G4VQN9_SCHMA Loading...

Cir_N domain-containing protein

AlphaFold DB , UniProt , Accession G4VQN9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 339 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	81.3	Confident	89.6	Confident	233 Å²	233	125 Å²	125	100%	1.148	59%	0.591	S	S	*	*				0	118.9	0	-78.6	-75.6	-171.4	0	0	109	I3	M1-I3 PolarHBondContact O-N 2.93Å
2	N	84.7	Confident	89.8	Confident	111 Å²	111	125.3 Å²	125.3	59%	0.594	60%	0.597	S	S	*	*			trans	-74.3	111.3	176.2	-173	-8	0	0	0	110	L4 P5	N2-L4 VanDerWaalsContact OD1-CB 3.25Å; N2-L4 WeakPolarHBondContact OD1-CB 3.43Å; N2-L4 WeakPolarHBondContact OD1-CD1 3.42Å; N2-L4 PolarHBondContact OD1-N 3Å; N2-P5 WeakPolarHBondContact OD1-CD 3.4Å
3	I	89.2	Confident	90	Very high	106 Å²	106	120.1 Å²	120.1	54%	0.544	57%	0.571	S	S	.	*			trans	-89.3	-9.1	-179.6	61.2	168.9	0	0	0	113.3	M1 K6	M1-I3 PolarHBondContact O-N 2.93Å; I3-K6 PolarHBondContact O-N 3.43Å
4	L	87.3	Confident	90.2	Very high	68 Å²	68	124.6 Å²	124.6	36%	0.356	59%	0.587	S	S	.	*	G	3₁₀ helix	trans	-62	-42	-175.5	-74.5	139	0	0	0	113.4	N2 K6 K7 W9 H10	N2-L4 VanDerWaalsContact OD1-CB 3.25Å; N2-L4 WeakPolarHBondContact OD1-CB 3.43Å; N2-L4 WeakPolarHBondContact OD1-CD1 3.42Å; N2-L4 PolarHBondContact OD1-N 3Å; L4-K6 PolarHBondContact O-N 2.7Å; L4-K7 WeakPolarHBondContact O-CB 3.45Å; L4-K7 PolarHBondContact O-N 3.37Å; L4-W9 HydrophobicContact CD2-CH2 3.5Å; L4-W9 VanDerWaalsContact CD2-CH2 3.5Å; L4-W9 HydrophobicContact CD2-CZ2 4.48Å; L4-W9 HydrophobicContact CD2-CZ3 3.83Å; L4-H10 VanDerWaalsContact O-CB 3.25Å; L4-H10 WeakPolarHBondContact O-CB 3.33Å
5	P	89.9	Confident	90.4	Very high	71 Å²	71	123.8 Å²	123.8	46%	0.461	58%	0.583	S	S	.	*	G	3₁₀ helix	trans	-59.5	-21.4	178.5	-26.5	35.9	0	0	0	114.7	N2	N2-P5 WeakPolarHBondContact OD1-CD 3.4Å
6	K	89.9	Confident	90.5	Very high	190 Å²	190	117.1 Å²	117.1	83%	0.826	55%	0.552	S	S	*	*	G	3₁₀ helix	trans	-85.7	-9.9	177.4	-61.4	-176.1	178.1	-176.8	0	113.2	I3 L4	I3-K6 PolarHBondContact O-N 3.43Å; L4-K6 PolarHBondContact O-N 2.7Å
7	K	92.9	Very high	90.7	Very high	89 Å²	89	113.4 Å²	113.4	39%	0.387	54%	0.536	S	S	.	.	S	Bend	trans	-87.1	130.1	179.9	-57.7	-61.7	-176.5	177.6	0	109.9	L4 W9 H10	L4-K7 WeakPolarHBondContact O-CB 3.45Å; L4-K7 PolarHBondContact O-N 3.37Å; K7-W9 HydrophobicContact CB-CD2 4.09Å; K7-W9 HydrophobicContact CB-CG 4.35Å; K7-W9 HydrophobicContact CB-CZ2 3.98Å; K7-W9 HydrophobicContact CG-CZ2 3.86Å; K7-W9 PolarHBondContact O-N 3.19Å; K7-W9 VanDerWaalsContact O-N 3.17Å; K7-H10 WeakPolarHBondContact O-CB 3.35Å; K7-H10 PolarHBondContact O-N 3.17Å; K7-H10 VanDerWaalsContact O-N 3.14Å
8	R	91.3	Very high	90.8	Very high	210 Å²	210	109.7 Å²	109.7	79%	0.792	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-25.9	179.4	69.6	179.4	114	86	-3.4	114.6	N16	R8-N16 PolarHBondContact O-ND2 2.89Å
9	W	92.5	Very high	91	Very high	161 Å²	161	111.7 Å²	111.7	61%	0.61	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-1.7	-178.5	54	-104.8	0	0	0	113.7	L4 K7 V11	L4-W9 HydrophobicContact CD2-CH2 3.5Å; L4-W9 VanDerWaalsContact CD2-CH2 3.5Å; L4-W9 HydrophobicContact CD2-CZ2 4.48Å; L4-W9 HydrophobicContact CD2-CZ3 3.83Å; K7-W9 HydrophobicContact CB-CD2 4.09Å; K7-W9 HydrophobicContact CB-CG 4.35Å; K7-W9 HydrophobicContact CB-CZ2 3.98Å; K7-W9 HydrophobicContact CG-CZ2 3.86Å; K7-W9 PolarHBondContact O-N 3.19Å; K7-W9 VanDerWaalsContact O-N 3.17Å; W9-V11 PolarHBondContact O-N 3.36Å
10	H	94.2	Very high	91.2	Very high	30 Å²	30	109.6 Å²	109.6	14%	0.139	52%	0.524	C	S	.	.			trans	-69.8	117.2	-174.1	-175.6	46.8	0	0	0	111.9	L4 K7 L12 K13 N16	L4-H10 VanDerWaalsContact O-CB 3.25Å; L4-H10 WeakPolarHBondContact O-CB 3.33Å; K7-H10 WeakPolarHBondContact O-CB 3.35Å; K7-H10 PolarHBondContact O-N 3.17Å; K7-H10 VanDerWaalsContact O-N 3.14Å; H10-L12 PolarHBondContact O-N 2.99Å; H10-K13 HydrophobicContact CB-CB 4.47Å; H10-K13 VanDerWaalsContact O-CB 3.23Å; H10-K13 WeakPolarHBondContact O-CB 3.26Å; H10-K13 PolarHBondContact O-N 3.34Å; H10-N16 PolarHBondContact O-ND2 2.95Å
11	V	92.5	Very high	91.4	Very high	106 Å²	106	112 Å²	112	64%	0.642	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-36.2	-174.2	-176.7	0	0	0	0	112.6	W9 K13 I17	W9-V11 PolarHBondContact O-N 3.36Å; V11-K13 VanDerWaalsContact C-N 3.29Å; V11-K13 PolarHBondContact O-N 3.05Å; V11-I17 WeakPolarHBondContact O-CG1 3.47Å
12	L	91.6	Very high	91.9	Very high	128 Å²	128	104.1 Å²	104.1	67%	0.67	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-0.7	-178.8	-54.8	176	0	0	0	113.9	H10 K14	H10-L12 PolarHBondContact O-N 2.99Å; L12-K14 PolarHBondContact O-N 3.22Å
13	K	92.7	Very high	92.5	Very high	58 Å²	58	102.9 Å²	102.9	25%	0.252	49%	0.488	S	S	.	.	S	Bend	trans	-64.8	131.3	173.2	-164.6	-175.3	-177.3	-155.4	0	108.4	H10 V11 E15 N16 I17	H10-K13 HydrophobicContact CB-CB 4.47Å; H10-K13 VanDerWaalsContact O-CB 3.23Å; H10-K13 WeakPolarHBondContact O-CB 3.26Å; H10-K13 PolarHBondContact O-N 3.34Å; V11-K13 VanDerWaalsContact C-N 3.29Å; V11-K13 PolarHBondContact O-N 3.05Å; K13-E15 WeakPolarHBondContact CE-OE1 3.32Å; K13-E15 WeakPolarHBondContact CE-OE2 3.47Å; K13-E15 IonicContact NZ-OE1 3.41Å; K13-E15 PolarHBondContact NZ-OE1 3.47Å; K13-E15 IonicContact NZ-OE2 3.41Å; K13-E15 PolarHBondContact NZ-OE2 3.38Å; K13-E15 PolarHBondContact O-N 2.84Å; K13-N16 HydrophobicContact CB-CB 4.46Å; K13-N16 PolarHBondContact O-N 3.48Å; K13-I17 PolarHBondContact O-N 3.3Å
14	K	93.2	Very high	92.6	Very high	184 Å²	184	103.5 Å²	103.5	80%	0.8	49%	0.489	S	S	*	.	H	α-helix	trans	-48.4	-40.3	-177.6	-172	179.1	179.2	-177.9	0	113.4	L12 A18	L12-K14 PolarHBondContact O-N 3.22Å; K14-A18 WeakPolarHBondContact O-CB 3.32Å; K14-A18 PolarHBondContact O-N 2.9Å
15	E	92.3	Very high	92.9	Very high	112 Å²	112	102.6 Å²	102.6	52%	0.523	49%	0.491	S	S	.	.	H	α-helix	trans	-63.1	-39.4	176.3	-67.4	165.1	-149.6	0	0	113.5	K13 A18 R19	K13-E15 WeakPolarHBondContact CE-OE1 3.32Å; K13-E15 WeakPolarHBondContact CE-OE2 3.47Å; K13-E15 IonicContact NZ-OE1 3.41Å; K13-E15 PolarHBondContact NZ-OE1 3.47Å; K13-E15 IonicContact NZ-OE2 3.41Å; K13-E15 PolarHBondContact NZ-OE2 3.38Å; K13-E15 PolarHBondContact O-N 2.84Å; E15-A18 PolarHBondContact O-N 3.15Å; E15-R19 PolarHBondContact O-N 3.47Å
16	N	92.7	Very high	93.1	Very high	17 Å²	17	105 Å²	105	9%	0.091	50%	0.495	C	S	.	.	H	α-helix	trans	-75.1	-41.1	-179.3	-71.1	-13.6	0	0	0	110.8	R8 H10 K13 A18 R19 V20	R8-N16 PolarHBondContact O-ND2 2.89Å; H10-N16 PolarHBondContact O-ND2 2.95Å; K13-N16 HydrophobicContact CB-CB 4.46Å; K13-N16 PolarHBondContact O-N 3.48Å; N16-A18 VanDerWaalsContact C-N 3.27Å; N16-A18 PolarHBondContact O-N 2.88Å; N16-R19 PolarHBondContact O-N 3.46Å; N16-V20 WeakPolarHBondContact O-CG2 3.34Å; N16-V20 PolarHBondContact O-N 3.1Å
17	I	93	Very high	93.2	Very high	54 Å²	54	103.2 Å²	103.2	28%	0.277	48%	0.484	S	S	.	.	H	α-helix	trans	-59	-42.6	172.4	-55.7	173.9	0	0	0	110.1	V11 K13 R19 V20 R21	V11-I17 WeakPolarHBondContact O-CG1 3.47Å; K13-I17 PolarHBondContact O-N 3.3Å; I17-R19 PolarHBondContact O-N 2.95Å; I17-V20 PolarHBondContact O-N 2.98Å; I17-R21 VanDerWaalsContact CG2-CZ 3.43Å; I17-R21 WeakPolarHBondContact O-CG 3.41Å; I17-R21 PolarHBondContact O-N 2.81Å
18	A	93	Very high	93.1	Very high	47 Å²	47	101.7 Å²	101.7	39%	0.388	48%	0.478	S	S	.	.	H	α-helix	trans	-62	-41.5	176.7	0	0	0	0	0	112.2	K14 E15 N16 R21 S22	K14-A18 WeakPolarHBondContact O-CB 3.32Å; K14-A18 PolarHBondContact O-N 2.9Å; E15-A18 PolarHBondContact O-N 3.15Å; N16-A18 VanDerWaalsContact C-N 3.27Å; N16-A18 PolarHBondContact O-N 2.88Å; A18-R21 PolarHBondContact O-N 3.37Å; A18-S22 PolarHBondContact O-N 2.78Å; A18-S22 PolarHBondContact O-OG 3.41Å
19	R	94.4	Very high	93	Very high	148 Å²	148	96.8 Å²	96.8	56%	0.558	46%	0.464	S	S	*	.	H	α-helix	trans	-62.6	-46.9	175.7	-166.2	-177.9	-55.4	145.2	10.8	112.1	E15 N16 I17 R21 S22 D23	E15-R19 PolarHBondContact O-N 3.47Å; N16-R19 PolarHBondContact O-N 3.46Å; I17-R19 PolarHBondContact O-N 2.95Å; R19-R21 VanDerWaalsContact C-N 3.32Å; R19-R21 PolarHBondContact O-N 3.32Å; R19-S22 PolarHBondContact O-N 3.48Å; R19-S22 VanDerWaalsContact O-N 3.14Å; R19-D23 PolarHBondContact O-N 3.09Å
20	V	95.7	Very high	93	Very high	68 Å²	68	94.6 Å²	94.6	41%	0.412	46%	0.461	S	S	.	.	H	α-helix	trans	-57.7	-46	175.7	171.8	0	0	0	0	110.6	N16 I17 S22 D23 E24	N16-V20 WeakPolarHBondContact O-CG2 3.34Å; N16-V20 PolarHBondContact O-N 3.1Å; I17-V20 PolarHBondContact O-N 2.98Å; V20-S22 VanDerWaalsContact C-N 3.35Å; V20-S22 PolarHBondContact O-N 2.91Å; V20-D23 PolarHBondContact O-N 2.9Å; V20-E24 HydrophobicContact CG1-CG 4.18Å; V20-E24 VanDerWaalsContact CG1-OE1 3.3Å; V20-E24 WeakPolarHBondContact CG1-OE1 3.46Å; V20-E24 WeakPolarHBondContact O-CB 3.39Å; V20-E24 VanDerWaalsContact O-CG 3.28Å; V20-E24 WeakPolarHBondContact O-CG 3.37Å; V20-E24 PolarHBondContact O-N 3.47Å
21	R	94.5	Very high	93	Very high	162 Å²	162	99.2 Å²	99.2	61%	0.611	48%	0.477	S	S	*	.	H	α-helix	trans	-61.4	-40	175.7	-73.7	-174.5	-173.1	120.7	0.2	113.2	I17 A18 R19 D23 A25	I17-R21 VanDerWaalsContact CG2-CZ 3.43Å; I17-R21 WeakPolarHBondContact O-CG 3.41Å; I17-R21 PolarHBondContact O-N 2.81Å; A18-R21 PolarHBondContact O-N 3.37Å; R19-R21 VanDerWaalsContact C-N 3.32Å; R19-R21 PolarHBondContact O-N 3.32Å; R21-D23 VanDerWaalsContact C-N 3.35Å; R21-A25 WeakPolarHBondContact O-CB 3.27Å; R21-A25 PolarHBondContact O-N 2.71Å
22	S	92.8	Very high	92.9	Very high	66 Å²	66	101.5 Å²	101.5	46%	0.462	47%	0.474	S	S	.	.	H	α-helix	trans	-65.3	-38.6	175.7	-66.6	0	0	0	0	112.1	A18 R19 V20 K26	A18-S22 PolarHBondContact O-N 2.78Å; A18-S22 PolarHBondContact O-OG 3.41Å; R19-S22 PolarHBondContact O-N 3.48Å; R19-S22 VanDerWaalsContact O-N 3.14Å; V20-S22 VanDerWaalsContact C-N 3.35Å; V20-S22 PolarHBondContact O-N 2.91Å; S22-K26 VanDerWaalsContact O-CG 3.29Å; S22-K26 WeakPolarHBondContact O-CG 3.45Å; S22-K26 PolarHBondContact O-N 3.14Å
23	D	96.3	Very high	93	Very high	85 Å²	85	101.7 Å²	101.7	46%	0.455	47%	0.469	S	S	.	.	H	α-helix	trans	-72	-42.4	178.1	-66.5	-21.1	0	0	0	111.4	R19 V20 R21 A25 K26 Y27	R19-D23 PolarHBondContact O-N 3.09Å; V20-D23 PolarHBondContact O-N 2.9Å; R21-D23 VanDerWaalsContact C-N 3.35Å; D23-A25 VanDerWaalsContact C-N 3.34Å; D23-A25 PolarHBondContact O-N 2.94Å; D23-K26 PolarHBondContact O-N 3.31Å; D23-Y27 WeakPolarHBondContact O-CB 3.36Å; D23-Y27 PolarHBondContact O-N 2.81Å
24	E	92.8	Very high	93	Very high	119 Å²	119	104.4 Å²	104.4	56%	0.556	49%	0.485	S	S	*	.	H	α-helix	trans	-60.1	-42.1	172.2	-73.5	172	173.5	0	0	111.7	V20 Y27 E28	V20-E24 HydrophobicContact CG1-CG 4.18Å; V20-E24 VanDerWaalsContact CG1-OE1 3.3Å; V20-E24 WeakPolarHBondContact CG1-OE1 3.46Å; V20-E24 WeakPolarHBondContact O-CB 3.39Å; V20-E24 VanDerWaalsContact O-CG 3.28Å; V20-E24 WeakPolarHBondContact O-CG 3.37Å; V20-E24 PolarHBondContact O-N 3.47Å; E24-Y27 PolarHBondContact O-N 3.1Å; E24-E28 WeakPolarHBondContact O-CB 3.36Å; E24-E28 PolarHBondContact O-N 3.37Å
25	A	93.3	Very high	92.9	Very high	49 Å²	49	100.7 Å²	100.7	41%	0.405	47%	0.471	S	S	.	.	H	α-helix	trans	-64.6	-44.4	176.7	0	0	0	0	0	112.1	R21 D23 Y27 E28 E29	R21-A25 WeakPolarHBondContact O-CB 3.27Å; R21-A25 PolarHBondContact O-N 2.71Å; D23-A25 VanDerWaalsContact C-N 3.34Å; D23-A25 PolarHBondContact O-N 2.94Å; A25-Y27 VanDerWaalsContact C-N 3.33Å; A25-Y27 PolarHBondContact O-N 2.97Å; A25-E28 PolarHBondContact O-N 3.08Å; A25-E29 WeakPolarHBondContact O-CG 3.12Å; A25-E29 PolarHBondContact O-N 2.84Å
26	K	93.7	Very high	92.9	Very high	123 Å²	123	100.4 Å²	100.4	54%	0.535	47%	0.472	S	S	.	.	H	α-helix	trans	-60.3	-43.9	174.1	-75	171.4	-178	176.1	0	111.6	S22 D23 E28 E29 E30	S22-K26 VanDerWaalsContact O-CG 3.29Å; S22-K26 WeakPolarHBondContact O-CG 3.45Å; S22-K26 PolarHBondContact O-N 3.14Å; D23-K26 PolarHBondContact O-N 3.31Å; K26-E28 VanDerWaalsContact C-N 3.34Å; K26-E28 PolarHBondContact O-N 3.3Å; K26-E29 PolarHBondContact O-N 3.43Å; K26-E30 WeakPolarHBondContact O-CG 3.28Å; K26-E30 PolarHBondContact O-N 2.83Å
27	Y	92.8	Very high	92.8	Very high	152 Å²	152	107.3 Å²	107.3	60%	0.596	50%	0.502	S	S	*	.	H	α-helix	trans	-62	-42.3	177.8	-178.5	-100.4	0	0	0	111.9	D23 E24 A25 E30 R31	D23-Y27 WeakPolarHBondContact O-CB 3.36Å; D23-Y27 PolarHBondContact O-N 2.81Å; E24-Y27 PolarHBondContact O-N 3.1Å; A25-Y27 VanDerWaalsContact C-N 3.33Å; A25-Y27 PolarHBondContact O-N 2.97Å; Y27-E30 PolarHBondContact O-N 3.36Å; Y27-R31 WeakPolarHBondContact O-CB 3.32Å; Y27-R31 PolarHBondContact O-N 2.94Å
28	E	90.2	Very high	92.8	Very high	56 Å²	56	106.9 Å²	106.9	26%	0.262	51%	0.506	S	S	.	.	H	α-helix	trans	-64.5	-41.4	176	-174.3	64.8	-153	0	0	111.9	E24 A25 K26 R31 R32	E24-E28 WeakPolarHBondContact O-CB 3.36Å; E24-E28 PolarHBondContact O-N 3.37Å; A25-E28 PolarHBondContact O-N 3.08Å; K26-E28 VanDerWaalsContact C-N 3.34Å; K26-E28 PolarHBondContact O-N 3.3Å; E28-R31 PolarHBondContact O-N 3.41Å; E28-R31 IonicContact OE1-CZ 3.01Å; E28-R31 IonicContact OE1-NH1 3.75Å; E28-R31 IonicContact OE1-NH2 3.9Å; E28-R31 PolarHBondContact OE1-NH2 2.87Å; E28-R31 IonicContact OE2-CZ 2.88Å; E28-R31 VanDerWaalsContact OE2-CZ 3.25Å; E28-R31 IonicContact OE2-NH1 2.76Å; E28-R31 PolarHBondContact OE2-NH1 3.45Å; E28-R31 IonicContact OE2-NH2 3.02Å; E28-R31 PolarHBondContact OE2-NH2 2.74Å; E28-R32 WeakPolarHBondContact O-CB 3.28Å; E28-R32 VanDerWaalsContact O-CG 3.27Å; E28-R32 WeakPolarHBondContact O-CG 3.45Å; E28-R32 PolarHBondContact O-N 2.93Å; E28-R32 IonicContact OE1-NE 2.79Å; E28-R32 PolarHBondContact OE1-NE 3.47Å; E28-R32 IonicContact OE1-NH2 3.75Å
29	E	89.9	Confident	92.7	Very high	107 Å²	107	108.7 Å²	108.7	50%	0.5	51%	0.507	S	S	.	.	H	α-helix	trans	-63.1	-43.9	174.7	-75	-179.7	-168.5	0	0	112.4	A25 K26 R32 K33	A25-E29 WeakPolarHBondContact O-CG 3.12Å; A25-E29 PolarHBondContact O-N 2.84Å; K26-E29 PolarHBondContact O-N 3.43Å; E29-R32 PolarHBondContact O-N 3.46Å; E29-K33 VanDerWaalsContact O-CG 3.31Å; E29-K33 WeakPolarHBondContact O-CG 3.21Å; E29-K33 PolarHBondContact O-N 2.95Å
30	E	91.8	Very high	92.5	Very high	116 Å²	116	106.2 Å²	106.2	54%	0.542	50%	0.504	S	S	.	.	H	α-helix	trans	-62.4	-44.7	174.8	-74.7	-179.9	179.1	0	0	111.3	K26 Y27 R32 K33 I34	K26-E30 WeakPolarHBondContact O-CG 3.28Å; K26-E30 PolarHBondContact O-N 2.83Å; Y27-E30 PolarHBondContact O-N 3.36Å; E30-R32 VanDerWaalsContact C-N 3.31Å; E30-R32 PolarHBondContact O-N 3.48Å; E30-K33 PolarHBondContact O-N 2.85Å; E30-K33 VanDerWaalsContact O-N 3.17Å; E30-I34 VanDerWaalsContact O-CG1 3.31Å; E30-I34 WeakPolarHBondContact O-CG1 3.37Å; E30-I34 PolarHBondContact O-N 3.46Å
31	R	93.1	Very high	92.2	Very high	126 Å²	126	105.2 Å²	105.2	48%	0.475	50%	0.503	S	S	.	.	H	α-helix	trans	-59.9	-42.3	176.4	-158.9	-177	83.7	-124.6	-11.6	111.3	Y27 E28 I34 E35	Y27-R31 WeakPolarHBondContact O-CB 3.32Å; Y27-R31 PolarHBondContact O-N 2.94Å; E28-R31 PolarHBondContact O-N 3.41Å; E28-R31 IonicContact OE1-CZ 3.01Å; E28-R31 IonicContact OE1-NH1 3.75Å; E28-R31 IonicContact OE1-NH2 3.9Å; E28-R31 PolarHBondContact OE1-NH2 2.87Å; E28-R31 IonicContact OE2-CZ 2.88Å; E28-R31 VanDerWaalsContact OE2-CZ 3.25Å; E28-R31 IonicContact OE2-NH1 2.76Å; E28-R31 PolarHBondContact OE2-NH1 3.45Å; E28-R31 IonicContact OE2-NH2 3.02Å; E28-R31 PolarHBondContact OE2-NH2 2.74Å; R31-I34 PolarHBondContact O-N 2.91Å; R31-E35 WeakPolarHBondContact O-CB 3.35Å; R31-E35 PolarHBondContact O-N 2.88Å
32	R	92	Very high	92	Very high	155 Å²	155	103.2 Å²	103.2	59%	0.585	50%	0.504	S	S	*	.	H	α-helix	trans	-63.3	-41.5	175.3	-74.4	174.7	-174.8	-172.9	0.6	112.4	E28 E29 E30 I34 E35 L36	E28-R32 WeakPolarHBondContact O-CB 3.28Å; E28-R32 VanDerWaalsContact O-CG 3.27Å; E28-R32 WeakPolarHBondContact O-CG 3.45Å; E28-R32 PolarHBondContact O-N 2.93Å; E28-R32 IonicContact OE1-NE 2.79Å; E28-R32 PolarHBondContact OE1-NE 3.47Å; E28-R32 IonicContact OE1-NH2 3.75Å; E29-R32 PolarHBondContact O-N 3.46Å; E30-R32 VanDerWaalsContact C-N 3.31Å; E30-R32 PolarHBondContact O-N 3.48Å; R32-I34 VanDerWaalsContact C-N 3.34Å; R32-E35 PolarHBondContact O-N 3.29Å; R32-L36 WeakPolarHBondContact O-CB 3.36Å; R32-L36 WeakPolarHBondContact O-CG 3.3Å; R32-L36 PolarHBondContact O-N 2.97Å
33	K	92.7	Very high	91.9	Very high	131 Å²	131	105.5 Å²	105.5	57%	0.57	51%	0.508	S	S	*	.	H	α-helix	trans	-63.6	-40.8	175.8	-71.8	169.5	-168.9	171.4	0	111.6	E29 E30 K37	E29-K33 VanDerWaalsContact O-CG 3.31Å; E29-K33 WeakPolarHBondContact O-CG 3.21Å; E29-K33 PolarHBondContact O-N 2.95Å; E30-K33 PolarHBondContact O-N 2.85Å; E30-K33 VanDerWaalsContact O-N 3.17Å; K33-K37 VanDerWaalsContact O-CB 3.31Å; K33-K37 WeakPolarHBondContact O-CB 3.31Å; K33-K37 PolarHBondContact O-N 2.9Å
34	I	92.6	Very high	91.5	Very high	115 Å²	115	107.2 Å²	107.2	59%	0.59	51%	0.513	S	S	*	.	H	α-helix	trans	-64.2	-47	176.3	-68	165.1	0	0	0	110.5	E30 R31 R32 K37 A38	E30-I34 VanDerWaalsContact O-CG1 3.31Å; E30-I34 WeakPolarHBondContact O-CG1 3.37Å; E30-I34 PolarHBondContact O-N 3.46Å; R31-I34 PolarHBondContact O-N 2.91Å; R32-I34 VanDerWaalsContact C-N 3.34Å; I34-K37 PolarHBondContact O-N 3.18Å; I34-A38 WeakPolarHBondContact O-CB 3.22Å; I34-A38 PolarHBondContact O-N 3.28Å
35	E	92.2	Very high	91.5	Very high	106 Å²	106	104.3 Å²	104.3	50%	0.495	51%	0.51	S	S	.	.	H	α-helix	trans	-59.6	-48.2	177.5	-178	61.4	-149.8	0	0	111.5	R31 R32 K37 A38 Q39	R31-E35 WeakPolarHBondContact O-CB 3.35Å; R31-E35 PolarHBondContact O-N 2.88Å; R32-E35 PolarHBondContact O-N 3.29Å; E35-K37 VanDerWaalsContact C-N 3.3Å; E35-K37 PolarHBondContact O-N 2.86Å; E35-A38 PolarHBondContact O-N 3.31Å; E35-Q39 WeakPolarHBondContact O-CG 3.41Å; E35-Q39 PolarHBondContact O-N 2.87Å; E35-Q39 PolarHBondContact OE1-NE2 3.34Å
36	L	91.3	Very high	91.3	Very high	106 Å²	106	110.9 Å²	110.9	56%	0.555	52%	0.524	S	S	*	.	H	α-helix	trans	-59.7	-40.8	175.8	-74.6	175	0	0	0	112	R32 Q39 L40	R32-L36 WeakPolarHBondContact O-CB 3.36Å; R32-L36 WeakPolarHBondContact O-CG 3.3Å; R32-L36 PolarHBondContact O-N 2.97Å; L36-Q39 PolarHBondContact O-N 3.18Å; L36-L40 WeakPolarHBondContact O-CG 3.46Å; L36-L40 PolarHBondContact O-N 3.4Å
37	K	90.4	Very high	90.9	Very high	163 Å²	163	109 Å²	109	71%	0.709	52%	0.518	S	S	*	.	H	α-helix	trans	-66.1	-39.2	176.7	-173.5	174.1	-179.1	175.3	0	112	K33 I34 E35 A41	K33-K37 VanDerWaalsContact O-CB 3.31Å; K33-K37 WeakPolarHBondContact O-CB 3.31Å; K33-K37 PolarHBondContact O-N 2.9Å; I34-K37 PolarHBondContact O-N 3.18Å; E35-K37 VanDerWaalsContact C-N 3.3Å; E35-K37 PolarHBondContact O-N 2.86Å; K37-A41 WeakPolarHBondContact O-CB 3.3Å; K37-A41 PolarHBondContact O-N 3.45Å
38	A	93.5	Very high	90.8	Very high	44 Å²	44	105.2 Å²	105.2	36%	0.364	51%	0.509	S	S	.	.	H	α-helix	trans	-65.6	-44.5	175.6	0	0	0	0	0	111.3	I34 E35 L40 A41 D42	I34-A38 WeakPolarHBondContact O-CB 3.22Å; I34-A38 PolarHBondContact O-N 3.28Å; E35-A38 PolarHBondContact O-N 3.31Å; A38-L40 PolarHBondContact O-N 2.89Å; A38-A41 PolarHBondContact O-N 3.41Å; A38-D42 PolarHBondContact O-N 3.45Å
39	Q	91.4	Very high	90.8	Very high	86 Å²	86	109.1 Å²	109.1	40%	0.402	52%	0.522	S	S	.	.	H	α-helix	trans	-62	-42.2	176.6	-71.2	178.1	11.7	0	0	112.4	E35 L36 D42 Q43	E35-Q39 WeakPolarHBondContact O-CG 3.41Å; E35-Q39 PolarHBondContact O-N 2.87Å; E35-Q39 PolarHBondContact OE1-NE2 3.34Å; L36-Q39 PolarHBondContact O-N 3.18Å; Q39-D42 PolarHBondContact O-N 2.83Å; Q39-Q43 VanDerWaalsContact O-CG 3.29Å; Q39-Q43 WeakPolarHBondContact O-CG 3.49Å; Q39-Q43 PolarHBondContact O-N 3.3Å
40	L	88.9	Confident	90.6	Very high	95 Å²	95	108.7 Å²	108.7	50%	0.497	52%	0.523	S	S	.	.	H	α-helix	trans	-63	-44.6	173.9	-77.1	172.6	0	0	0	111.5	L36 A38 D42 Q43 E44	L36-L40 WeakPolarHBondContact O-CG 3.46Å; L36-L40 PolarHBondContact O-N 3.4Å; A38-L40 PolarHBondContact O-N 2.89Å; L40-D42 VanDerWaalsContact C-N 3.32Å; L40-D42 PolarHBondContact O-N 3.14Å; L40-Q43 PolarHBondContact O-N 2.96Å; L40-E44 WeakPolarHBondContact O-CB 3.31Å; L40-E44 WeakPolarHBondContact O-CG 3.43Å; L40-E44 PolarHBondContact O-N 3.45Å
41	A	90	Very high	90.3	Very high	48 Å²	48	111.2 Å²	111.2	40%	0.397	53%	0.527	S	S	.	.	H	α-helix	trans	-61.3	-39.2	176.8	0	0	0	0	0	112.4	K37 A38 E44 A45	K37-A41 WeakPolarHBondContact O-CB 3.3Å; K37-A41 PolarHBondContact O-N 3.45Å; A38-A41 PolarHBondContact O-N 3.41Å; A41-E44 PolarHBondContact O-N 2.88Å; A41-A45 VanDerWaalsContact O-CB 3.26Å; A41-A45 WeakPolarHBondContact O-CB 3.36Å; A41-A45 PolarHBondContact O-N 2.8Å
42	D	90	Very high	90.1	Very high	120 Å²	120	113.6 Å²	113.6	64%	0.642	54%	0.536	S	S	*	.	H	α-helix	trans	-65.5	-43.1	175.2	-85.1	-1.9	0	0	0	111.9	A38 Q39 L40 R46	A38-D42 PolarHBondContact O-N 3.45Å; Q39-D42 PolarHBondContact O-N 2.83Å; L40-D42 VanDerWaalsContact C-N 3.32Å; L40-D42 PolarHBondContact O-N 3.14Å; D42-R46 VanDerWaalsContact O-CB 3.28Å; D42-R46 WeakPolarHBondContact O-CB 3.49Å; D42-R46 PolarHBondContact O-N 3.17Å
43	Q	91.2	Very high	89.7	Confident	113 Å²	113	110.8 Å²	110.8	53%	0.528	53%	0.53	S	S	.	.	H	α-helix	trans	-61.6	-46.9	174.8	-72.2	175.8	11.9	0	0	111.2	Q39 L40 R46 I47	Q39-Q43 VanDerWaalsContact O-CG 3.29Å; Q39-Q43 WeakPolarHBondContact O-CG 3.49Å; Q39-Q43 PolarHBondContact O-N 3.3Å; L40-Q43 PolarHBondContact O-N 2.96Å; Q43-R46 PolarHBondContact O-N 3.41Å; Q43-I47 VanDerWaalsContact O-CG1 3.27Å; Q43-I47 WeakPolarHBondContact O-CG1 3.37Å; Q43-I47 PolarHBondContact O-N 3.43Å
44	E	88.2	Confident	89.1	Confident	121 Å²	121	111.6 Å²	111.6	57%	0.565	53%	0.533	S	S	*	.	H	α-helix	trans	-61.7	-48	177.5	-74.3	177	177.1	0	0	111.6	L40 A41 R46 I47 D48	L40-E44 WeakPolarHBondContact O-CB 3.31Å; L40-E44 WeakPolarHBondContact O-CG 3.43Å; L40-E44 PolarHBondContact O-N 3.45Å; A41-E44 PolarHBondContact O-N 2.88Å; E44-R46 VanDerWaalsContact C-N 3.3Å; E44-R46 PolarHBondContact O-N 3.33Å; E44-I47 PolarHBondContact O-N 2.87Å; E44-I47 VanDerWaalsContact O-N 3.17Å; E44-D48 WeakPolarHBondContact O-CB 3.2Å; E44-D48 PolarHBondContact O-N 3.14Å
45	A	92.3	Very high	88.5	Confident	59 Å²	59	109.1 Å²	109.1	49%	0.488	53%	0.526	S	S	.	.	H	α-helix	trans	-60.5	-40.1	177.7	0	0	0	0	0	112	A41 D48 Y49	A41-A45 VanDerWaalsContact O-CB 3.26Å; A41-A45 WeakPolarHBondContact O-CB 3.36Å; A41-A45 PolarHBondContact O-N 2.8Å; A45-D48 PolarHBondContact O-N 3.47Å; A45-Y49 WeakPolarHBondContact O-CB 3.32Å; A45-Y49 PolarHBondContact O-N 2.93Å
46	R	89.5	Confident	87.5	Confident	187 Å²	187	110.3 Å²	110.3	71%	0.706	54%	0.536	S	S	*	.	H	α-helix	trans	-63.7	-44.4	175	-177.7	176.4	-179.5	172.1	-0	111.7	D42 Q43 E44 Y49 L50	D42-R46 VanDerWaalsContact O-CB 3.28Å; D42-R46 WeakPolarHBondContact O-CB 3.49Å; D42-R46 PolarHBondContact O-N 3.17Å; Q43-R46 PolarHBondContact O-N 3.41Å; E44-R46 VanDerWaalsContact C-N 3.3Å; E44-R46 PolarHBondContact O-N 3.33Å; R46-Y49 PolarHBondContact O-N 3.04Å; R46-L50 WeakPolarHBondContact O-CG 3.49Å; R46-L50 PolarHBondContact O-N 2.93Å; R46-L50 VanDerWaalsContact O-N 3.12Å
47	I	85.8	Confident	86.3	Confident	82 Å²	82	111.9 Å²	111.9	42%	0.421	54%	0.544	S	S	.	.	H	α-helix	trans	-65.2	-43.5	177.8	-69.3	165.5	0	0	0	110.6	Q43 E44 Y49 L50 R51	Q43-I47 VanDerWaalsContact O-CG1 3.27Å; Q43-I47 WeakPolarHBondContact O-CG1 3.37Å; Q43-I47 PolarHBondContact O-N 3.43Å; E44-I47 PolarHBondContact O-N 2.87Å; E44-I47 VanDerWaalsContact O-N 3.17Å; I47-Y49 PolarHBondContact O-N 3.21Å; I47-L50 PolarHBondContact O-N 3.09Å; I47-R51 HydrophobicContact CG2-CG 4.45Å; I47-R51 WeakPolarHBondContact O-CG 3.25Å; I47-R51 PolarHBondContact O-N 3.28Å
48	D	89.4	Confident	84.7	Confident	73 Å²	73	108.5 Å²	108.5	39%	0.39	54%	0.537	S	S	.	.	H	α-helix	trans	-64.9	-38.9	178.3	-83.5	-7.2	0	0	0	112.2	E44 A45 R51 R52	E44-D48 WeakPolarHBondContact O-CB 3.2Å; E44-D48 PolarHBondContact O-N 3.14Å; A45-D48 PolarHBondContact O-N 3.47Å; D48-R51 PolarHBondContact O-N 2.69Å; D48-R51 IonicContact OD1-NH1 3.33Å; D48-R52 WeakPolarHBondContact O-CB 3.44Å; D48-R52 VanDerWaalsContact O-CG 3.29Å; D48-R52 WeakPolarHBondContact O-CG 3.47Å; D48-R52 PolarHBondContact O-N 2.94Å
49	Y	90	Very high	82.8	Confident	138 Å²	138	112.1 Å²	112.1	54%	0.541	56%	0.56	S	S	.	*	H	α-helix	trans	-57.9	-47.5	171.3	175.3	-95.9	0	0	0	111.5	A45 R46 I47 R52 Q53	A45-Y49 WeakPolarHBondContact O-CB 3.32Å; A45-Y49 PolarHBondContact O-N 2.93Å; R46-Y49 PolarHBondContact O-N 3.04Å; I47-Y49 PolarHBondContact O-N 3.21Å; Y49-R52 PolarHBondContact O-N 2.91Å; Y49-Q53 HydrophobicContact CD1-CG 4.18Å; Y49-Q53 HydrophobicContact CE1-CG 3.79Å; Y49-Q53 HydrophobicContact CE2-CG 4.28Å; Y49-Q53 WeakPolarHBondContact O-CB 3.45Å; Y49-Q53 VanDerWaalsContact O-CG 3.3Å; Y49-Q53 WeakPolarHBondContact O-CG 3.44Å; Y49-Q53 PolarHBondContact O-N 2.7Å; Y49-Q53 PolarHBondContact OH-NE2 3.03Å; Y49-Q53 VanDerWaalsContact OH-NE2 3.11Å
50	L	87.6	Confident	80.7	Confident	98 Å²	98	110.4 Å²	110.4	51%	0.513	57%	0.566	S	S	.	*	H	α-helix	trans	-64.6	-38.9	177.1	-69.3	172.1	0	0	0	112.3	R46 I47 Q53 K54	R46-L50 WeakPolarHBondContact O-CG 3.49Å; R46-L50 PolarHBondContact O-N 2.93Å; R46-L50 VanDerWaalsContact O-N 3.12Å; I47-L50 PolarHBondContact O-N 3.09Å; L50-Q53 PolarHBondContact O-N 3.39Å; L50-K54 WeakPolarHBondContact O-CB 3.39Å; L50-K54 PolarHBondContact O-N 3Å
51	R	85.5	Confident	78.2	Confident	169 Å²	169	112.1 Å²	112.1	64%	0.638	59%	0.585	S	S	*	*	H	α-helix	trans	-62.6	-43.8	174.8	-77.1	180	-176	169.8	1.5	111.7	I47 D48 K54 S55	I47-R51 HydrophobicContact CG2-CG 4.45Å; I47-R51 WeakPolarHBondContact O-CG 3.25Å; I47-R51 PolarHBondContact O-N 3.28Å; D48-R51 PolarHBondContact O-N 2.69Å; D48-R51 IonicContact OD1-NH1 3.33Å; R51-K54 PolarHBondContact O-N 3.41Å; R51-S55 PolarHBondContact O-N 3.32Å; R51-S55 PolarHBondContact O-OG 3.24Å
52	R	88.3	Confident	75.9	Confident	177 Å²	177	113 Å²	113	67%	0.668	60%	0.599	S	S	*	*	H	α-helix	trans	-66.9	-40.6	177	-70.7	175.2	-173.5	-152.7	3.7	112.4	D48 Y49 S55 N56	D48-R52 WeakPolarHBondContact O-CB 3.44Å; D48-R52 VanDerWaalsContact O-CG 3.29Å; D48-R52 WeakPolarHBondContact O-CG 3.47Å; D48-R52 PolarHBondContact O-N 2.94Å; Y49-R52 PolarHBondContact O-N 2.91Å; R52-S55 WeakPolarHBondContact CA-OG 3.44Å; R52-S55 PolarHBondContact O-N 2.84Å; R52-S55 PolarHBondContact O-OG 2.84Å; R52-N56 PolarHBondContact O-N 3.06Å; R52-N56 VanDerWaalsContact O-N 3.07Å
53	Q	84.2	Confident	73.5	Confident	96 Å²	96	113.1 Å²	113.1	45%	0.449	61%	0.61	S	S	.	*	H	α-helix	trans	-60.3	-47.2	173.1	-76.5	-113.8	-38.9	0	0	111.1	Y49 L50 N56 L57	Y49-Q53 HydrophobicContact CD1-CG 4.18Å; Y49-Q53 HydrophobicContact CE1-CG 3.79Å; Y49-Q53 HydrophobicContact CE2-CG 4.28Å; Y49-Q53 WeakPolarHBondContact O-CB 3.45Å; Y49-Q53 VanDerWaalsContact O-CG 3.3Å; Y49-Q53 WeakPolarHBondContact O-CG 3.44Å; Y49-Q53 PolarHBondContact O-N 2.7Å; Y49-Q53 PolarHBondContact OH-NE2 3.03Å; Y49-Q53 VanDerWaalsContact OH-NE2 3.11Å; L50-Q53 PolarHBondContact O-N 3.39Å; Q53-N56 PolarHBondContact O-N 3.06Å; Q53-L57 PolarHBondContact O-N 3.49Å; Q53-L57 VanDerWaalsContact O-N 3.17Å
54	K	79.9	Confident	71.1	Confident	147 Å²	147	115.6 Å²	115.6	64%	0.639	63%	0.626	S	S	*	*	H	α-helix	trans	-62.1	-45.7	177	-173.3	176.8	179.6	177.2	0	111.6	L50 R51 N56 L57 T58	L50-K54 WeakPolarHBondContact O-CB 3.39Å; L50-K54 PolarHBondContact O-N 3Å; R51-K54 PolarHBondContact O-N 3.41Å; K54-N56 VanDerWaalsContact C-N 3.29Å; K54-N56 PolarHBondContact O-N 3.45Å; K54-L57 PolarHBondContact O-N 2.84Å; K54-L57 VanDerWaalsContact O-N 3.09Å; K54-T58 HydrophobicContact CG-CG2 4.17Å; K54-T58 WeakPolarHBondContact O-CG2 3.41Å; K54-T58 PolarHBondContact O-N 2.84Å; K54-T58 PolarHBondContact O-OG1 2.95Å; K54-T58 VanDerWaalsContact O-OG1 3.1Å
55	S	79	Confident	68.9	Low	64 Å²	64	112.7 Å²	112.7	45%	0.448	63%	0.629	S	S	.	*	H	α-helix	trans	-61.8	-36.5	179.6	64.4	0	0	0	0	112.8	R51 R52 L57 T58	R51-S55 PolarHBondContact O-N 3.32Å; R51-S55 PolarHBondContact O-OG 3.24Å; R52-S55 WeakPolarHBondContact CA-OG 3.44Å; R52-S55 PolarHBondContact O-N 2.84Å; R52-S55 PolarHBondContact O-OG 2.84Å; S55-L57 VanDerWaalsContact C-N 3.32Å; S55-T58 PolarHBondContact O-N 3.38Å; S55-T58 PolarHBondContact O-OG1 2.92Å
56	N	72.4	Confident	66.5	Low	131 Å²	131	118.9 Å²	118.9	70%	0.701	65%	0.645	S	S	*	*	H	α-helix	trans	-69.8	-28	175.9	-75.2	-1.7	0	0	0	112.9	R52 Q53 K54	R52-N56 PolarHBondContact O-N 3.06Å; R52-N56 VanDerWaalsContact O-N 3.07Å; Q53-N56 PolarHBondContact O-N 3.06Å; K54-N56 VanDerWaalsContact C-N 3.29Å; K54-N56 PolarHBondContact O-N 3.45Å
57	L	64.8	Low	64.4	Low	139 Å²	139	118.1 Å²	118.1	73%	0.728	65%	0.65	S	S	*	*	H	α-helix	trans	-79.4	-29.8	174.4	-102.4	67.6	0	0	0	112.7	Q53 K54 S55 S59	Q53-L57 PolarHBondContact O-N 3.49Å; Q53-L57 VanDerWaalsContact O-N 3.17Å; K54-L57 PolarHBondContact O-N 2.84Å; K54-L57 VanDerWaalsContact O-N 3.09Å; S55-L57 VanDerWaalsContact C-N 3.32Å; L57-S59 PolarHBondContact O-N 2.68Å
58	T	57.9	Low	62.6	Low	92 Å²	92	120.2 Å²	120.2	56%	0.564	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.1	12.1	-170.4	55.5	0	0	0	0	115.4	K54 S55 G60	K54-T58 HydrophobicContact CG-CG2 4.17Å; K54-T58 WeakPolarHBondContact O-CG2 3.41Å; K54-T58 PolarHBondContact O-N 2.84Å; K54-T58 PolarHBondContact O-OG1 2.95Å; K54-T58 VanDerWaalsContact O-OG1 3.1Å; S55-T58 PolarHBondContact O-N 3.38Å; S55-T58 PolarHBondContact O-OG1 2.92Å; T58-G60 PolarHBondContact O-N 3.5Å
59	S	53.1	Low	60.5	Low	119 Å²	119	121.7 Å²	121.7	83%	0.832	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.3	2.1	168.2	89.2	0	0	0	0	113.4	L57	L57-S59 PolarHBondContact O-N 2.68Å
60	G	45.9	Very low	58.3	Low	51 Å²	51	121.1 Å²	121.1	53%	0.526	68%	0.678	S	S	.	*	S	Bend	trans	-130.3	108	175.8	0	0	0	0	0	111.4	T58	T58-G60 PolarHBondContact O-N 3.5Å
61	S	38.1	Very low	56.2	Low	130 Å²	130	120.2 Å²	120.2	91%	0.909	68%	0.677	S	S	*	*			trans	57.3	119.1	149.4	-157.5	0	0	0	0	119.8
62	G	40.4	Very low	54.6	Low	67 Å²	67	120.8 Å²	120.8	69%	0.691	68%	0.684	S	S	*	*			trans	91.6	94.2	132.1	0	0	0	0	0	117.6
63	S	40	Very low	52.7	Low	123 Å²	123	118 Å²	118	86%	0.86	68%	0.682	S	S	*	*				27	101.3	124.2	179.9	0	0	0	0	117.5
64	D	40.5	Very low	50.9	Low	164 Å²	164	117.4 Å²	117.4	88%	0.877	69%	0.688	S	S	*	*				-160.9	141.5	116.2	-149.7	-1.3	0	0	0	111.2	F66	D64-F66 PolarHBondContact O-N 3.14Å
65	G	41.5	Very low	49.5	Very low	60 Å²	60	115.1 Å²	115.1	62%	0.619	69%	0.686	S	S	*	*			trans	-73.7	114	-167	0	0	0	0	0	113.6
66	F	43.8	Very low	47.9	Very low	190 Å²	190	118.4 Å²	118.4	83%	0.833	70%	0.698	S	S	*	*			trans	-123.4	81.4	148	-130.5	-95.6	0	0	0	107.7	D64 I68	D64-F66 PolarHBondContact O-N 3.14Å; F66-I68 HydrophobicContact CD1-CD1 4.45Å; F66-I68 HydrophobicContact CD1-CG1 3.88Å; F66-I68 PolarHBondContact O-N 3.46Å
67	Q	44.9	Very low	46.7	Very low	170 Å²	170	117.3 Å²	117.3	79%	0.794	69%	0.693	S	S	*	*			trans	-70.1	86.4	166.5	-68.9	-153.8	2.7	0	0	107.8	T69	Q67-T69 PolarHBondContact O-N 3.31Å
68	I	46.4	Very low	46	Very low	127 Å²	127	117.4 Å²	117.4	65%	0.651	70%	0.698	S	S	*	*			trans	-66.2	92.1	155.4	-60	177	0	0	0	104.2	F66 L70	F66-I68 HydrophobicContact CD1-CD1 4.45Å; F66-I68 HydrophobicContact CD1-CG1 3.88Å; F66-I68 PolarHBondContact O-N 3.46Å; I68-L70 HydrophobicContact CG2-CB 4.45Å; I68-L70 PolarHBondContact O-N 3.05Å
69	T	45.6	Very low	45.7	Very low	104 Å²	104	118.8 Å²	118.8	64%	0.638	71%	0.712	S	S	*	*			trans	-64.7	77	163.5	44.6	0	0	0	0	106.9	Q67 T71	Q67-T69 PolarHBondContact O-N 3.31Å; T69-T71 PolarHBondContact O-N 3.27Å
70	L	45.5	Very low	45.8	Very low	125 Å²	125	120.3 Å²	120.3	65%	0.654	71%	0.706	S	S	*	*			trans	-67.2	85.5	158.4	-165.5	70.5	0	0	0	104.2	I68 K72	I68-L70 HydrophobicContact CG2-CB 4.45Å; I68-L70 PolarHBondContact O-N 3.05Å; L70-K72 PolarHBondContact O-N 2.97Å
71	T	42.1	Very low	46.3	Very low	80 Å²	80	120.2 Å²	120.2	49%	0.491	71%	0.705	S	S	.	*			trans	-50.7	129.8	175.7	46.5	0	0	0	0	106.5	T69 D73 S74	T69-T71 PolarHBondContact O-N 3.27Å; T71-D73 PolarHBondContact O-N 2.92Å; T71-S74 PolarHBondContact O-N 2.99Å
72	K	52.7	Low	47.9	Very low	180 Å²	180	119 Å²	119	78%	0.783	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.2	-2.1	-178.3	-150	170.9	179.5	-179.8	0	112.5	L70	L70-K72 PolarHBondContact O-N 2.97Å
73	D	48	Very low	49.9	Very low	119 Å²	119	119.3 Å²	119.3	64%	0.636	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.7	-18.5	-179.3	-52.5	-24.2	0	0	0	112.6	T71 V75	T71-D73 PolarHBondContact O-N 2.92Å; D73-V75 VanDerWaalsContact C-N 3.27Å; D73-V75 PolarHBondContact O-N 3.18Å
74	S	47.2	Very low	51.8	Low	83 Å²	83	120 Å²	120	58%	0.58	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.6	-10	177.9	179.9	0	0	0	0	114.2	T71	T71-S74 PolarHBondContact O-N 2.99Å
75	V	50.1	Low	53.6	Low	99 Å²	99	118.9 Å²	118.9	60%	0.6	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.9	-1.2	-176.4	-173	0	0	0	0	111.4	D73	D73-V75 VanDerWaalsContact C-N 3.27Å; D73-V75 PolarHBondContact O-N 3.18Å
76	L	45.6	Very low	55.6	Low	133 Å²	133	122.1 Å²	122.1	70%	0.696	66%	0.657	S	S	*	*	S	Bend	trans	-111.4	1	-176.8	-66.8	176.5	0	0	0	115
77	D	46.5	Very low	57.7	Low	109 Å²	109	115.9 Å²	115.9	58%	0.583	64%	0.638	S	S	*	*			trans	-100.9	20.4	179	-89.8	-7.1	0	0	0	115	S79 Q80	D77-S79 PolarHBondContact O-N 2.78Å; D77-Q80 PolarHBondContact O-N 3.14Å
78	V	51.1	Low	59.7	Low	140 Å²	140	113.8 Å²	113.8	85%	0.848	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.1	-5	173.1	-179.1	0	0	0	0	112.6
79	S	51.6	Low	61.7	Low	121 Å²	121	113.5 Å²	113.5	85%	0.846	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.7	-4.1	-179.9	-56.7	0	0	0	0	114.5	D77	D77-S79 PolarHBondContact O-N 2.78Å
80	Q	53.6	Low	63.9	Low	152 Å²	152	114.9 Å²	114.9	71%	0.71	62%	0.619	S	S	*	*	S	Bend	trans	-108.3	98.7	175.7	-162.2	166	-30.8	0	0	107.8	D77 N82	D77-Q80 PolarHBondContact O-N 3.14Å; Q80-N82 PolarHBondContact O-N 2.9Å
81	G	57	Low	66.1	Low	49 Å²	49	113 Å²	113	51%	0.505	61%	0.608	S	S	.	*			trans	-49.4	138.4	-176.6	0	0	0	0	0	111.8	A83	G81-A83 PolarHBondContact O-N 3.17Å
82	N	72	Confident	68.4	Low	103 Å²	103	113.9 Å²	113.9	55%	0.551	61%	0.607	S	S	*	*			trans	-59.5	106	179.9	-172.1	9.9	0	0	0	108.9	Q80 E84 Y85 E86	Q80-N82 PolarHBondContact O-N 2.9Å; N82-E84 PolarHBondContact O-N 3.07Å; N82-E84 VanDerWaalsContact O-N 3.14Å; N82-Y85 WeakPolarHBondContact O-CB 3.39Å; N82-Y85 PolarHBondContact O-N 2.85Å; N82-E86 PolarHBondContact O-N 3.4Å; N82-E86 VanDerWaalsContact O-N 3.14Å
83	A	82.4	Confident	70.3	Confident	74 Å²	74	110.3 Å²	110.3	61%	0.612	59%	0.593	S	S	*	*	H	α-helix	trans	-57.6	-32.6	-173.6	0	0	0	0	0	111.8	G81 S87	G81-A83 PolarHBondContact O-N 3.17Å; A83-S87 WeakPolarHBondContact O-CB 3.44Å; A83-S87 PolarHBondContact O-N 3.4Å; A83-S87 VanDerWaalsContact O-N 3.09Å
84	E	80.7	Confident	72.4	Confident	137 Å²	137	106.8 Å²	106.8	64%	0.64	57%	0.573	S	S	*	*	H	α-helix	trans	-64.1	-45	174.5	-62	-175	166.5	0	0	111.3	N82 E86 S87 E88	N82-E84 PolarHBondContact O-N 3.07Å; N82-E84 VanDerWaalsContact O-N 3.14Å; E84-E86 PolarHBondContact O-N 2.96Å; E84-S87 PolarHBondContact O-N 3.49Å; E84-S87 PolarHBondContact O-OG 2.94Å; E84-E88 WeakPolarHBondContact O-CG 3.22Å; E84-E88 PolarHBondContact O-N 2.91Å
85	Y	77.8	Confident	74.4	Confident	141 Å²	141	109 Å²	109	55%	0.553	57%	0.572	S	S	*	*	H	α-helix	trans	-64.3	-41	179.3	179.5	-102.5	0	0	0	112.8	N82 S87 E88 K89	N82-Y85 WeakPolarHBondContact O-CB 3.39Å; N82-Y85 PolarHBondContact O-N 2.85Å; Y85-S87 VanDerWaalsContact C-N 3.32Å; Y85-E88 PolarHBondContact O-N 3.14Å; Y85-K89 HydrophobicContact CE1-CD 4.49Å; Y85-K89 VanDerWaalsContact O-CB 3.31Å; Y85-K89 WeakPolarHBondContact O-CB 3.18Å; Y85-K89 PolarHBondContact O-N 3.18Å
86	E	83.4	Confident	76.4	Confident	128 Å²	128	110 Å²	110	60%	0.598	57%	0.569	S	S	*	*	H	α-helix	trans	-65.8	-38.4	175.7	-65.5	-169.9	168.3	0	0	111.5	N82 E84 K90	N82-E86 PolarHBondContact O-N 3.4Å; N82-E86 VanDerWaalsContact O-N 3.14Å; E84-E86 PolarHBondContact O-N 2.96Å; E86-K90 WeakPolarHBondContact O-CB 3.31Å; E86-K90 PolarHBondContact O-N 3.22Å
87	S	87.3	Confident	78.6	Confident	60 Å²	60	106.1 Å²	106.1	42%	0.42	55%	0.547	S	S	.	.	H	α-helix	trans	-66.2	-42.4	175.3	80.7	0	0	0	0	112.2	A83 E84 Y85 K90 I91	A83-S87 WeakPolarHBondContact O-CB 3.44Å; A83-S87 PolarHBondContact O-N 3.4Å; A83-S87 VanDerWaalsContact O-N 3.09Å; E84-S87 PolarHBondContact O-N 3.49Å; E84-S87 PolarHBondContact O-OG 2.94Å; Y85-S87 VanDerWaalsContact C-N 3.32Å; S87-K90 PolarHBondContact O-N 3.37Å; S87-I91 WeakPolarHBondContact O-CD1 3.31Å; S87-I91 VanDerWaalsContact O-CG1 3.25Å; S87-I91 WeakPolarHBondContact O-CG1 3.48Å; S87-I91 PolarHBondContact O-N 3.03Å
88	E	86.5	Confident	80.6	Confident	126 Å²	126	104.3 Å²	104.3	59%	0.589	53%	0.534	S	S	*	.	H	α-helix	trans	-64.9	-43.9	176.6	-76.3	-175.1	171.5	0	0	112	E84 Y85 K90 I91 E92	E84-E88 WeakPolarHBondContact O-CG 3.22Å; E84-E88 PolarHBondContact O-N 2.91Å; Y85-E88 PolarHBondContact O-N 3.14Å; E88-K90 VanDerWaalsContact C-N 3.29Å; E88-K90 PolarHBondContact O-N 3.42Å; E88-I91 PolarHBondContact O-N 3.41Å; E88-I91 VanDerWaalsContact O-N 3.17Å; E88-E92 WeakPolarHBondContact O-CB 3.4Å; E88-E92 PolarHBondContact O-N 2.91Å
89	K	90	Very high	82.3	Confident	121 Å²	121	103.7 Å²	103.7	53%	0.526	53%	0.531	S	S	.	.	H	α-helix	trans	-61.8	-39.3	176.7	-173.1	177.8	179.2	-178.3	0	111.5	Y85 E92 Q93	Y85-K89 HydrophobicContact CE1-CD 4.49Å; Y85-K89 VanDerWaalsContact O-CB 3.31Å; Y85-K89 WeakPolarHBondContact O-CB 3.18Å; Y85-K89 PolarHBondContact O-N 3.18Å; K89-E92 PolarHBondContact O-N 2.96Å; K89-Q93 VanDerWaalsContact O-CB 3.31Å; K89-Q93 WeakPolarHBondContact O-CB 3.34Å; K89-Q93 PolarHBondContact O-N 2.82Å
90	K	91.2	Very high	84	Confident	132 Å²	132	103.1 Å²	103.1	57%	0.574	52%	0.521	S	S	*	.	H	α-helix	trans	-64.5	-45.6	173.3	-172.4	179.7	177.1	-175.4	0	111.1	E86 S87 E88 E92 Q93 E94	E86-K90 WeakPolarHBondContact O-CB 3.31Å; E86-K90 PolarHBondContact O-N 3.22Å; S87-K90 PolarHBondContact O-N 3.37Å; E88-K90 VanDerWaalsContact C-N 3.29Å; E88-K90 PolarHBondContact O-N 3.42Å; K90-E92 VanDerWaalsContact C-N 3.32Å; K90-E92 PolarHBondContact O-N 3.2Å; K90-Q93 PolarHBondContact O-N 3.31Å; K90-E94 VanDerWaalsContact CE-OE1 3.32Å; K90-E94 WeakPolarHBondContact CE-OE1 3.25Å; K90-E94 WeakPolarHBondContact O-CB 3.38Å; K90-E94 VanDerWaalsContact O-CG 3.28Å; K90-E94 WeakPolarHBondContact O-CG 3.4Å; K90-E94 PolarHBondContact O-N 2.97Å
91	I	91.8	Very high	85.4	Confident	85 Å²	85	98.1 Å²	98.1	44%	0.436	51%	0.511	S	S	.	.	H	α-helix	trans	-60.4	-41.9	176.1	-68.5	162.5	0	0	0	111.1	S87 E88 E94 K95	S87-I91 WeakPolarHBondContact O-CD1 3.31Å; S87-I91 VanDerWaalsContact O-CG1 3.25Å; S87-I91 WeakPolarHBondContact O-CG1 3.48Å; S87-I91 PolarHBondContact O-N 3.03Å; E88-I91 PolarHBondContact O-N 3.41Å; E88-I91 VanDerWaalsContact O-N 3.17Å; I91-E94 PolarHBondContact O-N 3.48Å; I91-K95 HydrophobicContact CG2-CD 4.3Å; I91-K95 WeakPolarHBondContact O-CB 3.36Å; I91-K95 VanDerWaalsContact O-CG 3.32Å; I91-K95 WeakPolarHBondContact O-CG 3.43Å; I91-K95 PolarHBondContact O-N 3.49Å
92	E	90.9	Very high	86.9	Confident	99 Å²	99	101.7 Å²	101.7	46%	0.463	52%	0.517	S	S	.	.	H	α-helix	trans	-67.8	-42.1	178.4	-164	-167.7	163.2	0	0	111.8	E88 K89 K90 K95 K96	E88-E92 WeakPolarHBondContact O-CB 3.4Å; E88-E92 PolarHBondContact O-N 2.91Å; K89-E92 PolarHBondContact O-N 2.96Å; K90-E92 VanDerWaalsContact C-N 3.32Å; K90-E92 PolarHBondContact O-N 3.2Å; E92-K95 PolarHBondContact O-N 2.86Å; E92-K96 WeakPolarHBondContact O-CG 3.22Å; E92-K96 PolarHBondContact O-N 3.06Å; E92-K96 WeakPolarHBondContact OE1-CE 3.25Å; E92-K96 IonicContact OE1-NZ 3.34Å; E92-K96 PolarHBondContact OE1-NZ 2.95Å
93	Q	91.5	Very high	87.5	Confident	106 Å²	106	98.8 Å²	98.8	50%	0.495	50%	0.501	S	S	.	.	H	α-helix	trans	-60	-47.5	173.5	-178.8	174.3	-12.9	0	0	110.6	K89 K90 K95 K96 E97	K89-Q93 VanDerWaalsContact O-CB 3.31Å; K89-Q93 WeakPolarHBondContact O-CB 3.34Å; K89-Q93 PolarHBondContact O-N 2.82Å; K90-Q93 PolarHBondContact O-N 3.31Å; Q93-K95 VanDerWaalsContact C-N 3.33Å; Q93-K95 PolarHBondContact O-N 3.35Å; Q93-K96 PolarHBondContact O-N 3.19Å; Q93-E97 HydrophobicContact CG-CG 4.39Å; Q93-E97 VanDerWaalsContact CG-OE1 3.27Å; Q93-E97 WeakPolarHBondContact CG-OE1 3.33Å; Q93-E97 PolarHBondContact NE2-OE1 3.34Å; Q93-E97 WeakPolarHBondContact O-CB 3.23Å; Q93-E97 VanDerWaalsContact O-CG 3.31Å; Q93-E97 WeakPolarHBondContact O-CG 3.38Å; Q93-E97 PolarHBondContact O-N 3.39Å
94	E	92	Very high	87.7	Confident	45 Å²	45	99.2 Å²	99.2	21%	0.21	50%	0.496	C	S	.	.	H	α-helix	trans	-61.9	-38.6	176.1	-71.2	179.8	-170.3	0	0	112	K90 I91 E97 K98 L103 Y105	K90-E94 VanDerWaalsContact CE-OE1 3.32Å; K90-E94 WeakPolarHBondContact CE-OE1 3.25Å; K90-E94 WeakPolarHBondContact O-CB 3.38Å; K90-E94 VanDerWaalsContact O-CG 3.28Å; K90-E94 WeakPolarHBondContact O-CG 3.4Å; K90-E94 PolarHBondContact O-N 2.97Å; I91-E94 PolarHBondContact O-N 3.48Å; E94-E97 PolarHBondContact O-N 3.23Å; E94-K98 VanDerWaalsContact O-CB 3.28Å; E94-K98 WeakPolarHBondContact O-CB 3.4Å; E94-K98 WeakPolarHBondContact O-CD 3.21Å; E94-K98 WeakPolarHBondContact O-CG 3.29Å; E94-K98 PolarHBondContact O-N 3.03Å; E94-K98 IonicContact OE2-NZ 3.62Å; E94-L103 HydrophobicContact CB-CD2 3.65Å; E94-L103 HydrophobicContact CG-CD2 3.59Å; E94-Y105 PolarHBondContact OE2-OH 3.37Å
95	K	90.6	Very high	87.8	Confident	129 Å²	129	97.5 Å²	97.5	56%	0.561	49%	0.485	S	S	*	.	H	α-helix	trans	-62.1	-45.2	173.5	-77.7	174	-178.1	175.8	0	111.5	I91 E92 Q93 K98 T99	I91-K95 HydrophobicContact CG2-CD 4.3Å; I91-K95 WeakPolarHBondContact O-CB 3.36Å; I91-K95 VanDerWaalsContact O-CG 3.32Å; I91-K95 WeakPolarHBondContact O-CG 3.43Å; I91-K95 PolarHBondContact O-N 3.49Å; E92-K95 PolarHBondContact O-N 2.86Å; Q93-K95 VanDerWaalsContact C-N 3.33Å; Q93-K95 PolarHBondContact O-N 3.35Å; K95-K98 PolarHBondContact O-N 2.83Å; K95-T99 WeakPolarHBondContact O-CB 3.39Å; K95-T99 PolarHBondContact O-N 3.23Å; K95-T99 PolarHBondContact O-OG1 2.82Å
96	K	91.9	Very high	88.1	Confident	121 Å²	121	99.8 Å²	99.8	53%	0.526	51%	0.505	S	S	.	.	H	α-helix	trans	-62.4	-46.7	176.9	-73.5	172.4	-176.3	164.1	0	111	E92 Q93 K98 T99 V100	E92-K96 WeakPolarHBondContact O-CG 3.22Å; E92-K96 PolarHBondContact O-N 3.06Å; E92-K96 WeakPolarHBondContact OE1-CE 3.25Å; E92-K96 IonicContact OE1-NZ 3.34Å; E92-K96 PolarHBondContact OE1-NZ 2.95Å; Q93-K96 PolarHBondContact O-N 3.19Å; K96-K98 VanDerWaalsContact C-N 3.33Å; K96-K98 PolarHBondContact O-N 2.95Å; K96-T99 PolarHBondContact O-N 2.99Å; K96-V100 VanDerWaalsContact O-CG2 3.3Å; K96-V100 WeakPolarHBondContact O-CG2 3.28Å; K96-V100 PolarHBondContact O-N 3.21Å
97	E	90.9	Very high	87.8	Confident	51 Å²	51	96.8 Å²	96.8	24%	0.238	51%	0.509	C	S	.	.	H	α-helix	trans	-64.2	-36.9	177.9	-68.9	173.6	-173.7	0	0	111.8	Q93 E94 G101 I102 L103	Q93-E97 HydrophobicContact CG-CG 4.39Å; Q93-E97 VanDerWaalsContact CG-OE1 3.27Å; Q93-E97 WeakPolarHBondContact CG-OE1 3.33Å; Q93-E97 PolarHBondContact NE2-OE1 3.34Å; Q93-E97 WeakPolarHBondContact O-CB 3.23Å; Q93-E97 VanDerWaalsContact O-CG 3.31Å; Q93-E97 WeakPolarHBondContact O-CG 3.38Å; Q93-E97 PolarHBondContact O-N 3.39Å; E94-E97 PolarHBondContact O-N 3.23Å; E97-G101 CarbonylContact O-C 3.54Å; E97-G101 PolarHBondContact O-N 3.48Å; E97-I102 HydrophobicContact CB-CB 4.22Å; E97-I102 HydrophobicContact CG-CG2 4.49Å; E97-I102 PolarHBondContact O-N 2.92Å; E97-L103 HydrophobicContact CB-CB 3.45Å; E97-L103 VanDerWaalsContact CB-CB 3.45Å; E97-L103 HydrophobicContact CB-CD2 4.49Å; E97-L103 PolarHBondContact O-N 3.48Å; E97-L103 VanDerWaalsContact O-N 3.08Å
98	K	89.5	Confident	87.1	Confident	71 Å²	71	97.5 Å²	97.5	31%	0.309	51%	0.506	S	S	.	.	H	α-helix	trans	-64.2	-46.6	172.2	-76.2	164	-167	167.7	0	112.2	E94 K95 K96 V100 G101 L103 Y105	E94-K98 VanDerWaalsContact O-CB 3.28Å; E94-K98 WeakPolarHBondContact O-CB 3.4Å; E94-K98 WeakPolarHBondContact O-CD 3.21Å; E94-K98 WeakPolarHBondContact O-CG 3.29Å; E94-K98 PolarHBondContact O-N 3.03Å; E94-K98 IonicContact OE2-NZ 3.62Å; K95-K98 PolarHBondContact O-N 2.83Å; K96-K98 VanDerWaalsContact C-N 3.33Å; K96-K98 PolarHBondContact O-N 2.95Å; K98-V100 VanDerWaalsContact C-N 3.33Å; K98-V100 PolarHBondContact O-N 3.34Å; K98-G101 PolarHBondContact O-N 2.91Å; K98-G101 VanDerWaalsContact O-N 3.1Å; K98-L103 WeakPolarHBondContact CA-O 3.42Å; K98-L103 HydrophobicContact CG-CB 4.37Å; K98-L103 HydrophobicContact CG-CD2 4.38Å; K98-L103 HydrophobicContact CG-CG 4.42Å; K98-L103 WeakPolarHBondContact CG-O 3.46Å; K98-Y105 HydrophobicContact CD-CE2 4.36Å; K98-Y105 VanDerWaalsContact CE-CZ 3.44Å; K98-Y105 VanDerWaalsContact CE-OH 3.26Å; K98-Y105 WeakPolarHBondContact CE-OH 3.23Å; K98-Y105 PolarHBondContact NZ-OH 2.93Å
99	T	85	Confident	86.2	Confident	127 Å²	127	94.8 Å²	94.8	78%	0.779	50%	0.498	S	S	*	.	H	α-helix	trans	-64.1	-38	179.2	-58.9	0	0	0	0	112.1	K95 K96 G101	K95-T99 WeakPolarHBondContact O-CB 3.39Å; K95-T99 PolarHBondContact O-N 3.23Å; K95-T99 PolarHBondContact O-OG1 2.82Å; K96-T99 PolarHBondContact O-N 2.99Å; T99-G101 VanDerWaalsContact C-N 3.29Å
100	V	87.5	Confident	85.1	Confident	108 Å²	108	94.9 Å²	94.9	66%	0.655	51%	0.508	S	S	*	.	H	α-helix	trans	-75.6	-20.4	175.4	178.7	0	0	0	0	111.8	K96 K98 I102	K96-V100 VanDerWaalsContact O-CG2 3.3Å; K96-V100 WeakPolarHBondContact O-CG2 3.28Å; K96-V100 PolarHBondContact O-N 3.21Å; K98-V100 VanDerWaalsContact C-N 3.33Å; K98-V100 PolarHBondContact O-N 3.34Å; V100-I102 HydrophobicContact CB-CD1 4.3Å; V100-I102 HydrophobicContact CB-CG1 4.39Å; V100-I102 HydrophobicContact CG1-CD1 3.78Å; V100-I102 HydrophobicContact CG1-CG1 3.9Å
101	G	83.7	Confident	83.8	Confident	47 Å²	47	92.3 Å²	92.3	49%	0.485	50%	0.5	S	S	.	.	T	Hydrogen-bonded Turn	trans	87	12.1	-176.9	0	0	0	0	0	114.6	E97 K98 T99	E97-G101 CarbonylContact O-C 3.54Å; E97-G101 PolarHBondContact O-N 3.48Å; K98-G101 PolarHBondContact O-N 2.91Å; K98-G101 VanDerWaalsContact O-N 3.1Å; T99-G101 VanDerWaalsContact C-N 3.29Å
102	I	88.6	Confident	82.5	Confident	125 Å²	125	92.9 Å²	92.9	64%	0.641	50%	0.504	S	S	*	.	S	Bend	trans	-73.9	-43.8	174.9	-65.9	167	0	0	0	110.5	E97 V100	E97-I102 HydrophobicContact CB-CB 4.22Å; E97-I102 HydrophobicContact CG-CG2 4.49Å; E97-I102 PolarHBondContact O-N 2.92Å; V100-I102 HydrophobicContact CB-CD1 4.3Å; V100-I102 HydrophobicContact CB-CG1 4.39Å; V100-I102 HydrophobicContact CG1-CD1 3.78Å; V100-I102 HydrophobicContact CG1-CG1 3.9Å
103	L	84.8	Confident	81.3	Confident	42 Å²	42	91.7 Å²	91.7	22%	0.22	51%	0.511	C	S	.	.			trans	-101.2	103.1	177.8	-176.8	65.6	0	0	0	109.2	E94 E97 K98 Y105	E94-L103 HydrophobicContact CB-CD2 3.65Å; E94-L103 HydrophobicContact CG-CD2 3.59Å; E97-L103 HydrophobicContact CB-CB 3.45Å; E97-L103 VanDerWaalsContact CB-CB 3.45Å; E97-L103 HydrophobicContact CB-CD2 4.49Å; E97-L103 PolarHBondContact O-N 3.48Å; E97-L103 VanDerWaalsContact O-N 3.08Å; K98-L103 WeakPolarHBondContact CA-O 3.42Å; K98-L103 HydrophobicContact CG-CB 4.37Å; K98-L103 HydrophobicContact CG-CD2 4.38Å; K98-L103 HydrophobicContact CG-CG 4.42Å; K98-L103 WeakPolarHBondContact CG-O 3.46Å; L103-Y105 HydrophobicContact CD1-CE1 4.28Å; L103-Y105 HydrophobicContact CD2-CE1 4.29Å; L103-Y105 HydrophobicContact CG-CE1 4.35Å
104	T	85.7	Confident	80.2	Confident	83 Å²	83	90.2 Å²	90.2	51%	0.509	52%	0.517	S	S	.	.			trans	-115.6	119.7	170.8	-4	0	0	0	0	107.8
105	Y	83.4	Confident	79.2	Confident	101 Å²	101	91.2 Å²	91.2	40%	0.396	54%	0.54	S	S	.	.			trans	-74.2	147.8	175.5	-62.6	-62.2	0	0	0	110.7	E94 K98 L103 G107 Q108	E94-Y105 PolarHBondContact OE2-OH 3.37Å; K98-Y105 HydrophobicContact CD-CE2 4.36Å; K98-Y105 VanDerWaalsContact CE-CZ 3.44Å; K98-Y105 VanDerWaalsContact CE-OH 3.26Å; K98-Y105 WeakPolarHBondContact CE-OH 3.23Å; K98-Y105 PolarHBondContact NZ-OH 2.93Å; L103-Y105 HydrophobicContact CD1-CE1 4.28Å; L103-Y105 HydrophobicContact CD2-CE1 4.29Å; L103-Y105 HydrophobicContact CG-CE1 4.35Å; Y105-G107 PolarHBondContact O-N 3.3Å; Y105-G107 VanDerWaalsContact O-N 3.17Å; Y105-Q108 WeakPolarHBondContact O-CB 3.23Å; Y105-Q108 PolarHBondContact O-N 3.26Å
106	L	83.8	Confident	78.4	Confident	188 Å²	188	92.4 Å²	92.4	98%	0.984	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	120.8	172.5	-173.8	64.5	0	0	0	109.6
107	G	76.7	Confident	77.8	Confident	65 Å²	65	94.3 Å²	94.3	67%	0.67	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	95.7	-12.8	-174.6	0	0	0	0	0	114.8	Y105 T109	Y105-G107 PolarHBondContact O-N 3.3Å; Y105-G107 VanDerWaalsContact O-N 3.17Å; G107-T109 PolarHBondContact O-N 2.65Å
108	Q	73.9	Confident	77.2	Confident	76 Å²	76	92.6 Å²	92.6	36%	0.355	55%	0.549	S	S	.	.			trans	-85.5	87.5	170.1	-161	167.3	25.9	0	0	107.9	Y105	Y105-Q108 WeakPolarHBondContact O-CB 3.23Å; Y105-Q108 PolarHBondContact O-N 3.26Å
109	T	67.4	Low	76.8	Confident	68 Å²	68	98.4 Å²	98.4	42%	0.417	57%	0.569	S	S	.	*			trans	-67.8	152.7	174.7	68.4	0	0	0	0	109.1	G107 L111 D112 A113	G107-T109 PolarHBondContact O-N 2.65Å; T109-L111 PolarHBondContact O-N 3.39Å; T109-D112 PolarHBondContact N-OD2 2.8Å; T109-D112 PolarHBondContact O-N 2.92Å; T109-D112 PolarHBondContact OG1-N 3.46Å; T109-D112 PolarHBondContact OG1-OD2 2.93Å; T109-A113 PolarHBondContact O-N 3.17Å
110	V	66	Low	76.7	Confident	124 Å²	124	98.9 Å²	98.9	75%	0.752	56%	0.558	S	S	*	*	H	α-helix	trans	-53.2	-25	174.6	179	0	0	0	0	111.3
111	L	63.9	Low	76.6	Confident	77 Å²	77	99 Å²	99	40%	0.403	56%	0.555	S	S	.	*	H	α-helix	trans	-70.2	-42	176.7	-59.5	168.3	0	0	0	112.2	T109 A113 A114 P118	T109-L111 PolarHBondContact O-N 3.39Å; L111-A113 VanDerWaalsContact C-N 3.35Å; L111-A113 PolarHBondContact O-N 2.88Å; L111-A114 PolarHBondContact O-N 3.41Å; L111-P118 HydrophobicContact CD1-CB 4.14Å; L111-P118 HydrophobicContact CD1-CG 4.13Å; L111-P118 HydrophobicContact CD2-CB 4.46Å
112	D	65.1	Low	76.6	Confident	97 Å²	97	98.7 Å²	98.7	52%	0.519	54%	0.543	S	S	.	.	H	α-helix	trans	-72.2	-29.1	-178.7	-60.3	-51	0	0	0	112.7	T109 A114 G115	T109-D112 PolarHBondContact N-OD2 2.8Å; T109-D112 PolarHBondContact O-N 2.92Å; T109-D112 PolarHBondContact OG1-N 3.46Å; T109-D112 PolarHBondContact OG1-OD2 2.93Å; D112-A114 VanDerWaalsContact C-N 3.31Å; D112-A114 PolarHBondContact O-N 3.39Å; D112-G115 PolarHBondContact O-N 2.96Å; D112-G115 VanDerWaalsContact O-N 3.1Å
113	A	64.9	Low	76.4	Confident	74 Å²	74	98.4 Å²	98.4	61%	0.612	54%	0.539	S	S	*	.	H	α-helix	trans	-66.6	-31.3	178.7	0	0	0	0	0	113	T109 L111 G115	T109-A113 PolarHBondContact O-N 3.17Å; L111-A113 VanDerWaalsContact C-N 3.35Å; L111-A113 PolarHBondContact O-N 2.88Å; A113-G115 VanDerWaalsContact C-N 3.26Å
114	A	68.5	Low	76.4	Confident	75 Å²	75	100.4 Å²	100.4	62%	0.62	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.3	-10.8	174.6	0	0	0	0	0	112.8	L111 D112 E116	L111-A114 PolarHBondContact O-N 3.41Å; D112-A114 VanDerWaalsContact C-N 3.31Å; D112-A114 PolarHBondContact O-N 3.39Å; A114-E116 PolarHBondContact O-N 3.37Å; A114-E116 VanDerWaalsContact O-N 3.09Å
115	G	70.9	Confident	76.4	Confident	67 Å²	67	105.4 Å²	105.4	69%	0.691	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	67.2	-0.1	-172.8	0	0	0	0	0	114.1	D112 A113	D112-G115 PolarHBondContact O-N 2.96Å; D112-G115 VanDerWaalsContact O-N 3.1Å; A113-G115 VanDerWaalsContact C-N 3.26Å
116	E	75.1	Confident	76.3	Confident	154 Å²	154	104.3 Å²	104.3	72%	0.72	57%	0.568	S	S	*	*			trans	-93.4	112.6	179.1	-70	-165.1	177.3	0	0	109.9	A114	A114-E116 PolarHBondContact O-N 3.37Å; A114-E116 VanDerWaalsContact O-N 3.09Å
117	K	78.7	Confident	75.9	Confident	160 Å²	160	98.2 Å²	98.2	70%	0.696	54%	0.535	S	S	*	.			trans	-59.6	131.8	172.8	-66.1	174.9	-179.2	-172.1	0	108.6	V122	K117-V122 HydrophobicContact CB-CG2 3.9Å
118	P	78.4	Confident	76.1	Confident	16 Å²	16	101.1 Å²	101.1	10%	0.104	53%	0.531	C	S	.	.			trans	-58.9	149.3	177.3	24.4	-32.8	0	0	0	110.6	L111 Y120 D121	L111-P118 HydrophobicContact CD1-CB 4.14Å; L111-P118 HydrophobicContact CD1-CG 4.13Å; L111-P118 HydrophobicContact CD2-CB 4.46Å; P118-Y120 HydrophobicContact CB-CD1 3.92Å; P118-Y120 HydrophobicContact CB-CD2 4.34Å; P118-Y120 HydrophobicContact CB-CE1 3.44Å; P118-Y120 VanDerWaalsContact CB-CE1 3.44Å; P118-Y120 HydrophobicContact CB-CE2 3.88Å; P118-Y120 HydrophobicContact CB-CG 4.36Å; P118-Y120 VanDerWaalsContact CB-CZ 3.4Å; P118-Y120 HydrophobicContact CG-CD2 4.11Å; P118-Y120 HydrophobicContact CG-CE1 3.95Å; P118-Y120 HydrophobicContact CG-CE2 3.43Å; P118-Y120 VanDerWaalsContact CG-CE2 3.43Å; P118-Y120 WeakPolarHBondContact CG-OH 3.43Å; P118-Y120 PolarHBondContact O-N 3.43Å; P118-D121 HydrophobicContact CG-CB 4.15Å; P118-D121 WeakPolarHBondContact CG-OD2 3.36Å; P118-D121 PolarHBondContact O-N 2.97Å
119	W	80.7	Confident	76.5	Confident	192 Å²	192	103.2 Å²	103.2	73%	0.727	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-26	-173.1	70.9	-89.6	0	0	0	114.1
120	Y	83.5	Confident	77.2	Confident	138 Å²	138	105.3 Å²	105.3	54%	0.541	55%	0.545	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-21.9	179.4	55.9	-106.6	0	0	0	114.3	P118	P118-Y120 HydrophobicContact CB-CD1 3.92Å; P118-Y120 HydrophobicContact CB-CD2 4.34Å; P118-Y120 HydrophobicContact CB-CE1 3.44Å; P118-Y120 VanDerWaalsContact CB-CE1 3.44Å; P118-Y120 HydrophobicContact CB-CE2 3.88Å; P118-Y120 HydrophobicContact CB-CG 4.36Å; P118-Y120 VanDerWaalsContact CB-CZ 3.4Å; P118-Y120 HydrophobicContact CG-CD2 4.11Å; P118-Y120 HydrophobicContact CG-CE1 3.95Å; P118-Y120 HydrophobicContact CG-CE2 3.43Å; P118-Y120 VanDerWaalsContact CG-CE2 3.43Å; P118-Y120 WeakPolarHBondContact CG-OH 3.43Å; P118-Y120 PolarHBondContact O-N 3.43Å
121	D	84.7	Confident	78	Confident	110 Å²	110	103.1 Å²	103.1	59%	0.588	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-16.9	175.8	-79.5	-14.4	0	0	0	112.1	P118	P118-D121 HydrophobicContact CG-CB 4.15Å; P118-D121 WeakPolarHBondContact CG-OD2 3.36Å; P118-D121 PolarHBondContact O-N 2.97Å
122	V	83.5	Confident	79	Confident	41 Å²	41	101.5 Å²	101.5	25%	0.248	52%	0.522	C	S	.	.	S	Bend	trans	-81.8	124.7	178.9	178.2	0	0	0	0	109.5	K117 T126	K117-V122 HydrophobicContact CB-CG2 3.9Å; V122-T126 HydrophobicContact CG1-CG2 3.63Å
123	H	85.3	Confident	80	Confident	118 Å²	118	100 Å²	100	55%	0.546	51%	0.512	S	S	.	.			trans	-53.5	136.3	178.4	-168.3	62.8	0	0	0	111.1	R125 T126 H127	H123-R125 PolarHBondContact O-N 3.4Å; H123-T126 WeakPolarHBondContact O-CA 3.34Å; H123-T126 WeakPolarHBondContact O-CB 3.3Å; H123-T126 PolarHBondContact O-N 2.92Å; H123-H127 PolarHBondContact O-N 3.04Å
124	P	84.7	Confident	81	Confident	85 Å²	85	104.1 Å²	104.1	55%	0.552	51%	0.511	S	S	*	.	H	α-helix	trans	-54.9	-29.2	-172.2	16.2	-32.9	0	0	0	114.8	H127 Q128	P124-H127 WeakPolarHBondContact O-CB 3.45Å; P124-H127 PolarHBondContact O-N 3.19Å; P124-Q128 WeakPolarHBondContact O-CG 3.44Å; P124-Q128 PolarHBondContact O-N 2.77Å
125	R	84.4	Confident	81.9	Confident	187 Å²	187	106.7 Å²	106.7	71%	0.706	51%	0.509	S	S	*	.	H	α-helix	trans	-66.5	-36.6	174.6	-63	-176.2	-179.8	-174.4	0.8	112.7	H123 H127 Q128 H129	H123-R125 PolarHBondContact O-N 3.4Å; R125-H127 VanDerWaalsContact C-N 3.34Å; R125-Q128 PolarHBondContact O-N 2.91Å; R125-H129 PolarHBondContact O-N 2.91Å; R125-H129 VanDerWaalsContact O-N 3.15Å
126	T	81.9	Confident	82.7	Confident	79 Å²	79	108.3 Å²	108.3	49%	0.485	50%	0.497	S	S	.	.	H	α-helix	trans	-70.1	-35.9	175	-50.4	0	0	0	0	110.4	V122 H123 Q128 H129 H130	V122-T126 HydrophobicContact CG1-CG2 3.63Å; H123-T126 WeakPolarHBondContact O-CA 3.34Å; H123-T126 WeakPolarHBondContact O-CB 3.3Å; H123-T126 PolarHBondContact O-N 2.92Å; T126-Q128 VanDerWaalsContact C-N 3.34Å; T126-Q128 PolarHBondContact O-N 2.9Å; T126-H129 PolarHBondContact O-N 3.4Å; T126-H130 WeakPolarHBondContact O-CB 3.39Å; T126-H130 PolarHBondContact O-N 3.34Å
127	H	76.5	Confident	83.3	Confident	60 Å²	60	105 Å²	105	28%	0.278	48%	0.484	S	S	.	.	H	α-helix	trans	-59.7	-43.7	171.8	-166	-88.2	0	0	0	111.5	H123 P124 R125 H129 H130 E131	H123-H127 PolarHBondContact O-N 3.04Å; P124-H127 WeakPolarHBondContact O-CB 3.45Å; P124-H127 PolarHBondContact O-N 3.19Å; R125-H127 VanDerWaalsContact C-N 3.34Å; H127-H129 PolarHBondContact O-N 3.43Å; H127-H130 PolarHBondContact O-N 2.89Å; H127-E131 IonicContact CE1-OE1 3.06Å; H127-E131 PolarHBondContact CE1-OE1 3.48Å; H127-E131 IonicContact ND1-OE1 2.76Å; H127-E131 PolarHBondContact ND1-OE1 3.33Å; H127-E131 IonicContact ND1-OE2 3.51Å; H127-E131 WeakPolarHBondContact O-CB 3.48Å; H127-E131 VanDerWaalsContact O-CG 3.32Å; H127-E131 WeakPolarHBondContact O-CG 3.31Å; H127-E131 PolarHBondContact O-N 3.36Å
128	Q	81.2	Confident	83.9	Confident	125 Å²	125	103.5 Å²	103.5	58%	0.584	48%	0.477	S	S	*	.	H	α-helix	trans	-61.3	-43.5	176	-69.8	173.1	-2.1	0	0	112.6	P124 R125 T126 E131 S132	P124-Q128 WeakPolarHBondContact O-CG 3.44Å; P124-Q128 PolarHBondContact O-N 2.77Å; R125-Q128 PolarHBondContact O-N 2.91Å; T126-Q128 VanDerWaalsContact C-N 3.34Å; T126-Q128 PolarHBondContact O-N 2.9Å; Q128-E131 PolarHBondContact O-N 3.3Å; Q128-S132 WeakPolarHBondContact O-CB 3.44Å; Q128-S132 PolarHBondContact O-N 2.92Å; Q128-S132 PolarHBondContact O-OG 3.44Å
129	H	82.2	Confident	84.5	Confident	120 Å²	120	108.2 Å²	108.2	56%	0.556	50%	0.498	S	S	*	.	H	α-helix	trans	-63	-48.1	176	-166	-75.8	0	0	0	110.6	R125 T126 H127 E131 S132 E133	R125-H129 PolarHBondContact O-N 2.91Å; R125-H129 VanDerWaalsContact O-N 3.15Å; T126-H129 PolarHBondContact O-N 3.4Å; H127-H129 PolarHBondContact O-N 3.43Å; H129-E131 VanDerWaalsContact C-N 3.34Å; H129-E131 PolarHBondContact O-N 2.91Å; H129-S132 PolarHBondContact O-N 3.27Å; H129-S132 VanDerWaalsContact O-N 3.14Å; H129-S132 PolarHBondContact O-OG 2.98Å; H129-E133 WeakPolarHBondContact O-CG 3.27Å; H129-E133 PolarHBondContact O-N 3.23Å
130	H	80.5	Confident	84.9	Confident	112 Å²	112	103.9 Å²	103.9	52%	0.519	49%	0.486	S	S	.	.	H	α-helix	trans	-62.4	-39.3	178.6	-166.3	-106.9	0	0	0	112.3	T126 H127 E133 R134	T126-H130 WeakPolarHBondContact O-CB 3.39Å; T126-H130 PolarHBondContact O-N 3.34Å; H127-H130 PolarHBondContact O-N 2.89Å; H130-E133 PolarHBondContact O-N 3.09Å; H130-R134 WeakPolarHBondContact O-CB 3.31Å; H130-R134 WeakPolarHBondContact O-CG 3.32Å; H130-R134 PolarHBondContact O-N 3.14Å
131	E	84	Confident	85.2	Confident	78 Å²	78	102.8 Å²	102.8	36%	0.364	49%	0.489	S	S	.	.	H	α-helix	trans	-63.5	-41.8	172.2	-79.7	-175.7	148.7	0	0	112.5	H127 Q128 H129 R134 K135	H127-E131 IonicContact CE1-OE1 3.06Å; H127-E131 PolarHBondContact CE1-OE1 3.48Å; H127-E131 IonicContact ND1-OE1 2.76Å; H127-E131 PolarHBondContact ND1-OE1 3.33Å; H127-E131 IonicContact ND1-OE2 3.51Å; H127-E131 WeakPolarHBondContact O-CB 3.48Å; H127-E131 VanDerWaalsContact O-CG 3.32Å; H127-E131 WeakPolarHBondContact O-CG 3.31Å; H127-E131 PolarHBondContact O-N 3.36Å; Q128-E131 PolarHBondContact O-N 3.3Å; H129-E131 VanDerWaalsContact C-N 3.34Å; H129-E131 PolarHBondContact O-N 2.91Å; E131-R134 PolarHBondContact O-N 2.85Å; E131-K135 WeakPolarHBondContact O-CB 3.41Å; E131-K135 VanDerWaalsContact O-CG 3.32Å; E131-K135 WeakPolarHBondContact O-CG 3.31Å; E131-K135 PolarHBondContact O-N 3.21Å
132	S	85.5	Confident	85.5	Confident	44 Å²	44	101.2 Å²	101.2	31%	0.308	48%	0.478	S	S	.	.	H	α-helix	trans	-64.5	-41.6	178	74.1	0	0	0	0	111.5	Q128 H129 K135 K136	Q128-S132 WeakPolarHBondContact O-CB 3.44Å; Q128-S132 PolarHBondContact O-N 2.92Å; Q128-S132 PolarHBondContact O-OG 3.44Å; H129-S132 PolarHBondContact O-N 3.27Å; H129-S132 VanDerWaalsContact O-N 3.14Å; H129-S132 PolarHBondContact O-OG 2.98Å; S132-K135 PolarHBondContact O-N 2.86Å; S132-K136 WeakPolarHBondContact O-CG 3.42Å; S132-K136 PolarHBondContact O-N 2.88Å
133	E	85.8	Confident	85.9	Confident	65 Å²	65	104.1 Å²	104.1	30%	0.304	49%	0.491	S	S	.	.	H	α-helix	trans	-66.8	-41.3	175	-67.9	-57.9	118.8	0	0	111.4	H129 H130 K135 K136 N137	H129-E133 WeakPolarHBondContact O-CG 3.27Å; H129-E133 PolarHBondContact O-N 3.23Å; H130-E133 PolarHBondContact O-N 3.09Å; E133-K135 VanDerWaalsContact C-N 3.32Å; E133-K135 PolarHBondContact O-N 3.46Å; E133-K136 PolarHBondContact O-N 3.18Å; E133-K136 IonicContact OE1-NZ 2.99Å; E133-K136 PolarHBondContact OE1-NZ 3.36Å; E133-N137 WeakPolarHBondContact O-CB 3.36Å; E133-N137 VanDerWaalsContact O-CG 3.26Å; E133-N137 PolarHBondContact O-N 2.99Å; E133-N137 PolarHBondContact O-ND2 2.69Å
134	R	84.8	Confident	86.1	Confident	160 Å²	160	104 Å²	104	60%	0.604	49%	0.489	S	S	*	.	H	α-helix	trans	-61.3	-39	173.4	-75	177.6	79	174.2	9.6	112.2	H130 E131 K138	H130-R134 WeakPolarHBondContact O-CB 3.31Å; H130-R134 WeakPolarHBondContact O-CG 3.32Å; H130-R134 PolarHBondContact O-N 3.14Å; E131-R134 PolarHBondContact O-N 2.85Å; R134-K138 VanDerWaalsContact O-CB 3.3Å; R134-K138 WeakPolarHBondContact O-CB 3.48Å; R134-K138 PolarHBondContact O-N 3.47Å
135	K	87.9	Confident	86.5	Confident	130 Å²	130	107.5 Å²	107.5	57%	0.565	50%	0.495	S	S	*	.	H	α-helix	trans	-66.8	-47.4	176	-75.6	174.8	-176.8	176.3	0	111.6	E131 S132 E133 N137 K138 E139	E131-K135 WeakPolarHBondContact O-CB 3.41Å; E131-K135 VanDerWaalsContact O-CG 3.32Å; E131-K135 WeakPolarHBondContact O-CG 3.31Å; E131-K135 PolarHBondContact O-N 3.21Å; S132-K135 PolarHBondContact O-N 2.86Å; E133-K135 VanDerWaalsContact C-N 3.32Å; E133-K135 PolarHBondContact O-N 3.46Å; K135-N137 PolarHBondContact O-N 3Å; K135-K138 WeakPolarHBondContact O-CB 3.14Å; K135-K138 PolarHBondContact O-N 3.4Å; K135-K138 VanDerWaalsContact O-N 3.14Å; K135-E139 WeakPolarHBondContact O-CG 3.41Å; K135-E139 PolarHBondContact O-N 3.41Å
136	K	88	Confident	86.9	Confident	101 Å²	101	105.3 Å²	105.3	44%	0.439	49%	0.491	S	S	.	.	H	α-helix	trans	-56.4	-49.3	174.1	-70.3	173.2	-171.2	168.9	0	111.5	S132 E133 K138 E139 E140	S132-K136 WeakPolarHBondContact O-CG 3.42Å; S132-K136 PolarHBondContact O-N 2.88Å; E133-K136 PolarHBondContact O-N 3.18Å; E133-K136 IonicContact OE1-NZ 2.99Å; E133-K136 PolarHBondContact OE1-NZ 3.36Å; K136-K138 VanDerWaalsContact C-N 3.29Å; K136-K138 PolarHBondContact O-N 2.86Å; K136-E139 PolarHBondContact O-N 3.37Å; K136-E140 WeakPolarHBondContact O-CG 3.43Å; K136-E140 PolarHBondContact O-N 3.19Å
137	N	86.5	Confident	87.3	Confident	83 Å²	83	104.9 Å²	104.9	44%	0.444	49%	0.488	S	S	.	.	H	α-helix	trans	-59.7	-40.7	177.1	-73.4	-17	0	0	0	111.7	E133 K135 L141	E133-N137 WeakPolarHBondContact O-CB 3.36Å; E133-N137 VanDerWaalsContact O-CG 3.26Å; E133-N137 PolarHBondContact O-N 2.99Å; E133-N137 PolarHBondContact O-ND2 2.69Å; K135-N137 PolarHBondContact O-N 3Å; N137-L141 WeakPolarHBondContact O-CB 3.27Å; N137-L141 WeakPolarHBondContact O-CG 3.33Å; N137-L141 PolarHBondContact O-N 2.99Å
138	K	90.9	Very high	87.9	Confident	129 Å²	129	107.4 Å²	107.4	56%	0.561	50%	0.503	S	S	*	.	H	α-helix	trans	-65	-44.5	175.9	-172.7	-178.3	178.3	-171	0	111.8	R134 K135 K136 L141 E142	R134-K138 VanDerWaalsContact O-CB 3.3Å; R134-K138 WeakPolarHBondContact O-CB 3.48Å; R134-K138 PolarHBondContact O-N 3.47Å; K135-K138 WeakPolarHBondContact O-CB 3.14Å; K135-K138 PolarHBondContact O-N 3.4Å; K135-K138 VanDerWaalsContact O-N 3.14Å; K136-K138 VanDerWaalsContact C-N 3.29Å; K136-K138 PolarHBondContact O-N 2.86Å; K138-L141 PolarHBondContact O-N 3.25Å; K138-E142 WeakPolarHBondContact CE-OE1 3.44Å; K138-E142 WeakPolarHBondContact O-CB 3.36Å; K138-E142 WeakPolarHBondContact O-CG 3.35Å; K138-E142 PolarHBondContact O-N 3.19Å
139	E	91	Very high	88.4	Confident	115 Å²	115	105.1 Å²	105.1	54%	0.537	51%	0.506	S	S	.	.	H	α-helix	trans	-61.8	-43.7	176.8	-73.4	169.7	-162.4	0	0	111.2	K135 K136 L141 E142 I143	K135-E139 WeakPolarHBondContact O-CG 3.41Å; K135-E139 PolarHBondContact O-N 3.41Å; K136-E139 PolarHBondContact O-N 3.37Å; E139-L141 PolarHBondContact O-N 3.01Å; E139-E142 PolarHBondContact O-N 3.4Å; E139-I143 WeakPolarHBondContact O-CD1 3.29Å; E139-I143 VanDerWaalsContact O-CG1 3.22Å; E139-I143 WeakPolarHBondContact O-CG1 3.39Å; E139-I143 PolarHBondContact O-N 2.92Å
140	E	89.9	Confident	88.9	Confident	102 Å²	102	102.3 Å²	102.3	48%	0.477	50%	0.495	S	S	.	.	H	α-helix	trans	-61.5	-43.6	174.1	-73.4	-174.9	-167	0	0	112.7	K136 E142 I143 K144	K136-E140 WeakPolarHBondContact O-CG 3.43Å; K136-E140 PolarHBondContact O-N 3.19Å; E140-E142 VanDerWaalsContact C-N 3.33Å; E140-I143 PolarHBondContact O-N 3.42Å; E140-K144 WeakPolarHBondContact O-CG 3.47Å; E140-K144 PolarHBondContact O-N 3.44Å
141	L	89.4	Confident	89.6	Confident	115 Å²	115	101.3 Å²	101.3	60%	0.602	50%	0.498	S	S	*	.	H	α-helix	trans	-64	-39	175.3	-73.1	172.6	0	0	0	111.4	N137 K138 E139 K144 K145	N137-L141 WeakPolarHBondContact O-CB 3.27Å; N137-L141 WeakPolarHBondContact O-CG 3.33Å; N137-L141 PolarHBondContact O-N 2.99Å; K138-L141 PolarHBondContact O-N 3.25Å; E139-L141 PolarHBondContact O-N 3.01Å; L141-K144 PolarHBondContact O-N 3.24Å; L141-K145 VanDerWaalsContact O-CB 3.31Å; L141-K145 WeakPolarHBondContact O-CB 3.46Å; L141-K145 PolarHBondContact O-N 3.32Å
142	E	91.1	Very high	90	Very high	77 Å²	77	102.2 Å²	102.2	36%	0.36	51%	0.505	S	S	.	.	H	α-helix	trans	-67.6	-39.6	175.5	-77.1	-177	-164.5	0	0	112.3	K138 E139 E140 K145 K146	K138-E142 WeakPolarHBondContact CE-OE1 3.44Å; K138-E142 WeakPolarHBondContact O-CB 3.36Å; K138-E142 WeakPolarHBondContact O-CG 3.35Å; K138-E142 PolarHBondContact O-N 3.19Å; E139-E142 PolarHBondContact O-N 3.4Å; E140-E142 VanDerWaalsContact C-N 3.33Å; E142-K145 PolarHBondContact O-N 3.44Å; E142-K146 WeakPolarHBondContact O-CB 3.42Å; E142-K146 WeakPolarHBondContact O-CG 3.49Å; E142-K146 PolarHBondContact O-N 3Å
143	I	91.6	Very high	90.3	Very high	101 Å²	101	102.1 Å²	102.1	52%	0.518	50%	0.503	S	S	.	.	H	α-helix	trans	-61.6	-48.5	173.8	-67.5	160.4	0	0	0	109.4	E139 E140 K145 K146 T147	E139-I143 WeakPolarHBondContact O-CD1 3.29Å; E139-I143 VanDerWaalsContact O-CG1 3.22Å; E139-I143 WeakPolarHBondContact O-CG1 3.39Å; E139-I143 PolarHBondContact O-N 2.92Å; E140-I143 PolarHBondContact O-N 3.42Å; I143-K145 VanDerWaalsContact C-N 3.31Å; I143-K145 PolarHBondContact O-N 3.44Å; I143-K146 PolarHBondContact O-N 3.42Å; I143-T147 HydrophobicContact CG2-CG2 4.34Å; I143-T147 WeakPolarHBondContact O-CG2 3.43Å; I143-T147 PolarHBondContact O-N 3.22Å; I143-T147 PolarHBondContact O-OG1 2.99Å
144	K	91.2	Very high	90.6	Very high	117 Å²	117	103.1 Å²	103.1	51%	0.509	51%	0.507	S	S	.	.	H	α-helix	trans	-59.6	-40.9	175.8	-72.4	171	-177.8	168.4	0	112	E140 L141 T147 L148	E140-K144 WeakPolarHBondContact O-CG 3.47Å; E140-K144 PolarHBondContact O-N 3.44Å; L141-K144 PolarHBondContact O-N 3.24Å; K144-T147 WeakPolarHBondContact CA-OG1 3.46Å; K144-T147 PolarHBondContact O-N 3.01Å; K144-T147 PolarHBondContact O-OG1 3.16Å; K144-L148 WeakPolarHBondContact O-CB 3.33Å; K144-L148 VanDerWaalsContact O-CG 3.23Å; K144-L148 WeakPolarHBondContact O-CG 3.44Å; K144-L148 PolarHBondContact O-N 3.08Å
145	K	92.2	Very high	91	Very high	158 Å²	158	100.6 Å²	100.6	69%	0.687	50%	0.504	S	S	*	.	H	α-helix	trans	-65.2	-41.7	176.6	-172.4	175.8	179.9	179.1	0	111.6	L141 E142 I143 A149	L141-K145 VanDerWaalsContact O-CB 3.31Å; L141-K145 WeakPolarHBondContact O-CB 3.46Å; L141-K145 PolarHBondContact O-N 3.32Å; E142-K145 PolarHBondContact O-N 3.44Å; I143-K145 VanDerWaalsContact C-N 3.31Å; I143-K145 PolarHBondContact O-N 3.44Å; K145-A149 VanDerWaalsContact O-CB 3.23Å; K145-A149 WeakPolarHBondContact O-CB 3.37Å; K145-A149 PolarHBondContact O-N 3.2Å
146	K	92.3	Very high	91.3	Very high	141 Å²	141	101 Å²	101	61%	0.613	51%	0.505	S	S	*	.	H	α-helix	trans	-66.8	-41.6	177.1	-72.5	170.7	-171.5	173.9	0	111.8	E142 I143 A149 D150	E142-K146 WeakPolarHBondContact O-CB 3.42Å; E142-K146 WeakPolarHBondContact O-CG 3.49Å; E142-K146 PolarHBondContact O-N 3Å; I143-K146 PolarHBondContact O-N 3.42Å; K146-A149 PolarHBondContact O-N 2.88Å; K146-D150 PolarHBondContact O-N 3.47Å
147	T	91.4	Very high	91.6	Very high	70 Å²	70	100.7 Å²	100.7	43%	0.429	50%	0.504	S	S	.	.	H	α-helix	trans	-68.4	-37	177.8	57	0	0	0	0	112.4	I143 K144 D150 T153	I143-T147 HydrophobicContact CG2-CG2 4.34Å; I143-T147 WeakPolarHBondContact O-CG2 3.43Å; I143-T147 PolarHBondContact O-N 3.22Å; I143-T147 PolarHBondContact O-OG1 2.99Å; K144-T147 WeakPolarHBondContact CA-OG1 3.46Å; K144-T147 PolarHBondContact O-N 3.01Å; K144-T147 PolarHBondContact O-OG1 3.16Å; T147-D150 PolarHBondContact O-N 3.43Å; T147-T153 WeakPolarHBondContact O-CB 3.45Å; T147-T153 PolarHBondContact O-OG1 3.37Å
148	L	89.1	Confident	92	Very high	112 Å²	112	100.2 Å²	100.2	59%	0.586	50%	0.504	S	S	*	.	H	α-helix	trans	-70.2	-33.4	173.8	-71.8	175.8	0	0	0	112.7	K144 D150	K144-L148 WeakPolarHBondContact O-CB 3.33Å; K144-L148 VanDerWaalsContact O-CG 3.23Å; K144-L148 WeakPolarHBondContact O-CG 3.44Å; K144-L148 PolarHBondContact O-N 3.08Å; L148-D150 VanDerWaalsContact C-N 3.29Å
149	A	90.3	Very high	92.2	Very high	78 Å²	78	98.9 Å²	98.9	65%	0.645	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-4.2	176.4	0	0	0	0	0	113.6	K145 K146 P151	K145-A149 VanDerWaalsContact O-CB 3.23Å; K145-A149 WeakPolarHBondContact O-CB 3.37Å; K145-A149 PolarHBondContact O-N 3.2Å; K146-A149 PolarHBondContact O-N 2.88Å; A149-P151 WeakPolarHBondContact O-CD 3.44Å
150	D	93.3	Very high	92.4	Very high	60 Å²	60	98.6 Å²	98.6	32%	0.321	50%	0.498	S	S	.	.			trans	-78.7	118	179.1	-177.4	-2.6	0	0	0	110.6	K146 T147 L148 L152 T153	K146-D150 PolarHBondContact O-N 3.47Å; T147-D150 PolarHBondContact O-N 3.43Å; L148-D150 VanDerWaalsContact C-N 3.29Å; D150-L152 PolarHBondContact O-N 2.86Å; D150-L152 WeakPolarHBondContact OD1-CB 3.26Å; D150-L152 PolarHBondContact OD1-N 2.77Å; D150-T153 WeakPolarHBondContact O-CB 3.3Å; D150-T153 PolarHBondContact O-N 3.46Å
151	P	94.7	Very high	92.6	Very high	91 Å²	91	99.7 Å²	99.7	59%	0.591	51%	0.505	S	S	*	.	H	α-helix	trans	-59.3	-27.4	177.7	24.7	-35	0	0	0	113.3	A149 T153 E154 M155	A149-P151 WeakPolarHBondContact O-CD 3.44Å; P151-T153 VanDerWaalsContact C-N 3.29Å; P151-T153 PolarHBondContact O-N 2.84Å; P151-E154 PolarHBondContact O-N 2.97Å; P151-M155 WeakPolarHBondContact O-CG 3.28Å; P151-M155 PolarHBondContact O-N 3.3Å
152	L	93.3	Very high	92.9	Very high	98 Å²	98	101.2 Å²	101.2	51%	0.513	51%	0.507	S	S	.	.	H	α-helix	trans	-67.1	-32.4	176.6	-67.9	175.4	0	0	0	112	D150 M155 K156	D150-L152 PolarHBondContact O-N 2.86Å; D150-L152 WeakPolarHBondContact OD1-CB 3.26Å; D150-L152 PolarHBondContact OD1-N 2.77Å; L152-M155 HydrophobicContact CD2-SD 4.3Å; L152-M155 PolarHBondContact O-N 3.22Å; L152-K156 WeakPolarHBondContact O-CB 3.27Å; L152-K156 VanDerWaalsContact O-CG 3.27Å; L152-K156 WeakPolarHBondContact O-CG 3.38Å; L152-K156 PolarHBondContact O-N 2.96Å
153	T	92.4	Very high	93.1	Very high	41 Å²	41	103.1 Å²	103.1	25%	0.252	51%	0.514	S	S	.	.	H	α-helix	trans	-64.7	-43	174.4	-56.8	0	0	0	0	110.5	T147 D150 P151 K156 K157	T147-T153 WeakPolarHBondContact O-CB 3.45Å; T147-T153 PolarHBondContact O-OG1 3.37Å; D150-T153 WeakPolarHBondContact O-CB 3.3Å; D150-T153 PolarHBondContact O-N 3.46Å; P151-T153 VanDerWaalsContact C-N 3.29Å; P151-T153 PolarHBondContact O-N 2.84Å; T153-K156 PolarHBondContact O-N 3.48Å; T153-K157 WeakPolarHBondContact O-CG 3.43Å; T153-K157 PolarHBondContact O-N 3.17Å; T153-K157 VanDerWaalsContact O-N 3.14Å
154	E	91	Very high	93.2	Very high	86 Å²	86	106.5 Å²	106.5	40%	0.402	52%	0.521	S	S	.	.	H	α-helix	trans	-66.1	-43	176	-68.6	-56.6	133.9	0	0	112	P151 K156 K157 V158	P151-E154 PolarHBondContact O-N 2.97Å; E154-K156 PolarHBondContact O-N 3.37Å; E154-K157 WeakPolarHBondContact O-CB 3.49Å; E154-K157 PolarHBondContact O-N 3.37Å; E154-K157 IonicContact OE1-NZ 3.23Å; E154-K157 PolarHBondContact OE1-NZ 2.84Å; E154-K157 IonicContact OE2-NZ 3.05Å; E154-V158 WeakPolarHBondContact O-CG2 3.41Å; E154-V158 PolarHBondContact O-N 2.94Å; E154-V158 VanDerWaalsContact O-N 3.08Å
155	M	94.1	Very high	93.3	Very high	108 Å²	108	104.6 Å²	104.6	53%	0.532	52%	0.522	S	S	.	.	H	α-helix	trans	-59.5	-44.1	175.2	-72	178.3	65.4	0	0	112.2	P151 L152 K157 V158 E159	P151-M155 WeakPolarHBondContact O-CG 3.28Å; P151-M155 PolarHBondContact O-N 3.3Å; L152-M155 HydrophobicContact CD2-SD 4.3Å; L152-M155 PolarHBondContact O-N 3.22Å; M155-K157 VanDerWaalsContact C-N 3.34Å; M155-K157 PolarHBondContact O-N 3.5Å; M155-V158 PolarHBondContact O-N 3.12Å; M155-V158 VanDerWaalsContact O-N 3.16Å; M155-E159 WeakPolarHBondContact O-CG 3.39Å; M155-E159 PolarHBondContact O-N 3.48Å
156	K	94.3	Very high	93.5	Very high	137 Å²	137	105 Å²	105	60%	0.596	52%	0.523	S	S	*	.	H	α-helix	trans	-60.3	-41.6	176	-75.3	172.5	-177.8	175.2	0	112.1	L152 T153 E154 V158 E159 E160	L152-K156 WeakPolarHBondContact O-CB 3.27Å; L152-K156 VanDerWaalsContact O-CG 3.27Å; L152-K156 WeakPolarHBondContact O-CG 3.38Å; L152-K156 PolarHBondContact O-N 2.96Å; T153-K156 PolarHBondContact O-N 3.48Å; E154-K156 PolarHBondContact O-N 3.37Å; K156-V158 VanDerWaalsContact C-N 3.31Å; K156-V158 PolarHBondContact O-N 3.4Å; K156-E159 PolarHBondContact O-N 2.7Å; K156-E160 WeakPolarHBondContact O-CG 3.48Å; K156-E160 PolarHBondContact O-N 2.93Å
157	K	93.6	Very high	93.6	Very high	95 Å²	95	101.3 Å²	101.3	41%	0.413	51%	0.508	S	S	.	.	H	α-helix	trans	-59.8	-42.8	175	-70.3	172.1	-174.3	169.2	0	111.5	T153 E154 M155 E160 M161	T153-K157 WeakPolarHBondContact O-CG 3.43Å; T153-K157 PolarHBondContact O-N 3.17Å; T153-K157 VanDerWaalsContact O-N 3.14Å; E154-K157 WeakPolarHBondContact O-CB 3.49Å; E154-K157 PolarHBondContact O-N 3.37Å; E154-K157 IonicContact OE1-NZ 3.23Å; E154-K157 PolarHBondContact OE1-NZ 2.84Å; E154-K157 IonicContact OE2-NZ 3.05Å; M155-K157 VanDerWaalsContact C-N 3.34Å; M155-K157 PolarHBondContact O-N 3.5Å; K157-E160 PolarHBondContact O-N 3.01Å; K157-M161 VanDerWaalsContact O-CG 3.3Å; K157-M161 WeakPolarHBondContact O-CG 3.43Å; K157-M161 PolarHBondContact O-N 3.43Å
158	V	94.6	Very high	93.7	Very high	73 Å²	73	102.3 Å²	102.3	44%	0.442	51%	0.511	S	S	.	.	H	α-helix	trans	-66.2	-43.2	179.1	172.7	0	0	0	0	111.4	E154 M155 K156 E160 M161 F162	E154-V158 WeakPolarHBondContact O-CG2 3.41Å; E154-V158 PolarHBondContact O-N 2.94Å; E154-V158 VanDerWaalsContact O-N 3.08Å; M155-V158 PolarHBondContact O-N 3.12Å; M155-V158 VanDerWaalsContact O-N 3.16Å; K156-V158 VanDerWaalsContact C-N 3.31Å; K156-V158 PolarHBondContact O-N 3.4Å; V158-E160 PolarHBondContact O-N 2.84Å; V158-M161 WeakPolarHBondContact O-CB 3.17Å; V158-M161 PolarHBondContact O-N 3.28Å; V158-F162 HydrophobicContact CG1-CD2 3.67Å; V158-F162 HydrophobicContact CG1-CE2 3.37Å; V158-F162 WeakPolarHBondContact O-CD2 3.3Å; V158-F162 PolarHBondContact O-N 2.97Å
159	E	95.5	Very high	93.8	Very high	101 Å²	101	103.1 Å²	103.1	47%	0.472	51%	0.51	S	S	.	.	H	α-helix	trans	-59.2	-45.2	174.4	-73.4	179.3	-175	0	0	112.2	M155 K156 M161 F162 K163	M155-E159 WeakPolarHBondContact O-CG 3.39Å; M155-E159 PolarHBondContact O-N 3.48Å; K156-E159 PolarHBondContact O-N 2.7Å; E159-M161 VanDerWaalsContact C-N 3.32Å; E159-M161 PolarHBondContact O-N 3.21Å; E159-F162 PolarHBondContact O-N 3.47Å; E159-K163 WeakPolarHBondContact O-CG 3.36Å; E159-K163 PolarHBondContact O-N 2.92Å
160	E	95.5	Very high	94	Very high	109 Å²	109	106.7 Å²	106.7	51%	0.509	51%	0.507	S	S	.	.	H	α-helix	trans	-62.1	-39	175.7	-70.9	-57.8	126.6	0	0	112	K156 K157 V158 K163 R164	K156-E160 WeakPolarHBondContact O-CG 3.48Å; K156-E160 PolarHBondContact O-N 2.93Å; K157-E160 PolarHBondContact O-N 3.01Å; V158-E160 PolarHBondContact O-N 2.84Å; E160-K163 PolarHBondContact O-N 2.9Å; E160-K163 IonicContact OE1-NZ 3.49Å; E160-K163 PolarHBondContact OE1-NZ 3.46Å; E160-R164 VanDerWaalsContact O-CB 3.32Å; E160-R164 WeakPolarHBondContact O-CB 3.32Å; E160-R164 PolarHBondContact O-N 3.23Å
161	M	93.7	Very high	93.9	Very high	126 Å²	126	108.9 Å²	108.9	62%	0.621	52%	0.515	S	S	*	.	H	α-helix	trans	-61.3	-43.7	173.2	-74.3	-70.1	-68.9	0	0	112.2	K157 V158 E159 R164 S165	K157-M161 VanDerWaalsContact O-CG 3.3Å; K157-M161 WeakPolarHBondContact O-CG 3.43Å; K157-M161 PolarHBondContact O-N 3.43Å; V158-M161 WeakPolarHBondContact O-CB 3.17Å; V158-M161 PolarHBondContact O-N 3.28Å; E159-M161 VanDerWaalsContact C-N 3.32Å; E159-M161 PolarHBondContact O-N 3.21Å; M161-R164 PolarHBondContact O-N 2.88Å; M161-S165 WeakPolarHBondContact O-CB 3.48Å; M161-S165 PolarHBondContact O-N 3.33Å
162	F	95.7	Very high	93.6	Very high	147 Å²	147	107.8 Å²	107.8	65%	0.645	51%	0.509	S	S	*	.	H	α-helix	trans	-66.3	-42.1	176.1	-78.7	-65.6	0	0	0	112.5	V158 E159 S165 K166	V158-F162 HydrophobicContact CG1-CD2 3.67Å; V158-F162 HydrophobicContact CG1-CE2 3.37Å; V158-F162 WeakPolarHBondContact O-CD2 3.3Å; V158-F162 PolarHBondContact O-N 2.97Å; E159-F162 PolarHBondContact O-N 3.47Å; F162-S165 PolarHBondContact O-N 2.91Å; F162-K166 WeakPolarHBondContact O-CB 3.37Å; F162-K166 PolarHBondContact O-N 3.37Å
163	K	95.5	Very high	93.4	Very high	116 Å²	116	107.7 Å²	107.7	50%	0.504	51%	0.506	S	S	.	.	H	α-helix	trans	-59.5	-47.2	174.3	-71.5	174.8	-165.7	166.2	0	110.9	E159 E160 S165 K166 E167	E159-K163 WeakPolarHBondContact O-CG 3.36Å; E159-K163 PolarHBondContact O-N 2.92Å; E160-K163 PolarHBondContact O-N 2.9Å; E160-K163 IonicContact OE1-NZ 3.49Å; E160-K163 PolarHBondContact OE1-NZ 3.46Å; K163-S165 PolarHBondContact O-N 2.92Å; K163-K166 PolarHBondContact O-N 3.17Å; K163-E167 WeakPolarHBondContact O-CB 3.42Å; K163-E167 PolarHBondContact O-N 3.39Å
164	R	94.8	Very high	93.3	Very high	173 Å²	173	108.3 Å²	108.3	65%	0.653	52%	0.515	S	S	*	.	H	α-helix	trans	-60.9	-43.2	176.4	-173.6	179.1	179	-179.9	0.7	111.8	E160 M161 E167 L168	E160-R164 VanDerWaalsContact O-CB 3.32Å; E160-R164 WeakPolarHBondContact O-CB 3.32Å; E160-R164 PolarHBondContact O-N 3.23Å; M161-R164 PolarHBondContact O-N 2.88Å; R164-E167 PolarHBondContact O-N 2.91Å; R164-L168 HydrophobicContact CG-CD1 4.11Å; R164-L168 WeakPolarHBondContact O-CB 3.45Å; R164-L168 WeakPolarHBondContact O-CG 3.29Å; R164-L168 PolarHBondContact O-N 2.9Å
165	S	93.2	Very high	93.2	Very high	76 Å²	76	106.2 Å²	106.2	53%	0.531	51%	0.513	S	S	.	.	H	α-helix	trans	-64.6	-39.3	177	-173.3	0	0	0	0	112.5	M161 F162 K163 K169	M161-S165 WeakPolarHBondContact O-CB 3.48Å; M161-S165 PolarHBondContact O-N 3.33Å; F162-S165 PolarHBondContact O-N 2.91Å; K163-S165 PolarHBondContact O-N 2.92Å; S165-K169 WeakPolarHBondContact O-CB 3.3Å; S165-K169 PolarHBondContact O-N 3.4Å
166	K	94.9	Very high	92.8	Very high	166 Å²	166	105.8 Å²	105.8	72%	0.722	51%	0.509	S	S	*	.	H	α-helix	trans	-65.7	-42.6	175.9	-175.2	178.3	179.1	-179	0	111.1	F162 K163 K169 R170	F162-K166 WeakPolarHBondContact O-CB 3.37Å; F162-K166 PolarHBondContact O-N 3.37Å; K163-K166 PolarHBondContact O-N 3.17Å; K166-K169 PolarHBondContact O-N 3.45Å; K166-R170 PolarHBondContact O-N 3.1Å
167	E	95	Very high	92.5	Very high	64 Å²	64	104 Å²	104	30%	0.299	51%	0.506	S	S	.	.	H	α-helix	trans	-66.4	-43.8	177.3	-178.4	56.2	-159.1	0	0	111.8	K163 R164 K169 R170 Q171	K163-E167 WeakPolarHBondContact O-CB 3.42Å; K163-E167 PolarHBondContact O-N 3.39Å; R164-E167 PolarHBondContact O-N 2.91Å; E167-K169 VanDerWaalsContact C-N 3.29Å; E167-K169 PolarHBondContact O-N 2.9Å; E167-R170 VanDerWaalsContact CD-NH2 3.3Å; E167-R170 WeakPolarHBondContact O-CB 3.42Å; E167-R170 PolarHBondContact O-N 3.41Å; E167-R170 VanDerWaalsContact O-N 3.14Å; E167-R170 IonicContact OE1-CZ 3.26Å; E167-R170 IonicContact OE1-NE 3.5Å; E167-R170 IonicContact OE1-NH2 3.71Å; E167-R170 PolarHBondContact OE1-NH2 3.42Å; E167-R170 IonicContact OE2-CZ 3.25Å; E167-R170 VanDerWaalsContact OE2-CZ 3.26Å; E167-R170 IonicContact OE2-NE 2.65Å; E167-R170 PolarHBondContact OE2-NE 3.09Å; E167-R170 IonicContact OE2-NH2 2.8Å; E167-R170 PolarHBondContact OE2-NH2 3.38Å; E167-Q171 HydrophobicContact CG-CG 4.46Å; E167-Q171 WeakPolarHBondContact O-CB 3.37Å; E167-Q171 WeakPolarHBondContact O-CG 3.34Å; E167-Q171 PolarHBondContact O-N 3.12Å; E167-Q171 PolarHBondContact OE1-NE2 3.46Å
168	L	92.9	Very high	92.2	Very high	92 Å²	92	106.3 Å²	106.3	48%	0.482	52%	0.518	S	S	.	.	H	α-helix	trans	-58.2	-41.9	173.8	-79.2	166.6	0	0	0	111.9	R164 Q171 S172	R164-L168 HydrophobicContact CG-CD1 4.11Å; R164-L168 WeakPolarHBondContact O-CB 3.45Å; R164-L168 WeakPolarHBondContact O-CG 3.29Å; R164-L168 PolarHBondContact O-N 2.9Å; L168-Q171 PolarHBondContact O-N 2.9Å; L168-S172 WeakPolarHBondContact O-CB 3.43Å; L168-S172 PolarHBondContact O-N 2.9Å; L168-S172 PolarHBondContact O-OG 3.42Å
169	K	92.6	Very high	91.9	Very high	128 Å²	128	105.5 Å²	105.5	56%	0.557	51%	0.507	S	S	*	.	H	α-helix	trans	-63.1	-43.9	175.2	-174.3	176.4	177.6	178.3	0	111.6	S165 K166 E167 Q171 S172 E173	S165-K169 WeakPolarHBondContact O-CB 3.3Å; S165-K169 PolarHBondContact O-N 3.4Å; K166-K169 PolarHBondContact O-N 3.45Å; E167-K169 VanDerWaalsContact C-N 3.29Å; E167-K169 PolarHBondContact O-N 2.9Å; K169-Q171 VanDerWaalsContact C-N 3.35Å; K169-S172 WeakPolarHBondContact CA-OG 3.42Å; K169-S172 PolarHBondContact O-N 3.07Å; K169-S172 PolarHBondContact O-OG 3.35Å; K169-E173 WeakPolarHBondContact CE-OE1 3.5Å; K169-E173 WeakPolarHBondContact O-CB 3.4Å; K169-E173 VanDerWaalsContact O-CG 3.3Å; K169-E173 WeakPolarHBondContact O-CG 3.39Å; K169-E173 PolarHBondContact O-N 3.35Å
170	R	93.5	Very high	91.5	Very high	154 Å²	154	100.8 Å²	100.8	58%	0.581	49%	0.485	S	S	*	.	H	α-helix	trans	-61.6	-42.8	175.8	-170.7	-178.8	73.4	128.2	6.8	111.6	K166 E167 E173 A174	K166-R170 PolarHBondContact O-N 3.1Å; E167-R170 VanDerWaalsContact CD-NH2 3.3Å; E167-R170 WeakPolarHBondContact O-CB 3.42Å; E167-R170 PolarHBondContact O-N 3.41Å; E167-R170 VanDerWaalsContact O-N 3.14Å; E167-R170 IonicContact OE1-CZ 3.26Å; E167-R170 IonicContact OE1-NE 3.5Å; E167-R170 IonicContact OE1-NH2 3.71Å; E167-R170 PolarHBondContact OE1-NH2 3.42Å; E167-R170 IonicContact OE2-CZ 3.25Å; E167-R170 VanDerWaalsContact OE2-CZ 3.26Å; E167-R170 IonicContact OE2-NE 2.65Å; E167-R170 PolarHBondContact OE2-NE 3.09Å; E167-R170 IonicContact OE2-NH2 2.8Å; E167-R170 PolarHBondContact OE2-NH2 3.38Å; R170-E173 PolarHBondContact O-N 3.14Å; R170-A174 VanDerWaalsContact O-CB 3.27Å; R170-A174 WeakPolarHBondContact O-CB 3.41Å; R170-A174 PolarHBondContact O-N 3.02Å
171	Q	91.4	Very high	91.2	Very high	106 Å²	106	98.2 Å²	98.2	50%	0.495	48%	0.479	S	S	.	.	H	α-helix	trans	-65.7	-42.7	176.7	-72.4	177.1	7.2	0	0	111.7	E167 L168 K169 A174 A175	E167-Q171 HydrophobicContact CG-CG 4.46Å; E167-Q171 WeakPolarHBondContact O-CB 3.37Å; E167-Q171 WeakPolarHBondContact O-CG 3.34Å; E167-Q171 PolarHBondContact O-N 3.12Å; E167-Q171 PolarHBondContact OE1-NE2 3.46Å; L168-Q171 PolarHBondContact O-N 2.9Å; K169-Q171 VanDerWaalsContact C-N 3.35Å; Q171-A174 PolarHBondContact O-N 3.31Å; Q171-A175 VanDerWaalsContact O-CB 3.29Å; Q171-A175 WeakPolarHBondContact O-CB 3.24Å; Q171-A175 PolarHBondContact O-N 2.89Å
172	S	88.8	Confident	91	Very high	68 Å²	68	94 Å²	94	48%	0.476	47%	0.465	S	S	.	.	H	α-helix	trans	-65	-41.1	176	61.6	0	0	0	0	112.4	L168 K169 A175 E176	L168-S172 WeakPolarHBondContact O-CB 3.43Å; L168-S172 PolarHBondContact O-N 2.9Å; L168-S172 PolarHBondContact O-OG 3.42Å; K169-S172 WeakPolarHBondContact CA-OG 3.42Å; K169-S172 PolarHBondContact O-N 3.07Å; K169-S172 PolarHBondContact O-OG 3.35Å; S172-A175 PolarHBondContact O-N 3.13Å; S172-E176 WeakPolarHBondContact O-CB 3.44Å; S172-E176 PolarHBondContact O-N 2.85Å
173	E	88.9	Confident	90.6	Very high	95 Å²	95	87.1 Å²	87.1	44%	0.444	44%	0.435	S	S	.	.	H	α-helix	trans	-65.8	-42	175.9	-74	174.4	-173.5	0	0	111.1	K169 R170 E176 L177	K169-E173 WeakPolarHBondContact CE-OE1 3.5Å; K169-E173 WeakPolarHBondContact O-CB 3.4Å; K169-E173 VanDerWaalsContact O-CG 3.3Å; K169-E173 WeakPolarHBondContact O-CG 3.39Å; K169-E173 PolarHBondContact O-N 3.35Å; R170-E173 PolarHBondContact O-N 3.14Å; E173-E176 PolarHBondContact O-N 2.89Å; E173-L177 WeakPolarHBondContact O-CG 3.34Å; E173-L177 PolarHBondContact O-N 3.27Å
174	A	90.4	Very high	90.1	Very high	54 Å²	54	83 Å²	83	45%	0.446	42%	0.418	S	S	.	.	H	α-helix	trans	-64.3	-43	176	0	0	0	0	0	112.2	R170 Q171 E176 L177 E178	R170-A174 VanDerWaalsContact O-CB 3.27Å; R170-A174 WeakPolarHBondContact O-CB 3.41Å; R170-A174 PolarHBondContact O-N 3.02Å; Q171-A174 PolarHBondContact O-N 3.31Å; A174-E176 VanDerWaalsContact C-N 3.34Å; A174-L177 PolarHBondContact O-N 3.47Å; A174-E178 WeakPolarHBondContact O-CB 3.43Å; A174-E178 PolarHBondContact O-N 3.45Å
175	A	88.9	Confident	89.7	Confident	42 Å²	42	82 Å²	82	35%	0.347	42%	0.42	S	S	.	.	H	α-helix	trans	-66.4	-34.8	176.1	0	0	0	0	0	112.3	Q171 S172 R179	Q171-A175 VanDerWaalsContact O-CB 3.29Å; Q171-A175 WeakPolarHBondContact O-CB 3.24Å; Q171-A175 PolarHBondContact O-N 2.89Å; S172-A175 PolarHBondContact O-N 3.13Å; A175-R179 WeakPolarHBondContact O-CB 3.35Å; A175-R179 PolarHBondContact O-N 2.86Å
176	E	85.3	Confident	89.4	Confident	99 Å²	99	81.2 Å²	81.2	46%	0.463	42%	0.418	S	S	.	.	H	α-helix	trans	-66.6	-42.2	174.2	-170.7	174.6	-172.4	0	0	111.5	S172 E173 A174 R179 A180	S172-E176 WeakPolarHBondContact O-CB 3.44Å; S172-E176 PolarHBondContact O-N 2.85Å; E173-E176 PolarHBondContact O-N 2.89Å; A174-E176 VanDerWaalsContact C-N 3.34Å; E176-R179 PolarHBondContact O-N 3.37Å; E176-A180 WeakPolarHBondContact O-CB 3.44Å; E176-A180 PolarHBondContact O-N 3.36Å
177	L	88.1	Confident	89	Confident	99 Å²	99	74.2 Å²	74.2	52%	0.518	39%	0.389	S	S	.	.	H	α-helix	trans	-64.1	-43	173.6	-72.6	172.7	0	0	0	112.3	E173 A174 R179 A180 S181 D276	E173-L177 WeakPolarHBondContact O-CG 3.34Å; E173-L177 PolarHBondContact O-N 3.27Å; A174-L177 PolarHBondContact O-N 3.47Å; L177-R179 VanDerWaalsContact C-N 3.34Å; L177-A180 PolarHBondContact O-N 3.43Å; L177-S181 WeakPolarHBondContact O-CB 3.47Å; L177-S181 PolarHBondContact O-N 3.02Å; L177-D276 WeakPolarHBondContact CD2-OD2 3.32Å
178	E	88	Confident	88.5	Confident	145 Å²	145	76.3 Å²	76.3	68%	0.678	41%	0.408	S	S	*	.	H	α-helix	trans	-61.6	-43.8	176.2	-175.4	175.9	-172.4	0	0	111.2	A174 S181 A182	A174-E178 WeakPolarHBondContact O-CB 3.43Å; A174-E178 PolarHBondContact O-N 3.45Å; E178-S181 WeakPolarHBondContact O-CB 3.48Å; E178-S181 PolarHBondContact O-N 2.86Å; E178-A182 WeakPolarHBondContact O-CB 3.41Å; E178-A182 PolarHBondContact O-N 3.36Å
179	R	86.6	Confident	88.2	Confident	56 Å²	56	78.1 Å²	78.1	21%	0.211	42%	0.418	C	S	.	.	H	α-helix	trans	-60.5	-47.5	174.9	-171.6	-175.3	-61.1	125.5	0	111.6	A175 E176 L177 S181 A182 C183 V280 P293	A175-R179 WeakPolarHBondContact O-CB 3.35Å; A175-R179 PolarHBondContact O-N 2.86Å; E176-R179 PolarHBondContact O-N 3.37Å; L177-R179 VanDerWaalsContact C-N 3.34Å; R179-S181 VanDerWaalsContact C-N 3.33Å; R179-S181 PolarHBondContact O-N 3.11Å; R179-A182 PolarHBondContact O-N 2.9Å; R179-C183 PolarHBondContact O-N 3.16Å; R179-C183 PolarHBondContact O-SG 3.11Å; R179-V280 HydrophobicContact CG-CG2 4.31Å; R179-P293 VanDerWaalsContact NH2-CG 3.29Å
180	A	88.8	Confident	87.7	Confident	1 Å²	1	73.7 Å²	73.7	1%	0.008	40%	0.4	C	S	.	.	H	α-helix	trans	-60.6	-43.6	177.3	0	0	0	0	0	112	E176 L177 A182 C183 I184 D276 V280	E176-A180 WeakPolarHBondContact O-CB 3.44Å; E176-A180 PolarHBondContact O-N 3.36Å; L177-A180 PolarHBondContact O-N 3.43Å; A180-A182 VanDerWaalsContact C-N 3.34Å; A180-A182 PolarHBondContact O-N 3.25Å; A180-C183 WeakPolarHBondContact O-CB 3.33Å; A180-C183 PolarHBondContact O-N 3.07Å; A180-I184 WeakPolarHBondContact O-CG1 3.46Å; A180-I184 PolarHBondContact O-N 3.47Å; A180-D276 HydrophobicContact CB-CB 3.53Å; A180-V280 HydrophobicContact CB-CG2 3.82Å
181	S	88.3	Confident	87.3	Confident	55 Å²	55	68.7 Å²	68.7	39%	0.385	38%	0.383	S	S	.	.	H	α-helix	trans	-58.2	-45.4	174.5	-176.1	0	0	0	0	111.4	L177 E178 R179 C183 I184 H185	L177-S181 WeakPolarHBondContact O-CB 3.47Å; L177-S181 PolarHBondContact O-N 3.02Å; E178-S181 WeakPolarHBondContact O-CB 3.48Å; E178-S181 PolarHBondContact O-N 2.86Å; R179-S181 VanDerWaalsContact C-N 3.33Å; R179-S181 PolarHBondContact O-N 3.11Å; S181-C183 PolarHBondContact O-N 2.84Å; S181-I184 PolarHBondContact O-N 3.12Å; S181-H185 WeakPolarHBondContact O-CB 3.49Å; S181-H185 PolarHBondContact O-CD2 3.34Å; S181-H185 PolarHBondContact O-N 2.64Å
182	A	88.9	Confident	86.7	Confident	38 Å²	38	68.9 Å²	68.9	31%	0.314	39%	0.393	S	S	.	.	H	α-helix	trans	-62	-41.5	175.8	0	0	0	0	0	112.3	E178 R179 A180 H185 A186 L291	E178-A182 WeakPolarHBondContact O-CB 3.41Å; E178-A182 PolarHBondContact O-N 3.36Å; R179-A182 PolarHBondContact O-N 2.9Å; A180-A182 VanDerWaalsContact C-N 3.34Å; A180-A182 PolarHBondContact O-N 3.25Å; A182-H185 PolarHBondContact O-N 3.04Å; A182-A186 WeakPolarHBondContact O-CB 3.43Å; A182-A186 PolarHBondContact O-N 2.81Å; A182-L291 HydrophobicContact CB-CD2 4.02Å
183	C	87.4	Confident	86	Confident	2 Å²	2	73.1 Å²	73.1	1%	0.014	41%	0.41	C	S	.	.	H	α-helix	trans	-61.2	-45.6	174.9	-66	0	0	0	0	112.1	R179 A180 S181 H185 A186 M187 A279 A283 L291	R179-C183 PolarHBondContact O-N 3.16Å; R179-C183 PolarHBondContact O-SG 3.11Å; A180-C183 WeakPolarHBondContact O-CB 3.33Å; A180-C183 PolarHBondContact O-N 3.07Å; S181-C183 PolarHBondContact O-N 2.84Å; C183-H185 VanDerWaalsContact C-N 3.32Å; C183-H185 PolarHBondContact O-N 2.83Å; C183-A186 PolarHBondContact O-N 3.37Å; C183-M187 PolarHBondContact O-N 2.88Å; C183-A279 HydrophobicContact CB-CB 3.97Å; C183-A283 HydrophobicContact CB-CB 4.13Å; C183-A283 WeakPolarHBondContact SG-CB 3.35Å; C183-L291 HydrophobicContact CB-CD1 4.17Å; C183-L291 WeakPolarHBondContact SG-CD1 3.3Å
184	I	85.4	Confident	85.1	Confident	31 Å²	31	71.9 Å²	71.9	16%	0.159	41%	0.407	C	S	.	.	H	α-helix	trans	-62	-42.4	177.7	-71.6	162.8	0	0	0	110.6	A180 S181 M187 D276 A279	A180-I184 WeakPolarHBondContact O-CG1 3.46Å; A180-I184 PolarHBondContact O-N 3.47Å; S181-I184 PolarHBondContact O-N 3.12Å; I184-M187 CarbonylContact O-C 3.31Å; I184-M187 VanDerWaalsContact O-C 3.31Å; I184-M187 PolarHBondContact O-N 2.63Å; I184-D276 WeakPolarHBondContact CD1-OD1 3.41Å; I184-A279 HydrophobicContact CD1-CB 4.34Å; I184-A279 HydrophobicContact CG1-CB 3.71Å
185	H	86.8	Confident	84	Confident	150 Å²	150	75.1 Å²	75.1	69%	0.694	42%	0.415	S	S	*	.	H	α-helix	trans	-66.7	-35.4	177.2	-84.1	-63.8	0	0	0	113	S181 A182 C183 M187	S181-H185 WeakPolarHBondContact O-CB 3.49Å; S181-H185 PolarHBondContact O-CD2 3.34Å; S181-H185 PolarHBondContact O-N 2.64Å; A182-H185 PolarHBondContact O-N 3.04Å; C183-H185 VanDerWaalsContact C-N 3.32Å; C183-H185 PolarHBondContact O-N 2.83Å; H185-M187 VanDerWaalsContact C-N 3.34Å
186	A	87.9	Confident	82.7	Confident	60 Å²	60	80.6 Å²	80.6	50%	0.496	44%	0.436	S	S	.	.	H	α-helix	trans	-71.2	-28.7	176.7	0	0	0	0	0	112.8	A182 C183	A182-A186 WeakPolarHBondContact O-CB 3.43Å; A182-A186 PolarHBondContact O-N 2.81Å; C183-A186 PolarHBondContact O-N 3.37Å
187	M	85.7	Confident	81.4	Confident	19 Å²	19	79.6 Å²	79.6	9%	0.094	44%	0.436	C	S	.	.			trans	-131.9	74.7	-176	-63.6	-178.6	-81.1	0	0	111.7	C183 I184 H185 N189 L190 A283 F286 L288	C183-M187 PolarHBondContact O-N 2.88Å; I184-M187 CarbonylContact O-C 3.31Å; I184-M187 VanDerWaalsContact O-C 3.31Å; I184-M187 PolarHBondContact O-N 2.63Å; H185-M187 VanDerWaalsContact C-N 3.34Å; M187-N189 PolarHBondContact O-N 3.14Å; M187-N189 VanDerWaalsContact O-N 3.1Å; M187-L190 HydrophobicContact CB-CD1 3.4Å; M187-L190 VanDerWaalsContact CB-CD1 3.4Å; M187-L190 HydrophobicContact CB-CG 3.61Å; M187-L190 HydrophobicContact CE-CD1 3.59Å; M187-L190 HydrophobicContact CE-CG 4.4Å; M187-L190 HydrophobicContact CG-CD1 4.26Å; M187-L190 WeakPolarHBondContact O-CB 3.42Å; M187-L190 PolarHBondContact O-N 2.96Å; M187-L190 HydrophobicContact SD-CD1 3.95Å; M187-L190 HydrophobicContact SD-CD2 4.3Å; M187-L190 HydrophobicContact SD-CG 4.15Å; M187-A283 HydrophobicContact CE-CB 3.6Å; M187-F286 HydrophobicContact CE-CD2 4.41Å; M187-F286 HydrophobicContact SD-CD2 3.68Å; M187-F286 HydrophobicContact SD-CE2 4.02Å; M187-L288 HydrophobicContact CE-CD1 4.19Å; M187-L288 HydrophobicContact CG-CD1 4.34Å; M187-L288 HydrophobicContact SD-CD1 4.05Å
188	P	83.8	Confident	79.7	Confident	108 Å²	108	80 Å²	80	70%	0.701	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-15.1	-175.3	23.7	-32.6	0	0	0	114.3
189	N	86.6	Confident	78.1	Confident	130 Å²	130	82.5 Å²	82.5	70%	0.695	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	-1.6	179.9	60.5	-7.3	0	0	0	114.4	M187 F191	M187-N189 PolarHBondContact O-N 3.14Å; M187-N189 VanDerWaalsContact O-N 3.1Å; N189-F191 PolarHBondContact O-N 3.38Å
190	L	81.9	Confident	75.7	Confident	35 Å²	35	85.2 Å²	85.2	18%	0.183	48%	0.48	C	S	.	.	S	Bend	trans	-59.3	-31.5	179.1	-86.4	165.4	0	0	0	113.6	M187 L282 F286	M187-L190 HydrophobicContact CB-CD1 3.4Å; M187-L190 VanDerWaalsContact CB-CD1 3.4Å; M187-L190 HydrophobicContact CB-CG 3.61Å; M187-L190 HydrophobicContact CE-CD1 3.59Å; M187-L190 HydrophobicContact CE-CG 4.4Å; M187-L190 HydrophobicContact CG-CD1 4.26Å; M187-L190 WeakPolarHBondContact O-CB 3.42Å; M187-L190 PolarHBondContact O-N 2.96Å; M187-L190 HydrophobicContact SD-CD1 3.95Å; M187-L190 HydrophobicContact SD-CD2 4.3Å; M187-L190 HydrophobicContact SD-CG 4.15Å; L190-L282 HydrophobicContact CD2-CB 3.9Å; L190-L282 HydrophobicContact CD2-CD1 3.44Å; L190-L282 VanDerWaalsContact CD2-CD1 3.44Å; L190-L282 HydrophobicContact CD2-CG 4.24Å; L190-F286 HydrophobicContact CD2-CE2 4.44Å
191	F	85.2	Confident	73.6	Confident	49 Å²	49	89.6 Å²	89.6	22%	0.215	51%	0.508	C	S	.	.			trans	-143.1	77.2	-170.2	-58.9	-74.3	0	0	0	109.2	N189 D193 D194 R275 A278 A279	N189-F191 PolarHBondContact O-N 3.38Å; F191-D193 VanDerWaalsContact C-N 3.26Å; F191-D193 PolarHBondContact O-N 3.38Å; F191-D194 HydrophobicContact CB-CB 4.2Å; F191-D194 WeakPolarHBondContact O-CB 3.37Å; F191-D194 PolarHBondContact O-N 3.24Å; F191-R275 HydrophobicContact CD1-CG 4.36Å; F191-R275 HydrophobicContact CD2-CG 3.9Å; F191-R275 VanDerWaalsContact CD2-CZ 3.41Å; F191-R275 HydrophobicContact CE1-CG 4.22Å; F191-R275 HydrophobicContact CE2-CG 3.75Å; F191-R275 HydrophobicContact CG-CG 4.22Å; F191-R275 HydrophobicContact CZ-CG 3.92Å; F191-A278 HydrophobicContact CE1-CB 4.25Å; F191-A278 HydrophobicContact CZ-CB 3.84Å; F191-A279 HydrophobicContact CE2-CB 4.02Å
192	P	79.1	Confident	71.6	Confident	110 Å²	110	95.4 Å²	95.4	71%	0.714	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-26.3	-175.3	24.2	-31.8	0	0	0	113.4	D194	P192-D194 VanDerWaalsContact C-N 3.34Å
193	D	74.1	Confident	69.5	Low	157 Å²	157	103.6 Å²	103.6	84%	0.84	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.1	11.3	-178.4	-61.7	-31	0	0	0	113.7	F191 I195	F191-D193 VanDerWaalsContact C-N 3.26Å; F191-D193 PolarHBondContact O-N 3.38Å; D193-I195 PolarHBondContact O-N 2.86Å
194	D	70.9	Confident	67.6	Low	69 Å²	69	112 Å²	112	37%	0.369	59%	0.59	S	S	.	*			trans	-71	124.5	-176.5	-145.7	57.2	0	0	0	110.6	F191 P192 M196 R275	F191-D194 HydrophobicContact CB-CB 4.2Å; F191-D194 WeakPolarHBondContact O-CB 3.37Å; F191-D194 PolarHBondContact O-N 3.24Å; P192-D194 VanDerWaalsContact C-N 3.34Å; D194-M196 PolarHBondContact O-N 2.83Å; D194-R275 VanDerWaalsContact CG-CZ 3.49Å; D194-R275 IonicContact OD1-CZ 3.4Å; D194-R275 IonicContact OD1-NH1 2.63Å; D194-R275 PolarHBondContact OD1-NH1 2.91Å; D194-R275 WeakPolarHBondContact OD2-CD 3.28Å; D194-R275 IonicContact OD2-CZ 3.76Å; D194-R275 IonicContact OD2-NE 3.26Å; D194-R275 PolarHBondContact OD2-NE 3.19Å; D194-R275 IonicContact OD2-NH1 3.12Å; D194-R275 PolarHBondContact OD2-NH1 3.43Å; D194-R275 IonicContact OD2-NH2 3.59Å
195	I	66.3	Low	65.7	Low	122 Å²	122	114 Å²	114	63%	0.626	61%	0.612	S	S	*	*			trans	-64.6	100.4	179.9	-57	169.7	0	0	0	107.5	D193 V197 L268	D193-I195 PolarHBondContact O-N 2.86Å; I195-V197 PolarHBondContact O-N 3.06Å; I195-L268 HydrophobicContact CD1-CD2 4.46Å
196	M	62.1	Low	63.7	Low	158 Å²	158	112.6 Å²	112.6	78%	0.778	62%	0.619	S	S	*	*			trans	-51.3	112.3	170.8	-73.3	-93.7	81.1	0	0	107.7	D194 P198	D194-M196 PolarHBondContact O-N 2.83Å; M196-P198 VanDerWaalsContact O-CD 3.29Å; M196-P198 WeakPolarHBondContact O-CD 3.43Å; M196-P198 VanDerWaalsContact O-N 3.11Å
197	V	57.8	Low	61.9	Low	78 Å²	78	119.6 Å²	119.6	47%	0.473	64%	0.638	S	S	.	*			trans	-57.9	121.5	170.2	-171.5	0	0	0	0	105.5	I195 K199	I195-V197 PolarHBondContact O-N 3.06Å; V197-K199 PolarHBondContact O-N 2.76Å
198	P	52.9	Low	59.9	Low	106 Å²	106	123.2 Å²	123.2	69%	0.688	67%	0.665	S	S	*	*			trans	-52.5	113.1	174.8	-23.1	32.3	0	0	0	106.6	M196 C200	M196-P198 VanDerWaalsContact O-CD 3.29Å; M196-P198 WeakPolarHBondContact O-CD 3.43Å; M196-P198 VanDerWaalsContact O-N 3.11Å; P198-C200 VanDerWaalsContact C-N 3.35Å; P198-C200 PolarHBondContact O-N 2.99Å
199	K	53.8	Low	58	Low	198 Å²	198	129 Å²	129	86%	0.861	67%	0.673	S	S	*	*			trans	-55.1	109.5	169.7	-82.6	-177.7	176.8	175.8	0	104.1	V197 P201	V197-K199 PolarHBondContact O-N 2.76Å; K199-P201 WeakPolarHBondContact O-CD 3.32Å
200	C	36.1	Very low	56	Low	114 Å²	114	134.9 Å²	134.9	77%	0.77	69%	0.686	S	S	*	*			trans	-50.9	110.5	177.5	-68.6	0	0	0	0	106.7	P198 Y202	P198-C200 VanDerWaalsContact C-N 3.35Å; P198-C200 PolarHBondContact O-N 2.99Å; C200-Y202 PolarHBondContact O-N 3.45Å
201	P	45.2	Very low	54.6	Low	93 Å²	93	139.4 Å²	139.4	60%	0.604	72%	0.715	S	S	*	*			trans	-66.9	135.3	173.5	31.4	-31.7	0	0	0	105.4	K199	K199-P201 WeakPolarHBondContact O-CD 3.32Å
202	Y	45.4	Very low	52.6	Low	176 Å²	176	140.9 Å²	140.9	69%	0.69	74%	0.744	S	S	*	*			trans	56.1	96.6	169.9	71.6	-85.6	0	0	0	118.2	C200 E204	C200-Y202 PolarHBondContact O-N 3.45Å; Y202-E204 PolarHBondContact O-N 3.32Å
203	K	45.9	Very low	51.1	Low	211 Å²	211	141.4 Å²	141.4	92%	0.917	75%	0.75	S	S	*	*			trans	-85.8	67.7	142.1	-73.9	-172.7	-179.7	179.2	0	109
204	E	47	Very low	49.6	Very low	177 Å²	177	145.6 Å²	145.6	83%	0.827	75%	0.754	S	S	*	*			trans	-117.9	-7.3	169.9	-70.4	-160.9	164.5	0	0	113.9	Y202	Y202-E204 PolarHBondContact O-N 3.32Å
205	A	45	Very low	48.4	Very low	75 Å²	75	152 Å²	152	62%	0.62	78%	0.775	S	S	*	*	S	Bend	trans	-98	4.9	-169.8	0	0	0	0	0	116.9
206	S	46	Very low	47.6	Very low	120 Å²	120	150.2 Å²	150.2	84%	0.839	77%	0.773	S	S	*	*			trans	-106.5	32.6	-172.8	-43.3	0	0	0	0	114.9
207	K	49.4	Very low	46.7	Very low	206 Å²	206	150.9 Å²	150.9	90%	0.896	78%	0.775	S	S	*	*			trans	-111.5	60	165.2	-70.3	-179.2	-177.9	172.4	0	110
208	S	44.3	Very low	45.7	Very low	95 Å²	95	152.6 Å²	152.6	66%	0.664	79%	0.79	S	S	*	*	S	Bend	trans	-152.4	119.5	169.5	-166.7	0	0	0	0	110.5
209	R	43.5	Very low	45.1	Very low	229 Å²	229	155.5 Å²	155.5	86%	0.864	80%	0.799	S	S	*	*			trans	73.3	72.5	168.4	-54.6	-179.4	-163.6	-172	3.5	117
210	R	45.1	Very low	44.4	Very low	254 Å²	254	151.3 Å²	151.3	96%	0.958	79%	0.79	S	S	*	*			trans	-87.6	95.1	144.6	-80.9	-176.2	168.5	167.6	-2.9	108.7
211	T	51	Low	44.4	Very low	130 Å²	130	155.1 Å²	155.1	80%	0.798	80%	0.796	S	S	*	*			trans	-139.9	117.9	160.2	51.8	0	0	0	0	107.4
212	G	43.5	Very low	43.9	Very low	80 Å²	80	156.5 Å²	156.5	83%	0.825	80%	0.803	S	S	*	*	S	Bend	trans	96.7	89.1	167.3	0	0	0	0	0	115.1
213	S	48.3	Very low	43.4	Very low	121 Å²	121	152.6 Å²	152.6	85%	0.846	80%	0.801	S	S	*	*				158.5	112.9	111.3	-166.9	0	0	0	0	109.6
214	R	41.6	Very low	42.9	Very low	246 Å²	246	148.2 Å²	148.2	93%	0.928	80%	0.796	S	S	*	*			trans	-79.3	111.3	170.9	-83.2	173.2	-97.9	165.5	-7.2	107.5
215	Y	46.6	Very low	42.6	Very low	202 Å²	202	146 Å²	146	79%	0.792	79%	0.79	S	S	*	*			trans	-172.6	146	145.2	-158.1	-115.4	0	0	0	112.4
216	S	48.9	Very low	42.5	Very low	86 Å²	86	146.3 Å²	146.3	60%	0.601	79%	0.788	S	S	*	*			trans	69.1	98.1	168.5	69.3	0	0	0	0	116.8
217	Q	44.6	Very low	42.2	Very low	172 Å²	172	147.5 Å²	147.5	80%	0.804	78%	0.778	S	S	*	*				79.8	111.6	86.4	-83.1	-179.7	-4.7	0	0	112.5	L219	Q217-L219 PolarHBondContact O-N 3.25Å; Q217-L219 VanDerWaalsContact O-N 3.16Å
218	S	35.8	Very low	41.7	Very low	114 Å²	114	140.6 Å²	140.6	80%	0.797	77%	0.765	S	S	*	*			trans	-46.8	106.4	171.8	49.3	0	0	0	0	112.6
219	L	39.5	Very low	41.7	Very low	167 Å²	167	143.9 Å²	143.9	87%	0.874	77%	0.77	S	S	*	*			trans	-98.5	98.9	157.7	-84.9	161.1	0	0	0	107.4	Q217	Q217-L219 PolarHBondContact O-N 3.25Å; Q217-L219 VanDerWaalsContact O-N 3.16Å
220	T	40.2	Very low	41.6	Very low	109 Å²	109	140 Å²	140	67%	0.669	77%	0.766	S	S	*	*			trans	-54.5	139.7	166.4	44.6	0	0	0	0	110.1	T222	T220-T222 PolarHBondContact O-N 3.47Å
221	E	36.8	Very low	41.7	Very low	195 Å²	195	133 Å²	133	91%	0.911	75%	0.751	S	S	*	*	S	Bend	trans	-53.8	89.6	179.6	-61.5	171.2	168.4	0	0	111.6
222	T	34	Very low	41.6	Very low	121 Å²	121	135.4 Å²	135.4	74%	0.742	75%	0.751	S	S	*	*			trans	-165.3	130.2	166.7	-5	0	0	0	0	106.5	T220	T220-T222 PolarHBondContact O-N 3.47Å
223	S	35.1	Very low	41.7	Very low	94 Å²	94	138.2 Å²	138.2	66%	0.657	75%	0.747	S	S	*	*			trans	92	73.6	-179.4	-156.3	0	0	0	0	116.3
224	C	34.1	Very low	41.6	Very low	119 Å²	119	139.6 Å²	139.6	80%	0.804	74%	0.744	S	S	*	*			trans	-106.4	51.7	144.1	54.8	0	0	0	0	109.3
225	N	41.2	Very low	41.9	Very low	132 Å²	132	133 Å²	133	71%	0.706	74%	0.736	S	S	*	*			trans	-125.2	7.3	178.4	-88.2	-14.3	0	0	0	114.9	R262	N225-R262 PolarHBondContact OD1-NH2 3Å
226	S	42.8	Very low	41.9	Very low	81 Å²	81	128.8 Å²	128.8	57%	0.566	73%	0.731	S	S	*	*			trans	-117.7	16.5	-175.2	65.2	0	0	0	0	116.6	G228	S226-G228 PolarHBondContact O-N 3.44Å
227	F	39.5	Very low	41.6	Very low	145 Å²	145	133.4 Å²	133.4	64%	0.636	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.3	3.2	175.6	-154	-101.1	0	0	0	114
228	G	40.2	Very low	41.9	Very low	61 Å²	61	129.3 Å²	129.3	63%	0.629	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90	1.1	-176.7	0	0	0	0	0	116.1	S226	S226-G228 PolarHBondContact O-N 3.44Å
229	E	44.2	Very low	42.2	Very low	164 Å²	164	130.1 Å²	130.1	77%	0.766	74%	0.735	S	S	*	*	S	Bend	trans	-110.9	-0.5	-172.4	-105	172.1	161.6	0	0	115
230	L	41.2	Very low	42.6	Very low	147 Å²	147	126.5 Å²	126.5	77%	0.77	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.8	12	-172.5	-107.4	157.3	0	0	0	115.6
231	T	45.8	Very low	43.1	Very low	107 Å²	107	125.4 Å²	125.4	66%	0.656	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.1	4.3	179	56.3	0	0	0	0	114.6
232	K	49.7	Very low	44.1	Very low	181 Å²	181	121.3 Å²	121.3	79%	0.787	70%	0.704	S	S	*	*	S	Bend	trans	-94.8	-12.3	-177.6	-98.5	173.4	178.3	171.4	0	116.1
233	D	44.9	Very low	45.1	Very low	139 Å²	139	122.9 Å²	122.9	74%	0.743	70%	0.703	S	S	*	*	S	Bend	trans	-105.5	15.4	-172.2	-63.6	-19.6	0	0	0	114.5	S235	D233-S235 PolarHBondContact O-N 3.06Å
234	L	46.6	Very low	46.1	Very low	149 Å²	149	119.6 Å²	119.6	78%	0.78	68%	0.679	S	S	*	*			trans	-99.1	47.7	178.4	-138.9	78.9	0	0	0	112.6
235	S	47.4	Very low	47	Very low	108 Å²	108	119.9 Å²	119.9	76%	0.755	67%	0.671	S	S	*	*			trans	-107	12.3	170.7	-65	0	0	0	0	113.5	D233 E237	D233-S235 PolarHBondContact O-N 3.06Å; S235-E237 PolarHBondContact O-N 3.27Å
236	T	48.4	Very low	48	Very low	114 Å²	114	119.2 Å²	119.2	70%	0.699	67%	0.667	S	S	*	*			trans	-79.7	110.7	176.7	-50.7	0	0	0	0	110.6	V238	T236-V238 PolarHBondContact O-N 2.81Å
237	E	42	Very low	49.1	Very low	182 Å²	182	122.7 Å²	122.7	85%	0.85	67%	0.672	S	S	*	*			trans	-37.9	100.3	167.9	-57.3	-72.4	156.9	0	0	112.2	S235	S235-E237 PolarHBondContact O-N 3.27Å
238	V	50.3	Low	50.5	Low	86 Å²	86	119.8 Å²	119.8	52%	0.521	66%	0.659	S	S	.	*			trans	-124.9	108.1	166.5	-172.3	0	0	0	0	107	T236 L240	T236-V238 PolarHBondContact O-N 2.81Å; V238-L240 HydrophobicContact CB-CD1 4.25Å; V238-L240 HydrophobicContact CB-CG 4.2Å; V238-L240 HydrophobicContact CG1-CD1 4.08Å; V238-L240 HydrophobicContact CG1-CD2 3.9Å; V238-L240 HydrophobicContact CG1-CG 3.69Å; V238-L240 PolarHBondContact O-N 3.38Å
239	S	43.4	Very low	52.2	Low	131 Å²	131	119.6 Å²	119.6	92%	0.916	65%	0.648	S	S	*	*			trans	-54.1	103.2	167	-78.7	0	0	0	0	109.2
240	L	46	Very low	53.8	Low	91 Å²	91	116.8 Å²	116.8	48%	0.476	64%	0.635	S	S	.	*			trans	-124.1	130.7	178.1	-68	166.9	0	0	0	109.5	V238 S244	V238-L240 HydrophobicContact CB-CD1 4.25Å; V238-L240 HydrophobicContact CB-CG 4.2Å; V238-L240 HydrophobicContact CG1-CD1 4.08Å; V238-L240 HydrophobicContact CG1-CD2 3.9Å; V238-L240 HydrophobicContact CG1-CG 3.69Å; V238-L240 PolarHBondContact O-N 3.38Å; L240-S244 WeakPolarHBondContact CB-OG 3.45Å
241	S	52.6	Low	55.5	Low	86 Å²	86	115.3 Å²	115.3	60%	0.601	63%	0.627	S	S	*	*			trans	-41.4	149.2	174.6	-156.3	0	0	0	0	112.8	E243 S244	S241-E243 PolarHBondContact O-N 3.09Å; S241-S244 WeakPolarHBondContact O-CB 3.44Å; S241-S244 PolarHBondContact O-N 3.24Å; S241-S244 PolarHBondContact O-OG 3.04Å
242	P	56.1	Low	57.1	Low	110 Å²	110	114.6 Å²	114.6	71%	0.714	62%	0.618	S	S	*	*	G	3₁₀ helix	trans	-52.6	-23.4	-173.6	4.8	-16.7	0	0	0	115.5	S244	P242-S244 VanDerWaalsContact C-N 3.27Å; P242-S244 PolarHBondContact O-N 3.11Å
243	E	55.1	Low	58.5	Low	154 Å²	154	112.3 Å²	112.3	72%	0.72	61%	0.61	S	S	*	*	G	3₁₀ helix	trans	-72.5	-10.4	175.8	-67.9	-177.1	156.3	0	0	115.2	S241	S241-E243 PolarHBondContact O-N 3.09Å
244	S	56.1	Low	60.1	Low	24 Å²	24	110.6 Å²	110.6	17%	0.168	60%	0.599	C	S	.	*	G	3₁₀ helix	trans	-86.1	-19.4	179.8	89.4	0	0	0	0	113.8	L240 S241 P242 D246 K247 K248	L240-S244 WeakPolarHBondContact CB-OG 3.45Å; S241-S244 WeakPolarHBondContact O-CB 3.44Å; S241-S244 PolarHBondContact O-N 3.24Å; S241-S244 PolarHBondContact O-OG 3.04Å; P242-S244 VanDerWaalsContact C-N 3.27Å; P242-S244 PolarHBondContact O-N 3.11Å; S244-D246 VanDerWaalsContact C-N 3.3Å; S244-D246 PolarHBondContact O-N 3.21Å; S244-K247 PolarHBondContact O-N 2.8Å; S244-K248 PolarHBondContact O-N 2.85Å
245	M	54.7	Low	61.7	Low	126 Å²	126	104.9 Å²	104.9	62%	0.621	57%	0.574	S	S	*	*	H	α-helix	trans	-65.8	-35.5	-177.3	-70.3	-67.9	-81.2	0	0	111.4	K247 K248 S249	M245-K247 VanDerWaalsContact C-N 3.34Å; M245-K247 PolarHBondContact O-N 2.92Å; M245-K248 PolarHBondContact O-N 2.82Å; M245-S249 PolarHBondContact O-N 3.36Å; M245-S249 VanDerWaalsContact O-N 3.08Å
246	D	62.3	Low	63.5	Low	118 Å²	118	105.8 Å²	105.8	63%	0.631	56%	0.564	S	S	*	*	H	α-helix	trans	-69.7	-28.6	178.3	-63.1	-28.2	0	0	0	113.3	S244 S249 H250	S244-D246 VanDerWaalsContact C-N 3.3Å; S244-D246 PolarHBondContact O-N 3.21Å; D246-S249 WeakPolarHBondContact CA-OG 3.45Å; D246-S249 PolarHBondContact O-OG 2.81Å; D246-H250 WeakPolarHBondContact O-CB 3.47Å; D246-H250 PolarHBondContact O-N 3.48Å
247	K	65.8	Low	65.1	Low	154 Å²	154	103 Å²	103	67%	0.67	55%	0.549	S	S	*	.	H	α-helix	trans	-77.6	-38.1	177.9	-66	176.6	-176.1	170	0	111.5	S244 M245 L251	S244-K247 PolarHBondContact O-N 2.8Å; M245-K247 VanDerWaalsContact C-N 3.34Å; M245-K247 PolarHBondContact O-N 2.92Å; K247-L251 PolarHBondContact O-N 2.89Å; K247-L251 VanDerWaalsContact O-N 3.09Å
248	K	67.4	Low	67	Low	83 Å²	83	96.6 Å²	96.6	36%	0.361	52%	0.524	S	S	.	.	H	α-helix	trans	-65.8	-41.8	173.8	-78.1	-176.6	179.3	178	0	111.2	S244 M245 L251 I252	S244-K248 PolarHBondContact O-N 2.85Å; M245-K248 PolarHBondContact O-N 2.82Å; K248-L251 PolarHBondContact O-N 3.33Å; K248-I252 WeakPolarHBondContact O-CD1 3.27Å; K248-I252 VanDerWaalsContact O-CG1 3.23Å; K248-I252 WeakPolarHBondContact O-CG1 3.42Å; K248-I252 PolarHBondContact O-N 2.87Å; K248-I252 VanDerWaalsContact O-N 3.07Å
249	S	76.4	Confident	68.6	Low	58 Å²	58	95.7 Å²	95.7	41%	0.406	52%	0.516	S	S	.	.	H	α-helix	trans	-61.4	-46.4	176.6	65.8	0	0	0	0	111.6	M245 D246 L251 I252 E253	M245-S249 PolarHBondContact O-N 3.36Å; M245-S249 VanDerWaalsContact O-N 3.08Å; D246-S249 WeakPolarHBondContact CA-OG 3.45Å; D246-S249 PolarHBondContact O-OG 2.81Å; S249-L251 PolarHBondContact O-N 3.43Å; S249-I252 PolarHBondContact O-N 2.98Å; S249-E253 WeakPolarHBondContact O-CG 3.05Å; S249-E253 PolarHBondContact O-N 2.94Å
250	H	78.1	Confident	70.7	Confident	105 Å²	105	94.6 Å²	94.6	49%	0.486	50%	0.499	S	S	.	.	H	α-helix	trans	-63	-41	178.3	-177.1	-87.6	0	0	0	113.3	D246 I252 E253 M254	D246-H250 WeakPolarHBondContact O-CB 3.47Å; D246-H250 PolarHBondContact O-N 3.48Å; H250-I252 VanDerWaalsContact C-N 3.35Å; H250-I252 PolarHBondContact O-N 2.75Å; H250-E253 PolarHBondContact O-N 3.48Å; H250-M254 WeakPolarHBondContact CE1-CE 3.45Å; H250-M254 PolarHBondContact CE1-SD 3.36Å; H250-M254 WeakPolarHBondContact O-CG 3.3Å; H250-M254 PolarHBondContact O-N 3.16Å
251	L	76.9	Confident	72.7	Confident	115 Å²	115	94.6 Å²	94.6	60%	0.602	50%	0.5	S	S	*	.	H	α-helix	trans	-63.8	-39.5	174.9	-78.4	174.6	0	0	0	112.4	K247 K248 S249 E253 M254 A255	K247-L251 PolarHBondContact O-N 2.89Å; K247-L251 VanDerWaalsContact O-N 3.09Å; K248-L251 PolarHBondContact O-N 3.33Å; S249-L251 PolarHBondContact O-N 3.43Å; L251-E253 VanDerWaalsContact C-N 3.33Å; L251-M254 PolarHBondContact O-N 3.39Å; L251-A255 PolarHBondContact O-N 3.21Å
252	I	78.7	Confident	74.2	Confident	93 Å²	93	95.3 Å²	95.3	48%	0.477	49%	0.489	S	S	.	.	H	α-helix	trans	-64	-40.2	174.9	-67.9	164.4	0	0	0	110.3	K248 S249 H250 A255 K256	K248-I252 WeakPolarHBondContact O-CD1 3.27Å; K248-I252 VanDerWaalsContact O-CG1 3.23Å; K248-I252 WeakPolarHBondContact O-CG1 3.42Å; K248-I252 PolarHBondContact O-N 2.87Å; K248-I252 VanDerWaalsContact O-N 3.07Å; S249-I252 PolarHBondContact O-N 2.98Å; H250-I252 VanDerWaalsContact C-N 3.35Å; H250-I252 PolarHBondContact O-N 2.75Å; I252-A255 PolarHBondContact O-N 3.38Å; I252-K256 HydrophobicContact CG2-CD 4.08Å; I252-K256 HydrophobicContact CG2-CG 4.5Å; I252-K256 WeakPolarHBondContact O-CB 3.37Å; I252-K256 VanDerWaalsContact O-CG 3.26Å; I252-K256 WeakPolarHBondContact O-CG 3.45Å; I252-K256 PolarHBondContact O-N 3.06Å
253	E	80.5	Confident	75.7	Confident	132 Å²	132	95.2 Å²	95.2	62%	0.617	48%	0.482	S	S	*	.	H	α-helix	trans	-67.4	-38.6	174.7	-70.4	-159	169.1	0	0	113	S249 H250 L251 K256 S257	S249-E253 WeakPolarHBondContact O-CG 3.05Å; S249-E253 PolarHBondContact O-N 2.94Å; H250-E253 PolarHBondContact O-N 3.48Å; L251-E253 VanDerWaalsContact C-N 3.33Å; E253-K256 PolarHBondContact O-N 2.95Å; E253-S257 WeakPolarHBondContact O-CB 3.38Å; E253-S257 PolarHBondContact O-N 3.21Å; E253-S257 PolarHBondContact O-OG 3.46Å; E253-S257 VanDerWaalsContact O-OG 3.09Å
254	M	77.8	Confident	77.2	Confident	104 Å²	104	95.5 Å²	95.5	51%	0.512	48%	0.477	S	S	.	.	H	α-helix	trans	-61.8	-43.9	172.3	-76.7	-168.8	144.2	0	0	111.9	H250 L251 S257 S258	H250-M254 WeakPolarHBondContact CE1-CE 3.45Å; H250-M254 PolarHBondContact CE1-SD 3.36Å; H250-M254 WeakPolarHBondContact O-CG 3.3Å; H250-M254 PolarHBondContact O-N 3.16Å; L251-M254 PolarHBondContact O-N 3.39Å; M254-S257 WeakPolarHBondContact CA-OG 3.29Å; M254-S257 PolarHBondContact O-N 3.19Å; M254-S257 PolarHBondContact O-OG 3.26Å; M254-S258 WeakPolarHBondContact O-CB 3.36Å; M254-S258 PolarHBondContact O-N 3.29Å; M254-S258 PolarHBondContact O-OG 3Å
255	A	79.9	Confident	78.6	Confident	29 Å²	29	96.5 Å²	96.5	24%	0.24	49%	0.486	C	S	.	.	H	α-helix	trans	-62.1	-49.4	174.9	0	0	0	0	0	111.2	L251 I252 S257 S258 D259	L251-A255 PolarHBondContact O-N 3.21Å; I252-A255 PolarHBondContact O-N 3.38Å; A255-S257 PolarHBondContact O-N 3.47Å; A255-S258 PolarHBondContact O-N 3.2Å; A255-S258 VanDerWaalsContact O-N 3.12Å; A255-S258 PolarHBondContact O-OG 3.07Å; A255-D259 PolarHBondContact O-N 3.42Å
256	K	84.4	Confident	80.1	Confident	127 Å²	127	94.3 Å²	94.3	55%	0.552	48%	0.475	S	S	*	.	H	α-helix	trans	-57.9	-44.8	176.3	-73.9	172.3	-180	176.5	0	112.3	I252 E253 S258 D259 I260	I252-K256 HydrophobicContact CG2-CD 4.08Å; I252-K256 HydrophobicContact CG2-CG 4.5Å; I252-K256 WeakPolarHBondContact O-CB 3.37Å; I252-K256 VanDerWaalsContact O-CG 3.26Å; I252-K256 WeakPolarHBondContact O-CG 3.45Å; I252-K256 PolarHBondContact O-N 3.06Å; E253-K256 PolarHBondContact O-N 2.95Å; K256-S258 VanDerWaalsContact C-N 3.34Å; K256-D259 PolarHBondContact O-N 3.41Å; K256-I260 WeakPolarHBondContact O-CB 3.35Å; K256-I260 WeakPolarHBondContact O-CD1 3.39Å; K256-I260 WeakPolarHBondContact O-CG1 3.36Å; K256-I260 PolarHBondContact O-N 3.42Å
257	S	82.8	Confident	81.3	Confident	54 Å²	54	95.9 Å²	95.9	38%	0.378	47%	0.472	S	S	.	.	H	α-helix	trans	-66.1	-36.5	177.4	64.8	0	0	0	0	111.8	E253 M254 A255 I260 N261	E253-S257 WeakPolarHBondContact O-CB 3.38Å; E253-S257 PolarHBondContact O-N 3.21Å; E253-S257 PolarHBondContact O-OG 3.46Å; E253-S257 VanDerWaalsContact O-OG 3.09Å; M254-S257 WeakPolarHBondContact CA-OG 3.29Å; M254-S257 PolarHBondContact O-N 3.19Å; M254-S257 PolarHBondContact O-OG 3.26Å; A255-S257 PolarHBondContact O-N 3.47Å; S257-I260 PolarHBondContact O-N 2.89Å; S257-N261 VanDerWaalsContact O-CB 3.24Å; S257-N261 WeakPolarHBondContact O-CB 3.45Å; S257-N261 PolarHBondContact O-N 3.35Å; S257-N261 PolarHBondContact O-ND2 3.16Å
258	S	81.8	Confident	82.3	Confident	48 Å²	48	91.1 Å²	91.1	34%	0.336	45%	0.453	S	S	.	.	H	α-helix	trans	-65.2	-41.4	174	78.3	0	0	0	0	112.3	M254 A255 K256 N261 R262	M254-S258 WeakPolarHBondContact O-CB 3.36Å; M254-S258 PolarHBondContact O-N 3.29Å; M254-S258 PolarHBondContact O-OG 3Å; A255-S258 PolarHBondContact O-N 3.2Å; A255-S258 VanDerWaalsContact O-N 3.12Å; A255-S258 PolarHBondContact O-OG 3.07Å; K256-S258 VanDerWaalsContact C-N 3.34Å; S258-N261 PolarHBondContact O-N 3.26Å; S258-R262 PolarHBondContact O-N 3.26Å
259	D	85	Confident	83.3	Confident	68 Å²	68	92.8 Å²	92.8	36%	0.364	46%	0.462	S	S	.	.	H	α-helix	trans	-66.7	-43.4	175.7	-73	-26.6	0	0	0	111.5	A255 K256 N261 R262 L263	A255-D259 PolarHBondContact O-N 3.42Å; K256-D259 PolarHBondContact O-N 3.41Å; D259-N261 VanDerWaalsContact C-N 3.31Å; D259-N261 PolarHBondContact O-N 3.47Å; D259-R262 WeakPolarHBondContact O-CB 3.5Å; D259-R262 PolarHBondContact O-N 2.86Å; D259-L263 WeakPolarHBondContact O-CG 3.45Å; D259-L263 PolarHBondContact O-N 3.31Å
260	I	86.8	Confident	83.8	Confident	107 Å²	107	96.4 Å²	96.4	55%	0.549	47%	0.467	S	S	.	.	H	α-helix	trans	-61.2	-42.3	173.6	-69.4	162.6	0	0	0	110.3	K256 S257 R262 L263 R264	K256-I260 WeakPolarHBondContact O-CB 3.35Å; K256-I260 WeakPolarHBondContact O-CD1 3.39Å; K256-I260 WeakPolarHBondContact O-CG1 3.36Å; K256-I260 PolarHBondContact O-N 3.42Å; S257-I260 PolarHBondContact O-N 2.89Å; I260-R262 VanDerWaalsContact C-N 3.34Å; I260-R262 PolarHBondContact O-N 2.94Å; I260-L263 PolarHBondContact O-N 3.15Å; I260-R264 VanDerWaalsContact O-CB 3.28Å; I260-R264 WeakPolarHBondContact O-CB 3.31Å; I260-R264 PolarHBondContact O-N 3.34Å
261	N	86.8	Confident	84.4	Confident	92 Å²	92	95.3 Å²	95.3	49%	0.492	46%	0.462	S	S	.	.	H	α-helix	trans	-64.8	-37.9	177	-74.8	-30.2	0	0	0	111.8	S257 S258 D259 R264 A265	S257-N261 VanDerWaalsContact O-CB 3.24Å; S257-N261 WeakPolarHBondContact O-CB 3.45Å; S257-N261 PolarHBondContact O-N 3.35Å; S257-N261 PolarHBondContact O-ND2 3.16Å; S258-N261 PolarHBondContact O-N 3.26Å; D259-N261 VanDerWaalsContact C-N 3.31Å; D259-N261 PolarHBondContact O-N 3.47Å; N261-R264 PolarHBondContact O-N 2.93Å; N261-A265 WeakPolarHBondContact O-CB 3.42Å; N261-A265 PolarHBondContact O-N 3.23Å
262	R	85.6	Confident	84.9	Confident	101 Å²	101	95.8 Å²	95.8	38%	0.381	46%	0.456	S	S	.	.	H	α-helix	trans	-61.5	-50	172.4	178.6	-176.4	175.2	171.9	1.2	111.2	N225 S258 D259 I260 R264 A265 E266	N225-R262 PolarHBondContact OD1-NH2 3Å; S258-R262 PolarHBondContact O-N 3.26Å; D259-R262 WeakPolarHBondContact O-CB 3.5Å; D259-R262 PolarHBondContact O-N 2.86Å; I260-R262 VanDerWaalsContact C-N 3.34Å; I260-R262 PolarHBondContact O-N 2.94Å; R262-R264 VanDerWaalsContact C-N 3.28Å; R262-R264 PolarHBondContact O-N 3.15Å; R262-A265 PolarHBondContact O-N 3.45Å; R262-E266 PolarHBondContact O-N 2.93Å
263	L	86.1	Confident	85.4	Confident	107 Å²	107	97.6 Å²	97.6	56%	0.56	46%	0.46	S	S	*	.	H	α-helix	trans	-61.5	-37.9	177.4	-70.7	172.1	0	0	0	111.7	D259 I260 E266 R267	D259-L263 WeakPolarHBondContact O-CG 3.45Å; D259-L263 PolarHBondContact O-N 3.31Å; I260-L263 PolarHBondContact O-N 3.15Å; L263-E266 PolarHBondContact O-N 2.91Å; L263-R267 VanDerWaalsContact O-CB 3.25Å; L263-R267 WeakPolarHBondContact O-CB 3.46Å; L263-R267 PolarHBondContact O-N 2.88Å
264	R	86.8	Confident	85.9	Confident	161 Å²	161	96.6 Å²	96.6	61%	0.608	46%	0.455	S	S	*	.	H	α-helix	trans	-64.9	-44	174.5	-171.1	178.7	-173.7	179.1	3	111.5	I260 N261 R262 R267 L268	I260-R264 VanDerWaalsContact O-CB 3.28Å; I260-R264 WeakPolarHBondContact O-CB 3.31Å; I260-R264 PolarHBondContact O-N 3.34Å; N261-R264 PolarHBondContact O-N 2.93Å; R262-R264 VanDerWaalsContact C-N 3.28Å; R262-R264 PolarHBondContact O-N 3.15Å; R264-R267 PolarHBondContact O-N 3.38Å; R264-L268 HydrophobicContact CG-CD1 4.25Å; R264-L268 WeakPolarHBondContact O-CB 3.33Å; R264-L268 VanDerWaalsContact O-CG 3.28Å; R264-L268 WeakPolarHBondContact O-CG 3.45Å; R264-L268 PolarHBondContact O-N 2.98Å
265	A	85.4	Confident	86.4	Confident	45 Å²	45	93.3 Å²	93.3	37%	0.372	44%	0.437	S	S	.	.	H	α-helix	trans	-63.5	-43.2	177	0	0	0	0	0	111.6	N261 R262 L268 Q269	N261-A265 WeakPolarHBondContact O-CB 3.42Å; N261-A265 PolarHBondContact O-N 3.23Å; R262-A265 PolarHBondContact O-N 3.45Å; A265-L268 PolarHBondContact O-N 3.41Å; A265-Q269 WeakPolarHBondContact O-CG 3.25Å; A265-Q269 PolarHBondContact O-N 2.9Å
266	E	86.7	Confident	86.9	Confident	80 Å²	80	93.5 Å²	93.5	37%	0.374	44%	0.435	S	S	.	.	H	α-helix	trans	-66.2	-42.4	176.8	-163	-155.1	122	0	0	111.9	R262 L263 L268 Q269 R270	R262-E266 PolarHBondContact O-N 2.93Å; L263-E266 PolarHBondContact O-N 2.91Å; E266-L268 PolarHBondContact O-N 2.91Å; E266-Q269 PolarHBondContact O-N 3.45Å; E266-R270 PolarHBondContact O-N 3.23Å; E266-R270 IonicContact OE1-CZ 3.92Å; E266-R270 IonicContact OE1-NE 2.77Å; E266-R270 PolarHBondContact OE1-NE 3.34Å; E266-R270 IonicContact OE1-NH2 2.69Å; E266-R270 PolarHBondContact OE1-NH2 2.89Å
267	R	87.9	Confident	87.2	Confident	151 Å²	151	94.5 Å²	94.5	57%	0.57	44%	0.435	S	S	*	.	H	α-helix	trans	-56.6	-49.5	172.3	176.9	179.5	173.4	173.5	0.7	111	L263 R264 Q269 R270 E271	L263-R267 VanDerWaalsContact O-CB 3.25Å; L263-R267 WeakPolarHBondContact O-CB 3.46Å; L263-R267 PolarHBondContact O-N 2.88Å; R264-R267 PolarHBondContact O-N 3.38Å; R267-Q269 VanDerWaalsContact C-N 3.31Å; R267-Q269 PolarHBondContact O-N 3.48Å; R267-R270 PolarHBondContact O-N 3.5Å; R267-R270 VanDerWaalsContact O-N 3.16Å; R267-E271 HydrophobicContact CG-CG 4.47Å; R267-E271 WeakPolarHBondContact CG-OE1 3Å; R267-E271 IonicContact CZ-OE1 3.56Å; R267-E271 IonicContact NE-OE1 3.83Å; R267-E271 PolarHBondContact NE-OE1 2.88Å; R267-E271 IonicContact NH2-OE1 2.83Å; R267-E271 PolarHBondContact NH2-OE1 3.02Å; R267-E271 WeakPolarHBondContact O-CG 3.49Å; R267-E271 PolarHBondContact O-N 2.87Å
268	L	87.1	Confident	87.6	Confident	54 Å²	54	93.4 Å²	93.4	28%	0.283	43%	0.429	S	S	.	.	H	α-helix	trans	-61.5	-36.8	177.3	-74.8	167.4	0	0	0	112.3	I195 R264 A265 E266 R272	I195-L268 HydrophobicContact CD1-CD2 4.46Å; R264-L268 HydrophobicContact CG-CD1 4.25Å; R264-L268 WeakPolarHBondContact O-CB 3.33Å; R264-L268 VanDerWaalsContact O-CG 3.28Å; R264-L268 WeakPolarHBondContact O-CG 3.45Å; R264-L268 PolarHBondContact O-N 2.98Å; A265-L268 PolarHBondContact O-N 3.41Å; E266-L268 PolarHBondContact O-N 2.91Å; L268-R272 WeakPolarHBondContact O-CB 3.41Å; L268-R272 VanDerWaalsContact O-CG 3.23Å; L268-R272 WeakPolarHBondContact O-CG 3.42Å; L268-R272 PolarHBondContact O-N 3.12Å
269	Q	87.6	Confident	88	Confident	118 Å²	118	91.1 Å²	91.1	55%	0.551	41%	0.413	S	S	*	.	H	α-helix	trans	-66.2	-40	174.5	-75.4	177.7	3.2	0	0	112.3	A265 E266 R267 K273	A265-Q269 WeakPolarHBondContact O-CG 3.25Å; A265-Q269 PolarHBondContact O-N 2.9Å; E266-Q269 PolarHBondContact O-N 3.45Å; R267-Q269 VanDerWaalsContact C-N 3.31Å; R267-Q269 PolarHBondContact O-N 3.48Å; Q269-K273 WeakPolarHBondContact O-CG 3.38Å; Q269-K273 PolarHBondContact O-N 3.33Å
270	R	88.1	Confident	88.2	Confident	133 Å²	133	89.6 Å²	89.6	50%	0.502	41%	0.406	S	S	.	.	H	α-helix	trans	-65.7	-45.6	175	-76.7	-172.2	-94.3	104.9	-5.8	111.5	E266 R267 R272 K273 E274	E266-R270 PolarHBondContact O-N 3.23Å; E266-R270 IonicContact OE1-CZ 3.92Å; E266-R270 IonicContact OE1-NE 2.77Å; E266-R270 PolarHBondContact OE1-NE 3.34Å; E266-R270 IonicContact OE1-NH2 2.69Å; E266-R270 PolarHBondContact OE1-NH2 2.89Å; R267-R270 PolarHBondContact O-N 3.5Å; R267-R270 VanDerWaalsContact O-N 3.16Å; R270-R272 VanDerWaalsContact C-N 3.34Å; R270-R272 PolarHBondContact O-N 3.39Å; R270-K273 PolarHBondContact O-N 2.88Å; R270-E274 WeakPolarHBondContact O-CB 3.44Å; R270-E274 PolarHBondContact O-N 2.91Å
271	E	89.9	Confident	88.3	Confident	82 Å²	82	90.2 Å²	90.2	38%	0.383	41%	0.41	S	S	.	.	H	α-helix	trans	-58.8	-43.5	175.5	-72.9	171.7	-178.4	0	0	111.4	R267 E274 R275	R267-E271 HydrophobicContact CG-CG 4.47Å; R267-E271 WeakPolarHBondContact CG-OE1 3Å; R267-E271 IonicContact CZ-OE1 3.56Å; R267-E271 IonicContact NE-OE1 3.83Å; R267-E271 PolarHBondContact NE-OE1 2.88Å; R267-E271 IonicContact NH2-OE1 2.83Å; R267-E271 PolarHBondContact NH2-OE1 3.02Å; R267-E271 WeakPolarHBondContact O-CG 3.49Å; R267-E271 PolarHBondContact O-N 2.87Å; E271-E274 PolarHBondContact O-N 3.35Å; E271-R275 VanDerWaalsContact O-CB 3.32Å; E271-R275 WeakPolarHBondContact O-CB 3.48Å; E271-R275 PolarHBondContact O-N 2.68Å
272	R	88	Confident	88.4	Confident	126 Å²	126	88.5 Å²	88.5	48%	0.475	40%	0.4	S	S	.	.	H	α-helix	trans	-61.7	-47.4	174.5	-74.8	171.7	-168.1	-126.1	7.8	113.3	L268 R270 E274 R275 D276	L268-R272 WeakPolarHBondContact O-CB 3.41Å; L268-R272 VanDerWaalsContact O-CG 3.23Å; L268-R272 WeakPolarHBondContact O-CG 3.42Å; L268-R272 PolarHBondContact O-N 3.12Å; R270-R272 VanDerWaalsContact C-N 3.34Å; R270-R272 PolarHBondContact O-N 3.39Å; R272-E274 VanDerWaalsContact C-N 3.27Å; R272-E274 PolarHBondContact O-N 3.39Å; R272-R275 WeakPolarHBondContact O-CB 3.44Å; R272-R275 PolarHBondContact O-N 2.91Å; R272-D276 WeakPolarHBondContact O-CB 3.42Å; R272-D276 PolarHBondContact O-N 3.39Å
273	K	89.1	Confident	88.5	Confident	130 Å²	130	83.9 Å²	83.9	57%	0.565	38%	0.383	S	S	*	.	H	α-helix	trans	-61	-39	178	-75.7	179	178.5	-177.6	0	111.7	Q269 R270 D276 R277	Q269-K273 WeakPolarHBondContact O-CG 3.38Å; Q269-K273 PolarHBondContact O-N 3.33Å; R270-K273 PolarHBondContact O-N 2.88Å; K273-D276 PolarHBondContact O-N 3.39Å; K273-R277 VanDerWaalsContact O-CG 3.31Å; K273-R277 WeakPolarHBondContact O-CG 3.23Å; K273-R277 PolarHBondContact O-N 3.49Å
274	E	90.2	Very high	88.4	Confident	111 Å²	111	86.1 Å²	86.1	52%	0.519	39%	0.389	S	S	.	.	H	α-helix	trans	-70.6	-39.8	178.3	-160.7	58.6	-151.5	0	0	111.6	R270 E271 R272 R277 A278	R270-E274 WeakPolarHBondContact O-CB 3.44Å; R270-E274 PolarHBondContact O-N 2.91Å; E271-E274 PolarHBondContact O-N 3.35Å; R272-E274 VanDerWaalsContact C-N 3.27Å; R272-E274 PolarHBondContact O-N 3.39Å; E274-R277 PolarHBondContact O-N 2.84Å; E274-R277 IonicContact OE2-NH1 3.46Å; E274-R277 PolarHBondContact OE2-NH1 3.49Å; E274-A278 VanDerWaalsContact O-CB 3.27Å; E274-A278 WeakPolarHBondContact O-CB 3.36Å; E274-A278 PolarHBondContact O-N 3.31Å
275	R	89.6	Confident	88.4	Confident	35 Å²	35	82.3 Å²	82.3	13%	0.132	39%	0.387	C	S	.	.	H	α-helix	trans	-57.9	-48.2	170.3	178.8	-156	164.9	76.9	2.6	111.8	F191 D194 E271 R272 R277 A278 A279	F191-R275 HydrophobicContact CD1-CG 4.36Å; F191-R275 HydrophobicContact CD2-CG 3.9Å; F191-R275 VanDerWaalsContact CD2-CZ 3.41Å; F191-R275 HydrophobicContact CE1-CG 4.22Å; F191-R275 HydrophobicContact CE2-CG 3.75Å; F191-R275 HydrophobicContact CG-CG 4.22Å; F191-R275 HydrophobicContact CZ-CG 3.92Å; D194-R275 VanDerWaalsContact CG-CZ 3.49Å; D194-R275 IonicContact OD1-CZ 3.4Å; D194-R275 IonicContact OD1-NH1 2.63Å; D194-R275 PolarHBondContact OD1-NH1 2.91Å; D194-R275 WeakPolarHBondContact OD2-CD 3.28Å; D194-R275 IonicContact OD2-CZ 3.76Å; D194-R275 IonicContact OD2-NE 3.26Å; D194-R275 PolarHBondContact OD2-NE 3.19Å; D194-R275 IonicContact OD2-NH1 3.12Å; D194-R275 PolarHBondContact OD2-NH1 3.43Å; D194-R275 IonicContact OD2-NH2 3.59Å; E271-R275 VanDerWaalsContact O-CB 3.32Å; E271-R275 WeakPolarHBondContact O-CB 3.48Å; E271-R275 PolarHBondContact O-N 2.68Å; R272-R275 WeakPolarHBondContact O-CB 3.44Å; R272-R275 PolarHBondContact O-N 2.91Å; R275-R277 PolarHBondContact O-N 3.21Å; R275-A278 PolarHBondContact O-N 3.37Å; R275-A279 WeakPolarHBondContact O-CB 3.24Å; R275-A279 PolarHBondContact O-N 2.95Å
276	D	90.2	Very high	88.5	Confident	34 Å²	34	86.5 Å²	86.5	18%	0.182	40%	0.397	C	S	.	.	H	α-helix	trans	-60.2	-45.9	179.9	-72.5	-17.8	0	0	0	111	L177 A180 I184 R272 K273 A279 V280	L177-D276 WeakPolarHBondContact CD2-OD2 3.32Å; A180-D276 HydrophobicContact CB-CB 3.53Å; I184-D276 WeakPolarHBondContact CD1-OD1 3.41Å; R272-D276 WeakPolarHBondContact O-CB 3.42Å; R272-D276 PolarHBondContact O-N 3.39Å; K273-D276 PolarHBondContact O-N 3.39Å; D276-A279 PolarHBondContact O-N 3.29Å; D276-V280 WeakPolarHBondContact O-CG2 3.41Å; D276-V280 PolarHBondContact O-N 3.45Å; D276-V280 VanDerWaalsContact O-N 3.16Å
277	R	89.4	Confident	88	Confident	148 Å²	148	85.5 Å²	85.5	56%	0.558	41%	0.408	S	S	*	.	H	α-helix	trans	-60.4	-46.7	173.6	-73.7	172.4	179.4	167.3	-3	112.3	K273 E274 R275 A279 V280 L281	K273-R277 VanDerWaalsContact O-CG 3.31Å; K273-R277 WeakPolarHBondContact O-CG 3.23Å; K273-R277 PolarHBondContact O-N 3.49Å; E274-R277 PolarHBondContact O-N 2.84Å; E274-R277 IonicContact OE2-NH1 3.46Å; E274-R277 PolarHBondContact OE2-NH1 3.49Å; R275-R277 PolarHBondContact O-N 3.21Å; R277-A279 VanDerWaalsContact C-N 3.33Å; R277-A279 PolarHBondContact O-N 3.03Å; R277-V280 PolarHBondContact O-N 2.96Å; R277-L281 WeakPolarHBondContact O-CB 3.31Å; R277-L281 PolarHBondContact O-N 2.93Å
278	A	91.6	Very high	87.4	Confident	30 Å²	30	82 Å²	82	25%	0.248	40%	0.4	C	S	.	.	H	α-helix	trans	-63.4	-38.8	179.3	0	0	0	0	0	111.9	F191 E274 R275 L281 L282	F191-A278 HydrophobicContact CE1-CB 4.25Å; F191-A278 HydrophobicContact CZ-CB 3.84Å; E274-A278 VanDerWaalsContact O-CB 3.27Å; E274-A278 WeakPolarHBondContact O-CB 3.36Å; E274-A278 PolarHBondContact O-N 3.31Å; R275-A278 PolarHBondContact O-N 3.37Å; A278-L281 PolarHBondContact O-N 2.89Å; A278-L282 WeakPolarHBondContact O-CB 3.45Å; A278-L282 VanDerWaalsContact O-CG 3.31Å; A278-L282 WeakPolarHBondContact O-CG 3.27Å; A278-L282 PolarHBondContact O-N 3.16Å
279	A	90.2	Very high	86.3	Confident	0 Å²	0	82.9 Å²	82.9	0%	0	41%	0.406	C	S	.	.	H	α-helix	trans	-61.7	-45.2	176.2	0	0	0	0	0	112	C183 I184 F191 R275 D276 R277 A283	C183-A279 HydrophobicContact CB-CB 3.97Å; I184-A279 HydrophobicContact CD1-CB 4.34Å; I184-A279 HydrophobicContact CG1-CB 3.71Å; F191-A279 HydrophobicContact CE2-CB 4.02Å; R275-A279 WeakPolarHBondContact O-CB 3.24Å; R275-A279 PolarHBondContact O-N 2.95Å; D276-A279 PolarHBondContact O-N 3.29Å; R277-A279 VanDerWaalsContact C-N 3.33Å; R277-A279 PolarHBondContact O-N 3.03Å; A279-A283 WeakPolarHBondContact O-CB 3.43Å; A279-A283 PolarHBondContact O-N 3.49Å
280	V	89	Confident	84.8	Confident	37 Å²	37	82 Å²	82	22%	0.224	42%	0.418	C	S	.	.	H	α-helix	trans	-64	-43.6	176.4	175.3	0	0	0	0	111.1	R179 A180 D276 R277 K284	R179-V280 HydrophobicContact CG-CG2 4.31Å; A180-V280 HydrophobicContact CB-CG2 3.82Å; D276-V280 WeakPolarHBondContact O-CG2 3.41Å; D276-V280 PolarHBondContact O-N 3.45Å; D276-V280 VanDerWaalsContact O-N 3.16Å; R277-V280 PolarHBondContact O-N 2.96Å; V280-K284 PolarHBondContact O-N 2.88Å; V280-K284 VanDerWaalsContact O-N 3.13Å
281	L	88.5	Confident	83.5	Confident	120 Å²	120	78.3 Å²	78.3	63%	0.628	41%	0.408	S	S	*	.	H	α-helix	trans	-64.1	-44.3	179.2	-173.6	149.3	0	0	0	112	R277 A278 K284 S285	R277-L281 WeakPolarHBondContact O-CB 3.31Å; R277-L281 PolarHBondContact O-N 2.93Å; A278-L281 PolarHBondContact O-N 2.89Å; L281-K284 WeakPolarHBondContact O-CB 3.35Å; L281-K284 PolarHBondContact O-N 3.36Å; L281-S285 PolarHBondContact O-N 2.97Å; L281-S285 VanDerWaalsContact O-N 3.08Å
282	L	89.1	Confident	82.2	Confident	56 Å²	56	78.2 Å²	78.2	29%	0.293	41%	0.406	S	S	.	.	H	α-helix	trans	-67.5	-43.4	179.1	-73.7	167.5	0	0	0	111.5	L190 A278 K284 S285 F286	L190-L282 HydrophobicContact CD2-CB 3.9Å; L190-L282 HydrophobicContact CD2-CD1 3.44Å; L190-L282 VanDerWaalsContact CD2-CD1 3.44Å; L190-L282 HydrophobicContact CD2-CG 4.24Å; A278-L282 WeakPolarHBondContact O-CB 3.45Å; A278-L282 VanDerWaalsContact O-CG 3.31Å; A278-L282 WeakPolarHBondContact O-CG 3.27Å; A278-L282 PolarHBondContact O-N 3.16Å; L282-K284 VanDerWaalsContact C-N 3.25Å; L282-K284 PolarHBondContact O-N 3.27Å; L282-S285 WeakPolarHBondContact CA-OG 3.4Å; L282-S285 WeakPolarHBondContact O-CA 3.34Å; L282-S285 PolarHBondContact O-N 3.38Å; L282-S285 PolarHBondContact O-OG 3.16Å; L282-F286 HydrophobicContact CB-CD2 4.42Å; L282-F286 HydrophobicContact CB-CE2 4.17Å; L282-F286 WeakPolarHBondContact O-CD2 3.46Å; L282-F286 PolarHBondContact O-N 3.48Å
283	A	88	Confident	80.8	Confident	3 Å²	3	74.3 Å²	74.3	3%	0.025	40%	0.398	C	S	.	.	H	α-helix	trans	-55.3	-42.6	174.5	0	0	0	0	0	112	C183 M187 A279 S285 F286 G287 L288	C183-A283 HydrophobicContact CB-CB 4.13Å; C183-A283 WeakPolarHBondContact SG-CB 3.35Å; M187-A283 HydrophobicContact CE-CB 3.6Å; A279-A283 WeakPolarHBondContact O-CB 3.43Å; A279-A283 PolarHBondContact O-N 3.49Å; A283-S285 PolarHBondContact O-N 3.06Å; A283-F286 PolarHBondContact O-N 3.39Å; A283-G287 PolarHBondContact O-N 2.84Å; A283-L288 HydrophobicContact CB-CB 4.47Å; A283-L288 WeakPolarHBondContact O-CB 3.44Å; A283-L288 PolarHBondContact O-N 2.82Å
284	K	85.1	Confident	79.3	Confident	154 Å²	154	73.5 Å²	73.5	67%	0.67	41%	0.406	S	S	*	.	H	α-helix	trans	-61.4	-42.1	174.2	-173.3	176.1	-178.5	179.4	0	112.1	V280 L281 L282 F286 G287	V280-K284 PolarHBondContact O-N 2.88Å; V280-K284 VanDerWaalsContact O-N 3.13Å; L281-K284 WeakPolarHBondContact O-CB 3.35Å; L281-K284 PolarHBondContact O-N 3.36Å; L282-K284 VanDerWaalsContact C-N 3.25Å; L282-K284 PolarHBondContact O-N 3.27Å; K284-F286 VanDerWaalsContact C-N 3.32Å; K284-F286 PolarHBondContact O-N 2.86Å; K284-G287 PolarHBondContact O-N 3.42Å
285	S	86.8	Confident	77.8	Confident	82 Å²	82	75.4 Å²	75.4	57%	0.573	42%	0.419	S	S	*	.	H	α-helix	trans	-66.9	-32.1	178.5	74.9	0	0	0	0	113.5	L281 L282 A283 G287	L281-S285 PolarHBondContact O-N 2.97Å; L281-S285 VanDerWaalsContact O-N 3.08Å; L282-S285 WeakPolarHBondContact CA-OG 3.4Å; L282-S285 WeakPolarHBondContact O-CA 3.34Å; L282-S285 PolarHBondContact O-N 3.38Å; L282-S285 PolarHBondContact O-OG 3.16Å; A283-S285 PolarHBondContact O-N 3.06Å; S285-G287 PolarHBondContact O-N 3.36Å
286	F	85.4	Confident	76.2	Confident	132 Å²	132	78.4 Å²	78.4	58%	0.579	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	0.4	175.3	-70	-61.1	0	0	0	113.4	M187 L190 L282 A283 K284 L288	M187-F286 HydrophobicContact CE-CD2 4.41Å; M187-F286 HydrophobicContact SD-CD2 3.68Å; M187-F286 HydrophobicContact SD-CE2 4.02Å; L190-F286 HydrophobicContact CD2-CE2 4.44Å; L282-F286 HydrophobicContact CB-CD2 4.42Å; L282-F286 HydrophobicContact CB-CE2 4.17Å; L282-F286 WeakPolarHBondContact O-CD2 3.46Å; L282-F286 PolarHBondContact O-N 3.48Å; A283-F286 PolarHBondContact O-N 3.39Å; K284-F286 VanDerWaalsContact C-N 3.32Å; K284-F286 PolarHBondContact O-N 2.86Å; F286-L288 HydrophobicContact CB-CD1 4.41Å; F286-L288 HydrophobicContact CB-CG 4.21Å; F286-L288 PolarHBondContact O-N 2.87Å
287	G	78	Confident	74.5	Confident	59 Å²	59	85 Å²	85	61%	0.608	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.4	17.1	-177.4	0	0	0	0	0	113.5	A283 K284 S285 D289	A283-G287 PolarHBondContact O-N 2.84Å; K284-G287 PolarHBondContact O-N 3.42Å; S285-G287 PolarHBondContact O-N 3.36Å; G287-D289 PolarHBondContact O-N 3.34Å
288	L	73.5	Confident	73	Confident	77 Å²	77	85.3 Å²	85.3	40%	0.403	47%	0.472	S	S	.	.			trans	-80.1	53.5	172.3	-60.5	176.8	0	0	0	110	M187 A283 F286 A290	M187-L288 HydrophobicContact CE-CD1 4.19Å; M187-L288 HydrophobicContact CG-CD1 4.34Å; M187-L288 HydrophobicContact SD-CD1 4.05Å; A283-L288 HydrophobicContact CB-CB 4.47Å; A283-L288 WeakPolarHBondContact O-CB 3.44Å; A283-L288 PolarHBondContact O-N 2.82Å; F286-L288 HydrophobicContact CB-CD1 4.41Å; F286-L288 HydrophobicContact CB-CG 4.21Å; F286-L288 PolarHBondContact O-N 2.87Å; L288-A290 PolarHBondContact O-N 3.23Å; L288-A290 VanDerWaalsContact O-N 3.15Å
289	D	63.9	Low	71.5	Confident	74 Å²	74	88 Å²	88	40%	0.396	49%	0.49	S	S	.	.	G	3₁₀ helix	trans	-68.3	-8.8	179.8	-115	10.3	0	0	0	112	G287 L291 K292	G287-D289 PolarHBondContact O-N 3.34Å; D289-L291 PolarHBondContact O-N 2.99Å; D289-L291 VanDerWaalsContact O-N 3.15Å; D289-K292 WeakPolarHBondContact O-CB 3.34Å; D289-K292 PolarHBondContact O-N 3.47Å; D289-K292 VanDerWaalsContact O-N 3.16Å
290	A	57.3	Low	70.3	Confident	99 Å²	99	97.6 Å²	97.6	82%	0.818	53%	0.527	S	S	*	.	G	3₁₀ helix	trans	-65.7	-8.3	176.2	0	0	0	0	0	114.7	L288 K292	L288-A290 PolarHBondContact O-N 3.23Å; L288-A290 VanDerWaalsContact O-N 3.15Å; A290-K292 VanDerWaalsContact C-N 3.33Å
291	L	60.1	Low	69.1	Low	56 Å²	56	98.2 Å²	98.2	29%	0.293	53%	0.531	S	S	.	.	G	3₁₀ helix	trans	-91.1	6.9	174.1	-61.6	177.8	0	0	0	113.1	A182 C183 D289	A182-L291 HydrophobicContact CB-CD2 4.02Å; C183-L291 HydrophobicContact CB-CD1 4.17Å; C183-L291 WeakPolarHBondContact SG-CD1 3.3Å; D289-L291 PolarHBondContact O-N 2.99Å; D289-L291 VanDerWaalsContact O-N 3.15Å
292	K	63.1	Low	68.6	Low	79 Å²	79	96.3 Å²	96.3	34%	0.343	52%	0.521	S	S	.	.	S	Bend	trans	-67.4	139.3	167.6	-104.3	178.8	169.1	-175	0	110.3	D289 A290 Q296	D289-K292 WeakPolarHBondContact O-CB 3.34Å; D289-K292 PolarHBondContact O-N 3.47Å; D289-K292 VanDerWaalsContact O-N 3.16Å; A290-K292 VanDerWaalsContact C-N 3.33Å; K292-Q296 HydrophobicContact CD-CB 4.08Å; K292-Q296 HydrophobicContact CG-CB 4.43Å; K292-Q296 PolarHBondContact NZ-O 2.99Å
293	P	59.3	Low	68.1	Low	45 Å²	45	100.8 Å²	100.8	29%	0.292	54%	0.541	S	S	.	.			trans	-58.7	142.3	164.1	26.6	-33	0	0	0	108.3	R179 D295 Q296	R179-P293 VanDerWaalsContact NH2-CG 3.29Å; P293-D295 PolarHBondContact O-N 2.99Å; P293-Q296 HydrophobicContact CG-CG 4.34Å; P293-Q296 PolarHBondContact O-N 3.36Å; P293-Q296 VanDerWaalsContact O-N 3.16Å
294	P	57.1	Low	67.7	Low	113 Å²	113	111.4 Å²	111.4	73%	0.734	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.3	-22.6	-172.2	22.6	-33.8	0	0	0	113.4	Q296	P294-Q296 VanDerWaalsContact C-N 3.29Å; P294-Q296 PolarHBondContact O-N 3.13Å
295	D	58.1	Low	67.3	Low	151 Å²	151	107.7 Å²	107.7	81%	0.807	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	-7.6	-175.6	-56.1	-17.7	0	0	0	114.3	P293 E297	P293-D295 PolarHBondContact O-N 2.99Å; D295-E297 VanDerWaalsContact C-N 3.33Å; D295-E297 PolarHBondContact O-N 3.08Å
296	Q	56.1	Low	67	Low	98 Å²	98	104.9 Å²	104.9	46%	0.458	55%	0.552	S	S	.	*			trans	-97	53.5	174.1	-68.1	-172	-4	0	0	111.4	K292 P293 P294 Q298	K292-Q296 HydrophobicContact CD-CB 4.08Å; K292-Q296 HydrophobicContact CG-CB 4.43Å; K292-Q296 PolarHBondContact NZ-O 2.99Å; P293-Q296 HydrophobicContact CG-CG 4.34Å; P293-Q296 PolarHBondContact O-N 3.36Å; P293-Q296 VanDerWaalsContact O-N 3.16Å; P294-Q296 VanDerWaalsContact C-N 3.29Å; P294-Q296 PolarHBondContact O-N 3.13Å; Q296-Q298 PolarHBondContact O-N 3.49Å
297	E	54.8	Low	66.9	Low	171 Å²	171	100.5 Å²	100.5	80%	0.799	54%	0.537	S	S	*	.			trans	-50.4	128	160.4	-69.6	-176	170.9	0	0	107.5	D295 S299	D295-E297 VanDerWaalsContact C-N 3.33Å; D295-E297 PolarHBondContact O-N 3.08Å; E297-S299 VanDerWaalsContact C-N 3.29Å; E297-S299 PolarHBondContact O-N 3.47Å
298	Q	57.1	Low	66.8	Low	155 Å²	155	107.9 Å²	107.9	72%	0.724	55%	0.553	S	S	*	*			trans	-56.5	103.5	168.3	-72.5	175.6	-10.4	0	0	105.5	Q296 Y300	Q296-Q298 PolarHBondContact O-N 3.49Å; Q298-Y300 VanDerWaalsContact C-N 3.32Å; Q298-Y300 PolarHBondContact O-N 3.17Å
299	S	60.9	Low	67	Low	88 Å²	88	109.7 Å²	109.7	62%	0.615	56%	0.563	S	S	*	*			trans	-60.8	104	175.6	58.9	0	0	0	0	105.6	E297 V301	E297-S299 VanDerWaalsContact C-N 3.29Å; E297-S299 PolarHBondContact O-N 3.47Å; S299-V301 VanDerWaalsContact C-N 3.28Å; S299-V301 WeakPolarHBondContact O-CG2 3.48Å; S299-V301 PolarHBondContact O-N 3.29Å
300	Y	64.6	Low	68.1	Low	201 Å²	201	107.4 Å²	107.4	79%	0.788	55%	0.553	S	S	*	*			trans	-67.9	96	176.4	-175.2	-93.7	0	0	0	106.6	Q298 D302	Q298-Y300 VanDerWaalsContact C-N 3.32Å; Q298-Y300 PolarHBondContact O-N 3.17Å; Y300-D302 PolarHBondContact O-N 3.39Å
301	V	65.2	Low	69.5	Low	49 Å²	49	107 Å²	107	30%	0.297	55%	0.549	S	S	.	.			trans	-77.2	108.6	178.9	-176.9	0	0	0	0	106.6	S299 E303 L306 A318	S299-V301 VanDerWaalsContact C-N 3.28Å; S299-V301 WeakPolarHBondContact O-CG2 3.48Å; S299-V301 PolarHBondContact O-N 3.29Å; V301-E303 PolarHBondContact O-N 2.92Å; V301-E303 VanDerWaalsContact O-N 3.11Å; V301-L306 HydrophobicContact CG1-CD2 3.82Å; V301-L306 HydrophobicContact CG1-CG 4.13Å; V301-A318 HydrophobicContact CB-CB 4.25Å; V301-A318 HydrophobicContact CG1-CB 3.86Å; V301-A318 HydrophobicContact CG2-CB 3.82Å
302	D	76.7	Confident	70.6	Confident	80 Å²	80	112.2 Å²	112.2	43%	0.428	57%	0.57	S	S	.	*			trans	-52.3	119.2	175.2	179.4	1.6	0	0	0	109.3	Y300 R304 S305	Y300-D302 PolarHBondContact O-N 3.39Å; D302-R304 PolarHBondContact O-N 3.45Å; D302-R304 WeakPolarHBondContact OD1-CB 3.41Å; D302-R304 WeakPolarHBondContact OD1-CG 3.49Å; D302-R304 PolarHBondContact OD1-N 3.2Å; D302-R304 VanDerWaalsContact OD1-N 3.09Å; D302-S305 WeakPolarHBondContact O-CB 3.45Å; D302-S305 PolarHBondContact O-N 3.02Å; D302-S305 PolarHBondContact O-OG 3.41Å
303	E	78.6	Confident	71.5	Confident	151 Å²	151	112.9 Å²	112.9	71%	0.706	58%	0.577	S	S	*	*	G	3₁₀ helix	trans	-56.9	-26.2	-176.4	-63.3	-171.3	170	0	0	112.3	V301 S305 L306	V301-E303 PolarHBondContact O-N 2.92Å; V301-E303 VanDerWaalsContact O-N 3.11Å; E303-S305 PolarHBondContact O-N 3.38Å; E303-L306 WeakPolarHBondContact O-CB 3.4Å; E303-L306 PolarHBondContact O-N 2.92Å
304	R	79.1	Confident	72.8	Confident	226 Å²	226	114 Å²	114	85%	0.853	59%	0.585	S	S	*	*	G	3₁₀ helix	trans	-67.9	-23.4	176.7	-62.4	174.7	172.8	-177.7	-0.8	113.4	D302 L306	D302-R304 PolarHBondContact O-N 3.45Å; D302-R304 WeakPolarHBondContact OD1-CB 3.41Å; D302-R304 WeakPolarHBondContact OD1-CG 3.49Å; D302-R304 PolarHBondContact OD1-N 3.2Å; D302-R304 VanDerWaalsContact OD1-N 3.09Å; R304-L306 VanDerWaalsContact C-N 3.34Å
305	S	77.7	Confident	73.9	Confident	76 Å²	76	114.9 Å²	114.9	53%	0.531	58%	0.579	S	S	.	*	G	3₁₀ helix	trans	-83.3	-14.2	178.2	74.4	0	0	0	0	112.9	D302 E303	D302-S305 WeakPolarHBondContact O-CB 3.45Å; D302-S305 PolarHBondContact O-N 3.02Å; D302-S305 PolarHBondContact O-OG 3.41Å; E303-S305 PolarHBondContact O-N 3.38Å
306	L	80.5	Confident	75.2	Confident	23 Å²	23	112.5 Å²	112.5	12%	0.12	57%	0.565	C	S	.	*	S	Bend	trans	-76.1	145.4	-177.3	-67.1	171	0	0	0	111.3	V301 E303 R304 P314 A318	V301-L306 HydrophobicContact CG1-CD2 3.82Å; V301-L306 HydrophobicContact CG1-CG 4.13Å; E303-L306 WeakPolarHBondContact O-CB 3.4Å; E303-L306 PolarHBondContact O-N 2.92Å; R304-L306 VanDerWaalsContact C-N 3.34Å; L306-P314 HydrophobicContact CD1-CB 4.17Å; L306-A318 HydrophobicContact CD2-CB 3.82Å
307	P	83.2	Confident	76.7	Confident	40 Å²	40	108.7 Å²	108.7	26%	0.26	55%	0.55	S	S	.	.	P	Polyproline II helix	trans	-63.9	155.9	173.1	-7.4	17.2	0	0	0	111.8	N309 S310 A321	P307-N309 PolarHBondContact O-N 3.48Å; P307-S310 WeakPolarHBondContact O-CB 3.07Å; P307-S310 PolarHBondContact O-N 3.33Å; P307-S310 PolarHBondContact O-OG 3.33Å; P307-A321 HydrophobicContact CG-CB 4.08Å
308	F	75.5	Confident	78.1	Confident	214 Å²	214	101.1 Å²	101.1	94%	0.939	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	137.9	166.8	-171.4	-99.3	0	0	0	110.3
309	N	78.8	Confident	79.5	Confident	115 Å²	115	98.1 Å²	98.1	62%	0.615	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.7	19.2	-170.8	-160	28.3	0	0	0	116.7	P307 A311	P307-N309 PolarHBondContact O-N 3.48Å; N309-A311 PolarHBondContact O-N 3.49Å
310	S	87.1	Confident	80.7	Confident	26 Å²	26	97.9 Å²	97.9	18%	0.182	50%	0.496	C	S	.	.	G	3₁₀ helix	trans	-73.9	-9.1	173.3	57.5	0	0	0	0	115.1	P307 F312 N313 S317	P307-S310 WeakPolarHBondContact O-CB 3.07Å; P307-S310 PolarHBondContact O-N 3.33Å; P307-S310 PolarHBondContact O-OG 3.33Å; S310-F312 VanDerWaalsContact C-N 3.28Å; S310-F312 PolarHBondContact O-N 3.29Å; S310-N313 CarbonylContact O-C 3.27Å; S310-N313 VanDerWaalsContact O-C 3.27Å; S310-N313 PolarHBondContact O-N 3.14Å; S310-S317 WeakPolarHBondContact CA-OG 3.41Å
311	A	85.5	Confident	81.7	Confident	91 Å²	91	89.3 Å²	89.3	75%	0.752	47%	0.466	S	S	*	.	G	3₁₀ helix	trans	-59.2	-31.8	-172.7	0	0	0	0	0	114.7	N309	N309-A311 PolarHBondContact O-N 3.49Å
312	F	83.2	Confident	82.8	Confident	165 Å²	165	91.4 Å²	91.4	72%	0.724	47%	0.473	S	S	*	.	G	3₁₀ helix	trans	-83.5	-26	-178	-68.6	-82.1	0	0	0	113.1	S310	S310-F312 VanDerWaalsContact C-N 3.28Å; S310-F312 PolarHBondContact O-N 3.29Å
313	N	83.2	Confident	83.3	Confident	92 Å²	92	95.6 Å²	95.6	49%	0.492	48%	0.483	S	S	.	.			trans	-156.7	84.5	-177.9	-68.4	-67.5	0	0	0	110.5	S310 E315 L316 S317	S310-N313 CarbonylContact O-C 3.27Å; S310-N313 VanDerWaalsContact O-C 3.27Å; S310-N313 PolarHBondContact O-N 3.14Å; N313-E315 PolarHBondContact O-N 2.92Å; N313-L316 HydrophobicContact CB-CB 4.03Å; N313-L316 HydrophobicContact CB-CD1 3.96Å; N313-L316 HydrophobicContact CB-CG 4.18Å; N313-S317 VanDerWaalsContact O-CB 3.32Å; N313-S317 WeakPolarHBondContact O-CB 3.43Å; N313-S317 PolarHBondContact O-N 2.85Å; N313-S317 PolarHBondContact O-OG 3.38Å
314	P	85.2	Confident	83.6	Confident	70 Å²	70	94 Å²	94	46%	0.455	47%	0.47	S	S	.	.	H	α-helix	trans	-64.4	-40.3	-176.4	23.9	-32.8	0	0	0	112.1	L306 S317 A318	L306-P314 HydrophobicContact CD1-CB 4.17Å; P314-S317 CarbonylContact O-C 3.59Å; P314-S317 WeakPolarHBondContact O-CB 3.14Å; P314-S317 PolarHBondContact O-N 2.84Å; P314-A318 WeakPolarHBondContact O-CB 3.4Å; P314-A318 PolarHBondContact O-N 2.92Å
315	E	81.6	Confident	83.9	Confident	131 Å²	131	88.4 Å²	88.4	61%	0.612	45%	0.454	S	S	*	.	H	α-helix	trans	-59.9	-50.6	178.3	-66.2	-64.1	154.3	0	0	112.8	N313 S317 A318 I319	N313-E315 PolarHBondContact O-N 2.92Å; E315-S317 VanDerWaalsContact C-N 3.26Å; E315-S317 PolarHBondContact O-N 3.07Å; E315-A318 WeakPolarHBondContact O-CB 3.23Å; E315-A318 PolarHBondContact O-N 3.43Å; E315-I319 WeakPolarHBondContact O-CG1 3.26Å; E315-I319 PolarHBondContact O-N 2.91Å
316	L	83.7	Confident	84.3	Confident	100 Å²	100	91.8 Å²	91.8	52%	0.524	46%	0.455	S	S	.	.	H	α-helix	trans	-63.9	-37.6	177.2	-64.2	179.4	0	0	0	111	N313 A318 I319 L320	N313-L316 HydrophobicContact CB-CB 4.03Å; N313-L316 HydrophobicContact CB-CD1 3.96Å; N313-L316 HydrophobicContact CB-CG 4.18Å; L316-A318 VanDerWaalsContact C-N 3.35Å; L316-I319 PolarHBondContact O-N 3.37Å; L316-L320 WeakPolarHBondContact O-CB 3.46Å; L316-L320 VanDerWaalsContact O-CG 3.3Å; L316-L320 WeakPolarHBondContact O-CG 3.45Å; L316-L320 PolarHBondContact O-N 2.91Å
317	S	87.4	Confident	84.6	Confident	19 Å²	19	96.3 Å²	96.3	13%	0.133	48%	0.475	C	S	.	.	H	α-helix	trans	-65.9	-39	178.2	-60.5	0	0	0	0	111.8	S310 N313 P314 E315 L320 A321	S310-S317 WeakPolarHBondContact CA-OG 3.41Å; N313-S317 VanDerWaalsContact O-CB 3.32Å; N313-S317 WeakPolarHBondContact O-CB 3.43Å; N313-S317 PolarHBondContact O-N 2.85Å; N313-S317 PolarHBondContact O-OG 3.38Å; P314-S317 CarbonylContact O-C 3.59Å; P314-S317 WeakPolarHBondContact O-CB 3.14Å; P314-S317 PolarHBondContact O-N 2.84Å; E315-S317 VanDerWaalsContact C-N 3.26Å; E315-S317 PolarHBondContact O-N 3.07Å; S317-L320 PolarHBondContact O-N 3.31Å; S317-A321 VanDerWaalsContact O-CB 3.24Å; S317-A321 WeakPolarHBondContact O-CB 3.42Å; S317-A321 PolarHBondContact O-N 3.43Å
318	A	85.4	Confident	84.7	Confident	12 Å²	12	102.9 Å²	102.9	10%	0.099	50%	0.495	C	S	.	.	H	α-helix	trans	-61.1	-51.2	173.9	0	0	0	0	0	111.3	V301 L306 P314 E315 L316 L320 A321 E322	V301-A318 HydrophobicContact CB-CB 4.25Å; V301-A318 HydrophobicContact CG1-CB 3.86Å; V301-A318 HydrophobicContact CG2-CB 3.82Å; L306-A318 HydrophobicContact CD2-CB 3.82Å; P314-A318 WeakPolarHBondContact O-CB 3.4Å; P314-A318 PolarHBondContact O-N 2.92Å; E315-A318 WeakPolarHBondContact O-CB 3.23Å; E315-A318 PolarHBondContact O-N 3.43Å; L316-A318 VanDerWaalsContact C-N 3.35Å; A318-L320 VanDerWaalsContact C-N 3.31Å; A318-L320 PolarHBondContact O-N 2.76Å; A318-A321 WeakPolarHBondContact O-CB 3.49Å; A318-A321 PolarHBondContact O-N 3.34Å; A318-A321 VanDerWaalsContact O-N 3.11Å; A318-E322 PolarHBondContact O-N 3.08Å
319	I	85.4	Confident	85.2	Confident	92 Å²	92	97.3 Å²	97.3	47%	0.472	47%	0.472	S	S	.	.	H	α-helix	trans	-58.8	-43.4	178.8	-65.8	165.8	0	0	0	111.1	E315 L316 R323	E315-I319 WeakPolarHBondContact O-CG1 3.26Å; E315-I319 PolarHBondContact O-N 2.91Å; L316-I319 PolarHBondContact O-N 3.37Å; I319-R323 WeakPolarHBondContact O-CB 3.49Å; I319-R323 PolarHBondContact O-N 3.46Å
320	L	86.7	Confident	85.4	Confident	83 Å²	83	94.9 Å²	94.9	44%	0.435	46%	0.464	S	S	.	.	H	α-helix	trans	-68.9	-36.7	177.2	-71	174.7	0	0	0	112.4	L316 S317 A318 R324	L316-L320 WeakPolarHBondContact O-CB 3.46Å; L316-L320 VanDerWaalsContact O-CG 3.3Å; L316-L320 WeakPolarHBondContact O-CG 3.45Å; L316-L320 PolarHBondContact O-N 2.91Å; S317-L320 PolarHBondContact O-N 3.31Å; A318-L320 VanDerWaalsContact C-N 3.31Å; A318-L320 PolarHBondContact O-N 2.76Å; L320-R324 WeakPolarHBondContact O-CG 3.36Å; L320-R324 PolarHBondContact O-N 3.28Å; L320-R324 VanDerWaalsContact O-N 3.07Å; L320-R324 PolarHBondContact O-NE 3.22Å
321	A	86.8	Confident	85.1	Confident	20 Å²	20	100.5 Å²	100.5	17%	0.165	48%	0.481	C	S	.	.	H	α-helix	trans	-63.3	-46.6	174.4	0	0	0	0	0	111.2	P307 S317 A318 R323 R324 Q325	P307-A321 HydrophobicContact CG-CB 4.08Å; S317-A321 VanDerWaalsContact O-CB 3.24Å; S317-A321 WeakPolarHBondContact O-CB 3.42Å; S317-A321 PolarHBondContact O-N 3.43Å; A318-A321 WeakPolarHBondContact O-CB 3.49Å; A318-A321 PolarHBondContact O-N 3.34Å; A318-A321 VanDerWaalsContact O-N 3.11Å; A321-R323 PolarHBondContact O-N 3.09Å; A321-R324 WeakPolarHBondContact O-CB 3.35Å; A321-R324 PolarHBondContact O-N 2.86Å; A321-R324 VanDerWaalsContact O-N 3.14Å; A321-Q325 PolarHBondContact O-N 3.07Å
322	E	86.7	Confident	84.8	Confident	93 Å²	93	103.6 Å²	103.6	44%	0.435	48%	0.477	S	S	.	.	H	α-helix	trans	-61	-45.3	177.4	-165.6	-169	-174	0	0	111.4	A318 R324 Q325 R326	A318-E322 PolarHBondContact O-N 3.08Å; E322-R324 VanDerWaalsContact C-N 3.3Å; E322-R324 PolarHBondContact O-N 3.2Å; E322-Q325 PolarHBondContact O-N 3.46Å; E322-Q325 VanDerWaalsContact O-N 3.13Å; E322-R326 WeakPolarHBondContact O-CG 3.28Å; E322-R326 PolarHBondContact O-N 2.85Å; E322-R326 IonicContact OE1-CZ 2.69Å; E322-R326 IonicContact OE1-NE 2.94Å; E322-R326 IonicContact OE1-NH2 3.91Å; E322-R326 PolarHBondContact OE1-NH2 3.27Å; E322-R326 IonicContact OE2-CZ 2.74Å; E322-R326 IonicContact OE2-NH2 2.68Å; E322-R326 PolarHBondContact OE2-NH2 2.94Å; E322-R326 VanDerWaalsContact OE2-NH2 3.12Å
323	R	87.2	Confident	84	Confident	168 Å²	168	105.1 Å²	105.1	63%	0.634	48%	0.478	S	S	*	.	H	α-helix	trans	-57.4	-43.5	174.4	-173.4	-174.5	-67.5	-169.3	-1.1	111.8	I319 A321 H327	I319-R323 WeakPolarHBondContact O-CB 3.49Å; I319-R323 PolarHBondContact O-N 3.46Å; A321-R323 PolarHBondContact O-N 3.09Å; R323-H327 PolarHBondContact O-N 3.45Å; R323-H327 VanDerWaalsContact O-N 3.12Å
324	R	85.3	Confident	83.1	Confident	118 Å²	118	104.3 Å²	104.3	45%	0.445	48%	0.48	S	S	.	.	H	α-helix	trans	-65.2	-39.4	176.2	-77.9	-179.6	-72.3	-131.4	-6.1	111.9	L320 A321 E322 H327 R328	L320-R324 WeakPolarHBondContact O-CG 3.36Å; L320-R324 PolarHBondContact O-N 3.28Å; L320-R324 VanDerWaalsContact O-N 3.07Å; L320-R324 PolarHBondContact O-NE 3.22Å; A321-R324 WeakPolarHBondContact O-CB 3.35Å; A321-R324 PolarHBondContact O-N 2.86Å; A321-R324 VanDerWaalsContact O-N 3.14Å; E322-R324 VanDerWaalsContact C-N 3.3Å; E322-R324 PolarHBondContact O-N 3.2Å; R324-H327 PolarHBondContact O-N 3.5Å; R324-R328 WeakPolarHBondContact O-CG 3.05Å; R324-R328 PolarHBondContact O-N 2.8Å
325	Q	85.9	Confident	81.9	Confident	109 Å²	109	108.4 Å²	108.4	51%	0.509	49%	0.487	S	S	.	.	H	α-helix	trans	-63.9	-48.7	177.1	-178.7	171.9	-8.7	0	0	111.3	A321 E322 H327 R328 E329	A321-Q325 PolarHBondContact O-N 3.07Å; E322-Q325 PolarHBondContact O-N 3.46Å; E322-Q325 VanDerWaalsContact O-N 3.13Å; Q325-H327 VanDerWaalsContact C-N 3.26Å; Q325-H327 PolarHBondContact O-N 3.44Å; Q325-R328 WeakPolarHBondContact O-CA 3.49Å; Q325-R328 WeakPolarHBondContact O-CB 3.49Å; Q325-R328 PolarHBondContact O-N 3.03Å; Q325-E329 HydrophobicContact CG-CG 4.36Å; Q325-E329 VanDerWaalsContact CG-OE1 3.3Å; Q325-E329 WeakPolarHBondContact CG-OE1 3.38Å; Q325-E329 PolarHBondContact NE2-OE1 2.86Å; Q325-E329 WeakPolarHBondContact O-CG 3.38Å; Q325-E329 PolarHBondContact O-N 2.83Å
326	R	86.7	Confident	80.8	Confident	147 Å²	147	110.7 Å²	110.7	56%	0.555	50%	0.495	S	S	*	.	H	α-helix	trans	-54.7	-43.2	174.5	-68.8	179.5	-169.4	156.2	1	111.8	E322 E329 S330	E322-R326 WeakPolarHBondContact O-CG 3.28Å; E322-R326 PolarHBondContact O-N 2.85Å; E322-R326 IonicContact OE1-CZ 2.69Å; E322-R326 IonicContact OE1-NE 2.94Å; E322-R326 IonicContact OE1-NH2 3.91Å; E322-R326 PolarHBondContact OE1-NH2 3.27Å; E322-R326 IonicContact OE2-CZ 2.74Å; E322-R326 IonicContact OE2-NH2 2.68Å; E322-R326 PolarHBondContact OE2-NH2 2.94Å; E322-R326 VanDerWaalsContact OE2-NH2 3.12Å; R326-E329 PolarHBondContact O-N 3.48Å; R326-S330 WeakPolarHBondContact O-CB 3.49Å; R326-S330 PolarHBondContact O-N 2.81Å
327	H	85.9	Confident	79.6	Confident	117 Å²	117	114.1 Å²	114.1	54%	0.542	51%	0.509	S	S	.	.	H	α-helix	trans	-64.1	-42.9	175.5	-172.2	-95.1	0	0	0	112.3	R323 R324 Q325 S330 R331	R323-H327 PolarHBondContact O-N 3.45Å; R323-H327 VanDerWaalsContact O-N 3.12Å; R324-H327 PolarHBondContact O-N 3.5Å; Q325-H327 VanDerWaalsContact C-N 3.26Å; Q325-H327 PolarHBondContact O-N 3.44Å; H327-S330 PolarHBondContact O-N 3.09Å; H327-S330 PolarHBondContact O-OG 3.32Å; H327-R331 PolarHBondContact O-N 2.69Å
328	R	85.6	Confident	78.1	Confident	179 Å²	179	119 Å²	119	68%	0.675	54%	0.537	S	S	*	.	H	α-helix	trans	-61.9	-43.1	174.8	-74.2	175.6	176.8	-178.3	-0.9	112.2	R324 Q325 R331 K332	R324-R328 WeakPolarHBondContact O-CG 3.05Å; R324-R328 PolarHBondContact O-N 2.8Å; Q325-R328 WeakPolarHBondContact O-CA 3.49Å; Q325-R328 WeakPolarHBondContact O-CB 3.49Å; Q325-R328 PolarHBondContact O-N 3.03Å; R328-R331 PolarHBondContact O-N 3.33Å; R328-K332 PolarHBondContact O-N 2.94Å
329	E	86	Confident	76.1	Confident	96 Å²	96	128.3 Å²	128.3	45%	0.449	59%	0.585	S	S	.	*	H	α-helix	trans	-65.4	-40.5	178.8	-72.8	173.2	-175	0	0	111.9	Q325 R326 R331 K332 R333	Q325-E329 HydrophobicContact CG-CG 4.36Å; Q325-E329 VanDerWaalsContact CG-OE1 3.3Å; Q325-E329 WeakPolarHBondContact CG-OE1 3.38Å; Q325-E329 PolarHBondContact NE2-OE1 2.86Å; Q325-E329 WeakPolarHBondContact O-CG 3.38Å; Q325-E329 PolarHBondContact O-N 2.83Å; R326-E329 PolarHBondContact O-N 3.48Å; E329-R331 VanDerWaalsContact C-N 3.31Å; E329-R331 PolarHBondContact O-N 2.79Å; E329-K332 PolarHBondContact O-N 2.81Å; E329-R333 PolarHBondContact O-N 3.1Å
330	S	83	Confident	75.7	Confident	64 Å²	64	130.1 Å²	130.1	45%	0.448	59%	0.591	S	S	.	*	H	α-helix	trans	-60	-40.5	174.4	72.5	0	0	0	0	112.3	R326 H327 R333 S334	R326-S330 WeakPolarHBondContact O-CB 3.49Å; R326-S330 PolarHBondContact O-N 2.81Å; H327-S330 PolarHBondContact O-N 3.09Å; H327-S330 PolarHBondContact O-OG 3.32Å; S330-R333 PolarHBondContact O-N 2.96Å; S330-S334 PolarHBondContact O-N 3.38Å
331	R	80.9	Confident	75.1	Confident	144 Å²	144	132.6 Å²	132.6	54%	0.543	60%	0.599	S	S	.	*	H	α-helix	trans	-66.7	-41.4	174.7	-68.1	-177.6	72.4	173.8	3.5	111.9	H327 R328 E329 R333 S334 Y335	H327-R331 PolarHBondContact O-N 2.69Å; R328-R331 PolarHBondContact O-N 3.33Å; E329-R331 VanDerWaalsContact C-N 3.31Å; E329-R331 PolarHBondContact O-N 2.79Å; R331-R333 VanDerWaalsContact C-N 3.33Å; R331-R333 PolarHBondContact O-N 3.05Å; R331-S334 WeakPolarHBondContact O-CB 3.5Å; R331-S334 PolarHBondContact O-N 3.23Å; R331-Y335 WeakPolarHBondContact O-CD2 3.29Å; R331-Y335 PolarHBondContact O-N 3.33Å
332	K	78.3	Confident	74.4	Confident	156 Å²	156	138.8 Å²	138.8	68%	0.678	62%	0.623	S	S	*	*	H	α-helix	trans	-62.7	-36.9	177.1	-75.7	-174.8	178.2	-175.9	0	112.7	R328 E329 S334 Y335 K336	R328-K332 PolarHBondContact O-N 2.94Å; E329-K332 PolarHBondContact O-N 2.81Å; K332-S334 VanDerWaalsContact C-N 3.35Å; K332-Y335 PolarHBondContact O-N 3.29Å; K332-K336 PolarHBondContact O-N 3.36Å
333	R	66.4	Low	73.7	Confident	198 Å²	198	141.5 Å²	141.5	75%	0.747	63%	0.634	S	S	*	*	H	α-helix	trans	-62.6	-41.9	174.4	-81.9	-177.7	177.6	176.6	-0.1	111.9	E329 S330 R331 Y335 K336 E337	E329-R333 PolarHBondContact O-N 3.1Å; S330-R333 PolarHBondContact O-N 2.96Å; R331-R333 VanDerWaalsContact C-N 3.33Å; R331-R333 PolarHBondContact O-N 3.05Å; R333-Y335 PolarHBondContact O-N 3.38Å; R333-K336 PolarHBondContact O-N 3.25Å; R333-K336 VanDerWaalsContact O-N 3.09Å; R333-E337 PolarHBondContact O-N 3.21Å
334	S	64.8	Low	72.9	Confident	74 Å²	74	139.9 Å²	139.9	52%	0.517	63%	0.634	S	S	.	*	H	α-helix	trans	-61.7	-26.7	177.6	-176.8	0	0	0	0	114.2	S330 R331 K332	S330-S334 PolarHBondContact O-N 3.38Å; R331-S334 WeakPolarHBondContact O-CB 3.5Å; R331-S334 PolarHBondContact O-N 3.23Å; K332-S334 VanDerWaalsContact C-N 3.35Å
335	Y	59.6	Low	72.1	Confident	156 Å²	156	141.3 Å²	141.3	61%	0.612	65%	0.647	S	S	*	*	H	α-helix	trans	-86.1	-20.1	176.2	-72.2	-74.7	0	0	0	113.3	R331 K332 R333	R331-Y335 WeakPolarHBondContact O-CD2 3.29Å; R331-Y335 PolarHBondContact O-N 3.33Å; K332-Y335 PolarHBondContact O-N 3.29Å; R333-Y335 PolarHBondContact O-N 3.38Å
336	K	59.3	Low	71.1	Confident	179 Å²	179	143.6 Å²	143.6	78%	0.778	66%	0.657	S	S	*	*	H	α-helix	trans	-85.4	-11.2	178.4	-90.9	-172.1	173.5	-169.6	0	114.4	K332 R333	K332-K336 PolarHBondContact O-N 3.36Å; R333-K336 PolarHBondContact O-N 3.25Å; R333-K336 VanDerWaalsContact O-N 3.09Å
337	E	58.2	Low	69.9	Low	173 Å²	173	143.4 Å²	143.4	81%	0.808	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.5	0.4	174.4	-79.9	176.9	172.4	0	0	112.8	R333	R333-E337 PolarHBondContact O-N 3.21Å
338	V	56.8	Low	68.5	Low	122 Å²	122	145.6 Å²	145.6	74%	0.739	68%	0.675	S	S	*	*			trans	-113.2	-9.9	-176.4	-175.4	0	0	0	0	113.2
339	D	43.5	Very low	67	Low	206 Å²	206	142.5 Å²	142.5	100%	1.102	68%	0.675	S	S	*	*			trans	-108.2	0	170.2	-68.7	-29.4	0	0	0	109.6

Retrieved 339 of 339 residues in 61.3 ms (Link to these results)

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