A0A096MIA8_POEFO Loading...

Phospholipid phosphatase 4

AlphaFold DB , UniProt , Accession A0A096MIA8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 221 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	66.5	Low	81	Confident	70 Å²	70	61.9 Å²	61.9	35%	0.345	34%	0.341	S	S	.	.				0	-57	0	-84.6	-52.7	149.4	0	0	113.3	A3 I4 S5 H93 I139	M1-A3 PolarHBondContact O-N 3.27Å; M1-I4 PolarHBondContact O-N 2.89Å; M1-S5 PolarHBondContact O-N 3.17Å; M1-S5 PolarHBondContact O-OG 3.1Å; M1-H93 HydrophobicContact CG-CB 4.14Å; M1-H93 WeakPolarHBondContact CG-CD2 3.4Å; M1-I139 HydrophobicContact CE-CB 4.12Å; M1-I139 HydrophobicContact CE-CD1 4.13Å; M1-I139 HydrophobicContact CE-CG1 3.9Å; M1-I139 HydrophobicContact CE-CG2 3.25Å; M1-I139 HydrophobicContact SD-CD1 4.11Å; M1-I139 HydrophobicContact SD-CG1 4.47Å; M1-I139 HydrophobicContact SD-CG2 3.54Å; M1-I139 VanDerWaalsContact SD-CG2 3.54Å
2	F	68.2	Low	81.8	Confident	133 Å²	133	59.7 Å²	59.7	58%	0.583	33%	0.33	S	S	*	.	H	α-helix	trans	-52.7	-42.4	-177.6	-151.3	-90.1	0	0	0	112.7	I4 S5 F6 F96	F2-I4 PolarHBondContact O-N 3.38Å; F2-S5 PolarHBondContact O-N 3.13Å; F2-F6 VanDerWaalsContact O-CB 3.25Å; F2-F6 WeakPolarHBondContact O-CB 3.25Å; F2-F6 PolarHBondContact O-N 3Å; F2-F96 HydrophobicContact CD2-CD1 4.33Å; F2-F96 HydrophobicContact CD2-CE1 4.05Å; F2-F96 HydrophobicContact CD2-CZ 4.24Å; F2-F96 HydrophobicContact CE2-CD1 4.23Å; F2-F96 AromaticContact CE2-CE1 3.55Å; F2-F96 HydrophobicContact CE2-CE1 3.55Å; F2-F96 AromaticContact CE2-CZ 3.79Å; F2-F96 HydrophobicContact CE2-CZ 3.79Å; F2-F96 HydrophobicContact CZ-CE1 4.48Å
3	A	74.8	Confident	82.4	Confident	57 Å²	57	55.4 Å²	55.4	47%	0.471	31%	0.306	S	S	.	.	H	α-helix	trans	-59.1	-43.9	173.6	0	0	0	0	0	113.3	M1 F6 L7	M1-A3 PolarHBondContact O-N 3.27Å; A3-F6 PolarHBondContact O-N 2.89Å; A3-L7 HydrophobicContact CB-CD1 4.09Å; A3-L7 WeakPolarHBondContact O-CA 3.36Å; A3-L7 WeakPolarHBondContact O-CB 3.26Å; A3-L7 WeakPolarHBondContact O-CG 3.44Å; A3-L7 PolarHBondContact O-N 3.38Å
4	I	78.9	Confident	83	Confident	77 Å²	77	60.1 Å²	60.1	40%	0.395	32%	0.322	S	S	.	.	H	α-helix	trans	-67.8	-48.5	179.9	-60.2	171.5	0	0	0	110	M1 F2 F6 T8 I139	M1-I4 PolarHBondContact O-N 2.89Å; F2-I4 PolarHBondContact O-N 3.38Å; I4-F6 PolarHBondContact O-N 3.46Å; I4-T8 WeakPolarHBondContact O-CB 3.24Å; I4-T8 PolarHBondContact O-N 3.23Å; I4-T8 VanDerWaalsContact O-N 3.09Å; I4-T8 PolarHBondContact O-OG1 3.02Å; I4-I139 HydrophobicContact CG2-CD1 4.4Å
5	S	79	Confident	83.5	Confident	1 Å²	1	61.1 Å²	61.1	1%	0.007	33%	0.331	C	S	.	.	H	α-helix	trans	-63.6	-25.2	-179.8	-63.8	0	0	0	0	114	M1 F2 P9 F96 A97	M1-S5 PolarHBondContact O-N 3.17Å; M1-S5 PolarHBondContact O-OG 3.1Å; F2-S5 PolarHBondContact O-N 3.13Å; S5-P9 VanDerWaalsContact O-CD 3.22Å; S5-P9 WeakPolarHBondContact O-CD 3.49Å; S5-P9 WeakPolarHBondContact O-CG 3.34Å; S5-F96 VanDerWaalsContact CB-O 3.3Å; S5-F96 WeakPolarHBondContact CB-O 3.44Å; S5-F96 PolarHBondContact OG-O 2.99Å; S5-A97 PolarHBondContact OG-N 3.32Å
6	F	81.1	Confident	83.8	Confident	79 Å²	79	58.1 Å²	58.1	35%	0.346	32%	0.315	S	S	.	.	H	α-helix	trans	-97.2	-46.4	179.6	-173.6	-98	0	0	0	112.9	F2 A3 I4 P9 L10 L38	F2-F6 VanDerWaalsContact O-CB 3.25Å; F2-F6 WeakPolarHBondContact O-CB 3.25Å; F2-F6 PolarHBondContact O-N 3Å; A3-F6 PolarHBondContact O-N 2.89Å; I4-F6 PolarHBondContact O-N 3.46Å; F6-P9 WeakPolarHBondContact O-CD 3.24Å; F6-L10 HydrophobicContact CD1-CD1 3.74Å; F6-L10 HydrophobicContact CE1-CD1 3.3Å; F6-L10 HydrophobicContact CE2-CD1 4.4Å; F6-L10 HydrophobicContact CG-CD1 4.46Å; F6-L10 HydrophobicContact CZ-CD1 3.68Å; F6-L10 WeakPolarHBondContact O-CG 3.32Å; F6-L38 HydrophobicContact CB-CD1 4.37Å; F6-L38 HydrophobicContact CD2-CD1 3.78Å
7	L	87.1	Confident	84	Confident	104 Å²	104	59 Å²	59	55%	0.545	32%	0.316	S	S	.	.	H	α-helix	trans	-73.8	-36.8	-175.8	-62.5	172.6	0	0	0	112.1	A3 L10 A11	A3-L7 HydrophobicContact CB-CD1 4.09Å; A3-L7 WeakPolarHBondContact O-CA 3.36Å; A3-L7 WeakPolarHBondContact O-CB 3.26Å; A3-L7 WeakPolarHBondContact O-CG 3.44Å; A3-L7 PolarHBondContact O-N 3.38Å; L7-L10 PolarHBondContact O-N 3.35Å; L7-A11 WeakPolarHBondContact O-CB 3.4Å; L7-A11 PolarHBondContact O-N 2.98Å
8	T	88.1	Confident	84.3	Confident	52 Å²	52	61.7 Å²	61.7	32%	0.319	33%	0.329	S	S	.	.	H	α-helix	trans	-63.5	-48.7	-177.9	-59.3	0	0	0	0	112.4	I4 L10 A11 V12 L101	I4-T8 WeakPolarHBondContact O-CB 3.24Å; I4-T8 PolarHBondContact O-N 3.23Å; I4-T8 VanDerWaalsContact O-N 3.09Å; I4-T8 PolarHBondContact O-OG1 3.02Å; T8-L10 VanDerWaalsContact C-N 3.34Å; T8-L10 PolarHBondContact O-N 3.1Å; T8-A11 PolarHBondContact O-N 3.19Å; T8-V12 WeakPolarHBondContact O-CG2 3.43Å; T8-V12 PolarHBondContact O-N 3.05Å; T8-L101 HydrophobicContact CG2-CD2 3.56Å
9	P	87.4	Confident	84.6	Confident	1 Å²	1	65.2 Å²	65.2	1%	0.006	35%	0.346	C	S	.	.	H	α-helix	trans	-59	-43	174.6	-23.3	32.4	0	0	0	113.1	S5 F6 A11 V12 I13 V34 G100 T104	S5-P9 VanDerWaalsContact O-CD 3.22Å; S5-P9 WeakPolarHBondContact O-CD 3.49Å; S5-P9 WeakPolarHBondContact O-CG 3.34Å; F6-P9 WeakPolarHBondContact O-CD 3.24Å; P9-A11 PolarHBondContact O-N 3.1Å; P9-V12 PolarHBondContact O-N 3.18Å; P9-I13 WeakPolarHBondContact O-CB 3.32Å; P9-I13 WeakPolarHBondContact O-CD1 3.14Å; P9-I13 VanDerWaalsContact O-CG1 3.22Å; P9-I13 WeakPolarHBondContact O-CG1 3.49Å; P9-I13 PolarHBondContact O-N 3.02Å; P9-V34 HydrophobicContact CB-CG2 3.73Å; P9-V34 HydrophobicContact CG-CG2 4.02Å; P9-G100 WeakPolarHBondContact CG-O 3.39Å; P9-T104 WeakPolarHBondContact CA-OG1 3.41Å; P9-T104 WeakPolarHBondContact CB-OG1 3.49Å; P9-T104 WeakPolarHBondContact CG-OG1 3.46Å
10	L	89.8	Confident	84.7	Confident	51 Å²	51	66 Å²	66	27%	0.267	35%	0.347	S	S	.	.	H	α-helix	trans	-63.4	-42.2	179.2	-68.1	179.1	0	0	0	112.2	F6 L7 T8 I13 F14 V34	F6-L10 HydrophobicContact CD1-CD1 3.74Å; F6-L10 HydrophobicContact CE1-CD1 3.3Å; F6-L10 HydrophobicContact CE2-CD1 4.4Å; F6-L10 HydrophobicContact CG-CD1 4.46Å; F6-L10 HydrophobicContact CZ-CD1 3.68Å; F6-L10 WeakPolarHBondContact O-CG 3.32Å; L7-L10 PolarHBondContact O-N 3.35Å; T8-L10 VanDerWaalsContact C-N 3.34Å; T8-L10 PolarHBondContact O-N 3.1Å; L10-I13 PolarHBondContact O-N 3.44Å; L10-F14 WeakPolarHBondContact O-CB 3.46Å; L10-F14 PolarHBondContact O-N 3.12Å; L10-V34 HydrophobicContact CD2-CG1 4.49Å
11	A	90.6	Very high	84.7	Confident	56 Å²	56	73.5 Å²	73.5	46%	0.463	37%	0.371	S	S	.	.	H	α-helix	trans	-60.8	-45.1	175	0	0	0	0	0	111.1	L7 T8 P9 F14 V15	L7-A11 WeakPolarHBondContact O-CB 3.4Å; L7-A11 PolarHBondContact O-N 2.98Å; T8-A11 PolarHBondContact O-N 3.19Å; P9-A11 PolarHBondContact O-N 3.1Å; A11-F14 PolarHBondContact O-N 3.28Å; A11-V15 VanDerWaalsContact O-CG2 3.31Å; A11-V15 WeakPolarHBondContact O-CG2 3.45Å; A11-V15 PolarHBondContact O-N 2.95Å
12	V	90.7	Very high	85.5	Confident	35 Å²	35	71 Å²	71	21%	0.212	36%	0.36	C	S	.	.	H	α-helix	trans	-64.6	-43.8	177.8	173.3	0	0	0	0	111.6	T8 P9 F14 V15 V16 T104 L108	T8-V12 WeakPolarHBondContact O-CG2 3.43Å; T8-V12 PolarHBondContact O-N 3.05Å; P9-V12 PolarHBondContact O-N 3.18Å; V12-F14 VanDerWaalsContact C-N 3.27Å; V12-F14 PolarHBondContact O-N 3.2Å; V12-V15 PolarHBondContact O-N 3.4Å; V12-V16 HydrophobicContact CG1-CG2 4.32Å; V12-V16 WeakPolarHBondContact O-CB 3.4Å; V12-V16 WeakPolarHBondContact O-CG2 3.33Å; V12-V16 PolarHBondContact O-N 3.09Å; V12-T104 HydrophobicContact CB-CG2 3.91Å; V12-T104 HydrophobicContact CG1-CG2 3.8Å; V12-T104 HydrophobicContact CG2-CG2 3.84Å; V12-L108 HydrophobicContact CG1-CD1 4.26Å; V12-L108 HydrophobicContact CG1-CD2 3.83Å; V12-L108 HydrophobicContact CG1-CG 4.11Å
13	I	89.6	Confident	86.3	Confident	4 Å²	4	70.2 Å²	70.2	2%	0.021	36%	0.362	C	S	.	.	H	α-helix	trans	-58.4	-42.6	175.7	-69.1	162.3	0	0	0	110.3	P9 L10 V16 K17 I27 A30 V34 Y107	P9-I13 WeakPolarHBondContact O-CB 3.32Å; P9-I13 WeakPolarHBondContact O-CD1 3.14Å; P9-I13 VanDerWaalsContact O-CG1 3.22Å; P9-I13 WeakPolarHBondContact O-CG1 3.49Å; P9-I13 PolarHBondContact O-N 3.02Å; L10-I13 PolarHBondContact O-N 3.44Å; I13-V16 PolarHBondContact O-N 3.38Å; I13-K17 WeakPolarHBondContact O-CB 3.39Å; I13-K17 PolarHBondContact O-N 3.3Å; I13-I27 HydrophobicContact CG2-CG2 4.28Å; I13-A30 HydrophobicContact CD1-CB 3.83Å; I13-A30 HydrophobicContact CG1-CB 4.07Å; I13-A30 HydrophobicContact CG2-CB 4.03Å; I13-V34 HydrophobicContact CD1-CG1 4.37Å; I13-Y107 HydrophobicContact CG1-CD1 4.37Å; I13-Y107 HydrophobicContact CG1-CE1 4.01Å
14	F	89.9	Confident	87	Confident	121 Å²	121	76 Å²	76	53%	0.531	38%	0.376	S	S	.	.	H	α-helix	trans	-69	-38.9	178.8	-165.5	-102.9	0	0	0	112.8	L10 A11 V12 K17 I18	L10-F14 WeakPolarHBondContact O-CB 3.46Å; L10-F14 PolarHBondContact O-N 3.12Å; A11-F14 PolarHBondContact O-N 3.28Å; V12-F14 VanDerWaalsContact C-N 3.27Å; V12-F14 PolarHBondContact O-N 3.2Å; F14-K17 HydrophobicContact CD2-CD 4.22Å; F14-K17 HydrophobicContact CE2-CD 4.27Å; F14-K17 WeakPolarHBondContact O-CB 3.46Å; F14-K17 PolarHBondContact O-N 3.05Å; F14-I18 HydrophobicContact CD1-CD1 3.65Å; F14-I18 HydrophobicContact CD1-CG1 4.41Å; F14-I18 HydrophobicContact CE1-CD1 3.46Å; F14-I18 VanDerWaalsContact CE1-CD1 3.46Å; F14-I18 HydrophobicContact CE1-CG1 4.25Å; F14-I18 HydrophobicContact CZ-CD1 4.3Å; F14-I18 WeakPolarHBondContact O-CG1 3.43Å; F14-I18 PolarHBondContact O-N 3.14Å
15	V	90.6	Very high	87.5	Confident	76 Å²	76	75.1 Å²	75.1	46%	0.461	38%	0.375	S	S	.	.	H	α-helix	trans	-63.5	-45.7	173.5	169	0	0	0	0	110.9	A11 V12 K17 I18 I19	A11-V15 VanDerWaalsContact O-CG2 3.31Å; A11-V15 WeakPolarHBondContact O-CG2 3.45Å; A11-V15 PolarHBondContact O-N 2.95Å; V12-V15 PolarHBondContact O-N 3.4Å; V15-K17 VanDerWaalsContact C-N 3.29Å; V15-K17 PolarHBondContact O-N 3.1Å; V15-I18 PolarHBondContact O-N 2.88Å; V15-I18 VanDerWaalsContact O-N 3.12Å; V15-I19 HydrophobicContact CG1-CD1 3.61Å; V15-I19 HydrophobicContact CG1-CG1 4.35Å; V15-I19 WeakPolarHBondContact O-CG1 3.42Å; V15-I19 PolarHBondContact O-N 2.83Å
16	V	88.4	Confident	88.1	Confident	12 Å²	12	75.7 Å²	75.7	7%	0.073	38%	0.377	C	S	.	.	H	α-helix	trans	-60.4	-41.5	175.8	169.7	0	0	0	0	110.7	V12 I13 I18 I19 Q20 T22 Y107 L108 K111	V12-V16 HydrophobicContact CG1-CG2 4.32Å; V12-V16 WeakPolarHBondContact O-CB 3.4Å; V12-V16 WeakPolarHBondContact O-CG2 3.33Å; V12-V16 PolarHBondContact O-N 3.09Å; I13-V16 PolarHBondContact O-N 3.38Å; V16-I18 VanDerWaalsContact C-N 3.34Å; V16-I18 PolarHBondContact O-N 3.01Å; V16-I19 PolarHBondContact O-N 3.39Å; V16-Q20 HydrophobicContact CG1-CG 4.26Å; V16-Q20 WeakPolarHBondContact O-CB 3.12Å; V16-Q20 PolarHBondContact O-N 3.39Å; V16-T22 HydrophobicContact CG1-CG2 4.49Å; V16-Y107 HydrophobicContact CB-CE1 4.14Å; V16-Y107 HydrophobicContact CG1-CE1 4.16Å; V16-Y107 HydrophobicContact CG2-CE1 4.03Å; V16-L108 HydrophobicContact CG2-CD2 4.07Å; V16-K111 HydrophobicContact CG1-CD 4.38Å; V16-K111 HydrophobicContact CG1-CG 4.19Å
17	K	87.3	Confident	88.5	Confident	74 Å²	74	73.4 Å²	73.4	32%	0.322	37%	0.368	S	S	.	.	H	α-helix	trans	-55.1	-48.9	172.4	171.6	-165.2	-169	167.7	0	112.1	I13 F14 V15 R21 T22 I27	I13-K17 WeakPolarHBondContact O-CB 3.39Å; I13-K17 PolarHBondContact O-N 3.3Å; F14-K17 HydrophobicContact CD2-CD 4.22Å; F14-K17 HydrophobicContact CE2-CD 4.27Å; F14-K17 WeakPolarHBondContact O-CB 3.46Å; F14-K17 PolarHBondContact O-N 3.05Å; V15-K17 VanDerWaalsContact C-N 3.29Å; V15-K17 PolarHBondContact O-N 3.1Å; K17-R21 WeakPolarHBondContact O-CA 3.38Å; K17-R21 PolarHBondContact O-N 2.96Å; K17-T22 WeakPolarHBondContact CA-OG1 3.3Å; K17-T22 PolarHBondContact O-N 3.41Å; K17-I27 HydrophobicContact CB-CD1 4.21Å; K17-I27 HydrophobicContact CB-CG1 4.25Å; K17-I27 HydrophobicContact CD-CD1 3.29Å; K17-I27 HydrophobicContact CD-CG1 4.12Å; K17-I27 HydrophobicContact CG-CD1 3.66Å; K17-I27 HydrophobicContact CG-CG1 4.24Å
18	I	88.8	Confident	88.8	Confident	108 Å²	108	74 Å²	74	55%	0.554	37%	0.366	S	S	*	.	H	α-helix	trans	-63.8	-45.5	-178	-69.4	166.3	0	0	0	110.5	F14 V15 V16	F14-I18 HydrophobicContact CD1-CD1 3.65Å; F14-I18 HydrophobicContact CD1-CG1 4.41Å; F14-I18 HydrophobicContact CE1-CD1 3.46Å; F14-I18 VanDerWaalsContact CE1-CD1 3.46Å; F14-I18 HydrophobicContact CE1-CG1 4.25Å; F14-I18 HydrophobicContact CZ-CD1 4.3Å; F14-I18 WeakPolarHBondContact O-CG1 3.43Å; F14-I18 PolarHBondContact O-N 3.14Å; V15-I18 PolarHBondContact O-N 2.88Å; V15-I18 VanDerWaalsContact O-N 3.12Å; V16-I18 VanDerWaalsContact C-N 3.34Å; V16-I18 PolarHBondContact O-N 3.01Å
19	I	90.1	Very high	89.1	Confident	128 Å²	128	72.7 Å²	72.7	66%	0.656	36%	0.357	S	S	*	.	H	α-helix	trans	-72	-47.8	-175.4	-65.3	172.8	0	0	0	111.6	V15 V16	V15-I19 HydrophobicContact CG1-CD1 3.61Å; V15-I19 HydrophobicContact CG1-CG1 4.35Å; V15-I19 WeakPolarHBondContact O-CG1 3.42Å; V15-I19 PolarHBondContact O-N 2.83Å; V16-I19 PolarHBondContact O-N 3.39Å
20	Q	86.3	Confident	89.5	Confident	80 Å²	80	72.7 Å²	72.7	37%	0.374	36%	0.357	S	S	.	.	H	α-helix	trans	-92.7	-2.4	-174.7	-62.2	-172.9	-1.6	0	0	113.3	V16 T22 K111	V16-Q20 HydrophobicContact CG1-CG 4.26Å; V16-Q20 WeakPolarHBondContact O-CB 3.12Å; V16-Q20 PolarHBondContact O-N 3.39Å; Q20-T22 HydrophobicContact CB-CG2 3.81Å; Q20-T22 PolarHBondContact O-N 3.39Å; Q20-K111 PolarHBondContact NE2-O 3.38Å
21	R	86.1	Confident	89.7	Confident	225 Å²	225	72.1 Å²	72.1	85%	0.849	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.1	44	-176.6	-63.3	-170.5	176.1	172.5	-0.2	113.1	K17	K17-R21 WeakPolarHBondContact O-CA 3.38Å; K17-R21 PolarHBondContact O-N 2.96Å
22	T	83.2	Confident	89.9	Confident	17 Å²	17	73.6 Å²	73.6	10%	0.104	36%	0.356	C	S	.	.			trans	-67.1	148.2	-177	61.5	0	0	0	0	112.8	V16 K17 Q20 E26	V16-T22 HydrophobicContact CG1-CG2 4.49Å; K17-T22 WeakPolarHBondContact CA-OG1 3.3Å; K17-T22 PolarHBondContact O-N 3.41Å; Q20-T22 HydrophobicContact CB-CG2 3.81Å; Q20-T22 PolarHBondContact O-N 3.39Å; T22-E26 WeakPolarHBondContact CB-OE2 3.25Å; T22-E26 WeakPolarHBondContact CG2-OE2 3.47Å
23	D	85.3	Confident	90.1	Very high	117 Å²	117	72 Å²	72	63%	0.626	35%	0.346	S	S	*	.			trans	-66.8	161.4	178.7	-69.3	-39.9	0	0	0	114.3	T25 E26 I27	D23-T25 PolarHBondContact O-N 3.11Å; D23-E26 PolarHBondContact O-N 3.47Å; D23-E26 VanDerWaalsContact O-N 3.12Å; D23-I27 PolarHBondContact O-N 3.29Å
24	K	88.3	Confident	90.4	Very high	178 Å²	178	71.8 Å²	71.8	77%	0.774	35%	0.346	S	S	*	.	H	α-helix	trans	-57.2	-35.8	176.6	-66.7	-178.4	-177.3	176	0	112.5	E26 I27 K28	K24-E26 VanDerWaalsContact C-N 3.33Å; K24-E26 PolarHBondContact O-N 3.35Å; K24-I27 PolarHBondContact O-N 3.4Å; K24-K28 WeakPolarHBondContact O-CB 3.35Å; K24-K28 PolarHBondContact O-N 3.4Å; K24-K28 VanDerWaalsContact O-N 3.09Å
25	T	89.8	Confident	90.7	Very high	59 Å²	59	68.5 Å²	68.5	36%	0.362	34%	0.338	S	S	.	.	H	α-helix	trans	-59.3	-45.3	177.4	-54.7	0	0	0	0	110.6	D23 I27 K28 E29 A186	D23-T25 PolarHBondContact O-N 3.11Å; T25-I27 PolarHBondContact O-N 3.2Å; T25-K28 WeakPolarHBondContact O-CB 3.37Å; T25-K28 PolarHBondContact O-N 2.93Å; T25-E29 HydrophobicContact CG2-CG 4.41Å; T25-E29 WeakPolarHBondContact O-CG 3.21Å; T25-E29 PolarHBondContact O-N 3.02Å; T25-A186 HydrophobicContact CG2-CB 3.95Å
26	E	90.8	Very high	90.9	Very high	12 Å²	12	68 Å²	68	6%	0.056	33%	0.332	C	S	.	.	H	α-helix	trans	-65.9	-39.8	-176.9	-56.9	-157.4	143.5	0	0	113.5	T22 D23 K24 K28 E29 A30 K111 L183 P184	T22-E26 WeakPolarHBondContact CB-OE2 3.25Å; T22-E26 WeakPolarHBondContact CG2-OE2 3.47Å; D23-E26 PolarHBondContact O-N 3.47Å; D23-E26 VanDerWaalsContact O-N 3.12Å; K24-E26 VanDerWaalsContact C-N 3.33Å; K24-E26 PolarHBondContact O-N 3.35Å; E26-K28 VanDerWaalsContact C-N 3.33Å; E26-E29 PolarHBondContact O-N 2.97Å; E26-A30 WeakPolarHBondContact O-CB 3.44Å; E26-A30 PolarHBondContact O-N 3.48Å; E26-K111 VanDerWaalsContact CD-NZ 3.33Å; E26-K111 IonicContact OE1-NZ 3.47Å; E26-K111 PolarHBondContact OE1-NZ 3.41Å; E26-K111 IonicContact OE2-NZ 2.62Å; E26-K111 PolarHBondContact OE2-NZ 2.67Å; E26-L183 WeakPolarHBondContact OE1-CD2 3.36Å; E26-P184 HydrophobicContact CB-CG 4.39Å; E26-P184 HydrophobicContact CG-CG 4.07Å; E26-P184 WeakPolarHBondContact OE1-CD 3.38Å
27	I	91.1	Very high	91.3	Very high	31 Å²	31	67.4 Å²	67.4	16%	0.159	33%	0.328	C	S	.	.	H	α-helix	trans	-65.1	-42.8	177.2	-61.3	151.4	0	0	0	109.8	I13 K17 D23 K24 T25 A30 C31	I13-I27 HydrophobicContact CG2-CG2 4.28Å; K17-I27 HydrophobicContact CB-CD1 4.21Å; K17-I27 HydrophobicContact CB-CG1 4.25Å; K17-I27 HydrophobicContact CD-CD1 3.29Å; K17-I27 HydrophobicContact CD-CG1 4.12Å; K17-I27 HydrophobicContact CG-CD1 3.66Å; K17-I27 HydrophobicContact CG-CG1 4.24Å; D23-I27 PolarHBondContact O-N 3.29Å; K24-I27 PolarHBondContact O-N 3.4Å; T25-I27 PolarHBondContact O-N 3.2Å; I27-A30 PolarHBondContact O-N 3.44Å; I27-C31 WeakPolarHBondContact O-CB 3.37Å; I27-C31 PolarHBondContact O-N 3.36Å; I27-C31 PolarHBondContact O-SG 3.33Å
28	K	93.3	Very high	91.7	Very high	116 Å²	116	64.4 Å²	64.4	50%	0.504	32%	0.316	S	S	.	.	H	α-helix	trans	-59.9	-49.9	177.8	-173	-164.6	66.2	166.8	0	110.4	K24 T25 E26 A30 C31 L32	K24-K28 WeakPolarHBondContact O-CB 3.35Å; K24-K28 PolarHBondContact O-N 3.4Å; K24-K28 VanDerWaalsContact O-N 3.09Å; T25-K28 WeakPolarHBondContact O-CB 3.37Å; T25-K28 PolarHBondContact O-N 2.93Å; E26-K28 VanDerWaalsContact C-N 3.33Å; K28-A30 PolarHBondContact O-N 2.83Å; K28-C31 PolarHBondContact O-N 2.93Å; K28-L32 HydrophobicContact CG-CD1 4.14Å; K28-L32 WeakPolarHBondContact O-CB 3.32Å; K28-L32 VanDerWaalsContact O-CG 3.26Å; K28-L32 WeakPolarHBondContact O-CG 3.27Å; K28-L32 PolarHBondContact O-N 3.29Å
29	E	94.7	Very high	92.1	Very high	26 Å²	26	62 Å²	62	12%	0.121	31%	0.312	C	S	.	.	H	α-helix	trans	-62.7	-40.4	178.2	-62	-52.1	133.6	0	0	112	T25 E26 L32 A33 H172 P184 A186	T25-E29 HydrophobicContact CG2-CG 4.41Å; T25-E29 WeakPolarHBondContact O-CG 3.21Å; T25-E29 PolarHBondContact O-N 3.02Å; E26-E29 PolarHBondContact O-N 2.97Å; E29-L32 PolarHBondContact O-N 2.99Å; E29-A33 VanDerWaalsContact O-CB 3.27Å; E29-A33 WeakPolarHBondContact O-CB 3.29Å; E29-A33 PolarHBondContact O-N 2.85Å; E29-H172 IonicContact OE2-CD2 3.36Å; E29-H172 PolarHBondContact OE2-CD2 3.37Å; E29-P184 HydrophobicContact CB-CB 3.84Å; E29-P184 HydrophobicContact CB-CG 4.25Å; E29-P184 HydrophobicContact CG-CB 3.96Å; E29-P184 HydrophobicContact CG-CG 4.18Å; E29-A186 HydrophobicContact CG-CB 3.84Å
30	A	94.2	Very high	92.4	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-62.7	-44.1	175.7	0	0	0	0	0	112.3	I13 E26 I27 K28 A33 V34 Y107 Y173	I13-A30 HydrophobicContact CD1-CB 3.83Å; I13-A30 HydrophobicContact CG1-CB 4.07Å; I13-A30 HydrophobicContact CG2-CB 4.03Å; E26-A30 WeakPolarHBondContact O-CB 3.44Å; E26-A30 PolarHBondContact O-N 3.48Å; I27-A30 PolarHBondContact O-N 3.44Å; K28-A30 PolarHBondContact O-N 2.83Å; A30-A33 PolarHBondContact O-N 2.99Å; A30-V34 WeakPolarHBondContact O-CG1 3.47Å; A30-V34 PolarHBondContact O-N 3.33Å; A30-Y107 HydrophobicContact CB-CD2 4.44Å; A30-Y107 HydrophobicContact CB-CE2 3.84Å; A30-Y173 WeakPolarHBondContact CA-OH 3.38Å; A30-Y173 WeakPolarHBondContact CB-OH 3.43Å; A30-Y173 PolarHBondContact N-OH 3.04Å
31	C	93.8	Very high	93	Very high	40 Å²	40	55 Å²	55	27%	0.27	28%	0.278	S	S	.	.	H	α-helix	trans	-65.9	-39.1	177.2	-74.1	0	0	0	0	112.4	I27 K28 V34 S35	I27-C31 WeakPolarHBondContact O-CB 3.37Å; I27-C31 PolarHBondContact O-N 3.36Å; I27-C31 PolarHBondContact O-SG 3.33Å; K28-C31 PolarHBondContact O-N 2.93Å; C31-V34 WeakPolarHBondContact O-CG1 3.34Å; C31-S35 WeakPolarHBondContact O-CB 3.32Å; C31-S35 PolarHBondContact O-N 3.42Å; C31-S35 PolarHBondContact O-OG 3.4Å
32	L	95.3	Very high	93.4	Very high	87 Å²	87	44.7 Å²	44.7	46%	0.455	24%	0.242	S	C	.	.	H	α-helix	trans	-65.3	-45.5	174.7	-72.5	173.8	0	0	0	110.7	K28 E29 S35 L36	K28-L32 HydrophobicContact CG-CD1 4.14Å; K28-L32 WeakPolarHBondContact O-CB 3.32Å; K28-L32 VanDerWaalsContact O-CG 3.26Å; K28-L32 WeakPolarHBondContact O-CG 3.27Å; K28-L32 PolarHBondContact O-N 3.29Å; E29-L32 PolarHBondContact O-N 2.99Å; L32-S35 PolarHBondContact O-N 3.15Å; L32-L36 VanDerWaalsContact O-CB 3.27Å; L32-L36 WeakPolarHBondContact O-CB 3.44Å; L32-L36 PolarHBondContact O-N 3.4Å
33	A	96	Very high	94.1	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-62.4	-46.5	-179.9	0	0	0	0	0	112.6	E29 A30 L36 A37 F103 S168 H172 Y173	E29-A33 VanDerWaalsContact O-CB 3.27Å; E29-A33 WeakPolarHBondContact O-CB 3.29Å; E29-A33 PolarHBondContact O-N 2.85Å; A30-A33 PolarHBondContact O-N 2.99Å; A33-L36 PolarHBondContact O-N 3.05Å; A33-A37 PolarHBondContact O-N 3.43Å; A33-F103 HydrophobicContact CB-CE2 3.52Å; A33-F103 HydrophobicContact CB-CZ 3.57Å; A33-S168 WeakPolarHBondContact O-CB 3.3Å; A33-H172 HydrophobicContact CB-CB 4Å; A33-H172 WeakPolarHBondContact CB-ND1 3.44Å; A33-Y173 HydrophobicContact CB-CE2 4.5Å
34	V	95.4	Very high	94.7	Very high	1 Å²	1	47.8 Å²	47.8	1%	0.006	26%	0.257	C	S	.	.	H	α-helix	trans	-69.6	-39.2	178.7	71.3	0	0	0	0	112.3	P9 L10 I13 A30 C31 L36 A37 L38 F103	P9-V34 HydrophobicContact CB-CG2 3.73Å; P9-V34 HydrophobicContact CG-CG2 4.02Å; L10-V34 HydrophobicContact CD2-CG1 4.49Å; I13-V34 HydrophobicContact CD1-CG1 4.37Å; A30-V34 WeakPolarHBondContact O-CG1 3.47Å; A30-V34 PolarHBondContact O-N 3.33Å; C31-V34 WeakPolarHBondContact O-CG1 3.34Å; V34-L36 VanDerWaalsContact C-N 3.32Å; V34-L36 PolarHBondContact O-N 2.86Å; V34-A37 PolarHBondContact O-N 2.74Å; V34-L38 HydrophobicContact CG2-CD1 4.16Å; V34-L38 HydrophobicContact CG2-CG 4.43Å; V34-L38 WeakPolarHBondContact O-CG 3.29Å; V34-L38 PolarHBondContact O-N 3.23Å; V34-F103 HydrophobicContact CB-CD1 3.64Å; V34-F103 HydrophobicContact CB-CE1 3.66Å; V34-F103 HydrophobicContact CB-CG 4.21Å; V34-F103 HydrophobicContact CB-CZ 4.21Å; V34-F103 HydrophobicContact CG2-CB 4.5Å; V34-F103 HydrophobicContact CG2-CD1 3.69Å; V34-F103 HydrophobicContact CG2-CE1 4.22Å; V34-F103 HydrophobicContact CG2-CG 4.14Å
35	S	95.3	Very high	95.1	Very high	52 Å²	52	39.3 Å²	39.3	36%	0.364	22%	0.22	S	C	.	.	H	α-helix	trans	-62.2	-42.9	176.5	-63.2	0	0	0	0	111	C31 L32 L38 A39	C31-S35 WeakPolarHBondContact O-CB 3.32Å; C31-S35 PolarHBondContact O-N 3.42Å; C31-S35 PolarHBondContact O-OG 3.4Å; L32-S35 PolarHBondContact O-N 3.15Å; S35-L38 PolarHBondContact O-N 3.26Å; S35-A39 VanDerWaalsContact O-CB 3.25Å; S35-A39 WeakPolarHBondContact O-CB 3.36Å; S35-A39 PolarHBondContact O-N 3.3Å
36	L	96.3	Very high	95.3	Very high	64 Å²	64	40 Å²	40	34%	0.335	22%	0.221	S	C	.	.	H	α-helix	trans	-61.3	-46.2	175.3	-178.5	64.8	0	0	0	111.4	L32 A33 V34 L38 A39 L40	L32-L36 VanDerWaalsContact O-CB 3.27Å; L32-L36 WeakPolarHBondContact O-CB 3.44Å; L32-L36 PolarHBondContact O-N 3.4Å; A33-L36 PolarHBondContact O-N 3.05Å; V34-L36 VanDerWaalsContact C-N 3.32Å; V34-L36 PolarHBondContact O-N 2.86Å; L36-L38 PolarHBondContact O-N 3.45Å; L36-A39 PolarHBondContact O-N 2.65Å; L36-L40 HydrophobicContact CD1-CD1 3.79Å; L36-L40 HydrophobicContact CD1-CG 3.96Å; L36-L40 HydrophobicContact CG-CD1 3.92Å; L36-L40 HydrophobicContact CG-CG 4.41Å; L36-L40 WeakPolarHBondContact O-CB 3.34Å; L36-L40 WeakPolarHBondContact O-CG 3.26Å; L36-L40 PolarHBondContact O-N 3.27Å
37	A	97	Very high	95.6	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-57.9	-49.4	178.8	0	0	0	0	0	111.6	A33 V34 N41 S99 S168	A33-A37 PolarHBondContact O-N 3.43Å; V34-A37 PolarHBondContact O-N 2.74Å; A37-N41 WeakPolarHBondContact O-CB 3.3Å; A37-N41 PolarHBondContact O-N 3.39Å; A37-S99 PolarHBondContact O-OG 3.28Å; A37-S168 VanDerWaalsContact CA-OG 3.32Å; A37-S168 WeakPolarHBondContact CA-OG 3.5Å; A37-S168 PolarHBondContact N-OG 3.07Å
38	L	95.9	Very high	95.9	Very high	11 Å²	11	43.6 Å²	43.6	6%	0.058	24%	0.243	C	C	.	.	H	α-helix	trans	-67.8	-39.6	-178.5	-69.1	173.4	0	0	0	112.3	F6 V34 S35 L36 G42 F96	F6-L38 HydrophobicContact CB-CD1 4.37Å; F6-L38 HydrophobicContact CD2-CD1 3.78Å; V34-L38 HydrophobicContact CG2-CD1 4.16Å; V34-L38 HydrophobicContact CG2-CG 4.43Å; V34-L38 WeakPolarHBondContact O-CG 3.29Å; V34-L38 PolarHBondContact O-N 3.23Å; S35-L38 PolarHBondContact O-N 3.26Å; L36-L38 PolarHBondContact O-N 3.45Å; L38-G42 PolarHBondContact O-N 3.47Å; L38-F96 HydrophobicContact CD2-CD1 4.1Å
39	A	96.3	Very high	96	Very high	59 Å²	59	38.9 Å²	38.9	49%	0.488	22%	0.223	S	C	.	.	H	α-helix	trans	-65.6	-51.7	178.8	0	0	0	0	0	111.5	S35 L36 G42 V43	S35-A39 VanDerWaalsContact O-CB 3.25Å; S35-A39 WeakPolarHBondContact O-CB 3.36Å; S35-A39 PolarHBondContact O-N 3.3Å; L36-A39 PolarHBondContact O-N 2.65Å; A39-G42 PolarHBondContact O-N 2.87Å; A39-V43 WeakPolarHBondContact O-CG2 3.49Å; A39-V43 PolarHBondContact O-N 3.01Å
40	L	97.1	Very high	96	Very high	60 Å²	60	43.6 Å²	43.6	31%	0.314	25%	0.248	S	C	.	.	H	α-helix	trans	-61.6	-47.1	178.4	-68.9	177.3	0	0	0	111.3	L36 G42 V43 F44 F164	L36-L40 HydrophobicContact CD1-CD1 3.79Å; L36-L40 HydrophobicContact CD1-CG 3.96Å; L36-L40 HydrophobicContact CG-CD1 3.92Å; L36-L40 HydrophobicContact CG-CG 4.41Å; L36-L40 WeakPolarHBondContact O-CB 3.34Å; L36-L40 WeakPolarHBondContact O-CG 3.26Å; L36-L40 PolarHBondContact O-N 3.27Å; L40-G42 VanDerWaalsContact C-N 3.29Å; L40-G42 PolarHBondContact O-N 2.82Å; L40-V43 PolarHBondContact O-N 3.26Å; L40-F44 WeakPolarHBondContact O-CD2 3.4Å; L40-F44 PolarHBondContact O-N 2.88Å; L40-F164 HydrophobicContact CB-CD1 3.61Å; L40-F164 HydrophobicContact CB-CE1 3.83Å; L40-F164 HydrophobicContact CB-CG 4.18Å; L40-F164 HydrophobicContact CD1-CD1 4.12Å; L40-F164 HydrophobicContact CD1-CE1 4.39Å
41	N	97.4	Very high	96.1	Very high	0 Å²	0	50 Å²	50	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-56.9	-44.1	175.3	172.9	77.6	0	0	0	111.8	A37 T45 S95 G161 F164	A37-N41 WeakPolarHBondContact O-CB 3.3Å; A37-N41 PolarHBondContact O-N 3.39Å; N41-T45 WeakPolarHBondContact O-CB 3.37Å; N41-T45 PolarHBondContact O-N 3.45Å; N41-T45 PolarHBondContact O-OG1 2.87Å; N41-T45 PolarHBondContact OD1-OG1 2.96Å; N41-S95 PolarHBondContact OD1-O 3.48Å; N41-S95 PolarHBondContact OD1-OG 3.23Å; N41-G161 WeakPolarHBondContact OD1-CA 3.41Å; N41-F164 HydrophobicContact CB-CB 4.16Å; N41-F164 HydrophobicContact CB-CD2 4.05Å; N41-F164 HydrophobicContact CB-CG 4.36Å
42	G	95.9	Very high	96.2	Very high	9 Å²	9	51.4 Å²	51.4	9%	0.093	29%	0.288	C	S	.	.	H	α-helix	trans	-63.2	-47.1	-179.4	0	0	0	0	0	112.9	L38 A39 L40 N46	L38-G42 PolarHBondContact O-N 3.47Å; A39-G42 PolarHBondContact O-N 2.87Å; L40-G42 VanDerWaalsContact C-N 3.29Å; L40-G42 PolarHBondContact O-N 2.82Å; G42-N46 VanDerWaalsContact O-CB 3.27Å; G42-N46 WeakPolarHBondContact O-CB 3.44Å; G42-N46 PolarHBondContact O-N 3.04Å; G42-N46 PolarHBondContact O-ND2 3.25Å
43	V	97	Very high	96.1	Very high	93 Å²	93	48.7 Å²	48.7	56%	0.564	28%	0.281	S	S	*	.	H	α-helix	trans	-59.8	-53.9	176.6	172.6	0	0	0	0	110.2	A39 L40 T45 N46 T47	A39-V43 WeakPolarHBondContact O-CG2 3.49Å; A39-V43 PolarHBondContact O-N 3.01Å; L40-V43 PolarHBondContact O-N 3.26Å; V43-T45 PolarHBondContact O-N 3.01Å; V43-N46 PolarHBondContact O-N 3.49Å; V43-T47 WeakPolarHBondContact O-CB 3.32Å; V43-T47 PolarHBondContact O-N 3.29Å; V43-T47 PolarHBondContact O-OG1 3.2Å
44	F	97.4	Very high	96	Very high	106 Å²	106	52.1 Å²	52.1	47%	0.465	29%	0.294	S	S	.	.	H	α-helix	trans	-62.3	-47.7	-177.5	-90.4	-100.2	0	0	0	112.7	L40 N46 T47 I48 F164	L40-F44 WeakPolarHBondContact O-CD2 3.4Å; L40-F44 PolarHBondContact O-N 2.88Å; F44-N46 VanDerWaalsContact C-N 3.35Å; F44-N46 PolarHBondContact O-N 3.32Å; F44-T47 PolarHBondContact O-N 3.19Å; F44-I48 VanDerWaalsContact O-CG1 3.27Å; F44-I48 WeakPolarHBondContact O-CG1 3.46Å; F44-I48 PolarHBondContact O-N 3.24Å; F44-F164 HydrophobicContact CB-CE2 3.71Å; F44-F164 HydrophobicContact CB-CZ 3.98Å; F44-F164 HydrophobicContact CD1-CE2 4.34Å; F44-F164 AromaticContact CD1-CZ 3.96Å; F44-F164 HydrophobicContact CD1-CZ 3.96Å; F44-F164 HydrophobicContact CD2-CE1 4.19Å; F44-F164 HydrophobicContact CD2-CE2 4.05Å; F44-F164 AromaticContact CD2-CZ 3.42Å; F44-F164 HydrophobicContact CD2-CZ 3.42Å; F44-F164 VanDerWaalsContact CD2-CZ 3.42Å; F44-F164 HydrophobicContact CE1-CZ 4.3Å; F44-F164 HydrophobicContact CE2-CE1 4.31Å; F44-F164 AromaticContact CE2-CZ 3.8Å; F44-F164 HydrophobicContact CE2-CZ 3.8Å; F44-F164 AromaticContact CG-CE2 3.78Å; F44-F164 HydrophobicContact CG-CE2 3.78Å; F44-F164 AromaticContact CG-CZ 3.5Å; F44-F164 HydrophobicContact CG-CZ 3.5Å; F44-F164 VanDerWaalsContact CG-CZ 3.5Å; F44-F164 HydrophobicContact CZ-CZ 4.22Å
45	T	96.6	Very high	96	Very high	0 Å²	0	55 Å²	55	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-60.9	-45.1	-178.3	-61.2	0	0	0	0	111.6	N41 V43 K49 P90 S95	N41-T45 WeakPolarHBondContact O-CB 3.37Å; N41-T45 PolarHBondContact O-N 3.45Å; N41-T45 PolarHBondContact O-OG1 2.87Å; N41-T45 PolarHBondContact OD1-OG1 2.96Å; V43-T45 PolarHBondContact O-N 3.01Å; T45-K49 WeakPolarHBondContact O-CB 3.5Å; T45-K49 PolarHBondContact O-N 3.16Å; T45-P90 HydrophobicContact CG2-CG 4.14Å; T45-S95 WeakPolarHBondContact OG1-CB 3.39Å; T45-S95 PolarHBondContact OG1-OG 3.27Å
46	N	95.3	Very high	96.1	Very high	73 Å²	73	53.3 Å²	53.3	39%	0.39	30%	0.299	S	S	.	.	H	α-helix	trans	-70.8	-39	-178.8	-69.1	-28.1	0	0	0	111.5	G42 V43 F44 K49 L50	G42-N46 VanDerWaalsContact O-CB 3.27Å; G42-N46 WeakPolarHBondContact O-CB 3.44Å; G42-N46 PolarHBondContact O-N 3.04Å; G42-N46 PolarHBondContact O-ND2 3.25Å; V43-N46 PolarHBondContact O-N 3.49Å; F44-N46 VanDerWaalsContact C-N 3.35Å; F44-N46 PolarHBondContact O-N 3.32Å; N46-K49 PolarHBondContact O-N 2.74Å; N46-L50 WeakPolarHBondContact O-CG 3.42Å; N46-L50 PolarHBondContact O-N 2.92Å
47	T	96.9	Very high	96	Very high	71 Å²	71	52.8 Å²	52.8	44%	0.436	30%	0.299	S	S	.	.	H	α-helix	trans	-60.6	-51	175.3	-63.6	0	0	0	0	111.4	V43 F44 K49 L50 I51	V43-T47 WeakPolarHBondContact O-CB 3.32Å; V43-T47 PolarHBondContact O-N 3.29Å; V43-T47 PolarHBondContact O-OG1 3.2Å; F44-T47 PolarHBondContact O-N 3.19Å; T47-K49 PolarHBondContact O-N 3.48Å; T47-L50 PolarHBondContact O-N 2.95Å; T47-I51 HydrophobicContact CG2-CD1 3.72Å; T47-I51 VanDerWaalsContact O-CG1 3.3Å; T47-I51 WeakPolarHBondContact O-CG1 3.29Å; T47-I51 PolarHBondContact O-N 3.23Å
48	I	96.6	Very high	95.9	Very high	48 Å²	48	53.6 Å²	53.6	25%	0.246	30%	0.304	C	S	.	.	H	α-helix	trans	-59.6	-40.4	177.8	-61.7	165.1	0	0	0	110.2	F44 L50 I51 V52 F89 P90 I160	F44-I48 VanDerWaalsContact O-CG1 3.27Å; F44-I48 WeakPolarHBondContact O-CG1 3.46Å; F44-I48 PolarHBondContact O-N 3.24Å; I48-L50 PolarHBondContact O-N 3.07Å; I48-I51 PolarHBondContact O-N 2.62Å; I48-V52 HydrophobicContact CG2-CG2 3.83Å; I48-V52 WeakPolarHBondContact O-CB 3.47Å; I48-V52 WeakPolarHBondContact O-CG2 3.47Å; I48-V52 PolarHBondContact O-N 3.48Å; I48-F89 HydrophobicContact CG2-CD1 4.09Å; I48-F89 HydrophobicContact CG2-CE1 3.92Å; I48-P90 HydrophobicContact CB-CG 4.39Å; I48-P90 HydrophobicContact CG2-CG 4.27Å; I48-I160 HydrophobicContact CD1-CD1 3.94Å
49	K	95.1	Very high	95.8	Very high	17 Å²	17	55.7 Å²	55.7	7%	0.074	31%	0.311	C	S	.	.	H	α-helix	trans	-62	-39.8	179.5	172.2	170.1	-82.7	-142.4	0	113.9	T45 N46 T47 G53 K87 F89 P90 S92	T45-K49 WeakPolarHBondContact O-CB 3.5Å; T45-K49 PolarHBondContact O-N 3.16Å; N46-K49 PolarHBondContact O-N 2.74Å; T47-K49 PolarHBondContact O-N 3.48Å; K49-G53 PolarHBondContact O-N 2.8Å; K49-K87 HydrophobicContact CD-CB 3.88Å; K49-K87 WeakPolarHBondContact CE-O 3.38Å; K49-K87 HydrophobicContact CG-CB 3.78Å; K49-K87 HydrophobicContact CG-CG 4.2Å; K49-K87 PolarHBondContact NZ-O 3.03Å; K49-F89 WeakPolarHBondContact CA-O 3.35Å; K49-P90 WeakPolarHBondContact CE-O 3.09Å; K49-S92 WeakPolarHBondContact CE-OG 3.48Å; K49-S92 PolarHBondContact NZ-OG 2.91Å; K49-S92 VanDerWaalsContact NZ-OG 3.1Å
50	L	94.6	Very high	95.7	Very high	124 Å²	124	57.5 Å²	57.5	65%	0.649	31%	0.308	S	S	*	.	H	α-helix	trans	-73.1	-33.2	176.4	-66.5	175.9	0	0	0	112.2	N46 T47 I48	N46-L50 WeakPolarHBondContact O-CG 3.42Å; N46-L50 PolarHBondContact O-N 2.92Å; T47-L50 PolarHBondContact O-N 2.95Å; I48-L50 PolarHBondContact O-N 3.07Å
51	I	96.1	Very high	95.6	Very high	134 Å²	134	61.6 Å²	61.6	69%	0.687	33%	0.326	S	S	*	.	H	α-helix	trans	-73.1	-48.2	179.2	-67.1	167.5	0	0	0	111.5	T47 I48	T47-I51 HydrophobicContact CG2-CD1 3.72Å; T47-I51 VanDerWaalsContact O-CG1 3.3Å; T47-I51 WeakPolarHBondContact O-CG1 3.29Å; T47-I51 PolarHBondContact O-N 3.23Å; I48-I51 PolarHBondContact O-N 2.62Å
52	V	96.3	Very high	95.4	Very high	71 Å²	71	62.6 Å²	62.6	43%	0.43	33%	0.329	S	S	.	.	H	α-helix	trans	-75.1	-37.4	-170.7	175.1	0	0	0	0	112	I48 R54 F89	I48-V52 HydrophobicContact CG2-CG2 3.83Å; I48-V52 WeakPolarHBondContact O-CB 3.47Å; I48-V52 WeakPolarHBondContact O-CG2 3.47Å; I48-V52 PolarHBondContact O-N 3.48Å; V52-R54 HydrophobicContact CG1-CB 4.04Å; V52-R54 PolarHBondContact O-N 3.42Å; V52-R54 VanDerWaalsContact O-N 3.09Å; V52-F89 HydrophobicContact CB-CD1 4.12Å; V52-F89 HydrophobicContact CG1-CB 4.12Å; V52-F89 HydrophobicContact CG1-CD1 3.87Å; V52-F89 HydrophobicContact CG1-CG 4.32Å; V52-F89 HydrophobicContact CG2-CD1 3.92Å; V52-F89 HydrophobicContact CG2-CE1 4.3Å
53	G	93.6	Very high	95.4	Very high	30 Å²	30	62.5 Å²	62.5	31%	0.309	33%	0.327	S	S	.	.			trans	62.3	21.2	173.9	0	0	0	0	0	115.3	K49 P55 R86	K49-G53 PolarHBondContact O-N 2.8Å; G53-P55 WeakPolarHBondContact O-CD 3.37Å; G53-R86 CarbonylContact C-O 3.52Å; G53-R86 WeakPolarHBondContact CA-O 3.46Å; G53-R86 VanDerWaalsContact O-O 3.13Å
54	R	95	Very high	95.4	Very high	71 Å²	71	58.6 Å²	58.6	27%	0.268	30%	0.303	S	S	.	.	P	Polyproline II helix	trans	-60.9	128.1	-175.4	-173.2	-175.1	179.7	176.6	4.4	110.9	V52 R86 S88 F89 H150 D153	V52-R54 HydrophobicContact CG1-CB 4.04Å; V52-R54 PolarHBondContact O-N 3.42Å; V52-R54 VanDerWaalsContact O-N 3.09Å; R54-R86 PolarHBondContact N-O 3.16Å; R54-R86 CarbonylContact O-C 3.33Å; R54-R86 VanDerWaalsContact O-O 3.13Å; R54-S88 WeakPolarHBondContact O-CB 3.43Å; R54-S88 PolarHBondContact O-N 3.35Å; R54-F89 HydrophobicContact CB-CB 3.77Å; R54-F89 HydrophobicContact CG-CB 4.42Å; R54-H150 PolarHBondContact NH2-CD2 2.89Å; R54-H150 PolarHBondContact NH2-ND1 2.9Å; R54-D153 WeakPolarHBondContact CD-OD1 3.32Å; R54-D153 IonicContact CZ-OD1 3.52Å; R54-D153 IonicContact NE-OD1 3.8Å; R54-D153 IonicContact NH1-OD1 2.67Å; R54-D153 PolarHBondContact NH1-OD1 3.32Å; R54-D153 IonicContact NH1-OD2 3.98Å
55	P	95.6	Very high	95.2	Very high	63 Å²	63	57.9 Å²	57.9	41%	0.409	31%	0.309	S	S	.	.	P	Polyproline II helix	trans	-60.4	139.5	170.5	-23.3	34.2	0	0	0	112.6	G53 Y59 G85 H150	G53-P55 WeakPolarHBondContact O-CD 3.37Å; P55-Y59 HydrophobicContact CB-CD1 3.91Å; P55-Y59 HydrophobicContact CB-CD2 4.4Å; P55-Y59 HydrophobicContact CB-CG 3.79Å; P55-Y59 HydrophobicContact CG-CD1 4.49Å; P55-G85 CarbonylContact C-O 3.21Å; P55-G85 WeakPolarHBondContact CA-O 3.49Å; P55-H150 PolarHBondContact O-CE1 3.36Å
56	R	95.6	Very high	95	Very high	15 Å²	15	62.6 Å²	62.6	6%	0.057	33%	0.334	C	S	.	.	P	Polyproline II helix	trans	-72.4	160.8	171.4	-68.4	179.5	-178.7	-96.9	2.7	111.1	D58 Y59 E84 G85 K148 H149	R56-D58 WeakPolarHBondContact CB-OD1 3.14Å; R56-D58 PolarHBondContact O-N 2.62Å; R56-Y59 WeakPolarHBondContact O-CB 3.41Å; R56-Y59 PolarHBondContact O-N 3.47Å; R56-E84 IonicContact CZ-OE1 3.18Å; R56-E84 IonicContact CZ-OE2 3.76Å; R56-E84 PolarHBondContact NE-O 3.36Å; R56-E84 IonicContact NE-OE1 3.28Å; R56-E84 PolarHBondContact NE-OE1 2.86Å; R56-E84 IonicContact NE-OE2 3.28Å; R56-E84 PolarHBondContact NE-OE2 3.5Å; R56-E84 IonicContact NH2-OE1 2.59Å; R56-E84 PolarHBondContact NH2-OE1 3.3Å; R56-E84 IonicContact NH2-OE2 3.91Å; R56-G85 WeakPolarHBondContact CG-O 3.3Å; R56-G85 PolarHBondContact N-O 3.41Å; R56-K148 WeakPolarHBondContact CG-O 3.35Å; R56-K148 PolarHBondContact NH1-O 3.42Å; R56-H149 PolarHBondContact NH1-CE1 3.03Å; R56-H149 VanDerWaalsContact NH1-CE1 3.33Å; R56-H149 PolarHBondContact NH1-NE2 2.97Å
57	P	95.6	Very high	94.8	Very high	53 Å²	53	61.3 Å²	61.3	34%	0.344	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-33.8	172.5	-22.5	31.9	0	0	0	113.2	Y59 Y147	P57-Y59 VanDerWaalsContact C-N 3.3Å; P57-Y59 PolarHBondContact O-N 2.92Å; P57-Y147 WeakPolarHBondContact CB-O 3.43Å; P57-Y147 WeakPolarHBondContact CD-O 3.46Å; P57-Y147 WeakPolarHBondContact CG-O 3.36Å
58	D	93.4	Very high	94.5	Very high	18 Å²	18	64.8 Å²	64.8	10%	0.096	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86	10.9	176.9	69	-12.5	0	0	0	114.1	R56 F60 Q61 R62 K148	R56-D58 WeakPolarHBondContact CB-OD1 3.14Å; R56-D58 PolarHBondContact O-N 2.62Å; D58-F60 PolarHBondContact O-N 3.39Å; D58-Q61 PolarHBondContact O-N 3.34Å; D58-R62 WeakPolarHBondContact O-CG 3.11Å; D58-R62 PolarHBondContact O-N 2.95Å; D58-R62 IonicContact OD1-CZ 3.65Å; D58-R62 IonicContact OD1-NE 3.37Å; D58-R62 PolarHBondContact OD1-NE 2.81Å; D58-R62 IonicContact OD1-NH2 3.45Å; D58-R62 PolarHBondContact OD1-NH2 3.39Å; D58-R62 IonicContact OD2-CZ 3.32Å; D58-R62 VanDerWaalsContact OD2-CZ 3.32Å; D58-R62 IonicContact OD2-NE 3.85Å; D58-R62 PolarHBondContact OD2-NE 3.45Å; D58-R62 IonicContact OD2-NH2 2.9Å; D58-R62 PolarHBondContact OD2-NH2 2.96Å; D58-K148 IonicContact OD2-NZ 2.76Å; D58-K148 PolarHBondContact OD2-NZ 3.25Å
59	Y	95.1	Very high	94.3	Very high	55 Å²	55	68.4 Å²	68.4	22%	0.216	37%	0.367	C	S	.	.	H	α-helix	trans	-61.6	-40.5	-174.7	-178.3	-110.3	0	0	0	113.4	P55 R56 P57 Q61 R62 C63 V82 R86	P55-Y59 HydrophobicContact CB-CD1 3.91Å; P55-Y59 HydrophobicContact CB-CD2 4.4Å; P55-Y59 HydrophobicContact CB-CG 3.79Å; P55-Y59 HydrophobicContact CG-CD1 4.49Å; R56-Y59 WeakPolarHBondContact O-CB 3.41Å; R56-Y59 PolarHBondContact O-N 3.47Å; P57-Y59 VanDerWaalsContact C-N 3.3Å; P57-Y59 PolarHBondContact O-N 2.92Å; Y59-Q61 PolarHBondContact O-N 3.17Å; Y59-R62 WeakPolarHBondContact O-CB 3.5Å; Y59-R62 PolarHBondContact O-N 3.43Å; Y59-R62 VanDerWaalsContact O-N 3.15Å; Y59-C63 HydrophobicContact CE1-CB 4.41Å; Y59-C63 WeakPolarHBondContact O-CB 3.36Å; Y59-C63 PolarHBondContact O-N 2.86Å; Y59-V82 HydrophobicContact CE2-CG1 4.05Å; Y59-R86 HydrophobicContact CD2-CG 4.38Å; Y59-R86 HydrophobicContact CE2-CG 3.59Å
60	F	94.3	Very high	94	Very high	96 Å²	96	70 Å²	70	42%	0.421	38%	0.376	S	S	.	.	H	α-helix	trans	-58.8	-47.3	-178.1	-179.1	-94.5	0	0	0	111.7	D58 R62 C63 F64 M69	D58-F60 PolarHBondContact O-N 3.39Å; F60-R62 PolarHBondContact O-N 3.35Å; F60-C63 PolarHBondContact O-N 3.26Å; F60-C63 VanDerWaalsContact O-N 3.14Å; F60-F64 AromaticContact CD2-CD2 3.96Å; F60-F64 HydrophobicContact CD2-CD2 3.96Å; F60-F64 AromaticContact CE2-CD2 3.67Å; F60-F64 HydrophobicContact CE2-CD2 3.67Å; F60-F64 HydrophobicContact CE2-CE2 4.23Å; F60-F64 HydrophobicContact CZ-CB 4.43Å; F60-F64 HydrophobicContact CZ-CD2 4.12Å; F60-F64 PolarHBondContact O-N 3.01Å; F60-M69 HydrophobicContact CE2-CB 4.47Å
61	Q	93.5	Very high	93.8	Very high	146 Å²	146	69.2 Å²	69.2	68%	0.682	39%	0.387	S	S	*	.	H	α-helix	trans	-66.9	-26.5	179.8	-65.7	-178.5	-47.8	0	0	112.9	D58 Y59 F64 P65	D58-Q61 PolarHBondContact O-N 3.34Å; Y59-Q61 PolarHBondContact O-N 3.17Å; Q61-F64 CarbonylContact O-C 3.56Å; Q61-P65 WeakPolarHBondContact O-CA 3.35Å
62	R	94.7	Very high	93.5	Very high	22 Å²	22	71 Å²	71	8%	0.083	39%	0.39	C	S	.	.	H	α-helix	trans	-75.8	-36.4	173.6	-65.5	162.2	176.5	-113.2	17.3	111.9	D58 Y59 F60 M81 V82 E84	D58-R62 WeakPolarHBondContact O-CG 3.11Å; D58-R62 PolarHBondContact O-N 2.95Å; D58-R62 IonicContact OD1-CZ 3.65Å; D58-R62 IonicContact OD1-NE 3.37Å; D58-R62 PolarHBondContact OD1-NE 2.81Å; D58-R62 IonicContact OD1-NH2 3.45Å; D58-R62 PolarHBondContact OD1-NH2 3.39Å; D58-R62 IonicContact OD2-CZ 3.32Å; D58-R62 VanDerWaalsContact OD2-CZ 3.32Å; D58-R62 IonicContact OD2-NE 3.85Å; D58-R62 PolarHBondContact OD2-NE 3.45Å; D58-R62 IonicContact OD2-NH2 2.9Å; D58-R62 PolarHBondContact OD2-NH2 2.96Å; Y59-R62 WeakPolarHBondContact O-CB 3.5Å; Y59-R62 PolarHBondContact O-N 3.43Å; Y59-R62 VanDerWaalsContact O-N 3.15Å; F60-R62 PolarHBondContact O-N 3.35Å; R62-M81 PolarHBondContact NH1-O 3.16Å; R62-V82 WeakPolarHBondContact O-CG2 3.29Å; R62-E84 IonicContact CZ-OE2 3.11Å; R62-E84 IonicContact NH1-OE2 2.62Å; R62-E84 PolarHBondContact NH1-OE2 3.06Å; R62-E84 IonicContact NH2-OE2 2.9Å; R62-E84 PolarHBondContact NH2-OE2 2.93Å
63	C	95.5	Very high	93.1	Very high	7 Å²	7	74.5 Å²	74.5	5%	0.047	40%	0.404	C	S	.	.	H	α-helix	trans	-76.2	-39.7	179.7	-176.2	0	0	0	0	111.9	Y59 F60 C75 T76 G77	Y59-C63 HydrophobicContact CE1-CB 4.41Å; Y59-C63 WeakPolarHBondContact O-CB 3.36Å; Y59-C63 PolarHBondContact O-N 2.86Å; F60-C63 PolarHBondContact O-N 3.26Å; F60-C63 VanDerWaalsContact O-N 3.14Å; C63-C75 HydrophobicContact CB-CB 3.95Å; C63-C75 WeakPolarHBondContact CB-SG 3.49Å; C63-C75 CarbonylContact O-C 3.55Å; C63-C75 WeakPolarHBondContact O-CA 3.47Å; C63-C75 WeakPolarHBondContact SG-CA 3.38Å; C63-C75 WeakPolarHBondContact SG-CB 3.48Å; C63-C75 CovalentContact SG-SG 2.04Å; C63-C75 PolarHBondContact SG-SG 3.28Å; C63-T76 PolarHBondContact O-N 2.88Å; C63-T76 PolarHBondContact O-OG1 3.43Å; C63-G77 PolarHBondContact O-N 3.42Å; C63-G77 VanDerWaalsContact O-N 3.08Å
64	F	95.9	Very high	93	Very high	11 Å²	11	78.4 Å²	78.4	5%	0.048	42%	0.417	C	S	.	.			trans	-127.3	84.7	178.8	-56.7	-73.2	0	0	0	110	F60 Q61 D66 G67 Q68 M69 L74	F60-F64 AromaticContact CD2-CD2 3.96Å; F60-F64 HydrophobicContact CD2-CD2 3.96Å; F60-F64 AromaticContact CE2-CD2 3.67Å; F60-F64 HydrophobicContact CE2-CD2 3.67Å; F60-F64 HydrophobicContact CE2-CE2 4.23Å; F60-F64 HydrophobicContact CZ-CB 4.43Å; F60-F64 HydrophobicContact CZ-CD2 4.12Å; F60-F64 PolarHBondContact O-N 3.01Å; Q61-F64 CarbonylContact O-C 3.56Å; F64-D66 PolarHBondContact O-N 3.48Å; F64-G67 WeakPolarHBondContact O-CA 3.14Å; F64-G67 PolarHBondContact O-N 2.88Å; F64-Q68 VanDerWaalsContact CD1-O 3.32Å; F64-Q68 WeakPolarHBondContact CD1-O 3.36Å; F64-M69 HydrophobicContact CE1-CG 4.37Å; F64-M69 HydrophobicContact CE2-CB 4.33Å; F64-M69 HydrophobicContact CE2-CG 3.97Å; F64-M69 HydrophobicContact CZ-CB 4.38Å; F64-M69 HydrophobicContact CZ-CG 3.82Å; F64-L74 WeakPolarHBondContact CE1-O 3.39Å
65	P	94.1	Very high	92.9	Very high	91 Å²	91	77.4 Å²	77.4	59%	0.591	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-26.3	-178.4	-22.8	34.1	0	0	0	114	Q61	Q61-P65 WeakPolarHBondContact O-CA 3.35Å
66	D	92.2	Very high	92.8	Very high	98 Å²	98	78.3 Å²	78.3	52%	0.524	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-6.4	173.1	58.7	-11.5	0	0	0	113.2	F64 Q68	F64-D66 PolarHBondContact O-N 3.48Å; D66-Q68 PolarHBondContact O-N 2.96Å; D66-Q68 PolarHBondContact OD1-N 3.12Å
67	G	91.6	Very high	92.7	Very high	47 Å²	47	78.1 Å²	78.1	49%	0.485	43%	0.427	S	S	.	.	S	Bend	trans	71.2	5.6	-176.8	0	0	0	0	0	113.9	F64	F64-G67 WeakPolarHBondContact O-CA 3.14Å; F64-G67 PolarHBondContact O-N 2.88Å
68	Q	91.5	Very high	92.7	Very high	143 Å²	143	82.3 Å²	82.3	67%	0.668	44%	0.442	S	S	*	.			trans	-109	115.2	-176.6	-63.3	-169.3	8.1	0	0	110.6	F64 D66 N70	F64-Q68 VanDerWaalsContact CD1-O 3.32Å; F64-Q68 WeakPolarHBondContact CD1-O 3.36Å; D66-Q68 PolarHBondContact O-N 2.96Å; D66-Q68 PolarHBondContact OD1-N 3.12Å; Q68-N70 PolarHBondContact O-N 3.28Å
69	M	91.1	Very high	92.8	Very high	124 Å²	124	86.1 Å²	86.1	61%	0.611	47%	0.468	S	S	*	.			trans	-75.4	125.8	174.9	-175.2	171	67.3	0	0	110.1	F60 F64	F60-M69 HydrophobicContact CE2-CB 4.47Å; F64-M69 HydrophobicContact CE1-CG 4.37Å; F64-M69 HydrophobicContact CE2-CB 4.33Å; F64-M69 HydrophobicContact CE2-CG 3.97Å; F64-M69 HydrophobicContact CZ-CB 4.38Å; F64-M69 HydrophobicContact CZ-CG 3.82Å
70	N	88.1	Confident	92.7	Very high	52 Å²	52	91.1 Å²	91.1	28%	0.278	49%	0.493	S	S	.	.			trans	-79.8	155.5	173.2	64.5	55	0	0	0	111.8	Q68 K72 M73 L74	Q68-N70 PolarHBondContact O-N 3.28Å; N70-K72 PolarHBondContact O-N 2.97Å; N70-K72 VanDerWaalsContact O-N 3.1Å; N70-K72 PolarHBondContact OD1-N 3.43Å; N70-M73 PolarHBondContact O-N 3.31Å; N70-M73 PolarHBondContact OD1-N 2.98Å; N70-L74 PolarHBondContact ND2-O 3.38Å; N70-L74 PolarHBondContact OD1-N 3.45Å; N70-L74 VanDerWaalsContact OD1-N 3.1Å
71	A	91	Very high	92.7	Very high	106 Å²	106	91.4 Å²	91.4	88%	0.876	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-20.3	-179.8	0	0	0	0	0	114	M73	A71-M73 VanDerWaalsContact C-N 3.34Å
72	K	90.2	Very high	92.8	Very high	173 Å²	173	85.2 Å²	85.2	75%	0.752	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-7.9	178.1	-62.1	-177.8	-179.3	178.4	0	112.9	N70 L74	N70-K72 PolarHBondContact O-N 2.97Å; N70-K72 VanDerWaalsContact O-N 3.1Å; N70-K72 PolarHBondContact OD1-N 3.43Å; K72-L74 HydrophobicContact CB-CD1 4.01Å; K72-L74 HydrophobicContact CB-CG 4.02Å; K72-L74 HydrophobicContact CD-CD1 4.32Å; K72-L74 PolarHBondContact O-N 2.91Å; K72-L74 VanDerWaalsContact O-N 3.15Å
73	M	86.8	Confident	92.7	Very high	144 Å²	144	86.1 Å²	86.1	71%	0.709	48%	0.479	S	S	*	.			trans	52.1	28.6	-173.6	-55.9	-175.9	-129.7	0	0	114	N70 A71	N70-M73 PolarHBondContact O-N 3.31Å; N70-M73 PolarHBondContact OD1-N 2.98Å; A71-M73 VanDerWaalsContact C-N 3.34Å
74	L	91.4	Very high	92.6	Very high	111 Å²	111	88.8 Å²	88.8	58%	0.581	49%	0.491	S	S	*	.			trans	-93	129	178	-67	173.6	0	0	0	109.5	F64 N70 K72 T76	F64-L74 WeakPolarHBondContact CE1-O 3.39Å; N70-L74 PolarHBondContact ND2-O 3.38Å; N70-L74 PolarHBondContact OD1-N 3.45Å; N70-L74 VanDerWaalsContact OD1-N 3.1Å; K72-L74 HydrophobicContact CB-CD1 4.01Å; K72-L74 HydrophobicContact CB-CG 4.02Å; K72-L74 HydrophobicContact CD-CD1 4.32Å; K72-L74 PolarHBondContact O-N 2.91Å; K72-L74 VanDerWaalsContact O-N 3.15Å; L74-T76 PolarHBondContact O-N 2.93Å
75	C	93.4	Very high	92.5	Very high	51 Å²	51	88.3 Å²	88.3	35%	0.345	49%	0.489	S	S	.	.			trans	-61	136.5	176.5	-61.4	0	0	0	0	111.2	C63 V82	C63-C75 HydrophobicContact CB-CB 3.95Å; C63-C75 WeakPolarHBondContact CB-SG 3.49Å; C63-C75 CarbonylContact O-C 3.55Å; C63-C75 WeakPolarHBondContact O-CA 3.47Å; C63-C75 WeakPolarHBondContact SG-CA 3.38Å; C63-C75 WeakPolarHBondContact SG-CB 3.48Å; C63-C75 CovalentContact SG-SG 2.04Å; C63-C75 PolarHBondContact SG-SG 3.28Å; C75-V82 HydrophobicContact CB-CG1 4.1Å; C75-V82 HydrophobicContact CB-CG2 3.98Å
76	T	94	Very high	92.5	Very high	82 Å²	82	90.5 Å²	90.5	50%	0.503	49%	0.485	S	S	.	.			trans	-103.6	-14.2	177.2	52.6	0	0	0	0	112.5	C63 L74	C63-T76 PolarHBondContact O-N 2.88Å; C63-T76 PolarHBondContact O-OG1 3.43Å; L74-T76 PolarHBondContact O-N 2.93Å
77	G	93.1	Very high	92.6	Very high	11 Å²	11	89.2 Å²	89.2	11%	0.113	48%	0.475	C	S	.	.	S	Bend	trans	-74.5	169.8	176.5	0	0	0	0	0	114.4	C63	C63-G77 PolarHBondContact O-N 3.42Å; C63-G77 VanDerWaalsContact O-N 3.08Å
78	E	96.1	Very high	92.8	Very high	140 Å²	140	87 Å²	87	65%	0.654	45%	0.452	S	S	*	.			trans	-53.8	125.8	-178.2	-73.6	-63.1	119.9	0	0	112.3	E80 M81 V82	E78-E80 PolarHBondContact O-N 2.97Å; E78-E80 VanDerWaalsContact O-N 3.13Å; E78-M81 HydrophobicContact CB-CB 4.16Å; E78-M81 HydrophobicContact CB-CG 4.1Å; E78-M81 WeakPolarHBondContact O-CB 3.35Å; E78-M81 PolarHBondContact O-N 3.45Å; E78-V82 WeakPolarHBondContact O-CG2 3.41Å; E78-V82 PolarHBondContact O-N 2.96Å
79	P	94.6	Very high	93	Very high	98 Å²	98	82.3 Å²	82.3	64%	0.636	43%	0.429	S	S	*	.	H	α-helix	trans	-54.3	-38.4	-174.1	-28.3	34.2	0	0	0	113.9	S83	P79-S83 WeakPolarHBondContact O-CB 3.46Å; P79-S83 PolarHBondContact O-N 2.98Å
80	E	94.7	Very high	93.3	Very high	161 Å²	161	76.4 Å²	76.4	75%	0.752	40%	0.4	S	S	*	.	H	α-helix	trans	-64.3	-46.7	177.8	-66.3	-166.6	167.8	0	0	111.7	E78 V82 S83 E84	E78-E80 PolarHBondContact O-N 2.97Å; E78-E80 VanDerWaalsContact O-N 3.13Å; E80-V82 VanDerWaalsContact C-N 3.34Å; E80-V82 PolarHBondContact O-N 3.46Å; E80-S83 PolarHBondContact O-N 2.99Å; E80-S83 PolarHBondContact O-OG 2.9Å; E80-E84 WeakPolarHBondContact O-CB 3.4Å; E80-E84 PolarHBondContact O-N 3.06Å
81	M	93.7	Very high	93.6	Very high	101 Å²	101	74 Å²	74	50%	0.498	39%	0.387	S	S	.	.	H	α-helix	trans	-64.8	-38.3	179.7	-71.4	-68.4	-76	0	0	112.1	R62 E78 E84 G85	R62-M81 PolarHBondContact NH1-O 3.16Å; E78-M81 HydrophobicContact CB-CB 4.16Å; E78-M81 HydrophobicContact CB-CG 4.1Å; E78-M81 WeakPolarHBondContact O-CB 3.35Å; E78-M81 PolarHBondContact O-N 3.45Å; M81-E84 PolarHBondContact O-N 2.93Å; M81-G85 PolarHBondContact O-N 3.26Å
82	V	95.1	Very high	93.8	Very high	17 Å²	17	69.8 Å²	69.8	10%	0.103	35%	0.352	C	S	.	.	H	α-helix	trans	-65.9	-44.6	173.6	176.8	0	0	0	0	110.4	Y59 R62 C75 E78 E80 E84 G85 R86	Y59-V82 HydrophobicContact CE2-CG1 4.05Å; R62-V82 WeakPolarHBondContact O-CG2 3.29Å; C75-V82 HydrophobicContact CB-CG1 4.1Å; C75-V82 HydrophobicContact CB-CG2 3.98Å; E78-V82 WeakPolarHBondContact O-CG2 3.41Å; E78-V82 PolarHBondContact O-N 2.96Å; E80-V82 VanDerWaalsContact C-N 3.34Å; E80-V82 PolarHBondContact O-N 3.46Å; V82-E84 VanDerWaalsContact C-N 3.31Å; V82-E84 PolarHBondContact O-N 3.35Å; V82-G85 PolarHBondContact O-N 3.48Å; V82-R86 PolarHBondContact O-N 3.49Å
83	S	93.8	Very high	94	Very high	40 Å²	40	64.2 Å²	64.2	28%	0.28	33%	0.328	S	S	.	.	H	α-helix	trans	-63.6	-37.3	177.6	85.4	0	0	0	0	112.3	P79 E80 G85 R86	P79-S83 WeakPolarHBondContact O-CB 3.46Å; P79-S83 PolarHBondContact O-N 2.98Å; E80-S83 PolarHBondContact O-N 2.99Å; E80-S83 PolarHBondContact O-OG 2.9Å; S83-G85 VanDerWaalsContact C-N 3.34Å; S83-R86 PolarHBondContact O-N 2.66Å
84	E	92.9	Very high	94.4	Very high	64 Å²	64	57.3 Å²	57.3	30%	0.299	29%	0.294	S	S	.	.	H	α-helix	trans	-67.9	-36.7	175.2	-157.9	-71.1	134.8	0	0	111.2	R56 R62 E80 M81 V82 R86 K87	R56-E84 IonicContact CZ-OE1 3.18Å; R56-E84 IonicContact CZ-OE2 3.76Å; R56-E84 PolarHBondContact NE-O 3.36Å; R56-E84 IonicContact NE-OE1 3.28Å; R56-E84 PolarHBondContact NE-OE1 2.86Å; R56-E84 IonicContact NE-OE2 3.28Å; R56-E84 PolarHBondContact NE-OE2 3.5Å; R56-E84 IonicContact NH2-OE1 2.59Å; R56-E84 PolarHBondContact NH2-OE1 3.3Å; R56-E84 IonicContact NH2-OE2 3.91Å; R62-E84 IonicContact CZ-OE2 3.11Å; R62-E84 IonicContact NH1-OE2 2.62Å; R62-E84 PolarHBondContact NH1-OE2 3.06Å; R62-E84 IonicContact NH2-OE2 2.9Å; R62-E84 PolarHBondContact NH2-OE2 2.93Å; E80-E84 WeakPolarHBondContact O-CB 3.4Å; E80-E84 PolarHBondContact O-N 3.06Å; M81-E84 PolarHBondContact O-N 2.93Å; V82-E84 VanDerWaalsContact C-N 3.31Å; V82-E84 PolarHBondContact O-N 3.35Å; E84-R86 PolarHBondContact O-N 3.14Å; E84-K87 WeakPolarHBondContact O-CB 3.48Å; E84-K87 PolarHBondContact O-N 2.91Å
85	G	93.5	Very high	94.7	Very high	0 Å²	0	52 Å²	52	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-61.7	-23.6	174.3	0	0	0	0	0	114	P55 R56 M81 V82 S83 K87	P55-G85 CarbonylContact C-O 3.21Å; P55-G85 WeakPolarHBondContact CA-O 3.49Å; R56-G85 WeakPolarHBondContact CG-O 3.3Å; R56-G85 PolarHBondContact N-O 3.41Å; M81-G85 PolarHBondContact O-N 3.26Å; V82-G85 PolarHBondContact O-N 3.48Å; S83-G85 VanDerWaalsContact C-N 3.34Å; G85-K87 VanDerWaalsContact C-N 3.3Å
86	R	94.7	Very high	94.9	Very high	137 Å²	137	50.4 Å²	50.4	52%	0.517	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	5.8	173.8	-63.3	-165.9	-64	174.5	-0.9	114.1	G53 R54 Y59 V82 S83 E84	G53-R86 CarbonylContact C-O 3.52Å; G53-R86 WeakPolarHBondContact CA-O 3.46Å; G53-R86 VanDerWaalsContact O-O 3.13Å; R54-R86 PolarHBondContact N-O 3.16Å; R54-R86 CarbonylContact O-C 3.33Å; R54-R86 VanDerWaalsContact O-O 3.13Å; Y59-R86 HydrophobicContact CD2-CG 4.38Å; Y59-R86 HydrophobicContact CE2-CG 3.59Å; V82-R86 PolarHBondContact O-N 3.49Å; S83-R86 PolarHBondContact O-N 2.66Å; E84-R86 PolarHBondContact O-N 3.14Å
87	K	94.1	Very high	95	Very high	72 Å²	72	46.5 Å²	46.5	31%	0.313	23%	0.23	S	C	.	.			trans	-111.9	50	-174.4	-65.8	172.9	-170.3	165.5	0	111.4	K49 E84 G85	K49-K87 HydrophobicContact CD-CB 3.88Å; K49-K87 WeakPolarHBondContact CE-O 3.38Å; K49-K87 HydrophobicContact CG-CB 3.78Å; K49-K87 HydrophobicContact CG-CG 4.2Å; K49-K87 PolarHBondContact NZ-O 3.03Å; E84-K87 WeakPolarHBondContact O-CB 3.48Å; E84-K87 PolarHBondContact O-N 2.91Å; G85-K87 VanDerWaalsContact C-N 3.3Å
88	S	94.7	Very high	95.2	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.229	C	C	.	.			trans	-81	-51.4	-178	-158.1	0	0	0	0	113.5	R54 P90 H149 D153	R54-S88 WeakPolarHBondContact O-CB 3.43Å; R54-S88 PolarHBondContact O-N 3.35Å; S88-P90 CarbonylContact O-C 3.56Å; S88-H149 PolarHBondContact O-CE1 2.73Å; S88-H149 PolarHBondContact O-ND1 3.36Å; S88-D153 PolarHBondContact OG-OD2 3.36Å
89	F	96.3	Very high	95.3	Very high	45 Å²	45	40.3 Å²	40.3	20%	0.197	20%	0.197	C	C	.	.	S	Bend	trans	-98.7	137.9	-171.5	-178.8	-89.9	0	0	0	112.3	I48 K49 V52 R54 D153 V156	I48-F89 HydrophobicContact CG2-CD1 4.09Å; I48-F89 HydrophobicContact CG2-CE1 3.92Å; K49-F89 WeakPolarHBondContact CA-O 3.35Å; V52-F89 HydrophobicContact CB-CD1 4.12Å; V52-F89 HydrophobicContact CG1-CB 4.12Å; V52-F89 HydrophobicContact CG1-CD1 3.87Å; V52-F89 HydrophobicContact CG1-CG 4.32Å; V52-F89 HydrophobicContact CG2-CD1 3.92Å; V52-F89 HydrophobicContact CG2-CE1 4.3Å; R54-F89 HydrophobicContact CB-CB 3.77Å; R54-F89 HydrophobicContact CG-CB 4.42Å; F89-D153 WeakPolarHBondContact CB-OD1 3.45Å; F89-D153 HydrophobicContact CD2-CB 4.44Å; F89-D153 VanDerWaalsContact CD2-OD1 3.3Å; F89-D153 WeakPolarHBondContact CD2-OD1 3.18Å; F89-V156 HydrophobicContact CE2-CB 3.87Å; F89-V156 HydrophobicContact CE2-CG1 4.02Å; F89-V156 HydrophobicContact CE2-CG2 3.91Å; F89-V156 HydrophobicContact CZ-CB 4.11Å; F89-V156 HydrophobicContact CZ-CG1 3.73Å; F89-V156 HydrophobicContact CZ-CG2 4.23Å
90	P	96.8	Very high	95.4	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	17%	0.167	C	C	.	.	S	Bend	cis	-76.2	168.3	-20.7	32.6	-33.9	0	0	0	110.4	T45 I48 K49 S88 S92 V156 I160	T45-P90 HydrophobicContact CG2-CG 4.14Å; I48-P90 HydrophobicContact CB-CG 4.39Å; I48-P90 HydrophobicContact CG2-CG 4.27Å; K49-P90 WeakPolarHBondContact CE-O 3.09Å; S88-P90 CarbonylContact O-C 3.56Å; P90-S92 PolarHBondContact O-N 3.35Å; P90-S92 VanDerWaalsContact O-N 3.12Å; P90-V156 HydrophobicContact CB-CG1 4.43Å; P90-I160 HydrophobicContact CB-CD1 4.26Å; P90-I160 HydrophobicContact CG-CD1 3.98Å
91	S	95.8	Very high	95.4	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	13%	0.133	C	C	.	.			trans	-71.9	108.5	178.3	-176.4	0	0	0	0	111.2	H93 S94 S95 H149 D153	S91-H93 PolarHBondContact O-N 2.96Å; S91-S94 PolarHBondContact O-N 3.48Å; S91-S94 PolarHBondContact OG-N 3.39Å; S91-S95 PolarHBondContact O-N 3.46Å; S91-H149 PolarHBondContact OG-CD2 2.88Å; S91-H149 VanDerWaalsContact OG-CD2 3.3Å; S91-H149 PolarHBondContact OG-NE2 3.49Å; S91-D153 WeakPolarHBondContact CB-O 3.48Å; S91-D153 PolarHBondContact N-O 2.88Å
92	S	94.2	Very high	95.6	Very high	19 Å²	19	23.4 Å²	23.4	13%	0.133	11%	0.109	C	C	.	.	H	α-helix	trans	-57.8	-36.6	173.2	-43.6	0	0	0	0	112.2	K49 P90 S95 F96	K49-S92 WeakPolarHBondContact CE-OG 3.48Å; K49-S92 PolarHBondContact NZ-OG 2.91Å; K49-S92 VanDerWaalsContact NZ-OG 3.1Å; P90-S92 PolarHBondContact O-N 3.35Å; P90-S92 VanDerWaalsContact O-N 3.12Å; S92-S95 PolarHBondContact O-N 2.89Å; S92-F96 WeakPolarHBondContact O-CB 3.27Å; S92-F96 VanDerWaalsContact O-CD2 3.25Å; S92-F96 WeakPolarHBondContact O-CD2 3.37Å; S92-F96 PolarHBondContact O-N 3.42Å
93	H	94.4	Very high	95.7	Very high	55 Å²	55	22.6 Å²	22.6	26%	0.255	10%	0.104	S	C	.	.	H	α-helix	trans	-61.6	-47.8	177.8	-73.1	72.2	0	0	0	111	M1 S91 A97 R143	M1-H93 HydrophobicContact CG-CB 4.14Å; M1-H93 WeakPolarHBondContact CG-CD2 3.4Å; S91-H93 PolarHBondContact O-N 2.96Å; H93-A97 WeakPolarHBondContact O-CB 3.34Å; H93-A97 PolarHBondContact O-N 3.49Å; H93-A97 VanDerWaalsContact O-N 3.07Å; H93-R143 HydrophobicContact CB-CG 3.75Å
94	S	96.4	Very high	95.8	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-62.9	-49.5	175.8	-169.4	0	0	0	0	111.1	S91 F96 A97 F98 A140 A154 G158	S91-S94 PolarHBondContact O-N 3.48Å; S91-S94 PolarHBondContact OG-N 3.39Å; S94-F96 PolarHBondContact O-N 2.96Å; S94-A97 PolarHBondContact O-N 3.14Å; S94-F98 WeakPolarHBondContact O-CD2 3.22Å; S94-F98 PolarHBondContact O-N 2.9Å; S94-A140 WeakPolarHBondContact OG-CB 3.36Å; S94-A154 VanDerWaalsContact CB-O 3.3Å; S94-A154 WeakPolarHBondContact CB-O 3.21Å; S94-A154 PolarHBondContact OG-O 2.58Å; S94-G158 PolarHBondContact OG-N 3Å
95	S	97.2	Very high	96	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-60.2	-47.8	-176.9	-145.5	0	0	0	0	113.3	N41 T45 S91 S92 S99 G157 G161	N41-S95 PolarHBondContact OD1-O 3.48Å; N41-S95 PolarHBondContact OD1-OG 3.23Å; T45-S95 WeakPolarHBondContact OG1-CB 3.39Å; T45-S95 PolarHBondContact OG1-OG 3.27Å; S91-S95 PolarHBondContact O-N 3.46Å; S92-S95 PolarHBondContact O-N 2.89Å; S95-S99 WeakPolarHBondContact O-CB 3.48Å; S95-S99 PolarHBondContact O-N 3.12Å; S95-G157 WeakPolarHBondContact CA-O 3.14Å; S95-G157 WeakPolarHBondContact CB-O 3.44Å; S95-G157 PolarHBondContact OG-O 2.94Å; S95-G161 WeakPolarHBondContact O-CA 3.44Å
96	F	96.6	Very high	96.1	Very high	17 Å²	17	19 Å²	19	8%	0.075	8%	0.083	C	C	.	.	H	α-helix	trans	-68.1	-34.9	176.8	-82.6	-76.6	0	0	0	112.7	F2 S5 L38 S92 S94 G100	F2-F96 HydrophobicContact CD2-CD1 4.33Å; F2-F96 HydrophobicContact CD2-CE1 4.05Å; F2-F96 HydrophobicContact CD2-CZ 4.24Å; F2-F96 HydrophobicContact CE2-CD1 4.23Å; F2-F96 AromaticContact CE2-CE1 3.55Å; F2-F96 HydrophobicContact CE2-CE1 3.55Å; F2-F96 AromaticContact CE2-CZ 3.79Å; F2-F96 HydrophobicContact CE2-CZ 3.79Å; F2-F96 HydrophobicContact CZ-CE1 4.48Å; S5-F96 VanDerWaalsContact CB-O 3.3Å; S5-F96 WeakPolarHBondContact CB-O 3.44Å; S5-F96 PolarHBondContact OG-O 2.99Å; L38-F96 HydrophobicContact CD2-CD1 4.1Å; S92-F96 WeakPolarHBondContact O-CB 3.27Å; S92-F96 VanDerWaalsContact O-CD2 3.25Å; S92-F96 WeakPolarHBondContact O-CD2 3.37Å; S92-F96 PolarHBondContact O-N 3.42Å; S94-F96 PolarHBondContact O-N 2.96Å; F96-G100 PolarHBondContact O-N 3.07Å
97	A	96.6	Very high	96.1	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-64.8	-50.7	176.4	0	0	0	0	0	111.1	S5 H93 S94 S99 L101 A136 I139	S5-A97 PolarHBondContact OG-N 3.32Å; H93-A97 WeakPolarHBondContact O-CB 3.34Å; H93-A97 PolarHBondContact O-N 3.49Å; H93-A97 VanDerWaalsContact O-N 3.07Å; S94-A97 PolarHBondContact O-N 3.14Å; A97-S99 VanDerWaalsContact C-N 3.34Å; A97-S99 PolarHBondContact O-N 2.88Å; A97-L101 VanDerWaalsContact O-CB 3.22Å; A97-L101 WeakPolarHBondContact O-CB 3.39Å; A97-L101 PolarHBondContact O-N 2.99Å; A97-A136 HydrophobicContact CB-CB 4.24Å; A97-I139 HydrophobicContact CB-CB 4.15Å; A97-I139 HydrophobicContact CB-CD1 4.12Å; A97-I139 HydrophobicContact CB-CG2 3.72Å
98	F	97.4	Very high	96.1	Very high	20 Å²	20	10.2 Å²	10.2	9%	0.088	5%	0.049	C	C	.	.	H	α-helix	trans	-68.6	-29.5	177.8	-83	-78.7	0	0	0	113.3	S94 G102 L133 A136 M137 A140 G158 L162	S94-F98 WeakPolarHBondContact O-CD2 3.22Å; S94-F98 PolarHBondContact O-N 2.9Å; F98-G102 WeakPolarHBondContact O-CA 3.46Å; F98-G102 PolarHBondContact O-N 3.36Å; F98-L133 HydrophobicContact CD1-CD2 4.39Å; F98-A136 HydrophobicContact CD1-CB 3.99Å; F98-A136 HydrophobicContact CD2-CB 4.27Å; F98-A136 HydrophobicContact CE1-CB 4.06Å; F98-A136 HydrophobicContact CE2-CB 4.34Å; F98-A136 HydrophobicContact CG-CB 4.11Å; F98-A136 HydrophobicContact CZ-CB 4.24Å; F98-M137 HydrophobicContact CZ-CB 4.36Å; F98-M137 HydrophobicContact CZ-CE 4.13Å; F98-M137 HydrophobicContact CZ-SD 4.39Å; F98-A140 HydrophobicContact CE2-CB 3.91Å; F98-G158 WeakPolarHBondContact CB-O 3.21Å; F98-L162 HydrophobicContact CB-CG 4.19Å; F98-L162 HydrophobicContact CD1-CD1 3.97Å; F98-L162 HydrophobicContact CD1-CD2 3.97Å; F98-L162 HydrophobicContact CD1-CG 3.77Å; F98-L162 HydrophobicContact CE1-CD1 4.37Å; F98-L162 HydrophobicContact CG-CG 4.33Å
99	S	97.6	Very high	96.1	Very high	0 Å²	0	10.2 Å²	10.2	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-67.9	-54.5	173.2	-178.7	0	0	0	0	111.9	A37 S95 A97 F103 G161 A165	A37-S99 PolarHBondContact O-OG 3.28Å; S95-S99 WeakPolarHBondContact O-CB 3.48Å; S95-S99 PolarHBondContact O-N 3.12Å; A97-S99 VanDerWaalsContact C-N 3.34Å; A97-S99 PolarHBondContact O-N 2.88Å; S99-F103 WeakPolarHBondContact O-CB 3.42Å; S99-F103 PolarHBondContact O-N 2.87Å; S99-G161 WeakPolarHBondContact CA-O 3.39Å; S99-A165 WeakPolarHBondContact O-CB 3.11Å
100	G	96.4	Very high	96	Very high	0 Å²	0	8.1 Å²	8.1	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-69.9	-54.7	-178.7	0	0	0	0	0	112.9	P9 F96 F103 T104	P9-G100 WeakPolarHBondContact CG-O 3.39Å; F96-G100 PolarHBondContact O-N 3.07Å; G100-F103 PolarHBondContact O-N 3.32Å; G100-T104 PolarHBondContact O-N 3.08Å; G100-T104 PolarHBondContact O-OG1 3.33Å; G100-T104 VanDerWaalsContact O-OG1 3.07Å
101	L	96.3	Very high	95.8	Very high	5 Å²	5	8.7 Å²	8.7	3%	0.026	4%	0.043	C	C	.	.	H	α-helix	trans	-75.2	-30.1	-177.1	-59.7	172.7	0	0	0	112.5	T8 A97 T104 S105 P132 A136 I139	T8-L101 HydrophobicContact CG2-CD2 3.56Å; A97-L101 VanDerWaalsContact O-CB 3.22Å; A97-L101 WeakPolarHBondContact O-CB 3.39Å; A97-L101 PolarHBondContact O-N 2.99Å; L101-T104 WeakPolarHBondContact O-CB 3.48Å; L101-T104 PolarHBondContact O-N 3.43Å; L101-S105 WeakPolarHBondContact O-CB 3.37Å; L101-S105 PolarHBondContact O-N 2.95Å; L101-P132 HydrophobicContact CB-CB 4.13Å; L101-P132 WeakPolarHBondContact CB-O 3.38Å; L101-P132 WeakPolarHBondContact O-CB 3.46Å; L101-A136 HydrophobicContact CB-CB 4.09Å; L101-A136 HydrophobicContact CD1-CB 3.89Å; L101-I139 HydrophobicContact CD1-CD1 4.09Å
102	G	97.2	Very high	95.6	Very high	0 Å²	0	9.9 Å²	9.9	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-66.7	-40.2	170.3	0	0	0	0	0	111.6	F98 T104 S105 F106	F98-G102 WeakPolarHBondContact O-CA 3.46Å; F98-G102 PolarHBondContact O-N 3.36Å; G102-T104 PolarHBondContact O-N 3.47Å; G102-S105 WeakPolarHBondContact O-CB 3.22Å; G102-S105 PolarHBondContact O-N 3.26Å; G102-F106 VanDerWaalsContact O-CD2 3.26Å; G102-F106 WeakPolarHBondContact O-CD2 3.4Å; G102-F106 VanDerWaalsContact O-CG 3.29Å; G102-F106 WeakPolarHBondContact O-CG 3.33Å; G102-F106 PolarHBondContact O-N 3.41Å
103	F	97	Very high	95.4	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-59.7	-46.6	170.5	177.9	-88.6	0	0	0	111.3	A33 V34 S99 G100 S105 F106 Y107 A165 Y169	A33-F103 HydrophobicContact CB-CE2 3.52Å; A33-F103 HydrophobicContact CB-CZ 3.57Å; V34-F103 HydrophobicContact CB-CD1 3.64Å; V34-F103 HydrophobicContact CB-CE1 3.66Å; V34-F103 HydrophobicContact CB-CG 4.21Å; V34-F103 HydrophobicContact CB-CZ 4.21Å; V34-F103 HydrophobicContact CG2-CB 4.5Å; V34-F103 HydrophobicContact CG2-CD1 3.69Å; V34-F103 HydrophobicContact CG2-CE1 4.22Å; V34-F103 HydrophobicContact CG2-CG 4.14Å; S99-F103 WeakPolarHBondContact O-CB 3.42Å; S99-F103 PolarHBondContact O-N 2.87Å; G100-F103 PolarHBondContact O-N 3.32Å; F103-S105 VanDerWaalsContact C-N 3.26Å; F103-S105 PolarHBondContact O-N 2.87Å; F103-F106 PolarHBondContact O-N 3.26Å; F103-F106 VanDerWaalsContact O-N 3.16Å; F103-Y107 WeakPolarHBondContact O-CB 3.39Å; F103-Y107 PolarHBondContact O-N 3.02Å; F103-A165 HydrophobicContact CB-CB 4.08Å; F103-Y169 HydrophobicContact CE2-CD2 4.39Å
104	T	96.1	Very high	95.2	Very high	3 Å²	3	9.2 Å²	9.2	2%	0.018	5%	0.045	C	C	.	.	H	α-helix	trans	-56.4	-41.7	175.2	-57.8	0	0	0	0	112	P9 V12 G100 L101 G102 Y107 L108 P132	P9-T104 WeakPolarHBondContact CA-OG1 3.41Å; P9-T104 WeakPolarHBondContact CB-OG1 3.49Å; P9-T104 WeakPolarHBondContact CG-OG1 3.46Å; V12-T104 HydrophobicContact CB-CG2 3.91Å; V12-T104 HydrophobicContact CG1-CG2 3.8Å; V12-T104 HydrophobicContact CG2-CG2 3.84Å; G100-T104 PolarHBondContact O-N 3.08Å; G100-T104 PolarHBondContact O-OG1 3.33Å; G100-T104 VanDerWaalsContact O-OG1 3.07Å; L101-T104 WeakPolarHBondContact O-CB 3.48Å; L101-T104 PolarHBondContact O-N 3.43Å; G102-T104 PolarHBondContact O-N 3.47Å; T104-Y107 PolarHBondContact O-N 3.47Å; T104-L108 HydrophobicContact CG2-CD1 4.2Å; T104-L108 HydrophobicContact CG2-CG 4.49Å; T104-L108 WeakPolarHBondContact O-CB 3.3Å; T104-L108 WeakPolarHBondContact O-CG 3.37Å; T104-L108 PolarHBondContact O-N 3.01Å; T104-P132 HydrophobicContact CG2-CB 4.36Å; T104-P132 HydrophobicContact CG2-CG 4.03Å
105	S	96.6	Very high	94.9	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-61	-48.6	175.6	-178.3	0	0	0	0	111.7	L101 G102 F103 Y107 L108 A109 M129 L133	L101-S105 WeakPolarHBondContact O-CB 3.37Å; L101-S105 PolarHBondContact O-N 2.95Å; G102-S105 WeakPolarHBondContact O-CB 3.22Å; G102-S105 PolarHBondContact O-N 3.26Å; F103-S105 VanDerWaalsContact C-N 3.26Å; F103-S105 PolarHBondContact O-N 2.87Å; S105-Y107 PolarHBondContact O-N 2.9Å; S105-L108 PolarHBondContact O-N 3.4Å; S105-A109 WeakPolarHBondContact O-CB 3.1Å; S105-A109 PolarHBondContact O-N 3.34Å; S105-M129 VanDerWaalsContact CB-O 3.29Å; S105-M129 WeakPolarHBondContact CB-O 3.19Å; S105-M129 WeakPolarHBondContact O-CG 3.48Å; S105-M129 VanDerWaalsContact OG-CE 3.3Å; S105-M129 WeakPolarHBondContact OG-CE 3.26Å; S105-M129 PolarHBondContact OG-O 3Å; S105-L133 VanDerWaalsContact OG-CD1 3.32Å; S105-L133 WeakPolarHBondContact OG-CD1 3.21Å; S105-L133 WeakPolarHBondContact OG-CG 3.3Å
106	F	96.1	Very high	94.5	Very high	26 Å²	26	13.3 Å²	13.3	11%	0.114	6%	0.063	C	C	.	.	H	α-helix	trans	-63.2	-41.6	176.4	-60.9	-32.4	0	0	0	112.7	G102 F103 A109 G110 L162 A165 Y166 Y169 F176	G102-F106 VanDerWaalsContact O-CD2 3.26Å; G102-F106 WeakPolarHBondContact O-CD2 3.4Å; G102-F106 VanDerWaalsContact O-CG 3.29Å; G102-F106 WeakPolarHBondContact O-CG 3.33Å; G102-F106 PolarHBondContact O-N 3.41Å; F103-F106 PolarHBondContact O-N 3.26Å; F103-F106 VanDerWaalsContact O-N 3.16Å; F106-A109 WeakPolarHBondContact O-CB 3.34Å; F106-A109 PolarHBondContact O-N 3.37Å; F106-G110 PolarHBondContact O-N 3.25Å; F106-G110 VanDerWaalsContact O-N 3.07Å; F106-L162 HydrophobicContact CZ-CD2 4.13Å; F106-A165 HydrophobicContact CD2-CB 4.06Å; F106-A165 HydrophobicContact CE2-CB 3.82Å; F106-Y166 HydrophobicContact CE2-CD2 4.49Å; F106-Y169 HydrophobicContact CB-CD1 4.4Å; F106-Y169 HydrophobicContact CB-CD2 3.95Å; F106-Y169 HydrophobicContact CB-CE2 4.4Å; F106-Y169 HydrophobicContact CB-CG 3.96Å; F106-Y169 WeakPolarHBondContact O-CE2 3.31Å; F106-F176 HydrophobicContact CB-CE1 3.85Å; F106-F176 HydrophobicContact CB-CZ 3.72Å; F106-F176 HydrophobicContact CD1-CE1 4.33Å; F106-F176 HydrophobicContact CD1-CE2 4.19Å; F106-F176 AromaticContact CD1-CZ 3.54Å; F106-F176 HydrophobicContact CD1-CZ 3.54Å; F106-F176 HydrophobicContact CE1-CZ 4.35Å; F106-F176 HydrophobicContact CG-CE1 4.38Å; F106-F176 AromaticContact CG-CZ 3.76Å; F106-F176 HydrophobicContact CG-CZ 3.76Å; F106-F176 WeakPolarHBondContact O-CE1 3.12Å
107	Y	94.9	Very high	93.9	Very high	3 Å²	3	18.6 Å²	18.6	1%	0.012	9%	0.092	C	C	.	.	H	α-helix	trans	-60	-47.9	175.6	178.2	-103.2	0	0	0	111.6	I13 V16 A30 F103 T104 S105 A109 G110 K111 Y173	I13-Y107 HydrophobicContact CG1-CD1 4.37Å; I13-Y107 HydrophobicContact CG1-CE1 4.01Å; V16-Y107 HydrophobicContact CB-CE1 4.14Å; V16-Y107 HydrophobicContact CG1-CE1 4.16Å; V16-Y107 HydrophobicContact CG2-CE1 4.03Å; A30-Y107 HydrophobicContact CB-CD2 4.44Å; A30-Y107 HydrophobicContact CB-CE2 3.84Å; F103-Y107 WeakPolarHBondContact O-CB 3.39Å; F103-Y107 PolarHBondContact O-N 3.02Å; T104-Y107 PolarHBondContact O-N 3.47Å; S105-Y107 PolarHBondContact O-N 2.9Å; Y107-A109 VanDerWaalsContact C-N 3.34Å; Y107-A109 PolarHBondContact O-N 3.41Å; Y107-G110 PolarHBondContact O-N 2.95Å; Y107-K111 HydrophobicContact CD1-CG 4.31Å; Y107-K111 HydrophobicContact CD2-CG 4.34Å; Y107-K111 HydrophobicContact CE1-CG 3.92Å; Y107-K111 HydrophobicContact CE2-CD 4.48Å; Y107-K111 HydrophobicContact CE2-CG 3.95Å; Y107-K111 WeakPolarHBondContact O-CB 3.37Å; Y107-K111 WeakPolarHBondContact O-CG 3.44Å; Y107-K111 PolarHBondContact O-N 2.9Å; Y107-K111 WeakPolarHBondContact OH-CE 3.44Å; Y107-Y173 HydrophobicContact CD2-CE2 4.45Å
108	L	94.4	Very high	93	Very high	22 Å²	22	20.6 Å²	20.6	12%	0.115	11%	0.113	C	C	.	.	H	α-helix	trans	-64.5	-37.2	175.2	-71.9	176.4	0	0	0	112.1	V12 V16 T104 S105 G110 K111 L112 P132	V12-L108 HydrophobicContact CG1-CD1 4.26Å; V12-L108 HydrophobicContact CG1-CD2 3.83Å; V12-L108 HydrophobicContact CG1-CG 4.11Å; V16-L108 HydrophobicContact CG2-CD2 4.07Å; T104-L108 HydrophobicContact CG2-CD1 4.2Å; T104-L108 HydrophobicContact CG2-CG 4.49Å; T104-L108 WeakPolarHBondContact O-CB 3.3Å; T104-L108 WeakPolarHBondContact O-CG 3.37Å; T104-L108 PolarHBondContact O-N 3.01Å; S105-L108 PolarHBondContact O-N 3.4Å; L108-G110 VanDerWaalsContact C-N 3.3Å; L108-G110 PolarHBondContact O-N 3.28Å; L108-K111 PolarHBondContact O-N 3.02Å; L108-L112 VanDerWaalsContact O-CB 3.25Å; L108-L112 WeakPolarHBondContact O-CB 3.33Å; L108-L112 WeakPolarHBondContact O-CG 3.32Å; L108-L112 PolarHBondContact O-N 3.43Å; L108-P132 HydrophobicContact CD1-CG 4.18Å
109	A	94.4	Very high	92	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-57	-45.4	175.8	0	0	0	0	0	111.6	S105 F106 Y107 Q113 C114 F115 M129 F176	S105-A109 WeakPolarHBondContact O-CB 3.1Å; S105-A109 PolarHBondContact O-N 3.34Å; F106-A109 WeakPolarHBondContact O-CB 3.34Å; F106-A109 PolarHBondContact O-N 3.37Å; Y107-A109 VanDerWaalsContact C-N 3.34Å; Y107-A109 PolarHBondContact O-N 3.41Å; A109-Q113 PolarHBondContact O-N 2.95Å; A109-Q113 VanDerWaalsContact O-N 3.14Å; A109-C114 PolarHBondContact O-N 2.99Å; A109-F115 HydrophobicContact CB-CE2 4.33Å; A109-M129 HydrophobicContact CB-CE 4.16Å; A109-M129 HydrophobicContact CB-CG 3.7Å; A109-F176 HydrophobicContact CB-CD1 3.96Å; A109-F176 HydrophobicContact CB-CE1 4.09Å
110	G	92.9	Very high	91.4	Very high	1 Å²	1	28.5 Å²	28.5	1%	0.01	14%	0.143	C	C	.	.	H	α-helix	trans	-67.8	-49.5	175.8	0	0	0	0	0	112.5	F106 Y107 L108 L112 Q113 C181 H182	F106-G110 PolarHBondContact O-N 3.25Å; F106-G110 VanDerWaalsContact O-N 3.07Å; Y107-G110 PolarHBondContact O-N 2.95Å; L108-G110 VanDerWaalsContact C-N 3.3Å; L108-G110 PolarHBondContact O-N 3.28Å; G110-L112 PolarHBondContact O-N 3.38Å; G110-Q113 PolarHBondContact O-N 3.32Å; G110-Q113 VanDerWaalsContact O-N 3.1Å; G110-C181 PolarHBondContact O-SG 3.31Å; G110-C181 VanDerWaalsContact O-SG 3.4Å; G110-H182 WeakPolarHBondContact O-CA 3.37Å; G110-H182 WeakPolarHBondContact O-CB 3.32Å
111	K	92.7	Very high	90.9	Very high	11 Å²	11	32.2 Å²	32.2	5%	0.048	18%	0.181	C	C	.	.	H	α-helix	trans	-67.8	-30.8	-176.8	-73.1	-59.1	-165.6	-179	0	114.8	V16 Q20 E26 Y107 L108 H182	V16-K111 HydrophobicContact CG1-CD 4.38Å; V16-K111 HydrophobicContact CG1-CG 4.19Å; Q20-K111 PolarHBondContact NE2-O 3.38Å; E26-K111 VanDerWaalsContact CD-NZ 3.33Å; E26-K111 IonicContact OE1-NZ 3.47Å; E26-K111 PolarHBondContact OE1-NZ 3.41Å; E26-K111 IonicContact OE2-NZ 2.62Å; E26-K111 PolarHBondContact OE2-NZ 2.67Å; Y107-K111 HydrophobicContact CD1-CG 4.31Å; Y107-K111 HydrophobicContact CD2-CG 4.34Å; Y107-K111 HydrophobicContact CE1-CG 3.92Å; Y107-K111 HydrophobicContact CE2-CD 4.48Å; Y107-K111 HydrophobicContact CE2-CG 3.95Å; Y107-K111 WeakPolarHBondContact O-CB 3.37Å; Y107-K111 WeakPolarHBondContact O-CG 3.44Å; Y107-K111 PolarHBondContact O-N 2.9Å; Y107-K111 WeakPolarHBondContact OH-CE 3.44Å; L108-K111 PolarHBondContact O-N 3.02Å; K111-H182 HydrophobicContact CD-CB 4.41Å; K111-H182 WeakPolarHBondContact CD-O 3.34Å; K111-H182 VanDerWaalsContact CE-O 3.3Å; K111-H182 WeakPolarHBondContact CE-O 3.04Å; K111-H182 PolarHBondContact NZ-O 3.42Å
112	L	91.8	Very high	90.6	Very high	25 Å²	25	38.4 Å²	38.4	13%	0.131	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-3	174.4	-60.5	177.5	0	0	0	112	L108 G110 C114 W124 R125 A128	L108-L112 VanDerWaalsContact O-CB 3.25Å; L108-L112 WeakPolarHBondContact O-CB 3.33Å; L108-L112 WeakPolarHBondContact O-CG 3.32Å; L108-L112 PolarHBondContact O-N 3.43Å; G110-L112 PolarHBondContact O-N 3.38Å; L112-C114 VanDerWaalsContact C-N 3.25Å; L112-C114 PolarHBondContact O-N 3.33Å; L112-W124 HydrophobicContact CD1-CZ3 4.3Å; L112-W124 HydrophobicContact CD2-CH2 3.99Å; L112-W124 HydrophobicContact CD2-CZ3 4.17Å; L112-R125 HydrophobicContact CB-CB 4.19Å; L112-R125 HydrophobicContact CB-CG 4.25Å; L112-R125 HydrophobicContact CD1-CB 4.36Å; L112-R125 VanDerWaalsContact O-CD 3.24Å; L112-R125 WeakPolarHBondContact O-CD 3.27Å; L112-R125 PolarHBondContact O-NH1 3.42Å; L112-A128 HydrophobicContact CD1-CB 3.8Å
113	Q	91.2	Very high	90.4	Very high	48 Å²	48	42.7 Å²	42.7	22%	0.224	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.8	44.3	179.7	-75.8	-178.5	-57	0	0	111.6	A109 G110 F115 T116 G119 M179 H182	A109-Q113 PolarHBondContact O-N 2.95Å; A109-Q113 VanDerWaalsContact O-N 3.14Å; G110-Q113 PolarHBondContact O-N 3.32Å; G110-Q113 VanDerWaalsContact O-N 3.1Å; Q113-F115 PolarHBondContact O-N 3.28Å; Q113-F115 VanDerWaalsContact O-N 3.09Å; Q113-T116 WeakPolarHBondContact CB-OG1 3.35Å; Q113-T116 PolarHBondContact O-N 3.01Å; Q113-G119 VanDerWaalsContact O-CA 3.26Å; Q113-G119 WeakPolarHBondContact O-CA 3.33Å; Q113-M179 PolarHBondContact NE2-O 2.62Å; Q113-H182 HydrophobicContact CG-CB 4.29Å
114	C	90.1	Very high	90.2	Very high	13 Å²	13	49.9 Å²	49.9	9%	0.088	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-27.9	-170.8	-68.8	0	0	0	0	113.7	A109 L112 R125	A109-C114 PolarHBondContact O-N 2.99Å; L112-C114 VanDerWaalsContact C-N 3.25Å; L112-C114 PolarHBondContact O-N 3.33Å; C114-R125 PolarHBondContact SG-O 3.3Å; C114-R125 VanDerWaalsContact SG-O 3.39Å
115	F	89.4	Confident	90	Very high	85 Å²	85	51.3 Å²	51.3	37%	0.373	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.1	7.6	-172.6	-56.4	-70.9	0	0	0	114.1	A109 Q113 L126 F176 L177	A109-F115 HydrophobicContact CB-CE2 4.33Å; Q113-F115 PolarHBondContact O-N 3.28Å; Q113-F115 VanDerWaalsContact O-N 3.09Å; F115-L126 HydrophobicContact CZ-CD1 4.39Å; F115-F176 HydrophobicContact CD2-CB 3.96Å; F115-L177 HydrophobicContact CB-CD2 3.98Å
116	T	89.4	Confident	89.8	Confident	1 Å²	1	55.4 Å²	55.4	1%	0.006	29%	0.288	C	S	.	.	S	Bend	trans	-103.3	165.1	174.3	72.6	0	0	0	0	110.6	Q113 G118 G119 R120 F176 H178 M179	Q113-T116 WeakPolarHBondContact CB-OG1 3.35Å; Q113-T116 PolarHBondContact O-N 3.01Å; T116-G118 PolarHBondContact O-N 2.98Å; T116-G118 VanDerWaalsContact O-N 3.1Å; T116-G119 PolarHBondContact O-N 3.46Å; T116-R120 WeakPolarHBondContact O-CB 3.47Å; T116-R120 PolarHBondContact O-N 2.87Å; T116-F176 WeakPolarHBondContact CG2-O 3.09Å; T116-H178 VanDerWaalsContact CG2-O 3.32Å; T116-H178 WeakPolarHBondContact CG2-O 3.49Å; T116-M179 HydrophobicContact CG2-CE 4.01Å
117	D	83.8	Confident	89.7	Confident	127 Å²	127	58.1 Å²	58.1	68%	0.679	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-25.1	-180	-62.9	-38.4	0	0	0	113	G119	D117-G119 VanDerWaalsContact C-N 3.27Å; D117-G119 PolarHBondContact O-N 2.98Å
118	G	76.4	Confident	89.7	Confident	42 Å²	42	59.6 Å²	59.6	43%	0.433	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-13.5	175.6	0	0	0	0	0	115.2	T116 R125	T116-G118 PolarHBondContact O-N 2.98Å; T116-G118 VanDerWaalsContact O-N 3.1Å; G118-R125 PolarHBondContact O-NH1 3.4Å
119	G	77.6	Confident	89.7	Confident	2 Å²	2	59.4 Å²	59.4	2%	0.021	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-140.4	-8.5	-177.2	0	0	0	0	0	117.4	Q113 T116 D117 R122	Q113-G119 VanDerWaalsContact O-CA 3.26Å; Q113-G119 WeakPolarHBondContact O-CA 3.33Å; T116-G119 PolarHBondContact O-N 3.46Å; D117-G119 VanDerWaalsContact C-N 3.27Å; D117-G119 PolarHBondContact O-N 2.98Å; G119-R122 PolarHBondContact O-N 3.22Å
120	R	84.8	Confident	89.7	Confident	184 Å²	184	62.6 Å²	62.6	69%	0.694	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	143.5	177.6	-155.8	164.6	76.2	146.6	2.6	111	T116	T116-R120 WeakPolarHBondContact O-CB 3.47Å; T116-R120 PolarHBondContact O-N 2.87Å
121	G	86.3	Confident	89.8	Confident	79 Å²	79	67.8 Å²	67.8	81%	0.814	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	86	-4.2	-179.2	0	0	0	0	0	115.7
122	R	90.2	Very high	90	Very high	134 Å²	134	67.8 Å²	67.8	51%	0.506	37%	0.368	S	S	.	.			trans	-99.9	91.6	176.9	-61.1	179.4	-174.3	-171.6	0.1	111.2	G119 W124 R125	G119-R122 PolarHBondContact O-N 3.22Å; R122-W124 PolarHBondContact O-N 3.11Å; R122-W124 VanDerWaalsContact O-N 3.1Å; R122-R125 HydrophobicContact CB-CG 4.16Å; R122-R125 WeakPolarHBondContact O-CB 3.36Å; R122-R125 PolarHBondContact O-N 2.96Å
123	S	91.8	Very high	90.2	Very high	91 Å²	91	68.6 Å²	68.6	64%	0.636	37%	0.373	S	S	*	.	H	α-helix	trans	-54.1	-34.4	-173.1	-52.8	0	0	0	0	114.7	R125 L126 C127	S123-R125 PolarHBondContact O-N 3.3Å; S123-L126 WeakPolarHBondContact O-CB 3.39Å; S123-L126 PolarHBondContact O-N 3.21Å; S123-L126 VanDerWaalsContact O-N 3.11Å; S123-C127 PolarHBondContact O-N 2.64Å; S123-C127 PolarHBondContact O-SG 2.9Å; S123-C127 VanDerWaalsContact O-SG 3.39Å
124	W	93.6	Very high	90.4	Very high	150 Å²	150	73.2 Å²	73.2	57%	0.568	39%	0.389	S	S	*	.	H	α-helix	trans	-59.5	-31.4	179.3	75.7	-97.7	0	0	0	113	L112 R122 C127 A128	L112-W124 HydrophobicContact CD1-CZ3 4.3Å; L112-W124 HydrophobicContact CD2-CH2 3.99Å; L112-W124 HydrophobicContact CD2-CZ3 4.17Å; R122-W124 PolarHBondContact O-N 3.11Å; R122-W124 VanDerWaalsContact O-N 3.1Å; W124-C127 PolarHBondContact O-N 3.5Å; W124-A128 WeakPolarHBondContact O-CB 3.45Å; W124-A128 PolarHBondContact O-N 3.01Å
125	R	92.4	Very high	90.6	Very high	33 Å²	33	74.8 Å²	74.8	13%	0.125	40%	0.4	C	S	.	.	H	α-helix	trans	-69.1	-40.3	177.9	-63.5	-175.4	167.1	-175.1	7.5	111.2	L112 C114 G118 R122 S123 A128 M129	L112-R125 HydrophobicContact CB-CB 4.19Å; L112-R125 HydrophobicContact CB-CG 4.25Å; L112-R125 HydrophobicContact CD1-CB 4.36Å; L112-R125 VanDerWaalsContact O-CD 3.24Å; L112-R125 WeakPolarHBondContact O-CD 3.27Å; L112-R125 PolarHBondContact O-NH1 3.42Å; C114-R125 PolarHBondContact SG-O 3.3Å; C114-R125 VanDerWaalsContact SG-O 3.39Å; G118-R125 PolarHBondContact O-NH1 3.4Å; R122-R125 HydrophobicContact CB-CG 4.16Å; R122-R125 WeakPolarHBondContact O-CB 3.36Å; R122-R125 PolarHBondContact O-N 2.96Å; S123-R125 PolarHBondContact O-N 3.3Å; R125-A128 PolarHBondContact O-N 3.4Å; R125-M129 WeakPolarHBondContact O-CB 3.38Å; R125-M129 PolarHBondContact O-N 3.47Å
126	L	92	Very high	90.9	Very high	86 Å²	86	70.8 Å²	70.8	45%	0.45	38%	0.383	S	S	.	.	H	α-helix	trans	-64.8	-45.2	173.2	-177.4	64.9	0	0	0	110.8	F115 S123 A128 M129 V130	F115-L126 HydrophobicContact CZ-CD1 4.39Å; S123-L126 WeakPolarHBondContact O-CB 3.39Å; S123-L126 PolarHBondContact O-N 3.21Å; S123-L126 VanDerWaalsContact O-N 3.11Å; L126-A128 VanDerWaalsContact C-N 3.32Å; L126-A128 PolarHBondContact O-N 2.92Å; L126-M129 HydrophobicContact CD1-SD 4.5Å; L126-M129 PolarHBondContact O-N 3.42Å; L126-M129 VanDerWaalsContact O-N 3.15Å; L126-V130 HydrophobicContact CD1-CG2 4.06Å; L126-V130 HydrophobicContact CG-CG2 4.24Å; L126-V130 WeakPolarHBondContact O-CB 3.45Å; L126-V130 WeakPolarHBondContact O-CG2 3.49Å; L126-V130 PolarHBondContact O-N 3.47Å
127	C	94.5	Very high	91.2	Very high	84 Å²	84	75 Å²	75	57%	0.568	40%	0.403	S	S	*	.	H	α-helix	trans	-58.5	-44.4	176.3	-65	0	0	0	0	111.8	S123 W124 M129 V130 L131	S123-C127 PolarHBondContact O-N 2.64Å; S123-C127 PolarHBondContact O-SG 2.9Å; S123-C127 VanDerWaalsContact O-SG 3.39Å; W124-C127 PolarHBondContact O-N 3.5Å; C127-M129 VanDerWaalsContact C-N 3.31Å; C127-M129 PolarHBondContact O-N 2.87Å; C127-V130 PolarHBondContact O-N 3.47Å; C127-L131 WeakPolarHBondContact O-CB 3.17Å; C127-L131 PolarHBondContact O-N 3.46Å
128	A	93.8	Very high	91.8	Very high	34 Å²	34	73.3 Å²	73.3	28%	0.281	39%	0.392	S	S	.	.	H	α-helix	trans	-61.6	-38.6	176.6	0	0	0	0	0	112.4	L112 W124 R125 L126 P132	L112-A128 HydrophobicContact CD1-CB 3.8Å; W124-A128 WeakPolarHBondContact O-CB 3.45Å; W124-A128 PolarHBondContact O-N 3.01Å; R125-A128 PolarHBondContact O-N 3.4Å; L126-A128 VanDerWaalsContact C-N 3.32Å; L126-A128 PolarHBondContact O-N 2.92Å; A128-P132 WeakPolarHBondContact O-CD 3.18Å
129	M	94.2	Very high	92.7	Very high	17 Å²	17	72.4 Å²	72.4	8%	0.084	38%	0.378	C	S	.	.	H	α-helix	trans	-70.7	-38.8	176.5	176.7	-89.2	179.8	0	0	112.8	S105 A109 R125 L126 C127 P132 L133	S105-M129 VanDerWaalsContact CB-O 3.29Å; S105-M129 WeakPolarHBondContact CB-O 3.19Å; S105-M129 WeakPolarHBondContact O-CG 3.48Å; S105-M129 VanDerWaalsContact OG-CE 3.3Å; S105-M129 WeakPolarHBondContact OG-CE 3.26Å; S105-M129 PolarHBondContact OG-O 3Å; A109-M129 HydrophobicContact CB-CE 4.16Å; A109-M129 HydrophobicContact CB-CG 3.7Å; R125-M129 WeakPolarHBondContact O-CB 3.38Å; R125-M129 PolarHBondContact O-N 3.47Å; L126-M129 HydrophobicContact CD1-SD 4.5Å; L126-M129 PolarHBondContact O-N 3.42Å; L126-M129 VanDerWaalsContact O-N 3.15Å; C127-M129 VanDerWaalsContact C-N 3.31Å; C127-M129 PolarHBondContact O-N 2.87Å; M129-P132 WeakPolarHBondContact O-CD 3.45Å; M129-L133 HydrophobicContact CE-CD1 4.46Å
130	V	95.4	Very high	93.5	Very high	67 Å²	67	72.6 Å²	72.6	41%	0.406	38%	0.379	S	S	.	.	H	α-helix	trans	-76.7	-30.1	-178	170.1	0	0	0	0	112.3	L126 C127 L133 Y134	L126-V130 HydrophobicContact CD1-CG2 4.06Å; L126-V130 HydrophobicContact CG-CG2 4.24Å; L126-V130 WeakPolarHBondContact O-CB 3.45Å; L126-V130 WeakPolarHBondContact O-CG2 3.49Å; L126-V130 PolarHBondContact O-N 3.47Å; C127-V130 PolarHBondContact O-N 3.47Å; V130-L133 WeakPolarHBondContact O-CB 3.44Å; V130-L133 PolarHBondContact O-N 3.43Å; V130-Y134 PolarHBondContact O-N 2.73Å
131	L	95.4	Very high	94	Very high	110 Å²	110	67.9 Å²	67.9	58%	0.576	37%	0.367	S	S	*	.	H	α-helix	trans	-55.3	-46.1	-174.7	-178	144.7	0	0	0	113.9	C127 L133 Y134 S135	C127-L131 WeakPolarHBondContact O-CB 3.17Å; C127-L131 PolarHBondContact O-N 3.46Å; L131-L133 VanDerWaalsContact C-N 3.34Å; L131-L133 PolarHBondContact O-N 3.06Å; L131-Y134 WeakPolarHBondContact O-CB 3.22Å; L131-Y134 PolarHBondContact O-N 2.89Å; L131-S135 PolarHBondContact O-N 3.46Å; L131-S135 PolarHBondContact O-OG 2.9Å
132	P	95.3	Very high	94.3	Very high	11 Å²	11	65.9 Å²	65.9	7%	0.071	34%	0.34	C	S	.	.	H	α-helix	trans	-58.8	-39.6	173	-25.9	33.9	0	0	0	114	L101 T104 L108 A128 M129 S135 A136	L101-P132 HydrophobicContact CB-CB 4.13Å; L101-P132 WeakPolarHBondContact CB-O 3.38Å; L101-P132 WeakPolarHBondContact O-CB 3.46Å; T104-P132 HydrophobicContact CG2-CB 4.36Å; T104-P132 HydrophobicContact CG2-CG 4.03Å; L108-P132 HydrophobicContact CD1-CG 4.18Å; A128-P132 WeakPolarHBondContact O-CD 3.18Å; M129-P132 WeakPolarHBondContact O-CD 3.45Å; P132-S135 PolarHBondContact O-N 3.44Å; P132-A136 PolarHBondContact O-N 2.93Å
133	L	95.8	Very high	94.4	Very high	42 Å²	42	62.2 Å²	62.2	22%	0.22	33%	0.327	C	S	.	.	H	α-helix	trans	-67	-40	177	-72.6	173	0	0	0	111.5	F98 S105 M129 V130 L131 S135 A136 M137 L162	F98-L133 HydrophobicContact CD1-CD2 4.39Å; S105-L133 VanDerWaalsContact OG-CD1 3.32Å; S105-L133 WeakPolarHBondContact OG-CD1 3.21Å; S105-L133 WeakPolarHBondContact OG-CG 3.3Å; M129-L133 HydrophobicContact CE-CD1 4.46Å; V130-L133 WeakPolarHBondContact O-CB 3.44Å; V130-L133 PolarHBondContact O-N 3.43Å; L131-L133 VanDerWaalsContact C-N 3.34Å; L131-L133 PolarHBondContact O-N 3.06Å; L133-S135 VanDerWaalsContact C-N 3.35Å; L133-A136 WeakPolarHBondContact O-CB 3.2Å; L133-A136 PolarHBondContact O-N 3.01Å; L133-M137 PolarHBondContact O-N 3.41Å; L133-L162 HydrophobicContact CD2-CD2 3.76Å
134	Y	96.3	Very high	94.4	Very high	145 Å²	145	60.1 Å²	60.1	57%	0.569	31%	0.31	S	S	*	.	H	α-helix	trans	-61.1	-45	173.7	-179.6	-103	0	0	0	111.1	V130 L131 A136 M137 M138	V130-Y134 PolarHBondContact O-N 2.73Å; L131-Y134 WeakPolarHBondContact O-CB 3.22Å; L131-Y134 PolarHBondContact O-N 2.89Å; Y134-A136 VanDerWaalsContact C-N 3.32Å; Y134-A136 PolarHBondContact O-N 3.3Å; Y134-M137 WeakPolarHBondContact O-CB 3.2Å; Y134-M137 PolarHBondContact O-N 3.27Å; Y134-M137 VanDerWaalsContact O-N 3.14Å; Y134-M138 HydrophobicContact CD1-CG 4.27Å; Y134-M138 HydrophobicContact CE1-CG 3.87Å; Y134-M138 HydrophobicContact CE1-SD 4.26Å; Y134-M138 HydrophobicContact CE2-SD 4.16Å; Y134-M138 WeakPolarHBondContact O-CG 3.33Å; Y134-M138 PolarHBondContact O-N 2.88Å
135	S	94.9	Very high	94.3	Very high	47 Å²	47	57.3 Å²	57.3	33%	0.329	31%	0.312	S	S	.	.	H	α-helix	trans	-59.7	-40.3	173.9	-58.2	0	0	0	0	112.5	L131 P132 L133 M137 M138 I139	L131-S135 PolarHBondContact O-N 3.46Å; L131-S135 PolarHBondContact O-OG 2.9Å; P132-S135 PolarHBondContact O-N 3.44Å; L133-S135 VanDerWaalsContact C-N 3.35Å; S135-M137 VanDerWaalsContact C-N 3.33Å; S135-M137 PolarHBondContact O-N 3.49Å; S135-M138 PolarHBondContact O-N 3.08Å; S135-I139 WeakPolarHBondContact O-CG1 3.39Å; S135-I139 PolarHBondContact O-N 3.18Å; S135-I139 VanDerWaalsContact O-N 3.08Å
136	A	96	Very high	94.3	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-62.3	-40.7	174.6	0	0	0	0	0	112.2	A97 F98 L101 P132 L133 Y134 I139 A140	A97-A136 HydrophobicContact CB-CB 4.24Å; F98-A136 HydrophobicContact CD1-CB 3.99Å; F98-A136 HydrophobicContact CD2-CB 4.27Å; F98-A136 HydrophobicContact CE1-CB 4.06Å; F98-A136 HydrophobicContact CE2-CB 4.34Å; F98-A136 HydrophobicContact CG-CB 4.11Å; F98-A136 HydrophobicContact CZ-CB 4.24Å; L101-A136 HydrophobicContact CB-CB 4.09Å; L101-A136 HydrophobicContact CD1-CB 3.89Å; P132-A136 PolarHBondContact O-N 2.93Å; L133-A136 WeakPolarHBondContact O-CB 3.2Å; L133-A136 PolarHBondContact O-N 3.01Å; Y134-A136 VanDerWaalsContact C-N 3.32Å; Y134-A136 PolarHBondContact O-N 3.3Å; A136-I139 WeakPolarHBondContact O-CB 3.46Å; A136-I139 PolarHBondContact O-N 3.14Å; A136-A140 PolarHBondContact O-N 3.09Å
137	M	95.8	Very high	94.1	Very high	90 Å²	90	63.3 Å²	63.3	44%	0.443	34%	0.336	S	S	.	.	H	α-helix	trans	-62.1	-45.9	175.1	-176.1	61.4	78	0	0	111.6	F98 L133 Y134 S135 I139 A140 L141	F98-M137 HydrophobicContact CZ-CB 4.36Å; F98-M137 HydrophobicContact CZ-CE 4.13Å; F98-M137 HydrophobicContact CZ-SD 4.39Å; L133-M137 PolarHBondContact O-N 3.41Å; Y134-M137 WeakPolarHBondContact O-CB 3.2Å; Y134-M137 PolarHBondContact O-N 3.27Å; Y134-M137 VanDerWaalsContact O-N 3.14Å; S135-M137 VanDerWaalsContact C-N 3.33Å; S135-M137 PolarHBondContact O-N 3.49Å; M137-I139 VanDerWaalsContact C-N 3.26Å; M137-I139 PolarHBondContact O-N 3.07Å; M137-A140 PolarHBondContact O-N 3.47Å; M137-A140 VanDerWaalsContact O-N 3.08Å; M137-L141 HydrophobicContact CG-CD1 4.03Å; M137-L141 HydrophobicContact CG-CG 4.33Å; M137-L141 WeakPolarHBondContact O-CG 3.45Å; M137-L141 PolarHBondContact O-N 3.49Å; M137-L141 HydrophobicContact SD-CD1 4.47Å; M137-L141 HydrophobicContact SD-CG 4.26Å
138	M	95.8	Very high	93.9	Very high	91 Å²	91	62.5 Å²	62.5	45%	0.448	32%	0.323	S	S	.	.	H	α-helix	trans	-59.5	-38.9	177.2	-65	-50.6	-63.7	0	0	112	Y134 S135 S142	Y134-M138 HydrophobicContact CD1-CG 4.27Å; Y134-M138 HydrophobicContact CE1-CG 3.87Å; Y134-M138 HydrophobicContact CE1-SD 4.26Å; Y134-M138 HydrophobicContact CE2-SD 4.16Å; Y134-M138 WeakPolarHBondContact O-CG 3.33Å; Y134-M138 PolarHBondContact O-N 2.88Å; S135-M138 PolarHBondContact O-N 3.08Å; M138-S142 PolarHBondContact O-N 3.39Å
139	I	94.4	Very high	93.9	Very high	24 Å²	24	61 Å²	61	12%	0.123	31%	0.31	C	S	.	.	H	α-helix	trans	-62.4	-46.8	173.5	-71.2	170.3	0	0	0	111.1	M1 I4 A97 L101 S135 A136 M137 S142	M1-I139 HydrophobicContact CE-CB 4.12Å; M1-I139 HydrophobicContact CE-CD1 4.13Å; M1-I139 HydrophobicContact CE-CG1 3.9Å; M1-I139 HydrophobicContact CE-CG2 3.25Å; M1-I139 HydrophobicContact SD-CD1 4.11Å; M1-I139 HydrophobicContact SD-CG1 4.47Å; M1-I139 HydrophobicContact SD-CG2 3.54Å; M1-I139 VanDerWaalsContact SD-CG2 3.54Å; I4-I139 HydrophobicContact CG2-CD1 4.4Å; A97-I139 HydrophobicContact CB-CB 4.15Å; A97-I139 HydrophobicContact CB-CD1 4.12Å; A97-I139 HydrophobicContact CB-CG2 3.72Å; L101-I139 HydrophobicContact CD1-CD1 4.09Å; S135-I139 WeakPolarHBondContact O-CG1 3.39Å; S135-I139 PolarHBondContact O-N 3.18Å; S135-I139 VanDerWaalsContact O-N 3.08Å; A136-I139 WeakPolarHBondContact O-CB 3.46Å; A136-I139 PolarHBondContact O-N 3.14Å; M137-I139 VanDerWaalsContact C-N 3.26Å; M137-I139 PolarHBondContact O-N 3.07Å; I139-S142 PolarHBondContact O-N 3.28Å; I139-S142 PolarHBondContact O-OG 3.09Å
140	A	94.8	Very high	94	Very high	5 Å²	5	62.9 Å²	62.9	4%	0.041	32%	0.319	C	S	.	.	H	α-helix	trans	-64.3	-42.5	179.8	0	0	0	0	0	112.2	S94 F98 A136 M137 S142 R143	S94-A140 WeakPolarHBondContact OG-CB 3.36Å; F98-A140 HydrophobicContact CE2-CB 3.91Å; A136-A140 PolarHBondContact O-N 3.09Å; M137-A140 PolarHBondContact O-N 3.47Å; M137-A140 VanDerWaalsContact O-N 3.08Å; A140-S142 PolarHBondContact O-N 3.03Å; A140-R143 PolarHBondContact O-N 2.84Å
141	L	94.7	Very high	93.9	Very high	85 Å²	85	67.6 Å²	67.6	45%	0.445	33%	0.329	S	S	.	.	H	α-helix	trans	-63.1	-41.3	177.2	-70.9	174.6	0	0	0	111.8	M137 R143 T144 C145	M137-L141 HydrophobicContact CG-CD1 4.03Å; M137-L141 HydrophobicContact CG-CG 4.33Å; M137-L141 WeakPolarHBondContact O-CG 3.45Å; M137-L141 PolarHBondContact O-N 3.49Å; M137-L141 HydrophobicContact SD-CD1 4.47Å; M137-L141 HydrophobicContact SD-CG 4.26Å; L141-R143 PolarHBondContact O-N 3.39Å; L141-R143 VanDerWaalsContact O-N 3.1Å; L141-T144 WeakPolarHBondContact O-CB 3.33Å; L141-T144 PolarHBondContact O-N 3.36Å; L141-C145 PolarHBondContact O-N 3.1Å; L141-C145 PolarHBondContact O-SG 3.01Å; L141-C145 VanDerWaalsContact O-SG 3.41Å
142	S	94.1	Very high	94	Very high	37 Å²	37	65.3 Å²	65.3	26%	0.259	32%	0.316	S	S	.	.	H	α-helix	trans	-53.7	-35.9	177.5	75.9	0	0	0	0	112.7	M138 I139 A140 T144 C145 D146	M138-S142 PolarHBondContact O-N 3.39Å; I139-S142 PolarHBondContact O-N 3.28Å; I139-S142 PolarHBondContact O-OG 3.09Å; A140-S142 PolarHBondContact O-N 3.03Å; S142-T144 VanDerWaalsContact C-N 3.31Å; S142-T144 PolarHBondContact O-N 3.02Å; S142-C145 PolarHBondContact O-N 3.4Å; S142-D146 WeakPolarHBondContact O-CB 3.34Å; S142-D146 PolarHBondContact O-N 3.46Å
143	R	92.1	Very high	94.1	Very high	57 Å²	57	64.8 Å²	64.8	22%	0.215	31%	0.312	C	S	.	.	H	α-helix	trans	-73	-24	-180	-66.1	-57.2	89.2	162.3	-3.4	114.1	H93 A140 L141 D146 K148 H149	H93-R143 HydrophobicContact CB-CG 3.75Å; A140-R143 PolarHBondContact O-N 2.84Å; L141-R143 PolarHBondContact O-N 3.39Å; L141-R143 VanDerWaalsContact O-N 3.1Å; R143-D146 IonicContact CZ-OD2 3.7Å; R143-D146 IonicContact NE-OD2 3.04Å; R143-D146 IonicContact NH2-OD2 2.92Å; R143-D146 PolarHBondContact NH2-OD2 3.09Å; R143-K148 PolarHBondContact O-N 2.97Å; R143-K148 VanDerWaalsContact O-N 3.09Å; R143-H149 HydrophobicContact CB-CB 4.42Å; R143-H149 PolarHBondContact O-N 3.23Å; R143-H149 VanDerWaalsContact O-N 3.14Å
144	T	91.6	Very high	94.1	Very high	47 Å²	47	63.2 Å²	63.2	29%	0.288	31%	0.305	S	S	.	.	H	α-helix	trans	-79.1	-43.1	172.8	-50.7	0	0	0	0	109.5	L141 S142 D146 Y147 W151	L141-T144 WeakPolarHBondContact O-CB 3.33Å; L141-T144 PolarHBondContact O-N 3.36Å; S142-T144 VanDerWaalsContact C-N 3.31Å; S142-T144 PolarHBondContact O-N 3.02Å; T144-D146 VanDerWaalsContact C-N 3.31Å; T144-D146 PolarHBondContact O-N 2.96Å; T144-Y147 PolarHBondContact O-N 3.14Å; T144-Y147 VanDerWaalsContact O-N 3.14Å; T144-W151 HydrophobicContact CG2-CB 4.4Å
145	C	91.9	Very high	94.1	Very high	91 Å²	91	62.7 Å²	62.7	62%	0.615	31%	0.306	S	S	*	.	H	α-helix	trans	-60.3	-38.5	175.7	-60.5	0	0	0	0	112.8	L141 S142 Y147	L141-C145 PolarHBondContact O-N 3.1Å; L141-C145 PolarHBondContact O-SG 3.01Å; L141-C145 VanDerWaalsContact O-SG 3.41Å; S142-C145 PolarHBondContact O-N 3.4Å; C145-Y147 WeakPolarHBondContact O-CD2 3.43Å; C145-Y147 PolarHBondContact O-N 2.64Å
146	D	91.2	Very high	94.3	Very high	80 Å²	80	62.6 Å²	62.6	43%	0.428	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	10	179.6	-61.8	-25.8	0	0	0	113.5	S142 R143 T144 K148	S142-D146 WeakPolarHBondContact O-CB 3.34Å; S142-D146 PolarHBondContact O-N 3.46Å; R143-D146 IonicContact CZ-OD2 3.7Å; R143-D146 IonicContact NE-OD2 3.04Å; R143-D146 IonicContact NH2-OD2 2.92Å; R143-D146 PolarHBondContact NH2-OD2 3.09Å; T144-D146 VanDerWaalsContact C-N 3.31Å; T144-D146 PolarHBondContact O-N 2.96Å; D146-K148 HydrophobicContact CB-CG 3.97Å; D146-K148 PolarHBondContact O-N 3.35Å
147	Y	88.9	Confident	94.3	Very high	166 Å²	166	62.6 Å²	62.6	65%	0.651	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.7	24.2	-176.6	-64	-85.8	0	0	0	114.3	P57 T144 C145	P57-Y147 WeakPolarHBondContact CB-O 3.43Å; P57-Y147 WeakPolarHBondContact CD-O 3.46Å; P57-Y147 WeakPolarHBondContact CG-O 3.36Å; T144-Y147 PolarHBondContact O-N 3.14Å; T144-Y147 VanDerWaalsContact O-N 3.14Å; C145-Y147 WeakPolarHBondContact O-CD2 3.43Å; C145-Y147 PolarHBondContact O-N 2.64Å
148	K	89.6	Confident	94.4	Very high	66 Å²	66	58.5 Å²	58.5	29%	0.287	28%	0.284	S	S	.	.	S	Bend	trans	-84	-26.2	179.7	-66.6	-56.8	176	-172.1	0	112.3	R56 D58 R143 D146	R56-K148 WeakPolarHBondContact CG-O 3.35Å; R56-K148 PolarHBondContact NH1-O 3.42Å; D58-K148 IonicContact OD2-NZ 2.76Å; D58-K148 PolarHBondContact OD2-NZ 3.25Å; R143-K148 PolarHBondContact O-N 2.97Å; R143-K148 VanDerWaalsContact O-N 3.09Å; D146-K148 HydrophobicContact CB-CG 3.97Å; D146-K148 PolarHBondContact O-N 3.35Å
149	H	94.4	Very high	94.6	Very high	2 Å²	2	57.6 Å²	57.6	1%	0.009	28%	0.284	C	S	.	.	S	Bend	trans	-144.6	146.4	-176.1	-75.3	-67.9	0	0	0	110.1	R56 S88 S91 R143 D153	R56-H149 PolarHBondContact NH1-CE1 3.03Å; R56-H149 VanDerWaalsContact NH1-CE1 3.33Å; R56-H149 PolarHBondContact NH1-NE2 2.97Å; S88-H149 PolarHBondContact O-CE1 2.73Å; S88-H149 PolarHBondContact O-ND1 3.36Å; S91-H149 PolarHBondContact OG-CD2 2.88Å; S91-H149 VanDerWaalsContact OG-CD2 3.3Å; S91-H149 PolarHBondContact OG-NE2 3.49Å; R143-H149 HydrophobicContact CB-CB 4.42Å; R143-H149 PolarHBondContact O-N 3.23Å; R143-H149 VanDerWaalsContact O-N 3.14Å; H149-D153 HydrophobicContact CB-CB 4.08Å; H149-D153 IonicContact ND1-OD2 2.62Å
150	H	94.7	Very high	94.7	Very high	58 Å²	58	57.6 Å²	57.6	27%	0.269	28%	0.284	S	S	.	.			trans	-72.8	155.4	164.9	-54.7	82.7	0	0	0	108.9	R54 P55 Q152 D153 A154	R54-H150 PolarHBondContact NH2-CD2 2.89Å; R54-H150 PolarHBondContact NH2-ND1 2.9Å; P55-H150 PolarHBondContact O-CE1 3.36Å; H150-Q152 PolarHBondContact O-N 3.37Å; H150-Q152 VanDerWaalsContact O-N 3.14Å; H150-D153 IonicContact CG-OD2 3.87Å; H150-D153 PolarHBondContact N-OD2 2.88Å; H150-D153 IonicContact ND1-OD2 3.29Å; H150-D153 PolarHBondContact ND1-OD2 3.48Å; H150-D153 WeakPolarHBondContact O-CB 3.44Å; H150-D153 PolarHBondContact O-N 3.22Å; H150-A154 PolarHBondContact O-N 3.29Å
151	W	95	Very high	94.9	Very high	165 Å²	165	57.4 Å²	57.4	63%	0.625	28%	0.282	S	S	*	.	H	α-helix	trans	-58.1	-31.5	179.7	69.9	-97.1	0	0	0	112.5	T144 D153 A154 F155	T144-W151 HydrophobicContact CG2-CB 4.4Å; W151-D153 VanDerWaalsContact C-N 3.35Å; W151-D153 PolarHBondContact O-N 3.42Å; W151-A154 PolarHBondContact O-N 3.02Å; W151-F155 HydrophobicContact CE3-CB 4.46Å; W151-F155 WeakPolarHBondContact O-CB 3.48Å; W151-F155 PolarHBondContact O-N 3.33Å
152	Q	96.9	Very high	95.1	Very high	63 Å²	63	56 Å²	56	29%	0.294	28%	0.275	S	S	.	.	H	α-helix	trans	-66.1	-38.3	175.9	-51.6	91	-2.9	0	0	111.8	H150 A154 F155 V156	H150-Q152 PolarHBondContact O-N 3.37Å; H150-Q152 VanDerWaalsContact O-N 3.14Å; Q152-A154 VanDerWaalsContact C-N 3.27Å; Q152-A154 PolarHBondContact O-N 2.99Å; Q152-F155 PolarHBondContact O-N 3.36Å; Q152-V156 WeakPolarHBondContact O-CB 3.27Å; Q152-V156 WeakPolarHBondContact O-CG2 3.44Å; Q152-V156 PolarHBondContact O-N 3.1Å
153	D	96.9	Very high	95.3	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-62.4	-40.7	177.7	-52.6	-26.5	0	0	0	109.9	R54 S88 F89 S91 H149 H150 W151 G157	R54-D153 WeakPolarHBondContact CD-OD1 3.32Å; R54-D153 IonicContact CZ-OD1 3.52Å; R54-D153 IonicContact NE-OD1 3.8Å; R54-D153 IonicContact NH1-OD1 2.67Å; R54-D153 PolarHBondContact NH1-OD1 3.32Å; R54-D153 IonicContact NH1-OD2 3.98Å; S88-D153 PolarHBondContact OG-OD2 3.36Å; F89-D153 WeakPolarHBondContact CB-OD1 3.45Å; F89-D153 HydrophobicContact CD2-CB 4.44Å; F89-D153 VanDerWaalsContact CD2-OD1 3.3Å; F89-D153 WeakPolarHBondContact CD2-OD1 3.18Å; S91-D153 WeakPolarHBondContact CB-O 3.48Å; S91-D153 PolarHBondContact N-O 2.88Å; H149-D153 HydrophobicContact CB-CB 4.08Å; H149-D153 IonicContact ND1-OD2 2.62Å; H150-D153 IonicContact CG-OD2 3.87Å; H150-D153 PolarHBondContact N-OD2 2.88Å; H150-D153 IonicContact ND1-OD2 3.29Å; H150-D153 PolarHBondContact ND1-OD2 3.48Å; H150-D153 WeakPolarHBondContact O-CB 3.44Å; H150-D153 PolarHBondContact O-N 3.22Å; W151-D153 VanDerWaalsContact C-N 3.35Å; W151-D153 PolarHBondContact O-N 3.42Å; D153-G157 PolarHBondContact O-N 3.46Å; D153-G157 VanDerWaalsContact O-N 3.11Å
154	A	96.3	Very high	95.5	Very high	8 Å²	8	56.9 Å²	56.9	7%	0.066	28%	0.279	C	S	.	.	H	α-helix	trans	-69.1	-45.8	177.2	0	0	0	0	0	112	S94 H150 W151 Q152 G157 G158	S94-A154 VanDerWaalsContact CB-O 3.3Å; S94-A154 WeakPolarHBondContact CB-O 3.21Å; S94-A154 PolarHBondContact OG-O 2.58Å; H150-A154 PolarHBondContact O-N 3.29Å; W151-A154 PolarHBondContact O-N 3.02Å; Q152-A154 VanDerWaalsContact C-N 3.27Å; Q152-A154 PolarHBondContact O-N 2.99Å; A154-G157 PolarHBondContact O-N 2.98Å; A154-G158 PolarHBondContact O-N 3.07Å
155	F	96.9	Very high	95.8	Very high	134 Å²	134	54.6 Å²	54.6	59%	0.588	27%	0.265	S	S	*	.	H	α-helix	trans	-62.9	-52.5	179.5	179.2	-103.1	0	0	0	112.2	W151 Q152 G157 G158 V159	W151-F155 HydrophobicContact CE3-CB 4.46Å; W151-F155 WeakPolarHBondContact O-CB 3.48Å; W151-F155 PolarHBondContact O-N 3.33Å; Q152-F155 PolarHBondContact O-N 3.36Å; F155-G157 VanDerWaalsContact C-N 3.32Å; F155-G157 PolarHBondContact O-N 2.83Å; F155-G158 WeakPolarHBondContact O-CA 3.25Å; F155-G158 PolarHBondContact O-N 3.44Å; F155-V159 HydrophobicContact CD1-CG2 4.45Å; F155-V159 HydrophobicContact CE1-CG2 4.06Å; F155-V159 HydrophobicContact CE2-CG2 4.43Å; F155-V159 HydrophobicContact CZ-CG2 4.05Å; F155-V159 WeakPolarHBondContact O-CG2 3.06Å; F155-V159 PolarHBondContact O-N 3.3Å
156	V	97.9	Very high	96.1	Very high	46 Å²	46	55.3 Å²	55.3	28%	0.279	26%	0.256	S	S	.	.	H	α-helix	trans	-63.7	-39.8	179.3	176	0	0	0	0	111	F89 P90 Q152 G158 V159 I160	F89-V156 HydrophobicContact CE2-CB 3.87Å; F89-V156 HydrophobicContact CE2-CG1 4.02Å; F89-V156 HydrophobicContact CE2-CG2 3.91Å; F89-V156 HydrophobicContact CZ-CB 4.11Å; F89-V156 HydrophobicContact CZ-CG1 3.73Å; F89-V156 HydrophobicContact CZ-CG2 4.23Å; P90-V156 HydrophobicContact CB-CG1 4.43Å; Q152-V156 WeakPolarHBondContact O-CB 3.27Å; Q152-V156 WeakPolarHBondContact O-CG2 3.44Å; Q152-V156 PolarHBondContact O-N 3.1Å; V156-G158 VanDerWaalsContact C-N 3.31Å; V156-G158 PolarHBondContact O-N 3.12Å; V156-V159 PolarHBondContact O-N 2.73Å; V156-I160 HydrophobicContact CG1-CD1 3.91Å; V156-I160 HydrophobicContact CG1-CG1 4.39Å; V156-I160 WeakPolarHBondContact O-CG1 3.2Å; V156-I160 PolarHBondContact O-N 3.46Å
157	G	97.4	Very high	96.4	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-56.1	-46.5	171.3	0	0	0	0	0	111.7	S95 D153 A154 F155 V159 I160 G161	S95-G157 WeakPolarHBondContact CA-O 3.14Å; S95-G157 WeakPolarHBondContact CB-O 3.44Å; S95-G157 PolarHBondContact OG-O 2.94Å; D153-G157 PolarHBondContact O-N 3.46Å; D153-G157 VanDerWaalsContact O-N 3.11Å; A154-G157 PolarHBondContact O-N 2.98Å; F155-G157 VanDerWaalsContact C-N 3.32Å; F155-G157 PolarHBondContact O-N 2.83Å; G157-V159 PolarHBondContact O-N 3.48Å; G157-I160 PolarHBondContact O-N 2.91Å; G157-G161 PolarHBondContact O-N 2.8Å
158	G	97.8	Very high	96.8	Very high	4 Å²	4	47.5 Å²	47.5	4%	0.041	23%	0.225	C	C	.	.	H	α-helix	trans	-61	-42.1	177.8	0	0	0	0	0	113.4	S94 F98 A154 F155 V156 G161 L162	S94-G158 PolarHBondContact OG-N 3Å; F98-G158 WeakPolarHBondContact CB-O 3.21Å; A154-G158 PolarHBondContact O-N 3.07Å; F155-G158 WeakPolarHBondContact O-CA 3.25Å; F155-G158 PolarHBondContact O-N 3.44Å; V156-G158 VanDerWaalsContact C-N 3.31Å; V156-G158 PolarHBondContact O-N 3.12Å; G158-G161 PolarHBondContact O-N 3.18Å; G158-L162 WeakPolarHBondContact O-CG 3.47Å; G158-L162 PolarHBondContact O-N 3.09Å
159	V	98.4	Very high	97.1	Very high	72 Å²	72	44.4 Å²	44.4	44%	0.436	21%	0.211	S	C	.	.	H	α-helix	trans	-61.6	-46.8	175.8	172.7	0	0	0	0	111.5	F155 V156 G157 G161 L162 L163	F155-V159 HydrophobicContact CD1-CG2 4.45Å; F155-V159 HydrophobicContact CE1-CG2 4.06Å; F155-V159 HydrophobicContact CE2-CG2 4.43Å; F155-V159 HydrophobicContact CZ-CG2 4.05Å; F155-V159 WeakPolarHBondContact O-CG2 3.06Å; F155-V159 PolarHBondContact O-N 3.3Å; V156-V159 PolarHBondContact O-N 2.73Å; G157-V159 PolarHBondContact O-N 3.48Å; V159-G161 VanDerWaalsContact C-N 3.32Å; V159-G161 PolarHBondContact O-N 3Å; V159-L162 PolarHBondContact O-N 3.23Å; V159-L163 WeakPolarHBondContact O-CB 3.25Å; V159-L163 PolarHBondContact O-N 2.62Å
160	I	98.1	Very high	97.2	Very high	24 Å²	24	47.5 Å²	47.5	12%	0.123	22%	0.223	C	C	.	.	H	α-helix	trans	-59.5	-45.7	176.6	-67.8	167.5	0	0	0	110.3	I48 P90 V156 G157 L163 F164	I48-I160 HydrophobicContact CD1-CD1 3.94Å; P90-I160 HydrophobicContact CB-CD1 4.26Å; P90-I160 HydrophobicContact CG-CD1 3.98Å; V156-I160 HydrophobicContact CG1-CD1 3.91Å; V156-I160 HydrophobicContact CG1-CG1 4.39Å; V156-I160 WeakPolarHBondContact O-CG1 3.2Å; V156-I160 PolarHBondContact O-N 3.46Å; G157-I160 PolarHBondContact O-N 2.91Å; I160-L163 PolarHBondContact O-N 2.88Å; I160-F164 HydrophobicContact CG2-CD2 3.87Å; I160-F164 HydrophobicContact CG2-CE2 3.83Å; I160-F164 WeakPolarHBondContact O-CD2 3.25Å; I160-F164 PolarHBondContact O-N 3.44Å; I160-F164 VanDerWaalsContact O-N 3.16Å
161	G	97.8	Very high	97.3	Very high	0 Å²	0	51 Å²	51	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-59.1	-49.7	177.7	0	0	0	0	0	112.9	N41 S95 S99 G157 G158 V159 L163 F164 A165	N41-G161 WeakPolarHBondContact OD1-CA 3.41Å; S95-G161 WeakPolarHBondContact O-CA 3.44Å; S99-G161 WeakPolarHBondContact CA-O 3.39Å; G157-G161 PolarHBondContact O-N 2.8Å; G158-G161 PolarHBondContact O-N 3.18Å; V159-G161 VanDerWaalsContact C-N 3.32Å; V159-G161 PolarHBondContact O-N 3Å; G161-L163 VanDerWaalsContact C-N 3.34Å; G161-L163 PolarHBondContact O-N 3.23Å; G161-F164 PolarHBondContact O-N 2.98Å; G161-A165 WeakPolarHBondContact O-CB 3.12Å; G161-A165 PolarHBondContact O-N 3.29Å
162	L	98.4	Very high	97.3	Very high	56 Å²	56	44.2 Å²	44.2	29%	0.293	21%	0.214	S	C	.	.	H	α-helix	trans	-62.9	-38.7	178	-76.7	174	0	0	0	112.6	F98 F106 L133 G158 V159 A165 Y166	F98-L162 HydrophobicContact CB-CG 4.19Å; F98-L162 HydrophobicContact CD1-CD1 3.97Å; F98-L162 HydrophobicContact CD1-CD2 3.97Å; F98-L162 HydrophobicContact CD1-CG 3.77Å; F98-L162 HydrophobicContact CE1-CD1 4.37Å; F98-L162 HydrophobicContact CG-CG 4.33Å; F106-L162 HydrophobicContact CZ-CD2 4.13Å; L133-L162 HydrophobicContact CD2-CD2 3.76Å; G158-L162 WeakPolarHBondContact O-CG 3.47Å; G158-L162 PolarHBondContact O-N 3.09Å; V159-L162 PolarHBondContact O-N 3.23Å; L162-A165 PolarHBondContact O-N 2.92Å; L162-Y166 WeakPolarHBondContact O-CB 3.08Å; L162-Y166 PolarHBondContact O-N 2.95Å
163	L	98.4	Very high	97.2	Very high	90 Å²	90	41.3 Å²	41.3	47%	0.471	20%	0.201	S	C	.	.	H	α-helix	trans	-59.5	-52.1	178	178.1	65.4	0	0	0	111.1	V159 I160 G161 Y166 I167	V159-L163 WeakPolarHBondContact O-CB 3.25Å; V159-L163 PolarHBondContact O-N 2.62Å; I160-L163 PolarHBondContact O-N 2.88Å; G161-L163 VanDerWaalsContact C-N 3.34Å; G161-L163 PolarHBondContact O-N 3.23Å; L163-Y166 PolarHBondContact O-N 3.33Å; L163-I167 HydrophobicContact CD1-CD1 3.77Å; L163-I167 HydrophobicContact CD1-CG1 4.35Å; L163-I167 HydrophobicContact CG-CD1 3.95Å; L163-I167 WeakPolarHBondContact O-CG1 3.49Å; L163-I167 PolarHBondContact O-N 3.06Å
164	F	98.1	Very high	97.1	Very high	22 Å²	22	41.4 Å²	41.4	10%	0.096	20%	0.202	C	C	.	.	H	α-helix	trans	-68.6	-36.7	179.3	-75.1	-63.5	0	0	0	112.4	L40 N41 F44 I160 G161 Y166 S168	L40-F164 HydrophobicContact CB-CD1 3.61Å; L40-F164 HydrophobicContact CB-CE1 3.83Å; L40-F164 HydrophobicContact CB-CG 4.18Å; L40-F164 HydrophobicContact CD1-CD1 4.12Å; L40-F164 HydrophobicContact CD1-CE1 4.39Å; N41-F164 HydrophobicContact CB-CB 4.16Å; N41-F164 HydrophobicContact CB-CD2 4.05Å; N41-F164 HydrophobicContact CB-CG 4.36Å; F44-F164 HydrophobicContact CB-CE2 3.71Å; F44-F164 HydrophobicContact CB-CZ 3.98Å; F44-F164 HydrophobicContact CD1-CE2 4.34Å; F44-F164 AromaticContact CD1-CZ 3.96Å; F44-F164 HydrophobicContact CD1-CZ 3.96Å; F44-F164 HydrophobicContact CD2-CE1 4.19Å; F44-F164 HydrophobicContact CD2-CE2 4.05Å; F44-F164 AromaticContact CD2-CZ 3.42Å; F44-F164 HydrophobicContact CD2-CZ 3.42Å; F44-F164 VanDerWaalsContact CD2-CZ 3.42Å; F44-F164 HydrophobicContact CE1-CZ 4.3Å; F44-F164 HydrophobicContact CE2-CE1 4.31Å; F44-F164 AromaticContact CE2-CZ 3.8Å; F44-F164 HydrophobicContact CE2-CZ 3.8Å; F44-F164 AromaticContact CG-CE2 3.78Å; F44-F164 HydrophobicContact CG-CE2 3.78Å; F44-F164 AromaticContact CG-CZ 3.5Å; F44-F164 HydrophobicContact CG-CZ 3.5Å; F44-F164 VanDerWaalsContact CG-CZ 3.5Å; F44-F164 HydrophobicContact CZ-CZ 4.22Å; I160-F164 HydrophobicContact CG2-CD2 3.87Å; I160-F164 HydrophobicContact CG2-CE2 3.83Å; I160-F164 WeakPolarHBondContact O-CD2 3.25Å; I160-F164 PolarHBondContact O-N 3.44Å; I160-F164 VanDerWaalsContact O-N 3.16Å; G161-F164 PolarHBondContact O-N 2.98Å; F164-Y166 VanDerWaalsContact C-N 3.31Å; F164-Y166 PolarHBondContact O-N 3.43Å; F164-S168 VanDerWaalsContact O-CB 3.29Å; F164-S168 WeakPolarHBondContact O-CB 3.34Å; F164-S168 PolarHBondContact O-N 3.06Å; F164-S168 PolarHBondContact O-OG 3.22Å; F164-S168 VanDerWaalsContact O-OG 3.06Å
165	A	97.5	Very high	96.9	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-57.2	-45.6	171.6	0	0	0	0	0	111.9	S99 F103 F106 G161 L162 Y169	S99-A165 WeakPolarHBondContact O-CB 3.11Å; F103-A165 HydrophobicContact CB-CB 4.08Å; F106-A165 HydrophobicContact CD2-CB 4.06Å; F106-A165 HydrophobicContact CE2-CB 3.82Å; G161-A165 WeakPolarHBondContact O-CB 3.12Å; G161-A165 PolarHBondContact O-N 3.29Å; L162-A165 PolarHBondContact O-N 2.92Å; A165-Y169 VanDerWaalsContact O-CB 3.27Å; A165-Y169 WeakPolarHBondContact O-CB 3.11Å; A165-Y169 PolarHBondContact O-N 3Å
166	Y	97.5	Very high	96.6	Very high	105 Å²	105	38.7 Å²	38.7	41%	0.412	19%	0.193	S	C	.	.	H	α-helix	trans	-68	-48.8	-178.6	178.3	-104.3	0	0	0	112	F106 L162 L163 F164 S168 Y169 R170 F176	F106-Y166 HydrophobicContact CE2-CD2 4.49Å; L162-Y166 WeakPolarHBondContact O-CB 3.08Å; L162-Y166 PolarHBondContact O-N 2.95Å; L163-Y166 PolarHBondContact O-N 3.33Å; F164-Y166 VanDerWaalsContact C-N 3.31Å; F164-Y166 PolarHBondContact O-N 3.43Å; Y166-S168 PolarHBondContact O-N 2.99Å; Y166-Y169 PolarHBondContact O-N 3.28Å; Y166-R170 HydrophobicContact CD1-CG 4.27Å; Y166-R170 HydrophobicContact CD2-CG 4.17Å; Y166-R170 HydrophobicContact CE1-CG 3.84Å; Y166-R170 HydrophobicContact CE2-CG 3.73Å; Y166-R170 HydrophobicContact CG-CG 4.43Å; Y166-R170 WeakPolarHBondContact O-CB 3.12Å; Y166-R170 VanDerWaalsContact O-CG 3.32Å; Y166-R170 WeakPolarHBondContact O-CG 3.37Å; Y166-R170 PolarHBondContact O-N 2.97Å; Y166-F176 HydrophobicContact CD2-CE2 4.43Å; Y166-F176 HydrophobicContact CE2-CE2 4.12Å
167	I	97.4	Very high	96.2	Very high	82 Å²	82	42.8 Å²	42.8	42%	0.421	21%	0.213	S	C	.	.	H	α-helix	trans	-61.6	-45.8	-179.9	-67.3	170.2	0	0	0	110.4	L163 Y169 R170 Q171	L163-I167 HydrophobicContact CD1-CD1 3.77Å; L163-I167 HydrophobicContact CD1-CG1 4.35Å; L163-I167 HydrophobicContact CG-CD1 3.95Å; L163-I167 WeakPolarHBondContact O-CG1 3.49Å; L163-I167 PolarHBondContact O-N 3.06Å; I167-Y169 PolarHBondContact O-N 3.25Å; I167-R170 PolarHBondContact O-N 3.22Å; I167-Q171 WeakPolarHBondContact O-CB 3.27Å; I167-Q171 PolarHBondContact O-N 3.46Å
168	S	97.1	Very high	95.8	Very high	1 Å²	1	47.1 Å²	47.1	1%	0.007	23%	0.233	C	C	.	.	H	α-helix	trans	-67.6	-35	179.2	-61.6	0	0	0	0	112.9	A33 A37 F164 Y166 H172	A33-S168 WeakPolarHBondContact O-CB 3.3Å; A37-S168 VanDerWaalsContact CA-OG 3.32Å; A37-S168 WeakPolarHBondContact CA-OG 3.5Å; A37-S168 PolarHBondContact N-OG 3.07Å; F164-S168 VanDerWaalsContact O-CB 3.29Å; F164-S168 WeakPolarHBondContact O-CB 3.34Å; F164-S168 PolarHBondContact O-N 3.06Å; F164-S168 PolarHBondContact O-OG 3.22Å; F164-S168 VanDerWaalsContact O-OG 3.06Å; Y166-S168 PolarHBondContact O-N 2.99Å; S168-H172 PolarHBondContact O-ND1 3.44Å
169	Y	96.6	Very high	95.4	Very high	1 Å²	1	51.2 Å²	51.2	0%	0.004	25%	0.252	C	S	.	.	H	α-helix	trans	-61	-51.4	169.6	174.3	-93.8	0	0	0	110.8	F103 F106 A165 Y166 I167 Q171 H172 Y173 P174 F176 C181	F103-Y169 HydrophobicContact CE2-CD2 4.39Å; F106-Y169 HydrophobicContact CB-CD1 4.4Å; F106-Y169 HydrophobicContact CB-CD2 3.95Å; F106-Y169 HydrophobicContact CB-CE2 4.4Å; F106-Y169 HydrophobicContact CB-CG 3.96Å; F106-Y169 WeakPolarHBondContact O-CE2 3.31Å; A165-Y169 VanDerWaalsContact O-CB 3.27Å; A165-Y169 WeakPolarHBondContact O-CB 3.11Å; A165-Y169 PolarHBondContact O-N 3Å; Y166-Y169 PolarHBondContact O-N 3.28Å; I167-Y169 PolarHBondContact O-N 3.25Å; Y169-Q171 PolarHBondContact O-N 2.81Å; Y169-H172 PolarHBondContact O-N 2.76Å; Y169-Y173 AromaticContact CD2-CD2 3.7Å; Y169-Y173 HydrophobicContact CD2-CD2 3.7Å; Y169-Y173 HydrophobicContact CD2-CE2 4.48Å; Y169-Y173 HydrophobicContact CD2-CG 4.06Å; Y169-Y173 HydrophobicContact CE2-CD1 4.33Å; Y169-Y173 AromaticContact CE2-CD2 3.71Å; Y169-Y173 HydrophobicContact CE2-CD2 3.71Å; Y169-Y173 AromaticContact CE2-CG 3.61Å; Y169-Y173 HydrophobicContact CE2-CG 3.61Å; Y169-Y173 HydrophobicContact CG-CD2 4.43Å; Y169-Y173 VanDerWaalsContact CZ-CB 3.44Å; Y169-Y173 AromaticContact CZ-CG 3.97Å; Y169-Y173 PolarHBondContact O-N 2.92Å; Y169-P174 WeakPolarHBondContact CE1-O 3.09Å; Y169-F176 AromaticContact CD1-CE1 3.79Å; Y169-F176 HydrophobicContact CD1-CE1 3.79Å; Y169-F176 AromaticContact CD1-CZ 3.91Å; Y169-F176 HydrophobicContact CD1-CZ 3.91Å; Y169-F176 AromaticContact CE1-CD1 3.77Å; Y169-F176 HydrophobicContact CE1-CD1 3.77Å; Y169-F176 AromaticContact CE1-CE1 3.15Å; Y169-F176 HydrophobicContact CE1-CE1 3.15Å; Y169-F176 AromaticContact CE1-CZ 3.71Å; Y169-F176 HydrophobicContact CE1-CZ 3.71Å; Y169-F176 HydrophobicContact CE2-CE1 4.21Å; Y169-F176 AromaticContact CZ-CD1 3.89Å; Y169-F176 AromaticContact CZ-CE1 3.41Å; Y169-F176 VanDerWaalsContact CZ-CE1 3.41Å; Y169-C181 PolarHBondContact OH-O 3.03Å
170	R	96.1	Very high	95	Very high	66 Å²	66	50.7 Å²	50.7	25%	0.249	25%	0.247	C	C	.	.	H	α-helix	trans	-64.5	-26.3	-178.8	-71	-64.4	-64.8	111.3	5.9	113.8	Y166 I167 H172 Y173 P174 P175 Y185	Y166-R170 HydrophobicContact CD1-CG 4.27Å; Y166-R170 HydrophobicContact CD2-CG 4.17Å; Y166-R170 HydrophobicContact CE1-CG 3.84Å; Y166-R170 HydrophobicContact CE2-CG 3.73Å; Y166-R170 HydrophobicContact CG-CG 4.43Å; Y166-R170 WeakPolarHBondContact O-CB 3.12Å; Y166-R170 VanDerWaalsContact O-CG 3.32Å; Y166-R170 WeakPolarHBondContact O-CG 3.37Å; Y166-R170 PolarHBondContact O-N 2.97Å; I167-R170 PolarHBondContact O-N 3.22Å; R170-H172 PolarHBondContact O-N 3.25Å; R170-Y173 PolarHBondContact NH1-O 3.38Å; R170-P174 VanDerWaalsContact NH1-CA 3.32Å; R170-P175 VanDerWaalsContact NH1-CD 3.34Å; R170-P175 VanDerWaalsContact NH1-N 3.17Å; R170-Y185 PolarHBondContact NH1-OH 3.45Å
171	Q	96.6	Very high	94.6	Very high	131 Å²	131	49.6 Å²	49.6	61%	0.612	24%	0.241	S	C	*	.	H	α-helix	trans	-64.4	-29.3	173.3	-176.5	62.4	19	0	0	112.4	I167 Y169	I167-Q171 WeakPolarHBondContact O-CB 3.27Å; I167-Q171 PolarHBondContact O-N 3.46Å; Y169-Q171 PolarHBondContact O-N 2.81Å
172	H	95.4	Very high	94.3	Very high	24 Å²	24	52 Å²	52	11%	0.111	25%	0.252	C	S	.	.	H	α-helix	trans	-112.7	-24.3	-174	-62.4	78.5	0	0	0	113.5	E29 A33 S168 Y169 R170 P184 Y185	E29-H172 IonicContact OE2-CD2 3.36Å; E29-H172 PolarHBondContact OE2-CD2 3.37Å; A33-H172 HydrophobicContact CB-CB 4Å; A33-H172 WeakPolarHBondContact CB-ND1 3.44Å; S168-H172 PolarHBondContact O-ND1 3.44Å; Y169-H172 PolarHBondContact O-N 2.76Å; R170-H172 PolarHBondContact O-N 3.25Å; H172-P184 CarbonylContact O-C 2.88Å; H172-P184 VanDerWaalsContact O-CA 3.29Å; H172-P184 WeakPolarHBondContact O-CA 3.12Å; H172-Y185 WeakPolarHBondContact O-CD2 3.42Å; H172-Y185 PolarHBondContact O-N 2.88Å
173	Y	94.9	Very high	94	Very high	1 Å²	1	51.3 Å²	51.3	0%	0.004	25%	0.249	C	C	.	.	S	Bend	trans	-127.5	148.6	-174.2	-66.1	-87.5	0	0	0	112.2	A30 A33 Y107 Y169 R170 P184	A30-Y173 WeakPolarHBondContact CA-OH 3.38Å; A30-Y173 WeakPolarHBondContact CB-OH 3.43Å; A30-Y173 PolarHBondContact N-OH 3.04Å; A33-Y173 HydrophobicContact CB-CE2 4.5Å; Y107-Y173 HydrophobicContact CD2-CE2 4.45Å; Y169-Y173 AromaticContact CD2-CD2 3.7Å; Y169-Y173 HydrophobicContact CD2-CD2 3.7Å; Y169-Y173 HydrophobicContact CD2-CE2 4.48Å; Y169-Y173 HydrophobicContact CD2-CG 4.06Å; Y169-Y173 HydrophobicContact CE2-CD1 4.33Å; Y169-Y173 AromaticContact CE2-CD2 3.71Å; Y169-Y173 HydrophobicContact CE2-CD2 3.71Å; Y169-Y173 AromaticContact CE2-CG 3.61Å; Y169-Y173 HydrophobicContact CE2-CG 3.61Å; Y169-Y173 HydrophobicContact CG-CD2 4.43Å; Y169-Y173 VanDerWaalsContact CZ-CB 3.44Å; Y169-Y173 AromaticContact CZ-CG 3.97Å; Y169-Y173 PolarHBondContact O-N 2.92Å; R170-Y173 PolarHBondContact NH1-O 3.38Å; Y173-P184 HydrophobicContact CD1-CB 4.18Å; Y173-P184 HydrophobicContact CE1-CB 3.78Å; Y173-P184 HydrophobicContact CE1-CG 4.41Å
174	P	94.4	Very high	93.8	Very high	3 Å²	3	47 Å²	47	2%	0.019	23%	0.226	C	C	.	.			trans	-60.3	168	170.6	-22.1	33.4	0	0	0	114.5	Y169 R170 H178 L183 Y185 L188	Y169-P174 WeakPolarHBondContact CE1-O 3.09Å; R170-P174 VanDerWaalsContact NH1-CA 3.32Å; P174-H178 HydrophobicContact CB-CB 3.89Å; P174-L183 WeakPolarHBondContact CD-O 3.44Å; P174-Y185 HydrophobicContact CB-CE1 4.5Å; P174-Y185 HydrophobicContact CG-CD1 4.4Å; P174-Y185 HydrophobicContact CG-CE1 3.97Å; P174-L188 HydrophobicContact CG-CD1 3.77Å
175	P	93.3	Very high	93.6	Very high	50 Å²	50	50.6 Å²	50.6	33%	0.325	24%	0.24	S	C	.	.			trans	-59.5	151.9	172	-17.9	29.1	0	0	0	111.9	R170 L177 H178 C181	R170-P175 VanDerWaalsContact NH1-CD 3.34Å; R170-P175 VanDerWaalsContact NH1-N 3.17Å; P175-L177 PolarHBondContact O-N 2.76Å; P175-H178 VanDerWaalsContact O-CB 3.24Å; P175-H178 WeakPolarHBondContact O-CB 3.5Å; P175-H178 PolarHBondContact O-N 2.9Å; P175-C181 VanDerWaalsContact O-CB 3.32Å; P175-C181 WeakPolarHBondContact O-CB 3.44Å
176	F	89.1	Confident	93.3	Very high	35 Å²	35	52.3 Å²	52.3	15%	0.154	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-18.8	-177.9	-50	-61.7	0	0	0	115.3	F106 A109 F115 T116 Y166 Y169	F106-F176 HydrophobicContact CB-CE1 3.85Å; F106-F176 HydrophobicContact CB-CZ 3.72Å; F106-F176 HydrophobicContact CD1-CE1 4.33Å; F106-F176 HydrophobicContact CD1-CE2 4.19Å; F106-F176 AromaticContact CD1-CZ 3.54Å; F106-F176 HydrophobicContact CD1-CZ 3.54Å; F106-F176 HydrophobicContact CE1-CZ 4.35Å; F106-F176 HydrophobicContact CG-CE1 4.38Å; F106-F176 AromaticContact CG-CZ 3.76Å; F106-F176 HydrophobicContact CG-CZ 3.76Å; F106-F176 WeakPolarHBondContact O-CE1 3.12Å; A109-F176 HydrophobicContact CB-CD1 3.96Å; A109-F176 HydrophobicContact CB-CE1 4.09Å; F115-F176 HydrophobicContact CD2-CB 3.96Å; T116-F176 WeakPolarHBondContact CG2-O 3.09Å; Y166-F176 HydrophobicContact CD2-CE2 4.43Å; Y166-F176 HydrophobicContact CE2-CE2 4.12Å; Y169-F176 AromaticContact CD1-CE1 3.79Å; Y169-F176 HydrophobicContact CD1-CE1 3.79Å; Y169-F176 AromaticContact CD1-CZ 3.91Å; Y169-F176 HydrophobicContact CD1-CZ 3.91Å; Y169-F176 AromaticContact CE1-CD1 3.77Å; Y169-F176 HydrophobicContact CE1-CD1 3.77Å; Y169-F176 AromaticContact CE1-CE1 3.15Å; Y169-F176 HydrophobicContact CE1-CE1 3.15Å; Y169-F176 AromaticContact CE1-CZ 3.71Å; Y169-F176 HydrophobicContact CE1-CZ 3.71Å; Y169-F176 HydrophobicContact CE2-CE1 4.21Å; Y169-F176 AromaticContact CZ-CD1 3.89Å; Y169-F176 AromaticContact CZ-CE1 3.41Å; Y169-F176 VanDerWaalsContact CZ-CE1 3.41Å
177	L	89.6	Confident	93.1	Very high	132 Å²	132	48.3 Å²	48.3	69%	0.691	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-12.4	178.4	-63.6	168.1	0	0	0	112.3	F115 P175 M179	F115-L177 HydrophobicContact CB-CD2 3.98Å; P175-L177 PolarHBondContact O-N 2.76Å; L177-M179 WeakPolarHBondContact O-CE 3.5Å
178	H	90	Very high	92.8	Very high	90 Å²	90	46.4 Å²	46.4	42%	0.417	23%	0.231	S	C	.	.	S	Bend	trans	-73.3	139.2	177.7	-166.7	-83.7	0	0	0	110	T116 P174 P175 D180 C181	T116-H178 VanDerWaalsContact CG2-O 3.32Å; T116-H178 WeakPolarHBondContact CG2-O 3.49Å; P174-H178 HydrophobicContact CB-CB 3.89Å; P175-H178 VanDerWaalsContact O-CB 3.24Å; P175-H178 WeakPolarHBondContact O-CB 3.5Å; P175-H178 PolarHBondContact O-N 2.9Å; H178-D180 IonicContact CE1-OD2 3.4Å; H178-D180 PolarHBondContact CE1-OD2 3.28Å; H178-D180 PolarHBondContact ND1-N 3.29Å; H178-D180 VanDerWaalsContact ND1-N 3.18Å; H178-D180 IonicContact ND1-OD2 3.85Å; H178-D180 PolarHBondContact O-N 3.28Å; H178-C181 VanDerWaalsContact O-CB 3.25Å; H178-C181 WeakPolarHBondContact O-CB 3.38Å; H178-C181 PolarHBondContact O-N 3.45Å; H178-C181 PolarHBondContact O-SG 2.9Å
179	M	88.1	Confident	92.5	Very high	90 Å²	90	48.1 Å²	48.1	44%	0.443	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-39	-176.9	-67.8	-58	106.7	0	0	112.4	Q113 T116 L177 C181	Q113-M179 PolarHBondContact NE2-O 2.62Å; T116-M179 HydrophobicContact CG2-CE 4.01Å; L177-M179 WeakPolarHBondContact O-CE 3.5Å; M179-C181 VanDerWaalsContact C-N 3.33Å; M179-C181 PolarHBondContact O-N 2.59Å
180	D	90.2	Very high	92.1	Very high	61 Å²	61	51 Å²	51	33%	0.326	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	24.6	178.4	-48.5	-52.4	0	0	0	114.7	H178 H182 L183 L188	H178-D180 IonicContact CE1-OD2 3.4Å; H178-D180 PolarHBondContact CE1-OD2 3.28Å; H178-D180 PolarHBondContact ND1-N 3.29Å; H178-D180 VanDerWaalsContact ND1-N 3.18Å; H178-D180 IonicContact ND1-OD2 3.85Å; H178-D180 PolarHBondContact O-N 3.28Å; D180-H182 PolarHBondContact O-N 3.18Å; D180-L183 PolarHBondContact O-N 2.93Å; D180-L188 HydrophobicContact CB-CD1 4.39Å; D180-L188 HydrophobicContact CB-CD2 3.86Å
181	C	90.7	Very high	91.6	Very high	1 Å²	1	51.2 Å²	51.2	1%	0.007	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-14.5	178.3	66.5	0	0	0	0	114.5	G110 Y169 P175 H178 M179	G110-C181 PolarHBondContact O-SG 3.31Å; G110-C181 VanDerWaalsContact O-SG 3.4Å; Y169-C181 PolarHBondContact OH-O 3.03Å; P175-C181 VanDerWaalsContact O-CB 3.32Å; P175-C181 WeakPolarHBondContact O-CB 3.44Å; H178-C181 VanDerWaalsContact O-CB 3.25Å; H178-C181 WeakPolarHBondContact O-CB 3.38Å; H178-C181 PolarHBondContact O-N 3.45Å; H178-C181 PolarHBondContact O-SG 2.9Å; M179-C181 VanDerWaalsContact C-N 3.33Å; M179-C181 PolarHBondContact O-N 2.59Å
182	H	90.4	Very high	91.1	Very high	51 Å²	51	49.5 Å²	49.5	24%	0.236	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80	-18.3	176.1	67.7	-78.7	0	0	0	112.8	G110 K111 Q113 D180	G110-H182 WeakPolarHBondContact O-CA 3.37Å; G110-H182 WeakPolarHBondContact O-CB 3.32Å; K111-H182 HydrophobicContact CD-CB 4.41Å; K111-H182 WeakPolarHBondContact CD-O 3.34Å; K111-H182 VanDerWaalsContact CE-O 3.3Å; K111-H182 WeakPolarHBondContact CE-O 3.04Å; K111-H182 PolarHBondContact NZ-O 3.42Å; Q113-H182 HydrophobicContact CG-CB 4.29Å; D180-H182 PolarHBondContact O-N 3.18Å
183	L	91.9	Very high	90.6	Very high	42 Å²	42	58.2 Å²	58.2	22%	0.22	32%	0.32	C	S	.	.	S	Bend	trans	-102.4	140.8	-179.1	-60.4	176.8	0	0	0	110.8	E26 P174 D180 L188	E26-L183 WeakPolarHBondContact OE1-CD2 3.36Å; P174-L183 WeakPolarHBondContact CD-O 3.44Å; D180-L183 PolarHBondContact O-N 2.93Å; L183-L188 HydrophobicContact CB-CD2 3.99Å; L183-L188 HydrophobicContact CB-CG 4.11Å; L183-L188 HydrophobicContact CD1-CD2 3.74Å; L183-L188 HydrophobicContact CG-CD2 4.5Å
184	P	94.4	Very high	89.8	Confident	0 Å²	0	61 Å²	61	0%	0	34%	0.344	C	S	.	.			trans	-74.5	156.5	169.6	32.7	-34.7	0	0	0	111.1	E26 E29 H172 Y173 A186 S187 L188	E26-P184 HydrophobicContact CB-CG 4.39Å; E26-P184 HydrophobicContact CG-CG 4.07Å; E26-P184 WeakPolarHBondContact OE1-CD 3.38Å; E29-P184 HydrophobicContact CB-CB 3.84Å; E29-P184 HydrophobicContact CB-CG 4.25Å; E29-P184 HydrophobicContact CG-CB 3.96Å; E29-P184 HydrophobicContact CG-CG 4.18Å; H172-P184 CarbonylContact O-C 2.88Å; H172-P184 VanDerWaalsContact O-CA 3.29Å; H172-P184 WeakPolarHBondContact O-CA 3.12Å; Y173-P184 HydrophobicContact CD1-CB 4.18Å; Y173-P184 HydrophobicContact CE1-CB 3.78Å; Y173-P184 HydrophobicContact CE1-CG 4.41Å; P184-A186 PolarHBondContact O-N 3.29Å; P184-A186 VanDerWaalsContact O-N 3.16Å; P184-S187 WeakPolarHBondContact CG-OG 3.37Å; P184-S187 PolarHBondContact O-N 2.95Å; P184-L188 PolarHBondContact O-N 2.96Å
185	Y	93.5	Very high	88.8	Confident	97 Å²	97	66.3 Å²	66.3	38%	0.38	38%	0.378	S	S	.	.	H	α-helix	trans	-56.4	-33.5	178.7	-75.3	-60.3	0	0	0	113.3	R170 H172 P174 S187 L188 A189	R170-Y185 PolarHBondContact NH1-OH 3.45Å; H172-Y185 WeakPolarHBondContact O-CD2 3.42Å; H172-Y185 PolarHBondContact O-N 2.88Å; P174-Y185 HydrophobicContact CB-CE1 4.5Å; P174-Y185 HydrophobicContact CG-CD1 4.4Å; P174-Y185 HydrophobicContact CG-CE1 3.97Å; Y185-S187 VanDerWaalsContact C-N 3.33Å; Y185-S187 PolarHBondContact O-N 3.14Å; Y185-L188 HydrophobicContact CD1-CD1 4.25Å; Y185-L188 PolarHBondContact O-N 3.31Å; Y185-A189 WeakPolarHBondContact O-CB 3.34Å; Y185-A189 PolarHBondContact O-N 3.5Å
186	A	92.9	Very high	87.9	Confident	35 Å²	35	69.3 Å²	69.3	29%	0.289	40%	0.398	S	S	.	.	H	α-helix	trans	-61.6	-39.6	176.3	0	0	0	0	0	112.6	T25 E29 P184 A190	T25-A186 HydrophobicContact CG2-CB 3.95Å; E29-A186 HydrophobicContact CG-CB 3.84Å; P184-A186 PolarHBondContact O-N 3.29Å; P184-A186 VanDerWaalsContact O-N 3.16Å; A186-A190 WeakPolarHBondContact O-CB 3.5Å; A186-A190 PolarHBondContact O-N 2.89Å
187	S	92	Very high	86.7	Confident	21 Å²	21	73.3 Å²	73.3	15%	0.147	43%	0.427	C	S	.	.	H	α-helix	trans	-70.4	-40.9	176.4	-61.4	0	0	0	0	111.4	P184 Y185 A189 A190 A191	P184-S187 WeakPolarHBondContact CG-OG 3.37Å; P184-S187 PolarHBondContact O-N 2.95Å; Y185-S187 VanDerWaalsContact C-N 3.33Å; Y185-S187 PolarHBondContact O-N 3.14Å; S187-A189 PolarHBondContact O-N 3.41Å; S187-A190 PolarHBondContact O-N 3.01Å; S187-A191 PolarHBondContact O-N 3.15Å
188	L	91	Very high	85.4	Confident	42 Å²	42	71.5 Å²	71.5	22%	0.22	43%	0.431	C	S	.	.	H	α-helix	trans	-62.4	-43	176.1	-64.4	175.1	0	0	0	111.8	P174 D180 L183 P184 Y185 A191 S192	P174-L188 HydrophobicContact CG-CD1 3.77Å; D180-L188 HydrophobicContact CB-CD1 4.39Å; D180-L188 HydrophobicContact CB-CD2 3.86Å; L183-L188 HydrophobicContact CB-CD2 3.99Å; L183-L188 HydrophobicContact CB-CG 4.11Å; L183-L188 HydrophobicContact CD1-CD2 3.74Å; L183-L188 HydrophobicContact CG-CD2 4.5Å; P184-L188 PolarHBondContact O-N 2.96Å; Y185-L188 HydrophobicContact CD1-CD1 4.25Å; Y185-L188 PolarHBondContact O-N 3.31Å; L188-A191 PolarHBondContact O-N 3.15Å; L188-S192 PolarHBondContact O-N 2.78Å
189	A	90.7	Very high	83.9	Confident	37 Å²	37	75.7 Å²	75.7	31%	0.306	45%	0.451	S	S	.	.	H	α-helix	trans	-64.3	-40.4	175.7	0	0	0	0	0	111.7	Y185 S187 S192 R193	Y185-A189 WeakPolarHBondContact O-CB 3.34Å; Y185-A189 PolarHBondContact O-N 3.5Å; S187-A189 PolarHBondContact O-N 3.41Å; A189-S192 PolarHBondContact O-N 2.83Å; A189-S192 PolarHBondContact O-OG 3.1Å; A189-R193 WeakPolarHBondContact O-CG 3.32Å; A189-R193 PolarHBondContact O-N 3.29Å
190	A	88.6	Confident	82.1	Confident	62 Å²	62	79.2 Å²	79.2	51%	0.512	47%	0.471	S	S	.	.	H	α-helix	trans	-62.3	-44	175.4	0	0	0	0	0	111.9	A186 S187 S192 R193 A194	A186-A190 WeakPolarHBondContact O-CB 3.5Å; A186-A190 PolarHBondContact O-N 2.89Å; S187-A190 PolarHBondContact O-N 3.01Å; A190-S192 PolarHBondContact O-N 3.46Å; A190-R193 PolarHBondContact O-N 2.04Å; A190-A194 PolarHBondContact O-N 2.89Å
191	A	86.1	Confident	80.1	Confident	71 Å²	71	82.8 Å²	82.8	59%	0.587	49%	0.491	S	S	*	.	H	α-helix	trans	-61.7	-41.9	176.6	0	0	0	0	0	112.3	S187 L188 R193 A194	S187-A191 PolarHBondContact O-N 3.15Å; L188-A191 PolarHBondContact O-N 3.15Å; A191-R193 PolarHBondContact O-N 2.77Å; A191-A194 PolarHBondContact O-N 3.47Å
192	S	86.6	Confident	78.1	Confident	95 Å²	95	88.4 Å²	88.4	66%	0.664	53%	0.527	S	S	*	.	H	α-helix	trans	-65.8	-21.5	178.1	70.1	0	0	0	0	114.6	L188 A189 A190	L188-S192 PolarHBondContact O-N 2.78Å; A189-S192 PolarHBondContact O-N 2.83Å; A189-S192 PolarHBondContact O-OG 3.1Å; A190-S192 PolarHBondContact O-N 3.46Å
193	R	84.8	Confident	76.2	Confident	206 Å²	206	94.4 Å²	94.4	78%	0.777	56%	0.555	S	S	*	*	H	α-helix	trans	-95.9	-9.4	-179.3	-69.7	175.5	-174.6	178.1	1.6	112.9	A189 A190 A191	A189-R193 WeakPolarHBondContact O-CG 3.32Å; A189-R193 PolarHBondContact O-N 3.29Å; A190-R193 PolarHBondContact O-N 2.04Å; A191-R193 PolarHBondContact O-N 2.77Å
194	A	77.7	Confident	73.9	Confident	61 Å²	61	97.9 Å²	97.9	50%	0.504	58%	0.58	S	S	.	*	S	Bend	trans	-68	132	177.1	0	0	0	0	0	109.1	A190 A191	A190-A194 PolarHBondContact O-N 2.89Å; A191-A194 PolarHBondContact O-N 3.47Å
195	P	73.7	Confident	71.7	Confident	114 Å²	114	103.6 Å²	103.6	74%	0.74	62%	0.615	S	S	*	*	P	Polyproline II helix	trans	-58.2	145.3	172.3	23.3	-30.2	0	0	0	109.4
196	P	73.2	Confident	69.3	Low	113 Å²	113	106.4 Å²	106.4	73%	0.734	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-55.2	144.4	175.9	22.7	-31.3	0	0	0	109.5	A198	P196-A198 PolarHBondContact O-N 3.2Å
197	P	65.2	Low	67.4	Low	118 Å²	118	111.9 Å²	111.9	77%	0.766	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-54.3	133.8	174.9	22.4	-30.8	0	0	0	108.6	Q199	P197-Q199 PolarHBondContact O-N 3.26Å; P197-Q199 VanDerWaalsContact O-N 3.12Å
198	A	62.1	Low	65	Low	94 Å²	94	114.9 Å²	114.9	78%	0.777	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-51.5	122.8	173.2	0	0	0	0	0	107.7	P196 D200	P196-A198 PolarHBondContact O-N 3.2Å; A198-D200 PolarHBondContact O-N 3.42Å; A198-D200 VanDerWaalsContact O-N 3.1Å
199	Q	57.7	Low	62.8	Low	179 Å²	179	119.2 Å²	119.2	84%	0.836	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-60.1	116	168.7	-73.1	176	-49.5	0	0	105.9	P197 D201	P197-Q199 PolarHBondContact O-N 3.26Å; P197-Q199 VanDerWaalsContact O-N 3.12Å; Q199-D201 PolarHBondContact O-N 3.27Å
200	D	51.9	Low	60.5	Low	163 Å²	163	123.5 Å²	123.5	87%	0.872	74%	0.738	S	S	*	*			trans	-60.1	98.4	161.5	-96.2	-23.7	0	0	0	105.6	A198	A198-D200 PolarHBondContact O-N 3.42Å; A198-D200 VanDerWaalsContact O-N 3.1Å
201	D	48	Very low	58.4	Low	137 Å²	137	127.9 Å²	127.9	73%	0.733	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-54.7	127.6	167.1	-90.8	-34	0	0	0	107	Q199 Q203	Q199-D201 PolarHBondContact O-N 3.27Å; D201-Q203 PolarHBondContact O-N 3.08Å
202	P	48.2	Very low	56.4	Low	118 Å²	118	129.8 Å²	129.8	77%	0.766	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-56.1	116.6	174.8	-19.5	29.4	0	0	0	108.7
203	Q	50.5	Low	54.2	Low	177 Å²	177	134.5 Å²	134.5	83%	0.827	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-54.5	132.1	171.5	-73.1	-165.8	-69.6	0	0	108.8	D201 V205	D201-Q203 PolarHBondContact O-N 3.08Å; Q203-V205 PolarHBondContact O-N 2.85Å
204	P	44.1	Very low	52.2	Low	115 Å²	115	133.4 Å²	133.4	75%	0.747	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-64.4	122.2	174.9	25.7	-29.3	0	0	0	108.1	D206	P204-D206 PolarHBondContact O-N 3Å; P204-D206 VanDerWaalsContact O-N 3.13Å
205	V	48	Very low	50.4	Low	120 Å²	120	133.9 Å²	133.9	73%	0.727	79%	0.787	S	S	*	*			trans	-68.9	106.2	174.5	-176.3	0	0	0	0	107.2	Q203 N207	Q203-V205 PolarHBondContact O-N 2.85Å; V205-N207 VanDerWaalsContact C-N 3.31Å; V205-N207 PolarHBondContact O-N 3.46Å
206	D	42.7	Very low	49	Very low	157 Å²	157	136.6 Å²	136.6	84%	0.84	79%	0.794	S	S	*	*			trans	-64.8	89.3	171.2	-84.4	-26.9	0	0	0	109.8	P204 A208	P204-D206 PolarHBondContact O-N 3Å; P204-D206 VanDerWaalsContact O-N 3.13Å; D206-A208 PolarHBondContact O-N 3.01Å
207	N	51.8	Low	47.7	Very low	149 Å²	149	137.9 Å²	137.9	80%	0.797	80%	0.8	S	S	*	*			trans	-87.5	89.4	165.2	-82.3	-11.8	0	0	0	109.2	V205	V205-N207 VanDerWaalsContact C-N 3.31Å; V205-N207 PolarHBondContact O-N 3.46Å
208	A	42.1	Very low	46.8	Very low	84 Å²	84	141.6 Å²	141.6	69%	0.694	81%	0.807	S	S	*	*			trans	-142.8	75.9	162.6	0	0	0	0	0	110.2	D206 T210	D206-A208 PolarHBondContact O-N 3.01Å; A208-T210 PolarHBondContact O-N 3.13Å
209	T	44.5	Very low	45.9	Very low	133 Å²	133	140.5 Å²	140.5	82%	0.816	81%	0.805	S	S	*	*			trans	-81.1	89.5	161.8	-39.3	0	0	0	0	108.1	L211	T209-L211 PolarHBondContact O-N 3.1Å
210	T	43	Very low	45.7	Very low	128 Å²	128	138.1 Å²	138.1	79%	0.785	81%	0.805	S	S	*	*			trans	-70.9	105.8	163.5	43.2	0	0	0	0	108.9	A208	A208-T210 PolarHBondContact O-N 3.13Å
211	L	44.1	Very low	45.1	Very low	154 Å²	154	141 Å²	141	81%	0.806	83%	0.828	S	S	*	*			trans	-78.1	129.7	164	-86.2	156.7	0	0	0	109.3	T209	T209-L211 PolarHBondContact O-N 3.1Å
212	P	44.9	Very low	45	Very low	110 Å²	110	141.2 Å²	141.2	71%	0.714	83%	0.833	S	S	*	*			trans	-81.3	123.5	163.7	29.2	-25.4	0	0	0	109.7	E214	P212-E214 PolarHBondContact O-N 3.18Å
213	M	39.9	Very low	44.8	Very low	194 Å²	194	142.4 Å²	142.4	96%	0.956	84%	0.836	S	S	*	*			trans	-78.2	105.3	165.8	-85.7	-99.6	-67.2	0	0	108.4
214	E	42.8	Very low	44.5	Very low	183 Å²	183	140.5 Å²	140.5	86%	0.855	84%	0.837	S	S	*	*			trans	-86.5	130.9	170.3	-148.1	155.8	126.3	0	0	109.1	P212	P212-E214 PolarHBondContact O-N 3.18Å
215	G	40.2	Very low	44.5	Very low	71 Å²	71	142 Å²	142	73%	0.732	84%	0.842	S	S	*	*			trans	-75.1	151.9	-168.6	0	0	0	0	0	114.9
216	L	45.2	Very low	44.3	Very low	172 Å²	172	143.4 Å²	143.4	90%	0.901	85%	0.849	S	S	*	*			trans	-122.4	118.4	155.9	-110.7	90.5	0	0	0	109.2
217	T	44.1	Very low	44.4	Very low	139 Å²	139	142.5 Å²	142.5	85%	0.853	85%	0.85	S	S	*	*			trans	-71	127.5	168.5	45	0	0	0	0	110.7
218	E	46.3	Very low	43.9	Very low	197 Å²	197	142 Å²	142	92%	0.921	85%	0.854	S	S	*	*			trans	-97.3	141.7	159.6	-75.5	-146.4	130.2	0	0	110.7
219	G	43.2	Very low	44	Very low	71 Å²	71	146.5 Å²	146.5	73%	0.732	87%	0.866	S	S	*	*			trans	-82.7	-175	-176	0	0	0	0	0	114.8
220	P	54.3	Low	44	Very low	129 Å²	129	147.6 Å²	147.6	84%	0.838	87%	0.87	S	S	*	*			trans	-96	140	-161.6	35	-30.6	0	0	0	113.7
221	V	39.6	Very low	44.1	Very low	223 Å²	223	149.4 Å²	149.4	100%	1.352	88%	0.878	S	S	*	*			trans	-146.3	0	147.3	-171.4	0	0	0	0	108.6

Retrieved 221 of 221 residues in 207.3 ms (Link to these results)

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