A0A096NHY2_PAPAN Loading...

Apoptosis-associated speck-like protein containing a CARD

AlphaFold DB , UniProt , Accession A0A096NHY2, Species PAPAN (Papio anubis, Olive baboon), Gene PYCARD, Length 195 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	45.2	Very low	76.1	Confident	235 Å²	235	69.9 Å²	69.9	100%	1.158	34%	0.338	S	S	*	.				0	106.4	0	-70.8	-68.3	-172.6	0	0	106.1	R3	M1-R3 PolarHBondContact O-N 3.32Å; M1-R3 VanDerWaalsContact O-N 3.12Å
2	G	59.2	Low	76.7	Confident	27 Å²	27	64.2 Å²	64.2	28%	0.278	31%	0.311	S	S	.	.			trans	-66.8	104.2	-165.3	0	0	0	0	0	112.2	A4 R5 D6 E62	G2-A4 PolarHBondContact O-N 2.96Å; G2-R5 WeakPolarHBondContact O-CB 3.36Å; G2-R5 PolarHBondContact O-N 3.3Å; G2-R5 VanDerWaalsContact O-N 3.13Å; G2-D6 PolarHBondContact O-N 2.69Å; G2-E62 WeakPolarHBondContact CA-OE2 3.47Å
3	R	71	Confident	77.3	Confident	169 Å²	169	69.8 Å²	69.8	64%	0.638	34%	0.336	S	S	*	.	H	α-helix	trans	-60.7	-33.8	179.9	-71.6	-175.8	178	178.9	-0.9	111.7	M1 A7 Q91	M1-R3 PolarHBondContact O-N 3.32Å; M1-R3 VanDerWaalsContact O-N 3.12Å; R3-A7 VanDerWaalsContact O-CB 3.31Å; R3-A7 WeakPolarHBondContact O-CB 3.44Å; R3-A7 PolarHBondContact O-N 2.94Å; R3-Q91 PolarHBondContact NH1-O 3.36Å; R3-Q91 VanDerWaalsContact NH1-O 3.08Å
4	A	73.9	Confident	77.7	Confident	7 Å²	7	72.8 Å²	72.8	6%	0.058	36%	0.355	C	S	.	.	H	α-helix	trans	-76.1	-32.4	177.2	0	0	0	0	0	112.4	G2 I8 E62 A66 T89	G2-A4 PolarHBondContact O-N 2.96Å; A4-I8 WeakPolarHBondContact O-CB 3.38Å; A4-I8 VanDerWaalsContact O-CD1 3.28Å; A4-I8 WeakPolarHBondContact O-CD1 3.28Å; A4-I8 WeakPolarHBondContact O-CG1 3.32Å; A4-I8 PolarHBondContact O-N 3.48Å; A4-E62 HydrophobicContact CB-CB 4.49Å; A4-E62 HydrophobicContact CB-CG 3.16Å; A4-A66 HydrophobicContact CB-CB 4.16Å; A4-T89 HydrophobicContact CB-CG2 3.61Å
5	R	82.4	Confident	78	Confident	83 Å²	83	68.9 Å²	68.9	31%	0.313	34%	0.336	S	S	.	.	H	α-helix	trans	-60.4	-48.2	169.2	-174.7	-175.5	-177.1	-93.6	3.8	111	G2 I8 L9 T53 D54 V57	G2-R5 WeakPolarHBondContact O-CB 3.36Å; G2-R5 PolarHBondContact O-N 3.3Å; G2-R5 VanDerWaalsContact O-N 3.13Å; R5-I8 PolarHBondContact O-N 2.99Å; R5-L9 PolarHBondContact O-N 2.76Å; R5-T53 HydrophobicContact CG-CG2 3.79Å; R5-T53 VanDerWaalsContact O-CG2 3.24Å; R5-T53 WeakPolarHBondContact O-CG2 3.45Å; R5-D54 IonicContact CZ-OD2 3.65Å; R5-D54 IonicContact NE-OD2 3.32Å; R5-D54 PolarHBondContact NE-OD2 3.44Å; R5-D54 IonicContact NH2-OD2 3.05Å; R5-D54 PolarHBondContact NH2-OD2 2.81Å; R5-V57 HydrophobicContact CB-CG2 4.05Å; R5-V57 HydrophobicContact CG-CG2 4.17Å
6	D	82.9	Confident	78.2	Confident	103 Å²	103	69.4 Å²	69.4	55%	0.551	35%	0.345	S	S	*	.	H	α-helix	trans	-63.7	-43.1	-179.5	-150.2	-113.2	0	0	0	111.6	G2 I8 L9 E10	G2-D6 PolarHBondContact O-N 2.69Å; D6-I8 PolarHBondContact O-N 3.26Å; D6-L9 WeakPolarHBondContact O-CB 3.4Å; D6-L9 PolarHBondContact O-N 3.07Å; D6-E10 PolarHBondContact O-N 3.19Å
7	A	82.4	Confident	78.3	Confident	6 Å²	6	70.5 Å²	70.5	5%	0.05	37%	0.367	C	S	.	.	H	α-helix	trans	-63.1	-40.5	175.8	0	0	0	0	0	113.2	R3 L9 A11 L85 A88 T89	R3-A7 VanDerWaalsContact O-CB 3.31Å; R3-A7 WeakPolarHBondContact O-CB 3.44Å; R3-A7 PolarHBondContact O-N 2.94Å; A7-L9 VanDerWaalsContact C-N 3.34Å; A7-A11 VanDerWaalsContact O-CB 3.29Å; A7-A11 WeakPolarHBondContact O-CB 3.46Å; A7-A11 PolarHBondContact O-N 3.15Å; A7-L85 HydrophobicContact CB-CG 4.29Å; A7-L85 WeakPolarHBondContact O-CD1 3.49Å; A7-A88 HydrophobicContact CB-CB 3.61Å; A7-T89 HydrophobicContact CB-CG2 4.5Å
8	I	84.7	Confident	78.4	Confident	0 Å²	0	75.7 Å²	75.7	0%	0	39%	0.389	C	S	.	.	H	α-helix	trans	-64.6	-42.3	174.6	-66.8	160.5	0	0	0	110.1	A4 R5 D6 A11 L12 T53 L56 V57 A66 T69 L85	A4-I8 WeakPolarHBondContact O-CB 3.38Å; A4-I8 VanDerWaalsContact O-CD1 3.28Å; A4-I8 WeakPolarHBondContact O-CD1 3.28Å; A4-I8 WeakPolarHBondContact O-CG1 3.32Å; A4-I8 PolarHBondContact O-N 3.48Å; R5-I8 PolarHBondContact O-N 2.99Å; D6-I8 PolarHBondContact O-N 3.26Å; I8-A11 PolarHBondContact O-N 3.32Å; I8-L12 HydrophobicContact CG2-CD1 3.92Å; I8-L12 HydrophobicContact CG2-CG 4.33Å; I8-L12 WeakPolarHBondContact O-CB 3.47Å; I8-L12 VanDerWaalsContact O-CG 3.27Å; I8-L12 WeakPolarHBondContact O-CG 3.35Å; I8-L12 PolarHBondContact O-N 2.94Å; I8-T53 HydrophobicContact CB-CG2 3.92Å; I8-T53 HydrophobicContact CG2-CG2 3.76Å; I8-L56 HydrophobicContact CG2-CD1 4.21Å; I8-V57 HydrophobicContact CD1-CG2 3.84Å; I8-A66 HydrophobicContact CD1-CB 4.04Å; I8-A66 HydrophobicContact CG1-CB 4.21Å; I8-T69 HydrophobicContact CG2-CG2 4.3Å; I8-L85 HydrophobicContact CB-CD1 4.37Å; I8-L85 HydrophobicContact CG1-CD1 3.99Å
9	L	86.6	Confident	78.6	Confident	22 Å²	22	74.4 Å²	74.4	12%	0.115	38%	0.381	C	S	.	.	H	α-helix	trans	-61.2	-52.6	178.6	-178.2	60.1	0	0	0	111.2	R5 D6 A7 A11 L12 E13 L50 T53	R5-L9 PolarHBondContact O-N 2.76Å; D6-L9 WeakPolarHBondContact O-CB 3.4Å; D6-L9 PolarHBondContact O-N 3.07Å; A7-L9 VanDerWaalsContact C-N 3.34Å; L9-A11 VanDerWaalsContact C-N 3.28Å; L9-A11 PolarHBondContact O-N 2.82Å; L9-L12 CarbonylContact O-C 3.57Å; L9-L12 PolarHBondContact O-N 3.18Å; L9-E13 HydrophobicContact CD1-CG 4.18Å; L9-E13 HydrophobicContact CG-CG 4.4Å; L9-E13 WeakPolarHBondContact O-CG 3.43Å; L9-E13 PolarHBondContact O-N 3.3Å; L9-L50 HydrophobicContact CD1-CB 4.06Å; L9-L50 HydrophobicContact CD1-CG 4.39Å; L9-L50 HydrophobicContact CD2-CD1 4.31Å; L9-T53 WeakPolarHBondContact CA-OG1 3.44Å; L9-T53 HydrophobicContact CB-CG2 4.11Å
10	E	84.6	Confident	78.8	Confident	113 Å²	113	72.1 Å²	72.1	53%	0.528	37%	0.37	S	S	.	.	H	α-helix	trans	-57.9	-42.7	179.3	-173.9	177	82.5	0	0	111.3	D6 L12 E13 N14	D6-E10 PolarHBondContact O-N 3.19Å; E10-L12 VanDerWaalsContact C-N 3.32Å; E10-L12 PolarHBondContact O-N 3.25Å; E10-E13 PolarHBondContact O-N 3.31Å; E10-N14 WeakPolarHBondContact O-CB 3.5Å; E10-N14 PolarHBondContact O-N 2.85Å
11	A	83.7	Confident	78.9	Confident	4 Å²	4	74.6 Å²	74.6	3%	0.033	38%	0.378	C	S	.	.	H	α-helix	trans	-64	-36.5	176.4	0	0	0	0	0	112.8	A7 I8 L9 L15 L73 T81 L85	A7-A11 VanDerWaalsContact O-CB 3.29Å; A7-A11 WeakPolarHBondContact O-CB 3.46Å; A7-A11 PolarHBondContact O-N 3.15Å; I8-A11 PolarHBondContact O-N 3.32Å; L9-A11 VanDerWaalsContact C-N 3.28Å; L9-A11 PolarHBondContact O-N 2.82Å; A11-L15 WeakPolarHBondContact O-CG 3.45Å; A11-L73 HydrophobicContact CB-CD1 3.93Å; A11-T81 HydrophobicContact CB-CG2 3.69Å; A11-L85 HydrophobicContact CB-CB 4.46Å; A11-L85 HydrophobicContact CB-CD1 3.5Å
12	L	83.9	Confident	80.7	Confident	1 Å²	1	68.2 Å²	68.2	1%	0.005	34%	0.344	C	S	.	.	H	α-helix	trans	-76.4	-32.5	177.1	-70.5	178.2	0	0	0	112.8	I8 L9 E10 N14 L15 F23 A49 L52 T53 L56	I8-L12 HydrophobicContact CG2-CD1 3.92Å; I8-L12 HydrophobicContact CG2-CG 4.33Å; I8-L12 WeakPolarHBondContact O-CB 3.47Å; I8-L12 VanDerWaalsContact O-CG 3.27Å; I8-L12 WeakPolarHBondContact O-CG 3.35Å; I8-L12 PolarHBondContact O-N 2.94Å; L9-L12 CarbonylContact O-C 3.57Å; L9-L12 PolarHBondContact O-N 3.18Å; E10-L12 VanDerWaalsContact C-N 3.32Å; E10-L12 PolarHBondContact O-N 3.25Å; L12-N14 VanDerWaalsContact C-N 3.34Å; L12-L15 HydrophobicContact CD2-CD1 3.61Å; L12-L15 WeakPolarHBondContact O-CB 3.49Å; L12-L15 PolarHBondContact O-N 3.05Å; L12-F23 HydrophobicContact CD2-CD1 3.99Å; L12-F23 HydrophobicContact CD2-CD2 4.42Å; L12-F23 HydrophobicContact CD2-CE1 3.86Å; L12-F23 HydrophobicContact CD2-CE2 4.31Å; L12-F23 HydrophobicContact CD2-CG 4.29Å; L12-F23 HydrophobicContact CD2-CZ 4.04Å; L12-A49 HydrophobicContact CB-CB 3.97Å; L12-L52 HydrophobicContact CD1-CB 4.23Å; L12-L52 HydrophobicContact CD1-CD2 3.9Å; L12-L52 HydrophobicContact CD1-CG 3.94Å; L12-L52 HydrophobicContact CD2-CD2 4.22Å; L12-T53 WeakPolarHBondContact CD1-OG1 2.94Å; L12-L56 HydrophobicContact CD1-CD1 4.43Å
13	E	84.3	Confident	81.9	Confident	137 Å²	137	67 Å²	67	64%	0.64	33%	0.331	S	S	*	.	H	α-helix	trans	-71.3	-30.5	174.7	-73.3	-166.2	95.2	0	0	112.4	L9 E10 L15 A49	L9-E13 HydrophobicContact CD1-CG 4.18Å; L9-E13 HydrophobicContact CG-CG 4.4Å; L9-E13 WeakPolarHBondContact O-CG 3.43Å; L9-E13 PolarHBondContact O-N 3.3Å; E10-E13 PolarHBondContact O-N 3.31Å; E13-L15 PolarHBondContact O-N 3.34Å; E13-A49 HydrophobicContact CG-CB 4.36Å
14	N	83.6	Confident	82.4	Confident	112 Å²	112	59.5 Å²	59.5	60%	0.599	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-8	174.4	-162	66.2	0	0	0	112.9	E10 L12 T81	E10-N14 WeakPolarHBondContact O-CB 3.5Å; E10-N14 PolarHBondContact O-N 2.85Å; L12-N14 VanDerWaalsContact C-N 3.34Å; N14-T81 HydrophobicContact CB-CG2 4.49Å
15	L	81.3	Confident	82.8	Confident	15 Å²	15	62.7 Å²	62.7	8%	0.079	32%	0.318	C	S	.	.	S	Bend	trans	-81.5	139.7	174.9	-62.5	169.6	0	0	0	111.1	A11 L12 E13 E19 L20 F23 L73 M76 L78	A11-L15 WeakPolarHBondContact O-CG 3.45Å; L12-L15 HydrophobicContact CD2-CD1 3.61Å; L12-L15 WeakPolarHBondContact O-CB 3.49Å; L12-L15 PolarHBondContact O-N 3.05Å; E13-L15 PolarHBondContact O-N 3.34Å; L15-E19 HydrophobicContact CB-CB 4.17Å; L15-E19 HydrophobicContact CD2-CB 3.91Å; L15-L20 HydrophobicContact CB-CB 4.26Å; L15-F23 HydrophobicContact CD1-CB 4.26Å; L15-F23 HydrophobicContact CD1-CD2 4.38Å; L15-F23 HydrophobicContact CD1-CG 4.35Å; L15-L73 HydrophobicContact CD1-CD2 4.25Å; L15-L73 HydrophobicContact CD2-CD2 3.76Å; L15-L73 HydrophobicContact CG-CD2 4.42Å; L15-M76 HydrophobicContact CD2-CE 4.3Å; L15-L78 HydrophobicContact CD2-CD1 3.19Å
16	T	81.5	Confident	82.6	Confident	77 Å²	77	62.1 Å²	62.1	47%	0.472	32%	0.318	S	S	.	.			trans	-70.3	161.6	165.4	66	0	0	0	0	111.1	E18 E19 L20	T16-E18 PolarHBondContact O-N 3.08Å; T16-E18 VanDerWaalsContact O-N 3.16Å; T16-E19 PolarHBondContact O-N 3.17Å; T16-E19 WeakPolarHBondContact OG1-CG 3.36Å; T16-E19 PolarHBondContact OG1-N 3.21Å; T16-L20 WeakPolarHBondContact O-CB 3.37Å; T16-L20 PolarHBondContact O-N 2.87Å
17	A	80.3	Confident	82.4	Confident	88 Å²	88	57.4 Å²	57.4	73%	0.727	29%	0.293	S	S	*	.	H	α-helix	trans	-56.9	-32.9	178.7	0	0	0	0	0	113.4	K21	A17-K21 WeakPolarHBondContact O-CB 3.49Å; A17-K21 PolarHBondContact O-N 3.03Å; A17-K21 VanDerWaalsContact O-N 3.13Å
18	E	80.4	Confident	82	Confident	164 Å²	164	59.3 Å²	59.3	77%	0.766	30%	0.302	S	S	*	.	H	α-helix	trans	-70.9	-42.1	175.8	-63.5	-171.5	84	0	0	111.6	T16 K21 K22	T16-E18 PolarHBondContact O-N 3.08Å; T16-E18 VanDerWaalsContact O-N 3.16Å; E18-K21 PolarHBondContact O-N 3.37Å; E18-K22 PolarHBondContact O-N 3.47Å
19	E	81.8	Confident	81.6	Confident	50 Å²	50	64 Å²	64	23%	0.234	34%	0.335	C	S	.	.	H	α-helix	trans	-68.8	-40.3	176.7	-70.5	-153.5	110.2	0	0	112	L15 T16 K21 K22 F23 M76 L78	L15-E19 HydrophobicContact CB-CB 4.17Å; L15-E19 HydrophobicContact CD2-CB 3.91Å; T16-E19 PolarHBondContact O-N 3.17Å; T16-E19 WeakPolarHBondContact OG1-CG 3.36Å; T16-E19 PolarHBondContact OG1-N 3.21Å; E19-K21 VanDerWaalsContact C-N 3.28Å; E19-K21 PolarHBondContact O-N 2.92Å; E19-K22 CarbonylContact O-C 3.51Å; E19-K22 WeakPolarHBondContact O-CA 3.2Å; E19-K22 WeakPolarHBondContact O-CB 3.37Å; E19-K22 PolarHBondContact O-N 3.41Å; E19-F23 WeakPolarHBondContact O-CB 3.31Å; E19-F23 PolarHBondContact O-N 3.44Å; E19-M76 HydrophobicContact CB-CE 3.68Å; E19-M76 HydrophobicContact CG-CE 4.19Å; E19-M76 WeakPolarHBondContact O-CE 3.12Å; E19-L78 WeakPolarHBondContact OE1-CD1 3.39Å
20	L	82.1	Confident	80.8	Confident	28 Å²	28	64.3 Å²	64.3	15%	0.147	34%	0.338	C	S	.	.	H	α-helix	trans	-62.5	-36.7	174.7	-171.1	141.9	0	0	0	111.6	L15 T16 F23 K24 A49	L15-L20 HydrophobicContact CB-CB 4.26Å; T16-L20 WeakPolarHBondContact O-CB 3.37Å; T16-L20 PolarHBondContact O-N 2.87Å; L20-F23 PolarHBondContact O-N 3.45Å; L20-K24 HydrophobicContact CD2-CD 3.95Å; L20-K24 VanDerWaalsContact CD2-NZ 3.34Å; L20-K24 VanDerWaalsContact O-CG 3.27Å; L20-K24 WeakPolarHBondContact O-CG 3.43Å; L20-K24 PolarHBondContact O-N 2.86Å; L20-A49 HydrophobicContact CD1-CB 4.23Å
21	K	81.7	Confident	79.8	Confident	125 Å²	125	64.3 Å²	64.3	54%	0.543	35%	0.347	S	S	.	.	H	α-helix	trans	-65.7	-39.9	171.8	-171.5	177.2	-177.9	178.1	0	112	A17 E18 E19 L25 L45	A17-K21 WeakPolarHBondContact O-CB 3.49Å; A17-K21 PolarHBondContact O-N 3.03Å; A17-K21 VanDerWaalsContact O-N 3.13Å; E18-K21 PolarHBondContact O-N 3.37Å; E19-K21 VanDerWaalsContact C-N 3.28Å; E19-K21 PolarHBondContact O-N 2.92Å; K21-L25 PolarHBondContact O-N 2.88Å; K21-L25 VanDerWaalsContact O-N 3.14Å; K21-L45 HydrophobicContact CG-CD2 4.47Å
22	K	82.6	Confident	79.2	Confident	102 Å²	102	65.4 Å²	65.4	44%	0.443	35%	0.353	S	S	.	.	H	α-helix	trans	-68.3	-39	176.2	-167.1	177	-178.3	-174.7	0	111.7	E18 E19 L25 K26 M76	E18-K22 PolarHBondContact O-N 3.47Å; E19-K22 CarbonylContact O-C 3.51Å; E19-K22 WeakPolarHBondContact O-CA 3.2Å; E19-K22 WeakPolarHBondContact O-CB 3.37Å; E19-K22 PolarHBondContact O-N 3.41Å; K22-L25 WeakPolarHBondContact O-CB 3.49Å; K22-L25 PolarHBondContact O-N 2.89Å; K22-K26 WeakPolarHBondContact O-CB 3.35Å; K22-K26 WeakPolarHBondContact O-CG 3.38Å; K22-K26 PolarHBondContact O-N 3.48Å; K22-M76 HydrophobicContact CB-CE 4.09Å; K22-M76 HydrophobicContact CD-CE 4.43Å; K22-M76 HydrophobicContact CD-CG 4.48Å; K22-M76 HydrophobicContact CG-CE 4.44Å; K22-M76 HydrophobicContact CG-CG 4.41Å
23	F	84.3	Confident	78.2	Confident	0 Å²	0	72.3 Å²	72.3	0%	0	38%	0.379	C	S	.	.	H	α-helix	trans	-58.1	-50.3	173.5	-178.9	-87.5	0	0	0	110.5	L12 L15 E19 L20 L25 K26 L27 L52 L56 T69 V72 L73 M76	L12-F23 HydrophobicContact CD2-CD1 3.99Å; L12-F23 HydrophobicContact CD2-CD2 4.42Å; L12-F23 HydrophobicContact CD2-CE1 3.86Å; L12-F23 HydrophobicContact CD2-CE2 4.31Å; L12-F23 HydrophobicContact CD2-CG 4.29Å; L12-F23 HydrophobicContact CD2-CZ 4.04Å; L15-F23 HydrophobicContact CD1-CB 4.26Å; L15-F23 HydrophobicContact CD1-CD2 4.38Å; L15-F23 HydrophobicContact CD1-CG 4.35Å; E19-F23 WeakPolarHBondContact O-CB 3.31Å; E19-F23 PolarHBondContact O-N 3.44Å; L20-F23 PolarHBondContact O-N 3.45Å; F23-L25 VanDerWaalsContact C-N 3.3Å; F23-L25 PolarHBondContact O-N 3.24Å; F23-K26 PolarHBondContact O-N 3.48Å; F23-K26 VanDerWaalsContact O-N 3.16Å; F23-L27 HydrophobicContact CE1-CD2 4.49Å; F23-L27 WeakPolarHBondContact O-CB 3.36Å; F23-L27 PolarHBondContact O-N 3.06Å; F23-L52 HydrophobicContact CD1-CD2 4.18Å; F23-L52 HydrophobicContact CE1-CD2 4.16Å; F23-L56 HydrophobicContact CE1-CD1 4.33Å; F23-L56 HydrophobicContact CZ-CD1 4.48Å; F23-T69 HydrophobicContact CE2-CG2 3.83Å; F23-T69 HydrophobicContact CZ-CG2 3.81Å; F23-V72 HydrophobicContact CD2-CB 4.03Å; F23-V72 HydrophobicContact CD2-CG1 3.32Å; F23-V72 HydrophobicContact CE2-CB 3.66Å; F23-V72 HydrophobicContact CE2-CG1 3.49Å; F23-V72 VanDerWaalsContact CE2-CG1 3.49Å; F23-V72 HydrophobicContact CG-CG1 3.98Å; F23-V72 HydrophobicContact CZ-CB 4.35Å; F23-V72 HydrophobicContact CZ-CG1 4.27Å; F23-L73 HydrophobicContact CD2-CD2 4.2Å; F23-L73 HydrophobicContact CD2-CG 4.47Å; F23-L73 HydrophobicContact CE2-CD2 4.41Å; F23-L73 HydrophobicContact CE2-CG 4.25Å; F23-M76 WeakPolarHBondContact CA-SD 3.2Å; F23-M76 HydrophobicContact CB-CE 4.25Å; F23-M76 HydrophobicContact CB-SD 3.64Å; F23-M76 HydrophobicContact CD2-SD 4.05Å; F23-M76 HydrophobicContact CG-SD 4.35Å; F23-M76 PolarHBondContact N-SD 3.04Å
24	K	82.1	Confident	76.7	Confident	12 Å²	12	75 Å²	75	5%	0.052	39%	0.391	C	S	.	.	H	α-helix	trans	-58.5	-39.2	176	-70.8	169.2	175.9	-175.6	0	112.5	L20 L28 L44 L45 M47 L52	L20-K24 HydrophobicContact CD2-CD 3.95Å; L20-K24 VanDerWaalsContact CD2-NZ 3.34Å; L20-K24 VanDerWaalsContact O-CG 3.27Å; L20-K24 WeakPolarHBondContact O-CG 3.43Å; L20-K24 PolarHBondContact O-N 2.86Å; K24-L28 WeakPolarHBondContact O-CG 3.19Å; K24-L28 PolarHBondContact O-N 3.4Å; K24-L44 VanDerWaalsContact CD-O 3.23Å; K24-L44 WeakPolarHBondContact CD-O 3.41Å; K24-L44 WeakPolarHBondContact CE-O 3.45Å; K24-L44 PolarHBondContact NZ-O 3.01Å; K24-L45 HydrophobicContact CD-CD2 4.46Å; K24-L45 PolarHBondContact NZ-O 3.24Å; K24-M47 PolarHBondContact NZ-O 3.16Å; K24-L52 HydrophobicContact CG-CD2 4.39Å
25	L	80.8	Confident	75.6	Confident	74 Å²	74	73.8 Å²	73.8	39%	0.387	41%	0.405	S	S	.	.	H	α-helix	trans	-68.1	-42.4	175.4	-82.6	166.5	0	0	0	112.5	K21 K22 F23 L27 L28 S29	K21-L25 PolarHBondContact O-N 2.88Å; K21-L25 VanDerWaalsContact O-N 3.14Å; K22-L25 WeakPolarHBondContact O-CB 3.49Å; K22-L25 PolarHBondContact O-N 2.89Å; F23-L25 VanDerWaalsContact C-N 3.3Å; F23-L25 PolarHBondContact O-N 3.24Å; L25-L27 VanDerWaalsContact C-N 3.33Å; L25-L28 WeakPolarHBondContact O-CB 3.11Å; L25-L28 PolarHBondContact O-N 3.06Å; L25-S29 PolarHBondContact O-N 3.39Å
26	K	78.8	Confident	74.9	Confident	72 Å²	72	76.8 Å²	76.8	31%	0.313	42%	0.416	S	S	.	.	H	α-helix	trans	-68.5	-34.1	177.9	-73.7	-69.1	-170.3	161.9	0	111.9	K22 F23 L28 S29 V30 V72 D75 M76	K22-K26 WeakPolarHBondContact O-CB 3.35Å; K22-K26 WeakPolarHBondContact O-CG 3.38Å; K22-K26 PolarHBondContact O-N 3.48Å; F23-K26 PolarHBondContact O-N 3.48Å; F23-K26 VanDerWaalsContact O-N 3.16Å; K26-L28 PolarHBondContact O-N 2.96Å; K26-S29 CarbonylContact O-C 3.54Å; K26-S29 PolarHBondContact O-N 2.81Å; K26-V30 WeakPolarHBondContact O-CB 3.1Å; K26-V30 PolarHBondContact O-N 3.21Å; K26-V72 HydrophobicContact CB-CG1 3.66Å; K26-D75 WeakPolarHBondContact CD-OD1 3.44Å; K26-D75 WeakPolarHBondContact CE-OD1 3.1Å; K26-D75 IonicContact NZ-OD1 2.62Å; K26-D75 PolarHBondContact NZ-OD1 2.68Å; K26-M76 HydrophobicContact CG-CG 4.36Å
27	L	79.3	Confident	74.2	Confident	4 Å²	4	75.2 Å²	75.2	2%	0.021	42%	0.415	C	S	.	.	H	α-helix	trans	-62.2	-26	172.4	-163.5	72.3	0	0	0	112.9	F23 L25 V30 L44 L56 L68 V72	F23-L27 HydrophobicContact CE1-CD2 4.49Å; F23-L27 WeakPolarHBondContact O-CB 3.36Å; F23-L27 PolarHBondContact O-N 3.06Å; L25-L27 VanDerWaalsContact C-N 3.33Å; L27-V30 HydrophobicContact CD1-CG1 4.48Å; L27-V30 WeakPolarHBondContact O-CG1 3.47Å; L27-L44 HydrophobicContact CD2-CD1 4.22Å; L27-L44 HydrophobicContact CD2-CD2 3.71Å; L27-L56 HydrophobicContact CD1-CD2 4.26Å; L27-L56 HydrophobicContact CD2-CD2 3.94Å; L27-L68 HydrophobicContact CD1-CD2 3.63Å; L27-L68 HydrophobicContact CD1-CG 3.93Å; L27-V72 HydrophobicContact CD1-CG2 4.25Å
28	L	73.3	Confident	73.9	Confident	46 Å²	46	79.2 Å²	79.2	24%	0.241	41%	0.411	C	S	.	.	H	α-helix	trans	-81.5	-23.8	173	-66.5	161.5	0	0	0	112.9	K24 L25 K26 R41 L44	K24-L28 WeakPolarHBondContact O-CG 3.19Å; K24-L28 PolarHBondContact O-N 3.4Å; L25-L28 WeakPolarHBondContact O-CB 3.11Å; L25-L28 PolarHBondContact O-N 3.06Å; K26-L28 PolarHBondContact O-N 2.96Å; L28-R41 HydrophobicContact CD1-CB 3.62Å; L28-R41 HydrophobicContact CD1-CG 3.57Å; L28-R41 HydrophobicContact CD2-CB 4.14Å; L28-L44 HydrophobicContact CD2-CD1 4.06Å; L28-L44 HydrophobicContact CG-CD1 4.3Å
29	S	75.7	Confident	73.6	Confident	97 Å²	97	71.6 Å²	71.6	68%	0.678	38%	0.376	S	S	*	.	H	α-helix	trans	-97.2	-18.8	-176.4	-162	0	0	0	0	113.2	L25 K26	L25-S29 PolarHBondContact O-N 3.39Å; K26-S29 CarbonylContact O-C 3.54Å; K26-S29 PolarHBondContact O-N 2.81Å
30	V	71.1	Confident	73.2	Confident	30 Å²	30	73.4 Å²	73.4	18%	0.182	39%	0.392	C	S	.	.	S	Bend	trans	-70.9	135.5	-179.6	70.3	0	0	0	0	110.2	K26 L27 L32 L68 V72	K26-V30 WeakPolarHBondContact O-CB 3.1Å; K26-V30 PolarHBondContact O-N 3.21Å; L27-V30 HydrophobicContact CD1-CG1 4.48Å; L27-V30 WeakPolarHBondContact O-CG1 3.47Å; V30-L32 PolarHBondContact O-N 3.47Å; V30-L68 HydrophobicContact CG1-CD1 3.78Å; V30-L68 HydrophobicContact CG2-CD1 4.05Å; V30-V72 HydrophobicContact CB-CG2 4.45Å; V30-V72 HydrophobicContact CG1-CG2 4.37Å
31	P	63.4	Low	72.7	Confident	112 Å²	112	78.6 Å²	78.6	73%	0.727	41%	0.409	S	S	*	.			trans	-65.7	115.8	172.8	25.8	-32.4	0	0	0	109.6
32	L	70.6	Confident	72.2	Confident	28 Å²	28	75.2 Å²	75.2	15%	0.147	41%	0.409	C	S	.	.	P	Polyproline II helix	trans	-82.6	150.6	174	-68.5	155.8	0	0	0	109.7	V30 R38 Y60 L68	V30-L32 PolarHBondContact O-N 3.47Å; L32-R38 HydrophobicContact CD1-CB 4.15Å; L32-R38 HydrophobicContact CD1-CG 3.65Å; L32-Y60 HydrophobicContact CD1-CE1 4.46Å; L32-Y60 HydrophobicContact CD2-CD1 4.24Å; L32-Y60 HydrophobicContact CD2-CE1 3.51Å; L32-L68 HydrophobicContact CD2-CD1 4.31Å; L32-L68 HydrophobicContact CD2-CD2 3.78Å
33	R	63.5	Low	71.7	Confident	146 Å²	146	72.3 Å²	72.3	55%	0.551	41%	0.405	S	S	*	.	P	Polyproline II helix	trans	-63.3	144.9	176.3	-170.9	177.5	-69.7	174	2.2	110	G35 Y36 Y64	R33-G35 PolarHBondContact O-N 3.12Å; R33-Y36 HydrophobicContact CB-CD2 4.06Å; R33-Y36 HydrophobicContact CB-CE2 4.47Å; R33-Y36 PolarHBondContact O-N 3.37Å; R33-Y36 VanDerWaalsContact O-N 3.16Å; R33-Y64 HydrophobicContact CB-CE1 4.47Å; R33-Y64 HydrophobicContact CB-CE2 4.27Å; R33-Y64 PolarHBondContact N-OH 2.71Å
34	E	51.9	Low	71.2	Confident	193 Å²	193	72.4 Å²	72.4	90%	0.902	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	129.5	179.5	-58.4	-175.2	94.4	0	0	110.6
35	G	60.7	Low	70.6	Confident	87 Å²	87	75.3 Å²	75.3	90%	0.897	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	98	-11.8	-177.1	0	0	0	0	0	115.9	R33	R33-G35 PolarHBondContact O-N 3.12Å
36	Y	66.6	Low	70.3	Confident	78 Å²	78	76.8 Å²	76.8	31%	0.306	44%	0.438	S	S	.	.	P	Polyproline II helix	trans	-96	126.5	176	-70.3	-89	0	0	0	112.3	R33 Y60 L61 Y64	R33-Y36 HydrophobicContact CB-CD2 4.06Å; R33-Y36 HydrophobicContact CB-CE2 4.47Å; R33-Y36 PolarHBondContact O-N 3.37Å; R33-Y36 VanDerWaalsContact O-N 3.16Å; Y36-Y60 AromaticContact CD1-CD1 3.73Å; Y36-Y60 HydrophobicContact CD1-CD1 3.73Å; Y36-Y60 HydrophobicContact CD1-CE1 4.39Å; Y36-Y60 HydrophobicContact CG-CD1 4.12Å; Y36-L61 HydrophobicContact CE1-CD1 4.33Å; Y36-Y64 HydrophobicContact CD2-CE1 4.23Å; Y36-Y64 HydrophobicContact CE1-CD1 4.49Å; Y36-Y64 HydrophobicContact CE2-CD1 4.45Å; Y36-Y64 HydrophobicContact CE2-CE1 4.43Å; Y36-Y64 HydrophobicContact CG-CE1 4.31Å
37	G	67.9	Low	70.3	Confident	43 Å²	43	74.9 Å²	74.9	44%	0.443	43%	0.43	S	S	.	.	P	Polyproline II helix	trans	-74.7	146.5	175.9	0	0	0	0	0	112.2	Y60	G37-Y60 PolarHBondContact O-OH 3.33Å
38	R	73.6	Confident	70.4	Confident	173 Å²	173	80.1 Å²	80.1	65%	0.653	46%	0.458	S	S	*	.	P	Polyproline II helix	trans	-78.2	133.7	176	-44.2	-163.5	162.8	161.1	-6.4	109.9	L32	L32-R38 HydrophobicContact CD1-CB 4.15Å; L32-R38 HydrophobicContact CD1-CG 3.65Å
39	I	73.8	Confident	70.8	Confident	4 Å²	4	78.9 Å²	78.9	2%	0.021	45%	0.454	C	S	.	.	P	Polyproline II helix	trans	-69.4	130.3	171.2	-54	169.9	0	0	0	108.1	R41 L44 M47 K55 F59 Y60	I39-R41 PolarHBondContact O-N 2.84Å; I39-L44 HydrophobicContact CB-CD1 3.83Å; I39-L44 HydrophobicContact CB-CG 3.95Å; I39-L44 HydrophobicContact CG2-CD1 4.08Å; I39-L44 HydrophobicContact CG2-CD2 4.38Å; I39-L44 HydrophobicContact CG2-CG 3.68Å; I39-L44 WeakPolarHBondContact O-CD1 3.39Å; I39-M47 HydrophobicContact CG2-CE 4.29Å; I39-K55 HydrophobicContact CD1-CG 3.81Å; I39-F59 HydrophobicContact CG1-CD1 4.17Å; I39-Y60 HydrophobicContact CD1-CD2 4.46Å; I39-Y60 HydrophobicContact CD1-CE2 3.63Å; I39-Y60 HydrophobicContact CG1-CE2 4Å
40	P	73.4	Confident	71.2	Confident	88 Å²	88	78.6 Å²	78.6	57%	0.571	45%	0.445	S	S	*	.	P	Polyproline II helix	trans	-62.7	136.1	-179.7	21.8	-31.3	0	0	0	111.4	G42 A43 L44	P40-G42 PolarHBondContact O-N 2.58Å; P40-G42 VanDerWaalsContact O-N 3.16Å; P40-A43 HydrophobicContact CG-CB 4.09Å; P40-A43 PolarHBondContact O-N 3.2Å; P40-A43 VanDerWaalsContact O-N 3.1Å; P40-L44 PolarHBondContact O-N 3.09Å; P40-L44 VanDerWaalsContact O-N 3.07Å
41	R	71.1	Confident	71.9	Confident	137 Å²	137	81.4 Å²	81.4	52%	0.517	46%	0.459	S	S	.	.	H	α-helix	trans	-52.1	-39.5	-177.1	179.2	172.5	-178	-173.5	-1.9	113.5	L28 I39 L44 L45	L28-R41 HydrophobicContact CD1-CB 3.62Å; L28-R41 HydrophobicContact CD1-CG 3.57Å; L28-R41 HydrophobicContact CD2-CB 4.14Å; I39-R41 PolarHBondContact O-N 2.84Å; R41-L44 PolarHBondContact O-N 3.47Å; R41-L45 HydrophobicContact CG-CD1 3.62Å; R41-L45 HydrophobicContact CG-CG 4.34Å; R41-L45 WeakPolarHBondContact O-CB 3.29Å; R41-L45 WeakPolarHBondContact O-CD1 3.35Å; R41-L45 WeakPolarHBondContact O-CG 3.46Å; R41-L45 PolarHBondContact O-N 3.47Å
42	G	72.1	Confident	72.8	Confident	53 Å²	53	76 Å²	76	55%	0.546	42%	0.424	S	S	.	.	H	α-helix	trans	-62.6	-44.3	-179.8	0	0	0	0	0	112.6	P40 S46	P40-G42 PolarHBondContact O-N 2.58Å; P40-G42 VanDerWaalsContact O-N 3.16Å; G42-S46 PolarHBondContact O-N 3.24Å
43	A	72.1	Confident	73.6	Confident	42 Å²	42	74.7 Å²	74.7	35%	0.347	42%	0.417	S	S	.	.	H	α-helix	trans	-68.5	-42.1	176.5	0	0	0	0	0	111.2	P40 L45 S46 M47	P40-A43 HydrophobicContact CG-CB 4.09Å; P40-A43 PolarHBondContact O-N 3.2Å; P40-A43 VanDerWaalsContact O-N 3.1Å; A43-L45 VanDerWaalsContact C-N 3.35Å; A43-L45 PolarHBondContact O-N 2.96Å; A43-S46 PolarHBondContact O-N 2.83Å; A43-M47 VanDerWaalsContact C-CE 3.48Å; A43-M47 HydrophobicContact CB-CE 3.67Å; A43-M47 VanDerWaalsContact O-CE 3.28Å; A43-M47 WeakPolarHBondContact O-CE 3.39Å; A43-M47 WeakPolarHBondContact O-CG 3.49Å; A43-M47 PolarHBondContact O-N 3.38Å
44	L	72.8	Confident	74.6	Confident	2 Å²	2	71.3 Å²	71.3	1%	0.01	41%	0.41	C	S	.	.	H	α-helix	trans	-58.3	-43.7	176.8	-90.9	162.9	0	0	0	112.5	K24 L27 L28 I39 P40 R41 S46 M47 L52	K24-L44 VanDerWaalsContact CD-O 3.23Å; K24-L44 WeakPolarHBondContact CD-O 3.41Å; K24-L44 WeakPolarHBondContact CE-O 3.45Å; K24-L44 PolarHBondContact NZ-O 3.01Å; L27-L44 HydrophobicContact CD2-CD1 4.22Å; L27-L44 HydrophobicContact CD2-CD2 3.71Å; L28-L44 HydrophobicContact CD2-CD1 4.06Å; L28-L44 HydrophobicContact CG-CD1 4.3Å; I39-L44 HydrophobicContact CB-CD1 3.83Å; I39-L44 HydrophobicContact CB-CG 3.95Å; I39-L44 HydrophobicContact CG2-CD1 4.08Å; I39-L44 HydrophobicContact CG2-CD2 4.38Å; I39-L44 HydrophobicContact CG2-CG 3.68Å; I39-L44 WeakPolarHBondContact O-CD1 3.39Å; P40-L44 PolarHBondContact O-N 3.09Å; P40-L44 VanDerWaalsContact O-N 3.07Å; R41-L44 PolarHBondContact O-N 3.47Å; L44-S46 VanDerWaalsContact C-N 3.35Å; L44-S46 PolarHBondContact O-N 3.03Å; L44-M47 PolarHBondContact O-N 3.16Å; L44-L52 HydrophobicContact CD2-CD1 3.37Å
45	L	70.8	Confident	76.1	Confident	73 Å²	73	65.7 Å²	65.7	38%	0.382	38%	0.382	S	S	.	.	H	α-helix	trans	-66.1	-36.3	-177.4	-78.4	160.9	0	0	0	112.7	K21 K24 R41 A43	K21-L45 HydrophobicContact CG-CD2 4.47Å; K24-L45 HydrophobicContact CD-CD2 4.46Å; K24-L45 PolarHBondContact NZ-O 3.24Å; R41-L45 HydrophobicContact CG-CD1 3.62Å; R41-L45 HydrophobicContact CG-CG 4.34Å; R41-L45 WeakPolarHBondContact O-CB 3.29Å; R41-L45 WeakPolarHBondContact O-CD1 3.35Å; R41-L45 WeakPolarHBondContact O-CG 3.46Å; R41-L45 PolarHBondContact O-N 3.47Å; A43-L45 VanDerWaalsContact C-N 3.35Å; A43-L45 PolarHBondContact O-N 2.96Å
46	S	74.9	Confident	77.1	Confident	105 Å²	105	61.5 Å²	61.5	73%	0.734	34%	0.34	S	S	*	.	H	α-helix	trans	-81.6	-12.1	179.4	-79.4	0	0	0	0	115.4	G42 A43 L44	G42-S46 PolarHBondContact O-N 3.24Å; A43-S46 PolarHBondContact O-N 2.83Å; L44-S46 VanDerWaalsContact C-N 3.35Å; L44-S46 PolarHBondContact O-N 3.03Å
47	M	77.3	Confident	77.9	Confident	32 Å²	32	59.1 Å²	59.1	16%	0.158	33%	0.333	C	S	.	.			trans	-81.2	138.1	178.6	-74.3	178.9	-128.1	0	0	112.6	K24 I39 A43 L44 D51 L52 K55	K24-M47 PolarHBondContact NZ-O 3.16Å; I39-M47 HydrophobicContact CG2-CE 4.29Å; A43-M47 VanDerWaalsContact C-CE 3.48Å; A43-M47 HydrophobicContact CB-CE 3.67Å; A43-M47 VanDerWaalsContact O-CE 3.28Å; A43-M47 WeakPolarHBondContact O-CE 3.39Å; A43-M47 WeakPolarHBondContact O-CG 3.49Å; A43-M47 PolarHBondContact O-N 3.38Å; L44-M47 PolarHBondContact O-N 3.16Å; M47-D51 HydrophobicContact CB-CB 3.98Å; M47-D51 HydrophobicContact CG-CB 4.02Å; M47-L52 HydrophobicContact CB-CB 4.41Å; M47-K55 HydrophobicContact CE-CG 4.23Å; M47-K55 HydrophobicContact SD-CB 3.93Å; M47-K55 HydrophobicContact SD-CG 4.11Å
48	D	81.6	Confident	78.7	Confident	114 Å²	114	61.4 Å²	61.4	61%	0.61	34%	0.342	S	S	*	.			trans	-73.5	169.4	169	-64.3	-76.3	0	0	0	111.8	L50 D51 L52	D48-L50 PolarHBondContact O-N 3.34Å; D48-D51 PolarHBondContact O-N 3.49Å; D48-L52 WeakPolarHBondContact O-CB 3.48Å; D48-L52 PolarHBondContact O-N 2.91Å
49	A	81.5	Confident	79	Confident	19 Å²	19	57.6 Å²	57.6	16%	0.157	33%	0.331	C	S	.	.	H	α-helix	trans	-55.8	-37.3	-178.8	0	0	0	0	0	112.4	L12 E13 L20 T53	L12-A49 HydrophobicContact CB-CB 3.97Å; E13-A49 HydrophobicContact CG-CB 4.36Å; L20-A49 HydrophobicContact CD1-CB 4.23Å; A49-T53 WeakPolarHBondContact O-CB 3.23Å; A49-T53 PolarHBondContact O-N 2.9Å; A49-T53 PolarHBondContact O-OG1 3.5Å
50	L	83.9	Confident	79.2	Confident	92 Å²	92	57.5 Å²	57.5	48%	0.482	33%	0.33	S	S	.	.	H	α-helix	trans	-71.7	-49.3	180	-166.7	140.5	0	0	0	112.3	L9 D48 L52 T53 D54	L9-L50 HydrophobicContact CD1-CB 4.06Å; L9-L50 HydrophobicContact CD1-CG 4.39Å; L9-L50 HydrophobicContact CD2-CD1 4.31Å; D48-L50 PolarHBondContact O-N 3.34Å; L50-L52 VanDerWaalsContact C-N 3.31Å; L50-L52 PolarHBondContact O-N 3.38Å; L50-T53 WeakPolarHBondContact O-CB 3.34Å; L50-T53 PolarHBondContact O-N 3.5Å; L50-D54 PolarHBondContact O-N 2.94Å
51	D	86.3	Confident	79.6	Confident	88 Å²	88	58.1 Å²	58.1	47%	0.471	33%	0.328	S	S	.	.	H	α-helix	trans	-61.9	-38.9	174	-75.6	-94.8	0	0	0	112.2	M47 D48 D54 K55	M47-D51 HydrophobicContact CB-CB 3.98Å; M47-D51 HydrophobicContact CG-CB 4.02Å; D48-D51 PolarHBondContact O-N 3.49Å; D51-D54 PolarHBondContact O-N 3.49Å; D51-K55 VanDerWaalsContact O-CB 3.25Å; D51-K55 WeakPolarHBondContact O-CB 3.49Å; D51-K55 PolarHBondContact O-N 3.04Å
52	L	83.6	Confident	79.9	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-64	-44.2	176.9	179.7	57.8	0	0	0	111.1	L12 F23 K24 L44 M47 D48 L50 K55 L56	L12-L52 HydrophobicContact CD1-CB 4.23Å; L12-L52 HydrophobicContact CD1-CD2 3.9Å; L12-L52 HydrophobicContact CD1-CG 3.94Å; L12-L52 HydrophobicContact CD2-CD2 4.22Å; F23-L52 HydrophobicContact CD1-CD2 4.18Å; F23-L52 HydrophobicContact CE1-CD2 4.16Å; K24-L52 HydrophobicContact CG-CD2 4.39Å; L44-L52 HydrophobicContact CD2-CD1 3.37Å; M47-L52 HydrophobicContact CB-CB 4.41Å; D48-L52 WeakPolarHBondContact O-CB 3.48Å; D48-L52 PolarHBondContact O-N 2.91Å; L50-L52 VanDerWaalsContact C-N 3.31Å; L50-L52 PolarHBondContact O-N 3.38Å; L52-K55 PolarHBondContact O-N 3.25Å; L52-L56 HydrophobicContact CD1-CD1 4.22Å; L52-L56 HydrophobicContact CD1-CG 4.22Å; L52-L56 HydrophobicContact CG-CD1 4.02Å; L52-L56 HydrophobicContact CG-CG 4.48Å; L52-L56 WeakPolarHBondContact O-CB 3.17Å; L52-L56 VanDerWaalsContact O-CG 3.24Å; L52-L56 WeakPolarHBondContact O-CG 3.43Å; L52-L56 PolarHBondContact O-N 3.24Å
53	T	85.5	Confident	80.1	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-59.4	-51	175.7	-60.7	0	0	0	0	111.1	R5 I8 L9 L12 A49 L50 K55 L56 V57	R5-T53 HydrophobicContact CG-CG2 3.79Å; R5-T53 VanDerWaalsContact O-CG2 3.24Å; R5-T53 WeakPolarHBondContact O-CG2 3.45Å; I8-T53 HydrophobicContact CB-CG2 3.92Å; I8-T53 HydrophobicContact CG2-CG2 3.76Å; L9-T53 WeakPolarHBondContact CA-OG1 3.44Å; L9-T53 HydrophobicContact CB-CG2 4.11Å; L12-T53 WeakPolarHBondContact CD1-OG1 2.94Å; A49-T53 WeakPolarHBondContact O-CB 3.23Å; A49-T53 PolarHBondContact O-N 2.9Å; A49-T53 PolarHBondContact O-OG1 3.5Å; L50-T53 WeakPolarHBondContact O-CB 3.34Å; L50-T53 PolarHBondContact O-N 3.5Å; T53-K55 VanDerWaalsContact C-N 3.28Å; T53-K55 PolarHBondContact O-N 3.15Å; T53-L56 PolarHBondContact O-N 3.35Å; T53-L56 VanDerWaalsContact O-N 3.17Å; T53-V57 WeakPolarHBondContact O-CG2 3.41Å; T53-V57 PolarHBondContact O-N 2.9Å
54	D	85.3	Confident	80.4	Confident	75 Å²	75	55.7 Å²	55.7	40%	0.401	31%	0.313	S	S	.	.	H	α-helix	trans	-61	-42.9	-178.7	-159.7	-93.6	0	0	0	110.7	R5 L50 D51 L56 V57 S58	R5-D54 IonicContact CZ-OD2 3.65Å; R5-D54 IonicContact NE-OD2 3.32Å; R5-D54 PolarHBondContact NE-OD2 3.44Å; R5-D54 IonicContact NH2-OD2 3.05Å; R5-D54 PolarHBondContact NH2-OD2 2.81Å; L50-D54 PolarHBondContact O-N 2.94Å; D51-D54 PolarHBondContact O-N 3.49Å; D54-L56 PolarHBondContact O-N 3.3Å; D54-V57 PolarHBondContact O-N 3.5Å; D54-S58 WeakPolarHBondContact O-CB 3.29Å; D54-S58 PolarHBondContact O-N 2.85Å
55	K	84.4	Confident	80.8	Confident	74 Å²	74	55.6 Å²	55.6	32%	0.322	31%	0.312	S	S	.	.	H	α-helix	trans	-63.3	-44	175.4	-166.1	66.5	173.4	-176.2	0	111.9	I39 M47 D51 L52 T53 S58 F59	I39-K55 HydrophobicContact CD1-CG 3.81Å; M47-K55 HydrophobicContact CE-CG 4.23Å; M47-K55 HydrophobicContact SD-CB 3.93Å; M47-K55 HydrophobicContact SD-CG 4.11Å; D51-K55 VanDerWaalsContact O-CB 3.25Å; D51-K55 WeakPolarHBondContact O-CB 3.49Å; D51-K55 PolarHBondContact O-N 3.04Å; L52-K55 PolarHBondContact O-N 3.25Å; T53-K55 VanDerWaalsContact C-N 3.28Å; T53-K55 PolarHBondContact O-N 3.15Å; K55-S58 PolarHBondContact O-N 3.34Å; K55-F59 HydrophobicContact CD-CD2 4.29Å; K55-F59 WeakPolarHBondContact O-CB 3.32Å; K55-F59 PolarHBondContact O-N 2.99Å
56	L	81.6	Confident	81.3	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-60.8	-46.1	178.2	-77.9	168.5	0	0	0	111.2	I8 L12 F23 L27 L52 T53 D54 Y60	I8-L56 HydrophobicContact CG2-CD1 4.21Å; L12-L56 HydrophobicContact CD1-CD1 4.43Å; F23-L56 HydrophobicContact CE1-CD1 4.33Å; F23-L56 HydrophobicContact CZ-CD1 4.48Å; L27-L56 HydrophobicContact CD1-CD2 4.26Å; L27-L56 HydrophobicContact CD2-CD2 3.94Å; L52-L56 HydrophobicContact CD1-CD1 4.22Å; L52-L56 HydrophobicContact CD1-CG 4.22Å; L52-L56 HydrophobicContact CG-CD1 4.02Å; L52-L56 HydrophobicContact CG-CG 4.48Å; L52-L56 WeakPolarHBondContact O-CB 3.17Å; L52-L56 VanDerWaalsContact O-CG 3.24Å; L52-L56 WeakPolarHBondContact O-CG 3.43Å; L52-L56 PolarHBondContact O-N 3.24Å; T53-L56 PolarHBondContact O-N 3.35Å; T53-L56 VanDerWaalsContact O-N 3.17Å; D54-L56 PolarHBondContact O-N 3.3Å; L56-Y60 HydrophobicContact CD2-CD2 3.66Å; L56-Y60 HydrophobicContact CD2-CE2 3.86Å; L56-Y60 WeakPolarHBondContact O-CA 3.36Å; L56-Y60 WeakPolarHBondContact O-CB 3.3Å; L56-Y60 PolarHBondContact O-N 3.43Å
57	V	83.7	Confident	81.7	Confident	28 Å²	28	51.9 Å²	51.9	17%	0.17	28%	0.282	C	S	.	.	H	α-helix	trans	-68.1	-36.9	178.7	174.7	0	0	0	0	111.6	R5 I8 T53 D54 L61 E62	R5-V57 HydrophobicContact CB-CG2 4.05Å; R5-V57 HydrophobicContact CG-CG2 4.17Å; I8-V57 HydrophobicContact CD1-CG2 3.84Å; T53-V57 WeakPolarHBondContact O-CG2 3.41Å; T53-V57 PolarHBondContact O-N 2.9Å; D54-V57 PolarHBondContact O-N 3.5Å; V57-L61 CarbonylContact O-C 3.07Å; V57-L61 WeakPolarHBondContact O-CA 3.44Å; V57-L61 PolarHBondContact O-N 3Å; V57-L61 VanDerWaalsContact O-N 3.08Å; V57-E62 HydrophobicContact CG1-CB 4.01Å
58	S	83.6	Confident	82	Confident	91 Å²	91	50.6 Å²	50.6	64%	0.636	28%	0.275	S	S	*	.	H	α-helix	trans	-75.9	-36.6	-179.3	-161.6	0	0	0	0	112.8	D54 K55	D54-S58 WeakPolarHBondContact O-CB 3.29Å; D54-S58 PolarHBondContact O-N 2.85Å; K55-S58 PolarHBondContact O-N 3.34Å
59	F	80.3	Confident	82.1	Confident	93 Å²	93	45.2 Å²	45.2	41%	0.408	25%	0.246	S	C	.	.	H	α-helix	trans	-90.5	-37.1	-177	-126.2	-108.4	0	0	0	113.5	I39 K55	I39-F59 HydrophobicContact CG1-CD1 4.17Å; K55-F59 HydrophobicContact CD-CD2 4.29Å; K55-F59 WeakPolarHBondContact O-CB 3.32Å; K55-F59 PolarHBondContact O-N 2.99Å
60	Y	77.4	Confident	82.3	Confident	2 Å²	2	44.3 Å²	44.3	1%	0.008	24%	0.239	C	C	.	.	H	α-helix	trans	-113.4	8	-175.5	-59.6	-68.1	0	0	0	113.1	L32 Y36 G37 I39 L56 Y64 G65 L68	L32-Y60 HydrophobicContact CD1-CE1 4.46Å; L32-Y60 HydrophobicContact CD2-CD1 4.24Å; L32-Y60 HydrophobicContact CD2-CE1 3.51Å; Y36-Y60 AromaticContact CD1-CD1 3.73Å; Y36-Y60 HydrophobicContact CD1-CD1 3.73Å; Y36-Y60 HydrophobicContact CD1-CE1 4.39Å; Y36-Y60 HydrophobicContact CG-CD1 4.12Å; G37-Y60 PolarHBondContact O-OH 3.33Å; I39-Y60 HydrophobicContact CD1-CD2 4.46Å; I39-Y60 HydrophobicContact CD1-CE2 3.63Å; I39-Y60 HydrophobicContact CG1-CE2 4Å; L56-Y60 HydrophobicContact CD2-CD2 3.66Å; L56-Y60 HydrophobicContact CD2-CE2 3.86Å; L56-Y60 WeakPolarHBondContact O-CA 3.36Å; L56-Y60 WeakPolarHBondContact O-CB 3.3Å; L56-Y60 PolarHBondContact O-N 3.43Å; Y60-Y64 HydrophobicContact CD1-CD1 4.35Å; Y60-Y64 AromaticContact CD1-CE1 3.99Å; Y60-Y64 HydrophobicContact CD1-CE1 3.99Å; Y60-Y64 HydrophobicContact CG-CE1 4.48Å; Y60-Y64 VanDerWaalsContact O-CB 3.25Å; Y60-Y64 WeakPolarHBondContact O-CB 3.2Å; Y60-Y64 WeakPolarHBondContact O-CD1 3.36Å; Y60-G65 PolarHBondContact O-N 2.9Å; Y60-L68 HydrophobicContact CD2-CD2 4.21Å; Y60-L68 HydrophobicContact CE2-CD2 4.29Å; Y60-L68 HydrophobicContact CG-CD2 4.36Å
61	L	81.3	Confident	82.2	Confident	101 Å²	101	43.5 Å²	43.5	53%	0.529	24%	0.235	S	C	.	.			trans	65.4	160.1	-174.3	-74.6	69.7	0	0	0	113.5	Y36 V57 G65	Y36-L61 HydrophobicContact CE1-CD1 4.33Å; V57-L61 CarbonylContact O-C 3.07Å; V57-L61 WeakPolarHBondContact O-CA 3.44Å; V57-L61 PolarHBondContact O-N 3Å; V57-L61 VanDerWaalsContact O-N 3.08Å; L61-G65 WeakPolarHBondContact O-CA 3.47Å; L61-G65 PolarHBondContact O-N 3.08Å
62	E	77.6	Confident	82.1	Confident	80 Å²	80	39.4 Å²	39.4	37%	0.374	21%	0.214	S	C	.	.	H	α-helix	trans	-61.9	-47.5	-176.5	-178.6	168.9	114.5	0	0	112.8	G2 A4 V57 A66	G2-E62 WeakPolarHBondContact CA-OE2 3.47Å; A4-E62 HydrophobicContact CB-CB 4.49Å; A4-E62 HydrophobicContact CB-CG 3.16Å; V57-E62 HydrophobicContact CG1-CB 4.01Å; E62-A66 WeakPolarHBondContact O-CB 3.48Å; E62-A66 PolarHBondContact O-N 2.77Å
63	A	76.2	Confident	82.1	Confident	74 Å²	74	39.4 Å²	39.4	61%	0.612	21%	0.214	S	C	*	.	H	α-helix	trans	-70.8	-47.4	-178.4	0	0	0	0	0	112.7	A66 E67	A63-A66 PolarHBondContact O-N 3.46Å; A63-E67 PolarHBondContact O-N 3.25Å; A63-E67 VanDerWaalsContact O-N 3.1Å
64	Y	78.9	Confident	82	Confident	27 Å²	27	45.2 Å²	45.2	11%	0.106	24%	0.235	C	C	.	.	H	α-helix	trans	-77.8	-33.1	-176.6	175	-112.2	0	0	0	112.2	R33 Y36 Y60 A66 E67 L68	R33-Y64 HydrophobicContact CB-CE1 4.47Å; R33-Y64 HydrophobicContact CB-CE2 4.27Å; R33-Y64 PolarHBondContact N-OH 2.71Å; Y36-Y64 HydrophobicContact CD2-CE1 4.23Å; Y36-Y64 HydrophobicContact CE1-CD1 4.49Å; Y36-Y64 HydrophobicContact CE2-CD1 4.45Å; Y36-Y64 HydrophobicContact CE2-CE1 4.43Å; Y36-Y64 HydrophobicContact CG-CE1 4.31Å; Y60-Y64 HydrophobicContact CD1-CD1 4.35Å; Y60-Y64 AromaticContact CD1-CE1 3.99Å; Y60-Y64 HydrophobicContact CD1-CE1 3.99Å; Y60-Y64 HydrophobicContact CG-CE1 4.48Å; Y60-Y64 VanDerWaalsContact O-CB 3.25Å; Y60-Y64 WeakPolarHBondContact O-CB 3.2Å; Y60-Y64 WeakPolarHBondContact O-CD1 3.36Å; Y64-A66 VanDerWaalsContact C-N 3.3Å; Y64-A66 PolarHBondContact O-N 2.99Å; Y64-E67 PolarHBondContact O-N 3.48Å; Y64-L68 VanDerWaalsContact O-CB 3.23Å; Y64-L68 WeakPolarHBondContact O-CB 3.43Å; Y64-L68 PolarHBondContact O-N 3.49Å
65	G	80.9	Confident	81.7	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-60.1	-38.6	169.5	0	0	0	0	0	112.6	Y60 L61 T69	Y60-G65 PolarHBondContact O-N 2.9Å; L61-G65 WeakPolarHBondContact O-CA 3.47Å; L61-G65 PolarHBondContact O-N 3.08Å; G65-T69 WeakPolarHBondContact O-CB 3.31Å; G65-T69 PolarHBondContact O-N 2.87Å; G65-T69 PolarHBondContact O-OG1 3.37Å
66	A	82.7	Confident	81.3	Confident	2 Å²	2	43.7 Å²	43.7	2%	0.017	23%	0.231	C	C	.	.	H	α-helix	trans	-68.8	-47.7	175.7	0	0	0	0	0	112.1	A4 I8 E62 A63 Y64 L68 T69 A70 L85 T89	A4-A66 HydrophobicContact CB-CB 4.16Å; I8-A66 HydrophobicContact CD1-CB 4.04Å; I8-A66 HydrophobicContact CG1-CB 4.21Å; E62-A66 WeakPolarHBondContact O-CB 3.48Å; E62-A66 PolarHBondContact O-N 2.77Å; A63-A66 PolarHBondContact O-N 3.46Å; Y64-A66 VanDerWaalsContact C-N 3.3Å; Y64-A66 PolarHBondContact O-N 2.99Å; A66-L68 VanDerWaalsContact C-N 3.3Å; A66-L68 PolarHBondContact O-N 3.14Å; A66-T69 PolarHBondContact O-N 2.84Å; A66-A70 PolarHBondContact O-N 2.77Å; A66-L85 HydrophobicContact CB-CD2 4.05Å; A66-L85 WeakPolarHBondContact O-CD2 3.46Å; A66-T89 HydrophobicContact CB-CG2 3.58Å
67	E	82.6	Confident	81	Confident	98 Å²	98	46.1 Å²	46.1	46%	0.458	26%	0.256	S	S	.	.	H	α-helix	trans	-58.3	-43.1	174.9	-80.8	-171.2	84.1	0	0	112.2	A63 Y64 A70 N71	A63-E67 PolarHBondContact O-N 3.25Å; A63-E67 VanDerWaalsContact O-N 3.1Å; Y64-E67 PolarHBondContact O-N 3.48Å; E67-A70 PolarHBondContact O-N 2.99Å; E67-N71 WeakPolarHBondContact O-CB 3.21Å; E67-N71 PolarHBondContact O-N 2.93Å; E67-N71 PolarHBondContact O-ND2 3.33Å
68	L	83.4	Confident	80.8	Confident	5 Å²	5	46.4 Å²	46.4	3%	0.026	26%	0.256	C	S	.	.	H	α-helix	trans	-61.9	-45.9	177.9	-172.8	65.4	0	0	0	110.8	L27 V30 L32 Y60 Y64 A66 N71 V72	L27-L68 HydrophobicContact CD1-CD2 3.63Å; L27-L68 HydrophobicContact CD1-CG 3.93Å; V30-L68 HydrophobicContact CG1-CD1 3.78Å; V30-L68 HydrophobicContact CG2-CD1 4.05Å; L32-L68 HydrophobicContact CD2-CD1 4.31Å; L32-L68 HydrophobicContact CD2-CD2 3.78Å; Y60-L68 HydrophobicContact CD2-CD2 4.21Å; Y60-L68 HydrophobicContact CE2-CD2 4.29Å; Y60-L68 HydrophobicContact CG-CD2 4.36Å; Y64-L68 VanDerWaalsContact O-CB 3.23Å; Y64-L68 WeakPolarHBondContact O-CB 3.43Å; Y64-L68 PolarHBondContact O-N 3.49Å; A66-L68 VanDerWaalsContact C-N 3.3Å; A66-L68 PolarHBondContact O-N 3.14Å; L68-N71 PolarHBondContact O-N 3.11Å; L68-V72 VanDerWaalsContact O-CG2 3.3Å; L68-V72 WeakPolarHBondContact O-CG2 3.25Å; L68-V72 PolarHBondContact O-N 3.08Å
69	T	83.9	Confident	80.6	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-61.4	-46.4	177.4	-57.2	0	0	0	0	110.9	I8 F23 G65 A66 N71 V72 L73 L85	I8-T69 HydrophobicContact CG2-CG2 4.3Å; F23-T69 HydrophobicContact CE2-CG2 3.83Å; F23-T69 HydrophobicContact CZ-CG2 3.81Å; G65-T69 WeakPolarHBondContact O-CB 3.31Å; G65-T69 PolarHBondContact O-N 2.87Å; G65-T69 PolarHBondContact O-OG1 3.37Å; A66-T69 PolarHBondContact O-N 2.84Å; T69-N71 VanDerWaalsContact C-N 3.34Å; T69-N71 PolarHBondContact O-N 3.25Å; T69-V72 PolarHBondContact O-N 3.39Å; T69-L73 HydrophobicContact CG2-CD1 3.89Å; T69-L73 HydrophobicContact CG2-CG 4.34Å; T69-L73 WeakPolarHBondContact O-CB 3.43Å; T69-L73 VanDerWaalsContact O-CG 3.23Å; T69-L73 WeakPolarHBondContact O-CG 3.12Å; T69-L73 PolarHBondContact O-N 3.23Å; T69-L85 HydrophobicContact CG2-CD1 3.68Å
70	A	84.6	Confident	80.6	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-58.8	-42.8	176.4	0	0	0	0	0	112.6	A66 E67 L73 R74 A82 L85 Q86	A66-A70 PolarHBondContact O-N 2.77Å; E67-A70 PolarHBondContact O-N 2.99Å; A70-L73 PolarHBondContact O-N 2.83Å; A70-R74 WeakPolarHBondContact O-CB 3.4Å; A70-R74 PolarHBondContact O-N 3.48Å; A70-A82 WeakPolarHBondContact O-CB 3.5Å; A70-L85 HydrophobicContact CB-CD2 3.82Å; A70-Q86 HydrophobicContact CB-CG 3.71Å
71	N	82.6	Confident	80.7	Confident	75 Å²	75	52.6 Å²	52.6	40%	0.401	28%	0.277	S	S	.	.	H	α-helix	trans	-65.8	-41.9	178.5	-76.9	-40.4	0	0	0	112	E67 L68 T69 R74 D75	E67-N71 WeakPolarHBondContact O-CB 3.21Å; E67-N71 PolarHBondContact O-N 2.93Å; E67-N71 PolarHBondContact O-ND2 3.33Å; L68-N71 PolarHBondContact O-N 3.11Å; T69-N71 VanDerWaalsContact C-N 3.34Å; T69-N71 PolarHBondContact O-N 3.25Å; N71-R74 PolarHBondContact O-N 3.19Å; N71-D75 PolarHBondContact O-N 3.17Å
72	V	84.3	Confident	80.6	Confident	3 Å²	3	47.8 Å²	47.8	2%	0.018	25%	0.252	C	S	.	.	H	α-helix	trans	-66.2	-42.5	177.2	175.4	0	0	0	0	111.1	F23 K26 L27 V30 L68 T69 R74 D75 M76	F23-V72 HydrophobicContact CD2-CB 4.03Å; F23-V72 HydrophobicContact CD2-CG1 3.32Å; F23-V72 HydrophobicContact CE2-CB 3.66Å; F23-V72 HydrophobicContact CE2-CG1 3.49Å; F23-V72 VanDerWaalsContact CE2-CG1 3.49Å; F23-V72 HydrophobicContact CG-CG1 3.98Å; F23-V72 HydrophobicContact CZ-CB 4.35Å; F23-V72 HydrophobicContact CZ-CG1 4.27Å; K26-V72 HydrophobicContact CB-CG1 3.66Å; L27-V72 HydrophobicContact CD1-CG2 4.25Å; V30-V72 HydrophobicContact CB-CG2 4.45Å; V30-V72 HydrophobicContact CG1-CG2 4.37Å; L68-V72 VanDerWaalsContact O-CG2 3.3Å; L68-V72 WeakPolarHBondContact O-CG2 3.25Å; L68-V72 PolarHBondContact O-N 3.08Å; T69-V72 PolarHBondContact O-N 3.39Å; V72-R74 VanDerWaalsContact C-N 3.33Å; V72-R74 PolarHBondContact O-N 3Å; V72-D75 PolarHBondContact O-N 3.39Å; V72-M76 HydrophobicContact CG1-SD 4.22Å; V72-M76 WeakPolarHBondContact O-CG 3.45Å; V72-M76 PolarHBondContact O-N 2.91Å
73	L	83.8	Confident	80.7	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-61.2	-41.6	175.6	-71.1	170.2	0	0	0	111.6	A11 L15 F23 T69 A70 D75 M76 G77 L78 T81 A82 L85	A11-L73 HydrophobicContact CB-CD1 3.93Å; L15-L73 HydrophobicContact CD1-CD2 4.25Å; L15-L73 HydrophobicContact CD2-CD2 3.76Å; L15-L73 HydrophobicContact CG-CD2 4.42Å; F23-L73 HydrophobicContact CD2-CD2 4.2Å; F23-L73 HydrophobicContact CD2-CG 4.47Å; F23-L73 HydrophobicContact CE2-CD2 4.41Å; F23-L73 HydrophobicContact CE2-CG 4.25Å; T69-L73 HydrophobicContact CG2-CD1 3.89Å; T69-L73 HydrophobicContact CG2-CG 4.34Å; T69-L73 WeakPolarHBondContact O-CB 3.43Å; T69-L73 VanDerWaalsContact O-CG 3.23Å; T69-L73 WeakPolarHBondContact O-CG 3.12Å; T69-L73 PolarHBondContact O-N 3.23Å; A70-L73 PolarHBondContact O-N 2.83Å; L73-D75 PolarHBondContact O-N 2.96Å; L73-M76 WeakPolarHBondContact O-CB 3.41Å; L73-M76 PolarHBondContact O-N 3.13Å; L73-G77 PolarHBondContact O-N 2.83Å; L73-L78 HydrophobicContact CB-CB 4.41Å; L73-L78 HydrophobicContact CD2-CB 4.43Å; L73-L78 HydrophobicContact CD2-CD1 3.85Å; L73-L78 PolarHBondContact O-N 3.38Å; L73-T81 HydrophobicContact CD1-CG2 4.29Å; L73-A82 HydrophobicContact CB-CB 3.83Å; L73-L85 HydrophobicContact CD1-CD1 4.38Å
74	R	82	Confident	80.8	Confident	121 Å²	121	47.6 Å²	47.6	46%	0.457	25%	0.247	S	C	.	.	H	α-helix	trans	-62	-42.6	175.6	-174.2	177.2	-62.8	173.7	0.4	112.2	A70 N71 V72 M76 G77 A82	A70-R74 WeakPolarHBondContact O-CB 3.4Å; A70-R74 PolarHBondContact O-N 3.48Å; N71-R74 PolarHBondContact O-N 3.19Å; V72-R74 VanDerWaalsContact C-N 3.33Å; V72-R74 PolarHBondContact O-N 3Å; R74-M76 VanDerWaalsContact C-N 3.25Å; R74-M76 PolarHBondContact O-N 3.42Å; R74-G77 PolarHBondContact O-N 3.38Å; R74-G77 VanDerWaalsContact O-N 3.07Å; R74-A82 HydrophobicContact CB-CB 4.46Å
75	D	79.6	Confident	80.9	Confident	102 Å²	102	46.4 Å²	46.4	55%	0.545	24%	0.243	S	C	.	.	H	α-helix	trans	-67.4	-27.2	177	-171.6	-98.6	0	0	0	112.6	K26 N71 V72 L73 G77	K26-D75 WeakPolarHBondContact CD-OD1 3.44Å; K26-D75 WeakPolarHBondContact CE-OD1 3.1Å; K26-D75 IonicContact NZ-OD1 2.62Å; K26-D75 PolarHBondContact NZ-OD1 2.68Å; N71-D75 PolarHBondContact O-N 3.17Å; V72-D75 PolarHBondContact O-N 3.39Å; L73-D75 PolarHBondContact O-N 2.96Å; D75-G77 VanDerWaalsContact C-N 3.28Å
76	M	75.8	Confident	80.8	Confident	16 Å²	16	49.1 Å²	49.1	8%	0.079	26%	0.256	C	S	.	.	H	α-helix	trans	-75.6	-14.3	171.8	-72.7	174.7	54.9	0	0	113.9	L15 E19 K22 F23 K26 V72 L73 R74 L78	L15-M76 HydrophobicContact CD2-CE 4.3Å; E19-M76 HydrophobicContact CB-CE 3.68Å; E19-M76 HydrophobicContact CG-CE 4.19Å; E19-M76 WeakPolarHBondContact O-CE 3.12Å; K22-M76 HydrophobicContact CB-CE 4.09Å; K22-M76 HydrophobicContact CD-CE 4.43Å; K22-M76 HydrophobicContact CD-CG 4.48Å; K22-M76 HydrophobicContact CG-CE 4.44Å; K22-M76 HydrophobicContact CG-CG 4.41Å; F23-M76 WeakPolarHBondContact CA-SD 3.2Å; F23-M76 HydrophobicContact CB-CE 4.25Å; F23-M76 HydrophobicContact CB-SD 3.64Å; F23-M76 HydrophobicContact CD2-SD 4.05Å; F23-M76 HydrophobicContact CG-SD 4.35Å; F23-M76 PolarHBondContact N-SD 3.04Å; K26-M76 HydrophobicContact CG-CG 4.36Å; V72-M76 HydrophobicContact CG1-SD 4.22Å; V72-M76 WeakPolarHBondContact O-CG 3.45Å; V72-M76 PolarHBondContact O-N 2.91Å; L73-M76 WeakPolarHBondContact O-CB 3.41Å; L73-M76 PolarHBondContact O-N 3.13Å; R74-M76 VanDerWaalsContact C-N 3.25Å; R74-M76 PolarHBondContact O-N 3.42Å; M76-L78 HydrophobicContact CB-CD1 4.33Å; M76-L78 HydrophobicContact CE-CD1 3.93Å
77	G	76.4	Confident	80.4	Confident	51 Å²	51	51.1 Å²	51.1	53%	0.526	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	96.3	0	-176.1	0	0	0	0	0	114.3	L73 R74 D75 Q79	L73-G77 PolarHBondContact O-N 2.83Å; R74-G77 PolarHBondContact O-N 3.38Å; R74-G77 VanDerWaalsContact O-N 3.07Å; D75-G77 VanDerWaalsContact C-N 3.28Å; G77-Q79 VanDerWaalsContact C-N 3.26Å; G77-Q79 PolarHBondContact O-N 2.87Å
78	L	79.9	Confident	79.9	Confident	34 Å²	34	48.1 Å²	48.1	18%	0.178	26%	0.264	C	S	.	.			trans	-85.8	63.6	-179.3	-65.3	163.4	0	0	0	111.1	L15 E19 L73 M76 E80 A82	L15-L78 HydrophobicContact CD2-CD1 3.19Å; E19-L78 WeakPolarHBondContact OE1-CD1 3.39Å; L73-L78 HydrophobicContact CB-CB 4.41Å; L73-L78 HydrophobicContact CD2-CB 4.43Å; L73-L78 HydrophobicContact CD2-CD1 3.85Å; L73-L78 PolarHBondContact O-N 3.38Å; M76-L78 HydrophobicContact CB-CD1 4.33Å; M76-L78 HydrophobicContact CE-CD1 3.93Å; L78-E80 VanDerWaalsContact C-N 3.31Å; L78-E80 PolarHBondContact O-N 3.36Å; L78-A82 WeakPolarHBondContact O-CB 3.33Å; L78-A82 PolarHBondContact O-N 3.19Å
79	Q	78.6	Confident	79.2	Confident	140 Å²	140	50.2 Å²	50.2	65%	0.654	28%	0.277	S	S	*	.	H	α-helix	trans	-65.2	-33.9	-177	-69.9	-178.4	65	0	0	112.7	G77 G83	G77-Q79 VanDerWaalsContact C-N 3.26Å; G77-Q79 PolarHBondContact O-N 2.87Å; Q79-G83 PolarHBondContact O-N 3.44Å
80	E	79.9	Confident	78	Confident	163 Å²	163	57 Å²	57	76%	0.762	31%	0.309	S	S	*	.	H	α-helix	trans	-64.6	-48.2	178.9	-69.7	-176.9	85.1	0	0	111.7	L78 G83 Q84	L78-E80 VanDerWaalsContact C-N 3.31Å; L78-E80 PolarHBondContact O-N 3.36Å; E80-G83 PolarHBondContact O-N 2.95Å; E80-Q84 PolarHBondContact O-N 2.91Å
81	T	79.1	Confident	76.4	Confident	12 Å²	12	63.4 Å²	63.4	7%	0.074	34%	0.338	C	S	.	.	H	α-helix	trans	-67.5	-40.3	178.4	-38.1	0	0	0	0	111.2	A11 N14 L73 G83 Q84 L85	A11-T81 HydrophobicContact CB-CG2 3.69Å; N14-T81 HydrophobicContact CB-CG2 4.49Å; L73-T81 HydrophobicContact CD1-CG2 4.29Å; T81-G83 VanDerWaalsContact C-N 3.32Å; T81-G83 PolarHBondContact O-N 2.9Å; T81-Q84 PolarHBondContact O-N 3.39Å; T81-L85 WeakPolarHBondContact O-CB 3.36Å; T81-L85 PolarHBondContact O-N 2.94Å
82	A	80.9	Confident	74.6	Confident	1 Å²	1	63.2 Å²	63.2	1%	0.008	35%	0.354	C	S	.	.	H	α-helix	trans	-62	-40.5	174	0	0	0	0	0	112.1	A70 L73 R74 L78 L85 Q86	A70-A82 WeakPolarHBondContact O-CB 3.5Å; L73-A82 HydrophobicContact CB-CB 3.83Å; R74-A82 HydrophobicContact CB-CB 4.46Å; L78-A82 WeakPolarHBondContact O-CB 3.33Å; L78-A82 PolarHBondContact O-N 3.19Å; A82-L85 PolarHBondContact O-N 3.19Å; A82-Q86 WeakPolarHBondContact O-CG 3.27Å; A82-Q86 PolarHBondContact O-N 3.36Å
83	G	79.1	Confident	72.5	Confident	34 Å²	34	68.3 Å²	68.3	35%	0.351	39%	0.39	S	S	.	.	H	α-helix	trans	-66.5	-42	177.3	0	0	0	0	0	112.5	Q79 E80 T81 Q86 A87	Q79-G83 PolarHBondContact O-N 3.44Å; E80-G83 PolarHBondContact O-N 2.95Å; T81-G83 VanDerWaalsContact C-N 3.32Å; T81-G83 PolarHBondContact O-N 2.9Å; G83-Q86 PolarHBondContact O-N 3.05Å; G83-A87 WeakPolarHBondContact O-CB 3.1Å; G83-A87 PolarHBondContact O-N 3.34Å
84	Q	77.4	Confident	70.5	Confident	115 Å²	115	72 Å²	72	54%	0.537	43%	0.428	S	S	.	.	H	α-helix	trans	-63.1	-43.4	174	-82.1	174	67.9	0	0	111.9	E80 T81 Q86 A87 A88	E80-Q84 PolarHBondContact O-N 2.91Å; T81-Q84 PolarHBondContact O-N 3.39Å; Q84-Q86 PolarHBondContact O-N 3.16Å; Q84-A87 PolarHBondContact O-N 2.82Å; Q84-A88 WeakPolarHBondContact O-CB 3.33Å; Q84-A88 PolarHBondContact O-N 3.29Å
85	L	82.2	Confident	68.2	Low	3 Å²	3	71 Å²	71	2%	0.016	45%	0.445	C	S	.	.	H	α-helix	trans	-63.5	-41.5	176.8	-172.8	144.1	0	0	0	111.7	A7 I8 A11 A66 T69 A70 L73 T81 A82 T89	A7-L85 HydrophobicContact CB-CG 4.29Å; A7-L85 WeakPolarHBondContact O-CD1 3.49Å; I8-L85 HydrophobicContact CB-CD1 4.37Å; I8-L85 HydrophobicContact CG1-CD1 3.99Å; A11-L85 HydrophobicContact CB-CB 4.46Å; A11-L85 HydrophobicContact CB-CD1 3.5Å; A66-L85 HydrophobicContact CB-CD2 4.05Å; A66-L85 WeakPolarHBondContact O-CD2 3.46Å; T69-L85 HydrophobicContact CG2-CD1 3.68Å; A70-L85 HydrophobicContact CB-CD2 3.82Å; L73-L85 HydrophobicContact CD1-CD1 4.38Å; T81-L85 WeakPolarHBondContact O-CB 3.36Å; T81-L85 PolarHBondContact O-N 2.94Å; A82-L85 PolarHBondContact O-N 3.19Å; L85-T89 VanDerWaalsContact O-CG2 3.28Å; L85-T89 WeakPolarHBondContact O-CG2 3.46Å; L85-T89 PolarHBondContact O-N 3.49Å; L85-T89 VanDerWaalsContact O-N 3.1Å; L85-T89 PolarHBondContact O-OG1 3.17Å
86	Q	78.1	Confident	65.9	Low	57 Å²	57	70.6 Å²	70.6	27%	0.266	46%	0.457	S	S	.	.	H	α-helix	trans	-65.8	-40.4	173.1	-73.2	-172.5	-29.3	0	0	112.1	A70 A82 G83 Q84 T89 H90	A70-Q86 HydrophobicContact CB-CG 3.71Å; A82-Q86 WeakPolarHBondContact O-CG 3.27Å; A82-Q86 PolarHBondContact O-N 3.36Å; G83-Q86 PolarHBondContact O-N 3.05Å; Q84-Q86 PolarHBondContact O-N 3.16Å; Q86-T89 WeakPolarHBondContact CA-OG1 3.42Å; Q86-T89 PolarHBondContact O-N 3.2Å; Q86-T89 PolarHBondContact O-OG1 3.08Å; Q86-H90 VanDerWaalsContact O-CB 3.29Å; Q86-H90 WeakPolarHBondContact O-CB 3.12Å; Q86-H90 PolarHBondContact O-CD2 3.35Å; Q86-H90 PolarHBondContact O-N 2.86Å
87	A	74.8	Confident	65	Low	44 Å²	44	76.1 Å²	76.1	36%	0.364	49%	0.494	S	S	.	.	H	α-helix	trans	-63.2	-46.7	176.2	0	0	0	0	0	111.4	G83 Q84 T89 H90 Q91	G83-A87 WeakPolarHBondContact O-CB 3.1Å; G83-A87 PolarHBondContact O-N 3.34Å; Q84-A87 PolarHBondContact O-N 2.82Å; A87-T89 VanDerWaalsContact C-N 3.26Å; A87-T89 PolarHBondContact O-N 2.97Å; A87-H90 PolarHBondContact O-N 2.83Å; A87-Q91 WeakPolarHBondContact O-CB 3.41Å; A87-Q91 WeakPolarHBondContact O-CG 3.48Å; A87-Q91 PolarHBondContact O-N 2.84Å
88	A	71.4	Confident	63	Low	35 Å²	35	78.1 Å²	78.1	29%	0.289	51%	0.505	S	S	.	.	H	α-helix	trans	-63.5	-31.8	179.5	0	0	0	0	0	112.8	A7 Q84	A7-A88 HydrophobicContact CB-CB 3.61Å; Q84-A88 WeakPolarHBondContact O-CB 3.33Å; Q84-A88 PolarHBondContact O-N 3.29Å
89	T	68.4	Low	61.2	Low	48 Å²	48	80.2 Å²	80.2	29%	0.294	54%	0.535	S	S	.	.	H	α-helix	trans	-81.6	-30.4	175.8	53.2	0	0	0	0	113.8	A4 A7 A66 L85 Q86 A87	A4-T89 HydrophobicContact CB-CG2 3.61Å; A7-T89 HydrophobicContact CB-CG2 4.5Å; A66-T89 HydrophobicContact CB-CG2 3.58Å; L85-T89 VanDerWaalsContact O-CG2 3.28Å; L85-T89 WeakPolarHBondContact O-CG2 3.46Å; L85-T89 PolarHBondContact O-N 3.49Å; L85-T89 VanDerWaalsContact O-N 3.1Å; L85-T89 PolarHBondContact O-OG1 3.17Å; Q86-T89 WeakPolarHBondContact CA-OG1 3.42Å; Q86-T89 PolarHBondContact O-N 3.2Å; Q86-T89 PolarHBondContact O-OG1 3.08Å; A87-T89 VanDerWaalsContact C-N 3.26Å; A87-T89 PolarHBondContact O-N 2.97Å
90	H	60.3	Low	59.3	Low	144 Å²	144	81.4 Å²	81.4	67%	0.667	54%	0.544	S	S	*	.	H	α-helix	trans	-91.7	-10.4	178.2	-75.1	-119	0	0	0	114.3	Q86 A87 G92	Q86-H90 VanDerWaalsContact O-CB 3.29Å; Q86-H90 WeakPolarHBondContact O-CB 3.12Å; Q86-H90 PolarHBondContact O-CD2 3.35Å; Q86-H90 PolarHBondContact O-N 2.86Å; A87-H90 PolarHBondContact O-N 2.83Å; H90-G92 PolarHBondContact O-N 2.82Å
91	Q	49.8	Very low	57.1	Low	133 Å²	133	82 Å²	82	62%	0.621	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	47.6	177.2	-85.5	-168.8	-20	0	0	113.5	R3 A87	R3-Q91 PolarHBondContact NH1-O 3.36Å; R3-Q91 VanDerWaalsContact NH1-O 3.08Å; A87-Q91 WeakPolarHBondContact O-CB 3.41Å; A87-Q91 WeakPolarHBondContact O-CG 3.48Å; A87-Q91 PolarHBondContact O-N 2.84Å
92	G	44.8	Very low	55.3	Low	71 Å²	71	85.8 Å²	85.8	73%	0.732	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.5	-6.1	162.8	0	0	0	0	0	114.1	H90	H90-G92 PolarHBondContact O-N 2.82Å
93	S	41.4	Very low	53.2	Low	111 Å²	111	91.2 Å²	91.2	78%	0.776	62%	0.615	S	S	*	*	S	Bend	trans	-155.3	123.3	170.5	-165.1	0	0	0	0	110.5
94	G	41	Very low	51.1	Low	76 Å²	76	94.9 Å²	94.9	78%	0.784	63%	0.633	S	S	*	*			trans	-69.7	149.7	-161	0	0	0	0	0	116.7
95	A	32.5	Very low	49.6	Very low	100 Å²	100	99.1 Å²	99.1	83%	0.826	65%	0.652	S	S	*	*			trans	-166.8	144.1	143.6	0	0	0	0	0	109.5
96	A	32.8	Very low	47.5	Very low	95 Å²	95	104 Å²	104	79%	0.785	69%	0.687	S	S	*	*			trans	-67.8	169.3	-171.4	0	0	0	0	0	114.5
97	P	55.8	Low	45.5	Very low	132 Å²	132	105.5 Å²	105.5	86%	0.857	71%	0.709	S	S	*	*			trans	-86.8	130.4	-172.8	34.3	-28.1	0	0	0	110.9
98	A	34.6	Very low	43.6	Very low	92 Å²	92	108 Å²	108	76%	0.76	73%	0.729	S	S	*	*			trans	-152.2	120.3	161.7	0	0	0	0	0	108.1
99	G	43.1	Very low	42.4	Very low	79 Å²	79	113.2 Å²	113.2	81%	0.814	75%	0.746	S	S	*	*			trans	-60.5	140.4	-174.2	0	0	0	0	0	112.9
100	I	37.4	Very low	41	Very low	164 Å²	164	116.9 Å²	116.9	84%	0.841	77%	0.77	S	S	*	*			trans	-138.9	134.8	143	-71.4	103.1	0	0	0	106.8
101	Q	34	Very low	40.3	Very low	175 Å²	175	112.4 Å²	112.4	82%	0.818	76%	0.762	S	S	*	*			trans	-40.4	152.3	173.4	-72.9	157.3	13.2	0	0	114.1
102	A	40.7	Very low	40.2	Very low	93 Å²	93	111.4 Å²	111.4	77%	0.769	76%	0.761	S	S	*	*			trans	-39.6	127.2	165.4	0	0	0	0	0	112
103	P	36.8	Very low	40.9	Very low	115 Å²	115	109.4 Å²	109.4	75%	0.747	73%	0.733	S	S	*	*			trans	-72.9	147.1	155.1	-4.1	21.5	0	0	0	108.7
104	P	36.4	Very low	41.9	Very low	111 Å²	111	106.9 Å²	106.9	72%	0.721	71%	0.708	S	S	*	*			trans	-61.3	147	173.6	29	-32.7	0	0	0	109.2	S106	P104-S106 VanDerWaalsContact C-N 3.34Å; P104-S106 PolarHBondContact O-N 3.44Å
105	Q	45.8	Very low	42.8	Very low	204 Å²	204	103.3 Å²	103.3	95%	0.953	67%	0.671	S	S	*	*			trans	-45.1	95	170.3	-61	162.2	-88	0	0	110.5
106	S	37.5	Very low	44.3	Very low	105 Å²	105	100.2 Å²	100.2	73%	0.734	64%	0.64	S	S	*	*			trans	-114.4	112.3	158.5	-70.4	0	0	0	0	104.8	P104 A108	P104-S106 VanDerWaalsContact C-N 3.34Å; P104-S106 PolarHBondContact O-N 3.44Å; S106-A108 PolarHBondContact O-N 2.88Å
107	A	36	Very low	45.8	Very low	88 Å²	88	101 Å²	101	73%	0.727	63%	0.63	S	S	*	*			trans	-37.8	107.3	178.4	0	0	0	0	0	110.4	K109	A107-K109 PolarHBondContact O-N 3.41Å
108	A	35.3	Very low	46.5	Very low	96 Å²	96	95.7 Å²	95.7	79%	0.793	59%	0.594	S	S	*	*			trans	-61.7	90.6	160.7	0	0	0	0	0	105.7	S106 P110	S106-A108 PolarHBondContact O-N 2.88Å; A108-P110 VanDerWaalsContact O-CD 3.26Å; A108-P110 WeakPolarHBondContact O-CD 3.06Å
109	K	45.9	Very low	48.2	Very low	146 Å²	146	96.8 Å²	96.8	64%	0.635	58%	0.579	S	S	*	*			trans	-68.2	113.5	169.8	-71.6	-171.8	175.3	-175	0	105.8	A107 G111	A107-K109 PolarHBondContact O-N 3.41Å; K109-G111 PolarHBondContact O-N 3.42Å
110	P	39	Very low	49.4	Very low	125 Å²	125	96.5 Å²	96.5	81%	0.812	57%	0.569	S	S	*	*	S	Bend	trans	-71.1	131.7	176.5	20.4	-13	0	0	0	108.2	A108	A108-P110 VanDerWaalsContact O-CD 3.26Å; A108-P110 WeakPolarHBondContact O-CD 3.06Å
111	G	46.5	Very low	51	Low	49 Å²	49	90.1 Å²	90.1	51%	0.505	54%	0.541	S	S	.	.			trans	98.7	70.4	176	0	0	0	0	0	113.4	K109 H113	K109-G111 PolarHBondContact O-N 3.42Å; G111-H113 VanDerWaalsContact C-N 3.27Å; G111-H113 PolarHBondContact O-N 3.1Å
112	L	48	Very low	52.9	Low	113 Å²	113	81.9 Å²	81.9	59%	0.592	50%	0.502	S	S	*	.			trans	-64.1	96.1	160	-160.2	79	0	0	0	106.8	D116 L117	L112-D116 HydrophobicContact CD1-CB 3.81Å; L112-D116 HydrophobicContact CG-CB 3.95Å; L112-L117 HydrophobicContact CD2-CB 3.83Å; L112-L117 HydrophobicContact CD2-CD1 3.66Å; L112-L117 HydrophobicContact CD2-CG 4.33Å; L112-L117 HydrophobicContact CG-CB 4.34Å
113	H	58.2	Low	54.3	Low	29 Å²	29	78.4 Å²	78.4	13%	0.134	47%	0.47	C	S	.	.			trans	-60.2	149.2	177	-153.8	-100.1	0	0	0	108.7	G111 V115 D116 L117 W171 K174 L178	G111-H113 VanDerWaalsContact C-N 3.27Å; G111-H113 PolarHBondContact O-N 3.1Å; H113-V115 PolarHBondContact O-N 3.13Å; H113-D116 WeakPolarHBondContact O-CA 3.05Å; H113-D116 VanDerWaalsContact O-CB 3.25Å; H113-D116 WeakPolarHBondContact O-CB 3.37Å; H113-D116 PolarHBondContact O-N 2.81Å; H113-L117 PolarHBondContact O-N 3.23Å; H113-L117 VanDerWaalsContact O-N 3.11Å; H113-W171 AromaticContact CD2-CZ3 3.91Å; H113-K174 HydrophobicContact CB-CD 3.5Å; H113-L178 VanDerWaalsContact CE1-CD1 3.46Å; H113-L178 WeakPolarHBondContact CE1-CD1 3.46Å
114	F	61.8	Low	55.8	Low	57 Å²	57	76.9 Å²	76.9	25%	0.25	47%	0.468	C	S	.	.	H	α-helix	trans	-43.6	-41.5	177.7	177.4	-97.7	0	0	0	113.2	D116 L117 H118 L178 L192 E193	F114-D116 VanDerWaalsContact C-N 3.33Å; F114-D116 PolarHBondContact O-N 2.87Å; F114-L117 PolarHBondContact O-N 2.79Å; F114-H118 AromaticContact CD2-CD2 3.45Å; F114-H118 VanDerWaalsContact CD2-CD2 3.45Å; F114-H118 WeakPolarHBondContact CD2-CD2 3.4Å; F114-H118 AromaticContact CD2-NE2 3.66Å; F114-H118 AromaticContact CE2-CD2 3.41Å; F114-H118 VanDerWaalsContact CE2-CD2 3.41Å; F114-H118 WeakPolarHBondContact CE2-CD2 3.17Å; F114-H118 AromaticContact CE2-NE2 3.48Å; F114-H118 WeakPolarHBondContact CE2-NE2 3.26Å; F114-H118 AromaticContact CG-CD2 3.89Å; F114-H118 AromaticContact CZ-CD2 3.87Å; F114-H118 WeakPolarHBondContact O-CB 3.01Å; F114-H118 PolarHBondContact O-CD2 3.12Å; F114-H118 PolarHBondContact O-N 2.9Å; F114-L178 HydrophobicContact CD1-CD2 3.83Å; F114-L178 HydrophobicContact CE1-CD2 4.05Å; F114-L192 HydrophobicContact CE1-CB 3.9Å; F114-L192 HydrophobicContact CE2-CB 4.21Å; F114-L192 WeakPolarHBondContact CE2-O 3.21Å; F114-L192 HydrophobicContact CZ-CB 3.34Å; F114-E193 HydrophobicContact CE2-CB 4.46Å; F114-E193 HydrophobicContact CE2-CG 3.99Å; F114-E193 HydrophobicContact CZ-CB 4.34Å; F114-E193 HydrophobicContact CZ-CG 3.7Å
115	V	61.5	Low	57.3	Low	2 Å²	2	78.3 Å²	78.3	1%	0.012	46%	0.459	C	S	.	.	H	α-helix	trans	-62.9	-34.5	177.8	-168.5	0	0	0	0	113.6	H113 R119 L122 F163 F177 L178	H113-V115 PolarHBondContact O-N 3.13Å; V115-R119 WeakPolarHBondContact O-CA 3.14Å; V115-R119 PolarHBondContact O-N 3.08Å; V115-R119 VanDerWaalsContact O-N 3.08Å; V115-L122 HydrophobicContact CB-CD1 4.47Å; V115-L122 HydrophobicContact CG1-CD1 3.77Å; V115-F163 HydrophobicContact CG1-CE1 3.76Å; V115-F163 HydrophobicContact CG1-CZ 3.71Å; V115-F177 HydrophobicContact CB-CD1 4.4Å; V115-F177 HydrophobicContact CG1-CD1 3.38Å; V115-F177 HydrophobicContact CG1-CE1 3.3Å; V115-F177 HydrophobicContact CG1-CG 4.44Å; V115-F177 HydrophobicContact CG1-CZ 4.35Å; V115-F177 HydrophobicContact CG2-CD1 4.05Å; V115-L178 HydrophobicContact CG2-CD1 3.46Å; V115-L178 VanDerWaalsContact CG2-CD1 3.46Å; V115-L178 HydrophobicContact CG2-CG 3.67Å
116	D	63.3	Low	58.3	Low	34 Å²	34	69 Å²	69	18%	0.182	42%	0.416	C	S	.	.	H	α-helix	trans	-76.2	-41.2	178	-122.1	-81.8	0	0	0	111.1	L112 H113 F114 R119 K174	L112-D116 HydrophobicContact CD1-CB 3.81Å; L112-D116 HydrophobicContact CG-CB 3.95Å; H113-D116 WeakPolarHBondContact O-CA 3.05Å; H113-D116 VanDerWaalsContact O-CB 3.25Å; H113-D116 WeakPolarHBondContact O-CB 3.37Å; H113-D116 PolarHBondContact O-N 2.81Å; F114-D116 VanDerWaalsContact C-N 3.33Å; F114-D116 PolarHBondContact O-N 2.87Å; D116-R119 VanDerWaalsContact O-CB 3.27Å; D116-R119 WeakPolarHBondContact O-CB 3.36Å; D116-R119 PolarHBondContact O-N 3.39Å; D116-K174 IonicContact OD2-NZ 2.71Å; D116-K174 PolarHBondContact OD2-NZ 3.47Å
117	L	65.4	Low	59.5	Low	111 Å²	111	69.3 Å²	69.3	58%	0.581	41%	0.413	S	S	*	.	H	α-helix	trans	-62.9	-44.1	175.3	-177.9	65.8	0	0	0	111	L112 H113 F114	L112-L117 HydrophobicContact CD2-CB 3.83Å; L112-L117 HydrophobicContact CD2-CD1 3.66Å; L112-L117 HydrophobicContact CD2-CG 4.33Å; L112-L117 HydrophobicContact CG-CB 4.34Å; H113-L117 PolarHBondContact O-N 3.23Å; H113-L117 VanDerWaalsContact O-N 3.11Å; F114-L117 PolarHBondContact O-N 2.79Å
118	H	70.5	Confident	61	Low	22 Å²	22	69 Å²	69	10%	0.102	40%	0.399	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	15.8	-178.5	-61.3	-72.3	0	0	0	113.9	F114 A120 A121 L122 L192	F114-H118 AromaticContact CD2-CD2 3.45Å; F114-H118 VanDerWaalsContact CD2-CD2 3.45Å; F114-H118 WeakPolarHBondContact CD2-CD2 3.4Å; F114-H118 AromaticContact CD2-NE2 3.66Å; F114-H118 AromaticContact CE2-CD2 3.41Å; F114-H118 VanDerWaalsContact CE2-CD2 3.41Å; F114-H118 WeakPolarHBondContact CE2-CD2 3.17Å; F114-H118 AromaticContact CE2-NE2 3.48Å; F114-H118 WeakPolarHBondContact CE2-NE2 3.26Å; F114-H118 AromaticContact CG-CD2 3.89Å; F114-H118 AromaticContact CZ-CD2 3.87Å; F114-H118 WeakPolarHBondContact O-CB 3.01Å; F114-H118 PolarHBondContact O-CD2 3.12Å; F114-H118 PolarHBondContact O-N 2.9Å; H118-A120 VanDerWaalsContact C-N 3.27Å; H118-A120 PolarHBondContact O-N 3.32Å; H118-A120 VanDerWaalsContact O-N 3.13Å; H118-A121 PolarHBondContact O-N 3.41Å; H118-L122 HydrophobicContact CB-CD1 4.45Å; H118-L122 WeakPolarHBondContact O-CG 3.08Å; H118-L122 PolarHBondContact O-N 2.94Å; H118-L192 HydrophobicContact CB-CD1 4.09Å; H118-L192 HydrophobicContact CB-CD2 3.77Å; H118-L192 HydrophobicContact CB-CG 4.37Å; H118-L192 PolarHBondContact CE1-O 3.13Å; H118-L192 PolarHBondContact NE2-O 3.36Å
119	R	70.3	Confident	62.5	Low	115 Å²	115	64.7 Å²	64.7	43%	0.434	36%	0.363	S	S	.	.	H	α-helix	trans	-41.5	-52.1	177.4	158.2	-175.2	158.9	-161.4	-5.2	112.8	V115 D116 L122 I123	V115-R119 WeakPolarHBondContact O-CA 3.14Å; V115-R119 PolarHBondContact O-N 3.08Å; V115-R119 VanDerWaalsContact O-N 3.08Å; D116-R119 VanDerWaalsContact O-CB 3.27Å; D116-R119 WeakPolarHBondContact O-CB 3.36Å; D116-R119 PolarHBondContact O-N 3.39Å; R119-L122 PolarHBondContact O-N 3.17Å; R119-I123 HydrophobicContact CG-CD1 3.59Å; R119-I123 WeakPolarHBondContact O-CB 3.25Å; R119-I123 WeakPolarHBondContact O-CD1 3.4Å; R119-I123 WeakPolarHBondContact O-CG1 3.32Å; R119-I123 PolarHBondContact O-N 2.97Å
120	A	67.8	Low	63.4	Low	73 Å²	73	63.6 Å²	63.6	60%	0.603	36%	0.36	S	S	*	.	H	α-helix	trans	-69.2	-38.1	-173.5	0	0	0	0	0	111.9	H118 I123 A124	H118-A120 VanDerWaalsContact C-N 3.27Å; H118-A120 PolarHBondContact O-N 3.32Å; H118-A120 VanDerWaalsContact O-N 3.13Å; A120-I123 PolarHBondContact O-N 3.23Å; A120-A124 VanDerWaalsContact O-CB 3.3Å; A120-A124 WeakPolarHBondContact O-CB 3.35Å; A120-A124 PolarHBondContact O-N 3.05Å
121	A	71.4	Confident	64.9	Low	30 Å²	30	59 Å²	59	25%	0.248	34%	0.336	C	S	.	.	H	α-helix	trans	-70.6	-39.1	178.7	0	0	0	0	0	111.3	H118 A124 R125 L192	H118-A121 PolarHBondContact O-N 3.41Å; A121-A124 PolarHBondContact O-N 3.4Å; A121-R125 VanDerWaalsContact O-CB 3.29Å; A121-R125 WeakPolarHBondContact O-CB 3.37Å; A121-R125 PolarHBondContact O-N 3.5Å; A121-L192 HydrophobicContact CB-CD2 3.54Å
122	L	72.6	Confident	66.2	Low	1 Å²	1	56.9 Å²	56.9	1%	0.005	31%	0.313	C	S	.	.	H	α-helix	trans	-62.7	-47.7	172	-71.4	167.3	0	0	0	111.7	V115 H118 R119 A124 R125 V126 F163 F177 L181 L188 L192	V115-L122 HydrophobicContact CB-CD1 4.47Å; V115-L122 HydrophobicContact CG1-CD1 3.77Å; H118-L122 HydrophobicContact CB-CD1 4.45Å; H118-L122 WeakPolarHBondContact O-CG 3.08Å; H118-L122 PolarHBondContact O-N 2.94Å; R119-L122 PolarHBondContact O-N 3.17Å; L122-A124 VanDerWaalsContact C-N 3.26Å; L122-A124 PolarHBondContact O-N 2.83Å; L122-R125 PolarHBondContact O-N 2.7Å; L122-V126 HydrophobicContact CB-CG2 4.49Å; L122-V126 HydrophobicContact CD2-CG2 4.22Å; L122-V126 WeakPolarHBondContact O-CB 3.29Å; L122-V126 WeakPolarHBondContact O-CG2 3.25Å; L122-V126 PolarHBondContact O-N 2.98Å; L122-F163 HydrophobicContact CD1-CZ 4.44Å; L122-F177 HydrophobicContact CD1-CE1 4.07Å; L122-L181 HydrophobicContact CD1-CD1 4.43Å; L122-L181 HydrophobicContact CD2-CD1 3.54Å; L122-L181 HydrophobicContact CD2-CD2 3.82Å; L122-L181 HydrophobicContact CD2-CG 4.37Å; L122-L188 HydrophobicContact CD2-CD2 3.83Å; L122-L192 HydrophobicContact CD1-CD1 4.5Å; L122-L192 HydrophobicContact CD2-CD1 3.4Å; L122-L192 HydrophobicContact CG-CD1 3.7Å
123	I	70.9	Confident	67.3	Low	21 Å²	21	51.9 Å²	51.9	11%	0.108	29%	0.287	C	S	.	.	H	α-helix	trans	-60.2	-36.2	177.8	-71.2	165.9	0	0	0	112	R119 A120 P156 M159 R160 F163	R119-I123 HydrophobicContact CG-CD1 3.59Å; R119-I123 WeakPolarHBondContact O-CB 3.25Å; R119-I123 WeakPolarHBondContact O-CD1 3.4Å; R119-I123 WeakPolarHBondContact O-CG1 3.32Å; R119-I123 PolarHBondContact O-N 2.97Å; A120-I123 PolarHBondContact O-N 3.23Å; I123-P156 HydrophobicContact CG2-CB 3.49Å; I123-P156 VanDerWaalsContact CG2-CB 3.49Å; I123-M159 HydrophobicContact CB-CB 4.49Å; I123-M159 HydrophobicContact CG1-CB 3.7Å; I123-R160 HydrophobicContact CD1-CB 4.46Å; I123-F163 HydrophobicContact CD1-CD2 4.24Å; I123-F163 HydrophobicContact CG1-CD2 4.35Å; I123-F163 HydrophobicContact CG1-CE2 4.32Å
124	A	67.4	Low	68	Low	83 Å²	83	55.5 Å²	55.5	69%	0.686	31%	0.307	S	S	*	.	H	α-helix	trans	-86.3	-31	-175.5	0	0	0	0	0	113.7	A120 A121 L122	A120-A124 VanDerWaalsContact O-CB 3.3Å; A120-A124 WeakPolarHBondContact O-CB 3.35Å; A120-A124 PolarHBondContact O-N 3.05Å; A121-A124 PolarHBondContact O-N 3.4Å; L122-A124 VanDerWaalsContact C-N 3.26Å; L122-A124 PolarHBondContact O-N 2.83Å
125	R	68.8	Low	68.5	Low	141 Å²	141	55.2 Å²	55.2	53%	0.532	32%	0.315	S	S	.	.	H	α-helix	trans	-104.8	-20.1	-173.4	-66.3	-167	162	155.2	-4.1	114.4	A121 L122 T127 L188 D191	A121-R125 VanDerWaalsContact O-CB 3.29Å; A121-R125 WeakPolarHBondContact O-CB 3.37Å; A121-R125 PolarHBondContact O-N 3.5Å; L122-R125 PolarHBondContact O-N 2.7Å; R125-T127 PolarHBondContact O-N 3.3Å; R125-T127 PolarHBondContact O-OG1 3.38Å; R125-L188 HydrophobicContact CB-CD1 3.57Å; R125-L188 HydrophobicContact CB-CD2 4.34Å; R125-L188 HydrophobicContact CB-CG 4.18Å; R125-L188 WeakPolarHBondContact O-CD1 3.44Å; R125-D191 IonicContact CZ-OD1 2.87Å; R125-D191 IonicContact NH1-OD1 2.68Å; R125-D191 PolarHBondContact NH1-OD1 3.03Å
126	V	66.9	Low	69	Low	9 Å²	9	55.2 Å²	55.2	6%	0.055	32%	0.315	C	S	.	.			trans	-69.1	110.2	175	175.7	0	0	0	0	109	L122 V129 L132 M159 L181 L188	L122-V126 HydrophobicContact CB-CG2 4.49Å; L122-V126 HydrophobicContact CD2-CG2 4.22Å; L122-V126 WeakPolarHBondContact O-CB 3.29Å; L122-V126 WeakPolarHBondContact O-CG2 3.25Å; L122-V126 PolarHBondContact O-N 2.98Å; V126-V129 HydrophobicContact CB-CG2 4.43Å; V126-V129 HydrophobicContact CG1-CG2 3.74Å; V126-L132 HydrophobicContact CG1-CD1 3.8Å; V126-M159 HydrophobicContact CB-CE 3.77Å; V126-M159 HydrophobicContact CG1-CE 3.87Å; V126-M159 HydrophobicContact CG2-CE 3.74Å; V126-L181 HydrophobicContact CG2-CD2 3.79Å; V126-L188 HydrophobicContact CG2-CD2 4.44Å
127	T	62.8	Low	69	Low	110 Å²	110	58.1 Å²	58.1	68%	0.675	32%	0.324	S	S	*	.			trans	-90.5	-30.8	-177.5	-24.4	0	0	0	0	110.9	R125	R125-T127 PolarHBondContact O-N 3.3Å; R125-T127 PolarHBondContact O-OG1 3.38Å
128	D	66.4	Low	68.7	Low	83 Å²	83	56 Å²	56	44%	0.444	33%	0.329	S	S	.	.			trans	-109.8	82.4	178.9	-156.7	-87.1	0	0	0	110.7	G131	D128-G131 WeakPolarHBondContact OD1-CA 3.24Å; D128-G131 PolarHBondContact OD1-N 2.97Å
129	V	67.3	Low	68.3	Low	4 Å²	4	59.7 Å²	59.7	2%	0.024	35%	0.354	C	S	.	.	H	α-helix	trans	-78.8	-25.6	178.1	171.7	0	0	0	0	110.9	V126 L133 N155 K158 M159	V126-V129 HydrophobicContact CB-CG2 4.43Å; V126-V129 HydrophobicContact CG1-CG2 3.74Å; V129-L133 HydrophobicContact CG1-CD1 3.45Å; V129-L133 VanDerWaalsContact CG1-CD1 3.45Å; V129-L133 WeakPolarHBondContact O-CB 3.37Å; V129-L133 WeakPolarHBondContact O-CD1 3.41Å; V129-L133 PolarHBondContact O-N 2.88Å; V129-N155 HydrophobicContact CG2-CB 4.15Å; V129-K158 HydrophobicContact CG1-CB 4.37Å; V129-M159 HydrophobicContact CG1-CG 4.24Å; V129-M159 HydrophobicContact CG2-CG 3.93Å
130	E	65.2	Low	67.8	Low	123 Å²	123	55.6 Å²	55.6	58%	0.575	34%	0.341	S	S	*	.	H	α-helix	trans	-74.3	-44.6	-175.7	-70	-179.5	90.5	0	0	112.5	L132 L133 D134	E130-L132 VanDerWaalsContact C-N 3.29Å; E130-L132 PolarHBondContact O-N 3.39Å; E130-L133 PolarHBondContact O-N 3.05Å; E130-D134 WeakPolarHBondContact O-CB 3.28Å; E130-D134 PolarHBondContact O-N 3.13Å
131	G	70.4	Confident	67.7	Low	30 Å²	30	52.6 Å²	52.6	31%	0.309	32%	0.315	S	S	.	.	H	α-helix	trans	-65.5	-34	174.4	0	0	0	0	0	112.6	D128 A135	D128-G131 WeakPolarHBondContact OD1-CA 3.24Å; D128-G131 PolarHBondContact OD1-N 2.97Å; G131-A135 WeakPolarHBondContact O-CB 3.12Å; G131-A135 PolarHBondContact O-N 2.97Å; G131-A135 VanDerWaalsContact O-N 3.08Å
132	L	73.4	Confident	67.5	Low	3 Å²	3	59 Å²	59	2%	0.016	34%	0.337	C	S	.	.	H	α-helix	trans	-64.9	-49.1	170.9	-109.8	155.9	0	0	0	111.4	V126 E130 D134 A135 L136 F177 A180 L181	V126-L132 HydrophobicContact CG1-CD1 3.8Å; E130-L132 VanDerWaalsContact C-N 3.29Å; E130-L132 PolarHBondContact O-N 3.39Å; L132-D134 VanDerWaalsContact C-N 3.3Å; L132-D134 PolarHBondContact O-N 3.06Å; L132-A135 PolarHBondContact O-N 2.97Å; L132-L136 HydrophobicContact CD2-CD1 3.85Å; L132-L136 WeakPolarHBondContact O-CB 3.47Å; L132-L136 WeakPolarHBondContact O-CD1 3.23Å; L132-L136 WeakPolarHBondContact O-CG 3.11Å; L132-L136 PolarHBondContact O-N 2.77Å; L132-F177 HydrophobicContact CD2-CD2 4.06Å; L132-F177 HydrophobicContact CD2-CE2 3.98Å; L132-A180 HydrophobicContact CD2-CB 3.58Å; L132-A180 HydrophobicContact CG-CB 4.4Å; L132-L181 HydrophobicContact CD1-CD2 3.81Å; L132-L181 HydrophobicContact CD1-CG 3.93Å; L132-L181 HydrophobicContact CD2-CG 4.23Å
133	L	71.3	Confident	67.4	Low	9 Å²	9	63 Å²	63	5%	0.047	36%	0.359	C	S	.	.	H	α-helix	trans	-61	-39.4	178.3	-111.7	98.7	0	0	0	112	V129 E130 L136 Y137 Y146 V149 L162	V129-L133 HydrophobicContact CG1-CD1 3.45Å; V129-L133 VanDerWaalsContact CG1-CD1 3.45Å; V129-L133 WeakPolarHBondContact O-CB 3.37Å; V129-L133 WeakPolarHBondContact O-CD1 3.41Å; V129-L133 PolarHBondContact O-N 2.88Å; E130-L133 PolarHBondContact O-N 3.05Å; L133-L136 CarbonylContact O-C 3.53Å; L133-L136 PolarHBondContact O-N 3.24Å; L133-Y137 VanDerWaalsContact O-CB 3.29Å; L133-Y137 WeakPolarHBondContact O-CB 3.4Å; L133-Y137 PolarHBondContact O-N 2.97Å; L133-Y146 HydrophobicContact CB-CD2 4.4Å; L133-Y146 HydrophobicContact CB-CE2 3.88Å; L133-Y146 HydrophobicContact CD2-CD2 3.65Å; L133-Y146 HydrophobicContact CD2-CE2 3.71Å; L133-Y146 HydrophobicContact CD2-CG 4.39Å; L133-Y146 HydrophobicContact CG-CD2 4.38Å; L133-Y146 HydrophobicContact CG-CE2 4.3Å; L133-V149 HydrophobicContact CD1-CG1 4Å; L133-V149 HydrophobicContact CD2-CB 4.23Å; L133-V149 HydrophobicContact CD2-CG1 3.76Å; L133-V149 HydrophobicContact CG-CG1 4.4Å; L133-L162 HydrophobicContact CD1-CD1 4.08Å; L133-L162 HydrophobicContact CG-CD1 4.32Å
134	D	73.8	Confident	67.6	Low	105 Å²	105	69.3 Å²	69.3	56%	0.561	39%	0.388	S	S	*	.	H	α-helix	trans	-65.3	-43.7	178.1	-166.7	-102.5	0	0	0	111.7	E130 L132 L136 Y137	E130-D134 WeakPolarHBondContact O-CB 3.28Å; E130-D134 PolarHBondContact O-N 3.13Å; L132-D134 VanDerWaalsContact C-N 3.3Å; L132-D134 PolarHBondContact O-N 3.06Å; D134-L136 PolarHBondContact O-N 2.9Å; D134-Y137 WeakPolarHBondContact O-CB 3.34Å; D134-Y137 PolarHBondContact O-N 3.31Å; D134-Y137 VanDerWaalsContact O-N 3.17Å
135	A	71.1	Confident	67.7	Low	51 Å²	51	67.9 Å²	67.9	42%	0.421	37%	0.367	S	S	.	.	H	α-helix	trans	-64.8	-28.9	174.4	0	0	0	0	0	113.2	G131 L132 A180	G131-A135 WeakPolarHBondContact O-CB 3.12Å; G131-A135 PolarHBondContact O-N 2.97Å; G131-A135 VanDerWaalsContact O-N 3.08Å; L132-A135 PolarHBondContact O-N 2.97Å; A135-A180 HydrophobicContact CB-CB 4.14Å
136	L	71.4	Confident	67.9	Low	2 Å²	2	62.9 Å²	62.9	1%	0.01	35%	0.348	C	S	.	.	H	α-helix	trans	-86.7	-18.4	176.7	-74.8	150.8	0	0	0	113.1	L132 L133 D134 V140 L141 F177	L132-L136 HydrophobicContact CD2-CD1 3.85Å; L132-L136 WeakPolarHBondContact O-CB 3.47Å; L132-L136 WeakPolarHBondContact O-CD1 3.23Å; L132-L136 WeakPolarHBondContact O-CG 3.11Å; L132-L136 PolarHBondContact O-N 2.77Å; L133-L136 CarbonylContact O-C 3.53Å; L133-L136 PolarHBondContact O-N 3.24Å; D134-L136 PolarHBondContact O-N 2.9Å; L136-V140 HydrophobicContact CD2-CB 4.2Å; L136-V140 HydrophobicContact CD2-CG2 4.19Å; L136-V140 PolarHBondContact O-N 3.39Å; L136-V140 VanDerWaalsContact O-N 3.12Å; L136-L141 HydrophobicContact CB-CD1 4.01Å; L136-L141 PolarHBondContact O-N 2.88Å; L136-F177 HydrophobicContact CD1-CD2 3.53Å; L136-F177 HydrophobicContact CD1-CE2 4.15Å; L136-F177 HydrophobicContact CD2-CB 4.24Å; L136-F177 HydrophobicContact CD2-CD2 4.45Å
137	Y	63.3	Low	68	Low	94 Å²	94	68.2 Å²	68.2	37%	0.369	37%	0.372	S	S	.	.	B	Isolated β-bridge	trans	-70.8	130.6	177.7	-177.2	-106.4	0	0	0	110.1	L133 D134 T139 D143 Y146	L133-Y137 VanDerWaalsContact O-CB 3.29Å; L133-Y137 WeakPolarHBondContact O-CB 3.4Å; L133-Y137 PolarHBondContact O-N 2.97Å; D134-Y137 WeakPolarHBondContact O-CB 3.34Å; D134-Y137 PolarHBondContact O-N 3.31Å; D134-Y137 VanDerWaalsContact O-N 3.17Å; Y137-T139 VanDerWaalsContact C-N 3.31Å; Y137-T139 PolarHBondContact O-N 3.31Å; Y137-D143 HydrophobicContact CE2-CB 4.47Å; Y137-D143 PolarHBondContact OH-OD2 2.82Å; Y137-Y146 VanDerWaalsContact CD2-CB 3.48Å; Y137-Y146 AromaticContact CD2-CD1 3.85Å; Y137-Y146 HydrophobicContact CD2-CD1 3.85Å; Y137-Y146 AromaticContact CD2-CD2 3.23Å; Y137-Y146 HydrophobicContact CD2-CD2 3.23Å; Y137-Y146 HydrophobicContact CD2-CE1 4.39Å; Y137-Y146 AromaticContact CD2-CE2 3.82Å; Y137-Y146 HydrophobicContact CD2-CE2 3.82Å; Y137-Y146 AromaticContact CD2-CG 3.24Å; Y137-Y146 HydrophobicContact CD2-CG 3.24Å; Y137-Y146 AromaticContact CE2-CD1 3.74Å; Y137-Y146 HydrophobicContact CE2-CD1 3.74Å; Y137-Y146 HydrophobicContact CE2-CD2 4.02Å; Y137-Y146 HydrophobicContact CE2-CE1 4.37Å; Y137-Y146 AromaticContact CE2-CG 3.56Å; Y137-Y146 HydrophobicContact CE2-CG 3.56Å; Y137-Y146 AromaticContact CG-CD2 3.82Å; Y137-Y146 HydrophobicContact CG-CD2 3.82Å; Y137-Y146 HydrophobicContact CG-CE2 4.02Å; Y137-Y146 HydrophobicContact CG-CG 4.23Å
138	G	59.9	Low	68.6	Low	67 Å²	67	67.3 Å²	67.3	69%	0.691	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.9	-23.7	-178.9	0	0	0	0	0	115.1	L141	G138-L141 PolarHBondContact N-O 3.1Å
139	T	61	Low	68.9	Low	100 Å²	100	63.3 Å²	63.3	61%	0.613	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.6	-48.1	177.7	-34.1	0	0	0	0	112.3	Y137 L176	Y137-T139 VanDerWaalsContact C-N 3.31Å; Y137-T139 PolarHBondContact O-N 3.31Å; T139-L176 HydrophobicContact CG2-CD2 3.9Å
140	V	61.6	Low	69.1	Low	29 Å²	29	67.1 Å²	67.1	18%	0.176	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.1	-37.7	-171.7	172.8	0	0	0	0	112	L136 C173 L176	L136-V140 HydrophobicContact CD2-CB 4.2Å; L136-V140 HydrophobicContact CD2-CG2 4.19Å; L136-V140 PolarHBondContact O-N 3.39Å; L136-V140 VanDerWaalsContact O-N 3.12Å; V140-C173 HydrophobicContact CB-CB 4.38Å; V140-C173 HydrophobicContact CG1-CB 3.56Å; V140-C173 HydrophobicContact CG2-CB 3.86Å; V140-L176 HydrophobicContact CG2-CD2 4.3Å
141	L	64.8	Low	69.5	Low	9 Å²	9	65 Å²	65	5%	0.047	36%	0.36	C	S	.	.	B	Isolated β-bridge	trans	-103.9	131.2	178.1	-77.7	91.2	0	0	0	110.9	L136 G138 Q145 V149 L162 W169	L136-L141 HydrophobicContact CB-CD1 4.01Å; L136-L141 PolarHBondContact O-N 2.88Å; G138-L141 PolarHBondContact N-O 3.1Å; L141-Q145 HydrophobicContact CB-CB 4.48Å; L141-Q145 HydrophobicContact CD2-CB 4.12Å; L141-Q145 HydrophobicContact CG-CB 4.46Å; L141-V149 HydrophobicContact CD2-CG2 4.34Å; L141-L162 HydrophobicContact CD1-CD1 4.25Å; L141-L162 HydrophobicContact CD2-CD1 4.04Å; L141-W169 HydrophobicContact CD1-CZ2 4.31Å
142	K	67.8	Low	69.7	Low	164 Å²	164	66.2 Å²	66.2	71%	0.713	36%	0.358	S	S	*	.			trans	-76.8	156.9	165.9	-68.2	-176	-179.7	-177.7	0	110.1	Q144 Q145 Y146	K142-Q144 PolarHBondContact O-N 2.83Å; K142-Q144 VanDerWaalsContact O-N 3.08Å; K142-Q145 WeakPolarHBondContact O-CB 3.36Å; K142-Q145 PolarHBondContact O-N 3.39Å; K142-Y146 PolarHBondContact O-N 2.84Å
143	D	70.4	Confident	69.3	Low	86 Å²	86	71.9 Å²	71.9	46%	0.46	40%	0.398	S	S	.	.	H	α-helix	trans	-46.1	-44.2	-177.6	-168.8	-108.2	0	0	0	114	Y137 Q145 Y146 Q147	Y137-D143 HydrophobicContact CE2-CB 4.47Å; Y137-D143 PolarHBondContact OH-OD2 2.82Å; D143-Q145 PolarHBondContact O-N 3.47Å; D143-Y146 PolarHBondContact O-N 3.39Å; D143-Q147 WeakPolarHBondContact O-CB 3.31Å; D143-Q147 PolarHBondContact O-N 3.1Å
144	Q	74.4	Confident	69.4	Low	153 Å²	153	74.9 Å²	74.9	72%	0.715	42%	0.417	S	S	*	.	H	α-helix	trans	-66.2	-37	179.4	-167	148.2	0.5	0	0	114.1	K142 E148	K142-Q144 PolarHBondContact O-N 2.83Å; K142-Q144 VanDerWaalsContact O-N 3.08Å; Q144-E148 WeakPolarHBondContact O-CG 3.28Å; Q144-E148 PolarHBondContact O-N 3.21Å
145	Q	70.3	Confident	69.1	Low	54 Å²	54	73.1 Å²	73.1	25%	0.252	41%	0.407	S	S	.	.	H	α-helix	trans	-74.4	-37.7	177.5	-64.4	165	-46.2	0	0	110.9	L141 K142 D143 E148 V149	L141-Q145 HydrophobicContact CB-CB 4.48Å; L141-Q145 HydrophobicContact CD2-CB 4.12Å; L141-Q145 HydrophobicContact CG-CB 4.46Å; K142-Q145 WeakPolarHBondContact O-CB 3.36Å; K142-Q145 PolarHBondContact O-N 3.39Å; D143-Q145 PolarHBondContact O-N 3.47Å; Q145-E148 PolarHBondContact O-N 3.45Å; Q145-V149 WeakPolarHBondContact O-CB 3.38Å; Q145-V149 WeakPolarHBondContact O-CG2 3.21Å; Q145-V149 PolarHBondContact O-N 3.25Å
146	Y	72.2	Confident	69	Low	36 Å²	36	73.1 Å²	73.1	14%	0.141	40%	0.403	C	S	.	.	H	α-helix	trans	-61.6	-46.3	172.6	177.3	-88.4	0	0	0	111	L133 Y137 K142 D143 E148 V149 Q150	L133-Y146 HydrophobicContact CB-CD2 4.4Å; L133-Y146 HydrophobicContact CB-CE2 3.88Å; L133-Y146 HydrophobicContact CD2-CD2 3.65Å; L133-Y146 HydrophobicContact CD2-CE2 3.71Å; L133-Y146 HydrophobicContact CD2-CG 4.39Å; L133-Y146 HydrophobicContact CG-CD2 4.38Å; L133-Y146 HydrophobicContact CG-CE2 4.3Å; Y137-Y146 VanDerWaalsContact CD2-CB 3.48Å; Y137-Y146 AromaticContact CD2-CD1 3.85Å; Y137-Y146 HydrophobicContact CD2-CD1 3.85Å; Y137-Y146 AromaticContact CD2-CD2 3.23Å; Y137-Y146 HydrophobicContact CD2-CD2 3.23Å; Y137-Y146 HydrophobicContact CD2-CE1 4.39Å; Y137-Y146 AromaticContact CD2-CE2 3.82Å; Y137-Y146 HydrophobicContact CD2-CE2 3.82Å; Y137-Y146 AromaticContact CD2-CG 3.24Å; Y137-Y146 HydrophobicContact CD2-CG 3.24Å; Y137-Y146 AromaticContact CE2-CD1 3.74Å; Y137-Y146 HydrophobicContact CE2-CD1 3.74Å; Y137-Y146 HydrophobicContact CE2-CD2 4.02Å; Y137-Y146 HydrophobicContact CE2-CE1 4.37Å; Y137-Y146 AromaticContact CE2-CG 3.56Å; Y137-Y146 HydrophobicContact CE2-CG 3.56Å; Y137-Y146 AromaticContact CG-CD2 3.82Å; Y137-Y146 HydrophobicContact CG-CD2 3.82Å; Y137-Y146 HydrophobicContact CG-CE2 4.02Å; Y137-Y146 HydrophobicContact CG-CG 4.23Å; K142-Y146 PolarHBondContact O-N 2.84Å; D143-Y146 PolarHBondContact O-N 3.39Å; Y146-E148 PolarHBondContact O-N 3.16Å; Y146-V149 PolarHBondContact O-N 3.19Å; Y146-Q150 HydrophobicContact CE1-CB 4.43Å; Y146-Q150 VanDerWaalsContact O-CB 3.23Å; Y146-Q150 WeakPolarHBondContact O-CB 3.39Å; Y146-Q150 PolarHBondContact O-N 3.43Å; Y146-Q150 PolarHBondContact OH-NE2 3.07Å
147	Q	70.2	Confident	69	Low	120 Å²	120	74.8 Å²	74.8	56%	0.561	42%	0.415	S	S	*	.	H	α-helix	trans	-66.6	-37.5	179.6	-153.9	178.9	-85.4	0	0	112	D143 Q150 A151	D143-Q147 WeakPolarHBondContact O-CB 3.31Å; D143-Q147 PolarHBondContact O-N 3.1Å; Q147-Q150 PolarHBondContact O-N 2.81Å; Q147-A151 WeakPolarHBondContact O-CB 3.44Å; Q147-A151 PolarHBondContact O-N 2.98Å
148	E	73.6	Confident	69.5	Low	91 Å²	91	71.5 Å²	71.5	43%	0.425	40%	0.402	S	S	.	.	H	α-helix	trans	-65.3	-38.3	173	-82.1	-163.7	88	0	0	112.9	Q144 Q145 Y146	Q144-E148 WeakPolarHBondContact O-CG 3.28Å; Q144-E148 PolarHBondContact O-N 3.21Å; Q145-E148 PolarHBondContact O-N 3.45Å; Y146-E148 PolarHBondContact O-N 3.16Å
149	V	74.5	Confident	70	Confident	0 Å²	0	68.4 Å²	68.4	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-73.3	-38.4	176.5	173.1	0	0	0	0	110.9	L133 L141 Q145 Y146 K158 K161 L162 F165	L133-V149 HydrophobicContact CD1-CG1 4Å; L133-V149 HydrophobicContact CD2-CB 4.23Å; L133-V149 HydrophobicContact CD2-CG1 3.76Å; L133-V149 HydrophobicContact CG-CG1 4.4Å; L141-V149 HydrophobicContact CD2-CG2 4.34Å; Q145-V149 WeakPolarHBondContact O-CB 3.38Å; Q145-V149 WeakPolarHBondContact O-CG2 3.21Å; Q145-V149 PolarHBondContact O-N 3.25Å; Y146-V149 PolarHBondContact O-N 3.19Å; V149-K158 HydrophobicContact CG1-CB 3.92Å; V149-K158 WeakPolarHBondContact CG1-O 3.2Å; V149-K158 WeakPolarHBondContact O-CB 3.42Å; V149-K158 WeakPolarHBondContact O-CG 3.24Å; V149-K161 HydrophobicContact CG2-CB 4.5Å; V149-L162 HydrophobicContact CG1-CB 4.03Å; V149-L162 HydrophobicContact CG1-CD1 4.08Å; V149-L162 HydrophobicContact CG2-CB 3.97Å; V149-L162 HydrophobicContact CG2-CD1 4.5Å; V149-F165 HydrophobicContact CG2-CD2 4.44Å; V149-F165 HydrophobicContact CG2-CE2 4.08Å
150	Q	70.4	Confident	70.4	Confident	84 Å²	84	70.5 Å²	70.5	39%	0.393	37%	0.367	S	S	.	.	H	α-helix	trans	-71.1	-34.4	178.8	-170.9	-174.7	70	0	0	112.1	Y146 Q147 E152 K158	Y146-Q150 HydrophobicContact CE1-CB 4.43Å; Y146-Q150 VanDerWaalsContact O-CB 3.23Å; Y146-Q150 WeakPolarHBondContact O-CB 3.39Å; Y146-Q150 PolarHBondContact O-N 3.43Å; Y146-Q150 PolarHBondContact OH-NE2 3.07Å; Q147-Q150 PolarHBondContact O-N 2.81Å; Q150-E152 PolarHBondContact O-N 2.81Å; Q150-E152 VanDerWaalsContact O-N 3.16Å; Q150-K158 WeakPolarHBondContact O-CE 3.27Å
151	A	74.8	Confident	71	Confident	78 Å²	78	72.3 Å²	72.3	65%	0.645	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-13.3	178.9	0	0	0	0	0	113.8	Q147	Q147-A151 WeakPolarHBondContact O-CB 3.44Å; Q147-A151 PolarHBondContact O-N 2.98Å
152	E	73.9	Confident	71.3	Confident	55 Å²	55	72 Å²	72	26%	0.257	37%	0.37	S	S	.	.	S	Bend	trans	-72.3	134.4	175.7	-127.9	84.7	67.6	0	0	111.9	Q150 T154 K158 K161	Q150-E152 PolarHBondContact O-N 2.81Å; Q150-E152 VanDerWaalsContact O-N 3.16Å; E152-T154 VanDerWaalsContact C-N 3.27Å; E152-T154 PolarHBondContact O-N 3.3Å; E152-T154 VanDerWaalsContact O-N 3.16Å; E152-K158 HydrophobicContact CB-CG 3.82Å; E152-K158 WeakPolarHBondContact O-CE 3.45Å; E152-K161 VanDerWaalsContact CD-NZ 3.26Å; E152-K161 WeakPolarHBondContact OE1-CB 3.43Å; E152-K161 WeakPolarHBondContact OE1-CD 3.37Å; E152-K161 WeakPolarHBondContact OE1-CE 3.46Å; E152-K161 WeakPolarHBondContact OE1-CG 3.45Å; E152-K161 IonicContact OE1-NZ 3.05Å; E152-K161 PolarHBondContact OE1-NZ 3.43Å; E152-K161 IonicContact OE2-NZ 3.93Å; E152-K161 PolarHBondContact OE2-NZ 3.26Å
153	S	64.1	Low	71.2	Confident	123 Å²	123	64.4 Å²	64.4	86%	0.86	34%	0.338	S	S	*	.	S	Bend	trans	-73.1	-11.1	-168.9	-43.9	0	0	0	0	115.4
154	T	73.8	Confident	71.1	Confident	72 Å²	72	64.3 Å²	64.3	44%	0.442	34%	0.343	S	S	.	.	S	Bend	trans	-135.9	130.8	-175	22.1	0	0	0	0	111.4	E152 P156 S157 K158	E152-T154 VanDerWaalsContact C-N 3.27Å; E152-T154 PolarHBondContact O-N 3.3Å; E152-T154 VanDerWaalsContact O-N 3.16Å; T154-P156 VanDerWaalsContact C-CD 3.44Å; T154-P156 VanDerWaalsContact C-N 3.3Å; T154-P156 VanDerWaalsContact O-N 3.15Å; T154-S157 WeakPolarHBondContact O-CA 3.45Å; T154-S157 VanDerWaalsContact O-CB 3.32Å; T154-S157 WeakPolarHBondContact O-CB 3.18Å; T154-S157 PolarHBondContact O-N 2.97Å; T154-S157 WeakPolarHBondContact OG1-CB 3.3Å; T154-S157 PolarHBondContact OG1-OG 2.81Å; T154-K158 WeakPolarHBondContact O-CG 3.45Å; T154-K158 PolarHBondContact O-N 3.34Å
155	N	68.4	Low	70.6	Confident	67 Å²	67	59.4 Å²	59.4	36%	0.358	32%	0.32	S	S	.	.	H	α-helix	trans	-42.6	-45.4	175.5	-65.4	-20.9	0	0	0	114.6	V129 S157 K158 M159	V129-N155 HydrophobicContact CG2-CB 4.15Å; N155-S157 VanDerWaalsContact C-N 3.34Å; N155-S157 PolarHBondContact O-N 3.44Å; N155-K158 PolarHBondContact O-N 3.29Å; N155-M159 PolarHBondContact O-N 2.95Å
156	P	67.7	Low	69.7	Low	51 Å²	51	59.8 Å²	59.8	33%	0.331	32%	0.322	S	S	.	.	H	α-helix	trans	-69	-30.1	176.6	25.2	-36.4	0	0	0	114	I123 T154 R160	I123-P156 HydrophobicContact CG2-CB 3.49Å; I123-P156 VanDerWaalsContact CG2-CB 3.49Å; T154-P156 VanDerWaalsContact C-CD 3.44Å; T154-P156 VanDerWaalsContact C-N 3.3Å; T154-P156 VanDerWaalsContact O-N 3.15Å; P156-R160 WeakPolarHBondContact O-CB 3.46Å; P156-R160 PolarHBondContact O-N 3.47Å
157	S	72.2	Confident	68.9	Low	37 Å²	37	63.1 Å²	63.1	26%	0.259	35%	0.349	S	S	.	.	H	α-helix	trans	-73.1	-38.5	176.4	-55.2	0	0	0	0	110.9	T154 N155 R160 K161	T154-S157 WeakPolarHBondContact O-CA 3.45Å; T154-S157 VanDerWaalsContact O-CB 3.32Å; T154-S157 WeakPolarHBondContact O-CB 3.18Å; T154-S157 PolarHBondContact O-N 2.97Å; T154-S157 WeakPolarHBondContact OG1-CB 3.3Å; T154-S157 PolarHBondContact OG1-OG 2.81Å; N155-S157 VanDerWaalsContact C-N 3.34Å; N155-S157 PolarHBondContact O-N 3.44Å; S157-R160 PolarHBondContact O-N 2.9Å; S157-K161 WeakPolarHBondContact O-CB 3.37Å; S157-K161 PolarHBondContact O-N 3.39Å
158	K	74	Confident	68	Low	26 Å²	26	60.3 Å²	60.3	11%	0.113	35%	0.345	C	S	.	.	H	α-helix	trans	-56.2	-53	172.4	-56.2	-173.6	179.3	169.6	0	110.7	V129 V149 Q150 E152 T154 N155 R160 K161 L162	V129-K158 HydrophobicContact CG1-CB 4.37Å; V149-K158 HydrophobicContact CG1-CB 3.92Å; V149-K158 WeakPolarHBondContact CG1-O 3.2Å; V149-K158 WeakPolarHBondContact O-CB 3.42Å; V149-K158 WeakPolarHBondContact O-CG 3.24Å; Q150-K158 WeakPolarHBondContact O-CE 3.27Å; E152-K158 HydrophobicContact CB-CG 3.82Å; E152-K158 WeakPolarHBondContact O-CE 3.45Å; T154-K158 WeakPolarHBondContact O-CG 3.45Å; T154-K158 PolarHBondContact O-N 3.34Å; N155-K158 PolarHBondContact O-N 3.29Å; K158-R160 VanDerWaalsContact C-N 3.33Å; K158-R160 PolarHBondContact O-N 3.27Å; K158-K161 PolarHBondContact O-N 2.95Å; K158-L162 VanDerWaalsContact O-CB 3.31Å; K158-L162 WeakPolarHBondContact O-CB 3.36Å; K158-L162 PolarHBondContact O-N 3.02Å
159	M	69.9	Low	67.4	Low	2 Å²	2	57.2 Å²	57.2	1%	0.01	33%	0.33	C	S	.	.	H	α-helix	trans	-59.1	-44.1	175.8	-76	-75.3	-120.5	0	0	111.5	I123 V126 V129 N155 K161 L162 F163 F177	I123-M159 HydrophobicContact CB-CB 4.49Å; I123-M159 HydrophobicContact CG1-CB 3.7Å; V126-M159 HydrophobicContact CB-CE 3.77Å; V126-M159 HydrophobicContact CG1-CE 3.87Å; V126-M159 HydrophobicContact CG2-CE 3.74Å; V129-M159 HydrophobicContact CG1-CG 4.24Å; V129-M159 HydrophobicContact CG2-CG 3.93Å; N155-M159 PolarHBondContact O-N 2.95Å; M159-K161 VanDerWaalsContact C-N 3.33Å; M159-K161 PolarHBondContact O-N 3.42Å; M159-L162 WeakPolarHBondContact O-CB 3.23Å; M159-L162 PolarHBondContact O-N 2.96Å; M159-F163 WeakPolarHBondContact O-CD2 3.43Å; M159-F163 PolarHBondContact O-N 3.46Å; M159-F177 HydrophobicContact CE-CE2 4.35Å; M159-F177 HydrophobicContact CE-CZ 3.91Å; M159-F177 HydrophobicContact SD-CE2 4.35Å; M159-F177 HydrophobicContact SD-CZ 4.35Å
160	R	70.4	Confident	66.7	Low	144 Å²	144	62.8 Å²	62.8	54%	0.543	36%	0.36	S	S	.	.	H	α-helix	trans	-63.5	-37.4	179.5	-157.1	-175	-63.8	170.6	-0.7	112.6	I123 P156 S157 K158 S164	I123-R160 HydrophobicContact CD1-CB 4.46Å; P156-R160 WeakPolarHBondContact O-CB 3.46Å; P156-R160 PolarHBondContact O-N 3.47Å; S157-R160 PolarHBondContact O-N 2.9Å; K158-R160 VanDerWaalsContact C-N 3.33Å; K158-R160 PolarHBondContact O-N 3.27Å; R160-S164 PolarHBondContact O-N 3Å
161	K	72.6	Confident	66.4	Low	67 Å²	67	67.6 Å²	67.6	29%	0.291	38%	0.375	S	S	.	.	H	α-helix	trans	-68	-43	175.5	-159.8	74.7	159.8	-88.7	0	110.8	V149 E152 S157 K158 M159 F163 S164 F165	V149-K161 HydrophobicContact CG2-CB 4.5Å; E152-K161 VanDerWaalsContact CD-NZ 3.26Å; E152-K161 WeakPolarHBondContact OE1-CB 3.43Å; E152-K161 WeakPolarHBondContact OE1-CD 3.37Å; E152-K161 WeakPolarHBondContact OE1-CE 3.46Å; E152-K161 WeakPolarHBondContact OE1-CG 3.45Å; E152-K161 IonicContact OE1-NZ 3.05Å; E152-K161 PolarHBondContact OE1-NZ 3.43Å; E152-K161 IonicContact OE2-NZ 3.93Å; E152-K161 PolarHBondContact OE2-NZ 3.26Å; S157-K161 WeakPolarHBondContact O-CB 3.37Å; S157-K161 PolarHBondContact O-N 3.39Å; K158-K161 PolarHBondContact O-N 2.95Å; M159-K161 VanDerWaalsContact C-N 3.33Å; M159-K161 PolarHBondContact O-N 3.42Å; K161-F163 PolarHBondContact O-N 3.38Å; K161-S164 WeakPolarHBondContact O-CA 3.46Å; K161-S164 WeakPolarHBondContact O-CB 3.29Å; K161-S164 PolarHBondContact O-N 3.2Å; K161-F165 HydrophobicContact CG-CE2 4.23Å; K161-F165 WeakPolarHBondContact O-CD2 3.37Å; K161-F165 PolarHBondContact O-N 2.97Å
162	L	72.4	Confident	66.2	Low	1 Å²	1	68.7 Å²	68.7	1%	0.005	37%	0.373	C	S	.	.	H	α-helix	trans	-60.4	-43.9	174.7	-176	140.2	0	0	0	111.8	L133 L141 V149 K158 M159 S164 F165 W169 F177	L133-L162 HydrophobicContact CD1-CD1 4.08Å; L133-L162 HydrophobicContact CG-CD1 4.32Å; L141-L162 HydrophobicContact CD1-CD1 4.25Å; L141-L162 HydrophobicContact CD2-CD1 4.04Å; V149-L162 HydrophobicContact CG1-CB 4.03Å; V149-L162 HydrophobicContact CG1-CD1 4.08Å; V149-L162 HydrophobicContact CG2-CB 3.97Å; V149-L162 HydrophobicContact CG2-CD1 4.5Å; K158-L162 VanDerWaalsContact O-CB 3.31Å; K158-L162 WeakPolarHBondContact O-CB 3.36Å; K158-L162 PolarHBondContact O-N 3.02Å; M159-L162 WeakPolarHBondContact O-CB 3.23Å; M159-L162 PolarHBondContact O-N 2.96Å; L162-S164 VanDerWaalsContact C-N 3.31Å; L162-S164 PolarHBondContact O-N 3.48Å; L162-F165 WeakPolarHBondContact O-CB 3.49Å; L162-F165 PolarHBondContact O-N 3.46Å; L162-W169 HydrophobicContact CD1-CZ2 4.27Å; L162-W169 HydrophobicContact CD2-CH2 3.23Å; L162-W169 HydrophobicContact CD2-CZ2 3.19Å; L162-W169 HydrophobicContact CD2-CZ3 4.32Å; L162-W169 HydrophobicContact CG-CH2 4.12Å; L162-W169 HydrophobicContact CG-CZ2 3.57Å; L162-F177 HydrophobicContact CD2-CE2 4.47Å
163	F	66	Low	65.9	Low	6 Å²	6	66.8 Å²	66.8	3%	0.026	37%	0.366	C	S	.	.	H	α-helix	trans	-65.7	-28.8	169.2	-80.9	-74.2	0	0	0	113.2	V115 L122 I123 M159 K161 F165 M166 F177	V115-F163 HydrophobicContact CG1-CE1 3.76Å; V115-F163 HydrophobicContact CG1-CZ 3.71Å; L122-F163 HydrophobicContact CD1-CZ 4.44Å; I123-F163 HydrophobicContact CD1-CD2 4.24Å; I123-F163 HydrophobicContact CG1-CD2 4.35Å; I123-F163 HydrophobicContact CG1-CE2 4.32Å; M159-F163 WeakPolarHBondContact O-CD2 3.43Å; M159-F163 PolarHBondContact O-N 3.46Å; K161-F163 PolarHBondContact O-N 3.38Å; F163-F165 PolarHBondContact O-N 3.36Å; F163-M166 WeakPolarHBondContact O-CB 3.36Å; F163-M166 WeakPolarHBondContact O-CE 3.48Å; F163-M166 WeakPolarHBondContact O-CG 3.33Å; F163-M166 PolarHBondContact O-N 3.04Å; F163-F177 HydrophobicContact CZ-CE1 4.49Å; F163-F177 HydrophobicContact CZ-CZ 4.4Å
164	S	67.3	Low	66.2	Low	83 Å²	83	62.3 Å²	62.3	58%	0.58	33%	0.331	S	S	*	.	H	α-helix	trans	-63.9	-21.1	174.6	-164.6	0	0	0	0	112.6	R160 K161 L162 M166	R160-S164 PolarHBondContact O-N 3Å; K161-S164 WeakPolarHBondContact O-CA 3.46Å; K161-S164 WeakPolarHBondContact O-CB 3.29Å; K161-S164 PolarHBondContact O-N 3.2Å; L162-S164 VanDerWaalsContact C-N 3.31Å; L162-S164 PolarHBondContact O-N 3.48Å; S164-M166 PolarHBondContact O-N 2.91Å
165	F	63.8	Low	66.2	Low	50 Å²	50	63.6 Å²	63.6	22%	0.219	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	9	171.5	-64.2	-77.2	0	0	0	113.6	V149 K161 L162 F163 P167 A168	V149-F165 HydrophobicContact CG2-CD2 4.44Å; V149-F165 HydrophobicContact CG2-CE2 4.08Å; K161-F165 HydrophobicContact CG-CE2 4.23Å; K161-F165 WeakPolarHBondContact O-CD2 3.37Å; K161-F165 PolarHBondContact O-N 2.97Å; L162-F165 WeakPolarHBondContact O-CB 3.49Å; L162-F165 PolarHBondContact O-N 3.46Å; F163-F165 PolarHBondContact O-N 3.36Å; F165-P167 VanDerWaalsContact C-N 3.3Å; F165-P167 WeakPolarHBondContact O-CD 3.4Å; F165-A168 WeakPolarHBondContact O-CB 3.28Å; F165-A168 PolarHBondContact O-N 2.97Å
166	M	51.5	Low	66.4	Low	62 Å²	62	62.7 Å²	62.7	31%	0.305	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-39.4	-37.8	174.8	-98.5	-179.8	-44.4	0	0	117.2	F163 S164 A168 W169	F163-M166 WeakPolarHBondContact O-CB 3.36Å; F163-M166 WeakPolarHBondContact O-CE 3.48Å; F163-M166 WeakPolarHBondContact O-CG 3.33Å; F163-M166 PolarHBondContact O-N 3.04Å; S164-M166 PolarHBondContact O-N 2.91Å; M166-A168 PolarHBondContact O-N 3.48Å; M166-W169 PolarHBondContact O-N 3.4Å
167	P	54.8	Low	66.8	Low	107 Å²	107	60.3 Å²	60.3	70%	0.695	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-66.9	-16.4	175.4	22.8	-32.1	0	0	0	114.5	F165	F165-P167 VanDerWaalsContact C-N 3.3Å; F165-P167 WeakPolarHBondContact O-CD 3.4Å
168	A	51.1	Low	66.8	Low	60 Å²	60	60.1 Å²	60.1	50%	0.496	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-98.6	-5.3	177.9	0	0	0	0	0	113.8	F165 M166 N170	F165-A168 WeakPolarHBondContact O-CB 3.28Å; F165-A168 PolarHBondContact O-N 2.97Å; M166-A168 PolarHBondContact O-N 3.48Å; A168-N170 PolarHBondContact O-N 3.46Å
169	W	61.8	Low	67	Low	27 Å²	27	64.1 Å²	64.1	10%	0.102	33%	0.329	C	S	.	.			trans	-87.1	104.1	-177.5	-80.4	37.1	0	0	0	110.7	L141 L162 M166 C173 K174 F177	L141-W169 HydrophobicContact CD1-CZ2 4.31Å; L162-W169 HydrophobicContact CD1-CZ2 4.27Å; L162-W169 HydrophobicContact CD2-CH2 3.23Å; L162-W169 HydrophobicContact CD2-CZ2 3.19Å; L162-W169 HydrophobicContact CD2-CZ3 4.32Å; L162-W169 HydrophobicContact CG-CH2 4.12Å; L162-W169 HydrophobicContact CG-CZ2 3.57Å; M166-W169 PolarHBondContact O-N 3.4Å; W169-C173 HydrophobicContact CB-CB 4.42Å; W169-K174 HydrophobicContact CE3-CG 4.18Å; W169-F177 HydrophobicContact CH2-CB 4.42Å; W169-F177 AromaticContact CH2-CD2 3.79Å; W169-F177 HydrophobicContact CH2-CD2 3.79Å; W169-F177 HydrophobicContact CH2-CE2 4.4Å; W169-F177 HydrophobicContact CH2-CG 4.25Å; W169-F177 HydrophobicContact CZ3-CB 4.06Å; W169-F177 HydrophobicContact CZ3-CD2 4.07Å; W169-F177 HydrophobicContact CZ3-CG 4.06Å
170	N	60.7	Low	67.2	Low	117 Å²	117	64.5 Å²	64.5	63%	0.626	33%	0.333	S	S	*	.			trans	-67.3	162.2	171.3	-74.1	-52.7	0	0	0	111.1	A168 T172 C173 K174	A168-N170 PolarHBondContact O-N 3.46Å; N170-T172 VanDerWaalsContact C-N 3.25Å; N170-T172 PolarHBondContact O-N 3.3Å; N170-C173 WeakPolarHBondContact O-CA 3.34Å; N170-C173 WeakPolarHBondContact O-CB 3.47Å; N170-C173 PolarHBondContact O-N 2.85Å; N170-K174 PolarHBondContact O-N 3.38Å
171	W	64.3	Low	67.5	Low	185 Å²	185	57.8 Å²	57.8	70%	0.701	31%	0.308	S	S	*	.	H	α-helix	trans	-52.5	-42.8	177.6	-80.2	77.9	0	0	0	112.8	H113 C173 K174 D175	H113-W171 AromaticContact CD2-CZ3 3.91Å; W171-C173 PolarHBondContact O-N 2.96Å; W171-K174 PolarHBondContact O-N 2.95Å; W171-K174 VanDerWaalsContact O-N 3.15Å; W171-D175 PolarHBondContact O-N 3.41Å; W171-D175 VanDerWaalsContact O-N 3.09Å
172	T	69.8	Low	67.7	Low	100 Å²	100	62.7 Å²	62.7	61%	0.613	33%	0.325	S	S	*	.	H	α-helix	trans	-58.3	-33.1	175.2	-44.2	0	0	0	0	113	N170 D175 L176	N170-T172 VanDerWaalsContact C-N 3.25Å; N170-T172 PolarHBondContact O-N 3.3Å; T172-D175 PolarHBondContact O-N 2.97Å; T172-L176 WeakPolarHBondContact O-CB 3.23Å; T172-L176 PolarHBondContact O-N 2.92Å
173	C	67.3	Low	67.8	Low	15 Å²	15	70.2 Å²	70.2	10%	0.101	36%	0.36	C	S	.	.	H	α-helix	trans	-70.3	-38.8	179.2	-54.1	0	0	0	0	111.8	V140 W169 N170 W171 D175 F177	V140-C173 HydrophobicContact CB-CB 4.38Å; V140-C173 HydrophobicContact CG1-CB 3.56Å; V140-C173 HydrophobicContact CG2-CB 3.86Å; W169-C173 HydrophobicContact CB-CB 4.42Å; N170-C173 WeakPolarHBondContact O-CA 3.34Å; N170-C173 WeakPolarHBondContact O-CB 3.47Å; N170-C173 PolarHBondContact O-N 2.85Å; W171-C173 PolarHBondContact O-N 2.96Å; C173-D175 VanDerWaalsContact C-N 3.34Å; C173-F177 WeakPolarHBondContact O-CB 3.37Å; C173-F177 PolarHBondContact O-N 2.85Å
174	K	71	Confident	67.9	Low	29 Å²	29	72.8 Å²	72.8	13%	0.126	38%	0.376	C	S	.	.	H	α-helix	trans	-69.2	-35.9	176.2	-61.3	-166.3	179.9	-164.9	0	111.5	H113 D116 W169 N170 W171 F177 L178	H113-K174 HydrophobicContact CB-CD 3.5Å; D116-K174 IonicContact OD2-NZ 2.71Å; D116-K174 PolarHBondContact OD2-NZ 3.47Å; W169-K174 HydrophobicContact CE3-CG 4.18Å; N170-K174 PolarHBondContact O-N 3.38Å; W171-K174 PolarHBondContact O-N 2.95Å; W171-K174 VanDerWaalsContact O-N 3.15Å; K174-F177 PolarHBondContact O-N 3.16Å; K174-L178 PolarHBondContact O-N 3.43Å
175	D	72.9	Confident	68	Low	100 Å²	100	69.2 Å²	69.2	54%	0.535	35%	0.35	S	S	.	.	H	α-helix	trans	-66.8	-45.3	175.3	-146.5	-101.6	0	0	0	111.4	W171 T172 C173 F177 L178 Q179	W171-D175 PolarHBondContact O-N 3.41Å; W171-D175 VanDerWaalsContact O-N 3.09Å; T172-D175 PolarHBondContact O-N 2.97Å; C173-D175 VanDerWaalsContact C-N 3.34Å; D175-F177 VanDerWaalsContact C-N 3.31Å; D175-F177 PolarHBondContact O-N 3.28Å; D175-L178 WeakPolarHBondContact O-CB 2.87Å; D175-L178 PolarHBondContact O-N 2.74Å; D175-Q179 WeakPolarHBondContact O-CB 3.38Å; D175-Q179 PolarHBondContact O-N 3.44Å
176	L	73.9	Confident	68.4	Low	48 Å²	48	69.7 Å²	69.7	25%	0.251	36%	0.36	S	S	.	.	H	α-helix	trans	-60.6	-40.3	174.2	-125.1	100.8	0	0	0	112.3	T139 V140 T172 Q179 A180	T139-L176 HydrophobicContact CG2-CD2 3.9Å; V140-L176 HydrophobicContact CG2-CD2 4.3Å; T172-L176 WeakPolarHBondContact O-CB 3.23Å; T172-L176 PolarHBondContact O-N 2.92Å; L176-Q179 WeakPolarHBondContact O-CB 3.11Å; L176-Q179 PolarHBondContact O-N 3.04Å; L176-A180 WeakPolarHBondContact O-CB 3.27Å; L176-A180 PolarHBondContact O-N 3.03Å
177	F	75.9	Confident	69.4	Low	1 Å²	1	73.2 Å²	73.2	0%	0.004	37%	0.371	C	S	.	.	H	α-helix	trans	-63.2	-43.3	176.5	-179.8	-92.8	0	0	0	111.6	V115 L122 L132 L136 M159 L162 F163 W169 C173 K174 D175 Q179 A180 L181	V115-F177 HydrophobicContact CB-CD1 4.4Å; V115-F177 HydrophobicContact CG1-CD1 3.38Å; V115-F177 HydrophobicContact CG1-CE1 3.3Å; V115-F177 HydrophobicContact CG1-CG 4.44Å; V115-F177 HydrophobicContact CG1-CZ 4.35Å; V115-F177 HydrophobicContact CG2-CD1 4.05Å; L122-F177 HydrophobicContact CD1-CE1 4.07Å; L132-F177 HydrophobicContact CD2-CD2 4.06Å; L132-F177 HydrophobicContact CD2-CE2 3.98Å; L136-F177 HydrophobicContact CD1-CD2 3.53Å; L136-F177 HydrophobicContact CD1-CE2 4.15Å; L136-F177 HydrophobicContact CD2-CB 4.24Å; L136-F177 HydrophobicContact CD2-CD2 4.45Å; M159-F177 HydrophobicContact CE-CE2 4.35Å; M159-F177 HydrophobicContact CE-CZ 3.91Å; M159-F177 HydrophobicContact SD-CE2 4.35Å; M159-F177 HydrophobicContact SD-CZ 4.35Å; L162-F177 HydrophobicContact CD2-CE2 4.47Å; F163-F177 HydrophobicContact CZ-CE1 4.49Å; F163-F177 HydrophobicContact CZ-CZ 4.4Å; W169-F177 HydrophobicContact CH2-CB 4.42Å; W169-F177 AromaticContact CH2-CD2 3.79Å; W169-F177 HydrophobicContact CH2-CD2 3.79Å; W169-F177 HydrophobicContact CH2-CE2 4.4Å; W169-F177 HydrophobicContact CH2-CG 4.25Å; W169-F177 HydrophobicContact CZ3-CB 4.06Å; W169-F177 HydrophobicContact CZ3-CD2 4.07Å; W169-F177 HydrophobicContact CZ3-CG 4.06Å; C173-F177 WeakPolarHBondContact O-CB 3.37Å; C173-F177 PolarHBondContact O-N 2.85Å; K174-F177 PolarHBondContact O-N 3.16Å; D175-F177 VanDerWaalsContact C-N 3.31Å; D175-F177 PolarHBondContact O-N 3.28Å; F177-Q179 VanDerWaalsContact C-N 3.33Å; F177-A180 PolarHBondContact O-N 3.32Å; F177-L181 HydrophobicContact CD1-CD1 3.53Å; F177-L181 HydrophobicContact CD1-CG 4.48Å; F177-L181 HydrophobicContact CE1-CD1 3.1Å; F177-L181 HydrophobicContact CE1-CG 4.12Å; F177-L181 HydrophobicContact CG-CD1 4.49Å; F177-L181 HydrophobicContact CZ-CD1 3.76Å; F177-L181 HydrophobicContact CZ-CG 4.4Å; F177-L181 WeakPolarHBondContact O-CB 3.46Å; F177-L181 PolarHBondContact O-N 3.21Å
178	L	72.1	Confident	70.2	Confident	32 Å²	32	68.5 Å²	68.5	17%	0.168	34%	0.34	C	S	.	.	H	α-helix	trans	-62.1	-40.3	172.7	-98.4	149.4	0	0	0	112.2	H113 F114 V115 K174 D175 L181 R182 V189	H113-L178 VanDerWaalsContact CE1-CD1 3.46Å; H113-L178 WeakPolarHBondContact CE1-CD1 3.46Å; F114-L178 HydrophobicContact CD1-CD2 3.83Å; F114-L178 HydrophobicContact CE1-CD2 4.05Å; V115-L178 HydrophobicContact CG2-CD1 3.46Å; V115-L178 VanDerWaalsContact CG2-CD1 3.46Å; V115-L178 HydrophobicContact CG2-CG 3.67Å; K174-L178 PolarHBondContact O-N 3.43Å; D175-L178 WeakPolarHBondContact O-CB 2.87Å; D175-L178 PolarHBondContact O-N 2.74Å; L178-L181 WeakPolarHBondContact O-CB 3.37Å; L178-L181 PolarHBondContact O-N 3.2Å; L178-R182 WeakPolarHBondContact O-CB 3.38Å; L178-R182 PolarHBondContact O-N 3.14Å; L178-V189 HydrophobicContact CD2-CG1 4.36Å
179	Q	76.9	Confident	71.1	Confident	110 Å²	110	65.9 Å²	65.9	51%	0.514	32%	0.317	S	S	.	.	H	α-helix	trans	-64	-49.7	176.6	-169.9	177.6	-58.6	0	0	111	D175 L176 F177 L181 R182 E183	D175-Q179 WeakPolarHBondContact O-CB 3.38Å; D175-Q179 PolarHBondContact O-N 3.44Å; L176-Q179 WeakPolarHBondContact O-CB 3.11Å; L176-Q179 PolarHBondContact O-N 3.04Å; F177-Q179 VanDerWaalsContact C-N 3.33Å; Q179-L181 VanDerWaalsContact C-N 3.3Å; Q179-L181 PolarHBondContact O-N 2.7Å; Q179-R182 WeakPolarHBondContact O-CA 3.44Å; Q179-R182 WeakPolarHBondContact O-CB 3.39Å; Q179-R182 PolarHBondContact O-N 3.47Å; Q179-E183 WeakPolarHBondContact O-CG 3.47Å; Q179-E183 PolarHBondContact O-N 2.72Å
180	A	75.8	Confident	71.6	Confident	11 Å²	11	70.4 Å²	70.4	9%	0.091	34%	0.339	C	S	.	.	H	α-helix	trans	-61	-39.1	177.3	0	0	0	0	0	112	L132 A135 L176 F177 E183 T184	L132-A180 HydrophobicContact CD2-CB 3.58Å; L132-A180 HydrophobicContact CG-CB 4.4Å; A135-A180 HydrophobicContact CB-CB 4.14Å; L176-A180 WeakPolarHBondContact O-CB 3.27Å; L176-A180 PolarHBondContact O-N 3.03Å; F177-A180 PolarHBondContact O-N 3.32Å; A180-E183 PolarHBondContact O-N 2.62Å; A180-T184 PolarHBondContact O-N 3.34Å; A180-T184 PolarHBondContact O-OG1 3.31Å
181	L	76.6	Confident	72.3	Confident	3 Å²	3	68.5 Å²	68.5	2%	0.016	33%	0.329	C	S	.	.	H	α-helix	trans	-61.9	-41.3	171	-93.9	164.1	0	0	0	112.6	L122 V126 L132 F177 L178 Q179 E183 Q185 V189	L122-L181 HydrophobicContact CD1-CD1 4.43Å; L122-L181 HydrophobicContact CD2-CD1 3.54Å; L122-L181 HydrophobicContact CD2-CD2 3.82Å; L122-L181 HydrophobicContact CD2-CG 4.37Å; V126-L181 HydrophobicContact CG2-CD2 3.79Å; L132-L181 HydrophobicContact CD1-CD2 3.81Å; L132-L181 HydrophobicContact CD1-CG 3.93Å; L132-L181 HydrophobicContact CD2-CG 4.23Å; F177-L181 HydrophobicContact CD1-CD1 3.53Å; F177-L181 HydrophobicContact CD1-CG 4.48Å; F177-L181 HydrophobicContact CE1-CD1 3.1Å; F177-L181 HydrophobicContact CE1-CG 4.12Å; F177-L181 HydrophobicContact CG-CD1 4.49Å; F177-L181 HydrophobicContact CZ-CD1 3.76Å; F177-L181 HydrophobicContact CZ-CG 4.4Å; F177-L181 WeakPolarHBondContact O-CB 3.46Å; F177-L181 PolarHBondContact O-N 3.21Å; L178-L181 WeakPolarHBondContact O-CB 3.37Å; L178-L181 PolarHBondContact O-N 3.2Å; Q179-L181 VanDerWaalsContact C-N 3.3Å; Q179-L181 PolarHBondContact O-N 2.7Å; L181-E183 VanDerWaalsContact C-N 3.3Å; L181-E183 PolarHBondContact O-N 2.82Å; L181-Q185 CarbonylContact O-C 3.38Å; L181-Q185 VanDerWaalsContact O-CA 3.28Å; L181-Q185 WeakPolarHBondContact O-CA 3.39Å; L181-Q185 PolarHBondContact O-N 3.33Å; L181-V189 HydrophobicContact CB-CG2 3.83Å
182	R	75.6	Confident	72.5	Confident	170 Å²	170	60 Å²	60	64%	0.642	30%	0.297	S	S	*	.	H	α-helix	trans	-63.7	-37.1	175.4	-105.4	178.4	69.4	-179.3	1.1	111.9	L178 Q179 S186 V189	L178-R182 WeakPolarHBondContact O-CB 3.38Å; L178-R182 PolarHBondContact O-N 3.14Å; Q179-R182 WeakPolarHBondContact O-CA 3.44Å; Q179-R182 WeakPolarHBondContact O-CB 3.39Å; Q179-R182 PolarHBondContact O-N 3.47Å; R182-S186 WeakPolarHBondContact O-CA 3.01Å; R182-S186 WeakPolarHBondContact O-CB 3.2Å; R182-S186 PolarHBondContact O-N 3.49Å; R182-V189 HydrophobicContact CG-CB 4.11Å; R182-V189 HydrophobicContact CG-CG1 4.02Å; R182-V189 HydrophobicContact CG-CG2 4.01Å
183	E	73.9	Confident	72.3	Confident	158 Å²	158	61.5 Å²	61.5	74%	0.738	30%	0.298	S	S	*	.	H	α-helix	trans	-75.2	-39.3	-179.4	-66.5	-152.1	103.3	0	0	112.9	Q179 A180 L181	Q179-E183 WeakPolarHBondContact O-CG 3.47Å; Q179-E183 PolarHBondContact O-N 2.72Å; A180-E183 PolarHBondContact O-N 2.62Å; L181-E183 VanDerWaalsContact C-N 3.3Å; L181-E183 PolarHBondContact O-N 2.82Å
184	T	70.1	Confident	71.9	Confident	61 Å²	61	71.6 Å²	71.6	37%	0.374	33%	0.333	S	S	.	.	H	α-helix	trans	-82.6	-43.6	177.9	40.5	0	0	0	0	112.6	A180	A180-T184 PolarHBondContact O-N 3.34Å; A180-T184 PolarHBondContact O-OG1 3.31Å
185	Q	67.9	Low	70.9	Confident	7 Å²	7	76.5 Å²	76.5	3%	0.033	37%	0.372	C	S	.	.	H	α-helix	trans	-141.8	60.7	-168.8	-54.5	-164.9	-61.5	0	0	112	L181 Y187 L188 V189	L181-Q185 CarbonylContact O-C 3.38Å; L181-Q185 VanDerWaalsContact O-CA 3.28Å; L181-Q185 WeakPolarHBondContact O-CA 3.39Å; L181-Q185 PolarHBondContact O-N 3.33Å; Q185-Y187 HydrophobicContact CB-CE1 4.01Å; Q185-Y187 HydrophobicContact CB-CE2 4.28Å; Q185-Y187 HydrophobicContact CG-CE1 4.33Å; Q185-Y187 PolarHBondContact NE2-OH 2.98Å; Q185-Y187 PolarHBondContact O-N 3.19Å; Q185-L188 HydrophobicContact CB-CB 3.91Å; Q185-L188 HydrophobicContact CB-CD1 4.47Å; Q185-L188 WeakPolarHBondContact O-CB 3.4Å; Q185-L188 PolarHBondContact O-N 3.02Å; Q185-V189 PolarHBondContact O-N 3.41Å
186	S	73.2	Confident	70.9	Confident	60 Å²	60	75.4 Å²	75.4	42%	0.42	36%	0.364	S	S	.	.	H	α-helix	trans	-49.4	-41.1	176.4	51.1	0	0	0	0	113.9	R182 L188 V189 E190	R182-S186 WeakPolarHBondContact O-CA 3.01Å; R182-S186 WeakPolarHBondContact O-CB 3.2Å; R182-S186 PolarHBondContact O-N 3.49Å; S186-L188 PolarHBondContact O-N 3.07Å; S186-V189 PolarHBondContact O-N 3.23Å; S186-V189 VanDerWaalsContact O-N 3.15Å; S186-E190 PolarHBondContact O-N 3.42Å
187	Y	72.6	Confident	70.7	Confident	137 Å²	137	76.8 Å²	76.8	54%	0.537	37%	0.369	S	S	.	.	H	α-helix	trans	-60	-31.5	177.3	55.5	-92.7	0	0	0	113.6	Q185 D191	Q185-Y187 HydrophobicContact CB-CE1 4.01Å; Q185-Y187 HydrophobicContact CB-CE2 4.28Å; Q185-Y187 HydrophobicContact CG-CE1 4.33Å; Q185-Y187 PolarHBondContact NE2-OH 2.98Å; Q185-Y187 PolarHBondContact O-N 3.19Å; Y187-D191 WeakPolarHBondContact O-CB 3.4Å; Y187-D191 PolarHBondContact O-N 2.95Å; Y187-D191 VanDerWaalsContact O-N 3.07Å
188	L	71.1	Confident	70.4	Confident	8 Å²	8	81 Å²	81	4%	0.042	39%	0.39	C	S	.	.	H	α-helix	trans	-79.5	-33	-178.8	-151.8	144.8	0	0	0	109.9	L122 R125 V126 Q185 S186 L192	L122-L188 HydrophobicContact CD2-CD2 3.83Å; R125-L188 HydrophobicContact CB-CD1 3.57Å; R125-L188 HydrophobicContact CB-CD2 4.34Å; R125-L188 HydrophobicContact CB-CG 4.18Å; R125-L188 WeakPolarHBondContact O-CD1 3.44Å; V126-L188 HydrophobicContact CG2-CD2 4.44Å; Q185-L188 HydrophobicContact CB-CB 3.91Å; Q185-L188 HydrophobicContact CB-CD1 4.47Å; Q185-L188 WeakPolarHBondContact O-CB 3.4Å; Q185-L188 PolarHBondContact O-N 3.02Å; S186-L188 PolarHBondContact O-N 3.07Å; L188-L192 HydrophobicContact CD2-CD1 3.7Å; L188-L192 HydrophobicContact CD2-CG 4.32Å; L188-L192 WeakPolarHBondContact O-CB 3.48Å; L188-L192 WeakPolarHBondContact O-CD1 3.46Å; L188-L192 WeakPolarHBondContact O-CG 3.41Å; L188-L192 PolarHBondContact O-N 3.05Å
189	V	71	Confident	70.3	Confident	4 Å²	4	83.9 Å²	83.9	2%	0.024	40%	0.403	C	S	.	.	H	α-helix	trans	-67.7	-46.5	171.8	-177.6	0	0	0	0	110.6	L178 L181 R182 Q185 S186 D191 L192 E193	L178-V189 HydrophobicContact CD2-CG1 4.36Å; L181-V189 HydrophobicContact CB-CG2 3.83Å; R182-V189 HydrophobicContact CG-CB 4.11Å; R182-V189 HydrophobicContact CG-CG1 4.02Å; R182-V189 HydrophobicContact CG-CG2 4.01Å; Q185-V189 PolarHBondContact O-N 3.41Å; S186-V189 PolarHBondContact O-N 3.23Å; S186-V189 VanDerWaalsContact O-N 3.15Å; V189-D191 VanDerWaalsContact C-N 3.34Å; V189-D191 PolarHBondContact O-N 3.05Å; V189-L192 PolarHBondContact O-N 3Å; V189-E193 HydrophobicContact CG1-CG 4.25Å; V189-E193 WeakPolarHBondContact O-CB 3.42Å; V189-E193 WeakPolarHBondContact O-CG 3.46Å; V189-E193 PolarHBondContact O-N 2.81Å
190	E	72.1	Confident	69.9	Low	122 Å²	122	82.3 Å²	82.3	57%	0.57	40%	0.396	S	S	*	.	H	α-helix	trans	-61.3	-38.7	176	-83.9	178.5	66.1	0	0	113.2	S186 E193 R194	S186-E190 PolarHBondContact O-N 3.42Å; E190-E193 PolarHBondContact O-N 3.16Å; E190-R194 VanDerWaalsContact O-CG 3.31Å; E190-R194 WeakPolarHBondContact O-CG 3.39Å; E190-R194 PolarHBondContact O-N 3.04Å
191	D	73.6	Confident	69.5	Low	78 Å²	78	87 Å²	87	42%	0.417	42%	0.416	S	S	.	.	H	α-helix	trans	-65.8	-40.8	175.8	-173	-110.6	0	0	0	111.5	R125 Y187 V189 R194 S195	R125-D191 IonicContact CZ-OD1 2.87Å; R125-D191 IonicContact NH1-OD1 2.68Å; R125-D191 PolarHBondContact NH1-OD1 3.03Å; Y187-D191 WeakPolarHBondContact O-CB 3.4Å; Y187-D191 PolarHBondContact O-N 2.95Å; Y187-D191 VanDerWaalsContact O-N 3.07Å; V189-D191 VanDerWaalsContact C-N 3.34Å; V189-D191 PolarHBondContact O-N 3.05Å; D191-R194 PolarHBondContact O-N 3.38Å; D191-S195 PolarHBondContact O-N 3.42Å
192	L	69.4	Low	69	Low	5 Å²	5	93 Å²	93	3%	0.026	45%	0.445	C	S	.	.	H	α-helix	trans	-71.5	-34.7	176.9	-68.5	175.9	0	0	0	112.4	F114 H118 A121 L122 L188 V189 R194 S195	F114-L192 HydrophobicContact CE1-CB 3.9Å; F114-L192 HydrophobicContact CE2-CB 4.21Å; F114-L192 WeakPolarHBondContact CE2-O 3.21Å; F114-L192 HydrophobicContact CZ-CB 3.34Å; H118-L192 HydrophobicContact CB-CD1 4.09Å; H118-L192 HydrophobicContact CB-CD2 3.77Å; H118-L192 HydrophobicContact CB-CG 4.37Å; H118-L192 PolarHBondContact CE1-O 3.13Å; H118-L192 PolarHBondContact NE2-O 3.36Å; A121-L192 HydrophobicContact CB-CD2 3.54Å; L122-L192 HydrophobicContact CD1-CD1 4.5Å; L122-L192 HydrophobicContact CD2-CD1 3.4Å; L122-L192 HydrophobicContact CG-CD1 3.7Å; L188-L192 HydrophobicContact CD2-CD1 3.7Å; L188-L192 HydrophobicContact CD2-CG 4.32Å; L188-L192 WeakPolarHBondContact O-CB 3.48Å; L188-L192 WeakPolarHBondContact O-CD1 3.46Å; L188-L192 WeakPolarHBondContact O-CG 3.41Å; L188-L192 PolarHBondContact O-N 3.05Å; V189-L192 PolarHBondContact O-N 3Å; L192-R194 PolarHBondContact O-N 3.31Å; L192-S195 PolarHBondContact O-N 3.37Å
193	E	66.1	Low	68.5	Low	133 Å²	133	87.1 Å²	87.1	62%	0.621	43%	0.43	S	S	*	.	H	α-helix	trans	-68.7	-23.9	177.7	-79.4	-170.6	97.2	0	0	112.4	F114 V189 E190	F114-E193 HydrophobicContact CE2-CB 4.46Å; F114-E193 HydrophobicContact CE2-CG 3.99Å; F114-E193 HydrophobicContact CZ-CB 4.34Å; F114-E193 HydrophobicContact CZ-CG 3.7Å; V189-E193 HydrophobicContact CG1-CG 4.25Å; V189-E193 WeakPolarHBondContact O-CB 3.42Å; V189-E193 WeakPolarHBondContact O-CG 3.46Å; V189-E193 PolarHBondContact O-N 2.81Å; E190-E193 PolarHBondContact O-N 3.16Å
194	R	59.3	Low	68	Low	226 Å²	226	81.2 Å²	81.2	85%	0.853	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.8	-3.5	178.7	-70.9	-179.8	67.1	-168	-1	114	E190 D191 L192	E190-R194 VanDerWaalsContact O-CG 3.31Å; E190-R194 WeakPolarHBondContact O-CG 3.39Å; E190-R194 PolarHBondContact O-N 3.04Å; D191-R194 PolarHBondContact O-N 3.38Å; L192-R194 PolarHBondContact O-N 3.31Å
195	S	50.1	Low	67.8	Low	133 Å²	133	83 Å²	83	93%	0.93	41%	0.407	S	S	*	.			trans	-101.4	0	-171.2	-168.7	0	0	0	0	114.7	D191 L192	D191-S195 PolarHBondContact O-N 3.42Å; L192-S195 PolarHBondContact O-N 3.37Å

Retrieved 195 of 195 residues in 55.5 ms (Link to these results)

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