A0A087XG65_POEFO Loading...

U3 small nucleolar ribonucleoprotein protein MPP10

Component of the 60-80S U3 small nucleolar ribonucleoprotein (U3 snoRNP). Required for the early cleavages during pre-18S ribosomal RNA processing.

AlphaFold DB , UniProt , Accession A0A087XG65, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 669 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	50.5	Low	74.7	Confident	196 Å²	196	112.6 Å²	112.6	97%	0.966	53%	0.53	S	S	*	.				0	-54.3	0	-65.6	-179	-171.4	0	0	109	N3 R4 E5	M1-N3 PolarHBondContact O-N 2.94Å; M1-R4 WeakPolarHBondContact O-CB 3.43Å; M1-R4 PolarHBondContact O-N 2.62Å; M1-E5 VanDerWaalsContact C-OE2 3.23Å
2	A	59	Low	75.7	Confident	60 Å²	60	110 Å²	110	50%	0.496	52%	0.522	S	S	.	.	H	α-helix	trans	-1.6	-72	162.2	0	0	0	0	0	117.2	R4 E5 M6	A2-R4 PolarHBondContact O-N 3.38Å; A2-E5 VanDerWaalsContact CA-OE2 3.32Å; A2-E5 WeakPolarHBondContact CA-OE2 3.37Å; A2-E5 PolarHBondContact N-OE2 2.88Å; A2-E5 CarbonylContact O-C 3.44Å; A2-E5 WeakPolarHBondContact O-CA 3.4Å; A2-E5 PolarHBondContact O-N 2.87Å; A2-M6 WeakPolarHBondContact O-CB 3.35Å; A2-M6 PolarHBondContact O-N 3.26Å
3	N	66.8	Low	76.5	Confident	117 Å²	117	102.2 Å²	102.2	63%	0.626	49%	0.487	S	S	*	.	H	α-helix	trans	-56.1	-20.3	-177.8	-65.6	16.3	0	0	0	115.1	M1 R7	M1-N3 PolarHBondContact O-N 2.94Å; N3-R7 VanDerWaalsContact O-CG 3.27Å; N3-R7 WeakPolarHBondContact O-CG 3.27Å; N3-R7 PolarHBondContact O-N 3.4Å
4	R	71.9	Confident	77.3	Confident	181 Å²	181	100.5 Å²	100.5	68%	0.683	49%	0.486	S	S	*	.	H	α-helix	trans	-89.2	-28	173.5	-164.4	-179.8	-170.5	-173.3	5.1	112.9	M1 A2 R8	M1-R4 WeakPolarHBondContact O-CB 3.43Å; M1-R4 PolarHBondContact O-N 2.62Å; A2-R4 PolarHBondContact O-N 3.38Å; R4-R8 WeakPolarHBondContact O-CD 3.23Å; R4-R8 WeakPolarHBondContact O-CG 3.2Å; R4-R8 PolarHBondContact O-N 3.36Å
5	E	76.4	Confident	78	Confident	102 Å²	102	100.1 Å²	100.1	48%	0.477	48%	0.481	S	S	.	.	H	α-helix	trans	-74.2	-47.1	170	-75.5	118.6	-157.1	0	0	110.3	M1 A2 R7 R8 V9	M1-E5 VanDerWaalsContact C-OE2 3.23Å; A2-E5 VanDerWaalsContact CA-OE2 3.32Å; A2-E5 WeakPolarHBondContact CA-OE2 3.37Å; A2-E5 PolarHBondContact N-OE2 2.88Å; A2-E5 CarbonylContact O-C 3.44Å; A2-E5 WeakPolarHBondContact O-CA 3.4Å; A2-E5 PolarHBondContact O-N 2.87Å; E5-R7 PolarHBondContact O-N 3.41Å; E5-R8 WeakPolarHBondContact O-CB 3.33Å; E5-R8 PolarHBondContact O-N 2.84Å; E5-V9 PolarHBondContact O-N 2.8Å
6	M	77.4	Confident	78.4	Confident	53 Å²	53	97.9 Å²	97.9	26%	0.261	47%	0.472	S	S	.	.	H	α-helix	trans	-52.1	-48.7	173.3	-178.1	-176.8	84.4	0	0	112.3	A2 R8 V9 L10 L48 V52	A2-M6 WeakPolarHBondContact O-CB 3.35Å; A2-M6 PolarHBondContact O-N 3.26Å; M6-R8 VanDerWaalsContact C-N 3.33Å; M6-R8 PolarHBondContact O-N 3.05Å; M6-V9 PolarHBondContact O-N 3.48Å; M6-L10 HydrophobicContact CG-CD1 4.16Å; M6-L10 WeakPolarHBondContact O-CG 3.46Å; M6-L10 PolarHBondContact O-N 3.33Å; M6-L48 HydrophobicContact CB-CD1 4.43Å; M6-L48 HydrophobicContact CG-CD1 4.11Å; M6-L48 HydrophobicContact CG-CD2 4.16Å; M6-L48 HydrophobicContact CG-CG 4.4Å; M6-V52 HydrophobicContact SD-CG2 4.14Å
7	R	79.5	Confident	78.9	Confident	166 Å²	166	95.7 Å²	95.7	63%	0.626	46%	0.462	S	S	*	.	H	α-helix	trans	-61.3	-38	176.8	-78.2	177.8	-176.7	-170.7	1	112.9	N3 E5 L10 E11	N3-R7 VanDerWaalsContact O-CG 3.27Å; N3-R7 WeakPolarHBondContact O-CG 3.27Å; N3-R7 PolarHBondContact O-N 3.4Å; E5-R7 PolarHBondContact O-N 3.41Å; R7-L10 PolarHBondContact O-N 3.12Å; R7-E11 WeakPolarHBondContact O-CB 3.47Å; R7-E11 WeakPolarHBondContact O-CG 3.39Å; R7-E11 PolarHBondContact O-N 3.06Å
8	R	84.2	Confident	79.3	Confident	133 Å²	133	95.5 Å²	95.5	50%	0.502	46%	0.464	S	S	.	.	H	α-helix	trans	-66.1	-45.3	175.7	-75.3	168.7	166	-176.1	-8.5	112.3	R4 E5 M6 L10 E11 D12	R4-R8 WeakPolarHBondContact O-CD 3.23Å; R4-R8 WeakPolarHBondContact O-CG 3.2Å; R4-R8 PolarHBondContact O-N 3.36Å; E5-R8 WeakPolarHBondContact O-CB 3.33Å; E5-R8 PolarHBondContact O-N 2.84Å; M6-R8 VanDerWaalsContact C-N 3.33Å; M6-R8 PolarHBondContact O-N 3.05Å; R8-L10 VanDerWaalsContact C-N 3.28Å; R8-L10 PolarHBondContact O-N 2.8Å; R8-E11 PolarHBondContact O-N 3.36Å; R8-D12 WeakPolarHBondContact O-CB 3.5Å; R8-D12 VanDerWaalsContact O-CG 3.25Å; R8-D12 PolarHBondContact O-N 2.81Å
9	V	83.9	Confident	79.6	Confident	57 Å²	57	97 Å²	97	35%	0.345	47%	0.474	S	S	.	.	H	α-helix	trans	-59	-42.6	176.3	176	0	0	0	0	110.5	E5 M6 D12 C13 L48	E5-V9 PolarHBondContact O-N 2.8Å; M6-V9 PolarHBondContact O-N 3.48Å; V9-D12 PolarHBondContact O-N 3.21Å; V9-C13 PolarHBondContact O-N 2.89Å; V9-C13 PolarHBondContact O-SG 3.28Å; V9-L48 HydrophobicContact CB-CD2 4.31Å; V9-L48 HydrophobicContact CG1-CD2 3.99Å
10	L	84.9	Confident	79.6	Confident	71 Å²	71	93.5 Å²	93.5	37%	0.372	46%	0.458	S	S	.	.	H	α-helix	trans	-66.7	-43.7	175.1	-67.4	169.2	0	0	0	112.6	M6 R7 R8 D12 C13 V14 L45 L48	M6-L10 HydrophobicContact CG-CD1 4.16Å; M6-L10 WeakPolarHBondContact O-CG 3.46Å; M6-L10 PolarHBondContact O-N 3.33Å; R7-L10 PolarHBondContact O-N 3.12Å; R8-L10 VanDerWaalsContact C-N 3.28Å; R8-L10 PolarHBondContact O-N 2.8Å; L10-D12 VanDerWaalsContact C-N 3.26Å; L10-D12 PolarHBondContact O-N 3Å; L10-C13 PolarHBondContact O-N 2.79Å; L10-V14 WeakPolarHBondContact O-CB 3.41Å; L10-V14 WeakPolarHBondContact O-CG2 3.25Å; L10-V14 PolarHBondContact O-N 3.49Å; L10-L45 HydrophobicContact CD2-CD2 3.74Å; L10-L48 HydrophobicContact CD2-CD2 3.96Å; L10-L48 HydrophobicContact CG-CD2 3.96Å
11	E	87.7	Confident	79.7	Confident	103 Å²	103	92.2 Å²	92.2	48%	0.481	46%	0.456	S	S	.	.	H	α-helix	trans	-58.3	-37.9	173.3	-75.9	164.3	-146.7	0	0	111.9	R7 R8 K15	R7-E11 WeakPolarHBondContact O-CB 3.47Å; R7-E11 WeakPolarHBondContact O-CG 3.39Å; R7-E11 PolarHBondContact O-N 3.06Å; R8-E11 PolarHBondContact O-N 3.36Å; E11-K15 WeakPolarHBondContact O-CD 3.5Å; E11-K15 WeakPolarHBondContact O-CE 3.47Å; E11-K15 VanDerWaalsContact O-CG 3.3Å; E11-K15 WeakPolarHBondContact O-CG 3.45Å; E11-K15 PolarHBondContact O-N 3.42Å; E11-K15 VanDerWaalsContact O-N 3.16Å
12	D	86.1	Confident	81.2	Confident	81 Å²	81	86.5 Å²	86.5	43%	0.433	44%	0.439	S	S	.	.	H	α-helix	trans	-75.7	-38.1	178.8	-67.2	-27.9	0	0	0	112	R8 V9 L10 V14 K15 I16	R8-D12 WeakPolarHBondContact O-CB 3.5Å; R8-D12 VanDerWaalsContact O-CG 3.25Å; R8-D12 PolarHBondContact O-N 2.81Å; V9-D12 PolarHBondContact O-N 3.21Å; L10-D12 VanDerWaalsContact C-N 3.26Å; L10-D12 PolarHBondContact O-N 3Å; D12-V14 VanDerWaalsContact C-N 3.34Å; D12-V14 PolarHBondContact O-N 3.41Å; D12-K15 PolarHBondContact O-N 3.27Å; D12-K15 IonicContact OD1-NZ 2.66Å; D12-K15 PolarHBondContact OD1-NZ 2.93Å; D12-I16 WeakPolarHBondContact O-CG1 3.28Å; D12-I16 PolarHBondContact O-N 2.88Å; D12-I16 VanDerWaalsContact O-N 3.09Å
13	C	85.7	Confident	82.1	Confident	9 Å²	9	89.4 Å²	89.4	6%	0.061	44%	0.442	C	S	.	.	H	α-helix	trans	-60.7	-42.8	170.1	-65.7	0	0	0	0	111.6	V9 L10 K15 I16 I17 L41 L45	V9-C13 PolarHBondContact O-N 2.89Å; V9-C13 PolarHBondContact O-SG 3.28Å; L10-C13 PolarHBondContact O-N 2.79Å; C13-K15 VanDerWaalsContact C-N 3.31Å; C13-K15 PolarHBondContact O-N 2.84Å; C13-I16 PolarHBondContact O-N 3.12Å; C13-I17 WeakPolarHBondContact O-CG1 3.34Å; C13-I17 PolarHBondContact O-N 3.35Å; C13-L41 HydrophobicContact CB-CD1 3.99Å; C13-L41 HydrophobicContact CB-CG 4.18Å; C13-L41 WeakPolarHBondContact O-CD1 3.14Å; C13-L45 HydrophobicContact CB-CD2 4.3Å
14	V	88.3	Confident	82.5	Confident	78 Å²	78	88.2 Å²	88.2	47%	0.473	44%	0.441	S	S	.	.	H	α-helix	trans	-64.1	-34	177.1	168.3	0	0	0	0	111.9	L10 D12 N18	L10-V14 WeakPolarHBondContact O-CB 3.41Å; L10-V14 WeakPolarHBondContact O-CG2 3.25Å; L10-V14 PolarHBondContact O-N 3.49Å; D12-V14 VanDerWaalsContact C-N 3.34Å; D12-V14 PolarHBondContact O-N 3.41Å; V14-N18 WeakPolarHBondContact CG1-ND2 3.44Å; V14-N18 WeakPolarHBondContact O-CB 3.49Å; V14-N18 VanDerWaalsContact O-CG 3.23Å; V14-N18 PolarHBondContact O-N 3.36Å; V14-N18 PolarHBondContact O-ND2 3.04Å
15	K	87.6	Confident	82.7	Confident	95 Å²	95	87.1 Å²	87.1	41%	0.413	44%	0.444	S	S	.	.	H	α-helix	trans	-64.2	-50.9	172.1	-68.5	158.2	-150.8	156.3	0	111	E11 D12 C13 I17 N18 D19	E11-K15 WeakPolarHBondContact O-CD 3.5Å; E11-K15 WeakPolarHBondContact O-CE 3.47Å; E11-K15 VanDerWaalsContact O-CG 3.3Å; E11-K15 WeakPolarHBondContact O-CG 3.45Å; E11-K15 PolarHBondContact O-N 3.42Å; E11-K15 VanDerWaalsContact O-N 3.16Å; D12-K15 PolarHBondContact O-N 3.27Å; D12-K15 IonicContact OD1-NZ 2.66Å; D12-K15 PolarHBondContact OD1-NZ 2.93Å; C13-K15 VanDerWaalsContact C-N 3.31Å; C13-K15 PolarHBondContact O-N 2.84Å; K15-I17 VanDerWaalsContact C-N 3.27Å; K15-I17 PolarHBondContact O-N 3.05Å; K15-N18 PolarHBondContact O-N 3.16Å; K15-D19 WeakPolarHBondContact O-CB 3.24Å; K15-D19 VanDerWaalsContact O-CG 3.28Å; K15-D19 PolarHBondContact O-N 2.71Å
16	I	85.1	Confident	82.4	Confident	65 Å²	65	86 Å²	86	33%	0.333	44%	0.441	S	S	.	.	H	α-helix	trans	-56.7	-40.7	179.1	-65.4	163	0	0	0	111.6	D12 C13 N20 L41	D12-I16 WeakPolarHBondContact O-CG1 3.28Å; D12-I16 PolarHBondContact O-N 2.88Å; D12-I16 VanDerWaalsContact O-N 3.09Å; C13-I16 PolarHBondContact O-N 3.12Å; I16-N20 WeakPolarHBondContact O-CB 3.46Å; I16-N20 PolarHBondContact O-N 2.89Å; I16-N20 VanDerWaalsContact O-N 3.16Å; I16-N20 PolarHBondContact O-ND2 2.89Å; I16-L41 HydrophobicContact CB-CD1 3.99Å; I16-L41 HydrophobicContact CG2-CD1 3.86Å
17	I	86.5	Confident	82.2	Confident	60 Å²	60	88.3 Å²	88.3	31%	0.308	45%	0.45	S	S	.	.	H	α-helix	trans	-64.1	-49.3	174.2	-67.4	163.5	0	0	0	111	C13 K15 N20 T21 F38 L41	C13-I17 WeakPolarHBondContact O-CG1 3.34Å; C13-I17 PolarHBondContact O-N 3.35Å; K15-I17 VanDerWaalsContact C-N 3.27Å; K15-I17 PolarHBondContact O-N 3.05Å; I17-N20 PolarHBondContact O-N 2.9Å; I17-T21 HydrophobicContact CG2-CG2 4.3Å; I17-T21 WeakPolarHBondContact O-CB 3.38Å; I17-T21 VanDerWaalsContact O-CG2 3.3Å; I17-T21 WeakPolarHBondContact O-CG2 3.41Å; I17-T21 PolarHBondContact O-N 3.21Å; I17-T21 PolarHBondContact O-OG1 3.14Å; I17-F38 HydrophobicContact CG1-CE1 4.32Å; I17-L41 HydrophobicContact CD1-CD1 4.13Å; I17-L41 HydrophobicContact CD1-CD2 4.21Å; I17-L41 HydrophobicContact CG1-CD1 3.76Å; I17-L41 HydrophobicContact CG1-CD2 4.49Å
18	N	86.7	Confident	82.1	Confident	92 Å²	92	87.9 Å²	87.9	49%	0.492	46%	0.459	S	S	.	.	H	α-helix	trans	-63.6	-43.3	-179.1	-73.2	-36.8	0	0	0	112.3	V14 K15 N20 T21 A22	V14-N18 WeakPolarHBondContact CG1-ND2 3.44Å; V14-N18 WeakPolarHBondContact O-CB 3.49Å; V14-N18 VanDerWaalsContact O-CG 3.23Å; V14-N18 PolarHBondContact O-N 3.36Å; V14-N18 PolarHBondContact O-ND2 3.04Å; K15-N18 PolarHBondContact O-N 3.16Å; N18-N20 PolarHBondContact O-N 2.84Å; N18-T21 PolarHBondContact O-N 2.73Å; N18-T21 PolarHBondContact O-OG1 3Å; N18-A22 WeakPolarHBondContact O-CB 3.4Å; N18-A22 PolarHBondContact O-N 2.99Å
19	D	84.6	Confident	81.7	Confident	124 Å²	124	84.3 Å²	84.3	66%	0.663	46%	0.455	S	S	*	.	H	α-helix	trans	-64.9	-39	-179.1	-67.5	-30.3	0	0	0	111.5	K15	K15-D19 WeakPolarHBondContact O-CB 3.24Å; K15-D19 VanDerWaalsContact O-CG 3.28Å; K15-D19 PolarHBondContact O-N 2.71Å
20	N	80.2	Confident	81.3	Confident	27 Å²	27	89.7 Å²	89.7	14%	0.144	48%	0.48	C	S	.	.	H	α-helix	trans	-74.7	-36.3	174.4	-82.7	-80.4	0	0	0	113.3	I16 I17 N18 F27 E37 F38	I16-N20 WeakPolarHBondContact O-CB 3.46Å; I16-N20 PolarHBondContact O-N 2.89Å; I16-N20 VanDerWaalsContact O-N 3.16Å; I16-N20 PolarHBondContact O-ND2 2.89Å; I17-N20 PolarHBondContact O-N 2.9Å; N18-N20 PolarHBondContact O-N 2.84Å; N20-F27 WeakPolarHBondContact O-CE2 3.4Å; N20-E37 PolarHBondContact ND2-OE2 2.89Å; N20-F38 HydrophobicContact CB-CE2 4.2Å; N20-F38 HydrophobicContact CB-CZ 3.74Å
21	T	80.8	Confident	80.9	Confident	67 Å²	67	90.9 Å²	90.9	41%	0.411	48%	0.484	S	S	.	.	H	α-helix	trans	-83.8	-12.7	-177.7	54.6	0	0	0	0	114.3	I17 N18 Q23	I17-T21 HydrophobicContact CG2-CG2 4.3Å; I17-T21 WeakPolarHBondContact O-CB 3.38Å; I17-T21 VanDerWaalsContact O-CG2 3.3Å; I17-T21 WeakPolarHBondContact O-CG2 3.41Å; I17-T21 PolarHBondContact O-N 3.21Å; I17-T21 PolarHBondContact O-OG1 3.14Å; N18-T21 PolarHBondContact O-N 2.73Å; N18-T21 PolarHBondContact O-OG1 3Å; T21-Q23 PolarHBondContact O-N 3.08Å; T21-Q23 VanDerWaalsContact O-N 3.11Å
22	A	82.8	Confident	80.4	Confident	75 Å²	75	92.5 Å²	92.5	62%	0.62	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-16.5	178.2	0	0	0	0	0	114.6	N18	N18-A22 WeakPolarHBondContact O-CB 3.4Å; N18-A22 PolarHBondContact O-N 2.99Å
23	Q	76.6	Confident	80.1	Confident	121 Å²	121	90.6 Å²	90.6	57%	0.565	50%	0.495	S	S	*	.			trans	-126.1	79.8	177.5	-69.4	-169.8	-12.3	0	0	111.4	T21 E25 N26	T21-Q23 PolarHBondContact O-N 3.08Å; T21-Q23 VanDerWaalsContact O-N 3.11Å; Q23-E25 PolarHBondContact O-N 3.15Å; Q23-E25 VanDerWaalsContact O-N 3.11Å; Q23-N26 VanDerWaalsContact CB-ND2 3.33Å; Q23-N26 WeakPolarHBondContact CB-ND2 3.47Å; Q23-N26 PolarHBondContact O-N 3.19Å; Q23-N26 PolarHBondContact OE1-ND2 2.78Å
24	P	74.8	Confident	79.9	Confident	93 Å²	93	91.6 Å²	91.6	60%	0.604	50%	0.502	S	S	*	.	G	3₁₀ helix	trans	-61.7	-21.7	-177.3	24.3	-34.5	0	0	0	113.8	N26 F27	P24-N26 PolarHBondContact O-N 2.94Å; P24-F27 PolarHBondContact O-N 2.65Å
25	E	77.1	Confident	79.6	Confident	158 Å²	158	90 Å²	90	74%	0.738	50%	0.497	S	S	*	.	G	3₁₀ helix	trans	-61.3	-28.4	177.3	-61.8	-177.9	-173.9	0	0	113.2	Q23 F27 L28	Q23-E25 PolarHBondContact O-N 3.15Å; Q23-E25 VanDerWaalsContact O-N 3.11Å; E25-F27 VanDerWaalsContact C-N 3.29Å; E25-F27 PolarHBondContact O-N 3.33Å; E25-L28 WeakPolarHBondContact O-CB 3.48Å; E25-L28 WeakPolarHBondContact O-CG 3.43Å; E25-L28 PolarHBondContact O-N 3.04Å
26	N	69.8	Low	79.4	Confident	79 Å²	79	88.2 Å²	88.2	42%	0.422	50%	0.5	S	S	.	.	G	3₁₀ helix	trans	-68.6	-28.6	-177.3	-65.8	-26.9	0	0	0	112.5	Q23 P24 L28 S29	Q23-N26 VanDerWaalsContact CB-ND2 3.33Å; Q23-N26 WeakPolarHBondContact CB-ND2 3.47Å; Q23-N26 PolarHBondContact O-N 3.19Å; Q23-N26 PolarHBondContact OE1-ND2 2.78Å; P24-N26 PolarHBondContact O-N 2.94Å; N26-L28 PolarHBondContact O-N 3.16Å; N26-S29 PolarHBondContact O-N 2.83Å; N26-S29 PolarHBondContact O-OG 3.12Å
27	F	74.6	Confident	79.4	Confident	101 Å²	101	89.3 Å²	89.3	44%	0.443	50%	0.504	S	S	.	.	G	3₁₀ helix	trans	-74.8	-2.3	178.5	-59.7	-85.5	0	0	0	113.8	N20 P24 E25 S29 F38	N20-F27 WeakPolarHBondContact O-CE2 3.4Å; P24-F27 PolarHBondContact O-N 2.65Å; E25-F27 VanDerWaalsContact C-N 3.29Å; E25-F27 PolarHBondContact O-N 3.33Å; F27-S29 PolarHBondContact O-N 2.93Å; F27-F38 HydrophobicContact CE1-CE2 4.1Å; F27-F38 HydrophobicContact CZ-CE2 4.28Å
28	L	76.4	Confident	79.4	Confident	156 Å²	156	89.3 Å²	89.3	82%	0.817	50%	0.502	S	S	*	.	G	3₁₀ helix	trans	-74.1	6.5	170	-59.5	175.2	0	0	0	113	E25 N26	E25-L28 WeakPolarHBondContact O-CB 3.48Å; E25-L28 WeakPolarHBondContact O-CG 3.43Å; E25-L28 PolarHBondContact O-N 3.04Å; N26-L28 PolarHBondContact O-N 3.16Å
29	S	75.3	Confident	79.5	Confident	58 Å²	58	87 Å²	87	41%	0.406	49%	0.491	S	S	.	.	S	Bend	trans	-144.6	155.2	178.6	60.3	0	0	0	0	110.2	N26 F27 Q31	N26-S29 PolarHBondContact O-N 2.83Å; N26-S29 PolarHBondContact O-OG 3.12Å; F27-S29 PolarHBondContact O-N 2.93Å; S29-Q31 PolarHBondContact O-N 2.87Å; S29-Q31 PolarHBondContact OG-NE2 3.07Å
30	L	75.4	Confident	79.6	Confident	170 Å²	170	84.2 Å²	84.2	89%	0.89	48%	0.481	S	S	*	.			trans	-68.9	125.2	171.6	-63.1	175.3	0	0	0	109
31	Q	76.6	Confident	80.1	Confident	96 Å²	96	83.4 Å²	83.4	45%	0.449	48%	0.476	S	S	.	.			trans	-132.9	93.3	-173	-69.2	-67.4	-24.2	0	0	109.9	S29 G33 P34 A35	S29-Q31 PolarHBondContact O-N 2.87Å; S29-Q31 PolarHBondContact OG-NE2 3.07Å; Q31-G33 PolarHBondContact O-N 3.13Å; Q31-P34 HydrophobicContact CB-CG 4.07Å; Q31-P34 WeakPolarHBondContact O-CD 3.47Å; Q31-A35 PolarHBondContact O-N 3.31Å
32	D	77.1	Confident	80.5	Confident	138 Å²	138	82.4 Å²	82.4	74%	0.738	47%	0.47	S	S	*	.	H	α-helix	trans	-61.6	-25.9	-174.9	-50.1	-21.6	0	0	0	113.2	A36	D32-A36 WeakPolarHBondContact O-CB 3.5Å; D32-A36 PolarHBondContact O-N 3.41Å
33	G	80.6	Confident	80.8	Confident	40 Å²	40	81.3 Å²	81.3	41%	0.412	45%	0.452	S	S	.	.	H	α-helix	trans	-65.6	-63.7	178.8	0	0	0	0	0	113	Q31 A35 A36 E37	Q31-G33 PolarHBondContact O-N 3.13Å; G33-A35 PolarHBondContact O-N 2.85Å; G33-A36 WeakPolarHBondContact O-CB 3.24Å; G33-A36 PolarHBondContact O-N 2.86Å; G33-E37 PolarHBondContact O-N 3.42Å
34	P	81.6	Confident	81.3	Confident	31 Å²	31	78.5 Å²	78.5	20%	0.201	44%	0.443	C	S	.	.	H	α-helix	trans	-52.1	-36.8	171.3	-29.4	35.5	0	0	0	113.5	Q31 E37 F38	Q31-P34 HydrophobicContact CB-CG 4.07Å; Q31-P34 WeakPolarHBondContact O-CD 3.47Å; P34-E37 PolarHBondContact O-N 2.87Å; P34-F38 HydrophobicContact CB-CD2 4.36Å; P34-F38 HydrophobicContact CB-CE2 4.21Å; P34-F38 WeakPolarHBondContact O-CD2 3.32Å; P34-F38 PolarHBondContact O-N 3.27Å
35	A	81.6	Confident	81.9	Confident	44 Å²	44	77 Å²	77	36%	0.364	43%	0.43	S	S	.	.	H	α-helix	trans	-63	-41.9	174.9	0	0	0	0	0	112.6	Q31 G33 T39	Q31-A35 PolarHBondContact O-N 3.31Å; G33-A35 PolarHBondContact O-N 2.85Å; A35-T39 WeakPolarHBondContact O-CB 3.35Å; A35-T39 WeakPolarHBondContact O-CG2 3.27Å; A35-T39 PolarHBondContact O-N 2.89Å; A35-T39 PolarHBondContact O-OG1 2.86Å
36	A	84.4	Confident	82.3	Confident	58 Å²	58	69.9 Å²	69.9	48%	0.479	40%	0.396	S	S	.	.	H	α-helix	trans	-65.3	-36.4	172.3	0	0	0	0	0	112.4	D32 G33 T39 S40	D32-A36 WeakPolarHBondContact O-CB 3.5Å; D32-A36 PolarHBondContact O-N 3.41Å; G33-A36 WeakPolarHBondContact O-CB 3.24Å; G33-A36 PolarHBondContact O-N 2.86Å; A36-T39 WeakPolarHBondContact CA-OG1 3.43Å; A36-T39 PolarHBondContact O-OG1 3.08Å; A36-T39 VanDerWaalsContact O-OG1 3.1Å; A36-S40 VanDerWaalsContact O-CB 3.32Å; A36-S40 WeakPolarHBondContact O-CB 3.43Å; A36-S40 PolarHBondContact O-N 2.98Å; A36-S40 PolarHBondContact O-OG 2.71Å
37	E	85.1	Confident	83.1	Confident	88 Å²	88	67.9 Å²	67.9	41%	0.411	39%	0.385	S	S	.	.	H	α-helix	trans	-67.3	-47.7	174.9	-69.6	-173.6	-167.2	0	0	111.7	N20 G33 P34 S40 L41	N20-E37 PolarHBondContact ND2-OE2 2.89Å; G33-E37 PolarHBondContact O-N 3.42Å; P34-E37 PolarHBondContact O-N 2.87Å; E37-S40 PolarHBondContact O-N 2.62Å; E37-S40 PolarHBondContact O-OG 3.17Å; E37-L41 WeakPolarHBondContact O-CB 3.48Å; E37-L41 PolarHBondContact O-N 3.46Å
38	F	86.5	Confident	83.5	Confident	60 Å²	60	64.6 Å²	64.6	26%	0.263	37%	0.372	S	S	.	.	H	α-helix	trans	-66.9	-36	179	-73.1	-58.7	0	0	0	113.5	I17 N20 F27 P34 L41 T42	I17-F38 HydrophobicContact CG1-CE1 4.32Å; N20-F38 HydrophobicContact CB-CE2 4.2Å; N20-F38 HydrophobicContact CB-CZ 3.74Å; F27-F38 HydrophobicContact CE1-CE2 4.1Å; F27-F38 HydrophobicContact CZ-CE2 4.28Å; P34-F38 HydrophobicContact CB-CD2 4.36Å; P34-F38 HydrophobicContact CB-CE2 4.21Å; P34-F38 WeakPolarHBondContact O-CD2 3.32Å; P34-F38 PolarHBondContact O-N 3.27Å; F38-L41 PolarHBondContact O-N 3.44Å; F38-T42 WeakPolarHBondContact O-CB 3.26Å; F38-T42 PolarHBondContact O-N 2.85Å; F38-T42 PolarHBondContact O-OG1 2.77Å
39	T	87.6	Confident	83.7	Confident	43 Å²	43	60.9 Å²	60.9	26%	0.264	35%	0.35	S	S	.	.	H	α-helix	trans	-68	-39.2	172.8	47.7	0	0	0	0	111.6	A35 A36 T42 K43	A35-T39 WeakPolarHBondContact O-CB 3.35Å; A35-T39 WeakPolarHBondContact O-CG2 3.27Å; A35-T39 PolarHBondContact O-N 2.89Å; A35-T39 PolarHBondContact O-OG1 2.86Å; A36-T39 WeakPolarHBondContact CA-OG1 3.43Å; A36-T39 PolarHBondContact O-OG1 3.08Å; A36-T39 VanDerWaalsContact O-OG1 3.1Å; T39-T42 PolarHBondContact O-N 2.81Å; T39-K43 PolarHBondContact O-N 2.94Å
40	S	87.5	Confident	84	Confident	65 Å²	65	59.9 Å²	59.9	46%	0.455	34%	0.339	S	S	.	.	H	α-helix	trans	-64.3	-39.1	173.1	82.4	0	0	0	0	112.5	A36 E37 K43 T44	A36-S40 VanDerWaalsContact O-CB 3.32Å; A36-S40 WeakPolarHBondContact O-CB 3.43Å; A36-S40 PolarHBondContact O-N 2.98Å; A36-S40 PolarHBondContact O-OG 2.71Å; E37-S40 PolarHBondContact O-N 2.62Å; E37-S40 PolarHBondContact O-OG 3.17Å; S40-K43 WeakPolarHBondContact O-CB 3.4Å; S40-K43 PolarHBondContact O-N 2.97Å; S40-T44 PolarHBondContact O-N 3.11Å
41	L	89.5	Confident	84	Confident	10 Å²	10	56 Å²	56	5%	0.052	33%	0.326	C	S	.	.	H	α-helix	trans	-68.8	-41.6	177.1	-176.1	151.3	0	0	0	111.5	C13 I16 I17 E37 F38 K43 T44 L45	C13-L41 HydrophobicContact CB-CD1 3.99Å; C13-L41 HydrophobicContact CB-CG 4.18Å; C13-L41 WeakPolarHBondContact O-CD1 3.14Å; I16-L41 HydrophobicContact CB-CD1 3.99Å; I16-L41 HydrophobicContact CG2-CD1 3.86Å; I17-L41 HydrophobicContact CD1-CD1 4.13Å; I17-L41 HydrophobicContact CD1-CD2 4.21Å; I17-L41 HydrophobicContact CG1-CD1 3.76Å; I17-L41 HydrophobicContact CG1-CD2 4.49Å; E37-L41 WeakPolarHBondContact O-CB 3.48Å; E37-L41 PolarHBondContact O-N 3.46Å; F38-L41 PolarHBondContact O-N 3.44Å; L41-K43 VanDerWaalsContact C-N 3.27Å; L41-K43 PolarHBondContact O-N 3.11Å; L41-T44 WeakPolarHBondContact CA-OG1 3.42Å; L41-T44 PolarHBondContact O-N 2.95Å; L41-T44 PolarHBondContact O-OG1 3.35Å; L41-L45 HydrophobicContact CD2-CD1 3.6Å; L41-L45 HydrophobicContact CD2-CG 4.06Å; L41-L45 WeakPolarHBondContact O-CG 3.5Å; L41-L45 PolarHBondContact O-N 3.44Å
42	T	89.2	Confident	83.9	Confident	46 Å²	46	55 Å²	55	28%	0.282	33%	0.326	S	S	.	.	H	α-helix	trans	-59.1	-41.8	174.6	-58.3	0	0	0	0	110.5	F38 T39 L45 Y46 L65 L79	F38-T42 WeakPolarHBondContact O-CB 3.26Å; F38-T42 PolarHBondContact O-N 2.85Å; F38-T42 PolarHBondContact O-OG1 2.77Å; T39-T42 PolarHBondContact O-N 2.81Å; T42-L45 PolarHBondContact O-N 3.48Å; T42-Y46 WeakPolarHBondContact O-CB 3.13Å; T42-Y46 PolarHBondContact O-N 3.16Å; T42-L65 HydrophobicContact CG2-CD2 3.97Å; T42-L79 HydrophobicContact CG2-CD1 3.75Å; T42-L79 HydrophobicContact CG2-CD2 4.17Å
43	K	89.6	Confident	83.7	Confident	53 Å²	53	50.7 Å²	50.7	23%	0.23	30%	0.302	C	S	.	.	H	α-helix	trans	-62.5	-46.5	172.4	175.9	161.8	-177.8	150	0	112.9	T39 S40 L41 L45 Y46 D47 L65 V67	T39-K43 PolarHBondContact O-N 2.94Å; S40-K43 WeakPolarHBondContact O-CB 3.4Å; S40-K43 PolarHBondContact O-N 2.97Å; L41-K43 VanDerWaalsContact C-N 3.27Å; L41-K43 PolarHBondContact O-N 3.11Å; K43-L45 VanDerWaalsContact C-N 3.33Å; K43-L45 PolarHBondContact O-N 3.45Å; K43-Y46 PolarHBondContact O-N 2.81Å; K43-D47 WeakPolarHBondContact O-CB 3.13Å; K43-D47 VanDerWaalsContact O-CG 3.28Å; K43-D47 PolarHBondContact O-N 3.12Å; K43-L65 HydrophobicContact CB-CB 4.22Å; K43-L65 HydrophobicContact CB-CD2 4.09Å; K43-L65 WeakPolarHBondContact CD-O 3.37Å; K43-L65 VanDerWaalsContact CE-O 3.25Å; K43-L65 WeakPolarHBondContact CE-O 3.33Å; K43-L65 HydrophobicContact CG-CB 4.11Å; K43-L65 PolarHBondContact NZ-O 3.01Å; K43-V67 HydrophobicContact CB-CG2 4.12Å; K43-V67 HydrophobicContact CD-CG2 4.04Å
44	T	87.8	Confident	83	Confident	62 Å²	62	52 Å²	52	38%	0.38	30%	0.302	S	S	.	.	H	α-helix	trans	-65.8	-34.3	179.1	57.8	0	0	0	0	112.9	S40 L41 L48	S40-T44 PolarHBondContact O-N 3.11Å; L41-T44 WeakPolarHBondContact CA-OG1 3.42Å; L41-T44 PolarHBondContact O-N 2.95Å; L41-T44 PolarHBondContact O-OG1 3.35Å; T44-L48 WeakPolarHBondContact O-CB 3.44Å; T44-L48 PolarHBondContact O-N 3.28Å
45	L	86.7	Confident	82	Confident	62 Å²	62	55.8 Å²	55.8	33%	0.325	34%	0.337	S	S	.	.	H	α-helix	trans	-69.3	-43.3	174	-69.7	-176.8	0	0	0	112.4	L10 C13 L41 T42 K43 L48 Q49	L10-L45 HydrophobicContact CD2-CD2 3.74Å; C13-L45 HydrophobicContact CB-CD2 4.3Å; L41-L45 HydrophobicContact CD2-CD1 3.6Å; L41-L45 HydrophobicContact CD2-CG 4.06Å; L41-L45 WeakPolarHBondContact O-CG 3.5Å; L41-L45 PolarHBondContact O-N 3.44Å; T42-L45 PolarHBondContact O-N 3.48Å; K43-L45 VanDerWaalsContact C-N 3.33Å; K43-L45 PolarHBondContact O-N 3.45Å; L45-L48 PolarHBondContact O-N 3.25Å; L45-Q49 WeakPolarHBondContact O-CB 3.3Å; L45-Q49 PolarHBondContact O-N 3.47Å
46	Y	86.3	Confident	81	Confident	7 Å²	7	57.2 Å²	57.2	3%	0.027	36%	0.355	C	S	.	.	H	α-helix	trans	-62.6	-50.3	176.1	179.6	-84.6	0	0	0	111.6	T42 K43 L48 Q49 K50 S60 L62 L65 L79 Q82	T42-Y46 WeakPolarHBondContact O-CB 3.13Å; T42-Y46 PolarHBondContact O-N 3.16Å; K43-Y46 PolarHBondContact O-N 2.81Å; Y46-L48 VanDerWaalsContact C-N 3.28Å; Y46-L48 PolarHBondContact O-N 3.48Å; Y46-Q49 PolarHBondContact O-N 3.26Å; Y46-K50 VanDerWaalsContact O-CB 3.31Å; Y46-K50 WeakPolarHBondContact O-CB 3.17Å; Y46-K50 PolarHBondContact O-N 3.04Å; Y46-S60 PolarHBondContact OH-OG 2.99Å; Y46-L62 PolarHBondContact OH-O 3.02Å; Y46-L65 HydrophobicContact CD1-CB 3.62Å; Y46-L65 HydrophobicContact CD1-CD1 4.27Å; Y46-L65 HydrophobicContact CD2-CD1 3.96Å; Y46-L65 HydrophobicContact CE1-CB 4.18Å; Y46-L65 HydrophobicContact CE1-CD1 4.45Å; Y46-L65 HydrophobicContact CE2-CD1 4.13Å; Y46-L65 HydrophobicContact CG-CB 3.9Å; Y46-L65 HydrophobicContact CG-CD1 4.01Å; Y46-L65 HydrophobicContact CG-CG 4.41Å; Y46-L79 HydrophobicContact CD2-CD2 3.62Å; Y46-L79 HydrophobicContact CE2-CD2 4.33Å; Y46-L79 HydrophobicContact CG-CD2 4.39Å; Y46-Q82 HydrophobicContact CE2-CB 3.99Å; Y46-Q82 HydrophobicContact CE2-CG 4.41Å
47	D	85.7	Confident	80.1	Confident	37 Å²	37	55 Å²	55	20%	0.198	34%	0.337	C	S	.	.	H	α-helix	trans	-61.8	-37.6	179.2	-71.1	5.5	0	0	0	111	K43 S51 Q64 L65	K43-D47 WeakPolarHBondContact O-CB 3.13Å; K43-D47 VanDerWaalsContact O-CG 3.28Å; K43-D47 PolarHBondContact O-N 3.12Å; D47-S51 PolarHBondContact O-N 3.09Å; D47-Q64 WeakPolarHBondContact OD1-CA 3.39Å; D47-Q64 WeakPolarHBondContact OD1-CB 3.47Å; D47-L65 PolarHBondContact OD1-N 3.05Å
48	L	83.7	Confident	79.1	Confident	32 Å²	32	59.8 Å²	59.8	17%	0.168	36%	0.356	C	S	.	.	H	α-helix	trans	-65.9	-49.1	174.6	-176.8	64.4	0	0	0	111.6	M6 V9 L10 T44 L45 Y46 K50 S51 V52	M6-L48 HydrophobicContact CB-CD1 4.43Å; M6-L48 HydrophobicContact CG-CD1 4.11Å; M6-L48 HydrophobicContact CG-CD2 4.16Å; M6-L48 HydrophobicContact CG-CG 4.4Å; V9-L48 HydrophobicContact CB-CD2 4.31Å; V9-L48 HydrophobicContact CG1-CD2 3.99Å; L10-L48 HydrophobicContact CD2-CD2 3.96Å; L10-L48 HydrophobicContact CG-CD2 3.96Å; T44-L48 WeakPolarHBondContact O-CB 3.44Å; T44-L48 PolarHBondContact O-N 3.28Å; L45-L48 PolarHBondContact O-N 3.25Å; Y46-L48 VanDerWaalsContact C-N 3.28Å; Y46-L48 PolarHBondContact O-N 3.48Å; L48-K50 VanDerWaalsContact C-N 3.29Å; L48-K50 PolarHBondContact O-N 3.37Å; L48-S51 PolarHBondContact O-N 3.16Å; L48-S51 VanDerWaalsContact O-N 3.12Å; L48-S51 PolarHBondContact O-OG 3.41Å; L48-V52 WeakPolarHBondContact O-CG2 3.3Å; L48-V52 PolarHBondContact O-N 2.93Å
49	Q	80.6	Confident	78.3	Confident	78 Å²	78	57.7 Å²	57.7	36%	0.364	35%	0.351	S	S	.	.	H	α-helix	trans	-59.7	-41	176.5	179.9	63.8	6.1	0	0	111.1	L45 Y46 S51 V52 E53	L45-Q49 WeakPolarHBondContact O-CB 3.3Å; L45-Q49 PolarHBondContact O-N 3.47Å; Y46-Q49 PolarHBondContact O-N 3.26Å; Q49-S51 VanDerWaalsContact C-N 3.29Å; Q49-S51 PolarHBondContact O-N 3.33Å; Q49-V52 CarbonylContact O-C 3.59Å; Q49-V52 PolarHBondContact O-N 2.91Å; Q49-E53 PolarHBondContact O-N 3.37Å
50	K	80.3	Confident	77.6	Confident	38 Å²	38	55.9 Å²	55.9	17%	0.165	34%	0.34	C	S	.	.	H	α-helix	trans	-63.9	-33	176.6	-166.3	48.7	157.3	-179.5	0	112.6	Y46 L48 V52 E53 S60 L62 P63	Y46-K50 VanDerWaalsContact O-CB 3.31Å; Y46-K50 WeakPolarHBondContact O-CB 3.17Å; Y46-K50 PolarHBondContact O-N 3.04Å; L48-K50 VanDerWaalsContact C-N 3.29Å; L48-K50 PolarHBondContact O-N 3.37Å; K50-V52 PolarHBondContact O-N 2.84Å; K50-E53 VanDerWaalsContact CD-CD 3.42Å; K50-E53 HydrophobicContact CD-CG 4.15Å; K50-E53 VanDerWaalsContact CD-OE1 3.22Å; K50-E53 WeakPolarHBondContact CD-OE1 3.21Å; K50-E53 IonicContact NZ-OE1 2.68Å; K50-E53 PolarHBondContact NZ-OE1 3.21Å; K50-E53 IonicContact NZ-OE2 3.6Å; K50-E53 PolarHBondContact NZ-OE2 3.38Å; K50-S60 PolarHBondContact NZ-O 2.98Å; K50-L62 WeakPolarHBondContact CE-O 3.17Å; K50-P63 WeakPolarHBondContact CG-O 3.49Å
51	S	76.8	Confident	76.9	Confident	88 Å²	88	58.5 Å²	58.5	62%	0.615	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-10	173.8	79.4	0	0	0	0	114.8	D47 L48 Q49	D47-S51 PolarHBondContact O-N 3.09Å; L48-S51 PolarHBondContact O-N 3.16Å; L48-S51 VanDerWaalsContact O-N 3.12Å; L48-S51 PolarHBondContact O-OG 3.41Å; Q49-S51 VanDerWaalsContact C-N 3.29Å; Q49-S51 PolarHBondContact O-N 3.33Å
52	V	74.8	Confident	76.4	Confident	74 Å²	74	60.5 Å²	60.5	45%	0.448	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.4	8.2	-175.2	-179.1	0	0	0	0	111.9	M6 L48 Q49 K50	M6-V52 HydrophobicContact SD-CG2 4.14Å; L48-V52 WeakPolarHBondContact O-CG2 3.3Å; L48-V52 PolarHBondContact O-N 2.93Å; Q49-V52 CarbonylContact O-C 3.59Å; Q49-V52 PolarHBondContact O-N 2.91Å; K50-V52 PolarHBondContact O-N 2.84Å
53	E	72.5	Confident	75.7	Confident	49 Å²	49	63.2 Å²	63.2	23%	0.229	39%	0.385	C	S	.	.			trans	-54.4	125.2	-179.2	-82.6	-171.9	174.4	0	0	112.4	Q49 K50 G59 Q82	Q49-E53 PolarHBondContact O-N 3.37Å; K50-E53 VanDerWaalsContact CD-CD 3.42Å; K50-E53 HydrophobicContact CD-CG 4.15Å; K50-E53 VanDerWaalsContact CD-OE1 3.22Å; K50-E53 WeakPolarHBondContact CD-OE1 3.21Å; K50-E53 IonicContact NZ-OE1 2.68Å; K50-E53 PolarHBondContact NZ-OE1 3.21Å; K50-E53 IonicContact NZ-OE2 3.6Å; K50-E53 PolarHBondContact NZ-OE2 3.38Å; E53-G59 WeakPolarHBondContact OE1-CA 3.38Å; E53-G59 PolarHBondContact OE1-N 2.83Å; E53-G59 PolarHBondContact OE2-N 3.02Å; E53-Q82 PolarHBondContact OE1-NE2 3.33Å; E53-Q82 VanDerWaalsContact OE1-NE2 3.15Å
54	P	65.6	Low	75.3	Confident	66 Å²	66	66.2 Å²	66.2	43%	0.429	40%	0.4	S	S	.	.			trans	-71.6	148	-179.4	30.2	-34.3	0	0	0	110.6	G56 C57	P54-G56 PolarHBondContact O-N 3.42Å; P54-C57 HydrophobicContact CG-CB 3.93Å; P54-C57 PolarHBondContact O-N 3.11Å
55	A	59.8	Low	75.2	Confident	112 Å²	112	63.2 Å²	63.2	93%	0.926	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-17.6	-168.2	0	0	0	0	0	116.1
56	G	61.6	Low	75.1	Confident	73 Å²	73	62.7 Å²	62.7	75%	0.753	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	-16.7	173.7	0	0	0	0	0	115.5	P54	P54-G56 PolarHBondContact O-N 3.42Å
57	C	64.5	Low	75	Confident	13 Å²	13	63.9 Å²	63.9	9%	0.088	39%	0.388	C	S	.	.			trans	-117.5	99.6	-176.8	-165.3	0	0	0	0	111.3	P54 H89	P54-C57 HydrophobicContact CG-CB 3.93Å; P54-C57 PolarHBondContact O-N 3.11Å; C57-H89 HydrophobicContact CB-CB 4.14Å
58	K	64.7	Low	74.8	Confident	187 Å²	187	67.8 Å²	67.8	81%	0.813	41%	0.409	S	S	*	.			trans	-87	114.7	163	-65	178.7	-176.2	175.3	0	107.4
59	G	69.1	Low	74.6	Confident	16 Å²	16	74 Å²	74	17%	0.165	44%	0.443	C	S	.	.			trans	-77	-133.3	177.2	0	0	0	0	0	112.3	E53	E53-G59 WeakPolarHBondContact OE1-CA 3.38Å; E53-G59 PolarHBondContact OE1-N 2.83Å; E53-G59 PolarHBondContact OE2-N 3.02Å
60	S	72.6	Confident	74.6	Confident	5 Å²	5	74.1 Å²	74.1	4%	0.035	44%	0.442	C	S	.	.			trans	-54.5	153.3	172.2	51.8	0	0	0	0	112.9	Y46 K50 L62	Y46-S60 PolarHBondContact OH-OG 2.99Å; K50-S60 PolarHBondContact NZ-O 2.98Å; S60-L62 PolarHBondContact O-N 3.32Å
61	P	74.4	Confident	74.8	Confident	121 Å²	121	77.5 Å²	77.5	79%	0.786	46%	0.462	S	S	*	.	S	Bend	trans	-75.9	-9.9	174.5	31.9	-35.9	0	0	0	113.4
62	L	77.4	Confident	75.1	Confident	52 Å²	52	80.1 Å²	80.1	27%	0.272	47%	0.465	S	S	.	.			trans	-81.3	127.5	-177.7	-64.1	172.8	0	0	0	110.9	Y46 K50 S60 E78	Y46-L62 PolarHBondContact OH-O 3.02Å; K50-L62 WeakPolarHBondContact CE-O 3.17Å; S60-L62 PolarHBondContact O-N 3.32Å; L62-E78 HydrophobicContact CD1-CB 4.06Å; L62-E78 HydrophobicContact CD1-CG 3.71Å; L62-E78 WeakPolarHBondContact CD1-OE1 3.43Å
63	P	75.8	Confident	75.6	Confident	103 Å²	103	83.3 Å²	83.3	67%	0.669	48%	0.475	S	S	*	.	S	Bend	trans	-79.3	-20	-176.6	32.1	-36.1	0	0	0	114.1	K50	K50-P63 WeakPolarHBondContact CG-O 3.49Å
64	Q	81.8	Confident	76.3	Confident	115 Å²	115	84.4 Å²	84.4	54%	0.537	48%	0.48	S	S	.	.	S	Bend	trans	-150.7	159.1	179	-69.6	-175.3	-31.7	0	0	109	D47	D47-Q64 WeakPolarHBondContact OD1-CA 3.39Å; D47-Q64 WeakPolarHBondContact OD1-CB 3.47Å
65	L	85.3	Confident	77.4	Confident	0 Å²	0	82 Å²	82	0%	0	46%	0.463	C	S	.	.			trans	-76.9	134.3	177.7	-163.2	70.5	0	0	0	111.4	T42 K43 Y46 D47 V67 I75 E78 L79	T42-L65 HydrophobicContact CG2-CD2 3.97Å; K43-L65 HydrophobicContact CB-CB 4.22Å; K43-L65 HydrophobicContact CB-CD2 4.09Å; K43-L65 WeakPolarHBondContact CD-O 3.37Å; K43-L65 VanDerWaalsContact CE-O 3.25Å; K43-L65 WeakPolarHBondContact CE-O 3.33Å; K43-L65 HydrophobicContact CG-CB 4.11Å; K43-L65 PolarHBondContact NZ-O 3.01Å; Y46-L65 HydrophobicContact CD1-CB 3.62Å; Y46-L65 HydrophobicContact CD1-CD1 4.27Å; Y46-L65 HydrophobicContact CD2-CD1 3.96Å; Y46-L65 HydrophobicContact CE1-CB 4.18Å; Y46-L65 HydrophobicContact CE1-CD1 4.45Å; Y46-L65 HydrophobicContact CE2-CD1 4.13Å; Y46-L65 HydrophobicContact CG-CB 3.9Å; Y46-L65 HydrophobicContact CG-CD1 4.01Å; Y46-L65 HydrophobicContact CG-CG 4.41Å; D47-L65 PolarHBondContact OD1-N 3.05Å; L65-V67 HydrophobicContact CD2-CG2 4.16Å; L65-V67 HydrophobicContact CG-CG2 4.33Å; L65-I75 HydrophobicContact CD2-CG2 3.99Å; L65-I75 HydrophobicContact CG-CG2 4.44Å; L65-E78 HydrophobicContact CD1-CB 3.83Å; L65-E78 WeakPolarHBondContact CD1-OE2 3.43Å; L65-L79 HydrophobicContact CD1-CD2 3.89Å; L65-L79 HydrophobicContact CD1-CG 4.37Å; L65-L79 HydrophobicContact CD2-CD2 4.32Å
66	V	85	Confident	78.8	Confident	51 Å²	51	85 Å²	85	31%	0.309	45%	0.45	S	S	.	.			trans	-97.4	111.2	178.5	-172	0	0	0	0	110	F70 E78	V66-F70 HydrophobicContact CB-CE1 4.37Å; V66-F70 HydrophobicContact CB-CE2 4.38Å; V66-F70 HydrophobicContact CB-CZ 4.27Å; V66-F70 HydrophobicContact CG1-CD2 3.81Å; V66-F70 HydrophobicContact CG1-CE1 4.45Å; V66-F70 HydrophobicContact CG1-CE2 3.6Å; V66-F70 HydrophobicContact CG1-CG 4.35Å; V66-F70 HydrophobicContact CG1-CZ 3.96Å; V66-E78 PolarHBondContact N-OE2 3.13Å
67	V	83.3	Confident	80	Confident	31 Å²	31	86 Å²	86	19%	0.188	44%	0.436	C	S	.	.			trans	-111	-17.9	179.5	179.4	0	0	0	0	111.2	K43 L65 N69 I75	K43-V67 HydrophobicContact CB-CG2 4.12Å; K43-V67 HydrophobicContact CD-CG2 4.04Å; L65-V67 HydrophobicContact CD2-CG2 4.16Å; L65-V67 HydrophobicContact CG-CG2 4.33Å; V67-N69 PolarHBondContact O-N 3.41Å; V67-N69 VanDerWaalsContact O-N 3.08Å; V67-I75 HydrophobicContact CB-CD1 4.47Å; V67-I75 HydrophobicContact CG1-CD1 4.15Å; V67-I75 HydrophobicContact CG2-CD1 4.31Å
68	D	81.2	Confident	80.9	Confident	119 Å²	119	86.3 Å²	86.3	64%	0.636	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	101.7	-173.8	-59.4	-45.3	0	0	0	111.2
69	N	79.8	Confident	81.9	Confident	162 Å²	162	78.5 Å²	78.5	87%	0.866	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.9	28.9	-176.7	-37	-93.6	0	0	0	114.9	V67	V67-N69 PolarHBondContact O-N 3.41Å; V67-N69 VanDerWaalsContact O-N 3.08Å
70	F	81.3	Confident	82.8	Confident	81 Å²	81	83.2 Å²	83.2	36%	0.355	42%	0.42	S	S	.	.			trans	-104.4	140.3	172.3	-86.9	-132.8	0	0	0	110.4	V66 Q74 I75 E78	V66-F70 HydrophobicContact CB-CE1 4.37Å; V66-F70 HydrophobicContact CB-CE2 4.38Å; V66-F70 HydrophobicContact CB-CZ 4.27Å; V66-F70 HydrophobicContact CG1-CD2 3.81Å; V66-F70 HydrophobicContact CG1-CE1 4.45Å; V66-F70 HydrophobicContact CG1-CE2 3.6Å; V66-F70 HydrophobicContact CG1-CG 4.35Å; V66-F70 HydrophobicContact CG1-CZ 3.96Å; F70-Q74 HydrophobicContact CB-CB 4.38Å; F70-Q74 HydrophobicContact CD1-CB 3.77Å; F70-Q74 HydrophobicContact CG-CB 4.42Å; F70-I75 HydrophobicContact CB-CD1 4.45Å; F70-I75 HydrophobicContact CB-CG1 3.94Å; F70-E78 WeakPolarHBondContact CE1-OE1 3.45Å
71	D	84	Confident	83.3	Confident	109 Å²	109	87.6 Å²	87.6	58%	0.583	44%	0.443	S	S	*	.			trans	-75	155.6	173.6	-63.1	-48.5	0	0	0	110.7	E73 Q74 I75	D71-E73 VanDerWaalsContact C-N 3.27Å; D71-E73 PolarHBondContact O-N 2.87Å; D71-E73 VanDerWaalsContact O-N 3.17Å; D71-Q74 HydrophobicContact CB-CG 4.28Å; D71-Q74 WeakPolarHBondContact O-CA 3.33Å; D71-Q74 WeakPolarHBondContact O-CB 3.49Å; D71-Q74 PolarHBondContact O-N 2.87Å; D71-Q74 PolarHBondContact OD2-NE2 2.81Å; D71-I75 PolarHBondContact O-N 3.29Å; D71-I75 VanDerWaalsContact O-N 3.13Å
72	E	82.3	Confident	83.7	Confident	144 Å²	144	82.1 Å²	82.1	67%	0.673	41%	0.407	S	S	*	.	H	α-helix	trans	-53.6	-41.4	-176.1	-63.6	-179.5	-178.5	0	0	113	Q74 I75 W76	E72-Q74 VanDerWaalsContact C-N 3.31Å; E72-Q74 PolarHBondContact O-N 3.36Å; E72-I75 PolarHBondContact O-N 3.18Å; E72-W76 PolarHBondContact O-N 3.41Å
73	E	86.6	Confident	84	Confident	141 Å²	141	83.5 Å²	83.5	66%	0.659	41%	0.414	S	S	*	.	H	α-helix	trans	-63.1	-35.1	177.1	-165.1	-172.2	150.4	0	0	112.5	D71 W76 Q77	D71-E73 VanDerWaalsContact C-N 3.27Å; D71-E73 PolarHBondContact O-N 2.87Å; D71-E73 VanDerWaalsContact O-N 3.17Å; E73-W76 PolarHBondContact O-N 3.36Å; E73-Q77 VanDerWaalsContact O-CG 3.32Å; E73-Q77 WeakPolarHBondContact O-CG 3.33Å; E73-Q77 PolarHBondContact O-N 3.41Å; E73-Q77 PolarHBondContact OE1-NE2 2.94Å
74	Q	86.9	Confident	84.3	Confident	72 Å²	72	82.6 Å²	82.6	34%	0.336	40%	0.404	S	S	.	.	H	α-helix	trans	-71.1	-39.6	178.8	-61.3	166.2	-3	0	0	110.6	F70 D71 E72 W76 Q77 E78	F70-Q74 HydrophobicContact CB-CB 4.38Å; F70-Q74 HydrophobicContact CD1-CB 3.77Å; F70-Q74 HydrophobicContact CG-CB 4.42Å; D71-Q74 HydrophobicContact CB-CG 4.28Å; D71-Q74 WeakPolarHBondContact O-CA 3.33Å; D71-Q74 WeakPolarHBondContact O-CB 3.49Å; D71-Q74 PolarHBondContact O-N 2.87Å; D71-Q74 PolarHBondContact OD2-NE2 2.81Å; E72-Q74 VanDerWaalsContact C-N 3.31Å; E72-Q74 PolarHBondContact O-N 3.36Å; Q74-W76 VanDerWaalsContact C-N 3.33Å; Q74-Q77 PolarHBondContact O-N 2.81Å; Q74-E78 PolarHBondContact O-N 3.36Å; Q74-E78 VanDerWaalsContact O-N 3.07Å
75	I	87.9	Confident	84.1	Confident	14 Å²	14	78.8 Å²	78.8	7%	0.072	39%	0.392	C	S	.	.	H	α-helix	trans	-62.2	-42.6	173.4	-59.6	172.6	0	0	0	110	L65 V67 F70 D71 E72 Q77 E78 L79	L65-I75 HydrophobicContact CD2-CG2 3.99Å; L65-I75 HydrophobicContact CG-CG2 4.44Å; V67-I75 HydrophobicContact CB-CD1 4.47Å; V67-I75 HydrophobicContact CG1-CD1 4.15Å; V67-I75 HydrophobicContact CG2-CD1 4.31Å; F70-I75 HydrophobicContact CB-CD1 4.45Å; F70-I75 HydrophobicContact CB-CG1 3.94Å; D71-I75 PolarHBondContact O-N 3.29Å; D71-I75 VanDerWaalsContact O-N 3.13Å; E72-I75 PolarHBondContact O-N 3.18Å; I75-Q77 VanDerWaalsContact C-N 3.33Å; I75-Q77 PolarHBondContact O-N 2.95Å; I75-E78 PolarHBondContact O-N 3.11Å; I75-L79 WeakPolarHBondContact O-CG 3.49Å; I75-L79 PolarHBondContact O-N 3.18Å; I75-L79 VanDerWaalsContact O-N 3.15Å
76	W	88.9	Confident	83.8	Confident	175 Å²	175	79.5 Å²	79.5	66%	0.663	40%	0.396	S	S	*	.	H	α-helix	trans	-61.1	-37.9	173.9	-84	110.2	0	0	0	113.3	E72 E73 Q74 L79 E80	E72-W76 PolarHBondContact O-N 3.41Å; E73-W76 PolarHBondContact O-N 3.36Å; Q74-W76 VanDerWaalsContact C-N 3.33Å; W76-L79 HydrophobicContact CD2-CD1 4.49Å; W76-L79 HydrophobicContact CE3-CD1 4.03Å; W76-L79 HydrophobicContact CZ3-CD1 4.24Å; W76-L79 PolarHBondContact O-N 2.9Å; W76-E80 PolarHBondContact O-N 2.67Å
77	Q	86.7	Confident	83.6	Confident	96 Å²	96	82 Å²	82	45%	0.449	41%	0.406	S	S	.	.	H	α-helix	trans	-66.1	-37.6	175.2	-70.5	169.2	20.4	0	0	112.2	E73 Q74 I75 L79 E80 I81	E73-Q77 VanDerWaalsContact O-CG 3.32Å; E73-Q77 WeakPolarHBondContact O-CG 3.33Å; E73-Q77 PolarHBondContact O-N 3.41Å; E73-Q77 PolarHBondContact OE1-NE2 2.94Å; Q74-Q77 PolarHBondContact O-N 2.81Å; I75-Q77 VanDerWaalsContact C-N 3.33Å; I75-Q77 PolarHBondContact O-N 2.95Å; Q77-L79 VanDerWaalsContact C-N 3.35Å; Q77-L79 PolarHBondContact O-N 3.48Å; Q77-E80 PolarHBondContact O-N 3.38Å; Q77-I81 WeakPolarHBondContact O-CD1 3.48Å; Q77-I81 VanDerWaalsContact O-CG1 3.29Å; Q77-I81 WeakPolarHBondContact O-CG1 3.44Å; Q77-I81 PolarHBondContact O-N 3Å
78	E	84.1	Confident	83.4	Confident	19 Å²	19	87.2 Å²	87.2	9%	0.089	43%	0.426	C	S	.	.	H	α-helix	trans	-61.9	-41.5	172.6	-64.8	-159.3	157.1	0	0	112	L62 L65 V66 F70 Q74 I75	L62-E78 HydrophobicContact CD1-CB 4.06Å; L62-E78 HydrophobicContact CD1-CG 3.71Å; L62-E78 WeakPolarHBondContact CD1-OE1 3.43Å; L65-E78 HydrophobicContact CD1-CB 3.83Å; L65-E78 WeakPolarHBondContact CD1-OE2 3.43Å; V66-E78 PolarHBondContact N-OE2 3.13Å; F70-E78 WeakPolarHBondContact CE1-OE1 3.45Å; Q74-E78 PolarHBondContact O-N 3.36Å; Q74-E78 VanDerWaalsContact O-N 3.07Å; I75-E78 PolarHBondContact O-N 3.11Å
79	L	86	Confident	83.4	Confident	22 Å²	22	84.7 Å²	84.7	12%	0.115	41%	0.41	C	S	.	.	H	α-helix	trans	-66.2	-43.8	176	-63.3	176.4	0	0	0	112.3	T42 Y46 L65 I75 W76 Q77 I81 Q82 N83	T42-L79 HydrophobicContact CG2-CD1 3.75Å; T42-L79 HydrophobicContact CG2-CD2 4.17Å; Y46-L79 HydrophobicContact CD2-CD2 3.62Å; Y46-L79 HydrophobicContact CE2-CD2 4.33Å; Y46-L79 HydrophobicContact CG-CD2 4.39Å; L65-L79 HydrophobicContact CD1-CD2 3.89Å; L65-L79 HydrophobicContact CD1-CG 4.37Å; L65-L79 HydrophobicContact CD2-CD2 4.32Å; I75-L79 WeakPolarHBondContact O-CG 3.49Å; I75-L79 PolarHBondContact O-N 3.18Å; I75-L79 VanDerWaalsContact O-N 3.15Å; W76-L79 HydrophobicContact CD2-CD1 4.49Å; W76-L79 HydrophobicContact CE3-CD1 4.03Å; W76-L79 HydrophobicContact CZ3-CD1 4.24Å; W76-L79 PolarHBondContact O-N 2.9Å; Q77-L79 VanDerWaalsContact C-N 3.35Å; Q77-L79 PolarHBondContact O-N 3.48Å; L79-I81 VanDerWaalsContact C-N 3.31Å; L79-I81 PolarHBondContact O-N 2.99Å; L79-Q82 PolarHBondContact O-N 3.28Å; L79-N83 WeakPolarHBondContact O-CB 3.4Å; L79-N83 PolarHBondContact O-N 3.27Å; L79-N83 PolarHBondContact O-ND2 3.43Å
80	E	87.7	Confident	83.4	Confident	115 Å²	115	82.1 Å²	82.1	54%	0.537	39%	0.391	S	S	.	.	H	α-helix	trans	-59.1	-42.2	179.3	179.4	173.6	-168.3	0	0	111.5	W76 Q77 Q82 N83 N84	W76-E80 PolarHBondContact O-N 2.67Å; Q77-E80 PolarHBondContact O-N 3.38Å; E80-Q82 VanDerWaalsContact C-N 3.3Å; E80-Q82 PolarHBondContact O-N 3.12Å; E80-N83 PolarHBondContact O-N 3.37Å; E80-N84 WeakPolarHBondContact CG-ND2 3.42Å; E80-N84 WeakPolarHBondContact O-CB 3.32Å; E80-N84 PolarHBondContact O-N 2.91Å; E80-N84 PolarHBondContact OE1-ND2 3.09Å
81	I	83.9	Confident	83.6	Confident	98 Å²	98	84.6 Å²	84.6	50%	0.503	40%	0.402	S	S	.	.	H	α-helix	trans	-60.9	-37.8	179.4	-68.8	164.5	0	0	0	111.6	Q77 L79	Q77-I81 WeakPolarHBondContact O-CD1 3.48Å; Q77-I81 VanDerWaalsContact O-CG1 3.29Å; Q77-I81 WeakPolarHBondContact O-CG1 3.44Å; Q77-I81 PolarHBondContact O-N 3Å; L79-I81 VanDerWaalsContact C-N 3.31Å; L79-I81 PolarHBondContact O-N 2.99Å
82	Q	81.3	Confident	83.4	Confident	6 Å²	6	84 Å²	84	3%	0.028	40%	0.399	C	S	.	.	H	α-helix	trans	-72.9	-48.7	173.7	-164.2	-174.4	31.6	0	0	111.3	Y46 E53 L79 E80 N84 A85 V86	Y46-Q82 HydrophobicContact CE2-CB 3.99Å; Y46-Q82 HydrophobicContact CE2-CG 4.41Å; E53-Q82 PolarHBondContact OE1-NE2 3.33Å; E53-Q82 VanDerWaalsContact OE1-NE2 3.15Å; L79-Q82 PolarHBondContact O-N 3.28Å; E80-Q82 VanDerWaalsContact C-N 3.3Å; E80-Q82 PolarHBondContact O-N 3.12Å; Q82-N84 PolarHBondContact O-N 3.26Å; Q82-A85 PolarHBondContact O-N 3.31Å; Q82-A85 VanDerWaalsContact O-N 3.15Å; Q82-V86 HydrophobicContact CG-CG2 4.11Å; Q82-V86 WeakPolarHBondContact O-CG2 3.41Å; Q82-V86 PolarHBondContact O-N 3.17Å
83	N	83.6	Confident	83.4	Confident	81 Å²	81	78.8 Å²	78.8	43%	0.433	38%	0.38	S	S	.	.	H	α-helix	trans	-62.3	-41.1	-174.7	-73.8	-27.6	0	0	0	112.3	L79 E80 A85 V86 M87	L79-N83 WeakPolarHBondContact O-CB 3.4Å; L79-N83 PolarHBondContact O-N 3.27Å; L79-N83 PolarHBondContact O-ND2 3.43Å; E80-N83 PolarHBondContact O-N 3.37Å; N83-A85 PolarHBondContact O-N 2.89Å; N83-V86 PolarHBondContact O-N 3Å; N83-M87 WeakPolarHBondContact O-CB 3.27Å; N83-M87 WeakPolarHBondContact O-CG 3.34Å; N83-M87 PolarHBondContact O-N 3.18Å
84	N	83.5	Confident	83.4	Confident	84 Å²	84	75.7 Å²	75.7	45%	0.449	37%	0.371	S	S	.	.	H	α-helix	trans	-66.3	-22.7	177.8	-86.3	-35.9	0	0	0	114	E80 Q82 K88	E80-N84 WeakPolarHBondContact CG-ND2 3.42Å; E80-N84 WeakPolarHBondContact O-CB 3.32Å; E80-N84 PolarHBondContact O-N 2.91Å; E80-N84 PolarHBondContact OE1-ND2 3.09Å; Q82-N84 PolarHBondContact O-N 3.26Å; N84-K88 WeakPolarHBondContact O-CD 3.32Å; N84-K88 WeakPolarHBondContact O-CE 3.43Å; N84-K88 WeakPolarHBondContact O-CG 3.5Å
85	A	78.1	Confident	83.3	Confident	34 Å²	34	76.1 Å²	76.1	28%	0.281	38%	0.375	S	S	.	.	H	α-helix	trans	-82.6	-47.7	171.2	0	0	0	0	0	111.3	Q82 N83 K88 H89	Q82-A85 PolarHBondContact O-N 3.31Å; Q82-A85 VanDerWaalsContact O-N 3.15Å; N83-A85 PolarHBondContact O-N 2.89Å; A85-K88 PolarHBondContact O-N 3.03Å; A85-H89 PolarHBondContact O-N 2.83Å
86	V	78.8	Confident	82.9	Confident	15 Å²	15	82 Å²	82	9%	0.091	40%	0.402	C	S	.	.	H	α-helix	trans	-68.1	-38.3	-176.6	170.6	0	0	0	0	112.2	Q82 N83 K88 H89 F90	Q82-V86 HydrophobicContact CG-CG2 4.11Å; Q82-V86 WeakPolarHBondContact O-CG2 3.41Å; Q82-V86 PolarHBondContact O-N 3.17Å; N83-V86 PolarHBondContact O-N 3Å; V86-K88 VanDerWaalsContact C-N 3.28Å; V86-K88 PolarHBondContact O-N 3.24Å; V86-H89 WeakPolarHBondContact O-CB 3.43Å; V86-H89 PolarHBondContact O-N 2.99Å; V86-F90 HydrophobicContact CG1-CD2 3.56Å; V86-F90 HydrophobicContact CG1-CE2 3.29Å; V86-F90 HydrophobicContact CG1-CZ 4.24Å; V86-F90 PolarHBondContact O-N 3.22Å
87	M	80.4	Confident	82.4	Confident	104 Å²	104	77.6 Å²	77.6	51%	0.512	40%	0.395	S	S	.	.	H	α-helix	trans	-63.2	-30.9	176.4	-75.5	-64.6	-69.2	0	0	113.1	N83 K91	N83-M87 WeakPolarHBondContact O-CB 3.27Å; N83-M87 WeakPolarHBondContact O-CG 3.34Å; N83-M87 PolarHBondContact O-N 3.18Å; M87-K91 WeakPolarHBondContact O-CG 3.3Å; M87-K91 PolarHBondContact O-N 2.97Å
88	K	79.4	Confident	82.1	Confident	140 Å²	140	77.5 Å²	77.5	61%	0.609	40%	0.397	S	S	*	.	H	α-helix	trans	-69.2	-42.6	174.2	-68.7	173.5	-175.8	175.4	0	111	N84 A85 V86 K91 N92	N84-K88 WeakPolarHBondContact O-CD 3.32Å; N84-K88 WeakPolarHBondContact O-CE 3.43Å; N84-K88 WeakPolarHBondContact O-CG 3.5Å; A85-K88 PolarHBondContact O-N 3.03Å; V86-K88 VanDerWaalsContact C-N 3.28Å; V86-K88 PolarHBondContact O-N 3.24Å; K88-K91 PolarHBondContact O-N 3.07Å; K88-N92 PolarHBondContact O-N 3.44Å; K88-N92 VanDerWaalsContact O-N 3.09Å; K88-N92 PolarHBondContact O-OD1 2.86Å
89	H	79.5	Confident	81.8	Confident	66 Å²	66	81.4 Å²	81.4	31%	0.306	42%	0.417	S	S	.	.	H	α-helix	trans	-62.3	-42.4	173.4	179	-82	0	0	0	111.9	C57 A85 V86 A93	C57-H89 HydrophobicContact CB-CB 4.14Å; A85-H89 PolarHBondContact O-N 2.83Å; V86-H89 WeakPolarHBondContact O-CB 3.43Å; V86-H89 PolarHBondContact O-N 2.99Å; H89-A93 VanDerWaalsContact O-CB 3.26Å; H89-A93 WeakPolarHBondContact O-CB 3.48Å; H89-A93 PolarHBondContact O-N 3.43Å
90	F	80.5	Confident	81.1	Confident	108 Å²	108	87.4 Å²	87.4	47%	0.474	44%	0.443	S	S	.	.	H	α-helix	trans	-68.5	-34.9	177.5	-75.6	-48.9	0	0	0	113.8	V86 V94	V86-F90 HydrophobicContact CG1-CD2 3.56Å; V86-F90 HydrophobicContact CG1-CE2 3.29Å; V86-F90 HydrophobicContact CG1-CZ 4.24Å; V86-F90 PolarHBondContact O-N 3.22Å; F90-V94 WeakPolarHBondContact O-CB 3.48Å; F90-V94 VanDerWaalsContact O-CG2 3.28Å; F90-V94 WeakPolarHBondContact O-CG2 3.38Å; F90-V94 PolarHBondContact O-N 2.98Å
91	K	85.2	Confident	80.3	Confident	133 Å²	133	85.4 Å²	85.4	58%	0.578	44%	0.439	S	S	*	.	H	α-helix	trans	-59.9	-58.6	170.7	-76.6	-176.7	176.5	-163.8	0	110.7	M87 K88 A93 V94 D95	M87-K91 WeakPolarHBondContact O-CG 3.3Å; M87-K91 PolarHBondContact O-N 2.97Å; K88-K91 PolarHBondContact O-N 3.07Å; K91-A93 PolarHBondContact O-N 3.27Å; K91-A93 VanDerWaalsContact O-N 3.15Å; K91-V94 WeakPolarHBondContact O-CA 3.38Å; K91-V94 WeakPolarHBondContact O-CB 3.36Å; K91-V94 PolarHBondContact O-N 2.72Å; K91-D95 PolarHBondContact O-N 3.1Å; K91-D95 VanDerWaalsContact O-OD2 3.11Å
92	N	81.1	Confident	79.2	Confident	98 Å²	98	85.9 Å²	85.9	52%	0.524	44%	0.441	S	S	.	.	H	α-helix	trans	-53.8	-40.4	178.6	-66.1	25.7	0	0	0	112.7	K88 D95 E96	K88-N92 PolarHBondContact O-N 3.44Å; K88-N92 VanDerWaalsContact O-N 3.09Å; K88-N92 PolarHBondContact O-OD1 2.86Å; N92-D95 PolarHBondContact O-N 2.74Å; N92-E96 WeakPolarHBondContact O-CB 3.43Å; N92-E96 WeakPolarHBondContact O-CG 3.46Å; N92-E96 PolarHBondContact O-N 2.98Å
93	A	81.9	Confident	78	Confident	33 Å²	33	90.9 Å²	90.9	27%	0.273	47%	0.468	S	S	.	.	H	α-helix	trans	-69.5	-36	177.6	0	0	0	0	0	113.1	H89 K91 T97	H89-A93 VanDerWaalsContact O-CB 3.26Å; H89-A93 WeakPolarHBondContact O-CB 3.48Å; H89-A93 PolarHBondContact O-N 3.43Å; K91-A93 PolarHBondContact O-N 3.27Å; K91-A93 VanDerWaalsContact O-N 3.15Å; A93-T97 WeakPolarHBondContact O-CG2 3.38Å; A93-T97 PolarHBondContact O-N 3.39Å; A93-T97 PolarHBondContact O-OG1 3.05Å
94	V	86.7	Confident	76.4	Confident	76 Å²	76	93.2 Å²	93.2	46%	0.461	47%	0.474	S	S	.	.	H	α-helix	trans	-65.8	-47.1	172	166.2	0	0	0	0	110	F90 K91 E96 T97 L98	F90-V94 WeakPolarHBondContact O-CB 3.48Å; F90-V94 VanDerWaalsContact O-CG2 3.28Å; F90-V94 WeakPolarHBondContact O-CG2 3.38Å; F90-V94 PolarHBondContact O-N 2.98Å; K91-V94 WeakPolarHBondContact O-CA 3.38Å; K91-V94 WeakPolarHBondContact O-CB 3.36Å; K91-V94 PolarHBondContact O-N 2.72Å; V94-E96 PolarHBondContact O-N 3.42Å; V94-T97 WeakPolarHBondContact CA-OG1 3.41Å; V94-T97 CarbonylContact O-C 3.49Å; V94-T97 PolarHBondContact O-N 2.87Å; V94-T97 PolarHBondContact O-OG1 2.92Å; V94-L98 HydrophobicContact CG1-CD1 3.8Å; V94-L98 HydrophobicContact CG1-CG 4.27Å; V94-L98 WeakPolarHBondContact O-CG 3.46Å; V94-L98 PolarHBondContact O-N 2.97Å
95	D	83.5	Confident	74.4	Confident	82 Å²	82	96.4 Å²	96.4	44%	0.439	49%	0.486	S	S	.	.	H	α-helix	trans	-58.8	-46.8	178	-55	-32.1	0	0	0	110.9	K91 N92 T97 L98 I99	K91-D95 PolarHBondContact O-N 3.1Å; K91-D95 VanDerWaalsContact O-OD2 3.11Å; N92-D95 PolarHBondContact O-N 2.74Å; D95-T97 VanDerWaalsContact C-N 3.34Å; D95-T97 PolarHBondContact O-N 3.18Å; D95-L98 PolarHBondContact O-N 3.35Å; D95-I99 WeakPolarHBondContact O-CD1 3.49Å; D95-I99 VanDerWaalsContact O-CG1 3.28Å; D95-I99 WeakPolarHBondContact O-CG1 3.13Å; D95-I99 PolarHBondContact O-N 2.83Å
96	E	80.5	Confident	72.8	Confident	137 Å²	137	101 Å²	101	64%	0.64	51%	0.506	S	S	*	.	H	α-helix	trans	-59.5	-39.5	172.5	-79.8	-179.8	-158.4	0	0	112.5	N92 V94 K100	N92-E96 WeakPolarHBondContact O-CB 3.43Å; N92-E96 WeakPolarHBondContact O-CG 3.46Å; N92-E96 PolarHBondContact O-N 2.98Å; V94-E96 PolarHBondContact O-N 3.42Å; E96-K100 WeakPolarHBondContact O-CB 3.05Å; E96-K100 PolarHBondContact O-N 3.3Å; E96-K100 VanDerWaalsContact O-N 3.12Å
97	T	79.1	Confident	70.9	Confident	83 Å²	83	105.1 Å²	105.1	51%	0.509	53%	0.532	S	S	.	.	H	α-helix	trans	-71.7	-36	176.3	52.7	0	0	0	0	113.5	A93 V94 D95 K100 T101	A93-T97 WeakPolarHBondContact O-CG2 3.38Å; A93-T97 PolarHBondContact O-N 3.39Å; A93-T97 PolarHBondContact O-OG1 3.05Å; V94-T97 WeakPolarHBondContact CA-OG1 3.41Å; V94-T97 CarbonylContact O-C 3.49Å; V94-T97 PolarHBondContact O-N 2.87Å; V94-T97 PolarHBondContact O-OG1 2.92Å; D95-T97 VanDerWaalsContact C-N 3.34Å; D95-T97 PolarHBondContact O-N 3.18Å; T97-K100 CarbonylContact O-C 3.57Å; T97-K100 WeakPolarHBondContact O-CA 3.41Å; T97-K100 PolarHBondContact O-N 3.37Å; T97-K100 VanDerWaalsContact O-N 3.14Å; T97-T101 PolarHBondContact O-N 2.78Å; T97-T101 PolarHBondContact O-OG1 2.97Å
98	L	79.7	Confident	68.7	Low	94 Å²	94	108.5 Å²	108.5	49%	0.492	55%	0.546	S	S	.	.	H	α-helix	trans	-65.9	-44.9	177.1	-74.4	168.8	0	0	0	111.2	V94 D95 K100 T101 L102	V94-L98 HydrophobicContact CG1-CD1 3.8Å; V94-L98 HydrophobicContact CG1-CG 4.27Å; V94-L98 WeakPolarHBondContact O-CG 3.46Å; V94-L98 PolarHBondContact O-N 2.97Å; D95-L98 PolarHBondContact O-N 3.35Å; L98-K100 PolarHBondContact O-N 3.48Å; L98-T101 WeakPolarHBondContact CA-OG1 3.39Å; L98-T101 PolarHBondContact O-N 3.15Å; L98-T101 PolarHBondContact O-OG1 3.29Å; L98-L102 PolarHBondContact O-N 3.42Å
99	I	76.4	Confident	66.6	Low	100 Å²	100	110.5 Å²	110.5	51%	0.513	56%	0.557	S	S	.	*	H	α-helix	trans	-57.4	-38.1	171.3	-68.4	164	0	0	0	110.3	D95 L103	D95-I99 WeakPolarHBondContact O-CD1 3.49Å; D95-I99 VanDerWaalsContact O-CG1 3.28Å; D95-I99 WeakPolarHBondContact O-CG1 3.13Å; D95-I99 PolarHBondContact O-N 2.83Å; I99-L103 HydrophobicContact CG2-CD1 3.82Å; I99-L103 WeakPolarHBondContact O-CB 3.36Å; I99-L103 VanDerWaalsContact O-CG 3.24Å; I99-L103 WeakPolarHBondContact O-CG 3.35Å; I99-L103 PolarHBondContact O-N 2.88Å
100	K	72.9	Confident	64.2	Low	149 Å²	149	117 Å²	117	65%	0.648	59%	0.588	S	S	*	*	H	α-helix	trans	-83.6	-10.3	-178	-160.8	168.9	-170	167.3	0	115	E96 T97 L98 K104	E96-K100 WeakPolarHBondContact O-CB 3.05Å; E96-K100 PolarHBondContact O-N 3.3Å; E96-K100 VanDerWaalsContact O-N 3.12Å; T97-K100 CarbonylContact O-C 3.57Å; T97-K100 WeakPolarHBondContact O-CA 3.41Å; T97-K100 PolarHBondContact O-N 3.37Å; T97-K100 VanDerWaalsContact O-N 3.14Å; L98-K100 PolarHBondContact O-N 3.48Å; K100-K104 WeakPolarHBondContact O-CD 3.48Å; K100-K104 WeakPolarHBondContact O-CG 3.43Å
101	T	69.8	Low	61.7	Low	73 Å²	73	119.2 Å²	119.2	45%	0.448	61%	0.605	S	S	.	*	H	α-helix	trans	-89.4	-42	166.3	46.9	0	0	0	0	111.2	T97 L98 L103 K104 E105	T97-T101 PolarHBondContact O-N 2.78Å; T97-T101 PolarHBondContact O-OG1 2.97Å; L98-T101 WeakPolarHBondContact CA-OG1 3.39Å; L98-T101 PolarHBondContact O-N 3.15Å; L98-T101 PolarHBondContact O-OG1 3.29Å; T101-L103 PolarHBondContact O-N 3.45Å; T101-K104 WeakPolarHBondContact O-CB 3.32Å; T101-K104 PolarHBondContact O-N 3.05Å; T101-E105 PolarHBondContact O-N 3.02Å; T101-E105 VanDerWaalsContact O-N 3.13Å
102	L	62	Low	59.1	Low	107 Å²	107	120.4 Å²	120.4	56%	0.56	61%	0.613	S	S	*	*	H	α-helix	trans	-55.5	-52.3	172.2	-80.8	159.4	0	0	0	111.2	L98 K104 E105 D106	L98-L102 PolarHBondContact O-N 3.42Å; L102-K104 PolarHBondContact O-N 3.24Å; L102-E105 PolarHBondContact O-N 3.14Å; L102-D106 PolarHBondContact O-N 2.9Å
103	L	54.9	Low	56.5	Low	112 Å²	112	122.3 Å²	122.3	59%	0.586	62%	0.623	S	S	*	*	H	α-helix	trans	-66.4	7.1	175.4	-68.6	172.5	0	0	0	115	I99 T101	I99-L103 HydrophobicContact CG2-CD1 3.82Å; I99-L103 WeakPolarHBondContact O-CB 3.36Å; I99-L103 VanDerWaalsContact O-CG 3.24Å; I99-L103 WeakPolarHBondContact O-CG 3.35Å; I99-L103 PolarHBondContact O-N 2.88Å; T101-L103 PolarHBondContact O-N 3.45Å
104	K	50.6	Low	54	Low	129 Å²	129	128.8 Å²	128.8	56%	0.561	65%	0.647	S	S	*	*	H	α-helix	trans	-110.1	-38.5	171.7	-86.6	-179.1	153.4	-123.7	0	112.3	K100 T101 L102 D106 T107	K100-K104 WeakPolarHBondContact O-CD 3.48Å; K100-K104 WeakPolarHBondContact O-CG 3.43Å; T101-K104 WeakPolarHBondContact O-CB 3.32Å; T101-K104 PolarHBondContact O-N 3.05Å; L102-K104 PolarHBondContact O-N 3.24Å; K104-D106 PolarHBondContact O-N 3.36Å; K104-T107 WeakPolarHBondContact CA-OG1 3.44Å; K104-T107 PolarHBondContact O-N 3.01Å; K104-T107 VanDerWaalsContact O-N 3.09Å; K104-T107 PolarHBondContact O-OG1 3.3Å
105	E	42.3	Very low	51.2	Low	152 Å²	152	133.1 Å²	133.1	71%	0.71	66%	0.662	S	S	*	*	H	α-helix	trans	-62.4	-31.7	173.4	-68.2	173.1	139.3	0	0	110.4	T101 L102 T107	T101-E105 PolarHBondContact O-N 3.02Å; T101-E105 VanDerWaalsContact O-N 3.13Å; L102-E105 PolarHBondContact O-N 3.14Å; E105-T107 PolarHBondContact O-N 2.89Å; E105-T107 VanDerWaalsContact O-N 3.12Å
106	D	43.6	Very low	48.6	Very low	129 Å²	129	137.6 Å²	137.6	69%	0.69	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69	4.9	171.2	-68.7	-27	0	0	0	115.7	L102 K104	L102-D106 PolarHBondContact O-N 2.9Å; K104-D106 PolarHBondContact O-N 3.36Å
107	T	37.8	Very low	46	Very low	103 Å²	103	136 Å²	136	63%	0.632	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-136.6	13.5	-170.7	44	0	0	0	0	117.1	K104 E105	K104-T107 WeakPolarHBondContact CA-OG1 3.44Å; K104-T107 PolarHBondContact O-N 3.01Å; K104-T107 VanDerWaalsContact O-N 3.09Å; K104-T107 PolarHBondContact O-OG1 3.3Å; E105-T107 PolarHBondContact O-N 2.89Å; E105-T107 VanDerWaalsContact O-N 3.12Å
108	E	34.7	Very low	43.5	Very low	175 Å²	175	141.8 Å²	141.8	82%	0.818	71%	0.713	S	S	*	*	S	Bend	trans	-109.4	7.3	174.4	-63.8	-169.5	174.7	0	0	113.9
109	E	35.1	Very low	40.9	Very low	181 Å²	181	141.1 Å²	141.1	85%	0.846	73%	0.729	S	S	*	*	S	Bend	trans	-129.8	69.6	-178.4	-72.1	-86	176.2	0	0	112.6
110	E	30.7	Very low	38.5	Very low	202 Å²	202	145.4 Å²	145.4	94%	0.944	75%	0.746	S	S	*	*			trans	-172.2	130.3	142.3	-110.3	177.3	-162.2	0	0	110.3
111	D	27.5	Very low	36.3	Very low	155 Å²	155	144.1 Å²	144.1	83%	0.829	75%	0.751	S	S	*	*			trans	-109.2	162.4	-167.7	-121.9	-31.2	0	0	0	113.1
112	E	29.3	Very low	34.2	Very low	159 Å²	159	147.3 Å²	147.3	74%	0.743	77%	0.765	S	S	*	*			trans	38.8	106.4	157.3	-57.5	-173.9	153.4	0	0	120
113	N	27.6	Very low	32.6	Very low	138 Å²	138	148.9 Å²	148.9	74%	0.738	77%	0.774	S	S	*	*				171.5	153.2	105.9	-91	-68.1	0	0	0	115.4
114	E	29.4	Very low	31.4	Very low	168 Å²	168	151.5 Å²	151.5	79%	0.785	78%	0.784	S	S	*	*			trans	31.1	141.8	148.3	-64.6	-179.7	176.3	0	0	122.5
115	E	28.4	Very low	30.2	Very low	167 Å²	167	151.9 Å²	151.9	78%	0.78	79%	0.792	S	S	*	*			cis	-165.8	173.4	-22.6	-138.9	-178.9	-155.7	0	0	109.7
116	E	27.3	Very low	29.4	Very low	176 Å²	176	150.4 Å²	150.4	82%	0.822	79%	0.789	S	S	*	*			trans	19.8	125.4	167.9	-58.7	-161	156.1	0	0	123.1
117	A	27.5	Very low	28.7	Very low	105 Å²	105	149.7 Å²	149.7	87%	0.868	79%	0.789	S	S	*	*				-170.3	142.3	114	0	0	0	0	0	112.8
118	E	25.3	Very low	28.2	Very low	204 Å²	204	152.8 Å²	152.8	95%	0.953	80%	0.796	S	S	*	*			trans	-91.1	161.1	-179.4	-58.3	-175.3	150.6	0	0	114.1
119	G	26.7	Very low	27.9	Very low	80 Å²	80	152.8 Å²	152.8	83%	0.825	80%	0.796	S	S	*	*			trans	167.3	92.2	164.5	0	0	0	0	0	117.1
120	E	25.4	Very low	27.5	Very low	190 Å²	190	150.3 Å²	150.3	89%	0.888	80%	0.796	S	S	*	*			trans	-69.8	163.4	159.2	-52.3	176.7	134.7	0	0	109.6
121	T	25.8	Very low	27.3	Very low	121 Å²	121	146.1 Å²	146.1	74%	0.742	79%	0.789	S	S	*	*			cis	-156.9	-179.6	37.5	56.6	0	0	0	0	113
122	D	26.6	Very low	27.2	Very low	141 Å²	141	147.9 Å²	147.9	75%	0.754	79%	0.79	S	S	*	*			trans	-35	166.4	162.7	-50	-52	0	0	0	117
123	D	27.3	Very low	27	Very low	140 Å²	140	146.8 Å²	146.8	75%	0.749	79%	0.788	S	S	*	*			cis	-163.8	171.1	30.2	-146.8	-10.6	0	0	0	116.6
124	E	30.4	Very low	26.9	Very low	167 Å²	167	149.9 Å²	149.9	78%	0.78	79%	0.789	S	S	*	*			trans	42.5	103	159.8	-61.7	-145.9	137.7	0	0	123.5
125	N	25.4	Very low	26.6	Very low	136 Å²	136	147 Å²	147	73%	0.727	78%	0.779	S	S	*	*				97.8	139.6	110.2	-166.3	47.2	0	0	0	123.4
126	D	25.8	Very low	26.5	Very low	122 Å²	122	147.9 Å²	147.9	65%	0.652	78%	0.781	S	S	*	*			trans	103.4	128.2	145.1	-117	-43.5	0	0	0	124.1
127	T	27.7	Very low	26.3	Very low	113 Å²	113	148.8 Å²	148.8	69%	0.693	78%	0.782	S	S	*	*			trans	66.3	98.3	156.2	-54.3	0	0	0	0	122.2
128	E	27.6	Very low	26.1	Very low	168 Å²	168	148.5 Å²	148.5	79%	0.785	78%	0.779	S	S	*	*			trans	53.1	115	135.1	-59.5	-159.3	142.3	0	0	125.1
129	Q	29.2	Very low	26.1	Very low	175 Å²	175	143.4 Å²	143.4	82%	0.818	77%	0.772	S	S	*	*			trans	71.7	125.5	146	-59.7	-161.8	27.7	0	0	121.1
130	P	26.5	Very low	26	Very low	129 Å²	129	149 Å²	149	84%	0.838	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-88.9	157.7	-171.2	36.4	-37.4	0	0	0	115.2
131	S	25.6	Very low	26	Very low	115 Å²	115	143.9 Å²	143.9	80%	0.804	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-73.8	147	169.5	47	0	0	0	0	112.7
132	K	27.3	Very low	25.9	Very low	192 Å²	192	146.9 Å²	146.9	84%	0.835	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-71.2	145.6	160.5	-63.7	180	178.2	-177.1	0	109.4
133	L	24.1	Very low	25.8	Very low	135 Å²	135	146 Å²	146	71%	0.707	78%	0.778	S	S	*	*				162.3	142.3	113	-88.4	166.9	0	0	0	114
134	R	25.6	Very low	25.7	Very low	203 Å²	203	146.9 Å²	146.9	77%	0.766	78%	0.782	S	S	*	*			trans	74.6	155	144.8	-69.8	164.1	112.5	-172	5.1	116.4
135	N	23.8	Very low	25.4	Very low	108 Å²	108	144.7 Å²	144.7	58%	0.578	79%	0.786	S	S	*	*			cis	-167.7	162.5	2.2	-126.6	1.9	0	0	0	113.9
136	K	25.2	Very low	25.7	Very low	186 Å²	186	147.6 Å²	147.6	81%	0.809	80%	0.795	S	S	*	*			trans	67	167	154.6	-65.4	170.3	176.5	-171.1	0	115.6
137	K	22.7	Very low	25.8	Very low	194 Å²	194	151.2 Å²	151.2	84%	0.843	81%	0.808	S	S	*	*			cis	-112.2	166.3	3.5	-80.6	-178.4	-178.5	174.2	0	110.5
138	A	23.9	Very low	26	Very low	99 Å²	99	153.6 Å²	153.6	82%	0.818	82%	0.816	S	S	*	*				65.7	135.9	50.1	0	0	0	0	0	113.7
139	A	25.3	Very low	26	Very low	98 Å²	98	150.4 Å²	150.4	81%	0.81	81%	0.812	S	S	*	*			trans	-138.6	157.1	-152.7	0	0	0	0	0	114.8
140	E	23.8	Very low	26.5	Very low	197 Å²	197	149.4 Å²	149.4	92%	0.921	81%	0.813	S	S	*	*			trans	178.4	148.4	160.6	-101	171.3	152.2	0	0	106.8
141	A	25.9	Very low	26.9	Very low	82 Å²	82	151 Å²	151	68%	0.678	81%	0.812	S	S	*	*			cis	-157	149.4	-9	0	0	0	0	0	112.7
142	Q	24	Very low	27.5	Very low	185 Å²	185	153 Å²	153	86%	0.864	81%	0.814	S	S	*	*			trans	42.8	115.3	151.8	-64.2	-175.4	-47.9	0	0	122.9
143	S	24.1	Very low	28.2	Very low	123 Å²	123	151.4 Å²	151.4	86%	0.86	81%	0.808	S	S	*	*			trans	-158.6	134.9	133.4	-171.8	0	0	0	0	109.1
144	D	25.8	Very low	29.6	Very low	158 Å²	158	150.1 Å²	150.1	85%	0.845	80%	0.801	S	S	*	*			trans	-85.2	130.3	-164.4	-58.3	-51.8	0	0	0	114.7
145	S	24.5	Very low	31	Very low	121 Å²	121	145 Å²	145	85%	0.846	79%	0.793	S	S	*	*			trans	-159.2	136.9	152.7	-171.6	0	0	0	0	110.1
146	E	30.4	Very low	32.4	Very low	196 Å²	196	144.5 Å²	144.5	92%	0.916	79%	0.79	S	S	*	*			trans	-86.6	116.3	179.9	-59.9	175.4	146.6	0	0	111.1
147	E	28.4	Very low	34.5	Very low	199 Å²	199	138.3 Å²	138.3	93%	0.93	77%	0.773	S	S	*	*			trans	-153	128.9	154.5	-133.3	166.4	-154.6	0	0	110.1
148	D	31.6	Very low	36.3	Very low	163 Å²	163	133.5 Å²	133.5	87%	0.872	76%	0.756	S	S	*	*			trans	-102.6	127	-165.9	-162	11.8	0	0	0	110.4
149	S	28.8	Very low	38.1	Very low	100 Å²	100	132.7 Å²	132.7	70%	0.699	74%	0.736	S	S	*	*			trans	-151.3	123.4	177.1	63.5	0	0	0	0	112.6
150	D	38.7	Very low	40	Very low	155 Å²	155	132.7 Å²	132.7	83%	0.829	72%	0.717	S	S	*	*			trans	-67.7	138.9	-173.8	-53.9	-87.6	0	0	0	113.2
151	I	35.7	Very low	41.8	Very low	161 Å²	161	131.7 Å²	131.7	83%	0.826	71%	0.705	S	S	*	*			trans	-115	110.1	165.8	-71.8	176.5	0	0	0	108.3	F153	I151-F153 PolarHBondContact O-N 3.45Å
152	D	38.3	Very low	43.2	Very low	158 Å²	158	131.5 Å²	131.5	85%	0.845	69%	0.69	S	S	*	*			trans	-62.4	115.3	-178.6	-75	-51.1	0	0	0	112.3	D154	D152-D154 PolarHBondContact O-N 3.03Å
153	F	40.8	Very low	44.3	Very low	159 Å²	159	128.4 Å²	128.4	70%	0.697	67%	0.674	S	S	*	*			trans	-84.7	105.3	170.9	-173.4	-91	0	0	0	110.2	I151 V155 L158	I151-F153 PolarHBondContact O-N 3.45Å; F153-V155 VanDerWaalsContact C-N 3.34Å; F153-V155 HydrophobicContact CD1-CG2 3.92Å; F153-V155 HydrophobicContact CE1-CG2 4.39Å; F153-V155 PolarHBondContact O-N 2.82Å; F153-L158 HydrophobicContact CE1-CD2 4.45Å
154	D	53.8	Low	45.3	Very low	108 Å²	108	130.1 Å²	130.1	58%	0.578	67%	0.668	S	S	*	*			trans	-71.5	83	-178.6	-174.4	4	0	0	0	112.8	D152 D156 A157	D152-D154 PolarHBondContact O-N 3.03Å; D154-D156 PolarHBondContact O-N 3.05Å; D154-D156 WeakPolarHBondContact OD1-CB 3.28Å; D154-D156 PolarHBondContact OD1-N 3.25Å; D154-D156 VanDerWaalsContact OD1-N 3.09Å; D154-A157 HydrophobicContact CB-CB 4.43Å; D154-A157 PolarHBondContact O-N 3.36Å; D154-A157 PolarHBondContact OD1-N 2.89Å
155	V	55.1	Low	46.1	Very low	96 Å²	96	130 Å²	130	58%	0.582	66%	0.66	S	S	*	*	H	α-helix	trans	-53.7	-34.3	173.6	178.3	0	0	0	0	111.7	F153 A157 L158 E159	F153-V155 VanDerWaalsContact C-N 3.34Å; F153-V155 HydrophobicContact CD1-CG2 3.92Å; F153-V155 HydrophobicContact CE1-CG2 4.39Å; F153-V155 PolarHBondContact O-N 2.82Å; V155-A157 PolarHBondContact O-N 3.12Å; V155-L158 WeakPolarHBondContact O-CB 3.39Å; V155-L158 PolarHBondContact O-N 2.68Å; V155-E159 PolarHBondContact O-N 3.4Å
156	D	54.6	Low	46.8	Very low	96 Å²	96	131.7 Å²	131.7	51%	0.513	65%	0.652	S	S	.	*	H	α-helix	trans	-72.1	-19.3	-174	-163.3	32.1	0	0	0	111.7	D154 K160	D154-D156 PolarHBondContact O-N 3.05Å; D154-D156 WeakPolarHBondContact OD1-CB 3.28Å; D154-D156 PolarHBondContact OD1-N 3.25Å; D154-D156 VanDerWaalsContact OD1-N 3.09Å; D156-K160 WeakPolarHBondContact O-CG 3.41Å; D156-K160 PolarHBondContact O-NZ 3.39Å; D156-K160 IonicContact OD1-NZ 2.65Å; D156-K160 PolarHBondContact OD1-NZ 3.11Å; D156-K160 IonicContact OD2-NZ 2.63Å; D156-K160 PolarHBondContact OD2-NZ 3.28Å
157	A	67.9	Low	47	Very low	56 Å²	56	131.3 Å²	131.3	46%	0.463	65%	0.65	S	S	.	*	H	α-helix	trans	-78.8	-30	168	0	0	0	0	0	113.5	D154 V155	D154-A157 HydrophobicContact CB-CB 4.43Å; D154-A157 PolarHBondContact O-N 3.36Å; D154-A157 PolarHBondContact OD1-N 2.89Å; V155-A157 PolarHBondContact O-N 3.12Å
158	L	60.8	Low	47.4	Very low	93 Å²	93	124.2 Å²	124.2	49%	0.487	63%	0.631	S	S	.	*	H	α-helix	trans	-75.9	-45.3	179	-172.7	63.8	0	0	0	111.3	F153 V155 K160 R161 E162	F153-L158 HydrophobicContact CE1-CD2 4.45Å; V155-L158 WeakPolarHBondContact O-CB 3.39Å; V155-L158 PolarHBondContact O-N 2.68Å; L158-K160 PolarHBondContact O-N 3.04Å; L158-R161 WeakPolarHBondContact O-CA 3.36Å; L158-R161 VanDerWaalsContact O-CB 3.26Å; L158-R161 WeakPolarHBondContact O-CB 3.42Å; L158-R161 PolarHBondContact O-N 3.5Å; L158-E162 PolarHBondContact O-N 2.8Å; L158-E162 VanDerWaalsContact O-N 3.14Å
159	E	62.4	Low	47.4	Very low	83 Å²	83	122.9 Å²	122.9	39%	0.388	63%	0.628	S	S	.	*	H	α-helix	trans	-64.2	-37.2	-175.7	-159.8	-124.4	-149.2	0	0	112.8	V155 R161 E162 K163	V155-E159 PolarHBondContact O-N 3.4Å; E159-R161 VanDerWaalsContact C-N 3.26Å; E159-R161 PolarHBondContact O-N 3.4Å; E159-E162 WeakPolarHBondContact O-CB 3.37Å; E159-E162 PolarHBondContact O-N 3Å; E159-K163 WeakPolarHBondContact O-CG 3.48Å; E159-K163 PolarHBondContact O-N 3.12Å; E159-K163 VanDerWaalsContact OE1-CE 3.23Å; E159-K163 WeakPolarHBondContact OE1-CE 3.24Å; E159-K163 IonicContact OE1-NZ 3.92Å; E159-K163 PolarHBondContact OE1-NZ 3.09Å; E159-K163 WeakPolarHBondContact OE2-CD 3.49Å; E159-K163 WeakPolarHBondContact OE2-CE 3.35Å; E159-K163 IonicContact OE2-NZ 2.82Å; E159-K163 PolarHBondContact OE2-NZ 3.06Å
160	K	65	Low	47.7	Very low	98 Å²	98	129.7 Å²	129.7	43%	0.426	64%	0.639	S	S	.	*	H	α-helix	trans	-63.7	-30.1	172.5	-68.3	179	-169.9	67.6	0	112.9	D156 L158 Q164	D156-K160 WeakPolarHBondContact O-CG 3.41Å; D156-K160 PolarHBondContact O-NZ 3.39Å; D156-K160 IonicContact OD1-NZ 2.65Å; D156-K160 PolarHBondContact OD1-NZ 3.11Å; D156-K160 IonicContact OD2-NZ 2.63Å; D156-K160 PolarHBondContact OD2-NZ 3.28Å; L158-K160 PolarHBondContact O-N 3.04Å; K160-Q164 WeakPolarHBondContact O-CG 3.31Å; K160-Q164 PolarHBondContact O-N 3.39Å
161	R	61.1	Low	47.3	Very low	175 Å²	175	129.6 Å²	129.6	66%	0.66	64%	0.638	S	S	*	*	H	α-helix	trans	-76.8	-34.2	179.2	-161.6	176.9	-175.3	176.6	-0.6	112	L158 E159	L158-R161 WeakPolarHBondContact O-CA 3.36Å; L158-R161 VanDerWaalsContact O-CB 3.26Å; L158-R161 WeakPolarHBondContact O-CB 3.42Å; L158-R161 PolarHBondContact O-N 3.5Å; E159-R161 VanDerWaalsContact C-N 3.26Å; E159-R161 PolarHBondContact O-N 3.4Å
162	E	54.8	Low	47.5	Very low	78 Å²	78	128.7 Å²	128.7	36%	0.364	64%	0.635	S	S	.	*	H	α-helix	trans	-63	-52.4	168.7	-84.3	-78.5	112.7	0	0	111.6	L158 E159 Q164 K165 K166	L158-E162 PolarHBondContact O-N 2.8Å; L158-E162 VanDerWaalsContact O-N 3.14Å; E159-E162 WeakPolarHBondContact O-CB 3.37Å; E159-E162 PolarHBondContact O-N 3Å; E162-Q164 PolarHBondContact O-N 3.31Å; E162-K165 WeakPolarHBondContact O-CB 3.38Å; E162-K165 PolarHBondContact O-N 2.95Å; E162-K166 PolarHBondContact O-N 2.93Å; E162-K166 WeakPolarHBondContact OE2-CE 3.21Å; E162-K166 IonicContact OE2-NZ 3.46Å; E162-K166 PolarHBondContact OE2-NZ 3.42Å
163	K	48.2	Very low	47.3	Very low	121 Å²	121	125.9 Å²	125.9	53%	0.526	63%	0.628	S	S	.	*	H	α-helix	trans	-60.8	-30.6	-177.7	-73.8	175.5	177.5	169.8	0	113	E159	E159-K163 WeakPolarHBondContact O-CG 3.48Å; E159-K163 PolarHBondContact O-N 3.12Å; E159-K163 VanDerWaalsContact OE1-CE 3.23Å; E159-K163 WeakPolarHBondContact OE1-CE 3.24Å; E159-K163 IonicContact OE1-NZ 3.92Å; E159-K163 PolarHBondContact OE1-NZ 3.09Å; E159-K163 WeakPolarHBondContact OE2-CD 3.49Å; E159-K163 WeakPolarHBondContact OE2-CE 3.35Å; E159-K163 IonicContact OE2-NZ 2.82Å; E159-K163 PolarHBondContact OE2-NZ 3.06Å
164	Q	44.4	Very low	47.5	Very low	158 Å²	158	129.3 Å²	129.3	74%	0.738	64%	0.636	S	S	*	*	H	α-helix	trans	-71.8	-32	172.9	-73.6	-178.8	3.8	0	0	114	K160 E162 K166	K160-Q164 WeakPolarHBondContact O-CG 3.31Å; K160-Q164 PolarHBondContact O-N 3.39Å; E162-Q164 PolarHBondContact O-N 3.31Å; Q164-K166 VanDerWaalsContact C-N 3.35Å
165	K	43.2	Very low	46.9	Very low	155 Å²	155	130.2 Å²	130.2	67%	0.674	65%	0.646	S	S	*	*	H	α-helix	trans	-67.4	-34.5	174.6	-77.2	179.3	174.9	175.6	0	112.5	E162 Q167 G168	E162-K165 WeakPolarHBondContact O-CB 3.38Å; E162-K165 PolarHBondContact O-N 2.95Å; K165-Q167 PolarHBondContact O-N 3.15Å; K165-Q167 VanDerWaalsContact O-N 3.13Å; K165-G168 PolarHBondContact O-N 2.85Å
166	K	39.7	Very low	46.6	Very low	157 Å²	157	135.3 Å²	135.3	68%	0.683	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.9	0.9	-174.5	-67.5	172.9	-176.1	163.1	0	114.1	E162 Q164	E162-K166 PolarHBondContact O-N 2.93Å; E162-K166 WeakPolarHBondContact OE2-CE 3.21Å; E162-K166 IonicContact OE2-NZ 3.46Å; E162-K166 PolarHBondContact OE2-NZ 3.42Å; Q164-K166 VanDerWaalsContact C-N 3.35Å
167	Q	34.3	Very low	46.6	Very low	188 Å²	188	135.4 Å²	135.4	88%	0.879	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.3	33.5	169.1	-66.6	-162.4	1	0	0	114.1	K165	K165-Q167 PolarHBondContact O-N 3.15Å; K165-Q167 VanDerWaalsContact O-N 3.13Å
168	G	36.8	Very low	46.4	Very low	50 Å²	50	138.5 Å²	138.5	52%	0.515	68%	0.677	S	S	.	*	S	Bend	trans	-127.6	143.7	171.7	0	0	0	0	0	112.8	K165	K165-G168 PolarHBondContact O-N 2.85Å
169	V	30.8	Very low	46.4	Very low	136 Å²	136	139.1 Å²	139.1	82%	0.824	69%	0.686	S	S	*	*			trans	57.9	87.3	170.3	-166.4	0	0	0	0	115.9
170	R	35.2	Very low	46.7	Very low	242 Å²	242	137.5 Å²	137.5	91%	0.913	68%	0.684	S	S	*	*			trans	-84.3	113.9	134.8	-75.7	-176.1	177.2	-179.6	-0.3	107.9
171	N	30.6	Very low	46.8	Very low	153 Å²	153	142.8 Å²	142.8	82%	0.818	71%	0.71	S	S	*	*			trans	-168	147.2	150.6	-98.3	-23.7	0	0	0	110.5
172	D	39	Very low	47.4	Very low	143 Å²	143	139.4 Å²	139.4	77%	0.765	71%	0.709	S	S	*	*			trans	-91.3	116.6	-179.9	178	12.3	0	0	0	110.6
173	S	34.1	Very low	48.5	Very low	98 Å²	98	137.5 Å²	137.5	69%	0.685	70%	0.701	S	S	*	*			trans	-153.8	110.2	161.9	62.2	0	0	0	0	110.5	T175	S173-T175 PolarHBondContact O-N 2.97Å
174	R	45.6	Very low	50	Low	232 Å²	232	135.9 Å²	135.9	88%	0.875	70%	0.698	S	S	*	*			trans	-61.4	107.5	167.5	-68.7	-176.5	176.7	88.4	1.5	109.8
175	T	40.4	Very low	51.3	Low	127 Å²	127	138.4 Å²	138.4	78%	0.779	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-60.1	140.1	168.3	7.8	0	0	0	0	109.9	S173 V177	S173-T175 PolarHBondContact O-N 2.97Å; T175-V177 PolarHBondContact O-N 3.46Å
176	K	49.3	Very low	52.5	Low	202 Å²	202	138.9 Å²	138.9	88%	0.878	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-71.3	117.1	167.3	-84.4	-174.1	172	-175.4	0	108.3	V178	K176-V178 PolarHBondContact O-N 3.42Å
177	V	55.5	Low	53.8	Low	99 Å²	99	138 Å²	138	60%	0.6	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-61.3	132.8	165.6	176.5	0	0	0	0	108.7	T175 S190	T175-V177 PolarHBondContact O-N 3.46Å; V177-S190 VanDerWaalsContact CG1-OG 3.29Å; V177-S190 WeakPolarHBondContact CG1-OG 3.46Å
178	V	62.4	Low	56.2	Low	121 Å²	121	133.1 Å²	133.1	73%	0.733	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-98.2	126.1	164.4	178.5	0	0	0	0	105.7	K176 S180	K176-V178 PolarHBondContact O-N 3.42Å; V178-S180 PolarHBondContact O-N 2.82Å
179	P	62.4	Low	58.2	Low	106 Å²	106	134.9 Å²	134.9	69%	0.688	67%	0.673	S	S	*	*	P	Polyproline II helix	trans	-64.1	130	176.4	27.8	-33.7	0	0	0	109.6
180	S	67.9	Low	60.6	Low	48 Å²	48	130.3 Å²	130.3	34%	0.336	65%	0.647	S	S	.	*	P	Polyproline II helix	trans	-81.4	162.2	171	70.6	0	0	0	0	110.7	V178 V182 D183	V178-S180 PolarHBondContact O-N 2.82Å; S180-V182 PolarHBondContact O-N 3.15Å; S180-V182 VanDerWaalsContact O-N 3.1Å; S180-D183 WeakPolarHBondContact CA-OD2 3.33Å; S180-D183 WeakPolarHBondContact CB-OD2 3.4Å; S180-D183 PolarHBondContact N-OD2 2.88Å; S180-D183 PolarHBondContact O-N 3.18Å; S180-D183 PolarHBondContact OG-N 2.92Å; S180-D183 PolarHBondContact OG-OD2 2.91Å
181	E	68	Low	62.9	Low	210 Å²	210	124.1 Å²	124.1	98%	0.981	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.9	-4.4	179.7	-59.9	180	160.2	0	0	113.3
182	V	72.8	Confident	65.2	Low	104 Å²	104	122.4 Å²	122.4	63%	0.63	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111	-1.4	179.8	-164.3	0	0	0	0	111.6	S180 D184 L189	S180-V182 PolarHBondContact O-N 3.15Å; S180-V182 VanDerWaalsContact O-N 3.1Å; V182-D184 PolarHBondContact O-N 2.92Å; V182-D184 VanDerWaalsContact O-N 3.16Å; V182-L189 HydrophobicContact CB-CD1 3.95Å; V182-L189 HydrophobicContact CG1-CD1 4.4Å
183	D	76.9	Confident	67	Low	38 Å²	38	122.1 Å²	122.1	20%	0.203	61%	0.611	C	S	.	*			trans	-78.1	95.5	172.8	-71.5	-57.9	0	0	0	110.5	S180 K188 L189	S180-D183 WeakPolarHBondContact CA-OD2 3.33Å; S180-D183 WeakPolarHBondContact CB-OD2 3.4Å; S180-D183 PolarHBondContact N-OD2 2.88Å; S180-D183 PolarHBondContact O-N 3.18Å; S180-D183 PolarHBondContact OG-N 2.92Å; S180-D183 PolarHBondContact OG-OD2 2.91Å; D183-K188 HydrophobicContact CB-CG 4.44Å; D183-K188 VanDerWaalsContact OD1-C 3.31Å; D183-K188 WeakPolarHBondContact OD1-CA 3.43Å; D183-K188 WeakPolarHBondContact OD1-CB 3.47Å; D183-L189 PolarHBondContact OD1-N 2.86Å
184	D	80.8	Confident	69.3	Low	87 Å²	87	120.9 Å²	120.9	47%	0.465	60%	0.602	S	S	.	*			trans	-89.6	-171.3	173.9	76.3	42.3	0	0	0	112.4	V182 F186 F187	V182-D184 PolarHBondContact O-N 2.92Å; V182-D184 VanDerWaalsContact O-N 3.16Å; D184-F186 VanDerWaalsContact C-N 3.28Å; D184-F186 PolarHBondContact O-N 3.39Å; D184-F186 WeakPolarHBondContact OD1-CA 3.48Å; D184-F186 PolarHBondContact OD1-N 2.73Å; D184-F187 PolarHBondContact N-O 3.27Å; D184-F187 PolarHBondContact OD1-N 2.72Å
185	R	71.1	Confident	71.1	Confident	211 Å²	211	116.1 Å²	116.1	80%	0.796	59%	0.588	S	S	*	*	S	Bend	trans	-72.6	-21.2	-177.6	-65.9	-171.8	-171.3	160.9	8	113.4	D256	R185-D256 IonicContact CZ-OD2 2.65Å; R185-D256 IonicContact NH1-OD2 2.77Å; R185-D256 PolarHBondContact NH1-OD2 3.36Å
186	F	69.2	Low	72.9	Confident	164 Å²	164	114 Å²	114	72%	0.719	57%	0.572	S	S	*	*	S	Bend	trans	-110.4	-46	-172.1	-176.3	-119.1	0	0	0	111.6	D184	D184-F186 VanDerWaalsContact C-N 3.28Å; D184-F186 PolarHBondContact O-N 3.39Å; D184-F186 WeakPolarHBondContact OD1-CA 3.48Å; D184-F186 PolarHBondContact OD1-N 2.73Å
187	F	66.2	Low	74.2	Confident	139 Å²	139	108.8 Å²	108.8	61%	0.61	55%	0.553	S	S	*	*			trans	-104.2	123.6	172.9	-66.3	-67.1	0	0	0	111.4	D184	D184-F187 PolarHBondContact N-O 3.27Å; D184-F187 PolarHBondContact OD1-N 2.72Å
188	K	85.2	Confident	75.3	Confident	86 Å²	86	109.2 Å²	109.2	37%	0.374	55%	0.548	S	S	.	.			trans	-119.6	124.9	167.4	-64.8	176	-136.8	69.9	0	109	D183 S190 E191 M192	D183-K188 HydrophobicContact CB-CG 4.44Å; D183-K188 VanDerWaalsContact OD1-C 3.31Å; D183-K188 WeakPolarHBondContact OD1-CA 3.43Å; D183-K188 WeakPolarHBondContact OD1-CB 3.47Å; K188-S190 VanDerWaalsContact C-N 3.26Å; K188-S190 PolarHBondContact O-N 3.12Å; K188-E191 HydrophobicContact CB-CB 3.87Å; K188-E191 IonicContact NZ-OE2 2.65Å; K188-E191 PolarHBondContact NZ-OE2 3.06Å; K188-E191 WeakPolarHBondContact O-CA 3.46Å; K188-E191 WeakPolarHBondContact O-CB 3.28Å; K188-E191 PolarHBondContact O-N 2.9Å; K188-M192 PolarHBondContact O-N 2.93Å
189	L	78.8	Confident	75.9	Confident	87 Å²	87	107.2 Å²	107.2	46%	0.455	53%	0.532	S	S	.	.	H	α-helix	trans	-59.6	-38.6	179.5	-80.6	166.4	0	0	0	111.1	V182 D183 E191 M192 E193	V182-L189 HydrophobicContact CB-CD1 3.95Å; V182-L189 HydrophobicContact CG1-CD1 4.4Å; D183-L189 PolarHBondContact OD1-N 2.86Å; L189-E191 VanDerWaalsContact C-N 3.27Å; L189-E191 PolarHBondContact O-N 3Å; L189-M192 PolarHBondContact O-N 3.2Å; L189-E193 WeakPolarHBondContact O-CB 3.25Å; L189-E193 PolarHBondContact O-N 3.37Å
190	S	80.8	Confident	76.3	Confident	40 Å²	40	107 Å²	107	28%	0.28	53%	0.525	S	S	.	.	H	α-helix	trans	-68.2	-22.8	174.2	-54.2	0	0	0	0	114.2	V177 K188 S194	V177-S190 VanDerWaalsContact CG1-OG 3.29Å; V177-S190 WeakPolarHBondContact CG1-OG 3.46Å; K188-S190 VanDerWaalsContact C-N 3.26Å; K188-S190 PolarHBondContact O-N 3.12Å; S190-S194 VanDerWaalsContact O-CB 3.28Å; S190-S194 WeakPolarHBondContact O-CB 3.45Å; S190-S194 PolarHBondContact O-N 3.48Å; S190-S194 PolarHBondContact O-OG 3Å
191	E	83.9	Confident	76.5	Confident	111 Å²	111	109.2 Å²	109.2	52%	0.519	53%	0.529	S	S	.	.	H	α-helix	trans	-79.9	-44.4	175.8	-165.8	160.9	-177.8	0	0	109.5	K188 L189 S194 F195	K188-E191 HydrophobicContact CB-CB 3.87Å; K188-E191 IonicContact NZ-OE2 2.65Å; K188-E191 PolarHBondContact NZ-OE2 3.06Å; K188-E191 WeakPolarHBondContact O-CA 3.46Å; K188-E191 WeakPolarHBondContact O-CB 3.28Å; K188-E191 PolarHBondContact O-N 2.9Å; L189-E191 VanDerWaalsContact C-N 3.27Å; L189-E191 PolarHBondContact O-N 3Å; E191-S194 PolarHBondContact O-N 2.69Å; E191-S194 PolarHBondContact O-OG 3.09Å; E191-F195 WeakPolarHBondContact O-CB 3.35Å; E191-F195 PolarHBondContact O-N 3.26Å
192	M	79.6	Confident	76.4	Confident	117 Å²	117	104.9 Å²	104.9	58%	0.576	50%	0.504	S	S	*	.	H	α-helix	trans	-61.2	-47.5	171.8	-178.4	178.6	177.3	0	0	112.7	K188 L189 S194 F195 L196	K188-M192 PolarHBondContact O-N 2.93Å; L189-M192 PolarHBondContact O-N 3.2Å; M192-S194 VanDerWaalsContact C-N 3.33Å; M192-S194 PolarHBondContact O-N 3.42Å; M192-F195 WeakPolarHBondContact O-CB 3.13Å; M192-F195 PolarHBondContact O-N 3.41Å; M192-F195 VanDerWaalsContact O-N 3.11Å; M192-L196 HydrophobicContact CE-CD1 4.27Å; M192-L196 HydrophobicContact CG-CD1 4.3Å; M192-L196 WeakPolarHBondContact O-CG 3.41Å; M192-L196 PolarHBondContact O-N 3.32Å
193	E	75.3	Confident	75.6	Confident	138 Å²	138	105.6 Å²	105.6	65%	0.645	50%	0.5	S	S	*	.	H	α-helix	trans	-59.7	-44.2	176.4	-173.2	177	-141.3	0	0	110.4	L189 F195 L196 D197	L189-E193 WeakPolarHBondContact O-CB 3.25Å; L189-E193 PolarHBondContact O-N 3.37Å; E193-F195 VanDerWaalsContact C-N 3.28Å; E193-F195 PolarHBondContact O-N 3.4Å; E193-L196 PolarHBondContact O-N 3.13Å; E193-D197 WeakPolarHBondContact O-CB 3.49Å; E193-D197 PolarHBondContact O-N 3.31Å
194	S	82.7	Confident	74.4	Confident	71 Å²	71	106.5 Å²	106.5	50%	0.497	52%	0.519	S	S	.	.	H	α-helix	trans	-66.8	-25.6	175.4	76.7	0	0	0	0	114.4	S190 E191 M192 E198	S190-S194 VanDerWaalsContact O-CB 3.28Å; S190-S194 WeakPolarHBondContact O-CB 3.45Å; S190-S194 PolarHBondContact O-N 3.48Å; S190-S194 PolarHBondContact O-OG 3Å; E191-S194 PolarHBondContact O-N 2.69Å; E191-S194 PolarHBondContact O-OG 3.09Å; M192-S194 VanDerWaalsContact C-N 3.33Å; M192-S194 PolarHBondContact O-N 3.42Å; S194-E198 WeakPolarHBondContact O-CB 3.37Å; S194-E198 PolarHBondContact O-N 3.15Å
195	F	84.8	Confident	73	Confident	132 Å²	132	110.5 Å²	110.5	58%	0.579	53%	0.532	S	S	*	.	H	α-helix	trans	-78.1	-42.8	176.8	176.5	-94.2	0	0	0	111.6	E191 M192 E193 E198 M199	E191-F195 WeakPolarHBondContact O-CB 3.35Å; E191-F195 PolarHBondContact O-N 3.26Å; M192-F195 WeakPolarHBondContact O-CB 3.13Å; M192-F195 PolarHBondContact O-N 3.41Å; M192-F195 VanDerWaalsContact O-N 3.11Å; E193-F195 VanDerWaalsContact C-N 3.28Å; E193-F195 PolarHBondContact O-N 3.4Å; F195-E198 PolarHBondContact O-N 3.47Å; F195-M199 HydrophobicContact CE1-CG 4.39Å; F195-M199 HydrophobicContact CZ-CG 4.45Å; F195-M199 PolarHBondContact O-N 3.1Å
196	L	77.8	Confident	71.7	Confident	84 Å²	84	106.3 Å²	106.3	44%	0.44	52%	0.521	S	S	.	.	H	α-helix	trans	-60.6	-49.3	170.6	-67.4	170.4	0	0	0	110	M192 E193 E198 M199 D200	M192-L196 HydrophobicContact CE-CD1 4.27Å; M192-L196 HydrophobicContact CG-CD1 4.3Å; M192-L196 WeakPolarHBondContact O-CG 3.41Å; M192-L196 PolarHBondContact O-N 3.32Å; E193-L196 PolarHBondContact O-N 3.13Å; L196-E198 PolarHBondContact O-N 3.41Å; L196-M199 CarbonylContact O-C 3.55Å; L196-M199 WeakPolarHBondContact O-CA 3.38Å; L196-M199 PolarHBondContact O-N 3.02Å; L196-D200 PolarHBondContact O-N 2.92Å; L196-D200 VanDerWaalsContact O-OD1 3.12Å
197	D	75.9	Confident	70.5	Confident	91 Å²	91	105.5 Å²	105.5	49%	0.487	53%	0.525	S	S	.	.	H	α-helix	trans	-63.7	-16.1	179	-161.9	44.4	0	0	0	113	E193 K201	E193-D197 WeakPolarHBondContact O-CB 3.49Å; E193-D197 PolarHBondContact O-N 3.31Å; D197-K201 WeakPolarHBondContact O-CD 3.26Å; D197-K201 VanDerWaalsContact O-CG 3.23Å; D197-K201 WeakPolarHBondContact O-CG 3.25Å; D197-K201 PolarHBondContact O-NZ 2.89Å; D197-K201 IonicContact OD1-NZ 2.8Å; D197-K201 PolarHBondContact OD1-NZ 3.37Å; D197-K201 IonicContact OD2-NZ 2.86Å; D197-K201 PolarHBondContact OD2-NZ 3.08Å
198	E	78.8	Confident	69.3	Low	108 Å²	108	108.5 Å²	108.5	51%	0.505	54%	0.54	S	S	.	.	H	α-helix	trans	-92.5	-27.5	170.8	178.2	68.6	-154.9	0	0	112.7	S194 F195 L196 R202	S194-E198 WeakPolarHBondContact O-CB 3.37Å; S194-E198 PolarHBondContact O-N 3.15Å; F195-E198 PolarHBondContact O-N 3.47Å; L196-E198 PolarHBondContact O-N 3.41Å; E198-R202 IonicContact OE1-NH2 3.26Å
199	M	74.2	Confident	67	Low	80 Å²	80	107.1 Å²	107.1	39%	0.394	55%	0.55	S	S	.	*	H	α-helix	trans	-76.1	-46.8	171.2	-89.7	-57.7	-152.6	0	0	112.3	F195 L196 K201 R202 E203	F195-M199 HydrophobicContact CE1-CG 4.39Å; F195-M199 HydrophobicContact CZ-CG 4.45Å; F195-M199 PolarHBondContact O-N 3.1Å; L196-M199 CarbonylContact O-C 3.55Å; L196-M199 WeakPolarHBondContact O-CA 3.38Å; L196-M199 PolarHBondContact O-N 3.02Å; M199-K201 PolarHBondContact O-N 3.49Å; M199-K201 VanDerWaalsContact O-N 3.15Å; M199-R202 CarbonylContact O-C 3.58Å; M199-R202 WeakPolarHBondContact O-CA 3.47Å; M199-R202 VanDerWaalsContact O-CB 3.28Å; M199-R202 WeakPolarHBondContact O-CB 3.22Å; M199-R202 PolarHBondContact O-N 3.25Å; M199-E203 PolarHBondContact O-N 3.26Å
200	D	71.8	Confident	65.5	Low	100 Å²	100	112.6 Å²	112.6	54%	0.535	57%	0.574	S	S	.	*	H	α-helix	trans	-56.8	-32.2	174.9	-69	23.7	0	0	0	111.5	L196 R202 G204	L196-D200 PolarHBondContact O-N 2.92Å; L196-D200 VanDerWaalsContact O-OD1 3.12Å; D200-R202 VanDerWaalsContact C-N 3.31Å; D200-G204 WeakPolarHBondContact O-CA 3.41Å; D200-G204 PolarHBondContact O-N 3.35Å
201	K	71.6	Confident	63.4	Low	96 Å²	96	117 Å²	117	42%	0.417	59%	0.594	S	S	.	*	H	α-helix	trans	-80.2	-5.8	174.5	-74.5	-176.8	-164.2	66.7	0	114.7	D197 M199 K205	D197-K201 WeakPolarHBondContact O-CD 3.26Å; D197-K201 VanDerWaalsContact O-CG 3.23Å; D197-K201 WeakPolarHBondContact O-CG 3.25Å; D197-K201 PolarHBondContact O-NZ 2.89Å; D197-K201 IonicContact OD1-NZ 2.8Å; D197-K201 PolarHBondContact OD1-NZ 3.37Å; D197-K201 IonicContact OD2-NZ 2.86Å; D197-K201 PolarHBondContact OD2-NZ 3.08Å; M199-K201 PolarHBondContact O-N 3.49Å; M199-K201 VanDerWaalsContact O-N 3.15Å; K201-K205 WeakPolarHBondContact O-CD 3.18Å; K201-K205 WeakPolarHBondContact O-CG 3.47Å
202	R	65.6	Low	61.6	Low	119 Å²	119	119.3 Å²	119.3	45%	0.449	61%	0.61	S	S	.	*	H	α-helix	trans	-100.9	-51.8	174.9	-169.9	177	-56.6	176.2	6.7	110.1	E198 M199 D200 K205 E206	E198-R202 IonicContact OE1-NH2 3.26Å; M199-R202 CarbonylContact O-C 3.58Å; M199-R202 WeakPolarHBondContact O-CA 3.47Å; M199-R202 VanDerWaalsContact O-CB 3.28Å; M199-R202 WeakPolarHBondContact O-CB 3.22Å; M199-R202 PolarHBondContact O-N 3.25Å; D200-R202 VanDerWaalsContact C-N 3.31Å; R202-K205 WeakPolarHBondContact O-CB 3.46Å; R202-K205 PolarHBondContact O-N 2.86Å; R202-E206 PolarHBondContact O-N 3.39Å
203	E	57.1	Low	59.6	Low	118 Å²	118	119.1 Å²	119.1	55%	0.551	61%	0.61	S	S	*	*	H	α-helix	trans	-59.5	-50.1	173.1	-169.1	163.1	-134.4	0	0	110.4	M199 K205 E206 D207	M199-E203 PolarHBondContact O-N 3.26Å; E203-K205 PolarHBondContact O-N 3.42Å; E203-E206 PolarHBondContact O-N 3.22Å; E203-D207 PolarHBondContact O-N 3.3Å
204	G	51.3	Low	58.3	Low	58 Å²	58	117.9 Å²	117.9	60%	0.598	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.5	17.8	171.1	0	0	0	0	0	116.1	D200	D200-G204 WeakPolarHBondContact O-CA 3.41Å; D200-G204 PolarHBondContact O-N 3.35Å
205	K	51.2	Low	56.6	Low	170 Å²	170	123.5 Å²	123.5	74%	0.739	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.8	-11.1	165.5	-86.2	-178.4	-172.2	152.4	0	113.6	K201 R202 E203	K201-K205 WeakPolarHBondContact O-CD 3.18Å; K201-K205 WeakPolarHBondContact O-CG 3.47Å; R202-K205 WeakPolarHBondContact O-CB 3.46Å; R202-K205 PolarHBondContact O-N 2.86Å; E203-K205 PolarHBondContact O-N 3.42Å
206	E	43.6	Very low	54.7	Low	124 Å²	124	126 Å²	126	58%	0.579	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.5	-17.1	177.1	-69.9	171.9	177.4	0	0	110.4	R202 E203 E208	R202-E206 PolarHBondContact O-N 3.39Å; E203-E206 PolarHBondContact O-N 3.22Å; E206-E208 PolarHBondContact O-N 3.41Å
207	D	44	Very low	53	Low	147 Å²	147	129 Å²	129	79%	0.786	64%	0.642	S	S	*	*			trans	-76.4	29.6	178.5	-156	31.1	0	0	0	116.1	E203	E203-D207 PolarHBondContact O-N 3.3Å
208	E	41.9	Very low	51.4	Low	202 Å²	202	131.3 Å²	131.3	94%	0.944	66%	0.655	S	S	*	*	S	Bend	trans	-118.5	34.2	161.8	-84.8	-164.4	168.3	0	0	110.7	E206	E206-E208 PolarHBondContact O-N 3.41Å
209	G	36.2	Very low	49.8	Very low	56 Å²	56	132.5 Å²	132.5	58%	0.577	67%	0.669	S	S	*	*			trans	-164.8	84.4	179.5	0	0	0	0	0	115.1	D211	G209-D211 PolarHBondContact O-N 3.28Å
210	E	47.1	Very low	48.1	Very low	203 Å²	203	134.1 Å²	134.1	95%	0.949	69%	0.685	S	S	*	*			trans	-56.3	103.2	167.9	-62.9	177.9	159.9	0	0	111.8
211	D	38	Very low	46.3	Very low	132 Å²	132	134.7 Å²	134.7	71%	0.706	70%	0.697	S	S	*	*	S	Bend	trans	-169.2	88.3	165.3	-136.1	21.3	0	0	0	111.2	G209	G209-D211 PolarHBondContact O-N 3.28Å
212	D	46.1	Very low	44.9	Very low	159 Å²	159	138 Å²	138	85%	0.85	72%	0.719	S	S	*	*			trans	32.6	90.2	166.9	-64.2	-22.9	0	0	0	118.4	D214	D212-D214 PolarHBondContact O-N 2.81Å
213	I	37.3	Very low	43.5	Very low	113 Å²	113	140.2 Å²	140.2	58%	0.579	74%	0.735	S	S	*	*			trans	-82.5	101.8	160.1	-60.4	-179.5	0	0	0	109	Y215	I213-Y215 HydrophobicContact CB-CE2 4.2Å; I213-Y215 HydrophobicContact CG2-CD2 4.11Å; I213-Y215 HydrophobicContact CG2-CE1 4.44Å; I213-Y215 HydrophobicContact CG2-CE2 3.86Å; I213-Y215 HydrophobicContact CG2-CG 4.5Å; I213-Y215 VanDerWaalsContact O-CD2 3.26Å; I213-Y215 WeakPolarHBondContact O-CD2 3.42Å; I213-Y215 PolarHBondContact O-N 3.34Å
214	D	47.4	Very low	42.5	Very low	112 Å²	112	141.6 Å²	141.6	60%	0.599	75%	0.746	S	S	*	*			trans	-82.1	93	176	-170.3	-8	0	0	0	110.3	D212 F216 Q217	D212-D214 PolarHBondContact O-N 2.81Å; D214-F216 PolarHBondContact O-N 3.34Å; D214-F216 PolarHBondContact OD1-N 2.93Å; D214-F216 VanDerWaalsContact OD1-N 3.17Å; D214-Q217 PolarHBondContact O-N 2.69Å
215	Y	46.6	Very low	41.7	Very low	189 Å²	189	145.9 Å²	145.9	74%	0.741	76%	0.755	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.2	-9.6	178.5	-68	-95.9	0	0	0	113.7	I213	I213-Y215 HydrophobicContact CB-CE2 4.2Å; I213-Y215 HydrophobicContact CG2-CD2 4.11Å; I213-Y215 HydrophobicContact CG2-CE1 4.44Å; I213-Y215 HydrophobicContact CG2-CE2 3.86Å; I213-Y215 HydrophobicContact CG2-CG 4.5Å; I213-Y215 VanDerWaalsContact O-CD2 3.26Å; I213-Y215 WeakPolarHBondContact O-CD2 3.42Å; I213-Y215 PolarHBondContact O-N 3.34Å
216	F	46.2	Very low	41.3	Very low	184 Å²	184	144.6 Å²	144.6	81%	0.807	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.4	14.4	173.5	-96.6	-88	0	0	0	113.7	D214 D218	D214-F216 PolarHBondContact O-N 3.34Å; D214-F216 PolarHBondContact OD1-N 2.93Å; D214-F216 VanDerWaalsContact OD1-N 3.17Å; F216-D218 PolarHBondContact O-N 3.4Å
217	Q	42	Very low	40.8	Very low	148 Å²	148	146.4 Å²	146.4	69%	0.692	77%	0.769	S	S	*	*			trans	-72.2	97.2	173.1	-161.9	-167.6	-90	0	0	111.3	D214 V219	D214-Q217 PolarHBondContact O-N 2.69Å; Q217-V219 PolarHBondContact O-N 2.98Å
218	D	41.6	Very low	40.8	Very low	140 Å²	140	146 Å²	146	75%	0.749	77%	0.767	S	S	*	*			trans	-38.1	130	175.3	-64.7	-51.9	0	0	0	113.1	F216	F216-D218 PolarHBondContact O-N 3.4Å
219	V	46.2	Very low	40.7	Very low	132 Å²	132	143 Å²	143	80%	0.8	76%	0.757	S	S	*	*			trans	-58	132.2	166.1	-178.1	0	0	0	0	107.4	Q217 S221	Q217-V219 PolarHBondContact O-N 2.98Å; V219-S221 PolarHBondContact O-N 3.15Å
220	P	38.4	Very low	41.1	Very low	115 Å²	115	147.5 Å²	147.5	75%	0.747	77%	0.768	S	S	*	*			trans	-57.3	115.8	178.9	-24.4	34.3	0	0	0	110.6	D222	P220-D222 PolarHBondContact O-N 3.44Å
221	S	33.3	Very low	40.8	Very low	112 Å²	112	146.3 Å²	146.3	78%	0.783	76%	0.762	S	S	*	*			trans	-62	120.1	170.1	-163	0	0	0	0	108	V219 E223	V219-S221 PolarHBondContact O-N 3.15Å; S221-E223 PolarHBondContact O-N 3.02Å
222	D	41.3	Very low	40.9	Very low	164 Å²	164	145.9 Å²	145.9	88%	0.877	76%	0.759	S	S	*	*			trans	-91.6	93.3	-172.2	-162.6	36.3	0	0	0	109.1	P220	P220-D222 PolarHBondContact O-N 3.44Å
223	E	36.5	Very low	40.5	Very low	166 Å²	166	145.4 Å²	145.4	78%	0.776	75%	0.753	S	S	*	*			trans	-139.8	131.2	172.7	-101.5	175.2	165.3	0	0	110.1	S221	S221-E223 PolarHBondContact O-N 3.02Å
224	D	35.8	Very low	40.5	Very low	147 Å²	147	144.8 Å²	144.8	79%	0.786	76%	0.759	S	S	*	*	S	Bend	trans	68	65.5	167.5	-59.3	0.3	0	0	0	119.3
225	D	35.9	Very low	40.1	Very low	149 Å²	149	144.5 Å²	144.5	80%	0.797	77%	0.766	S	S	*	*				93.2	150	112.8	-86.2	-18.6	0	0	0	124.4
226	D	42.2	Very low	39.9	Very low	143 Å²	143	144.6 Å²	144.6	77%	0.765	77%	0.77	S	S	*	*			trans	59.3	88.2	166	-76.7	-21.7	0	0	0	119.4
227	L	32.9	Very low	39.3	Very low	161 Å²	161	144.1 Å²	144.1	84%	0.843	77%	0.77	S	S	*	*	S	Bend		-170.1	113	128.3	-116.3	143.4	0	0	0	115.2
228	D	43.1	Very low	39	Very low	138 Å²	138	146.2 Å²	146.2	74%	0.738	78%	0.777	S	S	*	*			trans	47.9	78.3	152.4	-57.3	-26.1	0	0	0	119.8	D230	D228-D230 PolarHBondContact O-N 3.41Å
229	L	41.1	Very low	38.5	Very low	139 Å²	139	149.7 Å²	149.7	73%	0.728	79%	0.786	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.4	-18.9	174.1	-175.1	57.2	0	0	0	114.9	E231	L229-E231 PolarHBondContact O-N 2.76Å
230	D	43.7	Very low	38.1	Very low	152 Å²	152	152.9 Å²	152.9	81%	0.813	79%	0.789	S	S	*	*	H	α-helix	trans	-66.1	-28.5	-172	-87.1	-29	0	0	0	114.8	D228 I232	D228-D230 PolarHBondContact O-N 3.41Å; D230-I232 PolarHBondContact O-N 3.37Å
231	E	42.1	Very low	37.8	Very low	177 Å²	177	155.2 Å²	155.2	83%	0.827	80%	0.795	S	S	*	*	H	α-helix	trans	-75.5	-23.7	-173.6	-163.9	167.9	-163.3	0	0	113.1	L229	L229-E231 PolarHBondContact O-N 2.76Å
232	I	39.5	Very low	37.9	Very low	124 Å²	124	158.2 Å²	158.2	64%	0.636	80%	0.799	S	S	*	*	H	α-helix	trans	-77.6	-39.9	-179.1	-73.5	175.5	0	0	0	112	D230 S234 S235	D230-I232 PolarHBondContact O-N 3.37Å; I232-S234 VanDerWaalsContact C-N 3.26Å; I232-S234 PolarHBondContact O-N 3.45Å; I232-S235 PolarHBondContact O-N 3.01Å; I232-S235 PolarHBondContact O-OG 3.38Å
233	M	37.5	Very low	37.8	Very low	148 Å²	148	155.3 Å²	155.3	73%	0.729	80%	0.797	S	S	*	*	H	α-helix	trans	-67	-23.6	-174.8	-73.1	-68	-78.7	0	0	113.7	S235	M233-S235 PolarHBondContact O-N 3.07Å
234	S	36.2	Very low	38.1	Very low	101 Å²	101	155.5 Å²	155.5	71%	0.706	80%	0.795	S	S	*	*	G	3₁₀ helix	trans	-60.7	-24.4	178.1	-170.2	0	0	0	0	113.9	I232	I232-S234 VanDerWaalsContact C-N 3.26Å; I232-S234 PolarHBondContact O-N 3.45Å
235	S	39.6	Very low	39.1	Very low	106 Å²	106	152.5 Å²	152.5	74%	0.741	79%	0.786	S	S	*	*	G	3₁₀ helix	trans	-85.5	-6.5	-168.7	66.1	0	0	0	0	116	I232 M233	I232-S235 PolarHBondContact O-N 3.01Å; I232-S235 PolarHBondContact O-OG 3.38Å; M233-S235 PolarHBondContact O-N 3.07Å
236	K	42	Very low	40	Very low	190 Å²	190	150.4 Å²	150.4	83%	0.826	78%	0.783	S	S	*	*	G	3₁₀ helix	trans	-114.1	23.4	-170.1	-149.3	171.4	-178.4	176.9	0	115.8	K238	K236-K238 PolarHBondContact O-N 2.86Å
237	E	34.7	Very low	40.9	Very low	175 Å²	175	154.4 Å²	154.4	82%	0.818	79%	0.787	S	S	*	*			trans	-68	94.4	168	-80.7	-146.5	134.9	0	0	112.5
238	K	35.2	Very low	41.7	Very low	192 Å²	192	152.8 Å²	152.8	84%	0.835	78%	0.78	S	S	*	*			trans	174.3	90.9	130.8	-92.6	149.5	-166	156.9	0	113.7	K236	K236-K238 PolarHBondContact O-N 2.86Å
239	K	31	Very low	43.1	Very low	213 Å²	213	152.2 Å²	152.2	93%	0.926	78%	0.776	S	S	*	*				-170.2	126.9	127.3	-102.3	163	-175.3	-179.6	0	108.1
240	K	38.2	Very low	44.8	Very low	199 Å²	199	153.4 Å²	153.4	87%	0.865	78%	0.775	S	S	*	*			trans	-77.6	139.9	173.6	-67.7	-177.4	175.9	-175.2	0	109.3
241	N	32.7	Very low	45.2	Very low	163 Å²	163	154.4 Å²	154.4	87%	0.872	77%	0.769	S	S	*	*				-159.7	169.7	125.3	-92.9	-14.6	0	0	0	109.2
242	M	34.2	Very low	46.1	Very low	176 Å²	176	155 Å²	155	87%	0.867	77%	0.768	S	S	*	*			trans	-61.9	132.5	-158.5	-67.5	160.6	60.6	0	0	114.4
243	A	39.1	Very low	47.4	Very low	102 Å²	102	153.9 Å²	153.9	84%	0.843	76%	0.764	S	S	*	*			trans	-79.7	130.4	164.8	0	0	0	0	0	110.3
244	K	44.6	Very low	48.6	Very low	170 Å²	170	154.9 Å²	154.9	74%	0.739	76%	0.764	S	S	*	*			trans	-107.8	144.3	157	-71.1	-178.7	177.8	178.6	0	107.6
245	S	55.7	Low	49.8	Very low	84 Å²	84	155.1 Å²	155.1	59%	0.587	75%	0.753	S	S	*	*			trans	-67.5	142.6	178.8	-174.7	0	0	0	0	111.1	R247 N248	S245-R247 PolarHBondContact O-N 2.93Å; S245-N248 PolarHBondContact O-N 2.77Å; S245-N248 VanDerWaalsContact O-N 3.11Å
246	S	55.7	Low	50.5	Low	105 Å²	105	155.8 Å²	155.8	73%	0.734	75%	0.748	S	S	*	*	G	3₁₀ helix	trans	-58.6	-17.9	-177.9	49.2	0	0	0	0	114.2	N248	S246-N248 VanDerWaalsContact C-N 3.31Å; S246-N248 PolarHBondContact O-N 3.38Å
247	R	61	Low	50.7	Low	228 Å²	228	150.7 Å²	150.7	86%	0.86	74%	0.741	S	S	*	*	G	3₁₀ helix	trans	-78.4	-7.5	178.8	-150.6	171.3	-177.7	94.9	-2.8	114.6	S245	S245-R247 PolarHBondContact O-N 2.93Å
248	N	49.4	Very low	51.1	Low	127 Å²	127	151.9 Å²	151.9	68%	0.679	75%	0.749	S	S	*	*	G	3₁₀ helix	trans	-112.4	7.9	-176.2	-78.8	27.5	0	0	0	114.8	S245 S246	S245-N248 PolarHBondContact O-N 2.77Å; S245-N248 VanDerWaalsContact O-N 3.11Å; S246-N248 VanDerWaalsContact C-N 3.31Å; S246-N248 PolarHBondContact O-N 3.38Å
249	L	72.8	Confident	51	Low	126 Å²	126	150.2 Å²	150.2	66%	0.66	75%	0.75	S	S	*	*			trans	-71.9	125.9	175	-68.5	163.5	0	0	0	110	D253	L249-D253 HydrophobicContact CD2-CB 4.13Å
250	K	75.3	Confident	51.3	Low	163 Å²	163	143.8 Å²	143.8	71%	0.709	74%	0.743	S	S	*	*			trans	-105.6	163.4	172.4	-69.2	-170.8	177.7	-177.2	0	110.2	K252 D253	K250-K252 PolarHBondContact O-N 3.27Å; K250-D253 PolarHBondContact N-OD2 3.07Å; K250-D253 WeakPolarHBondContact O-CB 3.49Å; K250-D253 PolarHBondContact O-N 2.88Å
251	Y	53.2	Low	51	Low	174 Å²	174	137.2 Å²	137.2	68%	0.682	73%	0.733	S	S	*	*	H	α-helix	trans	-52.7	-32.6	-176.4	-165.7	-93.5	0	0	0	114	D253 F254 F255	Y251-D253 VanDerWaalsContact C-N 3.31Å; Y251-D253 PolarHBondContact O-N 3.46Å; Y251-F254 PolarHBondContact O-N 3.11Å; Y251-F255 HydrophobicContact CD1-CB 4.41Å; Y251-F255 AromaticContact CD1-CD2 3.92Å; Y251-F255 HydrophobicContact CD1-CD2 3.92Å; Y251-F255 HydrophobicContact CD2-CD2 4.03Å; Y251-F255 HydrophobicContact CD2-CE2 4.22Å; Y251-F255 HydrophobicContact CE1-CB 4.1Å; Y251-F255 AromaticContact CE1-CD2 3.47Å; Y251-F255 HydrophobicContact CE1-CD2 3.47Å; Y251-F255 VanDerWaalsContact CE1-CD2 3.47Å; Y251-F255 HydrophobicContact CE1-CE2 4.19Å; Y251-F255 HydrophobicContact CE1-CG 4.04Å; Y251-F255 AromaticContact CE2-CD2 3.61Å; Y251-F255 HydrophobicContact CE2-CD2 3.61Å; Y251-F255 AromaticContact CE2-CE2 3.55Å; Y251-F255 HydrophobicContact CE2-CE2 3.55Å; Y251-F255 HydrophobicContact CG-CD2 4.18Å; Y251-F255 AromaticContact CZ-CD2 3.3Å; Y251-F255 AromaticContact CZ-CE2 3.53Å; Y251-F255 PolarHBondContact O-N 2.95Å
252	K	60.3	Low	51.3	Low	189 Å²	189	135.6 Å²	135.6	82%	0.822	73%	0.731	S	S	*	*	H	α-helix	trans	-70.4	-17.3	175.6	-66.5	-173.2	176	-174.7	0	114.9	K250 F254	K250-K252 PolarHBondContact O-N 3.27Å; K252-F254 VanDerWaalsContact C-N 3.31Å
253	D	67.6	Low	51.2	Low	101 Å²	101	131.7 Å²	131.7	54%	0.54	73%	0.727	S	S	.	*	H	α-helix	trans	-81.3	-14.7	172.2	-58.8	-64.9	0	0	0	111.9	L249 K250 Y251	L249-D253 HydrophobicContact CD2-CB 4.13Å; K250-D253 PolarHBondContact N-OD2 3.07Å; K250-D253 WeakPolarHBondContact O-CB 3.49Å; K250-D253 PolarHBondContact O-N 2.88Å; Y251-D253 VanDerWaalsContact C-N 3.31Å; Y251-D253 PolarHBondContact O-N 3.46Å
254	F	62.2	Low	50.8	Low	168 Å²	168	135.9 Å²	135.9	74%	0.737	73%	0.726	S	S	*	*	H	α-helix	trans	-108.1	-33.7	-177.9	-161.3	-81.8	0	0	0	112.5	Y251 K252	Y251-F254 PolarHBondContact O-N 3.11Å; K252-F254 VanDerWaalsContact C-N 3.31Å
255	F	61.8	Low	50.1	Low	106 Å²	106	135.4 Å²	135.4	47%	0.465	73%	0.73	S	S	.	*	S	Bend	trans	-120	108.2	175.1	-63.1	-78.2	0	0	0	110.2	Y251	Y251-F255 HydrophobicContact CD1-CB 4.41Å; Y251-F255 AromaticContact CD1-CD2 3.92Å; Y251-F255 HydrophobicContact CD1-CD2 3.92Å; Y251-F255 HydrophobicContact CD2-CD2 4.03Å; Y251-F255 HydrophobicContact CD2-CE2 4.22Å; Y251-F255 HydrophobicContact CE1-CB 4.1Å; Y251-F255 AromaticContact CE1-CD2 3.47Å; Y251-F255 HydrophobicContact CE1-CD2 3.47Å; Y251-F255 VanDerWaalsContact CE1-CD2 3.47Å; Y251-F255 HydrophobicContact CE1-CE2 4.19Å; Y251-F255 HydrophobicContact CE1-CG 4.04Å; Y251-F255 AromaticContact CE2-CD2 3.61Å; Y251-F255 HydrophobicContact CE2-CD2 3.61Å; Y251-F255 AromaticContact CE2-CE2 3.55Å; Y251-F255 HydrophobicContact CE2-CE2 3.55Å; Y251-F255 HydrophobicContact CG-CD2 4.18Å; Y251-F255 AromaticContact CZ-CD2 3.3Å; Y251-F255 AromaticContact CZ-CE2 3.53Å; Y251-F255 PolarHBondContact O-N 2.95Å
256	D	54.2	Low	48.9	Very low	121 Å²	121	137.9 Å²	137.9	65%	0.647	74%	0.736	S	S	*	*			trans	-65.8	136.3	168.5	-162	5.7	0	0	0	109.1	R185 M258	R185-D256 IonicContact CZ-OD2 2.65Å; R185-D256 IonicContact NH1-OD2 2.77Å; R185-D256 PolarHBondContact NH1-OD2 3.36Å; D256-M258 PolarHBondContact O-N 2.84Å
257	A	46	Very low	47.6	Very low	82 Å²	82	141.9 Å²	141.9	68%	0.678	74%	0.744	S	S	*	*			trans	-78.3	123.6	-171.7	0	0	0	0	0	110.4	D259	A257-D259 PolarHBondContact O-N 3.49Å; A257-D259 VanDerWaalsContact O-N 3.08Å
258	M	42.3	Very low	46.1	Very low	201 Å²	201	139.4 Å²	139.4	99%	0.99	74%	0.742	S	S	*	*			trans	-60.5	111.8	173	-80.7	-178.2	153.4	0	0	110.7	D256	D256-M258 PolarHBondContact O-N 2.84Å
259	D	34.6	Very low	45.1	Very low	157 Å²	157	138.8 Å²	138.8	84%	0.84	75%	0.747	S	S	*	*			trans	-123	144.3	167.2	-170.2	21.4	0	0	0	111.2	A257 G261	A257-D259 PolarHBondContact O-N 3.49Å; A257-D259 VanDerWaalsContact O-N 3.08Å; D259-G261 VanDerWaalsContact C-N 3.31Å; D259-G261 PolarHBondContact O-N 2.91Å; D259-G261 VanDerWaalsContact O-N 3.09Å
260	G	35.6	Very low	43	Very low	77 Å²	77	139.6 Å²	139.6	79%	0.794	75%	0.752	S	S	*	*			trans	-83.4	27	-159.1	0	0	0	0	0	117
261	G	32	Very low	40.8	Very low	62 Å²	62	138.5 Å²	138.5	64%	0.639	75%	0.754	S	S	*	*			trans	60.6	-162.6	178.3	0	0	0	0	0	115.1	D259	D259-G261 VanDerWaalsContact C-N 3.31Å; D259-G261 PolarHBondContact O-N 2.91Å; D259-G261 VanDerWaalsContact O-N 3.09Å
262	P	39.8	Very low	39.8	Very low	128 Å²	128	136.8 Å²	136.8	83%	0.831	76%	0.757	S	S	*	*			cis	-113.9	144.2	-15.3	37.4	-25.9	0	0	0	113.3
263	A	32.5	Very low	38.5	Very low	95 Å²	95	134.1 Å²	134.1	79%	0.785	75%	0.752	S	S	*	*			trans	16.7	120.6	162.1	0	0	0	0	0	120.9
264	K	30.2	Very low	36.8	Very low	190 Å²	190	135.7 Å²	135.7	83%	0.826	76%	0.76	S	S	*	*				-178.5	147.2	107.2	-102.8	178.7	-172.9	-175.7	0	116.6
265	I	28.8	Very low	35.3	Very low	159 Å²	159	133.9 Å²	133.9	82%	0.815	76%	0.758	S	S	*	*			trans	72.9	146.7	148.2	-66.8	166.3	0	0	0	117.8
266	N	31.3	Very low	33.9	Very low	137 Å²	137	135.3 Å²	135.3	73%	0.733	77%	0.77	S	S	*	*			trans	-100.8	135.6	-175.8	153.9	114	0	0	0	110.5
267	E	29.2	Very low	32.9	Very low	189 Å²	189	137.5 Å²	137.5	88%	0.883	78%	0.777	S	S	*	*			trans	-158.3	171.5	151.2	-127.5	161.3	-137	0	0	112.2
268	Q	29.8	Very low	32.2	Very low	175 Å²	175	141.1 Å²	141.1	82%	0.818	78%	0.782	S	S	*	*			trans	-105.3	152.8	-173.7	-63.1	165.6	-122.7	0	0	112.1
269	S	27.3	Very low	31.5	Very low	115 Å²	115	139.7 Å²	139.7	80%	0.804	77%	0.772	S	S	*	*			trans	-175.4	176.7	136.4	50.4	0	0	0	0	111.5
270	D	28.6	Very low	31.2	Very low	142 Å²	142	138.7 Å²	138.7	76%	0.759	77%	0.767	S	S	*	*			trans	-112.8	-166.7	-158.3	-49.1	-92.2	0	0	0	114.6
271	D	30.3	Very low	30.9	Very low	140 Å²	140	141 Å²	141	75%	0.749	76%	0.76	S	S	*	*			trans	79.3	109.1	158.2	-58.5	-5.3	0	0	0	122.1
272	D	31.8	Very low	30.7	Very low	139 Å²	139	145.8 Å²	145.8	74%	0.743	77%	0.766	S	S	*	*				83.5	154.7	113.8	-63.7	-7.4	0	0	0	126.6
273	D	32.6	Very low	30.1	Very low	132 Å²	132	146.2 Å²	146.2	71%	0.706	76%	0.761	S	S	*	*			trans	73.6	106.3	157.7	-62.5	-6.7	0	0	0	124.3
274	D	31.5	Very low	30.2	Very low	134 Å²	134	150.1 Å²	150.1	72%	0.717	76%	0.763	S	S	*	*				95	143.2	113.6	-69.6	-7.9	0	0	0	126.6
275	D	31.6	Very low	30.3	Very low	131 Å²	131	144.5 Å²	144.5	70%	0.701	76%	0.759	S	S	*	*			trans	72.9	95.1	143.5	-72.2	7.9	0	0	0	124.3
276	D	32.3	Very low	30.4	Very low	135 Å²	135	146 Å²	146	72%	0.722	76%	0.762	S	S	*	*				98.7	152.3	100.5	-103.5	-10.8	0	0	0	125.4
277	E	31.8	Very low	30.4	Very low	168 Å²	168	147.6 Å²	147.6	79%	0.785	77%	0.765	S	S	*	*			trans	41.3	130.1	162.1	-60.8	-174.9	147	0	0	120.6
278	M	32	Very low	30.4	Very low	158 Å²	158	147.2 Å²	147.2	78%	0.778	76%	0.764	S	S	*	*			cis	99.8	134.3	33.1	-83.1	-73.2	-78.2	0	0	115.4
279	E	28.5	Very low	30.4	Very low	170 Å²	170	145.4 Å²	145.4	79%	0.794	76%	0.76	S	S	*	*			trans	61.5	161.8	165.7	-64.2	-176.5	169.2	0	0	120.3
280	D	27.7	Very low	30.5	Very low	137 Å²	137	147.6 Å²	147.6	73%	0.733	76%	0.755	S	S	*	*				-166.5	178.9	-55.1	-144.3	-28.9	0	0	0	110.3
281	I	28.6	Very low	30.5	Very low	124 Å²	124	146.3 Å²	146.3	64%	0.636	75%	0.748	S	S	*	*			trans	78.3	117.8	144.2	-76.8	163.1	0	0	0	121.7
282	Q	28.4	Very low	30.6	Very low	163 Å²	163	147.8 Å²	147.8	76%	0.762	75%	0.751	S	S	*	*			trans	67.7	157.7	144.4	-73.7	169	-26.3	0	0	120.2
283	D	27.5	Very low	30.6	Very low	138 Å²	138	149.6 Å²	149.6	74%	0.738	75%	0.754	S	S	*	*			cis	-147.5	175.3	28.7	-155.5	10.5	0	0	0	116.5
284	E	34.9	Very low	30.5	Very low	177 Å²	177	151.8 Å²	151.8	83%	0.827	76%	0.761	S	S	*	*			trans	-77.1	-178.9	-178.2	-59.4	168.9	179.4	0	0	113.5
285	G	31	Very low	30.5	Very low	71 Å²	71	154.2 Å²	154.2	73%	0.732	77%	0.767	S	S	*	*			cis	-142.7	-147.8	-5.2	0	0	0	0	0	108.9
286	E	30.8	Very low	30.5	Very low	190 Å²	190	155.8 Å²	155.8	89%	0.888	78%	0.776	S	S	*	*			cis	-148.4	145	-3	-63.7	174.1	105.3	0	0	105.5
287	E	31.4	Very low	30.6	Very low	171 Å²	171	156.3 Å²	156.3	80%	0.799	78%	0.779	S	S	*	*				43	141.9	84.7	-45.4	-58.8	-179.5	0	0	115.8
288	E	29.3	Very low	30.5	Very low	182 Å²	182	154.5 Å²	154.5	85%	0.85	78%	0.775	S	S	*	*			cis	-163.5	-169.4	13.5	-136.7	173.2	-138.8	0	0	108.1
289	D	30	Very low	30.5	Very low	137 Å²	137	154.1 Å²	154.1	73%	0.733	78%	0.776	S	S	*	*				-147.4	-176.5	-93.5	-165.3	6.6	0	0	0	111.2
290	F	29.4	Very low	30.5	Very low	160 Å²	160	149.5 Å²	149.5	70%	0.702	77%	0.774	S	S	*	*			trans	90.1	132.6	152.5	-104.5	-117.3	0	0	0	125.8
291	D	29.8	Very low	30.6	Very low	116 Å²	116	151.4 Å²	151.4	62%	0.62	78%	0.784	S	S	*	*			trans	58.4	151	145.5	-77	6.7	0	0	0	124.5
292	E	31.6	Very low	30.6	Very low	171 Å²	171	148.4 Å²	148.4	80%	0.799	78%	0.784	S	S	*	*			cis	-159.1	-173.5	-28.6	-148.3	-178.5	-166.5	0	0	108.3
293	E	31.2	Very low	30.7	Very low	176 Å²	176	144.5 Å²	144.5	82%	0.822	79%	0.787	S	S	*	*			trans	-83.3	166.7	-164.1	-56.2	176.8	156.9	0	0	116.5
294	E	30.9	Very low	30.9	Very low	179 Å²	179	143.6 Å²	143.6	84%	0.836	79%	0.792	S	S	*	*				-177.4	155.2	127.5	-98.4	-73.3	-157.5	0	0	112.1
295	E	32.6	Very low	31	Very low	184 Å²	184	140.9 Å²	140.9	86%	0.86	79%	0.789	S	S	*	*			trans	-104.6	155.2	-174.7	-59	-176.5	136.1	0	0	113.9
296	D	30.6	Very low	31.1	Very low	164 Å²	164	142.9 Å²	142.9	88%	0.877	79%	0.792	S	S	*	*				-173	158.6	129.8	-153.8	-3.6	0	0	0	111.1
297	D	34.3	Very low	31.2	Very low	147 Å²	147	143.8 Å²	143.8	79%	0.786	79%	0.793	S	S	*	*			trans	-87.1	155	-168.7	-89.9	-48.3	0	0	0	116.1
298	N	29.8	Very low	31.4	Very low	130 Å²	130	140 Å²	140	70%	0.695	79%	0.791	S	S	*	*				156.4	131.5	101.4	-167.5	77.1	0	0	0	115.5
299	D	32.2	Very low	31.7	Very low	149 Å²	149	136 Å²	136	80%	0.797	78%	0.784	S	S	*	*			trans	41.2	125.6	163	-68.4	-41.2	0	0	0	121.7
300	G	28.9	Very low	32	Very low	73 Å²	73	140.4 Å²	140.4	75%	0.753	79%	0.79	S	S	*	*			trans	175.1	49.9	163	0	0	0	0	0	123.1
301	D	28.9	Very low	32.7	Very low	177 Å²	177	142.4 Å²	142.4	95%	0.947	80%	0.798	S	S	*	*			trans	64.3	166	157.8	-166.9	29.6	0	0	0	118.8
302	G	29.6	Very low	33	Very low	62 Å²	62	146.6 Å²	146.6	64%	0.639	81%	0.811	S	S	*	*			trans	88.3	82.9	158.5	0	0	0	0	0	118.1
303	G	29.9	Very low	33.5	Very low	81 Å²	81	145 Å²	145	84%	0.835	81%	0.812	S	S	*	*			trans	-48.2	141.8	-177.1	0	0	0	0	0	118.5
304	S	31.6	Very low	33.6	Very low	118 Å²	118	142.5 Å²	142.5	83%	0.825	81%	0.81	S	S	*	*			trans	-74.2	138	180	178.5	0	0	0	0	114.2
305	P	36.4	Very low	33.8	Very low	120 Å²	120	142.9 Å²	142.9	78%	0.779	81%	0.809	S	S	*	*			trans	-107.4	113.8	163.7	34.8	-25.1	0	0	0	112
306	S	32.9	Very low	34.1	Very low	114 Å²	114	139.5 Å²	139.5	80%	0.797	80%	0.797	S	S	*	*			trans	-75.3	154.9	175.3	56.3	0	0	0	0	113.3
307	K	33.8	Very low	34.9	Very low	208 Å²	208	140.2 Å²	140.2	90%	0.904	80%	0.799	S	S	*	*			trans	-113.1	153	159.2	-63.8	171	-173	163.1	0	106.4
308	A	35.3	Very low	35.2	Very low	92 Å²	92	137.1 Å²	137.1	76%	0.76	79%	0.79	S	S	*	*			cis	-132.8	168	12.5	0	0	0	0	0	110.1
309	S	36.6	Very low	36.1	Very low	99 Å²	99	134.7 Å²	134.7	69%	0.692	80%	0.795	S	S	*	*				-179.6	-176.6	60.8	56.8	0	0	0	0	112.8
310	R	34.7	Very low	36.1	Very low	229 Å²	229	136.9 Å²	136.9	86%	0.864	80%	0.801	S	S	*	*			trans	86.3	124.6	168.3	-56.2	175.3	-179.7	-160.2	-3.6	117.4
311	K	45.4	Very low	36.6	Very low	202 Å²	202	142.1 Å²	142.1	88%	0.878	81%	0.805	S	S	*	*			trans	44.3	84.5	150.3	-59.3	-176.9	-179.7	-178	0	117.7
312	K	36.2	Very low	36.9	Very low	204 Å²	204	141.6 Å²	141.6	89%	0.887	80%	0.803	S	S	*	*			trans	-86.6	111.1	153.2	-71	-168.1	175	-169.2	0	109.9
313	V	40.4	Very low	37.5	Very low	136 Å²	136	143 Å²	143	82%	0.824	80%	0.803	S	S	*	*			trans	-84	109.8	156.7	176.5	0	0	0	0	106.5	F315	V313-F315 PolarHBondContact O-N 3.16Å
314	T	33.6	Very low	38.2	Very low	125 Å²	125	147.9 Å²	147.9	77%	0.767	80%	0.804	S	S	*	*			trans	-79.2	107.6	165	45.6	0	0	0	0	107.6	D316	T314-D316 PolarHBondContact O-N 3.21Å
315	F	35.1	Very low	38.4	Very low	186 Å²	186	145.8 Å²	145.8	82%	0.816	80%	0.801	S	S	*	*			trans	-64.6	125.7	172	-164.6	-88	0	0	0	108.7	V313	V313-F315 PolarHBondContact O-N 3.16Å
316	D	38.7	Very low	38.7	Very low	114 Å²	114	148.8 Å²	148.8	61%	0.61	80%	0.804	S	S	*	*			trans	-76.9	144.2	-176.9	-156.1	-45.3	0	0	0	110.1	T314 S318	T314-D316 PolarHBondContact O-N 3.21Å; D316-S318 PolarHBondContact O-N 3.13Å; D316-S318 VanDerWaalsContact O-N 3.11Å; D316-S318 PolarHBondContact OD1-OG 2.78Å
317	L	48.1	Very low	39	Very low	178 Å²	178	150.5 Å²	150.5	93%	0.932	81%	0.805	S	S	*	*	S	Bend	trans	-88.1	56.3	174.3	-81.7	172.1	0	0	0	110.1
318	S	41.5	Very low	39.7	Very low	83 Å²	83	148.7 Å²	148.7	58%	0.58	80%	0.802	S	S	*	*			trans	-146.4	113.3	177.8	48.7	0	0	0	0	112.8	D316	D316-S318 PolarHBondContact O-N 3.13Å; D316-S318 VanDerWaalsContact O-N 3.11Å; D316-S318 PolarHBondContact OD1-OG 2.78Å
319	G	47.5	Very low	40.3	Very low	79 Å²	79	152.6 Å²	152.6	81%	0.814	80%	0.804	S	S	*	*			trans	66.1	81.2	151.2	0	0	0	0	0	118.1
320	E	33.2	Very low	41	Very low	194 Å²	194	157.1 Å²	157.1	91%	0.907	81%	0.814	S	S	*	*			trans	-134.3	115	131	-124.7	163.2	-150.8	0	0	108.7	D322	E320-D322 PolarHBondContact O-N 3.42Å
321	E	39.2	Very low	41.9	Very low	183 Å²	183	151.9 Å²	151.9	86%	0.855	81%	0.808	S	S	*	*			trans	-71.2	117.6	163.8	-71.8	169.6	107.9	0	0	106.4	S323	E321-S323 PolarHBondContact O-N 3.28Å
322	D	35.3	Very low	41.8	Very low	167 Å²	167	151.6 Å²	151.6	89%	0.893	81%	0.807	S	S	*	*			trans	-68.4	79.7	160.9	-173.1	25.5	0	0	0	107	E320 E324	E320-D322 PolarHBondContact O-N 3.42Å; D322-E324 PolarHBondContact O-N 3.23Å
323	S	41	Very low	42.4	Very low	91 Å²	91	146.1 Å²	146.1	64%	0.636	81%	0.809	S	S	*	*			trans	-55.6	123.7	-176.9	178.6	0	0	0	0	108.2	E321 G325	E321-S323 PolarHBondContact O-N 3.28Å; S323-G325 PolarHBondContact O-N 2.91Å
324	E	45.8	Very low	42.2	Very low	184 Å²	184	142.9 Å²	142.9	86%	0.86	80%	0.803	S	S	*	*			trans	-55.2	109.9	169.5	-72.7	-161.1	124.5	0	0	107.7	D322 E326	D322-E324 PolarHBondContact O-N 3.23Å; E324-E326 VanDerWaalsContact C-N 3.31Å; E324-E326 PolarHBondContact O-N 3Å
325	G	36.3	Very low	42.8	Very low	74 Å²	74	147 Å²	147	76%	0.763	81%	0.81	S	S	*	*			trans	-69	89.2	-180	0	0	0	0	0	109.5	S323 D327	S323-G325 PolarHBondContact O-N 2.91Å; G325-D327 PolarHBondContact O-N 3.43Å
326	E	43	Very low	42.7	Very low	182 Å²	182	144.9 Å²	144.9	85%	0.85	81%	0.813	S	S	*	*			trans	-59.1	124.7	165.5	-68.5	-164	140.6	0	0	108.6	E324 M328	E324-E326 VanDerWaalsContact C-N 3.31Å; E324-E326 PolarHBondContact O-N 3Å; E326-M328 PolarHBondContact O-N 3.17Å
327	D	39.2	Very low	42.9	Very low	150 Å²	150	144.6 Å²	144.6	80%	0.802	82%	0.82	S	S	*	*			trans	-66.3	108.5	-169.9	-147.7	-14.4	0	0	0	109.9	G325 E329	G325-D327 PolarHBondContact O-N 3.43Å; D327-E329 PolarHBondContact O-N 3.21Å
328	M	48.4	Very low	42.5	Very low	171 Å²	171	141.7 Å²	141.7	84%	0.842	81%	0.814	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.4	18	-159.6	-155.9	-179.4	176.7	0	0	114.4	E326	E326-M328 PolarHBondContact O-N 3.17Å
329	E	46.9	Very low	42.1	Very low	173 Å²	173	143.9 Å²	143.9	81%	0.808	83%	0.83	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.5	-22.3	-179.8	-99.5	-169.1	163.8	0	0	115.1	D327 T331	D327-E329 PolarHBondContact O-N 3.21Å; E329-T331 PolarHBondContact O-N 2.94Å; E329-T331 VanDerWaalsContact O-N 3.08Å
330	E	51.3	Low	41.8	Very low	195 Å²	195	149.4 Å²	149.4	91%	0.911	83%	0.834	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	8.3	-175.8	-143.2	-175.2	-175.1	0	0	114.7
331	T	52.9	Low	42.2	Very low	119 Å²	119	150 Å²	150	73%	0.73	83%	0.834	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.6	14.3	-179.8	51	0	0	0	0	115.9	E329	E329-T331 PolarHBondContact O-N 2.94Å; E329-T331 VanDerWaalsContact O-N 3.08Å
332	F	44.9	Very low	42.7	Very low	195 Å²	195	146.4 Å²	146.4	86%	0.855	83%	0.829	S	S	*	*	S	Bend	trans	-124.6	118.1	163	-125.5	-96.8	0	0	0	112.3	G334	F332-G334 VanDerWaalsContact C-N 3.3Å; F332-G334 PolarHBondContact O-N 3.07Å
333	G	47.1	Very low	43.8	Very low	90 Å²	90	146.6 Å²	146.6	93%	0.928	82%	0.824	S	S	*	*			trans	-71.9	68.7	-172.3	0	0	0	0	0	115.3
334	G	37.5	Very low	45.1	Very low	68 Å²	68	149.3 Å²	149.3	70%	0.701	84%	0.837	S	S	*	*			trans	-95.5	110.6	178.1	0	0	0	0	0	113.2	F332 T336	F332-G334 VanDerWaalsContact C-N 3.3Å; F332-G334 PolarHBondContact O-N 3.07Å; G334-T336 PolarHBondContact O-N 3.18Å
335	K	45.7	Very low	46.5	Very low	210 Å²	210	144.1 Å²	144.1	91%	0.913	81%	0.812	S	S	*	*			trans	-83.4	92.9	-173.3	-176.8	-171.7	174.6	-178.3	0	113.7
336	T	33.2	Very low	48.9	Very low	142 Å²	142	143.9 Å²	143.9	87%	0.871	80%	0.798	S	S	*	*			trans	-132.5	176.1	154.4	59.9	0	0	0	0	110.2	G334	G334-T336 PolarHBondContact O-N 3.18Å
337	S	43	Very low	50.9	Low	109 Å²	109	140.1 Å²	140.1	76%	0.762	79%	0.792	S	S	*	*			trans	-137.5	118.8	-161.7	57.4	0	0	0	0	113.9
338	S	38.9	Very low	53.3	Low	116 Å²	116	140.9 Å²	140.9	81%	0.811	79%	0.785	S	S	*	*				162.5	109.3	127.2	57.3	0	0	0	0	113.4
339	S	34.2	Very low	55.3	Low	130 Å²	130	137 Å²	137	91%	0.909	76%	0.764	S	S	*	*			trans	-171.2	166.8	142.7	-86.7	0	0	0	0	110.5
340	E	40	Very low	57.3	Low	194 Å²	194	134.4 Å²	134.4	91%	0.907	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-88	162.3	-171	-58.6	-170.1	136.1	0	0	112.9	S342	E340-S342 PolarHBondContact O-N 3.1Å
341	K	41.8	Very low	59.2	Low	206 Å²	206	133.7 Å²	133.7	90%	0.896	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-71.4	121.5	-175.7	-63.5	177.4	179.7	179.9	0	111.3
342	S	49.4	Very low	61.1	Low	108 Å²	108	133.4 Å²	133.4	76%	0.755	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-73.4	131.7	159.9	44.7	0	0	0	0	110.2	E340	E340-S342 PolarHBondContact O-N 3.1Å
343	E	58.7	Low	63.3	Low	171 Å²	171	127.5 Å²	127.5	80%	0.799	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-78.5	155.7	169.9	-61.9	-168.4	146.8	0	0	110.5	K345	E343-K345 VanDerWaalsContact C-N 3.32Å; E343-K345 PolarHBondContact O-N 2.99Å
344	V	68	Low	65.6	Low	148 Å²	148	130.5 Å²	130.5	90%	0.897	69%	0.692	S	S	*	*			trans	-78.2	82.4	-176.5	-173.8	0	0	0	0	110.3
345	K	77	Confident	68.4	Low	76 Å²	76	132.2 Å²	132.2	33%	0.33	68%	0.683	S	S	.	*			trans	-61.1	148.1	-177.2	-61.7	-178	-161.8	177.7	0	113.4	E343 E349 K350 E353	E343-K345 VanDerWaalsContact C-N 3.32Å; E343-K345 PolarHBondContact O-N 2.99Å; K345-E349 WeakPolarHBondContact CA-OE2 3.34Å; K345-E349 HydrophobicContact CB-CB 4.39Å; K345-E349 HydrophobicContact CB-CG 4.08Å; K345-E349 WeakPolarHBondContact CB-OE2 3.46Å; K345-E349 HydrophobicContact CD-CG 4.32Å; K345-E349 HydrophobicContact CG-CG 4.41Å; K345-K350 HydrophobicContact CB-CG 4.1Å; K345-E353 WeakPolarHBondContact CD-OE2 3.36Å; K345-E353 IonicContact NZ-OE1 2.74Å; K345-E353 PolarHBondContact NZ-OE1 2.89Å; K345-E353 IonicContact NZ-OE2 2.64Å; K345-E353 PolarHBondContact NZ-OE2 3.32Å
346	S	85.6	Confident	70.8	Confident	69 Å²	69	124.6 Å²	124.6	48%	0.483	66%	0.657	S	S	.	*			trans	-63.1	155.4	178.9	179.1	0	0	0	0	112.4	Y348 E349 K350	S346-Y348 VanDerWaalsContact C-N 3.3Å; S346-Y348 PolarHBondContact O-N 3.49Å; S346-E349 PolarHBondContact N-OE2 3.39Å; S346-E349 CarbonylContact O-C 3.57Å; S346-E349 WeakPolarHBondContact O-CB 3.22Å; S346-E349 PolarHBondContact O-N 3.15Å; S346-K350 WeakPolarHBondContact O-CG 3.41Å; S346-K350 PolarHBondContact O-N 2.97Å
347	S	85.4	Confident	73.7	Confident	103 Å²	103	122.8 Å²	122.8	72%	0.72	64%	0.638	S	S	*	*	H	α-helix	trans	-62.5	-35.8	177.6	57.3	0	0	0	0	112.9	E349 R351	S347-E349 VanDerWaalsContact C-N 3.35Å; S347-R351 WeakPolarHBondContact O-CB 3.22Å; S347-R351 PolarHBondContact O-N 3.14Å; S347-R351 VanDerWaalsContact O-N 3.12Å
348	Y	90.3	Very high	76.3	Confident	166 Å²	166	122.6 Å²	122.6	65%	0.651	62%	0.624	S	S	*	*	H	α-helix	trans	-66.3	-37.9	171.9	179.6	-94.6	0	0	0	111.9	S346 R351 Q352	S346-Y348 VanDerWaalsContact C-N 3.3Å; S346-Y348 PolarHBondContact O-N 3.49Å; Y348-R351 CarbonylContact O-C 3.57Å; Y348-R351 WeakPolarHBondContact O-CB 3.21Å; Y348-R351 PolarHBondContact O-N 3.02Å; Y348-Q352 VanDerWaalsContact CE1-OE1 3.31Å; Y348-Q352 WeakPolarHBondContact O-CB 3.37Å; Y348-Q352 PolarHBondContact O-N 3.33Å
349	E	88.8	Confident	79	Confident	89 Å²	89	120.8 Å²	120.8	42%	0.416	60%	0.604	S	S	.	*	H	α-helix	trans	-72.5	-45.7	-178.7	-175.5	173.7	-141.8	0	0	111.4	K345 S346 S347 R351 Q352 E353	K345-E349 WeakPolarHBondContact CA-OE2 3.34Å; K345-E349 HydrophobicContact CB-CB 4.39Å; K345-E349 HydrophobicContact CB-CG 4.08Å; K345-E349 WeakPolarHBondContact CB-OE2 3.46Å; K345-E349 HydrophobicContact CD-CG 4.32Å; K345-E349 HydrophobicContact CG-CG 4.41Å; S346-E349 PolarHBondContact N-OE2 3.39Å; S346-E349 CarbonylContact O-C 3.57Å; S346-E349 WeakPolarHBondContact O-CB 3.22Å; S346-E349 PolarHBondContact O-N 3.15Å; S347-E349 VanDerWaalsContact C-N 3.35Å; E349-R351 PolarHBondContact O-N 2.86Å; E349-Q352 CarbonylContact O-C 3.57Å; E349-Q352 PolarHBondContact O-N 3.26Å; E349-E353 WeakPolarHBondContact O-CG 3.38Å; E349-E353 PolarHBondContact O-N 2.81Å
350	K	88.8	Confident	82	Confident	118 Å²	118	120 Å²	120	51%	0.513	59%	0.586	S	S	.	*	H	α-helix	trans	-54.6	-39.1	168.3	-70.2	-176.2	178.3	-171.2	0	111.8	K345 S346 K354	K345-K350 HydrophobicContact CB-CG 4.1Å; S346-K350 WeakPolarHBondContact O-CG 3.41Å; S346-K350 PolarHBondContact O-N 2.97Å; K350-K354 WeakPolarHBondContact O-CG 3.32Å; K350-K354 PolarHBondContact O-N 3.08Å
351	R	92	Very high	84.6	Confident	181 Å²	181	115.5 Å²	115.5	68%	0.683	57%	0.565	S	S	*	*	H	α-helix	trans	-69.9	-40.4	174.5	-172.8	177.9	-178.3	179.3	2.4	112.1	S347 Y348 E349 E353 K354 M355	S347-R351 WeakPolarHBondContact O-CB 3.22Å; S347-R351 PolarHBondContact O-N 3.14Å; S347-R351 VanDerWaalsContact O-N 3.12Å; Y348-R351 CarbonylContact O-C 3.57Å; Y348-R351 WeakPolarHBondContact O-CB 3.21Å; Y348-R351 PolarHBondContact O-N 3.02Å; E349-R351 PolarHBondContact O-N 2.86Å; R351-E353 VanDerWaalsContact C-N 3.33Å; R351-K354 PolarHBondContact O-N 3.07Å; R351-M355 WeakPolarHBondContact O-CB 3.3Å; R351-M355 VanDerWaalsContact O-CG 3.25Å; R351-M355 WeakPolarHBondContact O-CG 3.2Å; R351-M355 PolarHBondContact O-N 3Å
352	Q	92.9	Very high	87.2	Confident	113 Å²	113	110.8 Å²	110.8	53%	0.528	55%	0.549	S	S	.	.	H	α-helix	trans	-65.2	-37.5	176.3	-175.6	172.8	-16.4	0	0	111.5	Y348 E349 M355 S356	Y348-Q352 VanDerWaalsContact CE1-OE1 3.31Å; Y348-Q352 WeakPolarHBondContact O-CB 3.37Å; Y348-Q352 PolarHBondContact O-N 3.33Å; E349-Q352 CarbonylContact O-C 3.57Å; E349-Q352 PolarHBondContact O-N 3.26Å; Q352-M355 PolarHBondContact O-N 3.15Å; Q352-S356 WeakPolarHBondContact O-CB 3.49Å; Q352-S356 PolarHBondContact O-N 2.71Å; Q352-S356 PolarHBondContact O-OG 3Å
353	E	91.9	Very high	89.4	Confident	70 Å²	70	111 Å²	111	33%	0.327	54%	0.538	S	S	.	.	H	α-helix	trans	-66.3	-50.8	173.9	-70.8	-171.1	156.2	0	0	111.3	K345 E349 R351 M355 S356 Q357	K345-E353 WeakPolarHBondContact CD-OE2 3.36Å; K345-E353 IonicContact NZ-OE1 2.74Å; K345-E353 PolarHBondContact NZ-OE1 2.89Å; K345-E353 IonicContact NZ-OE2 2.64Å; K345-E353 PolarHBondContact NZ-OE2 3.32Å; E349-E353 WeakPolarHBondContact O-CG 3.38Å; E349-E353 PolarHBondContact O-N 2.81Å; R351-E353 VanDerWaalsContact C-N 3.33Å; E353-M355 PolarHBondContact O-N 3.48Å; E353-S356 WeakPolarHBondContact CA-OG 3.31Å; E353-S356 PolarHBondContact O-N 3.44Å; E353-S356 PolarHBondContact O-OG 3.45Å; E353-Q357 WeakPolarHBondContact O-CG 3.48Å; E353-Q357 PolarHBondContact O-N 2.96Å
354	K	95.1	Very high	91.1	Very high	153 Å²	153	107.9 Å²	107.9	67%	0.665	53%	0.527	S	S	*	.	H	α-helix	trans	-55.2	-39	172.5	-75.3	-173.2	176.1	-171.7	0	112.5	K350 R351 K358	K350-K354 WeakPolarHBondContact O-CG 3.32Å; K350-K354 PolarHBondContact O-N 3.08Å; R351-K354 PolarHBondContact O-N 3.07Å; K354-K358 WeakPolarHBondContact O-CB 3.48Å; K354-K358 PolarHBondContact O-N 2.78Å
355	M	95.5	Very high	92.3	Very high	104 Å²	104	104.1 Å²	104.1	51%	0.512	51%	0.512	S	S	.	.	H	α-helix	trans	-66.5	-41.7	173.5	-75	-61.8	-53.2	0	0	112.5	R351 Q352 E353 K358 I359	R351-M355 WeakPolarHBondContact O-CB 3.3Å; R351-M355 VanDerWaalsContact O-CG 3.25Å; R351-M355 WeakPolarHBondContact O-CG 3.2Å; R351-M355 PolarHBondContact O-N 3Å; Q352-M355 PolarHBondContact O-N 3.15Å; E353-M355 PolarHBondContact O-N 3.48Å; M355-K358 PolarHBondContact O-N 3.36Å; M355-I359 WeakPolarHBondContact O-CB 3.45Å; M355-I359 WeakPolarHBondContact O-CD1 3.45Å; M355-I359 VanDerWaalsContact O-CG1 3.23Å; M355-I359 WeakPolarHBondContact O-CG1 3.26Å; M355-I359 PolarHBondContact O-N 3Å
356	S	95.6	Very high	93	Very high	51 Å²	51	104.6 Å²	104.6	36%	0.357	53%	0.529	S	S	.	.	H	α-helix	trans	-67.7	-35.9	176.8	66.4	0	0	0	0	113	Q352 E353 I359 Q360	Q352-S356 WeakPolarHBondContact O-CB 3.49Å; Q352-S356 PolarHBondContact O-N 2.71Å; Q352-S356 PolarHBondContact O-OG 3Å; E353-S356 WeakPolarHBondContact CA-OG 3.31Å; E353-S356 PolarHBondContact O-N 3.44Å; E353-S356 PolarHBondContact O-OG 3.45Å; S356-I359 PolarHBondContact O-N 2.75Å; S356-Q360 WeakPolarHBondContact O-CB 3.32Å; S356-Q360 WeakPolarHBondContact O-CG 3.35Å; S356-Q360 PolarHBondContact O-N 3.09Å
357	Q	95.6	Very high	93.4	Very high	104 Å²	104	108.3 Å²	108.3	49%	0.486	54%	0.543	S	S	.	.	H	α-helix	trans	-62.4	-48.6	171.5	-72	166.8	-25	0	0	110	E353 I359 Q360 E361	E353-Q357 WeakPolarHBondContact O-CG 3.48Å; E353-Q357 PolarHBondContact O-N 2.96Å; Q357-I359 VanDerWaalsContact C-N 3.3Å; Q357-I359 PolarHBondContact O-N 2.84Å; Q357-Q360 PolarHBondContact O-N 3.14Å; Q357-Q360 VanDerWaalsContact O-N 3.16Å; Q357-E361 WeakPolarHBondContact O-CG 3.41Å; Q357-E361 PolarHBondContact O-N 2.81Å
358	K	96.6	Very high	93.7	Very high	105 Å²	105	106.3 Å²	106.3	46%	0.457	53%	0.533	S	S	.	.	H	α-helix	trans	-62.6	-34.7	176.3	-162.2	72.1	-144.6	166.8	0	113.1	K354 M355 E361 L362	K354-K358 WeakPolarHBondContact O-CB 3.48Å; K354-K358 PolarHBondContact O-N 2.78Å; M355-K358 PolarHBondContact O-N 3.36Å; K358-E361 WeakPolarHBondContact CD-OE2 3.41Å; K358-E361 VanDerWaalsContact CE-OE2 3.32Å; K358-E361 WeakPolarHBondContact CE-OE2 3.47Å; K358-E361 IonicContact NZ-OE2 2.62Å; K358-E361 PolarHBondContact NZ-OE2 3.38Å; K358-L362 HydrophobicContact CG-CD1 4.44Å; K358-L362 WeakPolarHBondContact O-CB 3.49Å; K358-L362 WeakPolarHBondContact O-CD1 3.36Å; K358-L362 VanDerWaalsContact O-CG 3.24Å; K358-L362 WeakPolarHBondContact O-CG 3.32Å; K358-L362 PolarHBondContact O-N 3.03Å; K358-L362 VanDerWaalsContact O-N 3.14Å
359	I	95.9	Very high	93.7	Very high	78 Å²	78	107.7 Å²	107.7	40%	0.4	55%	0.545	S	S	.	.	H	α-helix	trans	-66.3	-47.8	172.8	-72.4	163	0	0	0	110.2	M355 S356 Q357 E361 L362 E363	M355-I359 WeakPolarHBondContact O-CB 3.45Å; M355-I359 WeakPolarHBondContact O-CD1 3.45Å; M355-I359 VanDerWaalsContact O-CG1 3.23Å; M355-I359 WeakPolarHBondContact O-CG1 3.26Å; M355-I359 PolarHBondContact O-N 3Å; S356-I359 PolarHBondContact O-N 2.75Å; Q357-I359 VanDerWaalsContact C-N 3.3Å; Q357-I359 PolarHBondContact O-N 2.84Å; I359-E361 PolarHBondContact O-N 3.09Å; I359-L362 CarbonylContact O-C 3.56Å; I359-L362 PolarHBondContact O-N 3.29Å; I359-L362 VanDerWaalsContact O-N 3.12Å; I359-E363 HydrophobicContact CG2-CG 4.15Å; I359-E363 WeakPolarHBondContact CG2-OE1 3.29Å; I359-E363 WeakPolarHBondContact O-CB 3.13Å; I359-E363 WeakPolarHBondContact O-CG 3.44Å; I359-E363 PolarHBondContact O-N 2.93Å
360	Q	96.4	Very high	93.9	Very high	112 Å²	112	110.6 Å²	110.6	52%	0.523	56%	0.556	S	S	.	*	H	α-helix	trans	-62.7	-38	177.6	-74.5	173.5	-6.4	0	0	112.7	S356 Q357 N364	S356-Q360 WeakPolarHBondContact O-CB 3.32Å; S356-Q360 WeakPolarHBondContact O-CG 3.35Å; S356-Q360 PolarHBondContact O-N 3.09Å; Q357-Q360 PolarHBondContact O-N 3.14Å; Q357-Q360 VanDerWaalsContact O-N 3.16Å; Q360-N364 VanDerWaalsContact O-CB 3.24Å; Q360-N364 WeakPolarHBondContact O-CB 3.3Å; Q360-N364 PolarHBondContact O-N 3.35Å; Q360-N364 PolarHBondContact O-ND2 2.78Å
361	E	96.5	Very high	94	Very high	101 Å²	101	107.7 Å²	107.7	47%	0.472	55%	0.554	S	S	.	*	H	α-helix	trans	-58.4	-46.1	171	-74.1	169.2	-151	0	0	111.7	Q357 K358 I359 A365	Q357-E361 WeakPolarHBondContact O-CG 3.41Å; Q357-E361 PolarHBondContact O-N 2.81Å; K358-E361 WeakPolarHBondContact CD-OE2 3.41Å; K358-E361 VanDerWaalsContact CE-OE2 3.32Å; K358-E361 WeakPolarHBondContact CE-OE2 3.47Å; K358-E361 IonicContact NZ-OE2 2.62Å; K358-E361 PolarHBondContact NZ-OE2 3.38Å; I359-E361 PolarHBondContact O-N 3.09Å; E361-A365 VanDerWaalsContact O-CB 3.26Å; E361-A365 WeakPolarHBondContact O-CB 3.41Å; E361-A365 PolarHBondContact O-N 3.45Å
362	L	95.5	Very high	93.9	Very high	107 Å²	107	101 Å²	101	56%	0.56	53%	0.529	S	S	*	.	H	α-helix	trans	-72.7	-36	-179.4	-69.7	169.8	0	0	0	112.6	K358 I359 A365 A366	K358-L362 HydrophobicContact CG-CD1 4.44Å; K358-L362 WeakPolarHBondContact O-CB 3.49Å; K358-L362 WeakPolarHBondContact O-CD1 3.36Å; K358-L362 VanDerWaalsContact O-CG 3.24Å; K358-L362 WeakPolarHBondContact O-CG 3.32Å; K358-L362 PolarHBondContact O-N 3.03Å; K358-L362 VanDerWaalsContact O-N 3.14Å; I359-L362 CarbonylContact O-C 3.56Å; I359-L362 PolarHBondContact O-N 3.29Å; I359-L362 VanDerWaalsContact O-N 3.12Å; L362-A365 PolarHBondContact O-N 3.25Å; L362-A366 VanDerWaalsContact O-CB 3.28Å; L362-A366 WeakPolarHBondContact O-CB 3.47Å; L362-A366 PolarHBondContact O-N 2.83Å
363	E	95.1	Very high	93.9	Very high	111 Å²	111	100 Å²	100	52%	0.519	53%	0.525	S	S	.	.	H	α-helix	trans	-65.3	-45.5	173	-73.8	174.4	166.1	0	0	110.7	I359 A366 L367	I359-E363 HydrophobicContact CG2-CG 4.15Å; I359-E363 WeakPolarHBondContact CG2-OE1 3.29Å; I359-E363 WeakPolarHBondContact O-CB 3.13Å; I359-E363 WeakPolarHBondContact O-CG 3.44Å; I359-E363 PolarHBondContact O-N 2.93Å; E363-A366 PolarHBondContact O-N 3.46Å; E363-L367 WeakPolarHBondContact O-CB 3.43Å; E363-L367 VanDerWaalsContact O-CG 3.27Å; E363-L367 WeakPolarHBondContact O-CG 3.45Å; E363-L367 PolarHBondContact O-N 2.91Å
364	N	95.4	Very high	93.8	Very high	107 Å²	107	102.6 Å²	102.6	57%	0.572	54%	0.54	S	S	*	.	H	α-helix	trans	-63.4	-42.6	174.5	-72.7	-32.2	0	0	0	111.8	Q360 A366 L367 A368	Q360-N364 VanDerWaalsContact O-CB 3.24Å; Q360-N364 WeakPolarHBondContact O-CB 3.3Å; Q360-N364 PolarHBondContact O-N 3.35Å; Q360-N364 PolarHBondContact O-ND2 2.78Å; N364-A366 VanDerWaalsContact C-N 3.29Å; N364-A366 PolarHBondContact O-N 3.28Å; N364-L367 PolarHBondContact O-N 2.83Å; N364-A368 WeakPolarHBondContact O-CB 3.34Å; N364-A368 PolarHBondContact O-N 3Å
365	A	92.9	Very high	93.5	Very high	69 Å²	69	98.1 Å²	98.1	57%	0.57	53%	0.528	S	S	*	.	H	α-helix	trans	-66.7	-27.7	176.5	0	0	0	0	0	113.3	E361 L362	E361-A365 VanDerWaalsContact O-CB 3.26Å; E361-A365 WeakPolarHBondContact O-CB 3.41Å; E361-A365 PolarHBondContact O-N 3.45Å; L362-A365 PolarHBondContact O-N 3.25Å
366	A	91.8	Very high	93.3	Very high	85 Å²	85	96.4 Å²	96.4	70%	0.702	54%	0.537	S	S	*	.	H	α-helix	trans	-82.1	-19.6	173.9	0	0	0	0	0	113.8	L362 E363 N364	L362-A366 VanDerWaalsContact O-CB 3.28Å; L362-A366 WeakPolarHBondContact O-CB 3.47Å; L362-A366 PolarHBondContact O-N 2.83Å; E363-A366 PolarHBondContact O-N 3.46Å; N364-A366 VanDerWaalsContact C-N 3.29Å; N364-A366 PolarHBondContact O-N 3.28Å
367	L	93.4	Very high	93	Very high	148 Å²	148	103.6 Å²	103.6	78%	0.775	57%	0.565	S	S	*	*	H	α-helix	trans	-90.9	-22.5	173.5	-71	168.9	0	0	0	113.1	E363 N364	E363-L367 WeakPolarHBondContact O-CB 3.43Å; E363-L367 VanDerWaalsContact O-CG 3.27Å; E363-L367 WeakPolarHBondContact O-CG 3.45Å; E363-L367 PolarHBondContact O-N 2.91Å; N364-L367 PolarHBondContact O-N 2.83Å
368	A	92.8	Very high	92.9	Very high	61 Å²	61	101 Å²	101	50%	0.504	56%	0.556	S	S	.	*	S	Bend	trans	-69.4	159.7	176.5	0	0	0	0	0	112.3	N364	N364-A368 WeakPolarHBondContact O-CB 3.34Å; N364-A368 PolarHBondContact O-N 3Å
369	E	89.9	Confident	92.6	Very high	194 Å²	194	99.5 Å²	99.5	91%	0.907	56%	0.556	S	S	*	*	P	Polyproline II helix	trans	-65.2	142.1	169.8	-65.6	-177.9	177.8	0	0	110.2
370	K	92.1	Very high	92.5	Very high	150 Å²	150	99.8 Å²	99.8	65%	0.652	57%	0.57	S	S	*	*	P	Polyproline II helix	trans	-68.9	144.4	179.4	-69.2	-175.4	178.3	-177.6	0	110.5	L374	K370-L374 HydrophobicContact CB-CB 4.23Å; K370-L374 HydrophobicContact CD-CB 4.19Å; K370-L374 WeakPolarHBondContact CD-O 3.49Å
371	A	91.3	Very high	92.2	Very high	57 Å²	57	103.5 Å²	103.5	47%	0.471	59%	0.587	S	S	.	*	P	Polyproline II helix	trans	-55.3	148.4	166.7	0	0	0	0	0	110.5	Q373 L374	A371-Q373 PolarHBondContact O-N 3.24Å; A371-Q373 VanDerWaalsContact O-N 3.16Å; A371-L374 PolarHBondContact O-N 3.42Å
372	W	90.6	Very high	92	Very high	40 Å²	40	103.1 Å²	103.1	15%	0.152	59%	0.592	C	S	.	*	G	3₁₀ helix	trans	-60.4	-34.3	-165.4	71.2	-94.3	0	0	0	112.7	L374 S375 V378 R383 S387 E391	W372-L374 PolarHBondContact O-N 3.12Å; W372-S375 WeakPolarHBondContact O-CB 3.28Å; W372-S375 PolarHBondContact O-N 3.32Å; W372-V378 HydrophobicContact CB-CG1 4.4Å; W372-V378 HydrophobicContact CE3-CB 4.37Å; W372-V378 HydrophobicContact CE3-CG1 3.87Å; W372-V378 HydrophobicContact CE3-CG2 4.3Å; W372-V378 VanDerWaalsContact O-CG2 3.27Å; W372-V378 WeakPolarHBondContact O-CG2 3.34Å; W372-R383 HydrophobicContact CB-CB 4.29Å; W372-R383 HydrophobicContact CD2-CB 3.6Å; W372-R383 HydrophobicContact CE3-CB 4.04Å; W372-R383 HydrophobicContact CG-CB 3.75Å; W372-R383 HydrophobicContact CZ2-CB 4.47Å; W372-S387 WeakPolarHBondContact CZ2-OG 3.45Å; W372-S387 PolarHBondContact NE1-OG 3.38Å; W372-S387 VanDerWaalsContact NE1-OG 3.17Å; W372-E391 WeakPolarHBondContact CH2-OE2 3.31Å; W372-E391 WeakPolarHBondContact CZ2-OE1 3.23Å; W372-E391 VanDerWaalsContact CZ2-OE2 3.3Å; W372-E391 WeakPolarHBondContact CZ2-OE2 3.35Å
373	Q	91.9	Very high	91.7	Very high	94 Å²	94	101.5 Å²	101.5	44%	0.439	58%	0.578	S	S	.	*	G	3₁₀ helix	trans	-59.2	-27.4	175.9	-48.8	87.7	-15.6	0	0	113.7	A371 S375 E391	A371-Q373 PolarHBondContact O-N 3.24Å; A371-Q373 VanDerWaalsContact O-N 3.16Å; Q373-S375 VanDerWaalsContact C-N 3.34Å; Q373-E391 VanDerWaalsContact CG-CD 3.44Å; Q373-E391 WeakPolarHBondContact CG-OE1 3.27Å; Q373-E391 WeakPolarHBondContact CG-OE2 3.42Å; Q373-E391 PolarHBondContact NE2-OE1 2.95Å
374	L	90.1	Very high	91.6	Very high	124 Å²	124	100.1 Å²	100.1	65%	0.649	58%	0.579	S	S	*	*	G	3₁₀ helix	trans	-95.7	11.3	-179.4	-61.5	176	0	0	0	112.7	K370 A371 W372	K370-L374 HydrophobicContact CB-CB 4.23Å; K370-L374 HydrophobicContact CD-CB 4.19Å; K370-L374 WeakPolarHBondContact CD-O 3.49Å; A371-L374 PolarHBondContact O-N 3.42Å; W372-L374 PolarHBondContact O-N 3.12Å
375	S	88.9	Confident	91.6	Very high	58 Å²	58	103.7 Å²	103.7	41%	0.406	59%	0.592	S	S	.	*	S	Bend	trans	-112.2	142.8	175.7	-58.9	0	0	0	0	110.2	W372 Q373 V378	W372-S375 WeakPolarHBondContact O-CB 3.28Å; W372-S375 PolarHBondContact O-N 3.32Å; Q373-S375 VanDerWaalsContact C-N 3.34Å; S375-V378 WeakPolarHBondContact O-CG2 3.44Å
376	G	90.4	Very high	91.5	Very high	68 Å²	68	106.2 Å²	106.2	70%	0.701	60%	0.596	S	S	*	*	S	Bend	trans	-80	162.1	171.5	0	0	0	0	0	111.7	V378	G376-V378 PolarHBondContact O-N 2.86Å; G376-V378 VanDerWaalsContact O-N 3.15Å
377	E	90	Very high	91.5	Very high	202 Å²	202	102.7 Å²	102.7	94%	0.944	57%	0.567	S	S	*	*	S	Bend	trans	57	32	168.2	-58.8	176.3	-171.6	0	0	114.6	T379	E377-T379 PolarHBondContact O-N 3.04Å
378	V	92.6	Very high	91.3	Very high	50 Å²	50	99.3 Å²	99.3	30%	0.303	55%	0.548	S	S	.	.			trans	-64.2	124.2	-177.8	-174	0	0	0	0	111.4	W372 S375 G376 T382 R383	W372-V378 HydrophobicContact CB-CG1 4.4Å; W372-V378 HydrophobicContact CE3-CB 4.37Å; W372-V378 HydrophobicContact CE3-CG1 3.87Å; W372-V378 HydrophobicContact CE3-CG2 4.3Å; W372-V378 VanDerWaalsContact O-CG2 3.27Å; W372-V378 WeakPolarHBondContact O-CG2 3.34Å; S375-V378 WeakPolarHBondContact O-CG2 3.44Å; G376-V378 PolarHBondContact O-N 2.86Å; G376-V378 VanDerWaalsContact O-N 3.15Å; V378-T382 WeakPolarHBondContact CG1-OG1 3.32Å; V378-R383 HydrophobicContact CG1-CB 4.19Å
379	T	92.1	Very high	91.2	Very high	74 Å²	74	103.7 Å²	103.7	45%	0.454	56%	0.562	S	S	.	*			trans	-85.6	160.9	173.4	75.1	0	0	0	0	111.6	E377 Q381 T382	E377-T379 PolarHBondContact O-N 3.04Å; T379-Q381 PolarHBondContact O-N 2.63Å; T379-Q381 VanDerWaalsContact O-N 3.13Å; T379-Q381 PolarHBondContact OG1-N 3.26Å; T379-T382 WeakPolarHBondContact CA-OG1 3.48Å; T379-T382 PolarHBondContact N-OG1 3.32Å; T379-T382 PolarHBondContact O-N 2.89Å; T379-T382 VanDerWaalsContact O-N 3.12Å; T379-T382 PolarHBondContact O-OG1 2.95Å; T379-T382 PolarHBondContact OG1-N 2.92Å; T379-T382 PolarHBondContact OG1-OG1 3.09Å
380	A	91.9	Very high	91.2	Very high	84 Å²	84	102.3 Å²	102.3	69%	0.694	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.1	-22.4	175.3	0	0	0	0	0	114
381	Q	91.9	Very high	91.1	Very high	189 Å²	189	97.4 Å²	97.4	88%	0.883	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-19.9	178.3	-65.4	-179.7	-7.5	0	0	113.6	T379	T379-Q381 PolarHBondContact O-N 2.63Å; T379-Q381 VanDerWaalsContact O-N 3.13Å; T379-Q381 PolarHBondContact OG1-N 3.26Å
382	T	90.5	Very high	91.1	Very high	93 Å²	93	103.1 Å²	103.1	57%	0.571	56%	0.557	S	S	*	*	S	Bend	trans	-92.4	-1.1	-175.8	38.9	0	0	0	0	114	V378 T379	V378-T382 WeakPolarHBondContact CG1-OG1 3.32Å; T379-T382 WeakPolarHBondContact CA-OG1 3.48Å; T379-T382 PolarHBondContact N-OG1 3.32Å; T379-T382 PolarHBondContact O-N 2.89Å; T379-T382 VanDerWaalsContact O-N 3.12Å; T379-T382 PolarHBondContact O-OG1 2.95Å; T379-T382 PolarHBondContact OG1-N 2.92Å; T379-T382 PolarHBondContact OG1-OG1 3.09Å
383	R	91.1	Very high	91.1	Very high	73 Å²	73	104.7 Å²	104.7	28%	0.275	57%	0.571	S	S	.	*	S	Bend	trans	-122.8	159.6	175.7	66.3	178.1	-178.5	-172.4	1.1	110.6	W372 V378 M388	W372-R383 HydrophobicContact CB-CB 4.29Å; W372-R383 HydrophobicContact CD2-CB 3.6Å; W372-R383 HydrophobicContact CE3-CB 4.04Å; W372-R383 HydrophobicContact CG-CB 3.75Å; W372-R383 HydrophobicContact CZ2-CB 4.47Å; V378-R383 HydrophobicContact CG1-CB 4.19Å; R383-M388 PolarHBondContact NH1-SD 3.23Å
384	P	93.1	Very high	91.1	Very high	82 Å²	82	109.5 Å²	109.5	53%	0.532	59%	0.594	S	S	.	*			trans	-60.4	152.3	173.4	-20.1	32.9	0	0	0	112.3	S387	P384-S387 WeakPolarHBondContact O-CB 3.45Å; P384-S387 PolarHBondContact O-N 2.92Å
385	E	93.4	Very high	91.2	Very high	182 Å²	182	111.4 Å²	111.4	85%	0.85	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.5	145.4	171.5	-64.2	-177.6	174.8	0	0	110.6	S387	E385-S387 PolarHBondContact O-N 3.19Å
386	N	91.8	Very high	91.4	Very high	123 Å²	123	117.6 Å²	117.6	66%	0.658	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	58.5	-4.7	-178.9	-60.7	-31.9	0	0	0	117.7	M388 L389	N386-M388 PolarHBondContact O-N 3.05Å; N386-L389 HydrophobicContact CB-CD1 4.21Å; N386-L389 WeakPolarHBondContact O-CB 3.25Å; N386-L389 PolarHBondContact O-N 2.74Å
387	S	91.4	Very high	91.5	Very high	11 Å²	11	119.4 Å²	119.4	8%	0.077	61%	0.61	C	S	.	*	T	Hydrogen-bonded Turn	trans	-57.6	-14.9	-177	-158.6	0	0	0	0	115.4	W372 P384 E385 L389	W372-S387 WeakPolarHBondContact CZ2-OG 3.45Å; W372-S387 PolarHBondContact NE1-OG 3.38Å; W372-S387 VanDerWaalsContact NE1-OG 3.17Å; P384-S387 WeakPolarHBondContact O-CB 3.45Å; P384-S387 PolarHBondContact O-N 2.92Å; E385-S387 PolarHBondContact O-N 3.19Å; S387-L389 VanDerWaalsContact C-N 3.35Å
388	M	89.2	Confident	91.6	Very high	77 Å²	77	115 Å²	115	38%	0.379	61%	0.608	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.9	-20.7	172.8	-167.4	77.5	-164	0	0	113.2	R383 N386 E390 V393	R383-M388 PolarHBondContact NH1-SD 3.23Å; N386-M388 PolarHBondContact O-N 3.05Å; M388-E390 VanDerWaalsContact C-N 3.29Å; M388-V393 HydrophobicContact CE-CB 3.67Å; M388-V393 HydrophobicContact CE-CG1 4.09Å; M388-V393 HydrophobicContact CE-CG2 3.69Å; M388-V393 HydrophobicContact SD-CG2 4.34Å
389	L	90.9	Very high	91.7	Very high	152 Å²	152	116.3 Å²	116.3	80%	0.796	62%	0.619	S	S	*	*	S	Bend	trans	-81.2	-12.4	178	-68.3	163.6	0	0	0	112.4	N386 S387	N386-L389 HydrophobicContact CB-CD1 4.21Å; N386-L389 WeakPolarHBondContact O-CB 3.25Å; N386-L389 PolarHBondContact O-N 2.74Å; S387-L389 VanDerWaalsContact C-N 3.35Å
390	E	90.4	Very high	91.6	Very high	166 Å²	166	124.3 Å²	124.3	78%	0.776	64%	0.641	S	S	*	*	S	Bend	trans	-97.7	-5	179.4	-58.1	-175.5	164.2	0	0	112.5	M388	M388-E390 VanDerWaalsContact C-N 3.29Å
391	E	88.8	Confident	91.4	Very high	47 Å²	47	126.5 Å²	126.5	22%	0.22	64%	0.64	C	S	.	*	S	Bend	trans	-127.6	120.7	-169.1	-70.1	-178	-160.2	0	0	112.9	W372 Q373 V393	W372-E391 WeakPolarHBondContact CH2-OE2 3.31Å; W372-E391 WeakPolarHBondContact CZ2-OE1 3.23Å; W372-E391 VanDerWaalsContact CZ2-OE2 3.3Å; W372-E391 WeakPolarHBondContact CZ2-OE2 3.35Å; Q373-E391 VanDerWaalsContact CG-CD 3.44Å; Q373-E391 WeakPolarHBondContact CG-OE1 3.27Å; Q373-E391 WeakPolarHBondContact CG-OE2 3.42Å; Q373-E391 PolarHBondContact NE2-OE1 2.95Å; E391-V393 HydrophobicContact CB-CG2 4.37Å; E391-V393 PolarHBondContact O-N 3.26Å
392	D	92.1	Very high	91.4	Very high	177 Å²	177	121.8 Å²	121.8	95%	0.947	63%	0.634	S	S	*	*			trans	-72.4	87.5	176	-64.4	-50.4	0	0	0	111.1
393	V	90.7	Very high	91.4	Very high	72 Å²	72	123.2 Å²	123.2	44%	0.436	65%	0.645	S	S	.	*			trans	-97.8	116.9	176.6	-177.9	0	0	0	0	110.8	M388 E391 F395	M388-V393 HydrophobicContact CE-CB 3.67Å; M388-V393 HydrophobicContact CE-CG1 4.09Å; M388-V393 HydrophobicContact CE-CG2 3.69Å; M388-V393 HydrophobicContact SD-CG2 4.34Å; E391-V393 HydrophobicContact CB-CG2 4.37Å; E391-V393 PolarHBondContact O-N 3.26Å; V393-F395 WeakPolarHBondContact O-CD1 3.49Å
394	E	92.3	Very high	91.4	Very high	196 Å²	196	123.5 Å²	123.5	92%	0.916	66%	0.663	S	S	*	*			trans	-71.1	128.5	170.2	-64.4	-178.3	179.3	0	0	111
395	F	91.4	Very high	91.5	Very high	164 Å²	164	126.7 Å²	126.7	72%	0.719	67%	0.674	S	S	*	*			trans	-141.8	153.2	174.6	65.6	-90.8	0	0	0	111.8	V393	V393-F395 WeakPolarHBondContact O-CD1 3.49Å
396	E	93.6	Very high	91.6	Very high	188 Å²	188	120.9 Å²	120.9	88%	0.879	65%	0.651	S	S	*	*			trans	-81.4	126.5	178.4	-173.7	175.3	-173	0	0	111.1
397	Q	92.8	Very high	91.8	Very high	105 Å²	105	122.8 Å²	122.8	49%	0.491	66%	0.656	S	S	.	*			trans	-92.7	119.1	172.4	-169.4	177.9	2.3	0	0	110.3	S399 L401	Q397-S399 WeakPolarHBondContact CG-O 3.47Å; Q397-S399 PolarHBondContact O-N 3.01Å; Q397-S399 VanDerWaalsContact O-N 3.12Å; Q397-L401 VanDerWaalsContact NE2-CD2 3.31Å
398	A	92.3	Very high	91.9	Very high	110 Å²	110	129.1 Å²	129.1	91%	0.909	68%	0.684	S	S	*	*	S	Bend	trans	-68.3	-10.6	-172.8	0	0	0	0	0	115.5
399	S	93	Very high	92.3	Very high	77 Å²	77	128.5 Å²	128.5	54%	0.538	69%	0.685	S	S	.	*	S	Bend	trans	-136.1	150.6	179.4	58.9	0	0	0	0	111.2	Q397	Q397-S399 WeakPolarHBondContact CG-O 3.47Å; Q397-S399 PolarHBondContact O-N 3.01Å; Q397-S399 VanDerWaalsContact O-N 3.12Å
400	R	90.4	Very high	92.5	Very high	243 Å²	243	123.8 Å²	123.8	92%	0.917	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-71.7	132.3	165	-65	-174.6	179.4	94.1	4.1	108.2
401	L	89.1	Confident	92.9	Very high	129 Å²	129	120.4 Å²	120.4	68%	0.675	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-59.3	149.3	166.4	-67.3	173.3	0	0	0	109.9	Q397	Q397-L401 VanDerWaalsContact NE2-CD2 3.31Å
402	A	91.3	Very high	93.2	Very high	91 Å²	91	124.2 Å²	124.2	75%	0.752	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-60.6	135.4	170.3	0	0	0	0	0	109.3	A404	A402-A404 PolarHBondContact O-N 3.28Å
403	P	90.8	Very high	93.5	Very high	123 Å²	123	120.8 Å²	120.8	80%	0.799	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-63.8	128.7	177.3	26.8	-33.4	0	0	0	109.5	I405	P403-I405 PolarHBondContact O-N 3.3Å
404	A	91.4	Very high	93.7	Very high	79 Å²	79	121.7 Å²	121.7	65%	0.653	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-64.7	134.8	171.3	0	0	0	0	0	109.4	A402 T406	A402-A404 PolarHBondContact O-N 3.28Å; A404-T406 PolarHBondContact O-N 2.64Å; A404-T406 VanDerWaalsContact O-N 3.11Å
405	I	93.6	Very high	94	Very high	148 Å²	148	116 Å²	116	76%	0.759	62%	0.623	S	S	*	*			trans	-73.9	103.2	175.6	-57.5	173.4	0	0	0	107.2	P403 T410	P403-I405 PolarHBondContact O-N 3.3Å; I405-T410 HydrophobicContact CG2-CG2 3.57Å
406	T	96.4	Very high	94.3	Very high	60 Å²	60	112.7 Å²	112.7	37%	0.368	61%	0.612	S	S	.	*			trans	-99.5	155.6	175.1	68.4	0	0	0	0	110.7	A404 E408 T409 T410	A404-T406 PolarHBondContact O-N 2.64Å; A404-T406 VanDerWaalsContact O-N 3.11Å; T406-E408 PolarHBondContact O-N 3.09Å; T406-T409 PolarHBondContact N-OG1 3.06Å; T406-T409 VanDerWaalsContact N-OG1 3.09Å; T406-T409 PolarHBondContact O-N 3.02Å; T406-T409 PolarHBondContact O-OG1 3.08Å; T406-T409 PolarHBondContact OG1-N 3.2Å; T406-T410 PolarHBondContact O-N 3.3Å
407	E	95.3	Very high	94.4	Very high	164 Å²	164	107.7 Å²	107.7	77%	0.766	59%	0.59	S	S	*	*	H	α-helix	trans	-55.1	-35.8	177.5	-63.8	174.6	-173.3	0	0	112.2	T409 T410 L411	E407-T409 PolarHBondContact O-N 3.24Å; E407-T410 WeakPolarHBondContact CA-OG1 3.43Å; E407-T410 PolarHBondContact O-N 3.19Å; E407-T410 PolarHBondContact O-OG1 2.74Å; E407-L411 WeakPolarHBondContact O-CB 3.33Å; E407-L411 VanDerWaalsContact O-CG 3.26Å; E407-L411 WeakPolarHBondContact O-CG 3.13Å; E407-L411 PolarHBondContact O-N 3.16Å
408	E	94.8	Very high	94.6	Very high	143 Å²	143	107.5 Å²	107.5	67%	0.668	59%	0.588	S	S	*	*	H	α-helix	trans	-61	-43	173.7	-60.5	-179.7	165.5	0	0	112.3	T406 Q412	T406-E408 PolarHBondContact O-N 3.09Å; E408-Q412 VanDerWaalsContact O-CG 3.3Å; E408-Q412 WeakPolarHBondContact O-CG 3.3Å; E408-Q412 PolarHBondContact O-N 3.1Å; E408-Q412 VanDerWaalsContact O-N 3.11Å
409	T	96.6	Very high	94.8	Very high	64 Å²	64	108 Å²	108	39%	0.393	57%	0.571	S	S	.	*	H	α-helix	trans	-71	-33.9	178.2	59.9	0	0	0	0	112.7	T406 E407 L413	T406-T409 PolarHBondContact N-OG1 3.06Å; T406-T409 VanDerWaalsContact N-OG1 3.09Å; T406-T409 PolarHBondContact O-N 3.02Å; T406-T409 PolarHBondContact O-OG1 3.08Å; T406-T409 PolarHBondContact OG1-N 3.2Å; E407-T409 PolarHBondContact O-N 3.24Å; T409-L413 WeakPolarHBondContact O-CB 3.5Å; T409-L413 PolarHBondContact O-N 3.4Å
410	T	96.7	Very high	95	Very high	53 Å²	53	109.4 Å²	109.4	33%	0.325	57%	0.565	S	S	.	*	H	α-helix	trans	-71.4	-39.4	175.4	50.9	0	0	0	0	111.8	I405 T406 E407 L413 E414	I405-T410 HydrophobicContact CG2-CG2 3.57Å; T406-T410 PolarHBondContact O-N 3.3Å; E407-T410 WeakPolarHBondContact CA-OG1 3.43Å; E407-T410 PolarHBondContact O-N 3.19Å; E407-T410 PolarHBondContact O-OG1 2.74Å; T410-L413 PolarHBondContact O-N 2.97Å; T410-E414 WeakPolarHBondContact O-CB 3.31Å; T410-E414 WeakPolarHBondContact O-CG 3.39Å; T410-E414 PolarHBondContact O-N 3.42Å
411	L	96.9	Very high	95.3	Very high	96 Å²	96	102.4 Å²	102.4	50%	0.503	55%	0.545	S	S	.	.	H	α-helix	trans	-62.5	-43.5	174.7	-72.7	168.5	0	0	0	111.9	E407 L413 E414 D415	E407-L411 WeakPolarHBondContact O-CB 3.33Å; E407-L411 VanDerWaalsContact O-CG 3.26Å; E407-L411 WeakPolarHBondContact O-CG 3.13Å; E407-L411 PolarHBondContact O-N 3.16Å; L411-L413 VanDerWaalsContact C-N 3.35Å; L411-L413 PolarHBondContact O-N 2.56Å; L411-E414 PolarHBondContact O-N 3.4Å; L411-D415 PolarHBondContact O-N 2.81Å
412	Q	96.9	Very high	95.7	Very high	127 Å²	127	104.6 Å²	104.6	59%	0.593	55%	0.549	S	S	*	.	H	α-helix	trans	-62	-41	174.7	-71.6	172.2	29.2	0	0	112.3	E408 D415 I416	E408-Q412 VanDerWaalsContact O-CG 3.3Å; E408-Q412 WeakPolarHBondContact O-CG 3.3Å; E408-Q412 PolarHBondContact O-N 3.1Å; E408-Q412 VanDerWaalsContact O-N 3.11Å; Q412-D415 PolarHBondContact O-N 2.64Å; Q412-I416 WeakPolarHBondContact O-CG1 3.33Å; Q412-I416 PolarHBondContact O-N 3.36Å; Q412-I416 VanDerWaalsContact O-N 3.15Å
413	L	96.8	Very high	95.8	Very high	104 Å²	104	106 Å²	106	55%	0.545	54%	0.544	S	S	.	.	H	α-helix	trans	-66.5	-44.1	176.8	179.9	61.2	0	0	0	111.9	T409 T410 L411 D415 I416 I417	T409-L413 WeakPolarHBondContact O-CB 3.5Å; T409-L413 PolarHBondContact O-N 3.4Å; T410-L413 PolarHBondContact O-N 2.97Å; L411-L413 VanDerWaalsContact C-N 3.35Å; L411-L413 PolarHBondContact O-N 2.56Å; L413-D415 VanDerWaalsContact C-N 3.33Å; L413-D415 PolarHBondContact O-N 3.3Å; L413-I416 PolarHBondContact O-N 2.93Å; L413-I417 HydrophobicContact CD1-CD1 4.35Å; L413-I417 HydrophobicContact CG-CD1 4.06Å; L413-I417 WeakPolarHBondContact O-CG1 3.45Å; L413-I417 PolarHBondContact O-N 2.93Å
414	E	96.5	Very high	95.8	Very high	92 Å²	92	106.4 Å²	106.4	43%	0.43	54%	0.535	S	S	.	.	H	α-helix	trans	-57.5	-44.2	173.7	-83.9	-172	-153.7	0	0	112.1	T410 L411 I416 I417 K418	T410-E414 WeakPolarHBondContact O-CB 3.31Å; T410-E414 WeakPolarHBondContact O-CG 3.39Å; T410-E414 PolarHBondContact O-N 3.42Å; L411-E414 PolarHBondContact O-N 3.4Å; E414-I416 VanDerWaalsContact C-N 3.33Å; E414-I416 PolarHBondContact O-N 2.98Å; E414-I417 CarbonylContact O-C 3.6Å; E414-I417 WeakPolarHBondContact O-CA 3.36Å; E414-I417 WeakPolarHBondContact O-CB 3.37Å; E414-I417 PolarHBondContact O-N 3Å; E414-I417 VanDerWaalsContact O-N 3.08Å; E414-K418 VanDerWaalsContact O-CG 3.25Å; E414-K418 WeakPolarHBondContact O-CG 3.49Å; E414-K418 PolarHBondContact O-N 2.79Å; E414-K418 VanDerWaalsContact OE2-CE 3.31Å; E414-K418 WeakPolarHBondContact OE2-CE 3.23Å; E414-K418 IonicContact OE2-NZ 3.24Å; E414-K418 PolarHBondContact OE2-NZ 3.04Å
415	D	97.5	Very high	95.9	Very high	76 Å²	76	104.7 Å²	104.7	41%	0.406	52%	0.521	S	S	.	.	H	α-helix	trans	-69.4	-32.9	-177.5	-75	-2.4	0	0	0	112.1	L411 Q412 L413 K418 Q419	L411-D415 PolarHBondContact O-N 2.81Å; Q412-D415 PolarHBondContact O-N 2.64Å; L413-D415 VanDerWaalsContact C-N 3.33Å; L413-D415 PolarHBondContact O-N 3.3Å; D415-K418 WeakPolarHBondContact OD1-CD 3.39Å; D415-K418 IonicContact OD1-NZ 3.54Å; D415-K418 PolarHBondContact OD1-NZ 3.18Å; D415-Q419 WeakPolarHBondContact O-CB 3.27Å; D415-Q419 VanDerWaalsContact O-CG 3.23Å; D415-Q419 WeakPolarHBondContact O-CG 3.36Å; D415-Q419 PolarHBondContact O-N 3.13Å
416	I	97.1	Very high	95.8	Very high	94 Å²	94	103.2 Å²	103.2	48%	0.482	51%	0.509	S	S	.	.	H	α-helix	trans	-61.7	-45.2	166.7	-67.2	164.4	0	0	0	110.4	Q412 L413 E414 Q419 R420	Q412-I416 WeakPolarHBondContact O-CG1 3.33Å; Q412-I416 PolarHBondContact O-N 3.36Å; Q412-I416 VanDerWaalsContact O-N 3.15Å; L413-I416 PolarHBondContact O-N 2.93Å; E414-I416 VanDerWaalsContact C-N 3.33Å; E414-I416 PolarHBondContact O-N 2.98Å; I416-Q419 PolarHBondContact O-N 3.42Å; I416-R420 HydrophobicContact CG2-CG 4.38Å; I416-R420 VanDerWaalsContact O-CG 3.28Å; I416-R420 WeakPolarHBondContact O-CG 3.48Å; I416-R420 PolarHBondContact O-N 2.87Å
417	I	96.6	Very high	95.6	Very high	83 Å²	83	106.8 Å²	106.8	43%	0.426	53%	0.526	S	S	.	.	H	α-helix	trans	-63.9	-45.1	178.6	-68.4	163.4	0	0	0	111.3	L413 E414 Q419 R420 I421	L413-I417 HydrophobicContact CD1-CD1 4.35Å; L413-I417 HydrophobicContact CG-CD1 4.06Å; L413-I417 WeakPolarHBondContact O-CG1 3.45Å; L413-I417 PolarHBondContact O-N 2.93Å; E414-I417 CarbonylContact O-C 3.6Å; E414-I417 WeakPolarHBondContact O-CA 3.36Å; E414-I417 WeakPolarHBondContact O-CB 3.37Å; E414-I417 PolarHBondContact O-N 3Å; E414-I417 VanDerWaalsContact O-N 3.08Å; I417-Q419 VanDerWaalsContact C-N 3.3Å; I417-Q419 PolarHBondContact O-N 2.96Å; I417-R420 PolarHBondContact O-N 2.87Å; I417-I421 HydrophobicContact CG2-CD1 3.73Å; I417-I421 HydrophobicContact CG2-CG1 4.44Å; I417-I421 WeakPolarHBondContact O-CG1 3.47Å; I417-I421 PolarHBondContact O-N 3.08Å
418	K	97.1	Very high	95.4	Very high	102 Å²	102	105.1 Å²	105.1	44%	0.443	52%	0.522	S	S	.	.	H	α-helix	trans	-58.1	-41.9	175.5	-68	162.6	-159.4	154.9	0	111	E414 D415 K422	E414-K418 VanDerWaalsContact O-CG 3.25Å; E414-K418 WeakPolarHBondContact O-CG 3.49Å; E414-K418 PolarHBondContact O-N 2.79Å; E414-K418 VanDerWaalsContact OE2-CE 3.31Å; E414-K418 WeakPolarHBondContact OE2-CE 3.23Å; E414-K418 IonicContact OE2-NZ 3.24Å; E414-K418 PolarHBondContact OE2-NZ 3.04Å; D415-K418 WeakPolarHBondContact OD1-CD 3.39Å; D415-K418 IonicContact OD1-NZ 3.54Å; D415-K418 PolarHBondContact OD1-NZ 3.18Å; K418-K422 VanDerWaalsContact O-CB 3.27Å; K418-K422 WeakPolarHBondContact O-CB 3.26Å; K418-K422 PolarHBondContact O-N 3.41Å
419	Q	97	Very high	95	Very high	119 Å²	119	104.8 Å²	104.8	56%	0.556	53%	0.53	S	S	*	.	H	α-helix	trans	-65.3	-48.7	174.1	-72	172.2	27.7	0	0	112.1	D415 I416 I417 I421 K422 D423	D415-Q419 WeakPolarHBondContact O-CB 3.27Å; D415-Q419 VanDerWaalsContact O-CG 3.23Å; D415-Q419 WeakPolarHBondContact O-CG 3.36Å; D415-Q419 PolarHBondContact O-N 3.13Å; I416-Q419 PolarHBondContact O-N 3.42Å; I417-Q419 VanDerWaalsContact C-N 3.3Å; I417-Q419 PolarHBondContact O-N 2.96Å; Q419-I421 VanDerWaalsContact C-N 3.31Å; Q419-I421 PolarHBondContact O-N 3.41Å; Q419-K422 PolarHBondContact O-N 3.31Å; Q419-D423 WeakPolarHBondContact O-CB 3.23Å; Q419-D423 PolarHBondContact O-N 3.34Å
420	R	96.7	Very high	94.4	Very high	108 Å²	108	108.5 Å²	108.5	41%	0.408	54%	0.543	S	S	.	.	H	α-helix	trans	-54.9	-44.3	177	-71	-68.5	-154	110.2	5.7	112.5	I416 I417 Q424 A425 D427	I416-R420 HydrophobicContact CG2-CG 4.38Å; I416-R420 VanDerWaalsContact O-CG 3.28Å; I416-R420 WeakPolarHBondContact O-CG 3.48Å; I416-R420 PolarHBondContact O-N 2.87Å; I417-R420 PolarHBondContact O-N 2.87Å; R420-Q424 PolarHBondContact O-N 2.92Å; R420-Q424 VanDerWaalsContact O-N 3.09Å; R420-A425 PolarHBondContact NH1-O 2.66Å; R420-A425 PolarHBondContact O-N 2.68Å; R420-D427 IonicContact CZ-OD2 2.66Å; R420-D427 IonicContact NH1-OD1 2.69Å; R420-D427 IonicContact NH1-OD2 2.91Å; R420-D427 PolarHBondContact NH1-OD2 2.79Å; R420-D427 IonicContact NH2-OD2 3.72Å; R420-D427 PolarHBondContact NH2-OD2 2.96Å
421	I	96.5	Very high	93.8	Very high	95 Å²	95	117.6 Å²	117.6	49%	0.487	57%	0.571	S	S	.	*	H	α-helix	trans	-66.3	-46.1	178.4	-67.9	167.8	0	0	0	110.8	I417 Q419 D423 Q424 F426	I417-I421 HydrophobicContact CG2-CD1 3.73Å; I417-I421 HydrophobicContact CG2-CG1 4.44Å; I417-I421 WeakPolarHBondContact O-CG1 3.47Å; I417-I421 PolarHBondContact O-N 3.08Å; Q419-I421 VanDerWaalsContact C-N 3.31Å; Q419-I421 PolarHBondContact O-N 3.41Å; I421-D423 VanDerWaalsContact C-N 3.32Å; I421-D423 PolarHBondContact O-N 2.94Å; I421-Q424 PolarHBondContact O-N 3.43Å; I421-Q424 VanDerWaalsContact O-N 3.08Å; I421-F426 HydrophobicContact CB-CZ 4.48Å; I421-F426 HydrophobicContact CG1-CE1 4.07Å; I421-F426 HydrophobicContact CG1-CZ 4.2Å
422	K	96.4	Very high	93.1	Very high	175 Å²	175	122.6 Å²	122.6	76%	0.761	59%	0.589	S	S	*	*	H	α-helix	trans	-59.7	-40.3	178	-175.9	179.3	-178.2	179.3	0	112.7	K418 Q419 Q424	K418-K422 VanDerWaalsContact O-CB 3.27Å; K418-K422 WeakPolarHBondContact O-CB 3.26Å; K418-K422 PolarHBondContact O-N 3.41Å; Q419-K422 PolarHBondContact O-N 3.31Å; K422-Q424 VanDerWaalsContact C-N 3.29Å
423	D	94.6	Very high	92	Very high	122 Å²	122	123.3 Å²	123.3	65%	0.652	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.8	-7	178	-68.9	-14.3	0	0	0	113.2	Q419 I421 A425	Q419-D423 WeakPolarHBondContact O-CB 3.23Å; Q419-D423 PolarHBondContact O-N 3.34Å; I421-D423 VanDerWaalsContact C-N 3.32Å; I421-D423 PolarHBondContact O-N 2.94Å; D423-A425 HydrophobicContact CB-CB 4.13Å; D423-A425 PolarHBondContact O-N 2.96Å
424	Q	90.9	Very high	90.9	Very high	131 Å²	131	127 Å²	127	61%	0.612	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	55.8	33	-172.1	-54.3	-173.3	-22.6	0	0	113	R420 I421 K422 F426	R420-Q424 PolarHBondContact O-N 2.92Å; R420-Q424 VanDerWaalsContact O-N 3.09Å; I421-Q424 PolarHBondContact O-N 3.43Å; I421-Q424 VanDerWaalsContact O-N 3.08Å; K422-Q424 VanDerWaalsContact C-N 3.29Å; Q424-F426 HydrophobicContact CB-CE2 4.27Å; Q424-F426 PolarHBondContact O-N 2.69Å
425	A	92.8	Very high	89.5	Confident	43 Å²	43	128.1 Å²	128.1	36%	0.355	62%	0.619	S	S	.	*			trans	-94	65.8	-172.5	0	0	0	0	0	111.9	R420 D423	R420-A425 PolarHBondContact NH1-O 2.66Å; R420-A425 PolarHBondContact O-N 2.68Å; D423-A425 HydrophobicContact CB-CB 4.13Å; D423-A425 PolarHBondContact O-N 2.96Å
426	F	91.9	Very high	87.9	Confident	117 Å²	117	131.8 Å²	131.8	51%	0.513	63%	0.631	S	S	.	*			trans	-89.2	136.5	178.1	-54.8	-75.6	0	0	0	111.4	I421 Q424 D428	I421-F426 HydrophobicContact CB-CZ 4.48Å; I421-F426 HydrophobicContact CG1-CE1 4.07Å; I421-F426 HydrophobicContact CG1-CZ 4.2Å; Q424-F426 HydrophobicContact CB-CE2 4.27Å; Q424-F426 PolarHBondContact O-N 2.69Å; F426-D428 PolarHBondContact O-N 2.81Å
427	D	92.4	Very high	86	Confident	134 Å²	134	133.3 Å²	133.3	72%	0.717	64%	0.636	S	S	*	*			trans	-87.9	21.3	178.9	-64.4	-52	0	0	0	112.4	R420	R420-D427 IonicContact CZ-OD2 2.66Å; R420-D427 IonicContact NH1-OD1 2.69Å; R420-D427 IonicContact NH1-OD2 2.91Å; R420-D427 PolarHBondContact NH1-OD2 2.79Å; R420-D427 IonicContact NH2-OD2 3.72Å; R420-D427 PolarHBondContact NH2-OD2 2.96Å
428	D	90.1	Very high	84	Confident	129 Å²	129	136.6 Å²	136.6	69%	0.69	65%	0.65	S	S	*	*			trans	-65.4	145	-174.8	-67.5	-30.5	0	0	0	113.4	F426 E430	F426-D428 PolarHBondContact O-N 2.81Å; D428-E430 PolarHBondContact O-N 2.74Å; D428-E430 VanDerWaalsContact O-N 3.07Å
429	V	87.7	Confident	82.2	Confident	137 Å²	137	135.3 Å²	135.3	83%	0.83	65%	0.65	S	S	*	*			trans	-74.2	102.3	178.5	-176.5	0	0	0	0	110.8	R431	V429-R431 PolarHBondContact O-N 3.45Å
430	E	82.6	Confident	80	Confident	141 Å²	141	135.5 Å²	135.5	66%	0.659	65%	0.65	S	S	*	*			trans	-52.7	127.3	174.3	-72.2	-163.6	151.3	0	0	112	D428 K432	D428-E430 PolarHBondContact O-N 2.74Å; D428-E430 VanDerWaalsContact O-N 3.07Å; E430-K432 PolarHBondContact O-N 2.66Å
431	R	85.3	Confident	77.9	Confident	245 Å²	245	138 Å²	138	93%	0.925	67%	0.666	S	S	*	*			trans	-61.3	108.9	173.5	-71.7	-173.6	179	-175.7	0.6	109.9	V429 E433	V429-R431 PolarHBondContact O-N 3.45Å; R431-E433 PolarHBondContact O-N 3.33Å
432	K	81.8	Confident	75.7	Confident	201 Å²	201	141.8 Å²	141.8	87%	0.874	68%	0.675	S	S	*	*			trans	-63.4	93.9	177.7	-66.4	172.1	-176	166.5	0	110.7	E430 K434	E430-K432 PolarHBondContact O-N 2.66Å; K432-K434 PolarHBondContact O-N 3.3Å
433	E	74.4	Confident	73.6	Confident	141 Å²	141	141.5 Å²	141.5	66%	0.659	67%	0.674	S	S	*	*			trans	-55.5	127.3	166.6	-75.6	-160.3	-169.8	0	0	109.2	R431 K436	R431-E433 PolarHBondContact O-N 3.33Å; E433-K436 IonicContact OE1-NZ 2.98Å; E433-K436 WeakPolarHBondContact OE2-CE 3.09Å; E433-K436 IonicContact OE2-NZ 2.59Å; E433-K436 PolarHBondContact OE2-NZ 2.99Å
434	K	73.2	Confident	71.8	Confident	181 Å²	181	142.1 Å²	142.1	79%	0.787	67%	0.671	S	S	*	*			trans	-54.5	131	166.7	-67	-179.2	-179.1	177.7	0	107.4	K432 K436	K432-K434 PolarHBondContact O-N 3.3Å; K434-K436 PolarHBondContact O-N 3.39Å
435	P	67.3	Low	69.9	Low	116 Å²	116	146.8 Å²	146.8	75%	0.753	68%	0.683	S	S	*	*			trans	-59	112	-178.2	23.8	-33	0	0	0	108.7	E437	P435-E437 PolarHBondContact O-N 3.01Å
436	K	63.1	Low	68.2	Low	153 Å²	153	152.6 Å²	152.6	67%	0.665	71%	0.707	S	S	*	*			trans	-68.9	90.6	171.4	-70.2	159.4	-176.1	153	0	106.2	E433 K434 E438	E433-K436 IonicContact OE1-NZ 2.98Å; E433-K436 WeakPolarHBondContact OE2-CE 3.09Å; E433-K436 IonicContact OE2-NZ 2.59Å; E433-K436 PolarHBondContact OE2-NZ 2.99Å; K434-K436 PolarHBondContact O-N 3.39Å; K436-E438 PolarHBondContact O-N 3.33Å
437	E	58	Low	66.8	Low	126 Å²	126	152.5 Å²	152.5	59%	0.589	72%	0.716	S	S	*	*			trans	-52.2	113.5	170.7	-65.1	-172.7	152.1	0	0	106.9	P435 V439	P435-E437 PolarHBondContact O-N 3.01Å; E437-V439 VanDerWaalsContact C-N 3.29Å; E437-V439 WeakPolarHBondContact O-CG2 3.48Å; E437-V439 PolarHBondContact O-N 3.36Å
438	E	54.9	Low	65.9	Low	153 Å²	153	152.6 Å²	152.6	72%	0.715	72%	0.716	S	S	*	*			trans	-69.1	94.3	-177.8	-71.1	-170.6	179.6	0	0	107	K436 F440 E441	K436-E438 PolarHBondContact O-N 3.33Å; E438-F440 CarbonylContact O-C 3.57Å; E438-F440 PolarHBondContact O-N 3.14Å; E438-E441 PolarHBondContact O-N 3.34Å
439	V	58.9	Low	65.1	Low	74 Å²	74	152.8 Å²	152.8	45%	0.448	72%	0.717	S	S	.	*	T	Hydrogen-bonded Turn	trans	-46.7	-17.5	-178.4	-170.2	0	0	0	0	113.2	E437 P510 V512	E437-V439 VanDerWaalsContact C-N 3.29Å; E437-V439 WeakPolarHBondContact O-CG2 3.48Å; E437-V439 PolarHBondContact O-N 3.36Å; V439-P510 HydrophobicContact CG2-CB 4.11Å; V439-P510 HydrophobicContact CG2-CG 3.63Å; V439-V512 HydrophobicContact CG1-CG2 3.8Å
440	F	51.1	Low	64.8	Low	124 Å²	124	154.6 Å²	154.6	54%	0.544	72%	0.716	S	S	.	*	T	Hydrogen-bonded Turn	trans	-134.5	81.4	173.1	-64.2	-76	0	0	0	113.1	E438 Y442	E438-F440 CarbonylContact O-C 3.57Å; E438-F440 PolarHBondContact O-N 3.14Å; F440-Y442 HydrophobicContact CB-CD2 3.7Å; F440-Y442 HydrophobicContact CB-CG 4.4Å; F440-Y442 AromaticContact CD1-CD2 3.37Å; F440-Y442 HydrophobicContact CD1-CD2 3.37Å; F440-Y442 AromaticContact CD1-CE2 3.47Å; F440-Y442 HydrophobicContact CD1-CE2 3.47Å; F440-Y442 VanDerWaalsContact CD1-CE2 3.47Å; F440-Y442 HydrophobicContact CD1-CG 4.32Å; F440-Y442 HydrophobicContact CE1-CD2 4.18Å; F440-Y442 AromaticContact CE1-CE2 3.8Å; F440-Y442 HydrophobicContact CE1-CE2 3.8Å; F440-Y442 AromaticContact CG-CD2 3.69Å; F440-Y442 HydrophobicContact CG-CD2 3.69Å; F440-Y442 HydrophobicContact CG-CE2 4.08Å; F440-Y442 PolarHBondContact O-N 2.72Å
441	E	52.7	Low	64.8	Low	160 Å²	160	154.7 Å²	154.7	75%	0.748	72%	0.716	S	S	*	*			trans	-65.4	67.1	140.4	-78.2	-147.8	161.1	0	0	108.5	E438 K443	E438-E441 PolarHBondContact O-N 3.34Å; E441-K443 CarbonylContact O-C 3.56Å; E441-K443 PolarHBondContact O-N 2.95Å
442	Y	49.6	Very low	64.8	Low	175 Å²	175	152.3 Å²	152.3	69%	0.686	71%	0.713	S	S	*	*			trans	-57.1	-14.6	-162.9	-145.3	-73.7	0	0	0	114.1	F440	F440-Y442 HydrophobicContact CB-CD2 3.7Å; F440-Y442 HydrophobicContact CB-CG 4.4Å; F440-Y442 AromaticContact CD1-CD2 3.37Å; F440-Y442 HydrophobicContact CD1-CD2 3.37Å; F440-Y442 AromaticContact CD1-CE2 3.47Å; F440-Y442 HydrophobicContact CD1-CE2 3.47Å; F440-Y442 VanDerWaalsContact CD1-CE2 3.47Å; F440-Y442 HydrophobicContact CD1-CG 4.32Å; F440-Y442 HydrophobicContact CE1-CD2 4.18Å; F440-Y442 AromaticContact CE1-CE2 3.8Å; F440-Y442 HydrophobicContact CE1-CE2 3.8Å; F440-Y442 AromaticContact CG-CD2 3.69Å; F440-Y442 HydrophobicContact CG-CD2 3.69Å; F440-Y442 HydrophobicContact CG-CE2 4.08Å; F440-Y442 PolarHBondContact O-N 2.72Å
443	K	52.3	Low	64.9	Low	168 Å²	168	146.7 Å²	146.7	73%	0.73	70%	0.699	S	S	*	*	S	Bend	trans	-141.2	101.8	170.7	-60.6	-169.5	-178.9	-165.1	0	109.4	E441 R445	E441-K443 CarbonylContact O-C 3.56Å; E441-K443 PolarHBondContact O-N 2.95Å; K443-R445 PolarHBondContact O-N 2.74Å
444	K	57.1	Low	65.5	Low	135 Å²	135	148.8 Å²	148.8	59%	0.587	71%	0.706	S	S	*	*			trans	-52	138.2	162.1	-168.7	171.8	-173.8	172	0	107.7	L446	K444-L446 PolarHBondContact O-N 3.36Å
445	R	51.8	Low	66.2	Low	230 Å²	230	143.6 Å²	143.6	87%	0.868	68%	0.684	S	S	*	*			trans	-64.7	101.9	-177.2	-69.6	-173.6	-176.5	-173.7	3.4	109.6	K443 T447	K443-R445 PolarHBondContact O-N 2.74Å; R445-T447 PolarHBondContact O-N 3.5Å
446	L	57.1	Low	67.3	Low	164 Å²	164	141.2 Å²	141.2	86%	0.859	67%	0.671	S	S	*	*			trans	-55.1	103.4	179.8	-173.3	70.6	0	0	0	110	K444 L448	K444-L446 PolarHBondContact O-N 3.36Å; L446-L448 PolarHBondContact O-N 2.94Å
447	T	61.7	Low	68.4	Low	115 Å²	115	139.6 Å²	139.6	71%	0.706	67%	0.668	S	S	*	*			trans	-72.8	109.2	175.9	43.1	0	0	0	0	107.9	R445 D449	R445-T447 PolarHBondContact O-N 3.5Å; T447-D449 PolarHBondContact O-N 3.06Å; T447-D449 VanDerWaalsContact O-N 3.07Å
448	L	73.9	Confident	69.9	Low	137 Å²	137	136.9 Å²	136.9	72%	0.717	67%	0.668	S	S	*	*			trans	-70.7	103.8	178.4	177.2	62.4	0	0	0	109.7	L446 H450	L446-L448 PolarHBondContact O-N 2.94Å; L448-H450 PolarHBondContact O-CE1 3.42Å; L448-H450 VanDerWaalsContact O-CE1 3.3Å; L448-H450 PolarHBondContact O-N 3.34Å; L448-H450 PolarHBondContact O-ND1 3.15Å; L448-H450 VanDerWaalsContact O-ND1 3.1Å
449	D	72.8	Confident	71.5	Confident	132 Å²	132	133.1 Å²	133.1	71%	0.706	65%	0.65	S	S	*	*			trans	-56.7	133.9	174.2	-71.7	-32	0	0	0	111.2	T447	T447-D449 PolarHBondContact O-N 3.06Å; T447-D449 VanDerWaalsContact O-N 3.07Å
450	H	80.6	Confident	72.9	Confident	175 Å²	175	132.9 Å²	132.9	81%	0.81	65%	0.646	S	S	*	*			trans	-99.7	4.5	178.9	-67.2	-14.8	0	0	0	112.8	L448	L448-H450 PolarHBondContact O-CE1 3.42Å; L448-H450 VanDerWaalsContact O-CE1 3.3Å; L448-H450 PolarHBondContact O-N 3.34Å; L448-H450 PolarHBondContact O-ND1 3.15Å; L448-H450 VanDerWaalsContact O-ND1 3.1Å
451	E	84.4	Confident	74.8	Confident	143 Å²	143	133.9 Å²	133.9	67%	0.668	65%	0.647	S	S	*	*	S	Bend	trans	-70.3	156.7	167.4	-63.6	-156.2	156.9	0	0	111.3	S453 K454	E451-S453 PolarHBondContact O-N 2.89Å; E451-K454 IonicContact OE2-NZ 2.73Å; E451-K454 PolarHBondContact OE2-NZ 3.29Å
452	K	83.6	Confident	76.5	Confident	195 Å²	195	132 Å²	132	85%	0.848	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-73.6	129	172	-65.3	176.5	-176.8	173.1	0	108.8	K454	K452-K454 PolarHBondContact O-N 3.5Å
453	S	83.6	Confident	78.2	Confident	83 Å²	83	127 Å²	127	58%	0.58	62%	0.621	S	S	*	*	P	Polyproline II helix	trans	-51.9	134	177.4	-177.6	0	0	0	0	111.6	E451 Q455	E451-S453 PolarHBondContact O-N 2.89Å; S453-Q455 VanDerWaalsContact C-N 3.28Å; S453-Q455 PolarHBondContact OG-N 2.77Å; S453-Q455 PolarHBondContact OG-O 3.25Å
454	K	88.3	Confident	79.8	Confident	185 Å²	185	123.2 Å²	123.2	80%	0.804	61%	0.606	S	S	*	*	S	Bend	trans	-80.4	-12.1	176.4	-65.5	161.2	-172.7	154.7	0	111.8	E451 K452	E451-K454 IonicContact OE2-NZ 2.73Å; E451-K454 PolarHBondContact OE2-NZ 3.29Å; K452-K454 PolarHBondContact O-N 3.5Å
455	Q	87.2	Confident	81.2	Confident	72 Å²	72	124.2 Å²	124.2	34%	0.336	61%	0.607	S	S	.	*	S	Bend	trans	-101.8	152.7	-179.7	-63.2	-176.4	-6.2	0	0	112	S453 Q459 I460	S453-Q455 VanDerWaalsContact C-N 3.28Å; S453-Q455 PolarHBondContact OG-N 2.77Å; S453-Q455 PolarHBondContact OG-O 3.25Å; Q455-Q459 HydrophobicContact CB-CG 4.47Å; Q455-I460 HydrophobicContact CB-CG1 4.15Å
456	S	90.2	Very high	82.8	Confident	67 Å²	67	116.9 Å²	116.9	47%	0.469	58%	0.584	S	S	.	*			trans	-80.3	156.6	172.6	77.9	0	0	0	0	112.1	A458 Q459 I460	S456-A458 PolarHBondContact O-N 3.24Å; S456-Q459 WeakPolarHBondContact O-CB 3.22Å; S456-Q459 PolarHBondContact O-N 3.01Å; S456-Q459 WeakPolarHBondContact OG-CB 3.44Å; S456-Q459 PolarHBondContact OG-N 3.48Å; S456-I460 WeakPolarHBondContact O-CG1 3.38Å; S456-I460 PolarHBondContact O-N 2.91Å
457	L	86.4	Confident	83.9	Confident	118 Å²	118	115.3 Å²	115.3	62%	0.618	57%	0.571	S	S	*	*	H	α-helix	trans	-57.6	-36.2	178.2	-178.8	61.9	0	0	0	112.9	I460 Y461	L457-I460 PolarHBondContact O-N 3.08Å; L457-Y461 HydrophobicContact CD1-CD2 4.26Å; L457-Y461 HydrophobicContact CD1-CE2 3.72Å; L457-Y461 HydrophobicContact CD2-CE2 4.29Å; L457-Y461 HydrophobicContact CG-CD2 4.15Å; L457-Y461 HydrophobicContact CG-CE2 3.75Å; L457-Y461 WeakPolarHBondContact O-CD2 3.4Å; L457-Y461 PolarHBondContact O-N 3.49Å
458	A	88.9	Confident	84.5	Confident	70 Å²	70	115.1 Å²	115.1	58%	0.579	56%	0.561	S	S	*	*	H	α-helix	trans	-66.7	-39.3	176.4	0	0	0	0	0	112.2	S456 I460 Y461 E462	S456-A458 PolarHBondContact O-N 3.24Å; A458-I460 VanDerWaalsContact C-N 3.35Å; A458-Y461 PolarHBondContact O-N 3.49Å; A458-E462 PolarHBondContact O-N 2.89Å
459	Q	89.1	Confident	84.8	Confident	74 Å²	74	113.5 Å²	113.5	35%	0.346	55%	0.552	S	S	.	*	H	α-helix	trans	-68.5	-33.5	177.8	-174.3	179.8	18.3	0	0	112.2	Q455 S456 E462 Q463	Q455-Q459 HydrophobicContact CB-CG 4.47Å; S456-Q459 WeakPolarHBondContact O-CB 3.22Å; S456-Q459 PolarHBondContact O-N 3.01Å; S456-Q459 WeakPolarHBondContact OG-CB 3.44Å; S456-Q459 PolarHBondContact OG-N 3.48Å; Q459-E462 PolarHBondContact O-N 3.15Å; Q459-Q463 WeakPolarHBondContact O-CB 3.26Å; Q459-Q463 WeakPolarHBondContact O-CG 3.13Å; Q459-Q463 PolarHBondContact O-N 3.45Å
460	I	88.4	Confident	84.7	Confident	68 Å²	68	113.9 Å²	113.9	35%	0.349	55%	0.55	S	S	.	*	H	α-helix	trans	-63.8	-46.3	172.5	-65.7	168.2	0	0	0	109.9	Q455 S456 L457 A458 E462 Q463 E464	Q455-I460 HydrophobicContact CB-CG1 4.15Å; S456-I460 WeakPolarHBondContact O-CG1 3.38Å; S456-I460 PolarHBondContact O-N 2.91Å; L457-I460 PolarHBondContact O-N 3.08Å; A458-I460 VanDerWaalsContact C-N 3.35Å; I460-E462 PolarHBondContact O-N 3.02Å; I460-Q463 PolarHBondContact O-N 2.81Å; I460-E464 WeakPolarHBondContact O-CB 3.49Å; I460-E464 PolarHBondContact O-N 3.14Å
461	Y	90.3	Very high	83.5	Confident	145 Å²	145	111.9 Å²	111.9	57%	0.569	55%	0.545	S	S	*	.	H	α-helix	trans	-64.6	-36.7	176.1	-74.8	-55.5	0	0	0	113.4	L457 A458 E464 Y465	L457-Y461 HydrophobicContact CD1-CD2 4.26Å; L457-Y461 HydrophobicContact CD1-CE2 3.72Å; L457-Y461 HydrophobicContact CD2-CE2 4.29Å; L457-Y461 HydrophobicContact CG-CD2 4.15Å; L457-Y461 HydrophobicContact CG-CE2 3.75Å; L457-Y461 WeakPolarHBondContact O-CD2 3.4Å; L457-Y461 PolarHBondContact O-N 3.49Å; A458-Y461 PolarHBondContact O-N 3.49Å; Y461-E464 PolarHBondContact O-N 3.38Å; Y461-Y465 VanDerWaalsContact O-CB 3.28Å; Y461-Y465 WeakPolarHBondContact O-CB 3.43Å; Y461-Y465 PolarHBondContact O-N 3.01Å
462	E	89.3	Confident	81.8	Confident	121 Å²	121	114.2 Å²	114.2	57%	0.565	55%	0.553	S	S	*	*	H	α-helix	trans	-62.2	-47.4	173.9	-178.3	178.9	-163.8	0	0	111.4	A458 Q459 I460 Y465 I466	A458-E462 PolarHBondContact O-N 2.89Å; Q459-E462 PolarHBondContact O-N 3.15Å; I460-E462 PolarHBondContact O-N 3.02Å; E462-Y465 PolarHBondContact O-N 3.05Å; E462-I466 HydrophobicContact CG-CD1 4.1Å; E462-I466 VanDerWaalsContact O-CG1 3.3Å; E462-I466 WeakPolarHBondContact O-CG1 3.47Å; E462-I466 PolarHBondContact O-N 3.37Å
463	Q	86.3	Confident	80	Confident	69 Å²	69	110.4 Å²	110.4	32%	0.322	55%	0.546	S	S	.	.	H	α-helix	trans	-67.4	-37.9	177.3	-71	176.3	19.1	0	0	112.5	Q459 I460 I466 K467	Q459-Q463 WeakPolarHBondContact O-CB 3.26Å; Q459-Q463 WeakPolarHBondContact O-CG 3.13Å; Q459-Q463 PolarHBondContact O-N 3.45Å; I460-Q463 PolarHBondContact O-N 2.81Å; Q463-I466 PolarHBondContact O-N 3.44Å; Q463-K467 WeakPolarHBondContact O-CB 3.16Å; Q463-K467 WeakPolarHBondContact O-CG 3.38Å; Q463-K467 PolarHBondContact O-N 2.86Å
464	E	84.3	Confident	78.4	Confident	90 Å²	90	114 Å²	114	42%	0.421	55%	0.554	S	S	.	*	H	α-helix	trans	-62.4	-45.8	173.9	-170.7	-176.5	176.8	0	0	111	I460 Y461 I466 K467 Q468	I460-E464 WeakPolarHBondContact O-CB 3.49Å; I460-E464 PolarHBondContact O-N 3.14Å; Y461-E464 PolarHBondContact O-N 3.38Å; E464-I466 PolarHBondContact O-N 2.98Å; E464-K467 PolarHBondContact O-N 2.8Å; E464-Q468 HydrophobicContact CG-CG 4.48Å; E464-Q468 WeakPolarHBondContact O-CB 3.45Å; E464-Q468 VanDerWaalsContact O-CG 3.3Å; E464-Q468 WeakPolarHBondContact O-CG 3.4Å; E464-Q468 PolarHBondContact O-N 2.75Å; E464-Q468 PolarHBondContact OE1-NE2 3.03Å
465	Y	87.8	Confident	76.8	Confident	156 Å²	156	111.1 Å²	111.1	61%	0.612	54%	0.544	S	S	*	.	H	α-helix	trans	-62.7	-42.5	178	-175.1	-115.4	0	0	0	112.4	Y461 E462 Q468 I469	Y461-Y465 VanDerWaalsContact O-CB 3.28Å; Y461-Y465 WeakPolarHBondContact O-CB 3.43Å; Y461-Y465 PolarHBondContact O-N 3.01Å; E462-Y465 PolarHBondContact O-N 3.05Å; Y465-Q468 PolarHBondContact O-N 2.82Å; Y465-I469 HydrophobicContact CD1-CD1 3.88Å; Y465-I469 HydrophobicContact CD2-CD1 4.42Å; Y465-I469 HydrophobicContact CE1-CD1 3.51Å; Y465-I469 HydrophobicContact CE2-CD1 4.1Å; Y465-I469 HydrophobicContact CG-CD1 4.32Å; Y465-I469 WeakPolarHBondContact O-CG1 3.38Å; Y465-I469 PolarHBondContact O-N 2.85Å
466	I	85.8	Confident	75.6	Confident	75 Å²	75	116 Å²	116	39%	0.385	57%	0.567	S	S	.	*	H	α-helix	trans	-63.4	-45.3	175.1	-68	165.1	0	0	0	110.8	E462 Q463 E464 Q468 I469 Q470	E462-I466 HydrophobicContact CG-CD1 4.1Å; E462-I466 VanDerWaalsContact O-CG1 3.3Å; E462-I466 WeakPolarHBondContact O-CG1 3.47Å; E462-I466 PolarHBondContact O-N 3.37Å; Q463-I466 PolarHBondContact O-N 3.44Å; E464-I466 PolarHBondContact O-N 2.98Å; I466-Q468 PolarHBondContact O-N 3.36Å; I466-I469 PolarHBondContact O-N 3.46Å; I466-Q470 HydrophobicContact CG2-CG 4.43Å; I466-Q470 WeakPolarHBondContact O-CG 3.47Å; I466-Q470 PolarHBondContact O-N 3.42Å
467	K	80	Confident	74.2	Confident	132 Å²	132	119 Å²	119	57%	0.574	57%	0.573	S	S	*	*	H	α-helix	trans	-63.3	-40.3	177	-73.8	-177.3	176.2	-165	0	112.2	Q463 E464 I469 Q470 N471	Q463-K467 WeakPolarHBondContact O-CB 3.16Å; Q463-K467 WeakPolarHBondContact O-CG 3.38Å; Q463-K467 PolarHBondContact O-N 2.86Å; E464-K467 PolarHBondContact O-N 2.8Å; K467-I469 VanDerWaalsContact C-N 3.31Å; K467-I469 PolarHBondContact O-N 2.83Å; K467-Q470 PolarHBondContact O-N 3.34Å; K467-N471 PolarHBondContact O-N 3Å
468	Q	74.4	Confident	73.9	Confident	110 Å²	110	117.3 Å²	117.3	51%	0.514	57%	0.565	S	S	.	*	H	α-helix	trans	-65.6	-29.2	174.6	-73.8	179.5	15.3	0	0	113.3	E464 Y465 I466 N471	E464-Q468 HydrophobicContact CG-CG 4.48Å; E464-Q468 WeakPolarHBondContact O-CB 3.45Å; E464-Q468 VanDerWaalsContact O-CG 3.3Å; E464-Q468 WeakPolarHBondContact O-CG 3.4Å; E464-Q468 PolarHBondContact O-N 2.75Å; E464-Q468 PolarHBondContact OE1-NE2 3.03Å; Y465-Q468 PolarHBondContact O-N 2.82Å; I466-Q468 PolarHBondContact O-N 3.36Å; Q468-N471 PolarHBondContact O-ND2 2.98Å; Q468-N471 PolarHBondContact O-OD1 3.43Å
469	I	79.2	Confident	73.8	Confident	103 Å²	103	118.4 Å²	118.4	53%	0.528	57%	0.566	S	S	.	*	H	α-helix	trans	-76.5	-41.3	173.6	-72.9	168.2	0	0	0	111.3	Y465 I466 K467 N471	Y465-I469 HydrophobicContact CD1-CD1 3.88Å; Y465-I469 HydrophobicContact CD2-CD1 4.42Å; Y465-I469 HydrophobicContact CE1-CD1 3.51Å; Y465-I469 HydrophobicContact CE2-CD1 4.1Å; Y465-I469 HydrophobicContact CG-CD1 4.32Å; Y465-I469 WeakPolarHBondContact O-CG1 3.38Å; Y465-I469 PolarHBondContact O-N 2.85Å; I466-I469 PolarHBondContact O-N 3.46Å; K467-I469 VanDerWaalsContact C-N 3.31Å; K467-I469 PolarHBondContact O-N 2.83Å; I469-N471 PolarHBondContact O-N 3.34Å
470	Q	71.1	Confident	73.8	Confident	141 Å²	141	117.2 Å²	117.2	66%	0.659	57%	0.569	S	S	*	*	H	α-helix	trans	-73.5	-22.5	-173.3	-74.5	178.9	-28.2	0	0	114.2	I466 K467 K472	I466-Q470 HydrophobicContact CG2-CG 4.43Å; I466-Q470 WeakPolarHBondContact O-CG 3.47Å; I466-Q470 PolarHBondContact O-N 3.42Å; K467-Q470 PolarHBondContact O-N 3.34Å; Q470-K472 VanDerWaalsContact C-N 3.27Å; Q470-K472 PolarHBondContact O-N 2.63Å
471	N	54	Low	73.6	Confident	132 Å²	132	119 Å²	119	71%	0.706	58%	0.575	S	S	*	*			trans	47.4	39.8	165.9	-85.8	-45.6	0	0	0	116.2	K467 Q468 I469	K467-N471 PolarHBondContact O-N 3Å; Q468-N471 PolarHBondContact O-ND2 2.98Å; Q468-N471 PolarHBondContact O-OD1 3.43Å; I469-N471 PolarHBondContact O-N 3.34Å
472	K	49.6	Very low	73.6	Confident	193 Å²	193	114 Å²	114	84%	0.839	56%	0.56	S	S	*	*			trans	-138.7	150.3	163.2	-93.9	-177.4	176.8	-177.6	0	111.7	Q470	Q470-K472 VanDerWaalsContact C-N 3.27Å; Q470-K472 PolarHBondContact O-N 2.63Å
473	T	46.8	Very low	73.8	Confident	114 Å²	114	114 Å²	114	70%	0.699	56%	0.56	S	S	*	*			trans	-49	165.2	158.1	42.3	0	0	0	0	111.7
474	E	49.6	Very low	74.2	Confident	158 Å²	158	115.3 Å²	115.3	74%	0.738	57%	0.568	S	S	*	*			cis	-109.1	169.1	19.9	-62.2	74.6	-132.8	0	0	116.7
475	E	54.5	Low	74.5	Confident	126 Å²	126	116.4 Å²	116.4	59%	0.589	57%	0.573	S	S	*	*			trans	-65.5	133.9	148.8	-67.2	-169.7	154.6	0	0	107	E477	E475-E477 PolarHBondContact O-N 3.36Å
476	E	60.9	Low	74.8	Confident	175 Å²	175	115.4 Å²	115.4	82%	0.818	57%	0.572	S	S	*	*			trans	-60.8	101.6	-174.5	-71.5	171.4	-172.7	0	0	111.4	N478	E476-N478 PolarHBondContact O-N 3.06Å
477	E	62.2	Low	75.3	Confident	128 Å²	128	117.5 Å²	117.5	60%	0.598	58%	0.584	S	S	*	*			trans	-57.4	134	161.5	-64.7	-166.1	157.6	0	0	108.2	E475 P479 V482	E475-E477 PolarHBondContact O-N 3.36Å; E477-P479 VanDerWaalsContact O-N 3.16Å; E477-V482 HydrophobicContact CB-CG2 4.39Å
478	N	79.3	Confident	76	Confident	84 Å²	84	115.1 Å²	115.1	45%	0.449	58%	0.575	S	S	.	*			trans	-56	128	179.4	-66.9	-55.4	0	0	0	108.5	E476 A480 H481	E476-N478 PolarHBondContact O-N 3.06Å; N478-A480 PolarHBondContact O-N 3.19Å; N478-H481 PolarHBondContact ND2-NE2 3.43Å; N478-H481 WeakPolarHBondContact O-CB 3.47Å; N478-H481 PolarHBondContact O-N 3.17Å
479	P	86.6	Confident	76.9	Confident	92 Å²	92	112.8 Å²	112.8	60%	0.597	57%	0.566	S	S	*	*	H	α-helix	trans	-57.6	-29.3	-178.5	20.3	-31.9	0	0	0	111.9	E477 H481 V482 E483	E477-P479 VanDerWaalsContact O-N 3.16Å; P479-H481 VanDerWaalsContact C-N 3.33Å; P479-H481 PolarHBondContact O-N 3.07Å; P479-V482 PolarHBondContact O-N 3.24Å; P479-E483 WeakPolarHBondContact O-CB 3.12Å; P479-E483 WeakPolarHBondContact O-CG 3.46Å; P479-E483 PolarHBondContact O-N 2.86Å
480	A	88.8	Confident	77.7	Confident	50 Å²	50	111.3 Å²	111.3	41%	0.413	56%	0.562	S	S	.	*	H	α-helix	trans	-58.4	-34.4	171.4	0	0	0	0	0	114.3	N478 I484	N478-A480 PolarHBondContact O-N 3.19Å; A480-I484 VanDerWaalsContact O-CB 3.31Å; A480-I484 WeakPolarHBondContact O-CB 3.23Å; A480-I484 WeakPolarHBondContact O-CD1 3.23Å; A480-I484 WeakPolarHBondContact O-CG1 3.5Å; A480-I484 PolarHBondContact O-N 2.82Å
481	H	86	Confident	78.8	Confident	104 Å²	104	108.8 Å²	108.8	48%	0.481	55%	0.553	S	S	.	*	H	α-helix	trans	-69.4	-43.3	174	-67.8	-49.4	0	0	0	111	N478 P479 E483 I484 Q485	N478-H481 PolarHBondContact ND2-NE2 3.43Å; N478-H481 WeakPolarHBondContact O-CB 3.47Å; N478-H481 PolarHBondContact O-N 3.17Å; P479-H481 VanDerWaalsContact C-N 3.33Å; P479-H481 PolarHBondContact O-N 3.07Å; H481-E483 VanDerWaalsContact C-N 3.32Å; H481-E483 PolarHBondContact O-N 2.8Å; H481-I484 PolarHBondContact O-N 2.89Å; H481-Q485 WeakPolarHBondContact O-CB 3.49Å; H481-Q485 PolarHBondContact O-N 3.03Å
482	V	89.9	Confident	80.7	Confident	41 Å²	41	106.2 Å²	106.2	25%	0.248	54%	0.536	C	S	.	.	H	α-helix	trans	-64.9	-36.7	177.2	-177.3	0	0	0	0	111.3	E477 P479 K486	E477-V482 HydrophobicContact CB-CG2 4.39Å; P479-V482 PolarHBondContact O-N 3.24Å; V482-K486 HydrophobicContact CG1-CD 4.32Å; V482-K486 WeakPolarHBondContact O-CD 3.48Å; V482-K486 VanDerWaalsContact O-CG 3.26Å; V482-K486 WeakPolarHBondContact O-CG 3.19Å; V482-K486 PolarHBondContact O-N 2.84Å; V482-K486 VanDerWaalsContact O-N 3.13Å
483	E	93.8	Very high	82.8	Confident	121 Å²	121	102.9 Å²	102.9	57%	0.565	53%	0.526	S	S	*	.	H	α-helix	trans	-66.8	-46.9	172.1	-74.4	170.5	-168.8	0	0	111.9	P479 H481 Q485 K486 L487	P479-E483 WeakPolarHBondContact O-CB 3.12Å; P479-E483 WeakPolarHBondContact O-CG 3.46Å; P479-E483 PolarHBondContact O-N 2.86Å; H481-E483 VanDerWaalsContact C-N 3.32Å; H481-E483 PolarHBondContact O-N 2.8Å; E483-Q485 VanDerWaalsContact C-N 3.34Å; E483-Q485 PolarHBondContact O-N 3.15Å; E483-K486 PolarHBondContact O-N 2.59Å; E483-L487 WeakPolarHBondContact O-CB 3.5Å; E483-L487 WeakPolarHBondContact O-CG 3.42Å; E483-L487 PolarHBondContact O-N 2.98Å
484	I	93.8	Very high	85.1	Confident	97 Å²	97	104 Å²	104	50%	0.497	52%	0.522	S	S	.	.	H	α-helix	trans	-60.6	-42.6	176	-73.3	164	0	0	0	110.9	A480 H481 L487 M488	A480-I484 VanDerWaalsContact O-CB 3.31Å; A480-I484 WeakPolarHBondContact O-CB 3.23Å; A480-I484 WeakPolarHBondContact O-CD1 3.23Å; A480-I484 WeakPolarHBondContact O-CG1 3.5Å; A480-I484 PolarHBondContact O-N 2.82Å; H481-I484 PolarHBondContact O-N 2.89Å; I484-L487 PolarHBondContact O-N 3.43Å; I484-M488 VanDerWaalsContact O-CB 3.23Å; I484-M488 WeakPolarHBondContact O-CB 3.34Å; I484-M488 PolarHBondContact O-N 3.11Å
485	Q	90.9	Very high	87.2	Confident	113 Å²	113	100.4 Å²	100.4	53%	0.528	51%	0.507	S	S	.	.	H	α-helix	trans	-62	-47.5	177.9	-173	176.5	8.5	0	0	111.3	H481 E483 L487 M488 D489	H481-Q485 WeakPolarHBondContact O-CB 3.49Å; H481-Q485 PolarHBondContact O-N 3.03Å; E483-Q485 VanDerWaalsContact C-N 3.34Å; E483-Q485 PolarHBondContact O-N 3.15Å; Q485-L487 PolarHBondContact O-N 2.93Å; Q485-M488 WeakPolarHBondContact O-CB 3.39Å; Q485-M488 PolarHBondContact O-N 2.98Å; Q485-M488 VanDerWaalsContact O-N 3.15Å; Q485-D489 PolarHBondContact O-N 2.92Å
486	K	94.6	Very high	89	Confident	134 Å²	134	95.7 Å²	95.7	58%	0.583	49%	0.485	S	S	*	.	H	α-helix	trans	-59.9	-42.5	174.9	-72.1	165.6	-176	170.4	0	112.4	V482 E483 T490	V482-K486 HydrophobicContact CG1-CD 4.32Å; V482-K486 WeakPolarHBondContact O-CD 3.48Å; V482-K486 VanDerWaalsContact O-CG 3.26Å; V482-K486 WeakPolarHBondContact O-CG 3.19Å; V482-K486 PolarHBondContact O-N 2.84Å; V482-K486 VanDerWaalsContact O-N 3.13Å; E483-K486 PolarHBondContact O-N 2.59Å; K486-T490 WeakPolarHBondContact O-CB 3.39Å; K486-T490 VanDerWaalsContact O-CG2 3.3Å; K486-T490 WeakPolarHBondContact O-CG2 3.44Å; K486-T490 PolarHBondContact O-N 3.06Å; K486-T490 PolarHBondContact O-OG1 3.45Å
487	L	96	Very high	90.7	Very high	120 Å²	120	89.9 Å²	89.9	63%	0.628	47%	0.467	S	S	*	.	H	α-helix	trans	-64.6	-40.6	175.2	-71.7	172.7	0	0	0	111.6	E483 I484 Q485 T490 L491	E483-L487 WeakPolarHBondContact O-CB 3.5Å; E483-L487 WeakPolarHBondContact O-CG 3.42Å; E483-L487 PolarHBondContact O-N 2.98Å; I484-L487 PolarHBondContact O-N 3.43Å; Q485-L487 PolarHBondContact O-N 2.93Å; L487-T490 PolarHBondContact O-N 2.98Å; L487-T490 PolarHBondContact O-OG1 2.8Å; L487-T490 VanDerWaalsContact O-OG1 3.1Å; L487-L491 VanDerWaalsContact O-CB 3.32Å; L487-L491 WeakPolarHBondContact O-CB 3.46Å; L487-L491 PolarHBondContact O-N 3.27Å
488	M	93.9	Very high	92.2	Very high	81 Å²	81	90.7 Å²	90.7	40%	0.399	48%	0.475	S	S	.	.	H	α-helix	trans	-65	-46.2	178.5	-170.1	68	77.6	0	0	111.8	I484 Q485 L491 F492	I484-M488 VanDerWaalsContact O-CB 3.23Å; I484-M488 WeakPolarHBondContact O-CB 3.34Å; I484-M488 PolarHBondContact O-N 3.11Å; Q485-M488 WeakPolarHBondContact O-CB 3.39Å; Q485-M488 PolarHBondContact O-N 2.98Å; Q485-M488 VanDerWaalsContact O-N 3.15Å; M488-L491 WeakPolarHBondContact O-CB 3.43Å; M488-L491 PolarHBondContact O-N 3.37Å; M488-L491 VanDerWaalsContact O-N 3.14Å; M488-F492 HydrophobicContact CG-CD2 3.71Å; M488-F492 HydrophobicContact CG-CE2 3.32Å; M488-F492 HydrophobicContact CG-CZ 4.13Å; M488-F492 WeakPolarHBondContact O-CD2 3.48Å; M488-F492 PolarHBondContact O-N 3Å; M488-F492 HydrophobicContact SD-CD2 4.16Å; M488-F492 HydrophobicContact SD-CE1 4.46Å; M488-F492 HydrophobicContact SD-CE2 3.49Å; M488-F492 WeakPolarHBondContact SD-CE2 3.49Å; M488-F492 HydrophobicContact SD-CZ 3.65Å
489	D	93.1	Very high	92.9	Very high	61 Å²	61	88.8 Å²	88.8	33%	0.326	47%	0.468	S	S	.	.	H	α-helix	trans	-67.4	-37.6	177.7	-72.1	-41.6	0	0	0	112.1	Q485 L491 L493 K506	Q485-D489 PolarHBondContact O-N 2.92Å; D489-L491 PolarHBondContact O-N 2.99Å; D489-L493 VanDerWaalsContact O-CB 3.27Å; D489-L493 WeakPolarHBondContact O-CB 3.42Å; D489-L493 PolarHBondContact O-N 3.35Å; D489-K506 IonicContact OD1-NZ 2.71Å; D489-K506 PolarHBondContact OD1-NZ 3.23Å
490	T	96.3	Very high	93.2	Very high	73 Å²	73	89.8 Å²	89.8	45%	0.448	47%	0.469	S	S	.	.	H	α-helix	trans	-74.6	-10.3	172.5	62.1	0	0	0	0	114.4	K486 L487 K494	K486-T490 WeakPolarHBondContact O-CB 3.39Å; K486-T490 VanDerWaalsContact O-CG2 3.3Å; K486-T490 WeakPolarHBondContact O-CG2 3.44Å; K486-T490 PolarHBondContact O-N 3.06Å; K486-T490 PolarHBondContact O-OG1 3.45Å; L487-T490 PolarHBondContact O-N 2.98Å; L487-T490 PolarHBondContact O-OG1 2.8Å; L487-T490 VanDerWaalsContact O-OG1 3.1Å; T490-K494 WeakPolarHBondContact O-CD 3.44Å; T490-K494 WeakPolarHBondContact O-CE 3.18Å; T490-K494 WeakPolarHBondContact O-CG 3.38Å; T490-K494 PolarHBondContact O-NZ 2.77Å
491	L	95.3	Very high	93.3	Very high	88 Å²	88	93.8 Å²	93.8	46%	0.461	48%	0.477	S	S	.	.	H	α-helix	trans	-88.3	-52.5	170.5	176.7	62.1	0	0	0	110.2	L487 M488 D489 L493 K494 L495	L487-L491 VanDerWaalsContact O-CB 3.32Å; L487-L491 WeakPolarHBondContact O-CB 3.46Å; L487-L491 PolarHBondContact O-N 3.27Å; M488-L491 WeakPolarHBondContact O-CB 3.43Å; M488-L491 PolarHBondContact O-N 3.37Å; M488-L491 VanDerWaalsContact O-N 3.14Å; D489-L491 PolarHBondContact O-N 2.99Å; L491-L493 PolarHBondContact O-N 3.4Å; L491-K494 WeakPolarHBondContact O-CB 3.22Å; L491-K494 PolarHBondContact O-N 2.82Å; L491-K494 VanDerWaalsContact O-N 3.07Å; L491-L495 HydrophobicContact CD1-CD1 4.13Å; L491-L495 HydrophobicContact CD1-CG 4.26Å; L491-L495 HydrophobicContact CG-CD1 3.97Å; L491-L495 HydrophobicContact CG-CG 4.48Å; L491-L495 WeakPolarHBondContact O-CG 3.21Å; L491-L495 PolarHBondContact O-N 3.35Å
492	F	92.8	Very high	93.6	Very high	78 Å²	78	95.9 Å²	95.9	34%	0.342	49%	0.487	S	S	.	.	H	α-helix	trans	-57.5	-48.6	177.3	-71.8	-46.9	0	0	0	111.4	M488 K494 L495 D496	M488-F492 HydrophobicContact CG-CD2 3.71Å; M488-F492 HydrophobicContact CG-CE2 3.32Å; M488-F492 HydrophobicContact CG-CZ 4.13Å; M488-F492 WeakPolarHBondContact O-CD2 3.48Å; M488-F492 PolarHBondContact O-N 3Å; M488-F492 HydrophobicContact SD-CD2 4.16Å; M488-F492 HydrophobicContact SD-CE1 4.46Å; M488-F492 HydrophobicContact SD-CE2 3.49Å; M488-F492 WeakPolarHBondContact SD-CE2 3.49Å; M488-F492 HydrophobicContact SD-CZ 3.65Å; F492-K494 PolarHBondContact O-N 3.21Å; F492-L495 HydrophobicContact CD1-CD1 4.43Å; F492-L495 CarbonylContact O-C 3.49Å; F492-L495 WeakPolarHBondContact O-CA 3.48Å; F492-L495 PolarHBondContact O-N 2.65Å; F492-D496 WeakPolarHBondContact O-CB 3.5Å; F492-D496 PolarHBondContact O-N 3.13Å
493	L	93.2	Very high	93.5	Very high	122 Å²	122	98.1 Å²	98.1	64%	0.639	49%	0.493	S	S	*	.	H	α-helix	trans	-56.1	-24.9	177.8	-175	146.4	0	0	0	114	D489 L491 A497	D489-L493 VanDerWaalsContact O-CB 3.27Å; D489-L493 WeakPolarHBondContact O-CB 3.42Å; D489-L493 PolarHBondContact O-N 3.35Å; L491-L493 PolarHBondContact O-N 3.4Å; L493-A497 VanDerWaalsContact O-CB 3.31Å; L493-A497 WeakPolarHBondContact O-CB 3.5Å; L493-A497 PolarHBondContact O-N 3.3Å
494	K	95.4	Very high	93.2	Very high	139 Å²	139	98.5 Å²	98.5	60%	0.604	50%	0.504	S	S	*	.	H	α-helix	trans	-85.7	-34.4	173.2	-66.8	171.3	-170.4	153.9	0	113.3	T490 L491 F492 L498	T490-K494 WeakPolarHBondContact O-CD 3.44Å; T490-K494 WeakPolarHBondContact O-CE 3.18Å; T490-K494 WeakPolarHBondContact O-CG 3.38Å; T490-K494 PolarHBondContact O-NZ 2.77Å; L491-K494 WeakPolarHBondContact O-CB 3.22Å; L491-K494 PolarHBondContact O-N 2.82Å; L491-K494 VanDerWaalsContact O-N 3.07Å; F492-K494 PolarHBondContact O-N 3.21Å; K494-L498 VanDerWaalsContact O-CB 3.25Å; K494-L498 WeakPolarHBondContact O-CB 3.4Å; K494-L498 PolarHBondContact O-N 3.49Å
495	L	93.3	Very high	92.9	Very high	82 Å²	82	99 Å²	99	43%	0.429	51%	0.514	S	S	.	.	H	α-helix	trans	-71.8	-42	175.7	-67.1	174	0	0	0	110.9	L491 F492 A497 L498 S499	L491-L495 HydrophobicContact CD1-CD1 4.13Å; L491-L495 HydrophobicContact CD1-CG 4.26Å; L491-L495 HydrophobicContact CG-CD1 3.97Å; L491-L495 HydrophobicContact CG-CG 4.48Å; L491-L495 WeakPolarHBondContact O-CG 3.21Å; L491-L495 PolarHBondContact O-N 3.35Å; F492-L495 HydrophobicContact CD1-CD1 4.43Å; F492-L495 CarbonylContact O-C 3.49Å; F492-L495 WeakPolarHBondContact O-CA 3.48Å; F492-L495 PolarHBondContact O-N 2.65Å; L495-A497 VanDerWaalsContact C-N 3.35Å; L495-L498 CarbonylContact O-C 3.59Å; L495-L498 WeakPolarHBondContact O-CB 3.42Å; L495-L498 PolarHBondContact O-N 3.32Å; L495-L498 VanDerWaalsContact O-N 3.12Å; L495-S499 PolarHBondContact O-N 3.26Å; L495-S499 PolarHBondContact O-OG 3.19Å
496	D	94.1	Very high	92.6	Very high	26 Å²	26	99.4 Å²	99.4	14%	0.139	51%	0.514	C	S	.	.	H	α-helix	trans	-63.1	-42.1	175.6	-53.2	-20.2	0	0	0	110.1	F492 S499 N500 F501 F503	F492-D496 WeakPolarHBondContact O-CB 3.5Å; F492-D496 PolarHBondContact O-N 3.13Å; D496-S499 PolarHBondContact O-N 3.11Å; D496-S499 PolarHBondContact O-OG 2.77Å; D496-S499 VanDerWaalsContact O-OG 3.13Å; D496-N500 PolarHBondContact O-N 3Å; D496-F501 HydrophobicContact CB-CD1 4.02Å; D496-F501 HydrophobicContact CB-CE1 4.16Å; D496-F501 VanDerWaalsContact O-CA 3.3Å; D496-F501 WeakPolarHBondContact O-CA 3.26Å; D496-F501 PolarHBondContact O-N 2.88Å; D496-F503 HydrophobicContact CB-CD1 3.91Å; D496-F503 HydrophobicContact CB-CE1 3.88Å; D496-F503 HydrophobicContact CB-CG 4.38Å; D496-F503 HydrophobicContact CB-CZ 4.28Å
497	A	94.9	Very high	92	Very high	53 Å²	53	98 Å²	98	44%	0.438	52%	0.518	S	S	.	.	H	α-helix	trans	-66.5	-34.8	172.1	0	0	0	0	0	112.9	L493 L495 N500 F501	L493-A497 VanDerWaalsContact O-CB 3.31Å; L493-A497 WeakPolarHBondContact O-CB 3.5Å; L493-A497 PolarHBondContact O-N 3.3Å; L495-A497 VanDerWaalsContact C-N 3.35Å; A497-N500 PolarHBondContact O-N 3.3Å; A497-F501 HydrophobicContact CB-CE2 4.49Å; A497-F501 HydrophobicContact CB-CZ 4.11Å
498	L	95	Very high	91.3	Very high	146 Å²	146	98.4 Å²	98.4	76%	0.764	53%	0.528	S	S	*	.	H	α-helix	trans	-71.4	-28.4	176.9	-176.6	64.7	0	0	0	112.7	K494 L495 N500	K494-L498 VanDerWaalsContact O-CB 3.25Å; K494-L498 WeakPolarHBondContact O-CB 3.4Å; K494-L498 PolarHBondContact O-N 3.49Å; L495-L498 CarbonylContact O-C 3.59Å; L495-L498 WeakPolarHBondContact O-CB 3.42Å; L495-L498 PolarHBondContact O-N 3.32Å; L495-L498 VanDerWaalsContact O-N 3.12Å; L498-N500 VanDerWaalsContact C-N 3.29Å
499	S	92.9	Very high	90.6	Very high	43 Å²	43	98.9 Å²	98.9	30%	0.301	54%	0.535	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	12.4	174.2	68.7	0	0	0	0	113.9	L495 D496 F501 H502	L495-S499 PolarHBondContact O-N 3.26Å; L495-S499 PolarHBondContact O-OG 3.19Å; D496-S499 PolarHBondContact O-N 3.11Å; D496-S499 PolarHBondContact O-OG 2.77Å; D496-S499 VanDerWaalsContact O-OG 3.13Å; S499-F501 PolarHBondContact O-N 3.1Å; S499-H502 WeakPolarHBondContact O-CB 2.97Å; S499-H502 PolarHBondContact O-CD2 3.18Å; S499-H502 PolarHBondContact O-N 3.36Å; S499-H502 PolarHBondContact OG-O 3.3Å
500	N	92.8	Very high	90	Very high	114 Å²	114	99.3 Å²	99.3	61%	0.61	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.1	35.8	-173.7	-168.5	65.3	0	0	0	112.7	D496 A497 L498 H502	D496-N500 PolarHBondContact O-N 3Å; A497-N500 PolarHBondContact O-N 3.3Å; L498-N500 VanDerWaalsContact C-N 3.29Å; N500-H502 PolarHBondContact ND2-NE2 3.1Å; N500-H502 VanDerWaalsContact ND2-NE2 3.1Å; N500-H502 PolarHBondContact O-N 3.41Å; N500-H502 VanDerWaalsContact O-N 3.16Å
501	F	90.6	Very high	89.2	Confident	134 Å²	134	102.2 Å²	102.2	59%	0.588	55%	0.55	S	S	*	*	T	Hydrogen-bonded Turn	trans	58.7	17	-173.8	-58	-83.4	0	0	0	115.3	D496 A497 S499 F503	D496-F501 HydrophobicContact CB-CD1 4.02Å; D496-F501 HydrophobicContact CB-CE1 4.16Å; D496-F501 VanDerWaalsContact O-CA 3.3Å; D496-F501 WeakPolarHBondContact O-CA 3.26Å; D496-F501 PolarHBondContact O-N 2.88Å; A497-F501 HydrophobicContact CB-CE2 4.49Å; A497-F501 HydrophobicContact CB-CZ 4.11Å; S499-F501 PolarHBondContact O-N 3.1Å; F501-F503 HydrophobicContact CB-CE1 4.34Å; F501-F503 HydrophobicContact CD1-CE1 4.18Å; F501-F503 VanDerWaalsContact O-CD1 3.32Å; F501-F503 WeakPolarHBondContact O-CD1 3.38Å; F501-F503 PolarHBondContact O-N 3.49Å
502	H	92.2	Very high	88.6	Confident	147 Å²	147	102.7 Å²	102.7	68%	0.681	56%	0.556	S	S	*	*			trans	-85.7	81	167.5	-54.6	-58.2	0	0	0	110.1	S499 N500	S499-H502 WeakPolarHBondContact O-CB 2.97Å; S499-H502 PolarHBondContact O-CD2 3.18Å; S499-H502 PolarHBondContact O-N 3.36Å; S499-H502 PolarHBondContact OG-O 3.3Å; N500-H502 PolarHBondContact ND2-NE2 3.1Å; N500-H502 VanDerWaalsContact ND2-NE2 3.1Å; N500-H502 PolarHBondContact O-N 3.41Å; N500-H502 VanDerWaalsContact O-N 3.16Å
503	F	88.4	Confident	88.2	Confident	88 Å²	88	106.5 Å²	106.5	39%	0.386	57%	0.573	S	S	.	*	S	Bend	trans	-137.5	158.1	178.7	69.6	-75.2	0	0	0	111.9	D496 F501	D496-F503 HydrophobicContact CB-CD1 3.91Å; D496-F503 HydrophobicContact CB-CE1 3.88Å; D496-F503 HydrophobicContact CB-CG 4.38Å; D496-F503 HydrophobicContact CB-CZ 4.28Å; F501-F503 HydrophobicContact CB-CE1 4.34Å; F501-F503 HydrophobicContact CD1-CE1 4.18Å; F501-F503 VanDerWaalsContact O-CD1 3.32Å; F501-F503 WeakPolarHBondContact O-CD1 3.38Å; F501-F503 PolarHBondContact O-N 3.49Å
504	T	88.1	Confident	87.8	Confident	129 Å²	129	107.1 Å²	107.1	79%	0.791	58%	0.581	S	S	*	*	P	Polyproline II helix	trans	-70.4	121.2	171.4	51.8	0	0	0	0	109.4
505	P	87.4	Confident	87.4	Confident	109 Å²	109	104.2 Å²	104.2	71%	0.708	58%	0.575	S	S	*	*	P	Polyproline II helix	trans	-61.2	151	-177.4	24.9	-34.4	0	0	0	111.6
506	K	84.5	Confident	87.1	Confident	120 Å²	120	103.6 Å²	103.6	52%	0.522	58%	0.577	S	S	.	*	P	Polyproline II helix	trans	-53.2	140.4	176.3	-68.6	-179.6	176.6	178.7	0	110.1	D489	D489-K506 IonicContact OD1-NZ 2.71Å; D489-K506 PolarHBondContact OD1-NZ 3.23Å
507	P	82.9	Confident	86.9	Confident	105 Å²	105	106.3 Å²	106.3	68%	0.682	59%	0.592	S	S	*	*	P	Polyproline II helix	trans	-60.1	143.4	179.7	25.7	-34.5	0	0	0	110.8	V509	P507-V509 PolarHBondContact O-N 2.85Å
508	P	79.9	Confident	86.5	Confident	128 Å²	128	107.2 Å²	107.2	83%	0.831	59%	0.589	S	S	*	*			trans	-72.4	96.4	-174.2	28.4	-34.9	0	0	0	111.6
509	V	80.3	Confident	86.2	Confident	91 Å²	91	103.1 Å²	103.1	55%	0.552	57%	0.571	S	S	*	*			trans	-75.6	135.4	171	-179.3	0	0	0	0	109.3	P507 E511	P507-V509 PolarHBondContact O-N 2.85Å; V509-E511 PolarHBondContact O-N 2.8Å
510	P	80.1	Confident	85.8	Confident	71 Å²	71	102.1 Å²	102.1	46%	0.461	56%	0.564	S	S	.	*			trans	-72.7	86.4	-179.3	29.2	-37	0	0	0	113.2	V439	V439-P510 HydrophobicContact CG2-CB 4.11Å; V439-P510 HydrophobicContact CG2-CG 3.63Å
511	E	78.9	Confident	85.4	Confident	134 Å²	134	101 Å²	101	63%	0.626	56%	0.557	S	S	*	*			trans	-71.8	121.8	175	-65.3	-177.9	165.5	0	0	112.9	V509 K513	V509-E511 PolarHBondContact O-N 2.8Å; E511-K513 PolarHBondContact O-N 2.99Å; E511-K513 WeakPolarHBondContact OE2-CE 3.28Å; E511-K513 IonicContact OE2-NZ 3.71Å; E511-K513 PolarHBondContact OE2-NZ 3.28Å
512	V	82.6	Confident	85.2	Confident	97 Å²	97	98.5 Å²	98.5	59%	0.588	55%	0.553	S	S	*	*			trans	-87	98.8	175.5	-178.1	0	0	0	0	110.7	V439 V514	V439-V512 HydrophobicContact CG1-CG2 3.8Å; V512-V514 HydrophobicContact CG1-CG2 4.34Å
513	K	84	Confident	84.8	Confident	158 Å²	158	97.7 Å²	97.7	69%	0.687	55%	0.551	S	S	*	*			trans	-91.3	106.7	177.1	-72.5	168.9	-177.7	158.5	0	110.7	E511 V515	E511-K513 PolarHBondContact O-N 2.99Å; E511-K513 WeakPolarHBondContact OE2-CE 3.28Å; E511-K513 IonicContact OE2-NZ 3.71Å; E511-K513 PolarHBondContact OE2-NZ 3.28Å; K513-V515 PolarHBondContact O-N 3.27Å
514	V	85.7	Confident	84.6	Confident	135 Å²	135	96.6 Å²	96.6	82%	0.818	55%	0.547	S	S	*	.			trans	-83.2	98.8	179	-177.6	0	0	0	0	109.9	V512	V512-V514 HydrophobicContact CG1-CG2 4.34Å
515	V	86.1	Confident	84.4	Confident	78 Å²	78	99.1 Å²	99.1	47%	0.473	55%	0.55	S	S	.	*			trans	-77.7	135.5	174.8	174.8	0	0	0	0	110.4	K513 L536 L537	K513-V515 PolarHBondContact O-N 3.27Å; V515-L536 HydrophobicContact CG1-CB 4.21Å; V515-L536 HydrophobicContact CG1-CD2 3.95Å; V515-L537 HydrophobicContact CG1-CD1 4.31Å
516	S	88.4	Confident	84.2	Confident	69 Å²	69	101.4 Å²	101.4	48%	0.483	56%	0.562	S	S	.	*			trans	-100.7	142.4	172.7	62.7	0	0	0	0	110.9	L518	S516-L518 PolarHBondContact O-N 3.07Å; S516-L518 WeakPolarHBondContact OG-CD1 3.23Å
517	N	88.5	Confident	84.1	Confident	83 Å²	83	98.7 Å²	98.7	44%	0.444	56%	0.562	S	S	.	*			trans	-71.6	92.2	177.2	-172.6	3	0	0	0	110.6	T535 L537	N517-T535 WeakPolarHBondContact OD1-CB 3.36Å; N517-L537 HydrophobicContact CB-CB 4Å; N517-L537 HydrophobicContact CB-CD2 3.98Å
518	L	87.5	Confident	84	Confident	73 Å²	73	100.3 Å²	100.3	38%	0.382	57%	0.572	S	S	.	*			trans	-122.3	154.7	174.5	-62	176.2	0	0	0	109.1	S516 T522 T535 L536	S516-L518 PolarHBondContact O-N 3.07Å; S516-L518 WeakPolarHBondContact OG-CD1 3.23Å; L518-T522 WeakPolarHBondContact CB-OG1 3.48Å; L518-T535 WeakPolarHBondContact O-CA 3.47Å; L518-L536 PolarHBondContact O-N 2.87Å
519	P	87.9	Confident	84	Confident	59 Å²	59	99.6 Å²	99.6	38%	0.383	57%	0.565	S	S	.	*	B	Isolated β-bridge	trans	-69.9	139.4	170.6	31.3	-33.8	0	0	0	110.2	I521 T522 A534	P519-I521 HydrophobicContact CB-CG2 4.06Å; P519-I521 HydrophobicContact CG-CG2 4.16Å; P519-I521 PolarHBondContact O-N 3.22Å; P519-I521 VanDerWaalsContact O-N 3.14Å; P519-T522 HydrophobicContact CG-CG2 4.03Å; P519-T522 PolarHBondContact O-N 3.45Å; P519-T522 PolarHBondContact O-OG1 2.82Å; P519-A534 CarbonylContact C-O 3.56Å; P519-A534 WeakPolarHBondContact CA-O 3.47Å
520	S	84.9	Confident	83.8	Confident	22 Å²	22	97.5 Å²	97.5	15%	0.154	56%	0.555	C	S	.	*	G	3₁₀ helix	trans	-56.1	-34.4	-170.5	-62.8	0	0	0	0	113.7	T522 M523 E524 S532 A534	S520-T522 PolarHBondContact O-N 2.78Å; S520-M523 WeakPolarHBondContact O-CA 3.17Å; S520-M523 PolarHBondContact O-N 3.27Å; S520-E524 PolarHBondContact O-N 3.32Å; S520-E524 VanDerWaalsContact O-N 3.1Å; S520-S532 VanDerWaalsContact CB-OG 3.3Å; S520-S532 WeakPolarHBondContact CB-OG 3.45Å; S520-A534 PolarHBondContact N-O 2.88Å; S520-A534 PolarHBondContact OG-O 2.84Å
521	I	85.2	Confident	83.4	Confident	91 Å²	91	100.4 Å²	100.4	47%	0.467	57%	0.571	S	S	.	*	G	3₁₀ helix	trans	-51.4	-19.1	171.2	-165.2	168.9	0	0	0	115.2	P519 S530	P519-I521 HydrophobicContact CB-CG2 4.06Å; P519-I521 HydrophobicContact CG-CG2 4.16Å; P519-I521 PolarHBondContact O-N 3.22Å; P519-I521 VanDerWaalsContact O-N 3.14Å; I521-S530 WeakPolarHBondContact CG1-OG 3.4Å
522	T	86.5	Confident	83.3	Confident	82 Å²	82	95.7 Å²	95.7	50%	0.503	55%	0.553	S	S	.	*	G	3₁₀ helix	trans	-86.8	-11.1	174.9	59	0	0	0	0	114.4	L518 P519 S520	L518-T522 WeakPolarHBondContact CB-OG1 3.48Å; P519-T522 HydrophobicContact CG-CG2 4.03Å; P519-T522 PolarHBondContact O-N 3.45Å; P519-T522 PolarHBondContact O-OG1 2.82Å; S520-T522 PolarHBondContact O-N 2.78Å
523	M	83.3	Confident	83.2	Confident	129 Å²	129	99.4 Å²	99.4	64%	0.635	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.2	-18.3	171.7	-67.1	-59.3	-48.9	0	0	112.5	S520 L536	S520-M523 WeakPolarHBondContact O-CA 3.17Å; S520-M523 PolarHBondContact O-N 3.27Å; M523-L536 HydrophobicContact CB-CD1 4.26Å; M523-L536 HydrophobicContact CG-CD1 3.89Å; M523-L536 HydrophobicContact CG-CD2 3.92Å
524	E	83.6	Confident	83.3	Confident	65 Å²	65	94.5 Å²	94.5	30%	0.304	56%	0.558	S	S	.	*	S	Bend	trans	-65.8	155.5	171.7	-70.9	174.2	-169.1	0	0	111.8	S520 S530 S532	S520-E524 PolarHBondContact O-N 3.32Å; S520-E524 VanDerWaalsContact O-N 3.1Å; E524-S530 WeakPolarHBondContact OE2-CB 3.28Å; E524-S530 PolarHBondContact OE2-OG 3.38Å; E524-S532 PolarHBondContact OE1-OG 2.91Å
525	E	84.4	Confident	83.4	Confident	182 Å²	182	91.7 Å²	91.7	85%	0.85	54%	0.542	S	S	*	.			trans	-67.2	156.7	171.3	-62	-169.6	162.7	0	0	111.4	A527	E525-A527 PolarHBondContact O-N 2.9Å
526	V	83	Confident	83.5	Confident	157 Å²	157	91.4 Å²	91.4	95%	0.952	54%	0.537	S	S	*	.			trans	-77.6	66.6	-175.7	-168.8	0	0	0	0	111.4
527	A	82.3	Confident	83.5	Confident	63 Å²	63	89.7 Å²	89.7	52%	0.521	52%	0.523	S	S	.	.			trans	-88.2	147.9	174.3	0	0	0	0	0	111.5	E525 V529	E525-A527 PolarHBondContact O-N 2.9Å; A527-V529 PolarHBondContact O-N 3.28Å; A527-V529 VanDerWaalsContact O-N 3.13Å
528	P	81.9	Confident	83.6	Confident	139 Å²	139	87.9 Å²	87.9	90%	0.903	52%	0.519	S	S	*	.	S	Bend	trans	-66.7	-9.3	177	-23	34.8	0	0	0	115.6
529	V	79.1	Confident	83.6	Confident	114 Å²	114	89.7 Å²	89.7	69%	0.691	54%	0.535	S	S	*	.			trans	-133.3	105.1	177.4	-178.9	0	0	0	0	107.6	A527	A527-V529 PolarHBondContact O-N 3.28Å; A527-V529 VanDerWaalsContact O-N 3.13Å
530	S	76.9	Confident	83.6	Confident	46 Å²	46	91.6 Å²	91.6	32%	0.322	54%	0.539	S	S	.	.			trans	-85.2	152.6	164.2	173.1	0	0	0	0	109.5	I521 E524	I521-S530 WeakPolarHBondContact CG1-OG 3.4Å; E524-S530 WeakPolarHBondContact OE2-CB 3.28Å; E524-S530 PolarHBondContact OE2-OG 3.38Å
531	T	70.4	Confident	83.8	Confident	133 Å²	133	96.6 Å²	96.6	82%	0.816	56%	0.56	S	S	*	*			trans	-118.5	2.8	-173.9	52.9	0	0	0	0	113.5
532	S	76.8	Confident	84	Confident	34 Å²	34	96.4 Å²	96.4	24%	0.238	56%	0.563	C	S	.	*			trans	-136.6	124	-175.9	84.5	0	0	0	0	115.5	S520 E524 A534	S520-S532 VanDerWaalsContact CB-OG 3.3Å; S520-S532 WeakPolarHBondContact CB-OG 3.45Å; E524-S532 PolarHBondContact OE1-OG 2.91Å; S532-A534 VanDerWaalsContact C-N 3.3Å
533	D	81.4	Confident	84	Confident	176 Å²	176	100 Å²	100	94%	0.941	57%	0.571	S	S	*	*			trans	-88.8	7	169.1	-74.4	-41	0	0	0	112.5
534	A	86.1	Confident	84.1	Confident	54 Å²	54	100.2 Å²	100.2	45%	0.446	57%	0.571	S	S	.	*			trans	-75.6	161.8	-172.4	0	0	0	0	0	113	P519 S520 S532	P519-A534 CarbonylContact C-O 3.56Å; P519-A534 WeakPolarHBondContact CA-O 3.47Å; S520-A534 PolarHBondContact N-O 2.88Å; S520-A534 PolarHBondContact OG-O 2.84Å; S532-A534 VanDerWaalsContact C-N 3.3Å
535	T	88.2	Confident	84.1	Confident	77 Å²	77	103.2 Å²	103.2	47%	0.472	58%	0.583	S	S	.	*	B	Isolated β-bridge	trans	-103.4	147.5	168.4	49.6	0	0	0	0	111.3	N517 L518 L537	N517-T535 WeakPolarHBondContact OD1-CB 3.36Å; L518-T535 WeakPolarHBondContact O-CA 3.47Å; T535-L537 PolarHBondContact O-N 2.96Å; T535-L537 PolarHBondContact OG1-O 3.33Å
536	L	86.8	Confident	83.8	Confident	72 Å²	72	98.1 Å²	98.1	38%	0.377	56%	0.562	S	S	.	*	S	Bend	trans	-65.6	-18.3	-177.7	-125.1	79.9	0	0	0	114.5	V515 L518 M523	V515-L536 HydrophobicContact CG1-CB 4.21Å; V515-L536 HydrophobicContact CG1-CD2 3.95Å; L518-L536 PolarHBondContact O-N 2.87Å; M523-L536 HydrophobicContact CB-CD1 4.26Å; M523-L536 HydrophobicContact CG-CD1 3.89Å; M523-L536 HydrophobicContact CG-CD2 3.92Å
537	L	90	Very high	83.3	Confident	33 Å²	33	99.3 Å²	99.3	17%	0.173	55%	0.554	C	S	.	*	S	Bend	trans	-108.9	129.8	-176.5	-159.6	73.7	0	0	0	109.9	V515 N517 T535 E541 V542	V515-L537 HydrophobicContact CG1-CD1 4.31Å; N517-L537 HydrophobicContact CB-CB 4Å; N517-L537 HydrophobicContact CB-CD2 3.98Å; T535-L537 PolarHBondContact O-N 2.96Å; T535-L537 PolarHBondContact OG1-O 3.33Å; L537-E541 HydrophobicContact CD1-CB 3.9Å; L537-E541 WeakPolarHBondContact CD1-OE2 3.29Å; L537-E541 HydrophobicContact CD2-CB 4.28Å; L537-E541 HydrophobicContact CG-CB 3.73Å; L537-V542 HydrophobicContact CB-CG2 4.3Å; L537-V542 HydrophobicContact CD2-CG2 3.9Å; L537-V542 HydrophobicContact CG-CG2 4.23Å
538	A	88.9	Confident	82.5	Confident	44 Å²	44	100.9 Å²	100.9	36%	0.364	57%	0.566	S	S	.	*			trans	-71.4	154.4	-174.4	0	0	0	0	0	112.3	E540 E541 V542	A538-E540 PolarHBondContact O-N 3.28Å; A538-E540 VanDerWaalsContact O-N 3.14Å; A538-E541 HydrophobicContact CB-CG 4.16Å; A538-E541 WeakPolarHBondContact CB-OE2 3.41Å; A538-E541 PolarHBondContact N-OE2 3.05Å; A538-E541 WeakPolarHBondContact O-CB 3.12Å; A538-E541 PolarHBondContact O-N 2.77Å; A538-V542 WeakPolarHBondContact O-CG2 3.26Å; A538-V542 PolarHBondContact O-N 3.04Å
539	P	88.4	Confident	82.1	Confident	112 Å²	112	96.3 Å²	96.3	73%	0.727	55%	0.545	S	S	*	.	H	α-helix	trans	-55.6	-32.7	177.6	-28.2	36.3	0	0	0	114.4	K543	P539-K543 PolarHBondContact O-N 2.85Å
540	E	88.1	Confident	81.9	Confident	99 Å²	99	97.7 Å²	97.7	46%	0.463	55%	0.548	S	S	.	.	H	α-helix	trans	-74.8	-23.1	176	-61.5	-159.7	170.5	0	0	114	A538 K543 E544 K545	A538-E540 PolarHBondContact O-N 3.28Å; A538-E540 VanDerWaalsContact O-N 3.14Å; E540-K543 CarbonylContact C-O 3.11Å; E540-K543 WeakPolarHBondContact CA-O 3.4Å; E540-K543 CarbonylContact O-C 3.42Å; E540-E544 VanDerWaalsContact O-CA 3.26Å; E540-E544 WeakPolarHBondContact O-CA 3.37Å; E540-E544 PolarHBondContact O-N 3.01Å; E540-E544 VanDerWaalsContact O-N 3.12Å; E540-K545 WeakPolarHBondContact OE1-CD 3.28Å; E540-K545 IonicContact OE1-NZ 2.67Å; E540-K545 PolarHBondContact OE1-NZ 3.1Å; E540-K545 IonicContact OE2-NZ 2.71Å; E540-K545 PolarHBondContact OE2-NZ 3.4Å
541	E	88.6	Confident	81.8	Confident	127 Å²	127	102 Å²	102	59%	0.593	57%	0.567	S	S	*	*	H	α-helix	trans	-85.8	-35.2	175.6	-64.1	174.4	133.1	0	0	110.9	L537 A538 K543	L537-E541 HydrophobicContact CD1-CB 3.9Å; L537-E541 WeakPolarHBondContact CD1-OE2 3.29Å; L537-E541 HydrophobicContact CD2-CB 4.28Å; L537-E541 HydrophobicContact CG-CB 3.73Å; A538-E541 HydrophobicContact CB-CG 4.16Å; A538-E541 WeakPolarHBondContact CB-OE2 3.41Å; A538-E541 PolarHBondContact N-OE2 3.05Å; A538-E541 WeakPolarHBondContact O-CB 3.12Å; A538-E541 PolarHBondContact O-N 2.77Å; E541-K543 VanDerWaalsContact C-N 3.28Å
542	V	88.9	Confident	82.3	Confident	87 Å²	87	99.8 Å²	99.8	53%	0.527	55%	0.55	S	S	.	*	H	α-helix	trans	-63.9	-35.1	168	175.5	0	0	0	0	110.8	L537 A538	L537-V542 HydrophobicContact CB-CG2 4.3Å; L537-V542 HydrophobicContact CD2-CG2 3.9Å; L537-V542 HydrophobicContact CG-CG2 4.23Å; A538-V542 WeakPolarHBondContact O-CG2 3.26Å; A538-V542 PolarHBondContact O-N 3.04Å
543	K	87.9	Confident	82.6	Confident	157 Å²	157	99.4 Å²	99.4	68%	0.683	55%	0.551	S	S	*	*	S	Bend	trans	-153.6	109.3	176.5	-178.6	-172.5	173.3	-171	0	111	P539 E540 E541 K545	P539-K543 PolarHBondContact O-N 2.85Å; E540-K543 CarbonylContact C-O 3.11Å; E540-K543 WeakPolarHBondContact CA-O 3.4Å; E540-K543 CarbonylContact O-C 3.42Å; E541-K543 VanDerWaalsContact C-N 3.28Å; K543-K545 PolarHBondContact O-N 2.91Å
544	E	85.4	Confident	82.6	Confident	133 Å²	133	96.5 Å²	96.5	62%	0.621	54%	0.536	S	S	*	.			trans	-48.9	131.7	176	-79.6	-165.4	-131.6	0	0	111.8	E540 N546 K547	E540-E544 VanDerWaalsContact O-CA 3.26Å; E540-E544 WeakPolarHBondContact O-CA 3.37Å; E540-E544 PolarHBondContact O-N 3.01Å; E540-E544 VanDerWaalsContact O-N 3.12Å; E544-N546 PolarHBondContact O-N 3.44Å; E544-K547 WeakPolarHBondContact OE2-CE 3.28Å; E544-K547 IonicContact OE2-NZ 2.71Å; E544-K547 PolarHBondContact OE2-NZ 2.93Å
545	K	82.2	Confident	82.7	Confident	128 Å²	128	100.2 Å²	100.2	56%	0.557	55%	0.553	S	S	*	*			trans	-63.5	134.1	168.7	57.7	164.8	173	-88.6	0	110.3	E540 K543 K547	E540-K545 WeakPolarHBondContact OE1-CD 3.28Å; E540-K545 IonicContact OE1-NZ 2.67Å; E540-K545 PolarHBondContact OE1-NZ 3.1Å; E540-K545 IonicContact OE2-NZ 2.71Å; E540-K545 PolarHBondContact OE2-NZ 3.4Å; K543-K545 PolarHBondContact O-N 2.91Å; K545-K547 PolarHBondContact O-N 3.04Å
546	N	78.8	Confident	82.5	Confident	76 Å²	76	102.5 Å²	102.5	41%	0.406	56%	0.558	S	S	.	*			trans	-62.2	109.6	174.9	-68.3	-34.4	0	0	0	109.3	E544 A548 G549 L551	E544-N546 PolarHBondContact O-N 3.44Å; N546-A548 PolarHBondContact O-N 3.3Å; N546-G549 WeakPolarHBondContact CB-O 3.47Å; N546-G549 PolarHBondContact O-N 2.86Å; N546-L551 HydrophobicContact CB-CD2 4.38Å
547	K	72.1	Confident	82.5	Confident	182 Å²	182	100.8 Å²	100.8	79%	0.791	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	5.7	-175.7	-60.6	173.3	-175.1	156.7	0	114.6	E544 K545	E544-K547 WeakPolarHBondContact OE2-CE 3.28Å; E544-K547 IonicContact OE2-NZ 2.71Å; E544-K547 PolarHBondContact OE2-NZ 2.93Å; K545-K547 PolarHBondContact O-N 3.04Å
548	A	66.6	Low	82.4	Confident	95 Å²	95	102.4 Å²	102.4	79%	0.785	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.5	6.9	178	0	0	0	0	0	113.4	N546	N546-A548 PolarHBondContact O-N 3.3Å
549	G	71.6	Confident	82.4	Confident	44 Å²	44	104.3 Å²	104.3	45%	0.454	57%	0.57	S	S	.	*	S	Bend	trans	80.2	-141.8	-170	0	0	0	0	0	112	N546	N546-G549 WeakPolarHBondContact CB-O 3.47Å; N546-G549 PolarHBondContact O-N 2.86Å
550	D	76.4	Confident	82.4	Confident	142 Å²	142	103.9 Å²	103.9	76%	0.759	57%	0.566	S	S	*	*	S	Bend	trans	-64.7	147	178.5	-74.4	-39.4	0	0	0	112.8	L552	D550-L552 VanDerWaalsContact C-N 3.26Å; D550-L552 PolarHBondContact O-N 3.19Å
551	L	75.2	Confident	82.3	Confident	138 Å²	138	102.1 Å²	102.1	72%	0.723	56%	0.559	S	S	*	*			trans	-79.9	69.9	-176.5	-65	176.3	0	0	0	111.7	N546 G553	N546-L551 HydrophobicContact CB-CD2 4.38Å; L551-G553 PolarHBondContact O-N 2.67Å
552	L	80.3	Confident	82.3	Confident	86 Å²	86	100.4 Å²	100.4	45%	0.45	55%	0.55	S	S	.	.			trans	-60.1	125.7	174	-116.3	71.7	0	0	0	111.5	D550 E556 K557	D550-L552 VanDerWaalsContact C-N 3.26Å; D550-L552 PolarHBondContact O-N 3.19Å; L552-E556 HydrophobicContact CD2-CB 4.47Å; L552-E556 HydrophobicContact CG-CB 4.11Å; L552-K557 HydrophobicContact CB-CG 4.1Å; L552-K557 HydrophobicContact CD2-CG 4.37Å; L552-K557 VanDerWaalsContact O-CE 3.26Å; L552-K557 WeakPolarHBondContact O-CE 3.08Å
553	G	83.1	Confident	82.5	Confident	26 Å²	26	102.8 Å²	102.8	27%	0.268	55%	0.553	S	S	.	*			trans	-67.1	152.5	175.2	0	0	0	0	0	112.3	L551 T555 E556 K557	L551-G553 PolarHBondContact O-N 2.67Å; G553-T555 PolarHBondContact O-N 2.94Å; G553-E556 PolarHBondContact N-OE2 3.05Å; G553-E556 PolarHBondContact O-N 3.19Å; G553-K557 WeakPolarHBondContact O-CG 3.43Å; G553-K557 PolarHBondContact O-N 3.42Å
554	D	81.8	Confident	82.5	Confident	114 Å²	114	104 Å²	104	61%	0.61	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.4	-15.6	179.1	-73.1	-37.1	0	0	0	113.4	K557 K562	D554-K557 WeakPolarHBondContact OD1-CD 3.35Å; D554-K557 WeakPolarHBondContact OD1-CE 3.41Å; D554-K557 IonicContact OD1-NZ 2.63Å; D554-K557 PolarHBondContact OD1-NZ 3.16Å; D554-K562 WeakPolarHBondContact O-CE 3.27Å; D554-K562 PolarHBondContact O-NZ 2.94Å
555	T	86.4	Confident	82.6	Confident	132 Å²	132	100.4 Å²	100.4	81%	0.81	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-29.3	168.5	43	0	0	0	0	113.7	G553	G553-T555 PolarHBondContact O-N 2.94Å
556	E	85.8	Confident	83	Confident	125 Å²	125	102.7 Å²	102.7	58%	0.584	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	-33	-173.6	-62.6	162.5	166.1	0	0	111.9	L552 G553 T558	L552-E556 HydrophobicContact CD2-CB 4.47Å; L552-E556 HydrophobicContact CG-CB 4.11Å; G553-E556 PolarHBondContact N-OE2 3.05Å; G553-E556 PolarHBondContact O-N 3.19Å; E556-T558 PolarHBondContact O-N 3.17Å
557	K	85.8	Confident	83.6	Confident	37 Å²	37	107.6 Å²	107.6	16%	0.161	56%	0.555	C	S	.	*	S	Bend	trans	-53.7	129.9	176.1	-69.8	176.5	-169.6	173.3	0	112.3	L552 G553 D554 D561 K562 E565	L552-K557 HydrophobicContact CB-CG 4.1Å; L552-K557 HydrophobicContact CD2-CG 4.37Å; L552-K557 VanDerWaalsContact O-CE 3.26Å; L552-K557 WeakPolarHBondContact O-CE 3.08Å; G553-K557 WeakPolarHBondContact O-CG 3.43Å; G553-K557 PolarHBondContact O-N 3.42Å; D554-K557 WeakPolarHBondContact OD1-CD 3.35Å; D554-K557 WeakPolarHBondContact OD1-CE 3.41Å; D554-K557 IonicContact OD1-NZ 2.63Å; D554-K557 PolarHBondContact OD1-NZ 3.16Å; K557-D561 HydrophobicContact CB-CB 4.3Å; K557-K562 HydrophobicContact CB-CD 4.41Å; K557-K562 HydrophobicContact CB-CG 4.15Å; K557-K562 WeakPolarHBondContact O-CE 3.34Å; K557-K562 PolarHBondContact O-NZ 3.21Å; K557-E565 IonicContact NZ-OE1 2.73Å; K557-E565 IonicContact NZ-OE2 3.74Å; K557-E565 PolarHBondContact NZ-OE2 2.56Å
558	T	87.4	Confident	84.5	Confident	66 Å²	66	104.7 Å²	104.7	41%	0.405	54%	0.544	S	S	.	.			trans	-68.5	166.3	176.4	70.6	0	0	0	0	112	E556 T560 D561 K562	E556-T558 PolarHBondContact O-N 3.17Å; T558-T560 PolarHBondContact O-N 3.01Å; T558-T560 PolarHBondContact OG1-N 3.42Å; T558-T560 PolarHBondContact OG1-OG1 3.38Å; T558-D561 VanDerWaalsContact CB-OD2 3.31Å; T558-D561 WeakPolarHBondContact CB-OD2 3.27Å; T558-D561 WeakPolarHBondContact CG2-OD2 3.37Å; T558-D561 PolarHBondContact N-OD2 2.89Å; T558-D561 PolarHBondContact O-N 3.13Å; T558-D561 PolarHBondContact OG1-N 3.19Å; T558-D561 PolarHBondContact OG1-OD2 3.34Å; T558-K562 WeakPolarHBondContact O-CD 3.23Å; T558-K562 WeakPolarHBondContact O-CG 3.4Å; T558-K562 PolarHBondContact O-N 3.39Å
559	S	88.6	Confident	85.8	Confident	85 Å²	85	106.4 Å²	106.4	59%	0.594	53%	0.533	S	S	*	.	H	α-helix	trans	-60	-37.2	172.4	-173.3	0	0	0	0	111.7	K562 K563	S559-K562 PolarHBondContact O-N 3.23Å; S559-K563 WeakPolarHBondContact O-CG 3.45Å; S559-K563 PolarHBondContact O-N 2.84Å
560	T	88.9	Confident	86.9	Confident	103 Å²	103	110.8 Å²	110.8	63%	0.632	54%	0.54	S	S	*	.	H	α-helix	trans	-63.1	-44.5	173.9	25	0	0	0	0	112.6	T558 K563 R564	T558-T560 PolarHBondContact O-N 3.01Å; T558-T560 PolarHBondContact OG1-N 3.42Å; T558-T560 PolarHBondContact OG1-OG1 3.38Å; T560-K563 PolarHBondContact O-N 2.92Å; T560-R564 PolarHBondContact O-N 2.96Å
561	D	86.8	Confident	87.8	Confident	61 Å²	61	109.7 Å²	109.7	33%	0.326	53%	0.528	S	S	.	.	H	α-helix	trans	-64.6	-44.6	176.2	-59.3	-46.5	0	0	0	111.3	K557 T558 K563 R564 E565	K557-D561 HydrophobicContact CB-CB 4.3Å; T558-D561 VanDerWaalsContact CB-OD2 3.31Å; T558-D561 WeakPolarHBondContact CB-OD2 3.27Å; T558-D561 WeakPolarHBondContact CG2-OD2 3.37Å; T558-D561 PolarHBondContact N-OD2 2.89Å; T558-D561 PolarHBondContact O-N 3.13Å; T558-D561 PolarHBondContact OG1-N 3.19Å; T558-D561 PolarHBondContact OG1-OD2 3.34Å; D561-K563 VanDerWaalsContact C-N 3.28Å; D561-K563 PolarHBondContact O-N 3.02Å; D561-R564 CarbonylContact O-C 3.59Å; D561-R564 PolarHBondContact O-N 3.16Å; D561-R564 VanDerWaalsContact O-N 3.07Å; D561-E565 WeakPolarHBondContact O-CB 3.35Å; D561-E565 PolarHBondContact O-N 2.79Å
562	K	88.7	Confident	88.7	Confident	92 Å²	92	105.5 Å²	105.5	40%	0.4	51%	0.508	S	S	.	.	H	α-helix	trans	-58.8	-39	175.4	-75.2	159.6	172.4	146.6	0	111.7	D554 K557 T558 S559 R566	D554-K562 WeakPolarHBondContact O-CE 3.27Å; D554-K562 PolarHBondContact O-NZ 2.94Å; K557-K562 HydrophobicContact CB-CD 4.41Å; K557-K562 HydrophobicContact CB-CG 4.15Å; K557-K562 WeakPolarHBondContact O-CE 3.34Å; K557-K562 PolarHBondContact O-NZ 3.21Å; T558-K562 WeakPolarHBondContact O-CD 3.23Å; T558-K562 WeakPolarHBondContact O-CG 3.4Å; T558-K562 PolarHBondContact O-N 3.39Å; S559-K562 PolarHBondContact O-N 3.23Å; K562-R566 VanDerWaalsContact O-CB 3.29Å; K562-R566 WeakPolarHBondContact O-CB 3.36Å; K562-R566 PolarHBondContact O-N 2.61Å
563	K	92.4	Very high	89.4	Confident	136 Å²	136	108.3 Å²	108.3	59%	0.591	52%	0.517	S	S	*	.	H	α-helix	trans	-68.3	-40.4	172	-73.5	-178.8	-178.5	-174.3	0	112.4	S559 T560 D561 R567	S559-K563 WeakPolarHBondContact O-CG 3.45Å; S559-K563 PolarHBondContact O-N 2.84Å; T560-K563 PolarHBondContact O-N 2.92Å; D561-K563 VanDerWaalsContact C-N 3.28Å; D561-K563 PolarHBondContact O-N 3.02Å; K563-R567 WeakPolarHBondContact O-CG 3.16Å; K563-R567 PolarHBondContact O-N 3.47Å
564	R	88.6	Confident	89.9	Confident	182 Å²	182	114.3 Å²	114.3	69%	0.687	53%	0.531	S	S	*	.	H	α-helix	trans	-64.3	-48	175.8	-172.1	179.9	-178.9	-134.9	0.9	111.5	T560 D561 R566 R567 H568	T560-R564 PolarHBondContact O-N 2.96Å; D561-R564 CarbonylContact O-C 3.59Å; D561-R564 PolarHBondContact O-N 3.16Å; D561-R564 VanDerWaalsContact O-N 3.07Å; R564-R566 VanDerWaalsContact C-N 3.34Å; R564-R566 PolarHBondContact O-N 3.26Å; R564-R567 PolarHBondContact O-N 3.11Å; R564-R567 VanDerWaalsContact O-N 3.15Å; R564-H568 PolarHBondContact O-N 3.01Å
565	E	87.8	Confident	90.5	Very high	59 Å²	59	113 Å²	113	28%	0.276	52%	0.524	S	S	.	.	H	α-helix	trans	-62.7	-39.1	177.7	-160.5	-170.2	148.5	0	0	111.4	K557 D561 H568 K569	K557-E565 IonicContact NZ-OE1 2.73Å; K557-E565 IonicContact NZ-OE2 3.74Å; K557-E565 PolarHBondContact NZ-OE2 2.56Å; D561-E565 WeakPolarHBondContact O-CB 3.35Å; D561-E565 PolarHBondContact O-N 2.79Å; E565-H568 PolarHBondContact O-N 3.13Å; E565-K569 HydrophobicContact CG-CD 4.25Å; E565-K569 VanDerWaalsContact O-CB 3.29Å; E565-K569 WeakPolarHBondContact O-CB 3.22Å; E565-K569 WeakPolarHBondContact O-CG 3.47Å; E565-K569 PolarHBondContact O-N 2.65Å; E565-K569 WeakPolarHBondContact OE1-CE 3.38Å; E565-K569 IonicContact OE1-NZ 2.75Å; E565-K569 PolarHBondContact OE1-NZ 3.33Å
566	R	89.6	Confident	90.8	Very high	175 Å²	175	112.2 Å²	112.2	66%	0.66	51%	0.509	S	S	*	.	H	α-helix	trans	-62.4	-42.7	172.1	-174.2	-176.4	-177.3	-142.2	5.2	112.2	K562 R564 K570	K562-R566 VanDerWaalsContact O-CB 3.29Å; K562-R566 WeakPolarHBondContact O-CB 3.36Å; K562-R566 PolarHBondContact O-N 2.61Å; R564-R566 VanDerWaalsContact C-N 3.34Å; R564-R566 PolarHBondContact O-N 3.26Å; R566-K570 PolarHBondContact O-N 3.06Å
567	R	92.9	Very high	91.1	Very high	180 Å²	180	109.4 Å²	109.4	68%	0.679	50%	0.497	S	S	*	.	H	α-helix	trans	-64	-46.7	175.4	-76.2	-170.5	-71.7	169.4	-2.5	111.5	K563 R564 K570 K571	K563-R567 WeakPolarHBondContact O-CG 3.16Å; K563-R567 PolarHBondContact O-N 3.47Å; R564-R567 PolarHBondContact O-N 3.11Å; R564-R567 VanDerWaalsContact O-N 3.15Å; R567-K570 WeakPolarHBondContact O-CA 3.32Å; R567-K570 WeakPolarHBondContact O-CB 3.45Å; R567-K570 PolarHBondContact O-N 3.24Å; R567-K570 VanDerWaalsContact O-N 3.11Å; R567-K571 PolarHBondContact O-N 3.03Å
568	H	90.8	Very high	91.3	Very high	121 Å²	121	111.5 Å²	111.5	56%	0.56	51%	0.508	S	S	*	.	H	α-helix	trans	-60.6	-47.7	176.3	-178.6	-117.1	0	0	0	112.1	R564 E565 K570 K571 V572	R564-H568 PolarHBondContact O-N 3.01Å; E565-H568 PolarHBondContact O-N 3.13Å; H568-K570 PolarHBondContact O-N 3.22Å; H568-K571 PolarHBondContact O-N 3.3Å; H568-K571 VanDerWaalsContact O-N 3.13Å; H568-V572 WeakPolarHBondContact O-CG2 3.39Å; H568-V572 PolarHBondContact O-N 3.48Å
569	K	92.3	Very high	91.4	Very high	130 Å²	130	113.5 Å²	113.5	57%	0.565	51%	0.513	S	S	*	.	H	α-helix	trans	-59.5	-31.5	173.8	-76.2	171.9	168.2	172.8	0	112.5	E565 K573	E565-K569 HydrophobicContact CG-CD 4.25Å; E565-K569 VanDerWaalsContact O-CB 3.29Å; E565-K569 WeakPolarHBondContact O-CB 3.22Å; E565-K569 WeakPolarHBondContact O-CG 3.47Å; E565-K569 PolarHBondContact O-N 2.65Å; E565-K569 WeakPolarHBondContact OE1-CE 3.38Å; E565-K569 IonicContact OE1-NZ 2.75Å; E565-K569 PolarHBondContact OE1-NZ 3.33Å; K569-K573 VanDerWaalsContact O-CB 3.27Å; K569-K573 WeakPolarHBondContact O-CB 3.49Å; K569-K573 PolarHBondContact O-N 3.45Å; K569-K573 VanDerWaalsContact O-N 3.12Å
570	K	95.3	Very high	91.3	Very high	137 Å²	137	114.5 Å²	114.5	60%	0.596	51%	0.506	S	S	*	.	H	α-helix	trans	-68.2	-51.5	169	-83.2	-169.2	171.2	-165.2	0	112.4	R566 R567 H568 V572 K573 R574	R566-K570 PolarHBondContact O-N 3.06Å; R567-K570 WeakPolarHBondContact O-CA 3.32Å; R567-K570 WeakPolarHBondContact O-CB 3.45Å; R567-K570 PolarHBondContact O-N 3.24Å; R567-K570 VanDerWaalsContact O-N 3.11Å; H568-K570 PolarHBondContact O-N 3.22Å; K570-V572 PolarHBondContact O-N 3.45Å; K570-K573 PolarHBondContact O-N 2.96Å; K570-K573 VanDerWaalsContact O-N 3.13Å; K570-R574 PolarHBondContact O-N 2.85Å
571	K	94.5	Very high	91.3	Very high	119 Å²	119	114.3 Å²	114.3	52%	0.517	50%	0.498	S	S	.	.	H	α-helix	trans	-54.6	-51.4	178.3	-169.8	178.6	-178.5	-177.4	0	110.3	R567 H568 K573 R574 L575	R567-K571 PolarHBondContact O-N 3.03Å; H568-K571 PolarHBondContact O-N 3.3Å; H568-K571 VanDerWaalsContact O-N 3.13Å; K571-K573 VanDerWaalsContact C-N 3.33Å; K571-K573 PolarHBondContact O-N 2.97Å; K571-R574 PolarHBondContact O-N 3.35Å; K571-R574 VanDerWaalsContact O-N 3.16Å; K571-L575 HydrophobicContact CG-CD1 4.15Å; K571-L575 WeakPolarHBondContact O-CG 3.31Å; K571-L575 PolarHBondContact O-N 2.99Å
572	V	94.4	Very high	91.1	Very high	50 Å²	50	118.8 Å²	118.8	30%	0.303	52%	0.515	S	S	.	.	H	α-helix	trans	-62.8	-34.5	178.7	176.9	0	0	0	0	112.9	H568 K570 K576	H568-V572 WeakPolarHBondContact O-CG2 3.39Å; H568-V572 PolarHBondContact O-N 3.48Å; K570-V572 PolarHBondContact O-N 3.45Å; V572-K576 HydrophobicContact CG1-CD 4.08Å; V572-K576 WeakPolarHBondContact O-CB 3.39Å; V572-K576 VanDerWaalsContact O-CG 3.31Å; V572-K576 WeakPolarHBondContact O-CG 3.33Å; V572-K576 PolarHBondContact O-N 2.8Å
573	K	95.2	Very high	90.7	Very high	145 Å²	145	120.8 Å²	120.8	63%	0.63	52%	0.52	S	S	*	.	H	α-helix	trans	-70.9	-40.4	174.3	-169.5	-170	176.5	-160.8	0	111.8	K569 K570 K571 K576 I577	K569-K573 VanDerWaalsContact O-CB 3.27Å; K569-K573 WeakPolarHBondContact O-CB 3.49Å; K569-K573 PolarHBondContact O-N 3.45Å; K569-K573 VanDerWaalsContact O-N 3.12Å; K570-K573 PolarHBondContact O-N 2.96Å; K570-K573 VanDerWaalsContact O-N 3.13Å; K571-K573 VanDerWaalsContact C-N 3.33Å; K571-K573 PolarHBondContact O-N 2.97Å; K573-K576 PolarHBondContact O-N 3.31Å; K573-I577 HydrophobicContact CD-CD1 4.46Å; K573-I577 HydrophobicContact CG-CD1 4.02Å; K573-I577 VanDerWaalsContact O-CG1 3.32Å; K573-I577 WeakPolarHBondContact O-CG1 3.3Å; K573-I577 PolarHBondContact O-N 3Å
574	R	94.8	Very high	90.2	Very high	151 Å²	151	119.7 Å²	119.7	57%	0.57	52%	0.517	S	S	*	.	H	α-helix	trans	-60.6	-51.2	177.6	-171.7	172.5	80	179.1	5	110.6	K570 K571 K576 I577 Q578	K570-R574 PolarHBondContact O-N 2.85Å; K571-R574 PolarHBondContact O-N 3.35Å; K571-R574 VanDerWaalsContact O-N 3.16Å; R574-K576 PolarHBondContact O-N 3.38Å; R574-I577 WeakPolarHBondContact O-CB 3.47Å; R574-I577 PolarHBondContact O-N 2.85Å; R574-Q578 PolarHBondContact O-N 3.5Å
575	L	93.2	Very high	89.8	Confident	87 Å²	87	117.5 Å²	117.5	46%	0.455	51%	0.512	S	S	.	.	H	α-helix	trans	-56.6	-46.9	176.5	-65.8	169.9	0	0	0	111.8	K571 I577 Q578 E579	K571-L575 HydrophobicContact CG-CD1 4.15Å; K571-L575 WeakPolarHBondContact O-CG 3.31Å; K571-L575 PolarHBondContact O-N 2.99Å; L575-I577 PolarHBondContact O-N 3.3Å; L575-I577 VanDerWaalsContact O-N 3.13Å; L575-Q578 PolarHBondContact O-N 3.5Å; L575-E579 VanDerWaalsContact O-CB 3.27Å; L575-E579 WeakPolarHBondContact O-CB 3.44Å; L575-E579 PolarHBondContact O-N 2.96Å
576	K	93.3	Very high	89.2	Confident	116 Å²	116	119 Å²	119	50%	0.504	52%	0.522	S	S	.	.	H	α-helix	trans	-72.7	2	177	-70.6	179.7	177.7	-179	0	115.4	V572 K573 R574 K580	V572-K576 HydrophobicContact CG1-CD 4.08Å; V572-K576 WeakPolarHBondContact O-CB 3.39Å; V572-K576 VanDerWaalsContact O-CG 3.31Å; V572-K576 WeakPolarHBondContact O-CG 3.33Å; V572-K576 PolarHBondContact O-N 2.8Å; K573-K576 PolarHBondContact O-N 3.31Å; R574-K576 PolarHBondContact O-N 3.38Å; K576-K580 VanDerWaalsContact O-CD 3.22Å; K576-K580 WeakPolarHBondContact O-CD 3.49Å; K576-K580 WeakPolarHBondContact O-CE 3.42Å; K576-K580 WeakPolarHBondContact O-CG 3.21Å; K576-K580 PolarHBondContact O-NZ 3.43Å; K576-K580 VanDerWaalsContact O-NZ 3.16Å
577	I	91.8	Very high	88.5	Confident	65 Å²	65	116.1 Å²	116.1	33%	0.333	51%	0.514	S	S	.	.	H	α-helix	trans	-101.8	-53.2	169	-74.5	168.6	0	0	0	108.2	K573 R574 L575 E579 K580 E581	K573-I577 HydrophobicContact CD-CD1 4.46Å; K573-I577 HydrophobicContact CG-CD1 4.02Å; K573-I577 VanDerWaalsContact O-CG1 3.32Å; K573-I577 WeakPolarHBondContact O-CG1 3.3Å; K573-I577 PolarHBondContact O-N 3Å; R574-I577 WeakPolarHBondContact O-CB 3.47Å; R574-I577 PolarHBondContact O-N 2.85Å; L575-I577 PolarHBondContact O-N 3.3Å; L575-I577 VanDerWaalsContact O-N 3.13Å; I577-E579 VanDerWaalsContact C-N 3.31Å; I577-E579 PolarHBondContact O-N 3.5Å; I577-K580 WeakPolarHBondContact O-CA 3.03Å; I577-K580 WeakPolarHBondContact O-CB 3.46Å; I577-K580 PolarHBondContact O-N 3.49Å; I577-E581 VanDerWaalsContact CG2-CD 3.46Å; I577-E581 HydrophobicContact CG2-CG 4.42Å; I577-E581 WeakPolarHBondContact CG2-OE1 3.49Å; I577-E581 PolarHBondContact O-N 3.26Å
578	Q	90.8	Very high	87.7	Confident	82 Å²	82	112.4 Å²	112.4	38%	0.383	50%	0.504	S	S	.	.	H	α-helix	trans	-54.7	-42.4	175.6	-68.7	170.4	-48.3	0	0	112.6	R574 L575 K580 E581 K582	R574-Q578 PolarHBondContact O-N 3.5Å; L575-Q578 PolarHBondContact O-N 3.5Å; Q578-K580 VanDerWaalsContact C-N 3.3Å; Q578-K580 PolarHBondContact O-N 3.41Å; Q578-E581 PolarHBondContact O-N 3.34Å; Q578-K582 WeakPolarHBondContact O-CB 3.34Å; Q578-K582 WeakPolarHBondContact O-CG 3.3Å; Q578-K582 PolarHBondContact O-N 3.2Å
579	E	89.6	Confident	86.9	Confident	108 Å²	108	109.4 Å²	109.4	51%	0.505	50%	0.501	S	S	.	.	H	α-helix	trans	-57.5	-41.1	173.5	-173.6	-149.4	153	0	0	112	L575 I577 R583	L575-E579 VanDerWaalsContact O-CB 3.27Å; L575-E579 WeakPolarHBondContact O-CB 3.44Å; L575-E579 PolarHBondContact O-N 2.96Å; I577-E579 VanDerWaalsContact C-N 3.31Å; I577-E579 PolarHBondContact O-N 3.5Å; E579-R583 WeakPolarHBondContact O-CB 3.3Å; E579-R583 PolarHBondContact O-N 2.97Å
580	K	86.4	Confident	85.6	Confident	106 Å²	106	107.4 Å²	107.4	46%	0.461	50%	0.503	S	S	.	.	H	α-helix	trans	-74.6	-36.7	179.8	-68.6	174.6	-170.7	151.4	0	112	K576 I577 Q578 R583 Q584	K576-K580 VanDerWaalsContact O-CD 3.22Å; K576-K580 WeakPolarHBondContact O-CD 3.49Å; K576-K580 WeakPolarHBondContact O-CE 3.42Å; K576-K580 WeakPolarHBondContact O-CG 3.21Å; K576-K580 PolarHBondContact O-NZ 3.43Å; K576-K580 VanDerWaalsContact O-NZ 3.16Å; I577-K580 WeakPolarHBondContact O-CA 3.03Å; I577-K580 WeakPolarHBondContact O-CB 3.46Å; I577-K580 PolarHBondContact O-N 3.49Å; Q578-K580 VanDerWaalsContact C-N 3.3Å; Q578-K580 PolarHBondContact O-N 3.41Å; K580-R583 CarbonylContact O-C 3.58Å; K580-R583 PolarHBondContact O-N 3.46Å; K580-Q584 WeakPolarHBondContact O-CB 3.32Å; K580-Q584 VanDerWaalsContact O-CG 3.27Å; K580-Q584 WeakPolarHBondContact O-CG 3.41Å; K580-Q584 PolarHBondContact O-N 3.13Å
581	E	88.1	Confident	84.1	Confident	99 Å²	99	108.1 Å²	108.1	46%	0.463	50%	0.502	S	S	.	.	H	α-helix	trans	-68.5	-48.2	177.3	-72.4	161.1	173.8	0	0	110.6	I577 Q578 R583 Q584 K585	I577-E581 VanDerWaalsContact CG2-CD 3.46Å; I577-E581 HydrophobicContact CG2-CG 4.42Å; I577-E581 WeakPolarHBondContact CG2-OE1 3.49Å; I577-E581 PolarHBondContact O-N 3.26Å; Q578-E581 PolarHBondContact O-N 3.34Å; E581-R583 VanDerWaalsContact C-N 3.31Å; E581-R583 PolarHBondContact O-N 3.06Å; E581-Q584 WeakPolarHBondContact O-CA 3.42Å; E581-Q584 WeakPolarHBondContact O-CB 3.34Å; E581-Q584 PolarHBondContact O-N 3.12Å; E581-K585 PolarHBondContact O-N 2.95Å
582	K	83.6	Confident	82.3	Confident	154 Å²	154	108.1 Å²	108.1	67%	0.67	51%	0.512	S	S	*	.	H	α-helix	trans	-54.3	-46.8	170.1	-72.9	-172.5	177.8	-168.4	0	111	Q578 Q584 K585 L586	Q578-K582 WeakPolarHBondContact O-CB 3.34Å; Q578-K582 WeakPolarHBondContact O-CG 3.3Å; Q578-K582 PolarHBondContact O-N 3.2Å; K582-Q584 VanDerWaalsContact C-N 3.28Å; K582-Q584 PolarHBondContact O-N 3.42Å; K582-K585 PolarHBondContact O-N 3.13Å; K582-L586 WeakPolarHBondContact O-CB 3.41Å; K582-L586 PolarHBondContact O-N 3.27Å
583	R	80.1	Confident	80.2	Confident	134 Å²	134	108.3 Å²	108.3	51%	0.506	52%	0.524	S	S	.	.	H	α-helix	trans	-70.9	-16.1	176.9	-162.8	-179.8	69.8	170.6	-0.1	114.3	E579 K580 E581 K587	E579-R583 WeakPolarHBondContact O-CB 3.3Å; E579-R583 PolarHBondContact O-N 2.97Å; K580-R583 CarbonylContact O-C 3.58Å; K580-R583 PolarHBondContact O-N 3.46Å; E581-R583 VanDerWaalsContact C-N 3.31Å; E581-R583 PolarHBondContact O-N 3.06Å; R583-K587 WeakPolarHBondContact O-CB 3.37Å; R583-K587 WeakPolarHBondContact O-CD 3.44Å; R583-K587 WeakPolarHBondContact O-CG 3.46Å; R583-K587 PolarHBondContact O-N 2.98Å
584	Q	80.7	Confident	77.9	Confident	113 Å²	113	104.8 Å²	104.8	53%	0.528	53%	0.529	S	S	.	.	H	α-helix	trans	-84.2	-48.9	171	-83.1	172	-41.1	0	0	110.3	K580 E581 K582 L586 K587 E588	K580-Q584 WeakPolarHBondContact O-CB 3.32Å; K580-Q584 VanDerWaalsContact O-CG 3.27Å; K580-Q584 WeakPolarHBondContact O-CG 3.41Å; K580-Q584 PolarHBondContact O-N 3.13Å; E581-Q584 WeakPolarHBondContact O-CA 3.42Å; E581-Q584 WeakPolarHBondContact O-CB 3.34Å; E581-Q584 PolarHBondContact O-N 3.12Å; K582-Q584 VanDerWaalsContact C-N 3.28Å; K582-Q584 PolarHBondContact O-N 3.42Å; Q584-L586 PolarHBondContact O-N 2.93Å; Q584-K587 CarbonylContact O-C 3.49Å; Q584-K587 WeakPolarHBondContact O-CA 3.27Å; Q584-K587 PolarHBondContact O-N 2.86Å; Q584-E588 PolarHBondContact O-N 3.11Å
585	K	80.7	Confident	75.8	Confident	136 Å²	136	104 Å²	104	59%	0.591	54%	0.536	S	S	*	.	H	α-helix	trans	-50.2	-52.4	171.4	-73.3	-169.7	173.2	-167.6	0	110.9	E581 K582 K587 E588 A589	E581-K585 PolarHBondContact O-N 2.95Å; K582-K585 PolarHBondContact O-N 3.13Å; K585-K587 VanDerWaalsContact C-N 3.32Å; K585-K587 PolarHBondContact O-N 2.92Å; K585-E588 PolarHBondContact O-N 2.69Å; K585-A589 PolarHBondContact O-N 2.87Å
586	L	74.5	Confident	74.1	Confident	91 Å²	91	108.4 Å²	108.4	48%	0.476	55%	0.552	S	S	.	*	H	α-helix	trans	-57	-39.8	174.8	-95.3	162.9	0	0	0	113.6	K582 Q584 E588 S590	K582-L586 WeakPolarHBondContact O-CB 3.41Å; K582-L586 PolarHBondContact O-N 3.27Å; Q584-L586 PolarHBondContact O-N 2.93Å; L586-E588 VanDerWaalsContact C-N 3.25Å; L586-E588 PolarHBondContact O-N 3.14Å; L586-S590 WeakPolarHBondContact O-CB 3.37Å; L586-S590 PolarHBondContact O-N 3.19Å
587	K	74.7	Confident	72.5	Confident	114 Å²	114	111.7 Å²	111.7	50%	0.496	57%	0.566	S	S	.	*	H	α-helix	trans	-77.4	-8.6	177.8	-75.1	-178.3	-178.7	-168.9	0	113.6	R583 Q584 K585 R591	R583-K587 WeakPolarHBondContact O-CB 3.37Å; R583-K587 WeakPolarHBondContact O-CD 3.44Å; R583-K587 WeakPolarHBondContact O-CG 3.46Å; R583-K587 PolarHBondContact O-N 2.98Å; Q584-K587 CarbonylContact O-C 3.49Å; Q584-K587 WeakPolarHBondContact O-CA 3.27Å; Q584-K587 PolarHBondContact O-N 2.86Å; K585-K587 VanDerWaalsContact C-N 3.32Å; K585-K587 PolarHBondContact O-N 2.92Å; K587-R591 WeakPolarHBondContact O-CD 3.38Å; K587-R591 WeakPolarHBondContact O-CG 3.47Å
588	E	76.7	Confident	70.9	Confident	102 Å²	102	112.2 Å²	112.2	48%	0.477	57%	0.573	S	S	.	*	H	α-helix	trans	-100.8	-40.4	176.2	-76.3	167	-179.2	0	0	111	Q584 K585 L586 S590 R591 T592	Q584-E588 PolarHBondContact O-N 3.11Å; K585-E588 PolarHBondContact O-N 2.69Å; L586-E588 VanDerWaalsContact C-N 3.25Å; L586-E588 PolarHBondContact O-N 3.14Å; E588-S590 VanDerWaalsContact C-N 3.31Å; E588-S590 PolarHBondContact O-N 2.93Å; E588-R591 WeakPolarHBondContact O-CA 3.47Å; E588-R591 WeakPolarHBondContact O-CB 3.46Å; E588-R591 PolarHBondContact O-N 2.93Å; E588-R591 IonicContact OE1-NH1 2.72Å; E588-T592 PolarHBondContact O-N 3.14Å; E588-T592 PolarHBondContact O-OG1 2.82Å
589	A	73.5	Confident	69.6	Low	59 Å²	59	110.4 Å²	110.4	49%	0.488	57%	0.57	S	S	.	*	H	α-helix	trans	-55.3	-44.8	163.1	0	0	0	0	0	111.8	K585 R591 T592 G593	K585-A589 PolarHBondContact O-N 2.87Å; A589-R591 PolarHBondContact O-N 3.45Å; A589-R591 VanDerWaalsContact O-N 3.12Å; A589-T592 WeakPolarHBondContact CA-OG1 3.47Å; A589-T592 PolarHBondContact O-N 3.12Å; A589-T592 PolarHBondContact O-OG1 2.63Å; A589-G593 PolarHBondContact O-N 2.67Å; A589-G593 VanDerWaalsContact O-N 3.09Å
590	S	66.3	Low	68.4	Low	88 Å²	88	114.3 Å²	114.3	62%	0.615	59%	0.585	S	S	*	*	H	α-helix	trans	-64.8	-11.8	173.5	-177.7	0	0	0	0	114.3	L586 E588	L586-S590 WeakPolarHBondContact O-CB 3.37Å; L586-S590 PolarHBondContact O-N 3.19Å; E588-S590 VanDerWaalsContact C-N 3.31Å; E588-S590 PolarHBondContact O-N 2.93Å
591	R	62.5	Low	67.6	Low	152 Å²	152	112.2 Å²	112.2	57%	0.574	59%	0.588	S	S	*	*	H	α-helix	trans	-97.6	-30.3	173.4	-74.8	166	177.3	166.1	-0.7	113.5	K587 E588 A589 G593	K587-R591 WeakPolarHBondContact O-CD 3.38Å; K587-R591 WeakPolarHBondContact O-CG 3.47Å; E588-R591 WeakPolarHBondContact O-CA 3.47Å; E588-R591 WeakPolarHBondContact O-CB 3.46Å; E588-R591 PolarHBondContact O-N 2.93Å; E588-R591 IonicContact OE1-NH1 2.72Å; A589-R591 PolarHBondContact O-N 3.45Å; A589-R591 VanDerWaalsContact O-N 3.12Å; R591-G593 VanDerWaalsContact C-N 3.31Å
592	T	58.1	Low	67	Low	118 Å²	118	111.9 Å²	111.9	72%	0.724	59%	0.587	S	S	*	*	H	α-helix	trans	-70.7	-29.8	170.4	32.7	0	0	0	0	111.4	E588 A589 G594	E588-T592 PolarHBondContact O-N 3.14Å; E588-T592 PolarHBondContact O-OG1 2.82Å; A589-T592 WeakPolarHBondContact CA-OG1 3.47Å; A589-T592 PolarHBondContact O-N 3.12Å; A589-T592 PolarHBondContact O-OG1 2.63Å; T592-G594 VanDerWaalsContact C-N 3.3Å; T592-G594 PolarHBondContact O-N 2.71Å
593	G	49.2	Very low	66.5	Low	54 Å²	54	107.6 Å²	107.6	56%	0.557	57%	0.573	S	S	*	*	S	Bend	trans	-64.8	73.4	172.2	0	0	0	0	0	115.4	A589 R591 N595	A589-G593 PolarHBondContact O-N 2.67Å; A589-G593 VanDerWaalsContact O-N 3.09Å; R591-G593 VanDerWaalsContact C-N 3.31Å; G593-N595 VanDerWaalsContact C-N 3.26Å; G593-N595 PolarHBondContact O-N 2.84Å
594	G	48.5	Very low	66.2	Low	71 Å²	71	103.9 Å²	103.9	73%	0.732	57%	0.565	S	S	*	*	S	Bend	trans	71.5	-52.1	162.4	0	0	0	0	0	117.2	T592 K596	T592-G594 VanDerWaalsContact C-N 3.3Å; T592-G594 PolarHBondContact O-N 2.71Å; G594-K596 PolarHBondContact O-N 2.92Å; G594-K596 VanDerWaalsContact O-N 3.14Å
595	N	49.1	Very low	66.2	Low	135 Å²	135	103 Å²	103	72%	0.722	56%	0.561	S	S	*	*			trans	-89.9	76.7	-173.2	-85.7	-53.5	0	0	0	112.4	G593 K597	G593-N595 VanDerWaalsContact C-N 3.26Å; G593-N595 PolarHBondContact O-N 2.84Å; N595-K597 VanDerWaalsContact C-N 3.3Å; N595-K597 PolarHBondContact O-N 3.04Å
596	K	57.8	Low	66	Low	180 Å²	180	100.2 Å²	100.2	78%	0.783	55%	0.553	S	S	*	*			trans	-61.1	85.7	170.4	-66.9	-176.6	-178.9	178.6	0	111.2	G594	G594-K596 PolarHBondContact O-N 2.92Å; G594-K596 VanDerWaalsContact O-N 3.14Å
597	K	60.6	Low	65.8	Low	184 Å²	184	99.8 Å²	99.8	80%	0.8	55%	0.55	S	S	*	*	P	Polyproline II helix	trans	-54.9	120.6	166.2	-71.3	174.5	179.9	170.1	0	107.2	N595 S599	N595-K597 VanDerWaalsContact C-N 3.3Å; N595-K597 PolarHBondContact O-N 3.04Å; K597-S599 PolarHBondContact O-N 3.26Å
598	P	57.1	Low	65.9	Low	76 Å²	76	99.8 Å²	99.8	49%	0.494	55%	0.551	S	S	.	*	P	Polyproline II helix	trans	-58.6	134.7	-165.5	21.7	-33.8	0	0	0	110.6	E602 V603	P598-E602 VanDerWaalsContact CA-OE2 3.23Å; P598-E602 WeakPolarHBondContact CA-OE2 3.47Å; P598-E602 HydrophobicContact CB-CB 4.32Å; P598-E602 WeakPolarHBondContact CB-OE2 3.49Å; P598-V603 HydrophobicContact CB-CG2 4Å; P598-V603 HydrophobicContact CG-CG2 3.91Å
599	S	63.1	Low	65.9	Low	45 Å²	45	100.3 Å²	100.3	32%	0.315	55%	0.551	S	S	.	*	P	Polyproline II helix	trans	-61.2	155.3	-171.3	73.4	0	0	0	0	111.2	K597 A601 E602 V603	K597-S599 PolarHBondContact O-N 3.26Å; S599-A601 CarbonylContact O-C 3.58Å; S599-A601 PolarHBondContact O-N 3.16Å; S599-E602 WeakPolarHBondContact CB-OE1 3.4Å; S599-E602 VanDerWaalsContact N-CD 3.31Å; S599-E602 PolarHBondContact N-OE1 2.89Å; S599-E602 PolarHBondContact N-OE2 3.04Å; S599-E602 PolarHBondContact O-N 2.96Å; S599-E602 WeakPolarHBondContact OG-CG 3.47Å; S599-E602 PolarHBondContact OG-N 3.46Å; S599-E602 VanDerWaalsContact OG-N 3.15Å; S599-E602 PolarHBondContact OG-OE1 3.43Å; S599-V603 WeakPolarHBondContact O-CG2 3.05Å; S599-V603 PolarHBondContact O-N 3.03Å
600	K	65.7	Low	65.8	Low	189 Å²	189	102.7 Å²	102.7	82%	0.822	56%	0.555	S	S	*	*	H	α-helix	trans	-57.6	-26.8	176.7	-165.5	175.2	-179.5	179.9	0	111.4	T604	K600-T604 VanDerWaalsContact O-CG2 3.28Å; K600-T604 WeakPolarHBondContact O-CG2 3.36Å; K600-T604 PolarHBondContact O-N 3.32Å
601	A	69.7	Low	65.9	Low	63 Å²	63	100.8 Å²	100.8	52%	0.521	54%	0.54	S	S	.	.	H	α-helix	trans	-65.2	-60.1	169.2	0	0	0	0	0	111.5	S599 V603 T604 E605	S599-A601 CarbonylContact O-C 3.58Å; S599-A601 PolarHBondContact O-N 3.16Å; A601-V603 VanDerWaalsContact C-N 3.3Å; A601-V603 PolarHBondContact O-N 3.03Å; A601-T604 CarbonylContact O-C 3.59Å; A601-T604 WeakPolarHBondContact O-CA 3.28Å; A601-T604 PolarHBondContact O-N 3.46Å; A601-T604 PolarHBondContact O-OG1 3.02Å; A601-E605 WeakPolarHBondContact O-CG 3.48Å; A601-E605 PolarHBondContact O-N 3.01Å
602	E	75.3	Confident	66.5	Low	92 Å²	92	102.6 Å²	102.6	43%	0.43	55%	0.552	S	S	.	*	H	α-helix	trans	-53.3	-42	178.7	-72	144.4	-122.8	0	0	113.1	P598 S599 T604 E605 N606	P598-E602 VanDerWaalsContact CA-OE2 3.23Å; P598-E602 WeakPolarHBondContact CA-OE2 3.47Å; P598-E602 HydrophobicContact CB-CB 4.32Å; P598-E602 WeakPolarHBondContact CB-OE2 3.49Å; S599-E602 WeakPolarHBondContact CB-OE1 3.4Å; S599-E602 VanDerWaalsContact N-CD 3.31Å; S599-E602 PolarHBondContact N-OE1 2.89Å; S599-E602 PolarHBondContact N-OE2 3.04Å; S599-E602 PolarHBondContact O-N 2.96Å; S599-E602 WeakPolarHBondContact OG-CG 3.47Å; S599-E602 PolarHBondContact OG-N 3.46Å; S599-E602 VanDerWaalsContact OG-N 3.15Å; S599-E602 PolarHBondContact OG-OE1 3.43Å; E602-T604 PolarHBondContact O-N 2.87Å; E602-E605 WeakPolarHBondContact O-CB 3.29Å; E602-E605 PolarHBondContact O-N 3.46Å; E602-E605 VanDerWaalsContact O-N 3.14Å; E602-N606 WeakPolarHBondContact O-CB 3.44Å; E602-N606 VanDerWaalsContact O-CG 3.23Å; E602-N606 PolarHBondContact O-N 3.34Å; E602-N606 PolarHBondContact O-ND2 2.87Å
603	V	72.8	Confident	67.1	Low	64 Å²	64	99.6 Å²	99.6	39%	0.388	54%	0.544	S	S	.	.	H	α-helix	trans	-62.9	-43.1	176.8	176.3	0	0	0	0	110.6	P598 S599 A601 E605 N606 L607	P598-V603 HydrophobicContact CB-CG2 4Å; P598-V603 HydrophobicContact CG-CG2 3.91Å; S599-V603 WeakPolarHBondContact O-CG2 3.05Å; S599-V603 PolarHBondContact O-N 3.03Å; A601-V603 VanDerWaalsContact C-N 3.3Å; A601-V603 PolarHBondContact O-N 3.03Å; V603-E605 VanDerWaalsContact C-N 3.32Å; V603-E605 PolarHBondContact O-N 3.15Å; V603-N606 PolarHBondContact O-N 2.98Å; V603-L607 HydrophobicContact CG1-CD1 4.2Å; V603-L607 WeakPolarHBondContact O-CB 3.26Å; V603-L607 WeakPolarHBondContact O-CG 3.34Å; V603-L607 PolarHBondContact O-N 3.34Å
604	T	73.9	Confident	67.4	Low	55 Å²	55	100.1 Å²	100.1	34%	0.337	55%	0.55	S	S	.	.	H	α-helix	trans	-68.3	-31	173.3	71.1	0	0	0	0	112.7	K600 A601 E602 K608	K600-T604 VanDerWaalsContact O-CG2 3.28Å; K600-T604 WeakPolarHBondContact O-CG2 3.36Å; K600-T604 PolarHBondContact O-N 3.32Å; A601-T604 CarbonylContact O-C 3.59Å; A601-T604 WeakPolarHBondContact O-CA 3.28Å; A601-T604 PolarHBondContact O-N 3.46Å; A601-T604 PolarHBondContact O-OG1 3.02Å; E602-T604 PolarHBondContact O-N 2.87Å; T604-K608 WeakPolarHBondContact O-CB 3.46Å; T604-K608 VanDerWaalsContact O-CD 3.28Å; T604-K608 WeakPolarHBondContact O-CD 3.48Å; T604-K608 WeakPolarHBondContact O-CG 3.37Å; T604-K608 PolarHBondContact O-N 3.26Å; T604-K608 PolarHBondContact OG1-NZ 3.18Å
605	E	80.2	Confident	68.1	Low	95 Å²	95	106.7 Å²	106.7	44%	0.444	56%	0.558	S	S	.	*	H	α-helix	trans	-67	-44.5	174	-69.6	-137.2	146.9	0	0	112.5	A601 E602 V603 L607 K608 K609	A601-E605 WeakPolarHBondContact O-CG 3.48Å; A601-E605 PolarHBondContact O-N 3.01Å; E602-E605 WeakPolarHBondContact O-CB 3.29Å; E602-E605 PolarHBondContact O-N 3.46Å; E602-E605 VanDerWaalsContact O-N 3.14Å; V603-E605 VanDerWaalsContact C-N 3.32Å; V603-E605 PolarHBondContact O-N 3.15Å; E605-L607 VanDerWaalsContact C-N 3.3Å; E605-L607 PolarHBondContact O-N 2.84Å; E605-K608 CarbonylContact O-C 3.6Å; E605-K608 WeakPolarHBondContact O-CA 3.2Å; E605-K608 WeakPolarHBondContact O-CB 3.32Å; E605-K608 PolarHBondContact O-N 2.76Å; E605-K608 VanDerWaalsContact O-N 3.08Å; E605-K609 WeakPolarHBondContact O-CB 3.44Å; E605-K609 VanDerWaalsContact O-CG 3.23Å; E605-K609 WeakPolarHBondContact O-CG 3.48Å; E605-K609 PolarHBondContact O-N 2.96Å; E605-K609 IonicContact OE2-NZ 2.62Å; E605-K609 PolarHBondContact OE2-NZ 2.92Å
606	N	75.9	Confident	68.2	Low	78 Å²	78	102.6 Å²	102.6	42%	0.417	54%	0.543	S	S	.	.	H	α-helix	trans	-69.6	-34.2	-179.3	-65.1	-17.8	0	0	0	110.2	E602 V603 K609 L610	E602-N606 WeakPolarHBondContact O-CB 3.44Å; E602-N606 VanDerWaalsContact O-CG 3.23Å; E602-N606 PolarHBondContact O-N 3.34Å; E602-N606 PolarHBondContact O-ND2 2.87Å; V603-N606 PolarHBondContact O-N 2.98Å; N606-K609 PolarHBondContact O-N 3.37Å; N606-K609 PolarHBondContact OD1-NZ 3.26Å; N606-L610 VanDerWaalsContact O-CD1 3.23Å; N606-L610 WeakPolarHBondContact O-CD1 3.38Å; N606-L610 PolarHBondContact O-N 3.4Å
607	L	71.1	Confident	68.2	Low	81 Å²	81	100.5 Å²	100.5	42%	0.424	55%	0.545	S	S	.	.	H	α-helix	trans	-63.1	-40.2	165.4	-76.4	168.5	0	0	0	113.3	V603 E605 K609 T611 I618	V603-L607 HydrophobicContact CG1-CD1 4.2Å; V603-L607 WeakPolarHBondContact O-CB 3.26Å; V603-L607 WeakPolarHBondContact O-CG 3.34Å; V603-L607 PolarHBondContact O-N 3.34Å; E605-L607 VanDerWaalsContact C-N 3.3Å; E605-L607 PolarHBondContact O-N 2.84Å; L607-K609 VanDerWaalsContact C-N 3.34Å; L607-T611 PolarHBondContact O-N 2.97Å; L607-T611 PolarHBondContact O-OG1 2.94Å; L607-I618 HydrophobicContact CB-CD1 3.95Å; L607-I618 HydrophobicContact CD2-CD1 4.17Å
608	K	76.1	Confident	67.9	Low	115 Å²	115	95.5 Å²	95.5	50%	0.5	53%	0.526	S	S	.	.	H	α-helix	trans	-65.5	-34	172.6	-71.7	157.2	-170.2	158.1	0	112	T604 E605 T611 K612	T604-K608 WeakPolarHBondContact O-CB 3.46Å; T604-K608 VanDerWaalsContact O-CD 3.28Å; T604-K608 WeakPolarHBondContact O-CD 3.48Å; T604-K608 WeakPolarHBondContact O-CG 3.37Å; T604-K608 PolarHBondContact O-N 3.26Å; T604-K608 PolarHBondContact OG1-NZ 3.18Å; E605-K608 CarbonylContact O-C 3.6Å; E605-K608 WeakPolarHBondContact O-CA 3.2Å; E605-K608 WeakPolarHBondContact O-CB 3.32Å; E605-K608 PolarHBondContact O-N 2.76Å; E605-K608 VanDerWaalsContact O-N 3.08Å; K608-T611 WeakPolarHBondContact CA-OG1 3.29Å; K608-T611 PolarHBondContact O-OG1 3.27Å; K608-K612 WeakPolarHBondContact O-CB 3.02Å; K608-K612 VanDerWaalsContact O-CG 3.26Å; K608-K612 WeakPolarHBondContact O-CG 3.4Å; K608-K612 PolarHBondContact O-N 2.9Å; K608-K612 VanDerWaalsContact O-N 3.1Å
609	K	78.5	Confident	67.5	Low	112 Å²	112	100 Å²	100	49%	0.487	55%	0.545	S	S	.	.	H	α-helix	trans	-70.5	-46.6	175.8	-68.5	159.5	-164.3	160.7	0	110.5	E605 N606 L607 T611 K612 G613	E605-K609 WeakPolarHBondContact O-CB 3.44Å; E605-K609 VanDerWaalsContact O-CG 3.23Å; E605-K609 WeakPolarHBondContact O-CG 3.48Å; E605-K609 PolarHBondContact O-N 2.96Å; E605-K609 IonicContact OE2-NZ 2.62Å; E605-K609 PolarHBondContact OE2-NZ 2.92Å; N606-K609 PolarHBondContact O-N 3.37Å; N606-K609 PolarHBondContact OD1-NZ 3.26Å; L607-K609 VanDerWaalsContact C-N 3.34Å; K609-T611 PolarHBondContact O-N 3.19Å; K609-K612 PolarHBondContact O-N 3.32Å; K609-G613 PolarHBondContact O-N 3.5Å
610	L	71.1	Confident	67.1	Low	109 Å²	109	104.8 Å²	104.8	57%	0.571	56%	0.561	S	S	*	*	H	α-helix	trans	-62.6	-41.8	175.7	-95	77.4	0	0	0	113.1	N606 G613	N606-L610 VanDerWaalsContact O-CD1 3.23Å; N606-L610 WeakPolarHBondContact O-CD1 3.38Å; N606-L610 PolarHBondContact O-N 3.4Å; L610-G613 WeakPolarHBondContact O-CA 3.3Å; L610-G613 PolarHBondContact O-N 2.71Å; L610-G613 VanDerWaalsContact O-N 3.15Å
611	T	68.4	Low	66.4	Low	49 Å²	49	100.5 Å²	100.5	30%	0.301	55%	0.546	S	S	.	.	H	α-helix	trans	-69.1	-38.2	177.5	43.8	0	0	0	0	113	L607 K608 K609 G613 G614 I618	L607-T611 PolarHBondContact O-N 2.97Å; L607-T611 PolarHBondContact O-OG1 2.94Å; K608-T611 WeakPolarHBondContact CA-OG1 3.29Å; K608-T611 PolarHBondContact O-OG1 3.27Å; K609-T611 PolarHBondContact O-N 3.19Å; T611-G613 PolarHBondContact O-N 3.49Å; T611-G614 PolarHBondContact O-N 3.38Å; T611-G614 VanDerWaalsContact O-N 3.11Å; T611-I618 HydrophobicContact CG2-CB 4.13Å; T611-I618 HydrophobicContact CG2-CD1 3.5Å; T611-I618 VanDerWaalsContact CG2-CD1 3.5Å; T611-I618 HydrophobicContact CG2-CG1 3.5Å
612	K	74.6	Confident	65.5	Low	189 Å²	189	104.9 Å²	104.9	82%	0.822	56%	0.556	S	S	*	*	H	α-helix	trans	-60	-31.4	168.6	-77.7	176.6	177.5	-174.9	0	112.3	K608 K609 G614	K608-K612 WeakPolarHBondContact O-CB 3.02Å; K608-K612 VanDerWaalsContact O-CG 3.26Å; K608-K612 WeakPolarHBondContact O-CG 3.4Å; K608-K612 PolarHBondContact O-N 2.9Å; K608-K612 VanDerWaalsContact O-N 3.1Å; K609-K612 PolarHBondContact O-N 3.32Å; K612-G614 PolarHBondContact O-N 2.74Å
613	G	70.6	Confident	64.6	Low	55 Å²	55	102.3 Å²	102.3	57%	0.567	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	2.6	174.5	0	0	0	0	0	115.7	K609 L610 T611 K615	K609-G613 PolarHBondContact O-N 3.5Å; L610-G613 WeakPolarHBondContact O-CA 3.3Å; L610-G613 PolarHBondContact O-N 2.71Å; L610-G613 VanDerWaalsContact O-N 3.15Å; T611-G613 PolarHBondContact O-N 3.49Å; G613-K615 PolarHBondContact O-N 2.67Å
614	G	55.9	Low	63.7	Low	65 Å²	65	105.6 Å²	105.6	67%	0.67	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	69.8	-8	170.8	0	0	0	0	0	117	T611 K612 A616	T611-G614 PolarHBondContact O-N 3.38Å; T611-G614 VanDerWaalsContact O-N 3.11Å; K612-G614 PolarHBondContact O-N 2.74Å; G614-A616 VanDerWaalsContact C-N 3.34Å; G614-A616 PolarHBondContact O-N 2.6Å
615	K	62.4	Low	62.7	Low	209 Å²	209	110.4 Å²	110.4	91%	0.909	59%	0.588	S	S	*	*	S	Bend	trans	-77.3	-13.5	-178.9	-78.4	-173.6	173.5	-178.4	0	114.8	G613	G613-K615 PolarHBondContact O-N 2.67Å
616	A	51.4	Low	61.6	Low	49 Å²	49	113.3 Å²	113.3	41%	0.405	60%	0.599	S	S	.	*			trans	-145.3	142.9	176.8	0	0	0	0	0	111.1	G614	G614-A616 VanDerWaalsContact C-N 3.34Å; G614-A616 PolarHBondContact O-N 2.6Å
617	V	57	Low	60.9	Low	136 Å²	136	112.9 Å²	112.9	82%	0.824	61%	0.606	S	S	*	*			trans	-106.1	116	168.6	178	0	0	0	0	107.5	L619	V617-L619 PolarHBondContact O-N 2.77Å
618	I	55.2	Low	60.4	Low	79 Å²	79	114.2 Å²	114.2	41%	0.405	61%	0.613	S	S	.	*			trans	-69.9	114.2	169.8	-71.1	170.2	0	0	0	107.8	L607 T611 K620	L607-I618 HydrophobicContact CB-CD1 3.95Å; L607-I618 HydrophobicContact CD2-CD1 4.17Å; T611-I618 HydrophobicContact CG2-CB 4.13Å; T611-I618 HydrophobicContact CG2-CD1 3.5Å; T611-I618 VanDerWaalsContact CG2-CD1 3.5Å; T611-I618 HydrophobicContact CG2-CG1 3.5Å; I618-K620 VanDerWaalsContact C-N 3.29Å; I618-K620 HydrophobicContact CG2-CG 4.17Å; I618-K620 PolarHBondContact O-N 2.73Å
619	L	49.2	Very low	59.6	Low	171 Å²	171	119.9 Å²	119.9	90%	0.895	63%	0.631	S	S	*	*			trans	-62.9	95	160.2	-79.2	166.7	0	0	0	107.7	V617 D621	V617-L619 PolarHBondContact O-N 2.77Å; L619-D621 PolarHBondContact O-N 3.48Å
620	K	54.3	Low	59.6	Low	146 Å²	146	117.4 Å²	117.4	64%	0.635	63%	0.628	S	S	*	*			trans	-75.5	110.6	171.7	-61.5	-173.9	178.7	178.7	0	109.1	I618 E622	I618-K620 VanDerWaalsContact C-N 3.29Å; I618-K620 HydrophobicContact CG2-CG 4.17Å; I618-K620 PolarHBondContact O-N 2.73Å; K620-E622 HydrophobicContact CB-CG 3.64Å; K620-E622 HydrophobicContact CD-CG 3.74Å; K620-E622 WeakPolarHBondContact CD-OE1 3.49Å; K620-E622 WeakPolarHBondContact CE-OE1 3.35Å; K620-E622 HydrophobicContact CG-CG 4.43Å; K620-E622 IonicContact NZ-OE1 2.63Å; K620-E622 PolarHBondContact NZ-OE1 3.26Å; K620-E622 PolarHBondContact O-N 3Å
621	D	50.3	Low	59.9	Low	98 Å²	98	116.4 Å²	116.4	52%	0.524	63%	0.63	S	S	.	*			trans	-76.7	71.3	161.1	-103.1	-31.8	0	0	0	109.7	L619 G623 K624	L619-D621 PolarHBondContact O-N 3.48Å; D621-G623 VanDerWaalsContact C-N 3.34Å; D621-G623 PolarHBondContact O-N 3.07Å; D621-K624 HydrophobicContact CB-CD 4.22Å; D621-K624 WeakPolarHBondContact OD1-CE 3.41Å; D621-K624 IonicContact OD1-NZ 2.6Å; D621-K624 PolarHBondContact OD1-NZ 3.34Å; D621-K624 IonicContact OD2-NZ 2.67Å; D621-K624 PolarHBondContact OD2-NZ 2.86Å
622	E	51.5	Low	60.5	Low	155 Å²	155	121.6 Å²	121.6	72%	0.724	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.1	89.9	177.7	-62.2	-164.4	147.5	0	0	110.4	K620	K620-E622 HydrophobicContact CB-CG 3.64Å; K620-E622 HydrophobicContact CD-CG 3.74Å; K620-E622 WeakPolarHBondContact CD-OE1 3.49Å; K620-E622 WeakPolarHBondContact CE-OE1 3.35Å; K620-E622 HydrophobicContact CG-CG 4.43Å; K620-E622 IonicContact NZ-OE1 2.63Å; K620-E622 PolarHBondContact NZ-OE1 3.26Å; K620-E622 PolarHBondContact O-N 3Å
623	G	55.8	Low	60.6	Low	39 Å²	39	113.6 Å²	113.6	40%	0.402	62%	0.62	S	S	.	*	T	Hydrogen-bonded Turn	trans	133.6	-9.1	163.9	0	0	0	0	0	117.6	D621	D621-G623 VanDerWaalsContact C-N 3.34Å; D621-G623 PolarHBondContact O-N 3.07Å
624	K	53.5	Low	61.2	Low	132 Å²	132	115.9 Å²	115.9	57%	0.574	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.8	-27.9	-174.1	-66	-178.9	-172.5	159.7	0	114.9	D621 K626	D621-K624 HydrophobicContact CB-CD 4.22Å; D621-K624 WeakPolarHBondContact OD1-CE 3.41Å; D621-K624 IonicContact OD1-NZ 2.6Å; D621-K624 PolarHBondContact OD1-NZ 3.34Å; D621-K624 IonicContact OD2-NZ 2.67Å; D621-K624 PolarHBondContact OD2-NZ 2.86Å; K624-K626 VanDerWaalsContact C-N 3.26Å; K624-K626 PolarHBondContact O-N 2.98Å
625	D	52.6	Low	62.6	Low	157 Å²	157	118.4 Å²	118.4	84%	0.84	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.7	-9.3	-171.1	-60	-16.7	0	0	0	114.5	A627	D625-A627 PolarHBondContact O-N 3.03Å; D625-A627 VanDerWaalsContact O-N 3.16Å
626	K	58.8	Low	63.5	Low	155 Å²	155	110.9 Å²	110.9	67%	0.674	58%	0.581	S	S	*	*	S	Bend	trans	-83	91.1	176.3	-70.3	-176.1	-179.1	177.9	0	109.6	K624 L628	K624-K626 VanDerWaalsContact C-N 3.26Å; K624-K626 PolarHBondContact O-N 2.98Å; K626-L628 PolarHBondContact O-N 3.46Å
627	A	59.9	Low	64.9	Low	70 Å²	70	111.7 Å²	111.7	58%	0.579	58%	0.577	S	S	*	*			trans	-47.3	134	176.3	0	0	0	0	0	112	D625 R629	D625-A627 PolarHBondContact O-N 3.03Å; D625-A627 VanDerWaalsContact O-N 3.16Å; A627-R629 HydrophobicContact CB-CG 4.26Å; A627-R629 PolarHBondContact O-N 3.46Å
628	L	60.4	Low	66.1	Low	108 Å²	108	109 Å²	109	57%	0.565	56%	0.557	S	S	*	*	S	Bend	trans	-71.5	47.7	-171	-66.5	175.5	0	0	0	114.3	K626 F634 Q637	K626-L628 PolarHBondContact O-N 3.46Å; L628-F634 HydrophobicContact CD2-CB 4.29Å; L628-F634 HydrophobicContact CD2-CD2 4.2Å; L628-Q637 VanDerWaalsContact CD2-OE1 3.32Å
629	R	60.4	Low	67.5	Low	234 Å²	234	110.7 Å²	110.7	88%	0.883	56%	0.563	S	S	*	*			trans	-88.7	-0.1	-174.8	-63	-177.7	68.2	153.8	1.1	114.1	A627	A627-R629 HydrophobicContact CB-CG 4.26Å; A627-R629 PolarHBondContact O-N 3.46Å
630	S	78.8	Confident	69	Low	61 Å²	61	106.6 Å²	106.6	43%	0.427	54%	0.542	S	S	.	.	S	Bend	trans	-142.9	150	170.4	77.6	0	0	0	0	111.9	Q632 A633 F634	S630-Q632 VanDerWaalsContact C-N 3.27Å; S630-Q632 PolarHBondContact O-N 3.28Å; S630-A633 WeakPolarHBondContact O-CB 3.44Å; S630-A633 PolarHBondContact O-N 3.13Å; S630-A633 PolarHBondContact OG-N 3.45Å; S630-F634 PolarHBondContact O-N 3.17Å
631	S	77.4	Confident	70.4	Confident	87 Å²	87	105 Å²	105	61%	0.608	54%	0.537	S	S	*	.	H	α-helix	trans	-60.3	-36.6	175.6	50.3	0	0	0	0	112.2	A633 F634 F635	S631-A633 VanDerWaalsContact C-N 3.35Å; S631-A633 PolarHBondContact O-N 3.18Å; S631-F634 WeakPolarHBondContact O-CB 3.39Å; S631-F634 PolarHBondContact O-N 3.21Å; S631-F635 WeakPolarHBondContact O-CD2 3.23Å; S631-F635 PolarHBondContact O-N 3.11Å
632	Q	80.1	Confident	71.9	Confident	158 Å²	158	103.8 Å²	103.8	74%	0.738	53%	0.533	S	S	*	.	H	α-helix	trans	-64	-36.7	176.4	-168.4	179.1	6.6	0	0	112.5	S630 S636	S630-Q632 VanDerWaalsContact C-N 3.27Å; S630-Q632 PolarHBondContact O-N 3.28Å; Q632-S636 WeakPolarHBondContact O-CB 3.34Å; Q632-S636 PolarHBondContact O-N 3.34Å; Q632-S636 PolarHBondContact O-OG 3.06Å
633	A	77.4	Confident	73.3	Confident	21 Å²	21	101.7 Å²	101.7	17%	0.174	52%	0.521	C	S	.	.	H	α-helix	trans	-65.8	-44.4	172.9	0	0	0	0	0	111.3	S630 S631 S636 Q637	S630-A633 WeakPolarHBondContact O-CB 3.44Å; S630-A633 PolarHBondContact O-N 3.13Å; S630-A633 PolarHBondContact OG-N 3.45Å; S631-A633 VanDerWaalsContact C-N 3.35Å; S631-A633 PolarHBondContact O-N 3.18Å; A633-S636 WeakPolarHBondContact CA-OG 3.4Å; A633-S636 PolarHBondContact O-N 3.12Å; A633-S636 PolarHBondContact O-OG 2.79Å; A633-Q637 WeakPolarHBondContact O-CB 3.46Å; A633-Q637 PolarHBondContact O-N 3.46Å
634	F	83.4	Confident	74.3	Confident	104 Å²	104	103 Å²	103	46%	0.456	52%	0.524	S	S	.	.	H	α-helix	trans	-59.9	-49.3	176.2	178.8	-95.4	0	0	0	112.5	L628 S630 S631 S636 Q637 L638	L628-F634 HydrophobicContact CD2-CB 4.29Å; L628-F634 HydrophobicContact CD2-CD2 4.2Å; S630-F634 PolarHBondContact O-N 3.17Å; S631-F634 WeakPolarHBondContact O-CB 3.39Å; S631-F634 PolarHBondContact O-N 3.21Å; F634-S636 PolarHBondContact O-N 3.49Å; F634-Q637 PolarHBondContact O-N 3.31Å; F634-L638 WeakPolarHBondContact O-CB 3.48Å; F634-L638 PolarHBondContact O-N 2.88Å
635	F	83.8	Confident	75.5	Confident	118 Å²	118	102.3 Å²	102.3	52%	0.518	52%	0.523	S	S	.	.	H	α-helix	trans	-69.6	-32.1	-178.9	-74.7	-62.5	0	0	0	113.6	S631 L638 Q639	S631-F635 WeakPolarHBondContact O-CD2 3.23Å; S631-F635 PolarHBondContact O-N 3.11Å; F635-L638 HydrophobicContact CD1-CD2 4.24Å; F635-Q639 WeakPolarHBondContact O-CG 3.49Å; F635-Q639 PolarHBondContact O-N 3.38Å
636	S	81.9	Confident	76.7	Confident	50 Å²	50	99.8 Å²	99.8	35%	0.35	51%	0.509	S	S	.	.	H	α-helix	trans	-68.9	-42.5	172.9	47.3	0	0	0	0	111.8	Q632 A633 F634 L638 Q639 D640	Q632-S636 WeakPolarHBondContact O-CB 3.34Å; Q632-S636 PolarHBondContact O-N 3.34Å; Q632-S636 PolarHBondContact O-OG 3.06Å; A633-S636 WeakPolarHBondContact CA-OG 3.4Å; A633-S636 PolarHBondContact O-N 3.12Å; A633-S636 PolarHBondContact O-OG 2.79Å; F634-S636 PolarHBondContact O-N 3.49Å; S636-L638 VanDerWaalsContact C-N 3.34Å; S636-L638 PolarHBondContact O-N 2.99Å; S636-Q639 PolarHBondContact O-N 3.27Å; S636-D640 PolarHBondContact O-N 3.13Å
637	Q	81.3	Confident	77.4	Confident	67 Å²	67	98.8 Å²	98.8	31%	0.313	50%	0.504	S	S	.	.	H	α-helix	trans	-61.3	-40.2	173.1	-170.7	172.9	2.9	0	0	112.2	L628 A633 F634 D640 Q641	L628-Q637 VanDerWaalsContact CD2-OE1 3.32Å; A633-Q637 WeakPolarHBondContact O-CB 3.46Å; A633-Q637 PolarHBondContact O-N 3.46Å; F634-Q637 PolarHBondContact O-N 3.31Å; Q637-D640 PolarHBondContact O-N 3.36Å; Q637-Q641 WeakPolarHBondContact O-CB 3.17Å; Q637-Q641 PolarHBondContact O-N 2.89Å
638	L	82	Confident	77.7	Confident	79 Å²	79	98.2 Å²	98.2	41%	0.414	50%	0.496	S	S	.	.	H	α-helix	trans	-61.2	-45.2	173.8	-172	73.8	0	0	0	111.8	F634 F635 S636 D640 Q641 V642	F634-L638 WeakPolarHBondContact O-CB 3.48Å; F634-L638 PolarHBondContact O-N 2.88Å; F635-L638 HydrophobicContact CD1-CD2 4.24Å; S636-L638 VanDerWaalsContact C-N 3.34Å; S636-L638 PolarHBondContact O-N 2.99Å; L638-D640 PolarHBondContact O-N 3.25Å; L638-Q641 PolarHBondContact O-N 3.33Å; L638-V642 WeakPolarHBondContact O-CG2 3.43Å; L638-V642 PolarHBondContact O-N 3.39Å
639	Q	85.3	Confident	78.1	Confident	114 Å²	114	97 Å²	97	53%	0.533	49%	0.493	S	S	.	.	H	α-helix	trans	-62.5	-41.2	176.1	-75	178.4	14.9	0	0	112.3	F635 S636 V642 K643	F635-Q639 WeakPolarHBondContact O-CG 3.49Å; F635-Q639 PolarHBondContact O-N 3.38Å; S636-Q639 PolarHBondContact O-N 3.27Å; Q639-V642 PolarHBondContact O-N 2.99Å; Q639-K643 VanDerWaalsContact O-CG 3.23Å; Q639-K643 WeakPolarHBondContact O-CG 3.48Å; Q639-K643 PolarHBondContact O-N 3.4Å
640	D	80.7	Confident	78.5	Confident	86 Å²	86	93.1 Å²	93.1	46%	0.46	48%	0.483	S	S	.	.	H	α-helix	trans	-72.4	-33.4	179.3	-69.5	-20.7	0	0	0	112.1	S636 Q637 L638 K643 S644	S636-D640 PolarHBondContact O-N 3.13Å; Q637-D640 PolarHBondContact O-N 3.36Å; L638-D640 PolarHBondContact O-N 3.25Å; D640-K643 PolarHBondContact O-N 2.87Å; D640-K643 WeakPolarHBondContact OD1-CD 3.26Å; D640-K643 WeakPolarHBondContact OD1-CE 3.5Å; D640-K643 IonicContact OD1-NZ 2.77Å; D640-K643 PolarHBondContact OD1-NZ 2.87Å; D640-S644 WeakPolarHBondContact O-CB 3.41Å; D640-S644 PolarHBondContact O-N 3.49Å; D640-S644 PolarHBondContact O-OG 3.22Å
641	Q	82.2	Confident	77.4	Confident	113 Å²	113	94.6 Å²	94.6	53%	0.528	48%	0.483	S	S	.	.	H	α-helix	trans	-61.5	-46.2	169.8	-165.6	172.6	16.4	0	0	111	Q637 L638 S644 Q645	Q637-Q641 WeakPolarHBondContact O-CB 3.17Å; Q637-Q641 PolarHBondContact O-N 2.89Å; L638-Q641 PolarHBondContact O-N 3.33Å; Q641-S644 PolarHBondContact O-N 3.35Å; Q641-S644 PolarHBondContact O-OG 3Å; Q641-Q645 PolarHBondContact O-N 3.43Å; Q641-Q645 VanDerWaalsContact O-N 3.13Å
642	V	82.6	Confident	76.4	Confident	72 Å²	72	97.6 Å²	97.6	44%	0.436	49%	0.487	S	S	.	.	H	α-helix	trans	-61.1	-45.4	173.5	169.9	0	0	0	0	111.7	L638 Q639 S644 Q645 I646	L638-V642 WeakPolarHBondContact O-CG2 3.43Å; L638-V642 PolarHBondContact O-N 3.39Å; Q639-V642 PolarHBondContact O-N 2.99Å; V642-S644 VanDerWaalsContact C-N 3.3Å; V642-S644 PolarHBondContact O-N 2.93Å; V642-Q645 PolarHBondContact O-N 2.93Å; V642-I646 HydrophobicContact CG1-CD1 3.75Å; V642-I646 HydrophobicContact CG1-CG1 4.49Å; V642-I646 WeakPolarHBondContact O-CG1 3.35Å; V642-I646 PolarHBondContact O-N 3.37Å
643	K	81	Confident	75.1	Confident	110 Å²	110	94.3 Å²	94.3	48%	0.478	48%	0.482	S	S	.	.	H	α-helix	trans	-58.8	-39.7	175.5	-70.4	165.5	-150.4	161.4	0	112	Q639 D640 I646 K647	Q639-K643 VanDerWaalsContact O-CG 3.23Å; Q639-K643 WeakPolarHBondContact O-CG 3.48Å; Q639-K643 PolarHBondContact O-N 3.4Å; D640-K643 PolarHBondContact O-N 2.87Å; D640-K643 WeakPolarHBondContact OD1-CD 3.26Å; D640-K643 WeakPolarHBondContact OD1-CE 3.5Å; D640-K643 IonicContact OD1-NZ 2.77Å; D640-K643 PolarHBondContact OD1-NZ 2.87Å; K643-I646 PolarHBondContact O-N 3.01Å; K643-K647 WeakPolarHBondContact O-CB 3.5Å; K643-K647 PolarHBondContact O-N 3.48Å
644	S	77.4	Confident	73.9	Confident	66 Å²	66	97.6 Å²	97.6	46%	0.462	50%	0.503	S	S	.	.	H	α-helix	trans	-67.7	-37.7	179.1	72.3	0	0	0	0	112.9	D640 Q641 V642 K647 S648	D640-S644 WeakPolarHBondContact O-CB 3.41Å; D640-S644 PolarHBondContact O-N 3.49Å; D640-S644 PolarHBondContact O-OG 3.22Å; Q641-S644 PolarHBondContact O-N 3.35Å; Q641-S644 PolarHBondContact O-OG 3Å; V642-S644 VanDerWaalsContact C-N 3.3Å; V642-S644 PolarHBondContact O-N 2.93Å; S644-K647 PolarHBondContact O-N 2.72Å; S644-S648 PolarHBondContact O-N 3.46Å; S644-S648 PolarHBondContact O-OG 2.92Å
645	Q	78.8	Confident	72.3	Confident	119 Å²	119	100 Å²	100	56%	0.556	51%	0.514	S	S	*	.	H	α-helix	trans	-67.3	-39.6	172.5	-69.7	-178.1	-5.7	0	0	112.4	Q641 V642 K647 S648 T649	Q641-Q645 PolarHBondContact O-N 3.43Å; Q641-Q645 VanDerWaalsContact O-N 3.13Å; V642-Q645 PolarHBondContact O-N 2.93Å; Q645-K647 VanDerWaalsContact C-N 3.29Å; Q645-K647 PolarHBondContact O-N 3.03Å; Q645-S648 PolarHBondContact O-OG 3.19Å; Q645-S648 VanDerWaalsContact O-OG 3.12Å; Q645-T649 WeakPolarHBondContact O-CG2 3.44Å; Q645-T649 PolarHBondContact O-N 3.25Å; Q645-T649 VanDerWaalsContact O-N 3.11Å; Q645-T649 PolarHBondContact O-OG1 3.23Å
646	I	76.2	Confident	70.5	Confident	104 Å²	104	103.8 Å²	103.8	53%	0.533	53%	0.53	S	S	.	.	H	α-helix	trans	-64.6	-35.9	173.3	-67	166.9	0	0	0	110.9	V642 K643 T649 K650	V642-I646 HydrophobicContact CG1-CD1 3.75Å; V642-I646 HydrophobicContact CG1-CG1 4.49Å; V642-I646 WeakPolarHBondContact O-CG1 3.35Å; V642-I646 PolarHBondContact O-N 3.37Å; K643-I646 PolarHBondContact O-N 3.01Å; I646-T649 WeakPolarHBondContact CA-OG1 3.41Å; I646-T649 PolarHBondContact O-OG1 3.2Å; I646-T649 VanDerWaalsContact O-OG1 3.06Å; I646-K650 VanDerWaalsContact O-CB 3.3Å; I646-K650 WeakPolarHBondContact O-CB 3.31Å; I646-K650 PolarHBondContact O-N 3.39Å; I646-K650 VanDerWaalsContact O-N 3.17Å
647	K	73.9	Confident	68.7	Low	133 Å²	133	111 Å²	111	58%	0.578	56%	0.555	S	S	*	*	H	α-helix	trans	-71.9	-44.9	177.6	-169.7	175	176.6	-175.4	0	112.3	K643 S644 Q645 T649 K650 E651	K643-K647 WeakPolarHBondContact O-CB 3.5Å; K643-K647 PolarHBondContact O-N 3.48Å; S644-K647 PolarHBondContact O-N 2.72Å; Q645-K647 VanDerWaalsContact C-N 3.29Å; Q645-K647 PolarHBondContact O-N 3.03Å; K647-T649 PolarHBondContact O-N 3.06Å; K647-K650 PolarHBondContact O-N 3.37Å; K647-E651 WeakPolarHBondContact CE-OE1 3.32Å; K647-E651 PolarHBondContact O-N 2.9Å
648	S	67.9	Low	67	Low	58 Å²	58	117.5 Å²	117.5	41%	0.406	58%	0.582	S	S	.	*	H	α-helix	trans	-65.2	-40.1	179.7	64.8	0	0	0	0	112.3	S644 Q645 K650 E651 Q652	S644-S648 PolarHBondContact O-N 3.46Å; S644-S648 PolarHBondContact O-OG 2.92Å; Q645-S648 PolarHBondContact O-OG 3.19Å; Q645-S648 VanDerWaalsContact O-OG 3.12Å; S648-K650 PolarHBondContact O-N 2.8Å; S648-E651 PolarHBondContact O-N 3.04Å; S648-Q652 WeakPolarHBondContact O-CG 3.1Å; S648-Q652 PolarHBondContact O-N 2.85Å
649	T	68.5	Low	64.8	Low	82 Å²	82	122.6 Å²	122.6	50%	0.503	60%	0.604	S	S	.	*	H	α-helix	trans	-65.1	-35.6	173.1	50.1	0	0	0	0	112.6	Q645 I646 K647 Q652 S653	Q645-T649 WeakPolarHBondContact O-CG2 3.44Å; Q645-T649 PolarHBondContact O-N 3.25Å; Q645-T649 VanDerWaalsContact O-N 3.11Å; Q645-T649 PolarHBondContact O-OG1 3.23Å; I646-T649 WeakPolarHBondContact CA-OG1 3.41Å; I646-T649 PolarHBondContact O-OG1 3.2Å; I646-T649 VanDerWaalsContact O-OG1 3.06Å; K647-T649 PolarHBondContact O-N 3.06Å; T649-Q652 PolarHBondContact O-N 3.06Å; T649-S653 PolarHBondContact O-N 3.27Å; T649-S653 VanDerWaalsContact O-N 3.13Å; T649-S653 PolarHBondContact O-OG 3.46Å
650	K	67.7	Low	62.6	Low	153 Å²	153	126.7 Å²	126.7	67%	0.665	62%	0.62	S	S	*	*	H	α-helix	trans	-70.3	-30	173.4	-166.3	172	-176.7	176.4	0	113.6	I646 K647 S648 S653 S654	I646-K650 VanDerWaalsContact O-CB 3.3Å; I646-K650 WeakPolarHBondContact O-CB 3.31Å; I646-K650 PolarHBondContact O-N 3.39Å; I646-K650 VanDerWaalsContact O-N 3.17Å; K647-K650 PolarHBondContact O-N 3.37Å; S648-K650 PolarHBondContact O-N 2.8Å; K650-S653 PolarHBondContact O-OG 3.4Å; K650-S654 PolarHBondContact O-OG 2.56Å
651	E	56.1	Low	60.8	Low	93 Å²	93	131.8 Å²	131.8	44%	0.435	64%	0.641	S	S	.	*	H	α-helix	trans	-78.7	-25.9	172.5	-74.2	-171.5	-147.4	0	0	113.3	K647 S648 S654	K647-E651 WeakPolarHBondContact CE-OE1 3.32Å; K647-E651 PolarHBondContact O-N 2.9Å; S648-E651 PolarHBondContact O-N 3.04Å; E651-S654 PolarHBondContact O-OG 3.03Å
652	Q	56.5	Low	58.8	Low	149 Å²	149	132.7 Å²	132.7	70%	0.696	65%	0.654	S	S	*	*	H	α-helix	trans	-72.2	-43.1	171.5	-75	-179.1	-2.6	0	0	112	S648 T649 S654 K655	S648-Q652 WeakPolarHBondContact O-CG 3.1Å; S648-Q652 PolarHBondContact O-N 2.85Å; T649-Q652 PolarHBondContact O-N 3.06Å; Q652-S654 VanDerWaalsContact C-N 3.25Å; Q652-S654 PolarHBondContact O-N 2.75Å; Q652-K655 PolarHBondContact O-N 2.76Å
653	S	53.4	Low	56.6	Low	90 Å²	90	134 Å²	134	63%	0.629	67%	0.667	S	S	*	*	H	α-helix	trans	-67.6	-22.2	-178.4	62.9	0	0	0	0	114.2	T649 K650	T649-S653 PolarHBondContact O-N 3.27Å; T649-S653 VanDerWaalsContact O-N 3.13Å; T649-S653 PolarHBondContact O-OG 3.46Å; K650-S653 PolarHBondContact O-OG 3.4Å
654	S	52.2	Low	54.9	Low	89 Å²	89	136 Å²	136	62%	0.622	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87	-8.3	179.2	43.5	0	0	0	0	114.7	K650 E651 Q652	K650-S654 PolarHBondContact O-OG 2.56Å; E651-S654 PolarHBondContact O-OG 3.03Å; Q652-S654 VanDerWaalsContact C-N 3.25Å; Q652-S654 PolarHBondContact O-N 2.75Å
655	K	49.6	Very low	53.3	Low	154 Å²	154	137.1 Å²	137.1	67%	0.67	70%	0.695	S	S	*	*			trans	-101.8	46.9	-177.6	-74.6	173.7	-179.7	159.4	0	114.4	Q652 K657	Q652-K655 PolarHBondContact O-N 2.76Å; K655-K657 PolarHBondContact O-N 3.47Å
656	K	45.9	Very low	51.7	Low	199 Å²	199	141.4 Å²	141.4	87%	0.865	71%	0.712	S	S	*	*			trans	-68.6	110.4	164.2	-82.1	-171.3	175.3	-179.4	0	110.1	K658	K656-K658 PolarHBondContact O-N 3.38Å
657	K	44.3	Very low	50.2	Low	201 Å²	201	144.6 Å²	144.6	87%	0.874	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-60.1	124.3	-178.2	-65.5	177.2	178.7	176.9	0	111.6	K655	K655-K657 PolarHBondContact O-N 3.47Å
658	K	44.1	Very low	49	Very low	204 Å²	204	147.8 Å²	147.8	89%	0.887	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-74.8	125.9	150.7	-73.4	-173.7	176.9	-177.4	0	107.6	K656	K656-K658 PolarHBondContact O-N 3.38Å
659	Q	37.4	Very low	47.9	Very low	186 Å²	186	156.9 Å²	156.9	87%	0.869	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-75.6	144.2	166.5	-67.9	-176.7	-8.2	0	0	109.2
660	K	38.3	Very low	46.9	Very low	199 Å²	199	160.7 Å²	160.7	87%	0.865	80%	0.8	S	S	*	*			trans	-112.3	122	162.6	-87.7	-171.7	172.3	-174.8	0	107.1
661	E	42.2	Very low	45.8	Very low	194 Å²	194	161.1 Å²	161.1	91%	0.907	81%	0.807	S	S	*	*			trans	-71.7	146.1	163.6	-62.5	178.1	159.6	0	0	109.1
662	V	41.4	Very low	45.2	Very low	132 Å²	132	164.8 Å²	164.8	80%	0.8	83%	0.828	S	S	*	*			trans	-133	122.2	175.2	179.9	0	0	0	0	107.6
663	S	35.5	Very low	44.5	Very low	100 Å²	100	165.8 Å²	165.8	70%	0.699	84%	0.836	S	S	*	*			trans	-84	135.6	-172.9	43.5	0	0	0	0	112.6	S665	S663-S665 PolarHBondContact O-N 2.72Å
664	V	45.2	Very low	44	Very low	152 Å²	152	170.5 Å²	170.5	92%	0.921	85%	0.849	S	S	*	*	S	Bend	trans	-83.6	52.9	-173.3	-165.5	0	0	0	0	111.3
665	S	45.1	Very low	43.4	Very low	88 Å²	88	175.9 Å²	175.9	62%	0.615	86%	0.864	S	S	*	*			trans	-141.8	44.5	-170.7	57.5	0	0	0	0	115.2	S663	S663-S665 PolarHBondContact O-N 2.72Å
666	K	44.7	Very low	43	Very low	209 Å²	209	177.5 Å²	177.5	91%	0.909	88%	0.878	S	S	*	*			trans	-162.3	73	156.3	-103.2	144.8	-168.9	179.9	0	112.1
667	L	44.4	Very low	42.8	Very low	172 Å²	172	175.8 Å²	175.8	90%	0.901	88%	0.879	S	S	*	*			trans	-125.1	111.6	159.6	-92.9	160.4	0	0	0	108.1
668	K	49.6	Very low	42.6	Very low	199 Å²	199	173.8 Å²	173.8	87%	0.865	88%	0.879	S	S	*	*			trans	-138.4	149.3	157.9	-97	-170.2	166.3	-175.4	0	106.1
669	L	43.7	Very low	42.5	Very low	250 Å²	250	171 Å²	171	100%	1.309	88%	0.878	S	S	*	*			trans	-43	0	-165.4	-78.5	65.1	0	0	0	113.3

Retrieved 669 of 669 residues in 131.5 ms (Link to these results)

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