A0A077ZAT7_TRITR Loading...

Protein clc isoform

AlphaFold DB , UniProt , Accession A0A077ZAT7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 209 aa.

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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	48.9	Very low	74	Confident	221 Å²	221	89.2 Å²	89.2	100%	1.089	48%	0.476	S	S	*	.				0	-31.8	0	-62.2	-172.4	-174.9	0	0	113.7	F3	M1-F3 VanDerWaalsContact C-N 3.27Å; M1-F3 PolarHBondContact O-N 3.38Å
2	Q	51.8	Low	75.4	Confident	168 Å²	168	90 Å²	90	79%	0.785	48%	0.48	S	S	*	.	H	α-helix	trans	-60.9	-28.8	179.9	-70.8	176.4	-34.6	0	0	115	G5 V6	Q2-G5 PolarHBondContact O-N 3Å; Q2-G5 VanDerWaalsContact O-N 3.16Å; Q2-V6 PolarHBondContact O-N 3.49Å
3	F	57.8	Low	76.7	Confident	82 Å²	82	87.1 Å²	87.1	36%	0.36	46%	0.464	S	S	.	.	H	α-helix	trans	-73.8	-33.7	-173.8	-60.2	-71.7	0	0	0	114.2	M1 G5 V6 Q7	M1-F3 VanDerWaalsContact C-N 3.27Å; M1-F3 PolarHBondContact O-N 3.38Å; F3-G5 PolarHBondContact O-N 2.88Å; F3-V6 PolarHBondContact O-N 2.81Å; F3-Q7 PolarHBondContact O-N 3.32Å
4	A	68.1	Low	77.7	Confident	56 Å²	56	80.9 Å²	80.9	46%	0.463	43%	0.431	S	S	.	.	H	α-helix	trans	-63	-34	169.9	0	0	0	0	0	110.9	Q7 I8	A4-Q7 PolarHBondContact O-N 3.14Å; A4-I8 WeakPolarHBondContact O-CB 3.35Å; A4-I8 WeakPolarHBondContact O-CD1 3.41Å; A4-I8 WeakPolarHBondContact O-CG1 3.31Å; A4-I8 PolarHBondContact O-N 3.39Å
5	G	78.5	Confident	78.7	Confident	33 Å²	33	81.4 Å²	81.4	34%	0.34	43%	0.433	S	S	.	.	H	α-helix	trans	-61	-49.4	178	0	0	0	0	0	113	Q2 F3 Q7 I8 V9	Q2-G5 PolarHBondContact O-N 3Å; Q2-G5 VanDerWaalsContact O-N 3.16Å; F3-G5 PolarHBondContact O-N 2.88Å; G5-Q7 VanDerWaalsContact C-N 3.33Å; G5-Q7 PolarHBondContact O-N 2.78Å; G5-I8 PolarHBondContact O-N 3.49Å; G5-V9 WeakPolarHBondContact O-CB 3.44Å; G5-V9 VanDerWaalsContact O-CG2 3.25Å; G5-V9 WeakPolarHBondContact O-CG2 3.41Å; G5-V9 PolarHBondContact O-N 3.28Å
6	V	81.5	Confident	79.6	Confident	64 Å²	64	79.2 Å²	79.2	39%	0.388	43%	0.43	S	S	.	.	H	α-helix	trans	-63.3	-40.5	-179.3	-177.5	0	0	0	0	111.3	Q2 F3 S10 S198	Q2-V6 PolarHBondContact O-N 3.49Å; F3-V6 PolarHBondContact O-N 2.81Å; V6-S10 VanDerWaalsContact O-CB 3.32Å; V6-S10 WeakPolarHBondContact O-CB 3.42Å; V6-S10 PolarHBondContact O-N 3.46Å; V6-S10 PolarHBondContact O-OG 2.99Å; V6-S198 VanDerWaalsContact CG1-OG 3.28Å; V6-S198 WeakPolarHBondContact CG1-OG 3.42Å
7	Q	81.3	Confident	80.2	Confident	99 Å²	99	74.5 Å²	74.5	46%	0.463	40%	0.404	S	S	.	.	H	α-helix	trans	-65	-43.8	177.2	-174.3	177.9	-20.7	0	0	111.9	F3 A4 G5 S10 F11 L195	F3-Q7 PolarHBondContact O-N 3.32Å; A4-Q7 PolarHBondContact O-N 3.14Å; G5-Q7 VanDerWaalsContact C-N 3.33Å; G5-Q7 PolarHBondContact O-N 2.78Å; Q7-S10 PolarHBondContact O-N 3.1Å; Q7-F11 PolarHBondContact O-N 3.13Å; Q7-L195 HydrophobicContact CG-CD2 4.22Å
8	I	84	Confident	80.8	Confident	102 Å²	102	70.6 Å²	70.6	52%	0.523	38%	0.383	S	S	.	.	H	α-helix	trans	-63.5	-47.5	177.1	-67.2	162.9	0	0	0	110.5	A4 G5 S10 F11 L12	A4-I8 WeakPolarHBondContact O-CB 3.35Å; A4-I8 WeakPolarHBondContact O-CD1 3.41Å; A4-I8 WeakPolarHBondContact O-CG1 3.31Å; A4-I8 PolarHBondContact O-N 3.39Å; G5-I8 PolarHBondContact O-N 3.49Å; I8-S10 VanDerWaalsContact C-N 3.29Å; I8-S10 PolarHBondContact O-N 3.46Å; I8-F11 WeakPolarHBondContact O-CB 3.44Å; I8-F11 PolarHBondContact O-N 3.32Å; I8-F11 VanDerWaalsContact O-N 3.14Å; I8-L12 HydrophobicContact CG2-CD1 4.21Å; I8-L12 HydrophobicContact CG2-CG 4.49Å; I8-L12 WeakPolarHBondContact O-CG 3.49Å; I8-L12 PolarHBondContact O-N 3.14Å
9	V	88.2	Confident	81.4	Confident	82 Å²	82	69.5 Å²	69.5	50%	0.497	39%	0.385	S	S	.	.	H	α-helix	trans	-60.3	-41.8	177.6	171.7	0	0	0	0	110.7	G5 F11 L12 L13	G5-V9 WeakPolarHBondContact O-CB 3.44Å; G5-V9 VanDerWaalsContact O-CG2 3.25Å; G5-V9 WeakPolarHBondContact O-CG2 3.41Å; G5-V9 PolarHBondContact O-N 3.28Å; V9-F11 VanDerWaalsContact C-N 3.33Å; V9-F11 PolarHBondContact O-N 3.42Å; V9-L12 PolarHBondContact O-N 2.85Å; V9-L13 HydrophobicContact CG1-CD1 4.09Å; V9-L13 HydrophobicContact CG1-CG 4.47Å; V9-L13 WeakPolarHBondContact O-CB 3.49Å; V9-L13 WeakPolarHBondContact O-CG 3.38Å; V9-L13 PolarHBondContact O-N 2.63Å
10	S	87.9	Confident	81.9	Confident	3 Å²	3	68.9 Å²	68.9	2%	0.021	38%	0.38	C	S	.	.	H	α-helix	trans	-63.9	-39.3	176.7	-54	0	0	0	0	111.6	V6 Q7 I8 L13 L14 S191 G194 L195	V6-S10 VanDerWaalsContact O-CB 3.32Å; V6-S10 WeakPolarHBondContact O-CB 3.42Å; V6-S10 PolarHBondContact O-N 3.46Å; V6-S10 PolarHBondContact O-OG 2.99Å; Q7-S10 PolarHBondContact O-N 3.1Å; I8-S10 VanDerWaalsContact C-N 3.29Å; I8-S10 PolarHBondContact O-N 3.46Å; S10-L13 PolarHBondContact O-N 3.41Å; S10-L14 PolarHBondContact O-N 3.17Å; S10-S191 VanDerWaalsContact O-CB 3.29Å; S10-S191 WeakPolarHBondContact O-CB 3.29Å; S10-S191 PolarHBondContact O-OG 2.88Å; S10-G194 VanDerWaalsContact OG-C 3.3Å; S10-G194 WeakPolarHBondContact OG-CA 2.93Å; S10-L195 PolarHBondContact OG-N 2.86Å
11	F	86.1	Confident	82.3	Confident	71 Å²	71	65.6 Å²	65.6	31%	0.311	36%	0.362	S	S	.	.	H	α-helix	trans	-66.3	-41.2	176	-171.2	-98.2	0	0	0	112.2	Q7 I8 V9 L13 L14 L15 L118	Q7-F11 PolarHBondContact O-N 3.13Å; I8-F11 WeakPolarHBondContact O-CB 3.44Å; I8-F11 PolarHBondContact O-N 3.32Å; I8-F11 VanDerWaalsContact O-N 3.14Å; V9-F11 VanDerWaalsContact C-N 3.33Å; V9-F11 PolarHBondContact O-N 3.42Å; F11-L13 VanDerWaalsContact C-N 3.35Å; F11-L14 WeakPolarHBondContact O-CB 3.37Å; F11-L14 PolarHBondContact O-N 3.09Å; F11-L15 PolarHBondContact O-N 3.17Å; F11-L118 HydrophobicContact CD2-CD2 4.21Å; F11-L118 HydrophobicContact CE1-CD2 4.39Å; F11-L118 HydrophobicContact CE2-CD2 3.56Å; F11-L118 HydrophobicContact CZ-CD2 3.68Å
12	L	91.3	Very high	84.3	Confident	99 Å²	99	58.9 Å²	58.9	52%	0.518	33%	0.33	S	S	.	.	H	α-helix	trans	-63.4	-40.5	174	-68.6	175.2	0	0	0	111.9	I8 V9 L14 L15 A16	I8-L12 HydrophobicContact CG2-CD1 4.21Å; I8-L12 HydrophobicContact CG2-CG 4.49Å; I8-L12 WeakPolarHBondContact O-CG 3.49Å; I8-L12 PolarHBondContact O-N 3.14Å; V9-L12 PolarHBondContact O-N 2.85Å; L12-L14 VanDerWaalsContact C-N 3.32Å; L12-L14 PolarHBondContact O-N 3.44Å; L12-L15 PolarHBondContact O-N 2.95Å; L12-A16 WeakPolarHBondContact O-CB 3.24Å; L12-A16 PolarHBondContact O-N 3.2Å
13	L	91.9	Very high	86.2	Confident	52 Å²	52	54 Å²	54	27%	0.272	31%	0.312	S	S	.	.	H	α-helix	trans	-62.9	-38	173.4	-75.3	170.1	0	0	0	111.9	V9 S10 F11 G17 L190	V9-L13 HydrophobicContact CG1-CD1 4.09Å; V9-L13 HydrophobicContact CG1-CG 4.47Å; V9-L13 WeakPolarHBondContact O-CB 3.49Å; V9-L13 WeakPolarHBondContact O-CG 3.38Å; V9-L13 PolarHBondContact O-N 2.63Å; S10-L13 PolarHBondContact O-N 3.41Å; F11-L13 VanDerWaalsContact C-N 3.35Å; L13-G17 PolarHBondContact O-N 3.09Å; L13-L190 HydrophobicContact CD1-CB 4.26Å
14	L	90.7	Very high	87.6	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-65.5	-45.5	175.1	-174.3	56.4	0	0	0	111.4	S10 F11 L12 G17 T18 L118 V136 Q188 S191	S10-L14 PolarHBondContact O-N 3.17Å; F11-L14 WeakPolarHBondContact O-CB 3.37Å; F11-L14 PolarHBondContact O-N 3.09Å; L12-L14 VanDerWaalsContact C-N 3.32Å; L12-L14 PolarHBondContact O-N 3.44Å; L14-G17 PolarHBondContact O-N 3.34Å; L14-T18 WeakPolarHBondContact O-CB 3.23Å; L14-T18 PolarHBondContact O-N 2.89Å; L14-T18 PolarHBondContact O-OG1 3.46Å; L14-L118 HydrophobicContact CB-CD2 4.18Å; L14-L118 HydrophobicContact CD2-CD2 3.75Å; L14-L118 HydrophobicContact CD2-CG 4.06Å; L14-L118 HydrophobicContact CG-CD2 3.77Å; L14-L118 HydrophobicContact CG-CG 4.07Å; L14-V136 HydrophobicContact CD1-CG1 3.62Å; L14-V136 HydrophobicContact CD1-CG2 4.06Å; L14-V136 HydrophobicContact CD2-CG2 3.71Å; L14-Q188 HydrophobicContact CD1-CG 4.34Å; L14-S191 WeakPolarHBondContact CB-OG 3.09Å
15	L	92.2	Very high	88.5	Confident	89 Å²	89	48.3 Å²	48.3	47%	0.466	28%	0.277	S	S	.	.	H	α-helix	trans	-60.9	-48.9	178.3	-175.7	68.9	0	0	0	110.8	F11 L12 T18 A19 L118	F11-L15 PolarHBondContact O-N 3.17Å; L12-L15 PolarHBondContact O-N 2.95Å; L15-T18 PolarHBondContact O-N 2.93Å; L15-A19 WeakPolarHBondContact O-CB 3.34Å; L15-A19 PolarHBondContact O-N 3.26Å; L15-L118 HydrophobicContact CB-CD2 4.41Å; L15-L118 HydrophobicContact CD1-CD1 4.04Å; L15-L118 HydrophobicContact CD1-CD2 4.49Å
16	A	93	Very high	88.7	Confident	46 Å²	46	50.7 Å²	50.7	38%	0.38	29%	0.294	S	S	.	.	H	α-helix	trans	-60.8	-47.7	176	0	0	0	0	0	111.4	L12 T18 A19 L20	L12-A16 WeakPolarHBondContact O-CB 3.24Å; L12-A16 PolarHBondContact O-N 3.2Å; A16-T18 PolarHBondContact O-N 3.21Å; A16-A19 PolarHBondContact O-N 3.43Å; A16-L20 WeakPolarHBondContact O-CB 3.19Å; A16-L20 VanDerWaalsContact O-CG 3.25Å; A16-L20 WeakPolarHBondContact O-CG 3.37Å; A16-L20 PolarHBondContact O-N 3.18Å
17	G	90.4	Very high	88.7	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-60.5	-43.1	178.8	0	0	0	0	0	112.8	L13 L14 L20 V21	L13-G17 PolarHBondContact O-N 3.09Å; L14-G17 PolarHBondContact O-N 3.34Å; G17-L20 PolarHBondContact O-N 3.44Å; G17-V21 WeakPolarHBondContact O-CG2 3.36Å; G17-V21 PolarHBondContact O-N 3.04Å
18	T	90.8	Very high	88.3	Confident	4 Å²	4	46.1 Å²	46.1	3%	0.025	27%	0.274	C	S	.	.	H	α-helix	trans	-64.3	-44.5	177.1	-51.8	0	0	0	0	111.4	L14 L15 A16 L20 V21 I22 S114 V115 L118	L14-T18 WeakPolarHBondContact O-CB 3.23Å; L14-T18 PolarHBondContact O-N 2.89Å; L14-T18 PolarHBondContact O-OG1 3.46Å; L15-T18 PolarHBondContact O-N 2.93Å; A16-T18 PolarHBondContact O-N 3.21Å; T18-L20 VanDerWaalsContact C-N 3.35Å; T18-L20 PolarHBondContact O-N 3.46Å; T18-V21 PolarHBondContact O-N 2.91Å; T18-I22 HydrophobicContact CG2-CD1 3.9Å; T18-I22 HydrophobicContact CG2-CG1 4.49Å; T18-I22 VanDerWaalsContact O-CG1 3.3Å; T18-I22 WeakPolarHBondContact O-CG1 3.33Å; T18-I22 PolarHBondContact O-N 3.39Å; T18-S114 WeakPolarHBondContact OG1-CB 3.33Å; T18-V115 HydrophobicContact CG2-CG2 3.78Å; T18-L118 HydrophobicContact CG2-CD1 4.05Å
19	A	92.6	Very high	88.1	Confident	50 Å²	50	44 Å²	44	41%	0.413	26%	0.262	S	S	.	.	H	α-helix	trans	-62.1	-42.2	176.7	0	0	0	0	0	111.8	L15 A16 I22 T23	L15-A19 WeakPolarHBondContact O-CB 3.34Å; L15-A19 PolarHBondContact O-N 3.26Å; A16-A19 PolarHBondContact O-N 3.43Å; A19-I22 PolarHBondContact O-N 3.42Å; A19-T23 VanDerWaalsContact O-CB 3.29Å; A19-T23 WeakPolarHBondContact O-CB 3.34Å; A19-T23 PolarHBondContact O-N 2.91Å; A19-T23 PolarHBondContact O-OG1 3.22Å
20	L	92.1	Very high	87.7	Confident	56 Å²	56	40.1 Å²	40.1	29%	0.293	24%	0.238	S	C	.	.	H	α-helix	trans	-63.2	-45.7	175.3	-68.7	170.7	0	0	0	111.3	A16 G17 T18 T23 S24 I180 A183	A16-L20 WeakPolarHBondContact O-CB 3.19Å; A16-L20 VanDerWaalsContact O-CG 3.25Å; A16-L20 WeakPolarHBondContact O-CG 3.37Å; A16-L20 PolarHBondContact O-N 3.18Å; G17-L20 PolarHBondContact O-N 3.44Å; T18-L20 VanDerWaalsContact C-N 3.35Å; T18-L20 PolarHBondContact O-N 3.46Å; L20-T23 PolarHBondContact O-N 3.27Å; L20-S24 WeakPolarHBondContact O-CB 3.2Å; L20-S24 PolarHBondContact O-N 3.14Å; L20-I180 HydrophobicContact CB-CG2 3.96Å; L20-I180 HydrophobicContact CD2-CG2 3.85Å; L20-I180 VanDerWaalsContact O-CG2 3.27Å; L20-I180 WeakPolarHBondContact O-CG2 3.34Å; L20-A183 HydrophobicContact CD1-CB 4.21Å
21	V	89.9	Confident	87.2	Confident	0 Å²	0	40 Å²	40	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-60.8	-48	177.2	168.5	0	0	0	0	111.1	G17 T18 T23 S24 I25 M107 A111 T143	G17-V21 WeakPolarHBondContact O-CG2 3.36Å; G17-V21 PolarHBondContact O-N 3.04Å; T18-V21 PolarHBondContact O-N 2.91Å; V21-T23 VanDerWaalsContact C-N 3.33Å; V21-T23 PolarHBondContact O-N 3.42Å; V21-S24 PolarHBondContact O-N 3.46Å; V21-S24 PolarHBondContact O-OG 3.03Å; V21-I25 HydrophobicContact CG1-CD1 3.95Å; V21-I25 VanDerWaalsContact O-CG1 3.3Å; V21-I25 WeakPolarHBondContact O-CG1 3.33Å; V21-I25 PolarHBondContact O-N 3.48Å; V21-M107 HydrophobicContact CG1-CE 3.9Å; V21-A111 HydrophobicContact CG1-CB 4.11Å; V21-T143 HydrophobicContact CG2-CG2 4.03Å
22	I	91	Very high	86.5	Confident	81 Å²	81	38.8 Å²	38.8	42%	0.415	23%	0.231	S	C	.	.	H	α-helix	trans	-60.3	-44	177	-67.4	168	0	0	0	110.9	T18 A19 S24 I25 A26 A111 V115	T18-I22 HydrophobicContact CG2-CD1 3.9Å; T18-I22 HydrophobicContact CG2-CG1 4.49Å; T18-I22 VanDerWaalsContact O-CG1 3.3Å; T18-I22 WeakPolarHBondContact O-CG1 3.33Å; T18-I22 PolarHBondContact O-N 3.39Å; A19-I22 PolarHBondContact O-N 3.42Å; I22-S24 VanDerWaalsContact C-N 3.33Å; I22-S24 PolarHBondContact O-N 3.24Å; I22-I25 PolarHBondContact O-N 2.96Å; I22-A26 WeakPolarHBondContact O-CB 3.42Å; I22-A26 PolarHBondContact O-N 3.25Å; I22-A111 HydrophobicContact CG1-CB 4.11Å; I22-V115 HydrophobicContact CD1-CG2 4.07Å
23	T	90.3	Very high	85.4	Confident	66 Å²	66	35.1 Å²	35.1	41%	0.405	21%	0.211	S	C	.	.	H	α-helix	trans	-63.3	-40.6	178	-55.8	0	0	0	0	111.1	A19 L20 V21 I25 A26 T27	A19-T23 VanDerWaalsContact O-CB 3.29Å; A19-T23 WeakPolarHBondContact O-CB 3.34Å; A19-T23 PolarHBondContact O-N 2.91Å; A19-T23 PolarHBondContact O-OG1 3.22Å; L20-T23 PolarHBondContact O-N 3.27Å; V21-T23 VanDerWaalsContact C-N 3.33Å; V21-T23 PolarHBondContact O-N 3.42Å; T23-I25 VanDerWaalsContact C-N 3.34Å; T23-I25 PolarHBondContact O-N 3.23Å; T23-A26 PolarHBondContact O-N 2.96Å; T23-T27 HydrophobicContact CG2-CG2 4.19Å; T23-T27 WeakPolarHBondContact O-CB 3.39Å; T23-T27 VanDerWaalsContact O-CG2 3.25Å; T23-T27 WeakPolarHBondContact O-CG2 3.47Å; T23-T27 PolarHBondContact O-N 2.89Å; T23-T27 PolarHBondContact O-OG1 3.39Å
24	S	87.9	Confident	83.8	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-62.7	-41.5	176.3	74.4	0	0	0	0	111.5	L20 V21 I22 T27 W30 M107 S177	L20-S24 WeakPolarHBondContact O-CB 3.2Å; L20-S24 PolarHBondContact O-N 3.14Å; V21-S24 PolarHBondContact O-N 3.46Å; V21-S24 PolarHBondContact O-OG 3.03Å; I22-S24 VanDerWaalsContact C-N 3.33Å; I22-S24 PolarHBondContact O-N 3.24Å; S24-T27 PolarHBondContact O-N 2.96Å; S24-T27 PolarHBondContact O-OG1 3.36Å; S24-W30 PolarHBondContact O-NE1 3.27Å; S24-M107 WeakPolarHBondContact OG-CE 3.46Å; S24-S177 WeakPolarHBondContact CB-O 3.24Å
25	I	86.4	Confident	82.1	Confident	17 Å²	17	35.6 Å²	35.6	9%	0.087	22%	0.219	C	C	.	.	H	α-helix	trans	-64.9	-43.1	178.1	-65.5	164.2	0	0	0	110.4	V21 I22 T23 T27 W52 L104 M107 A111	V21-I25 HydrophobicContact CG1-CD1 3.95Å; V21-I25 VanDerWaalsContact O-CG1 3.3Å; V21-I25 WeakPolarHBondContact O-CG1 3.33Å; V21-I25 PolarHBondContact O-N 3.48Å; I22-I25 PolarHBondContact O-N 2.96Å; T23-I25 VanDerWaalsContact C-N 3.34Å; T23-I25 PolarHBondContact O-N 3.23Å; I25-T27 VanDerWaalsContact C-N 3.32Å; I25-T27 PolarHBondContact O-N 3.46Å; I25-W52 HydrophobicContact CG2-CZ2 4.48Å; I25-W52 PolarHBondContact O-NE1 2.66Å; I25-L104 HydrophobicContact CG2-CD1 4.3Å; I25-M107 HydrophobicContact CD1-CB 3.84Å; I25-M107 WeakPolarHBondContact CD1-O 3.4Å; I25-M107 HydrophobicContact CG1-CB 3.8Å; I25-M107 HydrophobicContact CG1-CE 4.38Å; I25-A111 HydrophobicContact CD1-CB 3.96Å
26	A	83.3	Confident	80	Confident	83 Å²	83	34.1 Å²	34.1	69%	0.686	23%	0.226	S	C	*	.	H	α-helix	trans	-72.6	-22.7	-177.5	0	0	0	0	0	113.8	I22 T23	I22-A26 WeakPolarHBondContact O-CB 3.42Å; I22-A26 PolarHBondContact O-N 3.25Å; T23-A26 PolarHBondContact O-N 2.96Å
27	T	82.6	Confident	77.7	Confident	44 Å²	44	35.3 Å²	35.3	27%	0.27	23%	0.225	S	C	.	.			trans	-91.5	138.4	-174.8	46.9	0	0	0	0	112.1	T23 S24 I25 H29 S177	T23-T27 HydrophobicContact CG2-CG2 4.19Å; T23-T27 WeakPolarHBondContact O-CB 3.39Å; T23-T27 VanDerWaalsContact O-CG2 3.25Å; T23-T27 WeakPolarHBondContact O-CG2 3.47Å; T23-T27 PolarHBondContact O-N 2.89Å; T23-T27 PolarHBondContact O-OG1 3.39Å; S24-T27 PolarHBondContact O-N 2.96Å; S24-T27 PolarHBondContact O-OG1 3.36Å; I25-T27 VanDerWaalsContact C-N 3.32Å; I25-T27 PolarHBondContact O-N 3.46Å; T27-H29 PolarHBondContact O-N 3.33Å; T27-S177 WeakPolarHBondContact CB-OG 3.21Å; T27-S177 WeakPolarHBondContact OG1-CB 3.23Å; T27-S177 PolarHBondContact OG1-OG 3.21Å
28	S	71.6	Confident	75.5	Confident	23 Å²	23	38.4 Å²	38.4	16%	0.161	26%	0.257	C	S	.	.	S	Bend	trans	-87.3	27.2	-175.6	56.6	0	0	0	0	114	R49 G50	S28-R49 CarbonylContact O-C 3.58Å; S28-G50 VanDerWaalsContact C-CA 3.45Å; S28-G50 VanDerWaalsContact CA-CA 3.47Å; S28-G50 PolarHBondContact O-N 2.88Å
29	H	79.9	Confident	73.3	Confident	59 Å²	59	44.4 Å²	44.4	27%	0.273	29%	0.288	S	S	.	.			trans	-125.3	45.3	-163.6	-73.1	-16.6	0	0	0	112.8	T27 Y32 Y48 G175 W176 S177	T27-H29 PolarHBondContact O-N 3.33Å; H29-Y32 HydrophobicContact CB-CE1 3.91Å; H29-Y32 VanDerWaalsContact CB-OH 3.22Å; H29-Y32 WeakPolarHBondContact CB-OH 3.48Å; H29-Y32 AromaticContact CG-CE1 3.91Å; H29-Y32 AromaticContact ND1-CE1 3.64Å; H29-Y48 AromaticContact CE1-CD1 3.61Å; H29-Y48 AromaticContact ND1-CD1 3.49Å; H29-Y48 WeakPolarHBondContact ND1-CD1 3.2Å; H29-G175 CarbonylContact O-C 3.6Å; H29-G175 WeakPolarHBondContact O-CA 3.34Å; H29-W176 PolarHBondContact O-N 3.25Å; H29-S177 VanDerWaalsContact C-CB 3.45Å; H29-S177 VanDerWaalsContact C-OG 3.27Å; H29-S177 WeakPolarHBondContact CA-OG 3.3Å; H29-S177 VanDerWaalsContact CB-OG 3.28Å; H29-S177 WeakPolarHBondContact CB-OG 3.45Å; H29-S177 PolarHBondContact N-OG 2.94Å; H29-S177 VanDerWaalsContact O-CB 3.23Å; H29-S177 WeakPolarHBondContact O-CB 3.33Å; H29-S177 PolarHBondContact O-N 3.38Å; H29-S177 PolarHBondContact O-OG 2.87Å
30	W	80.4	Confident	71.5	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	30%	0.3	C	S	.	.	S	Bend	trans	-81.7	-40.4	-179.4	-81	68.1	0	0	0	112.8	S24 R49 L51 M107 Y150 G175 S177 Y178 A181	S24-W30 PolarHBondContact O-NE1 3.27Å; W30-R49 WeakPolarHBondContact CB-O 3.43Å; W30-R49 PolarHBondContact N-O 2.93Å; W30-L51 HydrophobicContact CD2-CD1 3.58Å; W30-L51 HydrophobicContact CE3-CD1 3.86Å; W30-L51 HydrophobicContact CG-CD1 4.02Å; W30-L51 HydrophobicContact CH2-CD1 4.18Å; W30-L51 HydrophobicContact CH2-CD2 4.36Å; W30-L51 HydrophobicContact CZ2-CD1 3.94Å; W30-L51 HydrophobicContact CZ2-CD2 3.86Å; W30-L51 HydrophobicContact CZ2-CG 4.48Å; W30-L51 HydrophobicContact CZ3-CD1 4.14Å; W30-M107 HydrophobicContact CH2-CE 3.85Å; W30-M107 HydrophobicContact CH2-CG 4.16Å; W30-M107 HydrophobicContact CH2-SD 4.25Å; W30-M107 HydrophobicContact CZ2-CE 4.11Å; W30-Y150 HydrophobicContact CB-CE1 4.25Å; W30-Y150 HydrophobicContact CB-CE2 4.27Å; W30-Y150 HydrophobicContact CE3-CD1 4.07Å; W30-Y150 AromaticContact CE3-CD2 3.95Å; W30-Y150 HydrophobicContact CE3-CD2 3.95Å; W30-Y150 HydrophobicContact CE3-CE1 4.22Å; W30-Y150 HydrophobicContact CE3-CE2 4.1Å; W30-Y150 AromaticContact CE3-CG 3.95Å; W30-Y150 HydrophobicContact CE3-CG 3.95Å; W30-Y150 HydrophobicContact CZ3-CD2 4.37Å; W30-Y150 HydrophobicContact CZ3-CG 4.22Å; W30-G175 PolarHBondContact O-N 3.45Å; W30-S177 VanDerWaalsContact CD1-CB 3.44Å; W30-Y178 HydrophobicContact CE3-CD2 4.19Å; W30-Y178 HydrophobicContact CZ3-CD2 4.3Å; W30-Y178 WeakPolarHBondContact O-CB 3.18Å; W30-A181 HydrophobicContact CH2-CB 3.71Å; W30-A181 HydrophobicContact CZ2-CB 4.05Å; W30-A181 HydrophobicContact CZ3-CB 4.35Å
31	S	76.4	Confident	69.5	Low	0 Å²	0	47.7 Å²	47.7	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	156.1	168.8	66.1	0	0	0	0	111.5	R49 Y150 T173	S31-R49 PolarHBondContact N-O 2.96Å; S31-R49 VanDerWaalsContact N-O 3.16Å; S31-R49 PolarHBondContact O-N 3.36Å; S31-Y150 WeakPolarHBondContact CB-OH 3.45Å; S31-Y150 PolarHBondContact OG-OH 3.43Å; S31-T173 CarbonylContact C-O 3.43Å; S31-T173 WeakPolarHBondContact CA-O 3.28Å; S31-T173 VanDerWaalsContact CB-O 3.3Å; S31-T173 WeakPolarHBondContact CB-O 3.2Å
32	Y	71.6	Confident	67.8	Low	46 Å²	46	49.8 Å²	49.8	18%	0.18	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	130.1	174.2	-44.2	-55.9	0	0	0	108.5	H29 N47 Y48 T173	H29-Y32 HydrophobicContact CB-CE1 3.91Å; H29-Y32 VanDerWaalsContact CB-OH 3.22Å; H29-Y32 WeakPolarHBondContact CB-OH 3.48Å; H29-Y32 AromaticContact CG-CE1 3.91Å; H29-Y32 AromaticContact ND1-CE1 3.64Å; Y32-N47 WeakPolarHBondContact CA-O 3.23Å; Y32-Y48 AromaticContact CD1-CD1 3.07Å; Y32-Y48 HydrophobicContact CD1-CD1 3.07Å; Y32-Y48 AromaticContact CD1-CE1 3.4Å; Y32-Y48 HydrophobicContact CD1-CE1 3.4Å; Y32-Y48 AromaticContact CD1-CG 3.78Å; Y32-Y48 HydrophobicContact CD1-CG 3.78Å; Y32-Y48 AromaticContact CE1-CD1 3.03Å; Y32-Y48 HydrophobicContact CE1-CD1 3.03Å; Y32-Y48 AromaticContact CE1-CE1 3.35Å; Y32-Y48 HydrophobicContact CE1-CE1 3.35Å; Y32-Y48 HydrophobicContact CE1-CG 4.08Å; Y32-Y48 HydrophobicContact CG-CD1 4.19Å; Y32-Y48 HydrophobicContact CG-CE1 4.16Å; Y32-Y48 AromaticContact CZ-CE1 3.97Å; Y32-T173 PolarHBondContact N-O 3.34Å; Y32-T173 PolarHBondContact O-N 3.16Å; Y32-T173 PolarHBondContact O-OG1 2.93Å
33	D	67.5	Low	66	Low	21 Å²	21	52.1 Å²	52.1	11%	0.112	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	107.3	174.4	179	-6	0	0	0	106.3	S35 N47 R49 V172	D33-S35 PolarHBondContact O-N 3.43Å; D33-S35 PolarHBondContact OD1-OG 3.49Å; D33-N47 HydrophobicContact CB-CB 4.12Å; D33-N47 PolarHBondContact N-O 3.34Å; D33-N47 PolarHBondContact O-N 3.41Å; D33-R49 IonicContact OD2-CZ 2.69Å; D33-R49 IonicContact OD2-NH2 3.74Å; D33-R49 PolarHBondContact OD2-NH2 2.87Å; D33-V172 HydrophobicContact CB-CG2 4.42Å
34	S	60.3	Low	64.3	Low	43 Å²	43	52.1 Å²	52.1	30%	0.301	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	94.4	174.6	56.2	0	0	0	0	107.5	G36 T171	S34-G36 PolarHBondContact O-N 3.49Å; S34-T171 PolarHBondContact OG-OG1 2.98Å
35	S	54.5	Low	63	Low	20 Å²	20	54.6 Å²	54.6	14%	0.14	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	97	172.1	-35.6	0	0	0	0	106.7	D33 L37 L45 N47	D33-S35 PolarHBondContact O-N 3.43Å; D33-S35 PolarHBondContact OD1-OG 3.49Å; S35-L37 PolarHBondContact O-N 3.14Å; S35-L45 PolarHBondContact N-O 3.01Å; S35-N47 PolarHBondContact OG-ND2 2.68Å
36	G	47.7	Very low	61.9	Low	58 Å²	58	56.4 Å²	56.4	60%	0.598	35%	0.354	S	S	*	.			trans	-72	44.1	174.8	0	0	0	0	0	112.9	S34 G38	S34-G36 PolarHBondContact O-N 3.49Å; G36-G38 PolarHBondContact O-N 2.86Å; G36-G38 VanDerWaalsContact O-N 3.15Å
37	L	45	Very low	61	Low	71 Å²	71	53.5 Å²	53.5	37%	0.372	33%	0.327	S	S	.	.			trans	-81.4	91.3	177	-96.9	85.3	0	0	0	109.5	S35 I39 T168	S35-L37 PolarHBondContact O-N 3.14Å; L37-I39 HydrophobicContact CB-CG1 4.33Å; L37-I39 HydrophobicContact CD2-CD1 3.52Å; L37-I39 HydrophobicContact CD2-CG1 4.03Å; L37-I39 HydrophobicContact CG-CD1 4.31Å; L37-I39 HydrophobicContact CG-CG1 4.35Å; L37-I39 PolarHBondContact O-N 2.94Å; L37-T168 HydrophobicContact CD1-CG2 3.88Å
38	G	43.8	Very low	60.4	Low	64 Å²	64	53.1 Å²	53.1	66%	0.66	32%	0.321	S	S	*	.			trans	-73.1	67.2	160.7	0	0	0	0	0	110.9	G36	G36-G38 PolarHBondContact O-N 2.86Å; G36-G38 VanDerWaalsContact O-N 3.15Å
39	I	45.4	Very low	60.3	Low	131 Å²	131	55.3 Å²	55.3	67%	0.672	33%	0.325	S	S	*	.			trans	-98.6	97.4	169	-56.2	-172.4	0	0	0	107.8	L37	L37-I39 HydrophobicContact CB-CG1 4.33Å; L37-I39 HydrophobicContact CD2-CD1 3.52Å; L37-I39 HydrophobicContact CD2-CG1 4.03Å; L37-I39 HydrophobicContact CG-CD1 4.31Å; L37-I39 HydrophobicContact CG-CG1 4.35Å; L37-I39 PolarHBondContact O-N 2.94Å
40	G	54.9	Low	59.7	Low	65 Å²	65	52.7 Å²	52.7	67%	0.67	31%	0.314	S	S	*	.	S	Bend	trans	80.3	-141.4	-178.2	0	0	0	0	0	113.2	V42	G40-V42 PolarHBondContact O-N 3.23Å
41	N	50.2	Low	59.1	Low	110 Å²	110	53.3 Å²	53.3	59%	0.588	32%	0.317	S	S	*	.	S	Bend	trans	-79.7	10.6	-175.8	-72.2	7.8	0	0	0	114.4	V60 D61	N41-V60 HydrophobicContact CB-CG1 4.4Å; N41-V60 WeakPolarHBondContact O-CG1 3.28Å; N41-D61 WeakPolarHBondContact CB-O 3.32Å; N41-D61 PolarHBondContact O-N 2.88Å
42	V	53.9	Low	58.9	Low	44 Å²	44	58.3 Å²	58.3	27%	0.267	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	100.4	-179.5	-174.7	0	0	0	0	107.8	G40 I58 V60	G40-V42 PolarHBondContact O-N 3.23Å; V42-I58 HydrophobicContact CG1-CG2 4.01Å; V42-V60 HydrophobicContact CG2-CG2 4.33Å
43	E	53.4	Low	58.9	Low	130 Å²	130	59.1 Å²	59.1	61%	0.607	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83	-21.9	-173.2	-69.3	-163.3	139.7	0	0	113.2	N59 D61	E43-N59 PolarHBondContact N-O 3.46Å; E43-D61 HydrophobicContact CG-CB 3.99Å
44	L	54.6	Low	58.9	Low	66 Å²	66	60.6 Å²	60.6	35%	0.346	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	118.6	-178.3	-148.4	88.7	0	0	0	111.9	Q46 N59	L44-Q46 HydrophobicContact CD2-CG 3.75Å; L44-Q46 HydrophobicContact CG-CG 4.32Å; L44-N59 HydrophobicContact CB-CB 4.21Å; L44-N59 PolarHBondContact O-N 2.89Å; L44-N59 VanDerWaalsContact O-N 3.07Å
45	L	59.5	Low	59.4	Low	51 Å²	51	58.6 Å²	58.6	27%	0.267	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	106.3	166.5	-167.8	72.5	0	0	0	108.8	S35 I58	S35-L45 PolarHBondContact N-O 3.01Å; L45-I58 HydrophobicContact CD1-CB 4.37Å; L45-I58 HydrophobicContact CD1-CG1 3.65Å; L45-I58 HydrophobicContact CD1-CG2 4.5Å
46	Q	63	Low	60	Low	55 Å²	55	60.4 Å²	60.4	26%	0.257	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	114.3	172.4	-80.7	-179.8	-15.7	0	0	109.6	L44 Y48 R57	L44-Q46 HydrophobicContact CD2-CG 3.75Å; L44-Q46 HydrophobicContact CG-CG 4.32Å; Q46-Y48 HydrophobicContact CB-CD2 4.33Å; Q46-Y48 HydrophobicContact CB-CE2 3.73Å; Q46-Y48 PolarHBondContact OE1-OH 2.73Å; Q46-Y48 VanDerWaalsContact OE1-OH 3.1Å; Q46-R57 HydrophobicContact CB-CB 4.27Å; Q46-R57 PolarHBondContact N-O 3.47Å; Q46-R57 PolarHBondContact O-N 3.36Å
47	N	65.2	Low	60.8	Low	23 Å²	23	62 Å²	62	12%	0.123	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	105.5	179.4	-64.5	-34	0	0	0	109.1	Y32 D33 S35 H56	Y32-N47 WeakPolarHBondContact CA-O 3.23Å; D33-N47 HydrophobicContact CB-CB 4.12Å; D33-N47 PolarHBondContact N-O 3.34Å; D33-N47 PolarHBondContact O-N 3.41Å; S35-N47 PolarHBondContact OG-ND2 2.68Å; N47-H56 PolarHBondContact OD1-ND1 3.36Å
48	Y	69.1	Low	61.7	Low	36 Å²	36	61.1 Å²	61.1	14%	0.141	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	115.1	173.9	-65.1	-103.9	0	0	0	109	H29 Y32 Q46 C55 R57	H29-Y48 AromaticContact CE1-CD1 3.61Å; H29-Y48 AromaticContact ND1-CD1 3.49Å; H29-Y48 WeakPolarHBondContact ND1-CD1 3.2Å; Y32-Y48 AromaticContact CD1-CD1 3.07Å; Y32-Y48 HydrophobicContact CD1-CD1 3.07Å; Y32-Y48 AromaticContact CD1-CE1 3.4Å; Y32-Y48 HydrophobicContact CD1-CE1 3.4Å; Y32-Y48 AromaticContact CD1-CG 3.78Å; Y32-Y48 HydrophobicContact CD1-CG 3.78Å; Y32-Y48 AromaticContact CE1-CD1 3.03Å; Y32-Y48 HydrophobicContact CE1-CD1 3.03Å; Y32-Y48 AromaticContact CE1-CE1 3.35Å; Y32-Y48 HydrophobicContact CE1-CE1 3.35Å; Y32-Y48 HydrophobicContact CE1-CG 4.08Å; Y32-Y48 HydrophobicContact CG-CD1 4.19Å; Y32-Y48 HydrophobicContact CG-CE1 4.16Å; Y32-Y48 AromaticContact CZ-CE1 3.97Å; Q46-Y48 HydrophobicContact CB-CD2 4.33Å; Q46-Y48 HydrophobicContact CB-CE2 3.73Å; Q46-Y48 PolarHBondContact OE1-OH 2.73Å; Q46-Y48 VanDerWaalsContact OE1-OH 3.1Å; Y48-C55 WeakPolarHBondContact CA-O 3.41Å; Y48-C55 WeakPolarHBondContact CB-O 3.17Å; Y48-C55 PolarHBondContact N-O 3.01Å; Y48-C55 PolarHBondContact O-N 3.46Å; Y48-R57 HydrophobicContact CD2-CB 4.34Å; Y48-R57 HydrophobicContact CE2-CB 3.94Å
49	R	69.2	Low	62.3	Low	68 Å²	68	59.9 Å²	59.9	26%	0.257	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	111.5	176	-59.8	-173.2	-172.3	-167.2	7.4	108.6	S28 W30 S31 D33	S28-R49 CarbonylContact O-C 3.58Å; W30-R49 WeakPolarHBondContact CB-O 3.43Å; W30-R49 PolarHBondContact N-O 2.93Å; S31-R49 PolarHBondContact N-O 2.96Å; S31-R49 VanDerWaalsContact N-O 3.16Å; S31-R49 PolarHBondContact O-N 3.36Å; D33-R49 IonicContact OD2-CZ 2.69Å; D33-R49 IonicContact OD2-NH2 3.74Å; D33-R49 PolarHBondContact OD2-NH2 2.87Å
50	G	67.2	Low	62.9	Low	4 Å²	4	55.5 Å²	55.5	4%	0.041	28%	0.28	C	S	.	.			trans	-93.5	168.3	163.4	0	0	0	0	0	112	S28 W52 E53	S28-G50 VanDerWaalsContact C-CA 3.45Å; S28-G50 VanDerWaalsContact CA-CA 3.47Å; S28-G50 PolarHBondContact O-N 2.88Å; G50-W52 VanDerWaalsContact C-N 3.35Å; G50-E53 CarbonylContact C-O 3.55Å; G50-E53 WeakPolarHBondContact CA-O 3.45Å; G50-E53 PolarHBondContact N-O 3.48Å
51	L	69.2	Low	62.9	Low	13 Å²	13	54.9 Å²	54.9	7%	0.068	26%	0.261	C	S	.	.	S	Bend	trans	-65.9	-38.9	171.9	-125.5	64.5	0	0	0	111.3	W30 F77 V103 L104 M107 Y150	W30-L51 HydrophobicContact CD2-CD1 3.58Å; W30-L51 HydrophobicContact CE3-CD1 3.86Å; W30-L51 HydrophobicContact CG-CD1 4.02Å; W30-L51 HydrophobicContact CH2-CD1 4.18Å; W30-L51 HydrophobicContact CH2-CD2 4.36Å; W30-L51 HydrophobicContact CZ2-CD1 3.94Å; W30-L51 HydrophobicContact CZ2-CD2 3.86Å; W30-L51 HydrophobicContact CZ2-CG 4.48Å; W30-L51 HydrophobicContact CZ3-CD1 4.14Å; L51-F77 VanDerWaalsContact O-CE2 3.25Å; L51-F77 WeakPolarHBondContact O-CE2 3.31Å; L51-V103 HydrophobicContact CD1-CG1 4.12Å; L51-L104 HydrophobicContact CB-CD1 4.3Å; L51-L104 HydrophobicContact CD2-CB 4.27Å; L51-L104 HydrophobicContact CD2-CD1 3.62Å; L51-L104 HydrophobicContact CG-CB 4.33Å; L51-L104 HydrophobicContact CG-CD1 4.05Å; L51-M107 HydrophobicContact CD2-CB 4.35Å; L51-M107 HydrophobicContact CD2-CG 4.29Å; L51-Y150 HydrophobicContact CD1-CD2 4.4Å; L51-Y150 HydrophobicContact CD1-CE2 4.35Å
52	W	70.9	Confident	63.3	Low	106 Å²	106	54.1 Å²	54.1	40%	0.402	26%	0.257	S	S	.	.	S	Bend	trans	-101.3	-32.2	-178.5	-64.8	89.3	0	0	0	114.2	I25 G50 R76 F77 L104	I25-W52 HydrophobicContact CG2-CZ2 4.48Å; I25-W52 PolarHBondContact O-NE1 2.66Å; G50-W52 VanDerWaalsContact C-N 3.35Å; W52-R76 PolarHBondContact O-N 2.88Å; W52-F77 HydrophobicContact CE3-CB 4.34Å; W52-F77 HydrophobicContact CE3-CD2 4Å; W52-F77 HydrophobicContact CE3-CG 4.21Å; W52-F77 HydrophobicContact CZ3-CG 4.48Å; W52-L104 HydrophobicContact CD2-CD1 4.26Å; W52-L104 HydrophobicContact CD2-CD2 4.12Å; W52-L104 VanDerWaalsContact CE2-CD1 3.49Å; W52-L104 HydrophobicContact CE3-CD2 4.12Å; W52-L104 HydrophobicContact CH2-CD1 4.4Å; W52-L104 HydrophobicContact CH2-CD2 3.95Å; W52-L104 HydrophobicContact CZ2-CD1 3.6Å; W52-L104 HydrophobicContact CZ2-CD2 3.95Å; W52-L104 HydrophobicContact CZ2-CG 4.19Å; W52-L104 HydrophobicContact CZ3-CD2 4.04Å
53	E	72.4	Confident	63.5	Low	62 Å²	62	54 Å²	54	29%	0.29	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	139.5	-168.5	-51.1	-172.3	159.5	0	0	110.3	G50 V74 N75	G50-E53 CarbonylContact C-O 3.55Å; G50-E53 WeakPolarHBondContact CA-O 3.45Å; G50-E53 PolarHBondContact N-O 3.48Å; E53-V74 WeakPolarHBondContact CA-O 3.23Å; E53-N75 HydrophobicContact CG-CB 4.41Å; E53-N75 WeakPolarHBondContact CG-OD1 3.33Å; E53-N75 VanDerWaalsContact OE1-CG 3.23Å; E53-N75 PolarHBondContact OE1-ND2 3.29Å; E53-N75 PolarHBondContact OE1-OD1 3Å
54	K	68.2	Low	63.4	Low	52 Å²	52	54.7 Å²	54.7	23%	0.226	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	120.2	162.1	-68.8	-179.6	-176.7	170	0	106.7	C73 V74 R76 D95	K54-C73 CarbonylContact O-C 3.16Å; K54-C73 WeakPolarHBondContact O-CA 3.33Å; K54-V74 PolarHBondContact N-O 2.94Å; K54-V74 PolarHBondContact O-N 3.41Å; K54-R76 HydrophobicContact CD-CG 4.23Å; K54-R76 HydrophobicContact CG-CG 3.78Å; K54-R76 VanDerWaalsContact CG-CZ 3.4Å; K54-D95 PolarHBondContact NZ-O 2.61Å
55	C	69.7	Low	63.2	Low	1 Å²	1	55.8 Å²	55.8	1%	0.007	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	125	171.2	-62.3	0	0	0	0	109.4	Y48 Y71 H72 C73	Y48-C55 WeakPolarHBondContact CA-O 3.41Å; Y48-C55 WeakPolarHBondContact CB-O 3.17Å; Y48-C55 PolarHBondContact N-O 3.01Å; Y48-C55 PolarHBondContact O-N 3.46Å; C55-Y71 HydrophobicContact CB-CE1 3.98Å; C55-Y71 HydrophobicContact CB-CE2 4.48Å; C55-H72 CarbonylContact C-O 3.48Å; C55-H72 WeakPolarHBondContact CA-O 3.4Å; C55-C73 HydrophobicContact CB-CB 4.16Å; C55-C73 WeakPolarHBondContact CB-SG 3.5Å; C55-C73 WeakPolarHBondContact SG-CB 3.25Å; C55-C73 CovalentContact SG-SG 2.05Å; C55-C73 PolarHBondContact SG-SG 3.14Å
56	H	67.6	Low	62.6	Low	59 Å²	59	55.3 Å²	55.3	27%	0.273	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	122.8	175.6	-60	-78.1	0	0	0	108.1	N47 H72	N47-H56 PolarHBondContact OD1-ND1 3.36Å; H56-H72 PolarHBondContact N-O 2.88Å; H56-H72 PolarHBondContact O-N 3.45Å
57	R	64.4	Low	62.2	Low	90 Å²	90	56.9 Å²	56.9	34%	0.34	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	112.9	168.5	-169.7	178.1	-172.3	174.7	5.3	107.9	Q46 Y48 G70 Y71	Q46-R57 HydrophobicContact CB-CB 4.27Å; Q46-R57 PolarHBondContact N-O 3.47Å; Q46-R57 PolarHBondContact O-N 3.36Å; Y48-R57 HydrophobicContact CD2-CB 4.34Å; Y48-R57 HydrophobicContact CE2-CB 3.94Å; R57-G70 WeakPolarHBondContact CA-O 3.48Å; R57-Y71 HydrophobicContact CB-CD2 4.11Å; R57-Y71 HydrophobicContact CB-CE2 4.33Å; R57-Y71 HydrophobicContact CG-CD2 4.19Å
58	I	63.4	Low	61.7	Low	54 Å²	54	59.1 Å²	59.1	28%	0.277	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	114.8	178.5	-49.8	172	0	0	0	106.4	V42 L45 V60 G70	V42-I58 HydrophobicContact CG1-CG2 4.01Å; L45-I58 HydrophobicContact CD1-CB 4.37Å; L45-I58 HydrophobicContact CD1-CG1 3.65Å; L45-I58 HydrophobicContact CD1-CG2 4.5Å; I58-V60 HydrophobicContact CG2-CG2 3.59Å; I58-G70 PolarHBondContact N-O 3.16Å; I58-G70 PolarHBondContact O-N 2.91Å
59	N	57.9	Low	61.3	Low	37 Å²	37	61.9 Å²	61.9	20%	0.198	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	108.8	165.5	-70.7	-1.1	0	0	0	107.3	E43 L44 N69	E43-N59 PolarHBondContact N-O 3.46Å; L44-N59 HydrophobicContact CB-CB 4.21Å; L44-N59 PolarHBondContact O-N 2.89Å; L44-N59 VanDerWaalsContact O-N 3.07Å; N59-N69 PolarHBondContact OD1-OD1 2.89Å
60	V	57.7	Low	60.8	Low	39 Å²	39	59.5 Å²	59.5	24%	0.236	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	119.1	171.8	-169.7	0	0	0	0	107.3	N41 V42 I58 L62 S68	N41-V60 HydrophobicContact CB-CG1 4.4Å; N41-V60 WeakPolarHBondContact O-CG1 3.28Å; V42-V60 HydrophobicContact CG2-CG2 4.33Å; I58-V60 HydrophobicContact CG2-CG2 3.59Å; V60-L62 HydrophobicContact CB-CD1 3.77Å; V60-L62 HydrophobicContact CG1-CD1 3.56Å; V60-L62 HydrophobicContact CG1-CG 4.19Å; V60-L62 PolarHBondContact O-N 3.28Å; V60-S68 PolarHBondContact N-O 3.33Å; V60-S68 PolarHBondContact O-N 3.35Å; V60-S68 VanDerWaalsContact O-N 3.16Å
61	D	55.5	Low	60.8	Low	52 Å²	52	64.7 Å²	64.7	28%	0.278	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	104.3	168	-171.3	5.2	0	0	0	108.3	N41 E43 G63	N41-D61 WeakPolarHBondContact CB-O 3.32Å; N41-D61 PolarHBondContact O-N 2.88Å; E43-D61 HydrophobicContact CG-CB 3.99Å; D61-G63 PolarHBondContact O-N 3.34Å; D61-G63 PolarHBondContact OD1-N 3.46Å
62	L	56.7	Low	60.7	Low	94 Å²	94	69.8 Å²	69.8	49%	0.492	40%	0.396	S	S	.	.			trans	-84.7	14.5	175.5	-77.1	90.9	0	0	0	112.2	V60 A65	V60-L62 HydrophobicContact CB-CD1 3.77Å; V60-L62 HydrophobicContact CG1-CD1 3.56Å; V60-L62 HydrophobicContact CG1-CG 4.19Å; V60-L62 PolarHBondContact O-N 3.28Å; L62-A65 HydrophobicContact CB-CB 4.39Å
63	G	57.9	Low	60.6	Low	42 Å²	42	67.3 Å²	67.3	43%	0.433	40%	0.395	S	S	.	.	G	3₁₀ helix	trans	67.6	-137.9	-174.5	0	0	0	0	0	111.3	D61 A65 G66	D61-G63 PolarHBondContact O-N 3.34Å; D61-G63 PolarHBondContact OD1-N 3.46Å; G63-A65 PolarHBondContact O-N 2.73Å; G63-G66 PolarHBondContact O-N 2.89Å; G63-G66 VanDerWaalsContact O-N 3.13Å
64	S	52.3	Low	60.3	Low	145 Å²	145	68.5 Å²	68.5	100%	1.014	41%	0.406	S	S	*	.	G	3₁₀ helix	trans	-58.7	-2.5	-173.7	-142.6	0	0	0	0	115.9
65	A	50.1	Low	60.3	Low	88 Å²	88	69.1 Å²	69.1	73%	0.727	41%	0.412	S	S	*	.	G	3₁₀ helix	trans	-98.1	-0.6	179.3	0	0	0	0	0	114.7	L62 G63	L62-A65 HydrophobicContact CB-CB 4.39Å; G63-A65 PolarHBondContact O-N 2.73Å
66	G	47.9	Very low	60.1	Low	41 Å²	41	70.4 Å²	70.4	42%	0.423	42%	0.417	S	S	.	.			trans	94.6	157.9	176.8	0	0	0	0	0	114.1	G63	G63-G66 PolarHBondContact O-N 2.89Å; G63-G66 VanDerWaalsContact O-N 3.13Å
67	V	53.1	Low	60.1	Low	89 Å²	89	69.2 Å²	69.2	54%	0.539	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	121.4	-178.1	-174.6	0	0	0	0	109.6	N69	V67-N69 WeakPolarHBondContact CG1-OD1 3.35Å
68	S	55.3	Low	60.3	Low	70 Å²	70	70.8 Å²	70.8	49%	0.49	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	110	170	-167.2	0	0	0	0	109	V60	V60-S68 PolarHBondContact N-O 3.33Å; V60-S68 PolarHBondContact O-N 3.35Å; V60-S68 VanDerWaalsContact O-N 3.16Å
69	N	59.8	Low	60.3	Low	93 Å²	93	70 Å²	70	50%	0.497	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	99.4	173	-75.9	-9.1	0	0	0	109	N59 V67	N59-N69 PolarHBondContact OD1-OD1 2.89Å; V67-N69 WeakPolarHBondContact CG1-OD1 3.35Å
70	G	60.4	Low	60.7	Low	18 Å²	18	71 Å²	71	19%	0.186	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	120.3	170.5	0	0	0	0	0	110.5	R57 I58	R57-G70 WeakPolarHBondContact CA-O 3.48Å; I58-G70 PolarHBondContact N-O 3.16Å; I58-G70 PolarHBondContact O-N 2.91Å
71	Y	66.9	Low	61.1	Low	114 Å²	114	76.8 Å²	76.8	45%	0.447	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	101.7	169.3	-159.1	-99.6	0	0	0	108.6	C55 R57 C73	C55-Y71 HydrophobicContact CB-CE1 3.98Å; C55-Y71 HydrophobicContact CB-CE2 4.48Å; R57-Y71 HydrophobicContact CB-CD2 4.11Å; R57-Y71 HydrophobicContact CB-CE2 4.33Å; R57-Y71 HydrophobicContact CG-CD2 4.19Å; Y71-C73 WeakPolarHBondContact CE1-SG 3.35Å
72	H	66.7	Low	61.7	Low	119 Å²	119	78.7 Å²	78.7	55%	0.551	46%	0.459	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.4	110	-178.4	-75.4	-72.6	0	0	0	110.2	C55 H56	C55-H72 CarbonylContact C-O 3.48Å; C55-H72 WeakPolarHBondContact CA-O 3.4Å; H56-H72 PolarHBondContact N-O 2.88Å; H56-H72 PolarHBondContact O-N 3.45Å
73	C	68.4	Low	61.9	Low	54 Å²	54	78.5 Å²	78.5	37%	0.365	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	128.8	171.4	-64	0	0	0	0	110.4	K54 C55 Y71	K54-C73 CarbonylContact O-C 3.16Å; K54-C73 WeakPolarHBondContact O-CA 3.33Å; C55-C73 HydrophobicContact CB-CB 4.16Å; C55-C73 WeakPolarHBondContact CB-SG 3.5Å; C55-C73 WeakPolarHBondContact SG-CB 3.25Å; C55-C73 CovalentContact SG-SG 2.05Å; C55-C73 PolarHBondContact SG-SG 3.14Å; Y71-C73 WeakPolarHBondContact CE1-SG 3.35Å
74	V	67.4	Low	62.3	Low	87 Å²	87	79 Å²	79	53%	0.527	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	121.7	175.3	-176.3	0	0	0	0	108.2	E53 K54 R76	E53-V74 WeakPolarHBondContact CA-O 3.23Å; K54-V74 PolarHBondContact N-O 2.94Å; K54-V74 PolarHBondContact O-N 3.41Å; V74-R76 PolarHBondContact O-N 3.17Å
75	N	68.2	Low	63.1	Low	66 Å²	66	76.4 Å²	76.4	35%	0.353	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	110.9	178.7	-68.2	20.4	0	0	0	108.2	E53 F77 K78	E53-N75 HydrophobicContact CG-CB 4.41Å; E53-N75 WeakPolarHBondContact CG-OD1 3.33Å; E53-N75 VanDerWaalsContact OE1-CG 3.23Å; E53-N75 PolarHBondContact OE1-ND2 3.29Å; E53-N75 PolarHBondContact OE1-OD1 3Å; N75-F77 PolarHBondContact O-N 3.21Å; N75-K78 HydrophobicContact CB-CB 3.79Å; N75-K78 WeakPolarHBondContact O-CB 3.33Å; N75-K78 PolarHBondContact O-N 2.82Å; N75-K78 VanDerWaalsContact O-N 3.11Å
76	R	65.6	Low	64.1	Low	28 Å²	28	79.2 Å²	79.2	11%	0.106	43%	0.431	C	S	.	.	H	α-helix	trans	-60.5	-36.1	-176.5	-57.6	-172.5	-165.8	-145.9	1.5	111.6	W52 K54 V74 L96 E100	W52-R76 PolarHBondContact O-N 2.88Å; K54-R76 HydrophobicContact CD-CG 4.23Å; K54-R76 HydrophobicContact CG-CG 3.78Å; K54-R76 VanDerWaalsContact CG-CZ 3.4Å; V74-R76 PolarHBondContact O-N 3.17Å; R76-L96 HydrophobicContact CB-CD1 3.86Å; R76-E100 IonicContact CZ-OE1 2.63Å; R76-E100 IonicContact CZ-OE2 3.11Å; R76-E100 IonicContact NH1-OE1 2.98Å; R76-E100 PolarHBondContact NH1-OE1 3.32Å; R76-E100 IonicContact NH1-OE2 3.22Å; R76-E100 PolarHBondContact NH1-OE2 2.89Å; R76-E100 IonicContact NH2-OE1 3.94Å
77	F	66.9	Low	64.8	Low	34 Å²	34	79.8 Å²	79.8	15%	0.149	44%	0.437	C	S	.	.	H	α-helix	trans	-84.1	-10	-177.9	-69.7	-87.2	0	0	0	113.8	L51 W52 N75 V80 F81 L96 I101 L104	L51-F77 VanDerWaalsContact O-CE2 3.25Å; L51-F77 WeakPolarHBondContact O-CE2 3.31Å; W52-F77 HydrophobicContact CE3-CB 4.34Å; W52-F77 HydrophobicContact CE3-CD2 4Å; W52-F77 HydrophobicContact CE3-CG 4.21Å; W52-F77 HydrophobicContact CZ3-CG 4.48Å; N75-F77 PolarHBondContact O-N 3.21Å; F77-V80 PolarHBondContact O-N 3.47Å; F77-F81 VanDerWaalsContact O-CB 3.32Å; F77-F81 WeakPolarHBondContact O-CB 3.41Å; F77-F81 PolarHBondContact O-N 3.24Å; F77-L96 HydrophobicContact CD1-CD2 4.23Å; F77-L96 HydrophobicContact CE1-CD2 3.8Å; F77-L96 HydrophobicContact CE2-CD1 4.33Å; F77-L96 HydrophobicContact CZ-CD1 4.19Å; F77-L96 HydrophobicContact CZ-CD2 4.08Å; F77-I101 HydrophobicContact CE1-CG1 4.22Å; F77-I101 HydrophobicContact CZ-CG1 4.38Å; F77-L104 HydrophobicContact CD1-CD2 4.47Å; F77-L104 HydrophobicContact CD2-CD2 4.23Å; F77-L104 HydrophobicContact CE1-CD2 3.86Å; F77-L104 HydrophobicContact CE2-CD2 3.61Å; F77-L104 HydrophobicContact CZ-CD2 3.38Å
78	K	68.1	Low	65	Low	122 Å²	122	80.2 Å²	80.2	53%	0.53	44%	0.436	S	S	.	.	H	α-helix	trans	-63.1	-45.9	177.8	-177.9	176.8	176.5	-177.8	0	110.7	N75 V80 F81 E82	N75-K78 HydrophobicContact CB-CB 3.79Å; N75-K78 WeakPolarHBondContact O-CB 3.33Å; N75-K78 PolarHBondContact O-N 2.82Å; N75-K78 VanDerWaalsContact O-N 3.11Å; K78-V80 VanDerWaalsContact C-N 3.33Å; K78-V80 PolarHBondContact O-N 3.43Å; K78-F81 PolarHBondContact O-N 2.91Å; K78-E82 WeakPolarHBondContact CE-OE1 3.47Å; K78-E82 HydrophobicContact CG-CG 4.43Å; K78-E82 IonicContact NZ-OE1 3.79Å; K78-E82 WeakPolarHBondContact O-CB 3.41Å; K78-E82 WeakPolarHBondContact O-CG 3.27Å; K78-E82 PolarHBondContact O-N 3.16Å
79	A	63.1	Low	65.2	Low	37 Å²	37	85.1 Å²	85.1	31%	0.306	45%	0.449	S	S	.	.	H	α-helix	trans	-63.4	-39.5	176.1	0	0	0	0	0	112	R83	A79-R83 WeakPolarHBondContact O-CB 3.42Å; A79-R83 WeakPolarHBondContact O-CG 3.48Å; A79-R83 PolarHBondContact O-N 3.39Å
80	V	66.2	Low	64.8	Low	60 Å²	60	85.7 Å²	85.7	36%	0.364	46%	0.46	S	S	.	.	H	α-helix	trans	-64.9	-44.9	176.5	-179.1	0	0	0	0	111.2	F77 K78 R83 A84 L96	F77-V80 PolarHBondContact O-N 3.47Å; K78-V80 VanDerWaalsContact C-N 3.33Å; K78-V80 PolarHBondContact O-N 3.43Å; V80-R83 PolarHBondContact O-N 2.91Å; V80-A84 VanDerWaalsContact O-CB 3.22Å; V80-A84 WeakPolarHBondContact O-CB 3.34Å; V80-A84 PolarHBondContact O-N 2.93Å; V80-L96 HydrophobicContact CG2-CD2 3.66Å
81	F	66.5	Low	64.4	Low	159 Å²	159	94.9 Å²	94.9	70%	0.697	49%	0.489	S	S	*	.	H	α-helix	trans	-69.9	-39.5	-178.9	-165.9	-92.7	0	0	0	112	F77 K78 A84 S85	F77-F81 VanDerWaalsContact O-CB 3.32Å; F77-F81 WeakPolarHBondContact O-CB 3.41Å; F77-F81 PolarHBondContact O-N 3.24Å; K78-F81 PolarHBondContact O-N 2.91Å; F81-A84 PolarHBondContact O-N 3.32Å; F81-S85 WeakPolarHBondContact O-CB 3.23Å; F81-S85 PolarHBondContact O-N 3.48Å; F81-S85 PolarHBondContact O-OG 2.9Å
82	E	68.2	Low	63.4	Low	93 Å²	93	98.2 Å²	98.2	44%	0.435	51%	0.509	S	S	.	.	H	α-helix	trans	-64.7	-37.3	174.2	-75.8	175.7	176.3	0	0	112.1	K78 S85 Q86	K78-E82 WeakPolarHBondContact CE-OE1 3.47Å; K78-E82 HydrophobicContact CG-CG 4.43Å; K78-E82 IonicContact NZ-OE1 3.79Å; K78-E82 WeakPolarHBondContact O-CB 3.41Å; K78-E82 WeakPolarHBondContact O-CG 3.27Å; K78-E82 PolarHBondContact O-N 3.16Å; E82-S85 PolarHBondContact O-OG 3.46Å; E82-Q86 VanDerWaalsContact O-CG 3.3Å; E82-Q86 WeakPolarHBondContact O-CG 3.39Å; E82-Q86 PolarHBondContact O-N 2.86Å; E82-Q86 VanDerWaalsContact O-N 3.14Å
83	R	60.3	Low	62.5	Low	89 Å²	89	95.1 Å²	95.1	34%	0.336	50%	0.497	S	S	.	.	H	α-helix	trans	-77.3	-35.6	175.1	-69.9	-171.8	-161.4	158.5	12.2	113	A79 V80 S85 Q86 G87 D88 D93	A79-R83 WeakPolarHBondContact O-CB 3.42Å; A79-R83 WeakPolarHBondContact O-CG 3.48Å; A79-R83 PolarHBondContact O-N 3.39Å; V80-R83 PolarHBondContact O-N 2.91Å; R83-S85 PolarHBondContact O-N 3.4Å; R83-Q86 CarbonylContact O-C 3.45Å; R83-Q86 PolarHBondContact O-N 3.46Å; R83-Q86 VanDerWaalsContact O-N 3.07Å; R83-G87 PolarHBondContact O-N 3.36Å; R83-D88 PolarHBondContact O-N 2.92Å; R83-D93 IonicContact CZ-OD1 2.87Å; R83-D93 IonicContact CZ-OD2 2.87Å; R83-D93 IonicContact NH1-OD1 3.53Å; R83-D93 PolarHBondContact NH1-OD1 3.36Å; R83-D93 IonicContact NH1-OD2 3.23Å; R83-D93 PolarHBondContact NH1-OD2 2.95Å; R83-D93 IonicContact NH2-OD1 3.98Å; R83-D93 PolarHBondContact NH2-OD1 3.33Å; R83-D93 IonicContact NH2-OD2 3.53Å; R83-D93 PolarHBondContact NH2-OD2 2.88Å; R83-D93 VanDerWaalsContact NH2-OD2 3.11Å
84	A	66.3	Low	61.7	Low	52 Å²	52	101.6 Å²	101.6	43%	0.43	52%	0.522	S	S	.	.	H	α-helix	trans	-61.8	-35.3	172.9	0	0	0	0	0	111.4	V80 F81 G87	V80-A84 VanDerWaalsContact O-CB 3.22Å; V80-A84 WeakPolarHBondContact O-CB 3.34Å; V80-A84 PolarHBondContact O-N 2.93Å; F81-A84 PolarHBondContact O-N 3.32Å; A84-G87 PolarHBondContact O-N 2.97Å
85	S	70.3	Confident	61	Low	91 Å²	91	103.1 Å²	103.1	64%	0.636	53%	0.527	S	S	*	.	H	α-helix	trans	-74.2	-26.2	173.1	72.8	0	0	0	0	113.2	F81 E82 R83	F81-S85 WeakPolarHBondContact O-CB 3.23Å; F81-S85 PolarHBondContact O-N 3.48Å; F81-S85 PolarHBondContact O-OG 2.9Å; E82-S85 PolarHBondContact O-OG 3.46Å; R83-S85 PolarHBondContact O-N 3.4Å
86	Q	71.6	Confident	60.6	Low	148 Å²	148	101.2 Å²	101.2	69%	0.692	52%	0.516	S	S	*	.	H	α-helix	trans	-85.2	-6.1	173.6	-71.4	175	2.8	0	0	114.1	E82 R83 D88	E82-Q86 VanDerWaalsContact O-CG 3.3Å; E82-Q86 WeakPolarHBondContact O-CG 3.39Å; E82-Q86 PolarHBondContact O-N 2.86Å; E82-Q86 VanDerWaalsContact O-N 3.14Å; R83-Q86 CarbonylContact O-C 3.45Å; R83-Q86 PolarHBondContact O-N 3.46Å; R83-Q86 VanDerWaalsContact O-N 3.07Å; Q86-D88 PolarHBondContact O-N 3.36Å
87	G	61.2	Low	60.9	Low	52 Å²	52	103.8 Å²	103.8	54%	0.536	53%	0.529	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.5	13	178.8	0	0	0	0	0	114.7	R83 A84	R83-G87 PolarHBondContact O-N 3.36Å; A84-G87 PolarHBondContact O-N 2.97Å
88	D	57.9	Low	61.3	Low	98 Å²	98	105.7 Å²	105.7	52%	0.524	55%	0.551	S	S	.	*			trans	-102.8	89.6	-172.2	-150.6	-10.2	0	0	0	110.9	R83 Q86 S90	R83-D88 PolarHBondContact O-N 2.92Å; Q86-D88 PolarHBondContact O-N 3.36Å; D88-S90 VanDerWaalsContact C-N 3.29Å
89	F	59.3	Low	62	Low	174 Å²	174	101.3 Å²	101.3	76%	0.763	53%	0.532	S	S	*	.			trans	-87.5	9	179.6	-63.8	-79.2	0	0	0	113.2	R91	F89-R91 VanDerWaalsContact C-N 3.31Å; F89-R91 PolarHBondContact O-N 2.67Å
90	S	52.6	Low	62.8	Low	105 Å²	105	100.5 Å²	100.5	73%	0.734	52%	0.521	S	S	*	.			trans	-80.3	-1.1	-160.9	-159.6	0	0	0	0	115.9	D88	D88-S90 VanDerWaalsContact C-N 3.29Å
91	R	50	Low	63.5	Low	210 Å²	210	101.3 Å²	101.3	79%	0.792	52%	0.523	S	S	*	.			trans	-141	107.2	178.1	-126.5	175.2	178.2	142.7	-2.3	111.1	F89 D93	F89-R91 VanDerWaalsContact C-N 3.31Å; F89-R91 PolarHBondContact O-N 2.67Å; R91-D93 PolarHBondContact O-N 3.24Å
92	Q	46.9	Very low	64.4	Low	184 Å²	184	96 Å²	96	86%	0.86	51%	0.508	S	S	*	.			trans	-65.7	100.9	170.5	-163.9	167.9	6.9	0	0	107.5	Q94	Q92-Q94 PolarHBondContact O-N 3.44Å; Q92-Q94 VanDerWaalsContact O-N 3.1Å
93	D	48.6	Very low	65.4	Low	55 Å²	55	91.5 Å²	91.5	29%	0.294	49%	0.487	S	S	.	.			trans	-59.5	116.7	173.6	-78.6	-24.5	0	0	0	107.7	R83 R91 D95 L96	R83-D93 IonicContact CZ-OD1 2.87Å; R83-D93 IonicContact CZ-OD2 2.87Å; R83-D93 IonicContact NH1-OD1 3.53Å; R83-D93 PolarHBondContact NH1-OD1 3.36Å; R83-D93 IonicContact NH1-OD2 3.23Å; R83-D93 PolarHBondContact NH1-OD2 2.95Å; R83-D93 IonicContact NH2-OD1 3.98Å; R83-D93 PolarHBondContact NH2-OD1 3.33Å; R83-D93 IonicContact NH2-OD2 3.53Å; R83-D93 PolarHBondContact NH2-OD2 2.88Å; R83-D93 VanDerWaalsContact NH2-OD2 3.11Å; R91-D93 PolarHBondContact O-N 3.24Å; D93-D95 PolarHBondContact O-N 3.33Å; D93-L96 PolarHBondContact O-N 2.9Å
94	Q	50.2	Low	66.6	Low	190 Å²	190	87.8 Å²	87.8	89%	0.888	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-10.9	175.6	-82.8	173.8	-34	0	0	113.1	Q92	Q92-Q94 PolarHBondContact O-N 3.44Å; Q92-Q94 VanDerWaalsContact O-N 3.1Å
95	D	54.2	Low	67.7	Low	119 Å²	119	87.4 Å²	87.4	64%	0.636	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-15.2	-175.4	-69.7	-37.3	0	0	0	115.2	K54 D93	K54-D95 PolarHBondContact NZ-O 2.61Å; D93-D95 PolarHBondContact O-N 3.33Å
96	L	59.6	Low	68.7	Low	26 Å²	26	85.4 Å²	85.4	14%	0.136	45%	0.453	C	S	.	.	S	Bend	trans	-113.7	100.2	177.5	-157.5	70.6	0	0	0	110.3	R76 F77 V80 D93 I101	R76-L96 HydrophobicContact CB-CD1 3.86Å; F77-L96 HydrophobicContact CD1-CD2 4.23Å; F77-L96 HydrophobicContact CE1-CD2 3.8Å; F77-L96 HydrophobicContact CE2-CD1 4.33Å; F77-L96 HydrophobicContact CZ-CD1 4.19Å; F77-L96 HydrophobicContact CZ-CD2 4.08Å; V80-L96 HydrophobicContact CG2-CD2 3.66Å; D93-L96 PolarHBondContact O-N 2.9Å; L96-I101 HydrophobicContact CD2-CD1 3.7Å; L96-I101 HydrophobicContact CD2-CG1 3.75Å; L96-I101 HydrophobicContact CG-CD1 4.17Å; L96-I101 HydrophobicContact CG-CG1 4.01Å
97	Q	70.3	Confident	69.5	Low	81 Å²	81	78.4 Å²	78.4	38%	0.379	42%	0.42	S	S	.	.			trans	-73.5	137.4	-176.2	-60.5	179.1	-0.1	0	0	109.2	W99 E100	Q97-W99 HydrophobicContact CB-CG 4.32Å; Q97-W99 PolarHBondContact O-N 2.92Å; Q97-W99 VanDerWaalsContact O-N 3.09Å; Q97-W99 VanDerWaalsContact OE1-CE2 3.24Å; Q97-E100 HydrophobicContact CB-CG 4.27Å; Q97-E100 WeakPolarHBondContact O-CB 3.45Å; Q97-E100 PolarHBondContact O-N 3.39Å
98	A	76.4	Confident	70.9	Confident	74 Å²	74	77.6 Å²	77.6	61%	0.612	41%	0.406	S	S	*	.	H	α-helix	trans	-56.6	-31.9	-173.9	0	0	0	0	0	113	E100 I101 A102	A98-E100 VanDerWaalsContact C-N 3.35Å; A98-I101 PolarHBondContact O-N 3.36Å; A98-A102 PolarHBondContact O-N 3.36Å
99	W	81.9	Confident	72.6	Confident	30 Å²	30	76.9 Å²	76.9	11%	0.114	40%	0.401	C	S	.	.	H	α-helix	trans	-67.6	-31	175.9	67	-100.7	0	0	0	112.9	Q97 I101 A102 V103 T149 Y150 E153	Q97-W99 HydrophobicContact CB-CG 4.32Å; Q97-W99 PolarHBondContact O-N 2.92Å; Q97-W99 VanDerWaalsContact O-N 3.09Å; Q97-W99 VanDerWaalsContact OE1-CE2 3.24Å; W99-I101 VanDerWaalsContact C-N 3.33Å; W99-I101 PolarHBondContact O-N 3.48Å; W99-A102 PolarHBondContact O-N 2.94Å; W99-V103 HydrophobicContact CE3-CG2 4.14Å; W99-V103 VanDerWaalsContact O-CG2 3.27Å; W99-V103 WeakPolarHBondContact O-CG2 3.27Å; W99-V103 PolarHBondContact O-N 3.38Å; W99-T149 HydrophobicContact CB-CG2 4.46Å; W99-Y150 HydrophobicContact CH2-CD2 4.36Å; W99-Y150 HydrophobicContact CH2-CE2 4.29Å; W99-Y150 AromaticContact CZ3-CD2 3.68Å; W99-Y150 HydrophobicContact CZ3-CD2 3.68Å; W99-Y150 HydrophobicContact CZ3-CE2 4.03Å; W99-Y150 HydrophobicContact CZ3-CG 4.38Å; W99-E153 HydrophobicContact CB-CG 4.02Å; W99-E153 HydrophobicContact CD2-CB 3.75Å; W99-E153 HydrophobicContact CD2-CG 3.59Å; W99-E153 HydrophobicContact CE3-CB 3.88Å; W99-E153 HydrophobicContact CE3-CG 3.92Å; W99-E153 HydrophobicContact CG-CB 4.28Å; W99-E153 HydrophobicContact CG-CG 3.63Å; W99-E153 HydrophobicContact CH2-CB 4.17Å; W99-E153 HydrophobicContact CZ2-CB 4.03Å; W99-E153 HydrophobicContact CZ3-CB 4.08Å
100	E	80.4	Confident	74.1	Confident	20 Å²	20	68.6 Å²	68.6	9%	0.093	37%	0.365	C	S	.	.	H	α-helix	trans	-65.7	-40.3	177.2	-65.9	-177	150.2	0	0	110.6	R76 Q97 A98 V103 L104	R76-E100 IonicContact CZ-OE1 2.63Å; R76-E100 IonicContact CZ-OE2 3.11Å; R76-E100 IonicContact NH1-OE1 2.98Å; R76-E100 PolarHBondContact NH1-OE1 3.32Å; R76-E100 IonicContact NH1-OE2 3.22Å; R76-E100 PolarHBondContact NH1-OE2 2.89Å; R76-E100 IonicContact NH2-OE1 3.94Å; Q97-E100 HydrophobicContact CB-CG 4.27Å; Q97-E100 WeakPolarHBondContact O-CB 3.45Å; Q97-E100 PolarHBondContact O-N 3.39Å; A98-E100 VanDerWaalsContact C-N 3.35Å; E100-V103 PolarHBondContact O-N 2.96Å; E100-L104 WeakPolarHBondContact O-CB 3.43Å; E100-L104 PolarHBondContact O-N 2.85Å
101	I	81.1	Confident	75.9	Confident	78 Å²	78	64.1 Å²	64.1	40%	0.4	33%	0.334	S	S	.	.	H	α-helix	trans	-65.1	-42.7	174.1	-54.8	175.9	0	0	0	110	F77 L96 A98 W99 L104 A105	F77-I101 HydrophobicContact CE1-CG1 4.22Å; F77-I101 HydrophobicContact CZ-CG1 4.38Å; L96-I101 HydrophobicContact CD2-CD1 3.7Å; L96-I101 HydrophobicContact CD2-CG1 3.75Å; L96-I101 HydrophobicContact CG-CD1 4.17Å; L96-I101 HydrophobicContact CG-CG1 4.01Å; A98-I101 PolarHBondContact O-N 3.36Å; W99-I101 VanDerWaalsContact C-N 3.33Å; W99-I101 PolarHBondContact O-N 3.48Å; I101-L104 PolarHBondContact O-N 3.42Å; I101-A105 VanDerWaalsContact O-CB 3.31Å; I101-A105 WeakPolarHBondContact O-CB 3.34Å; I101-A105 PolarHBondContact O-N 2.91Å
102	A	86	Confident	77.9	Confident	46 Å²	46	59.4 Å²	59.4	38%	0.38	32%	0.324	S	S	.	.	H	α-helix	trans	-62.8	-44.3	177.9	0	0	0	0	0	111.9	A98 W99 A105 L106	A98-A102 PolarHBondContact O-N 3.36Å; W99-A102 PolarHBondContact O-N 2.94Å; A102-A105 PolarHBondContact O-N 2.73Å; A102-L106 WeakPolarHBondContact O-CB 3.47Å; A102-L106 VanDerWaalsContact O-CG 3.27Å; A102-L106 WeakPolarHBondContact O-CG 3.29Å; A102-L106 PolarHBondContact O-N 3.38Å
103	V	87.5	Confident	80	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-61.4	-47.3	175.6	171.9	0	0	0	0	110.4	L51 W99 E100 A105 L106 M107 G146 T149 Y150	L51-V103 HydrophobicContact CD1-CG1 4.12Å; W99-V103 HydrophobicContact CE3-CG2 4.14Å; W99-V103 VanDerWaalsContact O-CG2 3.27Å; W99-V103 WeakPolarHBondContact O-CG2 3.27Å; W99-V103 PolarHBondContact O-N 3.38Å; E100-V103 PolarHBondContact O-N 2.96Å; V103-A105 PolarHBondContact O-N 2.68Å; V103-L106 PolarHBondContact O-N 2.83Å; V103-M107 HydrophobicContact CG1-CG 4.37Å; V103-M107 WeakPolarHBondContact O-CB 3.29Å; V103-M107 VanDerWaalsContact O-CG 3.25Å; V103-M107 WeakPolarHBondContact O-CG 3.27Å; V103-M107 PolarHBondContact O-N 3.38Å; V103-G146 WeakPolarHBondContact CG2-O 3.37Å; V103-T149 HydrophobicContact CG2-CG2 3.96Å; V103-Y150 HydrophobicContact CG1-CD2 4.3Å
104	L	87.1	Confident	81.9	Confident	11 Å²	11	49 Å²	49	6%	0.058	28%	0.275	C	S	.	.	H	α-helix	trans	-59.7	-46.5	177.5	178.3	60.5	0	0	0	111.5	I25 L51 W52 F77 E100 I101 L106 M107 C108	I25-L104 HydrophobicContact CG2-CD1 4.3Å; L51-L104 HydrophobicContact CB-CD1 4.3Å; L51-L104 HydrophobicContact CD2-CB 4.27Å; L51-L104 HydrophobicContact CD2-CD1 3.62Å; L51-L104 HydrophobicContact CG-CB 4.33Å; L51-L104 HydrophobicContact CG-CD1 4.05Å; W52-L104 HydrophobicContact CD2-CD1 4.26Å; W52-L104 HydrophobicContact CD2-CD2 4.12Å; W52-L104 VanDerWaalsContact CE2-CD1 3.49Å; W52-L104 HydrophobicContact CE3-CD2 4.12Å; W52-L104 HydrophobicContact CH2-CD1 4.4Å; W52-L104 HydrophobicContact CH2-CD2 3.95Å; W52-L104 HydrophobicContact CZ2-CD1 3.6Å; W52-L104 HydrophobicContact CZ2-CD2 3.95Å; W52-L104 HydrophobicContact CZ2-CG 4.19Å; W52-L104 HydrophobicContact CZ3-CD2 4.04Å; F77-L104 HydrophobicContact CD1-CD2 4.47Å; F77-L104 HydrophobicContact CD2-CD2 4.23Å; F77-L104 HydrophobicContact CE1-CD2 3.86Å; F77-L104 HydrophobicContact CE2-CD2 3.61Å; F77-L104 HydrophobicContact CZ-CD2 3.38Å; E100-L104 WeakPolarHBondContact O-CB 3.43Å; E100-L104 PolarHBondContact O-N 2.85Å; I101-L104 PolarHBondContact O-N 3.42Å; L104-L106 PolarHBondContact O-N 3.49Å; L104-M107 PolarHBondContact O-N 2.89Å; L104-C108 WeakPolarHBondContact O-CB 3.27Å; L104-C108 PolarHBondContact O-N 2.89Å; L104-C108 PolarHBondContact O-SG 3.24Å; L104-C108 VanDerWaalsContact O-SG 3.36Å
105	A	88.6	Confident	83.8	Confident	44 Å²	44	42.8 Å²	42.8	36%	0.364	25%	0.25	S	C	.	.	H	α-helix	trans	-60.6	-45.3	178	0	0	0	0	0	111.8	I101 A102 V103 M107 C108 I109	I101-A105 VanDerWaalsContact O-CB 3.31Å; I101-A105 WeakPolarHBondContact O-CB 3.34Å; I101-A105 PolarHBondContact O-N 2.91Å; A102-A105 PolarHBondContact O-N 2.73Å; V103-A105 PolarHBondContact O-N 2.68Å; A105-M107 PolarHBondContact O-N 3.43Å; A105-C108 PolarHBondContact O-N 3.34Å; A105-I109 WeakPolarHBondContact O-CB 3.33Å; A105-I109 WeakPolarHBondContact O-CD1 3.44Å; A105-I109 WeakPolarHBondContact O-CG1 3.34Å; A105-I109 PolarHBondContact O-N 2.93Å
106	L	91	Very high	85.5	Confident	49 Å²	49	41.4 Å²	41.4	26%	0.257	24%	0.242	S	C	.	.	H	α-helix	trans	-60.6	-43.8	177.1	-75.8	169.2	0	0	0	112.1	A102 V103 L104 I109 S110 C142 A145	A102-L106 WeakPolarHBondContact O-CB 3.47Å; A102-L106 VanDerWaalsContact O-CG 3.27Å; A102-L106 WeakPolarHBondContact O-CG 3.29Å; A102-L106 PolarHBondContact O-N 3.38Å; V103-L106 PolarHBondContact O-N 2.83Å; L104-L106 PolarHBondContact O-N 3.49Å; L106-I109 PolarHBondContact O-N 3.21Å; L106-S110 WeakPolarHBondContact O-CB 3.44Å; L106-S110 PolarHBondContact O-N 2.93Å; L106-C142 HydrophobicContact CD2-CB 4.37Å; L106-A145 HydrophobicContact CD1-CB 4.25Å
107	M	89.8	Confident	86.7	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-66.8	-42.5	178.4	-68.3	-60.7	-70.1	0	0	111.6	V21 S24 I25 W30 L51 V103 L104 A105 S110 A111 T143 V147 A181	V21-M107 HydrophobicContact CG1-CE 3.9Å; S24-M107 WeakPolarHBondContact OG-CE 3.46Å; I25-M107 HydrophobicContact CD1-CB 3.84Å; I25-M107 WeakPolarHBondContact CD1-O 3.4Å; I25-M107 HydrophobicContact CG1-CB 3.8Å; I25-M107 HydrophobicContact CG1-CE 4.38Å; W30-M107 HydrophobicContact CH2-CE 3.85Å; W30-M107 HydrophobicContact CH2-CG 4.16Å; W30-M107 HydrophobicContact CH2-SD 4.25Å; W30-M107 HydrophobicContact CZ2-CE 4.11Å; L51-M107 HydrophobicContact CD2-CB 4.35Å; L51-M107 HydrophobicContact CD2-CG 4.29Å; V103-M107 HydrophobicContact CG1-CG 4.37Å; V103-M107 WeakPolarHBondContact O-CB 3.29Å; V103-M107 VanDerWaalsContact O-CG 3.25Å; V103-M107 WeakPolarHBondContact O-CG 3.27Å; V103-M107 PolarHBondContact O-N 3.38Å; L104-M107 PolarHBondContact O-N 2.89Å; A105-M107 PolarHBondContact O-N 3.43Å; M107-S110 PolarHBondContact O-N 2.93Å; M107-A111 WeakPolarHBondContact O-CB 3.22Å; M107-A111 PolarHBondContact O-N 3.14Å; M107-T143 HydrophobicContact CE-CG2 4.15Å; M107-T143 HydrophobicContact SD-CG2 4.02Å; M107-V147 HydrophobicContact SD-CG2 4.44Å; M107-A181 HydrophobicContact CE-CB 3.84Å
108	C	90.6	Very high	87.4	Confident	36 Å²	36	37.7 Å²	37.7	24%	0.243	22%	0.224	C	C	.	.	H	α-helix	trans	-62.9	-44.3	174.7	-74.7	0	0	0	0	112.2	L104 A105 A111 L112	L104-C108 WeakPolarHBondContact O-CB 3.27Å; L104-C108 PolarHBondContact O-N 2.89Å; L104-C108 PolarHBondContact O-SG 3.24Å; L104-C108 VanDerWaalsContact O-SG 3.36Å; A105-C108 PolarHBondContact O-N 3.34Å; C108-A111 PolarHBondContact O-N 3.31Å; C108-L112 WeakPolarHBondContact O-CB 3.47Å; C108-L112 VanDerWaalsContact O-CG 3.29Å; C108-L112 WeakPolarHBondContact O-CG 3.44Å; C108-L112 PolarHBondContact O-N 2.91Å
109	I	91.7	Very high	87.9	Confident	83 Å²	83	38.6 Å²	38.6	43%	0.426	22%	0.223	S	C	.	.	H	α-helix	trans	-61.1	-45.8	176.2	-69.8	164.5	0	0	0	110.1	A105 L106 A111 L112 V113	A105-I109 WeakPolarHBondContact O-CB 3.33Å; A105-I109 WeakPolarHBondContact O-CD1 3.44Å; A105-I109 WeakPolarHBondContact O-CG1 3.34Å; A105-I109 PolarHBondContact O-N 2.93Å; L106-I109 PolarHBondContact O-N 3.21Å; I109-A111 PolarHBondContact O-N 3.35Å; I109-L112 PolarHBondContact O-N 3.47Å; I109-V113 HydrophobicContact CG2-CG2 4.16Å; I109-V113 WeakPolarHBondContact O-CB 3.47Å; I109-V113 VanDerWaalsContact O-CG2 3.23Å; I109-V113 WeakPolarHBondContact O-CG2 3.28Å; I109-V113 PolarHBondContact O-N 3.26Å
110	S	90.8	Very high	87.9	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-58.1	-47.8	175.8	173.2	0	0	0	0	112.2	L106 M107 L112 V113 S114 A139 T143 Q188	L106-S110 WeakPolarHBondContact O-CB 3.44Å; L106-S110 PolarHBondContact O-N 2.93Å; M107-S110 PolarHBondContact O-N 2.93Å; S110-L112 PolarHBondContact O-N 2.85Å; S110-V113 PolarHBondContact O-N 2.86Å; S110-S114 VanDerWaalsContact O-CB 3.27Å; S110-S114 WeakPolarHBondContact O-CB 3.41Å; S110-S114 PolarHBondContact O-N 3.45Å; S110-S114 PolarHBondContact O-OG 3.07Å; S110-A139 WeakPolarHBondContact CB-O 3.45Å; S110-A139 PolarHBondContact OG-O 3.47Å; S110-T143 VanDerWaalsContact CB-OG1 3.23Å; S110-T143 WeakPolarHBondContact CB-OG1 3.35Å; S110-T143 PolarHBondContact OG-OG1 3.39Å; S110-Q188 PolarHBondContact OG-OE1 2.98Å
111	A	90.7	Very high	87.7	Confident	10 Å²	10	43.4 Å²	43.4	8%	0.083	25%	0.248	C	C	.	.	H	α-helix	trans	-59.9	-47.3	178.6	0	0	0	0	0	111.5	V21 I22 I25 M107 C108 I109 S114 V115	V21-A111 HydrophobicContact CG1-CB 4.11Å; I22-A111 HydrophobicContact CG1-CB 4.11Å; I25-A111 HydrophobicContact CD1-CB 3.96Å; M107-A111 WeakPolarHBondContact O-CB 3.22Å; M107-A111 PolarHBondContact O-N 3.14Å; C108-A111 PolarHBondContact O-N 3.31Å; I109-A111 PolarHBondContact O-N 3.35Å; A111-S114 PolarHBondContact O-N 3.47Å; A111-V115 VanDerWaalsContact O-CG2 3.27Å; A111-V115 WeakPolarHBondContact O-CG2 3.42Å; A111-V115 PolarHBondContact O-N 3.38Å
112	L	92.6	Very high	87.2	Confident	111 Å²	111	44.8 Å²	44.8	58%	0.581	26%	0.262	S	S	*	.	H	α-helix	trans	-61.9	-49.7	178.8	-73.3	171.5	0	0	0	111.9	C108 I109 S110 S114 V115 I116	C108-L112 WeakPolarHBondContact O-CB 3.47Å; C108-L112 VanDerWaalsContact O-CG 3.29Å; C108-L112 WeakPolarHBondContact O-CG 3.44Å; C108-L112 PolarHBondContact O-N 2.91Å; I109-L112 PolarHBondContact O-N 3.47Å; S110-L112 PolarHBondContact O-N 2.85Å; L112-S114 VanDerWaalsContact C-N 3.26Å; L112-S114 PolarHBondContact O-N 2.95Å; L112-V115 PolarHBondContact O-N 2.67Å; L112-I116 WeakPolarHBondContact O-CB 3.48Å; L112-I116 WeakPolarHBondContact O-CD1 3.5Å; L112-I116 WeakPolarHBondContact O-CG1 3.27Å; L112-I116 PolarHBondContact O-N 2.86Å
113	V	91.1	Very high	86.3	Confident	21 Å²	21	47.4 Å²	47.4	13%	0.127	28%	0.276	C	S	.	.	H	α-helix	trans	-62	-37	179	174.6	0	0	0	0	110.9	I109 S110 S117 W135 A139	I109-V113 HydrophobicContact CG2-CG2 4.16Å; I109-V113 WeakPolarHBondContact O-CB 3.47Å; I109-V113 VanDerWaalsContact O-CG2 3.23Å; I109-V113 WeakPolarHBondContact O-CG2 3.28Å; I109-V113 PolarHBondContact O-N 3.26Å; S110-V113 PolarHBondContact O-N 2.86Å; V113-S117 WeakPolarHBondContact O-CB 3.3Å; V113-S117 PolarHBondContact O-N 2.95Å; V113-S117 PolarHBondContact O-OG 3.22Å; V113-W135 HydrophobicContact CG1-CB 3.92Å; V113-W135 HydrophobicContact CG1-CE3 4Å; V113-W135 VanDerWaalsContact CG1-O 3.24Å; V113-W135 WeakPolarHBondContact CG1-O 3.38Å; V113-A139 HydrophobicContact CB-CB 4.16Å; V113-A139 HydrophobicContact CG1-CB 4.02Å
114	S	89.1	Confident	85.1	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-68.8	-43.6	177.2	-58.6	0	0	0	0	112.3	T18 S110 A111 L112 S117 L118 A139 Q188	T18-S114 WeakPolarHBondContact OG1-CB 3.33Å; S110-S114 VanDerWaalsContact O-CB 3.27Å; S110-S114 WeakPolarHBondContact O-CB 3.41Å; S110-S114 PolarHBondContact O-N 3.45Å; S110-S114 PolarHBondContact O-OG 3.07Å; A111-S114 PolarHBondContact O-N 3.47Å; L112-S114 VanDerWaalsContact C-N 3.26Å; L112-S114 PolarHBondContact O-N 2.95Å; S114-S117 WeakPolarHBondContact O-CB 3.35Å; S114-S117 PolarHBondContact O-N 3.47Å; S114-L118 WeakPolarHBondContact O-CG 3.45Å; S114-L118 PolarHBondContact O-N 2.81Å; S114-A139 WeakPolarHBondContact OG-CB 3.46Å; S114-Q188 PolarHBondContact OG-NE2 3.32Å
115	V	90.2	Very high	83.8	Confident	59 Å²	59	53.8 Å²	53.8	36%	0.358	32%	0.32	S	S	.	.	H	α-helix	trans	-63.5	-46	176.1	170.3	0	0	0	0	110.7	T18 I22 A111 L112 S117 L118 V119	T18-V115 HydrophobicContact CG2-CG2 3.78Å; I22-V115 HydrophobicContact CD1-CG2 4.07Å; A111-V115 VanDerWaalsContact O-CG2 3.27Å; A111-V115 WeakPolarHBondContact O-CG2 3.42Å; A111-V115 PolarHBondContact O-N 3.38Å; L112-V115 PolarHBondContact O-N 2.67Å; V115-S117 VanDerWaalsContact C-N 3.28Å; V115-S117 PolarHBondContact O-N 2.83Å; V115-L118 PolarHBondContact O-N 2.88Å; V115-L118 VanDerWaalsContact O-N 3.17Å; V115-V119 HydrophobicContact CG1-CG2 4.46Å; V115-V119 WeakPolarHBondContact O-CG2 3.25Å; V115-V119 PolarHBondContact O-N 2.85Å
116	I	88.1	Confident	82.5	Confident	91 Å²	91	58.1 Å²	58.1	47%	0.467	34%	0.337	S	S	.	.	H	α-helix	trans	-55.5	-48.5	173.7	-71.2	168	0	0	0	109.3	L112 L118 V119 F120	L112-I116 WeakPolarHBondContact O-CB 3.48Å; L112-I116 WeakPolarHBondContact O-CD1 3.5Å; L112-I116 WeakPolarHBondContact O-CG1 3.27Å; L112-I116 PolarHBondContact O-N 2.86Å; I116-L118 VanDerWaalsContact C-N 3.33Å; I116-L118 PolarHBondContact O-N 3.07Å; I116-V119 PolarHBondContact O-N 3.42Å; I116-F120 HydrophobicContact CG2-CD2 3.62Å; I116-F120 HydrophobicContact CG2-CE2 3.8Å; I116-F120 WeakPolarHBondContact O-CD2 3.25Å; I116-F120 PolarHBondContact O-N 3.36Å
117	S	86.1	Confident	81.1	Confident	4 Å²	4	67 Å²	67	3%	0.028	37%	0.367	C	S	.	.	H	α-helix	trans	-59.6	-41.6	178.4	-60.1	0	0	0	0	112.4	V113 S114 V115 S121 L132	V113-S117 WeakPolarHBondContact O-CB 3.3Å; V113-S117 PolarHBondContact O-N 2.95Å; V113-S117 PolarHBondContact O-OG 3.22Å; S114-S117 WeakPolarHBondContact O-CB 3.35Å; S114-S117 PolarHBondContact O-N 3.47Å; V115-S117 VanDerWaalsContact C-N 3.28Å; V115-S117 PolarHBondContact O-N 2.83Å; S117-S121 WeakPolarHBondContact O-CB 3.5Å; S117-S121 PolarHBondContact O-N 3.36Å; S117-L132 WeakPolarHBondContact O-CD1 3.32Å
118	L	85.6	Confident	79.9	Confident	24 Å²	24	70 Å²	70	13%	0.126	39%	0.387	C	S	.	.	H	α-helix	trans	-63.9	-43.2	176.8	-75.2	169.7	0	0	0	112.4	F11 L14 L15 T18 S114 V115 I116 S121 P122	F11-L118 HydrophobicContact CD2-CD2 4.21Å; F11-L118 HydrophobicContact CE1-CD2 4.39Å; F11-L118 HydrophobicContact CE2-CD2 3.56Å; F11-L118 HydrophobicContact CZ-CD2 3.68Å; L14-L118 HydrophobicContact CB-CD2 4.18Å; L14-L118 HydrophobicContact CD2-CD2 3.75Å; L14-L118 HydrophobicContact CD2-CG 4.06Å; L14-L118 HydrophobicContact CG-CD2 3.77Å; L14-L118 HydrophobicContact CG-CG 4.07Å; L15-L118 HydrophobicContact CB-CD2 4.41Å; L15-L118 HydrophobicContact CD1-CD1 4.04Å; L15-L118 HydrophobicContact CD1-CD2 4.49Å; T18-L118 HydrophobicContact CG2-CD1 4.05Å; S114-L118 WeakPolarHBondContact O-CG 3.45Å; S114-L118 PolarHBondContact O-N 2.81Å; V115-L118 PolarHBondContact O-N 2.88Å; V115-L118 VanDerWaalsContact O-N 3.17Å; I116-L118 VanDerWaalsContact C-N 3.33Å; I116-L118 PolarHBondContact O-N 3.07Å; L118-S121 PolarHBondContact O-N 3.48Å; L118-P122 VanDerWaalsContact O-CD 3.23Å; L118-P122 WeakPolarHBondContact O-CD 3.35Å
119	V	86	Confident	78.8	Confident	94 Å²	94	68.4 Å²	68.4	57%	0.57	38%	0.377	S	S	*	.	H	α-helix	trans	-67	-40.8	179.8	172.9	0	0	0	0	111.5	V115 I116 P122	V115-V119 HydrophobicContact CG1-CG2 4.46Å; V115-V119 WeakPolarHBondContact O-CG2 3.25Å; V115-V119 PolarHBondContact O-N 2.85Å; I116-V119 PolarHBondContact O-N 3.42Å; V119-P122 WeakPolarHBondContact O-CD 3.44Å
120	F	81.6	Confident	77.7	Confident	120 Å²	120	68.1 Å²	68.1	53%	0.526	38%	0.383	S	S	.	.	H	α-helix	trans	-81.3	-17.7	179.9	-75.1	-72.7	0	0	0	113.5	I116 C123 C124	I116-F120 HydrophobicContact CG2-CD2 3.62Å; I116-F120 HydrophobicContact CG2-CE2 3.8Å; I116-F120 WeakPolarHBondContact O-CD2 3.25Å; I116-F120 PolarHBondContact O-N 3.36Å; F120-C123 PolarHBondContact O-N 2.97Å; F120-C123 VanDerWaalsContact O-N 3.09Å; F120-C124 PolarHBondContact O-N 3.45Å; F120-C124 VanDerWaalsContact O-N 3.17Å; F120-C124 PolarHBondContact O-SG 3.3Å
121	S	77.1	Confident	77	Confident	31 Å²	31	71.5 Å²	71.5	22%	0.217	41%	0.406	C	S	.	.	G	3₁₀ helix	trans	-54.2	-46.9	-179.8	-164.2	0	0	0	0	114.9	S117 L118 C123 L132	S117-S121 WeakPolarHBondContact O-CB 3.5Å; S117-S121 PolarHBondContact O-N 3.36Å; L118-S121 PolarHBondContact O-N 3.48Å; S121-C123 VanDerWaalsContact C-N 3.29Å; S121-C123 PolarHBondContact O-N 3.31Å; S121-L132 VanDerWaalsContact CA-CD1 3.45Å
122	P	69.5	Low	76.5	Confident	107 Å²	107	71.4 Å²	71.4	70%	0.695	40%	0.404	S	S	*	.	G	3₁₀ helix	trans	-71.2	-20	177.2	26	-34.5	0	0	0	114.1	L118 V119	L118-P122 VanDerWaalsContact O-CD 3.23Å; L118-P122 WeakPolarHBondContact O-CD 3.35Å; V119-P122 WeakPolarHBondContact O-CD 3.44Å
123	C	67.8	Low	76	Confident	101 Å²	101	67.2 Å²	67.2	68%	0.682	38%	0.383	S	S	*	.	G	3₁₀ helix	trans	-94.8	-9.7	-176.3	-60.4	0	0	0	0	113.8	F120 S121	F120-C123 PolarHBondContact O-N 2.97Å; F120-C123 VanDerWaalsContact O-N 3.09Å; S121-C123 VanDerWaalsContact C-N 3.29Å; S121-C123 PolarHBondContact O-N 3.31Å
124	C	62.6	Low	75.8	Confident	46 Å²	46	72.1 Å²	72.1	31%	0.311	40%	0.403	S	S	.	.			trans	-86.9	116.2	-172.9	-76.8	0	0	0	0	112.7	F120 C128	F120-C124 PolarHBondContact O-N 3.45Å; F120-C124 VanDerWaalsContact O-N 3.17Å; F120-C124 PolarHBondContact O-SG 3.3Å; C124-C128 HydrophobicContact CB-CB 3.79Å
125	C	60.2	Low	75.7	Confident	98 Å²	98	78.2 Å²	78.2	66%	0.662	43%	0.426	S	S	*	.			trans	-58.9	158.7	163.2	-57.4	0	0	0	0	110.9	R127 C128	C125-R127 PolarHBondContact O-N 2.89Å; C125-C128 PolarHBondContact O-N 3.29Å
126	N	59.9	Low	75.7	Confident	136 Å²	136	75.4 Å²	75.4	73%	0.727	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.9	-25.3	-174.5	-140.5	11.6	0	0	0	114.5
127	R	61.2	Low	75.7	Confident	234 Å²	234	74.7 Å²	74.7	88%	0.883	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-32.8	178.8	-153	168.6	-168.8	170.2	2.1	114.5	C125 G129	C125-R127 PolarHBondContact O-N 2.89Å; R127-G129 VanDerWaalsContact C-N 3.25Å
128	C	66.1	Low	76	Confident	63 Å²	63	76.8 Å²	76.8	43%	0.426	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-7.6	177.2	-64.2	0	0	0	0	112.4	C124 C125 S130 C131 L132	C124-C128 HydrophobicContact CB-CB 3.79Å; C125-C128 PolarHBondContact O-N 3.29Å; C128-S130 PolarHBondContact O-N 3.21Å; C128-C131 WeakPolarHBondContact O-CB 3.29Å; C128-C131 PolarHBondContact O-N 2.9Å; C128-L132 PolarHBondContact O-N 3.49Å
129	G	65.9	Low	76.2	Confident	3 Å²	3	75.6 Å²	75.6	3%	0.031	41%	0.41	C	S	.	.	H	α-helix	trans	-54.8	-52.4	-178.8	0	0	0	0	0	112.2	R127 C131 L132 T133 R199	R127-G129 VanDerWaalsContact C-N 3.25Å; G129-C131 PolarHBondContact O-N 3.32Å; G129-C131 VanDerWaalsContact O-N 3.13Å; G129-L132 WeakPolarHBondContact O-CA 3.32Å; G129-L132 VanDerWaalsContact O-CB 3.31Å; G129-L132 WeakPolarHBondContact O-CB 3.3Å; G129-L132 PolarHBondContact O-N 3.27Å; G129-T133 PolarHBondContact O-N 2.93Å; G129-T133 VanDerWaalsContact O-N 3.14Å; G129-T133 PolarHBondContact O-OG1 2.83Å; G129-R199 PolarHBondContact O-NH1 3.35Å; G129-R199 PolarHBondContact O-NH2 2.95Å
130	S	69.5	Low	76.4	Confident	78 Å²	78	71.3 Å²	71.3	55%	0.545	38%	0.384	S	S	.	.	H	α-helix	trans	-53.6	-38.5	-176.2	-57	0	0	0	0	113.2	C128 L132 T133 F134	C128-S130 PolarHBondContact O-N 3.21Å; S130-L132 PolarHBondContact O-N 3Å; S130-T133 WeakPolarHBondContact CA-OG1 3.49Å; S130-T133 PolarHBondContact O-N 2.66Å; S130-T133 PolarHBondContact O-OG1 3.2Å; S130-F134 PolarHBondContact O-N 3.41Å; S130-F134 VanDerWaalsContact O-N 3.14Å
131	C	76.9	Confident	77	Confident	71 Å²	71	70.5 Å²	70.5	48%	0.48	39%	0.385	S	S	.	.	H	α-helix	trans	-61.3	-44.2	174.8	-56.8	0	0	0	0	111.1	C128 G129 T133 F134 W135	C128-C131 WeakPolarHBondContact O-CB 3.29Å; C128-C131 PolarHBondContact O-N 2.9Å; G129-C131 PolarHBondContact O-N 3.32Å; G129-C131 VanDerWaalsContact O-N 3.13Å; C131-T133 PolarHBondContact O-N 3.36Å; C131-F134 WeakPolarHBondContact O-CB 3.34Å; C131-F134 PolarHBondContact O-N 3.32Å; C131-W135 PolarHBondContact O-N 3.29Å
132	L	78.9	Confident	77.7	Confident	8 Å²	8	70 Å²	70	4%	0.042	38%	0.381	C	S	.	.	H	α-helix	trans	-63	-41.1	179.3	-168.2	146.5	0	0	0	112.6	S117 S121 C128 G129 S130 F134 W135 V136 L195	S117-L132 WeakPolarHBondContact O-CD1 3.32Å; S121-L132 VanDerWaalsContact CA-CD1 3.45Å; C128-L132 PolarHBondContact O-N 3.49Å; G129-L132 WeakPolarHBondContact O-CA 3.32Å; G129-L132 VanDerWaalsContact O-CB 3.31Å; G129-L132 WeakPolarHBondContact O-CB 3.3Å; G129-L132 PolarHBondContact O-N 3.27Å; S130-L132 PolarHBondContact O-N 3Å; L132-F134 VanDerWaalsContact C-N 3.29Å; L132-F134 PolarHBondContact O-N 2.81Å; L132-W135 PolarHBondContact O-N 3.43Å; L132-V136 HydrophobicContact CD2-CG2 4.14Å; L132-V136 VanDerWaalsContact O-CG2 3.24Å; L132-V136 WeakPolarHBondContact O-CG2 3.3Å; L132-V136 PolarHBondContact O-N 2.91Å; L132-L195 HydrophobicContact CD2-CD1 3.92Å
133	T	83.4	Confident	78.8	Confident	23 Å²	23	64.9 Å²	64.9	14%	0.141	35%	0.348	C	S	.	.	H	α-helix	trans	-61.7	-40.8	173.7	23.2	0	0	0	0	112.2	G129 S130 C131 V136 L137 L195 R199	G129-T133 PolarHBondContact O-N 2.93Å; G129-T133 VanDerWaalsContact O-N 3.14Å; G129-T133 PolarHBondContact O-OG1 2.83Å; S130-T133 WeakPolarHBondContact CA-OG1 3.49Å; S130-T133 PolarHBondContact O-N 2.66Å; S130-T133 PolarHBondContact O-OG1 3.2Å; C131-T133 PolarHBondContact O-N 3.36Å; T133-V136 PolarHBondContact O-N 3.28Å; T133-L137 WeakPolarHBondContact O-CB 3.3Å; T133-L137 PolarHBondContact O-N 3.46Å; T133-L195 HydrophobicContact CG2-CB 3.31Å; T133-L195 HydrophobicContact CG2-CD1 4.41Å; T133-L195 HydrophobicContact CG2-CG 4.49Å; T133-R199 PolarHBondContact OG1-NH1 3.45Å
134	F	85.7	Confident	79.9	Confident	123 Å²	123	63.7 Å²	63.7	54%	0.539	34%	0.337	S	S	.	.	H	α-helix	trans	-65.8	-43.9	-180	-179.9	-104.1	0	0	0	111.4	S130 C131 L132 L137 I138	S130-F134 PolarHBondContact O-N 3.41Å; S130-F134 VanDerWaalsContact O-N 3.14Å; C131-F134 WeakPolarHBondContact O-CB 3.34Å; C131-F134 PolarHBondContact O-N 3.32Å; L132-F134 VanDerWaalsContact C-N 3.29Å; L132-F134 PolarHBondContact O-N 2.81Å; F134-L137 PolarHBondContact O-N 3.42Å; F134-I138 HydrophobicContact CD1-CD1 3.75Å; F134-I138 HydrophobicContact CE1-CD1 3.28Å; F134-I138 HydrophobicContact CE1-CG1 4.33Å; F134-I138 HydrophobicContact CE2-CD1 4.4Å; F134-I138 HydrophobicContact CG-CD1 4.49Å; F134-I138 HydrophobicContact CZ-CD1 3.66Å; F134-I138 HydrophobicContact CZ-CG1 4.38Å; F134-I138 WeakPolarHBondContact O-CG1 3.25Å; F134-I138 PolarHBondContact O-N 2.99Å
135	W	88.2	Confident	81.3	Confident	128 Å²	128	63.6 Å²	63.6	49%	0.485	34%	0.34	S	S	.	.	H	α-helix	trans	-63.4	-42.7	176	-71.4	121	0	0	0	112.9	V113 C131 L132 L137 I138 A139	V113-W135 HydrophobicContact CG1-CB 3.92Å; V113-W135 HydrophobicContact CG1-CE3 4Å; V113-W135 VanDerWaalsContact CG1-O 3.24Å; V113-W135 WeakPolarHBondContact CG1-O 3.38Å; C131-W135 PolarHBondContact O-N 3.29Å; L132-W135 PolarHBondContact O-N 3.43Å; W135-L137 VanDerWaalsContact C-N 3.29Å; W135-L137 PolarHBondContact O-N 2.9Å; W135-I138 HydrophobicContact CE3-CD1 4.07Å; W135-I138 HydrophobicContact CZ3-CD1 4.2Å; W135-I138 PolarHBondContact O-N 2.68Å; W135-A139 PolarHBondContact O-N 2.97Å
136	V	88.8	Confident	82.7	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-63.9	-37.3	176.2	176.3	0	0	0	0	111.1	L14 L132 T133 A139 A140	L14-V136 HydrophobicContact CD1-CG1 3.62Å; L14-V136 HydrophobicContact CD1-CG2 4.06Å; L14-V136 HydrophobicContact CD2-CG2 3.71Å; L132-V136 HydrophobicContact CD2-CG2 4.14Å; L132-V136 VanDerWaalsContact O-CG2 3.24Å; L132-V136 WeakPolarHBondContact O-CG2 3.3Å; L132-V136 PolarHBondContact O-N 2.91Å; T133-V136 PolarHBondContact O-N 3.28Å; V136-A139 PolarHBondContact O-N 3.3Å; V136-A140 PolarHBondContact O-N 2.98Å
137	L	89.9	Confident	84.2	Confident	77 Å²	77	53 Å²	53	40%	0.403	28%	0.277	S	S	.	.	H	α-helix	trans	-66.7	-41.2	175.4	-174.9	136.5	0	0	0	112	T133 F134 W135 A139 A140 L141	T133-L137 WeakPolarHBondContact O-CB 3.3Å; T133-L137 PolarHBondContact O-N 3.46Å; F134-L137 PolarHBondContact O-N 3.42Å; W135-L137 VanDerWaalsContact C-N 3.29Å; W135-L137 PolarHBondContact O-N 2.9Å; L137-A139 VanDerWaalsContact C-N 3.34Å; L137-A139 PolarHBondContact O-N 3.49Å; L137-A140 PolarHBondContact O-N 2.92Å; L137-L141 HydrophobicContact CD2-CD1 3.71Å; L137-L141 HydrophobicContact CD2-CG 4.3Å; L137-L141 WeakPolarHBondContact O-CG 3.44Å; L137-L141 PolarHBondContact O-N 3.48Å
138	I	90.7	Very high	85.6	Confident	47 Å²	47	43.7 Å²	43.7	24%	0.241	25%	0.253	C	S	.	.	H	α-helix	trans	-59.8	-45.9	172.8	-70.7	171.2	0	0	0	110.5	F134 W135 A140 L141 C142	F134-I138 HydrophobicContact CD1-CD1 3.75Å; F134-I138 HydrophobicContact CE1-CD1 3.28Å; F134-I138 HydrophobicContact CE1-CG1 4.33Å; F134-I138 HydrophobicContact CE2-CD1 4.4Å; F134-I138 HydrophobicContact CG-CD1 4.49Å; F134-I138 HydrophobicContact CZ-CD1 3.66Å; F134-I138 HydrophobicContact CZ-CG1 4.38Å; F134-I138 WeakPolarHBondContact O-CG1 3.25Å; F134-I138 PolarHBondContact O-N 2.99Å; W135-I138 HydrophobicContact CE3-CD1 4.07Å; W135-I138 HydrophobicContact CZ3-CD1 4.2Å; W135-I138 PolarHBondContact O-N 2.68Å; I138-A140 PolarHBondContact O-N 2.88Å; I138-L141 PolarHBondContact O-N 2.86Å; I138-C142 PolarHBondContact O-N 3.42Å; I138-C142 PolarHBondContact O-SG 3.09Å; I138-C142 VanDerWaalsContact O-SG 3.33Å
139	A	90.5	Very high	86.7	Confident	0 Å²	0	43 Å²	43	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-58.9	-46.7	177.6	0	0	0	0	0	111.8	S110 V113 S114 W135 V136 L137 L141 C142 T143	S110-A139 WeakPolarHBondContact CB-O 3.45Å; S110-A139 PolarHBondContact OG-O 3.47Å; V113-A139 HydrophobicContact CB-CB 4.16Å; V113-A139 HydrophobicContact CG1-CB 4.02Å; S114-A139 WeakPolarHBondContact OG-CB 3.46Å; W135-A139 PolarHBondContact O-N 2.97Å; V136-A139 PolarHBondContact O-N 3.3Å; L137-A139 VanDerWaalsContact C-N 3.34Å; L137-A139 PolarHBondContact O-N 3.49Å; A139-L141 PolarHBondContact O-N 3.1Å; A139-C142 WeakPolarHBondContact O-CB 3.39Å; A139-C142 PolarHBondContact O-N 2.69Å; A139-T143 PolarHBondContact O-N 3.42Å; A139-T143 PolarHBondContact O-OG1 3.47Å
140	A	90.8	Very high	87.6	Confident	3 Å²	3	43.2 Å²	43.2	3%	0.025	25%	0.247	C	C	.	.	H	α-helix	trans	-58.8	-45.5	176.4	0	0	0	0	0	111.9	V136 L137 I138 C142 T143 V144 Q188 M189	V136-A140 PolarHBondContact O-N 2.98Å; L137-A140 PolarHBondContact O-N 2.92Å; I138-A140 PolarHBondContact O-N 2.88Å; A140-C142 VanDerWaalsContact C-N 3.35Å; A140-C142 PolarHBondContact O-N 2.89Å; A140-T143 PolarHBondContact O-N 2.91Å; A140-V144 WeakPolarHBondContact O-CG2 3.49Å; A140-V144 PolarHBondContact O-N 3.38Å; A140-Q188 HydrophobicContact CB-CB 3.86Å; A140-M189 HydrophobicContact CB-CB 4.22Å
141	L	93.1	Very high	88.5	Confident	103 Å²	103	40 Å²	40	54%	0.539	23%	0.225	S	C	.	.	H	α-helix	trans	-62.6	-40.4	176.8	-73.4	178.7	0	0	0	112.2	L137 I138 A139 T143 V144 A145	L137-L141 HydrophobicContact CD2-CD1 3.71Å; L137-L141 HydrophobicContact CD2-CG 4.3Å; L137-L141 WeakPolarHBondContact O-CG 3.44Å; L137-L141 PolarHBondContact O-N 3.48Å; I138-L141 PolarHBondContact O-N 2.86Å; A139-L141 PolarHBondContact O-N 3.1Å; L141-T143 VanDerWaalsContact C-N 3.35Å; L141-V144 PolarHBondContact O-N 2.94Å; L141-A145 VanDerWaalsContact O-CB 3.23Å; L141-A145 WeakPolarHBondContact O-CB 3.49Å; L141-A145 PolarHBondContact O-N 3.32Å
142	C	93.1	Very high	88.9	Confident	21 Å²	21	44.5 Å²	44.5	14%	0.142	23%	0.234	C	C	.	.	H	α-helix	trans	-62.4	-41.7	174.8	-72.7	0	0	0	0	111.7	L106 I138 A139 A140 A145 G146	L106-C142 HydrophobicContact CD2-CB 4.37Å; I138-C142 PolarHBondContact O-N 3.42Å; I138-C142 PolarHBondContact O-SG 3.09Å; I138-C142 VanDerWaalsContact O-SG 3.33Å; A139-C142 WeakPolarHBondContact O-CB 3.39Å; A139-C142 PolarHBondContact O-N 2.69Å; A140-C142 VanDerWaalsContact C-N 3.35Å; A140-C142 PolarHBondContact O-N 2.89Å; C142-A145 PolarHBondContact O-N 2.88Å; C142-G146 PolarHBondContact O-N 2.95Å
143	T	91.3	Very high	89.2	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-64.8	-46.1	175.4	-63.9	0	0	0	0	111.7	V21 M107 S110 A139 A140 L141 A145 G146 V147 Q188	V21-T143 HydrophobicContact CG2-CG2 4.03Å; M107-T143 HydrophobicContact CE-CG2 4.15Å; M107-T143 HydrophobicContact SD-CG2 4.02Å; S110-T143 VanDerWaalsContact CB-OG1 3.23Å; S110-T143 WeakPolarHBondContact CB-OG1 3.35Å; S110-T143 PolarHBondContact OG-OG1 3.39Å; A139-T143 PolarHBondContact O-N 3.42Å; A139-T143 PolarHBondContact O-OG1 3.47Å; A140-T143 PolarHBondContact O-N 2.91Å; L141-T143 VanDerWaalsContact C-N 3.35Å; T143-A145 VanDerWaalsContact C-N 3.33Å; T143-A145 PolarHBondContact O-N 3.41Å; T143-G146 PolarHBondContact O-N 3.11Å; T143-V147 HydrophobicContact CG2-CG2 4.26Å; T143-V147 WeakPolarHBondContact O-CB 3.4Å; T143-V147 VanDerWaalsContact O-CG2 3.28Å; T143-V147 WeakPolarHBondContact O-CG2 3.27Å; T143-V147 PolarHBondContact O-N 3.3Å; T143-Q188 PolarHBondContact OG1-OE1 2.87Å
144	V	91.4	Very high	88.8	Confident	75 Å²	75	45.8 Å²	45.8	46%	0.455	24%	0.238	S	C	.	.	H	α-helix	trans	-61.8	-42.7	177.5	172.9	0	0	0	0	110.9	A140 L141 G148	A140-V144 WeakPolarHBondContact O-CG2 3.49Å; A140-V144 PolarHBondContact O-N 3.38Å; L141-V144 PolarHBondContact O-N 2.94Å; V144-G148 WeakPolarHBondContact O-CA 3.4Å; V144-G148 PolarHBondContact O-N 2.84Å
145	A	92.7	Very high	88.4	Confident	44 Å²	44	46.7 Å²	46.7	36%	0.364	24%	0.239	S	C	.	.	H	α-helix	trans	-64.4	-42.6	175.9	0	0	0	0	0	111.9	L106 L141 C142 T143 T149	L106-A145 HydrophobicContact CD1-CB 4.25Å; L141-A145 VanDerWaalsContact O-CB 3.23Å; L141-A145 WeakPolarHBondContact O-CB 3.49Å; L141-A145 PolarHBondContact O-N 3.32Å; C142-A145 PolarHBondContact O-N 2.88Å; T143-A145 VanDerWaalsContact C-N 3.33Å; T143-A145 PolarHBondContact O-N 3.41Å; A145-T149 VanDerWaalsContact O-CB 3.27Å; A145-T149 WeakPolarHBondContact O-CB 3.14Å; A145-T149 PolarHBondContact O-N 3.37Å; A145-T149 PolarHBondContact O-OG1 3.47Å
146	G	89.4	Confident	87.7	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-64	-50	177.8	0	0	0	0	0	112.3	V103 C142 T143 T149 Y150	V103-G146 WeakPolarHBondContact CG2-O 3.37Å; C142-G146 PolarHBondContact O-N 2.95Å; T143-G146 PolarHBondContact O-N 3.11Å; G146-T149 PolarHBondContact O-N 3.05Å; G146-Y150 WeakPolarHBondContact O-CB 3.25Å; G146-Y150 PolarHBondContact O-N 3.24Å
147	V	90.8	Very high	86.7	Confident	12 Å²	12	43.8 Å²	43.8	7%	0.073	24%	0.236	C	C	.	.	H	α-helix	trans	-61.8	-45.3	176	171	0	0	0	0	111.1	M107 T143 Y150 A151 Y178 A181 V182	M107-V147 HydrophobicContact SD-CG2 4.44Å; T143-V147 HydrophobicContact CG2-CG2 4.26Å; T143-V147 WeakPolarHBondContact O-CB 3.4Å; T143-V147 VanDerWaalsContact O-CG2 3.28Å; T143-V147 WeakPolarHBondContact O-CG2 3.27Å; T143-V147 PolarHBondContact O-N 3.3Å; V147-Y150 WeakPolarHBondContact O-CB 3.4Å; V147-Y150 PolarHBondContact O-N 3.19Å; V147-A151 WeakPolarHBondContact O-CB 3.44Å; V147-A151 PolarHBondContact O-N 2.87Å; V147-Y178 HydrophobicContact CB-CE2 4.47Å; V147-Y178 HydrophobicContact CG1-CD2 4.29Å; V147-Y178 HydrophobicContact CG1-CE2 3.47Å; V147-Y178 VanDerWaalsContact CG1-CE2 3.47Å; V147-A181 HydrophobicContact CG2-CB 3.71Å; V147-V182 HydrophobicContact CG1-CG2 3.51Å
148	G	89.9	Confident	85.3	Confident	38 Å²	38	43.7 Å²	43.7	39%	0.392	24%	0.236	S	C	.	.	H	α-helix	trans	-64.3	-42.1	179.7	0	0	0	0	0	112.7	V144 A151 Y152	V144-G148 WeakPolarHBondContact O-CA 3.4Å; V144-G148 PolarHBondContact O-N 2.84Å; G148-A151 PolarHBondContact O-N 3.23Å; G148-Y152 VanDerWaalsContact O-CB 3.25Å; G148-Y152 WeakPolarHBondContact O-CB 3.25Å; G148-Y152 PolarHBondContact O-N 2.87Å
149	T	88.8	Confident	83.6	Confident	48 Å²	48	48.9 Å²	48.9	29%	0.294	26%	0.259	S	S	.	.	H	α-helix	trans	-63.6	-44.1	174.4	-54.4	0	0	0	0	110.6	W99 V103 A145 G146 A151 Y152 E153	W99-T149 HydrophobicContact CB-CG2 4.46Å; V103-T149 HydrophobicContact CG2-CG2 3.96Å; A145-T149 VanDerWaalsContact O-CB 3.27Å; A145-T149 WeakPolarHBondContact O-CB 3.14Å; A145-T149 PolarHBondContact O-N 3.37Å; A145-T149 PolarHBondContact O-OG1 3.47Å; G146-T149 PolarHBondContact O-N 3.05Å; T149-A151 PolarHBondContact O-N 2.73Å; T149-Y152 PolarHBondContact O-N 2.91Å; T149-E153 HydrophobicContact CG2-CG 4.34Å; T149-E153 WeakPolarHBondContact O-CB 3.27Å; T149-E153 VanDerWaalsContact O-CG 3.3Å; T149-E153 WeakPolarHBondContact O-CG 2.92Å; T149-E153 PolarHBondContact O-N 2.8Å
150	Y	86.9	Confident	81.8	Confident	9 Å²	9	55.8 Å²	55.8	4%	0.035	29%	0.289	C	S	.	.	H	α-helix	trans	-58.8	-48.6	176.2	-169.6	-86.9	0	0	0	111.8	W30 S31 L51 W99 V103 G146 V147 E153 V154 F174 Y178	W30-Y150 HydrophobicContact CB-CE1 4.25Å; W30-Y150 HydrophobicContact CB-CE2 4.27Å; W30-Y150 HydrophobicContact CE3-CD1 4.07Å; W30-Y150 AromaticContact CE3-CD2 3.95Å; W30-Y150 HydrophobicContact CE3-CD2 3.95Å; W30-Y150 HydrophobicContact CE3-CE1 4.22Å; W30-Y150 HydrophobicContact CE3-CE2 4.1Å; W30-Y150 AromaticContact CE3-CG 3.95Å; W30-Y150 HydrophobicContact CE3-CG 3.95Å; W30-Y150 HydrophobicContact CZ3-CD2 4.37Å; W30-Y150 HydrophobicContact CZ3-CG 4.22Å; S31-Y150 WeakPolarHBondContact CB-OH 3.45Å; S31-Y150 PolarHBondContact OG-OH 3.43Å; L51-Y150 HydrophobicContact CD1-CD2 4.4Å; L51-Y150 HydrophobicContact CD1-CE2 4.35Å; W99-Y150 HydrophobicContact CH2-CD2 4.36Å; W99-Y150 HydrophobicContact CH2-CE2 4.29Å; W99-Y150 AromaticContact CZ3-CD2 3.68Å; W99-Y150 HydrophobicContact CZ3-CD2 3.68Å; W99-Y150 HydrophobicContact CZ3-CE2 4.03Å; W99-Y150 HydrophobicContact CZ3-CG 4.38Å; V103-Y150 HydrophobicContact CG1-CD2 4.3Å; G146-Y150 WeakPolarHBondContact O-CB 3.25Å; G146-Y150 PolarHBondContact O-N 3.24Å; V147-Y150 WeakPolarHBondContact O-CB 3.4Å; V147-Y150 PolarHBondContact O-N 3.19Å; Y150-E153 PolarHBondContact O-N 3.45Å; Y150-V154 HydrophobicContact CD1-CG2 3.97Å; Y150-V154 HydrophobicContact CE1-CG2 3.66Å; Y150-V154 WeakPolarHBondContact O-CB 3.08Å; Y150-V154 VanDerWaalsContact O-CG2 3.25Å; Y150-V154 WeakPolarHBondContact O-CG2 3.41Å; Y150-V154 PolarHBondContact O-N 3.24Å; Y150-F174 HydrophobicContact CD1-CE1 4.24Å; Y150-F174 HydrophobicContact CE1-CD1 4.37Å; Y150-F174 HydrophobicContact CE1-CE1 4.31Å; Y150-Y178 AromaticContact CD1-CD2 3.86Å; Y150-Y178 HydrophobicContact CD1-CD2 3.86Å; Y150-Y178 HydrophobicContact CD1-CE2 4.19Å; Y150-Y178 HydrophobicContact CE1-CD2 4.44Å
151	A	86.8	Confident	79.7	Confident	10 Å²	10	56.9 Å²	56.9	8%	0.083	30%	0.301	C	S	.	.	H	α-helix	trans	-63.8	-44.6	178.8	0	0	0	0	0	112	V147 G148 T149 E153 V154 Y155 F174 Y178	V147-A151 WeakPolarHBondContact O-CB 3.44Å; V147-A151 PolarHBondContact O-N 2.87Å; G148-A151 PolarHBondContact O-N 3.23Å; T149-A151 PolarHBondContact O-N 2.73Å; A151-E153 PolarHBondContact O-N 3.11Å; A151-V154 PolarHBondContact O-N 2.97Å; A151-Y155 HydrophobicContact CB-CD2 4.49Å; A151-Y155 WeakPolarHBondContact O-CB 3.25Å; A151-Y155 WeakPolarHBondContact O-CD2 3.46Å; A151-Y155 PolarHBondContact O-N 3.46Å; A151-F174 HydrophobicContact CB-CE1 4.35Å; A151-F174 HydrophobicContact CB-CZ 4.18Å; A151-Y178 HydrophobicContact CB-CE2 4.07Å; A151-Y178 WeakPolarHBondContact CB-OH 3.35Å
152	Y	86.6	Confident	77.3	Confident	166 Å²	166	59.3 Å²	59.3	65%	0.651	31%	0.309	S	S	*	.	H	α-helix	trans	-58.9	-47.1	178.3	180	-97.3	0	0	0	111.6	G148 T149 Y155 S156	G148-Y152 VanDerWaalsContact O-CB 3.25Å; G148-Y152 WeakPolarHBondContact O-CB 3.25Å; G148-Y152 PolarHBondContact O-N 2.87Å; T149-Y152 PolarHBondContact O-N 2.91Å; Y152-Y155 PolarHBondContact O-N 3.29Å; Y152-S156 WeakPolarHBondContact O-CB 3.44Å; Y152-S156 PolarHBondContact O-N 3.34Å
153	E	84	Confident	75	Confident	48 Å²	48	66.7 Å²	66.7	22%	0.224	34%	0.341	C	S	.	.	H	α-helix	trans	-65.8	-43	179.7	-70	-72.5	178.9	0	0	111.2	W99 T149 Y150 A151 Y155 S156 T157	W99-E153 HydrophobicContact CB-CG 4.02Å; W99-E153 HydrophobicContact CD2-CB 3.75Å; W99-E153 HydrophobicContact CD2-CG 3.59Å; W99-E153 HydrophobicContact CE3-CB 3.88Å; W99-E153 HydrophobicContact CE3-CG 3.92Å; W99-E153 HydrophobicContact CG-CB 4.28Å; W99-E153 HydrophobicContact CG-CG 3.63Å; W99-E153 HydrophobicContact CH2-CB 4.17Å; W99-E153 HydrophobicContact CZ2-CB 4.03Å; W99-E153 HydrophobicContact CZ3-CB 4.08Å; T149-E153 HydrophobicContact CG2-CG 4.34Å; T149-E153 WeakPolarHBondContact O-CB 3.27Å; T149-E153 VanDerWaalsContact O-CG 3.3Å; T149-E153 WeakPolarHBondContact O-CG 2.92Å; T149-E153 PolarHBondContact O-N 2.8Å; Y150-E153 PolarHBondContact O-N 3.45Å; A151-E153 PolarHBondContact O-N 3.11Å; E153-Y155 PolarHBondContact O-N 3.03Å; E153-S156 PolarHBondContact O-N 2.71Å; E153-S156 PolarHBondContact O-OG 3.48Å; E153-S156 PolarHBondContact OE2-OG 2.83Å; E153-T157 WeakPolarHBondContact O-CG2 3.39Å; E153-T157 PolarHBondContact O-N 3.46Å; E153-T157 PolarHBondContact O-OG1 3.24Å
154	V	75.9	Confident	72.9	Confident	10 Å²	10	73.1 Å²	73.1	6%	0.061	37%	0.374	C	S	.	.	H	α-helix	trans	-59.5	-46.7	174.7	170.4	0	0	0	0	111.5	Y150 A151 S156 T157 D158 V172 F174	Y150-V154 HydrophobicContact CD1-CG2 3.97Å; Y150-V154 HydrophobicContact CE1-CG2 3.66Å; Y150-V154 WeakPolarHBondContact O-CB 3.08Å; Y150-V154 VanDerWaalsContact O-CG2 3.25Å; Y150-V154 WeakPolarHBondContact O-CG2 3.41Å; Y150-V154 PolarHBondContact O-N 3.24Å; A151-V154 PolarHBondContact O-N 2.97Å; V154-S156 VanDerWaalsContact C-N 3.33Å; V154-S156 PolarHBondContact O-N 2.95Å; V154-T157 WeakPolarHBondContact CA-OG1 3.34Å; V154-T157 PolarHBondContact O-N 3.18Å; V154-T157 PolarHBondContact O-OG1 3.48Å; V154-D158 PolarHBondContact O-N 2.93Å; V154-V172 HydrophobicContact CG1-CB 4.21Å; V154-V172 HydrophobicContact CG1-CG1 3.67Å; V154-F174 HydrophobicContact CB-CE1 3.97Å; V154-F174 HydrophobicContact CB-CZ 4.09Å; V154-F174 HydrophobicContact CG1-CE1 3.85Å; V154-F174 HydrophobicContact CG1-CZ 3.81Å; V154-F174 HydrophobicContact CG2-CE1 4.21Å
155	Y	77.1	Confident	70.7	Confident	142 Å²	142	71 Å²	71	56%	0.557	37%	0.365	S	S	*	.	H	α-helix	trans	-64.2	-38	175.8	-80.7	-61.7	0	0	0	112.5	A151 Y152 E153 T157 D158 Q159 F174	A151-Y155 HydrophobicContact CB-CD2 4.49Å; A151-Y155 WeakPolarHBondContact O-CB 3.25Å; A151-Y155 WeakPolarHBondContact O-CD2 3.46Å; A151-Y155 PolarHBondContact O-N 3.46Å; Y152-Y155 PolarHBondContact O-N 3.29Å; E153-Y155 PolarHBondContact O-N 3.03Å; Y155-T157 VanDerWaalsContact C-N 3.3Å; Y155-T157 PolarHBondContact O-N 2.83Å; Y155-D158 PolarHBondContact O-N 3.37Å; Y155-Q159 PolarHBondContact O-N 3.36Å; Y155-F174 HydrophobicContact CD2-CZ 4.36Å; Y155-F174 AromaticContact CE2-CE2 3.94Å; Y155-F174 HydrophobicContact CE2-CE2 3.94Å; Y155-F174 AromaticContact CE2-CZ 3.96Å; Y155-F174 HydrophobicContact CE2-CZ 3.96Å; Y155-F174 AromaticContact CZ-CE2 3.86Å
156	S	74	Confident	68.1	Low	16 Å²	16	74.2 Å²	74.2	11%	0.112	39%	0.385	C	S	.	.	H	α-helix	trans	-66.8	-34.8	177.5	86.7	0	0	0	0	111.9	Y152 E153 V154 Q159 K160	Y152-S156 WeakPolarHBondContact O-CB 3.44Å; Y152-S156 PolarHBondContact O-N 3.34Å; E153-S156 PolarHBondContact O-N 2.71Å; E153-S156 PolarHBondContact O-OG 3.48Å; E153-S156 PolarHBondContact OE2-OG 2.83Å; V154-S156 VanDerWaalsContact C-N 3.33Å; V154-S156 PolarHBondContact O-N 2.95Å; S156-Q159 PolarHBondContact O-N 3.36Å; S156-K160 WeakPolarHBondContact O-CB 3.44Å; S156-K160 WeakPolarHBondContact O-CG 3.47Å; S156-K160 PolarHBondContact O-N 3.28Å
157	T	66.4	Low	66.1	Low	50 Å²	50	81.3 Å²	81.3	31%	0.307	42%	0.421	S	S	.	.	H	α-helix	trans	-70.5	-32.5	174.8	54.5	0	0	0	0	112.2	E153 V154 Y155 G161	E153-T157 WeakPolarHBondContact O-CG2 3.39Å; E153-T157 PolarHBondContact O-N 3.46Å; E153-T157 PolarHBondContact O-OG1 3.24Å; V154-T157 WeakPolarHBondContact CA-OG1 3.34Å; V154-T157 PolarHBondContact O-N 3.18Å; V154-T157 PolarHBondContact O-OG1 3.48Å; Y155-T157 VanDerWaalsContact C-N 3.3Å; Y155-T157 PolarHBondContact O-N 2.83Å; T157-G161 WeakPolarHBondContact O-CA 3.36Å; T157-G161 PolarHBondContact O-N 3.48Å
158	D	60.8	Low	64.1	Low	76 Å²	76	84 Å²	84	41%	0.406	44%	0.437	S	S	.	.	H	α-helix	trans	-68.2	-41.2	174.6	-161	19.3	0	0	0	110.9	V154 Y155 G161 H162	V154-D158 PolarHBondContact O-N 2.93Å; Y155-D158 PolarHBondContact O-N 3.37Å; D158-G161 PolarHBondContact O-N 2.63Å; D158-H162 PolarHBondContact O-N 2.84Å
159	Q	56	Low	62.2	Low	156 Å²	156	90.4 Å²	90.4	73%	0.729	46%	0.457	S	S	*	.	H	α-helix	trans	-66.6	-44.7	176	-73.5	-171.9	-19.3	0	0	113.3	Y155 S156 G161 H162	Y155-Q159 PolarHBondContact O-N 3.36Å; S156-Q159 PolarHBondContact O-N 3.36Å; Q159-G161 VanDerWaalsContact C-N 3.29Å; Q159-H162 PolarHBondContact O-N 3Å
160	K	52.5	Low	60.5	Low	145 Å²	145	89.6 Å²	89.6	63%	0.63	46%	0.458	S	S	*	.	H	α-helix	trans	-68.5	-33.5	174.9	-69.6	174.5	-177.3	170.8	0	111.5	S156 H162	S156-K160 WeakPolarHBondContact O-CB 3.44Å; S156-K160 WeakPolarHBondContact O-CG 3.47Å; S156-K160 PolarHBondContact O-N 3.28Å; K160-H162 VanDerWaalsContact C-N 3.35Å
161	G	46.7	Very low	59.4	Low	25 Å²	25	93 Å²	93	26%	0.258	48%	0.48	S	S	.	.	H	α-helix	trans	-61.2	-43.7	172.9	0	0	0	0	0	110.7	T157 D158 Q159 E163 I164 A165	T157-G161 WeakPolarHBondContact O-CA 3.36Å; T157-G161 PolarHBondContact O-N 3.48Å; D158-G161 PolarHBondContact O-N 2.63Å; Q159-G161 VanDerWaalsContact C-N 3.29Å; G161-E163 PolarHBondContact O-N 3.22Å; G161-E163 VanDerWaalsContact O-N 3.1Å; G161-I164 CarbonylContact O-C 3.49Å; G161-I164 PolarHBondContact O-N 3.45Å; G161-A165 WeakPolarHBondContact O-CA 3.19Å; G161-A165 WeakPolarHBondContact O-CB 3.4Å; G161-A165 PolarHBondContact O-N 2.86Å
162	H	42.8	Very low	58.4	Low	155 Å²	155	94 Å²	94	72%	0.718	49%	0.485	S	S	*	.	H	α-helix	trans	-58.4	-29	-176.2	-149.2	61.1	0	0	0	114.4	D158 Q159 K160	D158-H162 PolarHBondContact O-N 2.84Å; Q159-H162 PolarHBondContact O-N 3Å; K160-H162 VanDerWaalsContact C-N 3.35Å
163	E	45.3	Very low	57.9	Low	175 Å²	175	89.3 Å²	89.3	82%	0.818	47%	0.474	S	S	*	.	H	α-helix	trans	-75.3	-21.7	174.7	-71.8	-170.7	152.2	0	0	113.7	G161	G161-E163 PolarHBondContact O-N 3.22Å; G161-E163 VanDerWaalsContact O-N 3.1Å
164	I	46.1	Very low	57.8	Low	135 Å²	135	89 Å²	89	69%	0.692	47%	0.472	S	S	*	.	H	α-helix	trans	-109.9	-21.6	-178.5	-48	175.4	0	0	0	111.4	G161 S166	G161-I164 CarbonylContact O-C 3.49Å; G161-I164 PolarHBondContact O-N 3.45Å; I164-S166 PolarHBondContact O-N 3.28Å
165	A	44.7	Very low	58	Low	31 Å²	31	88.5 Å²	88.5	26%	0.256	47%	0.469	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	14	-168.6	0	0	0	0	0	114.3	G161 I167 T168	G161-A165 WeakPolarHBondContact O-CA 3.19Å; G161-A165 WeakPolarHBondContact O-CB 3.4Å; G161-A165 PolarHBondContact O-N 2.86Å; A165-I167 PolarHBondContact O-N 3.16Å; A165-T168 WeakPolarHBondContact CB-O 3.42Å; A165-T168 PolarHBondContact O-N 3.38Å
166	S	39.7	Very low	58.3	Low	112 Å²	112	91.2 Å²	91.2	78%	0.783	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-10.8	160.5	62	0	0	0	0	112.4	I164	I164-S166 PolarHBondContact O-N 3.28Å
167	I	47.3	Very low	58.9	Low	149 Å²	149	90.6 Å²	90.6	76%	0.764	47%	0.473	S	S	*	.	S	Bend	trans	-111.1	-16.8	-177.8	-53.9	174.2	0	0	0	112.6	A165	A165-I167 PolarHBondContact O-N 3.16Å
168	T	48.8	Very low	59.9	Low	67 Å²	67	89.5 Å²	89.5	41%	0.411	46%	0.464	S	S	.	.			trans	-146.8	103.9	-177.7	48.4	0	0	0	0	111.9	L37 A165 G170	L37-T168 HydrophobicContact CD1-CG2 3.88Å; A165-T168 WeakPolarHBondContact CB-O 3.42Å; A165-T168 PolarHBondContact O-N 3.38Å; T168-G170 VanDerWaalsContact C-N 3.29Å; T168-G170 PolarHBondContact O-N 2.84Å
169	H	48.9	Very low	61.3	Low	173 Å²	173	93.3 Å²	93.3	80%	0.801	47%	0.473	S	S	*	.			trans	-67	78.2	173.8	-86.5	-83.9	0	0	0	112
170	G	54.3	Low	63	Low	31 Å²	31	88.1 Å²	88.1	32%	0.32	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	93.3	168	0	0	0	0	0	110.3	T168	T168-G170 VanDerWaalsContact C-N 3.29Å; T168-G170 PolarHBondContact O-N 2.84Å
171	T	62.7	Low	64.7	Low	80 Å²	80	81.2 Å²	81.2	49%	0.491	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	115.6	171	52.8	0	0	0	0	109.3	S34	S34-T171 PolarHBondContact OG-OG1 2.98Å
172	V	66.8	Low	66.8	Low	33 Å²	33	82.1 Å²	82.1	20%	0.2	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	118.1	173.2	-176.4	0	0	0	0	108.8	D33 V154	D33-V172 HydrophobicContact CB-CG2 4.42Å; V154-V172 HydrophobicContact CG1-CB 4.21Å; V154-V172 HydrophobicContact CG1-CG1 3.67Å
173	T	75.8	Confident	69.2	Low	67 Å²	67	76.8 Å²	76.8	41%	0.411	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	140.4	177.5	57.6	0	0	0	0	110.5	S31 Y32 G175	S31-T173 CarbonylContact C-O 3.43Å; S31-T173 WeakPolarHBondContact CA-O 3.28Å; S31-T173 VanDerWaalsContact CB-O 3.3Å; S31-T173 WeakPolarHBondContact CB-O 3.2Å; Y32-T173 PolarHBondContact N-O 3.34Å; Y32-T173 PolarHBondContact O-N 3.16Å; Y32-T173 PolarHBondContact O-OG1 2.93Å; T173-G175 PolarHBondContact O-N 3.23Å
174	F	81	Confident	71.3	Confident	41 Å²	41	68.4 Å²	68.4	18%	0.18	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	128.8	174.2	-66.4	-70.4	0	0	0	110.2	Y150 A151 V154 Y155 Y178	Y150-F174 HydrophobicContact CD1-CE1 4.24Å; Y150-F174 HydrophobicContact CE1-CD1 4.37Å; Y150-F174 HydrophobicContact CE1-CE1 4.31Å; A151-F174 HydrophobicContact CB-CE1 4.35Å; A151-F174 HydrophobicContact CB-CZ 4.18Å; V154-F174 HydrophobicContact CB-CE1 3.97Å; V154-F174 HydrophobicContact CB-CZ 4.09Å; V154-F174 HydrophobicContact CG1-CE1 3.85Å; V154-F174 HydrophobicContact CG1-CZ 3.81Å; V154-F174 HydrophobicContact CG2-CE1 4.21Å; Y155-F174 HydrophobicContact CD2-CZ 4.36Å; Y155-F174 AromaticContact CE2-CE2 3.94Å; Y155-F174 HydrophobicContact CE2-CE2 3.94Å; Y155-F174 AromaticContact CE2-CZ 3.96Å; Y155-F174 HydrophobicContact CE2-CZ 3.96Å; Y155-F174 AromaticContact CZ-CE2 3.86Å; F174-Y178 HydrophobicContact CB-CD1 3.89Å; F174-Y178 HydrophobicContact CB-CG 4.29Å; F174-Y178 AromaticContact CD1-CD1 3.9Å; F174-Y178 HydrophobicContact CD1-CD1 3.9Å; F174-Y178 HydrophobicContact CD1-CD2 4.02Å; F174-Y178 HydrophobicContact CD1-CE1 4.15Å; F174-Y178 HydrophobicContact CD1-CE2 4.24Å; F174-Y178 AromaticContact CD1-CG 3.85Å; F174-Y178 HydrophobicContact CD1-CG 3.85Å; F174-Y178 HydrophobicContact CE1-CD2 4.41Å; F174-Y178 HydrophobicContact CE1-CE2 4.25Å; F174-Y178 AromaticContact CG-CD1 3.96Å; F174-Y178 HydrophobicContact CG-CD1 3.96Å; F174-Y178 HydrophobicContact CG-CE1 4.21Å; F174-Y178 HydrophobicContact CG-CG 4.32Å
175	G	80.2	Confident	73.4	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	33%	0.332	C	S	.	.			trans	-85.3	176.5	178.6	0	0	0	0	0	112.7	H29 W30 T173 S177 Y178	H29-G175 CarbonylContact O-C 3.6Å; H29-G175 WeakPolarHBondContact O-CA 3.34Å; W30-G175 PolarHBondContact O-N 3.45Å; T173-G175 PolarHBondContact O-N 3.23Å; G175-S177 VanDerWaalsContact C-N 3.3Å; G175-S177 PolarHBondContact O-N 2.63Å; G175-Y178 PolarHBondContact O-N 3.37Å
176	W	83.9	Confident	75.7	Confident	199 Å²	199	63.6 Å²	63.6	75%	0.754	34%	0.339	S	S	*	.	H	α-helix	trans	-65.3	-33.6	-174.4	-73.2	53.1	0	0	0	112.5	H29 Y178 W179 I180	H29-W176 PolarHBondContact O-N 3.25Å; W176-Y178 VanDerWaalsContact C-N 3.27Å; W176-Y178 PolarHBondContact O-N 3.19Å; W176-W179 PolarHBondContact O-N 3.48Å; W176-I180 VanDerWaalsContact O-CG1 3.3Å; W176-I180 WeakPolarHBondContact O-CG1 3.5Å; W176-I180 PolarHBondContact O-N 3.06Å
177	S	86.6	Confident	78.1	Confident	2 Å²	2	59.5 Å²	59.5	1%	0.014	31%	0.311	C	S	.	.	H	α-helix	trans	-62.7	-35.2	179.2	-54.8	0	0	0	0	112.3	S24 T27 H29 W30 G175 I180 A181	S24-S177 WeakPolarHBondContact CB-O 3.24Å; T27-S177 WeakPolarHBondContact CB-OG 3.21Å; T27-S177 WeakPolarHBondContact OG1-CB 3.23Å; T27-S177 PolarHBondContact OG1-OG 3.21Å; H29-S177 VanDerWaalsContact C-CB 3.45Å; H29-S177 VanDerWaalsContact C-OG 3.27Å; H29-S177 WeakPolarHBondContact CA-OG 3.3Å; H29-S177 VanDerWaalsContact CB-OG 3.28Å; H29-S177 WeakPolarHBondContact CB-OG 3.45Å; H29-S177 PolarHBondContact N-OG 2.94Å; H29-S177 VanDerWaalsContact O-CB 3.23Å; H29-S177 WeakPolarHBondContact O-CB 3.33Å; H29-S177 PolarHBondContact O-N 3.38Å; H29-S177 PolarHBondContact O-OG 2.87Å; W30-S177 VanDerWaalsContact CD1-CB 3.44Å; G175-S177 VanDerWaalsContact C-N 3.3Å; G175-S177 PolarHBondContact O-N 2.63Å; S177-I180 PolarHBondContact O-N 2.95Å; S177-A181 PolarHBondContact O-N 3.26Å
178	Y	87.9	Confident	80.2	Confident	27 Å²	27	52.4 Å²	52.4	11%	0.106	27%	0.274	C	S	.	.	H	α-helix	trans	-62.9	-47	176.3	173.6	-93.5	0	0	0	110.8	W30 V147 Y150 A151 F174 G175 W176 I180 A181 V182	W30-Y178 HydrophobicContact CE3-CD2 4.19Å; W30-Y178 HydrophobicContact CZ3-CD2 4.3Å; W30-Y178 WeakPolarHBondContact O-CB 3.18Å; V147-Y178 HydrophobicContact CB-CE2 4.47Å; V147-Y178 HydrophobicContact CG1-CD2 4.29Å; V147-Y178 HydrophobicContact CG1-CE2 3.47Å; V147-Y178 VanDerWaalsContact CG1-CE2 3.47Å; Y150-Y178 AromaticContact CD1-CD2 3.86Å; Y150-Y178 HydrophobicContact CD1-CD2 3.86Å; Y150-Y178 HydrophobicContact CD1-CE2 4.19Å; Y150-Y178 HydrophobicContact CE1-CD2 4.44Å; A151-Y178 HydrophobicContact CB-CE2 4.07Å; A151-Y178 WeakPolarHBondContact CB-OH 3.35Å; F174-Y178 HydrophobicContact CB-CD1 3.89Å; F174-Y178 HydrophobicContact CB-CG 4.29Å; F174-Y178 AromaticContact CD1-CD1 3.9Å; F174-Y178 HydrophobicContact CD1-CD1 3.9Å; F174-Y178 HydrophobicContact CD1-CD2 4.02Å; F174-Y178 HydrophobicContact CD1-CE1 4.15Å; F174-Y178 HydrophobicContact CD1-CE2 4.24Å; F174-Y178 AromaticContact CD1-CG 3.85Å; F174-Y178 HydrophobicContact CD1-CG 3.85Å; F174-Y178 HydrophobicContact CE1-CD2 4.41Å; F174-Y178 HydrophobicContact CE1-CE2 4.25Å; F174-Y178 AromaticContact CG-CD1 3.96Å; F174-Y178 HydrophobicContact CG-CD1 3.96Å; F174-Y178 HydrophobicContact CG-CE1 4.21Å; F174-Y178 HydrophobicContact CG-CG 4.32Å; G175-Y178 PolarHBondContact O-N 3.37Å; W176-Y178 VanDerWaalsContact C-N 3.27Å; W176-Y178 PolarHBondContact O-N 3.19Å; Y178-I180 VanDerWaalsContact C-N 3.33Å; Y178-I180 PolarHBondContact O-N 2.88Å; Y178-A181 WeakPolarHBondContact O-CB 3.47Å; Y178-A181 PolarHBondContact O-N 3.01Å; Y178-A181 VanDerWaalsContact O-N 3.16Å; Y178-V182 HydrophobicContact CD1-CG2 4.08Å; Y178-V182 HydrophobicContact CE1-CG2 3.69Å; Y178-V182 HydrophobicContact CE2-CG2 4.49Å; Y178-V182 WeakPolarHBondContact O-CG2 3.3Å; Y178-V182 PolarHBondContact O-N 3.07Å
179	W	89.7	Confident	82.2	Confident	157 Å²	157	53.3 Å²	53.3	60%	0.595	28%	0.275	S	S	*	.	H	α-helix	trans	-66.6	-34.6	177.4	-66.7	109.8	0	0	0	113	W176 A181 V182 A183	W176-W179 PolarHBondContact O-N 3.48Å; W179-A181 VanDerWaalsContact C-N 3.34Å; W179-V182 HydrophobicContact CE3-CG2 4.43Å; W179-V182 PolarHBondContact O-N 2.78Å; W179-A183 WeakPolarHBondContact O-CB 3.19Å; W179-A183 PolarHBondContact O-N 3.47Å
180	I	90.9	Very high	84.3	Confident	47 Å²	47	49.8 Å²	49.8	24%	0.241	26%	0.261	C	S	.	.	H	α-helix	trans	-62.9	-42.2	171.8	-70.6	169.5	0	0	0	110.5	L20 W176 S177 Y178 A183 G184	L20-I180 HydrophobicContact CB-CG2 3.96Å; L20-I180 HydrophobicContact CD2-CG2 3.85Å; L20-I180 VanDerWaalsContact O-CG2 3.27Å; L20-I180 WeakPolarHBondContact O-CG2 3.34Å; W176-I180 VanDerWaalsContact O-CG1 3.3Å; W176-I180 WeakPolarHBondContact O-CG1 3.5Å; W176-I180 PolarHBondContact O-N 3.06Å; S177-I180 PolarHBondContact O-N 2.95Å; Y178-I180 VanDerWaalsContact C-N 3.33Å; Y178-I180 PolarHBondContact O-N 2.88Å; I180-A183 PolarHBondContact O-N 3.27Å; I180-G184 PolarHBondContact O-N 2.88Å
181	A	89.2	Confident	85.9	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-63.6	-42.6	175.7	0	0	0	0	0	111.8	W30 M107 V147 S177 Y178 W179 G184 G185	W30-A181 HydrophobicContact CH2-CB 3.71Å; W30-A181 HydrophobicContact CZ2-CB 4.05Å; W30-A181 HydrophobicContact CZ3-CB 4.35Å; M107-A181 HydrophobicContact CE-CB 3.84Å; V147-A181 HydrophobicContact CG2-CB 3.71Å; S177-A181 PolarHBondContact O-N 3.26Å; Y178-A181 WeakPolarHBondContact O-CB 3.47Å; Y178-A181 PolarHBondContact O-N 3.01Å; Y178-A181 VanDerWaalsContact O-N 3.16Å; W179-A181 VanDerWaalsContact C-N 3.34Å; A181-G184 PolarHBondContact O-N 2.89Å; A181-G185 PolarHBondContact O-N 2.7Å
182	V	91.3	Very high	87.1	Confident	43 Å²	43	44.8 Å²	44.8	26%	0.261	23%	0.225	S	C	.	.	H	α-helix	trans	-60.5	-49.2	175.4	-178.4	0	0	0	0	110.3	V147 Y178 W179 G184 G185 C186	V147-V182 HydrophobicContact CG1-CG2 3.51Å; Y178-V182 HydrophobicContact CD1-CG2 4.08Å; Y178-V182 HydrophobicContact CE1-CG2 3.69Å; Y178-V182 HydrophobicContact CE2-CG2 4.49Å; Y178-V182 WeakPolarHBondContact O-CG2 3.3Å; Y178-V182 PolarHBondContact O-N 3.07Å; W179-V182 HydrophobicContact CE3-CG2 4.43Å; W179-V182 PolarHBondContact O-N 2.78Å; V182-G184 VanDerWaalsContact C-N 3.31Å; V182-G184 PolarHBondContact O-N 3.47Å; V182-G185 PolarHBondContact O-N 2.98Å; V182-C186 PolarHBondContact O-N 2.83Å; V182-C186 PolarHBondContact O-SG 3.29Å; V182-C186 VanDerWaalsContact O-SG 3.38Å
183	A	92.5	Very high	88.1	Confident	43 Å²	43	47.1 Å²	47.1	36%	0.355	24%	0.236	S	C	.	.	H	α-helix	trans	-59.6	-43.2	177	0	0	0	0	0	111.4	L20 W179 I180 C186 C187	L20-A183 HydrophobicContact CD1-CB 4.21Å; W179-A183 WeakPolarHBondContact O-CB 3.19Å; W179-A183 PolarHBondContact O-N 3.47Å; I180-A183 PolarHBondContact O-N 3.27Å; A183-C186 PolarHBondContact O-N 3.47Å; A183-C187 PolarHBondContact O-N 3.36Å; A183-C187 PolarHBondContact O-SG 2.85Å
184	G	89.7	Confident	88.6	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-59.6	-47.4	175.9	0	0	0	0	0	113	I180 A181 V182 C187 Q188	I180-G184 PolarHBondContact O-N 2.88Å; A181-G184 PolarHBondContact O-N 2.89Å; V182-G184 VanDerWaalsContact C-N 3.31Å; V182-G184 PolarHBondContact O-N 3.47Å; G184-C187 PolarHBondContact O-N 2.75Å; G184-Q188 WeakPolarHBondContact O-CG 3.35Å; G184-Q188 PolarHBondContact O-N 2.79Å
185	G	89.7	Confident	88.8	Confident	3 Å²	3	42.9 Å²	42.9	3%	0.031	21%	0.214	C	C	.	.	H	α-helix	trans	-61.7	-42.5	175.9	0	0	0	0	0	112.7	A181 V182 C187 Q188 M189	A181-G185 PolarHBondContact O-N 2.7Å; V182-G185 PolarHBondContact O-N 2.98Å; G185-C187 PolarHBondContact O-N 2.81Å; G185-Q188 PolarHBondContact O-N 2.05Å; G185-M189 WeakPolarHBondContact O-CB 3.1Å; G185-M189 PolarHBondContact O-N 2.66Å
186	C	92.3	Very high	88.9	Confident	61 Å²	61	44.3 Å²	44.3	41%	0.412	23%	0.229	S	C	.	.	H	α-helix	trans	-61.1	-44	173.9	-73.4	0	0	0	0	112	V182 A183 M189 L190	V182-C186 PolarHBondContact O-N 2.83Å; V182-C186 PolarHBondContact O-SG 3.29Å; V182-C186 VanDerWaalsContact O-SG 3.38Å; A183-C186 PolarHBondContact O-N 3.47Å; C186-M189 PolarHBondContact O-N 3.35Å; C186-L190 WeakPolarHBondContact O-CB 3.42Å; C186-L190 WeakPolarHBondContact O-CG 3.49Å; C186-L190 PolarHBondContact O-N 2.84Å
187	C	91.5	Very high	88.8	Confident	26 Å²	26	39 Å²	39	18%	0.176	22%	0.215	C	C	.	.	H	α-helix	trans	-62.2	-43.4	176.2	-72.2	0	0	0	0	112.2	A183 G184 G185 S191	A183-C187 PolarHBondContact O-N 3.36Å; A183-C187 PolarHBondContact O-SG 2.85Å; G184-C187 PolarHBondContact O-N 2.75Å; G185-C187 PolarHBondContact O-N 2.81Å; C187-S191 VanDerWaalsContact O-CB 3.27Å; C187-S191 WeakPolarHBondContact O-CB 3.42Å; C187-S191 PolarHBondContact O-N 2.78Å
188	Q	90.4	Very high	88.4	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-63.3	-42.3	175.7	-71.9	174.4	-18.7	0	0	111.7	L14 S110 S114 A140 T143 G184 G185 S191 S192	L14-Q188 HydrophobicContact CD1-CG 4.34Å; S110-Q188 PolarHBondContact OG-OE1 2.98Å; S114-Q188 PolarHBondContact OG-NE2 3.32Å; A140-Q188 HydrophobicContact CB-CB 3.86Å; T143-Q188 PolarHBondContact OG1-OE1 2.87Å; G184-Q188 WeakPolarHBondContact O-CG 3.35Å; G184-Q188 PolarHBondContact O-N 2.79Å; G185-Q188 PolarHBondContact O-N 2.05Å; Q188-S191 WeakPolarHBondContact O-CB 3.22Å; Q188-S191 PolarHBondContact O-N 3.1Å; Q188-S192 PolarHBondContact O-N 3.2Å
189	M	91.2	Very high	87.6	Confident	87 Å²	87	40.7 Å²	40.7	43%	0.429	22%	0.222	S	C	.	.	H	α-helix	trans	-64.5	-48.1	178.2	-167	168	74.3	0	0	111.4	A140 G185 C186 S191 S192 I193	A140-M189 HydrophobicContact CB-CB 4.22Å; G185-M189 WeakPolarHBondContact O-CB 3.1Å; G185-M189 PolarHBondContact O-N 2.66Å; C186-M189 PolarHBondContact O-N 3.35Å; M189-S191 VanDerWaalsContact C-N 3.3Å; M189-S191 PolarHBondContact O-N 2.86Å; M189-S192 PolarHBondContact O-N 3.45Å; M189-S192 VanDerWaalsContact O-N 3.16Å; M189-S192 PolarHBondContact O-OG 2.71Å; M189-I193 HydrophobicContact CG-CD1 4.22Å; M189-I193 WeakPolarHBondContact O-CG1 3.39Å; M189-I193 PolarHBondContact O-N 2.87Å
190	L	92	Very high	86.6	Confident	98 Å²	98	36.5 Å²	36.5	51%	0.513	22%	0.221	S	C	.	.	H	α-helix	trans	-61.5	-38.8	175.6	-71.1	174.4	0	0	0	112.2	L13 C186 I193 G194	L13-L190 HydrophobicContact CD1-CB 4.26Å; C186-L190 WeakPolarHBondContact O-CB 3.42Å; C186-L190 WeakPolarHBondContact O-CG 3.49Å; C186-L190 PolarHBondContact O-N 2.84Å; L190-I193 PolarHBondContact O-N 2.86Å; L190-G194 PolarHBondContact O-N 3.45Å
191	S	88.9	Confident	85.1	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-60.8	-47.2	172.9	178.6	0	0	0	0	111.7	S10 L14 C187 Q188 M189 I193 G194 L195	S10-S191 VanDerWaalsContact O-CB 3.29Å; S10-S191 WeakPolarHBondContact O-CB 3.29Å; S10-S191 PolarHBondContact O-OG 2.88Å; L14-S191 WeakPolarHBondContact CB-OG 3.09Å; C187-S191 VanDerWaalsContact O-CB 3.27Å; C187-S191 WeakPolarHBondContact O-CB 3.42Å; C187-S191 PolarHBondContact O-N 2.78Å; Q188-S191 WeakPolarHBondContact O-CB 3.22Å; Q188-S191 PolarHBondContact O-N 3.1Å; M189-S191 VanDerWaalsContact C-N 3.3Å; M189-S191 PolarHBondContact O-N 2.86Å; S191-I193 VanDerWaalsContact C-N 3.3Å; S191-I193 PolarHBondContact O-N 3.1Å; S191-G194 PolarHBondContact O-N 3.03Å; S191-L195 WeakPolarHBondContact O-CB 3.42Å; S191-L195 WeakPolarHBondContact O-CG 3.46Å; S191-L195 PolarHBondContact O-N 3.41Å
192	S	87.7	Confident	83.7	Confident	7 Å²	7	46 Å²	46	5%	0.049	26%	0.258	C	S	.	.	H	α-helix	trans	-59.1	-41.7	178.5	78.5	0	0	0	0	112	Q188 M189 G196	Q188-S192 PolarHBondContact O-N 3.2Å; M189-S192 PolarHBondContact O-N 3.45Å; M189-S192 VanDerWaalsContact O-N 3.16Å; M189-S192 PolarHBondContact O-OG 2.71Å; S192-G196 PolarHBondContact O-N 3.4Å
193	I	88.5	Confident	82	Confident	82 Å²	82	47.3 Å²	47.3	42%	0.421	27%	0.269	S	S	.	.	H	α-helix	trans	-66.8	-46.9	177.5	-65.8	165.6	0	0	0	110.1	M189 L190 S191 L195 G196 I197	M189-I193 HydrophobicContact CG-CD1 4.22Å; M189-I193 WeakPolarHBondContact O-CG1 3.39Å; M189-I193 PolarHBondContact O-N 2.87Å; L190-I193 PolarHBondContact O-N 2.86Å; S191-I193 VanDerWaalsContact C-N 3.3Å; S191-I193 PolarHBondContact O-N 3.1Å; I193-L195 PolarHBondContact O-N 2.93Å; I193-G196 PolarHBondContact O-N 3.06Å; I193-G196 VanDerWaalsContact O-N 3.14Å; I193-I197 HydrophobicContact CG2-CD1 3.71Å; I193-I197 HydrophobicContact CG2-CG1 4.32Å; I193-I197 WeakPolarHBondContact O-CG1 3.48Å; I193-I197 PolarHBondContact O-N 2.97Å
194	G	85.6	Confident	80	Confident	10 Å²	10	48.2 Å²	48.2	10%	0.103	28%	0.276	C	S	.	.	H	α-helix	trans	-61.5	-42.5	179.2	0	0	0	0	0	113.1	S10 L190 S191 S198	S10-G194 VanDerWaalsContact OG-C 3.3Å; S10-G194 WeakPolarHBondContact OG-CA 2.93Å; L190-G194 PolarHBondContact O-N 3.45Å; S191-G194 PolarHBondContact O-N 3.03Å; G194-S198 WeakPolarHBondContact O-CB 3.36Å; G194-S198 PolarHBondContact O-N 3.02Å; G194-S198 PolarHBondContact O-OG 3.3Å
195	L	84.4	Confident	78.1	Confident	8 Å²	8	56.2 Å²	56.2	4%	0.042	31%	0.307	C	S	.	.	H	α-helix	trans	-65.3	-39.2	172.6	-67.3	174.4	0	0	0	111.8	Q7 S10 L132 T133 S191 I193 R199	Q7-L195 HydrophobicContact CG-CD2 4.22Å; S10-L195 PolarHBondContact OG-N 2.86Å; L132-L195 HydrophobicContact CD2-CD1 3.92Å; T133-L195 HydrophobicContact CG2-CB 3.31Å; T133-L195 HydrophobicContact CG2-CD1 4.41Å; T133-L195 HydrophobicContact CG2-CG 4.49Å; S191-L195 WeakPolarHBondContact O-CB 3.42Å; S191-L195 WeakPolarHBondContact O-CG 3.46Å; S191-L195 PolarHBondContact O-N 3.41Å; I193-L195 PolarHBondContact O-N 2.93Å; L195-R199 WeakPolarHBondContact O-CG 3.47Å; L195-R199 PolarHBondContact O-N 3.23Å
196	G	83.1	Confident	76.2	Confident	30 Å²	30	59.9 Å²	59.9	31%	0.309	33%	0.333	S	S	.	.	H	α-helix	trans	-62.4	-48.8	176.1	0	0	0	0	0	112.9	S192 I193 S198 R199 A200	S192-G196 PolarHBondContact O-N 3.4Å; I193-G196 PolarHBondContact O-N 3.06Å; I193-G196 VanDerWaalsContact O-N 3.14Å; G196-S198 VanDerWaalsContact C-N 3.34Å; G196-S198 PolarHBondContact O-N 3.38Å; G196-R199 PolarHBondContact O-N 3.01Å; G196-A200 PolarHBondContact O-N 3.07Å
197	I	82.4	Confident	74.2	Confident	88 Å²	88	64.7 Å²	64.7	45%	0.451	35%	0.349	S	S	.	.	H	α-helix	trans	-62.3	-43.1	178.3	-67.6	168.9	0	0	0	110.8	I193 R199 A200 R201	I193-I197 HydrophobicContact CG2-CD1 3.71Å; I193-I197 HydrophobicContact CG2-CG1 4.32Å; I193-I197 WeakPolarHBondContact O-CG1 3.48Å; I193-I197 PolarHBondContact O-N 2.97Å; I197-R199 PolarHBondContact O-N 2.84Å; I197-A200 PolarHBondContact O-N 3.15Å; I197-R201 PolarHBondContact O-N 3.26Å
198	S	77.3	Confident	71.9	Confident	8 Å²	8	69.1 Å²	69.1	6%	0.056	38%	0.375	C	S	.	.	H	α-helix	trans	-57.6	-38.9	178.9	-59.3	0	0	0	0	110.7	V6 G194 G196 H202	V6-S198 VanDerWaalsContact CG1-OG 3.28Å; V6-S198 WeakPolarHBondContact CG1-OG 3.42Å; G194-S198 WeakPolarHBondContact O-CB 3.36Å; G194-S198 PolarHBondContact O-N 3.02Å; G194-S198 PolarHBondContact O-OG 3.3Å; G196-S198 VanDerWaalsContact C-N 3.34Å; G196-S198 PolarHBondContact O-N 3.38Å; S198-H202 PolarHBondContact O-CD2 2.98Å
199	R	70.9	Confident	69.6	Low	57 Å²	57	79.6 Å²	79.6	22%	0.215	43%	0.428	C	S	.	.	H	α-helix	trans	-80.6	-40.6	-179.6	-70.6	-169.5	-178.1	124.1	2.6	115	G129 T133 L195 G196 I197 R201 H202 S203	G129-R199 PolarHBondContact O-NH1 3.35Å; G129-R199 PolarHBondContact O-NH2 2.95Å; T133-R199 PolarHBondContact OG1-NH1 3.45Å; L195-R199 WeakPolarHBondContact O-CG 3.47Å; L195-R199 PolarHBondContact O-N 3.23Å; G196-R199 PolarHBondContact O-N 3.01Å; I197-R199 PolarHBondContact O-N 2.84Å; R199-R201 PolarHBondContact O-N 3.27Å; R199-H202 PolarHBondContact O-N 3.24Å; R199-S203 PolarHBondContact O-N 3.41Å; R199-S203 VanDerWaalsContact O-N 3.1Å
200	A	68.5	Low	68.5	Low	69 Å²	69	79.2 Å²	79.2	57%	0.57	43%	0.428	S	S	*	.	H	α-helix	trans	-55.1	-36.8	177.7	0	0	0	0	0	111.1	G196 I197 S203 A204	G196-A200 PolarHBondContact O-N 3.07Å; I197-A200 PolarHBondContact O-N 3.15Å; A200-S203 PolarHBondContact O-N 2.97Å; A200-A204 PolarHBondContact O-N 3.39Å
201	R	61	Low	67.2	Low	144 Å²	144	78.2 Å²	78.2	54%	0.543	42%	0.424	S	S	.	.	H	α-helix	trans	-73.9	-33.6	176.3	-66.7	-169.5	178.1	-164.5	1.4	113.5	I197 R199 S203 A204 Y205	I197-R201 PolarHBondContact O-N 3.26Å; R199-R201 PolarHBondContact O-N 3.27Å; R201-S203 VanDerWaalsContact C-N 3.31Å; R201-S203 PolarHBondContact O-N 3.16Å; R201-A204 PolarHBondContact O-N 2.96Å; R201-Y205 WeakPolarHBondContact O-CD2 3.36Å; R201-Y205 PolarHBondContact O-N 3.13Å
202	H	59.4	Low	66	Low	102 Å²	102	82.6 Å²	82.6	47%	0.472	45%	0.448	S	S	.	.	H	α-helix	trans	-63.9	-35.6	172.6	-84.7	-69.5	0	0	0	112.7	S198 R199 A204	S198-H202 PolarHBondContact O-CD2 2.98Å; R199-H202 PolarHBondContact O-N 3.24Å; H202-A204 VanDerWaalsContact C-N 3.34Å
203	S	55.8	Low	64.8	Low	71 Å²	71	87 Å²	87	50%	0.497	47%	0.471	S	S	.	.	H	α-helix	trans	-71.5	-26.4	175.8	-164.7	0	0	0	0	113.5	R199 A200 R201 S206	R199-S203 PolarHBondContact O-N 3.41Å; R199-S203 VanDerWaalsContact O-N 3.1Å; A200-S203 PolarHBondContact O-N 2.97Å; R201-S203 VanDerWaalsContact C-N 3.31Å; R201-S203 PolarHBondContact O-N 3.16Å; S203-S206 PolarHBondContact O-OG 2.87Å
204	A	50.7	Low	63.3	Low	62 Å²	62	87.3 Å²	87.3	51%	0.512	47%	0.474	S	S	.	.	H	α-helix	trans	-72.9	-31.6	178.6	0	0	0	0	0	112.3	A200 R201 H202	A200-A204 PolarHBondContact O-N 3.39Å; R201-A204 PolarHBondContact O-N 2.96Å; H202-A204 VanDerWaalsContact C-N 3.34Å
205	Y	49.6	Very low	61.8	Low	167 Å²	167	92.5 Å²	92.5	66%	0.655	50%	0.499	S	S	*	.	H	α-helix	trans	-78.5	-20.3	177.9	-81.3	-78.6	0	0	0	113.9	R201 H207	R201-Y205 WeakPolarHBondContact O-CD2 3.36Å; R201-Y205 PolarHBondContact O-N 3.13Å; Y205-H207 VanDerWaalsContact C-N 3.25Å; Y205-H207 PolarHBondContact O-N 2.78Å
206	S	49.3	Very low	60.2	Low	81 Å²	81	98.5 Å²	98.5	57%	0.566	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-4	177.7	58.7	0	0	0	0	114.5	S203	S203-S206 PolarHBondContact O-OG 2.87Å
207	H	49.6	Very low	58.4	Low	162 Å²	162	103.8 Å²	103.8	75%	0.75	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.9	9	177.9	-86.4	-74	0	0	0	113.9	Y205	Y205-H207 VanDerWaalsContact C-N 3.25Å; Y205-H207 PolarHBondContact O-N 2.78Å
208	V	44.4	Very low	56.4	Low	119 Å²	119	105.1 Å²	105.1	72%	0.721	56%	0.557	S	S	*	*			trans	-122	25.7	-175.9	-163.3	0	0	0	0	112.6
209	I	40.5	Very low	54.5	Low	219 Å²	219	113.9 Å²	113.9	100%	1.123	60%	0.602	S	S	*	*			trans	-132.3	0	166.5	-56.4	172.7	0	0	0	107.1

Retrieved 209 of 209 residues in 113.3 ms (Link to these results)

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