A0A5K4FBI8_SCHMA Loading...

Rac guanyl-nucleotide exchange factor

AlphaFold DB , UniProt , Accession A0A5K4FBI8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 576 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	38	Very low	51.7	Low	171 Å²	171	104.5 Å²	104.5	84%	0.842	52%	0.524	S	S	*	.				0	-68.7	0	-164.7	174.3	-77.4	0	0	111.2	Q3 F4 F5	M1-Q3 PolarHBondContact O-N 3.46Å; M1-F4 WeakPolarHBondContact O-CB 3.42Å; M1-F4 PolarHBondContact O-N 3.38Å; M1-F5 HydrophobicContact CG-CD2 4.27Å; M1-F5 HydrophobicContact CG-CE2 3.96Å; M1-F5 PolarHBondContact O-N 2.92Å
2	F	35.5	Very low	52.7	Low	182 Å²	182	100 Å²	100	80%	0.798	50%	0.5	S	S	*	.	H	α-helix	trans	-51.8	-48.1	-177.8	-143.1	-86.7	0	0	0	113.5	F4 F5 S6	F2-F4 PolarHBondContact O-N 3.11Å; F2-F5 WeakPolarHBondContact O-CB 3.26Å; F2-F5 PolarHBondContact O-N 3Å; F2-S6 PolarHBondContact O-N 2.87Å
3	Q	42.4	Very low	54.2	Low	130 Å²	130	97.8 Å²	97.8	61%	0.607	49%	0.491	S	S	*	.	H	α-helix	trans	-55.3	-33.8	176	-164.8	64.8	49.5	0	0	114.4	M1 S6 N7	M1-Q3 PolarHBondContact O-N 3.46Å; Q3-S6 PolarHBondContact O-N 2.91Å; Q3-N7 PolarHBondContact NE2-OD1 2.84Å; Q3-N7 WeakPolarHBondContact O-CB 3.17Å; Q3-N7 VanDerWaalsContact O-CG 3.26Å; Q3-N7 PolarHBondContact O-N 3.5Å; Q3-N7 PolarHBondContact O-OD1 3.02Å
4	F	46.1	Very low	56	Low	143 Å²	143	98.5 Å²	98.5	63%	0.627	49%	0.492	S	S	*	.	H	α-helix	trans	-70.6	-38.5	177.9	-177.7	-91.2	0	0	0	111.2	M1 F2 A8	M1-F4 WeakPolarHBondContact O-CB 3.42Å; M1-F4 PolarHBondContact O-N 3.38Å; F2-F4 PolarHBondContact O-N 3.11Å; F4-A8 VanDerWaalsContact O-CB 3.27Å; F4-A8 WeakPolarHBondContact O-CB 3.44Å; F4-A8 PolarHBondContact O-N 2.85Å
5	F	40.9	Very low	57.1	Low	110 Å²	110	100.1 Å²	100.1	48%	0.482	50%	0.497	S	S	.	.	H	α-helix	trans	-66.7	-39.2	172.7	-75.9	-71.3	0	0	0	112	M1 F2 L9	M1-F5 HydrophobicContact CG-CD2 4.27Å; M1-F5 HydrophobicContact CG-CE2 3.96Å; M1-F5 PolarHBondContact O-N 2.92Å; F2-F5 WeakPolarHBondContact O-CB 3.26Å; F2-F5 PolarHBondContact O-N 3Å; F5-L9 WeakPolarHBondContact O-CB 3.28Å; F5-L9 PolarHBondContact O-N 3.29Å
6	S	51.2	Low	58	Low	39 Å²	39	100 Å²	100	27%	0.273	50%	0.498	S	S	.	.	H	α-helix	trans	-58.1	-60.9	171	-61.9	0	0	0	0	110.8	F2 Q3 A8 L9 D10	F2-S6 PolarHBondContact O-N 2.87Å; Q3-S6 PolarHBondContact O-N 2.91Å; S6-A8 PolarHBondContact O-N 2.82Å; S6-A8 VanDerWaalsContact O-N 3.13Å; S6-L9 CarbonylContact O-C 3.52Å; S6-L9 PolarHBondContact O-N 3.41Å; S6-D10 WeakPolarHBondContact O-CB 3.29Å; S6-D10 PolarHBondContact O-N 3.49Å; S6-D10 VanDerWaalsContact O-OD2 3.06Å
7	N	62	Low	59.3	Low	86 Å²	86	100.5 Å²	100.5	46%	0.46	50%	0.497	S	S	.	.	H	α-helix	trans	-54.7	-39	-178.5	-68.1	27.7	0	0	0	112.8	Q3 T11	Q3-N7 PolarHBondContact NE2-OD1 2.84Å; Q3-N7 WeakPolarHBondContact O-CB 3.17Å; Q3-N7 VanDerWaalsContact O-CG 3.26Å; Q3-N7 PolarHBondContact O-N 3.5Å; Q3-N7 PolarHBondContact O-OD1 3.02Å; N7-T11 WeakPolarHBondContact O-CB 3.17Å; N7-T11 PolarHBondContact O-N 2.77Å; N7-T11 PolarHBondContact O-OG1 3.24Å
8	A	52.3	Low	60.4	Low	28 Å²	28	100.6 Å²	100.6	23%	0.231	50%	0.499	C	S	.	.	H	α-helix	trans	-69.4	-40.5	177.2	0	0	0	0	0	112.6	F4 S6 T11 Q12	F4-A8 VanDerWaalsContact O-CB 3.27Å; F4-A8 WeakPolarHBondContact O-CB 3.44Å; F4-A8 PolarHBondContact O-N 2.85Å; S6-A8 PolarHBondContact O-N 2.82Å; S6-A8 VanDerWaalsContact O-N 3.13Å; A8-T11 WeakPolarHBondContact O-CB 3.29Å; A8-T11 PolarHBondContact O-N 2.9Å; A8-Q12 WeakPolarHBondContact O-CG 3.36Å; A8-Q12 PolarHBondContact O-N 3.02Å
9	L	60.6	Low	61.2	Low	96 Å²	96	100.1 Å²	100.1	50%	0.503	50%	0.498	S	S	.	.	H	α-helix	trans	-72.8	-34.3	178.6	-170.3	143.7	0	0	0	111.8	F5 S6 Q12 N13	F5-L9 WeakPolarHBondContact O-CB 3.28Å; F5-L9 PolarHBondContact O-N 3.29Å; S6-L9 CarbonylContact O-C 3.52Å; S6-L9 PolarHBondContact O-N 3.41Å; L9-Q12 PolarHBondContact O-N 2.79Å; L9-N13 WeakPolarHBondContact CD2-ND2 3.45Å; L9-N13 WeakPolarHBondContact O-CB 3.23Å; L9-N13 PolarHBondContact O-N 3.04Å; L9-N13 PolarHBondContact O-ND2 3.2Å
10	D	70	Confident	62.1	Low	85 Å²	85	101.4 Å²	101.4	46%	0.455	50%	0.502	S	S	.	.	H	α-helix	trans	-64.3	-44.2	169.9	-62.3	-36.2	0	0	0	110.8	S6 Q12 N13 E14	S6-D10 WeakPolarHBondContact O-CB 3.29Å; S6-D10 PolarHBondContact O-N 3.49Å; S6-D10 VanDerWaalsContact O-OD2 3.06Å; D10-Q12 PolarHBondContact O-N 3.5Å; D10-N13 WeakPolarHBondContact O-CB 3.48Å; D10-N13 PolarHBondContact O-N 2.81Å; D10-N13 VanDerWaalsContact O-N 3.15Å; D10-E14 PolarHBondContact O-N 3.3Å
11	T	70.3	Confident	63	Low	79 Å²	79	101.4 Å²	101.4	49%	0.485	50%	0.504	S	S	.	.	H	α-helix	trans	-58.2	-47.2	173.4	-53.2	0	0	0	0	111.3	N7 A8 N13 E14 E15	N7-T11 WeakPolarHBondContact O-CB 3.17Å; N7-T11 PolarHBondContact O-N 2.77Å; N7-T11 PolarHBondContact O-OG1 3.24Å; A8-T11 WeakPolarHBondContact O-CB 3.29Å; A8-T11 PolarHBondContact O-N 2.9Å; T11-N13 VanDerWaalsContact C-N 3.31Å; T11-N13 PolarHBondContact O-N 3.41Å; T11-E14 PolarHBondContact O-N 3.23Å; T11-E15 PolarHBondContact O-N 3.35Å
12	Q	63.1	Low	65	Low	51 Å²	51	99.1 Å²	99.1	24%	0.238	49%	0.49	C	S	.	.	H	α-helix	trans	-61.8	-36.2	175.6	-73.9	-175.5	-56.9	0	0	112.8	A8 L9 D10 E15 L16	A8-Q12 WeakPolarHBondContact O-CG 3.36Å; A8-Q12 PolarHBondContact O-N 3.02Å; L9-Q12 PolarHBondContact O-N 2.79Å; D10-Q12 PolarHBondContact O-N 3.5Å; Q12-E15 PolarHBondContact O-N 3.23Å; Q12-L16 VanDerWaalsContact O-CB 3.29Å; Q12-L16 WeakPolarHBondContact O-CB 3.4Å; Q12-L16 PolarHBondContact O-N 2.83Å
13	N	72.5	Confident	67	Low	71 Å²	71	93.5 Å²	93.5	38%	0.38	47%	0.47	S	S	.	.	H	α-helix	trans	-65.9	-39.7	176.2	-75	-32.2	0	0	0	111.9	L9 D10 T11 L16 K17	L9-N13 WeakPolarHBondContact CD2-ND2 3.45Å; L9-N13 WeakPolarHBondContact O-CB 3.23Å; L9-N13 PolarHBondContact O-N 3.04Å; L9-N13 PolarHBondContact O-ND2 3.2Å; D10-N13 WeakPolarHBondContact O-CB 3.48Å; D10-N13 PolarHBondContact O-N 2.81Å; D10-N13 VanDerWaalsContact O-N 3.15Å; T11-N13 VanDerWaalsContact C-N 3.31Å; T11-N13 PolarHBondContact O-N 3.41Å; N13-L16 PolarHBondContact O-N 3.11Å; N13-K17 VanDerWaalsContact O-CG 3.26Å; N13-K17 WeakPolarHBondContact O-CG 3.23Å; N13-K17 PolarHBondContact O-N 3.02Å
14	E	79.7	Confident	68.8	Low	108 Å²	108	90.2 Å²	90.2	51%	0.505	46%	0.459	S	S	.	.	H	α-helix	trans	-69.7	-39.3	174.8	-61.6	-46.3	131.9	0	0	112.5	D10 T11 L16 K17 L18	D10-E14 PolarHBondContact O-N 3.3Å; T11-E14 PolarHBondContact O-N 3.23Å; E14-L16 VanDerWaalsContact C-N 3.33Å; E14-L16 PolarHBondContact O-N 3.49Å; E14-K17 PolarHBondContact O-N 3.03Å; E14-K17 IonicContact OE1-NZ 2.66Å; E14-K17 PolarHBondContact OE1-NZ 2.87Å; E14-K17 VanDerWaalsContact OE2-CD 3.29Å; E14-K17 WeakPolarHBondContact OE2-CD 3.39Å; E14-K17 IonicContact OE2-NZ 2.69Å; E14-K17 PolarHBondContact OE2-NZ 2.87Å; E14-L18 WeakPolarHBondContact O-CB 3.24Å; E14-L18 PolarHBondContact O-N 3.37Å
15	E	72.1	Confident	70.5	Confident	123 Å²	123	87.8 Å²	87.8	58%	0.575	45%	0.449	S	S	*	.	H	α-helix	trans	-60.4	-42.4	171.1	-73.4	-175.5	171.1	0	0	111.9	T11 Q12 L18 L19	T11-E15 PolarHBondContact O-N 3.35Å; Q12-E15 PolarHBondContact O-N 3.23Å; E15-L18 PolarHBondContact O-N 3.38Å; E15-L19 WeakPolarHBondContact O-CB 3.46Å; E15-L19 PolarHBondContact O-N 2.87Å
16	L	72.1	Confident	72.2	Confident	98 Å²	98	88.4 Å²	88.4	51%	0.513	46%	0.457	S	S	.	.	H	α-helix	trans	-66.5	-39.8	178.3	-161.6	93.4	0	0	0	111.8	Q12 N13 E14 L19 H20	Q12-L16 VanDerWaalsContact O-CB 3.29Å; Q12-L16 WeakPolarHBondContact O-CB 3.4Å; Q12-L16 PolarHBondContact O-N 2.83Å; N13-L16 PolarHBondContact O-N 3.11Å; E14-L16 VanDerWaalsContact C-N 3.33Å; E14-L16 PolarHBondContact O-N 3.49Å; L16-L19 PolarHBondContact O-N 3.49Å; L16-H20 WeakPolarHBondContact O-CB 3.27Å; L16-H20 PolarHBondContact O-N 2.89Å
17	K	79	Confident	73.5	Confident	109 Å²	109	92 Å²	92	47%	0.474	47%	0.47	S	S	.	.	H	α-helix	trans	-62.7	-46.1	172.2	-73.9	167.4	-175.7	175.9	0	111.5	N13 E14 L19 H20 N21	N13-K17 VanDerWaalsContact O-CG 3.26Å; N13-K17 WeakPolarHBondContact O-CG 3.23Å; N13-K17 PolarHBondContact O-N 3.02Å; E14-K17 PolarHBondContact O-N 3.03Å; E14-K17 IonicContact OE1-NZ 2.66Å; E14-K17 PolarHBondContact OE1-NZ 2.87Å; E14-K17 VanDerWaalsContact OE2-CD 3.29Å; E14-K17 WeakPolarHBondContact OE2-CD 3.39Å; E14-K17 IonicContact OE2-NZ 2.69Å; E14-K17 PolarHBondContact OE2-NZ 2.87Å; K17-L19 VanDerWaalsContact C-N 3.3Å; K17-L19 PolarHBondContact O-N 3.39Å; K17-H20 PolarHBondContact O-N 3.28Å; K17-N21 WeakPolarHBondContact O-CB 3Å; K17-N21 VanDerWaalsContact O-CG 3.24Å; K17-N21 PolarHBondContact O-N 2.9Å; K17-N21 PolarHBondContact O-OD1 2.9Å
18	L	79.6	Confident	74.6	Confident	101 Å²	101	92.9 Å²	92.9	53%	0.529	47%	0.466	S	S	.	.	H	α-helix	trans	-60.7	-41.6	178	-176.4	67.8	0	0	0	111.3	E14 E15 K22	E14-L18 WeakPolarHBondContact O-CB 3.24Å; E14-L18 PolarHBondContact O-N 3.37Å; E15-L18 PolarHBondContact O-N 3.38Å; L18-K22 WeakPolarHBondContact O-CG 3.48Å; L18-K22 PolarHBondContact O-N 2.88Å; L18-K22 VanDerWaalsContact O-N 3.1Å
19	L	74.8	Confident	75.9	Confident	91 Å²	91	94.6 Å²	94.6	48%	0.476	47%	0.474	S	S	.	.	H	α-helix	trans	-67.2	-42.8	175.1	-176	61.3	0	0	0	111.8	E15 L16 K17 K22 V23	E15-L19 WeakPolarHBondContact O-CB 3.46Å; E15-L19 PolarHBondContact O-N 2.87Å; L16-L19 PolarHBondContact O-N 3.49Å; K17-L19 VanDerWaalsContact C-N 3.3Å; K17-L19 PolarHBondContact O-N 3.39Å; L19-K22 PolarHBondContact O-N 3.48Å; L19-V23 WeakPolarHBondContact O-CG2 3.18Å; L19-V23 PolarHBondContact O-N 2.88Å
20	H	79.6	Confident	76.8	Confident	126 Å²	126	94.3 Å²	94.3	58%	0.583	47%	0.473	S	S	*	.	H	α-helix	trans	-59.7	-47.3	175.8	-169.9	-57.3	0	0	0	111.2	L16 K17 K22 V23 T24	L16-H20 WeakPolarHBondContact O-CB 3.27Å; L16-H20 PolarHBondContact O-N 2.89Å; K17-H20 PolarHBondContact O-N 3.28Å; H20-K22 VanDerWaalsContact C-N 3.33Å; H20-K22 PolarHBondContact O-N 3.42Å; H20-V23 PolarHBondContact O-N 3.34Å; H20-V23 VanDerWaalsContact O-N 3.12Å; H20-T24 PolarHBondContact CE1-OG1 3.4Å; H20-T24 PolarHBondContact ND1-OG1 3.37Å; H20-T24 PolarHBondContact O-N 3.45Å; H20-T24 PolarHBondContact O-OG1 3.41Å; H20-T24 VanDerWaalsContact O-OG1 3.1Å
21	N	80.7	Confident	77.4	Confident	103 Å²	103	94.8 Å²	94.8	55%	0.551	48%	0.475	S	S	*	.	H	α-helix	trans	-60.5	-42.4	178.2	-68.2	-6.8	0	0	0	111.4	K17 V23 T24 E25	K17-N21 WeakPolarHBondContact O-CB 3Å; K17-N21 VanDerWaalsContact O-CG 3.24Å; K17-N21 PolarHBondContact O-N 2.9Å; K17-N21 PolarHBondContact O-OD1 2.9Å; N21-V23 VanDerWaalsContact C-N 3.35Å; N21-V23 PolarHBondContact O-N 2.87Å; N21-T24 PolarHBondContact O-N 3.31Å; N21-E25 PolarHBondContact O-N 3.45Å
22	K	80.4	Confident	77.9	Confident	123 Å²	123	95.8 Å²	95.8	54%	0.535	47%	0.474	S	S	.	.	H	α-helix	trans	-62.9	-37.9	174	-74.4	176.4	179.5	-178.4	0	112.7	L18 L19 H20 L26	L18-K22 WeakPolarHBondContact O-CG 3.48Å; L18-K22 PolarHBondContact O-N 2.88Å; L18-K22 VanDerWaalsContact O-N 3.1Å; L19-K22 PolarHBondContact O-N 3.48Å; H20-K22 VanDerWaalsContact C-N 3.33Å; H20-K22 PolarHBondContact O-N 3.42Å; K22-L26 WeakPolarHBondContact O-CB 3.38Å; K22-L26 VanDerWaalsContact O-CG 3.27Å; K22-L26 WeakPolarHBondContact O-CG 3.46Å; K22-L26 PolarHBondContact O-N 2.97Å
23	V	77.3	Confident	78.5	Confident	64 Å²	64	95.6 Å²	95.6	39%	0.388	48%	0.477	S	S	.	.	H	α-helix	trans	-68.6	-43.1	175.2	170.7	0	0	0	0	111.1	L19 H20 N21 E25 L26 E27	L19-V23 WeakPolarHBondContact O-CG2 3.18Å; L19-V23 PolarHBondContact O-N 2.88Å; H20-V23 PolarHBondContact O-N 3.34Å; H20-V23 VanDerWaalsContact O-N 3.12Å; N21-V23 VanDerWaalsContact C-N 3.35Å; N21-V23 PolarHBondContact O-N 2.87Å; V23-E25 PolarHBondContact O-N 2.88Å; V23-L26 PolarHBondContact O-N 3.09Å; V23-E27 HydrophobicContact CG1-CG 4.43Å; V23-E27 WeakPolarHBondContact O-CG 3.39Å; V23-E27 PolarHBondContact O-N 3.28Å
24	T	81	Confident	78.7	Confident	60 Å²	60	95.9 Å²	95.9	37%	0.368	48%	0.478	S	S	.	.	H	α-helix	trans	-62.7	-40.6	177.2	-57.7	0	0	0	0	112	H20 N21 E27 R28	H20-T24 PolarHBondContact CE1-OG1 3.4Å; H20-T24 PolarHBondContact ND1-OG1 3.37Å; H20-T24 PolarHBondContact O-N 3.45Å; H20-T24 PolarHBondContact O-OG1 3.41Å; H20-T24 VanDerWaalsContact O-OG1 3.1Å; N21-T24 PolarHBondContact O-N 3.31Å; T24-E27 PolarHBondContact O-N 3.21Å; T24-R28 PolarHBondContact O-N 3Å
25	E	80.8	Confident	78.7	Confident	93 Å²	93	94.7 Å²	94.7	44%	0.435	48%	0.475	S	S	.	.	H	α-helix	trans	-67.5	-38.7	173.8	-77.8	-59.8	116.1	0	0	112.7	N21 V23 E27 R28 V29	N21-E25 PolarHBondContact O-N 3.45Å; V23-E25 PolarHBondContact O-N 2.88Å; E25-E27 VanDerWaalsContact C-N 3.33Å; E25-E27 PolarHBondContact O-N 3.34Å; E25-R28 PolarHBondContact O-N 3.46Å; E25-R28 IonicContact OE1-NE 3.99Å; E25-R28 PolarHBondContact OE1-NE 3.47Å; E25-R28 IonicContact OE2-CZ 2.93Å; E25-R28 VanDerWaalsContact OE2-CZ 3.24Å; E25-R28 IonicContact OE2-NE 3.81Å; E25-R28 PolarHBondContact OE2-NE 3.4Å; E25-R28 IonicContact OE2-NH2 3.3Å; E25-R28 PolarHBondContact OE2-NH2 2.95Å; E25-V29 WeakPolarHBondContact O-CG2 3.34Å; E25-V29 PolarHBondContact O-N 2.82Å
26	L	78.2	Confident	79.1	Confident	122 Å²	122	92.1 Å²	92.1	64%	0.639	46%	0.462	S	S	*	.	H	α-helix	trans	-64.4	-36.9	172.4	-76.1	168.4	0	0	0	112.2	K22 V23 N30	K22-L26 WeakPolarHBondContact O-CB 3.38Å; K22-L26 VanDerWaalsContact O-CG 3.27Å; K22-L26 WeakPolarHBondContact O-CG 3.46Å; K22-L26 PolarHBondContact O-N 2.97Å; V23-L26 PolarHBondContact O-N 3.09Å; L26-N30 WeakPolarHBondContact O-CB 3.31Å; L26-N30 PolarHBondContact O-N 3.25Å
27	E	77.2	Confident	79.1	Confident	116 Å²	116	89.8 Å²	89.8	54%	0.542	45%	0.452	S	S	.	.	H	α-helix	trans	-67.8	-40.5	173.8	-74.4	179.5	161.9	0	0	111.5	V23 T24 E25 N31	V23-E27 HydrophobicContact CG1-CG 4.43Å; V23-E27 WeakPolarHBondContact O-CG 3.39Å; V23-E27 PolarHBondContact O-N 3.28Å; T24-E27 PolarHBondContact O-N 3.21Å; E25-E27 VanDerWaalsContact C-N 3.33Å; E25-E27 PolarHBondContact O-N 3.34Å; E27-N31 WeakPolarHBondContact O-CB 3.47Å; E27-N31 PolarHBondContact O-N 3.27Å; E27-N31 PolarHBondContact O-ND2 3.47Å; E27-N31 VanDerWaalsContact O-ND2 3.16Å
28	R	85.9	Confident	79.1	Confident	103 Å²	103	92.1 Å²	92.1	39%	0.389	46%	0.464	S	S	.	.	H	α-helix	trans	-59.1	-54.9	172.9	-174.7	-174.4	64.6	71.2	3.4	111.5	T24 E25 N30 N31 E32	T24-R28 PolarHBondContact O-N 3Å; E25-R28 PolarHBondContact O-N 3.46Å; E25-R28 IonicContact OE1-NE 3.99Å; E25-R28 PolarHBondContact OE1-NE 3.47Å; E25-R28 IonicContact OE2-CZ 2.93Å; E25-R28 VanDerWaalsContact OE2-CZ 3.24Å; E25-R28 IonicContact OE2-NE 3.81Å; E25-R28 PolarHBondContact OE2-NE 3.4Å; E25-R28 IonicContact OE2-NH2 3.3Å; E25-R28 PolarHBondContact OE2-NH2 2.95Å; R28-N30 VanDerWaalsContact C-N 3.35Å; R28-N30 PolarHBondContact O-N 3.14Å; R28-N31 PolarHBondContact O-N 3Å; R28-N31 VanDerWaalsContact O-N 3.16Å; R28-E32 WeakPolarHBondContact CG-OE1 3.32Å; R28-E32 IonicContact CZ-OE1 3.1Å; R28-E32 IonicContact CZ-OE2 3.79Å; R28-E32 IonicContact NH1-OE1 3.9Å; R28-E32 PolarHBondContact NH1-OE1 3.02Å; R28-E32 IonicContact NH1-OE2 2.69Å; R28-E32 PolarHBondContact NH1-OE2 2.69Å; R28-E32 PolarHBondContact O-N 3.41Å
29	V	78.6	Confident	79.1	Confident	65 Å²	65	94.3 Å²	94.3	39%	0.394	47%	0.469	S	S	.	.	H	α-helix	trans	-63.1	-40.4	-179.9	172.7	0	0	0	0	111.3	E25 N31 E32 V33	E25-V29 WeakPolarHBondContact O-CG2 3.34Å; E25-V29 PolarHBondContact O-N 2.82Å; V29-N31 VanDerWaalsContact C-N 3.32Å; V29-N31 PolarHBondContact O-N 2.76Å; V29-E32 PolarHBondContact O-N 3.31Å; V29-V33 HydrophobicContact CG1-CG2 4.43Å; V29-V33 VanDerWaalsContact O-CG2 3.3Å; V29-V33 WeakPolarHBondContact O-CG2 3.22Å; V29-V33 PolarHBondContact O-N 2.95Å
30	N	80.4	Confident	79.4	Confident	90 Å²	90	94 Å²	94	48%	0.481	47%	0.468	S	S	.	.	H	α-helix	trans	-63.5	-37.6	175.5	178.3	86.6	0	0	0	112	L26 R28 V33 L34	L26-N30 WeakPolarHBondContact O-CB 3.31Å; L26-N30 PolarHBondContact O-N 3.25Å; R28-N30 VanDerWaalsContact C-N 3.35Å; R28-N30 PolarHBondContact O-N 3.14Å; N30-V33 PolarHBondContact O-N 3.33Å; N30-L34 WeakPolarHBondContact ND2-CD1 3.13Å; N30-L34 WeakPolarHBondContact O-CB 3.39Å; N30-L34 VanDerWaalsContact O-CG 3.29Å; N30-L34 WeakPolarHBondContact O-CG 3.41Å; N30-L34 PolarHBondContact O-N 2.79Å
31	N	81.8	Confident	78.7	Confident	94 Å²	94	91.4 Å²	91.4	50%	0.503	48%	0.475	S	S	.	.	H	α-helix	trans	-67.4	-40.5	174.1	-69.2	-22.4	0	0	0	111.6	E27 R28 V29 L34 D35	E27-N31 WeakPolarHBondContact O-CB 3.47Å; E27-N31 PolarHBondContact O-N 3.27Å; E27-N31 PolarHBondContact O-ND2 3.47Å; E27-N31 VanDerWaalsContact O-ND2 3.16Å; R28-N31 PolarHBondContact O-N 3Å; R28-N31 VanDerWaalsContact O-N 3.16Å; V29-N31 VanDerWaalsContact C-N 3.32Å; V29-N31 PolarHBondContact O-N 2.76Å; N31-L34 PolarHBondContact O-N 3.47Å; N31-D35 WeakPolarHBondContact O-CB 3.23Å; N31-D35 PolarHBondContact O-N 3.25Å
32	E	82	Confident	78	Confident	100 Å²	100	94 Å²	94	47%	0.467	48%	0.478	S	S	.	.	H	α-helix	trans	-62.7	-40.6	174.4	-73.8	164.9	-170.2	0	0	112.3	R28 V29 D35 F36	R28-E32 WeakPolarHBondContact CG-OE1 3.32Å; R28-E32 IonicContact CZ-OE1 3.1Å; R28-E32 IonicContact CZ-OE2 3.79Å; R28-E32 IonicContact NH1-OE1 3.9Å; R28-E32 PolarHBondContact NH1-OE1 3.02Å; R28-E32 IonicContact NH1-OE2 2.69Å; R28-E32 PolarHBondContact NH1-OE2 2.69Å; R28-E32 PolarHBondContact O-N 3.41Å; V29-E32 PolarHBondContact O-N 3.31Å; E32-D35 PolarHBondContact O-N 2.99Å; E32-F36 WeakPolarHBondContact O-CB 2.75Å; E32-F36 PolarHBondContact O-N 3.48Å
33	V	75.3	Confident	77.6	Confident	48 Å²	48	94.1 Å²	94.1	29%	0.291	48%	0.484	S	S	.	.	H	α-helix	trans	-65.4	-41.9	173.4	172.4	0	0	0	0	111.4	V29 N30 F36 V37 L43 P44	V29-V33 HydrophobicContact CG1-CG2 4.43Å; V29-V33 VanDerWaalsContact O-CG2 3.3Å; V29-V33 WeakPolarHBondContact O-CG2 3.22Å; V29-V33 PolarHBondContact O-N 2.95Å; N30-V33 PolarHBondContact O-N 3.33Å; V33-F36 PolarHBondContact O-N 2.96Å; V33-V37 VanDerWaalsContact O-CG2 3.29Å; V33-V37 WeakPolarHBondContact O-CG2 3.4Å; V33-V37 PolarHBondContact O-N 2.88Å; V33-L43 HydrophobicContact CG1-CD2 4.17Å; V33-P44 HydrophobicContact CG1-CG 4.27Å; V33-P44 HydrophobicContact CG2-CG 4.29Å
34	L	76.3	Confident	77.3	Confident	77 Å²	77	93.2 Å²	93.2	40%	0.403	48%	0.479	S	S	.	.	H	α-helix	trans	-63.7	-43.4	174.9	-76.7	170.5	0	0	0	111.6	N30 N31 F36 V37 H38	N30-L34 WeakPolarHBondContact ND2-CD1 3.13Å; N30-L34 WeakPolarHBondContact O-CB 3.39Å; N30-L34 VanDerWaalsContact O-CG 3.29Å; N30-L34 WeakPolarHBondContact O-CG 3.41Å; N30-L34 PolarHBondContact O-N 2.79Å; N31-L34 PolarHBondContact O-N 3.47Å; L34-F36 VanDerWaalsContact C-N 3.33Å; L34-F36 PolarHBondContact O-N 3.45Å; L34-V37 PolarHBondContact O-N 2.84Å; L34-H38 WeakPolarHBondContact O-CB 3.22Å; L34-H38 PolarHBondContact O-CD2 3.02Å; L34-H38 VanDerWaalsContact O-CD2 3.25Å; L34-H38 PolarHBondContact O-N 3.18Å
35	D	79.3	Confident	76.4	Confident	82 Å²	82	97.9 Å²	97.9	44%	0.439	50%	0.496	S	S	.	.	H	α-helix	trans	-61.6	-40.9	175.7	-114.7	38	0	0	0	111.6	N31 E32 H38 K39	N31-D35 WeakPolarHBondContact O-CB 3.23Å; N31-D35 PolarHBondContact O-N 3.25Å; E32-D35 PolarHBondContact O-N 2.99Å; D35-H38 PolarHBondContact O-N 3.3Å; D35-K39 WeakPolarHBondContact O-CB 3.43Å; D35-K39 WeakPolarHBondContact O-CD 3.39Å; D35-K39 VanDerWaalsContact O-CG 3.22Å; D35-K39 WeakPolarHBondContact O-CG 3.45Å; D35-K39 PolarHBondContact O-N 2.97Å; D35-K39 WeakPolarHBondContact OD2-CE 3.39Å; D35-K39 IonicContact OD2-NZ 3.36Å; D35-K39 PolarHBondContact OD2-NZ 3.38Å
36	F	80.3	Confident	75.5	Confident	69 Å²	69	100.5 Å²	100.5	30%	0.303	51%	0.512	S	S	.	.	H	α-helix	trans	-63.1	-46.1	173.7	-173.6	-77.3	0	0	0	111.4	E32 V33 L34 H38 K39 N40 R42 P44	E32-F36 WeakPolarHBondContact O-CB 2.75Å; E32-F36 PolarHBondContact O-N 3.48Å; V33-F36 PolarHBondContact O-N 2.96Å; L34-F36 VanDerWaalsContact C-N 3.33Å; L34-F36 PolarHBondContact O-N 3.45Å; F36-H38 VanDerWaalsContact C-N 3.34Å; F36-H38 PolarHBondContact O-N 3.39Å; F36-K39 PolarHBondContact O-N 3.36Å; F36-N40 HydrophobicContact CD1-CB 4.24Å; F36-N40 WeakPolarHBondContact CD1-ND2 3.45Å; F36-N40 VanDerWaalsContact CD2-ND2 3.32Å; F36-N40 WeakPolarHBondContact CD2-ND2 3.35Å; F36-N40 HydrophobicContact CE1-CB 4.03Å; F36-N40 VanDerWaalsContact CE1-ND2 3.35Å; F36-N40 WeakPolarHBondContact CE1-ND2 3.34Å; F36-N40 WeakPolarHBondContact CE2-ND2 3.19Å; F36-N40 WeakPolarHBondContact CG-ND2 3.33Å; F36-N40 WeakPolarHBondContact CZ-ND2 3.39Å; F36-N40 VanDerWaalsContact O-CB 3.29Å; F36-N40 WeakPolarHBondContact O-CB 3.38Å; F36-N40 PolarHBondContact O-N 2.88Å; F36-N40 PolarHBondContact O-ND2 3.37Å; F36-R42 WeakPolarHBondContact CD1-O 3.46Å; F36-R42 HydrophobicContact CE1-CG 4.37Å; F36-R42 WeakPolarHBondContact CE1-O 3.49Å; F36-P44 HydrophobicContact CB-CG 4.18Å; F36-P44 HydrophobicContact CD1-CB 4.32Å; F36-P44 HydrophobicContact CD1-CG 3.69Å; F36-P44 HydrophobicContact CD2-CG 4.39Å; F36-P44 HydrophobicContact CE1-CB 4.27Å; F36-P44 HydrophobicContact CE1-CG 4.13Å; F36-P44 HydrophobicContact CG-CG 3.84Å; F36-P44 HydrophobicContact CZ-CB 4.45Å
37	V	73.3	Confident	74	Confident	50 Å²	50	101 Å²	101	30%	0.303	51%	0.514	S	S	.	.	H	α-helix	trans	-63.4	-39.6	177.2	169.6	0	0	0	0	111.4	V33 L34 G41 L43	V33-V37 VanDerWaalsContact O-CG2 3.29Å; V33-V37 WeakPolarHBondContact O-CG2 3.4Å; V33-V37 PolarHBondContact O-N 2.88Å; L34-V37 PolarHBondContact O-N 2.84Å; V37-G41 VanDerWaalsContact O-CA 3.3Å; V37-G41 WeakPolarHBondContact O-CA 3.47Å; V37-G41 PolarHBondContact O-N 2.88Å; V37-L43 HydrophobicContact CG2-CD2 3.86Å; V37-L43 HydrophobicContact CG2-CG 4.18Å
38	H	78	Confident	72.3	Confident	157 Å²	157	100.8 Å²	100.8	73%	0.727	52%	0.521	S	S	*	.	H	α-helix	trans	-67.1	-36.2	176	-89.1	-71.1	0	0	0	113.1	L34 D35 F36	L34-H38 WeakPolarHBondContact O-CB 3.22Å; L34-H38 PolarHBondContact O-CD2 3.02Å; L34-H38 VanDerWaalsContact O-CD2 3.25Å; L34-H38 PolarHBondContact O-N 3.18Å; D35-H38 PolarHBondContact O-N 3.3Å; F36-H38 VanDerWaalsContact C-N 3.34Å; F36-H38 PolarHBondContact O-N 3.39Å
39	K	80.8	Confident	70.1	Confident	148 Å²	148	100.9 Å²	100.9	64%	0.643	53%	0.529	S	S	*	.	H	α-helix	trans	-78.7	-40.6	178.6	-71.4	163	-167.9	160.6	0	112.8	D35 F36	D35-K39 WeakPolarHBondContact O-CB 3.43Å; D35-K39 WeakPolarHBondContact O-CD 3.39Å; D35-K39 VanDerWaalsContact O-CG 3.22Å; D35-K39 WeakPolarHBondContact O-CG 3.45Å; D35-K39 PolarHBondContact O-N 2.97Å; D35-K39 WeakPolarHBondContact OD2-CE 3.39Å; D35-K39 IonicContact OD2-NZ 3.36Å; D35-K39 PolarHBondContact OD2-NZ 3.38Å; F36-K39 PolarHBondContact O-N 3.36Å
40	N	79.5	Confident	68.2	Low	83 Å²	83	108.4 Å²	108.4	44%	0.444	55%	0.55	S	S	.	*	H	α-helix	trans	-107.9	-8.5	-167.8	-60.9	-39.7	0	0	0	114.4	F36 R42	F36-N40 HydrophobicContact CD1-CB 4.24Å; F36-N40 WeakPolarHBondContact CD1-ND2 3.45Å; F36-N40 VanDerWaalsContact CD2-ND2 3.32Å; F36-N40 WeakPolarHBondContact CD2-ND2 3.35Å; F36-N40 HydrophobicContact CE1-CB 4.03Å; F36-N40 VanDerWaalsContact CE1-ND2 3.35Å; F36-N40 WeakPolarHBondContact CE1-ND2 3.34Å; F36-N40 WeakPolarHBondContact CE2-ND2 3.19Å; F36-N40 WeakPolarHBondContact CG-ND2 3.33Å; F36-N40 WeakPolarHBondContact CZ-ND2 3.39Å; F36-N40 VanDerWaalsContact O-CB 3.29Å; F36-N40 WeakPolarHBondContact O-CB 3.38Å; F36-N40 PolarHBondContact O-N 2.88Å; F36-N40 PolarHBondContact O-ND2 3.37Å; N40-R42 HydrophobicContact CB-CG 4.12Å; N40-R42 PolarHBondContact O-N 3.33Å
41	G	65.1	Low	66.1	Low	72 Å²	72	112.8 Å²	112.8	74%	0.742	57%	0.568	S	S	*	*	S	Bend	trans	68.2	-0.7	-177	0	0	0	0	0	115.3	V37	V37-G41 VanDerWaalsContact O-CA 3.3Å; V37-G41 WeakPolarHBondContact O-CA 3.47Å; V37-G41 PolarHBondContact O-N 2.88Å
42	R	67	Low	63.9	Low	158 Å²	158	114.9 Å²	114.9	60%	0.596	58%	0.579	S	S	*	*	S	Bend	trans	-132.7	155.3	-178.5	64.5	-179.5	-179.7	155	3.3	110.8	F36 N40	F36-R42 WeakPolarHBondContact CD1-O 3.46Å; F36-R42 HydrophobicContact CE1-CG 4.37Å; F36-R42 WeakPolarHBondContact CE1-O 3.49Å; N40-R42 HydrophobicContact CB-CG 4.12Å; N40-R42 PolarHBondContact O-N 3.33Å
43	L	70.9	Confident	61.7	Low	126 Å²	126	117.2 Å²	117.2	66%	0.66	59%	0.594	S	S	*	*	P	Polyproline II helix	trans	-63.9	154.8	169.9	-79.4	157.8	0	0	0	110.8	V33 V37	V33-L43 HydrophobicContact CG1-CD2 4.17Å; V37-L43 HydrophobicContact CG2-CD2 3.86Å; V37-L43 HydrophobicContact CG2-CG 4.18Å
44	P	70.5	Confident	59.5	Low	45 Å²	45	123.4 Å²	123.4	29%	0.292	62%	0.62	S	S	.	*	P	Polyproline II helix	trans	-55.7	141.4	165	-21.2	32.4	0	0	0	110.6	V33 F36 I46	V33-P44 HydrophobicContact CG1-CG 4.27Å; V33-P44 HydrophobicContact CG2-CG 4.29Å; F36-P44 HydrophobicContact CB-CG 4.18Å; F36-P44 HydrophobicContact CD1-CB 4.32Å; F36-P44 HydrophobicContact CD1-CG 3.69Å; F36-P44 HydrophobicContact CD2-CG 4.39Å; F36-P44 HydrophobicContact CE1-CB 4.27Å; F36-P44 HydrophobicContact CE1-CG 4.13Å; F36-P44 HydrophobicContact CG-CG 3.84Å; F36-P44 HydrophobicContact CZ-CB 4.45Å; P44-I46 PolarHBondContact O-N 3.34Å
45	E	64.1	Low	57.3	Low	157 Å²	157	128.4 Å²	128.4	73%	0.734	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-75.5	117.7	175.6	-167.6	151.2	-149.2	0	0	108.3	I47	E45-I47 PolarHBondContact O-N 2.77Å
46	I	60.1	Low	55.1	Low	148 Å²	148	129.4 Å²	129.4	76%	0.759	67%	0.666	S	S	*	*			trans	-77.3	91.9	-178.3	-54.3	178.3	0	0	0	107.6	P44 T48	P44-I46 PolarHBondContact O-N 3.34Å; I46-T48 VanDerWaalsContact C-N 3.32Å; I46-T48 HydrophobicContact CG2-CG2 4.1Å; I46-T48 PolarHBondContact O-N 3.08Å
47	I	48.1	Very low	52.7	Low	132 Å²	132	131.5 Å²	131.5	68%	0.677	69%	0.689	S	S	*	*			trans	-66.7	94.4	170.8	-54.2	176.5	0	0	0	107.8	E45 D49	E45-I47 PolarHBondContact O-N 2.77Å; I47-D49 VanDerWaalsContact C-N 3.34Å; I47-D49 WeakPolarHBondContact CG2-OD1 3.3Å; I47-D49 PolarHBondContact O-N 3.1Å; I47-D49 VanDerWaalsContact O-N 3.12Å
48	T	40.4	Very low	50.8	Low	112 Å²	112	136 Å²	136	69%	0.687	71%	0.711	S	S	*	*			trans	-78.2	86.5	168.6	50.6	0	0	0	0	108.9	I46 R50	I46-T48 VanDerWaalsContact C-N 3.32Å; I46-T48 HydrophobicContact CG2-CG2 4.1Å; I46-T48 PolarHBondContact O-N 3.08Å; T48-R50 VanDerWaalsContact C-N 3.25Å; T48-R50 PolarHBondContact O-N 3.32Å
49	D	40.5	Very low	48.6	Very low	106 Å²	106	136.6 Å²	136.6	57%	0.567	71%	0.714	S	S	*	*			trans	-63.3	89.9	168.9	-72.7	-29.5	0	0	0	109.2	I47 E51 N52	I47-D49 VanDerWaalsContact C-N 3.34Å; I47-D49 WeakPolarHBondContact CG2-OD1 3.3Å; I47-D49 PolarHBondContact O-N 3.1Å; I47-D49 VanDerWaalsContact O-N 3.12Å; D49-E51 PolarHBondContact O-N 3.31Å; D49-N52 PolarHBondContact O-N 2.66Å
50	R	38.2	Very low	46.3	Very low	222 Å²	222	137.7 Å²	137.7	84%	0.838	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.9	-10.4	-166	-161.4	172.5	-178.7	176.9	-1.7	113.7	T48	T48-R50 VanDerWaalsContact C-N 3.25Å; T48-R50 PolarHBondContact O-N 3.32Å
51	E	37.4	Very low	43.9	Very low	182 Å²	182	141.6 Å²	141.6	85%	0.85	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.8	-7.2	-175.2	-58.8	-179.4	152.3	0	0	113	D49	D49-E51 PolarHBondContact O-N 3.31Å
52	N	35.1	Very low	42.3	Very low	138 Å²	138	146.4 Å²	146.4	74%	0.738	76%	0.755	S	S	*	*	S	Bend	trans	-107.9	18.9	178.7	-71.1	-59.7	0	0	0	113.8	D49	D49-N52 PolarHBondContact O-N 2.66Å
53	L	35	Very low	40.6	Very low	150 Å²	150	144.4 Å²	144.4	79%	0.785	77%	0.765	S	S	*	*			trans	-114.1	1.9	-178.8	-97.3	163.5	0	0	0	114.7	L55	L53-L55 PolarHBondContact O-N 3.41Å
54	E	30.2	Very low	38.7	Very low	178 Å²	178	144.5 Å²	144.5	83%	0.832	77%	0.771	S	S	*	*			trans	-84.5	97.8	161.4	-65.3	-171.3	156.9	0	0	109.2
55	L	30.1	Very low	36.6	Very low	181 Å²	181	153.1 Å²	153.1	95%	0.948	80%	0.799	S	S	*	*			trans	174	59.3	154.7	-97.6	165.6	0	0	0	111.8	L53	L53-L55 PolarHBondContact O-N 3.41Å
56	A	31.8	Very low	35	Very low	103 Å²	103	153.4 Å²	153.4	85%	0.851	79%	0.794	S	S	*	*			trans	-157.4	49.2	170.9	0	0	0	0	0	111.6
57	S	29.7	Very low	33.6	Very low	113 Å²	113	148.9 Å²	148.9	79%	0.79	78%	0.783	S	S	*	*			trans	-140	69.1	-171.8	179.2	0	0	0	0	112.8
58	D	34.8	Very low	32.9	Very low	146 Å²	146	146.5 Å²	146.5	78%	0.781	78%	0.778	S	S	*	*			trans	-109.2	109.8	159.7	-71.7	-56.3	0	0	0	107.4
59	Q	31.2	Very low	32.4	Very low	169 Å²	169	148.2 Å²	148.2	79%	0.79	78%	0.778	S	S	*	*				73.3	107	99.6	-72.4	-167.5	2.4	0	0	114.8
60	D	32.2	Very low	32.2	Very low	170 Å²	170	147.9 Å²	147.9	91%	0.909	79%	0.785	S	S	*	*			trans	-164.4	101.7	142.1	-109.6	-22.1	0	0	0	109.4
61	D	30	Very low	32	Very low	165 Å²	165	141.3 Å²	141.3	88%	0.882	77%	0.766	S	S	*	*			trans	-87.7	128.4	176.6	-86.1	-55.2	0	0	0	111.6
62	I	31.1	Very low	32.1	Very low	173 Å²	173	140.9 Å²	140.9	89%	0.887	76%	0.764	S	S	*	*			trans	-137.9	138	158.8	-60.3	-174.3	0	0	0	111
63	S	32.1	Very low	32	Very low	116 Å²	116	138.2 Å²	138.2	81%	0.811	77%	0.769	S	S	*	*			trans	-96.6	166.9	-163.4	56.6	0	0	0	0	117.1
64	V	29.3	Very low	31.9	Very low	129 Å²	129	134.6 Å²	134.6	78%	0.782	77%	0.767	S	S	*	*			trans	-85.7	156.3	-178.8	176.5	0	0	0	0	113.4
65	Y	28.2	Very low	32.1	Very low	226 Å²	226	135 Å²	135	89%	0.886	77%	0.769	S	S	*	*			trans	-144.7	134.9	164.8	-141.6	-91.8	0	0	0	114.1
66	R	29.9	Very low	32.2	Very low	163 Å²	163	133.7 Å²	133.7	62%	0.615	76%	0.758	S	S	*	*			trans	-99.9	150.5	-172.5	152.8	-64.7	-94	-174.9	-5.7	117.6	N298	R66-N298 HydrophobicContact CG-CB 4.17Å; R66-N298 VanDerWaalsContact CZ-CG 3.43Å; R66-N298 PolarHBondContact NE-OD1 3.41Å; R66-N298 VanDerWaalsContact NH2-CG 3.27Å; R66-N298 PolarHBondContact NH2-OD1 3.02Å
67	G	30.4	Very low	32.3	Very low	52 Å²	52	139.3 Å²	139.3	54%	0.536	76%	0.757	S	S	.	*			trans	-177.5	133.4	152.4	0	0	0	0	0	109.4
68	S	32.7	Very low	32.3	Very low	82 Å²	82	141.6 Å²	141.6	57%	0.573	76%	0.755	S	S	*	*				72	138.1	69.3	-62.8	0	0	0	0	114.3
69	E	30.6	Very low	31.8	Very low	148 Å²	148	141.3 Å²	141.3	69%	0.692	75%	0.753	S	S	*	*			cis	-173.1	165.2	-6	-107.3	150.3	-115.9	0	0	107.6	T299	E69-T299 HydrophobicContact CG-CG2 3.8Å
70	S	35.1	Very low	31.6	Very low	100 Å²	100	142 Å²	142	70%	0.699	76%	0.757	S	S	*	*			cis	-151	-129.1	-8.1	62.8	0	0	0	0	112.2
71	N	35.3	Very low	31.2	Very low	84 Å²	84	139.4 Å²	139.4	45%	0.449	75%	0.747	S	S	.	*			trans	-130.4	176.7	-146.2	-73.8	-18.3	0	0	0	120.8	E301	N71-E301 WeakPolarHBondContact ND2-CB 3.2Å; N71-E301 PolarHBondContact ND2-OE2 3.47Å
72	H	39.2	Very low	31.1	Very low	173 Å²	173	137.1 Å²	137.1	80%	0.801	74%	0.739	S	S	*	*			trans	90.8	144.1	162.8	-41.5	-51	0	0	0	119.1	E301	H72-E301 IonicContact CE1-OE2 2.69Å
73	G	32.6	Very low	30.8	Very low	82 Å²	82	135.1 Å²	135.1	85%	0.845	73%	0.734	S	S	*	*			cis	170.5	158.3	-8.2	0	0	0	0	0	114.4
74	G	32.4	Very low	30.6	Very low	73 Å²	73	139.9 Å²	139.9	75%	0.753	74%	0.735	S	S	*	*			trans	120.7	111.2	174.4	0	0	0	0	0	114.6
75	E	34.9	Very low	30.5	Very low	187 Å²	187	145.1 Å²	145.1	87%	0.874	74%	0.74	S	S	*	*				78.7	138.6	65.5	-73.1	-145.7	160.7	0	0	115.6
76	H	32.4	Very low	30.6	Very low	153 Å²	153	138.9 Å²	138.9	71%	0.708	73%	0.73	S	S	*	*			cis	-168.1	173	-21.5	-141.9	-66.1	0	0	0	110
77	R	33.5	Very low	30.9	Very low	221 Å²	221	134.6 Å²	134.6	83%	0.834	72%	0.723	S	S	*	*			trans	94.6	124.3	168.8	-57.8	179.6	-175.6	-159.9	-1.2	115.4
78	Q	29.7	Very low	31.4	Very low	162 Å²	162	137.4 Å²	137.4	76%	0.757	73%	0.726	S	S	*	*				77.6	141.7	52	-73.5	-176	-9.4	0	0	114.3
79	L	25.7	Very low	32.1	Very low	140 Å²	140	136.6 Å²	136.6	73%	0.733	72%	0.72	S	S	*	*			cis	-173.1	128.1	-24.3	-158.6	169.1	0	0	0	106.2
80	E	27.2	Very low	33.2	Very low	184 Å²	184	133.5 Å²	133.5	86%	0.86	72%	0.715	S	S	*	*			trans	-148.3	143.3	169.3	-151.2	167.1	-129.1	0	0	113.1
81	T	23.6	Very low	34.1	Very low	115 Å²	115	133.1 Å²	133.1	71%	0.706	71%	0.708	S	S	*	*			trans	-116.6	115.3	-168.6	-55.2	0	0	0	0	110.9
82	V	26.5	Very low	34.9	Very low	117 Å²	117	133 Å²	133	71%	0.709	71%	0.707	S	S	*	*			trans	-120.7	100.4	179.6	-177.5	0	0	0	0	111.8	R84	V82-R84 PolarHBondContact O-N 3.47Å
83	T	25.7	Very low	36.1	Very low	130 Å²	130	127.4 Å²	127.4	80%	0.798	69%	0.685	S	S	*	*			trans	-78.7	94.2	172.9	-50.6	0	0	0	0	110.8
84	R	27	Very low	37.8	Very low	216 Å²	216	125.6 Å²	125.6	82%	0.815	67%	0.666	S	S	*	*			trans	-161.7	134.2	167.3	-101.8	141.3	-165.6	-149.2	4.5	112.6	V82	V82-R84 PolarHBondContact O-N 3.47Å
85	R	27.7	Very low	39.5	Very low	240 Å²	240	125.4 Å²	125.4	91%	0.906	65%	0.65	S	S	*	*	S	Bend	trans	25.8	126.2	159.2	-66.7	-179.9	175.3	163	-2.5	118.9	P87	R85-P87 VanDerWaalsContact O-CD 3.3Å; R85-P87 WeakPolarHBondContact O-CD 3.46Å
86	S	30.3	Very low	41.1	Very low	95 Å²	95	116.7 Å²	116.7	66%	0.664	61%	0.61	S	S	*	*			trans	-21.7	98.4	174.9	-169.8	0	0	0	0	115.3	N88	S86-N88 VanDerWaalsContact C-N 3.26Å; S86-N88 PolarHBondContact O-N 3.4Å
87	P	36.5	Very low	43	Very low	72 Å²	72	112 Å²	112	47%	0.468	59%	0.594	S	S	.	*			trans	-74.2	-18.5	179.1	-17.9	32.9	0	0	0	113.1	R85 S89 S90 V91	R85-P87 VanDerWaalsContact O-CD 3.3Å; R85-P87 WeakPolarHBondContact O-CD 3.46Å; P87-S89 VanDerWaalsContact C-N 3.32Å; P87-S89 PolarHBondContact O-N 3.46Å; P87-S90 PolarHBondContact O-N 3.13Å; P87-S90 PolarHBondContact O-OG 3.21Å; P87-V91 WeakPolarHBondContact O-CG2 3.43Å; P87-V91 PolarHBondContact O-N 3.36Å; P87-V91 VanDerWaalsContact O-N 3.15Å
88	N	41.8	Very low	45	Very low	111 Å²	111	107.5 Å²	107.5	59%	0.594	58%	0.581	S	S	*	*	H	α-helix	trans	-65.5	-35.1	-164.5	-61	6.5	0	0	0	112.4	S86 L92	S86-N88 VanDerWaalsContact C-N 3.26Å; S86-N88 PolarHBondContact O-N 3.4Å; N88-L92 VanDerWaalsContact O-CB 3.31Å; N88-L92 WeakPolarHBondContact O-CB 3.4Å; N88-L92 WeakPolarHBondContact O-CG 3.2Å; N88-L92 PolarHBondContact O-N 2.86Å
89	S	45.6	Very low	47	Very low	65 Å²	65	104 Å²	104	46%	0.455	57%	0.567	S	S	.	*	H	α-helix	trans	-64.8	-50.1	177.8	167.2	0	0	0	0	112.1	P87 V91 L92 T93	P87-S89 VanDerWaalsContact C-N 3.32Å; P87-S89 PolarHBondContact O-N 3.46Å; S89-V91 VanDerWaalsContact C-N 3.34Å; S89-V91 PolarHBondContact O-N 2.97Å; S89-L92 PolarHBondContact O-N 3.09Å; S89-T93 PolarHBondContact O-N 2.76Å; S89-T93 PolarHBondContact O-OG1 3.2Å; S89-T93 VanDerWaalsContact O-OG1 3.09Å
90	S	55	Low	49.1	Very low	84 Å²	84	98 Å²	98	59%	0.587	54%	0.537	S	S	*	.	H	α-helix	trans	-70.1	-31.4	-178.3	54.6	0	0	0	0	112.8	P87 G94	P87-S90 PolarHBondContact O-N 3.13Å; P87-S90 PolarHBondContact O-OG 3.21Å; S90-G94 PolarHBondContact O-N 2.74Å
91	V	53.4	Low	51.5	Low	92 Å²	92	94.7 Å²	94.7	56%	0.558	52%	0.521	S	S	*	.	H	α-helix	trans	-67.8	-45.3	171.9	175.3	0	0	0	0	111	P87 S89 G94 V95	P87-V91 WeakPolarHBondContact O-CG2 3.43Å; P87-V91 PolarHBondContact O-N 3.36Å; P87-V91 VanDerWaalsContact O-N 3.15Å; S89-V91 VanDerWaalsContact C-N 3.34Å; S89-V91 PolarHBondContact O-N 2.97Å; V91-G94 PolarHBondContact O-N 2.96Å; V91-V95 WeakPolarHBondContact O-CG2 3.47Å; V91-V95 PolarHBondContact O-N 3.31Å
92	L	52	Low	53.9	Low	81 Å²	81	94 Å²	94	42%	0.424	51%	0.51	S	S	.	.	H	α-helix	trans	-62.1	-48.7	175.9	-85.4	161.7	0	0	0	111.9	N88 S89 G94 V95 I96 V132	N88-L92 VanDerWaalsContact O-CB 3.31Å; N88-L92 WeakPolarHBondContact O-CB 3.4Å; N88-L92 WeakPolarHBondContact O-CG 3.2Å; N88-L92 PolarHBondContact O-N 2.86Å; S89-L92 PolarHBondContact O-N 3.09Å; L92-G94 VanDerWaalsContact C-N 3.29Å; L92-G94 PolarHBondContact O-N 3.26Å; L92-V95 PolarHBondContact O-N 3.5Å; L92-I96 WeakPolarHBondContact O-CD1 3.45Å; L92-I96 VanDerWaalsContact O-CG1 3.24Å; L92-I96 WeakPolarHBondContact O-CG1 3.46Å; L92-I96 PolarHBondContact O-N 2.86Å; L92-V132 HydrophobicContact CB-CG2 4.3Å; L92-V132 HydrophobicContact CD1-CG2 4.38Å
93	T	64	Low	56	Low	56 Å²	56	90.7 Å²	90.7	34%	0.344	49%	0.488	S	S	.	.	H	α-helix	trans	-58.8	-41.2	175.7	-57.1	0	0	0	0	111.4	S89 V95 I96 S97	S89-T93 PolarHBondContact O-N 2.76Å; S89-T93 PolarHBondContact O-OG1 3.2Å; S89-T93 VanDerWaalsContact O-OG1 3.09Å; T93-V95 PolarHBondContact O-N 3.17Å; T93-I96 PolarHBondContact O-N 3.41Å; T93-S97 PolarHBondContact O-N 3.42Å; T93-S97 PolarHBondContact O-OG 3.42Å; T93-S97 VanDerWaalsContact O-OG 3.1Å
94	G	68.7	Low	58.2	Low	43 Å²	43	86.1 Å²	86.1	44%	0.443	46%	0.461	S	S	.	.	H	α-helix	trans	-64.5	-36.4	176.5	0	0	0	0	0	114.2	S90 V91 L92 K98	S90-G94 PolarHBondContact O-N 2.74Å; V91-G94 PolarHBondContact O-N 2.96Å; L92-G94 VanDerWaalsContact C-N 3.29Å; L92-G94 PolarHBondContact O-N 3.26Å; G94-K98 WeakPolarHBondContact O-CB 3.38Å; G94-K98 PolarHBondContact O-N 2.93Å
95	V	68.3	Low	60.5	Low	70 Å²	70	81.8 Å²	81.8	42%	0.424	45%	0.445	S	S	.	.	H	α-helix	trans	-67.6	-48	171.5	171.1	0	0	0	0	110.4	V91 L92 T93 S97 K98 D99	V91-V95 WeakPolarHBondContact O-CG2 3.47Å; V91-V95 PolarHBondContact O-N 3.31Å; L92-V95 PolarHBondContact O-N 3.5Å; T93-V95 PolarHBondContact O-N 3.17Å; V95-S97 PolarHBondContact O-N 3.38Å; V95-K98 WeakPolarHBondContact O-CB 3.49Å; V95-K98 PolarHBondContact O-N 3.47Å; V95-K98 VanDerWaalsContact O-N 3.09Å; V95-D99 PolarHBondContact O-N 3.38Å
96	I	68.1	Low	62.6	Low	4 Å²	4	76.4 Å²	76.4	2%	0.021	43%	0.43	C	S	.	.	H	α-helix	trans	-57.7	-46.6	179.3	-67	161.3	0	0	0	110.8	L92 T93 K98 D99 T100 M128 V132	L92-I96 WeakPolarHBondContact O-CD1 3.45Å; L92-I96 VanDerWaalsContact O-CG1 3.24Å; L92-I96 WeakPolarHBondContact O-CG1 3.46Å; L92-I96 PolarHBondContact O-N 2.86Å; T93-I96 PolarHBondContact O-N 3.41Å; I96-K98 VanDerWaalsContact C-N 3.32Å; I96-K98 PolarHBondContact O-N 2.89Å; I96-D99 PolarHBondContact O-N 2.95Å; I96-T100 HydrophobicContact CG2-CG2 4.4Å; I96-T100 WeakPolarHBondContact O-CG2 3.42Å; I96-T100 PolarHBondContact O-N 3.42Å; I96-T100 PolarHBondContact O-OG1 2.86Å; I96-M128 HydrophobicContact CD1-CB 3.9Å; I96-M128 HydrophobicContact CD1-CE 4.31Å; I96-M128 HydrophobicContact CG1-CB 4.03Å; I96-M128 HydrophobicContact CG1-CE 3.85Å; I96-M128 HydrophobicContact CG2-CB 3.78Å; I96-M128 HydrophobicContact CG2-CG 4.28Å; I96-V132 HydrophobicContact CD1-CG2 3.7Å
97	S	73.1	Confident	64	Low	55 Å²	55	72.7 Å²	72.7	39%	0.385	40%	0.402	S	S	.	.	H	α-helix	trans	-62.3	-35.5	176.8	-60.6	0	0	0	0	113.3	T93 V95 T100 E101	T93-S97 PolarHBondContact O-N 3.42Å; T93-S97 PolarHBondContact O-OG 3.42Å; T93-S97 VanDerWaalsContact O-OG 3.1Å; V95-S97 PolarHBondContact O-N 3.38Å; S97-T100 WeakPolarHBondContact CA-OG1 3.48Å; S97-T100 PolarHBondContact O-OG1 2.91Å; S97-E101 WeakPolarHBondContact O-CB 3.49Å; S97-E101 PolarHBondContact O-N 3.19Å
98	K	76	Confident	65.6	Low	126 Å²	126	74.3 Å²	74.3	55%	0.548	41%	0.405	S	S	.	.	H	α-helix	trans	-70.6	-41.6	176.8	-173.1	-168.5	170.5	-159.5	0	111.5	G94 V95 I96 E101 E102	G94-K98 WeakPolarHBondContact O-CB 3.38Å; G94-K98 PolarHBondContact O-N 2.93Å; V95-K98 WeakPolarHBondContact O-CB 3.49Å; V95-K98 PolarHBondContact O-N 3.47Å; V95-K98 VanDerWaalsContact O-N 3.09Å; I96-K98 VanDerWaalsContact C-N 3.32Å; I96-K98 PolarHBondContact O-N 2.89Å; K98-E101 WeakPolarHBondContact O-CB 3.39Å; K98-E101 PolarHBondContact O-N 2.99Å; K98-E102 PolarHBondContact O-N 2.99Å
99	D	70.3	Confident	67	Low	88 Å²	88	73.6 Å²	73.6	47%	0.471	41%	0.408	S	S	.	.	H	α-helix	trans	-72.2	-35.2	-179.4	-68.2	-3.5	0	0	0	111.2	V95 I96 E102 L103	V95-D99 PolarHBondContact O-N 3.38Å; I96-D99 PolarHBondContact O-N 2.95Å; D99-E102 PolarHBondContact O-N 3.21Å; D99-L103 WeakPolarHBondContact O-CB 3.12Å; D99-L103 PolarHBondContact O-N 3.48Å
100	T	70.8	Confident	67.5	Low	15 Å²	15	76.5 Å²	76.5	9%	0.092	42%	0.418	C	S	.	.	H	α-helix	trans	-71.6	-33.3	172.5	53.9	0	0	0	0	112.7	I96 S97 S104 V124 Q125	I96-T100 HydrophobicContact CG2-CG2 4.4Å; I96-T100 WeakPolarHBondContact O-CG2 3.42Å; I96-T100 PolarHBondContact O-N 3.42Å; I96-T100 PolarHBondContact O-OG1 2.86Å; S97-T100 WeakPolarHBondContact CA-OG1 3.48Å; S97-T100 PolarHBondContact O-OG1 2.91Å; T100-S104 VanDerWaalsContact O-CB 3.3Å; T100-S104 WeakPolarHBondContact O-CB 3.31Å; T100-S104 PolarHBondContact O-N 3.44Å; T100-V124 HydrophobicContact CG2-CG1 4.14Å; T100-Q125 HydrophobicContact CG2-CB 4.39Å; T100-Q125 PolarHBondContact OG1-OE1 3.47Å
101	E	76.4	Confident	68	Low	113 Å²	113	75.9 Å²	75.9	53%	0.528	43%	0.425	S	S	.	.	H	α-helix	trans	-59.9	-44.5	165.8	-99.8	-165.8	-150	0	0	112.4	S97 K98 S104 R105	S97-E101 WeakPolarHBondContact O-CB 3.49Å; S97-E101 PolarHBondContact O-N 3.19Å; K98-E101 WeakPolarHBondContact O-CB 3.39Å; K98-E101 PolarHBondContact O-N 2.99Å; E101-S104 WeakPolarHBondContact O-CB 3.39Å; E101-S104 PolarHBondContact O-N 3.05Å; E101-R105 WeakPolarHBondContact O-CG 3.49Å; E101-R105 PolarHBondContact O-N 2.99Å; E101-R105 IonicContact OE2-CZ 3.52Å; E101-R105 IonicContact OE2-NH1 3.64Å; E101-R105 PolarHBondContact OE2-NH1 2.95Å; E101-R105 IonicContact OE2-NH2 2.63Å
102	E	74.9	Confident	68.2	Low	101 Å²	101	75 Å²	75	47%	0.472	42%	0.417	S	S	.	.	H	α-helix	trans	-70.2	-41.6	-178.4	-160.8	154.8	148.1	0	0	111.7	K98 D99 S104 R105 E106	K98-E102 PolarHBondContact O-N 2.99Å; D99-E102 PolarHBondContact O-N 3.21Å; E102-S104 VanDerWaalsContact C-N 3.31Å; E102-S104 PolarHBondContact O-N 3.25Å; E102-R105 WeakPolarHBondContact O-CB 3.39Å; E102-R105 PolarHBondContact O-N 3.3Å; E102-R105 IonicContact OE2-NH2 3.68Å; E102-E106 PolarHBondContact O-N 3.42Å
103	L	70	Confident	69.3	Low	48 Å²	48	76.5 Å²	76.5	25%	0.251	42%	0.422	S	S	.	.	H	α-helix	trans	-56.9	-42.9	168.5	177.6	63.4	0	0	0	111.9	D99 E106 L107 V121 V124	D99-L103 WeakPolarHBondContact O-CB 3.12Å; D99-L103 PolarHBondContact O-N 3.48Å; L103-E106 PolarHBondContact O-N 2.74Å; L103-L107 HydrophobicContact CD1-CD1 3.92Å; L103-L107 HydrophobicContact CD1-CG 4.02Å; L103-L107 HydrophobicContact CD2-CD1 4.47Å; L103-L107 HydrophobicContact CG-CD1 3.79Å; L103-L107 HydrophobicContact CG-CG 4.32Å; L103-L107 WeakPolarHBondContact O-CB 3.42Å; L103-L107 VanDerWaalsContact O-CG 3.23Å; L103-L107 WeakPolarHBondContact O-CG 3.31Å; L103-L107 PolarHBondContact O-N 2.78Å; L103-V121 HydrophobicContact CD2-CG2 4.47Å; L103-V121 HydrophobicContact CG-CG2 4.46Å; L103-V124 HydrophobicContact CD2-CB 4.05Å; L103-V124 HydrophobicContact CD2-CG1 4.05Å; L103-V124 HydrophobicContact CD2-CG2 3.87Å
104	S	71.9	Confident	69.8	Low	33 Å²	33	77.4 Å²	77.4	23%	0.231	43%	0.43	C	S	.	.	H	α-helix	trans	-61.5	-43.5	176.4	-173	0	0	0	0	111.7	T100 E101 E102 L107 M108	T100-S104 VanDerWaalsContact O-CB 3.3Å; T100-S104 WeakPolarHBondContact O-CB 3.31Å; T100-S104 PolarHBondContact O-N 3.44Å; E101-S104 WeakPolarHBondContact O-CB 3.39Å; E101-S104 PolarHBondContact O-N 3.05Å; E102-S104 VanDerWaalsContact C-N 3.31Å; E102-S104 PolarHBondContact O-N 3.25Å; S104-L107 PolarHBondContact O-N 3.31Å; S104-M108 WeakPolarHBondContact O-CB 3.46Å; S104-M108 WeakPolarHBondContact O-CG 3.31Å; S104-M108 PolarHBondContact O-N 2.98Å
105	R	76.1	Confident	70.1	Confident	126 Å²	126	79 Å²	79	48%	0.475	44%	0.435	S	S	.	.	H	α-helix	trans	-60.8	-44.2	174.1	-71.3	-178.9	-75.1	-98.1	2	112.1	E101 E102 S109	E101-R105 WeakPolarHBondContact O-CG 3.49Å; E101-R105 PolarHBondContact O-N 2.99Å; E101-R105 IonicContact OE2-CZ 3.52Å; E101-R105 IonicContact OE2-NH1 3.64Å; E101-R105 PolarHBondContact OE2-NH1 2.95Å; E101-R105 IonicContact OE2-NH2 2.63Å; E102-R105 WeakPolarHBondContact O-CB 3.39Å; E102-R105 PolarHBondContact O-N 3.3Å; E102-R105 IonicContact OE2-NH2 3.68Å; R105-S109 PolarHBondContact O-N 2.94Å; R105-S109 VanDerWaalsContact O-N 3.13Å
106	E	70.5	Confident	70.1	Confident	127 Å²	127	80.4 Å²	80.4	59%	0.593	44%	0.435	S	S	*	.	H	α-helix	trans	-66.3	-45.1	176.5	-71.5	-151.1	140.6	0	0	112.7	E102 L103 M108 S109 L110	E102-E106 PolarHBondContact O-N 3.42Å; L103-E106 PolarHBondContact O-N 2.74Å; E106-M108 VanDerWaalsContact C-N 3.34Å; E106-M108 PolarHBondContact O-N 2.63Å; E106-S109 WeakPolarHBondContact O-CA 3.46Å; E106-S109 WeakPolarHBondContact O-CB 3.26Å; E106-S109 PolarHBondContact O-N 2.72Å; E106-S109 PolarHBondContact O-OG 3.2Å; E106-L110 WeakPolarHBondContact O-CG 3.4Å; E106-L110 PolarHBondContact O-N 3Å; E106-L110 VanDerWaalsContact O-N 3.1Å
107	L	60.9	Low	70	Confident	16 Å²	16	80.2 Å²	80.2	8%	0.084	43%	0.434	C	S	.	.	H	α-helix	trans	-62.6	-39	179.5	-70.3	169.2	0	0	0	112.3	L103 S104 S109 L110 L112 C117 I120 V121	L103-L107 HydrophobicContact CD1-CD1 3.92Å; L103-L107 HydrophobicContact CD1-CG 4.02Å; L103-L107 HydrophobicContact CD2-CD1 4.47Å; L103-L107 HydrophobicContact CG-CD1 3.79Å; L103-L107 HydrophobicContact CG-CG 4.32Å; L103-L107 WeakPolarHBondContact O-CB 3.42Å; L103-L107 VanDerWaalsContact O-CG 3.23Å; L103-L107 WeakPolarHBondContact O-CG 3.31Å; L103-L107 PolarHBondContact O-N 2.78Å; S104-L107 PolarHBondContact O-N 3.31Å; L107-S109 VanDerWaalsContact C-N 3.34Å; L107-L110 PolarHBondContact O-N 3.42Å; L107-L112 HydrophobicContact CB-CD1 4.44Å; L107-L112 HydrophobicContact CD2-CD1 3.68Å; L107-C117 HydrophobicContact CB-CB 4.19Å; L107-I120 HydrophobicContact CD1-CB 3.99Å; L107-I120 HydrophobicContact CD1-CG2 3.7Å; L107-I120 HydrophobicContact CD2-CD1 4.25Å; L107-V121 HydrophobicContact CD1-CG2 4.01Å
108	M	69	Low	70.2	Confident	107 Å²	107	81.3 Å²	81.3	53%	0.527	44%	0.436	S	S	.	.	H	α-helix	trans	-60.4	-42.1	170.3	-68.5	-86	-173.3	0	0	111.4	S104 E106 L110 G111	S104-M108 WeakPolarHBondContact O-CB 3.46Å; S104-M108 WeakPolarHBondContact O-CG 3.31Å; S104-M108 PolarHBondContact O-N 2.98Å; E106-M108 VanDerWaalsContact C-N 3.34Å; E106-M108 PolarHBondContact O-N 2.63Å; M108-L110 PolarHBondContact O-N 3.3Å; M108-G111 PolarHBondContact O-N 3.31Å
109	S	72.3	Confident	70.1	Confident	95 Å²	95	81.6 Å²	81.6	66%	0.664	44%	0.439	S	S	*	.	H	α-helix	trans	-66.1	-24.1	179.3	84.4	0	0	0	0	113.9	R105 E106 L107 G111	R105-S109 PolarHBondContact O-N 2.94Å; R105-S109 VanDerWaalsContact O-N 3.13Å; E106-S109 WeakPolarHBondContact O-CA 3.46Å; E106-S109 WeakPolarHBondContact O-CB 3.26Å; E106-S109 PolarHBondContact O-N 2.72Å; E106-S109 PolarHBondContact O-OG 3.2Å; L107-S109 VanDerWaalsContact C-N 3.34Å; S109-G111 VanDerWaalsContact C-N 3.25Å; S109-G111 PolarHBondContact O-N 2.95Å
110	L	56.5	Low	69.9	Low	127 Å²	127	81 Å²	81	67%	0.665	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-0.3	177.6	-69.7	168.9	0	0	0	113.6	E106 L107 M108 L112	E106-L110 WeakPolarHBondContact O-CG 3.4Å; E106-L110 PolarHBondContact O-N 3Å; E106-L110 VanDerWaalsContact O-N 3.1Å; L107-L110 PolarHBondContact O-N 3.42Å; M108-L110 PolarHBondContact O-N 3.3Å; L110-L112 VanDerWaalsContact C-N 3.33Å; L110-L112 HydrophobicContact CB-CD1 4.45Å; L110-L112 HydrophobicContact CB-CG 4.45Å; L110-L112 PolarHBondContact O-N 2.92Å
111	G	65.7	Low	70.1	Confident	71 Å²	71	81.2 Å²	81.2	73%	0.732	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.8	24.8	176.4	0	0	0	0	0	114.2	M108 S109	M108-G111 PolarHBondContact O-N 3.31Å; S109-G111 VanDerWaalsContact C-N 3.25Å; S109-G111 PolarHBondContact O-N 2.95Å
112	L	57.7	Low	70.1	Confident	74 Å²	74	80.7 Å²	80.7	39%	0.387	44%	0.437	S	S	.	.			trans	-75.5	151.7	174.5	-70.2	167.7	0	0	0	111.2	L107 L110 C117	L107-L112 HydrophobicContact CB-CD1 4.44Å; L107-L112 HydrophobicContact CD2-CD1 3.68Å; L110-L112 VanDerWaalsContact C-N 3.33Å; L110-L112 HydrophobicContact CB-CD1 4.45Å; L110-L112 HydrophobicContact CB-CG 4.45Å; L110-L112 PolarHBondContact O-N 2.92Å; L112-C117 VanDerWaalsContact CB-SG 3.53Å
113	E	74.8	Confident	70	Confident	111 Å²	111	80.7 Å²	80.7	52%	0.519	44%	0.437	S	S	.	.			trans	-61.9	136.5	170.6	-67.8	156	-142.1	0	0	110.1	S115 K116 C117	E113-S115 PolarHBondContact O-N 2.88Å; E113-S115 VanDerWaalsContact O-N 3.15Å; E113-K116 HydrophobicContact CB-CD 4.2Å; E113-K116 HydrophobicContact CB-CG 4.43Å; E113-K116 WeakPolarHBondContact O-CA 3.47Å; E113-K116 WeakPolarHBondContact O-CB 3.36Å; E113-K116 PolarHBondContact O-N 2.89Å; E113-K116 IonicContact OE1-NZ 3.94Å; E113-K116 PolarHBondContact OE1-NZ 2.72Å; E113-K116 WeakPolarHBondContact OE2-CE 3.41Å; E113-K116 IonicContact OE2-NZ 3.64Å; E113-K116 PolarHBondContact OE2-NZ 2.73Å; E113-C117 PolarHBondContact O-N 3.01Å; E113-C117 PolarHBondContact O-SG 3.15Å
114	S	73.7	Confident	70	Confident	75 Å²	75	80.8 Å²	80.8	52%	0.524	44%	0.439	S	S	.	.	H	α-helix	trans	-57.2	-33.7	-177	54.3	0	0	0	0	113.6	K116 C117 N118	S114-K116 VanDerWaalsContact C-N 3.29Å; S114-K116 PolarHBondContact O-N 3.44Å; S114-C117 PolarHBondContact O-N 2.72Å; S114-N118 WeakPolarHBondContact O-CB 3.22Å; S114-N118 PolarHBondContact O-N 3.02Å; S114-N118 PolarHBondContact O-OD1 3.38Å; S114-N118 VanDerWaalsContact O-OD1 3.08Å
115	S	74.1	Confident	70.1	Confident	76 Å²	76	81.3 Å²	81.3	53%	0.531	44%	0.438	S	S	.	.	H	α-helix	trans	-61	-35.1	172.8	54.1	0	0	0	0	113.3	E113 H119	E113-S115 PolarHBondContact O-N 2.88Å; E113-S115 VanDerWaalsContact O-N 3.15Å; S115-H119 WeakPolarHBondContact O-CB 3.26Å; S115-H119 PolarHBondContact O-N 2.98Å
116	K	68.6	Low	70.1	Confident	101 Å²	101	80.9 Å²	80.9	44%	0.439	44%	0.441	S	S	.	.	H	α-helix	trans	-79.1	-36.8	175.7	-68.4	169.2	178.6	148.2	0	111.2	E113 S114 I120	E113-K116 HydrophobicContact CB-CD 4.2Å; E113-K116 HydrophobicContact CB-CG 4.43Å; E113-K116 WeakPolarHBondContact O-CA 3.47Å; E113-K116 WeakPolarHBondContact O-CB 3.36Å; E113-K116 PolarHBondContact O-N 2.89Å; E113-K116 IonicContact OE1-NZ 3.94Å; E113-K116 PolarHBondContact OE1-NZ 2.72Å; E113-K116 WeakPolarHBondContact OE2-CE 3.41Å; E113-K116 IonicContact OE2-NZ 3.64Å; E113-K116 PolarHBondContact OE2-NZ 2.73Å; S114-K116 VanDerWaalsContact C-N 3.29Å; S114-K116 PolarHBondContact O-N 3.44Å; K116-I120 WeakPolarHBondContact O-CD1 2.92Å; K116-I120 VanDerWaalsContact O-CG1 3.23Å; K116-I120 WeakPolarHBondContact O-CG1 3.31Å; K116-I120 PolarHBondContact O-N 3.46Å
117	C	67.3	Low	70.2	Confident	0 Å²	0	79 Å²	79	0%	0	44%	0.435	C	S	.	.	H	α-helix	trans	-59.3	-54.2	172.2	-60.2	0	0	0	0	110.9	L107 L112 E113 S114 H119 I120 V121	L107-C117 HydrophobicContact CB-CB 4.19Å; L112-C117 VanDerWaalsContact CB-SG 3.53Å; E113-C117 PolarHBondContact O-N 3.01Å; E113-C117 PolarHBondContact O-SG 3.15Å; S114-C117 PolarHBondContact O-N 2.72Å; C117-H119 PolarHBondContact O-N 2.99Å; C117-I120 PolarHBondContact O-N 2.86Å; C117-I120 VanDerWaalsContact O-N 3.14Å; C117-V121 WeakPolarHBondContact O-CG2 3.13Å; C117-V121 PolarHBondContact O-N 2.96Å
118	N	76.1	Confident	70.6	Confident	78 Å²	78	81.6 Å²	81.6	42%	0.417	45%	0.448	S	S	.	.	H	α-helix	trans	-58.8	-51.2	-178.4	-66.5	12.6	0	0	0	110.7	S114 I120 V121 D122	S114-N118 WeakPolarHBondContact O-CB 3.22Å; S114-N118 PolarHBondContact O-N 3.02Å; S114-N118 PolarHBondContact O-OD1 3.38Å; S114-N118 VanDerWaalsContact O-OD1 3.08Å; N118-I120 PolarHBondContact O-N 3.17Å; N118-I120 VanDerWaalsContact O-N 3.13Å; N118-V121 CarbonylContact O-C 3.56Å; N118-V121 WeakPolarHBondContact O-CA 3.23Å; N118-V121 WeakPolarHBondContact O-CB 3.41Å; N118-V121 PolarHBondContact O-N 2.91Å; N118-D122 WeakPolarHBondContact O-CB 3.37Å; N118-D122 PolarHBondContact O-N 3.43Å; N118-D122 VanDerWaalsContact O-OD2 3.09Å
119	H	73.6	Confident	70.8	Confident	132 Å²	132	79.6 Å²	79.6	61%	0.611	44%	0.439	S	S	*	.	H	α-helix	trans	-58.2	-31.9	178.4	-171.3	-23.9	0	0	0	113.2	S115 C117 H123	S115-H119 WeakPolarHBondContact O-CB 3.26Å; S115-H119 PolarHBondContact O-N 2.98Å; C117-H119 PolarHBondContact O-N 2.99Å; H119-H123 VanDerWaalsContact O-CB 3.24Å; H119-H123 WeakPolarHBondContact O-CB 3.42Å; H119-H123 PolarHBondContact O-N 3.26Å
120	I	67.6	Low	70.7	Confident	74 Å²	74	79.2 Å²	79.2	38%	0.379	43%	0.43	S	S	.	.	H	α-helix	trans	-71.8	-43.9	173.6	-68.1	164.9	0	0	0	110.7	L107 K116 C117 N118 V124	L107-I120 HydrophobicContact CD1-CB 3.99Å; L107-I120 HydrophobicContact CD1-CG2 3.7Å; L107-I120 HydrophobicContact CD2-CD1 4.25Å; K116-I120 WeakPolarHBondContact O-CD1 2.92Å; K116-I120 VanDerWaalsContact O-CG1 3.23Å; K116-I120 WeakPolarHBondContact O-CG1 3.31Å; K116-I120 PolarHBondContact O-N 3.46Å; C117-I120 PolarHBondContact O-N 2.86Å; C117-I120 VanDerWaalsContact O-N 3.14Å; N118-I120 PolarHBondContact O-N 3.17Å; N118-I120 VanDerWaalsContact O-N 3.13Å; I120-V124 WeakPolarHBondContact O-CG2 3.27Å; I120-V124 PolarHBondContact O-N 2.97Å
121	V	74.5	Confident	70.9	Confident	21 Å²	21	77.4 Å²	77.4	13%	0.127	42%	0.42	C	S	.	.	H	α-helix	trans	-62.9	-49	177.6	172	0	0	0	0	111.2	L103 L107 C117 N118 H123 V124 Q125	L103-V121 HydrophobicContact CD2-CG2 4.47Å; L103-V121 HydrophobicContact CG-CG2 4.46Å; L107-V121 HydrophobicContact CD1-CG2 4.01Å; C117-V121 WeakPolarHBondContact O-CG2 3.13Å; C117-V121 PolarHBondContact O-N 2.96Å; N118-V121 CarbonylContact O-C 3.56Å; N118-V121 WeakPolarHBondContact O-CA 3.23Å; N118-V121 WeakPolarHBondContact O-CB 3.41Å; N118-V121 PolarHBondContact O-N 2.91Å; V121-H123 VanDerWaalsContact C-N 3.33Å; V121-H123 PolarHBondContact O-N 2.98Å; V121-V124 PolarHBondContact O-N 2.81Å; V121-V124 VanDerWaalsContact O-N 3.12Å; V121-Q125 WeakPolarHBondContact O-CB 3.43Å; V121-Q125 PolarHBondContact O-N 3.01Å
122	D	76.4	Confident	70.8	Confident	102 Å²	102	75.2 Å²	75.2	55%	0.545	39%	0.393	S	S	.	.	H	α-helix	trans	-57	-45.8	178.3	-59.2	-31.7	0	0	0	111	N118 Q125 E126	N118-D122 WeakPolarHBondContact O-CB 3.37Å; N118-D122 PolarHBondContact O-N 3.43Å; N118-D122 VanDerWaalsContact O-OD2 3.09Å; D122-Q125 PolarHBondContact O-N 2.73Å; D122-E126 WeakPolarHBondContact O-CB 3.41Å; D122-E126 PolarHBondContact O-N 3.36Å
123	H	72.7	Confident	71.1	Confident	100 Å²	100	74.3 Å²	74.3	46%	0.463	39%	0.393	S	S	.	.	H	α-helix	trans	-69.6	-32	178	-178.7	-81.6	0	0	0	112.6	H119 V121 N127	H119-H123 VanDerWaalsContact O-CB 3.24Å; H119-H123 WeakPolarHBondContact O-CB 3.42Å; H119-H123 PolarHBondContact O-N 3.26Å; V121-H123 VanDerWaalsContact C-N 3.33Å; V121-H123 PolarHBondContact O-N 2.98Å; H123-N127 PolarHBondContact CE1-ND2 3.35Å; H123-N127 PolarHBondContact ND1-ND2 3.43Å; H123-N127 PolarHBondContact O-N 3.27Å; H123-N127 VanDerWaalsContact O-N 3.15Å; H123-N127 PolarHBondContact O-ND2 2.98Å
124	V	69.9	Low	70	Confident	51 Å²	51	72.8 Å²	72.8	31%	0.309	39%	0.391	S	S	.	.	H	α-helix	trans	-70.3	-44.1	173	168	0	0	0	0	110.6	T100 L103 I120 V121 N127 M128	T100-V124 HydrophobicContact CG2-CG1 4.14Å; L103-V124 HydrophobicContact CD2-CB 4.05Å; L103-V124 HydrophobicContact CD2-CG1 4.05Å; L103-V124 HydrophobicContact CD2-CG2 3.87Å; I120-V124 WeakPolarHBondContact O-CG2 3.27Å; I120-V124 PolarHBondContact O-N 2.97Å; V121-V124 PolarHBondContact O-N 2.81Å; V121-V124 VanDerWaalsContact O-N 3.12Å; V124-N127 PolarHBondContact O-N 2.82Å; V124-M128 HydrophobicContact CG1-CG 4.4Å; V124-M128 WeakPolarHBondContact O-CG 3.48Å; V124-M128 PolarHBondContact O-N 3.45Å
125	Q	74.7	Confident	68.7	Low	44 Å²	44	74.4 Å²	74.4	21%	0.206	39%	0.394	C	S	.	.	H	α-helix	trans	-56.1	-52	174.5	-175.6	64.1	53.3	0	0	110.7	T100 V121 D122 N127 M128 D129	T100-Q125 HydrophobicContact CG2-CB 4.39Å; T100-Q125 PolarHBondContact OG1-OE1 3.47Å; V121-Q125 WeakPolarHBondContact O-CB 3.43Å; V121-Q125 PolarHBondContact O-N 3.01Å; D122-Q125 PolarHBondContact O-N 2.73Å; Q125-N127 VanDerWaalsContact C-N 3.32Å; Q125-N127 PolarHBondContact O-N 3.35Å; Q125-M128 PolarHBondContact O-N 3.46Å; Q125-M128 VanDerWaalsContact O-N 3.11Å; Q125-D129 VanDerWaalsContact NE2-CG 3.31Å; Q125-D129 PolarHBondContact NE2-OD1 3.03Å; Q125-D129 PolarHBondContact NE2-OD2 2.89Å; Q125-D129 PolarHBondContact O-N 2.82Å
126	E	75.6	Confident	67.2	Low	116 Å²	116	74.3 Å²	74.3	54%	0.542	39%	0.39	S	S	.	.	H	α-helix	trans	-55.6	-42.7	176.7	-179.1	-179.5	-161.8	0	0	112.5	D122 N130	D122-E126 WeakPolarHBondContact O-CB 3.41Å; D122-E126 PolarHBondContact O-N 3.36Å; E126-N130 WeakPolarHBondContact O-CB 3.46Å; E126-N130 PolarHBondContact O-N 3.1Å; E126-N130 PolarHBondContact O-ND2 2.93Å
127	N	72.3	Confident	65.9	Low	87 Å²	87	73.5 Å²	73.5	47%	0.465	39%	0.394	S	S	.	.	H	α-helix	trans	-70	-34.5	178.6	-83	-92.5	0	0	0	112.6	H123 V124 Q125 L131	H123-N127 PolarHBondContact CE1-ND2 3.35Å; H123-N127 PolarHBondContact ND1-ND2 3.43Å; H123-N127 PolarHBondContact O-N 3.27Å; H123-N127 VanDerWaalsContact O-N 3.15Å; H123-N127 PolarHBondContact O-ND2 2.98Å; V124-N127 PolarHBondContact O-N 2.82Å; Q125-N127 VanDerWaalsContact C-N 3.32Å; Q125-N127 PolarHBondContact O-N 3.35Å; N127-L131 PolarHBondContact O-N 3.13Å; N127-L131 VanDerWaalsContact O-N 3.08Å
128	M	70.2	Confident	64.5	Low	71 Å²	71	76 Å²	76	35%	0.35	42%	0.415	S	S	.	.	H	α-helix	trans	-71.9	-40.6	176.5	-68	-61	-68.7	0	0	111.9	I96 V124 Q125 L131 V132	I96-M128 HydrophobicContact CD1-CB 3.9Å; I96-M128 HydrophobicContact CD1-CE 4.31Å; I96-M128 HydrophobicContact CG1-CB 4.03Å; I96-M128 HydrophobicContact CG1-CE 3.85Å; I96-M128 HydrophobicContact CG2-CB 3.78Å; I96-M128 HydrophobicContact CG2-CG 4.28Å; V124-M128 HydrophobicContact CG1-CG 4.4Å; V124-M128 WeakPolarHBondContact O-CG 3.48Å; V124-M128 PolarHBondContact O-N 3.45Å; Q125-M128 PolarHBondContact O-N 3.46Å; Q125-M128 VanDerWaalsContact O-N 3.11Å; M128-L131 WeakPolarHBondContact O-CB 3.14Å; M128-L131 PolarHBondContact O-N 3.42Å; M128-L131 VanDerWaalsContact O-N 3.16Å; M128-V132 WeakPolarHBondContact O-CG2 3.33Å; M128-V132 PolarHBondContact O-N 3.49Å
129	D	71.6	Confident	62.6	Low	65 Å²	65	80.9 Å²	80.9	35%	0.348	43%	0.428	S	S	.	.	H	α-helix	trans	-67.8	-35.6	176.3	-66.9	-35.7	0	0	0	111.8	Q125 L131 S133	Q125-D129 VanDerWaalsContact NE2-CG 3.31Å; Q125-D129 PolarHBondContact NE2-OD1 3.03Å; Q125-D129 PolarHBondContact NE2-OD2 2.89Å; Q125-D129 PolarHBondContact O-N 2.82Å; D129-L131 VanDerWaalsContact C-N 3.34Å; D129-S133 WeakPolarHBondContact O-CB 3.43Å; D129-S133 PolarHBondContact O-N 2.85Å; D129-S133 PolarHBondContact O-OG 3.09Å
130	N	70.1	Confident	60.8	Low	87 Å²	87	82 Å²	82	47%	0.465	43%	0.434	S	S	.	.	H	α-helix	trans	-65	-33.7	170.1	-82.1	-60.5	0	0	0	112.8	E126 S133 T134	E126-N130 WeakPolarHBondContact O-CB 3.46Å; E126-N130 PolarHBondContact O-N 3.1Å; E126-N130 PolarHBondContact O-ND2 2.93Å; N130-S133 WeakPolarHBondContact CA-OG 3.46Å; N130-S133 PolarHBondContact O-OG 3.43Å; N130-T134 WeakPolarHBondContact O-CG2 3.15Å; N130-T134 PolarHBondContact O-N 3.37Å; N130-T134 VanDerWaalsContact O-N 3.12Å; N130-T134 PolarHBondContact O-OG1 2.88Å
131	L	62.6	Low	59.6	Low	89 Å²	89	82.5 Å²	82.5	47%	0.466	44%	0.444	S	S	.	.	H	α-helix	trans	-70.5	-47.9	175.4	-173.2	64.3	0	0	0	111.3	N127 M128 D129 S133 T134 D135	N127-L131 PolarHBondContact O-N 3.13Å; N127-L131 VanDerWaalsContact O-N 3.08Å; M128-L131 WeakPolarHBondContact O-CB 3.14Å; M128-L131 PolarHBondContact O-N 3.42Å; M128-L131 VanDerWaalsContact O-N 3.16Å; D129-L131 VanDerWaalsContact C-N 3.34Å; L131-S133 VanDerWaalsContact C-N 3.29Å; L131-S133 PolarHBondContact O-N 3.07Å; L131-T134 PolarHBondContact O-N 2.82Å; L131-T134 PolarHBondContact O-OG1 3.25Å; L131-T134 VanDerWaalsContact O-OG1 3.08Å; L131-D135 PolarHBondContact O-N 3.44Å
132	V	63.3	Low	57.7	Low	26 Å²	26	89.2 Å²	89.2	16%	0.158	47%	0.474	C	S	.	.	H	α-helix	trans	-61.8	-36.5	178.1	173.1	0	0	0	0	112.1	L92 I96 M128 T136	L92-V132 HydrophobicContact CB-CG2 4.3Å; L92-V132 HydrophobicContact CD1-CG2 4.38Å; I96-V132 HydrophobicContact CD1-CG2 3.7Å; M128-V132 WeakPolarHBondContact O-CG2 3.33Å; M128-V132 PolarHBondContact O-N 3.49Å; V132-T136 WeakPolarHBondContact O-CG2 3.17Å; V132-T136 PolarHBondContact O-N 2.87Å; V132-T136 PolarHBondContact O-OG1 2.87Å
133	S	62.2	Low	55.8	Low	54 Å²	54	90.9 Å²	90.9	38%	0.378	48%	0.482	S	S	.	.	H	α-helix	trans	-76.7	-25.5	176.9	53	0	0	0	0	114.1	D129 N130 L131 T136 T137	D129-S133 WeakPolarHBondContact O-CB 3.43Å; D129-S133 PolarHBondContact O-N 2.85Å; D129-S133 PolarHBondContact O-OG 3.09Å; N130-S133 WeakPolarHBondContact CA-OG 3.46Å; N130-S133 PolarHBondContact O-OG 3.43Å; L131-S133 VanDerWaalsContact C-N 3.29Å; L131-S133 PolarHBondContact O-N 3.07Å; S133-T136 WeakPolarHBondContact CA-OG1 3.29Å; S133-T136 PolarHBondContact O-OG1 2.88Å; S133-T137 WeakPolarHBondContact O-CB 3.45Å; S133-T137 WeakPolarHBondContact O-CG2 3.36Å; S133-T137 PolarHBondContact O-N 2.82Å; S133-T137 PolarHBondContact O-OG1 3.38Å
134	T	52.8	Low	54	Low	80 Å²	80	92.5 Å²	92.5	49%	0.491	49%	0.494	S	S	.	.	H	α-helix	trans	-80	-40.2	173.4	42	0	0	0	0	112.8	N130 L131 T136 T137 A138	N130-T134 WeakPolarHBondContact O-CG2 3.15Å; N130-T134 PolarHBondContact O-N 3.37Å; N130-T134 VanDerWaalsContact O-N 3.12Å; N130-T134 PolarHBondContact O-OG1 2.88Å; L131-T134 PolarHBondContact O-N 2.82Å; L131-T134 PolarHBondContact O-OG1 3.25Å; L131-T134 VanDerWaalsContact O-OG1 3.08Å; T134-T136 VanDerWaalsContact C-N 3.35Å; T134-T136 PolarHBondContact O-N 3.47Å; T134-T137 PolarHBondContact O-OG1 3.48Å; T134-A138 VanDerWaalsContact O-CB 3.29Å; T134-A138 WeakPolarHBondContact O-CB 3.45Å; T134-A138 PolarHBondContact O-N 3.42Å
135	D	45.3	Very low	52.4	Low	108 Å²	108	98.4 Å²	98.4	58%	0.578	52%	0.516	S	S	*	.	H	α-helix	trans	-66.9	-33.6	176.1	-82.3	-23.5	0	0	0	112.7	L131	L131-D135 PolarHBondContact O-N 3.44Å
136	T	43	Very low	50.4	Low	75 Å²	75	104.3 Å²	104.3	46%	0.46	55%	0.549	S	S	.	.	H	α-helix	trans	-72	-45.8	175.5	43.2	0	0	0	0	112.6	V132 S133 T134 A138 Y139 E140	V132-T136 WeakPolarHBondContact O-CG2 3.17Å; V132-T136 PolarHBondContact O-N 2.87Å; V132-T136 PolarHBondContact O-OG1 2.87Å; S133-T136 WeakPolarHBondContact CA-OG1 3.29Å; S133-T136 PolarHBondContact O-OG1 2.88Å; T134-T136 VanDerWaalsContact C-N 3.35Å; T134-T136 PolarHBondContact O-N 3.47Å; T136-A138 PolarHBondContact O-N 2.71Å; T136-Y139 PolarHBondContact O-N 2.94Å; T136-E140 PolarHBondContact O-N 3.29Å
137	T	42.1	Very low	48.6	Very low	83 Å²	83	107.5 Å²	107.5	51%	0.509	56%	0.561	S	S	.	*	H	α-helix	trans	-70.7	-29.6	-179.6	51.2	0	0	0	0	113.4	S133 T134 S141	S133-T137 WeakPolarHBondContact O-CB 3.45Å; S133-T137 WeakPolarHBondContact O-CG2 3.36Å; S133-T137 PolarHBondContact O-N 2.82Å; S133-T137 PolarHBondContact O-OG1 3.38Å; T134-T137 PolarHBondContact O-OG1 3.48Å; T137-S141 WeakPolarHBondContact O-CB 3.46Å; T137-S141 PolarHBondContact O-N 3.22Å; T137-S141 PolarHBondContact O-OG 3.2Å
138	A	38.8	Very low	46.7	Very low	53 Å²	53	112.5 Å²	112.5	44%	0.438	58%	0.579	S	S	.	*	H	α-helix	trans	-64.8	-37.6	174.7	0	0	0	0	0	112.8	T134 T136	T134-A138 VanDerWaalsContact O-CB 3.29Å; T134-A138 WeakPolarHBondContact O-CB 3.45Å; T134-A138 PolarHBondContact O-N 3.42Å; T136-A138 PolarHBondContact O-N 2.71Å
139	Y	34.6	Very low	44.9	Very low	181 Å²	181	116.2 Å²	116.2	71%	0.71	61%	0.605	S	S	*	*	H	α-helix	trans	-78.2	-40.2	-177	-117.1	-85.1	0	0	0	113.4	T136 S141 Q142	T136-Y139 PolarHBondContact O-N 2.94Å; Y139-S141 VanDerWaalsContact C-N 3.32Å; Y139-S141 PolarHBondContact O-N 2.91Å; Y139-Q142 PolarHBondContact O-N 3.1Å
140	E	37	Very low	43.1	Very low	154 Å²	154	119.3 Å²	119.3	72%	0.72	63%	0.627	S	S	*	*	H	α-helix	trans	-67.7	-33.9	176.7	-66.7	-170.2	150.6	0	0	111.8	T136 Q142 L143	T136-E140 PolarHBondContact O-N 3.29Å; E140-Q142 PolarHBondContact O-N 3.49Å; E140-Q142 VanDerWaalsContact O-N 3.11Å; E140-L143 PolarHBondContact O-N 2.97Å
141	S	41.2	Very low	41	Very low	85 Å²	85	120.6 Å²	120.6	59%	0.594	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.3	-12.4	178.8	-60.7	0	0	0	0	115	T137 Y139	T137-S141 WeakPolarHBondContact O-CB 3.46Å; T137-S141 PolarHBondContact O-N 3.22Å; T137-S141 PolarHBondContact O-OG 3.2Å; Y139-S141 VanDerWaalsContact C-N 3.32Å; Y139-S141 PolarHBondContact O-N 2.91Å
142	Q	36.1	Very low	39.4	Very low	162 Å²	162	124.6 Å²	124.6	76%	0.757	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.9	-1.5	179.4	-75	-171.3	-27.3	0	0	114.4	Y139 E140	Y139-Q142 PolarHBondContact O-N 3.1Å; E140-Q142 PolarHBondContact O-N 3.49Å; E140-Q142 VanDerWaalsContact O-N 3.11Å
143	L	35.7	Very low	37.7	Very low	138 Å²	138	129.4 Å²	129.4	72%	0.723	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.8	-7	-175.4	-77.7	166.7	0	0	0	115.4	E140	E140-L143 PolarHBondContact O-N 2.97Å
144	D	34.4	Very low	36	Very low	133 Å²	133	132.7 Å²	132.7	71%	0.711	71%	0.712	S	S	*	*	S	Bend	trans	-105.6	5.8	-176.9	-156.1	35	0	0	0	114.7
145	F	36.1	Very low	35	Very low	175 Å²	175	138.5 Å²	138.5	77%	0.768	73%	0.734	S	S	*	*	G	3₁₀ helix	trans	-80	-21.3	179.9	-100.1	-84.8	0	0	0	114.7	K147	F145-K147 VanDerWaalsContact C-N 3.33Å; F145-K147 PolarHBondContact O-N 3.37Å
146	D	33.9	Very low	34.1	Very low	168 Å²	168	145.1 Å²	145.1	90%	0.898	75%	0.751	S	S	*	*	G	3₁₀ helix	trans	-86.1	16	-172.3	-82.1	-24.9	0	0	0	115.3
147	K	36.8	Very low	33.3	Very low	184 Å²	184	144.9 Å²	144.9	80%	0.8	76%	0.763	S	S	*	*	G	3₁₀ helix	trans	-123.8	-2	-174.3	-91.4	177.9	179.7	167.5	0	118	F145	F145-K147 VanDerWaalsContact C-N 3.33Å; F145-K147 PolarHBondContact O-N 3.37Å
148	K	33.1	Very low	32.5	Very low	191 Å²	191	148.7 Å²	148.7	83%	0.83	78%	0.779	S	S	*	*			trans	-149.3	92.4	175.6	-90.3	-175.8	176.5	172	0	113.9
149	T	32.1	Very low	31.9	Very low	149 Å²	149	150.7 Å²	150.7	91%	0.914	79%	0.789	S	S	*	*				-170.5	127.1	109	16.6	0	0	0	0	112
150	T	33.7	Very low	31.5	Very low	131 Å²	131	147.7 Å²	147.7	80%	0.804	80%	0.795	S	S	*	*			trans	-73.6	146.3	174.8	-44.6	0	0	0	0	111
151	C	25.4	Very low	31.3	Very low	114 Å²	114	146.2 Å²	146.2	77%	0.77	80%	0.799	S	S	*	*			trans	-2.4	134.6	163.6	-49.3	0	0	0	0	119.3
152	L	29.9	Very low	30.6	Very low	172 Å²	172	150.2 Å²	150.2	90%	0.901	81%	0.812	S	S	*	*				-162.4	152.7	117.6	-103.7	166.6	0	0	0	111.3
153	T	28.6	Very low	30	Very low	127 Å²	127	150.9 Å²	150.9	78%	0.779	81%	0.812	S	S	*	*			trans	-93.1	156	-169.1	32.9	0	0	0	0	114
154	P	26.4	Very low	29.6	Very low	124 Å²	124	151.9 Å²	151.9	81%	0.805	81%	0.813	S	S	*	*			trans	-81.1	142.2	-174.7	32.3	-35.6	0	0	0	113.2
155	Q	30.7	Very low	29.3	Very low	201 Å²	201	153 Å²	153	94%	0.939	82%	0.817	S	S	*	*			trans	-133.4	164.5	163.5	-79.1	-153.3	-0.7	0	0	112.9
156	R	26.9	Very low	29	Very low	248 Å²	248	150.6 Å²	150.6	94%	0.936	81%	0.811	S	S	*	*			trans	-84.6	127.8	-162.4	-62.2	166.7	172.6	158.8	-5.5	113.5
157	G	25.7	Very low	28.7	Very low	70 Å²	70	149.5 Å²	149.5	72%	0.722	81%	0.806	S	S	*	*				93.5	175.2	113.7	0	0	0	0	0	120.6
158	I	26.5	Very low	28.4	Very low	162 Å²	162	147.1 Å²	147.1	83%	0.831	80%	0.801	S	S	*	*			trans	82	103.5	163	-53	170.3	0	0	0	117.2
159	S	25.4	Very low	28.5	Very low	95 Å²	95	143.7 Å²	143.7	66%	0.664	80%	0.801	S	S	*	*			trans	45.7	113.7	150.6	67.6	0	0	0	0	122.9
160	S	25.6	Very low	28.4	Very low	119 Å²	119	142.7 Å²	142.7	83%	0.832	79%	0.79	S	S	*	*				60.9	152.1	117.8	-56.7	0	0	0	0	122.5
161	P	32.8	Very low	28.6	Very low	122 Å²	122	143 Å²	143	79%	0.792	78%	0.782	S	S	*	*			trans	-101.6	161.2	-159.8	39.8	-36.2	0	0	0	115.9
162	I	27	Very low	29.1	Very low	169 Å²	169	144.4 Å²	144.4	87%	0.867	78%	0.782	S	S	*	*			trans	-133.5	161	169.1	-66.5	-176.2	0	0	0	109.9
163	F	24.3	Very low	29.3	Very low	177 Å²	177	141 Å²	141	78%	0.776	78%	0.779	S	S	*	*			trans	-92.9	152.3	-164.2	-96	-114	0	0	0	115.9
164	E	26.7	Very low	29.3	Very low	159 Å²	159	140.3 Å²	140.3	74%	0.743	78%	0.779	S	S	*	*			trans	72	-177.5	132.4	-159.3	157	-126.1	0	0	120.4	I166	E164-I166 HydrophobicContact CG-CD1 4.46Å
165	I	28.3	Very low	30	Very low	155 Å²	155	139.7 Å²	139.7	80%	0.795	78%	0.775	S	S	*	*			trans	76.8	105.4	-167.5	-49.2	173.9	0	0	0	112.2
166	I	28.6	Very low	30.3	Very low	125 Å²	125	136.9 Å²	136.9	64%	0.641	77%	0.772	S	S	*	*			cis	92.9	109.3	41.3	-61.7	163.1	0	0	0	113.5	E164 L168	E164-I166 HydrophobicContact CG-CD1 4.46Å; I166-L168 HydrophobicContact CG2-CD1 4.41Å
167	D	29	Very low	30.5	Very low	145 Å²	145	132.5 Å²	132.5	78%	0.775	77%	0.767	S	S	*	*			trans	-178.7	140.1	132.6	-99.1	-9.8	0	0	0	107
168	L	29.5	Very low	31.2	Very low	135 Å²	135	133.9 Å²	133.9	71%	0.707	76%	0.763	S	S	*	*			cis	118.3	154.3	18.6	-94	168.8	0	0	0	111	I166	I166-L168 HydrophobicContact CG2-CD1 4.41Å
169	S	34.7	Very low	31.6	Very low	118 Å²	118	134.6 Å²	134.6	83%	0.825	76%	0.763	S	S	*	*			trans	81.6	94.7	-168.2	-39.4	0	0	0	0	114.1
170	D	31.7	Very low	32	Very low	128 Å²	128	135.6 Å²	135.6	68%	0.684	77%	0.769	S	S	*	*			cis	97.8	150.4	19.3	-154	-2.6	0	0	0	115.5
171	H	37.5	Very low	32.3	Very low	138 Å²	138	135.3 Å²	135.3	64%	0.639	77%	0.767	S	S	*	*			trans	97.8	101.1	162.6	-66	1.1	0	0	0	122
172	N	35.3	Very low	32.5	Very low	143 Å²	143	133.2 Å²	133.2	77%	0.765	77%	0.767	S	S	*	*				69.4	142.6	124.8	-51.4	-31.5	0	0	0	119.7
173	A	33.2	Very low	32.9	Very low	102 Å²	102	132.6 Å²	132.6	84%	0.843	77%	0.765	S	S	*	*			cis	-149.1	-174.9	17	0	0	0	0	0	113.5
174	S	28.6	Very low	33.7	Very low	111 Å²	111	131.1 Å²	131.1	78%	0.776	77%	0.766	S	S	*	*			trans	-149.9	-158.1	-173.3	-162.9	0	0	0	0	110.4
175	P	42.2	Very low	34.1	Very low	111 Å²	111	127.8 Å²	127.8	72%	0.721	76%	0.76	S	S	*	*				-119.9	175	-86.7	37.3	-23.5	0	0	0	115.5
176	T	36	Very low	34.6	Very low	143 Å²	143	128.6 Å²	128.6	88%	0.877	77%	0.766	S	S	*	*			trans	-152.2	141.2	160.7	-1.1	0	0	0	0	115
177	N	32.6	Very low	34.7	Very low	155 Å²	155	132.2 Å²	132.2	83%	0.829	78%	0.777	S	S	*	*			trans	-106.4	-167.9	166.5	-76	-27	0	0	0	108
178	P	40.5	Very low	35.1	Very low	99 Å²	99	131.2 Å²	131.2	64%	0.643	78%	0.781	S	S	*	*			cis	-140.9	-162.6	3.7	45.6	-25.9	0	0	0	116.1
179	E	33.7	Very low	35.2	Very low	178 Å²	178	133.8 Å²	133.8	83%	0.832	79%	0.79	S	S	*	*			trans	71.4	154	159.2	-73.5	159.7	-144.4	0	0	118.1
180	C	34	Very low	35	Very low	116 Å²	116	135 Å²	135	78%	0.784	79%	0.787	S	S	*	*			cis	-138	-178.9	10.2	-153.1	0	0	0	0	113.5
181	S	33.1	Very low	34.8	Very low	113 Å²	113	140.1 Å²	140.1	79%	0.79	80%	0.799	S	S	*	*			trans	-97.6	171.6	-164.2	55.5	0	0	0	0	116.4
182	G	37.1	Very low	34.2	Very low	77 Å²	77	137 Å²	137	79%	0.794	80%	0.803	S	S	*	*			trans	-179.6	96.4	170	0	0	0	0	0	113
183	D	34.9	Very low	33.8	Very low	156 Å²	156	139 Å²	139	83%	0.834	81%	0.808	S	S	*	*			trans	-76.1	149.9	172.3	-75.2	-68.5	0	0	0	111.8
184	D	39.6	Very low	33.5	Very low	147 Å²	147	138.6 Å²	138.6	79%	0.786	80%	0.797	S	S	*	*				-162.9	128	107.5	-133.5	-27	0	0	0	115.9
185	S	35.1	Very low	33.4	Very low	89 Å²	89	142.3 Å²	142.3	62%	0.622	80%	0.802	S	S	*	*			trans	4.8	126	147.5	-45.9	0	0	0	0	120.9
186	N	38.9	Very low	32.6	Very low	171 Å²	171	146 Å²	146	91%	0.914	80%	0.803	S	S	*	*				-163.3	158.5	110.5	-110.6	-62.9	0	0	0	115.2
187	K	32.4	Very low	32.1	Very low	202 Å²	202	144.4 Å²	144.4	88%	0.878	80%	0.797	S	S	*	*			trans	-105.3	143.5	-171	-62.5	168.3	-179	167.8	0	113
188	S	35.9	Very low	31.9	Very low	124 Å²	124	146.4 Å²	146.4	87%	0.867	80%	0.799	S	S	*	*			trans	-153.8	160.8	137.5	61.9	0	0	0	0	109.9
189	Q	33.2	Very low	31.3	Very low	189 Å²	189	148.6 Å²	148.6	88%	0.883	80%	0.804	S	S	*	*			trans	-111	144.3	-162.8	-69.3	167.4	-88.7	0	0	113.9
190	N	29.2	Very low	31.2	Very low	144 Å²	144	144.9 Å²	144.9	77%	0.77	80%	0.796	S	S	*	*			trans	-2.1	139	147.6	-110.4	-33.5	0	0	0	118.1
191	Y	26.9	Very low	31.2	Very low	235 Å²	235	144.5 Å²	144.5	92%	0.922	79%	0.79	S	S	*	*				-165.1	116.7	114.8	-105.1	-65.9	0	0	0	113.9
192	G	26	Very low	31.5	Very low	71 Å²	71	145.7 Å²	145.7	73%	0.732	79%	0.786	S	S	*	*			trans	56	104.5	143	0	0	0	0	0	120.9
193	Q	26.7	Very low	31.6	Very low	186 Å²	186	146.2 Å²	146.2	87%	0.869	78%	0.778	S	S	*	*			trans	-136.7	129.4	155.5	-156	175.8	18.3	0	0	110.2
194	P	27	Very low	31.9	Very low	93 Å²	93	142.8 Å²	142.8	60%	0.604	76%	0.762	S	S	*	*			trans	-78.5	134.4	-175.1	30	-34.6	0	0	0	112.5	Y196	P194-Y196 HydrophobicContact CB-CD2 4.47Å; P194-Y196 HydrophobicContact CB-CE2 4.12Å; P194-Y196 HydrophobicContact CG-CD2 4.29Å; P194-Y196 HydrophobicContact CG-CE2 3.81Å; P194-Y196 PolarHBondContact O-N 3.4Å
195	Q	25.6	Very low	32.1	Very low	190 Å²	190	139.5 Å²	139.5	89%	0.888	75%	0.748	S	S	*	*			trans	-75.9	114.1	171.6	-69.8	-178	-13.2	0	0	110.6
196	Y	26	Very low	32.9	Very low	189 Å²	189	138.5 Å²	138.5	74%	0.741	74%	0.737	S	S	*	*			trans	-101.7	95.6	168.7	-78.9	-79.7	0	0	0	110.6	P194 F198	P194-Y196 HydrophobicContact CB-CD2 4.47Å; P194-Y196 HydrophobicContact CB-CE2 4.12Å; P194-Y196 HydrophobicContact CG-CD2 4.29Å; P194-Y196 HydrophobicContact CG-CE2 3.81Å; P194-Y196 PolarHBondContact O-N 3.4Å; Y196-F198 PolarHBondContact O-N 3.47Å
197	S	26	Very low	33.4	Very low	108 Å²	108	137.2 Å²	137.2	76%	0.755	72%	0.721	S	S	*	*			trans	-77.5	107.1	167	39.8	0	0	0	0	109.9	L199	S197-L199 PolarHBondContact O-N 2.79Å
198	F	27.6	Very low	34.6	Very low	198 Å²	198	130.3 Å²	130.3	87%	0.868	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-69.2	117.1	178.6	-78.5	-90.4	0	0	0	111.3	Y196	Y196-F198 PolarHBondContact O-N 3.47Å
199	L	28.2	Very low	36	Very low	145 Å²	145	128.6 Å²	128.6	76%	0.759	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-62.7	142.5	169.4	-98	68.3	0	0	0	110.7	S197 T201	S197-L199 PolarHBondContact O-N 2.79Å; L199-T201 PolarHBondContact O-N 2.66Å; L199-T201 VanDerWaalsContact O-N 3.15Å
200	P	32.1	Very low	37.3	Very low	100 Å²	100	128.4 Å²	128.4	65%	0.649	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-57.3	119.3	168.6	-22.6	33.5	0	0	0	110.5	I202 V205	P200-I202 PolarHBondContact O-N 2.95Å; P200-V205 HydrophobicContact CB-CG2 4.32Å
201	T	33.4	Very low	39	Very low	107 Å²	107	128 Å²	128	66%	0.656	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-63.5	136.8	178.7	-39.4	0	0	0	0	109.9	L199 S203 T204	L199-T201 PolarHBondContact O-N 2.66Å; L199-T201 VanDerWaalsContact O-N 3.15Å; T201-S203 PolarHBondContact O-N 3.38Å; T201-T204 PolarHBondContact O-N 2.9Å; T201-T204 PolarHBondContact O-OG1 3.32Å
202	I	40.5	Very low	41	Very low	138 Å²	138	124 Å²	124	71%	0.708	63%	0.634	S	S	*	*	H	α-helix	trans	-44.4	-40.3	-174.7	-62.6	168	0	0	0	112.5	P200 T204 V205 T206	P200-I202 PolarHBondContact O-N 2.95Å; I202-T204 PolarHBondContact O-N 3.09Å; I202-V205 PolarHBondContact O-N 3.23Å; I202-V205 VanDerWaalsContact O-N 3.13Å; I202-T206 PolarHBondContact O-N 3.43Å; I202-T206 PolarHBondContact O-OG1 3.05Å; I202-T206 VanDerWaalsContact O-OG1 3.09Å
203	S	39.3	Very low	42.9	Very low	89 Å²	89	125.2 Å²	125.2	62%	0.622	62%	0.621	S	S	*	*	H	α-helix	trans	-43.9	-48.9	173.6	-176.1	0	0	0	0	115.4	T201 Y207	T201-S203 PolarHBondContact O-N 3.38Å; S203-Y207 WeakPolarHBondContact O-CB 3.49Å; S203-Y207 PolarHBondContact O-N 2.96Å
204	T	41.4	Very low	44.7	Very low	83 Å²	83	121.5 Å²	121.5	51%	0.509	61%	0.607	S	S	.	*	H	α-helix	trans	-74.3	-32.1	-177.7	43.7	0	0	0	0	112.3	T201 I202 Y207 E208	T201-T204 PolarHBondContact O-N 2.9Å; T201-T204 PolarHBondContact O-OG1 3.32Å; I202-T204 PolarHBondContact O-N 3.09Å; T204-Y207 PolarHBondContact O-N 3.39Å; T204-E208 PolarHBondContact O-N 2.87Å; T204-E208 VanDerWaalsContact O-N 3.11Å
205	V	42.9	Very low	46.6	Very low	79 Å²	79	121.5 Å²	121.5	48%	0.479	60%	0.601	S	S	.	*	H	α-helix	trans	-66.7	-46	174.2	-176.5	0	0	0	0	110.4	P200 I202 Y207 E208 L209	P200-V205 HydrophobicContact CB-CG2 4.32Å; I202-V205 PolarHBondContact O-N 3.23Å; I202-V205 VanDerWaalsContact O-N 3.13Å; V205-Y207 VanDerWaalsContact C-N 3.34Å; V205-Y207 PolarHBondContact O-N 3.24Å; V205-E208 PolarHBondContact O-N 3.3Å; V205-L209 HydrophobicContact CG1-CD1 4.34Å; V205-L209 WeakPolarHBondContact O-CB 3.37Å; V205-L209 PolarHBondContact O-N 3.4Å
206	T	52.3	Low	48.5	Very low	67 Å²	67	118.8 Å²	118.8	41%	0.411	58%	0.583	S	S	.	*	H	α-helix	trans	-64	-36.8	176.4	-49.5	0	0	0	0	112.4	I202 R210	I202-T206 PolarHBondContact O-N 3.43Å; I202-T206 PolarHBondContact O-OG1 3.05Å; I202-T206 VanDerWaalsContact O-OG1 3.09Å; T206-R210 PolarHBondContact O-N 2.95Å
207	Y	49.9	Very low	49.8	Very low	144 Å²	144	111.9 Å²	111.9	57%	0.565	57%	0.565	S	S	*	*	H	α-helix	trans	-64.5	-49.3	176.6	176.6	-94.1	0	0	0	112.3	S203 T204 V205 L209 R210 R211	S203-Y207 WeakPolarHBondContact O-CB 3.49Å; S203-Y207 PolarHBondContact O-N 2.96Å; T204-Y207 PolarHBondContact O-N 3.39Å; V205-Y207 VanDerWaalsContact C-N 3.34Å; V205-Y207 PolarHBondContact O-N 3.24Å; Y207-L209 VanDerWaalsContact C-N 3.33Å; Y207-L209 PolarHBondContact O-N 2.97Å; Y207-R210 PolarHBondContact O-N 3.14Å; Y207-R211 WeakPolarHBondContact O-CB 3.48Å; Y207-R211 PolarHBondContact O-N 3.17Å
208	E	56.9	Low	51	Low	58 Å²	58	110.7 Å²	110.7	27%	0.271	55%	0.55	S	S	.	.	H	α-helix	trans	-68.9	-29.9	178.4	-82.8	-65	133	0	0	112.8	T204 V205 R211 R212	T204-E208 PolarHBondContact O-N 2.87Å; T204-E208 VanDerWaalsContact O-N 3.11Å; V205-E208 PolarHBondContact O-N 3.3Å; E208-R211 WeakPolarHBondContact OE1-CD 3.49Å; E208-R211 IonicContact OE1-CZ 3.4Å; E208-R211 IonicContact OE1-NE 2.68Å; E208-R211 IonicContact OE1-NH1 3.64Å; E208-R211 PolarHBondContact OE1-NH1 3.22Å; E208-R211 IonicContact OE2-NH1 3.84Å; E208-R212 WeakPolarHBondContact O-CB 3.42Å; E208-R212 WeakPolarHBondContact O-CD 3.45Å; E208-R212 WeakPolarHBondContact O-CG 3.47Å; E208-R212 PolarHBondContact O-N 2.87Å; E208-R212 IonicContact OE2-NE 2.84Å
209	L	65	Low	52.4	Low	87 Å²	87	107.6 Å²	107.6	46%	0.455	54%	0.538	S	S	.	.	H	α-helix	trans	-59.4	-56.1	168.5	-100.5	157.4	0	0	0	111.4	V205 Y207 R211 R212 E213	V205-L209 HydrophobicContact CG1-CD1 4.34Å; V205-L209 WeakPolarHBondContact O-CB 3.37Å; V205-L209 PolarHBondContact O-N 3.4Å; Y207-L209 VanDerWaalsContact C-N 3.33Å; Y207-L209 PolarHBondContact O-N 2.97Å; L209-R211 VanDerWaalsContact C-N 3.29Å; L209-R211 PolarHBondContact O-N 3.08Å; L209-R212 PolarHBondContact O-N 3.29Å; L209-R212 VanDerWaalsContact O-N 3.12Å; L209-E213 WeakPolarHBondContact O-CG 3.24Å; L209-E213 PolarHBondContact O-N 3.39Å
210	R	60.4	Low	53.5	Low	185 Å²	185	108.8 Å²	108.8	70%	0.698	53%	0.532	S	S	*	.	H	α-helix	trans	-58.5	-39.1	177.4	-83.2	-174.6	170.6	173.9	-2.1	112.6	T206 Y207 E213 L214	T206-R210 PolarHBondContact O-N 2.95Å; Y207-R210 PolarHBondContact O-N 3.14Å; R210-E213 PolarHBondContact O-N 3.48Å; R210-L214 WeakPolarHBondContact O-CB 3.22Å; R210-L214 PolarHBondContact O-N 2.92Å
211	R	65.5	Low	54.1	Low	135 Å²	135	110 Å²	110	51%	0.509	53%	0.532	S	S	.	.	H	α-helix	trans	-61.4	-44.4	176.3	-174.1	-172.5	175.4	-160	-4.8	111.7	Y207 E208 L209 L215	Y207-R211 WeakPolarHBondContact O-CB 3.48Å; Y207-R211 PolarHBondContact O-N 3.17Å; E208-R211 WeakPolarHBondContact OE1-CD 3.49Å; E208-R211 IonicContact OE1-CZ 3.4Å; E208-R211 IonicContact OE1-NE 2.68Å; E208-R211 IonicContact OE1-NH1 3.64Å; E208-R211 PolarHBondContact OE1-NH1 3.22Å; E208-R211 IonicContact OE2-NH1 3.84Å; L209-R211 VanDerWaalsContact C-N 3.29Å; L209-R211 PolarHBondContact O-N 3.08Å; R211-L215 WeakPolarHBondContact O-CG 3.48Å; R211-L215 PolarHBondContact O-N 2.67Å; R211-L215 VanDerWaalsContact O-N 3.09Å
212	R	69.2	Low	54.6	Low	152 Å²	152	110.4 Å²	110.4	57%	0.574	54%	0.535	S	S	*	.	H	α-helix	trans	-68.7	-38.2	177.6	-70.5	166	-173.3	-161.2	-2.7	112	E208 L209 L215 R216	E208-R212 WeakPolarHBondContact O-CB 3.42Å; E208-R212 WeakPolarHBondContact O-CD 3.45Å; E208-R212 WeakPolarHBondContact O-CG 3.47Å; E208-R212 PolarHBondContact O-N 2.87Å; E208-R212 IonicContact OE2-NE 2.84Å; L209-R212 PolarHBondContact O-N 3.29Å; L209-R212 VanDerWaalsContact O-N 3.12Å; R212-L215 PolarHBondContact O-N 3.13Å; R212-R216 WeakPolarHBondContact O-CG 3.49Å; R212-R216 PolarHBondContact O-N 2.79Å
213	E	65	Low	54.8	Low	97 Å²	97	107.7 Å²	107.7	45%	0.453	53%	0.528	S	S	.	.	H	α-helix	trans	-66.7	-41.9	176.4	-72.4	172.6	154.5	0	0	112.2	L209 R210 L215 R216 A217	L209-E213 WeakPolarHBondContact O-CG 3.24Å; L209-E213 PolarHBondContact O-N 3.39Å; R210-E213 PolarHBondContact O-N 3.48Å; E213-L215 VanDerWaalsContact C-N 3.34Å; E213-L215 PolarHBondContact O-N 2.97Å; E213-R216 PolarHBondContact O-N 2.97Å; E213-A217 WeakPolarHBondContact O-CB 3.49Å; E213-A217 PolarHBondContact O-N 2.98Å
214	L	64.7	Low	54.8	Low	107 Å²	107	108.9 Å²	108.9	56%	0.56	53%	0.527	S	S	*	.	H	α-helix	trans	-67	-35.5	176.8	-161.3	149	0	0	0	111.7	R210 A217 N218	R210-L214 WeakPolarHBondContact O-CB 3.22Å; R210-L214 PolarHBondContact O-N 2.92Å; L214-A217 PolarHBondContact O-N 2.89Å; L214-N218 VanDerWaalsContact O-CG 3.3Å; L214-N218 PolarHBondContact O-N 2.68Å; L214-N218 PolarHBondContact O-OD1 3.37Å
215	L	66.7	Low	54.3	Low	94 Å²	94	110.1 Å²	110.1	49%	0.492	54%	0.539	S	S	.	.	H	α-helix	trans	-63.2	-45.2	169.6	-75.2	167	0	0	0	112.3	R211 R212 E213 A217 N218 Q219	R211-L215 WeakPolarHBondContact O-CG 3.48Å; R211-L215 PolarHBondContact O-N 2.67Å; R211-L215 VanDerWaalsContact O-N 3.09Å; R212-L215 PolarHBondContact O-N 3.13Å; E213-L215 VanDerWaalsContact C-N 3.34Å; E213-L215 PolarHBondContact O-N 2.97Å; L215-A217 VanDerWaalsContact C-N 3.33Å; L215-A217 PolarHBondContact O-N 2.97Å; L215-N218 PolarHBondContact O-N 3.27Å; L215-Q219 WeakPolarHBondContact O-CB 3.43Å; L215-Q219 WeakPolarHBondContact O-CG 3.44Å; L215-Q219 PolarHBondContact O-N 2.79Å
216	R	64.7	Low	53.7	Low	132 Å²	132	110.9 Å²	110.9	50%	0.498	55%	0.548	S	S	.	.	H	α-helix	trans	-62.7	-38.2	174.2	-70.1	-175.8	-160.5	130.9	-6	112.4	R212 E213 Q219 R220	R212-R216 WeakPolarHBondContact O-CG 3.49Å; R212-R216 PolarHBondContact O-N 2.79Å; E213-R216 PolarHBondContact O-N 2.97Å; R216-Q219 PolarHBondContact O-N 3.35Å; R216-R220 WeakPolarHBondContact O-CG 3.23Å; R216-R220 PolarHBondContact O-N 3.49Å
217	A	54.6	Low	52.6	Low	44 Å²	44	118.4 Å²	118.4	36%	0.364	57%	0.57	S	S	.	*	H	α-helix	trans	-64.2	-48.2	178.5	0	0	0	0	0	110.8	E213 L214 L215 Q219 R220 I221	E213-A217 WeakPolarHBondContact O-CB 3.49Å; E213-A217 PolarHBondContact O-N 2.98Å; L214-A217 PolarHBondContact O-N 2.89Å; L215-A217 VanDerWaalsContact C-N 3.33Å; L215-A217 PolarHBondContact O-N 2.97Å; A217-Q219 VanDerWaalsContact C-N 3.34Å; A217-Q219 PolarHBondContact O-N 2.97Å; A217-R220 PolarHBondContact O-N 3.29Å; A217-I221 WeakPolarHBondContact O-CG1 3.3Å; A217-I221 PolarHBondContact O-N 3.13Å
218	N	51	Low	51.6	Low	83 Å²	83	116.9 Å²	116.9	44%	0.444	58%	0.58	S	S	.	*	H	α-helix	trans	-60.6	-42.3	175.3	-69.5	0.1	0	0	0	111.7	L214 L215 R220 I221 V222	L214-N218 VanDerWaalsContact O-CG 3.3Å; L214-N218 PolarHBondContact O-N 2.68Å; L214-N218 PolarHBondContact O-OD1 3.37Å; L215-N218 PolarHBondContact O-N 3.27Å; N218-R220 PolarHBondContact O-N 3.31Å; N218-I221 PolarHBondContact O-N 2.87Å; N218-V222 WeakPolarHBondContact O-CG2 3.42Å; N218-V222 PolarHBondContact O-N 2.81Å
219	Q	55.9	Low	50.3	Low	134 Å²	134	122.3 Å²	122.3	63%	0.626	61%	0.611	S	S	*	*	H	α-helix	trans	-60.4	-44.3	174.6	-76.7	175.6	-27.6	0	0	112.3	L215 R216 A217 I221 V222 S223	L215-Q219 WeakPolarHBondContact O-CB 3.43Å; L215-Q219 WeakPolarHBondContact O-CG 3.44Å; L215-Q219 PolarHBondContact O-N 2.79Å; R216-Q219 PolarHBondContact O-N 3.35Å; A217-Q219 VanDerWaalsContact C-N 3.34Å; A217-Q219 PolarHBondContact O-N 2.97Å; Q219-I221 VanDerWaalsContact C-N 3.34Å; Q219-I221 PolarHBondContact O-N 3.42Å; Q219-V222 PolarHBondContact O-N 2.9Å; Q219-S223 WeakPolarHBondContact O-CB 3.33Å; Q219-S223 PolarHBondContact O-N 2.77Å; Q219-S223 PolarHBondContact O-OG 2.95Å
220	R	53.1	Low	48.5	Very low	169 Å²	169	124.8 Å²	124.8	64%	0.638	62%	0.624	S	S	*	*	H	α-helix	trans	-62.7	-37.8	176	-75.2	172.2	176.4	-179.1	-3	113	R216 A217 N218 V222 S223 N224	R216-R220 WeakPolarHBondContact O-CG 3.23Å; R216-R220 PolarHBondContact O-N 3.49Å; A217-R220 PolarHBondContact O-N 3.29Å; N218-R220 PolarHBondContact O-N 3.31Å; R220-V222 VanDerWaalsContact C-N 3.34Å; R220-S223 PolarHBondContact O-N 2.99Å; R220-S223 PolarHBondContact O-OG 3.04Å; R220-N224 VanDerWaalsContact O-CB 3.25Å; R220-N224 WeakPolarHBondContact O-CB 3.35Å; R220-N224 PolarHBondContact O-N 3.34Å; R220-N224 PolarHBondContact O-OD1 3.37Å
221	I	44.2	Very low	47	Very low	126 Å²	126	123.5 Å²	123.5	65%	0.646	63%	0.631	S	S	*	*	H	α-helix	trans	-64.7	-41.3	175.9	-68	163.3	0	0	0	110.2	A217 N218 Q219	A217-I221 WeakPolarHBondContact O-CG1 3.3Å; A217-I221 PolarHBondContact O-N 3.13Å; N218-I221 PolarHBondContact O-N 2.87Å; Q219-I221 VanDerWaalsContact C-N 3.34Å; Q219-I221 PolarHBondContact O-N 3.42Å
222	V	44.6	Very low	45.4	Very low	116 Å²	116	122.1 Å²	122.1	70%	0.703	64%	0.642	S	S	*	*	H	α-helix	trans	-71	-34.3	176.9	173.9	0	0	0	0	112.4	N218 Q219 R220	N218-V222 WeakPolarHBondContact O-CG2 3.42Å; N218-V222 PolarHBondContact O-N 2.81Å; Q219-V222 PolarHBondContact O-N 2.9Å; R220-V222 VanDerWaalsContact C-N 3.34Å
223	S	43	Very low	43.4	Very low	80 Å²	80	123.3 Å²	123.3	56%	0.559	66%	0.658	S	S	*	*	H	α-helix	trans	-88	-8.6	-178.7	68.4	0	0	0	0	115.2	Q219 R220 S225	Q219-S223 WeakPolarHBondContact O-CB 3.33Å; Q219-S223 PolarHBondContact O-N 2.77Å; Q219-S223 PolarHBondContact O-OG 2.95Å; R220-S223 PolarHBondContact O-N 2.99Å; R220-S223 PolarHBondContact O-OG 3.04Å; S223-S225 VanDerWaalsContact C-N 3.34Å
224	N	39.7	Very low	41.7	Very low	114 Å²	114	127 Å²	127	61%	0.61	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.1	17.7	177	-76.9	9.6	0	0	0	113.2	R220 S226	R220-N224 VanDerWaalsContact O-CB 3.25Å; R220-N224 WeakPolarHBondContact O-CB 3.35Å; R220-N224 PolarHBondContact O-N 3.34Å; R220-N224 PolarHBondContact O-OD1 3.37Å; N224-S226 PolarHBondContact O-N 3.01Å
225	S	31.8	Very low	40	Very low	109 Å²	109	126.9 Å²	126.9	76%	0.762	68%	0.684	S	S	*	*			trans	-75.3	55.2	173.8	65.9	0	0	0	0	112.1	S223	S223-S225 VanDerWaalsContact C-N 3.34Å
226	S	30	Very low	38.2	Very low	95 Å²	95	129.5 Å²	129.5	66%	0.664	70%	0.697	S	S	*	*			trans	-146.3	35.9	-169.2	49.8	0	0	0	0	113.2	N224	N224-S226 PolarHBondContact O-N 3.01Å
227	Y	29.8	Very low	36.4	Very low	226 Å²	226	128.9 Å²	128.9	89%	0.886	71%	0.708	S	S	*	*			trans	-104.7	120.3	158.2	-98.4	-91.9	0	0	0	109.9	L229	Y227-L229 PolarHBondContact O-N 3.27Å
228	S	27.4	Very low	35.2	Very low	111 Å²	111	132.9 Å²	132.9	78%	0.776	72%	0.723	S	S	*	*			trans	-78.4	93.9	-176.5	49.2	0	0	0	0	111.6	N230	S228-N230 PolarHBondContact O-N 3.26Å
229	L	29.4	Very low	34.2	Very low	173 Å²	173	138 Å²	138	91%	0.906	74%	0.744	S	S	*	*			trans	-85.7	65.8	163.8	-98	168.8	0	0	0	110.5	Y227	Y227-L229 PolarHBondContact O-N 3.27Å
230	N	27.2	Very low	32.9	Very low	139 Å²	139	139.5 Å²	139.5	74%	0.743	76%	0.755	S	S	*	*			trans	-147.7	98.1	166.3	-93.2	-15.2	0	0	0	106.5	S228	S228-N230 PolarHBondContact O-N 3.26Å
231	D	30	Very low	31.8	Very low	158 Å²	158	136.9 Å²	136.9	85%	0.845	76%	0.762	S	S	*	*	S	Bend	trans	-172	132.5	141.8	-94.4	-22.9	0	0	0	109.9
232	S	30.7	Very low	30.8	Very low	105 Å²	105	140.6 Å²	140.6	73%	0.734	77%	0.77	S	S	*	*			trans	48.3	77.5	154.8	-53.1	0	0	0	0	119.7	E234	S232-E234 VanDerWaalsContact C-N 3.33Å
233	I	28.2	Very low	30.1	Very low	178 Å²	178	144.1 Å²	144.1	91%	0.913	78%	0.778	S	S	*	*			trans	-94.1	70.9	141.7	-54.4	179.9	0	0	0	107.7
234	E	29.3	Very low	29.3	Very low	175 Å²	175	148.5 Å²	148.5	82%	0.818	79%	0.79	S	S	*	*			trans	-163.9	148.4	165.3	-122.1	167.9	-167.1	0	0	112.1	S232	S232-E234 VanDerWaalsContact C-N 3.33Å
235	S	29.2	Very low	28.9	Very low	104 Å²	104	149 Å²	149	73%	0.727	80%	0.802	S	S	*	*			trans	80	136.1	-179.2	81.4	0	0	0	0	118.4
236	L	28.1	Very low	28.8	Very low	148 Å²	148	151.6 Å²	151.6	78%	0.775	81%	0.806	S	S	*	*			trans	53.1	112.9	169.4	-76.9	72.2	0	0	0	116.3
237	T	28.1	Very low	28.9	Very low	119 Å²	119	152 Å²	152	73%	0.73	81%	0.807	S	S	*	*			cis	55	124.1	22.2	-25.5	0	0	0	0	113.6
238	D	28.1	Very low	28.8	Very low	128 Å²	128	146.4 Å²	146.4	68%	0.684	80%	0.8	S	S	*	*			trans	58.3	94.5	177.9	-54.9	-31.1	0	0	0	116.2
239	H	31.5	Very low	29	Very low	190 Å²	190	146 Å²	146	88%	0.88	80%	0.797	S	S	*	*				-170.3	134.2	96.9	-98.2	-68.2	0	0	0	113.2
240	I	27.1	Very low	28.9	Very low	166 Å²	166	146 Å²	146	85%	0.851	80%	0.797	S	S	*	*			trans	-88.8	130.1	175.3	-63.1	162	0	0	0	109.8
241	S	30.2	Very low	28.9	Very low	114 Å²	114	144.6 Å²	144.6	80%	0.797	80%	0.799	S	S	*	*			trans	-165.1	140.2	139.3	52.3	0	0	0	0	113
242	Y	24.2	Very low	28.8	Very low	204 Å²	204	144.3 Å²	144.3	80%	0.8	80%	0.802	S	S	*	*			trans	-72.3	148	161.5	-92.3	-123.2	0	0	0	109.6
243	H	29.4	Very low	28.7	Very low	190 Å²	190	147.8 Å²	147.8	88%	0.88	81%	0.807	S	S	*	*			trans	-154.1	146.4	132.7	-116.8	-78.2	0	0	0	112.1
244	Q	25.3	Very low	28.5	Very low	172 Å²	172	146.2 Å²	146.2	80%	0.804	80%	0.799	S	S	*	*			trans	-97.3	141.7	-175.5	-59.4	162.3	-48.5	0	0	111.5
245	S	31.2	Very low	28.5	Very low	124 Å²	124	144 Å²	144	87%	0.867	80%	0.8	S	S	*	*			trans	-159.5	83.8	160.7	55.3	0	0	0	0	113.6
246	I	29.8	Very low	28.3	Very low	164 Å²	164	144 Å²	144	84%	0.841	80%	0.8	S	S	*	*			trans	-87	158.3	156.1	-90.8	168.8	0	0	0	106.7
247	P	32.1	Very low	28.4	Very low	105 Å²	105	142.6 Å²	142.6	68%	0.682	80%	0.803	S	S	*	*			cis	-146.2	-165.7	35.4	31.9	-5.4	0	0	0	117.6
248	S	29.5	Very low	28.3	Very low	107 Å²	107	145.2 Å²	145.2	75%	0.748	81%	0.807	S	S	*	*			trans	94	139.1	147.2	-60.6	0	0	0	0	119.1
249	S	30.2	Very low	28.1	Very low	102 Å²	102	145.4 Å²	145.4	71%	0.713	82%	0.817	S	S	*	*			cis	-166.8	140.8	-11.2	46.7	0	0	0	0	112.8
250	L	28	Very low	27.9	Very low	174 Å²	174	144.7 Å²	144.7	91%	0.911	81%	0.814	S	S	*	*			trans	171.1	154.1	135	-94.9	160.2	0	0	0	110.8
251	S	27.3	Very low	27.7	Very low	110 Å²	110	141.3 Å²	141.3	77%	0.769	81%	0.81	S	S	*	*			trans	-147	143.8	-156.4	18.7	0	0	0	0	114.8
252	V	28.6	Very low	27.5	Very low	151 Å²	151	142.6 Å²	142.6	92%	0.915	81%	0.807	S	S	*	*			trans	-141.8	151.6	160.9	-176.3	0	0	0	0	108
253	Q	28.3	Very low	27.4	Very low	178 Å²	178	138.8 Å²	138.8	83%	0.832	81%	0.809	S	S	*	*			trans	-103.9	144.4	-161.7	-72.9	160.7	-100.6	0	0	116.1
254	L	24	Very low	27.3	Very low	145 Å²	145	136.8 Å²	136.8	76%	0.759	80%	0.803	S	S	*	*				6.1	153.8	128.1	-79.3	136.1	0	0	0	119.2
255	P	28.4	Very low	27.3	Very low	130 Å²	130	133.9 Å²	133.9	84%	0.844	80%	0.799	S	S	*	*			cis	-139.1	-177.5	43.8	41.5	-23.2	0	0	0	117.9
256	S	25.6	Very low	26.9	Very low	104 Å²	104	133.8 Å²	133.8	73%	0.727	80%	0.797	S	S	*	*			trans	-121.6	138.3	-169.1	46.3	0	0	0	0	114.2
257	S	29.2	Very low	26.9	Very low	118 Å²	118	133.3 Å²	133.3	83%	0.825	80%	0.796	S	S	*	*			trans	-171.6	142.4	161.8	58.2	0	0	0	0	107.3
258	E	27.5	Very low	26.5	Very low	174 Å²	174	135.4 Å²	135.4	81%	0.813	80%	0.802	S	S	*	*			cis	-135.3	165.2	10.9	-62.1	174.5	111.8	0	0	110.8
259	C	22.8	Very low	26.5	Very low	132 Å²	132	139.5 Å²	139.5	89%	0.892	81%	0.808	S	S	*	*			trans	-123.6	124.5	164.7	-73.1	0	0	0	0	109.3
260	Q	27.1	Very low	26.2	Very low	174 Å²	174	138.7 Å²	138.7	81%	0.813	80%	0.803	S	S	*	*			trans	-132.6	112.9	161.6	-73.6	-165.7	2.3	0	0	109.6
261	A	23.5	Very low	26.1	Very low	95 Å²	95	138.8 Å²	138.8	79%	0.785	80%	0.804	S	S	*	*			trans	-83.8	136.3	167.8	0	0	0	0	0	109.3
262	I	25.3	Very low	25.9	Very low	142 Å²	142	141 Å²	141	73%	0.728	80%	0.801	S	S	*	*			trans	-119.1	100	168.3	-59.4	-179.8	0	0	0	107.6	I264	I262-I264 HydrophobicContact CG2-CG1 4.17Å
263	C	21.7	Very low	25.8	Very low	123 Å²	123	145.1 Å²	145.1	83%	0.831	80%	0.802	S	S	*	*			trans	-77.2	137.7	165.8	-61	0	0	0	0	109.2
264	I	27.9	Very low	25.7	Very low	148 Å²	148	141.6 Å²	141.6	76%	0.759	80%	0.797	S	S	*	*			trans	-120.8	133.7	167.8	-61.5	-178	0	0	0	107.4	I262	I262-I264 HydrophobicContact CG2-CG1 4.17Å
265	P	26.3	Very low	25.7	Very low	112 Å²	112	141.4 Å²	141.4	73%	0.727	80%	0.797	S	S	*	*			trans	-80.5	152.8	-164.6	-12.3	29.7	0	0	0	113.7
266	C	22.8	Very low	25.6	Very low	122 Å²	122	140.7 Å²	140.7	82%	0.824	80%	0.795	S	S	*	*			trans	-62	141.8	159.8	-55.3	0	0	0	0	110.3
267	N	28	Very low	25.6	Very low	154 Å²	154	142.7 Å²	142.7	82%	0.824	80%	0.798	S	S	*	*			trans	-149.8	124.4	158.5	-106.6	-34.2	0	0	0	110.6
268	N	25.2	Very low	25.4	Very low	149 Å²	149	142.5 Å²	142.5	80%	0.797	80%	0.796	S	S	*	*			trans	-76.5	130.7	178.4	-64.4	-41.1	0	0	0	110.3
269	H	28.3	Very low	25.4	Very low	192 Å²	192	141.3 Å²	141.3	89%	0.889	80%	0.795	S	S	*	*			trans	-143.2	120.6	148.3	-88.6	-61.2	0	0	0	111.3
270	S	23.7	Very low	25.6	Very low	86 Å²	86	140.9 Å²	140.9	60%	0.601	79%	0.791	S	S	*	*			trans	-77	136.8	179.4	176.8	0	0	0	0	111.6	H272	S270-H272 PolarHBondContact OG-CD2 2.97Å
271	L	27.2	Very low	25.6	Very low	176 Å²	176	138.4 Å²	138.4	92%	0.921	79%	0.788	S	S	*	*			trans	-134.6	90.9	153.2	-77.1	179.9	0	0	0	109.1
272	H	23	Very low	25.9	Very low	156 Å²	156	142.2 Å²	142.2	72%	0.722	79%	0.791	S	S	*	*			trans	-58.2	134	162.7	-75.5	-94.1	0	0	0	110.4	S270	S270-H272 PolarHBondContact OG-CD2 2.97Å
273	Y	26	Very low	25.9	Very low	238 Å²	238	138.9 Å²	138.9	93%	0.933	78%	0.781	S	S	*	*			trans	-146	144.8	138	-104.6	-74.6	0	0	0	110
274	S	26.4	Very low	26.4	Very low	104 Å²	104	138.4 Å²	138.4	73%	0.727	77%	0.77	S	S	*	*			trans	-97.5	135	-151.5	-56.5	0	0	0	0	115.7
275	N	23.4	Very low	26.6	Very low	140 Å²	140	136.5 Å²	136.5	75%	0.749	77%	0.765	S	S	*	*			trans	33.6	113	138.3	-172.4	9.2	0	0	0	119.4
276	S	26.7	Very low	26.9	Very low	115 Å²	115	135 Å²	135	80%	0.804	75%	0.751	S	S	*	*			trans	-152.2	104.9	140.2	53.2	0	0	0	0	113.3
277	N	24.9	Very low	27.3	Very low	147 Å²	147	133.4 Å²	133.4	79%	0.786	74%	0.741	S	S	*	*			trans	11.8	107.9	159	-65.3	-15.9	0	0	0	119.9
278	S	25.9	Very low	27.5	Very low	113 Å²	113	131.1 Å²	131.1	79%	0.79	73%	0.733	S	S	*	*				179.7	118.9	117.4	47.6	0	0	0	0	112.4
279	N	26.5	Very low	27.8	Very low	149 Å²	149	129 Å²	129	80%	0.797	72%	0.72	S	S	*	*			trans	-147.7	108.5	169.4	-107.6	-14.4	0	0	0	110.5	T281	N279-T281 VanDerWaalsContact C-N 3.34Å; N279-T281 PolarHBondContact O-N 3.21Å
280	P	26.7	Very low	27.9	Very low	123 Å²	123	128.2 Å²	128.2	80%	0.799	71%	0.71	S	S	*	*			trans	-92.9	60.1	173.4	36.6	-33	0	0	0	111	M282	P280-M282 PolarHBondContact O-N 3.35Å
281	T	28.8	Very low	28.2	Very low	122 Å²	122	135 Å²	135	75%	0.748	72%	0.724	S	S	*	*			trans	-72.9	89.3	175.6	-2.8	0	0	0	0	110	N279 S283	N279-T281 VanDerWaalsContact C-N 3.34Å; N279-T281 PolarHBondContact O-N 3.21Å; T281-S283 PolarHBondContact O-N 3.2Å
282	M	28.2	Very low	28.3	Very low	175 Å²	175	131.6 Å²	131.6	86%	0.862	71%	0.713	S	S	*	*			trans	-61.6	99.1	175.7	-82.1	-77.6	-168.1	0	0	111.2	P280 L284	P280-M282 PolarHBondContact O-N 3.35Å; M282-L284 PolarHBondContact O-N 2.97Å
283	S	25.8	Very low	28.5	Very low	73 Å²	73	129.3 Å²	129.3	51%	0.51	71%	0.71	S	S	.	*			trans	-67.2	119.1	172.8	52.7	0	0	0	0	110.2	T281 T285	T281-S283 PolarHBondContact O-N 3.2Å; S283-T285 PolarHBondContact O-N 2.95Å
284	L	32.3	Very low	28.7	Very low	113 Å²	113	123.5 Å²	123.5	59%	0.592	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.1	-3.6	-173.5	-76.1	175.3	0	0	0	114.6	M282	M282-L284 PolarHBondContact O-N 2.97Å
285	T	32.6	Very low	29	Very low	107 Å²	107	126.9 Å²	126.9	66%	0.656	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.3	-31.2	176.5	43	0	0	0	0	113.2	S283 S287	S283-T285 PolarHBondContact O-N 2.95Å; T285-S287 PolarHBondContact O-N 3.16Å
286	D	31.8	Very low	29.4	Very low	80 Å²	80	129.2 Å²	129.2	43%	0.428	71%	0.712	S	S	.	*	T	Hydrogen-bonded Turn	trans	-88.9	-1.5	-154.4	-157.8	58.1	0	0	0	115.6	R290	D286-R290 VanDerWaalsContact O-CD 3.28Å; D286-R290 WeakPolarHBondContact O-CD 3.23Å; D286-R290 WeakPolarHBondContact O-CG 3.37Å; D286-R290 PolarHBondContact O-NE 3.41Å; D286-R290 IonicContact OD1-NH2 3.24Å; D286-R290 IonicContact OD2-CZ 3.56Å; D286-R290 IonicContact OD2-NE 3.82Å; D286-R290 PolarHBondContact OD2-NE 2.86Å; D286-R290 IonicContact OD2-NH2 2.75Å; D286-R290 PolarHBondContact OD2-NH2 3.2Å
287	S	32.3	Very low	29.8	Very low	89 Å²	89	129.2 Å²	129.2	62%	0.622	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.3	0.7	-172	48.1	0	0	0	0	115.2	T285	T285-S287 PolarHBondContact O-N 3.16Å
288	V	31.8	Very low	30.1	Very low	107 Å²	107	124.9 Å²	124.9	65%	0.648	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.6	-25.8	179.1	-177.5	0	0	0	0	112.6
289	L	31.1	Very low	30.8	Very low	103 Å²	103	123.2 Å²	123.2	54%	0.539	67%	0.674	S	S	.	*	S	Bend	trans	-97	-11.1	-176.8	-70.1	171	0	0	0	115.1	Y291 C292	L289-Y291 PolarHBondContact O-N 3.03Å; L289-C292 PolarHBondContact O-N 3.36Å
290	R	30.1	Very low	31.1	Very low	176 Å²	176	123.4 Å²	123.4	66%	0.664	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.2	4.3	-179.4	-72.1	-175.6	-178.6	-119.6	6.4	115.4	D286	D286-R290 VanDerWaalsContact O-CD 3.28Å; D286-R290 WeakPolarHBondContact O-CD 3.23Å; D286-R290 WeakPolarHBondContact O-CG 3.37Å; D286-R290 PolarHBondContact O-NE 3.41Å; D286-R290 IonicContact OD1-NH2 3.24Å; D286-R290 IonicContact OD2-CZ 3.56Å; D286-R290 IonicContact OD2-NE 3.82Å; D286-R290 PolarHBondContact OD2-NE 2.86Å; D286-R290 IonicContact OD2-NH2 2.75Å; D286-R290 PolarHBondContact OD2-NH2 3.2Å
291	Y	30.4	Very low	31.6	Very low	228 Å²	228	123.4 Å²	123.4	89%	0.894	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.9	-4.1	175.4	-121.4	-80.9	0	0	0	114.2	L289	L289-Y291 PolarHBondContact O-N 3.03Å
292	C	29	Very low	31.9	Very low	105 Å²	105	124.3 Å²	124.3	71%	0.709	67%	0.67	S	S	*	*	S	Bend	trans	-126	16.1	-177.4	-61.2	0	0	0	0	113.9	L289	L289-C292 PolarHBondContact O-N 3.36Å
293	V	28.1	Very low	32.1	Very low	108 Å²	108	122.1 Å²	122.1	66%	0.655	66%	0.662	S	S	*	*			trans	-120.1	99.8	177.1	-176.9	0	0	0	0	108.7	E295	V293-E295 PolarHBondContact O-N 2.65Å
294	S	30.6	Very low	32.5	Very low	116 Å²	116	124 Å²	124	81%	0.811	67%	0.672	S	S	*	*			trans	-65	123.9	163.9	-67.1	0	0	0	0	108.6	K296	S294-K296 PolarHBondContact O-N 2.97Å
295	E	32	Very low	32.7	Very low	175 Å²	175	123.9 Å²	123.9	82%	0.818	67%	0.672	S	S	*	*			trans	-61.6	128.3	176.3	-64.1	-178.8	136.5	0	0	109.4	V293 S297	V293-E295 PolarHBondContact O-N 2.65Å; E295-S297 PolarHBondContact O-N 3.1Å
296	K	31.8	Very low	32.8	Very low	190 Å²	190	125.7 Å²	125.7	83%	0.826	68%	0.678	S	S	*	*			trans	-74.3	72.8	177.6	-72.8	-179.7	177.1	173.5	0	110.7	S294	S294-K296 PolarHBondContact O-N 2.97Å
297	S	34.4	Very low	33	Very low	114 Å²	114	131.4 Å²	131.4	80%	0.797	70%	0.695	S	S	*	*			trans	-63.3	137	158.5	53.9	0	0	0	0	108.6	E295	E295-S297 PolarHBondContact O-N 3.1Å
298	N	32.7	Very low	33.3	Very low	57 Å²	57	131 Å²	131	31%	0.305	69%	0.692	S	S	.	*			trans	-133.3	110	-175.2	-95.3	104.8	0	0	0	109.8	R66	R66-N298 HydrophobicContact CG-CB 4.17Å; R66-N298 VanDerWaalsContact CZ-CG 3.43Å; R66-N298 PolarHBondContact NE-OD1 3.41Å; R66-N298 VanDerWaalsContact NH2-CG 3.27Å; R66-N298 PolarHBondContact NH2-OD1 3.02Å
299	T	38.9	Very low	33.9	Very low	77 Å²	77	134.2 Å²	134.2	47%	0.472	71%	0.705	S	S	.	*			trans	-154.7	143.7	132	26.1	0	0	0	0	108.3	E69 E301	E69-T299 HydrophobicContact CG-CG2 3.8Å; T299-E301 PolarHBondContact O-N 2.96Å
300	D	34.6	Very low	34.6	Very low	153 Å²	153	133.9 Å²	133.9	82%	0.818	71%	0.711	S	S	*	*			trans	-74.1	119	-177.1	-56.6	-95.5	0	0	0	111.8
301	E	36.8	Very low	35.4	Very low	123 Å²	123	126.7 Å²	126.7	58%	0.575	69%	0.687	S	S	*	*			trans	-160.3	95.2	143.3	-123.3	175.2	-154.7	0	0	111.5	N71 H72 T299 N303	N71-E301 WeakPolarHBondContact ND2-CB 3.2Å; N71-E301 PolarHBondContact ND2-OE2 3.47Å; H72-E301 IonicContact CE1-OE2 2.69Å; T299-E301 PolarHBondContact O-N 2.96Å; E301-N303 PolarHBondContact O-N 3.09Å
302	T	34.5	Very low	36.4	Very low	141 Å²	141	122.2 Å²	122.2	87%	0.865	69%	0.687	S	S	*	*			trans	5.9	88.3	162.2	-45.2	0	0	0	0	118
303	N	33.6	Very low	38.1	Very low	130 Å²	130	120.2 Å²	120.2	70%	0.695	67%	0.673	S	S	*	*			trans	-119.5	100.7	162.8	-168.7	-1.7	0	0	0	110.5	E301 N305	E301-N303 PolarHBondContact O-N 3.09Å; N303-N305 PolarHBondContact O-N 3.46Å
304	P	34.1	Very low	39.4	Very low	112 Å²	112	118.4 Å²	118.4	73%	0.727	68%	0.676	S	S	*	*	S	Bend	trans	-81.2	54.7	-172.3	35.1	-37.2	0	0	0	112.8
305	N	36.3	Very low	40.8	Very low	111 Å²	111	116.4 Å²	116.4	59%	0.594	66%	0.656	S	S	*	*			trans	-141.6	42.8	164.8	-86.7	-59.1	0	0	0	110.2	N303 Y307	N303-N305 PolarHBondContact O-N 3.46Å; N305-Y307 WeakPolarHBondContact O-CD2 3.41Å; N305-Y307 PolarHBondContact O-N 3.31Å
306	D	34.4	Very low	41.8	Very low	145 Å²	145	113 Å²	113	78%	0.775	65%	0.649	S	S	*	*			trans	-62.6	101.2	162.9	-128.2	-15.1	0	0	0	107.8	S308	D306-S308 PolarHBondContact O-N 3.49Å; D306-S308 PolarHBondContact O-OG 3.44Å
307	Y	36.3	Very low	43	Very low	199 Å²	199	112.2 Å²	112.2	78%	0.78	65%	0.649	S	S	*	*			trans	-70.8	52.1	168.4	-64.3	-80	0	0	0	110.5	N305 L309	N305-Y307 WeakPolarHBondContact O-CD2 3.41Å; N305-Y307 PolarHBondContact O-N 3.31Å; Y307-L309 PolarHBondContact O-N 3.19Å
308	S	38.6	Very low	44.2	Very low	81 Å²	81	110.4 Å²	110.4	57%	0.566	64%	0.636	S	S	*	*			trans	-43.2	130.9	149.2	61	0	0	0	0	108	D306 S310	D306-S308 PolarHBondContact O-N 3.49Å; D306-S308 PolarHBondContact O-OG 3.44Å; S308-S310 PolarHBondContact O-N 3.15Å
309	L	44.5	Very low	45.3	Very low	174 Å²	174	107.8 Å²	107.8	91%	0.911	62%	0.622	S	S	*	*			trans	-73.7	67.4	170.4	-85.7	72.8	0	0	0	108.3	Y307 C311	Y307-L309 PolarHBondContact O-N 3.19Å; L309-C311 PolarHBondContact O-N 3.33Å; L309-C311 VanDerWaalsContact O-N 3.17Å
310	S	45.2	Very low	46.1	Very low	97 Å²	97	108.5 Å²	108.5	68%	0.678	63%	0.628	S	S	*	*			trans	-48.6	122.5	160.3	60.4	0	0	0	0	107	S308	S308-S310 PolarHBondContact O-N 3.15Å
311	C	46.3	Very low	47.2	Very low	24 Å²	24	106.8 Å²	106.8	16%	0.162	62%	0.618	C	S	.	*			trans	-52.9	140.5	-174.7	178.3	0	0	0	0	109.9	L309 C313 G314 C319	L309-C311 PolarHBondContact O-N 3.33Å; L309-C311 VanDerWaalsContact O-N 3.17Å; C311-C313 HydrophobicContact CB-CB 4.3Å; C311-C313 WeakPolarHBondContact CB-SG 3.49Å; C311-C313 PolarHBondContact O-N 3.32Å; C311-C313 WeakPolarHBondContact SG-CB 3.41Å; C311-C313 PolarHBondContact SG-N 3.42Å; C311-C313 CovalentContact SG-SG 2.05Å; C311-C313 PolarHBondContact SG-SG 3.39Å; C311-G314 PolarHBondContact O-N 2.96Å; C311-C319 HydrophobicContact CB-CB 4.04Å; C311-C319 WeakPolarHBondContact CB-SG 3.38Å; C311-C319 PolarHBondContact SG-SG 2.86Å
312	P	52.6	Low	48.5	Very low	135 Å²	135	101.9 Å²	101.9	88%	0.877	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.8	-10.9	169	23.3	-34.4	0	0	0	113.7
313	C	63.2	Low	50	Low	63 Å²	63	102.7 Å²	102.7	43%	0.426	59%	0.592	S	S	.	*	T	Hydrogen-bonded Turn	trans	-90.1	1.7	172.7	65.3	0	0	0	0	115.5	C311 N315 C319	C311-C313 HydrophobicContact CB-CB 4.3Å; C311-C313 WeakPolarHBondContact CB-SG 3.49Å; C311-C313 PolarHBondContact O-N 3.32Å; C311-C313 WeakPolarHBondContact SG-CB 3.41Å; C311-C313 PolarHBondContact SG-N 3.42Å; C311-C313 CovalentContact SG-SG 2.05Å; C311-C313 PolarHBondContact SG-SG 3.39Å; C313-N315 PolarHBondContact O-N 2.87Å; C313-C319 WeakPolarHBondContact SG-CB 3.47Å; C313-C319 VanDerWaalsContact SG-SG 3.62Å
314	G	56.7	Low	51.3	Low	70 Å²	70	102.7 Å²	102.7	72%	0.722	59%	0.587	S	S	*	*	S	Bend	trans	67.8	-14.8	170.8	0	0	0	0	0	118.1	C311	C311-G314 PolarHBondContact O-N 2.96Å
315	N	58.9	Low	52.7	Low	74 Å²	74	100.4 Å²	100.4	40%	0.396	57%	0.566	S	S	.	*			trans	-117.6	106.1	-174.3	-178.5	-31.5	0	0	0	111.2	C313 Q317 S318 C319	C313-N315 PolarHBondContact O-N 2.87Å; N315-Q317 VanDerWaalsContact C-N 3.27Å; N315-Q317 PolarHBondContact O-N 3.19Å; N315-Q317 PolarHBondContact OD1-N 3.49Å; N315-Q317 VanDerWaalsContact OD1-N 3.08Å; N315-S318 WeakPolarHBondContact CB-OG 3.44Å; N315-S318 PolarHBondContact ND2-OG 2.88Å; N315-S318 PolarHBondContact OD1-N 3.36Å; N315-S318 VanDerWaalsContact OD1-N 3.1Å; N315-S318 PolarHBondContact OD1-OG 3.39Å; N315-C319 WeakPolarHBondContact O-CB 3.37Å; N315-C319 PolarHBondContact O-N 3.3Å; N315-C319 VanDerWaalsContact O-N 3.08Å
316	P	53.4	Low	54	Low	103 Å²	103	98.5 Å²	98.5	67%	0.669	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.3	-30.2	-175.9	-26.8	35.4	0	0	0	115.3	S322	P316-S322 WeakPolarHBondContact O-CB 3.3Å
317	Q	57.6	Low	55.5	Low	174 Å²	174	96.3 Å²	96.3	81%	0.813	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-43.4	-173.9	-64.7	-175.5	-6	0	0	112.4	N315 K325	N315-Q317 VanDerWaalsContact C-N 3.27Å; N315-Q317 PolarHBondContact O-N 3.19Å; N315-Q317 PolarHBondContact OD1-N 3.49Å; N315-Q317 VanDerWaalsContact OD1-N 3.08Å; Q317-K325 PolarHBondContact O-NZ 3Å
318	S	59.2	Low	56.7	Low	76 Å²	76	95.1 Å²	95.1	53%	0.531	53%	0.534	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-30.8	177.7	69	0	0	0	0	112.5	N315 K325	N315-S318 WeakPolarHBondContact CB-OG 3.44Å; N315-S318 PolarHBondContact ND2-OG 2.88Å; N315-S318 PolarHBondContact OD1-N 3.36Å; N315-S318 VanDerWaalsContact OD1-N 3.1Å; N315-S318 PolarHBondContact OD1-OG 3.39Å; S318-K325 PolarHBondContact O-NZ 3.4Å
319	C	55.2	Low	57.8	Low	2 Å²	2	95.3 Å²	95.3	1%	0.014	53%	0.528	C	S	.	.			trans	-39.6	124.2	179.2	175.2	0	0	0	0	114.4	C311 C313 N315 L321 S322 K325	C311-C319 HydrophobicContact CB-CB 4.04Å; C311-C319 WeakPolarHBondContact CB-SG 3.38Å; C311-C319 PolarHBondContact SG-SG 2.86Å; C313-C319 WeakPolarHBondContact SG-CB 3.47Å; C313-C319 VanDerWaalsContact SG-SG 3.62Å; N315-C319 WeakPolarHBondContact O-CB 3.37Å; N315-C319 PolarHBondContact O-N 3.3Å; N315-C319 VanDerWaalsContact O-N 3.08Å; C319-L321 PolarHBondContact SG-N 3.12Å; C319-S322 PolarHBondContact O-OG 3.39Å; C319-S322 PolarHBondContact SG-N 2.98Å; C319-K325 VanDerWaalsContact O-CD 3.28Å; C319-K325 WeakPolarHBondContact O-CD 3.17Å; C319-K325 WeakPolarHBondContact O-CE 3.27Å; C319-K325 PolarHBondContact O-NZ 3.4Å
320	P	56.9	Low	58.7	Low	91 Å²	91	89.3 Å²	89.3	59%	0.591	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-23.8	174.1	30.1	-34.2	0	0	0	113.2
321	L	58.1	Low	59.8	Low	117 Å²	117	91.4 Å²	91.4	61%	0.613	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.2	22.4	177.2	-60.6	175	0	0	0	112.7	C319 I326	C319-L321 PolarHBondContact SG-N 3.12Å; L321-I326 HydrophobicContact CB-CD1 4.36Å; L321-I326 VanDerWaalsContact O-CD1 3.23Å; L321-I326 WeakPolarHBondContact O-CD1 3.4Å
322	S	63.1	Low	60.7	Low	21 Å²	21	93.4 Å²	93.4	15%	0.147	51%	0.506	C	S	.	.			trans	-70.7	142.7	178.8	39.1	0	0	0	0	108.4	P316 C319 Q324 K325 I326	P316-S322 WeakPolarHBondContact O-CB 3.3Å; C319-S322 PolarHBondContact O-OG 3.39Å; C319-S322 PolarHBondContact SG-N 2.98Å; S322-Q324 PolarHBondContact O-N 3.1Å; S322-Q324 VanDerWaalsContact O-N 3.1Å; S322-K325 CarbonylContact O-C 3.55Å; S322-K325 WeakPolarHBondContact O-CA 3.04Å; S322-K325 PolarHBondContact O-N 2.77Å; S322-K325 WeakPolarHBondContact OG-CD 3.33Å; S322-K325 WeakPolarHBondContact OG-CE 3.28Å; S322-K325 VanDerWaalsContact OG-CG 3.31Å; S322-K325 WeakPolarHBondContact OG-CG 3.44Å; S322-I326 PolarHBondContact O-N 3.15Å
323	E	66.3	Low	61.1	Low	158 Å²	158	91.4 Å²	91.4	74%	0.738	49%	0.494	S	S	*	.	H	α-helix	trans	-51.4	-42	-174	-167.9	179	-171.4	0	0	112.1	K325 I326 E327	E323-K325 PolarHBondContact O-N 3.22Å; E323-I326 PolarHBondContact O-N 3.13Å; E323-E327 WeakPolarHBondContact O-CB 3.43Å; E323-E327 PolarHBondContact O-N 2.97Å
324	Q	60.7	Low	61	Low	129 Å²	129	93.1 Å²	93.1	60%	0.603	51%	0.505	S	S	*	.	H	α-helix	trans	-64.2	-33.8	174.2	-62.7	-176.7	1.8	0	0	114.4	S322 R328	S322-Q324 PolarHBondContact O-N 3.1Å; S322-Q324 VanDerWaalsContact O-N 3.1Å; Q324-R328 WeakPolarHBondContact O-CB 3.34Å; Q324-R328 WeakPolarHBondContact O-CD 3.44Å; Q324-R328 WeakPolarHBondContact O-CG 3.44Å; Q324-R328 PolarHBondContact O-N 3.43Å
325	K	63.1	Low	61.3	Low	64 Å²	64	92.2 Å²	92.2	28%	0.278	48%	0.483	S	S	.	.	H	α-helix	trans	-79.2	-37.4	175.3	-68.8	-176.1	-154.2	163.7	0	111.2	Q317 S318 C319 S322 E323 E327 R328 L329	Q317-K325 PolarHBondContact O-NZ 3Å; S318-K325 PolarHBondContact O-NZ 3.4Å; C319-K325 VanDerWaalsContact O-CD 3.28Å; C319-K325 WeakPolarHBondContact O-CD 3.17Å; C319-K325 WeakPolarHBondContact O-CE 3.27Å; C319-K325 PolarHBondContact O-NZ 3.4Å; S322-K325 CarbonylContact O-C 3.55Å; S322-K325 WeakPolarHBondContact O-CA 3.04Å; S322-K325 PolarHBondContact O-N 2.77Å; S322-K325 WeakPolarHBondContact OG-CD 3.33Å; S322-K325 WeakPolarHBondContact OG-CE 3.28Å; S322-K325 VanDerWaalsContact OG-CG 3.31Å; S322-K325 WeakPolarHBondContact OG-CG 3.44Å; E323-K325 PolarHBondContact O-N 3.22Å; K325-E327 VanDerWaalsContact C-N 3.33Å; K325-R328 PolarHBondContact O-N 3.18Å; K325-L329 WeakPolarHBondContact O-CB 3.28Å; K325-L329 WeakPolarHBondContact O-CD1 3.26Å; K325-L329 WeakPolarHBondContact O-CG 3.43Å; K325-L329 PolarHBondContact O-N 3.25Å
326	I	63.9	Low	61.3	Low	72 Å²	72	92.6 Å²	92.6	37%	0.369	48%	0.484	S	S	.	.	H	α-helix	trans	-58.7	-47.5	169.9	-66.2	176.2	0	0	0	109.5	L321 S322 E323 R328 L329 C330	L321-I326 HydrophobicContact CB-CD1 4.36Å; L321-I326 VanDerWaalsContact O-CD1 3.23Å; L321-I326 WeakPolarHBondContact O-CD1 3.4Å; S322-I326 PolarHBondContact O-N 3.15Å; E323-I326 PolarHBondContact O-N 3.13Å; I326-R328 PolarHBondContact O-N 2.91Å; I326-L329 PolarHBondContact O-N 3.19Å; I326-C330 WeakPolarHBondContact O-CB 3.41Å; I326-C330 PolarHBondContact O-N 3.5Å; I326-C330 PolarHBondContact O-SG 2.82Å; I326-C330 VanDerWaalsContact O-SG 3.34Å
327	E	65.5	Low	61.6	Low	99 Å²	99	93.4 Å²	93.4	46%	0.463	48%	0.479	S	S	.	.	H	α-helix	trans	-61.4	-44.4	177.3	-165.2	-166.3	-175.9	0	0	112	E323 K325 L329 C330 K331	E323-E327 WeakPolarHBondContact O-CB 3.43Å; E323-E327 PolarHBondContact O-N 2.97Å; K325-E327 VanDerWaalsContact C-N 3.33Å; E327-L329 VanDerWaalsContact C-N 3.33Å; E327-L329 PolarHBondContact O-N 3.03Å; E327-C330 PolarHBondContact O-N 3.46Å; E327-K331 HydrophobicContact CG-CD 4.14Å; E327-K331 WeakPolarHBondContact O-CB 3.34Å; E327-K331 WeakPolarHBondContact O-CG 3.38Å; E327-K331 PolarHBondContact O-N 3.47Å; E327-K331 VanDerWaalsContact OE1-CE 3.29Å; E327-K331 WeakPolarHBondContact OE1-CE 3.35Å; E327-K331 IonicContact OE1-NZ 3.29Å; E327-K331 PolarHBondContact OE1-NZ 3.16Å
328	R	62.6	Low	61.5	Low	174 Å²	174	86.8 Å²	86.8	66%	0.657	46%	0.458	S	S	*	.	H	α-helix	trans	-63.3	-35.4	174.7	-73.9	168.4	-172	175.9	5.4	112.9	Q324 K325 I326 N332	Q324-R328 WeakPolarHBondContact O-CB 3.34Å; Q324-R328 WeakPolarHBondContact O-CD 3.44Å; Q324-R328 WeakPolarHBondContact O-CG 3.44Å; Q324-R328 PolarHBondContact O-N 3.43Å; K325-R328 PolarHBondContact O-N 3.18Å; I326-R328 PolarHBondContact O-N 2.91Å; R328-N332 PolarHBondContact O-N 3.27Å
329	L	62	Low	61.8	Low	84 Å²	84	89.4 Å²	89.4	44%	0.44	46%	0.459	S	S	.	.	H	α-helix	trans	-71.2	-43.7	174.2	-70.3	164.9	0	0	0	111	K325 I326 E327 K331 N332 I335	K325-L329 WeakPolarHBondContact O-CB 3.28Å; K325-L329 WeakPolarHBondContact O-CD1 3.26Å; K325-L329 WeakPolarHBondContact O-CG 3.43Å; K325-L329 PolarHBondContact O-N 3.25Å; I326-L329 PolarHBondContact O-N 3.19Å; E327-L329 VanDerWaalsContact C-N 3.33Å; E327-L329 PolarHBondContact O-N 3.03Å; L329-K331 VanDerWaalsContact C-N 3.28Å; L329-K331 PolarHBondContact O-N 2.86Å; L329-N332 VanDerWaalsContact O-CB 3.3Å; L329-N332 WeakPolarHBondContact O-CB 3.48Å; L329-N332 PolarHBondContact O-N 3.27Å; L329-N332 VanDerWaalsContact O-N 3.1Å; L329-I335 HydrophobicContact CB-CD1 3.93Å; L329-I335 HydrophobicContact CD2-CD1 3.44Å; L329-I335 VanDerWaalsContact CD2-CD1 3.44Å; L329-I335 HydrophobicContact CG-CD1 4.3Å; L329-I335 WeakPolarHBondContact O-CB 3.3Å; L329-I335 WeakPolarHBondContact O-CG2 3.41Å
330	C	62.1	Low	62	Low	49 Å²	49	93.2 Å²	93.2	33%	0.331	48%	0.483	S	S	.	.	H	α-helix	trans	-67.6	-25.2	176.3	-71.6	0	0	0	0	113.3	I326 E327 I336	I326-C330 WeakPolarHBondContact O-CB 3.41Å; I326-C330 PolarHBondContact O-N 3.5Å; I326-C330 PolarHBondContact O-SG 2.82Å; I326-C330 VanDerWaalsContact O-SG 3.34Å; E327-C330 PolarHBondContact O-N 3.46Å; C330-I336 WeakPolarHBondContact O-CD1 3.46Å; C330-I336 WeakPolarHBondContact O-CG1 3.4Å
331	K	69.3	Low	62.2	Low	141 Å²	141	93.1 Å²	93.1	61%	0.613	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-8.4	171.2	-73.4	175.2	173.9	174.9	0	113.6	E327 L329	E327-K331 HydrophobicContact CG-CD 4.14Å; E327-K331 WeakPolarHBondContact O-CB 3.34Å; E327-K331 WeakPolarHBondContact O-CG 3.38Å; E327-K331 PolarHBondContact O-N 3.47Å; E327-K331 VanDerWaalsContact OE1-CE 3.29Å; E327-K331 WeakPolarHBondContact OE1-CE 3.35Å; E327-K331 IonicContact OE1-NZ 3.29Å; E327-K331 PolarHBondContact OE1-NZ 3.16Å; L329-K331 VanDerWaalsContact C-N 3.28Å; L329-K331 PolarHBondContact O-N 2.86Å
332	N	64	Low	62.3	Low	65 Å²	65	91.5 Å²	91.5	35%	0.348	47%	0.468	S	S	.	.			trans	-74.9	122.3	179.2	-176	-57.4	0	0	0	110.4	R328 L329 C334 I335 I336	R328-N332 PolarHBondContact O-N 3.27Å; L329-N332 VanDerWaalsContact O-CB 3.3Å; L329-N332 WeakPolarHBondContact O-CB 3.48Å; L329-N332 PolarHBondContact O-N 3.27Å; L329-N332 VanDerWaalsContact O-N 3.1Å; N332-C334 VanDerWaalsContact C-N 3.28Å; N332-C334 PolarHBondContact O-N 2.93Å; N332-C334 WeakPolarHBondContact OD1-CB 3.42Å; N332-C334 PolarHBondContact OD1-N 3.24Å; N332-I335 HydrophobicContact CB-CB 4.21Å; N332-I335 HydrophobicContact CB-CD1 4.07Å; N332-I335 HydrophobicContact CB-CG1 4.14Å; N332-I335 PolarHBondContact O-N 3.36Å; N332-I336 WeakPolarHBondContact O-CG1 3.48Å; N332-I336 PolarHBondContact O-N 3.23Å
333	P	62.2	Low	62.2	Low	94 Å²	94	92.8 Å²	92.8	61%	0.61	48%	0.477	S	S	*	.	H	α-helix	trans	-62.3	-32.7	-173.5	24.2	-34.1	0	0	0	113.2	I335 H337	P333-I335 VanDerWaalsContact C-N 3.32Å; P333-I335 PolarHBondContact O-N 2.84Å; P333-H337 WeakPolarHBondContact O-CB 3.43Å; P333-H337 PolarHBondContact O-N 3.29Å
334	C	60.9	Low	61.8	Low	98 Å²	98	87.7 Å²	87.7	66%	0.662	46%	0.462	S	S	*	.	H	α-helix	trans	-67	-34.6	176.6	-59.8	0	0	0	0	111.9	N332 G338	N332-C334 VanDerWaalsContact C-N 3.28Å; N332-C334 PolarHBondContact O-N 2.93Å; N332-C334 WeakPolarHBondContact OD1-CB 3.42Å; N332-C334 PolarHBondContact OD1-N 3.24Å; C334-G338 PolarHBondContact O-N 2.9Å
335	I	61.8	Low	61.7	Low	51 Å²	51	85.7 Å²	85.7	26%	0.262	46%	0.459	S	S	.	.	H	α-helix	trans	-76	-44.6	177.7	-64.7	-179.6	0	0	0	110.3	L329 N332 P333 H337 G338 F339	L329-I335 HydrophobicContact CB-CD1 3.93Å; L329-I335 HydrophobicContact CD2-CD1 3.44Å; L329-I335 VanDerWaalsContact CD2-CD1 3.44Å; L329-I335 HydrophobicContact CG-CD1 4.3Å; L329-I335 WeakPolarHBondContact O-CB 3.3Å; L329-I335 WeakPolarHBondContact O-CG2 3.41Å; N332-I335 HydrophobicContact CB-CB 4.21Å; N332-I335 HydrophobicContact CB-CD1 4.07Å; N332-I335 HydrophobicContact CB-CG1 4.14Å; N332-I335 PolarHBondContact O-N 3.36Å; P333-I335 VanDerWaalsContact C-N 3.32Å; P333-I335 PolarHBondContact O-N 2.84Å; I335-H337 VanDerWaalsContact C-N 3.3Å; I335-H337 PolarHBondContact O-N 3.46Å; I335-G338 PolarHBondContact O-N 3.29Å; I335-F339 HydrophobicContact CG2-CD2 3.73Å; I335-F339 HydrophobicContact CG2-CE2 3.81Å; I335-F339 WeakPolarHBondContact O-CD2 3.43Å; I335-F339 PolarHBondContact O-N 3.47Å
336	I	58.9	Low	61.8	Low	82 Å²	82	88.9 Å²	88.9	42%	0.421	47%	0.473	S	S	.	.	H	α-helix	trans	-55.2	-47.6	172.1	-62.8	167.5	0	0	0	110.2	C330 N332 F339 T340	C330-I336 WeakPolarHBondContact O-CD1 3.46Å; C330-I336 WeakPolarHBondContact O-CG1 3.4Å; N332-I336 WeakPolarHBondContact O-CG1 3.48Å; N332-I336 PolarHBondContact O-N 3.23Å; I336-F339 PolarHBondContact O-N 3.34Å; I336-T340 VanDerWaalsContact O-CB 3.32Å; I336-T340 WeakPolarHBondContact O-CB 3.35Å; I336-T340 PolarHBondContact O-N 3.33Å; I336-T340 PolarHBondContact O-OG1 2.93Å
337	H	59.7	Low	62	Low	121 Å²	121	91 Å²	91	56%	0.56	48%	0.476	S	S	*	.	H	α-helix	trans	-63.9	-43.5	178.9	-171.1	73.2	0	0	0	111.8	P333 I335 T340 I341	P333-H337 WeakPolarHBondContact O-CB 3.43Å; P333-H337 PolarHBondContact O-N 3.29Å; I335-H337 VanDerWaalsContact C-N 3.3Å; I335-H337 PolarHBondContact O-N 3.46Å; H337-T340 WeakPolarHBondContact O-CB 3.34Å; H337-T340 PolarHBondContact O-N 2.74Å; H337-I341 WeakPolarHBondContact NE2-CD1 3.4Å; H337-I341 WeakPolarHBondContact O-CG1 3.46Å; H337-I341 PolarHBondContact O-N 3.3Å
338	G	56.9	Low	62	Low	35 Å²	35	86.4 Å²	86.4	36%	0.361	46%	0.455	S	S	.	.	H	α-helix	trans	-58.6	-48.6	174.3	0	0	0	0	0	113.3	C334 I335 T340 I341 L342	C334-G338 PolarHBondContact O-N 2.9Å; I335-G338 PolarHBondContact O-N 3.29Å; G338-T340 VanDerWaalsContact C-N 3.31Å; G338-T340 PolarHBondContact O-N 2.82Å; G338-I341 PolarHBondContact O-N 3.1Å; G338-L342 VanDerWaalsContact O-CB 3.29Å; G338-L342 WeakPolarHBondContact O-CB 3.27Å; G338-L342 PolarHBondContact O-N 2.88Å
339	F	64	Low	62.4	Low	130 Å²	130	85 Å²	85	57%	0.57	45%	0.449	S	S	*	.	H	α-helix	trans	-65.3	-32.6	174.7	-86.3	-73.7	0	0	0	112.8	I335 I336 S343	I335-F339 HydrophobicContact CG2-CD2 3.73Å; I335-F339 HydrophobicContact CG2-CE2 3.81Å; I335-F339 WeakPolarHBondContact O-CD2 3.43Å; I335-F339 PolarHBondContact O-N 3.47Å; I336-F339 PolarHBondContact O-N 3.34Å; F339-S343 WeakPolarHBondContact O-CB 3.44Å; F339-S343 PolarHBondContact O-N 2.76Å; F339-S343 PolarHBondContact O-OG 3.09Å
340	T	59.4	Low	62.9	Low	83 Å²	83	82.4 Å²	82.4	51%	0.509	44%	0.436	S	S	.	.	H	α-helix	trans	-66.9	-47.8	175.6	-60	0	0	0	0	111.1	I336 H337 G338 S343 A344	I336-T340 VanDerWaalsContact O-CB 3.32Å; I336-T340 WeakPolarHBondContact O-CB 3.35Å; I336-T340 PolarHBondContact O-N 3.33Å; I336-T340 PolarHBondContact O-OG1 2.93Å; H337-T340 WeakPolarHBondContact O-CB 3.34Å; H337-T340 PolarHBondContact O-N 2.74Å; G338-T340 VanDerWaalsContact C-N 3.31Å; G338-T340 PolarHBondContact O-N 2.82Å; T340-S343 PolarHBondContact O-N 3.19Å; T340-A344 WeakPolarHBondContact O-CB 3.42Å; T340-A344 PolarHBondContact O-N 2.85Å
341	I	61.9	Low	63.4	Low	88 Å²	88	81.5 Å²	81.5	45%	0.451	43%	0.428	S	S	.	.	H	α-helix	trans	-58.8	-49.6	173.2	-70.2	168.4	0	0	0	110.2	H337 G338 S343 A344 V345	H337-I341 WeakPolarHBondContact NE2-CD1 3.4Å; H337-I341 WeakPolarHBondContact O-CG1 3.46Å; H337-I341 PolarHBondContact O-N 3.3Å; G338-I341 PolarHBondContact O-N 3.1Å; I341-S343 VanDerWaalsContact C-N 3.32Å; I341-S343 PolarHBondContact O-N 3.33Å; I341-A344 PolarHBondContact O-N 3.24Å; I341-A344 VanDerWaalsContact O-N 3.16Å; I341-V345 HydrophobicContact CG2-CG2 4.29Å; I341-V345 WeakPolarHBondContact O-CG2 3.41Å; I341-V345 PolarHBondContact O-N 3.49Å
342	L	59.7	Low	63.6	Low	83 Å²	83	81.1 Å²	81.1	44%	0.435	42%	0.422	S	S	.	.	H	α-helix	trans	-59.6	-43.7	-178.7	-173.4	60.9	0	0	0	111.4	G338 V345 F346	G338-L342 VanDerWaalsContact O-CB 3.29Å; G338-L342 WeakPolarHBondContact O-CB 3.27Å; G338-L342 PolarHBondContact O-N 2.88Å; L342-V345 PolarHBondContact O-N 3.48Å; L342-F346 HydrophobicContact CD1-CD2 3.94Å; L342-F346 HydrophobicContact CD1-CE2 3.56Å; L342-F346 HydrophobicContact CD1-CZ 4.48Å; L342-F346 HydrophobicContact CD2-CE2 4.31Å; L342-F346 HydrophobicContact CG-CD2 3.87Å; L342-F346 HydrophobicContact CG-CE2 3.72Å; L342-F346 VanDerWaalsContact O-CD2 3.27Å; L342-F346 WeakPolarHBondContact O-CD2 3.24Å; L342-F346 PolarHBondContact O-N 3.37Å
343	S	60.7	Low	64.2	Low	48 Å²	48	81.7 Å²	81.7	34%	0.336	42%	0.423	S	S	.	.	H	α-helix	trans	-63.5	-42	175.1	-62.1	0	0	0	0	112.4	F339 T340 I341 F346 R347	F339-S343 WeakPolarHBondContact O-CB 3.44Å; F339-S343 PolarHBondContact O-N 2.76Å; F339-S343 PolarHBondContact O-OG 3.09Å; T340-S343 PolarHBondContact O-N 3.19Å; I341-S343 VanDerWaalsContact C-N 3.32Å; I341-S343 PolarHBondContact O-N 3.33Å; S343-F346 PolarHBondContact O-N 3.1Å; S343-R347 VanDerWaalsContact O-CB 3.31Å; S343-R347 WeakPolarHBondContact O-CB 3.46Å; S343-R347 VanDerWaalsContact O-CG 3.26Å; S343-R347 WeakPolarHBondContact O-CG 3.46Å; S343-R347 PolarHBondContact O-N 3.41Å
344	A	58.3	Low	65	Low	52 Å²	52	77.2 Å²	77.2	43%	0.43	39%	0.394	S	S	.	.	H	α-helix	trans	-65.8	-38.1	176.1	0	0	0	0	0	112.3	T340 I341 G348	T340-A344 WeakPolarHBondContact O-CB 3.42Å; T340-A344 PolarHBondContact O-N 2.85Å; I341-A344 PolarHBondContact O-N 3.24Å; I341-A344 VanDerWaalsContact O-N 3.16Å; A344-G348 PolarHBondContact O-N 3.01Å
345	V	59.7	Low	65.8	Low	87 Å²	87	74.3 Å²	74.3	53%	0.527	37%	0.371	S	S	.	.	H	α-helix	trans	-66.5	-46.3	174.7	169.4	0	0	0	0	111.2	I341 L342 G348 R349	I341-V345 HydrophobicContact CG2-CG2 4.29Å; I341-V345 WeakPolarHBondContact O-CG2 3.41Å; I341-V345 PolarHBondContact O-N 3.49Å; L342-V345 PolarHBondContact O-N 3.48Å; V345-G348 PolarHBondContact O-N 2.78Å; V345-R349 WeakPolarHBondContact O-CB 3.24Å; V345-R349 PolarHBondContact O-N 2.95Å
346	F	63.5	Low	66.4	Low	131 Å²	131	75.1 Å²	75.1	58%	0.575	39%	0.386	S	S	*	.	H	α-helix	trans	-63	-48.4	175.8	-85	-62.5	0	0	0	112.1	L342 S343 G348 R349 L350	L342-F346 HydrophobicContact CD1-CD2 3.94Å; L342-F346 HydrophobicContact CD1-CE2 3.56Å; L342-F346 HydrophobicContact CD1-CZ 4.48Å; L342-F346 HydrophobicContact CD2-CE2 4.31Å; L342-F346 HydrophobicContact CG-CD2 3.87Å; L342-F346 HydrophobicContact CG-CE2 3.72Å; L342-F346 VanDerWaalsContact O-CD2 3.27Å; L342-F346 WeakPolarHBondContact O-CD2 3.24Å; L342-F346 PolarHBondContact O-N 3.37Å; S343-F346 PolarHBondContact O-N 3.1Å; F346-G348 PolarHBondContact O-N 3.15Å; F346-R349 PolarHBondContact O-N 2.97Å; F346-L350 WeakPolarHBondContact O-CB 3.46Å; F346-L350 PolarHBondContact O-N 2.97Å
347	R	68.6	Low	67.5	Low	117 Å²	117	71.2 Å²	71.2	44%	0.442	37%	0.366	S	S	.	.	H	α-helix	trans	-59.8	-46.9	176.1	-73.5	173.9	178.5	-175.5	-0.4	111.6	S343 R349 L350 I351	S343-R347 VanDerWaalsContact O-CB 3.31Å; S343-R347 WeakPolarHBondContact O-CB 3.46Å; S343-R347 VanDerWaalsContact O-CG 3.26Å; S343-R347 WeakPolarHBondContact O-CG 3.46Å; S343-R347 PolarHBondContact O-N 3.41Å; R347-R349 VanDerWaalsContact C-N 3.3Å; R347-R349 PolarHBondContact O-N 3.31Å; R347-L350 PolarHBondContact O-N 2.84Å; R347-I351 WeakPolarHBondContact O-CB 3.47Å; R347-I351 VanDerWaalsContact O-CG1 3.27Å; R347-I351 WeakPolarHBondContact O-CG1 3.5Å; R347-I351 PolarHBondContact O-N 3.31Å
348	G	65.4	Low	68.4	Low	1 Å²	1	67.8 Å²	67.8	1%	0.01	35%	0.354	C	S	.	.	H	α-helix	trans	-63	-33.2	176.4	0	0	0	0	0	113.1	A344 V345 F346 R352	A344-G348 PolarHBondContact O-N 3.01Å; V345-G348 PolarHBondContact O-N 2.78Å; F346-G348 PolarHBondContact O-N 3.15Å; G348-R352 WeakPolarHBondContact O-CB 3.45Å; G348-R352 WeakPolarHBondContact O-CG 3.39Å; G348-R352 PolarHBondContact O-N 2.95Å; G348-R352 PolarHBondContact O-NE 3.45Å; G348-R352 PolarHBondContact O-NH2 3.29Å
349	R	71.9	Confident	69.6	Low	144 Å²	144	69.5 Å²	69.5	54%	0.543	35%	0.352	S	S	.	.	H	α-helix	trans	-68.9	-47.9	171.9	-177.5	175.7	177.6	159.3	1.7	111.3	V345 F346 R347 R352 Q353	V345-R349 WeakPolarHBondContact O-CB 3.24Å; V345-R349 PolarHBondContact O-N 2.95Å; F346-R349 PolarHBondContact O-N 2.97Å; R347-R349 VanDerWaalsContact C-N 3.3Å; R347-R349 PolarHBondContact O-N 3.31Å; R349-R352 PolarHBondContact O-N 3.3Å; R349-Q353 WeakPolarHBondContact O-CG 3.29Å; R349-Q353 PolarHBondContact O-N 3.45Å
350	L	71.9	Confident	70.4	Confident	31 Å²	31	63.3 Å²	63.3	16%	0.162	33%	0.325	C	S	.	.	H	α-helix	trans	-59.5	-47.4	178.7	-174.6	66.3	0	0	0	111.7	F346 R347 R352 Q353 L354 I424 I428 I431	F346-L350 WeakPolarHBondContact O-CB 3.46Å; F346-L350 PolarHBondContact O-N 2.97Å; R347-L350 PolarHBondContact O-N 2.84Å; L350-R352 PolarHBondContact O-N 3.15Å; L350-Q353 PolarHBondContact O-N 3.15Å; L350-L354 HydrophobicContact CG-CD1 4.4Å; L350-L354 WeakPolarHBondContact O-CG 3.38Å; L350-L354 PolarHBondContact O-N 3.34Å; L350-I424 HydrophobicContact CD2-CG2 4.39Å; L350-I428 HydrophobicContact CD1-CG1 4.04Å; L350-I431 HydrophobicContact CD1-CD1 3.63Å
351	I	73.4	Confident	71.3	Confident	30 Å²	30	64 Å²	64	15%	0.154	32%	0.322	C	S	.	.	H	α-helix	trans	-59.3	-45.8	176.5	-70.5	165.1	0	0	0	111.1	R347 Q353 L354 L355 F419 Y566	R347-I351 WeakPolarHBondContact O-CB 3.47Å; R347-I351 VanDerWaalsContact O-CG1 3.27Å; R347-I351 WeakPolarHBondContact O-CG1 3.5Å; R347-I351 PolarHBondContact O-N 3.31Å; I351-Q353 VanDerWaalsContact C-N 3.35Å; I351-Q353 PolarHBondContact O-N 3.08Å; I351-L354 PolarHBondContact O-N 3.17Å; I351-L355 HydrophobicContact CG2-CD1 3.96Å; I351-L355 HydrophobicContact CG2-CG 4.46Å; I351-L355 WeakPolarHBondContact O-CB 3.26Å; I351-L355 VanDerWaalsContact O-CG 3.3Å; I351-L355 WeakPolarHBondContact O-CG 3.27Å; I351-L355 PolarHBondContact O-N 3.28Å; I351-F419 HydrophobicContact CG2-CE1 4.14Å; I351-Y566 HydrophobicContact CD1-CE2 3.96Å
352	R	73	Confident	72	Confident	133 Å²	133	63.1 Å²	63.1	50%	0.502	32%	0.318	S	S	.	.	H	α-helix	trans	-65.6	-35.5	176.7	-76.7	175	-68.5	-152.9	-0.1	112.7	G348 R349 L350 A356	G348-R352 WeakPolarHBondContact O-CB 3.45Å; G348-R352 WeakPolarHBondContact O-CG 3.39Å; G348-R352 PolarHBondContact O-N 2.95Å; G348-R352 PolarHBondContact O-NE 3.45Å; G348-R352 PolarHBondContact O-NH2 3.29Å; R349-R352 PolarHBondContact O-N 3.3Å; L350-R352 PolarHBondContact O-N 3.15Å; R352-A356 WeakPolarHBondContact O-CB 3.4Å; R352-A356 PolarHBondContact O-N 3.09Å; R352-A356 VanDerWaalsContact O-N 3.1Å
353	Q	76.7	Confident	73	Confident	76 Å²	76	60 Å²	60	36%	0.355	30%	0.301	S	S	.	.	H	α-helix	trans	-70.2	-38.2	174	-70.6	-178.6	-81.2	0	0	112	R349 L350 I351 A356 T357 I431	R349-Q353 WeakPolarHBondContact O-CG 3.29Å; R349-Q353 PolarHBondContact O-N 3.45Å; L350-Q353 PolarHBondContact O-N 3.15Å; I351-Q353 VanDerWaalsContact C-N 3.35Å; I351-Q353 PolarHBondContact O-N 3.08Å; Q353-A356 PolarHBondContact O-N 2.9Å; Q353-T357 WeakPolarHBondContact O-CG2 3.18Å; Q353-T357 PolarHBondContact O-N 2.96Å; Q353-I431 HydrophobicContact CB-CD1 3.59Å; Q353-I431 HydrophobicContact CB-CG1 3.99Å; Q353-I431 HydrophobicContact CB-CG2 4.16Å
354	L	78.6	Confident	73.7	Confident	1 Å²	1	60.6 Å²	60.6	1%	0.005	30%	0.301	C	S	.	.	H	α-helix	trans	-61.6	-49.2	172.4	-76.7	170.9	0	0	0	111.8	L350 I351 A356 T357 V360 I418 F419 Q427 L430 I431	L350-L354 HydrophobicContact CG-CD1 4.4Å; L350-L354 WeakPolarHBondContact O-CG 3.38Å; L350-L354 PolarHBondContact O-N 3.34Å; I351-L354 PolarHBondContact O-N 3.17Å; L354-A356 PolarHBondContact O-N 2.89Å; L354-T357 WeakPolarHBondContact O-CB 3.38Å; L354-T357 WeakPolarHBondContact O-CG2 3.4Å; L354-T357 PolarHBondContact O-N 3.11Å; L354-T357 PolarHBondContact O-OG1 3.31Å; L354-V360 VanDerWaalsContact O-CB 3.3Å; L354-V360 WeakPolarHBondContact O-CB 3.31Å; L354-V360 WeakPolarHBondContact O-CG2 3.46Å; L354-I418 HydrophobicContact CD2-CG2 4.17Å; L354-F419 HydrophobicContact CB-CE1 3.63Å; L354-F419 HydrophobicContact CB-CZ 3.79Å; L354-F419 HydrophobicContact CD1-CD1 3.91Å; L354-F419 HydrophobicContact CD1-CE1 3.77Å; L354-F419 HydrophobicContact CG-CE1 4.36Å; L354-Q427 HydrophobicContact CD1-CB 4.13Å; L354-Q427 HydrophobicContact CD1-CG 3.95Å; L354-Q427 HydrophobicContact CD2-CB 3.94Å; L354-Q427 HydrophobicContact CD2-CG 4.19Å; L354-Q427 HydrophobicContact CG-CB 4.47Å; L354-L430 HydrophobicContact CD2-CD2 4.18Å; L354-I431 HydrophobicContact CD2-CD1 4.2Å; L354-I431 HydrophobicContact CD2-CG1 4.17Å; L354-I431 HydrophobicContact CG-CD1 4.12Å; L354-I431 HydrophobicContact CG-CG1 4.47Å
355	L	77.3	Confident	74.5	Confident	36 Å²	36	63.2 Å²	63.2	19%	0.188	30%	0.299	C	S	.	.	H	α-helix	trans	-59.5	-29.9	175.9	-71.6	169.9	0	0	0	112.9	I351 V360 I364 F419 I568	I351-L355 HydrophobicContact CG2-CD1 3.96Å; I351-L355 HydrophobicContact CG2-CG 4.46Å; I351-L355 WeakPolarHBondContact O-CB 3.26Å; I351-L355 VanDerWaalsContact O-CG 3.3Å; I351-L355 WeakPolarHBondContact O-CG 3.27Å; I351-L355 PolarHBondContact O-N 3.28Å; L355-V360 HydrophobicContact CD2-CG1 4.15Å; L355-I364 HydrophobicContact CD2-CD1 3.74Å; L355-F419 HydrophobicContact CD2-CE2 4.29Å; L355-F419 HydrophobicContact CD2-CZ 3.73Å; L355-F419 HydrophobicContact CG-CE1 4.42Å; L355-F419 HydrophobicContact CG-CZ 3.87Å; L355-I568 HydrophobicContact CD1-CD1 4.37Å
356	A	75.3	Confident	75.2	Confident	68 Å²	68	61.4 Å²	61.4	56%	0.562	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-7.1	176.1	0	0	0	0	0	114.2	R352 Q353 L354	R352-A356 WeakPolarHBondContact O-CB 3.4Å; R352-A356 PolarHBondContact O-N 3.09Å; R352-A356 VanDerWaalsContact O-N 3.1Å; Q353-A356 PolarHBondContact O-N 2.9Å; L354-A356 PolarHBondContact O-N 2.89Å
357	T	82.3	Confident	75.6	Confident	1 Å²	1	56 Å²	56	1%	0.006	27%	0.268	C	S	.	.	S	Bend	trans	-69	138.9	174.2	68.1	0	0	0	0	110.1	Q353 L354 K359 V360 H361 L430 I431	Q353-T357 WeakPolarHBondContact O-CG2 3.18Å; Q353-T357 PolarHBondContact O-N 2.96Å; L354-T357 WeakPolarHBondContact O-CB 3.38Å; L354-T357 WeakPolarHBondContact O-CG2 3.4Å; L354-T357 PolarHBondContact O-N 3.11Å; L354-T357 PolarHBondContact O-OG1 3.31Å; T357-K359 PolarHBondContact O-N 2.98Å; T357-V360 PolarHBondContact O-N 3.24Å; T357-V360 WeakPolarHBondContact OG1-CB 3.3Å; T357-V360 WeakPolarHBondContact OG1-CG2 3.34Å; T357-V360 PolarHBondContact OG1-N 3.15Å; T357-H361 WeakPolarHBondContact O-CB 3.39Å; T357-H361 PolarHBondContact O-N 3.02Å; T357-L430 HydrophobicContact CG2-CD2 4.34Å; T357-L430 HydrophobicContact CG2-CG 4.13Å; T357-I431 HydrophobicContact CG2-CG1 4.02Å
358	P	77.9	Confident	75.9	Confident	48 Å²	48	55.9 Å²	55.9	31%	0.312	27%	0.271	S	S	.	.	H	α-helix	trans	-53.9	-39.4	175.8	-29	36.4	0	0	0	112.5	V360 H361 D362 S434	P358-V360 PolarHBondContact O-N 2.78Å; P358-H361 PolarHBondContact O-N 2.91Å; P358-D362 VanDerWaalsContact O-CB 3.22Å; P358-D362 WeakPolarHBondContact O-CB 3.43Å; P358-D362 PolarHBondContact O-N 3.34Å; P358-S434 VanDerWaalsContact CD-CB 3.49Å
359	K	82.5	Confident	76.2	Confident	72 Å²	72	59.2 Å²	59.2	31%	0.313	29%	0.288	S	S	.	.	H	α-helix	trans	-56.9	-54.4	177.7	-167.3	-171.2	-179.3	-165.4	0	112	T357 D362 L363 E414 I418 L430	T357-K359 PolarHBondContact O-N 2.98Å; K359-D362 PolarHBondContact O-N 2.76Å; K359-L363 HydrophobicContact CG-CD1 4.23Å; K359-L363 VanDerWaalsContact O-CG 3.24Å; K359-L363 WeakPolarHBondContact O-CG 3.49Å; K359-L363 PolarHBondContact O-N 2.8Å; K359-E414 WeakPolarHBondContact CE-OE1 3.23Å; K359-E414 IonicContact NZ-OE1 2.61Å; K359-E414 PolarHBondContact NZ-OE1 3.11Å; K359-I418 HydrophobicContact CD-CD1 4.15Å; K359-L430 HydrophobicContact CB-CD1 4.16Å; K359-L430 HydrophobicContact CD-CD1 3.85Å
360	V	80.7	Confident	76.1	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-67.4	-39.3	-178.9	174.1	0	0	0	0	111	L354 L355 T357 P358 D362 L363 I364 I418 F419 L430	L354-V360 VanDerWaalsContact O-CB 3.3Å; L354-V360 WeakPolarHBondContact O-CB 3.31Å; L354-V360 WeakPolarHBondContact O-CG2 3.46Å; L355-V360 HydrophobicContact CD2-CG1 4.15Å; T357-V360 PolarHBondContact O-N 3.24Å; T357-V360 WeakPolarHBondContact OG1-CB 3.3Å; T357-V360 WeakPolarHBondContact OG1-CG2 3.34Å; T357-V360 PolarHBondContact OG1-N 3.15Å; P358-V360 PolarHBondContact O-N 2.78Å; V360-D362 PolarHBondContact O-N 3.2Å; V360-L363 PolarHBondContact O-N 3.19Å; V360-I364 HydrophobicContact CG1-CD1 3.76Å; V360-I364 HydrophobicContact CG1-CG1 4.38Å; V360-I364 WeakPolarHBondContact O-CB 3.19Å; V360-I364 VanDerWaalsContact O-CG1 3.26Å; V360-I364 WeakPolarHBondContact O-CG1 3.21Å; V360-I364 PolarHBondContact O-N 3.47Å; V360-I418 HydrophobicContact CG2-CD1 4.1Å; V360-I418 HydrophobicContact CG2-CG2 3.9Å; V360-F419 HydrophobicContact CG1-CE2 3.79Å; V360-F419 HydrophobicContact CG1-CZ 4.04Å; V360-F419 HydrophobicContact CG2-CE2 4.44Å; V360-L430 HydrophobicContact CG2-CD2 4.17Å
361	H	77.8	Confident	75.9	Confident	96 Å²	96	53.8 Å²	53.8	44%	0.444	28%	0.275	S	S	.	.	H	α-helix	trans	-62.9	-39.5	176.7	-179.2	-121.4	0	0	0	112.7	T357 P358 I364 R365	T357-H361 WeakPolarHBondContact O-CB 3.39Å; T357-H361 PolarHBondContact O-N 3.02Å; P358-H361 PolarHBondContact O-N 2.91Å; H361-I364 PolarHBondContact O-N 2.64Å; H361-R365 PolarHBondContact CE1-NH2 3.48Å; H361-R365 PolarHBondContact O-N 2.89Å
362	D	77.3	Confident	75.8	Confident	70 Å²	70	57.4 Å²	57.4	37%	0.374	29%	0.29	S	S	.	.	H	α-helix	trans	-75	-33.5	178	-64.9	-18.4	0	0	0	111.9	P358 K359 V360 R365 S366	P358-D362 VanDerWaalsContact O-CB 3.22Å; P358-D362 WeakPolarHBondContact O-CB 3.43Å; P358-D362 PolarHBondContact O-N 3.34Å; K359-D362 PolarHBondContact O-N 2.76Å; V360-D362 PolarHBondContact O-N 3.2Å; D362-R365 PolarHBondContact O-N 3.44Å; D362-R365 IonicContact OD1-CZ 2.72Å; D362-R365 IonicContact OD1-NH1 2.73Å; D362-R365 PolarHBondContact OD1-NH1 2.9Å; D362-R365 IonicContact OD1-NH2 2.82Å; D362-S366 WeakPolarHBondContact O-CB 3.43Å; D362-S366 PolarHBondContact O-N 2.94Å; D362-S366 PolarHBondContact O-OG 2.71Å
363	L	81.3	Confident	75.6	Confident	17 Å²	17	54.6 Å²	54.6	9%	0.089	28%	0.284	C	S	.	.	H	α-helix	trans	-63	-47	167.9	-69.3	167.8	0	0	0	110.9	K359 V360 R365 S366 V367 I411 E414 I415 I418	K359-L363 HydrophobicContact CG-CD1 4.23Å; K359-L363 VanDerWaalsContact O-CG 3.24Å; K359-L363 WeakPolarHBondContact O-CG 3.49Å; K359-L363 PolarHBondContact O-N 2.8Å; V360-L363 PolarHBondContact O-N 3.19Å; L363-R365 VanDerWaalsContact C-N 3.34Å; L363-R365 PolarHBondContact O-N 3.36Å; L363-S366 CarbonylContact O-C 3.58Å; L363-S366 WeakPolarHBondContact O-CA 3.37Å; L363-S366 WeakPolarHBondContact O-CB 3.47Å; L363-S366 PolarHBondContact O-N 2.89Å; L363-S366 VanDerWaalsContact O-N 3.09Å; L363-V367 WeakPolarHBondContact O-CG2 3.45Å; L363-V367 PolarHBondContact O-N 3.36Å; L363-I411 HydrophobicContact CB-CG2 4.14Å; L363-I411 HydrophobicContact CD2-CG2 3.87Å; L363-E414 HydrophobicContact CD1-CB 4.46Å; L363-E414 HydrophobicContact CD1-CG 3.89Å; L363-E414 HydrophobicContact CD2-CG 4.39Å; L363-E414 VanDerWaalsContact CD2-OE2 3.31Å; L363-E414 WeakPolarHBondContact CD2-OE2 3.27Å; L363-I415 HydrophobicContact CB-CD1 4.01Å; L363-I415 HydrophobicContact CB-CG1 3.87Å; L363-I415 HydrophobicContact CD1-CG1 4.2Å; L363-I418 HydrophobicContact CD1-CD1 3.74Å
364	I	75	Confident	75.1	Confident	62 Å²	62	51.7 Å²	51.7	32%	0.318	27%	0.271	S	S	.	.	H	α-helix	trans	-61.4	-40.7	176.2	-71.2	167.8	0	0	0	111.3	L355 V360 H361 S366 V367 K368 I415	L355-I364 HydrophobicContact CD2-CD1 3.74Å; V360-I364 HydrophobicContact CG1-CD1 3.76Å; V360-I364 HydrophobicContact CG1-CG1 4.38Å; V360-I364 WeakPolarHBondContact O-CB 3.19Å; V360-I364 VanDerWaalsContact O-CG1 3.26Å; V360-I364 WeakPolarHBondContact O-CG1 3.21Å; V360-I364 PolarHBondContact O-N 3.47Å; H361-I364 PolarHBondContact O-N 2.64Å; I364-S366 VanDerWaalsContact C-N 3.34Å; I364-V367 PolarHBondContact O-N 3.37Å; I364-K368 WeakPolarHBondContact O-CB 3.34Å; I364-K368 PolarHBondContact O-N 3.06Å; I364-I415 HydrophobicContact CG1-CD1 4.2Å
365	R	75.6	Confident	74.7	Confident	106 Å²	106	56.7 Å²	56.7	40%	0.4	30%	0.297	S	S	.	.	H	α-helix	trans	-62.7	-42.5	172.7	-166.9	-172.8	-61.3	96.8	-7.8	111.1	H361 D362 L363 V367 K368 D369	H361-R365 PolarHBondContact CE1-NH2 3.48Å; H361-R365 PolarHBondContact O-N 2.89Å; D362-R365 PolarHBondContact O-N 3.44Å; D362-R365 IonicContact OD1-CZ 2.72Å; D362-R365 IonicContact OD1-NH1 2.73Å; D362-R365 PolarHBondContact OD1-NH1 2.9Å; D362-R365 IonicContact OD1-NH2 2.82Å; L363-R365 VanDerWaalsContact C-N 3.34Å; L363-R365 PolarHBondContact O-N 3.36Å; R365-V367 PolarHBondContact O-N 3.22Å; R365-K368 WeakPolarHBondContact O-CB 3.31Å; R365-K368 PolarHBondContact O-N 2.8Å; R365-K368 VanDerWaalsContact O-N 3.13Å; R365-D369 WeakPolarHBondContact CG-OD2 3.45Å; R365-D369 PolarHBondContact O-N 3.35Å
366	S	72.5	Confident	74.5	Confident	50 Å²	50	57.9 Å²	57.9	35%	0.35	31%	0.308	S	S	.	.	H	α-helix	trans	-63.6	-40.2	177.9	-57.1	0	0	0	0	112.3	D362 L363 I364 I370	D362-S366 WeakPolarHBondContact O-CB 3.43Å; D362-S366 PolarHBondContact O-N 2.94Å; D362-S366 PolarHBondContact O-OG 2.71Å; L363-S366 CarbonylContact O-C 3.58Å; L363-S366 WeakPolarHBondContact O-CA 3.37Å; L363-S366 WeakPolarHBondContact O-CB 3.47Å; L363-S366 PolarHBondContact O-N 2.89Å; L363-S366 VanDerWaalsContact O-N 3.09Å; I364-S366 VanDerWaalsContact C-N 3.34Å; S366-I370 VanDerWaalsContact O-CB 3.31Å; S366-I370 WeakPolarHBondContact O-CB 3.34Å; S366-I370 WeakPolarHBondContact O-CD1 3.29Å; S366-I370 VanDerWaalsContact O-CG1 3.26Å; S366-I370 WeakPolarHBondContact O-CG1 3.42Å; S366-I370 PolarHBondContact O-N 2.61Å
367	V	73.9	Confident	74	Confident	17 Å²	17	55 Å²	55	10%	0.103	28%	0.284	C	S	.	.	H	α-helix	trans	-57.1	-50.9	169	171.1	0	0	0	0	110.4	L363 I364 R365 D369 A371 L408 I411 L412 I415	L363-V367 WeakPolarHBondContact O-CG2 3.45Å; L363-V367 PolarHBondContact O-N 3.36Å; I364-V367 PolarHBondContact O-N 3.37Å; R365-V367 PolarHBondContact O-N 3.22Å; V367-D369 PolarHBondContact O-N 3.33Å; V367-A371 WeakPolarHBondContact O-CB 3.39Å; V367-A371 PolarHBondContact O-N 3.35Å; V367-L408 HydrophobicContact CB-CD1 4.35Å; V367-L408 HydrophobicContact CG1-CD1 3.99Å; V367-L408 HydrophobicContact CG2-CD1 4.37Å; V367-I411 HydrophobicContact CG2-CB 4.43Å; V367-I411 HydrophobicContact CG2-CG2 3.52Å; V367-L412 HydrophobicContact CG1-CD2 4.25Å; V367-L412 HydrophobicContact CG2-CD2 3.9Å; V367-L412 HydrophobicContact CG2-CG 4.26Å; V367-I415 HydrophobicContact CG2-CD1 3.85Å
368	K	73.8	Confident	73.4	Confident	114 Å²	114	59.4 Å²	59.4	50%	0.496	30%	0.303	S	S	.	.	H	α-helix	trans	-59.6	-44.2	-178.4	-174.3	174.4	-174.8	172.1	0	112.3	I364 R365 K372	I364-K368 WeakPolarHBondContact O-CB 3.34Å; I364-K368 PolarHBondContact O-N 3.06Å; R365-K368 WeakPolarHBondContact O-CB 3.31Å; R365-K368 PolarHBondContact O-N 2.8Å; R365-K368 VanDerWaalsContact O-N 3.13Å; K368-K372 VanDerWaalsContact O-CG 3.29Å; K368-K372 WeakPolarHBondContact O-CG 3.47Å; K368-K372 PolarHBondContact O-N 2.91Å
369	D	72.3	Confident	73	Confident	71 Å²	71	62.2 Å²	62.2	38%	0.38	32%	0.315	S	S	.	.	H	α-helix	trans	-81.1	-31.7	-175.3	-66.5	-29.6	0	0	0	112.8	R365 V367 K372 L373	R365-D369 WeakPolarHBondContact CG-OD2 3.45Å; R365-D369 PolarHBondContact O-N 3.35Å; V367-D369 PolarHBondContact O-N 3.33Å; D369-K372 IonicContact OD1-NZ 2.72Å; D369-K372 PolarHBondContact OD1-NZ 3.16Å; D369-L373 WeakPolarHBondContact O-CB 3.29Å; D369-L373 PolarHBondContact O-N 2.74Å
370	I	69.5	Low	72.2	Confident	27 Å²	27	63.8 Å²	63.8	14%	0.138	32%	0.323	C	S	.	.	H	α-helix	trans	-69.1	-41	168.9	-67.4	165.8	0	0	0	110.9	S366 L373 I374 L404 K407 L408 I411	S366-I370 VanDerWaalsContact O-CB 3.31Å; S366-I370 WeakPolarHBondContact O-CB 3.34Å; S366-I370 WeakPolarHBondContact O-CD1 3.29Å; S366-I370 VanDerWaalsContact O-CG1 3.26Å; S366-I370 WeakPolarHBondContact O-CG1 3.42Å; S366-I370 PolarHBondContact O-N 2.61Å; I370-L373 PolarHBondContact O-N 3.4Å; I370-I374 HydrophobicContact CG2-CD1 3.84Å; I370-I374 HydrophobicContact CG2-CG1 4.41Å; I370-I374 WeakPolarHBondContact O-CG1 3.4Å; I370-I374 PolarHBondContact O-N 2.87Å; I370-L404 HydrophobicContact CG2-CB 4.37Å; I370-L404 HydrophobicContact CG2-CD2 4.45Å; I370-K407 HydrophobicContact CD1-CB 4.13Å; I370-L408 HydrophobicContact CG2-CB 3.98Å; I370-L408 HydrophobicContact CG2-CD1 4.34Å; I370-I411 HydrophobicContact CD1-CD1 3.43Å; I370-I411 VanDerWaalsContact CD1-CD1 3.43Å
371	A	67.8	Low	71.2	Confident	35 Å²	35	66.5 Å²	66.5	29%	0.289	34%	0.338	S	S	.	.	H	α-helix	trans	-62.2	-44.6	175.6	0	0	0	0	0	111.7	V367 L373 I374 L375	V367-A371 WeakPolarHBondContact O-CB 3.39Å; V367-A371 PolarHBondContact O-N 3.35Å; A371-L373 VanDerWaalsContact C-N 3.35Å; A371-L373 PolarHBondContact O-N 3.43Å; A371-I374 PolarHBondContact O-N 3.34Å; A371-L375 WeakPolarHBondContact O-CB 3.29Å; A371-L375 VanDerWaalsContact O-CG 3.31Å; A371-L375 WeakPolarHBondContact O-CG 3.36Å; A371-L375 PolarHBondContact O-N 3.15Å
372	K	70.7	Confident	70.3	Confident	105 Å²	105	68.6 Å²	68.6	46%	0.457	35%	0.347	S	S	.	.	H	α-helix	trans	-55.9	-47.1	170	-77.4	173.2	-173.2	164.2	0	111.9	K368 D369 I374 L375 S376	K368-K372 VanDerWaalsContact O-CG 3.29Å; K368-K372 WeakPolarHBondContact O-CG 3.47Å; K368-K372 PolarHBondContact O-N 2.91Å; D369-K372 IonicContact OD1-NZ 2.72Å; D369-K372 PolarHBondContact OD1-NZ 3.16Å; K372-I374 PolarHBondContact O-N 2.86Å; K372-L375 WeakPolarHBondContact O-CB 3.34Å; K372-L375 PolarHBondContact O-N 2.82Å; K372-L375 VanDerWaalsContact O-N 3.17Å; K372-S376 PolarHBondContact O-N 3.09Å; K372-S376 PolarHBondContact O-OG 3.13Å
373	L	68.2	Low	69.5	Low	74 Å²	74	71.8 Å²	71.8	39%	0.387	36%	0.364	S	S	.	.	H	α-helix	trans	-62.3	-43.1	-178.7	-177.5	58.7	0	0	0	111.6	D369 I370 A371 L375 S376 I377 F400 L404	D369-L373 WeakPolarHBondContact O-CB 3.29Å; D369-L373 PolarHBondContact O-N 2.74Å; I370-L373 PolarHBondContact O-N 3.4Å; A371-L373 VanDerWaalsContact C-N 3.35Å; A371-L373 PolarHBondContact O-N 3.43Å; L373-L375 VanDerWaalsContact C-N 3.35Å; L373-L375 PolarHBondContact O-N 3.35Å; L373-S376 PolarHBondContact O-N 2.91Å; L373-I377 HydrophobicContact CD1-CD1 4.26Å; L373-I377 HydrophobicContact CG-CD1 4.01Å; L373-I377 WeakPolarHBondContact O-CB 3.22Å; L373-I377 WeakPolarHBondContact O-CD1 3.48Å; L373-I377 WeakPolarHBondContact O-CG1 3.39Å; L373-I377 PolarHBondContact O-N 2.88Å; L373-F400 HydrophobicContact CD2-CZ 4.43Å; L373-L404 HydrophobicContact CD2-CD1 3.79Å; L373-L404 HydrophobicContact CD2-CD2 3.76Å; L373-L404 HydrophobicContact CD2-CG 4.45Å; L373-L404 HydrophobicContact CG-CD1 3.84Å
374	I	67.5	Low	68.3	Low	15 Å²	15	74.7 Å²	74.7	8%	0.077	38%	0.379	C	S	.	.	H	α-helix	trans	-62.2	-40.6	173.6	-67.2	166.7	0	0	0	111.2	I370 A371 K372 I377 K378 L404 L408	I370-I374 HydrophobicContact CG2-CD1 3.84Å; I370-I374 HydrophobicContact CG2-CG1 4.41Å; I370-I374 WeakPolarHBondContact O-CG1 3.4Å; I370-I374 PolarHBondContact O-N 2.87Å; A371-I374 PolarHBondContact O-N 3.34Å; K372-I374 PolarHBondContact O-N 2.86Å; I374-I377 PolarHBondContact O-N 3.47Å; I374-K378 HydrophobicContact CG2-CD 4.13Å; I374-K378 WeakPolarHBondContact O-CB 3.39Å; I374-K378 WeakPolarHBondContact O-CG 3.35Å; I374-K378 PolarHBondContact O-N 3.5Å; I374-L404 HydrophobicContact CD1-CB 4Å; I374-L404 HydrophobicContact CG1-CB 3.82Å; I374-L404 HydrophobicContact CG1-CD1 4.17Å; I374-L408 HydrophobicContact CD1-CD2 4.05Å
375	L	70.8	Confident	67.2	Low	106 Å²	106	76.7 Å²	76.7	56%	0.555	40%	0.398	S	S	*	.	H	α-helix	trans	-64.6	-44.7	175.9	-73.7	166.5	0	0	0	112	A371 K372 L373 I377 K378 L379	A371-L375 WeakPolarHBondContact O-CB 3.29Å; A371-L375 VanDerWaalsContact O-CG 3.31Å; A371-L375 WeakPolarHBondContact O-CG 3.36Å; A371-L375 PolarHBondContact O-N 3.15Å; K372-L375 WeakPolarHBondContact O-CB 3.34Å; K372-L375 PolarHBondContact O-N 2.82Å; K372-L375 VanDerWaalsContact O-N 3.17Å; L373-L375 VanDerWaalsContact C-N 3.35Å; L373-L375 PolarHBondContact O-N 3.35Å; L375-I377 PolarHBondContact O-N 3.49Å; L375-K378 PolarHBondContact O-N 2.84Å; L375-L379 WeakPolarHBondContact O-CG 3.39Å; L375-L379 PolarHBondContact O-N 3.34Å
376	S	71.3	Confident	66.1	Low	61 Å²	61	79.7 Å²	79.7	43%	0.427	42%	0.419	S	S	.	.	H	α-helix	trans	-59.9	-44.9	174.4	-62.2	0	0	0	0	112	K372 L373 K378 L379 E380	K372-S376 PolarHBondContact O-N 3.09Å; K372-S376 PolarHBondContact O-OG 3.13Å; L373-S376 PolarHBondContact O-N 2.91Å; S376-K378 VanDerWaalsContact C-N 3.26Å; S376-K378 PolarHBondContact O-N 3.19Å; S376-L379 PolarHBondContact O-N 3.37Å; S376-E380 WeakPolarHBondContact O-CB 3.47Å; S376-E380 WeakPolarHBondContact O-CG 3.44Å; S376-E380 PolarHBondContact O-N 2.79Å
377	I	66.6	Low	65.3	Low	8 Å²	8	82.9 Å²	82.9	4%	0.041	43%	0.432	C	S	.	.	H	α-helix	trans	-57.2	-40	175.3	-75.1	164.8	0	0	0	111.3	L373 I374 L375 N381 K397 F400 L404	L373-I377 HydrophobicContact CD1-CD1 4.26Å; L373-I377 HydrophobicContact CG-CD1 4.01Å; L373-I377 WeakPolarHBondContact O-CB 3.22Å; L373-I377 WeakPolarHBondContact O-CD1 3.48Å; L373-I377 WeakPolarHBondContact O-CG1 3.39Å; L373-I377 PolarHBondContact O-N 2.88Å; I374-I377 PolarHBondContact O-N 3.47Å; L375-I377 PolarHBondContact O-N 3.49Å; I377-N381 WeakPolarHBondContact O-CB 3.29Å; I377-N381 PolarHBondContact O-N 3.17Å; I377-N381 PolarHBondContact O-ND2 3.09Å; I377-N381 PolarHBondContact O-OD1 3.43Å; I377-K397 HydrophobicContact CG2-CG 4.35Å; I377-K397 WeakPolarHBondContact O-CE 3.49Å; I377-K397 PolarHBondContact O-NZ 3.23Å; I377-F400 HydrophobicContact CD1-CD1 3.7Å; I377-F400 HydrophobicContact CD1-CE1 3.66Å; I377-L404 HydrophobicContact CD1-CD1 3.29Å
378	K	68.3	Low	64.3	Low	93 Å²	93	92.3 Å²	92.3	40%	0.404	47%	0.472	S	S	.	.	H	α-helix	trans	-74.3	-40.2	178.3	-74.9	177.5	-180	-177.3	0	113.4	I374 L375 S376 N381 Q382 E401	I374-K378 HydrophobicContact CG2-CD 4.13Å; I374-K378 WeakPolarHBondContact O-CB 3.39Å; I374-K378 WeakPolarHBondContact O-CG 3.35Å; I374-K378 PolarHBondContact O-N 3.5Å; L375-K378 PolarHBondContact O-N 2.84Å; S376-K378 VanDerWaalsContact C-N 3.26Å; S376-K378 PolarHBondContact O-N 3.19Å; K378-N381 WeakPolarHBondContact O-CB 3.47Å; K378-N381 PolarHBondContact O-N 2.9Å; K378-N381 VanDerWaalsContact O-N 3.14Å; K378-Q382 PolarHBondContact O-N 2.89Å; K378-E401 WeakPolarHBondContact CE-OE1 3.09Å; K378-E401 IonicContact NZ-OE1 2.64Å; K378-E401 PolarHBondContact NZ-OE1 3.02Å
379	L	69.3	Low	63.2	Low	108 Å²	108	93.2 Å²	93.2	57%	0.565	48%	0.481	S	S	*	.	H	α-helix	trans	-63.1	-45	173.4	-73.6	165.5	0	0	0	111	L375 S376 N381 Q382 L383	L375-L379 WeakPolarHBondContact O-CG 3.39Å; L375-L379 PolarHBondContact O-N 3.34Å; S376-L379 PolarHBondContact O-N 3.37Å; L379-N381 VanDerWaalsContact C-N 3.31Å; L379-N381 PolarHBondContact O-N 2.88Å; L379-Q382 PolarHBondContact O-N 3.08Å; L379-L383 PolarHBondContact O-N 3.34Å
380	E	65.4	Low	62.2	Low	104 Å²	104	94.2 Å²	94.2	49%	0.486	49%	0.486	S	S	.	.	H	α-helix	trans	-57.7	-41.7	169.2	-77.7	179.7	-173.3	0	0	112.1	S376 Q382 L383 I384 K397	S376-E380 WeakPolarHBondContact O-CB 3.47Å; S376-E380 WeakPolarHBondContact O-CG 3.44Å; S376-E380 PolarHBondContact O-N 2.79Å; E380-Q382 VanDerWaalsContact C-N 3.33Å; E380-Q382 PolarHBondContact O-N 3.19Å; E380-L383 PolarHBondContact O-N 3.16Å; E380-I384 HydrophobicContact CB-CD1 4.31Å; E380-I384 VanDerWaalsContact O-CB 3.27Å; E380-I384 WeakPolarHBondContact O-CB 3.43Å; E380-I384 WeakPolarHBondContact O-CD1 3.4Å; E380-I384 WeakPolarHBondContact O-CG1 3.37Å; E380-I384 PolarHBondContact O-N 2.91Å; E380-K397 IonicContact OE2-NZ 3.31Å; E380-K397 PolarHBondContact OE2-NZ 2.85Å
381	N	61.1	Low	61.5	Low	58 Å²	58	102.2 Å²	102.2	31%	0.31	52%	0.52	S	S	.	.	H	α-helix	trans	-64.2	-37.8	178.7	-78.1	-16.1	0	0	0	111.8	I377 K378 L379 S385 K397	I377-N381 WeakPolarHBondContact O-CB 3.29Å; I377-N381 PolarHBondContact O-N 3.17Å; I377-N381 PolarHBondContact O-ND2 3.09Å; I377-N381 PolarHBondContact O-OD1 3.43Å; K378-N381 WeakPolarHBondContact O-CB 3.47Å; K378-N381 PolarHBondContact O-N 2.9Å; K378-N381 VanDerWaalsContact O-N 3.14Å; L379-N381 VanDerWaalsContact C-N 3.31Å; L379-N381 PolarHBondContact O-N 2.88Å; N381-S385 VanDerWaalsContact O-CB 3.23Å; N381-S385 WeakPolarHBondContact O-CB 3.39Å; N381-S385 PolarHBondContact O-N 3.04Å; N381-K397 VanDerWaalsContact OD1-CD 3.23Å; N381-K397 WeakPolarHBondContact OD1-CD 3.38Å; N381-K397 WeakPolarHBondContact OD1-CE 3.3Å; N381-K397 PolarHBondContact OD1-NZ 3Å
382	Q	59.3	Low	60.6	Low	139 Å²	139	108.7 Å²	108.7	65%	0.65	55%	0.545	S	S	*	.	H	α-helix	trans	-65.1	-43.3	173	-71.7	177.1	-18.2	0	0	111.5	K378 L379 E380 S385	K378-Q382 PolarHBondContact O-N 2.89Å; L379-Q382 PolarHBondContact O-N 3.08Å; E380-Q382 VanDerWaalsContact C-N 3.33Å; E380-Q382 PolarHBondContact O-N 3.19Å; Q382-S385 PolarHBondContact O-N 3.22Å
383	L	58.8	Low	59.7	Low	137 Å²	137	108.5 Å²	108.5	72%	0.717	55%	0.548	S	S	*	.	H	α-helix	trans	-65.6	-41.4	177.6	-141.6	83.1	0	0	0	112.5	L379 E380	L379-L383 PolarHBondContact O-N 3.34Å; E380-L383 PolarHBondContact O-N 3.16Å
384	I	56.7	Low	59.2	Low	78 Å²	78	108.4 Å²	108.4	40%	0.4	55%	0.553	S	S	.	*	H	α-helix	trans	-74.6	-27.4	179	-66.5	165.2	0	0	0	110.9	E380 M386 N387	E380-I384 HydrophobicContact CB-CD1 4.31Å; E380-I384 VanDerWaalsContact O-CB 3.27Å; E380-I384 WeakPolarHBondContact O-CB 3.43Å; E380-I384 WeakPolarHBondContact O-CD1 3.4Å; E380-I384 WeakPolarHBondContact O-CG1 3.37Å; E380-I384 PolarHBondContact O-N 2.91Å; I384-M386 PolarHBondContact O-N 2.97Å; I384-M386 VanDerWaalsContact O-N 3.11Å; I384-N387 CarbonylContact O-C 3.59Å; I384-N387 WeakPolarHBondContact O-CA 3.26Å; I384-N387 PolarHBondContact O-N 3.28Å
385	S	52.4	Low	58.7	Low	105 Å²	105	113.5 Å²	113.5	73%	0.734	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.4	-18.1	177	-171.3	0	0	0	0	114	N381 Q382	N381-S385 VanDerWaalsContact O-CB 3.23Å; N381-S385 WeakPolarHBondContact O-CB 3.39Å; N381-S385 PolarHBondContact O-N 3.04Å; Q382-S385 PolarHBondContact O-N 3.22Å
386	M	52.9	Low	58.4	Low	169 Å²	169	116.5 Å²	116.5	83%	0.833	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	-25.7	169.7	-69.5	-66.8	-176.4	0	0	112.7	I384	I384-M386 PolarHBondContact O-N 2.97Å; I384-M386 VanDerWaalsContact O-N 3.11Å
387	N	54.5	Low	57.9	Low	116 Å²	116	115.3 Å²	115.3	62%	0.62	58%	0.576	S	S	*	*	S	Bend	trans	-101.4	109.2	-176.4	-71.9	-48.6	0	0	0	110.6	I384 L389	I384-N387 CarbonylContact O-C 3.59Å; I384-N387 WeakPolarHBondContact O-CA 3.26Å; I384-N387 PolarHBondContact O-N 3.28Å; N387-L389 PolarHBondContact O-N 2.98Å
388	K	52.8	Low	57.7	Low	216 Å²	216	119.7 Å²	119.7	94%	0.939	60%	0.599	S	S	*	*			trans	-67.9	23.8	-164.8	-124.2	173.4	-173.3	174.1	0	117.3
389	L	50.9	Low	57.6	Low	133 Å²	133	121.7 Å²	121.7	70%	0.696	61%	0.608	S	S	*	*			trans	-103.7	151.8	-175.8	-103.9	85.8	0	0	0	114.2	N387	N387-L389 PolarHBondContact O-N 2.98Å
390	N	52.6	Low	57.5	Low	91 Å²	91	121.5 Å²	121.5	49%	0.487	60%	0.602	S	S	.	*			trans	72.2	65.8	159.8	-54.7	-30.9	0	0	0	119	Q392 L393	N390-Q392 PolarHBondContact O-N 2.72Å; N390-Q392 VanDerWaalsContact O-N 3.11Å; N390-L393 HydrophobicContact CB-CB 3.93Å; N390-L393 HydrophobicContact CB-CD1 3.92Å; N390-L393 HydrophobicContact CB-CG 4.39Å; N390-L393 PolarHBondContact O-N 2.73Å
391	K	53.8	Low	57.5	Low	195 Å²	195	118.9 Å²	118.9	85%	0.848	59%	0.59	S	S	*	*	H	α-helix	trans	-48.5	-31.6	157.1	-82.4	-174.1	174.1	-179.5	0	113.3	C394	K391-C394 VanDerWaalsContact O-CB 3.26Å; K391-C394 WeakPolarHBondContact O-CB 3.36Å; K391-C394 PolarHBondContact O-N 3.21Å
392	Q	49.3	Very low	58	Low	172 Å²	172	119.3 Å²	119.3	80%	0.804	59%	0.592	S	S	*	*	H	α-helix	trans	-73.1	-27	177.4	-76.3	-175.6	-16.4	0	0	114.6	N390 C394	N390-Q392 PolarHBondContact O-N 2.72Å; N390-Q392 VanDerWaalsContact O-N 3.11Å; Q392-C394 VanDerWaalsContact C-N 3.29Å
393	L	51.2	Low	58.5	Low	101 Å²	101	115.5 Å²	115.5	53%	0.529	58%	0.576	S	S	.	*	H	α-helix	trans	-68.6	-34.5	171.8	-106	75	0	0	0	110.9	N390 N395 K396 K397	N390-L393 HydrophobicContact CB-CB 3.93Å; N390-L393 HydrophobicContact CB-CD1 3.92Å; N390-L393 HydrophobicContact CB-CG 4.39Å; N390-L393 PolarHBondContact O-N 2.73Å; L393-N395 VanDerWaalsContact C-N 3.35Å; L393-N395 PolarHBondContact O-N 3.02Å; L393-K396 PolarHBondContact O-N 3.12Å; L393-K397 WeakPolarHBondContact O-CB 3.37Å; L393-K397 PolarHBondContact O-N 2.92Å
394	C	57.5	Low	59.1	Low	72 Å²	72	109.4 Å²	109.4	49%	0.486	54%	0.544	S	S	.	.	H	α-helix	trans	-52.7	-49.9	-178.4	-167.9	0	0	0	0	111.7	K391 Q392 K396 K397 L398	K391-C394 VanDerWaalsContact O-CB 3.26Å; K391-C394 WeakPolarHBondContact O-CB 3.36Å; K391-C394 PolarHBondContact O-N 3.21Å; Q392-C394 VanDerWaalsContact C-N 3.29Å; C394-K396 PolarHBondContact O-N 3.45Å; C394-K397 PolarHBondContact O-N 3.42Å; C394-L398 WeakPolarHBondContact O-CB 3.16Å; C394-L398 PolarHBondContact O-N 2.87Å
395	N	58	Low	59.8	Low	122 Å²	122	107.8 Å²	107.8	65%	0.652	54%	0.536	S	S	*	.	H	α-helix	trans	-62	-43.3	-178.8	-68.3	10	0	0	0	112.9	L393 F399	L393-N395 VanDerWaalsContact C-N 3.35Å; L393-N395 PolarHBondContact O-N 3.02Å; N395-F399 WeakPolarHBondContact O-CB 3.35Å; N395-F399 PolarHBondContact O-N 2.85Å
396	K	63.5	Low	60.8	Low	168 Å²	168	106.6 Å²	106.6	73%	0.73	52%	0.521	S	S	*	.	H	α-helix	trans	-68.6	-40.7	177.7	-74	-167.4	174.5	-170.3	0	112	L393 C394 F399 F400	L393-K396 PolarHBondContact O-N 3.12Å; C394-K396 PolarHBondContact O-N 3.45Å; K396-F399 PolarHBondContact O-N 3.4Å; K396-F400 PolarHBondContact O-N 3.31Å
397	K	60.3	Low	61.9	Low	36 Å²	36	104.3 Å²	104.3	16%	0.157	51%	0.506	C	S	.	.	H	α-helix	trans	-71.6	-35.3	179.7	-166.8	161.2	176.7	-175.8	0	112.1	I377 E380 N381 L393 C394 F400 E401	I377-K397 HydrophobicContact CG2-CG 4.35Å; I377-K397 WeakPolarHBondContact O-CE 3.49Å; I377-K397 PolarHBondContact O-NZ 3.23Å; E380-K397 IonicContact OE2-NZ 3.31Å; E380-K397 PolarHBondContact OE2-NZ 2.85Å; N381-K397 VanDerWaalsContact OD1-CD 3.23Å; N381-K397 WeakPolarHBondContact OD1-CD 3.38Å; N381-K397 WeakPolarHBondContact OD1-CE 3.3Å; N381-K397 PolarHBondContact OD1-NZ 3Å; L393-K397 WeakPolarHBondContact O-CB 3.37Å; L393-K397 PolarHBondContact O-N 2.92Å; C394-K397 PolarHBondContact O-N 3.42Å; K397-F400 PolarHBondContact O-N 3.46Å; K397-E401 WeakPolarHBondContact O-CB 3.32Å; K397-E401 PolarHBondContact O-N 3.1Å
398	L	63.3	Low	62.9	Low	100 Å²	100	99.9 Å²	99.9	52%	0.524	48%	0.483	S	S	.	.	H	α-helix	trans	-68.4	-40.8	173.7	-166.6	158.7	0	0	0	111.5	C394 F400 E401 L402	C394-L398 WeakPolarHBondContact O-CB 3.16Å; C394-L398 PolarHBondContact O-N 2.87Å; L398-F400 VanDerWaalsContact C-N 3.32Å; L398-F400 PolarHBondContact O-N 3.25Å; L398-E401 PolarHBondContact O-N 3.1Å; L398-L402 WeakPolarHBondContact O-CB 3.46Å; L398-L402 PolarHBondContact O-N 2.97Å
399	F	66.4	Low	63.9	Low	135 Å²	135	95 Å²	95	59%	0.592	46%	0.459	S	S	*	.	H	α-helix	trans	-62	-38.5	171.1	-176.3	-109.9	0	0	0	112.1	N395 K396 N403	N395-F399 WeakPolarHBondContact O-CB 3.35Å; N395-F399 PolarHBondContact O-N 2.85Å; K396-F399 PolarHBondContact O-N 3.4Å; F399-N403 WeakPolarHBondContact CD1-ND2 3.41Å; F399-N403 WeakPolarHBondContact CE1-ND2 3.16Å; F399-N403 VanDerWaalsContact CZ-ND2 3.29Å; F399-N403 WeakPolarHBondContact CZ-ND2 3.46Å; F399-N403 WeakPolarHBondContact O-CB 3.35Å; F399-N403 PolarHBondContact O-N 3.32Å; F399-N403 PolarHBondContact O-ND2 3.05Å
400	F	66.9	Low	65.1	Low	104 Å²	104	93 Å²	93	46%	0.456	45%	0.449	S	S	.	.	H	α-helix	trans	-66.6	-44.3	174.6	-169.8	-122.3	0	0	0	112.2	L373 I377 K396 K397 L398 L402 N403 L404	L373-F400 HydrophobicContact CD2-CZ 4.43Å; I377-F400 HydrophobicContact CD1-CD1 3.7Å; I377-F400 HydrophobicContact CD1-CE1 3.66Å; K396-F400 PolarHBondContact O-N 3.31Å; K397-F400 PolarHBondContact O-N 3.46Å; L398-F400 VanDerWaalsContact C-N 3.32Å; L398-F400 PolarHBondContact O-N 3.25Å; F400-L402 PolarHBondContact O-N 2.87Å; F400-N403 PolarHBondContact O-N 3.1Å; F400-L404 HydrophobicContact CD1-CD1 4.02Å; F400-L404 HydrophobicContact CE1-CD1 3.8Å; F400-L404 HydrophobicContact CZ-CD1 4.13Å; F400-L404 WeakPolarHBondContact O-CG 3.35Å; F400-L404 PolarHBondContact O-N 3.46Å
401	E	66	Low	66.2	Low	49 Å²	49	89.9 Å²	89.9	23%	0.229	43%	0.432	C	S	.	.	H	α-helix	trans	-61.5	-42.2	175.5	-170.8	173.9	163.2	0	0	111.9	K378 K397 L398 L404 L405	K378-E401 WeakPolarHBondContact CE-OE1 3.09Å; K378-E401 IonicContact NZ-OE1 2.64Å; K378-E401 PolarHBondContact NZ-OE1 3.02Å; K397-E401 WeakPolarHBondContact O-CB 3.32Å; K397-E401 PolarHBondContact O-N 3.1Å; L398-E401 PolarHBondContact O-N 3.1Å; E401-L404 PolarHBondContact O-N 3.44Å; E401-L405 WeakPolarHBondContact O-CB 3.43Å; E401-L405 PolarHBondContact O-N 3.23Å
402	L	70.8	Confident	67.1	Low	68 Å²	68	81.6 Å²	81.6	36%	0.356	40%	0.397	S	S	.	.	H	α-helix	trans	-60.6	-46.2	174.5	-168.7	80.8	0	0	0	111.7	L398 F400 L404 L405 I406	L398-L402 WeakPolarHBondContact O-CB 3.46Å; L398-L402 PolarHBondContact O-N 2.97Å; F400-L402 PolarHBondContact O-N 2.87Å; L402-L404 VanDerWaalsContact C-N 3.31Å; L402-L404 PolarHBondContact O-N 2.83Å; L402-L405 PolarHBondContact O-N 3.4Å; L402-I406 HydrophobicContact CD2-CD1 4.38Å; L402-I406 HydrophobicContact CG-CD1 4.09Å; L402-I406 VanDerWaalsContact O-CG1 3.31Å; L402-I406 WeakPolarHBondContact O-CG1 3.41Å; L402-I406 PolarHBondContact O-N 2.85Å
403	N	70.9	Confident	68.4	Low	58 Å²	58	76 Å²	76	31%	0.31	37%	0.373	S	S	.	.	H	α-helix	trans	-64.3	-34	177.6	-79.3	-59.4	0	0	0	112.7	F399 F400 K407	F399-N403 WeakPolarHBondContact CD1-ND2 3.41Å; F399-N403 WeakPolarHBondContact CE1-ND2 3.16Å; F399-N403 VanDerWaalsContact CZ-ND2 3.29Å; F399-N403 WeakPolarHBondContact CZ-ND2 3.46Å; F399-N403 WeakPolarHBondContact O-CB 3.35Å; F399-N403 PolarHBondContact O-N 3.32Å; F399-N403 PolarHBondContact O-ND2 3.05Å; F400-N403 PolarHBondContact O-N 3.1Å; N403-K407 WeakPolarHBondContact O-CG 3.32Å; N403-K407 PolarHBondContact O-N 3.34Å; N403-K407 VanDerWaalsContact O-N 3.09Å
404	L	71.5	Confident	69.8	Low	9 Å²	9	74.2 Å²	74.2	5%	0.047	36%	0.361	C	S	.	.	H	α-helix	trans	-71	-38.5	173	-69.6	173.6	0	0	0	112	I370 L373 I374 I377 F400 E401 L402 K407 L408	I370-L404 HydrophobicContact CG2-CB 4.37Å; I370-L404 HydrophobicContact CG2-CD2 4.45Å; L373-L404 HydrophobicContact CD2-CD1 3.79Å; L373-L404 HydrophobicContact CD2-CD2 3.76Å; L373-L404 HydrophobicContact CD2-CG 4.45Å; L373-L404 HydrophobicContact CG-CD1 3.84Å; I374-L404 HydrophobicContact CD1-CB 4Å; I374-L404 HydrophobicContact CG1-CB 3.82Å; I374-L404 HydrophobicContact CG1-CD1 4.17Å; I377-L404 HydrophobicContact CD1-CD1 3.29Å; F400-L404 HydrophobicContact CD1-CD1 4.02Å; F400-L404 HydrophobicContact CE1-CD1 3.8Å; F400-L404 HydrophobicContact CZ-CD1 4.13Å; F400-L404 WeakPolarHBondContact O-CG 3.35Å; F400-L404 PolarHBondContact O-N 3.46Å; E401-L404 PolarHBondContact O-N 3.44Å; L402-L404 VanDerWaalsContact C-N 3.31Å; L402-L404 PolarHBondContact O-N 2.83Å; L404-K407 PolarHBondContact O-N 2.78Å; L404-L408 WeakPolarHBondContact O-CB 3.36Å; L404-L408 PolarHBondContact O-N 2.87Å
405	L	71.3	Confident	70.8	Confident	45 Å²	45	71.2 Å²	71.2	24%	0.236	34%	0.34	C	S	.	.	H	α-helix	trans	-64.8	-40.1	175.4	-165.4	71.4	0	0	0	111.7	E401 L402 L408 Y409 L545	E401-L405 WeakPolarHBondContact O-CB 3.43Å; E401-L405 PolarHBondContact O-N 3.23Å; L402-L405 PolarHBondContact O-N 3.4Å; L405-L408 PolarHBondContact O-N 3.44Å; L405-Y409 WeakPolarHBondContact O-CB 3.4Å; L405-Y409 PolarHBondContact O-N 3.44Å; L405-L545 HydrophobicContact CD2-CG 4.48Å
406	I	73.5	Confident	71.6	Confident	80 Å²	80	67.3 Å²	67.3	41%	0.41	32%	0.318	S	S	.	.	H	α-helix	trans	-63.9	-43.5	174	-68.5	163.5	0	0	0	110.9	L402 Y409 N410	L402-I406 HydrophobicContact CD2-CD1 4.38Å; L402-I406 HydrophobicContact CG-CD1 4.09Å; L402-I406 VanDerWaalsContact O-CG1 3.31Å; L402-I406 WeakPolarHBondContact O-CG1 3.41Å; L402-I406 PolarHBondContact O-N 2.85Å; I406-Y409 PolarHBondContact O-N 2.89Å; I406-N410 VanDerWaalsContact O-CG 3.23Å; I406-N410 PolarHBondContact O-N 3.38Å; I406-N410 PolarHBondContact O-OD1 2.79Å
407	K	76	Confident	72.5	Confident	120 Å²	120	62.8 Å²	62.8	52%	0.522	30%	0.3	S	S	.	.	H	α-helix	trans	-61.7	-44.3	174.4	-75.3	175	176.9	-175.7	0	112	I370 N403 L404 N410 I411	I370-K407 HydrophobicContact CD1-CB 4.13Å; N403-K407 WeakPolarHBondContact O-CG 3.32Å; N403-K407 PolarHBondContact O-N 3.34Å; N403-K407 VanDerWaalsContact O-N 3.09Å; L404-K407 PolarHBondContact O-N 2.78Å; K407-N410 PolarHBondContact O-N 2.85Å; K407-I411 WeakPolarHBondContact O-CD1 3.43Å; K407-I411 VanDerWaalsContact O-CG1 3.3Å; K407-I411 WeakPolarHBondContact O-CG1 3.37Å; K407-I411 PolarHBondContact O-N 3.19Å; K407-I411 VanDerWaalsContact O-N 3.08Å
408	L	74.6	Confident	73.4	Confident	24 Å²	24	61.1 Å²	61.1	13%	0.126	29%	0.292	C	S	.	.	H	α-helix	trans	-60.7	-45	176.8	-175.5	63.6	0	0	0	111.4	V367 I370 I374 L404 L405 I411 L412	V367-L408 HydrophobicContact CB-CD1 4.35Å; V367-L408 HydrophobicContact CG1-CD1 3.99Å; V367-L408 HydrophobicContact CG2-CD1 4.37Å; I370-L408 HydrophobicContact CG2-CB 3.98Å; I370-L408 HydrophobicContact CG2-CD1 4.34Å; I374-L408 HydrophobicContact CD1-CD2 4.05Å; L404-L408 WeakPolarHBondContact O-CB 3.36Å; L404-L408 PolarHBondContact O-N 2.87Å; L405-L408 PolarHBondContact O-N 3.44Å; L408-I411 PolarHBondContact O-N 3.2Å; L408-L412 HydrophobicContact CD1-CD1 4.23Å; L408-L412 HydrophobicContact CD1-CG 4.46Å; L408-L412 HydrophobicContact CG-CD1 3.99Å; L408-L412 WeakPolarHBondContact O-CB 3.34Å; L408-L412 VanDerWaalsContact O-CG 3.31Å; L408-L412 WeakPolarHBondContact O-CG 3.29Å; L408-L412 PolarHBondContact O-N 3.42Å
409	Y	73.7	Confident	74	Confident	113 Å²	113	58 Å²	58	44%	0.443	28%	0.275	S	S	.	.	H	α-helix	trans	-59.1	-48.5	175.3	176.1	-93.2	0	0	0	111.8	L405 I406 I411 L412 N413 L552	L405-Y409 WeakPolarHBondContact O-CB 3.4Å; L405-Y409 PolarHBondContact O-N 3.44Å; I406-Y409 PolarHBondContact O-N 2.89Å; Y409-I411 VanDerWaalsContact C-N 3.34Å; Y409-I411 PolarHBondContact O-N 3.24Å; Y409-L412 PolarHBondContact O-N 2.93Å; Y409-N413 WeakPolarHBondContact O-CB 3.5Å; Y409-N413 PolarHBondContact O-N 2.9Å; Y409-L552 HydrophobicContact CD2-CD2 4.2Å
410	N	76.2	Confident	74.4	Confident	91 Å²	91	56 Å²	56	49%	0.487	27%	0.266	S	S	.	.	H	α-helix	trans	-60.6	-42.1	179.9	-68.6	-5.1	0	0	0	112.2	I406 K407 N413 E414	I406-N410 VanDerWaalsContact O-CG 3.23Å; I406-N410 PolarHBondContact O-N 3.38Å; I406-N410 PolarHBondContact O-OD1 2.79Å; K407-N410 PolarHBondContact O-N 2.85Å; N410-N413 PolarHBondContact O-N 3.07Å; N410-E414 PolarHBondContact O-N 3.22Å
411	I	74.6	Confident	74.9	Confident	26 Å²	26	56.1 Å²	56.1	13%	0.133	27%	0.27	C	S	.	.	H	α-helix	trans	-70.2	-39.9	179.4	-66.3	161.5	0	0	0	111.1	L363 V367 I370 K407 L408 Y409 N413 E414 I415	L363-I411 HydrophobicContact CB-CG2 4.14Å; L363-I411 HydrophobicContact CD2-CG2 3.87Å; V367-I411 HydrophobicContact CG2-CB 4.43Å; V367-I411 HydrophobicContact CG2-CG2 3.52Å; I370-I411 HydrophobicContact CD1-CD1 3.43Å; I370-I411 VanDerWaalsContact CD1-CD1 3.43Å; K407-I411 WeakPolarHBondContact O-CD1 3.43Å; K407-I411 VanDerWaalsContact O-CG1 3.3Å; K407-I411 WeakPolarHBondContact O-CG1 3.37Å; K407-I411 PolarHBondContact O-N 3.19Å; K407-I411 VanDerWaalsContact O-N 3.08Å; L408-I411 PolarHBondContact O-N 3.2Å; Y409-I411 VanDerWaalsContact C-N 3.34Å; Y409-I411 PolarHBondContact O-N 3.24Å; I411-N413 VanDerWaalsContact C-N 3.34Å; I411-E414 PolarHBondContact O-N 3.23Å; I411-I415 HydrophobicContact CG2-CD1 4.39Å; I411-I415 WeakPolarHBondContact O-CG1 3.43Å; I411-I415 PolarHBondContact O-N 2.83Å
412	L	74.3	Confident	75.6	Confident	20 Å²	20	56.9 Å²	56.9	11%	0.105	27%	0.271	C	S	.	.	H	α-helix	trans	-66.2	-36.8	174.2	-72.6	171.5	0	0	0	111.8	V367 L408 Y409 I415 H416 L552 F556	V367-L412 HydrophobicContact CG1-CD2 4.25Å; V367-L412 HydrophobicContact CG2-CD2 3.9Å; V367-L412 HydrophobicContact CG2-CG 4.26Å; L408-L412 HydrophobicContact CD1-CD1 4.23Å; L408-L412 HydrophobicContact CD1-CG 4.46Å; L408-L412 HydrophobicContact CG-CD1 3.99Å; L408-L412 WeakPolarHBondContact O-CB 3.34Å; L408-L412 VanDerWaalsContact O-CG 3.31Å; L408-L412 WeakPolarHBondContact O-CG 3.29Å; L408-L412 PolarHBondContact O-N 3.42Å; Y409-L412 PolarHBondContact O-N 2.93Å; L412-I415 PolarHBondContact O-N 2.88Å; L412-H416 WeakPolarHBondContact O-CB 3.12Å; L412-H416 PolarHBondContact O-N 2.77Å; L412-L552 HydrophobicContact CD1-CD2 3.88Å; L412-F556 HydrophobicContact CD2-CD2 4.4Å; L412-F556 HydrophobicContact CD2-CE2 4.5Å
413	N	76.4	Confident	76	Confident	55 Å²	55	56.2 Å²	56.2	29%	0.294	27%	0.272	S	S	.	.	H	α-helix	trans	-65.1	-39.9	172.2	-177.9	81.7	0	0	0	111.7	Y409 N410 I411 H416 E417	Y409-N413 WeakPolarHBondContact O-CB 3.5Å; Y409-N413 PolarHBondContact O-N 2.9Å; N410-N413 PolarHBondContact O-N 3.07Å; I411-N413 VanDerWaalsContact C-N 3.34Å; N413-H416 PolarHBondContact O-N 2.86Å; N413-E417 PolarHBondContact ND2-OE1 2.74Å; N413-E417 WeakPolarHBondContact O-CB 3.07Å; N413-E417 WeakPolarHBondContact O-CG 3.49Å; N413-E417 PolarHBondContact O-N 2.87Å
414	E	81.1	Confident	76.2	Confident	63 Å²	63	58.8 Å²	58.8	29%	0.294	29%	0.285	S	S	.	.	H	α-helix	trans	-65.4	-38.1	175.4	-172.9	170.9	-168.9	0	0	112.4	K359 L363 N410 I411 E417 I418	K359-E414 WeakPolarHBondContact CE-OE1 3.23Å; K359-E414 IonicContact NZ-OE1 2.61Å; K359-E414 PolarHBondContact NZ-OE1 3.11Å; L363-E414 HydrophobicContact CD1-CB 4.46Å; L363-E414 HydrophobicContact CD1-CG 3.89Å; L363-E414 HydrophobicContact CD2-CG 4.39Å; L363-E414 VanDerWaalsContact CD2-OE2 3.31Å; L363-E414 WeakPolarHBondContact CD2-OE2 3.27Å; N410-E414 PolarHBondContact O-N 3.22Å; I411-E414 PolarHBondContact O-N 3.23Å; E414-E417 PolarHBondContact O-N 3.27Å; E414-I418 HydrophobicContact CG-CD1 4.24Å; E414-I418 WeakPolarHBondContact O-CD1 3.44Å; E414-I418 VanDerWaalsContact O-CG1 3.26Å; E414-I418 WeakPolarHBondContact O-CG1 3.39Å; E414-I418 PolarHBondContact O-N 2.05Å
415	I	76.7	Confident	76.4	Confident	9 Å²	9	67 Å²	67	5%	0.046	32%	0.32	C	S	.	.	H	α-helix	trans	-62.7	-47.3	170.8	-68.4	169	0	0	0	110.3	L363 I364 V367 I411 L412 E417 I418 F419 I559	L363-I415 HydrophobicContact CB-CD1 4.01Å; L363-I415 HydrophobicContact CB-CG1 3.87Å; L363-I415 HydrophobicContact CD1-CG1 4.2Å; I364-I415 HydrophobicContact CG1-CD1 4.2Å; V367-I415 HydrophobicContact CG2-CD1 3.85Å; I411-I415 HydrophobicContact CG2-CD1 4.39Å; I411-I415 WeakPolarHBondContact O-CG1 3.43Å; I411-I415 PolarHBondContact O-N 2.83Å; L412-I415 PolarHBondContact O-N 2.88Å; I415-E417 VanDerWaalsContact C-N 3.34Å; I415-E417 PolarHBondContact O-N 3.46Å; I415-I418 PolarHBondContact O-N 3.35Å; I415-F419 HydrophobicContact CG2-CD2 3.9Å; I415-F419 HydrophobicContact CG2-CE2 4.17Å; I415-F419 WeakPolarHBondContact O-CD2 3.44Å; I415-F419 PolarHBondContact O-N 3.31Å; I415-F419 VanDerWaalsContact O-N 3.07Å; I415-I559 HydrophobicContact CG2-CD1 4.34Å
416	H	76.6	Confident	76.8	Confident	41 Å²	41	69.6 Å²	69.6	19%	0.19	33%	0.331	C	S	.	.	H	α-helix	trans	-60.5	-41.6	177.7	176.3	-97.9	0	0	0	112.1	L412 N413 F419 F420 Q555	L412-H416 WeakPolarHBondContact O-CB 3.12Å; L412-H416 PolarHBondContact O-N 2.77Å; N413-H416 PolarHBondContact O-N 2.86Å; H416-F419 PolarHBondContact O-N 3.28Å; H416-F420 AromaticContact CD2-CD2 3.36Å; H416-F420 WeakPolarHBondContact CD2-CD2 3.49Å; H416-F420 AromaticContact CD2-CE2 3.98Å; H416-F420 AromaticContact NE2-CD2 3.96Å; H416-F420 WeakPolarHBondContact O-CB 3.42Å; H416-F420 WeakPolarHBondContact O-CD2 3.35Å; H416-F420 PolarHBondContact O-N 2.87Å; H416-Q555 PolarHBondContact CD2-NE2 2.91Å; H416-Q555 VanDerWaalsContact CD2-NE2 3.26Å; H416-Q555 PolarHBondContact CD2-OE1 3.3Å; H416-Q555 PolarHBondContact NE2-NE2 3.27Å
417	E	81.3	Confident	77.1	Confident	73 Å²	73	66.5 Å²	66.5	34%	0.341	32%	0.315	S	S	.	.	I	π-helix	trans	-58.6	-49.9	174	-83	178.2	-153.1	0	0	111.4	N413 E414 I415 F419 I421 W422	N413-E417 PolarHBondContact ND2-OE1 2.74Å; N413-E417 WeakPolarHBondContact O-CB 3.07Å; N413-E417 WeakPolarHBondContact O-CG 3.49Å; N413-E417 PolarHBondContact O-N 2.87Å; E414-E417 PolarHBondContact O-N 3.27Å; I415-E417 VanDerWaalsContact C-N 3.34Å; I415-E417 PolarHBondContact O-N 3.46Å; E417-F419 VanDerWaalsContact C-N 3.34Å; E417-F419 PolarHBondContact O-N 2.74Å; E417-I421 HydrophobicContact CG-CB 4.47Å; E417-I421 HydrophobicContact CG-CD1 3.94Å; E417-I421 CarbonylContact O-C 3.59Å; E417-I421 PolarHBondContact O-N 3.35Å; E417-W422 VanDerWaalsContact C-CD1 3.48Å; E417-W422 PolarHBondContact O-N 3.43Å
418	I	79.1	Confident	77	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	31%	0.312	C	S	.	.	I	π-helix	trans	-59.8	-40.9	-179.5	-68.8	163.9	0	0	0	112.1	L354 K359 V360 L363 E414 I415 W422 Q427 L430	L354-I418 HydrophobicContact CD2-CG2 4.17Å; K359-I418 HydrophobicContact CD-CD1 4.15Å; V360-I418 HydrophobicContact CG2-CD1 4.1Å; V360-I418 HydrophobicContact CG2-CG2 3.9Å; L363-I418 HydrophobicContact CD1-CD1 3.74Å; E414-I418 HydrophobicContact CG-CD1 4.24Å; E414-I418 WeakPolarHBondContact O-CD1 3.44Å; E414-I418 VanDerWaalsContact O-CG1 3.26Å; E414-I418 WeakPolarHBondContact O-CG1 3.39Å; E414-I418 PolarHBondContact O-N 2.05Å; I415-I418 PolarHBondContact O-N 3.35Å; I418-W422 HydrophobicContact CB-CD2 4.42Å; I418-W422 HydrophobicContact CG1-CD2 4.04Å; I418-W422 HydrophobicContact CG1-CE3 4.12Å; I418-W422 HydrophobicContact CG1-CH2 3.91Å; I418-W422 HydrophobicContact CG1-CZ2 3.78Å; I418-W422 HydrophobicContact CG1-CZ3 4.06Å; I418-W422 HydrophobicContact CG2-CE3 4.44Å; I418-Q427 WeakPolarHBondContact O-CG 3.29Å; I418-Q427 PolarHBondContact O-NE2 3.03Å; I418-L430 HydrophobicContact CG2-CD2 3.98Å
419	F	75.1	Confident	77.2	Confident	34 Å²	34	66.8 Å²	66.8	15%	0.149	33%	0.326	C	S	.	.	I	π-helix	trans	-87	-33.5	-175.7	-79.2	-77	0	0	0	114.9	I351 L354 L355 V360 I415 H416 E417 Q427	I351-F419 HydrophobicContact CG2-CE1 4.14Å; L354-F419 HydrophobicContact CB-CE1 3.63Å; L354-F419 HydrophobicContact CB-CZ 3.79Å; L354-F419 HydrophobicContact CD1-CD1 3.91Å; L354-F419 HydrophobicContact CD1-CE1 3.77Å; L354-F419 HydrophobicContact CG-CE1 4.36Å; L355-F419 HydrophobicContact CD2-CE2 4.29Å; L355-F419 HydrophobicContact CD2-CZ 3.73Å; L355-F419 HydrophobicContact CG-CE1 4.42Å; L355-F419 HydrophobicContact CG-CZ 3.87Å; V360-F419 HydrophobicContact CG1-CE2 3.79Å; V360-F419 HydrophobicContact CG1-CZ 4.04Å; V360-F419 HydrophobicContact CG2-CE2 4.44Å; I415-F419 HydrophobicContact CG2-CD2 3.9Å; I415-F419 HydrophobicContact CG2-CE2 4.17Å; I415-F419 WeakPolarHBondContact O-CD2 3.44Å; I415-F419 PolarHBondContact O-N 3.31Å; I415-F419 VanDerWaalsContact O-N 3.07Å; H416-F419 PolarHBondContact O-N 3.28Å; E417-F419 VanDerWaalsContact C-N 3.34Å; E417-F419 PolarHBondContact O-N 2.74Å; F419-Q427 PolarHBondContact O-NE2 2.83Å; F419-Q427 VanDerWaalsContact O-NE2 3.13Å
420	F	75.5	Confident	77.5	Confident	94 Å²	94	62.4 Å²	62.4	41%	0.412	31%	0.31	S	S	.	.	I	π-helix	trans	-119.4	-21.4	-169	-58.2	-81.7	0	0	0	115.3	H416 L558 L562	H416-F420 AromaticContact CD2-CD2 3.36Å; H416-F420 WeakPolarHBondContact CD2-CD2 3.49Å; H416-F420 AromaticContact CD2-CE2 3.98Å; H416-F420 AromaticContact NE2-CD2 3.96Å; H416-F420 WeakPolarHBondContact O-CB 3.42Å; H416-F420 WeakPolarHBondContact O-CD2 3.35Å; H416-F420 PolarHBondContact O-N 2.87Å; F420-L558 HydrophobicContact CE1-CD2 3.96Å; F420-L558 HydrophobicContact CZ-CD2 3.78Å; F420-L562 HydrophobicContact CE1-CD1 4.41Å; F420-L562 HydrophobicContact CZ-CD1 3.73Å
421	I	78.2	Confident	77.6	Confident	107 Å²	107	59 Å²	59	55%	0.549	29%	0.292	S	S	.	.	I	π-helix	trans	-110.3	-33.3	-175.2	-57.4	178	0	0	0	111.6	E417	E417-I421 HydrophobicContact CG-CB 4.47Å; E417-I421 HydrophobicContact CG-CD1 3.94Å; E417-I421 CarbonylContact O-C 3.59Å; E417-I421 PolarHBondContact O-N 3.35Å
422	W	81	Confident	77.6	Confident	64 Å²	64	60.2 Å²	60.2	24%	0.242	30%	0.302	C	S	.	.	S	Bend	trans	-67	134.1	176.3	-74.6	23.7	0	0	0	111	E417 I418 Q426 Q427 L430	E417-W422 VanDerWaalsContact C-CD1 3.48Å; E417-W422 PolarHBondContact O-N 3.43Å; I418-W422 HydrophobicContact CB-CD2 4.42Å; I418-W422 HydrophobicContact CG1-CD2 4.04Å; I418-W422 HydrophobicContact CG1-CE3 4.12Å; I418-W422 HydrophobicContact CG1-CH2 3.91Å; I418-W422 HydrophobicContact CG1-CZ2 3.78Å; I418-W422 HydrophobicContact CG1-CZ3 4.06Å; I418-W422 HydrophobicContact CG2-CE3 4.44Å; W422-Q426 HydrophobicContact CB-CB 4.14Å; W422-Q426 HydrophobicContact CD2-CB 4.33Å; W422-Q426 HydrophobicContact CE3-CB 4.01Å; W422-Q426 HydrophobicContact CG-CB 4.42Å; W422-Q427 HydrophobicContact CB-CG 4.11Å; W422-Q427 PolarHBondContact O-NE2 3.03Å; W422-L430 HydrophobicContact CZ3-CB 4.13Å; W422-L430 HydrophobicContact CZ3-CD1 4.28Å; W422-L430 HydrophobicContact CZ3-CD2 3.97Å; W422-L430 HydrophobicContact CZ3-CG 4.35Å
423	S	79.2	Confident	77.6	Confident	54 Å²	54	64.1 Å²	64.1	38%	0.378	32%	0.322	S	S	.	.			trans	-62.2	154.9	173	65.7	0	0	0	0	111.5	K425 Q426 Q427	S423-K425 PolarHBondContact O-N 3.41Å; S423-K425 VanDerWaalsContact O-N 3.1Å; S423-Q426 WeakPolarHBondContact O-CA 3.43Å; S423-Q426 WeakPolarHBondContact O-CB 3.3Å; S423-Q426 PolarHBondContact O-N 2.97Å; S423-Q426 WeakPolarHBondContact OG-CG 3.27Å; S423-Q426 PolarHBondContact OG-N 3.35Å; S423-Q426 PolarHBondContact OG-OE1 3.21Å; S423-Q427 PolarHBondContact O-N 3.48Å
424	I	74	Confident	76.9	Confident	112 Å²	112	62 Å²	62	57%	0.574	31%	0.312	S	S	*	.	H	α-helix	trans	-54.4	-33.4	176	-61.5	173.5	0	0	0	111.2	L350 Q427 I428	L350-I424 HydrophobicContact CD2-CG2 4.39Å; I424-Q427 PolarHBondContact O-N 3.12Å; I424-I428 HydrophobicContact CG2-CD1 3.72Å; I424-I428 HydrophobicContact CG2-CG1 4.27Å; I424-I428 WeakPolarHBondContact O-CB 3.42Å; I424-I428 VanDerWaalsContact O-CG1 3.27Å; I424-I428 WeakPolarHBondContact O-CG1 3.41Å; I424-I428 PolarHBondContact O-N 3.1Å
425	K	76.8	Confident	75.8	Confident	182 Å²	182	61.4 Å²	61.4	79%	0.791	31%	0.314	S	S	*	.	H	α-helix	trans	-62	-44.5	173.8	-65.7	-173.2	178.3	-175.9	0	112.4	S423 S429	S423-K425 PolarHBondContact O-N 3.41Å; S423-K425 VanDerWaalsContact O-N 3.1Å; K425-S429 WeakPolarHBondContact O-CB 3.45Å; K425-S429 PolarHBondContact O-N 3.47Å
426	Q	78.4	Confident	74.7	Confident	99 Å²	99	65.5 Å²	65.5	46%	0.463	34%	0.336	S	S	.	.	H	α-helix	trans	-69.5	-38.7	176.7	-70.5	159.6	-59.5	0	0	111.9	W422 S423 S429 L430	W422-Q426 HydrophobicContact CB-CB 4.14Å; W422-Q426 HydrophobicContact CD2-CB 4.33Å; W422-Q426 HydrophobicContact CE3-CB 4.01Å; W422-Q426 HydrophobicContact CG-CB 4.42Å; S423-Q426 WeakPolarHBondContact O-CA 3.43Å; S423-Q426 WeakPolarHBondContact O-CB 3.3Å; S423-Q426 PolarHBondContact O-N 2.97Å; S423-Q426 WeakPolarHBondContact OG-CG 3.27Å; S423-Q426 PolarHBondContact OG-N 3.35Å; S423-Q426 PolarHBondContact OG-OE1 3.21Å; Q426-S429 PolarHBondContact O-N 3.41Å; Q426-L430 PolarHBondContact O-N 2.85Å
427	Q	79.2	Confident	73.4	Confident	15 Å²	15	66.8 Å²	66.8	7%	0.07	35%	0.347	C	S	.	.	H	α-helix	trans	-61.9	-46.2	174.6	-71.9	-179.8	-9.1	0	0	111.9	L354 I418 F419 W422 S423 I424 L430 I431	L354-Q427 HydrophobicContact CD1-CB 4.13Å; L354-Q427 HydrophobicContact CD1-CG 3.95Å; L354-Q427 HydrophobicContact CD2-CB 3.94Å; L354-Q427 HydrophobicContact CD2-CG 4.19Å; L354-Q427 HydrophobicContact CG-CB 4.47Å; I418-Q427 WeakPolarHBondContact O-CG 3.29Å; I418-Q427 PolarHBondContact O-NE2 3.03Å; F419-Q427 PolarHBondContact O-NE2 2.83Å; F419-Q427 VanDerWaalsContact O-NE2 3.13Å; W422-Q427 HydrophobicContact CB-CG 4.11Å; W422-Q427 PolarHBondContact O-NE2 3.03Å; S423-Q427 PolarHBondContact O-N 3.48Å; I424-Q427 PolarHBondContact O-N 3.12Å; Q427-L430 PolarHBondContact O-N 3.1Å; Q427-I431 WeakPolarHBondContact O-CG1 3.35Å; Q427-I431 PolarHBondContact O-N 3.2Å; Q427-I431 VanDerWaalsContact O-N 3.16Å
428	I	75.4	Confident	71.7	Confident	92 Å²	92	66.9 Å²	66.9	47%	0.472	35%	0.349	S	S	.	.	H	α-helix	trans	-65.1	-38.5	175.1	-69.4	171	0	0	0	111.3	L350 I424 I431 S432	L350-I428 HydrophobicContact CD1-CG1 4.04Å; I424-I428 HydrophobicContact CG2-CD1 3.72Å; I424-I428 HydrophobicContact CG2-CG1 4.27Å; I424-I428 WeakPolarHBondContact O-CB 3.42Å; I424-I428 VanDerWaalsContact O-CG1 3.27Å; I424-I428 WeakPolarHBondContact O-CG1 3.41Å; I424-I428 PolarHBondContact O-N 3.1Å; I428-I431 WeakPolarHBondContact O-CB 3.16Å; I428-I431 PolarHBondContact O-N 3.23Å; I428-S432 PolarHBondContact O-N 2.99Å
429	S	77.8	Confident	69.9	Low	58 Å²	58	70 Å²	70	41%	0.406	37%	0.368	S	S	.	.	H	α-helix	trans	-62	-41.2	175	179.7	0	0	0	0	112.5	K425 Q426 I431 S432 I433	K425-S429 WeakPolarHBondContact O-CB 3.45Å; K425-S429 PolarHBondContact O-N 3.47Å; Q426-S429 PolarHBondContact O-N 3.41Å; S429-I431 VanDerWaalsContact C-N 3.3Å; S429-I431 PolarHBondContact O-N 2.83Å; S429-S432 PolarHBondContact O-N 3.08Å; S429-S432 PolarHBondContact O-OG 3.39Å; S429-S432 VanDerWaalsContact O-OG 3.1Å; S429-I433 WeakPolarHBondContact O-CB 3.35Å; S429-I433 WeakPolarHBondContact O-CD1 3.46Å; S429-I433 VanDerWaalsContact O-CG1 3.23Å; S429-I433 WeakPolarHBondContact O-CG1 3.1Å; S429-I433 PolarHBondContact O-N 3.48Å
430	L	80.6	Confident	68.2	Low	21 Å²	21	76 Å²	76	11%	0.11	39%	0.394	C	S	.	.	H	α-helix	trans	-61.6	-40	173.8	-170.4	68.4	0	0	0	111.7	L354 T357 K359 V360 I418 W422 Q426 Q427 S434	L354-L430 HydrophobicContact CD2-CD2 4.18Å; T357-L430 HydrophobicContact CG2-CD2 4.34Å; T357-L430 HydrophobicContact CG2-CG 4.13Å; K359-L430 HydrophobicContact CB-CD1 4.16Å; K359-L430 HydrophobicContact CD-CD1 3.85Å; V360-L430 HydrophobicContact CG2-CD2 4.17Å; I418-L430 HydrophobicContact CG2-CD2 3.98Å; W422-L430 HydrophobicContact CZ3-CB 4.13Å; W422-L430 HydrophobicContact CZ3-CD1 4.28Å; W422-L430 HydrophobicContact CZ3-CD2 3.97Å; W422-L430 HydrophobicContact CZ3-CG 4.35Å; Q426-L430 PolarHBondContact O-N 2.85Å; Q427-L430 PolarHBondContact O-N 3.1Å; L430-S434 WeakPolarHBondContact O-CB 3.31Å; L430-S434 PolarHBondContact O-N 3.08Å
431	I	78.3	Confident	66.6	Low	20 Å²	20	76.2 Å²	76.2	10%	0.103	40%	0.399	C	S	.	.	H	α-helix	trans	-65	-47	175.8	-66	161.5	0	0	0	110.7	L350 Q353 L354 T357 Q427 I428 S429 I433 S434 S435	L350-I431 HydrophobicContact CD1-CD1 3.63Å; Q353-I431 HydrophobicContact CB-CD1 3.59Å; Q353-I431 HydrophobicContact CB-CG1 3.99Å; Q353-I431 HydrophobicContact CB-CG2 4.16Å; L354-I431 HydrophobicContact CD2-CD1 4.2Å; L354-I431 HydrophobicContact CD2-CG1 4.17Å; L354-I431 HydrophobicContact CG-CD1 4.12Å; L354-I431 HydrophobicContact CG-CG1 4.47Å; T357-I431 HydrophobicContact CG2-CG1 4.02Å; Q427-I431 WeakPolarHBondContact O-CG1 3.35Å; Q427-I431 PolarHBondContact O-N 3.2Å; Q427-I431 VanDerWaalsContact O-N 3.16Å; I428-I431 WeakPolarHBondContact O-CB 3.16Å; I428-I431 PolarHBondContact O-N 3.23Å; S429-I431 VanDerWaalsContact C-N 3.3Å; S429-I431 PolarHBondContact O-N 2.83Å; I431-I433 PolarHBondContact O-N 2.94Å; I431-S434 WeakPolarHBondContact O-CB 3.42Å; I431-S434 PolarHBondContact O-N 2.79Å; I431-S434 VanDerWaalsContact O-N 3.1Å; I431-S434 PolarHBondContact O-OG 3.05Å; I431-S435 PolarHBondContact O-N 3.47Å; I431-S435 PolarHBondContact O-OG 3.42Å
432	S	73.9	Confident	64.8	Low	52 Å²	52	75.2 Å²	75.2	36%	0.364	40%	0.395	S	S	.	.	H	α-helix	trans	-67.4	-37.4	-178	67.1	0	0	0	0	112.9	I428 S429 S434 S435 N436	I428-S432 PolarHBondContact O-N 2.99Å; S429-S432 PolarHBondContact O-N 3.08Å; S429-S432 PolarHBondContact O-OG 3.39Å; S429-S432 VanDerWaalsContact O-OG 3.1Å; S432-S434 VanDerWaalsContact C-N 3.32Å; S432-S434 PolarHBondContact O-N 2.75Å; S432-S435 WeakPolarHBondContact CA-OG 3.32Å; S432-S435 PolarHBondContact O-N 3.35Å; S432-S435 PolarHBondContact O-OG 3.42Å; S432-N436 WeakPolarHBondContact O-CB 3.28Å; S432-N436 PolarHBondContact O-N 3.48Å; S432-N436 VanDerWaalsContact O-N 3.09Å; S432-N436 PolarHBondContact O-ND2 3.3Å
433	I	73.9	Confident	62.6	Low	101 Å²	101	76.7 Å²	76.7	52%	0.518	41%	0.407	S	S	.	.	H	α-helix	trans	-59	-45.8	169.3	-67.5	164.2	0	0	0	109.9	S429 I431 N436 V437	S429-I433 WeakPolarHBondContact O-CB 3.35Å; S429-I433 WeakPolarHBondContact O-CD1 3.46Å; S429-I433 VanDerWaalsContact O-CG1 3.23Å; S429-I433 WeakPolarHBondContact O-CG1 3.1Å; S429-I433 PolarHBondContact O-N 3.48Å; I431-I433 PolarHBondContact O-N 2.94Å; I433-N436 PolarHBondContact O-N 2.7Å; I433-V437 PolarHBondContact O-N 3.32Å; I433-V437 VanDerWaalsContact O-N 3.15Å
434	S	63.1	Low	60.4	Low	12 Å²	12	77.7 Å²	77.7	8%	0.084	41%	0.414	C	S	.	.	H	α-helix	trans	-65.3	-41.2	180	77.7	0	0	0	0	113.7	P358 L430 I431 S432 N436 V437 I438	P358-S434 VanDerWaalsContact CD-CB 3.49Å; L430-S434 WeakPolarHBondContact O-CB 3.31Å; L430-S434 PolarHBondContact O-N 3.08Å; I431-S434 WeakPolarHBondContact O-CB 3.42Å; I431-S434 PolarHBondContact O-N 2.79Å; I431-S434 VanDerWaalsContact O-N 3.1Å; I431-S434 PolarHBondContact O-OG 3.05Å; S432-S434 VanDerWaalsContact C-N 3.32Å; S432-S434 PolarHBondContact O-N 2.75Å; S434-N436 VanDerWaalsContact C-N 3.28Å; S434-N436 PolarHBondContact O-N 2.93Å; S434-V437 PolarHBondContact O-N 3.49Å; S434-I438 WeakPolarHBondContact O-CG1 3.35Å; S434-I438 PolarHBondContact O-N 3.03Å
435	S	57.8	Low	58.5	Low	49 Å²	49	76 Å²	76	34%	0.343	41%	0.412	S	S	.	.	H	α-helix	trans	-65.1	-35.8	177.3	52.7	0	0	0	0	111.3	I431 S432 V437 I438 T439	I431-S435 PolarHBondContact O-N 3.47Å; I431-S435 PolarHBondContact O-OG 3.42Å; S432-S435 WeakPolarHBondContact CA-OG 3.32Å; S432-S435 PolarHBondContact O-N 3.35Å; S432-S435 PolarHBondContact O-OG 3.42Å; S435-V437 VanDerWaalsContact C-N 3.3Å; S435-V437 PolarHBondContact O-N 3.47Å; S435-I438 PolarHBondContact O-N 3.29Å; S435-T439 WeakPolarHBondContact O-CG2 3.38Å; S435-T439 PolarHBondContact O-N 2.82Å; S435-T439 PolarHBondContact O-OG1 2.69Å; S435-T439 VanDerWaalsContact O-OG1 3.09Å
436	N	53.9	Low	56.5	Low	95 Å²	95	71.7 Å²	71.7	51%	0.508	40%	0.396	S	S	.	.	H	α-helix	trans	-70.9	-23.9	177.2	-69.8	-6	0	0	0	113.2	S432 I433 S434 T439 K440	S432-N436 WeakPolarHBondContact O-CB 3.28Å; S432-N436 PolarHBondContact O-N 3.48Å; S432-N436 VanDerWaalsContact O-N 3.09Å; S432-N436 PolarHBondContact O-ND2 3.3Å; I433-N436 PolarHBondContact O-N 2.7Å; S434-N436 VanDerWaalsContact C-N 3.28Å; S434-N436 PolarHBondContact O-N 2.93Å; N436-T439 WeakPolarHBondContact CA-OG1 3.36Å; N436-T439 PolarHBondContact O-OG1 3.3Å; N436-K440 WeakPolarHBondContact O-CB 3.08Å; N436-K440 VanDerWaalsContact O-CG 3.27Å; N436-K440 WeakPolarHBondContact O-CG 3.33Å; N436-K440 PolarHBondContact O-N 2.91Å
437	V	48.8	Very low	54.4	Low	68 Å²	68	72 Å²	72	41%	0.412	41%	0.405	S	S	.	.	H	α-helix	trans	-75.1	-44.9	168.3	172.8	0	0	0	0	110.5	I433 S434 S435 K440 I441	I433-V437 PolarHBondContact O-N 3.32Å; I433-V437 VanDerWaalsContact O-N 3.15Å; S434-V437 PolarHBondContact O-N 3.49Å; S435-V437 VanDerWaalsContact C-N 3.3Å; S435-V437 PolarHBondContact O-N 3.47Å; V437-K440 PolarHBondContact O-N 2.88Å; V437-I441 HydrophobicContact CG1-CD1 3.79Å; V437-I441 WeakPolarHBondContact O-CG1 3.18Å; V437-I441 PolarHBondContact O-N 3.5Å
438	I	45	Very low	52.3	Low	75 Å²	75	79.7 Å²	79.7	39%	0.385	44%	0.438	S	S	.	.	H	α-helix	trans	-64.8	-43	-179.5	-66.3	164.4	0	0	0	111.5	S434 S435 I441 N442	S434-I438 WeakPolarHBondContact O-CG1 3.35Å; S434-I438 PolarHBondContact O-N 3.03Å; S435-I438 PolarHBondContact O-N 3.29Å; I438-I441 PolarHBondContact O-N 3.05Å; I438-N442 WeakPolarHBondContact O-CB 3.4Å; I438-N442 VanDerWaalsContact O-CG 3.31Å; I438-N442 PolarHBondContact O-N 2.99Å
439	T	42.1	Very low	50.1	Low	66 Å²	66	82.6 Å²	82.6	41%	0.405	45%	0.454	S	S	.	.	H	α-helix	trans	-65.8	-37.9	175.6	54.1	0	0	0	0	112	S435 N436 N442 N443	S435-T439 WeakPolarHBondContact O-CG2 3.38Å; S435-T439 PolarHBondContact O-N 2.82Å; S435-T439 PolarHBondContact O-OG1 2.69Å; S435-T439 VanDerWaalsContact O-OG1 3.09Å; N436-T439 WeakPolarHBondContact CA-OG1 3.36Å; N436-T439 PolarHBondContact O-OG1 3.3Å; T439-N442 PolarHBondContact O-N 3.45Å; T439-N443 WeakPolarHBondContact O-CB 3.34Å; T439-N443 PolarHBondContact O-N 2.89Å; T439-N443 PolarHBondContact O-OD1 3.33Å
440	K	38.3	Very low	47.7	Very low	159 Å²	159	85.7 Å²	85.7	69%	0.691	46%	0.463	S	S	*	.	H	α-helix	trans	-64.9	-40.6	174.2	-77.8	-179.9	178.7	-176.3	0	112.8	N436 V437 C444	N436-K440 WeakPolarHBondContact O-CB 3.08Å; N436-K440 VanDerWaalsContact O-CG 3.27Å; N436-K440 WeakPolarHBondContact O-CG 3.33Å; N436-K440 PolarHBondContact O-N 2.91Å; V437-K440 PolarHBondContact O-N 2.88Å; K440-C444 WeakPolarHBondContact O-CB 3.42Å; K440-C444 PolarHBondContact O-N 3.09Å
441	I	43.2	Very low	45.2	Very low	99 Å²	99	91.3 Å²	91.3	51%	0.508	49%	0.494	S	S	.	.	H	α-helix	trans	-65.4	-45.9	176	-69.2	167.6	0	0	0	111	V437 I438 S445	V437-I441 HydrophobicContact CG1-CD1 3.79Å; V437-I441 WeakPolarHBondContact O-CG1 3.18Å; V437-I441 PolarHBondContact O-N 3.5Å; I438-I441 PolarHBondContact O-N 3.05Å; I441-S445 WeakPolarHBondContact O-CB 3.38Å; I441-S445 PolarHBondContact O-N 3.43Å; I441-S445 VanDerWaalsContact O-N 3.15Å; I441-S445 PolarHBondContact O-OG 3.12Å
442	N	39.4	Very low	42.9	Very low	86 Å²	86	96.3 Å²	96.3	46%	0.46	53%	0.527	S	S	.	.	H	α-helix	trans	-65.3	-46.9	178.5	-71.4	-7.7	0	0	0	111.3	I438 T439 C444 S445 I446	I438-N442 WeakPolarHBondContact O-CB 3.4Å; I438-N442 VanDerWaalsContact O-CG 3.31Å; I438-N442 PolarHBondContact O-N 2.99Å; T439-N442 PolarHBondContact O-N 3.45Å; N442-C444 PolarHBondContact O-N 3.49Å; N442-S445 WeakPolarHBondContact O-CB 3.11Å; N442-S445 PolarHBondContact O-N 3.46Å; N442-S445 VanDerWaalsContact O-N 3.09Å; N442-I446 VanDerWaalsContact O-CG1 3.29Å; N442-I446 WeakPolarHBondContact O-CG1 3.42Å; N442-I446 PolarHBondContact O-N 3.09Å
443	N	35.8	Very low	40.8	Very low	96 Å²	96	100.3 Å²	100.3	51%	0.513	54%	0.543	S	S	.	.	H	α-helix	trans	-63.3	-40.9	179.1	-69.9	3.8	0	0	0	111.6	T439 S445 I446 T447	T439-N443 WeakPolarHBondContact O-CB 3.34Å; T439-N443 PolarHBondContact O-N 2.89Å; T439-N443 PolarHBondContact O-OD1 3.33Å; N443-S445 PolarHBondContact O-N 2.92Å; N443-I446 PolarHBondContact O-N 2.99Å; N443-T447 WeakPolarHBondContact O-CG2 3.47Å; N443-T447 PolarHBondContact O-N 3.35Å; N443-T447 PolarHBondContact O-OG1 3.39Å
444	C	33.5	Very low	38.8	Very low	75 Å²	75	98.7 Å²	98.7	51%	0.507	54%	0.541	S	S	.	.	H	α-helix	trans	-67.5	-19.6	176.5	-167.5	0	0	0	0	113.5	K440 N442	K440-C444 WeakPolarHBondContact O-CB 3.42Å; K440-C444 PolarHBondContact O-N 3.09Å; N442-C444 PolarHBondContact O-N 3.49Å
445	S	33.1	Very low	37.4	Very low	77 Å²	77	105.1 Å²	105.1	54%	0.538	57%	0.574	S	S	.	*	H	α-helix	trans	-87.3	-38.2	174.2	-55.3	0	0	0	0	111.5	I441 N442 N443	I441-S445 WeakPolarHBondContact O-CB 3.38Å; I441-S445 PolarHBondContact O-N 3.43Å; I441-S445 VanDerWaalsContact O-N 3.15Å; I441-S445 PolarHBondContact O-OG 3.12Å; N442-S445 WeakPolarHBondContact O-CB 3.11Å; N442-S445 PolarHBondContact O-N 3.46Å; N442-S445 VanDerWaalsContact O-N 3.09Å; N443-S445 PolarHBondContact O-N 2.92Å
446	I	34.6	Very low	36.4	Very low	91 Å²	91	108.9 Å²	108.9	47%	0.467	59%	0.591	S	S	.	*	H	α-helix	trans	-73.3	-40.5	179.2	-67.6	163.3	0	0	0	111.6	N442 N443 K448 L449 M450	N442-I446 VanDerWaalsContact O-CG1 3.29Å; N442-I446 WeakPolarHBondContact O-CG1 3.42Å; N442-I446 PolarHBondContact O-N 3.09Å; N443-I446 PolarHBondContact O-N 2.99Å; I446-K448 PolarHBondContact O-N 3.4Å; I446-L449 PolarHBondContact O-N 2.92Å; I446-M450 HydrophobicContact CG2-CG 3.96Å; I446-M450 PolarHBondContact O-N 3.3Å
447	T	35.1	Very low	35.4	Very low	104 Å²	104	107.8 Å²	107.8	64%	0.638	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.7	-16.7	178.9	54	0	0	0	0	113.9	N443	N443-T447 WeakPolarHBondContact O-CG2 3.47Å; N443-T447 PolarHBondContact O-N 3.35Å; N443-T447 PolarHBondContact O-OG1 3.39Å
448	K	34.9	Very low	34.7	Very low	178 Å²	178	111 Å²	111	77%	0.774	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.6	-5.5	170.6	-73.5	-173.4	175.2	-177.7	0	114.2	I446	I446-K448 PolarHBondContact O-N 3.4Å
449	L	28.8	Very low	34.2	Very low	152 Å²	152	113.9 Å²	113.9	80%	0.796	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112	-19.7	177.4	-150.2	73.1	0	0	0	112.8	I446 N451	I446-L449 PolarHBondContact O-N 2.92Å; L449-N451 PolarHBondContact O-N 3.07Å
450	M	27	Very low	33.8	Very low	123 Å²	123	116.9 Å²	116.9	61%	0.606	63%	0.628	S	S	*	*			trans	-94.3	73.5	-178.7	-72.3	-70.1	175.8	0	0	112.7	I446	I446-M450 HydrophobicContact CG2-CG 3.96Å; I446-M450 PolarHBondContact O-N 3.3Å
451	N	29.3	Very low	33.4	Very low	140 Å²	140	116.5 Å²	116.5	75%	0.749	63%	0.633	S	S	*	*			trans	-65.5	156	151.3	-95.3	-21.3	0	0	0	109.4	L449 I453	L449-N451 PolarHBondContact O-N 3.07Å; N451-I453 PolarHBondContact O-N 3.47Å
452	P	28.7	Very low	33	Very low	125 Å²	125	122.6 Å²	122.6	81%	0.812	65%	0.649	S	S	*	*			trans	-72.8	90.8	-156.7	27.3	-36.3	0	0	0	114.4	S454	P452-S454 PolarHBondContact O-N 3.01Å
453	I	30.6	Very low	32.7	Very low	135 Å²	135	125.5 Å²	125.5	69%	0.692	66%	0.661	S	S	*	*			trans	-77.6	89.3	171.2	-57	-180	0	0	0	109.8	N451	N451-I453 PolarHBondContact O-N 3.47Å
454	S	31.5	Very low	32.4	Very low	68 Å²	68	128.7 Å²	128.7	48%	0.476	68%	0.677	S	S	.	*			trans	21.2	124.8	150.2	-173.2	0	0	0	0	119	P452 N456 S457	P452-S454 PolarHBondContact O-N 3.01Å; S454-N456 PolarHBondContact O-N 3.47Å; S454-S457 PolarHBondContact O-OG 3.49Å
455	N	34.8	Very low	32.5	Very low	146 Å²	146	132.3 Å²	132.3	78%	0.781	69%	0.686	S	S	*	*	G	3₁₀ helix	trans	-57.3	-9.2	-179.5	-69	-20.2	0	0	0	116	S457	N455-S457 PolarHBondContact O-N 3.11Å
456	N	36.1	Very low	32.4	Very low	129 Å²	129	134 Å²	134	69%	0.69	70%	0.695	S	S	*	*	G	3₁₀ helix	trans	-67.4	-20.2	-177.2	-65.9	-1.9	0	0	0	113.8	S454	S454-N456 PolarHBondContact O-N 3.47Å
457	S	32.6	Very low	32.4	Very low	71 Å²	71	136.9 Å²	136.9	50%	0.497	71%	0.706	S	S	.	*	G	3₁₀ helix	trans	-72.2	-27	-177.8	56.4	0	0	0	0	114.2	S454 N455 H459	S454-S457 PolarHBondContact O-OG 3.49Å; N455-S457 PolarHBondContact O-N 3.11Å; S457-H459 VanDerWaalsContact C-N 3.31Å; S457-H459 PolarHBondContact O-N 3.46Å
458	L	34	Very low	32.5	Very low	135 Å²	135	140.3 Å²	140.3	71%	0.707	72%	0.715	S	S	*	*	G	3₁₀ helix	trans	-74.2	-16.9	-175.1	-108.5	161.6	0	0	0	114.1
459	H	34.8	Very low	32.5	Very low	136 Å²	136	138.4 Å²	138.4	63%	0.63	72%	0.718	S	S	*	*	G	3₁₀ helix	trans	-81	-22.2	-175.8	-144	-74	0	0	0	113.7	S457	S457-H459 VanDerWaalsContact C-N 3.31Å; S457-H459 PolarHBondContact O-N 3.46Å
460	I	34.4	Very low	32.6	Very low	130 Å²	130	139.1 Å²	139.1	67%	0.667	72%	0.723	S	S	*	*	G	3₁₀ helix	trans	-79	-31.6	-173.6	-60.9	176.3	0	0	0	111.7	R462	I460-R462 PolarHBondContact O-N 3.01Å
461	L	29.8	Very low	32.8	Very low	150 Å²	150	137.9 Å²	137.9	79%	0.785	73%	0.726	S	S	*	*	G	3₁₀ helix	trans	-78.2	-1.9	-179.7	-73.3	169.3	0	0	0	114.3
462	R	33.3	Very low	32.9	Very low	227 Å²	227	139.6 Å²	139.6	86%	0.857	73%	0.734	S	S	*	*	G	3₁₀ helix	trans	-100	1.4	-173.7	-120.6	178.9	-174.9	179.2	1.8	115.6	I460	I460-R462 PolarHBondContact O-N 3.01Å
463	Q	34.4	Very low	33.1	Very low	148 Å²	148	139.3 Å²	139.3	69%	0.692	73%	0.733	S	S	*	*			trans	-109.7	-4.1	-171.4	-71.8	-170.6	-25.6	0	0	116.4	Q465	Q463-Q465 PolarHBondContact O-N 2.95Å
464	L	28.6	Very low	33.1	Very low	163 Å²	163	141.9 Å²	141.9	85%	0.853	74%	0.739	S	S	*	*			trans	-81.5	76.4	-177	-67.9	175.5	0	0	0	112.8
465	Q	35.4	Very low	33.1	Very low	151 Å²	151	145.8 Å²	145.8	71%	0.706	75%	0.754	S	S	*	*			trans	-71.4	153.9	169.6	-76.3	-168.5	-13.6	0	0	112.6	Q463 H467	Q463-Q465 PolarHBondContact O-N 2.95Å; Q465-H467 PolarHBondContact O-N 3.13Å
466	P	30.8	Very low	33.1	Very low	113 Å²	113	149 Å²	149	73%	0.734	76%	0.761	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	25.3	-161.9	-16.4	33.6	0	0	0	116.7
467	H	35.1	Very low	32.8	Very low	150 Å²	150	151.1 Å²	151.1	69%	0.694	77%	0.767	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.6	-0.9	-158.2	-55.3	-35.2	0	0	0	116.1	Q465	Q465-H467 PolarHBondContact O-N 3.13Å
468	Q	37.3	Very low	32.7	Very low	176 Å²	176	155.3 Å²	155.3	82%	0.822	78%	0.782	S	S	*	*			trans	-117.6	15.5	-169.7	-68.3	-170.7	-24.3	0	0	116.2	N470	Q468-N470 PolarHBondContact O-N 3.28Å
469	V	35.1	Very low	32.7	Very low	139 Å²	139	153.7 Å²	153.7	84%	0.842	78%	0.782	S	S	*	*			trans	-100.7	33.5	-175.6	-154.3	0	0	0	0	113.2
470	N	30.4	Very low	32.4	Very low	166 Å²	166	154.6 Å²	154.6	89%	0.888	79%	0.792	S	S	*	*	S	Bend	trans	-119.4	25.5	-176.8	-95.1	-5.1	0	0	0	114.1	Q468	Q468-N470 PolarHBondContact O-N 3.28Å
471	S	31.1	Very low	32.5	Very low	97 Å²	97	156.3 Å²	156.3	68%	0.678	80%	0.802	S	S	*	*			trans	-157.9	108.6	173.2	43.4	0	0	0	0	112.8
472	L	32.2	Very low	32.6	Very low	176 Å²	176	155.1 Å²	155.1	92%	0.921	80%	0.801	S	S	*	*			trans	-172.3	153.8	142.5	-116.8	88.2	0	0	0	108
473	P	33.7	Very low	32.7	Very low	119 Å²	119	152 Å²	152	77%	0.773	80%	0.801	S	S	*	*			trans	-94.7	153.5	-150.3	-7.5	27	0	0	0	116.3
474	K	30.2	Very low	32.6	Very low	190 Å²	190	148.5 Å²	148.5	83%	0.826	81%	0.805	S	S	*	*			trans	-70.7	129.4	157.2	-63	175.8	-179.8	176	0	109.6
475	N	31.3	Very low	32.9	Very low	149 Å²	149	149 Å²	149	80%	0.797	80%	0.802	S	S	*	*			trans	148.2	113.4	133.9	-76.4	-13.9	0	0	0	113.4
476	K	35.2	Very low	32.6	Very low	214 Å²	214	149 Å²	149	93%	0.93	80%	0.802	S	S	*	*			trans	-163.2	116.8	130.3	-107.6	165.3	-175.8	178.7	0	109.4
477	Q	28.9	Very low	32.8	Very low	174 Å²	174	152.4 Å²	152.4	81%	0.813	81%	0.806	S	S	*	*			trans	-93	-167.8	172.3	-66	174.2	-39.7	0	0	109.5
478	I	29.8	Very low	32.7	Very low	159 Å²	159	153.1 Å²	153.1	82%	0.815	81%	0.807	S	S	*	*			trans	78.1	125.3	164.9	-51.8	164.1	0	0	0	112.9
479	S	34.3	Very low	32.6	Very low	100 Å²	100	152.7 Å²	152.7	70%	0.699	81%	0.81	S	S	*	*			cis	-160.9	157.2	-9.4	47.3	0	0	0	0	110.9
480	N	29	Very low	32.3	Very low	156 Å²	156	152.8 Å²	152.8	83%	0.834	81%	0.805	S	S	*	*			trans	-67.9	151.8	164.2	-64.4	-24	0	0	0	110.9
481	N	36	Very low	32.4	Very low	165 Å²	165	152.6 Å²	152.6	88%	0.882	80%	0.804	S	S	*	*			trans	-152.5	147.6	150	-113.9	-19.9	0	0	0	111.1
482	V	31.7	Very low	32.2	Very low	125 Å²	125	153.3 Å²	153.3	76%	0.758	81%	0.81	S	S	*	*			trans	-113.1	143.3	-177.7	172.6	0	0	0	0	108.5
483	N	35.9	Very low	32.2	Very low	163 Å²	163	152.2 Å²	152.2	87%	0.872	80%	0.803	S	S	*	*			trans	177.1	137.1	147.7	-94.2	-22.1	0	0	0	114.1
484	G	31.5	Very low	31.9	Very low	74 Å²	74	154 Å²	154	76%	0.763	80%	0.804	S	S	*	*			trans	73.7	143.1	152.3	0	0	0	0	0	118.6
485	E	34.9	Very low	31.8	Very low	172 Å²	172	150.1 Å²	150.1	80%	0.804	80%	0.798	S	S	*	*			cis	-143.6	154.5	-7.7	-67.5	-167.4	135.6	0	0	110.3	K487	E485-K487 IonicContact OE2-NZ 2.67Å
486	E	29.4	Very low	31.5	Very low	151 Å²	151	150.2 Å²	150.2	71%	0.706	80%	0.799	S	S	*	*			trans	-77.2	134	165.4	-65	-167.9	158.6	0	0	111.4	K488	E486-K488 WeakPolarHBondContact OE2-CE 3.33Å; E486-K488 IonicContact OE2-NZ 3.73Å; E486-K488 PolarHBondContact OE2-NZ 2.93Å; E486-K488 VanDerWaalsContact OE2-NZ 3.1Å
487	K	36.7	Very low	31.4	Very low	186 Å²	186	149.6 Å²	149.6	81%	0.809	80%	0.796	S	S	*	*			trans	-134.1	114.1	147.7	-77.2	-170.1	174	127.6	0	112.4	E485	E485-K487 IonicContact OE2-NZ 2.67Å
488	K	32.3	Very low	31.3	Very low	164 Å²	164	149.1 Å²	149.1	71%	0.713	79%	0.794	S	S	*	*			trans	-71.8	143.4	174.4	-65.4	156.4	-176.1	150	0	110.2	E486	E486-K488 WeakPolarHBondContact OE2-CE 3.33Å; E486-K488 IonicContact OE2-NZ 3.73Å; E486-K488 PolarHBondContact OE2-NZ 2.93Å; E486-K488 VanDerWaalsContact OE2-NZ 3.1Å
489	L	35.6	Very low	31.3	Very low	168 Å²	168	149.1 Å²	149.1	88%	0.88	79%	0.794	S	S	*	*			trans	-148.2	106.8	153.7	-114.5	169.5	0	0	0	109.9
490	N	28.2	Very low	31	Very low	140 Å²	140	152.5 Å²	152.5	75%	0.749	80%	0.796	S	S	*	*			trans	-72.3	150.5	168.1	-65.4	-24.3	0	0	0	109.4
491	N	32.9	Very low	30.8	Very low	162 Å²	162	154.5 Å²	154.5	87%	0.866	80%	0.798	S	S	*	*				-169.3	133.8	127.4	-96.3	-27	0	0	0	111.3
492	S	26	Very low	30.5	Very low	113 Å²	113	152.8 Å²	152.8	79%	0.79	80%	0.796	S	S	*	*			trans	-96.9	127.6	176.6	58.8	0	0	0	0	111.2
493	I	31.9	Very low	30.2	Very low	153 Å²	153	151.2 Å²	151.2	79%	0.785	80%	0.796	S	S	*	*			trans	-137.3	115.2	156.7	-56.2	-178.2	0	0	0	109.2
494	I	28.5	Very low	30	Very low	156 Å²	156	152.5 Å²	152.5	80%	0.8	79%	0.793	S	S	*	*			trans	-98.7	135.3	162.3	-62	170.8	0	0	0	107.2
495	P	27	Very low	29.8	Very low	108 Å²	108	155.9 Å²	155.9	70%	0.701	79%	0.794	S	S	*	*			trans	-133.9	133.9	144.3	26.8	-9.4	0	0	0	113.1
496	N	26.2	Very low	29.4	Very low	152 Å²	152	156.4 Å²	156.4	81%	0.813	80%	0.797	S	S	*	*			trans	-46.1	135.3	172	-70.5	-61.2	0	0	0	113.6
497	K	32	Very low	29.4	Very low	201 Å²	201	158.2 Å²	158.2	87%	0.874	80%	0.802	S	S	*	*			trans	-126.3	114.5	149.8	-86.6	-173.3	174.7	176.3	0	110.6	I499	K497-I499 PolarHBondContact O-N 2.91Å
498	Q	27.5	Very low	28.9	Very low	163 Å²	163	157 Å²	157	76%	0.762	80%	0.803	S	S	*	*			trans	-67.6	122.7	176.4	-62.4	169.3	-6.7	0	0	110	K500	Q498-K500 PolarHBondContact O-N 3.49Å
499	I	29.5	Very low	28.8	Very low	159 Å²	159	157.2 Å²	157.2	82%	0.815	81%	0.807	S	S	*	*			trans	-85.2	104	163.7	-61.5	178.9	0	0	0	107.2	K497	K497-I499 PolarHBondContact O-N 2.91Å
500	K	28.9	Very low	28.4	Very low	172 Å²	172	157 Å²	157	75%	0.748	81%	0.806	S	S	*	*			trans	-77.6	122.7	176.9	-72.5	-180	175.8	177.2	0	110.1	Q498	Q498-K500 PolarHBondContact O-N 3.49Å
501	F	25.4	Very low	28.4	Very low	197 Å²	197	159.2 Å²	159.2	86%	0.864	81%	0.812	S	S	*	*			trans	-72.3	127.4	165.7	-74.8	-90.3	0	0	0	110.6	A503	F501-A503 PolarHBondContact O-N 2.99Å
502	P	29.1	Very low	28.1	Very low	130 Å²	130	158.9 Å²	158.9	84%	0.844	81%	0.81	S	S	*	*			trans	-80.6	108.1	166.5	31.2	-30.5	0	0	0	109.7
503	A	25.7	Very low	28.2	Very low	91 Å²	91	162.8 Å²	162.8	75%	0.752	81%	0.813	S	S	*	*			trans	-93.3	120.7	173.7	0	0	0	0	0	111.2	F501	F501-A503 PolarHBondContact O-N 2.99Å
504	K	30.8	Very low	28	Very low	190 Å²	190	163.1 Å²	163.1	83%	0.826	82%	0.816	S	S	*	*			trans	174.6	126.7	137.6	-97.3	158.4	-174.4	-179.7	0	113.6
505	N	26.9	Very low	27.8	Very low	145 Å²	145	164.8 Å²	164.8	78%	0.775	82%	0.82	S	S	*	*			trans	36.3	99.4	133.1	-51.8	2.2	0	0	0	119.4
506	Q	28	Very low	28.1	Very low	183 Å²	183	166.4 Å²	166.4	86%	0.855	82%	0.822	S	S	*	*			trans	-164.3	177.6	135.2	-107	156.8	28.7	0	0	110.1
507	F	28.3	Very low	28.1	Very low	189 Å²	189	167.5 Å²	167.5	83%	0.829	82%	0.819	S	S	*	*			trans	66.3	49.7	-174.7	-64.2	-78.9	0	0	0	117.1
508	I	27.2	Very low	27.8	Very low	160 Å²	160	165.7 Å²	165.7	82%	0.821	82%	0.819	S	S	*	*			trans	-94.4	101.5	134.6	-61.9	174.7	0	0	0	106.4
509	Q	28.6	Very low	27.8	Very low	169 Å²	169	165.8 Å²	165.8	79%	0.79	82%	0.819	S	S	*	*			trans	162.5	95.7	158.4	-95.7	169.7	14	0	0	109.2
510	N	28.2	Very low	27.8	Very low	163 Å²	163	162.9 Å²	162.9	87%	0.872	81%	0.813	S	S	*	*			trans	-172.4	41.4	147.3	-101.1	-17.3	0	0	0	111.7	N512	N510-N512 PolarHBondContact O-N 3.15Å
511	E	27.8	Very low	27.7	Very low	188 Å²	188	164 Å²	164	88%	0.879	82%	0.817	S	S	*	*			trans	-78.4	98.1	156.7	-72.4	-176.2	154.4	0	0	107.8
512	N	27.5	Very low	27.9	Very low	154 Å²	154	164.1 Å²	164.1	82%	0.824	82%	0.818	S	S	*	*			trans	176.5	150.5	148.3	-99.3	-58.7	0	0	0	111.4	N510	N510-N512 PolarHBondContact O-N 3.15Å
513	K	26.8	Very low	27.6	Very low	195 Å²	195	168.2 Å²	168.2	85%	0.848	82%	0.823	S	S	*	*			trans	63.4	71.2	172.1	-57.5	177.5	-178.8	177.7	0	117.5
514	L	28.3	Very low	27.8	Very low	161 Å²	161	168.5 Å²	168.5	84%	0.843	82%	0.815	S	S	*	*			trans	-126.9	89.5	137.8	-115.7	103.4	0	0	0	109.9	I516	L514-I516 HydrophobicContact CD2-CD1 3.91Å; L514-I516 HydrophobicContact CD2-CG1 4.37Å
515	Q	25.3	Very low	27.6	Very low	190 Å²	190	169.5 Å²	169.5	89%	0.888	82%	0.819	S	S	*	*			trans	-87.8	111.8	164.1	-69.2	-178.8	-0.6	0	0	108.1
516	I	31.7	Very low	27.6	Very low	143 Å²	143	170.8 Å²	170.8	73%	0.733	82%	0.819	S	S	*	*			trans	-122	131.2	164.4	-62.9	-176.9	0	0	0	107.3	L514	L514-I516 HydrophobicContact CD2-CD1 3.91Å; L514-I516 HydrophobicContact CD2-CG1 4.37Å
517	K	27.6	Very low	27.5	Very low	174 Å²	174	172.9 Å²	172.9	76%	0.757	82%	0.82	S	S	*	*			trans	-82.7	133.6	-165.4	-66	174.4	178.1	175.3	0	111.7	H519	K517-H519 PolarHBondContact O-N 3.26Å
518	N	24.7	Very low	27.6	Very low	163 Å²	163	168.6 Å²	168.6	87%	0.872	81%	0.811	S	S	*	*			trans	-77.2	98.6	171.1	-78.6	-24.7	0	0	0	111.7
519	H	26.6	Very low	27.6	Very low	166 Å²	166	168 Å²	168	77%	0.769	81%	0.808	S	S	*	*			trans	-139.2	139.8	158.5	-57.8	-72.3	0	0	0	107.2	K517	K517-H519 PolarHBondContact O-N 3.26Å
520	S	30.4	Very low	27.6	Very low	98 Å²	98	167.9 Å²	167.9	69%	0.685	81%	0.805	S	S	*	*			cis	-151.4	156.3	10.8	61.9	0	0	0	0	114.2
521	K	26.2	Very low	27.6	Very low	194 Å²	194	166.7 Å²	166.7	84%	0.843	79%	0.792	S	S	*	*			trans	33.1	93.8	147.6	-60	173.5	-178	174.5	0	119
522	F	29.6	Very low	27.5	Very low	200 Å²	200	165 Å²	165	88%	0.877	79%	0.786	S	S	*	*			trans	-120.5	126.4	137.7	-94	-87.1	0	0	0	109.6
523	K	23	Very low	27.6	Very low	217 Å²	217	164 Å²	164	94%	0.943	78%	0.78	S	S	*	*			trans	-96.4	85.5	176.4	-83.3	-174.6	172.9	-179.4	0	110
524	T	29.9	Very low	27.6	Very low	96 Å²	96	160.9 Å²	160.9	59%	0.589	77%	0.772	S	S	*	*			trans	-102.6	138.4	160.2	44	0	0	0	0	109.4	F526	T524-F526 PolarHBondContact O-N 3.39Å
525	K	26.7	Very low	27.7	Very low	211 Å²	211	160.7 Å²	160.7	92%	0.917	77%	0.77	S	S	*	*			trans	-76.3	87.4	-179.8	-73.4	-177.8	178.4	177.3	0	109.9	Y527	K525-Y527 PolarHBondContact O-N 3.39Å
526	F	28.3	Very low	27.9	Very low	173 Å²	173	158.4 Å²	158.4	76%	0.759	76%	0.764	S	S	*	*			trans	-63.9	129.1	168.3	-80.3	-91.9	0	0	0	110.6	T524 P528	T524-F526 PolarHBondContact O-N 3.39Å; F526-P528 VanDerWaalsContact O-CD 3.28Å; F526-P528 WeakPolarHBondContact O-CD 3.44Å
527	Y	25.4	Very low	27.8	Very low	227 Å²	227	154.1 Å²	154.1	89%	0.89	76%	0.756	S	S	*	*			trans	-83.5	106.1	146.4	-87.1	-81.3	0	0	0	107.3	K525 I529	K525-Y527 PolarHBondContact O-N 3.39Å; Y527-I529 PolarHBondContact O-N 3.26Å
528	P	29.2	Very low	28.2	Very low	99 Å²	99	152.6 Å²	152.6	64%	0.643	76%	0.756	S	S	*	*			trans	-75	113.1	177.9	29.9	-32.8	0	0	0	109.5	F526 K530	F526-P528 VanDerWaalsContact O-CD 3.28Å; F526-P528 WeakPolarHBondContact O-CD 3.44Å; P528-K530 PolarHBondContact O-N 3.11Å
529	I	28.8	Very low	28.5	Very low	147 Å²	147	153.2 Å²	153.2	75%	0.754	75%	0.751	S	S	*	*			trans	-67.5	89	159.5	-58.1	-178.4	0	0	0	106.5	Y527 F531	Y527-I529 PolarHBondContact O-N 3.26Å; I529-F531 HydrophobicContact CG2-CD2 3.68Å; I529-F531 HydrophobicContact CG2-CE2 3.77Å; I529-F531 PolarHBondContact O-N 3.5Å
530	K	28.1	Very low	28.7	Very low	166 Å²	166	153 Å²	153	72%	0.722	75%	0.748	S	S	*	*			trans	-77	67.5	-168.5	-168.2	-172.8	177.9	-175.6	0	111.1	P528 M532	P528-K530 PolarHBondContact O-N 3.11Å; K530-M532 VanDerWaalsContact C-N 3.29Å; K530-M532 PolarHBondContact O-N 3.37Å
531	F	27.7	Very low	29.1	Very low	138 Å²	138	152.1 Å²	152.1	61%	0.605	74%	0.735	S	S	*	*			trans	-66.6	87.8	170.3	-92.9	-68.8	0	0	0	110.5	I529 I533	I529-F531 HydrophobicContact CG2-CD2 3.68Å; I529-F531 HydrophobicContact CG2-CE2 3.77Å; I529-F531 PolarHBondContact O-N 3.5Å; F531-I533 VanDerWaalsContact C-N 3.33Å; F531-I533 PolarHBondContact O-N 3.26Å
532	M	26.6	Very low	29.6	Very low	153 Å²	153	147.6 Å²	147.6	75%	0.754	72%	0.72	S	S	*	*			trans	-69	93.3	161.8	-76.2	-167.1	65.9	0	0	108.9	K530 N534	K530-M532 VanDerWaalsContact C-N 3.29Å; K530-M532 PolarHBondContact O-N 3.37Å; M532-N534 VanDerWaalsContact C-N 3.27Å; M532-N534 PolarHBondContact O-N 2.88Å
533	I	29.5	Very low	29.9	Very low	134 Å²	134	143 Å²	143	69%	0.687	71%	0.705	S	S	*	*			trans	-71.6	88.6	169.1	-57.6	178.9	0	0	0	107.7	F531 I535	F531-I533 VanDerWaalsContact C-N 3.33Å; F531-I533 PolarHBondContact O-N 3.26Å; I533-I535 PolarHBondContact O-N 3.12Å
534	N	26.6	Very low	30.7	Very low	129 Å²	129	135.1 Å²	135.1	69%	0.69	67%	0.673	S	S	*	*			trans	-68.2	124	167	-170.2	-4.9	0	0	0	108.1	M532 N536	M532-N534 VanDerWaalsContact C-N 3.27Å; M532-N534 PolarHBondContact O-N 2.88Å; N534-N536 PolarHBondContact O-N 2.91Å
535	I	30.4	Very low	31.2	Very low	156 Å²	156	133.1 Å²	133.1	80%	0.8	66%	0.658	S	S	*	*	S	Bend	trans	-84.8	45.1	-164.6	-43.7	-178.9	0	0	0	111	I533	I533-I535 PolarHBondContact O-N 3.12Å
536	N	29.6	Very low	31.9	Very low	142 Å²	142	127 Å²	127	76%	0.759	64%	0.635	S	S	*	*			trans	-137	105	-178.6	-84.5	-44	0	0	0	110.4	N534	N534-N536 PolarHBondContact O-N 2.91Å
537	G	29.4	Very low	32.6	Very low	54 Å²	54	121.8 Å²	121.8	56%	0.557	62%	0.619	S	S	*	*			trans	115.5	104.9	169.5	0	0	0	0	0	114.8	F539 F540	G537-F539 PolarHBondContact O-N 2.69Å; G537-F540 PolarHBondContact O-N 2.84Å
538	N	35.7	Very low	33.3	Very low	142 Å²	142	114.3 Å²	114.3	76%	0.759	59%	0.594	S	S	*	*	H	α-helix	trans	-61.2	-4.9	178.9	-69.5	-25.5	0	0	0	115.1
539	F	31	Very low	34	Very low	176 Å²	176	113 Å²	113	77%	0.772	58%	0.581	S	S	*	*	H	α-helix	trans	-82.4	-38.2	-175.9	-136.3	-98	0	0	0	113	G537 I541	G537-F539 PolarHBondContact O-N 2.69Å; F539-I541 VanDerWaalsContact C-N 3.31Å; F539-I541 PolarHBondContact O-N 3.4Å
540	F	31.5	Very low	34.6	Very low	161 Å²	161	110.3 Å²	110.3	71%	0.706	57%	0.568	S	S	*	*	H	α-helix	trans	-72.2	-25	-176.4	-118.1	-82.6	0	0	0	113.4	G537 N544	G537-F540 PolarHBondContact O-N 2.84Å; F540-N544 PolarHBondContact O-N 2.97Å
541	I	37.4	Very low	35.5	Very low	79 Å²	79	107.1 Å²	107.1	41%	0.405	56%	0.558	S	S	.	*	H	α-helix	trans	-64.3	-41.9	179.7	-64.1	175.2	0	0	0	110.6	F539 L545	F539-I541 VanDerWaalsContact C-N 3.31Å; F539-I541 PolarHBondContact O-N 3.4Å; I541-L545 HydrophobicContact CG2-CD1 3.96Å; I541-L545 WeakPolarHBondContact O-CB 3.29Å; I541-L545 PolarHBondContact O-N 2.93Å
542	N	37.4	Very low	36.3	Very low	99 Å²	99	102 Å²	102	53%	0.529	54%	0.537	S	S	.	.	H	α-helix	trans	-66.3	-45.4	-175	-76.9	-16.2	0	0	0	113.2	N544 L545 I546	N542-N544 PolarHBondContact O-N 2.94Å; N542-L545 PolarHBondContact O-N 3.44Å; N542-I546 VanDerWaalsContact O-CG1 3.29Å; N542-I546 WeakPolarHBondContact O-CG1 3.3Å; N542-I546 PolarHBondContact O-N 2.9Å
543	N	35.6	Very low	37.2	Very low	105 Å²	105	96.1 Å²	96.1	56%	0.561	51%	0.511	S	S	*	.	H	α-helix	trans	-67.3	-38.9	-178.4	-71.2	-0.2	0	0	0	111.7	I546 S547	N543-I546 PolarHBondContact O-N 3.25Å; N543-S547 PolarHBondContact O-N 3.44Å
544	N	40.2	Very low	38	Very low	50 Å²	50	95.4 Å²	95.4	27%	0.267	51%	0.508	S	S	.	.	H	α-helix	trans	-67.9	-38.9	172.7	-73.1	-21	0	0	0	111.7	F540 N542 I546 S547 I548	F540-N544 PolarHBondContact O-N 2.97Å; N542-N544 PolarHBondContact O-N 2.94Å; N544-I546 VanDerWaalsContact C-N 3.34Å; N544-I546 PolarHBondContact O-N 3.16Å; N544-S547 PolarHBondContact O-N 2.98Å; N544-I548 WeakPolarHBondContact O-CB 3.38Å; N544-I548 WeakPolarHBondContact O-CD1 3.42Å; N544-I548 VanDerWaalsContact O-CG1 3.24Å; N544-I548 WeakPolarHBondContact O-CG1 3.43Å; N544-I548 PolarHBondContact O-N 3.16Å
545	L	39.7	Very low	39.2	Very low	55 Å²	55	92 Å²	92	29%	0.288	49%	0.488	S	S	.	.	H	α-helix	trans	-61.1	-41.3	172.8	-117.4	82.3	0	0	0	111.8	L405 I541 N542 I548 I549	L405-L545 HydrophobicContact CD2-CG 4.48Å; I541-L545 HydrophobicContact CG2-CD1 3.96Å; I541-L545 WeakPolarHBondContact O-CB 3.29Å; I541-L545 PolarHBondContact O-N 2.93Å; N542-L545 PolarHBondContact O-N 3.44Å; L545-I548 PolarHBondContact O-N 3.48Å; L545-I549 HydrophobicContact CB-CD1 4.49Å; L545-I549 HydrophobicContact CD2-CD1 4.43Å; L545-I549 VanDerWaalsContact O-CB 3.23Å; L545-I549 WeakPolarHBondContact O-CB 3.49Å; L545-I549 WeakPolarHBondContact O-CD1 3.33Å; L545-I549 WeakPolarHBondContact O-CG1 3.41Å; L545-I549 PolarHBondContact O-N 3.21Å
546	I	42.9	Very low	40.2	Very low	83 Å²	83	89.3 Å²	89.3	43%	0.426	47%	0.471	S	S	.	.	H	α-helix	trans	-65	-43.4	178.3	-69.6	162.4	0	0	0	110.6	N542 N543 N544 I549 N550	N542-I546 VanDerWaalsContact O-CG1 3.29Å; N542-I546 WeakPolarHBondContact O-CG1 3.3Å; N542-I546 PolarHBondContact O-N 2.9Å; N543-I546 PolarHBondContact O-N 3.25Å; N544-I546 VanDerWaalsContact C-N 3.34Å; N544-I546 PolarHBondContact O-N 3.16Å; I546-I549 PolarHBondContact O-N 3.1Å; I546-N550 WeakPolarHBondContact O-CB 3.43Å; I546-N550 VanDerWaalsContact O-CG 3.25Å; I546-N550 PolarHBondContact O-N 2.92Å; I546-N550 PolarHBondContact O-OD1 2.85Å
547	S	42	Very low	41.3	Very low	62 Å²	62	85.2 Å²	85.2	43%	0.434	45%	0.448	S	S	.	.	H	α-helix	trans	-61.2	-46.5	174.4	-176.3	0	0	0	0	111.9	N543 N544 I549 N550 I551	N543-S547 PolarHBondContact O-N 3.44Å; N544-S547 PolarHBondContact O-N 2.98Å; S547-I549 PolarHBondContact O-N 3.46Å; S547-N550 PolarHBondContact O-N 3.3Å; S547-I551 WeakPolarHBondContact O-CG1 3.46Å; S547-I551 PolarHBondContact O-N 3.41Å
548	I	40.6	Very low	42.3	Very low	70 Å²	70	86.8 Å²	86.8	36%	0.359	44%	0.443	S	S	.	.	H	α-helix	trans	-63.2	-40.7	176.4	-69.1	164.9	0	0	0	111.2	N544 L545 I551 L552	N544-I548 WeakPolarHBondContact O-CB 3.38Å; N544-I548 WeakPolarHBondContact O-CD1 3.42Å; N544-I548 VanDerWaalsContact O-CG1 3.24Å; N544-I548 WeakPolarHBondContact O-CG1 3.43Å; N544-I548 PolarHBondContact O-N 3.16Å; L545-I548 PolarHBondContact O-N 3.48Å; I548-I551 PolarHBondContact O-N 3.04Å; I548-L552 HydrophobicContact CG2-CD1 3.76Å; I548-L552 HydrophobicContact CG2-CG 4.27Å; I548-L552 WeakPolarHBondContact O-CB 3.35Å; I548-L552 VanDerWaalsContact O-CG 3.22Å; I548-L552 WeakPolarHBondContact O-CG 3.25Å; I548-L552 PolarHBondContact O-N 3.43Å
549	I	43	Very low	43.1	Very low	71 Å²	71	81.4 Å²	81.4	36%	0.364	41%	0.413	S	S	.	.	H	α-helix	trans	-65.1	-38.8	176.2	-74.9	164.3	0	0	0	111	L545 I546 S547 S553	L545-I549 HydrophobicContact CB-CD1 4.49Å; L545-I549 HydrophobicContact CD2-CD1 4.43Å; L545-I549 VanDerWaalsContact O-CB 3.23Å; L545-I549 WeakPolarHBondContact O-CB 3.49Å; L545-I549 WeakPolarHBondContact O-CD1 3.33Å; L545-I549 WeakPolarHBondContact O-CG1 3.41Å; L545-I549 PolarHBondContact O-N 3.21Å; I546-I549 PolarHBondContact O-N 3.1Å; S547-I549 PolarHBondContact O-N 3.46Å; I549-S553 WeakPolarHBondContact O-CA 3.49Å; I549-S553 WeakPolarHBondContact O-CB 3.44Å; I549-S553 PolarHBondContact O-N 3.44Å
550	N	42.6	Very low	44.1	Very low	92 Å²	92	76.3 Å²	76.3	49%	0.492	39%	0.394	S	S	.	.	H	α-helix	trans	-69.7	-43	177	-70.6	-2.9	0	0	0	111.6	I546 S547 S553 N554	I546-N550 WeakPolarHBondContact O-CB 3.43Å; I546-N550 VanDerWaalsContact O-CG 3.25Å; I546-N550 PolarHBondContact O-N 2.92Å; I546-N550 PolarHBondContact O-OD1 2.85Å; S547-N550 PolarHBondContact O-N 3.3Å; N550-S553 PolarHBondContact O-N 2.97Å; N550-N554 PolarHBondContact O-N 3.43Å
551	I	46.1	Very low	45	Very low	99 Å²	99	71.5 Å²	71.5	51%	0.508	38%	0.375	S	S	.	.	H	α-helix	trans	-62.4	-47	174.9	-67.5	164.3	0	0	0	110.4	S547 I548 S553 N554 Q555	S547-I551 WeakPolarHBondContact O-CG1 3.46Å; S547-I551 PolarHBondContact O-N 3.41Å; I548-I551 PolarHBondContact O-N 3.04Å; I551-S553 VanDerWaalsContact C-N 3.31Å; I551-S553 PolarHBondContact O-N 3.47Å; I551-N554 PolarHBondContact O-N 2.87Å; I551-Q555 WeakPolarHBondContact O-CB 3.36Å; I551-Q555 WeakPolarHBondContact O-CG 3.41Å; I551-Q555 PolarHBondContact O-N 3.23Å
552	L	45.3	Very low	45.6	Very low	29 Å²	29	70.1 Å²	70.1	15%	0.152	37%	0.368	C	S	.	.	H	α-helix	trans	-62.1	-37.7	173.6	-75.4	173.2	0	0	0	111.4	Y409 L412 I548 Q555 F556	Y409-L552 HydrophobicContact CD2-CD2 4.2Å; L412-L552 HydrophobicContact CD1-CD2 3.88Å; I548-L552 HydrophobicContact CG2-CD1 3.76Å; I548-L552 HydrophobicContact CG2-CG 4.27Å; I548-L552 WeakPolarHBondContact O-CB 3.35Å; I548-L552 VanDerWaalsContact O-CG 3.22Å; I548-L552 WeakPolarHBondContact O-CG 3.25Å; I548-L552 PolarHBondContact O-N 3.43Å; L552-Q555 PolarHBondContact O-N 2.94Å; L552-F556 WeakPolarHBondContact O-CB 3.34Å; L552-F556 PolarHBondContact O-N 3.19Å
553	S	44.6	Very low	46.1	Very low	31 Å²	31	67.9 Å²	67.9	22%	0.217	36%	0.356	C	S	.	.	H	α-helix	trans	-66.3	-39.8	178.8	-167.8	0	0	0	0	111.5	I549 N550 I551 Q557	I549-S553 WeakPolarHBondContact O-CA 3.49Å; I549-S553 WeakPolarHBondContact O-CB 3.44Å; I549-S553 PolarHBondContact O-N 3.44Å; N550-S553 PolarHBondContact O-N 2.97Å; I551-S553 VanDerWaalsContact C-N 3.31Å; I551-S553 PolarHBondContact O-N 3.47Å; S553-Q557 WeakPolarHBondContact O-CB 3.42Å; S553-Q557 WeakPolarHBondContact O-CG 3.41Å; S553-Q557 PolarHBondContact O-N 2.92Å
554	N	46.7	Very low	46.5	Very low	118 Å²	118	66.6 Å²	66.6	63%	0.631	35%	0.348	S	S	*	.	H	α-helix	trans	-70.7	-39.2	176.6	-71.5	3.2	0	0	0	111.6	N550 I551 Q557 L558	N550-N554 PolarHBondContact O-N 3.43Å; I551-N554 PolarHBondContact O-N 2.87Å; N554-Q557 WeakPolarHBondContact O-CB 3.29Å; N554-L558 PolarHBondContact O-N 2.83Å
555	Q	52.3	Low	46.7	Very low	57 Å²	57	68.6 Å²	68.6	27%	0.266	36%	0.359	S	S	.	.	H	α-helix	trans	-65.2	-42.9	173.6	-77.6	-74.5	-4	0	0	112.1	H416 I551 L552 L558 I559	H416-Q555 PolarHBondContact CD2-NE2 2.91Å; H416-Q555 VanDerWaalsContact CD2-NE2 3.26Å; H416-Q555 PolarHBondContact CD2-OE1 3.3Å; H416-Q555 PolarHBondContact NE2-NE2 3.27Å; I551-Q555 WeakPolarHBondContact O-CB 3.36Å; I551-Q555 WeakPolarHBondContact O-CG 3.41Å; I551-Q555 PolarHBondContact O-N 3.23Å; L552-Q555 PolarHBondContact O-N 2.94Å; Q555-L558 PolarHBondContact O-N 3.22Å; Q555-I559 WeakPolarHBondContact O-CG1 3.4Å; Q555-I559 PolarHBondContact O-N 2.99Å
556	F	50.5	Low	47	Very low	100 Å²	100	69.2 Å²	69.2	44%	0.439	36%	0.358	S	S	.	.	H	α-helix	trans	-71.7	-34.9	178.3	-152.8	-83.8	0	0	0	111.3	L412 L552 I559 L560	L412-F556 HydrophobicContact CD2-CD2 4.4Å; L412-F556 HydrophobicContact CD2-CE2 4.5Å; L552-F556 WeakPolarHBondContact O-CB 3.34Å; L552-F556 PolarHBondContact O-N 3.19Å; F556-I559 PolarHBondContact O-N 3.38Å; F556-L560 WeakPolarHBondContact O-CB 3.24Å; F556-L560 PolarHBondContact O-N 2.83Å
557	Q	52.9	Low	46.5	Very low	57 Å²	57	76.3 Å²	76.3	27%	0.266	38%	0.379	S	S	.	.	H	α-helix	trans	-55.2	-50.2	166.4	-86.2	-82.4	-17.1	0	0	110.8	S553 N554 L560 L561	S553-Q557 WeakPolarHBondContact O-CB 3.42Å; S553-Q557 WeakPolarHBondContact O-CG 3.41Å; S553-Q557 PolarHBondContact O-N 2.92Å; N554-Q557 WeakPolarHBondContact O-CB 3.29Å; Q557-L560 PolarHBondContact O-N 3.27Å; Q557-L561 VanDerWaalsContact O-CB 3.28Å; Q557-L561 WeakPolarHBondContact O-CB 3.23Å; Q557-L561 WeakPolarHBondContact O-CG 3.45Å; Q557-L561 PolarHBondContact O-N 2.92Å
558	L	50.9	Low	46.2	Very low	87 Å²	87	75.9 Å²	75.9	46%	0.455	37%	0.372	S	S	.	.	H	α-helix	trans	-63.8	-44.4	-180	-146.9	77.4	0	0	0	112.5	F420 N554 Q555 L562	F420-L558 HydrophobicContact CE1-CD2 3.96Å; F420-L558 HydrophobicContact CZ-CD2 3.78Å; N554-L558 PolarHBondContact O-N 2.83Å; Q555-L558 PolarHBondContact O-N 3.22Å; L558-L562 WeakPolarHBondContact O-CG 3.35Å; L558-L562 PolarHBondContact O-N 3.47Å
559	I	51.7	Low	45.9	Very low	28 Å²	28	78.1 Å²	78.1	14%	0.144	39%	0.391	C	S	.	.	H	α-helix	trans	-67.4	-39.1	177.5	-68.2	167.2	0	0	0	111.1	I415 Q555 F556 L562 I563	I415-I559 HydrophobicContact CG2-CD1 4.34Å; Q555-I559 WeakPolarHBondContact O-CG1 3.4Å; Q555-I559 PolarHBondContact O-N 2.99Å; F556-I559 PolarHBondContact O-N 3.38Å; I559-L562 PolarHBondContact O-N 3.49Å; I559-I563 HydrophobicContact CG2-CD1 3.9Å; I559-I563 VanDerWaalsContact O-CG1 3.3Å; I559-I563 WeakPolarHBondContact O-CG1 3.32Å; I559-I563 PolarHBondContact O-N 3.44Å
560	L	51.3	Low	45.7	Very low	69 Å²	69	79.5 Å²	79.5	36%	0.361	40%	0.398	S	S	.	.	H	α-helix	trans	-71	-39.3	177.9	-167.2	72.4	0	0	0	111.4	F556 Q557 L562 I563 I564	F556-L560 WeakPolarHBondContact O-CB 3.24Å; F556-L560 PolarHBondContact O-N 2.83Å; Q557-L560 PolarHBondContact O-N 3.27Å; L560-L562 VanDerWaalsContact C-N 3.32Å; L560-L562 PolarHBondContact O-N 3.25Å; L560-I563 PolarHBondContact O-N 3.24Å; L560-I563 VanDerWaalsContact O-N 3.16Å; L560-I564 HydrophobicContact CD1-CD1 4.45Å; L560-I564 HydrophobicContact CD2-CD1 4.26Å; L560-I564 HydrophobicContact CG-CD1 3.82Å; L560-I564 HydrophobicContact CG-CG1 4.42Å; L560-I564 WeakPolarHBondContact O-CB 3.48Å; L560-I564 VanDerWaalsContact O-CG1 3.29Å; L560-I564 WeakPolarHBondContact O-CG1 3.37Å; L560-I564 PolarHBondContact O-N 3.17Å
561	L	51	Low	45.4	Very low	61 Å²	61	78.8 Å²	78.8	32%	0.319	39%	0.393	S	S	.	.	H	α-helix	trans	-59.2	-41.6	169.8	-84.4	162.1	0	0	0	111.4	Q557 I564 N565	Q557-L561 VanDerWaalsContact O-CB 3.28Å; Q557-L561 WeakPolarHBondContact O-CB 3.23Å; Q557-L561 WeakPolarHBondContact O-CG 3.45Å; Q557-L561 PolarHBondContact O-N 2.92Å; L561-I564 PolarHBondContact O-N 2.88Å; L561-N565 WeakPolarHBondContact O-CB 3.22Å; L561-N565 VanDerWaalsContact O-CG 3.3Å; L561-N565 PolarHBondContact O-N 2.82Å; L561-N565 PolarHBondContact O-ND2 3.05Å
562	L	50.1	Low	44.6	Very low	49 Å²	49	79.5 Å²	79.5	26%	0.257	40%	0.398	S	S	.	.	H	α-helix	trans	-64.7	-39.1	173.5	-73.5	169.6	0	0	0	112.2	F420 L558 I559 L560 Y566	F420-L562 HydrophobicContact CE1-CD1 4.41Å; F420-L562 HydrophobicContact CZ-CD1 3.73Å; L558-L562 WeakPolarHBondContact O-CG 3.35Å; L558-L562 PolarHBondContact O-N 3.47Å; I559-L562 PolarHBondContact O-N 3.49Å; L560-L562 VanDerWaalsContact C-N 3.32Å; L560-L562 PolarHBondContact O-N 3.25Å; L562-Y566 HydrophobicContact CD2-CD2 4.12Å; L562-Y566 HydrophobicContact CD2-CE2 3.8Å; L562-Y566 WeakPolarHBondContact O-CB 3.29Å; L562-Y566 WeakPolarHBondContact O-CD2 3.39Å; L562-Y566 PolarHBondContact O-N 3.18Å
563	I	47.2	Very low	44.2	Very low	52 Å²	52	85.7 Å²	85.7	27%	0.267	43%	0.426	S	S	.	.	H	α-helix	trans	-69.5	-38.6	177.5	-71.9	165.4	0	0	0	112.1	I559 L560 I568	I559-I563 HydrophobicContact CG2-CD1 3.9Å; I559-I563 VanDerWaalsContact O-CG1 3.3Å; I559-I563 WeakPolarHBondContact O-CG1 3.32Å; I559-I563 PolarHBondContact O-N 3.44Å; L560-I563 PolarHBondContact O-N 3.24Å; L560-I563 VanDerWaalsContact O-N 3.16Å; I563-I568 HydrophobicContact CG2-CD1 4.26Å
564	I	45.7	Very low	43.6	Very low	79 Å²	79	89.9 Å²	89.9	41%	0.405	45%	0.445	S	S	.	.	H	α-helix	trans	-76.5	-51.6	-179.1	-69.7	171.8	0	0	0	110.9	L560 L561 Y566 R567	L560-I564 HydrophobicContact CD1-CD1 4.45Å; L560-I564 HydrophobicContact CD2-CD1 4.26Å; L560-I564 HydrophobicContact CG-CD1 3.82Å; L560-I564 HydrophobicContact CG-CG1 4.42Å; L560-I564 WeakPolarHBondContact O-CB 3.48Å; L560-I564 VanDerWaalsContact O-CG1 3.29Å; L560-I564 WeakPolarHBondContact O-CG1 3.37Å; L560-I564 PolarHBondContact O-N 3.17Å; L561-I564 PolarHBondContact O-N 2.88Å; I564-Y566 VanDerWaalsContact C-N 3.3Å; I564-Y566 PolarHBondContact O-N 2.95Å; I564-R567 PolarHBondContact O-N 3.41Å
565	N	43.7	Very low	43.2	Very low	92 Å²	92	90.9 Å²	90.9	49%	0.492	45%	0.449	S	S	.	.	H	α-helix	trans	-67.5	-28.4	-176.2	-69.3	-33.5	0	0	0	112.8	L561 R567	L561-N565 WeakPolarHBondContact O-CB 3.22Å; L561-N565 VanDerWaalsContact O-CG 3.3Å; L561-N565 PolarHBondContact O-N 2.82Å; L561-N565 PolarHBondContact O-ND2 3.05Å; N565-R567 VanDerWaalsContact C-N 3.3Å; N565-R567 PolarHBondContact O-N 2.67Å
566	Y	45	Very low	42.2	Very low	68 Å²	68	98.4 Å²	98.4	27%	0.267	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	33.6	174.2	-72.3	-71.2	0	0	0	114.5	I351 L562 I564 I568	I351-Y566 HydrophobicContact CD1-CE2 3.96Å; L562-Y566 HydrophobicContact CD2-CD2 4.12Å; L562-Y566 HydrophobicContact CD2-CE2 3.8Å; L562-Y566 WeakPolarHBondContact O-CB 3.29Å; L562-Y566 WeakPolarHBondContact O-CD2 3.39Å; L562-Y566 PolarHBondContact O-N 3.18Å; I564-Y566 VanDerWaalsContact C-N 3.3Å; I564-Y566 PolarHBondContact O-N 2.95Å; Y566-I568 PolarHBondContact O-N 2.91Å; Y566-I568 VanDerWaalsContact O-N 3.15Å
567	R	34.1	Very low	41.7	Very low	232 Å²	232	98.4 Å²	98.4	88%	0.875	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	28.7	71.1	163.9	-99.6	-167.6	175.9	-178.2	1.9	114.3	I564 N565 P569	I564-R567 PolarHBondContact O-N 3.41Å; N565-R567 VanDerWaalsContact C-N 3.3Å; N565-R567 PolarHBondContact O-N 2.67Å; R567-P569 WeakPolarHBondContact O-CD 3.3Å
568	I	35.5	Very low	41.2	Very low	53 Å²	53	100.5 Å²	100.5	27%	0.272	50%	0.495	S	S	.	.			trans	-81	120.7	171.6	-53.3	-176	0	0	0	108.7	L355 I563 Y566 I570	L355-I568 HydrophobicContact CD1-CD1 4.37Å; I563-I568 HydrophobicContact CG2-CD1 4.26Å; Y566-I568 PolarHBondContact O-N 2.91Å; Y566-I568 VanDerWaalsContact O-N 3.15Å; I568-I570 HydrophobicContact CG2-CB 3.96Å; I568-I570 HydrophobicContact CG2-CD1 3.75Å; I568-I570 HydrophobicContact CG2-CG1 3.8Å; I568-I570 PolarHBondContact O-N 2.85Å
569	P	34.6	Very low	40.6	Very low	117 Å²	117	101.3 Å²	101.3	76%	0.76	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	26	-176.4	32.1	-37.4	0	0	0	114.4	R567	R567-P569 WeakPolarHBondContact O-CD 3.3Å
570	I	38.6	Very low	40	Very low	100 Å²	100	105.6 Å²	105.6	51%	0.513	52%	0.518	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	-20.8	178.5	-66.6	174.5	0	0	0	111.2	I568 D572 Q573 L574	I568-I570 HydrophobicContact CG2-CB 3.96Å; I568-I570 HydrophobicContact CG2-CD1 3.75Å; I568-I570 HydrophobicContact CG2-CG1 3.8Å; I568-I570 PolarHBondContact O-N 2.85Å; I570-D572 PolarHBondContact O-N 2.96Å; I570-Q573 PolarHBondContact O-N 3.3Å; I570-Q573 VanDerWaalsContact O-N 3.09Å; I570-L574 HydrophobicContact CG2-CD1 4.36Å
571	I	35	Very low	39.3	Very low	76 Å²	76	107.9 Å²	107.9	39%	0.39	53%	0.528	S	S	.	.	G	3₁₀ helix	trans	-65.6	-29.8	178.6	-63	178.8	0	0	0	111.4	Q573 L574 I575	I571-Q573 PolarHBondContact O-N 3.48Å; I571-Q573 VanDerWaalsContact O-N 3.13Å; I571-L574 PolarHBondContact O-N 3.45Å; I571-I575 HydrophobicContact CG2-CD1 3.5Å; I571-I575 HydrophobicContact CG2-CG1 3.97Å; I571-I575 PolarHBondContact O-N 3.49Å
572	D	30.7	Very low	38.5	Very low	114 Å²	114	111 Å²	111	61%	0.61	54%	0.542	S	S	*	.	G	3₁₀ helix	trans	-66.1	-10.4	174.4	-122.8	45.8	0	0	0	114.1	I570	I570-D572 PolarHBondContact O-N 2.96Å
573	Q	35.2	Very low	37.6	Very low	159 Å²	159	115.4 Å²	115.4	74%	0.743	56%	0.562	S	S	*	*	G	3₁₀ helix	trans	-110.4	13.3	170.8	-66	-170.4	-14.1	0	0	113	I570 I571	I570-Q573 PolarHBondContact O-N 3.3Å; I570-Q573 VanDerWaalsContact O-N 3.09Å; I571-Q573 PolarHBondContact O-N 3.48Å; I571-Q573 VanDerWaalsContact O-N 3.13Å
574	L	33.5	Very low	36.9	Very low	119 Å²	119	120.3 Å²	120.3	62%	0.623	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.6	-6.5	174.4	-77.1	166.3	0	0	0	113.1	I570 I571	I570-L574 HydrophobicContact CG2-CD1 4.36Å; I571-L574 PolarHBondContact O-N 3.45Å
575	I	37.4	Very low	36.2	Very low	139 Å²	139	123.8 Å²	123.8	71%	0.713	60%	0.6	S	S	*	*			trans	-104.6	-4.2	170.3	-63.3	-178	0	0	0	111.2	I571	I571-I575 HydrophobicContact CG2-CD1 3.5Å; I571-I575 HydrophobicContact CG2-CG1 3.97Å; I571-I575 PolarHBondContact O-N 3.49Å
576	K	30.9	Very low	35.5	Very low	216 Å²	216	126.6 Å²	126.6	94%	0.939	61%	0.609	S	S	*	*			trans	-110.7	0	166.2	-71.1	174.9	-178.6	157.4	0	109.6

Retrieved 576 of 576 residues in 82.7 ms (Link to these results)

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