A0A087XGV3_POEFO Loading...

Pannexin

Structural component of the gap junctions and the hemichannels.

AlphaFold DB , UniProt , Accession A0A087XGV3, Species POEFO (Poecilia formosa, Amazon molly), Gene PANX, Length 687 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	36.5	Very low	43.8	Very low	208 Å²	208	113.5 Å²	113.5	100%	1.025	58%	0.575	S	S	*	*				0	-47.6	0	-78.1	-170.7	-82.7	0	0	112	N3 I4 L5	M1-N3 PolarHBondContact O-N 3.02Å; M1-I4 WeakPolarHBondContact O-CB 3.37Å; M1-I4 PolarHBondContact O-N 2.76Å; M1-L5 PolarHBondContact O-N 3.37Å
2	Q	37.8	Very low	44.9	Very low	130 Å²	130	108 Å²	108	61%	0.607	56%	0.559	S	S	*	*	H	α-helix	trans	-36.4	-60.7	178.4	-136.6	69.8	13	0	0	115.1	I4 L5 D6	Q2-I4 PolarHBondContact O-N 2.86Å; Q2-L5 WeakPolarHBondContact O-CA 3.32Å; Q2-L5 WeakPolarHBondContact O-CB 3.38Å; Q2-L5 PolarHBondContact O-N 2.94Å; Q2-D6 PolarHBondContact O-N 3.46Å; Q2-D6 VanDerWaalsContact O-OD2 3.13Å
3	N	36.4	Very low	46.1	Very low	128 Å²	128	102.4 Å²	102.4	68%	0.684	53%	0.533	S	S	*	.	H	α-helix	trans	-54.2	-28.8	-178.8	-55.8	39.9	0	0	0	114.5	M1 Q7	M1-N3 PolarHBondContact O-N 3.02Å; N3-Q7 WeakPolarHBondContact O-CB 3.31Å; N3-Q7 PolarHBondContact O-N 3.39Å; N3-Q7 VanDerWaalsContact O-N 3.07Å
4	I	39.8	Very low	46.8	Very low	107 Å²	107	99.6 Å²	99.6	55%	0.549	53%	0.532	S	S	.	.	H	α-helix	trans	-75.8	-35	177.5	-58.4	173.8	0	0	0	109.9	M1 Q2 N8	M1-I4 WeakPolarHBondContact O-CB 3.37Å; M1-I4 PolarHBondContact O-N 2.76Å; Q2-I4 PolarHBondContact O-N 2.86Å; I4-N8 WeakPolarHBondContact O-CB 3.31Å; I4-N8 PolarHBondContact O-N 3.07Å; I4-N8 VanDerWaalsContact O-N 3.15Å; I4-N8 PolarHBondContact O-ND2 3.38Å
5	L	41.8	Very low	47.2	Very low	123 Å²	123	100.7 Å²	100.7	64%	0.644	54%	0.537	S	S	*	.	H	α-helix	trans	-69.6	-47.4	175.7	-157.6	73.9	0	0	0	110.7	M1 Q2 Q7 N8 L9	M1-L5 PolarHBondContact O-N 3.37Å; Q2-L5 WeakPolarHBondContact O-CA 3.32Å; Q2-L5 WeakPolarHBondContact O-CB 3.38Å; Q2-L5 PolarHBondContact O-N 2.94Å; L5-Q7 PolarHBondContact O-N 3.48Å; L5-N8 PolarHBondContact O-N 3.41Å; L5-L9 PolarHBondContact O-N 2.88Å
6	D	45.4	Very low	47.7	Very low	72 Å²	72	102 Å²	102	39%	0.385	54%	0.543	S	S	.	.	H	α-helix	trans	-61.6	-45.3	178.8	-56	-45.1	0	0	0	111.3	Q2 N8 L9 D10	Q2-D6 PolarHBondContact O-N 3.46Å; Q2-D6 VanDerWaalsContact O-OD2 3.13Å; D6-N8 VanDerWaalsContact C-N 3.3Å; D6-N8 PolarHBondContact O-N 3.22Å; D6-L9 PolarHBondContact O-N 3.47Å; D6-L9 VanDerWaalsContact O-N 3.11Å; D6-D10 PolarHBondContact O-N 2.82Å
7	Q	44.8	Very low	48.2	Very low	129 Å²	129	97.6 Å²	97.6	60%	0.603	52%	0.524	S	S	*	.	H	α-helix	trans	-66.3	-29.2	178.5	-170.2	171.2	23.4	0	0	113	N3 L5 M11	N3-Q7 WeakPolarHBondContact O-CB 3.31Å; N3-Q7 PolarHBondContact O-N 3.39Å; N3-Q7 VanDerWaalsContact O-N 3.07Å; L5-Q7 PolarHBondContact O-N 3.48Å; Q7-M11 WeakPolarHBondContact O-CB 3.27Å; Q7-M11 PolarHBondContact O-N 2.82Å
8	N	43.9	Very low	48.6	Very low	92 Å²	92	94.2 Å²	94.2	49%	0.492	52%	0.516	S	S	.	.	H	α-helix	trans	-76.4	-35.1	170.4	-83.6	-70.6	0	0	0	112.3	I4 L5 D6 M11 A12	I4-N8 WeakPolarHBondContact O-CB 3.31Å; I4-N8 PolarHBondContact O-N 3.07Å; I4-N8 VanDerWaalsContact O-N 3.15Å; I4-N8 PolarHBondContact O-ND2 3.38Å; L5-N8 PolarHBondContact O-N 3.41Å; D6-N8 VanDerWaalsContact C-N 3.3Å; D6-N8 PolarHBondContact O-N 3.22Å; N8-M11 PolarHBondContact O-N 3.37Å; N8-A12 WeakPolarHBondContact O-CB 3.2Å; N8-A12 PolarHBondContact O-N 2.95Å
9	L	51.4	Low	49.1	Very low	98 Å²	98	95.9 Å²	95.9	51%	0.513	52%	0.52	S	S	.	.	H	α-helix	trans	-67.9	-41.8	177.4	-170.7	67.5	0	0	0	111.7	L5 D6 T13 A76	L5-L9 PolarHBondContact O-N 2.88Å; D6-L9 PolarHBondContact O-N 3.47Å; D6-L9 VanDerWaalsContact O-N 3.11Å; L9-T13 WeakPolarHBondContact O-CB 3.28Å; L9-T13 PolarHBondContact O-N 2.94Å; L9-T13 PolarHBondContact O-OG1 2.8Å; L9-A76 HydrophobicContact CD2-CB 4.44Å
10	D	52.1	Low	49.5	Very low	54 Å²	54	96.5 Å²	96.5	29%	0.289	52%	0.518	S	S	.	.	H	α-helix	trans	-57.9	-48	169.3	-86.3	-34	0	0	0	111.3	D6 T13 A14 R73	D6-D10 PolarHBondContact O-N 2.82Å; D10-T13 PolarHBondContact O-N 3.22Å; D10-A14 WeakPolarHBondContact O-CB 3.48Å; D10-A14 PolarHBondContact O-N 2.64Å; D10-R73 IonicContact OD1-CZ 2.67Å; D10-R73 IonicContact OD1-NE 3.76Å; D10-R73 PolarHBondContact OD1-NE 2.82Å; D10-R73 IonicContact OD1-NH2 3.93Å; D10-R73 PolarHBondContact OD1-NH2 3.4Å; D10-R73 IonicContact OD2-CZ 3.55Å; D10-R73 IonicContact OD2-NE 3.71Å; D10-R73 PolarHBondContact OD2-NE 3.27Å; D10-R73 IonicContact OD2-NH2 3.78Å; D10-R73 PolarHBondContact OD2-NH2 2.76Å
11	M	51.4	Low	49.6	Very low	108 Å²	108	93.8 Å²	93.8	53%	0.532	50%	0.503	S	S	.	.	H	α-helix	trans	-65.7	-42.9	-178.4	-170.1	178.3	-62.9	0	0	112.2	Q7 N8 T13 A14 L15	Q7-M11 WeakPolarHBondContact O-CB 3.27Å; Q7-M11 PolarHBondContact O-N 2.82Å; N8-M11 PolarHBondContact O-N 3.37Å; M11-T13 VanDerWaalsContact C-N 3.34Å; M11-T13 PolarHBondContact O-N 3.17Å; M11-A14 PolarHBondContact O-N 3.05Å; M11-L15 HydrophobicContact CG-CD1 4.12Å; M11-L15 WeakPolarHBondContact O-CB 3.24Å; M11-L15 VanDerWaalsContact O-CG 3.26Å; M11-L15 WeakPolarHBondContact O-CG 3.22Å; M11-L15 PolarHBondContact O-N 3.28Å
12	A	57.3	Low	50.4	Low	47 Å²	47	90.8 Å²	90.8	39%	0.388	48%	0.484	S	S	.	.	H	α-helix	trans	-63.3	-40.4	175.2	0	0	0	0	0	111.6	N8 L15 L16	N8-A12 WeakPolarHBondContact O-CB 3.2Å; N8-A12 PolarHBondContact O-N 2.95Å; A12-L15 PolarHBondContact O-N 2.9Å; A12-L16 PolarHBondContact O-N 2.98Å
13	T	60.1	Low	51.2	Low	35 Å²	35	89 Å²	89	22%	0.215	48%	0.476	C	S	.	.	H	α-helix	trans	-64.2	-45	175.3	-57.8	0	0	0	0	111.2	L9 D10 M11 L15 L16 A17 T72	L9-T13 WeakPolarHBondContact O-CB 3.28Å; L9-T13 PolarHBondContact O-N 2.94Å; L9-T13 PolarHBondContact O-OG1 2.8Å; D10-T13 PolarHBondContact O-N 3.22Å; M11-T13 VanDerWaalsContact C-N 3.34Å; M11-T13 PolarHBondContact O-N 3.17Å; T13-L15 VanDerWaalsContact C-N 3.33Å; T13-L15 PolarHBondContact O-N 3.45Å; T13-L16 PolarHBondContact O-N 3.36Å; T13-A17 WeakPolarHBondContact O-CB 3.46Å; T13-A17 PolarHBondContact O-N 2.84Å; T13-T72 HydrophobicContact CG2-CG2 3.85Å
14	A	56	Low	51.9	Low	63 Å²	63	88.1 Å²	88.1	52%	0.521	47%	0.47	S	S	.	.	H	α-helix	trans	-64.9	-34.4	177.1	0	0	0	0	0	112.8	D10 M11 G18	D10-A14 WeakPolarHBondContact O-CB 3.48Å; D10-A14 PolarHBondContact O-N 2.64Å; M11-A14 PolarHBondContact O-N 3.05Å; A14-G18 PolarHBondContact O-N 2.81Å
15	L	53.3	Low	52.5	Low	117 Å²	117	86.2 Å²	86.2	61%	0.613	46%	0.46	S	S	*	.	H	α-helix	trans	-71.2	-46.3	175	-73.5	168.1	0	0	0	112	M11 A12 T13 A17 G18 E19	M11-L15 HydrophobicContact CG-CD1 4.12Å; M11-L15 WeakPolarHBondContact O-CB 3.24Å; M11-L15 VanDerWaalsContact O-CG 3.26Å; M11-L15 WeakPolarHBondContact O-CG 3.22Å; M11-L15 PolarHBondContact O-N 3.28Å; A12-L15 PolarHBondContact O-N 2.9Å; T13-L15 VanDerWaalsContact C-N 3.33Å; T13-L15 PolarHBondContact O-N 3.45Å; L15-A17 VanDerWaalsContact C-N 3.33Å; L15-A17 PolarHBondContact O-N 2.82Å; L15-G18 PolarHBondContact O-N 2.76Å; L15-E19 WeakPolarHBondContact O-CB 3.35Å; L15-E19 PolarHBondContact O-N 2.99Å
16	L	55.6	Low	52.7	Low	121 Å²	121	85.3 Å²	85.3	63%	0.634	46%	0.456	S	S	*	.	H	α-helix	trans	-60.9	-42.1	174.2	-108.3	124.5	0	0	0	111.9	A12 T13 K20	A12-L16 PolarHBondContact O-N 2.98Å; T13-L16 PolarHBondContact O-N 3.36Å; L16-K20 PolarHBondContact O-N 2.74Å
17	A	56.3	Low	52.7	Low	27 Å²	27	84.2 Å²	84.2	22%	0.223	45%	0.453	C	S	.	.	H	α-helix	trans	-60.6	-46.1	172.7	0	0	0	0	0	111.4	T13 L15 L21 L65	T13-A17 WeakPolarHBondContact O-CB 3.46Å; T13-A17 PolarHBondContact O-N 2.84Å; L15-A17 VanDerWaalsContact C-N 3.33Å; L15-A17 PolarHBondContact O-N 2.82Å; A17-L21 WeakPolarHBondContact O-CB 3.12Å; A17-L21 PolarHBondContact O-N 3.48Å; A17-L65 HydrophobicContact CB-CD2 4.1Å
18	G	54	Low	52.5	Low	36 Å²	36	80.8 Å²	80.8	37%	0.371	45%	0.452	S	S	.	.	H	α-helix	trans	-66.2	-36.7	178.8	0	0	0	0	0	114.1	A14 L15 K22	A14-G18 PolarHBondContact O-N 2.81Å; L15-G18 PolarHBondContact O-N 2.76Å; G18-K22 WeakPolarHBondContact O-CB 3.18Å; G18-K22 PolarHBondContact O-N 3.27Å
19	E	59.6	Low	52.2	Low	128 Å²	128	81 Å²	81	60%	0.598	46%	0.461	S	S	*	.	H	α-helix	trans	-73.7	-42	178.4	-172.2	160.7	-131.6	0	0	111.8	L15 K22 E23	L15-E19 WeakPolarHBondContact O-CB 3.35Å; L15-E19 PolarHBondContact O-N 2.99Å; E19-K22 WeakPolarHBondContact O-CB 3.13Å; E19-K22 PolarHBondContact O-N 3.19Å; E19-E23 PolarHBondContact O-N 2.82Å
20	K	56	Low	51.5	Low	107 Å²	107	79.9 Å²	79.9	47%	0.465	46%	0.461	S	S	.	.	H	α-helix	trans	-69.5	-32.1	171.2	-70.9	-69.2	161.9	-149	0	112.8	L16 K22 E23 L24	L16-K20 PolarHBondContact O-N 2.74Å; K20-K22 VanDerWaalsContact C-N 3.33Å; K20-E23 WeakPolarHBondContact CD-OE2 3.15Å; K20-E23 IonicContact NZ-OE1 2.7Å; K20-E23 PolarHBondContact NZ-OE1 2.98Å; K20-E23 IonicContact NZ-OE2 2.77Å; K20-E23 PolarHBondContact NZ-OE2 3.1Å; K20-E23 PolarHBondContact O-N 3.4Å; K20-L24 WeakPolarHBondContact O-CB 3.45Å; K20-L24 WeakPolarHBondContact O-CD1 3.22Å; K20-L24 VanDerWaalsContact O-CG 3.28Å; K20-L24 WeakPolarHBondContact O-CG 3.21Å; K20-L24 PolarHBondContact O-N 2.79Å
21	L	52.9	Low	50.7	Low	40 Å²	40	83.4 Å²	83.4	21%	0.209	48%	0.476	C	S	.	.	H	α-helix	trans	-61.9	-40.3	169.5	-178.3	63.4	0	0	0	111.7	A17 L24 I25 I61 L65	A17-L21 WeakPolarHBondContact O-CB 3.12Å; A17-L21 PolarHBondContact O-N 3.48Å; L21-L24 PolarHBondContact O-N 3.23Å; L21-I25 HydrophobicContact CD1-CD1 3.59Å; L21-I25 HydrophobicContact CD1-CG1 3.81Å; L21-I25 HydrophobicContact CD2-CD1 4.16Å; L21-I25 HydrophobicContact CG-CD1 3.65Å; L21-I25 HydrophobicContact CG-CG1 4.16Å; L21-I25 WeakPolarHBondContact O-CB 3.48Å; L21-I25 WeakPolarHBondContact O-CG1 3.28Å; L21-I25 PolarHBondContact O-N 3.47Å; L21-I61 HydrophobicContact CD1-CG2 3.43Å; L21-I61 VanDerWaalsContact CD1-CG2 3.43Å; L21-L65 HydrophobicContact CB-CD1 4.12Å; L21-L65 HydrophobicContact CD1-CD1 3.81Å; L21-L65 HydrophobicContact CD2-CD1 3.73Å; L21-L65 HydrophobicContact CG-CD1 4.08Å
22	K	51.4	Low	50.1	Low	145 Å²	145	82.4 Å²	82.4	63%	0.63	47%	0.472	S	S	*	.	H	α-helix	trans	-61.9	-44	177.4	-176.5	-173.8	174.8	-167.9	0	111.7	G18 E19 K20 L26	G18-K22 WeakPolarHBondContact O-CB 3.18Å; G18-K22 PolarHBondContact O-N 3.27Å; E19-K22 WeakPolarHBondContact O-CB 3.13Å; E19-K22 PolarHBondContact O-N 3.19Å; K20-K22 VanDerWaalsContact C-N 3.33Å; K22-L26 PolarHBondContact O-N 3.14Å
23	E	55	Low	49.3	Very low	92 Å²	92	88.7 Å²	88.7	43%	0.43	49%	0.494	S	S	.	.	H	α-helix	trans	-62.7	-40.9	172.3	-70.2	179.3	-177.6	0	0	112.5	E19 K20 L26	E19-E23 PolarHBondContact O-N 2.82Å; K20-E23 WeakPolarHBondContact CD-OE2 3.15Å; K20-E23 IonicContact NZ-OE1 2.7Å; K20-E23 PolarHBondContact NZ-OE1 2.98Å; K20-E23 IonicContact NZ-OE2 2.77Å; K20-E23 PolarHBondContact NZ-OE2 3.1Å; K20-E23 PolarHBondContact O-N 3.4Å; E23-L26 CarbonylContact O-C 3.26Å; E23-L26 VanDerWaalsContact O-C 3.26Å
24	L	52.4	Low	48.2	Very low	110 Å²	110	96.6 Å²	96.6	58%	0.576	53%	0.525	S	S	*	.	H	α-helix	trans	-74.6	-29.8	-178.3	-73.2	166.5	0	0	0	113.8	K20 L21 I61	K20-L24 WeakPolarHBondContact O-CB 3.45Å; K20-L24 WeakPolarHBondContact O-CD1 3.22Å; K20-L24 VanDerWaalsContact O-CG 3.28Å; K20-L24 WeakPolarHBondContact O-CG 3.21Å; K20-L24 PolarHBondContact O-N 2.79Å; L21-L24 PolarHBondContact O-N 3.23Å; L24-I61 HydrophobicContact CB-CD1 4.24Å
25	I	50.7	Low	47.3	Very low	66 Å²	66	95 Å²	95	34%	0.338	52%	0.515	S	S	.	.	H	α-helix	trans	-81	-32	174.4	-67.5	-179.5	0	0	0	111.3	L21 P27 I57	L21-I25 HydrophobicContact CD1-CD1 3.59Å; L21-I25 HydrophobicContact CD1-CG1 3.81Å; L21-I25 HydrophobicContact CD2-CD1 4.16Å; L21-I25 HydrophobicContact CG-CD1 3.65Å; L21-I25 HydrophobicContact CG-CG1 4.16Å; L21-I25 WeakPolarHBondContact O-CB 3.48Å; L21-I25 WeakPolarHBondContact O-CG1 3.28Å; L21-I25 PolarHBondContact O-N 3.47Å; I25-P27 WeakPolarHBondContact O-CD 3.41Å; I25-I57 HydrophobicContact CB-CD1 4.41Å; I25-I57 HydrophobicContact CD1-CG2 4.13Å; I25-I57 HydrophobicContact CG1-CD1 3.97Å; I25-I57 HydrophobicContact CG1-CG1 4.14Å; I25-I57 HydrophobicContact CG1-CG2 4.27Å; I25-I57 HydrophobicContact CG2-CD1 4.04Å
26	L	46	Very low	46.6	Very low	105 Å²	105	92.1 Å²	92.1	55%	0.55	51%	0.514	S	S	.	.			trans	-122.8	77.5	177.5	-68.6	98.5	0	0	0	112.3	K22 E23 G28	K22-L26 PolarHBondContact O-N 3.14Å; E23-L26 CarbonylContact O-C 3.26Å; E23-L26 VanDerWaalsContact O-C 3.26Å; L26-G28 PolarHBondContact O-N 2.87Å; L26-G28 VanDerWaalsContact O-N 3.14Å
27	P	47.2	Very low	45.8	Very low	49 Å²	49	91.6 Å²	91.6	32%	0.318	53%	0.526	S	S	.	.	G	3₁₀ helix	trans	-62.9	-17.6	171.2	25.3	-34.7	0	0	0	113.6	I25 S29 S30 Q31	I25-P27 WeakPolarHBondContact O-CD 3.41Å; P27-S29 PolarHBondContact O-N 2.75Å; P27-S30 PolarHBondContact O-N 2.62Å; P27-Q31 PolarHBondContact O-N 2.85Å
28	G	40.3	Very low	45	Very low	57 Å²	57	96.4 Å²	96.4	59%	0.588	55%	0.548	S	S	*	.	G	3₁₀ helix	trans	-73.7	24.7	-178	0	0	0	0	0	116.4	L26	L26-G28 PolarHBondContact O-N 2.87Å; L26-G28 VanDerWaalsContact O-N 3.14Å
29	S	37.4	Very low	44.6	Very low	97 Å²	97	97.2 Å²	97.2	68%	0.678	55%	0.551	S	S	*	*	G	3₁₀ helix	trans	-130.4	0.6	168.9	71.5	0	0	0	0	114.2	P27	P27-S29 PolarHBondContact O-N 2.75Å
30	S	35.9	Very low	43.5	Very low	74 Å²	74	94.6 Å²	94.6	52%	0.517	56%	0.558	S	S	.	*	T	Hydrogen-bonded Turn	trans	-138.8	-16.3	179.6	62	0	0	0	0	114	P27 D32	P27-S30 PolarHBondContact O-N 2.62Å; S30-D32 VanDerWaalsContact C-N 3.28Å
31	Q	36.2	Very low	42.7	Very low	127 Å²	127	97.5 Å²	97.5	59%	0.593	58%	0.578	S	S	*	*	H	α-helix	trans	-72.5	-22.4	172.1	-157.6	172.9	22.3	0	0	112.7	P27 E33 K34 G35	P27-Q31 PolarHBondContact O-N 2.85Å; Q31-E33 PolarHBondContact O-N 2.95Å; Q31-K34 PolarHBondContact O-N 3.4Å; Q31-G35 PolarHBondContact O-N 2.79Å
32	D	38.6	Very low	42.2	Very low	87 Å²	87	99.8 Å²	99.8	47%	0.465	59%	0.588	S	S	.	*	H	α-helix	trans	-59.8	-40.7	-177.9	-78.1	-9.4	0	0	0	113.3	S30 K34 Q44	S30-D32 VanDerWaalsContact C-N 3.28Å; D32-K34 PolarHBondContact O-N 3.45Å; D32-Q44 PolarHBondContact OD1-NE2 3.33Å
33	E	39.2	Very low	42.3	Very low	179 Å²	179	96.5 Å²	96.5	84%	0.836	58%	0.58	S	S	*	*	H	α-helix	trans	-70.8	-31.8	-178	-69.1	-154.5	125.3	0	0	113.5	Q31	Q31-E33 PolarHBondContact O-N 2.95Å
34	K	37.8	Very low	42.4	Very low	202 Å²	202	98 Å²	98	88%	0.878	59%	0.587	S	S	*	*	H	α-helix	trans	-94.5	-11.6	-174.9	-68	-178.4	-179.2	174.3	0	113.9	Q31 D32	Q31-K34 PolarHBondContact O-N 3.4Å; D32-K34 PolarHBondContact O-N 3.45Å
35	G	37.9	Very low	42.8	Very low	29 Å²	29	93.6 Å²	93.6	30%	0.299	57%	0.565	S	S	.	*	S	Bend	trans	-91.6	-5.4	171.9	0	0	0	0	0	115.3	Q31 A37 L38 A39	Q31-G35 PolarHBondContact O-N 2.79Å; G35-A37 VanDerWaalsContact C-N 3.27Å; G35-A37 PolarHBondContact O-N 2.75Å; G35-L38 PolarHBondContact O-N 2.69Å; G35-L38 VanDerWaalsContact O-N 3.09Å; G35-A39 WeakPolarHBondContact O-CB 3.47Å; G35-A39 PolarHBondContact O-N 2.9Å
36	G	38.1	Very low	43.5	Very low	57 Å²	57	94 Å²	94	59%	0.588	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.4	-18.6	-156	0	0	0	0	0	118.7
37	A	38.5	Very low	44.3	Very low	109 Å²	109	90 Å²	90	90%	0.901	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	-18.4	179.3	0	0	0	0	0	114.6	G35	G35-A37 VanDerWaalsContact C-N 3.27Å; G35-A37 PolarHBondContact O-N 2.75Å
38	L	40	Very low	45.4	Very low	129 Å²	129	90.1 Å²	90.1	68%	0.675	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.1	-31	-172.5	-145.4	154.4	0	0	0	112.1	G35 G40 L41	G35-L38 PolarHBondContact O-N 2.69Å; G35-L38 VanDerWaalsContact O-N 3.09Å; L38-G40 PolarHBondContact O-N 3.38Å; L38-L41 PolarHBondContact O-N 3.39Å
39	A	45	Very low	47	Very low	52 Å²	52	87.6 Å²	87.6	43%	0.43	51%	0.512	S	S	.	.	G	3₁₀ helix	trans	-63.2	-23.8	169.4	0	0	0	0	0	113	G35 L41	G35-A39 WeakPolarHBondContact O-CB 3.47Å; G35-A39 PolarHBondContact O-N 2.9Å; A39-L41 VanDerWaalsContact C-N 3.26Å; A39-L41 PolarHBondContact O-N 3.37Å
40	G	37.5	Very low	49	Very low	73 Å²	73	86.1 Å²	86.1	75%	0.753	50%	0.5	S	S	*	.	G	3₁₀ helix	trans	-68.6	-16.4	178.5	0	0	0	0	0	115.4	L38	L38-G40 PolarHBondContact O-N 3.38Å
41	L	37.7	Very low	51.2	Low	168 Å²	168	84.9 Å²	84.9	88%	0.88	49%	0.486	S	S	*	.	G	3₁₀ helix	trans	-105.9	-12.1	-179.4	-150.6	84.5	0	0	0	113.6	L38 A39	L38-L41 PolarHBondContact O-N 3.39Å; A39-L41 VanDerWaalsContact C-N 3.26Å; A39-L41 PolarHBondContact O-N 3.37Å
42	M	43.7	Very low	53.5	Low	88 Å²	88	78.9 Å²	78.9	43%	0.433	46%	0.458	S	S	.	.	S	Bend	trans	-116.8	120.9	177.1	-61.6	-171.1	76.4	0	0	108.4	Q44 T152	M42-Q44 PolarHBondContact O-N 2.94Å; M42-Q44 VanDerWaalsContact O-N 3.16Å; M42-T152 HydrophobicContact CE-CG2 3.58Å
43	V	53.8	Low	55.7	Low	76 Å²	76	79.6 Å²	79.6	46%	0.461	45%	0.454	S	S	.	.			trans	-50.2	127	174.6	-179.4	0	0	0	0	108.8	L45 H358	V43-L45 HydrophobicContact CB-CD1 4.44Å; V43-L45 HydrophobicContact CB-CG 4.35Å; V43-L45 HydrophobicContact CG1-CG 4.23Å; V43-L45 WeakPolarHBondContact O-CD1 3.23Å; V43-L45 WeakPolarHBondContact O-CG 3.1Å; V43-L45 PolarHBondContact O-N 2.85Å; V43-H358 HydrophobicContact CG1-CB 4.25Å
44	Q	56.6	Low	58	Low	124 Å²	124	74.9 Å²	74.9	58%	0.579	44%	0.437	S	S	*	.			trans	-72.4	68.1	-173.8	-165.7	-176.8	27.4	0	0	110.9	D32 M42	D32-Q44 PolarHBondContact OD1-NE2 3.33Å; M42-Q44 PolarHBondContact O-N 2.94Å; M42-Q44 VanDerWaalsContact O-N 3.16Å
45	L	60.5	Low	60.5	Low	18 Å²	18	65.4 Å²	65.4	9%	0.094	40%	0.396	C	S	.	.			trans	-70.1	138.4	-176.1	-66.1	139.3	0	0	0	110.5	V43 L47 T152 L155 N156 L159 N355	V43-L45 HydrophobicContact CB-CD1 4.44Å; V43-L45 HydrophobicContact CB-CG 4.35Å; V43-L45 HydrophobicContact CG1-CG 4.23Å; V43-L45 WeakPolarHBondContact O-CD1 3.23Å; V43-L45 WeakPolarHBondContact O-CG 3.1Å; V43-L45 PolarHBondContact O-N 2.85Å; L45-L47 HydrophobicContact CB-CD1 3.5Å; L45-L47 WeakPolarHBondContact O-CD1 3.36Å; L45-L47 PolarHBondContact O-N 3.33Å; L45-T152 HydrophobicContact CD1-CG2 4.15Å; L45-L155 HydrophobicContact CD2-CD2 4.02Å; L45-L155 HydrophobicContact CD2-CG 4.29Å; L45-N156 WeakPolarHBondContact CD1-ND2 3.31Å; L45-L159 HydrophobicContact CD2-CD2 3.82Å; L45-N355 VanDerWaalsContact CA-OD1 3.29Å; L45-N355 WeakPolarHBondContact CA-OD1 3.18Å; L45-N355 WeakPolarHBondContact CB-OD1 3.37Å; L45-N355 HydrophobicContact CD2-CB 3.93Å
46	K	66	Low	62.9	Low	75 Å²	75	64.9 Å²	64.9	33%	0.326	39%	0.387	S	S	.	.			trans	-69.3	98.4	167.7	-61.8	170.3	-176.2	169.1	0	108.7	E48 E354 N355	K46-E48 VanDerWaalsContact C-N 3.31Å; K46-E354 HydrophobicContact CB-CG 4.37Å; K46-E354 HydrophobicContact CD-CG 3.93Å; K46-E354 WeakPolarHBondContact CD-OE1 3.2Å; K46-E354 IonicContact NZ-OE1 3.51Å; K46-E354 PolarHBondContact NZ-OE1 3.11Å; K46-N355 PolarHBondContact N-OD1 2.64Å; K46-N355 PolarHBondContact O-ND2 3.36Å
47	L	62.4	Low	65.3	Low	20 Å²	20	63.7 Å²	63.7	11%	0.105	37%	0.367	C	S	.	.			trans	-89.8	4.8	179	-102.4	81.4	0	0	0	115.1	L45 W143 S148 L151 T152 F351	L45-L47 HydrophobicContact CB-CD1 3.5Å; L45-L47 WeakPolarHBondContact O-CD1 3.36Å; L45-L47 PolarHBondContact O-N 3.33Å; L47-W143 PolarHBondContact O-NE1 3.04Å; L47-S148 WeakPolarHBondContact CD2-O 3.33Å; L47-S148 WeakPolarHBondContact CD2-OG 3.34Å; L47-L151 HydrophobicContact CD2-CB 4.28Å; L47-L151 HydrophobicContact CG-CD2 4.46Å; L47-T152 HydrophobicContact CD1-CG2 4.23Å; L47-T152 WeakPolarHBondContact CD2-OG1 3.2Å; L47-F351 WeakPolarHBondContact O-CE1 3.42Å
48	E	70.3	Confident	67.7	Low	51 Å²	51	58.5 Å²	58.5	24%	0.238	32%	0.324	C	S	.	.	S	Bend	trans	-121.5	142.5	165.1	-59.6	-171.3	109.6	0	0	108.6	K46 R53 R231	K46-E48 VanDerWaalsContact C-N 3.31Å; E48-R53 HydrophobicContact CB-CG 4.03Å; E48-R53 VanDerWaalsContact OE2-CG 3.3Å; E48-R53 WeakPolarHBondContact OE2-CG 3.34Å; E48-R53 IonicContact OE2-CZ 2.64Å; E48-R53 IonicContact OE2-NE 3.54Å; E48-R53 PolarHBondContact OE2-NE 3.17Å; E48-R53 IonicContact OE2-NH2 2.81Å; E48-R231 IonicContact OE1-NH2 3.6Å; E48-R231 PolarHBondContact OE1-NH2 2.7Å
49	L	74.8	Confident	70.1	Confident	4 Å²	4	52.5 Å²	52.5	2%	0.021	29%	0.293	C	S	.	.			trans	-66.5	150	166.8	-80.8	40.6	0	0	0	108.7	F51 D52 R53 Y228 M350 F351	L49-F51 HydrophobicContact CB-CB 4.2Å; L49-F51 PolarHBondContact O-N 3.31Å; L49-D52 HydrophobicContact CB-CB 4.29Å; L49-D52 WeakPolarHBondContact CD2-OD1 3.36Å; L49-D52 PolarHBondContact O-N 3.47Å; L49-D52 VanDerWaalsContact O-N 3.13Å; L49-R53 PolarHBondContact O-N 3.48Å; L49-R53 VanDerWaalsContact O-N 3.16Å; L49-Y228 HydrophobicContact CD2-CE2 4.13Å; L49-Y228 WeakPolarHBondContact CD2-OH 3.19Å; L49-M350 HydrophobicContact CD2-CE 4.02Å; L49-M350 HydrophobicContact CD2-SD 3.39Å; L49-M350 WeakPolarHBondContact CD2-SD 3.26Å; L49-M350 HydrophobicContact CG-SD 3.78Å; L49-F351 HydrophobicContact CD1-CD1 3.64Å; L49-F351 HydrophobicContact CD1-CD2 4.19Å; L49-F351 HydrophobicContact CD1-CE1 3.21Å; L49-F351 HydrophobicContact CD1-CE2 3.81Å; L49-F351 HydrophobicContact CD1-CG 4.11Å; L49-F351 HydrophobicContact CD1-CZ 3.3Å
50	P	78.6	Confident	72.4	Confident	66 Å²	66	50.4 Å²	50.4	43%	0.429	28%	0.275	S	S	.	.	H	α-helix	trans	-56.9	-29.9	167.8	24	-33.5	0	0	0	111.5	V54 E354	P50-V54 WeakPolarHBondContact O-CG2 3.48Å; P50-V54 PolarHBondContact O-N 2.95Å; P50-E354 WeakPolarHBondContact CD-OE2 3.25Å
51	F	81.5	Confident	74.9	Confident	49 Å²	49	48 Å²	48	22%	0.215	25%	0.245	C	C	.	.	H	α-helix	trans	-61.2	-55.1	171.4	-175.7	-90	0	0	0	112.9	L49 R53 V54 V55 I305 I306 N309	L49-F51 HydrophobicContact CB-CB 4.2Å; L49-F51 PolarHBondContact O-N 3.31Å; F51-R53 PolarHBondContact O-N 2.93Å; F51-V54 PolarHBondContact O-N 2.85Å; F51-V55 HydrophobicContact CD1-CG2 3.98Å; F51-V55 HydrophobicContact CE1-CG2 3.49Å; F51-V55 VanDerWaalsContact CE1-CG2 3.49Å; F51-V55 HydrophobicContact CZ-CG2 3.86Å; F51-V55 PolarHBondContact O-N 3.35Å; F51-I305 HydrophobicContact CE2-CG2 3.57Å; F51-I305 HydrophobicContact CZ-CG2 3.88Å; F51-I306 HydrophobicContact CE1-CG1 4.42Å; F51-I306 HydrophobicContact CZ-CG1 4.35Å; F51-N309 WeakPolarHBondContact CD1-ND2 3.46Å; F51-N309 HydrophobicContact CD2-CB 4.46Å; F51-N309 HydrophobicContact CE1-CB 3.96Å; F51-N309 WeakPolarHBondContact CE1-ND2 3.49Å; F51-N309 HydrophobicContact CE2-CB 3.72Å; F51-N309 HydrophobicContact CZ-CB 3.45Å; F51-N309 VanDerWaalsContact CZ-CB 3.45Å; F51-N309 WeakPolarHBondContact CZ-ND2 3.28Å
52	D	84.4	Confident	77.3	Confident	1 Å²	1	43 Å²	43	1%	0.005	22%	0.218	C	C	.	.	H	α-helix	trans	-57.8	-34.6	-179.1	-70.3	38.6	0	0	0	111.1	L49 V55 T56 Y228 R231 H232	L49-D52 HydrophobicContact CB-CB 4.29Å; L49-D52 WeakPolarHBondContact CD2-OD1 3.36Å; L49-D52 PolarHBondContact O-N 3.47Å; L49-D52 VanDerWaalsContact O-N 3.13Å; D52-V55 PolarHBondContact O-N 2.9Å; D52-T56 PolarHBondContact O-N 3.17Å; D52-T56 VanDerWaalsContact O-N 3.08Å; D52-T56 PolarHBondContact O-OG1 2.85Å; D52-Y228 PolarHBondContact OD1-OH 2.77Å; D52-Y228 WeakPolarHBondContact OD2-CE2 3.33Å; D52-R231 IonicContact OD2-CZ 2.68Å; D52-R231 IonicContact OD2-NH1 3.37Å; D52-R231 PolarHBondContact OD2-NH1 3.23Å; D52-H232 IonicContact OD1-CE1 2.73Å; D52-H232 IonicContact OD1-NE2 2.78Å; D52-H232 IonicContact OD2-CE1 3.18Å
53	R	85.8	Confident	79.6	Confident	102 Å²	102	39 Å²	39	39%	0.385	20%	0.199	S	C	.	.	H	α-helix	trans	-67.5	-47.6	172.1	-71.8	-177.3	172.6	177	-0.5	113.4	E48 L49 F51 V55 T56 I57	E48-R53 HydrophobicContact CB-CG 4.03Å; E48-R53 VanDerWaalsContact OE2-CG 3.3Å; E48-R53 WeakPolarHBondContact OE2-CG 3.34Å; E48-R53 IonicContact OE2-CZ 2.64Å; E48-R53 IonicContact OE2-NE 3.54Å; E48-R53 PolarHBondContact OE2-NE 3.17Å; E48-R53 IonicContact OE2-NH2 2.81Å; L49-R53 PolarHBondContact O-N 3.48Å; L49-R53 VanDerWaalsContact O-N 3.16Å; F51-R53 PolarHBondContact O-N 2.93Å; R53-V55 PolarHBondContact O-N 2.82Å; R53-T56 PolarHBondContact O-N 3.35Å; R53-T56 VanDerWaalsContact O-N 3.15Å; R53-I57 WeakPolarHBondContact O-CD1 3.38Å; R53-I57 VanDerWaalsContact O-CG1 3.25Å; R53-I57 WeakPolarHBondContact O-CG1 3.43Å; R53-I57 PolarHBondContact O-N 2.62Å
54	V	88.3	Confident	81.3	Confident	80 Å²	80	38.1 Å²	38.1	49%	0.485	19%	0.191	S	C	.	.	H	α-helix	trans	-58.1	-36.8	175.1	168.4	0	0	0	0	110.9	P50 F51 G58	P50-V54 WeakPolarHBondContact O-CG2 3.48Å; P50-V54 PolarHBondContact O-N 2.95Å; F51-V54 PolarHBondContact O-N 2.85Å; V54-G58 PolarHBondContact O-N 3.43Å
55	V	89.6	Confident	82.9	Confident	2 Å²	2	34.4 Å²	34.4	1%	0.012	18%	0.175	C	C	.	.	H	α-helix	trans	-63.8	-47.2	173.5	167.7	0	0	0	0	112.1	F51 D52 R53 G58 T59 I235 I306	F51-V55 HydrophobicContact CD1-CG2 3.98Å; F51-V55 HydrophobicContact CE1-CG2 3.49Å; F51-V55 VanDerWaalsContact CE1-CG2 3.49Å; F51-V55 HydrophobicContact CZ-CG2 3.86Å; F51-V55 PolarHBondContact O-N 3.35Å; D52-V55 PolarHBondContact O-N 2.9Å; R53-V55 PolarHBondContact O-N 2.82Å; V55-G58 PolarHBondContact O-N 2.83Å; V55-T59 HydrophobicContact CG1-CG2 4.48Å; V55-T59 WeakPolarHBondContact O-CB 3.24Å; V55-T59 WeakPolarHBondContact O-CG2 3.34Å; V55-T59 PolarHBondContact O-N 3.39Å; V55-T59 PolarHBondContact O-OG1 2.78Å; V55-I235 HydrophobicContact CG1-CD1 4.18Å; V55-I235 HydrophobicContact CG1-CG2 4.19Å; V55-I306 HydrophobicContact CG1-CD1 3.75Å; V55-I306 HydrophobicContact CG1-CG1 4.21Å; V55-I306 HydrophobicContact CG2-CD1 4.14Å; V55-I306 HydrophobicContact CG2-CG1 3.71Å
56	T	88.6	Confident	84.2	Confident	19 Å²	19	35.1 Å²	35.1	12%	0.117	18%	0.178	C	C	.	.	H	α-helix	trans	-66.4	-40.1	177.9	-61.3	0	0	0	0	112.1	D52 R53 G58 V60 I61 Y137	D52-T56 PolarHBondContact O-N 3.17Å; D52-T56 VanDerWaalsContact O-N 3.08Å; D52-T56 PolarHBondContact O-OG1 2.85Å; R53-T56 PolarHBondContact O-N 3.35Å; R53-T56 VanDerWaalsContact O-N 3.15Å; T56-G58 PolarHBondContact O-N 2.58Å; T56-V60 HydrophobicContact CG2-CG2 4.5Å; T56-V60 WeakPolarHBondContact O-CB 3.5Å; T56-V60 PolarHBondContact O-N 2.86Å; T56-I61 PolarHBondContact O-N 2.78Å; T56-Y137 HydrophobicContact CG2-CD2 4.2Å; T56-Y137 HydrophobicContact CG2-CE2 4.2Å
57	I	88.8	Confident	85.3	Confident	31 Å²	31	31.9 Å²	31.9	16%	0.159	17%	0.165	C	C	.	.	I	π-helix	trans	-61	-46.6	173.9	-64.4	159.6	0	0	0	110.2	I25 R53 I61 I62	I25-I57 HydrophobicContact CB-CD1 4.41Å; I25-I57 HydrophobicContact CD1-CG2 4.13Å; I25-I57 HydrophobicContact CG1-CD1 3.97Å; I25-I57 HydrophobicContact CG1-CG1 4.14Å; I25-I57 HydrophobicContact CG1-CG2 4.27Å; I25-I57 HydrophobicContact CG2-CD1 4.04Å; R53-I57 WeakPolarHBondContact O-CD1 3.38Å; R53-I57 VanDerWaalsContact O-CG1 3.25Å; R53-I57 WeakPolarHBondContact O-CG1 3.43Å; R53-I57 PolarHBondContact O-N 2.62Å; I57-I61 HydrophobicContact CB-CD1 4.48Å; I57-I61 HydrophobicContact CG1-CD1 3.97Å; I57-I61 PolarHBondContact O-N 2.69Å; I57-I62 HydrophobicContact CG2-CD1 4.38Å; I57-I62 HydrophobicContact CG2-CG1 4.33Å; I57-I62 PolarHBondContact O-N 2.62Å
58	G	88.5	Confident	86.5	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.178	C	C	.	.	I	π-helix	trans	-70.2	-33.8	-177.8	0	0	0	0	0	115.3	V54 V55 T56 L298	V54-G58 PolarHBondContact O-N 3.43Å; V55-G58 PolarHBondContact O-N 2.83Å; T56-G58 PolarHBondContact O-N 2.58Å; G58-L298 WeakPolarHBondContact O-CD2 3.18Å; G58-L298 WeakPolarHBondContact O-CG 3.42Å
59	T	90.8	Very high	87.1	Confident	4 Å²	4	35.1 Å²	35.1	3%	0.025	19%	0.186	C	C	.	.	I	π-helix	trans	-104	-8.7	-174.2	59.6	0	0	0	0	114.7	V55 M136 L299 M302	V55-T59 HydrophobicContact CG1-CG2 4.48Å; V55-T59 WeakPolarHBondContact O-CB 3.24Å; V55-T59 WeakPolarHBondContact O-CG2 3.34Å; V55-T59 PolarHBondContact O-N 3.39Å; V55-T59 PolarHBondContact O-OG1 2.78Å; T59-M136 HydrophobicContact CG2-CE 4.37Å; T59-L299 HydrophobicContact CG2-CD2 4.35Å; T59-M302 HydrophobicContact CG2-CB 3.74Å; T59-M302 HydrophobicContact CG2-CG 4.19Å
60	V	91.8	Very high	87.5	Confident	8 Å²	8	35.3 Å²	35.3	5%	0.048	19%	0.187	C	C	.	.	I	π-helix	trans	-127	-56.3	178.1	-177.8	0	0	0	0	111.6	T56 P63 I64 A133 M136 Y137	T56-V60 HydrophobicContact CG2-CG2 4.5Å; T56-V60 WeakPolarHBondContact O-CB 3.5Å; T56-V60 PolarHBondContact O-N 2.86Å; V60-P63 WeakPolarHBondContact O-CD 3.32Å; V60-I64 HydrophobicContact CG1-CD1 3.78Å; V60-I64 VanDerWaalsContact O-CG1 3.25Å; V60-I64 WeakPolarHBondContact O-CG1 3.44Å; V60-I64 PolarHBondContact O-N 3.45Å; V60-I64 VanDerWaalsContact O-N 3.08Å; V60-A133 HydrophobicContact CG1-CB 4.48Å; V60-M136 HydrophobicContact CG2-CB 3.84Å; V60-Y137 HydrophobicContact CG1-CD2 4.38Å
61	I	89.8	Confident	87.7	Confident	23 Å²	23	34 Å²	34	12%	0.118	17%	0.174	C	C	.	.	I	π-helix	trans	-73.5	-46	-167.6	-56.9	173.6	0	0	0	111.8	L21 L24 T56 I57 I64 L65	L21-I61 HydrophobicContact CD1-CG2 3.43Å; L21-I61 VanDerWaalsContact CD1-CG2 3.43Å; L24-I61 HydrophobicContact CB-CD1 4.24Å; T56-I61 PolarHBondContact O-N 2.78Å; I57-I61 HydrophobicContact CB-CD1 4.48Å; I57-I61 HydrophobicContact CG1-CD1 3.97Å; I57-I61 PolarHBondContact O-N 2.69Å; I61-I64 PolarHBondContact O-N 3.31Å; I61-L65 PolarHBondContact O-N 2.65Å
62	I	89.6	Confident	87.8	Confident	61 Å²	61	33.9 Å²	33.9	31%	0.313	18%	0.178	S	C	.	.	H	α-helix	trans	-63.1	-47	177.2	-62.3	173.3	0	0	0	111.3	I57 I64 L65 L66 L298	I57-I62 HydrophobicContact CG2-CD1 4.38Å; I57-I62 HydrophobicContact CG2-CG1 4.33Å; I57-I62 PolarHBondContact O-N 2.62Å; I62-I64 VanDerWaalsContact C-N 3.3Å; I62-I64 PolarHBondContact O-N 3.5Å; I62-L65 PolarHBondContact O-N 3.16Å; I62-L66 HydrophobicContact CG2-CD1 3.94Å; I62-L66 HydrophobicContact CG2-CG 4.18Å; I62-L66 WeakPolarHBondContact O-CB 3.43Å; I62-L66 VanDerWaalsContact O-CG 3.26Å; I62-L66 WeakPolarHBondContact O-CG 3.28Å; I62-L66 PolarHBondContact O-N 3.41Å; I62-L298 HydrophobicContact CB-CD2 3.8Å; I62-L298 HydrophobicContact CG2-CD2 3.42Å; I62-L298 VanDerWaalsContact CG2-CD2 3.42Å
63	P	90.5	Very high	87.6	Confident	6 Å²	6	37.6 Å²	37.6	4%	0.039	19%	0.192	C	C	.	.	H	α-helix	trans	-55.1	-39	172.1	-28.1	35.2	0	0	0	114.2	V60 L66 V67 D295 L298	V60-P63 WeakPolarHBondContact O-CD 3.32Å; P63-L66 PolarHBondContact O-N 3.29Å; P63-V67 VanDerWaalsContact O-CG2 3.3Å; P63-V67 WeakPolarHBondContact O-CG2 3.39Å; P63-V67 PolarHBondContact O-N 2.89Å; P63-D295 WeakPolarHBondContact CG-OD1 3.45Å; P63-L298 HydrophobicContact CG-CD2 4.32Å
64	I	90.7	Very high	87.3	Confident	57 Å²	57	34.7 Å²	34.7	29%	0.292	18%	0.184	S	C	.	.	H	α-helix	trans	-63.1	-49.7	174.6	-71.7	167.3	0	0	0	111.2	V60 I61 I62 L66 V67 T68 A133	V60-I64 HydrophobicContact CG1-CD1 3.78Å; V60-I64 VanDerWaalsContact O-CG1 3.25Å; V60-I64 WeakPolarHBondContact O-CG1 3.44Å; V60-I64 PolarHBondContact O-N 3.45Å; V60-I64 VanDerWaalsContact O-N 3.08Å; I61-I64 PolarHBondContact O-N 3.31Å; I62-I64 VanDerWaalsContact C-N 3.3Å; I62-I64 PolarHBondContact O-N 3.5Å; I64-L66 VanDerWaalsContact C-N 3.28Å; I64-L66 PolarHBondContact O-N 3.21Å; I64-V67 PolarHBondContact O-N 2.96Å; I64-V67 VanDerWaalsContact O-N 3.15Å; I64-T68 PolarHBondContact O-N 3.28Å; I64-T68 PolarHBondContact O-OG1 2.84Å; I64-T68 VanDerWaalsContact O-OG1 3.07Å; I64-A133 HydrophobicContact CD1-CB 3.96Å; I64-A133 HydrophobicContact CG1-CB 3.56Å
65	L	89.5	Confident	86.6	Confident	46 Å²	46	38.8 Å²	38.8	24%	0.241	20%	0.196	C	C	.	.	H	α-helix	trans	-59.4	-40.9	178.2	-69.8	-171.7	0	0	0	112.4	A17 L21 I61 I62 T68 L69	A17-L65 HydrophobicContact CB-CD2 4.1Å; L21-L65 HydrophobicContact CB-CD1 4.12Å; L21-L65 HydrophobicContact CD1-CD1 3.81Å; L21-L65 HydrophobicContact CD2-CD1 3.73Å; L21-L65 HydrophobicContact CG-CD1 4.08Å; I61-L65 PolarHBondContact O-N 2.65Å; I62-L65 PolarHBondContact O-N 3.16Å; L65-T68 PolarHBondContact O-N 3.29Å; L65-L69 PolarHBondContact O-N 3.36Å
66	L	88.3	Confident	86	Confident	33 Å²	33	41.6 Å²	41.6	17%	0.173	22%	0.219	C	C	.	.	H	α-helix	trans	-58.3	-48.8	175.1	-75.2	176.2	0	0	0	110.5	I62 P63 I64 T68 L69 V70 M291 V294 D295	I62-L66 HydrophobicContact CG2-CD1 3.94Å; I62-L66 HydrophobicContact CG2-CG 4.18Å; I62-L66 WeakPolarHBondContact O-CB 3.43Å; I62-L66 VanDerWaalsContact O-CG 3.26Å; I62-L66 WeakPolarHBondContact O-CG 3.28Å; I62-L66 PolarHBondContact O-N 3.41Å; P63-L66 PolarHBondContact O-N 3.29Å; I64-L66 VanDerWaalsContact C-N 3.28Å; I64-L66 PolarHBondContact O-N 3.21Å; L66-T68 PolarHBondContact O-N 3.38Å; L66-L69 PolarHBondContact O-N 2.88Å; L66-V70 PolarHBondContact O-N 2.95Å; L66-M291 VanDerWaalsContact C-CE 3.43Å; L66-M291 VanDerWaalsContact CA-CE 3.4Å; L66-M291 HydrophobicContact CB-CE 3.34Å; L66-M291 HydrophobicContact CD2-CE 3.34Å; L66-M291 HydrophobicContact CD2-SD 4.23Å; L66-M291 HydrophobicContact CG-CE 3.85Å; L66-M291 WeakPolarHBondContact O-CE 3.38Å; L66-V294 HydrophobicContact CD1-CG1 3.99Å; L66-V294 HydrophobicContact CD2-CG1 4.24Å; L66-D295 HydrophobicContact CD1-CB 4.35Å
67	V	88.1	Confident	85.2	Confident	7 Å²	7	44.7 Å²	44.7	4%	0.042	23%	0.232	C	C	.	.	H	α-helix	trans	-62.8	-40.4	175.5	169.2	0	0	0	0	112.5	P63 I64 L69 V70 F71 P126 L129 L130	P63-V67 VanDerWaalsContact O-CG2 3.3Å; P63-V67 WeakPolarHBondContact O-CG2 3.39Å; P63-V67 PolarHBondContact O-N 2.89Å; I64-V67 PolarHBondContact O-N 2.96Å; I64-V67 VanDerWaalsContact O-N 3.15Å; V67-L69 PolarHBondContact O-N 2.97Å; V67-V70 PolarHBondContact O-N 3.29Å; V67-F71 HydrophobicContact CG1-CD2 3.68Å; V67-F71 HydrophobicContact CG1-CE2 3.64Å; V67-F71 WeakPolarHBondContact O-CD2 3.03Å; V67-F71 PolarHBondContact O-N 2.93Å; V67-P126 HydrophobicContact CG1-CB 4.36Å; V67-P126 WeakPolarHBondContact CG1-O 3.26Å; V67-L129 HydrophobicContact CG2-CB 3.39Å; V67-L129 HydrophobicContact CG2-CD1 3.86Å; V67-L129 HydrophobicContact CG2-CG 4.28Å; V67-L130 HydrophobicContact CG1-CB 4.47Å
68	T	88.1	Confident	84.6	Confident	61 Å²	61	47.7 Å²	47.7	37%	0.374	25%	0.245	S	C	.	.	H	α-helix	trans	-60.8	-44.9	177.4	-59.1	0	0	0	0	111.9	I64 L65 L66 V70 F71 T72	I64-T68 PolarHBondContact O-N 3.28Å; I64-T68 PolarHBondContact O-OG1 2.84Å; I64-T68 VanDerWaalsContact O-OG1 3.07Å; L65-T68 PolarHBondContact O-N 3.29Å; L66-T68 PolarHBondContact O-N 3.38Å; T68-V70 VanDerWaalsContact C-N 3.3Å; T68-V70 PolarHBondContact O-N 2.85Å; T68-F71 PolarHBondContact O-N 2.88Å; T68-F71 VanDerWaalsContact O-N 3.14Å; T68-T72 PolarHBondContact O-N 3Å; T68-T72 PolarHBondContact O-OG1 2.66Å
69	L	84	Confident	84	Confident	77 Å²	77	49.8 Å²	49.8	40%	0.403	26%	0.26	S	S	.	.	H	α-helix	trans	-60.6	-39.3	177.4	-172	158.4	0	0	0	111.8	L65 L66 V67 T72 R73 L287	L65-L69 PolarHBondContact O-N 3.36Å; L66-L69 PolarHBondContact O-N 2.88Å; V67-L69 PolarHBondContact O-N 2.97Å; L69-T72 PolarHBondContact O-OG1 2.78Å; L69-T72 VanDerWaalsContact O-OG1 3.07Å; L69-R73 HydrophobicContact CD2-CG 4.46Å; L69-R73 PolarHBondContact O-N 2.62Å; L69-R73 VanDerWaalsContact O-N 3.13Å; L69-L287 HydrophobicContact CD2-CD1 4.4Å
70	V	83.1	Confident	83.9	Confident	8 Å²	8	49.7 Å²	49.7	5%	0.048	26%	0.259	C	S	.	.	H	α-helix	trans	-64.9	-42.5	174.3	172.9	0	0	0	0	111.4	L66 V67 T68 N74 P126 L287 Q288 M291	L66-V70 PolarHBondContact O-N 2.95Å; V67-V70 PolarHBondContact O-N 3.29Å; T68-V70 VanDerWaalsContact C-N 3.3Å; T68-V70 PolarHBondContact O-N 2.85Å; V70-N74 WeakPolarHBondContact CG1-ND2 3.38Å; V70-N74 VanDerWaalsContact O-CB 3.26Å; V70-N74 WeakPolarHBondContact O-CB 3.15Å; V70-N74 PolarHBondContact O-N 2.66Å; V70-N74 PolarHBondContact O-ND2 3.29Å; V70-P126 HydrophobicContact CG1-CG 4.19Å; V70-L287 HydrophobicContact CG2-CD2 4.25Å; V70-L287 HydrophobicContact CG2-CG 4.21Å; V70-Q288 HydrophobicContact CG1-CG 4.13Å; V70-M291 HydrophobicContact CG2-CB 4.08Å; V70-M291 HydrophobicContact CG2-CE 3.82Å; V70-M291 HydrophobicContact CG2-CG 3.51Å; V70-M291 HydrophobicContact CG2-SD 4.18Å
71	F	82.8	Confident	83.7	Confident	38 Å²	38	53.8 Å²	53.8	17%	0.167	28%	0.275	C	S	.	.	H	α-helix	trans	-62.9	-47.3	176.4	-89.6	-66.5	0	0	0	112.1	V67 T68 R73 N74 F75 P126 Y127	V67-F71 HydrophobicContact CG1-CD2 3.68Å; V67-F71 HydrophobicContact CG1-CE2 3.64Å; V67-F71 WeakPolarHBondContact O-CD2 3.03Å; V67-F71 PolarHBondContact O-N 2.93Å; T68-F71 PolarHBondContact O-N 2.88Å; T68-F71 VanDerWaalsContact O-N 3.14Å; F71-R73 VanDerWaalsContact C-N 3.33Å; F71-R73 PolarHBondContact O-N 2.81Å; F71-N74 PolarHBondContact O-N 2.9Å; F71-F75 AromaticContact CD1-CE2 3.93Å; F71-F75 HydrophobicContact CD1-CE2 3.93Å; F71-F75 WeakPolarHBondContact O-CD2 3.35Å; F71-F75 PolarHBondContact O-N 2.79Å; F71-P126 HydrophobicContact CD2-CB 4.04Å; F71-P126 HydrophobicContact CE1-CB 4.06Å; F71-P126 HydrophobicContact CE2-CB 3.42Å; F71-P126 VanDerWaalsContact CE2-CB 3.42Å; F71-P126 HydrophobicContact CZ-CB 3.44Å; F71-P126 VanDerWaalsContact CZ-CB 3.44Å; F71-Y127 AromaticContact CE1-CE1 3.99Å; F71-Y127 HydrophobicContact CE1-CE1 3.99Å; F71-Y127 HydrophobicContact CE1-CE2 4.21Å; F71-Y127 AromaticContact CE1-CZ 3.76Å; F71-Y127 AromaticContact CZ-CD1 3.93Å; F71-Y127 HydrophobicContact CZ-CD1 3.93Å; F71-Y127 HydrophobicContact CZ-CD2 4.37Å; F71-Y127 AromaticContact CZ-CE1 3.71Å; F71-Y127 HydrophobicContact CZ-CE1 3.71Å; F71-Y127 HydrophobicContact CZ-CE2 4.18Å; F71-Y127 HydrophobicContact CZ-CG 4.26Å; F71-Y127 AromaticContact CZ-CZ 3.85Å
72	T	82.9	Confident	83.7	Confident	47 Å²	47	53.9 Å²	53.9	29%	0.288	28%	0.277	S	S	.	.	H	α-helix	trans	-63.6	-39	-178.9	53	0	0	0	0	112	T13 T68 L69 F75 A76	T13-T72 HydrophobicContact CG2-CG2 3.85Å; T68-T72 PolarHBondContact O-N 3Å; T68-T72 PolarHBondContact O-OG1 2.66Å; L69-T72 PolarHBondContact O-OG1 2.78Å; L69-T72 VanDerWaalsContact O-OG1 3.07Å; T72-F75 PolarHBondContact O-N 3.37Å; T72-A76 PolarHBondContact O-N 2.77Å; T72-A76 VanDerWaalsContact O-N 3.16Å
73	R	80.7	Confident	83.7	Confident	79 Å²	79	58.3 Å²	58.3	30%	0.298	29%	0.291	S	S	.	.	H	α-helix	trans	-63.5	-45.5	171	-76.3	-61.5	-168	99.1	1.7	112.9	D10 L69 F71 F75 A76 E77 L287	D10-R73 IonicContact OD1-CZ 2.67Å; D10-R73 IonicContact OD1-NE 3.76Å; D10-R73 PolarHBondContact OD1-NE 2.82Å; D10-R73 IonicContact OD1-NH2 3.93Å; D10-R73 PolarHBondContact OD1-NH2 3.4Å; D10-R73 IonicContact OD2-CZ 3.55Å; D10-R73 IonicContact OD2-NE 3.71Å; D10-R73 PolarHBondContact OD2-NE 3.27Å; D10-R73 IonicContact OD2-NH2 3.78Å; D10-R73 PolarHBondContact OD2-NH2 2.76Å; L69-R73 HydrophobicContact CD2-CG 4.46Å; L69-R73 PolarHBondContact O-N 2.62Å; L69-R73 VanDerWaalsContact O-N 3.13Å; F71-R73 VanDerWaalsContact C-N 3.33Å; F71-R73 PolarHBondContact O-N 2.81Å; R73-F75 PolarHBondContact O-N 3.28Å; R73-A76 PolarHBondContact O-N 2.91Å; R73-A76 VanDerWaalsContact O-N 3.11Å; R73-E77 IonicContact NH1-OE1 3.79Å; R73-E77 PolarHBondContact NH1-OE1 2.75Å; R73-E77 PolarHBondContact O-N 3.3Å; R73-L287 HydrophobicContact CB-CD2 3.63Å; R73-L287 HydrophobicContact CG-CD2 3.9Å
74	N	77.9	Confident	83.6	Confident	41 Å²	41	60 Å²	60	22%	0.219	30%	0.301	C	S	.	.	H	α-helix	trans	-68.1	-12.5	179.1	-71	-14.4	0	0	0	114.6	V70 F71 A284	V70-N74 WeakPolarHBondContact CG1-ND2 3.38Å; V70-N74 VanDerWaalsContact O-CB 3.26Å; V70-N74 WeakPolarHBondContact O-CB 3.15Å; V70-N74 PolarHBondContact O-N 2.66Å; V70-N74 PolarHBondContact O-ND2 3.29Å; F71-N74 PolarHBondContact O-N 2.9Å; N74-A284 VanDerWaalsContact OD1-CB 3.28Å; N74-A284 WeakPolarHBondContact OD1-CB 3.26Å
75	F	75.4	Confident	83.4	Confident	167 Å²	167	59.9 Å²	59.9	73%	0.732	30%	0.304	S	S	*	.	H	α-helix	trans	-97.2	-20.7	170.8	-78.7	-63.7	0	0	0	113.5	F71 T72 R73	F71-F75 AromaticContact CD1-CE2 3.93Å; F71-F75 HydrophobicContact CD1-CE2 3.93Å; F71-F75 WeakPolarHBondContact O-CD2 3.35Å; F71-F75 PolarHBondContact O-N 2.79Å; T72-F75 PolarHBondContact O-N 3.37Å; R73-F75 PolarHBondContact O-N 3.28Å
76	A	75.8	Confident	83.1	Confident	60 Å²	60	66.6 Å²	66.6	50%	0.496	33%	0.334	S	S	.	.	H	α-helix	trans	-86.3	-39.1	174.5	0	0	0	0	0	112.4	L9 T72 R73	L9-A76 HydrophobicContact CD2-CB 4.44Å; T72-A76 PolarHBondContact O-N 2.77Å; T72-A76 VanDerWaalsContact O-N 3.16Å; R73-A76 PolarHBondContact O-N 2.91Å; R73-A76 VanDerWaalsContact O-N 3.11Å
77	E	73.1	Confident	83	Confident	85 Å²	85	72.2 Å²	72.2	40%	0.397	36%	0.364	S	S	.	.	S	Bend	trans	-92.7	154.3	177.9	-65.9	177.9	-144.5	0	0	111.9	R73 S79	R73-E77 IonicContact NH1-OE1 3.79Å; R73-E77 PolarHBondContact NH1-OE1 2.75Å; R73-E77 PolarHBondContact O-N 3.3Å; E77-S79 PolarHBondContact O-N 3.46Å
78	E	75.7	Confident	82.8	Confident	94 Å²	94	74.9 Å²	74.9	44%	0.439	38%	0.375	S	S	.	.			trans	-74.8	124.4	176.7	-64	-167.5	119.2	0	0	111.6	I80 Y81 R97 P283	E78-I80 VanDerWaalsContact C-N 3.25Å; E78-I80 PolarHBondContact O-N 3.47Å; E78-I80 VanDerWaalsContact O-N 3.08Å; E78-Y81 HydrophobicContact CB-CE1 4.15Å; E78-Y81 WeakPolarHBondContact OE2-CE1 3.32Å; E78-R97 VanDerWaalsContact CD-NH1 3.35Å; E78-R97 IonicContact OE1-CZ 3.4Å; E78-R97 IonicContact OE1-NH1 2.71Å; E78-R97 PolarHBondContact OE1-NH1 3.43Å; E78-R97 IonicContact OE1-NH2 3.29Å; E78-R97 PolarHBondContact OE1-NH2 3.4Å; E78-R97 IonicContact OE2-CZ 3.57Å; E78-R97 IonicContact OE2-NH1 3.53Å; E78-R97 IonicContact OE2-NH2 2.72Å; E78-R97 PolarHBondContact OE2-NH2 3.28Å; E78-P283 WeakPolarHBondContact O-CG 3.29Å
79	S	76.3	Confident	82.9	Confident	43 Å²	43	75.5 Å²	75.5	30%	0.301	38%	0.379	S	S	.	.	S	Bend	trans	-63.6	-20.2	-168.8	62.7	0	0	0	0	116.5	E77	E77-S79 PolarHBondContact O-N 3.46Å
80	I	87.3	Confident	83.1	Confident	3 Å²	3	81.7 Å²	81.7	2%	0.015	40%	0.397	C	S	.	.			trans	-155.8	130.9	-178.5	-179.1	170	0	0	0	110.6	E78 R97 C100 W101 F258 C280	E78-I80 VanDerWaalsContact C-N 3.25Å; E78-I80 PolarHBondContact O-N 3.47Å; E78-I80 VanDerWaalsContact O-N 3.08Å; I80-R97 HydrophobicContact CG2-CG 3.94Å; I80-R97 VanDerWaalsContact O-CZ 3.24Å; I80-R97 PolarHBondContact O-NE 3.34Å; I80-R97 PolarHBondContact O-NH2 3.37Å; I80-C100 HydrophobicContact CD1-CB 4.21Å; I80-W101 HydrophobicContact CB-CE3 4.13Å; I80-W101 HydrophobicContact CD1-CE3 4.48Å; I80-W101 HydrophobicContact CG2-CB 4.18Å; I80-W101 HydrophobicContact CG2-CD2 4.36Å; I80-W101 HydrophobicContact CG2-CE3 4.05Å; I80-W101 HydrophobicContact CG2-CG 4.43Å; I80-F258 HydrophobicContact CD1-CE1 3.88Å; I80-F258 HydrophobicContact CD1-CZ 3.82Å; I80-C280 HydrophobicContact CD1-CB 4.04Å; I80-C280 HydrophobicContact CG1-CB 4.25Å
81	Y	88.2	Confident	83.4	Confident	94 Å²	94	86.8 Å²	86.8	37%	0.369	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	137.8	167.5	-64.4	-72	0	0	0	109.3	E78 C280 K281 P283	E78-Y81 HydrophobicContact CB-CE1 4.15Å; E78-Y81 WeakPolarHBondContact OE2-CE1 3.32Å; Y81-C280 CarbonylContact O-C 3.44Å; Y81-C280 WeakPolarHBondContact O-CA 3.38Å; Y81-K281 PolarHBondContact N-O 3.23Å; Y81-K281 PolarHBondContact O-N 2.98Å; Y81-P283 HydrophobicContact CD2-CG 4.07Å; Y81-P283 HydrophobicContact CE2-CB 4.15Å; Y81-P283 HydrophobicContact CE2-CG 3.78Å
82	C	90.5	Very high	83.6	Confident	25 Å²	25	89.3 Å²	89.3	17%	0.169	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	129.2	174.9	-70.7	0	0	0	0	110.1	T84 C280	C82-T84 PolarHBondContact O-N 3.04Å; C82-T84 VanDerWaalsContact O-N 3.14Å; C82-C280 HydrophobicContact CB-CB 4.16Å; C82-C280 WeakPolarHBondContact CB-SG 3.39Å; C82-C280 WeakPolarHBondContact SG-CB 3.36Å; C82-C280 CovalentContact SG-SG 2.05Å; C82-C280 PolarHBondContact SG-SG 3.35Å
83	Y	89.8	Confident	83.8	Confident	153 Å²	153	88.3 Å²	88.3	60%	0.6	43%	0.433	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.9	79.8	179.3	-60.3	-75.4	0	0	0	109.6	N279 K281	Y83-N279 HydrophobicContact CD2-CB 4.4Å; Y83-N279 WeakPolarHBondContact CD2-O 3.38Å; Y83-N279 PolarHBondContact N-O 3.26Å; Y83-K281 HydrophobicContact CE2-CB 4.47Å
84	T	87.6	Confident	84.2	Confident	43 Å²	43	88.9 Å²	88.9	26%	0.264	44%	0.441	S	S	.	.			trans	-75.5	146.6	175.2	52.1	0	0	0	0	111.3	C82 F88 A93 A96 V278	C82-T84 PolarHBondContact O-N 3.04Å; C82-T84 VanDerWaalsContact O-N 3.14Å; T84-F88 HydrophobicContact CG2-CD2 4.18Å; T84-A93 HydrophobicContact CG2-CB 4.29Å; T84-A96 HydrophobicContact CG2-CB 3.96Å; T84-V278 HydrophobicContact CG2-CG1 4.39Å
85	P	85.8	Confident	84.6	Confident	53 Å²	53	94 Å²	94	34%	0.344	46%	0.459	S	S	.	.			trans	-64.9	150.8	178.4	28.3	-35.3	0	0	0	111.8	N87 F88 L276	P85-N87 PolarHBondContact O-N 3.23Å; P85-F88 HydrophobicContact CG-CD1 3.83Å; P85-F88 HydrophobicContact CG-CE1 4.05Å; P85-F88 HydrophobicContact CG-CG 4.32Å; P85-F88 WeakPolarHBondContact O-CB 3.15Å; P85-F88 PolarHBondContact O-N 3.1Å; P85-F88 VanDerWaalsContact O-N 3.09Å; P85-L276 HydrophobicContact CG-CD2 4.26Å
86	H	83.4	Confident	85.2	Confident	188 Å²	188	86.1 Å²	86.1	87%	0.87	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-19	-177.5	-172	-74.9	0	0	0	114.1	F88	H86-F88 PolarHBondContact O-N 3.12Å
87	N	86.2	Confident	85.8	Confident	150 Å²	150	86 Å²	86	80%	0.802	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-1.2	178.9	-61.8	-2.7	0	0	0	113.5	P85	P85-N87 PolarHBondContact O-N 3.23Å
88	F	85.1	Confident	86.5	Confident	63 Å²	63	83.7 Å²	83.7	28%	0.276	41%	0.409	S	S	.	.			trans	-87.4	138.5	179.7	-88.6	28.4	0	0	0	112.6	T84 P85 H86 Q92 A96 L262 L276	T84-F88 HydrophobicContact CG2-CD2 4.18Å; P85-F88 HydrophobicContact CG-CD1 3.83Å; P85-F88 HydrophobicContact CG-CE1 4.05Å; P85-F88 HydrophobicContact CG-CG 4.32Å; P85-F88 WeakPolarHBondContact O-CB 3.15Å; P85-F88 PolarHBondContact O-N 3.1Å; P85-F88 VanDerWaalsContact O-N 3.09Å; H86-F88 PolarHBondContact O-N 3.12Å; F88-Q92 HydrophobicContact CB-CB 4.17Å; F88-Q92 HydrophobicContact CD2-CB 3.71Å; F88-Q92 HydrophobicContact CE2-CB 4.16Å; F88-Q92 HydrophobicContact CG-CB 4.01Å; F88-A96 HydrophobicContact CE2-CB 4.34Å; F88-L262 HydrophobicContact CE2-CD1 4.45Å; F88-L276 HydrophobicContact CE1-CD2 3.63Å; F88-L276 HydrophobicContact CE2-CD2 4.12Å; F88-L276 HydrophobicContact CZ-CD2 3.26Å
89	T	89.3	Confident	87.1	Confident	75 Å²	75	82.2 Å²	82.2	46%	0.46	40%	0.4	S	S	.	.			trans	-69.7	162.8	166.2	73.2	0	0	0	0	111	D91 Q92 A93	T89-D91 PolarHBondContact O-N 3.45Å; T89-Q92 PolarHBondContact O-N 2.92Å; T89-Q92 WeakPolarHBondContact OG1-CG 3.49Å; T89-Q92 PolarHBondContact OG1-N 3.39Å; T89-A93 PolarHBondContact O-N 2.93Å
90	R	88.2	Confident	87.7	Confident	207 Å²	207	80.1 Å²	80.1	78%	0.781	39%	0.386	S	S	*	.	H	α-helix	trans	-52.7	-41	176.2	-176.2	175.1	-178.8	141	1.6	112.2	A93 L94	R90-A93 PolarHBondContact O-N 2.89Å; R90-L94 HydrophobicContact CG-CD1 4.22Å; R90-L94 WeakPolarHBondContact O-CG 3.44Å; R90-L94 PolarHBondContact O-N 2.67Å
91	D	88.8	Confident	87.7	Confident	115 Å²	115	83.5 Å²	83.5	62%	0.615	40%	0.398	S	S	*	.	H	α-helix	trans	-77.1	-33.9	-176.4	-51.1	-42.2	0	0	0	111.9	T89 A93 L94 Y95	T89-D91 PolarHBondContact O-N 3.45Å; D91-A93 VanDerWaalsContact C-N 3.34Å; D91-L94 PolarHBondContact O-N 2.87Å; D91-Y95 WeakPolarHBondContact O-CB 3.33Å; D91-Y95 PolarHBondContact O-N 2.97Å
92	Q	87.4	Confident	87.5	Confident	90 Å²	90	82.7 Å²	82.7	42%	0.421	40%	0.404	S	S	.	.	H	α-helix	trans	-64.7	-38.4	170.1	-71.7	169.1	-19.7	0	0	111.7	F88 T89 Y95 A96	F88-Q92 HydrophobicContact CB-CB 4.17Å; F88-Q92 HydrophobicContact CD2-CB 3.71Å; F88-Q92 HydrophobicContact CE2-CB 4.16Å; F88-Q92 HydrophobicContact CG-CB 4.01Å; T89-Q92 PolarHBondContact O-N 2.92Å; T89-Q92 WeakPolarHBondContact OG1-CG 3.49Å; T89-Q92 PolarHBondContact OG1-N 3.39Å; Q92-Y95 PolarHBondContact O-N 2.76Å; Q92-A96 WeakPolarHBondContact O-CB 3.3Å; Q92-A96 PolarHBondContact O-N 2.79Å
93	A	87.2	Confident	87.1	Confident	27 Å²	27	85 Å²	85	22%	0.223	41%	0.412	C	S	.	.	H	α-helix	trans	-68.4	-40.3	175.1	0	0	0	0	0	112.4	T84 T89 R90 D91 A96 R97	T84-A93 HydrophobicContact CG2-CB 4.29Å; T89-A93 PolarHBondContact O-N 2.93Å; R90-A93 PolarHBondContact O-N 2.89Å; D91-A93 VanDerWaalsContact C-N 3.34Å; A93-A96 PolarHBondContact O-N 3.2Å; A93-R97 WeakPolarHBondContact O-CB 3.49Å; A93-R97 PolarHBondContact O-N 3.34Å
94	L	88.5	Confident	86.7	Confident	90 Å²	90	77.8 Å²	77.8	47%	0.471	38%	0.384	S	S	.	.	H	α-helix	trans	-65.2	-40.7	173	-72.7	170.2	0	0	0	112.2	R90 D91 R97 G98	R90-L94 HydrophobicContact CG-CD1 4.22Å; R90-L94 WeakPolarHBondContact O-CG 3.44Å; R90-L94 PolarHBondContact O-N 2.67Å; D91-L94 PolarHBondContact O-N 2.87Å; L94-R97 PolarHBondContact O-N 3.15Å; L94-G98 PolarHBondContact O-N 3.32Å
95	Y	88.1	Confident	86.5	Confident	150 Å²	150	80.2 Å²	80.2	59%	0.588	39%	0.388	S	S	*	.	H	α-helix	trans	-60.6	-50.3	173.3	173	-96.4	0	0	0	111.4	D91 Q92 R97 G98 Y99	D91-Y95 WeakPolarHBondContact O-CB 3.33Å; D91-Y95 PolarHBondContact O-N 2.97Å; Q92-Y95 PolarHBondContact O-N 2.76Å; Y95-R97 VanDerWaalsContact C-N 3.33Å; Y95-R97 PolarHBondContact O-N 3.29Å; Y95-G98 PolarHBondContact O-N 3.32Å; Y95-G98 VanDerWaalsContact O-N 3.16Å; Y95-Y99 WeakPolarHBondContact O-CB 3.14Å; Y95-Y99 PolarHBondContact O-N 3.13Å
96	A	87.1	Confident	86.1	Confident	0 Å²	0	78 Å²	78	0%	0	37%	0.373	C	S	.	.	H	α-helix	trans	-58.3	-45.1	178.3	0	0	0	0	0	111.6	T84 F88 Q92 A93 G98 Y99 C100 L262	T84-A96 HydrophobicContact CG2-CB 3.96Å; F88-A96 HydrophobicContact CE2-CB 4.34Å; Q92-A96 WeakPolarHBondContact O-CB 3.3Å; Q92-A96 PolarHBondContact O-N 2.79Å; A93-A96 PolarHBondContact O-N 3.2Å; A96-G98 PolarHBondContact O-N 3.35Å; A96-Y99 PolarHBondContact O-N 2.86Å; A96-C100 WeakPolarHBondContact O-CB 3.22Å; A96-C100 PolarHBondContact O-N 2.75Å; A96-C100 PolarHBondContact O-SG 3Å; A96-L262 HydrophobicContact CB-CD1 4.13Å; A96-L262 HydrophobicContact CB-CD2 3.83Å
97	R	88.6	Confident	85.9	Confident	58 Å²	58	69.1 Å²	69.1	22%	0.219	33%	0.332	C	S	.	.	H	α-helix	trans	-57.7	-47	174.6	-170.5	-171	-155.9	162.9	19.8	112.3	E78 I80 A93 L94 Y95 W101	E78-R97 VanDerWaalsContact CD-NH1 3.35Å; E78-R97 IonicContact OE1-CZ 3.4Å; E78-R97 IonicContact OE1-NH1 2.71Å; E78-R97 PolarHBondContact OE1-NH1 3.43Å; E78-R97 IonicContact OE1-NH2 3.29Å; E78-R97 PolarHBondContact OE1-NH2 3.4Å; E78-R97 IonicContact OE2-CZ 3.57Å; E78-R97 IonicContact OE2-NH1 3.53Å; E78-R97 IonicContact OE2-NH2 2.72Å; E78-R97 PolarHBondContact OE2-NH2 3.28Å; I80-R97 HydrophobicContact CG2-CG 3.94Å; I80-R97 VanDerWaalsContact O-CZ 3.24Å; I80-R97 PolarHBondContact O-NE 3.34Å; I80-R97 PolarHBondContact O-NH2 3.37Å; A93-R97 WeakPolarHBondContact O-CB 3.49Å; A93-R97 PolarHBondContact O-N 3.34Å; L94-R97 PolarHBondContact O-N 3.15Å; Y95-R97 VanDerWaalsContact C-N 3.33Å; Y95-R97 PolarHBondContact O-N 3.29Å; R97-W101 WeakPolarHBondContact O-CB 3.48Å; R97-W101 PolarHBondContact O-N 3.19Å; R97-W101 VanDerWaalsContact O-N 3.08Å
98	G	88.6	Confident	85.5	Confident	36 Å²	36	64.8 Å²	64.8	37%	0.371	31%	0.308	S	S	.	.	H	α-helix	trans	-62.9	-48.3	178.4	0	0	0	0	0	112.4	L94 Y95 A96 C100 W101 T102	L94-G98 PolarHBondContact O-N 3.32Å; Y95-G98 PolarHBondContact O-N 3.32Å; Y95-G98 VanDerWaalsContact O-N 3.16Å; A96-G98 PolarHBondContact O-N 3.35Å; G98-C100 PolarHBondContact O-N 3.41Å; G98-W101 WeakPolarHBondContact O-CB 3.32Å; G98-W101 PolarHBondContact O-N 3.29Å; G98-W101 VanDerWaalsContact O-N 3.13Å; G98-T102 PolarHBondContact O-N 3.44Å; G98-T102 PolarHBondContact O-OG1 3.15Å
99	Y	87.8	Confident	84.5	Confident	63 Å²	63	66 Å²	66	25%	0.247	32%	0.322	C	S	.	.	H	α-helix	trans	-59.3	-47.3	178.8	-175	-91.1	0	0	0	112	Y95 A96 W101 T102 E103 L262 G263	Y95-Y99 WeakPolarHBondContact O-CB 3.14Å; Y95-Y99 PolarHBondContact O-N 3.13Å; A96-Y99 PolarHBondContact O-N 2.86Å; Y99-W101 VanDerWaalsContact C-N 3.27Å; Y99-W101 PolarHBondContact O-N 3.46Å; Y99-T102 WeakPolarHBondContact CA-OG1 3.44Å; Y99-T102 PolarHBondContact O-N 2.89Å; Y99-T102 VanDerWaalsContact O-N 3.09Å; Y99-T102 PolarHBondContact O-OG1 3.37Å; Y99-E103 HydrophobicContact CE1-CG 4.2Å; Y99-E103 PolarHBondContact O-N 2.81Å; Y99-L262 HydrophobicContact CD1-CD2 3.87Å; Y99-L262 HydrophobicContact CG-CD2 4.34Å; Y99-G263 WeakPolarHBondContact OH-CA 3.4Å
100	C	88.1	Confident	83.2	Confident	0 Å²	0	70.9 Å²	70.9	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-66.1	-28.6	177.3	-60.8	0	0	0	0	112.6	I80 A96 G98 L104 F258 C260	I80-C100 HydrophobicContact CD1-CB 4.21Å; A96-C100 WeakPolarHBondContact O-CB 3.22Å; A96-C100 PolarHBondContact O-N 2.75Å; A96-C100 PolarHBondContact O-SG 3Å; G98-C100 PolarHBondContact O-N 3.41Å; C100-L104 WeakPolarHBondContact O-CA 3.34Å; C100-L104 WeakPolarHBondContact O-CD1 3.39Å; C100-L104 PolarHBondContact O-N 2.94Å; C100-L104 VanDerWaalsContact O-N 3.09Å; C100-F258 HydrophobicContact CB-CZ 4.38Å; C100-C260 WeakPolarHBondContact CA-SG 3.22Å; C100-C260 HydrophobicContact CB-CB 3.75Å; C100-C260 WeakPolarHBondContact CB-SG 3.16Å; C100-C260 WeakPolarHBondContact SG-CB 3.44Å; C100-C260 CovalentContact SG-SG 2.03Å; C100-C260 PolarHBondContact SG-SG 2.81Å
101	W	87.1	Confident	82.6	Confident	73 Å²	73	63.3 Å²	63.3	28%	0.277	32%	0.323	S	S	.	.	H	α-helix	trans	-75.5	-23.7	171.9	-173.9	-120.6	0	0	0	114	I80 R97 G98 Y99 L104 K123 L282	I80-W101 HydrophobicContact CB-CE3 4.13Å; I80-W101 HydrophobicContact CD1-CE3 4.48Å; I80-W101 HydrophobicContact CG2-CB 4.18Å; I80-W101 HydrophobicContact CG2-CD2 4.36Å; I80-W101 HydrophobicContact CG2-CE3 4.05Å; I80-W101 HydrophobicContact CG2-CG 4.43Å; R97-W101 WeakPolarHBondContact O-CB 3.48Å; R97-W101 PolarHBondContact O-N 3.19Å; R97-W101 VanDerWaalsContact O-N 3.08Å; G98-W101 WeakPolarHBondContact O-CB 3.32Å; G98-W101 PolarHBondContact O-N 3.29Å; G98-W101 VanDerWaalsContact O-N 3.13Å; Y99-W101 VanDerWaalsContact C-N 3.27Å; Y99-W101 PolarHBondContact O-N 3.46Å; W101-L104 HydrophobicContact CE3-CD1 3.87Å; W101-L104 HydrophobicContact CZ3-CD1 4.29Å; W101-K123 HydrophobicContact CH2-CD 4.44Å; W101-K123 HydrophobicContact CH2-CG 4.29Å; W101-K123 HydrophobicContact CZ2-CD 4.04Å; W101-K123 HydrophobicContact CZ2-CG 4.05Å; W101-K123 PolarHBondContact O-NZ 3.14Å; W101-L282 HydrophobicContact CZ3-CD2 4.07Å
102	T	85.2	Confident	81.8	Confident	78 Å²	78	64 Å²	64	48%	0.479	32%	0.322	S	S	.	.	H	α-helix	trans	-85.8	-42.9	175.9	45.4	0	0	0	0	113.2	G98 Y99 F120	G98-T102 PolarHBondContact O-N 3.44Å; G98-T102 PolarHBondContact O-OG1 3.15Å; Y99-T102 WeakPolarHBondContact CA-OG1 3.44Å; Y99-T102 PolarHBondContact O-N 2.89Å; Y99-T102 VanDerWaalsContact O-N 3.09Å; Y99-T102 PolarHBondContact O-OG1 3.37Å; T102-F120 WeakPolarHBondContact O-CE1 3.34Å; T102-F120 WeakPolarHBondContact O-CZ 3.46Å
103	E	82.3	Confident	81	Confident	73 Å²	73	63.6 Å²	63.6	34%	0.341	33%	0.327	S	S	.	.	H	α-helix	trans	-83	-40.3	179.8	-85.6	-59.7	133.4	0	0	113.6	Y99 R105 F120	Y99-E103 HydrophobicContact CE1-CG 4.2Å; Y99-E103 PolarHBondContact O-N 2.81Å; E103-R105 VanDerWaalsContact C-N 3.25Å; E103-R105 PolarHBondContact O-N 2.8Å; E103-R105 IonicContact OE2-CZ 3.37Å; E103-R105 IonicContact OE2-NE 3.46Å; E103-R105 PolarHBondContact OE2-NE 3.49Å; E103-R105 IonicContact OE2-NH2 2.62Å; E103-F120 WeakPolarHBondContact O-CE2 3.44Å; E103-F120 VanDerWaalsContact O-CZ 3.29Å; E103-F120 WeakPolarHBondContact O-CZ 3.25Å
104	L	81.5	Confident	80	Confident	1 Å²	1	68.6 Å²	68.6	1%	0.005	35%	0.346	C	S	.	.			trans	46.4	41.8	172.6	-140.1	71	0	0	0	115.1	C100 W101 L119 K123 F258 L282	C100-L104 WeakPolarHBondContact O-CA 3.34Å; C100-L104 WeakPolarHBondContact O-CD1 3.39Å; C100-L104 PolarHBondContact O-N 2.94Å; C100-L104 VanDerWaalsContact O-N 3.09Å; W101-L104 HydrophobicContact CE3-CD1 3.87Å; W101-L104 HydrophobicContact CZ3-CD1 4.29Å; L104-L119 HydrophobicContact CD2-CB 4.35Å; L104-L119 HydrophobicContact CG-CB 3.99Å; L104-L119 WeakPolarHBondContact O-CA 3.3Å; L104-L119 WeakPolarHBondContact O-CB 3.3Å; L104-L119 PolarHBondContact O-N 3.39Å; L104-K123 HydrophobicContact CD2-CB 4.26Å; L104-F258 HydrophobicContact CD1-CZ 4.07Å; L104-L282 HydrophobicContact CD1-CD2 4.47Å
105	R	81.9	Confident	79.3	Confident	95 Å²	95	70.1 Å²	70.1	36%	0.358	35%	0.354	S	S	.	.	B	Isolated β-bridge	trans	-106.8	142.6	172.9	-64.2	169.8	-168.1	-95.7	0.1	110.4	E103 W116 F258	E103-R105 VanDerWaalsContact C-N 3.25Å; E103-R105 PolarHBondContact O-N 2.8Å; E103-R105 IonicContact OE2-CZ 3.37Å; E103-R105 IonicContact OE2-NE 3.46Å; E103-R105 PolarHBondContact OE2-NE 3.49Å; E103-R105 IonicContact OE2-NH2 2.62Å; R105-W116 HydrophobicContact CB-CB 4.27Å; R105-W116 HydrophobicContact CB-CE3 4.32Å; R105-F258 WeakPolarHBondContact O-CD2 3.23Å
106	D	78.9	Confident	78.9	Confident	7 Å²	7	65 Å²	65	4%	0.037	33%	0.333	C	S	.	.			trans	-87.5	112.9	169.4	-173.7	33.5	0	0	0	111.1	I108 W116 P117 L119 F258 T259	D106-I108 HydrophobicContact CB-CG1 4.41Å; D106-I108 PolarHBondContact O-N 3.3Å; D106-I108 WeakPolarHBondContact OD2-CG1 3.08Å; D106-W116 WeakPolarHBondContact O-CB 3.3Å; D106-P117 HydrophobicContact CB-CG 4.22Å; D106-P117 PolarHBondContact N-O 2.87Å; D106-L119 HydrophobicContact CB-CD1 3.84Å; D106-F258 HydrophobicContact CB-CB 4.02Å; D106-F258 WeakPolarHBondContact OD1-CA 3.23Å; D106-T259 PolarHBondContact OD1-N 2.91Å
107	A	78.9	Confident	78.4	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	35%	0.352	C	S	.	.			trans	-80.4	65.8	-179.8	0	0	0	0	0	111.3	W116 T259 A261 R277	A107-W116 HydrophobicContact CB-CD2 4Å; A107-W116 HydrophobicContact CB-CE3 3.98Å; A107-W116 HydrophobicContact CB-CH2 3.7Å; A107-W116 HydrophobicContact CB-CZ2 3.69Å; A107-W116 HydrophobicContact CB-CZ3 3.84Å; A107-T259 WeakPolarHBondContact CB-O 3.39Å; A107-T259 PolarHBondContact N-O 3.24Å; A107-A261 HydrophobicContact CB-CB 3.8Å; A107-R277 PolarHBondContact O-NH1 3.3Å
108	I	76.4	Confident	77.8	Confident	59 Å²	59	68.1 Å²	68.1	30%	0.303	36%	0.363	S	S	.	.			trans	-53.9	131.4	179.1	-58	173.9	0	0	0	109.9	D106 V111 P117	D106-I108 HydrophobicContact CB-CG1 4.41Å; D106-I108 PolarHBondContact O-N 3.3Å; D106-I108 WeakPolarHBondContact OD2-CG1 3.08Å; I108-V111 HydrophobicContact CB-CB 4.13Å; I108-V111 HydrophobicContact CB-CG2 3.8Å; I108-V111 HydrophobicContact CG2-CB 4.45Å; I108-V111 HydrophobicContact CG2-CG2 3.63Å; I108-V111 PolarHBondContact O-N 2.97Å; I108-P117 HydrophobicContact CD1-CG 3.88Å
109	P	65.3	Low	77.4	Confident	88 Å²	88	66.9 Å²	66.9	57%	0.571	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	144.3	175.7	25.5	-34.3	0	0	0	111.2	V111	P109-V111 PolarHBondContact O-N 3.41Å; P109-V111 VanDerWaalsContact O-N 3.15Å
110	N	61.5	Low	77	Confident	178 Å²	178	67.9 Å²	67.9	95%	0.952	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.9	1.2	-176.4	-49.5	-33.4	0	0	0	116.3
111	V	75.6	Confident	76.6	Confident	49 Å²	49	69.6 Å²	69.6	30%	0.297	36%	0.361	S	S	.	.	S	Bend	trans	-96.6	135.9	171.3	-176	0	0	0	0	109.9	I108 P109 L115 W116	I108-V111 HydrophobicContact CB-CB 4.13Å; I108-V111 HydrophobicContact CB-CG2 3.8Å; I108-V111 HydrophobicContact CG2-CB 4.45Å; I108-V111 HydrophobicContact CG2-CG2 3.63Å; I108-V111 PolarHBondContact O-N 2.97Å; P109-V111 PolarHBondContact O-N 3.41Å; P109-V111 VanDerWaalsContact O-N 3.15Å; V111-L115 HydrophobicContact CG1-CB 3.95Å; V111-W116 PolarHBondContact O-NE1 2.84Å
112	Q	71.9	Confident	76.2	Confident	130 Å²	130	66.3 Å²	66.3	61%	0.607	35%	0.349	S	S	*	.			trans	-69.1	148	178.4	-65.1	-165.4	26.5	0	0	112	H114 L115	Q112-H114 PolarHBondContact O-N 3.07Å; Q112-H114 VanDerWaalsContact O-N 3.09Å; Q112-H114 PolarHBondContact OE1-CE1 2.73Å; Q112-H114 PolarHBondContact OE1-ND1 2.78Å; Q112-L115 PolarHBondContact O-N 3.08Å
113	P	70.2	Confident	76.1	Confident	81 Å²	81	65.9 Å²	65.9	53%	0.526	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-55.7	-31.4	-175.7	-27.7	35.2	0	0	0	115.7	L115 W116	P113-L115 PolarHBondContact O-N 3.47Å; P113-W116 HydrophobicContact CB-CD2 4.39Å; P113-W116 HydrophobicContact CB-CE3 4.36Å; P113-W116 HydrophobicContact CB-CH2 4.06Å; P113-W116 HydrophobicContact CB-CZ2 4.09Å; P113-W116 HydrophobicContact CB-CZ3 4.2Å; P113-W116 HydrophobicContact CG-CH2 4.04Å; P113-W116 HydrophobicContact CG-CZ2 3.87Å
114	H	66.9	Low	76.3	Confident	132 Å²	132	68.4 Å²	68.4	61%	0.611	35%	0.351	S	S	*	.	G	3₁₀ helix	trans	-70.1	-15.7	178.5	73.8	-106.1	0	0	0	113.8	Q112	Q112-H114 PolarHBondContact O-N 3.07Å; Q112-H114 VanDerWaalsContact O-N 3.09Å; Q112-H114 PolarHBondContact OE1-CE1 2.73Å; Q112-H114 PolarHBondContact OE1-ND1 2.78Å
115	L	73.8	Confident	76.5	Confident	121 Å²	121	68.6 Å²	68.6	63%	0.634	35%	0.352	S	S	*	.	G	3₁₀ helix	trans	-114.8	6.7	-173.5	-142.7	77.3	0	0	0	113.1	V111 Q112 P113	V111-L115 HydrophobicContact CG1-CB 3.95Å; Q112-L115 PolarHBondContact O-N 3.08Å; P113-L115 PolarHBondContact O-N 3.47Å
116	W	78.3	Confident	76.8	Confident	42 Å²	42	64.4 Å²	64.4	16%	0.159	34%	0.337	C	S	.	.			trans	-66.6	132.1	175.6	-68.3	-15.5	0	0	0	111.5	R105 D106 A107 V111 P113 A261	R105-W116 HydrophobicContact CB-CB 4.27Å; R105-W116 HydrophobicContact CB-CE3 4.32Å; D106-W116 WeakPolarHBondContact O-CB 3.3Å; A107-W116 HydrophobicContact CB-CD2 4Å; A107-W116 HydrophobicContact CB-CE3 3.98Å; A107-W116 HydrophobicContact CB-CH2 3.7Å; A107-W116 HydrophobicContact CB-CZ2 3.69Å; A107-W116 HydrophobicContact CB-CZ3 3.84Å; V111-W116 PolarHBondContact O-NE1 2.84Å; P113-W116 HydrophobicContact CB-CD2 4.39Å; P113-W116 HydrophobicContact CB-CE3 4.36Å; P113-W116 HydrophobicContact CB-CH2 4.06Å; P113-W116 HydrophobicContact CB-CZ2 4.09Å; P113-W116 HydrophobicContact CB-CZ3 4.2Å; P113-W116 HydrophobicContact CG-CH2 4.04Å; P113-W116 HydrophobicContact CG-CZ2 3.87Å; W116-A261 HydrophobicContact CH2-CB 3.79Å; W116-A261 HydrophobicContact CZ3-CB 4.03Å
117	P	76.8	Confident	77.3	Confident	60 Å²	60	70 Å²	70	39%	0.39	36%	0.358	S	S	.	.			trans	-67.9	142	-179.5	28.5	-34.2	0	0	0	111.6	D106 I108	D106-P117 HydrophobicContact CB-CG 4.22Å; D106-P117 PolarHBondContact N-O 2.87Å; I108-P117 HydrophobicContact CD1-CG 3.88Å
118	S	77.3	Confident	77.9	Confident	65 Å²	65	70.2 Å²	70.2	46%	0.455	36%	0.36	S	S	.	.	B	Isolated β-bridge	trans	-90.5	115.7	-177.7	51.9	0	0	0	0	112.1	F120	S118-F120 PolarHBondContact O-N 3.49Å
119	L	79.3	Confident	78.5	Confident	9 Å²	9	68.1 Å²	68.1	5%	0.047	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	4.9	173.9	-76.7	77.4	0	0	0	112.9	L104 D106 E121 H122 F258 L282	L104-L119 HydrophobicContact CD2-CB 4.35Å; L104-L119 HydrophobicContact CG-CB 3.99Å; L104-L119 WeakPolarHBondContact O-CA 3.3Å; L104-L119 WeakPolarHBondContact O-CB 3.3Å; L104-L119 PolarHBondContact O-N 3.39Å; D106-L119 HydrophobicContact CB-CD1 3.84Å; L119-E121 PolarHBondContact O-N 2.76Å; L119-H122 WeakPolarHBondContact O-CB 3.5Å; L119-H122 PolarHBondContact O-CD2 3.37Å; L119-H122 PolarHBondContact O-N 2.96Å; L119-F258 HydrophobicContact CD2-CB 4.01Å; L119-F258 HydrophobicContact CD2-CD1 4.25Å; L119-F258 HydrophobicContact CD2-CG 4.12Å; L119-L282 HydrophobicContact CD2-CD1 4.28Å
120	F	80	Confident	79.7	Confident	84 Å²	84	68.1 Å²	68.1	37%	0.368	34%	0.344	S	S	.	.	H	α-helix	trans	-50.2	-25.3	175.3	-80.6	-76.7	0	0	0	114.5	T102 E103 S118 H122 K123 F124	T102-F120 WeakPolarHBondContact O-CE1 3.34Å; T102-F120 WeakPolarHBondContact O-CZ 3.46Å; E103-F120 WeakPolarHBondContact O-CE2 3.44Å; E103-F120 VanDerWaalsContact O-CZ 3.29Å; E103-F120 WeakPolarHBondContact O-CZ 3.25Å; S118-F120 PolarHBondContact O-N 3.49Å; F120-H122 PolarHBondContact O-N 2.87Å; F120-K123 PolarHBondContact O-N 3.42Å; F120-F124 PolarHBondContact O-N 2.89Å; F120-F124 VanDerWaalsContact O-N 3.11Å
121	E	79.8	Confident	81.1	Confident	36 Å²	36	62.2 Å²	62.2	17%	0.168	32%	0.32	C	S	.	.	H	α-helix	trans	-52.9	-37.4	173.5	-63.9	-174	-163.6	0	0	112.1	L119 K123 F124 L125 Y249 R252	L119-E121 PolarHBondContact O-N 2.76Å; E121-K123 PolarHBondContact O-N 2.83Å; E121-F124 PolarHBondContact O-N 3.42Å; E121-L125 WeakPolarHBondContact O-CB 3.25Å; E121-L125 PolarHBondContact O-N 3.1Å; E121-Y249 HydrophobicContact CB-CD2 4.19Å; E121-Y249 HydrophobicContact CB-CE2 4.46Å; E121-R252 IonicContact OE1-CZ 3.78Å; E121-R252 IonicContact OE1-NH1 2.86Å; E121-R252 PolarHBondContact OE1-NH1 3.41Å
122	H	78.6	Confident	81.9	Confident	5 Å²	5	61.8 Å²	61.8	2%	0.023	31%	0.314	C	S	.	.	H	α-helix	trans	-62.8	-38.7	175.9	-72.9	-65.6	0	0	0	114.3	L119 F120 F124 Y249 Q253 L282 Q288	L119-H122 WeakPolarHBondContact O-CB 3.5Å; L119-H122 PolarHBondContact O-CD2 3.37Å; L119-H122 PolarHBondContact O-N 2.96Å; F120-H122 PolarHBondContact O-N 2.87Å; H122-F124 VanDerWaalsContact C-N 3.34Å; H122-Y249 AromaticContact CE1-CE2 3.62Å; H122-Y249 AromaticContact CE1-CZ 3.69Å; H122-Y249 PolarHBondContact CE1-OH 2.99Å; H122-Y249 AromaticContact ND1-CE2 3.89Å; H122-Y249 AromaticContact ND1-CZ 3.95Å; H122-Y249 PolarHBondContact ND1-OH 3.43Å; H122-Y249 VanDerWaalsContact ND1-OH 3.11Å; H122-Q253 VanDerWaalsContact NE2-CG 3.25Å; H122-Q253 WeakPolarHBondContact NE2-CG 3.29Å; H122-Q253 PolarHBondContact NE2-NE2 3.16Å; H122-L282 HydrophobicContact CB-CD2 4.11Å; H122-Q288 PolarHBondContact ND1-OE1 2.99Å; H122-Q288 PolarHBondContact O-NE2 3.23Å
123	K	82.9	Confident	82.8	Confident	68 Å²	68	55.8 Å²	55.8	30%	0.296	29%	0.287	S	S	.	.	H	α-helix	trans	-76.6	-28.1	-177.5	-163.2	168.3	-175.9	173.6	0	110.9	W101 L104 F120 E121 Y127	W101-K123 HydrophobicContact CH2-CD 4.44Å; W101-K123 HydrophobicContact CH2-CG 4.29Å; W101-K123 HydrophobicContact CZ2-CD 4.04Å; W101-K123 HydrophobicContact CZ2-CG 4.05Å; W101-K123 PolarHBondContact O-NZ 3.14Å; L104-K123 HydrophobicContact CD2-CB 4.26Å; F120-K123 PolarHBondContact O-N 3.42Å; E121-K123 PolarHBondContact O-N 2.83Å; K123-Y127 WeakPolarHBondContact O-CD2 3.41Å; K123-Y127 WeakPolarHBondContact O-CE2 3.42Å
124	F	86.1	Confident	83.8	Confident	127 Å²	127	54 Å²	54	56%	0.557	28%	0.284	S	S	*	.	H	α-helix	trans	-95.3	-28.3	-178.6	-164.9	-110.7	0	0	0	114.5	F120 E121 H122 Y127 A128	F120-F124 PolarHBondContact O-N 2.89Å; F120-F124 VanDerWaalsContact O-N 3.11Å; E121-F124 PolarHBondContact O-N 3.42Å; H122-F124 VanDerWaalsContact C-N 3.34Å; F124-Y127 WeakPolarHBondContact O-CA 3.19Å; F124-Y127 WeakPolarHBondContact O-CB 3.27Å; F124-Y127 PolarHBondContact O-N 2.87Å; F124-A128 HydrophobicContact CD1-CB 3.82Å; F124-A128 HydrophobicContact CE1-CB 3.77Å; F124-A128 PolarHBondContact O-N 3.16Å
125	L	86.6	Confident	84.9	Confident	5 Å²	5	51.1 Å²	51.1	3%	0.026	27%	0.272	C	S	.	.	H	α-helix	trans	-45.7	-50.3	-174.3	166.7	70.3	0	0	0	114.6	E121 Y127 A128 L129 Y245 L246 Y249 Q288	E121-L125 WeakPolarHBondContact O-CB 3.25Å; E121-L125 PolarHBondContact O-N 3.1Å; L125-Y127 VanDerWaalsContact C-N 3.3Å; L125-Y127 PolarHBondContact O-N 2.83Å; L125-A128 PolarHBondContact O-N 2.96Å; L125-L129 HydrophobicContact CD1-CD1 3.64Å; L125-L129 HydrophobicContact CD1-CD2 4.43Å; L125-L129 HydrophobicContact CD1-CG 3.85Å; L125-L129 HydrophobicContact CG-CD1 4.1Å; L125-L129 WeakPolarHBondContact O-CG 3.04Å; L125-L129 PolarHBondContact O-N 2.78Å; L125-Y245 HydrophobicContact CD1-CE1 3.7Å; L125-L246 HydrophobicContact CD1-CD2 4.23Å; L125-Y249 HydrophobicContact CD2-CD1 4.33Å; L125-Y249 HydrophobicContact CD2-CE1 3.68Å; L125-Y249 HydrophobicContact CD2-CE2 4.04Å; L125-Q288 HydrophobicContact CD2-CB 3.85Å; L125-Q288 HydrophobicContact CD2-CG 4.04Å
126	P	87.9	Confident	85.8	Confident	7 Å²	7	45.7 Å²	45.7	5%	0.045	24%	0.244	C	C	.	.	H	α-helix	trans	-63.8	-33.9	-180	-23.9	36.8	0	0	0	113.3	V67 V70 F71 L130	V67-P126 HydrophobicContact CG1-CB 4.36Å; V67-P126 WeakPolarHBondContact CG1-O 3.26Å; V70-P126 HydrophobicContact CG1-CG 4.19Å; F71-P126 HydrophobicContact CD2-CB 4.04Å; F71-P126 HydrophobicContact CE1-CB 4.06Å; F71-P126 HydrophobicContact CE2-CB 3.42Å; F71-P126 VanDerWaalsContact CE2-CB 3.42Å; F71-P126 HydrophobicContact CZ-CB 3.44Å; F71-P126 VanDerWaalsContact CZ-CB 3.44Å; P126-L130 WeakPolarHBondContact O-CB 3.23Å; P126-L130 PolarHBondContact O-N 2.9Å; P126-L130 VanDerWaalsContact O-N 3.15Å
127	Y	89.6	Confident	86.4	Confident	124 Å²	124	48.4 Å²	48.4	49%	0.486	25%	0.254	S	S	.	.	H	α-helix	trans	-74	-37.8	175.7	-55.7	-83.4	0	0	0	111.7	F71 K123 F124 L125 L130 A131	F71-Y127 AromaticContact CE1-CE1 3.99Å; F71-Y127 HydrophobicContact CE1-CE1 3.99Å; F71-Y127 HydrophobicContact CE1-CE2 4.21Å; F71-Y127 AromaticContact CE1-CZ 3.76Å; F71-Y127 AromaticContact CZ-CD1 3.93Å; F71-Y127 HydrophobicContact CZ-CD1 3.93Å; F71-Y127 HydrophobicContact CZ-CD2 4.37Å; F71-Y127 AromaticContact CZ-CE1 3.71Å; F71-Y127 HydrophobicContact CZ-CE1 3.71Å; F71-Y127 HydrophobicContact CZ-CE2 4.18Å; F71-Y127 HydrophobicContact CZ-CG 4.26Å; F71-Y127 AromaticContact CZ-CZ 3.85Å; K123-Y127 WeakPolarHBondContact O-CD2 3.41Å; K123-Y127 WeakPolarHBondContact O-CE2 3.42Å; F124-Y127 WeakPolarHBondContact O-CA 3.19Å; F124-Y127 WeakPolarHBondContact O-CB 3.27Å; F124-Y127 PolarHBondContact O-N 2.87Å; L125-Y127 VanDerWaalsContact C-N 3.3Å; L125-Y127 PolarHBondContact O-N 2.83Å; Y127-L130 PolarHBondContact O-N 3.48Å; Y127-A131 WeakPolarHBondContact O-CB 3.16Å; Y127-A131 PolarHBondContact O-N 3.39Å
128	A	90.6	Very high	87.1	Confident	4 Å²	4	50.4 Å²	50.4	3%	0.033	26%	0.261	C	S	.	.	H	α-helix	trans	-61.6	-47.5	174.3	0	0	0	0	0	111.4	F124 L125 L130 A131 F132 Y245	F124-A128 HydrophobicContact CD1-CB 3.82Å; F124-A128 HydrophobicContact CE1-CB 3.77Å; F124-A128 PolarHBondContact O-N 3.16Å; L125-A128 PolarHBondContact O-N 2.96Å; A128-L130 PolarHBondContact O-N 3.48Å; A128-A131 PolarHBondContact O-N 3.37Å; A128-F132 HydrophobicContact CB-CD2 4.5Å; A128-F132 HydrophobicContact CB-CE2 4Å; A128-F132 WeakPolarHBondContact O-CD2 3.47Å; A128-F132 VanDerWaalsContact O-CG 3.28Å; A128-F132 WeakPolarHBondContact O-CG 3.47Å; A128-F132 PolarHBondContact O-N 3.23Å; A128-Y245 HydrophobicContact CB-CE1 3.9Å
129	L	89.8	Confident	87.7	Confident	15 Å²	15	48 Å²	48	8%	0.079	24%	0.244	C	C	.	.	H	α-helix	trans	-64.5	-39.6	178.2	-67.1	173.4	0	0	0	112.5	V67 L125 A131 F132 A133 L246	V67-L129 HydrophobicContact CG2-CB 3.39Å; V67-L129 HydrophobicContact CG2-CD1 3.86Å; V67-L129 HydrophobicContact CG2-CG 4.28Å; L125-L129 HydrophobicContact CD1-CD1 3.64Å; L125-L129 HydrophobicContact CD1-CD2 4.43Å; L125-L129 HydrophobicContact CD1-CG 3.85Å; L125-L129 HydrophobicContact CG-CD1 4.1Å; L125-L129 WeakPolarHBondContact O-CG 3.04Å; L125-L129 PolarHBondContact O-N 2.78Å; L129-A131 VanDerWaalsContact C-N 3.34Å; L129-A131 PolarHBondContact O-N 2.96Å; L129-F132 HydrophobicContact CD2-CD2 4.3Å; L129-F132 PolarHBondContact O-N 2.84Å; L129-A133 WeakPolarHBondContact O-CB 3.48Å; L129-A133 PolarHBondContact O-N 2.87Å; L129-L246 HydrophobicContact CD1-CD2 4.48Å; L129-L246 HydrophobicContact CD2-CD1 4.27Å; L129-L246 HydrophobicContact CD2-CD2 3.88Å; L129-L246 HydrophobicContact CD2-CG 4.17Å
130	L	89.9	Confident	88	Confident	88 Å²	88	48.2 Å²	48.2	46%	0.461	25%	0.246	S	C	.	.	H	α-helix	trans	-61.7	-41.6	173	-176	62.1	0	0	0	111.9	V67 P126 Y127 A128 A133 G134	V67-L130 HydrophobicContact CG1-CB 4.47Å; P126-L130 WeakPolarHBondContact O-CB 3.23Å; P126-L130 PolarHBondContact O-N 2.9Å; P126-L130 VanDerWaalsContact O-N 3.15Å; Y127-L130 PolarHBondContact O-N 3.48Å; A128-L130 PolarHBondContact O-N 3.48Å; L130-A133 PolarHBondContact O-N 3.03Å; L130-G134 PolarHBondContact O-N 3.02Å; L130-G134 VanDerWaalsContact O-N 3.08Å
131	A	92.1	Very high	88.3	Confident	55 Å²	55	47 Å²	47	46%	0.455	24%	0.244	S	C	.	.	H	α-helix	trans	-65.8	-41.7	175.1	0	0	0	0	0	112.2	Y127 A128 L129 G134 I135	Y127-A131 WeakPolarHBondContact O-CB 3.16Å; Y127-A131 PolarHBondContact O-N 3.39Å; A128-A131 PolarHBondContact O-N 3.37Å; L129-A131 VanDerWaalsContact C-N 3.34Å; L129-A131 PolarHBondContact O-N 2.96Å; A131-G134 PolarHBondContact O-N 3.46Å; A131-I135 WeakPolarHBondContact O-CG1 3.45Å; A131-I135 PolarHBondContact O-N 3.2Å
132	F	92.4	Very high	88.6	Confident	39 Å²	39	46.6 Å²	46.6	17%	0.171	25%	0.249	C	C	.	.	H	α-helix	trans	-62.9	-42.1	174.9	-64.3	-44.9	0	0	0	111.9	A128 L129 G134 I135 M136 I241 P242 Y245	A128-F132 HydrophobicContact CB-CD2 4.5Å; A128-F132 HydrophobicContact CB-CE2 4Å; A128-F132 WeakPolarHBondContact O-CD2 3.47Å; A128-F132 VanDerWaalsContact O-CG 3.28Å; A128-F132 WeakPolarHBondContact O-CG 3.47Å; A128-F132 PolarHBondContact O-N 3.23Å; L129-F132 HydrophobicContact CD2-CD2 4.3Å; L129-F132 PolarHBondContact O-N 2.84Å; F132-G134 VanDerWaalsContact C-N 3.34Å; F132-G134 PolarHBondContact O-N 2.86Å; F132-I135 PolarHBondContact O-N 3.47Å; F132-M136 WeakPolarHBondContact O-CB 3.32Å; F132-M136 VanDerWaalsContact O-CG 3.24Å; F132-M136 WeakPolarHBondContact O-CG 3.46Å; F132-M136 PolarHBondContact O-N 3.37Å; F132-I241 HydrophobicContact CD1-CG2 4.3Å; F132-I241 HydrophobicContact CE1-CG2 3.62Å; F132-I241 HydrophobicContact CZ-CG2 4.16Å; F132-P242 HydrophobicContact CB-CB 4.11Å; F132-P242 HydrophobicContact CB-CG 4.28Å; F132-P242 HydrophobicContact CD2-CB 3.81Å; F132-P242 HydrophobicContact CE2-CB 4.41Å; F132-P242 HydrophobicContact CG-CB 3.97Å; F132-P242 HydrophobicContact CG-CG 4.39Å; F132-Y245 AromaticContact CE2-CD1 3.6Å; F132-Y245 HydrophobicContact CE2-CD1 3.6Å; F132-Y245 HydrophobicContact CE2-CE1 4.12Å; F132-Y245 AromaticContact CE2-CG 3.93Å; F132-Y245 HydrophobicContact CE2-CG 3.93Å; F132-Y245 HydrophobicContact CZ-CD1 4.36Å; F132-Y245 HydrophobicContact CZ-CG 4.25Å
133	A	90.8	Very high	89	Confident	4 Å²	4	46.9 Å²	46.9	3%	0.033	25%	0.25	C	S	.	.	H	α-helix	trans	-61.7	-41	175.4	0	0	0	0	0	112.2	V60 I64 L129 L130 M136 Y137	V60-A133 HydrophobicContact CG1-CB 4.48Å; I64-A133 HydrophobicContact CD1-CB 3.96Å; I64-A133 HydrophobicContact CG1-CB 3.56Å; L129-A133 WeakPolarHBondContact O-CB 3.48Å; L129-A133 PolarHBondContact O-N 2.87Å; L130-A133 PolarHBondContact O-N 3.03Å; A133-M136 PolarHBondContact O-N 3.21Å; A133-Y137 PolarHBondContact O-N 2.99Å; A133-Y137 VanDerWaalsContact O-N 3.14Å
134	G	89.9	Confident	89.1	Confident	45 Å²	45	48.6 Å²	48.6	46%	0.464	26%	0.259	S	S	.	.	H	α-helix	trans	-60.8	-42.4	172.9	0	0	0	0	0	113.2	L130 A131 F132 Y137	L130-G134 PolarHBondContact O-N 3.02Å; L130-G134 VanDerWaalsContact O-N 3.08Å; A131-G134 PolarHBondContact O-N 3.46Å; F132-G134 VanDerWaalsContact C-N 3.34Å; F132-G134 PolarHBondContact O-N 2.86Å; G134-Y137 PolarHBondContact O-N 3.08Å
135	I	91.5	Very high	88.9	Confident	70 Å²	70	49.6 Å²	49.6	36%	0.359	26%	0.263	S	S	.	.	H	α-helix	trans	-66.4	-41.2	175.5	-68.8	163.1	0	0	0	111.2	A131 F132 Y137 I138 L238	A131-I135 WeakPolarHBondContact O-CG1 3.45Å; A131-I135 PolarHBondContact O-N 3.2Å; F132-I135 PolarHBondContact O-N 3.47Å; I135-Y137 PolarHBondContact O-N 3.45Å; I135-I138 WeakPolarHBondContact O-CB 3.31Å; I135-I138 WeakPolarHBondContact O-CG1 3.43Å; I135-I138 PolarHBondContact O-N 3.15Å; I135-I138 VanDerWaalsContact O-N 3.13Å; I135-L238 HydrophobicContact CG2-CD1 4.32Å; I135-L238 HydrophobicContact CG2-CD2 3.87Å
136	M	91.8	Very high	88.6	Confident	8 Å²	8	54.8 Å²	54.8	4%	0.039	29%	0.291	C	S	.	.	H	α-helix	trans	-65.4	-18.4	177.9	-76.3	-61.8	-64.8	0	0	113.7	T59 V60 F132 A133 P139 I235 L238 S239	T59-M136 HydrophobicContact CG2-CE 4.37Å; V60-M136 HydrophobicContact CG2-CB 3.84Å; F132-M136 WeakPolarHBondContact O-CB 3.32Å; F132-M136 VanDerWaalsContact O-CG 3.24Å; F132-M136 WeakPolarHBondContact O-CG 3.46Å; F132-M136 PolarHBondContact O-N 3.37Å; A133-M136 PolarHBondContact O-N 3.21Å; M136-P139 WeakPolarHBondContact O-CD 3.22Å; M136-I235 HydrophobicContact CE-CG2 3.86Å; M136-L238 HydrophobicContact SD-CB 3.6Å; M136-S239 PolarHBondContact SD-N 2.86Å; M136-S239 VanDerWaalsContact SD-N 3.37Å
137	Y	91.1	Very high	88.1	Confident	99 Å²	99	54.7 Å²	54.7	39%	0.388	29%	0.29	S	S	.	.	H	α-helix	trans	-81.4	-19.5	174.3	-167.4	-122.8	0	0	0	113.7	T56 V60 A133 G134 I135 A140 L141	T56-Y137 HydrophobicContact CG2-CD2 4.2Å; T56-Y137 HydrophobicContact CG2-CE2 4.2Å; V60-Y137 HydrophobicContact CG1-CD2 4.38Å; A133-Y137 PolarHBondContact O-N 2.99Å; A133-Y137 VanDerWaalsContact O-N 3.14Å; G134-Y137 PolarHBondContact O-N 3.08Å; I135-Y137 PolarHBondContact O-N 3.45Å; Y137-A140 HydrophobicContact CD2-CB 4.05Å; Y137-A140 HydrophobicContact CE2-CB 4.02Å; Y137-A140 WeakPolarHBondContact O-CB 3.32Å; Y137-A140 PolarHBondContact O-N 2.96Å; Y137-L141 HydrophobicContact CD1-CD1 3.69Å; Y137-L141 HydrophobicContact CD1-CD2 4.39Å; Y137-L141 HydrophobicContact CD1-CG 3.81Å; Y137-L141 HydrophobicContact CE1-CD1 3.77Å; Y137-L141 HydrophobicContact CE1-CD2 3.65Å; Y137-L141 HydrophobicContact CE1-CG 3.57Å; Y137-L141 PolarHBondContact O-N 3.46Å
138	I	90.9	Very high	87.5	Confident	101 Å²	101	50 Å²	50	52%	0.518	28%	0.276	S	S	.	.	H	α-helix	trans	-56.7	-41.7	-177.6	-60.5	172.7	0	0	0	113.1	I135 A140 L141 G142	I135-I138 WeakPolarHBondContact O-CB 3.31Å; I135-I138 WeakPolarHBondContact O-CG1 3.43Å; I135-I138 PolarHBondContact O-N 3.15Å; I135-I138 VanDerWaalsContact O-N 3.13Å; I138-A140 VanDerWaalsContact C-N 3.27Å; I138-A140 PolarHBondContact O-N 3.19Å; I138-L141 PolarHBondContact O-N 2.68Å; I138-G142 PolarHBondContact O-N 2.67Å
139	P	90	Very high	86.8	Confident	15 Å²	15	54.3 Å²	54.3	10%	0.097	30%	0.302	C	S	.	.	H	α-helix	trans	-65.4	-22.8	175.7	-23.1	35.2	0	0	0	114.9	M136 W143 R231 A234 I235 L238	M136-P139 WeakPolarHBondContact O-CD 3.22Å; P139-W143 PolarHBondContact O-N 3.09Å; P139-R231 HydrophobicContact CB-CG 4.48Å; P139-A234 HydrophobicContact CG-CB 4.3Å; P139-I235 HydrophobicContact CB-CD1 4.26Å; P139-I235 HydrophobicContact CB-CG1 3.68Å; P139-I235 HydrophobicContact CG-CG1 3.92Å; P139-L238 HydrophobicContact CG-CD1 3.66Å
140	A	86.5	Confident	86.2	Confident	13 Å²	13	60.8 Å²	60.8	11%	0.107	33%	0.325	C	S	.	.	H	α-helix	trans	-75.6	-50	174.7	0	0	0	0	0	110.6	Y137 I138 G142 W143 E144	Y137-A140 HydrophobicContact CD2-CB 4.05Å; Y137-A140 HydrophobicContact CE2-CB 4.02Å; Y137-A140 WeakPolarHBondContact O-CB 3.32Å; Y137-A140 PolarHBondContact O-N 2.96Å; I138-A140 VanDerWaalsContact C-N 3.27Å; I138-A140 PolarHBondContact O-N 3.19Å; A140-G142 VanDerWaalsContact C-N 3.28Å; A140-G142 PolarHBondContact O-N 2.92Å; A140-W143 WeakPolarHBondContact O-CB 3.38Å; A140-W143 PolarHBondContact O-N 3.15Å; A140-E144 PolarHBondContact O-N 3.23Å; A140-E144 VanDerWaalsContact O-N 3.09Å
141	L	86.5	Confident	85.8	Confident	59 Å²	59	56.7 Å²	56.7	31%	0.309	30%	0.304	S	S	.	.	H	α-helix	trans	-57	-41.5	172	-67.4	173.4	0	0	0	111.9	Y137 I138 W143 E144 F145	Y137-L141 HydrophobicContact CD1-CD1 3.69Å; Y137-L141 HydrophobicContact CD1-CD2 4.39Å; Y137-L141 HydrophobicContact CD1-CG 3.81Å; Y137-L141 HydrophobicContact CE1-CD1 3.77Å; Y137-L141 HydrophobicContact CE1-CD2 3.65Å; Y137-L141 HydrophobicContact CE1-CG 3.57Å; Y137-L141 PolarHBondContact O-N 3.46Å; I138-L141 PolarHBondContact O-N 2.68Å; L141-W143 VanDerWaalsContact C-N 3.28Å; L141-W143 PolarHBondContact O-N 2.88Å; L141-E144 PolarHBondContact O-N 3.24Å; L141-E144 VanDerWaalsContact O-N 3.16Å; L141-F145 HydrophobicContact CB-CE2 4.39Å; L141-F145 WeakPolarHBondContact O-CD2 3.27Å; L141-F145 PolarHBondContact O-N 2.88Å
142	G	85.7	Confident	85.2	Confident	28 Å²	28	55.1 Å²	55.1	29%	0.289	29%	0.289	S	S	.	.	H	α-helix	trans	-60	-35.1	175.8	0	0	0	0	0	113.4	I138 A140 L146	I138-G142 PolarHBondContact O-N 2.67Å; A140-G142 VanDerWaalsContact C-N 3.28Å; A140-G142 PolarHBondContact O-N 2.92Å; G142-L146 VanDerWaalsContact O-CB 3.22Å; G142-L146 WeakPolarHBondContact O-CB 3.5Å; G142-L146 WeakPolarHBondContact O-CG 3.41Å; G142-L146 PolarHBondContact O-N 3.31Å
143	W	86.8	Confident	84.7	Confident	10 Å²	10	56.5 Å²	56.5	4%	0.038	30%	0.303	C	S	.	.	H	α-helix	trans	-69.2	-43.2	173.2	-178.1	-98	0	0	0	111.8	L47 P139 A140 L141 F145 A147 S148 L151 L224 I227 Y228 R231 F351	L47-W143 PolarHBondContact O-NE1 3.04Å; P139-W143 PolarHBondContact O-N 3.09Å; A140-W143 WeakPolarHBondContact O-CB 3.38Å; A140-W143 PolarHBondContact O-N 3.15Å; L141-W143 VanDerWaalsContact C-N 3.28Å; L141-W143 PolarHBondContact O-N 2.88Å; W143-F145 PolarHBondContact O-N 2.85Å; W143-A147 HydrophobicContact CD2-CB 3.54Å; W143-A147 HydrophobicContact CE3-CB 3.39Å; W143-A147 HydrophobicContact CG-CB 4.21Å; W143-A147 HydrophobicContact CH2-CB 3.82Å; W143-A147 HydrophobicContact CZ2-CB 3.96Å; W143-A147 HydrophobicContact CZ3-CB 3.54Å; W143-A147 WeakPolarHBondContact O-CB 3.35Å; W143-A147 PolarHBondContact O-N 3.12Å; W143-S148 PolarHBondContact O-N 3.08Å; W143-L151 HydrophobicContact CZ2-CD2 3.88Å; W143-L224 HydrophobicContact CH2-CD1 4.23Å; W143-I227 HydrophobicContact CE3-CG2 4.24Å; W143-I227 HydrophobicContact CZ3-CG2 3.99Å; W143-Y228 AromaticContact CH2-CD2 3.85Å; W143-Y228 HydrophobicContact CH2-CD2 3.85Å; W143-Y228 HydrophobicContact CZ3-CD2 4.03Å; W143-R231 HydrophobicContact CE3-CB 4.44Å; W143-F351 HydrophobicContact CH2-CZ 4.36Å; W143-F351 HydrophobicContact CZ2-CE2 4.3Å; W143-F351 AromaticContact CZ2-CZ 3.69Å; W143-F351 HydrophobicContact CZ2-CZ 3.69Å
144	E	85.2	Confident	84.3	Confident	104 Å²	104	58.5 Å²	58.5	49%	0.486	31%	0.312	S	S	.	.	I	π-helix	trans	-60.8	-42	177.8	-168.4	177.2	-170.6	0	0	112.5	A140 L141 S148	A140-E144 PolarHBondContact O-N 3.23Å; A140-E144 VanDerWaalsContact O-N 3.09Å; L141-E144 PolarHBondContact O-N 3.24Å; L141-E144 VanDerWaalsContact O-N 3.16Å; E144-S148 VanDerWaalsContact O-CB 3.25Å; E144-S148 WeakPolarHBondContact O-CB 3.37Å
145	F	81.6	Confident	83.8	Confident	148 Å²	148	56.3 Å²	56.3	65%	0.649	29%	0.29	S	S	*	.	I	π-helix	trans	-80.1	-41.9	178.6	-67.2	-63.3	0	0	0	114.1	L141 W143	L141-F145 HydrophobicContact CB-CE2 4.39Å; L141-F145 WeakPolarHBondContact O-CD2 3.27Å; L141-F145 PolarHBondContact O-N 2.88Å; W143-F145 PolarHBondContact O-N 2.85Å
146	L	79.6	Confident	83.3	Confident	115 Å²	115	55 Å²	55	60%	0.602	28%	0.283	S	S	*	.	I	π-helix	trans	-93.1	-38.2	-169.3	-60.3	173.8	0	0	0	114.4	G142	G142-L146 VanDerWaalsContact O-CB 3.22Å; G142-L146 WeakPolarHBondContact O-CB 3.5Å; G142-L146 WeakPolarHBondContact O-CG 3.41Å; G142-L146 PolarHBondContact O-N 3.31Å
147	A	77.7	Confident	82.8	Confident	4 Å²	4	59.5 Å²	59.5	3%	0.033	30%	0.303	C	S	.	.	I	π-helix	trans	-103.5	-42.3	-171	0	0	0	0	0	112.1	W143 R150 L151 I227	W143-A147 HydrophobicContact CD2-CB 3.54Å; W143-A147 HydrophobicContact CE3-CB 3.39Å; W143-A147 HydrophobicContact CG-CB 4.21Å; W143-A147 HydrophobicContact CH2-CB 3.82Å; W143-A147 HydrophobicContact CZ2-CB 3.96Å; W143-A147 HydrophobicContact CZ3-CB 3.54Å; W143-A147 WeakPolarHBondContact O-CB 3.35Å; W143-A147 PolarHBondContact O-N 3.12Å; A147-R150 PolarHBondContact O-N 2.63Å; A147-L151 VanDerWaalsContact O-CB 3.27Å; A147-L151 WeakPolarHBondContact O-CB 3.26Å; A147-L151 PolarHBondContact O-N 3.44Å; A147-I227 HydrophobicContact CB-CG2 4.2Å
148	S	76.5	Confident	82.1	Confident	27 Å²	27	54.8 Å²	54.8	19%	0.189	28%	0.284	C	S	.	.	I	π-helix	trans	-56.5	-59.6	-171.3	175.6	0	0	0	0	112.4	L47 W143 E144 R150 L151 T152	L47-S148 WeakPolarHBondContact CD2-O 3.33Å; L47-S148 WeakPolarHBondContact CD2-OG 3.34Å; W143-S148 PolarHBondContact O-N 3.08Å; E144-S148 VanDerWaalsContact O-CB 3.25Å; E144-S148 WeakPolarHBondContact O-CB 3.37Å; S148-R150 VanDerWaalsContact C-N 3.27Å; S148-R150 PolarHBondContact O-N 3.25Å; S148-R150 VanDerWaalsContact O-N 3.13Å; S148-L151 CarbonylContact O-C 3.58Å; S148-L151 WeakPolarHBondContact O-CA 3.22Å; S148-L151 PolarHBondContact O-N 3.42Å; S148-T152 PolarHBondContact O-N 2.78Å; S148-T152 PolarHBondContact O-OG1 3.15Å
149	T	76.1	Confident	81.4	Confident	94 Å²	94	50.7 Å²	50.7	58%	0.577	26%	0.263	S	S	*	.	H	α-helix	trans	-51.9	-41.4	-178.6	54.7	0	0	0	0	113.8
150	R	78.7	Confident	80.8	Confident	151 Å²	151	55.8 Å²	55.8	57%	0.57	29%	0.286	S	S	*	.	H	α-helix	trans	-67.7	-52	174.6	-67.6	179.8	177.1	-98.8	-1.8	110.9	A147 S148 T152 S153 E154	A147-R150 PolarHBondContact O-N 2.63Å; S148-R150 VanDerWaalsContact C-N 3.27Å; S148-R150 PolarHBondContact O-N 3.25Å; S148-R150 VanDerWaalsContact O-N 3.13Å; R150-T152 VanDerWaalsContact C-N 3.31Å; R150-T152 PolarHBondContact O-N 3.25Å; R150-S153 PolarHBondContact O-N 3.44Å; R150-S153 VanDerWaalsContact O-N 3.14Å; R150-S153 PolarHBondContact O-OG 3.18Å; R150-E154 WeakPolarHBondContact O-CG 3.24Å; R150-E154 PolarHBondContact O-N 3.25Å; R150-E154 VanDerWaalsContact O-N 3.09Å
151	L	80.6	Confident	80.2	Confident	1 Å²	1	56.8 Å²	56.8	1%	0.005	29%	0.288	C	S	.	.	H	α-helix	trans	-58.9	-38.3	-178.2	-174.1	61	0	0	0	112.3	L47 W143 A147 S148 S153 E154 L155 L224 L348 F351	L47-L151 HydrophobicContact CD2-CB 4.28Å; L47-L151 HydrophobicContact CG-CD2 4.46Å; W143-L151 HydrophobicContact CZ2-CD2 3.88Å; A147-L151 VanDerWaalsContact O-CB 3.27Å; A147-L151 WeakPolarHBondContact O-CB 3.26Å; A147-L151 PolarHBondContact O-N 3.44Å; S148-L151 CarbonylContact O-C 3.58Å; S148-L151 WeakPolarHBondContact O-CA 3.22Å; S148-L151 PolarHBondContact O-N 3.42Å; L151-S153 VanDerWaalsContact C-N 3.32Å; L151-S153 PolarHBondContact O-N 3.25Å; L151-E154 PolarHBondContact O-N 2.81Å; L151-L155 WeakPolarHBondContact O-CB 3.29Å; L151-L155 PolarHBondContact O-N 2.99Å; L151-L224 HydrophobicContact CD1-CD2 4.04Å; L151-L348 HydrophobicContact CD1-CD1 4.27Å; L151-F351 HydrophobicContact CD1-CD2 4.41Å; L151-F351 HydrophobicContact CD2-CD1 3.84Å; L151-F351 HydrophobicContact CD2-CD2 4.02Å; L151-F351 HydrophobicContact CD2-CE1 3.59Å; L151-F351 HydrophobicContact CD2-CE2 3.79Å; L151-F351 HydrophobicContact CD2-CG 4.05Å; L151-F351 HydrophobicContact CD2-CZ 3.57Å
152	T	79.3	Confident	79.6	Confident	22 Å²	22	54.7 Å²	54.7	14%	0.135	28%	0.277	C	S	.	.	H	α-helix	trans	-58.1	-45.4	176.7	-38.8	0	0	0	0	111.1	M42 L45 L47 S148 R150 N156	M42-T152 HydrophobicContact CE-CG2 3.58Å; L45-T152 HydrophobicContact CD1-CG2 4.15Å; L47-T152 HydrophobicContact CD1-CG2 4.23Å; L47-T152 WeakPolarHBondContact CD2-OG1 3.2Å; S148-T152 PolarHBondContact O-N 2.78Å; S148-T152 PolarHBondContact O-OG1 3.15Å; R150-T152 VanDerWaalsContact C-N 3.31Å; R150-T152 PolarHBondContact O-N 3.25Å; T152-N156 VanDerWaalsContact O-CB 3.3Å; T152-N156 WeakPolarHBondContact O-CB 3.49Å; T152-N156 PolarHBondContact O-N 3.21Å; T152-N156 PolarHBondContact O-ND2 3.31Å
153	S	82.9	Confident	78.9	Confident	68 Å²	68	55.4 Å²	55.4	48%	0.476	27%	0.274	S	S	.	.	H	α-helix	trans	-68.7	-43.4	-179	70.1	0	0	0	0	112.6	R150 L151 F157	R150-S153 PolarHBondContact O-N 3.44Å; R150-S153 VanDerWaalsContact O-N 3.14Å; R150-S153 PolarHBondContact O-OG 3.18Å; L151-S153 VanDerWaalsContact C-N 3.32Å; L151-S153 PolarHBondContact O-N 3.25Å; S153-F157 WeakPolarHBondContact O-CB 3.16Å; S153-F157 PolarHBondContact O-N 2.52Å
154	E	80.8	Confident	78.4	Confident	46 Å²	46	57.9 Å²	57.9	22%	0.215	29%	0.288	C	S	.	.	H	α-helix	trans	-72.7	-35.9	-177.7	-64.7	-176.7	149.3	0	0	111.8	R150 L151 L158 R218	R150-E154 WeakPolarHBondContact O-CG 3.24Å; R150-E154 PolarHBondContact O-N 3.25Å; R150-E154 VanDerWaalsContact O-N 3.09Å; L151-E154 PolarHBondContact O-N 2.81Å; E154-L158 WeakPolarHBondContact O-CB 3.09Å; E154-L158 PolarHBondContact O-N 2.91Å; E154-L158 VanDerWaalsContact O-N 3.08Å; E154-R218 VanDerWaalsContact CD-NH1 3.34Å; E154-R218 IonicContact OE1-CZ 2.81Å; E154-R218 IonicContact OE1-NH1 2.66Å; E154-R218 PolarHBondContact OE1-NH1 3.43Å; E154-R218 IonicContact OE1-NH2 2.66Å; E154-R218 PolarHBondContact OE1-NH2 3.39Å; E154-R218 IonicContact OE2-CZ 3.4Å; E154-R218 IonicContact OE2-NH1 2.78Å; E154-R218 IonicContact OE2-NH2 2.95Å; E154-R218 PolarHBondContact OE2-NH2 3.24Å
155	L	79.4	Confident	77.5	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-70.8	-47.3	175.8	-170.5	64.2	0	0	0	110.9	L45 L151 F157 L158 L159 L348 F351	L45-L155 HydrophobicContact CD2-CD2 4.02Å; L45-L155 HydrophobicContact CD2-CG 4.29Å; L151-L155 WeakPolarHBondContact O-CB 3.29Å; L151-L155 PolarHBondContact O-N 2.99Å; L155-F157 PolarHBondContact O-N 3.45Å; L155-L158 PolarHBondContact O-N 3.47Å; L155-L159 HydrophobicContact CD1-CD1 3.58Å; L155-L159 HydrophobicContact CG-CD1 3.94Å; L155-L159 WeakPolarHBondContact O-CB 3.35Å; L155-L159 VanDerWaalsContact O-CD1 3.26Å; L155-L159 WeakPolarHBondContact O-CD1 3.36Å; L155-L159 PolarHBondContact O-N 2.88Å; L155-L348 HydrophobicContact CD1-CD1 4.04Å; L155-F351 HydrophobicContact CD1-CB 3.96Å; L155-F351 HydrophobicContact CD2-CB 4.11Å
156	N	80.8	Confident	76.7	Confident	42 Å²	42	48.2 Å²	48.2	23%	0.225	25%	0.245	C	C	.	.	H	α-helix	trans	-55.9	-48.7	173.4	-89.7	-66.6	0	0	0	111.9	L45 T152 L158 L159 Q160	L45-N156 WeakPolarHBondContact CD1-ND2 3.31Å; T152-N156 VanDerWaalsContact O-CB 3.3Å; T152-N156 WeakPolarHBondContact O-CB 3.49Å; T152-N156 PolarHBondContact O-N 3.21Å; T152-N156 PolarHBondContact O-ND2 3.31Å; N156-L158 PolarHBondContact O-N 3.3Å; N156-L159 PolarHBondContact O-N 3.35Å; N156-Q160 WeakPolarHBondContact O-CB 3.37Å; N156-Q160 PolarHBondContact O-N 3.19Å
157	F	81.8	Confident	76.2	Confident	102 Å²	102	46.2 Å²	46.2	45%	0.447	23%	0.232	S	C	.	.	H	α-helix	trans	-57.7	-48.8	179	173.2	-99.6	0	0	0	111.7	S153 L155 Q160 E161 Y214	S153-F157 WeakPolarHBondContact O-CB 3.16Å; S153-F157 PolarHBondContact O-N 2.52Å; L155-F157 PolarHBondContact O-N 3.45Å; F157-Q160 PolarHBondContact O-N 2.77Å; F157-E161 VanDerWaalsContact O-CB 3.3Å; F157-E161 WeakPolarHBondContact O-CB 3.41Å; F157-E161 PolarHBondContact O-N 3.49Å; F157-Y214 HydrophobicContact CD1-CE1 4.31Å; F157-Y214 HydrophobicContact CD1-CE2 4.01Å; F157-Y214 AromaticContact CD1-CZ 3.83Å; F157-Y214 HydrophobicContact CE1-CD1 4.29Å; F157-Y214 AromaticContact CE1-CD2 3.88Å; F157-Y214 HydrophobicContact CE1-CD2 3.88Å; F157-Y214 HydrophobicContact CE1-CE1 4.12Å; F157-Y214 AromaticContact CE1-CE2 3.67Å; F157-Y214 HydrophobicContact CE1-CE2 3.67Å; F157-Y214 HydrophobicContact CE1-CG 4.19Å; F157-Y214 AromaticContact CE1-CZ 3.8Å
158	L	76.7	Confident	75.6	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-67	-38.7	179.9	177	151.8	0	0	0	112.3	E154 L155 N156 I162 F211 Y214 L215 L348 C352	E154-L158 WeakPolarHBondContact O-CB 3.09Å; E154-L158 PolarHBondContact O-N 2.91Å; E154-L158 VanDerWaalsContact O-N 3.08Å; L155-L158 PolarHBondContact O-N 3.47Å; N156-L158 PolarHBondContact O-N 3.3Å; L158-I162 HydrophobicContact CD2-CD1 3.47Å; L158-I162 VanDerWaalsContact CD2-CD1 3.47Å; L158-I162 HydrophobicContact CD2-CG1 4.38Å; L158-I162 HydrophobicContact CG-CD1 4.12Å; L158-I162 WeakPolarHBondContact O-CB 3.4Å; L158-I162 VanDerWaalsContact O-CG1 3.26Å; L158-I162 WeakPolarHBondContact O-CG1 3.25Å; L158-I162 PolarHBondContact O-N 3.36Å; L158-F211 HydrophobicContact CG-CE2 4.32Å; L158-F211 HydrophobicContact CG-CZ 4.48Å; L158-Y214 HydrophobicContact CD1-CE1 4.37Å; L158-L215 HydrophobicContact CD1-CD2 4.05Å; L158-L348 HydrophobicContact CD1-CD2 3.66Å; L158-L348 HydrophobicContact CD1-CG 4.1Å; L158-C352 WeakPolarHBondContact CD2-SG 3.32Å
159	L	75.6	Confident	74.9	Confident	16 Å²	16	49.4 Å²	49.4	8%	0.084	24%	0.242	C	C	.	.	H	α-helix	trans	-64.2	-46.1	176.7	-95.5	65	0	0	0	111.5	L45 L155 N156 I162 D163 N355 I359	L45-L159 HydrophobicContact CD2-CD2 3.82Å; L155-L159 HydrophobicContact CD1-CD1 3.58Å; L155-L159 HydrophobicContact CG-CD1 3.94Å; L155-L159 WeakPolarHBondContact O-CB 3.35Å; L155-L159 VanDerWaalsContact O-CD1 3.26Å; L155-L159 WeakPolarHBondContact O-CD1 3.36Å; L155-L159 PolarHBondContact O-N 2.88Å; N156-L159 PolarHBondContact O-N 3.35Å; L159-I162 PolarHBondContact O-N 2.94Å; L159-D163 PolarHBondContact O-N 3.33Å; L159-N355 HydrophobicContact CD2-CB 4.38Å; L159-I359 HydrophobicContact CD1-CD1 4.48Å; L159-I359 HydrophobicContact CD2-CD1 3.77Å; L159-I359 HydrophobicContact CD2-CG1 3.82Å; L159-I359 HydrophobicContact CG-CD1 3.6Å; L159-I359 HydrophobicContact CG-CG1 4.08Å
160	Q	77.4	Confident	74.2	Confident	122 Å²	122	47.1 Å²	47.1	57%	0.57	23%	0.232	S	C	*	.	H	α-helix	trans	-67.1	-36.9	179.2	-172.5	58.6	73.3	0	0	112.3	N156 F157 D163 N164	N156-Q160 WeakPolarHBondContact O-CB 3.37Å; N156-Q160 PolarHBondContact O-N 3.19Å; F157-Q160 PolarHBondContact O-N 2.77Å; Q160-D163 PolarHBondContact O-N 2.94Å; Q160-N164 VanDerWaalsContact O-CB 3.31Å; Q160-N164 WeakPolarHBondContact O-CB 3.43Å; Q160-N164 PolarHBondContact O-N 3.26Å
161	E	75.6	Confident	73.2	Confident	33 Å²	33	46 Å²	46	15%	0.154	23%	0.233	C	C	.	.	H	α-helix	trans	-73.1	-32.2	177.5	-171.5	54.6	-148.1	0	0	112.1	F157 C165 F211	F157-E161 VanDerWaalsContact O-CB 3.3Å; F157-E161 WeakPolarHBondContact O-CB 3.41Å; F157-E161 PolarHBondContact O-N 3.49Å; E161-C165 WeakPolarHBondContact O-CB 3.42Å; E161-C165 PolarHBondContact O-N 2.98Å; E161-C165 PolarHBondContact O-SG 3.42Å; E161-C165 PolarHBondContact OE1-SG 3.39Å; E161-F211 HydrophobicContact CB-CD2 4.14Å; E161-F211 HydrophobicContact CB-CE2 4.28Å; E161-F211 HydrophobicContact CG-CB 4.1Å; E161-F211 HydrophobicContact CG-CD2 3.46Å; E161-F211 VanDerWaalsContact CG-CD2 3.46Å; E161-F211 HydrophobicContact CG-CE2 4.08Å; E161-F211 HydrophobicContact CG-CG 3.92Å
162	I	72.1	Confident	71.9	Confident	15 Å²	15	47.6 Å²	47.6	8%	0.077	25%	0.25	C	S	.	.	H	α-helix	trans	-64.5	-44.8	169.5	-73.2	172.7	0	0	0	110.9	L158 L159 C165 Y166 F211 L326 L362	L158-I162 HydrophobicContact CD2-CD1 3.47Å; L158-I162 VanDerWaalsContact CD2-CD1 3.47Å; L158-I162 HydrophobicContact CD2-CG1 4.38Å; L158-I162 HydrophobicContact CG-CD1 4.12Å; L158-I162 WeakPolarHBondContact O-CB 3.4Å; L158-I162 VanDerWaalsContact O-CG1 3.26Å; L158-I162 WeakPolarHBondContact O-CG1 3.25Å; L158-I162 PolarHBondContact O-N 3.36Å; L159-I162 PolarHBondContact O-N 2.94Å; I162-C165 PolarHBondContact O-N 3.3Å; I162-Y166 WeakPolarHBondContact O-CB 3.22Å; I162-Y166 PolarHBondContact O-N 3.04Å; I162-F211 HydrophobicContact CD1-CZ 4.16Å; I162-F211 HydrophobicContact CG1-CE1 4Å; I162-F211 HydrophobicContact CG1-CE2 4.35Å; I162-F211 HydrophobicContact CG1-CZ 3.5Å; I162-F211 VanDerWaalsContact CG1-CZ 3.5Å; I162-L326 HydrophobicContact CD1-CD2 3.89Å; I162-L326 HydrophobicContact CG1-CD2 4.02Å; I162-L326 HydrophobicContact CG2-CD2 4.48Å; I162-L362 HydrophobicContact CG2-CD1 3.76Å
163	D	72.4	Confident	70.6	Confident	43 Å²	43	49.4 Å²	49.4	23%	0.23	26%	0.255	C	S	.	.	H	α-helix	trans	-62.1	-47.1	178.2	-174.3	61	0	0	0	111.7	L159 Q160 Y166 H167 S361	L159-D163 PolarHBondContact O-N 3.33Å; Q160-D163 PolarHBondContact O-N 2.94Å; D163-Y166 PolarHBondContact O-N 2.93Å; D163-H167 PolarHBondContact O-N 3.29Å; D163-H167 IonicContact OD1-CD2 2.62Å; D163-S361 WeakPolarHBondContact OD1-CB 3.19Å; D163-S361 PolarHBondContact OD1-OG 3.06Å
164	N	74.8	Confident	69.2	Low	62 Å²	62	49 Å²	49	33%	0.332	26%	0.256	S	S	.	.	H	α-helix	trans	-60.9	-46.5	174	-178.4	39.7	0	0	0	111.9	Q160 Y166 H167 R168	Q160-N164 VanDerWaalsContact O-CB 3.31Å; Q160-N164 WeakPolarHBondContact O-CB 3.43Å; Q160-N164 PolarHBondContact O-N 3.26Å; N164-Y166 VanDerWaalsContact C-N 3.29Å; N164-Y166 PolarHBondContact O-N 3.43Å; N164-H167 PolarHBondContact O-N 3.05Å; N164-R168 VanDerWaalsContact O-CB 3.24Å; N164-R168 WeakPolarHBondContact O-CB 3.37Å; N164-R168 PolarHBondContact O-N 3.17Å
165	C	66.8	Low	67.6	Low	11 Å²	11	49.1 Å²	49.1	7%	0.074	26%	0.26	C	S	.	.	H	α-helix	trans	-61.8	-34.7	175.5	-87.8	0	0	0	0	112.8	E161 I162 A169	E161-C165 WeakPolarHBondContact O-CB 3.42Å; E161-C165 PolarHBondContact O-N 2.98Å; E161-C165 PolarHBondContact O-SG 3.42Å; E161-C165 PolarHBondContact OE1-SG 3.39Å; I162-C165 PolarHBondContact O-N 3.3Å; C165-A169 WeakPolarHBondContact O-CB 3.33Å; C165-A169 PolarHBondContact O-N 3.04Å
166	Y	65.7	Low	66.1	Low	39 Å²	39	53.9 Å²	53.9	15%	0.153	28%	0.281	C	S	.	.	H	α-helix	trans	-70.1	-51.8	175.3	174	-90.1	0	0	0	111.5	I162 D163 N164 R168 A169 A170 L365 I368	I162-Y166 WeakPolarHBondContact O-CB 3.22Å; I162-Y166 PolarHBondContact O-N 3.04Å; D163-Y166 PolarHBondContact O-N 2.93Å; N164-Y166 VanDerWaalsContact C-N 3.29Å; N164-Y166 PolarHBondContact O-N 3.43Å; Y166-R168 VanDerWaalsContact C-N 3.33Å; Y166-R168 PolarHBondContact O-N 2.91Å; Y166-A169 WeakPolarHBondContact O-CB 3.14Å; Y166-A169 PolarHBondContact O-N 2.93Å; Y166-A169 VanDerWaalsContact O-N 3.1Å; Y166-A170 PolarHBondContact O-N 3Å; Y166-L365 HydrophobicContact CD2-CB 4.05Å; Y166-L365 HydrophobicContact CD2-CD1 4.11Å; Y166-L365 HydrophobicContact CD2-CD2 4.29Å; Y166-L365 HydrophobicContact CD2-CG 4.37Å; Y166-L365 HydrophobicContact CE2-CB 3.83Å; Y166-L365 HydrophobicContact CE2-CD1 3.92Å; Y166-L365 HydrophobicContact CE2-CG 4.36Å; Y166-I368 VanDerWaalsContact OH-CD1 3.32Å; Y166-I368 WeakPolarHBondContact OH-CD1 2.96Å
167	H	68.4	Low	64.8	Low	72 Å²	72	54 Å²	54	33%	0.333	28%	0.281	S	S	.	.	H	α-helix	trans	-55.7	-49.1	176.5	-98.2	-84.9	0	0	0	111	D163 N164 A169 A170 E171	D163-H167 PolarHBondContact O-N 3.29Å; D163-H167 IonicContact OD1-CD2 2.62Å; N164-H167 PolarHBondContact O-N 3.05Å; H167-A169 VanDerWaalsContact C-N 3.33Å; H167-A169 PolarHBondContact O-N 2.87Å; H167-A170 PolarHBondContact O-N 3.32Å; H167-E171 IonicContact CE1-OE1 2.65Å; H167-E171 IonicContact CG-OE1 2.62Å; H167-E171 IonicContact ND1-OE1 3.31Å; H167-E171 PolarHBondContact ND1-OE1 3.46Å; H167-E171 WeakPolarHBondContact O-CB 3.21Å; H167-E171 WeakPolarHBondContact O-CG 3.34Å; H167-E171 PolarHBondContact O-N 3.08Å
168	R	66.4	Low	63.5	Low	89 Å²	89	54.1 Å²	54.1	34%	0.336	28%	0.283	S	S	.	.	H	α-helix	trans	-65.9	-30	176.8	-166.9	174.1	-172.8	-166.7	10.5	113.7	N164 Y166 G172 E207	N164-R168 VanDerWaalsContact O-CB 3.24Å; N164-R168 WeakPolarHBondContact O-CB 3.37Å; N164-R168 PolarHBondContact O-N 3.17Å; Y166-R168 VanDerWaalsContact C-N 3.33Å; Y166-R168 PolarHBondContact O-N 2.91Å; R168-G172 VanDerWaalsContact O-CA 3.27Å; R168-G172 WeakPolarHBondContact O-CA 3.07Å; R168-G172 PolarHBondContact O-N 2.98Å; R168-E207 IonicContact CZ-OE1 3.75Å; R168-E207 IonicContact CZ-OE2 3.72Å; R168-E207 IonicContact NH1-OE1 2.62Å; R168-E207 PolarHBondContact NH1-OE1 3.33Å; R168-E207 IonicContact NH1-OE2 2.66Å; R168-E207 PolarHBondContact NH1-OE2 2.98Å; R168-E207 IonicContact NH2-OE1 2.69Å
169	A	61.3	Low	62.4	Low	10 Å²	10	60.9 Å²	60.9	8%	0.083	31%	0.313	C	S	.	.	H	α-helix	trans	-68.9	-44	173.1	0	0	0	0	0	111.7	C165 Y166 H167 R173 V329	C165-A169 WeakPolarHBondContact O-CB 3.33Å; C165-A169 PolarHBondContact O-N 3.04Å; Y166-A169 WeakPolarHBondContact O-CB 3.14Å; Y166-A169 PolarHBondContact O-N 2.93Å; Y166-A169 VanDerWaalsContact O-N 3.1Å; H167-A169 VanDerWaalsContact C-N 3.33Å; H167-A169 PolarHBondContact O-N 2.87Å; A169-R173 VanDerWaalsContact O-CB 3.23Å; A169-R173 WeakPolarHBondContact O-CB 3.45Å; A169-R173 VanDerWaalsContact O-CG 3.3Å; A169-R173 WeakPolarHBondContact O-CG 3.47Å; A169-R173 PolarHBondContact O-N 3.48Å; A169-R173 VanDerWaalsContact O-N 3.12Å; A169-V329 HydrophobicContact CB-CG1 4.41Å
170	A	60.5	Low	61.2	Low	46 Å²	46	64 Å²	64	38%	0.38	33%	0.327	S	S	.	.	H	α-helix	trans	-66.2	-56.6	177.7	0	0	0	0	0	111.6	Y166 H167 G172 A174	Y166-A170 PolarHBondContact O-N 3Å; H167-A170 PolarHBondContact O-N 3.32Å; A170-G172 VanDerWaalsContact C-N 3.34Å; A170-G172 PolarHBondContact O-N 2.94Å; A170-A174 WeakPolarHBondContact O-CB 3.5Å; A170-A174 PolarHBondContact O-N 3.27Å; A170-A174 VanDerWaalsContact O-N 3.1Å
171	E	58.5	Low	60.1	Low	127 Å²	127	60.8 Å²	60.8	59%	0.593	31%	0.313	S	S	*	.	H	α-helix	trans	-71.3	-27.4	-176.1	-65.2	168.1	-149.1	0	0	112.9	H167 P175	H167-E171 IonicContact CE1-OE1 2.65Å; H167-E171 IonicContact CG-OE1 2.62Å; H167-E171 IonicContact ND1-OE1 3.31Å; H167-E171 PolarHBondContact ND1-OE1 3.46Å; H167-E171 WeakPolarHBondContact O-CB 3.21Å; H167-E171 WeakPolarHBondContact O-CG 3.34Å; H167-E171 PolarHBondContact O-N 3.08Å; E171-P175 WeakPolarHBondContact O-CD 3.19Å; E171-P175 VanDerWaalsContact O-CG 3.3Å; E171-P175 WeakPolarHBondContact O-CG 3.16Å
172	G	52.5	Low	59.1	Low	35 Å²	35	65.5 Å²	65.5	36%	0.361	34%	0.335	S	S	.	.	H	α-helix	trans	-82.2	-35.9	177.6	0	0	0	0	0	114.2	R168 A170	R168-G172 VanDerWaalsContact O-CA 3.27Å; R168-G172 WeakPolarHBondContact O-CA 3.07Å; R168-G172 PolarHBondContact O-N 2.98Å; A170-G172 VanDerWaalsContact C-N 3.34Å; A170-G172 PolarHBondContact O-N 2.94Å
173	R	52.5	Low	58.2	Low	59 Å²	59	69.3 Å²	69.3	22%	0.223	36%	0.363	C	S	.	.	H	α-helix	trans	-91.9	-46.3	-175.3	-62.1	-178.3	-173.3	152.6	8	113	A169 K176 I177 V329	A169-R173 VanDerWaalsContact O-CB 3.23Å; A169-R173 WeakPolarHBondContact O-CB 3.45Å; A169-R173 VanDerWaalsContact O-CG 3.3Å; A169-R173 WeakPolarHBondContact O-CG 3.47Å; A169-R173 PolarHBondContact O-N 3.48Å; A169-R173 VanDerWaalsContact O-N 3.12Å; R173-K176 PolarHBondContact O-N 2.97Å; R173-I177 HydrophobicContact CB-CD1 4.3Å; R173-I177 WeakPolarHBondContact O-CB 3.39Å; R173-I177 WeakPolarHBondContact O-CG1 3.49Å; R173-I177 PolarHBondContact O-N 3.28Å; R173-V329 PolarHBondContact NH1-O 2.88Å; R173-V329 PolarHBondContact NH2-O 3.31Å
174	A	54	Low	57.2	Low	61 Å²	61	72.2 Å²	72.2	50%	0.504	37%	0.373	S	S	.	.	H	α-helix	trans	-60.2	-48.5	-173.9	0	0	0	0	0	113.1	A170 K176 I177 E178	A170-A174 WeakPolarHBondContact O-CB 3.5Å; A170-A174 PolarHBondContact O-N 3.27Å; A170-A174 VanDerWaalsContact O-N 3.1Å; A174-K176 PolarHBondContact O-N 3.49Å; A174-I177 PolarHBondContact O-N 2.7Å; A174-E178 VanDerWaalsContact O-CB 3.32Å; A174-E178 WeakPolarHBondContact O-CB 3.47Å; A174-E178 PolarHBondContact O-N 2.95Å
175	P	47.1	Very low	56	Low	48 Å²	48	70.3 Å²	70.3	31%	0.312	37%	0.369	S	S	.	.	H	α-helix	trans	-73.3	-24.3	-179.9	-17.5	33.8	0	0	0	113.6	E171 K179	E171-P175 WeakPolarHBondContact O-CD 3.19Å; E171-P175 VanDerWaalsContact O-CG 3.3Å; E171-P175 WeakPolarHBondContact O-CG 3.16Å; P175-K179 VanDerWaalsContact O-CB 3.3Å; P175-K179 WeakPolarHBondContact O-CB 3.31Å; P175-K179 VanDerWaalsContact O-CD 3.3Å; P175-K179 WeakPolarHBondContact O-CD 3.37Å; P175-K179 WeakPolarHBondContact O-CG 3.42Å; P175-K179 PolarHBondContact O-N 2.88Å; P175-K179 VanDerWaalsContact O-N 3.16Å
176	K	47.5	Very low	55.2	Low	99 Å²	99	76.9 Å²	76.9	43%	0.43	41%	0.411	S	S	.	.	H	α-helix	trans	-67.4	-54.1	170.9	-97	-172.8	167.2	-175.8	0	109.9	R173 A174 E178 K179 Q180 E203	R173-K176 PolarHBondContact O-N 2.97Å; A174-K176 PolarHBondContact O-N 3.49Å; K176-E178 PolarHBondContact O-N 2.79Å; K176-K179 PolarHBondContact O-N 3.01Å; K176-Q180 WeakPolarHBondContact O-CB 3.48Å; K176-Q180 PolarHBondContact O-N 3.37Å; K176-E203 IonicContact NZ-OE1 2.62Å; K176-E203 PolarHBondContact NZ-OE1 2.85Å; K176-E203 IonicContact NZ-OE2 3.58Å; K176-E203 PolarHBondContact NZ-OE2 2.89Å
177	I	53.8	Low	54.3	Low	44 Å²	44	78.4 Å²	78.4	23%	0.226	44%	0.439	C	S	.	.	H	α-helix	trans	-60.4	-45.3	-179.8	-66.9	167.1	0	0	0	110.7	R173 A174 K179 Q180 I181 A200	R173-I177 HydrophobicContact CB-CD1 4.3Å; R173-I177 WeakPolarHBondContact O-CB 3.39Å; R173-I177 WeakPolarHBondContact O-CG1 3.49Å; R173-I177 PolarHBondContact O-N 3.28Å; A174-I177 PolarHBondContact O-N 2.7Å; I177-K179 PolarHBondContact O-N 3.43Å; I177-Q180 PolarHBondContact O-N 3.48Å; I177-I181 HydrophobicContact CG2-CD1 3.74Å; I177-I181 HydrophobicContact CG2-CG1 4.49Å; I177-I181 WeakPolarHBondContact O-CB 3.37Å; I177-I181 WeakPolarHBondContact O-CG1 3.4Å; I177-I181 PolarHBondContact O-N 3.34Å; I177-A200 HydrophobicContact CG1-CB 4.34Å
178	E	53.2	Low	53.4	Low	105 Å²	105	77 Å²	77	49%	0.491	43%	0.433	S	S	.	.	H	α-helix	trans	-57.9	-50.7	176.5	-173.7	-171.5	175.3	0	0	111.7	A174 K176 Q180 I181 Q182	A174-E178 VanDerWaalsContact O-CB 3.32Å; A174-E178 WeakPolarHBondContact O-CB 3.47Å; A174-E178 PolarHBondContact O-N 2.95Å; K176-E178 PolarHBondContact O-N 2.79Å; E178-Q180 VanDerWaalsContact C-N 3.33Å; E178-Q180 PolarHBondContact O-N 2.88Å; E178-I181 PolarHBondContact O-N 3.23Å; E178-Q182 HydrophobicContact CG-CG 4.42Å; E178-Q182 VanDerWaalsContact CG-NE2 3.31Å; E178-Q182 WeakPolarHBondContact O-CB 3.3Å; E178-Q182 WeakPolarHBondContact O-CG 3.23Å; E178-Q182 PolarHBondContact O-N 3.37Å; E178-Q182 PolarHBondContact OE1-NE2 3.25Å
179	K	54.7	Low	53	Low	143 Å²	143	76.2 Å²	76.2	62%	0.622	44%	0.439	S	S	*	.	H	α-helix	trans	-64.6	-35.1	179.5	-73	169.9	-172.2	172.7	0	112.5	P175 K176 I177 S183	P175-K179 VanDerWaalsContact O-CB 3.3Å; P175-K179 WeakPolarHBondContact O-CB 3.31Å; P175-K179 VanDerWaalsContact O-CD 3.3Å; P175-K179 WeakPolarHBondContact O-CD 3.37Å; P175-K179 WeakPolarHBondContact O-CG 3.42Å; P175-K179 PolarHBondContact O-N 2.88Å; P175-K179 VanDerWaalsContact O-N 3.16Å; K176-K179 PolarHBondContact O-N 3.01Å; I177-K179 PolarHBondContact O-N 3.43Å; K179-S183 VanDerWaalsContact O-CB 3.24Å; K179-S183 WeakPolarHBondContact O-CB 3.14Å; K179-S183 PolarHBondContact O-N 3.33Å; K179-S183 PolarHBondContact O-OG 2.69Å
180	Q	50.4	Low	52.7	Low	82 Å²	82	80 Å²	80	38%	0.383	46%	0.455	S	S	.	.	H	α-helix	trans	-72.9	-34.4	179	-143.9	161.5	0.1	0	0	112.1	K176 I177 E178 S183 K184 I196	K176-Q180 WeakPolarHBondContact O-CB 3.48Å; K176-Q180 PolarHBondContact O-N 3.37Å; I177-Q180 PolarHBondContact O-N 3.48Å; E178-Q180 VanDerWaalsContact C-N 3.33Å; E178-Q180 PolarHBondContact O-N 2.88Å; Q180-S183 WeakPolarHBondContact CA-OG 3.46Å; Q180-S183 PolarHBondContact O-OG 3.48Å; Q180-K184 PolarHBondContact O-N 2.77Å; Q180-I196 HydrophobicContact CB-CG2 4.13Å; Q180-I196 HydrophobicContact CG-CD1 4.28Å; Q180-I196 HydrophobicContact CG-CG1 4.49Å; Q180-I196 HydrophobicContact CG-CG2 3.98Å
181	I	54.7	Low	52.3	Low	54 Å²	54	87.6 Å²	87.6	28%	0.277	47%	0.473	S	S	.	.	H	α-helix	trans	-71	-46.6	171.6	-69.5	171.1	0	0	0	110.8	I177 E178 S183 G185 I188	I177-I181 HydrophobicContact CG2-CD1 3.74Å; I177-I181 HydrophobicContact CG2-CG1 4.49Å; I177-I181 WeakPolarHBondContact O-CB 3.37Å; I177-I181 WeakPolarHBondContact O-CG1 3.4Å; I177-I181 PolarHBondContact O-N 3.34Å; E178-I181 PolarHBondContact O-N 3.23Å; I181-S183 VanDerWaalsContact C-N 3.32Å; I181-S183 PolarHBondContact O-N 3.02Å; I181-G185 PolarHBondContact O-N 2.82Å; I181-I188 HydrophobicContact CG1-CD1 4.38Å; I181-I188 HydrophobicContact CG2-CD1 4.14Å
182	Q	53.2	Low	52	Low	131 Å²	131	84.6 Å²	84.6	61%	0.612	46%	0.459	S	S	*	.	H	α-helix	trans	-67.5	-28	-179.9	-72.5	-179.7	13.8	0	0	113.6	E178	E178-Q182 HydrophobicContact CG-CG 4.42Å; E178-Q182 VanDerWaalsContact CG-NE2 3.31Å; E178-Q182 WeakPolarHBondContact O-CB 3.3Å; E178-Q182 WeakPolarHBondContact O-CG 3.23Å; E178-Q182 PolarHBondContact O-N 3.37Å; E178-Q182 PolarHBondContact OE1-NE2 3.25Å
183	S	53.8	Low	52	Low	96 Å²	96	88 Å²	88	67%	0.671	46%	0.461	S	S	*	.	H	α-helix	trans	-82.2	-32.8	179.5	51.7	0	0	0	0	114.2	K179 Q180 I181	K179-S183 VanDerWaalsContact O-CB 3.24Å; K179-S183 WeakPolarHBondContact O-CB 3.14Å; K179-S183 PolarHBondContact O-N 3.33Å; K179-S183 PolarHBondContact O-OG 2.69Å; Q180-S183 WeakPolarHBondContact CA-OG 3.46Å; Q180-S183 PolarHBondContact O-OG 3.48Å; I181-S183 VanDerWaalsContact C-N 3.32Å; I181-S183 PolarHBondContact O-N 3.02Å
184	K	51.3	Low	52.1	Low	103 Å²	103	91.8 Å²	91.8	45%	0.448	48%	0.475	S	S	.	.	H	α-helix	trans	-77.3	-22	171.3	-74	-163.1	170.8	-172.1	0	113.5	Q180 I188 E192 I196	Q180-K184 PolarHBondContact O-N 2.77Å; K184-I188 HydrophobicContact CB-CG2 3.28Å; K184-I188 HydrophobicContact CD-CG2 3.69Å; K184-I188 HydrophobicContact CG-CG2 4.13Å; K184-E192 IonicContact NZ-OE1 3.89Å; K184-E192 PolarHBondContact NZ-OE1 3.28Å; K184-I196 HydrophobicContact CD-CD1 3.95Å
185	G	48.6	Very low	52.1	Low	22 Å²	22	94.3 Å²	94.3	23%	0.227	48%	0.477	C	S	.	.			trans	77.1	-176.4	174.8	0	0	0	0	0	114.3	I181 G187	I181-G185 PolarHBondContact O-N 2.82Å; G185-G187 PolarHBondContact O-N 3.21Å
186	P	50.3	Low	52.4	Low	150 Å²	150	92.8 Å²	92.8	97%	0.974	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	13.7	-165.5	32.1	-37.6	0	0	0	115.5
187	G	48.1	Very low	52.8	Low	71 Å²	71	91 Å²	91	73%	0.732	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.6	6.7	179.2	0	0	0	0	0	115	G185	G185-G187 PolarHBondContact O-N 3.21Å
188	I	49.8	Very low	52.9	Low	42 Å²	42	93.4 Å²	93.4	22%	0.215	47%	0.471	C	S	.	.			trans	-66	135.6	-177.3	48.9	177.3	0	0	0	113.1	I181 K184 R193	I181-I188 HydrophobicContact CG1-CD1 4.38Å; I181-I188 HydrophobicContact CG2-CD1 4.14Å; K184-I188 HydrophobicContact CB-CG2 3.28Å; K184-I188 HydrophobicContact CD-CG2 3.69Å; K184-I188 HydrophobicContact CG-CG2 4.13Å; I188-R193 HydrophobicContact CD1-CB 4.49Å; I188-R193 HydrophobicContact CD1-CG 4.36Å
189	T	56.8	Low	53	Low	73 Å²	73	93.2 Å²	93.2	45%	0.448	47%	0.473	S	S	.	.			trans	-74	148.4	172.9	63.1	0	0	0	0	111.4	R191 E192 R193	T189-R191 PolarHBondContact O-N 3.44Å; T189-R191 VanDerWaalsContact O-N 3.17Å; T189-E192 PolarHBondContact N-OE2 3.14Å; T189-E192 PolarHBondContact O-N 3.06Å; T189-E192 WeakPolarHBondContact OG1-CG 3.43Å; T189-E192 PolarHBondContact OG1-N 3.22Å; T189-E192 PolarHBondContact OG1-OE2 3.25Å; T189-R193 PolarHBondContact O-N 2.92Å
190	E	55.3	Low	52.9	Low	89 Å²	89	87 Å²	87	42%	0.416	45%	0.448	S	S	.	.	H	α-helix	trans	-58.6	-27.7	175.3	-102.3	-72.7	120.9	0	0	112.6	R193 R194	E190-R193 IonicContact OE1-CZ 3.72Å; E190-R193 IonicContact OE1-NH1 2.64Å; E190-R193 PolarHBondContact OE1-NH1 2.9Å; E190-R194 WeakPolarHBondContact O-CB 3.12Å; E190-R194 WeakPolarHBondContact O-CD 3.36Å; E190-R194 VanDerWaalsContact O-CG 3.22Å; E190-R194 WeakPolarHBondContact O-CG 3.19Å; E190-R194 PolarHBondContact O-N 3.46Å; E190-R194 IonicContact OE2-CZ 3.73Å; E190-R194 VanDerWaalsContact OE2-CZ 3.22Å; E190-R194 IonicContact OE2-NE 2.82Å; E190-R194 PolarHBondContact OE2-NE 2.95Å; E190-R194 IonicContact OE2-NH2 3.53Å; E190-R194 PolarHBondContact OE2-NH2 3.32Å
191	R	51.8	Low	53	Low	206 Å²	206	86.8 Å²	86.8	78%	0.777	45%	0.448	S	S	*	.	H	α-helix	trans	-67.9	-53.6	173.6	-72.1	-175.4	179.9	139.7	1.5	111.9	T189 R193 R194 E195	T189-R191 PolarHBondContact O-N 3.44Å; T189-R191 VanDerWaalsContact O-N 3.17Å; R191-R193 PolarHBondContact O-N 3.49Å; R191-R194 PolarHBondContact O-N 3.32Å; R191-R194 VanDerWaalsContact O-N 3.1Å; R191-E195 WeakPolarHBondContact O-CG 3.34Å; R191-E195 PolarHBondContact O-N 3Å
192	E	52.5	Low	52.5	Low	63 Å²	63	90.5 Å²	90.5	29%	0.294	46%	0.462	S	S	.	.	H	α-helix	trans	-59.5	-35.7	176	-73.9	174.1	92.1	0	0	112.5	K184 T189 E195 I196	K184-E192 IonicContact NZ-OE1 3.89Å; K184-E192 PolarHBondContact NZ-OE1 3.28Å; T189-E192 PolarHBondContact N-OE2 3.14Å; T189-E192 PolarHBondContact O-N 3.06Å; T189-E192 WeakPolarHBondContact OG1-CG 3.43Å; T189-E192 PolarHBondContact OG1-N 3.22Å; T189-E192 PolarHBondContact OG1-OE2 3.25Å; E192-E195 PolarHBondContact O-N 2.93Å; E192-I196 WeakPolarHBondContact O-CB 3.49Å; E192-I196 WeakPolarHBondContact O-CD1 3.36Å; E192-I196 VanDerWaalsContact O-CG1 3.23Å; E192-I196 WeakPolarHBondContact O-CG1 3.47Å; E192-I196 PolarHBondContact O-N 3.01Å
193	R	52.5	Low	52.2	Low	106 Å²	106	90 Å²	90	40%	0.4	46%	0.46	S	S	.	.	H	α-helix	trans	-64.3	-41.7	176.9	-168.7	178.2	178	-140.1	4.3	111.2	I188 T189 E190 R191 I197	I188-R193 HydrophobicContact CD1-CB 4.49Å; I188-R193 HydrophobicContact CD1-CG 4.36Å; T189-R193 PolarHBondContact O-N 2.92Å; E190-R193 IonicContact OE1-CZ 3.72Å; E190-R193 IonicContact OE1-NH1 2.64Å; E190-R193 PolarHBondContact OE1-NH1 2.9Å; R191-R193 PolarHBondContact O-N 3.49Å; R193-I197 HydrophobicContact CG-CD1 4.45Å; R193-I197 WeakPolarHBondContact O-CD1 3.47Å; R193-I197 VanDerWaalsContact O-CG1 3.28Å; R193-I197 WeakPolarHBondContact O-CG1 3.48Å; R193-I197 PolarHBondContact O-N 2.88Å; R193-I197 VanDerWaalsContact O-N 3.14Å
194	R	54.1	Low	52.1	Low	139 Å²	139	88.9 Å²	88.9	53%	0.525	44%	0.442	S	S	.	.	H	α-helix	trans	-68	-41.6	173.3	-71.1	169.2	-165.5	-129.1	0.3	112.2	E190 R191 I196 I197 E198	E190-R194 WeakPolarHBondContact O-CB 3.12Å; E190-R194 WeakPolarHBondContact O-CD 3.36Å; E190-R194 VanDerWaalsContact O-CG 3.22Å; E190-R194 WeakPolarHBondContact O-CG 3.19Å; E190-R194 PolarHBondContact O-N 3.46Å; E190-R194 IonicContact OE2-CZ 3.73Å; E190-R194 VanDerWaalsContact OE2-CZ 3.22Å; E190-R194 IonicContact OE2-NE 2.82Å; E190-R194 PolarHBondContact OE2-NE 2.95Å; E190-R194 IonicContact OE2-NH2 3.53Å; E190-R194 PolarHBondContact OE2-NH2 3.32Å; R191-R194 PolarHBondContact O-N 3.32Å; R191-R194 VanDerWaalsContact O-N 3.1Å; R194-I196 PolarHBondContact O-N 3.13Å; R194-I197 PolarHBondContact O-N 3.17Å; R194-E198 WeakPolarHBondContact O-CB 3.28Å; R194-E198 PolarHBondContact O-N 2.86Å
195	E	55	Low	52.2	Low	115 Å²	115	85 Å²	85	54%	0.537	43%	0.428	S	S	.	.	H	α-helix	trans	-64.3	-36.3	175.8	-72.7	176	171.1	0	0	112.9	R191 E192 E198 N199	R191-E195 WeakPolarHBondContact O-CG 3.34Å; R191-E195 PolarHBondContact O-N 3Å; E192-E195 PolarHBondContact O-N 2.93Å; E195-E198 PolarHBondContact O-N 2.96Å; E195-N199 WeakPolarHBondContact O-CB 3.48Å; E195-N199 PolarHBondContact O-N 3.21Å
196	I	53.8	Low	52.4	Low	16 Å²	16	88.4 Å²	88.4	8%	0.082	45%	0.446	C	S	.	.	H	α-helix	trans	-64.4	-44.6	172.8	-76.3	164.6	0	0	0	110.6	Q180 K184 E192 R194 A200	Q180-I196 HydrophobicContact CB-CG2 4.13Å; Q180-I196 HydrophobicContact CG-CD1 4.28Å; Q180-I196 HydrophobicContact CG-CG1 4.49Å; Q180-I196 HydrophobicContact CG-CG2 3.98Å; K184-I196 HydrophobicContact CD-CD1 3.95Å; E192-I196 WeakPolarHBondContact O-CB 3.49Å; E192-I196 WeakPolarHBondContact O-CD1 3.36Å; E192-I196 VanDerWaalsContact O-CG1 3.23Å; E192-I196 WeakPolarHBondContact O-CG1 3.47Å; E192-I196 PolarHBondContact O-N 3.01Å; R194-I196 PolarHBondContact O-N 3.13Å; I196-A200 WeakPolarHBondContact O-CB 3.46Å; I196-A200 PolarHBondContact O-N 2.82Å
197	I	56.2	Low	52.7	Low	61 Å²	61	84.8 Å²	84.8	31%	0.313	42%	0.416	S	S	.	.	H	α-helix	trans	-64.3	-44.4	175.9	-67.9	164.3	0	0	0	110.4	R193 R194 N199 A200 E201	R193-I197 HydrophobicContact CG-CD1 4.45Å; R193-I197 WeakPolarHBondContact O-CD1 3.47Å; R193-I197 VanDerWaalsContact O-CG1 3.28Å; R193-I197 WeakPolarHBondContact O-CG1 3.48Å; R193-I197 PolarHBondContact O-N 2.88Å; R193-I197 VanDerWaalsContact O-N 3.14Å; R194-I197 PolarHBondContact O-N 3.17Å; I197-N199 PolarHBondContact O-N 2.8Å; I197-A200 CarbonylContact O-C 3.56Å; I197-A200 PolarHBondContact O-N 2.94Å; I197-E201 PolarHBondContact O-N 3.25Å
198	E	55.1	Low	53.2	Low	95 Å²	95	82.1 Å²	82.1	44%	0.444	39%	0.385	S	S	.	.	H	α-helix	trans	-67.2	-36.2	179.6	-157.3	-161.3	137.6	0	0	112.3	R194 E195 E201 K202	R194-E198 WeakPolarHBondContact O-CB 3.28Å; R194-E198 PolarHBondContact O-N 2.86Å; E195-E198 PolarHBondContact O-N 2.96Å; E198-E201 PolarHBondContact O-N 2.99Å; E198-K202 WeakPolarHBondContact O-CB 3.23Å; E198-K202 VanDerWaalsContact O-CG 3.32Å; E198-K202 WeakPolarHBondContact O-CG 3.24Å; E198-K202 PolarHBondContact O-N 2.84Å; E198-K202 WeakPolarHBondContact OE1-CE 3.44Å; E198-K202 IonicContact OE1-NZ 3.55Å; E198-K202 PolarHBondContact OE1-NZ 2.88Å
199	N	54.7	Low	54	Low	100 Å²	100	83 Å²	83	54%	0.535	39%	0.39	S	S	.	.	H	α-helix	trans	-70	-37.5	172.1	-85.3	-25.8	0	0	0	112.1	E195 I197 E201 K202 E203	E195-N199 WeakPolarHBondContact O-CB 3.48Å; E195-N199 PolarHBondContact O-N 3.21Å; I197-N199 PolarHBondContact O-N 2.8Å; N199-E201 VanDerWaalsContact C-N 3.27Å; N199-E201 PolarHBondContact O-N 3.43Å; N199-K202 PolarHBondContact O-N 2.91Å; N199-E203 WeakPolarHBondContact O-CB 3.41Å; N199-E203 PolarHBondContact O-N 2.69Å
200	A	52.4	Low	54.4	Low	13 Å²	13	85.1 Å²	85.1	11%	0.107	40%	0.398	C	S	.	.	H	α-helix	trans	-67.5	-25.3	171.9	0	0	0	0	0	113	I177 I196 I197	I177-A200 HydrophobicContact CG1-CB 4.34Å; I196-A200 WeakPolarHBondContact O-CB 3.46Å; I196-A200 PolarHBondContact O-N 2.82Å; I197-A200 CarbonylContact O-C 3.56Å; I197-A200 PolarHBondContact O-N 2.94Å
201	E	52.2	Low	55.1	Low	78 Å²	78	81.1 Å²	81.1	36%	0.364	38%	0.379	S	S	.	.	H	α-helix	trans	-77.4	-33.5	167.5	-78.5	-171.2	-153.1	0	0	113.4	I197 E198 N199 K332	I197-E201 PolarHBondContact O-N 3.25Å; E198-E201 PolarHBondContact O-N 2.99Å; N199-E201 VanDerWaalsContact C-N 3.27Å; N199-E201 PolarHBondContact O-N 3.43Å; E201-K332 IonicContact OE2-NZ 4Å; E201-K332 PolarHBondContact OE2-NZ 3.22Å
202	K	44.3	Very low	55.9	Low	131 Å²	131	72.7 Å²	72.7	57%	0.57	35%	0.349	S	S	*	.	H	α-helix	trans	-74.3	-29.7	177.4	-81.5	163.2	163.4	162.8	0	112.6	E198 N199 K204	E198-K202 WeakPolarHBondContact O-CB 3.23Å; E198-K202 VanDerWaalsContact O-CG 3.32Å; E198-K202 WeakPolarHBondContact O-CG 3.24Å; E198-K202 PolarHBondContact O-N 2.84Å; E198-K202 WeakPolarHBondContact OE1-CE 3.44Å; E198-K202 IonicContact OE1-NZ 3.55Å; E198-K202 PolarHBondContact OE1-NZ 2.88Å; N199-K202 PolarHBondContact O-N 2.91Å; K202-K204 PolarHBondContact O-N 3.04Å
203	E	47.6	Very low	56.8	Low	122 Å²	122	75 Å²	75	57%	0.57	36%	0.358	S	S	*	.	S	Bend	trans	-73.7	58.9	175.9	-159	-171.5	-172.7	0	0	111.7	K176 N199 S205	K176-E203 IonicContact NZ-OE1 2.62Å; K176-E203 PolarHBondContact NZ-OE1 2.85Å; K176-E203 IonicContact NZ-OE2 3.58Å; K176-E203 PolarHBondContact NZ-OE2 2.89Å; N199-E203 WeakPolarHBondContact O-CB 3.41Å; N199-E203 PolarHBondContact O-N 2.69Å; E203-S205 PolarHBondContact O-N 3.44Å
204	K	51.3	Low	57.7	Low	72 Å²	72	72.3 Å²	72.3	31%	0.313	35%	0.348	S	S	.	.			trans	-52.7	126.6	174.8	-80.4	-171.3	171.1	-175.7	0	110	K202 E212	K202-K204 PolarHBondContact O-N 3.04Å; K204-E212 IonicContact NZ-OE1 2.75Å; K204-E212 PolarHBondContact NZ-OE1 3.12Å; K204-E212 IonicContact NZ-OE2 3.14Å; K204-E212 PolarHBondContact NZ-OE2 2.82Å
205	S	54	Low	58.4	Low	21 Å²	21	65.8 Å²	65.8	15%	0.147	32%	0.324	C	S	.	.			trans	-65.3	150.3	175.2	73.6	0	0	0	0	110.9	E203 E207 Q208 N209	E203-S205 PolarHBondContact O-N 3.44Å; S205-E207 VanDerWaalsContact C-N 3.28Å; S205-E207 PolarHBondContact O-N 3.29Å; S205-Q208 PolarHBondContact O-N 3.41Å; S205-Q208 VanDerWaalsContact O-N 3.15Å; S205-Q208 WeakPolarHBondContact OG-CB 3.44Å; S205-Q208 VanDerWaalsContact OG-CG 3.26Å; S205-Q208 WeakPolarHBondContact OG-CG 3.32Å; S205-Q208 PolarHBondContact OG-N 2.85Å; S205-N209 PolarHBondContact O-N 3.47Å
206	P	52.1	Low	59.2	Low	94 Å²	94	65.7 Å²	65.7	61%	0.61	32%	0.323	S	S	*	.	H	α-helix	trans	-62.2	-32.8	-176	22.4	-32.9	0	0	0	113.2	N209 L210	P206-N209 WeakPolarHBondContact O-CB 3.46Å; P206-N209 PolarHBondContact O-N 3.45Å; P206-L210 PolarHBondContact O-N 3.49Å; P206-L210 VanDerWaalsContact O-N 3.15Å
207	E	56.9	Low	60	Low	73 Å²	73	73.9 Å²	73.9	34%	0.341	35%	0.353	S	S	.	.	H	α-helix	trans	-73.9	-36.1	173.8	-73.2	128.8	-108.7	0	0	112.9	R168 S205 N209 L210 F211	R168-E207 IonicContact CZ-OE1 3.75Å; R168-E207 IonicContact CZ-OE2 3.72Å; R168-E207 IonicContact NH1-OE1 2.62Å; R168-E207 PolarHBondContact NH1-OE1 3.33Å; R168-E207 IonicContact NH1-OE2 2.66Å; R168-E207 PolarHBondContact NH1-OE2 2.98Å; R168-E207 IonicContact NH2-OE1 2.69Å; S205-E207 VanDerWaalsContact C-N 3.28Å; S205-E207 PolarHBondContact O-N 3.29Å; E207-N209 PolarHBondContact O-N 3.27Å; E207-L210 CarbonylContact O-C 3.58Å; E207-L210 WeakPolarHBondContact O-CA 3.47Å; E207-L210 WeakPolarHBondContact O-CB 3.37Å; E207-L210 PolarHBondContact O-N 3.06Å; E207-F211 PolarHBondContact O-N 3.36Å
208	Q	59.8	Low	60.5	Low	16 Å²	16	72.9 Å²	72.9	8%	0.075	35%	0.345	C	S	.	.	H	α-helix	trans	-60	-34.3	173.1	-78.8	175.3	-2.5	0	0	111.5	S205 E212	S205-Q208 PolarHBondContact O-N 3.41Å; S205-Q208 VanDerWaalsContact O-N 3.15Å; S205-Q208 WeakPolarHBondContact OG-CB 3.44Å; S205-Q208 VanDerWaalsContact OG-CG 3.26Å; S205-Q208 WeakPolarHBondContact OG-CG 3.32Å; S205-Q208 PolarHBondContact OG-N 2.85Å; Q208-E212 VanDerWaalsContact O-CB 3.23Å; Q208-E212 WeakPolarHBondContact O-CB 3.25Å; Q208-E212 PolarHBondContact O-N 3.25Å
209	N	65.3	Low	61	Low	61 Å²	61	68.6 Å²	68.6	33%	0.326	33%	0.327	S	S	.	.	H	α-helix	trans	-70.2	-32.5	172.7	-165.7	-40.8	0	0	0	112.3	S205 P206 E207 K213	S205-N209 PolarHBondContact O-N 3.47Å; P206-N209 WeakPolarHBondContact O-CB 3.46Å; P206-N209 PolarHBondContact O-N 3.45Å; E207-N209 PolarHBondContact O-N 3.27Å; N209-K213 WeakPolarHBondContact O-CB 3.35Å; N209-K213 WeakPolarHBondContact O-CD 3.39Å; N209-K213 WeakPolarHBondContact O-CG 3.26Å; N209-K213 PolarHBondContact O-N 2.86Å; N209-K213 VanDerWaalsContact O-N 3.14Å; N209-K213 WeakPolarHBondContact OD1-CE 3.18Å; N209-K213 PolarHBondContact OD1-NZ 3.29Å
210	L	66.5	Low	61.5	Low	117 Å²	117	70.1 Å²	70.1	61%	0.613	33%	0.331	S	S	*	.	H	α-helix	trans	-71.1	-45.4	174.6	-175	63.8	0	0	0	111.9	P206 E207 K213 Y214	P206-L210 PolarHBondContact O-N 3.49Å; P206-L210 VanDerWaalsContact O-N 3.15Å; E207-L210 CarbonylContact O-C 3.58Å; E207-L210 WeakPolarHBondContact O-CA 3.47Å; E207-L210 WeakPolarHBondContact O-CB 3.37Å; E207-L210 PolarHBondContact O-N 3.06Å; L210-K213 PolarHBondContact O-N 3.37Å; L210-Y214 PolarHBondContact O-N 3.09Å
211	F	68.9	Low	62.6	Low	4 Å²	4	71.1 Å²	71.1	2%	0.018	34%	0.337	C	S	.	.	H	α-helix	trans	-64.8	-41.2	175.9	-177.7	-119.1	0	0	0	111.7	L158 E161 I162 E207 K213 Y214 L215 I331	L158-F211 HydrophobicContact CG-CE2 4.32Å; L158-F211 HydrophobicContact CG-CZ 4.48Å; E161-F211 HydrophobicContact CB-CD2 4.14Å; E161-F211 HydrophobicContact CB-CE2 4.28Å; E161-F211 HydrophobicContact CG-CB 4.1Å; E161-F211 HydrophobicContact CG-CD2 3.46Å; E161-F211 VanDerWaalsContact CG-CD2 3.46Å; E161-F211 HydrophobicContact CG-CE2 4.08Å; E161-F211 HydrophobicContact CG-CG 3.92Å; I162-F211 HydrophobicContact CD1-CZ 4.16Å; I162-F211 HydrophobicContact CG1-CE1 4Å; I162-F211 HydrophobicContact CG1-CE2 4.35Å; I162-F211 HydrophobicContact CG1-CZ 3.5Å; I162-F211 VanDerWaalsContact CG1-CZ 3.5Å; E207-F211 PolarHBondContact O-N 3.36Å; F211-K213 VanDerWaalsContact C-N 3.34Å; F211-K213 PolarHBondContact O-N 3.38Å; F211-Y214 HydrophobicContact CD2-CD1 4.4Å; F211-Y214 HydrophobicContact CE2-CD1 4.41Å; F211-Y214 WeakPolarHBondContact O-CB 3.47Å; F211-Y214 PolarHBondContact O-N 3.25Å; F211-Y214 VanDerWaalsContact O-N 3.15Å; F211-L215 HydrophobicContact CD1-CD1 4.07Å; F211-L215 HydrophobicContact CD2-CG 4.47Å; F211-L215 HydrophobicContact CE1-CD1 3.58Å; F211-L215 HydrophobicContact CE1-CG 4.17Å; F211-L215 HydrophobicContact CE2-CD1 4.43Å; F211-L215 HydrophobicContact CE2-CD2 4.14Å; F211-L215 HydrophobicContact CE2-CG 4.13Å; F211-L215 HydrophobicContact CZ-CD1 3.78Å; F211-L215 HydrophobicContact CZ-CD2 3.98Å; F211-L215 HydrophobicContact CZ-CG 3.96Å; F211-L215 WeakPolarHBondContact O-CG 3.34Å; F211-L215 PolarHBondContact O-N 3.03Å; F211-I331 HydrophobicContact CD1-CD1 3.91Å; F211-I331 HydrophobicContact CE1-CD1 3.88Å
212	E	68.9	Low	63.9	Low	29 Å²	29	70 Å²	70	14%	0.136	33%	0.333	C	S	.	.	H	α-helix	trans	-58.7	-42.2	173	-174.5	175.3	-159.2	0	0	112.1	K204 Q208 L215 E216 I331	K204-E212 IonicContact NZ-OE1 2.75Å; K204-E212 PolarHBondContact NZ-OE1 3.12Å; K204-E212 IonicContact NZ-OE2 3.14Å; K204-E212 PolarHBondContact NZ-OE2 2.82Å; Q208-E212 VanDerWaalsContact O-CB 3.23Å; Q208-E212 WeakPolarHBondContact O-CB 3.25Å; Q208-E212 PolarHBondContact O-N 3.25Å; E212-L215 PolarHBondContact O-N 3.49Å; E212-E216 WeakPolarHBondContact O-CB 3.42Å; E212-E216 PolarHBondContact O-N 3.46Å; E212-I331 HydrophobicContact CB-CG2 4.37Å; E212-I331 HydrophobicContact CG-CG2 4.41Å
213	K	70.6	Confident	65.8	Low	113 Å²	113	69.7 Å²	69.7	49%	0.491	33%	0.332	S	S	.	.	H	α-helix	trans	-69.5	-32.4	173.7	-77.4	167.2	176.4	154.4	0	113.7	N209 L210 F211 R217	N209-K213 WeakPolarHBondContact O-CB 3.35Å; N209-K213 WeakPolarHBondContact O-CD 3.39Å; N209-K213 WeakPolarHBondContact O-CG 3.26Å; N209-K213 PolarHBondContact O-N 2.86Å; N209-K213 VanDerWaalsContact O-N 3.14Å; N209-K213 WeakPolarHBondContact OD1-CE 3.18Å; N209-K213 PolarHBondContact OD1-NZ 3.29Å; L210-K213 PolarHBondContact O-N 3.37Å; F211-K213 VanDerWaalsContact C-N 3.34Å; F211-K213 PolarHBondContact O-N 3.38Å; K213-R217 VanDerWaalsContact O-CB 3.31Å; K213-R217 WeakPolarHBondContact O-CB 3.37Å; K213-R217 PolarHBondContact O-N 2.91Å
214	Y	71.8	Confident	67.5	Low	49 Å²	49	64.4 Å²	64.4	19%	0.192	31%	0.308	C	S	.	.	H	α-helix	trans	-64.2	-49.4	172.1	173.2	-91.1	0	0	0	110.2	F157 L158 L210 F211 E216 R217 R218	F157-Y214 HydrophobicContact CD1-CE1 4.31Å; F157-Y214 HydrophobicContact CD1-CE2 4.01Å; F157-Y214 AromaticContact CD1-CZ 3.83Å; F157-Y214 HydrophobicContact CE1-CD1 4.29Å; F157-Y214 AromaticContact CE1-CD2 3.88Å; F157-Y214 HydrophobicContact CE1-CD2 3.88Å; F157-Y214 HydrophobicContact CE1-CE1 4.12Å; F157-Y214 AromaticContact CE1-CE2 3.67Å; F157-Y214 HydrophobicContact CE1-CE2 3.67Å; F157-Y214 HydrophobicContact CE1-CG 4.19Å; F157-Y214 AromaticContact CE1-CZ 3.8Å; L158-Y214 HydrophobicContact CD1-CE1 4.37Å; L210-Y214 PolarHBondContact O-N 3.09Å; F211-Y214 HydrophobicContact CD2-CD1 4.4Å; F211-Y214 HydrophobicContact CE2-CD1 4.41Å; F211-Y214 WeakPolarHBondContact O-CB 3.47Å; F211-Y214 PolarHBondContact O-N 3.25Å; F211-Y214 VanDerWaalsContact O-N 3.15Å; Y214-E216 PolarHBondContact O-N 2.83Å; Y214-R217 PolarHBondContact O-N 2.88Å; Y214-R218 HydrophobicContact CD1-CG 4.32Å; Y214-R218 HydrophobicContact CD2-CG 4.42Å; Y214-R218 HydrophobicContact CE1-CG 3.98Å; Y214-R218 HydrophobicContact CE2-CG 4.11Å; Y214-R218 WeakPolarHBondContact O-CB 3.45Å; Y214-R218 VanDerWaalsContact O-CG 3.25Å; Y214-R218 WeakPolarHBondContact O-CG 3.03Å; Y214-R218 PolarHBondContact O-N 3.24Å
215	L	69.6	Low	68.9	Low	2 Å²	2	61.1 Å²	61.1	1%	0.01	29%	0.294	C	S	.	.	H	α-helix	trans	-60.6	-42	175.5	-68.4	-178.6	0	0	0	112.1	L158 F211 E212 R218 G219 F323 W337 I345	L158-L215 HydrophobicContact CD1-CD2 4.05Å; F211-L215 HydrophobicContact CD1-CD1 4.07Å; F211-L215 HydrophobicContact CD2-CG 4.47Å; F211-L215 HydrophobicContact CE1-CD1 3.58Å; F211-L215 HydrophobicContact CE1-CG 4.17Å; F211-L215 HydrophobicContact CE2-CD1 4.43Å; F211-L215 HydrophobicContact CE2-CD2 4.14Å; F211-L215 HydrophobicContact CE2-CG 4.13Å; F211-L215 HydrophobicContact CZ-CD1 3.78Å; F211-L215 HydrophobicContact CZ-CD2 3.98Å; F211-L215 HydrophobicContact CZ-CG 3.96Å; F211-L215 WeakPolarHBondContact O-CG 3.34Å; F211-L215 PolarHBondContact O-N 3.03Å; E212-L215 PolarHBondContact O-N 3.49Å; L215-R218 CarbonylContact O-C 3.6Å; L215-R218 PolarHBondContact O-N 2.96Å; L215-G219 PolarHBondContact O-N 3.03Å; L215-F323 HydrophobicContact CD1-CE1 4.21Å; L215-F323 HydrophobicContact CD2-CE1 4.03Å; L215-F323 HydrophobicContact CD2-CZ 4.28Å; L215-W337 HydrophobicContact CB-CH2 4.15Å; L215-I345 HydrophobicContact CD2-CD1 3.97Å
216	E	71.5	Confident	70.4	Confident	113 Å²	113	67 Å²	67	53%	0.528	32%	0.317	S	S	.	.	H	α-helix	trans	-61	-48.1	175.2	-177.5	175	-145.6	0	0	111.8	E212 Y214 R218 G219 Q220	E212-E216 WeakPolarHBondContact O-CB 3.42Å; E212-E216 PolarHBondContact O-N 3.46Å; Y214-E216 PolarHBondContact O-N 2.83Å; E216-R218 VanDerWaalsContact C-N 3.33Å; E216-R218 PolarHBondContact O-N 3.28Å; E216-G219 PolarHBondContact O-N 2.88Å; E216-Q220 WeakPolarHBondContact O-CG 3.29Å; E216-Q220 PolarHBondContact O-N 3.35Å
217	R	70.6	Confident	72.1	Confident	188 Å²	188	64.7 Å²	64.7	71%	0.709	30%	0.299	S	S	*	.	H	α-helix	trans	-62.4	-37.7	177.4	-176.1	179.3	-69.6	162.8	-2.3	112.2	K213 Y214 Q220 S221	K213-R217 VanDerWaalsContact O-CB 3.31Å; K213-R217 WeakPolarHBondContact O-CB 3.37Å; K213-R217 PolarHBondContact O-N 2.91Å; Y214-R217 PolarHBondContact O-N 2.88Å; R217-Q220 PolarHBondContact O-N 2.68Å; R217-S221 PolarHBondContact O-N 2.87Å
218	R	67.6	Low	73.5	Confident	39 Å²	39	61.2 Å²	61.2	15%	0.147	28%	0.283	C	S	.	.	H	α-helix	trans	-79.6	-18.1	177.1	-64.6	-67.1	-66.5	-147.4	-8.4	113.4	E154 Y214 L215 E216 Q220 S221	E154-R218 VanDerWaalsContact CD-NH1 3.34Å; E154-R218 IonicContact OE1-CZ 2.81Å; E154-R218 IonicContact OE1-NH1 2.66Å; E154-R218 PolarHBondContact OE1-NH1 3.43Å; E154-R218 IonicContact OE1-NH2 2.66Å; E154-R218 PolarHBondContact OE1-NH2 3.39Å; E154-R218 IonicContact OE2-CZ 3.4Å; E154-R218 IonicContact OE2-NH1 2.78Å; E154-R218 IonicContact OE2-NH2 2.95Å; E154-R218 PolarHBondContact OE2-NH2 3.24Å; Y214-R218 HydrophobicContact CD1-CG 4.32Å; Y214-R218 HydrophobicContact CD2-CG 4.42Å; Y214-R218 HydrophobicContact CE1-CG 3.98Å; Y214-R218 HydrophobicContact CE2-CG 4.11Å; Y214-R218 WeakPolarHBondContact O-CB 3.45Å; Y214-R218 VanDerWaalsContact O-CG 3.25Å; Y214-R218 WeakPolarHBondContact O-CG 3.03Å; Y214-R218 PolarHBondContact O-N 3.24Å; L215-R218 CarbonylContact O-C 3.6Å; L215-R218 PolarHBondContact O-N 2.96Å; E216-R218 VanDerWaalsContact C-N 3.33Å; E216-R218 PolarHBondContact O-N 3.28Å; R218-Q220 VanDerWaalsContact C-N 3.28Å; R218-S221 PolarHBondContact O-OG 3.15Å
219	G	65.1	Low	74.8	Confident	6 Å²	6	62.4 Å²	62.4	6%	0.062	29%	0.289	C	S	.	.	H	α-helix	trans	-71.3	-21.9	165.1	0	0	0	0	0	113.7	L215 E216 C343	L215-G219 PolarHBondContact O-N 3.03Å; E216-G219 PolarHBondContact O-N 2.88Å; G219-C343 PolarHBondContact O-SG 3.28Å
220	Q	65.3	Low	76	Confident	131 Å²	131	62.1 Å²	62.1	61%	0.612	30%	0.295	S	S	*	.	H	α-helix	trans	-91.7	-16.2	177.7	-64.6	172.2	13.2	0	0	112.9	E216 R217 R218 N222	E216-Q220 WeakPolarHBondContact O-CG 3.29Å; E216-Q220 PolarHBondContact O-N 3.35Å; R217-Q220 PolarHBondContact O-N 2.68Å; R218-Q220 VanDerWaalsContact C-N 3.28Å; Q220-N222 PolarHBondContact O-ND2 3.48Å
221	S	75.4	Confident	77.1	Confident	34 Å²	34	57.2 Å²	57.2	24%	0.238	27%	0.269	C	S	.	.			trans	-83.5	147.6	174.5	68.8	0	0	0	0	111.9	R217 R218 D344	R217-S221 PolarHBondContact O-N 2.87Å; R218-S221 PolarHBondContact O-OG 3.15Å; S221-D344 VanDerWaalsContact C-CG 3.42Å; S221-D344 WeakPolarHBondContact CB-OD2 3.34Å; S221-D344 VanDerWaalsContact O-CG 3.22Å; S221-D344 PolarHBondContact O-N 3.09Å; S221-D344 PolarHBondContact OG-OD2 3.08Å
222	N	79.4	Confident	78.2	Confident	54 Å²	54	57.1 Å²	57.1	29%	0.289	27%	0.268	S	S	.	.			trans	-135.1	28.7	-177.5	-50.3	-104.9	0	0	0	109.8	Q220 K226 F342 D344	Q220-N222 PolarHBondContact O-ND2 3.48Å; N222-K226 WeakPolarHBondContact O-CB 3.34Å; N222-K226 VanDerWaalsContact O-CD 3.28Å; N222-K226 WeakPolarHBondContact O-CD 3.35Å; N222-K226 WeakPolarHBondContact O-CG 3.3Å; N222-K226 PolarHBondContact O-N 3.16Å; N222-F342 PolarHBondContact OD1-O 2.92Å; N222-F342 VanDerWaalsContact OD1-O 3.12Å; N222-D344 VanDerWaalsContact CA-OD1 3.22Å; N222-D344 WeakPolarHBondContact CA-OD1 3.43Å; N222-D344 PolarHBondContact N-OD2 3.31Å
223	F	83.4	Confident	79.2	Confident	125 Å²	125	59.7 Å²	59.7	55%	0.548	28%	0.283	S	S	.	.	H	α-helix	trans	-86.6	-50.4	-173.7	179.3	-103.3	0	0	0	111.7	A225 K226 I227 D344	F223-A225 VanDerWaalsContact C-N 3.35Å; F223-K226 PolarHBondContact O-N 3.3Å; F223-I227 HydrophobicContact CD1-CD1 4.05Å; F223-I227 HydrophobicContact CE1-CD1 3.5Å; F223-I227 VanDerWaalsContact CE1-CD1 3.5Å; F223-I227 HydrophobicContact CE2-CD1 4.11Å; F223-I227 HydrophobicContact CZ-CD1 3.54Å; F223-I227 WeakPolarHBondContact O-CG1 3.27Å; F223-I227 PolarHBondContact O-N 2.91Å; F223-D344 VanDerWaalsContact N-CG 3.3Å; F223-D344 PolarHBondContact N-OD1 3.23Å; F223-D344 PolarHBondContact N-OD2 2.9Å
224	L	82.5	Confident	80.3	Confident	12 Å²	12	56.1 Å²	56.1	6%	0.063	27%	0.274	C	S	.	.	H	α-helix	trans	-64.4	-40.5	176.4	-177.4	65.2	0	0	0	111.1	W143 L151 K226 I227 Y228 D344 I347	W143-L224 HydrophobicContact CH2-CD1 4.23Å; L151-L224 HydrophobicContact CD1-CD2 4.04Å; L224-K226 PolarHBondContact O-N 3.06Å; L224-I227 PolarHBondContact O-N 2.87Å; L224-Y228 WeakPolarHBondContact O-CB 3.5Å; L224-Y228 PolarHBondContact O-N 3.21Å; L224-D344 WeakPolarHBondContact CA-OD1 3.49Å; L224-D344 HydrophobicContact CB-CB 4.17Å; L224-D344 PolarHBondContact N-OD1 3.33Å; L224-D344 PolarHBondContact N-OD2 3.35Å; L224-I347 HydrophobicContact CD2-CB 4.43Å; L224-I347 HydrophobicContact CD2-CG2 4.13Å; L224-I347 HydrophobicContact CG-CG2 4.21Å
225	A	82.1	Confident	81.3	Confident	2 Å²	2	54 Å²	54	2%	0.017	27%	0.266	C	S	.	.	H	α-helix	trans	-62.7	-39.3	175	0	0	0	0	0	112.3	F223 L229 F342 D344 I347	F223-A225 VanDerWaalsContact C-N 3.35Å; A225-L229 VanDerWaalsContact O-CB 3.23Å; A225-L229 WeakPolarHBondContact O-CB 3.07Å; A225-L229 PolarHBondContact O-N 2.74Å; A225-F342 WeakPolarHBondContact CB-O 3.44Å; A225-D344 WeakPolarHBondContact CB-OD1 3.37Å; A225-D344 PolarHBondContact N-OD1 2.84Å; A225-I347 HydrophobicContact CB-CG1 4.16Å
226	K	85.6	Confident	82.4	Confident	146 Å²	146	55.7 Å²	55.7	64%	0.635	27%	0.274	S	S	*	.	H	α-helix	trans	-66	-40.9	173.2	-81.2	175.8	-175.3	-175	0	112.5	N222 F223 L224 A230	N222-K226 WeakPolarHBondContact O-CB 3.34Å; N222-K226 VanDerWaalsContact O-CD 3.28Å; N222-K226 WeakPolarHBondContact O-CD 3.35Å; N222-K226 WeakPolarHBondContact O-CG 3.3Å; N222-K226 PolarHBondContact O-N 3.16Å; F223-K226 PolarHBondContact O-N 3.3Å; L224-K226 PolarHBondContact O-N 3.06Å; K226-A230 WeakPolarHBondContact O-CB 3.19Å; K226-A230 PolarHBondContact O-N 3.01Å
227	I	87.2	Confident	83.4	Confident	45 Å²	45	54.3 Å²	54.3	23%	0.231	28%	0.276	C	S	.	.	H	α-helix	trans	-68	-43.1	177.4	-66.4	174.3	0	0	0	111.1	W143 A147 F223 L224 A230 R231	W143-I227 HydrophobicContact CE3-CG2 4.24Å; W143-I227 HydrophobicContact CZ3-CG2 3.99Å; A147-I227 HydrophobicContact CB-CG2 4.2Å; F223-I227 HydrophobicContact CD1-CD1 4.05Å; F223-I227 HydrophobicContact CE1-CD1 3.5Å; F223-I227 VanDerWaalsContact CE1-CD1 3.5Å; F223-I227 HydrophobicContact CE2-CD1 4.11Å; F223-I227 HydrophobicContact CZ-CD1 3.54Å; F223-I227 WeakPolarHBondContact O-CG1 3.27Å; F223-I227 PolarHBondContact O-N 2.91Å; L224-I227 PolarHBondContact O-N 2.87Å; I227-A230 PolarHBondContact O-N 2.95Å; I227-R231 PolarHBondContact O-N 3.38Å
228	Y	86.6	Confident	84.5	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-63.8	-41.6	177.3	-173.7	-95.8	0	0	0	112.3	L49 D52 W143 L224 H232 L313 I347	L49-Y228 HydrophobicContact CD2-CE2 4.13Å; L49-Y228 WeakPolarHBondContact CD2-OH 3.19Å; D52-Y228 PolarHBondContact OD1-OH 2.77Å; D52-Y228 WeakPolarHBondContact OD2-CE2 3.33Å; W143-Y228 AromaticContact CH2-CD2 3.85Å; W143-Y228 HydrophobicContact CH2-CD2 3.85Å; W143-Y228 HydrophobicContact CZ3-CD2 4.03Å; L224-Y228 WeakPolarHBondContact O-CB 3.5Å; L224-Y228 PolarHBondContact O-N 3.21Å; Y228-H232 AromaticContact CE1-CE1 3.74Å; Y228-H232 AromaticContact CE1-ND1 3.71Å; Y228-H232 AromaticContact CE2-CE1 3.42Å; Y228-H232 VanDerWaalsContact CE2-CE1 3.42Å; Y228-H232 WeakPolarHBondContact CE2-CE1 3.39Å; Y228-H232 AromaticContact CE2-ND1 3.94Å; Y228-H232 AromaticContact CZ-CE1 3.2Å; Y228-H232 AromaticContact CZ-ND1 3.66Å; Y228-H232 PolarHBondContact O-N 3.35Å; Y228-H232 PolarHBondContact O-ND1 3.16Å; Y228-H232 PolarHBondContact OH-CE1 2.69Å; Y228-H232 VanDerWaalsContact OH-CE1 3.25Å; Y228-L313 HydrophobicContact CE1-CD1 3.91Å; Y228-I347 HydrophobicContact CD1-CD1 3.81Å; Y228-I347 HydrophobicContact CE1-CD1 4.35Å; Y228-I347 HydrophobicContact CG-CD1 4.25Å; Y228-I347 HydrophobicContact CG-CG2 4.43Å
229	L	87.6	Confident	85.8	Confident	40 Å²	40	45.9 Å²	45.9	21%	0.209	25%	0.248	C	C	.	.	H	α-helix	trans	-63.7	-44.2	172	177.5	61.3	0	0	0	111.4	A225 R231 H232 L233 L310 F314 F342	A225-L229 VanDerWaalsContact O-CB 3.23Å; A225-L229 WeakPolarHBondContact O-CB 3.07Å; A225-L229 PolarHBondContact O-N 2.74Å; L229-R231 PolarHBondContact O-N 3.31Å; L229-H232 PolarHBondContact O-N 3.23Å; L229-L233 HydrophobicContact CD1-CD1 3.82Å; L229-L233 HydrophobicContact CD1-CD2 4.41Å; L229-L233 HydrophobicContact CD1-CG 3.84Å; L229-L233 HydrophobicContact CD2-CD1 4.39Å; L229-L233 HydrophobicContact CG-CD1 3.77Å; L229-L233 HydrophobicContact CG-CG 4.19Å; L229-L233 WeakPolarHBondContact O-CB 3.28Å; L229-L233 WeakPolarHBondContact O-CG 3.31Å; L229-L233 PolarHBondContact O-N 3.48Å; L229-L310 HydrophobicContact CD1-CD1 4.47Å; L229-L310 HydrophobicContact CD1-CD2 4.24Å; L229-F314 HydrophobicContact CB-CZ 4.34Å; L229-F314 HydrophobicContact CD1-CE2 3.89Å; L229-F314 HydrophobicContact CD1-CZ 4.33Å; L229-F342 HydrophobicContact CD2-CE1 4.12Å
230	A	89.8	Confident	87.1	Confident	55 Å²	55	48.3 Å²	48.3	46%	0.455	26%	0.264	S	S	.	.	H	α-helix	trans	-63.9	-38.3	178.2	0	0	0	0	0	112.7	K226 I227 H232 A234	K226-A230 WeakPolarHBondContact O-CB 3.19Å; K226-A230 PolarHBondContact O-N 3.01Å; I227-A230 PolarHBondContact O-N 2.95Å; A230-H232 PolarHBondContact O-N 2.86Å; A230-A234 WeakPolarHBondContact O-CB 3.4Å; A230-A234 PolarHBondContact O-N 3.24Å
231	R	90.3	Very high	88.4	Confident	15 Å²	15	46.2 Å²	46.2	6%	0.057	26%	0.256	C	S	.	.	H	α-helix	trans	-53.9	-53.6	171.4	-176.7	-169.1	-173.4	171.8	9	110.1	E48 D52 P139 W143 I227 L229 A234 I235	E48-R231 IonicContact OE1-NH2 3.6Å; E48-R231 PolarHBondContact OE1-NH2 2.7Å; D52-R231 IonicContact OD2-CZ 2.68Å; D52-R231 IonicContact OD2-NH1 3.37Å; D52-R231 PolarHBondContact OD2-NH1 3.23Å; P139-R231 HydrophobicContact CB-CG 4.48Å; W143-R231 HydrophobicContact CE3-CB 4.44Å; I227-R231 PolarHBondContact O-N 3.38Å; L229-R231 PolarHBondContact O-N 3.31Å; R231-A234 PolarHBondContact O-N 3.05Å; R231-I235 HydrophobicContact CG-CD1 4.17Å; R231-I235 WeakPolarHBondContact O-CG1 3.25Å; R231-I235 PolarHBondContact O-N 3.48Å
232	H	90.8	Very high	89.3	Confident	1 Å²	1	44.8 Å²	44.8	1%	0.005	25%	0.246	C	C	.	.	H	α-helix	trans	-72	-40.2	-174.8	-73	84.2	0	0	0	112.9	D52 Y228 L229 A230 A234 I235 M236 I306 L310	D52-H232 IonicContact OD1-CE1 2.73Å; D52-H232 IonicContact OD1-NE2 2.78Å; D52-H232 IonicContact OD2-CE1 3.18Å; Y228-H232 AromaticContact CE1-CE1 3.74Å; Y228-H232 AromaticContact CE1-ND1 3.71Å; Y228-H232 AromaticContact CE2-CE1 3.42Å; Y228-H232 VanDerWaalsContact CE2-CE1 3.42Å; Y228-H232 WeakPolarHBondContact CE2-CE1 3.39Å; Y228-H232 AromaticContact CE2-ND1 3.94Å; Y228-H232 AromaticContact CZ-CE1 3.2Å; Y228-H232 AromaticContact CZ-ND1 3.66Å; Y228-H232 PolarHBondContact O-N 3.35Å; Y228-H232 PolarHBondContact O-ND1 3.16Å; Y228-H232 PolarHBondContact OH-CE1 2.69Å; Y228-H232 VanDerWaalsContact OH-CE1 3.25Å; L229-H232 PolarHBondContact O-N 3.23Å; A230-H232 PolarHBondContact O-N 2.86Å; H232-A234 VanDerWaalsContact C-N 3.31Å; H232-A234 PolarHBondContact O-N 3.32Å; H232-I235 PolarHBondContact O-N 3.03Å; H232-M236 VanDerWaalsContact O-CG 3.29Å; H232-M236 WeakPolarHBondContact O-CG 3.47Å; H232-M236 PolarHBondContact O-N 3.1Å; H232-I306 HydrophobicContact CB-CG2 4.14Å; H232-L310 HydrophobicContact CB-CD1 3.95Å; H232-L310 HydrophobicContact CB-CD2 3.84Å; H232-L310 HydrophobicContact CB-CG 4.28Å
233	L	91.4	Very high	90	Very high	84 Å²	84	43.7 Å²	43.7	44%	0.44	24%	0.24	S	C	.	.	H	α-helix	trans	-63.1	-36.9	172.5	-69.4	178.2	0	0	0	111.9	L229 M236 C237	L229-L233 HydrophobicContact CD1-CD1 3.82Å; L229-L233 HydrophobicContact CD1-CD2 4.41Å; L229-L233 HydrophobicContact CD1-CG 3.84Å; L229-L233 HydrophobicContact CD2-CD1 4.39Å; L229-L233 HydrophobicContact CG-CD1 3.77Å; L229-L233 HydrophobicContact CG-CG 4.19Å; L229-L233 WeakPolarHBondContact O-CB 3.28Å; L229-L233 WeakPolarHBondContact O-CG 3.31Å; L229-L233 PolarHBondContact O-N 3.48Å; L233-M236 PolarHBondContact O-N 3.4Å; L233-C237 WeakPolarHBondContact O-CB 3.41Å; L233-C237 PolarHBondContact O-N 3.18Å; L233-C237 PolarHBondContact O-SG 3.37Å
234	A	92.2	Very high	90.6	Very high	37 Å²	37	41.1 Å²	41.1	31%	0.306	24%	0.237	S	C	.	.	H	α-helix	trans	-63.9	-42.1	173.8	0	0	0	0	0	111.9	P139 A230 R231 H232 C237 L238	P139-A234 HydrophobicContact CG-CB 4.3Å; A230-A234 WeakPolarHBondContact O-CB 3.4Å; A230-A234 PolarHBondContact O-N 3.24Å; R231-A234 PolarHBondContact O-N 3.05Å; H232-A234 VanDerWaalsContact C-N 3.31Å; H232-A234 PolarHBondContact O-N 3.32Å; A234-C237 PolarHBondContact O-N 2.99Å; A234-L238 VanDerWaalsContact O-CB 3.3Å; A234-L238 WeakPolarHBondContact O-CB 3.25Å; A234-L238 VanDerWaalsContact O-CG 3.23Å; A234-L238 WeakPolarHBondContact O-CG 3.49Å; A234-L238 PolarHBondContact O-N 2.95Å
235	I	92.8	Very high	91	Very high	5 Å²	5	43 Å²	43	3%	0.026	24%	0.244	C	C	.	.	H	α-helix	trans	-60.1	-48.6	174.5	-66.8	165.3	0	0	0	110.6	V55 M136 P139 R231 H232 S239 I306	V55-I235 HydrophobicContact CG1-CD1 4.18Å; V55-I235 HydrophobicContact CG1-CG2 4.19Å; M136-I235 HydrophobicContact CE-CG2 3.86Å; P139-I235 HydrophobicContact CB-CD1 4.26Å; P139-I235 HydrophobicContact CB-CG1 3.68Å; P139-I235 HydrophobicContact CG-CG1 3.92Å; R231-I235 HydrophobicContact CG-CD1 4.17Å; R231-I235 WeakPolarHBondContact O-CG1 3.25Å; R231-I235 PolarHBondContact O-N 3.48Å; H232-I235 PolarHBondContact O-N 3.03Å; I235-S239 VanDerWaalsContact O-CB 3.29Å; I235-S239 WeakPolarHBondContact O-CB 3.29Å; I235-S239 PolarHBondContact O-N 3.27Å; I235-S239 PolarHBondContact O-OG 3.34Å; I235-I306 HydrophobicContact CG2-CD1 3.78Å
236	M	92.6	Very high	91.5	Very high	38 Å²	38	42.9 Å²	42.9	19%	0.187	24%	0.243	C	C	.	.	H	α-helix	trans	-56.8	-54.1	176	-63.2	-70	-63.1	0	0	111.1	H232 L233 L238 S239 S240 N303 I306 L307	H232-M236 VanDerWaalsContact O-CG 3.29Å; H232-M236 WeakPolarHBondContact O-CG 3.47Å; H232-M236 PolarHBondContact O-N 3.1Å; L233-M236 PolarHBondContact O-N 3.4Å; M236-L238 PolarHBondContact O-N 3.18Å; M236-S239 PolarHBondContact O-N 3.24Å; M236-S239 PolarHBondContact O-OG 3.35Å; M236-S240 PolarHBondContact O-N 3.34Å; M236-S240 VanDerWaalsContact O-N 3.12Å; M236-N303 HydrophobicContact CE-CB 3.86Å; M236-N303 WeakPolarHBondContact CE-O 3.49Å; M236-N303 WeakPolarHBondContact CE-OD1 3.22Å; M236-N303 HydrophobicContact SD-CB 4.01Å; M236-N303 VanDerWaalsContact SD-O 3.38Å; M236-N303 PolarHBondContact SD-OD1 3.31Å; M236-I306 HydrophobicContact CG-CG2 3.92Å; M236-I306 HydrophobicContact SD-CB 3.7Å; M236-I306 HydrophobicContact SD-CD1 4.25Å; M236-I306 HydrophobicContact SD-CG2 3.56Å; M236-I306 VanDerWaalsContact SD-CG2 3.56Å; M236-L307 HydrophobicContact CE-CB 4.24Å
237	C	93.3	Very high	91.8	Very high	84 Å²	84	38.4 Å²	38.4	57%	0.568	23%	0.23	S	C	*	.	H	α-helix	trans	-61.4	-44.9	-178.2	-70.9	0	0	0	0	112.9	L233 A234 S240	L233-C237 WeakPolarHBondContact O-CB 3.41Å; L233-C237 PolarHBondContact O-N 3.18Å; L233-C237 PolarHBondContact O-SG 3.37Å; A234-C237 PolarHBondContact O-N 2.99Å; C237-S240 WeakPolarHBondContact O-CB 3.38Å; C237-S240 PolarHBondContact O-N 3.06Å; C237-S240 PolarHBondContact O-OG 2.88Å
238	L	93.8	Very high	92	Very high	49 Å²	49	38 Å²	38	26%	0.257	23%	0.233	S	C	.	.	H	α-helix	trans	-64.9	-40.1	178.2	-70.3	173.7	0	0	0	111.3	I135 M136 P139 A234 M236 S240 I241 P242	I135-L238 HydrophobicContact CG2-CD1 4.32Å; I135-L238 HydrophobicContact CG2-CD2 3.87Å; M136-L238 HydrophobicContact SD-CB 3.6Å; P139-L238 HydrophobicContact CG-CD1 3.66Å; A234-L238 VanDerWaalsContact O-CB 3.3Å; A234-L238 WeakPolarHBondContact O-CB 3.25Å; A234-L238 VanDerWaalsContact O-CG 3.23Å; A234-L238 WeakPolarHBondContact O-CG 3.49Å; A234-L238 PolarHBondContact O-N 2.95Å; M236-L238 PolarHBondContact O-N 3.18Å; L238-S240 VanDerWaalsContact C-N 3.27Å; L238-S240 PolarHBondContact O-N 2.94Å; L238-I241 WeakPolarHBondContact O-CB 3.3Å; L238-I241 PolarHBondContact O-N 3.36Å; L238-P242 VanDerWaalsContact O-CD 3.23Å; L238-P242 WeakPolarHBondContact O-CD 3.47Å
239	S	93.9	Very high	92.1	Very high	0 Å²	0	38 Å²	38	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-70.2	-19.9	179.2	74.5	0	0	0	0	114.4	M136 I235 M236 I241 P242 I243 N303	M136-S239 PolarHBondContact SD-N 2.86Å; M136-S239 VanDerWaalsContact SD-N 3.37Å; I235-S239 VanDerWaalsContact O-CB 3.29Å; I235-S239 WeakPolarHBondContact O-CB 3.29Å; I235-S239 PolarHBondContact O-N 3.27Å; I235-S239 PolarHBondContact O-OG 3.34Å; M236-S239 PolarHBondContact O-N 3.24Å; M236-S239 PolarHBondContact O-OG 3.35Å; S239-I241 PolarHBondContact O-N 3.47Å; S239-P242 VanDerWaalsContact O-CD 3.24Å; S239-P242 WeakPolarHBondContact O-CD 3.4Å; S239-P242 WeakPolarHBondContact O-CG 3.45Å; S239-I243 WeakPolarHBondContact O-CB 3.25Å; S239-I243 WeakPolarHBondContact O-CD1 3.49Å; S239-I243 VanDerWaalsContact O-CG1 3.27Å; S239-I243 WeakPolarHBondContact O-CG1 3.34Å; S239-I243 PolarHBondContact O-N 2.99Å; S239-I243 VanDerWaalsContact O-N 3.1Å; S239-N303 VanDerWaalsContact OG-CG 3.32Å; S239-N303 PolarHBondContact OG-ND2 3.48Å; S239-N303 PolarHBondContact OG-OD1 3.15Å
240	S	93.7	Very high	92.1	Very high	58 Å²	58	40.4 Å²	40.4	41%	0.406	24%	0.24	S	C	.	.	H	α-helix	trans	-59.8	-26.3	173.1	76.2	0	0	0	0	112.3	M236 C237 L238 S244	M236-S240 PolarHBondContact O-N 3.34Å; M236-S240 VanDerWaalsContact O-N 3.12Å; C237-S240 WeakPolarHBondContact O-CB 3.38Å; C237-S240 PolarHBondContact O-N 3.06Å; C237-S240 PolarHBondContact O-OG 2.88Å; L238-S240 VanDerWaalsContact C-N 3.27Å; L238-S240 PolarHBondContact O-N 2.94Å; S240-S244 VanDerWaalsContact O-CB 3.25Å; S240-S244 WeakPolarHBondContact O-CB 3.27Å; S240-S244 PolarHBondContact O-N 2.85Å; S240-S244 PolarHBondContact O-OG 3.14Å
241	I	92.9	Very high	92	Very high	86 Å²	86	41.2 Å²	41.2	44%	0.441	25%	0.247	S	C	.	.	H	α-helix	trans	-69.4	-59.6	179.2	-53.9	173.5	0	0	0	111.4	F132 L238 S239 I243 S244 Y245	F132-I241 HydrophobicContact CD1-CG2 4.3Å; F132-I241 HydrophobicContact CE1-CG2 3.62Å; F132-I241 HydrophobicContact CZ-CG2 4.16Å; L238-I241 WeakPolarHBondContact O-CB 3.3Å; L238-I241 PolarHBondContact O-N 3.36Å; S239-I241 PolarHBondContact O-N 3.47Å; I241-I243 VanDerWaalsContact C-N 3.31Å; I241-I243 PolarHBondContact O-N 3Å; I241-S244 PolarHBondContact O-N 2.98Å; I241-Y245 WeakPolarHBondContact O-CB 3.01Å; I241-Y245 PolarHBondContact O-N 3.13Å
242	P	93.7	Very high	91.5	Very high	5 Å²	5	48.6 Å²	48.6	3%	0.032	28%	0.275	C	S	.	.	H	α-helix	trans	-61.5	-35.4	174.4	22.1	-31.8	0	0	0	112.8	F132 L238 S239 S244 Y245 L246 L299	F132-P242 HydrophobicContact CB-CB 4.11Å; F132-P242 HydrophobicContact CB-CG 4.28Å; F132-P242 HydrophobicContact CD2-CB 3.81Å; F132-P242 HydrophobicContact CE2-CB 4.41Å; F132-P242 HydrophobicContact CG-CB 3.97Å; F132-P242 HydrophobicContact CG-CG 4.39Å; L238-P242 VanDerWaalsContact O-CD 3.23Å; L238-P242 WeakPolarHBondContact O-CD 3.47Å; S239-P242 VanDerWaalsContact O-CD 3.24Å; S239-P242 WeakPolarHBondContact O-CD 3.4Å; S239-P242 WeakPolarHBondContact O-CG 3.45Å; P242-S244 PolarHBondContact O-N 2.72Å; P242-Y245 PolarHBondContact O-N 2.66Å; P242-L246 VanDerWaalsContact O-CB 3.25Å; P242-L246 WeakPolarHBondContact O-CB 3.14Å; P242-L246 VanDerWaalsContact O-CG 3.26Å; P242-L246 WeakPolarHBondContact O-CG 3.16Å; P242-L246 PolarHBondContact O-N 3.04Å; P242-L299 HydrophobicContact CB-CD1 3.99Å; P242-L299 HydrophobicContact CG-CD1 4.1Å
243	I	94.7	Very high	90.6	Very high	30 Å²	30	49.6 Å²	49.6	15%	0.154	28%	0.28	C	S	.	.	H	α-helix	trans	-60.2	-46	174.5	-71.5	169.3	0	0	0	111.2	S239 I241 S247 L296 L299	S239-I243 WeakPolarHBondContact O-CB 3.25Å; S239-I243 WeakPolarHBondContact O-CD1 3.49Å; S239-I243 VanDerWaalsContact O-CG1 3.27Å; S239-I243 WeakPolarHBondContact O-CG1 3.34Å; S239-I243 PolarHBondContact O-N 2.99Å; S239-I243 VanDerWaalsContact O-N 3.1Å; I241-I243 VanDerWaalsContact C-N 3.31Å; I241-I243 PolarHBondContact O-N 3Å; I243-S247 WeakPolarHBondContact O-CB 3.1Å; I243-S247 PolarHBondContact O-N 3.32Å; I243-S247 PolarHBondContact O-OG 3.33Å; I243-L296 HydrophobicContact CB-CD1 4.32Å; I243-L296 HydrophobicContact CG1-CD1 4.46Å; I243-L296 HydrophobicContact CG2-CD1 3.89Å; I243-L299 HydrophobicContact CD1-CB 3.97Å; I243-L299 HydrophobicContact CG1-CB 3.72Å; I243-L299 HydrophobicContact CG1-CD1 4.35Å
244	S	94.3	Very high	89.2	Confident	71 Å²	71	55.6 Å²	55.6	50%	0.497	30%	0.296	S	S	.	.	H	α-helix	trans	-67.5	-37.7	177.7	-58.4	0	0	0	0	112.1	S240 I241 P242 S247 A248	S240-S244 VanDerWaalsContact O-CB 3.25Å; S240-S244 WeakPolarHBondContact O-CB 3.27Å; S240-S244 PolarHBondContact O-N 2.85Å; S240-S244 PolarHBondContact O-OG 3.14Å; I241-S244 PolarHBondContact O-N 2.98Å; P242-S244 PolarHBondContact O-N 2.72Å; S244-S247 WeakPolarHBondContact CA-OG 3.3Å; S244-S247 PolarHBondContact O-OG 2.96Å; S244-A248 VanDerWaalsContact O-CB 3.26Å; S244-A248 WeakPolarHBondContact O-CB 3.42Å; S244-A248 PolarHBondContact O-N 3.32Å
245	Y	92.9	Very high	88.1	Confident	52 Å²	52	59.1 Å²	59.1	20%	0.204	31%	0.306	C	S	.	.	H	α-helix	trans	-68.1	-49.1	177.4	176.9	-105.7	0	0	0	112.3	L125 A128 F132 I241 P242 S247 A248 Y249	L125-Y245 HydrophobicContact CD1-CE1 3.7Å; A128-Y245 HydrophobicContact CB-CE1 3.9Å; F132-Y245 AromaticContact CE2-CD1 3.6Å; F132-Y245 HydrophobicContact CE2-CD1 3.6Å; F132-Y245 HydrophobicContact CE2-CE1 4.12Å; F132-Y245 AromaticContact CE2-CG 3.93Å; F132-Y245 HydrophobicContact CE2-CG 3.93Å; F132-Y245 HydrophobicContact CZ-CD1 4.36Å; F132-Y245 HydrophobicContact CZ-CG 4.25Å; I241-Y245 WeakPolarHBondContact O-CB 3.01Å; I241-Y245 PolarHBondContact O-N 3.13Å; P242-Y245 PolarHBondContact O-N 2.66Å; Y245-S247 PolarHBondContact O-N 2.97Å; Y245-A248 PolarHBondContact O-N 3.18Å; Y245-Y249 WeakPolarHBondContact O-CB 3.47Å; Y245-Y249 PolarHBondContact O-N 3.12Å
246	L	92.1	Very high	87.5	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-63.7	-39.7	178.8	-75	172.2	0	0	0	112.4	L125 L129 P242 Y250 A292 D295 L296 L299	L125-L246 HydrophobicContact CD1-CD2 4.23Å; L129-L246 HydrophobicContact CD1-CD2 4.48Å; L129-L246 HydrophobicContact CD2-CD1 4.27Å; L129-L246 HydrophobicContact CD2-CD2 3.88Å; L129-L246 HydrophobicContact CD2-CG 4.17Å; P242-L246 VanDerWaalsContact O-CB 3.25Å; P242-L246 WeakPolarHBondContact O-CB 3.14Å; P242-L246 VanDerWaalsContact O-CG 3.26Å; P242-L246 WeakPolarHBondContact O-CG 3.16Å; P242-L246 PolarHBondContact O-N 3.04Å; L246-Y250 VanDerWaalsContact O-CB 3.29Å; L246-Y250 WeakPolarHBondContact O-CB 3.26Å; L246-Y250 PolarHBondContact O-N 2.91Å; L246-A292 HydrophobicContact CD2-CB 3.78Å; L246-D295 HydrophobicContact CD1-CB 3.98Å; L246-D295 WeakPolarHBondContact CD1-OD2 3.05Å; L246-L296 HydrophobicContact CB-CB 4.23Å; L246-L296 HydrophobicContact CB-CD1 4.28Å; L246-L296 HydrophobicContact CD1-CB 4.29Å; L246-L299 HydrophobicContact CD1-CD1 4.11Å
247	S	92.2	Very high	87.1	Confident	51 Å²	51	64 Å²	64	36%	0.357	33%	0.33	S	S	.	.	H	α-helix	trans	-69.8	-38.9	175.9	54.6	0	0	0	0	112.3	I243 S244 Y245 A251	I243-S247 WeakPolarHBondContact O-CB 3.1Å; I243-S247 PolarHBondContact O-N 3.32Å; I243-S247 PolarHBondContact O-OG 3.33Å; S244-S247 WeakPolarHBondContact CA-OG 3.3Å; S244-S247 PolarHBondContact O-OG 2.96Å; Y245-S247 PolarHBondContact O-N 2.97Å; S247-A251 VanDerWaalsContact O-CB 3.25Å; S247-A251 WeakPolarHBondContact O-CB 3.25Å; S247-A251 PolarHBondContact O-N 3.5Å
248	A	90.4	Very high	86.7	Confident	36 Å²	36	60.3 Å²	60.3	30%	0.298	30%	0.304	S	S	.	.	H	α-helix	trans	-63	-45.7	172.2	0	0	0	0	0	112.3	S244 Y245 A251 R252	S244-A248 VanDerWaalsContact O-CB 3.26Å; S244-A248 WeakPolarHBondContact O-CB 3.42Å; S244-A248 PolarHBondContact O-N 3.32Å; Y245-A248 PolarHBondContact O-N 3.18Å; A248-A251 PolarHBondContact O-N 2.97Å; A248-R252 WeakPolarHBondContact O-CB 3.24Å; A248-R252 VanDerWaalsContact O-CG 3.27Å; A248-R252 WeakPolarHBondContact O-CG 3.33Å; A248-R252 PolarHBondContact O-N 3.44Å
249	Y	88.6	Confident	86.4	Confident	2 Å²	2	59.6 Å²	59.6	1%	0.008	30%	0.302	C	S	.	.	H	α-helix	trans	-59	-49.4	175.3	170.5	-102	0	0	0	111.8	E121 H122 L125 Y245 A251 R252 Q253 Q288 A292	E121-Y249 HydrophobicContact CB-CD2 4.19Å; E121-Y249 HydrophobicContact CB-CE2 4.46Å; H122-Y249 AromaticContact CE1-CE2 3.62Å; H122-Y249 AromaticContact CE1-CZ 3.69Å; H122-Y249 PolarHBondContact CE1-OH 2.99Å; H122-Y249 AromaticContact ND1-CE2 3.89Å; H122-Y249 AromaticContact ND1-CZ 3.95Å; H122-Y249 PolarHBondContact ND1-OH 3.43Å; H122-Y249 VanDerWaalsContact ND1-OH 3.11Å; L125-Y249 HydrophobicContact CD2-CD1 4.33Å; L125-Y249 HydrophobicContact CD2-CE1 3.68Å; L125-Y249 HydrophobicContact CD2-CE2 4.04Å; Y245-Y249 WeakPolarHBondContact O-CB 3.47Å; Y245-Y249 PolarHBondContact O-N 3.12Å; Y249-A251 VanDerWaalsContact C-N 3.31Å; Y249-A251 PolarHBondContact O-N 3.19Å; Y249-R252 PolarHBondContact O-N 3.01Å; Y249-Q253 PolarHBondContact O-N 2.88Å; Y249-Q288 WeakPolarHBondContact OH-CB 3.42Å; Y249-Q288 PolarHBondContact OH-OE1 2.87Å; Y249-A292 HydrophobicContact CD1-CB 3.83Å; Y249-A292 HydrophobicContact CE1-CB 3.81Å
250	Y	88.1	Confident	86.1	Confident	90 Å²	90	59.9 Å²	59.9	35%	0.353	30%	0.304	S	S	.	.	H	α-helix	trans	-64.8	-31.9	177.9	-176.5	-95.2	0	0	0	113.3	L246 R289 V293	L246-Y250 VanDerWaalsContact O-CB 3.29Å; L246-Y250 WeakPolarHBondContact O-CB 3.26Å; L246-Y250 PolarHBondContact O-N 2.91Å; Y250-R289 HydrophobicContact CD2-CG 3.95Å; Y250-R289 HydrophobicContact CE2-CG 3.88Å; Y250-R289 VanDerWaalsContact CE2-NE 3.28Å; Y250-R289 PolarHBondContact OH-NH2 2.99Å; Y250-V293 HydrophobicContact CD2-CG2 3.48Å; Y250-V293 VanDerWaalsContact CD2-CG2 3.48Å; Y250-V293 HydrophobicContact CE2-CG2 3.24Å; Y250-V293 HydrophobicContact CG-CG2 4.41Å
251	A	86.9	Confident	85.7	Confident	72 Å²	72	58.2 Å²	58.2	60%	0.595	29%	0.294	S	S	*	.	H	α-helix	trans	-74.9	-39.6	176.5	0	0	0	0	0	112.6	S247 A248 Y249	S247-A251 VanDerWaalsContact O-CB 3.25Å; S247-A251 WeakPolarHBondContact O-CB 3.25Å; S247-A251 PolarHBondContact O-N 3.5Å; A248-A251 PolarHBondContact O-N 2.97Å; Y249-A251 VanDerWaalsContact C-N 3.31Å; Y249-A251 PolarHBondContact O-N 3.19Å
252	R	80.1	Confident	85.2	Confident	169 Å²	169	55.2 Å²	55.2	64%	0.638	28%	0.278	S	S	*	.	H	α-helix	trans	-68.3	-49.3	176.6	-72.4	169.9	-172.9	-174.6	2	111.4	E121 A248 Y249 R254	E121-R252 IonicContact OE1-CZ 3.78Å; E121-R252 IonicContact OE1-NH1 2.86Å; E121-R252 PolarHBondContact OE1-NH1 3.41Å; A248-R252 WeakPolarHBondContact O-CB 3.24Å; A248-R252 VanDerWaalsContact O-CG 3.27Å; A248-R252 WeakPolarHBondContact O-CG 3.33Å; A248-R252 PolarHBondContact O-N 3.44Å; Y249-R252 PolarHBondContact O-N 3.01Å; R252-R254 PolarHBondContact O-N 3.36Å
253	Q	71.8	Confident	83.9	Confident	23 Å²	23	56.1 Å²	56.1	11%	0.107	29%	0.289	C	S	.	.			trans	-91.9	105.6	-165.1	-155.6	72.9	11.9	0	0	114.4	H122 Y249 Q255 V285	H122-Q253 VanDerWaalsContact NE2-CG 3.25Å; H122-Q253 WeakPolarHBondContact NE2-CG 3.29Å; H122-Q253 PolarHBondContact NE2-NE2 3.16Å; Y249-Q253 PolarHBondContact O-N 2.88Å; Q253-Q255 PolarHBondContact NE2-O 2.93Å; Q253-V285 HydrophobicContact CG-CG1 4.24Å
254	R	62.9	Low	82.2	Confident	210 Å²	210	61.8 Å²	61.8	79%	0.792	32%	0.315	S	S	*	.			trans	-115.5	-10.4	166.2	-68.9	-173.6	175.9	-174.3	-1	114.7	R252	R252-R254 PolarHBondContact O-N 3.36Å
255	Q	69.5	Low	80.4	Confident	110 Å²	110	59.8 Å²	59.8	51%	0.514	30%	0.3	S	S	.	.			trans	-101.2	127.9	-177	-73.6	164.8	-59.5	0	0	111.3	Q253	Q253-Q255 PolarHBondContact NE2-O 2.93Å
256	N	78.3	Confident	78.4	Confident	41 Å²	41	63.2 Å²	63.2	22%	0.219	33%	0.329	C	S	.	.	S	Bend	trans	-93.7	-9.7	169.2	-50.7	-45.6	0	0	0	111.8	K281 L282 V285 Q286	N256-K281 WeakPolarHBondContact O-CA 3.23Å; N256-L282 PolarHBondContact O-N 2.92Å; N256-V285 WeakPolarHBondContact OD1-CG1 3.25Å; N256-Q286 PolarHBondContact ND2-NE2 3.35Å
257	E	84.4	Confident	76.5	Confident	104 Å²	104	68.1 Å²	68.1	49%	0.486	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	134.4	-168.9	-71.8	165.2	-156.6	0	0	108	C280 K281	E257-C280 CarbonylContact C-O 3.55Å; E257-C280 VanDerWaalsContact CA-O 3.3Å; E257-C280 WeakPolarHBondContact CA-O 3.44Å; E257-K281 HydrophobicContact CG-CB 3.97Å; E257-K281 HydrophobicContact CG-CD 3.78Å; E257-K281 HydrophobicContact CG-CG 3.71Å; E257-K281 WeakPolarHBondContact OE1-CD 3.3Å; E257-K281 WeakPolarHBondContact OE1-CE 3.35Å; E257-K281 IonicContact OE1-NZ 2.68Å; E257-K281 PolarHBondContact OE1-NZ 2.94Å
258	F	86.1	Confident	74.7	Confident	7 Å²	7	73 Å²	73	3%	0.031	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	153	-175.8	76.9	-75.7	0	0	0	110.4	I80 C100 L104 R105 D106 L119 C260 C280 L282	I80-F258 HydrophobicContact CD1-CE1 3.88Å; I80-F258 HydrophobicContact CD1-CZ 3.82Å; C100-F258 HydrophobicContact CB-CZ 4.38Å; L104-F258 HydrophobicContact CD1-CZ 4.07Å; R105-F258 WeakPolarHBondContact O-CD2 3.23Å; D106-F258 HydrophobicContact CB-CB 4.02Å; D106-F258 WeakPolarHBondContact OD1-CA 3.23Å; L119-F258 HydrophobicContact CD2-CB 4.01Å; L119-F258 HydrophobicContact CD2-CD1 4.25Å; L119-F258 HydrophobicContact CD2-CG 4.12Å; F258-C260 HydrophobicContact CD2-CB 4.44Å; F258-C260 HydrophobicContact CE2-CB 3.88Å; F258-C260 HydrophobicContact CZ-CB 4.48Å; F258-C280 HydrophobicContact CD1-CB 3.89Å; F258-C280 WeakPolarHBondContact CD1-O 3.49Å; F258-C280 HydrophobicContact CE1-CB 3.32Å; F258-C280 HydrophobicContact CE2-CB 4.4Å; F258-C280 HydrophobicContact CZ-CB 3.64Å; F258-C280 PolarHBondContact N-O 3.09Å; F258-C280 PolarHBondContact O-N 3.16Å; F258-L282 HydrophobicContact CD1-CD1 3.51Å; F258-L282 HydrophobicContact CE1-CD1 3.33Å; F258-L282 HydrophobicContact CZ-CD1 4.4Å
259	T	86.8	Confident	72.8	Confident	35 Å²	35	76.4 Å²	76.4	22%	0.215	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	109.4	176.3	-53.5	0	0	0	0	108.7	D106 A107 R277	D106-T259 PolarHBondContact OD1-N 2.91Å; A107-T259 WeakPolarHBondContact CB-O 3.39Å; A107-T259 PolarHBondContact N-O 3.24Å; T259-R277 HydrophobicContact CG2-CB 3.79Å; T259-R277 HydrophobicContact CG2-CG 4.22Å
260	C	87.8	Confident	71	Confident	5 Å²	5	78.2 Å²	78.2	3%	0.034	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	122.6	173	175.9	0	0	0	0	109.4	C100 F258 R277 V278	C100-C260 WeakPolarHBondContact CA-SG 3.22Å; C100-C260 HydrophobicContact CB-CB 3.75Å; C100-C260 WeakPolarHBondContact CB-SG 3.16Å; C100-C260 WeakPolarHBondContact SG-CB 3.44Å; C100-C260 CovalentContact SG-SG 2.03Å; C100-C260 PolarHBondContact SG-SG 2.81Å; F258-C260 HydrophobicContact CD2-CB 4.44Å; F258-C260 HydrophobicContact CE2-CB 3.88Å; F258-C260 HydrophobicContact CZ-CB 4.48Å; C260-R277 CarbonylContact O-C 3.56Å; C260-R277 WeakPolarHBondContact O-CA 3.33Å; C260-V278 HydrophobicContact CB-CG2 3.95Å; C260-V278 PolarHBondContact N-O 3.42Å; C260-V278 PolarHBondContact O-N 2.86Å
261	A	85.5	Confident	69.2	Low	23 Å²	23	82.4 Å²	82.4	19%	0.19	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	123.5	164.4	0	0	0	0	0	108.7	A107 W116 R277	A107-A261 HydrophobicContact CB-CB 3.8Å; W116-A261 HydrophobicContact CH2-CB 3.79Å; W116-A261 HydrophobicContact CZ3-CB 4.03Å; A261-R277 HydrophobicContact CB-CG 4.45Å
262	L	81.4	Confident	67.6	Low	23 Å²	23	84.5 Å²	84.5	12%	0.12	44%	0.441	C	S	.	.	P	Polyproline II helix	trans	-72.2	154	170.8	-66.5	164.9	0	0	0	109.5	F88 A96 Y99 L276 V278	F88-L262 HydrophobicContact CE2-CD1 4.45Å; A96-L262 HydrophobicContact CB-CD1 4.13Å; A96-L262 HydrophobicContact CB-CD2 3.83Å; Y99-L262 HydrophobicContact CD1-CD2 3.87Å; Y99-L262 HydrophobicContact CG-CD2 4.34Å; L262-L276 HydrophobicContact CD1-CB 4.27Å; L262-L276 HydrophobicContact CD1-CD2 3.88Å; L262-L276 HydrophobicContact CD1-CG 4.16Å; L262-L276 PolarHBondContact N-O 3.32Å; L262-V278 HydrophobicContact CD1-CG1 3.99Å; L262-V278 HydrophobicContact CD1-CG2 4.34Å; L262-V278 HydrophobicContact CG-CG2 4.31Å
263	G	67.4	Low	66.2	Low	25 Å²	25	84.2 Å²	84.2	26%	0.258	45%	0.447	S	S	.	.	P	Polyproline II helix	trans	-56.1	150.8	-165.3	0	0	0	0	0	115	Y99	Y99-G263 WeakPolarHBondContact OH-CA 3.4Å
264	E	59.7	Low	65.4	Low	148 Å²	148	87.5 Å²	87.5	69%	0.692	47%	0.465	S	S	*	.	P	Polyproline II helix	trans	-60.9	130.9	174.9	-166.9	135.7	-134.9	0	0	109.6	K275	E264-K275 WeakPolarHBondContact OE1-CE 3.25Å; E264-K275 IonicContact OE1-NZ 2.69Å; E264-K275 PolarHBondContact OE1-NZ 3.32Å
265	P	54.8	Low	65.4	Low	29 Å²	29	83.3 Å²	83.3	19%	0.188	45%	0.452	C	S	.	.	P	Polyproline II helix	trans	-55.3	154.4	-172.8	12.2	-28.8	0	0	0	115.1	D267 S270 L274	P265-D267 PolarHBondContact O-N 2.88Å; P265-S270 WeakPolarHBondContact CB-OG 3.5Å; P265-S270 WeakPolarHBondContact CG-OG 3.37Å; P265-L274 HydrophobicContact CB-CB 4.36Å; P265-L274 HydrophobicContact CB-CD2 3.75Å; P265-L274 HydrophobicContact CG-CB 4.07Å; P265-L274 HydrophobicContact CG-CD2 4.35Å
266	P	52.4	Low	65.8	Low	124 Å²	124	80.7 Å²	80.7	81%	0.805	44%	0.441	S	S	*	.	S	Bend	trans	-62.5	-28.7	176.6	27.2	-35.2	0	0	0	112.8
267	D	50.5	Low	66	Low	103 Å²	103	84.3 Å²	84.3	55%	0.551	45%	0.452	S	S	*	.			trans	-111.8	121	-179.3	-63.4	-63.5	0	0	0	111.6	P265 S269 S270	P265-D267 PolarHBondContact O-N 2.88Å; D267-S269 PolarHBondContact O-N 3.31Å; D267-S269 VanDerWaalsContact O-N 3.1Å; D267-S270 WeakPolarHBondContact O-CB 3.45Å; D267-S270 PolarHBondContact O-N 2.92Å; D267-S270 PolarHBondContact O-OG 3.21Å
268	T	54.9	Low	66.1	Low	155 Å²	155	79.5 Å²	79.5	95%	0.951	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-4.3	178.9	52	0	0	0	0	114.5
269	S	51.4	Low	66.2	Low	106 Å²	106	83.7 Å²	83.7	74%	0.741	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.7	-4.2	175.6	55.5	0	0	0	0	113.9	D267	D267-S269 PolarHBondContact O-N 3.31Å; D267-S269 VanDerWaalsContact O-N 3.1Å
270	S	50.3	Low	66.4	Low	40 Å²	40	82 Å²	82	28%	0.28	44%	0.443	S	S	.	.	S	Bend	trans	-77	150.7	-176.1	59	0	0	0	0	113.4	P265 D267	P265-S270 WeakPolarHBondContact CB-OG 3.5Å; P265-S270 WeakPolarHBondContact CG-OG 3.37Å; D267-S270 WeakPolarHBondContact O-CB 3.45Å; D267-S270 PolarHBondContact O-N 2.92Å; D267-S270 PolarHBondContact O-OG 3.21Å
271	Y	51.3	Low	66.4	Low	179 Å²	179	84.7 Å²	84.7	70%	0.702	45%	0.454	S	S	*	.			trans	-61.3	151	-173.8	-69.9	-90.3	0	0	0	113	E273 L274	Y271-E273 PolarHBondContact O-N 3.24Å; Y271-L274 PolarHBondContact O-N 3.14Å
272	P	53.3	Low	66.4	Low	115 Å²	115	83.8 Å²	83.8	75%	0.747	45%	0.445	S	S	*	.	G	3₁₀ helix	trans	-59.2	-16.5	179	24.3	-34.9	0	0	0	114.1	L274 K275	P272-L274 PolarHBondContact O-N 3.45Å; P272-K275 PolarHBondContact O-N 2.82Å
273	E	50.7	Low	66.3	Low	164 Å²	164	84.2 Å²	84.2	77%	0.766	45%	0.449	S	S	*	.	G	3₁₀ helix	trans	-61.3	-21	172.5	-60.8	-175.4	125.4	0	0	113.8	Y271 K275	Y271-E273 PolarHBondContact O-N 3.24Å; E273-K275 VanDerWaalsContact C-N 3.27Å; E273-K275 PolarHBondContact O-N 3.37Å
274	L	53.6	Low	66.9	Low	91 Å²	91	83.6 Å²	83.6	48%	0.476	44%	0.442	S	S	.	.	G	3₁₀ helix	trans	-74.8	-10.3	175	-95.6	75.6	0	0	0	114.1	P265 Y271 P272 L276	P265-L274 HydrophobicContact CB-CB 4.36Å; P265-L274 HydrophobicContact CB-CD2 3.75Å; P265-L274 HydrophobicContact CG-CB 4.07Å; P265-L274 HydrophobicContact CG-CD2 4.35Å; Y271-L274 PolarHBondContact O-N 3.14Å; P272-L274 PolarHBondContact O-N 3.45Å; L274-L276 PolarHBondContact O-N 3.13Å
275	K	63.5	Low	67.9	Low	123 Å²	123	76.7 Å²	76.7	54%	0.535	41%	0.41	S	S	.	.	S	Bend	trans	-79.8	54.9	170.6	-73.8	-173.5	172.9	178.4	0	111.7	E264 P272 E273 R277	E264-K275 WeakPolarHBondContact OE1-CE 3.25Å; E264-K275 IonicContact OE1-NZ 2.69Å; E264-K275 PolarHBondContact OE1-NZ 3.32Å; P272-K275 PolarHBondContact O-N 2.82Å; E273-K275 VanDerWaalsContact C-N 3.27Å; E273-K275 PolarHBondContact O-N 3.37Å; K275-R277 PolarHBondContact O-N 3Å
276	L	76.7	Confident	69.3	Low	54 Å²	54	80.7 Å²	80.7	28%	0.283	43%	0.426	S	S	.	.			trans	-66.3	126.2	-178	-175.9	63.9	0	0	0	110.8	P85 F88 L262 L274 V278	P85-L276 HydrophobicContact CG-CD2 4.26Å; F88-L276 HydrophobicContact CE1-CD2 3.63Å; F88-L276 HydrophobicContact CE2-CD2 4.12Å; F88-L276 HydrophobicContact CZ-CD2 3.26Å; L262-L276 HydrophobicContact CD1-CB 4.27Å; L262-L276 HydrophobicContact CD1-CD2 3.88Å; L262-L276 HydrophobicContact CD1-CG 4.16Å; L262-L276 PolarHBondContact N-O 3.32Å; L274-L276 PolarHBondContact O-N 3.13Å; L276-V278 HydrophobicContact CD2-CG1 4.31Å; L276-V278 HydrophobicContact CG-CG1 4.25Å
277	R	82.9	Confident	70.8	Confident	117 Å²	117	76.7 Å²	76.7	44%	0.442	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	129.8	173.2	-66.8	176.4	-174.5	-115.2	-0.7	109	A107 T259 C260 A261 K275	A107-R277 PolarHBondContact O-NH1 3.3Å; T259-R277 HydrophobicContact CG2-CB 3.79Å; T259-R277 HydrophobicContact CG2-CG 4.22Å; C260-R277 CarbonylContact O-C 3.56Å; C260-R277 WeakPolarHBondContact O-CA 3.33Å; A261-R277 HydrophobicContact CB-CG 4.45Å; K275-R277 PolarHBondContact O-N 3Å
278	V	87.3	Confident	72.5	Confident	3 Å²	3	72 Å²	72	2%	0.018	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	131.3	176.3	-64.2	0	0	0	0	109.6	T84 C260 L262 L276	T84-V278 HydrophobicContact CG2-CG1 4.39Å; C260-V278 HydrophobicContact CB-CG2 3.95Å; C260-V278 PolarHBondContact N-O 3.42Å; C260-V278 PolarHBondContact O-N 2.86Å; L262-V278 HydrophobicContact CD1-CG1 3.99Å; L262-V278 HydrophobicContact CD1-CG2 4.34Å; L262-V278 HydrophobicContact CG-CG2 4.31Å; L276-V278 HydrophobicContact CD2-CG1 4.31Å; L276-V278 HydrophobicContact CG-CG1 4.25Å
279	N	88.9	Confident	74.1	Confident	95 Å²	95	69.4 Å²	69.4	51%	0.508	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	126.6	176.1	-71	1.7	0	0	0	108.5	Y83	Y83-N279 HydrophobicContact CD2-CB 4.4Å; Y83-N279 WeakPolarHBondContact CD2-O 3.38Å; Y83-N279 PolarHBondContact N-O 3.26Å
280	C	89.3	Confident	75.9	Confident	1 Å²	1	69.3 Å²	69.3	1%	0.007	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	152.6	179.5	-63.9	0	0	0	0	110.8	I80 Y81 C82 E257 F258	I80-C280 HydrophobicContact CD1-CB 4.04Å; I80-C280 HydrophobicContact CG1-CB 4.25Å; Y81-C280 CarbonylContact O-C 3.44Å; Y81-C280 WeakPolarHBondContact O-CA 3.38Å; C82-C280 HydrophobicContact CB-CB 4.16Å; C82-C280 WeakPolarHBondContact CB-SG 3.39Å; C82-C280 WeakPolarHBondContact SG-CB 3.36Å; C82-C280 CovalentContact SG-SG 2.05Å; C82-C280 PolarHBondContact SG-SG 3.35Å; E257-C280 CarbonylContact C-O 3.55Å; E257-C280 VanDerWaalsContact CA-O 3.3Å; E257-C280 WeakPolarHBondContact CA-O 3.44Å; F258-C280 HydrophobicContact CD1-CB 3.89Å; F258-C280 WeakPolarHBondContact CD1-O 3.49Å; F258-C280 HydrophobicContact CE1-CB 3.32Å; F258-C280 HydrophobicContact CE2-CB 4.4Å; F258-C280 HydrophobicContact CZ-CB 3.64Å; F258-C280 PolarHBondContact N-O 3.09Å; F258-C280 PolarHBondContact O-N 3.16Å
281	K	88.8	Confident	77.7	Confident	61 Å²	61	68.4 Å²	68.4	27%	0.265	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	126.3	-173.1	-175.8	166.5	-173.6	155.2	0	109.4	Y81 Y83 N256 E257 P283	Y81-K281 PolarHBondContact N-O 3.23Å; Y81-K281 PolarHBondContact O-N 2.98Å; Y83-K281 HydrophobicContact CE2-CB 4.47Å; N256-K281 WeakPolarHBondContact O-CA 3.23Å; E257-K281 HydrophobicContact CG-CB 3.97Å; E257-K281 HydrophobicContact CG-CD 3.78Å; E257-K281 HydrophobicContact CG-CG 3.71Å; E257-K281 WeakPolarHBondContact OE1-CD 3.3Å; E257-K281 WeakPolarHBondContact OE1-CE 3.35Å; E257-K281 IonicContact OE1-NZ 2.68Å; E257-K281 PolarHBondContact OE1-NZ 2.94Å; K281-P283 WeakPolarHBondContact O-CD 3.32Å
282	L	85.3	Confident	79.6	Confident	3 Å²	3	60 Å²	60	2%	0.016	29%	0.294	C	S	.	.			trans	-97	109.2	174.5	-71	90.3	0	0	0	108.5	W101 L104 L119 H122 N256 F258 A284 V285	W101-L282 HydrophobicContact CZ3-CD2 4.07Å; L104-L282 HydrophobicContact CD1-CD2 4.47Å; L119-L282 HydrophobicContact CD2-CD1 4.28Å; H122-L282 HydrophobicContact CB-CD2 4.11Å; N256-L282 PolarHBondContact O-N 2.92Å; F258-L282 HydrophobicContact CD1-CD1 3.51Å; F258-L282 HydrophobicContact CE1-CD1 3.33Å; F258-L282 HydrophobicContact CZ-CD1 4.4Å; L282-A284 VanDerWaalsContact C-N 3.29Å; L282-A284 PolarHBondContact O-N 3.45Å; L282-V285 HydrophobicContact CB-CG2 3.47Å; L282-V285 VanDerWaalsContact CB-CG2 3.47Å; L282-V285 HydrophobicContact CD2-CG2 4.36Å; L282-V285 HydrophobicContact CG-CG2 4.42Å; L282-V285 PolarHBondContact O-N 3.14Å
283	P	80.3	Confident	81.5	Confident	32 Å²	32	57.5 Å²	57.5	21%	0.208	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-38.3	178.2	26.6	-33.6	0	0	0	111.5	E78 Y81 K281 V285 Q286	E78-P283 WeakPolarHBondContact O-CG 3.29Å; Y81-P283 HydrophobicContact CD2-CG 4.07Å; Y81-P283 HydrophobicContact CE2-CB 4.15Å; Y81-P283 HydrophobicContact CE2-CG 3.78Å; K281-P283 WeakPolarHBondContact O-CD 3.32Å; P283-V285 PolarHBondContact O-N 3.03Å; P283-Q286 PolarHBondContact O-N 3.47Å
284	A	79.1	Confident	83.5	Confident	13 Å²	13	52.9 Å²	52.9	11%	0.107	26%	0.26	C	S	.	.	H	α-helix	trans	-54.8	-23.7	-179.2	0	0	0	0	0	114.7	N74 L282 Q286 L287 Q288	N74-A284 VanDerWaalsContact OD1-CB 3.28Å; N74-A284 WeakPolarHBondContact OD1-CB 3.26Å; L282-A284 VanDerWaalsContact C-N 3.29Å; L282-A284 PolarHBondContact O-N 3.45Å; A284-Q286 VanDerWaalsContact C-N 3.28Å; A284-Q286 PolarHBondContact O-N 2.95Å; A284-L287 PolarHBondContact O-N 3.1Å; A284-Q288 WeakPolarHBondContact O-CB 3.27Å; A284-Q288 VanDerWaalsContact O-CG 3.29Å; A284-Q288 WeakPolarHBondContact O-CG 3.44Å; A284-Q288 PolarHBondContact O-N 3.23Å
285	V	80.9	Confident	85.4	Confident	2 Å²	2	48.8 Å²	48.8	1%	0.012	24%	0.239	C	C	.	.	H	α-helix	trans	-60.4	-37.6	-178.3	178.9	0	0	0	0	111.7	Q253 N256 L282 P283 R289	Q253-V285 HydrophobicContact CG-CG1 4.24Å; N256-V285 WeakPolarHBondContact OD1-CG1 3.25Å; L282-V285 HydrophobicContact CB-CG2 3.47Å; L282-V285 VanDerWaalsContact CB-CG2 3.47Å; L282-V285 HydrophobicContact CD2-CG2 4.36Å; L282-V285 HydrophobicContact CG-CG2 4.42Å; L282-V285 PolarHBondContact O-N 3.14Å; P283-V285 PolarHBondContact O-N 3.03Å; V285-R289 WeakPolarHBondContact O-CB 3.42Å; V285-R289 PolarHBondContact O-N 3.14Å
286	Q	84.4	Confident	86.8	Confident	113 Å²	113	44.6 Å²	44.6	53%	0.528	22%	0.222	S	C	.	.	H	α-helix	trans	-67.5	-45.9	-178.7	-63.6	-166.8	-4.2	0	0	111.1	N256 P283 A284 R289 I290	N256-Q286 PolarHBondContact ND2-NE2 3.35Å; P283-Q286 PolarHBondContact O-N 3.47Å; A284-Q286 VanDerWaalsContact C-N 3.28Å; A284-Q286 PolarHBondContact O-N 2.95Å; Q286-R289 PolarHBondContact O-N 3.48Å; Q286-I290 WeakPolarHBondContact O-CG1 3.24Å; Q286-I290 PolarHBondContact O-N 3.2Å; Q286-I290 VanDerWaalsContact O-N 3.14Å
287	L	83.9	Confident	87.7	Confident	40 Å²	40	44.6 Å²	44.6	21%	0.209	23%	0.229	C	C	.	.	H	α-helix	trans	-62.3	-55.9	174	-176.3	63	0	0	0	110	L69 V70 R73 A284 R289 I290 M291	L69-L287 HydrophobicContact CD2-CD1 4.4Å; V70-L287 HydrophobicContact CG2-CD2 4.25Å; V70-L287 HydrophobicContact CG2-CG 4.21Å; R73-L287 HydrophobicContact CB-CD2 3.63Å; R73-L287 HydrophobicContact CG-CD2 3.9Å; A284-L287 PolarHBondContact O-N 3.1Å; L287-R289 PolarHBondContact O-N 2.83Å; L287-R289 VanDerWaalsContact O-N 3.1Å; L287-I290 PolarHBondContact O-N 3.33Å; L287-M291 HydrophobicContact CD1-CG 4.05Å; L287-M291 HydrophobicContact CD1-SD 4.26Å; L287-M291 HydrophobicContact CG-CG 4.13Å; L287-M291 WeakPolarHBondContact O-CB 3.49Å; L287-M291 WeakPolarHBondContact O-CG 3.4Å; L287-M291 PolarHBondContact O-N 2.84Å
288	Q	86.2	Confident	88.2	Confident	6 Å²	6	40.3 Å²	40.3	3%	0.028	22%	0.215	C	C	.	.	H	α-helix	trans	-52.7	-36.1	178.9	-74.4	-177.2	-18.3	0	0	113.5	V70 H122 L125 Y249 A284 A292	V70-Q288 HydrophobicContact CG1-CG 4.13Å; H122-Q288 PolarHBondContact ND1-OE1 2.99Å; H122-Q288 PolarHBondContact O-NE2 3.23Å; L125-Q288 HydrophobicContact CD2-CB 3.85Å; L125-Q288 HydrophobicContact CD2-CG 4.04Å; Y249-Q288 WeakPolarHBondContact OH-CB 3.42Å; Y249-Q288 PolarHBondContact OH-OE1 2.87Å; A284-Q288 WeakPolarHBondContact O-CB 3.27Å; A284-Q288 VanDerWaalsContact O-CG 3.29Å; A284-Q288 WeakPolarHBondContact O-CG 3.44Å; A284-Q288 PolarHBondContact O-N 3.23Å; Q288-A292 VanDerWaalsContact O-CB 3.25Å; Q288-A292 WeakPolarHBondContact O-CB 3.36Å; Q288-A292 PolarHBondContact O-N 3.45Å
289	R	87.8	Confident	88.5	Confident	99 Å²	99	40.3 Å²	40.3	37%	0.374	22%	0.215	S	C	.	.	H	α-helix	trans	-71.4	-41.9	176.6	-175.5	174.7	172.4	-134.6	-11.2	113.1	Y250 V285 Q286 L287 M291 V293	Y250-R289 HydrophobicContact CD2-CG 3.95Å; Y250-R289 HydrophobicContact CE2-CG 3.88Å; Y250-R289 VanDerWaalsContact CE2-NE 3.28Å; Y250-R289 PolarHBondContact OH-NH2 2.99Å; V285-R289 WeakPolarHBondContact O-CB 3.42Å; V285-R289 PolarHBondContact O-N 3.14Å; Q286-R289 PolarHBondContact O-N 3.48Å; L287-R289 PolarHBondContact O-N 2.83Å; L287-R289 VanDerWaalsContact O-N 3.1Å; R289-M291 VanDerWaalsContact C-N 3.28Å; R289-M291 PolarHBondContact O-N 2.88Å; R289-V293 WeakPolarHBondContact O-CG2 3.15Å; R289-V293 PolarHBondContact O-N 3.04Å; R289-V293 VanDerWaalsContact O-N 3.12Å
290	I	89.1	Confident	88.8	Confident	105 Å²	105	38.5 Å²	38.5	54%	0.538	21%	0.209	S	C	.	.	H	α-helix	trans	-58.6	-47	172.6	-68	163.3	0	0	0	109.3	Q286 L287 V293 V294	Q286-I290 WeakPolarHBondContact O-CG1 3.24Å; Q286-I290 PolarHBondContact O-N 3.2Å; Q286-I290 VanDerWaalsContact O-N 3.14Å; L287-I290 PolarHBondContact O-N 3.33Å; I290-V293 PolarHBondContact O-N 3.03Å; I290-V294 HydrophobicContact CG2-CG2 4.44Å; I290-V294 WeakPolarHBondContact O-CG2 3.25Å; I290-V294 PolarHBondContact O-N 3.02Å
291	M	89.3	Confident	89	Confident	21 Å²	21	42 Å²	42	10%	0.103	23%	0.23	C	C	.	.	H	α-helix	trans	-65	-42.5	-176.8	-61.3	-67.3	-52.1	0	0	111.8	L66 V70 L287 R289 V293 V294 D295	L66-M291 VanDerWaalsContact C-CE 3.43Å; L66-M291 VanDerWaalsContact CA-CE 3.4Å; L66-M291 HydrophobicContact CB-CE 3.34Å; L66-M291 HydrophobicContact CD2-CE 3.34Å; L66-M291 HydrophobicContact CD2-SD 4.23Å; L66-M291 HydrophobicContact CG-CE 3.85Å; L66-M291 WeakPolarHBondContact O-CE 3.38Å; V70-M291 HydrophobicContact CG2-CB 4.08Å; V70-M291 HydrophobicContact CG2-CE 3.82Å; V70-M291 HydrophobicContact CG2-CG 3.51Å; V70-M291 HydrophobicContact CG2-SD 4.18Å; L287-M291 HydrophobicContact CD1-CG 4.05Å; L287-M291 HydrophobicContact CD1-SD 4.26Å; L287-M291 HydrophobicContact CG-CG 4.13Å; L287-M291 WeakPolarHBondContact O-CB 3.49Å; L287-M291 WeakPolarHBondContact O-CG 3.4Å; L287-M291 PolarHBondContact O-N 2.84Å; R289-M291 VanDerWaalsContact C-N 3.28Å; R289-M291 PolarHBondContact O-N 2.88Å; M291-V293 VanDerWaalsContact C-N 3.33Å; M291-V293 PolarHBondContact O-N 3.36Å; M291-V294 PolarHBondContact O-N 3.32Å; M291-D295 WeakPolarHBondContact O-CB 3.35Å; M291-D295 PolarHBondContact O-N 2.84Å
292	A	90.9	Very high	89.2	Confident	1 Å²	1	40.3 Å²	40.3	1%	0.008	22%	0.224	C	C	.	.	H	α-helix	trans	-61.9	-36.1	173.3	0	0	0	0	0	113.1	L246 Y249 Q288 L296	L246-A292 HydrophobicContact CD2-CB 3.78Å; Y249-A292 HydrophobicContact CD1-CB 3.83Å; Y249-A292 HydrophobicContact CE1-CB 3.81Å; Q288-A292 VanDerWaalsContact O-CB 3.25Å; Q288-A292 WeakPolarHBondContact O-CB 3.36Å; Q288-A292 PolarHBondContact O-N 3.45Å; A292-L296 WeakPolarHBondContact O-CB 3.26Å; A292-L296 PolarHBondContact O-N 2.93Å
293	V	92.4	Very high	89.5	Confident	63 Å²	63	41.1 Å²	41.1	38%	0.382	23%	0.228	S	C	.	.	H	α-helix	trans	-70.1	-43.5	175	170.8	0	0	0	0	111.5	Y250 R289 I290 M291 A297	Y250-V293 HydrophobicContact CD2-CG2 3.48Å; Y250-V293 VanDerWaalsContact CD2-CG2 3.48Å; Y250-V293 HydrophobicContact CE2-CG2 3.24Å; Y250-V293 HydrophobicContact CG-CG2 4.41Å; R289-V293 WeakPolarHBondContact O-CG2 3.15Å; R289-V293 PolarHBondContact O-N 3.04Å; R289-V293 VanDerWaalsContact O-N 3.12Å; I290-V293 PolarHBondContact O-N 3.03Å; M291-V293 VanDerWaalsContact C-N 3.33Å; M291-V293 PolarHBondContact O-N 3.36Å; V293-A297 VanDerWaalsContact O-CB 3.3Å; V293-A297 WeakPolarHBondContact O-CB 3.1Å; V293-A297 PolarHBondContact O-N 3.19Å
294	V	93.3	Very high	90.2	Very high	68 Å²	68	45.5 Å²	45.5	41%	0.412	24%	0.244	S	C	.	.	H	α-helix	trans	-63.3	-47.1	178.4	171.4	0	0	0	0	110.8	L66 I290 M291 A297 L298	L66-V294 HydrophobicContact CD1-CG1 3.99Å; L66-V294 HydrophobicContact CD2-CG1 4.24Å; I290-V294 HydrophobicContact CG2-CG2 4.44Å; I290-V294 WeakPolarHBondContact O-CG2 3.25Å; I290-V294 PolarHBondContact O-N 3.02Å; M291-V294 PolarHBondContact O-N 3.32Å; V294-A297 PolarHBondContact O-N 3.08Å; V294-L298 VanDerWaalsContact O-CB 3.28Å; V294-L298 WeakPolarHBondContact O-CB 3.33Å; V294-L298 PolarHBondContact O-N 3.29Å
295	D	92.8	Very high	90.8	Very high	5 Å²	5	48.1 Å²	48.1	3%	0.027	26%	0.256	C	S	.	.	H	α-helix	trans	-68	-41.2	179.6	-165.9	28.3	0	0	0	111.9	P63 L66 L246 M291 A297 L298 L299	P63-D295 WeakPolarHBondContact CG-OD1 3.45Å; L66-D295 HydrophobicContact CD1-CB 4.35Å; L246-D295 HydrophobicContact CD1-CB 3.98Å; L246-D295 WeakPolarHBondContact CD1-OD2 3.05Å; M291-D295 WeakPolarHBondContact O-CB 3.35Å; M291-D295 PolarHBondContact O-N 2.84Å; D295-A297 PolarHBondContact O-N 2.97Å; D295-L298 PolarHBondContact O-N 3.37Å; D295-L299 WeakPolarHBondContact O-CB 3.37Å; D295-L299 VanDerWaalsContact O-CG 3.31Å; D295-L299 WeakPolarHBondContact O-CG 3.05Å; D295-L299 PolarHBondContact O-N 3.3Å
296	L	94	Very high	91.3	Very high	35 Å²	35	48 Å²	48	18%	0.183	26%	0.255	C	S	.	.	H	α-helix	trans	-60.8	-42.9	173.7	179.9	61.6	0	0	0	112.1	I243 L246 A292 C300	I243-L296 HydrophobicContact CB-CD1 4.32Å; I243-L296 HydrophobicContact CG1-CD1 4.46Å; I243-L296 HydrophobicContact CG2-CD1 3.89Å; L246-L296 HydrophobicContact CB-CB 4.23Å; L246-L296 HydrophobicContact CB-CD1 4.28Å; L246-L296 HydrophobicContact CD1-CB 4.29Å; A292-L296 WeakPolarHBondContact O-CB 3.26Å; A292-L296 PolarHBondContact O-N 2.93Å; L296-C300 VanDerWaalsContact O-CB 3.23Å; L296-C300 WeakPolarHBondContact O-CB 3.2Å; L296-C300 PolarHBondContact O-N 3.33Å; L296-C300 PolarHBondContact O-SG 3.27Å
297	A	94.9	Very high	91.6	Very high	53 Å²	53	47.2 Å²	47.2	44%	0.438	25%	0.254	S	S	.	.	H	α-helix	trans	-66.8	-40.5	176.7	0	0	0	0	0	112.1	V293 V294 D295 T301	V293-A297 VanDerWaalsContact O-CB 3.3Å; V293-A297 WeakPolarHBondContact O-CB 3.1Å; V293-A297 PolarHBondContact O-N 3.19Å; V294-A297 PolarHBondContact O-N 3.08Å; D295-A297 PolarHBondContact O-N 2.97Å; A297-T301 WeakPolarHBondContact O-CB 3.33Å; A297-T301 WeakPolarHBondContact O-CG2 3.3Å; A297-T301 PolarHBondContact O-N 3.35Å; A297-T301 PolarHBondContact O-OG1 2.95Å
298	L	93.9	Very high	91.8	Very high	27 Å²	27	48.9 Å²	48.9	14%	0.141	26%	0.262	C	S	.	.	H	α-helix	trans	-63.5	-51.7	176.4	177.2	63.7	0	0	0	111.7	G58 I62 P63 V294 D295 C300 T301 M302	G58-L298 WeakPolarHBondContact O-CD2 3.18Å; G58-L298 WeakPolarHBondContact O-CG 3.42Å; I62-L298 HydrophobicContact CB-CD2 3.8Å; I62-L298 HydrophobicContact CG2-CD2 3.42Å; I62-L298 VanDerWaalsContact CG2-CD2 3.42Å; P63-L298 HydrophobicContact CG-CD2 4.32Å; V294-L298 VanDerWaalsContact O-CB 3.28Å; V294-L298 WeakPolarHBondContact O-CB 3.33Å; V294-L298 PolarHBondContact O-N 3.29Å; D295-L298 PolarHBondContact O-N 3.37Å; L298-C300 PolarHBondContact O-N 3.04Å; L298-T301 PolarHBondContact O-N 3.23Å; L298-T301 PolarHBondContact O-OG1 3.15Å; L298-M302 HydrophobicContact CD1-CE 3.81Å; L298-M302 HydrophobicContact CD1-CG 4.12Å; L298-M302 WeakPolarHBondContact O-CB 3.25Å; L298-M302 VanDerWaalsContact O-CG 3.25Å; L298-M302 WeakPolarHBondContact O-CG 3.4Å; L298-M302 PolarHBondContact O-N 3.47Å
299	L	93.5	Very high	91.8	Very high	4 Å²	4	49.8 Å²	49.8	2%	0.021	27%	0.268	C	S	.	.	H	α-helix	trans	-63	-42.3	179.4	-67.9	173.1	0	0	0	111.3	T59 P242 I243 L246 D295 N303	T59-L299 HydrophobicContact CG2-CD2 4.35Å; P242-L299 HydrophobicContact CB-CD1 3.99Å; P242-L299 HydrophobicContact CG-CD1 4.1Å; I243-L299 HydrophobicContact CD1-CB 3.97Å; I243-L299 HydrophobicContact CG1-CB 3.72Å; I243-L299 HydrophobicContact CG1-CD1 4.35Å; L246-L299 HydrophobicContact CD1-CD1 4.11Å; D295-L299 WeakPolarHBondContact O-CB 3.37Å; D295-L299 VanDerWaalsContact O-CG 3.31Å; D295-L299 WeakPolarHBondContact O-CG 3.05Å; D295-L299 PolarHBondContact O-N 3.3Å; L299-N303 WeakPolarHBondContact O-CB 3.21Å; L299-N303 PolarHBondContact O-N 3.5Å; L299-N303 PolarHBondContact O-ND2 2.89Å
300	C	94.9	Very high	91.5	Very high	56 Å²	56	45.6 Å²	45.6	38%	0.378	25%	0.253	S	S	.	.	H	α-helix	trans	-63.7	-43.3	175.6	-75.5	0	0	0	0	112.9	L296 L298 N303 F304	L296-C300 VanDerWaalsContact O-CB 3.23Å; L296-C300 WeakPolarHBondContact O-CB 3.2Å; L296-C300 PolarHBondContact O-N 3.33Å; L296-C300 PolarHBondContact O-SG 3.27Å; L298-C300 PolarHBondContact O-N 3.04Å; C300-N303 PolarHBondContact O-N 3.33Å; C300-F304 PolarHBondContact O-N 3.11Å
301	T	93.6	Very high	91.2	Very high	74 Å²	74	45.2 Å²	45.2	45%	0.454	25%	0.251	S	S	.	.	H	α-helix	trans	-68.9	-40.3	178.1	48.9	0	0	0	0	112.1	A297 L298 F304 I305	A297-T301 WeakPolarHBondContact O-CB 3.33Å; A297-T301 WeakPolarHBondContact O-CG2 3.3Å; A297-T301 PolarHBondContact O-N 3.35Å; A297-T301 PolarHBondContact O-OG1 2.95Å; L298-T301 PolarHBondContact O-N 3.23Å; L298-T301 PolarHBondContact O-OG1 3.15Å; T301-F304 PolarHBondContact O-N 3.38Å; T301-I305 WeakPolarHBondContact O-CB 3.36Å; T301-I305 WeakPolarHBondContact O-CD1 3.33Å; T301-I305 VanDerWaalsContact O-CG1 3.24Å; T301-I305 WeakPolarHBondContact O-CG1 3.4Å; T301-I305 PolarHBondContact O-N 3.45Å
302	M	92.4	Very high	90.8	Very high	27 Å²	27	48.8 Å²	48.8	13%	0.133	27%	0.267	C	S	.	.	H	α-helix	trans	-62.3	-42	173.4	-69.7	-66.8	164.6	0	0	111.9	T59 L298 F304 I305 I306	T59-M302 HydrophobicContact CG2-CB 3.74Å; T59-M302 HydrophobicContact CG2-CG 4.19Å; L298-M302 HydrophobicContact CD1-CE 3.81Å; L298-M302 HydrophobicContact CD1-CG 4.12Å; L298-M302 WeakPolarHBondContact O-CB 3.25Å; L298-M302 VanDerWaalsContact O-CG 3.25Å; L298-M302 WeakPolarHBondContact O-CG 3.4Å; L298-M302 PolarHBondContact O-N 3.47Å; M302-F304 PolarHBondContact O-N 2.66Å; M302-I305 PolarHBondContact O-N 2.98Å; M302-I306 WeakPolarHBondContact O-CD1 3.25Å; M302-I306 VanDerWaalsContact O-CG1 3.25Å; M302-I306 WeakPolarHBondContact O-CG1 3.41Å; M302-I306 PolarHBondContact O-N 3.11Å
303	N	92.8	Very high	89.9	Confident	20 Å²	20	48.8 Å²	48.8	11%	0.107	27%	0.267	C	S	.	.	H	α-helix	trans	-59.1	-46.2	173.1	-91.5	-98.8	0	0	0	112.2	M236 S239 L299 C300 I305 I306 L307	M236-N303 HydrophobicContact CE-CB 3.86Å; M236-N303 WeakPolarHBondContact CE-O 3.49Å; M236-N303 WeakPolarHBondContact CE-OD1 3.22Å; M236-N303 HydrophobicContact SD-CB 4.01Å; M236-N303 VanDerWaalsContact SD-O 3.38Å; M236-N303 PolarHBondContact SD-OD1 3.31Å; S239-N303 VanDerWaalsContact OG-CG 3.32Å; S239-N303 PolarHBondContact OG-ND2 3.48Å; S239-N303 PolarHBondContact OG-OD1 3.15Å; L299-N303 WeakPolarHBondContact O-CB 3.21Å; L299-N303 PolarHBondContact O-N 3.5Å; L299-N303 PolarHBondContact O-ND2 2.89Å; C300-N303 PolarHBondContact O-N 3.33Å; N303-I305 VanDerWaalsContact C-N 3.34Å; N303-I305 PolarHBondContact O-N 3.31Å; N303-I306 PolarHBondContact O-N 2.87Å; N303-L307 WeakPolarHBondContact O-CB 3.36Å; N303-L307 PolarHBondContact O-N 3.19Å
304	F	93.3	Very high	88.7	Confident	124 Å²	124	47.1 Å²	47.1	54%	0.544	26%	0.255	S	S	.	.	H	α-helix	trans	-62.9	-40.8	177.5	-176.8	-114	0	0	0	112	C300 T301 M302 L307 L308	C300-F304 PolarHBondContact O-N 3.11Å; T301-F304 PolarHBondContact O-N 3.38Å; M302-F304 PolarHBondContact O-N 2.66Å; F304-L307 PolarHBondContact O-N 3.21Å; F304-L308 HydrophobicContact CD1-CD1 3.96Å; F304-L308 HydrophobicContact CD1-CG 4.46Å; F304-L308 HydrophobicContact CE1-CD1 3.47Å; F304-L308 VanDerWaalsContact CE1-CD1 3.47Å; F304-L308 HydrophobicContact CE1-CG 4.16Å; F304-L308 HydrophobicContact CE2-CD1 4.43Å; F304-L308 HydrophobicContact CE2-CD2 4.43Å; F304-L308 HydrophobicContact CE2-CG 4.27Å; F304-L308 HydrophobicContact CZ-CD1 3.74Å; F304-L308 HydrophobicContact CZ-CD2 4.24Å; F304-L308 HydrophobicContact CZ-CG 4.05Å; F304-L308 WeakPolarHBondContact O-CB 3.07Å; F304-L308 WeakPolarHBondContact O-CG 3.42Å; F304-L308 PolarHBondContact O-N 2.85Å
305	I	91.9	Very high	87.4	Confident	68 Å²	68	48.7 Å²	48.7	35%	0.349	26%	0.264	S	S	.	.	H	α-helix	trans	-64.7	-40.9	176	-71.5	164.5	0	0	0	111.6	F51 T301 M302 N303 L308 N309	F51-I305 HydrophobicContact CE2-CG2 3.57Å; F51-I305 HydrophobicContact CZ-CG2 3.88Å; T301-I305 WeakPolarHBondContact O-CB 3.36Å; T301-I305 WeakPolarHBondContact O-CD1 3.33Å; T301-I305 VanDerWaalsContact O-CG1 3.24Å; T301-I305 WeakPolarHBondContact O-CG1 3.4Å; T301-I305 PolarHBondContact O-N 3.45Å; M302-I305 PolarHBondContact O-N 2.98Å; N303-I305 VanDerWaalsContact C-N 3.34Å; N303-I305 PolarHBondContact O-N 3.31Å; I305-L308 PolarHBondContact O-N 3.08Å; I305-N309 WeakPolarHBondContact O-CB 3.28Å; I305-N309 PolarHBondContact O-N 3.32Å
306	I	91.6	Very high	85.7	Confident	0 Å²	0	53 Å²	53	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-62.1	-48.8	173.1	-67.9	159.7	0	0	0	110.6	F51 V55 H232 I235 M236 M302 N303 L308 N309 L310	F51-I306 HydrophobicContact CE1-CG1 4.42Å; F51-I306 HydrophobicContact CZ-CG1 4.35Å; V55-I306 HydrophobicContact CG1-CD1 3.75Å; V55-I306 HydrophobicContact CG1-CG1 4.21Å; V55-I306 HydrophobicContact CG2-CD1 4.14Å; V55-I306 HydrophobicContact CG2-CG1 3.71Å; H232-I306 HydrophobicContact CB-CG2 4.14Å; I235-I306 HydrophobicContact CG2-CD1 3.78Å; M236-I306 HydrophobicContact CG-CG2 3.92Å; M236-I306 HydrophobicContact SD-CB 3.7Å; M236-I306 HydrophobicContact SD-CD1 4.25Å; M236-I306 HydrophobicContact SD-CG2 3.56Å; M236-I306 VanDerWaalsContact SD-CG2 3.56Å; M302-I306 WeakPolarHBondContact O-CD1 3.25Å; M302-I306 VanDerWaalsContact O-CG1 3.25Å; M302-I306 WeakPolarHBondContact O-CG1 3.41Å; M302-I306 PolarHBondContact O-N 3.11Å; N303-I306 PolarHBondContact O-N 2.87Å; I306-L308 VanDerWaalsContact C-N 3.34Å; I306-L308 PolarHBondContact O-N 2.65Å; I306-N309 PolarHBondContact O-N 3.01Å; I306-L310 HydrophobicContact CG2-CD1 4.09Å; I306-L310 HydrophobicContact CG2-CG 4.41Å; I306-L310 WeakPolarHBondContact O-CG 3.47Å; I306-L310 PolarHBondContact O-N 3.18Å
307	L	90.4	Very high	84.1	Confident	95 Å²	95	54.3 Å²	54.3	50%	0.497	29%	0.293	S	S	.	.	H	α-helix	trans	-59.8	-43.7	178.8	-178	62.7	0	0	0	111.7	M236 N303 F304 L310 L311	M236-L307 HydrophobicContact CE-CB 4.24Å; N303-L307 WeakPolarHBondContact O-CB 3.36Å; N303-L307 PolarHBondContact O-N 3.19Å; F304-L307 PolarHBondContact O-N 3.21Å; L307-L310 PolarHBondContact O-N 2.83Å; L307-L311 VanDerWaalsContact O-CB 3.29Å; L307-L311 WeakPolarHBondContact O-CB 3.3Å; L307-L311 PolarHBondContact O-N 3.4Å
308	L	88.6	Confident	82	Confident	75 Å²	75	60.5 Å²	60.5	39%	0.393	31%	0.31	S	S	.	.	H	α-helix	trans	-64	-40.6	174.9	-75.1	-177.1	0	0	0	112.6	F304 I305 I306 L311 H312	F304-L308 HydrophobicContact CD1-CD1 3.96Å; F304-L308 HydrophobicContact CD1-CG 4.46Å; F304-L308 HydrophobicContact CE1-CD1 3.47Å; F304-L308 VanDerWaalsContact CE1-CD1 3.47Å; F304-L308 HydrophobicContact CE1-CG 4.16Å; F304-L308 HydrophobicContact CE2-CD1 4.43Å; F304-L308 HydrophobicContact CE2-CD2 4.43Å; F304-L308 HydrophobicContact CE2-CG 4.27Å; F304-L308 HydrophobicContact CZ-CD1 3.74Å; F304-L308 HydrophobicContact CZ-CD2 4.24Å; F304-L308 HydrophobicContact CZ-CG 4.05Å; F304-L308 WeakPolarHBondContact O-CB 3.07Å; F304-L308 WeakPolarHBondContact O-CG 3.42Å; F304-L308 PolarHBondContact O-N 2.85Å; I305-L308 PolarHBondContact O-N 3.08Å; I306-L308 VanDerWaalsContact C-N 3.34Å; I306-L308 PolarHBondContact O-N 2.65Å; L308-L311 PolarHBondContact O-N 3.33Å; L308-H312 WeakPolarHBondContact O-CB 3.38Å; L308-H312 PolarHBondContact O-N 3.26Å
309	N	85.8	Confident	80	Confident	26 Å²	26	61.5 Å²	61.5	14%	0.139	32%	0.32	C	S	.	.	H	α-helix	trans	-65.8	-44.1	177.3	-175.1	33.4	0	0	0	111.6	F51 I305 I306 H312 L313	F51-N309 WeakPolarHBondContact CD1-ND2 3.46Å; F51-N309 HydrophobicContact CD2-CB 4.46Å; F51-N309 HydrophobicContact CE1-CB 3.96Å; F51-N309 WeakPolarHBondContact CE1-ND2 3.49Å; F51-N309 HydrophobicContact CE2-CB 3.72Å; F51-N309 HydrophobicContact CZ-CB 3.45Å; F51-N309 VanDerWaalsContact CZ-CB 3.45Å; F51-N309 WeakPolarHBondContact CZ-ND2 3.28Å; I305-N309 WeakPolarHBondContact O-CB 3.28Å; I305-N309 PolarHBondContact O-N 3.32Å; I306-N309 PolarHBondContact O-N 3.01Å; N309-H312 PolarHBondContact O-N 3.28Å; N309-L313 VanDerWaalsContact O-CB 3.31Å; N309-L313 WeakPolarHBondContact O-CB 3.38Å; N309-L313 WeakPolarHBondContact O-CG 3.18Å; N309-L313 PolarHBondContact O-N 3.13Å
310	L	82.8	Confident	78	Confident	11 Å²	11	65 Å²	65	6%	0.058	34%	0.338	C	S	.	.	H	α-helix	trans	-60.1	-46.7	173.6	-66.5	174.3	0	0	0	111.3	L229 H232 I306 L307 H312 L313 F314	L229-L310 HydrophobicContact CD1-CD1 4.47Å; L229-L310 HydrophobicContact CD1-CD2 4.24Å; H232-L310 HydrophobicContact CB-CD1 3.95Å; H232-L310 HydrophobicContact CB-CD2 3.84Å; H232-L310 HydrophobicContact CB-CG 4.28Å; I306-L310 HydrophobicContact CG2-CD1 4.09Å; I306-L310 HydrophobicContact CG2-CG 4.41Å; I306-L310 WeakPolarHBondContact O-CG 3.47Å; I306-L310 PolarHBondContact O-N 3.18Å; L307-L310 PolarHBondContact O-N 2.83Å; L310-H312 PolarHBondContact O-N 3.26Å; L310-L313 WeakPolarHBondContact O-CB 3.29Å; L310-L313 PolarHBondContact O-N 3.5Å; L310-F314 HydrophobicContact CB-CD2 4.47Å; L310-F314 HydrophobicContact CB-CE2 4.41Å; L310-F314 HydrophobicContact CD2-CE2 4.03Å; L310-F314 WeakPolarHBondContact O-CD2 3.41Å; L310-F314 PolarHBondContact O-N 3.02Å
311	L	82.4	Confident	75.7	Confident	97 Å²	97	69.9 Å²	69.9	51%	0.508	35%	0.353	S	S	.	.	H	α-helix	trans	-61.4	-44.4	178	-172.2	70.8	0	0	0	111.5	L307 L308 L313 F314 V315	L307-L311 VanDerWaalsContact O-CB 3.29Å; L307-L311 WeakPolarHBondContact O-CB 3.3Å; L307-L311 PolarHBondContact O-N 3.4Å; L308-L311 PolarHBondContact O-N 3.33Å; L311-L313 VanDerWaalsContact C-N 3.34Å; L311-L313 PolarHBondContact O-N 3.42Å; L311-F314 PolarHBondContact O-N 3.29Å; L311-V315 HydrophobicContact CD1-CB 4.47Å; L311-V315 HydrophobicContact CD1-CG2 3.69Å; L311-V315 HydrophobicContact CG-CG2 4.36Å; L311-V315 VanDerWaalsContact O-CB 3.25Å; L311-V315 WeakPolarHBondContact O-CB 3.4Å; L311-V315 PolarHBondContact O-N 2.83Å
312	H	79.8	Confident	73.6	Confident	95 Å²	95	67.6 Å²	67.6	44%	0.44	34%	0.339	S	S	.	.	I	π-helix	trans	-60.9	-41.7	174.7	176.9	-107.6	0	0	0	111.8	L308 N309 L310 V316 R317	L308-H312 WeakPolarHBondContact O-CB 3.38Å; L308-H312 PolarHBondContact O-N 3.26Å; N309-H312 PolarHBondContact O-N 3.28Å; L310-H312 PolarHBondContact O-N 3.26Å; H312-V316 PolarHBondContact O-N 3.07Å; H312-V316 VanDerWaalsContact O-N 3.16Å; H312-R317 WeakPolarHBondContact O-CB 3.46Å; H312-R317 PolarHBondContact O-N 3.42Å
313	L	72.5	Confident	71.7	Confident	1 Å²	1	67.1 Å²	67.1	1%	0.005	34%	0.336	C	S	.	.	I	π-helix	trans	-65.1	-39.6	179.4	-85.8	166.1	0	0	0	114.4	Y228 N309 L310 L311 N346 M350	Y228-L313 HydrophobicContact CE1-CD1 3.91Å; N309-L313 VanDerWaalsContact O-CB 3.31Å; N309-L313 WeakPolarHBondContact O-CB 3.38Å; N309-L313 WeakPolarHBondContact O-CG 3.18Å; N309-L313 PolarHBondContact O-N 3.13Å; L310-L313 WeakPolarHBondContact O-CB 3.29Å; L310-L313 PolarHBondContact O-N 3.5Å; L311-L313 VanDerWaalsContact C-N 3.34Å; L311-L313 PolarHBondContact O-N 3.42Å; L313-N346 PolarHBondContact O-ND2 3.4Å; L313-M350 HydrophobicContact CD1-CE 4.07Å; L313-M350 HydrophobicContact CD2-CE 3.27Å; L313-M350 HydrophobicContact CG-CE 4.16Å
314	F	67.9	Low	69.7	Low	29 Å²	29	70 Å²	70	13%	0.127	35%	0.352	C	S	.	.	I	π-helix	trans	-97.2	-24.6	-176	-61.8	-61.5	0	0	0	114.3	L229 L310 L311 P341 F342	L229-F314 HydrophobicContact CB-CZ 4.34Å; L229-F314 HydrophobicContact CD1-CE2 3.89Å; L229-F314 HydrophobicContact CD1-CZ 4.33Å; L310-F314 HydrophobicContact CB-CD2 4.47Å; L310-F314 HydrophobicContact CB-CE2 4.41Å; L310-F314 HydrophobicContact CD2-CE2 4.03Å; L310-F314 WeakPolarHBondContact O-CD2 3.41Å; L310-F314 PolarHBondContact O-N 3.02Å; L311-F314 PolarHBondContact O-N 3.29Å; F314-P341 HydrophobicContact CB-CB 4.29Å; F314-P341 HydrophobicContact CD1-CB 4.47Å; F314-P341 WeakPolarHBondContact O-CB 3.39Å; F314-F342 AromaticContact CD1-CD1 3.59Å; F314-F342 HydrophobicContact CD1-CD1 3.59Å; F314-F342 AromaticContact CD1-CE1 3.55Å; F314-F342 HydrophobicContact CD1-CE1 3.55Å; F314-F342 HydrophobicContact CD1-CG 4.45Å; F314-F342 HydrophobicContact CD1-CZ 4.39Å; F314-F342 HydrophobicContact CD2-CE1 4.19Å; F314-F342 AromaticContact CE1-CD1 3.44Å; F314-F342 HydrophobicContact CE1-CD1 3.44Å; F314-F342 VanDerWaalsContact CE1-CD1 3.44Å; F314-F342 AromaticContact CE1-CE1 3.66Å; F314-F342 HydrophobicContact CE1-CE1 3.66Å; F314-F342 HydrophobicContact CE1-CG 4.49Å; F314-F342 HydrophobicContact CE2-CE1 4.3Å; F314-F342 HydrophobicContact CG-CD1 4.36Å; F314-F342 AromaticContact CG-CE1 3.85Å; F314-F342 HydrophobicContact CG-CE1 3.85Å; F314-F342 HydrophobicContact CG-CZ 4.45Å; F314-F342 HydrophobicContact CZ-CD1 4.11Å; F314-F342 HydrophobicContact CZ-CE1 4.05Å
315	V	66	Low	67.7	Low	101 Å²	101	66 Å²	66	61%	0.612	33%	0.334	S	S	*	.	I	π-helix	trans	-106.6	-48.9	-177.1	-176.3	0	0	0	0	112.4	L311	L311-V315 HydrophobicContact CD1-CB 4.47Å; L311-V315 HydrophobicContact CD1-CG2 3.69Å; L311-V315 HydrophobicContact CG-CG2 4.36Å; L311-V315 VanDerWaalsContact O-CB 3.25Å; L311-V315 WeakPolarHBondContact O-CB 3.4Å; L311-V315 PolarHBondContact O-N 2.83Å
316	V	57.2	Low	65.7	Low	95 Å²	95	63.3 Å²	63.3	58%	0.576	32%	0.321	S	S	*	.	I	π-helix	trans	-85.6	-40.1	-171.3	-177	0	0	0	0	111.6	H312 K318	H312-V316 PolarHBondContact O-N 3.07Å; H312-V316 VanDerWaalsContact O-N 3.16Å; V316-K318 PolarHBondContact O-N 3.44Å
317	R	59.8	Low	63.8	Low	63 Å²	63	65.4 Å²	65.4	24%	0.238	33%	0.332	C	S	.	.			trans	-80.9	76.2	-173.2	-154.2	-176.7	106	95	-1	112.5	H312 S319 N346	H312-R317 WeakPolarHBondContact O-CB 3.46Å; H312-R317 PolarHBondContact O-N 3.42Å; R317-S319 PolarHBondContact O-N 3.04Å; R317-N346 VanDerWaalsContact CZ-OD1 3.31Å; R317-N346 PolarHBondContact NE-OD1 3.41Å; R317-N346 PolarHBondContact NH2-O 2.98Å; R317-N346 PolarHBondContact NH2-OD1 3.45Å
318	K	50.6	Low	61.6	Low	183 Å²	183	66.6 Å²	66.6	80%	0.796	33%	0.333	S	S	*	.			trans	-60.4	79.5	166.6	-77.1	-178.4	176.7	171.3	0	112	V316 N320	V316-K318 PolarHBondContact O-N 3.44Å; K318-N320 PolarHBondContact O-N 2.99Å
319	S	51.9	Low	59.4	Low	48 Å²	48	64.5 Å²	64.5	34%	0.336	32%	0.323	S	S	.	.	S	Bend	trans	40.2	-19.8	155.1	55.1	0	0	0	0	122.9	R317	R317-S319 PolarHBondContact O-N 3.04Å
320	N	50.9	Low	57.2	Low	77 Å²	77	64 Å²	64	41%	0.412	32%	0.324	S	S	.	.			trans	-105.4	-46.1	-147.1	-66.2	-9.9	0	0	0	115.1	K318 V322 F323 D324	K318-N320 PolarHBondContact O-N 2.99Å; N320-V322 CarbonylContact O-C 3.51Å; N320-V322 PolarHBondContact O-N 3.49Å; N320-F323 CarbonylContact O-C 3.59Å; N320-F323 WeakPolarHBondContact O-CA 3.41Å; N320-F323 PolarHBondContact O-N 2.85Å; N320-D324 HydrophobicContact CB-CB 4.46Å; N320-D324 WeakPolarHBondContact O-CB 3.48Å; N320-D324 PolarHBondContact O-N 3.21Å
321	F	47.2	Very low	55.5	Low	158 Å²	158	64.2 Å²	64.2	69%	0.693	33%	0.325	S	S	*	.	H	α-helix	trans	-44.2	-48	-157.8	-173.8	-106	0	0	0	116.5	K325	F321-K325 PolarHBondContact O-N 3.15Å
322	V	48.8	Very low	53.6	Low	27 Å²	27	65.1 Å²	65.1	16%	0.164	33%	0.325	C	S	.	.	H	α-helix	trans	-69.8	-46.7	178.4	-178.9	0	0	0	0	111.7	N320 D324 K325 L326	N320-V322 CarbonylContact O-C 3.51Å; N320-V322 PolarHBondContact O-N 3.49Å; V322-D324 VanDerWaalsContact C-N 3.26Å; V322-D324 PolarHBondContact O-N 3.37Å; V322-K325 PolarHBondContact O-N 3.09Å; V322-L326 VanDerWaalsContact O-CD1 3.25Å; V322-L326 WeakPolarHBondContact O-CD1 3.46Å; V322-L326 PolarHBondContact O-N 3.07Å
323	F	52.8	Low	52	Low	16 Å²	16	62 Å²	62	7%	0.07	31%	0.313	C	S	.	.	H	α-helix	trans	-71.2	-20.1	177.2	-75.8	-62.8	0	0	0	113.4	L215 N320 L326 N327 I345 A349	L215-F323 HydrophobicContact CD1-CE1 4.21Å; L215-F323 HydrophobicContact CD2-CE1 4.03Å; L215-F323 HydrophobicContact CD2-CZ 4.28Å; N320-F323 CarbonylContact O-C 3.59Å; N320-F323 WeakPolarHBondContact O-CA 3.41Å; N320-F323 PolarHBondContact O-N 2.85Å; F323-L326 HydrophobicContact CD1-CD2 4.45Å; F323-L326 CarbonylContact O-C 3.59Å; F323-L326 WeakPolarHBondContact O-CB 3.39Å; F323-L326 PolarHBondContact O-N 2.79Å; F323-N327 PolarHBondContact O-N 3.43Å; F323-I345 HydrophobicContact CD2-CD1 4.34Å; F323-I345 HydrophobicContact CD2-CG1 4.07Å; F323-I345 HydrophobicContact CE1-CD1 4.32Å; F323-I345 HydrophobicContact CE2-CD1 3.44Å; F323-I345 VanDerWaalsContact CE2-CD1 3.44Å; F323-I345 HydrophobicContact CE2-CG1 3.49Å; F323-I345 VanDerWaalsContact CE2-CG1 3.49Å; F323-I345 HydrophobicContact CZ-CD1 3.45Å; F323-I345 VanDerWaalsContact CZ-CD1 3.45Å; F323-I345 HydrophobicContact CZ-CG1 4.06Å; F323-A349 HydrophobicContact CD2-CB 4.26Å; F323-A349 HydrophobicContact CE2-CB 3.77Å
324	D	51.8	Low	50.4	Low	80 Å²	80	71.1 Å²	71.1	43%	0.428	35%	0.352	S	S	.	.	H	α-helix	trans	-76.5	-32.1	175.3	-147.2	37	0	0	0	111.6	N320 V322 L326 N327 K328	N320-D324 HydrophobicContact CB-CB 4.46Å; N320-D324 WeakPolarHBondContact O-CB 3.48Å; N320-D324 PolarHBondContact O-N 3.21Å; V322-D324 VanDerWaalsContact C-N 3.26Å; V322-D324 PolarHBondContact O-N 3.37Å; D324-L326 VanDerWaalsContact C-N 3.31Å; D324-N327 WeakPolarHBondContact O-CB 3.36Å; D324-N327 PolarHBondContact O-N 3.47Å; D324-N327 PolarHBondContact OD1-ND2 3.03Å; D324-K328 PolarHBondContact O-N 2.95Å
325	K	50.8	Low	49.1	Very low	40 Å²	40	81.7 Å²	81.7	17%	0.174	39%	0.391	C	S	.	.	H	α-helix	trans	-62.8	-35.8	163.2	-70.9	-156	170	-151.3	0	112.2	F321 V322 K328 D366	F321-K325 PolarHBondContact O-N 3.15Å; V322-K325 PolarHBondContact O-N 3.09Å; K325-K328 PolarHBondContact O-N 2.76Å; K325-D366 IonicContact NZ-OD1 2.69Å; K325-D366 PolarHBondContact NZ-OD1 3.4Å
326	L	51.1	Low	47.8	Very low	13 Å²	13	87.8 Å²	87.8	7%	0.068	40%	0.403	C	S	.	.	H	α-helix	trans	-71.8	-33.1	172.1	-83.4	81.9	0	0	0	113.2	I162 V322 F323 D324 K328 V329 I331	I162-L326 HydrophobicContact CD1-CD2 3.89Å; I162-L326 HydrophobicContact CG1-CD2 4.02Å; I162-L326 HydrophobicContact CG2-CD2 4.48Å; V322-L326 VanDerWaalsContact O-CD1 3.25Å; V322-L326 WeakPolarHBondContact O-CD1 3.46Å; V322-L326 PolarHBondContact O-N 3.07Å; F323-L326 HydrophobicContact CD1-CD2 4.45Å; F323-L326 CarbonylContact O-C 3.59Å; F323-L326 WeakPolarHBondContact O-CB 3.39Å; F323-L326 PolarHBondContact O-N 2.79Å; D324-L326 VanDerWaalsContact C-N 3.31Å; L326-K328 VanDerWaalsContact C-N 3.25Å; L326-K328 PolarHBondContact O-N 2.84Å; L326-V329 PolarHBondContact O-N 2.99Å; L326-I331 HydrophobicContact CB-CD1 4.5Å; L326-I331 HydrophobicContact CD2-CD1 4.3Å
327	N	50.2	Low	47.5	Very low	44 Å²	44	86.9 Å²	86.9	24%	0.235	39%	0.39	C	S	.	.	H	α-helix	trans	-57.3	-40.6	172.9	-72.9	-32.1	0	0	0	110.5	F323 D324 V329 G330 I331 T333	F323-N327 PolarHBondContact O-N 3.43Å; D324-N327 WeakPolarHBondContact O-CB 3.36Å; D324-N327 PolarHBondContact O-N 3.47Å; D324-N327 PolarHBondContact OD1-ND2 3.03Å; N327-V329 PolarHBondContact O-N 2.95Å; N327-G330 PolarHBondContact O-N 2.73Å; N327-I331 PolarHBondContact OD1-O 3.04Å; N327-T333 PolarHBondContact OD1-OG1 2.83Å
328	K	45.4	Very low	46.6	Very low	120 Å²	120	90.8 Å²	90.8	52%	0.522	41%	0.411	S	S	.	.	H	α-helix	trans	-60.6	-23.6	175.5	-68	-170.9	-179.5	-168.3	0	114	D324 K325 L326 G330 D373	D324-K328 PolarHBondContact O-N 2.95Å; K325-K328 PolarHBondContact O-N 2.76Å; L326-K328 VanDerWaalsContact C-N 3.25Å; L326-K328 PolarHBondContact O-N 2.84Å; K328-G330 PolarHBondContact O-N 3.22Å; K328-D373 IonicContact NZ-OD1 3.57Å; K328-D373 PolarHBondContact NZ-OD1 2.05Å; K328-D373 IonicContact NZ-OD2 2.69Å; K328-D373 PolarHBondContact NZ-OD2 3.43Å
329	V	42.1	Very low	46.6	Very low	31 Å²	31	92 Å²	92	19%	0.188	42%	0.416	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	1	175.2	-160.2	0	0	0	0	112.2	A169 R173 L326 N327 L365	A169-V329 HydrophobicContact CB-CG1 4.41Å; R173-V329 PolarHBondContact NH1-O 2.88Å; R173-V329 PolarHBondContact NH2-O 3.31Å; L326-V329 PolarHBondContact O-N 2.99Å; N327-V329 PolarHBondContact O-N 2.95Å; V329-L365 HydrophobicContact CG2-CD1 3.53Å; V329-L365 HydrophobicContact CG2-CD2 3.9Å; V329-L365 HydrophobicContact CG2-CG 4.31Å
330	G	38.8	Very low	46.6	Very low	15 Å²	15	92 Å²	92	16%	0.155	42%	0.416	C	S	.	.	T	Hydrogen-bonded Turn	trans	99.4	5.6	174.8	0	0	0	0	0	115	N327 K328 K332	N327-G330 PolarHBondContact O-N 2.73Å; K328-G330 PolarHBondContact O-N 3.22Å; G330-K332 PolarHBondContact O-N 2.93Å
331	I	47.7	Very low	47	Very low	16 Å²	16	90.9 Å²	90.9	8%	0.082	41%	0.413	C	S	.	.			trans	-75.4	75.7	166.7	-51.2	176.8	0	0	0	107.5	F211 E212 L326 N327 T333	F211-I331 HydrophobicContact CD1-CD1 3.91Å; F211-I331 HydrophobicContact CE1-CD1 3.88Å; E212-I331 HydrophobicContact CB-CG2 4.37Å; E212-I331 HydrophobicContact CG-CG2 4.41Å; L326-I331 HydrophobicContact CB-CD1 4.5Å; L326-I331 HydrophobicContact CD2-CD1 4.3Å; N327-I331 PolarHBondContact OD1-O 3.04Å; I331-T333 HydrophobicContact CG2-CG2 3.96Å; I331-T333 PolarHBondContact O-N 2.99Å
332	K	43.1	Very low	47.8	Very low	115 Å²	115	87.6 Å²	87.6	50%	0.5	40%	0.398	S	S	.	.			trans	-71.9	71.1	-174.6	-69.8	178.2	-179.8	171.5	0	111.9	E201 G330 K334	E201-K332 IonicContact OE2-NZ 4Å; E201-K332 PolarHBondContact OE2-NZ 3.22Å; G330-K332 PolarHBondContact O-N 2.93Å; K332-K334 PolarHBondContact O-N 2.81Å
333	T	44.8	Very low	48.9	Very low	31 Å²	31	86.8 Å²	86.8	19%	0.19	39%	0.394	C	S	.	.			trans	-58.6	125.7	-176.8	60.9	0	0	0	0	111.6	N327 I331 R335 W337	N327-T333 PolarHBondContact OD1-OG1 2.83Å; I331-T333 HydrophobicContact CG2-CG2 3.96Å; I331-T333 PolarHBondContact O-N 2.99Å; T333-R335 PolarHBondContact O-N 2.84Å; T333-W337 HydrophobicContact CG2-CZ2 4.15Å; T333-W337 PolarHBondContact OG1-NE1 3.11Å
334	K	39.8	Very low	50.1	Low	192 Å²	192	86.2 Å²	86.2	84%	0.835	39%	0.391	S	S	*	.			trans	-85.1	67.5	-155.9	-152.4	179.8	-172.4	-178	0	114.7	K332 R336	K332-K334 PolarHBondContact O-N 2.81Å; K334-R336 PolarHBondContact O-N 3.35Å
335	R	40.4	Very low	51.1	Low	250 Å²	250	82.9 Å²	82.9	94%	0.943	37%	0.373	S	S	*	.	S	Bend	trans	55.4	6.6	160.2	-119.8	-177.1	-168.2	-172.8	5.2	118.8	T333	T333-R335 PolarHBondContact O-N 2.84Å
336	R	39.2	Very low	52.3	Low	230 Å²	230	81.3 Å²	81.3	87%	0.868	37%	0.367	S	S	*	.			trans	-136.8	52	178.9	-70.5	-167.5	178.4	-168.8	1.1	113.5	K334 Q338	K334-R336 PolarHBondContact O-N 3.35Å; R336-Q338 PolarHBondContact O-N 2.9Å
337	W	49.8	Very low	53.5	Low	76 Å²	76	80.9 Å²	80.9	29%	0.288	37%	0.365	S	S	.	.			trans	-56.7	125.7	145.8	-63.7	101.9	0	0	0	106.9	L215 T333 I345	L215-W337 HydrophobicContact CB-CH2 4.15Å; T333-W337 HydrophobicContact CG2-CZ2 4.15Å; T333-W337 PolarHBondContact OG1-NE1 3.11Å; W337-I345 HydrophobicContact CE3-CG2 4.17Å; W337-I345 HydrophobicContact CH2-CD1 4.08Å; W337-I345 HydrophobicContact CH2-CG1 3.8Å; W337-I345 HydrophobicContact CZ3-CB 4.06Å; W337-I345 HydrophobicContact CZ3-CD1 4.29Å; W337-I345 HydrophobicContact CZ3-CG1 3.68Å; W337-I345 HydrophobicContact CZ3-CG2 3.92Å
338	Q	40.3	Very low	54.8	Low	145 Å²	145	78.9 Å²	78.9	68%	0.678	35%	0.354	S	S	*	.			trans	-59.4	148.2	-177.5	-89.9	-71.7	7.2	0	0	110.4	R336 S340	R336-Q338 PolarHBondContact O-N 2.9Å; Q338-S340 PolarHBondContact O-N 3Å
339	K	50.9	Low	56.1	Low	208 Å²	208	73.2 Å²	73.2	90%	0.904	33%	0.33	S	S	*	.	S	Bend	trans	-69.9	12.1	177.3	-64.8	-175.3	178.8	-178.6	0	113.5
340	S	53	Low	57.6	Low	48 Å²	48	74 Å²	74	34%	0.336	33%	0.332	S	S	.	.			trans	-81.2	128.6	177.6	179.4	0	0	0	0	110.1	Q338 F342	Q338-S340 PolarHBondContact O-N 3Å; S340-F342 PolarHBondContact O-N 2.9Å; S340-F342 PolarHBondContact OG-N 3.3Å
341	P	60	Low	59.4	Low	53 Å²	53	73.3 Å²	73.3	34%	0.344	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-10.2	174.2	30	-33.6	0	0	0	113.7	F314	F314-P341 HydrophobicContact CB-CB 4.29Å; F314-P341 HydrophobicContact CD1-CB 4.47Å; F314-P341 WeakPolarHBondContact O-CB 3.39Å
342	F	63.3	Low	60.5	Low	90 Å²	90	73.1 Å²	73.1	40%	0.395	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.7	16	-169.9	-64.7	-71.9	0	0	0	115.5	N222 A225 L229 F314 S340	N222-F342 PolarHBondContact OD1-O 2.92Å; N222-F342 VanDerWaalsContact OD1-O 3.12Å; A225-F342 WeakPolarHBondContact CB-O 3.44Å; L229-F342 HydrophobicContact CD2-CE1 4.12Å; F314-F342 AromaticContact CD1-CD1 3.59Å; F314-F342 HydrophobicContact CD1-CD1 3.59Å; F314-F342 AromaticContact CD1-CE1 3.55Å; F314-F342 HydrophobicContact CD1-CE1 3.55Å; F314-F342 HydrophobicContact CD1-CG 4.45Å; F314-F342 HydrophobicContact CD1-CZ 4.39Å; F314-F342 HydrophobicContact CD2-CE1 4.19Å; F314-F342 AromaticContact CE1-CD1 3.44Å; F314-F342 HydrophobicContact CE1-CD1 3.44Å; F314-F342 VanDerWaalsContact CE1-CD1 3.44Å; F314-F342 AromaticContact CE1-CE1 3.66Å; F314-F342 HydrophobicContact CE1-CE1 3.66Å; F314-F342 HydrophobicContact CE1-CG 4.49Å; F314-F342 HydrophobicContact CE2-CE1 4.3Å; F314-F342 HydrophobicContact CG-CD1 4.36Å; F314-F342 AromaticContact CG-CE1 3.85Å; F314-F342 HydrophobicContact CG-CE1 3.85Å; F314-F342 HydrophobicContact CG-CZ 4.45Å; F314-F342 HydrophobicContact CZ-CD1 4.11Å; F314-F342 HydrophobicContact CZ-CE1 4.05Å; S340-F342 PolarHBondContact O-N 2.9Å; S340-F342 PolarHBondContact OG-N 3.3Å
343	C	70.7	Confident	61.9	Low	10 Å²	10	71.8 Å²	71.8	7%	0.068	32%	0.323	C	S	.	.			trans	-73.9	137.8	-179.6	-63.2	0	0	0	0	112.7	G219 I345 N346	G219-C343 PolarHBondContact O-SG 3.28Å; C343-I345 HydrophobicContact CB-CG2 3.77Å; C343-I345 PolarHBondContact O-N 3.5Å; C343-I345 VanDerWaalsContact O-N 3.09Å; C343-N346 WeakPolarHBondContact O-CB 3.43Å; C343-N346 PolarHBondContact O-N 2.68Å
344	D	78	Confident	63.4	Low	3 Å²	3	72.4 Å²	72.4	2%	0.016	32%	0.324	C	S	.	.	H	α-helix	trans	-57.5	-29.8	-177.8	-68.1	-23.6	0	0	0	113.4	S221 N222 F223 L224 A225 N346 I347 L348	S221-D344 VanDerWaalsContact C-CG 3.42Å; S221-D344 WeakPolarHBondContact CB-OD2 3.34Å; S221-D344 VanDerWaalsContact O-CG 3.22Å; S221-D344 PolarHBondContact O-N 3.09Å; S221-D344 PolarHBondContact OG-OD2 3.08Å; N222-D344 VanDerWaalsContact CA-OD1 3.22Å; N222-D344 WeakPolarHBondContact CA-OD1 3.43Å; N222-D344 PolarHBondContact N-OD2 3.31Å; F223-D344 VanDerWaalsContact N-CG 3.3Å; F223-D344 PolarHBondContact N-OD1 3.23Å; F223-D344 PolarHBondContact N-OD2 2.9Å; L224-D344 WeakPolarHBondContact CA-OD1 3.49Å; L224-D344 HydrophobicContact CB-CB 4.17Å; L224-D344 PolarHBondContact N-OD1 3.33Å; L224-D344 PolarHBondContact N-OD2 3.35Å; A225-D344 WeakPolarHBondContact CB-OD1 3.37Å; A225-D344 PolarHBondContact N-OD1 2.84Å; D344-N346 PolarHBondContact O-N 3.37Å; D344-I347 PolarHBondContact O-N 2.78Å; D344-I347 VanDerWaalsContact O-N 3.15Å; D344-L348 PolarHBondContact O-N 2.96Å
345	I	73.7	Confident	64.9	Low	10 Å²	10	63.3 Å²	63.3	5%	0.051	28%	0.284	C	S	.	.	H	α-helix	trans	-54.9	-31.8	175.1	-162.8	67.7	0	0	0	113.4	L215 F323 W337 C343 A349	L215-I345 HydrophobicContact CD2-CD1 3.97Å; F323-I345 HydrophobicContact CD2-CD1 4.34Å; F323-I345 HydrophobicContact CD2-CG1 4.07Å; F323-I345 HydrophobicContact CE1-CD1 4.32Å; F323-I345 HydrophobicContact CE2-CD1 3.44Å; F323-I345 VanDerWaalsContact CE2-CD1 3.44Å; F323-I345 HydrophobicContact CE2-CG1 3.49Å; F323-I345 VanDerWaalsContact CE2-CG1 3.49Å; F323-I345 HydrophobicContact CZ-CD1 3.45Å; F323-I345 VanDerWaalsContact CZ-CD1 3.45Å; F323-I345 HydrophobicContact CZ-CG1 4.06Å; W337-I345 HydrophobicContact CE3-CG2 4.17Å; W337-I345 HydrophobicContact CH2-CD1 4.08Å; W337-I345 HydrophobicContact CH2-CG1 3.8Å; W337-I345 HydrophobicContact CZ3-CB 4.06Å; W337-I345 HydrophobicContact CZ3-CD1 4.29Å; W337-I345 HydrophobicContact CZ3-CG1 3.68Å; W337-I345 HydrophobicContact CZ3-CG2 3.92Å; C343-I345 HydrophobicContact CB-CG2 3.77Å; C343-I345 PolarHBondContact O-N 3.5Å; C343-I345 VanDerWaalsContact O-N 3.09Å; I345-A349 WeakPolarHBondContact O-CB 3.09Å; I345-A349 PolarHBondContact O-N 3.31Å; I345-A349 VanDerWaalsContact O-N 3.08Å
346	N	75.1	Confident	66.2	Low	8 Å²	8	54.1 Å²	54.1	4%	0.043	25%	0.249	C	C	.	.	H	α-helix	trans	-68.5	-40.8	179.5	-173.8	10.8	0	0	0	111.2	L313 R317 C343 D344	L313-N346 PolarHBondContact O-ND2 3.4Å; R317-N346 VanDerWaalsContact CZ-OD1 3.31Å; R317-N346 PolarHBondContact NE-OD1 3.41Å; R317-N346 PolarHBondContact NH2-O 2.98Å; R317-N346 PolarHBondContact NH2-OD1 3.45Å; C343-N346 WeakPolarHBondContact O-CB 3.43Å; C343-N346 PolarHBondContact O-N 2.68Å; D344-N346 PolarHBondContact O-N 3.37Å
347	I	77.8	Confident	67.3	Low	4 Å²	4	48.6 Å²	48.6	2%	0.021	24%	0.237	C	C	.	.	H	α-helix	trans	-72.7	-47.2	177.1	-57.5	-55	0	0	0	110.2	L224 A225 Y228 D344 A349 M350 F351	L224-I347 HydrophobicContact CD2-CB 4.43Å; L224-I347 HydrophobicContact CD2-CG2 4.13Å; L224-I347 HydrophobicContact CG-CG2 4.21Å; A225-I347 HydrophobicContact CB-CG1 4.16Å; Y228-I347 HydrophobicContact CD1-CD1 3.81Å; Y228-I347 HydrophobicContact CE1-CD1 4.35Å; Y228-I347 HydrophobicContact CG-CD1 4.25Å; Y228-I347 HydrophobicContact CG-CG2 4.43Å; D344-I347 PolarHBondContact O-N 2.78Å; D344-I347 VanDerWaalsContact O-N 3.15Å; I347-A349 VanDerWaalsContact C-N 3.3Å; I347-A349 PolarHBondContact O-N 2.73Å; I347-M350 WeakPolarHBondContact O-CB 3.37Å; I347-M350 PolarHBondContact O-N 3.46Å; I347-F351 HydrophobicContact CG2-CD2 3.93Å; I347-F351 HydrophobicContact CG2-CE2 3.65Å; I347-F351 WeakPolarHBondContact O-CD2 3.47Å; I347-F351 PolarHBondContact O-N 3.45Å
348	L	76.8	Confident	67.9	Low	1 Å²	1	49.2 Å²	49.2	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-59.1	-39.7	-177.7	-170	54.3	0	0	0	112.1	L151 L155 L158 D344 M350 F351 C352	L151-L348 HydrophobicContact CD1-CD1 4.27Å; L155-L348 HydrophobicContact CD1-CD1 4.04Å; L158-L348 HydrophobicContact CD1-CD2 3.66Å; L158-L348 HydrophobicContact CD1-CG 4.1Å; D344-L348 PolarHBondContact O-N 2.96Å; L348-M350 VanDerWaalsContact C-N 3.25Å; L348-M350 PolarHBondContact O-N 3.39Å; L348-F351 PolarHBondContact O-N 3.33Å; L348-C352 PolarHBondContact O-N 2.94Å; L348-C352 PolarHBondContact O-SG 3.45Å
349	A	73	Confident	69	Low	2 Å²	2	43 Å²	43	2%	0.017	21%	0.214	C	C	.	.	H	α-helix	trans	-58.3	-30.5	173.1	0	0	0	0	0	114.4	F323 I345 I347 N353	F323-A349 HydrophobicContact CD2-CB 4.26Å; F323-A349 HydrophobicContact CE2-CB 3.77Å; I345-A349 WeakPolarHBondContact O-CB 3.09Å; I345-A349 PolarHBondContact O-N 3.31Å; I345-A349 VanDerWaalsContact O-N 3.08Å; I347-A349 VanDerWaalsContact C-N 3.3Å; I347-A349 PolarHBondContact O-N 2.73Å; A349-N353 PolarHBondContact O-N 2.93Å
350	M	73.6	Confident	69.4	Low	47 Å²	47	41.4 Å²	41.4	23%	0.232	21%	0.207	C	C	.	.	H	α-helix	trans	-75.3	-45.2	177.8	-158.9	-170.1	-38.8	0	0	111.1	L49 L313 I347 L348 C352 N353 E354	L49-M350 HydrophobicContact CD2-CE 4.02Å; L49-M350 HydrophobicContact CD2-SD 3.39Å; L49-M350 WeakPolarHBondContact CD2-SD 3.26Å; L49-M350 HydrophobicContact CG-SD 3.78Å; L313-M350 HydrophobicContact CD1-CE 4.07Å; L313-M350 HydrophobicContact CD2-CE 3.27Å; L313-M350 HydrophobicContact CG-CE 4.16Å; I347-M350 WeakPolarHBondContact O-CB 3.37Å; I347-M350 PolarHBondContact O-N 3.46Å; L348-M350 VanDerWaalsContact C-N 3.25Å; L348-M350 PolarHBondContact O-N 3.39Å; M350-C352 PolarHBondContact O-N 2.86Å; M350-N353 PolarHBondContact O-N 2.89Å; M350-E354 PolarHBondContact O-N 2.9Å
351	F	75.5	Confident	69.6	Low	1 Å²	1	39.4 Å²	39.4	0%	0.004	19%	0.193	C	C	.	.	H	α-helix	trans	-58.7	-37.3	173.2	-75.8	-78.6	0	0	0	112.1	L47 L49 W143 L151 L155 I347 L348 N355	L47-F351 WeakPolarHBondContact O-CE1 3.42Å; L49-F351 HydrophobicContact CD1-CD1 3.64Å; L49-F351 HydrophobicContact CD1-CD2 4.19Å; L49-F351 HydrophobicContact CD1-CE1 3.21Å; L49-F351 HydrophobicContact CD1-CE2 3.81Å; L49-F351 HydrophobicContact CD1-CG 4.11Å; L49-F351 HydrophobicContact CD1-CZ 3.3Å; W143-F351 HydrophobicContact CH2-CZ 4.36Å; W143-F351 HydrophobicContact CZ2-CE2 4.3Å; W143-F351 AromaticContact CZ2-CZ 3.69Å; W143-F351 HydrophobicContact CZ2-CZ 3.69Å; L151-F351 HydrophobicContact CD1-CD2 4.41Å; L151-F351 HydrophobicContact CD2-CD1 3.84Å; L151-F351 HydrophobicContact CD2-CD2 4.02Å; L151-F351 HydrophobicContact CD2-CE1 3.59Å; L151-F351 HydrophobicContact CD2-CE2 3.79Å; L151-F351 HydrophobicContact CD2-CG 4.05Å; L151-F351 HydrophobicContact CD2-CZ 3.57Å; L155-F351 HydrophobicContact CD1-CB 3.96Å; L155-F351 HydrophobicContact CD2-CB 4.11Å; I347-F351 HydrophobicContact CG2-CD2 3.93Å; I347-F351 HydrophobicContact CG2-CE2 3.65Å; I347-F351 WeakPolarHBondContact O-CD2 3.47Å; I347-F351 PolarHBondContact O-N 3.45Å; L348-F351 PolarHBondContact O-N 3.33Å; F351-N355 WeakPolarHBondContact O-CB 3.44Å; F351-N355 PolarHBondContact O-N 3.2Å; F351-N355 PolarHBondContact O-ND2 2.96Å
352	C	71.8	Confident	69.7	Low	12 Å²	12	38 Å²	38	8%	0.081	18%	0.183	C	C	.	.	H	α-helix	trans	-64.3	-37.4	173.4	-62.4	0	0	0	0	113	L158 L348 M350 R356	L158-C352 WeakPolarHBondContact CD2-SG 3.32Å; L348-C352 PolarHBondContact O-N 2.94Å; L348-C352 PolarHBondContact O-SG 3.45Å; M350-C352 PolarHBondContact O-N 2.86Å; C352-R356 PolarHBondContact O-N 2.81Å; C352-R356 VanDerWaalsContact O-N 3.14Å
353	N	73.4	Confident	69.7	Low	86 Å²	86	36.3 Å²	36.3	46%	0.46	18%	0.178	S	C	.	.	H	α-helix	trans	-72.5	-38.6	179.3	-170	93	0	0	0	112.1	A349 M350 R356	A349-N353 PolarHBondContact O-N 2.93Å; M350-N353 PolarHBondContact O-N 2.89Å; N353-R356 WeakPolarHBondContact O-CB 3.39Å; N353-R356 PolarHBondContact O-N 3.18Å
354	E	74.4	Confident	69.1	Low	45 Å²	45	43.2 Å²	43.2	21%	0.21	20%	0.202	C	C	.	.	H	α-helix	trans	-71.1	-30.6	176.8	-175.2	56.8	-139.9	0	0	112.7	K46 P50 M350	K46-E354 HydrophobicContact CB-CG 4.37Å; K46-E354 HydrophobicContact CD-CG 3.93Å; K46-E354 WeakPolarHBondContact CD-OE1 3.2Å; K46-E354 IonicContact NZ-OE1 3.51Å; K46-E354 PolarHBondContact NZ-OE1 3.11Å; P50-E354 WeakPolarHBondContact CD-OE2 3.25Å; M350-E354 PolarHBondContact O-N 2.9Å
355	N	71.8	Confident	68.2	Low	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.7	8.2	177	-71.3	-85.1	0	0	0	113.5	L45 K46 L159 F351 D357 H358	L45-N355 VanDerWaalsContact CA-OD1 3.29Å; L45-N355 WeakPolarHBondContact CA-OD1 3.18Å; L45-N355 WeakPolarHBondContact CB-OD1 3.37Å; L45-N355 HydrophobicContact CD2-CB 3.93Å; K46-N355 PolarHBondContact N-OD1 2.64Å; K46-N355 PolarHBondContact O-ND2 3.36Å; L159-N355 HydrophobicContact CD2-CB 4.38Å; F351-N355 WeakPolarHBondContact O-CB 3.44Å; F351-N355 PolarHBondContact O-N 3.2Å; F351-N355 PolarHBondContact O-ND2 2.96Å; N355-D357 VanDerWaalsContact C-N 3.26Å; N355-D357 PolarHBondContact O-N 2.75Å; N355-H358 PolarHBondContact O-CD2 3.41Å; N355-H358 PolarHBondContact O-N 2.87Å
356	R	67.9	Low	67.5	Low	57 Å²	57	45.3 Å²	45.3	22%	0.215	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-54.2	-38.5	-176.8	166.5	174.4	162.6	172.1	-6.2	113.4	C352 N353 H358 I359 L362 N363 D366	C352-R356 PolarHBondContact O-N 2.81Å; C352-R356 VanDerWaalsContact O-N 3.14Å; N353-R356 WeakPolarHBondContact O-CB 3.39Å; N353-R356 PolarHBondContact O-N 3.18Å; R356-H358 PolarHBondContact O-N 3.3Å; R356-I359 WeakPolarHBondContact O-CB 3.39Å; R356-I359 PolarHBondContact O-N 3.03Å; R356-L362 HydrophobicContact CB-CD2 4.24Å; R356-L362 HydrophobicContact CG-CD2 3.71Å; R356-N363 VanDerWaalsContact CZ-OD1 3.22Å; R356-N363 PolarHBondContact NE-OD1 2.85Å; R356-N363 PolarHBondContact NH2-OD1 2.84Å; R356-D366 IonicContact CZ-OD2 2.88Å; R356-D366 IonicContact NH1-OD1 3.66Å; R356-D366 IonicContact NH1-OD2 3.35Å; R356-D366 PolarHBondContact NH1-OD2 3.48Å; R356-D366 VanDerWaalsContact NH2-CB 3.26Å; R356-D366 VanDerWaalsContact NH2-CG 3.31Å; R356-D366 IonicContact NH2-OD2 3.73Å; R356-D366 PolarHBondContact NH2-OD2 3.03Å
357	D	63.1	Low	66.7	Low	114 Å²	114	51 Å²	51	61%	0.61	24%	0.238	S	C	*	.	G	3₁₀ helix	trans	-67.2	-20.7	-173.4	-64	-40.6	0	0	0	113.8	N355 I359	N355-D357 VanDerWaalsContact C-N 3.26Å; N355-D357 PolarHBondContact O-N 2.75Å; D357-I359 PolarHBondContact O-N 2.85Å
358	H	61.3	Low	65.6	Low	90 Å²	90	54.3 Å²	54.3	42%	0.417	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-71.4	-13.2	171.8	-59.5	-93.7	0	0	0	112.4	V43 N355 R356	V43-H358 HydrophobicContact CG1-CB 4.25Å; N355-H358 PolarHBondContact O-CD2 3.41Å; N355-H358 PolarHBondContact O-N 2.87Å; R356-H358 PolarHBondContact O-N 3.3Å
359	I	63.3	Low	64.5	Low	13 Å²	13	54.6 Å²	54.6	7%	0.067	26%	0.257	C	S	.	.			trans	-109.6	98.9	-172.8	-35.4	165.1	0	0	0	111.1	L159 R356 D357 S361 L362 N363	L159-I359 HydrophobicContact CD1-CD1 4.48Å; L159-I359 HydrophobicContact CD2-CD1 3.77Å; L159-I359 HydrophobicContact CD2-CG1 3.82Å; L159-I359 HydrophobicContact CG-CD1 3.6Å; L159-I359 HydrophobicContact CG-CG1 4.08Å; R356-I359 WeakPolarHBondContact O-CB 3.39Å; R356-I359 PolarHBondContact O-N 3.03Å; D357-I359 PolarHBondContact O-N 2.85Å; I359-S361 VanDerWaalsContact C-N 3.28Å; I359-S361 WeakPolarHBondContact CG2-OG 3.47Å; I359-S361 PolarHBondContact O-N 3.14Å; I359-L362 HydrophobicContact CB-CB 3.83Å; I359-L362 HydrophobicContact CD1-CB 4.06Å; I359-L362 HydrophobicContact CD1-CD1 4.3Å; I359-L362 HydrophobicContact CG2-CB 3.9Å; I359-L362 PolarHBondContact O-N 2.86Å; I359-N363 PolarHBondContact O-N 2.86Å
360	K	60.6	Low	63.7	Low	176 Å²	176	59.7 Å²	59.7	77%	0.765	28%	0.284	S	S	*	.	H	α-helix	trans	-62.7	-32.4	179	-67.3	176.1	-177.5	171.9	0	112.9	R364	K360-R364 WeakPolarHBondContact O-CG 3.26Å; K360-R364 PolarHBondContact O-N 2.9Å; K360-R364 VanDerWaalsContact O-N 3.15Å
361	S	57.3	Low	62.6	Low	5 Å²	5	62.3 Å²	62.3	4%	0.035	30%	0.296	C	S	.	.	H	α-helix	trans	-71.6	-36.9	175	56.6	0	0	0	0	113.1	D163 I359 R364 L365	D163-S361 WeakPolarHBondContact OD1-CB 3.19Å; D163-S361 PolarHBondContact OD1-OG 3.06Å; I359-S361 VanDerWaalsContact C-N 3.28Å; I359-S361 WeakPolarHBondContact CG2-OG 3.47Å; I359-S361 PolarHBondContact O-N 3.14Å; S361-R364 CarbonylContact O-C 3.58Å; S361-R364 PolarHBondContact O-N 2.98Å; S361-L365 VanDerWaalsContact O-CB 3.27Å; S361-L365 WeakPolarHBondContact O-CB 3.18Å; S361-L365 PolarHBondContact O-N 2.75Å
362	L	61.2	Low	61.4	Low	25 Å²	25	64.3 Å²	64.3	13%	0.131	31%	0.31	C	S	.	.	H	α-helix	trans	-69.6	-35.4	179.2	-148.9	106.9	0	0	0	111.7	I162 R356 I359 L365 D366	I162-L362 HydrophobicContact CG2-CD1 3.76Å; R356-L362 HydrophobicContact CB-CD2 4.24Å; R356-L362 HydrophobicContact CG-CD2 3.71Å; I359-L362 HydrophobicContact CB-CB 3.83Å; I359-L362 HydrophobicContact CD1-CB 4.06Å; I359-L362 HydrophobicContact CD1-CD1 4.3Å; I359-L362 HydrophobicContact CG2-CB 3.9Å; I359-L362 PolarHBondContact O-N 2.86Å; L362-L365 PolarHBondContact O-N 3.09Å; L362-D366 WeakPolarHBondContact O-CB 3.11Å; L362-D366 PolarHBondContact O-N 3.15Å
363	N	63	Low	60.3	Low	54 Å²	54	66.7 Å²	66.7	29%	0.289	32%	0.322	S	S	.	.	H	α-helix	trans	-67.4	-38.9	171	-87.6	-28.1	0	0	0	112.5	R356 I359 D366 F367	R356-N363 VanDerWaalsContact CZ-OD1 3.22Å; R356-N363 PolarHBondContact NE-OD1 2.85Å; R356-N363 PolarHBondContact NH2-OD1 2.84Å; I359-N363 PolarHBondContact O-N 2.86Å; N363-D366 PolarHBondContact O-N 3.07Å; N363-F367 PolarHBondContact O-N 2.8Å; N363-F367 VanDerWaalsContact O-N 3.08Å
364	R	59.4	Low	59	Low	154 Å²	154	67.9 Å²	67.9	58%	0.581	33%	0.328	S	S	*	.	H	α-helix	trans	-64.3	-39.8	170.3	-75	171.3	172.2	-176.4	-4.2	112.4	K360 S361 F367 I368	K360-R364 WeakPolarHBondContact O-CG 3.26Å; K360-R364 PolarHBondContact O-N 2.9Å; K360-R364 VanDerWaalsContact O-N 3.15Å; S361-R364 CarbonylContact O-C 3.58Å; S361-R364 PolarHBondContact O-N 2.98Å; R364-F367 PolarHBondContact O-N 3.11Å; R364-I368 WeakPolarHBondContact O-CB 3.33Å; R364-I368 WeakPolarHBondContact O-CD1 3.28Å; R364-I368 VanDerWaalsContact O-CG1 3.22Å; R364-I368 WeakPolarHBondContact O-CG1 3.33Å; R364-I368 PolarHBondContact O-N 3.22Å
365	L	58.9	Low	57.5	Low	16 Å²	16	71.6 Å²	71.6	8%	0.084	35%	0.346	C	S	.	.	H	α-helix	trans	-69.4	-35.6	178.1	176.3	62.4	0	0	0	112	Y166 V329 S361 L362 T369	Y166-L365 HydrophobicContact CD2-CB 4.05Å; Y166-L365 HydrophobicContact CD2-CD1 4.11Å; Y166-L365 HydrophobicContact CD2-CD2 4.29Å; Y166-L365 HydrophobicContact CD2-CG 4.37Å; Y166-L365 HydrophobicContact CE2-CB 3.83Å; Y166-L365 HydrophobicContact CE2-CD1 3.92Å; Y166-L365 HydrophobicContact CE2-CG 4.36Å; V329-L365 HydrophobicContact CG2-CD1 3.53Å; V329-L365 HydrophobicContact CG2-CD2 3.9Å; V329-L365 HydrophobicContact CG2-CG 4.31Å; S361-L365 VanDerWaalsContact O-CB 3.27Å; S361-L365 WeakPolarHBondContact O-CB 3.18Å; S361-L365 PolarHBondContact O-N 2.75Å; L362-L365 PolarHBondContact O-N 3.09Å; L365-T369 HydrophobicContact CD1-CG2 3.82Å; L365-T369 HydrophobicContact CG-CG2 4.34Å; L365-T369 WeakPolarHBondContact O-CB 3.21Å; L365-T369 WeakPolarHBondContact O-CG2 3.45Å; L365-T369 PolarHBondContact O-N 2.91Å; L365-T369 PolarHBondContact O-OG1 3.16Å
366	D	58	Low	56.1	Low	42 Å²	42	79.5 Å²	79.5	23%	0.225	38%	0.377	C	S	.	.	H	α-helix	trans	-69.7	-41.5	174.9	-166.3	55.6	0	0	0	111.4	K325 R356 L362 N363 T369 N370	K325-D366 IonicContact NZ-OD1 2.69Å; K325-D366 PolarHBondContact NZ-OD1 3.4Å; R356-D366 IonicContact CZ-OD2 2.88Å; R356-D366 IonicContact NH1-OD1 3.66Å; R356-D366 IonicContact NH1-OD2 3.35Å; R356-D366 PolarHBondContact NH1-OD2 3.48Å; R356-D366 VanDerWaalsContact NH2-CB 3.26Å; R356-D366 VanDerWaalsContact NH2-CG 3.31Å; R356-D366 IonicContact NH2-OD2 3.73Å; R356-D366 PolarHBondContact NH2-OD2 3.03Å; L362-D366 WeakPolarHBondContact O-CB 3.11Å; L362-D366 PolarHBondContact O-N 3.15Å; N363-D366 PolarHBondContact O-N 3.07Å; D366-T369 WeakPolarHBondContact CA-OG1 3.33Å; D366-T369 PolarHBondContact O-N 3.46Å; D366-T369 PolarHBondContact O-OG1 3.41Å; D366-N370 WeakPolarHBondContact O-CB 3.34Å; D366-N370 PolarHBondContact O-N 3.14Å
367	F	57.8	Low	55	Low	127 Å²	127	80.6 Å²	80.6	56%	0.557	39%	0.388	S	S	*	.	H	α-helix	trans	-57.4	-54.1	169.6	179.7	-95.4	0	0	0	110.7	N363 R364 T369 N370 E371	N363-F367 PolarHBondContact O-N 2.8Å; N363-F367 VanDerWaalsContact O-N 3.08Å; R364-F367 PolarHBondContact O-N 3.11Å; F367-T369 PolarHBondContact O-N 2.9Å; F367-N370 PolarHBondContact O-N 3.37Å; F367-E371 WeakPolarHBondContact CE1-OE2 3.19Å; F367-E371 WeakPolarHBondContact CZ-OE1 3.29Å; F367-E371 WeakPolarHBondContact O-CB 3.38Å; F367-E371 PolarHBondContact O-N 2.76Å
368	I	54.8	Low	54.2	Low	73 Å²	73	79.1 Å²	79.1	37%	0.374	38%	0.38	S	S	.	.	H	α-helix	trans	-63	-38	179.8	-70.5	163.7	0	0	0	112	Y166 R364 S372	Y166-I368 VanDerWaalsContact OH-CD1 3.32Å; Y166-I368 WeakPolarHBondContact OH-CD1 2.96Å; R364-I368 WeakPolarHBondContact O-CB 3.33Å; R364-I368 WeakPolarHBondContact O-CD1 3.28Å; R364-I368 VanDerWaalsContact O-CG1 3.22Å; R364-I368 WeakPolarHBondContact O-CG1 3.33Å; R364-I368 PolarHBondContact O-N 3.22Å; I368-S372 WeakPolarHBondContact O-CA 3Å; I368-S372 WeakPolarHBondContact O-CB 3.46Å; I368-S372 PolarHBondContact O-N 2.85Å; I368-S372 PolarHBondContact O-OG 3.08Å
369	T	55.1	Low	53.6	Low	7 Å²	7	78.5 Å²	78.5	4%	0.043	38%	0.382	C	S	.	.	H	α-helix	trans	-74.6	-33.1	177.7	50.5	0	0	0	0	112.3	L365 D366 F367 D373	L365-T369 HydrophobicContact CD1-CG2 3.82Å; L365-T369 HydrophobicContact CG-CG2 4.34Å; L365-T369 WeakPolarHBondContact O-CB 3.21Å; L365-T369 WeakPolarHBondContact O-CG2 3.45Å; L365-T369 PolarHBondContact O-N 2.91Å; L365-T369 PolarHBondContact O-OG1 3.16Å; D366-T369 WeakPolarHBondContact CA-OG1 3.33Å; D366-T369 PolarHBondContact O-N 3.46Å; D366-T369 PolarHBondContact O-OG1 3.41Å; F367-T369 PolarHBondContact O-N 2.9Å; T369-D373 WeakPolarHBondContact O-CB 3.39Å; T369-D373 PolarHBondContact O-N 2.86Å
370	N	54.5	Low	52.7	Low	109 Å²	109	81 Å²	81	58%	0.583	40%	0.398	S	S	*	.	H	α-helix	trans	-73.3	-42.3	176	-167.6	65.5	0	0	0	111.6	D366 F367 L374	D366-N370 WeakPolarHBondContact O-CB 3.34Å; D366-N370 PolarHBondContact O-N 3.14Å; F367-N370 PolarHBondContact O-N 3.37Å; N370-L374 PolarHBondContact O-N 3.11Å; N370-L374 VanDerWaalsContact O-N 3.17Å
371	E	51.9	Low	52.1	Low	102 Å²	102	79.3 Å²	79.3	48%	0.477	39%	0.387	S	S	.	.	H	α-helix	trans	-72.4	-38.9	175.6	-172.5	177.7	-122.1	0	0	111.9	F367 L374 M375	F367-E371 WeakPolarHBondContact CE1-OE2 3.19Å; F367-E371 WeakPolarHBondContact CZ-OE1 3.29Å; F367-E371 WeakPolarHBondContact O-CB 3.38Å; F367-E371 PolarHBondContact O-N 2.76Å; E371-L374 CarbonylContact O-C 3.48Å; E371-L374 WeakPolarHBondContact O-CB 3.43Å; E371-L374 PolarHBondContact O-N 2.98Å; E371-M375 VanDerWaalsContact O-CB 3.28Å; E371-M375 WeakPolarHBondContact O-CB 3.4Å; E371-M375 PolarHBondContact O-N 3.47Å
372	S	50.6	Low	51.5	Low	43 Å²	43	86.1 Å²	86.1	30%	0.301	42%	0.418	S	S	.	.	H	α-helix	trans	-79.3	-22	175.4	69.7	0	0	0	0	113.9	I368 Y376	I368-S372 WeakPolarHBondContact O-CA 3Å; I368-S372 WeakPolarHBondContact O-CB 3.46Å; I368-S372 PolarHBondContact O-N 2.85Å; I368-S372 PolarHBondContact O-OG 3.08Å; S372-Y376 VanDerWaalsContact O-CB 3.25Å; S372-Y376 WeakPolarHBondContact O-CB 3.32Å; S372-Y376 PolarHBondContact O-N 3.39Å
373	D	48.3	Very low	50.5	Low	62 Å²	62	88.8 Å²	88.8	33%	0.332	43%	0.432	S	S	.	.	H	α-helix	trans	-64.4	-48	162.9	-83.7	-25.8	0	0	0	109.3	K328 T369 M375 Y376 D377	K328-D373 IonicContact NZ-OD1 3.57Å; K328-D373 PolarHBondContact NZ-OD1 2.05Å; K328-D373 IonicContact NZ-OD2 2.69Å; K328-D373 PolarHBondContact NZ-OD2 3.43Å; T369-D373 WeakPolarHBondContact O-CB 3.39Å; T369-D373 PolarHBondContact O-N 2.86Å; D373-M375 VanDerWaalsContact C-N 3.32Å; D373-M375 PolarHBondContact O-N 3.08Å; D373-Y376 PolarHBondContact O-N 2.96Å; D373-D377 WeakPolarHBondContact O-CB 3.32Å; D373-D377 PolarHBondContact O-N 2.89Å
374	L	46.6	Very low	49.8	Very low	112 Å²	112	91.3 Å²	91.3	59%	0.586	45%	0.445	S	S	*	.	H	α-helix	trans	-60.6	-39.5	175.4	-157.5	78	0	0	0	112.5	N370 E371 N378	N370-L374 PolarHBondContact O-N 3.11Å; N370-L374 VanDerWaalsContact O-N 3.17Å; E371-L374 CarbonylContact O-C 3.48Å; E371-L374 WeakPolarHBondContact O-CB 3.43Å; E371-L374 PolarHBondContact O-N 2.98Å; L374-N378 WeakPolarHBondContact O-CB 3.16Å; L374-N378 VanDerWaalsContact O-CG 3.24Å; L374-N378 PolarHBondContact O-N 2.03Å; L374-N378 PolarHBondContact O-ND2 2.96Å
375	M	41.8	Very low	49.3	Very low	123 Å²	123	86.3 Å²	86.3	61%	0.606	44%	0.436	S	S	*	.	H	α-helix	trans	-76.8	-34.8	179.4	-170.4	-176.7	170.2	0	0	112.4	E371 D373 V379	E371-M375 VanDerWaalsContact O-CB 3.28Å; E371-M375 WeakPolarHBondContact O-CB 3.4Å; E371-M375 PolarHBondContact O-N 3.47Å; D373-M375 VanDerWaalsContact C-N 3.32Å; D373-M375 PolarHBondContact O-N 3.08Å; M375-V379 HydrophobicContact CE-CG2 4.3Å; M375-V379 HydrophobicContact CG-CG2 4.04Å; M375-V379 WeakPolarHBondContact O-CB 3.08Å; M375-V379 WeakPolarHBondContact O-CG2 3.04Å; M375-V379 PolarHBondContact O-N 2.84Å
376	Y	43.4	Very low	48.6	Very low	165 Å²	165	87.9 Å²	87.9	65%	0.647	45%	0.452	S	S	*	.	H	α-helix	trans	-64.2	-46.1	169.4	-109.1	-90.9	0	0	0	109.9	S372 D373 N378 V379 V380	S372-Y376 VanDerWaalsContact O-CB 3.25Å; S372-Y376 WeakPolarHBondContact O-CB 3.32Å; S372-Y376 PolarHBondContact O-N 3.39Å; D373-Y376 PolarHBondContact O-N 2.96Å; Y376-N378 VanDerWaalsContact C-N 3.32Å; Y376-N378 PolarHBondContact O-N 3.49Å; Y376-V379 PolarHBondContact O-N 3.09Å; Y376-V380 HydrophobicContact CD1-CG2 3.99Å; Y376-V380 WeakPolarHBondContact O-CA 3.43Å; Y376-V380 WeakPolarHBondContact O-CB 3.44Å; Y376-V380 WeakPolarHBondContact O-CG2 3.5Å; Y376-V380 PolarHBondContact O-N 3.36Å
377	D	43.3	Very low	47.8	Very low	81 Å²	81	90 Å²	90	43%	0.433	46%	0.463	S	S	.	.	H	α-helix	trans	-59.3	-43.7	177.7	-120.7	26.7	0	0	0	111.4	D373 R381	D373-D377 WeakPolarHBondContact O-CB 3.32Å; D373-D377 PolarHBondContact O-N 2.89Å; D377-R381 VanDerWaalsContact CB-NH1 3.34Å; D377-R381 VanDerWaalsContact O-CB 3.22Å; D377-R381 WeakPolarHBondContact O-CB 3.38Å; D377-R381 WeakPolarHBondContact O-CG 2.97Å; D377-R381 PolarHBondContact O-N 3.23Å; D377-R381 IonicContact OD1-NH2 2.74Å; D377-R381 IonicContact OD2-CZ 2.99Å; D377-R381 IonicContact OD2-NH1 2.82Å; D377-R381 PolarHBondContact OD2-NH1 2.76Å; D377-R381 IonicContact OD2-NH2 3.22Å; D377-R381 PolarHBondContact OD2-NH2 3.13Å
378	N	47.8	Very low	47.2	Very low	82 Å²	82	87 Å²	87	44%	0.439	46%	0.461	S	S	.	.	H	α-helix	trans	-73.4	-44	178.6	-72.3	-19.6	0	0	0	112.9	L374 Y376 R381 Q382	L374-N378 WeakPolarHBondContact O-CB 3.16Å; L374-N378 VanDerWaalsContact O-CG 3.24Å; L374-N378 PolarHBondContact O-N 2.03Å; L374-N378 PolarHBondContact O-ND2 2.96Å; Y376-N378 VanDerWaalsContact C-N 3.32Å; Y376-N378 PolarHBondContact O-N 3.49Å; N378-R381 PolarHBondContact O-N 2.99Å; N378-Q382 WeakPolarHBondContact O-CB 3.34Å; N378-Q382 PolarHBondContact O-N 3.28Å
379	V	46.9	Very low	46.6	Very low	78 Å²	78	90.3 Å²	90.3	47%	0.473	48%	0.475	S	S	.	.	H	α-helix	trans	-67.9	-37.5	177.4	171.7	0	0	0	0	111.1	M375 Y376 L383	M375-V379 HydrophobicContact CE-CG2 4.3Å; M375-V379 HydrophobicContact CG-CG2 4.04Å; M375-V379 WeakPolarHBondContact O-CB 3.08Å; M375-V379 WeakPolarHBondContact O-CG2 3.04Å; M375-V379 PolarHBondContact O-N 2.84Å; Y376-V379 PolarHBondContact O-N 3.09Å; V379-L383 WeakPolarHBondContact O-CB 3.39Å; V379-L383 PolarHBondContact O-N 3.19Å
380	V	45.7	Very low	45.7	Very low	65 Å²	65	93.8 Å²	93.8	39%	0.394	50%	0.499	S	S	.	.	H	α-helix	trans	-71.6	-41.3	175.3	173.9	0	0	0	0	110.9	Y376 L383 L384	Y376-V380 HydrophobicContact CD1-CG2 3.99Å; Y376-V380 WeakPolarHBondContact O-CA 3.43Å; Y376-V380 WeakPolarHBondContact O-CB 3.44Å; Y376-V380 WeakPolarHBondContact O-CG2 3.5Å; Y376-V380 PolarHBondContact O-N 3.36Å; V380-L383 PolarHBondContact O-N 2.62Å; V380-L384 HydrophobicContact CG1-CD1 3.88Å; V380-L384 HydrophobicContact CG1-CG 4.38Å; V380-L384 VanDerWaalsContact O-CB 3.27Å; V380-L384 WeakPolarHBondContact O-CB 3.36Å; V380-L384 VanDerWaalsContact O-CG 3.24Å; V380-L384 WeakPolarHBondContact O-CG 3.39Å; V380-L384 PolarHBondContact O-N 3.41Å
381	R	47.3	Very low	44.9	Very low	141 Å²	141	94.7 Å²	94.7	53%	0.532	50%	0.504	S	S	.	.	H	α-helix	trans	-62.4	-41.2	171.3	-78.5	-176	-167.9	96.3	15.2	112.4	D377 N378 L384 A385	D377-R381 VanDerWaalsContact CB-NH1 3.34Å; D377-R381 VanDerWaalsContact O-CB 3.22Å; D377-R381 WeakPolarHBondContact O-CB 3.38Å; D377-R381 WeakPolarHBondContact O-CG 2.97Å; D377-R381 PolarHBondContact O-N 3.23Å; D377-R381 IonicContact OD1-NH2 2.74Å; D377-R381 IonicContact OD2-CZ 2.99Å; D377-R381 IonicContact OD2-NH1 2.82Å; D377-R381 PolarHBondContact OD2-NH1 2.76Å; D377-R381 IonicContact OD2-NH2 3.22Å; D377-R381 PolarHBondContact OD2-NH2 3.13Å; N378-R381 PolarHBondContact O-N 2.99Å; R381-L384 PolarHBondContact O-N 3.21Å; R381-A385 VanDerWaalsContact O-CB 3.31Å; R381-A385 WeakPolarHBondContact O-CB 3.05Å; R381-A385 PolarHBondContact O-N 2.72Å
382	Q	44.4	Very low	44.4	Very low	147 Å²	147	97.7 Å²	97.7	69%	0.687	52%	0.518	S	S	*	.	H	α-helix	trans	-75.2	-30.9	-178.5	-163.5	160.8	10.4	0	0	112	N378 A386	N378-Q382 WeakPolarHBondContact O-CB 3.34Å; N378-Q382 PolarHBondContact O-N 3.28Å; Q382-A386 VanDerWaalsContact O-CB 3.28Å; Q382-A386 WeakPolarHBondContact O-CB 3.47Å; Q382-A386 PolarHBondContact O-N 3.09Å
383	L	41.4	Very low	43.8	Very low	81 Å²	81	102.9 Å²	102.9	42%	0.424	54%	0.542	S	S	.	.	H	α-helix	trans	-69.3	-40.8	168.1	-170.3	72.8	0	0	0	111.5	V379 V380 A386 L387	V379-L383 WeakPolarHBondContact O-CB 3.39Å; V379-L383 PolarHBondContact O-N 3.19Å; V380-L383 PolarHBondContact O-N 2.62Å; L383-A386 PolarHBondContact O-N 3Å; L383-L387 HydrophobicContact CG-CD1 4.12Å; L383-L387 VanDerWaalsContact O-CB 3.31Å; L383-L387 WeakPolarHBondContact O-CB 3.47Å; L383-L387 WeakPolarHBondContact O-CG 3.39Å; L383-L387 PolarHBondContact O-N 2.98Å
384	L	47.3	Very low	43.1	Very low	108 Å²	108	104.3 Å²	104.3	57%	0.565	56%	0.563	S	S	*	*	H	α-helix	trans	-65.2	-39.8	173.7	-78.1	166.9	0	0	0	112	V380 R381 L387 A388	V380-L384 HydrophobicContact CG1-CD1 3.88Å; V380-L384 HydrophobicContact CG1-CG 4.38Å; V380-L384 VanDerWaalsContact O-CB 3.27Å; V380-L384 WeakPolarHBondContact O-CB 3.36Å; V380-L384 VanDerWaalsContact O-CG 3.24Å; V380-L384 WeakPolarHBondContact O-CG 3.39Å; V380-L384 PolarHBondContact O-N 3.41Å; R381-L384 PolarHBondContact O-N 3.21Å; L384-L387 PolarHBondContact O-N 3.39Å; L384-A388 WeakPolarHBondContact O-CB 3.32Å; L384-A388 PolarHBondContact O-N 2.93Å
385	A	50	Low	42.8	Very low	49 Å²	49	105.1 Å²	105.1	41%	0.405	57%	0.572	S	S	.	*	H	α-helix	trans	-65.1	-45.7	174.6	0	0	0	0	0	111.4	R381 L387 A388 Q389	R381-A385 VanDerWaalsContact O-CB 3.31Å; R381-A385 WeakPolarHBondContact O-CB 3.05Å; R381-A385 PolarHBondContact O-N 2.72Å; A385-L387 VanDerWaalsContact C-N 3.31Å; A385-L387 PolarHBondContact O-N 2.71Å; A385-A388 PolarHBondContact O-N 3.29Å; A385-Q389 WeakPolarHBondContact O-CG 3.36Å; A385-Q389 PolarHBondContact O-N 2.93Å
386	A	44.4	Very low	42.6	Very low	49 Å²	49	104.1 Å²	104.1	41%	0.405	58%	0.575	S	S	.	*	H	α-helix	trans	-61.6	-37.9	174.5	0	0	0	0	0	112.2	Q382 L383 Q389 S390	Q382-A386 VanDerWaalsContact O-CB 3.28Å; Q382-A386 WeakPolarHBondContact O-CB 3.47Å; Q382-A386 PolarHBondContact O-N 3.09Å; L383-A386 PolarHBondContact O-N 3Å; A386-Q389 PolarHBondContact O-N 3.16Å; A386-S390 VanDerWaalsContact O-CB 3.32Å; A386-S390 WeakPolarHBondContact O-CB 3.15Å; A386-S390 PolarHBondContact O-N 2.84Å; A386-S390 PolarHBondContact O-OG 3.45Å
387	L	40.2	Very low	42	Very low	87 Å²	87	102.6 Å²	102.6	46%	0.455	58%	0.583	S	S	.	*	H	α-helix	trans	-73.1	-31.5	175.3	-73	168.4	0	0	0	113	L383 L384 A385 S390 N391	L383-L387 HydrophobicContact CG-CD1 4.12Å; L383-L387 VanDerWaalsContact O-CB 3.31Å; L383-L387 WeakPolarHBondContact O-CB 3.47Å; L383-L387 WeakPolarHBondContact O-CG 3.39Å; L383-L387 PolarHBondContact O-N 2.98Å; L384-L387 PolarHBondContact O-N 3.39Å; A385-L387 VanDerWaalsContact C-N 3.31Å; A385-L387 PolarHBondContact O-N 2.71Å; L387-S390 PolarHBondContact O-OG 3.48Å; L387-N391 PolarHBondContact O-ND2 3.01Å
388	A	45	Very low	41.3	Very low	63 Å²	63	104 Å²	104	52%	0.521	60%	0.595	S	S	.	*	H	α-helix	trans	-67.7	-38.9	171.6	0	0	0	0	0	111.2	L384 A385	L384-A388 WeakPolarHBondContact O-CB 3.32Å; L384-A388 PolarHBondContact O-N 2.93Å; A385-A388 PolarHBondContact O-N 3.29Å
389	Q	42.8	Very low	40.5	Very low	143 Å²	143	110 Å²	110	67%	0.668	61%	0.611	S	S	*	*	H	α-helix	trans	-70	-41.1	174.8	-71	170.4	-38.4	0	0	111.8	A385 A386 N391 H392	A385-Q389 WeakPolarHBondContact O-CG 3.36Å; A385-Q389 PolarHBondContact O-N 2.93Å; A386-Q389 PolarHBondContact O-N 3.16Å; Q389-N391 PolarHBondContact O-N 3.39Å; Q389-N391 VanDerWaalsContact O-N 3.07Å; Q389-H392 PolarHBondContact O-N 2.97Å
390	S	35.3	Very low	39.6	Very low	79 Å²	79	112.8 Å²	112.8	55%	0.552	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.9	3.2	-178	81.6	0	0	0	0	115.5	A386 L387	A386-S390 VanDerWaalsContact O-CB 3.32Å; A386-S390 WeakPolarHBondContact O-CB 3.15Å; A386-S390 PolarHBondContact O-N 2.84Å; A386-S390 PolarHBondContact O-OG 3.45Å; L387-S390 PolarHBondContact O-OG 3.48Å
391	N	38.9	Very low	38.9	Very low	128 Å²	128	115.2 Å²	115.2	68%	0.684	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.7	0.4	177.1	-85.9	-81	0	0	0	113.8	L387 Q389	L387-N391 PolarHBondContact O-ND2 3.01Å; Q389-N391 PolarHBondContact O-N 3.39Å; Q389-N391 VanDerWaalsContact O-N 3.07Å
392	H	42.1	Very low	37.9	Very low	166 Å²	166	112.1 Å²	112.1	77%	0.769	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109	-19.2	177.7	-77.7	-55.6	0	0	0	115.3	Q389 A394	Q389-H392 PolarHBondContact O-N 2.97Å; H392-A394 VanDerWaalsContact C-N 3.31Å; H392-A394 PolarHBondContact O-N 2.73Å
393	D	36.3	Very low	37.2	Very low	151 Å²	151	113.3 Å²	113.3	81%	0.807	66%	0.66	S	S	*	*			trans	-84.4	68.6	176.9	-77.3	-38.1	0	0	0	113.1
394	A	34.8	Very low	36.9	Very low	93 Å²	93	117.7 Å²	117.7	77%	0.769	68%	0.678	S	S	*	*			trans	-115.6	92.9	161.6	0	0	0	0	0	108.8	H392	H392-A394 VanDerWaalsContact C-N 3.31Å; H392-A394 PolarHBondContact O-N 2.73Å
395	T	40.3	Very low	35.9	Very low	128 Å²	128	118.5 Å²	118.5	79%	0.785	69%	0.688	S	S	*	*			trans	-70.1	164.1	-176	57.4	0	0	0	0	112.8
396	P	36.7	Very low	34.9	Very low	102 Å²	102	123.1 Å²	123.1	66%	0.662	71%	0.705	S	S	*	*				-150.2	162.9	111.5	40.4	-25.8	0	0	0	116.6
397	T	30.7	Very low	34.8	Very low	133 Å²	133	128.6 Å²	128.6	82%	0.816	73%	0.727	S	S	*	*			trans	68.2	154.9	158.2	59.1	0	0	0	0	120.3
398	V	29.8	Very low	34.6	Very low	111 Å²	111	128.9 Å²	128.9	67%	0.673	73%	0.734	S	S	*	*			cis	-167.4	145.2	-25.6	131.6	0	0	0	0	108.3
399	R	31	Very low	33.6	Very low	208 Å²	208	132.7 Å²	132.7	79%	0.785	75%	0.746	S	S	*	*			trans	65.7	159.3	164.1	-86.6	172.1	150.7	118.2	4.9	117.9
400	E	28.3	Very low	32.9	Very low	136 Å²	136	133.5 Å²	133.5	64%	0.636	75%	0.751	S	S	*	*			cis	-152.8	161.4	-11.2	-137.7	153.8	-152.8	0	0	112.2
401	S	29.9	Very low	32.7	Very low	117 Å²	117	136.2 Å²	136.2	82%	0.818	76%	0.76	S	S	*	*			trans	31.3	132.6	153.3	-62.4	0	0	0	0	124
402	G	25.6	Very low	32.8	Very low	76 Å²	76	135.1 Å²	135.1	78%	0.784	76%	0.759	S	S	*	*			trans	-173.3	41.4	173.1	0	0	0	0	0	120.2
403	I	30.5	Very low	32	Very low	171 Å²	171	131.5 Å²	131.5	88%	0.877	75%	0.753	S	S	*	*			trans	30.6	138.7	153.1	-50.4	173.7	0	0	0	121.4
404	Q	35.5	Very low	31.6	Very low	173 Å²	173	131 Å²	131	81%	0.808	75%	0.75	S	S	*	*			trans	-59.9	156.7	172.1	-55.2	163.6	-10	0	0	114.3
405	T	26.5	Very low	31.4	Very low	125 Å²	125	134.7 Å²	134.7	77%	0.767	76%	0.756	S	S	*	*				-175	141	123.9	27	0	0	0	0	114.6
406	I	27.7	Very low	30.8	Very low	147 Å²	147	132 Å²	132	75%	0.754	75%	0.754	S	S	*	*			trans	67.1	123.9	140.1	-65.4	165.3	0	0	0	120	P408	I406-P408 HydrophobicContact CG2-CB 4.3Å; I406-P408 HydrophobicContact CG2-CG 3.67Å
407	D	42.9	Very low	30.4	Very low	163 Å²	163	134 Å²	134	87%	0.872	76%	0.764	S	S	*	*			trans	-126.4	120.6	160.5	173.8	19.3	0	0	0	107.4
408	P	35.3	Very low	30.2	Very low	94 Å²	94	131 Å²	131	61%	0.61	76%	0.759	S	S	*	*			trans	-137.1	124.6	178.8	38	-20.2	0	0	0	116.2	I406	I406-P408 HydrophobicContact CG2-CB 4.3Å; I406-P408 HydrophobicContact CG2-CG 3.67Å
409	N	25.5	Very low	30	Very low	143 Å²	143	132 Å²	132	77%	0.765	76%	0.761	S	S	*	*				68.3	101.4	126.2	-170.3	54.9	0	0	0	119.8
410	M	26.6	Very low	29.8	Very low	159 Å²	159	130.3 Å²	130.3	78%	0.783	76%	0.764	S	S	*	*				-179.3	148.4	100.2	-89.2	-154.1	70.8	0	0	114.1
411	D	32.1	Very low	29.7	Very low	137 Å²	137	128.2 Å²	128.2	73%	0.733	77%	0.77	S	S	*	*			trans	-120	155.2	163.4	-157.4	19	0	0	0	105.8
412	P	40.4	Very low	29.4	Very low	104 Å²	104	130.3 Å²	130.3	68%	0.675	77%	0.769	S	S	*	*				-142.9	-167.7	69.8	32.7	-7.3	0	0	0	112.1
413	S	26.2	Very low	29.5	Very low	90 Å²	90	134.6 Å²	134.6	63%	0.629	77%	0.769	S	S	*	*			cis	-157.7	-180	25.3	-48.7	0	0	0	0	113.8
414	D	28.5	Very low	29.9	Very low	140 Å²	140	131.4 Å²	131.4	75%	0.749	76%	0.759	S	S	*	*			trans	54.1	81.4	153.9	-60.7	-7.1	0	0	0	117.4
415	L	30.5	Very low	29.5	Very low	172 Å²	172	131.3 Å²	131.3	90%	0.901	76%	0.763	S	S	*	*				77.8	123.1	73.1	-69.8	166.3	0	0	0	115.3
416	G	25.8	Very low	29.5	Very low	72 Å²	72	130.5 Å²	130.5	74%	0.742	76%	0.758	S	S	*	*			trans	173	70.5	172.8	0	0	0	0	0	116.3
417	V	28.7	Very low	29.5	Very low	142 Å²	142	129.9 Å²	129.9	86%	0.861	76%	0.755	S	S	*	*			trans	34	101.7	151.3	-168	0	0	0	0	116.2
418	G	27.5	Very low	28.7	Very low	70 Å²	70	131 Å²	131	72%	0.722	75%	0.752	S	S	*	*				137.4	-175.5	54.8	0	0	0	0	0	109.3
419	D	25.6	Very low	28.5	Very low	133 Å²	133	138 Å²	138	71%	0.711	77%	0.766	S	S	*	*			cis	-164	167.9	-10.3	-126.8	-48.9	0	0	0	114.3
420	M	25.8	Very low	28.9	Very low	172 Å²	172	137.3 Å²	137.3	85%	0.847	77%	0.769	S	S	*	*			trans	26.5	139.8	161.6	-70.4	-64.5	176.5	0	0	125.9
421	A	26	Very low	29.2	Very low	93 Å²	93	141.3 Å²	141.3	77%	0.769	78%	0.776	S	S	*	*			trans	95	94.2	140	0	0	0	0	0	123.1
422	M	24.2	Very low	29	Very low	161 Å²	161	145.1 Å²	145.1	79%	0.793	79%	0.786	S	S	*	*				89.2	123.6	110.9	-161.1	163.8	169.2	0	0	123.3
423	E	27.1	Very low	28.3	Very low	166 Å²	166	149.8 Å²	149.8	78%	0.776	80%	0.796	S	S	*	*			trans	73.4	153.7	154.9	-79.1	-169	148.8	0	0	123.7
424	P	40.4	Very low	28.8	Very low	104 Å²	104	153.4 Å²	153.4	68%	0.675	81%	0.806	S	S	*	*			trans	-117.3	160.9	-160.8	42.2	-31.5	0	0	0	116.1
425	L	27	Very low	28.6	Very low	170 Å²	170	155.6 Å²	155.6	89%	0.89	81%	0.809	S	S	*	*			trans	-144.1	77.8	169.8	-148.4	75.2	0	0	0	116.6
426	V	25.7	Very low	28.5	Very low	109 Å²	109	159.2 Å²	159.2	66%	0.661	81%	0.811	S	S	*	*				45.8	99.9	116.5	-179.4	0	0	0	0	118.9
427	I	27.9	Very low	28.7	Very low	133 Å²	133	162.7 Å²	162.7	68%	0.682	81%	0.811	S	S	*	*				94.2	121.5	128.7	-76.2	-177.7	0	0	0	123.7
428	K	25.8	Very low	28.8	Very low	188 Å²	188	161.7 Å²	161.7	82%	0.817	81%	0.807	S	S	*	*			trans	70	123.3	147.7	-75.1	166.6	-159.6	167.1	0	123.4
429	R	32.1	Very low	28.8	Very low	239 Å²	239	164 Å²	164	90%	0.902	81%	0.812	S	S	*	*			trans	-72.8	159.6	150.1	-54.3	174.4	177.7	166.3	-2.5	110.3
430	P	33.7	Very low	28.9	Very low	129 Å²	129	162.2 Å²	162.2	84%	0.838	81%	0.81	S	S	*	*				-148.7	177.4	91.7	38.1	-20.1	0	0	0	116.6
431	R	32	Very low	29	Very low	243 Å²	243	161.2 Å²	161.2	92%	0.917	81%	0.808	S	S	*	*			trans	-54.9	153.9	-176.6	-60.3	171.1	172.2	166.3	-4.6	115.5
432	K	28.4	Very low	29.3	Very low	217 Å²	217	162.5 Å²	162.5	94%	0.943	81%	0.809	S	S	*	*			trans	-144.4	156.6	147.7	-109	168.6	-172.7	172	0	112.2
433	K	25.1	Very low	29.6	Very low	203 Å²	203	162.9 Å²	162.9	88%	0.883	81%	0.813	S	S	*	*			trans	-90.3	149.8	-178.3	-60.1	-179.6	178	-175.6	0	111.1
434	I	36.5	Very low	29.6	Very low	166 Å²	166	160.6 Å²	160.6	85%	0.851	81%	0.813	S	S	*	*			trans	-76.7	138.6	163.1	-66.8	173.2	0	0	0	108.9
435	K	25.2	Very low	29.1	Very low	185 Å²	185	164.4 Å²	164.4	80%	0.804	82%	0.822	S	S	*	*			trans	-105.8	133.6	170.5	-79.9	-175.7	172.9	-176.1	0	109.4
436	W	27.9	Very low	29.3	Very low	249 Å²	249	162.2 Å²	162.2	94%	0.943	82%	0.818	S	S	*	*			trans	-80.7	141.4	152.1	-80.6	93	0	0	0	109.3
437	I	29.7	Very low	29.2	Very low	144 Å²	144	166.3 Å²	166.3	74%	0.738	83%	0.827	S	S	*	*			trans	-107.2	121.2	-178.9	-62.3	168.6	0	0	0	108.7
438	P	31.3	Very low	29.2	Very low	122 Å²	122	169.2 Å²	169.2	79%	0.792	83%	0.834	S	S	*	*			trans	-79.4	142	163.7	33.1	-31.3	0	0	0	109.8
439	S	27.4	Very low	29.2	Very low	118 Å²	118	168.5 Å²	168.5	83%	0.825	83%	0.834	S	S	*	*			trans	-133.6	132.1	172.1	-171.8	0	0	0	0	110.5
440	S	28.8	Very low	29.2	Very low	95 Å²	95	162.7 Å²	162.7	66%	0.664	83%	0.827	S	S	*	*			trans	-157	145.2	177.2	55.7	0	0	0	0	109.4
441	N	26.5	Very low	28.9	Very low	152 Å²	152	164.7 Å²	164.7	81%	0.813	83%	0.83	S	S	*	*			trans	97.9	149.1	-178.5	-52.9	-18.9	0	0	0	114.5
442	P	32.5	Very low	28.7	Very low	120 Å²	120	159.7 Å²	159.7	78%	0.779	83%	0.827	S	S	*	*				-128.8	-174.6	-51.6	36.3	-21.2	0	0	0	111.8
443	L	29.6	Very low	28.6	Very low	169 Å²	169	157.1 Å²	157.1	89%	0.885	82%	0.822	S	S	*	*			trans	-59	146.5	-179.8	-75.7	159.3	0	0	0	114.8
444	P	29.1	Very low	28.9	Very low	117 Å²	117	153.5 Å²	153.5	76%	0.76	82%	0.817	S	S	*	*			trans	-115.1	170.9	134.2	18.2	-0.2	0	0	0	112.6
445	Q	29.1	Very low	28.5	Very low	185 Å²	185	156.3 Å²	156.3	86%	0.864	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-75.6	161.6	-172.3	-79.8	179.8	-15	0	0	114.7
446	P	31.6	Very low	28.5	Very low	124 Å²	124	153.7 Å²	153.7	81%	0.805	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-65.2	154.9	-179.6	27.1	-36.5	0	0	0	113.9
447	F	23.7	Very low	28.5	Very low	194 Å²	194	148.8 Å²	148.8	85%	0.851	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-64.1	149	-178.4	-132.7	-109.2	0	0	0	112.8	E449	F447-E449 HydrophobicContact CD1-CG 4.42Å
448	K	26.4	Very low	28.4	Very low	195 Å²	195	147.3 Å²	147.3	85%	0.848	79%	0.793	S	S	*	*			trans	-105.9	140.6	163.4	-73.4	-177.6	177.1	179.6	0	109.2
449	E	27	Very low	28.1	Very low	173 Å²	173	148.1 Å²	148.1	81%	0.808	79%	0.79	S	S	*	*			trans	-116.2	163.4	160.2	-81.2	-164.9	144.7	0	0	110	F447	F447-E449 HydrophobicContact CD1-CG 4.42Å
450	P	32	Very low	28.2	Very low	117 Å²	117	148.4 Å²	148.4	76%	0.76	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-90.9	171.6	-134.6	33.4	-37.7	0	0	0	116.4
451	L	26.4	Very low	28.1	Very low	170 Å²	170	153.1 Å²	153.1	89%	0.89	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-66.7	137.1	-179.9	-67.8	76.7	0	0	0	112.3
452	T	28.4	Very low	28.5	Very low	139 Å²	139	151.6 Å²	151.6	85%	0.853	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-97.7	147.9	147.3	50.4	0	0	0	0	109.7
453	L	27.6	Very low	28.1	Very low	162 Å²	162	153.2 Å²	153.2	85%	0.848	79%	0.791	S	S	*	*			trans	-110.8	111.5	-161.1	-162.5	-176.6	0	0	0	111.6
454	T	30.6	Very low	27.8	Very low	127 Å²	127	152.9 Å²	152.9	78%	0.779	78%	0.783	S	S	*	*			trans	-151.2	137.7	161.4	14.3	0	0	0	0	113.7
455	R	26.9	Very low	28.3	Very low	226 Å²	226	153 Å²	153	85%	0.853	78%	0.783	S	S	*	*			trans	0.5	155.2	146.9	-73.4	-179.6	161.8	129.7	-7	120.3
456	L	26.5	Very low	28.1	Very low	130 Å²	130	154.1 Å²	154.1	68%	0.681	79%	0.785	S	S	*	*			cis	-180	157.3	-11.6	174.8	57.8	0	0	0	109.1
457	E	27.7	Very low	28.4	Very low	145 Å²	145	153.5 Å²	153.5	68%	0.678	78%	0.781	S	S	*	*			trans	73.6	129.8	158.4	-87.1	168.5	118.3	0	0	124.2
458	N	26.5	Very low	28.6	Very low	114 Å²	114	150.5 Å²	150.5	61%	0.61	78%	0.779	S	S	*	*			trans	60.3	121.5	138.3	-60.6	-27.3	0	0	0	121.7
459	N	25.2	Very low	28.5	Very low	138 Å²	138	153 Å²	153	74%	0.738	78%	0.782	S	S	*	*				60.8	128.6	71.9	-65.7	-56.1	0	0	0	112.6
460	T	29.8	Very low	28.7	Very low	124 Å²	124	156 Å²	156	76%	0.761	79%	0.786	S	S	*	*			cis	-170.6	166.6	43.3	-24.3	0	0	0	0	114
461	K	26.5	Very low	28.6	Very low	195 Å²	195	160.2 Å²	160.2	85%	0.848	79%	0.793	S	S	*	*			trans	84.1	138.1	151.8	-81.3	179	177	175.7	0	122.7
462	P	35.5	Very low	28.5	Very low	120 Å²	120	158.1 Å²	158.1	78%	0.779	79%	0.787	S	S	*	*			trans	-117.2	-158.1	174.5	45.4	-35.8	0	0	0	114.8
463	E	23.6	Very low	28.5	Very low	153 Å²	153	160.2 Å²	160.2	72%	0.715	79%	0.79	S	S	*	*			trans	82.6	148.7	-171.7	-64.9	-154.7	114.9	0	0	115.4
464	K	24.1	Very low	28.4	Very low	163 Å²	163	156.7 Å²	156.7	71%	0.709	78%	0.784	S	S	*	*			cis	-154	153.2	9.3	-133.8	155.1	-176.7	135.2	0	111.5
465	P	39.4	Very low	28.2	Very low	118 Å²	118	157.6 Å²	157.6	77%	0.766	78%	0.784	S	S	*	*			trans	-103.5	169.9	-178.1	39.3	-35.6	0	0	0	115.2
466	K	25	Very low	28.1	Very low	210 Å²	210	151.3 Å²	151.3	91%	0.913	77%	0.774	S	S	*	*			trans	-160.6	147.3	162.1	-117.2	169.4	-172.8	177	0	115.1
467	P	37.7	Very low	28.2	Very low	111 Å²	111	152.4 Å²	152.4	72%	0.721	78%	0.78	S	S	*	*			trans	-128.8	166.8	-175.2	43.3	-30.5	0	0	0	117.3
468	V	28.3	Very low	28.3	Very low	131 Å²	131	153 Å²	153	79%	0.794	79%	0.787	S	S	*	*			trans	55	139.1	148.4	173.2	0	0	0	0	121.5
469	R	24.4	Very low	28.3	Very low	246 Å²	246	151.6 Å²	151.6	93%	0.928	79%	0.791	S	S	*	*			trans	-129.8	152.3	159.7	-168.2	169.4	-179.7	158.7	0.6	110.8
470	R	30.3	Very low	28.9	Very low	236 Å²	236	150.2 Å²	150.2	89%	0.891	79%	0.789	S	S	*	*			trans	-126.9	175.3	-172	-96.3	-176	173.5	-177.6	-1	114.2
471	K	29.6	Very low	28.8	Very low	206 Å²	206	152.1 Å²	152.1	90%	0.896	79%	0.794	S	S	*	*			trans	-75.9	165.5	-171.5	-52.4	175.9	175.3	-176.5	0	116.7
472	T	26	Very low	28.8	Very low	126 Å²	126	150.4 Å²	150.4	77%	0.773	79%	0.793	S	S	*	*			trans	-151.4	130.8	148	10.9	0	0	0	0	108.4
473	M	26.9	Very low	28.3	Very low	183 Å²	183	151.8 Å²	151.8	90%	0.901	79%	0.794	S	S	*	*				59.6	136.6	102	-69.8	175.2	169	0	0	115.4
474	A	27	Very low	28.4	Very low	88 Å²	88	148.9 Å²	148.9	73%	0.727	79%	0.791	S	S	*	*			cis	-164.3	-166.9	-8.7	0	0	0	0	0	108.3
475	D	24.6	Very low	28.5	Very low	147 Å²	147	150.7 Å²	150.7	79%	0.786	80%	0.799	S	S	*	*			cis	-158.4	-133.5	4.7	-156.9	-101.9	0	0	0	113.5
476	S	26.2	Very low	27.8	Very low	93 Å²	93	148.3 Å²	148.3	65%	0.65	80%	0.795	S	S	*	*			trans	-67.1	172.6	-173.3	-69.4	0	0	0	0	118.6
477	L	28	Very low	27.9	Very low	153 Å²	153	144.3 Å²	144.3	80%	0.801	79%	0.789	S	S	*	*			cis	-162.7	160.7	26.8	-134.5	153.4	0	0	0	113.4
478	I	29.4	Very low	27.3	Very low	158 Å²	158	147.8 Å²	147.8	81%	0.81	80%	0.795	S	S	*	*			trans	83.5	133.2	163.7	-51.2	-179.8	0	0	0	120.1
479	A	27.8	Very low	27.1	Very low	84 Å²	84	150.2 Å²	150.2	69%	0.694	80%	0.798	S	S	*	*			trans	-142.3	169.3	165.6	0	0	0	0	0	109.1
480	P	36.9	Very low	28.4	Very low	110 Å²	110	144.3 Å²	144.3	71%	0.714	79%	0.791	S	S	*	*				-152.8	142.8	84.7	40.7	-21.1	0	0	0	116.2
481	L	26.7	Very low	28.2	Very low	163 Å²	163	137.6 Å²	137.6	85%	0.853	79%	0.787	S	S	*	*				78.4	150.8	97.2	-64.9	172.5	0	0	0	120
482	L	27.3	Very low	28	Very low	159 Å²	159	132.2 Å²	132.2	83%	0.832	78%	0.78	S	S	*	*			trans	75.6	148.4	166.8	-58.2	170.9	0	0	0	119.1
483	D	25.7	Very low	27.9	Very low	149 Å²	149	135.7 Å²	135.7	80%	0.797	79%	0.785	S	S	*	*			cis	-166.9	178.1	-37.7	-149.9	-18.8	0	0	0	111.2
484	S	25.7	Very low	27.8	Very low	93 Å²	93	132.6 Å²	132.6	65%	0.65	78%	0.776	S	S	*	*			trans	90.3	82.7	146	-167.2	0	0	0	0	122.6
485	K	25.1	Very low	27.7	Very low	200 Å²	200	138.4 Å²	138.4	87%	0.87	78%	0.779	S	S	*	*				63.7	111.3	104.9	-164.9	-176.8	-168.3	177.2	0	122.5
486	G	26	Very low	27.6	Very low	68 Å²	68	138 Å²	138	70%	0.701	77%	0.772	S	S	*	*			trans	86.5	167.9	140.7	0	0	0	0	0	119
487	T	26.3	Very low	27.6	Very low	127 Å²	127	140.9 Å²	140.9	78%	0.779	78%	0.779	S	S	*	*			cis	-163	161.3	-17.5	-19.4	0	0	0	0	111.5
488	Q	26.1	Very low	27.4	Very low	183 Å²	183	139.2 Å²	139.2	86%	0.855	78%	0.776	S	S	*	*			trans	75.8	154.4	155.6	-68.5	171.9	3.5	0	0	122.1
489	H	24.2	Very low	27.2	Very low	183 Å²	183	141.4 Å²	141.4	85%	0.847	78%	0.779	S	S	*	*			trans	-102.2	-169.2	170.4	-60.5	-80.7	0	0	0	110
490	P	50.1	Low	27	Very low	121 Å²	121	141.1 Å²	141.1	79%	0.786	77%	0.773	S	S	*	*			cis	-131.3	-166.3	-25.9	23.1	1.9	0	0	0	113
491	A	25.7	Very low	26.4	Very low	96 Å²	96	141.7 Å²	141.7	79%	0.793	78%	0.779	S	S	*	*				123.1	124.4	127	0	0	0	0	0	121.5
492	A	25.9	Very low	26.4	Very low	92 Å²	92	138 Å²	138	76%	0.76	77%	0.772	S	S	*	*			trans	-6.8	136.6	155.8	0	0	0	0	0	124.2
493	K	24.8	Very low	26.3	Very low	200 Å²	200	137.3 Å²	137.3	87%	0.87	77%	0.769	S	S	*	*				-173.3	144.9	121.2	-94.7	161.7	-179.1	179.4	0	107.9
494	V	24.9	Very low	26.3	Very low	118 Å²	118	136.9 Å²	136.9	72%	0.715	77%	0.765	S	S	*	*			cis	89.8	126.6	32.6	172.6	0	0	0	0	113.5
495	R	24.6	Very low	26.3	Very low	209 Å²	209	138 Å²	138	79%	0.789	77%	0.774	S	S	*	*			trans	72.8	152.6	169.7	-79.9	-176.1	142.5	130.9	6	117.6
496	E	22.8	Very low	26.3	Very low	138 Å²	138	131.8 Å²	131.8	65%	0.645	77%	0.766	S	S	*	*			cis	-168.3	-175.4	-22.4	-155.6	155.2	-150	0	0	108.7
497	L	25.3	Very low	26.4	Very low	154 Å²	154	137.7 Å²	137.7	81%	0.806	78%	0.777	S	S	*	*			trans	71.1	121.5	169.8	-59	154.5	0	0	0	115.1
498	V	24.2	Very low	26.4	Very low	119 Å²	119	138.9 Å²	138.9	72%	0.721	77%	0.774	S	S	*	*			cis	89.2	103.2	44.6	173.7	0	0	0	0	113.2
499	F	24.9	Very low	26.7	Very low	203 Å²	203	139.9 Å²	139.9	89%	0.89	78%	0.776	S	S	*	*			trans	173.3	156.2	142.6	-115.9	-110.5	0	0	0	105.9
500	S	24.4	Very low	26.9	Very low	79 Å²	79	139.3 Å²	139.3	55%	0.552	77%	0.771	S	S	*	*			cis	176.2	138.4	-35.3	-84.9	0	0	0	0	104.9
501	S	24.6	Very low	25.9	Very low	121 Å²	121	142.4 Å²	142.4	85%	0.846	77%	0.774	S	S	*	*			trans	61.3	143.7	158.1	53.9	0	0	0	0	123.3
502	A	26.8	Very low	26	Very low	86 Å²	86	142 Å²	142	71%	0.711	77%	0.772	S	S	*	*			trans	84.9	100.6	149.3	0	0	0	0	0	121.7
503	D	23.7	Very low	26.4	Very low	144 Å²	144	148.7 Å²	148.7	77%	0.77	78%	0.777	S	S	*	*				79.5	124.1	117.5	-67.2	-1.2	0	0	0	126
504	I	27.2	Very low	26.5	Very low	140 Å²	140	146.3 Å²	146.3	72%	0.718	77%	0.774	S	S	*	*			trans	76.1	97.4	134.2	-62	168.4	0	0	0	119.9
505	S	25	Very low	26.6	Very low	118 Å²	118	149.8 Å²	149.8	83%	0.825	78%	0.78	S	S	*	*			trans	66.8	147.6	140.6	80.3	0	0	0	0	121.3
506	G	24.5	Very low	26.7	Very low	68 Å²	68	144.1 Å²	144.1	70%	0.701	77%	0.772	S	S	*	*			trans	129.6	118.6	144.6	0	0	0	0	0	118
507	M	28	Very low	27	Very low	192 Å²	192	145 Å²	145	95%	0.946	78%	0.78	S	S	*	*			trans	70.6	129.1	150.4	-57.4	-171	72.8	0	0	120.7
508	E	27.5	Very low	27	Very low	153 Å²	153	143.5 Å²	143.5	72%	0.715	77%	0.773	S	S	*	*			trans	-61.2	147.6	173.6	-51.1	167.5	88.9	0	0	113.2	K510	E508-K510 WeakPolarHBondContact OE1-CE 3.34Å; E508-K510 IonicContact OE1-NZ 3.37Å
509	K	31.4	Very low	27.4	Very low	204 Å²	204	144 Å²	144	89%	0.887	78%	0.776	S	S	*	*			trans	-132.6	106.6	149.1	-73.8	-171.6	178.8	172.9	0	110.8
510	K	28.6	Very low	27.6	Very low	171 Å²	171	142.2 Å²	142.2	74%	0.743	77%	0.77	S	S	*	*			trans	-66.9	132.9	171.7	-68.2	168	-177.2	162.5	0	109.6	E508	E508-K510 WeakPolarHBondContact OE1-CE 3.34Å; E508-K510 IonicContact OE1-NZ 3.37Å
511	H	29.8	Very low	28	Very low	185 Å²	185	144 Å²	144	86%	0.856	78%	0.78	S	S	*	*			trans	-126.9	101.1	161.2	-96.3	23	0	0	0	108.9
512	A	27.4	Very low	28.2	Very low	89 Å²	89	149.1 Å²	149.1	74%	0.736	78%	0.783	S	S	*	*			trans	-69.9	136.6	170.3	0	0	0	0	0	109.6
513	R	33.3	Very low	28.2	Very low	231 Å²	231	152.7 Å²	152.7	87%	0.872	79%	0.786	S	S	*	*			trans	-123.7	98.6	160.9	-87.9	-171.2	167.1	-175	-3.4	108.6	F515	R513-F515 PolarHBondContact O-N 3.17Å
514	N	28.4	Very low	28.5	Very low	151 Å²	151	153.8 Å²	153.8	81%	0.807	79%	0.791	S	S	*	*			trans	-68.9	127.1	169.1	-62.1	-16.3	0	0	0	108.6
515	F	26.5	Very low	28.4	Very low	191 Å²	191	152.7 Å²	152.7	84%	0.838	79%	0.791	S	S	*	*			trans	-132.3	94.9	156.1	-98.2	-82.8	0	0	0	106.7	R513	R513-F515 PolarHBondContact O-N 3.17Å
516	S	25.7	Very low	28.5	Very low	90 Å²	90	155 Å²	155	63%	0.629	80%	0.795	S	S	*	*			trans	-80.4	143.6	166.1	-165.5	0	0	0	0	109.1	D518	S516-D518 PolarHBondContact OG-OD2 3.1Å
517	L	29.9	Very low	28.6	Very low	156 Å²	156	163.1 Å²	163.1	82%	0.817	80%	0.804	S	S	*	*			trans	-152.5	79	169.2	-125.1	169.7	0	0	0	108.3
518	D	26.1	Very low	28.5	Very low	122 Å²	122	163.3 Å²	163.3	65%	0.652	80%	0.799	S	S	*	*			trans	-63.1	131.4	178.7	-73.1	-67.1	0	0	0	111.9	S516	S516-D518 PolarHBondContact OG-OD2 3.1Å
519	V	31.1	Very low	28.5	Very low	130 Å²	130	162.2 Å²	162.2	79%	0.788	81%	0.805	S	S	*	*			trans	-135.5	90.6	162.3	-175.8	0	0	0	0	107.8
520	H	29.4	Very low	28.1	Very low	165 Å²	165	160.1 Å²	160.1	76%	0.764	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-68.4	135	176	-83.5	-78.3	0	0	0	111.6
521	P	32.5	Very low	28	Very low	117 Å²	117	158.7 Å²	158.7	76%	0.76	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-74.3	155.2	163.2	32.4	-33.6	0	0	0	111
522	Y	28.3	Very low	27.8	Very low	229 Å²	229	157 Å²	157	90%	0.898	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-70.3	140	-173.9	-81.8	-98.6	0	0	0	113.9
523	M	27.2	Very low	27.6	Very low	160 Å²	160	157.4 Å²	157.4	79%	0.788	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-71.2	131.2	166.8	-81.8	-68.3	-64.9	0	0	111.5
524	L	29.8	Very low	27.3	Very low	168 Å²	168	152 Å²	152	88%	0.88	80%	0.795	S	S	*	*			trans	-119.6	117.4	158.7	-91.3	170.3	0	0	0	109.5
525	T	25.8	Very low	27	Very low	116 Å²	116	151.3 Å²	151.3	71%	0.712	80%	0.796	S	S	*	*			trans	-81.4	133.8	-179.7	52	0	0	0	0	111.2
526	N	28.1	Very low	27	Very low	168 Å²	168	148.9 Å²	148.9	90%	0.898	80%	0.797	S	S	*	*			trans	-132.2	153.2	162.7	-103.9	-39.1	0	0	0	111.7
527	R	25.8	Very low	27.1	Very low	238 Å²	238	153.3 Å²	153.3	90%	0.898	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-73.4	147.1	-162	-75.5	172.4	161.7	162.5	-8.4	113.8
528	K	26.2	Very low	27.3	Very low	195 Å²	195	151.1 Å²	151.1	85%	0.848	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-65.5	139.4	153.4	-63	-178.7	179.1	-177.5	0	109.3
529	P	27.9	Very low	27.3	Very low	130 Å²	130	153.4 Å²	153.4	84%	0.844	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-60.5	139.3	159	-18.8	32.3	0	0	0	109.8
530	K	22.6	Very low	27.4	Very low	161 Å²	161	152.3 Å²	152.3	70%	0.7	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-94.2	132	173.9	-173.7	-169.5	174.6	-161.1	0	108.4	E532	K530-E532 WeakPolarHBondContact CE-OE1 3.43Å; K530-E532 IonicContact NZ-OE1 2.6Å; K530-E532 PolarHBondContact NZ-OE1 3.27Å
531	V	26.9	Very low	27.5	Very low	140 Å²	140	150.4 Å²	150.4	85%	0.848	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-74.4	128.3	165.8	176.7	0	0	0	0	108.1
532	E	23.9	Very low	27.2	Very low	151 Å²	151	154.3 Å²	154.3	71%	0.706	82%	0.82	S	S	*	*			trans	-134.9	121.3	175.1	-160.9	132	-106.5	0	0	107.1	K530	K530-E532 WeakPolarHBondContact CE-OE1 3.43Å; K530-E532 IonicContact NZ-OE1 2.6Å; K530-E532 PolarHBondContact NZ-OE1 3.27Å
533	A	24.9	Very low	27.1	Very low	96 Å²	96	150.5 Å²	150.5	79%	0.793	81%	0.81	S	S	*	*			trans	-103.4	129.5	-176.3	0	0	0	0	0	109.8
534	S	25.8	Very low	27.1	Very low	118 Å²	118	150.3 Å²	150.3	83%	0.825	81%	0.812	S	S	*	*			trans	-107.7	129.4	165.1	46.6	0	0	0	0	109.4
535	V	22.6	Very low	27	Very low	136 Å²	136	147.7 Å²	147.7	82%	0.824	80%	0.798	S	S	*	*			trans	-104.8	126	172.5	174.7	0	0	0	0	107.8
536	V	27.2	Very low	27	Very low	141 Å²	141	150 Å²	150	86%	0.855	81%	0.806	S	S	*	*			trans	-138.8	145.4	162.2	-176.9	0	0	0	0	107.5
537	E	26.6	Very low	27	Very low	183 Å²	183	146.4 Å²	146.4	86%	0.855	79%	0.791	S	S	*	*			trans	-92.8	152.5	-165.1	-158.3	166.1	150.9	0	0	112.5
538	P	33.8	Very low	27.1	Very low	110 Å²	110	142.3 Å²	142.3	71%	0.714	79%	0.791	S	S	*	*			trans	-106.2	150	-169.5	38.6	-33.4	0	0	0	115.3
539	L	26.5	Very low	27	Very low	169 Å²	169	142.8 Å²	142.8	89%	0.885	79%	0.789	S	S	*	*			trans	-174.8	167.7	159	-130.1	88.5	0	0	0	109.3
540	P	32.8	Very low	27.1	Very low	107 Å²	107	143.8 Å²	143.8	70%	0.695	79%	0.787	S	S	*	*			cis	-111.3	179.8	-49.4	37.7	-24.4	0	0	0	111.5
541	P	32.1	Very low	27.3	Very low	125 Å²	125	144.2 Å²	144.2	81%	0.812	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-89.9	155.1	174.4	35.5	-34.7	0	0	0	113.8
542	E	26.3	Very low	27.4	Very low	200 Å²	200	140.7 Å²	140.7	94%	0.935	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-102.2	154.2	164	-74.5	-150.6	131.8	0	0	112.7
543	H	27.2	Very low	27.8	Very low	148 Å²	148	140.2 Å²	140.2	69%	0.685	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-90.8	147.6	-174.9	-113.3	-73.7	0	0	0	112.6
544	N	26.6	Very low	28	Very low	157 Å²	157	143.2 Å²	143.2	84%	0.84	79%	0.788	S	S	*	*				-168.7	97.8	128.6	-86.4	-39.9	0	0	0	106.1
545	L	28.1	Very low	28.3	Very low	113 Å²	113	143.4 Å²	143.4	59%	0.592	79%	0.785	S	S	*	*				44.8	101	79.1	-80.4	166	0	0	0	113.1	T547	L545-T547 HydrophobicContact CD2-CG2 3.84Å
546	D	25.9	Very low	28.6	Very low	164 Å²	164	142.4 Å²	142.4	88%	0.877	77%	0.773	S	S	*	*				-140.9	153.3	114.9	-139.7	-23.9	0	0	0	109.7
547	T	27.3	Very low	28.6	Very low	93 Å²	93	142 Å²	142	57%	0.571	77%	0.771	S	S	*	*			trans	-135.4	133.5	-164.5	48.7	0	0	0	0	114.1	L545	L545-T547 HydrophobicContact CD2-CG2 3.84Å
548	V	27.4	Very low	28.5	Very low	151 Å²	151	140.1 Å²	140.1	92%	0.915	76%	0.762	S	S	*	*			trans	-131.8	127	149.7	-177.4	0	0	0	0	108.3
549	Y	24.6	Very low	28.2	Very low	206 Å²	206	140.9 Å²	140.9	81%	0.808	76%	0.764	S	S	*	*			trans	-130	148.7	-178.8	-125.4	-85.3	0	0	0	108.8
550	L	30	Very low	28.1	Very low	150 Å²	150	138.8 Å²	138.8	79%	0.785	76%	0.763	S	S	*	*			trans	-174.6	97.1	152.7	-97.1	164.6	0	0	0	104.1
551	E	28	Very low	27.9	Very low	171 Å²	171	139.6 Å²	139.6	80%	0.799	77%	0.77	S	S	*	*				73.2	128.3	90.3	-174.9	169.5	-125.6	0	0	111.1
552	G	28.9	Very low	27.5	Very low	66 Å²	66	138.4 Å²	138.4	68%	0.68	77%	0.771	S	S	*	*			cis	174.7	165	7.8	0	0	0	0	0	105.3
553	T	32	Very low	27.6	Very low	140 Å²	140	136.8 Å²	136.8	86%	0.859	77%	0.765	S	S	*	*			cis	-149.8	171.8	29.8	48.3	0	0	0	0	112.6
554	H	29.7	Very low	27.5	Very low	159 Å²	159	136.4 Å²	136.4	74%	0.736	77%	0.774	S	S	*	*			trans	-94.3	-179.8	179.3	-63.9	-89.3	0	0	0	111.9	I556	H554-I556 WeakPolarHBondContact ND1-CD1 3.4Å
555	T	31	Very low	27.3	Very low	123 Å²	123	134.3 Å²	134.3	76%	0.755	77%	0.766	S	S	*	*			cis	-140.9	168.5	22.4	60	0	0	0	0	111.8
556	I	29.1	Very low	27.2	Very low	115 Å²	115	134 Å²	134	59%	0.59	77%	0.773	S	S	*	*			cis	85.9	84.4	10.4	-47.3	179.8	0	0	0	117.3	H554	H554-I556 WeakPolarHBondContact ND1-CD1 3.4Å
557	V	26.5	Very low	27.2	Very low	132 Å²	132	132.2 Å²	132.2	80%	0.8	77%	0.769	S	S	*	*			trans	-143.4	99.1	149.2	-176.1	0	0	0	0	107.3
558	H	24.7	Very low	27.2	Very low	144 Å²	144	134.6 Å²	134.6	67%	0.667	78%	0.784	S	S	*	*				56.2	112.4	98.7	-75.3	-97.2	0	0	0	115.4
559	V	28	Very low	27.2	Very low	126 Å²	126	131.9 Å²	131.9	76%	0.764	78%	0.777	S	S	*	*				85.4	122	58	167.6	0	0	0	0	113.6
560	S	24.3	Very low	27.3	Very low	124 Å²	124	125.9 Å²	125.9	87%	0.867	77%	0.77	S	S	*	*			trans	-167.6	154.5	138.5	-84.6	0	0	0	0	112.4
561	C	28.6	Very low	27	Very low	125 Å²	125	128 Å²	128	85%	0.845	77%	0.773	S	S	*	*			trans	-131	147.3	174.4	176.4	0	0	0	0	108.5
562	A	24.1	Very low	27.7	Very low	100 Å²	100	124.6 Å²	124.6	83%	0.826	77%	0.765	S	S	*	*			trans	-150.9	147.7	175.4	0	0	0	0	0	112.1
563	M	28.8	Very low	27.5	Very low	165 Å²	165	127.8 Å²	127.8	81%	0.813	77%	0.772	S	S	*	*			trans	-123.6	134.3	175.8	-73.9	179.5	62.2	0	0	111.8
564	T	23.7	Very low	27.3	Very low	140 Å²	140	124.9 Å²	124.9	86%	0.859	76%	0.762	S	S	*	*			trans	-147.3	121.6	151.9	41	0	0	0	0	106.2
565	V	23.9	Very low	27.2	Very low	113 Å²	113	124 Å²	124	69%	0.685	77%	0.768	S	S	*	*			cis	81.6	87.6	48.6	-177	0	0	0	0	113.2
566	S	24.6	Very low	27.1	Very low	106 Å²	106	125.4 Å²	125.4	74%	0.741	77%	0.77	S	S	*	*			trans	61.4	155.9	144.2	-42.6	0	0	0	0	119.3
567	T	26	Very low	27.5	Very low	128 Å²	128	125.7 Å²	125.7	79%	0.785	78%	0.78	S	S	*	*			cis	-160.8	145.6	8.5	-21.8	0	0	0	0	111.3
568	T	26.8	Very low	27.6	Very low	143 Å²	143	125.1 Å²	125.1	88%	0.877	78%	0.781	S	S	*	*			trans	-164.1	129.2	145.2	13.2	0	0	0	0	114.3
569	A	27.8	Very low	27.6	Very low	93 Å²	93	123.1 Å²	123.1	77%	0.769	79%	0.79	S	S	*	*			trans	38.1	94	152.2	0	0	0	0	0	122.5
570	A	26.1	Very low	27.6	Very low	80 Å²	80	123.1 Å²	123.1	66%	0.661	79%	0.79	S	S	*	*				-6.6	155.2	114.9	0	0	0	0	0	118.4
571	F	24.7	Very low	27.7	Very low	196 Å²	196	127.8 Å²	127.8	86%	0.86	79%	0.791	S	S	*	*			cis	178.4	-174.2	-1.5	-105.5	-37.2	0	0	0	108
572	P	42.3	Very low	27.7	Very low	98 Å²	98	126.7 Å²	126.7	64%	0.636	78%	0.78	S	S	*	*			cis	-140	178.1	-29.4	33.1	-11.6	0	0	0	116.5
573	T	25.8	Very low	27.8	Very low	133 Å²	133	129.9 Å²	129.9	82%	0.816	78%	0.783	S	S	*	*			trans	76.6	138.8	142.7	29.4	0	0	0	0	125.9
574	A	27.5	Very low	27.7	Very low	80 Å²	80	125.3 Å²	125.3	66%	0.661	78%	0.778	S	S	*	*				96.5	98.5	129.7	0	0	0	0	0	123.1
575	T	26.4	Very low	27.9	Very low	140 Å²	140	125.5 Å²	125.5	86%	0.859	78%	0.779	S	S	*	*				64.7	132.5	121.4	-22.6	0	0	0	0	122.7
576	L	29.9	Very low	28.3	Very low	152 Å²	152	125 Å²	125	80%	0.796	78%	0.781	S	S	*	*			trans	-54.3	165.3	155.2	-77	145.5	0	0	0	112.5
577	P	36.9	Very low	29.2	Very low	122 Å²	122	125.5 Å²	125.5	79%	0.792	78%	0.781	S	S	*	*			cis	-144.3	-164.7	32.1	43.5	-22.6	0	0	0	116.5
578	S	27.7	Very low	29.3	Very low	119 Å²	119	126.4 Å²	126.4	83%	0.832	78%	0.781	S	S	*	*			trans	-70.4	151.8	-175.8	-39.6	0	0	0	0	116.1
579	A	26	Very low	30.7	Very low	102 Å²	102	125 Å²	125	84%	0.843	77%	0.774	S	S	*	*			trans	-146.8	143	155	0	0	0	0	0	111.2
580	T	27	Very low	31.4	Very low	126 Å²	126	126.1 Å²	126.1	77%	0.773	77%	0.774	S	S	*	*			trans	-94.8	143.6	177.2	-50.7	0	0	0	0	109.8
581	Y	27.1	Very low	31.6	Very low	223 Å²	223	127.3 Å²	127.3	88%	0.875	78%	0.777	S	S	*	*			trans	-160.9	123.5	133.6	-122	-83.5	0	0	0	115.3
582	V	29.2	Very low	31.8	Very low	101 Å²	101	122.9 Å²	122.9	61%	0.612	77%	0.77	S	S	*	*			trans	-17.5	134	157	-171.2	0	0	0	0	118.1
583	N	26.1	Very low	31.3	Very low	168 Å²	168	126.9 Å²	126.9	90%	0.898	78%	0.781	S	S	*	*				-167.5	154.2	123.5	-95.6	-24.7	0	0	0	111
584	G	26.4	Very low	31.5	Very low	69 Å²	69	128 Å²	128	71%	0.711	78%	0.782	S	S	*	*			trans	-149.2	168.7	177.5	0	0	0	0	0	111.9
585	V	27.5	Very low	31.7	Very low	144 Å²	144	128.2 Å²	128.2	87%	0.873	78%	0.783	S	S	*	*			trans	-164.6	153.6	168.9	133.1	0	0	0	0	108.3
586	S	33.5	Very low	31.9	Very low	103 Å²	103	130 Å²	130	72%	0.72	79%	0.787	S	S	*	*			trans	-128.8	141.1	165.4	177.6	0	0	0	0	108.3
587	P	42	Very low	31.8	Very low	116 Å²	116	127.7 Å²	127.7	75%	0.753	78%	0.783	S	S	*	*				-146.3	166.9	112.1	36.2	-19.7	0	0	0	116.4
588	N	28.9	Very low	32.1	Very low	146 Å²	146	126.9 Å²	126.9	78%	0.781	78%	0.778	S	S	*	*			trans	-82.5	-170.1	169.9	-69.2	-20.1	0	0	0	112.3
589	P	56.8	Low	32.1	Very low	114 Å²	114	130.4 Å²	130.4	74%	0.74	78%	0.778	S	S	*	*			cis	-120.2	-163.5	-42.9	36.8	-18.2	0	0	0	110.5
590	P	41.9	Very low	32.1	Very low	116 Å²	116	131 Å²	131	75%	0.753	78%	0.776	S	S	*	*				-129.9	163.6	70.4	14.2	10.3	0	0	0	112.3
591	S	29.2	Very low	32.1	Very low	105 Å²	105	130.1 Å²	130.1	73%	0.734	78%	0.775	S	S	*	*			cis	97.3	104.7	21.2	86.4	0	0	0	0	116.9
592	S	30.7	Very low	33.3	Very low	103 Å²	103	125.4 Å²	125.4	72%	0.72	77%	0.772	S	S	*	*			trans	-169.8	125.9	155.2	54.8	0	0	0	0	111.7
593	E	31.6	Very low	33.2	Very low	182 Å²	182	125.5 Å²	125.5	85%	0.85	78%	0.783	S	S	*	*			trans	57.7	144.7	145.2	-70	152.2	-171.3	0	0	120.3
594	D	29.7	Very low	33.2	Very low	158 Å²	158	126.4 Å²	126.4	85%	0.845	78%	0.782	S	S	*	*			cis	-147	175.2	-0.8	-147.6	-17.4	0	0	0	111.9
595	A	30.7	Very low	33.4	Very low	83 Å²	83	130.7 Å²	130.7	69%	0.686	79%	0.787	S	S	*	*			trans	-126.2	150.1	-168.2	0	0	0	0	0	115.3
596	L	31.6	Very low	33.2	Very low	178 Å²	178	131.4 Å²	131.4	93%	0.932	78%	0.781	S	S	*	*			trans	-161.7	155.9	145.7	-107.7	157.1	0	0	0	112.1
597	S	27	Very low	32.8	Very low	104 Å²	104	134.4 Å²	134.4	73%	0.727	79%	0.788	S	S	*	*			trans	-143.9	-178	-173.2	-131.6	0	0	0	0	107.9
598	P	42.8	Very low	32.1	Very low	104 Å²	104	135.8 Å²	135.8	68%	0.675	79%	0.788	S	S	*	*			cis	-148.7	179	29.8	45.5	-24.7	0	0	0	118.4
599	K	27.5	Very low	33.8	Very low	193 Å²	193	133.9 Å²	133.9	84%	0.839	78%	0.784	S	S	*	*			trans	27.5	150.6	132.4	-62.1	174	-176.9	177.3	0	120.8
600	S	26.1	Very low	33.5	Very low	115 Å²	115	134.3 Å²	134.3	80%	0.804	79%	0.787	S	S	*	*			cis	-169.6	172.4	3	37	0	0	0	0	112.4
601	S	27.4	Very low	33	Very low	107 Å²	107	133.1 Å²	133.1	75%	0.748	79%	0.787	S	S	*	*			trans	-96.4	-166.9	171	58.8	0	0	0	0	112.2
602	P	53.5	Low	32.8	Very low	124 Å²	124	137.1 Å²	137.1	81%	0.805	79%	0.794	S	S	*	*			cis	-130	-175.3	-24.8	40.4	-24.4	0	0	0	113.8
603	A	26.3	Very low	32.6	Very low	103 Å²	103	138 Å²	138	85%	0.851	79%	0.791	S	S	*	*			trans	-175.9	175	151.9	0	0	0	0	0	114.5
604	Q	26.9	Very low	33.2	Very low	188 Å²	188	135 Å²	135	88%	0.879	79%	0.787	S	S	*	*			trans	-131.7	-171.6	-173.2	-66.2	174.1	-102.3	0	0	113.7
605	I	28.8	Very low	33.2	Very low	159 Å²	159	134.7 Å²	134.7	82%	0.815	78%	0.78	S	S	*	*			trans	89.7	145.6	162	-54.7	172	0	0	0	115.3
606	E	24.9	Very low	34.6	Very low	159 Å²	159	135.4 Å²	135.4	74%	0.743	78%	0.778	S	S	*	*			cis	167.5	137.5	-41.6	171.5	178.3	170.6	0	0	109.1
607	L	25.1	Very low	35.4	Very low	166 Å²	166	131.6 Å²	131.6	87%	0.869	76%	0.764	S	S	*	*			trans	-173.9	156.9	154.1	-107.3	150.1	0	0	0	113.3
608	L	26.4	Very low	35.4	Very low	144 Å²	144	134.3 Å²	134.3	75%	0.754	77%	0.77	S	S	*	*			trans	-150.7	-174.5	-164.6	-119.5	75.8	0	0	0	110.2
609	P	65.3	Low	34.7	Very low	107 Å²	107	136.1 Å²	136.1	70%	0.695	77%	0.773	S	S	*	*			cis	-116.6	-103.4	-32.8	36.8	-17.8	0	0	0	107.7
610	P	50.1	Low	34.6	Very low	122 Å²	122	132.3 Å²	132.3	79%	0.792	77%	0.766	S	S	*	*			cis	-91.6	-174.2	-46.3	43.9	-34	0	0	0	110.9
611	A	32	Very low	34.7	Very low	92 Å²	92	136.7 Å²	136.7	76%	0.76	77%	0.77	S	S	*	*			cis	-144.5	-170.2	-5.3	0	0	0	0	0	106.9
612	E	25.3	Very low	34.7	Very low	189 Å²	189	135.7 Å²	135.7	88%	0.883	77%	0.768	S	S	*	*			cis	-147.7	164.5	-5.3	-163.2	165.8	-160.9	0	0	107.3
613	N	26.5	Very low	34.8	Very low	121 Å²	121	135.4 Å²	135.4	65%	0.647	77%	0.767	S	S	*	*			trans	-132.9	175	-169.8	-133.9	-2.7	0	0	0	110.8
614	P	42.4	Very low	34.8	Very low	118 Å²	118	137.5 Å²	137.5	77%	0.766	77%	0.769	S	S	*	*			cis	-129.7	162.8	39.4	29.6	-7	0	0	0	115.6
615	E	31.4	Very low	35	Very low	152 Å²	152	137.6 Å²	137.6	71%	0.71	77%	0.769	S	S	*	*			cis	81.8	151.4	42.3	-98.5	-149.6	134.1	0	0	116.7
616	P	58.4	Low	35	Very low	99 Å²	99	138.7 Å²	138.7	64%	0.643	77%	0.771	S	S	*	*			cis	-130.6	-127.9	-29.7	37.1	-16	0	0	0	109.9
617	P	49.1	Very low	35.2	Very low	98 Å²	98	137.9 Å²	137.9	64%	0.636	77%	0.771	S	S	*	*			cis	-129.9	128.5	-42.4	33.3	-14.3	0	0	0	116.5
618	L	27.4	Very low	35.3	Very low	161 Å²	161	137.3 Å²	137.3	84%	0.843	77%	0.768	S	S	*	*				55.9	176.8	127.5	-54.8	169.9	0	0	0	123.9
619	L	28.2	Very low	35.2	Very low	142 Å²	142	134.9 Å²	134.9	74%	0.743	76%	0.763	S	S	*	*				-169.1	164.5	-67.5	-139.1	138	0	0	0	111.6
620	T	25.7	Very low	33.6	Very low	113 Å²	113	136 Å²	136	69%	0.693	76%	0.762	S	S	*	*			trans	80.2	109.7	152	8.3	0	0	0	0	123.5
621	K	27.1	Very low	32.6	Very low	206 Å²	206	139 Å²	139	90%	0.896	77%	0.765	S	S	*	*				61.5	138.8	119.2	-154.1	171.8	-174.9	178.7	0	122.7
622	A	27.1	Very low	32.3	Very low	86 Å²	86	142.2 Å²	142.2	71%	0.711	76%	0.764	S	S	*	*			trans	-99.6	-162	-176.8	0	0	0	0	0	113.3
623	P	56	Low	32.5	Very low	118 Å²	118	139.6 Å²	139.6	77%	0.766	76%	0.761	S	S	*	*			cis	-137.3	174.7	-13.4	42.3	-25.8	0	0	0	116.1
624	T	26.8	Very low	32.5	Very low	148 Å²	148	140.5 Å²	140.5	91%	0.908	77%	0.765	S	S	*	*			trans	-153	162.9	164.4	28.3	0	0	0	0	115
625	H	30.4	Very low	31.7	Very low	189 Å²	189	144.5 Å²	144.5	88%	0.875	77%	0.771	S	S	*	*			trans	-111.6	177.6	175.8	-100.7	-92.1	0	0	0	111.7
626	Q	29.1	Very low	31.6	Very low	182 Å²	182	145.5 Å²	145.5	85%	0.85	78%	0.775	S	S	*	*			trans	102.2	156.7	166.3	-62	-179	18.8	0	0	115.7
627	L	30	Very low	30.1	Very low	143 Å²	143	148.7 Å²	148.7	75%	0.749	78%	0.782	S	S	*	*			cis	-176.4	164.9	-44.5	-124.1	174.6	0	0	0	107.6
628	L	27.2	Very low	29.2	Very low	154 Å²	154	152.1 Å²	152.1	81%	0.806	79%	0.789	S	S	*	*			trans	69.6	167.1	165.7	-57.7	141.5	0	0	0	118.4
629	S	24.2	Very low	29.3	Very low	92 Å²	92	152.2 Å²	152.2	64%	0.643	79%	0.785	S	S	*	*			cis	-178.6	167.8	-43.9	-164.3	0	0	0	0	111.2
630	I	31.1	Very low	29.3	Very low	132 Å²	132	152.4 Å²	152.4	68%	0.677	79%	0.787	S	S	*	*			trans	62.7	115.3	160.9	-33.6	-176.7	0	0	0	118.6
631	H	28.3	Very low	29.4	Very low	184 Å²	184	152.1 Å²	152.1	85%	0.852	80%	0.796	S	S	*	*				-166.9	166.9	107.3	-110.3	-79.7	0	0	0	114.2
632	H	27.1	Very low	29.5	Very low	159 Å²	159	151.2 Å²	151.2	74%	0.736	80%	0.795	S	S	*	*			trans	-149.1	122.6	-151.1	-149.8	-68.2	0	0	0	111.3
633	T	29	Very low	29.5	Very low	135 Å²	135	153.1 Å²	153.1	83%	0.828	79%	0.793	S	S	*	*			trans	-162.6	120	160.6	38.4	0	0	0	0	106.5
634	L	26.1	Very low	28.1	Very low	140 Å²	140	159.5 Å²	159.5	73%	0.733	80%	0.802	S	S	*	*				58.6	105.4	59.8	-80	172.6	0	0	0	115.2
635	F	27.1	Very low	28.2	Very low	202 Å²	202	164 Å²	164	89%	0.886	80%	0.803	S	S	*	*				-159.2	168.6	123.9	-117.2	-82.3	0	0	0	109.8
636	E	28.6	Very low	28	Very low	172 Å²	172	158.6 Å²	158.6	80%	0.804	80%	0.798	S	S	*	*			trans	-113.3	-156.8	-169.9	-60.9	-175.3	101.4	0	0	112.9
637	E	27.4	Very low	27.9	Very low	167 Å²	167	160.8 Å²	160.8	78%	0.78	80%	0.798	S	S	*	*			trans	77.2	114.3	173.8	-67.1	168.1	-175.4	0	0	115
638	E	29.8	Very low	27.7	Very low	170 Å²	170	160.1 Å²	160.1	79%	0.794	80%	0.795	S	S	*	*				81.4	144.1	77.8	-82.9	-175.5	179.5	0	0	112.9
639	E	28.8	Very low	27.6	Very low	163 Å²	163	161.4 Å²	161.4	76%	0.762	80%	0.797	S	S	*	*			cis	-149.6	-168.1	-6.6	-146	-174.7	-169.7	0	0	110
640	D	28.2	Very low	27.6	Very low	146 Å²	146	165.5 Å²	165.5	78%	0.781	81%	0.806	S	S	*	*			trans	-31.6	146.9	176.3	-74.2	-15.5	0	0	0	120.3
641	A	28.5	Very low	27.4	Very low	107 Å²	107	170.6 Å²	170.6	88%	0.884	82%	0.816	S	S	*	*				-163.2	136.1	122.4	0	0	0	0	0	112.6
642	E	28.3	Very low	28	Very low	187 Å²	187	167.6 Å²	167.6	87%	0.874	81%	0.813	S	S	*	*			trans	-101.3	165.4	178.4	-151.2	-169.4	144.4	0	0	112.7
643	N	27	Very low	28.1	Very low	126 Å²	126	163.3 Å²	163.3	67%	0.674	81%	0.812	S	S	*	*			trans	74.6	105.4	145.8	-169.2	11	0	0	0	119.9
644	R	27.8	Very low	28.1	Very low	252 Å²	252	164.6 Å²	164.6	95%	0.951	81%	0.809	S	S	*	*			trans	-150	157.4	131.6	-113.8	175	-168.2	-144.2	1.3	112.3
645	R	27.4	Very low	28.3	Very low	242 Å²	242	164.4 Å²	164.4	91%	0.913	81%	0.808	S	S	*	*			trans	-147.9	138.4	-158.1	-165.8	-175.9	-155.4	-116.3	6.4	113.5
646	G	26.4	Very low	28.4	Very low	75 Å²	75	161.9 Å²	161.9	77%	0.773	80%	0.802	S	S	*	*			trans	97.6	162	171.1	0	0	0	0	0	114.5
647	R	26.8	Very low	28.3	Very low	228 Å²	228	158 Å²	158	86%	0.86	80%	0.799	S	S	*	*			cis	-158.9	168.3	-3.1	-177.4	178.5	-105.5	-104.5	6.5	108.7
648	L	26	Very low	28.3	Very low	130 Å²	130	155.1 Å²	155.1	68%	0.681	80%	0.804	S	S	*	*			trans	-18.4	150.2	172.8	-73.8	72.9	0	0	0	116.9
649	E	26.7	Very low	28.1	Very low	181 Å²	181	150.6 Å²	150.6	85%	0.846	80%	0.803	S	S	*	*				-153.4	-176.6	53.4	-74.9	170.4	164.7	0	0	109.5
650	E	24.4	Very low	28.5	Very low	177 Å²	177	149 Å²	149	83%	0.827	81%	0.807	S	S	*	*			cis	168.1	-178.2	-29.7	-172.7	141.1	-144.8	0	0	105.3
651	R	25.1	Very low	28.4	Very low	239 Å²	239	150.7 Å²	150.7	90%	0.902	81%	0.814	S	S	*	*			trans	-105.3	-172.1	-162.6	-104.1	-178.9	177.9	148.7	-4.6	113.6
652	P	41.3	Very low	28.3	Very low	121 Å²	121	150.3 Å²	150.3	79%	0.786	81%	0.805	S	S	*	*			cis	-126.5	173.5	1.7	35.9	-15.2	0	0	0	115.1
653	G	28.7	Very low	28.4	Very low	69 Å²	69	149.8 Å²	149.8	71%	0.711	80%	0.8	S	S	*	*				111.7	159.8	89	0	0	0	0	0	110.9
654	E	29.8	Very low	28.4	Very low	163 Å²	163	153 Å²	153	76%	0.762	81%	0.81	S	S	*	*			cis	-163.4	148.5	-13.2	-94.5	-154.8	109.5	0	0	110.5
655	L	29.8	Very low	28.4	Very low	135 Å²	135	147.2 Å²	147.2	71%	0.707	80%	0.803	S	S	*	*			trans	53.7	158.2	145.7	-77.3	47.1	0	0	0	120.9
656	I	29.4	Very low	28.4	Very low	150 Å²	150	142.4 Å²	142.4	77%	0.769	79%	0.794	S	S	*	*			cis	-158.9	147.5	-15.1	-117.7	166.8	0	0	0	110.6
657	A	27.3	Very low	28.4	Very low	90 Å²	90	145.1 Å²	145.1	74%	0.744	80%	0.795	S	S	*	*			trans	161.9	108.7	148.5	0	0	0	0	0	109
658	A	26.7	Very low	28.5	Very low	107 Å²	107	140.9 Å²	140.9	88%	0.884	79%	0.788	S	S	*	*				56.4	116.6	61.6	0	0	0	0	0	113.3
659	G	24.8	Very low	28.6	Very low	75 Å²	75	138.6 Å²	138.6	77%	0.773	79%	0.788	S	S	*	*			cis	167.1	-163.9	-0.8	0	0	0	0	0	108.4
660	P	37.6	Very low	28.7	Very low	129 Å²	129	136.2 Å²	136.2	84%	0.838	79%	0.786	S	S	*	*			cis	-130.9	151	-29.8	39	-24	0	0	0	113.7
661	I	27.6	Very low	29.1	Very low	181 Å²	181	133.4 Å²	133.4	93%	0.928	78%	0.776	S	S	*	*			trans	-134.9	149.1	165.7	-66	-175.1	0	0	0	110.5
662	S	26.5	Very low	29.4	Very low	99 Å²	99	127.1 Å²	127.1	69%	0.692	77%	0.768	S	S	*	*			trans	-86.9	122.2	-163.3	177.6	0	0	0	0	116.1
663	K	29.2	Very low	28.9	Very low	177 Å²	177	129.9 Å²	129.9	77%	0.77	77%	0.768	S	S	*	*			trans	36.1	112.8	138.9	-56.4	177.5	179.4	179.1	0	119.3
664	H	28.2	Very low	28.9	Very low	194 Å²	194	131 Å²	131	90%	0.898	77%	0.765	S	S	*	*				-142.8	110.8	129.3	-93.4	-65.1	0	0	0	109.6
665	T	27.4	Very low	29.1	Very low	130 Å²	130	132.9 Å²	132.9	80%	0.798	77%	0.771	S	S	*	*			trans	-83.2	124.6	-179.9	-52.1	0	0	0	0	110.4
666	I	26.4	Very low	28.9	Very low	141 Å²	141	133.5 Å²	133.5	72%	0.723	78%	0.775	S	S	*	*			trans	-105.2	108.6	174	-58.4	178.3	0	0	0	108.6	I668	I666-I668 HydrophobicContact CG2-CG1 4.07Å; I666-I668 PolarHBondContact O-N 3.28Å
667	T	27.3	Very low	29.1	Very low	131 Å²	131	136 Å²	136	80%	0.804	78%	0.775	S	S	*	*			trans	-80.3	100.9	179.2	-46.6	0	0	0	0	110.6
668	I	28.1	Very low	29.3	Very low	139 Å²	139	137.7 Å²	137.7	71%	0.713	78%	0.778	S	S	*	*			trans	-94.7	110.1	173.1	-56.6	-179.5	0	0	0	108.9	I666 T670	I666-I668 HydrophobicContact CG2-CG1 4.07Å; I666-I668 PolarHBondContact O-N 3.28Å; I668-T670 PolarHBondContact O-N 3.19Å
669	A	29.4	Very low	29.5	Very low	82 Å²	82	141 Å²	141	68%	0.678	77%	0.773	S	S	*	*			trans	-86.1	104.5	178.2	0	0	0	0	0	111.4	I671	A669-I671 PolarHBondContact O-N 2.94Å
670	T	28.3	Very low	29.9	Very low	131 Å²	131	143.7 Å²	143.7	80%	0.804	77%	0.769	S	S	*	*			trans	-82.5	109.8	178.4	-27.2	0	0	0	0	111	I668	I668-T670 PolarHBondContact O-N 3.19Å
671	I	33.4	Very low	29.6	Very low	118 Å²	118	144.6 Å²	144.6	61%	0.605	77%	0.765	S	S	*	*			trans	-87.1	123.9	178.6	-56.2	175.9	0	0	0	109.7	A669 F673	A669-I671 PolarHBondContact O-N 2.94Å; I671-F673 HydrophobicContact CG2-CD2 4.1Å; I671-F673 HydrophobicContact CG2-CE2 3.7Å; I671-F673 HydrophobicContact CG2-CZ 4.43Å
672	S	29.5	Very low	29.8	Very low	107 Å²	107	141.8 Å²	141.8	75%	0.748	75%	0.751	S	S	*	*			trans	-122.5	124.2	176.4	-173.2	0	0	0	0	111.4
673	F	31.2	Very low	30.1	Very low	179 Å²	179	141 Å²	141	79%	0.785	75%	0.751	S	S	*	*			trans	-94.6	108.7	179.7	-80.6	-90.1	0	0	0	111.1	I671	I671-F673 HydrophobicContact CG2-CD2 4.1Å; I671-F673 HydrophobicContact CG2-CE2 3.7Å; I671-F673 HydrophobicContact CG2-CZ 4.43Å
674	S	29.7	Very low	30	Very low	92 Å²	92	138.3 Å²	138.3	64%	0.643	75%	0.75	S	S	*	*			trans	-89.5	132.2	172.1	-175.1	0	0	0	0	111.4	N676	S674-N676 PolarHBondContact O-N 3.21Å; S674-N676 VanDerWaalsContact O-N 3.07Å
675	K	32.8	Very low	30.1	Very low	204 Å²	204	134.3 Å²	134.3	89%	0.887	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.6	-11.9	-166.7	-150.9	171.6	-173.7	175.6	0	115.4
676	N	26.8	Very low	30.1	Very low	148 Å²	148	134.7 Å²	134.7	79%	0.791	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.4	8.8	-165.4	-73.4	9.1	0	0	0	115.7	S674	S674-N676 PolarHBondContact O-N 3.21Å; S674-N676 VanDerWaalsContact O-N 3.07Å
677	R	33.4	Very low	30.5	Very low	203 Å²	203	138.8 Å²	138.8	77%	0.766	77%	0.766	S	S	*	*			trans	-143.3	137.3	173.5	-66.4	-169.8	-176.2	-162.5	1.9	112.4	F679	R677-F679 VanDerWaalsContact C-N 3.25Å; R677-F679 PolarHBondContact O-N 2.96Å
678	P	31.8	Very low	30.6	Very low	124 Å²	124	139.2 Å²	139.2	81%	0.805	76%	0.764	S	S	*	*			trans	-86.7	26.5	-179.5	37.5	-37.9	0	0	0	113.9
679	F	29.6	Very low	30.8	Very low	178 Å²	178	139.2 Å²	139.2	78%	0.781	77%	0.767	S	S	*	*	S	Bend	trans	-115.9	131.6	-178.7	-81.6	-80.4	0	0	0	111.7	R677 L681	R677-F679 VanDerWaalsContact C-N 3.25Å; R677-F679 PolarHBondContact O-N 2.96Å; F679-L681 PolarHBondContact O-N 3.4Å
680	L	34	Very low	30.8	Very low	131 Å²	131	142.3 Å²	142.3	69%	0.686	77%	0.772	S	S	*	*			trans	-71.5	107.6	176.4	-175.9	73.5	0	0	0	110	I682	L680-I682 HydrophobicContact CD2-CD1 3.96Å; L680-I682 HydrophobicContact CD2-CG1 3.92Å; L680-I682 HydrophobicContact CG-CG1 3.99Å; L680-I682 PolarHBondContact O-N 3.28Å
681	L	30.8	Very low	31	Very low	147 Å²	147	143 Å²	143	77%	0.77	77%	0.77	S	S	*	*			trans	-90.6	91.5	176.4	-112	164.5	0	0	0	110.2	F679 A683	F679-L681 PolarHBondContact O-N 3.4Å; L681-A683 PolarHBondContact O-N 3.48Å
682	I	32.2	Very low	30.8	Very low	122 Å²	122	144.6 Å²	144.6	63%	0.626	78%	0.78	S	S	*	*			trans	-78	96	170.9	-53.2	180	0	0	0	108.2	L680 T684	L680-I682 HydrophobicContact CD2-CD1 3.96Å; L680-I682 HydrophobicContact CD2-CG1 3.92Å; L680-I682 HydrophobicContact CG-CG1 3.99Å; L680-I682 PolarHBondContact O-N 3.28Å; I682-T684 HydrophobicContact CG2-CG2 4.13Å; I682-T684 PolarHBondContact O-N 3.41Å
683	A	32	Very low	30.9	Very low	84 Å²	84	147.1 Å²	147.1	69%	0.694	78%	0.782	S	S	*	*			trans	-83.1	90.1	175.8	0	0	0	0	0	110.8	L681 S685	L681-A683 PolarHBondContact O-N 3.48Å; A683-S685 PolarHBondContact O-N 2.83Å; A683-S685 VanDerWaalsContact O-N 3.08Å
684	T	28.9	Very low	30.9	Very low	120 Å²	120	144.8 Å²	144.8	74%	0.736	78%	0.782	S	S	*	*			trans	-76.8	86	171.2	51.9	0	0	0	0	110.8	I682 V686	I682-T684 HydrophobicContact CG2-CG2 4.13Å; I682-T684 PolarHBondContact O-N 3.41Å; T684-V686 PolarHBondContact O-N 2.6Å
685	S	28.3	Very low	31	Very low	110 Å²	110	148.8 Å²	148.8	77%	0.769	79%	0.793	S	S	*	*			trans	-71.1	114.3	162.4	-71.8	0	0	0	0	109.4	A683	A683-S685 PolarHBondContact O-N 2.83Å; A683-S685 VanDerWaalsContact O-N 3.08Å
686	V	28.7	Very low	30.9	Very low	137 Å²	137	144.3 Å²	144.3	83%	0.83	79%	0.785	S	S	*	*			trans	-88.1	130.8	166.5	-179.2	0	0	0	0	108.1	T684	T684-V686 PolarHBondContact O-N 2.6Å
687	I	33.8	Very low	31.2	Very low	227 Å²	227	143.9 Å²	143.9	100%	1.164	78%	0.784	S	S	*	*			trans	-135.4	0	168.2	-54.4	-179.1	0	0	0	106.4

Retrieved 687 of 687 residues in 142.1 ms (Link to these results)

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