	112.3	L52 C55 Q56 Q59 E75 I76 A81 F82 E83	L52-W79 HydrophobicContact CD1-CH2 4.22Å; L52-W79 HydrophobicContact CD1-CZ2 4.37Å; C55-W79 HydrophobicContact CB-CH2 3.95Å; C55-W79 HydrophobicContact CB-CZ3 4.26Å; C55-W79 VanDerWaalsContact SG-CZ3 3.54Å; Q56-W79 HydrophobicContact CB-CZ2 4.43Å; Q56-W79 HydrophobicContact CG-CH2 4.04Å; Q56-W79 HydrophobicContact CG-CZ2 3.43Å; Q56-W79 VanDerWaalsContact CG-CZ2 3.43Å; Q59-W79 HydrophobicContact CB-CD2 4.19Å; Q59-W79 HydrophobicContact CB-CE3 4.14Å; Q59-W79 HydrophobicContact CB-CZ3 4.41Å; Q59-W79 HydrophobicContact CG-CB 4.19Å; Q59-W79 HydrophobicContact CG-CD2 3.62Å; Q59-W79 HydrophobicContact CG-CE3 3.94Å; Q59-W79 HydrophobicContact CG-CG 3.69Å; E75-W79 WeakPolarHBondContact O-CB 3.46Å; E75-W79 PolarHBondContact O-N 3.02Å; I76-W79 PolarHBondContact O-N 3.05Å; W79-A81 VanDerWaalsContact C-N 3.3Å; W79-A81 PolarHBondContact O-N 3.05Å; W79-F82 HydrophobicContact CE3-CD1 4.2Å; W79-F82 HydrophobicContact CH2-CD1 4.2Å; W79-F82 HydrophobicContact CH2-CE1 4.4Å; W79-F82 AromaticContact CZ3-CD1 3.77Å; W79-F82 HydrophobicContact CZ3-CD1 3.77Å; W79-F82 HydrophobicContact CZ3-CE1 4.16Å; W79-F82 WeakPolarHBondContact O-CB 3.44Å; W79-F82 PolarHBondContact O-N 2.82Å; W79-F82 VanDerWaalsContact O-N 3.09Å; W79-E83 WeakPolarHBondContact O-CB 3.37Å; W79-E83 PolarHBondContact O-N 3.31Å
80	M	90	Very high	87.9	Confident	102 Å²	102	66 Å²	66	50%	0.502	35%	0.352	S	S	.	.	H	α-helix	trans	-59.9	-40	177.9	-72.9	-170.2	-60.8	0	0	111.9	I76 E77 F82 E83 S84	I76-M80 HydrophobicContact CG2-CE 3.98Å; I76-M80 HydrophobicContact CG2-CG 4.37Å; I76-M80 HydrophobicContact CG2-SD 4.3Å; I76-M80 WeakPolarHBondContact O-CG 3.31Å; I76-M80 PolarHBondContact O-N 2.93Å; E77-M80 HydrophobicContact CG-CE 4.27Å; E77-M80 PolarHBondContact O-N 2.92Å; M80-F82 VanDerWaalsContact C-N 3.35Å; M80-E83 PolarHBondContact O-N 3Å; M80-S84 VanDerWaalsContact O-CB 3.28Å; M80-S84 WeakPolarHBondContact O-CB 3.42Å; M80-S84 PolarHBondContact O-N 3.1Å
81	A	89.3	Confident	88.3	Confident	69 Å²	69	62 Å²	62	57%	0.57	34%	0.34	S	S	*	.	H	α-helix	trans	-63	-41.4	175	0	0	0	0	0	112	E77 S78 W79 S85	E77-A81 PolarHBondContact O-N 2.78Å; S78-A81 PolarHBondContact O-N 3.13Å; W79-A81 VanDerWaalsContact C-N 3.3Å; W79-A81 PolarHBondContact O-N 3.05Å; A81-S85 PolarHBondContact O-N 2.92Å
82	F	91.9	Very high	88.7	Confident	27 Å²	27	60.9 Å²	60.9	12%	0.118	34%	0.335	C	S	.	.	H	α-helix	trans	-66.6	-48.2	176	179.5	-100.2	0	0	0	112.1	Q18 I21 S78 W79 M80 S84 S85 V86	Q18-F82 HydrophobicContact CB-CE1 4.48Å; Q18-F82 HydrophobicContact CB-CE2 3.9Å; Q18-F82 HydrophobicContact CB-CZ 3.86Å; Q18-F82 HydrophobicContact CG-CD1 4.15Å; Q18-F82 HydrophobicContact CG-CD2 4.25Å; Q18-F82 HydrophobicContact CG-CE1 3.83Å; Q18-F82 HydrophobicContact CG-CE2 3.93Å; Q18-F82 HydrophobicContact CG-CG 4.35Å; Q18-F82 HydrophobicContact CG-CZ 3.71Å; I21-F82 HydrophobicContact CB-CZ 3.81Å; I21-F82 HydrophobicContact CD1-CE1 3.91Å; I21-F82 HydrophobicContact CD1-CZ 3.99Å; I21-F82 HydrophobicContact CG2-CE1 4.14Å; I21-F82 HydrophobicContact CG2-CE2 4.42Å; I21-F82 HydrophobicContact CG2-CZ 3.52Å; S78-F82 PolarHBondContact O-N 3.09Å; S78-F82 VanDerWaalsContact O-N 3.11Å; W79-F82 HydrophobicContact CE3-CD1 4.2Å; W79-F82 HydrophobicContact CH2-CD1 4.2Å; W79-F82 HydrophobicContact CH2-CE1 4.4Å; W79-F82 AromaticContact CZ3-CD1 3.77Å; W79-F82 HydrophobicContact CZ3-CD1 3.77Å; W79-F82 HydrophobicContact CZ3-CE1 4.16Å; W79-F82 WeakPolarHBondContact O-CB 3.44Å; W79-F82 PolarHBondContact O-N 2.82Å; W79-F82 VanDerWaalsContact O-N 3.09Å; M80-F82 VanDerWaalsContact C-N 3.35Å; F82-S84 VanDerWaalsContact C-N 3.3Å; F82-S84 PolarHBondContact O-N 3.36Å; F82-S85 WeakPolarHBondContact O-CB 3.5Å; F82-S85 PolarHBondContact O-N 2.88Å; F82-S85 VanDerWaalsContact O-N 3.12Å; F82-S85 PolarHBondContact O-OG 3.28Å; F82-V86 HydrophobicContact CD1-CG2 4.29Å; F82-V86 HydrophobicContact CE1-CG2 3.88Å; F82-V86 HydrophobicContact CZ-CG2 4.09Å; F82-V86 WeakPolarHBondContact O-CG2 3.45Å; F82-V86 PolarHBondContact O-N 3.39Å
83	E	90.8	Very high	88.8	Confident	49 Å²	49	58.7 Å²	58.7	23%	0.229	32%	0.323	C	S	.	.	H	α-helix	trans	-61	-39.3	179.3	-175.2	168.9	-137.7	0	0	111.9	Q56 W79 M80 S85 V86 M87	Q56-E83 PolarHBondContact NE2-OE1 2.99Å; W79-E83 WeakPolarHBondContact O-CB 3.37Å; W79-E83 PolarHBondContact O-N 3.31Å; M80-E83 PolarHBondContact O-N 3Å; E83-S85 VanDerWaalsContact C-N 3.33Å; E83-S85 PolarHBondContact O-N 2.93Å; E83-V86 WeakPolarHBondContact O-CB 3.43Å; E83-V86 PolarHBondContact O-N 2.75Å; E83-V86 VanDerWaalsContact O-N 3.14Å; E83-M87 WeakPolarHBondContact O-CG 3.41Å; E83-M87 PolarHBondContact O-N 3.11Å
84	S	89.7	Confident	88.9	Confident	66 Å²	66	58.1 Å²	58.1	46%	0.462	32%	0.319	S	S	.	.	H	α-helix	trans	-56.8	-45.7	173.3	-170.2	0	0	0	0	111.9	M80 F82 V86 M87 D88	M80-S84 VanDerWaalsContact O-CB 3.28Å; M80-S84 WeakPolarHBondContact O-CB 3.42Å; M80-S84 PolarHBondContact O-N 3.1Å; F82-S84 VanDerWaalsContact C-N 3.3Å; F82-S84 PolarHBondContact O-N 3.36Å; S84-V86 VanDerWaalsContact C-N 3.29Å; S84-V86 PolarHBondContact O-N 3.34Å; S84-M87 PolarHBondContact O-N 3.39Å; S84-M87 VanDerWaalsContact O-N 3.14Å; S84-D88 PolarHBondContact O-N 2.92Å
85	S	88.8	Confident	89	Confident	49 Å²	49	59.3 Å²	59.3	34%	0.343	32%	0.316	S	S	.	.	H	α-helix	trans	-62.9	-33.1	177.3	79	0	0	0	0	113.6	A81 F82 E83 V89	A81-S85 PolarHBondContact O-N 2.92Å; F82-S85 WeakPolarHBondContact O-CB 3.5Å; F82-S85 PolarHBondContact O-N 2.88Å; F82-S85 VanDerWaalsContact O-N 3.12Å; F82-S85 PolarHBondContact O-OG 3.28Å; E83-S85 VanDerWaalsContact C-N 3.33Å; E83-S85 PolarHBondContact O-N 2.93Å; S85-V89 WeakPolarHBondContact O-CG2 3.36Å
86	V	92.9	Very high	88.9	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-70.6	-42.3	175.5	-179	0	0	0	0	110.2	I21 I25 L48 L52 F82 E83 S84 V89 K90	I21-V86 HydrophobicContact CG2-CG2 3.7Å; I25-V86 HydrophobicContact CD1-CB 4.33Å; I25-V86 HydrophobicContact CD1-CG2 3.87Å; L48-V86 HydrophobicContact CD1-CG1 4.12Å; L48-V86 HydrophobicContact CD2-CG1 4.14Å; L48-V86 HydrophobicContact CG-CG1 4.19Å; L52-V86 HydrophobicContact CD1-CG1 4.3Å; L52-V86 HydrophobicContact CD1-CG2 4.37Å; L52-V86 HydrophobicContact CD2-CG1 4.14Å; F82-V86 HydrophobicContact CD1-CG2 4.29Å; F82-V86 HydrophobicContact CE1-CG2 3.88Å; F82-V86 HydrophobicContact CZ-CG2 4.09Å; F82-V86 WeakPolarHBondContact O-CG2 3.45Å; F82-V86 PolarHBondContact O-N 3.39Å; E83-V86 WeakPolarHBondContact O-CB 3.43Å; E83-V86 PolarHBondContact O-N 2.75Å; E83-V86 VanDerWaalsContact O-N 3.14Å; S84-V86 VanDerWaalsContact C-N 3.29Å; S84-V86 PolarHBondContact O-N 3.34Å; V86-V89 PolarHBondContact O-N 3.22Å; V86-K90 WeakPolarHBondContact O-CB 3.41Å; V86-K90 PolarHBondContact O-N 3.12Å
87	M	89.1	Confident	88.6	Confident	76 Å²	76	57.4 Å²	57.4	37%	0.374	31%	0.306	S	S	.	.	H	α-helix	trans	-65.9	-39.6	-179.2	-73.1	-61	179.1	0	0	112.3	E83 S84 V89 K90 V91	E83-M87 WeakPolarHBondContact O-CG 3.41Å; E83-M87 PolarHBondContact O-N 3.11Å; S84-M87 PolarHBondContact O-N 3.39Å; S84-M87 VanDerWaalsContact O-N 3.14Å; M87-V89 VanDerWaalsContact C-N 3.29Å; M87-V89 PolarHBondContact O-N 3.25Å; M87-K90 PolarHBondContact O-N 2.93Å; M87-K90 HydrophobicContact SD-CD 4.11Å; M87-V91 WeakPolarHBondContact O-CB 3.48Å; M87-V91 VanDerWaalsContact O-CG2 3.29Å; M87-V91 WeakPolarHBondContact O-CG2 3.37Å; M87-V91 PolarHBondContact O-N 2.85Å
88	D	89.6	Confident	88.1	Confident	100 Å²	100	58.3 Å²	58.3	54%	0.535	31%	0.31	S	S	.	.	H	α-helix	trans	-55	-46.4	175.9	-82.1	-13.6	0	0	0	111.9	S84 V91 K92	S84-D88 PolarHBondContact O-N 2.92Å; D88-V91 PolarHBondContact O-N 3.48Å; D88-K92 WeakPolarHBondContact O-CG 3.42Å; D88-K92 PolarHBondContact O-N 2.78Å
89	V	89.7	Confident	87.4	Confident	7 Å²	7	61.8 Å²	61.8	4%	0.042	32%	0.32	C	S	.	.	H	α-helix	trans	-71	-38.8	-179.4	176	0	0	0	0	110.8	I25 L28 S85 V86 M87 V91 K92 A93	I25-V89 HydrophobicContact CG1-CB 4.44Å; I25-V89 HydrophobicContact CG1-CG1 4.38Å; I25-V89 HydrophobicContact CG1-CG2 4.39Å; I25-V89 HydrophobicContact CG2-CB 4.41Å; I25-V89 HydrophobicContact CG2-CG1 4.3Å; I25-V89 HydrophobicContact CG2-CG2 3.62Å; L28-V89 HydrophobicContact CB-CG1 3.98Å; L28-V89 HydrophobicContact CD2-CG1 3.7Å; L28-V89 HydrophobicContact CG-CG1 4.41Å; S85-V89 WeakPolarHBondContact O-CG2 3.36Å; V86-V89 PolarHBondContact O-N 3.22Å; M87-V89 VanDerWaalsContact C-N 3.29Å; M87-V89 PolarHBondContact O-N 3.25Å; V89-V91 VanDerWaalsContact C-N 3.32Å; V89-V91 PolarHBondContact O-N 2.9Å; V89-K92 PolarHBondContact O-N 3.22Å; V89-A93 WeakPolarHBondContact O-CB 3.49Å; V89-A93 PolarHBondContact O-N 3.05Å
90	K	89.9	Confident	86.2	Confident	33 Å²	33	65 Å²	65	14%	0.143	34%	0.336	C	S	.	.	H	α-helix	trans	-63.1	-38.6	175	-169.9	175.7	177.8	168.8	0	111.7	M45 E49 V86 M87 K94	M45-K90 HydrophobicContact CE-CG 4.33Å; E49-K90 WeakPolarHBondContact OE1-CE 3.31Å; E49-K90 IonicContact OE1-NZ 3.27Å; E49-K90 PolarHBondContact OE1-NZ 3Å; V86-K90 WeakPolarHBondContact O-CB 3.41Å; V86-K90 PolarHBondContact O-N 3.12Å; M87-K90 PolarHBondContact O-N 2.93Å; M87-K90 HydrophobicContact SD-CD 4.11Å; K90-K94 WeakPolarHBondContact O-CB 3.44Å; K90-K94 WeakPolarHBondContact O-CG 3.4Å; K90-K94 PolarHBondContact O-N 3.23Å
91	V	89.5	Confident	84.2	Confident	94 Å²	94	66.6 Å²	66.6	57%	0.57	34%	0.34	S	S	*	.	H	α-helix	trans	-66.9	-46.8	175.1	170.2	0	0	0	0	110.5	M87 D88 V89 A93 K94 H95	M87-V91 WeakPolarHBondContact O-CB 3.48Å; M87-V91 VanDerWaalsContact O-CG2 3.29Å; M87-V91 WeakPolarHBondContact O-CG2 3.37Å; M87-V91 PolarHBondContact O-N 2.85Å; D88-V91 PolarHBondContact O-N 3.48Å; V89-V91 VanDerWaalsContact C-N 3.32Å; V89-V91 PolarHBondContact O-N 2.9Å; V91-A93 VanDerWaalsContact C-N 3.35Å; V91-A93 PolarHBondContact O-N 3.17Å; V91-K94 PolarHBondContact O-N 2.73Å; V91-H95 WeakPolarHBondContact O-CB 3.49Å; V91-H95 PolarHBondContact O-N 2.94Å
92	K	87.8	Confident	82	Confident	104 Å²	104	70.9 Å²	70.9	45%	0.452	35%	0.353	S	S	.	.	H	α-helix	trans	-56.3	-47.4	174.8	-73	178.1	-173	176.6	0	112.1	D29 D88 V89 H95 Y96	D29-K92 IonicContact OD1-NZ 3.06Å; D88-K92 WeakPolarHBondContact O-CG 3.42Å; D88-K92 PolarHBondContact O-N 2.78Å; V89-K92 PolarHBondContact O-N 3.22Å; K92-H95 PolarHBondContact O-N 3.21Å; K92-Y96 WeakPolarHBondContact O-CB 3.29Å; K92-Y96 PolarHBondContact O-N 3.38Å
93	A	85.9	Confident	78.9	Confident	0 Å²	0	76 Å²	76	0%	0	39%	0.386	C	S	.	.	H	α-helix	trans	-65.8	-43.4	178.8	0	0	0	0	0	112.2	L28 V32 V41 M45 V89 V91 H95 Y96 L97	L28-A93 HydrophobicContact CD2-CB 3.41Å; L28-A93 VanDerWaalsContact CD2-CB 3.41Å; L28-A93 HydrophobicContact CG-CB 4.11Å; V32-A93 HydrophobicContact CG2-CB 4.12Å; V41-A93 HydrophobicContact CG1-CB 4.01Å; M45-A93 HydrophobicContact CG-CB 3.95Å; M45-A93 HydrophobicContact SD-CB 3.72Å; V89-A93 WeakPolarHBondContact O-CB 3.49Å; V89-A93 PolarHBondContact O-N 3.05Å; V91-A93 VanDerWaalsContact C-N 3.35Å; V91-A93 PolarHBondContact O-N 3.17Å; A93-H95 VanDerWaalsContact C-N 3.3Å; A93-H95 PolarHBondContact O-N 3.18Å; A93-Y96 WeakPolarHBondContact O-CB 3.48Å; A93-Y96 PolarHBondContact O-N 3.39Å; A93-L97 VanDerWaalsContact O-CG 3.25Å; A93-L97 WeakPolarHBondContact O-CG 3.49Å; A93-L97 PolarHBondContact O-N 3.22Å
94	K	86.5	Confident	75.9	Confident	108 Å²	108	81.8 Å²	81.8	47%	0.47	41%	0.414	S	S	.	.	H	α-helix	trans	-59.9	-40.4	173.8	-80.6	-175.5	176	-175.5	0	112.5	M45 K90 V91 L97 Q98	M45-K94 HydrophobicContact CE-CD 4.43Å; M45-K94 HydrophobicContact CE-CG 3.66Å; M45-K94 HydrophobicContact SD-CG 4.23Å; K90-K94 WeakPolarHBondContact O-CB 3.44Å; K90-K94 WeakPolarHBondContact O-CG 3.4Å; K90-K94 PolarHBondContact O-N 3.23Å; V91-K94 PolarHBondContact O-N 2.73Å; K94-L97 PolarHBondContact O-N 2.99Å; K94-Q98 WeakPolarHBondContact O-CB 3.21Å; K94-Q98 PolarHBondContact O-N 2.66Å
95	H	86.2	Confident	72.8	Confident	99 Å²	99	85.4 Å²	85.4	46%	0.458	43%	0.433	S	S	.	.	H	α-helix	trans	-66.5	-42.5	177.2	-168	-104.5	0	0	0	111.3	V91 K92 A93 L97 Q98 Q99	V91-H95 WeakPolarHBondContact O-CB 3.49Å; V91-H95 PolarHBondContact O-N 2.94Å; K92-H95 PolarHBondContact O-N 3.21Å; A93-H95 VanDerWaalsContact C-N 3.3Å; A93-H95 PolarHBondContact O-N 3.18Å; H95-L97 PolarHBondContact O-N 3.33Å; H95-Q98 PolarHBondContact O-N 3.21Å; H95-Q99 PolarHBondContact CE1-NE2 3.4Å; H95-Q99 PolarHBondContact ND1-NE2 3.04Å; H95-Q99 WeakPolarHBondContact O-CG 3.47Å; H95-Q99 PolarHBondContact O-N 2.87Å
96	Y	84.3	Confident	69.7	Low	21 Å²	21	90 Å²	90	8%	0.082	45%	0.453	C	S	.	.	H	α-helix	trans	-57	-48.2	172.1	-179.6	-96.8	0	0	0	111.9	V32 K35 A36 V41 K92 A93 Q98 Q99 H100	V32-Y96 HydrophobicContact CG1-CD2 4.08Å; V32-Y96 HydrophobicContact CG1-CG 4.14Å; V32-Y96 HydrophobicContact CG2-CG 4.31Å; K35-Y96 VanDerWaalsContact CA-OH 3.24Å; K35-Y96 WeakPolarHBondContact CA-OH 3.37Å; K35-Y96 PolarHBondContact O-OH 3.15Å; A36-Y96 PolarHBondContact N-OH 2.81Å; A36-Y96 WeakPolarHBondContact O-CE1 3.48Å; A36-Y96 PolarHBondContact O-OH 3.27Å; V41-Y96 HydrophobicContact CB-CD1 4.48Å; V41-Y96 HydrophobicContact CG1-CD1 4.28Å; V41-Y96 HydrophobicContact CG2-CD1 4.06Å; V41-Y96 HydrophobicContact CG2-CE1 3.88Å; K92-Y96 WeakPolarHBondContact O-CB 3.29Å; K92-Y96 PolarHBondContact O-N 3.38Å; A93-Y96 WeakPolarHBondContact O-CB 3.48Å; A93-Y96 PolarHBondContact O-N 3.39Å; Y96-Q98 VanDerWaalsContact C-N 3.28Å; Y96-Q98 PolarHBondContact O-N 2.89Å; Y96-Q99 PolarHBondContact O-N 3.46Å; Y96-H100 AromaticContact CD2-CD2 3.75Å; Y96-H100 AromaticContact CD2-NE2 3.99Å; Y96-H100 AromaticContact CE2-CD2 3.4Å; Y96-H100 VanDerWaalsContact CE2-CD2 3.4Å; Y96-H100 WeakPolarHBondContact CE2-CD2 3.18Å; Y96-H100 AromaticContact CE2-NE2 3.36Å; Y96-H100 WeakPolarHBondContact CE2-NE2 3.43Å; Y96-H100 AromaticContact CZ-CD2 3.56Å; Y96-H100 AromaticContact CZ-NE2 3.76Å; Y96-H100 PolarHBondContact O-CD2 2.92Å; Y96-H100 PolarHBondContact O-N 3.15Å; Y96-H100 VanDerWaalsContact O-N 3.09Å
97	L	81.7	Confident	66.4	Low	22 Å²	22	99.9 Å²	99.9	12%	0.115	50%	0.499	C	S	.	.	H	α-helix	trans	-63.1	-32.2	176.8	-66.2	176	0	0	0	112.8	R38 V41 E42 M45 A93 K94 H95	R38-L97 HydrophobicContact CB-CD2 4.33Å; R38-L97 HydrophobicContact CG-CD2 3.38Å; V41-L97 HydrophobicContact CB-CD2 4.01Å; V41-L97 HydrophobicContact CG1-CD1 4.44Å; V41-L97 HydrophobicContact CG1-CD2 3.99Å; V41-L97 HydrophobicContact CG1-CG 4.12Å; E42-L97 HydrophobicContact CG-CD1 3.73Å; E42-L97 HydrophobicContact CG-CD2 3.67Å; E42-L97 HydrophobicContact CG-CG 4.36Å; M45-L97 HydrophobicContact SD-CD1 3.47Å; M45-L97 WeakPolarHBondContact SD-CD1 3.27Å; A93-L97 VanDerWaalsContact O-CG 3.25Å; A93-L97 WeakPolarHBondContact O-CG 3.49Å; A93-L97 PolarHBondContact O-N 3.22Å; K94-L97 PolarHBondContact O-N 2.99Å; H95-L97 PolarHBondContact O-N 3.33Å
98	Q	78.2	Confident	63.4	Low	123 Å²	123	99 Å²	99	58%	0.575	50%	0.504	S	S	*	.	H	α-helix	trans	-74.4	-40	174.9	-90.5	-177.6	-10.5	0	0	113.2	K94 H95 Y96 H100 K101	K94-Q98 WeakPolarHBondContact O-CB 3.21Å; K94-Q98 PolarHBondContact O-N 2.66Å; H95-Q98 PolarHBondContact O-N 3.21Å; Y96-Q98 VanDerWaalsContact C-N 3.28Å; Y96-Q98 PolarHBondContact O-N 2.89Å; Q98-H100 VanDerWaalsContact C-N 3.29Å; Q98-H100 PolarHBondContact O-N 3.06Å; Q98-K101 WeakPolarHBondContact O-CB 3.44Å; Q98-K101 WeakPolarHBondContact O-CG 3.23Å; Q98-K101 PolarHBondContact O-N 2.9Å
99	Q	72	Confident	60.3	Low	131 Å²	131	104.3 Å²	104.3	61%	0.612	52%	0.522	S	S	*	.	H	α-helix	trans	-68.8	-30.3	179	-74.4	-171.8	-17.9	0	0	112.4	H95 Y96 K101	H95-Q99 PolarHBondContact CE1-NE2 3.4Å; H95-Q99 PolarHBondContact ND1-NE2 3.04Å; H95-Q99 WeakPolarHBondContact O-CG 3.47Å; H95-Q99 PolarHBondContact O-N 2.87Å; Y96-Q99 PolarHBondContact O-N 3.46Å; Q99-K101 PolarHBondContact O-N 2.74Å
100	H	67.7	Low	57.4	Low	86 Å²	86	112.2 Å²	112.2	40%	0.398	55%	0.553	S	S	.	*	T	Hydrogen-bonded Turn	trans	-92.8	34.8	172.9	-69	-77.7	0	0	0	112.4	Y96 Q98 D102	Y96-H100 AromaticContact CD2-CD2 3.75Å; Y96-H100 AromaticContact CD2-NE2 3.99Å; Y96-H100 AromaticContact CE2-CD2 3.4Å; Y96-H100 VanDerWaalsContact CE2-CD2 3.4Å; Y96-H100 WeakPolarHBondContact CE2-CD2 3.18Å; Y96-H100 AromaticContact CE2-NE2 3.36Å; Y96-H100 WeakPolarHBondContact CE2-NE2 3.43Å; Y96-H100 AromaticContact CZ-CD2 3.56Å; Y96-H100 AromaticContact CZ-NE2 3.76Å; Y96-H100 PolarHBondContact O-CD2 2.92Å; Y96-H100 PolarHBondContact O-N 3.15Å; Y96-H100 VanDerWaalsContact O-N 3.09Å; Q98-H100 VanDerWaalsContact C-N 3.29Å; Q98-H100 PolarHBondContact O-N 3.06Å; H100-D102 PolarHBondContact O-N 3.26Å
101	K	46.4	Very low	54.6	Low	134 Å²	134	116.4 Å²	116.4	58%	0.583	58%	0.583	S	S	*	*			trans	-77.3	106.8	163.6	-88.4	-178.1	170.8	-177.2	0	108.3	Q98 Q99 T103	Q98-K101 WeakPolarHBondContact O-CB 3.44Å; Q98-K101 WeakPolarHBondContact O-CG 3.23Å; Q98-K101 PolarHBondContact O-N 2.9Å; Q99-K101 PolarHBondContact O-N 2.74Å; K101-T103 PolarHBondContact O-N 2.99Å; K101-T103 PolarHBondContact O-OG1 3.39Å
102	D	43.7	Very low	51.8	Low	160 Å²	160	116.2 Å²	116.2	86%	0.856	59%	0.592	S	S	*	*			trans	-50.4	116.6	174.2	-71.7	-39.7	0	0	0	110.5	H100 E104	H100-D102 PolarHBondContact O-N 3.26Å; D102-E104 PolarHBondContact O-N 2.78Å
103	T	27.2	Very low	49.4	Very low	133 Å²	133	116.9 Å²	116.9	82%	0.816	61%	0.607	S	S	*	*			trans	-89	92.2	173.5	-42.5	0	0	0	0	105.2	K101	K101-T103 PolarHBondContact O-N 2.99Å; K101-T103 PolarHBondContact O-OG1 3.39Å
104	E	26.7	Very low	47	Very low	172 Å²	172	122.8 Å²	122.8	80%	0.804	64%	0.643	S	S	*	*			trans	-156.1	81.6	166.4	-112.3	171.9	-148.9	0	0	110	D102 L106	D102-E104 PolarHBondContact O-N 2.78Å; E104-L106 PolarHBondContact O-N 2.86Å
105	T	24.3	Very low	44.7	Very low	141 Å²	141	120 Å²	120	87%	0.865	64%	0.644	S	S	*	*			trans	-69.7	103.4	155.6	39.3	0	0	0	0	108.8
106	L	25.4	Very low	42.6	Very low	146 Å²	146	119.4 Å²	119.4	76%	0.764	65%	0.649	S	S	*	*			trans	-132.5	102.1	160.7	-83.8	167.1	0	0	0	108.6	E104 A108	E104-L106 PolarHBondContact O-N 2.86Å; L106-A108 PolarHBondContact O-N 3.28Å; L106-A108 VanDerWaalsContact O-N 3.09Å
107	E	22.5	Very low	40.5	Very low	207 Å²	207	126.6 Å²	126.6	97%	0.967	69%	0.689	S	S	*	*			trans	-60.4	104.3	163.4	-68.1	-176.8	156.1	0	0	108.8
108	A	26.7	Very low	38.5	Very low	58 Å²	58	132.4 Å²	132.4	48%	0.479	72%	0.719	S	S	.	*			trans	-138.6	107.4	167.8	0	0	0	0	0	110.5	L106 Y110	L106-A108 PolarHBondContact O-N 3.28Å; L106-A108 VanDerWaalsContact O-N 3.09Å; A108-Y110 HydrophobicContact CB-CD2 3.78Å; A108-Y110 HydrophobicContact CB-CE2 3.45Å; A108-Y110 VanDerWaalsContact CB-CE2 3.45Å; A108-Y110 PolarHBondContact O-N 3.35Å; A108-Y110 VanDerWaalsContact O-N 3.13Å
109	K	24	Very low	37.3	Very low	211 Å²	211	132.2 Å²	132.2	92%	0.917	73%	0.729	S	S	*	*			trans	-57.7	107.9	169.8	-71.4	172	176.1	172.7	0	109.2
110	Y	29.5	Very low	36.7	Very low	173 Å²	173	137.2 Å²	137.2	68%	0.678	74%	0.742	S	S	*	*			trans	-131.8	145.6	168.3	-71.8	-70.4	0	0	0	111.8	A108	A108-Y110 HydrophobicContact CB-CD2 3.78Å; A108-Y110 HydrophobicContact CB-CE2 3.45Å; A108-Y110 VanDerWaalsContact CB-CE2 3.45Å; A108-Y110 PolarHBondContact O-N 3.35Å; A108-Y110 VanDerWaalsContact O-N 3.13Å
111	P	29.7	Very low	36.6	Very low	121 Å²	121	140.2 Å²	140.2	79%	0.786	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-77.8	155.7	-161.7	15.2	-5.1	0	0	0	114
112	A	31.6	Very low	38.3	Very low	90 Å²	90	139.2 Å²	139.2	74%	0.744	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-58.2	139.9	-170	0	0	0	0	0	114.6
113	P	37.8	Very low	40.1	Very low	119 Å²	119	134 Å²	134	77%	0.773	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-74.5	135.8	-174.8	27	-32	0	0	0	113.6	G115	P113-G115 PolarHBondContact O-N 3.41Å
114	V	35.4	Very low	42.9	Very low	124 Å²	124	128.6 Å²	128.6	75%	0.752	69%	0.694	S	S	*	*			trans	-82	78.8	179.9	-174.9	0	0	0	0	109.7
115	G	37.8	Very low	46	Very low	48 Å²	48	126.8 Å²	126.8	50%	0.495	69%	0.686	S	S	.	*			trans	-76.1	156.4	172	0	0	0	0	0	112.8	P113 N117	P113-G115 PolarHBondContact O-N 3.41Å; G115-N117 PolarHBondContact O-N 3.29Å
116	P	42.7	Very low	49.4	Very low	87 Å²	87	120.4 Å²	120.4	57%	0.565	65%	0.646	S	S	*	*			trans	-59.7	129.5	176.4	24.5	-32.2	0	0	0	110.8	L118	P116-L118 PolarHBondContact O-N 3.43Å
117	N	40.6	Very low	52.6	Low	173 Å²	173	117.2 Å²	117.2	93%	0.925	64%	0.636	S	S	*	*			trans	-49.8	90.3	-179.2	-98.3	-17.5	0	0	0	112.5	G115	G115-N117 PolarHBondContact O-N 3.29Å
118	L	39.9	Very low	55.7	Low	144 Å²	144	108 Å²	108	75%	0.754	60%	0.597	S	S	*	*			trans	-65.6	150.6	155.6	-69.6	166.9	0	0	0	107.6	P116 R120	P116-L118 PolarHBondContact O-N 3.43Å; L118-R120 PolarHBondContact O-N 3.5Å
119	P	51.1	Low	58.8	Low	118 Å²	118	108.7 Å²	108.7	77%	0.766	59%	0.592	S	S	*	*			trans	-48.7	130.5	165	-21.3	31.7	0	0	0	108.3	W121	P119-W121 PolarHBondContact O-N 2.77Å
120	R	60.6	Low	61.9	Low	236 Å²	236	100.2 Å²	100.2	89%	0.891	56%	0.558	S	S	*	*			trans	-53.3	114	-177.1	-144.2	179.1	-165.5	-174.6	3.4	107.8	L118 T122	L118-R120 PolarHBondContact O-N 3.5Å; R120-T122 PolarHBondContact O-N 3.42Å
121	W	65	Low	64.8	Low	150 Å²	150	94.2 Å²	94.2	57%	0.568	54%	0.537	S	S	*	.			trans	-65	112	178.5	-176.6	19.1	0	0	0	107.8	P119 Q139 A142 A143	P119-W121 PolarHBondContact O-N 2.77Å; W121-Q139 HydrophobicContact CZ2-CB 4.45Å; W121-Q139 WeakPolarHBondContact CZ2-O 3.42Å; W121-A142 HydrophobicContact CH2-CB 3.9Å; W121-A143 HydrophobicContact CE3-CB 4.16Å; W121-A143 VanDerWaalsContact CH2-CA 3.49Å; W121-A143 HydrophobicContact CH2-CB 3.42Å; W121-A143 VanDerWaalsContact CH2-CB 3.42Å; W121-A143 HydrophobicContact CZ2-CB 3.81Å; W121-A143 VanDerWaalsContact CZ3-CA 3.5Å; W121-A143 HydrophobicContact CZ3-CB 3.6Å
122	T	81.9	Confident	67.7	Low	113 Å²	113	93.5 Å²	93.5	69%	0.693	52%	0.523	S	S	*	.	P	Polyproline II helix	trans	-83.6	137.8	176.6	48.8	0	0	0	0	109.5	R120	R120-T122 PolarHBondContact O-N 3.42Å
123	L	81.8	Confident	70.6	Confident	51 Å²	51	89.8 Å²	89.8	27%	0.267	49%	0.491	S	S	.	.	P	Polyproline II helix	trans	-59	133.9	176.6	-73.1	165.8	0	0	0	110.7	A143 V144 Y158	L123-A143 HydrophobicContact CD2-CB 4.04Å; L123-V144 HydrophobicContact CD2-CG2 3.52Å; L123-Y158 HydrophobicContact CD1-CD1 3.61Å; L123-Y158 HydrophobicContact CD1-CE1 4.34Å; L123-Y158 HydrophobicContact CD1-CG 4.29Å
124	P	85.6	Confident	73	Confident	18 Å²	18	87.1 Å²	87.1	12%	0.117	48%	0.478	C	S	.	.	P	Polyproline II helix	trans	-64.6	149.5	176.4	32	-38.5	0	0	0	110.2	F136 Q139 F140 A162	P124-F136 HydrophobicContact CB-CD2 4.05Å; P124-F136 HydrophobicContact CG-CD2 3.86Å; P124-F136 HydrophobicContact CG-CE2 4.21Å; P124-Q139 HydrophobicContact CB-CB 4.28Å; P124-Q139 HydrophobicContact CG-CB 3.76Å; P124-F140 HydrophobicContact CG-CB 4.49Å; P124-A162 WeakPolarHBondContact O-CB 3.43Å
125	Q	92.5	Very high	75.5	Confident	135 Å²	135	84.1 Å²	84.1	63%	0.631	46%	0.463	S	S	*	.			trans	-107.1	138.9	178.1	-67.2	-69.9	-40.5	0	0	110	S161 A162	Q125-S161 PolarHBondContact NE2-O 2.76Å; Q125-S161 VanDerWaalsContact NE2-O 3.1Å; Q125-A162 CarbonylContact C-O 3.36Å; Q125-A162 WeakPolarHBondContact CA-O 3.06Å; Q125-A162 PolarHBondContact OE1-O 3.5Å
126	F	95.8	Very high	78.2	Confident	7 Å²	7	82.1 Å²	82.1	3%	0.031	44%	0.44	C	S	.	.	B	Isolated β-bridge	trans	-135.3	123.8	-179	178	-107.3	0	0	0	112.6	G128 D129 F133 F136 A162 L163 G164 A167 F192	F126-G128 VanDerWaalsContact CZ-CA 3.47Å; F126-D129 VanDerWaalsContact CE2-O 3.28Å; F126-D129 WeakPolarHBondContact CE2-O 3.38Å; F126-F133 HydrophobicContact CD1-CD2 4.5Å; F126-F133 AromaticContact CE1-CD2 3.81Å; F126-F133 HydrophobicContact CE1-CD2 3.81Å; F126-F133 HydrophobicContact CE1-CE2 4.41Å; F126-F133 HydrophobicContact CE2-CB 3.9Å; F126-F133 HydrophobicContact CE2-CD2 4.05Å; F126-F133 HydrophobicContact CZ-CB 4Å; F126-F133 AromaticContact CZ-CD2 3.57Å; F126-F133 HydrophobicContact CZ-CD2 3.57Å; F126-F133 HydrophobicContact CZ-CG 4.26Å; F126-F136 HydrophobicContact CB-CB 4.08Å; F126-F136 HydrophobicContact CB-CD1 3.66Å; F126-F136 HydrophobicContact CB-CD2 3.4Å; F126-F136 VanDerWaalsContact CB-CD2 3.4Å; F126-F136 HydrophobicContact CB-CE1 3.88Å; F126-F136 HydrophobicContact CB-CE2 3.62Å; F126-F136 HydrophobicContact CB-CG 3.41Å; F126-F136 VanDerWaalsContact CB-CG 3.41Å; F126-F136 HydrophobicContact CB-CZ 3.85Å; F126-F136 HydrophobicContact CD1-CD1 4.04Å; F126-F136 HydrophobicContact CD1-CE1 4.08Å; F126-F136 HydrophobicContact CD2-CB 4.01Å; F126-F136 HydrophobicContact CD2-CD1 4.13Å; F126-F136 HydrophobicContact CD2-CG 4.09Å; F126-F136 HydrophobicContact CG-CB 4.25Å; F126-F136 AromaticContact CG-CD1 3.68Å; F126-F136 HydrophobicContact CG-CD1 3.68Å; F126-F136 HydrophobicContact CG-CD2 4.3Å; F126-F136 HydrophobicContact CG-CE1 4.06Å; F126-F136 AromaticContact CG-CG 3.81Å; F126-F136 HydrophobicContact CG-CG 3.81Å; F126-A162 PolarHBondContact N-O 3.02Å; F126-L163 HydrophobicContact CB-CD2 4.24Å; F126-L163 HydrophobicContact CD1-CD2 3.75Å; F126-L163 HydrophobicContact CG-CD2 4.49Å; F126-L163 CarbonylContact O-C 3.49Å; F126-L163 WeakPolarHBondContact O-CA 3.18Å; F126-G164 PolarHBondContact O-N 2.72Å; F126-A167 HydrophobicContact CD1-CB 3.49Å; F126-A167 VanDerWaalsContact CD1-CB 3.49Å; F126-A167 HydrophobicContact CE1-CB 3.48Å; F126-A167 VanDerWaalsContact CE1-CB 3.48Å; F126-F192 HydrophobicContact CE1-CB 4.33Å; F126-F192 HydrophobicContact CE1-CD1 4.38Å; F126-F192 AromaticContact CE1-CD2 3.97Å; F126-F192 HydrophobicContact CE1-CD2 3.97Å; F126-F192 HydrophobicContact CE1-CE2 4.38Å; F126-F192 AromaticContact CE1-CG 3.98Å; F126-F192 HydrophobicContact CE1-CG 3.98Å; F126-F192 HydrophobicContact CZ-CB 3.98Å; F126-F192 HydrophobicContact CZ-CD1 4.13Å; F126-F192 HydrophobicContact CZ-CD2 4.39Å; F126-F192 AromaticContact CZ-CG 3.92Å; F126-F192 HydrophobicContact CZ-CG 3.92Å
127	S	91.4	Very high	80.7	Confident	79 Å²	79	78.6 Å²	78.6	55%	0.552	42%	0.416	S	S	*	.			trans	-106.1	-2.7	-174.5	61.4	0	0	0	0	115.3	G164 E166	S127-G164 CarbonylContact C-O 3.57Å; S127-G164 VanDerWaalsContact CA-O 3.27Å; S127-G164 WeakPolarHBondContact CA-O 3.09Å; S127-E166 PolarHBondContact O-N 2.93Å
128	G	88.8	Confident	83	Confident	14 Å²	14	75.1 Å²	75.1	14%	0.144	40%	0.397	C	S	.	.	S	Bend	trans	113	3.2	-178.1	0	0	0	0	0	116.4	F126 V130 F192	F126-G128 VanDerWaalsContact CZ-CA 3.47Å; G128-V130 PolarHBondContact O-N 2.83Å; G128-F192 WeakPolarHBondContact O-CD1 3.42Å
129	D	91.2	Very high	85.4	Confident	72 Å²	72	71.9 Å²	71.9	39%	0.385	38%	0.378	S	S	.	.			trans	-73.4	111.7	175	179.7	8.4	0	0	0	111.2	F126 L131 Q132 F133	F126-D129 VanDerWaalsContact CE2-O 3.28Å; F126-D129 WeakPolarHBondContact CE2-O 3.38Å; D129-L131 PolarHBondContact O-N 3.13Å; D129-L131 VanDerWaalsContact O-N 3.11Å; D129-L131 PolarHBondContact OD1-N 3.29Å; D129-Q132 HydrophobicContact CB-CB 4.5Å; D129-Q132 HydrophobicContact CB-CG 4.2Å; D129-Q132 PolarHBondContact O-N 3.07Å; D129-F133 PolarHBondContact O-N 3.36Å
130	V	89.4	Confident	87.4	Confident	32 Å²	32	66.2 Å²	66.2	19%	0.194	34%	0.342	C	S	.	.	H	α-helix	trans	-54	-32.3	-179	177	0	0	0	0	112.5	G128 Q132 F133 F192 A197 V198	G128-V130 PolarHBondContact O-N 2.83Å; V130-Q132 PolarHBondContact O-N 2.56Å; V130-F133 PolarHBondContact O-N 2.91Å; V130-F192 HydrophobicContact CG2-CD1 4.47Å; V130-A197 HydrophobicContact CG1-CB 4.15Å; V130-V198 HydrophobicContact CG1-CB 4.12Å; V130-V198 HydrophobicContact CG1-CG2 3.36Å
131	L	90.6	Very high	88.9	Confident	47 Å²	47	57.8 Å²	57.8	25%	0.246	31%	0.312	C	S	.	.	H	α-helix	trans	-68.1	-21.1	178	-63.8	-177.2	0	0	0	113.4	D129 V198 A201 H202	D129-L131 PolarHBondContact O-N 3.13Å; D129-L131 VanDerWaalsContact O-N 3.11Å; D129-L131 PolarHBondContact OD1-N 3.29Å; L131-V198 HydrophobicContact CD2-CG1 4.47Å; L131-A201 HydrophobicContact CD2-CB 3.57Å; L131-A201 HydrophobicContact CG-CB 3.99Å; L131-H202 VanDerWaalsContact CD2-CD2 3.49Å; L131-H202 WeakPolarHBondContact CD2-CD2 3.25Å; L131-H202 WeakPolarHBondContact CD2-NE2 3.34Å
132	Q	91.1	Very high	89.8	Confident	106 Å²	106	53.6 Å²	53.6	50%	0.495	31%	0.31	S	S	.	.	H	α-helix	trans	-100.4	-10.2	-179.4	-57.7	-57.2	-40.3	0	0	113.2	D129 V130 A134 S135 F136	D129-Q132 HydrophobicContact CB-CB 4.5Å; D129-Q132 HydrophobicContact CB-CG 4.2Å; D129-Q132 PolarHBondContact O-N 3.07Å; V130-Q132 PolarHBondContact O-N 2.56Å; Q132-A134 PolarHBondContact O-N 3.16Å; Q132-S135 PolarHBondContact O-N 2.78Å; Q132-F136 WeakPolarHBondContact O-CB 3.38Å; Q132-F136 PolarHBondContact O-N 3.35Å
133	F	91.7	Very high	90	Very high	13 Å²	13	49.2 Å²	49.2	6%	0.057	29%	0.285	C	S	.	.	H	α-helix	trans	-61.3	-45.6	-170.7	-178.2	-101.7	0	0	0	113	F126 D129 V130 S135 F136 W137 L188 R189 F192 G193	F126-F133 HydrophobicContact CD1-CD2 4.5Å; F126-F133 AromaticContact CE1-CD2 3.81Å; F126-F133 HydrophobicContact CE1-CD2 3.81Å; F126-F133 HydrophobicContact CE1-CE2 4.41Å; F126-F133 HydrophobicContact CE2-CB 3.9Å; F126-F133 HydrophobicContact CE2-CD2 4.05Å; F126-F133 HydrophobicContact CZ-CB 4Å; F126-F133 AromaticContact CZ-CD2 3.57Å; F126-F133 HydrophobicContact CZ-CD2 3.57Å; F126-F133 HydrophobicContact CZ-CG 4.26Å; D129-F133 PolarHBondContact O-N 3.36Å; V130-F133 PolarHBondContact O-N 2.91Å; F133-S135 PolarHBondContact O-N 3.04Å; F133-F136 HydrophobicContact CD2-CD1 4.34Å; F133-F136 HydrophobicContact CE2-CD1 4.49Å; F133-F136 PolarHBondContact O-N 3.17Å; F133-W137 HydrophobicContact CE1-CB 4.35Å; F133-W137 HydrophobicContact CZ-CB 4.41Å; F133-W137 WeakPolarHBondContact O-CB 3.33Å; F133-W137 PolarHBondContact O-N 2.81Å; F133-L188 HydrophobicContact CE2-CB 4.31Å; F133-R189 HydrophobicContact CE1-CG 4.39Å; F133-R189 HydrophobicContact CZ-CG 4.09Å; F133-F192 HydrophobicContact CB-CB 4.25Å; F133-F192 HydrophobicContact CD1-CB 4.49Å; F133-F192 HydrophobicContact CD2-CB 3.54Å; F133-F192 HydrophobicContact CD2-CG 4.49Å; F133-F192 HydrophobicContact CE2-CB 3.95Å; F133-F192 HydrophobicContact CG-CB 3.83Å; F133-G193 VanDerWaalsContact CE1-CA 3.41Å
134	A	87.7	Confident	90.4	Very high	62 Å²	62	47 Å²	47	51%	0.512	27%	0.273	S	S	.	.	H	α-helix	trans	-59.3	-47.8	179.1	0	0	0	0	0	111.7	Q132 F136 W137 D138	Q132-A134 PolarHBondContact O-N 3.16Å; A134-F136 PolarHBondContact O-N 3.4Å; A134-W137 PolarHBondContact O-N 2.95Å; A134-D138 WeakPolarHBondContact O-CB 3.34Å; A134-D138 PolarHBondContact O-N 2.65Å
135	S	88.8	Confident	90.6	Very high	61 Å²	61	47.9 Å²	47.9	43%	0.427	28%	0.277	S	S	.	.	H	α-helix	trans	-65.3	-37.6	178.8	-175.7	0	0	0	0	112.9	Q132 F133 Q139	Q132-S135 PolarHBondContact O-N 2.78Å; F133-S135 PolarHBondContact O-N 3.04Å; S135-Q139 WeakPolarHBondContact O-CG 3.3Å; S135-Q139 PolarHBondContact O-N 3.39Å; S135-Q139 PolarHBondContact O-NE2 2.59Å; S135-Q139 PolarHBondContact OG-NE2 2.84Å
136	F	94.6	Very high	90.4	Very high	6 Å²	6	45.5 Å²	45.5	3%	0.026	27%	0.274	C	S	.	.	H	α-helix	trans	-64.4	-50.7	173.7	160.7	-106	0	0	0	111.3	P124 F126 Q132 F133 A134 Q139 F140 L159 A162 L163	P124-F136 HydrophobicContact CB-CD2 4.05Å; P124-F136 HydrophobicContact CG-CD2 3.86Å; P124-F136 HydrophobicContact CG-CE2 4.21Å; F126-F136 HydrophobicContact CB-CB 4.08Å; F126-F136 HydrophobicContact CB-CD1 3.66Å; F126-F136 HydrophobicContact CB-CD2 3.4Å; F126-F136 VanDerWaalsContact CB-CD2 3.4Å; F126-F136 HydrophobicContact CB-CE1 3.88Å; F126-F136 HydrophobicContact CB-CE2 3.62Å; F126-F136 HydrophobicContact CB-CG 3.41Å; F126-F136 VanDerWaalsContact CB-CG 3.41Å; F126-F136 HydrophobicContact CB-CZ 3.85Å; F126-F136 HydrophobicContact CD1-CD1 4.04Å; F126-F136 HydrophobicContact CD1-CE1 4.08Å; F126-F136 HydrophobicContact CD2-CB 4.01Å; F126-F136 HydrophobicContact CD2-CD1 4.13Å; F126-F136 HydrophobicContact CD2-CG 4.09Å; F126-F136 HydrophobicContact CG-CB 4.25Å; F126-F136 AromaticContact CG-CD1 3.68Å; F126-F136 HydrophobicContact CG-CD1 3.68Å; F126-F136 HydrophobicContact CG-CD2 4.3Å; F126-F136 HydrophobicContact CG-CE1 4.06Å; F126-F136 AromaticContact CG-CG 3.81Å; F126-F136 HydrophobicContact CG-CG 3.81Å; Q132-F136 WeakPolarHBondContact O-CB 3.38Å; Q132-F136 PolarHBondContact O-N 3.35Å; F133-F136 HydrophobicContact CD2-CD1 4.34Å; F133-F136 HydrophobicContact CE2-CD1 4.49Å; F133-F136 PolarHBondContact O-N 3.17Å; A134-F136 PolarHBondContact O-N 3.4Å; F136-Q139 PolarHBondContact O-N 2.75Å; F136-F140 HydrophobicContact CE2-CB 4.28Å; F136-F140 HydrophobicContact CE2-CD2 4.4Å; F136-F140 HydrophobicContact CZ-CB 4.33Å; F136-F140 HydrophobicContact CZ-CD2 4.4Å; F136-F140 HydrophobicContact CZ-CG 4.39Å; F136-F140 WeakPolarHBondContact O-CB 3.46Å; F136-F140 PolarHBondContact O-N 3.05Å; F136-L159 HydrophobicContact CZ-CD1 4.15Å; F136-A162 HydrophobicContact CE2-CB 4.14Å; F136-L163 HydrophobicContact CE1-CD2 4.11Å; F136-L163 HydrophobicContact CZ-CD2 3.82Å
137	W	93.8	Very high	89.7	Confident	14 Å²	14	49.9 Å²	49.9	5%	0.053	29%	0.291	C	S	.	.	H	α-helix	trans	-63.5	-47.2	-175.2	-176.4	-96.7	0	0	0	111	F133 A134 Q139 F140 E141 I185	F133-W137 HydrophobicContact CE1-CB 4.35Å; F133-W137 HydrophobicContact CZ-CB 4.41Å; F133-W137 WeakPolarHBondContact O-CB 3.33Å; F133-W137 PolarHBondContact O-N 2.81Å; A134-W137 PolarHBondContact O-N 2.95Å; W137-Q139 VanDerWaalsContact C-N 3.26Å; W137-Q139 PolarHBondContact O-N 3.29Å; W137-F140 HydrophobicContact CZ3-CD1 4.25Å; W137-F140 PolarHBondContact O-N 2.88Å; W137-F140 VanDerWaalsContact O-N 3.15Å; W137-E141 PolarHBondContact NE1-OE1 3.38Å; W137-E141 WeakPolarHBondContact O-CB 3.38Å; W137-E141 PolarHBondContact O-N 3.06Å; W137-I185 HydrophobicContact CH2-CB 4.14Å; W137-I185 HydrophobicContact CH2-CD1 3.81Å; W137-I185 HydrophobicContact CH2-CG1 3.66Å; W137-I185 HydrophobicContact CH2-CG2 3.44Å; W137-I185 VanDerWaalsContact CH2-CG2 3.44Å; W137-I185 HydrophobicContact CZ2-CG2 3.86Å; W137-I185 HydrophobicContact CZ3-CG1 4.2Å; W137-I185 HydrophobicContact CZ3-CG2 4.13Å
138	D	89.3	Confident	89.2	Confident	99 Å²	99	52.9 Å²	52.9	53%	0.529	31%	0.306	S	S	.	.	H	α-helix	trans	-58.6	-39.4	179	-67.1	-8.8	0	0	0	112	A134 A142	A134-D138 WeakPolarHBondContact O-CB 3.34Å; A134-D138 PolarHBondContact O-N 2.65Å; D138-A142 WeakPolarHBondContact O-CB 3.47Å; D138-A142 PolarHBondContact O-N 3.47Å; D138-A142 VanDerWaalsContact O-N 3.13Å
139	Q	90.5	Very high	88.9	Confident	76 Å²	76	57.3 Å²	57.3	36%	0.355	33%	0.326	S	S	.	.	H	α-helix	trans	-71.6	-42	177	-74.7	177.9	80.3	0	0	112.3	W121 P124 S135 F136 W137 A143	W121-Q139 HydrophobicContact CZ2-CB 4.45Å; W121-Q139 WeakPolarHBondContact CZ2-O 3.42Å; P124-Q139 HydrophobicContact CB-CB 4.28Å; P124-Q139 HydrophobicContact CG-CB 3.76Å; S135-Q139 WeakPolarHBondContact O-CG 3.3Å; S135-Q139 PolarHBondContact O-N 3.39Å; S135-Q139 PolarHBondContact O-NE2 2.59Å; S135-Q139 PolarHBondContact OG-NE2 2.84Å; F136-Q139 PolarHBondContact O-N 2.75Å; W137-Q139 VanDerWaalsContact C-N 3.26Å; W137-Q139 PolarHBondContact O-N 3.29Å; Q139-A143 WeakPolarHBondContact O-CB 3.44Å; Q139-A143 PolarHBondContact O-N 2.8Å
140	F	93.8	Very high	88.6	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-67.9	-38.8	177.6	-173	-89.9	0	0	0	111.5	P124 F136 W137 A143 V144 D145 L159 A162	P124-F140 HydrophobicContact CG-CB 4.49Å; F136-F140 HydrophobicContact CE2-CB 4.28Å; F136-F140 HydrophobicContact CE2-CD2 4.4Å; F136-F140 HydrophobicContact CZ-CB 4.33Å; F136-F140 HydrophobicContact CZ-CD2 4.4Å; F136-F140 HydrophobicContact CZ-CG 4.39Å; F136-F140 WeakPolarHBondContact O-CB 3.46Å; F136-F140 PolarHBondContact O-N 3.05Å; W137-F140 HydrophobicContact CZ3-CD1 4.25Å; W137-F140 PolarHBondContact O-N 2.88Å; W137-F140 VanDerWaalsContact O-N 3.15Å; F140-A143 PolarHBondContact O-N 3.34Å; F140-V144 HydrophobicContact CD1-CB 4.43Å; F140-V144 HydrophobicContact CD2-CG2 4.4Å; F140-V144 HydrophobicContact CE1-CB 3.98Å; F140-V144 HydrophobicContact CE1-CG1 4.09Å; F140-V144 HydrophobicContact CE2-CB 4.1Å; F140-V144 HydrophobicContact CE2-CG1 4.35Å; F140-V144 HydrophobicContact CE2-CG2 4.01Å; F140-V144 HydrophobicContact CZ-CB 3.78Å; F140-V144 HydrophobicContact CZ-CG1 3.71Å; F140-V144 HydrophobicContact CZ-CG2 4.19Å; F140-V144 PolarHBondContact O-N 2.78Å; F140-D145 PolarHBondContact O-N 3.15Å; F140-L159 HydrophobicContact CD1-CD1 4.29Å; F140-L159 HydrophobicContact CD2-CD1 4.44Å; F140-L159 HydrophobicContact CE1-CB 4.25Å; F140-L159 HydrophobicContact CE1-CD1 3.89Å; F140-L159 HydrophobicContact CE2-CB 4.16Å; F140-L159 HydrophobicContact CE2-CD1 4.05Å; F140-L159 HydrophobicContact CZ-CB 3.58Å; F140-L159 HydrophobicContact CZ-CD1 3.77Å; F140-L159 HydrophobicContact CZ-CG 4.23Å; F140-A162 HydrophobicContact CD2-CB 4.3Å; F140-A162 HydrophobicContact CE2-CB 4.26Å
141	E	92.1	Very high	88.4	Confident	59 Å²	59	56.4 Å²	56.4	28%	0.276	32%	0.324	S	S	.	.	I	π-helix	trans	-61.9	-50.1	178.4	-174.8	174.1	-99.1	0	0	110.2	W137 A143 D145 C146 R189	W137-E141 PolarHBondContact NE1-OE1 3.38Å; W137-E141 WeakPolarHBondContact O-CB 3.38Å; W137-E141 PolarHBondContact O-N 3.06Å; E141-A143 PolarHBondContact O-N 3.48Å; E141-D145 HydrophobicContact CB-CB 4.29Å; E141-D145 HydrophobicContact CG-CB 4.13Å; E141-D145 PolarHBondContact O-N 2.69Å; E141-D145 VanDerWaalsContact O-N 3.16Å; E141-C146 WeakPolarHBondContact O-CB 3.47Å; E141-C146 PolarHBondContact O-N 3.33Å; E141-C146 PolarHBondContact O-SG 3.45Å; E141-C146 VanDerWaalsContact O-SG 3.41Å; E141-R189 IonicContact OE1-NH2 2.89Å; E141-R189 PolarHBondContact OE1-NH2 2.9Å
142	A	83.6	Confident	88.3	Confident	62 Å²	62	56.5 Å²	56.5	51%	0.512	33%	0.325	S	S	.	.	I	π-helix	trans	-64.8	-35.3	175.5	0	0	0	0	0	113.5	W121 D138	W121-A142 HydrophobicContact CH2-CB 3.9Å; D138-A142 WeakPolarHBondContact O-CB 3.47Å; D138-A142 PolarHBondContact O-N 3.47Å; D138-A142 VanDerWaalsContact O-N 3.13Å
143	A	85.1	Confident	88.1	Confident	20 Å²	20	53.7 Å²	53.7	17%	0.165	32%	0.315	C	S	.	.	I	π-helix	trans	-79.7	-38.4	-176.7	0	0	0	0	0	113.7	W121 L123 Q139 F140 E141 R147	W121-A143 HydrophobicContact CE3-CB 4.16Å; W121-A143 VanDerWaalsContact CH2-CA 3.49Å; W121-A143 HydrophobicContact CH2-CB 3.42Å; W121-A143 VanDerWaalsContact CH2-CB 3.42Å; W121-A143 HydrophobicContact CZ2-CB 3.81Å; W121-A143 VanDerWaalsContact CZ3-CA 3.5Å; W121-A143 HydrophobicContact CZ3-CB 3.6Å; L123-A143 HydrophobicContact CD2-CB 4.04Å; Q139-A143 WeakPolarHBondContact O-CB 3.44Å; Q139-A143 PolarHBondContact O-N 2.8Å; F140-A143 PolarHBondContact O-N 3.34Å; E141-A143 PolarHBondContact O-N 3.48Å; A143-R147 WeakPolarHBondContact O-CG 3.24Å
144	V	90.3	Very high	87.8	Confident	5 Å²	5	55.5 Å²	55.5	3%	0.03	33%	0.327	C	S	.	.	I	π-helix	trans	-133.6	-48.3	-164.4	-178.7	0	0	0	0	112.1	L123 F140 R147 L150 K155 Y158	L123-V144 HydrophobicContact CD2-CG2 3.52Å; F140-V144 HydrophobicContact CD1-CB 4.43Å; F140-V144 HydrophobicContact CD2-CG2 4.4Å; F140-V144 HydrophobicContact CE1-CB 3.98Å; F140-V144 HydrophobicContact CE1-CG1 4.09Å; F140-V144 HydrophobicContact CE2-CB 4.1Å; F140-V144 HydrophobicContact CE2-CG1 4.35Å; F140-V144 HydrophobicContact CE2-CG2 4.01Å; F140-V144 HydrophobicContact CZ-CB 3.78Å; F140-V144 HydrophobicContact CZ-CG1 3.71Å; F140-V144 HydrophobicContact CZ-CG2 4.19Å; F140-V144 PolarHBondContact O-N 2.78Å; V144-R147 WeakPolarHBondContact O-CB 3.46Å; V144-R147 PolarHBondContact O-N 3.01Å; V144-L150 HydrophobicContact CG1-CD1 4.09Å; V144-K155 HydrophobicContact CG1-CB 3.95Å; V144-K155 HydrophobicContact CG1-CG 3.9Å; V144-K155 WeakPolarHBondContact O-CE 3.38Å; V144-Y158 HydrophobicContact CG1-CD2 4.22Å; V144-Y158 HydrophobicContact CG2-CG 4.5Å
145	D	90.5	Very high	88.1	Confident	37 Å²	37	53.5 Å²	53.5	20%	0.198	31%	0.307	C	S	.	.	I	π-helix	trans	-68.9	-43.4	-171.3	-165	52.4	0	0	0	112.9	F140 E141 R147 K155 Y181	F140-D145 PolarHBondContact O-N 3.15Å; E141-D145 HydrophobicContact CB-CB 4.29Å; E141-D145 HydrophobicContact CG-CB 4.13Å; E141-D145 PolarHBondContact O-N 2.69Å; E141-D145 VanDerWaalsContact O-N 3.16Å; D145-R147 PolarHBondContact O-N 3.24Å; D145-K155 PolarHBondContact O-NZ 2.88Å; D145-Y181 VanDerWaalsContact OD1-CE1 3.27Å; D145-Y181 WeakPolarHBondContact OD1-CE1 3.37Å; D145-Y181 PolarHBondContact OD1-OH 2.76Å
146	C	89.1	Confident	88.2	Confident	84 Å²	84	50.6 Å²	50.6	57%	0.568	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-9.9	176.9	-67.2	0	0	0	0	113.6	E141 T148	E141-C146 WeakPolarHBondContact O-CB 3.47Å; E141-C146 PolarHBondContact O-N 3.33Å; E141-C146 PolarHBondContact O-SG 3.45Å; E141-C146 VanDerWaalsContact O-SG 3.41Å; C146-T148 PolarHBondContact O-N 3.32Å; C146-T148 VanDerWaalsContact O-N 3.16Å
147	R	80.4	Confident	88	Confident	100 Å²	100	54 Å²	54	38%	0.377	31%	0.308	S	S	.	.			trans	-73.7	106.6	178	-67.3	-113.6	-53.8	155	18.2	110.2	A143 V144 D145 D149 L150 K155	A143-R147 WeakPolarHBondContact O-CG 3.24Å; V144-R147 WeakPolarHBondContact O-CB 3.46Å; V144-R147 PolarHBondContact O-N 3.01Å; D145-R147 PolarHBondContact O-N 3.24Å; R147-D149 VanDerWaalsContact C-N 3.26Å; R147-D149 WeakPolarHBondContact CB-OD1 3.45Å; R147-D149 IonicContact CZ-OD1 3.7Å; R147-D149 IonicContact CZ-OD2 2.7Å; R147-D149 IonicContact NE-OD1 3.26Å; R147-D149 PolarHBondContact NE-OD1 3.21Å; R147-D149 VanDerWaalsContact NE-OD1 3.13Å; R147-D149 IonicContact NE-OD2 2.71Å; R147-D149 IonicContact NH1-OD1 3.88Å; R147-D149 PolarHBondContact NH1-OD1 3.39Å; R147-D149 IonicContact NH1-OD2 2.77Å; R147-D149 PolarHBondContact NH1-OD2 2.92Å; R147-D149 IonicContact NH2-OD1 3.93Å; R147-D149 PolarHBondContact NH2-OD1 2.95Å; R147-D149 IonicContact NH2-OD2 3.58Å; R147-D149 PolarHBondContact NH2-OD2 2.96Å; R147-D149 PolarHBondContact O-N 2.86Å; R147-L150 HydrophobicContact CB-CB 4.36Å; R147-L150 HydrophobicContact CB-CD1 3.88Å; R147-L150 HydrophobicContact CB-CG 3.95Å; R147-L150 HydrophobicContact CG-CD1 4.24Å; R147-K155 WeakPolarHBondContact O-CE 3.43Å; R147-K155 PolarHBondContact O-NZ 2.81Å
148	T	81.5	Confident	87.9	Confident	142 Å²	142	58.1 Å²	58.1	87%	0.871	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-17.8	176.8	52.5	0	0	0	0	113.1	C146 L150	C146-T148 PolarHBondContact O-N 3.32Å; C146-T148 VanDerWaalsContact O-N 3.16Å; T148-L150 VanDerWaalsContact C-N 3.34Å
149	D	82	Confident	88.1	Confident	106 Å²	106	53.4 Å²	53.4	57%	0.567	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-4.8	178.1	68	-40.6	0	0	0	113.7	R147	R147-D149 VanDerWaalsContact C-N 3.26Å; R147-D149 WeakPolarHBondContact CB-OD1 3.45Å; R147-D149 IonicContact CZ-OD1 3.7Å; R147-D149 IonicContact CZ-OD2 2.7Å; R147-D149 IonicContact NE-OD1 3.26Å; R147-D149 PolarHBondContact NE-OD1 3.21Å; R147-D149 VanDerWaalsContact NE-OD1 3.13Å; R147-D149 IonicContact NE-OD2 2.71Å; R147-D149 IonicContact NH1-OD1 3.88Å; R147-D149 PolarHBondContact NH1-OD1 3.39Å; R147-D149 IonicContact NH1-OD2 2.77Å; R147-D149 PolarHBondContact NH1-OD2 2.92Å; R147-D149 IonicContact NH2-OD1 3.93Å; R147-D149 PolarHBondContact NH2-OD1 2.95Å; R147-D149 IonicContact NH2-OD2 3.58Å; R147-D149 PolarHBondContact NH2-OD2 2.96Å; R147-D149 PolarHBondContact O-N 2.86Å
150	L	83.7	Confident	88.1	Confident	27 Å²	27	52.9 Å²	52.9	14%	0.141	30%	0.297	C	S	.	.	S	Bend	trans	-98.6	130.2	171.4	-62.9	179	0	0	0	110.5	V144 R147 T148 T154 K155 Y158	V144-L150 HydrophobicContact CG1-CD1 4.09Å; R147-L150 HydrophobicContact CB-CB 4.36Å; R147-L150 HydrophobicContact CB-CD1 3.88Å; R147-L150 HydrophobicContact CB-CG 3.95Å; R147-L150 HydrophobicContact CG-CD1 4.24Å; T148-L150 VanDerWaalsContact C-N 3.34Å; L150-T154 HydrophobicContact CD2-CG2 4.03Å; L150-K155 HydrophobicContact CB-CG 3.82Å; L150-K155 VanDerWaalsContact O-CE 3.3Å; L150-K155 WeakPolarHBondContact O-CE 3.34Å; L150-Y158 HydrophobicContact CD1-CD2 4.32Å; L150-Y158 HydrophobicContact CD1-CE2 4.2Å
151	S	85.4	Confident	87.9	Confident	58 Å²	58	55.9 Å²	55.9	41%	0.406	32%	0.318	S	S	.	.			trans	-66.7	153.5	168.2	66.1	0	0	0	0	111	V153 T154 K155	S151-V153 PolarHBondContact O-N 2.9Å; S151-T154 WeakPolarHBondContact O-CA 3.19Å; S151-T154 WeakPolarHBondContact O-CB 3Å; S151-T154 PolarHBondContact O-N 2.73Å; S151-T154 PolarHBondContact OG-N 3.38Å; S151-T154 PolarHBondContact OG-OG1 3.27Å; S151-K155 WeakPolarHBondContact O-CG 3.3Å; S151-K155 PolarHBondContact O-N 3.35Å
152	N	88.6	Confident	88	Confident	49 Å²	49	53.1 Å²	53.1	26%	0.262	31%	0.305	S	S	.	.	H	α-helix	trans	-57.7	-34.7	177.3	-79.3	2.2	0	0	0	112.8	T154 K155 M156 N178 Y181	N152-T154 VanDerWaalsContact C-N 3.33Å; N152-T154 PolarHBondContact O-N 2.87Å; N152-K155 PolarHBondContact O-N 3.33Å; N152-M156 VanDerWaalsContact O-CB 3.28Å; N152-M156 WeakPolarHBondContact O-CB 3.44Å; N152-M156 PolarHBondContact O-N 3.38Å; N152-N178 WeakPolarHBondContact CA-OD1 3.38Å; N152-N178 HydrophobicContact CB-CB 4.13Å; N152-N178 WeakPolarHBondContact CB-O 3.31Å; N152-N178 VanDerWaalsContact CB-OD1 3.28Å; N152-N178 WeakPolarHBondContact CB-OD1 3.14Å; N152-N178 PolarHBondContact N-OD1 2.84Å; N152-N178 VanDerWaalsContact N-OD1 3.13Å; N152-N178 PolarHBondContact ND2-O 3.48Å; N152-Y181 HydrophobicContact CB-CD1 4.02Å; N152-Y181 HydrophobicContact CB-CG 4.14Å
153	V	86.7	Confident	88.5	Confident	48 Å²	48	50.5 Å²	50.5	29%	0.291	28%	0.282	S	S	.	.	H	α-helix	trans	-56.7	-47.2	170.4	169	0	0	0	0	111	S151 M156 V157 V176 N178	S151-V153 PolarHBondContact O-N 2.9Å; V153-M156 WeakPolarHBondContact O-CB 3.46Å; V153-M156 PolarHBondContact O-N 2.81Å; V153-V157 WeakPolarHBondContact O-CG2 3.32Å; V153-V157 PolarHBondContact O-N 2.65Å; V153-V176 HydrophobicContact CG1-CG1 3.98Å; V153-N178 HydrophobicContact CG2-CB 4.23Å; V153-N178 VanDerWaalsContact CG2-N 3.33Å; V153-N178 WeakPolarHBondContact CG2-OD1 3.28Å; V153-N178 PolarHBondContact N-OD1 2.92Å
154	T	87.1	Confident	88.9	Confident	50 Å²	50	50.6 Å²	50.6	31%	0.307	29%	0.285	S	S	.	.	H	α-helix	trans	-67.7	-42.9	-178.8	-47.5	0	0	0	0	111.1	L150 S151 N152 M156 V157 Y158	L150-T154 HydrophobicContact CD2-CG2 4.03Å; S151-T154 WeakPolarHBondContact O-CA 3.19Å; S151-T154 WeakPolarHBondContact O-CB 3Å; S151-T154 PolarHBondContact O-N 2.73Å; S151-T154 PolarHBondContact OG-N 3.38Å; S151-T154 PolarHBondContact OG-OG1 3.27Å; N152-T154 VanDerWaalsContact C-N 3.33Å; N152-T154 PolarHBondContact O-N 2.87Å; T154-M156 PolarHBondContact O-N 3.32Å; T154-V157 PolarHBondContact O-N 3.2Å; T154-Y158 HydrophobicContact CG2-CD2 4.06Å; T154-Y158 HydrophobicContact CG2-CE2 3.67Å; T154-Y158 VanDerWaalsContact O-CD2 3.24Å; T154-Y158 WeakPolarHBondContact O-CD2 3.33Å; T154-Y158 PolarHBondContact O-N 3.47Å; T154-Y158 VanDerWaalsContact O-N 3.11Å
155	K	93	Very high	88.9	Confident	20 Å²	20	52.6 Å²	52.6	9%	0.087	31%	0.307	C	S	.	.	H	α-helix	trans	-58.9	-38.8	173.7	-62	-178.2	179.2	-178.9	0	111.5	V144 D145 R147 L150 S151 N152 Y158 L159 Y181	V144-K155 HydrophobicContact CG1-CB 3.95Å; V144-K155 HydrophobicContact CG1-CG 3.9Å; V144-K155 WeakPolarHBondContact O-CE 3.38Å; D145-K155 PolarHBondContact O-NZ 2.88Å; R147-K155 WeakPolarHBondContact O-CE 3.43Å; R147-K155 PolarHBondContact O-NZ 2.81Å; L150-K155 HydrophobicContact CB-CG 3.82Å; L150-K155 VanDerWaalsContact O-CE 3.3Å; L150-K155 WeakPolarHBondContact O-CE 3.34Å; S151-K155 WeakPolarHBondContact O-CG 3.3Å; S151-K155 PolarHBondContact O-N 3.35Å; N152-K155 PolarHBondContact O-N 3.33Å; K155-Y158 PolarHBondContact O-N 3.3Å; K155-L159 WeakPolarHBondContact O-CB 3.41Å; K155-L159 PolarHBondContact O-N 3.04Å; K155-Y181 HydrophobicContact CB-CD1 4.4Å; K155-Y181 HydrophobicContact CB-CD2 3.96Å; K155-Y181 HydrophobicContact CB-CE1 3.93Å; K155-Y181 HydrophobicContact CB-CE2 3.41Å; K155-Y181 VanDerWaalsContact CB-CE2 3.41Å; K155-Y181 HydrophobicContact CB-CG 4.41Å; K155-Y181 HydrophobicContact CD-CD1 4.4Å; K155-Y181 HydrophobicContact CD-CE1 3.64Å; K155-Y181 HydrophobicContact CG-CE1 4.45Å
156	M	92.1	Very high	88.9	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-67.4	-36.5	177.5	-170.7	159.4	175.2	0	0	113.2	N152 V153 T154 L159 Q160 F174 T175 V176 N180 Y181 V184	N152-M156 VanDerWaalsContact O-CB 3.28Å; N152-M156 WeakPolarHBondContact O-CB 3.44Å; N152-M156 PolarHBondContact O-N 3.38Å; V153-M156 WeakPolarHBondContact O-CB 3.46Å; V153-M156 PolarHBondContact O-N 2.81Å; T154-M156 PolarHBondContact O-N 3.32Å; M156-L159 PolarHBondContact O-N 3.49Å; M156-Q160 WeakPolarHBondContact O-CG 3.37Å; M156-Q160 PolarHBondContact O-N 2.89Å; M156-F174 HydrophobicContact CE-CB 3.77Å; M156-T175 VanDerWaalsContact CE-O 3.26Å; M156-T175 WeakPolarHBondContact CE-O 3.34Å; M156-V176 HydrophobicContact CB-CG1 4.02Å; M156-V176 HydrophobicContact CG-CG1 4.07Å; M156-N180 HydrophobicContact CE-CB 4.07Å; M156-N180 HydrophobicContact SD-CB 3.97Å; M156-Y181 HydrophobicContact CB-CD2 3.83Å; M156-Y181 HydrophobicContact CB-CG 4.49Å; M156-V184 HydrophobicContact CE-CG2 3.89Å
157	V	89.3	Confident	89.1	Confident	78 Å²	78	52.4 Å²	52.4	47%	0.473	30%	0.296	S	S	.	.	H	α-helix	trans	-63.9	-46	172.4	175.6	0	0	0	0	110.8	V153 T154 L159 Q160 S161 V176	V153-V157 WeakPolarHBondContact O-CG2 3.32Å; V153-V157 PolarHBondContact O-N 2.65Å; T154-V157 PolarHBondContact O-N 3.2Å; V157-L159 VanDerWaalsContact C-N 3.32Å; V157-L159 PolarHBondContact O-N 3.4Å; V157-Q160 PolarHBondContact O-N 2.97Å; V157-S161 PolarHBondContact O-N 3.31Å; V157-V176 HydrophobicContact CG2-CG1 3.68Å
158	Y	92.3	Very high	89.7	Confident	100 Å²	100	50.7 Å²	50.7	39%	0.392	29%	0.294	S	S	.	.	H	α-helix	trans	-61.7	-41.7	175.8	-74.9	-58.2	0	0	0	111.7	L123 V144 L150 T154 K155 S161 A162	L123-Y158 HydrophobicContact CD1-CD1 3.61Å; L123-Y158 HydrophobicContact CD1-CE1 4.34Å; L123-Y158 HydrophobicContact CD1-CG 4.29Å; V144-Y158 HydrophobicContact CG1-CD2 4.22Å; V144-Y158 HydrophobicContact CG2-CG 4.5Å; L150-Y158 HydrophobicContact CD1-CD2 4.32Å; L150-Y158 HydrophobicContact CD1-CE2 4.2Å; T154-Y158 HydrophobicContact CG2-CD2 4.06Å; T154-Y158 HydrophobicContact CG2-CE2 3.67Å; T154-Y158 VanDerWaalsContact O-CD2 3.24Å; T154-Y158 WeakPolarHBondContact O-CD2 3.33Å; T154-Y158 PolarHBondContact O-N 3.47Å; T154-Y158 VanDerWaalsContact O-N 3.11Å; K155-Y158 PolarHBondContact O-N 3.3Å; Y158-S161 PolarHBondContact O-N 3.03Å; Y158-S161 PolarHBondContact O-OG 3.31Å; Y158-A162 WeakPolarHBondContact O-CB 3Å; Y158-A162 PolarHBondContact O-N 3.35Å; Y158-A162 VanDerWaalsContact O-N 3.09Å
159	L	93.1	Very high	90.1	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-60.5	-50.5	175.5	-174.3	57.8	0	0	0	111.1	F136 F140 K155 M156 V157 S161 A162 L163 Y181 V184 L188	F136-L159 HydrophobicContact CZ-CD1 4.15Å; F140-L159 HydrophobicContact CD1-CD1 4.29Å; F140-L159 HydrophobicContact CD2-CD1 4.44Å; F140-L159 HydrophobicContact CE1-CB 4.25Å; F140-L159 HydrophobicContact CE1-CD1 3.89Å; F140-L159 HydrophobicContact CE2-CB 4.16Å; F140-L159 HydrophobicContact CE2-CD1 4.05Å; F140-L159 HydrophobicContact CZ-CB 3.58Å; F140-L159 HydrophobicContact CZ-CD1 3.77Å; F140-L159 HydrophobicContact CZ-CG 4.23Å; K155-L159 WeakPolarHBondContact O-CB 3.41Å; K155-L159 PolarHBondContact O-N 3.04Å; M156-L159 PolarHBondContact O-N 3.49Å; V157-L159 VanDerWaalsContact C-N 3.32Å; V157-L159 PolarHBondContact O-N 3.4Å; L159-S161 PolarHBondContact O-N 2.81Å; L159-A162 PolarHBondContact O-N 3.46Å; L159-L163 HydrophobicContact CD1-CD1 3.94Å; L159-L163 HydrophobicContact CD1-CD2 4.4Å; L159-L163 HydrophobicContact CD1-CG 4.13Å; L159-L163 HydrophobicContact CG-CD1 3.81Å; L159-L163 HydrophobicContact CG-CG 4.4Å; L159-L163 VanDerWaalsContact O-CG 3.23Å; L159-L163 WeakPolarHBondContact O-CG 3.38Å; L159-L163 PolarHBondContact O-N 3.46Å; L159-L163 VanDerWaalsContact O-N 3.16Å; L159-Y181 HydrophobicContact CB-CE2 4.48Å; L159-Y181 HydrophobicContact CD2-CD2 4.35Å; L159-Y181 HydrophobicContact CD2-CE2 4.01Å; L159-V184 HydrophobicContact CD2-CG1 3.68Å; L159-L188 HydrophobicContact CD1-CD1 4.1Å; L159-L188 HydrophobicContact CD2-CD1 3.92Å; L159-L188 HydrophobicContact CG-CD1 4.31Å
160	Q	90.3	Very high	90.4	Very high	65 Å²	65	44.3 Å²	44.3	30%	0.304	26%	0.258	S	S	.	.	H	α-helix	trans	-58.7	-35.2	176.5	-77.9	-173.3	-8.9	0	0	112.8	M156 V157 A162 I171	M156-Q160 WeakPolarHBondContact O-CG 3.37Å; M156-Q160 PolarHBondContact O-N 2.89Å; V157-Q160 PolarHBondContact O-N 2.97Å; Q160-A162 VanDerWaalsContact C-N 3.28Å; Q160-A162 PolarHBondContact O-N 3.37Å; Q160-I171 HydrophobicContact CG-CD1 3.97Å
161	S	90.6	Very high	90.7	Very high	64 Å²	64	43 Å²	43	45%	0.448	25%	0.251	S	S	.	.	H	α-helix	trans	-73.5	-18.5	176.5	77.5	0	0	0	0	114.4	Q125 V157 Y158 L159	Q125-S161 PolarHBondContact NE2-O 2.76Å; Q125-S161 VanDerWaalsContact NE2-O 3.1Å; V157-S161 PolarHBondContact O-N 3.31Å; Y158-S161 PolarHBondContact O-N 3.03Å; Y158-S161 PolarHBondContact O-OG 3.31Å; L159-S161 PolarHBondContact O-N 2.81Å
162	A	93.2	Very high	90.7	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-95.4	-11.6	179.6	0	0	0	0	0	112.8	P124 Q125 F126 F136 F140 Y158 L159 Q160	P124-A162 WeakPolarHBondContact O-CB 3.43Å; Q125-A162 CarbonylContact C-O 3.36Å; Q125-A162 WeakPolarHBondContact CA-O 3.06Å; Q125-A162 PolarHBondContact OE1-O 3.5Å; F126-A162 PolarHBondContact N-O 3.02Å; F136-A162 HydrophobicContact CE2-CB 4.14Å; F140-A162 HydrophobicContact CD2-CB 4.3Å; F140-A162 HydrophobicContact CE2-CB 4.26Å; Y158-A162 WeakPolarHBondContact O-CB 3Å; Y158-A162 PolarHBondContact O-N 3.35Å; Y158-A162 VanDerWaalsContact O-N 3.09Å; L159-A162 PolarHBondContact O-N 3.46Å; Q160-A162 VanDerWaalsContact C-N 3.28Å; Q160-A162 PolarHBondContact O-N 3.37Å
163	L	95.1	Very high	90.4	Very high	8 Å²	8	51.1 Å²	51.1	4%	0.042	29%	0.293	C	S	.	.	B	Isolated β-bridge	trans	-101.7	142	-177	-64.8	172.9	0	0	0	111.8	F126 F136 L159 A167 L168 I171 L188	F126-L163 HydrophobicContact CB-CD2 4.24Å; F126-L163 HydrophobicContact CD1-CD2 3.75Å; F126-L163 HydrophobicContact CG-CD2 4.49Å; F126-L163 CarbonylContact O-C 3.49Å; F126-L163 WeakPolarHBondContact O-CA 3.18Å; F136-L163 HydrophobicContact CE1-CD2 4.11Å; F136-L163 HydrophobicContact CZ-CD2 3.82Å; L159-L163 HydrophobicContact CD1-CD1 3.94Å; L159-L163 HydrophobicContact CD1-CD2 4.4Å; L159-L163 HydrophobicContact CD1-CG 4.13Å; L159-L163 HydrophobicContact CG-CD1 3.81Å; L159-L163 HydrophobicContact CG-CG 4.4Å; L159-L163 VanDerWaalsContact O-CG 3.23Å; L159-L163 WeakPolarHBondContact O-CG 3.38Å; L159-L163 PolarHBondContact O-N 3.46Å; L159-L163 VanDerWaalsContact O-N 3.16Å; L163-A167 HydrophobicContact CD2-CB 3.96Å; L163-L168 HydrophobicContact CB-CB 4.13Å; L163-L168 HydrophobicContact CB-CD1 4.15Å; L163-I171 HydrophobicContact CD1-CD1 3.46Å; L163-I171 VanDerWaalsContact CD1-CD1 3.46Å; L163-I171 HydrophobicContact CD1-CG1 4.2Å; L163-L188 HydrophobicContact CD1-CD1 3.9Å; L163-L188 HydrophobicContact CD1-CD2 4.34Å; L163-L188 HydrophobicContact CD2-CD1 4.48Å; L163-L188 HydrophobicContact CD2-CD2 4.48Å
164	G	91.7	Very high	90.5	Very high	22 Å²	22	51.6 Å²	51.6	23%	0.227	29%	0.291	C	S	.	.			trans	-139.2	176.7	170.7	0	0	0	0	0	112	F126 S127 A167 L168	F126-G164 PolarHBondContact O-N 2.72Å; S127-G164 CarbonylContact C-O 3.57Å; S127-G164 VanDerWaalsContact CA-O 3.27Å; S127-G164 WeakPolarHBondContact CA-O 3.09Å; G164-A167 PolarHBondContact O-N 3.03Å; G164-L168 PolarHBondContact O-N 3.46Å
165	G	92.3	Very high	90.4	Very high	47 Å²	47	53.9 Å²	53.9	49%	0.485	31%	0.305	S	S	.	.	H	α-helix	trans	52.4	-138.7	174.5	0	0	0	0	0	114.1	A167 L168 D169	G165-A167 PolarHBondContact O-N 3.16Å; G165-L168 PolarHBondContact O-N 3.46Å; G165-D169 PolarHBondContact O-N 3.4Å
166	E	89.3	Confident	90.1	Very high	117 Å²	117	55.4 Å²	55.4	55%	0.547	32%	0.316	S	S	.	.	H	α-helix	trans	-61.1	-27.2	-177.8	-71.8	-162.2	-168.2	0	0	113.7	S127 A170 R191 F192	S127-E166 PolarHBondContact O-N 2.93Å; E166-A170 WeakPolarHBondContact O-CB 3.33Å; E166-A170 PolarHBondContact O-N 2.97Å; E166-R191 IonicContact OE2-NH2 3.87Å; E166-R191 PolarHBondContact OE2-NH2 3.31Å; E166-F192 HydrophobicContact CB-CZ 4.44Å
167	A	93.2	Very high	89.7	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-73	-38.8	179.6	0	0	0	0	0	112.1	F126 L163 G164 G165 A170 L188 F192	F126-A167 HydrophobicContact CD1-CB 3.49Å; F126-A167 VanDerWaalsContact CD1-CB 3.49Å; F126-A167 HydrophobicContact CE1-CB 3.48Å; F126-A167 VanDerWaalsContact CE1-CB 3.48Å; L163-A167 HydrophobicContact CD2-CB 3.96Å; G164-A167 PolarHBondContact O-N 3.03Å; G165-A167 PolarHBondContact O-N 3.16Å; A167-A170 WeakPolarHBondContact O-CB 3.4Å; A167-L188 HydrophobicContact CB-CD2 4.43Å; A167-F192 HydrophobicContact CB-CE2 3.92Å; A167-F192 HydrophobicContact CB-CZ 4.01Å
168	L	92.4	Very high	89.2	Confident	63 Å²	63	58.1 Å²	58.1	33%	0.33	33%	0.329	S	S	.	.	H	α-helix	trans	-69.8	-40.5	172.5	-174.9	64.6	0	0	0	111.1	L163 G164 G165 A170 I171 R172	L163-L168 HydrophobicContact CB-CB 4.13Å; L163-L168 HydrophobicContact CB-CD1 4.15Å; G164-L168 PolarHBondContact O-N 3.46Å; G165-L168 PolarHBondContact O-N 3.46Å; L168-A170 VanDerWaalsContact C-N 3.26Å; L168-A170 PolarHBondContact O-N 3.24Å; L168-I171 HydrophobicContact CD1-CD1 4.5Å; L168-I171 HydrophobicContact CD1-CG1 4.46Å; L168-I171 WeakPolarHBondContact O-CG1 3.2Å; L168-I171 PolarHBondContact O-N 3.32Å; L168-I171 VanDerWaalsContact O-N 3.14Å; L168-R172 PolarHBondContact O-N 3.43Å; L168-R172 VanDerWaalsContact O-N 3.11Å
169	D	89.8	Confident	88.7	Confident	96 Å²	96	56.7 Å²	56.7	51%	0.513	34%	0.339	S	S	.	.	H	α-helix	trans	-61.7	-34.3	176.8	-76.9	-31.1	0	0	0	112.4	G165 I171 R172	G165-D169 PolarHBondContact O-N 3.4Å; D169-I171 PolarHBondContact O-N 2.78Å; D169-I171 VanDerWaalsContact O-N 3.16Å; D169-R172 PolarHBondContact O-N 3.17Å
170	A	88.5	Confident	88.7	Confident	19 Å²	19	58.1 Å²	58.1	16%	0.157	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-28.2	176.1	0	0	0	0	0	113.5	E166 A167 L168 F192	E166-A170 WeakPolarHBondContact O-CB 3.33Å; E166-A170 PolarHBondContact O-N 2.97Å; A167-A170 WeakPolarHBondContact O-CB 3.4Å; L168-A170 VanDerWaalsContact C-N 3.26Å; L168-A170 PolarHBondContact O-N 3.24Å; A170-F192 HydrophobicContact CB-CE2 4.25Å
171	I	90.9	Very high	88.8	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.4	3	-172.9	68.6	157.3	0	0	0	112.7	Q160 L163 L168 D169 G173 F174 V184 L188	Q160-I171 HydrophobicContact CG-CD1 3.97Å; L163-I171 HydrophobicContact CD1-CD1 3.46Å; L163-I171 VanDerWaalsContact CD1-CD1 3.46Å; L163-I171 HydrophobicContact CD1-CG1 4.2Å; L168-I171 HydrophobicContact CD1-CD1 4.5Å; L168-I171 HydrophobicContact CD1-CG1 4.46Å; L168-I171 WeakPolarHBondContact O-CG1 3.2Å; L168-I171 PolarHBondContact O-N 3.32Å; L168-I171 VanDerWaalsContact O-N 3.14Å; D169-I171 PolarHBondContact O-N 2.78Å; D169-I171 VanDerWaalsContact O-N 3.16Å; I171-G173 PolarHBondContact O-N 3.23Å; I171-F174 HydrophobicContact CB-CD2 4.39Å; I171-F174 PolarHBondContact O-N 3.1Å; I171-V184 HydrophobicContact CB-CG1 4.17Å; I171-V184 HydrophobicContact CB-CG2 4.35Å; I171-V184 HydrophobicContact CD1-CG1 4.04Å; I171-V184 HydrophobicContact CG2-CB 4.48Å; I171-V184 HydrophobicContact CG2-CG1 3.68Å; I171-V184 HydrophobicContact CG2-CG2 4.36Å; I171-L188 HydrophobicContact CG2-CD2 4.13Å; I171-L188 HydrophobicContact CG2-CG 4.16Å
172	R	85.7	Confident	88.7	Confident	200 Å²	200	54.9 Å²	54.9	76%	0.755	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-27.1	-173.3	-171.9	175.7	-180	-177.1	-1.2	113.9	L168 D169	L168-R172 PolarHBondContact O-N 3.43Å; L168-R172 VanDerWaalsContact O-N 3.11Å; D169-R172 PolarHBondContact O-N 3.17Å
173	G	82.4	Confident	88.6	Confident	77 Å²	77	58.6 Å²	58.6	79%	0.794	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-9.8	177.2	0	0	0	0	0	115.1	I171	I171-G173 PolarHBondContact O-N 3.23Å
174	F	88.6	Confident	88.5	Confident	58 Å²	58	58.2 Å²	58.2	25%	0.254	35%	0.346	S	S	.	.			trans	-90.3	118.8	-179.1	-68	-90.4	0	0	0	110.7	M156 I171 N180 I183 V184 I187	M156-F174 HydrophobicContact CE-CB 3.77Å; I171-F174 HydrophobicContact CB-CD2 4.39Å; I171-F174 PolarHBondContact O-N 3.1Å; F174-N180 HydrophobicContact CB-CB 4.46Å; F174-N180 HydrophobicContact CD1-CB 4.12Å; F174-I183 HydrophobicContact CE1-CG2 3.77Å; F174-I183 HydrophobicContact CZ-CG2 4.14Å; F174-V184 HydrophobicContact CB-CG2 3.74Å; F174-V184 HydrophobicContact CD1-CG2 4Å; F174-V184 HydrophobicContact CD2-CG2 3.95Å; F174-V184 HydrophobicContact CG-CG2 3.61Å; F174-I187 HydrophobicContact CD2-CD1 4.36Å; F174-I187 HydrophobicContact CE1-CD1 4.11Å; F174-I187 HydrophobicContact CE2-CD1 3.31Å; F174-I187 HydrophobicContact CZ-CD1 3.16Å
175	T	84.2	Confident	88.5	Confident	97 Å²	97	57.7 Å²	57.7	60%	0.595	34%	0.338	S	S	*	.			trans	-66.5	148	168.3	51.2	0	0	0	0	110.2	M156 T177 N180	M156-T175 VanDerWaalsContact CE-O 3.26Å; M156-T175 WeakPolarHBondContact CE-O 3.34Å; T175-T177 PolarHBondContact O-N 2.64Å; T175-N180 PolarHBondContact O-ND2 2.76Å; T175-N180 PolarHBondContact OG1-ND2 2.83Å
176	V	87.7	Confident	88.3	Confident	53 Å²	53	59.6 Å²	59.6	32%	0.321	34%	0.337	S	S	.	.	S	Bend	trans	-70.9	94.3	179.6	-173.7	0	0	0	0	109.5	V153 M156 V157	V153-V176 HydrophobicContact CG1-CG1 3.98Å; M156-V176 HydrophobicContact CB-CG1 4.02Å; M156-V176 HydrophobicContact CG-CG1 4.07Å; V157-V176 HydrophobicContact CG2-CG1 3.68Å
177	T	82.9	Confident	88.4	Confident	49 Å²	49	56.2 Å²	56.2	30%	0.301	32%	0.322	S	S	.	.			trans	-135.8	156.9	179.5	72.8	0	0	0	0	110.9	T175 A179 N180 Y181	T175-T177 PolarHBondContact O-N 2.64Å; T177-A179 PolarHBondContact O-N 2.72Å; T177-N180 PolarHBondContact O-N 3.06Å; T177-N180 WeakPolarHBondContact OG1-CB 3.21Å; T177-N180 PolarHBondContact OG1-N 3.28Å; T177-N180 PolarHBondContact OG1-ND2 2.87Å; T177-Y181 PolarHBondContact O-N 3.32Å
178	N	78.5	Confident	88.4	Confident	85 Å²	85	56.2 Å²	56.2	46%	0.455	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-34.9	179.4	-83.8	-42.6	0	0	0	112.4	N152 V153	N152-N178 WeakPolarHBondContact CA-OD1 3.38Å; N152-N178 HydrophobicContact CB-CB 4.13Å; N152-N178 WeakPolarHBondContact CB-O 3.31Å; N152-N178 VanDerWaalsContact CB-OD1 3.28Å; N152-N178 WeakPolarHBondContact CB-OD1 3.14Å; N152-N178 PolarHBondContact N-OD1 2.84Å; N152-N178 VanDerWaalsContact N-OD1 3.13Å; N152-N178 PolarHBondContact ND2-O 3.48Å; V153-N178 HydrophobicContact CG2-CB 4.23Å; V153-N178 VanDerWaalsContact CG2-N 3.33Å; V153-N178 WeakPolarHBondContact CG2-OD1 3.28Å; V153-N178 PolarHBondContact N-OD1 2.92Å
179	A	82.9	Confident	88.2	Confident	71 Å²	71	58 Å²	58	59%	0.587	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-30.6	-178.6	0	0	0	0	0	112.5	T177 P182	T177-A179 PolarHBondContact O-N 2.72Å; A179-P182 WeakPolarHBondContact O-CD 3.47Å
180	N	91.8	Very high	88	Confident	29 Å²	29	59.2 Å²	59.2	16%	0.155	33%	0.327	C	S	.	.	H	α-helix	trans	-79	-24.6	-177.4	-70.2	-15.6	0	0	0	113.3	M156 F174 T175 T177 I183 V184	M156-N180 HydrophobicContact CE-CB 4.07Å; M156-N180 HydrophobicContact SD-CB 3.97Å; F174-N180 HydrophobicContact CB-CB 4.46Å; F174-N180 HydrophobicContact CD1-CB 4.12Å; T175-N180 PolarHBondContact O-ND2 2.76Å; T175-N180 PolarHBondContact OG1-ND2 2.83Å; T177-N180 PolarHBondContact O-N 3.06Å; T177-N180 WeakPolarHBondContact OG1-CB 3.21Å; T177-N180 PolarHBondContact OG1-N 3.28Å; T177-N180 PolarHBondContact OG1-ND2 2.87Å; N180-I183 WeakPolarHBondContact O-CB 3.38Å; N180-I183 PolarHBondContact O-N 2.78Å; N180-V184 WeakPolarHBondContact O-CB 3.15Å; N180-V184 VanDerWaalsContact O-CG2 3.31Å; N180-V184 WeakPolarHBondContact O-CG2 3.43Å; N180-V184 PolarHBondContact O-N 3.08Å
181	Y	92.6	Very high	87.9	Confident	4 Å²	4	63.5 Å²	63.5	2%	0.016	34%	0.339	C	S	.	.	H	α-helix	trans	-59.2	-50.2	-175.2	177.1	-104.4	0	0	0	114	D145 N152 K155 M156 L159 T177 I183 V184 I185	D145-Y181 VanDerWaalsContact OD1-CE1 3.27Å; D145-Y181 WeakPolarHBondContact OD1-CE1 3.37Å; D145-Y181 PolarHBondContact OD1-OH 2.76Å; N152-Y181 HydrophobicContact CB-CD1 4.02Å; N152-Y181 HydrophobicContact CB-CG 4.14Å; K155-Y181 HydrophobicContact CB-CD1 4.4Å; K155-Y181 HydrophobicContact CB-CD2 3.96Å; K155-Y181 HydrophobicContact CB-CE1 3.93Å; K155-Y181 HydrophobicContact CB-CE2 3.41Å; K155-Y181 VanDerWaalsContact CB-CE2 3.41Å; K155-Y181 HydrophobicContact CB-CG 4.41Å; K155-Y181 HydrophobicContact CD-CD1 4.4Å; K155-Y181 HydrophobicContact CD-CE1 3.64Å; K155-Y181 HydrophobicContact CG-CE1 4.45Å; M156-Y181 HydrophobicContact CB-CD2 3.83Å; M156-Y181 HydrophobicContact CB-CG 4.49Å; L159-Y181 HydrophobicContact CB-CE2 4.48Å; L159-Y181 HydrophobicContact CD2-CD2 4.35Å; L159-Y181 HydrophobicContact CD2-CE2 4.01Å; T177-Y181 PolarHBondContact O-N 3.32Å; Y181-I183 VanDerWaalsContact C-N 3.31Å; Y181-I183 PolarHBondContact O-N 2.78Å; Y181-V184 PolarHBondContact O-N 3.4Å; Y181-I185 HydrophobicContact CD1-CD1 3.82Å; Y181-I185 HydrophobicContact CD2-CD1 4.46Å; Y181-I185 HydrophobicContact CE1-CD1 3.25Å; Y181-I185 HydrophobicContact CE1-CG1 4.31Å; Y181-I185 HydrophobicContact CE2-CD1 3.99Å; Y181-I185 HydrophobicContact CE2-CG1 4.28Å; Y181-I185 HydrophobicContact CG-CD1 4.4Å; Y181-I185 WeakPolarHBondContact O-CG1 3.49Å; Y181-I185 PolarHBondContact O-N 2.84Å
182	P	89.5	Confident	88	Confident	57 Å²	57	63.8 Å²	63.8	37%	0.37	34%	0.34	S	S	.	.	H	α-helix	trans	-59.9	-42.4	175.8	-20.4	33	0	0	0	112	A179 V184 I185 D186	A179-P182 WeakPolarHBondContact O-CD 3.47Å; P182-V184 VanDerWaalsContact C-N 3.31Å; P182-V184 PolarHBondContact O-N 2.94Å; P182-I185 WeakPolarHBondContact O-CB 3.47Å; P182-I185 PolarHBondContact O-N 3.31Å; P182-I185 VanDerWaalsContact O-N 3.17Å; P182-D186 PolarHBondContact O-N 3.31Å
183	I	90.3	Very high	87.8	Confident	78 Å²	78	55.6 Å²	55.6	40%	0.4	32%	0.318	S	S	.	.	H	α-helix	trans	-60.6	-42.8	178.4	-57.1	172.5	0	0	0	110.8	F174 N180 Y181 D186 I187	F174-I183 HydrophobicContact CE1-CG2 3.77Å; F174-I183 HydrophobicContact CZ-CG2 4.14Å; N180-I183 WeakPolarHBondContact O-CB 3.38Å; N180-I183 PolarHBondContact O-N 2.78Å; Y181-I183 VanDerWaalsContact C-N 3.31Å; Y181-I183 PolarHBondContact O-N 2.78Å; I183-D186 PolarHBondContact O-N 3.37Å; I183-I187 HydrophobicContact CG2-CD1 3.96Å; I183-I187 VanDerWaalsContact O-CG1 3.25Å; I183-I187 WeakPolarHBondContact O-CG1 3.43Å; I183-I187 PolarHBondContact O-N 2.87Å
184	V	92.7	Very high	87.9	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-65.4	-39.8	177.6	161.8	0	0	0	0	111.6	M156 L159 I171 F174 N180 Y181 P182 I187 L188	M156-V184 HydrophobicContact CE-CG2 3.89Å; L159-V184 HydrophobicContact CD2-CG1 3.68Å; I171-V184 HydrophobicContact CB-CG1 4.17Å; I171-V184 HydrophobicContact CB-CG2 4.35Å; I171-V184 HydrophobicContact CD1-CG1 4.04Å; I171-V184 HydrophobicContact CG2-CB 4.48Å; I171-V184 HydrophobicContact CG2-CG1 3.68Å; I171-V184 HydrophobicContact CG2-CG2 4.36Å; F174-V184 HydrophobicContact CB-CG2 3.74Å; F174-V184 HydrophobicContact CD1-CG2 4Å; F174-V184 HydrophobicContact CD2-CG2 3.95Å; F174-V184 HydrophobicContact CG-CG2 3.61Å; N180-V184 WeakPolarHBondContact O-CB 3.15Å; N180-V184 VanDerWaalsContact O-CG2 3.31Å; N180-V184 WeakPolarHBondContact O-CG2 3.43Å; N180-V184 PolarHBondContact O-N 3.08Å; Y181-V184 PolarHBondContact O-N 3.4Å; P182-V184 VanDerWaalsContact C-N 3.31Å; P182-V184 PolarHBondContact O-N 2.94Å; V184-I187 PolarHBondContact O-N 3.19Å; V184-L188 HydrophobicContact CG1-CD1 4.14Å; V184-L188 WeakPolarHBondContact O-CG 3.31Å; V184-L188 PolarHBondContact O-N 2.64Å
185	I	91.7	Very high	87.6	Confident	12 Å²	12	59 Å²	59	6%	0.062	31%	0.311	C	S	.	.	H	α-helix	trans	-60.5	-48.3	173.2	-68.8	170.9	0	0	0	110.3	W137 Y181 P182 I187 L188 R189	W137-I185 HydrophobicContact CH2-CB 4.14Å; W137-I185 HydrophobicContact CH2-CD1 3.81Å; W137-I185 HydrophobicContact CH2-CG1 3.66Å; W137-I185 HydrophobicContact CH2-CG2 3.44Å; W137-I185 VanDerWaalsContact CH2-CG2 3.44Å; W137-I185 HydrophobicContact CZ2-CG2 3.86Å; W137-I185 HydrophobicContact CZ3-CG1 4.2Å; W137-I185 HydrophobicContact CZ3-CG2 4.13Å; Y181-I185 HydrophobicContact CD1-CD1 3.82Å; Y181-I185 HydrophobicContact CD2-CD1 4.46Å; Y181-I185 HydrophobicContact CE1-CD1 3.25Å; Y181-I185 HydrophobicContact CE1-CG1 4.31Å; Y181-I185 HydrophobicContact CE2-CD1 3.99Å; Y181-I185 HydrophobicContact CE2-CG1 4.28Å; Y181-I185 HydrophobicContact CG-CD1 4.4Å; Y181-I185 WeakPolarHBondContact O-CG1 3.49Å; Y181-I185 PolarHBondContact O-N 2.84Å; P182-I185 WeakPolarHBondContact O-CB 3.47Å; P182-I185 PolarHBondContact O-N 3.31Å; P182-I185 VanDerWaalsContact O-N 3.17Å; I185-I187 VanDerWaalsContact C-N 3.31Å; I185-I187 PolarHBondContact O-N 2.83Å; I185-L188 PolarHBondContact O-N 2.84Å; I185-L188 VanDerWaalsContact O-N 3.16Å; I185-R189 HydrophobicContact CG2-CG 4.2Å; I185-R189 WeakPolarHBondContact O-CB 3.49Å; I185-R189 WeakPolarHBondContact O-CG 3.31Å; I185-R189 PolarHBondContact O-N 3.15Å
186	D	89.8	Confident	87.5	Confident	87 Å²	87	57.2 Å²	57.2	47%	0.465	30%	0.298	S	S	.	.	H	α-helix	trans	-59.8	-43.8	-179.9	-67.8	-24.5	0	0	0	110.5	P182 I183 L188 R189 E190	P182-D186 PolarHBondContact O-N 3.31Å; I183-D186 PolarHBondContact O-N 3.37Å; D186-L188 PolarHBondContact O-N 3.19Å; D186-R189 PolarHBondContact O-N 3.04Å; D186-E190 VanDerWaalsContact O-CB 3.3Å; D186-E190 WeakPolarHBondContact O-CB 3.49Å; D186-E190 VanDerWaalsContact O-CG 3.31Å; D186-E190 WeakPolarHBondContact O-CG 3.45Å; D186-E190 PolarHBondContact O-N 3.12Å
187	I	91.2	Very high	87.3	Confident	45 Å²	45	56.2 Å²	56.2	23%	0.231	30%	0.295	C	S	.	.	H	α-helix	trans	-59.9	-44.1	175.2	-70.9	166.1	0	0	0	112	F174 I183 V184 I185 R191	F174-I187 HydrophobicContact CD2-CD1 4.36Å; F174-I187 HydrophobicContact CE1-CD1 4.11Å; F174-I187 HydrophobicContact CE2-CD1 3.31Å; F174-I187 HydrophobicContact CZ-CD1 3.16Å; I183-I187 HydrophobicContact CG2-CD1 3.96Å; I183-I187 VanDerWaalsContact O-CG1 3.25Å; I183-I187 WeakPolarHBondContact O-CG1 3.43Å; I183-I187 PolarHBondContact O-N 2.87Å; V184-I187 PolarHBondContact O-N 3.19Å; I185-I187 VanDerWaalsContact C-N 3.31Å; I185-I187 PolarHBondContact O-N 2.83Å; I187-R191 WeakPolarHBondContact O-CB 3.41Å; I187-R191 PolarHBondContact O-N 2.85Å
188	L	92.4	Very high	87.6	Confident	0 Å²	0	55 Å²	55	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-66.2	-43.5	178.8	-71.9	169.8	0	0	0	111.4	F133 L159 L163 A167 I171 V184 I185 D186 R191 F192	F133-L188 HydrophobicContact CE2-CB 4.31Å; L159-L188 HydrophobicContact CD1-CD1 4.1Å; L159-L188 HydrophobicContact CD2-CD1 3.92Å; L159-L188 HydrophobicContact CG-CD1 4.31Å; L163-L188 HydrophobicContact CD1-CD1 3.9Å; L163-L188 HydrophobicContact CD1-CD2 4.34Å; L163-L188 HydrophobicContact CD2-CD1 4.48Å; L163-L188 HydrophobicContact CD2-CD2 4.48Å; A167-L188 HydrophobicContact CB-CD2 4.43Å; I171-L188 HydrophobicContact CG2-CD2 4.13Å; I171-L188 HydrophobicContact CG2-CG 4.16Å; V184-L188 HydrophobicContact CG1-CD1 4.14Å; V184-L188 WeakPolarHBondContact O-CG 3.31Å; V184-L188 PolarHBondContact O-N 2.64Å; I185-L188 PolarHBondContact O-N 2.84Å; I185-L188 VanDerWaalsContact O-N 3.16Å; D186-L188 PolarHBondContact O-N 3.19Å; L188-R191 PolarHBondContact O-N 2.88Å; L188-F192 HydrophobicContact CD2-CD2 3.98Å; L188-F192 HydrophobicContact CD2-CE2 3.87Å; L188-F192 WeakPolarHBondContact O-CB 3.38Å; L188-F192 WeakPolarHBondContact O-CD2 3.49Å; L188-F192 PolarHBondContact O-N 3.37Å
189	R	88.6	Confident	88	Confident	101 Å²	101	51.7 Å²	51.7	38%	0.381	27%	0.27	S	S	.	.	H	α-helix	trans	-65.2	-43.8	176.7	-74.2	179.3	171	176.2	-6.1	111.7	F133 E141 I185 D186 R191 G193	F133-R189 HydrophobicContact CE1-CG 4.39Å; F133-R189 HydrophobicContact CZ-CG 4.09Å; E141-R189 IonicContact OE1-NH2 2.89Å; E141-R189 PolarHBondContact OE1-NH2 2.9Å; I185-R189 HydrophobicContact CG2-CG 4.2Å; I185-R189 WeakPolarHBondContact O-CB 3.49Å; I185-R189 WeakPolarHBondContact O-CG 3.31Å; I185-R189 PolarHBondContact O-N 3.15Å; D186-R189 PolarHBondContact O-N 3.04Å; R189-R191 PolarHBondContact O-N 3.45Å; R189-G193 CarbonylContact O-C 3.54Å; R189-G193 WeakPolarHBondContact O-CA 3.47Å; R189-G193 PolarHBondContact O-N 3.36Å
190	E	84.7	Confident	88.3	Confident	121 Å²	121	49.7 Å²	49.7	57%	0.565	25%	0.249	S	C	*	.	H	α-helix	trans	-67.9	-33.5	177.9	-75.1	-168	153.7	0	0	112.9	D186 R194	D186-E190 VanDerWaalsContact O-CB 3.3Å; D186-E190 WeakPolarHBondContact O-CB 3.49Å; D186-E190 VanDerWaalsContact O-CG 3.31Å; D186-E190 WeakPolarHBondContact O-CG 3.45Å; D186-E190 PolarHBondContact O-N 3.12Å; E190-R194 WeakPolarHBondContact O-CD 3.26Å; E190-R194 WeakPolarHBondContact O-CG 3.28Å
191	R	87.3	Confident	88.3	Confident	110 Å²	110	49.5 Å²	49.5	42%	0.415	25%	0.251	S	S	.	.	H	α-helix	trans	-83.1	-42.9	-179.4	-173.5	170	173.7	173.9	-6	113	E166 I187 L188 R189	E166-R191 IonicContact OE2-NH2 3.87Å; E166-R191 PolarHBondContact OE2-NH2 3.31Å; I187-R191 WeakPolarHBondContact O-CB 3.41Å; I187-R191 PolarHBondContact O-N 2.85Å; L188-R191 PolarHBondContact O-N 2.88Å; R189-R191 PolarHBondContact O-N 3.45Å
192	F	91.9	Very high	88.3	Confident	5 Å²	5	50 Å²	50	2%	0.022	25%	0.254	C	S	.	.	H	α-helix	trans	-116.1	-21.1	-170.1	-55.8	-73.9	0	0	0	114.4	F126 G128 V130 F133 E166 A167 A170 L188 R194	F126-F192 HydrophobicContact CE1-CB 4.33Å; F126-F192 HydrophobicContact CE1-CD1 4.38Å; F126-F192 AromaticContact CE1-CD2 3.97Å; F126-F192 HydrophobicContact CE1-CD2 3.97Å; F126-F192 HydrophobicContact CE1-CE2 4.38Å; F126-F192 AromaticContact CE1-CG 3.98Å; F126-F192 HydrophobicContact CE1-CG 3.98Å; F126-F192 HydrophobicContact CZ-CB 3.98Å; F126-F192 HydrophobicContact CZ-CD1 4.13Å; F126-F192 HydrophobicContact CZ-CD2 4.39Å; F126-F192 AromaticContact CZ-CG 3.92Å; F126-F192 HydrophobicContact CZ-CG 3.92Å; G128-F192 WeakPolarHBondContact O-CD1 3.42Å; V130-F192 HydrophobicContact CG2-CD1 4.47Å; F133-F192 HydrophobicContact CB-CB 4.25Å; F133-F192 HydrophobicContact CD1-CB 4.49Å; F133-F192 HydrophobicContact CD2-CB 3.54Å; F133-F192 HydrophobicContact CD2-CG 4.49Å; F133-F192 HydrophobicContact CE2-CB 3.95Å; F133-F192 HydrophobicContact CG-CB 3.83Å; E166-F192 HydrophobicContact CB-CZ 4.44Å; A167-F192 HydrophobicContact CB-CE2 3.92Å; A167-F192 HydrophobicContact CB-CZ 4.01Å; A170-F192 HydrophobicContact CB-CE2 4.25Å; L188-F192 HydrophobicContact CD2-CD2 3.98Å; L188-F192 HydrophobicContact CD2-CE2 3.87Å; L188-F192 WeakPolarHBondContact O-CB 3.38Å; L188-F192 WeakPolarHBondContact O-CD2 3.49Å; L188-F192 PolarHBondContact O-N 3.37Å; F192-R194 VanDerWaalsContact C-N 3.26Å; F192-R194 PolarHBondContact O-N 3Å
193	G	82.9	Confident	88.4	Confident	29 Å²	29	47.6 Å²	47.6	30%	0.299	24%	0.238	S	C	.	.			trans	-86.5	18.9	179.5	0	0	0	0	0	115.1	F133 R189 H195	F133-G193 VanDerWaalsContact CE1-CA 3.41Å; R189-G193 CarbonylContact O-C 3.54Å; R189-G193 WeakPolarHBondContact O-CA 3.47Å; R189-G193 PolarHBondContact O-N 3.36Å; G193-H195 PolarHBondContact O-N 3.25Å
194	R	83.8	Confident	88.5	Confident	71 Å²	71	45.1 Å²	45.1	27%	0.268	23%	0.225	S	C	.	.			trans	-76	109.9	-176.4	-85.4	-173.7	65.7	171.5	3.6	111.9	E190 F192 D196 A197 V198	E190-R194 WeakPolarHBondContact O-CD 3.26Å; E190-R194 WeakPolarHBondContact O-CG 3.28Å; F192-R194 VanDerWaalsContact C-N 3.26Å; F192-R194 PolarHBondContact O-N 3Å; R194-D196 WeakPolarHBondContact CB-OD1 3.49Å; R194-D196 IonicContact CZ-OD1 2.66Å; R194-D196 IonicContact CZ-OD2 3.19Å; R194-D196 IonicContact NE-OD1 2.78Å; R194-D196 PolarHBondContact NE-OD1 3.06Å; R194-D196 VanDerWaalsContact NE-OD1 3.08Å; R194-D196 IonicContact NE-OD2 3.41Å; R194-D196 IonicContact NH2-OD1 3.48Å; R194-D196 IonicContact NH2-OD2 2.71Å; R194-D196 PolarHBondContact NH2-OD2 3.21Å; R194-D196 PolarHBondContact O-N 3.46Å; R194-A197 HydrophobicContact CB-CB 3.84Å; R194-A197 PolarHBondContact O-N 2.81Å; R194-V198 WeakPolarHBondContact O-CG2 3.29Å; R194-V198 PolarHBondContact O-N 3.23Å
195	H	81.9	Confident	88.4	Confident	136 Å²	136	46.7 Å²	46.7	63%	0.63	24%	0.237	S	C	*	.	H	α-helix	trans	-51.6	-41.4	179.3	-81.3	-102	0	0	0	113.1	G193 V198 V199	G193-H195 PolarHBondContact O-N 3.25Å; H195-V198 PolarHBondContact O-N 3.35Å; H195-V199 VanDerWaalsContact O-CG2 3.3Å; H195-V199 WeakPolarHBondContact O-CG2 3.04Å; H195-V199 PolarHBondContact O-N 3.4Å
196	D	81.8	Confident	88.3	Confident	59 Å²	59	48.3 Å²	48.3	32%	0.316	25%	0.245	S	C	.	.	H	α-helix	trans	-66.2	-40.5	179.1	61	-28.7	0	0	0	112.7	R194 V199 E200	R194-D196 WeakPolarHBondContact CB-OD1 3.49Å; R194-D196 IonicContact CZ-OD1 2.66Å; R194-D196 IonicContact CZ-OD2 3.19Å; R194-D196 IonicContact NE-OD1 2.78Å; R194-D196 PolarHBondContact NE-OD1 3.06Å; R194-D196 VanDerWaalsContact NE-OD1 3.08Å; R194-D196 IonicContact NE-OD2 3.41Å; R194-D196 IonicContact NH2-OD1 3.48Å; R194-D196 IonicContact NH2-OD2 2.71Å; R194-D196 PolarHBondContact NH2-OD2 3.21Å; R194-D196 PolarHBondContact O-N 3.46Å; D196-V199 PolarHBondContact O-N 2.92Å; D196-E200 WeakPolarHBondContact O-CB 3.43Å; D196-E200 PolarHBondContact O-N 3.46Å
197	A	85.3	Confident	88.1	Confident	31 Å²	31	48.5 Å²	48.5	26%	0.256	25%	0.245	S	C	.	.	H	α-helix	trans	-67.2	-38.6	175.8	0	0	0	0	0	112.2	V130 R194 E200 A201	V130-A197 HydrophobicContact CG1-CB 4.15Å; R194-A197 HydrophobicContact CB-CB 3.84Å; R194-A197 PolarHBondContact O-N 2.81Å; A197-E200 PolarHBondContact O-N 3.11Å; A197-A201 WeakPolarHBondContact O-CB 3.39Å; A197-A201 PolarHBondContact O-N 2.86Å
198	V	87.3	Confident	87.8	Confident	25 Å²	25	53.1 Å²	53.1	15%	0.152	26%	0.264	C	S	.	.	H	α-helix	trans	-64.6	-46	176.5	-177.3	0	0	0	0	110.4	V130 L131 R194 H195 A201 H202 I237	V130-V198 HydrophobicContact CG1-CB 4.12Å; V130-V198 HydrophobicContact CG1-CG2 3.36Å; L131-V198 HydrophobicContact CD2-CG1 4.47Å; R194-V198 WeakPolarHBondContact O-CG2 3.29Å; R194-V198 PolarHBondContact O-N 3.23Å; H195-V198 PolarHBondContact O-N 3.35Å; V198-A201 PolarHBondContact O-N 3.13Å; V198-H202 PolarHBondContact O-CD2 3Å; V198-H202 VanDerWaalsContact O-CD2 3.3Å; V198-H202 PolarHBondContact O-N 3.05Å; V198-I237 HydrophobicContact CB-CD1 4.46Å; V198-I237 HydrophobicContact CG1-CD1 3.48Å; V198-I237 VanDerWaalsContact CG1-CD1 3.48Å
199	V	87.5	Confident	87.2	Confident	15 Å²	15	54.4 Å²	54.4	9%	0.091	27%	0.274	C	S	.	.	H	α-helix	trans	-61.4	-47.5	176.3	172.7	0	0	0	0	110.7	H195 D196 A201 H202 V203 L234 I237 K239 L246	H195-V199 VanDerWaalsContact O-CG2 3.3Å; H195-V199 WeakPolarHBondContact O-CG2 3.04Å; H195-V199 PolarHBondContact O-N 3.4Å; D196-V199 PolarHBondContact O-N 2.92Å; V199-A201 VanDerWaalsContact C-N 3.32Å; V199-A201 PolarHBondContact O-N 3.07Å; V199-H202 PolarHBondContact O-N 3.46Å; V199-V203 HydrophobicContact CG1-CG2 4.35Å; V199-V203 WeakPolarHBondContact O-CG2 3.49Å; V199-V203 PolarHBondContact O-N 3.37Å; V199-L234 HydrophobicContact CG1-CD2 4.21Å; V199-L234 HydrophobicContact CG2-CD2 4.47Å; V199-I237 HydrophobicContact CG2-CG2 3.86Å; V199-K239 HydrophobicContact CG2-CG 4.02Å; V199-L246 HydrophobicContact CG1-CD1 4.34Å
200	E	89.2	Confident	86.4	Confident	29 Å²	29	56 Å²	56	14%	0.136	29%	0.29	C	S	.	.	H	α-helix	trans	-57.8	-43.4	176.6	175.9	168.6	-179.9	0	0	111.7	D196 A197 H202 V203 L204 V254 K257 R265	D196-E200 WeakPolarHBondContact O-CB 3.43Å; D196-E200 PolarHBondContact O-N 3.46Å; A197-E200 PolarHBondContact O-N 3.11Å; E200-H202 PolarHBondContact O-N 2.91Å; E200-V203 PolarHBondContact O-N 3.24Å; E200-L204 HydrophobicContact CG-CD1 3.8Å; E200-L204 HydrophobicContact CG-CG 4.22Å; E200-L204 WeakPolarHBondContact O-CB 3.22Å; E200-L204 VanDerWaalsContact O-CG 3.28Å; E200-L204 WeakPolarHBondContact O-CG 3.49Å; E200-L204 PolarHBondContact O-N 2.91Å; E200-V254 HydrophobicContact CB-CG2 4.08Å; E200-V254 HydrophobicContact CG-CG1 4.14Å; E200-V254 HydrophobicContact CG-CG2 3.95Å; E200-K257 IonicContact OE1-NZ 3.03Å; E200-K257 IonicContact OE2-NZ 3.77Å; E200-K257 PolarHBondContact OE2-NZ 2.79Å; E200-R265 IonicContact OE1-CZ 2.82Å; E200-R265 IonicContact OE1-NH2 3.01Å; E200-R265 PolarHBondContact OE1-NH2 3.34Å
201	A	91.4	Very high	85.5	Confident	25 Å²	25	60.3 Å²	60.3	21%	0.207	30%	0.302	C	S	.	.	H	α-helix	trans	-63.6	-40.8	179.1	0	0	0	0	0	112.7	L131 A197 V198 V199 S205	L131-A201 HydrophobicContact CD2-CB 3.57Å; L131-A201 HydrophobicContact CG-CB 3.99Å; A197-A201 WeakPolarHBondContact O-CB 3.39Å; A197-A201 PolarHBondContact O-N 2.86Å; V198-A201 PolarHBondContact O-N 3.13Å; V199-A201 VanDerWaalsContact C-N 3.32Å; V199-A201 PolarHBondContact O-N 3.07Å; A201-S205 WeakPolarHBondContact O-CB 3.43Å; A201-S205 PolarHBondContact O-N 3.2Å; A201-S205 PolarHBondContact O-OG 3.16Å
202	H	93.8	Very high	84.4	Confident	15 Å²	15	59.8 Å²	59.8	7%	0.069	30%	0.3	C	S	.	.	H	α-helix	trans	-65.2	-45.9	174.2	-84.1	-70.2	0	0	0	112.3	L131 V198 V199 E200 L204 S205 L206 H230 A233 L234	L131-H202 VanDerWaalsContact CD2-CD2 3.49Å; L131-H202 WeakPolarHBondContact CD2-CD2 3.25Å; L131-H202 WeakPolarHBondContact CD2-NE2 3.34Å; V198-H202 PolarHBondContact O-CD2 3Å; V198-H202 VanDerWaalsContact O-CD2 3.3Å; V198-H202 PolarHBondContact O-N 3.05Å; V199-H202 PolarHBondContact O-N 3.46Å; E200-H202 PolarHBondContact O-N 2.91Å; H202-L204 PolarHBondContact O-N 3.45Å; H202-S205 PolarHBondContact O-N 3.27Å; H202-L206 WeakPolarHBondContact O-CG 3.35Å; H202-L206 PolarHBondContact O-N 2.81Å; H202-H230 AromaticContact CE1-ND1 3.66Å; H202-H230 AromaticContact ND1-CG 3.71Å; H202-H230 AromaticContact ND1-ND1 3.04Å; H202-H230 PolarHBondContact ND1-ND1 2.89Å; H202-A233 WeakPolarHBondContact CE1-CB 3.11Å; H202-A233 WeakPolarHBondContact NE2-CB 3.05Å; H202-L234 HydrophobicContact CB-CD1 4.23Å; H202-L234 HydrophobicContact CB-CD2 3.79Å; H202-L234 HydrophobicContact CB-CG 3.87Å
203	V	91.4	Very high	83.1	Confident	6 Å²	6	66.9 Å²	66.9	4%	0.036	33%	0.333	C	S	.	.	H	α-helix	trans	-62.9	-43.8	178.5	174	0	0	0	0	110.6	V199 E200 S205 L206 L207 V254	V199-V203 HydrophobicContact CG1-CG2 4.35Å; V199-V203 WeakPolarHBondContact O-CG2 3.49Å; V199-V203 PolarHBondContact O-N 3.37Å; E200-V203 PolarHBondContact O-N 3.24Å; V203-S205 VanDerWaalsContact C-N 3.3Å; V203-S205 PolarHBondContact O-N 3.13Å; V203-L206 PolarHBondContact O-N 2.78Å; V203-L207 HydrophobicContact CG1-CD1 3.94Å; V203-L207 HydrophobicContact CG1-CG 4.42Å; V203-L207 VanDerWaalsContact O-CG 3.29Å; V203-L207 WeakPolarHBondContact O-CG 3.29Å; V203-L207 PolarHBondContact O-N 2.77Å; V203-V254 HydrophobicContact CB-CG1 4.32Å; V203-V254 HydrophobicContact CB-CG2 4.3Å; V203-V254 HydrophobicContact CG1-CB 4.01Å; V203-V254 HydrophobicContact CG1-CG1 3.86Å; V203-V254 HydrophobicContact CG1-CG2 4.18Å
204	L	91.7	Very high	82.2	Confident	25 Å²	25	73.4 Å²	73.4	13%	0.131	35%	0.353	C	S	.	.	H	α-helix	trans	-62.1	-38.1	174.7	-73.5	173.7	0	0	0	112.4	E200 H202 L206 L207 K208 V254 Q258	E200-L204 HydrophobicContact CG-CD1 3.8Å; E200-L204 HydrophobicContact CG-CG 4.22Å; E200-L204 WeakPolarHBondContact O-CB 3.22Å; E200-L204 VanDerWaalsContact O-CG 3.28Å; E200-L204 WeakPolarHBondContact O-CG 3.49Å; E200-L204 PolarHBondContact O-N 2.91Å; H202-L204 PolarHBondContact O-N 3.45Å; L204-L206 VanDerWaalsContact C-N 3.34Å; L204-L207 PolarHBondContact O-N 2.96Å; L204-K208 VanDerWaalsContact O-CB 3.26Å; L204-K208 WeakPolarHBondContact O-CB 3.42Å; L204-K208 VanDerWaalsContact O-CG 3.27Å; L204-K208 WeakPolarHBondContact O-CG 3.47Å; L204-K208 PolarHBondContact O-N 3.29Å; L204-V254 HydrophobicContact CD2-CG1 3.58Å; L204-V254 HydrophobicContact CG-CG1 3.69Å; L204-Q258 HydrophobicContact CD2-CG 3.68Å
205	S	91.7	Very high	80.9	Confident	34 Å²	34	76.5 Å²	76.5	24%	0.238	38%	0.375	C	S	.	.	H	α-helix	trans	-66.4	-37.5	177.6	-58.5	0	0	0	0	111.9	A201 H202 V203 A209 H230	A201-S205 WeakPolarHBondContact O-CB 3.43Å; A201-S205 PolarHBondContact O-N 3.2Å; A201-S205 PolarHBondContact O-OG 3.16Å; H202-S205 PolarHBondContact O-N 3.27Å; V203-S205 VanDerWaalsContact C-N 3.3Å; V203-S205 PolarHBondContact O-N 3.13Å; S205-A209 PolarHBondContact O-N 2.91Å; S205-A209 VanDerWaalsContact O-N 3.14Å; S205-H230 WeakPolarHBondContact CB-CE1 3.48Å; S205-H230 WeakPolarHBondContact CB-NE2 3.48Å
206	L	89	Confident	79.6	Confident	46 Å²	46	72.3 Å²	72.3	24%	0.241	36%	0.361	C	S	.	.	H	α-helix	trans	-65.3	-40.9	172.3	-71.8	170.8	0	0	0	112.1	H202 V203 L204 L227 H230 L234	H202-L206 WeakPolarHBondContact O-CG 3.35Å; H202-L206 PolarHBondContact O-N 2.81Å; V203-L206 PolarHBondContact O-N 2.78Å; L204-L206 VanDerWaalsContact C-N 3.34Å; L206-L227 HydrophobicContact CD2-CD2 3.81Å; L206-H230 HydrophobicContact CD1-CB 4.4Å; L206-H230 HydrophobicContact CD2-CB 3.84Å; L206-H230 HydrophobicContact CG-CB 3.92Å; L206-L234 HydrophobicContact CD1-CD1 3.85Å
207	L	86.1	Confident	78.7	Confident	90 Å²	90	77.3 Å²	77.3	47%	0.471	39%	0.388	S	S	.	.	H	α-helix	trans	-73.3	-30.9	180	-69.1	171.1	0	0	0	113.4	V203 L204 V254 L255	V203-L207 HydrophobicContact CG1-CD1 3.94Å; V203-L207 HydrophobicContact CG1-CG 4.42Å; V203-L207 VanDerWaalsContact O-CG 3.29Å; V203-L207 WeakPolarHBondContact O-CG 3.29Å; V203-L207 PolarHBondContact O-N 2.77Å; L204-L207 PolarHBondContact O-N 2.96Å; L207-V254 HydrophobicContact CD1-CG1 4.46Å; L207-L255 HydrophobicContact CD1-CD2 3.56Å; L207-L255 HydrophobicContact CD1-CG 4.11Å; L207-L255 HydrophobicContact CD2-CD2 4.18Å
208	K	84.4	Confident	77.7	Confident	142 Å²	142	78.1 Å²	78.1	62%	0.617	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-1.7	179.4	-69.6	178	179.4	179.8	0	113.5	L204 D210	L204-K208 VanDerWaalsContact O-CB 3.26Å; L204-K208 WeakPolarHBondContact O-CB 3.42Å; L204-K208 VanDerWaalsContact O-CG 3.27Å; L204-K208 WeakPolarHBondContact O-CG 3.47Å; L204-K208 PolarHBondContact O-N 3.29Å; K208-D210 PolarHBondContact O-N 3.15Å
209	A	80.1	Confident	76.8	Confident	27 Å²	27	82.2 Å²	82.2	22%	0.223	42%	0.415	C	S	.	.	P	Polyproline II helix	trans	-52.8	126.6	179.1	0	0	0	0	0	110.1	S205 R211 L223 L227	S205-A209 PolarHBondContact O-N 2.91Å; S205-A209 VanDerWaalsContact O-N 3.14Å; A209-R211 PolarHBondContact O-N 2.99Å; A209-L223 HydrophobicContact CB-CD1 4.4Å; A209-L227 HydrophobicContact CB-CD2 3.79Å
210	D	70.9	Confident	76.3	Confident	134 Å²	134	86.7 Å²	86.7	72%	0.717	44%	0.437	S	S	*	.	P	Polyproline II helix	trans	-56.6	139.2	-169.5	-77.5	-37.3	0	0	0	111.9	K208 W212	K208-D210 PolarHBondContact O-N 3.15Å; D210-W212 PolarHBondContact O-N 3.38Å
211	R	67.2	Low	75.9	Confident	212 Å²	212	93.3 Å²	93.3	80%	0.8	46%	0.461	S	S	*	.	P	Polyproline II helix	trans	-65.3	124.8	169.5	-170.8	-179.6	-125.8	-154	1.2	108.6	A209 E213	A209-R211 PolarHBondContact O-N 2.99Å; R211-E213 HydrophobicContact CB-CG 4.41Å; R211-E213 HydrophobicContact CG-CG 4.29Å; R211-E213 PolarHBondContact O-N 3.34Å
212	W	64.2	Low	75.3	Confident	99 Å²	99	98 Å²	98	38%	0.375	48%	0.479	S	S	.	.			trans	-69.7	97.5	174	179.1	56.3	0	0	0	110.5	D210 K214 N215	D210-W212 PolarHBondContact O-N 3.38Å; W212-K214 PolarHBondContact NE1-O 3.07Å; W212-N215 WeakPolarHBondContact CH2-OD1 3.34Å; W212-N215 WeakPolarHBondContact CZ2-OD1 3.35Å
213	E	63.7	Low	74.8	Confident	155 Å²	155	99.4 Å²	99.4	72%	0.724	49%	0.486	S	S	*	.			trans	-99	-20.4	-176.5	-68.8	-170.8	166.1	0	0	114.6	R211	R211-E213 HydrophobicContact CB-CG 4.41Å; R211-E213 HydrophobicContact CG-CG 4.29Å; R211-E213 PolarHBondContact O-N 3.34Å
214	K	64.4	Low	74.6	Confident	165 Å²	165	104.9 Å²	104.9	72%	0.717	51%	0.507	S	S	*	.	S	Bend	trans	-131.7	132.2	-173.4	-64.7	-176	-178.1	176.8	0	112	W212 S216	W212-K214 PolarHBondContact NE1-O 3.07Å; K214-S216 PolarHBondContact O-N 3.27Å
215	N	56.1	Low	74.4	Confident	137 Å²	137	108 Å²	108	73%	0.733	52%	0.524	S	S	*	.			trans	-73.2	61.8	178.3	-68.8	-13.6	0	0	0	112.1	W212	W212-N215 WeakPolarHBondContact CH2-OD1 3.34Å; W212-N215 WeakPolarHBondContact CZ2-OD1 3.35Å
216	S	54.5	Low	74.1	Confident	48 Å²	48	110.6 Å²	110.6	34%	0.336	53%	0.533	S	S	.	.			trans	-93	127.7	167.4	47.8	0	0	0	0	109.8	K214 K219	K214-S216 PolarHBondContact O-N 3.27Å; S216-K219 VanDerWaalsContact OG-CD 3.24Å; S216-K219 WeakPolarHBondContact OG-CD 3.21Å; S216-K219 WeakPolarHBondContact OG-CE 3.37Å; S216-K219 VanDerWaalsContact OG-CG 3.32Å; S216-K219 WeakPolarHBondContact OG-CG 3.46Å
217	D	63	Low	74.2	Confident	164 Å²	164	111.2 Å²	111.2	88%	0.877	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	147.5	173.5	-79.1	-19.2	0	0	0	111.8	K219	D217-K219 VanDerWaalsContact C-N 3.3Å; D217-K219 PolarHBondContact O-N 2.9Å
218	G	63.2	Low	74.4	Confident	47 Å²	47	108.5 Å²	108.5	49%	0.485	52%	0.522	S	S	.	.	T	Hydrogen-bonded Turn	trans	88	-33.9	-178.7	0	0	0	0	0	114.9	L220 R221 E222	G218-L220 VanDerWaalsContact C-N 3.29Å; G218-L220 PolarHBondContact O-N 3.1Å; G218-R221 PolarHBondContact O-N 3.18Å; G218-E222 PolarHBondContact O-N 2.82Å
219	K	70.4	Confident	74.6	Confident	112 Å²	112	103.6 Å²	103.6	49%	0.487	51%	0.512	S	S	.	.	H	α-helix	trans	-63.4	-28.5	-176	-71.7	-150.8	178.4	-162.7	0	114.9	S216 D217 R221 E222 L223	S216-K219 VanDerWaalsContact OG-CD 3.24Å; S216-K219 WeakPolarHBondContact OG-CD 3.21Å; S216-K219 WeakPolarHBondContact OG-CE 3.37Å; S216-K219 VanDerWaalsContact OG-CG 3.32Å; S216-K219 WeakPolarHBondContact OG-CG 3.46Å; D217-K219 VanDerWaalsContact C-N 3.3Å; D217-K219 PolarHBondContact O-N 2.9Å; K219-R221 VanDerWaalsContact C-N 3.33Å; K219-E222 PolarHBondContact O-N 3.47Å; K219-L223 WeakPolarHBondContact O-CB 3.25Å; K219-L223 PolarHBondContact O-N 3.22Å
220	L	75.6	Confident	75.3	Confident	108 Å²	108	103.7 Å²	103.7	57%	0.565	51%	0.508	S	S	*	.	H	α-helix	trans	-68.6	-34.4	176.1	-174.4	64.8	0	0	0	111.9	G218 Y224	G218-L220 VanDerWaalsContact C-N 3.29Å; G218-L220 PolarHBondContact O-N 3.1Å; L220-Y224 WeakPolarHBondContact O-CB 3.48Å; L220-Y224 PolarHBondContact O-N 2.75Å
221	R	81.6	Confident	76.2	Confident	168 Å²	168	100.3 Å²	100.3	63%	0.634	49%	0.489	S	S	*	.	H	α-helix	trans	-70.5	-43.2	175	178.1	125.8	-81	-177	-5	110.3	G218 K219 L223 Y224 D225	G218-R221 PolarHBondContact O-N 3.18Å; K219-R221 VanDerWaalsContact C-N 3.33Å; R221-L223 VanDerWaalsContact C-N 3.35Å; R221-L223 PolarHBondContact O-N 3.03Å; R221-Y224 WeakPolarHBondContact O-CB 3.43Å; R221-Y224 PolarHBondContact O-N 3.4Å; R221-D225 WeakPolarHBondContact CG-OD2 3.49Å; R221-D225 WeakPolarHBondContact O-CB 3.41Å; R221-D225 VanDerWaalsContact O-CG 3.3Å; R221-D225 PolarHBondContact O-N 2.81Å
222	E	79.1	Confident	77.3	Confident	125 Å²	125	97.9 Å²	97.9	58%	0.584	48%	0.48	S	S	*	.	H	α-helix	trans	-57.2	-46.8	173.5	-67.4	173	178.4	0	0	111.7	G218 K219 Y224 D225 Q226	G218-E222 PolarHBondContact O-N 2.82Å; K219-E222 PolarHBondContact O-N 3.47Å; E222-Y224 PolarHBondContact O-N 2.72Å; E222-D225 PolarHBondContact O-N 3.49Å; E222-Q226 VanDerWaalsContact O-CB 3.26Å; E222-Q226 WeakPolarHBondContact O-CB 3.3Å; E222-Q226 PolarHBondContact O-N 2.87Å
223	L	83.2	Confident	78.6	Confident	43 Å²	43	94.4 Å²	94.4	23%	0.225	47%	0.472	C	S	.	.	H	α-helix	trans	-61.4	-43.7	175.7	-179.6	64.9	0	0	0	111.7	A209 K219 R221 Q226 L227	A209-L223 HydrophobicContact CB-CD1 4.4Å; K219-L223 WeakPolarHBondContact O-CB 3.25Å; K219-L223 PolarHBondContact O-N 3.22Å; R221-L223 VanDerWaalsContact C-N 3.35Å; R221-L223 PolarHBondContact O-N 3.03Å; L223-Q226 PolarHBondContact O-N 2.95Å; L223-L227 HydrophobicContact CD1-CD1 4Å; L223-L227 HydrophobicContact CD1-CG 4.07Å; L223-L227 HydrophobicContact CG-CD1 3.97Å; L223-L227 HydrophobicContact CG-CG 4.4Å; L223-L227 WeakPolarHBondContact O-CB 3.38Å; L223-L227 VanDerWaalsContact O-CG 3.25Å; L223-L227 WeakPolarHBondContact O-CG 3.26Å; L223-L227 PolarHBondContact O-N 3.43Å
224	Y	86.9	Confident	79.8	Confident	121 Å²	121	87 Å²	87	48%	0.475	44%	0.438	S	S	.	.	H	α-helix	trans	-60.7	-48.5	175.8	171.1	-91.8	0	0	0	111.7	L220 R221 E222 Q226 L227 N228	L220-Y224 WeakPolarHBondContact O-CB 3.48Å; L220-Y224 PolarHBondContact O-N 2.75Å; R221-Y224 WeakPolarHBondContact O-CB 3.43Å; R221-Y224 PolarHBondContact O-N 3.4Å; E222-Y224 PolarHBondContact O-N 2.72Å; Y224-Q226 VanDerWaalsContact C-N 3.32Å; Y224-Q226 PolarHBondContact O-N 3.01Å; Y224-L227 PolarHBondContact O-N 3.47Å; Y224-N228 HydrophobicContact CE1-CB 4.49Å; Y224-N228 WeakPolarHBondContact O-CB 3.29Å; Y224-N228 PolarHBondContact O-N 2.9Å; Y224-N228 PolarHBondContact OH-ND2 3.16Å; Y224-N228 VanDerWaalsContact OH-ND2 3.1Å
225	D	87.2	Confident	81	Confident	91 Å²	91	81 Å²	81	49%	0.487	42%	0.416	S	S	.	.	H	α-helix	trans	-65.7	-37.3	-178.4	-69.3	-26.5	0	0	0	110.9	R221 E222 G229	R221-D225 WeakPolarHBondContact CG-OD2 3.49Å; R221-D225 WeakPolarHBondContact O-CB 3.41Å; R221-D225 VanDerWaalsContact O-CG 3.3Å; R221-D225 PolarHBondContact O-N 2.81Å; E222-D225 PolarHBondContact O-N 3.49Å; D225-G229 WeakPolarHBondContact O-CA 3.27Å; D225-G229 PolarHBondContact O-N 3.49Å
226	Q	86.4	Confident	82.4	Confident	88 Å²	88	80.6 Å²	80.6	41%	0.411	42%	0.418	S	S	.	.	H	α-helix	trans	-64.4	-53.7	174.5	-174.2	-178.3	5.6	0	0	111.8	E222 L223 Y224 N228 G229 H230	E222-Q226 VanDerWaalsContact O-CB 3.26Å; E222-Q226 WeakPolarHBondContact O-CB 3.3Å; E222-Q226 PolarHBondContact O-N 2.87Å; L223-Q226 PolarHBondContact O-N 2.95Å; Y224-Q226 VanDerWaalsContact C-N 3.32Å; Y224-Q226 PolarHBondContact O-N 3.01Å; Q226-N228 PolarHBondContact O-N 3.22Å; Q226-G229 PolarHBondContact O-N 3.13Å; Q226-H230 PolarHBondContact O-CD2 2.73Å; Q226-H230 PolarHBondContact O-N 2.85Å
227	L	89.6	Confident	83.9	Confident	59 Å²	59	80.7 Å²	80.7	31%	0.309	42%	0.415	S	S	.	.	H	α-helix	trans	-61.9	-45.4	-179.9	-69.1	175.9	0	0	0	111.3	L206 A209 L223 Y224 G229 H230 I231	L206-L227 HydrophobicContact CD2-CD2 3.81Å; A209-L227 HydrophobicContact CB-CD2 3.79Å; L223-L227 HydrophobicContact CD1-CD1 4Å; L223-L227 HydrophobicContact CD1-CG 4.07Å; L223-L227 HydrophobicContact CG-CD1 3.97Å; L223-L227 HydrophobicContact CG-CG 4.4Å; L223-L227 WeakPolarHBondContact O-CB 3.38Å; L223-L227 VanDerWaalsContact O-CG 3.25Å; L223-L227 WeakPolarHBondContact O-CG 3.26Å; L223-L227 PolarHBondContact O-N 3.43Å; Y224-L227 PolarHBondContact O-N 3.47Å; L227-G229 VanDerWaalsContact C-N 3.32Å; L227-G229 PolarHBondContact O-N 3.33Å; L227-H230 PolarHBondContact O-N 3.4Å; L227-I231 WeakPolarHBondContact O-CG1 3.36Å; L227-I231 PolarHBondContact O-N 2.8Å; L227-I231 VanDerWaalsContact O-N 3.13Å
228	N	90	Very high	84.9	Confident	33 Å²	33	74.8 Å²	74.8	18%	0.176	39%	0.393	C	S	.	.	H	α-helix	trans	-70.4	-30.8	-179	-156.2	21.6	0	0	0	112	Y224 Q226 I231 R232	Y224-N228 HydrophobicContact CE1-CB 4.49Å; Y224-N228 WeakPolarHBondContact O-CB 3.29Å; Y224-N228 PolarHBondContact O-N 2.9Å; Y224-N228 PolarHBondContact OH-ND2 3.16Å; Y224-N228 VanDerWaalsContact OH-ND2 3.1Å; Q226-N228 PolarHBondContact O-N 3.22Å; N228-I231 PolarHBondContact O-N 3.28Å; N228-R232 PolarHBondContact ND2-NH2 3.39Å; N228-R232 VanDerWaalsContact O-CG 3.32Å; N228-R232 WeakPolarHBondContact O-CG 3.5Å; N228-R232 PolarHBondContact O-N 3Å
229	G	90.2	Very high	86	Confident	40 Å²	40	75.2 Å²	75.2	41%	0.412	38%	0.381	S	S	.	.	H	α-helix	trans	-59.3	-47.7	172.6	0	0	0	0	0	112.2	D225 Q226 L227 R232 A233	D225-G229 WeakPolarHBondContact O-CA 3.27Å; D225-G229 PolarHBondContact O-N 3.49Å; Q226-G229 PolarHBondContact O-N 3.13Å; L227-G229 VanDerWaalsContact C-N 3.32Å; L227-G229 PolarHBondContact O-N 3.33Å; G229-R232 PolarHBondContact O-N 3.43Å; G229-A233 PolarHBondContact O-N 2.95Å; G229-A233 VanDerWaalsContact O-N 3.14Å
230	H	93.2	Very high	86.7	Confident	29 Å²	29	71 Å²	71	13%	0.134	36%	0.364	C	S	.	.	H	α-helix	trans	-68.5	-37.2	176.9	-63.7	-66.7	0	0	0	112.7	H202 S205 L206 Q226 L227 A233 L234	H202-H230 AromaticContact CE1-ND1 3.66Å; H202-H230 AromaticContact ND1-CG 3.71Å; H202-H230 AromaticContact ND1-ND1 3.04Å; H202-H230 PolarHBondContact ND1-ND1 2.89Å; S205-H230 WeakPolarHBondContact CB-CE1 3.48Å; S205-H230 WeakPolarHBondContact CB-NE2 3.48Å; L206-H230 HydrophobicContact CD1-CB 4.4Å; L206-H230 HydrophobicContact CD2-CB 3.84Å; L206-H230 HydrophobicContact CG-CB 3.92Å; Q226-H230 PolarHBondContact O-CD2 2.73Å; Q226-H230 PolarHBondContact O-N 2.85Å; L227-H230 PolarHBondContact O-N 3.4Å; H230-A233 PolarHBondContact O-N 3.5Å; H230-L234 WeakPolarHBondContact O-CG 3.48Å; H230-L234 PolarHBondContact O-N 3.31Å
231	I	90.8	Very high	86.9	Confident	62 Å²	62	69.7 Å²	69.7	32%	0.318	36%	0.357	S	S	.	.	H	α-helix	trans	-61.2	-45.8	175.7	-69.2	173.3	0	0	0	111	L227 N228 A233 L234 S235 I241	L227-I231 WeakPolarHBondContact O-CG1 3.36Å; L227-I231 PolarHBondContact O-N 2.8Å; L227-I231 VanDerWaalsContact O-N 3.13Å; N228-I231 PolarHBondContact O-N 3.28Å; I231-A233 PolarHBondContact O-N 3.47Å; I231-L234 PolarHBondContact O-N 3.36Å; I231-S235 PolarHBondContact O-N 3.42Å; I231-S235 PolarHBondContact O-OG 2.87Å; I231-I241 HydrophobicContact CG1-CD1 4.13Å; I231-I241 HydrophobicContact CG2-CD1 4.38Å
232	R	91.1	Very high	86.7	Confident	161 Å²	161	66.5 Å²	66.5	61%	0.608	36%	0.36	S	S	*	.	H	α-helix	trans	-63.4	-41.1	178.6	-72.2	174.4	-174.5	-174.6	1.5	112.4	N228 G229 S235 V236	N228-R232 PolarHBondContact ND2-NH2 3.39Å; N228-R232 VanDerWaalsContact O-CG 3.32Å; N228-R232 WeakPolarHBondContact O-CG 3.5Å; N228-R232 PolarHBondContact O-N 3Å; G229-R232 PolarHBondContact O-N 3.43Å; R232-S235 PolarHBondContact O-N 3.34Å; R232-V236 WeakPolarHBondContact O-CG2 3.48Å; R232-V236 PolarHBondContact O-N 3.47Å; R232-V236 VanDerWaalsContact O-N 3.08Å
233	A	90	Very high	86.9	Confident	27 Å²	27	67.1 Å²	67.1	22%	0.223	36%	0.361	C	S	.	.	H	α-helix	trans	-63.4	-42.3	177.5	0	0	0	0	0	111.7	H202 G229 H230 I231 S235 V236 I237	H202-A233 WeakPolarHBondContact CE1-CB 3.11Å; H202-A233 WeakPolarHBondContact NE2-CB 3.05Å; G229-A233 PolarHBondContact O-N 2.95Å; G229-A233 VanDerWaalsContact O-N 3.14Å; H230-A233 PolarHBondContact O-N 3.5Å; I231-A233 PolarHBondContact O-N 3.47Å; A233-S235 PolarHBondContact O-N 3.46Å; A233-V236 PolarHBondContact O-N 3.42Å; A233-V236 VanDerWaalsContact O-N 3.17Å; A233-I237 WeakPolarHBondContact O-CD1 3.29Å; A233-I237 VanDerWaalsContact O-CG1 3.31Å; A233-I237 WeakPolarHBondContact O-CG1 3.47Å; A233-I237 PolarHBondContact O-N 3.47Å; A233-I237 VanDerWaalsContact O-N 3.07Å
234	L	90.3	Very high	86.7	Confident	0 Å²	0	76 Å²	76	0%	0	39%	0.391	C	S	.	.	H	α-helix	trans	-59.7	-42.8	173.4	-75.1	168	0	0	0	112.1	V199 H202 L206 H230 I231 V236 I237 G238 K239 L246	V199-L234 HydrophobicContact CG1-CD2 4.21Å; V199-L234 HydrophobicContact CG2-CD2 4.47Å; H202-L234 HydrophobicContact CB-CD1 4.23Å; H202-L234 HydrophobicContact CB-CD2 3.79Å; H202-L234 HydrophobicContact CB-CG 3.87Å; L206-L234 HydrophobicContact CD1-CD1 3.85Å; H230-L234 WeakPolarHBondContact O-CG 3.48Å; H230-L234 PolarHBondContact O-N 3.31Å; I231-L234 PolarHBondContact O-N 3.36Å; L234-V236 VanDerWaalsContact C-N 3.31Å; L234-V236 PolarHBondContact O-N 3.44Å; L234-I237 PolarHBondContact O-N 2.98Å; L234-G238 PolarHBondContact O-N 3.37Å; L234-K239 HydrophobicContact CB-CB 4.44Å; L234-K239 HydrophobicContact CD2-CB 4.31Å; L234-K239 CarbonylContact O-C 3.59Å; L234-K239 WeakPolarHBondContact O-CA 3.43Å; L234-K239 PolarHBondContact O-N 2.78Å; L234-L246 HydrophobicContact CD1-CD2 4.42Å
235	S	88.2	Confident	86.7	Confident	38 Å²	38	73.8 Å²	73.8	27%	0.266	39%	0.386	S	S	.	.	H	α-helix	trans	-60.8	-37.5	175	-59.9	0	0	0	0	112.7	I231 R232 A233 G238 D240	I231-S235 PolarHBondContact O-N 3.42Å; I231-S235 PolarHBondContact O-OG 2.87Å; R232-S235 PolarHBondContact O-N 3.34Å; A233-S235 PolarHBondContact O-N 3.46Å; S235-G238 PolarHBondContact O-N 2.63Å; S235-D240 PolarHBondContact OG-OD1 3.49Å
236	V	85.7	Confident	86.7	Confident	128 Å²	128	70.6 Å²	70.6	78%	0.776	37%	0.368	S	S	*	.	H	α-helix	trans	-69.5	-34	177.6	173.2	0	0	0	0	111.9	R232 A233 L234 G238	R232-V236 WeakPolarHBondContact O-CG2 3.48Å; R232-V236 PolarHBondContact O-N 3.47Å; R232-V236 VanDerWaalsContact O-N 3.08Å; A233-V236 PolarHBondContact O-N 3.42Å; A233-V236 VanDerWaalsContact O-N 3.17Å; L234-V236 VanDerWaalsContact C-N 3.31Å; L234-V236 PolarHBondContact O-N 3.44Å; V236-G238 PolarHBondContact O-N 3.02Å
237	I	85.6	Confident	86.6	Confident	51 Å²	51	68.4 Å²	68.4	26%	0.262	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-7.6	177.4	-62.8	158.8	0	0	0	112.1	V198 V199 A233 L234	V198-I237 HydrophobicContact CB-CD1 4.46Å; V198-I237 HydrophobicContact CG1-CD1 3.48Å; V198-I237 VanDerWaalsContact CG1-CD1 3.48Å; V199-I237 HydrophobicContact CG2-CG2 3.86Å; A233-I237 WeakPolarHBondContact O-CD1 3.29Å; A233-I237 VanDerWaalsContact O-CG1 3.31Å; A233-I237 WeakPolarHBondContact O-CG1 3.47Å; A233-I237 PolarHBondContact O-N 3.47Å; A233-I237 VanDerWaalsContact O-N 3.07Å; L234-I237 PolarHBondContact O-N 2.98Å
238	G	85	Confident	86.3	Confident	40 Å²	40	68.9 Å²	68.9	41%	0.412	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.4	24.9	-176	0	0	0	0	0	113.5	L234 S235 V236	L234-G238 PolarHBondContact O-N 3.37Å; S235-G238 PolarHBondContact O-N 2.63Å; V236-G238 PolarHBondContact O-N 3.02Å
239	K	86.5	Confident	86	Confident	56 Å²	56	69.9 Å²	69.9	24%	0.243	38%	0.379	C	S	.	.			trans	-119	50	174.6	-65.5	-65.6	-174.6	169.2	0	110	V199 L234 I241 E245 L246 D250	V199-K239 HydrophobicContact CG2-CG 4.02Å; L234-K239 HydrophobicContact CB-CB 4.44Å; L234-K239 HydrophobicContact CD2-CB 4.31Å; L234-K239 CarbonylContact O-C 3.59Å; L234-K239 WeakPolarHBondContact O-CA 3.43Å; L234-K239 PolarHBondContact O-N 2.78Å; K239-I241 PolarHBondContact O-N 3.42Å; K239-E245 WeakPolarHBondContact CD-O 3.24Å; K239-L246 HydrophobicContact CB-CB 4.21Å; K239-L246 HydrophobicContact CB-CD1 4.1Å; K239-L246 HydrophobicContact CD-CD1 4.31Å; K239-L246 HydrophobicContact CG-CD1 4.4Å; K239-D250 IonicContact NZ-OD1 3.09Å; K239-D250 PolarHBondContact NZ-OD1 3.42Å; K239-D250 IonicContact NZ-OD2 3.66Å; K239-D250 PolarHBondContact NZ-OD2 2.87Å
240	D	85.1	Confident	85.7	Confident	23 Å²	23	69.3 Å²	69.3	12%	0.123	37%	0.366	C	S	.	.			trans	-69.2	115.4	179.6	-169.1	-16.2	0	0	0	111.5	S235 S242 K243 R244 E245	S235-D240 PolarHBondContact OG-OD1 3.49Å; D240-S242 VanDerWaalsContact CG-OG 3.22Å; D240-S242 PolarHBondContact O-N 3.47Å; D240-S242 WeakPolarHBondContact OD1-CB 3.4Å; D240-S242 PolarHBondContact OD1-N 3.45Å; D240-S242 PolarHBondContact OD1-OG 3Å; D240-S242 PolarHBondContact OD2-OG 3.45Å; D240-K243 HydrophobicContact CB-CB 4.13Å; D240-K243 HydrophobicContact CB-CD 4.11Å; D240-K243 HydrophobicContact CB-CG 4.17Å; D240-K243 PolarHBondContact O-N 3.48Å; D240-R244 PolarHBondContact O-N 2.87Å; D240-E245 WeakPolarHBondContact CB-OE2 3.47Å; D240-E245 PolarHBondContact N-OE2 3.21Å; D240-E245 PolarHBondContact O-N 3.33Å
241	I	79.8	Confident	85.5	Confident	81 Å²	81	70.9 Å²	70.9	42%	0.415	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-36.7	178.1	-59.4	172.2	0	0	0	110.9	I231 K239 K243 R244 L246	I231-I241 HydrophobicContact CG1-CD1 4.13Å; I231-I241 HydrophobicContact CG2-CD1 4.38Å; K239-I241 PolarHBondContact O-N 3.42Å; I241-K243 VanDerWaalsContact C-N 3.29Å; I241-K243 PolarHBondContact O-N 3.31Å; I241-R244 PolarHBondContact O-N 2.85Å; I241-L246 HydrophobicContact CD1-CD2 4.34Å; I241-L246 HydrophobicContact CG1-CB 4.32Å; I241-L246 HydrophobicContact CG1-CD2 3.94Å
242	S	77	Confident	85.4	Confident	101 Å²	101	71 Å²	71	71%	0.706	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-27.9	-177.5	70.8	0	0	0	0	112.7	D240	D240-S242 VanDerWaalsContact CG-OG 3.22Å; D240-S242 PolarHBondContact O-N 3.47Å; D240-S242 WeakPolarHBondContact OD1-CB 3.4Å; D240-S242 PolarHBondContact OD1-N 3.45Å; D240-S242 PolarHBondContact OD1-OG 3Å; D240-S242 PolarHBondContact OD2-OG 3.45Å
243	K	83.2	Confident	85.2	Confident	138 Å²	138	64.1 Å²	64.1	60%	0.6	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.3	2.2	175.5	-60.9	179.5	-174.6	174.1	0	113.5	D240 I241 E245	D240-K243 HydrophobicContact CB-CB 4.13Å; D240-K243 HydrophobicContact CB-CD 4.11Å; D240-K243 HydrophobicContact CB-CG 4.17Å; D240-K243 PolarHBondContact O-N 3.48Å; I241-K243 VanDerWaalsContact C-N 3.29Å; I241-K243 PolarHBondContact O-N 3.31Å; K243-E245 VanDerWaalsContact C-N 3.28Å; K243-E245 HydrophobicContact CB-CG 3.93Å; K243-E245 VanDerWaalsContact CD-OE1 3.27Å; K243-E245 WeakPolarHBondContact CD-OE1 3.45Å; K243-E245 PolarHBondContact O-N 3.32Å
244	R	79.5	Confident	85.2	Confident	229 Å²	229	63.2 Å²	63.2	86%	0.864	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.7	30.3	-176.5	-51.3	179.8	177.8	-173.7	-1.4	113.9	D240 I241	D240-R244 PolarHBondContact O-N 2.87Å; I241-R244 PolarHBondContact O-N 2.85Å
245	E	85.6	Confident	85.1	Confident	75 Å²	75	66.3 Å²	66.3	35%	0.35	36%	0.359	S	S	.	.			trans	-83.8	-25.9	178.8	-65.7	167.1	176.5	0	0	112.6	K239 D240 K243 S247	K239-E245 WeakPolarHBondContact CD-O 3.24Å; D240-E245 WeakPolarHBondContact CB-OE2 3.47Å; D240-E245 PolarHBondContact N-OE2 3.21Å; D240-E245 PolarHBondContact O-N 3.33Å; K243-E245 VanDerWaalsContact C-N 3.28Å; K243-E245 HydrophobicContact CB-CG 3.93Å; K243-E245 VanDerWaalsContact CD-OE1 3.27Å; K243-E245 WeakPolarHBondContact CD-OE1 3.45Å; K243-E245 PolarHBondContact O-N 3.32Å; E245-S247 PolarHBondContact O-N 2.98Å
246	L	87.2	Confident	85.3	Confident	23 Å²	23	67.2 Å²	67.2	12%	0.12	36%	0.358	C	S	.	.	S	Bend	trans	-80.9	106	167.4	-175	69.3	0	0	0	108.9	V199 L234 K239 I241 D250 I251	V199-L246 HydrophobicContact CG1-CD1 4.34Å; L234-L246 HydrophobicContact CD1-CD2 4.42Å; K239-L246 HydrophobicContact CB-CB 4.21Å; K239-L246 HydrophobicContact CB-CD1 4.1Å; K239-L246 HydrophobicContact CD-CD1 4.31Å; K239-L246 HydrophobicContact CG-CD1 4.4Å; I241-L246 HydrophobicContact CD1-CD2 4.34Å; I241-L246 HydrophobicContact CG1-CB 4.32Å; I241-L246 HydrophobicContact CG1-CD2 3.94Å; L246-D250 HydrophobicContact CD1-CB 3.78Å; L246-I251 HydrophobicContact CD2-CD1 4.01Å; L246-I251 HydrophobicContact CD2-CG1 4.07Å; L246-I251 HydrophobicContact CG-CD1 4.33Å; L246-I251 HydrophobicContact CG-CG1 4.18Å
247	S	84.5	Confident	85.4	Confident	42 Å²	42	62 Å²	62	29%	0.294	33%	0.325	S	S	.	.			trans	-77.1	158	-175.2	76	0	0	0	0	111.4	E245 E249 D250 I251	E245-S247 PolarHBondContact O-N 2.98Å; S247-E249 PolarHBondContact O-N 3.39Å; S247-E249 WeakPolarHBondContact OG-CB 3.47Å; S247-E249 PolarHBondContact OG-N 2.93Å; S247-D250 PolarHBondContact N-OD2 2.77Å; S247-D250 WeakPolarHBondContact O-CB 3.28Å; S247-D250 PolarHBondContact O-N 3.21Å; S247-D250 VanDerWaalsContact OG-CG 3.26Å; S247-D250 PolarHBondContact OG-N 3.41Å; S247-D250 PolarHBondContact OG-OD2 3.39Å; S247-I251 PolarHBondContact O-N 2.72Å
248	A	84.2	Confident	85.5	Confident	70 Å²	70	63.8 Å²	63.8	58%	0.579	33%	0.332	S	S	*	.	H	α-helix	trans	-60.9	-32.5	170.6	0	0	0	0	0	111.3	I251 L252	A248-I251 PolarHBondContact O-N 2.9Å; A248-L252 WeakPolarHBondContact O-CB 3.3Å; A248-L252 WeakPolarHBondContact O-CG 2.98Å; A248-L252 PolarHBondContact O-N 3.13Å
249	E	83.1	Confident	85.8	Confident	53 Å²	53	72.1 Å²	72.1	25%	0.248	35%	0.352	C	S	.	.	H	α-helix	trans	-60.5	-44.7	174	161	168.2	-157.1	0	0	112.4	S247 I251 L252 L253 R282 L283	S247-E249 PolarHBondContact O-N 3.39Å; S247-E249 WeakPolarHBondContact OG-CB 3.47Å; S247-E249 PolarHBondContact OG-N 2.93Å; E249-I251 VanDerWaalsContact C-N 3.3Å; E249-I251 PolarHBondContact O-N 3.01Å; E249-L252 PolarHBondContact O-N 2.9Å; E249-L253 HydrophobicContact CG-CD1 3.87Å; E249-L253 WeakPolarHBondContact O-CB 3.47Å; E249-L253 WeakPolarHBondContact O-CG 3.38Å; E249-L253 PolarHBondContact O-N 2.8Å; E249-R282 WeakPolarHBondContact OE1-CA 3.16Å; E249-R282 PolarHBondContact OE1-N 3.39Å; E249-L283 HydrophobicContact CG-CB 3.89Å; E249-L283 WeakPolarHBondContact OE1-CB 3.41Å; E249-L283 PolarHBondContact OE1-N 3.3Å
250	D	85.4	Confident	85.9	Confident	28 Å²	28	70.9 Å²	70.9	15%	0.15	35%	0.347	C	S	.	.	H	α-helix	trans	-56.2	-45.5	176.1	-67.7	-42.4	0	0	0	111	K239 L246 S247 V254	K239-D250 IonicContact NZ-OD1 3.09Å; K239-D250 PolarHBondContact NZ-OD1 3.42Å; K239-D250 IonicContact NZ-OD2 3.66Å; K239-D250 PolarHBondContact NZ-OD2 2.87Å; L246-D250 HydrophobicContact CD1-CB 3.78Å; S247-D250 PolarHBondContact N-OD2 2.77Å; S247-D250 WeakPolarHBondContact O-CB 3.28Å; S247-D250 PolarHBondContact O-N 3.21Å; S247-D250 VanDerWaalsContact OG-CG 3.26Å; S247-D250 PolarHBondContact OG-N 3.41Å; S247-D250 PolarHBondContact OG-OD2 3.39Å; D250-V254 WeakPolarHBondContact O-CG2 3.4Å; D250-V254 PolarHBondContact O-N 3.04Å
251	I	87.8	Confident	86.1	Confident	62 Å²	62	74 Å²	74	32%	0.318	37%	0.369	S	S	.	.	H	α-helix	trans	-70.6	-44.3	-178.9	-58.8	172.8	0	0	0	111.2	L246 S247 A248 E249 V254 L255	L246-I251 HydrophobicContact CD2-CD1 4.01Å; L246-I251 HydrophobicContact CD2-CG1 4.07Å; L246-I251 HydrophobicContact CG-CD1 4.33Å; L246-I251 HydrophobicContact CG-CG1 4.18Å; S247-I251 PolarHBondContact O-N 2.72Å; A248-I251 PolarHBondContact O-N 2.9Å; E249-I251 VanDerWaalsContact C-N 3.3Å; E249-I251 PolarHBondContact O-N 3.01Å; I251-V254 PolarHBondContact O-N 2.9Å; I251-L255 HydrophobicContact CG2-CD1 4.1Å; I251-L255 WeakPolarHBondContact O-CG 3.43Å; I251-L255 PolarHBondContact O-N 2.93Å; I251-L255 VanDerWaalsContact O-N 3.07Å
252	L	88.4	Confident	86.5	Confident	65 Å²	65	77.7 Å²	77.7	34%	0.34	38%	0.379	S	S	.	.	H	α-helix	trans	-65.4	-40.2	-178.8	-74.1	173	0	0	0	111.8	A248 E249 V254 L255 F256 L283	A248-L252 WeakPolarHBondContact O-CB 3.3Å; A248-L252 WeakPolarHBondContact O-CG 2.98Å; A248-L252 PolarHBondContact O-N 3.13Å; E249-L252 PolarHBondContact O-N 2.9Å; L252-V254 VanDerWaalsContact C-N 3.34Å; L252-V254 PolarHBondContact O-N 3.28Å; L252-L255 PolarHBondContact O-N 2.83Å; L252-F256 HydrophobicContact CB-CD2 4.48Å; L252-F256 HydrophobicContact CB-CE2 4.1Å; L252-F256 HydrophobicContact CB-CZ 4.22Å; L252-F256 HydrophobicContact CD2-CE1 4.16Å; L252-F256 HydrophobicContact CD2-CZ 3.95Å; L252-F256 WeakPolarHBondContact O-CB 3.42Å; L252-F256 WeakPolarHBondContact O-CG 3.35Å; L252-F256 PolarHBondContact O-N 3.03Å; L252-L283 HydrophobicContact CB-CD1 4.42Å
253	L	87.4	Confident	86.9	Confident	16 Å²	16	78.6 Å²	78.6	8%	0.084	37%	0.372	C	S	.	.	H	α-helix	trans	-58.9	-45.5	175.6	-80.1	167.1	0	0	0	111.5	E249 L255 F256 K257 W268 R282 L283 F286	E249-L253 HydrophobicContact CG-CD1 3.87Å; E249-L253 WeakPolarHBondContact O-CB 3.47Å; E249-L253 WeakPolarHBondContact O-CG 3.38Å; E249-L253 PolarHBondContact O-N 2.8Å; L253-L255 VanDerWaalsContact C-N 3.34Å; L253-L255 PolarHBondContact O-N 2.68Å; L253-F256 PolarHBondContact O-N 2.64Å; L253-K257 WeakPolarHBondContact O-CB 3.47Å; L253-K257 WeakPolarHBondContact O-CG 3.49Å; L253-K257 PolarHBondContact O-N 2.93Å; L253-W268 HydrophobicContact CD2-CZ2 4.28Å; L253-R282 HydrophobicContact CD1-CB 3.52Å; L253-L283 HydrophobicContact CD2-CD1 4.03Å; L253-L283 HydrophobicContact CG-CD1 4.04Å; L253-F286 HydrophobicContact CD2-CB 3.74Å; L253-F286 HydrophobicContact CD2-CD2 4.19Å; L253-F286 HydrophobicContact CD2-CG 3.96Å
254	V	89.7	Confident	87.3	Confident	8 Å²	8	73.1 Å²	73.1	5%	0.048	35%	0.35	C	S	.	.	H	α-helix	trans	-60.3	-45.4	175.8	175.5	0	0	0	0	110.7	E200 V203 L204 L207 D250 I251 L252 Q258	E200-V254 HydrophobicContact CB-CG2 4.08Å; E200-V254 HydrophobicContact CG-CG1 4.14Å; E200-V254 HydrophobicContact CG-CG2 3.95Å; V203-V254 HydrophobicContact CB-CG1 4.32Å; V203-V254 HydrophobicContact CB-CG2 4.3Å; V203-V254 HydrophobicContact CG1-CB 4.01Å; V203-V254 HydrophobicContact CG1-CG1 3.86Å; V203-V254 HydrophobicContact CG1-CG2 4.18Å; L204-V254 HydrophobicContact CD2-CG1 3.58Å; L204-V254 HydrophobicContact CG-CG1 3.69Å; L207-V254 HydrophobicContact CD1-CG1 4.46Å; D250-V254 WeakPolarHBondContact O-CG2 3.4Å; D250-V254 PolarHBondContact O-N 3.04Å; I251-V254 PolarHBondContact O-N 2.9Å; L252-V254 VanDerWaalsContact C-N 3.34Å; L252-V254 PolarHBondContact O-N 3.28Å; V254-Q258 WeakPolarHBondContact O-CG 3.47Å; V254-Q258 PolarHBondContact O-N 3.01Å
255	L	89	Confident	87.8	Confident	65 Å²	65	64.9 Å²	64.9	34%	0.34	32%	0.318	S	S	.	.	H	α-helix	trans	-63.6	-43.6	178.1	-73.9	170.5	0	0	0	112.9	L207 I251 L252 L253 Q258	L207-L255 HydrophobicContact CD1-CD2 3.56Å; L207-L255 HydrophobicContact CD1-CG 4.11Å; L207-L255 HydrophobicContact CD2-CD2 4.18Å; I251-L255 HydrophobicContact CG2-CD1 4.1Å; I251-L255 WeakPolarHBondContact O-CG 3.43Å; I251-L255 PolarHBondContact O-N 2.93Å; I251-L255 VanDerWaalsContact O-N 3.07Å; L252-L255 PolarHBondContact O-N 2.83Å; L253-L255 VanDerWaalsContact C-N 3.34Å; L253-L255 PolarHBondContact O-N 2.68Å; L255-Q258 PolarHBondContact O-N 3.32Å
256	F	91	Very high	87.8	Confident	57 Å²	57	65.8 Å²	65.8	25%	0.25	32%	0.321	C	S	.	.	H	α-helix	trans	-69.9	-40.6	-178.5	-64.3	-16.8	0	0	0	111.6	L252 L253 Q258 R259 L260 L283 F286 F287	L252-F256 HydrophobicContact CB-CD2 4.48Å; L252-F256 HydrophobicContact CB-CE2 4.1Å; L252-F256 HydrophobicContact CB-CZ 4.22Å; L252-F256 HydrophobicContact CD2-CE1 4.16Å; L252-F256 HydrophobicContact CD2-CZ 3.95Å; L252-F256 WeakPolarHBondContact O-CB 3.42Å; L252-F256 WeakPolarHBondContact O-CG 3.35Å; L252-F256 PolarHBondContact O-N 3.03Å; L253-F256 PolarHBondContact O-N 2.64Å; F256-Q258 PolarHBondContact O-N 3.27Å; F256-R259 WeakPolarHBondContact O-CB 3.48Å; F256-R259 PolarHBondContact O-N 2.82Å; F256-L260 PolarHBondContact O-N 3.46Å; F256-L283 HydrophobicContact CD2-CD1 4.02Å; F256-L283 HydrophobicContact CE2-CD1 3.89Å; F256-F286 HydrophobicContact CB-CD1 4.41Å; F256-F286 HydrophobicContact CB-CE1 3.53Å; F256-F286 HydrophobicContact CB-CE2 4.48Å; F256-F286 HydrophobicContact CB-CZ 3.57Å; F256-F286 HydrophobicContact CD2-CD1 4.11Å; F256-F286 AromaticContact CD2-CE1 3.85Å; F256-F286 HydrophobicContact CD2-CE1 3.85Å; F256-F286 HydrophobicContact CG-CE1 4.08Å; F256-F287 HydrophobicContact CD2-CZ 4.48Å; F256-F287 HydrophobicContact CE2-CE2 4.23Å; F256-F287 AromaticContact CE2-CZ 3.83Å; F256-F287 HydrophobicContact CE2-CZ 3.83Å; F256-F287 HydrophobicContact CZ-CZ 4.5Å
257	K	88.5	Confident	87.9	Confident	18 Å²	18	68.9 Å²	68.9	8%	0.078	33%	0.332	C	S	.	.	H	α-helix	trans	-56.7	-35.3	173.4	-74.1	173.7	67.3	168.5	0	112.7	E200 L253 R259 L260 E269 F286	E200-K257 IonicContact OE1-NZ 3.03Å; E200-K257 IonicContact OE2-NZ 3.77Å; E200-K257 PolarHBondContact OE2-NZ 2.79Å; L253-K257 WeakPolarHBondContact O-CB 3.47Å; L253-K257 WeakPolarHBondContact O-CG 3.49Å; L253-K257 PolarHBondContact O-N 2.93Å; K257-R259 PolarHBondContact O-N 3.1Å; K257-L260 PolarHBondContact O-N 2.99Å; K257-E269 WeakPolarHBondContact CE-OE1 3.25Å; K257-E269 VanDerWaalsContact NZ-CD 3.3Å; K257-E269 IonicContact NZ-OE1 2.67Å; K257-E269 PolarHBondContact NZ-OE1 3.43Å; K257-E269 IonicContact NZ-OE2 3.2Å; K257-E269 PolarHBondContact NZ-OE2 2.85Å; K257-F286 HydrophobicContact CG-CE2 4.41Å
258	Q	88.2	Confident	88.1	Confident	89 Å²	89	67.1 Å²	67.1	42%	0.416	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-14.6	176.8	-64.2	-66	-41.1	0	0	113.5	L204 V254 L255 F256	L204-Q258 HydrophobicContact CD2-CG 3.68Å; V254-Q258 WeakPolarHBondContact O-CG 3.47Å; V254-Q258 PolarHBondContact O-N 3.01Å; L255-Q258 PolarHBondContact O-N 3.32Å; F256-Q258 PolarHBondContact O-N 3.27Å
259	R	90.1	Very high	88.2	Confident	216 Å²	216	66 Å²	66	82%	0.815	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.3	-10.8	176.9	-65.7	-171.5	176.5	-154.3	-0.2	113.9	F256 K257	F256-R259 WeakPolarHBondContact O-CB 3.48Å; F256-R259 PolarHBondContact O-N 2.82Å; K257-R259 PolarHBondContact O-N 3.1Å
260	L	90.3	Very high	88.2	Confident	29 Å²	29	68.3 Å²	68.3	15%	0.152	31%	0.312	C	S	.	.	S	Bend	trans	-80.5	139.7	179.9	-62.5	-176.2	0	0	0	111.6	F256 K257 V264 R265 F286 L290	F256-L260 PolarHBondContact O-N 3.46Å; K257-L260 PolarHBondContact O-N 2.99Å; L260-V264 HydrophobicContact CB-CB 4.41Å; L260-V264 HydrophobicContact CD1-CG1 4.19Å; L260-V264 HydrophobicContact CD2-CG1 4.22Å; L260-R265 HydrophobicContact CB-CB 4.05Å; L260-F286 HydrophobicContact CD1-CE2 3.64Å; L260-F286 HydrophobicContact CD1-CZ 3.79Å; L260-F286 HydrophobicContact CD2-CZ 4.27Å; L260-F286 HydrophobicContact CG-CE2 4.49Å; L260-F286 HydrophobicContact CG-CZ 4.18Å; L260-L290 HydrophobicContact CD2-CD2 3.72Å
261	P	87.4	Confident	88.1	Confident	88 Å²	88	68.9 Å²	68.9	57%	0.571	31%	0.313	S	S	*	.			trans	-55.9	148	166	-20.7	31	0	0	0	110.8	Q263 V264 R265	P261-Q263 PolarHBondContact O-N 3.26Å; P261-Q263 VanDerWaalsContact O-N 3.08Å; P261-V264 HydrophobicContact CB-CG2 4.28Å; P261-V264 HydrophobicContact CG-CG2 4.21Å; P261-V264 PolarHBondContact O-N 3.4Å; P261-R265 PolarHBondContact O-N 3.09Å
262	Y	88.5	Confident	87.8	Confident	160 Å²	160	66.8 Å²	66.8	63%	0.627	30%	0.302	S	S	*	.	H	α-helix	trans	-49.1	-42.8	-176.1	172.8	-97.4	0	0	0	113.5	R265 K266	Y262-R265 PolarHBondContact O-N 2.72Å; Y262-K266 HydrophobicContact CE1-CD 4.26Å; Y262-K266 VanDerWaalsContact O-CB 3.26Å; Y262-K266 WeakPolarHBondContact O-CB 3.27Å; Y262-K266 PolarHBondContact O-N 3.25Å
263	Q	86.5	Confident	87	Confident	119 Å²	119	67.7 Å²	67.7	56%	0.556	31%	0.307	S	S	*	.	H	α-helix	trans	-67.5	-36.6	-178.9	-59.3	-59.9	-15.2	0	0	113.1	P261 R267	P261-Q263 PolarHBondContact O-N 3.26Å; P261-Q263 VanDerWaalsContact O-N 3.08Å; Q263-R267 PolarHBondContact O-N 3.16Å; Q263-R267 PolarHBondContact O-NE 2.88Å
264	V	90.5	Very high	86.2	Confident	23 Å²	23	71.8 Å²	71.8	14%	0.139	33%	0.333	C	S	.	.	H	α-helix	trans	-73.4	-44.2	176.8	-175	0	0	0	0	109.6	L260 P261 K266 R267 W268 F289 L290 E293	L260-V264 HydrophobicContact CB-CB 4.41Å; L260-V264 HydrophobicContact CD1-CG1 4.19Å; L260-V264 HydrophobicContact CD2-CG1 4.22Å; P261-V264 HydrophobicContact CB-CG2 4.28Å; P261-V264 HydrophobicContact CG-CG2 4.21Å; P261-V264 PolarHBondContact O-N 3.4Å; V264-K266 VanDerWaalsContact C-N 3.32Å; V264-K266 PolarHBondContact O-N 3.22Å; V264-R267 PolarHBondContact O-N 3.49Å; V264-W268 PolarHBondContact O-N 3.27Å; V264-F289 HydrophobicContact CG1-CE1 3.89Å; V264-F289 HydrophobicContact CG1-CZ 4.17Å; V264-F289 WeakPolarHBondContact O-CZ 3.49Å; V264-L290 HydrophobicContact CG1-CD2 4.48Å; V264-E293 HydrophobicContact CG1-CG 4.29Å
265	R	90.3	Very high	85.1	Confident	56 Å²	56	76.7 Å²	76.7	21%	0.211	36%	0.359	C	S	.	.	H	α-helix	trans	-58.2	-44.4	173.7	-174	179.2	175.4	150.7	2.2	111.4	E200 L260 P261 Y262 R267 W268 E269	E200-R265 IonicContact OE1-CZ 2.82Å; E200-R265 IonicContact OE1-NH2 3.01Å; E200-R265 PolarHBondContact OE1-NH2 3.34Å; L260-R265 HydrophobicContact CB-CB 4.05Å; P261-R265 PolarHBondContact O-N 3.09Å; Y262-R265 PolarHBondContact O-N 2.72Å; R265-R267 VanDerWaalsContact C-N 3.31Å; R265-R267 PolarHBondContact O-N 3.31Å; R265-W268 WeakPolarHBondContact O-CB 3.42Å; R265-W268 PolarHBondContact O-N 3.29Å; R265-W268 VanDerWaalsContact O-N 3.12Å; R265-E269 HydrophobicContact CG-CG 4.41Å; R265-E269 IonicContact CZ-OE1 3.92Å; R265-E269 IonicContact NE-OE1 2.68Å; R265-E269 PolarHBondContact NE-OE1 2.58Å; R265-E269 IonicContact NH2-OE1 3.9Å; R265-E269 WeakPolarHBondContact O-CG 3.35Å; R265-E269 PolarHBondContact O-N 2.84Å
266	K	86.4	Confident	83.7	Confident	95 Å²	95	73.8 Å²	73.8	41%	0.413	34%	0.344	S	S	.	.	H	α-helix	trans	-56.9	-43.6	177.4	-178.9	-179.9	176.1	-177.5	0	111.7	Y262 V264 E269 Q270	Y262-K266 HydrophobicContact CE1-CD 4.26Å; Y262-K266 VanDerWaalsContact O-CB 3.26Å; Y262-K266 WeakPolarHBondContact O-CB 3.27Å; Y262-K266 PolarHBondContact O-N 3.25Å; V264-K266 VanDerWaalsContact C-N 3.32Å; V264-K266 PolarHBondContact O-N 3.22Å; K266-E269 PolarHBondContact O-N 3.16Å; K266-Q270 VanDerWaalsContact O-CG 3.29Å; K266-Q270 WeakPolarHBondContact O-CG 3.41Å; K266-Q270 PolarHBondContact O-N 2.68Å
267	R	88.1	Confident	82	Confident	88 Å²	88	79 Å²	79	33%	0.332	36%	0.362	S	S	.	.	H	α-helix	trans	-67.6	-35.4	176	-74.3	-177	-74.3	168	4	112.8	Q263 V264 R265 Q270 K271 F289 E293	Q263-R267 PolarHBondContact O-N 3.16Å; Q263-R267 PolarHBondContact O-NE 2.88Å; V264-R267 PolarHBondContact O-N 3.49Å; R265-R267 VanDerWaalsContact C-N 3.31Å; R265-R267 PolarHBondContact O-N 3.31Å; R267-Q270 WeakPolarHBondContact O-CB 3.18Å; R267-Q270 PolarHBondContact O-N 2.72Å; R267-K271 PolarHBondContact O-N 3.24Å; R267-F289 HydrophobicContact CB-CE2 3.91Å; R267-F289 HydrophobicContact CB-CZ 3.8Å; R267-E293 VanDerWaalsContact CD-OE1 3.29Å; R267-E293 WeakPolarHBondContact CD-OE1 3.31Å; R267-E293 IonicContact CZ-OE1 2.65Å; R267-E293 IonicContact CZ-OE2 3.58Å; R267-E293 IonicContact NE-OE1 3.04Å; R267-E293 PolarHBondContact NE-OE1 2.82Å; R267-E293 IonicContact NE-OE2 3.75Å; R267-E293 IonicContact NH1-OE1 2.84Å; R267-E293 PolarHBondContact NH1-OE1 3.3Å; R267-E293 IonicContact NH1-OE2 2.71Å; R267-E293 PolarHBondContact NH1-OE2 3.39Å; R267-E293 IonicContact NH2-OE1 3.72Å; R267-E293 IonicContact NH2-OE2 3.06Å; R267-E293 PolarHBondContact NH2-OE2 2.9Å
268	W	89.4	Confident	80.4	Confident	5 Å²	5	85.7 Å²	85.7	2%	0.019	40%	0.399	C	S	.	.	H	α-helix	trans	-62	-49.9	170.9	170.9	-109.3	0	0	0	111.8	L253 V264 R265 Q270 K271 M272 L285 F286 F289	L253-W268 HydrophobicContact CD2-CZ2 4.28Å; V264-W268 PolarHBondContact O-N 3.27Å; R265-W268 WeakPolarHBondContact O-CB 3.42Å; R265-W268 PolarHBondContact O-N 3.29Å; R265-W268 VanDerWaalsContact O-N 3.12Å; W268-Q270 PolarHBondContact O-N 3Å; W268-K271 PolarHBondContact O-N 2.72Å; W268-K271 VanDerWaalsContact O-N 3.13Å; W268-M272 HydrophobicContact CD2-CG 4.02Å; W268-M272 VanDerWaalsContact CE2-CG 3.5Å; W268-M272 HydrophobicContact CE3-CE 4.24Å; W268-M272 HydrophobicContact CE3-CG 4.44Å; W268-M272 HydrophobicContact CH2-CE 3.31Å; W268-M272 HydrophobicContact CH2-CG 4.06Å; W268-M272 HydrophobicContact CH2-SD 3.55Å; W268-M272 VanDerWaalsContact CH2-SD 3.55Å; W268-M272 HydrophobicContact CZ2-CE 3.82Å; W268-M272 HydrophobicContact CZ2-CG 3.55Å; W268-M272 HydrophobicContact CZ2-SD 3.4Å; W268-M272 WeakPolarHBondContact CZ2-SD 3.4Å; W268-M272 HydrophobicContact CZ3-CE 3.53Å; W268-M272 HydrophobicContact CZ3-CG 4.45Å; W268-M272 HydrophobicContact CZ3-SD 4.26Å; W268-M272 WeakPolarHBondContact O-CG 3.5Å; W268-M272 PolarHBondContact O-N 3.19Å; W268-L285 HydrophobicContact CH2-CB 4.23Å; W268-F286 AromaticContact CD2-CD2 3.73Å; W268-F286 HydrophobicContact CD2-CD2 3.73Å; W268-F286 HydrophobicContact CD2-CE2 4.27Å; W268-F286 AromaticContact CE2-CD2 3.63Å; W268-F286 AromaticContact CE3-CD2 3.99Å; W268-F286 HydrophobicContact CE3-CD2 3.99Å; W268-F286 HydrophobicContact CG-CD2 4.31Å; W268-F286 HydrophobicContact CG-CE2 4.39Å; W268-F286 VanDerWaalsContact CH2-CA 3.45Å; W268-F286 HydrophobicContact CH2-CB 3.59Å; W268-F286 AromaticContact CH2-CD2 3.98Å; W268-F286 HydrophobicContact CH2-CD2 3.98Å; W268-F286 HydrophobicContact CH2-CG 4.31Å; W268-F286 HydrophobicContact CZ2-CB 3.98Å; W268-F286 AromaticContact CZ2-CD2 3.75Å; W268-F286 HydrophobicContact CZ2-CD2 3.75Å; W268-F286 HydrophobicContact CZ2-CG 4.37Å; W268-F286 VanDerWaalsContact CZ3-CA 3.42Å; W268-F286 HydrophobicContact CZ3-CB 4Å; W268-F286 HydrophobicContact CZ3-CD2 4.11Å; W268-F289 HydrophobicContact CB-CD1 4.1Å; W268-F289 HydrophobicContact CB-CE1 3.6Å; W268-F289 HydrophobicContact CB-CE2 4.44Å; W268-F289 HydrophobicContact CB-CZ 3.8Å; W268-F289 HydrophobicContact CD2-CD1 4.34Å; W268-F289 HydrophobicContact CE3-CB 3.75Å; W268-F289 AromaticContact CE3-CD1 3.64Å; W268-F289 HydrophobicContact CE3-CD1 3.64Å; W268-F289 HydrophobicContact CE3-CD2 4.18Å; W268-F289 HydrophobicContact CE3-CE1 4.32Å; W268-F289 AromaticContact CE3-CG 3.57Å; W268-F289 HydrophobicContact CE3-CG 3.57Å; W268-F289 HydrophobicContact CG-CE1 4.48Å; W268-F289 HydrophobicContact CZ3-CB 3.78Å; W268-F289 HydrophobicContact CZ3-CD1 4.45Å; W268-F289 HydrophobicContact CZ3-CG 4.14Å
269	E	86.8	Confident	78.9	Confident	46 Å²	46	83.3 Å²	83.3	22%	0.215	39%	0.391	C	S	.	.	H	α-helix	trans	-60	-37.6	177.5	-57.2	-60.3	172.8	0	0	110.5	K257 R265 K266 M272 L273	K257-E269 WeakPolarHBondContact CE-OE1 3.25Å; K257-E269 VanDerWaalsContact NZ-CD 3.3Å; K257-E269 IonicContact NZ-OE1 2.67Å; K257-E269 PolarHBondContact NZ-OE1 3.43Å; K257-E269 IonicContact NZ-OE2 3.2Å; K257-E269 PolarHBondContact NZ-OE2 2.85Å; R265-E269 HydrophobicContact CG-CG 4.41Å; R265-E269 IonicContact CZ-OE1 3.92Å; R265-E269 IonicContact NE-OE1 2.68Å; R265-E269 PolarHBondContact NE-OE1 2.58Å; R265-E269 IonicContact NH2-OE1 3.9Å; R265-E269 WeakPolarHBondContact O-CG 3.35Å; R265-E269 PolarHBondContact O-N 2.84Å; K266-E269 PolarHBondContact O-N 3.16Å; E269-M272 PolarHBondContact O-N 3.1Å; E269-L273 WeakPolarHBondContact O-CB 3.22Å; E269-L273 WeakPolarHBondContact O-CD1 3.39Å; E269-L273 PolarHBondContact O-N 3.25Å
270	Q	82.2	Confident	77.3	Confident	101 Å²	101	79.8 Å²	79.8	47%	0.472	39%	0.389	S	S	.	.	H	α-helix	trans	-60	-49.3	173.4	-75.3	171.6	-25.7	0	0	111.9	K266 R267 W268 M272 L273 T274	K266-Q270 VanDerWaalsContact O-CG 3.29Å; K266-Q270 WeakPolarHBondContact O-CG 3.41Å; K266-Q270 PolarHBondContact O-N 2.68Å; R267-Q270 WeakPolarHBondContact O-CB 3.18Å; R267-Q270 PolarHBondContact O-N 2.72Å; W268-Q270 PolarHBondContact O-N 3Å; Q270-M272 VanDerWaalsContact C-N 3.28Å; Q270-M272 PolarHBondContact O-N 2.95Å; Q270-L273 PolarHBondContact O-N 3.3Å; Q270-L273 VanDerWaalsContact O-N 3.16Å; Q270-T274 PolarHBondContact O-N 3.03Å; Q270-T274 PolarHBondContact O-OG1 2.82Å
271	K	83.3	Confident	76.3	Confident	40 Å²	40	83.9 Å²	83.9	17%	0.174	41%	0.407	C	S	.	.	H	α-helix	trans	-59.9	-37.4	176.2	-173.6	171.5	-178.9	176.2	0	111.9	R267 W268 T274 D275 G276 E288 F289	R267-K271 PolarHBondContact O-N 3.24Å; W268-K271 PolarHBondContact O-N 2.72Å; W268-K271 VanDerWaalsContact O-N 3.13Å; K271-T274 PolarHBondContact O-OG1 3.48Å; K271-D275 PolarHBondContact O-N 3.44Å; K271-G276 PolarHBondContact O-N 3.43Å; K271-E288 IonicContact NZ-OE2 2.79Å; K271-E288 PolarHBondContact NZ-OE2 2.97Å; K271-F289 HydrophobicContact CD-CB 4.16Å; K271-F289 HydrophobicContact CD-CD2 3.95Å; K271-F289 HydrophobicContact CD-CG 4.46Å
272	M	81.6	Confident	75.7	Confident	19 Å²	19	83.5 Å²	83.5	9%	0.094	39%	0.394	C	S	.	.	H	α-helix	trans	-70.7	-35.3	176.5	-69.2	-61.9	95.3	0	0	113.3	W268 E269 Q270 G276	W268-M272 HydrophobicContact CD2-CG 4.02Å; W268-M272 VanDerWaalsContact CE2-CG 3.5Å; W268-M272 HydrophobicContact CE3-CE 4.24Å; W268-M272 HydrophobicContact CE3-CG 4.44Å; W268-M272 HydrophobicContact CH2-CE 3.31Å; W268-M272 HydrophobicContact CH2-CG 4.06Å; W268-M272 HydrophobicContact CH2-SD 3.55Å; W268-M272 VanDerWaalsContact CH2-SD 3.55Å; W268-M272 HydrophobicContact CZ2-CE 3.82Å; W268-M272 HydrophobicContact CZ2-CG 3.55Å; W268-M272 HydrophobicContact CZ2-SD 3.4Å; W268-M272 WeakPolarHBondContact CZ2-SD 3.4Å; W268-M272 HydrophobicContact CZ3-CE 3.53Å; W268-M272 HydrophobicContact CZ3-CG 4.45Å; W268-M272 HydrophobicContact CZ3-SD 4.26Å; W268-M272 WeakPolarHBondContact O-CG 3.5Å; W268-M272 PolarHBondContact O-N 3.19Å; E269-M272 PolarHBondContact O-N 3.1Å; Q270-M272 VanDerWaalsContact C-N 3.28Å; Q270-M272 PolarHBondContact O-N 2.95Å; M272-G276 WeakPolarHBondContact O-CA 3.23Å; M272-G276 PolarHBondContact O-N 3.31Å
273	L	72.6	Confident	75.4	Confident	83 Å²	83	77.4 Å²	77.4	44%	0.435	37%	0.372	S	S	.	.	H	α-helix	trans	-70.1	-32.1	175.6	-87.5	149.4	0	0	0	112.6	E269 Q270	E269-L273 WeakPolarHBondContact O-CB 3.22Å; E269-L273 WeakPolarHBondContact O-CD1 3.39Å; E269-L273 PolarHBondContact O-N 3.25Å; Q270-L273 PolarHBondContact O-N 3.3Å; Q270-L273 VanDerWaalsContact O-N 3.16Å
274	T	70.7	Confident	75.2	Confident	102 Å²	102	76.6 Å²	76.6	63%	0.626	37%	0.372	S	S	*	.	H	α-helix	trans	-88.6	-52.7	179.1	57.9	0	0	0	0	113.1	Q270 K271	Q270-T274 PolarHBondContact O-N 3.03Å; Q270-T274 PolarHBondContact O-OG1 2.82Å; K271-T274 PolarHBondContact O-OG1 3.48Å
275	D	65.5	Low	75	Confident	112 Å²	112	77 Å²	77	60%	0.599	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.2	-20.2	-166.4	-55.2	-14.9	0	0	0	112.6	K271	K271-D275 PolarHBondContact O-N 3.44Å
276	G	59.7	Low	74.9	Confident	3 Å²	3	74.4 Å²	74.4	3%	0.031	36%	0.363	C	S	.	.			trans	-94.6	0.7	-161.6	0	0	0	0	0	117.6	K271 M272 N278	K271-G276 PolarHBondContact O-N 3.43Å; M272-G276 WeakPolarHBondContact O-CA 3.23Å; M272-G276 PolarHBondContact O-N 3.31Å; G276-N278 PolarHBondContact O-N 3.23Å; G276-N278 VanDerWaalsContact O-N 3.15Å
277	R	55.7	Low	75.1	Confident	166 Å²	166	75 Å²	75	63%	0.626	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-30.8	-172.1	-75.1	-171.5	-175.5	-167.2	-1	113.4
278	N	55.7	Low	75.1	Confident	160 Å²	160	74.8 Å²	74.8	86%	0.856	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.1	30	-175.2	-74.1	-8.1	0	0	0	114.7	G276	G276-N278 PolarHBondContact O-N 3.23Å; G276-N278 VanDerWaalsContact O-N 3.15Å
279	C	55.6	Low	75.2	Confident	38 Å²	38	75 Å²	75	26%	0.257	37%	0.37	S	S	.	.			trans	-94.4	126.8	174.9	-167	0	0	0	0	112.2	H281 R282 L285	C279-H281 VanDerWaalsContact C-N 3.34Å; C279-H281 PolarHBondContact SG-N 3.47Å; C279-R282 WeakPolarHBondContact O-CG 3.35Å; C279-L285 HydrophobicContact CB-CD1 3.41Å; C279-L285 VanDerWaalsContact CB-CD1 3.41Å; C279-L285 WeakPolarHBondContact SG-CD1 3.4Å
280	D	57.4	Low	75.4	Confident	142 Å²	142	75 Å²	75	76%	0.759	37%	0.371	S	S	*	.	S	Bend	trans	-74.5	-19.8	173.3	-68.6	-29.9	0	0	0	113.3
281	H	68.4	Low	75.8	Confident	116 Å²	116	77 Å²	77	54%	0.537	38%	0.375	S	S	.	.			trans	-114	60.6	-173.7	-58	84	0	0	0	111.3	C279 L283 D284 L285	C279-H281 VanDerWaalsContact C-N 3.34Å; C279-H281 PolarHBondContact SG-N 3.47Å; H281-L283 VanDerWaalsContact C-N 3.31Å; H281-L283 PolarHBondContact O-N 2.88Å; H281-D284 HydrophobicContact CB-CB 4.39Å; H281-D284 IonicContact CD2-OD2 3.03Å; H281-D284 PolarHBondContact O-N 2.77Å; H281-L285 PolarHBondContact O-N 3.25Å
282	R	74.3	Confident	76	Confident	79 Å²	79	77.7 Å²	77.7	30%	0.298	38%	0.382	S	S	.	.	H	α-helix	trans	-68.1	-29.5	-173	-67.5	-177.4	177.6	-167.9	-5.5	112.9	E249 L253 C279 F286	E249-R282 WeakPolarHBondContact OE1-CA 3.16Å; E249-R282 PolarHBondContact OE1-N 3.39Å; L253-R282 HydrophobicContact CD1-CB 3.52Å; C279-R282 WeakPolarHBondContact O-CG 3.35Å; R282-F286 WeakPolarHBondContact O-CB 3.32Å; R282-F286 PolarHBondContact O-N 3.19Å
283	L	82	Confident	76.3	Confident	32 Å²	32	77.6 Å²	77.6	17%	0.168	38%	0.381	C	S	.	.	H	α-helix	trans	-70.7	-41.2	178.2	-164.8	65.5	0	0	0	112	E249 L252 L253 F256 H281 F286 F287	E249-L283 HydrophobicContact CG-CB 3.89Å; E249-L283 WeakPolarHBondContact OE1-CB 3.41Å; E249-L283 PolarHBondContact OE1-N 3.3Å; L252-L283 HydrophobicContact CB-CD1 4.42Å; L253-L283 HydrophobicContact CD2-CD1 4.03Å; L253-L283 HydrophobicContact CG-CD1 4.04Å; F256-L283 HydrophobicContact CD2-CD1 4.02Å; F256-L283 HydrophobicContact CE2-CD1 3.89Å; H281-L283 VanDerWaalsContact C-N 3.31Å; H281-L283 PolarHBondContact O-N 2.88Å; L283-F286 WeakPolarHBondContact O-CB 3.49Å; L283-F286 PolarHBondContact O-N 3.07Å; L283-F286 VanDerWaalsContact O-N 3.15Å; L283-F287 HydrophobicContact CD1-CE2 4.14Å; L283-F287 HydrophobicContact CD2-CE2 4.43Å; L283-F287 HydrophobicContact CG-CD2 4.2Å; L283-F287 HydrophobicContact CG-CE2 3.91Å; L283-F287 VanDerWaalsContact O-CD2 3.27Å; L283-F287 WeakPolarHBondContact O-CD2 3.44Å; L283-F287 PolarHBondContact O-N 3Å
284	D	83.9	Confident	77	Confident	102 Å²	102	77.1 Å²	77.1	55%	0.545	38%	0.382	S	S	.	.	H	α-helix	trans	-66.6	-42.8	176.9	-66.2	-33.2	0	0	0	110.6	H281 F286 F287 E288	H281-D284 HydrophobicContact CB-CB 4.39Å; H281-D284 IonicContact CD2-OD2 3.03Å; H281-D284 PolarHBondContact O-N 2.77Å; D284-F286 PolarHBondContact O-N 3.2Å; D284-F287 PolarHBondContact O-N 3.38Å; D284-E288 WeakPolarHBondContact O-CB 3.48Å; D284-E288 PolarHBondContact O-N 3.47Å
285	L	85.1	Confident	77.7	Confident	32 Å²	32	76.5 Å²	76.5	17%	0.168	37%	0.372	C	S	.	.	H	α-helix	trans	-56.7	-37.1	170	-91.4	162.2	0	0	0	112.9	W268 C279 H281 F289	W268-L285 HydrophobicContact CH2-CB 4.23Å; C279-L285 HydrophobicContact CB-CD1 3.41Å; C279-L285 VanDerWaalsContact CB-CD1 3.41Å; C279-L285 WeakPolarHBondContact SG-CD1 3.4Å; H281-L285 PolarHBondContact O-N 3.25Å; L285-F289 VanDerWaalsContact O-CB 3.23Å; L285-F289 WeakPolarHBondContact O-CB 3.06Å; L285-F289 PolarHBondContact O-N 3.5Å
286	F	89.3	Confident	78.5	Confident	2 Å²	2	74.8 Å²	74.8	1%	0.009	36%	0.362	C	S	.	.	H	α-helix	trans	-67.4	-43.2	177.8	-179.6	-95.7	0	0	0	112.1	L253 F256 K257 L260 W268 R282 L283 D284 F289 L290	L253-F286 HydrophobicContact CD2-CB 3.74Å; L253-F286 HydrophobicContact CD2-CD2 4.19Å; L253-F286 HydrophobicContact CD2-CG 3.96Å; F256-F286 HydrophobicContact CB-CD1 4.41Å; F256-F286 HydrophobicContact CB-CE1 3.53Å; F256-F286 HydrophobicContact CB-CE2 4.48Å; F256-F286 HydrophobicContact CB-CZ 3.57Å; F256-F286 HydrophobicContact CD2-CD1 4.11Å; F256-F286 AromaticContact CD2-CE1 3.85Å; F256-F286 HydrophobicContact CD2-CE1 3.85Å; F256-F286 HydrophobicContact CG-CE1 4.08Å; K257-F286 HydrophobicContact CG-CE2 4.41Å; L260-F286 HydrophobicContact CD1-CE2 3.64Å; L260-F286 HydrophobicContact CD1-CZ 3.79Å; L260-F286 HydrophobicContact CD2-CZ 4.27Å; L260-F286 HydrophobicContact CG-CE2 4.49Å; L260-F286 HydrophobicContact CG-CZ 4.18Å; W268-F286 AromaticContact CD2-CD2 3.73Å; W268-F286 HydrophobicContact CD2-CD2 3.73Å; W268-F286 HydrophobicContact CD2-CE2 4.27Å; W268-F286 AromaticContact CE2-CD2 3.63Å; W268-F286 AromaticContact CE3-CD2 3.99Å; W268-F286 HydrophobicContact CE3-CD2 3.99Å; W268-F286 HydrophobicContact CG-CD2 4.31Å; W268-F286 HydrophobicContact CG-CE2 4.39Å; W268-F286 VanDerWaalsContact CH2-CA 3.45Å; W268-F286 HydrophobicContact CH2-CB 3.59Å; W268-F286 AromaticContact CH2-CD2 3.98Å; W268-F286 HydrophobicContact CH2-CD2 3.98Å; W268-F286 HydrophobicContact CH2-CG 4.31Å; W268-F286 HydrophobicContact CZ2-CB 3.98Å; W268-F286 AromaticContact CZ2-CD2 3.75Å; W268-F286 HydrophobicContact CZ2-CD2 3.75Å; W268-F286 HydrophobicContact CZ2-CG 4.37Å; W268-F286 VanDerWaalsContact CZ3-CA 3.42Å; W268-F286 HydrophobicContact CZ3-CB 4Å; W268-F286 HydrophobicContact CZ3-CD2 4.11Å; R282-F286 WeakPolarHBondContact O-CB 3.32Å; R282-F286 PolarHBondContact O-N 3.19Å; L283-F286 WeakPolarHBondContact O-CB 3.49Å; L283-F286 PolarHBondContact O-N 3.07Å; L283-F286 VanDerWaalsContact O-N 3.15Å; D284-F286 PolarHBondContact O-N 3.2Å; F286-F289 PolarHBondContact O-N 3.07Å; F286-L290 HydrophobicContact CD1-CD1 3.98Å; F286-L290 HydrophobicContact CE1-CD1 3.36Å; F286-L290 HydrophobicContact CE1-CG 4.16Å; F286-L290 HydrophobicContact CZ-CD1 3.84Å; F286-L290 HydrophobicContact CZ-CG 4.32Å; F286-L290 PolarHBondContact O-N 3.35Å
287	F	90.3	Very high	79.3	Confident	106 Å²	106	79.5 Å²	79.5	47%	0.465	38%	0.383	S	S	.	.	H	α-helix	trans	-69.8	-38.3	175.7	-77.9	-66.3	0	0	0	112.6	F256 L283 D284 L290 R291	F256-F287 HydrophobicContact CD2-CZ 4.48Å; F256-F287 HydrophobicContact CE2-CE2 4.23Å; F256-F287 AromaticContact CE2-CZ 3.83Å; F256-F287 HydrophobicContact CE2-CZ 3.83Å; F256-F287 HydrophobicContact CZ-CZ 4.5Å; L283-F287 HydrophobicContact CD1-CE2 4.14Å; L283-F287 HydrophobicContact CD2-CE2 4.43Å; L283-F287 HydrophobicContact CG-CD2 4.2Å; L283-F287 HydrophobicContact CG-CE2 3.91Å; L283-F287 VanDerWaalsContact O-CD2 3.27Å; L283-F287 WeakPolarHBondContact O-CD2 3.44Å; L283-F287 PolarHBondContact O-N 3Å; D284-F287 PolarHBondContact O-N 3.38Å; F287-L290 PolarHBondContact O-N 3.09Å; F287-R291 PolarHBondContact O-N 2.87Å
288	E	87.8	Confident	80.6	Confident	85 Å²	85	77.2 Å²	77.2	40%	0.397	38%	0.379	S	S	.	.	H	α-helix	trans	-61.2	-45.7	172.3	-172	-156.8	-152.2	0	0	111	K271 D284 L290 R291 V292	K271-E288 IonicContact NZ-OE2 2.79Å; K271-E288 PolarHBondContact NZ-OE2 2.97Å; D284-E288 WeakPolarHBondContact O-CB 3.48Å; D284-E288 PolarHBondContact O-N 3.47Å; E288-L290 PolarHBondContact O-N 2.94Å; E288-R291 WeakPolarHBondContact O-CB 3.31Å; E288-R291 PolarHBondContact O-N 2.93Å; E288-V292 WeakPolarHBondContact O-CG2 3.39Å; E288-V292 PolarHBondContact O-N 3.47Å
289	F	91.9	Very high	81.5	Confident	10 Å²	10	73.9 Å²	73.9	4%	0.044	37%	0.367	C	S	.	.	H	α-helix	trans	-56.9	-48.1	174	166.8	-97.7	0	0	0	111.6	V264 R267 W268 K271 L285 F286 R291 V292 E293	V264-F289 HydrophobicContact CG1-CE1 3.89Å; V264-F289 HydrophobicContact CG1-CZ 4.17Å; V264-F289 WeakPolarHBondContact O-CZ 3.49Å; R267-F289 HydrophobicContact CB-CE2 3.91Å; R267-F289 HydrophobicContact CB-CZ 3.8Å; W268-F289 HydrophobicContact CB-CD1 4.1Å; W268-F289 HydrophobicContact CB-CE1 3.6Å; W268-F289 HydrophobicContact CB-CE2 4.44Å; W268-F289 HydrophobicContact CB-CZ 3.8Å; W268-F289 HydrophobicContact CD2-CD1 4.34Å; W268-F289 HydrophobicContact CE3-CB 3.75Å; W268-F289 AromaticContact CE3-CD1 3.64Å; W268-F289 HydrophobicContact CE3-CD1 3.64Å; W268-F289 HydrophobicContact CE3-CD2 4.18Å; W268-F289 HydrophobicContact CE3-CE1 4.32Å; W268-F289 AromaticContact CE3-CG 3.57Å; W268-F289 HydrophobicContact CE3-CG 3.57Å; W268-F289 HydrophobicContact CG-CE1 4.48Å; W268-F289 HydrophobicContact CZ3-CB 3.78Å; W268-F289 HydrophobicContact CZ3-CD1 4.45Å; W268-F289 HydrophobicContact CZ3-CG 4.14Å; K271-F289 HydrophobicContact CD-CB 4.16Å; K271-F289 HydrophobicContact CD-CD2 3.95Å; K271-F289 HydrophobicContact CD-CG 4.46Å; L285-F289 VanDerWaalsContact O-CB 3.23Å; L285-F289 WeakPolarHBondContact O-CB 3.06Å; L285-F289 PolarHBondContact O-N 3.5Å; F286-F289 PolarHBondContact O-N 3.07Å; F289-R291 VanDerWaalsContact C-N 3.3Å; F289-R291 PolarHBondContact O-N 2.98Å; F289-V292 PolarHBondContact O-N 3.37Å; F289-E293 HydrophobicContact CD1-CG 4.26Å; F289-E293 HydrophobicContact CD2-CG 4.2Å; F289-E293 HydrophobicContact CE1-CG 3.76Å; F289-E293 HydrophobicContact CE2-CG 3.69Å; F289-E293 HydrophobicContact CG-CG 4.45Å; F289-E293 HydrophobicContact CZ-CG 3.44Å; F289-E293 VanDerWaalsContact CZ-CG 3.44Å; F289-E293 WeakPolarHBondContact O-CB 3.37Å; F289-E293 VanDerWaalsContact O-CG 3.3Å; F289-E293 WeakPolarHBondContact O-CG 3.39Å; F289-E293 PolarHBondContact O-N 2.99Å
290	L	90.9	Very high	82.2	Confident	46 Å²	46	76.5 Å²	76.5	24%	0.241	38%	0.382	C	S	.	.	H	α-helix	trans	-60.7	-38.6	177.1	-86.6	178.3	0	0	0	112.7	L260 V264 F286 F287 E288 E293 V294	L260-L290 HydrophobicContact CD2-CD2 3.72Å; V264-L290 HydrophobicContact CG1-CD2 4.48Å; F286-L290 HydrophobicContact CD1-CD1 3.98Å; F286-L290 HydrophobicContact CE1-CD1 3.36Å; F286-L290 HydrophobicContact CE1-CG 4.16Å; F286-L290 HydrophobicContact CZ-CD1 3.84Å; F286-L290 HydrophobicContact CZ-CG 4.32Å; F286-L290 PolarHBondContact O-N 3.35Å; F287-L290 PolarHBondContact O-N 3.09Å; E288-L290 PolarHBondContact O-N 2.94Å; L290-E293 WeakPolarHBondContact O-CB 3.37Å; L290-E293 PolarHBondContact O-N 3.48Å; L290-V294 VanDerWaalsContact O-CG2 3.32Å; L290-V294 WeakPolarHBondContact O-CG2 3.03Å; L290-V294 PolarHBondContact O-N 3.24Å
291	R	90.1	Very high	82.4	Confident	143 Å²	143	77 Å²	77	54%	0.54	38%	0.378	S	S	.	.	H	α-helix	trans	-61.6	-49.5	175.5	-171.3	-173.5	71.4	-159.3	-6.3	111.2	F287 E288 F289 E293 V294 E295	F287-R291 PolarHBondContact O-N 2.87Å; E288-R291 WeakPolarHBondContact O-CB 3.31Å; E288-R291 PolarHBondContact O-N 2.93Å; F289-R291 VanDerWaalsContact C-N 3.3Å; F289-R291 PolarHBondContact O-N 2.98Å; R291-E293 VanDerWaalsContact C-N 3.25Å; R291-E293 PolarHBondContact O-N 2.61Å; R291-V294 PolarHBondContact O-N 2.91Å; R291-E295 WeakPolarHBondContact CG-OE1 3.41Å; R291-E295 IonicContact NE-OE1 3.65Å; R291-E295 PolarHBondContact NE-OE1 3.12Å; R291-E295 WeakPolarHBondContact O-CG 2.88Å; R291-E295 PolarHBondContact O-N 3.4Å
292	V	86.9	Confident	81.6	Confident	54 Å²	54	76 Å²	76	33%	0.327	38%	0.384	S	S	.	.	H	α-helix	trans	-59.8	-39.2	177	172.3	0	0	0	0	111	E288 F289 E295 I296	E288-V292 WeakPolarHBondContact O-CG2 3.39Å; E288-V292 PolarHBondContact O-N 3.47Å; F289-V292 PolarHBondContact O-N 3.37Å; V292-E295 PolarHBondContact O-N 3.14Å; V292-I296 HydrophobicContact CG1-CD1 3.8Å; V292-I296 HydrophobicContact CG1-CG1 4.36Å; V292-I296 VanDerWaalsContact O-CG1 3.23Å; V292-I296 WeakPolarHBondContact O-CG1 3.39Å; V292-I296 PolarHBondContact O-N 3.15Å
293	E	88.8	Confident	80.1	Confident	16 Å²	16	75.2 Å²	75.2	8%	0.075	40%	0.395	C	S	.	.	H	α-helix	trans	-63.7	-41.1	176.7	-77.9	-62.1	164.5	0	0	113.5	V264 R267 F289 L290 R291 E297	V264-E293 HydrophobicContact CG1-CG 4.29Å; R267-E293 VanDerWaalsContact CD-OE1 3.29Å; R267-E293 WeakPolarHBondContact CD-OE1 3.31Å; R267-E293 IonicContact CZ-OE1 2.65Å; R267-E293 IonicContact CZ-OE2 3.58Å; R267-E293 IonicContact NE-OE1 3.04Å; R267-E293 PolarHBondContact NE-OE1 2.82Å; R267-E293 IonicContact NE-OE2 3.75Å; R267-E293 IonicContact NH1-OE1 2.84Å; R267-E293 PolarHBondContact NH1-OE1 3.3Å; R267-E293 IonicContact NH1-OE2 2.71Å; R267-E293 PolarHBondContact NH1-OE2 3.39Å; R267-E293 IonicContact NH2-OE1 3.72Å; R267-E293 IonicContact NH2-OE2 3.06Å; R267-E293 PolarHBondContact NH2-OE2 2.9Å; F289-E293 HydrophobicContact CD1-CG 4.26Å; F289-E293 HydrophobicContact CD2-CG 4.2Å; F289-E293 HydrophobicContact CE1-CG 3.76Å; F289-E293 HydrophobicContact CE2-CG 3.69Å; F289-E293 HydrophobicContact CG-CG 4.45Å; F289-E293 HydrophobicContact CZ-CG 3.44Å; F289-E293 VanDerWaalsContact CZ-CG 3.44Å; F289-E293 WeakPolarHBondContact O-CB 3.37Å; F289-E293 VanDerWaalsContact O-CG 3.3Å; F289-E293 WeakPolarHBondContact O-CG 3.39Å; F289-E293 PolarHBondContact O-N 2.99Å; L290-E293 WeakPolarHBondContact O-CB 3.37Å; L290-E293 PolarHBondContact O-N 3.48Å; R291-E293 VanDerWaalsContact C-N 3.25Å; R291-E293 PolarHBondContact O-N 2.61Å; E293-E297 PolarHBondContact O-N 2.88Å; E293-E297 VanDerWaalsContact O-N 3.11Å
294	V	86.6	Confident	78.1	Confident	74 Å²	74	79.5 Å²	79.5	45%	0.448	42%	0.424	S	S	.	.	H	α-helix	trans	-64.1	-46.1	173.3	170.9	0	0	0	0	110.7	L290 R291 I296 E297 E298	L290-V294 VanDerWaalsContact O-CG2 3.32Å; L290-V294 WeakPolarHBondContact O-CG2 3.03Å; L290-V294 PolarHBondContact O-N 3.24Å; R291-V294 PolarHBondContact O-N 2.91Å; V294-I296 PolarHBondContact O-N 3.01Å; V294-E297 PolarHBondContact O-N 3.23Å; V294-E297 VanDerWaalsContact O-N 3.14Å; V294-E298 HydrophobicContact CG1-CG 4.45Å; V294-E298 WeakPolarHBondContact O-CG 3.38Å; V294-E298 PolarHBondContact O-N 3.49Å
295	E	86.1	Confident	76.1	Confident	89 Å²	89	80.4 Å²	80.4	42%	0.416	44%	0.438	S	S	.	.	H	α-helix	trans	-60.2	-42.9	178.1	-71.7	169.3	-167.9	0	0	111.9	R291 V292 E297 E298 C299	R291-E295 WeakPolarHBondContact CG-OE1 3.41Å; R291-E295 IonicContact NE-OE1 3.65Å; R291-E295 PolarHBondContact NE-OE1 3.12Å; R291-E295 WeakPolarHBondContact O-CG 2.88Å; R291-E295 PolarHBondContact O-N 3.4Å; V292-E295 PolarHBondContact O-N 3.14Å; E295-E297 VanDerWaalsContact C-N 3.33Å; E295-E297 PolarHBondContact O-N 3.48Å; E295-E298 PolarHBondContact O-N 2.79Å; E295-C299 WeakPolarHBondContact O-CB 3.5Å; E295-C299 PolarHBondContact O-N 3.1Å; E295-C299 PolarHBondContact O-SG 3.34Å
296	I	81.5	Confident	73.6	Confident	76 Å²	76	87.5 Å²	87.5	39%	0.39	48%	0.475	S	S	.	.	H	α-helix	trans	-61	-42.2	175.1	-70.1	165.9	0	0	0	110.9	V292 V294 C299 T300	V292-I296 HydrophobicContact CG1-CD1 3.8Å; V292-I296 HydrophobicContact CG1-CG1 4.36Å; V292-I296 VanDerWaalsContact O-CG1 3.23Å; V292-I296 WeakPolarHBondContact O-CG1 3.39Å; V292-I296 PolarHBondContact O-N 3.15Å; V294-I296 PolarHBondContact O-N 3.01Å; I296-C299 PolarHBondContact O-N 3.16Å; I296-T300 PolarHBondContact O-N 3.4Å; I296-T300 PolarHBondContact O-OG1 3.15Å
297	E	78.1	Confident	70.8	Confident	102 Å²	102	90.5 Å²	90.5	48%	0.477	51%	0.507	S	S	.	.	H	α-helix	trans	-67.2	-37.6	179.2	-160.1	-179.2	149.2	0	0	111.8	E293 V294 E295 T300 K301	E293-E297 PolarHBondContact O-N 2.88Å; E293-E297 VanDerWaalsContact O-N 3.11Å; V294-E297 PolarHBondContact O-N 3.23Å; V294-E297 VanDerWaalsContact O-N 3.14Å; E295-E297 VanDerWaalsContact C-N 3.33Å; E295-E297 PolarHBondContact O-N 3.48Å; E297-T300 WeakPolarHBondContact CA-OG1 3.26Å; E297-T300 PolarHBondContact O-OG1 2.83Å; E297-T300 VanDerWaalsContact O-OG1 3.08Å; E297-K301 WeakPolarHBondContact O-CG 3.37Å; E297-K301 PolarHBondContact O-N 2.67Å; E297-K301 WeakPolarHBondContact OE1-CE 3.23Å; E297-K301 IonicContact OE1-NZ 2.73Å; E297-K301 PolarHBondContact OE1-NZ 2.9Å
298	E	82	Confident	67.9	Low	117 Å²	117	97.6 Å²	97.6	55%	0.547	53%	0.531	S	S	.	.	H	α-helix	trans	-68.8	-40.7	174.7	-71.6	-179	166.7	0	0	112.1	V294 E295 K301 S302	V294-E298 HydrophobicContact CG1-CG 4.45Å; V294-E298 WeakPolarHBondContact O-CG 3.38Å; V294-E298 PolarHBondContact O-N 3.49Å; E295-E298 PolarHBondContact O-N 2.79Å; E298-K301 PolarHBondContact O-N 3.06Å; E298-S302 WeakPolarHBondContact O-CB 3.35Å; E298-S302 PolarHBondContact O-N 3.5Å; E298-S302 VanDerWaalsContact O-N 3.08Å; E298-S302 PolarHBondContact O-OG 3.21Å
299	C	75	Confident	65	Low	90 Å²	90	102.2 Å²	102.2	61%	0.608	55%	0.552	S	S	*	*	H	α-helix	trans	-65.2	-37.9	175.2	-73.4	0	0	0	0	112.4	E295 I296 S302 A303	E295-C299 WeakPolarHBondContact O-CB 3.5Å; E295-C299 PolarHBondContact O-N 3.1Å; E295-C299 PolarHBondContact O-SG 3.34Å; I296-C299 PolarHBondContact O-N 3.16Å; C299-S302 PolarHBondContact O-N 3.27Å; C299-A303 PolarHBondContact O-N 3.09Å; C299-A303 VanDerWaalsContact O-N 3.12Å
300	T	69.3	Low	62	Low	93 Å²	93	110.4 Å²	110.4	57%	0.571	59%	0.588	S	S	*	*	H	α-helix	trans	-74.2	-34.1	178.4	39.4	0	0	0	0	112.7	I296 E297 S302 A303	I296-T300 PolarHBondContact O-N 3.4Å; I296-T300 PolarHBondContact O-OG1 3.15Å; E297-T300 WeakPolarHBondContact CA-OG1 3.26Å; E297-T300 PolarHBondContact O-OG1 2.83Å; E297-T300 VanDerWaalsContact O-OG1 3.08Å; T300-S302 VanDerWaalsContact C-N 3.27Å; T300-S302 PolarHBondContact O-N 3.04Å; T300-A303 PolarHBondContact O-N 3.38Å
301	K	63.4	Low	59	Low	152 Å²	152	114.5 Å²	114.5	66%	0.661	61%	0.61	S	S	*	*	H	α-helix	trans	-67	-28.9	170.5	-75.5	173.2	-173.6	160.1	0	112.9	E297 E298	E297-K301 WeakPolarHBondContact O-CG 3.37Å; E297-K301 PolarHBondContact O-N 2.67Å; E297-K301 WeakPolarHBondContact OE1-CE 3.23Å; E297-K301 IonicContact OE1-NZ 2.73Å; E297-K301 PolarHBondContact OE1-NZ 2.9Å; E298-K301 PolarHBondContact O-N 3.06Å
302	S	51.2	Low	56	Low	96 Å²	96	113.2 Å²	113.2	67%	0.671	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.3	-5.1	-179.6	-52.1	0	0	0	0	113.7	E298 C299 T300 P304	E298-S302 WeakPolarHBondContact O-CB 3.35Å; E298-S302 PolarHBondContact O-N 3.5Å; E298-S302 VanDerWaalsContact O-N 3.08Å; E298-S302 PolarHBondContact O-OG 3.21Å; C299-S302 PolarHBondContact O-N 3.27Å; T300-S302 VanDerWaalsContact C-N 3.27Å; T300-S302 PolarHBondContact O-N 3.04Å; S302-P304 WeakPolarHBondContact O-CD 3.28Å
303	A	41.2	Very low	53.1	Low	63 Å²	63	116.7 Å²	116.7	52%	0.521	65%	0.647	S	S	.	*	S	Bend	trans	-74.8	117.5	-179.5	0	0	0	0	0	110.7	C299 T300 S305	C299-A303 PolarHBondContact O-N 3.09Å; C299-A303 VanDerWaalsContact O-N 3.12Å; T300-A303 PolarHBondContact O-N 3.38Å; A303-S305 PolarHBondContact O-N 2.85Å
304	P	41.3	Very low	50.1	Low	122 Å²	122	123.1 Å²	123.1	79%	0.792	68%	0.682	S	S	*	*			trans	-64.3	120.2	179.6	24.5	-31.3	0	0	0	109.9	S302 L306	S302-P304 WeakPolarHBondContact O-CD 3.28Å; P304-L306 PolarHBondContact O-N 3.17Å; P304-L306 VanDerWaalsContact O-N 3.12Å
305	S	40.6	Very low	47.2	Very low	120 Å²	120	124.9 Å²	124.9	84%	0.839	69%	0.692	S	S	*	*			trans	-59.3	114.1	177.3	55.5	0	0	0	0	110.7	A303 G307	A303-S305 PolarHBondContact O-N 2.85Å; S305-G307 PolarHBondContact O-N 2.86Å
306	L	33.4	Very low	44.4	Very low	181 Å²	181	127.5 Å²	127.5	95%	0.948	71%	0.709	S	S	*	*			trans	-61.8	112.2	170.5	-92.3	140.9	0	0	0	110.5	P304	P304-L306 PolarHBondContact O-N 3.17Å; P304-L306 VanDerWaalsContact O-N 3.12Å
307	G	30.9	Very low	42	Very low	66 Å²	66	129 Å²	129	68%	0.68	73%	0.727	S	S	*	*			trans	63.6	86.7	144.7	0	0	0	0	0	117.9	S305	S305-G307 PolarHBondContact O-N 2.86Å
308	R	28.5	Very low	39.5	Very low	255 Å²	255	135 Å²	135	96%	0.962	75%	0.745	S	S	*	*			trans	-123	99.1	130.6	-93.9	-174.5	176.7	176.6	-0.4	109.4
309	H	27.5	Very low	36.9	Very low	181 Å²	181	138.2 Å²	138.2	84%	0.838	76%	0.757	S	S	*	*			trans	-53.6	126.2	158.3	-99.8	-96.6	0	0	0	110.3
310	K	29.3	Very low	34.5	Very low	183 Å²	183	138.1 Å²	138.1	80%	0.796	76%	0.763	S	S	*	*				176.6	113.7	124.6	-95.7	-178.3	179.5	-174.4	0	110.6
311	D	27.2	Very low	32.3	Very low	131 Å²	131	139.2 Å²	139.2	70%	0.701	77%	0.774	S	S	*	*			trans	58.2	102.8	137	-48.8	-30.5	0	0	0	120.3
312	S	26.5	Very low	30.7	Very low	116 Å²	116	141.1 Å²	141.1	81%	0.811	79%	0.785	S	S	*	*				153.7	122.9	109.2	-63.7	0	0	0	0	111.5
313	P	27.1	Very low	29.4	Very low	128 Å²	128	141.7 Å²	141.7	83%	0.831	79%	0.789	S	S	*	*			trans	-99.3	139.3	-175.7	35.8	-29.6	0	0	0	113.3
314	N	26.3	Very low	28.8	Very low	151 Å²	151	145.8 Å²	145.8	81%	0.807	80%	0.801	S	S	*	*			trans	-160.1	102.4	155.7	-129.3	2.9	0	0	0	108.2
315	V	25.7	Very low	27.9	Very low	110 Å²	110	148.6 Å²	148.6	67%	0.667	81%	0.805	S	S	*	*				100.2	118.4	88	159	0	0	0	0	112.8
316	N	26.7	Very low	27.2	Very low	144 Å²	144	154.4 Å²	154.4	77%	0.77	81%	0.809	S	S	*	*			trans	90.7	135.7	146	-75.7	-12.2	0	0	0	124.6
317	S	30.3	Very low	26.8	Very low	109 Å²	109	154.9 Å²	154.9	76%	0.762	81%	0.806	S	S	*	*			trans	70.7	100.3	157.5	61.2	0	0	0	0	116.4
318	R	25.1	Very low	26.6	Very low	227 Å²	227	163.7 Å²	163.7	86%	0.857	82%	0.819	S	S	*	*				60.1	120.6	53.7	-82.8	-172.1	178.3	174.5	0.7	116
319	K	27.4	Very low	26.3	Very low	185 Å²	185	163.4 Å²	163.4	80%	0.804	82%	0.818	S	S	*	*			trans	83.8	108.5	149.6	-66.9	174.6	175.8	-173.8	0	115.9
320	A	25	Very low	26.3	Very low	88 Å²	88	159.4 Å²	159.4	73%	0.727	82%	0.816	S	S	*	*				79.3	109	69	0	0	0	0	0	113.5
321	S	24.4	Very low	26.1	Very low	115 Å²	115	157.8 Å²	157.8	80%	0.804	82%	0.816	S	S	*	*			trans	61.8	114.1	136.6	-47.3	0	0	0	0	119.6
322	Q	28.1	Very low	26.1	Very low	192 Å²	192	159.8 Å²	159.8	90%	0.897	83%	0.825	S	S	*	*				-174.1	131.8	124.3	-102.4	165.2	10	0	0	113.3
323	S	24.4	Very low	26	Very low	108 Å²	108	162.4 Å²	162.4	76%	0.755	83%	0.825	S	S	*	*			trans	-60	143.4	161	144.9	0	0	0	0	110.9
324	I	28.5	Very low	26	Very low	149 Å²	149	161.9 Å²	161.9	76%	0.764	82%	0.821	S	S	*	*			trans	-164.5	122.1	144.3	-89.8	142	0	0	0	108.5
325	M	21.9	Very low	26.1	Very low	181 Å²	181	166.7 Å²	166.7	89%	0.892	83%	0.828	S	S	*	*			trans	-62.3	137.8	162.4	-77.4	172.3	156.9	0	0	110.9
326	R	27.6	Very low	26.1	Very low	243 Å²	243	168.2 Å²	168.2	92%	0.917	83%	0.832	S	S	*	*			trans	-163.4	123.3	145.8	-116.7	171.8	178.1	-179.7	0.1	112.4
327	E	23.4	Very low	25.9	Very low	190 Å²	190	168 Å²	168	89%	0.888	83%	0.826	S	S	*	*			trans	-61.9	141.6	165.5	-62.2	168	135	0	0	111.2
328	R	26.6	Very low	25.6	Very low	251 Å²	251	170.4 Å²	170.4	95%	0.947	82%	0.823	S	S	*	*			trans	-162	119.6	145.1	-109	174.1	-162	-144.5	3.2	110.8
329	R	22.7	Very low	25.6	Very low	250 Å²	250	171.3 Å²	171.3	94%	0.943	83%	0.827	S	S	*	*			trans	-60.5	137.8	164.7	-74.5	171	165.6	167.9	-5.7	110.4
330	A	27.9	Very low	25.4	Very low	97 Å²	97	167.2 Å²	167.2	80%	0.802	82%	0.822	S	S	*	*			trans	-149.4	120.1	151.4	0	0	0	0	0	108.6
331	D	24.3	Very low	25.2	Very low	148 Å²	148	168.5 Å²	168.5	79%	0.791	82%	0.821	S	S	*	*			trans	-61.5	128.5	179	-63.4	-67.5	0	0	0	112.7
332	I	28.3	Very low	25.1	Very low	173 Å²	173	168.1 Å²	168.1	89%	0.887	82%	0.824	S	S	*	*			trans	-138	97.6	149.5	-58.2	-178	0	0	0	106.6
333	Q	24.9	Very low	24.9	Very low	172 Å²	172	163.7 Å²	163.7	80%	0.804	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-80.4	159	174.2	-88.8	-169.1	-2.4	0	0	112.1
334	P	26.3	Very low	25	Very low	116 Å²	116	163.6 Å²	163.6	75%	0.753	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-87.8	145.5	-163.8	16.8	-0.3	0	0	0	112.8
335	R	28.9	Very low	24.7	Very low	253 Å²	253	163.4 Å²	163.4	96%	0.955	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-82.4	138.6	178.7	-102.2	-179.2	175	171.6	-1.5	112.8
336	D	26.3	Very low	24.8	Very low	142 Å²	142	163.3 Å²	163.3	76%	0.759	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-66.6	141.7	-172.1	-67.7	-62.5	0	0	0	117.2
337	E	22.1	Very low	24.7	Very low	138 Å²	138	156.4 Å²	156.4	65%	0.645	82%	0.818	S	S	*	*				25.5	135.4	127.8	-68.9	-162.8	137.9	0	0	123
338	K	23.8	Very low	24.7	Very low	161 Å²	161	153.4 Å²	153.4	70%	0.7	81%	0.813	S	S	*	*			trans	76.5	114	139	-69.9	162.2	-174.2	155.8	0	119.1
339	R	24.4	Very low	24.5	Very low	245 Å²	245	148 Å²	148	93%	0.925	81%	0.807	S	S	*	*				-174.5	109.6	128.9	-98	156.2	-173.5	-159.6	2.7	108.4
340	S	23.1	Very low	24.6	Very low	100 Å²	100	140.8 Å²	140.8	70%	0.699	80%	0.795	S	S	*	*				86.4	98.2	86.1	-153.9	0	0	0	0	112.3
341	T	22	Very low	24.3	Very low	115 Å²	115	145.3 Å²	145.3	71%	0.706	80%	0.797	S	S	*	*				43.6	107.3	129.9	57	0	0	0	0	119	A343	T341-A343 PolarHBondContact O-N 3.19Å
342	A	21.2	Very low	24.4	Very low	107 Å²	107	145.4 Å²	145.4	88%	0.884	80%	0.797	S	S	*	*				41.7	80.6	122.9	0	0	0	0	0	116.3
343	A	24.3	Very low	24.1	Very low	99 Å²	99	145.9 Å²	145.9	82%	0.818	80%	0.795	S	S	*	*			trans	-132.6	85.7	159.1	0	0	0	0	0	108.7	T341	T341-A343 PolarHBondContact O-N 3.19Å
344	A	25.8	Very low	23.9	Very low	105 Å²	105	149.7 Å²	149.7	87%	0.868	80%	0.802	S	S	*	*			trans	-155.8	70.3	153.5	0	0	0	0	0	106.8
345	L	22.4	Very low	23.8	Very low	146 Å²	146	153 Å²	153	76%	0.764	81%	0.808	S	S	*	*			trans	-76.8	145.4	167.7	-89.7	160.8	0	0	0	109.2
346	Q	23.6	Very low	24	Very low	179 Å²	179	146 Å²	146	84%	0.836	80%	0.795	S	S	*	*			trans	74.4	110.7	146.8	-69.2	170.6	-11.4	0	0	120
347	A	25.6	Very low	23.9	Very low	97 Å²	97	148.3 Å²	148.3	80%	0.802	80%	0.798	S	S	*	*			trans	-168.1	140.3	144.8	0	0	0	0	0	106.8
348	V	25	Very low	23.9	Very low	128 Å²	128	147.7 Å²	147.7	78%	0.776	80%	0.8	S	S	*	*			cis	-159.6	142.9	-2.8	141.6	0	0	0	0	104.9
349	V	21.7	Very low	23.9	Very low	137 Å²	137	147 Å²	147	83%	0.83	80%	0.799	S	S	*	*			trans	-73.6	131.8	170	169.6	0	0	0	0	109.9
350	S	25.1	Very low	23.8	Very low	98 Å²	98	144 Å²	144	69%	0.685	79%	0.793	S	S	*	*			trans	-166.7	109.4	160.1	-76.8	0	0	0	0	108.4
351	K	22.2	Very low	23.7	Very low	193 Å²	193	145.2 Å²	145.2	84%	0.839	80%	0.799	S	S	*	*				91.2	120.5	81.9	-92.2	-172.9	176.2	-179.1	0	113.2
352	D	25.4	Very low	23.7	Very low	149 Å²	149	143 Å²	143	80%	0.797	80%	0.8	S	S	*	*			trans	127.2	96.8	151.6	-79.2	-8.3	0	0	0	112.2
353	Q	21.2	Very low	23.7	Very low	183 Å²	183	146.9 Å²	146.9	86%	0.855	80%	0.802	S	S	*	*				55	84.3	64.6	-66	-166	3.1	0	0	114.7
354	R	21.5	Very low	23.7	Very low	253 Å²	253	148.5 Å²	148.5	96%	0.955	80%	0.802	S	S	*	*			trans	-145.4	107.8	131.9	-67.8	-164.1	-173	175.4	2.4	110.3
355	Q	25.1	Very low	23.5	Very low	185 Å²	185	149.4 Å²	149.4	86%	0.864	80%	0.799	S	S	*	*			trans	-86.6	-175.1	151	-79.1	-175.8	-5.8	0	0	108.3
356	P	32.4	Very low	23.5	Very low	107 Å²	107	148.4 Å²	148.4	70%	0.695	80%	0.804	S	S	*	*			cis	-130.2	166	-40.2	30.4	-14	0	0	0	110.8
357	K	23.2	Very low	23.5	Very low	189 Å²	189	150.9 Å²	150.9	82%	0.822	81%	0.806	S	S	*	*			trans	-155.1	113.5	147.5	-89.3	-161.1	178.4	175.5	0	111.6
358	D	23.9	Very low	23.4	Very low	126 Å²	126	154 Å²	154	67%	0.674	81%	0.807	S	S	*	*			trans	59.7	97.9	131.4	-48.1	-29.4	0	0	0	118.1
359	E	22.3	Very low	23.4	Very low	146 Å²	146	152.5 Å²	152.5	68%	0.682	81%	0.809	S	S	*	*				73.9	100.4	87.6	-71.8	-149.6	131.5	0	0	113.5
360	K	22.2	Very low	23.5	Very low	183 Å²	183	152.4 Å²	152.4	80%	0.796	81%	0.808	S	S	*	*				64.6	95.3	105.2	-68.5	176.2	-168.4	150.9	0	113.7
361	C	21	Very low	23.7	Very low	124 Å²	124	151 Å²	151	84%	0.838	81%	0.809	S	S	*	*			trans	-114.9	101.1	144.7	-162.2	0	0	0	0	107.6
362	G	21.6	Very low	23.9	Very low	70 Å²	70	147.4 Å²	147.4	72%	0.722	81%	0.806	S	S	*	*			trans	-76.8	130.5	167.4	0	0	0	0	0	109.3
363	M	22.4	Very low	24.1	Very low	187 Å²	187	147.6 Å²	147.6	92%	0.921	81%	0.807	S	S	*	*			trans	-129.5	111.5	154.9	-85.2	-165.6	150	0	0	108.6
364	T	23.3	Very low	24.4	Very low	133 Å²	133	143.2 Å²	143.2	82%	0.816	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-66.7	155.3	176.9	39.3	0	0	0	0	112.5
365	P	23	Very low	24.6	Very low	125 Å²	125	141.9 Å²	141.9	81%	0.812	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-81.5	123.2	-169.5	32.7	-32.2	0	0	0	111.4
366	S	22.9	Very low	24.5	Very low	124 Å²	124	141.3 Å²	141.3	87%	0.867	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-88.1	131	171	-165.8	0	0	0	0	111.2
367	R	22.8	Very low	24	Very low	231 Å²	231	142 Å²	142	87%	0.872	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-60.9	137.6	-174.4	-71.6	164.6	169.2	166.8	-4.2	112.4	A369	R367-A369 PolarHBondContact O-N 3.34Å
368	I	23.7	Very low	24	Very low	163 Å²	163	139.3 Å²	139.3	84%	0.836	81%	0.809	S	S	*	*			trans	-71.9	111.6	162.9	-66.6	167.4	0	0	0	107.2
369	A	25	Very low	24	Very low	97 Å²	97	137.5 Å²	137.5	80%	0.802	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-85.4	119	170.4	0	0	0	0	0	109.1	R367	R367-A369 PolarHBondContact O-N 3.34Å
370	T	23.9	Very low	24	Very low	134 Å²	134	136.2 Å²	136.2	82%	0.822	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-82.4	118	171	37.7	0	0	0	0	109.6
371	G	29.2	Very low	24.1	Very low	69 Å²	69	132 Å²	132	71%	0.711	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-94.4	127.5	164.8	0	0	0	0	0	110.1	N373	G371-N373 PolarHBondContact O-N 2.79Å
372	P	26.5	Very low	24.4	Very low	117 Å²	117	137.6 Å²	137.6	76%	0.76	82%	0.816	S	S	*	*	S	Bend	trans	-86.5	108.9	-175	32.5	-28.5	0	0	0	109.4
373	N	29.8	Very low	24.6	Very low	153 Å²	153	145.6 Å²	145.6	82%	0.818	82%	0.824	S	S	*	*			trans	-178.2	15.1	143.1	-94.2	-13.9	0	0	0	115.5	G371 R375	G371-N373 PolarHBondContact O-N 2.79Å; N373-R375 PolarHBondContact O-N 3.45Å
374	G	27.1	Very low	24.8	Very low	91 Å²	91	146.3 Å²	146.3	94%	0.938	83%	0.825	S	S	*	*			trans	47.2	26.3	145.7	0	0	0	0	0	118.6
375	R	24.4	Very low	25	Very low	225 Å²	225	144.2 Å²	144.2	85%	0.849	82%	0.822	S	S	*	*			trans	-122.9	107.3	-178.8	-110.9	179.2	173	173.7	-1.8	109.1	N373 V377	N373-R375 PolarHBondContact O-N 3.45Å; R375-V377 PolarHBondContact O-N 3.39Å
376	L	23.2	Very low	25.2	Very low	173 Å²	173	145.3 Å²	145.3	91%	0.906	82%	0.821	S	S	*	*			trans	-65.5	91.4	174.1	-163.2	75.9	0	0	0	108.3
377	V	22.7	Very low	25.7	Very low	123 Å²	123	145 Å²	145	75%	0.745	82%	0.816	S	S	*	*			trans	-84.1	117.7	173.8	179.9	0	0	0	0	108.4	R375 A379	R375-V377 PolarHBondContact O-N 3.39Å; V377-A379 PolarHBondContact O-N 3.34Å
378	T	22.9	Very low	26.4	Very low	132 Å²	132	139.2 Å²	139.2	81%	0.81	81%	0.808	S	S	*	*			trans	-66.5	84.4	177.5	37	0	0	0	0	111	S380	T378-S380 PolarHBondContact O-N 2.85Å; T378-S380 VanDerWaalsContact O-N 3.1Å
379	A	23.5	Very low	27	Very low	88 Å²	88	136 Å²	136	73%	0.727	81%	0.806	S	S	*	*			trans	-84.2	80.1	-178.2	0	0	0	0	0	112.2	V377 S381	V377-A379 PolarHBondContact O-N 3.34Å; A379-S381 VanDerWaalsContact C-N 3.34Å
380	S	23.9	Very low	27.8	Very low	118 Å²	118	140 Å²	140	83%	0.825	81%	0.808	S	S	*	*			trans	-93.8	71.5	148.4	-78.3	0	0	0	0	108.2	T378	T378-S380 PolarHBondContact O-N 2.85Å; T378-S380 VanDerWaalsContact O-N 3.1Å
381	S	23.8	Very low	28.9	Very low	96 Å²	96	142.3 Å²	142.3	67%	0.671	80%	0.802	S	S	*	*			trans	-172.9	131.6	163.9	-87.7	0	0	0	0	110.5	A379	A379-S381 VanDerWaalsContact C-N 3.34Å
382	R	25.9	Very low	30	Very low	241 Å²	241	146 Å²	146	91%	0.909	80%	0.8	S	S	*	*			trans	81.8	104.1	165.9	-51.7	175.3	-165	-142	2.8	116
383	R	25.9	Very low	31.7	Very low	237 Å²	237	141.4 Å²	141.4	89%	0.894	77%	0.771	S	S	*	*				-159.8	119.4	89.8	-91.8	173.8	-174.2	-153.3	-0.1	107.5	A385	R383-A385 PolarHBondContact O-N 3.45Å
384	E	27.6	Very low	33.3	Very low	202 Å²	202	138.7 Å²	138.7	94%	0.944	76%	0.756	S	S	*	*			trans	-56.3	97.7	156.1	-73.1	167.6	151.8	0	0	105.6
385	A	27.1	Very low	35	Very low	90 Å²	90	136 Å²	136	74%	0.744	72%	0.721	S	S	*	*			trans	-84.1	128.2	164.5	0	0	0	0	0	105.8	R383	R383-A385 PolarHBondContact O-N 3.45Å
386	D	27.9	Very low	36.9	Very low	148 Å²	148	127.1 Å²	127.1	79%	0.791	69%	0.693	S	S	*	*			trans	-42.7	145.9	178.1	-73.7	-51.5	0	0	0	112.7
387	P	32.6	Very low	38.7	Very low	116 Å²	116	120.3 Å²	120.3	75%	0.753	67%	0.665	S	S	*	*			trans	-56.4	123.7	-175.3	22.3	-31.8	0	0	0	109.7	A389	P387-A389 PolarHBondContact O-N 3.37Å
388	P	38.3	Very low	40.5	Very low	111 Å²	111	124.9 Å²	124.9	72%	0.721	67%	0.669	S	S	*	*			trans	-62	129.2	-176.3	21.8	-29.5	0	0	0	109.7
389	A	35.5	Very low	42.3	Very low	94 Å²	94	121.5 Å²	121.5	78%	0.777	64%	0.644	S	S	*	*	S	Bend	trans	-44.7	150.1	172.4	0	0	0	0	0	112.2	P387	P387-A389 PolarHBondContact O-N 3.37Å
390	E	41.7	Very low	43.8	Very low	183 Å²	183	121.7 Å²	121.7	86%	0.855	64%	0.636	S	S	*	*	S	Bend	trans	-3.1	115.7	173.4	-74.7	177.2	148.7	0	0	116.4	Q392	E390-Q392 VanDerWaalsContact C-N 3.3Å; E390-Q392 PolarHBondContact O-N 2.89Å
391	R	48.3	Very low	45.3	Very low	182 Å²	182	120.8 Å²	120.8	69%	0.687	62%	0.621	S	S	*	*			trans	-53.3	75.1	-175.4	-60.5	173.7	-176.8	-178.6	2.6	113.8	T400	R391-T400 HydrophobicContact CB-CG2 3.28Å; R391-T400 HydrophobicContact CG-CG2 4.08Å; R391-T400 WeakPolarHBondContact O-CG2 3.19Å
392	Q	52.3	Low	47.1	Very low	145 Å²	145	121.8 Å²	121.8	68%	0.678	62%	0.618	S	S	*	*			trans	-79.1	137	164	-77.4	-176.8	-0.4	0	0	110.3	E390 L394 G397	E390-Q392 VanDerWaalsContact C-N 3.3Å; E390-Q392 PolarHBondContact O-N 2.89Å; Q392-L394 PolarHBondContact O-N 2.82Å; Q392-G397 WeakPolarHBondContact CB-O 3.37Å; Q392-G397 VanDerWaalsContact CD-O 3.24Å; Q392-G397 VanDerWaalsContact CG-O 3.28Å; Q392-G397 WeakPolarHBondContact CG-O 3.5Å; Q392-G397 PolarHBondContact OE1-O 3.19Å
393	C	60.9	Low	49.2	Very low	22 Å²	22	110.6 Å²	110.6	15%	0.149	58%	0.577	C	S	.	*			trans	-59	119.4	176.8	177.7	0	0	0	0	110.1	V395 C396 G397 H399 C403	C393-V395 PolarHBondContact O-N 3.01Å; C393-V395 VanDerWaalsContact SG-CB 3.52Å; C393-V395 PolarHBondContact SG-N 3.26Å; C393-C396 PolarHBondContact O-N 3.47Å; C393-G397 WeakPolarHBondContact O-CA 3.44Å; C393-G397 PolarHBondContact O-N 3.49Å; C393-H399 WeakPolarHBondContact CA-O 3.42Å; C393-H399 WeakPolarHBondContact CB-O 3.41Å; C393-H399 PolarHBondContact N-O 3.48Å; C393-C403 WeakPolarHBondContact SG-CB 3.33Å
394	L	63.4	Low	51.4	Low	96 Å²	96	103.4 Å²	103.4	50%	0.503	56%	0.561	S	S	.	*	T	Hydrogen-bonded Turn	trans	-64.7	-6.3	175.5	-66.1	176.3	0	0	0	114.7	Q392 T421 L423 V430	Q392-L394 PolarHBondContact O-N 2.82Å; L394-T421 HydrophobicContact CB-CG2 4.28Å; L394-L423 HydrophobicContact CD1-CD2 4.17Å; L394-V430 HydrophobicContact CD1-CG1 3.29Å
395	V	62.8	Low	53.5	Low	34 Å²	34	97.6 Å²	97.6	21%	0.206	54%	0.539	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-36.3	179.4	-172.8	0	0	0	0	112.2	C393 C403 F406 K417	C393-V395 PolarHBondContact O-N 3.01Å; C393-V395 VanDerWaalsContact SG-CB 3.52Å; C393-V395 PolarHBondContact SG-N 3.26Å; V395-C403 HydrophobicContact CB-CB 4.42Å; V395-F406 HydrophobicContact CB-CB 4.25Å; V395-F406 HydrophobicContact CG1-CB 3.91Å; V395-F406 HydrophobicContact CG1-CD2 4.23Å; V395-F406 HydrophobicContact CG2-CB 4.03Å; V395-F406 HydrophobicContact CG2-CD2 3.67Å; V395-F406 HydrophobicContact CG2-CE2 4.49Å; V395-F406 HydrophobicContact CG2-CG 4.1Å; V395-K417 HydrophobicContact CG2-CG 4.47Å
396	C	64.2	Low	56	Low	39 Å²	39	93.8 Å²	93.8	26%	0.264	51%	0.506	S	S	.	.	T	Hydrogen-bonded Turn	trans	-136.6	-3.8	-177.6	68.9	0	0	0	0	115.1	C393 R398 H399	C393-C396 PolarHBondContact O-N 3.47Å; C396-R398 PolarHBondContact O-N 3Å; C396-H399 PolarHBondContact SG-CE1 3.28Å; C396-H399 PolarHBondContact SG-NE2 2.88Å
397	G	61.6	Low	58.4	Low	30 Å²	30	89.9 Å²	89.9	31%	0.309	48%	0.484	S	S	.	.	S	Bend	trans	81.1	-3.8	179.3	0	0	0	0	0	116.7	Q392 C393	Q392-G397 WeakPolarHBondContact CB-O 3.37Å; Q392-G397 VanDerWaalsContact CD-O 3.24Å; Q392-G397 VanDerWaalsContact CG-O 3.28Å; Q392-G397 WeakPolarHBondContact CG-O 3.5Å; Q392-G397 PolarHBondContact OE1-O 3.19Å; C393-G397 WeakPolarHBondContact O-CA 3.44Å; C393-G397 PolarHBondContact O-N 3.49Å
398	R	59.9	Low	60.5	Low	219 Å²	219	88.3 Å²	88.3	83%	0.826	48%	0.481	S	S	*	.	S	Bend	trans	-113.9	-17.8	-161.6	-62.7	-176.8	-165.3	-171.2	2.8	118.7	C396	C396-R398 PolarHBondContact O-N 3Å
399	H	60.8	Low	62.3	Low	61 Å²	61	84.8 Å²	84.8	28%	0.282	46%	0.458	S	S	.	.			trans	-147.8	168.7	-172.3	27	80.2	0	0	0	114.1	C393 C396 C403 P404	C393-H399 WeakPolarHBondContact CA-O 3.42Å; C393-H399 WeakPolarHBondContact CB-O 3.41Å; C393-H399 PolarHBondContact N-O 3.48Å; C396-H399 PolarHBondContact SG-CE1 3.28Å; C396-H399 PolarHBondContact SG-NE2 2.88Å; H399-C403 VanDerWaalsContact CE1-CA 3.44Å; H399-C403 WeakPolarHBondContact CE1-CA 3.27Å; H399-P404 WeakPolarHBondContact CE1-CD 3.48Å
400	T	55.6	Low	64.4	Low	91 Å²	91	83.5 Å²	83.5	56%	0.558	44%	0.442	S	S	*	.	S	Bend	trans	-91.6	-32.9	-164.2	-6.6	0	0	0	0	114.5	R391	R391-T400 HydrophobicContact CB-CG2 3.28Å; R391-T400 HydrophobicContact CG-CG2 4.08Å; R391-T400 WeakPolarHBondContact O-CG2 3.19Å
401	L	55.6	Low	66.3	Low	99 Å²	99	76.3 Å²	76.3	52%	0.518	41%	0.41	S	S	.	.	S	Bend	trans	-148.6	154.5	-179.5	-89.9	110.7	0	0	0	109.7
402	L	60.9	Low	67.7	Low	117 Å²	117	72.1 Å²	72.1	61%	0.613	40%	0.398	S	S	*	.			trans	56.7	59.7	172.6	-63.1	167	0	0	0	115.1	P404 I407 L455	L402-P404 WeakPolarHBondContact O-CD 3.43Å; L402-I407 HydrophobicContact CB-CD1 4.12Å; L402-I407 HydrophobicContact CD2-CD1 4.17Å; L402-L455 HydrophobicContact CD2-CD1 4.11Å
403	C	69.6	Low	69	Low	7 Å²	7	70.5 Å²	70.5	5%	0.047	39%	0.391	C	S	.	.			trans	-62.2	120.8	176.8	173.3	0	0	0	0	112.4	C393 V395 H399 T405 F406 I407	C393-C403 WeakPolarHBondContact SG-CB 3.33Å; V395-C403 HydrophobicContact CB-CB 4.42Å; H399-C403 VanDerWaalsContact CE1-CA 3.44Å; H399-C403 WeakPolarHBondContact CE1-CA 3.27Å; C403-T405 PolarHBondContact O-N 3.02Å; C403-T405 VanDerWaalsContact SG-CB 3.55Å; C403-T405 PolarHBondContact SG-N 2.94Å; C403-F406 HydrophobicContact CB-CB 3.78Å; C403-F406 WeakPolarHBondContact O-CB 3.44Å; C403-F406 PolarHBondContact O-N 2.79Å; C403-F406 PolarHBondContact SG-N 3.32Å; C403-F406 VanDerWaalsContact SG-N 3.4Å; C403-I407 WeakPolarHBondContact O-CG1 3.17Å; C403-I407 PolarHBondContact O-N 2.84Å
404	P	72.6	Confident	70.2	Confident	85 Å²	85	71.2 Å²	71.2	55%	0.552	39%	0.39	S	S	*	.	H	α-helix	trans	-57.5	-38.6	178	-24.8	34.5	0	0	0	111.9	H399 L402 F406 I407 A408	H399-P404 WeakPolarHBondContact CE1-CD 3.48Å; L402-P404 WeakPolarHBondContact O-CD 3.43Å; P404-F406 VanDerWaalsContact C-N 3.34Å; P404-F406 PolarHBondContact O-N 2.84Å; P404-I407 PolarHBondContact O-N 3.2Å; P404-A408 VanDerWaalsContact O-CB 3.25Å; P404-A408 WeakPolarHBondContact O-CB 3.48Å; P404-A408 PolarHBondContact O-N 3.36Å
405	T	72.8	Confident	71.3	Confident	80 Å²	80	69.7 Å²	69.7	49%	0.491	38%	0.378	S	S	.	.	H	α-helix	trans	-62	-39.9	176	-30.6	0	0	0	0	112.2	C403 A408 T409	C403-T405 PolarHBondContact O-N 3.02Å; C403-T405 VanDerWaalsContact SG-CB 3.55Å; C403-T405 PolarHBondContact SG-N 2.94Å; T405-A408 PolarHBondContact O-N 3.33Å; T405-T409 PolarHBondContact O-N 2.89Å; T405-T409 VanDerWaalsContact O-N 3.16Å; T405-T409 PolarHBondContact O-OG1 2.94Å
406	F	79	Confident	72.1	Confident	10 Å²	10	74.4 Å²	74.4	4%	0.044	40%	0.396	C	S	.	.	H	α-helix	trans	-69.3	-43.2	177.4	-173.5	-106.6	0	0	0	111.4	V395 C403 P404 A408 T409 R414 K417 C418 L428 L455 L456	V395-F406 HydrophobicContact CB-CB 4.25Å; V395-F406 HydrophobicContact CG1-CB 3.91Å; V395-F406 HydrophobicContact CG1-CD2 4.23Å; V395-F406 HydrophobicContact CG2-CB 4.03Å; V395-F406 HydrophobicContact CG2-CD2 3.67Å; V395-F406 HydrophobicContact CG2-CE2 4.49Å; V395-F406 HydrophobicContact CG2-CG 4.1Å; C403-F406 HydrophobicContact CB-CB 3.78Å; C403-F406 WeakPolarHBondContact O-CB 3.44Å; C403-F406 PolarHBondContact O-N 2.79Å; C403-F406 PolarHBondContact SG-N 3.32Å; C403-F406 VanDerWaalsContact SG-N 3.4Å; P404-F406 VanDerWaalsContact C-N 3.34Å; P404-F406 PolarHBondContact O-N 2.84Å; F406-A408 VanDerWaalsContact C-N 3.29Å; F406-A408 PolarHBondContact O-N 3.05Å; F406-T409 WeakPolarHBondContact CA-OG1 3.43Å; F406-T409 PolarHBondContact O-N 2.79Å; F406-T409 PolarHBondContact O-OG1 3.19Å; F406-R414 HydrophobicContact CD1-CG 4.46Å; F406-R414 HydrophobicContact CD2-CG 4.26Å; F406-R414 HydrophobicContact CE1-CB 4.23Å; F406-R414 HydrophobicContact CE1-CG 4.12Å; F406-R414 HydrophobicContact CE2-CB 3.75Å; F406-R414 HydrophobicContact CE2-CG 3.91Å; F406-R414 HydrophobicContact CZ-CB 3.55Å; F406-R414 HydrophobicContact CZ-CG 3.83Å; F406-R414 WeakPolarHBondContact O-CD 3.38Å; F406-R414 WeakPolarHBondContact O-CG 3.44Å; F406-R414 PolarHBondContact O-NE 3.12Å; F406-K417 HydrophobicContact CE2-CB 4.31Å; F406-C418 VanDerWaalsContact CZ-SG 3.53Å; F406-L428 HydrophobicContact CE1-CD1 3.87Å; F406-L455 HydrophobicContact CD1-CD1 4.33Å; F406-L455 HydrophobicContact CE1-CB 4.43Å; F406-L455 HydrophobicContact CE1-CD1 4.4Å; F406-L456 HydrophobicContact CZ-CD2 4.29Å
407	I	78.6	Confident	72.8	Confident	66 Å²	66	76.3 Å²	76.3	34%	0.338	40%	0.399	S	S	.	.	H	α-helix	trans	-65	-35.5	176.3	-63.5	167	0	0	0	110.3	L402 C403 P404 R414 L455	L402-I407 HydrophobicContact CB-CD1 4.12Å; L402-I407 HydrophobicContact CD2-CD1 4.17Å; C403-I407 WeakPolarHBondContact O-CG1 3.17Å; C403-I407 PolarHBondContact O-N 2.84Å; P404-I407 PolarHBondContact O-N 3.2Å; I407-R414 PolarHBondContact O-NH2 3.27Å; I407-L455 HydrophobicContact CG1-CD1 4.01Å; I407-L455 HydrophobicContact CG1-CD2 4.12Å
408	A	75.4	Confident	73.9	Confident	83 Å²	83	74.9 Å²	74.9	69%	0.686	39%	0.385	S	S	*	.	H	α-helix	trans	-72.1	-26.8	177.1	0	0	0	0	0	113.2	P404 T405 F406	P404-A408 VanDerWaalsContact O-CB 3.25Å; P404-A408 WeakPolarHBondContact O-CB 3.48Å; P404-A408 PolarHBondContact O-N 3.36Å; T405-A408 PolarHBondContact O-N 3.33Å; F406-A408 VanDerWaalsContact C-N 3.29Å; F406-A408 PolarHBondContact O-N 3.05Å
409	T	76.3	Confident	74.9	Confident	37 Å²	37	70.9 Å²	70.9	23%	0.227	37%	0.373	C	S	.	.	S	Bend	trans	-67.9	143.9	177.5	14.9	0	0	0	0	112.8	T405 F406 Q413 R414	T405-T409 PolarHBondContact O-N 2.89Å; T405-T409 VanDerWaalsContact O-N 3.16Å; T405-T409 PolarHBondContact O-OG1 2.94Å; F406-T409 WeakPolarHBondContact CA-OG1 3.43Å; F406-T409 PolarHBondContact O-N 2.79Å; F406-T409 PolarHBondContact O-OG1 3.19Å; T409-Q413 HydrophobicContact CG2-CB 4.14Å; T409-R414 VanDerWaalsContact O-CZ 3.26Å; T409-R414 PolarHBondContact O-NE 3.47Å; T409-R414 PolarHBondContact O-NH2 3.37Å; T409-R414 VanDerWaalsContact O-NH2 3.1Å
410	P	80.6	Confident	75.7	Confident	68 Å²	68	73.7 Å²	73.7	44%	0.442	39%	0.386	S	S	.	.			trans	-56.6	149.7	172.5	-23.8	33	0	0	0	112.8	E412 Q413 R414	P410-E412 VanDerWaalsContact C-N 3.28Å; P410-E412 PolarHBondContact O-N 3.13Å; P410-Q413 WeakPolarHBondContact O-CA 3.26Å; P410-Q413 WeakPolarHBondContact O-CB 3.35Å; P410-Q413 PolarHBondContact O-N 3.3Å; P410-R414 PolarHBondContact O-N 2.59Å
411	V	81.6	Confident	76.6	Confident	31 Å²	31	70.9 Å²	70.9	19%	0.188	37%	0.369	C	S	.	.	H	α-helix	trans	-56.1	-39.4	-174.9	177.3	0	0	0	0	112.2	Q413 R414 W415 R458	V411-Q413 VanDerWaalsContact C-N 3.32Å; V411-Q413 PolarHBondContact O-N 2.91Å; V411-R414 WeakPolarHBondContact O-CB 3.45Å; V411-R414 PolarHBondContact O-N 3.33Å; V411-W415 VanDerWaalsContact O-CD1 3.31Å; V411-W415 PolarHBondContact O-N 3.11Å; V411-R458 HydrophobicContact CG1-CB 4.41Å; V411-R458 HydrophobicContact CG1-CG 4.4Å
412	E	77.2	Confident	77.6	Confident	95 Å²	95	76.2 Å²	76.2	44%	0.444	38%	0.383	S	S	.	.	H	α-helix	trans	-57.6	-43.3	174.2	-74.3	73.1	-156.1	0	0	112.7	P410 W415 K416 R458	P410-E412 VanDerWaalsContact C-N 3.28Å; P410-E412 PolarHBondContact O-N 3.13Å; E412-W415 PolarHBondContact O-N 3.07Å; E412-K416 PolarHBondContact O-N 3.08Å; E412-K416 VanDerWaalsContact O-N 3.12Å; E412-R458 VanDerWaalsContact CG-NH2 3.26Å; E412-R458 IonicContact OE1-CZ 2.83Å; E412-R458 IonicContact OE1-NE 2.87Å; E412-R458 PolarHBondContact OE1-NE 3.27Å; E412-R458 IonicContact OE1-NH2 3.26Å; E412-R458 PolarHBondContact OE1-NH2 3.29Å
413	Q	79.8	Confident	78.8	Confident	111 Å²	111	71.7 Å²	71.7	52%	0.519	36%	0.359	S	S	.	.	H	α-helix	trans	-72.2	-33.8	179.3	-65.1	-173.5	8.8	0	0	111.2	T409 P410 V411 K416 K417	T409-Q413 HydrophobicContact CG2-CB 4.14Å; P410-Q413 WeakPolarHBondContact O-CA 3.26Å; P410-Q413 WeakPolarHBondContact O-CB 3.35Å; P410-Q413 PolarHBondContact O-N 3.3Å; V411-Q413 VanDerWaalsContact C-N 3.32Å; V411-Q413 PolarHBondContact O-N 2.91Å; Q413-K416 PolarHBondContact O-N 2.7Å; Q413-K417 VanDerWaalsContact O-CB 3.32Å; Q413-K417 WeakPolarHBondContact O-CB 3.4Å; Q413-K417 PolarHBondContact O-N 3.06Å
414	R	85.9	Confident	79.5	Confident	36 Å²	36	71.5 Å²	71.5	14%	0.136	36%	0.358	C	S	.	.	H	α-helix	trans	-60.5	-46	171.9	-64.5	-178	-159.1	151.7	8.9	111.5	F406 I407 T409 P410 V411 K416 K417 C418 L455 L456	F406-R414 HydrophobicContact CD1-CG 4.46Å; F406-R414 HydrophobicContact CD2-CG 4.26Å; F406-R414 HydrophobicContact CE1-CB 4.23Å; F406-R414 HydrophobicContact CE1-CG 4.12Å; F406-R414 HydrophobicContact CE2-CB 3.75Å; F406-R414 HydrophobicContact CE2-CG 3.91Å; F406-R414 HydrophobicContact CZ-CB 3.55Å; F406-R414 HydrophobicContact CZ-CG 3.83Å; F406-R414 WeakPolarHBondContact O-CD 3.38Å; F406-R414 WeakPolarHBondContact O-CG 3.44Å; F406-R414 PolarHBondContact O-NE 3.12Å; I407-R414 PolarHBondContact O-NH2 3.27Å; T409-R414 VanDerWaalsContact O-CZ 3.26Å; T409-R414 PolarHBondContact O-NE 3.47Å; T409-R414 PolarHBondContact O-NH2 3.37Å; T409-R414 VanDerWaalsContact O-NH2 3.1Å; P410-R414 PolarHBondContact O-N 2.59Å; V411-R414 WeakPolarHBondContact O-CB 3.45Å; V411-R414 PolarHBondContact O-N 3.33Å; R414-K416 VanDerWaalsContact C-N 3.35Å; R414-K416 PolarHBondContact O-N 3.35Å; R414-K417 PolarHBondContact O-N 3.21Å; R414-C418 WeakPolarHBondContact O-CB 3.33Å; R414-C418 PolarHBondContact O-N 3.14Å; R414-C418 PolarHBondContact O-SG 2.98Å; R414-L455 VanDerWaalsContact CD-O 3.26Å; R414-L455 WeakPolarHBondContact CD-O 3.49Å; R414-L455 PolarHBondContact NH1-O 3.48Å; R414-L456 HydrophobicContact CB-CD2 3.73Å
415	W	86.2	Confident	80.3	Confident	64 Å²	64	70.3 Å²	70.3	24%	0.242	34%	0.344	C	S	.	.	H	α-helix	trans	-58.5	-45.6	175	-87.7	101.7	0	0	0	112.3	V411 E412 C418 K419 F425 H452 L456	V411-W415 VanDerWaalsContact O-CD1 3.31Å; V411-W415 PolarHBondContact O-N 3.11Å; E412-W415 PolarHBondContact O-N 3.07Å; W415-C418 PolarHBondContact O-N 3.35Å; W415-K419 WeakPolarHBondContact O-CG 3.42Å; W415-K419 PolarHBondContact O-N 2.87Å; W415-K419 VanDerWaalsContact O-N 3.13Å; W415-F425 HydrophobicContact CE3-CD1 4.38Å; W415-F425 HydrophobicContact CE3-CE1 4.42Å; W415-F425 HydrophobicContact CH2-CG 4.47Å; W415-F425 HydrophobicContact CZ3-CB 4.39Å; W415-F425 HydrophobicContact CZ3-CD1 4.01Å; W415-F425 HydrophobicContact CZ3-CD2 4.01Å; W415-F425 HydrophobicContact CZ3-CE1 4.3Å; W415-F425 HydrophobicContact CZ3-CE2 4.29Å; W415-F425 AromaticContact CZ3-CG 3.88Å; W415-F425 HydrophobicContact CZ3-CG 3.88Å; W415-F425 HydrophobicContact CZ3-CZ 4.43Å; W415-H452 HydrophobicContact CH2-CB 4.15Å; W415-H452 HydrophobicContact CZ2-CB 4.25Å; W415-H452 AromaticContact CZ2-ND1 3.85Å; W415-L456 HydrophobicContact CD2-CD2 4.34Å; W415-L456 HydrophobicContact CG-CD2 4.27Å; W415-L456 HydrophobicContact CH2-CD1 4.43Å; W415-L456 HydrophobicContact CZ2-CB 3.89Å; W415-L456 HydrophobicContact CZ2-CD1 4.44Å; W415-L456 HydrophobicContact CZ3-CD1 4.48Å; W415-L456 PolarHBondContact NE1-O 2.9Å
416	K	80	Confident	80.9	Confident	134 Å²	134	69.3 Å²	69.3	58%	0.583	33%	0.331	S	S	*	.	H	α-helix	trans	-63.1	-45.9	178.2	-160.5	-179.6	179	-177.9	0	111	E412 Q413 R414 C418 K419 E420	E412-K416 PolarHBondContact O-N 3.08Å; E412-K416 VanDerWaalsContact O-N 3.12Å; Q413-K416 PolarHBondContact O-N 2.7Å; R414-K416 VanDerWaalsContact C-N 3.35Å; R414-K416 PolarHBondContact O-N 3.35Å; K416-C418 PolarHBondContact O-N 3.1Å; K416-K419 WeakPolarHBondContact O-CB 3.5Å; K416-K419 PolarHBondContact O-N 3.04Å; K416-E420 WeakPolarHBondContact CE-OE1 3.47Å; K416-E420 WeakPolarHBondContact O-CG 3.42Å; K416-E420 PolarHBondContact O-N 3.44Å
417	K	79.3	Confident	81.2	Confident	78 Å²	78	69.1 Å²	69.1	34%	0.339	33%	0.331	S	S	.	.	H	α-helix	trans	-62.4	-42.8	178.1	-163.2	72.1	175.3	-178	0	112.1	V395 F406 Q413 R414 K419 E420 T421	V395-K417 HydrophobicContact CG2-CG 4.47Å; F406-K417 HydrophobicContact CE2-CB 4.31Å; Q413-K417 VanDerWaalsContact O-CB 3.32Å; Q413-K417 WeakPolarHBondContact O-CB 3.4Å; Q413-K417 PolarHBondContact O-N 3.06Å; R414-K417 PolarHBondContact O-N 3.21Å; K417-K419 VanDerWaalsContact C-N 3.31Å; K417-K419 PolarHBondContact O-N 3.26Å; K417-E420 PolarHBondContact O-N 2.85Å; K417-T421 HydrophobicContact CD-CG2 4.44Å; K417-T421 HydrophobicContact CG-CG2 4.4Å; K417-T421 WeakPolarHBondContact O-CB 3.42Å; K417-T421 PolarHBondContact O-N 2.99Å; K417-T421 PolarHBondContact O-OG1 3.24Å
418	C	83.6	Confident	81.3	Confident	0 Å²	0	67.7 Å²	67.7	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-61.7	-37.8	175.6	-72.3	0	0	0	0	112.6	F406 R414 W415 K416 R422 L423 F425	F406-C418 VanDerWaalsContact CZ-SG 3.53Å; R414-C418 WeakPolarHBondContact O-CB 3.33Å; R414-C418 PolarHBondContact O-N 3.14Å; R414-C418 PolarHBondContact O-SG 2.98Å; W415-C418 PolarHBondContact O-N 3.35Å; K416-C418 PolarHBondContact O-N 3.1Å; C418-R422 WeakPolarHBondContact O-CA 3.29Å; C418-R422 PolarHBondContact O-N 3.38Å; C418-L423 HydrophobicContact CB-CB 4.29Å; C418-L423 PolarHBondContact O-N 3.4Å; C418-F425 HydrophobicContact CB-CD1 3.85Å; C418-F425 HydrophobicContact CB-CE1 3.73Å
419	K	80.9	Confident	81.5	Confident	136 Å²	136	69.1 Å²	69.1	59%	0.591	31%	0.311	S	S	*	.	H	α-helix	trans	-67.8	-45.7	175.2	-72.5	174	-179.1	-180	0	111.8	W415 K416 K417 R422 F425	W415-K419 WeakPolarHBondContact O-CG 3.42Å; W415-K419 PolarHBondContact O-N 2.87Å; W415-K419 VanDerWaalsContact O-N 3.13Å; K416-K419 WeakPolarHBondContact O-CB 3.5Å; K416-K419 PolarHBondContact O-N 3.04Å; K417-K419 VanDerWaalsContact C-N 3.31Å; K417-K419 PolarHBondContact O-N 3.26Å; K419-R422 PolarHBondContact O-N 2.82Å; K419-F425 HydrophobicContact CG-CE1 4.11Å; K419-F425 HydrophobicContact CG-CZ 3.86Å
420	E	77.6	Confident	81.5	Confident	119 Å²	119	70.6 Å²	70.6	56%	0.556	32%	0.32	S	S	*	.	H	α-helix	trans	-63.9	-42.4	179	-72.8	170.1	-177	0	0	112	K416 K417	K416-E420 WeakPolarHBondContact CE-OE1 3.47Å; K416-E420 WeakPolarHBondContact O-CG 3.42Å; K416-E420 PolarHBondContact O-N 3.44Å; K417-E420 PolarHBondContact O-N 2.85Å
421	T	76.3	Confident	81.1	Confident	32 Å²	32	71.3 Å²	71.3	20%	0.196	34%	0.34	C	S	.	.	H	α-helix	trans	-90.7	-0.1	-178.1	57.4	0	0	0	0	114.1	L394 K417 L423	L394-T421 HydrophobicContact CB-CG2 4.28Å; K417-T421 HydrophobicContact CD-CG2 4.44Å; K417-T421 HydrophobicContact CG-CG2 4.4Å; K417-T421 WeakPolarHBondContact O-CB 3.42Å; K417-T421 PolarHBondContact O-N 2.99Å; K417-T421 PolarHBondContact O-OG1 3.24Å; T421-L423 VanDerWaalsContact C-N 3.32Å; T421-L423 PolarHBondContact O-N 3.17Å; T421-L423 WeakPolarHBondContact OG1-CD1 3.44Å; T421-L423 WeakPolarHBondContact OG1-CG 3.24Å
422	R	76.4	Confident	81.2	Confident	212 Å²	212	72.8 Å²	72.8	80%	0.8	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.2	43.3	-179.3	-60.3	-174.6	175.9	179.7	-0.3	114.1	C418 K419	C418-R422 WeakPolarHBondContact O-CA 3.29Å; C418-R422 PolarHBondContact O-N 3.38Å; K419-R422 PolarHBondContact O-N 2.82Å
423	L	84.6	Confident	81.4	Confident	22 Å²	22	73.4 Å²	73.4	12%	0.115	35%	0.35	C	S	.	.	B	Isolated β-bridge	trans	-76.9	140.2	171.2	-63.9	170.8	0	0	0	110.1	L394 C418 T421 F425 L428 V430	L394-L423 HydrophobicContact CD1-CD2 4.17Å; C418-L423 HydrophobicContact CB-CB 4.29Å; C418-L423 PolarHBondContact O-N 3.4Å; T421-L423 VanDerWaalsContact C-N 3.32Å; T421-L423 PolarHBondContact O-N 3.17Å; T421-L423 WeakPolarHBondContact OG1-CD1 3.44Å; T421-L423 WeakPolarHBondContact OG1-CG 3.24Å; L423-F425 PolarHBondContact O-N 3.15Å; L423-L428 WeakPolarHBondContact CD2-O 3.47Å; L423-V430 HydrophobicContact CD2-CG1 3.6Å
424	C	84.2	Confident	81.5	Confident	3 Å²	3	69.5 Å²	69.5	2%	0.02	33%	0.334	C	S	.	.			trans	-60.6	124.6	169.1	175.5	0	0	0	0	109.3	R426 L428 R429 H432	C424-R426 PolarHBondContact O-N 3.25Å; C424-R426 VanDerWaalsContact O-N 3.12Å; C424-L428 WeakPolarHBondContact O-CA 3.41Å; C424-L428 PolarHBondContact O-N 3.03Å; C424-R429 VanDerWaalsContact CB-O 3.27Å; C424-R429 WeakPolarHBondContact CB-O 3.47Å; C424-R429 PolarHBondContact N-O 3.25Å; C424-H432 WeakPolarHBondContact CB-O 3.36Å; C424-H432 PolarHBondContact SG-NE2 3.15Å; C424-H432 VanDerWaalsContact SG-NE2 3.39Å
425	F	89.2	Confident	81.1	Confident	59 Å²	59	75.5 Å²	75.5	26%	0.259	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-16.6	-176.2	-52.8	-46.8	0	0	0	113.4	W415 C418 K419 L423 V434 H452 H453 L456	W415-F425 HydrophobicContact CE3-CD1 4.38Å; W415-F425 HydrophobicContact CE3-CE1 4.42Å; W415-F425 HydrophobicContact CH2-CG 4.47Å; W415-F425 HydrophobicContact CZ3-CB 4.39Å; W415-F425 HydrophobicContact CZ3-CD1 4.01Å; W415-F425 HydrophobicContact CZ3-CD2 4.01Å; W415-F425 HydrophobicContact CZ3-CE1 4.3Å; W415-F425 HydrophobicContact CZ3-CE2 4.29Å; W415-F425 AromaticContact CZ3-CG 3.88Å; W415-F425 HydrophobicContact CZ3-CG 3.88Å; W415-F425 HydrophobicContact CZ3-CZ 4.43Å; C418-F425 HydrophobicContact CB-CD1 3.85Å; C418-F425 HydrophobicContact CB-CE1 3.73Å; K419-F425 HydrophobicContact CG-CE1 4.11Å; K419-F425 HydrophobicContact CG-CZ 3.86Å; L423-F425 PolarHBondContact O-N 3.15Å; F425-V434 HydrophobicContact CB-CG2 3.64Å; F425-V434 HydrophobicContact CD2-CG2 3.88Å; F425-V434 HydrophobicContact CG-CG2 4.11Å; F425-H452 CarbonylContact O-C 3.4Å; F425-H452 VanDerWaalsContact O-CA 3.3Å; F425-H452 WeakPolarHBondContact O-CA 3.37Å; F425-H453 VanDerWaalsContact O-CB 3.31Å; F425-H453 WeakPolarHBondContact O-CB 3.43Å; F425-H453 PolarHBondContact O-N 3.46Å; F425-L456 HydrophobicContact CB-CD1 3.95Å; F425-L456 HydrophobicContact CD1-CD1 4.11Å; F425-L456 HydrophobicContact CG-CD1 4.44Å
426	R	86.3	Confident	80.9	Confident	60 Å²	60	78.4 Å²	78.4	23%	0.226	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-41.3	-179.4	-175.8	167	170	157	-6.3	113.3	C424 V434 C437 S439 D440 D441 D451 H453	C424-R426 PolarHBondContact O-N 3.25Å; C424-R426 VanDerWaalsContact O-N 3.12Å; R426-V434 HydrophobicContact CB-CG1 4.24Å; R426-V434 HydrophobicContact CB-CG2 4.48Å; R426-C437 HydrophobicContact CB-CB 4.36Å; R426-S439 PolarHBondContact NE-O 3.45Å; R426-S439 PolarHBondContact NH2-O 3.13Å; R426-D440 IonicContact NH2-OD1 3.74Å; R426-D441 CarbonylContact O-C 3.54Å; R426-D451 IonicContact NH1-OD1 3.72Å; R426-D451 PolarHBondContact NH1-OD1 3.32Å; R426-D451 VanDerWaalsContact NH1-OD1 3.07Å; R426-H453 WeakPolarHBondContact O-CB 3.25Å; R426-H453 PolarHBondContact O-CD2 3.05Å
427	C	84.8	Confident	81.1	Confident	6 Å²	6	72.9 Å²	72.9	4%	0.041	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.3	-0.4	-177.9	70.1	0	0	0	0	114.8	R429 H432	C427-R429 PolarHBondContact O-N 3.05Å; C427-R429 VanDerWaalsContact O-N 3.15Å; C427-H432 PolarHBondContact SG-CE1 2.88Å; C427-H432 PolarHBondContact SG-NE2 2.94Å
428	L	81.7	Confident	81.1	Confident	35 Å²	35	79.1 Å²	79.1	18%	0.183	38%	0.382	C	S	.	.			trans	54.4	30.2	-177	-54.2	177.1	0	0	0	114.1	F406 L423 C424 H453 L455 L456	F406-L428 HydrophobicContact CE1-CD1 3.87Å; L423-L428 WeakPolarHBondContact CD2-O 3.47Å; C424-L428 WeakPolarHBondContact O-CA 3.41Å; C424-L428 PolarHBondContact O-N 3.03Å; L428-H453 HydrophobicContact CD1-CB 4.18Å; L428-H453 HydrophobicContact CD2-CB 4.19Å; L428-H453 HydrophobicContact CG-CB 3.89Å; L428-L455 HydrophobicContact CD1-CB 4.34Å; L428-L455 HydrophobicContact CD1-CD1 3.93Å; L428-L456 HydrophobicContact CD2-CD1 3.91Å; L428-L456 HydrophobicContact CD2-CG 4.24Å
429	R	79	Confident	80.8	Confident	114 Å²	114	80.1 Å²	80.1	43%	0.43	39%	0.389	S	S	.	.			trans	-107.6	149.7	172.5	-57.7	179	-167.3	161.9	7.4	110.6	C424 C427 D441	C424-R429 VanDerWaalsContact CB-O 3.27Å; C424-R429 WeakPolarHBondContact CB-O 3.47Å; C424-R429 PolarHBondContact N-O 3.25Å; C427-R429 PolarHBondContact O-N 3.05Å; C427-R429 VanDerWaalsContact O-N 3.15Å; R429-D441 IonicContact NH2-OD2 3.53Å
430	V	77	Confident	80.4	Confident	68 Å²	68	80.7 Å²	80.7	41%	0.412	40%	0.399	S	S	.	.	B	Isolated β-bridge	trans	-75.1	164.6	174.4	-72.4	0	0	0	0	112.8	L394 L423	L394-V430 HydrophobicContact CD1-CG1 3.29Å; L423-V430 HydrophobicContact CD2-CG1 3.6Å
431	G	72.4	Confident	80	Confident	83 Å²	83	78.2 Å²	78.2	86%	0.856	39%	0.389	S	S	*	.	S	Bend	trans	98.8	-8.2	165.5	0	0	0	0	0	115.7
432	H	84	Confident	79.9	Confident	61 Å²	61	77.4 Å²	77.4	28%	0.282	39%	0.387	S	S	.	.	S	Bend	trans	-149.3	159.8	178.5	63.4	-77.6	0	0	0	112.8	C424 C427	C424-H432 WeakPolarHBondContact CB-O 3.36Å; C424-H432 PolarHBondContact SG-NE2 3.15Å; C424-H432 VanDerWaalsContact SG-NE2 3.39Å; C427-H432 PolarHBondContact SG-CE1 2.88Å; C427-H432 PolarHBondContact SG-NE2 2.94Å
433	L	80.6	Confident	80.3	Confident	109 Å²	109	68.4 Å²	68.4	57%	0.571	36%	0.356	S	S	*	.			trans	-89.4	157.9	172.8	-67.8	168.4	0	0	0	110.2	K435 H436 C437	L433-K435 HydrophobicContact CB-CG 4.08Å; L433-K435 PolarHBondContact O-N 2.99Å; L433-K435 VanDerWaalsContact O-N 3.15Å; L433-H436 CarbonylContact O-C 3.49Å; L433-H436 PolarHBondContact O-N 3.31Å; L433-C437 PolarHBondContact O-N 3.26Å
434	V	81.8	Confident	79.9	Confident	29 Å²	29	71.8 Å²	71.8	18%	0.176	38%	0.378	C	S	.	.	G	3₁₀ helix	trans	-47.8	-44	177.1	174.4	0	0	0	0	112.6	F425 R426 H436 C437 D451	F425-V434 HydrophobicContact CB-CG2 3.64Å; F425-V434 HydrophobicContact CD2-CG2 3.88Å; F425-V434 HydrophobicContact CG-CG2 4.11Å; R426-V434 HydrophobicContact CB-CG1 4.24Å; R426-V434 HydrophobicContact CB-CG2 4.48Å; V434-H436 PolarHBondContact O-N 3.41Å; V434-H436 VanDerWaalsContact O-N 3.13Å; V434-C437 WeakPolarHBondContact O-CB 3.49Å; V434-C437 PolarHBondContact O-N 2.73Å; V434-D451 HydrophobicContact CG1-CB 3.45Å; V434-D451 VanDerWaalsContact CG1-CB 3.45Å; V434-D451 WeakPolarHBondContact CG1-O 3.29Å
435	K	77.8	Confident	79.3	Confident	162 Å²	162	75.3 Å²	75.3	70%	0.704	39%	0.394	S	S	*	.	G	3₁₀ helix	trans	-62.6	-18.2	178.8	63.6	173.3	179.7	171.7	0	115.3	L433	L433-K435 HydrophobicContact CB-CG 4.08Å; L433-K435 PolarHBondContact O-N 2.99Å; L433-K435 VanDerWaalsContact O-N 3.15Å
436	H	82.2	Confident	77.9	Confident	125 Å²	125	81.8 Å²	81.8	58%	0.579	43%	0.425	S	S	*	.	G	3₁₀ helix	trans	-111.3	9.8	176.6	-52.9	131.4	0	0	0	111.7	L433 V434	L433-H436 CarbonylContact O-C 3.49Å; L433-H436 PolarHBondContact O-N 3.31Å; V434-H436 PolarHBondContact O-N 3.41Å; V434-H436 VanDerWaalsContact O-N 3.13Å
437	C	83.5	Confident	76.7	Confident	17 Å²	17	83.1 Å²	83.1	12%	0.115	46%	0.458	C	S	.	.			trans	-78.6	120.8	-180	-174.8	0	0	0	0	110	R426 L433 V434 S439	R426-C437 HydrophobicContact CB-CB 4.36Å; L433-C437 PolarHBondContact O-N 3.26Å; V434-C437 WeakPolarHBondContact O-CB 3.49Å; V434-C437 PolarHBondContact O-N 2.73Å; C437-S439 VanDerWaalsContact C-N 3.34Å; C437-S439 PolarHBondContact SG-N 3.29Å
438	K	79.7	Confident	75.9	Confident	209 Å²	209	84 Å²	84	91%	0.909	46%	0.463	S	S	*	.			trans	-91	6.3	173.2	-62.4	-168.6	178.2	-174.1	0	113.5
439	S	77	Confident	75.2	Confident	21 Å²	21	86.2 Å²	86.2	15%	0.147	50%	0.495	C	S	.	.			trans	-82	140.6	179.4	-173.2	0	0	0	0	111.8	R426 C437 D441	R426-S439 PolarHBondContact NE-O 3.45Å; R426-S439 PolarHBondContact NH2-O 3.13Å; C437-S439 VanDerWaalsContact C-N 3.34Å; C437-S439 PolarHBondContact SG-N 3.29Å; S439-D441 VanDerWaalsContact C-N 3.29Å; S439-D441 WeakPolarHBondContact OG-CB 3.33Å; S439-D441 PolarHBondContact OG-N 3.41Å; S439-D441 PolarHBondContact OG-OD2 3.3Å
440	D	71.5	Confident	75.2	Confident	149 Å²	149	86.4 Å²	86.4	80%	0.797	50%	0.496	S	S	*	.			trans	-86.1	5	169.6	-70.1	-26	0	0	0	113.3	R426 G442	R426-D440 IonicContact NH2-OD1 3.74Å; D440-G442 PolarHBondContact O-N 2.98Å
441	D	70.7	Confident	75.4	Confident	67 Å²	67	88 Å²	88	36%	0.358	50%	0.502	S	S	.	.			trans	-68.9	28.9	176.3	-55.4	-38.7	0	0	0	114	R426 R429 S439 H453	R426-D441 CarbonylContact O-C 3.54Å; R429-D441 IonicContact NH2-OD2 3.53Å; S439-D441 VanDerWaalsContact C-N 3.29Å; S439-D441 WeakPolarHBondContact OG-CB 3.33Å; S439-D441 PolarHBondContact OG-N 3.41Å; S439-D441 PolarHBondContact OG-OD2 3.3Å; D441-H453 PolarHBondContact O-CD2 3.14Å
442	G	74.2	Confident	76.2	Confident	15 Å²	15	84.5 Å²	84.5	16%	0.155	46%	0.463	C	S	.	.			trans	-66.1	-178.6	177.4	0	0	0	0	0	113.3	D440 T444 H452	D440-G442 PolarHBondContact O-N 2.98Å; G442-T444 PolarHBondContact O-N 2.94Å; G442-H452 CarbonylContact C-O 3.6Å
443	C	84.2	Confident	76.4	Confident	22 Å²	22	83.1 Å²	83.1	15%	0.149	46%	0.457	C	S	.	.			trans	-67.2	117.1	-178	-161	0	0	0	0	110.5	H445 C448 H452 H457	C443-H445 VanDerWaalsContact C-N 3.32Å; C443-C448 HydrophobicContact CB-CB 4.21Å; C443-C448 VanDerWaalsContact SG-SG 3.66Å; C443-H452 WeakPolarHBondContact CA-O 3.4Å; C443-H452 VanDerWaalsContact CB-CD2 3.49Å; C443-H452 WeakPolarHBondContact CB-CD2 3.33Å; C443-H452 WeakPolarHBondContact CB-O 3.34Å; C443-H452 PolarHBondContact N-O 3.03Å; C443-H452 VanDerWaalsContact SG-CD2 3.59Å; C443-H452 PolarHBondContact SG-NE2 3.1Å; C443-H457 PolarHBondContact SG-ND1 2.81Å; C443-H457 VanDerWaalsContact SG-ND1 3.35Å
444	T	77.1	Confident	76.6	Confident	94 Å²	94	82.7 Å²	82.7	58%	0.577	45%	0.452	S	S	*	.			trans	-86.2	-6.4	178.1	53.7	0	0	0	0	112.6	G442 Q446 E454	G442-T444 PolarHBondContact O-N 2.94Å; T444-Q446 PolarHBondContact O-N 3.09Å; T444-E454 PolarHBondContact OG1-OE1 3.35Å; T444-E454 PolarHBondContact OG1-OE2 3.14Å
445	H	71.3	Confident	76.8	Confident	77 Å²	77	83 Å²	83	36%	0.356	45%	0.452	S	S	.	.	S	Bend	trans	-63.6	121.8	-178.8	-137.8	81.2	0	0	0	110.4	C443 G447 C448 H457	C443-H445 VanDerWaalsContact C-N 3.32Å; H445-G447 PolarHBondContact O-N 3.17Å; H445-G447 VanDerWaalsContact O-N 3.15Å; H445-C448 HydrophobicContact CB-CB 4.08Å; H445-C448 VanDerWaalsContact O-CB 3.29Å; H445-C448 WeakPolarHBondContact O-CB 3.46Å; H445-C448 PolarHBondContact O-N 3.4Å; H445-H457 AromaticContact CD2-CD2 3.79Å; H445-H457 AromaticContact CD2-CE1 3.97Å; H445-H457 AromaticContact CD2-NE2 3.42Å; H445-H457 PolarHBondContact CD2-NE2 3.34Å; H445-H457 AromaticContact CG-CD2 3.76Å; H445-H457 AromaticContact CG-NE2 3.74Å
446	Q	58.8	Low	77.2	Confident	195 Å²	195	75.2 Å²	75.2	91%	0.911	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	119.9	-174.3	-79.6	-171.6	-0.3	0	0	111.6	T444	T444-Q446 PolarHBondContact O-N 3.09Å
447	G	61	Low	77.3	Confident	88 Å²	88	70.7 Å²	70.7	91%	0.907	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.1	-3.5	-177.6	0	0	0	0	0	115	H445 G449	H445-G447 PolarHBondContact O-N 3.17Å; H445-G447 VanDerWaalsContact O-N 3.15Å; G447-G449 PolarHBondContact O-N 3.39Å
448	C	67.9	Low	76.8	Confident	23 Å²	23	76.1 Å²	76.1	16%	0.155	42%	0.416	C	S	.	.			trans	-85.4	96.7	175	-162.6	0	0	0	0	111.7	C443 H445 R450 H452 H457	C443-C448 HydrophobicContact CB-CB 4.21Å; C443-C448 VanDerWaalsContact SG-SG 3.66Å; H445-C448 HydrophobicContact CB-CB 4.08Å; H445-C448 VanDerWaalsContact O-CB 3.29Å; H445-C448 WeakPolarHBondContact O-CB 3.46Å; H445-C448 PolarHBondContact O-N 3.4Å; C448-R450 VanDerWaalsContact C-N 3.26Å; C448-R450 PolarHBondContact O-N 2.97Å; C448-H452 PolarHBondContact SG-NE2 3.15Å; C448-H457 PolarHBondContact SG-CE1 3.27Å; C448-H457 PolarHBondContact SG-ND1 2.9Å
449	G	68.2	Low	75.9	Confident	82 Å²	82	73 Å²	73	85%	0.845	40%	0.404	S	S	*	.			trans	-84.9	19.4	174.1	0	0	0	0	0	115	G447	G447-G449 PolarHBondContact O-N 3.39Å
450	R	79.1	Confident	74.5	Confident	118 Å²	118	78.6 Å²	78.6	45%	0.445	43%	0.428	S	S	.	.	S	Bend	trans	-93.6	139.4	-174.8	-65.8	-170.4	-86.6	-142.6	-5.7	111	C448 H452 E460	C448-R450 VanDerWaalsContact C-N 3.26Å; C448-R450 PolarHBondContact O-N 2.97Å; R450-H452 VanDerWaalsContact C-N 3.26Å; R450-H452 PolarHBondContact O-N 2.94Å; R450-E460 IonicContact CZ-OE1 2.59Å; R450-E460 VanDerWaalsContact CZ-OE1 3.31Å; R450-E460 IonicContact NH1-OE1 2.75Å; R450-E460 PolarHBondContact NH1-OE1 3.42Å; R450-E460 IonicContact NH2-OE1 2.92Å; R450-E460 PolarHBondContact NH2-OE1 2.95Å
451	D	81.1	Confident	72.7	Confident	102 Å²	102	78.5 Å²	78.5	55%	0.545	43%	0.427	S	S	.	.	S	Bend	trans	-75.7	68.5	178.3	-70.5	-57	0	0	0	113.2	R426 V434	R426-D451 IonicContact NH1-OD1 3.72Å; R426-D451 PolarHBondContact NH1-OD1 3.32Å; R426-D451 VanDerWaalsContact NH1-OD1 3.07Å; V434-D451 HydrophobicContact CG1-CB 3.45Å; V434-D451 VanDerWaalsContact CG1-CB 3.45Å; V434-D451 WeakPolarHBondContact CG1-O 3.29Å
452	H	88.3	Confident	71	Confident	9 Å²	9	78.7 Å²	78.7	4%	0.042	44%	0.438	C	S	.	.	S	Bend	trans	-137.7	167.5	170.8	60.8	-139.4	0	0	0	111.4	W415 F425 G442 C443 C448 R450 L456 H457	W415-H452 HydrophobicContact CH2-CB 4.15Å; W415-H452 HydrophobicContact CZ2-CB 4.25Å; W415-H452 AromaticContact CZ2-ND1 3.85Å; F425-H452 CarbonylContact O-C 3.4Å; F425-H452 VanDerWaalsContact O-CA 3.3Å; F425-H452 WeakPolarHBondContact O-CA 3.37Å; G442-H452 CarbonylContact C-O 3.6Å; C443-H452 WeakPolarHBondContact CA-O 3.4Å; C443-H452 VanDerWaalsContact CB-CD2 3.49Å; C443-H452 WeakPolarHBondContact CB-CD2 3.33Å; C443-H452 WeakPolarHBondContact CB-O 3.34Å; C443-H452 PolarHBondContact N-O 3.03Å; C443-H452 VanDerWaalsContact SG-CD2 3.59Å; C443-H452 PolarHBondContact SG-NE2 3.1Å; C448-H452 PolarHBondContact SG-NE2 3.15Å; R450-H452 VanDerWaalsContact C-N 3.26Å; R450-H452 PolarHBondContact O-N 2.94Å; H452-L456 HydrophobicContact CB-CB 4.31Å; H452-H457 AromaticContact NE2-ND1 3.43Å; H452-H457 PolarHBondContact NE2-ND1 2.89Å
453	H	88	Confident	68.8	Low	33 Å²	33	83.3 Å²	83.3	15%	0.153	46%	0.456	C	S	.	.			trans	-77.7	149	173.9	-169.9	-82.5	0	0	0	109.5	F425 R426 L428 D441 L455 L456	F425-H453 VanDerWaalsContact O-CB 3.31Å; F425-H453 WeakPolarHBondContact O-CB 3.43Å; F425-H453 PolarHBondContact O-N 3.46Å; R426-H453 WeakPolarHBondContact O-CB 3.25Å; R426-H453 PolarHBondContact O-CD2 3.05Å; L428-H453 HydrophobicContact CD1-CB 4.18Å; L428-H453 HydrophobicContact CD2-CB 4.19Å; L428-H453 HydrophobicContact CG-CB 3.89Å; D441-H453 PolarHBondContact O-CD2 3.14Å; H453-L455 VanDerWaalsContact C-N 3.28Å; H453-L455 PolarHBondContact ND1-N 3.49Å; H453-L455 PolarHBondContact O-N 3.31Å; H453-L456 WeakPolarHBondContact O-CB 3.49Å; H453-L456 PolarHBondContact O-N 3.03Å
454	E	84.8	Confident	66.3	Low	100 Å²	100	84.3 Å²	84.3	47%	0.467	47%	0.47	S	S	.	.	G	3₁₀ helix	trans	-52.3	-41.9	-179.3	-174.2	179.7	177.6	0	0	113.2	T444 L456 H457	T444-E454 PolarHBondContact OG1-OE1 3.35Å; T444-E454 PolarHBondContact OG1-OE2 3.14Å; E454-L456 PolarHBondContact O-N 3.16Å; E454-H457 WeakPolarHBondContact O-CB 3.33Å; E454-H457 PolarHBondContact O-N 2.91Å
455	L	85.5	Confident	64.6	Low	34 Å²	34	83.9 Å²	83.9	18%	0.178	46%	0.463	C	S	.	.	G	3₁₀ helix	trans	-59.9	-15.1	174.6	-64.8	176.9	0	0	0	115.5	L402 F406 I407 R414 L428 H453	L402-L455 HydrophobicContact CD2-CD1 4.11Å; F406-L455 HydrophobicContact CD1-CD1 4.33Å; F406-L455 HydrophobicContact CE1-CB 4.43Å; F406-L455 HydrophobicContact CE1-CD1 4.4Å; I407-L455 HydrophobicContact CG1-CD1 4.01Å; I407-L455 HydrophobicContact CG1-CD2 4.12Å; R414-L455 VanDerWaalsContact CD-O 3.26Å; R414-L455 WeakPolarHBondContact CD-O 3.49Å; R414-L455 PolarHBondContact NH1-O 3.48Å; L428-L455 HydrophobicContact CD1-CB 4.34Å; L428-L455 HydrophobicContact CD1-CD1 3.93Å; H453-L455 VanDerWaalsContact C-N 3.28Å; H453-L455 PolarHBondContact ND1-N 3.49Å; H453-L455 PolarHBondContact O-N 3.31Å
456	L	86.4	Confident	62.8	Low	0 Å²	0	83.5 Å²	83.5	0%	0	46%	0.461	C	S	.	.	G	3₁₀ helix	trans	-101.5	-0.3	174.3	-65.3	179.3	0	0	0	112.5	F406 R414 W415 F425 L428 H452 H453 E454 R458	F406-L456 HydrophobicContact CZ-CD2 4.29Å; R414-L456 HydrophobicContact CB-CD2 3.73Å; W415-L456 HydrophobicContact CD2-CD2 4.34Å; W415-L456 HydrophobicContact CG-CD2 4.27Å; W415-L456 HydrophobicContact CH2-CD1 4.43Å; W415-L456 HydrophobicContact CZ2-CB 3.89Å; W415-L456 HydrophobicContact CZ2-CD1 4.44Å; W415-L456 HydrophobicContact CZ3-CD1 4.48Å; W415-L456 PolarHBondContact NE1-O 2.9Å; F425-L456 HydrophobicContact CB-CD1 3.95Å; F425-L456 HydrophobicContact CD1-CD1 4.11Å; F425-L456 HydrophobicContact CG-CD1 4.44Å; L428-L456 HydrophobicContact CD2-CD1 3.91Å; L428-L456 HydrophobicContact CD2-CG 4.24Å; H452-L456 HydrophobicContact CB-CB 4.31Å; H453-L456 WeakPolarHBondContact O-CB 3.49Å; H453-L456 PolarHBondContact O-N 3.03Å; E454-L456 PolarHBondContact O-N 3.16Å; L456-R458 PolarHBondContact O-N 3.25Å
457	H	85.6	Confident	62.1	Low	29 Å²	29	74.4 Å²	74.4	13%	0.134	42%	0.419	C	S	.	.			trans	-60.4	122.9	176.5	-169	78.5	0	0	0	109.3	C443 H445 C448 H452 E454	C443-H457 PolarHBondContact SG-ND1 2.81Å; C443-H457 VanDerWaalsContact SG-ND1 3.35Å; H445-H457 AromaticContact CD2-CD2 3.79Å; H445-H457 AromaticContact CD2-CE1 3.97Å; H445-H457 AromaticContact CD2-NE2 3.42Å; H445-H457 PolarHBondContact CD2-NE2 3.34Å; H445-H457 AromaticContact CG-CD2 3.76Å; H445-H457 AromaticContact CG-NE2 3.74Å; C448-H457 PolarHBondContact SG-CE1 3.27Å; C448-H457 PolarHBondContact SG-ND1 2.9Å; H452-H457 AromaticContact NE2-ND1 3.43Å; H452-H457 PolarHBondContact NE2-ND1 2.89Å; E454-H457 WeakPolarHBondContact O-CB 3.33Å; E454-H457 PolarHBondContact O-N 2.91Å
458	R	73	Confident	61.4	Low	132 Å²	132	70.9 Å²	70.9	50%	0.498	38%	0.383	S	S	.	.			trans	-97.5	112.6	170.8	-150.1	-178.4	-155.3	-177.2	-1	105.1	V411 E412 L456 E460	V411-R458 HydrophobicContact CG1-CB 4.41Å; V411-R458 HydrophobicContact CG1-CG 4.4Å; E412-R458 VanDerWaalsContact CG-NH2 3.26Å; E412-R458 IonicContact OE1-CZ 2.83Å; E412-R458 IonicContact OE1-NE 2.87Å; E412-R458 PolarHBondContact OE1-NE 3.27Å; E412-R458 IonicContact OE1-NH2 3.26Å; E412-R458 PolarHBondContact OE1-NH2 3.29Å; L456-R458 PolarHBondContact O-N 3.25Å; R458-E460 PolarHBondContact O-N 2.9Å
459	E	60.7	Low	60.2	Low	142 Å²	142	70.7 Å²	70.7	66%	0.664	38%	0.38	S	S	*	.			trans	-55.1	117.1	159.1	-77.2	-178.2	170.9	0	0	105.4	N461	E459-N461 PolarHBondContact O-N 3.41Å
460	E	46.4	Very low	59	Low	140 Å²	140	69.7 Å²	69.7	65%	0.654	36%	0.355	S	S	*	.			trans	-61.9	101.6	172.2	-79.3	176.3	-169.3	0	0	105.5	R450 R458 A462	R450-E460 IonicContact CZ-OE1 2.59Å; R450-E460 VanDerWaalsContact CZ-OE1 3.31Å; R450-E460 IonicContact NH1-OE1 2.75Å; R450-E460 PolarHBondContact NH1-OE1 3.42Å; R450-E460 IonicContact NH2-OE1 2.92Å; R450-E460 PolarHBondContact NH2-OE1 2.95Å; R458-E460 PolarHBondContact O-N 2.9Å; E460-A462 PolarHBondContact O-N 2.97Å
461	N	34.8	Very low	57.1	Low	146 Å²	146	67.9 Å²	67.9	78%	0.781	35%	0.348	S	S	*	.			trans	-57.7	82.9	158.8	-96.5	-17.8	0	0	0	105.4	E459 E463	E459-N461 PolarHBondContact O-N 3.41Å; N461-E463 PolarHBondContact O-N 2.95Å
462	A	34	Very low	55.1	Low	71 Å²	71	63.6 Å²	63.6	59%	0.587	33%	0.326	S	S	*	.			trans	-64.6	89.9	161.8	0	0	0	0	0	104.9	E460 G464	E460-A462 PolarHBondContact O-N 2.97Å; A462-G464 PolarHBondContact O-N 3.32Å
463	E	29.3	Very low	53.1	Low	113 Å²	113	66.2 Å²	66.2	53%	0.528	35%	0.345	S	S	.	.			trans	-63.2	7.2	156.1	-67.6	-172.3	143.3	0	0	111.2	N461 I465 K1348	N461-E463 PolarHBondContact O-N 2.95Å; E463-I465 PolarHBondContact O-N 2.98Å; E463-I465 VanDerWaalsContact O-N 3.08Å; E463-K1348 WeakPolarHBondContact OE1-CD 3.41Å; E463-K1348 IonicContact OE1-NZ 2.85Å; E463-K1348 PolarHBondContact OE1-NZ 3.21Å
464	G	31.1	Very low	51.1	Low	42 Å²	42	73.5 Å²	73.5	43%	0.433	38%	0.377	S	S	.	.	S	Bend	trans	-63.2	98.6	157.2	0	0	0	0	0	112.5	A462	A462-G464 PolarHBondContact O-N 3.32Å
465	I	40.5	Very low	49.4	Very low	85 Å²	85	74.5 Å²	74.5	44%	0.436	38%	0.381	S	S	.	.			trans	57.2	88.4	142.8	-47.2	170.3	0	0	0	113.2	E463 V467 S571 T656	E463-I465 PolarHBondContact O-N 2.98Å; E463-I465 VanDerWaalsContact O-N 3.08Å; I465-V467 HydrophobicContact CG2-CG2 4.05Å; I465-S571 WeakPolarHBondContact O-CB 3.48Å; I465-S571 PolarHBondContact O-OG 2.86Å; I465-T656 HydrophobicContact CD1-CG2 3.63Å
466	Q	35.1	Very low	48	Very low	70 Å²	70	73.4 Å²	73.4	33%	0.327	38%	0.377	S	S	.	.			trans	-75.9	122.3	179.2	-73.8	174.6	-4.9	0	0	111.1	R651	Q466-R651 VanDerWaalsContact OE1-NH2 3.12Å
467	V	42.6	Very low	47	Very low	3 Å²	3	73.7 Å²	73.7	2%	0.018	38%	0.379	C	S	.	.	B	Isolated β-bridge	trans	-129.1	154.5	-166.5	162.7	0	0	0	0	108.3	I465 S571 V572 L573 E574 L653	I465-V467 HydrophobicContact CG2-CG2 4.05Å; V467-S571 WeakPolarHBondContact CB-OG 3.41Å; V467-S571 WeakPolarHBondContact CG2-OG 3.46Å; V467-V572 PolarHBondContact N-O 3.42Å; V467-L573 HydrophobicContact CB-CD2 4.5Å; V467-L573 HydrophobicContact CG1-CD2 3.42Å; V467-L573 VanDerWaalsContact CG1-CD2 3.42Å; V467-L573 CarbonylContact O-C 3.49Å; V467-L573 WeakPolarHBondContact O-CA 3.45Å; V467-E574 WeakPolarHBondContact O-CG 3.25Å; V467-E574 PolarHBondContact O-N 3.34Å; V467-L653 HydrophobicContact CB-CD1 4.33Å; V467-L653 HydrophobicContact CG1-CD1 3.22Å; V467-L653 HydrophobicContact CG1-CG 3.95Å
468	G	46.5	Very low	46.6	Very low	15 Å²	15	74.4 Å²	74.4	16%	0.155	39%	0.386	C	S	.	.	S	Bend	trans	123.7	-16.9	166.7	0	0	0	0	0	116.9
469	M	43.5	Very low	47.1	Very low	18 Å²	18	69 Å²	69	9%	0.089	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151	119.8	169.7	-164	103.1	81.6	0	0	107.8	R471 A477 V478 M479	M469-R471 VanDerWaalsContact C-N 3.32Å; M469-R471 HydrophobicContact CB-CG 4.21Å; M469-R471 HydrophobicContact CG-CG 3.96Å; M469-R471 PolarHBondContact O-N 3.3Å; M469-A477 HydrophobicContact CG-CB 3.7Å; M469-A477 HydrophobicContact SD-CB 4.25Å; M469-V478 WeakPolarHBondContact CA-O 3.26Å; M469-M479 HydrophobicContact SD-CG 3.57Å; M469-M479 VanDerWaalsContact SD-CG 3.57Å
470	L	42.8	Very low	48.4	Very low	62 Å²	62	64.7 Å²	64.7	33%	0.325	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	87.5	179.5	-153.2	110.4	0	0	0	108.5	A477 V478 R651 V652	L470-A477 VanDerWaalsContact O-CA 3.31Å; L470-A477 WeakPolarHBondContact O-CA 3.46Å; L470-V478 HydrophobicContact CB-CB 3.98Å; L470-V478 HydrophobicContact CB-CG2 4.26Å; L470-V478 PolarHBondContact N-O 2.92Å; L470-V478 PolarHBondContact O-N 3.27Å; L470-R651 WeakPolarHBondContact CD1-O 3.35Å; L470-R651 WeakPolarHBondContact CG-O 3.5Å; L470-V652 HydrophobicContact CD1-CB 4.33Å; L470-V652 HydrophobicContact CD1-CG1 4.33Å; L470-V652 HydrophobicContact CD1-CG2 4.3Å
471	R	39.6	Very low	50.6	Low	80 Å²	80	59.7 Å²	59.7	30%	0.302	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	110.9	178.2	-60.9	-170.8	-179.5	-147.4	-1.4	107.9	M469 A477 D577 A649 S650 R651	M469-R471 VanDerWaalsContact C-N 3.32Å; M469-R471 HydrophobicContact CB-CG 4.21Å; M469-R471 HydrophobicContact CG-CG 3.96Å; M469-R471 PolarHBondContact O-N 3.3Å; R471-A477 HydrophobicContact CG-CB 4.04Å; R471-D577 IonicContact NH2-OD2 3.13Å; R471-A649 CarbonylContact O-C 3.47Å; R471-S650 WeakPolarHBondContact O-CA 3.5Å; R471-R651 PolarHBondContact O-N 2.86Å
472	S	38.9	Very low	53.4	Low	11 Å²	11	53.2 Å²	53.2	8%	0.077	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	140.8	170.5	166.4	0	0	0	0	108.1	K474 Q475 S648 S650	S472-K474 PolarHBondContact O-N 2.91Å; S472-K474 PolarHBondContact OG-N 3.23Å; S472-Q475 PolarHBondContact N-O 2.97Å; S472-Q475 PolarHBondContact O-N 2.72Å; S472-Q475 VanDerWaalsContact O-N 3.13Å; S472-Q475 PolarHBondContact OG-N 3.12Å; S472-S648 CarbonylContact C-O 3.6Å; S472-S650 VanDerWaalsContact CB-OG 3.26Å; S472-S650 WeakPolarHBondContact CB-OG 3.22Å; S472-S650 PolarHBondContact OG-OG 3.18Å
473	S	45.9	Very low	56.3	Low	64 Å²	64	49.9 Å²	49.9	45%	0.448	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-8.9	177.4	63.6	0	0	0	0	113.2	S648	S473-S648 WeakPolarHBondContact CA-O 3.49Å; S473-S648 PolarHBondContact N-O 3.03Å
474	K	46.5	Very low	59.4	Low	186 Å²	186	45.6 Å²	45.6	81%	0.809	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-129.3	-1.2	174.2	-67.9	-170.4	175.8	-175.2	0	114.6	S472	S472-K474 PolarHBondContact O-N 2.91Å; S472-K474 PolarHBondContact OG-N 3.23Å
475	Q	48	Very low	62.5	Low	122 Å²	122	43.6 Å²	43.6	57%	0.57	22%	0.222	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-130.6	142.9	-179.6	-60.8	174.6	-32.8	0	0	112.2	S472	S472-Q475 PolarHBondContact N-O 2.97Å; S472-Q475 PolarHBondContact O-N 2.72Å; S472-Q475 VanDerWaalsContact O-N 3.13Å; S472-Q475 PolarHBondContact OG-N 3.12Å
476	A	56.6	Low	65.1	Low	10 Å²	10	43.5 Å²	43.5	8%	0.083	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-37.5	135.7	170.8	0	0	0	0	0	113.5	E625 R641 T642	A476-E625 WeakPolarHBondContact CB-OE2 3.46Å; A476-R641 HydrophobicContact CB-CB 4.49Å; A476-T642 WeakPolarHBondContact CA-O 3.49Å; A476-T642 WeakPolarHBondContact CB-O 3.41Å
477	A	66.1	Low	68.1	Low	6 Å²	6	40.1 Å²	40.1	5%	0.05	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	133.2	175.6	0	0	0	0	0	111.3	M469 L470 R471 R641 T642	M469-A477 HydrophobicContact CG-CB 3.7Å; M469-A477 HydrophobicContact SD-CB 4.25Å; L470-A477 VanDerWaalsContact O-CA 3.31Å; L470-A477 WeakPolarHBondContact O-CA 3.46Å; R471-A477 HydrophobicContact CG-CB 4.04Å; A477-R641 CarbonylContact O-C 3.45Å; A477-T642 VanDerWaalsContact CB-OG1 3.29Å; A477-T642 WeakPolarHBondContact CB-OG1 3.46Å; A477-T642 PolarHBondContact N-O 3.23Å; A477-T642 PolarHBondContact O-N 3.19Å; A477-T642 PolarHBondContact O-OG1 3.46Å
478	V	76.4	Confident	70.5	Confident	45 Å²	45	42.8 Å²	42.8	27%	0.273	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	124.3	179	-171.4	0	0	0	0	111.3	M469 L470 G640 R641	M469-V478 WeakPolarHBondContact CA-O 3.26Å; L470-V478 HydrophobicContact CB-CB 3.98Å; L470-V478 HydrophobicContact CB-CG2 4.26Å; L470-V478 PolarHBondContact N-O 2.92Å; L470-V478 PolarHBondContact O-N 3.27Å; V478-G640 WeakPolarHBondContact CA-O 3.41Å; V478-R641 HydrophobicContact CG2-CG 4.18Å
479	M	84.2	Confident	72.5	Confident	17 Å²	17	42.5 Å²	42.5	8%	0.084	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	132.8	173.7	-70.7	-169.4	-69.1	0	0	111.5	M469 W583 F595 P627 I638 C639 G640 T642	M469-M479 HydrophobicContact SD-CG 3.57Å; M469-M479 VanDerWaalsContact SD-CG 3.57Å; M479-W583 HydrophobicContact CE-CH2 3.87Å; M479-W583 HydrophobicContact CE-CZ3 4.06Å; M479-F595 HydrophobicContact SD-CE1 3.96Å; M479-P627 HydrophobicContact CE-CB 3.41Å; M479-P627 VanDerWaalsContact CE-CB 3.41Å; M479-P627 HydrophobicContact CE-CG 3.74Å; M479-I638 HydrophobicContact CE-CG2 3.5Å; M479-I638 HydrophobicContact SD-CG2 4.46Å; M479-C639 WeakPolarHBondContact O-CA 3.49Å; M479-G640 PolarHBondContact N-O 3.42Å; M479-G640 PolarHBondContact O-N 3.41Å; M479-T642 HydrophobicContact CE-CG2 3.62Å; M479-T642 HydrophobicContact CG-CG2 4.31Å; M479-T642 HydrophobicContact SD-CG2 4.42Å
480	L	88.7	Confident	74.3	Confident	52 Å²	52	47 Å²	47	27%	0.272	25%	0.247	S	C	.	.			trans	-82.2	157.1	173.2	-56.7	169.8	0	0	0	111.1	T482 L500 L573 L653	L480-T482 HydrophobicContact CB-CG2 4.36Å; L480-T482 PolarHBondContact O-N 3.26Å; L480-T482 PolarHBondContact O-OG1 3.41Å; L480-L500 HydrophobicContact CB-CD1 3.93Å; L480-L500 HydrophobicContact CD1-CD1 4.12Å; L480-L573 HydrophobicContact CD1-CD2 4.39Å; L480-L653 HydrophobicContact CD1-CD1 3.28Å; L480-L653 HydrophobicContact CD1-CD2 4.45Å; L480-L653 HydrophobicContact CG-CD1 4.46Å
481	Q	92.3	Very high	76.1	Confident	36 Å²	36	49.1 Å²	49.1	17%	0.168	26%	0.259	C	S	.	.			trans	-73.4	96.7	174.6	-70.4	178.5	4.9	0	0	110.6	F501 Y611 I630 I637 C639	Q481-F501 HydrophobicContact CB-CB 3.77Å; Q481-F501 PolarHBondContact O-N 2.82Å; Q481-Y611 VanDerWaalsContact CD-OH 3.26Å; Q481-Y611 PolarHBondContact NE2-OH 2.95Å; Q481-Y611 VanDerWaalsContact NE2-OH 3.16Å; Q481-Y611 PolarHBondContact OE1-OH 3.47Å; Q481-I630 VanDerWaalsContact NE2-CD1 3.31Å; Q481-I637 HydrophobicContact CB-CG2 3.82Å; Q481-I637 HydrophobicContact CG-CG2 4.07Å; Q481-C639 HydrophobicContact CB-CB 4.34Å; Q481-C639 HydrophobicContact CG-CB 3.38Å; Q481-C639 VanDerWaalsContact CG-SG 3.52Å
482	T	93.4	Very high	78.1	Confident	10 Å²	10	48 Å²	48	6%	0.061	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	145.6	-178.2	47.7	0	0	0	0	110.8	L480 C499 L500 L573 D593	L480-T482 HydrophobicContact CB-CG2 4.36Å; L480-T482 PolarHBondContact O-N 3.26Å; L480-T482 PolarHBondContact O-OG1 3.41Å; T482-C499 WeakPolarHBondContact CA-O 3.49Å; T482-L500 HydrophobicContact CG2-CD1 3.89Å; T482-L573 HydrophobicContact CG2-CD1 3.61Å; T482-D593 PolarHBondContact OG1-OD2 3.1Å
483	A	94.4	Very high	80.4	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	150	178.5	0	0	0	0	0	110.3	C499 F501 A592 L634 I637	A483-C499 PolarHBondContact N-O 3.34Å; A483-C499 PolarHBondContact O-N 3.03Å; A483-F501 HydrophobicContact CB-CE2 3.92Å; A483-A592 HydrophobicContact CB-CB 3.77Å; A483-L634 HydrophobicContact CB-CD1 4.18Å; A483-I637 HydrophobicContact CB-CG1 4.43Å
484	Q	95.2	Very high	82.6	Confident	24 Å²	24	48.6 Å²	48.6	11%	0.112	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	131.6	162.5	-57.3	-160.7	-51.3	0	0	109.3	V497 I552 F553 A592 D593	Q484-V497 WeakPolarHBondContact CA-O 3.43Å; Q484-I552 HydrophobicContact CB-CD1 3.49Å; Q484-I552 VanDerWaalsContact CB-CD1 3.49Å; Q484-F553 HydrophobicContact CB-CE2 4.42Å; Q484-A592 PolarHBondContact N-O 2.57Å; Q484-D593 VanDerWaalsContact CG-OD1 3.31Å; Q484-D593 WeakPolarHBondContact CG-OD1 3.45Å
485	A	95.6	Very high	85	Confident	0 Å²	0	42 Å²	42	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	154.4	178.2	0	0	0	0	0	110.4	V496 V497 L549 L634	A485-V496 WeakPolarHBondContact O-CA 3.37Å; A485-V497 HydrophobicContact CB-CG2 4.25Å; A485-V497 PolarHBondContact N-O 2.72Å; A485-V497 WeakPolarHBondContact O-CG2 3.49Å; A485-V497 PolarHBondContact O-N 2.75Å; A485-L549 HydrophobicContact CB-CB 4.28Å; A485-L549 HydrophobicContact CB-CD2 4.14Å; A485-L634 HydrophobicContact CB-CD1 3.89Å; A485-L634 HydrophobicContact CB-CD2 4.09Å
486	R	95.5	Very high	87.2	Confident	82 Å²	82	38.9 Å²	38.9	31%	0.309	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	117.2	167.4	-172.6	169.2	-72.9	-87.7	1.9	108.5	Y488 S494 L549 G550 I552	R486-Y488 HydrophobicContact CB-CE2 3.86Å; R486-Y488 VanDerWaalsContact CD-CZ 3.43Å; R486-Y488 WeakPolarHBondContact CD-OH 3.49Å; R486-Y488 HydrophobicContact CG-CD2 4.35Å; R486-Y488 HydrophobicContact CG-CE1 4.2Å; R486-Y488 HydrophobicContact CG-CE2 3.66Å; R486-Y488 WeakPolarHBondContact O-CD2 3.43Å; R486-Y488 WeakPolarHBondContact O-CE2 3.49Å; R486-S494 PolarHBondContact NH1-OG 2.95Å; R486-L549 WeakPolarHBondContact O-CA 3.37Å; R486-G550 PolarHBondContact N-O 3.02Å; R486-G550 PolarHBondContact O-N 3.22Å; R486-I552 HydrophobicContact CB-CG1 4.27Å
487	L	97.3	Very high	89.1	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	132.5	174.4	-175.1	154.6	0	0	0	109.6	S494 V495 V497 I510 I514 M518 L520 F547 A548 L549 V604	L487-S494 CarbonylContact O-C 3.47Å; L487-S494 WeakPolarHBondContact O-CA 3.42Å; L487-S494 WeakPolarHBondContact O-CB 3.34Å; L487-V495 HydrophobicContact CB-CG1 4.21Å; L487-V495 HydrophobicContact CD2-CG1 4.44Å; L487-V495 PolarHBondContact N-O 3.32Å; L487-V495 PolarHBondContact O-N 2.62Å; L487-V497 HydrophobicContact CB-CG1 3.95Å; L487-V497 HydrophobicContact CB-CG2 3.96Å; L487-V497 HydrophobicContact CD1-CG1 4.19Å; L487-I510 HydrophobicContact CD1-CD1 3.74Å; L487-I514 HydrophobicContact CD1-CG2 4.22Å; L487-M518 HydrophobicContact CD2-CB 4.42Å; L487-M518 HydrophobicContact CD2-CE 3.71Å; L487-M518 HydrophobicContact CD2-CG 3.99Å; L487-L520 HydrophobicContact CD2-CD1 4.46Å; L487-F547 HydrophobicContact CD1-CD2 3.51Å; L487-F547 HydrophobicContact CD1-CE2 3.71Å; L487-F547 HydrophobicContact CD1-CG 3.95Å; L487-F547 HydrophobicContact CD1-CZ 4.3Å; L487-F547 HydrophobicContact CD2-CB 4.21Å; L487-F547 HydrophobicContact CD2-CD2 4.48Å; L487-F547 HydrophobicContact CD2-CG 4.45Å; L487-F547 HydrophobicContact CG-CB 4.24Å; L487-F547 HydrophobicContact CG-CD2 3.64Å; L487-F547 HydrophobicContact CG-CE2 4.27Å; L487-F547 HydrophobicContact CG-CG 4.08Å; L487-A548 CarbonylContact C-O 3.44Å; L487-A548 WeakPolarHBondContact CA-O 3.36Å; L487-L549 HydrophobicContact CB-CD2 3.76Å; L487-L549 HydrophobicContact CD1-CD2 4.2Å; L487-L549 HydrophobicContact CG-CD2 4.06Å; L487-V604 HydrophobicContact CD1-CG2 4.32Å
488	Y	94	Very high	90.5	Very high	58 Å²	58	38.4 Å²	38.4	23%	0.227	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	128.5	177.8	-62.5	-93.1	0	0	0	110.9	R486 A493 F547 A548 Y558	R486-Y488 HydrophobicContact CB-CE2 3.86Å; R486-Y488 VanDerWaalsContact CD-CZ 3.43Å; R486-Y488 WeakPolarHBondContact CD-OH 3.49Å; R486-Y488 HydrophobicContact CG-CD2 4.35Å; R486-Y488 HydrophobicContact CG-CE1 4.2Å; R486-Y488 HydrophobicContact CG-CE2 3.66Å; R486-Y488 WeakPolarHBondContact O-CD2 3.43Å; R486-Y488 WeakPolarHBondContact O-CE2 3.49Å; Y488-A493 WeakPolarHBondContact CA-O 3.26Å; Y488-F547 WeakPolarHBondContact O-CB 3.49Å; Y488-A548 PolarHBondContact N-O 3.46Å; Y488-A548 PolarHBondContact O-N 3.12Å; Y488-Y558 AromaticContact CD2-CD1 3.82Å; Y488-Y558 HydrophobicContact CD2-CD1 3.82Å; Y488-Y558 HydrophobicContact CD2-CE1 4.2Å; Y488-Y558 HydrophobicContact CE1-CE1 4.36Å; Y488-Y558 AromaticContact CE2-CD1 3.34Å; Y488-Y558 HydrophobicContact CE2-CD1 3.34Å; Y488-Y558 AromaticContact CE2-CE1 3.36Å; Y488-Y558 HydrophobicContact CE2-CE1 3.36Å; Y488-Y558 HydrophobicContact CE2-CG 4.49Å; Y488-Y558 AromaticContact CZ-CD1 3.92Å; Y488-Y558 AromaticContact CZ-CE1 3.43Å; Y488-Y558 VanDerWaalsContact CZ-CE1 3.43Å; Y488-Y558 VanDerWaalsContact OH-CE1 3.3Å; Y488-Y558 WeakPolarHBondContact OH-CE1 3.38Å
489	G	88.4	Confident	91.5	Very high	9 Å²	9	36.2 Å²	36.2	9%	0.093	23%	0.226	C	C	.	.			trans	-82.2	168	169.1	0	0	0	0	0	112	D491 G492 A493	G489-D491 PolarHBondContact O-N 3.44Å; G489-G492 PolarHBondContact O-N 3.03Å; G489-G492 VanDerWaalsContact O-N 3.14Å; G489-A493 PolarHBondContact N-O 3.31Å
490	A	80.9	Confident	92	Very high	113 Å²	113	35.8 Å²	35.8	93%	0.934	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-22	178.4	0	0	0	0	0	113.4	G492	A490-G492 VanDerWaalsContact C-N 3.27Å
491	D	80.5	Confident	92.3	Very high	106 Å²	106	33.7 Å²	33.7	57%	0.567	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.5	2.4	176.3	62.7	-9.8	0	0	0	113.3	G489 A493	G489-D491 PolarHBondContact O-N 3.44Å; D491-A493 PolarHBondContact O-N 3.42Å; D491-A493 WeakPolarHBondContact OD1-CB 3.21Å; D491-A493 PolarHBondContact OD1-N 2.96Å
492	G	81.2	Confident	92.3	Very high	56 Å²	56	34.6 Å²	34.6	58%	0.577	22%	0.218	S	C	*	.	S	Bend	trans	80.7	-3.2	-175.9	0	0	0	0	0	114.2	G489 A490	G489-G492 PolarHBondContact O-N 3.03Å; G489-G492 VanDerWaalsContact O-N 3.14Å; A490-G492 VanDerWaalsContact C-N 3.27Å
493	A	87.8	Confident	92	Very high	38 Å²	38	36.8 Å²	36.8	31%	0.314	24%	0.237	S	C	.	.			trans	-60.1	144.6	171.7	0	0	0	0	0	109.6	Y488 G489 D491 M518	Y488-A493 WeakPolarHBondContact CA-O 3.26Å; G489-A493 PolarHBondContact N-O 3.31Å; D491-A493 PolarHBondContact O-N 3.42Å; D491-A493 WeakPolarHBondContact OD1-CB 3.21Å; D491-A493 PolarHBondContact OD1-N 2.96Å; A493-M518 HydrophobicContact CB-CE 4.03Å; A493-M518 WeakPolarHBondContact O-CE 3.32Å
494	S	92.4	Very high	91.4	Very high	51 Å²	51	40 Å²	40	36%	0.357	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	148.4	176.5	75.6	0	0	0	0	113.8	R486 L487	R486-S494 PolarHBondContact NH1-OG 2.95Å; L487-S494 CarbonylContact O-C 3.47Å; L487-S494 WeakPolarHBondContact O-CA 3.42Å; L487-S494 WeakPolarHBondContact O-CB 3.34Å
495	V	95.4	Very high	91.1	Very high	46 Å²	46	39.8 Å²	39.8	28%	0.279	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	145.4	176.5	68	0	0	0	0	110.1	L487 V497 I514 M518	L487-V495 HydrophobicContact CB-CG1 4.21Å; L487-V495 HydrophobicContact CD2-CG1 4.44Å; L487-V495 PolarHBondContact N-O 3.32Å; L487-V495 PolarHBondContact O-N 2.62Å; V495-V497 HydrophobicContact CG1-CG1 3.92Å; V495-I514 HydrophobicContact CG1-CG2 4.38Å; V495-M518 HydrophobicContact CB-SD 3.8Å; V495-M518 HydrophobicContact CG1-CE 4.1Å; V495-M518 HydrophobicContact CG1-CG 3.78Å; V495-M518 HydrophobicContact CG1-SD 3.47Å; V495-M518 WeakPolarHBondContact CG1-SD 3.31Å
496	V	94.5	Very high	90.7	Very high	58 Å²	58	47.7 Å²	47.7	35%	0.352	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	129.3	172.6	170.6	0	0	0	0	108.9	A485 I552	A485-V496 WeakPolarHBondContact O-CA 3.37Å; V496-I552 HydrophobicContact CB-CD1 4.24Å; V496-I552 HydrophobicContact CG1-CD1 3.47Å; V496-I552 VanDerWaalsContact CG1-CD1 3.47Å; V496-I552 HydrophobicContact CG2-CD1 3.87Å
497	V	96.5	Very high	90.6	Very high	1 Å²	1	49.6 Å²	49.6	1%	0.006	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	150.7	-178.7	-65.1	0	0	0	0	110.5	Q484 A485 L487 V495 I514 L549 D603 V604	Q484-V497 WeakPolarHBondContact CA-O 3.43Å; A485-V497 HydrophobicContact CB-CG2 4.25Å; A485-V497 PolarHBondContact N-O 2.72Å; A485-V497 WeakPolarHBondContact O-CG2 3.49Å; A485-V497 PolarHBondContact O-N 2.75Å; L487-V497 HydrophobicContact CB-CG1 3.95Å; L487-V497 HydrophobicContact CB-CG2 3.96Å; L487-V497 HydrophobicContact CD1-CG1 4.19Å; V495-V497 HydrophobicContact CG1-CG1 3.92Å; V497-I514 HydrophobicContact CG1-CG2 4.08Å; V497-L549 HydrophobicContact CG2-CD2 3.93Å; V497-D603 HydrophobicContact CB-CB 3.8Å; V497-D603 HydrophobicContact CG1-CB 4.07Å; V497-V604 HydrophobicContact CB-CG2 4.38Å; V497-V604 HydrophobicContact CG2-CG2 4.14Å
498	T	95.9	Very high	90.6	Very high	4 Å²	4	49.7 Å²	49.7	3%	0.025	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	124.4	167.4	-66.5	0	0	0	0	110.6	V600 D603 V604	T498-V600 HydrophobicContact CG2-CG1 3.85Å; T498-V600 WeakPolarHBondContact OG1-CG2 3.45Å; T498-D603 PolarHBondContact N-OD2 3.38Å; T498-D603 VanDerWaalsContact N-OD2 3.09Å; T498-D603 PolarHBondContact O-N 2.96Å; T498-V604 PolarHBondContact O-N 2.85Å; T498-V604 VanDerWaalsContact O-N 3.14Å
499	C	96.6	Very high	90.7	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	138.5	179.3	-60.4	0	0	0	0	111	T482 A483 F501 V604 I606	T482-C499 WeakPolarHBondContact CA-O 3.49Å; A483-C499 PolarHBondContact N-O 3.34Å; A483-C499 PolarHBondContact O-N 3.03Å; C499-F501 HydrophobicContact CB-CE2 4.41Å; C499-V604 CarbonylContact C-O 3.58Å; C499-V604 VanDerWaalsContact CA-O 3.27Å; C499-V604 WeakPolarHBondContact CA-O 3.33Å; C499-I606 HydrophobicContact CB-CD1 4.06Å
500	L	95.6	Very high	91.1	Very high	7 Å²	7	47.7 Å²	47.7	4%	0.037	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	123.4	168.6	177.9	66.1	0	0	0	109	L480 T482 V602 V604 L605 I606	L480-L500 HydrophobicContact CB-CD1 3.93Å; L480-L500 HydrophobicContact CD1-CD1 4.12Å; T482-L500 HydrophobicContact CG2-CD1 3.89Å; L500-V602 HydrophobicContact CB-CG1 3.65Å; L500-V602 HydrophobicContact CB-CG2 4.1Å; L500-V604 PolarHBondContact N-O 3.34Å; L500-L605 CarbonylContact O-C 3.6Å; L500-L605 WeakPolarHBondContact O-CA 3.44Å; L500-I606 PolarHBondContact O-N 2.87Å
501	F	95.7	Very high	91.9	Very high	9 Å²	9	42.9 Å²	42.9	4%	0.039	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	117.7	174.5	-73	-95.6	0	0	0	109.6	Q481 A483 C499 I606 Y611 F614 V615 L634 I637	Q481-F501 HydrophobicContact CB-CB 3.77Å; Q481-F501 PolarHBondContact O-N 2.82Å; A483-F501 HydrophobicContact CB-CE2 3.92Å; C499-F501 HydrophobicContact CB-CE2 4.41Å; F501-I606 HydrophobicContact CD1-CB 4Å; F501-I606 HydrophobicContact CD1-CD1 4.16Å; F501-I606 HydrophobicContact CD1-CG2 3.94Å; F501-I606 HydrophobicContact CD2-CD1 4.46Å; F501-I606 HydrophobicContact CE1-CB 4.12Å; F501-I606 HydrophobicContact CE1-CD1 3.53Å; F501-I606 HydrophobicContact CE1-CG1 4.43Å; F501-I606 HydrophobicContact CE1-CG2 3.9Å; F501-I606 HydrophobicContact CE2-CD1 3.9Å; F501-I606 HydrophobicContact CG-CB 4.48Å; F501-I606 HydrophobicContact CZ-CD1 3.39Å; F501-Y611 HydrophobicContact CB-CD2 4.19Å; F501-Y611 HydrophobicContact CB-CE2 3.8Å; F501-Y611 HydrophobicContact CD1-CD2 4.06Å; F501-Y611 HydrophobicContact CD1-CE2 4.2Å; F501-Y611 HydrophobicContact CG-CE2 4.49Å; F501-F614 HydrophobicContact CE1-CB 3.58Å; F501-F614 HydrophobicContact CE1-CD2 4.08Å; F501-F614 AromaticContact CE1-CG 3.95Å; F501-F614 HydrophobicContact CE1-CG 3.95Å; F501-F614 HydrophobicContact CZ-CB 3.86Å; F501-F614 HydrophobicContact CZ-CD2 4.5Å; F501-F614 HydrophobicContact CZ-CG 4.08Å; F501-V615 HydrophobicContact CD1-CG2 4.16Å; F501-V615 HydrophobicContact CE1-CG2 4.24Å; F501-L634 HydrophobicContact CE2-CD1 4.36Å; F501-L634 HydrophobicContact CZ-CD1 4.07Å; F501-I637 HydrophobicContact CD2-CD1 3.79Å; F501-I637 HydrophobicContact CE2-CD1 3.56Å; F501-I637 HydrophobicContact CG-CD1 4.4Å; F501-I637 HydrophobicContact CZ-CD1 4.01Å
502	D	91.1	Very high	92.5	Very high	54 Å²	54	42.9 Å²	42.9	29%	0.289	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	96.9	-175.5	-175	5.7	0	0	0	110.8	G504 S505 L605 I606	D502-G504 PolarHBondContact O-N 3.08Å; D502-G504 VanDerWaalsContact O-N 3.17Å; D502-G504 VanDerWaalsContact OD1-CA 3.29Å; D502-G504 WeakPolarHBondContact OD1-CA 3.32Å; D502-G504 PolarHBondContact OD1-N 2.86Å; D502-S505 PolarHBondContact O-N 3.31Å; D502-L605 HydrophobicContact CB-CD1 4.37Å; D502-L605 HydrophobicContact CB-CD2 3.98Å; D502-L605 HydrophobicContact CB-CG 4.15Å; D502-I606 PolarHBondContact N-O 3.45Å
503	A	86.8	Confident	93.1	Very high	57 Å²	57	46 Å²	46	47%	0.471	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-12.8	173.8	0	0	0	0	0	113.1	L608 Y611	A503-L608 HydrophobicContact CB-CD1 3.7Å; A503-Y611 HydrophobicContact CB-CD2 4.43Å; A503-Y611 HydrophobicContact CB-CE2 4.21Å
504	G	82.8	Confident	93.4	Very high	68 Å²	68	44.5 Å²	44.5	70%	0.701	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-15.4	171.9	0	0	0	0	0	114	D502	D502-G504 PolarHBondContact O-N 3.08Å; D502-G504 VanDerWaalsContact O-N 3.17Å; D502-G504 VanDerWaalsContact OD1-CA 3.29Å; D502-G504 WeakPolarHBondContact OD1-CA 3.32Å; D502-G504 PolarHBondContact OD1-N 2.86Å
505	S	88.9	Confident	93.5	Very high	18 Å²	18	42.1 Å²	42.1	13%	0.126	23%	0.225	C	C	.	.			trans	-93.8	125.7	177.7	-173	0	0	0	0	111.4	D502 R507 G607 L608	D502-S505 PolarHBondContact O-N 3.31Å; S505-R507 PolarHBondContact O-N 3.16Å; S505-R507 PolarHBondContact OG-N 3.26Å; S505-R507 PolarHBondContact OG-O 3.19Å; S505-G607 CarbonylContact O-C 3.54Å; S505-G607 VanDerWaalsContact O-CA 3.26Å; S505-G607 WeakPolarHBondContact O-CA 2.83Å; S505-L608 PolarHBondContact O-N 2.78Å
506	Q	86	Confident	93.4	Very high	167 Å²	167	43.3 Å²	43.3	78%	0.78	23%	0.23	S	C	*	.	S	Bend	trans	-75	-13.7	176.1	-62.9	-179.4	-40.5	0	0	113.6
507	R	93.4	Very high	93.3	Very high	121 Å²	121	45.9 Å²	45.9	46%	0.457	24%	0.242	S	C	.	.	S	Bend	trans	-134.8	149.4	-175.5	-74.8	-70.7	-177.6	-108.9	3.9	111.2	S505 F509 D609	S505-R507 PolarHBondContact O-N 3.16Å; S505-R507 PolarHBondContact OG-N 3.26Å; S505-R507 PolarHBondContact OG-O 3.19Å; R507-F509 HydrophobicContact CB-CE2 3.92Å; R507-F509 HydrophobicContact CB-CZ 3.98Å; R507-F509 VanDerWaalsContact O-CD2 3.31Å; R507-F509 WeakPolarHBondContact O-CD2 3.41Å; R507-F509 VanDerWaalsContact O-CE2 3.28Å; R507-F509 WeakPolarHBondContact O-CE2 3.43Å; R507-D609 VanDerWaalsContact CA-OD2 3.3Å; R507-D609 WeakPolarHBondContact CA-OD2 3.47Å
508	S	97.4	Very high	93.2	Very high	2 Å²	2	46.7 Å²	46.7	1%	0.014	25%	0.245	C	C	.	.			trans	-87.3	145	171.4	-65.8	0	0	0	0	112.1	M561 A563 L564 L605 G607 D609	S508-M561 VanDerWaalsContact CB-CE 3.41Å; S508-A563 WeakPolarHBondContact O-CA 3.34Å; S508-L564 PolarHBondContact O-N 3.01Å; S508-L605 CarbonylContact C-O 3.43Å; S508-L605 VanDerWaalsContact CA-O 3.23Å; S508-L605 WeakPolarHBondContact CA-O 3.39Å; S508-L605 WeakPolarHBondContact CB-O 3.38Å; S508-G607 PolarHBondContact OG-N 2.91Å; S508-D609 PolarHBondContact N-OD1 2.81Å; S508-D609 PolarHBondContact N-OD2 2.84Å; S508-D609 PolarHBondContact OG-OD1 3.27Å
509	F	97.1	Very high	92.9	Very high	26 Å²	26	55.7 Å²	55.7	11%	0.114	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	150.2	-176.1	-63.1	-86.3	0	0	0	112.1	R507 I529 L564 V566 V604 L605	R507-F509 HydrophobicContact CB-CE2 3.92Å; R507-F509 HydrophobicContact CB-CZ 3.98Å; R507-F509 VanDerWaalsContact O-CD2 3.31Å; R507-F509 WeakPolarHBondContact O-CD2 3.41Å; R507-F509 VanDerWaalsContact O-CE2 3.28Å; R507-F509 WeakPolarHBondContact O-CE2 3.43Å; F509-I529 HydrophobicContact CE1-CD1 4.11Å; F509-L564 VanDerWaalsContact CA-O 3.31Å; F509-L564 WeakPolarHBondContact CA-O 3.44Å; F509-L564 HydrophobicContact CD1-CB 3.66Å; F509-L564 HydrophobicContact CE1-CB 3.85Å; F509-L564 HydrophobicContact CE1-CD1 3.95Å; F509-V566 HydrophobicContact CB-CG2 4.05Å; F509-V566 HydrophobicContact CD1-CG1 3.64Å; F509-V566 HydrophobicContact CD1-CG2 4.34Å; F509-V566 HydrophobicContact CE1-CG1 4.12Å; F509-V604 CarbonylContact O-C 3.58Å; F509-V604 WeakPolarHBondContact O-CA 3.47Å; F509-L605 HydrophobicContact CB-CB 4.34Å; F509-L605 HydrophobicContact CD2-CD2 4.26Å; F509-L605 PolarHBondContact N-O 2.91Å; F509-L605 PolarHBondContact O-N 3.34Å
510	I	97.6	Very high	92.7	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	141.4	175.3	-175.3	166.4	0	0	0	110.3	L487 K512 I514 A515 L520 V545 F547 A563 L564 C565 V566 V604	L487-I510 HydrophobicContact CD1-CD1 3.74Å; I510-K512 PolarHBondContact O-N 3.31Å; I510-I514 HydrophobicContact CD1-CG2 4.07Å; I510-I514 HydrophobicContact CG1-CB 4.4Å; I510-I514 HydrophobicContact CG1-CG2 4.44Å; I510-A515 HydrophobicContact CD1-CB 4.35Å; I510-A515 HydrophobicContact CG1-CB 4.48Å; I510-A515 HydrophobicContact CG2-CB 4.21Å; I510-L520 HydrophobicContact CD1-CD1 4.04Å; I510-V545 HydrophobicContact CG2-CG2 3.61Å; I510-F547 HydrophobicContact CB-CE1 4.27Å; I510-F547 HydrophobicContact CB-CZ 4.48Å; I510-F547 HydrophobicContact CD1-CD1 4.1Å; I510-F547 HydrophobicContact CD1-CE1 3.66Å; I510-F547 HydrophobicContact CD1-CZ 3.96Å; I510-F547 HydrophobicContact CG2-CE1 4.43Å; I510-A563 HydrophobicContact CB-CB 4.08Å; I510-A563 HydrophobicContact CG2-CB 3.98Å; I510-L564 PolarHBondContact N-O 3Å; I510-C565 WeakPolarHBondContact O-CA 3.5Å; I510-V566 PolarHBondContact O-N 2.87Å; I510-V604 HydrophobicContact CD1-CG2 4.39Å; I510-V604 HydrophobicContact CG1-CG2 4.21Å
511	C	96	Very high	92.4	Very high	11 Å²	11	63.5 Å²	63.5	7%	0.074	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	126.8	174.4	-176.1	0	0	0	0	110.2	R513 I514 A515 V566 D603	C511-R513 PolarHBondContact O-N 3.41Å; C511-R513 VanDerWaalsContact O-N 3.16Å; C511-I514 HydrophobicContact CB-CG1 4.28Å; C511-I514 PolarHBondContact O-N 3.16Å; C511-A515 PolarHBondContact O-N 3.41Å; C511-A515 VanDerWaalsContact O-N 3.08Å; C511-V566 CarbonylContact C-O 3.42Å; C511-V566 WeakPolarHBondContact CA-O 3.16Å; C511-D603 WeakPolarHBondContact CB-O 3.46Å; C511-D603 PolarHBondContact N-O 3.3Å
512	K	93.1	Very high	92.1	Very high	107 Å²	107	64.8 Å²	64.8	47%	0.465	33%	0.331	S	S	.	.	H	α-helix	trans	-53.7	-39.3	-177.9	-176.9	177.6	176.9	-174.8	0	111.9	I510 I514 A515 D516 V566	I510-K512 PolarHBondContact O-N 3.31Å; K512-I514 VanDerWaalsContact C-N 3.32Å; K512-I514 PolarHBondContact O-N 2.94Å; K512-A515 PolarHBondContact O-N 2.93Å; K512-D516 VanDerWaalsContact CE-OD2 3.25Å; K512-D516 WeakPolarHBondContact CE-OD2 3.5Å; K512-D516 WeakPolarHBondContact CG-OD2 3.47Å; K512-D516 WeakPolarHBondContact O-CB 3.37Å; K512-D516 PolarHBondContact O-N 2.79Å; K512-V566 PolarHBondContact N-O 2.86Å
513	R	93.6	Very high	92.1	Very high	121 Å²	121	69 Å²	69	46%	0.457	35%	0.354	S	S	.	.	H	α-helix	trans	-55.1	-45.3	175.3	178.9	-178.6	59.2	74.2	6	112.2	C511 N517 D603	C511-R513 PolarHBondContact O-N 3.41Å; C511-R513 VanDerWaalsContact O-N 3.16Å; R513-N517 VanDerWaalsContact O-CB 3.28Å; R513-N517 WeakPolarHBondContact O-CB 3.23Å; R513-N517 PolarHBondContact O-N 3Å; R513-N517 PolarHBondContact O-OD1 2.81Å; R513-D603 IonicContact NH2-OD1 3.78Å; R513-D603 PolarHBondContact NH2-OD1 2.99Å
514	I	95.6	Very high	92.2	Very high	7 Å²	7	69.8 Å²	69.8	4%	0.036	35%	0.353	C	S	.	.	H	α-helix	trans	-70.3	-46	-180	-62.2	-66.7	0	0	0	110.2	L487 V495 V497 I510 C511 K512 D516 N517 M518 D603	L487-I514 HydrophobicContact CD1-CG2 4.22Å; V495-I514 HydrophobicContact CG1-CG2 4.38Å; V497-I514 HydrophobicContact CG1-CG2 4.08Å; I510-I514 HydrophobicContact CD1-CG2 4.07Å; I510-I514 HydrophobicContact CG1-CB 4.4Å; I510-I514 HydrophobicContact CG1-CG2 4.44Å; C511-I514 HydrophobicContact CB-CG1 4.28Å; C511-I514 PolarHBondContact O-N 3.16Å; K512-I514 VanDerWaalsContact C-N 3.32Å; K512-I514 PolarHBondContact O-N 2.94Å; I514-D516 VanDerWaalsContact C-N 3.3Å; I514-D516 PolarHBondContact O-N 3.41Å; I514-N517 PolarHBondContact O-N 3.14Å; I514-M518 HydrophobicContact CG2-CG 4.25Å; I514-M518 VanDerWaalsContact O-CB 3.3Å; I514-M518 WeakPolarHBondContact O-CB 3.47Å; I514-M518 VanDerWaalsContact O-CG 3.31Å; I514-M518 WeakPolarHBondContact O-CG 3.38Å; I514-M518 PolarHBondContact O-N 3.29Å; I514-D603 HydrophobicContact CG1-CB 4.02Å; I514-D603 WeakPolarHBondContact CG1-OD1 3.49Å
515	A	94.1	Very high	92.2	Very high	0 Å²	0	69.5 Å²	69.5	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-60.7	-38.8	178.7	0	0	0	0	0	112.8	I510 C511 K512 R519 L520 C565	I510-A515 HydrophobicContact CD1-CB 4.35Å; I510-A515 HydrophobicContact CG1-CB 4.48Å; I510-A515 HydrophobicContact CG2-CB 4.21Å; C511-A515 PolarHBondContact O-N 3.41Å; C511-A515 VanDerWaalsContact O-N 3.08Å; K512-A515 PolarHBondContact O-N 2.93Å; A515-R519 PolarHBondContact O-N 3.24Å; A515-L520 HydrophobicContact CB-CD1 4.43Å; A515-L520 PolarHBondContact O-N 2.96Å; A515-C565 VanDerWaalsContact CB-SG 3.5Å
516	D	93.9	Very high	91.7	Very high	72 Å²	72	73 Å²	73	39%	0.385	36%	0.356	S	S	.	.	H	α-helix	trans	-72.2	-44.7	177.8	-66.1	-10.7	0	0	0	111.1	K512 I514 M518 R519 R543	K512-D516 VanDerWaalsContact CE-OD2 3.25Å; K512-D516 WeakPolarHBondContact CE-OD2 3.5Å; K512-D516 WeakPolarHBondContact CG-OD2 3.47Å; K512-D516 WeakPolarHBondContact O-CB 3.37Å; K512-D516 PolarHBondContact O-N 2.79Å; I514-D516 VanDerWaalsContact C-N 3.3Å; I514-D516 PolarHBondContact O-N 3.41Å; D516-M518 VanDerWaalsContact C-N 3.34Å; D516-M518 PolarHBondContact O-N 3.41Å; D516-R519 WeakPolarHBondContact O-CA 3.39Å; D516-R519 PolarHBondContact O-N 3.33Å; D516-R543 IonicContact OD1-CZ 3.05Å; D516-R543 IonicContact OD1-NH2 2.75Å; D516-R543 PolarHBondContact OD1-NH2 3.36Å
517	N	92.3	Very high	91.4	Very high	112 Å²	112	66.4 Å²	66.4	60%	0.599	33%	0.328	S	S	*	.	H	α-helix	trans	-63.2	-38.6	177.9	-74.7	-1.3	0	0	0	112.8	R513 I514 R519	R513-N517 VanDerWaalsContact O-CB 3.28Å; R513-N517 WeakPolarHBondContact O-CB 3.23Å; R513-N517 PolarHBondContact O-N 3Å; R513-N517 PolarHBondContact O-OD1 2.81Å; I514-N517 PolarHBondContact O-N 3.14Å; N517-R519 PolarHBondContact O-N 3.45Å
518	M	93.2	Very high	90.6	Very high	17 Å²	17	63.9 Å²	63.9	8%	0.084	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82	5	175.3	-65.3	-62.9	-67.6	0	0	112.7	L487 A493 V495 I514 D516 L520	L487-M518 HydrophobicContact CD2-CB 4.42Å; L487-M518 HydrophobicContact CD2-CE 3.71Å; L487-M518 HydrophobicContact CD2-CG 3.99Å; A493-M518 HydrophobicContact CB-CE 4.03Å; A493-M518 WeakPolarHBondContact O-CE 3.32Å; V495-M518 HydrophobicContact CB-SD 3.8Å; V495-M518 HydrophobicContact CG1-CE 4.1Å; V495-M518 HydrophobicContact CG1-CG 3.78Å; V495-M518 HydrophobicContact CG1-SD 3.47Å; V495-M518 WeakPolarHBondContact CG1-SD 3.31Å; I514-M518 HydrophobicContact CG2-CG 4.25Å; I514-M518 VanDerWaalsContact O-CB 3.3Å; I514-M518 WeakPolarHBondContact O-CB 3.47Å; I514-M518 VanDerWaalsContact O-CG 3.31Å; I514-M518 WeakPolarHBondContact O-CG 3.38Å; I514-M518 PolarHBondContact O-N 3.29Å; D516-M518 VanDerWaalsContact C-N 3.34Å; D516-M518 PolarHBondContact O-N 3.41Å; M518-L520 HydrophobicContact CB-CD1 4.33Å; M518-L520 HydrophobicContact CB-CD2 4.14Å; M518-L520 HydrophobicContact CB-CG 3.82Å; M518-L520 PolarHBondContact O-N 3.38Å
519	R	89.6	Confident	89.6	Confident	194 Å²	194	66.7 Å²	66.7	73%	0.732	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.1	30.4	178.6	-56.5	177.9	-178	179.6	0.7	113.6	A515 D516 N517 Q521	A515-R519 PolarHBondContact O-N 3.24Å; D516-R519 WeakPolarHBondContact O-CA 3.39Å; D516-R519 PolarHBondContact O-N 3.33Å; N517-R519 PolarHBondContact O-N 3.45Å; R519-Q521 PolarHBondContact O-N 2.93Å
520	L	93.2	Very high	88.2	Confident	8 Å²	8	72 Å²	72	4%	0.042	37%	0.365	C	S	.	.			trans	-66.9	126.5	-179.2	-57.2	179.5	0	0	0	108.8	L487 I510 A515 M518 R543 V545 F547	L487-L520 HydrophobicContact CD2-CD1 4.46Å; I510-L520 HydrophobicContact CD1-CD1 4.04Å; A515-L520 HydrophobicContact CB-CD1 4.43Å; A515-L520 PolarHBondContact O-N 2.96Å; M518-L520 HydrophobicContact CB-CD1 4.33Å; M518-L520 HydrophobicContact CB-CD2 4.14Å; M518-L520 HydrophobicContact CB-CG 3.82Å; M518-L520 PolarHBondContact O-N 3.38Å; L520-R543 PolarHBondContact O-NH1 3.46Å; L520-R543 PolarHBondContact O-NH2 3.11Å; L520-V545 HydrophobicContact CB-CB 3.9Å; L520-V545 HydrophobicContact CB-CG1 3.89Å; L520-V545 HydrophobicContact CB-CG2 4.42Å; L520-V545 HydrophobicContact CD1-CB 4.42Å; L520-V545 HydrophobicContact CD1-CG2 4.15Å; L520-F547 HydrophobicContact CD1-CB 4.04Å; L520-F547 HydrophobicContact CD1-CD1 3.85Å; L520-F547 HydrophobicContact CD1-CG 4.21Å; L520-F547 HydrophobicContact CD2-CB 4.31Å
521	Q	89.3	Confident	87	Confident	163 Å²	163	73.6 Å²	73.6	76%	0.762	38%	0.378	S	S	*	.			trans	-104.3	157.2	-177.5	-67.3	-96.6	-9.7	0	0	110.1	R519	R519-Q521 PolarHBondContact O-N 2.93Å
522	G	89.3	Confident	85.1	Confident	36 Å²	36	82 Å²	82	37%	0.371	41%	0.413	S	S	.	.			trans	162.7	175.4	171.7	0	0	0	0	0	113.7	R543 R544	G522-R543 WeakPolarHBondContact O-CG 3.36Å; G522-R544 CarbonylContact C-O 3.53Å; G522-R544 WeakPolarHBondContact CA-O 3.44Å
523	N	90.2	Very high	83.1	Confident	141 Å²	141	80.8 Å²	80.8	75%	0.754	43%	0.432	S	S	*	.			trans	-73.3	146.1	-171.4	-67.3	-29.5	0	0	0	111.9	R544	N523-R544 PolarHBondContact O-N 3Å
524	T	89.1	Confident	81.1	Confident	74 Å²	74	77.1 Å²	77.1	45%	0.454	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	129.1	173.3	-57.9	0	0	0	0	110.3	R541 C542	T524-R541 HydrophobicContact CG2-CB 4.01Å; T524-C542 WeakPolarHBondContact CA-O 3.28Å
525	E	83.4	Confident	78.8	Confident	63 Å²	63	82.5 Å²	82.5	29%	0.294	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	156.7	174.7	55.3	-179.6	-129.8	0	0	110.7	V527 R541 C542 R544 L564	E525-V527 HydrophobicContact CG-CG2 3.79Å; E525-V527 WeakPolarHBondContact OE1-CG2 3.44Å; E525-R541 CarbonylContact O-C 3.56Å; E525-R541 WeakPolarHBondContact O-CA 3.46Å; E525-C542 PolarHBondContact N-O 3.4Å; E525-C542 PolarHBondContact O-N 3.31Å; E525-R544 IonicContact OE1-CZ 3.77Å; E525-R544 IonicContact OE1-NE 2.76Å; E525-R544 IonicContact OE1-NH2 3.87Å; E525-R544 PolarHBondContact OE1-NH2 2.93Å; E525-R544 IonicContact OE2-CZ 3.77Å; E525-R544 IonicContact OE2-NE 3.6Å; E525-R544 PolarHBondContact OE2-NE 3.37Å; E525-R544 IonicContact OE2-NH2 3.62Å; E525-R544 PolarHBondContact OE2-NH2 3.32Å; E525-L564 HydrophobicContact CG-CD2 3.95Å; E525-L564 WeakPolarHBondContact OE1-CD2 3.45Å
526	C	79.1	Confident	76.6	Confident	90 Å²	90	88 Å²	88	61%	0.608	49%	0.491	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.7	116.7	175.6	-155.9	0	0	0	0	108.7
527	V	79.8	Confident	74.9	Confident	30 Å²	30	86.1 Å²	86.1	18%	0.182	49%	0.486	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	134.3	-175.7	-170.4	0	0	0	0	109.2	E525 T540 C542 L564	E525-V527 HydrophobicContact CG-CG2 3.79Å; E525-V527 WeakPolarHBondContact OE1-CG2 3.44Å; V527-T540 PolarHBondContact N-O 3.4Å; V527-T540 PolarHBondContact O-N 3.17Å; V527-C542 HydrophobicContact CG2-CB 4.46Å; V527-L564 HydrophobicContact CB-CD1 4.34Å; V527-L564 HydrophobicContact CG1-CD1 4.16Å; V527-L564 HydrophobicContact CG2-CD1 3.8Å; V527-L564 HydrophobicContact CG2-CD2 4.46Å
528	T	75.8	Confident	73.2	Confident	68 Å²	68	88 Å²	88	42%	0.417	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	115.3	175.2	-52.2	0	0	0	0	109	A537	T528-A537 HydrophobicContact CG2-CB 3.31Å
529	I	75.9	Confident	72.1	Confident	61 Å²	61	91.4 Å²	91.4	31%	0.313	51%	0.512	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	124	-178.9	-55.3	176.2	0	0	0	108.6	F509 K538 V566	F509-I529 HydrophobicContact CE1-CD1 4.11Å; I529-K538 PolarHBondContact N-O 3.43Å; I529-V566 HydrophobicContact CD1-CG1 4.05Å
530	H	68.5	Low	71.5	Confident	138 Å²	138	84.1 Å²	84.1	64%	0.639	49%	0.489	S	S	*	.			trans	-105	118.4	175.3	-69.5	-96.8	0	0	0	109.2	A537	H530-A537 WeakPolarHBondContact CE1-CB 3.25Å; H530-A537 WeakPolarHBondContact ND1-CB 3.38Å
531	A	71.4	Confident	71	Confident	32 Å²	32	93.1 Å²	93.1	26%	0.264	52%	0.522	S	S	.	.			trans	-96.1	152.9	171.9	0	0	0	0	0	111	G533 S534 M654	A531-G533 PolarHBondContact O-N 3.02Å; A531-S534 PolarHBondContact N-OG 2.89Å; A531-S534 PolarHBondContact O-N 3.1Å; A531-S534 PolarHBondContact O-OG 3.4Å; A531-M654 HydrophobicContact CB-CE 3.48Å; A531-M654 VanDerWaalsContact CB-CE 3.48Å; A531-M654 HydrophobicContact CB-SD 3.91Å
532	F	56.9	Low	71	Confident	188 Å²	188	85.3 Å²	85.3	83%	0.825	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	124.2	177.9	-169.2	-93.2	0	0	0	110.7	S534	F532-S534 VanDerWaalsContact C-N 3.28Å; F532-S534 PolarHBondContact O-N 3.21Å
533	G	50.6	Low	71.2	Confident	82 Å²	82	86.2 Å²	86.2	85%	0.845	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.3	-1.3	-179.8	0	0	0	0	0	116.4	A531	A531-G533 PolarHBondContact O-N 3.02Å
534	S	51.4	Low	71.5	Confident	43 Å²	43	82.6 Å²	82.6	30%	0.301	45%	0.454	S	S	.	.			trans	-86.3	130.3	178.7	79.4	0	0	0	0	112.1	A531 F532	A531-S534 PolarHBondContact N-OG 2.89Å; A531-S534 PolarHBondContact O-N 3.1Å; A531-S534 PolarHBondContact O-OG 3.4Å; F532-S534 VanDerWaalsContact C-N 3.28Å; F532-S534 PolarHBondContact O-N 3.21Å
535	S	47.2	Very low	71.8	Confident	121 Å²	121	79.1 Å²	79.1	85%	0.846	43%	0.433	S	S	*	.	S	Bend	trans	-84.6	-14.2	168.5	57.6	0	0	0	0	112.7	A537	S535-A537 PolarHBondContact O-N 3.18Å
536	L	48.1	Very low	72.4	Confident	114 Å²	114	78.8 Å²	78.8	60%	0.597	44%	0.435	S	S	*	.			trans	-97.7	80.8	-178	-80.6	138.5	0	0	0	110.8	K538	L536-K538 PolarHBondContact O-N 3.04Å
537	A	58	Low	73.2	Confident	33 Å²	33	74.8 Å²	74.8	27%	0.273	41%	0.408	S	S	.	.			trans	-69.7	114.7	167.3	0	0	0	0	0	108.6	T528 H530 S535 P539	T528-A537 HydrophobicContact CG2-CB 3.31Å; H530-A537 WeakPolarHBondContact CE1-CB 3.25Å; H530-A537 WeakPolarHBondContact ND1-CB 3.38Å; S535-A537 PolarHBondContact O-N 3.18Å; A537-P539 WeakPolarHBondContact O-CD 3.42Å
538	K	56	Low	74	Confident	153 Å²	153	74.4 Å²	74.4	67%	0.665	41%	0.407	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96	117	-175.8	-164.7	173	-176.9	176.3	0	110.5	I529 L536 T540	I529-K538 PolarHBondContact N-O 3.43Å; L536-K538 PolarHBondContact O-N 3.04Å; K538-T540 PolarHBondContact O-N 3.44Å; K538-T540 VanDerWaalsContact O-N 3.1Å; K538-T540 PolarHBondContact O-OG1 2.95Å
539	P	71.2	Confident	75	Confident	88 Å²	88	71.1 Å²	71.1	57%	0.571	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59.7	116.8	168.2	-16.6	29.2	0	0	0	108.5	A537	A537-P539 WeakPolarHBondContact O-CD 3.42Å
540	T	76.9	Confident	75.9	Confident	40 Å²	40	68.2 Å²	68.2	25%	0.245	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	126.8	-174.8	-55.1	0	0	0	0	108.2	V527 K538 C542	V527-T540 PolarHBondContact N-O 3.4Å; V527-T540 PolarHBondContact O-N 3.17Å; K538-T540 PolarHBondContact O-N 3.44Å; K538-T540 VanDerWaalsContact O-N 3.1Å; K538-T540 PolarHBondContact O-OG1 2.95Å; T540-C542 PolarHBondContact O-N 3.46Å
541	R	81.9	Confident	77.1	Confident	197 Å²	197	62.2 Å²	62.2	74%	0.743	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.5	110.3	172.6	-72.3	-176	64.1	161.4	0	108.6	T524 E525	T524-R541 HydrophobicContact CG2-CB 4.01Å; E525-R541 CarbonylContact O-C 3.56Å; E525-R541 WeakPolarHBondContact O-CA 3.46Å
542	C	89.4	Confident	77.9	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	132.5	-177.8	-62.9	0	0	0	0	109.7	T524 E525 V527 T540 L564	T524-C542 WeakPolarHBondContact CA-O 3.28Å; E525-C542 PolarHBondContact N-O 3.4Å; E525-C542 PolarHBondContact O-N 3.31Å; V527-C542 HydrophobicContact CG2-CB 4.46Å; T540-C542 PolarHBondContact O-N 3.46Å; C542-L564 HydrophobicContact CB-CB 3.95Å; C542-L564 HydrophobicContact CB-CD2 3.98Å; C542-L564 HydrophobicContact CB-CG 4.37Å
543	R	94.3	Very high	78.9	Confident	54 Å²	54	58.3 Å²	58.3	20%	0.204	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	118.5	171.3	-178.2	169.2	63.7	142	7.3	108.7	D516 L520 G522 V545 C565	D516-R543 IonicContact OD1-CZ 3.05Å; D516-R543 IonicContact OD1-NH2 2.75Å; D516-R543 PolarHBondContact OD1-NH2 3.36Å; L520-R543 PolarHBondContact O-NH1 3.46Å; L520-R543 PolarHBondContact O-NH2 3.11Å; G522-R543 WeakPolarHBondContact O-CG 3.36Å; R543-V545 HydrophobicContact CG-CG1 4Å; R543-C565 HydrophobicContact CB-CB 4.05Å; R543-C565 WeakPolarHBondContact O-CB 3.3Å; R543-C565 PolarHBondContact O-N 3.39Å; R543-C565 PolarHBondContact O-SG 3.33Å
544	R	95.5	Very high	79.9	Confident	65 Å²	65	56.1 Å²	56.1	25%	0.245	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	128.4	171.3	-178.7	-178.4	-68.2	-91.9	-7	108.2	G522 N523 E525 E562 A563 L564	G522-R544 CarbonylContact C-O 3.53Å; G522-R544 WeakPolarHBondContact CA-O 3.44Å; N523-R544 PolarHBondContact O-N 3Å; E525-R544 IonicContact OE1-CZ 3.77Å; E525-R544 IonicContact OE1-NE 2.76Å; E525-R544 IonicContact OE1-NH2 3.87Å; E525-R544 PolarHBondContact OE1-NH2 2.93Å; E525-R544 IonicContact OE2-CZ 3.77Å; E525-R544 IonicContact OE2-NE 3.6Å; E525-R544 PolarHBondContact OE2-NE 3.37Å; E525-R544 IonicContact OE2-NH2 3.62Å; E525-R544 PolarHBondContact OE2-NH2 3.32Å; R544-E562 WeakPolarHBondContact CD-OE2 3.31Å; R544-E562 IonicContact CZ-OE2 3.08Å; R544-E562 IonicContact NH1-OE2 3.66Å; R544-E562 PolarHBondContact NH1-OE2 2.91Å; R544-A563 WeakPolarHBondContact CA-O 3.5Å; R544-L564 HydrophobicContact CB-CD2 4.01Å
545	V	96.5	Very high	80.8	Confident	1 Å²	1	58.2 Å²	58.2	1%	0.006	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	152.2	178.3	-64.6	0	0	0	0	110.1	I510 L520 R543 F547 E562 A563	I510-V545 HydrophobicContact CG2-CG2 3.61Å; L520-V545 HydrophobicContact CB-CB 3.9Å; L520-V545 HydrophobicContact CB-CG1 3.89Å; L520-V545 HydrophobicContact CB-CG2 4.42Å; L520-V545 HydrophobicContact CD1-CB 4.42Å; L520-V545 HydrophobicContact CD1-CG2 4.15Å; R543-V545 HydrophobicContact CG-CG1 4Å; V545-F547 HydrophobicContact CG2-CD1 4.18Å; V545-F547 HydrophobicContact CG2-CE1 4.22Å; V545-E562 CarbonylContact O-C 3.58Å; V545-E562 WeakPolarHBondContact O-CA 3.37Å; V545-A563 PolarHBondContact N-O 3.48Å; V545-A563 PolarHBondContact O-N 3.12Å
546	T	95.9	Very high	82	Confident	57 Å²	57	54.5 Å²	54.5	35%	0.35	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	134.8	178.2	-47.4	0	0	0	0	109.2	Q560 M561 E562	T546-Q560 HydrophobicContact CG2-CG 3.94Å; T546-M561 WeakPolarHBondContact CA-O 3.31Å; T546-E562 HydrophobicContact CG2-CG 4.37Å
547	F	96.9	Very high	83.5	Confident	6 Å²	6	52.8 Å²	52.8	3%	0.026	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	173.3	177.4	56	-88.4	0	0	0	109.9	L487 Y488 I510 L520 V545 L549 Q560 M561 A563 V604	L487-F547 HydrophobicContact CD1-CD2 3.51Å; L487-F547 HydrophobicContact CD1-CE2 3.71Å; L487-F547 HydrophobicContact CD1-CG 3.95Å; L487-F547 HydrophobicContact CD1-CZ 4.3Å; L487-F547 HydrophobicContact CD2-CB 4.21Å; L487-F547 HydrophobicContact CD2-CD2 4.48Å; L487-F547 HydrophobicContact CD2-CG 4.45Å; L487-F547 HydrophobicContact CG-CB 4.24Å; L487-F547 HydrophobicContact CG-CD2 3.64Å; L487-F547 HydrophobicContact CG-CE2 4.27Å; L487-F547 HydrophobicContact CG-CG 4.08Å; Y488-F547 WeakPolarHBondContact O-CB 3.49Å; I510-F547 HydrophobicContact CB-CE1 4.27Å; I510-F547 HydrophobicContact CB-CZ 4.48Å; I510-F547 HydrophobicContact CD1-CD1 4.1Å; I510-F547 HydrophobicContact CD1-CE1 3.66Å; I510-F547 HydrophobicContact CD1-CZ 3.96Å; I510-F547 HydrophobicContact CG2-CE1 4.43Å; L520-F547 HydrophobicContact CD1-CB 4.04Å; L520-F547 HydrophobicContact CD1-CD1 3.85Å; L520-F547 HydrophobicContact CD1-CG 4.21Å; L520-F547 HydrophobicContact CD2-CB 4.31Å; V545-F547 HydrophobicContact CG2-CD1 4.18Å; V545-F547 HydrophobicContact CG2-CE1 4.22Å; F547-L549 HydrophobicContact CD2-CD2 4.01Å; F547-L549 HydrophobicContact CD2-CG 4.11Å; F547-L549 HydrophobicContact CE2-CD1 4.16Å; F547-L549 HydrophobicContact CE2-CD2 3.79Å; F547-L549 HydrophobicContact CE2-CG 3.79Å; F547-Q560 WeakPolarHBondContact O-CA 3.47Å; F547-M561 HydrophobicContact CD2-CG 4.17Å; F547-M561 HydrophobicContact CE2-CG 3.7Å; F547-M561 HydrophobicContact CE2-SD 3.71Å; F547-M561 HydrophobicContact CZ-CE 4.39Å; F547-M561 HydrophobicContact CZ-CG 3.9Å; F547-M561 HydrophobicContact CZ-SD 3.87Å; F547-M561 PolarHBondContact N-O 3.03Å; F547-M561 VanDerWaalsContact N-O 3.09Å; F547-M561 PolarHBondContact O-N 3.39Å; F547-A563 HydrophobicContact CE1-CB 3.71Å; F547-A563 HydrophobicContact CZ-CB 3.99Å; F547-V604 HydrophobicContact CE2-CG1 4.49Å; F547-V604 HydrophobicContact CZ-CG1 4.16Å; F547-V604 HydrophobicContact CZ-CG2 4.42Å
548	A	95.5	Very high	84.8	Confident	21 Å²	21	57.7 Å²	57.7	17%	0.174	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	144.2	173.6	0	0	0	0	0	111.7	L487 Y488 Q559	L487-A548 CarbonylContact C-O 3.44Å; L487-A548 WeakPolarHBondContact CA-O 3.36Å; Y488-A548 PolarHBondContact N-O 3.46Å; Y488-A548 PolarHBondContact O-N 3.12Å; A548-Q559 CarbonylContact C-O 3.56Å; A548-Q559 VanDerWaalsContact CA-O 3.23Å; A548-Q559 WeakPolarHBondContact CA-O 3.43Å
549	L	97.4	Very high	86.5	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	133.3	172.6	-64.9	-179.3	0	0	0	110	A485 R486 L487 V497 F547 Y558 Q559 M561 V604 I606 F614	A485-L549 HydrophobicContact CB-CB 4.28Å; A485-L549 HydrophobicContact CB-CD2 4.14Å; R486-L549 WeakPolarHBondContact O-CA 3.37Å; L487-L549 HydrophobicContact CB-CD2 3.76Å; L487-L549 HydrophobicContact CD1-CD2 4.2Å; L487-L549 HydrophobicContact CG-CD2 4.06Å; V497-L549 HydrophobicContact CG2-CD2 3.93Å; F547-L549 HydrophobicContact CD2-CD2 4.01Å; F547-L549 HydrophobicContact CD2-CG 4.11Å; F547-L549 HydrophobicContact CE2-CD1 4.16Å; F547-L549 HydrophobicContact CE2-CD2 3.79Å; F547-L549 HydrophobicContact CE2-CG 3.79Å; L549-Y558 CarbonylContact O-C 3.55Å; L549-Y558 WeakPolarHBondContact O-CA 3.45Å; L549-Q559 PolarHBondContact N-O 3.29Å; L549-Q559 PolarHBondContact O-N 3.38Å; L549-M561 HydrophobicContact CD1-SD 3.64Å; L549-M561 HydrophobicContact CG-SD 4.19Å; L549-V604 HydrophobicContact CD1-CG1 4.44Å; L549-I606 HydrophobicContact CD1-CD1 4.08Å; L549-F614 HydrophobicContact CB-CE1 3.85Å; L549-F614 HydrophobicContact CB-CZ 4.02Å; L549-F614 HydrophobicContact CD1-CE1 4.23Å; L549-F614 HydrophobicContact CD1-CZ 3.88Å; L549-F614 HydrophobicContact CG-CZ 4.39Å
550	G	93.5	Very high	87.6	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	163.3	173.1	0	0	0	0	0	113.3	R486 L634	R486-G550 PolarHBondContact N-O 3.02Å; R486-G550 PolarHBondContact O-N 3.22Å; G550-L634 VanDerWaalsContact C-CD2 3.45Å
551	P	93.9	Very high	88.5	Confident	12 Å²	12	54.1 Å²	54.1	8%	0.078	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63	150.3	176.9	24.6	-32.7	0	0	0	112.3	T554	P551-T554 WeakPolarHBondContact CB-O 3.46Å; P551-T554 WeakPolarHBondContact CB-OG1 3.25Å; P551-T554 WeakPolarHBondContact CG-O 3.44Å
552	I	88.4	Confident	89.1	Confident	50 Å²	50	48.4 Å²	48.4	26%	0.256	27%	0.271	S	S	.	.	S	Bend	trans	-96.8	-41.7	173.7	-58.7	175.8	0	0	0	111	Q484 R486 V496	Q484-I552 HydrophobicContact CB-CD1 3.49Å; Q484-I552 VanDerWaalsContact CB-CD1 3.49Å; R486-I552 HydrophobicContact CB-CG1 4.27Å; V496-I552 HydrophobicContact CB-CD1 4.24Å; V496-I552 HydrophobicContact CG1-CD1 3.47Å; V496-I552 VanDerWaalsContact CG1-CD1 3.47Å; V496-I552 HydrophobicContact CG2-CD1 3.87Å
553	F	78.7	Confident	89.5	Confident	88 Å²	88	48.6 Å²	48.6	39%	0.386	27%	0.272	S	S	.	.	S	Bend	trans	-98	-14.6	-169.5	-52.2	-68.5	0	0	0	113.4	Q484 T590 L591 K594	Q484-F553 HydrophobicContact CB-CE2 4.42Å; F553-T590 HydrophobicContact CB-CG2 4.06Å; F553-L591 VanDerWaalsContact CD2-O 3.32Å; F553-L591 WeakPolarHBondContact CD2-O 3.39Å; F553-K594 HydrophobicContact CZ-CG 4.04Å
554	T	70.4	Confident	89.7	Confident	36 Å²	36	46.1 Å²	46.1	22%	0.221	26%	0.263	C	S	.	.	S	Bend	trans	-119	147.3	175.5	54.5	0	0	0	0	110	P551 T590	P551-T554 WeakPolarHBondContact CB-O 3.46Å; P551-T554 WeakPolarHBondContact CB-OG1 3.25Å; P551-T554 WeakPolarHBondContact CG-O 3.44Å; T554-T590 HydrophobicContact CG2-CG2 3.45Å; T554-T590 VanDerWaalsContact CG2-CG2 3.45Å
555	G	71.3	Confident	89.7	Confident	86 Å²	86	43.5 Å²	43.5	89%	0.887	25%	0.254	S	S	*	.			trans	-67.1	135	158.5	0	0	0	0	0	109.1
556	G	71.9	Confident	89.5	Confident	43 Å²	43	44 Å²	44	44%	0.443	26%	0.258	S	S	.	.			trans	-177.7	171.5	-178.1	0	0	0	0	0	113.1
557	S	79.4	Confident	89.1	Confident	78 Å²	78	46.4 Å²	46.4	55%	0.545	27%	0.274	S	S	.	.			trans	-72.2	154	177.8	52.5	0	0	0	0	112.1
558	Y	86.6	Confident	88.5	Confident	136 Å²	136	52.4 Å²	52.4	53%	0.533	30%	0.3	S	S	.	.			trans	-91.3	139.6	172.3	-41.3	-81.6	0	0	0	109.1	Y488 L549	Y488-Y558 AromaticContact CD2-CD1 3.82Å; Y488-Y558 HydrophobicContact CD2-CD1 3.82Å; Y488-Y558 HydrophobicContact CD2-CE1 4.2Å; Y488-Y558 HydrophobicContact CE1-CE1 4.36Å; Y488-Y558 AromaticContact CE2-CD1 3.34Å; Y488-Y558 HydrophobicContact CE2-CD1 3.34Å; Y488-Y558 AromaticContact CE2-CE1 3.36Å; Y488-Y558 HydrophobicContact CE2-CE1 3.36Å; Y488-Y558 HydrophobicContact CE2-CG 4.49Å; Y488-Y558 AromaticContact CZ-CD1 3.92Å; Y488-Y558 AromaticContact CZ-CE1 3.43Å; Y488-Y558 VanDerWaalsContact CZ-CE1 3.43Å; Y488-Y558 VanDerWaalsContact OH-CE1 3.3Å; Y488-Y558 WeakPolarHBondContact OH-CE1 3.38Å; L549-Y558 CarbonylContact O-C 3.55Å; L549-Y558 WeakPolarHBondContact O-CA 3.45Å
559	Q	91.3	Very high	88.1	Confident	59 Å²	59	53 Å²	53	28%	0.276	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	122.5	174.3	-66.1	-62.5	-14.8	0	0	109.7	A548 L549 F614	A548-Q559 CarbonylContact C-O 3.56Å; A548-Q559 VanDerWaalsContact CA-O 3.23Å; A548-Q559 WeakPolarHBondContact CA-O 3.43Å; L549-Q559 PolarHBondContact N-O 3.29Å; L549-Q559 PolarHBondContact O-N 3.38Å; Q559-F614 HydrophobicContact CB-CD1 4.29Å; Q559-F614 HydrophobicContact CB-CE1 3.61Å; Q559-F614 HydrophobicContact CB-CZ 3.76Å; Q559-F614 HydrophobicContact CG-CD1 4.22Å; Q559-F614 HydrophobicContact CG-CE1 4.03Å
560	Q	93.4	Very high	87.3	Confident	144 Å²	144	54.3 Å²	54.3	67%	0.673	31%	0.309	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.4	134	176.6	-169.6	176.4	-0.4	0	0	109.8	T546 F547	T546-Q560 HydrophobicContact CG2-CG 3.94Å; F547-Q560 WeakPolarHBondContact O-CA 3.47Å
561	M	95.6	Very high	86.5	Confident	3 Å²	3	54.9 Å²	54.9	2%	0.015	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	160.6	-179.8	67.8	174	-61.3	0	0	112.4	S508 T546 F547 L549 I606 H610 F614	S508-M561 VanDerWaalsContact CB-CE 3.41Å; T546-M561 WeakPolarHBondContact CA-O 3.31Å; F547-M561 HydrophobicContact CD2-CG 4.17Å; F547-M561 HydrophobicContact CE2-CG 3.7Å; F547-M561 HydrophobicContact CE2-SD 3.71Å; F547-M561 HydrophobicContact CZ-CE 4.39Å; F547-M561 HydrophobicContact CZ-CG 3.9Å; F547-M561 HydrophobicContact CZ-SD 3.87Å; F547-M561 PolarHBondContact N-O 3.03Å; F547-M561 VanDerWaalsContact N-O 3.09Å; F547-M561 PolarHBondContact O-N 3.39Å; L549-M561 HydrophobicContact CD1-SD 3.64Å; L549-M561 HydrophobicContact CG-SD 4.19Å; M561-I606 HydrophobicContact CE-CG1 4.38Å; M561-H610 HydrophobicContact CE-CB 4.15Å; M561-F614 HydrophobicContact SD-CE2 4.16Å; M561-F614 HydrophobicContact SD-CZ 4.08Å
562	E	96.2	Very high	85.8	Confident	78 Å²	78	57.7 Å²	57.7	36%	0.364	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	144	169.3	-62.1	-168.8	156.6	0	0	110.5	R544 V545 T546 H610	R544-E562 WeakPolarHBondContact CD-OE2 3.31Å; R544-E562 IonicContact CZ-OE2 3.08Å; R544-E562 IonicContact NH1-OE2 3.66Å; R544-E562 PolarHBondContact NH1-OE2 2.91Å; V545-E562 CarbonylContact O-C 3.58Å; V545-E562 WeakPolarHBondContact O-CA 3.37Å; T546-E562 HydrophobicContact CG2-CG 4.37Å; E562-H610 PolarHBondContact N-NE2 3.21Å; E562-H610 VanDerWaalsContact N-NE2 3.19Å; E562-H610 PolarHBondContact O-NE2 3.06Å
563	A	97.4	Very high	85.4	Confident	3 Å²	3	55.3 Å²	55.3	3%	0.025	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	155.3	173.4	0	0	0	0	0	112.2	S508 I510 R544 V545 F547	S508-A563 WeakPolarHBondContact O-CA 3.34Å; I510-A563 HydrophobicContact CB-CB 4.08Å; I510-A563 HydrophobicContact CG2-CB 3.98Å; R544-A563 WeakPolarHBondContact CA-O 3.5Å; V545-A563 PolarHBondContact N-O 3.48Å; V545-A563 PolarHBondContact O-N 3.12Å; F547-A563 HydrophobicContact CE1-CB 3.71Å; F547-A563 HydrophobicContact CZ-CB 3.99Å
564	L	97.1	Very high	85.2	Confident	3 Å²	3	52.5 Å²	52.5	2%	0.016	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	129.2	175.5	-66.9	174.7	0	0	0	111	S508 F509 I510 E525 V527 C542 R544 V566	S508-L564 PolarHBondContact O-N 3.01Å; F509-L564 VanDerWaalsContact CA-O 3.31Å; F509-L564 WeakPolarHBondContact CA-O 3.44Å; F509-L564 HydrophobicContact CD1-CB 3.66Å; F509-L564 HydrophobicContact CE1-CB 3.85Å; F509-L564 HydrophobicContact CE1-CD1 3.95Å; I510-L564 PolarHBondContact N-O 3Å; E525-L564 HydrophobicContact CG-CD2 3.95Å; E525-L564 WeakPolarHBondContact OE1-CD2 3.45Å; V527-L564 HydrophobicContact CB-CD1 4.34Å; V527-L564 HydrophobicContact CG1-CD1 4.16Å; V527-L564 HydrophobicContact CG2-CD1 3.8Å; V527-L564 HydrophobicContact CG2-CD2 4.46Å; C542-L564 HydrophobicContact CB-CB 3.95Å; C542-L564 HydrophobicContact CB-CD2 3.98Å; C542-L564 HydrophobicContact CB-CG 4.37Å; R544-L564 HydrophobicContact CB-CD2 4.01Å; L564-V566 PolarHBondContact O-N 3.3Å
565	C	95.9	Very high	85.6	Confident	10 Å²	10	53 Å²	53	7%	0.068	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	121.1	178.1	-65.7	0	0	0	0	111.1	I510 A515 R543	I510-C565 WeakPolarHBondContact O-CA 3.5Å; A515-C565 VanDerWaalsContact CB-SG 3.5Å; R543-C565 HydrophobicContact CB-CB 4.05Å; R543-C565 WeakPolarHBondContact O-CB 3.3Å; R543-C565 PolarHBondContact O-N 3.39Å; R543-C565 PolarHBondContact O-SG 3.33Å
566	V	92.1	Very high	86	Confident	12 Å²	12	49.3 Å²	49.3	7%	0.073	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	146.5	172.7	-68.5	0	0	0	0	110.4	F509 I510 C511 K512 I529 L564 K568 I569	F509-V566 HydrophobicContact CB-CG2 4.05Å; F509-V566 HydrophobicContact CD1-CG1 3.64Å; F509-V566 HydrophobicContact CD1-CG2 4.34Å; F509-V566 HydrophobicContact CE1-CG1 4.12Å; I510-V566 PolarHBondContact O-N 2.87Å; C511-V566 CarbonylContact C-O 3.42Å; C511-V566 WeakPolarHBondContact CA-O 3.16Å; K512-V566 PolarHBondContact N-O 2.86Å; I529-V566 HydrophobicContact CD1-CG1 4.05Å; L564-V566 PolarHBondContact O-N 3.3Å; V566-K568 PolarHBondContact O-N 2.93Å; V566-I569 HydrophobicContact CG2-CG1 3.95Å
567	P	88	Confident	86.4	Confident	107 Å²	107	51.3 Å²	51.3	70%	0.695	27%	0.271	S	S	*	.	S	Bend	trans	-57.2	-35.8	-177.2	-26.2	34.7	0	0	0	114
568	K	85.1	Confident	86.6	Confident	131 Å²	131	50.2 Å²	50.2	57%	0.57	27%	0.267	S	S	*	.			trans	-152.2	138.9	-179.5	-175.2	175.2	-179.6	179.3	0	108.1	V566 C570	V566-K568 PolarHBondContact O-N 2.93Å; K568-C570 WeakPolarHBondContact CE-O 3.27Å; K568-C570 WeakPolarHBondContact CG-O 3.48Å
569	I	87.6	Confident	86.5	Confident	34 Å²	34	45.5 Å²	45.5	17%	0.174	25%	0.25	C	S	.	.	S	Bend	trans	-84.8	-61.9	179.3	-67.3	177.8	0	0	0	110	V566 V602 D603 L605	V566-I569 HydrophobicContact CG2-CG1 3.95Å; I569-V602 HydrophobicContact CB-CG1 4.47Å; I569-V602 HydrophobicContact CD1-CG1 4.16Å; I569-V602 HydrophobicContact CG2-CB 4.35Å; I569-V602 HydrophobicContact CG2-CG1 3.99Å; I569-D603 WeakPolarHBondContact CD1-O 3.21Å; I569-L605 HydrophobicContact CD1-CB 4.24Å; I569-L605 HydrophobicContact CG2-CB 3.74Å; I569-L605 HydrophobicContact CG2-CD1 3.81Å; I569-L605 HydrophobicContact CG2-CG 4.39Å
570	C	79.5	Confident	86.3	Confident	27 Å²	27	45.9 Å²	45.9	18%	0.182	25%	0.249	C	C	.	.	S	Bend	trans	-145.3	176.7	175.7	61.4	0	0	0	0	109.7	K568 V602	K568-C570 WeakPolarHBondContact CE-O 3.27Å; K568-C570 WeakPolarHBondContact CG-O 3.48Å; C570-V602 WeakPolarHBondContact SG-CG2 3.36Å
571	S	76	Confident	85.8	Confident	13 Å²	13	47.5 Å²	47.5	9%	0.091	26%	0.257	C	S	.	.	S	Bend	trans	-72.8	170.6	169.7	47.2	0	0	0	0	111.7	I465 V467 L573	I465-S571 WeakPolarHBondContact O-CB 3.48Å; I465-S571 PolarHBondContact O-OG 2.86Å; V467-S571 WeakPolarHBondContact CB-OG 3.41Å; V467-S571 WeakPolarHBondContact CG2-OG 3.46Å; S571-L573 PolarHBondContact O-N 2.92Å
572	V	80.2	Confident	85.3	Confident	70 Å²	70	50.6 Å²	50.6	42%	0.424	28%	0.279	S	S	.	.	P	Polyproline II helix	trans	-61.3	130.1	-172.8	178.4	0	0	0	0	109.9	V467 R599	V467-V572 PolarHBondContact N-O 3.42Å; V572-R599 HydrophobicContact CG1-CB 3.79Å
573	L	80.6	Confident	84.9	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.005	26%	0.263	C	S	.	.	B	Isolated β-bridge	trans	-72.6	138.1	172.8	-54.9	-174	0	0	0	110.4	V467 L480 T482 S571 R599 V600 V602	V467-L573 HydrophobicContact CB-CD2 4.5Å; V467-L573 HydrophobicContact CG1-CD2 3.42Å; V467-L573 VanDerWaalsContact CG1-CD2 3.42Å; V467-L573 CarbonylContact O-C 3.49Å; V467-L573 WeakPolarHBondContact O-CA 3.45Å; L480-L573 HydrophobicContact CD1-CD2 4.39Å; T482-L573 HydrophobicContact CG2-CD1 3.61Å; S571-L573 PolarHBondContact O-N 2.92Å; L573-R599 WeakPolarHBondContact O-CA 3.46Å; L573-V600 HydrophobicContact CB-CG1 4.22Å; L573-V600 WeakPolarHBondContact CB-O 3.38Å; L573-V600 HydrophobicContact CD1-CG1 4.37Å; L573-V600 PolarHBondContact N-O 3.42Å; L573-V600 PolarHBondContact O-N 2.75Å; L573-V602 HydrophobicContact CD1-CG2 3.48Å; L573-V602 VanDerWaalsContact CD1-CG2 3.48Å; L573-V602 HydrophobicContact CD2-CG2 3.98Å; L573-V602 HydrophobicContact CG-CG2 3.65Å
574	E	73.3	Confident	84.5	Confident	28 Å²	28	52.5 Å²	52.5	13%	0.131	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-59.9	161.4	172.7	-72	-57.7	163.3	0	0	110.7	V467 R597 R599	V467-E574 WeakPolarHBondContact O-CG 3.25Å; V467-E574 PolarHBondContact O-N 3.34Å; E574-R597 PolarHBondContact O-NH1 3.47Å; E574-R597 VanDerWaalsContact O-NH1 3.15Å; E574-R597 PolarHBondContact O-NH2 3.49Å; E574-R599 IonicContact OE1-CZ 3.97Å; E574-R599 IonicContact OE1-NE 2.78Å; E574-R599 IonicContact OE1-NH2 3.61Å; E574-R599 PolarHBondContact OE1-NH2 2.67Å; E574-R599 IonicContact OE2-CZ 3.65Å; E574-R599 VanDerWaalsContact OE2-CZ 3.26Å; E574-R599 IonicContact OE2-NE 3.07Å; E574-R599 PolarHBondContact OE2-NE 2.79Å; E574-R599 IonicContact OE2-NH2 2.86Å; E574-R599 PolarHBondContact OE2-NH2 3Å
575	S	78.5	Confident	84.3	Confident	46 Å²	46	53.8 Å²	53.8	32%	0.322	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-64.5	143.3	169	49.7	0	0	0	0	110.6	R597	S575-R597 CarbonylContact C-O 3.58Å; S575-R597 WeakPolarHBondContact CA-O 3.27Å; S575-R597 WeakPolarHBondContact CB-O 3.48Å
576	N	81.2	Confident	84	Confident	10 Å²	10	53.4 Å²	53.4	5%	0.053	30%	0.298	C	S	.	.	B	Isolated β-bridge	trans	-98.8	147	165.7	62.5	13.8	0	0	0	108.8	K594 F595 P596 R597	N576-K594 PolarHBondContact ND2-O 3.11Å; N576-K594 VanDerWaalsContact ND2-O 3.09Å; N576-K594 PolarHBondContact OD1-O 2.91Å; N576-F595 HydrophobicContact CB-CD1 4.09Å; N576-F595 HydrophobicContact CB-CE1 3.88Å; N576-F595 WeakPolarHBondContact ND2-CD1 3.47Å; N576-F595 WeakPolarHBondContact ND2-CE1 3.36Å; N576-F595 WeakPolarHBondContact ND2-CZ 3.35Å; N576-P596 WeakPolarHBondContact O-CA 3.38Å; N576-P596 WeakPolarHBondContact O-CB 3.28Å; N576-R597 PolarHBondContact N-O 2.88Å; N576-R597 PolarHBondContact O-N 3.38Å; N576-R597 WeakPolarHBondContact OD1-CA 3.36Å; N576-R597 WeakPolarHBondContact OD1-CB 3.28Å; N576-R597 PolarHBondContact OD1-N 3.26Å
577	D	79.9	Confident	83.9	Confident	84 Å²	84	57.1 Å²	57.1	45%	0.449	31%	0.314	S	S	.	.	P	Polyproline II helix	trans	-80.7	169.6	-178.7	-60.3	-46.1	0	0	0	110.7	R471 F595	R471-D577 IonicContact NH2-OD2 3.13Å; D577-F595 WeakPolarHBondContact O-CD1 3.19Å
578	A	83	Confident	83.9	Confident	56 Å²	56	56 Å²	56	46%	0.463	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-60.7	149.4	172.6	0	0	0	0	0	110.8	R580	A578-R580 PolarHBondContact O-N 3.43Å
579	I	85.5	Confident	84.3	Confident	37 Å²	37	51 Å²	51	19%	0.19	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-57.8	124.5	174	-64.9	-60.1	0	0	0	109	W583 V586 L591 F595 I638	I579-W583 HydrophobicContact CD1-CE3 4.2Å; I579-W583 HydrophobicContact CD1-CZ3 4.13Å; I579-W583 HydrophobicContact CG2-CE3 4.21Å; I579-V586 HydrophobicContact CD1-CG2 4.34Å; I579-V586 HydrophobicContact CG2-CG2 3.49Å; I579-V586 VanDerWaalsContact CG2-CG2 3.49Å; I579-L591 HydrophobicContact CD1-CD1 3.81Å; I579-L591 HydrophobicContact CG1-CD1 3.76Å; I579-F595 HydrophobicContact CD1-CB 3.95Å; I579-F595 HydrophobicContact CD1-CD1 3.78Å; I579-F595 HydrophobicContact CD1-CD2 4.25Å; I579-F595 HydrophobicContact CD1-CE1 4.36Å; I579-F595 HydrophobicContact CD1-CG 3.73Å; I579-F595 HydrophobicContact CG1-CB 3.74Å; I579-F595 HydrophobicContact CG1-CD1 4.49Å; I579-F595 HydrophobicContact CG1-CG 4.1Å; I579-I638 HydrophobicContact CD1-CG1 4.37Å
580	R	85.4	Confident	84.5	Confident	67 Å²	67	52.5 Å²	52.5	25%	0.253	31%	0.312	S	S	.	.	P	Polyproline II helix	trans	-70.8	137.4	179.8	-58.2	-175	-179.7	-161.3	-11.9	109.9	A578 S582 W583 Q587 E644	A578-R580 PolarHBondContact O-N 3.43Å; R580-S582 PolarHBondContact O-N 3.3Å; R580-S582 VanDerWaalsContact O-N 3.17Å; R580-W583 HydrophobicContact CB-CD2 3.87Å; R580-W583 HydrophobicContact CB-CE3 4.33Å; R580-W583 HydrophobicContact CB-CG 4.09Å; R580-W583 HydrophobicContact CB-CZ2 4.37Å; R580-W583 HydrophobicContact CG-CD2 4.22Å; R580-W583 HydrophobicContact CG-CH2 4.14Å; R580-W583 HydrophobicContact CG-CZ2 3.82Å; R580-W583 HydrophobicContact CG-CZ3 4.47Å; R580-W583 WeakPolarHBondContact O-CB 3.32Å; R580-W583 PolarHBondContact O-N 3.47Å; R580-Q587 PolarHBondContact O-NE2 3.23Å; R580-E644 IonicContact CZ-OE2 3.35Å; R580-E644 IonicContact NH1-OE2 3.72Å; R580-E644 IonicContact NH2-OE2 2.92Å; R580-E644 PolarHBondContact NH2-OE2 2.82Å
581	E	84	Confident	85.1	Confident	177 Å²	177	52.6 Å²	52.6	83%	0.827	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-31.5	175.5	-68.7	-177.8	174.6	0	0	112.3	W583	E581-W583 PolarHBondContact O-N 2.87Å
582	S	84.3	Confident	85.9	Confident	69 Å²	69	52 Å²	52	48%	0.483	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-17.7	177.1	58.1	0	0	0	0	114.5	R580 T584	R580-S582 PolarHBondContact O-N 3.3Å; R580-S582 VanDerWaalsContact O-N 3.17Å; S582-T584 PolarHBondContact O-N 2.89Å
583	W	89	Confident	86.5	Confident	10 Å²	10	49 Å²	49	4%	0.038	29%	0.288	C	S	.	.			trans	-85	65.2	176.7	-57.3	-16	0	0	0	110.2	M479 I579 R580 E581 H585 V586 Q587 P627 T642	M479-W583 HydrophobicContact CE-CH2 3.87Å; M479-W583 HydrophobicContact CE-CZ3 4.06Å; I579-W583 HydrophobicContact CD1-CE3 4.2Å; I579-W583 HydrophobicContact CD1-CZ3 4.13Å; I579-W583 HydrophobicContact CG2-CE3 4.21Å; R580-W583 HydrophobicContact CB-CD2 3.87Å; R580-W583 HydrophobicContact CB-CE3 4.33Å; R580-W583 HydrophobicContact CB-CG 4.09Å; R580-W583 HydrophobicContact CB-CZ2 4.37Å; R580-W583 HydrophobicContact CG-CD2 4.22Å; R580-W583 HydrophobicContact CG-CH2 4.14Å; R580-W583 HydrophobicContact CG-CZ2 3.82Å; R580-W583 HydrophobicContact CG-CZ3 4.47Å; R580-W583 WeakPolarHBondContact O-CB 3.32Å; R580-W583 PolarHBondContact O-N 3.47Å; E581-W583 PolarHBondContact O-N 2.87Å; W583-H585 PolarHBondContact O-N 2.7Å; W583-H585 VanDerWaalsContact O-N 3.15Å; W583-V586 HydrophobicContact CB-CG2 3.6Å; W583-V586 HydrophobicContact CE3-CG2 4.24Å; W583-V586 VanDerWaalsContact O-CG2 3.31Å; W583-V586 WeakPolarHBondContact O-CG2 3.17Å; W583-V586 PolarHBondContact O-N 2.9Å; W583-Q587 PolarHBondContact O-N 3.36Å; W583-P627 HydrophobicContact CD2-CG 3.64Å; W583-P627 VanDerWaalsContact CE2-CD 3.43Å; W583-P627 HydrophobicContact CE3-CG 3.65Å; W583-P627 HydrophobicContact CG-CG 4.3Å; W583-P627 HydrophobicContact CH2-CG 3.91Å; W583-P627 HydrophobicContact CZ2-CG 3.88Å; W583-P627 HydrophobicContact CZ3-CG 3.8Å; W583-T642 HydrophobicContact CH2-CG2 3.83Å; W583-T642 HydrophobicContact CZ2-CG2 3.72Å
584	T	88.1	Confident	86.9	Confident	110 Å²	110	54.2 Å²	54.2	68%	0.675	31%	0.311	S	S	*	.	G	3₁₀ helix	trans	-56.7	-32.8	-173.6	55.1	0	0	0	0	113.2	S582 V586 Q587	S582-T584 PolarHBondContact O-N 2.89Å; T584-V586 VanDerWaalsContact C-N 3.29Å; T584-V586 PolarHBondContact O-N 3.2Å; T584-Q587 PolarHBondContact O-N 3.14Å
585	H	92.4	Very high	87.6	Confident	30 Å²	30	54.6 Å²	54.6	14%	0.139	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-70.6	-18.4	179.4	64.2	-63.7	0	0	0	114.4	W583 K620 G622 Q626 P627	W583-H585 PolarHBondContact O-N 2.7Å; W583-H585 VanDerWaalsContact O-N 3.15Å; H585-K620 WeakPolarHBondContact O-CD 3.3Å; H585-G622 PolarHBondContact CD2-N 3.49Å; H585-G622 VanDerWaalsContact CD2-N 3.28Å; H585-G622 VanDerWaalsContact CE1-CA 3.4Å; H585-G622 WeakPolarHBondContact CE1-CA 3.13Å; H585-G622 WeakPolarHBondContact NE2-CA 3.31Å; H585-G622 PolarHBondContact NE2-N 2.9Å; H585-Q626 PolarHBondContact CE1-OE1 3.4Å; H585-P627 PolarHBondContact NE2-O 3.31Å
586	V	91.1	Very high	88	Confident	3 Å²	3	56.7 Å²	56.7	2%	0.018	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-101.4	-7.5	176	-45.5	0	0	0	0	113.3	I579 W583 T584 L589 A629 I638	I579-V586 HydrophobicContact CD1-CG2 4.34Å; I579-V586 HydrophobicContact CG2-CG2 3.49Å; I579-V586 VanDerWaalsContact CG2-CG2 3.49Å; W583-V586 HydrophobicContact CB-CG2 3.6Å; W583-V586 HydrophobicContact CE3-CG2 4.24Å; W583-V586 VanDerWaalsContact O-CG2 3.31Å; W583-V586 WeakPolarHBondContact O-CG2 3.17Å; W583-V586 PolarHBondContact O-N 2.9Å; T584-V586 VanDerWaalsContact C-N 3.29Å; T584-V586 PolarHBondContact O-N 3.2Å; V586-L589 HydrophobicContact CB-CD1 4.27Å; V586-L589 WeakPolarHBondContact O-CG 3.46Å; V586-L589 PolarHBondContact O-N 3.12Å; V586-A629 HydrophobicContact CG1-CB 4Å; V586-I638 HydrophobicContact CB-CD1 4.02Å; V586-I638 HydrophobicContact CG1-CD1 3.86Å
587	Q	90.3	Very high	88.3	Confident	90 Å²	90	57 Å²	57	42%	0.421	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	139.7	177.4	-62.9	-59.9	-25.7	0	0	111.1	R580 W583 T584 L589	R580-Q587 PolarHBondContact O-NE2 3.23Å; W583-Q587 PolarHBondContact O-N 3.36Å; T584-Q587 PolarHBondContact O-N 3.14Å; Q587-L589 PolarHBondContact O-N 3.43Å
588	G	88.1	Confident	88.6	Confident	82 Å²	82	57.3 Å²	57.3	85%	0.845	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.3	2.2	179.2	0	0	0	0	0	115.6
589	L	91.9	Very high	88.6	Confident	26 Å²	26	61.1 Å²	61.1	14%	0.136	34%	0.336	C	S	.	.			trans	-78.1	138.5	175.4	-60.4	-174.9	0	0	0	111.2	V586 Q587 L591 K620 A629 W636	V586-L589 HydrophobicContact CB-CD1 4.27Å; V586-L589 WeakPolarHBondContact O-CG 3.46Å; V586-L589 PolarHBondContact O-N 3.12Å; Q587-L589 PolarHBondContact O-N 3.43Å; L589-L591 HydrophobicContact CB-CD2 3.89Å; L589-L591 PolarHBondContact O-N 3.14Å; L589-L591 VanDerWaalsContact O-N 3.1Å; L589-K620 HydrophobicContact CD1-CD 4.3Å; L589-K620 HydrophobicContact CD2-CD 4.32Å; L589-A629 HydrophobicContact CD1-CB 3.73Å; L589-W636 HydrophobicContact CB-CB 4.15Å; L589-W636 HydrophobicContact CB-CG 3.91Å; L589-W636 HydrophobicContact CD1-CB 4.21Å; L589-W636 HydrophobicContact CD1-CD2 3.75Å; L589-W636 HydrophobicContact CD1-CE3 3.94Å; L589-W636 HydrophobicContact CD1-CG 3.89Å; L589-W636 HydrophobicContact CD2-CD2 4.17Å; L589-W636 HydrophobicContact CD2-CG 4.37Å; L589-W636 HydrophobicContact CD2-CZ2 4.21Å; L589-W636 HydrophobicContact CG-CD2 4.38Å; L589-W636 HydrophobicContact CG-CG 4.28Å
590	T	92	Very high	88.7	Confident	67 Å²	67	60.8 Å²	60.8	41%	0.411	34%	0.335	S	S	.	.			trans	-75.4	100	168.1	-41.9	0	0	0	0	109.8	F553 T554 W636	F553-T590 HydrophobicContact CB-CG2 4.06Å; T554-T590 HydrophobicContact CG2-CG2 3.45Å; T554-T590 VanDerWaalsContact CG2-CG2 3.45Å; T590-W636 PolarHBondContact O-N 3.16Å
591	L	93.3	Very high	88.9	Confident	29 Å²	29	60 Å²	60	15%	0.152	34%	0.34	C	S	.	.	B	Isolated β-bridge	trans	-74.8	147.2	-175.2	-54.5	-174.9	0	0	0	112.1	F553 I579 L589 D593 F595 W636 I638	F553-L591 VanDerWaalsContact CD2-O 3.32Å; F553-L591 WeakPolarHBondContact CD2-O 3.39Å; I579-L591 HydrophobicContact CD1-CD1 3.81Å; I579-L591 HydrophobicContact CG1-CD1 3.76Å; L589-L591 HydrophobicContact CB-CD2 3.89Å; L589-L591 PolarHBondContact O-N 3.14Å; L589-L591 VanDerWaalsContact O-N 3.1Å; L591-D593 WeakPolarHBondContact CB-O 3.35Å; L591-F595 HydrophobicContact CD1-CB 4.42Å; L591-F595 HydrophobicContact CD1-CD2 3.58Å; L591-F595 HydrophobicContact CD1-CE2 4.19Å; L591-F595 HydrophobicContact CD1-CG 4.22Å; L591-W636 CarbonylContact C-O 3.57Å; L591-W636 WeakPolarHBondContact CA-O 3.29Å; L591-W636 HydrophobicContact CD2-CB 4.03Å; L591-I638 HydrophobicContact CD1-CG1 4.33Å; L591-I638 HydrophobicContact CD2-CD1 3.73Å; L591-I638 HydrophobicContact CD2-CG1 3.82Å
592	A	92.8	Very high	89.4	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	30%	0.302	C	S	.	.	S	Bend	trans	-80.4	-17.2	177.5	0	0	0	0	0	112.9	A483 Q484 L634 W636 I637	A483-A592 HydrophobicContact CB-CB 3.77Å; Q484-A592 PolarHBondContact N-O 2.57Å; A592-L634 HydrophobicContact CB-CB 4.41Å; A592-W636 PolarHBondContact N-O 3.48Å; A592-I637 HydrophobicContact CB-CG1 3.92Å
593	D	92.3	Very high	90	Very high	6 Å²	6	49.1 Å²	49.1	3%	0.032	28%	0.282	C	S	.	.	S	Bend	trans	-126.3	164.2	175.6	-163.3	6	0	0	0	110.1	T482 Q484 L591 F595 R597	T482-D593 PolarHBondContact OG1-OD2 3.1Å; Q484-D593 VanDerWaalsContact CG-OD1 3.31Å; Q484-D593 WeakPolarHBondContact CG-OD1 3.45Å; L591-D593 WeakPolarHBondContact CB-O 3.35Å; D593-F595 HydrophobicContact CB-CE2 3.94Å; D593-F595 WeakPolarHBondContact O-CD2 3.47Å; D593-R597 WeakPolarHBondContact OD1-CD 3.4Å; D593-R597 IonicContact OD1-NE 3.46Å; D593-R597 IonicContact OD2-CZ 3.93Å; D593-R597 IonicContact OD2-NE 3.97Å; D593-R597 PolarHBondContact OD2-NE 3.31Å; D593-R597 IonicContact OD2-NH2 3.77Å
594	K	88.9	Confident	90.4	Very high	112 Å²	112	48.7 Å²	48.7	49%	0.487	28%	0.281	S	S	.	.			trans	-77.4	140.4	174.1	-64.6	-176.3	-178.4	-176.6	0	110.4	F553 N576 R597	F553-K594 HydrophobicContact CZ-CG 4.04Å; N576-K594 PolarHBondContact ND2-O 3.11Å; N576-K594 VanDerWaalsContact ND2-O 3.09Å; N576-K594 PolarHBondContact OD1-O 2.91Å; K594-R597 HydrophobicContact CB-CB 4.24Å; K594-R597 WeakPolarHBondContact O-CB 3.48Å
595	F	88.8	Confident	90.8	Very high	36 Å²	36	44.3 Å²	44.3	16%	0.158	25%	0.253	C	S	.	.	S	Bend	trans	-137.9	108.3	172.6	-72.2	-96.2	0	0	0	108.3	M479 N576 D577 I579 L591 D593 I638	M479-F595 HydrophobicContact SD-CE1 3.96Å; N576-F595 HydrophobicContact CB-CD1 4.09Å; N576-F595 HydrophobicContact CB-CE1 3.88Å; N576-F595 WeakPolarHBondContact ND2-CD1 3.47Å; N576-F595 WeakPolarHBondContact ND2-CE1 3.36Å; N576-F595 WeakPolarHBondContact ND2-CZ 3.35Å; D577-F595 WeakPolarHBondContact O-CD1 3.19Å; I579-F595 HydrophobicContact CD1-CB 3.95Å; I579-F595 HydrophobicContact CD1-CD1 3.78Å; I579-F595 HydrophobicContact CD1-CD2 4.25Å; I579-F595 HydrophobicContact CD1-CE1 4.36Å; I579-F595 HydrophobicContact CD1-CG 3.73Å; I579-F595 HydrophobicContact CG1-CB 3.74Å; I579-F595 HydrophobicContact CG1-CD1 4.49Å; I579-F595 HydrophobicContact CG1-CG 4.1Å; L591-F595 HydrophobicContact CD1-CB 4.42Å; L591-F595 HydrophobicContact CD1-CD2 3.58Å; L591-F595 HydrophobicContact CD1-CE2 4.19Å; L591-F595 HydrophobicContact CD1-CG 4.22Å; D593-F595 HydrophobicContact CB-CE2 3.94Å; D593-F595 WeakPolarHBondContact O-CD2 3.47Å; F595-I638 HydrophobicContact CE2-CB 4.36Å; F595-I638 HydrophobicContact CE2-CG1 4.26Å; F595-I638 HydrophobicContact CZ-CB 3.9Å; F595-I638 HydrophobicContact CZ-CG1 4.27Å
596	P	86.7	Confident	91.1	Very high	89 Å²	89	42.9 Å²	42.9	58%	0.578	25%	0.247	S	C	*	.	S	Bend	cis	-78.1	156	2.6	32.4	-34.3	0	0	0	113.6	N576	N576-P596 WeakPolarHBondContact O-CA 3.38Å; N576-P596 WeakPolarHBondContact O-CB 3.28Å
597	R	87.3	Confident	91.3	Very high	18 Å²	18	42.8 Å²	42.8	7%	0.068	25%	0.246	C	C	.	.	B	Isolated β-bridge	trans	-126.6	138.3	173.1	-173.9	-173.9	43.6	70.8	-6.6	108.8	E574 S575 N576 D593 K594 V600	E574-R597 PolarHBondContact O-NH1 3.47Å; E574-R597 VanDerWaalsContact O-NH1 3.15Å; E574-R597 PolarHBondContact O-NH2 3.49Å; S575-R597 CarbonylContact C-O 3.58Å; S575-R597 WeakPolarHBondContact CA-O 3.27Å; S575-R597 WeakPolarHBondContact CB-O 3.48Å; N576-R597 PolarHBondContact N-O 2.88Å; N576-R597 PolarHBondContact O-N 3.38Å; N576-R597 WeakPolarHBondContact OD1-CA 3.36Å; N576-R597 WeakPolarHBondContact OD1-CB 3.28Å; N576-R597 PolarHBondContact OD1-N 3.26Å; D593-R597 WeakPolarHBondContact OD1-CD 3.4Å; D593-R597 IonicContact OD1-NE 3.46Å; D593-R597 IonicContact OD2-CZ 3.93Å; D593-R597 IonicContact OD2-NE 3.97Å; D593-R597 PolarHBondContact OD2-NE 3.31Å; D593-R597 IonicContact OD2-NH2 3.77Å; K594-R597 HydrophobicContact CB-CB 4.24Å; K594-R597 WeakPolarHBondContact O-CB 3.48Å; R597-V600 VanDerWaalsContact CZ-CG1 3.48Å
598	S	85.6	Confident	91.4	Very high	89 Å²	89	42.4 Å²	42.4	62%	0.622	25%	0.246	S	C	*	.			trans	-68.1	175.8	169.4	62	0	0	0	0	111.9	V600	S598-V600 PolarHBondContact O-N 3.33Å
599	R	83.5	Confident	91.8	Very high	137 Å²	137	41 Å²	41	52%	0.517	22%	0.219	S	C	.	.			trans	-53.7	139.3	170.3	-71.2	-177.8	170.2	-178.7	-7.1	111.8	V572 L573 E574	V572-R599 HydrophobicContact CG1-CB 3.79Å; L573-R599 WeakPolarHBondContact O-CA 3.46Å; E574-R599 IonicContact OE1-CZ 3.97Å; E574-R599 IonicContact OE1-NE 2.78Å; E574-R599 IonicContact OE1-NH2 3.61Å; E574-R599 PolarHBondContact OE1-NH2 2.67Å; E574-R599 IonicContact OE2-CZ 3.65Å; E574-R599 VanDerWaalsContact OE2-CZ 3.26Å; E574-R599 IonicContact OE2-NE 3.07Å; E574-R599 PolarHBondContact OE2-NE 2.79Å; E574-R599 IonicContact OE2-NH2 2.86Å; E574-R599 PolarHBondContact OE2-NH2 3Å
600	V	87.5	Confident	92	Very high	30 Å²	30	41.2 Å²	41.2	18%	0.182	22%	0.22	C	C	.	.	B	Isolated β-bridge	trans	-144.6	145.3	-176.7	81.9	0	0	0	0	112	T498 L573 R597 S598	T498-V600 HydrophobicContact CG2-CG1 3.85Å; T498-V600 WeakPolarHBondContact OG1-CG2 3.45Å; L573-V600 HydrophobicContact CB-CG1 4.22Å; L573-V600 WeakPolarHBondContact CB-O 3.38Å; L573-V600 HydrophobicContact CD1-CG1 4.37Å; L573-V600 PolarHBondContact N-O 3.42Å; L573-V600 PolarHBondContact O-N 2.75Å; R597-V600 VanDerWaalsContact CZ-CG1 3.48Å; S598-V600 PolarHBondContact O-N 3.33Å
601	S	89.8	Confident	92.2	Very high	51 Å²	51	38.9 Å²	38.9	36%	0.357	20%	0.203	S	C	.	.			trans	-83.5	141.7	169	55.7	0	0	0	0	111
602	V	93	Very high	92.3	Very high	4 Å²	4	45.4 Å²	45.4	2%	0.024	23%	0.227	C	C	.	.			trans	-77.6	127.7	170.5	-178.8	0	0	0	0	109.9	L500 I569 C570 L573 V604	L500-V602 HydrophobicContact CB-CG1 3.65Å; L500-V602 HydrophobicContact CB-CG2 4.1Å; I569-V602 HydrophobicContact CB-CG1 4.47Å; I569-V602 HydrophobicContact CD1-CG1 4.16Å; I569-V602 HydrophobicContact CG2-CB 4.35Å; I569-V602 HydrophobicContact CG2-CG1 3.99Å; C570-V602 WeakPolarHBondContact SG-CG2 3.36Å; L573-V602 HydrophobicContact CD1-CG2 3.48Å; L573-V602 VanDerWaalsContact CD1-CG2 3.48Å; L573-V602 HydrophobicContact CD2-CG2 3.98Å; L573-V602 HydrophobicContact CG-CG2 3.65Å; V602-V604 WeakPolarHBondContact CG1-O 3.21Å
603	D	97	Very high	92.3	Very high	13 Å²	13	49 Å²	49	7%	0.07	25%	0.246	C	C	.	.			trans	-99.2	-31.7	-179.3	-66.7	-57	0	0	0	112.2	V497 T498 C511 R513 I514 I569	V497-D603 HydrophobicContact CB-CB 3.8Å; V497-D603 HydrophobicContact CG1-CB 4.07Å; T498-D603 PolarHBondContact N-OD2 3.38Å; T498-D603 VanDerWaalsContact N-OD2 3.09Å; T498-D603 PolarHBondContact O-N 2.96Å; C511-D603 WeakPolarHBondContact CB-O 3.46Å; C511-D603 PolarHBondContact N-O 3.3Å; R513-D603 IonicContact NH2-OD1 3.78Å; R513-D603 PolarHBondContact NH2-OD1 2.99Å; I514-D603 HydrophobicContact CG1-CB 4.02Å; I514-D603 WeakPolarHBondContact CG1-OD1 3.49Å; I569-D603 WeakPolarHBondContact CD1-O 3.21Å
604	V	97.9	Very high	92.4	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	134	178.8	-176.2	0	0	0	0	110.4	L487 V497 T498 C499 L500 F509 I510 F547 L549 V602 I606	L487-V604 HydrophobicContact CD1-CG2 4.32Å; V497-V604 HydrophobicContact CB-CG2 4.38Å; V497-V604 HydrophobicContact CG2-CG2 4.14Å; T498-V604 PolarHBondContact O-N 2.85Å; T498-V604 VanDerWaalsContact O-N 3.14Å; C499-V604 CarbonylContact C-O 3.58Å; C499-V604 VanDerWaalsContact CA-O 3.27Å; C499-V604 WeakPolarHBondContact CA-O 3.33Å; L500-V604 PolarHBondContact N-O 3.34Å; F509-V604 CarbonylContact O-C 3.58Å; F509-V604 WeakPolarHBondContact O-CA 3.47Å; I510-V604 HydrophobicContact CD1-CG2 4.39Å; I510-V604 HydrophobicContact CG1-CG2 4.21Å; F547-V604 HydrophobicContact CE2-CG1 4.49Å; F547-V604 HydrophobicContact CZ-CG1 4.16Å; F547-V604 HydrophobicContact CZ-CG2 4.42Å; L549-V604 HydrophobicContact CD1-CG1 4.44Å; V602-V604 WeakPolarHBondContact CG1-O 3.21Å; V604-I606 HydrophobicContact CG1-CG1 4.2Å
605	L	97.4	Very high	92.6	Very high	19 Å²	19	44.1 Å²	44.1	10%	0.099	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	120.8	170.4	-174.1	158.7	0	0	0	108	L500 D502 S508 F509 I569	L500-L605 CarbonylContact O-C 3.6Å; L500-L605 WeakPolarHBondContact O-CA 3.44Å; D502-L605 HydrophobicContact CB-CD1 4.37Å; D502-L605 HydrophobicContact CB-CD2 3.98Å; D502-L605 HydrophobicContact CB-CG 4.15Å; S508-L605 CarbonylContact C-O 3.43Å; S508-L605 VanDerWaalsContact CA-O 3.23Å; S508-L605 WeakPolarHBondContact CA-O 3.39Å; S508-L605 WeakPolarHBondContact CB-O 3.38Å; F509-L605 HydrophobicContact CB-CB 4.34Å; F509-L605 HydrophobicContact CD2-CD2 4.26Å; F509-L605 PolarHBondContact N-O 2.91Å; F509-L605 PolarHBondContact O-N 3.34Å; I569-L605 HydrophobicContact CD1-CB 4.24Å; I569-L605 HydrophobicContact CG2-CB 3.74Å; I569-L605 HydrophobicContact CG2-CD1 3.81Å; I569-L605 HydrophobicContact CG2-CG 4.39Å
606	I	97.6	Very high	92.6	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	105.8	178.9	-60.8	170.6	0	0	0	107.3	C499 L500 F501 D502 L549 M561 V604 H610 F614	C499-I606 HydrophobicContact CB-CD1 4.06Å; L500-I606 PolarHBondContact O-N 2.87Å; F501-I606 HydrophobicContact CD1-CB 4Å; F501-I606 HydrophobicContact CD1-CD1 4.16Å; F501-I606 HydrophobicContact CD1-CG2 3.94Å; F501-I606 HydrophobicContact CD2-CD1 4.46Å; F501-I606 HydrophobicContact CE1-CB 4.12Å; F501-I606 HydrophobicContact CE1-CD1 3.53Å; F501-I606 HydrophobicContact CE1-CG1 4.43Å; F501-I606 HydrophobicContact CE1-CG2 3.9Å; F501-I606 HydrophobicContact CE2-CD1 3.9Å; F501-I606 HydrophobicContact CG-CB 4.48Å; F501-I606 HydrophobicContact CZ-CD1 3.39Å; D502-I606 PolarHBondContact N-O 3.45Å; L549-I606 HydrophobicContact CD1-CD1 4.08Å; M561-I606 HydrophobicContact CE-CG1 4.38Å; V604-I606 HydrophobicContact CG1-CG1 4.2Å; I606-H610 HydrophobicContact CG2-CB 4.09Å; I606-F614 HydrophobicContact CD1-CD2 4.06Å; I606-F614 HydrophobicContact CD1-CE2 3.97Å; I606-F614 HydrophobicContact CD1-CZ 4.34Å; I606-F614 HydrophobicContact CG2-CD2 4.02Å; I606-F614 HydrophobicContact CG2-CE2 4.2Å
607	G	94.8	Very high	92.4	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	175.4	176.5	0	0	0	0	0	111.9	S505 S508 D609 H610 Y611	S505-G607 CarbonylContact O-C 3.54Å; S505-G607 VanDerWaalsContact O-CA 3.26Å; S505-G607 WeakPolarHBondContact O-CA 2.83Å; S508-G607 PolarHBondContact OG-N 2.91Å; G607-D609 VanDerWaalsContact C-OD1 3.31Å; G607-D609 PolarHBondContact O-N 2.99Å; G607-H610 PolarHBondContact O-N 3.48Å; G607-Y611 WeakPolarHBondContact O-CB 3.47Å; G607-Y611 PolarHBondContact O-N 3.4Å
608	L	93.2	Very high	92.6	Very high	82 Å²	82	55.8 Å²	55.8	43%	0.429	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-16.9	179.4	-147.8	76.5	0	0	0	113.7	A503 S505 H610 Y612	A503-L608 HydrophobicContact CB-CD1 3.7Å; S505-L608 PolarHBondContact O-N 2.78Å; L608-H610 VanDerWaalsContact C-N 3.33Å; L608-Y612 HydrophobicContact CD1-CE2 4.37Å
609	D	96.3	Very high	93.1	Very high	53 Å²	53	55.8 Å²	55.8	28%	0.283	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-28.5	173.8	57.9	-17.7	0	0	0	113.6	R507 S508 G607	R507-D609 VanDerWaalsContact CA-OD2 3.3Å; R507-D609 WeakPolarHBondContact CA-OD2 3.47Å; S508-D609 PolarHBondContact N-OD1 2.81Å; S508-D609 PolarHBondContact N-OD2 2.84Å; S508-D609 PolarHBondContact OG-OD1 3.27Å; G607-D609 VanDerWaalsContact C-OD1 3.31Å; G607-D609 PolarHBondContact O-N 2.99Å
610	H	96.7	Very high	93.5	Very high	31 Å²	31	53.5 Å²	53.5	14%	0.144	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-123.6	-2	176.6	-75.5	-63.9	0	0	0	113.4	M561 E562 I606 G607 L608 Y612 D613 F614	M561-H610 HydrophobicContact CE-CB 4.15Å; E562-H610 PolarHBondContact N-NE2 3.21Å; E562-H610 VanDerWaalsContact N-NE2 3.19Å; E562-H610 PolarHBondContact O-NE2 3.06Å; I606-H610 HydrophobicContact CG2-CB 4.09Å; G607-H610 PolarHBondContact O-N 3.48Å; L608-H610 VanDerWaalsContact C-N 3.33Å; H610-Y612 PolarHBondContact O-N 3.44Å; H610-D613 WeakPolarHBondContact CA-OD2 3.46Å; H610-D613 IonicContact CE1-OD2 3.97Å; H610-D613 IonicContact CG-OD2 4Å; H610-D613 IonicContact ND1-OD2 2.96Å; H610-D613 PolarHBondContact ND1-OD2 3.09Å; H610-D613 WeakPolarHBondContact O-CB 3.48Å; H610-D613 PolarHBondContact O-N 2.75Å; H610-F614 HydrophobicContact CB-CE2 4.36Å; H610-F614 VanDerWaalsContact O-CD2 3.3Å; H610-F614 WeakPolarHBondContact O-CD2 3.39Å
611	Y	96.1	Very high	93.7	Very high	18 Å²	18	61.1 Å²	61.1	7%	0.071	29%	0.289	C	S	.	.	H	α-helix	trans	-54.4	-47.9	-173.2	-173.7	-82.6	0	0	0	113.1	Q481 F501 A503 G607 D613 F614 V615	Q481-Y611 VanDerWaalsContact CD-OH 3.26Å; Q481-Y611 PolarHBondContact NE2-OH 2.95Å; Q481-Y611 VanDerWaalsContact NE2-OH 3.16Å; Q481-Y611 PolarHBondContact OE1-OH 3.47Å; F501-Y611 HydrophobicContact CB-CD2 4.19Å; F501-Y611 HydrophobicContact CB-CE2 3.8Å; F501-Y611 HydrophobicContact CD1-CD2 4.06Å; F501-Y611 HydrophobicContact CD1-CE2 4.2Å; F501-Y611 HydrophobicContact CG-CE2 4.49Å; A503-Y611 HydrophobicContact CB-CD2 4.43Å; A503-Y611 HydrophobicContact CB-CE2 4.21Å; G607-Y611 WeakPolarHBondContact O-CB 3.47Å; G607-Y611 PolarHBondContact O-N 3.4Å; Y611-D613 VanDerWaalsContact C-N 3.29Å; Y611-D613 PolarHBondContact O-N 3.27Å; Y611-F614 PolarHBondContact O-N 3.35Å; Y611-V615 HydrophobicContact CD1-CB 4.15Å; Y611-V615 HydrophobicContact CD1-CG2 4.1Å; Y611-V615 HydrophobicContact CE1-CB 3.83Å; Y611-V615 HydrophobicContact CE1-CG1 4.01Å; Y611-V615 HydrophobicContact CE1-CG2 3.69Å; Y611-V615 PolarHBondContact O-N 2.7Å
612	Y	94	Very high	93.5	Very high	165 Å²	165	59.9 Å²	59.9	65%	0.647	29%	0.285	S	S	*	.	H	α-helix	trans	-81.5	-2.6	-178.7	-64.3	-70.3	0	0	0	114	L608 H610	L608-Y612 HydrophobicContact CD1-CE2 4.37Å; H610-Y612 PolarHBondContact O-N 3.44Å
613	D	93.7	Very high	93	Very high	75 Å²	75	67.1 Å²	67.1	40%	0.401	32%	0.318	S	S	.	.	H	α-helix	trans	-75.3	-22.1	168.7	-57.9	-24.8	0	0	0	111.1	H610 Y611	H610-D613 WeakPolarHBondContact CA-OD2 3.46Å; H610-D613 IonicContact CE1-OD2 3.97Å; H610-D613 IonicContact CG-OD2 4Å; H610-D613 IonicContact ND1-OD2 2.96Å; H610-D613 PolarHBondContact ND1-OD2 3.09Å; H610-D613 WeakPolarHBondContact O-CB 3.48Å; H610-D613 PolarHBondContact O-N 2.75Å; Y611-D613 VanDerWaalsContact C-N 3.29Å; Y611-D613 PolarHBondContact O-N 3.27Å
614	F	94.4	Very high	92.1	Very high	2 Å²	2	71.7 Å²	71.7	1%	0.009	35%	0.351	C	S	.	.	H	α-helix	trans	-107	-45.8	178.7	-63.4	-85.5	0	0	0	112.7	F501 L549 Q559 M561 I606 H610 Y611 S632 S633 L634	F501-F614 HydrophobicContact CE1-CB 3.58Å; F501-F614 HydrophobicContact CE1-CD2 4.08Å; F501-F614 AromaticContact CE1-CG 3.95Å; F501-F614 HydrophobicContact CE1-CG 3.95Å; F501-F614 HydrophobicContact CZ-CB 3.86Å; F501-F614 HydrophobicContact CZ-CD2 4.5Å; F501-F614 HydrophobicContact CZ-CG 4.08Å; L549-F614 HydrophobicContact CB-CE1 3.85Å; L549-F614 HydrophobicContact CB-CZ 4.02Å; L549-F614 HydrophobicContact CD1-CE1 4.23Å; L549-F614 HydrophobicContact CD1-CZ 3.88Å; L549-F614 HydrophobicContact CG-CZ 4.39Å; Q559-F614 HydrophobicContact CB-CD1 4.29Å; Q559-F614 HydrophobicContact CB-CE1 3.61Å; Q559-F614 HydrophobicContact CB-CZ 3.76Å; Q559-F614 HydrophobicContact CG-CD1 4.22Å; Q559-F614 HydrophobicContact CG-CE1 4.03Å; M561-F614 HydrophobicContact SD-CE2 4.16Å; M561-F614 HydrophobicContact SD-CZ 4.08Å; I606-F614 HydrophobicContact CD1-CD2 4.06Å; I606-F614 HydrophobicContact CD1-CE2 3.97Å; I606-F614 HydrophobicContact CD1-CZ 4.34Å; I606-F614 HydrophobicContact CG2-CD2 4.02Å; I606-F614 HydrophobicContact CG2-CE2 4.2Å; H610-F614 HydrophobicContact CB-CE2 4.36Å; H610-F614 VanDerWaalsContact O-CD2 3.3Å; H610-F614 WeakPolarHBondContact O-CD2 3.39Å; Y611-F614 PolarHBondContact O-N 3.35Å; F614-S632 CarbonylContact O-C 3.53Å; F614-S632 WeakPolarHBondContact O-CA 3.48Å; F614-S632 VanDerWaalsContact O-CB 3.28Å; F614-S632 WeakPolarHBondContact O-CB 3.02Å; F614-S633 WeakPolarHBondContact CD1-OG 3.48Å; F614-S633 PolarHBondContact O-N 3Å; F614-L634 HydrophobicContact CD1-CD1 4.03Å; F614-L634 HydrophobicContact CD1-CD2 4.31Å; F614-L634 HydrophobicContact CD1-CG 3.94Å; F614-L634 HydrophobicContact CE1-CD1 4.34Å; F614-L634 HydrophobicContact CE1-CD2 4.35Å; F614-L634 HydrophobicContact CE1-CG 4.4Å
615	V	93	Very high	91	Very high	15 Å²	15	74.6 Å²	74.6	9%	0.091	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	130.2	-174.9	176	0	0	0	0	110.7	F501 Y611 I630	F501-V615 HydrophobicContact CD1-CG2 4.16Å; F501-V615 HydrophobicContact CE1-CG2 4.24Å; Y611-V615 HydrophobicContact CD1-CB 4.15Å; Y611-V615 HydrophobicContact CD1-CG2 4.1Å; Y611-V615 HydrophobicContact CE1-CB 3.83Å; Y611-V615 HydrophobicContact CE1-CG1 4.01Å; Y611-V615 HydrophobicContact CE1-CG2 3.69Å; Y611-V615 PolarHBondContact O-N 2.7Å; V615-I630 HydrophobicContact CG1-CG2 3.55Å
616	T	89.1	Confident	90.4	Very high	68 Å²	68	75.5 Å²	75.5	42%	0.417	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	177.2	-179.7	67	0	0	0	0	111.8	E618 R631	T616-E618 VanDerWaalsContact C-N 3.28Å; T616-E618 PolarHBondContact O-N 3.03Å; T616-R631 PolarHBondContact N-O 3.19Å; T616-R631 VanDerWaalsContact OG1-CB 3.28Å; T616-R631 WeakPolarHBondContact OG1-CB 3.3Å; T616-R631 WeakPolarHBondContact OG1-CG 3.38Å; T616-R631 PolarHBondContact OG1-O 3.01Å
617	E	82.7	Confident	90.1	Very high	200 Å²	200	75.5 Å²	75.5	94%	0.935	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.8	-16	-178.8	-58.7	-176.1	178.9	0	0	113.8
618	E	92.3	Very high	90	Very high	120 Å²	120	76.9 Å²	76.9	56%	0.561	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.9	126.3	-178.1	-80.2	-177.1	-128.8	0	0	112.7	T616 R631 W636	T616-E618 VanDerWaalsContact C-N 3.28Å; T616-E618 PolarHBondContact O-N 3.03Å; E618-R631 HydrophobicContact CB-CB 3.63Å; E618-R631 HydrophobicContact CB-CG 4.24Å; E618-R631 WeakPolarHBondContact O-CB 3.39Å; E618-R631 PolarHBondContact O-N 3.38Å; E618-W636 HydrophobicContact CB-CH2 4.38Å
619	M	94.7	Very high	90	Very high	88 Å²	88	73 Å²	73	43%	0.433	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	134	179.3	179.9	-174.7	-71.1	0	0	110.6	R621 V628 A629 I630	M619-R621 HydrophobicContact CG-CG 4.14Å; M619-R621 HydrophobicContact SD-CG 3.96Å; M619-R621 PolarHBondContact SD-NE 3.2Å; M619-V628 HydrophobicContact CE-CG1 4.31Å; M619-V628 HydrophobicContact CG-CG1 3.33Å; M619-V628 HydrophobicContact SD-CG1 3.65Å; M619-A629 WeakPolarHBondContact CA-O 3.44Å; M619-I630 HydrophobicContact CE-CD1 3.99Å; M619-I630 HydrophobicContact CE-CG1 3.98Å; M619-I630 HydrophobicContact CG-CG1 4.33Å
620	K	92	Very high	89.9	Confident	90 Å²	90	71 Å²	71	39%	0.391	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	118.7	170.5	-67	-174.9	175.4	-171.1	0	109.8	H585 L589 V628 A629 W636	H585-K620 WeakPolarHBondContact O-CD 3.3Å; L589-K620 HydrophobicContact CD1-CD 4.3Å; L589-K620 HydrophobicContact CD2-CD 4.32Å; K620-V628 WeakPolarHBondContact O-CG1 3.33Å; K620-A629 HydrophobicContact CB-CB 4.34Å; K620-A629 PolarHBondContact N-O 3.46Å; K620-A629 PolarHBondContact O-N 3.03Å; K620-W636 HydrophobicContact CB-CZ3 4.46Å; K620-W636 HydrophobicContact CD-CH2 4.13Å; K620-W636 HydrophobicContact CD-CZ3 4.32Å; K620-W636 HydrophobicContact CG-CH2 4.01Å; K620-W636 HydrophobicContact CG-CZ3 4.02Å
621	R	91.6	Very high	89.9	Confident	189 Å²	189	73.1 Å²	73.1	71%	0.713	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.6	135.8	177.7	-62.4	-176.8	178.6	-170.2	-0.2	109.4	M619 V628	M619-R621 HydrophobicContact CG-CG 4.14Å; M619-R621 HydrophobicContact SD-CG 3.96Å; M619-R621 PolarHBondContact SD-NE 3.2Å; R621-V628 HydrophobicContact CG-CG1 4.13Å; R621-V628 HydrophobicContact CG-CG2 4.18Å
622	G	85.2	Confident	89.8	Confident	26 Å²	26	72.4 Å²	72.4	27%	0.268	35%	0.35	S	S	.	.			trans	-82.9	-168.7	169.2	0	0	0	0	0	111.7	H585	H585-G622 PolarHBondContact CD2-N 3.49Å; H585-G622 VanDerWaalsContact CD2-N 3.28Å; H585-G622 VanDerWaalsContact CE1-CA 3.4Å; H585-G622 WeakPolarHBondContact CE1-CA 3.13Å; H585-G622 WeakPolarHBondContact NE2-CA 3.31Å; H585-G622 PolarHBondContact NE2-N 2.9Å
623	E	83.1	Confident	89.7	Confident	155 Å²	155	66 Å²	66	72%	0.724	33%	0.33	S	S	*	.	S	Bend	trans	-67.5	175	169.2	-63.2	-161.9	171.3	0	0	112.1	E625 Q626	E623-E625 PolarHBondContact O-N 3.19Å; E623-Q626 HydrophobicContact CB-CG 4.41Å; E623-Q626 WeakPolarHBondContact O-CB 3.4Å; E623-Q626 PolarHBondContact O-N 3.06Å; E623-Q626 VanDerWaalsContact O-N 3.08Å
624	S	78	Confident	89.7	Confident	109 Å²	109	62.5 Å²	62.5	76%	0.762	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.4	137	175.1	-164.2	0	0	0	0	110.9	Q626	S624-Q626 VanDerWaalsContact C-N 3.26Å; S624-Q626 PolarHBondContact O-N 3.43Å
625	E	74.9	Confident	89.6	Confident	61 Å²	61	62.4 Å²	62.4	29%	0.285	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.6	20.6	-176.2	-50.4	-66.3	139.1	0	0	115.7	A476 E623 R641 S643	A476-E625 WeakPolarHBondContact CB-OE2 3.46Å; E623-E625 PolarHBondContact O-N 3.19Å; E625-R641 VanDerWaalsContact CD-CZ 3.43Å; E625-R641 IonicContact OE1-CZ 3.21Å; E625-R641 IonicContact OE1-NE 3.97Å; E625-R641 IonicContact OE1-NH1 3.64Å; E625-R641 PolarHBondContact OE1-NH1 2.96Å; E625-R641 IonicContact OE1-NH2 3.86Å; E625-R641 PolarHBondContact OE1-NH2 3.37Å; E625-R641 IonicContact OE2-CZ 2.69Å; E625-R641 IonicContact OE2-NE 3.83Å; E625-R641 PolarHBondContact OE2-NE 3.37Å; E625-R641 IonicContact OE2-NH1 3.07Å; E625-R641 IonicContact OE2-NH2 3.89Å; E625-R641 PolarHBondContact OE2-NH2 3.11Å; E625-S643 PolarHBondContact O-N 3.05Å; E625-S643 PolarHBondContact O-OG 3.08Å
626	Q	86	Confident	89.7	Confident	38 Å²	38	62.7 Å²	62.7	18%	0.178	31%	0.31	C	S	.	.	S	Bend	trans	-107.3	152.7	166.9	-60.4	-174.4	-7.6	0	0	111.3	H585 E623 S624 R641	H585-Q626 PolarHBondContact CE1-OE1 3.4Å; E623-Q626 HydrophobicContact CB-CG 4.41Å; E623-Q626 WeakPolarHBondContact O-CB 3.4Å; E623-Q626 PolarHBondContact O-N 3.06Å; E623-Q626 VanDerWaalsContact O-N 3.08Å; S624-Q626 VanDerWaalsContact C-N 3.26Å; S624-Q626 PolarHBondContact O-N 3.43Å; Q626-R641 CarbonylContact C-O 3.58Å
627	P	89.6	Confident	90	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-71	162.2	179.2	30.2	-35.6	0	0	0	111.6	M479 W583 H585 I638 C639	M479-P627 HydrophobicContact CE-CB 3.41Å; M479-P627 VanDerWaalsContact CE-CB 3.41Å; M479-P627 HydrophobicContact CE-CG 3.74Å; W583-P627 HydrophobicContact CD2-CG 3.64Å; W583-P627 VanDerWaalsContact CE2-CD 3.43Å; W583-P627 HydrophobicContact CE3-CG 3.65Å; W583-P627 HydrophobicContact CG-CG 4.3Å; W583-P627 HydrophobicContact CH2-CG 3.91Å; W583-P627 HydrophobicContact CZ2-CG 3.88Å; W583-P627 HydrophobicContact CZ3-CG 3.8Å; H585-P627 PolarHBondContact NE2-O 3.31Å; P627-I638 HydrophobicContact CB-CG2 3.76Å; P627-I638 HydrophobicContact CG-CG2 4.01Å; P627-C639 CarbonylContact C-O 3.42Å; P627-C639 WeakPolarHBondContact CA-O 3.24Å; P627-C639 WeakPolarHBondContact CB-O 3.41Å
628	V	92.7	Very high	90.5	Very high	30 Å²	30	50 Å²	50	18%	0.182	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	137.7	175.3	-179.5	0	0	0	0	109	M619 K620 R621 I630 I638 C639	M619-V628 HydrophobicContact CE-CG1 4.31Å; M619-V628 HydrophobicContact CG-CG1 3.33Å; M619-V628 HydrophobicContact SD-CG1 3.65Å; K620-V628 WeakPolarHBondContact O-CG1 3.33Å; R621-V628 HydrophobicContact CG-CG1 4.13Å; R621-V628 HydrophobicContact CG-CG2 4.18Å; V628-I630 HydrophobicContact CG1-CG1 4.03Å; V628-I638 WeakPolarHBondContact O-CA 3.45Å; V628-C639 PolarHBondContact N-O 3.1Å; V628-C639 PolarHBondContact O-N 3.18Å
629	A	94.4	Very high	90.5	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	124.9	168.8	0	0	0	0	0	109.6	V586 L589 M619 K620 W636 I637 I638	V586-A629 HydrophobicContact CG1-CB 4Å; L589-A629 HydrophobicContact CD1-CB 3.73Å; M619-A629 WeakPolarHBondContact CA-O 3.44Å; K620-A629 HydrophobicContact CB-CB 4.34Å; K620-A629 PolarHBondContact N-O 3.46Å; K620-A629 PolarHBondContact O-N 3.03Å; A629-W636 HydrophobicContact CB-CE3 3.79Å; A629-W636 HydrophobicContact CB-CZ3 4.32Å; A629-I637 CarbonylContact C-O 3.49Å; A629-I637 WeakPolarHBondContact CA-O 3.47Å; A629-I638 HydrophobicContact CB-CD1 3.49Å; A629-I638 VanDerWaalsContact CB-CD1 3.49Å
630	I	95	Very high	90.1	Very high	12 Å²	12	41.8 Å²	41.8	6%	0.062	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	130.5	179.4	-59.5	177.2	0	0	0	108.3	Q481 V615 M619 V628 I637	Q481-I630 VanDerWaalsContact NE2-CD1 3.31Å; V615-I630 HydrophobicContact CG1-CG2 3.55Å; M619-I630 HydrophobicContact CE-CD1 3.99Å; M619-I630 HydrophobicContact CE-CG1 3.98Å; M619-I630 HydrophobicContact CG-CG1 4.33Å; V628-I630 HydrophobicContact CG1-CG1 4.03Å; I630-I637 PolarHBondContact N-O 3.24Å; I630-I637 PolarHBondContact O-N 2.82Å
631	R	94.9	Very high	89.6	Confident	75 Å²	75	43.1 Å²	43.1	28%	0.283	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	128.5	179.1	-177.3	65.1	176.7	173.3	1.7	110	T616 E618 W636	T616-R631 PolarHBondContact N-O 3.19Å; T616-R631 VanDerWaalsContact OG1-CB 3.28Å; T616-R631 WeakPolarHBondContact OG1-CB 3.3Å; T616-R631 WeakPolarHBondContact OG1-CG 3.38Å; T616-R631 PolarHBondContact OG1-O 3.01Å; E618-R631 HydrophobicContact CB-CB 3.63Å; E618-R631 HydrophobicContact CB-CG 4.24Å; E618-R631 WeakPolarHBondContact O-CB 3.39Å; E618-R631 PolarHBondContact O-N 3.38Å; R631-W636 HydrophobicContact CB-CD2 4.31Å; R631-W636 HydrophobicContact CB-CE3 4.05Å; R631-W636 HydrophobicContact CB-CH2 3.91Å; R631-W636 HydrophobicContact CB-CZ2 4.18Å; R631-W636 HydrophobicContact CB-CZ3 3.86Å; R631-W636 HydrophobicContact CG-CZ2 4.38Å
632	S	93.9	Very high	88.8	Confident	2 Å²	2	34.6 Å²	34.6	1%	0.014	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	166.5	170.8	77.3	0	0	0	0	111.5	F614 L634 G635	F614-S632 CarbonylContact O-C 3.53Å; F614-S632 WeakPolarHBondContact O-CA 3.48Å; F614-S632 VanDerWaalsContact O-CB 3.28Å; F614-S632 WeakPolarHBondContact O-CB 3.02Å; S632-L634 PolarHBondContact O-N 3.33Å; S632-L634 PolarHBondContact OG-N 3.42Å; S632-G635 PolarHBondContact N-O 3.09Å; S632-G635 PolarHBondContact O-N 2.96Å; S632-G635 VanDerWaalsContact O-N 3.12Å; S632-G635 PolarHBondContact OG-N 2.81Å; S632-G635 PolarHBondContact OG-O 2.81Å
633	S	92.1	Very high	87.9	Confident	32 Å²	32	36.1 Å²	36.1	22%	0.224	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-15.2	170.6	58.3	0	0	0	0	113.8	F614	F614-S633 WeakPolarHBondContact CD1-OG 3.48Å; F614-S633 PolarHBondContact O-N 3Å
634	L	94.1	Very high	86.6	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.6	-7	176.5	-57.1	178.9	0	0	0	113.8	A483 A485 F501 G550 A592 F614 S632	A483-L634 HydrophobicContact CB-CD1 4.18Å; A485-L634 HydrophobicContact CB-CD1 3.89Å; A485-L634 HydrophobicContact CB-CD2 4.09Å; F501-L634 HydrophobicContact CE2-CD1 4.36Å; F501-L634 HydrophobicContact CZ-CD1 4.07Å; G550-L634 VanDerWaalsContact C-CD2 3.45Å; A592-L634 HydrophobicContact CB-CB 4.41Å; F614-L634 HydrophobicContact CD1-CD1 4.03Å; F614-L634 HydrophobicContact CD1-CD2 4.31Å; F614-L634 HydrophobicContact CD1-CG 3.94Å; F614-L634 HydrophobicContact CE1-CD1 4.34Å; F614-L634 HydrophobicContact CE1-CD2 4.35Å; F614-L634 HydrophobicContact CE1-CG 4.4Å; S632-L634 PolarHBondContact O-N 3.33Å; S632-L634 PolarHBondContact OG-N 3.42Å
635	G	93	Very high	85.3	Confident	1 Å²	1	33.2 Å²	33.2	1%	0.01	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	123.7	-173.1	-171.6	0	0	0	0	0	112.6	S632	S632-G635 PolarHBondContact N-O 3.09Å; S632-G635 PolarHBondContact O-N 2.96Å; S632-G635 VanDerWaalsContact O-N 3.12Å; S632-G635 PolarHBondContact OG-N 2.81Å; S632-G635 PolarHBondContact OG-O 2.81Å
636	W	95.2	Very high	83.9	Confident	20 Å²	20	31.5 Å²	31.5	8%	0.076	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	120.9	176.5	-71.6	92.2	0	0	0	111.3	L589 T590 L591 A592 E618 K620 A629 R631	L589-W636 HydrophobicContact CB-CB 4.15Å; L589-W636 HydrophobicContact CB-CG 3.91Å; L589-W636 HydrophobicContact CD1-CB 4.21Å; L589-W636 HydrophobicContact CD1-CD2 3.75Å; L589-W636 HydrophobicContact CD1-CE3 3.94Å; L589-W636 HydrophobicContact CD1-CG 3.89Å; L589-W636 HydrophobicContact CD2-CD2 4.17Å; L589-W636 HydrophobicContact CD2-CG 4.37Å; L589-W636 HydrophobicContact CD2-CZ2 4.21Å; L589-W636 HydrophobicContact CG-CD2 4.38Å; L589-W636 HydrophobicContact CG-CG 4.28Å; T590-W636 PolarHBondContact O-N 3.16Å; L591-W636 CarbonylContact C-O 3.57Å; L591-W636 WeakPolarHBondContact CA-O 3.29Å; L591-W636 HydrophobicContact CD2-CB 4.03Å; A592-W636 PolarHBondContact N-O 3.48Å; E618-W636 HydrophobicContact CB-CH2 4.38Å; K620-W636 HydrophobicContact CB-CZ3 4.46Å; K620-W636 HydrophobicContact CD-CH2 4.13Å; K620-W636 HydrophobicContact CD-CZ3 4.32Å; K620-W636 HydrophobicContact CG-CH2 4.01Å; K620-W636 HydrophobicContact CG-CZ3 4.02Å; A629-W636 HydrophobicContact CB-CE3 3.79Å; A629-W636 HydrophobicContact CB-CZ3 4.32Å; R631-W636 HydrophobicContact CB-CD2 4.31Å; R631-W636 HydrophobicContact CB-CE3 4.05Å; R631-W636 HydrophobicContact CB-CH2 3.91Å; R631-W636 HydrophobicContact CB-CZ2 4.18Å; R631-W636 HydrophobicContact CB-CZ3 3.86Å; R631-W636 HydrophobicContact CG-CZ2 4.38Å
637	I	95.2	Very high	81.8	Confident	2 Å²	2	37.5 Å²	37.5	1%	0.01	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	122.2	177.8	-60.4	172.4	0	0	0	108.6	Q481 A483 F501 A592 A629 I630	Q481-I637 HydrophobicContact CB-CG2 3.82Å; Q481-I637 HydrophobicContact CG-CG2 4.07Å; A483-I637 HydrophobicContact CB-CG1 4.43Å; F501-I637 HydrophobicContact CD2-CD1 3.79Å; F501-I637 HydrophobicContact CE2-CD1 3.56Å; F501-I637 HydrophobicContact CG-CD1 4.4Å; F501-I637 HydrophobicContact CZ-CD1 4.01Å; A592-I637 HydrophobicContact CB-CG1 3.92Å; A629-I637 CarbonylContact C-O 3.49Å; A629-I637 WeakPolarHBondContact CA-O 3.47Å; I630-I637 PolarHBondContact N-O 3.24Å; I630-I637 PolarHBondContact O-N 2.82Å
638	I	93.1	Very high	79.4	Confident	1 Å²	1	40.4 Å²	40.4	1%	0.005	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	129.1	175.8	-51.5	-54.1	0	0	0	109.3	M479 I579 V586 L591 F595 P627 V628 A629	M479-I638 HydrophobicContact CE-CG2 3.5Å; M479-I638 HydrophobicContact SD-CG2 4.46Å; I579-I638 HydrophobicContact CD1-CG1 4.37Å; V586-I638 HydrophobicContact CB-CD1 4.02Å; V586-I638 HydrophobicContact CG1-CD1 3.86Å; L591-I638 HydrophobicContact CD1-CG1 4.33Å; L591-I638 HydrophobicContact CD2-CD1 3.73Å; L591-I638 HydrophobicContact CD2-CG1 3.82Å; F595-I638 HydrophobicContact CE2-CB 4.36Å; F595-I638 HydrophobicContact CE2-CG1 4.26Å; F595-I638 HydrophobicContact CZ-CB 3.9Å; F595-I638 HydrophobicContact CZ-CG1 4.27Å; P627-I638 HydrophobicContact CB-CG2 3.76Å; P627-I638 HydrophobicContact CG-CG2 4.01Å; V628-I638 WeakPolarHBondContact O-CA 3.45Å; A629-I638 HydrophobicContact CB-CD1 3.49Å; A629-I638 VanDerWaalsContact CB-CD1 3.49Å
639	C	91	Very high	76.8	Confident	11 Å²	11	42.3 Å²	42.3	7%	0.074	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	167.8	-178.9	64.5	0	0	0	0	112.2	M479 Q481 P627 V628	M479-C639 WeakPolarHBondContact O-CA 3.49Å; Q481-C639 HydrophobicContact CB-CB 4.34Å; Q481-C639 HydrophobicContact CG-CB 3.38Å; Q481-C639 VanDerWaalsContact CG-SG 3.52Å; P627-C639 CarbonylContact C-O 3.42Å; P627-C639 WeakPolarHBondContact CA-O 3.24Å; P627-C639 WeakPolarHBondContact CB-O 3.41Å; V628-C639 PolarHBondContact N-O 3.1Å; V628-C639 PolarHBondContact O-N 3.18Å
640	G	87.2	Confident	74.4	Confident	23 Å²	23	45.8 Å²	45.8	24%	0.237	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	100.2	-168.3	178	0	0	0	0	0	114.4	V478 M479	V478-G640 WeakPolarHBondContact CA-O 3.41Å; M479-G640 PolarHBondContact N-O 3.42Å; M479-G640 PolarHBondContact O-N 3.41Å
641	R	81.4	Confident	71.9	Confident	119 Å²	119	50.6 Å²	50.6	45%	0.449	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	150.1	-169.1	-59.3	179.4	72.2	-161.4	-9.9	112	A476 A477 V478 E625 Q626	A476-R641 HydrophobicContact CB-CB 4.49Å; A477-R641 CarbonylContact O-C 3.45Å; V478-R641 HydrophobicContact CG2-CG 4.18Å; E625-R641 VanDerWaalsContact CD-CZ 3.43Å; E625-R641 IonicContact OE1-CZ 3.21Å; E625-R641 IonicContact OE1-NE 3.97Å; E625-R641 IonicContact OE1-NH1 3.64Å; E625-R641 PolarHBondContact OE1-NH1 2.96Å; E625-R641 IonicContact OE1-NH2 3.86Å; E625-R641 PolarHBondContact OE1-NH2 3.37Å; E625-R641 IonicContact OE2-CZ 2.69Å; E625-R641 IonicContact OE2-NE 3.83Å; E625-R641 PolarHBondContact OE2-NE 3.37Å; E625-R641 IonicContact OE2-NH1 3.07Å; E625-R641 IonicContact OE2-NH2 3.89Å; E625-R641 PolarHBondContact OE2-NH2 3.11Å; Q626-R641 CarbonylContact C-O 3.58Å
642	T	75.5	Confident	69.6	Low	10 Å²	10	50.7 Å²	50.7	6%	0.061	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	141.9	176.7	60.1	0	0	0	0	110.9	A476 A477 M479 W583 E644	A476-T642 WeakPolarHBondContact CA-O 3.49Å; A476-T642 WeakPolarHBondContact CB-O 3.41Å; A477-T642 VanDerWaalsContact CB-OG1 3.29Å; A477-T642 WeakPolarHBondContact CB-OG1 3.46Å; A477-T642 PolarHBondContact N-O 3.23Å; A477-T642 PolarHBondContact O-N 3.19Å; A477-T642 PolarHBondContact O-OG1 3.46Å; M479-T642 HydrophobicContact CE-CG2 3.62Å; M479-T642 HydrophobicContact CG-CG2 4.31Å; M479-T642 HydrophobicContact SD-CG2 4.42Å; W583-T642 HydrophobicContact CH2-CG2 3.83Å; W583-T642 HydrophobicContact CZ2-CG2 3.72Å; T642-E644 VanDerWaalsContact C-N 3.28Å; T642-E644 PolarHBondContact O-N 2.68Å
643	S	65.4	Low	67.5	Low	57 Å²	57	53.5 Å²	53.5	40%	0.399	31%	0.308	S	S	.	.	S	Bend	trans	-70	-5.3	-151.9	-25.7	0	0	0	0	117.2	E625	E625-S643 PolarHBondContact O-N 3.05Å; E625-S643 PolarHBondContact O-OG 3.08Å
644	E	56.1	Low	64.9	Low	115 Å²	115	55.8 Å²	55.8	54%	0.537	32%	0.316	S	S	.	.			trans	-112.8	129.9	-173.9	-77.5	176.2	155.5	0	0	113.5	R580 T642 A646	R580-E644 IonicContact CZ-OE2 3.35Å; R580-E644 IonicContact NH1-OE2 3.72Å; R580-E644 IonicContact NH2-OE2 2.92Å; R580-E644 PolarHBondContact NH2-OE2 2.82Å; T642-E644 VanDerWaalsContact C-N 3.28Å; T642-E644 PolarHBondContact O-N 2.68Å; E644-A646 PolarHBondContact O-N 3.32Å
645	P	50.7	Low	62.1	Low	88 Å²	88	60.8 Å²	60.8	57%	0.571	35%	0.347	S	S	*	.			trans	-72.3	116.6	164	28.3	-28.1	0	0	0	108.9
646	A	45.9	Very low	59.3	Low	26 Å²	26	63.6 Å²	63.6	22%	0.215	36%	0.364	C	S	.	.			trans	-88.1	140.6	170.7	0	0	0	0	0	109.8	E644 S648	E644-A646 PolarHBondContact O-N 3.32Å; A646-S648 PolarHBondContact O-N 3.19Å
647	D	42.5	Very low	56.5	Low	163 Å²	163	68.4 Å²	68.4	87%	0.872	40%	0.395	S	S	*	.	S	Bend	trans	-73.1	38.6	-169.4	-140.1	5.4	0	0	0	114.2
648	S	38.1	Very low	53.9	Low	62 Å²	62	76.5 Å²	76.5	43%	0.434	43%	0.433	S	S	.	.	S	Bend	trans	-136	146.3	-175.4	-66	0	0	0	0	112	S472 S473 A646	S472-S648 CarbonylContact C-O 3.6Å; S473-S648 WeakPolarHBondContact CA-O 3.49Å; S473-S648 PolarHBondContact N-O 3.03Å; A646-S648 PolarHBondContact O-N 3.19Å
649	A	38.8	Very low	51.6	Low	69 Å²	69	79.8 Å²	79.8	57%	0.57	45%	0.449	S	S	*	.			trans	-51.9	143.9	-175.5	0	0	0	0	0	113.5	R471 R651	R471-A649 CarbonylContact O-C 3.47Å; A649-R651 WeakPolarHBondContact O-CG 3.44Å; A649-R651 PolarHBondContact O-N 3.45Å
650	S	42.7	Very low	49.5	Very low	74 Å²	74	81 Å²	81	52%	0.517	46%	0.457	S	S	.	.			trans	-45.5	122.9	173.4	-92.5	0	0	0	0	112.9	R471 S472	R471-S650 WeakPolarHBondContact O-CA 3.5Å; S472-S650 VanDerWaalsContact CB-OG 3.26Å; S472-S650 WeakPolarHBondContact CB-OG 3.22Å; S472-S650 PolarHBondContact OG-OG 3.18Å
651	R	43.8	Very low	47.8	Very low	112 Å²	112	85.5 Å²	85.5	42%	0.423	48%	0.48	S	S	.	.			trans	-124.4	116.4	174.9	-70.5	172.6	-176.8	177.5	-8.1	110.9	Q466 L470 R471 A649	Q466-R651 VanDerWaalsContact OE1-NH2 3.12Å; L470-R651 WeakPolarHBondContact CD1-O 3.35Å; L470-R651 WeakPolarHBondContact CG-O 3.5Å; R471-R651 PolarHBondContact O-N 2.86Å; A649-R651 WeakPolarHBondContact O-CG 3.44Å; A649-R651 PolarHBondContact O-N 3.45Å
652	V	46.2	Very low	46.3	Very low	78 Å²	78	84.1 Å²	84.1	47%	0.473	48%	0.479	S	S	.	.			trans	-100.3	143	-179	-175	0	0	0	0	109.4	L470 M654 V655	L470-V652 HydrophobicContact CD1-CB 4.33Å; L470-V652 HydrophobicContact CD1-CG1 4.33Å; L470-V652 HydrophobicContact CD1-CG2 4.3Å; V652-M654 PolarHBondContact O-N 3.39Å; V652-V655 HydrophobicContact CB-CG2 4.31Å; V652-V655 HydrophobicContact CG1-CG2 4.34Å
653	L	48.5	Very low	45.3	Very low	61 Å²	61	88 Å²	88	32%	0.319	50%	0.497	S	S	.	.	S	Bend	trans	-51.4	-32	-178.5	-156.5	81.9	0	0	0	113.3	V467 L480	V467-L653 HydrophobicContact CB-CD1 4.33Å; V467-L653 HydrophobicContact CG1-CD1 3.22Å; V467-L653 HydrophobicContact CG1-CG 3.95Å; L480-L653 HydrophobicContact CD1-CD1 3.28Å; L480-L653 HydrophobicContact CD1-CD2 4.45Å; L480-L653 HydrophobicContact CG-CD1 4.46Å
654	M	37.6	Very low	44.8	Very low	79 Å²	79	87.7 Å²	87.7	39%	0.389	50%	0.498	S	S	.	.			trans	-158.2	114.3	175.4	-164.5	167.5	-173.4	0	0	110.7	A531 V652 T656	A531-M654 HydrophobicContact CB-CE 3.48Å; A531-M654 VanDerWaalsContact CB-CE 3.48Å; A531-M654 HydrophobicContact CB-SD 3.91Å; V652-M654 PolarHBondContact O-N 3.39Å; M654-T656 WeakPolarHBondContact CE-OG1 3.34Å
655	V	35.9	Very low	44.7	Very low	106 Å²	106	85.6 Å²	85.6	64%	0.642	49%	0.49	S	S	*	.			trans	-134.9	89.2	148.3	-179.4	0	0	0	0	105.3	V652 T657	V652-V655 HydrophobicContact CB-CG2 4.31Å; V652-V655 HydrophobicContact CG1-CG2 4.34Å; V655-T657 HydrophobicContact CG1-CG2 4.47Å
656	T	34.8	Very low	45	Very low	60 Å²	60	87.2 Å²	87.2	37%	0.368	49%	0.485	S	S	.	.			trans	-100	95.9	169.7	49.2	0	0	0	0	107.8	I465 M654 E658	I465-T656 HydrophobicContact CD1-CG2 3.63Å; M654-T656 WeakPolarHBondContact CE-OG1 3.34Å; T656-E658 PolarHBondContact O-N 2.83Å; T656-E658 VanDerWaalsContact O-N 3.15Å
657	T	36.6	Very low	45.6	Very low	120 Å²	120	91 Å²	91	74%	0.736	49%	0.494	S	S	*	.			trans	-79.4	69.2	154.1	55.6	0	0	0	0	107.3	V655 E659	V655-T657 HydrophobicContact CG1-CG2 4.47Å; T657-E659 PolarHBondContact O-N 3.19Å; T657-E659 VanDerWaalsContact O-N 3.14Å
658	E	40	Very low	46.4	Very low	172 Å²	172	86.8 Å²	86.8	80%	0.804	47%	0.471	S	S	*	.			trans	-70.8	107	158.6	-90.8	-166.6	170.5	0	0	106	T656 S660	T656-E658 PolarHBondContact O-N 2.83Å; T656-E658 VanDerWaalsContact O-N 3.15Å; E658-S660 PolarHBondContact O-N 3.28Å
659	E	45.1	Very low	47.4	Very low	71 Å²	71	87.5 Å²	87.5	33%	0.332	46%	0.464	S	S	.	.			trans	-61.8	133.2	172.8	-78	177.7	-177.9	0	0	108.8	T657 T661 M663 R667	T657-E659 PolarHBondContact O-N 3.19Å; T657-E659 VanDerWaalsContact O-N 3.14Å; E659-T661 PolarHBondContact O-N 2.71Å; E659-M663 HydrophobicContact CB-CB 4.07Å; E659-M663 HydrophobicContact CG-CE 4.26Å; E659-M663 HydrophobicContact CG-SD 4.49Å; E659-R667 VanDerWaalsContact CD-CZ 3.49Å; E659-R667 IonicContact OE1-CZ 3.94Å; E659-R667 IonicContact OE1-NE 3.46Å; E659-R667 IonicContact OE1-NH1 3.94Å; E659-R667 PolarHBondContact OE1-NH1 3.43Å; E659-R667 IonicContact OE1-NH2 3.54Å; E659-R667 PolarHBondContact OE1-NH2 3.05Å; E659-R667 IonicContact OE2-CZ 3.38Å; E659-R667 VanDerWaalsContact OE2-CZ 3.28Å; E659-R667 IonicContact OE2-NE 2.82Å; E659-R667 IonicContact OE2-NH1 3.1Å; E659-R667 PolarHBondContact OE2-NH1 3.46Å; E659-R667 IonicContact OE2-NH2 2.73Å
660	S	46.7	Very low	48.4	Very low	35 Å²	35	89.9 Å²	89.9	25%	0.245	46%	0.463	C	S	.	.			trans	-42.3	138.5	170.3	165.8	0	0	0	0	109.8	E658 E662 M663 A664	E658-S660 PolarHBondContact O-N 3.28Å; S660-E662 CarbonylContact O-C 3.59Å; S660-E662 PolarHBondContact O-N 3.49Å; S660-E662 WeakPolarHBondContact OG-CB 2.84Å; S660-E662 PolarHBondContact OG-N 2.89Å; S660-M663 WeakPolarHBondContact O-CA 3.44Å; S660-M663 WeakPolarHBondContact O-CB 3.34Å; S660-M663 PolarHBondContact O-N 3.06Å; S660-A664 PolarHBondContact O-N 3.19Å
661	T	50.4	Low	49.2	Very low	119 Å²	119	89 Å²	89	73%	0.73	45%	0.453	S	S	*	.	H	α-helix	trans	-49.9	-29.3	169.3	42.4	0	0	0	0	111.7	E659 L665	E659-T661 PolarHBondContact O-N 2.71Å; T661-L665 VanDerWaalsContact O-CB 3.3Å; T661-L665 WeakPolarHBondContact O-CB 3.41Å; T661-L665 WeakPolarHBondContact O-CD1 3.4Å; T661-L665 PolarHBondContact O-N 2.85Å
662	E	51.6	Low	49.7	Very low	89 Å²	89	84.3 Å²	84.3	42%	0.416	44%	0.436	S	S	.	.	H	α-helix	trans	-66.7	-43.4	171.8	-165.5	-169.1	151.7	0	0	112.8	S660 L665 R666	S660-E662 CarbonylContact O-C 3.59Å; S660-E662 PolarHBondContact O-N 3.49Å; S660-E662 WeakPolarHBondContact OG-CB 2.84Å; S660-E662 PolarHBondContact OG-N 2.89Å; E662-L665 WeakPolarHBondContact O-CB 3.21Å; E662-L665 PolarHBondContact O-N 2.98Å; E662-R666 WeakPolarHBondContact O-CG 3.49Å; E662-R666 PolarHBondContact O-N 3.05Å; E662-R666 IonicContact OE1-CZ 3.75Å; E662-R666 IonicContact OE1-NE 3.5Å; E662-R666 PolarHBondContact OE1-NE 3.35Å; E662-R666 IonicContact OE1-NH2 3.36Å; E662-R666 PolarHBondContact OE1-NH2 2.76Å
663	M	53.9	Low	49.9	Very low	92 Å²	92	81.7 Å²	81.7	45%	0.453	42%	0.423	S	S	.	.	H	α-helix	trans	-67.1	-40.6	174.8	-81.9	-171.1	69.4	0	0	111.8	E659 S660 L665 R666 R667	E659-M663 HydrophobicContact CB-CB 4.07Å; E659-M663 HydrophobicContact CG-CE 4.26Å; E659-M663 HydrophobicContact CG-SD 4.49Å; S660-M663 WeakPolarHBondContact O-CA 3.44Å; S660-M663 WeakPolarHBondContact O-CB 3.34Å; S660-M663 PolarHBondContact O-N 3.06Å; M663-L665 VanDerWaalsContact C-N 3.3Å; M663-L665 PolarHBondContact O-N 3.31Å; M663-R666 PolarHBondContact O-N 3.17Å; M663-R667 PolarHBondContact O-N 3.4Å
664	A	55.2	Low	49.7	Very low	50 Å²	50	82.4 Å²	82.4	41%	0.413	43%	0.426	S	S	.	.	H	α-helix	trans	-61	-40.9	172.9	0	0	0	0	0	111.3	S660 L668	S660-A664 PolarHBondContact O-N 3.19Å; A664-L668 WeakPolarHBondContact O-CB 3.41Å; A664-L668 PolarHBondContact O-N 2.99Å
665	L	54	Low	50.2	Low	71 Å²	71	81.4 Å²	81.4	37%	0.372	44%	0.436	S	S	.	.	H	α-helix	trans	-62.9	-43.1	171.7	-99.2	148	0	0	0	112.4	T661 E662 M663 L668 W669	T661-L665 VanDerWaalsContact O-CB 3.3Å; T661-L665 WeakPolarHBondContact O-CB 3.41Å; T661-L665 WeakPolarHBondContact O-CD1 3.4Å; T661-L665 PolarHBondContact O-N 2.85Å; E662-L665 WeakPolarHBondContact O-CB 3.21Å; E662-L665 PolarHBondContact O-N 2.98Å; M663-L665 VanDerWaalsContact C-N 3.3Å; M663-L665 PolarHBondContact O-N 3.31Å; L665-L668 WeakPolarHBondContact O-CB 3.41Å; L665-L668 PolarHBondContact O-N 3.1Å; L665-W669 HydrophobicContact CB-CZ2 4.4Å; L665-W669 HydrophobicContact CD2-CH2 4.32Å; L665-W669 HydrophobicContact CD2-CZ2 3.49Å; L665-W669 VanDerWaalsContact CD2-CZ2 3.49Å; L665-W669 VanDerWaalsContact O-CD2 3.24Å; L665-W669 PolarHBondContact O-N 3.02Å
666	R	56.6	Low	50.6	Low	123 Å²	123	79.6 Å²	79.6	46%	0.464	42%	0.422	S	S	.	.	H	α-helix	trans	-62.1	-48.2	175.3	-76	-177.1	-171.2	-162.2	5.3	111.6	E662 M663 L668 W669 E670	E662-R666 WeakPolarHBondContact O-CG 3.49Å; E662-R666 PolarHBondContact O-N 3.05Å; E662-R666 IonicContact OE1-CZ 3.75Å; E662-R666 IonicContact OE1-NE 3.5Å; E662-R666 PolarHBondContact OE1-NE 3.35Å; E662-R666 IonicContact OE1-NH2 3.36Å; E662-R666 PolarHBondContact OE1-NH2 2.76Å; M663-R666 PolarHBondContact O-N 3.17Å; R666-L668 VanDerWaalsContact C-N 3.34Å; R666-L668 PolarHBondContact O-N 3.35Å; R666-W669 HydrophobicContact CG-CE3 4.41Å; R666-W669 CarbonylContact O-C 3.49Å; R666-W669 WeakPolarHBondContact O-CA 3.42Å; R666-W669 WeakPolarHBondContact O-CB 3.17Å; R666-W669 PolarHBondContact O-N 3.05Å; R666-E670 WeakPolarHBondContact O-CG 3.31Å; R666-E670 PolarHBondContact O-N 3.41Å
667	R	59.1	Low	50.9	Low	105 Å²	105	81.4 Å²	81.4	40%	0.396	43%	0.433	S	S	.	.	H	α-helix	trans	-62.3	-39.7	175.4	-85.8	-171.2	178.2	158.8	12.8	112.7	E659 M663 W669 E670 L671	E659-R667 VanDerWaalsContact CD-CZ 3.49Å; E659-R667 IonicContact OE1-CZ 3.94Å; E659-R667 IonicContact OE1-NE 3.46Å; E659-R667 IonicContact OE1-NH1 3.94Å; E659-R667 PolarHBondContact OE1-NH1 3.43Å; E659-R667 IonicContact OE1-NH2 3.54Å; E659-R667 PolarHBondContact OE1-NH2 3.05Å; E659-R667 IonicContact OE2-CZ 3.38Å; E659-R667 VanDerWaalsContact OE2-CZ 3.28Å; E659-R667 IonicContact OE2-NE 2.82Å; E659-R667 IonicContact OE2-NH1 3.1Å; E659-R667 PolarHBondContact OE2-NH1 3.46Å; E659-R667 IonicContact OE2-NH2 2.73Å; M663-R667 PolarHBondContact O-N 3.4Å; R667-W669 PolarHBondContact O-N 3.31Å; R667-E670 CarbonylContact O-C 3.44Å; R667-E670 WeakPolarHBondContact O-CB 3.44Å; R667-E670 PolarHBondContact O-N 3.29Å; R667-E670 VanDerWaalsContact O-N 3.1Å; R667-L671 WeakPolarHBondContact O-CG 3.35Å; R667-L671 PolarHBondContact O-N 3.17Å
668	L	58.3	Low	51.2	Low	74 Å²	74	83.9 Å²	83.9	39%	0.387	44%	0.442	S	S	.	.	H	α-helix	trans	-57	-38.6	171.7	178.8	69.1	0	0	0	111.1	A664 L665 R666 L671 L1340	A664-L668 WeakPolarHBondContact O-CB 3.41Å; A664-L668 PolarHBondContact O-N 2.99Å; L665-L668 WeakPolarHBondContact O-CB 3.41Å; L665-L668 PolarHBondContact O-N 3.1Å; R666-L668 VanDerWaalsContact C-N 3.34Å; R666-L668 PolarHBondContact O-N 3.35Å; L668-L671 HydrophobicContact CD1-CD1 4.48Å; L668-L1340 WeakPolarHBondContact CD1-O 3.43Å
669	W	60.2	Low	51.4	Low	77 Å²	77	80.9 Å²	80.9	29%	0.292	43%	0.431	S	S	.	.	H	α-helix	trans	-74.7	-30.9	174.7	-58.7	-21.9	0	0	0	113.3	L665 R666 R667 M1180	L665-W669 HydrophobicContact CB-CZ2 4.4Å; L665-W669 HydrophobicContact CD2-CH2 4.32Å; L665-W669 HydrophobicContact CD2-CZ2 3.49Å; L665-W669 VanDerWaalsContact CD2-CZ2 3.49Å; L665-W669 VanDerWaalsContact O-CD2 3.24Å; L665-W669 PolarHBondContact O-N 3.02Å; R666-W669 HydrophobicContact CG-CE3 4.41Å; R666-W669 CarbonylContact O-C 3.49Å; R666-W669 WeakPolarHBondContact O-CA 3.42Å; R666-W669 WeakPolarHBondContact O-CB 3.17Å; R666-W669 PolarHBondContact O-N 3.05Å; R667-W669 PolarHBondContact O-N 3.31Å; W669-M1180 HydrophobicContact CH2-SD 3.66Å; W669-M1180 HydrophobicContact CZ3-SD 3.62Å
670	E	60.3	Low	51.1	Low	119 Å²	119	81.4 Å²	81.4	56%	0.556	46%	0.456	S	S	*	.	H	α-helix	trans	-70.1	-28.3	172.1	-69.7	165.5	-171.6	0	0	112.4	R666 R667 D672 A673	R666-E670 WeakPolarHBondContact O-CG 3.31Å; R666-E670 PolarHBondContact O-N 3.41Å; R667-E670 CarbonylContact O-C 3.44Å; R667-E670 WeakPolarHBondContact O-CB 3.44Å; R667-E670 PolarHBondContact O-N 3.29Å; R667-E670 VanDerWaalsContact O-N 3.1Å; E670-D672 VanDerWaalsContact C-N 3.25Å; E670-D672 PolarHBondContact O-N 3.48Å; E670-A673 CarbonylContact O-C 3.54Å; E670-A673 VanDerWaalsContact O-CA 3.3Å; E670-A673 WeakPolarHBondContact O-CA 3.44Å; E670-A673 VanDerWaalsContact O-CB 3.23Å; E670-A673 WeakPolarHBondContact O-CB 3.45Å; E670-A673 PolarHBondContact O-N 3.14Å
671	L	57.5	Low	50.9	Low	56 Å²	56	84 Å²	84	29%	0.293	48%	0.479	S	S	.	.	H	α-helix	trans	-60.7	-33.8	174.7	-77.2	172	0	0	0	112.6	R667 L668 A673 P1339	R667-L671 WeakPolarHBondContact O-CG 3.35Å; R667-L671 PolarHBondContact O-N 3.17Å; L668-L671 HydrophobicContact CD1-CD1 4.48Å; L671-A673 PolarHBondContact O-N 3.47Å; L671-P1339 HydrophobicContact CD2-CG 4.38Å
672	D	55.8	Low	50.7	Low	14 Å²	14	84.7 Å²	84.7	8%	0.075	47%	0.472	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-22.5	172.9	-85.7	-30.7	0	0	0	112.1	E670 I674 R1227 S1317 R1338	E670-D672 VanDerWaalsContact C-N 3.25Å; E670-D672 PolarHBondContact O-N 3.48Å; D672-I674 PolarHBondContact O-N 3.2Å; D672-R1227 IonicContact OD2-CZ 2.79Å; D672-R1227 IonicContact OD2-NE 3.39Å; D672-R1227 PolarHBondContact OD2-NE 3.29Å; D672-R1227 IonicContact OD2-NH2 2.8Å; D672-R1227 PolarHBondContact OD2-NH2 2.94Å; D672-S1317 PolarHBondContact O-OG 2.93Å; D672-S1317 VanDerWaalsContact O-OG 3.09Å; D672-R1338 IonicContact OD1-CZ 2.72Å; D672-R1338 IonicContact OD1-NE 3.23Å; D672-R1338 PolarHBondContact OD1-NE 2.87Å; D672-R1338 IonicContact OD1-NH2 2.77Å; D672-R1338 PolarHBondContact OD1-NH2 3.15Å
673	A	50.3	Low	50.4	Low	23 Å²	23	84.9 Å²	84.9	19%	0.19	48%	0.476	C	S	.	.			trans	-81.7	61	174.1	0	0	0	0	0	110.8	E670 L671 G675 I676	E670-A673 CarbonylContact O-C 3.54Å; E670-A673 VanDerWaalsContact O-CA 3.3Å; E670-A673 WeakPolarHBondContact O-CA 3.44Å; E670-A673 VanDerWaalsContact O-CB 3.23Å; E670-A673 WeakPolarHBondContact O-CB 3.45Å; E670-A673 PolarHBondContact O-N 3.14Å; L671-A673 PolarHBondContact O-N 3.47Å; A673-G675 VanDerWaalsContact C-N 3.28Å; A673-G675 PolarHBondContact O-N 3.31Å; A673-I676 HydrophobicContact CB-CB 4.06Å; A673-I676 WeakPolarHBondContact CB-O 3.44Å; A673-I676 PolarHBondContact O-N 3.14Å
674	I	44.7	Very low	50.4	Low	75 Å²	75	85.6 Å²	85.6	39%	0.385	49%	0.486	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	92.3	172.4	-55.6	175.9	0	0	0	109.1	D672 R1338	D672-I674 PolarHBondContact O-N 3.2Å; I674-R1338 HydrophobicContact CD1-CB 3.95Å; I674-R1338 HydrophobicContact CD1-CG 4.48Å
675	G	46.6	Very low	50.4	Low	59 Å²	59	86 Å²	86	61%	0.608	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.3	24.7	-178.9	0	0	0	0	0	115.7	A673	A673-G675 VanDerWaalsContact C-N 3.28Å; A673-G675 PolarHBondContact O-N 3.31Å
676	I	44.1	Very low	50.6	Low	68 Å²	68	83.3 Å²	83.3	35%	0.349	47%	0.474	S	S	.	.			trans	-107.2	87.8	169.1	-52.5	171.6	0	0	0	107.4	A673	A673-I676 HydrophobicContact CB-CB 4.06Å; A673-I676 WeakPolarHBondContact CB-O 3.44Å; A673-I676 PolarHBondContact O-N 3.14Å
677	T	41.6	Very low	50.9	Low	98 Å²	98	80.5 Å²	80.5	60%	0.601	47%	0.473	S	S	*	.			trans	-78.9	142.6	162.8	44.6	0	0	0	0	108.1	D679	T677-D679 VanDerWaalsContact CB-OD2 3.3Å; T677-D679 WeakPolarHBondContact CB-OD2 3.45Å; T677-D679 PolarHBondContact O-N 3.42Å; T677-D679 VanDerWaalsContact OG1-CG 3.3Å; T677-D679 PolarHBondContact OG1-OD2 3.12Å
678	D	43.5	Very low	51.4	Low	171 Å²	171	79.5 Å²	79.5	91%	0.914	48%	0.475	S	S	*	.			trans	-73.9	39.1	173.4	-141.9	11.3	0	0	0	110.5	G680	D678-G680 PolarHBondContact O-N 3.09Å
679	D	43.3	Very low	51.9	Low	109 Å²	109	78.7 Å²	78.7	58%	0.583	47%	0.469	S	S	*	.			trans	-72.3	66.5	178.4	-73	-32.8	0	0	0	108.9	T677 A681	T677-D679 VanDerWaalsContact CB-OD2 3.3Å; T677-D679 WeakPolarHBondContact CB-OD2 3.45Å; T677-D679 PolarHBondContact O-N 3.42Å; T677-D679 VanDerWaalsContact OG1-CG 3.3Å; T677-D679 PolarHBondContact OG1-OD2 3.12Å; D679-A681 PolarHBondContact O-N 3.3Å
680	G	39.9	Very low	52.3	Low	83 Å²	83	76.6 Å²	76.6	86%	0.856	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	26.7	168.3	0	0	0	0	0	113.6	D678	D678-G680 PolarHBondContact O-N 3.09Å
681	A	42.2	Very low	52.9	Low	89 Å²	89	77.3 Å²	77.3	74%	0.736	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-148.3	9.7	-172.5	0	0	0	0	0	117.1	D679	D679-A681 PolarHBondContact O-N 3.3Å
682	K	45.4	Very low	53.7	Low	133 Å²	133	82 Å²	82	58%	0.578	48%	0.478	S	S	*	.			trans	-137.8	36.2	170.4	-71.6	-172	-178.7	172.6	0	114	T684	K682-T684 PolarHBondContact O-N 3.29Å; K682-T684 PolarHBondContact O-OG1 2.86Å
683	D	46.3	Very low	54.6	Low	94 Å²	94	83.3 Å²	83.3	50%	0.503	49%	0.485	S	S	.	.			trans	-71.9	77.6	153.7	-157	-18.4	0	0	0	107.2	S685 A686 S687	D683-S685 PolarHBondContact O-N 3.22Å; D683-S685 VanDerWaalsContact O-N 3.15Å; D683-S685 WeakPolarHBondContact OD1-CA 3.45Å; D683-S685 WeakPolarHBondContact OD1-CB 3.29Å; D683-S685 PolarHBondContact OD1-N 3.29Å; D683-S685 PolarHBondContact OD1-OG 3.05Å; D683-A686 HydrophobicContact CB-CB 3.79Å; D683-A686 PolarHBondContact O-N 3.44Å; D683-A686 PolarHBondContact OD1-N 3.11Å; D683-A686 VanDerWaalsContact OD1-N 3.15Å; D683-S687 PolarHBondContact O-N 3.1Å; D683-S687 PolarHBondContact O-OG 3.34Å
684	T	53.3	Low	55.8	Low	106 Å²	106	86.9 Å²	86.9	65%	0.65	50%	0.498	S	S	*	.	H	α-helix	trans	-53.4	-29.1	173.3	-9.2	0	0	0	0	109.5	K682 L688	K682-T684 PolarHBondContact O-N 3.29Å; K682-T684 PolarHBondContact O-OG1 2.86Å; T684-L688 WeakPolarHBondContact O-CB 3.26Å; T684-L688 PolarHBondContact O-N 3.35Å; T684-L688 VanDerWaalsContact O-N 3.12Å
685	S	55.9	Low	57.4	Low	58 Å²	58	90.5 Å²	90.5	41%	0.406	51%	0.514	S	S	.	.	H	α-helix	trans	-63	-63.3	170.9	124	0	0	0	0	109.6	D683 S687 L688 Q689	D683-S685 PolarHBondContact O-N 3.22Å; D683-S685 VanDerWaalsContact O-N 3.15Å; D683-S685 WeakPolarHBondContact OD1-CA 3.45Å; D683-S685 WeakPolarHBondContact OD1-CB 3.29Å; D683-S685 PolarHBondContact OD1-N 3.29Å; D683-S685 PolarHBondContact OD1-OG 3.05Å; S685-S687 PolarHBondContact O-N 3.04Å; S685-S687 VanDerWaalsContact O-N 3.14Å; S685-L688 CarbonylContact O-C 3.57Å; S685-L688 WeakPolarHBondContact O-CA 3.43Å; S685-L688 PolarHBondContact O-N 2.97Å; S685-Q689 PolarHBondContact O-N 3.1Å; S685-Q689 PolarHBondContact O-NE2 3.01Å; S685-Q689 PolarHBondContact O-OE1 3.2Å; S685-Q689 PolarHBondContact OG-NE2 3.16Å; S685-Q689 PolarHBondContact OG-OE1 3.36Å
686	A	57.5	Low	58.8	Low	15 Å²	15	89.8 Å²	89.8	12%	0.124	50%	0.497	C	S	.	.	H	α-helix	trans	-54.3	-41.1	-176	0	0	0	0	0	113	D683 Q689 L690 P810	D683-A686 HydrophobicContact CB-CB 3.79Å; D683-A686 PolarHBondContact O-N 3.44Å; D683-A686 PolarHBondContact OD1-N 3.11Å; D683-A686 VanDerWaalsContact OD1-N 3.15Å; A686-Q689 PolarHBondContact O-N 3.05Å; A686-L690 WeakPolarHBondContact O-CB 3.38Å; A686-L690 PolarHBondContact O-N 3.04Å; A686-P810 HydrophobicContact CB-CB 4.24Å
687	S	63.3	Low	60.5	Low	64 Å²	64	91 Å²	91	45%	0.448	50%	0.5	S	S	.	.	H	α-helix	trans	-65.2	-41.2	178.3	-46.7	0	0	0	0	112.1	D683 S685 K691	D683-S687 PolarHBondContact O-N 3.1Å; D683-S687 PolarHBondContact O-OG 3.34Å; S685-S687 PolarHBondContact O-N 3.04Å; S685-S687 VanDerWaalsContact O-N 3.14Å; S687-K691 WeakPolarHBondContact O-CG 3.42Å; S687-K691 PolarHBondContact O-N 3.29Å; S687-K691 VanDerWaalsContact O-N 3.09Å
688	L	69.2	Low	62.4	Low	84 Å²	84	89 Å²	89	44%	0.44	49%	0.49	S	S	.	.	H	α-helix	trans	-75.7	-32.7	179.8	-162	149.5	0	0	0	111	T684 S685 K691 R692	T684-L688 WeakPolarHBondContact O-CB 3.26Å; T684-L688 PolarHBondContact O-N 3.35Å; T684-L688 VanDerWaalsContact O-N 3.12Å; S685-L688 CarbonylContact O-C 3.57Å; S685-L688 WeakPolarHBondContact O-CA 3.43Å; S685-L688 PolarHBondContact O-N 2.97Å; L688-K691 PolarHBondContact O-N 3.3Å; L688-R692 HydrophobicContact CD2-CG 4.37Å; L688-R692 WeakPolarHBondContact O-CG 3.15Å; L688-R692 PolarHBondContact O-N 3.39Å
689	Q	68.1	Low	64.1	Low	57 Å²	57	85 Å²	85	27%	0.266	46%	0.463	S	S	.	.	H	α-helix	trans	-68.5	-38.5	170.5	-68.5	114.8	17.8	0	0	112.4	S685 A686 K691 R692 L693	S685-Q689 PolarHBondContact O-N 3.1Å; S685-Q689 PolarHBondContact O-NE2 3.01Å; S685-Q689 PolarHBondContact O-OE1 3.2Å; S685-Q689 PolarHBondContact OG-NE2 3.16Å; S685-Q689 PolarHBondContact OG-OE1 3.36Å; A686-Q689 PolarHBondContact O-N 3.05Å; Q689-K691 VanDerWaalsContact C-N 3.34Å; Q689-R692 PolarHBondContact O-N 3.32Å; Q689-L693 WeakPolarHBondContact O-CB 3.42Å; Q689-L693 PolarHBondContact O-N 2.9Å
690	L	69.3	Low	65.4	Low	34 Å²	34	81.7 Å²	81.7	18%	0.178	45%	0.445	C	S	.	.	H	α-helix	trans	-62.6	-42.4	173.3	-178.1	64.8	0	0	0	111.4	A686 L693 Q694 P810 L812	A686-L690 WeakPolarHBondContact O-CB 3.38Å; A686-L690 PolarHBondContact O-N 3.04Å; L690-L693 PolarHBondContact O-N 2.81Å; L690-Q694 HydrophobicContact CD1-CG 4.48Å; L690-Q694 HydrophobicContact CG-CG 4.47Å; L690-Q694 WeakPolarHBondContact O-CB 3.39Å; L690-Q694 VanDerWaalsContact O-CG 3.29Å; L690-Q694 WeakPolarHBondContact O-CG 3.2Å; L690-Q694 PolarHBondContact O-N 2.98Å; L690-P810 HydrophobicContact CB-CG 4.24Å; L690-P810 HydrophobicContact CD2-CG 4.06Å; L690-L812 HydrophobicContact CD1-CD1 3.86Å; L690-L812 HydrophobicContact CD2-CD1 3.99Å; L690-L812 HydrophobicContact CD2-CD2 3.75Å; L690-L812 HydrophobicContact CD2-CG 4.42Å
691	K	73.3	Confident	66.9	Low	133 Å²	133	78.2 Å²	78.2	58%	0.578	41%	0.409	S	S	*	.	H	α-helix	trans	-60.3	-47.7	173.8	-76.2	-176.4	178.1	-173.7	0	111.8	S687 L688 Q689 L693 Q694 E695	S687-K691 WeakPolarHBondContact O-CG 3.42Å; S687-K691 PolarHBondContact O-N 3.29Å; S687-K691 VanDerWaalsContact O-N 3.09Å; L688-K691 PolarHBondContact O-N 3.3Å; Q689-K691 VanDerWaalsContact C-N 3.34Å; K691-L693 VanDerWaalsContact C-N 3.27Å; K691-L693 PolarHBondContact O-N 3.45Å; K691-Q694 PolarHBondContact O-N 3.18Å; K691-Q694 VanDerWaalsContact O-N 3.16Å; K691-E695 VanDerWaalsContact O-CG 3.29Å; K691-E695 WeakPolarHBondContact O-CG 3.36Å; K691-E695 PolarHBondContact O-N 2.84Å
692	R	75.1	Confident	68.5	Low	154 Å²	154	76.6 Å²	76.6	58%	0.581	39%	0.388	S	S	*	.	H	α-helix	trans	-57.7	-39.7	174.6	-76.8	178	-179.7	175.6	1.6	112.4	L688 Q689 T696	L688-R692 HydrophobicContact CD2-CG 4.37Å; L688-R692 WeakPolarHBondContact O-CG 3.15Å; L688-R692 PolarHBondContact O-N 3.39Å; Q689-R692 PolarHBondContact O-N 3.32Å; R692-T696 WeakPolarHBondContact O-CG2 3.45Å
693	L	73.3	Confident	70.1	Confident	42 Å²	42	72.7 Å²	72.7	22%	0.22	37%	0.37	C	S	.	.	H	α-helix	trans	-68.4	-43.8	176.7	-177.7	64.5	0	0	0	111	Q689 L690 K691 E695 T696 F697 R707 P709	Q689-L693 WeakPolarHBondContact O-CB 3.42Å; Q689-L693 PolarHBondContact O-N 2.9Å; L690-L693 PolarHBondContact O-N 2.81Å; K691-L693 VanDerWaalsContact C-N 3.27Å; K691-L693 PolarHBondContact O-N 3.45Å; L693-E695 VanDerWaalsContact C-N 3.27Å; L693-E695 PolarHBondContact O-N 3.05Å; L693-T696 WeakPolarHBondContact O-CA 3.49Å; L693-T696 WeakPolarHBondContact O-CB 3.35Å; L693-T696 PolarHBondContact O-N 3.4Å; L693-T696 PolarHBondContact O-OG1 2.88Å; L693-F697 HydrophobicContact CD1-CE1 4.25Å; L693-F697 HydrophobicContact CD2-CE1 4.39Å; L693-F697 HydrophobicContact CD2-CZ 4.45Å; L693-F697 HydrophobicContact CG-CE1 3.73Å; L693-F697 HydrophobicContact CG-CZ 4.13Å; L693-F697 WeakPolarHBondContact O-CD1 3.37Å; L693-F697 VanDerWaalsContact O-CE1 3.27Å; L693-F697 WeakPolarHBondContact O-CE1 3.15Å; L693-R707 WeakPolarHBondContact CD1-O 3.36Å; L693-P709 HydrophobicContact CD1-CB 4.17Å; L693-P709 HydrophobicContact CD2-CB 4.26Å
694	Q	75.2	Confident	71.8	Confident	99 Å²	99	72.8 Å²	72.8	46%	0.463	36%	0.364	S	S	.	.	H	α-helix	trans	-61.4	-34.2	176	-75	173.5	-25.2	0	0	112.6	L690 K691 T696 F697	L690-Q694 HydrophobicContact CD1-CG 4.48Å; L690-Q694 HydrophobicContact CG-CG 4.47Å; L690-Q694 WeakPolarHBondContact O-CB 3.39Å; L690-Q694 VanDerWaalsContact O-CG 3.29Å; L690-Q694 WeakPolarHBondContact O-CG 3.2Å; L690-Q694 PolarHBondContact O-N 2.98Å; K691-Q694 PolarHBondContact O-N 3.18Å; K691-Q694 VanDerWaalsContact O-N 3.16Å; Q694-T696 PolarHBondContact O-N 3.06Å; Q694-F697 HydrophobicContact CB-CD2 4.33Å; Q694-F697 HydrophobicContact CB-CE2 4.28Å; Q694-F697 HydrophobicContact CG-CD2 4.19Å; Q694-F697 HydrophobicContact CG-CE2 3.71Å; Q694-F697 HydrophobicContact CG-CZ 4.17Å; Q694-F697 WeakPolarHBondContact O-CB 3.38Å; Q694-F697 WeakPolarHBondContact O-CG 3.14Å; Q694-F697 PolarHBondContact O-N 3.28Å
695	E	78.5	Confident	73.3	Confident	151 Å²	151	68.6 Å²	68.6	71%	0.706	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-19.3	172.6	-72	161.7	-166.3	0	0	112.7	K691 L693	K691-E695 VanDerWaalsContact O-CG 3.29Å; K691-E695 WeakPolarHBondContact O-CG 3.36Å; K691-E695 PolarHBondContact O-N 2.84Å; L693-E695 VanDerWaalsContact C-N 3.27Å; L693-E695 PolarHBondContact O-N 3.05Å
696	T	75.4	Confident	74.7	Confident	43 Å²	43	67.4 Å²	67.4	26%	0.264	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-4.4	174.9	74.8	0	0	0	0	114	R692 L693 Q694 S698 R707	R692-T696 WeakPolarHBondContact O-CG2 3.45Å; L693-T696 WeakPolarHBondContact O-CA 3.49Å; L693-T696 WeakPolarHBondContact O-CB 3.35Å; L693-T696 PolarHBondContact O-N 3.4Å; L693-T696 PolarHBondContact O-OG1 2.88Å; Q694-T696 PolarHBondContact O-N 3.06Å; T696-S698 PolarHBondContact O-N 3.41Å; T696-R707 HydrophobicContact CG2-CB 4.08Å; T696-R707 HydrophobicContact CG2-CG 4.06Å
697	F	80.6	Confident	76.1	Confident	93 Å²	93	69.2 Å²	69.2	41%	0.408	33%	0.332	S	S	.	.			trans	-75	126.8	-178	-64.4	-5.8	0	0	0	109.8	L693 Q694 T705 V706	L693-F697 HydrophobicContact CD1-CE1 4.25Å; L693-F697 HydrophobicContact CD2-CE1 4.39Å; L693-F697 HydrophobicContact CD2-CZ 4.45Å; L693-F697 HydrophobicContact CG-CE1 3.73Å; L693-F697 HydrophobicContact CG-CZ 4.13Å; L693-F697 WeakPolarHBondContact O-CD1 3.37Å; L693-F697 VanDerWaalsContact O-CE1 3.27Å; L693-F697 WeakPolarHBondContact O-CE1 3.15Å; Q694-F697 HydrophobicContact CB-CD2 4.33Å; Q694-F697 HydrophobicContact CB-CE2 4.28Å; Q694-F697 HydrophobicContact CG-CD2 4.19Å; Q694-F697 HydrophobicContact CG-CE2 3.71Å; Q694-F697 HydrophobicContact CG-CZ 4.17Å; Q694-F697 WeakPolarHBondContact O-CB 3.38Å; Q694-F697 WeakPolarHBondContact O-CG 3.14Å; Q694-F697 PolarHBondContact O-N 3.28Å; F697-T705 WeakPolarHBondContact CA-O 3.4Å; F697-V706 HydrophobicContact CD1-CB 3.98Å; F697-V706 HydrophobicContact CD1-CG1 3.5Å; F697-V706 VanDerWaalsContact CD1-CG1 3.5Å; F697-V706 HydrophobicContact CE1-CB 3.94Å; F697-V706 HydrophobicContact CE1-CG1 3.53Å; F697-V706 HydrophobicContact CG-CG1 4.25Å; F697-V706 HydrophobicContact CZ-CG1 4.33Å
698	S	81.1	Confident	77.3	Confident	57 Å²	57	67.5 Å²	67.5	40%	0.399	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	135.5	167.8	59.6	0	0	0	0	109.5	T696 T705	T696-S698 PolarHBondContact O-N 3.41Å; S698-T705 PolarHBondContact N-O 2.86Å; S698-T705 PolarHBondContact O-N 3.31Å; S698-T705 WeakPolarHBondContact OG-CB 3.5Å
699	Y	80.7	Confident	78	Confident	88 Å²	88	65.4 Å²	65.4	35%	0.345	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	130	173.8	176.8	-116.9	0	0	0	107.8	G701 Y704 S919	Y699-G701 PolarHBondContact OH-O 2.79Å; Y699-Y704 AromaticContact CD2-CD1 3.95Å; Y699-Y704 HydrophobicContact CD2-CD1 3.95Å; Y699-Y704 HydrophobicContact CD2-CD2 4.2Å; Y699-Y704 AromaticContact CD2-CE1 3.73Å; Y699-Y704 HydrophobicContact CD2-CE1 3.73Å; Y699-Y704 HydrophobicContact CD2-CE2 4.01Å; Y699-Y704 HydrophobicContact CD2-CG 4.19Å; Y699-Y704 AromaticContact CD2-CZ 3.76Å; Y699-Y704 HydrophobicContact CE2-CE2 4.21Å; Y699-Y704 HydrophobicContact CG-CD1 4.32Å; Y699-Y704 AromaticContact CG-CE1 3.93Å; Y699-Y704 HydrophobicContact CG-CE1 3.93Å; Y699-S919 PolarHBondContact OH-O 3.16Å
700	N	69.7	Low	78.9	Confident	39 Å²	39	65 Å²	65	21%	0.209	31%	0.305	C	S	.	.			trans	-104.4	12	-177.6	74.4	-11.6	0	0	0	112.9	N702 R703 A873 E874 D875	N700-N702 PolarHBondContact OD1-N 2.97Å; N700-R703 PolarHBondContact N-O 3.19Å; N700-R703 PolarHBondContact OD1-N 3.41Å; N700-R703 PolarHBondContact OD1-O 2.94Å; N700-A873 VanDerWaalsContact CG-O 3.29Å; N700-A873 PolarHBondContact ND2-O 3.45Å; N700-A873 PolarHBondContact OD1-O 2.81Å; N700-E874 CarbonylContact O-C 3.44Å; N700-D875 PolarHBondContact O-N 3.36Å
701	G	71	Confident	79.5	Confident	9 Å²	9	68.2 Å²	68.2	9%	0.093	32%	0.318	C	S	.	.	S	Bend	trans	94.3	-12.7	-175.6	0	0	0	0	0	116.6	Y699 N876	Y699-G701 PolarHBondContact OH-O 2.79Å; G701-N876 PolarHBondContact O-N 2.74Å
702	N	76.4	Confident	79.2	Confident	56 Å²	56	65.2 Å²	65.2	30%	0.299	32%	0.318	S	S	.	.	S	Bend	trans	-134.7	-41	178.2	-178.3	29.2	0	0	0	112.4	N700 G920 G921	N700-N702 PolarHBondContact OD1-N 2.97Å; N702-G920 CarbonylContact O-C 3.36Å; N702-G920 WeakPolarHBondContact O-CA 3.49Å; N702-G921 WeakPolarHBondContact O-CA 3.5Å; N702-G921 PolarHBondContact O-N 3.01Å
703	R	79	Confident	79.1	Confident	50 Å²	50	66.2 Å²	66.2	19%	0.189	33%	0.329	C	S	.	.			trans	-135.5	154.8	179.5	-60.3	-165.6	-154.2	-177.2	6.1	111.6	N700 Q840 L842	N700-R703 PolarHBondContact N-O 3.19Å; N700-R703 PolarHBondContact OD1-N 3.41Å; N700-R703 PolarHBondContact OD1-O 2.94Å; R703-Q840 WeakPolarHBondContact CD-O 3.28Å; R703-L842 HydrophobicContact CB-CD1 3.99Å; R703-L842 HydrophobicContact CB-CG 4.12Å
704	Y	82.2	Confident	79.3	Confident	96 Å²	96	67.7 Å²	67.7	38%	0.376	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	133.3	172.3	-68	-85.5	0	0	0	110.5	Y699 L842 F922	Y699-Y704 AromaticContact CD2-CD1 3.95Å; Y699-Y704 HydrophobicContact CD2-CD1 3.95Å; Y699-Y704 HydrophobicContact CD2-CD2 4.2Å; Y699-Y704 AromaticContact CD2-CE1 3.73Å; Y699-Y704 HydrophobicContact CD2-CE1 3.73Å; Y699-Y704 HydrophobicContact CD2-CE2 4.01Å; Y699-Y704 HydrophobicContact CD2-CG 4.19Å; Y699-Y704 AromaticContact CD2-CZ 3.76Å; Y699-Y704 HydrophobicContact CE2-CE2 4.21Å; Y699-Y704 HydrophobicContact CG-CD1 4.32Å; Y699-Y704 AromaticContact CG-CE1 3.93Å; Y699-Y704 HydrophobicContact CG-CE1 3.93Å; Y704-L842 PolarHBondContact O-N 3.37Å; Y704-F922 AromaticContact CD2-CE2 3.98Å; Y704-F922 HydrophobicContact CD2-CE2 3.98Å; Y704-F922 HydrophobicContact CE2-CE2 4.27Å
705	T	84.2	Confident	79.6	Confident	19 Å²	19	67 Å²	67	12%	0.117	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	133.5	169.5	-55.6	0	0	0	0	109.2	F697 S698 L842 H844	F697-T705 WeakPolarHBondContact CA-O 3.4Å; S698-T705 PolarHBondContact N-O 2.86Å; S698-T705 PolarHBondContact O-N 3.31Å; S698-T705 WeakPolarHBondContact OG-CB 3.5Å; T705-L842 WeakPolarHBondContact CA-O 3.31Å; T705-L842 HydrophobicContact CG2-CB 4.34Å; T705-H844 HydrophobicContact CG2-CB 4.29Å
706	V	85.3	Confident	80	Confident	32 Å²	32	60.1 Å²	60.1	19%	0.194	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	160.8	-179.3	-53.5	0	0	0	0	111	F697 I841 L842 H844	F697-V706 HydrophobicContact CD1-CB 3.98Å; F697-V706 HydrophobicContact CD1-CG1 3.5Å; F697-V706 VanDerWaalsContact CD1-CG1 3.5Å; F697-V706 HydrophobicContact CE1-CB 3.94Å; F697-V706 HydrophobicContact CE1-CG1 3.53Å; F697-V706 HydrophobicContact CG-CG1 4.25Å; F697-V706 HydrophobicContact CZ-CG1 4.33Å; V706-I841 HydrophobicContact CB-CG2 4.39Å; V706-I841 HydrophobicContact CG1-CG2 3.9Å; V706-I841 HydrophobicContact CG2-CG2 3.6Å; V706-L842 PolarHBondContact N-O 3.36Å; V706-H844 PolarHBondContact O-N 2.93Å
707	R	86.8	Confident	80.6	Confident	53 Å²	53	59.8 Å²	59.8	20%	0.2	31%	0.307	C	S	.	.			trans	-96.5	159.5	170.1	-66.4	-161.9	74	150.3	17.8	111.6	L693 T696 H844 E846 D847	L693-R707 WeakPolarHBondContact CD1-O 3.36Å; T696-R707 HydrophobicContact CG2-CB 4.08Å; T696-R707 HydrophobicContact CG2-CG 4.06Å; R707-H844 HydrophobicContact CG-CB 3.67Å; R707-E846 IonicContact CZ-OE2 2.81Å; R707-E846 IonicContact NH1-OE2 3.2Å; R707-E846 PolarHBondContact NH1-OE2 2.85Å; R707-E846 VanDerWaalsContact NH2-CB 3.3Å; R707-E846 IonicContact NH2-OE2 2.8Å; R707-E846 PolarHBondContact NH2-OE2 2.96Å; R707-D847 WeakPolarHBondContact CA-OD2 3.14Å; R707-D847 VanDerWaalsContact CB-OD2 3.3Å; R707-D847 WeakPolarHBondContact CB-OD2 3.41Å; R707-D847 IonicContact CZ-OD1 2.75Å; R707-D847 IonicContact CZ-OD2 3.79Å; R707-D847 IonicContact NE-OD1 3.82Å; R707-D847 IonicContact NE-OD2 3.55Å; R707-D847 PolarHBondContact NE-OD2 3.44Å; R707-D847 IonicContact NH2-OD1 3.24Å; R707-D847 PolarHBondContact NH2-OD1 2.99Å; R707-D847 IonicContact NH2-OD2 4Å
708	L	87.9	Confident	81.1	Confident	28 Å²	28	58.6 Å²	58.6	15%	0.147	30%	0.304	C	S	.	.			trans	-68.3	138.4	169.6	-71.5	177.6	0	0	0	109.7	W710 L806 L843 D847 F850 V851	L708-W710 VanDerWaalsContact C-N 3.32Å; L708-W710 HydrophobicContact CB-CD2 4.47Å; L708-W710 HydrophobicContact CB-CZ2 4.01Å; L708-W710 HydrophobicContact CD1-CH2 4.15Å; L708-W710 HydrophobicContact CD1-CZ2 3.69Å; L708-W710 HydrophobicContact CG-CZ2 4.47Å; L708-W710 PolarHBondContact O-N 3.48Å; L708-L806 HydrophobicContact CB-CD2 3.81Å; L708-L806 HydrophobicContact CD1-CD2 4.5Å; L708-L806 HydrophobicContact CD2-CD1 4.23Å; L708-L843 HydrophobicContact CD2-CD1 4.12Å; L708-L843 HydrophobicContact CG-CD1 3.99Å; L708-D847 HydrophobicContact CB-CB 4.45Å; L708-D847 HydrophobicContact CD1-CB 4.19Å; L708-D847 HydrophobicContact CG-CB 4.12Å; L708-D847 PolarHBondContact N-OD2 2.9Å; L708-F850 HydrophobicContact CD1-CB 4.16Å; L708-V851 HydrophobicContact CD1-CG1 4.36Å
709	P	85.4	Confident	81.7	Confident	41 Å²	41	55.9 Å²	55.9	27%	0.266	29%	0.285	S	S	.	.			trans	-79.3	76.6	-175.4	33	-36.8	0	0	0	111.3	L693 L806 E807	L693-P709 HydrophobicContact CD1-CB 4.17Å; L693-P709 HydrophobicContact CD2-CB 4.26Å; P709-L806 HydrophobicContact CG-CB 4.42Å; P709-L806 CarbonylContact O-C 3.44Å; P709-L806 WeakPolarHBondContact O-CA 3.42Å; P709-E807 HydrophobicContact CB-CB 4.26Å; P709-E807 PolarHBondContact O-N 2.97Å
710	W	87.1	Confident	82.4	Confident	47 Å²	47	54.7 Å²	54.7	18%	0.178	28%	0.283	C	S	.	.	B	Isolated β-bridge	trans	-66.8	134.4	-175.6	-62.3	104.4	0	0	0	113.6	L708 K714 L802 L805 L806 D847 F850	L708-W710 VanDerWaalsContact C-N 3.32Å; L708-W710 HydrophobicContact CB-CD2 4.47Å; L708-W710 HydrophobicContact CB-CZ2 4.01Å; L708-W710 HydrophobicContact CD1-CH2 4.15Å; L708-W710 HydrophobicContact CD1-CZ2 3.69Å; L708-W710 HydrophobicContact CG-CZ2 4.47Å; L708-W710 PolarHBondContact O-N 3.48Å; W710-K714 HydrophobicContact CD2-CD 4.32Å; W710-K714 HydrophobicContact CD2-CG 3.93Å; W710-K714 HydrophobicContact CE3-CG 4.3Å; W710-K714 HydrophobicContact CG-CD 4.5Å; W710-K714 HydrophobicContact CG-CG 4.2Å; W710-K714 HydrophobicContact CZ2-CD 4.37Å; W710-K714 HydrophobicContact CZ2-CG 4.49Å; W710-L802 HydrophobicContact CH2-CD1 3.84Å; W710-L802 HydrophobicContact CZ3-CD1 4.11Å; W710-L805 HydrophobicContact CE3-CB 4.06Å; W710-L805 HydrophobicContact CZ3-CB 3.9Å; W710-L805 HydrophobicContact CZ3-CD1 4.23Å; W710-L806 HydrophobicContact CD2-CD2 3.98Å; W710-L806 HydrophobicContact CE3-CD2 3.69Å; W710-L806 HydrophobicContact CH2-CD2 4.29Å; W710-L806 HydrophobicContact CZ3-CD2 3.86Å; W710-D847 PolarHBondContact NE1-OD1 3.47Å; W710-F850 HydrophobicContact CH2-CB 4.1Å; W710-F850 AromaticContact CH2-CD1 3.5Å; W710-F850 HydrophobicContact CH2-CD1 3.5Å; W710-F850 VanDerWaalsContact CH2-CD1 3.5Å; W710-F850 AromaticContact CH2-CD2 3.94Å; W710-F850 HydrophobicContact CH2-CD2 3.94Å; W710-F850 AromaticContact CH2-CE1 3.73Å; W710-F850 HydrophobicContact CH2-CE1 3.73Å; W710-F850 HydrophobicContact CH2-CE2 4.2Å; W710-F850 AromaticContact CH2-CG 3.56Å; W710-F850 HydrophobicContact CH2-CG 3.56Å; W710-F850 HydrophobicContact CH2-CZ 4.09Å; W710-F850 HydrophobicContact CZ2-CB 4.3Å; W710-F850 HydrophobicContact CZ2-CD1 4.03Å; W710-F850 AromaticContact CZ2-CD2 3.58Å; W710-F850 HydrophobicContact CZ2-CD2 3.58Å; W710-F850 HydrophobicContact CZ2-CE1 4.15Å; W710-F850 AromaticContact CZ2-CE2 3.77Å; W710-F850 HydrophobicContact CZ2-CE2 3.77Å; W710-F850 AromaticContact CZ2-CG 3.7Å; W710-F850 HydrophobicContact CZ2-CG 3.7Å; W710-F850 HydrophobicContact CZ2-CZ 4.04Å
711	K	80.8	Confident	83.5	Confident	102 Å²	102	54.5 Å²	54.5	44%	0.443	29%	0.29	S	S	.	.	S	Bend	trans	-74.7	-38.5	170.9	-77.5	172.9	170.8	145.8	0	113.3	D804 L805 L806 E807	K711-D804 WeakPolarHBondContact CD-O 3.37Å; K711-D804 PolarHBondContact NZ-O 3.29Å; K711-L805 WeakPolarHBondContact CB-O 3.28Å; K711-L805 PolarHBondContact N-O 3.06Å; K711-L806 WeakPolarHBondContact CE-O 3.28Å; K711-L806 PolarHBondContact NZ-O 3.07Å; K711-E807 WeakPolarHBondContact CE-OE2 2.87Å; K711-E807 HydrophobicContact CG-CG 3.66Å; K711-E807 WeakPolarHBondContact CG-OE1 3.31Å
712	A	67.7	Low	84.7	Confident	71 Å²	71	55.6 Å²	55.6	59%	0.587	29%	0.293	S	S	*	.	S	Bend	trans	-162.3	-161	-171	0	0	0	0	0	110.9
713	E	73.4	Confident	85.6	Confident	174 Å²	174	53.1 Å²	53.1	81%	0.813	28%	0.28	S	S	*	.			trans	-52.2	137.2	-179.1	-75	-176.6	173.2	0	0	113.9	S715	E713-S715 VanDerWaalsContact C-N 3.33Å; E713-S715 PolarHBondContact O-N 2.7Å
714	K	76.5	Confident	86.4	Confident	74 Å²	74	53.6 Å²	53.6	32%	0.322	28%	0.284	S	S	.	.			trans	-86.4	63.8	-172.8	-48.3	-178.6	-174.6	-175.5	0	111.8	W710 D847 F850	W710-K714 HydrophobicContact CD2-CD 4.32Å; W710-K714 HydrophobicContact CD2-CG 3.93Å; W710-K714 HydrophobicContact CE3-CG 4.3Å; W710-K714 HydrophobicContact CG-CD 4.5Å; W710-K714 HydrophobicContact CG-CG 4.2Å; W710-K714 HydrophobicContact CZ2-CD 4.37Å; W710-K714 HydrophobicContact CZ2-CG 4.49Å; K714-D847 IonicContact NZ-OD1 2.9Å; K714-D847 PolarHBondContact NZ-OD1 3.23Å; K714-F850 HydrophobicContact CB-CE1 4.1Å; K714-F850 HydrophobicContact CB-CZ 3.61Å; K714-F850 HydrophobicContact CD-CE2 4.28Å; K714-F850 HydrophobicContact CD-CZ 4.13Å; K714-F850 HydrophobicContact CG-CZ 4.44Å
715	S	81.1	Confident	87	Confident	85 Å²	85	57 Å²	57	59%	0.594	30%	0.296	S	S	*	.			trans	-116.5	103.5	179.3	-165.3	0	0	0	0	111.2	E713	E713-S715 VanDerWaalsContact C-N 3.33Å; E713-S715 PolarHBondContact O-N 2.7Å
716	L	87.5	Confident	87.5	Confident	5 Å²	5	61 Å²	61	3%	0.026	31%	0.309	C	S	.	.			trans	-113.6	139.7	172.1	-79.5	168.1	0	0	0	110.8	G767 W770 V800 L802 L805 F850	L716-G767 PolarHBondContact N-O 3.02Å; L716-W770 HydrophobicContact CB-CB 4.5Å; L716-W770 HydrophobicContact CB-CD2 4.39Å; L716-W770 HydrophobicContact CB-CE3 3.75Å; L716-W770 HydrophobicContact CB-CZ3 4.3Å; L716-W770 HydrophobicContact CD1-CB 4.06Å; L716-W770 HydrophobicContact CD1-CD2 4Å; L716-W770 HydrophobicContact CD1-CE3 4.17Å; L716-W770 HydrophobicContact CD1-CG 3.99Å; L716-W770 HydrophobicContact CD2-CD2 4.39Å; L716-W770 HydrophobicContact CD2-CE3 3.95Å; L716-W770 HydrophobicContact CD2-CH2 4.27Å; L716-W770 HydrophobicContact CD2-CZ3 3.87Å; L716-W770 HydrophobicContact CG-CD2 4.49Å; L716-W770 HydrophobicContact CG-CE3 4.16Å; L716-V800 HydrophobicContact CD2-CB 4.33Å; L716-V800 HydrophobicContact CD2-CG2 3.79Å; L716-L802 HydrophobicContact CD1-CB 4.43Å; L716-L802 HydrophobicContact CD1-CD1 3.7Å; L716-L805 HydrophobicContact CD1-CD1 3.9Å; L716-L805 HydrophobicContact CD2-CD1 3.52Å; L716-L805 HydrophobicContact CD2-CG 4.4Å; L716-L805 HydrophobicContact CG-CD1 3.45Å; L716-L805 VanDerWaalsContact CG-CD1 3.45Å; L716-F850 HydrophobicContact CD1-CD1 3.91Å; L716-F850 HydrophobicContact CD1-CE1 4.46Å
717	P	88.4	Confident	88	Confident	36 Å²	36	59.7 Å²	59.7	23%	0.234	30%	0.301	C	S	.	.			trans	-74.7	141.9	173.6	28.2	-30.1	0	0	0	111	N719 W770 Y797 K798 V800	P717-N719 PolarHBondContact O-N 2.92Å; P717-W770 HydrophobicContact CG-CZ3 4.16Å; P717-W770 VanDerWaalsContact O-CE3 3.23Å; P717-W770 VanDerWaalsContact O-CZ3 3.28Å; P717-W770 WeakPolarHBondContact O-CZ3 3.41Å; P717-Y797 HydrophobicContact CB-CD1 4.22Å; P717-Y797 HydrophobicContact CB-CE1 4.16Å; P717-Y797 HydrophobicContact CG-CD1 3.98Å; P717-Y797 HydrophobicContact CG-CE1 4.4Å; P717-K798 HydrophobicContact CB-CD 4.07Å; P717-K798 HydrophobicContact CG-CB 4.11Å; P717-K798 HydrophobicContact CG-CD 4.48Å; P717-V800 VanDerWaalsContact CD-CG2 3.46Å; P717-V800 HydrophobicContact CG-CG2 3.77Å
718	N	90.3	Very high	88.3	Confident	68 Å²	68	59.8 Å²	59.8	36%	0.364	31%	0.305	S	S	.	.			trans	-60.5	113.9	175	177.9	-44	0	0	0	110.8	H720 E769 Y797	N718-H720 WeakPolarHBondContact OD1-CB 3.45Å; N718-H720 PolarHBondContact OD1-N 3.3Å; N718-E769 PolarHBondContact ND2-OE2 2.81Å; N718-Y797 WeakPolarHBondContact O-CE1 3.16Å; N718-Y797 PolarHBondContact O-OH 3.03Å
719	N	94.9	Very high	88.6	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	33%	0.328	C	S	.	.			trans	-104.2	17.6	-179.2	75	-31.5	0	0	0	113.6	P717 G721 Q722 A723 W770 Y771 Y797	P717-N719 PolarHBondContact O-N 2.92Å; N719-G721 VanDerWaalsContact C-N 3.31Å; N719-G721 PolarHBondContact O-N 3.1Å; N719-Q722 HydrophobicContact CB-CB 4.48Å; N719-Q722 WeakPolarHBondContact O-CA 3.39Å; N719-Q722 WeakPolarHBondContact O-CB 3.35Å; N719-Q722 PolarHBondContact O-N 3.26Å; N719-A723 PolarHBondContact O-N 3.41Å; N719-A723 VanDerWaalsContact O-N 3.11Å; N719-W770 HydrophobicContact CB-CE3 4.11Å; N719-W770 HydrophobicContact CB-CH2 4.29Å; N719-W770 HydrophobicContact CB-CZ3 3.93Å; N719-Y771 PolarHBondContact ND2-O 3.46Å; N719-Y771 WeakPolarHBondContact OD1-CA 3.48Å; N719-Y771 WeakPolarHBondContact OD1-CB 3.45Å; N719-Y771 PolarHBondContact OD1-N 2.65Å; N719-Y771 PolarHBondContact OD1-O 3.39Å; N719-Y797 HydrophobicContact CB-CD1 3.34Å; N719-Y797 HydrophobicContact CB-CD2 4.17Å; N719-Y797 HydrophobicContact CB-CE1 3.95Å; N719-Y797 HydrophobicContact CB-CG 3.44Å; N719-Y797 VanDerWaalsContact CB-CG 3.44Å
720	H	94.3	Very high	88.9	Confident	63 Å²	63	65 Å²	65	29%	0.292	32%	0.318	S	S	.	.	H	α-helix	trans	-47.6	-50.8	-177.5	177.8	-88.8	0	0	0	112.5	N718 Q722 A723 F724 Y771	N718-H720 WeakPolarHBondContact OD1-CB 3.45Å; N718-H720 PolarHBondContact OD1-N 3.3Å; H720-Q722 PolarHBondContact O-N 3.06Å; H720-A723 PolarHBondContact O-N 3.16Å; H720-A723 VanDerWaalsContact O-N 3.11Å; H720-F724 WeakPolarHBondContact O-CB 3.44Å; H720-F724 PolarHBondContact O-N 3.04Å; H720-Y771 HydrophobicContact CB-CD2 3.89Å; H720-Y771 HydrophobicContact CB-CE2 3.72Å; H720-Y771 AromaticContact CD2-CE1 3.71Å; H720-Y771 AromaticContact CD2-CE2 3.97Å; H720-Y771 AromaticContact CD2-CZ 3.59Å
721	G	92.5	Very high	89.1	Confident	35 Å²	35	62.8 Å²	62.8	36%	0.361	31%	0.31	S	S	.	.	H	α-helix	trans	-65	-20.8	-179.7	0	0	0	0	0	114.5	N719 R725	N719-G721 VanDerWaalsContact C-N 3.31Å; N719-G721 PolarHBondContact O-N 3.1Å; G721-R725 WeakPolarHBondContact O-CG 3.32Å; G721-R725 PolarHBondContact O-N 3.3Å; G721-R725 PolarHBondContact O-NE 3.42Å
722	Q	95.9	Very high	89.5	Confident	33 Å²	33	61.7 Å²	61.7	15%	0.154	31%	0.309	C	S	.	.	H	α-helix	trans	-76.5	-49.8	169.6	-179.9	-163.6	51.8	0	0	110.5	N719 H720 F724 R725 R726 S795 R796 Y797	N719-Q722 HydrophobicContact CB-CB 4.48Å; N719-Q722 WeakPolarHBondContact O-CA 3.39Å; N719-Q722 WeakPolarHBondContact O-CB 3.35Å; N719-Q722 PolarHBondContact O-N 3.26Å; H720-Q722 PolarHBondContact O-N 3.06Å; Q722-F724 VanDerWaalsContact C-N 3.25Å; Q722-F724 PolarHBondContact O-N 2.95Å; Q722-R725 PolarHBondContact O-N 2.97Å; Q722-R726 WeakPolarHBondContact O-CG 3.39Å; Q722-R726 PolarHBondContact O-N 3.49Å; Q722-S795 PolarHBondContact OE1-OG 3.03Å; Q722-R796 PolarHBondContact NE2-O 3.41Å; Q722-Y797 HydrophobicContact CB-CD2 4.02Å; Q722-Y797 HydrophobicContact CB-CE2 4.47Å
723	A	95.2	Very high	90.4	Very high	4 Å²	4	63.9 Å²	63.9	3%	0.033	31%	0.307	C	S	.	.	H	α-helix	trans	-59	-40.2	179.9	0	0	0	0	0	111.1	N719 H720 R726 L727 Y771 L854	N719-A723 PolarHBondContact O-N 3.41Å; N719-A723 VanDerWaalsContact O-N 3.11Å; H720-A723 PolarHBondContact O-N 3.16Å; H720-A723 VanDerWaalsContact O-N 3.11Å; A723-R726 WeakPolarHBondContact O-CB 3.43Å; A723-R726 PolarHBondContact O-N 3.23Å; A723-L727 PolarHBondContact O-N 2.77Å; A723-Y771 HydrophobicContact CB-CG 4.48Å; A723-L854 HydrophobicContact CB-CD1 4.1Å
724	F	96.8	Very high	91	Very high	60 Å²	60	56.4 Å²	56.4	26%	0.263	27%	0.272	S	S	.	.	H	α-helix	trans	-65.7	-43.2	177.8	-173.3	-133.9	0	0	0	112.8	H720 Q722 R726 L727 I728 L854 P864	H720-F724 WeakPolarHBondContact O-CB 3.44Å; H720-F724 PolarHBondContact O-N 3.04Å; Q722-F724 VanDerWaalsContact C-N 3.25Å; Q722-F724 PolarHBondContact O-N 2.95Å; F724-R726 VanDerWaalsContact C-N 3.29Å; F724-R726 PolarHBondContact O-N 3.43Å; F724-L727 HydrophobicContact CD2-CD2 4.37Å; F724-L727 WeakPolarHBondContact O-CB 3.48Å; F724-L727 PolarHBondContact O-N 2.71Å; F724-L727 VanDerWaalsContact O-N 3.16Å; F724-I728 HydrophobicContact CD1-CD1 4.11Å; F724-I728 HydrophobicContact CD2-CD1 4.45Å; F724-I728 HydrophobicContact CD2-CG1 4.43Å; F724-I728 HydrophobicContact CE1-CD1 3.78Å; F724-I728 HydrophobicContact CE2-CD1 4.11Å; F724-I728 HydrophobicContact CE2-CG1 4.1Å; F724-I728 HydrophobicContact CG-CD1 4.44Å; F724-I728 HydrophobicContact CZ-CD1 3.79Å; F724-I728 HydrophobicContact CZ-CG1 4.24Å; F724-I728 WeakPolarHBondContact O-CG1 3.24Å; F724-I728 PolarHBondContact O-N 3.29Å; F724-L854 HydrophobicContact CB-CD1 3.68Å; F724-L854 HydrophobicContact CD2-CD1 4.31Å; F724-L854 HydrophobicContact CG-CD1 4.41Å; F724-P864 HydrophobicContact CD2-CG 3.49Å; F724-P864 VanDerWaalsContact CD2-CG 3.49Å; F724-P864 HydrophobicContact CE2-CG 3.24Å; F724-P864 HydrophobicContact CZ-CG 4.23Å
725	R	95.2	Very high	91.3	Very high	167 Å²	167	57 Å²	57	63%	0.63	29%	0.286	S	S	*	.	H	α-helix	trans	-62.7	-35.2	173.4	-77.4	-178.9	-72.6	160.8	-6.9	112.8	G721 Q722 R729	G721-R725 WeakPolarHBondContact O-CG 3.32Å; G721-R725 PolarHBondContact O-N 3.3Å; G721-R725 PolarHBondContact O-NE 3.42Å; Q722-R725 PolarHBondContact O-N 2.97Å; R725-R729 WeakPolarHBondContact O-CB 3.36Å; R725-R729 PolarHBondContact O-N 3Å; R725-R729 VanDerWaalsContact O-N 3.09Å
726	R	95.3	Very high	91.4	Very high	102 Å²	102	57.2 Å²	57.2	39%	0.385	29%	0.292	S	S	.	.	H	α-helix	trans	-66.3	-40.9	173.8	-72.4	-93.2	-135.2	146.4	11.2	111.1	Q722 A723 F724 R729 L730 P773 D792 S795	Q722-R726 WeakPolarHBondContact O-CG 3.39Å; Q722-R726 PolarHBondContact O-N 3.49Å; A723-R726 WeakPolarHBondContact O-CB 3.43Å; A723-R726 PolarHBondContact O-N 3.23Å; F724-R726 VanDerWaalsContact C-N 3.29Å; F724-R726 PolarHBondContact O-N 3.43Å; R726-R729 PolarHBondContact O-N 3.02Å; R726-L730 WeakPolarHBondContact O-CB 3.26Å; R726-L730 PolarHBondContact O-N 3.44Å; R726-P773 HydrophobicContact CB-CB 4.07Å; R726-P773 HydrophobicContact CG-CB 4.06Å; R726-P773 HydrophobicContact CG-CG 4.31Å; R726-D792 IonicContact CZ-OD2 3.96Å; R726-D792 IonicContact NH1-OD2 2.7Å; R726-D792 IonicContact NH2-OD2 3.75Å; R726-D792 PolarHBondContact NH2-OD2 3.5Å; R726-S795 PolarHBondContact NH2-OG 3.26Å; R726-S795 VanDerWaalsContact NH2-OG 3.07Å
727	L	95.6	Very high	91.3	Very high	5 Å²	5	61.4 Å²	61.4	3%	0.026	31%	0.31	C	S	.	.	H	α-helix	trans	-61.4	-52.7	175.2	178.5	64.9	0	0	0	111.1	A723 F724 R729 L730 E731 L854 R856 P864	A723-L727 PolarHBondContact O-N 2.77Å; F724-L727 HydrophobicContact CD2-CD2 4.37Å; F724-L727 WeakPolarHBondContact O-CB 3.48Å; F724-L727 PolarHBondContact O-N 2.71Å; F724-L727 VanDerWaalsContact O-N 3.16Å; L727-R729 VanDerWaalsContact C-N 3.29Å; L727-R729 PolarHBondContact O-N 3.1Å; L727-L730 CarbonylContact O-C 3.01Å; L727-L730 WeakPolarHBondContact O-CA 3.3Å; L727-L730 WeakPolarHBondContact O-CB 3.14Å; L727-L730 PolarHBondContact O-N 2.83Å; L727-E731 HydrophobicContact CD1-CG 4.37Å; L727-E731 HydrophobicContact CG-CG 4.45Å; L727-E731 WeakPolarHBondContact O-CG 3.39Å; L727-E731 PolarHBondContact O-N 3Å; L727-L854 HydrophobicContact CD2-CB 4.02Å; L727-R856 HydrophobicContact CD2-CG 4.46Å; L727-P864 HydrophobicContact CD2-CB 4.17Å; L727-P864 HydrophobicContact CD2-CG 4.05Å
728	I	93.1	Very high	91.1	Very high	55 Å²	55	65.2 Å²	65.2	28%	0.282	33%	0.333	S	S	.	.	H	α-helix	trans	-55.3	-46.4	177.6	-66.2	168	0	0	0	110.9	F724 L730 E731 D732	F724-I728 HydrophobicContact CD1-CD1 4.11Å; F724-I728 HydrophobicContact CD2-CD1 4.45Å; F724-I728 HydrophobicContact CD2-CG1 4.43Å; F724-I728 HydrophobicContact CE1-CD1 3.78Å; F724-I728 HydrophobicContact CE2-CD1 4.11Å; F724-I728 HydrophobicContact CE2-CG1 4.1Å; F724-I728 HydrophobicContact CG-CD1 4.44Å; F724-I728 HydrophobicContact CZ-CD1 3.79Å; F724-I728 HydrophobicContact CZ-CG1 4.24Å; F724-I728 WeakPolarHBondContact O-CG1 3.24Å; F724-I728 PolarHBondContact O-N 3.29Å; I728-L730 VanDerWaalsContact C-N 3.29Å; I728-L730 PolarHBondContact O-N 3.31Å; I728-E731 WeakPolarHBondContact O-CB 3.32Å; I728-E731 PolarHBondContact O-N 2.86Å; I728-E731 VanDerWaalsContact O-N 3.15Å; I728-D732 PolarHBondContact O-N 3.04Å
729	R	92.7	Very high	90.7	Very high	167 Å²	167	69.9 Å²	69.9	63%	0.63	35%	0.353	S	S	*	.	H	α-helix	trans	-62.3	-37.7	177.9	-179.1	175.1	179.2	150.2	3.5	112.4	R725 R726 L727 D732 Q733	R725-R729 WeakPolarHBondContact O-CB 3.36Å; R725-R729 PolarHBondContact O-N 3Å; R725-R729 VanDerWaalsContact O-N 3.09Å; R726-R729 PolarHBondContact O-N 3.02Å; L727-R729 VanDerWaalsContact C-N 3.29Å; L727-R729 PolarHBondContact O-N 3.1Å; R729-D732 PolarHBondContact O-N 3.2Å; R729-Q733 VanDerWaalsContact O-CG 3.28Å; R729-Q733 WeakPolarHBondContact O-CG 3.36Å; R729-Q733 PolarHBondContact O-N 2.96Å
730	L	91.6	Very high	90.2	Very high	11 Å²	11	72.3 Å²	72.3	6%	0.058	36%	0.364	C	S	.	.	H	α-helix	trans	-65.5	-43.3	174.6	177.2	148.9	0	0	0	110.4	R726 L727 I728 D732 Q733 M734 Y744 H774 H775 F858	R726-L730 WeakPolarHBondContact O-CB 3.26Å; R726-L730 PolarHBondContact O-N 3.44Å; L727-L730 CarbonylContact O-C 3.01Å; L727-L730 WeakPolarHBondContact O-CA 3.3Å; L727-L730 WeakPolarHBondContact O-CB 3.14Å; L727-L730 PolarHBondContact O-N 2.83Å; I728-L730 VanDerWaalsContact C-N 3.29Å; I728-L730 PolarHBondContact O-N 3.31Å; L730-D732 VanDerWaalsContact C-N 3.3Å; L730-D732 PolarHBondContact O-N 3.18Å; L730-Q733 PolarHBondContact O-N 3.45Å; L730-Q733 VanDerWaalsContact O-N 3.15Å; L730-M734 HydrophobicContact CD2-CG 4.02Å; L730-M734 HydrophobicContact CG-CG 4.33Å; L730-M734 WeakPolarHBondContact O-CB 3.38Å; L730-M734 VanDerWaalsContact O-CG 3.27Å; L730-M734 WeakPolarHBondContact O-CG 3.48Å; L730-M734 PolarHBondContact O-N 3.34Å; L730-Y744 HydrophobicContact CD1-CE1 4.23Å; L730-Y744 HydrophobicContact CD2-CD1 4.17Å; L730-Y744 HydrophobicContact CD2-CE1 3.66Å; L730-H774 VanDerWaalsContact CD1-O 3.29Å; L730-H774 WeakPolarHBondContact CD1-O 3.28Å; L730-H775 HydrophobicContact CD1-CB 3.85Å; L730-F858 HydrophobicContact CD2-CE1 4.12Å; L730-F858 HydrophobicContact CD2-CZ 4.37Å
731	E	91.9	Very high	89.9	Confident	2 Å²	2	70.1 Å²	70.1	1%	0.009	36%	0.357	C	S	.	.	H	α-helix	trans	-61.4	-38.6	175.8	-64.1	168.2	163.7	0	0	111.4	L727 I728 M734 S735 R856 F858 R860	L727-E731 HydrophobicContact CD1-CG 4.37Å; L727-E731 HydrophobicContact CG-CG 4.45Å; L727-E731 WeakPolarHBondContact O-CG 3.39Å; L727-E731 PolarHBondContact O-N 3Å; I728-E731 WeakPolarHBondContact O-CB 3.32Å; I728-E731 PolarHBondContact O-N 2.86Å; I728-E731 VanDerWaalsContact O-N 3.15Å; E731-M734 PolarHBondContact O-N 2.86Å; E731-S735 PolarHBondContact O-N 3.33Å; E731-R856 IonicContact OE1-CZ 3.03Å; E731-R856 IonicContact OE1-NE 2.84Å; E731-R856 PolarHBondContact OE1-NE 2.98Å; E731-R856 IonicContact OE1-NH2 3.95Å; E731-R856 IonicContact OE2-CZ 3.64Å; E731-R856 IonicContact OE2-NE 2.75Å; E731-R856 IonicContact OE2-NH2 2.67Å; E731-R856 PolarHBondContact OE2-NH2 3.18Å; E731-F858 HydrophobicContact CB-CD1 4.23Å; E731-F858 HydrophobicContact CB-CE1 4.47Å; E731-F858 HydrophobicContact CG-CD1 3.8Å; E731-F858 HydrophobicContact CG-CE1 4.1Å; E731-R860 PolarHBondContact O-NH2 2.98Å; E731-R860 VanDerWaalsContact O-NH2 3.15Å
732	D	89.2	Confident	89.6	Confident	78 Å²	78	75 Å²	75	42%	0.417	37%	0.368	S	S	.	.	H	α-helix	trans	-67.6	-34.8	174.8	-68.4	-25.9	0	0	0	112.4	I728 R729 L730 S735 R860	I728-D732 PolarHBondContact O-N 3.04Å; R729-D732 PolarHBondContact O-N 3.2Å; L730-D732 VanDerWaalsContact C-N 3.3Å; L730-D732 PolarHBondContact O-N 3.18Å; D732-S735 PolarHBondContact O-OG 2.81Å; D732-R860 VanDerWaalsContact N-NH2 3.15Å; D732-R860 IonicContact OD1-CZ 3.54Å; D732-R860 IonicContact OD1-NH1 3.55Å; D732-R860 PolarHBondContact OD1-NH1 3.47Å; D732-R860 IonicContact OD1-NH2 2.84Å; D732-R860 PolarHBondContact OD1-NH2 3.18Å
733	Q	87.2	Confident	89.2	Confident	117 Å²	117	74.6 Å²	74.6	55%	0.547	37%	0.371	S	S	.	.	H	α-helix	trans	-74.1	-32.8	176.6	-74.5	177.6	-13.7	0	0	112.3	R729 L730	R729-Q733 VanDerWaalsContact O-CG 3.28Å; R729-Q733 WeakPolarHBondContact O-CG 3.36Å; R729-Q733 PolarHBondContact O-N 2.96Å; L730-Q733 PolarHBondContact O-N 3.45Å; L730-Q733 VanDerWaalsContact O-N 3.15Å
734	M	86.7	Confident	89	Confident	17 Å²	17	74.4 Å²	74.4	8%	0.084	37%	0.369	C	S	.	.	H	α-helix	trans	-84	-21.7	-178.8	-71.6	-64.3	-170.4	0	0	113.2	L730 E731 A736 K737 E740 A741 A776 F858	L730-M734 HydrophobicContact CD2-CG 4.02Å; L730-M734 HydrophobicContact CG-CG 4.33Å; L730-M734 WeakPolarHBondContact O-CB 3.38Å; L730-M734 VanDerWaalsContact O-CG 3.27Å; L730-M734 WeakPolarHBondContact O-CG 3.48Å; L730-M734 PolarHBondContact O-N 3.34Å; E731-M734 PolarHBondContact O-N 2.86Å; M734-A736 PolarHBondContact O-N 2.89Å; M734-K737 CarbonylContact O-C 3.57Å; M734-K737 WeakPolarHBondContact O-CA 3.41Å; M734-K737 PolarHBondContact O-N 3.47Å; M734-E740 HydrophobicContact SD-CB 3.98Å; M734-A741 HydrophobicContact CB-CB 4.04Å; M734-A776 HydrophobicContact CE-CB 3.76Å; M734-F858 HydrophobicContact CB-CE1 3.83Å; M734-F858 HydrophobicContact CB-CZ 4.12Å; M734-F858 HydrophobicContact CG-CE1 4.23Å; M734-F858 HydrophobicContact CG-CZ 4.22Å
735	S	81.9	Confident	88.7	Confident	88 Å²	88	74.6 Å²	74.6	62%	0.615	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-30.6	178.9	66	0	0	0	0	113.2	E731 D732 K737	E731-S735 PolarHBondContact O-N 3.33Å; D732-S735 PolarHBondContact O-OG 2.81Å; S735-K737 VanDerWaalsContact C-N 3.32Å
736	A	82.9	Confident	88.3	Confident	88 Å²	88	69.4 Å²	69.4	73%	0.727	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-3.1	175.5	0	0	0	0	0	114	M734	M734-A736 PolarHBondContact O-N 2.89Å
737	K	85.4	Confident	88	Confident	94 Å²	94	64.9 Å²	64.9	41%	0.409	35%	0.345	S	S	.	.			trans	-135.9	70.5	-168.4	-58.3	-165	-178.3	-169.9	0	112.7	M734 S735 E739 E740 A741	M734-K737 CarbonylContact O-C 3.57Å; M734-K737 WeakPolarHBondContact O-CA 3.41Å; M734-K737 PolarHBondContact O-N 3.47Å; S735-K737 VanDerWaalsContact C-N 3.32Å; K737-E739 PolarHBondContact O-N 3.46Å; K737-E740 HydrophobicContact CB-CB 4.02Å; K737-E740 HydrophobicContact CB-CG 4.3Å; K737-E740 HydrophobicContact CD-CB 4.42Å; K737-E740 HydrophobicContact CD-CG 4.16Å; K737-E740 WeakPolarHBondContact CD-OE1 3.12Å; K737-E740 WeakPolarHBondContact CD-OE2 3.48Å; K737-E740 IonicContact NZ-OE1 3.44Å; K737-E740 PolarHBondContact NZ-OE1 3.39Å; K737-E740 IonicContact NZ-OE2 2.82Å; K737-E740 PolarHBondContact NZ-OE2 2.94Å; K737-E740 PolarHBondContact O-N 2.87Å; K737-E740 VanDerWaalsContact O-N 3.13Å; K737-A741 WeakPolarHBondContact O-CB 3.25Å; K737-A741 PolarHBondContact O-N 3.25Å
738	T	84	Confident	87.7	Confident	115 Å²	115	64.7 Å²	64.7	71%	0.706	34%	0.344	S	S	*	.	H	α-helix	trans	-54	-44.3	-172.3	-44.7	0	0	0	0	114.2	A741 F742	T738-A741 PolarHBondContact O-N 3.14Å; T738-F742 WeakPolarHBondContact O-CB 3.43Å; T738-F742 PolarHBondContact O-N 3.47Å
739	E	81.7	Confident	87.5	Confident	167 Å²	167	66.3 Å²	66.3	78%	0.78	35%	0.35	S	S	*	.	H	α-helix	trans	-66.9	-40.5	179.2	-68.5	-173.5	179.2	0	0	113	K737 A743	K737-E739 PolarHBondContact O-N 3.46Å; E739-A743 WeakPolarHBondContact O-CB 3.48Å; E739-A743 PolarHBondContact O-N 3.48Å
740	E	85.7	Confident	87.2	Confident	51 Å²	51	61.2 Å²	61.2	24%	0.238	33%	0.333	C	S	.	.	H	α-helix	trans	-66.9	-40	176.7	-66	-170.4	-159	0	0	110.8	M734 K737 A743 Y744 I778	M734-E740 HydrophobicContact SD-CB 3.98Å; K737-E740 HydrophobicContact CB-CB 4.02Å; K737-E740 HydrophobicContact CB-CG 4.3Å; K737-E740 HydrophobicContact CD-CB 4.42Å; K737-E740 HydrophobicContact CD-CG 4.16Å; K737-E740 WeakPolarHBondContact CD-OE1 3.12Å; K737-E740 WeakPolarHBondContact CD-OE2 3.48Å; K737-E740 IonicContact NZ-OE1 3.44Å; K737-E740 PolarHBondContact NZ-OE1 3.39Å; K737-E740 IonicContact NZ-OE2 2.82Å; K737-E740 PolarHBondContact NZ-OE2 2.94Å; K737-E740 PolarHBondContact O-N 2.87Å; K737-E740 VanDerWaalsContact O-N 3.13Å; E740-A743 PolarHBondContact O-N 3.13Å; E740-Y744 WeakPolarHBondContact O-CB 3.41Å; E740-Y744 PolarHBondContact O-N 3.42Å; E740-I778 HydrophobicContact CB-CD1 3.34Å; E740-I778 HydrophobicContact CG-CD1 3.43Å; E740-I778 VanDerWaalsContact CG-CD1 3.43Å
741	A	87.5	Confident	87.1	Confident	17 Å²	17	62.1 Å²	62.1	14%	0.14	34%	0.336	C	S	.	.	H	α-helix	trans	-63.3	-45.7	176.6	0	0	0	0	0	111.7	M734 K737 T738 Y744 E745 F858	M734-A741 HydrophobicContact CB-CB 4.04Å; K737-A741 WeakPolarHBondContact O-CB 3.25Å; K737-A741 PolarHBondContact O-N 3.25Å; T738-A741 PolarHBondContact O-N 3.14Å; A741-Y744 WeakPolarHBondContact O-CB 3.4Å; A741-Y744 PolarHBondContact O-N 3.03Å; A741-E745 PolarHBondContact O-N 3.29Å; A741-F858 HydrophobicContact CB-CE2 4.31Å; A741-F858 HydrophobicContact CB-CZ 4.17Å
742	F	86.9	Confident	86.9	Confident	137 Å²	137	63.8 Å²	63.8	60%	0.601	35%	0.345	S	S	*	.	H	α-helix	trans	-62.6	-46.7	175.9	-179.4	-104.1	0	0	0	111.8	T738 Y744 E745 C746	T738-F742 WeakPolarHBondContact O-CB 3.43Å; T738-F742 PolarHBondContact O-N 3.47Å; F742-Y744 PolarHBondContact O-N 3.33Å; F742-E745 PolarHBondContact O-N 2.79Å; F742-C746 VanDerWaalsContact CZ-SG 3.57Å; F742-C746 PolarHBondContact O-N 3.47Å; F742-C746 PolarHBondContact O-SG 3.47Å; F742-C746 VanDerWaalsContact O-SG 3.33Å
743	A	86	Confident	86.7	Confident	25 Å²	25	64.6 Å²	64.6	21%	0.207	36%	0.357	C	S	.	.	H	α-helix	trans	-62	-31	175.9	0	0	0	0	0	112.5	E739 E740 G747 C787	E739-A743 WeakPolarHBondContact O-CB 3.48Å; E739-A743 PolarHBondContact O-N 3.48Å; E740-A743 PolarHBondContact O-N 3.13Å; A743-G747 PolarHBondContact O-N 3.32Å; A743-G747 VanDerWaalsContact O-N 3.11Å; A743-C787 HydrophobicContact CB-CB 4.22Å; A743-C787 WeakPolarHBondContact O-CB 3.32Å; A743-C787 PolarHBondContact O-SG 2.97Å
744	Y	90.9	Very high	86.4	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-70.4	-47.1	174.2	-172.3	-119	0	0	0	112.8	L730 E740 A741 F742 G747 M748 H774 A776 I789 W855 F858	L730-Y744 HydrophobicContact CD1-CE1 4.23Å; L730-Y744 HydrophobicContact CD2-CD1 4.17Å; L730-Y744 HydrophobicContact CD2-CE1 3.66Å; E740-Y744 WeakPolarHBondContact O-CB 3.41Å; E740-Y744 PolarHBondContact O-N 3.42Å; A741-Y744 WeakPolarHBondContact O-CB 3.4Å; A741-Y744 PolarHBondContact O-N 3.03Å; F742-Y744 PolarHBondContact O-N 3.33Å; Y744-G747 PolarHBondContact O-N 3.39Å; Y744-G747 VanDerWaalsContact O-N 3.17Å; Y744-M748 HydrophobicContact CE2-CE 4.48Å; Y744-M748 PolarHBondContact O-N 3.1Å; Y744-M748 WeakPolarHBondContact OH-CE 3.43Å; Y744-H774 AromaticContact CZ-ND1 3.83Å; Y744-H774 PolarHBondContact OH-CE1 3.28Å; Y744-H774 PolarHBondContact OH-ND1 2.86Å; Y744-A776 HydrophobicContact CD2-CB 3.29Å; Y744-A776 HydrophobicContact CE2-CB 3.78Å; Y744-A776 HydrophobicContact CG-CB 4.07Å; Y744-I789 HydrophobicContact CD2-CD1 3.33Å; Y744-I789 HydrophobicContact CE2-CD1 3.28Å; Y744-I789 HydrophobicContact CE2-CG2 4.34Å; Y744-I789 HydrophobicContact CG-CD1 4.42Å; Y744-W855 AromaticContact CD1-CH2 3.99Å; Y744-W855 HydrophobicContact CD1-CH2 3.99Å; Y744-W855 HydrophobicContact CD1-CZ3 4.08Å; Y744-W855 HydrophobicContact CE1-CH2 4.04Å; Y744-W855 AromaticContact CE1-CZ3 3.66Å; Y744-W855 HydrophobicContact CE1-CZ3 3.66Å; Y744-F858 AromaticContact CD1-CE2 3.98Å; Y744-F858 HydrophobicContact CD1-CE2 3.98Å; Y744-F858 AromaticContact CD1-CZ 3.62Å; Y744-F858 HydrophobicContact CD1-CZ 3.62Å; Y744-F858 HydrophobicContact CE1-CZ 4.39Å
745	E	90.4	Very high	86.1	Confident	63 Å²	63	63.2 Å²	63.2	29%	0.294	36%	0.362	S	S	.	.	H	α-helix	trans	-60.3	-48.9	176.5	-179.2	167.3	-114.6	0	0	111.4	A741 F742 G747 M748 E749 W855 F858	A741-E745 PolarHBondContact O-N 3.29Å; F742-E745 PolarHBondContact O-N 2.79Å; E745-G747 PolarHBondContact O-N 3.45Å; E745-M748 PolarHBondContact O-N 3Å; E745-E749 PolarHBondContact O-N 3.05Å; E745-W855 HydrophobicContact CB-CZ2 4.45Å; E745-W855 HydrophobicContact CG-CZ2 4.29Å; E745-F858 HydrophobicContact CB-CD2 4.4Å; E745-F858 HydrophobicContact CB-CE2 4.18Å
746	C	88.1	Confident	86.2	Confident	59 Å²	59	59.6 Å²	59.6	40%	0.399	34%	0.335	S	S	.	.	H	α-helix	trans	-57.1	-39.7	173.4	-66	0	0	0	0	112.2	F742 E749 E750	F742-C746 VanDerWaalsContact CZ-SG 3.57Å; F742-C746 PolarHBondContact O-N 3.47Å; F742-C746 PolarHBondContact O-SG 3.47Å; F742-C746 VanDerWaalsContact O-SG 3.33Å; C746-E749 PolarHBondContact O-N 3.45Å; C746-E750 PolarHBondContact O-N 2.84Å
747	G	87.4	Confident	86.5	Confident	7 Å²	7	55.7 Å²	55.7	7%	0.072	30%	0.302	C	S	.	.	H	α-helix	trans	-64.8	-36.4	176.5	0	0	0	0	0	113	A743 Y744 E745 Y751	A743-G747 PolarHBondContact O-N 3.32Å; A743-G747 VanDerWaalsContact O-N 3.11Å; Y744-G747 PolarHBondContact O-N 3.39Å; Y744-G747 VanDerWaalsContact O-N 3.17Å; E745-G747 PolarHBondContact O-N 3.45Å; G747-Y751 WeakPolarHBondContact O-CD2 3.4Å
748	M	90.6	Very high	86.7	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-74	-41.2	174.3	-82.5	-63.6	-172.4	0	0	112.5	Y744 E745 E750 Y751 I752 H774 I789 F791 Y853 W855	Y744-M748 HydrophobicContact CE2-CE 4.48Å; Y744-M748 PolarHBondContact O-N 3.1Å; Y744-M748 WeakPolarHBondContact OH-CE 3.43Å; E745-M748 PolarHBondContact O-N 3Å; M748-E750 PolarHBondContact O-N 3.3Å; M748-Y751 WeakPolarHBondContact O-CB 3.44Å; M748-Y751 PolarHBondContact O-N 3.23Å; M748-I752 PolarHBondContact O-N 3.39Å; M748-H774 HydrophobicContact CE-CB 3.96Å; M748-H774 VanDerWaalsContact CE-CD2 3.47Å; M748-H774 WeakPolarHBondContact CE-CD2 3.17Å; M748-I789 HydrophobicContact CE-CG2 3.43Å; M748-I789 VanDerWaalsContact CE-CG2 3.43Å; M748-I789 HydrophobicContact CG-CD1 4.31Å; M748-I789 HydrophobicContact SD-CG2 4.13Å; M748-F791 HydrophobicContact CE-CE1 4.3Å; M748-F791 HydrophobicContact CE-CZ 4.18Å; M748-F791 HydrophobicContact SD-CZ 4.45Å; M748-Y853 HydrophobicContact CE-CE2 4.35Å; M748-Y853 HydrophobicContact SD-CE2 4.07Å; M748-W855 HydrophobicContact CB-CD2 4.29Å; M748-W855 HydrophobicContact CB-CH2 4.42Å; M748-W855 HydrophobicContact CB-CZ2 3.84Å; M748-W855 HydrophobicContact CG-CD2 4.14Å; M748-W855 HydrophobicContact CG-CE3 4.25Å; M748-W855 HydrophobicContact CG-CH2 4.25Å; M748-W855 HydrophobicContact CG-CZ2 4.12Å; M748-W855 HydrophobicContact CG-CZ3 4.32Å
749	E	89	Confident	87	Confident	90 Å²	90	53.9 Å²	53.9	42%	0.421	28%	0.282	S	S	.	.	H	α-helix	trans	-59.9	-34.3	174.7	-76.1	-58.1	143.4	0	0	111.6	E745 C746 Y751 I752 S753	E745-E749 PolarHBondContact O-N 3.05Å; C746-E749 PolarHBondContact O-N 3.45Å; E749-Y751 VanDerWaalsContact C-N 3.29Å; E749-Y751 PolarHBondContact O-N 3.07Å; E749-I752 PolarHBondContact O-N 3.17Å; E749-I752 VanDerWaalsContact O-N 3.15Å; E749-S753 WeakPolarHBondContact O-CB 3.49Å; E749-S753 PolarHBondContact O-N 3.47Å; E749-S753 PolarHBondContact O-OG 2.88Å
750	E	86.5	Confident	87.4	Confident	59 Å²	59	46.8 Å²	46.8	28%	0.276	25%	0.252	S	S	.	.	H	α-helix	trans	-59.4	-37.9	173.8	-173	178.1	-160.6	0	0	112.4	C746 M748 I752 S753 N754 W756 K836	C746-E750 PolarHBondContact O-N 2.84Å; M748-E750 PolarHBondContact O-N 3.3Å; E750-I752 VanDerWaalsContact C-N 3.34Å; E750-S753 PolarHBondContact O-OG 3.08Å; E750-N754 WeakPolarHBondContact CG-ND2 3.4Å; E750-N754 VanDerWaalsContact O-CB 3.32Å; E750-N754 WeakPolarHBondContact O-CB 3.32Å; E750-N754 PolarHBondContact O-N 3.26Å; E750-N754 VanDerWaalsContact O-N 3.12Å; E750-N754 PolarHBondContact O-ND2 3.3Å; E750-W756 HydrophobicContact CG-CH2 4.06Å; E750-W756 HydrophobicContact CG-CZ3 4.08Å; E750-K836 WeakPolarHBondContact OE1-CE 3.4Å; E750-K836 IonicContact OE1-NZ 2.81Å; E750-K836 PolarHBondContact OE1-NZ 3.37Å
751	Y	88.3	Confident	87.3	Confident	30 Å²	30	49.9 Å²	49.9	12%	0.118	27%	0.27	C	S	.	.	H	α-helix	trans	-66	-41.6	177	-79.9	-118.8	0	0	0	111	G747 M748 E749 G755 W756 V757 I789 F791 M839 F869	G747-Y751 WeakPolarHBondContact O-CD2 3.4Å; M748-Y751 WeakPolarHBondContact O-CB 3.44Å; M748-Y751 PolarHBondContact O-N 3.23Å; E749-Y751 VanDerWaalsContact C-N 3.29Å; E749-Y751 PolarHBondContact O-N 3.07Å; Y751-G755 PolarHBondContact O-N 3.26Å; Y751-W756 AromaticContact CD1-CE3 3.92Å; Y751-W756 HydrophobicContact CD1-CE3 3.92Å; Y751-W756 AromaticContact CD2-CE3 3.99Å; Y751-W756 HydrophobicContact CD2-CE3 3.99Å; Y751-W756 AromaticContact CD2-CZ3 4Å; Y751-W756 HydrophobicContact CD2-CZ3 4Å; Y751-W756 HydrophobicContact CE1-CE3 4.28Å; Y751-W756 HydrophobicContact CE2-CE3 4.38Å; Y751-W756 HydrophobicContact CE2-CZ3 4.22Å; Y751-W756 AromaticContact CG-CE3 3.76Å; Y751-W756 HydrophobicContact CG-CE3 3.76Å; Y751-W756 HydrophobicContact CG-CZ3 4.25Å; Y751-W756 PolarHBondContact O-N 3.35Å; Y751-W756 VanDerWaalsContact O-N 3.07Å; Y751-V757 HydrophobicContact CD1-CG1 4.04Å; Y751-I789 HydrophobicContact CD2-CG1 4.49Å; Y751-I789 HydrophobicContact CE2-CB 4.16Å; Y751-I789 HydrophobicContact CE2-CG1 3.9Å; Y751-F791 HydrophobicContact CD1-CE2 4.28Å; Y751-F791 HydrophobicContact CD1-CZ 4.41Å; Y751-F791 AromaticContact CE1-CE2 3.63Å; Y751-F791 HydrophobicContact CE1-CE2 3.63Å; Y751-F791 HydrophobicContact CE1-CZ 4.21Å; Y751-M839 HydrophobicContact CD1-SD 4.34Å; Y751-M839 HydrophobicContact CE1-SD 3.65Å; Y751-F869 HydrophobicContact CD1-CE1 4.07Å; Y751-F869 AromaticContact CE1-CE1 3.96Å; Y751-F869 HydrophobicContact CE1-CE1 3.96Å; Y751-F869 HydrophobicContact CE1-CZ 4.3Å
752	I	88.1	Confident	87.1	Confident	38 Å²	38	54.9 Å²	54.9	20%	0.195	29%	0.29	C	S	.	.	H	α-helix	trans	-68.5	-50.2	-178.9	-61.8	170.4	0	0	0	110	M748 E749 E750 N754 G755 V757 W867	M748-I752 PolarHBondContact O-N 3.39Å; E749-I752 PolarHBondContact O-N 3.17Å; E749-I752 VanDerWaalsContact O-N 3.15Å; E750-I752 VanDerWaalsContact C-N 3.34Å; I752-N754 PolarHBondContact O-N 3.03Å; I752-G755 PolarHBondContact O-N 2.57Å; I752-V757 HydrophobicContact CB-CG2 4.4Å; I752-V757 HydrophobicContact CG1-CG2 3.82Å; I752-W867 HydrophobicContact CB-CH2 4.34Å; I752-W867 HydrophobicContact CB-CZ3 4.38Å; I752-W867 HydrophobicContact CD1-CH2 3.76Å; I752-W867 HydrophobicContact CD1-CZ2 3.68Å; I752-W867 HydrophobicContact CD1-CZ3 4.26Å; I752-W867 HydrophobicContact CG1-CE3 4.2Å; I752-W867 HydrophobicContact CG1-CH2 3.79Å; I752-W867 HydrophobicContact CG1-CZ2 4.16Å; I752-W867 HydrophobicContact CG1-CZ3 3.81Å; I752-W867 HydrophobicContact CG2-CH2 3.62Å; I752-W867 HydrophobicContact CG2-CZ3 3.89Å
753	S	85.4	Confident	86.8	Confident	95 Å²	95	54.2 Å²	54.2	66%	0.664	30%	0.299	S	S	*	.	H	α-helix	trans	-68.3	-32.5	-175.4	75.6	0	0	0	0	113.1	E749 E750 G755	E749-S753 WeakPolarHBondContact O-CB 3.49Å; E749-S753 PolarHBondContact O-N 3.47Å; E749-S753 PolarHBondContact O-OG 2.88Å; E750-S753 PolarHBondContact O-OG 3.08Å; S753-G755 PolarHBondContact O-N 3.41Å
754	N	81.4	Confident	86.7	Confident	68 Å²	68	53.7 Å²	53.7	36%	0.364	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-3.2	174.2	-73.4	-75.2	0	0	0	113.1	E750 I752 W756	E750-N754 WeakPolarHBondContact CG-ND2 3.4Å; E750-N754 VanDerWaalsContact O-CB 3.32Å; E750-N754 WeakPolarHBondContact O-CB 3.32Å; E750-N754 PolarHBondContact O-N 3.26Å; E750-N754 VanDerWaalsContact O-N 3.12Å; E750-N754 PolarHBondContact O-ND2 3.3Å; I752-N754 PolarHBondContact O-N 3.03Å; N754-W756 VanDerWaalsContact C-N 3.27Å; N754-W756 HydrophobicContact CB-CD2 3.78Å; N754-W756 HydrophobicContact CB-CE3 4.33Å; N754-W756 HydrophobicContact CB-CG 4.19Å; N754-W756 HydrophobicContact CB-CH2 4.05Å; N754-W756 HydrophobicContact CB-CZ2 3.53Å; N754-W756 HydrophobicContact CB-CZ3 4.45Å; N754-W756 PolarHBondContact O-N 3.12Å
755	G	79.6	Confident	86.3	Confident	37 Å²	37	57.7 Å²	57.7	38%	0.381	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.3	25.9	-179.7	0	0	0	0	0	113.7	Y751 I752 S753 T870	Y751-G755 PolarHBondContact O-N 3.26Å; I752-G755 PolarHBondContact O-N 2.57Å; S753-G755 PolarHBondContact O-N 3.41Å; G755-T870 WeakPolarHBondContact O-CB 3.24Å; G755-T870 WeakPolarHBondContact O-CG2 3.45Å; G755-T870 PolarHBondContact O-OG1 3.24Å
756	W	84.4	Confident	85.6	Confident	12 Å²	12	62.2 Å²	62.2	5%	0.045	36%	0.355	C	S	.	.	S	Bend	trans	-75.7	-19.6	173.6	-58.3	-31.1	0	0	0	112.5	E750 Y751 N754 K836 M839 F869 T870	E750-W756 HydrophobicContact CG-CH2 4.06Å; E750-W756 HydrophobicContact CG-CZ3 4.08Å; Y751-W756 AromaticContact CD1-CE3 3.92Å; Y751-W756 HydrophobicContact CD1-CE3 3.92Å; Y751-W756 AromaticContact CD2-CE3 3.99Å; Y751-W756 HydrophobicContact CD2-CE3 3.99Å; Y751-W756 AromaticContact CD2-CZ3 4Å; Y751-W756 HydrophobicContact CD2-CZ3 4Å; Y751-W756 HydrophobicContact CE1-CE3 4.28Å; Y751-W756 HydrophobicContact CE2-CE3 4.38Å; Y751-W756 HydrophobicContact CE2-CZ3 4.22Å; Y751-W756 AromaticContact CG-CE3 3.76Å; Y751-W756 HydrophobicContact CG-CE3 3.76Å; Y751-W756 HydrophobicContact CG-CZ3 4.25Å; Y751-W756 PolarHBondContact O-N 3.35Å; Y751-W756 VanDerWaalsContact O-N 3.07Å; N754-W756 VanDerWaalsContact C-N 3.27Å; N754-W756 HydrophobicContact CB-CD2 3.78Å; N754-W756 HydrophobicContact CB-CE3 4.33Å; N754-W756 HydrophobicContact CB-CG 4.19Å; N754-W756 HydrophobicContact CB-CH2 4.05Å; N754-W756 HydrophobicContact CB-CZ2 3.53Å; N754-W756 HydrophobicContact CB-CZ3 4.45Å; N754-W756 PolarHBondContact O-N 3.12Å; W756-K836 HydrophobicContact CH2-CD 3.51Å; W756-K836 HydrophobicContact CH2-CG 4.37Å; W756-K836 HydrophobicContact CZ2-CB 4.48Å; W756-K836 HydrophobicContact CZ2-CD 3.62Å; W756-M839 HydrophobicContact CD2-CB 3.63Å; W756-M839 HydrophobicContact CD2-CG 3.87Å; W756-M839 HydrophobicContact CD2-SD 4.25Å; W756-M839 HydrophobicContact CE3-CB 4.11Å; W756-M839 HydrophobicContact CE3-CG 3.81Å; W756-M839 HydrophobicContact CE3-SD 4.01Å; W756-M839 HydrophobicContact CG-CB 3.94Å; W756-M839 HydrophobicContact CG-CG 4.45Å; W756-M839 HydrophobicContact CH2-CG 4.45Å; W756-M839 HydrophobicContact CZ2-CB 4.1Å; W756-M839 HydrophobicContact CZ2-CG 4.45Å; W756-M839 HydrophobicContact CZ3-CG 4.12Å; W756-F869 VanDerWaalsContact O-CA 3.28Å; W756-F869 WeakPolarHBondContact O-CA 3.2Å; W756-T870 VanDerWaalsContact C-OG1 3.23Å; W756-T870 WeakPolarHBondContact CA-OG1 2.97Å; W756-T870 PolarHBondContact O-N 2.66Å; W756-T870 VanDerWaalsContact O-N 3.1Å; W756-T870 PolarHBondContact O-OG1 3.38Å; W756-T870 VanDerWaalsContact O-OG1 3.14Å
757	V	89.1	Confident	85.2	Confident	6 Å²	6	60.1 Å²	60.1	4%	0.036	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	144.5	-178.2	-60.5	0	0	0	0	110.3	Y751 I752 Y853 W867 R868 F869 T870	Y751-V757 HydrophobicContact CD1-CG1 4.04Å; I752-V757 HydrophobicContact CB-CG2 4.4Å; I752-V757 HydrophobicContact CG1-CG2 3.82Å; V757-Y853 HydrophobicContact CB-CE1 4.22Å; V757-Y853 WeakPolarHBondContact CB-OH 3.07Å; V757-Y853 HydrophobicContact CG1-CE1 3.81Å; V757-Y853 WeakPolarHBondContact CG1-OH 3.24Å; V757-Y853 VanDerWaalsContact CG2-OH 3.22Å; V757-Y853 WeakPolarHBondContact CG2-OH 3.23Å; V757-W867 HydrophobicContact CB-CE3 4.31Å; V757-W867 HydrophobicContact CG2-CE3 3.87Å; V757-W867 HydrophobicContact CG2-CZ3 4.29Å; V757-R868 CarbonylContact C-O 3.56Å; V757-R868 WeakPolarHBondContact CA-O 3.17Å; V757-F869 HydrophobicContact CG1-CD1 3.92Å; V757-F869 HydrophobicContact CG1-CE1 4.03Å; V757-F869 HydrophobicContact CG1-CG 4.36Å; V757-T870 VanDerWaalsContact CA-CG2 3.46Å
758	E	89.2	Confident	85	Confident	52 Å²	52	60.5 Å²	60.5	24%	0.243	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	154.2	175.8	55.7	-174.8	-145.5	0	0	109.5	A760 R848 W867 R868 T870	E758-A760 PolarHBondContact O-N 3.38Å; E758-R848 IonicContact OE1-NH1 3.86Å; E758-R848 IonicContact OE2-NH1 3.59Å; E758-W867 VanDerWaalsContact C-CE3 3.43Å; E758-W867 CarbonylContact O-C 3.5Å; E758-W867 VanDerWaalsContact O-CA 3.27Å; E758-W867 WeakPolarHBondContact O-CA 3.19Å; E758-R868 HydrophobicContact CG-CG 3.76Å; E758-R868 PolarHBondContact N-O 3.09Å; E758-R868 PolarHBondContact O-N 2.82Å; E758-R868 IonicContact OE1-CZ 3.75Å; E758-R868 VanDerWaalsContact OE1-CZ 3.24Å; E758-R868 IonicContact OE1-NE 2.93Å; E758-R868 PolarHBondContact OE1-NE 2.89Å; E758-R868 IonicContact OE1-NH2 3.87Å; E758-R868 PolarHBondContact OE1-NH2 3.22Å; E758-T870 HydrophobicContact CB-CG2 3.56Å; E758-T870 HydrophobicContact CG-CG2 3.68Å
759	R	91.5	Very high	84.9	Confident	119 Å²	119	62.4 Å²	62.4	45%	0.449	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	129.3	170.1	-167.6	-179.3	-69.7	-103.9	-4.3	109.2	N761 S865 V866	R759-N761 WeakPolarHBondContact CD-OD1 3.23Å; R759-N761 WeakPolarHBondContact CG-OD1 3.29Å; R759-N761 PolarHBondContact O-N 3.33Å; R759-S865 PolarHBondContact NH1-OG 2.87Å; R759-V866 WeakPolarHBondContact CA-O 3.45Å
760	A	89.9	Confident	85.2	Confident	17 Å²	17	58.1 Å²	58.1	14%	0.14	34%	0.335	C	S	.	.			trans	-77.5	88.9	176.1	0	0	0	0	0	109.6	E758 H762 V866 R868	E758-A760 PolarHBondContact O-N 3.38Å; A760-H762 PolarHBondContact O-N 2.91Å; A760-V866 HydrophobicContact CB-CB 4.13Å; A760-V866 HydrophobicContact CB-CG1 3.73Å; A760-V866 PolarHBondContact N-O 3.03Å; A760-R868 HydrophobicContact CB-CG 4.35Å
761	N	84	Confident	85.7	Confident	117 Å²	117	55.8 Å²	55.8	63%	0.626	32%	0.324	S	S	*	.			trans	-79.9	0.1	-175.7	-62.8	-29.3	0	0	0	113.8	R759	R759-N761 WeakPolarHBondContact CD-OD1 3.23Å; R759-N761 WeakPolarHBondContact CG-OD1 3.29Å; R759-N761 PolarHBondContact O-N 3.33Å
762	H	81.5	Confident	86.1	Confident	121 Å²	121	54.9 Å²	54.9	56%	0.56	32%	0.321	S	S	*	.	S	Bend	trans	-129.3	144.7	-175.4	-41.9	-58.4	0	0	0	110.3	A760 A764 R852	A760-H762 PolarHBondContact O-N 2.91Å; H762-A764 PolarHBondContact O-N 3.03Å; H762-R852 PolarHBondContact O-NH2 2.92Å
763	P	82	Confident	86.5	Confident	123 Å²	123	53.3 Å²	53.3	80%	0.799	31%	0.313	S	S	*	.	P	Polyproline II helix	trans	-61.2	138.7	170.6	26.7	-32.4	0	0	0	109.5
764	A	83	Confident	86.9	Confident	15 Å²	15	49.5 Å²	49.5	12%	0.124	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-69.9	152.6	175.5	0	0	0	0	0	110.3	H762 E769 D849 R852	H762-A764 PolarHBondContact O-N 3.03Å; A764-E769 HydrophobicContact CB-CB 3.5Å; A764-E769 VanDerWaalsContact CB-CB 3.5Å; A764-E769 HydrophobicContact CB-CG 3.64Å; A764-D849 HydrophobicContact CB-CB 3.95Å; A764-R852 VanDerWaalsContact CB-CZ 3.42Å
765	S	82.3	Confident	87.5	Confident	83 Å²	83	49.9 Å²	49.9	58%	0.58	28%	0.284	S	S	*	.	P	Polyproline II helix	trans	-61.6	144.1	168.4	-52.1	0	0	0	0	110.7	G767 A768	S765-G767 PolarHBondContact O-N 3.09Å; S765-A768 WeakPolarHBondContact O-CB 3.34Å; S765-A768 PolarHBondContact O-N 3.08Å
766	V	76.8	Confident	87.9	Confident	158 Å²	158	49 Å²	49	96%	0.958	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	124.8	177.9	179.5	0	0	0	0	109.8	A768	V766-A768 VanDerWaalsContact C-N 3.33Å
767	G	79.4	Confident	88	Confident	16 Å²	16	51 Å²	51	17%	0.165	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	89.6	-13.6	-177.5	0	0	0	0	0	115.1	L716 S765	L716-G767 PolarHBondContact N-O 3.02Å; S765-G767 PolarHBondContact O-N 3.09Å
768	A	83.2	Confident	87.6	Confident	15 Å²	15	52.6 Å²	52.6	12%	0.124	30%	0.295	C	S	.	.			trans	-98.9	5.6	178.2	0	0	0	0	0	114.1	S765 V766 D849 F850	S765-A768 WeakPolarHBondContact O-CB 3.34Å; S765-A768 PolarHBondContact O-N 3.08Å; V766-A768 VanDerWaalsContact C-N 3.33Å; A768-D849 CarbonylContact O-C 3.58Å; A768-D849 VanDerWaalsContact O-CB 3.27Å; A768-D849 WeakPolarHBondContact O-CB 3.49Å; A768-F850 VanDerWaalsContact CA-CE1 3.46Å; A768-F850 VanDerWaalsContact CA-CZ 3.45Å; A768-F850 HydrophobicContact CB-CE1 4.12Å; A768-F850 HydrophobicContact CB-CE2 3.84Å; A768-F850 HydrophobicContact CB-CZ 3.55Å; A768-F850 PolarHBondContact O-N 2.99Å
769	E	89.3	Confident	87	Confident	40 Å²	40	55.5 Å²	55.5	19%	0.187	30%	0.303	C	S	.	.			trans	-101.3	107.7	-171.7	-167.2	169.4	-149.9	0	0	112.4	N718 A764 Y771 R852	N718-E769 PolarHBondContact ND2-OE2 2.81Å; A764-E769 HydrophobicContact CB-CB 3.5Å; A764-E769 VanDerWaalsContact CB-CB 3.5Å; A764-E769 HydrophobicContact CB-CG 3.64Å; E769-Y771 HydrophobicContact CG-CE2 3.7Å; E769-Y771 PolarHBondContact OE1-OH 2.95Å; E769-Y771 VanDerWaalsContact OE1-OH 3.08Å; E769-R852 IonicContact OE1-NH1 2.7Å; E769-R852 PolarHBondContact OE1-NH1 2.93Å
770	W	94.6	Very high	85.9	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	31%	0.313	C	S	.	.			trans	-139.9	132.6	179.3	-172.4	-97	0	0	0	113.1	L716 P717 N719 S795 Y797 V800 D849 F850 R852	L716-W770 HydrophobicContact CB-CB 4.5Å; L716-W770 HydrophobicContact CB-CD2 4.39Å; L716-W770 HydrophobicContact CB-CE3 3.75Å; L716-W770 HydrophobicContact CB-CZ3 4.3Å; L716-W770 HydrophobicContact CD1-CB 4.06Å; L716-W770 HydrophobicContact CD1-CD2 4Å; L716-W770 HydrophobicContact CD1-CE3 4.17Å; L716-W770 HydrophobicContact CD1-CG 3.99Å; L716-W770 HydrophobicContact CD2-CD2 4.39Å; L716-W770 HydrophobicContact CD2-CE3 3.95Å; L716-W770 HydrophobicContact CD2-CH2 4.27Å; L716-W770 HydrophobicContact CD2-CZ3 3.87Å; L716-W770 HydrophobicContact CG-CD2 4.49Å; L716-W770 HydrophobicContact CG-CE3 4.16Å; P717-W770 HydrophobicContact CG-CZ3 4.16Å; P717-W770 VanDerWaalsContact O-CE3 3.23Å; P717-W770 VanDerWaalsContact O-CZ3 3.28Å; P717-W770 WeakPolarHBondContact O-CZ3 3.41Å; N719-W770 HydrophobicContact CB-CE3 4.11Å; N719-W770 HydrophobicContact CB-CH2 4.29Å; N719-W770 HydrophobicContact CB-CZ3 3.93Å; W770-S795 WeakPolarHBondContact CZ2-O 3.45Å; W770-Y797 HydrophobicContact CZ3-CD1 4.42Å; W770-V800 WeakPolarHBondContact CH2-O 3.38Å; W770-D849 PolarHBondContact N-O 3.49Å; W770-F850 CarbonylContact O-C 3.46Å; W770-R852 VanDerWaalsContact O-CB 3.31Å; W770-R852 WeakPolarHBondContact O-CB 3.49Å; W770-R852 PolarHBondContact O-N 2.77Å
771	Y	96.6	Very high	84.6	Confident	9 Å²	9	61.2 Å²	61.2	4%	0.035	34%	0.336	C	S	.	.	B	Isolated β-bridge	trans	-107.8	117.4	-177.9	-64	-98.3	0	0	0	110.9	N719 H720 A723 E769 P773 R852 L854 V866	N719-Y771 PolarHBondContact ND2-O 3.46Å; N719-Y771 WeakPolarHBondContact OD1-CA 3.48Å; N719-Y771 WeakPolarHBondContact OD1-CB 3.45Å; N719-Y771 PolarHBondContact OD1-N 2.65Å; N719-Y771 PolarHBondContact OD1-O 3.39Å; H720-Y771 HydrophobicContact CB-CD2 3.89Å; H720-Y771 HydrophobicContact CB-CE2 3.72Å; H720-Y771 AromaticContact CD2-CE1 3.71Å; H720-Y771 AromaticContact CD2-CE2 3.97Å; H720-Y771 AromaticContact CD2-CZ 3.59Å; A723-Y771 HydrophobicContact CB-CG 4.48Å; E769-Y771 HydrophobicContact CG-CE2 3.7Å; E769-Y771 PolarHBondContact OE1-OH 2.95Å; E769-Y771 VanDerWaalsContact OE1-OH 3.08Å; Y771-P773 VanDerWaalsContact O-CD 3.31Å; Y771-P773 WeakPolarHBondContact O-CD 3.48Å; Y771-R852 CarbonylContact C-O 3.35Å; Y771-R852 VanDerWaalsContact CA-O 3.26Å; Y771-R852 WeakPolarHBondContact CA-O 3.49Å; Y771-R852 HydrophobicContact CD1-CB 3.84Å; Y771-R852 HydrophobicContact CE1-CB 4Å; Y771-R852 HydrophobicContact CG-CB 4.26Å; Y771-L854 HydrophobicContact CD1-CD2 3.66Å; Y771-L854 HydrophobicContact CD1-CG 3.89Å; Y771-L854 HydrophobicContact CE1-CD2 3.55Å; Y771-L854 HydrophobicContact CE1-CG 4.3Å; Y771-V866 HydrophobicContact CD1-CG1 4.43Å; Y771-V866 HydrophobicContact CE1-CB 4.35Å; Y771-V866 HydrophobicContact CE1-CG1 3.54Å; Y771-V866 HydrophobicContact CE1-CG2 3.91Å
772	L	96	Very high	83.6	Confident	11 Å²	11	60.4 Å²	60.4	6%	0.058	33%	0.327	C	S	.	.			trans	-77.5	116.8	173.7	-61.3	177	0	0	0	109.9	F791 L802 V851 R852	L772-F791 HydrophobicContact CB-CB 4.17Å; L772-F791 HydrophobicContact CB-CD1 4.21Å; L772-F791 HydrophobicContact CD1-CB 3.98Å; L772-L802 HydrophobicContact CD2-CD2 4Å; L772-V851 HydrophobicContact CD1-CB 3.91Å; L772-V851 HydrophobicContact CD1-CG1 4.08Å; L772-R852 PolarHBondContact N-O 2.73Å
773	P	96.8	Very high	82.2	Confident	5 Å²	5	60.9 Å²	60.9	3%	0.032	34%	0.338	C	S	.	.			trans	-62.7	145.1	165.9	-18.3	33.4	0	0	0	109.4	R726 Y771 D792	R726-P773 HydrophobicContact CB-CB 4.07Å; R726-P773 HydrophobicContact CG-CB 4.06Å; R726-P773 HydrophobicContact CG-CG 4.31Å; Y771-P773 VanDerWaalsContact O-CD 3.31Å; Y771-P773 WeakPolarHBondContact O-CD 3.48Å; P773-D792 WeakPolarHBondContact O-CB 3.36Å; P773-D792 PolarHBondContact O-N 3.28Å
774	H	95.3	Very high	80.8	Confident	16 Å²	16	61 Å²	61	7%	0.074	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	158.8	-179.4	52.1	56.5	0	0	0	111.7	L730 Y744 M748 I789 V790 F791 Y853 L854	L730-H774 VanDerWaalsContact CD1-O 3.29Å; L730-H774 WeakPolarHBondContact CD1-O 3.28Å; Y744-H774 AromaticContact CZ-ND1 3.83Å; Y744-H774 PolarHBondContact OH-CE1 3.28Å; Y744-H774 PolarHBondContact OH-ND1 2.86Å; M748-H774 HydrophobicContact CE-CB 3.96Å; M748-H774 VanDerWaalsContact CE-CD2 3.47Å; M748-H774 WeakPolarHBondContact CE-CD2 3.17Å; H774-I789 HydrophobicContact CB-CG2 4.3Å; H774-V790 VanDerWaalsContact CA-O 3.27Å; H774-V790 WeakPolarHBondContact CA-O 3.47Å; H774-F791 HydrophobicContact CB-CD1 3.94Å; H774-F791 HydrophobicContact CB-CE1 4.08Å; H774-Y853 AromaticContact CD2-CD2 3.65Å; H774-Y853 AromaticContact NE2-CD2 3.86Å; H774-L854 PolarHBondContact NE2-O 3.02Å
775	H	92.2	Very high	79.6	Confident	75 Å²	75	63.2 Å²	63.2	35%	0.347	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	161.4	171	63.8	-73.9	0	0	0	111.9	L730 V790	L730-H775 HydrophobicContact CD1-CB 3.85Å; H775-V790 PolarHBondContact N-O 3.31Å; H775-V790 VanDerWaalsContact N-O 3.1Å; H775-V790 PolarHBondContact ND1-O 3.23Å; H775-V790 PolarHBondContact O-N 3.34Å
776	A	89.1	Confident	78.9	Confident	18 Å²	18	64.4 Å²	64.4	15%	0.149	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	138.7	174.8	0	0	0	0	0	111.5	M734 Y744 I778	M734-A776 HydrophobicContact CE-CB 3.76Å; Y744-A776 HydrophobicContact CD2-CB 3.29Å; Y744-A776 HydrophobicContact CE2-CB 3.78Å; Y744-A776 HydrophobicContact CG-CB 4.07Å; A776-I778 HydrophobicContact CB-CD1 4.34Å; A776-I778 HydrophobicContact CB-CG1 4.14Å
777	V	85.9	Confident	79.1	Confident	56 Å²	56	57.7 Å²	57.7	34%	0.339	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	112	158.3	176.2	0	0	0	0	107.9	R788 V790	V777-R788 PolarHBondContact N-O 3.43Å; V777-R788 PolarHBondContact O-N 2.7Å; V777-V790 HydrophobicContact CB-CG2 4.35Å; V777-V790 HydrophobicContact CG2-CG2 3.59Å
778	I	81.7	Confident	79.4	Confident	39 Å²	39	63.9 Å²	63.9	20%	0.2	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	127.4	-176.2	-60.6	172.7	0	0	0	109.8	E740 A776 K786	E740-I778 HydrophobicContact CB-CD1 3.34Å; E740-I778 HydrophobicContact CG-CD1 3.43Å; E740-I778 VanDerWaalsContact CG-CD1 3.43Å; A776-I778 HydrophobicContact CB-CD1 4.34Å; A776-I778 HydrophobicContact CB-CG1 4.14Å; I778-K786 CarbonylContact C-O 3.35Å; I778-K786 VanDerWaalsContact CA-O 3.27Å; I778-K786 WeakPolarHBondContact CA-O 3.4Å
779	R	75	Confident	79.7	Confident	112 Å²	112	63.8 Å²	63.8	42%	0.423	32%	0.319	S	S	.	.			trans	-116.4	96.7	-180	-74.3	-164	-169.2	-176.1	6	109.5	D781 K782 K786	R779-D781 WeakPolarHBondContact CB-OD1 3.48Å; R779-D781 PolarHBondContact O-N 2.82Å; R779-K782 HydrophobicContact CB-CB 4.46Å; R779-K782 HydrophobicContact CB-CG 4.15Å; R779-K782 PolarHBondContact O-N 2.93Å; R779-K782 VanDerWaalsContact O-N 3.14Å; R779-K786 PolarHBondContact N-O 3.12Å
780	H	70.1	Confident	79.8	Confident	139 Å²	139	64.5 Å²	64.5	64%	0.644	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-20.8	-179.8	-61.7	-80.1	0	0	0	113.2	K782	H780-K782 VanDerWaalsContact C-N 3.26Å; H780-K782 PolarHBondContact O-N 3.17Å
781	D	61.9	Low	79.7	Confident	117 Å²	117	66.3 Å²	66.3	63%	0.626	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-11.9	175.9	64.6	-63.8	0	0	0	113.9	R779	R779-D781 WeakPolarHBondContact CB-OD1 3.48Å; R779-D781 PolarHBondContact O-N 2.82Å
782	K	62.3	Low	79.4	Confident	100 Å²	100	67.6 Å²	67.6	44%	0.435	34%	0.342	S	S	.	.			trans	-101.7	132	179.3	-63.9	-62.8	176.5	-173.4	0	110.6	R779 H780 K786	R779-K782 HydrophobicContact CB-CB 4.46Å; R779-K782 HydrophobicContact CB-CG 4.15Å; R779-K782 PolarHBondContact O-N 2.93Å; R779-K782 VanDerWaalsContact O-N 3.14Å; H780-K782 VanDerWaalsContact C-N 3.26Å; H780-K782 PolarHBondContact O-N 3.17Å; K782-K786 WeakPolarHBondContact O-CE 3.26Å; K782-K786 WeakPolarHBondContact O-CG 3.41Å
783	T	52	Low	78.9	Confident	131 Å²	131	67.6 Å²	67.6	80%	0.804	34%	0.344	S	S	*	.	S	Bend	trans	-81.6	-42.9	179.1	37.5	0	0	0	0	112.7
784	T	53.2	Low	78.5	Confident	126 Å²	126	70.9 Å²	70.9	77%	0.773	37%	0.367	S	S	*	.	S	Bend	trans	-97.2	-28.3	-170	54.9	0	0	0	0	115.3
785	T	58.2	Low	78.2	Confident	61 Å²	61	70.4 Å²	70.4	37%	0.374	37%	0.366	S	S	.	.			trans	-132.1	62.1	-176.8	-14.9	0	0	0	0	110.3	C787	T785-C787 VanDerWaalsContact C-N 3.28Å; T785-C787 PolarHBondContact O-N 3.38Å
786	K	66.9	Low	78.2	Confident	109 Å²	109	71.6 Å²	71.6	47%	0.474	37%	0.367	S	S	.	.			trans	-61	-35.9	-176.7	-77.3	-179.8	-179.6	-179	0	112.6	I778 R779 K782	I778-K786 CarbonylContact C-O 3.35Å; I778-K786 VanDerWaalsContact CA-O 3.27Å; I778-K786 WeakPolarHBondContact CA-O 3.4Å; R779-K786 PolarHBondContact N-O 3.12Å; K782-K786 WeakPolarHBondContact O-CE 3.26Å; K782-K786 WeakPolarHBondContact O-CG 3.41Å
787	C	81.8	Confident	78.3	Confident	16 Å²	16	73.3 Å²	73.3	11%	0.108	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	131.5	-176.1	-171.2	0	0	0	0	110.9	A743 T785	A743-C787 HydrophobicContact CB-CB 4.22Å; A743-C787 WeakPolarHBondContact O-CB 3.32Å; A743-C787 PolarHBondContact O-SG 2.97Å; T785-C787 VanDerWaalsContact C-N 3.28Å; T785-C787 PolarHBondContact O-N 3.38Å
788	R	84.8	Confident	78.4	Confident	146 Å²	146	78.1 Å²	78.1	55%	0.551	39%	0.386	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120	127.8	165.2	-69.1	-173.5	179	-158.8	-3.2	109.2	V777	V777-R788 PolarHBondContact N-O 3.43Å; V777-R788 PolarHBondContact O-N 2.7Å
789	I	90.2	Very high	78.4	Confident	14 Å²	14	79 Å²	79	7%	0.072	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	125.5	177	-47.9	-61.2	0	0	0	108.9	Y744 M748 Y751 H774 F791	Y744-I789 HydrophobicContact CD2-CD1 3.33Å; Y744-I789 HydrophobicContact CE2-CD1 3.28Å; Y744-I789 HydrophobicContact CE2-CG2 4.34Å; Y744-I789 HydrophobicContact CG-CD1 4.42Å; M748-I789 HydrophobicContact CE-CG2 3.43Å; M748-I789 VanDerWaalsContact CE-CG2 3.43Å; M748-I789 HydrophobicContact CG-CD1 4.31Å; M748-I789 HydrophobicContact SD-CG2 4.13Å; Y751-I789 HydrophobicContact CD2-CG1 4.49Å; Y751-I789 HydrophobicContact CE2-CB 4.16Å; Y751-I789 HydrophobicContact CE2-CG1 3.9Å; H774-I789 HydrophobicContact CB-CG2 4.3Å; I789-F791 HydrophobicContact CB-CE2 4.26Å; I789-F791 HydrophobicContact CG2-CD2 4.29Å; I789-F791 HydrophobicContact CG2-CE1 4.49Å; I789-F791 HydrophobicContact CG2-CE2 3.71Å; I789-F791 HydrophobicContact CG2-CZ 3.83Å
790	V	90.4	Very high	79	Confident	54 Å²	54	76 Å²	76	33%	0.327	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	113.8	178.3	179.5	0	0	0	0	109.5	H774 H775 V777	H774-V790 VanDerWaalsContact CA-O 3.27Å; H774-V790 WeakPolarHBondContact CA-O 3.47Å; H775-V790 PolarHBondContact N-O 3.31Å; H775-V790 VanDerWaalsContact N-O 3.1Å; H775-V790 PolarHBondContact ND1-O 3.23Å; H775-V790 PolarHBondContact O-N 3.34Å; V777-V790 HydrophobicContact CB-CG2 4.35Å; V777-V790 HydrophobicContact CG2-CG2 3.59Å
791	F	93.3	Very high	79.9	Confident	38 Å²	38	69.4 Å²	69.4	17%	0.167	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	116.2	171.5	-63	-87.9	0	0	0	109.9	M748 Y751 L772 H774 I789 G793 Y853 F869	M748-F791 HydrophobicContact CE-CE1 4.3Å; M748-F791 HydrophobicContact CE-CZ 4.18Å; M748-F791 HydrophobicContact SD-CZ 4.45Å; Y751-F791 HydrophobicContact CD1-CE2 4.28Å; Y751-F791 HydrophobicContact CD1-CZ 4.41Å; Y751-F791 AromaticContact CE1-CE2 3.63Å; Y751-F791 HydrophobicContact CE1-CE2 3.63Å; Y751-F791 HydrophobicContact CE1-CZ 4.21Å; L772-F791 HydrophobicContact CB-CB 4.17Å; L772-F791 HydrophobicContact CB-CD1 4.21Å; L772-F791 HydrophobicContact CD1-CB 3.98Å; H774-F791 HydrophobicContact CB-CD1 3.94Å; H774-F791 HydrophobicContact CB-CE1 4.08Å; I789-F791 HydrophobicContact CB-CE2 4.26Å; I789-F791 HydrophobicContact CG2-CD2 4.29Å; I789-F791 HydrophobicContact CG2-CE1 4.49Å; I789-F791 HydrophobicContact CG2-CE2 3.71Å; I789-F791 HydrophobicContact CG2-CZ 3.83Å; F791-G793 PolarHBondContact O-N 2.86Å; F791-Y853 HydrophobicContact CD1-CD1 4.47Å; F791-Y853 HydrophobicContact CD1-CG 4.42Å; F791-Y853 AromaticContact CE1-CD1 3.69Å; F791-Y853 HydrophobicContact CE1-CD1 3.69Å; F791-Y853 HydrophobicContact CE1-CD2 4.06Å; F791-Y853 HydrophobicContact CE1-CE1 4.07Å; F791-Y853 HydrophobicContact CE1-CE2 4.4Å; F791-Y853 AromaticContact CE1-CG 3.68Å; F791-Y853 HydrophobicContact CE1-CG 3.68Å; F791-Y853 HydrophobicContact CZ-CD1 4.38Å; F791-Y853 HydrophobicContact CZ-CE1 4.32Å; F791-F869 HydrophobicContact CD2-CZ 4.01Å; F791-F869 AromaticContact CE2-CZ 3.8Å; F791-F869 HydrophobicContact CE2-CZ 3.8Å; F791-F869 HydrophobicContact CG-CZ 4.48Å; F791-F869 HydrophobicContact CZ-CZ 4.1Å
792	D	91.1	Very high	81.3	Confident	37 Å²	37	64.1 Å²	64.1	20%	0.198	34%	0.34	C	S	.	.			trans	-82.9	77.6	-172.5	-174.7	6.9	0	0	0	111.9	R726 P773 S794 S795	R726-D792 IonicContact CZ-OD2 3.96Å; R726-D792 IonicContact NH1-OD2 2.7Å; R726-D792 IonicContact NH2-OD2 3.75Å; R726-D792 PolarHBondContact NH2-OD2 3.5Å; P773-D792 WeakPolarHBondContact O-CB 3.36Å; P773-D792 PolarHBondContact O-N 3.28Å; D792-S794 PolarHBondContact O-N 3.36Å; D792-S794 VanDerWaalsContact O-N 3.16Å; D792-S794 PolarHBondContact OD1-N 3.11Å; D792-S795 WeakPolarHBondContact O-CB 3.43Å; D792-S795 PolarHBondContact O-N 2.82Å; D792-S795 VanDerWaalsContact O-N 3.15Å; D792-S795 PolarHBondContact OD1-N 3Å; D792-S795 VanDerWaalsContact OD1-N 3.12Å
793	G	85.4	Confident	82.5	Confident	10 Å²	10	62.9 Å²	62.9	10%	0.103	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-9.8	172.9	0	0	0	0	0	114.8	F791 N803	F791-G793 PolarHBondContact O-N 2.86Å; G793-N803 PolarHBondContact O-N 3.11Å
794	S	87.9	Confident	84.1	Confident	75 Å²	75	59.5 Å²	59.5	52%	0.524	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-6.2	176.5	-59	0	0	0	0	112.9	D792 R796 N803	D792-S794 PolarHBondContact O-N 3.36Å; D792-S794 VanDerWaalsContact O-N 3.16Å; D792-S794 PolarHBondContact OD1-N 3.11Å; S794-R796 PolarHBondContact O-N 3.1Å; S794-N803 PolarHBondContact OG-ND2 2.78Å
795	S	90	Very high	85.8	Confident	6 Å²	6	55.1 Å²	55.1	4%	0.042	29%	0.287	C	S	.	.			trans	-60.4	123.4	177.2	-173.6	0	0	0	0	110.3	Q722 R726 W770 D792 A801	Q722-S795 PolarHBondContact OE1-OG 3.03Å; R726-S795 PolarHBondContact NH2-OG 3.26Å; R726-S795 VanDerWaalsContact NH2-OG 3.07Å; W770-S795 WeakPolarHBondContact CZ2-O 3.45Å; D792-S795 WeakPolarHBondContact O-CB 3.43Å; D792-S795 PolarHBondContact O-N 2.82Å; D792-S795 VanDerWaalsContact O-N 3.15Å; D792-S795 PolarHBondContact OD1-N 3Å; D792-S795 VanDerWaalsContact OD1-N 3.12Å; S795-A801 WeakPolarHBondContact O-CB 3.23Å
796	R	90.9	Very high	87.2	Confident	99 Å²	99	53.2 Å²	53.2	37%	0.374	27%	0.274	S	S	.	.			trans	-92.9	137.1	-179.5	-70.8	177.6	-178.1	-82	-16.2	111.7	Q722 S794 G799 V800 A801 D804	Q722-R796 PolarHBondContact NE2-O 3.41Å; S794-R796 PolarHBondContact O-N 3.1Å; R796-G799 PolarHBondContact NH1-O 2.69Å; R796-V800 CarbonylContact C-O 3.55Å; R796-V800 VanDerWaalsContact CA-O 3.24Å; R796-V800 WeakPolarHBondContact CA-O 3.43Å; R796-A801 HydrophobicContact CG-CB 3.82Å; R796-D804 IonicContact CZ-OD1 2.62Å; R796-D804 IonicContact CZ-OD2 3.33Å; R796-D804 IonicContact NH1-OD1 3.47Å; R796-D804 IonicContact NH1-OD2 3.6Å; R796-D804 PolarHBondContact NH1-OD2 3.28Å; R796-D804 VanDerWaalsContact NH2-CG 3.3Å; R796-D804 IonicContact NH2-OD1 3.21Å; R796-D804 PolarHBondContact NH2-OD1 3.37Å; R796-D804 IonicContact NH2-OD2 3.32Å; R796-D804 PolarHBondContact NH2-OD2 3.04Å
797	Y	91.4	Very high	87.9	Confident	54 Å²	54	51 Å²	51	21%	0.212	27%	0.266	C	S	.	.	B	Isolated β-bridge	trans	-137.1	133.3	169.8	176.4	-105.7	0	0	0	109.6	P717 N718 N719 Q722 W770 G799 V800	P717-Y797 HydrophobicContact CB-CD1 4.22Å; P717-Y797 HydrophobicContact CB-CE1 4.16Å; P717-Y797 HydrophobicContact CG-CD1 3.98Å; P717-Y797 HydrophobicContact CG-CE1 4.4Å; N718-Y797 WeakPolarHBondContact O-CE1 3.16Å; N718-Y797 PolarHBondContact O-OH 3.03Å; N719-Y797 HydrophobicContact CB-CD1 3.34Å; N719-Y797 HydrophobicContact CB-CD2 4.17Å; N719-Y797 HydrophobicContact CB-CE1 3.95Å; N719-Y797 HydrophobicContact CB-CG 3.44Å; N719-Y797 VanDerWaalsContact CB-CG 3.44Å; Q722-Y797 HydrophobicContact CB-CD2 4.02Å; Q722-Y797 HydrophobicContact CB-CE2 4.47Å; W770-Y797 HydrophobicContact CZ3-CD1 4.42Å; Y797-G799 PolarHBondContact O-N 2.85Å; Y797-G799 VanDerWaalsContact O-N 3.09Å; Y797-V800 PolarHBondContact N-O 3.45Å; Y797-V800 WeakPolarHBondContact O-CG2 3.18Å; Y797-V800 PolarHBondContact O-N 3.18Å
798	K	87.7	Confident	87.4	Confident	158 Å²	158	55.3 Å²	55.3	69%	0.687	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.4	37.3	-172.3	-66.3	-177.5	176.2	179.7	0	113.4	P717	P717-K798 HydrophobicContact CB-CD 4.07Å; P717-K798 HydrophobicContact CG-CB 4.11Å; P717-K798 HydrophobicContact CG-CD 4.48Å
799	G	82.6	Confident	86.7	Confident	56 Å²	56	50.7 Å²	50.7	58%	0.577	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.9	-17.2	174.5	0	0	0	0	0	116.1	R796 Y797	R796-G799 PolarHBondContact NH1-O 2.69Å; Y797-G799 PolarHBondContact O-N 2.85Å; Y797-G799 VanDerWaalsContact O-N 3.09Å
800	V	87.6	Confident	85.6	Confident	49 Å²	49	51.8 Å²	51.8	30%	0.297	31%	0.308	S	S	.	.	B	Isolated β-bridge	trans	-111.8	152.8	-176.3	-62.7	0	0	0	0	111.8	L716 P717 W770 R796 Y797	L716-V800 HydrophobicContact CD2-CB 4.33Å; L716-V800 HydrophobicContact CD2-CG2 3.79Å; P717-V800 VanDerWaalsContact CD-CG2 3.46Å; P717-V800 HydrophobicContact CG-CG2 3.77Å; W770-V800 WeakPolarHBondContact CH2-O 3.38Å; R796-V800 CarbonylContact C-O 3.55Å; R796-V800 VanDerWaalsContact CA-O 3.24Å; R796-V800 WeakPolarHBondContact CA-O 3.43Å; Y797-V800 PolarHBondContact N-O 3.45Å; Y797-V800 WeakPolarHBondContact O-CG2 3.18Å; Y797-V800 PolarHBondContact O-N 3.18Å
801	A	89.4	Confident	84.4	Confident	1 Å²	1	55.5 Å²	55.5	1%	0.008	33%	0.333	C	S	.	.			trans	-128	158.2	167.2	0	0	0	0	0	109.7	S795 R796 N803 D804	S795-A801 WeakPolarHBondContact O-CB 3.23Å; R796-A801 HydrophobicContact CG-CB 3.82Å; A801-N803 VanDerWaalsContact C-N 3.3Å; A801-N803 PolarHBondContact O-N 2.97Å; A801-D804 PolarHBondContact N-OD2 3.22Å; A801-D804 WeakPolarHBondContact O-CB 3.49Å; A801-D804 PolarHBondContact O-N 2.94Å
802	L	90.2	Very high	83.3	Confident	6 Å²	6	59.4 Å²	59.4	3%	0.031	36%	0.355	C	S	.	.	H	α-helix	trans	-54.5	-47.4	177	178.5	63.1	0	0	0	111.5	W710 L716 L772 D804 L805 L806 F850 V851	W710-L802 HydrophobicContact CH2-CD1 3.84Å; W710-L802 HydrophobicContact CZ3-CD1 4.11Å; L716-L802 HydrophobicContact CD1-CB 4.43Å; L716-L802 HydrophobicContact CD1-CD1 3.7Å; L772-L802 HydrophobicContact CD2-CD2 4Å; L802-D804 PolarHBondContact O-N 2.91Å; L802-D804 VanDerWaalsContact O-N 3.09Å; L802-L805 PolarHBondContact O-N 2.83Å; L802-L806 HydrophobicContact CD1-CD1 4.34Å; L802-L806 HydrophobicContact CD1-CG 4.44Å; L802-L806 HydrophobicContact CD2-CD1 4.48Å; L802-L806 HydrophobicContact CG-CD1 3.99Å; L802-L806 HydrophobicContact CG-CG 4.43Å; L802-L806 PolarHBondContact O-N 3.17Å; L802-F850 HydrophobicContact CD1-CB 4.21Å; L802-V851 HydrophobicContact CD2-CG1 4.13Å
803	N	88.5	Confident	82.4	Confident	74 Å²	74	63.3 Å²	63.3	40%	0.396	37%	0.373	S	S	.	.	H	α-helix	trans	-61.3	-20.2	179.4	-71.5	-9.5	0	0	0	114.2	G793 S794 A801 L805	G793-N803 PolarHBondContact O-N 3.11Å; S794-N803 PolarHBondContact OG-ND2 2.78Å; A801-N803 VanDerWaalsContact C-N 3.3Å; A801-N803 PolarHBondContact O-N 2.97Å; N803-L805 VanDerWaalsContact C-N 3.27Å
804	D	85.5	Confident	81.9	Confident	60 Å²	60	64.3 Å²	64.3	32%	0.321	38%	0.38	S	S	.	.	H	α-helix	trans	-70.5	-27.8	175	-65.2	-38.9	0	0	0	111.8	K711 R796 A801 L802	K711-D804 WeakPolarHBondContact CD-O 3.37Å; K711-D804 PolarHBondContact NZ-O 3.29Å; R796-D804 IonicContact CZ-OD1 2.62Å; R796-D804 IonicContact CZ-OD2 3.33Å; R796-D804 IonicContact NH1-OD1 3.47Å; R796-D804 IonicContact NH1-OD2 3.6Å; R796-D804 PolarHBondContact NH1-OD2 3.28Å; R796-D804 VanDerWaalsContact NH2-CG 3.3Å; R796-D804 IonicContact NH2-OD1 3.21Å; R796-D804 PolarHBondContact NH2-OD1 3.37Å; R796-D804 IonicContact NH2-OD2 3.32Å; R796-D804 PolarHBondContact NH2-OD2 3.04Å; A801-D804 PolarHBondContact N-OD2 3.22Å; A801-D804 WeakPolarHBondContact O-CB 3.49Å; A801-D804 PolarHBondContact O-N 2.94Å; L802-D804 PolarHBondContact O-N 2.91Å; L802-D804 VanDerWaalsContact O-N 3.09Å
805	L	88.1	Confident	81.4	Confident	34 Å²	34	65.8 Å²	65.8	18%	0.178	38%	0.382	C	S	.	.	H	α-helix	trans	-92.2	-7.7	-178.7	-57.7	-176.9	0	0	0	113.6	W710 K711 L716 L802 N803	W710-L805 HydrophobicContact CE3-CB 4.06Å; W710-L805 HydrophobicContact CZ3-CB 3.9Å; W710-L805 HydrophobicContact CZ3-CD1 4.23Å; K711-L805 WeakPolarHBondContact CB-O 3.28Å; K711-L805 PolarHBondContact N-O 3.06Å; L716-L805 HydrophobicContact CD1-CD1 3.9Å; L716-L805 HydrophobicContact CD2-CD1 3.52Å; L716-L805 HydrophobicContact CD2-CG 4.4Å; L716-L805 HydrophobicContact CG-CD1 3.45Å; L716-L805 VanDerWaalsContact CG-CD1 3.45Å; L802-L805 PolarHBondContact O-N 2.83Å; N803-L805 VanDerWaalsContact C-N 3.27Å
806	L	88.2	Confident	81	Confident	22 Å²	22	68.3 Å²	68.3	12%	0.115	39%	0.394	C	S	.	.	B	Isolated β-bridge	trans	-103.8	144.9	-179.7	-58.1	-176.9	0	0	0	111.7	L708 P709 W710 K711 L802	L708-L806 HydrophobicContact CB-CD2 3.81Å; L708-L806 HydrophobicContact CD1-CD2 4.5Å; L708-L806 HydrophobicContact CD2-CD1 4.23Å; P709-L806 HydrophobicContact CG-CB 4.42Å; P709-L806 CarbonylContact O-C 3.44Å; P709-L806 WeakPolarHBondContact O-CA 3.42Å; W710-L806 HydrophobicContact CD2-CD2 3.98Å; W710-L806 HydrophobicContact CE3-CD2 3.69Å; W710-L806 HydrophobicContact CH2-CD2 4.29Å; W710-L806 HydrophobicContact CZ3-CD2 3.86Å; K711-L806 WeakPolarHBondContact CE-O 3.28Å; K711-L806 PolarHBondContact NZ-O 3.07Å; L802-L806 HydrophobicContact CD1-CD1 4.34Å; L802-L806 HydrophobicContact CD1-CG 4.44Å; L802-L806 HydrophobicContact CD2-CD1 4.48Å; L802-L806 HydrophobicContact CG-CD1 3.99Å; L802-L806 HydrophobicContact CG-CG 4.43Å; L802-L806 PolarHBondContact O-N 3.17Å
807	E	81.1	Confident	80.5	Confident	62 Å²	62	67.7 Å²	67.7	29%	0.29	40%	0.402	S	S	.	.			trans	-77.6	142	170.3	-67.5	-69	-169.7	0	0	111	P709 K711 G809	P709-E807 HydrophobicContact CB-CB 4.26Å; P709-E807 PolarHBondContact O-N 2.97Å; K711-E807 WeakPolarHBondContact CE-OE2 2.87Å; K711-E807 HydrophobicContact CG-CG 3.66Å; K711-E807 WeakPolarHBondContact CG-OE1 3.31Å; E807-G809 VanDerWaalsContact C-N 3.27Å
808	A	72.1	Confident	80.1	Confident	106 Å²	106	65.7 Å²	65.7	88%	0.876	40%	0.397	S	S	*	.			trans	-74.8	-20.9	175.8	0	0	0	0	0	112.6
809	G	69.4	Low	80.1	Confident	49 Å²	49	58.1 Å²	58.1	51%	0.505	36%	0.364	S	S	.	.			trans	73	165.6	-173	0	0	0	0	0	113.5	E807	E807-G809 VanDerWaalsContact C-N 3.27Å
810	P	67.6	Low	80.3	Confident	38 Å²	38	56.8 Å²	56.8	25%	0.247	34%	0.343	C	S	.	.			trans	-75.3	158.8	174.4	30.7	-33.6	0	0	0	112	A686 L690 L812	A686-P810 HydrophobicContact CB-CB 4.24Å; L690-P810 HydrophobicContact CB-CG 4.24Å; L690-P810 HydrophobicContact CD2-CG 4.06Å; P810-L812 HydrophobicContact CG-CD2 4.17Å; P810-L812 HydrophobicContact CG-CG 4.34Å; P810-L812 PolarHBondContact O-N 3.25Å; P810-L812 VanDerWaalsContact O-N 3.11Å
811	P	65	Low	80.3	Confident	131 Å²	131	60.2 Å²	60.2	85%	0.851	36%	0.36	S	S	*	.			trans	-68.2	108.1	171.2	28.4	-32.6	0	0	0	110.3
812	L	69.3	Low	80.4	Confident	121 Å²	121	62.8 Å²	62.8	63%	0.634	37%	0.369	S	S	*	.			trans	-100.5	-1.8	178.4	-64.5	178.6	0	0	0	114	L690 P810	L690-L812 HydrophobicContact CD1-CD1 3.86Å; L690-L812 HydrophobicContact CD2-CD1 3.99Å; L690-L812 HydrophobicContact CD2-CD2 3.75Å; L690-L812 HydrophobicContact CD2-CG 4.42Å; P810-L812 HydrophobicContact CG-CD2 4.17Å; P810-L812 HydrophobicContact CG-CG 4.34Å; P810-L812 PolarHBondContact O-N 3.25Å; P810-L812 VanDerWaalsContact O-N 3.11Å
813	Q	73.4	Confident	80.5	Confident	119 Å²	119	62.5 Å²	62.5	56%	0.556	37%	0.368	S	S	*	.	P	Polyproline II helix	trans	-70.8	138.1	-176.2	-65	171.7	2.1	0	0	110.4	Y892 V893	Q813-Y892 HydrophobicContact CB-CD2 4.41Å; Q813-Y892 HydrophobicContact CB-CE2 3.98Å; Q813-Y892 PolarHBondContact OE1-OH 3.42Å; Q813-Y892 VanDerWaalsContact OE1-OH 3.13Å; Q813-V893 HydrophobicContact CG-CG2 4.31Å
814	A	73	Confident	80.6	Confident	31 Å²	31	64.1 Å²	64.1	26%	0.256	37%	0.368	S	S	.	.	P	Polyproline II helix	trans	-66.7	149.6	173.4	0	0	0	0	0	110.9	L816 I819	A814-L816 PolarHBondContact O-N 3.21Å; A814-I819 HydrophobicContact CB-CD1 3.89Å; A814-I819 HydrophobicContact CB-CG1 4.26Å
815	D	77.4	Confident	80.8	Confident	106 Å²	106	66.4 Å²	66.4	57%	0.567	37%	0.372	S	S	*	.	P	Polyproline II helix	trans	-59.4	118	179.9	173.8	57.5	0	0	0	111.4	V817 G818 I819	D815-V817 VanDerWaalsContact C-N 3.28Å; D815-V817 PolarHBondContact O-N 3.08Å; D815-G818 WeakPolarHBondContact O-CA 3.19Å; D815-G818 PolarHBondContact O-N 2.81Å; D815-G818 VanDerWaalsContact O-N 3.11Å; D815-G818 WeakPolarHBondContact OD2-CA 3.37Å; D815-G818 PolarHBondContact OD2-N 2.89Å; D815-I819 WeakPolarHBondContact O-CG1 3.29Å; D815-I819 PolarHBondContact O-N 3.44Å
816	L	81.5	Confident	81	Confident	58 Å²	58	67.9 Å²	67.9	30%	0.304	38%	0.377	S	S	.	.	H	α-helix	trans	-58.2	-40.8	-173.9	-160.8	96.9	0	0	0	111.7	A814 I819 L820 Y892 L953	A814-L816 PolarHBondContact O-N 3.21Å; L816-I819 PolarHBondContact O-N 3.4Å; L816-L820 WeakPolarHBondContact O-CG 3.34Å; L816-L820 PolarHBondContact O-N 3.12Å; L816-Y892 HydrophobicContact CD1-CD1 4.13Å; L816-Y892 HydrophobicContact CD1-CD2 3.84Å; L816-Y892 HydrophobicContact CD1-CE1 3.85Å; L816-Y892 HydrophobicContact CD1-CE2 3.52Å; L816-Y892 HydrophobicContact CD1-CG 4.12Å; L816-L953 HydrophobicContact CD1-CB 4.16Å; L816-L953 HydrophobicContact CD1-CD1 4.27Å; L816-L953 HydrophobicContact CD1-CD2 4.41Å; L816-L953 HydrophobicContact CG-CB 4.49Å; L816-L953 HydrophobicContact CG-CD1 4.35Å
817	V	81.8	Confident	81.2	Confident	87 Å²	87	75.1 Å²	75.1	53%	0.527	41%	0.408	S	S	.	.	H	α-helix	trans	-66.1	-44.2	179.1	178.4	0	0	0	0	110.2	D815 I819 L820 L821	D815-V817 VanDerWaalsContact C-N 3.28Å; D815-V817 PolarHBondContact O-N 3.08Å; V817-I819 VanDerWaalsContact C-N 3.3Å; V817-I819 PolarHBondContact O-N 2.87Å; V817-L820 PolarHBondContact O-N 3.38Å; V817-L821 HydrophobicContact CG1-CD1 4.1Å; V817-L821 HydrophobicContact CG1-CG 4.4Å; V817-L821 WeakPolarHBondContact O-CG 3.33Å; V817-L821 PolarHBondContact O-N 2.95Å
818	G	82.2	Confident	81.7	Confident	11 Å²	11	72.8 Å²	72.8	11%	0.113	40%	0.398	C	S	.	.	H	α-helix	trans	-57.3	-41.3	174.4	0	0	0	0	0	112.8	D815 R822	D815-G818 WeakPolarHBondContact O-CA 3.19Å; D815-G818 PolarHBondContact O-N 2.81Å; D815-G818 VanDerWaalsContact O-N 3.11Å; D815-G818 WeakPolarHBondContact OD2-CA 3.37Å; D815-G818 PolarHBondContact OD2-N 2.89Å; G818-R822 VanDerWaalsContact C-CZ 3.43Å; G818-R822 VanDerWaalsContact C-NH1 3.3Å; G818-R822 WeakPolarHBondContact O-CG 3.38Å; G818-R822 VanDerWaalsContact O-CZ 3.22Å; G818-R822 PolarHBondContact O-N 3.44Å; G818-R822 PolarHBondContact O-NH1 2.94Å; G818-R822 VanDerWaalsContact O-NH1 3.08Å
819	I	88	Confident	82.7	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-65	-48.6	176.5	-59.7	170.5	0	0	0	110.3	A814 D815 L816 V817 L821 R822 F823 Y892 V897 L953	A814-I819 HydrophobicContact CB-CD1 3.89Å; A814-I819 HydrophobicContact CB-CG1 4.26Å; D815-I819 WeakPolarHBondContact O-CG1 3.29Å; D815-I819 PolarHBondContact O-N 3.44Å; L816-I819 PolarHBondContact O-N 3.4Å; V817-I819 VanDerWaalsContact C-N 3.3Å; V817-I819 PolarHBondContact O-N 2.87Å; I819-L821 VanDerWaalsContact C-N 3.31Å; I819-L821 PolarHBondContact O-N 3.4Å; I819-R822 CarbonylContact O-C 3.56Å; I819-R822 PolarHBondContact O-N 2.75Å; I819-R822 VanDerWaalsContact O-N 3.09Å; I819-F823 WeakPolarHBondContact O-CB 2.82Å; I819-F823 PolarHBondContact O-N 2.84Å; I819-Y892 HydrophobicContact CD1-CD2 3.94Å; I819-Y892 HydrophobicContact CD1-CG 4.28Å; I819-V897 HydrophobicContact CG2-CB 3.94Å; I819-V897 HydrophobicContact CG2-CG1 4.25Å; I819-L953 HydrophobicContact CB-CD1 4.05Å; I819-L953 HydrophobicContact CG2-CD1 3.71Å
820	L	87.6	Confident	83.9	Confident	27 Å²	27	65.7 Å²	65.7	14%	0.141	33%	0.334	C	S	.	.	H	α-helix	trans	-59.1	-40	177.7	-71.5	171	0	0	0	112.6	L816 V817 F823 R824 L953 I955 L964	L816-L820 WeakPolarHBondContact O-CG 3.34Å; L816-L820 PolarHBondContact O-N 3.12Å; V817-L820 PolarHBondContact O-N 3.38Å; L820-F823 WeakPolarHBondContact O-CB 3.32Å; L820-F823 PolarHBondContact O-N 2.96Å; L820-R824 WeakPolarHBondContact O-CG 3.49Å; L820-R824 PolarHBondContact O-N 3.2Å; L820-L953 HydrophobicContact CD2-CB 4.48Å; L820-L953 HydrophobicContact CD2-CD1 4.05Å; L820-L953 HydrophobicContact CG-CD1 4.13Å; L820-I955 HydrophobicContact CD1-CD1 3.64Å; L820-I955 HydrophobicContact CD2-CD1 4.33Å; L820-L964 HydrophobicContact CD2-CD1 4.4Å
821	L	87.6	Confident	85	Confident	122 Å²	122	64.7 Å²	64.7	64%	0.639	33%	0.326	S	S	*	.	H	α-helix	trans	-65.5	-39.4	175.4	-71.5	173.5	0	0	0	112	V817 I819 F823 R824 R825	V817-L821 HydrophobicContact CG1-CD1 4.1Å; V817-L821 HydrophobicContact CG1-CG 4.4Å; V817-L821 WeakPolarHBondContact O-CG 3.33Å; V817-L821 PolarHBondContact O-N 2.95Å; I819-L821 VanDerWaalsContact C-N 3.31Å; I819-L821 PolarHBondContact O-N 3.4Å; L821-F823 VanDerWaalsContact C-N 3.32Å; L821-R824 PolarHBondContact O-N 3.42Å; L821-R825 PolarHBondContact O-N 3.09Å
822	R	89.8	Confident	86.3	Confident	54 Å²	54	58.7 Å²	58.7	20%	0.204	29%	0.287	C	S	.	.	H	α-helix	trans	-68	-33.1	173.8	-74.9	-174.4	-66.5	-79.1	3	111.9	G818 I819 R825 Q889 N890 S899	G818-R822 VanDerWaalsContact C-CZ 3.43Å; G818-R822 VanDerWaalsContact C-NH1 3.3Å; G818-R822 WeakPolarHBondContact O-CG 3.38Å; G818-R822 VanDerWaalsContact O-CZ 3.22Å; G818-R822 PolarHBondContact O-N 3.44Å; G818-R822 PolarHBondContact O-NH1 2.94Å; G818-R822 VanDerWaalsContact O-NH1 3.08Å; I819-R822 CarbonylContact O-C 3.56Å; I819-R822 PolarHBondContact O-N 2.75Å; I819-R822 VanDerWaalsContact O-N 3.09Å; R822-R825 VanDerWaalsContact O-CB 3.26Å; R822-R825 WeakPolarHBondContact O-CB 3.35Å; R822-R825 PolarHBondContact O-N 2.88Å; R822-Q889 PolarHBondContact NE-O 2.78Å; R822-Q889 PolarHBondContact NH2-O 3.13Å; R822-N890 VanDerWaalsContact CD-OD1 3.29Å; R822-N890 WeakPolarHBondContact CD-OD1 3.38Å; R822-N890 PolarHBondContact NE-OD1 2.71Å; R822-S899 PolarHBondContact O-OG 3.32Å
823	F	93.5	Very high	87.1	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-67.2	-36.1	175.1	-169.6	-122.1	0	0	0	112.8	I819 L820 L821 R825 A829 V897 S898 S899 T952 W957	I819-F823 WeakPolarHBondContact O-CB 2.82Å; I819-F823 PolarHBondContact O-N 2.84Å; L820-F823 WeakPolarHBondContact O-CB 3.32Å; L820-F823 PolarHBondContact O-N 2.96Å; L821-F823 VanDerWaalsContact C-N 3.32Å; F823-R825 VanDerWaalsContact C-N 3.32Å; F823-A829 HydrophobicContact CD2-CB 4.29Å; F823-A829 HydrophobicContact CE1-CB 4.42Å; F823-A829 HydrophobicContact CE2-CB 3.71Å; F823-A829 HydrophobicContact CZ-CB 3.79Å; F823-V897 HydrophobicContact CB-CG1 3.81Å; F823-V897 HydrophobicContact CD1-CG1 3.98Å; F823-V897 HydrophobicContact CD2-CB 4.4Å; F823-V897 HydrophobicContact CD2-CG1 3.25Å; F823-V897 HydrophobicContact CE1-CG1 4.35Å; F823-V897 HydrophobicContact CE2-CG1 3.69Å; F823-V897 HydrophobicContact CG-CG1 3.41Å; F823-V897 VanDerWaalsContact CG-CG1 3.41Å; F823-V897 HydrophobicContact CZ-CG1 4.21Å; F823-S898 WeakPolarHBondContact CD2-O 3.48Å; F823-S898 WeakPolarHBondContact CE2-O 3.48Å; F823-S899 WeakPolarHBondContact O-CB 3.17Å; F823-S899 PolarHBondContact O-OG 3.31Å; F823-T952 HydrophobicContact CD1-CG2 4.28Å; F823-T952 HydrophobicContact CE1-CG2 3.97Å; F823-T952 HydrophobicContact CZ-CG2 4.34Å; F823-W957 AromaticContact CE1-CD2 3.9Å; F823-W957 HydrophobicContact CE1-CD2 3.9Å; F823-W957 AromaticContact CE1-CE2 3.93Å; F823-W957 HydrophobicContact CE1-CE3 4.12Å; F823-W957 HydrophobicContact CE1-CG 4.33Å; F823-W957 HydrophobicContact CE1-CH2 4.46Å; F823-W957 HydrophobicContact CE1-CZ2 4.21Å; F823-W957 HydrophobicContact CE1-CZ3 4.42Å; F823-W957 HydrophobicContact CE2-CH2 4.49Å; F823-W957 AromaticContact CZ-CD2 3.96Å; F823-W957 HydrophobicContact CZ-CD2 3.96Å; F823-W957 AromaticContact CZ-CE2 3.94Å; F823-W957 AromaticContact CZ-CE3 3.78Å; F823-W957 HydrophobicContact CZ-CE3 3.78Å; F823-W957 AromaticContact CZ-CH2 3.66Å; F823-W957 HydrophobicContact CZ-CH2 3.66Å; F823-W957 AromaticContact CZ-CZ2 3.8Å; F823-W957 HydrophobicContact CZ-CZ2 3.8Å; F823-W957 AromaticContact CZ-CZ3 3.66Å; F823-W957 HydrophobicContact CZ-CZ3 3.66Å
824	R	90.2	Very high	87.6	Confident	109 Å²	109	48.2 Å²	48.2	41%	0.411	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.7	0	176	-63.7	-60.9	-62.9	138.8	-7.5	114.2	L820 L821 D962 L964	L820-R824 WeakPolarHBondContact O-CG 3.49Å; L820-R824 PolarHBondContact O-N 3.2Å; L821-R824 PolarHBondContact O-N 3.42Å; R824-D962 IonicContact CZ-OD2 3.74Å; R824-D962 PolarHBondContact NH1-O 3.11Å; R824-D962 IonicContact NH1-OD1 2.72Å; R824-D962 PolarHBondContact NH1-OD1 2.78Å; R824-D962 IonicContact NH1-OD2 2.93Å; R824-D962 PolarHBondContact NH1-OD2 3.47Å; R824-D962 PolarHBondContact NH2-O 3.39Å; R824-D962 VanDerWaalsContact NH2-O 3.11Å; R824-D962 IonicContact NH2-OD2 3.11Å; R824-L964 HydrophobicContact CG-CD1 4.04Å
825	R	89.9	Confident	88.1	Confident	107 Å²	107	49.6 Å²	49.6	40%	0.404	24%	0.237	S	C	.	.	S	Bend	trans	-72.5	-38.1	-169.7	-176.3	172.4	59.2	-175.8	1.8	113.1	L821 R822 F823	L821-R825 PolarHBondContact O-N 3.09Å; R822-R825 VanDerWaalsContact O-CB 3.26Å; R822-R825 WeakPolarHBondContact O-CB 3.35Å; R822-R825 PolarHBondContact O-N 2.88Å; F823-R825 VanDerWaalsContact C-N 3.32Å
826	F	93.1	Very high	88.2	Confident	65 Å²	65	47.9 Å²	47.9	29%	0.285	22%	0.224	S	C	.	.	S	Bend	trans	-128.5	168.5	-173.4	-54.3	-59.7	0	0	0	112.3	S899 Y900 C901	F826-S899 WeakPolarHBondContact CD2-O 3.33Å; F826-S899 PolarHBondContact N-OG 2.96Å; F826-Y900 WeakPolarHBondContact CB-O 3.46Å; F826-C901 WeakPolarHBondContact CD1-SG 3.28Å; F826-C901 WeakPolarHBondContact CE1-SG 3.35Å
827	K	90.7	Very high	88.2	Confident	174 Å²	174	46.7 Å²	46.7	76%	0.757	22%	0.218	S	C	*	.	S	Bend	trans	-71.1	-35	-166.6	-67.1	-177.4	178.7	-178.7	0	113.8	Y900 N930	K827-Y900 PolarHBondContact N-O 3.06Å; K827-N930 PolarHBondContact O-ND2 3.09Å
828	V	93	Very high	88.1	Confident	14 Å²	14	49.1 Å²	49.1	9%	0.085	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	102.8	-176.9	-175.5	0	0	0	0	108.2	V830 S899 Y900 A906 C931 A934	V828-V830 HydrophobicContact CG1-CG2 4.24Å; V828-S899 CarbonylContact O-C 3.56Å; V828-S899 WeakPolarHBondContact O-CA 3.39Å; V828-S899 WeakPolarHBondContact O-CB 3.35Å; V828-Y900 PolarHBondContact N-O 3.47Å; V828-Y900 PolarHBondContact O-N 3.24Å; V828-A906 HydrophobicContact CB-CB 4.15Å; V828-A906 HydrophobicContact CG1-CB 3.57Å; V828-C931 HydrophobicContact CG1-CB 3.86Å; V828-A934 HydrophobicContact CG1-CB 4.32Å
829	A	93.6	Very high	88.1	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	131.4	-179.6	0	0	0	0	0	109.6	F823 S929 N930 W957	F823-A829 HydrophobicContact CD2-CB 4.29Å; F823-A829 HydrophobicContact CE1-CB 4.42Å; F823-A829 HydrophobicContact CE2-CB 3.71Å; F823-A829 HydrophobicContact CZ-CB 3.79Å; A829-S929 WeakPolarHBondContact O-CA 3.33Å; A829-S929 WeakPolarHBondContact O-CB 3.41Å; A829-S929 PolarHBondContact O-OG 3.37Å; A829-N930 PolarHBondContact N-OD1 3.42Å; A829-N930 PolarHBondContact O-N 3Å; A829-N930 PolarHBondContact O-OD1 3.02Å; A829-W957 HydrophobicContact CB-CH2 3.98Å; A829-W957 HydrophobicContact CB-CZ2 3.69Å
830	V	92.6	Very high	87.7	Confident	5 Å²	5	51.9 Å²	51.9	3%	0.03	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	133.2	-176.5	-176.1	0	0	0	0	109.4	V828 S898 Y900 A906 W927 T928	V828-V830 HydrophobicContact CG1-CG2 4.24Å; V830-S898 PolarHBondContact N-O 3.04Å; V830-S898 PolarHBondContact O-N 2.86Å; V830-Y900 HydrophobicContact CB-CE2 4.4Å; V830-Y900 HydrophobicContact CG2-CD2 4.3Å; V830-Y900 HydrophobicContact CG2-CE2 4.34Å; V830-A906 HydrophobicContact CG2-CB 4.22Å; V830-W927 HydrophobicContact CG1-CE3 3.71Å; V830-W927 HydrophobicContact CG1-CZ3 3.68Å; V830-T928 WeakPolarHBondContact CA-O 3.23Å
831	Q	92.5	Very high	87.5	Confident	18 Å²	18	53.4 Å²	53.4	8%	0.084	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	152.2	169.7	70.5	174.7	12.3	0	0	112.6	L896 V897 W927 T928 T952 W957	Q831-L896 CarbonylContact C-O 3.54Å; Q831-L896 WeakPolarHBondContact CA-O 3.44Å; Q831-L896 WeakPolarHBondContact CB-O 3.09Å; Q831-V897 HydrophobicContact CB-CG2 4.31Å; Q831-W927 WeakPolarHBondContact O-CA 3.27Å; Q831-T928 PolarHBondContact N-O 3.49Å; Q831-T928 PolarHBondContact O-N 3.37Å; Q831-T952 PolarHBondContact OE1-OG1 3.29Å; Q831-W957 HydrophobicContact CG-CZ3 4.05Å
832	A	91.3	Very high	87.3	Confident	4 Å²	4	47.9 Å²	47.9	3%	0.033	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	159.4	174.2	0	0	0	0	0	110.4	L896 L924 W927	A832-L896 PolarHBondContact N-O 3.08Å; A832-L896 PolarHBondContact O-N 2.7Å; A832-L924 HydrophobicContact CB-CB 4.17Å; A832-L924 HydrophobicContact CB-CD1 4.29Å; A832-L924 HydrophobicContact CB-CD2 4.03Å; A832-L924 HydrophobicContact CB-CG 4.42Å; A832-W927 HydrophobicContact CB-CD2 3.7Å; A832-W927 HydrophobicContact CB-CE3 3.73Å; A832-W927 HydrophobicContact CB-CG 4.32Å; A832-W927 HydrophobicContact CB-CH2 4Å; A832-W927 HydrophobicContact CB-CZ2 3.97Å; A832-W927 HydrophobicContact CB-CZ3 3.87Å
833	D	85.5	Confident	87.1	Confident	19 Å²	19	46.3 Å²	46.3	10%	0.102	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	135.7	-177.3	174.8	57.3	0	0	0	109.5	E835 K925 K926	D833-E835 PolarHBondContact O-N 3.25Å; D833-K925 PolarHBondContact N-O 2.98Å; D833-K925 PolarHBondContact O-N 3.47Å; D833-K926 HydrophobicContact CB-CB 4.36Å; D833-K926 HydrophobicContact CB-CD 4.04Å; D833-K926 IonicContact OD2-NZ 3.26Å; D833-K926 PolarHBondContact OD2-NZ 3.39Å
834	I	83.8	Confident	86.8	Confident	2 Å²	2	49.3 Å²	49.3	1%	0.01	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	118.1	172.9	-63.4	173.4	0	0	0	109	K836 M837 M891 D894 L917 F922 L924	I834-K836 PolarHBondContact O-N 3.22Å; I834-K836 VanDerWaalsContact O-N 3.07Å; I834-M837 HydrophobicContact CB-CB 4.09Å; I834-M837 HydrophobicContact CB-CG 4.42Å; I834-M837 HydrophobicContact CD1-CG 4.39Å; I834-M837 HydrophobicContact CG2-CB 3.66Å; I834-M837 HydrophobicContact CG2-CG 3.99Å; I834-M891 HydrophobicContact CD1-SD 3.89Å; I834-D894 HydrophobicContact CB-CB 4.22Å; I834-D894 PolarHBondContact N-O 3.32Å; I834-L917 HydrophobicContact CD1-CD1 4.36Å; I834-L917 HydrophobicContact CD1-CD2 4.34Å; I834-F922 HydrophobicContact CD1-CB 4.28Å; I834-F922 HydrophobicContact CG2-CB 3.79Å; I834-F922 HydrophobicContact CG2-CD1 3.86Å; I834-F922 HydrophobicContact CG2-CG 4.28Å; I834-L924 HydrophobicContact CG1-CD2 3.62Å
835	E	83.7	Confident	86.6	Confident	60 Å²	60	49.7 Å²	49.7	28%	0.28	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	115.3	178.5	-174.2	177.7	-130.3	0	0	111.1	D833 M837 Q840 D923 K925	D833-E835 PolarHBondContact O-N 3.25Å; E835-M837 PolarHBondContact O-N 3.5Å; E835-Q840 PolarHBondContact O-NE2 3.14Å; E835-D923 PolarHBondContact N-O 3.46Å; E835-K925 HydrophobicContact CB-CD 4.12Å; E835-K925 HydrophobicContact CB-CG 4.31Å; E835-K925 HydrophobicContact CG-CD 4.33Å; E835-K925 IonicContact OE1-NZ 2.85Å; E835-K925 PolarHBondContact OE1-NZ 2.86Å; E835-K925 WeakPolarHBondContact OE2-CE 3.11Å; E835-K925 IonicContact OE2-NZ 3.78Å; E835-K925 PolarHBondContact OE2-NZ 3.47Å
836	K	79.2	Confident	86.4	Confident	70 Å²	70	50.2 Å²	50.2	30%	0.304	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	55	40.4	171.6	-59.3	159.3	168.2	178.3	0	112.1	E750 W756 I834 F838 M839	E750-K836 WeakPolarHBondContact OE1-CE 3.4Å; E750-K836 IonicContact OE1-NZ 2.81Å; E750-K836 PolarHBondContact OE1-NZ 3.37Å; W756-K836 HydrophobicContact CH2-CD 3.51Å; W756-K836 HydrophobicContact CH2-CG 4.37Å; W756-K836 HydrophobicContact CZ2-CB 4.48Å; W756-K836 HydrophobicContact CZ2-CD 3.62Å; I834-K836 PolarHBondContact O-N 3.22Å; I834-K836 VanDerWaalsContact O-N 3.07Å; K836-F838 VanDerWaalsContact C-N 3.34Å; K836-F838 PolarHBondContact O-N 2.85Å; K836-F838 VanDerWaalsContact O-N 3.08Å; K836-M839 HydrophobicContact CB-CB 4.42Å; K836-M839 WeakPolarHBondContact O-CB 3.26Å; K836-M839 PolarHBondContact O-N 3.3Å
837	M	82.7	Confident	86.3	Confident	32 Å²	32	47.1 Å²	47.1	16%	0.158	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-37.7	-54.1	-173.3	-175.5	-165.2	-172.3	0	0	114.9	I834 E835 M839 Q840 V893 D894 F922	I834-M837 HydrophobicContact CB-CB 4.09Å; I834-M837 HydrophobicContact CB-CG 4.42Å; I834-M837 HydrophobicContact CD1-CG 4.39Å; I834-M837 HydrophobicContact CG2-CB 3.66Å; I834-M837 HydrophobicContact CG2-CG 3.99Å; E835-M837 PolarHBondContact O-N 3.5Å; M837-M839 VanDerWaalsContact C-N 3.27Å; M837-M839 PolarHBondContact O-N 3.15Å; M837-Q840 WeakPolarHBondContact O-CB 3.39Å; M837-Q840 PolarHBondContact O-N 2.81Å; M837-Q840 VanDerWaalsContact O-N 3.08Å; M837-V893 HydrophobicContact SD-CG1 4.08Å; M837-D894 HydrophobicContact CB-CB 4.24Å; M837-D894 HydrophobicContact SD-CB 4.11Å; M837-F922 HydrophobicContact CG-CD1 4.16Å; M837-F922 HydrophobicContact CG-CE1 4.07Å
838	F	79.4	Confident	86.3	Confident	138 Å²	138	39.5 Å²	39.5	61%	0.605	19%	0.187	S	C	*	.	G	3₁₀ helix	trans	-63.2	-32.3	-176.5	-63.4	-67.8	0	0	0	113.4	K836 Q840 I841 V893	K836-F838 VanDerWaalsContact C-N 3.34Å; K836-F838 PolarHBondContact O-N 2.85Å; K836-F838 VanDerWaalsContact O-N 3.08Å; F838-Q840 PolarHBondContact O-N 3.36Å; F838-I841 PolarHBondContact O-N 2.99Å; F838-V893 HydrophobicContact CZ-CG1 4.17Å
839	M	81.4	Confident	86.2	Confident	46 Å²	46	39.9 Å²	39.9	23%	0.227	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-76.8	-10.9	179.6	-56.4	-62.5	100.1	0	0	112.3	Y751 W756 K836 M837 I841 F869	Y751-M839 HydrophobicContact CD1-SD 4.34Å; Y751-M839 HydrophobicContact CE1-SD 3.65Å; W756-M839 HydrophobicContact CD2-CB 3.63Å; W756-M839 HydrophobicContact CD2-CG 3.87Å; W756-M839 HydrophobicContact CD2-SD 4.25Å; W756-M839 HydrophobicContact CE3-CB 4.11Å; W756-M839 HydrophobicContact CE3-CG 3.81Å; W756-M839 HydrophobicContact CE3-SD 4.01Å; W756-M839 HydrophobicContact CG-CB 3.94Å; W756-M839 HydrophobicContact CG-CG 4.45Å; W756-M839 HydrophobicContact CH2-CG 4.45Å; W756-M839 HydrophobicContact CZ2-CB 4.1Å; W756-M839 HydrophobicContact CZ2-CG 4.45Å; W756-M839 HydrophobicContact CZ3-CG 4.12Å; K836-M839 HydrophobicContact CB-CB 4.42Å; K836-M839 WeakPolarHBondContact O-CB 3.26Å; K836-M839 PolarHBondContact O-N 3.3Å; M837-M839 VanDerWaalsContact C-N 3.27Å; M837-M839 PolarHBondContact O-N 3.15Å; M839-I841 VanDerWaalsContact C-N 3.31Å; M839-F869 HydrophobicContact SD-CE1 4.22Å
840	Q	81.1	Confident	86.2	Confident	23 Å²	23	40 Å²	40	11%	0.107	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-82.5	-9.6	172.6	-49.4	-55.7	-15	0	0	112.6	R703 E835 M837 F838 G921 F922	R703-Q840 WeakPolarHBondContact CD-O 3.28Å; E835-Q840 PolarHBondContact O-NE2 3.14Å; M837-Q840 WeakPolarHBondContact O-CB 3.39Å; M837-Q840 PolarHBondContact O-N 2.81Å; M837-Q840 VanDerWaalsContact O-N 3.08Å; F838-Q840 PolarHBondContact O-N 3.36Å; Q840-G921 VanDerWaalsContact CG-O 3.32Å; Q840-G921 WeakPolarHBondContact CG-O 3.46Å; Q840-G921 PolarHBondContact OE1-O 2.62Å; Q840-F922 HydrophobicContact CB-CD1 3.83Å; Q840-F922 HydrophobicContact CB-CE1 3.78Å; Q840-F922 HydrophobicContact CG-CD1 4.16Å
841	I	82.8	Confident	86.2	Confident	60 Å²	60	40.4 Å²	40.4	31%	0.308	19%	0.191	S	C	.	.	S	Bend	trans	-96.4	125.3	177.3	-55.5	174.1	0	0	0	108.5	V706 F838 M839 F922	V706-I841 HydrophobicContact CB-CG2 4.39Å; V706-I841 HydrophobicContact CG1-CG2 3.9Å; V706-I841 HydrophobicContact CG2-CG2 3.6Å; F838-I841 PolarHBondContact O-N 2.99Å; M839-I841 VanDerWaalsContact C-N 3.31Å; I841-F922 HydrophobicContact CG1-CE1 4.1Å; I841-F922 HydrophobicContact CG1-CZ 4.03Å
842	L	82.7	Confident	86.3	Confident	6 Å²	6	39.9 Å²	39.9	3%	0.031	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	151.9	179.6	-60	175.8	0	0	0	111.5	R703 Y704 T705 V706	R703-L842 HydrophobicContact CB-CD1 3.99Å; R703-L842 HydrophobicContact CB-CG 4.12Å; Y704-L842 PolarHBondContact O-N 3.37Å; T705-L842 WeakPolarHBondContact CA-O 3.31Å; T705-L842 HydrophobicContact CG2-CB 4.34Å; V706-L842 PolarHBondContact N-O 3.36Å
843	L	87.2	Confident	86.5	Confident	21 Å²	21	39.7 Å²	39.7	11%	0.11	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	132.7	176.7	-165.8	61.4	0	0	0	111.1	L708 D847 R848 V851	L708-L843 HydrophobicContact CD2-CD1 4.12Å; L708-L843 HydrophobicContact CG-CD1 3.99Å; L843-D847 HydrophobicContact CD1-CB 4.33Å; L843-D847 HydrophobicContact CD2-CB 4.43Å; L843-D847 HydrophobicContact CG-CB 4.24Å; L843-R848 HydrophobicContact CB-CG 4.39Å; L843-R848 HydrophobicContact CD2-CG 4.47Å; L843-R848 HydrophobicContact CG-CG 4.49Å; L843-R848 PolarHBondContact O-NE 2.83Å; L843-R848 PolarHBondContact O-NH2 3.09Å; L843-V851 HydrophobicContact CD2-CG1 4.35Å; L843-V851 HydrophobicContact CD2-CG2 3.49Å; L843-V851 VanDerWaalsContact CD2-CG2 3.49Å
844	H	86.6	Confident	87.1	Confident	62 Å²	62	38.9 Å²	38.9	29%	0.287	18%	0.182	S	C	.	.	P	Polyproline II helix	trans	-56.9	140.1	175.8	-168.4	-81.1	0	0	0	111.4	T705 V706 R707 E846 D847 R848	T705-H844 HydrophobicContact CG2-CB 4.29Å; V706-H844 PolarHBondContact O-N 2.93Å; R707-H844 HydrophobicContact CG-CB 3.67Å; H844-E846 PolarHBondContact ND1-N 3.03Å; H844-E846 PolarHBondContact O-N 3.49Å; H844-D847 PolarHBondContact O-N 2.97Å; H844-R848 PolarHBondContact O-N 2.8Å
845	E	85.1	Confident	87.6	Confident	117 Å²	117	39.2 Å²	39.2	55%	0.547	18%	0.183	S	C	.	.	G	3₁₀ helix	trans	-53.6	-47.9	-170.7	-173.8	170	-178.4	0	0	113.7	D847 R848	E845-D847 PolarHBondContact O-N 3.26Å; E845-R848 WeakPolarHBondContact O-CB 3.47Å; E845-R848 PolarHBondContact O-N 2.83Å; E845-R848 VanDerWaalsContact O-N 3.11Å
846	E	86.2	Confident	88.1	Confident	119 Å²	119	37.5 Å²	37.5	56%	0.556	17%	0.174	S	C	*	.	G	3₁₀ helix	trans	-57.5	-20.4	176.9	-67.5	-174.3	171	0	0	115	R707 H844	R707-E846 IonicContact CZ-OE2 2.81Å; R707-E846 IonicContact NH1-OE2 3.2Å; R707-E846 PolarHBondContact NH1-OE2 2.85Å; R707-E846 VanDerWaalsContact NH2-CB 3.3Å; R707-E846 IonicContact NH2-OE2 2.8Å; R707-E846 PolarHBondContact NH2-OE2 2.96Å; H844-E846 PolarHBondContact ND1-N 3.03Å; H844-E846 PolarHBondContact O-N 3.49Å
847	D	90.2	Very high	88.5	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.172	C	C	.	.	G	3₁₀ helix	trans	-103.2	-5.6	-177.7	-64.2	-15.1	0	0	0	112.5	R707 L708 W710 K714 L843 H844 E845 D849 F850	R707-D847 WeakPolarHBondContact CA-OD2 3.14Å; R707-D847 VanDerWaalsContact CB-OD2 3.3Å; R707-D847 WeakPolarHBondContact CB-OD2 3.41Å; R707-D847 IonicContact CZ-OD1 2.75Å; R707-D847 IonicContact CZ-OD2 3.79Å; R707-D847 IonicContact NE-OD1 3.82Å; R707-D847 IonicContact NE-OD2 3.55Å; R707-D847 PolarHBondContact NE-OD2 3.44Å; R707-D847 IonicContact NH2-OD1 3.24Å; R707-D847 PolarHBondContact NH2-OD1 2.99Å; R707-D847 IonicContact NH2-OD2 4Å; L708-D847 HydrophobicContact CB-CB 4.45Å; L708-D847 HydrophobicContact CD1-CB 4.19Å; L708-D847 HydrophobicContact CG-CB 4.12Å; L708-D847 PolarHBondContact N-OD2 2.9Å; W710-D847 PolarHBondContact NE1-OD1 3.47Å; K714-D847 IonicContact NZ-OD1 2.9Å; K714-D847 PolarHBondContact NZ-OD1 3.23Å; L843-D847 HydrophobicContact CD1-CB 4.33Å; L843-D847 HydrophobicContact CD2-CB 4.43Å; L843-D847 HydrophobicContact CG-CB 4.24Å; H844-D847 PolarHBondContact O-N 2.97Å; E845-D847 PolarHBondContact O-N 3.26Å; D847-D849 PolarHBondContact O-N 3.27Å; D847-F850 PolarHBondContact O-N 2.75Å
848	R	91	Very high	88.6	Confident	14 Å²	14	36 Å²	36	5%	0.053	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-68.4	-32.2	-176	-64.9	178.8	-172.6	154	24.6	113.9	E758 L843 H844 E845 F850 V851 R868 F869	E758-R848 IonicContact OE1-NH1 3.86Å; E758-R848 IonicContact OE2-NH1 3.59Å; L843-R848 HydrophobicContact CB-CG 4.39Å; L843-R848 HydrophobicContact CD2-CG 4.47Å; L843-R848 HydrophobicContact CG-CG 4.49Å; L843-R848 PolarHBondContact O-NE 2.83Å; L843-R848 PolarHBondContact O-NH2 3.09Å; H844-R848 PolarHBondContact O-N 2.8Å; E845-R848 WeakPolarHBondContact O-CB 3.47Å; E845-R848 PolarHBondContact O-N 2.83Å; E845-R848 VanDerWaalsContact O-N 3.11Å; R848-F850 PolarHBondContact O-N 2.73Å; R848-V851 WeakPolarHBondContact O-CG2 3.49Å; R848-V851 PolarHBondContact O-N 2.97Å; R848-V851 VanDerWaalsContact O-N 3.13Å; R848-R868 HydrophobicContact CB-CG 4.35Å; R848-F869 WeakPolarHBondContact CD-O 3.41Å; R848-F869 VanDerWaalsContact CG-O 3.26Å; R848-F869 WeakPolarHBondContact CG-O 3.36Å
849	D	92.5	Very high	89	Confident	21 Å²	21	32.7 Å²	32.7	11%	0.112	16%	0.163	C	C	.	.	G	3₁₀ helix	trans	-72.4	-12.2	-178.6	-74.1	-30.1	0	0	0	113.6	A764 A768 W770 D847 V851 R852 R868	A764-D849 HydrophobicContact CB-CB 3.95Å; A768-D849 CarbonylContact O-C 3.58Å; A768-D849 VanDerWaalsContact O-CB 3.27Å; A768-D849 WeakPolarHBondContact O-CB 3.49Å; W770-D849 PolarHBondContact N-O 3.49Å; D847-D849 PolarHBondContact O-N 3.27Å; D849-V851 VanDerWaalsContact C-N 3.31Å; D849-R852 VanDerWaalsContact CG-NH2 3.28Å; D849-R852 WeakPolarHBondContact O-CG 3.23Å; D849-R852 IonicContact OD1-CZ 3.97Å; D849-R852 VanDerWaalsContact OD1-CZ 3.23Å; D849-R852 IonicContact OD1-NE 3.31Å; D849-R852 PolarHBondContact OD1-NE 3.04Å; D849-R852 IonicContact OD1-NH2 3.57Å; D849-R852 PolarHBondContact OD1-NH2 2.89Å; D849-R852 IonicContact OD2-NH2 2.75Å; D849-R868 WeakPolarHBondContact OD1-CD 3.26Å; D849-R868 IonicContact OD1-CZ 2.75Å; D849-R868 IonicContact OD1-NE 2.72Å; D849-R868 IonicContact OD1-NH1 2.79Å; D849-R868 PolarHBondContact OD1-NH1 2.91Å; D849-R868 IonicContact OD2-NH1 3.28Å; D849-R868 PolarHBondContact OD2-NH1 3.35Å
850	F	92.9	Very high	89.2	Confident	4 Å²	4	35.7 Å²	35.7	2%	0.018	17%	0.172	C	C	.	.	G	3₁₀ helix	trans	-81.5	-9.9	172.3	-62.8	-82.4	0	0	0	113.7	L708 W710 K714 L716 A768 W770 L802 D847 R848	L708-F850 HydrophobicContact CD1-CB 4.16Å; W710-F850 HydrophobicContact CH2-CB 4.1Å; W710-F850 AromaticContact CH2-CD1 3.5Å; W710-F850 HydrophobicContact CH2-CD1 3.5Å; W710-F850 VanDerWaalsContact CH2-CD1 3.5Å; W710-F850 AromaticContact CH2-CD2 3.94Å; W710-F850 HydrophobicContact CH2-CD2 3.94Å; W710-F850 AromaticContact CH2-CE1 3.73Å; W710-F850 HydrophobicContact CH2-CE1 3.73Å; W710-F850 HydrophobicContact CH2-CE2 4.2Å; W710-F850 AromaticContact CH2-CG 3.56Å; W710-F850 HydrophobicContact CH2-CG 3.56Å; W710-F850 HydrophobicContact CH2-CZ 4.09Å; W710-F850 HydrophobicContact CZ2-CB 4.3Å; W710-F850 HydrophobicContact CZ2-CD1 4.03Å; W710-F850 AromaticContact CZ2-CD2 3.58Å; W710-F850 HydrophobicContact CZ2-CD2 3.58Å; W710-F850 HydrophobicContact CZ2-CE1 4.15Å; W710-F850 AromaticContact CZ2-CE2 3.77Å; W710-F850 HydrophobicContact CZ2-CE2 3.77Å; W710-F850 AromaticContact CZ2-CG 3.7Å; W710-F850 HydrophobicContact CZ2-CG 3.7Å; W710-F850 HydrophobicContact CZ2-CZ 4.04Å; K714-F850 HydrophobicContact CB-CE1 4.1Å; K714-F850 HydrophobicContact CB-CZ 3.61Å; K714-F850 HydrophobicContact CD-CE2 4.28Å; K714-F850 HydrophobicContact CD-CZ 4.13Å; K714-F850 HydrophobicContact CG-CZ 4.44Å; L716-F850 HydrophobicContact CD1-CD1 3.91Å; L716-F850 HydrophobicContact CD1-CE1 4.46Å; A768-F850 VanDerWaalsContact CA-CE1 3.46Å; A768-F850 VanDerWaalsContact CA-CZ 3.45Å; A768-F850 HydrophobicContact CB-CE1 4.12Å; A768-F850 HydrophobicContact CB-CE2 3.84Å; A768-F850 HydrophobicContact CB-CZ 3.55Å; A768-F850 PolarHBondContact O-N 2.99Å; W770-F850 CarbonylContact O-C 3.46Å; L802-F850 HydrophobicContact CD1-CB 4.21Å; D847-F850 PolarHBondContact O-N 2.75Å; R848-F850 PolarHBondContact O-N 2.73Å
851	V	92.7	Very high	89.5	Confident	13 Å²	13	42.2 Å²	42.2	8%	0.079	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-123.7	36.4	-177.6	-64	0	0	0	0	111.4	L708 L772 L802 L843 R848 D849 F869	L708-V851 HydrophobicContact CD1-CG1 4.36Å; L772-V851 HydrophobicContact CD1-CB 3.91Å; L772-V851 HydrophobicContact CD1-CG1 4.08Å; L802-V851 HydrophobicContact CD2-CG1 4.13Å; L843-V851 HydrophobicContact CD2-CG1 4.35Å; L843-V851 HydrophobicContact CD2-CG2 3.49Å; L843-V851 VanDerWaalsContact CD2-CG2 3.49Å; R848-V851 WeakPolarHBondContact O-CG2 3.49Å; R848-V851 PolarHBondContact O-N 2.97Å; R848-V851 VanDerWaalsContact O-N 3.13Å; D849-V851 VanDerWaalsContact C-N 3.31Å; V851-F869 HydrophobicContact CB-CD2 3.93Å; V851-F869 HydrophobicContact CB-CE2 4.43Å; V851-F869 HydrophobicContact CG2-CB 4.25Å; V851-F869 HydrophobicContact CG2-CD2 3.73Å; V851-F869 HydrophobicContact CG2-CG 4.46Å
852	R	94.9	Very high	89.7	Confident	6 Å²	6	43 Å²	43	2%	0.023	21%	0.211	C	C	.	.	B	Isolated β-bridge	trans	-69.9	160.1	175.2	-66.8	171.5	169.1	-144.5	-11	110.9	H762 A764 E769 W770 Y771 L772 D849 V866 W867 R868	H762-R852 PolarHBondContact O-NH2 2.92Å; A764-R852 VanDerWaalsContact CB-CZ 3.42Å; E769-R852 IonicContact OE1-NH1 2.7Å; E769-R852 PolarHBondContact OE1-NH1 2.93Å; W770-R852 VanDerWaalsContact O-CB 3.31Å; W770-R852 WeakPolarHBondContact O-CB 3.49Å; W770-R852 PolarHBondContact O-N 2.77Å; Y771-R852 CarbonylContact C-O 3.35Å; Y771-R852 VanDerWaalsContact CA-O 3.26Å; Y771-R852 WeakPolarHBondContact CA-O 3.49Å; Y771-R852 HydrophobicContact CD1-CB 3.84Å; Y771-R852 HydrophobicContact CE1-CB 4Å; Y771-R852 HydrophobicContact CG-CB 4.26Å; L772-R852 PolarHBondContact N-O 2.73Å; D849-R852 VanDerWaalsContact CG-NH2 3.28Å; D849-R852 WeakPolarHBondContact O-CG 3.23Å; D849-R852 IonicContact OD1-CZ 3.97Å; D849-R852 VanDerWaalsContact OD1-CZ 3.23Å; D849-R852 IonicContact OD1-NE 3.31Å; D849-R852 PolarHBondContact OD1-NE 3.04Å; D849-R852 IonicContact OD1-NH2 3.57Å; D849-R852 PolarHBondContact OD1-NH2 2.89Å; D849-R852 IonicContact OD2-NH2 2.75Å; R852-V866 HydrophobicContact CB-CG1 4.05Å; R852-V866 HydrophobicContact CG-CG1 4.12Å; R852-W867 CarbonylContact C-O 3.6Å; R852-W867 WeakPolarHBondContact CA-O 3.4Å; R852-R868 HydrophobicContact CG-CB 4.2Å
853	Y	95.8	Very high	89.9	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	164.5	167.5	67.8	-85.6	0	0	0	111.4	M748 V757 H774 F791 W855 V866 W867	M748-Y853 HydrophobicContact CE-CE2 4.35Å; M748-Y853 HydrophobicContact SD-CE2 4.07Å; V757-Y853 HydrophobicContact CB-CE1 4.22Å; V757-Y853 WeakPolarHBondContact CB-OH 3.07Å; V757-Y853 HydrophobicContact CG1-CE1 3.81Å; V757-Y853 WeakPolarHBondContact CG1-OH 3.24Å; V757-Y853 VanDerWaalsContact CG2-OH 3.22Å; V757-Y853 WeakPolarHBondContact CG2-OH 3.23Å; H774-Y853 AromaticContact CD2-CD2 3.65Å; H774-Y853 AromaticContact NE2-CD2 3.86Å; F791-Y853 HydrophobicContact CD1-CD1 4.47Å; F791-Y853 HydrophobicContact CD1-CG 4.42Å; F791-Y853 AromaticContact CE1-CD1 3.69Å; F791-Y853 HydrophobicContact CE1-CD1 3.69Å; F791-Y853 HydrophobicContact CE1-CD2 4.06Å; F791-Y853 HydrophobicContact CE1-CE1 4.07Å; F791-Y853 HydrophobicContact CE1-CE2 4.4Å; F791-Y853 AromaticContact CE1-CG 3.68Å; F791-Y853 HydrophobicContact CE1-CG 3.68Å; F791-Y853 HydrophobicContact CZ-CD1 4.38Å; F791-Y853 HydrophobicContact CZ-CE1 4.32Å; Y853-W855 HydrophobicContact CD2-CB 4.33Å; Y853-W855 HydrophobicContact CE2-CB 4.04Å; Y853-V866 WeakPolarHBondContact O-CA 3.41Å; Y853-W867 HydrophobicContact CD1-CB 3.9Å; Y853-W867 HydrophobicContact CD2-CB 4.17Å; Y853-W867 HydrophobicContact CE1-CB 3.36Å; Y853-W867 HydrophobicContact CE1-CG 4.45Å; Y853-W867 HydrophobicContact CE2-CB 3.68Å; Y853-W867 HydrophobicContact CE2-CG 4.05Å; Y853-W867 HydrophobicContact CG-CB 4.27Å; Y853-W867 AromaticContact CZ-CG 3.88Å; Y853-W867 PolarHBondContact N-O 3.01Å; Y853-W867 PolarHBondContact O-N 3.4Å; Y853-W867 WeakPolarHBondContact OH-CB 3.45Å
854	L	96.5	Very high	90.2	Very high	3 Å²	3	48.2 Å²	48.2	2%	0.016	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	131	-176.8	-60.1	179.4	0	0	0	110.5	A723 F724 L727 Y771 H774 P864 V866	A723-L854 HydrophobicContact CB-CD1 4.1Å; F724-L854 HydrophobicContact CB-CD1 3.68Å; F724-L854 HydrophobicContact CD2-CD1 4.31Å; F724-L854 HydrophobicContact CG-CD1 4.41Å; L727-L854 HydrophobicContact CD2-CB 4.02Å; Y771-L854 HydrophobicContact CD1-CD2 3.66Å; Y771-L854 HydrophobicContact CD1-CG 3.89Å; Y771-L854 HydrophobicContact CE1-CD2 3.55Å; Y771-L854 HydrophobicContact CE1-CG 4.3Å; H774-L854 PolarHBondContact NE2-O 3.02Å; L854-P864 HydrophobicContact CB-CB 3.92Å; L854-P864 HydrophobicContact CD2-CB 4.38Å; L854-V866 HydrophobicContact CD2-CG2 3.88Å
855	W	95.6	Very high	90.5	Very high	8 Å²	8	46.5 Å²	46.5	3%	0.03	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	143.1	177.4	-176.3	-120.5	0	0	0	112.5	Y744 E745 M748 Y853 F858 S865	Y744-W855 AromaticContact CD1-CH2 3.99Å; Y744-W855 HydrophobicContact CD1-CH2 3.99Å; Y744-W855 HydrophobicContact CD1-CZ3 4.08Å; Y744-W855 HydrophobicContact CE1-CH2 4.04Å; Y744-W855 AromaticContact CE1-CZ3 3.66Å; Y744-W855 HydrophobicContact CE1-CZ3 3.66Å; E745-W855 HydrophobicContact CB-CZ2 4.45Å; E745-W855 HydrophobicContact CG-CZ2 4.29Å; M748-W855 HydrophobicContact CB-CD2 4.29Å; M748-W855 HydrophobicContact CB-CH2 4.42Å; M748-W855 HydrophobicContact CB-CZ2 3.84Å; M748-W855 HydrophobicContact CG-CD2 4.14Å; M748-W855 HydrophobicContact CG-CE3 4.25Å; M748-W855 HydrophobicContact CG-CH2 4.25Å; M748-W855 HydrophobicContact CG-CZ2 4.12Å; M748-W855 HydrophobicContact CG-CZ3 4.32Å; Y853-W855 HydrophobicContact CD2-CB 4.33Å; Y853-W855 HydrophobicContact CE2-CB 4.04Å; W855-F858 AromaticContact CH2-CD2 3.94Å; W855-F858 HydrophobicContact CH2-CD2 3.94Å; W855-F858 AromaticContact CH2-CE2 3.77Å; W855-F858 HydrophobicContact CH2-CE2 3.77Å; W855-F858 HydrophobicContact CH2-CZ 4.37Å; W855-S865 PolarHBondContact N-O 3.22Å; W855-S865 WeakPolarHBondContact O-CB 3.3Å; W855-S865 PolarHBondContact O-N 3.39Å
856	R	93.4	Very high	90.9	Very high	24 Å²	24	42.3 Å²	42.3	9%	0.091	22%	0.222	C	C	.	.			trans	-147.9	20.1	-179.3	62.6	-172.9	178.9	161	4	115.5	L727 E731 F858 D859 R860 I862 P864	L727-R856 HydrophobicContact CD2-CG 4.46Å; E731-R856 IonicContact OE1-CZ 3.03Å; E731-R856 IonicContact OE1-NE 2.84Å; E731-R856 PolarHBondContact OE1-NE 2.98Å; E731-R856 IonicContact OE1-NH2 3.95Å; E731-R856 IonicContact OE2-CZ 3.64Å; E731-R856 IonicContact OE2-NE 2.75Å; E731-R856 IonicContact OE2-NH2 2.67Å; E731-R856 PolarHBondContact OE2-NH2 3.18Å; R856-F858 PolarHBondContact O-N 3.23Å; R856-F858 VanDerWaalsContact O-N 3.12Å; R856-D859 WeakPolarHBondContact CD-O 3.4Å; R856-D859 WeakPolarHBondContact CG-O 3.39Å; R856-D859 WeakPolarHBondContact O-CB 3.3Å; R856-D859 PolarHBondContact O-N 2.89Å; R856-R860 PolarHBondContact NH1-O 3.26Å; R856-I862 HydrophobicContact CB-CD1 3.95Å; R856-I862 HydrophobicContact CB-CG1 3.89Å; R856-I862 WeakPolarHBondContact CD-O 3.38Å; R856-I862 PolarHBondContact NH1-O 3.01Å; R856-P864 HydrophobicContact CB-CB 4.5Å
857	G	87.6	Confident	91.3	Very high	25 Å²	25	37.9 Å²	37.9	26%	0.258	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.7	36	176.9	0	0	0	0	0	113.8	D859	G857-D859 PolarHBondContact O-N 3.32Å
858	F	85.9	Confident	91.4	Very high	47 Å²	47	38.6 Å²	38.6	21%	0.206	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.3	3.4	-173.1	-64.4	-78.8	0	0	0	117	L730 E731 M734 A741 Y744 E745 W855 R856 R860	L730-F858 HydrophobicContact CD2-CE1 4.12Å; L730-F858 HydrophobicContact CD2-CZ 4.37Å; E731-F858 HydrophobicContact CB-CD1 4.23Å; E731-F858 HydrophobicContact CB-CE1 4.47Å; E731-F858 HydrophobicContact CG-CD1 3.8Å; E731-F858 HydrophobicContact CG-CE1 4.1Å; M734-F858 HydrophobicContact CB-CE1 3.83Å; M734-F858 HydrophobicContact CB-CZ 4.12Å; M734-F858 HydrophobicContact CG-CE1 4.23Å; M734-F858 HydrophobicContact CG-CZ 4.22Å; A741-F858 HydrophobicContact CB-CE2 4.31Å; A741-F858 HydrophobicContact CB-CZ 4.17Å; Y744-F858 AromaticContact CD1-CE2 3.98Å; Y744-F858 HydrophobicContact CD1-CE2 3.98Å; Y744-F858 AromaticContact CD1-CZ 3.62Å; Y744-F858 HydrophobicContact CD1-CZ 3.62Å; Y744-F858 HydrophobicContact CE1-CZ 4.39Å; E745-F858 HydrophobicContact CB-CD2 4.4Å; E745-F858 HydrophobicContact CB-CE2 4.18Å; W855-F858 AromaticContact CH2-CD2 3.94Å; W855-F858 HydrophobicContact CH2-CD2 3.94Å; W855-F858 AromaticContact CH2-CE2 3.77Å; W855-F858 HydrophobicContact CH2-CE2 3.77Å; W855-F858 HydrophobicContact CH2-CZ 4.37Å; R856-F858 PolarHBondContact O-N 3.23Å; R856-F858 VanDerWaalsContact O-N 3.12Å; F858-R860 PolarHBondContact O-N 3.33Å; F858-R860 VanDerWaalsContact O-N 3.12Å
859	D	87.3	Confident	91.3	Very high	67 Å²	67	39.7 Å²	39.7	36%	0.358	21%	0.208	S	C	.	.			trans	-73.2	104.1	172.7	-178	-11.4	0	0	0	109.1	R856 G857 D861 I862	R856-D859 WeakPolarHBondContact CD-O 3.4Å; R856-D859 WeakPolarHBondContact CG-O 3.39Å; R856-D859 WeakPolarHBondContact O-CB 3.3Å; R856-D859 PolarHBondContact O-N 2.89Å; G857-D859 PolarHBondContact O-N 3.32Å; D859-D861 VanDerWaalsContact C-N 3.26Å; D859-D861 PolarHBondContact O-N 3.15Å; D859-D861 WeakPolarHBondContact OD1-CB 3.32Å; D859-D861 PolarHBondContact OD1-N 3.12Å; D859-I862 HydrophobicContact CB-CD1 3.98Å; D859-I862 HydrophobicContact CB-CG1 3.85Å; D859-I862 WeakPolarHBondContact O-CG1 3.28Å; D859-I862 WeakPolarHBondContact OD2-CG2 3.18Å
860	R	86.1	Confident	90.4	Very high	110 Å²	110	39.3 Å²	39.3	42%	0.415	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76	-17.1	-176.3	-65.8	-173.4	-179.4	-150.1	-0.7	113	E731 D732 R856 F858 I862	E731-R860 PolarHBondContact O-NH2 2.98Å; E731-R860 VanDerWaalsContact O-NH2 3.15Å; D732-R860 VanDerWaalsContact N-NH2 3.15Å; D732-R860 IonicContact OD1-CZ 3.54Å; D732-R860 IonicContact OD1-NH1 3.55Å; D732-R860 PolarHBondContact OD1-NH1 3.47Å; D732-R860 IonicContact OD1-NH2 2.84Å; D732-R860 PolarHBondContact OD1-NH2 3.18Å; R856-R860 PolarHBondContact NH1-O 3.26Å; F858-R860 PolarHBondContact O-N 3.33Å; F858-R860 VanDerWaalsContact O-N 3.12Å; R860-I862 VanDerWaalsContact C-N 3.31Å
861	D	86.2	Confident	88.4	Confident	160 Å²	160	46.9 Å²	46.9	86%	0.856	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-17.7	-176.3	-60.6	-32.7	0	0	0	111.4	D859	D859-D861 VanDerWaalsContact C-N 3.26Å; D859-D861 PolarHBondContact O-N 3.15Å; D859-D861 WeakPolarHBondContact OD1-CB 3.32Å; D859-D861 PolarHBondContact OD1-N 3.12Å
862	I	87.3	Confident	86.1	Confident	76 Å²	76	51.6 Å²	51.6	39%	0.39	26%	0.256	S	S	.	.	S	Bend	trans	-97.8	149.6	174.7	67.4	172.8	0	0	0	113.2	R856 D859 R860	R856-I862 HydrophobicContact CB-CD1 3.95Å; R856-I862 HydrophobicContact CB-CG1 3.89Å; R856-I862 WeakPolarHBondContact CD-O 3.38Å; R856-I862 PolarHBondContact NH1-O 3.01Å; D859-I862 HydrophobicContact CB-CD1 3.98Å; D859-I862 HydrophobicContact CB-CG1 3.85Å; D859-I862 WeakPolarHBondContact O-CG1 3.28Å; D859-I862 WeakPolarHBondContact OD2-CG2 3.18Å; R860-I862 VanDerWaalsContact C-N 3.31Å
863	T	87.6	Confident	83.2	Confident	123 Å²	123	53.3 Å²	53.3	76%	0.755	27%	0.271	S	S	*	.	P	Polyproline II helix	trans	-69.8	134.2	169.6	-60.9	0	0	0	0	109.4	S865	T863-S865 PolarHBondContact O-N 3.06Å
864	P	91.9	Very high	80	Confident	14 Å²	14	61.3 Å²	61.3	9%	0.091	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-57.5	132.9	179.3	-15.5	20.7	0	0	0	113.5	F724 L727 L854 R856	F724-P864 HydrophobicContact CD2-CG 3.49Å; F724-P864 VanDerWaalsContact CD2-CG 3.49Å; F724-P864 HydrophobicContact CE2-CG 3.24Å; F724-P864 HydrophobicContact CZ-CG 4.23Å; L727-P864 HydrophobicContact CD2-CB 4.17Å; L727-P864 HydrophobicContact CD2-CG 4.05Å; L854-P864 HydrophobicContact CB-CB 3.92Å; L854-P864 HydrophobicContact CD2-CB 4.38Å; R856-P864 HydrophobicContact CB-CB 4.5Å
865	S	93.2	Very high	76.7	Confident	26 Å²	26	66.6 Å²	66.6	18%	0.182	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	142.8	169.6	-62	0	0	0	0	109.7	R759 W855 T863	R759-S865 PolarHBondContact NH1-OG 2.87Å; W855-S865 PolarHBondContact N-O 3.22Å; W855-S865 WeakPolarHBondContact O-CB 3.3Å; W855-S865 PolarHBondContact O-N 3.39Å; T863-S865 PolarHBondContact O-N 3.06Å
866	V	94.7	Very high	73.6	Confident	29 Å²	29	72.3 Å²	72.3	18%	0.176	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	127.4	176	-175.3	0	0	0	0	109.4	R759 A760 Y771 R852 Y853 L854	R759-V866 WeakPolarHBondContact CA-O 3.45Å; A760-V866 HydrophobicContact CB-CB 4.13Å; A760-V866 HydrophobicContact CB-CG1 3.73Å; A760-V866 PolarHBondContact N-O 3.03Å; Y771-V866 HydrophobicContact CD1-CG1 4.43Å; Y771-V866 HydrophobicContact CE1-CB 4.35Å; Y771-V866 HydrophobicContact CE1-CG1 3.54Å; Y771-V866 HydrophobicContact CE1-CG2 3.91Å; R852-V866 HydrophobicContact CB-CG1 4.05Å; R852-V866 HydrophobicContact CG-CG1 4.12Å; Y853-V866 WeakPolarHBondContact O-CA 3.41Å; L854-V866 HydrophobicContact CD2-CG2 3.88Å
867	W	94.5	Very high	70.6	Confident	26 Å²	26	74.8 Å²	74.8	10%	0.098	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	155.7	179.4	-65.6	86.9	0	0	0	110.8	I752 V757 E758 R852 Y853	I752-W867 HydrophobicContact CB-CH2 4.34Å; I752-W867 HydrophobicContact CB-CZ3 4.38Å; I752-W867 HydrophobicContact CD1-CH2 3.76Å; I752-W867 HydrophobicContact CD1-CZ2 3.68Å; I752-W867 HydrophobicContact CD1-CZ3 4.26Å; I752-W867 HydrophobicContact CG1-CE3 4.2Å; I752-W867 HydrophobicContact CG1-CH2 3.79Å; I752-W867 HydrophobicContact CG1-CZ2 4.16Å; I752-W867 HydrophobicContact CG1-CZ3 3.81Å; I752-W867 HydrophobicContact CG2-CH2 3.62Å; I752-W867 HydrophobicContact CG2-CZ3 3.89Å; V757-W867 HydrophobicContact CB-CE3 4.31Å; V757-W867 HydrophobicContact CG2-CE3 3.87Å; V757-W867 HydrophobicContact CG2-CZ3 4.29Å; E758-W867 VanDerWaalsContact C-CE3 3.43Å; E758-W867 CarbonylContact O-C 3.5Å; E758-W867 VanDerWaalsContact O-CA 3.27Å; E758-W867 WeakPolarHBondContact O-CA 3.19Å; R852-W867 CarbonylContact C-O 3.6Å; R852-W867 WeakPolarHBondContact CA-O 3.4Å; Y853-W867 HydrophobicContact CD1-CB 3.9Å; Y853-W867 HydrophobicContact CD2-CB 4.17Å; Y853-W867 HydrophobicContact CE1-CB 3.36Å; Y853-W867 HydrophobicContact CE1-CG 4.45Å; Y853-W867 HydrophobicContact CE2-CB 3.68Å; Y853-W867 HydrophobicContact CE2-CG 4.05Å; Y853-W867 HydrophobicContact CG-CB 4.27Å; Y853-W867 AromaticContact CZ-CG 3.88Å; Y853-W867 PolarHBondContact N-O 3.01Å; Y853-W867 PolarHBondContact O-N 3.4Å; Y853-W867 WeakPolarHBondContact OH-CB 3.45Å
868	R	92	Very high	68.3	Low	15 Å²	15	81.1 Å²	81.1	6%	0.057	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	159.3	176.6	64.7	-174.8	-170.8	177.5	4	111	V757 E758 A760 R848 D849 R852	V757-R868 CarbonylContact C-O 3.56Å; V757-R868 WeakPolarHBondContact CA-O 3.17Å; E758-R868 HydrophobicContact CG-CG 3.76Å; E758-R868 PolarHBondContact N-O 3.09Å; E758-R868 PolarHBondContact O-N 2.82Å; E758-R868 IonicContact OE1-CZ 3.75Å; E758-R868 VanDerWaalsContact OE1-CZ 3.24Å; E758-R868 IonicContact OE1-NE 2.93Å; E758-R868 PolarHBondContact OE1-NE 2.89Å; E758-R868 IonicContact OE1-NH2 3.87Å; E758-R868 PolarHBondContact OE1-NH2 3.22Å; A760-R868 HydrophobicContact CB-CG 4.35Å; R848-R868 HydrophobicContact CB-CG 4.35Å; D849-R868 WeakPolarHBondContact OD1-CD 3.26Å; D849-R868 IonicContact OD1-CZ 2.75Å; D849-R868 IonicContact OD1-NE 2.72Å; D849-R868 IonicContact OD1-NH1 2.79Å; D849-R868 PolarHBondContact OD1-NH1 2.91Å; D849-R868 IonicContact OD2-NH1 3.28Å; D849-R868 PolarHBondContact OD2-NH1 3.35Å; R852-R868 HydrophobicContact CG-CB 4.2Å
869	F	88.8	Confident	66.5	Low	37 Å²	37	82.5 Å²	82.5	16%	0.162	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	149.9	-179.3	-67.8	-89.2	0	0	0	113.5	Y751 W756 V757 F791 M839 R848 V851	Y751-F869 HydrophobicContact CD1-CE1 4.07Å; Y751-F869 AromaticContact CE1-CE1 3.96Å; Y751-F869 HydrophobicContact CE1-CE1 3.96Å; Y751-F869 HydrophobicContact CE1-CZ 4.3Å; W756-F869 VanDerWaalsContact O-CA 3.28Å; W756-F869 WeakPolarHBondContact O-CA 3.2Å; V757-F869 HydrophobicContact CG1-CD1 3.92Å; V757-F869 HydrophobicContact CG1-CE1 4.03Å; V757-F869 HydrophobicContact CG1-CG 4.36Å; F791-F869 HydrophobicContact CD2-CZ 4.01Å; F791-F869 AromaticContact CE2-CZ 3.8Å; F791-F869 HydrophobicContact CE2-CZ 3.8Å; F791-F869 HydrophobicContact CG-CZ 4.48Å; F791-F869 HydrophobicContact CZ-CZ 4.1Å; M839-F869 HydrophobicContact SD-CE1 4.22Å; R848-F869 WeakPolarHBondContact CD-O 3.41Å; R848-F869 VanDerWaalsContact CG-O 3.26Å; R848-F869 WeakPolarHBondContact CG-O 3.36Å; V851-F869 HydrophobicContact CB-CD2 3.93Å; V851-F869 HydrophobicContact CB-CE2 4.43Å; V851-F869 HydrophobicContact CG2-CB 4.25Å; V851-F869 HydrophobicContact CG2-CD2 3.73Å; V851-F869 HydrophobicContact CG2-CG 4.46Å
870	T	74.6	Confident	64.9	Low	12 Å²	12	83.2 Å²	83.2	7%	0.074	44%	0.44	C	S	.	.			trans	-107.4	-172.8	-156.6	55.2	0	0	0	0	119.4	G755 W756 V757 E758	G755-T870 WeakPolarHBondContact O-CB 3.24Å; G755-T870 WeakPolarHBondContact O-CG2 3.45Å; G755-T870 PolarHBondContact O-OG1 3.24Å; W756-T870 VanDerWaalsContact C-OG1 3.23Å; W756-T870 WeakPolarHBondContact CA-OG1 2.97Å; W756-T870 PolarHBondContact O-N 2.66Å; W756-T870 VanDerWaalsContact O-N 3.1Å; W756-T870 PolarHBondContact O-OG1 3.38Å; W756-T870 VanDerWaalsContact O-OG1 3.14Å; V757-T870 VanDerWaalsContact CA-CG2 3.46Å; E758-T870 HydrophobicContact CB-CG2 3.56Å; E758-T870 HydrophobicContact CG-CG2 3.68Å
871	R	50.1	Low	63.7	Low	164 Å²	164	87.2 Å²	87.2	62%	0.619	46%	0.46	S	S	*	.			trans	-124	157.6	167.6	146.6	-177.3	-169.2	-115.2	1.5	111.7
872	H	44.7	Very low	62.8	Low	111 Å²	111	84.6 Å²	84.6	51%	0.514	44%	0.443	S	S	.	.				158.8	169.7	128.4	-161.3	41.4	0	0	0	117
873	A	33.5	Very low	61.4	Low	42 Å²	42	81 Å²	81	35%	0.347	42%	0.424	S	S	.	.			trans	80.8	131	165.6	0	0	0	0	0	121.6	N700	N700-A873 VanDerWaalsContact CG-O 3.29Å; N700-A873 PolarHBondContact ND2-O 3.45Å; N700-A873 PolarHBondContact OD1-O 2.81Å
874	E	28.9	Very low	60.4	Low	169 Å²	169	77 Å²	77	79%	0.79	40%	0.404	S	S	*	.			trans	-77.3	152.2	-160.1	-66.9	167	157	0	0	118.1	N700	N700-E874 CarbonylContact O-C 3.44Å
875	D	26.7	Very low	59.4	Low	114 Å²	114	78.7 Å²	78.7	61%	0.61	42%	0.419	S	S	*	.			trans	29.4	112.9	147.7	-64.9	-16.9	0	0	0	118.8	N700	N700-D875 PolarHBondContact O-N 3.36Å
876	N	31.1	Very low	58.3	Low	127 Å²	127	77.8 Å²	77.8	68%	0.679	41%	0.413	S	S	*	.				-170.5	127.7	122.7	-91.3	-45.5	0	0	0	115.3	G701	G701-N876 PolarHBondContact O-N 2.74Å
877	A	30.4	Very low	57.5	Low	76 Å²	76	77.5 Å²	77.5	63%	0.628	41%	0.411	S	S	*	.			trans	55.1	136.5	134.3	0	0	0	0	0	124.2
878	D	38.8	Very low	56.6	Low	159 Å²	159	86.9 Å²	86.9	85%	0.85	45%	0.447	S	S	*	.			trans	-66.2	155.6	169.3	-58.9	-64.7	0	0	0	114.6
879	A	49	Very low	56.1	Low	75 Å²	75	91 Å²	91	62%	0.62	47%	0.467	S	S	*	.			trans	152.6	75.9	133.7	0	0	0	0	0	115.4
880	Y	52.9	Low	56	Low	82 Å²	82	89.5 Å²	89.5	32%	0.322	46%	0.46	S	S	.	.			trans	-149.2	111.5	169.2	-52.9	-75.8	0	0	0	113.5	A884 E912 K915 L916	Y880-A884 WeakPolarHBondContact O-CB 3.39Å; Y880-E912 HydrophobicContact CD1-CB 4.33Å; Y880-E912 HydrophobicContact CD1-CG 4.29Å; Y880-K915 HydrophobicContact CD1-CB 4.1Å; Y880-K915 HydrophobicContact CD2-CB 4.49Å; Y880-K915 HydrophobicContact CE1-CB 3.51Å; Y880-K915 HydrophobicContact CE1-CD 3.78Å; Y880-K915 HydrophobicContact CE1-CG 4.29Å; Y880-K915 HydrophobicContact CE2-CB 3.91Å; Y880-K915 VanDerWaalsContact CZ-CB 3.41Å; Y880-L916 VanDerWaalsContact CD2-CA 3.44Å; Y880-L916 HydrophobicContact CD2-CB 3.69Å; Y880-L916 HydrophobicContact CD2-CD1 3.98Å; Y880-L916 HydrophobicContact CD2-CG 4.44Å; Y880-L916 HydrophobicContact CG-CB 3.9Å
881	K	61.9	Low	56.5	Low	194 Å²	194	91.1 Å²	91.1	84%	0.843	47%	0.467	S	S	*	.	S	Bend	trans	-94.6	-43	-176.7	-72.7	-175.2	-178.8	177.3	0	114.3	A885	K881-A885 PolarHBondContact O-N 2.82Å
882	Q	65.5	Low	58.2	Low	106 Å²	106	86.2 Å²	86.2	50%	0.495	45%	0.45	S	S	.	.	H	α-helix	trans	-78	-40.2	-177.4	-49.1	-176.8	13.9	0	0	110.8	A884 A885 A886 E912	Q882-A884 VanDerWaalsContact C-N 3.26Å; Q882-A884 PolarHBondContact O-N 3.27Å; Q882-A885 PolarHBondContact O-N 3.13Å; Q882-A885 VanDerWaalsContact O-N 3.15Å; Q882-A886 PolarHBondContact O-N 3.17Å; Q882-E912 VanDerWaalsContact CA-OE2 3.3Å; Q882-E912 WeakPolarHBondContact CA-OE2 3.29Å; Q882-E912 WeakPolarHBondContact CB-OE2 3.38Å; Q882-E912 PolarHBondContact N-OE2 2.85Å
883	G	59.4	Low	60.1	Low	0 Å²	0	83 Å²	83	0%	0	44%	0.438	C	S	.	.	H	α-helix	trans	-55.3	-40.4	171.5	0	0	0	0	0	112.6	A885 A886 V887 E912	G883-A885 PolarHBondContact O-N 3.11Å; G883-A886 PolarHBondContact O-N 2.75Å; G883-V887 WeakPolarHBondContact O-CG2 3.27Å; G883-V887 PolarHBondContact O-N 3.11Å; G883-E912 PolarHBondContact N-OE2 3.32Å
884	A	66.2	Low	62.4	Low	39 Å²	39	83.6 Å²	83.6	32%	0.322	44%	0.435	S	S	.	.	H	α-helix	trans	-63.2	-38.6	177.7	0	0	0	0	0	113	Y880 Q882 R888 L916	Y880-A884 WeakPolarHBondContact O-CB 3.39Å; Q882-A884 VanDerWaalsContact C-N 3.26Å; Q882-A884 PolarHBondContact O-N 3.27Å; A884-R888 VanDerWaalsContact O-CB 3.32Å; A884-R888 WeakPolarHBondContact O-CB 3.12Å; A884-R888 PolarHBondContact O-N 3.29Å; A884-L916 VanDerWaalsContact CA-CD2 3.47Å; A884-L916 HydrophobicContact CB-CD2 3.75Å
885	A	70	Confident	65.2	Low	49 Å²	49	77.6 Å²	77.6	41%	0.405	41%	0.408	S	S	.	.	H	α-helix	trans	-65.7	-40.8	176.5	0	0	0	0	0	111.7	K881 Q882 G883 Q889	K881-A885 PolarHBondContact O-N 2.82Å; Q882-A885 PolarHBondContact O-N 3.13Å; Q882-A885 VanDerWaalsContact O-N 3.15Å; G883-A885 PolarHBondContact O-N 3.11Å; A885-Q889 WeakPolarHBondContact O-CG 3.49Å; A885-Q889 PolarHBondContact O-N 3.41Å
886	A	71	Confident	68.2	Low	8 Å²	8	72.4 Å²	72.4	7%	0.066	38%	0.381	C	S	.	.	H	α-helix	trans	-63.6	-50	175.3	0	0	0	0	0	111.4	Q882 G883 R888 Q889 N890 V909	Q882-A886 PolarHBondContact O-N 3.17Å; G883-A886 PolarHBondContact O-N 2.75Å; A886-R888 VanDerWaalsContact C-N 3.34Å; A886-R888 PolarHBondContact O-N 3.01Å; A886-Q889 PolarHBondContact O-N 3.28Å; A886-N890 VanDerWaalsContact O-CB 3.24Å; A886-N890 WeakPolarHBondContact O-CB 3.47Å; A886-N890 PolarHBondContact O-N 3Å; A886-V909 HydrophobicContact CB-CG1 3.83Å
887	V	78.6	Confident	71.2	Confident	23 Å²	23	66.4 Å²	66.4	14%	0.139	35%	0.349	C	S	.	.	H	α-helix	trans	-56.4	-46.9	177.3	170.6	0	0	0	0	111.2	G883 Q889 M891 A913 L916 L917	G883-V887 WeakPolarHBondContact O-CG2 3.27Å; G883-V887 PolarHBondContact O-N 3.11Å; V887-Q889 VanDerWaalsContact C-N 3.32Å; V887-Q889 PolarHBondContact O-N 2.9Å; V887-M891 HydrophobicContact CG1-CE 4.28Å; V887-M891 HydrophobicContact CG1-SD 3.85Å; V887-M891 WeakPolarHBondContact O-CB 3.49Å; V887-M891 PolarHBondContact O-N 2.89Å; V887-A913 HydrophobicContact CG2-CB 4.2Å; V887-L916 HydrophobicContact CG2-CD2 4.43Å; V887-L917 HydrophobicContact CG1-CD2 4.32Å; V887-L917 HydrophobicContact CG2-CD1 3.97Å; V887-L917 HydrophobicContact CG2-CD2 4.39Å; V887-L917 HydrophobicContact CG2-CG 4.06Å
888	R	75.8	Confident	74.2	Confident	223 Å²	223	63 Å²	63	84%	0.842	32%	0.32	S	S	*	.	H	α-helix	trans	-64.9	-32.9	-176.9	-167.5	178.7	-176	103.5	0.1	113.8	A884 A886	A884-R888 VanDerWaalsContact O-CB 3.32Å; A884-R888 WeakPolarHBondContact O-CB 3.12Å; A884-R888 PolarHBondContact O-N 3.29Å; A886-R888 VanDerWaalsContact C-N 3.34Å; A886-R888 PolarHBondContact O-N 3.01Å
889	Q	80.6	Confident	76.8	Confident	101 Å²	101	55.5 Å²	55.5	47%	0.472	28%	0.28	S	S	.	.	H	α-helix	trans	-99.6	-27.5	-174.1	-66.1	-177.1	5.7	0	0	113.6	R822 A885 A886 V887	R822-Q889 PolarHBondContact NE-O 2.78Å; R822-Q889 PolarHBondContact NH2-O 3.13Å; A885-Q889 WeakPolarHBondContact O-CG 3.49Å; A885-Q889 PolarHBondContact O-N 3.41Å; A886-Q889 PolarHBondContact O-N 3.28Å; V887-Q889 VanDerWaalsContact C-N 3.32Å; V887-Q889 PolarHBondContact O-N 2.9Å
890	N	87.5	Confident	79	Confident	6 Å²	6	52.4 Å²	52.4	3%	0.032	25%	0.252	C	S	.	.	H	α-helix	trans	-121.9	3.5	-164.6	-63	-23.5	0	0	0	113.4	R822 A886 L896 V897 S898	R822-N890 VanDerWaalsContact CD-OD1 3.29Å; R822-N890 WeakPolarHBondContact CD-OD1 3.38Å; R822-N890 PolarHBondContact NE-OD1 2.71Å; A886-N890 VanDerWaalsContact O-CB 3.24Å; A886-N890 WeakPolarHBondContact O-CB 3.47Å; A886-N890 PolarHBondContact O-N 3Å; N890-L896 HydrophobicContact CB-CD1 4.24Å; N890-V897 WeakPolarHBondContact CB-O 3.5Å; N890-V897 PolarHBondContact O-N 3.32Å; N890-S898 PolarHBondContact ND2-OG 3.09Å
891	M	85.3	Confident	80.8	Confident	45 Å²	45	51.6 Å²	51.6	22%	0.222	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	134.1	173.3	-159.4	172.4	81.2	0	0	110.7	I834 V887 D895 L917	I834-M891 HydrophobicContact CD1-SD 3.89Å; V887-M891 HydrophobicContact CG1-CE 4.28Å; V887-M891 HydrophobicContact CG1-SD 3.85Å; V887-M891 WeakPolarHBondContact O-CB 3.49Å; V887-M891 PolarHBondContact O-N 2.89Å; M891-D895 CarbonylContact C-O 3.51Å; M891-D895 VanDerWaalsContact CA-O 3.32Å; M891-D895 WeakPolarHBondContact CA-O 3.3Å; M891-L917 HydrophobicContact SD-CD2 4.47Å
892	Y	85.6	Confident	82.2	Confident	62 Å²	62	45.4 Å²	45.4	24%	0.243	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	99	171.1	-171.3	-94.4	0	0	0	108.6	Q813 L816 I819 D894 D895 L953	Q813-Y892 HydrophobicContact CB-CD2 4.41Å; Q813-Y892 HydrophobicContact CB-CE2 3.98Å; Q813-Y892 PolarHBondContact OE1-OH 3.42Å; Q813-Y892 VanDerWaalsContact OE1-OH 3.13Å; L816-Y892 HydrophobicContact CD1-CD1 4.13Å; L816-Y892 HydrophobicContact CD1-CD2 3.84Å; L816-Y892 HydrophobicContact CD1-CE1 3.85Å; L816-Y892 HydrophobicContact CD1-CE2 3.52Å; L816-Y892 HydrophobicContact CD1-CG 4.12Å; I819-Y892 HydrophobicContact CD1-CD2 3.94Å; I819-Y892 HydrophobicContact CD1-CG 4.28Å; Y892-D894 PolarHBondContact O-N 3.05Å; Y892-D895 PolarHBondContact N-O 3.26Å; Y892-D895 PolarHBondContact O-N 3.39Å; Y892-L953 HydrophobicContact CD1-CD2 3.94Å; Y892-L953 HydrophobicContact CG-CD2 3.96Å
893	V	82.7	Confident	83.4	Confident	43 Å²	43	42.5 Å²	42.5	26%	0.261	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.2	-103.7	-170.8	-169.2	0	0	0	0	110.1	Q813 M837 F838	Q813-V893 HydrophobicContact CG-CG2 4.31Å; M837-V893 HydrophobicContact SD-CG1 4.08Å; F838-V893 HydrophobicContact CZ-CG1 4.17Å
894	D	83	Confident	84.9	Confident	54 Å²	54	49.8 Å²	49.8	29%	0.289	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-17.2	-179.2	47.6	-23.9	0	0	0	113.7	I834 M837 Y892	I834-D894 HydrophobicContact CB-CB 4.22Å; I834-D894 PolarHBondContact N-O 3.32Å; M837-D894 HydrophobicContact CB-CB 4.24Å; M837-D894 HydrophobicContact SD-CB 4.11Å; Y892-D894 PolarHBondContact O-N 3.05Å
895	D	87.2	Confident	86	Confident	44 Å²	44	51.5 Å²	51.5	24%	0.235	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	118.1	-177.3	-74.7	-38.1	0	0	0	111.6	M891 Y892 V897 L953	M891-D895 CarbonylContact C-O 3.51Å; M891-D895 VanDerWaalsContact CA-O 3.32Å; M891-D895 WeakPolarHBondContact CA-O 3.3Å; Y892-D895 PolarHBondContact N-O 3.26Å; Y892-D895 PolarHBondContact O-N 3.39Å; D895-V897 HydrophobicContact CB-CG2 4.08Å; D895-L953 HydrophobicContact CB-CD2 4.04Å
896	L	90.9	Very high	87	Confident	5 Å²	5	49.1 Å²	49.1	3%	0.026	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	118.5	165.2	177.8	64.9	0	0	0	109.2	Q831 A832 N890 A913 L924	Q831-L896 CarbonylContact C-O 3.54Å; Q831-L896 WeakPolarHBondContact CA-O 3.44Å; Q831-L896 WeakPolarHBondContact CB-O 3.09Å; A832-L896 PolarHBondContact N-O 3.08Å; A832-L896 PolarHBondContact O-N 2.7Å; N890-L896 HydrophobicContact CB-CD1 4.24Å; L896-A913 HydrophobicContact CD2-CB 4.11Å; L896-L924 HydrophobicContact CB-CD2 4.46Å; L896-L924 HydrophobicContact CD2-CD1 3.75Å
897	V	93.4	Very high	88	Confident	1 Å²	1	49.9 Å²	49.9	1%	0.006	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	102.8	-173.3	-178.6	0	0	0	0	110.8	I819 F823 Q831 N890 D895 T952 L953	I819-V897 HydrophobicContact CG2-CB 3.94Å; I819-V897 HydrophobicContact CG2-CG1 4.25Å; F823-V897 HydrophobicContact CB-CG1 3.81Å; F823-V897 HydrophobicContact CD1-CG1 3.98Å; F823-V897 HydrophobicContact CD2-CB 4.4Å; F823-V897 HydrophobicContact CD2-CG1 3.25Å; F823-V897 HydrophobicContact CE1-CG1 4.35Å; F823-V897 HydrophobicContact CE2-CG1 3.69Å; F823-V897 HydrophobicContact CG-CG1 3.41Å; F823-V897 VanDerWaalsContact CG-CG1 3.41Å; F823-V897 HydrophobicContact CZ-CG1 4.21Å; Q831-V897 HydrophobicContact CB-CG2 4.31Å; N890-V897 WeakPolarHBondContact CB-O 3.5Å; N890-V897 PolarHBondContact O-N 3.32Å; D895-V897 HydrophobicContact CB-CG2 4.08Å; V897-T952 HydrophobicContact CG1-CG2 3.63Å; V897-T952 HydrophobicContact CG2-CG2 4.11Å; V897-L953 HydrophobicContact CG2-CD2 4.21Å; V897-L953 HydrophobicContact CG2-CG 4.16Å
898	S	92.8	Very high	88.5	Confident	4 Å²	4	51.5 Å²	51.5	3%	0.028	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	167.3	-170.9	-165	0	0	0	0	113.6	F823 V830 N890 Y900	F823-S898 WeakPolarHBondContact CD2-O 3.48Å; F823-S898 WeakPolarHBondContact CE2-O 3.48Å; V830-S898 PolarHBondContact N-O 3.04Å; V830-S898 PolarHBondContact O-N 2.86Å; N890-S898 PolarHBondContact ND2-OG 3.09Å; S898-Y900 PolarHBondContact OG-OH 3.36Å
899	S	94.6	Very high	89.1	Confident	1 Å²	1	41.3 Å²	41.3	1%	0.007	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	159.3	169	68.9	0	0	0	0	111.9	R822 F823 F826 V828	R822-S899 PolarHBondContact O-OG 3.32Å; F823-S899 WeakPolarHBondContact O-CB 3.17Å; F823-S899 PolarHBondContact O-OG 3.31Å; F826-S899 WeakPolarHBondContact CD2-O 3.33Å; F826-S899 PolarHBondContact N-OG 2.96Å; V828-S899 CarbonylContact O-C 3.56Å; V828-S899 WeakPolarHBondContact O-CA 3.39Å; V828-S899 WeakPolarHBondContact O-CB 3.35Å
900	Y	94.2	Very high	89.6	Confident	11 Å²	11	36.6 Å²	36.6	4%	0.043	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	156.1	-174.7	-52.6	-79.3	0	0	0	112.7	F826 K827 V828 V830 S898 E905 A906 V909	F826-Y900 WeakPolarHBondContact CB-O 3.46Å; K827-Y900 PolarHBondContact N-O 3.06Å; V828-Y900 PolarHBondContact N-O 3.47Å; V828-Y900 PolarHBondContact O-N 3.24Å; V830-Y900 HydrophobicContact CB-CE2 4.4Å; V830-Y900 HydrophobicContact CG2-CD2 4.3Å; V830-Y900 HydrophobicContact CG2-CE2 4.34Å; S898-Y900 PolarHBondContact OG-OH 3.36Å; Y900-E905 HydrophobicContact CD1-CG 3.96Å; Y900-E905 HydrophobicContact CG-CG 4.38Å; Y900-A906 HydrophobicContact CD2-CB 3.57Å; Y900-A906 HydrophobicContact CE2-CB 4.43Å; Y900-A906 HydrophobicContact CG-CB 3.98Å; Y900-V909 HydrophobicContact CD1-CB 4.34Å; Y900-V909 HydrophobicContact CD1-CG2 4.37Å; Y900-V909 HydrophobicContact CE1-CB 3.64Å; Y900-V909 HydrophobicContact CE1-CG1 3.62Å; Y900-V909 HydrophobicContact CE1-CG2 4.03Å; Y900-V909 WeakPolarHBondContact OH-CG1 3.41Å
901	C	91.1	Very high	89.7	Confident	64 Å²	64	38.1 Å²	38.1	43%	0.432	20%	0.204	S	C	.	.	S	Bend	trans	-73.2	-38.1	-173.9	-66.2	0	0	0	0	112.3	F826 E905	F826-C901 WeakPolarHBondContact CD1-SG 3.28Å; F826-C901 WeakPolarHBondContact CE1-SG 3.35Å; C901-E905 WeakPolarHBondContact CB-OE2 3.37Å; C901-E905 PolarHBondContact N-OE2 3.03Å
902	T	91.3	Very high	89.8	Confident	65 Å²	65	37.9 Å²	37.9	40%	0.399	20%	0.202	S	C	.	.	S	Bend	trans	-127.2	158.6	-177.4	69.9	0	0	0	0	111	E904 E905 A906	T902-E904 VanDerWaalsContact C-N 3.3Å; T902-E904 PolarHBondContact O-N 3.45Å; T902-E905 PolarHBondContact O-N 2.92Å; T902-E905 WeakPolarHBondContact OG1-CB 3.48Å; T902-E905 PolarHBondContact OG1-N 3.47Å; T902-A906 WeakPolarHBondContact O-CB 3.46Å; T902-A906 PolarHBondContact O-N 3.23Å
903	L	90.6	Very high	89.8	Confident	44 Å²	44	34.9 Å²	34.9	23%	0.23	19%	0.19	C	C	.	.	H	α-helix	trans	-60.2	-41	173.9	173.6	60.7	0	0	0	111.7	A906 I907 E933 A934	L903-A906 WeakPolarHBondContact O-CB 3.43Å; L903-A906 PolarHBondContact O-N 2.86Å; L903-I907 HydrophobicContact CD1-CD1 3.73Å; L903-I907 HydrophobicContact CD1-CG1 4.16Å; L903-I907 HydrophobicContact CG-CD1 3.83Å; L903-I907 WeakPolarHBondContact O-CB 3.29Å; L903-I907 WeakPolarHBondContact O-CG1 3.43Å; L903-I907 PolarHBondContact O-N 2.87Å; L903-E933 HydrophobicContact CD1-CB 4.12Å; L903-E933 HydrophobicContact CD2-CB 3.81Å; L903-E933 WeakPolarHBondContact CD2-OE2 3.47Å; L903-A934 HydrophobicContact CD1-CB 3.67Å
904	E	90.5	Very high	90.1	Very high	154 Å²	154	35.9 Å²	35.9	72%	0.72	19%	0.189	S	C	*	.	H	α-helix	trans	-62	-44.9	179.3	-67.1	151.5	-178.2	0	0	111.8	T902 I907 S908	T902-E904 VanDerWaalsContact C-N 3.3Å; T902-E904 PolarHBondContact O-N 3.45Å; E904-I907 PolarHBondContact O-N 2.89Å; E904-S908 WeakPolarHBondContact O-CB 3.47Å; E904-S908 PolarHBondContact O-N 2.82Å
905	E	90.4	Very high	90.3	Very high	74 Å²	74	37.3 Å²	37.3	35%	0.346	19%	0.193	S	C	.	.	H	α-helix	trans	-63.6	-45	175.1	-175	-173.2	-159.9	0	0	110.7	Y900 C901 T902 I907 S908 V909	Y900-E905 HydrophobicContact CD1-CG 3.96Å; Y900-E905 HydrophobicContact CG-CG 4.38Å; C901-E905 WeakPolarHBondContact CB-OE2 3.37Å; C901-E905 PolarHBondContact N-OE2 3.03Å; T902-E905 PolarHBondContact O-N 2.92Å; T902-E905 WeakPolarHBondContact OG1-CB 3.48Å; T902-E905 PolarHBondContact OG1-N 3.47Å; E905-I907 VanDerWaalsContact C-N 3.29Å; E905-I907 PolarHBondContact O-N 3.19Å; E905-S908 PolarHBondContact O-N 3.18Å; E905-V909 HydrophobicContact CG-CG2 4.15Å; E905-V909 WeakPolarHBondContact O-CB 3.17Å; E905-V909 WeakPolarHBondContact O-CG2 3.46Å; E905-V909 PolarHBondContact O-N 3.18Å
906	A	91	Very high	90.2	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-57.4	-44.7	178	0	0	0	0	0	112	V828 V830 Y900 T902 L903 S910	V828-A906 HydrophobicContact CB-CB 4.15Å; V828-A906 HydrophobicContact CG1-CB 3.57Å; V830-A906 HydrophobicContact CG2-CB 4.22Å; Y900-A906 HydrophobicContact CD2-CB 3.57Å; Y900-A906 HydrophobicContact CE2-CB 4.43Å; Y900-A906 HydrophobicContact CG-CB 3.98Å; T902-A906 WeakPolarHBondContact O-CB 3.46Å; T902-A906 PolarHBondContact O-N 3.23Å; L903-A906 WeakPolarHBondContact O-CB 3.43Å; L903-A906 PolarHBondContact O-N 2.86Å; A906-S910 WeakPolarHBondContact O-CB 3.17Å; A906-S910 PolarHBondContact O-N 3.3Å; A906-S910 VanDerWaalsContact O-N 3.16Å; A906-S910 PolarHBondContact O-OG 2.8Å
907	I	90.9	Very high	90.1	Very high	23 Å²	23	37.9 Å²	37.9	12%	0.118	20%	0.196	C	C	.	.	H	α-helix	trans	-65.4	-52.2	177.2	-73.3	164.6	0	0	0	110.5	L903 E904 E905 V909 S910 D911 F938	L903-I907 HydrophobicContact CD1-CD1 3.73Å; L903-I907 HydrophobicContact CD1-CG1 4.16Å; L903-I907 HydrophobicContact CG-CD1 3.83Å; L903-I907 WeakPolarHBondContact O-CB 3.29Å; L903-I907 WeakPolarHBondContact O-CG1 3.43Å; L903-I907 PolarHBondContact O-N 2.87Å; E904-I907 PolarHBondContact O-N 2.89Å; E905-I907 VanDerWaalsContact C-N 3.29Å; E905-I907 PolarHBondContact O-N 3.19Å; I907-V909 PolarHBondContact O-N 3.06Å; I907-S910 PolarHBondContact O-N 2.76Å; I907-D911 VanDerWaalsContact O-CB 3.26Å; I907-D911 WeakPolarHBondContact O-CB 3.42Å; I907-D911 PolarHBondContact O-N 3Å; I907-F938 WeakPolarHBondContact O-CZ 3.35Å
908	S	89.4	Confident	89.8	Confident	57 Å²	57	43.1 Å²	43.1	40%	0.399	22%	0.218	S	C	.	.	H	α-helix	trans	-60.3	-50.4	-174.8	-171.1	0	0	0	0	111.9	E904 E905 D911 E912	E904-S908 WeakPolarHBondContact O-CB 3.47Å; E904-S908 PolarHBondContact O-N 2.82Å; E905-S908 PolarHBondContact O-N 3.18Å; S908-D911 PolarHBondContact O-N 3.48Å; S908-E912 PolarHBondContact O-N 3.21Å
909	V	88.8	Confident	89.3	Confident	10 Å²	10	44.6 Å²	44.6	6%	0.061	23%	0.229	C	C	.	.	H	α-helix	trans	-71	-38.2	-176.1	-178.6	0	0	0	0	111.3	A886 Y900 E905 I907 D911 E912 A913	A886-V909 HydrophobicContact CB-CG1 3.83Å; Y900-V909 HydrophobicContact CD1-CB 4.34Å; Y900-V909 HydrophobicContact CD1-CG2 4.37Å; Y900-V909 HydrophobicContact CE1-CB 3.64Å; Y900-V909 HydrophobicContact CE1-CG1 3.62Å; Y900-V909 HydrophobicContact CE1-CG2 4.03Å; Y900-V909 WeakPolarHBondContact OH-CG1 3.41Å; E905-V909 HydrophobicContact CG-CG2 4.15Å; E905-V909 WeakPolarHBondContact O-CB 3.17Å; E905-V909 WeakPolarHBondContact O-CG2 3.46Å; E905-V909 PolarHBondContact O-N 3.18Å; I907-V909 PolarHBondContact O-N 3.06Å; V909-D911 VanDerWaalsContact C-N 3.35Å; V909-E912 PolarHBondContact O-N 3.36Å; V909-A913 WeakPolarHBondContact O-CB 3.38Å; V909-A913 PolarHBondContact O-N 2.89Å
910	S	90.8	Very high	88.6	Confident	1 Å²	1	44.7 Å²	44.7	1%	0.007	23%	0.229	C	C	.	.	H	α-helix	trans	-68.2	-35.7	177.3	-57.6	0	0	0	0	111.7	A906 I907 A913 R914 F938	A906-S910 WeakPolarHBondContact O-CB 3.17Å; A906-S910 PolarHBondContact O-N 3.3Å; A906-S910 VanDerWaalsContact O-N 3.16Å; A906-S910 PolarHBondContact O-OG 2.8Å; I907-S910 PolarHBondContact O-N 2.76Å; S910-A913 PolarHBondContact O-N 3.48Å; S910-R914 VanDerWaalsContact O-CB 3.29Å; S910-R914 WeakPolarHBondContact O-CB 3.45Å; S910-R914 PolarHBondContact O-N 2.9Å; S910-F938 VanDerWaalsContact CB-CZ 3.46Å
911	D	88.4	Confident	87.9	Confident	38 Å²	38	44.7 Å²	44.7	20%	0.203	23%	0.233	C	C	.	.	H	α-helix	trans	-67.1	-41.9	174.4	-168.7	51.9	0	0	0	112.3	I907 S908 V909 R914 K915 F938	I907-D911 VanDerWaalsContact O-CB 3.26Å; I907-D911 WeakPolarHBondContact O-CB 3.42Å; I907-D911 PolarHBondContact O-N 3Å; S908-D911 PolarHBondContact O-N 3.48Å; V909-D911 VanDerWaalsContact C-N 3.35Å; D911-R914 PolarHBondContact O-N 3.37Å; D911-R914 IonicContact OD1-CZ 3.17Å; D911-R914 IonicContact OD1-NE 2.88Å; D911-R914 PolarHBondContact OD1-NE 2.83Å; D911-R914 IonicContact OD1-NH2 2.65Å; D911-R914 PolarHBondContact OD1-NH2 2.93Å; D911-K915 WeakPolarHBondContact O-CB 3.14Å; D911-K915 WeakPolarHBondContact O-CG 3.38Å; D911-K915 PolarHBondContact O-N 2.83Å; D911-K915 WeakPolarHBondContact OD2-CE 3.5Å; D911-K915 IonicContact OD2-NZ 3.74Å; D911-K915 PolarHBondContact OD2-NZ 3.28Å; D911-F938 HydrophobicContact CB-CE1 3.9Å; D911-F938 HydrophobicContact CB-CZ 4.5Å
912	E	87.6	Confident	87.8	Confident	40 Å²	40	42.8 Å²	42.8	19%	0.187	22%	0.218	C	C	.	.	H	α-helix	trans	-60.9	-45.2	171.9	-77.9	-167	-156.6	0	0	111.9	Y880 Q882 G883 S908 V909 R914 K915 L916	Y880-E912 HydrophobicContact CD1-CB 4.33Å; Y880-E912 HydrophobicContact CD1-CG 4.29Å; Q882-E912 VanDerWaalsContact CA-OE2 3.3Å; Q882-E912 WeakPolarHBondContact CA-OE2 3.29Å; Q882-E912 WeakPolarHBondContact CB-OE2 3.38Å; Q882-E912 PolarHBondContact N-OE2 2.85Å; G883-E912 PolarHBondContact N-OE2 3.32Å; S908-E912 PolarHBondContact O-N 3.21Å; V909-E912 PolarHBondContact O-N 3.36Å; E912-R914 VanDerWaalsContact C-N 3.34Å; E912-R914 PolarHBondContact O-N 2.99Å; E912-K915 PolarHBondContact O-N 3.13Å; E912-L916 VanDerWaalsContact O-CB 3.25Å; E912-L916 WeakPolarHBondContact O-CB 3.37Å; E912-L916 PolarHBondContact O-N 2.8Å
913	A	86.2	Confident	87.5	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-62.6	-42.1	178.4	0	0	0	0	0	111.6	V887 L896 V909 S910 L916 L917	V887-A913 HydrophobicContact CG2-CB 4.2Å; L896-A913 HydrophobicContact CD2-CB 4.11Å; V909-A913 WeakPolarHBondContact O-CB 3.38Å; V909-A913 PolarHBondContact O-N 2.89Å; S910-A913 PolarHBondContact O-N 3.48Å; A913-L916 PolarHBondContact O-N 3.02Å; A913-L917 WeakPolarHBondContact O-CB 3.39Å; A913-L917 WeakPolarHBondContact O-CG 3.47Å; A913-L917 PolarHBondContact O-N 3.42Å
914	R	89.4	Confident	87.4	Confident	64 Å²	64	40 Å²	40	24%	0.242	20%	0.201	C	C	.	.	H	α-helix	trans	-59.9	-49.5	175	-175.8	-176.1	68.5	100.5	-1.6	111.6	S910 D911 E912 K918 L924 W927	S910-R914 VanDerWaalsContact O-CB 3.29Å; S910-R914 WeakPolarHBondContact O-CB 3.45Å; S910-R914 PolarHBondContact O-N 2.9Å; D911-R914 PolarHBondContact O-N 3.37Å; D911-R914 IonicContact OD1-CZ 3.17Å; D911-R914 IonicContact OD1-NE 2.88Å; D911-R914 PolarHBondContact OD1-NE 2.83Å; D911-R914 IonicContact OD1-NH2 2.65Å; D911-R914 PolarHBondContact OD1-NH2 2.93Å; E912-R914 VanDerWaalsContact C-N 3.34Å; E912-R914 PolarHBondContact O-N 2.99Å; R914-K918 WeakPolarHBondContact O-CB 3.28Å; R914-K918 PolarHBondContact O-N 3.07Å; R914-L924 HydrophobicContact CB-CD1 4.47Å; R914-W927 HydrophobicContact CB-CH2 4.46Å; R914-W927 HydrophobicContact CB-CZ2 3.97Å; R914-W927 HydrophobicContact CG-CZ2 4.16Å
915	K	87.5	Confident	87.3	Confident	83 Å²	83	36.6 Å²	36.6	36%	0.361	18%	0.183	S	C	.	.	H	α-helix	trans	-65	-41.9	179.5	-71.5	169.4	173.1	163.9	0	112	Y880 D911 E912 K918 S919	Y880-K915 HydrophobicContact CD1-CB 4.1Å; Y880-K915 HydrophobicContact CD2-CB 4.49Å; Y880-K915 HydrophobicContact CE1-CB 3.51Å; Y880-K915 HydrophobicContact CE1-CD 3.78Å; Y880-K915 HydrophobicContact CE1-CG 4.29Å; Y880-K915 HydrophobicContact CE2-CB 3.91Å; Y880-K915 VanDerWaalsContact CZ-CB 3.41Å; D911-K915 WeakPolarHBondContact O-CB 3.14Å; D911-K915 WeakPolarHBondContact O-CG 3.38Å; D911-K915 PolarHBondContact O-N 2.83Å; D911-K915 WeakPolarHBondContact OD2-CE 3.5Å; D911-K915 IonicContact OD2-NZ 3.74Å; D911-K915 PolarHBondContact OD2-NZ 3.28Å; E912-K915 PolarHBondContact O-N 3.13Å; K915-K918 PolarHBondContact O-N 2.97Å; K915-S919 PolarHBondContact O-N 3.28Å
916	L	85.4	Confident	87	Confident	46 Å²	46	38.8 Å²	38.8	24%	0.241	19%	0.192	C	C	.	.	H	α-helix	trans	-61.4	-47.9	176.3	177	62.3	0	0	0	112.7	Y880 A884 V887 E912 A913 K918 S919	Y880-L916 VanDerWaalsContact CD2-CA 3.44Å; Y880-L916 HydrophobicContact CD2-CB 3.69Å; Y880-L916 HydrophobicContact CD2-CD1 3.98Å; Y880-L916 HydrophobicContact CD2-CG 4.44Å; Y880-L916 HydrophobicContact CG-CB 3.9Å; A884-L916 VanDerWaalsContact CA-CD2 3.47Å; A884-L916 HydrophobicContact CB-CD2 3.75Å; V887-L916 HydrophobicContact CG2-CD2 4.43Å; E912-L916 VanDerWaalsContact O-CB 3.25Å; E912-L916 WeakPolarHBondContact O-CB 3.37Å; E912-L916 PolarHBondContact O-N 2.8Å; A913-L916 PolarHBondContact O-N 3.02Å; L916-K918 VanDerWaalsContact C-N 3.33Å; L916-S919 PolarHBondContact O-N 3.45Å; L916-S919 PolarHBondContact O-OG 2.9Å
917	L	87.4	Confident	86.9	Confident	15 Å²	15	39.4 Å²	39.4	8%	0.079	19%	0.194	C	C	.	.	H	α-helix	trans	-68.7	-38.3	179.4	-76.2	171.3	0	0	0	110.7	I834 V887 M891 A913 S919 G920 G921 F922 L924	I834-L917 HydrophobicContact CD1-CD1 4.36Å; I834-L917 HydrophobicContact CD1-CD2 4.34Å; V887-L917 HydrophobicContact CG1-CD2 4.32Å; V887-L917 HydrophobicContact CG2-CD1 3.97Å; V887-L917 HydrophobicContact CG2-CD2 4.39Å; V887-L917 HydrophobicContact CG2-CG 4.06Å; M891-L917 HydrophobicContact SD-CD2 4.47Å; A913-L917 WeakPolarHBondContact O-CB 3.39Å; A913-L917 WeakPolarHBondContact O-CG 3.47Å; A913-L917 PolarHBondContact O-N 3.42Å; L917-S919 VanDerWaalsContact C-N 3.32Å; L917-S919 PolarHBondContact O-N 3.49Å; L917-G920 CarbonylContact O-C 3.53Å; L917-G920 WeakPolarHBondContact O-CA 3.34Å; L917-G920 PolarHBondContact O-N 2.92Å; L917-G921 PolarHBondContact O-N 3.35Å; L917-F922 CarbonylContact C-O 3.21Å; L917-F922 HydrophobicContact CB-CB 3.99Å; L917-F922 VanDerWaalsContact CB-O 3.29Å; L917-F922 WeakPolarHBondContact CB-O 3.36Å; L917-F922 HydrophobicContact CD2-CB 4.23Å; L917-F922 HydrophobicContact CD2-CD2 4.42Å; L917-F922 WeakPolarHBondContact O-CA 3.15Å; L917-F922 WeakPolarHBondContact O-CB 3.35Å; L917-F922 PolarHBondContact O-N 3.01Å; L917-L924 HydrophobicContact CD1-CD1 3.73Å; L917-L924 HydrophobicContact CD1-CD2 3.86Å; L917-L924 HydrophobicContact CD1-CG 3.75Å
918	K	87.7	Confident	86.9	Confident	112 Å²	112	38.7 Å²	38.7	49%	0.487	19%	0.191	S	C	.	.	H	α-helix	trans	-62.9	-33.6	176.4	-172.6	166.3	-175.7	164.7	0	113.1	R914 K915 L916 G920 G921 F922	R914-K918 WeakPolarHBondContact O-CB 3.28Å; R914-K918 PolarHBondContact O-N 3.07Å; K915-K918 PolarHBondContact O-N 2.97Å; L916-K918 VanDerWaalsContact C-N 3.33Å; K918-G920 PolarHBondContact O-N 3.22Å; K918-G921 PolarHBondContact O-N 3.22Å; K918-F922 PolarHBondContact N-O 3.3Å
919	S	81.7	Confident	87	Confident	35 Å²	35	36.4 Å²	36.4	25%	0.245	18%	0.175	C	C	.	.	H	α-helix	trans	-63.2	-32.7	173.7	73.6	0	0	0	0	111.7	Y699 K915 L916 L917 G921	Y699-S919 PolarHBondContact OH-O 3.16Å; K915-S919 PolarHBondContact O-N 3.28Å; L916-S919 PolarHBondContact O-N 3.45Å; L916-S919 PolarHBondContact O-OG 2.9Å; L917-S919 VanDerWaalsContact C-N 3.32Å; L917-S919 PolarHBondContact O-N 3.49Å; S919-G921 VanDerWaalsContact C-N 3.29Å; S919-G921 PolarHBondContact O-N 2.63Å
920	G	79.5	Confident	87.1	Confident	2 Å²	2	37.6 Å²	37.6	2%	0.021	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	8.3	172	0	0	0	0	0	115.4	N702 L917 K918 F922	N702-G920 CarbonylContact O-C 3.36Å; N702-G920 WeakPolarHBondContact O-CA 3.49Å; L917-G920 CarbonylContact O-C 3.53Å; L917-G920 WeakPolarHBondContact O-CA 3.34Å; L917-G920 PolarHBondContact O-N 2.92Å; K918-G920 PolarHBondContact O-N 3.22Å; G920-F922 VanDerWaalsContact C-N 3.31Å; G920-F922 WeakPolarHBondContact O-CD2 3.01Å; G920-F922 WeakPolarHBondContact O-CE2 3.32Å
921	G	81.3	Confident	87	Confident	12 Å²	12	38.8 Å²	38.8	12%	0.124	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.1	7.5	-179.4	0	0	0	0	0	114.3	N702 Q840 L917 K918 S919	N702-G921 WeakPolarHBondContact O-CA 3.5Å; N702-G921 PolarHBondContact O-N 3.01Å; Q840-G921 VanDerWaalsContact CG-O 3.32Å; Q840-G921 WeakPolarHBondContact CG-O 3.46Å; Q840-G921 PolarHBondContact OE1-O 2.62Å; L917-G921 PolarHBondContact O-N 3.35Å; K918-G921 PolarHBondContact O-N 3.22Å; S919-G921 VanDerWaalsContact C-N 3.29Å; S919-G921 PolarHBondContact O-N 2.63Å
922	F	87.7	Confident	86.7	Confident	23 Å²	23	41.9 Å²	41.9	10%	0.101	21%	0.211	C	C	.	.			trans	-96.7	94.4	-179.5	-58.4	-70	0	0	0	110.6	Y704 I834 M837 Q840 I841 L917 K918 G920	Y704-F922 AromaticContact CD2-CE2 3.98Å; Y704-F922 HydrophobicContact CD2-CE2 3.98Å; Y704-F922 HydrophobicContact CE2-CE2 4.27Å; I834-F922 HydrophobicContact CD1-CB 4.28Å; I834-F922 HydrophobicContact CG2-CB 3.79Å; I834-F922 HydrophobicContact CG2-CD1 3.86Å; I834-F922 HydrophobicContact CG2-CG 4.28Å; M837-F922 HydrophobicContact CG-CD1 4.16Å; M837-F922 HydrophobicContact CG-CE1 4.07Å; Q840-F922 HydrophobicContact CB-CD1 3.83Å; Q840-F922 HydrophobicContact CB-CE1 3.78Å; Q840-F922 HydrophobicContact CG-CD1 4.16Å; I841-F922 HydrophobicContact CG1-CE1 4.1Å; I841-F922 HydrophobicContact CG1-CZ 4.03Å; L917-F922 CarbonylContact C-O 3.21Å; L917-F922 HydrophobicContact CB-CB 3.99Å; L917-F922 VanDerWaalsContact CB-O 3.29Å; L917-F922 WeakPolarHBondContact CB-O 3.36Å; L917-F922 HydrophobicContact CD2-CB 4.23Å; L917-F922 HydrophobicContact CD2-CD2 4.42Å; L917-F922 WeakPolarHBondContact O-CA 3.15Å; L917-F922 WeakPolarHBondContact O-CB 3.35Å; L917-F922 PolarHBondContact O-N 3.01Å; K918-F922 PolarHBondContact N-O 3.3Å; G920-F922 VanDerWaalsContact C-N 3.31Å; G920-F922 WeakPolarHBondContact O-CD2 3.01Å; G920-F922 WeakPolarHBondContact O-CE2 3.32Å
923	D	85.9	Confident	86.5	Confident	47 Å²	47	46.4 Å²	46.4	25%	0.251	23%	0.232	S	C	.	.			trans	-80.8	122.4	-179.8	-161.2	23.3	0	0	0	111.5	E835 K925	E835-D923 PolarHBondContact N-O 3.46Å; D923-K925 VanDerWaalsContact OD2-CE 3.3Å; D923-K925 WeakPolarHBondContact OD2-CE 3.3Å
924	L	88.9	Confident	86.3	Confident	5 Å²	5	46.4 Å²	46.4	3%	0.026	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	120.7	176.7	-77.4	-177.6	0	0	0	110.6	A832 I834 L896 R914 L917 W927	A832-L924 HydrophobicContact CB-CB 4.17Å; A832-L924 HydrophobicContact CB-CD1 4.29Å; A832-L924 HydrophobicContact CB-CD2 4.03Å; A832-L924 HydrophobicContact CB-CG 4.42Å; I834-L924 HydrophobicContact CG1-CD2 3.62Å; L896-L924 HydrophobicContact CB-CD2 4.46Å; L896-L924 HydrophobicContact CD2-CD1 3.75Å; R914-L924 HydrophobicContact CB-CD1 4.47Å; L917-L924 HydrophobicContact CD1-CD1 3.73Å; L917-L924 HydrophobicContact CD1-CD2 3.86Å; L917-L924 HydrophobicContact CD1-CG 3.75Å; L924-W927 HydrophobicContact CB-CZ2 3.59Å; L924-W927 HydrophobicContact CD1-CH2 3.71Å; L924-W927 HydrophobicContact CD1-CZ2 3.56Å; L924-W927 HydrophobicContact CG-CZ2 4.26Å; L924-W927 PolarHBondContact O-NE1 3.25Å
925	K	86.8	Confident	85.8	Confident	81 Å²	81	43.6 Å²	43.6	35%	0.352	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	-179.6	177.4	-67.7	-165.2	177.7	171.7	0	111.6	D833 E835 D923 W927	D833-K925 PolarHBondContact N-O 2.98Å; D833-K925 PolarHBondContact O-N 3.47Å; E835-K925 HydrophobicContact CB-CD 4.12Å; E835-K925 HydrophobicContact CB-CG 4.31Å; E835-K925 HydrophobicContact CG-CD 4.33Å; E835-K925 IonicContact OE1-NZ 2.85Å; E835-K925 PolarHBondContact OE1-NZ 2.86Å; E835-K925 WeakPolarHBondContact OE2-CE 3.11Å; E835-K925 IonicContact OE2-NZ 3.78Å; E835-K925 PolarHBondContact OE2-NZ 3.47Å; D923-K925 VanDerWaalsContact OD2-CE 3.3Å; D923-K925 WeakPolarHBondContact OD2-CE 3.3Å; K925-W927 PolarHBondContact O-N 2.93Å
926	K	84.1	Confident	85.3	Confident	121 Å²	121	43.4 Å²	43.4	53%	0.526	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	58.1	33.8	178	-54	175.3	-171.5	150.5	0	113.7	D833 T928	D833-K926 HydrophobicContact CB-CB 4.36Å; D833-K926 HydrophobicContact CB-CD 4.04Å; D833-K926 IonicContact OD2-NZ 3.26Å; D833-K926 PolarHBondContact OD2-NZ 3.39Å; K926-T928 PolarHBondContact O-N 3.32Å; K926-T928 PolarHBondContact O-OG1 2.93Å; K926-T928 VanDerWaalsContact O-OG1 3.07Å
927	W	89.8	Confident	84.8	Confident	12 Å²	12	49.8 Å²	49.8	5%	0.045	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-49.6	124.7	175.5	-69.3	94.6	0	0	0	111.1	V830 Q831 A832 R914 L924 K925 V935 F938 H946	V830-W927 HydrophobicContact CG1-CE3 3.71Å; V830-W927 HydrophobicContact CG1-CZ3 3.68Å; Q831-W927 WeakPolarHBondContact O-CA 3.27Å; A832-W927 HydrophobicContact CB-CD2 3.7Å; A832-W927 HydrophobicContact CB-CE3 3.73Å; A832-W927 HydrophobicContact CB-CG 4.32Å; A832-W927 HydrophobicContact CB-CH2 4Å; A832-W927 HydrophobicContact CB-CZ2 3.97Å; A832-W927 HydrophobicContact CB-CZ3 3.87Å; R914-W927 HydrophobicContact CB-CH2 4.46Å; R914-W927 HydrophobicContact CB-CZ2 3.97Å; R914-W927 HydrophobicContact CG-CZ2 4.16Å; L924-W927 HydrophobicContact CB-CZ2 3.59Å; L924-W927 HydrophobicContact CD1-CH2 3.71Å; L924-W927 HydrophobicContact CD1-CZ2 3.56Å; L924-W927 HydrophobicContact CG-CZ2 4.26Å; L924-W927 PolarHBondContact O-NE1 3.25Å; K925-W927 PolarHBondContact O-N 2.93Å; W927-V935 HydrophobicContact CB-CG1 4.12Å; W927-F938 HydrophobicContact CB-CB 4.21Å; W927-F938 HydrophobicContact CD2-CB 3.72Å; W927-F938 HydrophobicContact CD2-CD2 4.03Å; W927-F938 AromaticContact CD2-CG 3.94Å; W927-F938 HydrophobicContact CD2-CG 3.94Å; W927-F938 HydrophobicContact CE3-CB 4.41Å; W927-F938 AromaticContact CE3-CD2 3.85Å; W927-F938 HydrophobicContact CE3-CD2 3.85Å; W927-F938 HydrophobicContact CE3-CE2 4.41Å; W927-F938 HydrophobicContact CE3-CG 4.18Å; W927-F938 HydrophobicContact CG-CB 3.58Å; W927-F938 HydrophobicContact CG-CD2 4.48Å; W927-F938 HydrophobicContact CG-CG 4.3Å; W927-F938 HydrophobicContact CZ2-CG 4.47Å; W927-F938 HydrophobicContact CZ3-CD2 4.25Å; W927-F938 HydrophobicContact CZ3-CE2 4.43Å; W927-H946 PolarHBondContact O-CE1 3.44Å
928	T	90.2	Very high	84.1	Confident	9 Å²	9	50 Å²	50	6%	0.055	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	138.7	178.5	-51.8	0	0	0	0	109.1	V830 Q831 K926 V950 W957 V959	V830-T928 WeakPolarHBondContact CA-O 3.23Å; Q831-T928 PolarHBondContact N-O 3.49Å; Q831-T928 PolarHBondContact O-N 3.37Å; K926-T928 PolarHBondContact O-N 3.32Å; K926-T928 PolarHBondContact O-OG1 2.93Å; K926-T928 VanDerWaalsContact O-OG1 3.07Å; T928-V950 HydrophobicContact CG2-CG1 4.13Å; T928-V950 HydrophobicContact CG2-CG2 4.17Å; T928-W957 HydrophobicContact CG2-CZ3 3.97Å; T928-V959 HydrophobicContact CG2-CG1 4.09Å; T928-V959 HydrophobicContact CG2-CG2 3.66Å
929	S	91.9	Very high	82.9	Confident	9 Å²	9	46 Å²	46	6%	0.063	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	148.3	-179.7	-179.8	0	0	0	0	111	A829 C931 V959	A829-S929 WeakPolarHBondContact O-CA 3.33Å; A829-S929 WeakPolarHBondContact O-CB 3.41Å; A829-S929 PolarHBondContact O-OG 3.37Å; S929-C931 WeakPolarHBondContact CB-O 3.4Å; S929-C931 PolarHBondContact O-N 3.45Å; S929-C931 PolarHBondContact OG-N 2.79Å; S929-C931 PolarHBondContact OG-O 2.88Å; S929-C931 VanDerWaalsContact OG-O 3.07Å; S929-V959 VanDerWaalsContact C-CG1 3.44Å; S929-V959 WeakPolarHBondContact O-CG1 3.29Å
930	N	90.5	Very high	81.8	Confident	34 Å²	34	52.3 Å²	52.3	18%	0.182	28%	0.275	C	S	.	.	S	Bend	trans	-70	-11.8	167	66.1	-11.1	0	0	0	112.7	K827 A829 W957 V959 D962	K827-N930 PolarHBondContact O-ND2 3.09Å; A829-N930 PolarHBondContact N-OD1 3.42Å; A829-N930 PolarHBondContact O-N 3Å; A829-N930 PolarHBondContact O-OD1 3.02Å; N930-W957 HydrophobicContact CB-CZ2 3.95Å; N930-V959 VanDerWaalsContact CB-O 3.31Å; N930-V959 WeakPolarHBondContact CB-O 3.45Å; N930-D962 HydrophobicContact CB-CB 4.13Å; N930-D962 VanDerWaalsContact ND2-CG 3.34Å; N930-D962 PolarHBondContact ND2-OD2 2.79Å
931	C	88.9	Confident	80.4	Confident	27 Å²	27	56.1 Å²	56.1	18%	0.182	30%	0.295	C	S	.	.	S	Bend	trans	-111.3	104.3	171.9	-174.9	0	0	0	0	109.6	V828 S929 E933 A934	V828-C931 HydrophobicContact CG1-CB 3.86Å; S929-C931 WeakPolarHBondContact CB-O 3.4Å; S929-C931 PolarHBondContact O-N 3.45Å; S929-C931 PolarHBondContact OG-N 2.79Å; S929-C931 PolarHBondContact OG-O 2.88Å; S929-C931 VanDerWaalsContact OG-O 3.07Å; C931-E933 PolarHBondContact O-N 3.38Å; C931-A934 HydrophobicContact CB-CB 4.39Å; C931-A934 WeakPolarHBondContact O-CB 3.42Å; C931-A934 PolarHBondContact O-N 3.01Å
932	P	81.9	Confident	78.8	Confident	103 Å²	103	65.6 Å²	65.6	67%	0.669	33%	0.332	S	S	*	.	H	α-helix	trans	-55.6	-36.2	-177.4	-27.9	35.2	0	0	0	114	A934 V935 A936	P932-A934 PolarHBondContact O-N 3.18Å; P932-V935 PolarHBondContact O-N 3.34Å; P932-V935 VanDerWaalsContact O-N 3.09Å; P932-A936 PolarHBondContact O-N 3.45Å; P932-A936 VanDerWaalsContact O-N 3.15Å
933	E	83.4	Confident	76.9	Confident	134 Å²	134	73.2 Å²	73.2	63%	0.626	37%	0.368	S	S	*	.	H	α-helix	trans	-60.5	-27.8	177.8	-65	177.3	-153.9	0	0	113	L903 C931	L903-E933 HydrophobicContact CD1-CB 4.12Å; L903-E933 HydrophobicContact CD2-CB 3.81Å; L903-E933 WeakPolarHBondContact CD2-OE2 3.47Å; C931-E933 PolarHBondContact O-N 3.38Å
934	A	83.1	Confident	75.2	Confident	1 Å²	1	77.5 Å²	77.5	1%	0.008	38%	0.381	C	S	.	.	H	α-helix	trans	-71	-37.4	176.5	0	0	0	0	0	111.6	V828 L903 C931 P932 F938	V828-A934 HydrophobicContact CG1-CB 4.32Å; L903-A934 HydrophobicContact CD1-CB 3.67Å; C931-A934 HydrophobicContact CB-CB 4.39Å; C931-A934 WeakPolarHBondContact O-CB 3.42Å; C931-A934 PolarHBondContact O-N 3.01Å; P932-A934 PolarHBondContact O-N 3.18Å; A934-F938 WeakPolarHBondContact O-CD2 3.29Å; A934-F938 WeakPolarHBondContact O-CE2 3.36Å
935	V	78.4	Confident	73.5	Confident	5 Å²	5	85 Å²	85	3%	0.03	42%	0.421	C	S	.	.	H	α-helix	trans	-78.2	-32	-177.6	176.2	0	0	0	0	111.8	W927 P932 R937 F938 S939 H946	W927-V935 HydrophobicContact CB-CG1 4.12Å; P932-V935 PolarHBondContact O-N 3.34Å; P932-V935 VanDerWaalsContact O-N 3.09Å; V935-R937 PolarHBondContact O-N 3.07Å; V935-F938 PolarHBondContact O-N 3.44Å; V935-S939 PolarHBondContact O-N 3.37Å; V935-H946 VanDerWaalsContact CG1-CE1 3.45Å; V935-H946 WeakPolarHBondContact CG1-CE1 3.45Å; V935-H946 WeakPolarHBondContact CG1-NE2 3.39Å
936	A	77.4	Confident	72.3	Confident	79 Å²	79	85.1 Å²	85.1	65%	0.653	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-15.9	-179.9	0	0	0	0	0	114.3	P932	P932-A936 PolarHBondContact O-N 3.45Å; P932-A936 VanDerWaalsContact O-N 3.15Å
937	R	74.2	Confident	71.5	Confident	179 Å²	179	83 Å²	83	68%	0.675	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.3	-15.3	177.2	-113.4	159.9	171.7	130.8	-3.5	115.1	V935	V935-R937 PolarHBondContact O-N 3.07Å
938	F	71.8	Confident	70.8	Confident	21 Å²	21	86.3 Å²	86.3	9%	0.092	44%	0.44	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.8	-16.4	-175.2	-54	-60.3	0	0	0	113.7	I907 S910 D911 W927 A934 V935	I907-F938 WeakPolarHBondContact O-CZ 3.35Å; S910-F938 VanDerWaalsContact CB-CZ 3.46Å; D911-F938 HydrophobicContact CB-CE1 3.9Å; D911-F938 HydrophobicContact CB-CZ 4.5Å; W927-F938 HydrophobicContact CB-CB 4.21Å; W927-F938 HydrophobicContact CD2-CB 3.72Å; W927-F938 HydrophobicContact CD2-CD2 4.03Å; W927-F938 AromaticContact CD2-CG 3.94Å; W927-F938 HydrophobicContact CD2-CG 3.94Å; W927-F938 HydrophobicContact CE3-CB 4.41Å; W927-F938 AromaticContact CE3-CD2 3.85Å; W927-F938 HydrophobicContact CE3-CD2 3.85Å; W927-F938 HydrophobicContact CE3-CE2 4.41Å; W927-F938 HydrophobicContact CE3-CG 4.18Å; W927-F938 HydrophobicContact CG-CB 3.58Å; W927-F938 HydrophobicContact CG-CD2 4.48Å; W927-F938 HydrophobicContact CG-CG 4.3Å; W927-F938 HydrophobicContact CZ2-CG 4.47Å; W927-F938 HydrophobicContact CZ3-CD2 4.25Å; W927-F938 HydrophobicContact CZ3-CE2 4.43Å; A934-F938 WeakPolarHBondContact O-CD2 3.29Å; A934-F938 WeakPolarHBondContact O-CE2 3.36Å; V935-F938 PolarHBondContact O-N 3.44Å
939	S	64	Low	70.4	Confident	26 Å²	26	89.4 Å²	89.4	18%	0.182	46%	0.458	C	S	.	.			trans	-106	115.2	179.8	-161	0	0	0	0	109.3	V935 D941	V935-S939 PolarHBondContact O-N 3.37Å; S939-D941 PolarHBondContact O-N 3.43Å
940	D	58.2	Low	70.1	Confident	169 Å²	169	89.8 Å²	89.8	90%	0.904	46%	0.46	S	S	*	.	S	Bend	trans	-65.6	-24.4	171.6	-66.9	-38.7	0	0	0	111.4	K942	D940-K942 PolarHBondContact O-N 3Å; D940-K942 VanDerWaalsContact O-N 3.15Å
941	D	50.4	Low	69.8	Low	82 Å²	82	93.8 Å²	93.8	44%	0.439	48%	0.48	S	S	.	.			trans	-75.6	96.5	172.9	-88.8	-23.6	0	0	0	110.5	S939 E943 R944	S939-D941 PolarHBondContact O-N 3.43Å; D941-E943 PolarHBondContact O-N 2.91Å; D941-R944 HydrophobicContact CB-CG 3.92Å; D941-R944 IonicContact OD2-CZ 2.72Å; D941-R944 IonicContact OD2-NE 2.97Å; D941-R944 PolarHBondContact OD2-NE 3.15Å; D941-R944 IonicContact OD2-NH2 3.12Å; D941-R944 PolarHBondContact OD2-NH2 3.32Å
942	K	48	Very low	69.7	Low	211 Å²	211	92.6 Å²	92.6	92%	0.917	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-14.9	168.4	-70.5	-173.7	178.2	178.8	0	113.4	D940	D940-K942 PolarHBondContact O-N 3Å; D940-K942 VanDerWaalsContact O-N 3.15Å
943	E	46	Very low	70	Confident	183 Å²	183	88.7 Å²	88.7	86%	0.855	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.9	6.3	-169.8	-65.4	-168.1	162.2	0	0	115.2	D941 N945	D941-E943 PolarHBondContact O-N 2.91Å; E943-N945 PolarHBondContact O-N 2.73Å
944	R	50.9	Low	69.8	Low	137 Å²	137	85.1 Å²	85.1	52%	0.517	44%	0.444	S	S	.	.			trans	-71.3	110.2	175.7	-83.8	-178.4	-171.2	-167	2.1	110.9	D941 H946	D941-R944 HydrophobicContact CB-CG 3.92Å; D941-R944 IonicContact OD2-CZ 2.72Å; D941-R944 IonicContact OD2-NE 2.97Å; D941-R944 PolarHBondContact OD2-NE 3.15Å; D941-R944 IonicContact OD2-NH2 3.12Å; D941-R944 PolarHBondContact OD2-NH2 3.32Å; R944-H946 VanDerWaalsContact C-N 3.29Å; R944-H946 PolarHBondContact O-CD2 3.23Å; R944-H946 PolarHBondContact O-N 3.41Å
945	N	54.2	Low	69.9	Low	163 Å²	163	86.6 Å²	86.6	87%	0.872	45%	0.451	S	S	*	.			trans	-55.5	96	154.5	-91.7	-24.6	0	0	0	108.3	E943 P947	E943-N945 PolarHBondContact O-N 2.73Å; N945-P947 WeakPolarHBondContact O-CD 3.44Å
946	H	61.6	Low	70.2	Confident	82 Å²	82	86.9 Å²	86.9	38%	0.38	45%	0.454	S	S	.	.			trans	-64.5	124.4	174.4	-71.2	-76.1	0	0	0	108.4	W927 V935 R944 N948	W927-H946 PolarHBondContact O-CE1 3.44Å; V935-H946 VanDerWaalsContact CG1-CE1 3.45Å; V935-H946 WeakPolarHBondContact CG1-CE1 3.45Å; V935-H946 WeakPolarHBondContact CG1-NE2 3.39Å; R944-H946 VanDerWaalsContact C-N 3.29Å; R944-H946 PolarHBondContact O-CD2 3.23Å; R944-H946 PolarHBondContact O-N 3.41Å; H946-N948 PolarHBondContact O-N 2.72Å
947	P	65.6	Low	70.8	Confident	77 Å²	77	83.1 Å²	83.1	50%	0.5	42%	0.423	S	S	.	.			trans	-59.6	132.1	179.1	22.5	-31.6	0	0	0	109.7	N945 V949 V950	N945-P947 WeakPolarHBondContact O-CD 3.44Å; P947-V949 PolarHBondContact O-N 3.27Å; P947-V949 VanDerWaalsContact O-N 3.16Å; P947-V950 HydrophobicContact CB-CG1 4.47Å; P947-V950 HydrophobicContact CG-CG1 3.72Å
948	N	75.5	Confident	71.4	Confident	81 Å²	81	79.6 Å²	79.6	43%	0.433	41%	0.41	S	S	.	.	S	Bend	trans	-62.7	-23.1	-179.6	-168.8	21.5	0	0	0	112.1	H946 R958 V959 K960	H946-N948 PolarHBondContact O-N 2.72Å; N948-R958 CarbonylContact O-C 3.48Å; N948-R958 VanDerWaalsContact O-CA 3.28Å; N948-R958 WeakPolarHBondContact O-CA 3.49Å; N948-V959 PolarHBondContact O-N 3Å; N948-K960 WeakPolarHBondContact OD1-CB 3.29Å
949	V	82.4	Confident	72.2	Confident	74 Å²	74	79.3 Å²	79.3	45%	0.448	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	126.5	175.7	-176.3	0	0	0	0	109.6	P947 A956 W957 R958	P947-V949 PolarHBondContact O-N 3.27Å; P947-V949 VanDerWaalsContact O-N 3.16Å; V949-A956 HydrophobicContact CG1-CB 3.99Å; V949-W957 WeakPolarHBondContact CA-O 3.14Å; V949-R958 HydrophobicContact CG2-CB 4.3Å; V949-R958 HydrophobicContact CG2-CG 4.17Å
950	V	85.2	Confident	73.1	Confident	17 Å²	17	86.1 Å²	86.1	10%	0.103	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	157	176.6	-67.8	0	0	0	0	110.2	T928 P947 A956 W957 V959	T928-V950 HydrophobicContact CG2-CG1 4.13Å; T928-V950 HydrophobicContact CG2-CG2 4.17Å; P947-V950 HydrophobicContact CB-CG1 4.47Å; P947-V950 HydrophobicContact CG-CG1 3.72Å; V950-A956 CarbonylContact O-C 3.56Å; V950-W957 HydrophobicContact CG2-CB 4.1Å; V950-W957 HydrophobicContact CG2-CD2 4.22Å; V950-W957 HydrophobicContact CG2-CE3 3.48Å; V950-W957 VanDerWaalsContact CG2-CE3 3.48Å; V950-W957 HydrophobicContact CG2-CZ3 4.26Å; V950-W957 PolarHBondContact N-O 3.35Å; V950-W957 PolarHBondContact O-N 2.89Å; V950-V959 HydrophobicContact CG1-CG2 4.33Å; V950-V959 HydrophobicContact CG2-CG2 3.64Å
951	M	85.1	Confident	74.4	Confident	119 Å²	119	82.1 Å²	82.1	59%	0.586	42%	0.415	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90	122	172.8	-63.1	-61.7	-76.4	0	0	109.1	G954 I955 A956	M951-G954 VanDerWaalsContact CE-O 3.23Å; M951-G954 WeakPolarHBondContact CE-O 3.22Å; M951-I955 CarbonylContact C-O 3.48Å; M951-I955 WeakPolarHBondContact CA-O 3.49Å; M951-A956 HydrophobicContact SD-CB 4.09Å
952	T	87.2	Confident	76.2	Confident	1 Å²	1	79.6 Å²	79.6	1%	0.006	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	111	176.5	-56.7	0	0	0	0	107.9	F823 Q831 V897 G954 I955 W957	F823-T952 HydrophobicContact CD1-CG2 4.28Å; F823-T952 HydrophobicContact CE1-CG2 3.97Å; F823-T952 HydrophobicContact CZ-CG2 4.34Å; Q831-T952 PolarHBondContact OE1-OG1 3.29Å; V897-T952 HydrophobicContact CG1-CG2 3.63Å; V897-T952 HydrophobicContact CG2-CG2 4.11Å; T952-G954 PolarHBondContact O-N 3.14Å; T952-G954 VanDerWaalsContact O-N 3.1Å; T952-I955 PolarHBondContact N-O 2.7Å; T952-I955 PolarHBondContact O-N 2.86Å; T952-W957 WeakPolarHBondContact OG1-CB 3.06Å
953	L	86.6	Confident	78.1	Confident	22 Å²	22	72.4 Å²	72.4	12%	0.115	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.9	33.3	-177.3	-56	178.2	0	0	0	113.7	L816 I819 L820 Y892 D895 V897	L816-L953 HydrophobicContact CD1-CB 4.16Å; L816-L953 HydrophobicContact CD1-CD1 4.27Å; L816-L953 HydrophobicContact CD1-CD2 4.41Å; L816-L953 HydrophobicContact CG-CB 4.49Å; L816-L953 HydrophobicContact CG-CD1 4.35Å; I819-L953 HydrophobicContact CB-CD1 4.05Å; I819-L953 HydrophobicContact CG2-CD1 3.71Å; L820-L953 HydrophobicContact CD2-CB 4.48Å; L820-L953 HydrophobicContact CD2-CD1 4.05Å; L820-L953 HydrophobicContact CG-CD1 4.13Å; Y892-L953 HydrophobicContact CD1-CD2 3.94Å; Y892-L953 HydrophobicContact CG-CD2 3.96Å; D895-L953 HydrophobicContact CB-CD2 4.04Å; V897-L953 HydrophobicContact CG2-CD2 4.21Å; V897-L953 HydrophobicContact CG2-CG 4.16Å
954	G	79.7	Confident	80.1	Confident	59 Å²	59	66.5 Å²	66.5	61%	0.608	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.5	2	-178.9	0	0	0	0	0	115.9	M951 T952	M951-G954 VanDerWaalsContact CE-O 3.23Å; M951-G954 WeakPolarHBondContact CE-O 3.22Å; T952-G954 PolarHBondContact O-N 3.14Å; T952-G954 VanDerWaalsContact O-N 3.1Å
955	I	85.4	Confident	81.4	Confident	32 Å²	32	62.5 Å²	62.5	16%	0.164	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	143.1	176	-55.6	178.6	0	0	0	109.1	L820 M951 T952 W957 L964 S965 L966	L820-I955 HydrophobicContact CD1-CD1 3.64Å; L820-I955 HydrophobicContact CD2-CD1 4.33Å; M951-I955 CarbonylContact C-O 3.48Å; M951-I955 WeakPolarHBondContact CA-O 3.49Å; T952-I955 PolarHBondContact N-O 2.7Å; T952-I955 PolarHBondContact O-N 2.86Å; I955-W957 PolarHBondContact O-N 3.32Å; I955-L964 HydrophobicContact CG2-CB 4.13Å; I955-L964 HydrophobicContact CG2-CD2 4.45Å; I955-S965 WeakPolarHBondContact CG2-O 3.5Å; I955-L966 HydrophobicContact CG1-CD2 4.28Å
956	A	84.7	Confident	82.1	Confident	10 Å²	10	61.4 Å²	61.4	8%	0.083	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	112.5	177.7	0	0	0	0	0	110.1	V949 V950 M951 L964 S965	V949-A956 HydrophobicContact CG1-CB 3.99Å; V950-A956 CarbonylContact O-C 3.56Å; M951-A956 HydrophobicContact SD-CB 4.09Å; A956-L964 CarbonylContact O-C 3.48Å; A956-S965 WeakPolarHBondContact CB-OG 3.37Å; A956-S965 PolarHBondContact N-O 3.38Å; A956-S965 PolarHBondContact O-N 3.13Å; A956-S965 PolarHBondContact O-OG 3.38Å; A956-S965 VanDerWaalsContact O-OG 3.1Å
957	W	90	Very high	81.8	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	117.4	173	-179.8	39.6	0	0	0	109.8	F823 A829 Q831 T928 N930 V949 V950 T952 I955 V959 D962 T963 L964	F823-W957 AromaticContact CE1-CD2 3.9Å; F823-W957 HydrophobicContact CE1-CD2 3.9Å; F823-W957 AromaticContact CE1-CE2 3.93Å; F823-W957 HydrophobicContact CE1-CE3 4.12Å; F823-W957 HydrophobicContact CE1-CG 4.33Å; F823-W957 HydrophobicContact CE1-CH2 4.46Å; F823-W957 HydrophobicContact CE1-CZ2 4.21Å; F823-W957 HydrophobicContact CE1-CZ3 4.42Å; F823-W957 HydrophobicContact CE2-CH2 4.49Å; F823-W957 AromaticContact CZ-CD2 3.96Å; F823-W957 HydrophobicContact CZ-CD2 3.96Å; F823-W957 AromaticContact CZ-CE2 3.94Å; F823-W957 AromaticContact CZ-CE3 3.78Å; F823-W957 HydrophobicContact CZ-CE3 3.78Å; F823-W957 AromaticContact CZ-CH2 3.66Å; F823-W957 HydrophobicContact CZ-CH2 3.66Å; F823-W957 AromaticContact CZ-CZ2 3.8Å; F823-W957 HydrophobicContact CZ-CZ2 3.8Å; F823-W957 AromaticContact CZ-CZ3 3.66Å; F823-W957 HydrophobicContact CZ-CZ3 3.66Å; A829-W957 HydrophobicContact CB-CH2 3.98Å; A829-W957 HydrophobicContact CB-CZ2 3.69Å; Q831-W957 HydrophobicContact CG-CZ3 4.05Å; T928-W957 HydrophobicContact CG2-CZ3 3.97Å; N930-W957 HydrophobicContact CB-CZ2 3.95Å; V949-W957 WeakPolarHBondContact CA-O 3.14Å; V950-W957 HydrophobicContact CG2-CB 4.1Å; V950-W957 HydrophobicContact CG2-CD2 4.22Å; V950-W957 HydrophobicContact CG2-CE3 3.48Å; V950-W957 VanDerWaalsContact CG2-CE3 3.48Å; V950-W957 HydrophobicContact CG2-CZ3 4.26Å; V950-W957 PolarHBondContact N-O 3.35Å; V950-W957 PolarHBondContact O-N 2.89Å; T952-W957 WeakPolarHBondContact OG1-CB 3.06Å; I955-W957 PolarHBondContact O-N 3.32Å; W957-V959 HydrophobicContact CD2-CG2 4.24Å; W957-V959 HydrophobicContact CE3-CG2 4.03Å; W957-V959 HydrophobicContact CH2-CG1 4.3Å; W957-V959 HydrophobicContact CZ2-CG1 4.47Å; W957-V959 HydrophobicContact CZ3-CG2 4.2Å; W957-D962 PolarHBondContact NE1-OD1 3.34Å; W957-T963 WeakPolarHBondContact CA-O 3.38Å; W957-L964 HydrophobicContact CB-CD2 3.59Å; W957-L964 HydrophobicContact CG-CD2 3.84Å
958	R	87.2	Confident	80.8	Confident	106 Å²	106	64.9 Å²	64.9	40%	0.4	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	109.9	170	-172	-176.8	-66.6	171.7	0.5	108.6	N948 V949 D961 D962 T963	N948-R958 CarbonylContact O-C 3.48Å; N948-R958 VanDerWaalsContact O-CA 3.28Å; N948-R958 WeakPolarHBondContact O-CA 3.49Å; V949-R958 HydrophobicContact CG2-CB 4.3Å; V949-R958 HydrophobicContact CG2-CG 4.17Å; R958-D961 WeakPolarHBondContact CD-OD2 3.47Å; R958-D961 HydrophobicContact CG-CB 4.32Å; R958-D961 IonicContact CZ-OD2 2.9Å; R958-D961 IonicContact NE-OD2 3.78Å; R958-D961 IonicContact NH1-OD2 2.9Å; R958-D961 PolarHBondContact NH1-OD2 3.34Å; R958-D961 VanDerWaalsContact NH1-OD2 3.07Å; R958-D962 VanDerWaalsContact O-CA 3.28Å; R958-D962 WeakPolarHBondContact O-CA 3.45Å; R958-D962 PolarHBondContact O-N 3.42Å; R958-T963 PolarHBondContact N-O 3.05Å; R958-T963 PolarHBondContact O-N 3.23Å; R958-T963 VanDerWaalsContact O-N 3.11Å
959	V	88.3	Confident	79	Confident	14 Å²	14	69.6 Å²	69.6	9%	0.085	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-45.2	-165.2	-177.7	0	0	0	0	111.7	T928 S929 N930 N948 V950 W957 D962	T928-V959 HydrophobicContact CG2-CG1 4.09Å; T928-V959 HydrophobicContact CG2-CG2 3.66Å; S929-V959 VanDerWaalsContact C-CG1 3.44Å; S929-V959 WeakPolarHBondContact O-CG1 3.29Å; N930-V959 VanDerWaalsContact CB-O 3.31Å; N930-V959 WeakPolarHBondContact CB-O 3.45Å; N948-V959 PolarHBondContact O-N 3Å; V950-V959 HydrophobicContact CG1-CG2 4.33Å; V950-V959 HydrophobicContact CG2-CG2 3.64Å; W957-V959 HydrophobicContact CD2-CG2 4.24Å; W957-V959 HydrophobicContact CE3-CG2 4.03Å; W957-V959 HydrophobicContact CH2-CG1 4.3Å; W957-V959 HydrophobicContact CZ2-CG1 4.47Å; W957-V959 HydrophobicContact CZ3-CG2 4.2Å; V959-D962 PolarHBondContact O-N 2.85Å
960	K	83.4	Confident	76.8	Confident	170 Å²	170	75.5 Å²	75.5	74%	0.739	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-43	-176.9	-173.1	-178.6	179.2	-177.5	0	112.9	N948 D962	N948-K960 WeakPolarHBondContact OD1-CB 3.29Å; K960-D962 VanDerWaalsContact C-N 3.31Å
961	D	84.2	Confident	74.4	Confident	85 Å²	85	80.4 Å²	80.4	46%	0.455	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-10.2	-179.7	-59.4	-16.4	0	0	0	111.8	R958 T963	R958-D961 WeakPolarHBondContact CD-OD2 3.47Å; R958-D961 HydrophobicContact CG-CB 4.32Å; R958-D961 IonicContact CZ-OD2 2.9Å; R958-D961 IonicContact NE-OD2 3.78Å; R958-D961 IonicContact NH1-OD2 2.9Å; R958-D961 PolarHBondContact NH1-OD2 3.34Å; R958-D961 VanDerWaalsContact NH1-OD2 3.07Å; D961-T963 HydrophobicContact CB-CG2 4.14Å; D961-T963 PolarHBondContact O-N 3.24Å
962	D	89.7	Confident	72.1	Confident	28 Å²	28	81 Å²	81	15%	0.15	43%	0.43	C	S	.	.	T	Hydrogen-bonded Turn	trans	49.8	51.2	-172.3	-171	29.5	0	0	0	113.4	R824 N930 W957 R958 V959 K960	R824-D962 IonicContact CZ-OD2 3.74Å; R824-D962 PolarHBondContact NH1-O 3.11Å; R824-D962 IonicContact NH1-OD1 2.72Å; R824-D962 PolarHBondContact NH1-OD1 2.78Å; R824-D962 IonicContact NH1-OD2 2.93Å; R824-D962 PolarHBondContact NH1-OD2 3.47Å; R824-D962 PolarHBondContact NH2-O 3.39Å; R824-D962 VanDerWaalsContact NH2-O 3.11Å; R824-D962 IonicContact NH2-OD2 3.11Å; N930-D962 HydrophobicContact CB-CB 4.13Å; N930-D962 VanDerWaalsContact ND2-CG 3.34Å; N930-D962 PolarHBondContact ND2-OD2 2.79Å; W957-D962 PolarHBondContact NE1-OD1 3.34Å; R958-D962 VanDerWaalsContact O-CA 3.28Å; R958-D962 WeakPolarHBondContact O-CA 3.45Å; R958-D962 PolarHBondContact O-N 3.42Å; V959-D962 PolarHBondContact O-N 2.85Å; K960-D962 VanDerWaalsContact C-N 3.31Å
963	T	87.3	Confident	69.9	Low	61 Å²	61	89.5 Å²	89.5	37%	0.374	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	138.5	-177.6	51.9	0	0	0	0	112.1	W957 R958 D961	W957-T963 WeakPolarHBondContact CA-O 3.38Å; R958-T963 PolarHBondContact N-O 3.05Å; R958-T963 PolarHBondContact O-N 3.23Å; R958-T963 VanDerWaalsContact O-N 3.11Å; D961-T963 HydrophobicContact CB-CG2 4.14Å; D961-T963 PolarHBondContact O-N 3.24Å
964	L	87.2	Confident	67.7	Low	59 Å²	59	94.1 Å²	94.1	31%	0.309	50%	0.501	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	135.3	173.9	-64.5	178	0	0	0	109.6	L820 R824 I955 A956 W957	L820-L964 HydrophobicContact CD2-CD1 4.4Å; R824-L964 HydrophobicContact CG-CD1 4.04Å; I955-L964 HydrophobicContact CG2-CB 4.13Å; I955-L964 HydrophobicContact CG2-CD2 4.45Å; A956-L964 CarbonylContact O-C 3.48Å; W957-L964 HydrophobicContact CB-CD2 3.59Å; W957-L964 HydrophobicContact CG-CD2 3.84Å
965	S	79.9	Confident	65.8	Low	53 Å²	53	98.6 Å²	98.6	37%	0.371	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	137.1	-179.9	59.3	0	0	0	0	111	I955 A956	I955-S965 WeakPolarHBondContact CG2-O 3.5Å; A956-S965 WeakPolarHBondContact CB-OG 3.37Å; A956-S965 PolarHBondContact N-O 3.38Å; A956-S965 PolarHBondContact O-N 3.13Å; A956-S965 PolarHBondContact O-OG 3.38Å; A956-S965 VanDerWaalsContact O-OG 3.1Å
966	L	67.8	Low	63.6	Low	140 Å²	140	103.9 Å²	103.9	73%	0.733	54%	0.54	S	S	*	.			trans	-89.3	110.4	171.2	-73.3	162.3	0	0	0	107.3	I955 S968	I955-L966 HydrophobicContact CG1-CD2 4.28Å; L966-S968 PolarHBondContact O-N 2.98Å
967	H	56.5	Low	61.3	Low	168 Å²	168	109.4 Å²	109.4	78%	0.778	57%	0.572	S	S	*	*			trans	-75.8	77.2	171.7	-161.9	81.5	0	0	0	108.8
968	S	44.2	Very low	58.7	Low	64 Å²	64	118.9 Å²	118.9	45%	0.448	61%	0.614	S	S	.	*			trans	-72.9	128.9	162.7	46.8	0	0	0	0	107.8	L966 W970	L966-S968 PolarHBondContact O-N 2.98Å; S968-W970 VanDerWaalsContact CB-CD1 3.45Å; S968-W970 PolarHBondContact O-N 2.84Å
969	M	38	Very low	56.1	Low	179 Å²	179	118.9 Å²	118.9	88%	0.882	63%	0.63	S	S	*	*			trans	-65.6	50.9	166.1	-59.8	179.7	-60.1	0	0	111.2
970	W	36.2	Very low	53.7	Low	199 Å²	199	126.9 Å²	126.9	75%	0.754	67%	0.667	S	S	*	*			trans	-66	134.3	157.8	-73	106.7	0	0	0	106.2	S968 T972	S968-W970 VanDerWaalsContact CB-CD1 3.45Å; S968-W970 PolarHBondContact O-N 2.84Å; W970-T972 PolarHBondContact O-N 3.09Å
971	P	34.9	Very low	51.4	Low	119 Å²	119	126 Å²	126	77%	0.773	67%	0.67	S	S	*	*			trans	-55.6	107.7	172.5	21.7	-29.5	0	0	0	107.7	E973	P971-E973 PolarHBondContact O-N 2.8Å
972	T	36.7	Very low	48.9	Very low	132 Å²	132	129.1 Å²	129.1	81%	0.81	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-70.2	118.5	171.4	37.7	0	0	0	0	106.8	W970	W970-T972 PolarHBondContact O-N 3.09Å
973	E	41.1	Very low	46.1	Very low	180 Å²	180	132 Å²	132	84%	0.841	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-54.3	138.7	164.4	-73.7	-177.2	165.9	0	0	108.8	P971	P971-E973 PolarHBondContact O-N 2.8Å
974	P	39	Very low	43.5	Very low	118 Å²	118	139.6 Å²	139.6	77%	0.766	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-58.5	139.4	-172.1	21.9	-32.3	0	0	0	111.9	N976	P974-N976 PolarHBondContact O-N 2.96Å
975	D	41	Very low	40.7	Very low	154 Å²	154	146.3 Å²	146.3	82%	0.824	77%	0.767	S	S	*	*			trans	-39.3	102	-174.9	-69.1	-48.1	0	0	0	114.1	T977	D975-T977 PolarHBondContact O-N 3.23Å; D975-T977 VanDerWaalsContact O-N 3.1Å
976	N	38.6	Very low	38.4	Very low	143 Å²	143	154.9 Å²	154.9	77%	0.765	79%	0.792	S	S	*	*			trans	-74.6	98.3	158.7	-96.8	-12.5	0	0	0	108	P974 F978	P974-N976 PolarHBondContact O-N 2.96Å; N976-F978 HydrophobicContact CB-CE2 4.44Å; N976-F978 WeakPolarHBondContact O-CD2 3.42Å; N976-F978 PolarHBondContact O-N 3.12Å
977	T	35.5	Very low	36.7	Very low	125 Å²	125	151.3 Å²	151.3	77%	0.767	79%	0.789	S	S	*	*			trans	-56.4	98.4	170.7	27	0	0	0	0	110.3	D975 S979	D975-T977 PolarHBondContact O-N 3.23Å; D975-T977 VanDerWaalsContact O-N 3.1Å; T977-S979 PolarHBondContact O-N 3.45Å
978	F	35.3	Very low	35.5	Very low	199 Å²	199	153.3 Å²	153.3	87%	0.873	80%	0.795	S	S	*	*			trans	-84.2	88.5	159.5	-71	-82.8	0	0	0	107.9	N976	N976-F978 HydrophobicContact CB-CE2 4.44Å; N976-F978 WeakPolarHBondContact O-CD2 3.42Å; N976-F978 PolarHBondContact O-N 3.12Å
979	S	33.7	Very low	34.8	Very low	106 Å²	106	155.8 Å²	155.8	74%	0.741	81%	0.808	S	S	*	*			trans	-85.2	110.3	156.8	58.5	0	0	0	0	107.3	T977	T977-S979 PolarHBondContact O-N 3.45Å
980	E	37.4	Very low	34.4	Very low	182 Å²	182	154.9 Å²	154.9	85%	0.85	81%	0.805	S	S	*	*			trans	-157.1	114	154.6	-115.6	167.7	-157.2	0	0	110.4	V982	E980-V982 PolarHBondContact O-N 2.98Å
981	D	34.7	Very low	34	Very low	153 Å²	153	153.6 Å²	153.6	82%	0.818	81%	0.805	S	S	*	*			trans	-36.6	116.2	172.3	-67.1	-56.2	0	0	0	114.7
982	V	33.1	Very low	33.8	Very low	150 Å²	150	152.3 Å²	152.3	91%	0.909	81%	0.805	S	S	*	*			trans	-111.3	74.9	164.7	-169.8	0	0	0	0	108.4	E980	E980-V982 PolarHBondContact O-N 2.98Å
983	S	30.2	Very low	33.4	Very low	89 Å²	89	151.6 Å²	151.6	62%	0.622	80%	0.796	S	S	*	*			trans	-139.3	80.5	173.7	53.3	0	0	0	0	111
984	Y	33.3	Very low	32.9	Very low	219 Å²	219	150.3 Å²	150.3	86%	0.859	80%	0.8	S	S	*	*			trans	-129.9	88.8	157.9	-87.6	-76.4	0	0	0	109.9	R986	Y984-R986 PolarHBondContact O-N 2.9Å
985	E	28.6	Very low	32.6	Very low	200 Å²	200	149.9 Å²	149.9	94%	0.935	79%	0.791	S	S	*	*			trans	-70.4	98.4	157.4	-69	-172	157.8	0	0	108.3
986	R	30.7	Very low	32.2	Very low	233 Å²	233	151.8 Å²	151.8	88%	0.879	80%	0.795	S	S	*	*			trans	-84.5	124.2	171.4	-85	-171.6	176.4	-172.9	0.3	110.6	Y984	Y984-R986 PolarHBondContact O-N 2.9Å
987	G	32.8	Very low	32.1	Very low	66 Å²	66	151.4 Å²	151.4	68%	0.68	80%	0.797	S	S	*	*			trans	-56.9	148	-179	0	0	0	0	0	115.1	T989	G987-T989 PolarHBondContact O-N 2.64Å; G987-T989 VanDerWaalsContact O-N 3.08Å
988	K	29.8	Very low	32.4	Very low	209 Å²	209	148 Å²	148	91%	0.909	79%	0.787	S	S	*	*			trans	-60.4	99.9	178.5	-68.8	171.3	177.1	171.1	0	111.3
989	T	30.2	Very low	32.8	Very low	116 Å²	116	146 Å²	146	71%	0.712	79%	0.785	S	S	*	*			trans	-87.6	118.2	163.3	-13.2	0	0	0	0	108.6	G987 F991	G987-T989 PolarHBondContact O-N 2.64Å; G987-T989 VanDerWaalsContact O-N 3.08Å; T989-F991 PolarHBondContact O-N 3.22Å
990	I	29.4	Very low	33.6	Very low	160 Å²	160	147.2 Å²	147.2	82%	0.821	78%	0.784	S	S	*	*			trans	-80.9	104.3	-178.2	-59	169.6	0	0	0	108
991	F	28.9	Very low	34.5	Very low	172 Å²	172	141 Å²	141	75%	0.754	75%	0.754	S	S	*	*			trans	-84.2	113.8	170.6	-77.7	-90.5	0	0	0	109.9	T989 N993	T989-F991 PolarHBondContact O-N 3.22Å; F991-N993 PolarHBondContact O-N 3.41Å
992	A	29.4	Very low	35.5	Very low	92 Å²	92	136.8 Å²	136.8	76%	0.76	75%	0.746	S	S	*	*			trans	-89.7	89.8	170.1	0	0	0	0	0	109.6	V994	A992-V994 PolarHBondContact O-N 3.04Å
993	N	29.2	Very low	37	Very low	117 Å²	117	138.9 Å²	138.9	63%	0.626	74%	0.738	S	S	*	*			trans	-82.2	111.7	173.9	-80	-7.6	0	0	0	110.7	F991 L995	F991-N993 PolarHBondContact O-N 3.41Å; N993-L995 HydrophobicContact CB-CD1 3.81Å; N993-L995 HydrophobicContact CB-CG 4.26Å; N993-L995 PolarHBondContact O-N 2.84Å
994	V	30.7	Very low	39.1	Very low	153 Å²	153	136.4 Å²	136.4	93%	0.927	72%	0.718	S	S	*	*			trans	-73.3	104.2	162.8	-178.7	0	0	0	0	106.9	A992	A992-V994 PolarHBondContact O-N 3.04Å
995	L	31.7	Very low	41.3	Very low	110 Å²	110	127 Å²	127	58%	0.576	69%	0.686	S	S	*	*			trans	-115.3	127.6	-175.4	-93.2	153.4	0	0	0	110.7	N993 V997	N993-L995 HydrophobicContact CB-CD1 3.81Å; N993-L995 HydrophobicContact CB-CG 4.26Å; N993-L995 PolarHBondContact O-N 2.84Å; L995-V997 PolarHBondContact O-N 3.04Å
996	Q	32.7	Very low	43.9	Very low	193 Å²	193	117.9 Å²	117.9	90%	0.902	64%	0.643	S	S	*	*			trans	-44.8	122.4	174.1	-125.8	171.8	-8.6	0	0	110.8	G998	Q996-G998 VanDerWaalsContact C-N 3.32Å; Q996-G998 PolarHBondContact O-N 3.31Å
997	V	37.3	Very low	46.5	Very low	136 Å²	136	112.4 Å²	112.4	82%	0.824	63%	0.628	S	S	*	*			trans	-74.3	82.2	-176.6	-174.7	0	0	0	0	109.4	L995	L995-V997 PolarHBondContact O-N 3.04Å
998	G	40.2	Very low	49.2	Very low	54 Å²	54	119.1 Å²	119.1	56%	0.557	63%	0.633	S	S	*	*			trans	-73.6	135.5	154.3	0	0	0	0	0	108.2	Q996 D1000	Q996-G998 VanDerWaalsContact C-N 3.32Å; Q996-G998 PolarHBondContact O-N 3.31Å; G998-D1000 PolarHBondContact O-N 2.83Å
999	N	45.1	Very low	52	Low	155 Å²	155	110.4 Å²	110.4	83%	0.829	60%	0.595	S	S	*	*	S	Bend	trans	-63.2	19.5	178.3	-93	-19.4	0	0	0	114.6
1000	D	50.6	Low	54.6	Low	133 Å²	133	108.1 Å²	108.1	71%	0.711	59%	0.587	S	S	*	*			trans	-85.9	129	-177	-82.5	-28.4	0	0	0	110.9	G998 G1002	G998-D1000 PolarHBondContact O-N 2.83Å; D1000-G1002 PolarHBondContact O-N 3.44Å
1001	F	55.7	Low	57.5	Low	51 Å²	51	105.8 Å²	105.8	22%	0.224	57%	0.573	C	S	.	*	G	3₁₀ helix	trans	-59.7	13.6	159.9	-75.4	-91.5	0	0	0	113.3	R1003 L1004 T1019 L1023 W1053 I1056	F1001-R1003 PolarHBondContact O-N 3.29Å; F1001-L1004 HydrophobicContact CD1-CD1 3.98Å; F1001-L1004 WeakPolarHBondContact O-CA 3.37Å; F1001-L1004 PolarHBondContact O-N 2.96Å; F1001-T1019 HydrophobicContact CD1-CG2 4.06Å; F1001-T1019 HydrophobicContact CE1-CG2 3.54Å; F1001-T1019 HydrophobicContact CZ-CG2 4.07Å; F1001-L1023 HydrophobicContact CE1-CD2 4.28Å; F1001-L1023 HydrophobicContact CE1-CG 4.21Å; F1001-L1023 HydrophobicContact CZ-CD1 4.18Å; F1001-L1023 HydrophobicContact CZ-CD2 3.62Å; F1001-L1023 HydrophobicContact CZ-CG 3.86Å; F1001-W1053 HydrophobicContact CB-CH2 4.46Å; F1001-I1056 HydrophobicContact CB-CD1 3.95Å; F1001-I1056 HydrophobicContact CD2-CD1 3.65Å; F1001-I1056 HydrophobicContact CE2-CD1 4.47Å; F1001-I1056 HydrophobicContact CG-CD1 4.11Å
1002	G	55.4	Low	60.6	Low	64 Å²	64	98.3 Å²	98.3	66%	0.66	54%	0.54	S	S	*	.	G	3₁₀ helix	trans	-55	-17.8	-174.2	0	0	0	0	0	115	D1000	D1000-G1002 PolarHBondContact O-N 3.44Å
1003	R	64.6	Low	63.7	Low	195 Å²	195	97 Å²	97	74%	0.736	52%	0.518	S	S	*	.	G	3₁₀ helix	trans	-74.2	-30.7	170.8	-68.5	-167.7	179	-168.7	1	113.8	F1001 A1005	F1001-R1003 PolarHBondContact O-N 3.29Å; R1003-A1005 VanDerWaalsContact C-N 3.28Å; R1003-A1005 PolarHBondContact O-N 3.17Å; R1003-A1005 VanDerWaalsContact O-N 3.15Å
1004	L	74.8	Confident	66.8	Low	36 Å²	36	99.1 Å²	99.1	19%	0.188	52%	0.518	C	S	.	.	S	Bend	trans	-85.2	70.7	172.9	-79.3	161	0	0	0	108.9	F1001 P1006 F1009 V1018 C1022 W1053	F1001-L1004 HydrophobicContact CD1-CD1 3.98Å; F1001-L1004 WeakPolarHBondContact O-CA 3.37Å; F1001-L1004 PolarHBondContact O-N 2.96Å; L1004-P1006 VanDerWaalsContact O-CD 3.29Å; L1004-P1006 WeakPolarHBondContact O-CD 3.48Å; L1004-P1006 VanDerWaalsContact O-N 3.09Å; L1004-F1009 HydrophobicContact CD2-CE2 4.26Å; L1004-F1009 HydrophobicContact CD2-CZ 4Å; L1004-V1018 HydrophobicContact CD2-CG1 3.77Å; L1004-C1022 HydrophobicContact CD1-CB 4.26Å; L1004-W1053 HydrophobicContact CB-CZ2 4.21Å; L1004-W1053 WeakPolarHBondContact O-CH2 3.26Å
1005	A	79.3	Confident	69.8	Low	23 Å²	23	91.9 Å²	91.9	19%	0.19	47%	0.474	C	S	.	.			trans	-57.5	114.8	177.2	0	0	0	0	0	110.3	R1003 E1007 R1008	R1003-A1005 VanDerWaalsContact C-N 3.28Å; R1003-A1005 PolarHBondContact O-N 3.17Å; R1003-A1005 VanDerWaalsContact O-N 3.15Å; A1005-E1007 PolarHBondContact O-N 2.88Å; A1005-E1007 VanDerWaalsContact O-N 3.15Å; A1005-R1008 HydrophobicContact CB-CG 4.1Å; A1005-R1008 WeakPolarHBondContact O-CB 3.43Å; A1005-R1008 PolarHBondContact O-N 2.83Å
1006	P	84.1	Confident	72.8	Confident	7 Å²	7	86.9 Å²	86.9	5%	0.045	45%	0.447	C	S	.	.	G	3₁₀ helix	trans	-63.1	-23.3	-176.3	26.4	-34.4	0	0	0	111.9	L1004 R1008 F1009 L1015 W1053 H1120 V1121	L1004-P1006 VanDerWaalsContact O-CD 3.29Å; L1004-P1006 WeakPolarHBondContact O-CD 3.48Å; L1004-P1006 VanDerWaalsContact O-N 3.09Å; P1006-R1008 PolarHBondContact O-N 2.72Å; P1006-R1008 VanDerWaalsContact O-N 3.16Å; P1006-F1009 PolarHBondContact O-N 2.83Å; P1006-L1015 HydrophobicContact CB-CD1 4.4Å; P1006-L1015 HydrophobicContact CB-CD2 4.19Å; P1006-W1053 HydrophobicContact CB-CH2 4.12Å; P1006-W1053 HydrophobicContact CB-CZ3 4.12Å; P1006-W1053 HydrophobicContact CG-CH2 4.14Å; P1006-W1053 HydrophobicContact CG-CZ3 3.95Å; P1006-H1120 PolarHBondContact O-CD2 3.08Å; P1006-H1120 PolarHBondContact O-NE2 3.29Å; P1006-H1120 VanDerWaalsContact O-NE2 3.1Å; P1006-V1121 HydrophobicContact CB-CG2 3.65Å; P1006-V1121 HydrophobicContact CG-CG2 3.97Å
1007	E	85.3	Confident	75.8	Confident	118 Å²	118	83.4 Å²	83.4	55%	0.551	43%	0.426	S	S	*	.	G	3₁₀ helix	trans	-60.5	-21.6	175.5	-59	74	-157.2	0	0	112.8	A1005 F1009 H1120	A1005-E1007 PolarHBondContact O-N 2.88Å; A1005-E1007 VanDerWaalsContact O-N 3.15Å; E1007-F1009 VanDerWaalsContact C-N 3.26Å; E1007-F1009 PolarHBondContact O-N 3.43Å; E1007-H1120 WeakPolarHBondContact CA-NE2 3.46Å
1008	R	87.7	Confident	78.5	Confident	207 Å²	207	79.1 Å²	79.1	78%	0.781	40%	0.4	S	S	*	.	G	3₁₀ helix	trans	-78.8	-8.7	176.3	-62.7	-178.9	179.9	-170.9	-0.1	113.4	A1005 P1006	A1005-R1008 HydrophobicContact CB-CG 4.1Å; A1005-R1008 WeakPolarHBondContact O-CB 3.43Å; A1005-R1008 PolarHBondContact O-N 2.83Å; P1006-R1008 PolarHBondContact O-N 2.72Å; P1006-R1008 VanDerWaalsContact O-N 3.16Å
1009	F	89.1	Confident	81	Confident	27 Å²	27	76.5 Å²	76.5	12%	0.118	37%	0.373	C	S	.	.			trans	-106.7	134.9	-178.1	-63.7	-97.1	0	0	0	110.8	L1004 P1006 E1007 R1014 L1015 V1018 H1120 L1124	L1004-F1009 HydrophobicContact CD2-CE2 4.26Å; L1004-F1009 HydrophobicContact CD2-CZ 4Å; P1006-F1009 PolarHBondContact O-N 2.83Å; E1007-F1009 VanDerWaalsContact C-N 3.26Å; E1007-F1009 PolarHBondContact O-N 3.43Å; F1009-R1014 HydrophobicContact CD1-CB 4.46Å; F1009-R1014 HydrophobicContact CD1-CG 4.13Å; F1009-R1014 HydrophobicContact CE1-CG 4.37Å; F1009-L1015 HydrophobicContact CB-CB 4.12Å; F1009-L1015 HydrophobicContact CB-CD1 4.44Å; F1009-L1015 HydrophobicContact CD1-CB 4.14Å; F1009-L1015 HydrophobicContact CD1-CD1 4.37Å; F1009-L1015 HydrophobicContact CD2-CD1 3.54Å; F1009-L1015 HydrophobicContact CE2-CD1 3.75Å; F1009-L1015 HydrophobicContact CG-CB 4.04Å; F1009-L1015 HydrophobicContact CG-CD1 3.87Å; F1009-L1015 HydrophobicContact CZ-CD1 4.26Å; F1009-V1018 HydrophobicContact CE1-CB 4.04Å; F1009-V1018 HydrophobicContact CE1-CG1 4.33Å; F1009-V1018 HydrophobicContact CE1-CG2 3.97Å; F1009-V1018 HydrophobicContact CZ-CB 4.24Å; F1009-V1018 HydrophobicContact CZ-CG1 4.08Å; F1009-H1120 PolarHBondContact O-NE2 3.45Å; F1009-L1124 HydrophobicContact CB-CD1 4.22Å; F1009-L1124 WeakPolarHBondContact O-CD2 3.32Å
1010	A	86	Confident	83.3	Confident	67 Å²	67	69.1 Å²	69.1	55%	0.554	33%	0.334	S	S	*	.	S	Bend	trans	-97.4	-16.7	176.7	0	0	0	0	0	113.5	L1124	A1010-L1124 WeakPolarHBondContact O-CD2 3.32Å
1011	Q	90.4	Very high	85.3	Confident	112 Å²	112	67.2 Å²	67.2	52%	0.523	32%	0.323	S	S	.	.			trans	-127.9	134.7	-177.3	-71.6	177.6	-27.9	0	0	109.9	R1014 L1015	Q1011-R1014 HydrophobicContact CB-CB 4.16Å; Q1011-R1014 PolarHBondContact O-N 3.22Å; Q1011-L1015 PolarHBondContact O-N 3.45Å
1012	F	94.3	Very high	87	Confident	14 Å²	14	67.1 Å²	67.1	6%	0.061	33%	0.328	C	S	.	.	H	α-helix	trans	-63.3	-47.7	179.9	-173.2	-110.8	0	0	0	111.8	R1014 L1015 I1016 E1050 V1121 L1124 L1125 D1128	F1012-R1014 VanDerWaalsContact C-N 3.26Å; F1012-R1014 PolarHBondContact O-N 3.34Å; F1012-L1015 VanDerWaalsContact O-CB 3.31Å; F1012-L1015 WeakPolarHBondContact O-CB 3.37Å; F1012-L1015 PolarHBondContact O-N 3.15Å; F1012-I1016 HydrophobicContact CD1-CG1 4.21Å; F1012-I1016 HydrophobicContact CE1-CD1 4.3Å; F1012-I1016 HydrophobicContact CE1-CG1 3.89Å; F1012-I1016 HydrophobicContact CE2-CD1 4.11Å; F1012-I1016 HydrophobicContact CE2-CG1 4.4Å; F1012-I1016 HydrophobicContact CZ-CD1 3.88Å; F1012-I1016 HydrophobicContact CZ-CG1 4Å; F1012-I1016 WeakPolarHBondContact O-CG1 2.88Å; F1012-I1016 PolarHBondContact O-N 3.41Å; F1012-E1050 HydrophobicContact CZ-CG 4.2Å; F1012-V1121 HydrophobicContact CE2-CG1 3.97Å; F1012-L1124 HydrophobicContact CB-CB 4.07Å; F1012-L1124 HydrophobicContact CD2-CB 4.11Å; F1012-L1125 HydrophobicContact CD2-CB 3.93Å; F1012-L1125 HydrophobicContact CE1-CD1 4.38Å; F1012-L1125 HydrophobicContact CE1-CG 4.45Å; F1012-L1125 HydrophobicContact CE2-CB 3.89Å; F1012-L1125 HydrophobicContact CE2-CD1 4.19Å; F1012-L1125 HydrophobicContact CE2-CG 4.42Å; F1012-L1125 HydrophobicContact CG-CB 4.31Å; F1012-L1125 HydrophobicContact CZ-CB 4.22Å; F1012-L1125 HydrophobicContact CZ-CD1 3.86Å; F1012-L1125 HydrophobicContact CZ-CG 4.26Å; F1012-D1128 HydrophobicContact CB-CB 3.75Å
1013	E	93.2	Very high	88.6	Confident	64 Å²	64	65.8 Å²	65.8	30%	0.299	31%	0.306	S	S	.	.	H	α-helix	trans	-54.6	-41.2	177.9	-172.8	64.6	-150.4	0	0	112.5	I1016 R1017 R1132	E1013-I1016 PolarHBondContact O-N 3.02Å; E1013-R1017 VanDerWaalsContact O-CG 3.31Å; E1013-R1017 WeakPolarHBondContact O-CG 3.46Å; E1013-R1017 PolarHBondContact O-N 2.86Å; E1013-R1017 IonicContact OE1-NH1 2.78Å; E1013-R1132 IonicContact OE2-NH2 3.31Å; E1013-R1132 PolarHBondContact OE2-NH2 3.41Å
1014	R	94.3	Very high	89.9	Confident	163 Å²	163	57.7 Å²	57.7	62%	0.615	28%	0.275	S	S	*	.	H	α-helix	trans	-66.9	-38.3	178.1	-171.4	175.2	177.5	172.3	-0.4	112.2	F1009 Q1011 F1012 V1018	F1009-R1014 HydrophobicContact CD1-CB 4.46Å; F1009-R1014 HydrophobicContact CD1-CG 4.13Å; F1009-R1014 HydrophobicContact CE1-CG 4.37Å; Q1011-R1014 HydrophobicContact CB-CB 4.16Å; Q1011-R1014 PolarHBondContact O-N 3.22Å; F1012-R1014 VanDerWaalsContact C-N 3.26Å; F1012-R1014 PolarHBondContact O-N 3.34Å; R1014-V1018 WeakPolarHBondContact O-CB 3.41Å; R1014-V1018 WeakPolarHBondContact O-CG2 3.42Å; R1014-V1018 PolarHBondContact O-N 3.04Å; R1014-V1018 VanDerWaalsContact O-N 3.12Å
1015	L	94.3	Very high	90.6	Very high	0 Å²	0	63 Å²	63	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-60.7	-47.8	174.2	176.1	66.3	0	0	0	110.5	P1006 F1009 Q1011 F1012 T1019 W1053 V1121 L1124	P1006-L1015 HydrophobicContact CB-CD1 4.4Å; P1006-L1015 HydrophobicContact CB-CD2 4.19Å; F1009-L1015 HydrophobicContact CB-CB 4.12Å; F1009-L1015 HydrophobicContact CB-CD1 4.44Å; F1009-L1015 HydrophobicContact CD1-CB 4.14Å; F1009-L1015 HydrophobicContact CD1-CD1 4.37Å; F1009-L1015 HydrophobicContact CD2-CD1 3.54Å; F1009-L1015 HydrophobicContact CE2-CD1 3.75Å; F1009-L1015 HydrophobicContact CG-CB 4.04Å; F1009-L1015 HydrophobicContact CG-CD1 3.87Å; F1009-L1015 HydrophobicContact CZ-CD1 4.26Å; Q1011-L1015 PolarHBondContact O-N 3.45Å; F1012-L1015 VanDerWaalsContact O-CB 3.31Å; F1012-L1015 WeakPolarHBondContact O-CB 3.37Å; F1012-L1015 PolarHBondContact O-N 3.15Å; L1015-T1019 WeakPolarHBondContact O-CB 3.26Å; L1015-T1019 PolarHBondContact O-N 3.09Å; L1015-T1019 PolarHBondContact O-OG1 3.33Å; L1015-W1053 HydrophobicContact CD1-CZ2 3.66Å; L1015-W1053 HydrophobicContact CD2-CD2 4.24Å; L1015-W1053 HydrophobicContact CD2-CG 4.42Å; L1015-W1053 HydrophobicContact CG-CZ2 4.41Å; L1015-V1121 HydrophobicContact CD2-CG1 4.38Å; L1015-V1121 HydrophobicContact CD2-CG2 4.32Å; L1015-L1124 HydrophobicContact CD2-CD1 4.18Å
1016	I	95.3	Very high	91	Very high	5 Å²	5	64.9 Å²	64.9	3%	0.026	31%	0.306	C	S	.	.	H	α-helix	trans	-63.4	-48.7	-179.8	-59.8	-45.5	0	0	0	111.4	F1012 E1013 V1018 T1019 A1020 L1046 A1049 E1050	F1012-I1016 HydrophobicContact CD1-CG1 4.21Å; F1012-I1016 HydrophobicContact CE1-CD1 4.3Å; F1012-I1016 HydrophobicContact CE1-CG1 3.89Å; F1012-I1016 HydrophobicContact CE2-CD1 4.11Å; F1012-I1016 HydrophobicContact CE2-CG1 4.4Å; F1012-I1016 HydrophobicContact CZ-CD1 3.88Å; F1012-I1016 HydrophobicContact CZ-CG1 4Å; F1012-I1016 WeakPolarHBondContact O-CG1 2.88Å; F1012-I1016 PolarHBondContact O-N 3.41Å; E1013-I1016 PolarHBondContact O-N 3.02Å; I1016-V1018 PolarHBondContact O-N 2.97Å; I1016-T1019 PolarHBondContact O-N 2.69Å; I1016-A1020 WeakPolarHBondContact O-CB 3.1Å; I1016-A1020 PolarHBondContact O-N 2.73Å; I1016-L1046 HydrophobicContact CG2-CB 4.25Å; I1016-L1046 HydrophobicContact CG2-CD2 4.06Å; I1016-L1046 WeakPolarHBondContact CG2-O 3.49Å; I1016-A1049 HydrophobicContact CG2-CB 3.96Å; I1016-E1050 HydrophobicContact CD1-CB 4.16Å
1017	R	95.1	Very high	91.2	Very high	121 Å²	121	67.5 Å²	67.5	46%	0.457	32%	0.315	S	S	.	.	H	α-helix	trans	-61.6	-44	-179.4	-69.1	175.8	80.9	97.4	0.5	113.1	E1013 T1019 A1020 L1021 L1041 L1046	E1013-R1017 VanDerWaalsContact O-CG 3.31Å; E1013-R1017 WeakPolarHBondContact O-CG 3.46Å; E1013-R1017 PolarHBondContact O-N 2.86Å; E1013-R1017 IonicContact OE1-NH1 2.78Å; R1017-T1019 VanDerWaalsContact C-N 3.32Å; R1017-T1019 PolarHBondContact O-N 3.19Å; R1017-A1020 PolarHBondContact O-N 3.35Å; R1017-L1021 WeakPolarHBondContact O-CG 3.45Å; R1017-L1021 PolarHBondContact O-N 3.08Å; R1017-L1041 HydrophobicContact CB-CD1 4.05Å; R1017-L1041 HydrophobicContact CG-CD1 4.25Å; R1017-L1046 HydrophobicContact CG-CD2 3.86Å
1018	V	93.8	Very high	91.5	Very high	45 Å²	45	63.2 Å²	63.2	27%	0.273	30%	0.296	S	S	.	.	H	α-helix	trans	-64.5	-40.7	177.1	171.4	0	0	0	0	110.8	L1004 F1009 R1014 I1016 L1021 C1022	L1004-V1018 HydrophobicContact CD2-CG1 3.77Å; F1009-V1018 HydrophobicContact CE1-CB 4.04Å; F1009-V1018 HydrophobicContact CE1-CG1 4.33Å; F1009-V1018 HydrophobicContact CE1-CG2 3.97Å; F1009-V1018 HydrophobicContact CZ-CB 4.24Å; F1009-V1018 HydrophobicContact CZ-CG1 4.08Å; R1014-V1018 WeakPolarHBondContact O-CB 3.41Å; R1014-V1018 WeakPolarHBondContact O-CG2 3.42Å; R1014-V1018 PolarHBondContact O-N 3.04Å; R1014-V1018 VanDerWaalsContact O-N 3.12Å; I1016-V1018 PolarHBondContact O-N 2.97Å; V1018-L1021 PolarHBondContact O-N 3.03Å; V1018-C1022 PolarHBondContact O-N 3.17Å; V1018-C1022 PolarHBondContact O-SG 3.2Å; V1018-C1022 VanDerWaalsContact O-SG 3.34Å
1019	T	92.2	Very high	91.5	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-64.4	-42.2	177.5	-54.9	0	0	0	0	111.5	F1001 L1015 I1016 R1017 L1021 C1022 L1023 A1049 W1053	F1001-T1019 HydrophobicContact CD1-CG2 4.06Å; F1001-T1019 HydrophobicContact CE1-CG2 3.54Å; F1001-T1019 HydrophobicContact CZ-CG2 4.07Å; L1015-T1019 WeakPolarHBondContact O-CB 3.26Å; L1015-T1019 PolarHBondContact O-N 3.09Å; L1015-T1019 PolarHBondContact O-OG1 3.33Å; I1016-T1019 PolarHBondContact O-N 2.69Å; R1017-T1019 VanDerWaalsContact C-N 3.32Å; R1017-T1019 PolarHBondContact O-N 3.19Å; T1019-L1021 PolarHBondContact O-N 2.96Å; T1019-C1022 WeakPolarHBondContact O-CB 3.49Å; T1019-C1022 PolarHBondContact O-N 3.5Å; T1019-L1023 HydrophobicContact CG2-CD1 4.5Å; T1019-L1023 PolarHBondContact O-N 3.39Å; T1019-A1049 HydrophobicContact CG2-CB 3.97Å; T1019-W1053 PolarHBondContact OG1-NE1 3.38Å
1020	A	93.5	Very high	91.6	Very high	0 Å²	0	64.9 Å²	64.9	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-62	-40.5	175.6	0	0	0	0	0	112	I1016 R1017 L1023 R1024 L1041 E1045 L1046 A1049	I1016-A1020 WeakPolarHBondContact O-CB 3.1Å; I1016-A1020 PolarHBondContact O-N 2.73Å; R1017-A1020 PolarHBondContact O-N 3.35Å; A1020-L1023 PolarHBondContact O-N 3.03Å; A1020-R1024 WeakPolarHBondContact O-CB 3.32Å; A1020-R1024 PolarHBondContact O-N 3.41Å; A1020-L1041 HydrophobicContact CB-CD1 4.07Å; A1020-L1041 HydrophobicContact CB-CD2 3.81Å; A1020-E1045 HydrophobicContact CB-CB 4.37Å; A1020-L1046 HydrophobicContact CB-CD2 4.13Å; A1020-A1049 HydrophobicContact CB-CB 3.88Å
1021	L	93.3	Very high	91.6	Very high	92 Å²	92	66.7 Å²	66.7	48%	0.482	31%	0.309	S	S	.	.	H	α-helix	trans	-63.1	-41	173	-73	169.5	0	0	0	112.3	R1017 V1018 T1019 R1024 F1025 L1041	R1017-L1021 WeakPolarHBondContact O-CG 3.45Å; R1017-L1021 PolarHBondContact O-N 3.08Å; V1018-L1021 PolarHBondContact O-N 3.03Å; T1019-L1021 PolarHBondContact O-N 2.96Å; L1021-R1024 PolarHBondContact O-N 3.46Å; L1021-F1025 WeakPolarHBondContact O-CB 3.41Å; L1021-F1025 PolarHBondContact O-N 2.83Å; L1021-L1041 HydrophobicContact CD2-CD1 4.46Å; L1021-L1041 HydrophobicContact CD2-CD2 3.93Å; L1021-L1041 HydrophobicContact CD2-CG 4.27Å; L1021-L1041 HydrophobicContact CG-CD1 4.17Å; L1021-L1041 HydrophobicContact CG-CD2 4.18Å; L1021-L1041 HydrophobicContact CG-CG 4.48Å
1022	C	90.1	Very high	91.1	Very high	49 Å²	49	67.6 Å²	67.6	33%	0.331	31%	0.313	S	S	.	.	H	α-helix	trans	-64	-44.3	175.4	-68.7	0	0	0	0	111.8	L1004 V1018 T1019 F1025 V1026	L1004-C1022 HydrophobicContact CD1-CB 4.26Å; V1018-C1022 PolarHBondContact O-N 3.17Å; V1018-C1022 PolarHBondContact O-SG 3.2Å; V1018-C1022 VanDerWaalsContact O-SG 3.34Å; T1019-C1022 WeakPolarHBondContact O-CB 3.49Å; T1019-C1022 PolarHBondContact O-N 3.5Å; C1022-F1025 WeakPolarHBondContact O-CB 3.31Å; C1022-F1025 PolarHBondContact O-N 3.28Å; C1022-V1026 WeakPolarHBondContact O-CG2 3.48Å; C1022-V1026 PolarHBondContact O-N 3.29Å
1023	L	89.8	Confident	90.4	Very high	37 Å²	37	70 Å²	70	19%	0.194	33%	0.332	C	S	.	.	H	α-helix	trans	-62.1	-44	175.5	-79.1	175.6	0	0	0	112.1	F1001 T1019 A1020 F1025 V1026 Y1027 Q1048 A1049	F1001-L1023 HydrophobicContact CE1-CD2 4.28Å; F1001-L1023 HydrophobicContact CE1-CG 4.21Å; F1001-L1023 HydrophobicContact CZ-CD1 4.18Å; F1001-L1023 HydrophobicContact CZ-CD2 3.62Å; F1001-L1023 HydrophobicContact CZ-CG 3.86Å; T1019-L1023 HydrophobicContact CG2-CD1 4.5Å; T1019-L1023 PolarHBondContact O-N 3.39Å; A1020-L1023 PolarHBondContact O-N 3.03Å; L1023-F1025 VanDerWaalsContact C-N 3.34Å; L1023-F1025 PolarHBondContact O-N 2.87Å; L1023-V1026 PolarHBondContact O-N 3.24Å; L1023-Y1027 WeakPolarHBondContact O-CB 3.4Å; L1023-Y1027 PolarHBondContact O-N 3.03Å; L1023-Q1048 HydrophobicContact CD1-CG 4.16Å; L1023-A1049 HydrophobicContact CD1-CB 4.33Å
1024	R	91.9	Very high	89.8	Confident	25 Å²	25	74.7 Å²	74.7	9%	0.094	35%	0.353	C	S	.	.	H	α-helix	trans	-60.3	-43.3	174.1	-178.6	-171.3	-76.1	-167	-17.3	111.6	A1020 L1021 V1026 Y1027 N1028 R1037 G1039 D1040 L1041 E1045	A1020-R1024 WeakPolarHBondContact O-CB 3.32Å; A1020-R1024 PolarHBondContact O-N 3.41Å; L1021-R1024 PolarHBondContact O-N 3.46Å; R1024-V1026 VanDerWaalsContact C-N 3.34Å; R1024-V1026 PolarHBondContact O-N 3.19Å; R1024-Y1027 WeakPolarHBondContact O-CB 3.33Å; R1024-Y1027 PolarHBondContact O-N 2.92Å; R1024-N1028 WeakPolarHBondContact O-CB 3.42Å; R1024-N1028 PolarHBondContact O-N 3.37Å; R1024-R1037 HydrophobicContact CG-CB 4.15Å; R1024-G1039 PolarHBondContact NH1-O 2.95Å; R1024-D1040 PolarHBondContact NH2-O 3.09Å; R1024-L1041 VanDerWaalsContact NH2-CA 3.34Å; R1024-E1045 WeakPolarHBondContact CG-OE1 3.3Å; R1024-E1045 IonicContact CZ-OE1 3.78Å; R1024-E1045 IonicContact CZ-OE2 2.74Å; R1024-E1045 IonicContact NE-OE1 2.71Å; R1024-E1045 PolarHBondContact NE-OE1 3.16Å; R1024-E1045 IonicContact NE-OE2 2.62Å; R1024-E1045 PolarHBondContact NE-OE2 3.49Å; R1024-E1045 IonicContact NH2-OE1 2.78Å; R1024-E1045 IonicContact NH2-OE2 2.63Å; R1024-E1045 PolarHBondContact NH2-OE2 3.04Å
1025	F	90	Very high	89.3	Confident	148 Å²	148	71.6 Å²	71.6	65%	0.649	35%	0.346	S	S	*	.	H	α-helix	trans	-59.2	-46.8	176.1	175.4	-96.3	0	0	0	111	L1021 C1022 L1023 Y1027 N1028 A1029	L1021-F1025 WeakPolarHBondContact O-CB 3.41Å; L1021-F1025 PolarHBondContact O-N 2.83Å; C1022-F1025 WeakPolarHBondContact O-CB 3.31Å; C1022-F1025 PolarHBondContact O-N 3.28Å; L1023-F1025 VanDerWaalsContact C-N 3.34Å; L1023-F1025 PolarHBondContact O-N 2.87Å; F1025-Y1027 PolarHBondContact O-N 3.32Å; F1025-N1028 PolarHBondContact O-N 3.2Å; F1025-A1029 VanDerWaalsContact O-CB 3.22Å; F1025-A1029 WeakPolarHBondContact O-CB 3.46Å; F1025-A1029 PolarHBondContact O-N 3.32Å
1026	V	86.9	Confident	89.1	Confident	61 Å²	61	76.9 Å²	76.9	37%	0.37	37%	0.366	S	S	.	.	H	α-helix	trans	-61.7	-42.8	176.3	173.9	0	0	0	0	111.4	C1022 L1023 R1024 A1029 R1030	C1022-V1026 WeakPolarHBondContact O-CG2 3.48Å; C1022-V1026 PolarHBondContact O-N 3.29Å; L1023-V1026 PolarHBondContact O-N 3.24Å; R1024-V1026 VanDerWaalsContact C-N 3.34Å; R1024-V1026 PolarHBondContact O-N 3.19Å; V1026-A1029 PolarHBondContact O-N 2.78Å; V1026-R1030 WeakPolarHBondContact O-CG 3.48Å; V1026-R1030 PolarHBondContact O-N 3.44Å
1027	Y	89.3	Confident	88.8	Confident	63 Å²	63	80.9 Å²	80.9	25%	0.247	38%	0.381	C	S	.	.	H	α-helix	trans	-59.5	-49.1	175.5	177.7	-87.4	0	0	0	111.5	L1023 R1024 F1025 A1029 R1030 R1031 R1037	L1023-Y1027 WeakPolarHBondContact O-CB 3.4Å; L1023-Y1027 PolarHBondContact O-N 3.03Å; R1024-Y1027 WeakPolarHBondContact O-CB 3.33Å; R1024-Y1027 PolarHBondContact O-N 2.92Å; F1025-Y1027 PolarHBondContact O-N 3.32Å; Y1027-A1029 PolarHBondContact O-N 2.9Å; Y1027-R1030 PolarHBondContact O-N 2.95Å; Y1027-R1031 VanDerWaalsContact CZ-CD 3.49Å; Y1027-R1031 PolarHBondContact OH-NH1 3.19Å; Y1027-R1037 HydrophobicContact CD1-CG 3.99Å; Y1027-R1037 HydrophobicContact CE1-CG 3.73Å
1028	N	92	Very high	88.4	Confident	28 Å²	28	84.1 Å²	84.1	15%	0.15	39%	0.393	C	S	.	.	H	α-helix	trans	-68.9	-32.8	-179.1	-75	-8.4	0	0	0	113.1	R1024 F1025 R1030 R1031 R1036 R1037	R1024-N1028 WeakPolarHBondContact O-CB 3.42Å; R1024-N1028 PolarHBondContact O-N 3.37Å; F1025-N1028 PolarHBondContact O-N 3.2Å; N1028-R1030 VanDerWaalsContact C-N 3.26Å; N1028-R1030 PolarHBondContact O-N 3.1Å; N1028-R1031 PolarHBondContact O-N 2.95Å; N1028-R1031 VanDerWaalsContact O-O 3.07Å; N1028-R1036 HydrophobicContact CB-CB 4.27Å; N1028-R1036 HydrophobicContact CB-CG 3.93Å; N1028-R1036 PolarHBondContact O-NE 2.96Å; N1028-R1036 VanDerWaalsContact OD1-CA 3.26Å; N1028-R1036 WeakPolarHBondContact OD1-CA 3.34Å; N1028-R1037 PolarHBondContact ND2-O 3.32Å; N1028-R1037 PolarHBondContact OD1-N 3Å
1029	A	86.1	Confident	88.2	Confident	67 Å²	67	84.9 Å²	84.9	55%	0.554	41%	0.41	S	S	*	.	H	α-helix	trans	-70.3	-24.4	178.6	0	0	0	0	0	112.5	F1025 V1026 Y1027	F1025-A1029 VanDerWaalsContact O-CB 3.22Å; F1025-A1029 WeakPolarHBondContact O-CB 3.46Å; F1025-A1029 PolarHBondContact O-N 3.32Å; V1026-A1029 PolarHBondContact O-N 2.78Å; Y1027-A1029 PolarHBondContact O-N 2.9Å
1030	R	90.8	Very high	88	Confident	201 Å²	201	92 Å²	92	76%	0.758	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.1	-0.6	178.8	-67.9	175.6	-179.2	-178.4	1.3	113.6	V1026 Y1027 N1028	V1026-R1030 WeakPolarHBondContact O-CG 3.48Å; V1026-R1030 PolarHBondContact O-N 3.44Å; Y1027-R1030 PolarHBondContact O-N 2.95Å; N1028-R1030 VanDerWaalsContact C-N 3.26Å; N1028-R1030 PolarHBondContact O-N 3.1Å
1031	R	86.5	Confident	88	Confident	106 Å²	106	93.4 Å²	93.4	40%	0.4	46%	0.455	S	S	.	.	S	Bend	trans	-131.3	154.9	-172.5	-74.2	-174	167.3	-131	7.2	112.8	Y1027 N1028 E1035 R1036	Y1027-R1031 VanDerWaalsContact CZ-CD 3.49Å; Y1027-R1031 PolarHBondContact OH-NH1 3.19Å; N1028-R1031 PolarHBondContact O-N 2.95Å; N1028-R1031 VanDerWaalsContact O-O 3.07Å; R1031-E1035 HydrophobicContact CB-CB 4.13Å; R1031-E1035 WeakPolarHBondContact CD-OE2 3.36Å; R1031-E1035 WeakPolarHBondContact CG-OE2 3.23Å; R1031-E1035 IonicContact CZ-OE2 2.84Å; R1031-E1035 IonicContact NE-OE2 3.33Å; R1031-E1035 IonicContact NH1-OE1 3.05Å; R1031-E1035 IonicContact NH1-OE2 3.93Å; R1031-E1035 PolarHBondContact NH1-OE2 3.25Å; R1031-R1036 PolarHBondContact O-NE 3.34Å
1032	E	80.7	Confident	87.9	Confident	130 Å²	130	91.9 Å²	91.9	61%	0.607	45%	0.45	S	S	*	.			trans	-66.2	157.2	177.3	-65.8	-138	153.7	0	0	112.2	Q1034 E1035 R1036	E1032-Q1034 HydrophobicContact CB-CG 4.16Å; E1032-Q1034 PolarHBondContact O-N 3.33Å; E1032-Q1034 PolarHBondContact OE2-NE2 3.06Å; E1032-E1035 PolarHBondContact O-N 2.81Å; E1032-R1036 WeakPolarHBondContact O-CG 3.24Å
1033	S	79	Confident	87.9	Confident	66 Å²	66	94.3 Å²	94.3	46%	0.462	46%	0.463	S	S	.	.	G	3₁₀ helix	trans	-53.5	-32.5	-171.7	-161.1	0	0	0	0	114.1
1034	Q	81.1	Confident	88	Confident	161 Å²	161	99 Å²	99	75%	0.752	48%	0.484	S	S	*	.	G	3₁₀ helix	trans	-71.7	-26.7	178.9	56.3	-153.1	-23.4	0	0	114.6	E1032	E1032-Q1034 HydrophobicContact CB-CG 4.16Å; E1032-Q1034 PolarHBondContact O-N 3.33Å; E1032-Q1034 PolarHBondContact OE2-NE2 3.06Å
1035	E	84.3	Confident	88.1	Confident	99 Å²	99	98 Å²	98	46%	0.463	48%	0.48	S	S	.	.	G	3₁₀ helix	trans	-97	-0.6	179.9	-56.8	-169.8	152.6	0	0	113.4	R1031 E1032	R1031-E1035 HydrophobicContact CB-CB 4.13Å; R1031-E1035 WeakPolarHBondContact CD-OE2 3.36Å; R1031-E1035 WeakPolarHBondContact CG-OE2 3.23Å; R1031-E1035 IonicContact CZ-OE2 2.84Å; R1031-E1035 IonicContact NE-OE2 3.33Å; R1031-E1035 IonicContact NH1-OE1 3.05Å; R1031-E1035 IonicContact NH1-OE2 3.93Å; R1031-E1035 PolarHBondContact NH1-OE2 3.25Å; E1032-E1035 PolarHBondContact O-N 2.81Å
1036	R	89.6	Confident	88.3	Confident	111 Å²	111	92.6 Å²	92.6	42%	0.419	46%	0.458	S	S	.	.			trans	-72.1	131.9	-175.2	-68.1	-178.4	-176.5	167.7	1.6	111.3	N1028 R1031 E1032	N1028-R1036 HydrophobicContact CB-CB 4.27Å; N1028-R1036 HydrophobicContact CB-CG 3.93Å; N1028-R1036 PolarHBondContact O-NE 2.96Å; N1028-R1036 VanDerWaalsContact OD1-CA 3.26Å; N1028-R1036 WeakPolarHBondContact OD1-CA 3.34Å; R1031-R1036 PolarHBondContact O-NE 3.34Å; E1032-R1036 WeakPolarHBondContact O-CG 3.24Å
1037	R	89.2	Confident	88.6	Confident	89 Å²	89	94 Å²	94	34%	0.336	46%	0.463	S	S	.	.			trans	-70.8	129.8	172	-63.9	176.1	-172.4	178.8	-0.4	110.2	R1024 Y1027 N1028 E1045	R1024-R1037 HydrophobicContact CG-CB 4.15Å; Y1027-R1037 HydrophobicContact CD1-CG 3.99Å; Y1027-R1037 HydrophobicContact CE1-CG 3.73Å; N1028-R1037 PolarHBondContact ND2-O 3.32Å; N1028-R1037 PolarHBondContact OD1-N 3Å; R1037-E1045 WeakPolarHBondContact CD-OE1 3.47Å; R1037-E1045 IonicContact NH1-OE1 3.33Å
1038	R	85.9	Confident	88.7	Confident	188 Å²	188	95.4 Å²	95.4	71%	0.709	47%	0.472	S	S	*	.			trans	-132.2	166.5	178.8	-57.6	-176.3	-170.9	-167.8	3	109.7
1039	G	89.3	Confident	88.8	Confident	61 Å²	61	94.1 Å²	94.1	63%	0.629	47%	0.465	S	S	*	.	S	Bend	trans	89.5	-160.4	-179.5	0	0	0	0	0	113.6	R1024	R1024-G1039 PolarHBondContact NH1-O 2.95Å
1040	D	89.5	Confident	89.2	Confident	151 Å²	151	92.3 Å²	92.3	81%	0.807	45%	0.445	S	S	*	.	S	Bend	trans	-68.6	156.8	178	-70	-36.9	0	0	0	112.1	R1024 T1042	R1024-D1040 PolarHBondContact NH2-O 3.09Å; D1040-T1042 PolarHBondContact O-N 3.12Å
1041	L	92.9	Very high	89.3	Confident	29 Å²	29	84.1 Å²	84.1	15%	0.152	42%	0.418	C	S	.	.	P	Polyproline II helix	trans	-61.8	128.7	175.9	-71.7	170.4	0	0	0	110.4	R1017 A1020 L1021 R1024 E1045 L1046	R1017-L1041 HydrophobicContact CB-CD1 4.05Å; R1017-L1041 HydrophobicContact CG-CD1 4.25Å; A1020-L1041 HydrophobicContact CB-CD1 4.07Å; A1020-L1041 HydrophobicContact CB-CD2 3.81Å; L1021-L1041 HydrophobicContact CD2-CD1 4.46Å; L1021-L1041 HydrophobicContact CD2-CD2 3.93Å; L1021-L1041 HydrophobicContact CD2-CG 4.27Å; L1021-L1041 HydrophobicContact CG-CD1 4.17Å; L1021-L1041 HydrophobicContact CG-CD2 4.18Å; L1021-L1041 HydrophobicContact CG-CG 4.48Å; R1024-L1041 VanDerWaalsContact NH2-CA 3.34Å; L1041-E1045 HydrophobicContact CD2-CB 4.47Å; L1041-L1046 HydrophobicContact CB-CD2 4.29Å; L1041-L1046 HydrophobicContact CB-CG 4.38Å; L1041-L1046 HydrophobicContact CD1-CD2 3.91Å
1042	T	90.9	Very high	89.5	Confident	60 Å²	60	80 Å²	80	37%	0.368	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-78.6	161.8	176.3	81	0	0	0	0	110.9	D1040 E1044 E1045 L1046	D1040-T1042 PolarHBondContact O-N 3.12Å; T1042-E1044 VanDerWaalsContact CB-OE2 3.25Å; T1042-E1044 WeakPolarHBondContact CB-OE2 3.19Å; T1042-E1044 PolarHBondContact O-N 2.93Å; T1042-E1044 PolarHBondContact OG1-N 2.98Å; T1042-E1044 PolarHBondContact OG1-OE2 2.9Å; T1042-E1045 PolarHBondContact N-OE2 3.1Å; T1042-E1045 PolarHBondContact O-N 2.66Å; T1042-E1045 PolarHBondContact OG1-N 3.48Å; T1042-L1046 PolarHBondContact O-N 3.41Å; T1042-L1046 VanDerWaalsContact O-N 3.17Å
1043	V	91	Very high	90.2	Very high	100 Å²	100	74 Å²	74	61%	0.606	38%	0.378	S	S	*	.	H	α-helix	trans	-60.6	-38.6	176.2	178.1	0	0	0	0	110.3	E1045 L1046 L1047	V1043-E1045 VanDerWaalsContact C-N 3.32Å; V1043-E1045 PolarHBondContact O-N 2.82Å; V1043-L1046 PolarHBondContact O-N 2.65Å; V1043-L1047 HydrophobicContact CG1-CD1 3.83Å; V1043-L1047 HydrophobicContact CG1-CG 4.16Å; V1043-L1047 WeakPolarHBondContact O-CB 3.42Å; V1043-L1047 WeakPolarHBondContact O-CG 3.46Å; V1043-L1047 PolarHBondContact O-N 3.21Å
1044	E	90.3	Very high	90.9	Very high	135 Å²	135	71.1 Å²	71.1	63%	0.631	36%	0.357	S	S	*	.	H	α-helix	trans	-61.8	-39.3	176.6	-59.2	79.7	-166.7	0	0	112.2	T1042 L1047 Q1048	T1042-E1044 VanDerWaalsContact CB-OE2 3.25Å; T1042-E1044 WeakPolarHBondContact CB-OE2 3.19Å; T1042-E1044 PolarHBondContact O-N 2.93Å; T1042-E1044 PolarHBondContact OG1-N 2.98Å; T1042-E1044 PolarHBondContact OG1-OE2 2.9Å; E1044-L1047 PolarHBondContact O-N 2.91Å; E1044-Q1048 VanDerWaalsContact O-CB 3.23Å; E1044-Q1048 WeakPolarHBondContact O-CB 3.12Å; E1044-Q1048 PolarHBondContact O-N 3.09Å
1045	E	94.1	Very high	91.5	Very high	3 Å²	3	65.7 Å²	65.7	1%	0.014	33%	0.331	C	S	.	.	H	α-helix	trans	-67.9	-37	178.2	-70.9	176.7	127.5	0	0	112.4	A1020 R1024 R1037 L1041 T1042 V1043 A1049	A1020-E1045 HydrophobicContact CB-CB 4.37Å; R1024-E1045 WeakPolarHBondContact CG-OE1 3.3Å; R1024-E1045 IonicContact CZ-OE1 3.78Å; R1024-E1045 IonicContact CZ-OE2 2.74Å; R1024-E1045 IonicContact NE-OE1 2.71Å; R1024-E1045 PolarHBondContact NE-OE1 3.16Å; R1024-E1045 IonicContact NE-OE2 2.62Å; R1024-E1045 PolarHBondContact NE-OE2 3.49Å; R1024-E1045 IonicContact NH2-OE1 2.78Å; R1024-E1045 IonicContact NH2-OE2 2.63Å; R1024-E1045 PolarHBondContact NH2-OE2 3.04Å; R1037-E1045 WeakPolarHBondContact CD-OE1 3.47Å; R1037-E1045 IonicContact NH1-OE1 3.33Å; L1041-E1045 HydrophobicContact CD2-CB 4.47Å; T1042-E1045 PolarHBondContact N-OE2 3.1Å; T1042-E1045 PolarHBondContact O-N 2.66Å; T1042-E1045 PolarHBondContact OG1-N 3.48Å; V1043-E1045 VanDerWaalsContact C-N 3.32Å; V1043-E1045 PolarHBondContact O-N 2.82Å; E1045-A1049 WeakPolarHBondContact O-CB 3.44Å; E1045-A1049 PolarHBondContact O-N 3.33Å; E1045-A1049 VanDerWaalsContact O-N 3.09Å
1046	L	95.8	Very high	91.8	Very high	36 Å²	36	62.6 Å²	62.6	19%	0.188	32%	0.318	C	S	.	.	H	α-helix	trans	-69.1	-44.9	175.1	-65.2	175.4	0	0	0	111.4	I1016 R1017 A1020 L1041 T1042 V1043 Q1048 A1049 E1050	I1016-L1046 HydrophobicContact CG2-CB 4.25Å; I1016-L1046 HydrophobicContact CG2-CD2 4.06Å; I1016-L1046 WeakPolarHBondContact CG2-O 3.49Å; R1017-L1046 HydrophobicContact CG-CD2 3.86Å; A1020-L1046 HydrophobicContact CB-CD2 4.13Å; L1041-L1046 HydrophobicContact CB-CD2 4.29Å; L1041-L1046 HydrophobicContact CB-CG 4.38Å; L1041-L1046 HydrophobicContact CD1-CD2 3.91Å; T1042-L1046 PolarHBondContact O-N 3.41Å; T1042-L1046 VanDerWaalsContact O-N 3.17Å; V1043-L1046 PolarHBondContact O-N 2.65Å; L1046-Q1048 VanDerWaalsContact C-N 3.34Å; L1046-Q1048 PolarHBondContact O-N 3.07Å; L1046-A1049 PolarHBondContact O-N 2.94Å; L1046-E1050 PolarHBondContact O-N 2.86Å
1047	L	92.4	Very high	92	Very high	89 Å²	89	57.3 Å²	57.3	47%	0.466	30%	0.298	S	S	.	.	H	α-helix	trans	-63.6	-38.9	176.5	-71.4	175.1	0	0	0	111.8	V1043 E1044 A1049 E1050 C1051	V1043-L1047 HydrophobicContact CG1-CD1 3.83Å; V1043-L1047 HydrophobicContact CG1-CG 4.16Å; V1043-L1047 WeakPolarHBondContact O-CB 3.42Å; V1043-L1047 WeakPolarHBondContact O-CG 3.46Å; V1043-L1047 PolarHBondContact O-N 3.21Å; E1044-L1047 PolarHBondContact O-N 2.91Å; L1047-A1049 VanDerWaalsContact C-N 3.34Å; L1047-A1049 PolarHBondContact O-N 3.3Å; L1047-E1050 PolarHBondContact O-N 3.15Å; L1047-C1051 VanDerWaalsContact O-CB 3.25Å; L1047-C1051 WeakPolarHBondContact O-CB 3.47Å; L1047-C1051 PolarHBondContact O-N 3.21Å
1048	Q	91.9	Very high	92.3	Very high	94 Å²	94	53.1 Å²	53.1	44%	0.439	28%	0.282	S	S	.	.	H	α-helix	trans	-62.4	-42.4	174.4	-174.7	-176.3	1	0	0	111.4	L1023 E1044 L1046 S1052	L1023-Q1048 HydrophobicContact CD1-CG 4.16Å; E1044-Q1048 VanDerWaalsContact O-CB 3.23Å; E1044-Q1048 WeakPolarHBondContact O-CB 3.12Å; E1044-Q1048 PolarHBondContact O-N 3.09Å; L1046-Q1048 VanDerWaalsContact C-N 3.34Å; L1046-Q1048 PolarHBondContact O-N 3.07Å; Q1048-S1052 WeakPolarHBondContact O-CB 3.37Å; Q1048-S1052 PolarHBondContact O-N 3.18Å; Q1048-S1052 PolarHBondContact O-OG 3.45Å
1049	A	93.3	Very high	92.6	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-67.1	-42	176.8	0	0	0	0	0	112.4	I1016 T1019 A1020 L1023 E1045 L1046 L1047 S1052 W1053	I1016-A1049 HydrophobicContact CG2-CB 3.96Å; T1019-A1049 HydrophobicContact CG2-CB 3.97Å; A1020-A1049 HydrophobicContact CB-CB 3.88Å; L1023-A1049 HydrophobicContact CD1-CB 4.33Å; E1045-A1049 WeakPolarHBondContact O-CB 3.44Å; E1045-A1049 PolarHBondContact O-N 3.33Å; E1045-A1049 VanDerWaalsContact O-N 3.09Å; L1046-A1049 PolarHBondContact O-N 2.94Å; L1047-A1049 VanDerWaalsContact C-N 3.34Å; L1047-A1049 PolarHBondContact O-N 3.3Å; A1049-S1052 PolarHBondContact O-N 3.05Å; A1049-W1053 PolarHBondContact O-N 3.12Å; A1049-W1053 VanDerWaalsContact O-N 3.16Å
1050	E	94.8	Very high	92.7	Very high	30 Å²	30	56 Å²	56	14%	0.14	27%	0.274	C	S	.	.	H	α-helix	trans	-59.5	-52	173	-174.8	-175.6	156.9	0	0	110.9	F1012 I1016 L1046 L1047 S1052 W1053 L1054 K1148	F1012-E1050 HydrophobicContact CZ-CG 4.2Å; I1016-E1050 HydrophobicContact CD1-CB 4.16Å; L1046-E1050 PolarHBondContact O-N 2.86Å; L1047-E1050 PolarHBondContact O-N 3.15Å; E1050-S1052 VanDerWaalsContact C-N 3.3Å; E1050-S1052 PolarHBondContact O-N 3.47Å; E1050-W1053 PolarHBondContact O-N 3.48Å; E1050-W1053 VanDerWaalsContact O-N 3.13Å; E1050-L1054 HydrophobicContact CG-CD1 4.08Å; E1050-L1054 HydrophobicContact CG-CG 4.48Å; E1050-L1054 WeakPolarHBondContact O-CG 3.49Å; E1050-L1054 PolarHBondContact O-N 2.73Å; E1050-K1148 IonicContact OE1-NZ 3.32Å; E1050-K1148 PolarHBondContact OE1-NZ 3.12Å; E1050-K1148 IonicContact OE2-NZ 3.68Å
1051	C	93.5	Very high	92.9	Very high	28 Å²	28	51.3 Å²	51.3	19%	0.189	25%	0.247	C	C	.	.	H	α-helix	trans	-57	-43.1	178.3	-174.8	0	0	0	0	111.7	L1047 W1053 L1054 Q1055	L1047-C1051 VanDerWaalsContact O-CB 3.25Å; L1047-C1051 WeakPolarHBondContact O-CB 3.47Å; L1047-C1051 PolarHBondContact O-N 3.21Å; C1051-W1053 PolarHBondContact O-N 2.96Å; C1051-L1054 PolarHBondContact O-N 3.08Å; C1051-Q1055 WeakPolarHBondContact O-CG 3.48Å; C1051-Q1055 PolarHBondContact O-N 2.72Å
1052	S	90.8	Very high	92.9	Very high	20 Å²	20	49.9 Å²	49.9	14%	0.14	24%	0.24	C	C	.	.	H	α-helix	trans	-58.2	-45	176.6	-59.4	0	0	0	0	112.1	Q1048 A1049 E1050 Q1055 I1056	Q1048-S1052 WeakPolarHBondContact O-CB 3.37Å; Q1048-S1052 PolarHBondContact O-N 3.18Å; Q1048-S1052 PolarHBondContact O-OG 3.45Å; A1049-S1052 PolarHBondContact O-N 3.05Å; E1050-S1052 VanDerWaalsContact C-N 3.3Å; E1050-S1052 PolarHBondContact O-N 3.47Å; S1052-Q1055 PolarHBondContact O-N 3.14Å; S1052-I1056 WeakPolarHBondContact O-CD1 3.06Å; S1052-I1056 VanDerWaalsContact O-CG1 3.22Å; S1052-I1056 WeakPolarHBondContact O-CG1 3.1Å; S1052-I1056 PolarHBondContact O-N 3.44Å
1053	W	94	Very high	92.9	Very high	5 Å²	5	48 Å²	48	2%	0.019	23%	0.232	C	C	.	.	H	α-helix	trans	-65.8	-41.1	177	-86.1	112.3	0	0	0	112.9	F1001 L1004 P1006 L1015 T1019 A1049 E1050 C1051 I1056 V1057 V1121	F1001-W1053 HydrophobicContact CB-CH2 4.46Å; L1004-W1053 HydrophobicContact CB-CZ2 4.21Å; L1004-W1053 WeakPolarHBondContact O-CH2 3.26Å; P1006-W1053 HydrophobicContact CB-CH2 4.12Å; P1006-W1053 HydrophobicContact CB-CZ3 4.12Å; P1006-W1053 HydrophobicContact CG-CH2 4.14Å; P1006-W1053 HydrophobicContact CG-CZ3 3.95Å; L1015-W1053 HydrophobicContact CD1-CZ2 3.66Å; L1015-W1053 HydrophobicContact CD2-CD2 4.24Å; L1015-W1053 HydrophobicContact CD2-CG 4.42Å; L1015-W1053 HydrophobicContact CG-CZ2 4.41Å; T1019-W1053 PolarHBondContact OG1-NE1 3.38Å; A1049-W1053 PolarHBondContact O-N 3.12Å; A1049-W1053 VanDerWaalsContact O-N 3.16Å; E1050-W1053 PolarHBondContact O-N 3.48Å; E1050-W1053 VanDerWaalsContact O-N 3.13Å; C1051-W1053 PolarHBondContact O-N 2.96Å; W1053-I1056 HydrophobicContact CE3-CD1 4.12Å; W1053-I1056 HydrophobicContact CE3-CG2 4.49Å; W1053-I1056 HydrophobicContact CZ3-CD1 4.28Å; W1053-I1056 HydrophobicContact CZ3-CG2 4.4Å; W1053-I1056 PolarHBondContact O-N 3.44Å; W1053-V1057 VanDerWaalsContact O-CG2 3.31Å; W1053-V1057 WeakPolarHBondContact O-CG2 3.44Å; W1053-V1057 PolarHBondContact O-N 3.31Å; W1053-V1121 HydrophobicContact CB-CG1 4.33Å; W1053-V1121 HydrophobicContact CE3-CG2 3.86Å; W1053-V1121 HydrophobicContact CZ3-CG2 4.27Å
1054	L	94.9	Very high	92.9	Very high	4 Å²	4	46.1 Å²	46.1	2%	0.021	23%	0.227	C	C	.	.	H	α-helix	trans	-64.1	-42.1	177.4	-63.8	174.9	0	0	0	111.2	E1050 C1051 I1056 V1057 Q1058 L1093 I1113 L1115 L1125 F1149	E1050-L1054 HydrophobicContact CG-CD1 4.08Å; E1050-L1054 HydrophobicContact CG-CG 4.48Å; E1050-L1054 WeakPolarHBondContact O-CG 3.49Å; E1050-L1054 PolarHBondContact O-N 2.73Å; C1051-L1054 PolarHBondContact O-N 3.08Å; L1054-I1056 PolarHBondContact O-N 2.87Å; L1054-V1057 PolarHBondContact O-N 3.28Å; L1054-Q1058 WeakPolarHBondContact O-CB 3.45Å; L1054-Q1058 VanDerWaalsContact O-CG 3.29Å; L1054-Q1058 WeakPolarHBondContact O-CG 3.4Å; L1054-Q1058 PolarHBondContact O-N 2.88Å; L1054-L1093 HydrophobicContact CB-CD1 4.35Å; L1054-L1093 HydrophobicContact CB-CD2 3.61Å; L1054-L1093 HydrophobicContact CD1-CD1 4.13Å; L1054-I1113 HydrophobicContact CD1-CD1 4.09Å; L1054-L1115 HydrophobicContact CD2-CD1 3.98Å; L1054-L1115 HydrophobicContact CD2-CD2 3.93Å; L1054-L1125 HydrophobicContact CD2-CD1 4.33Å; L1054-F1149 HydrophobicContact CD1-CE1 4.01Å; L1054-F1149 HydrophobicContact CD2-CE1 4.33Å
1055	Q	92.9	Very high	92.9	Very high	48 Å²	48	41.1 Å²	41.1	22%	0.224	20%	0.204	C	C	.	.	H	α-helix	trans	-60.8	-42.7	173.9	-72.5	176.6	-1.1	0	0	112	C1051 S1052 Q1058 R1059 D1091 L1093	C1051-Q1055 WeakPolarHBondContact O-CG 3.48Å; C1051-Q1055 PolarHBondContact O-N 2.72Å; S1052-Q1055 PolarHBondContact O-N 3.14Å; Q1055-Q1058 PolarHBondContact O-N 3.29Å; Q1055-R1059 WeakPolarHBondContact O-CB 3.33Å; Q1055-R1059 WeakPolarHBondContact O-CG 3.41Å; Q1055-R1059 PolarHBondContact O-N 2.9Å; Q1055-D1091 PolarHBondContact NE2-O 3.11Å; Q1055-L1093 HydrophobicContact CB-CD2 4.33Å; Q1055-L1093 HydrophobicContact CG-CD2 3.49Å; Q1055-L1093 VanDerWaalsContact CG-CD2 3.49Å; Q1055-L1093 HydrophobicContact CG-CG 4.34Å
1056	I	91.3	Very high	92.8	Very high	33 Å²	33	41.9 Å²	41.9	17%	0.169	21%	0.207	C	C	.	.	H	α-helix	trans	-61.4	-46.5	176.5	-69.5	162.1	0	0	0	110.9	F1001 S1052 W1053 L1054 Q1058 R1059 R1060	F1001-I1056 HydrophobicContact CB-CD1 3.95Å; F1001-I1056 HydrophobicContact CD2-CD1 3.65Å; F1001-I1056 HydrophobicContact CE2-CD1 4.47Å; F1001-I1056 HydrophobicContact CG-CD1 4.11Å; S1052-I1056 WeakPolarHBondContact O-CD1 3.06Å; S1052-I1056 VanDerWaalsContact O-CG1 3.22Å; S1052-I1056 WeakPolarHBondContact O-CG1 3.1Å; S1052-I1056 PolarHBondContact O-N 3.44Å; W1053-I1056 HydrophobicContact CE3-CD1 4.12Å; W1053-I1056 HydrophobicContact CE3-CG2 4.49Å; W1053-I1056 HydrophobicContact CZ3-CD1 4.28Å; W1053-I1056 HydrophobicContact CZ3-CG2 4.4Å; W1053-I1056 PolarHBondContact O-N 3.44Å; L1054-I1056 PolarHBondContact O-N 2.87Å; I1056-Q1058 VanDerWaalsContact C-N 3.34Å; I1056-Q1058 PolarHBondContact O-N 2.98Å; I1056-R1059 PolarHBondContact O-N 3.43Å; I1056-R1060 WeakPolarHBondContact O-CB 3.49Å; I1056-R1060 PolarHBondContact O-N 3.34Å
1057	V	94	Very high	92.6	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-61.1	-45	177.1	172.1	0	0	0	0	110.4	W1053 L1054 R1060 H1061 L1115 P1116 D1119 V1121 V1122	W1053-V1057 VanDerWaalsContact O-CG2 3.31Å; W1053-V1057 WeakPolarHBondContact O-CG2 3.44Å; W1053-V1057 PolarHBondContact O-N 3.31Å; L1054-V1057 PolarHBondContact O-N 3.28Å; V1057-R1060 PolarHBondContact O-N 3.33Å; V1057-H1061 PolarHBondContact O-CD2 2.91Å; V1057-H1061 VanDerWaalsContact O-CD2 3.27Å; V1057-H1061 PolarHBondContact O-N 2.94Å; V1057-H1061 VanDerWaalsContact O-N 3.11Å; V1057-L1115 HydrophobicContact CG1-CD2 4.17Å; V1057-P1116 HydrophobicContact CG1-CG 3.66Å; V1057-D1119 HydrophobicContact CG1-CB 4.2Å; V1057-V1121 HydrophobicContact CG2-CB 3.79Å; V1057-V1121 HydrophobicContact CG2-CG1 4.17Å; V1057-V1121 HydrophobicContact CG2-CG2 4.04Å; V1057-V1122 HydrophobicContact CG1-CG2 4.1Å
1058	Q	95.1	Very high	92.5	Very high	2 Å²	2	46.2 Å²	46.2	1%	0.009	22%	0.221	C	C	.	.	H	α-helix	trans	-65.5	-44.7	179.6	-73.8	-179.2	-20.6	0	0	112.3	L1054 Q1055 I1056 R1060 H1061 F1062 I1066 L1094 L1114 L1115	L1054-Q1058 WeakPolarHBondContact O-CB 3.45Å; L1054-Q1058 VanDerWaalsContact O-CG 3.29Å; L1054-Q1058 WeakPolarHBondContact O-CG 3.4Å; L1054-Q1058 PolarHBondContact O-N 2.88Å; Q1055-Q1058 PolarHBondContact O-N 3.29Å; I1056-Q1058 VanDerWaalsContact C-N 3.34Å; I1056-Q1058 PolarHBondContact O-N 2.98Å; Q1058-R1060 VanDerWaalsContact C-N 3.3Å; Q1058-R1060 PolarHBondContact O-N 3.19Å; Q1058-H1061 PolarHBondContact O-N 3.39Å; Q1058-F1062 HydrophobicContact CB-CD2 4.32Å; Q1058-F1062 HydrophobicContact CG-CD2 4.26Å; Q1058-F1062 CarbonylContact O-C 3.6Å; Q1058-F1062 VanDerWaalsContact O-CA 3.3Å; Q1058-F1062 WeakPolarHBondContact O-CA 3.43Å; Q1058-F1062 WeakPolarHBondContact O-CB 3.23Å; Q1058-F1062 PolarHBondContact O-N 3.32Å; Q1058-I1066 HydrophobicContact CB-CD1 4.01Å; Q1058-L1094 HydrophobicContact CG-CB 4.39Å; Q1058-L1094 PolarHBondContact NE2-O 2.86Å; Q1058-L1114 PolarHBondContact NE2-O 3.11Å; Q1058-L1115 HydrophobicContact CG-CD2 4.33Å
1059	R	92.1	Very high	92.4	Very high	180 Å²	180	43.3 Å²	43.3	68%	0.679	21%	0.208	S	C	*	.	H	α-helix	trans	-61.8	-37.6	175.2	-72.9	-176.2	-176.5	-152.6	1	112.4	Q1055 I1056 G1063 I1066	Q1055-R1059 WeakPolarHBondContact O-CB 3.33Å; Q1055-R1059 WeakPolarHBondContact O-CG 3.41Å; Q1055-R1059 PolarHBondContact O-N 2.9Å; I1056-R1059 PolarHBondContact O-N 3.43Å; R1059-G1063 WeakPolarHBondContact O-CA 3.45Å; R1059-G1063 PolarHBondContact O-N 2.91Å; R1059-G1063 VanDerWaalsContact O-N 3.1Å; R1059-I1066 HydrophobicContact CG-CD1 4.32Å
1060	R	91	Very high	92.3	Very high	129 Å²	129	48.4 Å²	48.4	49%	0.487	24%	0.235	S	C	.	.	H	α-helix	trans	-66.4	-38.3	178.4	-173.9	-175.1	-60.7	135.9	0.9	113.1	I1056 V1057 Q1058 D1119	I1056-R1060 WeakPolarHBondContact O-CB 3.49Å; I1056-R1060 PolarHBondContact O-N 3.34Å; V1057-R1060 PolarHBondContact O-N 3.33Å; Q1058-R1060 VanDerWaalsContact C-N 3.3Å; Q1058-R1060 PolarHBondContact O-N 3.19Å; R1060-D1119 IonicContact NH1-OD1 3Å; R1060-D1119 IonicContact NH1-OD2 3.75Å; R1060-D1119 PolarHBondContact NH1-OD2 3.41Å
1061	H	93.8	Very high	92.1	Very high	52 Å²	52	50.2 Å²	50.2	24%	0.241	25%	0.251	C	S	.	.	H	α-helix	trans	-104.2	-21.4	-173	-70.8	-97.8	0	0	0	114.7	V1057 Q1058 P1116 N1118 D1119	V1057-H1061 PolarHBondContact O-CD2 2.91Å; V1057-H1061 VanDerWaalsContact O-CD2 3.27Å; V1057-H1061 PolarHBondContact O-N 2.94Å; V1057-H1061 VanDerWaalsContact O-N 3.11Å; Q1058-H1061 PolarHBondContact O-N 3.39Å; H1061-P1116 HydrophobicContact CB-CB 4.04Å; H1061-P1116 HydrophobicContact CB-CG 3.99Å; H1061-N1118 PolarHBondContact CE1-O 3.2Å; H1061-D1119 IonicContact CD2-OD2 2.71Å; H1061-D1119 IonicContact CE1-OD2 2.96Å; H1061-D1119 IonicContact NE2-OD2 2.99Å; H1061-D1119 PolarHBondContact NE2-OD2 3.34Å
1062	F	94	Very high	91.7	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-133.2	20.6	-174.9	-46.5	-53.7	0	0	0	112.6	Q1058 A1064 E1065 I1066 I1081 L1094 L1114 P1116 I1152	Q1058-F1062 HydrophobicContact CB-CD2 4.32Å; Q1058-F1062 HydrophobicContact CG-CD2 4.26Å; Q1058-F1062 CarbonylContact O-C 3.6Å; Q1058-F1062 VanDerWaalsContact O-CA 3.3Å; Q1058-F1062 WeakPolarHBondContact O-CA 3.43Å; Q1058-F1062 WeakPolarHBondContact O-CB 3.23Å; Q1058-F1062 PolarHBondContact O-N 3.32Å; F1062-A1064 PolarHBondContact O-N 2.94Å; F1062-E1065 VanDerWaalsContact CA-OE2 3.3Å; F1062-E1065 WeakPolarHBondContact CA-OE2 3.44Å; F1062-E1065 PolarHBondContact O-N 3.35Å; F1062-E1065 VanDerWaalsContact O-N 3.16Å; F1062-I1066 HydrophobicContact CB-CD1 4.34Å; F1062-I1066 HydrophobicContact CB-CG1 4.49Å; F1062-I1066 VanDerWaalsContact O-CG1 3.3Å; F1062-I1066 WeakPolarHBondContact O-CG1 3.48Å; F1062-I1066 PolarHBondContact O-N 3.46Å; F1062-I1081 HydrophobicContact CB-CD1 4.38Å; F1062-I1081 HydrophobicContact CD1-CD1 4.25Å; F1062-I1081 HydrophobicContact CD1-CG2 4.05Å; F1062-I1081 HydrophobicContact CE1-CG2 3.73Å; F1062-I1081 HydrophobicContact CG-CD1 4.33Å; F1062-I1081 HydrophobicContact CZ-CG2 4.32Å; F1062-L1094 HydrophobicContact CB-CD2 3.9Å; F1062-L1094 HydrophobicContact CD2-CD2 3.77Å; F1062-L1094 HydrophobicContact CG-CD2 4.02Å; F1062-L1114 HydrophobicContact CE2-CD2 4.25Å; F1062-L1114 HydrophobicContact CZ-CD2 4.37Å; F1062-P1116 HydrophobicContact CZ-CB 4.06Å; F1062-I1152 HydrophobicContact CE1-CD1 3.54Å; F1062-I1152 HydrophobicContact CZ-CD1 3.51Å; F1062-I1152 HydrophobicContact CZ-CG1 4.49Å
1063	G	90.1	Very high	91.4	Very high	20 Å²	20	62.8 Å²	62.8	21%	0.206	30%	0.302	C	S	.	.	H	α-helix	trans	-55.9	-45.2	-174.5	0	0	0	0	0	113.7	R1059 E1065 I1066 E1067	R1059-G1063 WeakPolarHBondContact O-CA 3.45Å; R1059-G1063 PolarHBondContact O-N 2.91Å; R1059-G1063 VanDerWaalsContact O-N 3.1Å; G1063-E1065 VanDerWaalsContact C-N 3.34Å; G1063-E1065 PolarHBondContact O-N 3.01Å; G1063-I1066 PolarHBondContact O-N 2.88Å; G1063-E1067 WeakPolarHBondContact O-CG 3.45Å; G1063-E1067 PolarHBondContact O-N 3.04Å
1064	A	89.8	Confident	91	Very high	61 Å²	61	67.7 Å²	67.7	50%	0.504	34%	0.335	S	S	.	.	H	α-helix	trans	-63.7	-37.7	178.2	0	0	0	0	0	112.5	F1062 R1068	F1062-A1064 PolarHBondContact O-N 2.94Å; A1064-R1068 WeakPolarHBondContact O-CG 3.46Å; A1064-R1068 PolarHBondContact O-N 3.28Å
1065	E	92.3	Very high	90.6	Very high	30 Å²	30	68.7 Å²	68.7	14%	0.14	34%	0.34	C	S	.	.	H	α-helix	trans	-68.4	-42.2	174.2	-67.9	97.1	151.5	0	0	112.4	F1062 G1063 R1068 I1069 L1075 S1079 I1081	F1062-E1065 VanDerWaalsContact CA-OE2 3.3Å; F1062-E1065 WeakPolarHBondContact CA-OE2 3.44Å; F1062-E1065 PolarHBondContact O-N 3.35Å; F1062-E1065 VanDerWaalsContact O-N 3.16Å; G1063-E1065 VanDerWaalsContact C-N 3.34Å; G1063-E1065 PolarHBondContact O-N 3.01Å; E1065-R1068 PolarHBondContact O-N 3.45Å; E1065-I1069 WeakPolarHBondContact O-CD1 3.39Å; E1065-I1069 VanDerWaalsContact O-CG1 3.28Å; E1065-I1069 WeakPolarHBondContact O-CG1 3.16Å; E1065-I1069 PolarHBondContact O-N 2.9Å; E1065-L1075 HydrophobicContact CB-CD2 3.61Å; E1065-L1075 HydrophobicContact CG-CD2 3.73Å; E1065-S1079 WeakPolarHBondContact CG-OG 3.34Å; E1065-S1079 PolarHBondContact OE1-OG 3.19Å; E1065-I1081 HydrophobicContact CB-CD1 3.81Å; E1065-I1081 HydrophobicContact CB-CG1 4.47Å; E1065-I1081 HydrophobicContact CG-CD1 3.87Å; E1065-I1081 HydrophobicContact CG-CG1 4Å
1066	I	91.5	Very high	90.3	Very high	18 Å²	18	71.1 Å²	71.1	9%	0.092	35%	0.351	C	S	.	.	H	α-helix	trans	-60.9	-47	177.1	-68.4	164.3	0	0	0	110.4	Q1058 R1059 F1062 G1063 R1068 I1069 L1070 I1088 L1094	Q1058-I1066 HydrophobicContact CB-CD1 4.01Å; R1059-I1066 HydrophobicContact CG-CD1 4.32Å; F1062-I1066 HydrophobicContact CB-CD1 4.34Å; F1062-I1066 HydrophobicContact CB-CG1 4.49Å; F1062-I1066 VanDerWaalsContact O-CG1 3.3Å; F1062-I1066 WeakPolarHBondContact O-CG1 3.48Å; F1062-I1066 PolarHBondContact O-N 3.46Å; G1063-I1066 PolarHBondContact O-N 2.88Å; I1066-R1068 VanDerWaalsContact C-N 3.29Å; I1066-R1068 PolarHBondContact O-N 3.33Å; I1066-I1069 PolarHBondContact O-N 3.35Å; I1066-L1070 HydrophobicContact CG2-CD1 3.81Å; I1066-L1070 HydrophobicContact CG2-CG 4.3Å; I1066-L1070 WeakPolarHBondContact O-CB 3.33Å; I1066-L1070 VanDerWaalsContact O-CG 3.3Å; I1066-L1070 WeakPolarHBondContact O-CG 3.28Å; I1066-L1070 PolarHBondContact O-N 2.86Å; I1066-I1088 HydrophobicContact CG1-CD1 4.35Å; I1066-I1088 HydrophobicContact CG2-CD1 4.22Å; I1066-L1094 HydrophobicContact CG1-CD1 4.34Å; I1066-L1094 HydrophobicContact CG1-CD2 4.31Å
1067	E	90.5	Very high	89.8	Confident	135 Å²	135	75.2 Å²	75.2	63%	0.631	38%	0.378	S	S	*	.	H	α-helix	trans	-60.1	-39.1	177.2	-74.8	178.5	-174.6	0	0	112.4	G1063 S1071	G1063-E1067 WeakPolarHBondContact O-CG 3.45Å; G1063-E1067 PolarHBondContact O-N 3.04Å; E1067-S1071 VanDerWaalsContact O-CB 3.25Å; E1067-S1071 WeakPolarHBondContact O-CB 3.27Å; E1067-S1071 PolarHBondContact O-N 3.23Å; E1067-S1071 PolarHBondContact O-OG 3.48Å
1068	R	90.4	Very high	89.4	Confident	82 Å²	82	80.8 Å²	80.8	31%	0.309	41%	0.408	S	S	.	.	H	α-helix	trans	-66.2	-45.8	175.8	-79.5	-178.3	167.5	-127	0.2	112.2	A1064 E1065 I1066 S1071 H1072 K1073 P1074 L1075 Q1076	A1064-R1068 WeakPolarHBondContact O-CG 3.46Å; A1064-R1068 PolarHBondContact O-N 3.28Å; E1065-R1068 PolarHBondContact O-N 3.45Å; I1066-R1068 VanDerWaalsContact C-N 3.29Å; I1066-R1068 PolarHBondContact O-N 3.33Å; R1068-S1071 CarbonylContact O-C 3.52Å; R1068-S1071 PolarHBondContact O-N 3.3Å; R1068-H1072 PolarHBondContact O-N 3.35Å; R1068-H1072 VanDerWaalsContact O-N 3.13Å; R1068-K1073 CarbonylContact C-O 3.57Å; R1068-K1073 HydrophobicContact CB-CB 4.34Å; R1068-K1073 HydrophobicContact CG-CB 4.42Å; R1068-K1073 PolarHBondContact O-N 3.49Å; R1068-P1074 PolarHBondContact NH1-O 3.41Å; R1068-L1075 HydrophobicContact CB-CD2 4.27Å; R1068-Q1076 VanDerWaalsContact NH1-CG 3.32Å; R1068-Q1076 VanDerWaalsContact NH2-CG 3.35Å
1069	I	90.2	Very high	89	Confident	32 Å²	32	81.5 Å²	81.5	16%	0.164	41%	0.413	C	S	.	.	H	α-helix	trans	-61.6	-46	177.8	-67.5	161.8	0	0	0	110.2	E1065 I1066 S1071 H1072 L1075 P1086 I1088 L1094	E1065-I1069 WeakPolarHBondContact O-CD1 3.39Å; E1065-I1069 VanDerWaalsContact O-CG1 3.28Å; E1065-I1069 WeakPolarHBondContact O-CG1 3.16Å; E1065-I1069 PolarHBondContact O-N 2.9Å; I1066-I1069 PolarHBondContact O-N 3.35Å; I1069-S1071 VanDerWaalsContact C-N 3.27Å; I1069-S1071 PolarHBondContact O-N 2.92Å; I1069-H1072 PolarHBondContact O-N 2.91Å; I1069-L1075 HydrophobicContact CD1-CD2 4.26Å; I1069-L1075 HydrophobicContact CG1-CD2 4.05Å; I1069-P1086 HydrophobicContact CD1-CB 4.34Å; I1069-P1086 HydrophobicContact CD1-CG 4.15Å; I1069-P1086 WeakPolarHBondContact CD1-O 3.35Å; I1069-I1088 HydrophobicContact CG2-CG1 3.97Å; I1069-L1094 HydrophobicContact CD1-CD1 3.56Å
1070	L	90.3	Very high	88.7	Confident	107 Å²	107	79.8 Å²	79.8	56%	0.56	41%	0.407	S	S	*	.	H	α-helix	trans	-63.6	-31.7	176	-69.6	174.2	0	0	0	112.6	I1066 H1072 I1088	I1066-L1070 HydrophobicContact CG2-CD1 3.81Å; I1066-L1070 HydrophobicContact CG2-CG 4.3Å; I1066-L1070 WeakPolarHBondContact O-CB 3.33Å; I1066-L1070 VanDerWaalsContact O-CG 3.3Å; I1066-L1070 WeakPolarHBondContact O-CG 3.28Å; I1066-L1070 PolarHBondContact O-N 2.86Å; L1070-H1072 VanDerWaalsContact C-N 3.25Å; L1070-H1072 PolarHBondContact O-N 3.42Å; L1070-I1088 HydrophobicContact CD2-CG1 4.23Å
1071	S	90.9	Very high	88.6	Confident	68 Å²	68	73.7 Å²	73.7	48%	0.476	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	7.1	174.3	-55.6	0	0	0	0	113.6	E1067 R1068 I1069 K1073	E1067-S1071 VanDerWaalsContact O-CB 3.25Å; E1067-S1071 WeakPolarHBondContact O-CB 3.27Å; E1067-S1071 PolarHBondContact O-N 3.23Å; E1067-S1071 PolarHBondContact O-OG 3.48Å; R1068-S1071 CarbonylContact O-C 3.52Å; R1068-S1071 PolarHBondContact O-N 3.3Å; I1069-S1071 VanDerWaalsContact C-N 3.27Å; I1069-S1071 PolarHBondContact O-N 2.92Å; S1071-K1073 PolarHBondContact O-N 3.27Å; S1071-K1073 VanDerWaalsContact O-N 3.13Å
1072	H	84.8	Confident	88.2	Confident	181 Å²	181	77.7 Å²	77.7	84%	0.838	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.8	30.9	-173.4	-58.2	-72.9	0	0	0	114.3	R1068 I1069 L1070	R1068-H1072 PolarHBondContact O-N 3.35Å; R1068-H1072 VanDerWaalsContact O-N 3.13Å; I1069-H1072 PolarHBondContact O-N 2.91Å; L1070-H1072 VanDerWaalsContact C-N 3.25Å; L1070-H1072 PolarHBondContact O-N 3.42Å
1073	K	85.5	Confident	87.8	Confident	132 Å²	132	84.9 Å²	84.9	57%	0.574	43%	0.43	S	S	*	.	P	Polyproline II helix	trans	-97.4	141.2	176.3	-69.4	176.9	-177	173.1	0	110.2	R1068 S1071	R1068-K1073 CarbonylContact C-O 3.57Å; R1068-K1073 HydrophobicContact CB-CB 4.34Å; R1068-K1073 HydrophobicContact CG-CB 4.42Å; R1068-K1073 PolarHBondContact O-N 3.49Å; S1071-K1073 PolarHBondContact O-N 3.27Å; S1071-K1073 VanDerWaalsContact O-N 3.13Å
1074	P	84.6	Confident	87.6	Confident	108 Å²	108	85.3 Å²	85.3	70%	0.701	43%	0.426	S	S	*	.	P	Polyproline II helix	trans	-62.1	145.4	176	25.4	-33.1	0	0	0	111.6	R1068	R1068-P1074 PolarHBondContact NH1-O 3.41Å
1075	L	87.1	Confident	87.5	Confident	25 Å²	25	87.6 Å²	87.6	13%	0.131	43%	0.43	C	S	.	.	P	Polyproline II helix	trans	-62.4	150.5	173.6	-66.5	-175.6	0	0	0	111.2	E1065 R1068 I1069 I1081 R1082 P1086	E1065-L1075 HydrophobicContact CB-CD2 3.61Å; E1065-L1075 HydrophobicContact CG-CD2 3.73Å; R1068-L1075 HydrophobicContact CB-CD2 4.27Å; I1069-L1075 HydrophobicContact CD1-CD2 4.26Å; I1069-L1075 HydrophobicContact CG1-CD2 4.05Å; L1075-I1081 HydrophobicContact CD1-CG1 4.26Å; L1075-R1082 HydrophobicContact CB-CG 4.43Å; L1075-R1082 HydrophobicContact CD1-CB 4.41Å; L1075-P1086 HydrophobicContact CD1-CG 3.47Å; L1075-P1086 VanDerWaalsContact CD1-CG 3.47Å
1076	Q	86.6	Confident	87.4	Confident	98 Å²	98	86.8 Å²	86.8	46%	0.458	43%	0.427	S	S	.	.	P	Polyproline II helix	trans	-62.9	149.8	174.9	-64	-172.9	-61.2	0	0	110.9	R1068 D1078 S1079	R1068-Q1076 VanDerWaalsContact NH1-CG 3.32Å; R1068-Q1076 VanDerWaalsContact NH2-CG 3.35Å; Q1076-D1078 WeakPolarHBondContact CB-OD1 3.45Å; Q1076-D1078 PolarHBondContact O-N 3.34Å; Q1076-S1079 WeakPolarHBondContact O-CB 3.41Å; Q1076-S1079 PolarHBondContact O-N 3.27Å; Q1076-S1079 VanDerWaalsContact O-N 3.08Å
1077	T	81.4	Confident	87.4	Confident	120 Å²	120	89 Å²	89	74%	0.736	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-27.8	-178.1	34.3	0	0	0	0	113.5
1078	D	85.4	Confident	87.4	Confident	117 Å²	117	84.5 Å²	84.5	63%	0.626	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	-2.3	179.7	65	-29.8	0	0	0	114.2	Q1076 R1080	Q1076-D1078 WeakPolarHBondContact CB-OD1 3.45Å; Q1076-D1078 PolarHBondContact O-N 3.34Å; D1078-R1080 PolarHBondContact O-N 2.88Å
1079	S	87.6	Confident	87.3	Confident	17 Å²	17	80.8 Å²	80.8	12%	0.119	40%	0.403	C	S	.	.			trans	-62.6	125.9	178.2	175.6	0	0	0	0	111.1	E1065 Q1076 I1081 R1082	E1065-S1079 WeakPolarHBondContact CG-OG 3.34Å; E1065-S1079 PolarHBondContact OE1-OG 3.19Å; Q1076-S1079 WeakPolarHBondContact O-CB 3.41Å; Q1076-S1079 PolarHBondContact O-N 3.27Å; Q1076-S1079 VanDerWaalsContact O-N 3.08Å; S1079-I1081 PolarHBondContact O-N 3.42Å; S1079-I1081 WeakPolarHBondContact OG-CG1 3.36Å; S1079-I1081 PolarHBondContact OG-N 3.43Å; S1079-R1082 WeakPolarHBondContact O-CB 3.31Å; S1079-R1082 PolarHBondContact O-N 3.16Å
1080	R	84.6	Confident	87.1	Confident	144 Å²	144	86.9 Å²	86.9	54%	0.543	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-17.5	-178	-60.5	-179.5	-64.4	178.3	1.2	113.5	D1078 Q1083	D1078-R1080 PolarHBondContact O-N 2.88Å; R1080-Q1083 PolarHBondContact O-NE2 2.9Å
1081	I	89.3	Confident	87	Confident	0 Å²	0	84 Å²	84	0%	0	42%	0.422	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.3	-5.8	-174.6	65.7	164.3	0	0	0	113.5	F1062 E1065 L1075 S1079 Q1083 F1084 P1086 L1094 L1114 I1152	F1062-I1081 HydrophobicContact CB-CD1 4.38Å; F1062-I1081 HydrophobicContact CD1-CD1 4.25Å; F1062-I1081 HydrophobicContact CD1-CG2 4.05Å; F1062-I1081 HydrophobicContact CE1-CG2 3.73Å; F1062-I1081 HydrophobicContact CG-CD1 4.33Å; F1062-I1081 HydrophobicContact CZ-CG2 4.32Å; E1065-I1081 HydrophobicContact CB-CD1 3.81Å; E1065-I1081 HydrophobicContact CB-CG1 4.47Å; E1065-I1081 HydrophobicContact CG-CD1 3.87Å; E1065-I1081 HydrophobicContact CG-CG1 4Å; L1075-I1081 HydrophobicContact CD1-CG1 4.26Å; S1079-I1081 PolarHBondContact O-N 3.42Å; S1079-I1081 WeakPolarHBondContact OG-CG1 3.36Å; S1079-I1081 PolarHBondContact OG-N 3.43Å; I1081-Q1083 PolarHBondContact O-N 2.93Å; I1081-Q1083 VanDerWaalsContact O-N 3.12Å; I1081-F1084 HydrophobicContact CB-CD2 4.08Å; I1081-F1084 HydrophobicContact CG2-CD2 4.38Å; I1081-F1084 PolarHBondContact O-N 3.15Å; I1081-P1086 HydrophobicContact CD1-CB 4.32Å; I1081-P1086 HydrophobicContact CD1-CG 4.01Å; I1081-P1086 HydrophobicContact CG1-CG 4.23Å; I1081-P1086 WeakPolarHBondContact O-CD 3.2Å; I1081-L1094 HydrophobicContact CD1-CD2 3.74Å; I1081-L1114 HydrophobicContact CB-CD2 3.68Å; I1081-L1114 HydrophobicContact CD1-CD2 3.81Å; I1081-L1114 HydrophobicContact CG1-CD2 4.39Å; I1081-L1114 HydrophobicContact CG2-CD2 3.48Å; I1081-L1114 VanDerWaalsContact CG2-CD2 3.48Å; I1081-I1152 HydrophobicContact CG2-CD1 3.42Å; I1081-I1152 VanDerWaalsContact CG2-CD1 3.42Å; I1081-I1152 HydrophobicContact CG2-CG1 4.39Å
1082	R	85.5	Confident	86.9	Confident	136 Å²	136	86 Å²	86	51%	0.513	43%	0.427	S	S	.	.	G	3₁₀ helix	trans	-53.6	-35.2	179.5	-175.7	179.3	178.7	-153.3	3.4	113	L1075 S1079 F1084 D1085	L1075-R1082 HydrophobicContact CB-CG 4.43Å; L1075-R1082 HydrophobicContact CD1-CB 4.41Å; S1079-R1082 WeakPolarHBondContact O-CB 3.31Å; S1079-R1082 PolarHBondContact O-N 3.16Å; R1082-F1084 PolarHBondContact O-N 2.9Å; R1082-D1085 PolarHBondContact O-N 3.46Å
1083	Q	84.6	Confident	87.4	Confident	152 Å²	152	77.6 Å²	77.6	71%	0.71	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	-66.1	-15.6	179	70.2	-172.9	-39.7	0	0	114.7	R1080 I1081	R1080-Q1083 PolarHBondContact O-NE2 2.9Å; I1081-Q1083 PolarHBondContact O-N 2.93Å; I1081-Q1083 VanDerWaalsContact O-N 3.12Å
1084	F	87.7	Confident	87.8	Confident	29 Å²	29	71.3 Å²	71.3	13%	0.127	36%	0.361	C	S	.	.	G	3₁₀ helix	trans	-98.5	9.9	-176.9	-53.9	-59.5	0	0	0	113.1	I1081 R1082 P1086 V1096 G1097 L1114 W1150 I1152	I1081-F1084 HydrophobicContact CB-CD2 4.08Å; I1081-F1084 HydrophobicContact CG2-CD2 4.38Å; I1081-F1084 PolarHBondContact O-N 3.15Å; R1082-F1084 PolarHBondContact O-N 2.9Å; F1084-P1086 VanDerWaalsContact C-N 3.34Å; F1084-V1096 HydrophobicContact CB-CG1 4.25Å; F1084-V1096 HydrophobicContact CB-CG2 4.32Å; F1084-G1097 PolarHBondContact O-N 3.24Å; F1084-L1114 HydrophobicContact CB-CD1 4.1Å; F1084-L1114 HydrophobicContact CD2-CD1 3.72Å; F1084-L1114 HydrophobicContact CE2-CD1 4.42Å; F1084-L1114 HydrophobicContact CG-CD1 4Å; F1084-W1150 HydrophobicContact CD1-CZ2 4.37Å; F1084-W1150 AromaticContact CD1-NE1 3.49Å; F1084-W1150 AromaticContact CE1-CE2 3.7Å; F1084-W1150 AromaticContact CE1-CZ2 3.86Å; F1084-W1150 HydrophobicContact CE1-CZ2 3.86Å; F1084-W1150 AromaticContact CE1-NE1 3.07Å; F1084-W1150 AromaticContact CZ-NE1 3.39Å; F1084-I1152 HydrophobicContact CE2-CG1 4.27Å
1085	D	86.9	Confident	88.2	Confident	108 Å²	108	66.4 Å²	66.4	58%	0.578	33%	0.328	S	S	*	.			trans	42.5	54.7	-177	-167.1	32.6	0	0	0	113.2	R1082 G1097	R1082-D1085 PolarHBondContact O-N 3.46Å; D1085-G1097 WeakPolarHBondContact O-CA 3.48Å; D1085-G1097 PolarHBondContact O-N 3.32Å; D1085-G1097 VanDerWaalsContact O-N 3.1Å
1086	P	90.2	Very high	88.3	Confident	13 Å²	13	66.3 Å²	66.3	8%	0.084	33%	0.328	C	S	.	.			trans	-73.1	139.8	-164.5	31.5	-37.4	0	0	0	111.9	I1069 L1075 I1081 F1084 L1094 R1095	I1069-P1086 HydrophobicContact CD1-CB 4.34Å; I1069-P1086 HydrophobicContact CD1-CG 4.15Å; I1069-P1086 WeakPolarHBondContact CD1-O 3.35Å; L1075-P1086 HydrophobicContact CD1-CG 3.47Å; L1075-P1086 VanDerWaalsContact CD1-CG 3.47Å; I1081-P1086 HydrophobicContact CD1-CB 4.32Å; I1081-P1086 HydrophobicContact CD1-CG 4.01Å; I1081-P1086 HydrophobicContact CG1-CG 4.23Å; I1081-P1086 WeakPolarHBondContact O-CD 3.2Å; F1084-P1086 VanDerWaalsContact C-N 3.34Å; P1086-L1094 HydrophobicContact CB-CD1 3.93Å; P1086-L1094 HydrophobicContact CB-CG 4.26Å; P1086-R1095 WeakPolarHBondContact CA-O 3.3Å
1087	F	90.4	Very high	87.9	Confident	65 Å²	65	62 Å²	62	29%	0.285	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	165.4	175.7	72.7	-80	0	0	0	111.2	R1095 V1096 H1111	F1087-R1095 HydrophobicContact CE1-CB 4.26Å; F1087-R1095 HydrophobicContact CZ-CB 4.26Å; F1087-R1095 PolarHBondContact N-O 3.41Å; F1087-R1095 VanDerWaalsContact N-O 3.12Å; F1087-R1095 PolarHBondContact O-N 3.48Å; F1087-V1096 WeakPolarHBondContact CE1-O 3.47Å; F1087-H1111 HydrophobicContact CE1-CB 4.45Å; F1087-H1111 AromaticContact CE1-CE1 3.8Å; F1087-H1111 AromaticContact CE1-ND1 3.38Å; F1087-H1111 WeakPolarHBondContact CE1-ND1 3.35Å; F1087-H1111 HydrophobicContact CZ-CB 4.1Å; F1087-H1111 AromaticContact CZ-CE1 3.76Å; F1087-H1111 AromaticContact CZ-CG 3.69Å; F1087-H1111 AromaticContact CZ-ND1 3.46Å; F1087-H1111 WeakPolarHBondContact CZ-ND1 3.45Å
1088	I	91.8	Very high	87	Confident	40 Å²	40	58.1 Å²	58.1	21%	0.205	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	120.2	176.4	-58.7	-61.8	0	0	0	109.1	I1066 I1069 L1070 L1094	I1066-I1088 HydrophobicContact CG1-CD1 4.35Å; I1066-I1088 HydrophobicContact CG2-CD1 4.22Å; I1069-I1088 HydrophobicContact CG2-CG1 3.97Å; L1070-I1088 HydrophobicContact CD2-CG1 4.23Å; I1088-L1094 HydrophobicContact CD1-CB 4.22Å; I1088-L1094 HydrophobicContact CD1-CD1 3.77Å
1089	G	88.2	Confident	85.6	Confident	4 Å²	4	59.9 Å²	59.9	4%	0.041	30%	0.299	C	S	.	.			trans	-76.3	175.1	176.4	0	0	0	0	0	113.5	D1091 N1092 L1093 Y1107	G1089-D1091 PolarHBondContact O-N 3.15Å; G1089-D1091 VanDerWaalsContact O-N 3.12Å; G1089-N1092 PolarHBondContact O-N 2.88Å; G1089-L1093 PolarHBondContact N-O 3.5Å; G1089-Y1107 WeakPolarHBondContact CA-OH 3.46Å
1090	N	86.7	Confident	83.9	Confident	161 Å²	161	62 Å²	62	86%	0.861	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-19.1	-180	-64.1	-16	0	0	0	113.4	N1092	N1090-N1092 VanDerWaalsContact C-N 3.3Å
1091	D	87	Confident	82.5	Confident	46 Å²	46	58.8 Å²	58.8	25%	0.246	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	8.4	174.9	57.6	-3.8	0	0	0	113.5	Q1055 G1089 L1093 R1095	Q1055-D1091 PolarHBondContact NE2-O 3.11Å; G1089-D1091 PolarHBondContact O-N 3.15Å; G1089-D1091 VanDerWaalsContact O-N 3.12Å; D1091-L1093 PolarHBondContact O-N 3.31Å; D1091-L1093 PolarHBondContact OD1-N 2.8Å; D1091-L1093 WeakPolarHBondContact OD2-CD1 3.42Å; D1091-R1095 IonicContact OD1-NE 3.86Å; D1091-R1095 PolarHBondContact OD1-NE 2.82Å; D1091-R1095 IonicContact OD2-CZ 4Å; D1091-R1095 IonicContact OD2-NE 2.93Å; D1091-R1095 PolarHBondContact OD2-NE 3.46Å; D1091-R1095 IonicContact OD2-NH2 3.68Å; D1091-R1095 PolarHBondContact OD2-NH2 3.42Å
1092	N	89.8	Confident	81.1	Confident	111 Å²	111	68.5 Å²	68.5	59%	0.594	34%	0.342	S	S	*	.	S	Bend	trans	59	22.5	-174.5	-61.8	-56	0	0	0	114.1	G1089 N1090	G1089-N1092 PolarHBondContact O-N 2.88Å; N1090-N1092 VanDerWaalsContact C-N 3.3Å
1093	L	93.9	Very high	80	Confident	3 Å²	3	63.7 Å²	63.7	2%	0.016	33%	0.33	C	S	.	.			trans	-95.9	143.8	172.8	-69.3	174.9	0	0	0	111.1	L1054 Q1055 G1089 D1091 R1095 I1113	L1054-L1093 HydrophobicContact CB-CD1 4.35Å; L1054-L1093 HydrophobicContact CB-CD2 3.61Å; L1054-L1093 HydrophobicContact CD1-CD1 4.13Å; Q1055-L1093 HydrophobicContact CB-CD2 4.33Å; Q1055-L1093 HydrophobicContact CG-CD2 3.49Å; Q1055-L1093 VanDerWaalsContact CG-CD2 3.49Å; Q1055-L1093 HydrophobicContact CG-CG 4.34Å; G1089-L1093 PolarHBondContact N-O 3.5Å; D1091-L1093 PolarHBondContact O-N 3.31Å; D1091-L1093 PolarHBondContact OD1-N 2.8Å; D1091-L1093 WeakPolarHBondContact OD2-CD1 3.42Å; L1093-R1095 PolarHBondContact O-N 2.75Å; L1093-I1113 HydrophobicContact CB-CG2 4.5Å; L1093-I1113 HydrophobicContact CD1-CD1 3.81Å; L1093-I1113 HydrophobicContact CD1-CG1 4.22Å; L1093-I1113 HydrophobicContact CD1-CG2 4.34Å
1094	L	94.2	Very high	79.3	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	116.9	171.1	-169.6	71.2	0	0	0	109.5	Q1058 F1062 I1066 I1069 I1081 P1086 I1088 L1114	Q1058-L1094 HydrophobicContact CG-CB 4.39Å; Q1058-L1094 PolarHBondContact NE2-O 2.86Å; F1062-L1094 HydrophobicContact CB-CD2 3.9Å; F1062-L1094 HydrophobicContact CD2-CD2 3.77Å; F1062-L1094 HydrophobicContact CG-CD2 4.02Å; I1066-L1094 HydrophobicContact CG1-CD1 4.34Å; I1066-L1094 HydrophobicContact CG1-CD2 4.31Å; I1069-L1094 HydrophobicContact CD1-CD1 3.56Å; I1081-L1094 HydrophobicContact CD1-CD2 3.74Å; P1086-L1094 HydrophobicContact CB-CD1 3.93Å; P1086-L1094 HydrophobicContact CB-CG 4.26Å; I1088-L1094 HydrophobicContact CD1-CB 4.22Å; I1088-L1094 HydrophobicContact CD1-CD1 3.77Å; L1094-L1114 HydrophobicContact CD2-CB 4.45Å; L1094-L1114 HydrophobicContact CD2-CD2 3.84Å; L1094-L1114 HydrophobicContact CG-CB 4.39Å; L1094-L1114 HydrophobicContact CG-CD2 4.39Å; L1094-L1114 PolarHBondContact O-N 3.07Å
1095	R	93.3	Very high	78.4	Confident	6 Å²	6	68.8 Å²	68.8	2%	0.023	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	156.5	-176.2	-69.9	175.9	173.9	-91.4	4.9	110.9	P1086 F1087 D1091 L1093 H1111 Q1112 I1113	P1086-R1095 WeakPolarHBondContact CA-O 3.3Å; F1087-R1095 HydrophobicContact CE1-CB 4.26Å; F1087-R1095 HydrophobicContact CZ-CB 4.26Å; F1087-R1095 PolarHBondContact N-O 3.41Å; F1087-R1095 VanDerWaalsContact N-O 3.12Å; F1087-R1095 PolarHBondContact O-N 3.48Å; D1091-R1095 IonicContact OD1-NE 3.86Å; D1091-R1095 PolarHBondContact OD1-NE 2.82Å; D1091-R1095 IonicContact OD2-CZ 4Å; D1091-R1095 IonicContact OD2-NE 2.93Å; D1091-R1095 PolarHBondContact OD2-NE 3.46Å; D1091-R1095 IonicContact OD2-NH2 3.68Å; D1091-R1095 PolarHBondContact OD2-NH2 3.42Å; L1093-R1095 PolarHBondContact O-N 2.75Å; R1095-H1111 HydrophobicContact CB-CB 4.2Å; R1095-H1111 WeakPolarHBondContact CD-O 3.38Å; R1095-H1111 WeakPolarHBondContact CG-O 3.48Å; R1095-H1111 PolarHBondContact NH1-O 3.26Å; R1095-Q1112 WeakPolarHBondContact CA-O 3.35Å; R1095-I1113 HydrophobicContact CG-CG1 4.28Å
1096	V	88.9	Confident	77.8	Confident	22 Å²	22	69.9 Å²	69.9	13%	0.133	36%	0.362	C	S	.	.			trans	-72.2	129.3	175.7	176	0	0	0	0	109.8	F1084 F1087 H1111 Q1112 L1114 W1150	F1084-V1096 HydrophobicContact CB-CG1 4.25Å; F1084-V1096 HydrophobicContact CB-CG2 4.32Å; F1087-V1096 WeakPolarHBondContact CE1-O 3.47Å; V1096-H1111 PolarHBondContact O-ND1 3.1Å; V1096-H1111 VanDerWaalsContact O-ND1 3.1Å; V1096-Q1112 PolarHBondContact N-O 2.96Å; V1096-L1114 HydrophobicContact CG2-CD1 3.48Å; V1096-L1114 VanDerWaalsContact CG2-CD1 3.48Å; V1096-W1150 HydrophobicContact CG2-CB 3.58Å; V1096-W1150 HydrophobicContact CG2-CD2 4.47Å; V1096-W1150 HydrophobicContact CG2-CG 3.77Å
1097	G	78	Confident	77.4	Confident	9 Å²	9	73.6 Å²	73.6	9%	0.093	38%	0.375	C	S	.	.			trans	-98.6	-179	168	0	0	0	0	0	112.2	F1084 D1085	F1084-G1097 PolarHBondContact O-N 3.24Å; D1085-G1097 WeakPolarHBondContact O-CA 3.48Å; D1085-G1097 PolarHBondContact O-N 3.32Å; D1085-G1097 VanDerWaalsContact O-N 3.1Å
1098	G	62.7	Low	77	Confident	38 Å²	38	74.3 Å²	74.3	39%	0.392	38%	0.379	S	S	.	.	S	Bend	trans	76.8	124.1	172.5	0	0	0	0	0	115.8	N1100	G1098-N1100 PolarHBondContact O-N 2.9Å
1099	Q	56.8	Low	76.3	Confident	153 Å²	153	73.4 Å²	73.4	72%	0.715	38%	0.377	S	S	*	.	S	Bend	trans	83.7	-39.1	165	-51.7	-171	4.4	0	0	119
1100	N	51.6	Low	75.8	Confident	63 Å²	63	75 Å²	75	34%	0.337	38%	0.384	S	S	.	.			trans	-95.1	0.5	179.5	-94	-7.7	0	0	0	115.4	G1098 R1102 S1103	G1098-N1100 PolarHBondContact O-N 2.9Å; N1100-R1102 PolarHBondContact O-N 3.26Å; N1100-S1103 WeakPolarHBondContact O-CB 3.34Å; N1100-S1103 PolarHBondContact O-N 2.92Å; N1100-S1103 PolarHBondContact O-OG 3.45Å
1101	T	55.7	Low	75.8	Confident	76 Å²	76	68.2 Å²	68.2	47%	0.466	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-20.7	178.7	36.5	0	0	0	0	114.1	H1111	T1101-H1111 WeakPolarHBondContact CG2-CE1 3.2Å
1102	R	59.9	Low	76	Confident	203 Å²	203	67.2 Å²	67.2	77%	0.766	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.6	2.6	-179.6	-60	-174.1	-178.8	-173.3	-0.2	114.5	N1100	N1100-R1102 PolarHBondContact O-N 3.26Å
1103	S	62	Low	76.2	Confident	36 Å²	36	62 Å²	62	25%	0.252	31%	0.313	S	S	.	.	S	Bend	trans	-78.9	157.1	176.2	66	0	0	0	0	110.8	N1100 L1105 Q1110	N1100-S1103 WeakPolarHBondContact O-CB 3.34Å; N1100-S1103 PolarHBondContact O-N 2.92Å; N1100-S1103 PolarHBondContact O-OG 3.45Å; S1103-L1105 PolarHBondContact O-N 3.36Å; S1103-L1105 VanDerWaalsContact O-N 3.15Å; S1103-L1105 WeakPolarHBondContact OG-CB 3.37Å; S1103-L1105 WeakPolarHBondContact OG-CG 3.46Å; S1103-Q1110 PolarHBondContact O-NE2 3.47Å
1104	Q	68.8	Low	76.2	Confident	204 Å²	204	61.9 Å²	61.9	95%	0.953	31%	0.312	S	S	*	.	S	Bend	trans	-78	15.4	172.1	-68.9	179.3	-8.3	0	0	113.3
1105	L	68.9	Low	76.3	Confident	84 Å²	84	61.9 Å²	61.9	44%	0.44	31%	0.312	S	S	.	.	S	Bend	trans	-69.8	150.1	177.5	-66.5	175	0	0	0	110.2	S1103 A1109 Q1110	S1103-L1105 PolarHBondContact O-N 3.36Å; S1103-L1105 VanDerWaalsContact O-N 3.15Å; S1103-L1105 WeakPolarHBondContact OG-CB 3.37Å; S1103-L1105 WeakPolarHBondContact OG-CG 3.46Å; L1105-A1109 HydrophobicContact CB-CB 4Å; L1105-A1109 HydrophobicContact CD1-CB 4.35Å; L1105-Q1110 HydrophobicContact CB-CG 3.72Å; L1105-Q1110 VanDerWaalsContact O-CG 3.22Å; L1105-Q1110 WeakPolarHBondContact O-CG 3.34Å; L1105-Q1110 PolarHBondContact O-NE2 2.93Å
1106	D	76.2	Confident	76.4	Confident	131 Å²	131	61.8 Å²	61.8	70%	0.701	31%	0.312	S	S	*	.			trans	-58.1	152.1	171.3	-55.1	-32.6	0	0	0	110.5	E1108 A1109 Q1110	D1106-E1108 PolarHBondContact O-N 2.86Å; D1106-A1109 PolarHBondContact O-N 3.33Å; D1106-Q1110 PolarHBondContact O-N 2.87Å
1107	Y	81.6	Confident	76.6	Confident	90 Å²	90	62.3 Å²	62.3	35%	0.353	32%	0.315	S	S	.	.	H	α-helix	trans	-48.5	-38.4	-178.7	179.7	-99.4	0	0	0	113.3	G1089 A1109 H1111	G1089-Y1107 WeakPolarHBondContact CA-OH 3.46Å; Y1107-A1109 PolarHBondContact O-N 3.36Å; Y1107-H1111 AromaticContact CD2-CD2 3.72Å; Y1107-H1111 HydrophobicContact CE2-CB 4.49Å; Y1107-H1111 AromaticContact CE2-CD2 3.64Å; Y1107-H1111 WeakPolarHBondContact O-CB 3.28Å; Y1107-H1111 PolarHBondContact O-N 2.88Å
1108	E	81	Confident	77.2	Confident	81 Å²	81	66.6 Å²	66.6	38%	0.379	34%	0.335	S	S	.	.	H	α-helix	trans	-66.5	-35.1	177.9	-65.9	-158.2	145	0	0	114	D1106 H1111 Q1112 K1148	D1106-E1108 PolarHBondContact O-N 2.86Å; E1108-H1111 CarbonylContact O-C 3.59Å; E1108-Q1112 WeakPolarHBondContact O-CA 3.26Å; E1108-Q1112 PolarHBondContact O-N 3.24Å; E1108-K1148 VanDerWaalsContact OE1-CE 3.27Å; E1108-K1148 WeakPolarHBondContact OE1-CE 3.32Å; E1108-K1148 WeakPolarHBondContact OE2-CD 3.26Å
1109	A	76.5	Confident	78.7	Confident	20 Å²	20	65.4 Å²	65.4	17%	0.165	32%	0.32	C	S	.	.	H	α-helix	trans	-83	-33.9	-179.7	0	0	0	0	0	112	L1105 D1106 Y1107 Q1112 Q1147	L1105-A1109 HydrophobicContact CB-CB 4Å; L1105-A1109 HydrophobicContact CD1-CB 4.35Å; D1106-A1109 PolarHBondContact O-N 3.33Å; Y1107-A1109 PolarHBondContact O-N 3.36Å; A1109-Q1112 PolarHBondContact O-NE2 3.44Å; A1109-Q1147 WeakPolarHBondContact CA-O 3.41Å
1110	Q	78	Confident	80.4	Confident	38 Å²	38	61.1 Å²	61.1	18%	0.178	30%	0.3	C	S	.	.	H	α-helix	trans	-64.6	-45.4	170.4	-68	-178.8	-33.8	0	0	111.6	S1103 L1105 D1106	S1103-Q1110 PolarHBondContact O-NE2 3.47Å; L1105-Q1110 HydrophobicContact CB-CG 3.72Å; L1105-Q1110 VanDerWaalsContact O-CG 3.22Å; L1105-Q1110 WeakPolarHBondContact O-CG 3.34Å; L1105-Q1110 PolarHBondContact O-NE2 2.93Å; D1106-Q1110 PolarHBondContact O-N 2.87Å
1111	H	86.4	Confident	82.5	Confident	19 Å²	19	58.2 Å²	58.2	9%	0.088	28%	0.284	C	S	.	.	S	Bend	trans	-121.8	66.9	-170	-64.2	-62.5	0	0	0	111.1	F1087 R1095 V1096 T1101 Y1107 E1108	F1087-H1111 HydrophobicContact CE1-CB 4.45Å; F1087-H1111 AromaticContact CE1-CE1 3.8Å; F1087-H1111 AromaticContact CE1-ND1 3.38Å; F1087-H1111 WeakPolarHBondContact CE1-ND1 3.35Å; F1087-H1111 HydrophobicContact CZ-CB 4.1Å; F1087-H1111 AromaticContact CZ-CE1 3.76Å; F1087-H1111 AromaticContact CZ-CG 3.69Å; F1087-H1111 AromaticContact CZ-ND1 3.46Å; F1087-H1111 WeakPolarHBondContact CZ-ND1 3.45Å; R1095-H1111 HydrophobicContact CB-CB 4.2Å; R1095-H1111 WeakPolarHBondContact CD-O 3.38Å; R1095-H1111 WeakPolarHBondContact CG-O 3.48Å; R1095-H1111 PolarHBondContact NH1-O 3.26Å; V1096-H1111 PolarHBondContact O-ND1 3.1Å; V1096-H1111 VanDerWaalsContact O-ND1 3.1Å; T1101-H1111 WeakPolarHBondContact CG2-CE1 3.2Å; Y1107-H1111 AromaticContact CD2-CD2 3.72Å; Y1107-H1111 HydrophobicContact CE2-CB 4.49Å; Y1107-H1111 AromaticContact CE2-CD2 3.64Å; Y1107-H1111 WeakPolarHBondContact O-CB 3.28Å; Y1107-H1111 PolarHBondContact O-N 2.88Å; E1108-H1111 CarbonylContact O-C 3.59Å
1112	Q	91.1	Very high	84.4	Confident	25 Å²	25	54.7 Å²	54.7	12%	0.117	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-58.9	140.9	-177.5	-67.3	161.3	45.8	0	0	111.7	R1095 V1096 E1108 A1109 L1114 R1146 W1150	R1095-Q1112 WeakPolarHBondContact CA-O 3.35Å; V1096-Q1112 PolarHBondContact N-O 2.96Å; E1108-Q1112 WeakPolarHBondContact O-CA 3.26Å; E1108-Q1112 PolarHBondContact O-N 3.24Å; A1109-Q1112 PolarHBondContact O-NE2 3.44Å; Q1112-L1114 PolarHBondContact O-N 3.21Å; Q1112-R1146 WeakPolarHBondContact CG-O 3.36Å; Q1112-R1146 PolarHBondContact NE2-O 3.21Å; Q1112-R1146 PolarHBondContact OE1-O 3.27Å; Q1112-R1146 VanDerWaalsContact OE1-O 3.1Å; Q1112-W1150 HydrophobicContact CB-CB 3.93Å
1113	I	94.2	Very high	86.2	Confident	2 Å²	2	47 Å²	47	1%	0.01	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	124.1	-178	-60.3	163.2	0	0	0	109.3	L1054 L1093 R1095 L1115 K1148 F1149 W1150	L1054-I1113 HydrophobicContact CD1-CD1 4.09Å; L1093-I1113 HydrophobicContact CB-CG2 4.5Å; L1093-I1113 HydrophobicContact CD1-CD1 3.81Å; L1093-I1113 HydrophobicContact CD1-CG1 4.22Å; L1093-I1113 HydrophobicContact CD1-CG2 4.34Å; R1095-I1113 HydrophobicContact CG-CG1 4.28Å; I1113-L1115 HydrophobicContact CG2-CD2 4.43Å; I1113-L1115 HydrophobicContact CG2-CG 4.33Å; I1113-K1148 HydrophobicContact CD1-CG 4.31Å; I1113-K1148 PolarHBondContact N-O 2.97Å; I1113-F1149 HydrophobicContact CB-CD1 4.04Å; I1113-F1149 HydrophobicContact CD1-CD1 4.27Å; I1113-F1149 HydrophobicContact CD1-CE1 4Å; I1113-F1149 WeakPolarHBondContact O-CA 3.46Å; I1113-W1150 PolarHBondContact O-N 2.76Å
1114	L	94.1	Very high	87.8	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	124.2	-176.4	-160.3	88.8	0	0	0	110.9	Q1058 F1062 I1081 F1084 L1094 V1096 Q1112 W1150	Q1058-L1114 PolarHBondContact NE2-O 3.11Å; F1062-L1114 HydrophobicContact CE2-CD2 4.25Å; F1062-L1114 HydrophobicContact CZ-CD2 4.37Å; I1081-L1114 HydrophobicContact CB-CD2 3.68Å; I1081-L1114 HydrophobicContact CD1-CD2 3.81Å; I1081-L1114 HydrophobicContact CG1-CD2 4.39Å; I1081-L1114 HydrophobicContact CG2-CD2 3.48Å; I1081-L1114 VanDerWaalsContact CG2-CD2 3.48Å; F1084-L1114 HydrophobicContact CB-CD1 4.1Å; F1084-L1114 HydrophobicContact CD2-CD1 3.72Å; F1084-L1114 HydrophobicContact CE2-CD1 4.42Å; F1084-L1114 HydrophobicContact CG-CD1 4Å; L1094-L1114 HydrophobicContact CD2-CB 4.45Å; L1094-L1114 HydrophobicContact CD2-CD2 3.84Å; L1094-L1114 HydrophobicContact CG-CB 4.39Å; L1094-L1114 HydrophobicContact CG-CD2 4.39Å; L1094-L1114 PolarHBondContact O-N 3.07Å; V1096-L1114 HydrophobicContact CG2-CD1 3.48Å; V1096-L1114 VanDerWaalsContact CG2-CD1 3.48Å; Q1112-L1114 PolarHBondContact O-N 3.21Å; L1114-W1150 WeakPolarHBondContact CA-O 3.43Å; L1114-W1150 HydrophobicContact CD1-CB 4.45Å; L1114-W1150 HydrophobicContact CD1-CG 4.4Å
1115	L	97	Very high	89.1	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	149.1	-177.4	-69.1	175.9	0	0	0	112.7	L1054 V1057 Q1058 I1113 V1122 F1149 W1150 I1151 I1152	L1054-L1115 HydrophobicContact CD2-CD1 3.98Å; L1054-L1115 HydrophobicContact CD2-CD2 3.93Å; V1057-L1115 HydrophobicContact CG1-CD2 4.17Å; Q1058-L1115 HydrophobicContact CG-CD2 4.33Å; I1113-L1115 HydrophobicContact CG2-CD2 4.43Å; I1113-L1115 HydrophobicContact CG2-CG 4.33Å; L1115-V1122 HydrophobicContact CB-CG2 4.23Å; L1115-V1122 HydrophobicContact CD1-CG2 4.36Å; L1115-V1122 HydrophobicContact CD2-CG2 4.49Å; L1115-F1149 HydrophobicContact CD1-CB 4.22Å; L1115-F1149 HydrophobicContact CD1-CD1 3.61Å; L1115-F1149 HydrophobicContact CD1-CE1 4.31Å; L1115-F1149 HydrophobicContact CD1-CG 4.14Å; L1115-W1150 PolarHBondContact N-O 2.79Å; L1115-I1151 HydrophobicContact CB-CG1 4.09Å; L1115-I1151 CarbonylContact O-C 3.47Å; L1115-I1151 WeakPolarHBondContact O-CA 3.37Å; L1115-I1152 PolarHBondContact O-N 3.05Å
1116	P	95.9	Very high	90.4	Very high	3 Å²	3	32.2 Å²	32.2	2%	0.019	16%	0.163	C	C	.	.			trans	-73.1	153.1	174.2	33	-36.9	0	0	0	111	V1057 H1061 F1062 N1118 D1119 V1122	V1057-P1116 HydrophobicContact CG1-CG 3.66Å; H1061-P1116 HydrophobicContact CB-CB 4.04Å; H1061-P1116 HydrophobicContact CB-CG 3.99Å; F1062-P1116 HydrophobicContact CZ-CB 4.06Å; P1116-N1118 VanDerWaalsContact C-N 3.31Å; P1116-N1118 PolarHBondContact O-N 3.26Å; P1116-D1119 HydrophobicContact CG-CB 4.06Å; P1116-V1122 HydrophobicContact CG-CG2 4.36Å
1117	N	92.9	Very high	91.3	Very high	34 Å²	34	31 Å²	31	18%	0.182	15%	0.149	C	C	.	.	S	Bend	trans	-70.2	-26.3	171	49.2	-12.6	0	0	0	113.9	I1151 I1152 K1153 A1157 R1160	N1117-I1151 HydrophobicContact CB-CG2 4.36Å; N1117-I1152 WeakPolarHBondContact CB-O 3.45Å; N1117-I1152 PolarHBondContact N-O 3.02Å; N1117-K1153 HydrophobicContact CB-CB 4.34Å; N1117-A1157 HydrophobicContact CB-CB 4.01Å; N1117-R1160 PolarHBondContact O-NH2 3.49Å
1118	N	90.2	Very high	91.9	Very high	98 Å²	98	27.9 Å²	27.9	52%	0.524	14%	0.138	S	C	.	.	S	Bend	trans	-118.1	68.7	-164.6	-160.4	54.1	0	0	0	112.3	H1061 P1116 R1160	H1061-N1118 PolarHBondContact CE1-O 3.2Å; P1116-N1118 VanDerWaalsContact C-N 3.31Å; P1116-N1118 PolarHBondContact O-N 3.26Å; N1118-R1160 PolarHBondContact OD1-NH1 3Å; N1118-R1160 PolarHBondContact OD1-NH2 2.83Å
1119	D	94.3	Very high	92.5	Very high	14 Å²	14	25.8 Å²	25.8	8%	0.075	13%	0.13	C	C	.	.			trans	-138.8	148.1	171.6	-169.1	-80.4	0	0	0	109.6	V1057 R1060 H1061 P1116 V1121 V1122 T1123	V1057-D1119 HydrophobicContact CG1-CB 4.2Å; R1060-D1119 IonicContact NH1-OD1 3Å; R1060-D1119 IonicContact NH1-OD2 3.75Å; R1060-D1119 PolarHBondContact NH1-OD2 3.41Å; H1061-D1119 IonicContact CD2-OD2 2.71Å; H1061-D1119 IonicContact CE1-OD2 2.96Å; H1061-D1119 IonicContact NE2-OD2 2.99Å; H1061-D1119 PolarHBondContact NE2-OD2 3.34Å; P1116-D1119 HydrophobicContact CG-CB 4.06Å; D1119-V1121 WeakPolarHBondContact OD1-CB 3.16Å; D1119-V1121 PolarHBondContact OD1-N 3.13Å; D1119-V1122 HydrophobicContact CB-CB 4.32Å; D1119-V1122 HydrophobicContact CB-CG2 3.98Å; D1119-V1122 PolarHBondContact O-N 2.85Å; D1119-T1123 PolarHBondContact O-N 3.14Å; D1119-T1123 PolarHBondContact O-OG1 2.98Å
1120	H	92.8	Very high	93.4	Very high	63 Å²	63	24.9 Å²	24.9	29%	0.292	12%	0.122	S	C	.	.	H	α-helix	trans	-66	-39	-178.4	-172.5	75.9	0	0	0	111.7	P1006 E1007 F1009 V1122 T1123 L1124	P1006-H1120 PolarHBondContact O-CD2 3.08Å; P1006-H1120 PolarHBondContact O-NE2 3.29Å; P1006-H1120 VanDerWaalsContact O-NE2 3.1Å; E1007-H1120 WeakPolarHBondContact CA-NE2 3.46Å; F1009-H1120 PolarHBondContact O-NE2 3.45Å; H1120-V1122 PolarHBondContact O-N 3.2Å; H1120-T1123 WeakPolarHBondContact O-CB 3.4Å; H1120-T1123 PolarHBondContact O-N 3.04Å; H1120-T1123 VanDerWaalsContact O-N 3.14Å; H1120-L1124 WeakPolarHBondContact O-CG 3.46Å; H1120-L1124 PolarHBondContact O-N 3.42Å
1121	V	94.7	Very high	94	Very high	1 Å²	1	26.1 Å²	26.1	1%	0.006	13%	0.128	C	C	.	.	H	α-helix	trans	-64.5	-42.4	178	-179.8	0	0	0	0	110.4	P1006 F1012 L1015 W1053 V1057 D1119 T1123 L1124 L1125	P1006-V1121 HydrophobicContact CB-CG2 3.65Å; P1006-V1121 HydrophobicContact CG-CG2 3.97Å; F1012-V1121 HydrophobicContact CE2-CG1 3.97Å; L1015-V1121 HydrophobicContact CD2-CG1 4.38Å; L1015-V1121 HydrophobicContact CD2-CG2 4.32Å; W1053-V1121 HydrophobicContact CB-CG1 4.33Å; W1053-V1121 HydrophobicContact CE3-CG2 3.86Å; W1053-V1121 HydrophobicContact CZ3-CG2 4.27Å; V1057-V1121 HydrophobicContact CG2-CB 3.79Å; V1057-V1121 HydrophobicContact CG2-CG1 4.17Å; V1057-V1121 HydrophobicContact CG2-CG2 4.04Å; D1119-V1121 WeakPolarHBondContact OD1-CB 3.16Å; D1119-V1121 PolarHBondContact OD1-N 3.13Å; V1121-T1123 VanDerWaalsContact C-N 3.27Å; V1121-T1123 PolarHBondContact O-N 2.81Å; V1121-L1124 PolarHBondContact O-N 3.15Å; V1121-L1125 WeakPolarHBondContact O-CB 3.37Å; V1121-L1125 PolarHBondContact O-N 3.49Å
1122	V	97.1	Very high	94.1	Very high	2 Å²	2	32.4 Å²	32.4	1%	0.012	15%	0.151	C	C	.	.	H	α-helix	trans	-63.9	-35.6	175.3	-179.9	0	0	0	0	111.2	V1057 L1115 P1116 D1119 H1120 L1125 L1126 I1151	V1057-V1122 HydrophobicContact CG1-CG2 4.1Å; L1115-V1122 HydrophobicContact CB-CG2 4.23Å; L1115-V1122 HydrophobicContact CD1-CG2 4.36Å; L1115-V1122 HydrophobicContact CD2-CG2 4.49Å; P1116-V1122 HydrophobicContact CG-CG2 4.36Å; D1119-V1122 HydrophobicContact CB-CB 4.32Å; D1119-V1122 HydrophobicContact CB-CG2 3.98Å; D1119-V1122 PolarHBondContact O-N 2.85Å; H1120-V1122 PolarHBondContact O-N 3.2Å; V1122-L1125 PolarHBondContact O-N 2.98Å; V1122-L1126 HydrophobicContact CG1-CD1 4.37Å; V1122-L1126 WeakPolarHBondContact O-CB 3.44Å; V1122-L1126 WeakPolarHBondContact O-CG 3.43Å; V1122-L1126 PolarHBondContact O-N 3.49Å; V1122-I1151 HydrophobicContact CG1-CD1 3.89Å; V1122-I1151 HydrophobicContact CG1-CG1 4.29Å; V1122-I1151 HydrophobicContact CG1-CG2 4.22Å
1123	T	96.5	Very high	93.9	Very high	43 Å²	43	36.6 Å²	36.6	26%	0.264	17%	0.168	S	C	.	.	H	α-helix	trans	-66.4	-42.6	175.5	-57.6	0	0	0	0	111.4	D1119 H1120 V1121 R1127 V1161	D1119-T1123 PolarHBondContact O-N 3.14Å; D1119-T1123 PolarHBondContact O-OG1 2.98Å; H1120-T1123 WeakPolarHBondContact O-CB 3.4Å; H1120-T1123 PolarHBondContact O-N 3.04Å; H1120-T1123 VanDerWaalsContact O-N 3.14Å; V1121-T1123 VanDerWaalsContact C-N 3.27Å; V1121-T1123 PolarHBondContact O-N 2.81Å; T1123-R1127 VanDerWaalsContact O-CB 3.29Å; T1123-R1127 WeakPolarHBondContact O-CB 3.29Å; T1123-R1127 PolarHBondContact O-N 3.38Å; T1123-V1161 HydrophobicContact CG2-CG2 4.07Å
1124	L	96	Very high	93.6	Very high	7 Å²	7	44 Å²	44	4%	0.037	21%	0.207	C	C	.	.	H	α-helix	trans	-62.7	-44.9	174.1	-69.7	179.2	0	0	0	111.6	F1009 A1010 F1012 L1015 H1120 V1121 R1127 D1128	F1009-L1124 HydrophobicContact CB-CD1 4.22Å; F1009-L1124 WeakPolarHBondContact O-CD2 3.32Å; A1010-L1124 WeakPolarHBondContact O-CD2 3.32Å; F1012-L1124 HydrophobicContact CB-CB 4.07Å; F1012-L1124 HydrophobicContact CD2-CB 4.11Å; L1015-L1124 HydrophobicContact CD2-CD1 4.18Å; H1120-L1124 WeakPolarHBondContact O-CG 3.46Å; H1120-L1124 PolarHBondContact O-N 3.42Å; V1121-L1124 PolarHBondContact O-N 3.15Å; L1124-R1127 PolarHBondContact O-N 3.24Å; L1124-D1128 WeakPolarHBondContact O-CB 3.07Å; L1124-D1128 PolarHBondContact O-N 2.82Å
1125	L	96.1	Very high	93.3	Very high	4 Å²	4	46.5 Å²	46.5	2%	0.021	22%	0.219	C	C	.	.	H	α-helix	trans	-60.1	-49.3	177.6	-178.9	155.2	0	0	0	111.7	F1012 L1054 V1121 V1122 R1127 D1128 L1129 F1149	F1012-L1125 HydrophobicContact CD2-CB 3.93Å; F1012-L1125 HydrophobicContact CE1-CD1 4.38Å; F1012-L1125 HydrophobicContact CE1-CG 4.45Å; F1012-L1125 HydrophobicContact CE2-CB 3.89Å; F1012-L1125 HydrophobicContact CE2-CD1 4.19Å; F1012-L1125 HydrophobicContact CE2-CG 4.42Å; F1012-L1125 HydrophobicContact CG-CB 4.31Å; F1012-L1125 HydrophobicContact CZ-CB 4.22Å; F1012-L1125 HydrophobicContact CZ-CD1 3.86Å; F1012-L1125 HydrophobicContact CZ-CG 4.26Å; L1054-L1125 HydrophobicContact CD2-CD1 4.33Å; V1121-L1125 WeakPolarHBondContact O-CB 3.37Å; V1121-L1125 PolarHBondContact O-N 3.49Å; V1122-L1125 PolarHBondContact O-N 2.98Å; L1125-R1127 VanDerWaalsContact C-N 3.3Å; L1125-R1127 PolarHBondContact O-N 2.94Å; L1125-D1128 PolarHBondContact O-N 2.94Å; L1125-L1129 HydrophobicContact CD2-CD1 3.7Å; L1125-L1129 HydrophobicContact CD2-CG 4.4Å; L1125-L1129 PolarHBondContact O-N 2.86Å; L1125-F1149 HydrophobicContact CD1-CD1 4.49Å; L1125-F1149 HydrophobicContact CD1-CD2 4.48Å; L1125-F1149 HydrophobicContact CD1-CE1 3.97Å; L1125-F1149 HydrophobicContact CD1-CE2 3.95Å; L1125-F1149 HydrophobicContact CD1-CZ 3.68Å; L1125-F1149 HydrophobicContact CD2-CD2 3.99Å; L1125-F1149 HydrophobicContact CD2-CE2 3.96Å; L1125-F1149 HydrophobicContact CG-CE2 4.35Å
1126	L	97	Very high	92.6	Very high	1 Å²	1	47.2 Å²	47.2	1%	0.005	22%	0.224	C	C	.	.	H	α-helix	trans	-64.8	-34.5	177.7	-79.2	-179.5	0	0	0	112.5	V1122 H1130 A1145 I1151 A1157 V1158 V1161	V1122-L1126 HydrophobicContact CG1-CD1 4.37Å; V1122-L1126 WeakPolarHBondContact O-CB 3.44Å; V1122-L1126 WeakPolarHBondContact O-CG 3.43Å; V1122-L1126 PolarHBondContact O-N 3.49Å; L1126-H1130 VanDerWaalsContact O-CB 3.28Å; L1126-H1130 WeakPolarHBondContact O-CB 3.5Å; L1126-H1130 PolarHBondContact O-N 2.99Å; L1126-A1145 HydrophobicContact CD2-CB 3.98Å; L1126-I1151 HydrophobicContact CD1-CD1 3.83Å; L1126-I1151 HydrophobicContact CD2-CD1 3.56Å; L1126-I1151 HydrophobicContact CG-CD1 3.73Å; L1126-A1157 HydrophobicContact CD1-CB 3.58Å; L1126-V1158 HydrophobicContact CD1-CG2 4.13Å; L1126-V1158 HydrophobicContact CD2-CG2 3.88Å; L1126-V1161 HydrophobicContact CB-CG2 3.87Å; L1126-V1161 HydrophobicContact CD1-CG2 4.45Å
1127	R	94.3	Very high	92.2	Very high	106 Å²	106	51.5 Å²	51.5	40%	0.4	25%	0.252	S	S	.	.	H	α-helix	trans	-65.5	-45.1	174.2	-178.2	177.8	179.7	166.3	1.3	111.3	T1123 L1124 L1125 H1130 E1131 V1161	T1123-R1127 VanDerWaalsContact O-CB 3.29Å; T1123-R1127 WeakPolarHBondContact O-CB 3.29Å; T1123-R1127 PolarHBondContact O-N 3.38Å; L1124-R1127 PolarHBondContact O-N 3.24Å; L1125-R1127 VanDerWaalsContact C-N 3.3Å; L1125-R1127 PolarHBondContact O-N 2.94Å; R1127-H1130 PolarHBondContact O-N 2.95Å; R1127-E1131 HydrophobicContact CG-CG 4.46Å; R1127-E1131 WeakPolarHBondContact CG-OE1 3.35Å; R1127-E1131 IonicContact CZ-OE1 3.07Å; R1127-E1131 IonicContact NE-OE1 3.01Å; R1127-E1131 PolarHBondContact NE-OE1 2.87Å; R1127-E1131 IonicContact NH2-OE1 3.67Å; R1127-E1131 PolarHBondContact NH2-OE1 2.86Å; R1127-E1131 WeakPolarHBondContact O-CB 3.45Å; R1127-E1131 WeakPolarHBondContact O-CG 3.34Å; R1127-E1131 PolarHBondContact O-N 2.91Å; R1127-V1161 HydrophobicContact CB-CG1 3.96Å; R1127-V1161 HydrophobicContact CG-CG1 4.48Å
1128	D	94.7	Very high	92	Very high	25 Å²	25	51.1 Å²	51.1	13%	0.134	25%	0.251	C	S	.	.	H	α-helix	trans	-61.5	-46	176.8	-171.3	85.1	0	0	0	111.3	F1012 L1124 L1125 H1130 E1131 R1132	F1012-D1128 HydrophobicContact CB-CB 3.75Å; L1124-D1128 WeakPolarHBondContact O-CB 3.07Å; L1124-D1128 PolarHBondContact O-N 2.82Å; L1125-D1128 PolarHBondContact O-N 2.94Å; D1128-H1130 PolarHBondContact O-N 3Å; D1128-E1131 PolarHBondContact O-N 3.26Å; D1128-R1132 WeakPolarHBondContact O-CB 3.12Å; D1128-R1132 WeakPolarHBondContact O-CG 3.34Å; D1128-R1132 PolarHBondContact O-N 3.48Å; D1128-R1132 IonicContact OD1-NE 3.19Å; D1128-R1132 IonicContact OD1-NH2 2.9Å; D1128-R1132 IonicContact OD2-CZ 3.44Å; D1128-R1132 VanDerWaalsContact OD2-CZ 3.26Å; D1128-R1132 IonicContact OD2-NE 2.83Å; D1128-R1132 PolarHBondContact OD2-NE 2.95Å; D1128-R1132 IonicContact OD2-NH2 2.75Å; D1128-R1132 PolarHBondContact OD2-NH2 2.83Å; D1128-R1132 VanDerWaalsContact OD2-NH2 3.12Å
1129	L	93.1	Very high	92	Very high	37 Å²	37	50.6 Å²	50.6	19%	0.194	25%	0.246	C	C	.	.	H	α-helix	trans	-59.5	-42.9	173.5	-74.5	175.6	0	0	0	112.8	L1125 K1133 A1145	L1125-L1129 HydrophobicContact CD2-CD1 3.7Å; L1125-L1129 HydrophobicContact CD2-CG 4.4Å; L1125-L1129 PolarHBondContact O-N 2.86Å; L1129-K1133 WeakPolarHBondContact O-CB 3.4Å; L1129-K1133 WeakPolarHBondContact O-CG 3.45Å; L1129-K1133 PolarHBondContact O-N 3.2Å; L1129-A1145 HydrophobicContact CD1-CB 3.96Å
1130	H	95.1	Very high	91.6	Very high	1 Å²	1	52.1 Å²	52.1	1%	0.005	26%	0.26	C	S	.	.	H	α-helix	trans	-64	-43	177.5	171.6	70.2	0	0	0	112.3	L1126 R1127 D1128 K1133 L1134 H1135 A1136 T1141 L1162 C1168	L1126-H1130 VanDerWaalsContact O-CB 3.28Å; L1126-H1130 WeakPolarHBondContact O-CB 3.5Å; L1126-H1130 PolarHBondContact O-N 2.99Å; R1127-H1130 PolarHBondContact O-N 2.95Å; D1128-H1130 PolarHBondContact O-N 3Å; H1130-K1133 CarbonylContact O-C 3.59Å; H1130-K1133 PolarHBondContact O-N 2.9Å; H1130-L1134 PolarHBondContact O-N 2.94Å; H1130-H1135 AromaticContact CD2-ND1 3.59Å; H1130-H1135 WeakPolarHBondContact CE1-CA 3.48Å; H1130-H1135 AromaticContact CE1-ND1 3.84Å; H1130-H1135 AromaticContact NE2-CG 3.79Å; H1130-H1135 AromaticContact NE2-ND1 3Å; H1130-H1135 PolarHBondContact NE2-ND1 2.96Å; H1130-H1135 WeakPolarHBondContact O-CA 3.44Å; H1130-H1135 PolarHBondContact O-N 3.43Å; H1130-A1136 PolarHBondContact CE1-O 2.66Å; H1130-A1136 PolarHBondContact ND1-O 3.2Å; H1130-T1141 HydrophobicContact CB-CG2 3.96Å; H1130-L1162 WeakPolarHBondContact ND1-CD1 3.38Å; H1130-C1168 VanDerWaalsContact CE1-SG 3.51Å; H1130-C1168 PolarHBondContact NE2-SG 3.27Å
1131	E	91.2	Very high	91.5	Very high	63 Å²	63	49.2 Å²	49.2	29%	0.294	25%	0.247	S	C	.	.	H	α-helix	trans	-68.3	-42.2	177.7	-71.8	175.5	-173.5	0	0	111.2	R1127 D1128 K1133 L1134	R1127-E1131 HydrophobicContact CG-CG 4.46Å; R1127-E1131 WeakPolarHBondContact CG-OE1 3.35Å; R1127-E1131 IonicContact CZ-OE1 3.07Å; R1127-E1131 IonicContact NE-OE1 3.01Å; R1127-E1131 PolarHBondContact NE-OE1 2.87Å; R1127-E1131 IonicContact NH2-OE1 3.67Å; R1127-E1131 PolarHBondContact NH2-OE1 2.86Å; R1127-E1131 WeakPolarHBondContact O-CB 3.45Å; R1127-E1131 WeakPolarHBondContact O-CG 3.34Å; R1127-E1131 PolarHBondContact O-N 2.91Å; D1128-E1131 PolarHBondContact O-N 3.26Å; E1131-K1133 VanDerWaalsContact C-N 3.31Å; E1131-K1133 PolarHBondContact O-N 3.41Å; E1131-L1134 PolarHBondContact O-N 2.89Å
1132	R	88.2	Confident	91.4	Very high	152 Å²	152	49.6 Å²	49.6	57%	0.574	25%	0.249	S	C	*	.	H	α-helix	trans	-64.3	-31.3	174.9	-71.5	-173.3	-162.1	-146.2	-0.1	113.4	E1013 D1128 L1134	E1013-R1132 IonicContact OE2-NH2 3.31Å; E1013-R1132 PolarHBondContact OE2-NH2 3.41Å; D1128-R1132 WeakPolarHBondContact O-CB 3.12Å; D1128-R1132 WeakPolarHBondContact O-CG 3.34Å; D1128-R1132 PolarHBondContact O-N 3.48Å; D1128-R1132 IonicContact OD1-NE 3.19Å; D1128-R1132 IonicContact OD1-NH2 2.9Å; D1128-R1132 IonicContact OD2-CZ 3.44Å; D1128-R1132 VanDerWaalsContact OD2-CZ 3.26Å; D1128-R1132 IonicContact OD2-NE 2.83Å; D1128-R1132 PolarHBondContact OD2-NE 2.95Å; D1128-R1132 IonicContact OD2-NH2 2.75Å; D1128-R1132 PolarHBondContact OD2-NH2 2.83Å; D1128-R1132 VanDerWaalsContact OD2-NH2 3.12Å; R1132-L1134 PolarHBondContact O-N 3.38Å
1133	K	85.7	Confident	90.9	Very high	113 Å²	113	52.2 Å²	52.2	49%	0.491	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	23.9	172.9	-63.2	-66.5	-176.6	-179.9	0	112.5	L1129 H1130 E1131 H1135 A1136 A1144	L1129-K1133 WeakPolarHBondContact O-CB 3.4Å; L1129-K1133 WeakPolarHBondContact O-CG 3.45Å; L1129-K1133 PolarHBondContact O-N 3.2Å; H1130-K1133 CarbonylContact O-C 3.59Å; H1130-K1133 PolarHBondContact O-N 2.9Å; E1131-K1133 VanDerWaalsContact C-N 3.31Å; E1131-K1133 PolarHBondContact O-N 3.41Å; K1133-H1135 PolarHBondContact O-N 2.94Å; K1133-A1136 HydrophobicContact CB-CB 3.78Å; K1133-A1136 WeakPolarHBondContact O-CB 3.29Å; K1133-A1136 PolarHBondContact O-N 3.25Å; K1133-A1136 VanDerWaalsContact O-N 3.17Å; K1133-A1144 HydrophobicContact CG-CB 4.19Å
1134	L	88.9	Confident	90.5	Very high	156 Å²	156	50.9 Å²	50.9	82%	0.817	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.8	48.8	174.3	-57.7	177.4	0	0	0	113.7	H1130 E1131 R1132 A1136	H1130-L1134 PolarHBondContact O-N 2.94Å; E1131-L1134 PolarHBondContact O-N 2.89Å; R1132-L1134 PolarHBondContact O-N 3.38Å; L1134-A1136 VanDerWaalsContact C-N 3.33Å; L1134-A1136 PolarHBondContact O-N 2.68Å
1135	H	88.2	Confident	90.3	Very high	54 Å²	54	50.6 Å²	50.6	25%	0.25	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	62.2	35.8	-178.9	-62.1	-75.8	0	0	0	114.7	H1130 K1133 C1165 I1167	H1130-H1135 AromaticContact CD2-ND1 3.59Å; H1130-H1135 WeakPolarHBondContact CE1-CA 3.48Å; H1130-H1135 AromaticContact CE1-ND1 3.84Å; H1130-H1135 AromaticContact NE2-CG 3.79Å; H1130-H1135 AromaticContact NE2-ND1 3Å; H1130-H1135 PolarHBondContact NE2-ND1 2.96Å; H1130-H1135 WeakPolarHBondContact O-CA 3.44Å; H1130-H1135 PolarHBondContact O-N 3.43Å; K1133-H1135 PolarHBondContact O-N 2.94Å; H1135-C1165 PolarHBondContact CE1-SG 3.29Å; H1135-C1165 PolarHBondContact ND1-SG 2.96Å; H1135-C1165 VanDerWaalsContact ND1-SG 3.4Å; H1135-I1167 WeakPolarHBondContact NE2-CD1 3.32Å
1136	A	82.1	Confident	89.9	Confident	14 Å²	14	54.6 Å²	54.6	12%	0.116	28%	0.278	C	S	.	.			trans	-50.9	148.3	177.8	0	0	0	0	0	113.5	H1130 K1133 L1134 A1140 T1141	H1130-A1136 PolarHBondContact CE1-O 2.66Å; H1130-A1136 PolarHBondContact ND1-O 3.2Å; K1133-A1136 HydrophobicContact CB-CB 3.78Å; K1133-A1136 WeakPolarHBondContact O-CB 3.29Å; K1133-A1136 PolarHBondContact O-N 3.25Å; K1133-A1136 VanDerWaalsContact O-N 3.17Å; L1134-A1136 VanDerWaalsContact C-N 3.33Å; L1134-A1136 PolarHBondContact O-N 2.68Å; A1136-A1140 HydrophobicContact CB-CB 3.93Å; A1136-T1141 PolarHBondContact O-OG1 3.45Å; A1136-T1141 VanDerWaalsContact O-OG1 3.04Å
1137	P	87.1	Confident	89.4	Confident	94 Å²	94	60.7 Å²	60.7	61%	0.61	31%	0.306	S	S	*	.			trans	-66	167.4	176.5	26.7	-33.7	0	0	0	112.1	E1139 A1140 T1141	P1137-E1139 VanDerWaalsContact C-N 3.31Å; P1137-E1139 PolarHBondContact O-N 3.15Å; P1137-E1139 VanDerWaalsContact O-N 3.14Å; P1137-A1140 HydrophobicContact CG-CB 4.2Å; P1137-A1140 PolarHBondContact O-N 3.2Å; P1137-A1140 VanDerWaalsContact O-N 3.1Å; P1137-T1141 PolarHBondContact O-N 2.92Å; P1137-T1141 PolarHBondContact O-OG1 2.9Å
1138	T	89.8	Confident	89.1	Confident	26 Å²	26	57.7 Å²	57.7	16%	0.16	30%	0.296	C	S	.	.	H	α-helix	trans	-49.9	-46.6	-170.3	-60.6	0	0	0	0	113.5	L1142 R1155 V1158 K1159	T1138-L1142 VanDerWaalsContact O-CB 3.26Å; T1138-L1142 WeakPolarHBondContact O-CB 3.1Å; T1138-L1142 PolarHBondContact O-N 3.05Å; T1138-R1155 HydrophobicContact CG2-CG 3.94Å; T1138-V1158 HydrophobicContact CG2-CB 4.36Å; T1138-V1158 HydrophobicContact CG2-CG1 3.95Å; T1138-K1159 HydrophobicContact CG2-CG 3.72Å
1139	E	89.7	Confident	89.1	Confident	86 Å²	86	57 Å²	57	40%	0.402	29%	0.292	S	S	.	.	H	α-helix	trans	-71	-39.4	-176.2	-56.5	-46.4	129.4	0	0	112.4	P1137 L1142 A1143 R1155	P1137-E1139 VanDerWaalsContact C-N 3.31Å; P1137-E1139 PolarHBondContact O-N 3.15Å; P1137-E1139 VanDerWaalsContact O-N 3.14Å; E1139-L1142 PolarHBondContact O-N 3.37Å; E1139-A1143 WeakPolarHBondContact O-CB 3.12Å; E1139-A1143 PolarHBondContact O-N 2.98Å; E1139-R1155 IonicContact OE1-CZ 3.2Å; E1139-R1155 IonicContact OE1-NE 2.83Å; E1139-R1155 PolarHBondContact OE1-NE 3.31Å; E1139-R1155 IonicContact OE1-NH2 3.66Å; E1139-R1155 PolarHBondContact OE1-NH2 3.12Å; E1139-R1155 IonicContact OE2-CZ 2.65Å; E1139-R1155 IonicContact OE2-NE 3.6Å; E1139-R1155 IonicContact OE2-NH2 3.4Å
1140	A	85.6	Confident	89.1	Confident	47 Å²	47	58.6 Å²	58.6	39%	0.388	30%	0.295	S	S	.	.	H	α-helix	trans	-68.3	-40.7	178	0	0	0	0	0	111.7	A1136 P1137 L1142 A1143 A1144	A1136-A1140 HydrophobicContact CB-CB 3.93Å; P1137-A1140 HydrophobicContact CG-CB 4.2Å; P1137-A1140 PolarHBondContact O-N 3.2Å; P1137-A1140 VanDerWaalsContact O-N 3.1Å; A1140-L1142 VanDerWaalsContact C-N 3.34Å; A1140-A1143 PolarHBondContact O-N 2.91Å; A1140-A1144 PolarHBondContact O-N 3.39Å
1141	T	90.7	Very high	89.1	Confident	1 Å²	1	59.1 Å²	59.1	1%	0.006	30%	0.298	C	S	.	.	H	α-helix	trans	-64.4	-39.4	172.2	-53.6	0	0	0	0	111.6	H1130 A1136 P1137 A1144 A1145 V1158	H1130-T1141 HydrophobicContact CB-CG2 3.96Å; A1136-T1141 PolarHBondContact O-OG1 3.45Å; A1136-T1141 VanDerWaalsContact O-OG1 3.04Å; P1137-T1141 PolarHBondContact O-N 2.92Å; P1137-T1141 PolarHBondContact O-OG1 2.9Å; T1141-A1144 PolarHBondContact O-N 2.94Å; T1141-A1145 PolarHBondContact O-N 3.25Å; T1141-V1158 HydrophobicContact CG2-CG1 3.87Å; T1141-V1158 HydrophobicContact CG2-CG2 4.3Å
1142	L	92	Very high	89.1	Confident	10 Å²	10	57 Å²	57	5%	0.052	29%	0.288	C	S	.	.	H	α-helix	trans	-66.7	-40.7	177	-177.8	63.4	0	0	0	112.1	T1138 E1139 A1140 A1145 R1146 R1155 V1158	T1138-L1142 VanDerWaalsContact O-CB 3.26Å; T1138-L1142 WeakPolarHBondContact O-CB 3.1Å; T1138-L1142 PolarHBondContact O-N 3.05Å; E1139-L1142 PolarHBondContact O-N 3.37Å; A1140-L1142 VanDerWaalsContact C-N 3.34Å; L1142-A1145 PolarHBondContact O-N 2.77Å; L1142-R1146 WeakPolarHBondContact O-CG 3.37Å; L1142-R1146 PolarHBondContact O-N 3.08Å; L1142-R1155 HydrophobicContact CD2-CB 3.92Å; L1142-R1155 HydrophobicContact CD2-CG 4.26Å; L1142-V1158 HydrophobicContact CB-CG2 4.37Å; L1142-V1158 HydrophobicContact CD1-CG2 4.32Å
1143	A	88	Confident	89.2	Confident	57 Å²	57	57 Å²	57	47%	0.471	29%	0.293	S	S	.	.	H	α-helix	trans	-62.7	-44	176	0	0	0	0	0	111.4	E1139 A1140 A1145 R1146 Q1147	E1139-A1143 WeakPolarHBondContact O-CB 3.12Å; E1139-A1143 PolarHBondContact O-N 2.98Å; A1140-A1143 PolarHBondContact O-N 2.91Å; A1143-A1145 VanDerWaalsContact C-N 3.35Å; A1143-A1145 PolarHBondContact O-N 2.92Å; A1143-R1146 PolarHBondContact O-N 3.48Å; A1143-Q1147 PolarHBondContact O-N 2.91Å
1144	A	87.4	Confident	89.5	Confident	14 Å²	14	52 Å²	52	12%	0.116	27%	0.273	C	S	.	.	H	α-helix	trans	-61.2	-41.7	174.1	0	0	0	0	0	112.2	K1133 A1140 T1141 R1146 Q1147	K1133-A1144 HydrophobicContact CG-CB 4.19Å; A1140-A1144 PolarHBondContact O-N 3.39Å; T1141-A1144 PolarHBondContact O-N 2.94Å; A1144-R1146 VanDerWaalsContact C-N 3.34Å; A1144-R1146 PolarHBondContact O-N 2.97Å; A1144-Q1147 PolarHBondContact O-N 2.71Å
1145	A	90.5	Very high	89.7	Confident	1 Å²	1	50.9 Å²	50.9	1%	0.008	26%	0.258	C	S	.	.	H	α-helix	trans	-62.8	-40.2	175.5	0	0	0	0	0	112.2	L1126 L1129 T1141 L1142 A1143 Q1147 K1148 F1149	L1126-A1145 HydrophobicContact CD2-CB 3.98Å; L1129-A1145 HydrophobicContact CD1-CB 3.96Å; T1141-A1145 PolarHBondContact O-N 3.25Å; L1142-A1145 PolarHBondContact O-N 2.77Å; A1143-A1145 VanDerWaalsContact C-N 3.35Å; A1143-A1145 PolarHBondContact O-N 2.92Å; A1145-Q1147 PolarHBondContact O-N 2.98Å; A1145-K1148 PolarHBondContact O-N 2.8Å; A1145-F1149 WeakPolarHBondContact O-CA 3.36Å; A1145-F1149 PolarHBondContact O-N 3.48Å
1146	R	89.6	Confident	90	Very high	89 Å²	89	50.8 Å²	50.8	34%	0.336	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-8.5	-179.6	-79.6	178.3	170	166.6	-3.7	115.2	Q1112 L1142 A1143 A1144 K1148 F1149	Q1112-R1146 WeakPolarHBondContact CG-O 3.36Å; Q1112-R1146 PolarHBondContact NE2-O 3.21Å; Q1112-R1146 PolarHBondContact OE1-O 3.27Å; Q1112-R1146 VanDerWaalsContact OE1-O 3.1Å; L1142-R1146 WeakPolarHBondContact O-CG 3.37Å; L1142-R1146 PolarHBondContact O-N 3.08Å; A1143-R1146 PolarHBondContact O-N 3.48Å; A1144-R1146 VanDerWaalsContact C-N 3.34Å; A1144-R1146 PolarHBondContact O-N 2.97Å; R1146-K1148 PolarHBondContact O-N 3.49Å; R1146-F1149 WeakPolarHBondContact CA-O 3.39Å
1147	Q	85.4	Confident	90.7	Very high	129 Å²	129	50.2 Å²	50.2	60%	0.603	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-26.9	171.9	-68.3	-177.5	-26.8	0	0	112.2	A1109 A1143 A1144 A1145	A1109-Q1147 WeakPolarHBondContact CA-O 3.41Å; A1143-Q1147 PolarHBondContact O-N 2.91Å; A1144-Q1147 PolarHBondContact O-N 2.71Å; A1145-Q1147 PolarHBondContact O-N 2.98Å
1148	K	88.6	Confident	91.1	Very high	42 Å²	42	45.8 Å²	45.8	18%	0.183	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-132.5	-27	-176.5	-172	174.8	-177.2	-169	0	113.8	E1050 E1108 I1113 A1145 R1146	E1050-K1148 IonicContact OE1-NZ 3.32Å; E1050-K1148 PolarHBondContact OE1-NZ 3.12Å; E1050-K1148 IonicContact OE2-NZ 3.68Å; E1108-K1148 VanDerWaalsContact OE1-CE 3.27Å; E1108-K1148 WeakPolarHBondContact OE1-CE 3.32Å; E1108-K1148 WeakPolarHBondContact OE2-CD 3.26Å; I1113-K1148 HydrophobicContact CD1-CG 4.31Å; I1113-K1148 PolarHBondContact N-O 2.97Å; A1145-K1148 PolarHBondContact O-N 2.8Å; R1146-K1148 PolarHBondContact O-N 3.49Å
1149	F	93.5	Very high	91.4	Very high	12 Å²	12	49.9 Å²	49.9	5%	0.053	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	132.8	-169.6	-51.2	-74.3	0	0	0	112.9	L1054 I1113 L1115 L1125 A1145 R1146 I1151	L1054-F1149 HydrophobicContact CD1-CE1 4.01Å; L1054-F1149 HydrophobicContact CD2-CE1 4.33Å; I1113-F1149 HydrophobicContact CB-CD1 4.04Å; I1113-F1149 HydrophobicContact CD1-CD1 4.27Å; I1113-F1149 HydrophobicContact CD1-CE1 4Å; I1113-F1149 WeakPolarHBondContact O-CA 3.46Å; L1115-F1149 HydrophobicContact CD1-CB 4.22Å; L1115-F1149 HydrophobicContact CD1-CD1 3.61Å; L1115-F1149 HydrophobicContact CD1-CE1 4.31Å; L1115-F1149 HydrophobicContact CD1-CG 4.14Å; L1125-F1149 HydrophobicContact CD1-CD1 4.49Å; L1125-F1149 HydrophobicContact CD1-CD2 4.48Å; L1125-F1149 HydrophobicContact CD1-CE1 3.97Å; L1125-F1149 HydrophobicContact CD1-CE2 3.95Å; L1125-F1149 HydrophobicContact CD1-CZ 3.68Å; L1125-F1149 HydrophobicContact CD2-CD2 3.99Å; L1125-F1149 HydrophobicContact CD2-CE2 3.96Å; L1125-F1149 HydrophobicContact CG-CE2 4.35Å; A1145-F1149 WeakPolarHBondContact O-CA 3.36Å; A1145-F1149 PolarHBondContact O-N 3.48Å; R1146-F1149 WeakPolarHBondContact CA-O 3.39Å; F1149-I1151 HydrophobicContact CB-CG1 4.36Å
1150	W	93.4	Very high	91.6	Very high	69 Å²	69	48.8 Å²	48.8	26%	0.261	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	95.8	167.2	-170.3	-88.6	0	0	0	110.4	F1084 V1096 Q1112 I1113 L1114 L1115	F1084-W1150 HydrophobicContact CD1-CZ2 4.37Å; F1084-W1150 AromaticContact CD1-NE1 3.49Å; F1084-W1150 AromaticContact CE1-CE2 3.7Å; F1084-W1150 AromaticContact CE1-CZ2 3.86Å; F1084-W1150 HydrophobicContact CE1-CZ2 3.86Å; F1084-W1150 AromaticContact CE1-NE1 3.07Å; F1084-W1150 AromaticContact CZ-NE1 3.39Å; V1096-W1150 HydrophobicContact CG2-CB 3.58Å; V1096-W1150 HydrophobicContact CG2-CD2 4.47Å; V1096-W1150 HydrophobicContact CG2-CG 3.77Å; Q1112-W1150 HydrophobicContact CB-CB 3.93Å; I1113-W1150 PolarHBondContact O-N 2.76Å; L1114-W1150 WeakPolarHBondContact CA-O 3.43Å; L1114-W1150 HydrophobicContact CD1-CB 4.45Å; L1114-W1150 HydrophobicContact CD1-CG 4.4Å; L1115-W1150 PolarHBondContact N-O 2.79Å
1151	I	94.6	Very high	92.1	Very high	13 Å²	13	47 Å²	47	7%	0.067	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	121.4	178.9	-57.3	169	0	0	0	109.2	L1115 N1117 V1122 L1126 F1149 K1153 G1154 A1157	L1115-I1151 HydrophobicContact CB-CG1 4.09Å; L1115-I1151 CarbonylContact O-C 3.47Å; L1115-I1151 WeakPolarHBondContact O-CA 3.37Å; N1117-I1151 HydrophobicContact CB-CG2 4.36Å; V1122-I1151 HydrophobicContact CG1-CD1 3.89Å; V1122-I1151 HydrophobicContact CG1-CG1 4.29Å; V1122-I1151 HydrophobicContact CG1-CG2 4.22Å; L1126-I1151 HydrophobicContact CD1-CD1 3.83Å; L1126-I1151 HydrophobicContact CD2-CD1 3.56Å; L1126-I1151 HydrophobicContact CG-CD1 3.73Å; F1149-I1151 HydrophobicContact CB-CG1 4.36Å; I1151-K1153 PolarHBondContact O-N 3.3Å; I1151-G1154 VanDerWaalsContact O-CA 3.29Å; I1151-G1154 WeakPolarHBondContact O-CA 3.5Å; I1151-G1154 PolarHBondContact O-N 2.79Å; I1151-A1157 HydrophobicContact CG2-CB 4.28Å
1152	I	91.9	Very high	92.1	Very high	17 Å²	17	48.2 Å²	48.2	9%	0.087	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	125.5	174.9	-60.6	173	0	0	0	108.4	F1062 I1081 F1084 L1115 N1117 G1154	F1062-I1152 HydrophobicContact CE1-CD1 3.54Å; F1062-I1152 HydrophobicContact CZ-CD1 3.51Å; F1062-I1152 HydrophobicContact CZ-CG1 4.49Å; I1081-I1152 HydrophobicContact CG2-CD1 3.42Å; I1081-I1152 VanDerWaalsContact CG2-CD1 3.42Å; I1081-I1152 HydrophobicContact CG2-CG1 4.39Å; F1084-I1152 HydrophobicContact CE2-CG1 4.27Å; L1115-I1152 PolarHBondContact O-N 3.05Å; N1117-I1152 WeakPolarHBondContact CB-O 3.45Å; N1117-I1152 PolarHBondContact N-O 3.02Å; I1152-G1154 PolarHBondContact O-N 2.99Å
1153	K	91.6	Very high	92	Very high	154 Å²	154	55.9 Å²	55.9	67%	0.67	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.3	35.4	-171.9	-58.6	179.7	178.6	-176.5	0	113.1	N1117 I1151 R1155 A1156 A1157	N1117-K1153 HydrophobicContact CB-CB 4.34Å; I1151-K1153 PolarHBondContact O-N 3.3Å; K1153-R1155 VanDerWaalsContact C-N 3.29Å; K1153-R1155 PolarHBondContact O-N 2.95Å; K1153-R1155 VanDerWaalsContact O-N 3.15Å; K1153-A1156 HydrophobicContact CB-CB 4.41Å; K1153-A1156 WeakPolarHBondContact O-CB 3.42Å; K1153-A1156 PolarHBondContact O-N 2.92Å; K1153-A1157 PolarHBondContact O-N 3.01Å
1154	G	90.4	Very high	92.2	Very high	7 Å²	7	58.4 Å²	58.4	7%	0.072	27%	0.265	C	S	.	.	H	α-helix	trans	-51.3	-40.1	-174.4	0	0	0	0	0	114.8	I1151 I1152 A1156 A1157 V1158	I1151-G1154 VanDerWaalsContact O-CA 3.29Å; I1151-G1154 WeakPolarHBondContact O-CA 3.5Å; I1151-G1154 PolarHBondContact O-N 2.79Å; I1152-G1154 PolarHBondContact O-N 2.99Å; G1154-A1156 VanDerWaalsContact C-N 3.29Å; G1154-A1156 PolarHBondContact O-N 2.85Å; G1154-A1157 WeakPolarHBondContact O-CB 3.49Å; G1154-A1157 PolarHBondContact O-N 3.14Å; G1154-A1157 VanDerWaalsContact O-N 3.07Å; G1154-V1158 WeakPolarHBondContact O-CG2 3.49Å; G1154-V1158 PolarHBondContact O-N 2.77Å
1155	R	93.9	Very high	92.3	Very high	132 Å²	132	58.1 Å²	58.1	50%	0.498	26%	0.262	S	S	.	.	H	α-helix	trans	-56.9	-40.7	175.3	-165.4	177.4	-166.3	178	3.5	112.7	T1138 E1139 L1142 K1153 K1159	T1138-R1155 HydrophobicContact CG2-CG 3.94Å; E1139-R1155 IonicContact OE1-CZ 3.2Å; E1139-R1155 IonicContact OE1-NE 2.83Å; E1139-R1155 PolarHBondContact OE1-NE 3.31Å; E1139-R1155 IonicContact OE1-NH2 3.66Å; E1139-R1155 PolarHBondContact OE1-NH2 3.12Å; E1139-R1155 IonicContact OE2-CZ 2.65Å; E1139-R1155 IonicContact OE2-NE 3.6Å; E1139-R1155 IonicContact OE2-NH2 3.4Å; L1142-R1155 HydrophobicContact CD2-CB 3.92Å; L1142-R1155 HydrophobicContact CD2-CG 4.26Å; K1153-R1155 VanDerWaalsContact C-N 3.29Å; K1153-R1155 PolarHBondContact O-N 2.95Å; K1153-R1155 VanDerWaalsContact O-N 3.15Å; R1155-K1159 WeakPolarHBondContact O-CB 3.08Å; R1155-K1159 WeakPolarHBondContact O-CG 3.5Å; R1155-K1159 PolarHBondContact O-N 3.15Å
1156	A	94.9	Very high	92.1	Very high	53 Å²	53	63.6 Å²	63.6	44%	0.438	30%	0.295	S	S	.	.	H	α-helix	trans	-69.8	-37.3	177.4	0	0	0	0	0	111.7	K1153 G1154 R1160	K1153-A1156 HydrophobicContact CB-CB 4.41Å; K1153-A1156 WeakPolarHBondContact O-CB 3.42Å; K1153-A1156 PolarHBondContact O-N 2.92Å; G1154-A1156 VanDerWaalsContact C-N 3.29Å; G1154-A1156 PolarHBondContact O-N 2.85Å; A1156-R1160 WeakPolarHBondContact O-CB 3.04Å; A1156-R1160 PolarHBondContact O-N 3.15Å
1157	A	95.5	Very high	91.7	Very high	2 Å²	2	63.7 Å²	63.7	2%	0.017	30%	0.301	C	S	.	.	H	α-helix	trans	-63.9	-46.8	175.4	0	0	0	0	0	111.6	N1117 L1126 I1151 K1153 G1154 R1160 V1161	N1117-A1157 HydrophobicContact CB-CB 4.01Å; L1126-A1157 HydrophobicContact CD1-CB 3.58Å; I1151-A1157 HydrophobicContact CG2-CB 4.28Å; K1153-A1157 PolarHBondContact O-N 3.01Å; G1154-A1157 WeakPolarHBondContact O-CB 3.49Å; G1154-A1157 PolarHBondContact O-N 3.14Å; G1154-A1157 VanDerWaalsContact O-N 3.07Å; A1157-R1160 WeakPolarHBondContact O-CB 3.05Å; A1157-R1160 PolarHBondContact O-N 3.29Å; A1157-V1161 PolarHBondContact O-N 3.05Å; A1157-V1161 VanDerWaalsContact O-N 3.07Å
1158	V	96.7	Very high	91.7	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-60	-49	175.3	174.1	0	0	0	0	110.9	L1126 T1138 T1141 L1142 G1154 R1160 V1161 L1162	L1126-V1158 HydrophobicContact CD1-CG2 4.13Å; L1126-V1158 HydrophobicContact CD2-CG2 3.88Å; T1138-V1158 HydrophobicContact CG2-CB 4.36Å; T1138-V1158 HydrophobicContact CG2-CG1 3.95Å; T1141-V1158 HydrophobicContact CG2-CG1 3.87Å; T1141-V1158 HydrophobicContact CG2-CG2 4.3Å; L1142-V1158 HydrophobicContact CB-CG2 4.37Å; L1142-V1158 HydrophobicContact CD1-CG2 4.32Å; G1154-V1158 WeakPolarHBondContact O-CG2 3.49Å; G1154-V1158 PolarHBondContact O-N 2.77Å; V1158-R1160 PolarHBondContact O-N 2.84Å; V1158-V1161 PolarHBondContact O-N 3.44Å; V1158-L1162 HydrophobicContact CG1-CD1 3.75Å; V1158-L1162 WeakPolarHBondContact O-CD1 3.48Å; V1158-L1162 PolarHBondContact O-N 3.09Å
1159	K	95.2	Very high	91.3	Very high	113 Å²	113	63.2 Å²	63.2	49%	0.491	30%	0.299	S	S	.	.	H	α-helix	trans	-55	-38.6	176.3	-79.5	-173.6	174.3	-173.5	0	112.5	T1138 R1155 R1163	T1138-K1159 HydrophobicContact CG2-CG 3.72Å; R1155-K1159 WeakPolarHBondContact O-CB 3.08Å; R1155-K1159 WeakPolarHBondContact O-CG 3.5Å; R1155-K1159 PolarHBondContact O-N 3.15Å; K1159-R1163 VanDerWaalsContact O-CB 3.23Å; K1159-R1163 WeakPolarHBondContact O-CB 3.5Å; K1159-R1163 PolarHBondContact O-N 3.27Å
1160	R	94.8	Very high	90.2	Very high	62 Å²	62	69 Å²	69	23%	0.234	32%	0.324	C	S	.	.	H	α-helix	trans	-66.3	-41.8	176.6	171.5	168.8	49.3	-172.4	-1.2	112.1	N1117 N1118 A1156 A1157 V1158 N1164	N1117-R1160 PolarHBondContact O-NH2 3.49Å; N1118-R1160 PolarHBondContact OD1-NH1 3Å; N1118-R1160 PolarHBondContact OD1-NH2 2.83Å; A1156-R1160 WeakPolarHBondContact O-CB 3.04Å; A1156-R1160 PolarHBondContact O-N 3.15Å; A1157-R1160 WeakPolarHBondContact O-CB 3.05Å; A1157-R1160 PolarHBondContact O-N 3.29Å; V1158-R1160 PolarHBondContact O-N 2.84Å; R1160-N1164 WeakPolarHBondContact O-CB 3.37Å; R1160-N1164 VanDerWaalsContact O-CG 3.3Å; R1160-N1164 PolarHBondContact O-N 3.4Å; R1160-N1164 VanDerWaalsContact O-N 3.15Å; R1160-N1164 PolarHBondContact O-ND2 3.22Å
1161	V	94.6	Very high	89	Confident	10 Å²	10	71.7 Å²	71.7	6%	0.061	34%	0.342	C	S	.	.	H	α-helix	trans	-62.5	-50.1	175.2	170.9	0	0	0	0	111.1	T1123 L1126 R1127 A1157 V1158 R1163 N1164 C1165	T1123-V1161 HydrophobicContact CG2-CG2 4.07Å; L1126-V1161 HydrophobicContact CB-CG2 3.87Å; L1126-V1161 HydrophobicContact CD1-CG2 4.45Å; R1127-V1161 HydrophobicContact CB-CG1 3.96Å; R1127-V1161 HydrophobicContact CG-CG1 4.48Å; A1157-V1161 PolarHBondContact O-N 3.05Å; A1157-V1161 VanDerWaalsContact O-N 3.07Å; V1158-V1161 PolarHBondContact O-N 3.44Å; V1161-R1163 VanDerWaalsContact C-N 3.33Å; V1161-R1163 PolarHBondContact O-N 2.91Å; V1161-N1164 CarbonylContact O-C 3.54Å; V1161-N1164 PolarHBondContact O-N 3.37Å; V1161-N1164 VanDerWaalsContact O-N 3.09Å; V1161-C1165 PolarHBondContact O-N 2.92Å
1162	L	91.7	Very high	87.7	Confident	26 Å²	26	78.3 Å²	78.3	14%	0.136	37%	0.372	C	S	.	.	H	α-helix	trans	-60.8	-41.4	179.1	-89.8	63.7	0	0	0	112.1	H1130 V1158 N1164 C1165	H1130-L1162 WeakPolarHBondContact ND1-CD1 3.38Å; V1158-L1162 HydrophobicContact CG1-CD1 3.75Å; V1158-L1162 WeakPolarHBondContact O-CD1 3.48Å; V1158-L1162 PolarHBondContact O-N 3.09Å; L1162-N1164 PolarHBondContact O-N 2.79Å; L1162-C1165 WeakPolarHBondContact O-CB 3.48Å; L1162-C1165 PolarHBondContact O-N 2.9Å; L1162-C1165 VanDerWaalsContact O-N 3.11Å
1163	R	90.7	Very high	86.4	Confident	172 Å²	172	81.3 Å²	81.3	65%	0.649	40%	0.395	S	S	*	.	H	α-helix	trans	-62.3	-32.7	176.4	-177.2	176.9	62.8	-166.7	-1.1	112.7	K1159 V1161	K1159-R1163 VanDerWaalsContact O-CB 3.23Å; K1159-R1163 WeakPolarHBondContact O-CB 3.5Å; K1159-R1163 PolarHBondContact O-N 3.27Å; V1161-R1163 VanDerWaalsContact C-N 3.33Å; V1161-R1163 PolarHBondContact O-N 2.91Å
1164	N	90.3	Very high	84.2	Confident	109 Å²	109	80 Å²	80	58%	0.583	40%	0.4	S	S	*	.	H	α-helix	trans	-89.8	-5.2	177.9	-67.1	-11.8	0	0	0	112.7	R1160 V1161 L1162 V1166	R1160-N1164 WeakPolarHBondContact O-CB 3.37Å; R1160-N1164 VanDerWaalsContact O-CG 3.3Å; R1160-N1164 PolarHBondContact O-N 3.4Å; R1160-N1164 VanDerWaalsContact O-N 3.15Å; R1160-N1164 PolarHBondContact O-ND2 3.22Å; V1161-N1164 CarbonylContact O-C 3.54Å; V1161-N1164 PolarHBondContact O-N 3.37Å; V1161-N1164 VanDerWaalsContact O-N 3.09Å; L1162-N1164 PolarHBondContact O-N 2.79Å; N1164-V1166 PolarHBondContact O-N 3.07Å
1165	C	91.2	Very high	82.3	Confident	9 Å²	9	83.8 Å²	83.8	6%	0.061	43%	0.43	C	S	.	.			trans	-76.7	118.5	175.6	-176.9	0	0	0	0	110.5	H1135 V1161 L1162 I1167 C1168 K1169	H1135-C1165 PolarHBondContact CE1-SG 3.29Å; H1135-C1165 PolarHBondContact ND1-SG 2.96Å; H1135-C1165 VanDerWaalsContact ND1-SG 3.4Å; V1161-C1165 PolarHBondContact O-N 2.92Å; L1162-C1165 WeakPolarHBondContact O-CB 3.48Å; L1162-C1165 PolarHBondContact O-N 2.9Å; L1162-C1165 VanDerWaalsContact O-N 3.11Å; C1165-I1167 VanDerWaalsContact C-N 3.3Å; C1165-I1167 PolarHBondContact O-N 3.01Å; C1165-C1168 HydrophobicContact CB-CB 4.11Å; C1165-C1168 PolarHBondContact O-N 3.19Å; C1165-K1169 VanDerWaalsContact O-CB 3.28Å; C1165-K1169 WeakPolarHBondContact O-CB 3.4Å; C1165-K1169 PolarHBondContact O-N 3.33Å
1166	V	85.1	Confident	80.4	Confident	116 Å²	116	87.1 Å²	87.1	70%	0.703	44%	0.444	S	S	*	.	H	α-helix	trans	-61.1	-38.8	-177.5	179.4	0	0	0	0	111.8	N1164 K1170	N1164-V1166 PolarHBondContact O-N 3.07Å; V1166-K1170 WeakPolarHBondContact O-CB 3.48Å; V1166-K1170 PolarHBondContact O-N 2.93Å
1167	I	82.1	Confident	77.9	Confident	90 Å²	90	91.2 Å²	91.2	46%	0.462	45%	0.454	S	S	.	.	H	α-helix	trans	-67.3	-51.8	-178.7	-65.3	168.5	0	0	0	110.3	H1135 C1165 K1169 K1170 I1171	H1135-I1167 WeakPolarHBondContact NE2-CD1 3.32Å; C1165-I1167 VanDerWaalsContact C-N 3.3Å; C1165-I1167 PolarHBondContact O-N 3.01Å; I1167-K1169 VanDerWaalsContact C-N 3.32Å; I1167-K1169 PolarHBondContact O-N 2.89Å; I1167-K1170 WeakPolarHBondContact O-CB 3.47Å; I1167-K1170 PolarHBondContact O-N 2.84Å; I1167-I1171 HydrophobicContact CG2-CD1 4.1Å; I1167-I1171 WeakPolarHBondContact O-CG1 3.26Å; I1167-I1171 PolarHBondContact O-N 3.44Å; I1167-I1171 VanDerWaalsContact O-N 3.09Å
1168	C	84.6	Confident	75.7	Confident	12 Å²	12	95.6 Å²	95.6	8%	0.081	48%	0.484	C	S	.	.	H	α-helix	trans	-60.2	-42.3	176.5	-61.4	0	0	0	0	111.8	H1130 C1165 K1170 I1171 H1172	H1130-C1168 VanDerWaalsContact CE1-SG 3.51Å; H1130-C1168 PolarHBondContact NE2-SG 3.27Å; C1165-C1168 HydrophobicContact CB-CB 4.11Å; C1165-C1168 PolarHBondContact O-N 3.19Å; C1168-K1170 VanDerWaalsContact C-N 3.28Å; C1168-K1170 PolarHBondContact O-N 3.44Å; C1168-I1171 PolarHBondContact O-N 3.01Å; C1168-H1172 WeakPolarHBondContact O-CB 3.32Å; C1168-H1172 PolarHBondContact O-CD2 2.89Å; C1168-H1172 PolarHBondContact O-N 2.69Å
1169	K	80.5	Confident	73.2	Confident	149 Å²	149	104.5 Å²	104.5	65%	0.648	52%	0.523	S	S	*	.	H	α-helix	trans	-61.2	-36.9	178.5	-169.4	176.4	-178.6	-178.5	0	112.3	C1165 I1167 S1173	C1165-K1169 VanDerWaalsContact O-CB 3.28Å; C1165-K1169 WeakPolarHBondContact O-CB 3.4Å; C1165-K1169 PolarHBondContact O-N 3.33Å; I1167-K1169 VanDerWaalsContact C-N 3.32Å; I1167-K1169 PolarHBondContact O-N 2.89Å; K1169-S1173 WeakPolarHBondContact O-CB 3.46Å; K1169-S1173 PolarHBondContact O-N 3.37Å
1170	K	70.4	Confident	71	Confident	135 Å²	135	105.4 Å²	105.4	59%	0.587	53%	0.531	S	S	*	.	H	α-helix	trans	-67.4	-47.2	175.7	-174.8	-178.8	177.5	-173.7	0	111.6	V1166 I1167 C1168 H1172 S1173	V1166-K1170 WeakPolarHBondContact O-CB 3.48Å; V1166-K1170 PolarHBondContact O-N 2.93Å; I1167-K1170 WeakPolarHBondContact O-CB 3.47Å; I1167-K1170 PolarHBondContact O-N 2.84Å; C1168-K1170 VanDerWaalsContact C-N 3.28Å; C1168-K1170 PolarHBondContact O-N 3.44Å; K1170-H1172 VanDerWaalsContact C-N 3.29Å; K1170-H1172 PolarHBondContact O-N 3.07Å; K1170-S1173 PolarHBondContact O-N 2.81Å; K1170-S1173 PolarHBondContact O-OG 3.48Å
1171	I	69.3	Low	69.4	Low	124 Å²	124	106.7 Å²	106.7	64%	0.636	56%	0.555	S	S	*	*	H	α-helix	trans	-62.7	-38.1	179.8	-66.6	170.5	0	0	0	111.1	I1167 C1168	I1167-I1171 HydrophobicContact CG2-CD1 4.1Å; I1167-I1171 WeakPolarHBondContact O-CG1 3.26Å; I1167-I1171 PolarHBondContact O-N 3.44Å; I1167-I1171 VanDerWaalsContact O-N 3.09Å; C1168-I1171 PolarHBondContact O-N 3.01Å
1172	H	67.1	Low	67.8	Low	152 Å²	152	115.3 Å²	115.3	70%	0.704	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.3	5	179.3	-63.7	-61	0	0	0	114.3	C1168 K1170 V1174	C1168-H1172 WeakPolarHBondContact O-CB 3.32Å; C1168-H1172 PolarHBondContact O-CD2 2.89Å; C1168-H1172 PolarHBondContact O-N 2.69Å; K1170-H1172 VanDerWaalsContact C-N 3.29Å; K1170-H1172 PolarHBondContact O-N 3.07Å; H1172-V1174 PolarHBondContact O-N 2.97Å
1173	S	62.8	Low	66.7	Low	81 Å²	81	117.5 Å²	117.5	57%	0.566	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-72.9	128.7	178.7	64.6	0	0	0	0	111	K1169 K1170	K1169-S1173 WeakPolarHBondContact O-CB 3.46Å; K1169-S1173 PolarHBondContact O-N 3.37Å; K1170-S1173 PolarHBondContact O-N 2.81Å; K1170-S1173 PolarHBondContact O-OG 3.48Å
1174	V	45.8	Very low	66	Low	127 Å²	127	111.9 Å²	111.9	77%	0.77	59%	0.592	S	S	*	*	P	Polyproline II helix	trans	-77.3	141.9	170.6	-177.9	0	0	0	0	108.1	H1172 Y1176	H1172-V1174 PolarHBondContact O-N 2.97Å; V1174-Y1176 PolarHBondContact O-N 3.39Å
1175	A	51	Low	65.5	Low	86 Å²	86	113.7 Å²	113.7	71%	0.711	59%	0.594	S	S	*	*	P	Polyproline II helix	trans	-51.5	138.4	174.7	0	0	0	0	0	110.6	Q1177	A1175-Q1177 PolarHBondContact O-N 2.93Å
1176	Y	53.4	Low	65.1	Low	202 Å²	202	116.2 Å²	116.2	79%	0.792	61%	0.605	S	S	*	*			trans	-61.6	112.5	177.9	179.8	-101.5	0	0	0	109.3	V1174 S1178	V1174-Y1176 PolarHBondContact O-N 3.39Å; Y1176-S1178 PolarHBondContact O-N 3.41Å
1177	Q	43.7	Very low	64.9	Low	139 Å²	139	113.5 Å²	113.5	65%	0.65	58%	0.582	S	S	*	*			trans	-73.2	117.5	168.5	-73.8	179.2	-14.7	0	0	107.6	A1175 K1179	A1175-Q1177 PolarHBondContact O-N 2.93Å; Q1177-K1179 PolarHBondContact O-N 3.14Å; Q1177-K1179 VanDerWaalsContact O-N 3.1Å
1178	S	47.9	Very low	64.7	Low	93 Å²	93	113.7 Å²	113.7	65%	0.65	59%	0.587	S	S	*	*			trans	-61.4	116.6	176.7	52.3	0	0	0	0	109.1	Y1176 M1180	Y1176-S1178 PolarHBondContact O-N 3.41Å; S1178-M1180 PolarHBondContact O-N 3.22Å
1179	K	45.9	Very low	64.5	Low	188 Å²	188	116.3 Å²	116.3	82%	0.817	60%	0.603	S	S	*	*			trans	-65.5	106.7	168.8	-170.6	177.2	-179.4	-176.3	0	106.6	Q1177 A1181	Q1177-K1179 PolarHBondContact O-N 3.14Å; Q1177-K1179 VanDerWaalsContact O-N 3.1Å; K1179-A1181 PolarHBondContact O-N 3.24Å
1180	M	48.9	Very low	64.7	Low	131 Å²	131	118.1 Å²	118.1	65%	0.645	61%	0.614	S	S	*	*	P	Polyproline II helix	trans	-58.9	136.2	176	-67.9	-152.6	73.1	0	0	109	W669 S1178	W669-M1180 HydrophobicContact CH2-SD 3.66Å; W669-M1180 HydrophobicContact CZ3-SD 3.62Å; S1178-M1180 PolarHBondContact O-N 3.22Å
1181	A	59.6	Low	65.6	Low	89 Å²	89	112.7 Å²	112.7	74%	0.736	60%	0.595	S	S	*	*	P	Polyproline II helix	trans	-58.8	152.9	172.9	0	0	0	0	0	109.9	K1179 L1183	K1179-A1181 PolarHBondContact O-N 3.24Å; A1181-L1183 PolarHBondContact O-N 2.81Å
1182	E	62.2	Low	66.6	Low	191 Å²	191	110.5 Å²	110.5	89%	0.893	59%	0.59	S	S	*	*	P	Polyproline II helix	trans	-54.2	135.6	172	-69	-178.6	173.9	0	0	109.7
1183	L	69.2	Low	67.8	Low	72 Å²	72	105.4 Å²	105.4	38%	0.377	57%	0.57	S	S	.	*	P	Polyproline II helix	trans	-61.8	140	174.9	-71.1	165.3	0	0	0	108.4	A1181 K1185 V1188	A1181-L1183 PolarHBondContact O-N 2.81Å; L1183-K1185 PolarHBondContact O-N 3.01Å; L1183-V1188 HydrophobicContact CB-CG1 3.85Å; L1183-V1188 HydrophobicContact CD1-CG1 3.9Å
1184	P	75.9	Confident	69.3	Low	55 Å²	55	101.7 Å²	101.7	36%	0.357	54%	0.544	S	S	.	.	P	Polyproline II helix	trans	-52.2	135.2	173.9	-22.3	30.5	0	0	0	109.7	E1186 R1187	P1184-E1186 VanDerWaalsContact CB-OE2 3.23Å; P1184-E1186 WeakPolarHBondContact CB-OE2 3.29Å; P1184-E1186 PolarHBondContact O-N 3.49Å; P1184-R1187 PolarHBondContact O-N 2.84Å
1185	K	79.5	Confident	71.6	Confident	146 Å²	146	98.4 Å²	98.4	64%	0.635	52%	0.521	S	S	*	.	H	α-helix	trans	-50.7	-31.5	178.2	64.1	-179.9	-179.8	-177.7	0	111.3	L1183 R1187 V1188 T1189 R1196	L1183-K1185 PolarHBondContact O-N 3.01Å; K1185-R1187 PolarHBondContact O-N 2.8Å; K1185-V1188 PolarHBondContact O-N 3.22Å; K1185-T1189 PolarHBondContact O-N 2.78Å; K1185-T1189 PolarHBondContact O-OG1 3.14Å; K1185-R1196 PolarHBondContact O-NH1 3.44Å
1186	E	81.3	Confident	73.6	Confident	63 Å²	63	96.6 Å²	96.6	29%	0.294	50%	0.495	S	S	.	.	H	α-helix	trans	-55.9	-31.5	177.4	-65.3	73	-156.5	0	0	112.7	P1184 R1196 M1224	P1184-E1186 VanDerWaalsContact CB-OE2 3.23Å; P1184-E1186 WeakPolarHBondContact CB-OE2 3.29Å; P1184-E1186 PolarHBondContact O-N 3.49Å; E1186-R1196 WeakPolarHBondContact O-CD 3.13Å; E1186-R1196 PolarHBondContact O-NH1 3.32Å; E1186-M1224 HydrophobicContact CB-SD 3.97Å
1187	R	81.4	Confident	75.5	Confident	58 Å²	58	87 Å²	87	22%	0.219	46%	0.457	C	S	.	.	H	α-helix	trans	-88.8	-21.9	-179.7	-68.3	-171.5	63.6	-166.3	-5.4	114.7	P1184 K1185 M1224	P1184-R1187 PolarHBondContact O-N 2.84Å; K1185-R1187 PolarHBondContact O-N 2.8Å; R1187-M1224 HydrophobicContact CG-CB 4.21Å
1188	V	78.8	Confident	77.9	Confident	94 Å²	94	80.3 Å²	80.3	57%	0.57	43%	0.427	S	S	*	.	H	α-helix	trans	-113.4	-10.7	-169.2	-63.8	0	0	0	0	114.1	L1183 K1185	L1183-V1188 HydrophobicContact CB-CG1 3.85Å; L1183-V1188 HydrophobicContact CD1-CG1 3.9Å; K1185-V1188 PolarHBondContact O-N 3.22Å
1189	T	80.3	Confident	80	Confident	67 Å²	67	75.9 Å²	75.9	41%	0.411	40%	0.396	S	S	.	.	S	Bend	trans	-85.5	140.8	169.6	-25.1	0	0	0	0	110.2	K1185 A1191 R1196	K1185-T1189 PolarHBondContact O-N 2.78Å; K1185-T1189 PolarHBondContact O-OG1 3.14Å; T1189-A1191 PolarHBondContact O-N 2.83Å; T1189-R1196 PolarHBondContact OG1-NH1 3.21Å; T1189-R1196 PolarHBondContact OG1-NH2 3.07Å
1190	E	84.8	Confident	82.3	Confident	187 Å²	187	68.2 Å²	68.2	87%	0.874	36%	0.363	S	S	*	.			trans	-55	133.2	170.5	-169.3	177.6	176.1	0	0	110.9
1191	A	88.1	Confident	84.2	Confident	22 Å²	22	63.2 Å²	63.2	18%	0.182	34%	0.338	C	S	.	.			trans	-154.4	156.2	177.5	0	0	0	0	0	109.3	T1189 Q1195 R1196 V1225	T1189-A1191 PolarHBondContact O-N 2.83Å; A1191-Q1195 HydrophobicContact CB-CB 4.23Å; A1191-R1196 HydrophobicContact CB-CG 4.22Å; A1191-V1225 HydrophobicContact CB-CG2 4.06Å
1192	S	90.9	Very high	85.2	Confident	78 Å²	78	59.1 Å²	59.1	55%	0.545	30%	0.304	S	S	.	.			trans	-64.1	151.6	174	-65.5	0	0	0	0	111	F1194 Q1195	S1192-F1194 PolarHBondContact O-N 3.21Å; S1192-Q1195 WeakPolarHBondContact O-CB 3.4Å; S1192-Q1195 PolarHBondContact O-N 2.74Å
1193	P	92.9	Very high	85.7	Confident	44 Å²	44	51.3 Å²	51.3	29%	0.286	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.5	131.6	177.4	-26	34.4	0	0	0	111.8	Q1195 F1358 L1359	P1193-Q1195 PolarHBondContact O-N 3.03Å; P1193-Q1195 VanDerWaalsContact O-N 3.16Å; P1193-F1358 HydrophobicContact CG-CB 4.13Å; P1193-F1358 WeakPolarHBondContact CG-O 3.5Å; P1193-L1359 HydrophobicContact CB-CD2 3.96Å
1194	F	94.9	Very high	86.2	Confident	4 Å²	4	50.6 Å²	50.6	2%	0.018	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.1	4.5	-176.4	-64.2	-73.9	0	0	0	117.1	S1192 R1196 T1197 F1221 C1223 A1228 H1230 F1249 R1253 P1256 L1359	S1192-F1194 PolarHBondContact O-N 3.21Å; F1194-R1196 PolarHBondContact O-N 2.94Å; F1194-T1197 WeakPolarHBondContact CA-OG1 3.25Å; F1194-T1197 HydrophobicContact CD1-CG2 4.33Å; F1194-T1197 PolarHBondContact O-OG1 3.44Å; F1194-F1221 HydrophobicContact CE1-CB 4.4Å; F1194-C1223 HydrophobicContact CD1-CB 4.05Å; F1194-C1223 HydrophobicContact CE1-CB 4.29Å; F1194-C1223 HydrophobicContact CG-CB 4.34Å; F1194-C1223 PolarHBondContact N-SG 2.9Å; F1194-A1228 WeakPolarHBondContact CE1-O 3.35Å; F1194-A1228 HydrophobicContact CE2-CB 3.97Å; F1194-A1228 HydrophobicContact CZ-CB 3.9Å; F1194-H1230 HydrophobicContact CE1-CB 4.24Å; F1194-H1230 HydrophobicContact CZ-CB 3.87Å; F1194-F1249 HydrophobicContact CB-CE2 4.14Å; F1194-F1249 HydrophobicContact CB-CZ 3.9Å; F1194-F1249 AromaticContact CD1-CE2 3.48Å; F1194-F1249 HydrophobicContact CD1-CE2 3.48Å; F1194-F1249 VanDerWaalsContact CD1-CE2 3.48Å; F1194-F1249 AromaticContact CD1-CZ 3.74Å; F1194-F1249 HydrophobicContact CD1-CZ 3.74Å; F1194-F1249 HydrophobicContact CD2-CE2 4.43Å; F1194-F1249 AromaticContact CE1-CE2 3.88Å; F1194-F1249 HydrophobicContact CE1-CE2 3.88Å; F1194-F1249 AromaticContact CG-CE2 3.78Å; F1194-F1249 HydrophobicContact CG-CE2 3.78Å; F1194-F1249 HydrophobicContact CG-CZ 4.01Å; F1194-R1253 HydrophobicContact CB-CB 4.23Å; F1194-R1253 HydrophobicContact CD2-CB 3.82Å; F1194-R1253 HydrophobicContact CD2-CG 3.84Å; F1194-R1253 HydrophobicContact CE2-CB 4.4Å; F1194-R1253 HydrophobicContact CE2-CG 3.9Å; F1194-R1253 HydrophobicContact CG-CB 4.13Å; F1194-R1253 HydrophobicContact CG-CG 4.4Å; F1194-P1256 WeakPolarHBondContact O-CB 3.49Å; F1194-L1359 HydrophobicContact CD2-CD2 3.97Å; F1194-L1359 HydrophobicContact CE2-CD2 3.56Å
1195	Q	92.1	Very high	86.2	Confident	58 Å²	58	50.2 Å²	50.2	27%	0.271	27%	0.269	S	S	.	.	S	Bend	trans	-60.7	-32.7	170.2	-171.8	178.7	-11.7	0	0	111.6	A1191 S1192 P1193 P1256 D1257 C1258	A1191-Q1195 HydrophobicContact CB-CB 4.23Å; S1192-Q1195 WeakPolarHBondContact O-CB 3.4Å; S1192-Q1195 PolarHBondContact O-N 2.74Å; P1193-Q1195 PolarHBondContact O-N 3.03Å; P1193-Q1195 VanDerWaalsContact O-N 3.16Å; Q1195-P1256 CarbonylContact O-C 3.52Å; Q1195-D1257 HydrophobicContact CG-CB 4.1Å; Q1195-D1257 WeakPolarHBondContact CG-OD2 3.33Å; Q1195-D1257 PolarHBondContact NE2-OD2 3.45Å; Q1195-D1257 PolarHBondContact O-N 3.34Å; Q1195-C1258 PolarHBondContact O-N 2.84Å
1196	R	93	Very high	86.1	Confident	47 Å²	47	49.9 Å²	49.9	18%	0.177	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	114	173.9	-54.5	-178.7	179	178	-4.6	108.6	K1185 E1186 T1189 A1191 F1194 M1224	K1185-R1196 PolarHBondContact O-NH1 3.44Å; E1186-R1196 WeakPolarHBondContact O-CD 3.13Å; E1186-R1196 PolarHBondContact O-NH1 3.32Å; T1189-R1196 PolarHBondContact OG1-NH1 3.21Å; T1189-R1196 PolarHBondContact OG1-NH2 3.07Å; A1191-R1196 HydrophobicContact CB-CG 4.22Å; F1194-R1196 PolarHBondContact O-N 2.94Å; R1196-M1224 HydrophobicContact CB-CB 4.01Å; R1196-M1224 HydrophobicContact CB-CG 4.22Å; R1196-M1224 HydrophobicContact CB-SD 3.69Å; R1196-M1224 WeakPolarHBondContact O-CB 3.26Å; R1196-M1224 PolarHBondContact O-N 3.02Å
1197	T	94.4	Very high	85.8	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	128.3	-163.8	-67.3	0	0	0	0	113.1	F1194 V1199 F1221 T1222 M1224 F1249 C1258 M1259 Q1260	F1194-T1197 WeakPolarHBondContact CA-OG1 3.25Å; F1194-T1197 HydrophobicContact CD1-CG2 4.33Å; F1194-T1197 PolarHBondContact O-OG1 3.44Å; T1197-V1199 HydrophobicContact CG2-CG2 4.14Å; T1197-F1221 HydrophobicContact CG2-CB 4.11Å; T1197-F1221 HydrophobicContact CG2-CD1 4.2Å; T1197-T1222 CarbonylContact C-O 3.59Å; T1197-T1222 VanDerWaalsContact CA-O 3.32Å; T1197-T1222 WeakPolarHBondContact CA-O 2.93Å; T1197-M1224 WeakPolarHBondContact O-CE 3.41Å; T1197-F1249 HydrophobicContact CG2-CE1 4.38Å; T1197-F1249 HydrophobicContact CG2-CZ 3.92Å; T1197-C1258 PolarHBondContact N-O 2.6Å; T1197-M1259 CarbonylContact O-C 3.56Å; T1197-M1259 WeakPolarHBondContact O-CA 3.27Å; T1197-Q1260 PolarHBondContact O-N 2.82Å
1198	G	93	Very high	85	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	146.8	166.6	0	0	0	0	0	111.2	T1222 Q1260 Y1310	G1198-T1222 PolarHBondContact N-O 3.29Å; G1198-T1222 PolarHBondContact O-N 2.88Å; G1198-Q1260 CarbonylContact C-O 3.14Å; G1198-Q1260 VanDerWaalsContact CA-O 3.29Å; G1198-Q1260 WeakPolarHBondContact CA-O 3.35Å; G1198-Y1310 WeakPolarHBondContact CA-OH 3.43Å
1199	V	93.5	Very high	84.1	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	136.4	-178	179.2	0	0	0	0	111.1	T1197 L1220 F1221 F1242 M1259 Q1260 F1267	T1197-V1199 HydrophobicContact CG2-CG2 4.14Å; V1199-L1220 WeakPolarHBondContact CA-O 3.32Å; V1199-F1221 HydrophobicContact CG1-CD1 4.43Å; V1199-F1221 HydrophobicContact CG1-CE1 4.17Å; V1199-F1221 HydrophobicContact CG2-CD1 3.47Å; V1199-F1221 VanDerWaalsContact CG2-CD1 3.47Å; V1199-F1221 HydrophobicContact CG2-CE1 3.73Å; V1199-F1221 HydrophobicContact CG2-CG 4.45Å; V1199-F1242 HydrophobicContact CG1-CE2 3.76Å; V1199-F1242 HydrophobicContact CG1-CZ 4.38Å; V1199-M1259 HydrophobicContact CB-CE 4.45Å; V1199-M1259 HydrophobicContact CG2-CE 3.62Å; V1199-Q1260 PolarHBondContact N-O 3.46Å; V1199-F1267 HydrophobicContact CG1-CE1 3.75Å; V1199-F1267 HydrophobicContact CG1-CZ 3.77Å
1200	D	93	Very high	83.1	Confident	27 Å²	27	67 Å²	67	14%	0.144	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	163.7	174.3	-167.2	18.8	0	0	0	111.8	L1220 W1311 V1315	D1200-L1220 PolarHBondContact N-O 3.3Å; D1200-L1220 PolarHBondContact O-N 2.88Å; D1200-W1311 HydrophobicContact CB-CG 4.24Å; D1200-V1315 HydrophobicContact CB-CG2 4.24Å; D1200-V1315 WeakPolarHBondContact OD2-CG2 3.44Å
1201	F	90	Very high	81.9	Confident	26 Å²	26	66.3 Å²	66.3	11%	0.114	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	114.7	170.7	-75.9	-65.8	0	0	0	111.5	V1218 C1219 V1234 L1237 F1242 F1264 F1267	F1201-V1218 CarbonylContact C-O 3.51Å; F1201-V1218 WeakPolarHBondContact CA-O 3.47Å; F1201-C1219 HydrophobicContact CD1-CB 4Å; F1201-C1219 HydrophobicContact CE1-CB 3.71Å; F1201-V1234 HydrophobicContact CD1-CG2 4.28Å; F1201-V1234 HydrophobicContact CE1-CG2 3.81Å; F1201-L1237 HydrophobicContact CB-CD2 3.7Å; F1201-L1237 HydrophobicContact CD1-CD2 3.49Å; F1201-L1237 VanDerWaalsContact CD1-CD2 3.49Å; F1201-L1237 HydrophobicContact CD2-CD2 3.6Å; F1201-L1237 HydrophobicContact CE1-CD2 3.9Å; F1201-L1237 HydrophobicContact CE2-CD2 3.98Å; F1201-L1237 HydrophobicContact CG-CD2 3.32Å; F1201-L1237 HydrophobicContact CZ-CD2 4.12Å; F1201-F1242 HydrophobicContact CZ-CB 4.1Å; F1201-F1242 HydrophobicContact CZ-CD2 4.02Å; F1201-F1242 HydrophobicContact CZ-CG 4.46Å; F1201-F1264 HydrophobicContact CD2-CD1 4.13Å; F1201-F1264 HydrophobicContact CD2-CE1 4.15Å; F1201-F1264 HydrophobicContact CE2-CD1 4.05Å; F1201-F1264 AromaticContact CE2-CE1 3.97Å; F1201-F1264 HydrophobicContact CE2-CE1 3.97Å; F1201-F1267 AromaticContact CD2-CE1 3.82Å; F1201-F1267 HydrophobicContact CD2-CE1 3.82Å; F1201-F1267 HydrophobicContact CD2-CE2 4.12Å; F1201-F1267 AromaticContact CD2-CZ 3.35Å; F1201-F1267 HydrophobicContact CD2-CZ 3.35Å; F1201-F1267 HydrophobicContact CE2-CD1 4.22Å; F1201-F1267 AromaticContact CE2-CE1 3.31Å; F1201-F1267 HydrophobicContact CE2-CE1 3.31Å; F1201-F1267 HydrophobicContact CE2-CE2 4.35Å; F1201-F1267 AromaticContact CE2-CZ 3.39Å; F1201-F1267 HydrophobicContact CE2-CZ 3.39Å; F1201-F1267 HydrophobicContact CG-CZ 4.21Å; F1201-F1267 AromaticContact CZ-CE1 3.91Å; F1201-F1267 HydrophobicContact CZ-CE1 3.91Å; F1201-F1267 HydrophobicContact CZ-CZ 4.25Å
1202	A	80.9	Confident	80.2	Confident	3 Å²	3	71.1 Å²	71.1	3%	0.025	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	117.7	168.5	0	0	0	0	0	110.4	V1218 V1315	A1202-V1218 HydrophobicContact CB-CB 4.16Å; A1202-V1218 PolarHBondContact N-O 3.22Å; A1202-V1218 PolarHBondContact O-N 3.08Å; A1202-V1315 HydrophobicContact CB-CB 4.42Å; A1202-V1315 HydrophobicContact CB-CG1 3.69Å; A1202-V1315 HydrophobicContact CB-CG2 4.2Å
1203	G	72.5	Confident	79	Confident	27 Å²	27	71.8 Å²	71.8	28%	0.278	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	160.6	-173.6	175.6	0	0	0	0	0	113.2
1204	P	78.2	Confident	78.1	Confident	56 Å²	56	71.1 Å²	71.1	36%	0.364	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	cis	-76.4	152.1	6.4	30.9	-36	0	0	0	115	F1206 K1215 Y1217	P1204-F1206 HydrophobicContact CG-CE2 4.35Å; P1204-F1206 HydrophobicContact CG-CZ 4.42Å; P1204-K1215 HydrophobicContact CB-CD 4Å; P1204-K1215 HydrophobicContact CB-CG 3.55Å; P1204-K1215 VanDerWaalsContact CG-CE 3.41Å; P1204-Y1217 HydrophobicContact CB-CD1 4.38Å; P1204-Y1217 HydrophobicContact CB-CE1 3.93Å
1205	L	77.3	Confident	77.4	Confident	47 Å²	47	74 Å²	74	25%	0.246	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	146.4	162.2	-57.6	175.4	0	0	0	108.6	V1216 V1218 L1322	L1205-V1216 HydrophobicContact CB-CG2 4Å; L1205-V1216 PolarHBondContact N-O 2.85Å; L1205-V1216 PolarHBondContact O-N 3.34Å; L1205-V1216 VanDerWaalsContact O-O 3.14Å; L1205-V1218 HydrophobicContact CD1-CG2 3.55Å; L1205-L1322 HydrophobicContact CD1-CD1 3.7Å; L1205-L1322 HydrophobicContact CD2-CD1 4.04Å
1206	F	77	Confident	77.1	Confident	139 Å²	139	71.9 Å²	71.9	61%	0.61	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108	111.8	177.2	-63.8	-87.1	0	0	0	108.9	P1204 P1213 K1215	P1204-F1206 HydrophobicContact CG-CE2 4.35Å; P1204-F1206 HydrophobicContact CG-CZ 4.42Å; F1206-P1213 HydrophobicContact CB-CB 4.49Å; F1206-K1215 HydrophobicContact CE1-CB 4.46Å; F1206-K1215 HydrophobicContact CE1-CG 4.32Å
1207	V	74	Confident	77	Confident	55 Å²	55	71.3 Å²	71.3	33%	0.333	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	139.8	177.8	-66.3	0	0	0	0	110	R1209 P1213 A1214 V1216	V1207-R1209 PolarHBondContact O-N 3.33Å; V1207-P1213 CarbonylContact O-C 3.57Å; V1207-P1213 WeakPolarHBondContact O-CA 3.5Å; V1207-A1214 HydrophobicContact CG2-CB 4.18Å; V1207-A1214 WeakPolarHBondContact CG2-O 3.41Å; V1207-A1214 PolarHBondContact N-O 3.37Å; V1207-A1214 PolarHBondContact O-N 2.89Å; V1207-V1216 HydrophobicContact CB-CG2 4.26Å; V1207-V1216 HydrophobicContact CG1-CG2 3.6Å; V1207-V1216 HydrophobicContact CG2-CB 4.29Å; V1207-V1216 HydrophobicContact CG2-CG1 3.52Å; V1207-V1216 HydrophobicContact CG2-CG2 3.71Å
1208	R	66	Low	76.8	Confident	145 Å²	145	71.8 Å²	71.8	55%	0.547	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	114	-178.7	-164.5	-178.8	-173.2	131.2	4.3	110.6	R1386	R1208-R1386 WeakPolarHBondContact CD-O 3.35Å; R1208-R1386 PolarHBondContact NH1-O 2.95Å
1209	R	58.6	Low	76.9	Confident	196 Å²	196	71.8 Å²	71.8	74%	0.74	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105	106.3	169.1	-100	-168.3	173.3	-165.7	0.3	109.8	V1207 Q1211 N1212 A1214	V1207-R1209 PolarHBondContact O-N 3.33Å; R1209-Q1211 VanDerWaalsContact C-N 3.27Å; R1209-Q1211 PolarHBondContact O-N 3.26Å; R1209-N1212 PolarHBondContact N-O 3.16Å; R1209-N1212 VanDerWaalsContact N-O 3.09Å; R1209-N1212 PolarHBondContact O-N 2.85Å; R1209-A1214 HydrophobicContact CB-CB 4.38Å; R1209-A1214 HydrophobicContact CG-CB 4.48Å
1210	R	59.6	Low	76.9	Confident	247 Å²	247	71.8 Å²	71.8	93%	0.932	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.5	-77.2	179.8	-65.4	-177.2	177	173.6	-1.3	113.8
1211	Q	59.2	Low	77.1	Confident	171 Å²	171	70.5 Å²	70.5	80%	0.799	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.8	-24.6	-178.4	-71.4	178.1	-10.8	0	0	114.5	R1209	R1209-Q1211 VanDerWaalsContact C-N 3.27Å; R1209-Q1211 PolarHBondContact O-N 3.26Å
1212	N	54	Low	77.3	Confident	123 Å²	123	69.3 Å²	69.3	66%	0.658	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.1	136.8	-176.2	-72.1	-24.5	0	0	0	112.1	R1209 A1214	R1209-N1212 PolarHBondContact N-O 3.16Å; R1209-N1212 VanDerWaalsContact N-O 3.09Å; R1209-N1212 PolarHBondContact O-N 2.85Å; N1212-A1214 PolarHBondContact O-N 3.07Å
1213	P	64.1	Low	77.9	Confident	93 Å²	93	69.1 Å²	69.1	60%	0.604	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.3	120.5	169.7	25.9	-30.6	0	0	0	109.3	F1206 V1207	F1206-P1213 HydrophobicContact CB-CB 4.49Å; V1207-P1213 CarbonylContact O-C 3.57Å; V1207-P1213 WeakPolarHBondContact O-CA 3.5Å
1214	A	74	Confident	78.7	Confident	29 Å²	29	68.2 Å²	68.2	24%	0.24	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	130.7	173.8	0	0	0	0	0	109.3	V1207 R1209 N1212	V1207-A1214 HydrophobicContact CG2-CB 4.18Å; V1207-A1214 WeakPolarHBondContact CG2-O 3.41Å; V1207-A1214 PolarHBondContact N-O 3.37Å; V1207-A1214 PolarHBondContact O-N 2.89Å; R1209-A1214 HydrophobicContact CB-CB 4.38Å; R1209-A1214 HydrophobicContact CG-CB 4.48Å; N1212-A1214 PolarHBondContact O-N 3.07Å
1215	K	81.2	Confident	79.2	Confident	66 Å²	66	67.7 Å²	67.7	29%	0.287	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	123.9	173	-164.1	178.2	-170.6	176.6	0	108.4	P1204 F1206 Y1217	P1204-K1215 HydrophobicContact CB-CD 4Å; P1204-K1215 HydrophobicContact CB-CG 3.55Å; P1204-K1215 VanDerWaalsContact CG-CE 3.41Å; F1206-K1215 HydrophobicContact CE1-CB 4.46Å; F1206-K1215 HydrophobicContact CE1-CG 4.32Å; K1215-Y1217 HydrophobicContact CD-CE2 4.42Å; K1215-Y1217 WeakPolarHBondContact CE-OH 3.43Å; K1215-Y1217 HydrophobicContact CG-CE2 4.19Å; K1215-Y1217 PolarHBondContact NZ-OH 3.35Å
1216	V	86.3	Confident	79.8	Confident	12 Å²	12	65.9 Å²	65.9	7%	0.073	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	165.7	175.4	-61.6	0	0	0	0	109.4	L1205 V1207 L1233 V1234	L1205-V1216 HydrophobicContact CB-CG2 4Å; L1205-V1216 PolarHBondContact N-O 2.85Å; L1205-V1216 PolarHBondContact O-N 3.34Å; L1205-V1216 VanDerWaalsContact O-O 3.14Å; V1207-V1216 HydrophobicContact CB-CG2 4.26Å; V1207-V1216 HydrophobicContact CG1-CG2 3.6Å; V1207-V1216 HydrophobicContact CG2-CB 4.29Å; V1207-V1216 HydrophobicContact CG2-CG1 3.52Å; V1207-V1216 HydrophobicContact CG2-CG2 3.71Å; V1216-L1233 HydrophobicContact CB-CD1 4.21Å; V1216-L1233 HydrophobicContact CB-CG 4.46Å; V1216-L1233 HydrophobicContact CG2-CD1 3.82Å; V1216-L1233 HydrophobicContact CG2-CG 4.43Å; V1216-V1234 WeakPolarHBondContact CA-O 3.46Å
1217	Y	90.2	Very high	80.4	Confident	35 Å²	35	60.1 Å²	60.1	14%	0.137	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	155.5	-179.1	-56.4	-99.9	0	0	0	109	P1204 K1215 V1234 L1237	P1204-Y1217 HydrophobicContact CB-CD1 4.38Å; P1204-Y1217 HydrophobicContact CB-CE1 3.93Å; K1215-Y1217 HydrophobicContact CD-CE2 4.42Å; K1215-Y1217 WeakPolarHBondContact CE-OH 3.43Å; K1215-Y1217 HydrophobicContact CG-CE2 4.19Å; K1215-Y1217 PolarHBondContact NZ-OH 3.35Å; Y1217-V1234 PolarHBondContact N-O 3.32Å; Y1217-V1234 WeakPolarHBondContact O-CG2 3.36Å; Y1217-V1234 PolarHBondContact O-N 2.93Å; Y1217-L1237 HydrophobicContact CD1-CD1 4.01Å; Y1217-L1237 HydrophobicContact CD1-CD2 3.48Å; Y1217-L1237 VanDerWaalsContact CD1-CD2 3.48Å; Y1217-L1237 HydrophobicContact CD1-CG 3.8Å; Y1217-L1237 HydrophobicContact CD2-CD2 3.94Å; Y1217-L1237 HydrophobicContact CD2-CG 3.93Å; Y1217-L1237 HydrophobicContact CE1-CD1 3.58Å; Y1217-L1237 HydrophobicContact CE1-CD2 3.93Å; Y1217-L1237 HydrophobicContact CE1-CG 3.71Å; Y1217-L1237 HydrophobicContact CE2-CD1 4.48Å; Y1217-L1237 HydrophobicContact CE2-CD2 4.38Å; Y1217-L1237 HydrophobicContact CE2-CG 3.89Å; Y1217-L1237 HydrophobicContact CG-CD2 3.45Å; Y1217-L1237 VanDerWaalsContact CG-CD2 3.45Å; Y1217-L1237 HydrophobicContact CG-CG 3.88Å
1218	V	90.8	Very high	81.3	Confident	11 Å²	11	57.5 Å²	57.5	7%	0.067	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	117.4	171.6	175.5	0	0	0	0	107.1	F1201 A1202 L1205 L1220 L1231 E1232 L1233	F1201-V1218 CarbonylContact C-O 3.51Å; F1201-V1218 WeakPolarHBondContact CA-O 3.47Å; A1202-V1218 HydrophobicContact CB-CB 4.16Å; A1202-V1218 PolarHBondContact N-O 3.22Å; A1202-V1218 PolarHBondContact O-N 3.08Å; L1205-V1218 HydrophobicContact CD1-CG2 3.55Å; V1218-L1220 PolarHBondContact O-N 3.08Å; V1218-L1231 HydrophobicContact CG1-CB 3.93Å; V1218-L1231 HydrophobicContact CG1-CD2 3.78Å; V1218-L1231 HydrophobicContact CG1-CG 4.29Å; V1218-E1232 CarbonylContact C-O 3.56Å; V1218-E1232 WeakPolarHBondContact CA-O 3.39Å; V1218-L1233 HydrophobicContact CG2-CD1 4.03Å
1219	C	94.1	Very high	82.6	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	113.5	165.7	-167.3	0	0	0	0	107.6	F1201 F1221 E1232 V1234 A1245	F1201-C1219 HydrophobicContact CD1-CB 4Å; F1201-C1219 HydrophobicContact CE1-CB 3.71Å; C1219-F1221 HydrophobicContact CB-CE2 4.25Å; C1219-F1221 VanDerWaalsContact SG-CE2 3.56Å; C1219-F1221 VanDerWaalsContact SG-CZ 3.59Å; C1219-E1232 HydrophobicContact CB-CB 4.14Å; C1219-E1232 PolarHBondContact N-O 2.65Å; C1219-E1232 PolarHBondContact O-N 3.09Å; C1219-V1234 HydrophobicContact CB-CG1 4.21Å; C1219-A1245 HydrophobicContact CB-CB 4.25Å
1220	L	94.5	Very high	84.4	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	122.9	-179.7	-178.6	150.8	0	0	0	109	V1199 D1200 V1218 T1222 L1231 W1311 L1314 V1315 V1318	V1199-L1220 WeakPolarHBondContact CA-O 3.32Å; D1200-L1220 PolarHBondContact N-O 3.3Å; D1200-L1220 PolarHBondContact O-N 2.88Å; V1218-L1220 PolarHBondContact O-N 3.08Å; L1220-T1222 HydrophobicContact CD2-CG2 3.91Å; L1220-L1231 HydrophobicContact CB-CD2 4.04Å; L1220-L1231 HydrophobicContact CD1-CD2 3.93Å; L1220-L1231 HydrophobicContact CG-CD2 3.88Å; L1220-W1311 HydrophobicContact CD2-CB 4.47Å; L1220-L1314 HydrophobicContact CD1-CB 4.33Å; L1220-V1315 HydrophobicContact CD1-CG2 3.84Å; L1220-V1318 HydrophobicContact CD1-CG2 3.9Å
1221	F	96.1	Very high	86	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	128.4	166.7	-59.6	-91.1	0	0	0	108.2	F1194 T1197 V1199 C1219 I1229 H1230 E1232 F1242 F1246 F1249	F1194-F1221 HydrophobicContact CE1-CB 4.4Å; T1197-F1221 HydrophobicContact CG2-CB 4.11Å; T1197-F1221 HydrophobicContact CG2-CD1 4.2Å; V1199-F1221 HydrophobicContact CG1-CD1 4.43Å; V1199-F1221 HydrophobicContact CG1-CE1 4.17Å; V1199-F1221 HydrophobicContact CG2-CD1 3.47Å; V1199-F1221 VanDerWaalsContact CG2-CD1 3.47Å; V1199-F1221 HydrophobicContact CG2-CE1 3.73Å; V1199-F1221 HydrophobicContact CG2-CG 4.45Å; C1219-F1221 HydrophobicContact CB-CE2 4.25Å; C1219-F1221 VanDerWaalsContact SG-CE2 3.56Å; C1219-F1221 VanDerWaalsContact SG-CZ 3.59Å; F1221-I1229 CarbonylContact O-C 2.85Å; F1221-I1229 VanDerWaalsContact O-CA 3.29Å; F1221-I1229 WeakPolarHBondContact O-CA 3.4Å; F1221-H1230 HydrophobicContact CB-CB 4.27Å; F1221-H1230 PolarHBondContact N-O 3.38Å; F1221-H1230 PolarHBondContact O-N 3.5Å; F1221-E1232 HydrophobicContact CE2-CB 4.43Å; F1221-E1232 HydrophobicContact CE2-CG 4.33Å; F1221-F1242 HydrophobicContact CE1-CE2 4.1Å; F1221-F1242 HydrophobicContact CE1-CZ 4.4Å; F1221-F1242 AromaticContact CZ-CE2 3.98Å; F1221-F1242 HydrophobicContact CZ-CE2 3.98Å; F1221-F1246 AromaticContact CE1-CD2 3.88Å; F1221-F1246 HydrophobicContact CE1-CD2 3.88Å; F1221-F1246 HydrophobicContact CZ-CB 4.35Å; F1221-F1246 HydrophobicContact CZ-CD2 4.36Å; F1221-F1249 HydrophobicContact CB-CD2 3.88Å; F1221-F1249 HydrophobicContact CB-CE2 3.78Å; F1221-F1249 HydrophobicContact CB-CG 4.4Å; F1221-F1249 HydrophobicContact CB-CZ 4.24Å; F1221-F1249 HydrophobicContact CD1-CB 4.47Å; F1221-F1249 AromaticContact CD1-CD1 3.76Å; F1221-F1249 HydrophobicContact CD1-CD1 3.76Å; F1221-F1249 HydrophobicContact CD1-CD2 4.19Å; F1221-F1249 AromaticContact CD1-CE1 3.96Å; F1221-F1249 HydrophobicContact CD1-CE1 3.96Å; F1221-F1249 HydrophobicContact CD1-CE2 4.36Å; F1221-F1249 AromaticContact CD1-CG 3.87Å; F1221-F1249 HydrophobicContact CD1-CG 3.87Å; F1221-F1249 HydrophobicContact CD1-CZ 4.24Å; F1221-F1249 HydrophobicContact CD2-CB 4.04Å; F1221-F1249 HydrophobicContact CD2-CD2 4.12Å; F1221-F1249 HydrophobicContact CD2-CG 4.04Å; F1221-F1249 HydrophobicContact CE1-CB 4.4Å; F1221-F1249 AromaticContact CE1-CD1 3.95Å; F1221-F1249 HydrophobicContact CE1-CD1 3.95Å; F1221-F1249 HydrophobicContact CE1-CE1 4.47Å; F1221-F1249 HydrophobicContact CE1-CG 4.16Å; F1221-F1249 HydrophobicContact CE2-CB 3.91Å; F1221-F1249 HydrophobicContact CE2-CG 4.28Å; F1221-F1249 HydrophobicContact CG-CB 4.33Å; F1221-F1249 HydrophobicContact CG-CD1 4.19Å; F1221-F1249 AromaticContact CG-CD2 3.8Å; F1221-F1249 HydrophobicContact CG-CD2 3.8Å; F1221-F1249 HydrophobicContact CG-CE1 4.48Å; F1221-F1249 HydrophobicContact CG-CE2 4.09Å; F1221-F1249 AromaticContact CG-CG 3.83Å; F1221-F1249 HydrophobicContact CG-CG 3.83Å; F1221-F1249 HydrophobicContact CG-CZ 4.42Å; F1221-F1249 HydrophobicContact CZ-CB 4.11Å; F1221-F1249 HydrophobicContact CZ-CD1 4.48Å; F1221-F1249 HydrophobicContact CZ-CG 4.36Å
1222	T	94.2	Very high	87.6	Confident	0 Å²	0	24.6 Å²	24.6	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	135.6	175.7	175.7	0	0	0	0	111.5	T1197 G1198 L1220 A1228 Y1310 W1311 L1314	T1197-T1222 CarbonylContact C-O 3.59Å; T1197-T1222 VanDerWaalsContact CA-O 3.32Å; T1197-T1222 WeakPolarHBondContact CA-O 2.93Å; G1198-T1222 PolarHBondContact N-O 3.29Å; G1198-T1222 PolarHBondContact O-N 2.88Å; L1220-T1222 HydrophobicContact CD2-CG2 3.91Å; T1222-A1228 CarbonylContact C-O 3.52Å; T1222-A1228 VanDerWaalsContact CA-O 3.23Å; T1222-A1228 WeakPolarHBondContact CA-O 3.46Å; T1222-Y1310 HydrophobicContact CG2-CD2 4.24Å; T1222-Y1310 HydrophobicContact CG2-CE2 3.88Å; T1222-W1311 HydrophobicContact CG2-CB 3.59Å; T1222-L1314 HydrophobicContact CG2-CD1 4.27Å; T1222-L1314 WeakPolarHBondContact OG1-CD1 3.26Å
1223	C	93.5	Very high	89.3	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	134.4	169.6	-175.5	0	0	0	0	110.3	F1194 V1225 S1226 R1227 A1228	F1194-C1223 HydrophobicContact CD1-CB 4.05Å; F1194-C1223 HydrophobicContact CE1-CB 4.29Å; F1194-C1223 HydrophobicContact CG-CB 4.34Å; F1194-C1223 PolarHBondContact N-SG 2.9Å; C1223-V1225 VanDerWaalsContact C-N 3.31Å; C1223-V1225 PolarHBondContact SG-N 3.47Å; C1223-S1226 WeakPolarHBondContact CB-OG 3.29Å; C1223-S1226 PolarHBondContact SG-N 3.38Å; C1223-S1226 VanDerWaalsContact SG-N 3.44Å; C1223-S1226 PolarHBondContact SG-OG 3.38Å; C1223-R1227 VanDerWaalsContact O-CA 3.24Å; C1223-R1227 WeakPolarHBondContact O-CA 3.29Å; C1223-R1227 PolarHBondContact O-N 2.78Å; C1223-A1228 HydrophobicContact CB-CB 4.29Å; C1223-A1228 PolarHBondContact N-O 3.3Å
1224	M	90	Very high	90.6	Very high	7 Å²	7	19.1 Å²	19.1	3%	0.034	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-30.2	177.5	-70.4	175.7	-178.2	0	0	113	E1186 R1187 R1196 T1197 Q1260 Y1310	E1186-M1224 HydrophobicContact CB-SD 3.97Å; R1187-M1224 HydrophobicContact CG-CB 4.21Å; R1196-M1224 HydrophobicContact CB-CB 4.01Å; R1196-M1224 HydrophobicContact CB-CG 4.22Å; R1196-M1224 HydrophobicContact CB-SD 3.69Å; R1196-M1224 WeakPolarHBondContact O-CB 3.26Å; R1196-M1224 PolarHBondContact O-N 3.02Å; T1197-M1224 WeakPolarHBondContact O-CE 3.41Å; M1224-Q1260 HydrophobicContact CE-CB 3.26Å; M1224-Q1260 HydrophobicContact CE-CG 4.38Å; M1224-Y1310 WeakPolarHBondContact CE-OH 3.22Å; M1224-Y1310 HydrophobicContact CG-CE2 4.05Å; M1224-Y1310 VanDerWaalsContact CG-OH 3.29Å; M1224-Y1310 WeakPolarHBondContact CG-OH 3.21Å
1225	V	89.1	Confident	91.2	Very high	46 Å²	46	21.7 Å²	21.7	28%	0.279	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.2	-62.2	-173.9	-176.1	0	0	0	0	110.7	A1191 C1223 R1227	A1191-V1225 HydrophobicContact CB-CG2 4.06Å; C1223-V1225 VanDerWaalsContact C-N 3.31Å; C1223-V1225 PolarHBondContact SG-N 3.47Å; V1225-R1227 VanDerWaalsContact C-N 3.31Å; V1225-R1227 PolarHBondContact O-N 2.96Å
1226	S	89.4	Confident	91.5	Very high	9 Å²	9	20.4 Å²	20.4	6%	0.063	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-7.7	-177.5	70.7	0	0	0	0	114.5	C1223 A1228	C1223-S1226 WeakPolarHBondContact CB-OG 3.29Å; C1223-S1226 PolarHBondContact SG-N 3.38Å; C1223-S1226 VanDerWaalsContact SG-N 3.44Å; C1223-S1226 PolarHBondContact SG-OG 3.38Å; S1226-A1228 PolarHBondContact O-N 3.04Å; S1226-A1228 WeakPolarHBondContact OG-CB 3.44Å
1227	R	89.3	Confident	91.5	Very high	17 Å²	17	21.8 Å²	21.8	6%	0.064	12%	0.121	C	C	.	.			trans	58.7	15.7	-177.5	-47.6	-76	-69.1	129.4	-2.1	114.2	D672 C1223 V1225 Y1310 R1338 L1340	D672-R1227 IonicContact OD2-CZ 2.79Å; D672-R1227 IonicContact OD2-NE 3.39Å; D672-R1227 PolarHBondContact OD2-NE 3.29Å; D672-R1227 IonicContact OD2-NH2 2.8Å; D672-R1227 PolarHBondContact OD2-NH2 2.94Å; C1223-R1227 VanDerWaalsContact O-CA 3.24Å; C1223-R1227 WeakPolarHBondContact O-CA 3.29Å; C1223-R1227 PolarHBondContact O-N 2.78Å; V1225-R1227 VanDerWaalsContact C-N 3.31Å; V1225-R1227 PolarHBondContact O-N 2.96Å; R1227-Y1310 VanDerWaalsContact NH1-CD2 3.34Å; R1227-Y1310 PolarHBondContact NH1-O 3.28Å; R1227-Y1310 PolarHBondContact NH2-O 2.98Å; R1227-R1338 VanDerWaalsContact CB-NH2 3.28Å; R1227-R1338 PolarHBondContact O-NH1 3.47Å; R1227-R1338 PolarHBondContact O-NH2 3.33Å; R1227-L1340 HydrophobicContact CB-CD2 4Å; R1227-L1340 HydrophobicContact CG-CD2 4.21Å
1228	A	93.1	Very high	91.4	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	13%	0.133	C	C	.	.			trans	-63.4	143.3	172.7	0	0	0	0	0	110.9	F1194 T1222 C1223 S1226 N1336 P1355 L1359	F1194-A1228 WeakPolarHBondContact CE1-O 3.35Å; F1194-A1228 HydrophobicContact CE2-CB 3.97Å; F1194-A1228 HydrophobicContact CZ-CB 3.9Å; T1222-A1228 CarbonylContact C-O 3.52Å; T1222-A1228 VanDerWaalsContact CA-O 3.23Å; T1222-A1228 WeakPolarHBondContact CA-O 3.46Å; C1223-A1228 HydrophobicContact CB-CB 4.29Å; C1223-A1228 PolarHBondContact N-O 3.3Å; S1226-A1228 PolarHBondContact O-N 3.04Å; S1226-A1228 WeakPolarHBondContact OG-CB 3.44Å; A1228-N1336 WeakPolarHBondContact CA-OD1 3.48Å; A1228-P1355 HydrophobicContact CB-CB 3.83Å; A1228-L1359 HydrophobicContact CB-CD1 3.98Å; A1228-L1359 HydrophobicContact CB-CD2 3.97Å; A1228-L1359 HydrophobicContact CB-CG 4.04Å
1229	I	94	Very high	91.1	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	152	175.2	64.6	159.4	0	0	0	112.1	F1221 L1231 L1314 V1318 I1335 N1336	F1221-I1229 CarbonylContact O-C 2.85Å; F1221-I1229 VanDerWaalsContact O-CA 3.29Å; F1221-I1229 WeakPolarHBondContact O-CA 3.4Å; I1229-L1231 HydrophobicContact CD1-CD1 4Å; I1229-L1231 HydrophobicContact CD1-CD2 4.07Å; I1229-L1231 HydrophobicContact CD1-CG 4.01Å; I1229-L1314 HydrophobicContact CG2-CB 4.21Å; I1229-L1314 HydrophobicContact CG2-CD1 3.74Å; I1229-L1314 HydrophobicContact CG2-CD2 4.31Å; I1229-L1314 HydrophobicContact CG2-CG 4.32Å; I1229-V1318 HydrophobicContact CD1-CG2 3.78Å; I1229-I1335 HydrophobicContact CD1-CB 3.68Å; I1229-I1335 HydrophobicContact CD1-CD1 3.79Å; I1229-I1335 HydrophobicContact CD1-CG1 4.33Å; I1229-I1335 HydrophobicContact CD1-CG2 3.5Å; I1229-I1335 HydrophobicContact CG1-CB 4.24Å; I1229-I1335 HydrophobicContact CG1-CG2 3.89Å; I1229-N1336 PolarHBondContact N-OD1 3.01Å; I1229-N1336 PolarHBondContact O-ND2 2.86Å
1230	H	95.4	Very high	90.7	Very high	5 Å²	5	30.4 Å²	30.4	2%	0.023	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	130.7	168	179.8	67.8	0	0	0	109	F1194 F1221 E1232 F1249 R1253 E1332	F1194-H1230 HydrophobicContact CE1-CB 4.24Å; F1194-H1230 HydrophobicContact CZ-CB 3.87Å; F1221-H1230 HydrophobicContact CB-CB 4.27Å; F1221-H1230 PolarHBondContact N-O 3.38Å; F1221-H1230 PolarHBondContact O-N 3.5Å; H1230-E1232 IonicContact NE2-OE1 3.74Å; H1230-E1232 PolarHBondContact NE2-OE1 2.94Å; H1230-F1249 HydrophobicContact CB-CD2 4.14Å; H1230-F1249 HydrophobicContact CB-CE2 4.45Å; H1230-F1249 AromaticContact CD2-CD2 3.5Å; H1230-R1253 HydrophobicContact CB-CG 4.47Å; H1230-E1332 WeakPolarHBondContact CA-OE2 3.18Å; H1230-E1332 IonicContact CG-OE2 3.75Å; H1230-E1332 IonicContact ND1-OE1 3.74Å; H1230-E1332 PolarHBondContact ND1-OE1 3.03Å; H1230-E1332 IonicContact ND1-OE2 2.82Å; H1230-E1332 PolarHBondContact ND1-OE2 2.67Å
1231	L	93.7	Very high	90.5	Very high	36 Å²	36	31.9 Å²	31.9	19%	0.188	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	128.4	-170.3	-57.6	-179.6	0	0	0	111	V1218 L1220 I1229 V1318 I1331 E1332	V1218-L1231 HydrophobicContact CG1-CB 3.93Å; V1218-L1231 HydrophobicContact CG1-CD2 3.78Å; V1218-L1231 HydrophobicContact CG1-CG 4.29Å; L1220-L1231 HydrophobicContact CB-CD2 4.04Å; L1220-L1231 HydrophobicContact CD1-CD2 3.93Å; L1220-L1231 HydrophobicContact CG-CD2 3.88Å; I1229-L1231 HydrophobicContact CD1-CD1 4Å; I1229-L1231 HydrophobicContact CD1-CD2 4.07Å; I1229-L1231 HydrophobicContact CD1-CG 4.01Å; L1231-V1318 HydrophobicContact CD1-CG1 4.02Å; L1231-V1318 HydrophobicContact CD1-CG2 3.98Å; L1231-V1318 HydrophobicContact CD2-CG1 4.49Å; L1231-V1318 HydrophobicContact CD2-CG2 3.97Å; L1231-I1331 HydrophobicContact CD1-CG2 4.34Å; L1231-E1332 HydrophobicContact CD1-CB 4.36Å; L1231-E1332 HydrophobicContact CG-CB 4.48Å; L1231-E1332 PolarHBondContact N-OE2 2.99Å
1232	E	93.5	Very high	90.3	Very high	28 Å²	28	31.9 Å²	31.9	13%	0.131	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	122.6	179.1	-81.4	-69.3	164.3	0	0	110.5	V1218 C1219 F1221 H1230 V1234 A1245 R1248	V1218-E1232 CarbonylContact C-O 3.56Å; V1218-E1232 WeakPolarHBondContact CA-O 3.39Å; C1219-E1232 HydrophobicContact CB-CB 4.14Å; C1219-E1232 PolarHBondContact N-O 2.65Å; C1219-E1232 PolarHBondContact O-N 3.09Å; F1221-E1232 HydrophobicContact CE2-CB 4.43Å; F1221-E1232 HydrophobicContact CE2-CG 4.33Å; H1230-E1232 IonicContact NE2-OE1 3.74Å; H1230-E1232 PolarHBondContact NE2-OE1 2.94Å; E1232-V1234 PolarHBondContact O-N 2.65Å; E1232-A1245 HydrophobicContact CB-CB 3.75Å; E1232-A1245 HydrophobicContact CG-CB 4.16Å; E1232-R1248 WeakPolarHBondContact OE1-CB 3.39Å; E1232-R1248 IonicContact OE1-NE 2.86Å; E1232-R1248 IonicContact OE2-CZ 3.22Å; E1232-R1248 IonicContact OE2-NE 2.7Å; E1232-R1248 PolarHBondContact OE2-NE 3.19Å; E1232-R1248 IonicContact OE2-NH2 2.59Å; E1232-R1248 PolarHBondContact OE2-NH2 3.01Å
1233	L	89.7	Confident	90.1	Very high	98 Å²	98	33.3 Å²	33.3	51%	0.513	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	122.6	178.1	-166	72.6	0	0	0	109.9	V1216 V1218	V1216-L1233 HydrophobicContact CB-CD1 4.21Å; V1216-L1233 HydrophobicContact CB-CG 4.46Å; V1216-L1233 HydrophobicContact CG2-CD1 3.82Å; V1216-L1233 HydrophobicContact CG2-CG 4.43Å; V1218-L1233 HydrophobicContact CG2-CD1 4.03Å
1234	V	90.2	Very high	90	Very high	2 Å²	2	37 Å²	37	1%	0.012	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	139.6	179.4	-59.7	0	0	0	0	111.5	F1201 V1216 Y1217 C1219 E1232 S1236 N1241 A1245	F1201-V1234 HydrophobicContact CD1-CG2 4.28Å; F1201-V1234 HydrophobicContact CE1-CG2 3.81Å; V1216-V1234 WeakPolarHBondContact CA-O 3.46Å; Y1217-V1234 PolarHBondContact N-O 3.32Å; Y1217-V1234 WeakPolarHBondContact O-CG2 3.36Å; Y1217-V1234 PolarHBondContact O-N 2.93Å; C1219-V1234 HydrophobicContact CB-CG1 4.21Å; E1232-V1234 PolarHBondContact O-N 2.65Å; V1234-S1236 VanDerWaalsContact C-N 3.35Å; V1234-N1241 HydrophobicContact CB-CB 4.34Å; V1234-A1245 HydrophobicContact CG1-CB 3.76Å
1235	P	87.3	Confident	90.1	Very high	83 Å²	83	36.7 Å²	36.7	54%	0.539	20%	0.201	S	C	.	.	S	Bend	trans	-77.7	-20.4	-178.1	29.3	-32.1	0	0	0	113.2
1236	S	86.4	Confident	90.3	Very high	39 Å²	39	35.1 Å²	35.1	27%	0.273	19%	0.19	S	C	.	.	S	Bend	trans	-153.8	162.1	174.4	72.3	0	0	0	0	111.2	V1234 T1238 N1241	V1234-S1236 VanDerWaalsContact C-N 3.35Å; S1236-T1238 PolarHBondContact O-N 3.26Å; S1236-T1238 VanDerWaalsContact O-N 3.14Å; S1236-T1238 VanDerWaalsContact OG-CG2 3.32Å; S1236-T1238 WeakPolarHBondContact OG-CG2 3.39Å; S1236-T1238 PolarHBondContact OG-OG1 3.34Å; S1236-T1238 VanDerWaalsContact OG-OG1 3.07Å; S1236-N1241 WeakPolarHBondContact O-CB 3.45Å; S1236-N1241 PolarHBondContact OG-ND2 2.71Å
1237	L	88.1	Confident	90.3	Very high	42 Å²	42	43.8 Å²	43.8	22%	0.22	22%	0.222	C	C	.	.			trans	-80.2	22.9	179.3	-59.5	178.9	0	0	0	113.4	F1201 Y1217 F1264 S1266	F1201-L1237 HydrophobicContact CB-CD2 3.7Å; F1201-L1237 HydrophobicContact CD1-CD2 3.49Å; F1201-L1237 VanDerWaalsContact CD1-CD2 3.49Å; F1201-L1237 HydrophobicContact CD2-CD2 3.6Å; F1201-L1237 HydrophobicContact CE1-CD2 3.9Å; F1201-L1237 HydrophobicContact CE2-CD2 3.98Å; F1201-L1237 HydrophobicContact CG-CD2 3.32Å; F1201-L1237 HydrophobicContact CZ-CD2 4.12Å; Y1217-L1237 HydrophobicContact CD1-CD1 4.01Å; Y1217-L1237 HydrophobicContact CD1-CD2 3.48Å; Y1217-L1237 VanDerWaalsContact CD1-CD2 3.48Å; Y1217-L1237 HydrophobicContact CD1-CG 3.8Å; Y1217-L1237 HydrophobicContact CD2-CD2 3.94Å; Y1217-L1237 HydrophobicContact CD2-CG 3.93Å; Y1217-L1237 HydrophobicContact CE1-CD1 3.58Å; Y1217-L1237 HydrophobicContact CE1-CD2 3.93Å; Y1217-L1237 HydrophobicContact CE1-CG 3.71Å; Y1217-L1237 HydrophobicContact CE2-CD1 4.48Å; Y1217-L1237 HydrophobicContact CE2-CD2 4.38Å; Y1217-L1237 HydrophobicContact CE2-CG 3.89Å; Y1217-L1237 HydrophobicContact CG-CD2 3.45Å; Y1217-L1237 VanDerWaalsContact CG-CD2 3.45Å; Y1217-L1237 HydrophobicContact CG-CG 3.88Å; L1237-F1264 HydrophobicContact CB-CE1 3.9Å; L1237-F1264 HydrophobicContact CB-CZ 3.8Å; L1237-F1264 HydrophobicContact CD1-CZ 3.96Å; L1237-F1264 HydrophobicContact CG-CZ 4.48Å; L1237-S1266 VanDerWaalsContact O-CB 3.26Å; L1237-S1266 WeakPolarHBondContact O-CB 3.35Å; L1237-S1266 PolarHBondContact O-OG 2.99Å
1238	T	88.1	Confident	90.6	Very high	63 Å²	63	47.9 Å²	47.9	39%	0.387	24%	0.237	S	C	.	.			trans	-75.3	153	-178.3	54.4	0	0	0	0	111.5	S1236 Q1240 N1241 F1242	S1236-T1238 PolarHBondContact O-N 3.26Å; S1236-T1238 VanDerWaalsContact O-N 3.14Å; S1236-T1238 VanDerWaalsContact OG-CG2 3.32Å; S1236-T1238 WeakPolarHBondContact OG-CG2 3.39Å; S1236-T1238 PolarHBondContact OG-OG1 3.34Å; S1236-T1238 VanDerWaalsContact OG-OG1 3.07Å; T1238-Q1240 VanDerWaalsContact C-N 3.28Å; T1238-Q1240 PolarHBondContact O-N 2.92Å; T1238-N1241 PolarHBondContact O-N 3.06Å; T1238-N1241 PolarHBondContact OG1-ND2 3.06Å; T1238-F1242 PolarHBondContact O-N 2.65Å
1239	T	83.6	Confident	90.7	Very high	22 Å²	22	47.9 Å²	47.9	14%	0.135	24%	0.237	C	C	.	.	H	α-helix	trans	-52.6	-45.2	175.7	-47.4	0	0	0	0	112	N1241 F1242 L1243 T1269 A1270 E1273	T1239-N1241 PolarHBondContact O-N 2.76Å; T1239-F1242 WeakPolarHBondContact O-CB 3.5Å; T1239-F1242 PolarHBondContact O-N 3.03Å; T1239-L1243 HydrophobicContact CG2-CD1 4.16Å; T1239-L1243 HydrophobicContact CG2-CG 4.43Å; T1239-L1243 WeakPolarHBondContact O-CG 3.46Å; T1239-L1243 PolarHBondContact O-N 2.75Å; T1239-T1269 HydrophobicContact CG2-CG2 3.98Å; T1239-A1270 HydrophobicContact CG2-CB 3.84Å; T1239-E1273 WeakPolarHBondContact CG2-OE1 3Å
1240	Q	85.2	Confident	90.5	Very high	142 Å²	142	49.8 Å²	49.8	66%	0.664	25%	0.249	S	C	*	.	H	α-helix	trans	-60.7	-45.4	179.4	-172.4	-179.2	5.1	0	0	112.8	T1238 F1242 L1243 L1244	T1238-Q1240 VanDerWaalsContact C-N 3.28Å; T1238-Q1240 PolarHBondContact O-N 2.92Å; Q1240-F1242 VanDerWaalsContact C-N 3.32Å; Q1240-F1242 PolarHBondContact O-N 3.09Å; Q1240-L1243 PolarHBondContact O-N 3.46Å; Q1240-L1244 WeakPolarHBondContact O-CG 3.27Å; Q1240-L1244 PolarHBondContact O-N 3.38Å
1241	N	90.5	Very high	90.3	Very high	31 Å²	31	53.8 Å²	53.8	17%	0.166	28%	0.283	C	S	.	.	H	α-helix	trans	-67.4	-35.7	177.9	-80.4	-31.3	0	0	0	112.3	V1234 S1236 T1238 T1239 A1245	V1234-N1241 HydrophobicContact CB-CB 4.34Å; S1236-N1241 WeakPolarHBondContact O-CB 3.45Å; S1236-N1241 PolarHBondContact OG-ND2 2.71Å; T1238-N1241 PolarHBondContact O-N 3.06Å; T1238-N1241 PolarHBondContact OG1-ND2 3.06Å; T1239-N1241 PolarHBondContact O-N 2.76Å; N1241-A1245 WeakPolarHBondContact O-CB 3.11Å; N1241-A1245 PolarHBondContact O-N 2.84Å
1242	F	92.3	Very high	90.3	Very high	0 Å²	0	61 Å²	61	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-60.7	-50.5	170.3	173.4	-100.5	0	0	0	111.3	V1199 F1201 F1221 T1238 T1239 Q1240 L1244 A1245 F1246 M1259 F1267 A1270 W1297	V1199-F1242 HydrophobicContact CG1-CE2 3.76Å; V1199-F1242 HydrophobicContact CG1-CZ 4.38Å; F1201-F1242 HydrophobicContact CZ-CB 4.1Å; F1201-F1242 HydrophobicContact CZ-CD2 4.02Å; F1201-F1242 HydrophobicContact CZ-CG 4.46Å; F1221-F1242 HydrophobicContact CE1-CE2 4.1Å; F1221-F1242 HydrophobicContact CE1-CZ 4.4Å; F1221-F1242 AromaticContact CZ-CE2 3.98Å; F1221-F1242 HydrophobicContact CZ-CE2 3.98Å; T1238-F1242 PolarHBondContact O-N 2.65Å; T1239-F1242 WeakPolarHBondContact O-CB 3.5Å; T1239-F1242 PolarHBondContact O-N 3.03Å; Q1240-F1242 VanDerWaalsContact C-N 3.32Å; Q1240-F1242 PolarHBondContact O-N 3.09Å; F1242-L1244 VanDerWaalsContact C-N 3.27Å; F1242-L1244 PolarHBondContact O-N 2.77Å; F1242-A1245 CarbonylContact O-C 3.58Å; F1242-A1245 WeakPolarHBondContact O-CA 3.3Å; F1242-A1245 WeakPolarHBondContact O-CB 3.23Å; F1242-A1245 PolarHBondContact O-N 2.89Å; F1242-F1246 HydrophobicContact CE1-CB 4.11Å; F1242-F1246 HydrophobicContact CE1-CG 4.45Å; F1242-F1246 HydrophobicContact CZ-CB 4.09Å; F1242-F1246 HydrophobicContact CZ-CD2 4.39Å; F1242-F1246 HydrophobicContact CZ-CG 4.38Å; F1242-F1246 WeakPolarHBondContact O-CB 3.49Å; F1242-F1246 PolarHBondContact O-N 3.26Å; F1242-M1259 HydrophobicContact CZ-CE 4.28Å; F1242-F1267 AromaticContact CD2-CD1 4Å; F1242-F1267 HydrophobicContact CD2-CD1 4Å; F1242-F1267 AromaticContact CD2-CE1 3.59Å; F1242-F1267 HydrophobicContact CD2-CE1 3.59Å; F1242-F1267 AromaticContact CE2-CD1 3.99Å; F1242-F1267 HydrophobicContact CE2-CD1 3.99Å; F1242-F1267 AromaticContact CE2-CE1 3.65Å; F1242-F1267 HydrophobicContact CE2-CE1 3.65Å; F1242-F1267 HydrophobicContact CG-CD1 4.25Å; F1242-F1267 HydrophobicContact CG-CE1 4.23Å; F1242-F1267 HydrophobicContact CZ-CD1 4.23Å; F1242-F1267 HydrophobicContact CZ-CE1 4.33Å; F1242-A1270 HydrophobicContact CD1-CB 3.44Å; F1242-A1270 VanDerWaalsContact CD1-CB 3.44Å; F1242-A1270 HydrophobicContact CE1-CB 3.65Å; F1242-W1297 HydrophobicContact CD1-CH2 4.44Å; F1242-W1297 AromaticContact CE1-CH2 3.42Å; F1242-W1297 HydrophobicContact CE1-CH2 3.42Å; F1242-W1297 VanDerWaalsContact CE1-CH2 3.42Å; F1242-W1297 HydrophobicContact CE1-CZ2 4.45Å; F1242-W1297 HydrophobicContact CE1-CZ3 4.04Å; F1242-W1297 AromaticContact CZ-CH2 3.56Å; F1242-W1297 HydrophobicContact CZ-CH2 3.56Å; F1242-W1297 HydrophobicContact CZ-CZ2 4.24Å; F1242-W1297 HydrophobicContact CZ-CZ3 4.4Å
1243	L	89.7	Confident	90.2	Very high	30 Å²	30	62.5 Å²	62.5	16%	0.157	31%	0.312	C	S	.	.	H	α-helix	trans	-60.8	-36.4	-179.6	-72.1	173.5	0	0	0	112.3	T1239 Q1240 F1246 R1247 A1270 E1273 L1274	T1239-L1243 HydrophobicContact CG2-CD1 4.16Å; T1239-L1243 HydrophobicContact CG2-CG 4.43Å; T1239-L1243 WeakPolarHBondContact O-CG 3.46Å; T1239-L1243 PolarHBondContact O-N 2.75Å; Q1240-L1243 PolarHBondContact O-N 3.46Å; L1243-F1246 PolarHBondContact O-N 3.21Å; L1243-R1247 WeakPolarHBondContact O-CB 3.12Å; L1243-R1247 PolarHBondContact O-N 3.06Å; L1243-A1270 HydrophobicContact CD2-CB 4.06Å; L1243-A1270 HydrophobicContact CG-CB 4.41Å; L1243-E1273 HydrophobicContact CD1-CB 4.38Å; L1243-E1273 WeakPolarHBondContact CD1-OE2 3.34Å; L1243-L1274 HydrophobicContact CD2-CD1 4.44Å; L1243-L1274 HydrophobicContact CD2-CD2 4.1Å; L1243-L1274 HydrophobicContact CD2-CG 4.02Å
1244	L	90.8	Very high	90.2	Very high	78 Å²	78	59.6 Å²	59.6	41%	0.408	31%	0.306	S	S	.	.	H	α-helix	trans	-65.9	-42.4	172.9	-70.3	173.5	0	0	0	112.2	Q1240 F1242 R1247 R1248	Q1240-L1244 WeakPolarHBondContact O-CG 3.27Å; Q1240-L1244 PolarHBondContact O-N 3.38Å; F1242-L1244 VanDerWaalsContact C-N 3.27Å; F1242-L1244 PolarHBondContact O-N 2.77Å; L1244-R1247 PolarHBondContact O-N 2.62Å; L1244-R1248 WeakPolarHBondContact O-CG 3.46Å; L1244-R1248 PolarHBondContact O-N 3.22Å; L1244-R1248 PolarHBondContact O-NH1 3.16Å
1245	A	92.6	Very high	90.1	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-64	-44.7	173.8	0	0	0	0	0	111.6	C1219 E1232 V1234 N1241 F1242 R1247 R1248 F1249	C1219-A1245 HydrophobicContact CB-CB 4.25Å; E1232-A1245 HydrophobicContact CB-CB 3.75Å; E1232-A1245 HydrophobicContact CG-CB 4.16Å; V1234-A1245 HydrophobicContact CG1-CB 3.76Å; N1241-A1245 WeakPolarHBondContact O-CB 3.11Å; N1241-A1245 PolarHBondContact O-N 2.84Å; F1242-A1245 CarbonylContact O-C 3.58Å; F1242-A1245 WeakPolarHBondContact O-CA 3.3Å; F1242-A1245 WeakPolarHBondContact O-CB 3.23Å; F1242-A1245 PolarHBondContact O-N 2.89Å; A1245-R1247 VanDerWaalsContact C-N 3.34Å; A1245-R1247 PolarHBondContact O-N 2.99Å; A1245-R1248 PolarHBondContact O-N 2.95Å; A1245-R1248 VanDerWaalsContact O-N 3.16Å; A1245-F1249 PolarHBondContact O-N 3.49Å
1246	F	93.6	Very high	90.3	Very high	13 Å²	13	58.7 Å²	58.7	6%	0.057	29%	0.291	C	S	.	.	H	α-helix	trans	-59.6	-43	176.4	-179.1	-113.9	0	0	0	111.8	F1221 F1242 L1243 R1248 F1249 V1250 P1256 M1259 L1274 I1295	F1221-F1246 AromaticContact CE1-CD2 3.88Å; F1221-F1246 HydrophobicContact CE1-CD2 3.88Å; F1221-F1246 HydrophobicContact CZ-CB 4.35Å; F1221-F1246 HydrophobicContact CZ-CD2 4.36Å; F1242-F1246 HydrophobicContact CE1-CB 4.11Å; F1242-F1246 HydrophobicContact CE1-CG 4.45Å; F1242-F1246 HydrophobicContact CZ-CB 4.09Å; F1242-F1246 HydrophobicContact CZ-CD2 4.39Å; F1242-F1246 HydrophobicContact CZ-CG 4.38Å; F1242-F1246 WeakPolarHBondContact O-CB 3.49Å; F1242-F1246 PolarHBondContact O-N 3.26Å; L1243-F1246 PolarHBondContact O-N 3.21Å; F1246-R1248 VanDerWaalsContact C-N 3.34Å; F1246-R1248 PolarHBondContact O-N 3.37Å; F1246-F1249 AromaticContact CD2-CD1 3.91Å; F1246-F1249 HydrophobicContact CD2-CD1 3.91Å; F1246-F1249 AromaticContact CE2-CD1 3.97Å; F1246-F1249 HydrophobicContact CE2-CD1 3.97Å; F1246-F1249 HydrophobicContact CE2-CE1 4.21Å; F1246-F1249 WeakPolarHBondContact O-CB 3.35Å; F1246-F1249 PolarHBondContact O-N 3.29Å; F1246-V1250 HydrophobicContact CD1-CG2 4.33Å; F1246-V1250 HydrophobicContact CD2-CG2 4.17Å; F1246-V1250 HydrophobicContact CE1-CG2 3.86Å; F1246-V1250 HydrophobicContact CE2-CG2 3.68Å; F1246-V1250 HydrophobicContact CG-CG2 4.47Å; F1246-V1250 HydrophobicContact CZ-CG2 3.5Å; F1246-V1250 WeakPolarHBondContact O-CG2 3.06Å; F1246-V1250 PolarHBondContact O-N 3.4Å; F1246-P1256 HydrophobicContact CE2-CG 4.16Å; F1246-P1256 HydrophobicContact CZ-CG 4.31Å; F1246-M1259 HydrophobicContact CD2-SD 4.21Å; F1246-M1259 HydrophobicContact CE2-CE 4.33Å; F1246-M1259 HydrophobicContact CE2-SD 3.42Å; F1246-M1259 WeakPolarHBondContact CE2-SD 3.47Å; F1246-M1259 HydrophobicContact CZ-SD 3.96Å; F1246-L1274 HydrophobicContact CD1-CD1 4.31Å; F1246-L1274 HydrophobicContact CD1-CD2 4.45Å; F1246-L1274 HydrophobicContact CE1-CD1 3.96Å; F1246-L1274 HydrophobicContact CE1-CD2 4.2Å; F1246-I1295 HydrophobicContact CE1-CD1 4.18Å; F1246-I1295 HydrophobicContact CZ-CD1 3.62Å
1247	R	89.8	Confident	90.4	Very high	191 Å²	191	59.8 Å²	59.8	72%	0.721	29%	0.294	S	S	*	.	H	α-helix	trans	-60.1	-42.1	175.1	-174.1	176.5	-179	173.3	1.7	112.1	L1243 L1244 A1245 A1251	L1243-R1247 WeakPolarHBondContact O-CB 3.12Å; L1243-R1247 PolarHBondContact O-N 3.06Å; L1244-R1247 PolarHBondContact O-N 2.62Å; A1245-R1247 VanDerWaalsContact C-N 3.34Å; A1245-R1247 PolarHBondContact O-N 2.99Å; R1247-A1251 VanDerWaalsContact O-CB 3.3Å; R1247-A1251 WeakPolarHBondContact O-CB 3.34Å; R1247-A1251 PolarHBondContact O-N 2.78Å
1248	R	94.9	Very high	90.4	Very high	102 Å²	102	58.9 Å²	58.9	39%	0.385	29%	0.291	S	S	.	.	H	α-helix	trans	-67.2	-41.7	176.2	-70.4	-171.5	-60.5	-86.9	2.2	112	E1232 L1244 A1245 F1246 A1251 R1252	E1232-R1248 WeakPolarHBondContact OE1-CB 3.39Å; E1232-R1248 IonicContact OE1-NE 2.86Å; E1232-R1248 IonicContact OE2-CZ 3.22Å; E1232-R1248 IonicContact OE2-NE 2.7Å; E1232-R1248 PolarHBondContact OE2-NE 3.19Å; E1232-R1248 IonicContact OE2-NH2 2.59Å; E1232-R1248 PolarHBondContact OE2-NH2 3.01Å; L1244-R1248 WeakPolarHBondContact O-CG 3.46Å; L1244-R1248 PolarHBondContact O-N 3.22Å; L1244-R1248 PolarHBondContact O-NH1 3.16Å; A1245-R1248 PolarHBondContact O-N 2.95Å; A1245-R1248 VanDerWaalsContact O-N 3.16Å; F1246-R1248 VanDerWaalsContact C-N 3.34Å; F1246-R1248 PolarHBondContact O-N 3.37Å; R1248-A1251 PolarHBondContact O-N 2.86Å; R1248-R1252 WeakPolarHBondContact O-CB 3.44Å; R1248-R1252 PolarHBondContact O-N 2.95Å; R1248-R1252 VanDerWaalsContact O-N 3.13Å
1249	F	95	Very high	90.5	Very high	0 Å²	0	56 Å²	56	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-56.9	-53.7	172.8	162.9	-108.2	0	0	0	111.5	F1194 T1197 F1221 H1230 A1245 F1246 A1251 R1252 R1253 P1256	F1194-F1249 HydrophobicContact CB-CE2 4.14Å; F1194-F1249 HydrophobicContact CB-CZ 3.9Å; F1194-F1249 AromaticContact CD1-CE2 3.48Å; F1194-F1249 HydrophobicContact CD1-CE2 3.48Å; F1194-F1249 VanDerWaalsContact CD1-CE2 3.48Å; F1194-F1249 AromaticContact CD1-CZ 3.74Å; F1194-F1249 HydrophobicContact CD1-CZ 3.74Å; F1194-F1249 HydrophobicContact CD2-CE2 4.43Å; F1194-F1249 AromaticContact CE1-CE2 3.88Å; F1194-F1249 HydrophobicContact CE1-CE2 3.88Å; F1194-F1249 AromaticContact CG-CE2 3.78Å; F1194-F1249 HydrophobicContact CG-CE2 3.78Å; F1194-F1249 HydrophobicContact CG-CZ 4.01Å; T1197-F1249 HydrophobicContact CG2-CE1 4.38Å; T1197-F1249 HydrophobicContact CG2-CZ 3.92Å; F1221-F1249 HydrophobicContact CB-CD2 3.88Å; F1221-F1249 HydrophobicContact CB-CE2 3.78Å; F1221-F1249 HydrophobicContact CB-CG 4.4Å; F1221-F1249 HydrophobicContact CB-CZ 4.24Å; F1221-F1249 HydrophobicContact CD1-CB 4.47Å; F1221-F1249 AromaticContact CD1-CD1 3.76Å; F1221-F1249 HydrophobicContact CD1-CD1 3.76Å; F1221-F1249 HydrophobicContact CD1-CD2 4.19Å; F1221-F1249 AromaticContact CD1-CE1 3.96Å; F1221-F1249 HydrophobicContact CD1-CE1 3.96Å; F1221-F1249 HydrophobicContact CD1-CE2 4.36Å; F1221-F1249 AromaticContact CD1-CG 3.87Å; F1221-F1249 HydrophobicContact CD1-CG 3.87Å; F1221-F1249 HydrophobicContact CD1-CZ 4.24Å; F1221-F1249 HydrophobicContact CD2-CB 4.04Å; F1221-F1249 HydrophobicContact CD2-CD2 4.12Å; F1221-F1249 HydrophobicContact CD2-CG 4.04Å; F1221-F1249 HydrophobicContact CE1-CB 4.4Å; F1221-F1249 AromaticContact CE1-CD1 3.95Å; F1221-F1249 HydrophobicContact CE1-CD1 3.95Å; F1221-F1249 HydrophobicContact CE1-CE1 4.47Å; F1221-F1249 HydrophobicContact CE1-CG 4.16Å; F1221-F1249 HydrophobicContact CE2-CB 3.91Å; F1221-F1249 HydrophobicContact CE2-CG 4.28Å; F1221-F1249 HydrophobicContact CG-CB 4.33Å; F1221-F1249 HydrophobicContact CG-CD1 4.19Å; F1221-F1249 AromaticContact CG-CD2 3.8Å; F1221-F1249 HydrophobicContact CG-CD2 3.8Å; F1221-F1249 HydrophobicContact CG-CE1 4.48Å; F1221-F1249 HydrophobicContact CG-CE2 4.09Å; F1221-F1249 AromaticContact CG-CG 3.83Å; F1221-F1249 HydrophobicContact CG-CG 3.83Å; F1221-F1249 HydrophobicContact CG-CZ 4.42Å; F1221-F1249 HydrophobicContact CZ-CB 4.11Å; F1221-F1249 HydrophobicContact CZ-CD1 4.48Å; F1221-F1249 HydrophobicContact CZ-CG 4.36Å; H1230-F1249 HydrophobicContact CB-CD2 4.14Å; H1230-F1249 HydrophobicContact CB-CE2 4.45Å; H1230-F1249 AromaticContact CD2-CD2 3.5Å; A1245-F1249 PolarHBondContact O-N 3.49Å; F1246-F1249 AromaticContact CD2-CD1 3.91Å; F1246-F1249 HydrophobicContact CD2-CD1 3.91Å; F1246-F1249 AromaticContact CE2-CD1 3.97Å; F1246-F1249 HydrophobicContact CE2-CD1 3.97Å; F1246-F1249 HydrophobicContact CE2-CE1 4.21Å; F1246-F1249 WeakPolarHBondContact O-CB 3.35Å; F1246-F1249 PolarHBondContact O-N 3.29Å; F1249-A1251 VanDerWaalsContact C-N 3.32Å; F1249-A1251 PolarHBondContact O-N 3.37Å; F1249-R1252 PolarHBondContact O-N 2.86Å; F1249-R1253 HydrophobicContact CD2-CB 3.93Å; F1249-R1253 HydrophobicContact CD2-CG 3.71Å; F1249-R1253 HydrophobicContact CE2-CB 3.65Å; F1249-R1253 HydrophobicContact CE2-CG 3.7Å; F1249-R1253 HydrophobicContact CZ-CB 4.29Å; F1249-R1253 WeakPolarHBondContact O-CB 3.35Å; F1249-R1253 PolarHBondContact O-N 2.82Å; F1249-P1256 HydrophobicContact CE1-CG 4.26Å
1250	V	90.6	Very high	90.9	Very high	41 Å²	41	56.4 Å²	56.4	25%	0.248	27%	0.273	C	S	.	.	H	α-helix	trans	-60.8	-41.6	179.6	171.1	0	0	0	0	111.3	F1246 R1252 G1254 R1255	F1246-V1250 HydrophobicContact CD1-CG2 4.33Å; F1246-V1250 HydrophobicContact CD2-CG2 4.17Å; F1246-V1250 HydrophobicContact CE1-CG2 3.86Å; F1246-V1250 HydrophobicContact CE2-CG2 3.68Å; F1246-V1250 HydrophobicContact CG-CG2 4.47Å; F1246-V1250 HydrophobicContact CZ-CG2 3.5Å; F1246-V1250 WeakPolarHBondContact O-CG2 3.06Å; F1246-V1250 PolarHBondContact O-N 3.4Å; V1250-R1252 PolarHBondContact O-N 2.86Å; V1250-G1254 CarbonylContact O-C 3.51Å; V1250-G1254 VanDerWaalsContact O-CA 3.26Å; V1250-G1254 WeakPolarHBondContact O-CA 3.49Å; V1250-G1254 PolarHBondContact O-N 2.99Å; V1250-R1255 HydrophobicContact CG1-CB 4.26Å
1251	A	90.7	Very high	91.2	Very high	89 Å²	89	49.6 Å²	49.6	74%	0.736	24%	0.242	S	C	*	.	H	α-helix	trans	-62.1	-26.9	177.2	0	0	0	0	0	113.2	R1247 R1248 F1249	R1247-A1251 VanDerWaalsContact O-CB 3.3Å; R1247-A1251 WeakPolarHBondContact O-CB 3.34Å; R1247-A1251 PolarHBondContact O-N 2.78Å; R1248-A1251 PolarHBondContact O-N 2.86Å; F1249-A1251 VanDerWaalsContact C-N 3.32Å; F1249-A1251 PolarHBondContact O-N 3.37Å
1252	R	93	Very high	91.1	Very high	186 Å²	186	50.6 Å²	50.6	70%	0.702	25%	0.247	S	C	*	.	H	α-helix	trans	-101.6	-30.2	-176.8	-165.6	162.9	-179.1	99	-3.3	114.3	R1248 F1249 V1250	R1248-R1252 WeakPolarHBondContact O-CB 3.44Å; R1248-R1252 PolarHBondContact O-N 2.95Å; R1248-R1252 VanDerWaalsContact O-N 3.13Å; F1249-R1252 PolarHBondContact O-N 2.86Å; V1250-R1252 PolarHBondContact O-N 2.86Å
1253	R	92.9	Very high	90.7	Very high	60 Å²	60	52.9 Å²	52.9	23%	0.226	26%	0.259	C	S	.	.	H	α-helix	trans	-115.2	-9	-173.1	-57.6	-55.4	-175.2	-179.1	2.6	113.8	F1194 H1230 F1249 E1332	F1194-R1253 HydrophobicContact CB-CB 4.23Å; F1194-R1253 HydrophobicContact CD2-CB 3.82Å; F1194-R1253 HydrophobicContact CD2-CG 3.84Å; F1194-R1253 HydrophobicContact CE2-CB 4.4Å; F1194-R1253 HydrophobicContact CE2-CG 3.9Å; F1194-R1253 HydrophobicContact CG-CB 4.13Å; F1194-R1253 HydrophobicContact CG-CG 4.4Å; H1230-R1253 HydrophobicContact CB-CG 4.47Å; F1249-R1253 HydrophobicContact CD2-CB 3.93Å; F1249-R1253 HydrophobicContact CD2-CG 3.71Å; F1249-R1253 HydrophobicContact CE2-CB 3.65Å; F1249-R1253 HydrophobicContact CE2-CG 3.7Å; F1249-R1253 HydrophobicContact CZ-CB 4.29Å; F1249-R1253 WeakPolarHBondContact O-CB 3.35Å; F1249-R1253 PolarHBondContact O-N 2.82Å; R1253-E1332 IonicContact CZ-OE1 3.62Å; R1253-E1332 IonicContact NH2-OE1 3.57Å; R1253-E1332 PolarHBondContact NH2-OE1 2.8Å
1254	G	88.8	Confident	90.4	Very high	37 Å²	37	54.7 Å²	54.7	38%	0.381	27%	0.266	S	S	.	.			trans	87.8	167.5	-171.6	0	0	0	0	0	112.5	V1250	V1250-G1254 CarbonylContact O-C 3.51Å; V1250-G1254 VanDerWaalsContact O-CA 3.26Å; V1250-G1254 WeakPolarHBondContact O-CA 3.49Å; V1250-G1254 PolarHBondContact O-N 2.99Å
1255	R	87.8	Confident	90.1	Very high	67 Å²	67	60.8 Å²	60.8	25%	0.253	28%	0.284	S	S	.	.			trans	-75.2	130	179.2	-173.5	-173.6	72.6	78.7	6	109.8	V1250 D1257 D1293 R1294 I1295	V1250-R1255 HydrophobicContact CG1-CB 4.26Å; R1255-D1257 IonicContact NH2-OD1 3.35Å; R1255-D1257 PolarHBondContact NH2-OD1 3.18Å; R1255-D1293 IonicContact CZ-OD2 2.69Å; R1255-D1293 IonicContact NE-OD2 3.24Å; R1255-D1293 PolarHBondContact NH1-O 2.75Å; R1255-D1293 IonicContact NH2-OD1 2.81Å; R1255-D1293 IonicContact NH2-OD2 3.38Å; R1255-D1293 PolarHBondContact NH2-OD2 3.43Å; R1255-R1294 VanDerWaalsContact NH1-C 3.27Å; R1255-R1294 PolarHBondContact NH1-O 3.12Å; R1255-I1295 HydrophobicContact CG-CD1 3.91Å; R1255-I1295 HydrophobicContact CG-CG1 4.09Å
1256	P	91.4	Very high	89.7	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	29%	0.289	C	S	.	.			trans	-74.4	147	171	30.1	-33	0	0	0	111.1	F1194 Q1195 F1246 F1249 M1259 I1295	F1194-P1256 WeakPolarHBondContact O-CB 3.49Å; Q1195-P1256 CarbonylContact O-C 3.52Å; F1246-P1256 HydrophobicContact CE2-CG 4.16Å; F1246-P1256 HydrophobicContact CZ-CG 4.31Å; F1249-P1256 HydrophobicContact CE1-CG 4.26Å; P1256-M1259 HydrophobicContact CB-CG 4.14Å; P1256-M1259 HydrophobicContact CG-CG 3.79Å; P1256-M1259 HydrophobicContact CG-SD 3.81Å; P1256-I1295 HydrophobicContact CG-CD1 4.21Å; P1256-I1295 HydrophobicContact CG-CG2 4.25Å; P1256-I1295 WeakPolarHBondContact O-CG1 3.28Å
1257	D	87.9	Confident	89.4	Confident	62 Å²	62	61 Å²	61	33%	0.332	29%	0.286	S	S	.	.	S	Bend	trans	-79.4	-38.5	169.7	-72.9	-20.9	0	0	0	111.3	Q1195 R1255 I1295 T1296	Q1195-D1257 HydrophobicContact CG-CB 4.1Å; Q1195-D1257 WeakPolarHBondContact CG-OD2 3.33Å; Q1195-D1257 PolarHBondContact NE2-OD2 3.45Å; Q1195-D1257 PolarHBondContact O-N 3.34Å; R1255-D1257 IonicContact NH2-OD1 3.35Å; R1255-D1257 PolarHBondContact NH2-OD1 3.18Å; D1257-I1295 WeakPolarHBondContact O-CA 3.36Å; D1257-T1296 PolarHBondContact O-N 2.93Å
1258	C	89.5	Confident	89.2	Confident	22 Å²	22	57.1 Å²	57.1	15%	0.149	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	146.3	174.9	73.3	0	0	0	0	112.7	Q1195 T1197 T1296	Q1195-C1258 PolarHBondContact O-N 2.84Å; T1197-C1258 PolarHBondContact N-O 2.6Å; C1258-T1296 CarbonylContact C-O 3.53Å; C1258-T1296 WeakPolarHBondContact CA-O 3.33Å; C1258-T1296 WeakPolarHBondContact CB-O 3.39Å
1259	M	90.8	Very high	88.7	Confident	2 Å²	2	54.2 Å²	54.2	1%	0.01	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	149	177.4	-79.2	-175.8	44.1	0	0	111.9	T1197 V1199 F1242 F1246 P1256 I1295 T1296 W1297 T1298	T1197-M1259 CarbonylContact O-C 3.56Å; T1197-M1259 WeakPolarHBondContact O-CA 3.27Å; V1199-M1259 HydrophobicContact CB-CE 4.45Å; V1199-M1259 HydrophobicContact CG2-CE 3.62Å; F1242-M1259 HydrophobicContact CZ-CE 4.28Å; F1246-M1259 HydrophobicContact CD2-SD 4.21Å; F1246-M1259 HydrophobicContact CE2-CE 4.33Å; F1246-M1259 HydrophobicContact CE2-SD 3.42Å; F1246-M1259 WeakPolarHBondContact CE2-SD 3.47Å; F1246-M1259 HydrophobicContact CZ-SD 3.96Å; P1256-M1259 HydrophobicContact CB-CG 4.14Å; P1256-M1259 HydrophobicContact CG-CG 3.79Å; P1256-M1259 HydrophobicContact CG-SD 3.81Å; M1259-I1295 HydrophobicContact CB-CG2 4.33Å; M1259-I1295 HydrophobicContact CG-CG2 4Å; M1259-I1295 HydrophobicContact SD-CG2 4.18Å; M1259-T1296 PolarHBondContact N-O 2.84Å; M1259-W1297 HydrophobicContact CB-CD2 4.22Å; M1259-W1297 HydrophobicContact CB-CG 4.03Å; M1259-W1297 HydrophobicContact CE-CD2 3.92Å; M1259-W1297 HydrophobicContact CE-CE3 4Å; M1259-W1297 HydrophobicContact CE-CH2 3.67Å; M1259-W1297 HydrophobicContact CE-CZ2 3.53Å; M1259-W1297 HydrophobicContact CE-CZ3 3.9Å; M1259-W1297 WeakPolarHBondContact O-CA 3.49Å; M1259-T1298 PolarHBondContact O-N 3.44Å
1260	Q	91.4	Very high	88.2	Confident	31 Å²	31	54.2 Å²	54.2	15%	0.145	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	135.9	173.7	-164.3	-177.3	36.1	0	0	111.7	T1197 G1198 V1199 M1224 T1298 I1300 Y1310 W1311	T1197-Q1260 PolarHBondContact O-N 2.82Å; G1198-Q1260 CarbonylContact C-O 3.14Å; G1198-Q1260 VanDerWaalsContact CA-O 3.29Å; G1198-Q1260 WeakPolarHBondContact CA-O 3.35Å; V1199-Q1260 PolarHBondContact N-O 3.46Å; M1224-Q1260 HydrophobicContact CE-CB 3.26Å; M1224-Q1260 HydrophobicContact CE-CG 4.38Å; Q1260-T1298 VanDerWaalsContact CA-O 3.24Å; Q1260-T1298 WeakPolarHBondContact CA-O 3.17Å; Q1260-T1298 WeakPolarHBondContact CG-O 3.47Å; Q1260-I1300 HydrophobicContact CG-CG2 4.36Å; Q1260-Y1310 PolarHBondContact OE1-OH 3.27Å; Q1260-Y1310 VanDerWaalsContact OE1-OH 3.09Å; Q1260-W1311 HydrophobicContact CB-CH2 4.37Å; Q1260-W1311 HydrophobicContact CB-CZ3 3.99Å; Q1260-W1311 HydrophobicContact CG-CH2 3.79Å; Q1260-W1311 HydrophobicContact CG-CZ3 3.81Å
1261	S	92	Very high	88	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	172.1	178	68.8	0	0	0	0	112	W1297 T1298 F1299 I1300	S1261-W1297 PolarHBondContact OG-NE1 3.37Å; S1261-T1298 PolarHBondContact N-O 2.87Å; S1261-F1299 WeakPolarHBondContact OG-CE1 3.32Å; S1261-I1300 PolarHBondContact O-N 3.17Å
1262	D	87.3	Confident	87.5	Confident	51 Å²	51	54.9 Å²	54.9	27%	0.273	25%	0.251	S	S	.	.			trans	-68.6	173.2	164.4	81.8	-22.5	0	0	0	111.9	F1264 F1267 F1299 I1300	D1262-F1264 PolarHBondContact O-N 2.99Å; D1262-F1264 WeakPolarHBondContact OD1-CB 3.45Å; D1262-F1264 PolarHBondContact OD1-N 2.6Å; D1262-F1267 VanDerWaalsContact OD1-CD2 3.26Å; D1262-F1267 WeakPolarHBondContact OD1-CD2 3.33Å; D1262-F1267 WeakPolarHBondContact OD1-CE2 3.37Å; D1262-F1299 VanDerWaalsContact O-CD1 3.26Å; D1262-F1299 WeakPolarHBondContact O-CD1 3.35Å; D1262-I1300 HydrophobicContact CB-CD1 3.84Å; D1262-I1300 HydrophobicContact CB-CG1 4.46Å
1263	N	83.3	Confident	87	Confident	49 Å²	49	49.6 Å²	49.6	26%	0.262	24%	0.235	S	C	.	.			trans	-78.1	23	-179.9	-73.5	-69	0	0	0	113.9	R1265 R1268 F1299 I1300	N1263-R1265 PolarHBondContact O-N 2.78Å; N1263-R1268 VanDerWaalsContact OD1-CZ 3.31Å; N1263-R1268 PolarHBondContact OD1-NE 3.13Å; N1263-R1268 PolarHBondContact OD1-NH2 3.37Å; N1263-F1299 WeakPolarHBondContact OD1-CB 3.49Å; N1263-I1300 PolarHBondContact ND2-O 3.4Å
1264	F	85.4	Confident	86.2	Confident	68 Å²	68	47.7 Å²	47.7	30%	0.298	23%	0.229	S	C	.	.			trans	-58.3	135.3	-178.8	-173.7	-116.4	0	0	0	111.2	F1201 L1237 D1262 S1266 F1267 R1268	F1201-F1264 HydrophobicContact CD2-CD1 4.13Å; F1201-F1264 HydrophobicContact CD2-CE1 4.15Å; F1201-F1264 HydrophobicContact CE2-CD1 4.05Å; F1201-F1264 AromaticContact CE2-CE1 3.97Å; F1201-F1264 HydrophobicContact CE2-CE1 3.97Å; L1237-F1264 HydrophobicContact CB-CE1 3.9Å; L1237-F1264 HydrophobicContact CB-CZ 3.8Å; L1237-F1264 HydrophobicContact CD1-CZ 3.96Å; L1237-F1264 HydrophobicContact CG-CZ 4.48Å; D1262-F1264 PolarHBondContact O-N 2.99Å; D1262-F1264 WeakPolarHBondContact OD1-CB 3.45Å; D1262-F1264 PolarHBondContact OD1-N 2.6Å; F1264-S1266 VanDerWaalsContact C-N 3.28Å; F1264-S1266 VanDerWaalsContact CE1-OG 3.26Å; F1264-S1266 WeakPolarHBondContact CE1-OG 3.32Å; F1264-S1266 PolarHBondContact O-N 2.8Å; F1264-F1267 HydrophobicContact CB-CD2 3.67Å; F1264-F1267 HydrophobicContact CB-CE2 4.07Å; F1264-F1267 HydrophobicContact CB-CG 4.38Å; F1264-F1267 HydrophobicContact CD1-CD2 4.36Å; F1264-F1267 HydrophobicContact CD1-CE2 4.44Å; F1264-F1267 WeakPolarHBondContact O-CB 3.21Å; F1264-F1267 PolarHBondContact O-N 2.89Å; F1264-R1268 PolarHBondContact O-N 3.48Å; F1264-R1268 VanDerWaalsContact O-N 3.1Å
1265	R	84.2	Confident	85.6	Confident	206 Å²	206	49 Å²	49	78%	0.777	23%	0.228	S	C	*	.	H	α-helix	trans	-58.1	-40.1	-169.2	-165.5	176.8	-176.5	179.4	1.5	112.2	N1263 F1267 R1268 T1269	N1263-R1265 PolarHBondContact O-N 2.78Å; R1265-F1267 VanDerWaalsContact C-N 3.3Å; R1265-F1267 PolarHBondContact O-N 2.73Å; R1265-R1268 PolarHBondContact O-N 3.4Å; R1265-T1269 PolarHBondContact O-N 3.05Å; R1265-T1269 PolarHBondContact O-OG1 3.09Å; R1265-T1269 VanDerWaalsContact O-OG1 3.07Å
1266	S	82.8	Confident	84.8	Confident	17 Å²	17	50.3 Å²	50.3	12%	0.119	24%	0.236	C	C	.	.	H	α-helix	trans	-66.3	-30.2	178.5	-52	0	0	0	0	113.2	L1237 F1264 A1270	L1237-S1266 VanDerWaalsContact O-CB 3.26Å; L1237-S1266 WeakPolarHBondContact O-CB 3.35Å; L1237-S1266 PolarHBondContact O-OG 2.99Å; F1264-S1266 VanDerWaalsContact C-N 3.28Å; F1264-S1266 VanDerWaalsContact CE1-OG 3.26Å; F1264-S1266 WeakPolarHBondContact CE1-OG 3.32Å; F1264-S1266 PolarHBondContact O-N 2.8Å; S1266-A1270 WeakPolarHBondContact O-CB 3.38Å; S1266-A1270 PolarHBondContact O-N 3.25Å
1267	F	88.6	Confident	83.6	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-72.5	-42.9	173	-63.6	-34.8	0	0	0	111.3	V1199 F1201 F1242 D1262 F1264 R1265 T1269 A1270 D1271 W1297 F1299	V1199-F1267 HydrophobicContact CG1-CE1 3.75Å; V1199-F1267 HydrophobicContact CG1-CZ 3.77Å; F1201-F1267 AromaticContact CD2-CE1 3.82Å; F1201-F1267 HydrophobicContact CD2-CE1 3.82Å; F1201-F1267 HydrophobicContact CD2-CE2 4.12Å; F1201-F1267 AromaticContact CD2-CZ 3.35Å; F1201-F1267 HydrophobicContact CD2-CZ 3.35Å; F1201-F1267 HydrophobicContact CE2-CD1 4.22Å; F1201-F1267 AromaticContact CE2-CE1 3.31Å; F1201-F1267 HydrophobicContact CE2-CE1 3.31Å; F1201-F1267 HydrophobicContact CE2-CE2 4.35Å; F1201-F1267 AromaticContact CE2-CZ 3.39Å; F1201-F1267 HydrophobicContact CE2-CZ 3.39Å; F1201-F1267 HydrophobicContact CG-CZ 4.21Å; F1201-F1267 AromaticContact CZ-CE1 3.91Å; F1201-F1267 HydrophobicContact CZ-CE1 3.91Å; F1201-F1267 HydrophobicContact CZ-CZ 4.25Å; F1242-F1267 AromaticContact CD2-CD1 4Å; F1242-F1267 HydrophobicContact CD2-CD1 4Å; F1242-F1267 AromaticContact CD2-CE1 3.59Å; F1242-F1267 HydrophobicContact CD2-CE1 3.59Å; F1242-F1267 AromaticContact CE2-CD1 3.99Å; F1242-F1267 HydrophobicContact CE2-CD1 3.99Å; F1242-F1267 AromaticContact CE2-CE1 3.65Å; F1242-F1267 HydrophobicContact CE2-CE1 3.65Å; F1242-F1267 HydrophobicContact CG-CD1 4.25Å; F1242-F1267 HydrophobicContact CG-CE1 4.23Å; F1242-F1267 HydrophobicContact CZ-CD1 4.23Å; F1242-F1267 HydrophobicContact CZ-CE1 4.33Å; D1262-F1267 VanDerWaalsContact OD1-CD2 3.26Å; D1262-F1267 WeakPolarHBondContact OD1-CD2 3.33Å; D1262-F1267 WeakPolarHBondContact OD1-CE2 3.37Å; F1264-F1267 HydrophobicContact CB-CD2 3.67Å; F1264-F1267 HydrophobicContact CB-CE2 4.07Å; F1264-F1267 HydrophobicContact CB-CG 4.38Å; F1264-F1267 HydrophobicContact CD1-CD2 4.36Å; F1264-F1267 HydrophobicContact CD1-CE2 4.44Å; F1264-F1267 WeakPolarHBondContact O-CB 3.21Å; F1264-F1267 PolarHBondContact O-N 2.89Å; R1265-F1267 VanDerWaalsContact C-N 3.3Å; R1265-F1267 PolarHBondContact O-N 2.73Å; F1267-T1269 VanDerWaalsContact C-N 3.34Å; F1267-T1269 PolarHBondContact O-N 3.46Å; F1267-A1270 PolarHBondContact O-N 3.48Å; F1267-D1271 WeakPolarHBondContact O-CB 3.08Å; F1267-D1271 PolarHBondContact O-N 2.87Å; F1267-W1297 HydrophobicContact CB-CH2 4.26Å; F1267-W1297 HydrophobicContact CB-CZ2 3.74Å; F1267-W1297 HydrophobicContact CD1-CH2 4.35Å; F1267-W1297 HydrophobicContact CD1-CZ2 4.1Å; F1267-W1297 HydrophobicContact CG-CZ2 4.08Å; F1267-F1299 HydrophobicContact CB-CE1 3.93Å
1268	R	85.8	Confident	82.4	Confident	109 Å²	109	57.5 Å²	57.5	41%	0.411	27%	0.269	S	S	.	.	H	α-helix	trans	-58.1	-44.9	173.5	-72.7	-76.7	-168.9	172.5	3.4	111.7	N1263 F1264 R1265 Q1272 F1299	N1263-R1268 VanDerWaalsContact OD1-CZ 3.31Å; N1263-R1268 PolarHBondContact OD1-NE 3.13Å; N1263-R1268 PolarHBondContact OD1-NH2 3.37Å; F1264-R1268 PolarHBondContact O-N 3.48Å; F1264-R1268 VanDerWaalsContact O-N 3.1Å; R1265-R1268 PolarHBondContact O-N 3.4Å; R1268-Q1272 WeakPolarHBondContact O-CG 3.17Å; R1268-Q1272 PolarHBondContact O-N 3.34Å; R1268-Q1272 VanDerWaalsContact O-N 3.14Å; R1268-F1299 HydrophobicContact CG-CD1 4.26Å; R1268-F1299 HydrophobicContact CG-CE1 3.87Å; R1268-F1299 HydrophobicContact CG-CZ 4.15Å
1269	T	83.1	Confident	81.2	Confident	41 Å²	41	61.5 Å²	61.5	25%	0.252	29%	0.289	S	S	.	.	H	α-helix	trans	-69.2	-38.2	176.6	-53	0	0	0	0	111.8	T1239 R1265 F1267 Q1272 E1273	T1239-T1269 HydrophobicContact CG2-CG2 3.98Å; R1265-T1269 PolarHBondContact O-N 3.05Å; R1265-T1269 PolarHBondContact O-OG1 3.09Å; R1265-T1269 VanDerWaalsContact O-OG1 3.07Å; F1267-T1269 VanDerWaalsContact C-N 3.34Å; F1267-T1269 PolarHBondContact O-N 3.46Å; T1269-Q1272 WeakPolarHBondContact O-CB 3.12Å; T1269-Q1272 PolarHBondContact O-N 2.69Å; T1269-E1273 WeakPolarHBondContact O-CG 3.33Å; T1269-E1273 PolarHBondContact O-N 2.96Å
1270	A	85.2	Confident	79.6	Confident	0 Å²	0	68.8 Å²	68.8	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-63.6	-41.4	176	0	0	0	0	0	112.3	T1239 F1242 L1243 S1266 F1267 Q1272 E1273 L1274 W1297	T1239-A1270 HydrophobicContact CG2-CB 3.84Å; F1242-A1270 HydrophobicContact CD1-CB 3.44Å; F1242-A1270 VanDerWaalsContact CD1-CB 3.44Å; F1242-A1270 HydrophobicContact CE1-CB 3.65Å; L1243-A1270 HydrophobicContact CD2-CB 4.06Å; L1243-A1270 HydrophobicContact CG-CB 4.41Å; S1266-A1270 WeakPolarHBondContact O-CB 3.38Å; S1266-A1270 PolarHBondContact O-N 3.25Å; F1267-A1270 PolarHBondContact O-N 3.48Å; A1270-Q1272 VanDerWaalsContact C-N 3.34Å; A1270-E1273 PolarHBondContact O-N 2.78Å; A1270-L1274 WeakPolarHBondContact O-CB 3.24Å; A1270-L1274 VanDerWaalsContact O-CG 3.26Å; A1270-L1274 WeakPolarHBondContact O-CG 3.48Å; A1270-L1274 PolarHBondContact O-N 3.12Å; A1270-W1297 HydrophobicContact CB-CH2 4.01Å; A1270-W1297 HydrophobicContact CB-CZ3 4.09Å
1271	D	85.6	Confident	77.4	Confident	27 Å²	27	74.2 Å²	74.2	14%	0.144	35%	0.346	C	S	.	.	H	α-helix	trans	-59.8	-45	173.7	177.3	47.3	0	0	0	111.2	F1267 L1274 N1275 W1297 F1299	F1267-D1271 WeakPolarHBondContact O-CB 3.08Å; F1267-D1271 PolarHBondContact O-N 2.87Å; D1271-L1274 PolarHBondContact O-N 3.25Å; D1271-N1275 WeakPolarHBondContact O-CB 3.38Å; D1271-N1275 VanDerWaalsContact O-CG 3.3Å; D1271-N1275 PolarHBondContact O-N 3.45Å; D1271-N1275 PolarHBondContact O-ND2 3.18Å; D1271-N1275 PolarHBondContact OD1-ND2 3.04Å; D1271-W1297 HydrophobicContact CB-CB 4.5Å; D1271-W1297 HydrophobicContact CB-CD2 4Å; D1271-W1297 HydrophobicContact CB-CE3 3.61Å; D1271-W1297 HydrophobicContact CB-CG 4.4Å; D1271-W1297 HydrophobicContact CB-CZ3 4.07Å; D1271-W1297 WeakPolarHBondContact OD1-CB 3.29Å; D1271-F1299 HydrophobicContact CB-CE2 4.13Å; D1271-F1299 HydrophobicContact CB-CZ 3.87Å
1272	Q	81.9	Confident	75.2	Confident	117 Å²	117	78.5 Å²	78.5	55%	0.547	37%	0.369	S	S	.	.	H	α-helix	trans	-59.9	-49.3	174.1	-72.2	173	-13.3	0	0	112.1	R1268 T1269 A1270 L1274 N1275 E1276	R1268-Q1272 WeakPolarHBondContact O-CG 3.17Å; R1268-Q1272 PolarHBondContact O-N 3.34Å; R1268-Q1272 VanDerWaalsContact O-N 3.14Å; T1269-Q1272 WeakPolarHBondContact O-CB 3.12Å; T1269-Q1272 PolarHBondContact O-N 2.69Å; A1270-Q1272 VanDerWaalsContact C-N 3.34Å; Q1272-L1274 PolarHBondContact O-N 2.93Å; Q1272-N1275 PolarHBondContact O-N 3.07Å; Q1272-E1276 WeakPolarHBondContact O-CG 3.38Å; Q1272-E1276 PolarHBondContact O-N 2.73Å
1273	E	80.7	Confident	73.3	Confident	76 Å²	76	85.2 Å²	85.2	36%	0.355	39%	0.391	S	S	.	.	H	α-helix	trans	-62.4	-41.5	179.1	-75.5	-177.4	-143.7	0	0	112.2	T1239 L1243 T1269 A1270 E1276 L1277	T1239-E1273 WeakPolarHBondContact CG2-OE1 3Å; L1243-E1273 HydrophobicContact CD1-CB 4.38Å; L1243-E1273 WeakPolarHBondContact CD1-OE2 3.34Å; T1269-E1273 WeakPolarHBondContact O-CG 3.33Å; T1269-E1273 PolarHBondContact O-N 2.96Å; A1270-E1273 PolarHBondContact O-N 2.78Å; E1273-E1276 PolarHBondContact O-N 3.15Å; E1273-L1277 WeakPolarHBondContact O-CB 3.44Å; E1273-L1277 VanDerWaalsContact O-CG 3.28Å; E1273-L1277 WeakPolarHBondContact O-CG 3.3Å; E1273-L1277 PolarHBondContact O-N 3.02Å
1274	L	77.3	Confident	71.7	Confident	20 Å²	20	89.5 Å²	89.5	11%	0.105	42%	0.419	C	S	.	.	H	α-helix	trans	-61.9	-48.5	174.6	-74.1	173.6	0	0	0	110.6	L1243 F1246 A1270 D1271 Q1272 E1276 L1277 F1278 W1297	L1243-L1274 HydrophobicContact CD2-CD1 4.44Å; L1243-L1274 HydrophobicContact CD2-CD2 4.1Å; L1243-L1274 HydrophobicContact CD2-CG 4.02Å; F1246-L1274 HydrophobicContact CD1-CD1 4.31Å; F1246-L1274 HydrophobicContact CD1-CD2 4.45Å; F1246-L1274 HydrophobicContact CE1-CD1 3.96Å; F1246-L1274 HydrophobicContact CE1-CD2 4.2Å; A1270-L1274 WeakPolarHBondContact O-CB 3.24Å; A1270-L1274 VanDerWaalsContact O-CG 3.26Å; A1270-L1274 WeakPolarHBondContact O-CG 3.48Å; A1270-L1274 PolarHBondContact O-N 3.12Å; D1271-L1274 PolarHBondContact O-N 3.25Å; Q1272-L1274 PolarHBondContact O-N 2.93Å; L1274-E1276 VanDerWaalsContact C-N 3.29Å; L1274-E1276 PolarHBondContact O-N 3.18Å; L1274-L1277 PolarHBondContact O-N 2.97Å; L1274-F1278 HydrophobicContact CB-CD2 4.41Å; L1274-F1278 HydrophobicContact CB-CE2 4.13Å; L1274-F1278 HydrophobicContact CD2-CE2 4.48Å; L1274-F1278 WeakPolarHBondContact O-CD2 3.34Å; L1274-F1278 WeakPolarHBondContact O-CG 3.4Å; L1274-F1278 PolarHBondContact O-N 2.95Å; L1274-W1297 HydrophobicContact CD1-CE3 4.26Å; L1274-W1297 HydrophobicContact CD1-CZ3 3.87Å
1275	N	75.5	Confident	69.7	Low	65 Å²	65	93.6 Å²	93.6	35%	0.348	44%	0.443	S	S	.	.	H	α-helix	trans	-59.7	-38.6	176.7	-76.4	-45.6	0	0	0	112.2	D1271 Q1272 N1279	D1271-N1275 WeakPolarHBondContact O-CB 3.38Å; D1271-N1275 VanDerWaalsContact O-CG 3.3Å; D1271-N1275 PolarHBondContact O-N 3.45Å; D1271-N1275 PolarHBondContact O-ND2 3.18Å; D1271-N1275 PolarHBondContact OD1-ND2 3.04Å; Q1272-N1275 PolarHBondContact O-N 3.07Å; N1275-N1279 WeakPolarHBondContact O-CB 3.47Å; N1275-N1279 PolarHBondContact O-N 2.77Å; N1275-N1279 VanDerWaalsContact O-N 3.08Å; N1275-N1279 PolarHBondContact O-ND2 3.14Å; N1275-N1279 VanDerWaalsContact O-ND2 3.09Å
1276	E	71.4	Confident	67.6	Low	94 Å²	94	87.9 Å²	87.9	44%	0.439	43%	0.426	S	S	.	.	H	α-helix	trans	-65.8	-45.4	174.6	-78.1	-166.8	-151.1	0	0	112.9	Q1272 E1273 L1274 F1278 N1279 K1280	Q1272-E1276 WeakPolarHBondContact O-CG 3.38Å; Q1272-E1276 PolarHBondContact O-N 2.73Å; E1273-E1276 PolarHBondContact O-N 3.15Å; L1274-E1276 VanDerWaalsContact C-N 3.29Å; L1274-E1276 PolarHBondContact O-N 3.18Å; E1276-F1278 VanDerWaalsContact C-N 3.29Å; E1276-F1278 PolarHBondContact O-N 3.1Å; E1276-N1279 PolarHBondContact O-N 3.34Å; E1276-K1280 WeakPolarHBondContact O-CB 3.31Å; E1276-K1280 PolarHBondContact O-N 3.47Å; E1276-K1280 IonicContact OE2-NZ 2.81Å; E1276-K1280 PolarHBondContact OE2-NZ 2.85Å
1277	L	66.7	Low	65.6	Low	102 Å²	102	93.3 Å²	93.3	53%	0.534	45%	0.447	S	S	.	.	H	α-helix	trans	-59.9	-40.7	176.4	-73.6	167.7	0	0	0	111.3	E1273 L1274 N1279	E1273-L1277 WeakPolarHBondContact O-CB 3.44Å; E1273-L1277 VanDerWaalsContact O-CG 3.28Å; E1273-L1277 WeakPolarHBondContact O-CG 3.3Å; E1273-L1277 PolarHBondContact O-N 3.02Å; L1274-L1277 PolarHBondContact O-N 2.97Å; L1277-N1279 VanDerWaalsContact C-N 3.27Å; L1277-N1279 PolarHBondContact O-N 2.63Å
1278	F	62.9	Low	63.6	Low	111 Å²	111	102.6 Å²	102.6	49%	0.487	49%	0.488	S	S	.	.	H	α-helix	trans	-68.2	-24.8	174.7	-69.5	-59.8	0	0	0	113.1	L1274 E1276	L1274-F1278 HydrophobicContact CB-CD2 4.41Å; L1274-F1278 HydrophobicContact CB-CE2 4.13Å; L1274-F1278 HydrophobicContact CD2-CE2 4.48Å; L1274-F1278 WeakPolarHBondContact O-CD2 3.34Å; L1274-F1278 WeakPolarHBondContact O-CG 3.4Å; L1274-F1278 PolarHBondContact O-N 2.95Å; E1276-F1278 VanDerWaalsContact C-N 3.29Å; E1276-F1278 PolarHBondContact O-N 3.1Å
1279	N	63.9	Low	61.5	Low	105 Å²	105	105 Å²	105	56%	0.561	50%	0.504	S	S	*	.	H	α-helix	trans	-92.5	-38	-177.6	-76.4	-25.7	0	0	0	114.3	N1275 E1276 L1277	N1275-N1279 WeakPolarHBondContact O-CB 3.47Å; N1275-N1279 PolarHBondContact O-N 2.77Å; N1275-N1279 VanDerWaalsContact O-N 3.08Å; N1275-N1279 PolarHBondContact O-ND2 3.14Å; N1275-N1279 VanDerWaalsContact O-ND2 3.09Å; E1276-N1279 PolarHBondContact O-N 3.34Å; L1277-N1279 VanDerWaalsContact C-N 3.27Å; L1277-N1279 PolarHBondContact O-N 2.63Å
1280	K	56.3	Low	59.5	Low	155 Å²	155	107.6 Å²	107.6	67%	0.674	52%	0.515	S	S	*	.	H	α-helix	trans	-82.6	-38	-168.7	-84.4	175.5	176.5	160.8	0	114.3	E1276	E1276-K1280 WeakPolarHBondContact O-CB 3.31Å; E1276-K1280 PolarHBondContact O-N 3.47Å; E1276-K1280 IonicContact OE2-NZ 2.81Å; E1276-K1280 PolarHBondContact OE2-NZ 2.85Å
1281	E	46	Very low	57.5	Low	145 Å²	145	110.7 Å²	110.7	68%	0.678	54%	0.537	S	S	*	.	S	Bend	trans	-112.4	2.7	-151.3	-123.3	175.1	-168	0	0	119.2
1282	N	46	Very low	55.6	Low	90 Å²	90	118.3 Å²	118.3	48%	0.481	57%	0.569	S	S	.	*			trans	-153.3	54.6	174.7	-95.6	-45.9	0	0	0	114.3	T1284 M1286	N1282-T1284 PolarHBondContact O-N 2.74Å; N1282-T1284 VanDerWaalsContact O-N 3.15Å; N1282-M1286 HydrophobicContact CB-CB 3.87Å; N1282-M1286 HydrophobicContact CB-CG 3.9Å
1283	R	47.2	Very low	54	Low	193 Å²	193	116.1 Å²	116.1	73%	0.728	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.7	-24.3	178.2	-90.4	-177.2	167.3	-177.3	-4.4	114.2	K1287	R1283-K1287 WeakPolarHBondContact O-CD 3.45Å
1284	T	49.4	Very low	53.4	Low	139 Å²	139	120.7 Å²	120.7	85%	0.853	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.4	-39	-171.8	34.7	0	0	0	0	114.6	N1282	N1282-T1284 PolarHBondContact O-N 2.74Å; N1282-T1284 VanDerWaalsContact O-N 3.15Å
1285	L	43.4	Very low	53.5	Low	154 Å²	154	120.5 Å²	120.5	81%	0.806	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98	-26.7	-172	-146.7	73.7	0	0	0	115
1286	M	40.9	Very low	53.8	Low	86 Å²	86	121.7 Å²	121.7	42%	0.424	58%	0.584	S	S	.	*	S	Bend	trans	-105	-6.1	-177.1	-68.5	-75.9	-135.5	0	0	114.3	N1282 K1288 E1289 L1290	N1282-M1286 HydrophobicContact CB-CB 3.87Å; N1282-M1286 HydrophobicContact CB-CG 3.9Å; M1286-K1288 PolarHBondContact O-N 3.46Å; M1286-K1288 VanDerWaalsContact O-N 3.15Å; M1286-E1289 PolarHBondContact O-N 2.94Å; M1286-L1290 HydrophobicContact CB-CB 4.31Å; M1286-L1290 HydrophobicContact CB-CD1 4.06Å; M1286-L1290 HydrophobicContact CB-CG 4.45Å; M1286-L1290 HydrophobicContact CE-CD1 3.37Å; M1286-L1290 HydrophobicContact CE-CG 4.43Å; M1286-L1290 HydrophobicContact CG-CD1 4.01Å; M1286-L1290 PolarHBondContact O-N 3.07Å; M1286-L1290 HydrophobicContact SD-CD1 3.46Å; M1286-L1290 WeakPolarHBondContact SD-CD1 3.27Å; M1286-L1290 HydrophobicContact SD-CG 4.01Å
1287	K	40.4	Very low	54.7	Low	130 Å²	130	118.3 Å²	118.3	57%	0.565	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.2	-17.9	-175.5	-113.9	-166.7	-170.3	177	0	114.3	R1283 S1291	R1283-K1287 WeakPolarHBondContact O-CD 3.45Å; K1287-S1291 WeakPolarHBondContact O-CB 3.29Å; K1287-S1291 PolarHBondContact O-OG 3.06Å
1288	K	45.6	Very low	55.7	Low	195 Å²	195	116.9 Å²	116.9	85%	0.848	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89	-28.2	179	-128	177.8	-178.1	179.3	0	113.5	M1286	M1286-K1288 PolarHBondContact O-N 3.46Å; M1286-K1288 VanDerWaalsContact O-N 3.15Å
1289	E	43	Very low	56.9	Low	160 Å²	160	113 Å²	113	75%	0.748	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.2	-35.1	-176.2	-70.1	-61.5	149.6	0	0	113.8	M1286	M1286-E1289 PolarHBondContact O-N 2.94Å
1290	L	41.4	Very low	57.7	Low	95 Å²	95	108.9 Å²	108.9	50%	0.497	52%	0.523	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	-11.6	-179.5	-69.9	179.5	0	0	0	114.6	M1286 K1292 D1293	M1286-L1290 HydrophobicContact CB-CB 4.31Å; M1286-L1290 HydrophobicContact CB-CD1 4.06Å; M1286-L1290 HydrophobicContact CB-CG 4.45Å; M1286-L1290 HydrophobicContact CE-CD1 3.37Å; M1286-L1290 HydrophobicContact CE-CG 4.43Å; M1286-L1290 HydrophobicContact CG-CD1 4.01Å; M1286-L1290 PolarHBondContact O-N 3.07Å; M1286-L1290 HydrophobicContact SD-CD1 3.46Å; M1286-L1290 WeakPolarHBondContact SD-CD1 3.27Å; M1286-L1290 HydrophobicContact SD-CG 4.01Å; L1290-K1292 PolarHBondContact O-N 3.17Å; L1290-K1292 VanDerWaalsContact O-N 3.12Å; L1290-D1293 PolarHBondContact O-N 3.34Å
1291	S	42.1	Very low	58.6	Low	65 Å²	65	105.9 Å²	105.9	46%	0.455	52%	0.518	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-14.1	179.5	62.2	0	0	0	0	113.9	K1287 D1293	K1287-S1291 WeakPolarHBondContact O-CB 3.29Å; K1287-S1291 PolarHBondContact O-OG 3.06Å; S1291-D1293 VanDerWaalsContact C-N 3.33Å
1292	K	45.2	Very low	59.7	Low	188 Å²	188	103.3 Å²	103.3	82%	0.817	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-16.6	172.3	-88.8	-176.8	172	178.2	0	114	L1290	L1290-K1292 PolarHBondContact O-N 3.17Å; L1290-K1292 VanDerWaalsContact O-N 3.12Å
1293	D	49	Very low	60.5	Low	71 Å²	71	110.4 Å²	110.4	38%	0.38	53%	0.534	S	S	.	.			trans	-123.6	66.7	-156.4	-89.3	39.2	0	0	0	112.4	R1255 L1290 S1291	R1255-D1293 IonicContact CZ-OD2 2.69Å; R1255-D1293 IonicContact NE-OD2 3.24Å; R1255-D1293 PolarHBondContact NH1-O 2.75Å; R1255-D1293 IonicContact NH2-OD1 2.81Å; R1255-D1293 IonicContact NH2-OD2 3.38Å; R1255-D1293 PolarHBondContact NH2-OD2 3.43Å; L1290-D1293 PolarHBondContact O-N 3.34Å; S1291-D1293 VanDerWaalsContact C-N 3.33Å
1294	R	68.4	Low	61.4	Low	172 Å²	172	101.4 Å²	101.4	65%	0.649	50%	0.5	S	S	*	.			trans	-86.5	149.9	171.5	-57.8	-172.5	-157.8	-167.4	6.2	110.7	R1255	R1255-R1294 VanDerWaalsContact NH1-C 3.27Å; R1255-R1294 PolarHBondContact NH1-O 3.12Å
1295	I	78.3	Confident	62.1	Low	16 Å²	16	98 Å²	98	8%	0.082	48%	0.481	C	S	.	.			trans	-91.5	117.8	170.1	-50.9	-176.2	0	0	0	107.3	F1246 R1255 P1256 D1257 M1259 W1297	F1246-I1295 HydrophobicContact CE1-CD1 4.18Å; F1246-I1295 HydrophobicContact CZ-CD1 3.62Å; R1255-I1295 HydrophobicContact CG-CD1 3.91Å; R1255-I1295 HydrophobicContact CG-CG1 4.09Å; P1256-I1295 HydrophobicContact CG-CD1 4.21Å; P1256-I1295 HydrophobicContact CG-CG2 4.25Å; P1256-I1295 WeakPolarHBondContact O-CG1 3.28Å; D1257-I1295 WeakPolarHBondContact O-CA 3.36Å; M1259-I1295 HydrophobicContact CB-CG2 4.33Å; M1259-I1295 HydrophobicContact CG-CG2 4Å; M1259-I1295 HydrophobicContact SD-CG2 4.18Å; I1295-W1297 PolarHBondContact O-N 3.07Å
1296	T	82.8	Confident	63.2	Low	90 Å²	90	99.9 Å²	99.9	55%	0.552	48%	0.477	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.4	110.4	173.6	-58.1	0	0	0	0	109.4	D1257 C1258 M1259	D1257-T1296 PolarHBondContact O-N 2.93Å; C1258-T1296 CarbonylContact C-O 3.53Å; C1258-T1296 WeakPolarHBondContact CA-O 3.33Å; C1258-T1296 WeakPolarHBondContact CB-O 3.39Å; M1259-T1296 PolarHBondContact N-O 2.84Å
1297	W	89.5	Confident	64.6	Low	23 Å²	23	97.9 Å²	97.9	9%	0.087	47%	0.471	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	116.2	177.8	-156.1	-34.8	0	0	0	111.5	F1242 M1259 S1261 F1267 A1270 D1271 L1274 I1295 F1299	F1242-W1297 HydrophobicContact CD1-CH2 4.44Å; F1242-W1297 AromaticContact CE1-CH2 3.42Å; F1242-W1297 HydrophobicContact CE1-CH2 3.42Å; F1242-W1297 VanDerWaalsContact CE1-CH2 3.42Å; F1242-W1297 HydrophobicContact CE1-CZ2 4.45Å; F1242-W1297 HydrophobicContact CE1-CZ3 4.04Å; F1242-W1297 AromaticContact CZ-CH2 3.56Å; F1242-W1297 HydrophobicContact CZ-CH2 3.56Å; F1242-W1297 HydrophobicContact CZ-CZ2 4.24Å; F1242-W1297 HydrophobicContact CZ-CZ3 4.4Å; M1259-W1297 HydrophobicContact CB-CD2 4.22Å; M1259-W1297 HydrophobicContact CB-CG 4.03Å; M1259-W1297 HydrophobicContact CE-CD2 3.92Å; M1259-W1297 HydrophobicContact CE-CE3 4Å; M1259-W1297 HydrophobicContact CE-CH2 3.67Å; M1259-W1297 HydrophobicContact CE-CZ2 3.53Å; M1259-W1297 HydrophobicContact CE-CZ3 3.9Å; M1259-W1297 WeakPolarHBondContact O-CA 3.49Å; S1261-W1297 PolarHBondContact OG-NE1 3.37Å; F1267-W1297 HydrophobicContact CB-CH2 4.26Å; F1267-W1297 HydrophobicContact CB-CZ2 3.74Å; F1267-W1297 HydrophobicContact CD1-CH2 4.35Å; F1267-W1297 HydrophobicContact CD1-CZ2 4.1Å; F1267-W1297 HydrophobicContact CG-CZ2 4.08Å; A1270-W1297 HydrophobicContact CB-CH2 4.01Å; A1270-W1297 HydrophobicContact CB-CZ3 4.09Å; D1271-W1297 HydrophobicContact CB-CB 4.5Å; D1271-W1297 HydrophobicContact CB-CD2 4Å; D1271-W1297 HydrophobicContact CB-CE3 3.61Å; D1271-W1297 HydrophobicContact CB-CG 4.4Å; D1271-W1297 HydrophobicContact CB-CZ3 4.07Å; D1271-W1297 WeakPolarHBondContact OD1-CB 3.29Å; L1274-W1297 HydrophobicContact CD1-CE3 4.26Å; L1274-W1297 HydrophobicContact CD1-CZ3 3.87Å; I1295-W1297 PolarHBondContact O-N 3.07Å; W1297-F1299 AromaticContact CD1-CE2 3.98Å; W1297-F1299 AromaticContact CD1-CZ 3.87Å; W1297-F1299 HydrophobicContact CD2-CZ 4.29Å; W1297-F1299 HydrophobicContact CG-CE2 4.2Å; W1297-F1299 HydrophobicContact CG-CZ 4.16Å; W1297-F1299 AromaticContact NE1-CE1 3.9Å; W1297-F1299 AromaticContact NE1-CZ 3.84Å
1298	T	88.3	Confident	66.2	Low	71 Å²	71	91.7 Å²	91.7	44%	0.436	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	126.9	178.6	-55.2	0	0	0	0	110.8	M1259 Q1260 S1261	M1259-T1298 PolarHBondContact O-N 3.44Å; Q1260-T1298 VanDerWaalsContact CA-O 3.24Å; Q1260-T1298 WeakPolarHBondContact CA-O 3.17Å; Q1260-T1298 WeakPolarHBondContact CG-O 3.47Å; S1261-T1298 PolarHBondContact N-O 2.87Å
1299	F	87.9	Confident	67.6	Low	30 Å²	30	82.9 Å²	82.9	13%	0.132	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	138.1	174.5	-65.4	-87.4	0	0	0	110.2	S1261 D1262 N1263 F1267 R1268 D1271 W1297	S1261-F1299 WeakPolarHBondContact OG-CE1 3.32Å; D1262-F1299 VanDerWaalsContact O-CD1 3.26Å; D1262-F1299 WeakPolarHBondContact O-CD1 3.35Å; N1263-F1299 WeakPolarHBondContact OD1-CB 3.49Å; F1267-F1299 HydrophobicContact CB-CE1 3.93Å; R1268-F1299 HydrophobicContact CG-CD1 4.26Å; R1268-F1299 HydrophobicContact CG-CE1 3.87Å; R1268-F1299 HydrophobicContact CG-CZ 4.15Å; D1271-F1299 HydrophobicContact CB-CE2 4.13Å; D1271-F1299 HydrophobicContact CB-CZ 3.87Å; W1297-F1299 AromaticContact CD1-CE2 3.98Å; W1297-F1299 AromaticContact CD1-CZ 3.87Å; W1297-F1299 HydrophobicContact CD2-CZ 4.29Å; W1297-F1299 HydrophobicContact CG-CE2 4.2Å; W1297-F1299 HydrophobicContact CG-CZ 4.16Å; W1297-F1299 AromaticContact NE1-CE1 3.9Å; W1297-F1299 AromaticContact NE1-CZ 3.84Å
1300	I	81.2	Confident	69.3	Low	18 Å²	18	75.6 Å²	75.6	9%	0.092	38%	0.375	C	S	.	.	P	Polyproline II helix	trans	-62.5	156.4	174.3	70.3	-171	0	0	0	110.7	Q1260 S1261 D1262 N1263 C1307 W1311	Q1260-I1300 HydrophobicContact CG-CG2 4.36Å; S1261-I1300 PolarHBondContact O-N 3.17Å; D1262-I1300 HydrophobicContact CB-CD1 3.84Å; D1262-I1300 HydrophobicContact CB-CG1 4.46Å; N1263-I1300 PolarHBondContact ND2-O 3.4Å; I1300-C1307 HydrophobicContact CB-CB 3.83Å; I1300-C1307 HydrophobicContact CG2-CB 3.62Å; I1300-W1311 HydrophobicContact CG2-CH2 3.67Å; I1300-W1311 HydrophobicContact CG2-CZ2 4.03Å
1301	T	74.5	Confident	71.4	Confident	93 Å²	93	71.2 Å²	71.2	57%	0.571	35%	0.352	S	S	*	.	P	Polyproline II helix	trans	-58.5	133	173	-47.3	0	0	0	0	109.9	R1303 A1304	T1301-R1303 PolarHBondContact O-N 2.91Å; T1301-A1304 VanDerWaalsContact O-CB 3.3Å; T1301-A1304 WeakPolarHBondContact O-CB 3.18Å; T1301-A1304 PolarHBondContact O-N 2.92Å
1302	P	68.5	Low	73.2	Confident	91 Å²	91	72.5 Å²	72.5	59%	0.591	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.3	134.5	174.1	-25.9	33.7	0	0	0	110.8	A1304	P1302-A1304 PolarHBondContact O-N 3.47Å
1303	R	64.2	Low	74.8	Confident	239 Å²	239	68.8 Å²	68.8	90%	0.902	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.5	16.5	-175.4	-49	177.2	178.5	170.7	-0.3	115.4	T1301 P1305	T1301-R1303 PolarHBondContact O-N 2.91Å; R1303-P1305 WeakPolarHBondContact O-CD 3.46Å
1304	A	66.3	Low	76.6	Confident	3 Å²	3	65.4 Å²	65.4	3%	0.025	31%	0.314	C	S	.	.			trans	-109.3	64.6	171.5	0	0	0	0	0	112.7	T1301 P1302 W1306 C1307	T1301-A1304 VanDerWaalsContact O-CB 3.3Å; T1301-A1304 WeakPolarHBondContact O-CB 3.18Å; T1301-A1304 PolarHBondContact O-N 2.92Å; P1302-A1304 PolarHBondContact O-N 3.47Å; A1304-W1306 VanDerWaalsContact CA-CZ3 3.46Å; A1304-W1306 HydrophobicContact CB-CD2 4.08Å; A1304-W1306 HydrophobicContact CB-CE3 4.11Å; A1304-W1306 HydrophobicContact CB-CH2 3.48Å; A1304-W1306 VanDerWaalsContact CB-CH2 3.48Å; A1304-W1306 HydrophobicContact CB-CZ2 3.43Å; A1304-W1306 VanDerWaalsContact CB-CZ2 3.43Å; A1304-W1306 HydrophobicContact CB-CZ3 3.84Å; A1304-W1306 PolarHBondContact O-N 2.93Å; A1304-C1307 WeakPolarHBondContact O-CB 3.32Å; A1304-C1307 PolarHBondContact O-N 3.25Å; A1304-C1307 VanDerWaalsContact O-N 3.13Å
1305	P	63.9	Low	77.3	Confident	68 Å²	68	57.7 Å²	57.7	44%	0.442	29%	0.285	S	S	.	.	G	3₁₀ helix	trans	-61.2	-26.8	-177.1	27	-34.8	0	0	0	112.5	R1303 C1307 G1308 G1309	R1303-P1305 WeakPolarHBondContact O-CD 3.46Å; P1305-C1307 PolarHBondContact O-N 3.23Å; P1305-C1307 VanDerWaalsContact O-N 3.11Å; P1305-G1308 WeakPolarHBondContact O-CA 3.49Å; P1305-G1308 PolarHBondContact O-N 2.9Å; P1305-G1309 PolarHBondContact O-N 3.2Å
1306	W	66.7	Low	77.3	Confident	193 Å²	193	57.7 Å²	57.7	73%	0.731	29%	0.29	S	S	*	.	G	3₁₀ helix	trans	-58.3	-27.4	177.2	67.8	84.3	0	0	0	113.4	A1304 G1308 G1309	A1304-W1306 VanDerWaalsContact CA-CZ3 3.46Å; A1304-W1306 HydrophobicContact CB-CD2 4.08Å; A1304-W1306 HydrophobicContact CB-CE3 4.11Å; A1304-W1306 HydrophobicContact CB-CH2 3.48Å; A1304-W1306 VanDerWaalsContact CB-CH2 3.48Å; A1304-W1306 HydrophobicContact CB-CZ2 3.43Å; A1304-W1306 VanDerWaalsContact CB-CZ2 3.43Å; A1304-W1306 HydrophobicContact CB-CZ3 3.84Å; A1304-W1306 PolarHBondContact O-N 2.93Å; W1306-G1308 PolarHBondContact O-N 3.26Å; W1306-G1309 PolarHBondContact O-N 3.11Å
1307	C	70.5	Confident	77.2	Confident	44 Å²	44	53.6 Å²	53.6	30%	0.297	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-63.4	-26.7	173.2	-67.4	0	0	0	0	112.3	I1300 A1304 P1305	I1300-C1307 HydrophobicContact CB-CB 3.83Å; I1300-C1307 HydrophobicContact CG2-CB 3.62Å; A1304-C1307 WeakPolarHBondContact O-CB 3.32Å; A1304-C1307 PolarHBondContact O-N 3.25Å; A1304-C1307 VanDerWaalsContact O-N 3.13Å; P1305-C1307 PolarHBondContact O-N 3.23Å; P1305-C1307 VanDerWaalsContact O-N 3.11Å
1308	G	73	Confident	76.9	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-96.8	1.3	176.6	0	0	0	0	0	115.7	P1305 W1306 Y1310 W1311 E1312	P1305-G1308 WeakPolarHBondContact O-CA 3.49Å; P1305-G1308 PolarHBondContact O-N 2.9Å; W1306-G1308 PolarHBondContact O-N 3.26Å; G1308-Y1310 PolarHBondContact O-N 2.92Å; G1308-W1311 VanDerWaalsContact CA-CH2 3.46Å; G1308-W1311 VanDerWaalsContact O-CD2 3.3Å; G1308-W1311 VanDerWaalsContact O-CG 3.28Å; G1308-W1311 PolarHBondContact O-N 3.43Å; G1308-W1311 PolarHBondContact O-NE1 3.06Å; G1308-E1312 PolarHBondContact O-N 3.09Å
1309	G	75.9	Confident	76.4	Confident	11 Å²	11	53.8 Å²	53.8	11%	0.113	26%	0.26	C	S	.	.	H	α-helix	trans	-59.8	-17	-171.3	0	0	0	0	0	115.3	P1305 W1306 R1313	P1305-G1309 PolarHBondContact O-N 3.2Å; W1306-G1309 PolarHBondContact O-N 3.11Å; G1309-R1313 VanDerWaalsContact O-CG 3.28Å; G1309-R1313 WeakPolarHBondContact O-CG 3.46Å; G1309-R1313 PolarHBondContact O-N 3.33Å; G1309-R1313 PolarHBondContact O-NH1 3.03Å
1310	Y	78.5	Confident	75.7	Confident	6 Å²	6	53.9 Å²	53.9	2%	0.024	26%	0.263	C	S	.	.	H	α-helix	trans	-79.1	-29.4	176.9	74.5	-92	0	0	0	113.8	G1198 T1222 M1224 R1227 Q1260 G1308	G1198-Y1310 WeakPolarHBondContact CA-OH 3.43Å; T1222-Y1310 HydrophobicContact CG2-CD2 4.24Å; T1222-Y1310 HydrophobicContact CG2-CE2 3.88Å; M1224-Y1310 WeakPolarHBondContact CE-OH 3.22Å; M1224-Y1310 HydrophobicContact CG-CE2 4.05Å; M1224-Y1310 VanDerWaalsContact CG-OH 3.29Å; M1224-Y1310 WeakPolarHBondContact CG-OH 3.21Å; R1227-Y1310 VanDerWaalsContact NH1-CD2 3.34Å; R1227-Y1310 PolarHBondContact NH1-O 3.28Å; R1227-Y1310 PolarHBondContact NH2-O 2.98Å; Q1260-Y1310 PolarHBondContact OE1-OH 3.27Å; Q1260-Y1310 VanDerWaalsContact OE1-OH 3.09Å; G1308-Y1310 PolarHBondContact O-N 2.92Å
1311	W	84.3	Confident	75.4	Confident	4 Å²	4	54.2 Å²	54.2	2%	0.015	27%	0.269	C	S	.	.	H	α-helix	trans	-88.7	-33.9	172.8	60.3	71.5	0	0	0	111.4	D1200 L1220 T1222 Q1260 I1300 G1308 R1313 L1314 V1315	D1200-W1311 HydrophobicContact CB-CG 4.24Å; L1220-W1311 HydrophobicContact CD2-CB 4.47Å; T1222-W1311 HydrophobicContact CG2-CB 3.59Å; Q1260-W1311 HydrophobicContact CB-CH2 4.37Å; Q1260-W1311 HydrophobicContact CB-CZ3 3.99Å; Q1260-W1311 HydrophobicContact CG-CH2 3.79Å; Q1260-W1311 HydrophobicContact CG-CZ3 3.81Å; I1300-W1311 HydrophobicContact CG2-CH2 3.67Å; I1300-W1311 HydrophobicContact CG2-CZ2 4.03Å; G1308-W1311 VanDerWaalsContact CA-CH2 3.46Å; G1308-W1311 VanDerWaalsContact O-CD2 3.3Å; G1308-W1311 VanDerWaalsContact O-CG 3.28Å; G1308-W1311 PolarHBondContact O-N 3.43Å; G1308-W1311 PolarHBondContact O-NE1 3.06Å; W1311-R1313 PolarHBondContact O-N 2.94Å; W1311-L1314 CarbonylContact O-C 3.51Å; W1311-L1314 WeakPolarHBondContact O-CA 3.32Å; W1311-L1314 PolarHBondContact O-N 3.34Å; W1311-V1315 WeakPolarHBondContact O-CG2 3.42Å; W1311-V1315 PolarHBondContact O-N 2.92Å
1312	E	80.2	Confident	75.5	Confident	92 Å²	92	52.1 Å²	52.1	43%	0.43	25%	0.254	S	S	.	.	H	α-helix	trans	-56.8	-41	175.2	-70.5	-179.7	159.9	0	0	111.3	G1308 L1314 V1315 G1316	G1308-E1312 PolarHBondContact O-N 3.09Å; E1312-L1314 VanDerWaalsContact C-N 3.35Å; E1312-L1314 PolarHBondContact O-N 2.86Å; E1312-V1315 WeakPolarHBondContact O-CB 3.28Å; E1312-V1315 PolarHBondContact O-N 2.65Å; E1312-G1316 PolarHBondContact O-N 2.88Å
1313	R	79.7	Confident	75.5	Confident	110 Å²	110	55.8 Å²	55.8	42%	0.415	26%	0.26	S	S	.	.	H	α-helix	trans	-57.5	-45.2	172.3	-76.8	-177.6	-168.6	102.7	-8.8	112.4	G1309 W1311 G1316 S1317	G1309-R1313 VanDerWaalsContact O-CG 3.28Å; G1309-R1313 WeakPolarHBondContact O-CG 3.46Å; G1309-R1313 PolarHBondContact O-N 3.33Å; G1309-R1313 PolarHBondContact O-NH1 3.03Å; W1311-R1313 PolarHBondContact O-N 2.94Å; R1313-G1316 WeakPolarHBondContact O-CA 3.38Å; R1313-G1316 PolarHBondContact O-N 3.41Å; R1313-G1316 VanDerWaalsContact O-N 3.12Å; R1313-S1317 PolarHBondContact O-N 2.77Å; R1313-S1317 PolarHBondContact O-OG 2.77Å; R1313-S1317 VanDerWaalsContact O-OG 3.09Å
1314	L	85.4	Confident	75.7	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-71.5	-32.8	179.9	-67.2	172.8	0	0	0	112.6	L1220 T1222 I1229 W1311 E1312 G1316 S1317 V1318	L1220-L1314 HydrophobicContact CD1-CB 4.33Å; T1222-L1314 HydrophobicContact CG2-CD1 4.27Å; T1222-L1314 WeakPolarHBondContact OG1-CD1 3.26Å; I1229-L1314 HydrophobicContact CG2-CB 4.21Å; I1229-L1314 HydrophobicContact CG2-CD1 3.74Å; I1229-L1314 HydrophobicContact CG2-CD2 4.31Å; I1229-L1314 HydrophobicContact CG2-CG 4.32Å; W1311-L1314 CarbonylContact O-C 3.51Å; W1311-L1314 WeakPolarHBondContact O-CA 3.32Å; W1311-L1314 PolarHBondContact O-N 3.34Å; E1312-L1314 VanDerWaalsContact C-N 3.35Å; E1312-L1314 PolarHBondContact O-N 2.86Å; L1314-G1316 PolarHBondContact O-N 3.27Å; L1314-S1317 PolarHBondContact O-N 2.72Å; L1314-V1318 VanDerWaalsContact O-CG2 3.29Å; L1314-V1318 WeakPolarHBondContact O-CG2 3.5Å; L1314-V1318 PolarHBondContact O-N 3.06Å
1315	V	83.3	Confident	75.6	Confident	9 Å²	9	53.7 Å²	53.7	6%	0.055	26%	0.263	C	S	.	.	H	α-helix	trans	-58.2	-42.3	167.7	167.7	0	0	0	0	110.1	D1200 A1202 L1220 W1311 E1312 V1318 K1319	D1200-V1315 HydrophobicContact CB-CG2 4.24Å; D1200-V1315 WeakPolarHBondContact OD2-CG2 3.44Å; A1202-V1315 HydrophobicContact CB-CB 4.42Å; A1202-V1315 HydrophobicContact CB-CG1 3.69Å; A1202-V1315 HydrophobicContact CB-CG2 4.2Å; L1220-V1315 HydrophobicContact CD1-CG2 3.84Å; W1311-V1315 WeakPolarHBondContact O-CG2 3.42Å; W1311-V1315 PolarHBondContact O-N 2.92Å; E1312-V1315 WeakPolarHBondContact O-CB 3.28Å; E1312-V1315 PolarHBondContact O-N 2.65Å; V1315-V1318 PolarHBondContact O-N 2.97Å; V1315-K1319 HydrophobicContact CG1-CD 4.15Å; V1315-K1319 WeakPolarHBondContact O-CB 3.26Å; V1315-K1319 WeakPolarHBondContact O-CG 3.38Å; V1315-K1319 PolarHBondContact O-N 3.36Å
1316	G	78.7	Confident	75.3	Confident	17 Å²	17	57.8 Å²	57.8	18%	0.175	28%	0.28	C	S	.	.	H	α-helix	trans	-58.5	-50.7	171.5	0	0	0	0	0	112.7	E1312 R1313 L1314 V1318 K1319 T1320	E1312-G1316 PolarHBondContact O-N 2.88Å; R1313-G1316 WeakPolarHBondContact O-CA 3.38Å; R1313-G1316 PolarHBondContact O-N 3.41Å; R1313-G1316 VanDerWaalsContact O-N 3.12Å; L1314-G1316 PolarHBondContact O-N 3.27Å; G1316-V1318 VanDerWaalsContact C-N 3.28Å; G1316-V1318 PolarHBondContact O-N 3.13Å; G1316-K1319 PolarHBondContact O-N 3.44Å; G1316-K1319 VanDerWaalsContact O-N 3.15Å; G1316-T1320 PolarHBondContact O-N 2.99Å; G1316-T1320 PolarHBondContact O-OG1 3.38Å
1317	S	80.9	Confident	74.6	Confident	4 Å²	4	52.1 Å²	52.1	3%	0.028	28%	0.281	C	S	.	.	H	α-helix	trans	-58.1	-40.4	177.6	-40.9	0	0	0	0	111.9	D672 R1313 L1314 T1320 A1321	D672-S1317 PolarHBondContact O-OG 2.93Å; D672-S1317 VanDerWaalsContact O-OG 3.09Å; R1313-S1317 PolarHBondContact O-N 2.77Å; R1313-S1317 PolarHBondContact O-OG 2.77Å; R1313-S1317 VanDerWaalsContact O-OG 3.09Å; L1314-S1317 PolarHBondContact O-N 2.72Å; S1317-T1320 PolarHBondContact O-N 3.47Å; S1317-A1321 VanDerWaalsContact O-CB 3.31Å; S1317-A1321 WeakPolarHBondContact O-CB 3.42Å; S1317-A1321 PolarHBondContact O-N 3.27Å
1318	V	83	Confident	73.9	Confident	1 Å²	1	56.5 Å²	56.5	1%	0.006	30%	0.297	C	S	.	.	H	α-helix	trans	-65.3	-47	175.1	171.6	0	0	0	0	111.5	L1220 I1229 L1231 L1314 V1315 G1316 T1320 A1321 L1322 I1335	L1220-V1318 HydrophobicContact CD1-CG2 3.9Å; I1229-V1318 HydrophobicContact CD1-CG2 3.78Å; L1231-V1318 HydrophobicContact CD1-CG1 4.02Å; L1231-V1318 HydrophobicContact CD1-CG2 3.98Å; L1231-V1318 HydrophobicContact CD2-CG1 4.49Å; L1231-V1318 HydrophobicContact CD2-CG2 3.97Å; L1314-V1318 VanDerWaalsContact O-CG2 3.29Å; L1314-V1318 WeakPolarHBondContact O-CG2 3.5Å; L1314-V1318 PolarHBondContact O-N 3.06Å; V1315-V1318 PolarHBondContact O-N 2.97Å; G1316-V1318 VanDerWaalsContact C-N 3.28Å; G1316-V1318 PolarHBondContact O-N 3.13Å; V1318-T1320 VanDerWaalsContact C-N 3.31Å; V1318-T1320 PolarHBondContact O-N 3.26Å; V1318-A1321 PolarHBondContact O-N 3.16Å; V1318-L1322 HydrophobicContact CG1-CD1 3.82Å; V1318-L1322 HydrophobicContact CG1-CG 4.43Å; V1318-L1322 WeakPolarHBondContact O-CB 3.31Å; V1318-L1322 WeakPolarHBondContact O-CG 3.17Å; V1318-L1322 PolarHBondContact O-N 3.47Å; V1318-I1335 HydrophobicContact CB-CD1 4.21Å; V1318-I1335 HydrophobicContact CG2-CD1 3.51Å
1319	K	78.5	Confident	73	Confident	96 Å²	96	60.7 Å²	60.7	42%	0.417	33%	0.332	S	S	.	.	H	α-helix	trans	-59.7	-42.2	176.8	-77.1	175.8	177.9	175.9	0	111.5	V1315 G1316 K1323	V1315-K1319 HydrophobicContact CG1-CD 4.15Å; V1315-K1319 WeakPolarHBondContact O-CB 3.26Å; V1315-K1319 WeakPolarHBondContact O-CG 3.38Å; V1315-K1319 PolarHBondContact O-N 3.36Å; G1316-K1319 PolarHBondContact O-N 3.44Å; G1316-K1319 VanDerWaalsContact O-N 3.15Å; K1319-K1323 WeakPolarHBondContact O-CG 3.5Å; K1319-K1323 PolarHBondContact O-N 3.11Å
1320	T	72.2	Confident	72.7	Confident	33 Å²	33	65.6 Å²	65.6	20%	0.202	35%	0.348	C	S	.	.	H	α-helix	trans	-66.9	-45.6	177.9	-62.4	0	0	0	0	111.6	G1316 S1317 V1318 L1322 K1323 K1324	G1316-T1320 PolarHBondContact O-N 2.99Å; G1316-T1320 PolarHBondContact O-OG1 3.38Å; S1317-T1320 PolarHBondContact O-N 3.47Å; V1318-T1320 VanDerWaalsContact C-N 3.31Å; V1318-T1320 PolarHBondContact O-N 3.26Å; T1320-L1322 VanDerWaalsContact C-N 3.34Å; T1320-L1322 PolarHBondContact O-N 3.38Å; T1320-K1323 PolarHBondContact O-N 3.42Å; T1320-K1324 HydrophobicContact CG2-CD 4.09Å; T1320-K1324 WeakPolarHBondContact O-CG 3.4Å; T1320-K1324 PolarHBondContact O-N 3.23Å
1321	A	75.6	Confident	72.6	Confident	25 Å²	25	66.6 Å²	66.6	21%	0.207	35%	0.353	C	S	.	.	H	α-helix	trans	-61.5	-42.9	176.2	0	0	0	0	0	111.6	S1317 V1318 K1324 A1325 I1331 I1335	S1317-A1321 VanDerWaalsContact O-CB 3.31Å; S1317-A1321 WeakPolarHBondContact O-CB 3.42Å; S1317-A1321 PolarHBondContact O-N 3.27Å; V1318-A1321 PolarHBondContact O-N 3.16Å; A1321-K1324 PolarHBondContact O-N 2.89Å; A1321-A1325 VanDerWaalsContact O-CB 3.28Å; A1321-A1325 WeakPolarHBondContact O-CB 3.11Å; A1321-A1325 PolarHBondContact O-N 2.94Å; A1321-I1331 HydrophobicContact CB-CG2 3.78Å; A1321-I1335 HydrophobicContact CB-CD1 4.09Å; A1321-I1335 HydrophobicContact CB-CG1 4.46Å
1322	L	75.9	Confident	72.7	Confident	48 Å²	48	68.4 Å²	68.4	25%	0.251	36%	0.362	S	S	.	.	H	α-helix	trans	-59.3	-46.4	174	-79.7	164.9	0	0	0	111.8	L1205 V1318 T1320 K1324 L1326 I1331	L1205-L1322 HydrophobicContact CD1-CD1 3.7Å; L1205-L1322 HydrophobicContact CD2-CD1 4.04Å; V1318-L1322 HydrophobicContact CG1-CD1 3.82Å; V1318-L1322 HydrophobicContact CG1-CG 4.43Å; V1318-L1322 WeakPolarHBondContact O-CB 3.31Å; V1318-L1322 WeakPolarHBondContact O-CG 3.17Å; V1318-L1322 PolarHBondContact O-N 3.47Å; T1320-L1322 VanDerWaalsContact C-N 3.34Å; T1320-L1322 PolarHBondContact O-N 3.38Å; L1322-K1324 PolarHBondContact O-N 3.09Å; L1322-L1326 WeakPolarHBondContact O-CG 3.1Å; L1322-L1326 PolarHBondContact O-N 2.88Å; L1322-I1331 HydrophobicContact CB-CD1 4.3Å; L1322-I1331 HydrophobicContact CD2-CD1 3.25Å; L1322-I1331 HydrophobicContact CG-CD1 3.61Å
1323	K	69.2	Low	72.9	Confident	169 Å²	169	65 Å²	65	74%	0.735	35%	0.35	S	S	*	.	H	α-helix	trans	-61.6	-42	177.9	-77.8	179.2	179.4	-176.6	0	112.5	K1319 T1320	K1319-K1323 WeakPolarHBondContact O-CG 3.5Å; K1319-K1323 PolarHBondContact O-N 3.11Å; T1320-K1323 PolarHBondContact O-N 3.42Å
1324	K	67.3	Low	72.9	Confident	167 Å²	167	64.7 Å²	64.7	73%	0.726	35%	0.353	S	S	*	.	H	α-helix	trans	-80.1	-33	-175.2	-71.1	-177.7	178.4	-179.2	0	113.7	T1320 A1321 L1322	T1320-K1324 HydrophobicContact CG2-CD 4.09Å; T1320-K1324 WeakPolarHBondContact O-CG 3.4Å; T1320-K1324 PolarHBondContact O-N 3.23Å; A1321-K1324 PolarHBondContact O-N 2.89Å; L1322-K1324 PolarHBondContact O-N 3.09Å
1325	A	64.9	Low	73	Confident	30 Å²	30	65 Å²	65	25%	0.248	35%	0.354	C	S	.	.			trans	-112.5	25.7	-169.9	0	0	0	0	0	113.5	A1321 G1327 H1328	A1321-A1325 VanDerWaalsContact O-CB 3.28Å; A1321-A1325 WeakPolarHBondContact O-CB 3.11Å; A1321-A1325 PolarHBondContact O-N 2.94Å; A1325-G1327 PolarHBondContact O-N 2.8Å; A1325-H1328 HydrophobicContact CB-CB 4.35Å; A1325-H1328 PolarHBondContact O-N 3.1Å
1326	L	57	Low	73.3	Confident	155 Å²	155	64.6 Å²	64.6	81%	0.812	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45	110.2	174	-88.2	161.9	0	0	0	110	L1322	L1322-L1326 WeakPolarHBondContact O-CG 3.1Å; L1322-L1326 PolarHBondContact O-N 2.88Å
1327	G	52.9	Low	73.6	Confident	73 Å²	73	65 Å²	65	75%	0.753	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	114.6	-11.6	-176.8	0	0	0	0	0	116.3	A1325	A1325-G1327 PolarHBondContact O-N 2.8Å
1328	H	54.6	Low	73.9	Confident	137 Å²	137	65.3 Å²	65.3	63%	0.634	35%	0.354	S	S	*	.			trans	-104.3	130.9	179.9	-62.8	-78.1	0	0	0	113	A1325 Y1330	A1325-H1328 HydrophobicContact CB-CB 4.35Å; A1325-H1328 PolarHBondContact O-N 3.1Å; H1328-Y1330 PolarHBondContact O-N 2.78Å
1329	A	55.6	Low	73.8	Confident	88 Å²	88	66.8 Å²	66.8	73%	0.727	36%	0.364	S	S	*	.	S	Bend	trans	-82.9	8.2	-169.6	0	0	0	0	0	116.3
1330	Y	68.4	Low	73.7	Confident	114 Å²	114	63.6 Å²	63.6	45%	0.447	35%	0.351	S	S	.	.			trans	-122.9	26.2	-162.2	-52.2	-73.8	0	0	0	115.5	H1328 E1332 A1333 Q1334	H1328-Y1330 PolarHBondContact O-N 2.78Å; Y1330-E1332 PolarHBondContact O-N 3.33Å; Y1330-A1333 PolarHBondContact O-N 3.04Å; Y1330-A1333 VanDerWaalsContact O-N 3.09Å; Y1330-Q1334 WeakPolarHBondContact O-CG 3.44Å; Y1330-Q1334 PolarHBondContact O-N 2.86Å
1331	I	76.7	Confident	73.7	Confident	26 Å²	26	64.9 Å²	64.9	13%	0.133	36%	0.359	C	S	.	.	H	α-helix	trans	-57.3	-43.7	-174.5	-63.6	175.6	0	0	0	112.8	L1231 A1321 L1322 A1333 Q1334 I1335	L1231-I1331 HydrophobicContact CD1-CG2 4.34Å; A1321-I1331 HydrophobicContact CB-CG2 3.78Å; L1322-I1331 HydrophobicContact CB-CD1 4.3Å; L1322-I1331 HydrophobicContact CD2-CD1 3.25Å; L1322-I1331 HydrophobicContact CG-CD1 3.61Å; I1331-A1333 VanDerWaalsContact C-N 3.33Å; I1331-A1333 PolarHBondContact O-N 3.15Å; I1331-Q1334 PolarHBondContact O-N 3.42Å; I1331-I1335 HydrophobicContact CG2-CD1 3.68Å; I1331-I1335 HydrophobicContact CG2-CG1 4.41Å; I1331-I1335 WeakPolarHBondContact O-CG1 3.28Å; I1331-I1335 PolarHBondContact O-N 3.15Å
1332	E	87	Confident	73.2	Confident	42 Å²	42	70.6 Å²	70.6	20%	0.196	38%	0.38	C	S	.	.	H	α-helix	trans	-59.1	-44.5	176.7	178.5	176.5	139.6	0	0	111.4	H1230 L1231 R1253 Y1330 N1336	H1230-E1332 WeakPolarHBondContact CA-OE2 3.18Å; H1230-E1332 IonicContact CG-OE2 3.75Å; H1230-E1332 IonicContact ND1-OE1 3.74Å; H1230-E1332 PolarHBondContact ND1-OE1 3.03Å; H1230-E1332 IonicContact ND1-OE2 2.82Å; H1230-E1332 PolarHBondContact ND1-OE2 2.67Å; L1231-E1332 HydrophobicContact CD1-CB 4.36Å; L1231-E1332 HydrophobicContact CG-CB 4.48Å; L1231-E1332 PolarHBondContact N-OE2 2.99Å; R1253-E1332 IonicContact CZ-OE1 3.62Å; R1253-E1332 IonicContact NH2-OE1 3.57Å; R1253-E1332 PolarHBondContact NH2-OE1 2.8Å; Y1330-E1332 PolarHBondContact O-N 3.33Å; E1332-N1336 WeakPolarHBondContact CG-ND2 3.22Å; E1332-N1336 VanDerWaalsContact O-CB 3.28Å; E1332-N1336 WeakPolarHBondContact O-CB 3.38Å; E1332-N1336 VanDerWaalsContact O-CG 3.3Å; E1332-N1336 PolarHBondContact O-N 3.37Å; E1332-N1336 PolarHBondContact O-ND2 2.89Å; E1332-N1336 VanDerWaalsContact O-ND2 3.14Å
1333	A	84	Confident	72.6	Confident	21 Å²	21	73.3 Å²	73.3	17%	0.174	39%	0.394	C	S	.	.	H	α-helix	trans	-67.1	-42	-178.6	0	0	0	0	0	111.7	Y1330 I1331 N1336 A1337 F1356 Y1364	Y1330-A1333 PolarHBondContact O-N 3.04Å; Y1330-A1333 VanDerWaalsContact O-N 3.09Å; I1331-A1333 VanDerWaalsContact C-N 3.33Å; I1331-A1333 PolarHBondContact O-N 3.15Å; A1333-N1336 CarbonylContact O-C 3.56Å; A1333-N1336 PolarHBondContact O-N 3.46Å; A1333-A1337 WeakPolarHBondContact O-CB 3.44Å; A1333-A1337 PolarHBondContact O-N 2.73Å; A1333-F1356 HydrophobicContact CB-CE2 4.29Å; A1333-Y1364 HydrophobicContact CB-CD2 4.37Å; A1333-Y1364 HydrophobicContact CB-CE2 3.7Å
1334	Q	80.8	Confident	72.2	Confident	103 Å²	103	67.6 Å²	67.6	48%	0.481	38%	0.375	S	S	.	.	H	α-helix	trans	-64.7	-45.4	178.9	-70.4	-66.4	-26	0	0	112.1	Y1330 I1331 N1336 A1337 R1338	Y1330-Q1334 WeakPolarHBondContact O-CG 3.44Å; Y1330-Q1334 PolarHBondContact O-N 2.86Å; I1331-Q1334 PolarHBondContact O-N 3.42Å; Q1334-N1336 VanDerWaalsContact C-N 3.3Å; Q1334-N1336 PolarHBondContact O-N 3.3Å; Q1334-A1337 PolarHBondContact O-N 2.61Å; Q1334-A1337 VanDerWaalsContact O-N 3.09Å; Q1334-R1338 PolarHBondContact O-N 3.01Å
1335	I	85.6	Confident	71.7	Confident	6 Å²	6	64.6 Å²	64.6	3%	0.031	38%	0.381	C	S	.	.	H	α-helix	trans	-67.8	-34.6	177.3	-65.1	170.4	0	0	0	110.9	I1229 V1318 A1321 I1331 A1337 R1338	I1229-I1335 HydrophobicContact CD1-CB 3.68Å; I1229-I1335 HydrophobicContact CD1-CD1 3.79Å; I1229-I1335 HydrophobicContact CD1-CG1 4.33Å; I1229-I1335 HydrophobicContact CD1-CG2 3.5Å; I1229-I1335 HydrophobicContact CG1-CB 4.24Å; I1229-I1335 HydrophobicContact CG1-CG2 3.89Å; V1318-I1335 HydrophobicContact CB-CD1 4.21Å; V1318-I1335 HydrophobicContact CG2-CD1 3.51Å; A1321-I1335 HydrophobicContact CB-CD1 4.09Å; A1321-I1335 HydrophobicContact CB-CG1 4.46Å; I1331-I1335 HydrophobicContact CG2-CD1 3.68Å; I1331-I1335 HydrophobicContact CG2-CG1 4.41Å; I1331-I1335 WeakPolarHBondContact O-CG1 3.28Å; I1331-I1335 PolarHBondContact O-N 3.15Å; I1335-A1337 VanDerWaalsContact C-N 3.28Å; I1335-A1337 PolarHBondContact O-N 2.93Å; I1335-R1338 WeakPolarHBondContact O-CB 3.33Å; I1335-R1338 VanDerWaalsContact O-CD 3.31Å; I1335-R1338 WeakPolarHBondContact O-CD 3.38Å; I1335-R1338 WeakPolarHBondContact O-CG 3.27Å; I1335-R1338 PolarHBondContact O-N 3.15Å; I1335-R1338 PolarHBondContact O-NH1 3.34Å
1336	N	90.5	Very high	71.3	Confident	2 Å²	2	66 Å²	66	1%	0.011	39%	0.385	C	S	.	.	H	α-helix	trans	-73.1	-18	172.8	-75.6	-32.8	0	0	0	113.4	A1228 I1229 E1332 A1333 Q1334 R1338 P1355 F1356 L1359	A1228-N1336 WeakPolarHBondContact CA-OD1 3.48Å; I1229-N1336 PolarHBondContact N-OD1 3.01Å; I1229-N1336 PolarHBondContact O-ND2 2.86Å; E1332-N1336 WeakPolarHBondContact CG-ND2 3.22Å; E1332-N1336 VanDerWaalsContact O-CB 3.28Å; E1332-N1336 WeakPolarHBondContact O-CB 3.38Å; E1332-N1336 VanDerWaalsContact O-CG 3.3Å; E1332-N1336 PolarHBondContact O-N 3.37Å; E1332-N1336 PolarHBondContact O-ND2 2.89Å; E1332-N1336 VanDerWaalsContact O-ND2 3.14Å; A1333-N1336 CarbonylContact O-C 3.56Å; A1333-N1336 PolarHBondContact O-N 3.46Å; Q1334-N1336 VanDerWaalsContact C-N 3.3Å; Q1334-N1336 PolarHBondContact O-N 3.3Å; N1336-R1338 VanDerWaalsContact C-N 3.28Å; N1336-P1355 HydrophobicContact CB-CB 4.29Å; N1336-P1355 CarbonylContact O-C 3.19Å; N1336-P1355 WeakPolarHBondContact O-CD 3.46Å; N1336-F1356 HydrophobicContact CB-CD2 4.09Å; N1336-F1356 WeakPolarHBondContact O-CB 3.49Å; N1336-F1356 PolarHBondContact O-N 3.19Å; N1336-L1359 HydrophobicContact CB-CD1 4.42Å
1337	A	84.8	Confident	71.3	Confident	26 Å²	26	64.9 Å²	64.9	22%	0.215	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	1	174.5	0	0	0	0	0	113.1	A1333 Q1334 I1335 T1354 Y1364	A1333-A1337 WeakPolarHBondContact O-CB 3.44Å; A1333-A1337 PolarHBondContact O-N 2.73Å; Q1334-A1337 PolarHBondContact O-N 2.61Å; Q1334-A1337 VanDerWaalsContact O-N 3.09Å; I1335-A1337 VanDerWaalsContact C-N 3.28Å; I1335-A1337 PolarHBondContact O-N 2.93Å; A1337-T1354 WeakPolarHBondContact O-CG2 3.46Å; A1337-Y1364 HydrophobicContact CB-CD1 3.89Å; A1337-Y1364 HydrophobicContact CB-CG 3.95Å
1338	R	86.4	Confident	71.6	Confident	10 Å²	10	68.3 Å²	68.3	4%	0.038	38%	0.381	C	S	.	.	S	Bend	trans	-68.1	146.4	178.3	82.5	-173.1	-178.9	-78	-2.5	111.8	D672 I674 R1227 Q1334 I1335 N1336 T1354 P1355	D672-R1338 IonicContact OD1-CZ 2.72Å; D672-R1338 IonicContact OD1-NE 3.23Å; D672-R1338 PolarHBondContact OD1-NE 2.87Å; D672-R1338 IonicContact OD1-NH2 2.77Å; D672-R1338 PolarHBondContact OD1-NH2 3.15Å; I674-R1338 HydrophobicContact CD1-CB 3.95Å; I674-R1338 HydrophobicContact CD1-CG 4.48Å; R1227-R1338 VanDerWaalsContact CB-NH2 3.28Å; R1227-R1338 PolarHBondContact O-NH1 3.47Å; R1227-R1338 PolarHBondContact O-NH2 3.33Å; Q1334-R1338 PolarHBondContact O-N 3.01Å; I1335-R1338 WeakPolarHBondContact O-CB 3.33Å; I1335-R1338 VanDerWaalsContact O-CD 3.31Å; I1335-R1338 WeakPolarHBondContact O-CD 3.38Å; I1335-R1338 WeakPolarHBondContact O-CG 3.27Å; I1335-R1338 PolarHBondContact O-N 3.15Å; I1335-R1338 PolarHBondContact O-NH1 3.34Å; N1336-R1338 VanDerWaalsContact C-N 3.28Å; R1338-T1354 WeakPolarHBondContact O-CA 3.46Å; R1338-T1354 WeakPolarHBondContact O-CB 3.49Å; R1338-T1354 WeakPolarHBondContact O-CG2 3.41Å; R1338-P1355 WeakPolarHBondContact O-CD 3.48Å
1339	P	81.1	Confident	71.9	Confident	32 Å²	32	66.3 Å²	66.3	21%	0.208	38%	0.375	C	S	.	.			trans	-62.7	134.7	174	25.7	-33.8	0	0	0	111.8	L671 T1341 L1343 C1352	L671-P1339 HydrophobicContact CD2-CG 4.38Å; P1339-T1341 WeakPolarHBondContact CB-O 3.49Å; P1339-L1343 HydrophobicContact CB-CD1 4.11Å; P1339-L1343 HydrophobicContact CB-CG 4.42Å; P1339-L1343 HydrophobicContact CG-CD1 3.98Å; P1339-C1352 HydrophobicContact CB-CB 4.36Å
1340	L	78.2	Confident	72.4	Confident	29 Å²	29	70.8 Å²	70.8	15%	0.152	38%	0.383	C	S	.	.	S	Bend	trans	-92.1	-10.4	167.4	-69.7	170.9	0	0	0	112.3	L668 R1227 L1353 P1355 F1358	L668-L1340 WeakPolarHBondContact CD1-O 3.43Å; R1227-L1340 HydrophobicContact CB-CD2 4Å; R1227-L1340 HydrophobicContact CG-CD2 4.21Å; L1340-L1353 PolarHBondContact N-O 2.93Å; L1340-P1355 HydrophobicContact CD1-CG 4.19Å; L1340-P1355 HydrophobicContact CD2-CG 3.98Å; L1340-P1355 HydrophobicContact CG-CG 4.13Å; L1340-F1358 HydrophobicContact CD1-CD2 3.89Å; L1340-F1358 HydrophobicContact CD1-CE2 3.6Å
1341	T	70.8	Confident	72.6	Confident	60 Å²	60	72 Å²	72	37%	0.368	39%	0.392	S	S	.	.	S	Bend	trans	-131.2	164.5	-179.1	58.5	0	0	0	0	109.5	P1339 L1343	P1339-T1341 WeakPolarHBondContact CB-O 3.49Å; T1341-L1343 PolarHBondContact O-N 3.06Å
1342	F	66.5	Low	72.5	Confident	145 Å²	145	71.7 Å²	71.7	64%	0.636	39%	0.393	S	S	*	.			trans	-56.8	138.3	172.5	179.8	-105.6	0	0	0	111
1343	L	63.1	Low	72.3	Confident	105 Å²	105	73.9 Å²	73.9	55%	0.55	41%	0.405	S	S	.	.			trans	-91	107.5	171.5	-90.5	157	0	0	0	107.9	P1339 T1341 C1352	P1339-L1343 HydrophobicContact CB-CD1 4.11Å; P1339-L1343 HydrophobicContact CB-CG 4.42Å; P1339-L1343 HydrophobicContact CG-CD1 3.98Å; T1341-L1343 PolarHBondContact O-N 3.06Å; L1343-C1352 HydrophobicContact CD2-CB 3.85Å; L1343-C1352 HydrophobicContact CG-CB 4.07Å
1344	S	60.2	Low	72.5	Confident	49 Å²	49	73.2 Å²	73.2	34%	0.343	40%	0.399	S	S	.	.			trans	-66.6	148.4	173.4	-174	0	0	0	0	111.5	D1346 D1349	S1344-D1346 WeakPolarHBondContact OG-CB 3.36Å; S1344-D1346 PolarHBondContact OG-N 3.44Å; S1344-D1346 VanDerWaalsContact OG-N 3.1Å; S1344-D1349 WeakPolarHBondContact CB-OD2 3.41Å; S1344-D1349 PolarHBondContact OG-OD2 3.06Å
1345	A	56.6	Low	73	Confident	103 Å²	103	68.3 Å²	68.3	85%	0.851	38%	0.376	S	S	*	.	S	Bend	trans	-79.5	-9.3	169.7	0	0	0	0	0	112.2	P1347	A1345-P1347 WeakPolarHBondContact O-CD 2.96Å
1346	D	55.7	Low	73.1	Confident	61 Å²	61	69.8 Å²	69.8	33%	0.326	38%	0.383	S	S	.	.			trans	-77.3	117.3	177.7	-165.1	-29.3	0	0	0	110.4	S1344 K1348 D1349	S1344-D1346 WeakPolarHBondContact OG-CB 3.36Å; S1344-D1346 PolarHBondContact OG-N 3.44Å; S1344-D1346 VanDerWaalsContact OG-N 3.1Å; D1346-K1348 PolarHBondContact O-N 2.79Å; D1346-K1348 VanDerWaalsContact O-N 3.12Å; D1346-K1348 VanDerWaalsContact OD1-CB 3.3Å; D1346-K1348 WeakPolarHBondContact OD1-CB 3.27Å; D1346-K1348 WeakPolarHBondContact OD1-CG 3.49Å; D1346-K1348 PolarHBondContact OD1-N 3.44Å; D1346-D1349 PolarHBondContact O-N 3.37Å; D1346-D1349 VanDerWaalsContact O-N 3.14Å
1347	P	57.5	Low	73.1	Confident	130 Å²	130	71.3 Å²	71.3	84%	0.844	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-10.5	177.3	27.7	-35.1	0	0	0	114	A1345	A1345-P1347 WeakPolarHBondContact O-CD 2.96Å
1348	K	60.5	Low	73.3	Confident	145 Å²	145	75 Å²	75	63%	0.63	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-18.3	175.1	-62.5	-177.9	-178.3	179.4	0	113.6	E463 D1346	E463-K1348 WeakPolarHBondContact OE1-CD 3.41Å; E463-K1348 IonicContact OE1-NZ 2.85Å; E463-K1348 PolarHBondContact OE1-NZ 3.21Å; D1346-K1348 PolarHBondContact O-N 2.79Å; D1346-K1348 VanDerWaalsContact O-N 3.12Å; D1346-K1348 VanDerWaalsContact OD1-CB 3.3Å; D1346-K1348 WeakPolarHBondContact OD1-CB 3.27Å; D1346-K1348 WeakPolarHBondContact OD1-CG 3.49Å; D1346-K1348 PolarHBondContact OD1-N 3.44Å
1349	D	59.5	Low	73.5	Confident	95 Å²	95	76.2 Å²	76.2	51%	0.508	41%	0.408	S	S	.	.	S	Bend	trans	-67.2	150	178.2	-83.5	-30.3	0	0	0	111.1	S1344 D1346	S1344-D1349 WeakPolarHBondContact CB-OD2 3.41Å; S1344-D1349 PolarHBondContact OG-OD2 3.06Å; D1346-D1349 PolarHBondContact O-N 3.37Å; D1346-D1349 VanDerWaalsContact O-N 3.14Å
1350	M	66.1	Low	73.8	Confident	182 Å²	182	77.6 Å²	77.6	90%	0.897	42%	0.416	S	S	*	.	P	Polyproline II helix	trans	-65.5	151.8	-179.8	-64.2	-157.4	-63.9	0	0	111.2	C1352	M1350-C1352 PolarHBondContact O-N 3.04Å
1351	E	72.5	Confident	74.1	Confident	139 Å²	139	79.7 Å²	79.7	65%	0.65	44%	0.444	S	S	*	.	P	Polyproline II helix	trans	-50.5	136.6	172.2	-177.3	175.5	-169.2	0	0	110.8	H1357 A1363	E1351-H1357 IonicContact OE1-CE1 2.68Å; E1351-H1357 IonicContact OE1-NE2 2.77Å; E1351-A1363 WeakPolarHBondContact OE1-CB 3.39Å
1352	C	76	Confident	74.8	Confident	21 Å²	21	85.4 Å²	85.4	14%	0.142	46%	0.459	C	S	.	.	P	Polyproline II helix	trans	-67.3	138	-178	68.1	0	0	0	0	111.3	P1339 L1343 M1350 H1357	P1339-C1352 HydrophobicContact CB-CB 4.36Å; L1343-C1352 HydrophobicContact CD2-CB 3.85Å; L1343-C1352 HydrophobicContact CG-CB 4.07Å; M1350-C1352 PolarHBondContact O-N 3.04Å; C1352-H1357 PolarHBondContact O-CE1 3.4Å
1353	L	82.5	Confident	75.4	Confident	87 Å²	87	79.8 Å²	79.8	46%	0.455	44%	0.439	S	S	.	.	P	Polyproline II helix	trans	-69.5	143.2	173.3	-72.9	171.4	0	0	0	109.7	L1340 H1357 F1358	L1340-L1353 PolarHBondContact N-O 2.93Å; L1353-H1357 HydrophobicContact CD2-CB 4.38Å; L1353-F1358 HydrophobicContact CB-CE2 4.44Å; L1353-F1358 HydrophobicContact CD1-CZ 4.38Å
1354	T	87.5	Confident	76.3	Confident	8 Å²	8	77.6 Å²	77.6	5%	0.049	42%	0.424	C	S	.	.			trans	-135.8	158.5	179.4	71.1	0	0	0	0	108.3	A1337 R1338 F1356 H1357 F1358	A1337-T1354 WeakPolarHBondContact O-CG2 3.46Å; R1338-T1354 WeakPolarHBondContact O-CA 3.46Å; R1338-T1354 WeakPolarHBondContact O-CB 3.49Å; R1338-T1354 WeakPolarHBondContact O-CG2 3.41Å; T1354-F1356 PolarHBondContact O-N 2.88Å; T1354-F1356 VanDerWaalsContact O-N 3.11Å; T1354-F1356 WeakPolarHBondContact OG1-CB 3.46Å; T1354-F1356 PolarHBondContact OG1-N 2.92Å; T1354-H1357 PolarHBondContact N-ND1 3.44Å; T1354-H1357 WeakPolarHBondContact O-CB 3.15Å; T1354-H1357 PolarHBondContact O-N 3.11Å; T1354-H1357 PolarHBondContact OG1-N 3.21Å; T1354-H1357 PolarHBondContact OG1-ND1 2.81Å; T1354-F1358 WeakPolarHBondContact O-CD2 3.27Å
1355	P	90.4	Very high	76.9	Confident	0 Å²	0	86 Å²	86	0%	0	45%	0.448	C	S	.	.	H	α-helix	trans	-55.2	-30.4	172.7	-21.6	30.4	0	0	0	112.9	A1228 N1336 R1338 L1340 H1357 F1358 L1359	A1228-P1355 HydrophobicContact CB-CB 3.83Å; N1336-P1355 HydrophobicContact CB-CB 4.29Å; N1336-P1355 CarbonylContact O-C 3.19Å; N1336-P1355 WeakPolarHBondContact O-CD 3.46Å; R1338-P1355 WeakPolarHBondContact O-CD 3.48Å; L1340-P1355 HydrophobicContact CD1-CG 4.19Å; L1340-P1355 HydrophobicContact CD2-CG 3.98Å; L1340-P1355 HydrophobicContact CG-CG 4.13Å; P1355-H1357 VanDerWaalsContact C-N 3.3Å; P1355-H1357 PolarHBondContact O-N 2.86Å; P1355-F1358 PolarHBondContact O-N 2.75Å; P1355-L1359 WeakPolarHBondContact O-CG 3.42Å; P1355-L1359 PolarHBondContact O-N 2.94Å
1356	F	89.1	Confident	77.3	Confident	37 Å²	37	85.7 Å²	85.7	16%	0.162	43%	0.429	C	S	.	.	H	α-helix	trans	-61.4	-37.6	178.1	-149.6	-84.5	0	0	0	112.7	A1333 N1336 T1354 L1359 T1360 Y1364	A1333-F1356 HydrophobicContact CB-CE2 4.29Å; N1336-F1356 HydrophobicContact CB-CD2 4.09Å; N1336-F1356 WeakPolarHBondContact O-CB 3.49Å; N1336-F1356 PolarHBondContact O-N 3.19Å; T1354-F1356 PolarHBondContact O-N 2.88Å; T1354-F1356 VanDerWaalsContact O-N 3.11Å; T1354-F1356 WeakPolarHBondContact OG1-CB 3.46Å; T1354-F1356 PolarHBondContact OG1-N 2.92Å; F1356-L1359 PolarHBondContact O-N 3.48Å; F1356-T1360 HydrophobicContact CD1-CG2 4.05Å; F1356-T1360 VanDerWaalsContact CD1-OG1 3.28Å; F1356-T1360 WeakPolarHBondContact CD1-OG1 3.46Å; F1356-T1360 HydrophobicContact CE1-CG2 3.62Å; F1356-T1360 WeakPolarHBondContact CE1-OG1 3.42Å; F1356-T1360 HydrophobicContact CZ-CG2 3.99Å; F1356-T1360 PolarHBondContact O-N 2.91Å; F1356-T1360 PolarHBondContact O-OG1 3.11Å; F1356-Y1364 HydrophobicContact CD1-CD2 4.48Å; F1356-Y1364 AromaticContact CD2-CD2 3.96Å; F1356-Y1364 HydrophobicContact CD2-CD2 3.96Å; F1356-Y1364 HydrophobicContact CD2-CG 4.35Å; F1356-Y1364 HydrophobicContact CE1-CD2 4.04Å; F1356-Y1364 AromaticContact CE2-CD2 3.46Å; F1356-Y1364 HydrophobicContact CE2-CD2 3.46Å; F1356-Y1364 VanDerWaalsContact CE2-CD2 3.46Å; F1356-Y1364 HydrophobicContact CE2-CE2 4.15Å; F1356-Y1364 HydrophobicContact CE2-CG 4.28Å; F1356-Y1364 HydrophobicContact CG-CD2 4.45Å; F1356-Y1364 AromaticContact CZ-CD2 3.52Å; F1356-Y1364 HydrophobicContact CZ-CD2 3.52Å; F1356-Y1364 HydrophobicContact CZ-CE2 4.3Å; F1356-Y1364 HydrophobicContact CZ-CG 4.45Å
1357	H	89.3	Confident	77.6	Confident	33 Å²	33	89.5 Å²	89.5	15%	0.153	45%	0.448	C	S	.	.	H	α-helix	trans	-59.7	-46.2	174	-69.4	105	0	0	0	111.1	E1351 C1352 L1353 T1354 P1355 L1359 G1361 A1363	E1351-H1357 IonicContact OE1-CE1 2.68Å; E1351-H1357 IonicContact OE1-NE2 2.77Å; C1352-H1357 PolarHBondContact O-CE1 3.4Å; L1353-H1357 HydrophobicContact CD2-CB 4.38Å; T1354-H1357 PolarHBondContact N-ND1 3.44Å; T1354-H1357 WeakPolarHBondContact O-CB 3.15Å; T1354-H1357 PolarHBondContact O-N 3.11Å; T1354-H1357 PolarHBondContact OG1-N 3.21Å; T1354-H1357 PolarHBondContact OG1-ND1 2.81Å; P1355-H1357 VanDerWaalsContact C-N 3.3Å; P1355-H1357 PolarHBondContact O-N 2.86Å; H1357-L1359 VanDerWaalsContact C-N 3.33Å; H1357-L1359 PolarHBondContact O-N 2.85Å; H1357-G1361 WeakPolarHBondContact O-CA 3.43Å; H1357-G1361 PolarHBondContact O-N 2.85Å; H1357-A1363 WeakPolarHBondContact NE2-CA 3.1Å
1358	F	89.9	Confident	77.2	Confident	103 Å²	103	88.7 Å²	88.7	45%	0.452	44%	0.443	S	S	.	.	H	α-helix	trans	-67	-33.4	177.9	-68.7	-76.6	0	0	0	112.8	P1193 L1340 L1353 T1354 P1355	P1193-F1358 HydrophobicContact CG-CB 4.13Å; P1193-F1358 WeakPolarHBondContact CG-O 3.5Å; L1340-F1358 HydrophobicContact CD1-CD2 3.89Å; L1340-F1358 HydrophobicContact CD1-CE2 3.6Å; L1353-F1358 HydrophobicContact CB-CE2 4.44Å; L1353-F1358 HydrophobicContact CD1-CZ 4.38Å; T1354-F1358 WeakPolarHBondContact O-CD2 3.27Å; P1355-F1358 PolarHBondContact O-N 2.75Å
1359	L	89.9	Confident	76.7	Confident	37 Å²	37	90.3 Å²	90.3	19%	0.194	45%	0.446	C	S	.	.	H	α-helix	trans	-78.5	-31.5	-179	-68.1	177.9	0	0	0	114.3	P1193 F1194 A1228 N1336 P1355 F1356 H1357	P1193-L1359 HydrophobicContact CB-CD2 3.96Å; F1194-L1359 HydrophobicContact CD2-CD2 3.97Å; F1194-L1359 HydrophobicContact CE2-CD2 3.56Å; A1228-L1359 HydrophobicContact CB-CD1 3.98Å; A1228-L1359 HydrophobicContact CB-CD2 3.97Å; A1228-L1359 HydrophobicContact CB-CG 4.04Å; N1336-L1359 HydrophobicContact CB-CD1 4.42Å; P1355-L1359 WeakPolarHBondContact O-CG 3.42Å; P1355-L1359 PolarHBondContact O-N 2.94Å; F1356-L1359 PolarHBondContact O-N 3.48Å; H1357-L1359 VanDerWaalsContact C-N 3.33Å; H1357-L1359 PolarHBondContact O-N 2.85Å
1360	T	87.4	Confident	75.9	Confident	61 Å²	61	93.1 Å²	93.1	37%	0.374	46%	0.46	S	S	.	.	H	α-helix	trans	-127.2	-7.2	-169.1	67.8	0	0	0	0	114.5	F1356 R1362	F1356-T1360 HydrophobicContact CD1-CG2 4.05Å; F1356-T1360 VanDerWaalsContact CD1-OG1 3.28Å; F1356-T1360 WeakPolarHBondContact CD1-OG1 3.46Å; F1356-T1360 HydrophobicContact CE1-CG2 3.62Å; F1356-T1360 WeakPolarHBondContact CE1-OG1 3.42Å; F1356-T1360 HydrophobicContact CZ-CG2 3.99Å; F1356-T1360 PolarHBondContact O-N 2.91Å; F1356-T1360 PolarHBondContact O-OG1 3.11Å; T1360-R1362 PolarHBondContact O-N 3.48Å; T1360-R1362 WeakPolarHBondContact OG1-CG 3.46Å; T1360-R1362 PolarHBondContact OG1-O 2.81Å; T1360-R1362 VanDerWaalsContact OG1-O 3.1Å
1361	G	84.9	Confident	74.8	Confident	72 Å²	72	89.9 Å²	89.9	74%	0.742	45%	0.451	S	S	*	.	S	Bend	trans	71.7	11.2	-174.7	0	0	0	0	0	114.3	H1357	H1357-G1361 WeakPolarHBondContact O-CA 3.43Å; H1357-G1361 PolarHBondContact O-N 2.85Å
1362	R	86.3	Confident	73.2	Confident	181 Å²	181	90.9 Å²	90.9	68%	0.683	46%	0.455	S	S	*	.	S	Bend	trans	-152.1	161.9	-176.6	61.1	-175.5	179.7	-175.8	0.7	112.4	T1360	T1360-R1362 PolarHBondContact O-N 3.48Å; T1360-R1362 WeakPolarHBondContact OG1-CG 3.46Å; T1360-R1362 PolarHBondContact OG1-O 2.81Å; T1360-R1362 VanDerWaalsContact OG1-O 3.1Å
1363	A	79.4	Confident	71.5	Confident	26 Å²	26	97 Å²	97	22%	0.215	49%	0.492	C	S	.	.			trans	-65.6	150.9	173.9	0	0	0	0	0	112.3	E1351 H1357 R1365	E1351-A1363 WeakPolarHBondContact OE1-CB 3.39Å; H1357-A1363 WeakPolarHBondContact NE2-CA 3.1Å; A1363-R1365 PolarHBondContact O-N 2.8Å
1364	Y	80.4	Confident	69.4	Low	59 Å²	59	96.6 Å²	96.6	23%	0.231	51%	0.509	C	S	.	.			trans	-67.9	128.4	175.7	177.3	-113.8	0	0	0	110.7	A1333 A1337 F1356 H1366	A1333-Y1364 HydrophobicContact CB-CD2 4.37Å; A1333-Y1364 HydrophobicContact CB-CE2 3.7Å; A1337-Y1364 HydrophobicContact CB-CD1 3.89Å; A1337-Y1364 HydrophobicContact CB-CG 3.95Å; F1356-Y1364 HydrophobicContact CD1-CD2 4.48Å; F1356-Y1364 AromaticContact CD2-CD2 3.96Å; F1356-Y1364 HydrophobicContact CD2-CD2 3.96Å; F1356-Y1364 HydrophobicContact CD2-CG 4.35Å; F1356-Y1364 HydrophobicContact CE1-CD2 4.04Å; F1356-Y1364 AromaticContact CE2-CD2 3.46Å; F1356-Y1364 HydrophobicContact CE2-CD2 3.46Å; F1356-Y1364 VanDerWaalsContact CE2-CD2 3.46Å; F1356-Y1364 HydrophobicContact CE2-CE2 4.15Å; F1356-Y1364 HydrophobicContact CE2-CG 4.28Å; F1356-Y1364 HydrophobicContact CG-CD2 4.45Å; F1356-Y1364 AromaticContact CZ-CD2 3.52Å; F1356-Y1364 HydrophobicContact CZ-CD2 3.52Å; F1356-Y1364 HydrophobicContact CZ-CE2 4.3Å; F1356-Y1364 HydrophobicContact CZ-CG 4.45Å; Y1364-H1366 HydrophobicContact CE1-CB 4.27Å; Y1364-H1366 PolarHBondContact OH-CD2 2.75Å; Y1364-H1366 VanDerWaalsContact OH-CD2 3.3Å
1365	R	72.8	Confident	66.9	Low	227 Å²	227	99.4 Å²	99.4	86%	0.857	53%	0.533	S	S	*	.			trans	-123.2	122.9	172.3	-67.8	-174.3	-178.7	-178.5	0.1	109.6	A1363	A1363-R1365 PolarHBondContact O-N 2.8Å
1366	H	66.5	Low	64.3	Low	95 Å²	95	108.2 Å²	108.2	44%	0.44	57%	0.571	S	S	.	*	P	Polyproline II helix	trans	-78.9	139.3	175.8	-163.1	-78	0	0	0	110.1	Y1364	Y1364-H1366 HydrophobicContact CE1-CB 4.27Å; Y1364-H1366 PolarHBondContact OH-CD2 2.75Å; Y1364-H1366 VanDerWaalsContact OH-CD2 3.3Å
1367	I	61.8	Low	61.7	Low	142 Å²	142	112.3 Å²	112.3	73%	0.728	60%	0.602	S	S	*	*	P	Polyproline II helix	trans	-78.7	124.2	170.8	-62.7	173.3	0	0	0	107.4	Y1369	I1367-Y1369 PolarHBondContact O-N 2.72Å
1368	P	49.4	Very low	59.3	Low	113 Å²	113	118.1 Å²	118.1	73%	0.734	63%	0.629	S	S	*	*	P	Polyproline II helix	trans	-55.2	130.1	175.4	-21.5	31.3	0	0	0	110	L1370	P1368-L1370 PolarHBondContact O-N 2.75Å
1369	Y	49.2	Very low	56.9	Low	178 Å²	178	122.4 Å²	122.4	70%	0.698	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-65.2	128.5	172.5	-134.8	-93.3	0	0	0	107.6	I1367 T1371	I1367-Y1369 PolarHBondContact O-N 2.72Å; Y1369-T1371 PolarHBondContact O-N 2.84Å
1370	L	42.5	Very low	54.3	Low	155 Å²	155	124.5 Å²	124.5	81%	0.812	66%	0.662	S	S	*	*			trans	-66.8	87.8	156.3	-76.5	161.2	0	0	0	105.3	P1368 E1372	P1368-L1370 PolarHBondContact O-N 2.75Å; L1370-E1372 VanDerWaalsContact C-N 3.29Å; L1370-E1372 PolarHBondContact O-N 2.86Å
1371	T	42.4	Very low	52.1	Low	114 Å²	114	124.7 Å²	124.7	70%	0.699	67%	0.665	S	S	*	*			trans	-57.7	107.4	154.8	40.8	0	0	0	0	104.5	Y1369 V1373	Y1369-T1371 PolarHBondContact O-N 2.84Å; T1371-V1373 PolarHBondContact O-N 2.96Å
1372	E	40.1	Very low	49.8	Very low	159 Å²	159	123.8 Å²	123.8	74%	0.743	66%	0.656	S	S	*	*			trans	-44.5	114.6	174.4	-77.6	179.8	163.9	0	0	108.3	L1370 G1374 A1375	L1370-E1372 VanDerWaalsContact C-N 3.29Å; L1370-E1372 PolarHBondContact O-N 2.86Å; E1372-G1374 PolarHBondContact O-N 3.12Å; E1372-A1375 PolarHBondContact O-N 2.92Å
1373	V	40.3	Very low	47.5	Very low	149 Å²	149	118.8 Å²	118.8	90%	0.903	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.2	109.3	179.3	178.3	0	0	0	0	106.7	T1371	T1371-V1373 PolarHBondContact O-N 2.96Å
1374	G	38.1	Very low	45.3	Very low	80 Å²	80	122 Å²	122	83%	0.825	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	104.3	-7.5	167.2	0	0	0	0	0	117.3	E1372 K1376	E1372-G1374 PolarHBondContact O-N 3.12Å; G1374-K1376 PolarHBondContact O-N 2.95Å; G1374-K1376 VanDerWaalsContact O-N 3.09Å
1375	A	34.8	Very low	43.3	Very low	67 Å²	67	124.8 Å²	124.8	55%	0.554	68%	0.678	S	S	*	*			trans	-79.1	97.2	165.6	0	0	0	0	0	108.1	E1372	E1372-A1375 PolarHBondContact O-N 2.92Å
1376	K	35	Very low	41.5	Very low	184 Å²	184	122.1 Å²	122.1	80%	0.8	67%	0.667	S	S	*	*			trans	-40.8	132.5	156	-85.5	-178.9	177.3	177.2	0	106.2	G1374 Q1378	G1374-K1376 PolarHBondContact O-N 2.95Å; G1374-K1376 VanDerWaalsContact O-N 3.09Å; K1376-Q1378 VanDerWaalsContact C-N 3.26Å; K1376-Q1378 PolarHBondContact O-N 3.12Å
1377	P	36.3	Very low	39.8	Very low	123 Å²	123	128.1 Å²	128.1	80%	0.799	69%	0.686	S	S	*	*			trans	-53.7	102.6	177.9	22.1	-30.5	0	0	0	105.6	Q1379	P1377-Q1379 PolarHBondContact O-N 2.9Å
1378	Q	38.4	Very low	38.2	Very low	156 Å²	156	132 Å²	132	73%	0.729	70%	0.698	S	S	*	*			trans	-54.5	119.6	168.6	-79.1	178.5	-12.1	0	0	101.6	K1376 L1380	K1376-Q1378 VanDerWaalsContact C-N 3.26Å; K1376-Q1378 PolarHBondContact O-N 3.12Å; Q1378-L1380 PolarHBondContact O-N 2.71Å
1379	Q	39.2	Very low	37.7	Very low	192 Å²	192	133 Å²	133	90%	0.897	70%	0.696	S	S	*	*			trans	-51.3	98.2	166.3	-82.6	-179.5	-20	0	0	104	P1377 S1381	P1377-Q1379 PolarHBondContact O-N 2.9Å; Q1379-S1381 VanDerWaalsContact C-N 3.29Å; Q1379-S1381 PolarHBondContact O-N 3.08Å
1380	L	36.2	Very low	37.1	Very low	82 Å²	82	130.6 Å²	130.6	43%	0.429	70%	0.696	S	S	.	*			trans	-56.8	107.3	177.7	-75.7	162.7	0	0	0	102.5	Q1378 G1382 E1384 L1385	Q1378-L1380 PolarHBondContact O-N 2.71Å; L1380-G1382 PolarHBondContact O-N 2.93Å; L1380-E1384 HydrophobicContact CB-CB 4.24Å; L1380-E1384 HydrophobicContact CD2-CB 3.82Å; L1380-E1384 VanDerWaalsContact CD2-OE2 3.23Å; L1380-E1384 WeakPolarHBondContact CD2-OE2 3.35Å; L1380-L1385 HydrophobicContact CB-CD1 4.15Å; L1380-L1385 HydrophobicContact CB-CG 4.2Å
1381	S	39.4	Very low	36.8	Very low	64 Å²	64	129.3 Å²	129.3	45%	0.448	69%	0.69	S	S	.	*			trans	-52.8	147.6	178.7	65.7	0	0	0	0	106.9	Q1379 S1383 E1384	Q1379-S1381 VanDerWaalsContact C-N 3.29Å; Q1379-S1381 PolarHBondContact O-N 3.08Å; S1381-S1383 CarbonylContact O-C 3.5Å; S1381-S1383 PolarHBondContact O-N 3.03Å; S1381-S1383 PolarHBondContact OG-OG 3.32Å; S1381-E1384 PolarHBondContact O-N 3.49Å
1382	G	37.4	Very low	36.5	Very low	53 Å²	53	130.2 Å²	130.2	55%	0.546	69%	0.689	S	S	.	*	T	Hydrogen-bonded Turn	trans	-53.4	-13.3	-172.6	0	0	0	0	0	114.7	L1380 R1386	L1380-G1382 PolarHBondContact O-N 2.93Å; G1382-R1386 WeakPolarHBondContact O-CB 3.33Å; G1382-R1386 VanDerWaalsContact O-CD 3.29Å; G1382-R1386 WeakPolarHBondContact O-CD 3.48Å; G1382-R1386 WeakPolarHBondContact O-CG 3.42Å; G1382-R1386 PolarHBondContact O-N 3.36Å
1383	S	37.8	Very low	36.2	Very low	76 Å²	76	128.4 Å²	128.4	53%	0.531	69%	0.686	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.6	-35.6	170.5	63.2	0	0	0	0	114.3	S1381 R1386 R1387	S1381-S1383 CarbonylContact O-C 3.5Å; S1381-S1383 PolarHBondContact O-N 3.03Å; S1381-S1383 PolarHBondContact OG-OG 3.32Å; S1383-R1386 PolarHBondContact O-N 2.8Å; S1383-R1387 PolarHBondContact O-N 3.02Å
1384	E	33.8	Very low	36	Very low	93 Å²	93	127 Å²	127	44%	0.435	67%	0.671	S	S	.	*	T	Hydrogen-bonded Turn	trans	-81.6	-38.3	-178.9	-70.1	-171.7	136.9	0	0	112.5	L1380 S1381 R1386 R1387 K1388	L1380-E1384 HydrophobicContact CB-CB 4.24Å; L1380-E1384 HydrophobicContact CD2-CB 3.82Å; L1380-E1384 VanDerWaalsContact CD2-OE2 3.23Å; L1380-E1384 WeakPolarHBondContact CD2-OE2 3.35Å; S1381-E1384 PolarHBondContact O-N 3.49Å; E1384-R1386 PolarHBondContact O-N 3.03Å; E1384-R1387 PolarHBondContact O-N 3.01Å; E1384-K1388 PolarHBondContact O-N 3.45Å
1385	L	37.2	Very low	35.8	Very low	119 Å²	119	130.4 Å²	130.4	62%	0.623	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.2	-27.1	168.3	-103.8	154.2	0	0	0	112.2	L1380	L1380-L1385 HydrophobicContact CB-CD1 4.15Å; L1380-L1385 HydrophobicContact CB-CG 4.2Å
1386	R	35	Very low	35.9	Very low	170 Å²	170	135.2 Å²	135.2	64%	0.642	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.7	-11	174.9	-86.1	178	-177.9	-167.6	1.5	113.9	R1208 G1382 S1383 E1384	R1208-R1386 WeakPolarHBondContact CD-O 3.35Å; R1208-R1386 PolarHBondContact NH1-O 2.95Å; G1382-R1386 WeakPolarHBondContact O-CB 3.33Å; G1382-R1386 VanDerWaalsContact O-CD 3.29Å; G1382-R1386 WeakPolarHBondContact O-CD 3.48Å; G1382-R1386 WeakPolarHBondContact O-CG 3.42Å; G1382-R1386 PolarHBondContact O-N 3.36Å; S1383-R1386 PolarHBondContact O-N 2.8Å; E1384-R1386 PolarHBondContact O-N 3.03Å
1387	R	32.2	Very low	36	Very low	222 Å²	222	131.2 Å²	131.2	84%	0.838	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.6	-29.3	-175.6	-121	-177.3	-174	-179.5	2.8	113.4	S1383 E1384	S1383-R1387 PolarHBondContact O-N 3.02Å; E1384-R1387 PolarHBondContact O-N 3.01Å
1388	K	28.7	Very low	35.9	Very low	224 Å²	224	131.9 Å²	131.9	97%	0.974	65%	0.645	S	S	*	*			trans	-75	0	162.6	-81.4	-173.6	174.1	177.1	0	110	E1384	E1384-K1388 PolarHBondContact O-N 3.45Å

Retrieved 1,388 of 1,388 residues in 1974.3 ms (Link to these results)

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