G4LY35_SCHMA Loading...

LisH domain-containing protein

AlphaFold DB , UniProt , Accession G4LY35, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 234 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	46.8	Very low	76.6	Confident	240 Å²	240	123.4 Å²	123.4	100%	1.182	64%	0.641	S	S	*	*				0	90.3	0	-155	175.2	-147.4	0	0	104.9	T3	M1-T3 PolarHBondContact O-N 2.98Å; M1-T3 VanDerWaalsContact O-N 3.15Å
2	E	58.4	Low	77.7	Confident	194 Å²	194	126.1 Å²	126.1	91%	0.907	64%	0.639	S	S	*	*			trans	-68.5	111.4	-175.5	-164.5	162	-166	0	0	106.6	A4	E2-A4 PolarHBondContact O-N 3.15Å
3	T	60.7	Low	78.6	Confident	127 Å²	127	123.5 Å²	123.5	78%	0.779	63%	0.627	S	S	*	*			trans	-61.7	111.8	175.5	50.4	0	0	0	0	105.7	M1 S5	M1-T3 PolarHBondContact O-N 2.98Å; M1-T3 VanDerWaalsContact O-N 3.15Å; T3-S5 PolarHBondContact O-N 3.2Å
4	A	66.7	Low	79.3	Confident	79 Å²	79	126.8 Å²	126.8	65%	0.653	63%	0.628	S	S	*	*			trans	-41.2	121.1	169	0	0	0	0	0	107	E2 N6	E2-A4 PolarHBondContact O-N 3.15Å; A4-N6 PolarHBondContact O-N 2.87Å
5	S	83.2	Confident	79.9	Confident	52 Å²	52	122.3 Å²	122.3	36%	0.364	61%	0.611	S	S	.	*			trans	-56.8	146.5	-169.3	-178.8	0	0	0	0	108.2	T3 D7 D8 L9	T3-S5 PolarHBondContact O-N 3.2Å; S5-D7 PolarHBondContact O-N 2.95Å; S5-D8 VanDerWaalsContact CB-OD2 3.28Å; S5-D8 WeakPolarHBondContact CB-OD2 3.36Å; S5-D8 PolarHBondContact N-OD2 3.12Å; S5-D8 VanDerWaalsContact N-OD2 3.13Å; S5-D8 WeakPolarHBondContact O-CB 3.46Å; S5-D8 PolarHBondContact O-N 3.03Å; S5-L9 PolarHBondContact O-N 3.45Å
6	N	84.5	Confident	80.5	Confident	103 Å²	103	117.7 Å²	117.7	55%	0.551	59%	0.591	S	S	*	*	H	α-helix	trans	-51.8	-32.3	175.2	-171.7	-84.7	0	0	0	110.9	A4 K10	A4-N6 PolarHBondContact O-N 2.87Å; N6-K10 VanDerWaalsContact O-CG 3.28Å; N6-K10 WeakPolarHBondContact O-CG 3.42Å; N6-K10 PolarHBondContact O-N 3.28Å; N6-K10 WeakPolarHBondContact OD1-CE 3.1Å; N6-K10 PolarHBondContact OD1-NZ 2.81Å
7	D	88.7	Confident	80.9	Confident	98 Å²	98	114.9 Å²	114.9	52%	0.524	58%	0.578	S	S	.	*	H	α-helix	trans	-75.4	-35	177.2	-57.4	-41.3	0	0	0	113.2	S5 L9 K10 R11	S5-D7 PolarHBondContact O-N 2.95Å; D7-L9 VanDerWaalsContact C-N 3.34Å; D7-K10 PolarHBondContact O-N 3.32Å; D7-K10 IonicContact OD1-NZ 3.31Å; D7-K10 PolarHBondContact OD1-NZ 3.38Å; D7-R11 VanDerWaalsContact O-CB 3.25Å; D7-R11 WeakPolarHBondContact O-CB 3.09Å; D7-R11 PolarHBondContact O-N 3.28Å
8	D	88.6	Confident	81.3	Confident	93 Å²	93	113.3 Å²	113.3	50%	0.497	57%	0.571	S	S	.	*	H	α-helix	trans	-63	-44.1	173	-65.8	-36.6	0	0	0	110.6	S5 R11 Y12	S5-D8 VanDerWaalsContact CB-OD2 3.28Å; S5-D8 WeakPolarHBondContact CB-OD2 3.36Å; S5-D8 PolarHBondContact N-OD2 3.12Å; S5-D8 VanDerWaalsContact N-OD2 3.13Å; S5-D8 WeakPolarHBondContact O-CB 3.46Å; S5-D8 PolarHBondContact O-N 3.03Å; D8-R11 PolarHBondContact O-N 3.34Å; D8-Y12 WeakPolarHBondContact O-CB 3.13Å; D8-Y12 PolarHBondContact O-N 3.47Å
9	L	88.2	Confident	81.6	Confident	98 Å²	98	114.6 Å²	114.6	51%	0.513	58%	0.58	S	S	.	*	H	α-helix	trans	-64.9	-45.6	177.1	-179.4	61	0	0	0	111.6	S5 D7 R11 Y12 L13	S5-L9 PolarHBondContact O-N 3.45Å; D7-L9 VanDerWaalsContact C-N 3.34Å; L9-R11 VanDerWaalsContact C-N 3.31Å; L9-R11 PolarHBondContact O-N 2.92Å; L9-Y12 PolarHBondContact O-N 3.27Å; L9-L13 HydrophobicContact CD1-CD1 4.43Å; L9-L13 HydrophobicContact CD1-CG 4.38Å; L9-L13 HydrophobicContact CG-CD1 4.29Å; L9-L13 WeakPolarHBondContact O-CG 3.41Å; L9-L13 PolarHBondContact O-N 3.34Å
10	K	88.7	Confident	81.8	Confident	96 Å²	96	115.3 Å²	115.3	42%	0.417	59%	0.585	S	S	.	*	H	α-helix	trans	-58.9	-43.3	174.6	-78.5	166.3	176.1	153.4	0	111.6	N6 D7 L13 R14	N6-K10 VanDerWaalsContact O-CG 3.28Å; N6-K10 WeakPolarHBondContact O-CG 3.42Å; N6-K10 PolarHBondContact O-N 3.28Å; N6-K10 WeakPolarHBondContact OD1-CE 3.1Å; N6-K10 PolarHBondContact OD1-NZ 2.81Å; D7-K10 PolarHBondContact O-N 3.32Å; D7-K10 IonicContact OD1-NZ 3.31Å; D7-K10 PolarHBondContact OD1-NZ 3.38Å; K10-L13 PolarHBondContact O-N 2.87Å; K10-R14 WeakPolarHBondContact O-CB 2.96Å; K10-R14 VanDerWaalsContact O-CG 3.27Å; K10-R14 WeakPolarHBondContact O-CG 3.28Å; K10-R14 PolarHBondContact O-N 2.9Å
11	R	88.4	Confident	82.1	Confident	177 Å²	177	111.1 Å²	111.1	67%	0.668	57%	0.571	S	S	*	*	H	α-helix	trans	-63.5	-46.3	179.2	-177.4	172.2	173.1	-107	-3.8	110.6	D7 D8 L9 R14 T15	D7-R11 VanDerWaalsContact O-CB 3.25Å; D7-R11 WeakPolarHBondContact O-CB 3.09Å; D7-R11 PolarHBondContact O-N 3.28Å; D8-R11 PolarHBondContact O-N 3.34Å; L9-R11 VanDerWaalsContact C-N 3.31Å; L9-R11 PolarHBondContact O-N 2.92Å; R11-R14 WeakPolarHBondContact O-CB 3.43Å; R11-R14 PolarHBondContact O-N 3.48Å; R11-T15 PolarHBondContact O-N 2.96Å; R11-T15 PolarHBondContact O-OG1 3.2Å; R11-T15 VanDerWaalsContact O-OG1 3.12Å
12	Y	90.1	Very high	84.2	Confident	156 Å²	156	104.9 Å²	104.9	61%	0.612	54%	0.537	S	S	*	.	H	α-helix	trans	-59.7	-47.1	176.4	-176.8	-97.3	0	0	0	112.2	D8 L9 R14 T15 T16	D8-Y12 WeakPolarHBondContact O-CB 3.13Å; D8-Y12 PolarHBondContact O-N 3.47Å; L9-Y12 PolarHBondContact O-N 3.27Å; Y12-R14 VanDerWaalsContact C-N 3.34Å; Y12-R14 PolarHBondContact O-N 3.1Å; Y12-T15 WeakPolarHBondContact CA-OG1 3.4Å; Y12-T15 PolarHBondContact O-N 3.15Å; Y12-T15 PolarHBondContact O-OG1 3.33Å; Y12-T16 PolarHBondContact O-N 3.49Å; Y12-T16 PolarHBondContact O-OG1 2.99Å; Y12-T16 VanDerWaalsContact O-OG1 3.04Å
13	L	89.1	Confident	85.6	Confident	93 Å²	93	97.3 Å²	97.3	49%	0.487	50%	0.503	S	S	.	.	H	α-helix	trans	-62.5	-41.3	176.4	-71.1	174.5	0	0	0	112.1	L9 K10 T16 L17	L9-L13 HydrophobicContact CD1-CD1 4.43Å; L9-L13 HydrophobicContact CD1-CG 4.38Å; L9-L13 HydrophobicContact CG-CD1 4.29Å; L9-L13 WeakPolarHBondContact O-CG 3.41Å; L9-L13 PolarHBondContact O-N 3.34Å; K10-L13 PolarHBondContact O-N 2.87Å; L13-T16 PolarHBondContact O-N 2.96Å; L13-L17 WeakPolarHBondContact O-CB 3.17Å; L13-L17 VanDerWaalsContact O-CG 3.28Å; L13-L17 WeakPolarHBondContact O-CG 3.1Å; L13-L17 PolarHBondContact O-N 3.3Å
14	R	88.8	Confident	86.9	Confident	169 Å²	169	94.6 Å²	94.6	64%	0.638	49%	0.489	S	S	*	.	H	α-helix	trans	-60.4	-46.4	175	-78.7	174.9	178.4	177.4	0.2	111.3	K10 R11 Y12 L17 D18	K10-R14 WeakPolarHBondContact O-CB 2.96Å; K10-R14 VanDerWaalsContact O-CG 3.27Å; K10-R14 WeakPolarHBondContact O-CG 3.28Å; K10-R14 PolarHBondContact O-N 2.9Å; R11-R14 WeakPolarHBondContact O-CB 3.43Å; R11-R14 PolarHBondContact O-N 3.48Å; Y12-R14 VanDerWaalsContact C-N 3.34Å; Y12-R14 PolarHBondContact O-N 3.1Å; R14-L17 PolarHBondContact O-N 2.78Å; R14-D18 WeakPolarHBondContact O-CB 3.17Å; R14-D18 PolarHBondContact O-N 2.91Å
15	T	87.6	Confident	88	Confident	60 Å²	60	96 Å²	96	37%	0.368	48%	0.482	S	S	.	.	H	α-helix	trans	-62.9	-44.8	178.7	45.8	0	0	0	0	111.4	R11 Y12 L17 D18 D19	R11-T15 PolarHBondContact O-N 2.96Å; R11-T15 PolarHBondContact O-OG1 3.2Å; R11-T15 VanDerWaalsContact O-OG1 3.12Å; Y12-T15 WeakPolarHBondContact CA-OG1 3.4Å; Y12-T15 PolarHBondContact O-N 3.15Å; Y12-T15 PolarHBondContact O-OG1 3.33Å; T15-L17 PolarHBondContact O-N 2.83Å; T15-D18 PolarHBondContact O-N 3.49Å; T15-D19 WeakPolarHBondContact O-CB 3.25Å; T15-D19 PolarHBondContact O-N 3.35Å
16	T	89.8	Confident	88.5	Confident	48 Å²	48	96.7 Å²	96.7	29%	0.294	48%	0.481	S	S	.	.	H	α-helix	trans	-62.1	-44	177.3	-55.7	0	0	0	0	112.4	Y12 L13 D18 D19 D20	Y12-T16 PolarHBondContact O-N 3.49Å; Y12-T16 PolarHBondContact O-OG1 2.99Å; Y12-T16 VanDerWaalsContact O-OG1 3.04Å; L13-T16 PolarHBondContact O-N 2.96Å; T16-D18 VanDerWaalsContact C-N 3.3Å; T16-D18 PolarHBondContact O-N 3.02Å; T16-D19 PolarHBondContact O-N 2.83Å; T16-D20 PolarHBondContact O-N 2.92Å; T16-D20 VanDerWaalsContact O-N 3.08Å
17	L	86.4	Confident	88.9	Confident	70 Å²	70	96.9 Å²	96.9	37%	0.366	48%	0.477	S	S	.	.	H	α-helix	trans	-68.3	-28.2	177.7	-70	172.9	0	0	0	113.2	L13 R14 T15 F22 L23	L13-L17 WeakPolarHBondContact O-CB 3.17Å; L13-L17 VanDerWaalsContact O-CG 3.28Å; L13-L17 WeakPolarHBondContact O-CG 3.1Å; L13-L17 PolarHBondContact O-N 3.3Å; R14-L17 PolarHBondContact O-N 2.78Å; T15-L17 PolarHBondContact O-N 2.83Å; L17-F22 HydrophobicContact CD2-CB 4.43Å; L17-F22 HydrophobicContact CD2-CD1 4.29Å; L17-F22 PolarHBondContact O-N 3.02Å; L17-F22 VanDerWaalsContact O-N 3.11Å; L17-L23 HydrophobicContact CB-CB 4.12Å; L17-L23 WeakPolarHBondContact O-CB 3.21Å; L17-L23 PolarHBondContact O-N 3.02Å
18	D	88.9	Confident	89	Confident	87 Å²	87	94.8 Å²	94.8	47%	0.465	47%	0.473	S	S	.	.	H	α-helix	trans	-77.9	-40.9	176.4	-148.5	34.7	0	0	0	111.1	R14 T15 T16 D20 G21 L23	R14-D18 WeakPolarHBondContact O-CB 3.17Å; R14-D18 PolarHBondContact O-N 2.91Å; T15-D18 PolarHBondContact O-N 3.49Å; T16-D18 VanDerWaalsContact C-N 3.3Å; T16-D18 PolarHBondContact O-N 3.02Å; D18-D20 VanDerWaalsContact C-N 3.34Å; D18-D20 PolarHBondContact O-N 2.86Å; D18-G21 WeakPolarHBondContact O-CA 3.25Å; D18-G21 PolarHBondContact O-N 3.4Å; D18-L23 HydrophobicContact CB-CB 4.38Å; D18-L23 HydrophobicContact CB-CD2 3.99Å
19	D	86.6	Confident	89.1	Confident	138 Å²	138	94 Å²	94	74%	0.738	47%	0.469	S	S	*	.	H	α-helix	trans	-62.5	-39	176	-69.3	-22.8	0	0	0	111.9	T15 T16 G21	T15-D19 WeakPolarHBondContact O-CB 3.25Å; T15-D19 PolarHBondContact O-N 3.35Å; T16-D19 PolarHBondContact O-N 2.83Å; D19-G21 PolarHBondContact O-N 2.82Å
20	D	86.7	Confident	89.4	Confident	128 Å²	128	93.5 Å²	93.5	68%	0.684	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-7.8	174.1	-71.3	-19.9	0	0	0	112.9	T16 D18 F22	T16-D20 PolarHBondContact O-N 2.92Å; T16-D20 VanDerWaalsContact O-N 3.08Å; D18-D20 VanDerWaalsContact C-N 3.34Å; D18-D20 PolarHBondContact O-N 2.86Å; D20-F22 PolarHBondContact O-N 3.33Å
21	G	87.2	Confident	89.4	Confident	27 Å²	27	93.4 Å²	93.4	28%	0.278	47%	0.469	S	S	.	.	S	Bend	trans	75.9	-8.4	-176	0	0	0	0	0	115	D18 D19 L23 S24 E25	D18-G21 WeakPolarHBondContact O-CA 3.25Å; D18-G21 PolarHBondContact O-N 3.4Å; D19-G21 PolarHBondContact O-N 2.82Å; G21-L23 VanDerWaalsContact C-N 3.28Å; G21-L23 PolarHBondContact O-N 3.25Å; G21-S24 WeakPolarHBondContact O-CB 3.36Å; G21-S24 PolarHBondContact O-N 3.17Å; G21-S24 PolarHBondContact O-OG 2.94Å; G21-E25 PolarHBondContact O-N 3.17Å
22	F	89.9	Confident	89.5	Confident	109 Å²	109	92 Å²	92	48%	0.478	47%	0.468	S	S	.	.	H	α-helix	trans	-62.5	-33.3	-177.1	-153.8	-106.4	0	0	0	112.7	L17 D20 S24 E25 I26	L17-F22 HydrophobicContact CD2-CB 4.43Å; L17-F22 HydrophobicContact CD2-CD1 4.29Å; L17-F22 PolarHBondContact O-N 3.02Å; L17-F22 VanDerWaalsContact O-N 3.11Å; D20-F22 PolarHBondContact O-N 3.33Å; F22-S24 VanDerWaalsContact C-N 3.3Å; F22-S24 PolarHBondContact O-N 3.46Å; F22-E25 PolarHBondContact O-N 3.23Å; F22-I26 HydrophobicContact CD1-CD1 3.49Å; F22-I26 VanDerWaalsContact CD1-CD1 3.49Å; F22-I26 HydrophobicContact CD1-CG1 4.07Å; F22-I26 HydrophobicContact CE1-CD1 3.64Å; F22-I26 HydrophobicContact CE1-CG1 4.09Å; F22-I26 WeakPolarHBondContact O-CG1 3.47Å; F22-I26 PolarHBondContact O-N 3.36Å
23	L	89.1	Confident	89.5	Confident	36 Å²	36	91.4 Å²	91.4	19%	0.188	47%	0.469	C	S	.	.	H	α-helix	trans	-63.9	-37.2	175.7	-174.7	60.2	0	0	0	111.8	L17 D18 G21 K27	L17-L23 HydrophobicContact CB-CB 4.12Å; L17-L23 WeakPolarHBondContact O-CB 3.21Å; L17-L23 PolarHBondContact O-N 3.02Å; D18-L23 HydrophobicContact CB-CB 4.38Å; D18-L23 HydrophobicContact CB-CD2 3.99Å; G21-L23 VanDerWaalsContact C-N 3.28Å; G21-L23 PolarHBondContact O-N 3.25Å; L23-K27 HydrophobicContact CG-CD 4.24Å; L23-K27 WeakPolarHBondContact O-CB 3.34Å; L23-K27 WeakPolarHBondContact O-CD 3.28Å; L23-K27 WeakPolarHBondContact O-CG 3.28Å; L23-K27 PolarHBondContact O-N 2.98Å
24	S	87.4	Confident	89.6	Confident	70 Å²	70	91 Å²	91	49%	0.49	47%	0.466	S	S	.	.	H	α-helix	trans	-68.4	-38.9	176.7	79	0	0	0	0	111.7	G21 F22 K27 A28	G21-S24 WeakPolarHBondContact O-CB 3.36Å; G21-S24 PolarHBondContact O-N 3.17Å; G21-S24 PolarHBondContact O-OG 2.94Å; F22-S24 VanDerWaalsContact C-N 3.3Å; F22-S24 PolarHBondContact O-N 3.46Å; S24-K27 PolarHBondContact O-N 3.04Å; S24-A28 WeakPolarHBondContact O-CB 3.1Å; S24-A28 PolarHBondContact O-N 3.41Å
25	E	90.6	Very high	89.2	Confident	109 Å²	109	89.3 Å²	89.3	51%	0.509	46%	0.464	S	S	.	.	H	α-helix	trans	-63.6	-50	175.3	-175.7	177.6	178.2	0	0	111.3	G21 F22 K27 A28 D29	G21-E25 PolarHBondContact O-N 3.17Å; F22-E25 PolarHBondContact O-N 3.23Å; E25-K27 VanDerWaalsContact C-N 3.34Å; E25-K27 PolarHBondContact O-N 3.28Å; E25-A28 PolarHBondContact O-N 3.2Å; E25-D29 WeakPolarHBondContact O-CB 3.18Å; E25-D29 PolarHBondContact O-N 3.39Å
26	I	92.7	Very high	88.9	Confident	65 Å²	65	90.7 Å²	90.7	33%	0.333	47%	0.469	S	S	.	.	H	α-helix	trans	-59.3	-45.1	176.5	-68.1	167.5	0	0	0	110.9	F22 A28 D29 I30	F22-I26 HydrophobicContact CD1-CD1 3.49Å; F22-I26 VanDerWaalsContact CD1-CD1 3.49Å; F22-I26 HydrophobicContact CD1-CG1 4.07Å; F22-I26 HydrophobicContact CE1-CD1 3.64Å; F22-I26 HydrophobicContact CE1-CG1 4.09Å; F22-I26 WeakPolarHBondContact O-CG1 3.47Å; F22-I26 PolarHBondContact O-N 3.36Å; I26-A28 VanDerWaalsContact C-N 3.34Å; I26-A28 PolarHBondContact O-N 2.88Å; I26-D29 PolarHBondContact O-N 3.08Å; I26-I30 HydrophobicContact CG2-CD1 3.65Å; I26-I30 HydrophobicContact CG2-CG1 4.27Å; I26-I30 WeakPolarHBondContact O-CB 3.49Å; I26-I30 VanDerWaalsContact O-CG1 3.27Å; I26-I30 WeakPolarHBondContact O-CG1 3.3Å; I26-I30 PolarHBondContact O-N 2.9Å
27	K	92.6	Very high	88.5	Confident	108 Å²	108	95.2 Å²	95.2	47%	0.47	48%	0.484	S	S	.	.	H	α-helix	trans	-59.2	-46.7	176.9	-77.6	169.1	-179.6	168.1	0	110.6	L23 S24 E25 D29 I30 L31	L23-K27 HydrophobicContact CG-CD 4.24Å; L23-K27 WeakPolarHBondContact O-CB 3.34Å; L23-K27 WeakPolarHBondContact O-CD 3.28Å; L23-K27 WeakPolarHBondContact O-CG 3.28Å; L23-K27 PolarHBondContact O-N 2.98Å; S24-K27 PolarHBondContact O-N 3.04Å; E25-K27 VanDerWaalsContact C-N 3.34Å; E25-K27 PolarHBondContact O-N 3.28Å; K27-D29 VanDerWaalsContact C-N 3.34Å; K27-D29 PolarHBondContact O-N 3.27Å; K27-I30 PolarHBondContact O-N 2.85Å; K27-L31 WeakPolarHBondContact O-CB 3.49Å; K27-L31 WeakPolarHBondContact O-CG 3.34Å; K27-L31 PolarHBondContact O-N 3.17Å
28	A	90.6	Very high	88.1	Confident	53 Å²	53	95.7 Å²	95.7	44%	0.438	49%	0.486	S	S	.	.	H	α-helix	trans	-62.4	-40.1	177.9	0	0	0	0	0	112.1	S24 E25 I26 L31 K32	S24-A28 WeakPolarHBondContact O-CB 3.1Å; S24-A28 PolarHBondContact O-N 3.41Å; E25-A28 PolarHBondContact O-N 3.2Å; I26-A28 VanDerWaalsContact C-N 3.34Å; I26-A28 PolarHBondContact O-N 2.88Å; A28-L31 PolarHBondContact O-N 3.36Å; A28-K32 VanDerWaalsContact O-CB 3.25Å; A28-K32 WeakPolarHBondContact O-CB 3.21Å; A28-K32 PolarHBondContact O-N 3.12Å
29	D	92.3	Very high	87.1	Confident	76 Å²	76	98.8 Å²	98.8	41%	0.406	49%	0.492	S	S	.	.	H	α-helix	trans	-68.4	-41.4	177.7	-91.6	-6.4	0	0	0	113	E25 I26 K27 K32 K33	E25-D29 WeakPolarHBondContact O-CB 3.18Å; E25-D29 PolarHBondContact O-N 3.39Å; I26-D29 PolarHBondContact O-N 3.08Å; K27-D29 VanDerWaalsContact C-N 3.34Å; K27-D29 PolarHBondContact O-N 3.27Å; D29-K32 PolarHBondContact O-N 2.77Å; D29-K33 WeakPolarHBondContact O-CB 3.43Å; D29-K33 VanDerWaalsContact O-CG 3.27Å; D29-K33 WeakPolarHBondContact O-CG 3.39Å; D29-K33 PolarHBondContact O-N 3.12Å
30	I	93.2	Very high	85.8	Confident	89 Å²	89	96.2 Å²	96.2	46%	0.456	48%	0.478	S	S	.	.	H	α-helix	trans	-63.5	-48.4	173.5	-69.5	169.9	0	0	0	109.3	I26 K27 K32 K33 I34	I26-I30 HydrophobicContact CG2-CD1 3.65Å; I26-I30 HydrophobicContact CG2-CG1 4.27Å; I26-I30 WeakPolarHBondContact O-CB 3.49Å; I26-I30 VanDerWaalsContact O-CG1 3.27Å; I26-I30 WeakPolarHBondContact O-CG1 3.3Å; I26-I30 PolarHBondContact O-N 2.9Å; K27-I30 PolarHBondContact O-N 2.85Å; I30-K32 VanDerWaalsContact C-N 3.32Å; I30-K32 PolarHBondContact O-N 3.05Å; I30-K33 PolarHBondContact O-N 3.11Å; I30-K33 VanDerWaalsContact O-N 3.15Å; I30-I34 HydrophobicContact CG2-CD1 3.58Å; I30-I34 HydrophobicContact CG2-CG1 4.22Å; I30-I34 WeakPolarHBondContact O-CB 3.49Å; I30-I34 VanDerWaalsContact O-CG1 3.27Å; I30-I34 WeakPolarHBondContact O-CG1 3.46Å; I30-I34 PolarHBondContact O-N 3.12Å
31	L	88.8	Confident	84.5	Confident	93 Å²	93	97 Å²	97	49%	0.487	48%	0.477	S	S	.	.	H	α-helix	trans	-57.1	-46.7	175.9	-73.9	173	0	0	0	110.5	K27 A28 K33 I34 F35	K27-L31 WeakPolarHBondContact O-CB 3.49Å; K27-L31 WeakPolarHBondContact O-CG 3.34Å; K27-L31 PolarHBondContact O-N 3.17Å; A28-L31 PolarHBondContact O-N 3.36Å; L31-K33 PolarHBondContact O-N 3.21Å; L31-I34 PolarHBondContact O-N 3.23Å; L31-F35 HydrophobicContact CB-CD2 4.46Å; L31-F35 VanDerWaalsContact O-CB 3.28Å; L31-F35 WeakPolarHBondContact O-CB 3.07Å; L31-F35 VanDerWaalsContact O-CD2 3.3Å; L31-F35 WeakPolarHBondContact O-CD2 3.16Å; L31-F35 PolarHBondContact O-N 3.5Å
32	K	91.5	Very high	82.6	Confident	148 Å²	148	98.5 Å²	98.5	64%	0.643	48%	0.484	S	S	*	.	H	α-helix	trans	-58.7	-43.5	175.6	-178.7	180	179.4	-179.3	0	112.2	A28 D29 I30 N36	A28-K32 VanDerWaalsContact O-CB 3.25Å; A28-K32 WeakPolarHBondContact O-CB 3.21Å; A28-K32 PolarHBondContact O-N 3.12Å; D29-K32 PolarHBondContact O-N 2.77Å; I30-K32 VanDerWaalsContact C-N 3.32Å; I30-K32 PolarHBondContact O-N 3.05Å; K32-N36 WeakPolarHBondContact O-CB 3.22Å; K32-N36 PolarHBondContact O-N 3.31Å
33	K	89.5	Confident	80.6	Confident	143 Å²	143	98.9 Å²	98.9	62%	0.622	50%	0.497	S	S	*	.	H	α-helix	trans	-66	-40.8	176.8	-73.6	171.4	-166.9	-74.6	0	111.7	D29 I30 L31 K37	D29-K33 WeakPolarHBondContact O-CB 3.43Å; D29-K33 VanDerWaalsContact O-CG 3.27Å; D29-K33 WeakPolarHBondContact O-CG 3.39Å; D29-K33 PolarHBondContact O-N 3.12Å; I30-K33 PolarHBondContact O-N 3.11Å; I30-K33 VanDerWaalsContact O-N 3.15Å; L31-K33 PolarHBondContact O-N 3.21Å; K33-K37 WeakPolarHBondContact O-CB 3.39Å; K33-K37 WeakPolarHBondContact O-CG 3.34Å; K33-K37 PolarHBondContact O-N 3.16Å
34	I	90.9	Very high	78.6	Confident	85 Å²	85	102.4 Å²	102.4	44%	0.436	51%	0.513	S	S	.	.	H	α-helix	trans	-65.1	-51.8	175.4	-67.7	168.9	0	0	0	109.6	I30 L31 N36 K37 I38	I30-I34 HydrophobicContact CG2-CD1 3.58Å; I30-I34 HydrophobicContact CG2-CG1 4.22Å; I30-I34 WeakPolarHBondContact O-CB 3.49Å; I30-I34 VanDerWaalsContact O-CG1 3.27Å; I30-I34 WeakPolarHBondContact O-CG1 3.46Å; I30-I34 PolarHBondContact O-N 3.12Å; L31-I34 PolarHBondContact O-N 3.23Å; I34-N36 VanDerWaalsContact C-N 3.29Å; I34-N36 PolarHBondContact O-N 3.47Å; I34-K37 CarbonylContact O-C 3.58Å; I34-K37 WeakPolarHBondContact O-CA 3.5Å; I34-K37 WeakPolarHBondContact O-CB 3.31Å; I34-K37 PolarHBondContact O-N 3.2Å; I34-I38 HydrophobicContact CG2-CG2 4.34Å; I34-I38 WeakPolarHBondContact O-CG1 3.5Å; I34-I38 PolarHBondContact O-N 2.87Å
35	F	81.1	Confident	76.5	Confident	134 Å²	134	102.9 Å²	102.9	59%	0.588	51%	0.509	S	S	*	.	H	α-helix	trans	-55.9	-42.6	176.7	-93.7	-78.5	0	0	0	111.9	L31 I38 R39	L31-F35 HydrophobicContact CB-CD2 4.46Å; L31-F35 VanDerWaalsContact O-CB 3.28Å; L31-F35 WeakPolarHBondContact O-CB 3.07Å; L31-F35 VanDerWaalsContact O-CD2 3.3Å; L31-F35 WeakPolarHBondContact O-CD2 3.16Å; L31-F35 PolarHBondContact O-N 3.5Å; F35-I38 HydrophobicContact CD1-CD1 3.85Å; F35-I38 HydrophobicContact CD1-CG1 4.48Å; F35-I38 HydrophobicContact CE1-CD1 4.17Å; F35-I38 HydrophobicContact CG-CD1 4.31Å; F35-I38 VanDerWaalsContact O-CG1 3.24Å; F35-I38 WeakPolarHBondContact O-CG1 3.01Å; F35-R39 WeakPolarHBondContact O-CB 3.35Å; F35-R39 PolarHBondContact O-N 3.41Å
36	N	81.4	Confident	74.3	Confident	89 Å²	89	104.7 Å²	104.7	48%	0.476	52%	0.515	S	S	.	.	H	α-helix	trans	-65.9	-42.6	175.5	-168.6	28.7	0	0	0	111.5	K32 I34 R39 N40	K32-N36 WeakPolarHBondContact O-CB 3.22Å; K32-N36 PolarHBondContact O-N 3.31Å; I34-N36 VanDerWaalsContact C-N 3.29Å; I34-N36 PolarHBondContact O-N 3.47Å; N36-R39 PolarHBondContact O-N 2.72Å; N36-N40 WeakPolarHBondContact O-CB 3.37Å; N36-N40 PolarHBondContact O-N 2.94Å; N36-N40 PolarHBondContact O-ND2 3.42Å; N36-N40 PolarHBondContact OD1-ND2 3.03Å
37	K	81.1	Confident	71.9	Confident	142 Å²	142	107.1 Å²	107.1	62%	0.617	53%	0.533	S	S	*	.	H	α-helix	trans	-62.9	-47.4	175.8	-79.2	-175	-178.6	-168.7	0	111.9	K33 I34 R39 N40 Q41	K33-K37 WeakPolarHBondContact O-CB 3.39Å; K33-K37 WeakPolarHBondContact O-CG 3.34Å; K33-K37 PolarHBondContact O-N 3.16Å; I34-K37 CarbonylContact O-C 3.58Å; I34-K37 WeakPolarHBondContact O-CA 3.5Å; I34-K37 WeakPolarHBondContact O-CB 3.31Å; I34-K37 PolarHBondContact O-N 3.2Å; K37-R39 VanDerWaalsContact C-N 3.33Å; K37-R39 PolarHBondContact O-N 3.09Å; K37-N40 CarbonylContact O-C 3.59Å; K37-N40 PolarHBondContact O-N 2.69Å; K37-Q41 VanDerWaalsContact O-CB 3.29Å; K37-Q41 WeakPolarHBondContact O-CB 3.47Å; K37-Q41 WeakPolarHBondContact O-CG 3.31Å; K37-Q41 PolarHBondContact O-N 2.88Å
38	I	78.1	Confident	69.4	Low	80 Å²	80	104.4 Å²	104.4	41%	0.41	53%	0.528	S	S	.	.	H	α-helix	trans	-68.7	-32.2	178.6	67.4	-177.4	0	0	0	111.7	I34 F35 Q41 S42	I34-I38 HydrophobicContact CG2-CG2 4.34Å; I34-I38 WeakPolarHBondContact O-CG1 3.5Å; I34-I38 PolarHBondContact O-N 2.87Å; F35-I38 HydrophobicContact CD1-CD1 3.85Å; F35-I38 HydrophobicContact CD1-CG1 4.48Å; F35-I38 HydrophobicContact CE1-CD1 4.17Å; F35-I38 HydrophobicContact CG-CD1 4.31Å; F35-I38 VanDerWaalsContact O-CG1 3.24Å; F35-I38 WeakPolarHBondContact O-CG1 3.01Å; I38-Q41 PolarHBondContact O-N 3.21Å; I38-S42 VanDerWaalsContact O-CB 3.31Å; I38-S42 WeakPolarHBondContact O-CB 3.4Å; I38-S42 PolarHBondContact O-N 3.1Å
39	R	68.6	Low	67.4	Low	153 Å²	153	106.9 Å²	106.9	58%	0.577	54%	0.54	S	S	*	.	H	α-helix	trans	-66.1	-43.2	173.8	-175.7	174.3	-174.4	162.7	0.5	111.4	F35 N36 K37 Q41 S42 E44	F35-R39 WeakPolarHBondContact O-CB 3.35Å; F35-R39 PolarHBondContact O-N 3.41Å; N36-R39 PolarHBondContact O-N 2.72Å; K37-R39 VanDerWaalsContact C-N 3.33Å; K37-R39 PolarHBondContact O-N 3.09Å; R39-Q41 VanDerWaalsContact C-N 3.31Å; R39-Q41 PolarHBondContact O-N 2.98Å; R39-S42 WeakPolarHBondContact O-CB 3.5Å; R39-S42 PolarHBondContact O-N 3.23Å; R39-E44 IonicContact CZ-OE2 3.9Å; R39-E44 IonicContact NE-OE2 3.14Å; R39-E44 PolarHBondContact NE-OE2 3.22Å; R39-E44 VanDerWaalsContact NE-OE2 3.14Å; R39-E44 IonicContact NH2-OE2 2.91Å
40	N	59	Low	65.3	Low	84 Å²	84	107.4 Å²	107.4	45%	0.449	55%	0.546	S	S	.	.	H	α-helix	trans	-76.2	-17.9	176.8	-62.1	-33.3	0	0	0	113.2	N36 K37 K46	N36-N40 WeakPolarHBondContact O-CB 3.37Å; N36-N40 PolarHBondContact O-N 2.94Å; N36-N40 PolarHBondContact O-ND2 3.42Å; N36-N40 PolarHBondContact OD1-ND2 3.03Å; K37-N40 CarbonylContact O-C 3.59Å; K37-N40 PolarHBondContact O-N 2.69Å; N40-K46 WeakPolarHBondContact O-CE 3.48Å; N40-K46 PolarHBondContact O-NZ 2.99Å
41	Q	59.6	Low	63.2	Low	143 Å²	143	104.1 Å²	104.1	67%	0.668	53%	0.531	S	S	*	.	H	α-helix	trans	-89	-30.8	172.6	-77.5	175.9	-27.1	0	0	112	K37 I38 R39	K37-Q41 VanDerWaalsContact O-CB 3.29Å; K37-Q41 WeakPolarHBondContact O-CB 3.47Å; K37-Q41 WeakPolarHBondContact O-CG 3.31Å; K37-Q41 PolarHBondContact O-N 2.88Å; I38-Q41 PolarHBondContact O-N 3.21Å; R39-Q41 VanDerWaalsContact C-N 3.31Å; R39-Q41 PolarHBondContact O-N 2.98Å
42	S	45.5	Very low	61.7	Low	59 Å²	59	103.6 Å²	103.6	41%	0.413	53%	0.529	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.3	130.3	166.8	-170.4	0	0	0	0	106.1	I38 R39 E44	I38-S42 VanDerWaalsContact O-CB 3.31Å; I38-S42 WeakPolarHBondContact O-CB 3.4Å; I38-S42 PolarHBondContact O-N 3.1Å; R39-S42 WeakPolarHBondContact O-CB 3.5Å; R39-S42 PolarHBondContact O-N 3.23Å; S42-E44 PolarHBondContact O-N 2.93Å
43	P	49.7	Very low	60.3	Low	117 Å²	117	100.4 Å²	100.4	76%	0.76	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	48.5	171.4	31	-34.5	0	0	0	110.2	L45	P43-L45 PolarHBondContact O-N 3.45Å
44	E	45.6	Very low	59.1	Low	111 Å²	111	98.6 Å²	98.6	52%	0.519	52%	0.515	S	S	.	.	S	Bend	trans	-61.7	78.5	149.7	-82.7	-164.7	142.9	0	0	106.4	R39 S42 K46	R39-E44 IonicContact CZ-OE2 3.9Å; R39-E44 IonicContact NE-OE2 3.14Å; R39-E44 PolarHBondContact NE-OE2 3.22Å; R39-E44 VanDerWaalsContact NE-OE2 3.14Å; R39-E44 IonicContact NH2-OE2 2.91Å; S42-E44 PolarHBondContact O-N 2.93Å; E44-K46 PolarHBondContact O-N 3.14Å; E44-K46 VanDerWaalsContact O-N 3.07Å
45	L	44	Very low	58.3	Low	80 Å²	80	96.8 Å²	96.8	42%	0.419	51%	0.51	S	S	.	.			trans	48.9	53	152.8	-59.7	160.4	0	0	0	113.1	P43 T47 K58	P43-L45 PolarHBondContact O-N 3.45Å; L45-T47 PolarHBondContact O-N 2.87Å; L45-K58 HydrophobicContact CD1-CD 4.46Å
46	K	44.8	Very low	58.2	Low	146 Å²	146	95.2 Å²	95.2	64%	0.635	51%	0.507	S	S	*	.			trans	-63	108.7	159.7	-72.7	-169.4	-179.2	171.5	0	106.9	N40 E44 S48	N40-K46 WeakPolarHBondContact O-CE 3.48Å; N40-K46 PolarHBondContact O-NZ 2.99Å; E44-K46 PolarHBondContact O-N 3.14Å; E44-K46 VanDerWaalsContact O-N 3.07Å; K46-S48 PolarHBondContact O-N 3.23Å
47	T	41.5	Very low	58.3	Low	116 Å²	116	95.2 Å²	95.2	71%	0.712	51%	0.507	S	S	*	.			trans	-40	73.9	168.4	57.3	0	0	0	0	112.3	L45	L45-T47 PolarHBondContact O-N 2.87Å
48	S	40.9	Very low	58.5	Low	51 Å²	51	92.6 Å²	92.6	36%	0.357	50%	0.495	S	S	.	.			trans	-68	143.5	147.9	177.4	0	0	0	0	106.2	K46 T50 S51 D52	K46-S48 PolarHBondContact O-N 3.23Å; S48-T50 PolarHBondContact O-N 2.92Å; S48-T50 VanDerWaalsContact O-N 3.14Å; S48-T50 PolarHBondContact OG-N 2.87Å; S48-T50 PolarHBondContact OG-OG1 3.4Å; S48-S51 CarbonylContact O-C 3.59Å; S48-S51 WeakPolarHBondContact O-CA 3.31Å; S48-S51 WeakPolarHBondContact O-CB 3.32Å; S48-S51 PolarHBondContact O-N 3.25Å; S48-D52 PolarHBondContact O-N 3.32Å
49	P	48.7	Very low	59	Low	106 Å²	106	91.8 Å²	91.8	69%	0.688	49%	0.491	S	S	*	.	H	α-helix	trans	-59.8	-23.5	172.4	21.4	-31	0	0	0	112.2	S51 D52	P49-S51 VanDerWaalsContact C-N 3.3Å; P49-D52 PolarHBondContact O-N 2.81Å
50	T	46.9	Very low	59.9	Low	87 Å²	87	85.8 Å²	85.8	53%	0.534	47%	0.471	S	S	.	.	H	α-helix	trans	-72	-26.5	166.8	60.4	0	0	0	0	112.5	S48 D52 T53 H54	S48-T50 PolarHBondContact O-N 2.92Å; S48-T50 VanDerWaalsContact O-N 3.14Å; S48-T50 PolarHBondContact OG-N 2.87Å; S48-T50 PolarHBondContact OG-OG1 3.4Å; T50-D52 PolarHBondContact O-N 3.39Å; T50-T53 PolarHBondContact O-OG1 3.14Å; T50-H54 PolarHBondContact O-CD2 3.46Å
51	S	50.3	Low	61.4	Low	19 Å²	19	86 Å²	86	13%	0.133	47%	0.471	C	S	.	.	H	α-helix	trans	-68.6	-22.5	173.3	-165.1	0	0	0	0	112	S48 P49 H54 S55	S48-S51 CarbonylContact O-C 3.59Å; S48-S51 WeakPolarHBondContact O-CA 3.31Å; S48-S51 WeakPolarHBondContact O-CB 3.32Å; S48-S51 PolarHBondContact O-N 3.25Å; P49-S51 VanDerWaalsContact C-N 3.3Å; S51-H54 PolarHBondContact O-N 3.08Å; S51-S55 WeakPolarHBondContact O-CA 3.43Å; S51-S55 WeakPolarHBondContact O-CB 3.45Å; S51-S55 PolarHBondContact O-N 2.87Å
52	D	57.4	Low	62.9	Low	83 Å²	83	80 Å²	80	44%	0.444	44%	0.443	S	S	.	.	H	α-helix	trans	-64.1	-43.2	178.5	-65.4	-23.6	0	0	0	110.8	S48 P49 T50 S55 N56	S48-D52 PolarHBondContact O-N 3.32Å; P49-D52 PolarHBondContact O-N 2.81Å; T50-D52 PolarHBondContact O-N 3.39Å; D52-S55 PolarHBondContact O-N 2.85Å; D52-N56 WeakPolarHBondContact O-CB 3.38Å; D52-N56 PolarHBondContact O-N 3.48Å; D52-N56 PolarHBondContact O-ND2 3.39Å
53	T	61.3	Low	65	Low	81 Å²	81	77.4 Å²	77.4	50%	0.497	43%	0.425	S	S	.	.	H	α-helix	trans	-66	-45.6	175.6	58.9	0	0	0	0	111.2	T50 S55 N56 I57	T50-T53 PolarHBondContact O-OG1 3.14Å; T53-S55 VanDerWaalsContact C-N 3.31Å; T53-S55 PolarHBondContact O-N 3.34Å; T53-N56 PolarHBondContact O-N 3.42Å; T53-I57 WeakPolarHBondContact O-CD1 3.26Å; T53-I57 WeakPolarHBondContact O-CG1 3.34Å; T53-I57 PolarHBondContact O-N 2.96Å
54	H	64.8	Low	67	Low	105 Å²	105	72.5 Å²	72.5	49%	0.486	39%	0.392	S	S	.	.	H	α-helix	trans	-62.8	-36.8	176	-72.7	-69.1	0	0	0	112.7	T50 S51 I57 K58	T50-H54 PolarHBondContact O-CD2 3.46Å; S51-H54 PolarHBondContact O-N 3.08Å; H54-I57 PolarHBondContact O-N 3.03Å; H54-K58 VanDerWaalsContact O-CB 3.27Å; H54-K58 WeakPolarHBondContact O-CB 2.99Å; H54-K58 PolarHBondContact O-N 2.98Å
55	S	73.2	Confident	69.3	Low	46 Å²	46	69.6 Å²	69.6	32%	0.322	38%	0.379	S	S	.	.	H	α-helix	trans	-67.8	-44.3	177.1	-172.2	0	0	0	0	110.6	S51 D52 T53 I57 K58 L59	S51-S55 WeakPolarHBondContact O-CA 3.43Å; S51-S55 WeakPolarHBondContact O-CB 3.45Å; S51-S55 PolarHBondContact O-N 2.87Å; D52-S55 PolarHBondContact O-N 2.85Å; T53-S55 VanDerWaalsContact C-N 3.31Å; T53-S55 PolarHBondContact O-N 3.34Å; S55-I57 PolarHBondContact O-N 3.32Å; S55-K58 PolarHBondContact O-N 3.26Å; S55-L59 WeakPolarHBondContact O-CB 3.36Å; S55-L59 PolarHBondContact O-N 3.45Å
56	N	78.8	Confident	71.6	Confident	101 Å²	101	65.8 Å²	65.8	54%	0.54	36%	0.36	S	S	.	.	H	α-helix	trans	-63	-41.2	175	-69.3	-21.2	0	0	0	111.8	D52 T53 L59 L60	D52-N56 WeakPolarHBondContact O-CB 3.38Å; D52-N56 PolarHBondContact O-N 3.48Å; D52-N56 PolarHBondContact O-ND2 3.39Å; T53-N56 PolarHBondContact O-N 3.42Å; N56-L59 PolarHBondContact O-N 2.91Å; N56-L60 PolarHBondContact O-N 3.23Å
57	I	85.1	Confident	73.7	Confident	90 Å²	90	60.4 Å²	60.4	46%	0.462	34%	0.337	S	S	.	.	H	α-helix	trans	-65.3	-45	175.3	-67.4	162.4	0	0	0	110.5	T53 H54 S55 L59 L60 I61	T53-I57 WeakPolarHBondContact O-CD1 3.26Å; T53-I57 WeakPolarHBondContact O-CG1 3.34Å; T53-I57 PolarHBondContact O-N 2.96Å; H54-I57 PolarHBondContact O-N 3.03Å; S55-I57 PolarHBondContact O-N 3.32Å; I57-L59 VanDerWaalsContact C-N 3.32Å; I57-L59 PolarHBondContact O-N 3.46Å; I57-L60 WeakPolarHBondContact O-CB 3.41Å; I57-L60 PolarHBondContact O-N 2.99Å; I57-I61 HydrophobicContact CG2-CD1 3.77Å; I57-I61 HydrophobicContact CG2-CG1 4.36Å; I57-I61 WeakPolarHBondContact O-CG1 3.34Å; I57-I61 PolarHBondContact O-N 2.88Å
58	K	85.7	Confident	76	Confident	87 Å²	87	58.8 Å²	58.8	38%	0.378	32%	0.318	S	S	.	.	H	α-helix	trans	-58.4	-45.4	176.3	-176.9	-177.1	178.5	-173.3	0	111	L45 H54 S55 L60 I61 N62	L45-K58 HydrophobicContact CD1-CD 4.46Å; H54-K58 VanDerWaalsContact O-CB 3.27Å; H54-K58 WeakPolarHBondContact O-CB 2.99Å; H54-K58 PolarHBondContact O-N 2.98Å; S55-K58 PolarHBondContact O-N 3.26Å; K58-L60 VanDerWaalsContact C-N 3.33Å; K58-L60 PolarHBondContact O-N 3.48Å; K58-I61 PolarHBondContact O-N 3.35Å; K58-N62 VanDerWaalsContact O-CG 3.26Å; K58-N62 PolarHBondContact O-N 3.38Å; K58-N62 PolarHBondContact O-OD1 2.82Å
59	L	86.8	Confident	78.4	Confident	63 Å²	63	57 Å²	57	33%	0.33	30%	0.304	S	S	.	.	H	α-helix	trans	-58.2	-46.5	176	-175.8	75.7	0	0	0	111	S55 N56 I57 N62 E63 H87	S55-L59 WeakPolarHBondContact O-CB 3.36Å; S55-L59 PolarHBondContact O-N 3.45Å; N56-L59 PolarHBondContact O-N 2.91Å; I57-L59 VanDerWaalsContact C-N 3.32Å; I57-L59 PolarHBondContact O-N 3.46Å; L59-N62 PolarHBondContact O-N 3.21Å; L59-E63 WeakPolarHBondContact O-CG 3.48Å; L59-E63 PolarHBondContact O-N 2.78Å; L59-H87 WeakPolarHBondContact CD1-CE1 3.13Å
60	L	88.6	Confident	80.3	Confident	27 Å²	27	54.6 Å²	54.6	14%	0.141	29%	0.286	C	S	.	.	H	α-helix	trans	-60	-46.6	176.7	-114.6	63.1	0	0	0	112.2	N56 I57 K58 N62 E63 L64 L98 T101 L102	N56-L60 PolarHBondContact O-N 3.23Å; I57-L60 WeakPolarHBondContact O-CB 3.41Å; I57-L60 PolarHBondContact O-N 2.99Å; K58-L60 VanDerWaalsContact C-N 3.33Å; K58-L60 PolarHBondContact O-N 3.48Å; L60-N62 VanDerWaalsContact C-N 3.34Å; L60-N62 PolarHBondContact O-N 2.92Å; L60-E63 PolarHBondContact O-N 3.08Å; L60-L64 VanDerWaalsContact O-CG 3.26Å; L60-L64 WeakPolarHBondContact O-CG 3.15Å; L60-L64 PolarHBondContact O-N 3.01Å; L60-L98 HydrophobicContact CD1-CD2 4.22Å; L60-L98 HydrophobicContact CG-CD2 4.23Å; L60-T101 HydrophobicContact CD1-CG2 4.06Å; L60-T101 HydrophobicContact CD2-CG2 3.68Å; L60-L102 HydrophobicContact CD2-CD1 3.39Å; L60-L102 HydrophobicContact CD2-CG 3.92Å; L60-L102 HydrophobicContact CG-CD1 3.76Å
61	I	90.4	Very high	82.2	Confident	87 Å²	87	51.7 Å²	51.7	45%	0.446	27%	0.266	S	S	.	.	H	α-helix	trans	-60.7	-45.8	178.4	-68.5	166.5	0	0	0	110.5	I57 K58 E63 L64 I65	I57-I61 HydrophobicContact CG2-CD1 3.77Å; I57-I61 HydrophobicContact CG2-CG1 4.36Å; I57-I61 WeakPolarHBondContact O-CG1 3.34Å; I57-I61 PolarHBondContact O-N 2.88Å; K58-I61 PolarHBondContact O-N 3.35Å; I61-E63 VanDerWaalsContact C-N 3.34Å; I61-E63 PolarHBondContact O-N 2.87Å; I61-L64 PolarHBondContact O-N 3.28Å; I61-I65 HydrophobicContact CG2-CD1 3.8Å; I61-I65 HydrophobicContact CG2-CG1 4.49Å; I61-I65 WeakPolarHBondContact O-CG1 3.36Å; I61-I65 PolarHBondContact O-N 2.58Å
62	N	90.9	Very high	84	Confident	17 Å²	17	54.5 Å²	54.5	9%	0.091	28%	0.277	C	S	.	.	H	α-helix	trans	-60.8	-43.6	178.4	-70.8	-6.2	0	0	0	111.7	K58 L59 L60 L64 I65 I66 F81 H87	K58-N62 VanDerWaalsContact O-CG 3.26Å; K58-N62 PolarHBondContact O-N 3.38Å; K58-N62 PolarHBondContact O-OD1 2.82Å; L59-N62 PolarHBondContact O-N 3.21Å; L60-N62 VanDerWaalsContact C-N 3.34Å; L60-N62 PolarHBondContact O-N 2.92Å; N62-L64 VanDerWaalsContact C-N 3.35Å; N62-L64 PolarHBondContact O-N 2.67Å; N62-I65 PolarHBondContact O-N 2.91Å; N62-I66 WeakPolarHBondContact O-CB 3.25Å; N62-I66 VanDerWaalsContact O-CG1 3.25Å; N62-I66 WeakPolarHBondContact O-CG1 3.42Å; N62-I66 PolarHBondContact O-N 3.05Å; N62-F81 HydrophobicContact CB-CE1 4.17Å; N62-F81 HydrophobicContact CB-CZ 4.39Å; N62-H87 WeakPolarHBondContact CB-ND1 3.33Å
63	E	90.7	Very high	85.4	Confident	6 Å²	6	54.4 Å²	54.4	3%	0.028	28%	0.276	C	S	.	.	H	α-helix	trans	-62.2	-40.3	176	-75.4	-69.9	163.6	0	0	112.4	L59 L60 I61 I65 I66 E67 H87 L93 L98	L59-E63 WeakPolarHBondContact O-CG 3.48Å; L59-E63 PolarHBondContact O-N 2.78Å; L60-E63 PolarHBondContact O-N 3.08Å; I61-E63 VanDerWaalsContact C-N 3.34Å; I61-E63 PolarHBondContact O-N 2.87Å; E63-I65 VanDerWaalsContact C-N 3.34Å; E63-I65 PolarHBondContact O-N 3.47Å; E63-I66 PolarHBondContact O-N 3.41Å; E63-E67 WeakPolarHBondContact O-CB 3.41Å; E63-E67 PolarHBondContact O-N 2.81Å; E63-H87 IonicContact OE1-CD2 2.67Å; E63-H87 IonicContact OE1-CE1 3.78Å; E63-H87 IonicContact OE1-NE2 3.27Å; E63-H87 PolarHBondContact OE1-NE2 2.7Å; E63-L93 VanDerWaalsContact CD-CB 3.44Å; E63-L93 HydrophobicContact CG-CB 3.84Å; E63-L93 HydrophobicContact CG-CD2 4.18Å; E63-L93 PolarHBondContact OE1-N 3.38Å; E63-L93 PolarHBondContact OE2-N 3.27Å; E63-L98 HydrophobicContact CB-CD1 4.27Å; E63-L98 HydrophobicContact CB-CD2 3.89Å; E63-L98 HydrophobicContact CG-CD2 4.49Å
64	L	91.5	Very high	86.8	Confident	13 Å²	13	54 Å²	54	7%	0.068	27%	0.271	C	S	.	.	H	α-helix	trans	-65	-37.9	175.9	-67.8	173.9	0	0	0	112.3	L60 I61 N62 Y68 L102 L145 L146 I149	L60-L64 VanDerWaalsContact O-CG 3.26Å; L60-L64 WeakPolarHBondContact O-CG 3.15Å; L60-L64 PolarHBondContact O-N 3.01Å; I61-L64 PolarHBondContact O-N 3.28Å; N62-L64 VanDerWaalsContact C-N 3.35Å; N62-L64 PolarHBondContact O-N 2.67Å; L64-Y68 WeakPolarHBondContact O-CB 3.34Å; L64-Y68 PolarHBondContact O-N 2.88Å; L64-Y68 VanDerWaalsContact O-N 3.08Å; L64-L102 HydrophobicContact CD1-CD2 4.09Å; L64-L145 HydrophobicContact CD2-CB 3.52Å; L64-L145 HydrophobicContact CD2-CD1 4.34Å; L64-L146 HydrophobicContact CB-CB 4.44Å; L64-I149 HydrophobicContact CD1-CD1 3.53Å; L64-I149 HydrophobicContact CD2-CD1 4.2Å
65	I	93	Very high	88	Confident	50 Å²	50	52.7 Å²	52.7	26%	0.256	27%	0.273	S	S	.	.	H	α-helix	trans	-68.4	-44.2	175.4	-68.1	167	0	0	0	110	I61 N62 E63 E67 Y68 L69 F81	I61-I65 HydrophobicContact CG2-CD1 3.8Å; I61-I65 HydrophobicContact CG2-CG1 4.49Å; I61-I65 WeakPolarHBondContact O-CG1 3.36Å; I61-I65 PolarHBondContact O-N 2.58Å; N62-I65 PolarHBondContact O-N 2.91Å; E63-I65 VanDerWaalsContact C-N 3.34Å; E63-I65 PolarHBondContact O-N 3.47Å; I65-E67 VanDerWaalsContact C-N 3.34Å; I65-E67 PolarHBondContact O-N 3.28Å; I65-Y68 WeakPolarHBondContact O-CB 3.49Å; I65-Y68 PolarHBondContact O-N 3.45Å; I65-Y68 VanDerWaalsContact O-N 3.14Å; I65-L69 HydrophobicContact CG2-CD1 3.92Å; I65-L69 HydrophobicContact CG2-CG 4.14Å; I65-L69 VanDerWaalsContact O-CG 3.32Å; I65-L69 WeakPolarHBondContact O-CG 3.44Å; I65-L69 PolarHBondContact O-N 3.31Å; I65-F81 HydrophobicContact CB-CE1 4.09Å; I65-F81 HydrophobicContact CB-CZ 3.99Å; I65-F81 HydrophobicContact CD1-CE2 4.31Å; I65-F81 HydrophobicContact CD1-CZ 3.86Å; I65-F81 HydrophobicContact CG2-CD1 4.24Å; I65-F81 HydrophobicContact CG2-CD2 4.42Å; I65-F81 HydrophobicContact CG2-CE1 3.83Å; I65-F81 HydrophobicContact CG2-CE2 4.03Å; I65-F81 HydrophobicContact CG2-CZ 3.72Å
66	I	91.8	Very high	88.9	Confident	1 Å²	1	58.7 Å²	58.7	1%	0.005	29%	0.294	C	S	.	.	H	α-helix	trans	-60.3	-44.7	176.9	-74.7	165.4	0	0	0	110.7	N62 E63 Y68 L69 N70 E78 F81 R82 H87	N62-I66 WeakPolarHBondContact O-CB 3.25Å; N62-I66 VanDerWaalsContact O-CG1 3.25Å; N62-I66 WeakPolarHBondContact O-CG1 3.42Å; N62-I66 PolarHBondContact O-N 3.05Å; E63-I66 PolarHBondContact O-N 3.41Å; I66-Y68 VanDerWaalsContact C-N 3.27Å; I66-Y68 PolarHBondContact O-N 3.02Å; I66-L69 PolarHBondContact O-N 2.84Å; I66-N70 VanDerWaalsContact O-CB 3.31Å; I66-N70 WeakPolarHBondContact O-CB 3.35Å; I66-N70 PolarHBondContact O-N 3.39Å; I66-E78 HydrophobicContact CG2-CG 4.5Å; I66-F81 HydrophobicContact CD1-CD1 4.39Å; I66-F81 HydrophobicContact CD1-CE1 4.34Å; I66-F81 HydrophobicContact CG1-CD1 3.85Å; I66-F81 HydrophobicContact CG1-CE1 3.95Å; I66-R82 HydrophobicContact CD1-CG 4.12Å; I66-H87 HydrophobicContact CD1-CB 4.3Å
67	E	88.8	Confident	89.6	Confident	32 Å²	32	57.2 Å²	57.2	15%	0.15	29%	0.289	C	S	.	.	H	α-helix	trans	-59.5	-40.7	175.5	-170.8	-176.7	-157	0	0	111.2	E63 I65 F71 R95 P144 L145	E63-E67 WeakPolarHBondContact O-CB 3.41Å; E63-E67 PolarHBondContact O-N 2.81Å; I65-E67 VanDerWaalsContact C-N 3.34Å; I65-E67 PolarHBondContact O-N 3.28Å; E67-F71 WeakPolarHBondContact O-CB 3.49Å; E67-F71 PolarHBondContact O-N 2.93Å; E67-R95 IonicContact OE1-CZ 3.02Å; E67-R95 IonicContact OE1-NE 2.69Å; E67-R95 IonicContact OE1-NH1 3.4Å; E67-R95 PolarHBondContact OE1-NH1 2.67Å; E67-P144 HydrophobicContact CG-CB 4.15Å; E67-L145 WeakPolarHBondContact OE2-CB 3.46Å; E67-L145 VanDerWaalsContact OE2-CG 3.31Å; E67-L145 WeakPolarHBondContact OE2-CG 3.19Å; E67-L145 PolarHBondContact OE2-N 2.73Å
68	Y	90.4	Very high	89.9	Confident	82 Å²	82	54.2 Å²	54.2	32%	0.322	27%	0.273	S	S	.	.	H	α-helix	trans	-65.8	-47.9	175.6	172.7	-106	0	0	0	112.9	L64 I65 I66 N70 F71 E72 L146 F147	L64-Y68 WeakPolarHBondContact O-CB 3.34Å; L64-Y68 PolarHBondContact O-N 2.88Å; L64-Y68 VanDerWaalsContact O-N 3.08Å; I65-Y68 WeakPolarHBondContact O-CB 3.49Å; I65-Y68 PolarHBondContact O-N 3.45Å; I65-Y68 VanDerWaalsContact O-N 3.14Å; I66-Y68 VanDerWaalsContact C-N 3.27Å; I66-Y68 PolarHBondContact O-N 3.02Å; Y68-N70 VanDerWaalsContact C-N 3.29Å; Y68-N70 PolarHBondContact O-N 3.44Å; Y68-F71 WeakPolarHBondContact O-CB 3.42Å; Y68-F71 PolarHBondContact O-N 3.47Å; Y68-F71 VanDerWaalsContact O-N 3.16Å; Y68-E72 HydrophobicContact CD2-CG 4.08Å; Y68-E72 HydrophobicContact CE1-CG 4.14Å; Y68-E72 HydrophobicContact CE2-CG 3.49Å; Y68-E72 VanDerWaalsContact CE2-CG 3.49Å; Y68-E72 PolarHBondContact O-N 3.35Å; Y68-L146 HydrophobicContact CG-CD2 4.28Å; Y68-F147 HydrophobicContact CD2-CD2 4.33Å; Y68-F147 AromaticContact CD2-CE2 3.61Å; Y68-F147 HydrophobicContact CD2-CE2 3.61Å; Y68-F147 HydrophobicContact CD2-CZ 4.47Å; Y68-F147 AromaticContact CE2-CE2 3.6Å; Y68-F147 HydrophobicContact CE2-CE2 3.6Å; Y68-F147 HydrophobicContact CE2-CZ 4.02Å
69	L	91.6	Very high	90	Very high	13 Å²	13	53.9 Å²	53.9	7%	0.068	28%	0.281	C	S	.	.	H	α-helix	trans	-62.1	-39.4	179.4	-68.6	176.5	0	0	0	111.5	I65 I66 E72 N73 L74 T77 E78 F81	I65-L69 HydrophobicContact CG2-CD1 3.92Å; I65-L69 HydrophobicContact CG2-CG 4.14Å; I65-L69 VanDerWaalsContact O-CG 3.32Å; I65-L69 WeakPolarHBondContact O-CG 3.44Å; I65-L69 PolarHBondContact O-N 3.31Å; I66-L69 PolarHBondContact O-N 2.84Å; L69-E72 PolarHBondContact O-N 3.31Å; L69-N73 PolarHBondContact O-N 3.19Å; L69-L74 HydrophobicContact CB-CB 4.42Å; L69-L74 HydrophobicContact CD2-CB 4.07Å; L69-L74 HydrophobicContact CD2-CD1 3.71Å; L69-L74 PolarHBondContact O-N 2.89Å; L69-T77 HydrophobicContact CD1-CG2 4.16Å; L69-T77 HydrophobicContact CD2-CG2 3.95Å; L69-E78 HydrophobicContact CB-CB 4.2Å; L69-E78 HydrophobicContact CD1-CB 4.38Å; L69-F81 HydrophobicContact CD1-CB 4.1Å; L69-F81 HydrophobicContact CD1-CD1 4.41Å; L69-F81 HydrophobicContact CD1-CG 4.23Å
70	N	87.6	Confident	90.2	Very high	57 Å²	57	53.3 Å²	53.3	31%	0.305	28%	0.28	S	S	.	.	H	α-helix	trans	-64.6	-42.4	175.1	-175.7	35.3	0	0	0	111.3	I66 Y68 E72 N73	I66-N70 VanDerWaalsContact O-CB 3.31Å; I66-N70 WeakPolarHBondContact O-CB 3.35Å; I66-N70 PolarHBondContact O-N 3.39Å; Y68-N70 VanDerWaalsContact C-N 3.29Å; Y68-N70 PolarHBondContact O-N 3.44Å; N70-E72 PolarHBondContact O-N 2.98Å; N70-N73 PolarHBondContact O-N 3.01Å; N70-N73 VanDerWaalsContact O-N 3.12Å
71	F	87.6	Confident	90.3	Very high	25 Å²	25	54.2 Å²	54.2	11%	0.11	28%	0.283	C	S	.	.	H	α-helix	trans	-65.3	-35.4	176.7	178.4	-97.1	0	0	0	113.5	E67 Y68 N73 I110 L138 Q141 P144 F147	E67-F71 WeakPolarHBondContact O-CB 3.49Å; E67-F71 PolarHBondContact O-N 2.93Å; Y68-F71 WeakPolarHBondContact O-CB 3.42Å; Y68-F71 PolarHBondContact O-N 3.47Å; Y68-F71 VanDerWaalsContact O-N 3.16Å; F71-N73 PolarHBondContact O-N 3.07Å; F71-I110 HydrophobicContact CE2-CG2 4.27Å; F71-I110 HydrophobicContact CZ-CG2 4.03Å; F71-L138 VanDerWaalsContact O-CD2 3.22Å; F71-L138 WeakPolarHBondContact O-CD2 3.48Å; F71-Q141 HydrophobicContact CD2-CB 4.35Å; F71-P144 HydrophobicContact CB-CG 3.33Å; F71-P144 HydrophobicContact CD1-CG 3.58Å; F71-P144 HydrophobicContact CD2-CG 3.94Å; F71-P144 HydrophobicContact CE1-CG 4.35Å; F71-P144 VanDerWaalsContact CG-CD 3.46Å; F71-P144 HydrophobicContact CG-CG 3.33Å; F71-F147 HydrophobicContact CD1-CE2 4.48Å; F71-F147 HydrophobicContact CE1-CE2 4.48Å
72	E	87.2	Confident	90.2	Very high	79 Å²	79	51.5 Å²	51.5	37%	0.369	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	5.3	174.9	-63.9	-63.8	156.3	0	0	113.1	Y68 L69 N70 L74	Y68-E72 HydrophobicContact CD2-CG 4.08Å; Y68-E72 HydrophobicContact CE1-CG 4.14Å; Y68-E72 HydrophobicContact CE2-CG 3.49Å; Y68-E72 VanDerWaalsContact CE2-CG 3.49Å; Y68-E72 PolarHBondContact O-N 3.35Å; L69-E72 PolarHBondContact O-N 3.31Å; N70-E72 PolarHBondContact O-N 2.98Å; E72-L74 VanDerWaalsContact C-N 3.25Å; E72-L74 HydrophobicContact CB-CD1 3.96Å; E72-L74 HydrophobicContact CB-CG 3.93Å; E72-L74 PolarHBondContact O-N 3.46Å
73	N	88	Confident	90	Very high	80 Å²	80	57.3 Å²	57.3	43%	0.428	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.2	36.8	-175.8	-58.6	-57.3	0	0	0	114	L69 N70 F71 S75 L138	L69-N73 PolarHBondContact O-N 3.19Å; N70-N73 PolarHBondContact O-N 3.01Å; N70-N73 VanDerWaalsContact O-N 3.12Å; F71-N73 PolarHBondContact O-N 3.07Å; N73-S75 VanDerWaalsContact C-N 3.3Å; N73-S75 PolarHBondContact O-N 3.28Å; N73-L138 WeakPolarHBondContact ND2-CD2 3.45Å
74	L	90.3	Very high	89.7	Confident	73 Å²	73	64.4 Å²	64.4	38%	0.382	33%	0.327	S	S	.	.			trans	-91.4	56	178.7	-64.3	175	0	0	0	111.4	L69 E72 F76 T77 E78	L69-L74 HydrophobicContact CB-CB 4.42Å; L69-L74 HydrophobicContact CD2-CB 4.07Å; L69-L74 HydrophobicContact CD2-CD1 3.71Å; L69-L74 PolarHBondContact O-N 2.89Å; E72-L74 VanDerWaalsContact C-N 3.25Å; E72-L74 HydrophobicContact CB-CD1 3.96Å; E72-L74 HydrophobicContact CB-CG 3.93Å; E72-L74 PolarHBondContact O-N 3.46Å; L74-F76 VanDerWaalsContact C-N 3.31Å; L74-F76 PolarHBondContact O-N 3.28Å; L74-T77 PolarHBondContact O-N 2.84Å; L74-T77 VanDerWaalsContact O-N 3.14Å; L74-E78 WeakPolarHBondContact O-CB 3.22Å; L74-E78 PolarHBondContact O-N 3.44Å
75	S	89.3	Confident	89.3	Confident	77 Å²	77	64.8 Å²	64.8	54%	0.538	33%	0.331	S	S	.	.	H	α-helix	trans	-60.5	-35.1	-170.8	-48	0	0	0	0	114.1	N73 S79	N73-S75 VanDerWaalsContact C-N 3.3Å; N73-S75 PolarHBondContact O-N 3.28Å; S75-S79 PolarHBondContact O-N 3.11Å
76	F	92.9	Very high	88.5	Confident	172 Å²	172	65.7 Å²	65.7	75%	0.754	35%	0.353	S	S	*	.	H	α-helix	trans	-68.1	-45.8	176.9	-176.4	-103.2	0	0	0	111.5	L74 E78 S79 V80	L74-F76 VanDerWaalsContact C-N 3.31Å; L74-F76 PolarHBondContact O-N 3.28Å; F76-E78 VanDerWaalsContact C-N 3.32Å; F76-E78 PolarHBondContact O-N 3.47Å; F76-S79 PolarHBondContact O-N 3.47Å; F76-V80 HydrophobicContact CE1-CG2 4.12Å; F76-V80 HydrophobicContact CZ-CG2 4.15Å; F76-V80 WeakPolarHBondContact O-CG2 3.38Å; F76-V80 PolarHBondContact O-N 2.91Å; F76-V80 VanDerWaalsContact O-N 3.08Å
77	T	93.2	Very high	87.6	Confident	70 Å²	70	66.1 Å²	66.1	43%	0.429	36%	0.355	S	S	.	.	H	α-helix	trans	-63.1	-40.5	176.3	-54.5	0	0	0	0	111	L69 L74 V80 F81	L69-T77 HydrophobicContact CD1-CG2 4.16Å; L69-T77 HydrophobicContact CD2-CG2 3.95Å; L74-T77 PolarHBondContact O-N 2.84Å; L74-T77 VanDerWaalsContact O-N 3.14Å; T77-V80 PolarHBondContact O-N 3.45Å; T77-F81 WeakPolarHBondContact O-CB 3.02Å; T77-F81 PolarHBondContact O-N 3.2Å
78	E	90.9	Very high	86.5	Confident	28 Å²	28	65.8 Å²	65.8	13%	0.131	36%	0.359	C	S	.	.	H	α-helix	trans	-58.8	-47.3	174.4	-171.4	-158.8	146.1	0	0	111.5	I66 L69 L74 F76 V80 F81 R82	I66-E78 HydrophobicContact CG2-CG 4.5Å; L69-E78 HydrophobicContact CB-CB 4.2Å; L69-E78 HydrophobicContact CD1-CB 4.38Å; L74-E78 WeakPolarHBondContact O-CB 3.22Å; L74-E78 PolarHBondContact O-N 3.44Å; F76-E78 VanDerWaalsContact C-N 3.32Å; F76-E78 PolarHBondContact O-N 3.47Å; E78-V80 PolarHBondContact O-N 3.36Å; E78-F81 PolarHBondContact O-N 3.02Å; E78-R82 WeakPolarHBondContact O-CG 3.46Å; E78-R82 PolarHBondContact O-N 3.33Å; E78-R82 IonicContact OE1-CZ 2.65Å; E78-R82 VanDerWaalsContact OE1-CZ 3.27Å; E78-R82 IonicContact OE1-NE 3.63Å; E78-R82 PolarHBondContact OE1-NE 2.92Å; E78-R82 IonicContact OE1-NH2 3.72Å; E78-R82 PolarHBondContact OE1-NH2 3.27Å
79	S	88.6	Confident	85.3	Confident	79 Å²	79	69.9 Å²	69.9	55%	0.552	39%	0.387	S	S	*	.	H	α-helix	trans	-60.2	-45.2	179.2	-175.1	0	0	0	0	112.1	S75 F76 Q83	S75-S79 PolarHBondContact O-N 3.11Å; F76-S79 PolarHBondContact O-N 3.47Å; S79-Q83 PolarHBondContact O-N 2.83Å
80	V	91	Very high	84	Confident	52 Å²	52	74 Å²	74	32%	0.315	41%	0.408	S	S	.	.	H	α-helix	trans	-66.1	-45.7	176.9	175.4	0	0	0	0	110.1	F76 T77 E78 R82 Q83 E84	F76-V80 HydrophobicContact CE1-CG2 4.12Å; F76-V80 HydrophobicContact CZ-CG2 4.15Å; F76-V80 WeakPolarHBondContact O-CG2 3.38Å; F76-V80 PolarHBondContact O-N 2.91Å; F76-V80 VanDerWaalsContact O-N 3.08Å; T77-V80 PolarHBondContact O-N 3.45Å; E78-V80 PolarHBondContact O-N 3.36Å; V80-R82 PolarHBondContact O-N 3.38Å; V80-Q83 PolarHBondContact O-N 3.34Å; V80-Q83 VanDerWaalsContact O-N 3.11Å; V80-E84 HydrophobicContact CG1-CG 4.13Å; V80-E84 WeakPolarHBondContact CG1-OE1 3.19Å; V80-E84 WeakPolarHBondContact O-CG 3.2Å; V80-E84 PolarHBondContact O-N 3.42Å
81	F	91.1	Very high	83.1	Confident	46 Å²	46	79 Å²	79	20%	0.202	43%	0.429	C	S	.	.	H	α-helix	trans	-59.6	-43.5	-179.6	-178.4	-98.4	0	0	0	112.2	N62 I65 I66 L69 T77 E78 Q83 E84 S85	N62-F81 HydrophobicContact CB-CE1 4.17Å; N62-F81 HydrophobicContact CB-CZ 4.39Å; I65-F81 HydrophobicContact CB-CE1 4.09Å; I65-F81 HydrophobicContact CB-CZ 3.99Å; I65-F81 HydrophobicContact CD1-CE2 4.31Å; I65-F81 HydrophobicContact CD1-CZ 3.86Å; I65-F81 HydrophobicContact CG2-CD1 4.24Å; I65-F81 HydrophobicContact CG2-CD2 4.42Å; I65-F81 HydrophobicContact CG2-CE1 3.83Å; I65-F81 HydrophobicContact CG2-CE2 4.03Å; I65-F81 HydrophobicContact CG2-CZ 3.72Å; I66-F81 HydrophobicContact CD1-CD1 4.39Å; I66-F81 HydrophobicContact CD1-CE1 4.34Å; I66-F81 HydrophobicContact CG1-CD1 3.85Å; I66-F81 HydrophobicContact CG1-CE1 3.95Å; L69-F81 HydrophobicContact CD1-CB 4.1Å; L69-F81 HydrophobicContact CD1-CD1 4.41Å; L69-F81 HydrophobicContact CD1-CG 4.23Å; T77-F81 WeakPolarHBondContact O-CB 3.02Å; T77-F81 PolarHBondContact O-N 3.2Å; E78-F81 PolarHBondContact O-N 3.02Å; F81-Q83 VanDerWaalsContact C-N 3.31Å; F81-Q83 PolarHBondContact O-N 3.4Å; F81-E84 PolarHBondContact O-N 2.84Å; F81-S85 WeakPolarHBondContact O-CB 3.4Å; F81-S85 PolarHBondContact O-N 3.19Å; F81-S85 PolarHBondContact O-OG 3.33Å
82	R	88	Confident	82.6	Confident	29 Å²	29	80.4 Å²	80.4	11%	0.109	44%	0.438	C	S	.	.	H	α-helix	trans	-59.4	-42	175.2	-76.1	179.2	-174.4	-77.1	-7.9	112.7	I66 E78 V80 H87 G88 L90 N92	I66-R82 HydrophobicContact CD1-CG 4.12Å; E78-R82 WeakPolarHBondContact O-CG 3.46Å; E78-R82 PolarHBondContact O-N 3.33Å; E78-R82 IonicContact OE1-CZ 2.65Å; E78-R82 VanDerWaalsContact OE1-CZ 3.27Å; E78-R82 IonicContact OE1-NE 3.63Å; E78-R82 PolarHBondContact OE1-NE 2.92Å; E78-R82 IonicContact OE1-NH2 3.72Å; E78-R82 PolarHBondContact OE1-NH2 3.27Å; V80-R82 PolarHBondContact O-N 3.38Å; R82-H87 PolarHBondContact O-N 3.07Å; R82-G88 PolarHBondContact O-N 3.24Å; R82-L90 PolarHBondContact NH1-O 2.65Å; R82-N92 PolarHBondContact NH1-OD1 3.18Å; R82-N92 PolarHBondContact NH2-OD1 2.61Å
83	Q	86	Confident	82.4	Confident	140 Å²	140	78.7 Å²	78.7	65%	0.654	43%	0.431	S	S	*	.	H	α-helix	trans	-69.4	-41.7	-179.2	-175.1	57.6	79.4	0	0	111.7	S79 V80 F81	S79-Q83 PolarHBondContact O-N 2.83Å; V80-Q83 PolarHBondContact O-N 3.34Å; V80-Q83 VanDerWaalsContact O-N 3.11Å; F81-Q83 VanDerWaalsContact C-N 3.31Å; F81-Q83 PolarHBondContact O-N 3.4Å
84	E	85.6	Confident	82.1	Confident	155 Å²	155	78.7 Å²	78.7	72%	0.724	44%	0.436	S	S	*	.	H	α-helix	trans	-77.3	-37.7	-178.7	-70	-175.9	175.6	0	0	113.2	V80 F81 G86	V80-E84 HydrophobicContact CG1-CG 4.13Å; V80-E84 WeakPolarHBondContact CG1-OE1 3.19Å; V80-E84 WeakPolarHBondContact O-CG 3.2Å; V80-E84 PolarHBondContact O-N 3.42Å; F81-E84 PolarHBondContact O-N 2.84Å; E84-G86 PolarHBondContact O-N 2.87Å
85	S	83.1	Confident	81.8	Confident	21 Å²	21	77.5 Å²	77.5	15%	0.147	43%	0.426	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-7.6	-178.7	61.9	0	0	0	0	113.6	F81 H87	F81-S85 WeakPolarHBondContact O-CB 3.4Å; F81-S85 PolarHBondContact O-N 3.19Å; F81-S85 PolarHBondContact O-OG 3.33Å; S85-H87 WeakPolarHBondContact OG-CB 3.45Å
86	G	76.3	Confident	81.5	Confident	69 Å²	69	81.3 Å²	81.3	71%	0.711	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	77	9.1	-174	0	0	0	0	0	113.5	E84 G88	E84-G86 PolarHBondContact O-N 2.87Å; G86-G88 PolarHBondContact O-N 3.41Å
87	H	72.3	Confident	81.2	Confident	10 Å²	10	77.5 Å²	77.5	5%	0.046	42%	0.419	C	S	.	.			trans	-70.8	-18	176.9	-125.8	81.8	0	0	0	112.7	L59 N62 E63 I66 R82 S85 L90	L59-H87 WeakPolarHBondContact CD1-CE1 3.13Å; N62-H87 WeakPolarHBondContact CB-ND1 3.33Å; E63-H87 IonicContact OE1-CD2 2.67Å; E63-H87 IonicContact OE1-CE1 3.78Å; E63-H87 IonicContact OE1-NE2 3.27Å; E63-H87 PolarHBondContact OE1-NE2 2.7Å; I66-H87 HydrophobicContact CD1-CB 4.3Å; R82-H87 PolarHBondContact O-N 3.07Å; S85-H87 WeakPolarHBondContact OG-CB 3.45Å; H87-L90 WeakPolarHBondContact O-CB 3.48Å; H87-L90 PolarHBondContact O-N 3.38Å
88	G	65.6	Low	80.9	Confident	24 Å²	24	74.3 Å²	74.3	25%	0.247	40%	0.399	C	S	.	.	T	Hydrogen-bonded Turn	trans	53	-150.3	174.9	0	0	0	0	0	113	R82 G86 L90	R82-G88 PolarHBondContact O-N 3.24Å; G86-G88 PolarHBondContact O-N 3.41Å; G88-L90 PolarHBondContact O-N 3.38Å
89	N	64.6	Low	80.7	Confident	168 Å²	168	73.4 Å²	73.4	90%	0.898	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	23	173.5	-66.6	31.5	0	0	0	111.9	H91	N89-H91 PolarHBondContact O-N 3.18Å
90	L	64.9	Low	80.5	Confident	100 Å²	100	76.6 Å²	76.6	52%	0.524	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-61.8	132.2	179.5	-168.3	70.5	0	0	0	109.1	R82 H87 G88	R82-L90 PolarHBondContact NH1-O 2.65Å; H87-L90 WeakPolarHBondContact O-CB 3.48Å; H87-L90 PolarHBondContact O-N 3.38Å; G88-L90 PolarHBondContact O-N 3.38Å
91	H	69.1	Low	80.2	Confident	161 Å²	161	77.2 Å²	77.2	75%	0.745	41%	0.406	S	S	*	.	P	Polyproline II helix	trans	-59.6	139.2	173.5	-176	-81.8	0	0	0	109.5	N89 L93	N89-H91 PolarHBondContact O-N 3.18Å; H91-L93 PolarHBondContact O-N 2.92Å
92	N	77.2	Confident	79.9	Confident	56 Å²	56	77.2 Å²	77.2	30%	0.299	41%	0.408	S	S	.	.	P	Polyproline II helix	trans	-52.5	133.8	178	-65.3	-14.1	0	0	0	110.8	R82	R82-N92 PolarHBondContact NH1-OD1 3.18Å; R82-N92 PolarHBondContact NH2-OD1 2.61Å
93	L	82.2	Confident	79.7	Confident	42 Å²	42	84.3 Å²	84.3	22%	0.22	44%	0.442	C	S	.	.	P	Polyproline II helix	trans	-64.4	133.7	179.3	-164.4	63.9	0	0	0	108.7	E63 H91 R95 F97 L98	E63-L93 VanDerWaalsContact CD-CB 3.44Å; E63-L93 HydrophobicContact CG-CB 3.84Å; E63-L93 HydrophobicContact CG-CD2 4.18Å; E63-L93 PolarHBondContact OE1-N 3.38Å; E63-L93 PolarHBondContact OE2-N 3.27Å; H91-L93 PolarHBondContact O-N 2.92Å; L93-R95 PolarHBondContact O-N 3.41Å; L93-F97 HydrophobicContact CD1-CD1 3.88Å; L93-F97 HydrophobicContact CD1-CE1 4.27Å; L93-F97 HydrophobicContact CD1-CG 4.26Å; L93-F97 HydrophobicContact CD2-CD1 3.22Å; L93-F97 HydrophobicContact CD2-CE1 3.49Å; L93-F97 VanDerWaalsContact CD2-CE1 3.49Å; L93-F97 HydrophobicContact CD2-CG 4.27Å; L93-F97 HydrophobicContact CG-CB 4.3Å; L93-F97 HydrophobicContact CG-CD1 3.56Å; L93-F97 HydrophobicContact CG-CE1 4.21Å; L93-F97 HydrophobicContact CG-CG 4.17Å; L93-L98 HydrophobicContact CD2-CD2 3.77Å; L93-L98 HydrophobicContact CD2-CG 4.21Å
94	P	82.9	Confident	79.4	Confident	80 Å²	80	79.8 Å²	79.8	52%	0.519	42%	0.422	S	S	.	.	P	Polyproline II helix	trans	-61.1	133.3	-177.1	23.8	-31.5	0	0	0	109.1	Q96 F97 L98	P94-Q96 PolarHBondContact O-N 3.4Å; P94-F97 HydrophobicContact CG-CB 3.99Å; P94-F97 WeakPolarHBondContact O-CA 3.33Å; P94-F97 WeakPolarHBondContact O-CB 3.4Å; P94-F97 PolarHBondContact O-N 2.71Å; P94-L98 PolarHBondContact O-N 2.74Å
95	R	82.5	Confident	78.9	Confident	48 Å²	48	81 Å²	81	18%	0.181	43%	0.425	C	S	.	.	H	α-helix	trans	-53.8	-31.8	-177.2	-172.5	172.5	171.7	137.4	-5.7	113.1	E67 L93 F97 L98 C99 P142 I143 L145	E67-R95 IonicContact OE1-CZ 3.02Å; E67-R95 IonicContact OE1-NE 2.69Å; E67-R95 IonicContact OE1-NH1 3.4Å; E67-R95 PolarHBondContact OE1-NH1 2.67Å; L93-R95 PolarHBondContact O-N 3.41Å; R95-F97 VanDerWaalsContact C-N 3.33Å; R95-F97 PolarHBondContact O-N 3.3Å; R95-L98 PolarHBondContact O-N 3.44Å; R95-C99 WeakPolarHBondContact O-CB 3.05Å; R95-C99 PolarHBondContact O-N 3.28Å; R95-C99 PolarHBondContact O-SG 2.91Å; R95-P142 VanDerWaalsContact NH1-CB 3.3Å; R95-P142 VanDerWaalsContact NH1-CG 3.25Å; R95-P142 PolarHBondContact NH1-O 3.15Å; R95-I143 VanDerWaalsContact CZ-O 3.23Å; R95-I143 PolarHBondContact NH1-O 2.78Å; R95-I143 PolarHBondContact NH2-O 3.41Å; R95-L145 HydrophobicContact CG-CD1 4.05Å; R95-L145 HydrophobicContact CG-CG 4.47Å
96	Q	84.2	Confident	78.1	Confident	158 Å²	158	83.3 Å²	83.3	74%	0.738	44%	0.439	S	S	*	.	H	α-helix	trans	-59.6	-41.4	174.4	-176.5	173.9	3.5	0	0	112.4	P94 C99 Q100	P94-Q96 PolarHBondContact O-N 3.4Å; Q96-C99 PolarHBondContact O-N 3.13Å; Q96-Q100 WeakPolarHBondContact O-CB 3.27Å; Q96-Q100 PolarHBondContact O-N 3.14Å
97	F	86.8	Confident	77.3	Confident	92 Å²	92	84.9 Å²	84.9	40%	0.404	44%	0.435	S	S	.	.	H	α-helix	trans	-66.2	-45.4	176.5	178.9	-85.7	0	0	0	111	L93 P94 R95 C99 Q100 T101	L93-F97 HydrophobicContact CD1-CD1 3.88Å; L93-F97 HydrophobicContact CD1-CE1 4.27Å; L93-F97 HydrophobicContact CD1-CG 4.26Å; L93-F97 HydrophobicContact CD2-CD1 3.22Å; L93-F97 HydrophobicContact CD2-CE1 3.49Å; L93-F97 VanDerWaalsContact CD2-CE1 3.49Å; L93-F97 HydrophobicContact CD2-CG 4.27Å; L93-F97 HydrophobicContact CG-CB 4.3Å; L93-F97 HydrophobicContact CG-CD1 3.56Å; L93-F97 HydrophobicContact CG-CE1 4.21Å; L93-F97 HydrophobicContact CG-CG 4.17Å; P94-F97 HydrophobicContact CG-CB 3.99Å; P94-F97 WeakPolarHBondContact O-CA 3.33Å; P94-F97 WeakPolarHBondContact O-CB 3.4Å; P94-F97 PolarHBondContact O-N 2.71Å; R95-F97 VanDerWaalsContact C-N 3.33Å; R95-F97 PolarHBondContact O-N 3.3Å; F97-C99 VanDerWaalsContact C-N 3.3Å; F97-C99 PolarHBondContact O-N 2.81Å; F97-Q100 PolarHBondContact O-N 2.99Å; F97-T101 WeakPolarHBondContact CE1-OG1 2.98Å; F97-T101 WeakPolarHBondContact O-CB 3.07Å; F97-T101 PolarHBondContact O-N 2.77Å; F97-T101 PolarHBondContact O-OG1 2.78Å; F97-T101 VanDerWaalsContact O-OG1 3.07Å
98	L	87	Confident	76.8	Confident	3 Å²	3	86.2 Å²	86.2	2%	0.016	44%	0.444	C	S	.	.	H	α-helix	trans	-57.1	-46.9	175.3	-69.2	171.7	0	0	0	110.7	L60 E63 L93 P94 R95 Q100 T101 L102 L145	L60-L98 HydrophobicContact CD1-CD2 4.22Å; L60-L98 HydrophobicContact CG-CD2 4.23Å; E63-L98 HydrophobicContact CB-CD1 4.27Å; E63-L98 HydrophobicContact CB-CD2 3.89Å; E63-L98 HydrophobicContact CG-CD2 4.49Å; L93-L98 HydrophobicContact CD2-CD2 3.77Å; L93-L98 HydrophobicContact CD2-CG 4.21Å; P94-L98 PolarHBondContact O-N 2.74Å; R95-L98 PolarHBondContact O-N 3.44Å; L98-Q100 VanDerWaalsContact C-N 3.32Å; L98-Q100 PolarHBondContact O-N 2.8Å; L98-T101 PolarHBondContact O-N 2.96Å; L98-L102 HydrophobicContact CB-CD1 4.33Å; L98-L102 HydrophobicContact CD2-CD1 4.38Å; L98-L102 WeakPolarHBondContact O-CB 3.16Å; L98-L102 WeakPolarHBondContact O-CD1 3.35Å; L98-L102 PolarHBondContact O-N 3.09Å; L98-L145 HydrophobicContact CB-CD1 3.57Å; L98-L145 HydrophobicContact CD1-CD1 4.08Å; L98-L145 HydrophobicContact CG-CD1 4.48Å
99	C	85.3	Confident	76.7	Confident	9 Å²	9	87 Å²	87	6%	0.061	44%	0.443	C	S	.	.	H	α-helix	trans	-61.3	-40.9	178.8	-66.8	0	0	0	0	112.8	R95 Q96 F97 Q103 I104 P106	R95-C99 WeakPolarHBondContact O-CB 3.05Å; R95-C99 PolarHBondContact O-N 3.28Å; R95-C99 PolarHBondContact O-SG 2.91Å; Q96-C99 PolarHBondContact O-N 3.13Å; F97-C99 VanDerWaalsContact C-N 3.3Å; F97-C99 PolarHBondContact O-N 2.81Å; C99-Q103 CarbonylContact O-C 3.58Å; C99-Q103 WeakPolarHBondContact O-CA 3.44Å; C99-Q103 PolarHBondContact O-N 3.2Å; C99-I104 HydrophobicContact CB-CG1 4.28Å; C99-I104 WeakPolarHBondContact CB-O 3.34Å; C99-I104 PolarHBondContact O-N 2.77Å; C99-P106 HydrophobicContact CB-CG 4.1Å; C99-P106 VanDerWaalsContact SG-CB 3.54Å; C99-P106 WeakPolarHBondContact SG-CG 3.46Å
100	Q	85.1	Confident	76.6	Confident	145 Å²	145	80.4 Å²	80.4	68%	0.678	41%	0.407	S	S	*	.	H	α-helix	trans	-66.9	-46.7	177.3	-178.2	176.1	-23.4	0	0	111.8	Q96 F97 L98 Q103	Q96-Q100 WeakPolarHBondContact O-CB 3.27Å; Q96-Q100 PolarHBondContact O-N 3.14Å; F97-Q100 PolarHBondContact O-N 2.99Å; L98-Q100 VanDerWaalsContact C-N 3.32Å; L98-Q100 PolarHBondContact O-N 2.8Å; Q100-Q103 PolarHBondContact O-N 3.11Å
101	T	85.3	Confident	76.3	Confident	65 Å²	65	80.3 Å²	80.3	40%	0.399	40%	0.402	S	S	.	.	H	α-helix	trans	-67.2	-40	-179.3	-56.6	0	0	0	0	111.7	L60 F97 L98 Q103	L60-T101 HydrophobicContact CD1-CG2 4.06Å; L60-T101 HydrophobicContact CD2-CG2 3.68Å; F97-T101 WeakPolarHBondContact CE1-OG1 2.98Å; F97-T101 WeakPolarHBondContact O-CB 3.07Å; F97-T101 PolarHBondContact O-N 2.77Å; F97-T101 PolarHBondContact O-OG1 2.78Å; F97-T101 VanDerWaalsContact O-OG1 3.07Å; L98-T101 PolarHBondContact O-N 2.96Å; T101-Q103 VanDerWaalsContact C-N 3.32Å
102	L	84.8	Confident	75.8	Confident	46 Å²	46	75.3 Å²	75.3	24%	0.241	39%	0.386	C	S	.	.	H	α-helix	trans	-83.6	-5	176.9	-75.9	94.8	0	0	0	113.9	L60 L64 L98 I104 I149	L60-L102 HydrophobicContact CD2-CD1 3.39Å; L60-L102 HydrophobicContact CD2-CG 3.92Å; L60-L102 HydrophobicContact CG-CD1 3.76Å; L64-L102 HydrophobicContact CD1-CD2 4.09Å; L98-L102 HydrophobicContact CB-CD1 4.33Å; L98-L102 HydrophobicContact CD2-CD1 4.38Å; L98-L102 WeakPolarHBondContact O-CB 3.16Å; L98-L102 WeakPolarHBondContact O-CD1 3.35Å; L98-L102 PolarHBondContact O-N 3.09Å; L102-I104 HydrophobicContact CB-CD1 3.92Å; L102-I104 HydrophobicContact CB-CG1 3.93Å; L102-I104 HydrophobicContact CB-CG2 4.22Å; L102-I104 HydrophobicContact CD2-CD1 4.26Å; L102-I104 PolarHBondContact O-N 3.28Å; L102-I149 HydrophobicContact CD2-CD1 3.43Å; L102-I149 VanDerWaalsContact CD2-CD1 3.43Å; L102-I149 HydrophobicContact CD2-CG1 4.29Å
103	Q	83.5	Confident	75	Confident	179 Å²	179	76.3 Å²	76.3	84%	0.836	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.5	33.7	-176.7	-54.5	172.1	32.6	0	0	113.3	C99 Q100 T101	C99-Q103 CarbonylContact O-C 3.58Å; C99-Q103 WeakPolarHBondContact O-CA 3.44Å; C99-Q103 PolarHBondContact O-N 3.2Å; Q100-Q103 PolarHBondContact O-N 3.11Å; T101-Q103 VanDerWaalsContact C-N 3.32Å
104	I	79.5	Confident	74	Confident	44 Å²	44	79 Å²	79	23%	0.226	40%	0.404	C	S	.	.			trans	-103.5	143.3	178.4	58.7	-175.1	0	0	0	110.4	C99 L102 P106 L145	C99-I104 HydrophobicContact CB-CG1 4.28Å; C99-I104 WeakPolarHBondContact CB-O 3.34Å; C99-I104 PolarHBondContact O-N 2.77Å; L102-I104 HydrophobicContact CB-CD1 3.92Å; L102-I104 HydrophobicContact CB-CG1 3.93Å; L102-I104 HydrophobicContact CB-CG2 4.22Å; L102-I104 HydrophobicContact CD2-CD1 4.26Å; L102-I104 PolarHBondContact O-N 3.28Å; I104-P106 WeakPolarHBondContact O-CD 3.17Å; I104-L145 HydrophobicContact CD1-CB 3.95Å; I104-L145 HydrophobicContact CD1-CD1 4.04Å; I104-L145 HydrophobicContact CD1-CD2 3.69Å; I104-L145 HydrophobicContact CD1-CG 4.08Å; I104-L145 HydrophobicContact CG1-CD2 4.42Å
105	K	74.6	Confident	72.9	Confident	182 Å²	182	79.9 Å²	79.9	79%	0.791	40%	0.404	S	S	*	.			trans	-89.8	116.4	174.4	-67.5	-177.1	179	178.2	0	109.3	T107	K105-T107 HydrophobicContact CB-CG2 4Å; K105-T107 PolarHBondContact O-N 3.14Å
106	P	65.4	Low	71.7	Confident	68 Å²	68	84.3 Å²	84.3	44%	0.442	43%	0.425	S	S	.	.			trans	-77.1	104.1	177.6	27.7	-30.2	0	0	0	109.8	C99 I104	C99-P106 HydrophobicContact CB-CG 4.1Å; C99-P106 VanDerWaalsContact SG-CB 3.54Å; C99-P106 WeakPolarHBondContact SG-CG 3.46Å; I104-P106 WeakPolarHBondContact O-CD 3.17Å
107	T	60.2	Low	70.4	Confident	103 Å²	103	81.8 Å²	81.8	63%	0.632	42%	0.416	S	S	*	.			trans	-144.8	39.4	-175.9	85.9	0	0	0	0	116.2	K105	K105-T107 HydrophobicContact CB-CG2 4Å; K105-T107 PolarHBondContact O-N 3.14Å
108	V	61	Low	68.9	Low	38 Å²	38	81.9 Å²	81.9	23%	0.23	42%	0.418	C	S	.	.			trans	-154.3	125.3	166	-133.7	0	0	0	0	112.1	S112 L113 I143 Y148	V108-S112 WeakPolarHBondContact CG1-OG 3.24Å; V108-L113 HydrophobicContact CB-CG 4.46Å; V108-L113 HydrophobicContact CG1-CD2 3.9Å; V108-L113 HydrophobicContact CG1-CG 3.73Å; V108-I143 HydrophobicContact CB-CD1 4.05Å; V108-I143 WeakPolarHBondContact O-CG1 3.43Å; V108-I143 PolarHBondContact O-N 2.78Å; V108-Y148 WeakPolarHBondContact CA-OH 3.31Å; V108-Y148 WeakPolarHBondContact CB-OH 3.37Å; V108-Y148 HydrophobicContact CG2-CE1 3.6Å; V108-Y148 WeakPolarHBondContact CG2-OH 3.3Å; V108-Y148 PolarHBondContact N-OH 3.36Å; V108-Y148 PolarHBondContact O-OH 2.71Å
109	N	65	Low	67.3	Low	41 Å²	41	87 Å²	87	22%	0.219	45%	0.445	C	S	.	.	B	Isolated β-bridge	trans	-92	150.2	161.7	173.9	-37.8	0	0	0	106.9	K111 S112 L113 I139 E140	N109-K111 PolarHBondContact O-N 2.69Å; N109-K111 VanDerWaalsContact O-N 3.15Å; N109-K111 PolarHBondContact OD1-N 2.79Å; N109-S112 PolarHBondContact N-OG 3.34Å; N109-S112 PolarHBondContact O-N 2.88Å; N109-S112 PolarHBondContact O-OG 3.24Å; N109-L113 PolarHBondContact O-N 3.06Å; N109-I139 PolarHBondContact ND2-O 3.47Å; N109-I139 VanDerWaalsContact ND2-O 3.17Å; N109-I139 PolarHBondContact OD1-O 2.86Å; N109-E140 PolarHBondContact ND2-O 3.47Å
110	I	61.7	Low	65.8	Low	29 Å²	29	92.5 Å²	92.5	15%	0.149	47%	0.474	C	S	.	.	H	α-helix	trans	-53.9	-30.5	174.5	65.6	175.2	0	0	0	113.5	F71 S112 L113 I114 L138 I139 I143	F71-I110 HydrophobicContact CE2-CG2 4.27Å; F71-I110 HydrophobicContact CZ-CG2 4.03Å; I110-S112 VanDerWaalsContact C-N 3.29Å; I110-S112 PolarHBondContact O-N 3.49Å; I110-L113 PolarHBondContact O-N 3.07Å; I110-I114 HydrophobicContact CB-CD1 4.41Å; I110-I114 WeakPolarHBondContact O-CB 3.46Å; I110-I114 VanDerWaalsContact O-CG1 3.28Å; I110-I114 WeakPolarHBondContact O-CG1 3.29Å; I110-I114 PolarHBondContact O-N 2.97Å; I110-L138 HydrophobicContact CD1-CB 4.26Å; I110-L138 WeakPolarHBondContact CD1-O 3.27Å; I110-I139 HydrophobicContact CD1-CB 4.39Å; I110-I139 HydrophobicContact CD1-CG1 3.97Å; I110-I139 HydrophobicContact CG1-CG1 4.37Å; I110-I143 HydrophobicContact CG2-CD1 4.02Å; I110-I143 HydrophobicContact CG2-CG1 3.52Å
111	K	59	Low	64.2	Low	97 Å²	97	91.5 Å²	91.5	42%	0.422	47%	0.473	S	S	.	.	H	α-helix	trans	-51	-48.3	170.4	-74.4	-176.5	-172.9	174.9	0	111.3	N109 L115 I139 E140	N109-K111 PolarHBondContact O-N 2.69Å; N109-K111 VanDerWaalsContact O-N 3.15Å; N109-K111 PolarHBondContact OD1-N 2.79Å; K111-L115 WeakPolarHBondContact O-CB 3.19Å; K111-L115 PolarHBondContact O-N 2.79Å; K111-I139 HydrophobicContact CD-CG2 3.85Å; K111-I139 VanDerWaalsContact CE-O 3.28Å; K111-I139 WeakPolarHBondContact CE-O 3.14Å; K111-I139 HydrophobicContact CG-CG2 3.37Å; K111-I139 WeakPolarHBondContact CG-O 3.28Å; K111-E140 IonicContact NZ-OE1 3.57Å; K111-E140 PolarHBondContact NZ-OE1 2.87Å
112	S	59.1	Low	62.4	Low	57 Å²	57	92.2 Å²	92.2	40%	0.399	48%	0.475	S	S	.	.	H	α-helix	trans	-76.5	-27.9	-177	55.9	0	0	0	0	112.6	V108 N109 I110 K116	V108-S112 WeakPolarHBondContact CG1-OG 3.24Å; N109-S112 PolarHBondContact N-OG 3.34Å; N109-S112 PolarHBondContact O-N 2.88Å; N109-S112 PolarHBondContact O-OG 3.24Å; I110-S112 VanDerWaalsContact C-N 3.29Å; I110-S112 PolarHBondContact O-N 3.49Å; S112-K116 WeakPolarHBondContact O-CB 3.49Å; S112-K116 PolarHBondContact O-N 2.71Å
113	L	59.8	Low	60.6	Low	77 Å²	77	94.9 Å²	94.9	40%	0.403	50%	0.497	S	S	.	.	H	α-helix	trans	-69.2	-48	170	-76.4	-176.7	0	0	0	112.3	V108 N109 I110 K116 N117 I143	V108-L113 HydrophobicContact CB-CG 4.46Å; V108-L113 HydrophobicContact CG1-CD2 3.9Å; V108-L113 HydrophobicContact CG1-CG 3.73Å; N109-L113 PolarHBondContact O-N 3.06Å; I110-L113 PolarHBondContact O-N 3.07Å; L113-K116 PolarHBondContact O-N 2.85Å; L113-N117 PolarHBondContact O-N 2.84Å; L113-I143 HydrophobicContact CD1-CD1 3.24Å; L113-I143 HydrophobicContact CG-CD1 3.99Å
114	I	62.2	Low	58.5	Low	98 Å²	98	93.9 Å²	93.9	50%	0.503	50%	0.497	S	S	.	.	H	α-helix	trans	-64.4	-44.6	179.5	-65.3	167.3	0	0	0	109.7	I110 K116 N117 H118	I110-I114 HydrophobicContact CB-CD1 4.41Å; I110-I114 WeakPolarHBondContact O-CB 3.46Å; I110-I114 VanDerWaalsContact O-CG1 3.28Å; I110-I114 WeakPolarHBondContact O-CG1 3.29Å; I110-I114 PolarHBondContact O-N 2.97Å; I114-K116 PolarHBondContact O-N 3.29Å; I114-N117 PolarHBondContact O-N 2.96Å; I114-H118 WeakPolarHBondContact O-CB 3.36Å; I114-H118 PolarHBondContact O-N 3.34Å
115	L	59.2	Low	56.7	Low	99 Å²	99	95.3 Å²	95.3	52%	0.518	52%	0.516	S	S	.	.	H	α-helix	trans	-65.3	-38.9	177.7	-172.8	62.5	0	0	0	111.9	K111 N117 H118 N119	K111-L115 WeakPolarHBondContact O-CB 3.19Å; K111-L115 PolarHBondContact O-N 2.79Å; L115-N117 VanDerWaalsContact C-N 3.34Å; L115-N117 PolarHBondContact O-N 2.95Å; L115-H118 PolarHBondContact O-N 2.83Å; L115-N119 WeakPolarHBondContact O-CB 3.49Å; L115-N119 PolarHBondContact O-N 3.2Å
116	K	57	Low	54.8	Low	141 Å²	141	95.7 Å²	95.7	61%	0.613	52%	0.517	S	S	*	.	H	α-helix	trans	-63.1	-40.1	174.9	-173.5	174	-176.7	-179.8	0	111.7	S112 L113 I114	S112-K116 WeakPolarHBondContact O-CB 3.49Å; S112-K116 PolarHBondContact O-N 2.71Å; L113-K116 PolarHBondContact O-N 2.85Å; I114-K116 PolarHBondContact O-N 3.29Å
117	N	56.9	Low	53.6	Low	105 Å²	105	100.1 Å²	100.1	56%	0.561	54%	0.537	S	S	*	.	H	α-helix	trans	-70.5	-37.4	174.4	-78.9	-3.3	0	0	0	112.4	L113 I114 L115 N120 N121	L113-N117 PolarHBondContact O-N 2.84Å; I114-N117 PolarHBondContact O-N 2.96Å; L115-N117 VanDerWaalsContact C-N 3.34Å; L115-N117 PolarHBondContact O-N 2.95Å; N117-N120 PolarHBondContact O-N 3.5Å; N117-N121 PolarHBondContact O-N 3.42Å
118	H	54.5	Low	52.5	Low	94 Å²	94	100 Å²	100	44%	0.435	55%	0.546	S	S	.	.	H	α-helix	trans	-70.7	-37.9	-178.8	-159	37.3	0	0	0	112.2	I114 L115 N120 N121 N122	I114-H118 WeakPolarHBondContact O-CB 3.36Å; I114-H118 PolarHBondContact O-N 3.34Å; L115-H118 PolarHBondContact O-N 2.83Å; H118-N120 PolarHBondContact O-N 2.98Å; H118-N121 PolarHBondContact O-N 2.81Å; H118-N121 VanDerWaalsContact O-N 3.12Å; H118-N122 PolarHBondContact CD2-ND2 3.34Å; H118-N122 VanDerWaalsContact CD2-ND2 3.32Å; H118-N122 PolarHBondContact CE1-ND2 2.96Å; H118-N122 PolarHBondContact CE1-OD1 2.82Å; H118-N122 PolarHBondContact ND1-ND2 3.05Å; H118-N122 PolarHBondContact ND1-OD1 2.95Å; H118-N122 PolarHBondContact NE2-ND2 2.9Å; H118-N122 WeakPolarHBondContact O-CB 2.91Å; H118-N122 PolarHBondContact O-N 2.84Å
119	N	53.7	Low	51.3	Low	111 Å²	111	106.3 Å²	106.3	59%	0.594	58%	0.578	S	S	*	*	H	α-helix	trans	-64	-26.2	175.6	-71	-9.4	0	0	0	112.7	L115	L115-N119 WeakPolarHBondContact O-CB 3.49Å; L115-N119 PolarHBondContact O-N 3.2Å
120	N	54.1	Low	49.7	Very low	123 Å²	123	110.4 Å²	110.4	66%	0.658	60%	0.6	S	S	*	*	H	α-helix	trans	-79.5	-23.6	176	-72.7	-6.3	0	0	0	113.1	N117 H118	N117-N120 PolarHBondContact O-N 3.5Å; H118-N120 PolarHBondContact O-N 2.98Å
121	N	52.3	Low	48.6	Very low	125 Å²	125	116.4 Å²	116.4	67%	0.668	63%	0.632	S	S	*	*	H	α-helix	trans	-112.1	-4.8	-171.9	-67.2	-11.7	0	0	0	114.3	N117 H118 S123	N117-N121 PolarHBondContact O-N 3.42Å; H118-N121 PolarHBondContact O-N 2.81Å; H118-N121 VanDerWaalsContact O-N 3.12Å; N121-S123 PolarHBondContact O-N 3.24Å; N121-S123 VanDerWaalsContact O-N 3.15Å
122	N	46.6	Very low	47.8	Very low	80 Å²	80	118.3 Å²	118.3	43%	0.428	64%	0.643	S	S	.	*			trans	-91.1	75.1	177.8	-82.7	1.9	0	0	0	112.9	H118	H118-N122 PolarHBondContact CD2-ND2 3.34Å; H118-N122 VanDerWaalsContact CD2-ND2 3.32Å; H118-N122 PolarHBondContact CE1-ND2 2.96Å; H118-N122 PolarHBondContact CE1-OD1 2.82Å; H118-N122 PolarHBondContact ND1-ND2 3.05Å; H118-N122 PolarHBondContact ND1-OD1 2.95Å; H118-N122 PolarHBondContact NE2-ND2 2.9Å; H118-N122 WeakPolarHBondContact O-CB 2.91Å; H118-N122 PolarHBondContact O-N 2.84Å
123	S	46.4	Very low	46.8	Very low	101 Å²	101	125.5 Å²	125.5	71%	0.706	67%	0.667	S	S	*	*	S	Bend		-96.9	112	126.7	56.3	0	0	0	0	106.5	N121	N121-S123 PolarHBondContact O-N 3.24Å; N121-S123 VanDerWaalsContact O-N 3.15Å
124	N	41	Very low	46.2	Very low	158 Å²	158	125 Å²	125	85%	0.845	67%	0.67	S	S	*	*	S	Bend	trans	70.2	84.3	166.1	-50.8	-29.3	0	0	0	118.7
125	A	40.2	Very low	45.4	Very low	74 Å²	74	122.1 Å²	122.1	61%	0.612	66%	0.659	S	S	*	*			trans	-165.5	97.2	141.1	0	0	0	0	0	110.9
126	K	35.8	Very low	44.9	Very low	191 Å²	191	122.2 Å²	122.2	83%	0.83	66%	0.663	S	S	*	*			trans	-68.5	143.3	155.7	-64.8	169.1	178.7	173.4	0	107
127	N	40.4	Very low	44.6	Very low	161 Å²	161	122.5 Å²	122.5	86%	0.861	67%	0.667	S	S	*	*			trans	93.4	90.5	164.9	-42.6	-29.7	0	0	0	116.8
128	A	36.9	Very low	44.3	Very low	99 Å²	99	119.4 Å²	119.4	82%	0.818	65%	0.65	S	S	*	*			trans	-164.6	70.5	143.4	0	0	0	0	0	109.4	N130	A128-N130 VanDerWaalsContact C-N 3.33Å; A128-N130 PolarHBondContact O-N 3.32Å
129	L	36.1	Very low	44.4	Very low	171 Å²	171	117.3 Å²	117.3	90%	0.895	64%	0.642	S	S	*	*			trans	-96.7	56.8	173.4	-174.1	72.9	0	0	0	108.7
130	N	30.2	Very low	44.8	Very low	128 Å²	128	118.5 Å²	118.5	68%	0.684	64%	0.644	S	S	*	*			trans	-142.4	121.8	-171.6	-56.8	44.5	0	0	0	109.4	A128	A128-N130 VanDerWaalsContact C-N 3.33Å; A128-N130 PolarHBondContact O-N 3.32Å
131	N	38.4	Very low	45.6	Very low	154 Å²	154	115.1 Å²	115.1	82%	0.824	62%	0.624	S	S	*	*	S	Bend	trans	71.4	86.8	165.1	-51.7	-16.7	0	0	0	115.2
132	Q	43.4	Very low	46.8	Very low	138 Å²	138	112.1 Å²	112.1	65%	0.645	61%	0.611	S	S	*	*				-164.7	89.6	125.3	-70.3	-134.6	19.6	0	0	106.8	S134 S135	Q132-S134 PolarHBondContact O-N 3.21Å; Q132-S134 VanDerWaalsContact O-N 3.1Å; Q132-S135 WeakPolarHBondContact CB-OG 3.36Å; Q132-S135 WeakPolarHBondContact O-CB 3.22Å; Q132-S135 PolarHBondContact O-N 2.91Å
133	K	38.4	Very low	48.5	Very low	207 Å²	207	108.9 Å²	108.9	90%	0.9	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67	-3.3	178.8	-163.9	164.4	-179.9	179.4	0	112.9
134	S	46.7	Very low	50.6	Low	67 Å²	67	104 Å²	104	47%	0.469	56%	0.56	S	S	.	*	T	Hydrogen-bonded Turn	trans	-88.8	-16.7	167.7	47.7	0	0	0	0	113.1	Q132 L138	Q132-S134 PolarHBondContact O-N 3.21Å; Q132-S134 VanDerWaalsContact O-N 3.1Å; S134-L138 WeakPolarHBondContact O-CD1 3.25Å; S134-L138 VanDerWaalsContact O-CG 3.3Å; S134-L138 WeakPolarHBondContact O-CG 3.33Å
135	S	45.5	Very low	52.8	Low	38 Å²	38	96.6 Å²	96.6	27%	0.266	52%	0.52	S	S	.	.	H	α-helix	trans	-82.4	-25.7	-176.3	-55.3	0	0	0	0	113.5	Q132 E137 L138 I139	Q132-S135 WeakPolarHBondContact CB-OG 3.36Å; Q132-S135 WeakPolarHBondContact O-CB 3.22Å; Q132-S135 PolarHBondContact O-N 2.91Å; S135-E137 VanDerWaalsContact C-N 3.32Å; S135-E137 PolarHBondContact O-N 2.77Å; S135-L138 PolarHBondContact O-N 3.25Å; S135-I139 VanDerWaalsContact O-CB 3.28Å; S135-I139 WeakPolarHBondContact O-CB 3.2Å; S135-I139 WeakPolarHBondContact O-CD1 3.48Å; S135-I139 WeakPolarHBondContact O-CG1 3.41Å; S135-I139 PolarHBondContact O-N 3.03Å
136	T	48.9	Very low	55.2	Low	101 Å²	101	95.2 Å²	95.2	62%	0.62	50%	0.502	S	S	*	.	H	α-helix	trans	-65	-34.5	-174.2	48.2	0	0	0	0	113.7
137	E	50.3	Low	57.6	Low	147 Å²	147	90.6 Å²	90.6	69%	0.687	48%	0.482	S	S	*	.	H	α-helix	trans	-79.8	-40.1	176.9	-169.3	165.4	-164.4	0	0	111.7	S135 I139 E140	S135-E137 VanDerWaalsContact C-N 3.32Å; S135-E137 PolarHBondContact O-N 2.77Å; E137-I139 PolarHBondContact O-N 2.69Å; E137-I139 VanDerWaalsContact O-N 3.12Å; E137-E140 PolarHBondContact O-N 2.95Å; E137-E140 VanDerWaalsContact O-N 3.11Å
138	L	51.3	Low	59.7	Low	40 Å²	40	85.6 Å²	85.6	21%	0.209	45%	0.452	C	S	.	.	H	α-helix	trans	-55.8	-31.3	172.7	-68.9	-178.2	0	0	0	112.6	F71 N73 I110 S134 S135 E140 Q141	F71-L138 VanDerWaalsContact O-CD2 3.22Å; F71-L138 WeakPolarHBondContact O-CD2 3.48Å; N73-L138 WeakPolarHBondContact ND2-CD2 3.45Å; I110-L138 HydrophobicContact CD1-CB 4.26Å; I110-L138 WeakPolarHBondContact CD1-O 3.27Å; S134-L138 WeakPolarHBondContact O-CD1 3.25Å; S134-L138 VanDerWaalsContact O-CG 3.3Å; S134-L138 WeakPolarHBondContact O-CG 3.33Å; S135-L138 PolarHBondContact O-N 3.25Å; L138-E140 PolarHBondContact O-N 3.4Å; L138-Q141 PolarHBondContact O-N 3.41Å
139	I	55.8	Low	62.2	Low	50 Å²	50	82.8 Å²	82.8	26%	0.256	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-15	-177.4	-76.2	164.8	0	0	0	113	N109 I110 K111 S135 E137	N109-I139 PolarHBondContact ND2-O 3.47Å; N109-I139 VanDerWaalsContact ND2-O 3.17Å; N109-I139 PolarHBondContact OD1-O 2.86Å; I110-I139 HydrophobicContact CD1-CB 4.39Å; I110-I139 HydrophobicContact CD1-CG1 3.97Å; I110-I139 HydrophobicContact CG1-CG1 4.37Å; K111-I139 HydrophobicContact CD-CG2 3.85Å; K111-I139 VanDerWaalsContact CE-O 3.28Å; K111-I139 WeakPolarHBondContact CE-O 3.14Å; K111-I139 HydrophobicContact CG-CG2 3.37Å; K111-I139 WeakPolarHBondContact CG-O 3.28Å; S135-I139 VanDerWaalsContact O-CB 3.28Å; S135-I139 WeakPolarHBondContact O-CB 3.2Å; S135-I139 WeakPolarHBondContact O-CD1 3.48Å; S135-I139 WeakPolarHBondContact O-CG1 3.41Å; S135-I139 PolarHBondContact O-N 3.03Å; E137-I139 PolarHBondContact O-N 2.69Å; E137-I139 VanDerWaalsContact O-N 3.12Å
140	E	61.7	Low	64.6	Low	136 Å²	136	78.6 Å²	78.6	64%	0.636	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97	-28.3	177.6	-54.4	-134.7	132.9	0	0	113.6	N109 K111 E137 L138	N109-E140 PolarHBondContact ND2-O 3.47Å; K111-E140 IonicContact NZ-OE1 3.57Å; K111-E140 PolarHBondContact NZ-OE1 2.87Å; E137-E140 PolarHBondContact O-N 2.95Å; E137-E140 VanDerWaalsContact O-N 3.11Å; L138-E140 PolarHBondContact O-N 3.4Å
141	Q	70.8	Confident	67.2	Low	52 Å²	52	78.4 Å²	78.4	24%	0.243	40%	0.395	C	S	.	.	S	Bend	trans	-70.9	134.7	-177.5	-69.4	-172.6	-11.4	0	0	111.4	F71 L138	F71-Q141 HydrophobicContact CD2-CB 4.35Å; L138-Q141 PolarHBondContact O-N 3.41Å
142	P	78.4	Confident	69.4	Low	61 Å²	61	78 Å²	78	40%	0.396	38%	0.383	S	S	.	.	B	Isolated β-bridge	trans	-68.5	142.8	175.5	30.7	-35.1	0	0	0	110	R95	R95-P142 VanDerWaalsContact NH1-CB 3.3Å; R95-P142 VanDerWaalsContact NH1-CG 3.25Å; R95-P142 PolarHBondContact NH1-O 3.15Å
143	I	83.2	Confident	71.4	Confident	12 Å²	12	74.3 Å²	74.3	6%	0.062	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-55.6	137	-177.5	-61.4	171.9	0	0	0	110	R95 V108 I110 L113 F147 Y148	R95-I143 VanDerWaalsContact CZ-O 3.23Å; R95-I143 PolarHBondContact NH1-O 2.78Å; R95-I143 PolarHBondContact NH2-O 3.41Å; V108-I143 HydrophobicContact CB-CD1 4.05Å; V108-I143 WeakPolarHBondContact O-CG1 3.43Å; V108-I143 PolarHBondContact O-N 2.78Å; I110-I143 HydrophobicContact CG2-CD1 4.02Å; I110-I143 HydrophobicContact CG2-CG1 3.52Å; L113-I143 HydrophobicContact CD1-CD1 3.24Å; L113-I143 HydrophobicContact CG-CD1 3.99Å; I143-F147 HydrophobicContact CG2-CB 3.89Å; I143-F147 HydrophobicContact CG2-CD2 4.48Å; I143-F147 HydrophobicContact CG2-CG 4.18Å; I143-Y148 HydrophobicContact CB-CE2 3.9Å; I143-Y148 HydrophobicContact CG2-CE2 3.84Å
144	P	88.5	Confident	73.6	Confident	0 Å²	0	71.5 Å²	71.5	0%	0	36%	0.359	C	S	.	.	P	Polyproline II helix	trans	-59.5	143.2	-177.3	-23.8	33.7	0	0	0	112.2	E67 F71 L146 F147 Y148	E67-P144 HydrophobicContact CG-CB 4.15Å; F71-P144 HydrophobicContact CB-CG 3.33Å; F71-P144 HydrophobicContact CD1-CG 3.58Å; F71-P144 HydrophobicContact CD2-CG 3.94Å; F71-P144 HydrophobicContact CE1-CG 4.35Å; F71-P144 VanDerWaalsContact CG-CD 3.46Å; F71-P144 HydrophobicContact CG-CG 3.33Å; P144-L146 PolarHBondContact O-N 3.41Å; P144-F147 HydrophobicContact CB-CD2 4Å; P144-F147 HydrophobicContact CG-CD2 3.98Å; P144-F147 HydrophobicContact CG-CE2 4.11Å; P144-F147 WeakPolarHBondContact O-CB 3.27Å; P144-F147 PolarHBondContact O-N 3.22Å; P144-F147 VanDerWaalsContact O-N 3.1Å; P144-Y148 WeakPolarHBondContact O-CD2 3.27Å
145	L	88.1	Confident	75.3	Confident	1 Å²	1	73.1 Å²	73.1	1%	0.005	37%	0.366	C	S	.	.	H	α-helix	trans	-61.4	-29.6	180	-64.4	175.6	0	0	0	111.9	L64 E67 R95 L98 I104 F147 Y148 I149	L64-L145 HydrophobicContact CD2-CB 3.52Å; L64-L145 HydrophobicContact CD2-CD1 4.34Å; E67-L145 WeakPolarHBondContact OE2-CB 3.46Å; E67-L145 VanDerWaalsContact OE2-CG 3.31Å; E67-L145 WeakPolarHBondContact OE2-CG 3.19Å; E67-L145 PolarHBondContact OE2-N 2.73Å; R95-L145 HydrophobicContact CG-CD1 4.05Å; R95-L145 HydrophobicContact CG-CG 4.47Å; L98-L145 HydrophobicContact CB-CD1 3.57Å; L98-L145 HydrophobicContact CD1-CD1 4.08Å; L98-L145 HydrophobicContact CG-CD1 4.48Å; I104-L145 HydrophobicContact CD1-CB 3.95Å; I104-L145 HydrophobicContact CD1-CD1 4.04Å; I104-L145 HydrophobicContact CD1-CD2 3.69Å; I104-L145 HydrophobicContact CD1-CG 4.08Å; I104-L145 HydrophobicContact CG1-CD2 4.42Å; L145-F147 VanDerWaalsContact C-N 3.26Å; L145-F147 PolarHBondContact O-N 2.81Å; L145-Y148 HydrophobicContact CD2-CD2 4.48Å; L145-Y148 WeakPolarHBondContact O-CB 3.46Å; L145-Y148 PolarHBondContact O-N 3.45Å; L145-Y148 VanDerWaalsContact O-N 3.08Å; L145-I149 WeakPolarHBondContact O-CG1 3.48Å; L145-I149 PolarHBondContact O-N 2.88Å
146	L	89.9	Confident	77.1	Confident	46 Å²	46	75.7 Å²	75.7	24%	0.241	38%	0.377	C	S	.	.	H	α-helix	trans	-54.8	-39.3	174.9	-172.9	58	0	0	0	112.5	L64 Y68 P144 Y148 I149 I150	L64-L146 HydrophobicContact CB-CB 4.44Å; Y68-L146 HydrophobicContact CG-CD2 4.28Å; P144-L146 PolarHBondContact O-N 3.41Å; L146-Y148 VanDerWaalsContact C-N 3.33Å; L146-Y148 PolarHBondContact O-N 3.31Å; L146-I149 PolarHBondContact O-N 3.17Å; L146-I150 HydrophobicContact CD1-CG1 4.29Å; L146-I150 HydrophobicContact CG-CG1 4.45Å; L146-I150 WeakPolarHBondContact O-CG1 3.35Å; L146-I150 PolarHBondContact O-N 3.43Å
147	F	86.4	Confident	78.4	Confident	94 Å²	94	72.9 Å²	72.9	41%	0.412	37%	0.367	S	S	.	.	H	α-helix	trans	-62.2	-39.4	177.7	-84.5	-103.9	0	0	0	112.4	Y68 F71 I143 P144 L145 H151	Y68-F147 HydrophobicContact CD2-CD2 4.33Å; Y68-F147 AromaticContact CD2-CE2 3.61Å; Y68-F147 HydrophobicContact CD2-CE2 3.61Å; Y68-F147 HydrophobicContact CD2-CZ 4.47Å; Y68-F147 AromaticContact CE2-CE2 3.6Å; Y68-F147 HydrophobicContact CE2-CE2 3.6Å; Y68-F147 HydrophobicContact CE2-CZ 4.02Å; F71-F147 HydrophobicContact CD1-CE2 4.48Å; F71-F147 HydrophobicContact CE1-CE2 4.48Å; I143-F147 HydrophobicContact CG2-CB 3.89Å; I143-F147 HydrophobicContact CG2-CD2 4.48Å; I143-F147 HydrophobicContact CG2-CG 4.18Å; P144-F147 HydrophobicContact CB-CD2 4Å; P144-F147 HydrophobicContact CG-CD2 3.98Å; P144-F147 HydrophobicContact CG-CE2 4.11Å; P144-F147 WeakPolarHBondContact O-CB 3.27Å; P144-F147 PolarHBondContact O-N 3.22Å; P144-F147 VanDerWaalsContact O-N 3.1Å; L145-F147 VanDerWaalsContact C-N 3.26Å; L145-F147 PolarHBondContact O-N 2.81Å; F147-H151 VanDerWaalsContact O-CB 3.25Å; F147-H151 WeakPolarHBondContact O-CB 3.35Å; F147-H151 PolarHBondContact O-N 3.22Å
148	Y	85.7	Confident	79.2	Confident	56 Å²	56	71.2 Å²	71.2	22%	0.22	36%	0.362	C	S	.	.	H	α-helix	trans	-67.5	-39.5	179.1	-64.1	-88.1	0	0	0	111.6	V108 I143 P144 L145 L146 Y152	V108-Y148 WeakPolarHBondContact CA-OH 3.31Å; V108-Y148 WeakPolarHBondContact CB-OH 3.37Å; V108-Y148 HydrophobicContact CG2-CE1 3.6Å; V108-Y148 WeakPolarHBondContact CG2-OH 3.3Å; V108-Y148 PolarHBondContact N-OH 3.36Å; V108-Y148 PolarHBondContact O-OH 2.71Å; I143-Y148 HydrophobicContact CB-CE2 3.9Å; I143-Y148 HydrophobicContact CG2-CE2 3.84Å; P144-Y148 WeakPolarHBondContact O-CD2 3.27Å; L145-Y148 HydrophobicContact CD2-CD2 4.48Å; L145-Y148 WeakPolarHBondContact O-CB 3.46Å; L145-Y148 PolarHBondContact O-N 3.45Å; L145-Y148 VanDerWaalsContact O-N 3.08Å; L146-Y148 VanDerWaalsContact C-N 3.33Å; L146-Y148 PolarHBondContact O-N 3.31Å; Y148-Y152 WeakPolarHBondContact O-CB 3.43Å; Y148-Y152 PolarHBondContact O-N 3.36Å
149	I	88.1	Confident	79.8	Confident	39 Å²	39	77.2 Å²	77.2	20%	0.2	40%	0.395	C	S	.	.	H	α-helix	trans	-65.7	-48.2	178.4	-61.9	164.2	0	0	0	109.6	L64 L102 L145 L146 H151 Y152 L153	L64-I149 HydrophobicContact CD1-CD1 3.53Å; L64-I149 HydrophobicContact CD2-CD1 4.2Å; L102-I149 HydrophobicContact CD2-CD1 3.43Å; L102-I149 VanDerWaalsContact CD2-CD1 3.43Å; L102-I149 HydrophobicContact CD2-CG1 4.29Å; L145-I149 WeakPolarHBondContact O-CG1 3.48Å; L145-I149 PolarHBondContact O-N 2.88Å; L146-I149 PolarHBondContact O-N 3.17Å; I149-H151 PolarHBondContact O-N 2.94Å; I149-Y152 WeakPolarHBondContact O-CB 3.41Å; I149-Y152 PolarHBondContact O-N 2.82Å; I149-L153 HydrophobicContact CG2-CD1 4.16Å; I149-L153 HydrophobicContact CG2-CG 4.47Å; I149-L153 VanDerWaalsContact O-CG 3.31Å; I149-L153 WeakPolarHBondContact O-CG 3.47Å; I149-L153 PolarHBondContact O-N 3.05Å
150	I	87.2	Confident	79.9	Confident	83 Å²	83	83.9 Å²	83.9	43%	0.426	42%	0.422	S	S	.	.	H	α-helix	trans	-62.7	-45.9	178	-63.4	-57.8	0	0	0	110.9	L146 Y152 L153 M154	L146-I150 HydrophobicContact CD1-CG1 4.29Å; L146-I150 HydrophobicContact CG-CG1 4.45Å; L146-I150 WeakPolarHBondContact O-CG1 3.35Å; L146-I150 PolarHBondContact O-N 3.43Å; I150-Y152 VanDerWaalsContact C-N 3.3Å; I150-Y152 PolarHBondContact O-N 2.99Å; I150-L153 PolarHBondContact O-N 3.44Å; I150-L153 VanDerWaalsContact O-N 3.17Å; I150-M154 HydrophobicContact CG2-CG 4.25Å; I150-M154 HydrophobicContact CG2-SD 3.91Å; I150-M154 WeakPolarHBondContact O-CB 3.38Å; I150-M154 VanDerWaalsContact O-CG 3.25Å; I150-M154 WeakPolarHBondContact O-CG 3.42Å; I150-M154 PolarHBondContact O-N 3.18Å
151	H	84.4	Confident	79.5	Confident	124 Å²	124	83.1 Å²	83.1	57%	0.574	43%	0.426	S	S	*	.	H	α-helix	trans	-59.3	-41.7	175.6	-178.9	-88.9	0	0	0	112	F147 I149 M154 V155	F147-H151 VanDerWaalsContact O-CB 3.25Å; F147-H151 WeakPolarHBondContact O-CB 3.35Å; F147-H151 PolarHBondContact O-N 3.22Å; I149-H151 PolarHBondContact O-N 2.94Å; H151-M154 PolarHBondContact O-N 3.4Å; H151-V155 WeakPolarHBondContact O-CG2 3.45Å; H151-V155 PolarHBondContact O-N 2.85Å
152	Y	84.9	Confident	78.5	Confident	147 Å²	147	88.7 Å²	88.7	58%	0.576	45%	0.452	S	S	*	.	H	α-helix	trans	-61.8	-44.4	175.3	179.4	-88.4	0	0	0	111.7	Y148 I149 I150 M154 V155 N156	Y148-Y152 WeakPolarHBondContact O-CB 3.43Å; Y148-Y152 PolarHBondContact O-N 3.36Å; I149-Y152 WeakPolarHBondContact O-CB 3.41Å; I149-Y152 PolarHBondContact O-N 2.82Å; I150-Y152 VanDerWaalsContact C-N 3.3Å; I150-Y152 PolarHBondContact O-N 2.99Å; Y152-M154 VanDerWaalsContact C-N 3.34Å; Y152-V155 PolarHBondContact O-N 3.3Å; Y152-N156 WeakPolarHBondContact CD2-ND2 3.35Å; Y152-N156 HydrophobicContact CE1-CB 4.34Å; Y152-N156 WeakPolarHBondContact CE2-ND2 3.5Å; Y152-N156 WeakPolarHBondContact O-CB 3.37Å; Y152-N156 PolarHBondContact O-N 3.13Å; Y152-N156 PolarHBondContact O-ND2 2.65Å
153	L	86.5	Confident	76.9	Confident	59 Å²	59	93.3 Å²	93.3	31%	0.309	47%	0.473	S	S	.	.	H	α-helix	trans	-67.3	-35.1	177.5	-68.2	177.8	0	0	0	112.3	I149 I150 G157 L158	I149-L153 HydrophobicContact CG2-CD1 4.16Å; I149-L153 HydrophobicContact CG2-CG 4.47Å; I149-L153 VanDerWaalsContact O-CG 3.31Å; I149-L153 WeakPolarHBondContact O-CG 3.47Å; I149-L153 PolarHBondContact O-N 3.05Å; I150-L153 PolarHBondContact O-N 3.44Å; I150-L153 VanDerWaalsContact O-N 3.17Å; L153-G157 WeakPolarHBondContact O-CA 3.25Å; L153-G157 PolarHBondContact O-N 3.23Å; L153-L158 HydrophobicContact CD1-CD2 4.38Å; L153-L158 HydrophobicContact CD2-CD2 3.7Å; L153-L158 HydrophobicContact CD2-CG 4.25Å
154	M	83.3	Confident	75.1	Confident	149 Å²	149	99.9 Å²	99.9	73%	0.734	50%	0.504	S	S	*	.	H	α-helix	trans	-66.4	-39.5	175.5	-72.6	176.1	72.5	0	0	112.2	I150 H151 Y152	I150-M154 HydrophobicContact CG2-CG 4.25Å; I150-M154 HydrophobicContact CG2-SD 3.91Å; I150-M154 WeakPolarHBondContact O-CB 3.38Å; I150-M154 VanDerWaalsContact O-CG 3.25Å; I150-M154 WeakPolarHBondContact O-CG 3.42Å; I150-M154 PolarHBondContact O-N 3.18Å; H151-M154 PolarHBondContact O-N 3.4Å; Y152-M154 VanDerWaalsContact C-N 3.34Å
155	V	83.4	Confident	72.9	Confident	101 Å²	101	108.8 Å²	108.8	61%	0.612	55%	0.545	S	S	*	.	H	α-helix	trans	-78.2	-42.2	-179.2	172.7	0	0	0	0	111.9	H151 Y152	H151-V155 WeakPolarHBondContact O-CG2 3.45Å; H151-V155 PolarHBondContact O-N 2.85Å; Y152-V155 PolarHBondContact O-N 3.3Å
156	N	83.5	Confident	70.8	Confident	92 Å²	92	114 Å²	114	49%	0.492	57%	0.573	S	S	.	*	H	α-helix	trans	-91	-15.6	-175.2	-61.3	-67.1	0	0	0	113.6	Y152	Y152-N156 WeakPolarHBondContact CD2-ND2 3.35Å; Y152-N156 HydrophobicContact CE1-CB 4.34Å; Y152-N156 WeakPolarHBondContact CE2-ND2 3.5Å; Y152-N156 WeakPolarHBondContact O-CB 3.37Å; Y152-N156 PolarHBondContact O-N 3.13Å; Y152-N156 PolarHBondContact O-ND2 2.65Å
157	G	75.7	Confident	68.2	Low	41 Å²	41	116.8 Å²	116.8	42%	0.423	59%	0.594	S	S	.	*			trans	73	161.8	-173.7	0	0	0	0	0	113.5	L153	L153-G157 WeakPolarHBondContact O-CA 3.25Å; L153-G157 PolarHBondContact O-N 3.23Å
158	L	67.5	Low	65.7	Low	112 Å²	112	119.5 Å²	119.5	59%	0.586	61%	0.613	S	S	*	*	S	Bend	trans	-99.1	-3.4	175.1	-82.9	168.2	0	0	0	113.6	L153 K160 V161	L153-L158 HydrophobicContact CD1-CD2 4.38Å; L153-L158 HydrophobicContact CD2-CD2 3.7Å; L153-L158 HydrophobicContact CD2-CG 4.25Å; L158-K160 PolarHBondContact O-N 2.9Å; L158-V161 HydrophobicContact CD2-CG2 4.38Å; L158-V161 PolarHBondContact O-N 3Å; L158-V161 VanDerWaalsContact O-N 3.12Å
159	D	64	Low	63.5	Low	166 Å²	166	126 Å²	126	89%	0.888	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.3	1.4	-163.5	-153.8	28.1	0	0	0	114.9
160	K	57.1	Low	60.9	Low	191 Å²	191	131.3 Å²	131.3	83%	0.83	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.1	2.4	-179.9	-64.8	-169.8	179.5	-176.3	0	115.1	L158 H162	L158-K160 PolarHBondContact O-N 2.9Å; K160-H162 PolarHBondContact O-N 3.43Å
161	V	52.6	Low	58.2	Low	120 Å²	120	136.9 Å²	136.9	73%	0.727	69%	0.693	S	S	*	*			trans	-83.6	92.8	177.2	-172.1	0	0	0	0	109	L158 N163	L158-V161 HydrophobicContact CD2-CG2 4.38Å; L158-V161 PolarHBondContact O-N 3Å; L158-V161 VanDerWaalsContact O-N 3.12Å; V161-N163 PolarHBondContact O-N 2.87Å
162	H	49.5	Very low	55.8	Low	168 Å²	168	136.1 Å²	136.1	78%	0.778	70%	0.699	S	S	*	*			trans	-41.4	133.7	167.7	-73.4	-63.5	0	0	0	111	K160 H164	K160-H162 PolarHBondContact O-N 3.43Å; H162-H164 PolarHBondContact O-N 3.49Å
163	N	46.2	Very low	53.2	Low	158 Å²	158	135.8 Å²	135.8	85%	0.845	71%	0.712	S	S	*	*			trans	-37.8	111.6	163.6	-63.4	-65.9	0	0	0	108.1	V161 E165	V161-N163 PolarHBondContact O-N 2.87Å; N163-E165 VanDerWaalsContact C-N 3.31Å; N163-E165 PolarHBondContact O-N 3.36Å
164	H	45.6	Very low	50.7	Low	151 Å²	151	140.2 Å²	140.2	70%	0.699	73%	0.732	S	S	*	*			trans	-63.7	103.6	176.6	-154.9	-47.5	0	0	0	106	H162 L166	H162-H164 PolarHBondContact O-N 3.49Å; H164-L166 WeakPolarHBondContact CE1-CD1 3.28Å; H164-L166 WeakPolarHBondContact CE1-CG 3.28Å; H164-L166 WeakPolarHBondContact ND1-CB 3.27Å; H164-L166 WeakPolarHBondContact ND1-CD1 3.4Å; H164-L166 WeakPolarHBondContact ND1-CG 2.92Å; H164-L166 PolarHBondContact O-N 3.3Å
165	E	40.9	Very low	48	Very low	187 Å²	187	142.1 Å²	142.1	87%	0.874	74%	0.739	S	S	*	*			trans	-69.5	42.6	175.2	-157.5	175.2	-172.6	0	0	110.3	N163	N163-E165 VanDerWaalsContact C-N 3.31Å; N163-E165 PolarHBondContact O-N 3.36Å
166	L	43.7	Very low	45.5	Very low	111 Å²	111	144.9 Å²	144.9	58%	0.581	75%	0.745	S	S	*	*			trans	-112.2	48.5	169.1	-74.5	-175.6	0	0	0	109.8	H164	H164-L166 WeakPolarHBondContact CE1-CD1 3.28Å; H164-L166 WeakPolarHBondContact CE1-CG 3.28Å; H164-L166 WeakPolarHBondContact ND1-CB 3.27Å; H164-L166 WeakPolarHBondContact ND1-CD1 3.4Å; H164-L166 WeakPolarHBondContact ND1-CG 2.92Å; H164-L166 PolarHBondContact O-N 3.3Å
167	C	37.2	Very low	43	Very low	103 Å²	103	149.9 Å²	149.9	70%	0.696	76%	0.762	S	S	*	*	S	Bend	trans	-154.3	92.2	158.8	-171	0	0	0	0	106
168	N	32.9	Very low	40.7	Very low	151 Å²	151	153.7 Å²	153.7	81%	0.807	78%	0.782	S	S	*	*			trans	155.3	72.8	159.6	-74.5	-17.5	0	0	0	108.3
169	K	38.7	Very low	39	Very low	192 Å²	192	156 Å²	156	84%	0.835	79%	0.793	S	S	*	*			trans	-108.2	93.5	154.2	-76.8	-172.8	179.1	175.7	0	106.4	F171	K169-F171 PolarHBondContact O-N 3.21Å
170	D	33.7	Very low	37.4	Very low	152 Å²	152	153.5 Å²	153.5	81%	0.813	79%	0.786	S	S	*	*			trans	13.1	93.5	154.8	-52.6	-52.2	0	0	0	114.9	P172	D170-P172 WeakPolarHBondContact O-CD 3.44Å
171	F	31.4	Very low	35.9	Very low	200 Å²	200	151.8 Å²	151.8	88%	0.877	79%	0.786	S	S	*	*			trans	-67.7	120.6	157.9	-78.6	-84.1	0	0	0	107.3	K169 T173	K169-F171 PolarHBondContact O-N 3.21Å; F171-T173 PolarHBondContact O-N 3.47Å; F171-T173 VanDerWaalsContact O-N 3.13Å
172	P	33.4	Very low	34.8	Very low	108 Å²	108	153.6 Å²	153.6	70%	0.701	79%	0.792	S	S	*	*			trans	-64	120	174.3	25.7	-30.9	0	0	0	108.1	D170 Q174	D170-P172 WeakPolarHBondContact O-CD 3.44Å; P172-Q174 VanDerWaalsContact C-N 3.26Å; P172-Q174 PolarHBondContact O-N 3.08Å
173	T	30.8	Very low	33.8	Very low	139 Å²	139	156.2 Å²	156.2	85%	0.853	80%	0.795	S	S	*	*			trans	-53.8	88.2	165.7	20.1	0	0	0	0	109.3	F171 E175	F171-T173 PolarHBondContact O-N 3.47Å; F171-T173 VanDerWaalsContact O-N 3.13Å; T173-E175 PolarHBondContact O-N 2.87Å
174	Q	33.7	Very low	32.9	Very low	153 Å²	153	153.9 Å²	153.9	72%	0.715	79%	0.788	S	S	*	*			trans	-82.2	101.1	161.4	-85.6	-170.2	-7.4	0	0	107.7	P172 H176	P172-Q174 VanDerWaalsContact C-N 3.26Å; P172-Q174 PolarHBondContact O-N 3.08Å; Q174-H176 VanDerWaalsContact C-N 3.32Å; Q174-H176 PolarHBondContact O-N 3.45Å
175	E	25.7	Very low	32.2	Very low	188 Å²	188	153.4 Å²	153.4	88%	0.879	79%	0.789	S	S	*	*			trans	-50.9	91.9	163.2	-68.4	179.5	141.1	0	0	110.2	T173 K177	T173-E175 PolarHBondContact O-N 2.87Å; E175-K177 PolarHBondContact O-N 2.99Å
176	H	32.2	Very low	31.6	Very low	160 Å²	160	151 Å²	151	74%	0.741	78%	0.783	S	S	*	*			trans	-79.9	102.5	164.2	-82	-82.3	0	0	0	108.6	Q174 S178	Q174-H176 VanDerWaalsContact C-N 3.32Å; Q174-H176 PolarHBondContact O-N 3.45Å; H176-S178 PolarHBondContact O-N 3.21Å
177	K	31.2	Very low	31.1	Very low	197 Å²	197	152.3 Å²	152.3	86%	0.857	79%	0.79	S	S	*	*			trans	-35.4	122	169.3	-75.6	172.9	174.6	174.8	0	112.1	E175 I179	E175-K177 PolarHBondContact O-N 2.99Å; K177-I179 PolarHBondContact O-N 3.43Å
178	S	27.2	Very low	30.7	Very low	121 Å²	121	156.6 Å²	156.6	85%	0.846	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-48.4	118.9	171.3	-36.5	0	0	0	0	111.9	H176	H176-S178 PolarHBondContact O-N 3.21Å
179	I	32.1	Very low	31.1	Very low	159 Å²	159	155.7 Å²	155.7	82%	0.815	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-99.6	126.7	158	-63.8	179.8	0	0	0	106.1	K177	K177-I179 PolarHBondContact O-N 3.43Å
180	P	29.6	Very low	31	Very low	115 Å²	115	153.7 Å²	153.7	75%	0.747	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-75.6	133.4	-164.9	30.6	-34.4	0	0	0	111.5	N182	P180-N182 PolarHBondContact O-N 2.97Å
181	N	25.6	Very low	31.4	Very low	154 Å²	154	156.3 Å²	156.3	82%	0.824	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-56.7	120.2	161.9	-69	-32	0	0	0	109.2
182	N	29.3	Very low	31.5	Very low	159 Å²	159	154.2 Å²	154.2	85%	0.85	80%	0.796	S	S	*	*			trans	-174	90.7	150	-97.8	-4.5	0	0	0	111.1	P180	P180-N182 PolarHBondContact O-N 2.97Å
183	R	28.1	Very low	31.8	Very low	223 Å²	223	154.2 Å²	154.2	84%	0.842	80%	0.799	S	S	*	*				-171	119.8	124.8	-123.6	174.9	-176.7	164.7	1	111.5
184	P	28.1	Very low	32.2	Very low	109 Å²	109	152.8 Å²	152.8	71%	0.708	79%	0.79	S	S	*	*			trans	-81.3	125	164.1	31.9	-26	0	0	0	108.2
185	I	30.6	Very low	32.4	Very low	140 Å²	140	153.3 Å²	153.3	72%	0.718	80%	0.797	S	S	*	*			trans	-120.9	102.7	160	-61	178.5	0	0	0	105.4	N187	I185-N187 PolarHBondContact O-N 3.45Å
186	N	27.9	Very low	33.1	Very low	138 Å²	138	148.6 Å²	148.6	74%	0.738	78%	0.781	S	S	*	*			trans	-55.1	127.2	165.9	-53.2	-37.7	0	0	0	108
187	N	33	Very low	33.3	Very low	138 Å²	138	147.8 Å²	147.8	74%	0.738	78%	0.781	S	S	*	*			trans	-153	81.8	148.5	-80.3	-27.5	0	0	0	104.7	I185 D189	I185-N187 PolarHBondContact O-N 3.45Å; N187-D189 PolarHBondContact O-N 3.29Å
188	E	30.2	Very low	33.5	Very low	193 Å²	193	145 Å²	145	90%	0.902	77%	0.771	S	S	*	*			trans	-68.7	97.5	159	-71.9	-162.3	153.4	0	0	107
189	D	39.8	Very low	33.7	Very low	132 Å²	132	145.1 Å²	145.1	71%	0.706	76%	0.762	S	S	*	*			trans	-130.8	97.8	163.8	-74.6	-44.6	0	0	0	108.2	N187 F191	N187-D189 PolarHBondContact O-N 3.29Å; D189-F191 PolarHBondContact O-N 2.89Å
190	D	38.2	Very low	33.8	Very low	149 Å²	149	144.9 Å²	144.9	80%	0.797	76%	0.757	S	S	*	*			trans	56.1	41.2	146.6	-78.8	-21	0	0	0	120.2	N192	D190-N192 PolarHBondContact O-N 3.11Å
191	F	40.7	Very low	34	Very low	207 Å²	207	145.4 Å²	145.4	91%	0.908	75%	0.754	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.4	20.7	164.9	-118.6	-81.4	0	0	0	114.7	D189	D189-F191 PolarHBondContact O-N 2.89Å
192	N	33.4	Very low	34.1	Very low	156 Å²	156	142.3 Å²	142.3	83%	0.834	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.1	22.3	177.5	-82.6	-20.2	0	0	0	114.2	D190 T194	D190-N192 PolarHBondContact O-N 3.11Å; N192-T194 PolarHBondContact O-N 2.94Å
193	S	40.3	Very low	34.1	Very low	109 Å²	109	141.4 Å²	141.4	76%	0.762	74%	0.738	S	S	*	*	S	Bend	trans	-72.5	80.4	157.4	-84	0	0	0	0	109.6	L195	S193-L195 PolarHBondContact O-N 3.12Å
194	T	38.8	Very low	34.4	Very low	108 Å²	108	138.3 Å²	138.3	66%	0.663	73%	0.734	S	S	*	*			trans	44.5	75.3	133.4	-53	0	0	0	0	113.3	N192 V196	N192-T194 PolarHBondContact O-N 2.94Å; T194-V196 HydrophobicContact CG2-CB 3.83Å; T194-V196 HydrophobicContact CG2-CG2 3.15Å; T194-V196 PolarHBondContact O-N 2.75Å
195	L	38.6	Very low	34.5	Very low	164 Å²	164	139.6 Å²	139.6	86%	0.859	73%	0.734	S	S	*	*			trans	-62.1	64.5	150.3	-82	164.2	0	0	0	108.7	S193 L197	S193-L195 PolarHBondContact O-N 3.12Å; L195-L197 PolarHBondContact O-N 3.27Å; L195-L197 VanDerWaalsContact O-N 3.09Å
196	V	39.3	Very low	34.5	Very low	89 Å²	89	138 Å²	138	54%	0.539	73%	0.731	S	S	.	*			trans	-78.6	92.1	158.5	173	0	0	0	0	104.3	T194 H198	T194-V196 HydrophobicContact CG2-CB 3.83Å; T194-V196 HydrophobicContact CG2-CG2 3.15Å; T194-V196 PolarHBondContact O-N 2.75Å; V196-H198 VanDerWaalsContact CG1-CE1 3.46Å; V196-H198 WeakPolarHBondContact CG1-CE1 3.28Å; V196-H198 WeakPolarHBondContact CG1-ND1 3.37Å; V196-H198 PolarHBondContact O-N 2.9Å
197	L	37.8	Very low	34.6	Very low	144 Å²	144	140.6 Å²	140.6	75%	0.754	74%	0.739	S	S	*	*			trans	-55	86.4	155.5	-84.7	112.2	0	0	0	107.5	L195 N199	L195-L197 PolarHBondContact O-N 3.27Å; L195-L197 VanDerWaalsContact O-N 3.09Å; L197-N199 PolarHBondContact O-N 3.27Å
198	H	34.2	Very low	34.6	Very low	139 Å²	139	142.5 Å²	142.5	64%	0.644	74%	0.741	S	S	*	*			trans	-69	94.5	154.8	-91.4	91.6	0	0	0	105.8	V196 H200	V196-H198 VanDerWaalsContact CG1-CE1 3.46Å; V196-H198 WeakPolarHBondContact CG1-CE1 3.28Å; V196-H198 WeakPolarHBondContact CG1-ND1 3.37Å; V196-H198 PolarHBondContact O-N 2.9Å; H198-H200 AromaticContact CD2-NE2 3.84Å; H198-H200 PolarHBondContact O-N 3.42Å
199	N	32.2	Very low	34.6	Very low	123 Å²	123	141.5 Å²	141.5	66%	0.658	74%	0.735	S	S	*	*			trans	-65.5	68.6	173.3	-160.1	19.5	0	0	0	108.9	L197 N201	L197-N199 PolarHBondContact O-N 3.27Å; N199-N201 PolarHBondContact O-N 2.9Å; N199-N201 VanDerWaalsContact O-N 3.11Å
200	H	34.4	Very low	34.2	Very low	154 Å²	154	141 Å²	141	71%	0.713	74%	0.737	S	S	*	*			trans	-82.5	81.7	166.4	-73.4	-63.1	0	0	0	107.6	H198 S202	H198-H200 AromaticContact CD2-NE2 3.84Å; H198-H200 PolarHBondContact O-N 3.42Å; H200-S202 PolarHBondContact O-N 3.45Å
201	N	32.6	Very low	33.9	Very low	126 Å²	126	139.2 Å²	139.2	67%	0.674	73%	0.727	S	S	*	*			trans	-63.8	68.6	153.7	-72.8	-32.3	0	0	0	108.5	N199	N199-N201 PolarHBondContact O-N 2.9Å; N199-N201 VanDerWaalsContact O-N 3.11Å
202	S	28.4	Very low	33.5	Very low	88 Å²	88	136.6 Å²	136.6	62%	0.615	72%	0.722	S	S	*	*			trans	-98.3	85.2	161.3	-168.1	0	0	0	0	105.7	H200 Q204	H200-S202 PolarHBondContact O-N 3.45Å; S202-Q204 PolarHBondContact O-N 3.44Å
203	L	30.2	Very low	33.8	Very low	140 Å²	140	136.5 Å²	136.5	73%	0.733	72%	0.717	S	S	*	*			trans	-58.6	90.2	160	-90.5	86.5	0	0	0	106.4	N205	L203-N205 PolarHBondContact O-N 2.84Å
204	Q	34.2	Very low	33.5	Very low	159 Å²	159	139.8 Å²	139.8	74%	0.743	72%	0.72	S	S	*	*			trans	-67.9	97.8	155.3	-68.5	-163.4	8.1	0	0	105.4	S202 T206	S202-Q204 PolarHBondContact O-N 3.44Å; Q204-T206 PolarHBondContact O-N 3.35Å
205	N	29.2	Very low	33.3	Very low	136 Å²	136	141.7 Å²	141.7	73%	0.727	72%	0.724	S	S	*	*			trans	-52.9	82.7	159.5	-72.3	-24.4	0	0	0	107.2	L203 Q207	L203-N205 PolarHBondContact O-N 2.84Å; N205-Q207 VanDerWaalsContact C-N 3.29Å; N205-Q207 PolarHBondContact O-N 3.41Å
206	T	30.3	Very low	33	Very low	105 Å²	105	140 Å²	140	64%	0.644	72%	0.716	S	S	*	*			trans	-69.4	101.7	164.6	47.4	0	0	0	0	104.8	Q204 K208	Q204-T206 PolarHBondContact O-N 3.35Å; T206-K208 PolarHBondContact O-N 2.76Å
207	Q	30.9	Very low	32.9	Very low	193 Å²	193	142.9 Å²	142.9	90%	0.902	73%	0.726	S	S	*	*			trans	-55	78.7	161.5	-83.1	158.7	-53.6	0	0	107.4	N205 H209	N205-Q207 VanDerWaalsContact C-N 3.29Å; N205-Q207 PolarHBondContact O-N 3.41Å; Q207-H209 PolarHBondContact O-N 3.31Å
208	K	32.9	Very low	32.8	Very low	179 Å²	179	143.5 Å²	143.5	78%	0.778	73%	0.725	S	S	*	*			trans	-68.9	98.5	160.3	-86.9	-175.5	175.7	179.4	0	104.9	T206 V210	T206-K208 PolarHBondContact O-N 2.76Å; K208-V210 PolarHBondContact O-N 3.04Å
209	H	30	Very low	32.9	Very low	171 Å²	171	145.3 Å²	145.3	79%	0.792	73%	0.734	S	S	*	*			trans	-42	83.8	162.4	-176.1	-89.6	0	0	0	109.7	Q207 N211	Q207-H209 PolarHBondContact O-N 3.31Å; H209-N211 PolarHBondContact O-N 2.95Å; H209-N211 VanDerWaalsContact O-N 3.13Å
210	V	30.8	Very low	33.1	Very low	121 Å²	121	144.9 Å²	144.9	73%	0.733	74%	0.738	S	S	*	*			trans	-74.1	103.4	168.6	178.7	0	0	0	0	104.9	K208 L212	K208-V210 PolarHBondContact O-N 3.04Å; V210-L212 PolarHBondContact O-N 2.95Å
211	N	32.3	Very low	33.4	Very low	112 Å²	112	143.7 Å²	143.7	60%	0.599	74%	0.741	S	S	*	*			trans	-56.2	101.8	170.1	-170.6	2.7	0	0	0	107.4	H209 E213	H209-N211 PolarHBondContact O-N 2.95Å; H209-N211 VanDerWaalsContact O-N 3.13Å; N211-E213 PolarHBondContact O-N 3.48Å
212	L	32.5	Very low	33.6	Very low	153 Å²	153	145 Å²	145	80%	0.801	75%	0.748	S	S	*	*			trans	-68.5	83.8	169.5	-86.7	153.9	0	0	0	106.4	V210 H214	V210-L212 PolarHBondContact O-N 2.95Å; L212-H214 PolarHBondContact O-N 3.45Å; L212-H214 VanDerWaalsContact O-N 3.17Å
213	E	39.7	Very low	34.1	Very low	154 Å²	154	147.7 Å²	147.7	72%	0.72	76%	0.756	S	S	*	*			trans	-49.8	122.3	162.8	-79.2	-102.3	143	0	0	107.4	N211 I215	N211-E213 PolarHBondContact O-N 3.48Å; E213-I215 PolarHBondContact O-N 3.35Å
214	H	35.1	Very low	34.7	Very low	177 Å²	177	146.2 Å²	146.2	82%	0.819	75%	0.753	S	S	*	*			trans	-51.8	95	-180	-77.8	-113.4	0	0	0	110.6	L212 L216	L212-H214 PolarHBondContact O-N 3.45Å; L212-H214 VanDerWaalsContact O-N 3.17Å; H214-L216 VanDerWaalsContact C-N 3.28Å; H214-L216 PolarHBondContact O-N 2.94Å
215	I	34	Very low	34.9	Very low	148 Å²	148	145 Å²	145	76%	0.759	75%	0.752	S	S	*	*			trans	-74	94.5	163.8	-62.9	172.5	0	0	0	105.4	E213 I217	E213-I215 PolarHBondContact O-N 3.35Å; I215-I217 VanDerWaalsContact C-N 3.28Å; I215-I217 HydrophobicContact CG2-CG1 4.02Å; I215-I217 PolarHBondContact O-N 2.9Å
216	L	32.8	Very low	35.3	Very low	130 Å²	130	149 Å²	149	68%	0.681	76%	0.756	S	S	*	*			trans	-65.5	89.3	172.3	-148.8	88.7	0	0	0	107.5	H214 H218	H214-L216 VanDerWaalsContact C-N 3.28Å; H214-L216 PolarHBondContact O-N 2.94Å; L216-H218 PolarHBondContact O-N 3.03Å
217	I	37.5	Very low	35.6	Very low	149 Å²	149	150.4 Å²	150.4	76%	0.764	76%	0.757	S	S	*	*			trans	-72.1	100	171.4	-57.4	176.1	0	0	0	105.7	I215 E219	I215-I217 VanDerWaalsContact C-N 3.28Å; I215-I217 HydrophobicContact CG2-CG1 4.02Å; I215-I217 PolarHBondContact O-N 2.9Å; I217-E219 PolarHBondContact O-N 3.04Å
218	H	35.2	Very low	36	Very low	156 Å²	156	148.4 Å²	148.4	72%	0.722	75%	0.753	S	S	*	*			trans	-53	123.8	169.5	-84.7	-92.7	0	0	0	108.9	L216	L216-H218 PolarHBondContact O-N 3.03Å
219	E	35.9	Very low	36.5	Very low	178 Å²	178	145.4 Å²	145.4	83%	0.832	76%	0.755	S	S	*	*			trans	-56.8	135.6	169.6	-88.5	-161.7	150.2	0	0	109.7	I217 T221	I217-E219 PolarHBondContact O-N 3.04Å; E219-T221 PolarHBondContact O-N 2.92Å
220	P	37.2	Very low	36.9	Very low	114 Å²	114	145.6 Å²	145.6	74%	0.74	76%	0.756	S	S	*	*			trans	-72	114.8	175.3	7.6	6.6	0	0	0	108.3	D222	P220-D222 PolarHBondContact O-N 3.13Å
221	T	38.8	Very low	37.5	Very low	129 Å²	129	144.3 Å²	144.3	79%	0.791	75%	0.752	S	S	*	*			trans	-68.7	103.8	166.9	50.1	0	0	0	0	108.6	E219 N223	E219-T221 PolarHBondContact O-N 2.92Å; T221-N223 PolarHBondContact O-N 3Å
222	D	37	Very low	38.1	Very low	152 Å²	152	147.4 Å²	147.4	81%	0.813	77%	0.769	S	S	*	*			trans	-53.6	117.9	163.3	-73	-40.4	0	0	0	109.8	P220	P220-D222 PolarHBondContact O-N 3.13Å
223	N	40	Very low	38.3	Very low	145 Å²	145	147.4 Å²	147.4	78%	0.775	77%	0.769	S	S	*	*			trans	150.1	50.4	145.6	64	6.7	0	0	0	116.2	T221	T221-N223 PolarHBondContact O-N 3Å
224	T	43	Very low	38.5	Very low	109 Å²	109	154.6 Å²	154.6	67%	0.669	79%	0.791	S	S	*	*			trans	-104.2	78.2	158.3	-32.6	0	0	0	0	109.9	W226	T224-W226 HydrophobicContact CG2-CG 4.35Å; T224-W226 HydrophobicContact CG2-CZ2 4.48Å; T224-W226 PolarHBondContact O-N 3.03Å
225	N	36.9	Very low	38.7	Very low	135 Å²	135	153.5 Å²	153.5	72%	0.722	79%	0.79	S	S	*	*			trans	-64.3	85.3	165.2	-151.1	8.3	0	0	0	107.1	M227	N225-M227 PolarHBondContact O-N 3.03Å
226	W	39.3	Very low	38.9	Very low	219 Å²	219	153.7 Å²	153.7	83%	0.83	79%	0.792	S	S	*	*			trans	-71.5	76.9	166.7	-73.4	91.8	0	0	0	107.3	T224 N228	T224-W226 HydrophobicContact CG2-CG 4.35Å; T224-W226 HydrophobicContact CG2-CZ2 4.48Å; T224-W226 PolarHBondContact O-N 3.03Å; W226-N228 PolarHBondContact O-N 3.44Å
227	M	35.8	Very low	39.3	Very low	134 Å²	134	155.1 Å²	155.1	66%	0.66	80%	0.798	S	S	*	*			trans	-54	118.1	161	-83.5	-90.4	108	0	0	107.4	N225 S229	N225-M227 PolarHBondContact O-N 3.03Å; M227-S229 PolarHBondContact O-N 3.15Å
228	N	38.5	Very low	39.4	Very low	151 Å²	151	155.4 Å²	155.4	81%	0.807	80%	0.8	S	S	*	*			trans	-45	107.8	163	-54.1	-49.9	0	0	0	108.7	W226	W226-N228 PolarHBondContact O-N 3.44Å
229	S	44.4	Very low	39.6	Very low	117 Å²	117	155.4 Å²	155.4	82%	0.818	80%	0.804	S	S	*	*			trans	-110	104.2	159.5	-67.4	0	0	0	0	106.1	M227	M227-S229 PolarHBondContact O-N 3.15Å
230	E	39	Very low	39.9	Very low	174 Å²	174	153.9 Å²	153.9	81%	0.813	80%	0.803	S	S	*	*			trans	-54.5	156.3	169.3	-63.9	164.3	127.6	0	0	111.2
231	S	43.5	Very low	40	Very low	94 Å²	94	156.7 Å²	156.7	66%	0.657	81%	0.807	S	S	*	*			trans	73.5	82.9	148.4	-52.5	0	0	0	0	117.7
232	D	45.1	Very low	40.1	Very low	178 Å²	178	158.8 Å²	158.8	95%	0.952	81%	0.808	S	S	*	*			trans	-110.6	79.7	137.5	-76.9	-37	0	0	0	108.2
233	L	36.7	Very low	40.4	Very low	152 Å²	152	159.4 Å²	159.4	80%	0.796	81%	0.808	S	S	*	*			trans	-82.3	95.1	160.3	-114.6	148.8	0	0	0	106.1
234	Y	42.8	Very low	40.5	Very low	305 Å²	305	160.7 Å²	160.7	100%	1.196	81%	0.811	S	S	*	*			trans	-160	0	153.3	-96.5	-69.1	0	0	0	110.8

Retrieved 234 of 234 residues in 40.1 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).