A0A077Z8M1_TRITR Loading...

Conserved oligomeric Golgi complex subunit 4

AlphaFold DB , UniProt , Accession A0A077Z8M1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 761 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	58.3	Low	66.2	Low	236 Å²	236	129.4 Å²	129.4	100%	1.163	67%	0.671	S	S	*	*				0	71.4	0	-75.1	-176.3	173.9	0	0	110.6
2	L	50.4	Low	67.4	Low	171 Å²	171	122.1 Å²	122.1	90%	0.895	64%	0.644	S	S	*	*			cis	-45.7	122	20.4	-76.1	96.9	0	0	0	113.5	Y4	L2-Y4 VanDerWaalsContact C-N 3.28Å; L2-Y4 PolarHBondContact O-N 2.97Å
3	S	52.4	Low	68.5	Low	114 Å²	114	121.2 Å²	121.2	80%	0.797	64%	0.639	S	S	*	*			trans	-81.8	77.2	170	52.7	0	0	0	0	107.7	D5	S3-D5 PolarHBondContact O-N 3.13Å
4	Y	55.3	Low	69.6	Low	173 Å²	173	117.7 Å²	117.7	68%	0.678	63%	0.625	S	S	*	*			trans	-75.6	120.4	164	-154.7	-96	0	0	0	106.3	L2 F6	L2-Y4 VanDerWaalsContact C-N 3.28Å; L2-Y4 PolarHBondContact O-N 2.97Å; Y4-F6 WeakPolarHBondContact O-CD2 3.33Å; Y4-F6 WeakPolarHBondContact O-CE2 3.45Å; Y4-F6 PolarHBondContact O-N 3.2Å
5	D	61.1	Low	70.6	Confident	118 Å²	118	119.7 Å²	119.7	63%	0.631	63%	0.629	S	S	*	*			trans	-79	101.3	-176.5	-168.4	-8.8	0	0	0	108.4	S3 T7	S3-D5 PolarHBondContact O-N 3.13Å; D5-T7 PolarHBondContact O-N 3.36Å; D5-T7 VanDerWaalsContact OD1-CB 3.26Å; D5-T7 WeakPolarHBondContact OD1-CB 3.22Å; D5-T7 PolarHBondContact OD1-N 3.47Å; D5-T7 PolarHBondContact OD1-OG1 3.4Å
6	F	66	Low	71.4	Confident	117 Å²	117	119.8 Å²	119.8	51%	0.513	63%	0.626	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75.4	4	-179.2	-68.4	-81.8	0	0	0	113.2	Y4 D8 E9 I10	Y4-F6 WeakPolarHBondContact O-CD2 3.33Å; Y4-F6 WeakPolarHBondContact O-CE2 3.45Å; Y4-F6 PolarHBondContact O-N 3.2Å; F6-D8 PolarHBondContact O-N 3.37Å; F6-E9 VanDerWaalsContact CD1-OE2 3.31Å; F6-E9 WeakPolarHBondContact CD1-OE2 2.94Å; F6-E9 PolarHBondContact O-N 2.67Å; F6-I10 HydrophobicContact CB-CD1 4.27Å; F6-I10 WeakPolarHBondContact O-CG1 3.15Å; F6-I10 PolarHBondContact O-N 3.02Å
7	T	74.6	Confident	72.3	Confident	87 Å²	87	119.7 Å²	119.7	53%	0.534	63%	0.625	S	S	.	*	H	α-helix	trans	-59.9	-37.1	-175.9	-51.4	0	0	0	0	111.5	D5 S11	D5-T7 PolarHBondContact O-N 3.36Å; D5-T7 VanDerWaalsContact OD1-CB 3.26Å; D5-T7 WeakPolarHBondContact OD1-CB 3.22Å; D5-T7 PolarHBondContact OD1-N 3.47Å; D5-T7 PolarHBondContact OD1-OG1 3.4Å; T7-S11 VanDerWaalsContact O-CB 3.26Å; T7-S11 WeakPolarHBondContact O-CB 3.42Å; T7-S11 PolarHBondContact O-N 2.73Å; T7-S11 PolarHBondContact O-OG 3.2Å
8	D	75.6	Confident	73.3	Confident	131 Å²	131	119.6 Å²	119.6	70%	0.701	62%	0.624	S	S	*	*	H	α-helix	trans	-67.5	-45.4	175.5	-77.5	-13.3	0	0	0	112.2	F6 I10 S11 A12	F6-D8 PolarHBondContact O-N 3.37Å; D8-I10 PolarHBondContact O-N 2.8Å; D8-S11 WeakPolarHBondContact CA-OG 3.32Å; D8-S11 PolarHBondContact O-N 3.08Å; D8-S11 PolarHBondContact O-OG 3.34Å; D8-A12 WeakPolarHBondContact O-CB 3.29Å; D8-A12 PolarHBondContact O-N 3.44Å
9	E	76	Confident	74	Confident	114 Å²	114	117.9 Å²	117.9	53%	0.533	62%	0.616	S	S	.	*	H	α-helix	trans	-65.8	-39.2	178.7	-87.5	-178.2	168.3	0	0	112.8	F6 L13	F6-E9 VanDerWaalsContact CD1-OE2 3.31Å; F6-E9 WeakPolarHBondContact CD1-OE2 2.94Å; F6-E9 PolarHBondContact O-N 2.67Å; E9-L13 WeakPolarHBondContact O-CB 3.48Å; E9-L13 WeakPolarHBondContact O-CG 3.4Å; E9-L13 PolarHBondContact O-N 2.87Å
10	I	79.5	Confident	74.7	Confident	105 Å²	105	117.6 Å²	117.6	54%	0.538	61%	0.613	S	S	.	*	H	α-helix	trans	-68.1	-41.9	176.6	-66.7	172.5	0	0	0	110	F6 D8 L13 T14	F6-I10 HydrophobicContact CB-CD1 4.27Å; F6-I10 WeakPolarHBondContact O-CG1 3.15Å; F6-I10 PolarHBondContact O-N 3.02Å; D8-I10 PolarHBondContact O-N 2.8Å; I10-L13 PolarHBondContact O-N 3.12Å; I10-T14 PolarHBondContact O-N 2.8Å; I10-T14 PolarHBondContact O-OG1 3.25Å
11	S	78.9	Confident	75.4	Confident	57 Å²	57	120 Å²	120	40%	0.399	62%	0.615	S	S	.	*	H	α-helix	trans	-63.1	-42.6	177.7	73.6	0	0	0	0	111.6	T7 D8 T14 E15	T7-S11 VanDerWaalsContact O-CB 3.26Å; T7-S11 WeakPolarHBondContact O-CB 3.42Å; T7-S11 PolarHBondContact O-N 2.73Å; T7-S11 PolarHBondContact O-OG 3.2Å; D8-S11 WeakPolarHBondContact CA-OG 3.32Å; D8-S11 PolarHBondContact O-N 3.08Å; D8-S11 PolarHBondContact O-OG 3.34Å; S11-T14 WeakPolarHBondContact CA-OG1 3.32Å; S11-T14 PolarHBondContact O-N 2.86Å; S11-T14 PolarHBondContact O-OG1 2.9Å; S11-E15 WeakPolarHBondContact O-CB 3.48Å; S11-E15 PolarHBondContact O-N 3.4Å
12	A	80.8	Confident	76.9	Confident	42 Å²	42	115.4 Å²	115.4	35%	0.347	58%	0.584	S	S	.	*	H	α-helix	trans	-63.1	-41.8	174.8	0	0	0	0	0	112.8	D8 E15 Q16	D8-A12 WeakPolarHBondContact O-CB 3.29Å; D8-A12 PolarHBondContact O-N 3.44Å; A12-E15 PolarHBondContact O-N 3.43Å; A12-Q16 WeakPolarHBondContact O-CG 3.31Å; A12-Q16 PolarHBondContact O-N 2.86Å
13	L	81.2	Confident	78.7	Confident	110 Å²	110	115 Å²	115	58%	0.576	57%	0.571	S	S	*	*	H	α-helix	trans	-65.9	-39.4	176.1	-81.2	165.1	0	0	0	112	E9 I10 E15 Q16 L17	E9-L13 WeakPolarHBondContact O-CB 3.48Å; E9-L13 WeakPolarHBondContact O-CG 3.4Å; E9-L13 PolarHBondContact O-N 2.87Å; I10-L13 PolarHBondContact O-N 3.12Å; L13-E15 VanDerWaalsContact C-N 3.35Å; L13-Q16 PolarHBondContact O-N 2.69Å; L13-L17 WeakPolarHBondContact O-CB 3.16Å; L13-L17 PolarHBondContact O-N 3.3Å
14	T	84.9	Confident	80.4	Confident	73 Å²	73	115.4 Å²	115.4	45%	0.448	56%	0.56	S	S	.	*	H	α-helix	trans	-67.1	-36.5	175.6	44.9	0	0	0	0	112.5	I10 S11 L17 I18	I10-T14 PolarHBondContact O-N 2.8Å; I10-T14 PolarHBondContact O-OG1 3.25Å; S11-T14 WeakPolarHBondContact CA-OG1 3.32Å; S11-T14 PolarHBondContact O-N 2.86Å; S11-T14 PolarHBondContact O-OG1 2.9Å; T14-L17 PolarHBondContact O-N 3.5Å; T14-I18 WeakPolarHBondContact O-CD1 3.41Å; T14-I18 VanDerWaalsContact O-CG1 3.25Å; T14-I18 WeakPolarHBondContact O-CG1 3.16Å; T14-I18 PolarHBondContact O-N 2.8Å
15	E	84.4	Confident	82.1	Confident	147 Å²	147	113 Å²	113	69%	0.687	56%	0.555	S	S	*	*	H	α-helix	trans	-68.1	-42.4	176.8	-156.3	171.2	-150.6	0	0	111.1	S11 A12 L13 L17 I18 D19	S11-E15 WeakPolarHBondContact O-CB 3.48Å; S11-E15 PolarHBondContact O-N 3.4Å; A12-E15 PolarHBondContact O-N 3.43Å; L13-E15 VanDerWaalsContact C-N 3.35Å; E15-L17 PolarHBondContact O-N 2.99Å; E15-I18 PolarHBondContact O-N 2.98Å; E15-D19 PolarHBondContact O-N 3.4Å
16	Q	84.1	Confident	83.5	Confident	122 Å²	122	111.4 Å²	111.4	57%	0.57	54%	0.544	S	S	*	.	H	α-helix	trans	-62	-39.6	172.6	-74.8	-179.7	9.9	0	0	112.8	A12 L13 D19 I20	A12-Q16 WeakPolarHBondContact O-CG 3.31Å; A12-Q16 PolarHBondContact O-N 2.86Å; L13-Q16 PolarHBondContact O-N 2.69Å; Q16-D19 PolarHBondContact O-N 3.33Å; Q16-I20 VanDerWaalsContact O-CG1 3.3Å; Q16-I20 WeakPolarHBondContact O-CG1 3.31Å; Q16-I20 PolarHBondContact O-N 2.96Å
17	L	86.3	Confident	84.6	Confident	118 Å²	118	110.1 Å²	110.1	62%	0.618	54%	0.542	S	S	*	.	H	α-helix	trans	-66.2	-38.9	178.8	-161.2	90.9	0	0	0	111.8	L13 T14 E15 D19 R21	L13-L17 WeakPolarHBondContact O-CB 3.16Å; L13-L17 PolarHBondContact O-N 3.3Å; T14-L17 PolarHBondContact O-N 3.5Å; E15-L17 PolarHBondContact O-N 2.99Å; L17-D19 VanDerWaalsContact C-N 3.33Å; L17-R21 PolarHBondContact O-N 2.87Å; L17-R21 VanDerWaalsContact O-N 3.12Å
18	I	89.1	Confident	85.4	Confident	118 Å²	118	111.8 Å²	111.8	61%	0.605	54%	0.544	S	S	*	.	H	α-helix	trans	-65.1	-40.8	175.1	-69.5	165	0	0	0	110.2	T14 E15 R21 R22	T14-I18 WeakPolarHBondContact O-CD1 3.41Å; T14-I18 VanDerWaalsContact O-CG1 3.25Å; T14-I18 WeakPolarHBondContact O-CG1 3.16Å; T14-I18 PolarHBondContact O-N 2.8Å; E15-I18 PolarHBondContact O-N 2.98Å; I18-R21 PolarHBondContact O-N 2.96Å; I18-R22 WeakPolarHBondContact O-CB 3.47Å; I18-R22 PolarHBondContact O-N 3.29Å
19	D	88.3	Confident	86.1	Confident	87 Å²	87	111.7 Å²	111.7	47%	0.465	54%	0.542	S	S	.	.	H	α-helix	trans	-67	-41.6	-179.4	-149.6	35.7	0	0	0	112.6	E15 Q16 L17 R22 R23	E15-D19 PolarHBondContact O-N 3.4Å; Q16-D19 PolarHBondContact O-N 3.33Å; L17-D19 VanDerWaalsContact C-N 3.33Å; D19-R22 PolarHBondContact O-N 2.86Å; D19-R22 IonicContact OD1-CZ 2.69Å; D19-R22 IonicContact OD1-NE 2.74Å; D19-R22 PolarHBondContact OD1-NE 2.97Å; D19-R22 IonicContact OD1-NH2 3.53Å; D19-R22 PolarHBondContact OD1-NH2 3Å; D19-R23 PolarHBondContact O-N 2.97Å; D19-R23 VanDerWaalsContact O-N 3.07Å
20	I	87.3	Confident	86.8	Confident	111 Å²	111	112.3 Å²	112.3	57%	0.569	55%	0.545	S	S	*	.	H	α-helix	trans	-63.3	-44.1	175.3	-69.8	167.9	0	0	0	111	Q16 R22 R23 E24	Q16-I20 VanDerWaalsContact O-CG1 3.3Å; Q16-I20 WeakPolarHBondContact O-CG1 3.31Å; Q16-I20 PolarHBondContact O-N 2.96Å; I20-R22 VanDerWaalsContact C-N 3.35Å; I20-R22 PolarHBondContact O-N 2.94Å; I20-R23 WeakPolarHBondContact O-CB 3.46Å; I20-R23 PolarHBondContact O-N 3.33Å; I20-E24 PolarHBondContact O-N 3.09Å
21	R	89.5	Confident	87.1	Confident	169 Å²	169	112 Å²	112	64%	0.638	54%	0.543	S	S	*	.	H	α-helix	trans	-61.8	-42	177.8	-110.2	-176.3	-176.2	-150.1	-0	112.8	L17 I18 R23 E24 E25	L17-R21 PolarHBondContact O-N 2.87Å; L17-R21 VanDerWaalsContact O-N 3.12Å; I18-R21 PolarHBondContact O-N 2.96Å; R21-R23 VanDerWaalsContact C-N 3.28Å; R21-R23 PolarHBondContact O-N 2.86Å; R21-E24 WeakPolarHBondContact O-CB 3.31Å; R21-E24 PolarHBondContact O-N 2.77Å; R21-E25 PolarHBondContact O-N 2.9Å
22	R	88.9	Confident	87.5	Confident	139 Å²	139	114 Å²	114	53%	0.525	55%	0.55	S	S	.	*	H	α-helix	trans	-61.8	-38.6	176.1	-176.3	174.5	64.4	119.4	-5.1	111.5	I18 D19 I20 E26	I18-R22 WeakPolarHBondContact O-CB 3.47Å; I18-R22 PolarHBondContact O-N 3.29Å; D19-R22 PolarHBondContact O-N 2.86Å; D19-R22 IonicContact OD1-CZ 2.69Å; D19-R22 IonicContact OD1-NE 2.74Å; D19-R22 PolarHBondContact OD1-NE 2.97Å; D19-R22 IonicContact OD1-NH2 3.53Å; D19-R22 PolarHBondContact OD1-NH2 3Å; I20-R22 VanDerWaalsContact C-N 3.35Å; I20-R22 PolarHBondContact O-N 2.94Å; R22-E26 PolarHBondContact O-N 2.72Å; R22-E26 VanDerWaalsContact O-N 3.09Å
23	R	88.5	Confident	87.8	Confident	162 Å²	162	115.1 Å²	115.1	61%	0.611	56%	0.555	S	S	*	*	H	α-helix	trans	-67.4	-36.7	176.1	-151.6	74.4	-179.5	146.3	-1.3	112.7	D19 I20 R21 E26 L27	D19-R23 PolarHBondContact O-N 2.97Å; D19-R23 VanDerWaalsContact O-N 3.07Å; I20-R23 WeakPolarHBondContact O-CB 3.46Å; I20-R23 PolarHBondContact O-N 3.33Å; R21-R23 VanDerWaalsContact C-N 3.28Å; R21-R23 PolarHBondContact O-N 2.86Å; R23-E26 IonicContact CZ-OE2 3.51Å; R23-E26 IonicContact NH1-OE2 2.88Å; R23-E26 PolarHBondContact NH1-OE2 3.11Å; R23-L27 WeakPolarHBondContact O-CB 3.37Å; R23-L27 PolarHBondContact O-N 3.39Å; R23-L27 VanDerWaalsContact O-N 3.08Å
24	E	89	Confident	87.9	Confident	124 Å²	124	114.7 Å²	114.7	58%	0.579	55%	0.553	S	S	*	*	H	α-helix	trans	-66	-44.3	176.9	-159.1	174.7	-163.2	0	0	111.3	I20 R21 L27 E28	I20-E24 PolarHBondContact O-N 3.09Å; R21-E24 WeakPolarHBondContact O-CB 3.31Å; R21-E24 PolarHBondContact O-N 2.77Å; E24-L27 PolarHBondContact O-N 2.98Å; E24-E28 PolarHBondContact O-N 3.5Å
25	E	90.5	Very high	87.9	Confident	122 Å²	122	115.1 Å²	115.1	57%	0.57	56%	0.555	S	S	*	*	H	α-helix	trans	-65.1	-38.6	175.4	-73.5	-179.1	174.9	0	0	112.8	R21 E28 L29	R21-E25 PolarHBondContact O-N 2.9Å; E25-E28 PolarHBondContact O-N 3.25Å; E25-L29 WeakPolarHBondContact O-CG 3.3Å; E25-L29 PolarHBondContact O-N 3.31Å; E25-L29 VanDerWaalsContact O-N 3.15Å
26	E	90.9	Very high	87.7	Confident	84 Å²	84	117.2 Å²	117.2	39%	0.393	56%	0.556	S	S	.	*	H	α-helix	trans	-61.9	-45.3	173.6	-81.3	178.9	169.2	0	0	111.8	R22 R23 L29 E30	R22-E26 PolarHBondContact O-N 2.72Å; R22-E26 VanDerWaalsContact O-N 3.09Å; R23-E26 IonicContact CZ-OE2 3.51Å; R23-E26 IonicContact NH1-OE2 2.88Å; R23-E26 PolarHBondContact NH1-OE2 3.11Å; E26-L29 PolarHBondContact O-N 3.47Å; E26-E30 PolarHBondContact O-N 3.33Å; E26-E30 VanDerWaalsContact O-N 3.08Å
27	L	88.1	Confident	87.5	Confident	91 Å²	91	116.6 Å²	116.6	48%	0.476	56%	0.557	S	S	.	*	H	α-helix	trans	-64.6	-40.5	178.3	-90.1	158.8	0	0	0	112.3	R23 E24 L29 E30 I31	R23-L27 WeakPolarHBondContact O-CB 3.37Å; R23-L27 PolarHBondContact O-N 3.39Å; R23-L27 VanDerWaalsContact O-N 3.08Å; E24-L27 PolarHBondContact O-N 2.98Å; L27-L29 VanDerWaalsContact C-N 3.33Å; L27-L29 PolarHBondContact O-N 3.24Å; L27-E30 PolarHBondContact O-N 2.8Å; L27-I31 WeakPolarHBondContact O-CB 3.43Å; L27-I31 VanDerWaalsContact O-CG1 3.27Å; L27-I31 WeakPolarHBondContact O-CG1 3.33Å; L27-I31 PolarHBondContact O-N 2.94Å
28	E	91.5	Very high	87.2	Confident	122 Å²	122	115 Å²	115	57%	0.57	56%	0.555	S	S	*	*	H	α-helix	trans	-62.3	-39.9	175.4	-91.4	-169.7	145.6	0	0	112.3	E24 E25 N32	E24-E28 PolarHBondContact O-N 3.5Å; E25-E28 PolarHBondContact O-N 3.25Å; E28-N32 WeakPolarHBondContact O-CB 3.23Å; E28-N32 VanDerWaalsContact O-CG 3.29Å; E28-N32 PolarHBondContact O-N 2.91Å; E28-N32 PolarHBondContact O-ND2 2.84Å
29	L	90.3	Very high	86.7	Confident	128 Å²	128	113.3 Å²	113.3	67%	0.67	55%	0.55	S	S	*	.	H	α-helix	trans	-65.9	-40.6	176.4	-73.8	171.9	0	0	0	112	E25 E26 L27 N32 S33	E25-L29 WeakPolarHBondContact O-CG 3.3Å; E25-L29 PolarHBondContact O-N 3.31Å; E25-L29 VanDerWaalsContact O-N 3.15Å; E26-L29 PolarHBondContact O-N 3.47Å; L27-L29 VanDerWaalsContact C-N 3.33Å; L27-L29 PolarHBondContact O-N 3.24Å; L29-N32 PolarHBondContact O-N 2.9Å; L29-S33 PolarHBondContact O-N 2.89Å
30	E	90.1	Very high	86.2	Confident	127 Å²	127	112.8 Å²	112.8	59%	0.593	55%	0.547	S	S	*	.	H	α-helix	trans	-67.5	-43.7	179.9	-149.3	172.9	-148.7	0	0	111.7	E26 L27 N32 S33 I34	E26-E30 PolarHBondContact O-N 3.33Å; E26-E30 VanDerWaalsContact O-N 3.08Å; L27-E30 PolarHBondContact O-N 2.8Å; E30-N32 PolarHBondContact O-N 3.29Å; E30-S33 WeakPolarHBondContact O-CB 3.36Å; E30-S33 PolarHBondContact O-N 3.43Å; E30-I34 WeakPolarHBondContact O-CG1 3.37Å; E30-I34 PolarHBondContact O-N 3.47Å; E30-I34 VanDerWaalsContact O-N 3.12Å
31	I	87.1	Confident	85.8	Confident	98 Å²	98	112.3 Å²	112.3	50%	0.503	55%	0.545	S	S	.	.	H	α-helix	trans	-61.1	-45.3	174.8	-69.5	168.3	0	0	0	110.8	L27 S33 I34 V35	L27-I31 WeakPolarHBondContact O-CB 3.43Å; L27-I31 VanDerWaalsContact O-CG1 3.27Å; L27-I31 WeakPolarHBondContact O-CG1 3.33Å; L27-I31 PolarHBondContact O-N 2.94Å; I31-S33 VanDerWaalsContact C-N 3.3Å; I31-S33 PolarHBondContact O-N 3Å; I31-I34 PolarHBondContact O-N 3.46Å; I31-V35 HydrophobicContact CG2-CG2 4.35Å; I31-V35 VanDerWaalsContact O-CG2 3.3Å; I31-V35 WeakPolarHBondContact O-CG2 3.43Å; I31-V35 PolarHBondContact O-N 3.35Å
32	N	87.8	Confident	85.2	Confident	101 Å²	101	107.9 Å²	107.9	54%	0.54	54%	0.538	S	S	.	.	H	α-helix	trans	-64.4	-33.5	179.4	-78.9	-47.2	0	0	0	112.7	E28 L29 E30 R36	E28-N32 WeakPolarHBondContact O-CB 3.23Å; E28-N32 VanDerWaalsContact O-CG 3.29Å; E28-N32 PolarHBondContact O-N 2.91Å; E28-N32 PolarHBondContact O-ND2 2.84Å; L29-N32 PolarHBondContact O-N 2.9Å; E30-N32 PolarHBondContact O-N 3.29Å; N32-R36 PolarHBondContact O-N 3.43Å
33	S	85.8	Confident	84.7	Confident	65 Å²	65	107.6 Å²	107.6	46%	0.455	54%	0.541	S	S	.	.	H	α-helix	trans	-64.8	-50.1	173.6	-169.7	0	0	0	0	111.7	L29 E30 I31 V35 R36 D37	L29-S33 PolarHBondContact O-N 2.89Å; E30-S33 WeakPolarHBondContact O-CB 3.36Å; E30-S33 PolarHBondContact O-N 3.43Å; I31-S33 VanDerWaalsContact C-N 3.3Å; I31-S33 PolarHBondContact O-N 3Å; S33-V35 VanDerWaalsContact C-N 3.33Å; S33-V35 PolarHBondContact O-N 2.92Å; S33-R36 WeakPolarHBondContact O-CB 3.33Å; S33-R36 PolarHBondContact O-N 3.34Å; S33-R36 VanDerWaalsContact O-N 3.13Å; S33-D37 PolarHBondContact O-N 3.43Å
34	I	84.5	Confident	84.3	Confident	101 Å²	101	105.8 Å²	105.8	52%	0.518	54%	0.539	S	S	.	.	H	α-helix	trans	-62.3	-41.8	-178.6	-65.9	168	0	0	0	111	E30 I31 R36 D37 C38	E30-I34 WeakPolarHBondContact O-CG1 3.37Å; E30-I34 PolarHBondContact O-N 3.47Å; E30-I34 VanDerWaalsContact O-N 3.12Å; I31-I34 PolarHBondContact O-N 3.46Å; I34-R36 VanDerWaalsContact C-N 3.29Å; I34-R36 PolarHBondContact O-N 2.89Å; I34-D37 PolarHBondContact O-N 2.93Å; I34-C38 WeakPolarHBondContact O-CB 3.41Å; I34-C38 PolarHBondContact O-N 3.16Å
35	V	84.5	Confident	83.9	Confident	82 Å²	82	104 Å²	104	50%	0.497	53%	0.533	S	S	.	.	H	α-helix	trans	-61.9	-39.4	176.8	171.2	0	0	0	0	111	I31 S33 C38 V39	I31-V35 HydrophobicContact CG2-CG2 4.35Å; I31-V35 VanDerWaalsContact O-CG2 3.3Å; I31-V35 WeakPolarHBondContact O-CG2 3.43Å; I31-V35 PolarHBondContact O-N 3.35Å; S33-V35 VanDerWaalsContact C-N 3.33Å; S33-V35 PolarHBondContact O-N 2.92Å; V35-C38 PolarHBondContact O-N 2.78Å; V35-V39 VanDerWaalsContact O-CG2 3.28Å; V35-V39 WeakPolarHBondContact O-CG2 3.43Å; V35-V39 PolarHBondContact O-N 3.31Å
36	R	80.5	Confident	83.6	Confident	191 Å²	191	103.5 Å²	103.5	72%	0.721	53%	0.534	S	S	*	.	H	α-helix	trans	-63.3	-47.2	175.9	-122.1	179.9	179.5	180	0.4	111.9	N32 S33 I34 C38 V39 D40	N32-R36 PolarHBondContact O-N 3.43Å; S33-R36 WeakPolarHBondContact O-CB 3.33Å; S33-R36 PolarHBondContact O-N 3.34Å; S33-R36 VanDerWaalsContact O-N 3.13Å; I34-R36 VanDerWaalsContact C-N 3.29Å; I34-R36 PolarHBondContact O-N 2.89Å; R36-C38 VanDerWaalsContact C-N 3.34Å; R36-C38 PolarHBondContact O-N 2.84Å; R36-V39 PolarHBondContact O-N 3.37Å; R36-V39 VanDerWaalsContact O-N 3.13Å; R36-D40 PolarHBondContact O-N 2.83Å
37	D	79.3	Confident	83.2	Confident	108 Å²	108	102.9 Å²	102.9	58%	0.578	54%	0.54	S	S	*	.	H	α-helix	trans	-63.7	-39.1	179.3	-71.5	-19.6	0	0	0	112	S33 I34 V39 D40 L41	S33-D37 PolarHBondContact O-N 3.43Å; I34-D37 PolarHBondContact O-N 2.93Å; D37-V39 VanDerWaalsContact C-N 3.27Å; D37-V39 PolarHBondContact O-N 2.9Å; D37-D40 PolarHBondContact O-N 2.85Å; D37-L41 WeakPolarHBondContact O-CB 3.29Å; D37-L41 PolarHBondContact O-N 3.18Å; D37-L41 VanDerWaalsContact O-N 3.08Å
38	C	79	Confident	83	Confident	86 Å²	86	101.2 Å²	101.2	58%	0.581	54%	0.535	S	S	*	.	H	α-helix	trans	-64.3	-27.3	174.9	-84.4	0	0	0	0	113.8	I34 V35 R36 P42	I34-C38 WeakPolarHBondContact O-CB 3.41Å; I34-C38 PolarHBondContact O-N 3.16Å; V35-C38 PolarHBondContact O-N 2.78Å; R36-C38 VanDerWaalsContact C-N 3.34Å; R36-C38 PolarHBondContact O-N 2.84Å; C38-P42 WeakPolarHBondContact O-CD 3.37Å
39	V	79.1	Confident	82.7	Confident	82 Å²	82	101.7 Å²	101.7	50%	0.497	54%	0.536	S	S	.	.	H	α-helix	trans	-80.3	-31.5	179.3	169.9	0	0	0	0	112	V35 R36 D37	V35-V39 VanDerWaalsContact O-CG2 3.28Å; V35-V39 WeakPolarHBondContact O-CG2 3.43Å; V35-V39 PolarHBondContact O-N 3.31Å; R36-V39 PolarHBondContact O-N 3.37Å; R36-V39 VanDerWaalsContact O-N 3.13Å; D37-V39 VanDerWaalsContact C-N 3.27Å; D37-V39 PolarHBondContact O-N 2.9Å
40	D	77.7	Confident	82.4	Confident	75 Å²	75	98.3 Å²	98.3	40%	0.401	52%	0.523	S	S	.	.	H	α-helix	trans	-91.7	-27.8	-176.7	-75	-27.5	0	0	0	113.8	R36 D37 K43 Q44	R36-D40 PolarHBondContact O-N 2.83Å; D37-D40 PolarHBondContact O-N 2.85Å; D40-K43 PolarHBondContact O-N 3.46Å; D40-K43 VanDerWaalsContact O-N 3.15Å; D40-K43 IonicContact OD1-NZ 3.52Å; D40-Q44 PolarHBondContact O-N 3.28Å; D40-Q44 VanDerWaalsContact O-N 3.13Å
41	L	78.7	Confident	82.2	Confident	101 Å²	101	99.4 Å²	99.4	53%	0.529	52%	0.522	S	S	.	.	H	α-helix	trans	-56	-44.8	179	-169.5	73.2	0	0	0	114.2	D37 K43 Q44 L45	D37-L41 WeakPolarHBondContact O-CB 3.29Å; D37-L41 PolarHBondContact O-N 3.18Å; D37-L41 VanDerWaalsContact O-N 3.08Å; L41-K43 VanDerWaalsContact C-N 3.3Å; L41-K43 PolarHBondContact O-N 2.93Å; L41-Q44 PolarHBondContact O-N 2.83Å; L41-L45 HydrophobicContact CG-CD1 4.04Å; L41-L45 PolarHBondContact O-N 3.38Å
42	P	77.5	Confident	82.2	Confident	77 Å²	77	99.3 Å²	99.3	50%	0.5	52%	0.522	S	S	.	.	H	α-helix	trans	-64	-35	178	-20	32.5	0	0	0	112.5	C38 N46	C38-P42 WeakPolarHBondContact O-CD 3.37Å; P42-N46 VanDerWaalsContact O-CB 3.23Å; P42-N46 WeakPolarHBondContact O-CB 3.33Å; P42-N46 PolarHBondContact O-N 2.79Å
43	K	78.9	Confident	82.2	Confident	132 Å²	132	100.2 Å²	100.2	57%	0.574	53%	0.526	S	S	*	.	H	α-helix	trans	-68.2	-42.1	179.2	-64.9	177.3	-171.3	159.4	0	111.3	D40 L41 S47	D40-K43 PolarHBondContact O-N 3.46Å; D40-K43 VanDerWaalsContact O-N 3.15Å; D40-K43 IonicContact OD1-NZ 3.52Å; L41-K43 VanDerWaalsContact C-N 3.3Å; L41-K43 PolarHBondContact O-N 2.93Å; K43-S47 PolarHBondContact O-N 3.49Å; K43-S47 VanDerWaalsContact O-N 3.09Å; K43-S47 PolarHBondContact O-OG 3.48Å
44	Q	79.9	Confident	82.3	Confident	124 Å²	124	101.2 Å²	101.2	58%	0.579	53%	0.529	S	S	*	.	H	α-helix	trans	-68.4	-40.3	177.2	-69.9	-174.6	-1.8	0	0	112.7	D40 L41 S47 S48	D40-Q44 PolarHBondContact O-N 3.28Å; D40-Q44 VanDerWaalsContact O-N 3.13Å; L41-Q44 PolarHBondContact O-N 2.83Å; Q44-S47 PolarHBondContact O-OG 2.83Å; Q44-S48 WeakPolarHBondContact O-CB 3.46Å; Q44-S48 PolarHBondContact O-N 3.31Å; Q44-S48 VanDerWaalsContact O-N 3.12Å; Q44-S48 PolarHBondContact O-OG 2.82Å
45	L	81.3	Confident	82.5	Confident	86 Å²	86	100.9 Å²	100.9	45%	0.45	53%	0.526	S	S	.	.	H	α-helix	trans	-63.5	-47.4	174.2	-82.6	161.2	0	0	0	110.7	L41 S47 S48 F49	L41-L45 HydrophobicContact CG-CD1 4.04Å; L41-L45 PolarHBondContact O-N 3.38Å; L45-S47 VanDerWaalsContact C-N 3.33Å; L45-S47 PolarHBondContact O-N 3.49Å; L45-S48 PolarHBondContact O-N 3.2Å; L45-F49 HydrophobicContact CB-CD2 4.38Å; L45-F49 HydrophobicContact CD2-CD2 4.31Å; L45-F49 HydrophobicContact CD2-CE2 3.85Å; L45-F49 WeakPolarHBondContact O-CB 3.41Å; L45-F49 VanDerWaalsContact O-CD2 3.25Å; L45-F49 WeakPolarHBondContact O-CD2 3.24Å; L45-F49 PolarHBondContact O-N 3.18Å
46	N	83.7	Confident	82.6	Confident	112 Å²	112	99.7 Å²	99.7	60%	0.599	52%	0.524	S	S	*	.	H	α-helix	trans	-64.4	-36.9	-177.3	-159.1	40	0	0	0	112.5	P42 S50	P42-N46 VanDerWaalsContact O-CB 3.23Å; P42-N46 WeakPolarHBondContact O-CB 3.33Å; P42-N46 PolarHBondContact O-N 2.79Å; N46-S50 WeakPolarHBondContact O-CB 3.31Å; N46-S50 PolarHBondContact O-N 3.39Å; N46-S50 PolarHBondContact O-OG 3.49Å
47	S	81.7	Confident	83	Confident	72 Å²	72	94 Å²	94	50%	0.503	51%	0.511	S	S	.	.	H	α-helix	trans	-68.7	-40.5	175.4	67.2	0	0	0	0	112.5	K43 Q44 L45 S50 R51	K43-S47 PolarHBondContact O-N 3.49Å; K43-S47 VanDerWaalsContact O-N 3.09Å; K43-S47 PolarHBondContact O-OG 3.48Å; Q44-S47 PolarHBondContact O-OG 2.83Å; L45-S47 VanDerWaalsContact C-N 3.33Å; L45-S47 PolarHBondContact O-N 3.49Å; S47-S50 PolarHBondContact O-N 3.47Å; S47-R51 WeakPolarHBondContact O-CB 3.42Å; S47-R51 PolarHBondContact O-N 2.87Å
48	S	84	Confident	83.6	Confident	55 Å²	55	93.9 Å²	93.9	39%	0.385	51%	0.51	S	S	.	.	H	α-helix	trans	-67.4	-44.3	177.7	-58.4	0	0	0	0	111.9	Q44 L45 R51 L52	Q44-S48 WeakPolarHBondContact O-CB 3.46Å; Q44-S48 PolarHBondContact O-N 3.31Å; Q44-S48 VanDerWaalsContact O-N 3.12Å; Q44-S48 PolarHBondContact O-OG 2.82Å; L45-S48 PolarHBondContact O-N 3.2Å; S48-R51 PolarHBondContact O-N 3.01Å; S48-L52 WeakPolarHBondContact O-CG 3.19Å; S48-L52 PolarHBondContact O-N 2.76Å
49	F	86	Confident	84	Confident	133 Å²	133	93.7 Å²	93.7	58%	0.583	51%	0.506	S	S	*	.	H	α-helix	trans	-64	-42.6	173.9	-86.9	-69.2	0	0	0	112	L45 R51 L52 L53	L45-F49 HydrophobicContact CB-CD2 4.38Å; L45-F49 HydrophobicContact CD2-CD2 4.31Å; L45-F49 HydrophobicContact CD2-CE2 3.85Å; L45-F49 WeakPolarHBondContact O-CB 3.41Å; L45-F49 VanDerWaalsContact O-CD2 3.25Å; L45-F49 WeakPolarHBondContact O-CD2 3.24Å; L45-F49 PolarHBondContact O-N 3.18Å; F49-R51 VanDerWaalsContact C-N 3.31Å; F49-R51 PolarHBondContact O-N 3.27Å; F49-L52 PolarHBondContact O-N 2.93Å; F49-L53 VanDerWaalsContact O-CB 3.23Å; F49-L53 WeakPolarHBondContact O-CB 3.39Å; F49-L53 PolarHBondContact O-N 2.83Å
50	S	84.1	Confident	84.7	Confident	56 Å²	56	96 Å²	96	39%	0.392	51%	0.511	S	S	.	.	H	α-helix	trans	-62.1	-39.8	176.3	-63	0	0	0	0	111.6	N46 S47 T54	N46-S50 WeakPolarHBondContact O-CB 3.31Å; N46-S50 PolarHBondContact O-N 3.39Å; N46-S50 PolarHBondContact O-OG 3.49Å; S47-S50 PolarHBondContact O-N 3.47Å; S50-T54 WeakPolarHBondContact O-CB 3.48Å; S50-T54 PolarHBondContact O-N 2.9Å; S50-T54 PolarHBondContact O-OG1 2.91Å
51	R	85	Confident	85.2	Confident	151 Å²	151	94.9 Å²	94.9	57%	0.57	51%	0.509	S	S	*	.	H	α-helix	trans	-65.1	-48.5	175.2	-174.4	-179.6	65.2	143.6	0.9	112	S47 S48 F49 L53 T54 E55	S47-R51 WeakPolarHBondContact O-CB 3.42Å; S47-R51 PolarHBondContact O-N 2.87Å; S48-R51 PolarHBondContact O-N 3.01Å; F49-R51 VanDerWaalsContact C-N 3.31Å; F49-R51 PolarHBondContact O-N 3.27Å; R51-L53 VanDerWaalsContact C-N 3.31Å; R51-L53 PolarHBondContact O-N 2.77Å; R51-T54 WeakPolarHBondContact O-CB 3.16Å; R51-T54 PolarHBondContact O-N 3.03Å; R51-T54 VanDerWaalsContact O-N 3.16Å; R51-E55 PolarHBondContact O-N 3.46Å
52	L	86.4	Confident	85.9	Confident	96 Å²	96	94.2 Å²	94.2	50%	0.503	51%	0.506	S	S	.	.	H	α-helix	trans	-62	-39.1	177.5	-78.2	170.2	0	0	0	112.1	S48 F49 T54 E55 A56	S48-L52 WeakPolarHBondContact O-CG 3.19Å; S48-L52 PolarHBondContact O-N 2.76Å; F49-L52 PolarHBondContact O-N 2.93Å; L52-T54 VanDerWaalsContact C-N 3.34Å; L52-E55 PolarHBondContact O-N 2.79Å; L52-A56 VanDerWaalsContact O-CB 3.23Å; L52-A56 WeakPolarHBondContact O-CB 3.42Å; L52-A56 PolarHBondContact O-N 3.26Å
53	L	88.6	Confident	86.5	Confident	120 Å²	120	93.9 Å²	93.9	63%	0.628	50%	0.503	S	S	*	.	H	α-helix	trans	-63.4	-43.6	174.8	-169.1	71.7	0	0	0	110.4	F49 R51 A56 T57	F49-L53 VanDerWaalsContact O-CB 3.23Å; F49-L53 WeakPolarHBondContact O-CB 3.39Å; F49-L53 PolarHBondContact O-N 2.83Å; R51-L53 VanDerWaalsContact C-N 3.31Å; R51-L53 PolarHBondContact O-N 2.77Å; L53-A56 PolarHBondContact O-N 3.36Å; L53-T57 VanDerWaalsContact O-CG2 3.3Å; L53-T57 WeakPolarHBondContact O-CG2 3.42Å; L53-T57 PolarHBondContact O-N 3.45Å; L53-T57 PolarHBondContact O-OG1 3.5Å; L53-T57 VanDerWaalsContact O-OG1 3.11Å
54	T	87.4	Confident	87.1	Confident	86 Å²	86	90.9 Å²	90.9	53%	0.528	50%	0.498	S	S	.	.	H	α-helix	trans	-63.6	-47.3	177.4	-50.9	0	0	0	0	111.1	S50 R51 L52 A56 T57 L58	S50-T54 WeakPolarHBondContact O-CB 3.48Å; S50-T54 PolarHBondContact O-N 2.9Å; S50-T54 PolarHBondContact O-OG1 2.91Å; R51-T54 WeakPolarHBondContact O-CB 3.16Å; R51-T54 PolarHBondContact O-N 3.03Å; R51-T54 VanDerWaalsContact O-N 3.16Å; L52-T54 VanDerWaalsContact C-N 3.34Å; T54-A56 PolarHBondContact O-N 3.23Å; T54-T57 WeakPolarHBondContact CA-OG1 3.2Å; T54-T57 PolarHBondContact O-N 2.86Å; T54-T57 PolarHBondContact O-OG1 2.84Å; T54-L58 WeakPolarHBondContact O-CB 3.33Å; T54-L58 PolarHBondContact O-N 3.22Å
55	E	89.6	Confident	87.6	Confident	94 Å²	94	90.9 Å²	90.9	44%	0.439	50%	0.498	S	S	.	.	H	α-helix	trans	-60.3	-45.1	175.6	-76.2	173.5	-176.1	0	0	111.3	R51 L52 T57 L58 T59	R51-E55 PolarHBondContact O-N 3.46Å; L52-E55 PolarHBondContact O-N 2.79Å; E55-T57 PolarHBondContact O-N 3.37Å; E55-L58 PolarHBondContact O-N 2.87Å; E55-T59 WeakPolarHBondContact O-CB 3.23Å; E55-T59 PolarHBondContact O-N 3.02Å; E55-T59 PolarHBondContact O-OG1 2.82Å
56	A	86.4	Confident	88.1	Confident	56 Å²	56	92.5 Å²	92.5	46%	0.463	51%	0.507	S	S	.	.	H	α-helix	trans	-60.8	-45.2	176.9	0	0	0	0	0	111.9	L52 L53 T54 L58 T59 E60	L52-A56 VanDerWaalsContact O-CB 3.23Å; L52-A56 WeakPolarHBondContact O-CB 3.42Å; L52-A56 PolarHBondContact O-N 3.26Å; L53-A56 PolarHBondContact O-N 3.36Å; T54-A56 PolarHBondContact O-N 3.23Å; A56-L58 VanDerWaalsContact C-N 3.34Å; A56-L58 PolarHBondContact O-N 2.81Å; A56-T59 PolarHBondContact O-N 3.38Å; A56-E60 WeakPolarHBondContact O-CB 3.27Å; A56-E60 PolarHBondContact O-N 2.88Å
57	T	88.7	Confident	88.5	Confident	72 Å²	72	92.4 Å²	92.4	44%	0.442	51%	0.505	S	S	.	.	H	α-helix	trans	-65.7	-35.5	176.7	55.5	0	0	0	0	112.7	L53 T54 E55 S61	L53-T57 VanDerWaalsContact O-CG2 3.3Å; L53-T57 WeakPolarHBondContact O-CG2 3.42Å; L53-T57 PolarHBondContact O-N 3.45Å; L53-T57 PolarHBondContact O-OG1 3.5Å; L53-T57 VanDerWaalsContact O-OG1 3.11Å; T54-T57 WeakPolarHBondContact CA-OG1 3.2Å; T54-T57 PolarHBondContact O-N 2.86Å; T54-T57 PolarHBondContact O-OG1 2.84Å; E55-T57 PolarHBondContact O-N 3.37Å; T57-S61 WeakPolarHBondContact O-CB 3.24Å; T57-S61 PolarHBondContact O-N 2.89Å
58	L	90.9	Very high	89	Confident	106 Å²	106	91.8 Å²	91.8	56%	0.555	50%	0.501	S	S	*	.	H	α-helix	trans	-66.2	-45.8	175.5	-157.5	91.1	0	0	0	110.2	T54 E55 A56 E60 S61 D62	T54-L58 WeakPolarHBondContact O-CB 3.33Å; T54-L58 PolarHBondContact O-N 3.22Å; E55-L58 PolarHBondContact O-N 2.87Å; A56-L58 VanDerWaalsContact C-N 3.34Å; A56-L58 PolarHBondContact O-N 2.81Å; L58-E60 VanDerWaalsContact C-N 3.35Å; L58-E60 PolarHBondContact O-N 3.5Å; L58-S61 WeakPolarHBondContact O-CB 3.38Å; L58-S61 PolarHBondContact O-N 3.29Å; L58-D62 WeakPolarHBondContact O-CB 3.24Å; L58-D62 VanDerWaalsContact O-CG 3.31Å; L58-D62 PolarHBondContact O-N 3.34Å
59	T	88.6	Confident	89.3	Confident	81 Å²	81	92.3 Å²	92.3	50%	0.497	51%	0.505	S	S	.	.	H	α-helix	trans	-65.7	-38.9	179.5	-35.6	0	0	0	0	111.4	E55 A56 D62 T63	E55-T59 WeakPolarHBondContact O-CB 3.23Å; E55-T59 PolarHBondContact O-N 3.02Å; E55-T59 PolarHBondContact O-OG1 2.82Å; A56-T59 PolarHBondContact O-N 3.38Å; T59-D62 PolarHBondContact O-N 3.23Å; T59-T63 VanDerWaalsContact O-CB 3.3Å; T59-T63 WeakPolarHBondContact O-CB 3.48Å; T59-T63 PolarHBondContact O-N 2.89Å; T59-T63 PolarHBondContact O-OG1 3.14Å
60	E	92.5	Very high	89.7	Confident	131 Å²	131	90.4 Å²	90.4	61%	0.612	50%	0.504	S	S	*	.	H	α-helix	trans	-61.9	-45.2	173.5	-174.5	-171.3	179.3	0	0	111.3	A56 L58 S64	A56-E60 WeakPolarHBondContact O-CB 3.27Å; A56-E60 PolarHBondContact O-N 2.88Å; L58-E60 VanDerWaalsContact C-N 3.35Å; L58-E60 PolarHBondContact O-N 3.5Å; E60-S64 WeakPolarHBondContact O-CB 3.47Å; E60-S64 PolarHBondContact O-N 3.38Å; E60-S64 PolarHBondContact O-OG 3.27Å
61	S	89.3	Confident	90.1	Very high	52 Å²	52	92.6 Å²	92.6	36%	0.364	51%	0.511	S	S	.	.	H	α-helix	trans	-60.4	-49.7	174.8	169.6	0	0	0	0	111.5	T57 L58 T63 S64 Q65	T57-S61 WeakPolarHBondContact O-CB 3.24Å; T57-S61 PolarHBondContact O-N 2.89Å; L58-S61 WeakPolarHBondContact O-CB 3.38Å; L58-S61 PolarHBondContact O-N 3.29Å; S61-T63 PolarHBondContact O-N 2.95Å; S61-S64 PolarHBondContact O-N 3.45Å; S61-Q65 WeakPolarHBondContact O-CG 3.28Å; S61-Q65 PolarHBondContact O-N 2.81Å
62	D	92.5	Very high	90.4	Very high	86 Å²	86	89.7 Å²	89.7	46%	0.46	51%	0.506	S	S	.	.	H	α-helix	trans	-64.3	-41	-178.9	-71.5	-8.5	0	0	0	111.6	L58 T59 S64 Q65 L66	L58-D62 WeakPolarHBondContact O-CB 3.24Å; L58-D62 VanDerWaalsContact O-CG 3.31Å; L58-D62 PolarHBondContact O-N 3.34Å; T59-D62 PolarHBondContact O-N 3.23Å; D62-S64 VanDerWaalsContact C-N 3.34Å; D62-S64 PolarHBondContact O-N 3.06Å; D62-Q65 PolarHBondContact O-N 3.41Å; D62-L66 WeakPolarHBondContact O-CB 3.28Å; D62-L66 PolarHBondContact O-N 3.44Å
63	T	91.7	Very high	90.5	Very high	71 Å²	71	88.3 Å²	88.3	44%	0.436	50%	0.504	S	S	.	.	H	α-helix	trans	-65.4	-40.3	176.7	-51	0	0	0	0	110.9	T59 S61 L66 I67	T59-T63 VanDerWaalsContact O-CB 3.3Å; T59-T63 WeakPolarHBondContact O-CB 3.48Å; T59-T63 PolarHBondContact O-N 2.89Å; T59-T63 PolarHBondContact O-OG1 3.14Å; S61-T63 PolarHBondContact O-N 2.95Å; T63-L66 PolarHBondContact O-N 2.84Å; T63-I67 HydrophobicContact CG2-CD1 4.1Å; T63-I67 VanDerWaalsContact O-CG1 3.29Å; T63-I67 WeakPolarHBondContact O-CG1 3.48Å; T63-I67 PolarHBondContact O-N 2.92Å
64	S	90.4	Very high	90.6	Very high	68 Å²	68	86 Å²	86	48%	0.476	50%	0.498	S	S	.	.	H	α-helix	trans	-64.2	-40.9	175.6	-61.4	0	0	0	0	111.9	E60 S61 D62 S68	E60-S64 WeakPolarHBondContact O-CB 3.47Å; E60-S64 PolarHBondContact O-N 3.38Å; E60-S64 PolarHBondContact O-OG 3.27Å; S61-S64 PolarHBondContact O-N 3.45Å; D62-S64 VanDerWaalsContact C-N 3.34Å; D62-S64 PolarHBondContact O-N 3.06Å; S64-S68 WeakPolarHBondContact O-CB 3.49Å; S64-S68 PolarHBondContact O-N 3.13Å
65	Q	90.8	Very high	90.8	Very high	124 Å²	124	86.4 Å²	86.4	58%	0.579	50%	0.5	S	S	*	.	H	α-helix	trans	-65.4	-40.1	173.6	-72.2	-175.9	25.1	0	0	112.1	S61 D62 S68 S69	S61-Q65 WeakPolarHBondContact O-CG 3.28Å; S61-Q65 PolarHBondContact O-N 2.81Å; D62-Q65 PolarHBondContact O-N 3.41Å; Q65-S68 WeakPolarHBondContact O-CB 3.44Å; Q65-S68 PolarHBondContact O-N 3.33Å; Q65-S69 WeakPolarHBondContact O-CB 3.2Å; Q65-S69 PolarHBondContact O-N 3.04Å
66	L	90.9	Very high	90.8	Very high	120 Å²	120	86.4 Å²	86.4	63%	0.628	50%	0.502	S	S	*	.	H	α-helix	trans	-65.7	-44.8	178.2	-157.5	93	0	0	0	111.4	D62 T63 S68 S69 V70	D62-L66 WeakPolarHBondContact O-CB 3.28Å; D62-L66 PolarHBondContact O-N 3.44Å; T63-L66 PolarHBondContact O-N 2.84Å; L66-S68 VanDerWaalsContact C-N 3.31Å; L66-S68 PolarHBondContact O-N 3.36Å; L66-S69 PolarHBondContact O-N 3.41Å; L66-S69 VanDerWaalsContact O-N 3.16Å; L66-V70 WeakPolarHBondContact O-CG2 3.23Å; L66-V70 PolarHBondContact O-N 3.25Å
67	I	94	Very high	91	Very high	110 Å²	110	86.1 Å²	86.1	56%	0.564	50%	0.5	S	S	*	.	H	α-helix	trans	-58.6	-46.8	174.5	-71	167.4	0	0	0	109.8	T63 S69 V70 D71	T63-I67 HydrophobicContact CG2-CD1 4.1Å; T63-I67 VanDerWaalsContact O-CG1 3.29Å; T63-I67 WeakPolarHBondContact O-CG1 3.48Å; T63-I67 PolarHBondContact O-N 2.92Å; I67-S69 VanDerWaalsContact C-N 3.34Å; I67-S69 PolarHBondContact O-N 3.29Å; I67-V70 PolarHBondContact O-N 3.29Å; I67-D71 WeakPolarHBondContact O-CB 3.31Å; I67-D71 PolarHBondContact O-N 2.82Å
68	S	91.7	Very high	91	Very high	59 Å²	59	87.7 Å²	87.7	41%	0.413	51%	0.506	S	S	.	.	H	α-helix	trans	-57.1	-45.3	174.3	162.2	0	0	0	0	112.2	S64 Q65 L66 D71 I72	S64-S68 WeakPolarHBondContact O-CB 3.49Å; S64-S68 PolarHBondContact O-N 3.13Å; Q65-S68 WeakPolarHBondContact O-CB 3.44Å; Q65-S68 PolarHBondContact O-N 3.33Å; L66-S68 VanDerWaalsContact C-N 3.31Å; L66-S68 PolarHBondContact O-N 3.36Å; S68-D71 PolarHBondContact O-N 3.19Å; S68-I72 WeakPolarHBondContact O-CB 3.43Å; S68-I72 WeakPolarHBondContact O-CD1 3.24Å; S68-I72 WeakPolarHBondContact O-CG1 3.46Å; S68-I72 PolarHBondContact O-N 3.12Å
69	S	90.7	Very high	91.1	Very high	67 Å²	67	84.7 Å²	84.7	47%	0.469	50%	0.5	S	S	.	.	H	α-helix	trans	-68	-37.3	-179.4	-172.8	0	0	0	0	112.8	Q65 L66 I67 S73	Q65-S69 WeakPolarHBondContact O-CB 3.2Å; Q65-S69 PolarHBondContact O-N 3.04Å; L66-S69 PolarHBondContact O-N 3.41Å; L66-S69 VanDerWaalsContact O-N 3.16Å; I67-S69 VanDerWaalsContact C-N 3.34Å; I67-S69 PolarHBondContact O-N 3.29Å; S69-S73 VanDerWaalsContact O-CB 3.24Å; S69-S73 WeakPolarHBondContact O-CB 3.5Å; S69-S73 PolarHBondContact O-N 2.84Å; S69-S73 PolarHBondContact O-OG 2.8Å
70	V	92.6	Very high	91.1	Very high	93 Å²	93	85.6 Å²	85.6	56%	0.564	50%	0.501	S	S	*	.	H	α-helix	trans	-69	-42	176.2	170.1	0	0	0	0	110.3	L66 I67 S73 S74	L66-V70 WeakPolarHBondContact O-CG2 3.23Å; L66-V70 PolarHBondContact O-N 3.25Å; I67-V70 PolarHBondContact O-N 3.29Å; V70-S73 PolarHBondContact O-N 2.91Å; V70-S74 VanDerWaalsContact O-CB 3.31Å; V70-S74 WeakPolarHBondContact O-CB 3.27Å; V70-S74 PolarHBondContact O-N 3.33Å
71	D	92.7	Very high	90.9	Very high	101 Å²	101	81.8 Å²	81.8	54%	0.54	49%	0.489	S	S	.	.	H	α-helix	trans	-63.8	-47.4	176.8	-168.9	52.8	0	0	0	111.3	I67 S68 S73 S74 V75	I67-D71 WeakPolarHBondContact O-CB 3.31Å; I67-D71 PolarHBondContact O-N 2.82Å; S68-D71 PolarHBondContact O-N 3.19Å; D71-S73 VanDerWaalsContact C-N 3.31Å; D71-S73 PolarHBondContact O-N 3.34Å; D71-S74 WeakPolarHBondContact O-CB 3.35Å; D71-S74 PolarHBondContact O-N 3Å; D71-V75 VanDerWaalsContact O-CG2 3.32Å; D71-V75 WeakPolarHBondContact O-CG2 3.16Å; D71-V75 PolarHBondContact O-N 3.26Å
72	I	91.3	Very high	90.8	Very high	90 Å²	90	82 Å²	82	46%	0.462	49%	0.49	S	S	.	.	H	α-helix	trans	-58.8	-44.6	174.2	-68.9	164.6	0	0	0	110.6	S68 V75 I76	S68-I72 WeakPolarHBondContact O-CB 3.43Å; S68-I72 WeakPolarHBondContact O-CD1 3.24Å; S68-I72 WeakPolarHBondContact O-CG1 3.46Å; S68-I72 PolarHBondContact O-N 3.12Å; I72-V75 PolarHBondContact O-N 3.39Å; I72-I76 HydrophobicContact CG2-CD1 3.63Å; I72-I76 HydrophobicContact CG2-CG1 4.38Å; I72-I76 WeakPolarHBondContact O-CB 3.23Å; I72-I76 WeakPolarHBondContact O-CG1 3.42Å; I72-I76 PolarHBondContact O-N 3.01Å
73	S	89.9	Confident	90.7	Very high	68 Å²	68	85.5 Å²	85.5	48%	0.476	50%	0.501	S	S	.	.	H	α-helix	trans	-66.1	-37.2	178.3	-68.6	0	0	0	0	112.3	S69 V70 D71 A77	S69-S73 VanDerWaalsContact O-CB 3.24Å; S69-S73 WeakPolarHBondContact O-CB 3.5Å; S69-S73 PolarHBondContact O-N 2.84Å; S69-S73 PolarHBondContact O-OG 2.8Å; V70-S73 PolarHBondContact O-N 2.91Å; D71-S73 VanDerWaalsContact C-N 3.31Å; D71-S73 PolarHBondContact O-N 3.34Å; S73-A77 WeakPolarHBondContact O-CB 3.45Å; S73-A77 PolarHBondContact O-N 3.16Å
74	S	91.1	Very high	90.7	Very high	71 Å²	71	85.1 Å²	85.1	50%	0.497	50%	0.499	S	S	.	.	H	α-helix	trans	-65.1	-48	174.8	-176	0	0	0	0	111.1	V70 D71 I76 A77 D78	V70-S74 VanDerWaalsContact O-CB 3.31Å; V70-S74 WeakPolarHBondContact O-CB 3.27Å; V70-S74 PolarHBondContact O-N 3.33Å; D71-S74 WeakPolarHBondContact O-CB 3.35Å; D71-S74 PolarHBondContact O-N 3Å; S74-I76 VanDerWaalsContact C-N 3.34Å; S74-I76 PolarHBondContact O-N 2.69Å; S74-A77 PolarHBondContact O-N 3.4Å; S74-D78 WeakPolarHBondContact O-CB 3.27Å; S74-D78 PolarHBondContact O-N 2.82Å
75	V	91.2	Very high	90.5	Very high	94 Å²	94	89.8 Å²	89.8	57%	0.57	51%	0.506	S	S	*	.	H	α-helix	trans	-61.7	-42.6	177.1	171.5	0	0	0	0	111.2	D71 I72 G79	D71-V75 VanDerWaalsContact O-CG2 3.32Å; D71-V75 WeakPolarHBondContact O-CG2 3.16Å; D71-V75 PolarHBondContact O-N 3.26Å; I72-V75 PolarHBondContact O-N 3.39Å; V75-G79 PolarHBondContact O-N 3.44Å
76	I	88.8	Confident	90.6	Very high	94 Å²	94	88.7 Å²	88.7	48%	0.482	50%	0.504	S	S	.	.	H	α-helix	trans	-66	-45.2	176.1	-69	169.1	0	0	0	110.7	I72 S74 G79 I80	I72-I76 HydrophobicContact CG2-CD1 3.63Å; I72-I76 HydrophobicContact CG2-CG1 4.38Å; I72-I76 WeakPolarHBondContact O-CB 3.23Å; I72-I76 WeakPolarHBondContact O-CG1 3.42Å; I72-I76 PolarHBondContact O-N 3.01Å; S74-I76 VanDerWaalsContact C-N 3.34Å; S74-I76 PolarHBondContact O-N 2.69Å; I76-G79 PolarHBondContact O-N 2.88Å; I76-I80 HydrophobicContact CG2-CD1 3.63Å; I76-I80 HydrophobicContact CG2-CG1 4.3Å; I76-I80 WeakPolarHBondContact O-CB 3.3Å; I76-I80 VanDerWaalsContact O-CG1 3.23Å; I76-I80 WeakPolarHBondContact O-CG1 3.43Å; I76-I80 PolarHBondContact O-N 3.19Å
77	A	90.1	Very high	90.5	Very high	50 Å²	50	88.4 Å²	88.4	41%	0.413	50%	0.501	S	S	.	.	H	α-helix	trans	-65.2	-39.4	180	0	0	0	0	0	112.5	S73 S74 I80 S81	S73-A77 WeakPolarHBondContact O-CB 3.45Å; S73-A77 PolarHBondContact O-N 3.16Å; S74-A77 PolarHBondContact O-N 3.4Å; A77-I80 PolarHBondContact O-N 3.32Å; A77-S81 VanDerWaalsContact O-CB 3.24Å; A77-S81 WeakPolarHBondContact O-CB 3.48Å; A77-S81 PolarHBondContact O-N 3.25Å; A77-S81 PolarHBondContact O-OG 3.22Å
78	D	90.3	Very high	90.3	Very high	106 Å²	106	86.7 Å²	86.7	57%	0.567	49%	0.493	S	S	*	.	H	α-helix	trans	-70	-40.5	176.4	-159.7	43.5	0	0	0	110.9	S74 I80 S81 S82	S74-D78 WeakPolarHBondContact O-CB 3.27Å; S74-D78 PolarHBondContact O-N 2.82Å; D78-I80 PolarHBondContact O-N 2.9Å; D78-S81 PolarHBondContact O-N 3.21Å; D78-S82 WeakPolarHBondContact O-CB 3.26Å; D78-S82 PolarHBondContact O-N 3.44Å
79	G	91.6	Very high	90.4	Very high	42 Å²	42	87.1 Å²	87.1	43%	0.433	49%	0.493	S	S	.	.	H	α-helix	trans	-61.5	-43.3	172.3	0	0	0	0	0	113.1	V75 I76 K83	V75-G79 PolarHBondContact O-N 3.44Å; I76-G79 PolarHBondContact O-N 2.88Å; G79-K83 VanDerWaalsContact O-CB 3.27Å; G79-K83 WeakPolarHBondContact O-CB 3.23Å; G79-K83 PolarHBondContact O-N 3.41Å
80	I	88.6	Confident	90.4	Very high	100 Å²	100	86.3 Å²	86.3	51%	0.513	49%	0.49	S	S	.	.	H	α-helix	trans	-66.2	-45.5	174.7	-69.3	168.9	0	0	0	110.1	I76 A77 D78 S82 K83 V84	I76-I80 HydrophobicContact CG2-CD1 3.63Å; I76-I80 HydrophobicContact CG2-CG1 4.3Å; I76-I80 WeakPolarHBondContact O-CB 3.3Å; I76-I80 VanDerWaalsContact O-CG1 3.23Å; I76-I80 WeakPolarHBondContact O-CG1 3.43Å; I76-I80 PolarHBondContact O-N 3.19Å; A77-I80 PolarHBondContact O-N 3.32Å; D78-I80 PolarHBondContact O-N 2.9Å; I80-S82 PolarHBondContact O-N 3.37Å; I80-K83 PolarHBondContact O-N 2.7Å; I80-V84 HydrophobicContact CG2-CG2 4.11Å; I80-V84 WeakPolarHBondContact O-CB 3.45Å; I80-V84 VanDerWaalsContact O-CG2 3.24Å; I80-V84 WeakPolarHBondContact O-CG2 3.38Å; I80-V84 PolarHBondContact O-N 3.03Å
81	S	87.9	Confident	90.3	Very high	52 Å²	52	87.9 Å²	87.9	36%	0.364	49%	0.49	S	S	.	.	H	α-helix	trans	-63.3	-42.4	-179.2	-63.4	0	0	0	0	112.1	A77 D78 V84 R85	A77-S81 VanDerWaalsContact O-CB 3.24Å; A77-S81 WeakPolarHBondContact O-CB 3.48Å; A77-S81 PolarHBondContact O-N 3.25Å; A77-S81 PolarHBondContact O-OG 3.22Å; D78-S81 PolarHBondContact O-N 3.21Å; S81-V84 PolarHBondContact O-N 3.25Å; S81-R85 WeakPolarHBondContact O-CB 3.44Å; S81-R85 VanDerWaalsContact O-CG 3.28Å; S81-R85 WeakPolarHBondContact O-CG 3.36Å; S81-R85 PolarHBondContact O-N 3.38Å
82	S	88.4	Confident	90.2	Very high	56 Å²	56	86.6 Å²	86.6	39%	0.392	49%	0.485	S	S	.	.	H	α-helix	trans	-61.3	-47.6	172.7	-171.2	0	0	0	0	110.8	D78 I80 V84 R85 D86	D78-S82 WeakPolarHBondContact O-CB 3.26Å; D78-S82 PolarHBondContact O-N 3.44Å; I80-S82 PolarHBondContact O-N 3.37Å; S82-V84 VanDerWaalsContact C-N 3.32Å; S82-V84 PolarHBondContact O-N 2.78Å; S82-R85 WeakPolarHBondContact O-CB 3.42Å; S82-R85 PolarHBondContact O-N 3.16Å; S82-D86 WeakPolarHBondContact O-CB 3.49Å; S82-D86 VanDerWaalsContact O-CG 3.23Å; S82-D86 PolarHBondContact O-N 3.46Å
83	K	89.6	Confident	90.1	Very high	159 Å²	159	90.4 Å²	90.4	69%	0.691	49%	0.494	S	S	*	.	H	α-helix	trans	-65.4	-34.8	-179.4	-166.4	169.8	-174.4	176.3	0	112.8	G79 I80 M87	G79-K83 VanDerWaalsContact O-CB 3.27Å; G79-K83 WeakPolarHBondContact O-CB 3.23Å; G79-K83 PolarHBondContact O-N 3.41Å; I80-K83 PolarHBondContact O-N 2.7Å; K83-M87 WeakPolarHBondContact O-CB 3.35Å; K83-M87 PolarHBondContact O-N 3.34Å
84	V	91.1	Very high	90.1	Very high	63 Å²	63	91.1 Å²	91.1	38%	0.382	50%	0.495	S	S	.	.	H	α-helix	trans	-67.9	-44.2	173.2	170.5	0	0	0	0	110.3	I80 S81 S82 D86 M87 D88	I80-V84 HydrophobicContact CG2-CG2 4.11Å; I80-V84 WeakPolarHBondContact O-CB 3.45Å; I80-V84 VanDerWaalsContact O-CG2 3.24Å; I80-V84 WeakPolarHBondContact O-CG2 3.38Å; I80-V84 PolarHBondContact O-N 3.03Å; S81-V84 PolarHBondContact O-N 3.25Å; S82-V84 VanDerWaalsContact C-N 3.32Å; S82-V84 PolarHBondContact O-N 2.78Å; V84-D86 PolarHBondContact O-N 3.13Å; V84-M87 WeakPolarHBondContact O-CB 3.41Å; V84-M87 PolarHBondContact O-N 2.9Å; V84-D88 WeakPolarHBondContact O-CB 3.36Å; V84-D88 PolarHBondContact O-N 3.42Å
85	R	88.1	Confident	90.1	Very high	166 Å²	166	92.3 Å²	92.3	63%	0.626	50%	0.495	S	S	*	.	H	α-helix	trans	-60.3	-45.7	174.2	-74.1	172.2	-175.7	159.8	3.6	111.9	S81 S82 M87 D88 V89	S81-R85 WeakPolarHBondContact O-CB 3.44Å; S81-R85 VanDerWaalsContact O-CG 3.28Å; S81-R85 WeakPolarHBondContact O-CG 3.36Å; S81-R85 PolarHBondContact O-N 3.38Å; S82-R85 WeakPolarHBondContact O-CB 3.42Å; S82-R85 PolarHBondContact O-N 3.16Å; R85-M87 VanDerWaalsContact C-N 3.31Å; R85-M87 PolarHBondContact O-N 2.97Å; R85-D88 PolarHBondContact O-N 3.22Å; R85-V89 WeakPolarHBondContact O-CB 3.28Å; R85-V89 VanDerWaalsContact O-CG2 3.28Å; R85-V89 WeakPolarHBondContact O-CG2 3.35Å; R85-V89 PolarHBondContact O-N 3.5Å
86	D	91.2	Very high	89.8	Confident	102 Å²	102	93.4 Å²	93.4	55%	0.545	49%	0.494	S	S	.	.	H	α-helix	trans	-63.2	-40.1	177.5	-67.2	-29.2	0	0	0	111.3	S82 V84 A90	S82-D86 WeakPolarHBondContact O-CB 3.49Å; S82-D86 VanDerWaalsContact O-CG 3.23Å; S82-D86 PolarHBondContact O-N 3.46Å; V84-D86 PolarHBondContact O-N 3.13Å; D86-A90 VanDerWaalsContact O-CB 3.31Å; D86-A90 WeakPolarHBondContact O-CB 3.45Å; D86-A90 PolarHBondContact O-N 3.34Å
87	M	89.3	Confident	89.5	Confident	113 Å²	113	92.4 Å²	92.4	56%	0.557	49%	0.494	S	S	*	.	H	α-helix	trans	-65.3	-41.7	174.8	-177.1	-175.6	71.3	0	0	111.9	K83 V84 R85 A90 K91	K83-M87 WeakPolarHBondContact O-CB 3.35Å; K83-M87 PolarHBondContact O-N 3.34Å; V84-M87 WeakPolarHBondContact O-CB 3.41Å; V84-M87 PolarHBondContact O-N 2.9Å; R85-M87 VanDerWaalsContact C-N 3.31Å; R85-M87 PolarHBondContact O-N 2.97Å; M87-A90 PolarHBondContact O-N 3.38Å; M87-K91 VanDerWaalsContact O-CB 3.23Å; M87-K91 WeakPolarHBondContact O-CB 3.5Å; M87-K91 PolarHBondContact O-N 3.15Å
88	D	90.9	Very high	89.4	Confident	74 Å²	74	94.6 Å²	94.6	40%	0.396	50%	0.499	S	S	.	.	H	α-helix	trans	-67.2	-42.7	177.3	-77.3	-24.8	0	0	0	111	V84 R85 A90 K91 T92	V84-D88 WeakPolarHBondContact O-CB 3.36Å; V84-D88 PolarHBondContact O-N 3.42Å; R85-D88 PolarHBondContact O-N 3.22Å; D88-A90 VanDerWaalsContact C-N 3.32Å; D88-A90 PolarHBondContact O-N 3.36Å; D88-K91 PolarHBondContact O-N 3Å; D88-T92 WeakPolarHBondContact O-CB 3.25Å; D88-T92 PolarHBondContact O-N 2.93Å; D88-T92 PolarHBondContact O-OG1 3.09Å
89	V	93.2	Very high	89.2	Confident	68 Å²	68	94.2 Å²	94.2	41%	0.412	49%	0.493	S	S	.	.	H	α-helix	trans	-60.1	-44.6	173.3	170.3	0	0	0	0	110.6	R85 R93	R85-V89 WeakPolarHBondContact O-CB 3.28Å; R85-V89 VanDerWaalsContact O-CG2 3.28Å; R85-V89 WeakPolarHBondContact O-CG2 3.35Å; R85-V89 PolarHBondContact O-N 3.5Å; V89-R93 WeakPolarHBondContact O-CB 3.35Å; V89-R93 VanDerWaalsContact O-CG 3.23Å; V89-R93 WeakPolarHBondContact O-CG 3.45Å; V89-R93 PolarHBondContact O-N 3.38Å
90	A	89.9	Confident	88.7	Confident	50 Å²	50	95.4 Å²	95.4	41%	0.413	49%	0.487	S	S	.	.	H	α-helix	trans	-64.2	-42.7	175.9	0	0	0	0	0	111.8	D86 M87 D88 R93 V94	D86-A90 VanDerWaalsContact O-CB 3.31Å; D86-A90 WeakPolarHBondContact O-CB 3.45Å; D86-A90 PolarHBondContact O-N 3.34Å; M87-A90 PolarHBondContact O-N 3.38Å; D88-A90 VanDerWaalsContact C-N 3.32Å; D88-A90 PolarHBondContact O-N 3.36Å; A90-R93 PolarHBondContact O-N 3.39Å; A90-V94 WeakPolarHBondContact O-CB 3.37Å; A90-V94 VanDerWaalsContact O-CG2 3.24Å; A90-V94 WeakPolarHBondContact O-CG2 3.41Å; A90-V94 PolarHBondContact O-N 2.85Å
91	K	90.3	Very high	88.5	Confident	127 Å²	127	94 Å²	94	55%	0.552	48%	0.483	S	S	*	.	H	α-helix	trans	-63.2	-47	178.6	-178.2	-177.7	174.9	-173.4	0	111.5	M87 D88 R93 V94 I95	M87-K91 VanDerWaalsContact O-CB 3.23Å; M87-K91 WeakPolarHBondContact O-CB 3.5Å; M87-K91 PolarHBondContact O-N 3.15Å; D88-K91 PolarHBondContact O-N 3Å; K91-R93 PolarHBondContact O-N 2.94Å; K91-V94 PolarHBondContact O-N 3.24Å; K91-I95 HydrophobicContact CG-CD1 3.87Å; K91-I95 VanDerWaalsContact O-CG1 3.27Å; K91-I95 WeakPolarHBondContact O-CG1 3.36Å; K91-I95 PolarHBondContact O-N 2.89Å
92	T	90.7	Very high	88.3	Confident	73 Å²	73	96.4 Å²	96.4	45%	0.448	49%	0.488	S	S	.	.	H	α-helix	trans	-59.5	-46.9	175.9	-59.9	0	0	0	0	110.6	D88 V94 I95 E96	D88-T92 WeakPolarHBondContact O-CB 3.25Å; D88-T92 PolarHBondContact O-N 2.93Å; D88-T92 PolarHBondContact O-OG1 3.09Å; T92-V94 VanDerWaalsContact C-N 3.33Å; T92-V94 PolarHBondContact O-N 2.96Å; T92-I95 PolarHBondContact O-N 2.82Å; T92-E96 HydrophobicContact CG2-CG 4.41Å; T92-E96 WeakPolarHBondContact CG2-OE1 3.49Å; T92-E96 WeakPolarHBondContact O-CB 3.4Å; T92-E96 VanDerWaalsContact O-CG 3.3Å; T92-E96 WeakPolarHBondContact O-CG 3.47Å; T92-E96 PolarHBondContact O-N 3.35Å
93	R	89.3	Confident	88.1	Confident	170 Å²	170	94.8 Å²	94.8	64%	0.642	48%	0.475	S	S	*	.	H	α-helix	trans	-61	-39.2	175.7	-73	173	-178.2	176.6	3.2	113	V89 A90 K91 C97	V89-R93 WeakPolarHBondContact O-CB 3.35Å; V89-R93 VanDerWaalsContact O-CG 3.23Å; V89-R93 WeakPolarHBondContact O-CG 3.45Å; V89-R93 PolarHBondContact O-N 3.38Å; A90-R93 PolarHBondContact O-N 3.39Å; K91-R93 PolarHBondContact O-N 2.94Å; R93-C97 WeakPolarHBondContact O-CB 3.28Å; R93-C97 PolarHBondContact O-N 3.36Å
94	V	90.8	Very high	87.7	Confident	84 Å²	84	89 Å²	89	51%	0.509	45%	0.451	S	S	.	.	H	α-helix	trans	-67.7	-42.3	176.9	169	0	0	0	0	110.7	A90 K91 T92 C97 L98	A90-V94 WeakPolarHBondContact O-CB 3.37Å; A90-V94 VanDerWaalsContact O-CG2 3.24Å; A90-V94 WeakPolarHBondContact O-CG2 3.41Å; A90-V94 PolarHBondContact O-N 2.85Å; K91-V94 PolarHBondContact O-N 3.24Å; T92-V94 VanDerWaalsContact C-N 3.33Å; T92-V94 PolarHBondContact O-N 2.96Å; V94-C97 PolarHBondContact O-N 3.42Å; V94-L98 HydrophobicContact CG1-CD1 3.92Å; V94-L98 HydrophobicContact CG1-CG 4.32Å; V94-L98 WeakPolarHBondContact O-CB 3.17Å; V94-L98 VanDerWaalsContact O-CG 3.27Å; V94-L98 WeakPolarHBondContact O-CG 3.23Å; V94-L98 PolarHBondContact O-N 3.46Å
95	I	90	Very high	87.3	Confident	95 Å²	95	90.7 Å²	90.7	49%	0.487	46%	0.458	S	S	.	.	H	α-helix	trans	-63.7	-46.6	176.5	-68.9	167	0	0	0	110.5	K91 T92 C97 L98 Q99	K91-I95 HydrophobicContact CG-CD1 3.87Å; K91-I95 VanDerWaalsContact O-CG1 3.27Å; K91-I95 WeakPolarHBondContact O-CG1 3.36Å; K91-I95 PolarHBondContact O-N 2.89Å; T92-I95 PolarHBondContact O-N 2.82Å; I95-C97 VanDerWaalsContact C-N 3.32Å; I95-C97 PolarHBondContact O-N 2.94Å; I95-L98 PolarHBondContact O-N 2.84Å; I95-Q99 WeakPolarHBondContact O-CB 3.25Å; I95-Q99 PolarHBondContact O-N 3.25Å
96	E	85.2	Confident	87.1	Confident	118 Å²	118	84.8 Å²	84.8	55%	0.551	44%	0.439	S	S	*	.	H	α-helix	trans	-59.2	-43.2	174.8	-73.3	171.1	177.1	0	0	111.4	T92 Q99 F100	T92-E96 HydrophobicContact CG2-CG 4.41Å; T92-E96 WeakPolarHBondContact CG2-OE1 3.49Å; T92-E96 WeakPolarHBondContact O-CB 3.4Å; T92-E96 VanDerWaalsContact O-CG 3.3Å; T92-E96 WeakPolarHBondContact O-CG 3.47Å; T92-E96 PolarHBondContact O-N 3.35Å; E96-Q99 PolarHBondContact O-N 2.9Å; E96-F100 VanDerWaalsContact O-CB 3.23Å; E96-F100 WeakPolarHBondContact O-CB 3.41Å; E96-F100 PolarHBondContact O-N 3.16Å
97	C	83.6	Confident	86.8	Confident	72 Å²	72	80 Å²	80	49%	0.486	41%	0.413	S	S	.	.	H	α-helix	trans	-70.7	-34.9	179.4	-160.1	0	0	0	0	112.4	R93 V94 I95 V101	R93-C97 WeakPolarHBondContact O-CB 3.28Å; R93-C97 PolarHBondContact O-N 3.36Å; V94-C97 PolarHBondContact O-N 3.42Å; I95-C97 VanDerWaalsContact C-N 3.32Å; I95-C97 PolarHBondContact O-N 2.94Å; C97-V101 VanDerWaalsContact O-CG2 3.26Å; C97-V101 WeakPolarHBondContact O-CG2 3.21Å; C97-V101 PolarHBondContact O-N 3.43Å
98	L	87.6	Confident	86.5	Confident	97 Å²	97	82.5 Å²	82.5	51%	0.508	42%	0.416	S	S	.	.	H	α-helix	trans	-65.6	-48.6	173.3	-78.9	170.4	0	0	0	110.6	V94 I95 F100 V101 E102	V94-L98 HydrophobicContact CG1-CD1 3.92Å; V94-L98 HydrophobicContact CG1-CG 4.32Å; V94-L98 WeakPolarHBondContact O-CB 3.17Å; V94-L98 VanDerWaalsContact O-CG 3.27Å; V94-L98 WeakPolarHBondContact O-CG 3.23Å; V94-L98 PolarHBondContact O-N 3.46Å; I95-L98 PolarHBondContact O-N 2.84Å; L98-F100 VanDerWaalsContact C-N 3.29Å; L98-F100 PolarHBondContact O-N 2.67Å; L98-V101 PolarHBondContact O-N 2.84Å; L98-V101 VanDerWaalsContact O-N 3.14Å; L98-E102 WeakPolarHBondContact O-CB 3.46Å; L98-E102 WeakPolarHBondContact O-CG 3.41Å; L98-E102 PolarHBondContact O-N 3.48Å
99	Q	85.1	Confident	86.3	Confident	97 Å²	97	82.8 Å²	82.8	45%	0.453	42%	0.421	S	S	.	.	H	α-helix	trans	-56.9	-45.5	174.9	-174.8	63.5	51.5	0	0	110.8	I95 E96 V101 E102 D103	I95-Q99 WeakPolarHBondContact O-CB 3.25Å; I95-Q99 PolarHBondContact O-N 3.25Å; E96-Q99 PolarHBondContact O-N 2.9Å; Q99-V101 PolarHBondContact O-N 2.62Å; Q99-E102 PolarHBondContact O-N 3.46Å; Q99-D103 PolarHBondContact NE2-OD1 2.85Å; Q99-D103 WeakPolarHBondContact O-CB 3.49Å; Q99-D103 PolarHBondContact O-N 3.47Å
100	F	82.8	Confident	86	Confident	67 Å²	67	79.6 Å²	79.6	29%	0.294	40%	0.402	S	S	.	.	H	α-helix	trans	-60.9	-40.9	177.1	179.4	-96.3	0	0	0	113	E96 L98 I104 V140 A143	E96-F100 VanDerWaalsContact O-CB 3.23Å; E96-F100 WeakPolarHBondContact O-CB 3.41Å; E96-F100 PolarHBondContact O-N 3.16Å; L98-F100 VanDerWaalsContact C-N 3.29Å; L98-F100 PolarHBondContact O-N 2.67Å; F100-I104 HydrophobicContact CD1-CD1 3.88Å; F100-I104 HydrophobicContact CE1-CD1 3.26Å; F100-I104 HydrophobicContact CE1-CG1 4.33Å; F100-I104 HydrophobicContact CE2-CD1 4.35Å; F100-I104 HydrophobicContact CZ-CD1 3.52Å; F100-I104 HydrophobicContact CZ-CG1 4.41Å; F100-I104 WeakPolarHBondContact O-CG1 3.42Å; F100-I104 PolarHBondContact O-N 3.49Å; F100-V140 HydrophobicContact CD2-CB 4.44Å; F100-V140 HydrophobicContact CD2-CG2 3.78Å; F100-V140 HydrophobicContact CE2-CB 4.38Å; F100-V140 HydrophobicContact CE2-CG1 4.46Å; F100-V140 HydrophobicContact CE2-CG2 4.19Å; F100-A143 HydrophobicContact CE2-CB 3.55Å; F100-A143 HydrophobicContact CZ-CB 3.41Å; F100-A143 VanDerWaalsContact CZ-CB 3.41Å
101	V	82.8	Confident	85.9	Confident	71 Å²	71	78.6 Å²	78.6	43%	0.43	39%	0.391	S	S	.	.	H	α-helix	trans	-68.4	-41.8	175.7	169.6	0	0	0	0	111.2	C97 L98 Q99 I104 L105	C97-V101 VanDerWaalsContact O-CG2 3.26Å; C97-V101 WeakPolarHBondContact O-CG2 3.21Å; C97-V101 PolarHBondContact O-N 3.43Å; L98-V101 PolarHBondContact O-N 2.84Å; L98-V101 VanDerWaalsContact O-N 3.14Å; Q99-V101 PolarHBondContact O-N 2.62Å; V101-I104 PolarHBondContact O-N 2.87Å; V101-L105 HydrophobicContact CG1-CD1 4.12Å; V101-L105 HydrophobicContact CG1-CG 4.47Å; V101-L105 WeakPolarHBondContact O-CG 3.23Å; V101-L105 PolarHBondContact O-N 2.86Å
102	E	85.1	Confident	85.7	Confident	103 Å²	103	76.7 Å²	76.7	48%	0.481	38%	0.383	S	S	.	.	H	α-helix	trans	-59.9	-45.2	174.6	-74.2	176.9	-177.6	0	0	110.9	L98 Q99 I104 L105 D106	L98-E102 WeakPolarHBondContact O-CB 3.46Å; L98-E102 WeakPolarHBondContact O-CG 3.41Å; L98-E102 PolarHBondContact O-N 3.48Å; Q99-E102 PolarHBondContact O-N 3.46Å; E102-I104 VanDerWaalsContact C-N 3.34Å; E102-I104 PolarHBondContact O-N 2.65Å; E102-L105 PolarHBondContact O-N 2.85Å; E102-D106 WeakPolarHBondContact O-CB 3.5Å; E102-D106 PolarHBondContact O-N 2.88Å
103	D	83.6	Confident	85.6	Confident	22 Å²	22	73.9 Å²	73.9	12%	0.118	37%	0.369	C	S	.	.	H	α-helix	trans	-63.5	-37.4	176.8	-64.9	-20.9	0	0	0	111.8	Q99 L107 L136 V140	Q99-D103 PolarHBondContact NE2-OD1 2.85Å; Q99-D103 WeakPolarHBondContact O-CB 3.49Å; Q99-D103 PolarHBondContact O-N 3.47Å; D103-L107 WeakPolarHBondContact O-CB 3.41Å; D103-L107 PolarHBondContact O-N 3.32Å; D103-L136 HydrophobicContact CB-CD2 4.08Å; D103-L136 VanDerWaalsContact O-CD2 3.28Å; D103-L136 WeakPolarHBondContact O-CD2 3.48Å; D103-V140 HydrophobicContact CB-CB 4.31Å; D103-V140 HydrophobicContact CB-CG1 3.81Å; D103-V140 HydrophobicContact CB-CG2 3.73Å; D103-V140 WeakPolarHBondContact OD2-CG2 3.4Å
104	I	80.3	Confident	85.7	Confident	37 Å²	37	65.9 Å²	65.9	19%	0.19	34%	0.339	C	S	.	.	H	α-helix	trans	-68.2	-41.1	174	-72	177.3	0	0	0	111.7	F100 V101 E102 D106 L107 R108 V140	F100-I104 HydrophobicContact CD1-CD1 3.88Å; F100-I104 HydrophobicContact CE1-CD1 3.26Å; F100-I104 HydrophobicContact CE1-CG1 4.33Å; F100-I104 HydrophobicContact CE2-CD1 4.35Å; F100-I104 HydrophobicContact CZ-CD1 3.52Å; F100-I104 HydrophobicContact CZ-CG1 4.41Å; F100-I104 WeakPolarHBondContact O-CG1 3.42Å; F100-I104 PolarHBondContact O-N 3.49Å; V101-I104 PolarHBondContact O-N 2.87Å; E102-I104 VanDerWaalsContact C-N 3.34Å; E102-I104 PolarHBondContact O-N 2.65Å; I104-D106 VanDerWaalsContact C-N 3.32Å; I104-L107 WeakPolarHBondContact O-CB 3.48Å; I104-L107 PolarHBondContact O-N 2.88Å; I104-R108 PolarHBondContact O-N 3.46Å; I104-V140 HydrophobicContact CG1-CG1 3.82Å
105	L	83.6	Confident	85.5	Confident	99 Å²	99	69.5 Å²	69.5	52%	0.518	34%	0.344	S	S	.	.	H	α-helix	trans	-65.1	-40.1	176.3	-73.6	172.5	0	0	0	110.9	V101 E102 R108 T109	V101-L105 HydrophobicContact CG1-CD1 4.12Å; V101-L105 HydrophobicContact CG1-CG 4.47Å; V101-L105 WeakPolarHBondContact O-CG 3.23Å; V101-L105 PolarHBondContact O-N 2.86Å; E102-L105 PolarHBondContact O-N 2.85Å; L105-R108 PolarHBondContact O-N 2.87Å; L105-T109 WeakPolarHBondContact O-CB 3.3Å; L105-T109 PolarHBondContact O-N 2.84Å; L105-T109 PolarHBondContact O-OG1 2.64Å
106	D	84.6	Confident	85.5	Confident	42 Å²	42	68.8 Å²	68.8	23%	0.225	34%	0.34	C	S	.	.	H	α-helix	trans	-62.2	-44.5	172.7	-82.5	-13.8	0	0	0	111.4	E102 I104 R108 T109 C110 R132	E102-D106 WeakPolarHBondContact O-CB 3.5Å; E102-D106 PolarHBondContact O-N 2.88Å; I104-D106 VanDerWaalsContact C-N 3.32Å; D106-R108 VanDerWaalsContact C-N 3.32Å; D106-R108 PolarHBondContact O-N 3.11Å; D106-T109 CarbonylContact O-C 3.6Å; D106-T109 PolarHBondContact O-N 3.15Å; D106-T109 VanDerWaalsContact O-N 3.16Å; D106-C110 WeakPolarHBondContact O-CB 3.34Å; D106-C110 PolarHBondContact O-N 3.01Å; D106-C110 PolarHBondContact O-SG 3.32Å; D106-R132 IonicContact OD1-CZ 2.69Å; D106-R132 IonicContact OD1-NH2 2.78Å; D106-R132 PolarHBondContact OD1-NH2 3.18Å; D106-R132 IonicContact OD2-CZ 3.72Å; D106-R132 IonicContact OD2-NE 2.79Å; D106-R132 IonicContact OD2-NH2 3.41Å; D106-R132 PolarHBondContact OD2-NH2 3.31Å
107	L	84.1	Confident	85.7	Confident	1 Å²	1	63.3 Å²	63.3	1%	0.005	32%	0.315	C	S	.	.	H	α-helix	trans	-58	-44.5	175.2	176.1	63.9	0	0	0	111.4	D103 I104 C110 T111 F133 L136 S144 P161 V162 M165	D103-L107 WeakPolarHBondContact O-CB 3.41Å; D103-L107 PolarHBondContact O-N 3.32Å; I104-L107 WeakPolarHBondContact O-CB 3.48Å; I104-L107 PolarHBondContact O-N 2.88Å; L107-C110 PolarHBondContact O-N 3.3Å; L107-T111 WeakPolarHBondContact O-CB 3.42Å; L107-T111 PolarHBondContact O-N 3.09Å; L107-T111 PolarHBondContact O-OG1 3.11Å; L107-F133 HydrophobicContact CD1-CD2 3.48Å; L107-F133 VanDerWaalsContact CD1-CD2 3.48Å; L107-F133 HydrophobicContact CD1-CE2 3.7Å; L107-L136 HydrophobicContact CB-CD2 4.07Å; L107-S144 WeakPolarHBondContact CD2-OG 3.35Å; L107-P161 HydrophobicContact CD2-CB 4.21Å; L107-P161 HydrophobicContact CG-CB 4.22Å; L107-V162 HydrophobicContact CD2-CG2 3.88Å; L107-M165 HydrophobicContact CD1-CG 4.19Å
108	R	83	Confident	85.9	Confident	165 Å²	165	61.4 Å²	61.4	62%	0.623	30%	0.3	S	S	*	.	H	α-helix	trans	-64.5	-41.9	176.2	-73.3	-172.7	-179.9	-162.8	0.9	111.9	I104 L105 D106 T111 E112	I104-R108 PolarHBondContact O-N 3.46Å; L105-R108 PolarHBondContact O-N 2.87Å; D106-R108 VanDerWaalsContact C-N 3.32Å; D106-R108 PolarHBondContact O-N 3.11Å; R108-T111 PolarHBondContact O-N 2.89Å; R108-E112 PolarHBondContact O-N 3.46Å
109	T	86.8	Confident	85.8	Confident	81 Å²	81	60.5 Å²	60.5	50%	0.497	31%	0.306	S	S	.	.	H	α-helix	trans	-64.7	-41.4	177.6	-55.9	0	0	0	0	111.3	L105 D106 G113	L105-T109 WeakPolarHBondContact O-CB 3.3Å; L105-T109 PolarHBondContact O-N 2.84Å; L105-T109 PolarHBondContact O-OG1 2.64Å; D106-T109 CarbonylContact O-C 3.6Å; D106-T109 PolarHBondContact O-N 3.15Å; D106-T109 VanDerWaalsContact O-N 3.16Å; T109-G113 WeakPolarHBondContact O-CA 3.45Å; T109-G113 PolarHBondContact O-N 2.82Å
110	C	87.6	Confident	86	Confident	1 Å²	1	61.5 Å²	61.5	1%	0.007	32%	0.315	C	S	.	.	H	α-helix	trans	-64.9	-41.3	172.8	-72.8	0	0	0	0	111.7	D106 L107 G113 V114 H129 M165	D106-C110 WeakPolarHBondContact O-CB 3.34Å; D106-C110 PolarHBondContact O-N 3.01Å; D106-C110 PolarHBondContact O-SG 3.32Å; L107-C110 PolarHBondContact O-N 3.3Å; C110-G113 PolarHBondContact O-N 2.65Å; C110-V114 WeakPolarHBondContact O-CB 3.09Å; C110-V114 VanDerWaalsContact O-CG2 3.24Å; C110-V114 WeakPolarHBondContact O-CG2 3.24Å; C110-V114 PolarHBondContact O-N 3.17Å; C110-H129 HydrophobicContact CB-CB 4.24Å; C110-M165 HydrophobicContact CB-CE 4.02Å
111	T	86.3	Confident	86.2	Confident	29 Å²	29	64.6 Å²	64.6	18%	0.178	33%	0.33	C	S	.	.	H	α-helix	trans	-61.8	-47.2	179.2	-51.1	0	0	0	0	111.6	L107 R108 R115 A164 M165	L107-T111 WeakPolarHBondContact O-CB 3.42Å; L107-T111 PolarHBondContact O-N 3.09Å; L107-T111 PolarHBondContact O-OG1 3.11Å; R108-T111 PolarHBondContact O-N 2.89Å; T111-R115 PolarHBondContact O-N 2.66Å; T111-A164 HydrophobicContact CG2-CB 3.98Å; T111-M165 VanDerWaalsContact CA-SD 3.52Å; T111-M165 HydrophobicContact CG2-CG 4.31Å; T111-M165 WeakPolarHBondContact OG1-CG 3.48Å
112	E	87.3	Confident	86.5	Confident	86 Å²	86	63.4 Å²	63.4	40%	0.402	32%	0.322	S	S	.	.	H	α-helix	trans	-71.8	-40.3	177.7	-176.9	58.5	-169.8	0	0	112	R108 R115 I116	R108-E112 PolarHBondContact O-N 3.46Å; E112-R115 PolarHBondContact O-N 3.43Å; E112-R115 IonicContact OE1-CZ 3.42Å; E112-R115 IonicContact OE1-NE 2.65Å; E112-R115 IonicContact OE1-NH2 3.66Å; E112-R115 PolarHBondContact OE1-NH2 3.42Å; E112-R115 IonicContact OE2-CZ 3.74Å; E112-R115 IonicContact OE2-NE 2.78Å; E112-R115 PolarHBondContact OE2-NE 2.91Å; E112-R115 IonicContact OE2-NH2 2.68Å; E112-R115 PolarHBondContact OE2-NH2 3.13Å; E112-I116 HydrophobicContact CG-CD1 3.97Å; E112-I116 WeakPolarHBondContact O-CG1 3.48Å; E112-I116 PolarHBondContact O-N 2.77Å
113	G	89.3	Confident	86.8	Confident	15 Å²	15	59.6 Å²	59.6	16%	0.155	30%	0.303	C	S	.	.	H	α-helix	trans	-60.7	-45.2	177.1	0	0	0	0	0	112.8	T109 C110 I116 A117	T109-G113 WeakPolarHBondContact O-CA 3.45Å; T109-G113 PolarHBondContact O-N 2.82Å; C110-G113 PolarHBondContact O-N 2.65Å; G113-I116 PolarHBondContact O-N 2.82Å; G113-A117 VanDerWaalsContact O-CB 3.22Å; G113-A117 WeakPolarHBondContact O-CB 3.44Å; G113-A117 PolarHBondContact O-N 3.09Å
114	V	89.7	Confident	87.2	Confident	2 Å²	2	61.8 Å²	61.8	1%	0.012	31%	0.312	C	S	.	.	H	α-helix	trans	-62	-44.3	174.3	173.3	0	0	0	0	110.8	C110 I116 A117 M118 H129 V130 M165 A168	C110-V114 WeakPolarHBondContact O-CB 3.09Å; C110-V114 VanDerWaalsContact O-CG2 3.24Å; C110-V114 WeakPolarHBondContact O-CG2 3.24Å; C110-V114 PolarHBondContact O-N 3.17Å; V114-I116 VanDerWaalsContact C-N 3.32Å; V114-I116 PolarHBondContact O-N 3.29Å; V114-A117 PolarHBondContact O-N 2.91Å; V114-M118 HydrophobicContact CG1-CG 3.76Å; V114-M118 VanDerWaalsContact O-CB 3.26Å; V114-M118 WeakPolarHBondContact O-CB 3.36Å; V114-M118 WeakPolarHBondContact O-CG 3.33Å; V114-M118 PolarHBondContact O-N 2.81Å; V114-H129 HydrophobicContact CG2-CB 3.33Å; V114-V130 HydrophobicContact CG1-CG2 4.44Å; V114-V130 HydrophobicContact CG2-CG2 3.87Å; V114-M165 HydrophobicContact CB-SD 4.18Å; V114-M165 HydrophobicContact CG2-CE 3.8Å; V114-M165 HydrophobicContact CG2-SD 3.9Å; V114-A168 HydrophobicContact CG1-CB 3.6Å
115	R	86.6	Confident	87.6	Confident	159 Å²	159	65.1 Å²	65.1	60%	0.6	33%	0.327	S	S	*	.	H	α-helix	trans	-59.5	-43.8	-179.6	-169.4	-176.5	72.7	92.9	3.3	111.7	T111 E112 A119	T111-R115 PolarHBondContact O-N 2.66Å; E112-R115 PolarHBondContact O-N 3.43Å; E112-R115 IonicContact OE1-CZ 3.42Å; E112-R115 IonicContact OE1-NE 2.65Å; E112-R115 IonicContact OE1-NH2 3.66Å; E112-R115 PolarHBondContact OE1-NH2 3.42Å; E112-R115 IonicContact OE2-CZ 3.74Å; E112-R115 IonicContact OE2-NE 2.78Å; E112-R115 PolarHBondContact OE2-NE 2.91Å; E112-R115 IonicContact OE2-NH2 2.68Å; E112-R115 PolarHBondContact OE2-NH2 3.13Å; R115-A119 WeakPolarHBondContact O-CB 3.37Å; R115-A119 PolarHBondContact O-N 3.4Å; R115-A119 VanDerWaalsContact O-N 3.16Å
116	I	89.8	Confident	87.9	Confident	80 Å²	80	60.4 Å²	60.4	41%	0.41	30%	0.303	S	S	.	.	H	α-helix	trans	-68.9	-45.9	177.4	-64.1	167.7	0	0	0	110.7	E112 G113 V114 M118 A119 N120	E112-I116 HydrophobicContact CG-CD1 3.97Å; E112-I116 WeakPolarHBondContact O-CG1 3.48Å; E112-I116 PolarHBondContact O-N 2.77Å; G113-I116 PolarHBondContact O-N 2.82Å; V114-I116 VanDerWaalsContact C-N 3.32Å; V114-I116 PolarHBondContact O-N 3.29Å; I116-M118 PolarHBondContact O-N 3.22Å; I116-A119 PolarHBondContact O-N 3.3Å; I116-N120 PolarHBondContact O-N 2.9Å; I116-N120 PolarHBondContact O-ND2 2.88Å
117	A	90	Very high	88.1	Confident	4 Å²	4	58.4 Å²	58.4	3%	0.033	29%	0.292	C	S	.	.	H	α-helix	trans	-63.2	-42	-179.1	0	0	0	0	0	112.2	G113 V114 N120 E121 D122 Q125 A126	G113-A117 VanDerWaalsContact O-CB 3.22Å; G113-A117 WeakPolarHBondContact O-CB 3.44Å; G113-A117 PolarHBondContact O-N 3.09Å; V114-A117 PolarHBondContact O-N 2.91Å; A117-N120 CarbonylContact O-C 3.54Å; A117-N120 PolarHBondContact O-N 3.32Å; A117-E121 PolarHBondContact O-N 3.44Å; A117-E121 VanDerWaalsContact O-N 3.14Å; A117-D122 PolarHBondContact O-N 3.41Å; A117-Q125 HydrophobicContact CB-CB 4Å; A117-A126 HydrophobicContact CB-CB 3.87Å
118	M	87.5	Confident	88.4	Confident	31 Å²	31	61.5 Å²	61.5	15%	0.153	31%	0.314	C	S	.	.	H	α-helix	trans	-63.3	-40.3	174.7	-69.8	-74	-72.7	0	0	111.7	V114 I116 N120 E121 A126 E171 L172 I175	V114-M118 HydrophobicContact CG1-CG 3.76Å; V114-M118 VanDerWaalsContact O-CB 3.26Å; V114-M118 WeakPolarHBondContact O-CB 3.36Å; V114-M118 WeakPolarHBondContact O-CG 3.33Å; V114-M118 PolarHBondContact O-N 2.81Å; I116-M118 PolarHBondContact O-N 3.22Å; M118-N120 VanDerWaalsContact C-N 3.29Å; M118-N120 PolarHBondContact O-N 3.47Å; M118-E121 PolarHBondContact O-N 2.86Å; M118-A126 HydrophobicContact CG-CB 4.18Å; M118-A126 HydrophobicContact SD-CB 4.06Å; M118-E171 HydrophobicContact CE-CB 4.18Å; M118-E171 HydrophobicContact CE-CG 3.77Å; M118-L172 HydrophobicContact CE-CB 4.39Å; M118-L172 HydrophobicContact SD-CB 4.07Å; M118-L172 HydrophobicContact SD-CD1 3.8Å; M118-L172 HydrophobicContact SD-CG 4.41Å; M118-I175 HydrophobicContact CE-CD1 3.62Å
119	A	86.7	Confident	88.6	Confident	79 Å²	79	55.6 Å²	55.6	65%	0.653	29%	0.293	S	S	*	.	H	α-helix	trans	-67.6	-28.8	176.5	0	0	0	0	0	113.2	R115 I116	R115-A119 WeakPolarHBondContact O-CB 3.37Å; R115-A119 PolarHBondContact O-N 3.4Å; R115-A119 VanDerWaalsContact O-N 3.16Å; I116-A119 PolarHBondContact O-N 3.3Å
120	N	89.6	Confident	88.7	Confident	117 Å²	117	51.8 Å²	51.8	63%	0.626	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.3	2.3	178.3	-68.6	-20.9	0	0	0	113.6	I116 A117 M118 D122	I116-N120 PolarHBondContact O-N 2.9Å; I116-N120 PolarHBondContact O-ND2 2.88Å; A117-N120 CarbonylContact O-C 3.54Å; A117-N120 PolarHBondContact O-N 3.32Å; M118-N120 VanDerWaalsContact C-N 3.29Å; M118-N120 PolarHBondContact O-N 3.47Å; N120-D122 PolarHBondContact O-N 3.48Å
121	E	85.1	Confident	88.7	Confident	132 Å²	132	55.4 Å²	55.4	62%	0.617	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.7	23.4	-173.6	-53.3	-174.7	177.4	0	0	114.3	A117 M118 Y123	A117-E121 PolarHBondContact O-N 3.44Å; A117-E121 VanDerWaalsContact O-N 3.14Å; M118-E121 PolarHBondContact O-N 2.86Å; E121-Y123 HydrophobicContact CB-CE2 4.19Å; E121-Y123 WeakPolarHBondContact O-CD2 2.89Å; E121-Y123 WeakPolarHBondContact O-CE2 3.34Å; E121-Y123 PolarHBondContact O-N 3.14Å
122	D	90.6	Very high	88.7	Confident	47 Å²	47	59.3 Å²	59.3	25%	0.251	30%	0.298	S	S	.	.			trans	-89	81.9	173.2	-172.1	-15.9	0	0	0	109.6	A117 N120 E124 Q125 A126	A117-D122 PolarHBondContact O-N 3.41Å; N120-D122 PolarHBondContact O-N 3.48Å; D122-E124 VanDerWaalsContact C-N 3.27Å; D122-E124 PolarHBondContact O-N 3.24Å; D122-E124 PolarHBondContact OD1-N 3.02Å; D122-Q125 PolarHBondContact O-N 3.25Å; D122-Q125 PolarHBondContact OD1-N 3Å; D122-Q125 VanDerWaalsContact OD2-CD 3.3Å; D122-Q125 WeakPolarHBondContact OD2-CG 3.3Å; D122-Q125 PolarHBondContact OD2-NE2 3.44Å; D122-A126 PolarHBondContact O-N 2.86Å; D122-A126 VanDerWaalsContact O-N 3.14Å
123	Y	91.3	Very high	88.6	Confident	22 Å²	22	55.5 Å²	55.5	9%	0.086	28%	0.28	C	S	.	.	H	α-helix	trans	-68.3	-23.5	-175.3	-55.1	-63.4	0	0	0	113.4	E121 A127 L172 I175 F195	E121-Y123 HydrophobicContact CB-CE2 4.19Å; E121-Y123 WeakPolarHBondContact O-CD2 2.89Å; E121-Y123 WeakPolarHBondContact O-CE2 3.34Å; E121-Y123 PolarHBondContact O-N 3.14Å; Y123-A127 WeakPolarHBondContact O-CB 3.2Å; Y123-A127 PolarHBondContact O-N 3.23Å; Y123-L172 HydrophobicContact CD1-CD1 3.83Å; Y123-L172 HydrophobicContact CG-CD1 4.48Å; Y123-I175 HydrophobicContact CD1-CG2 4.02Å; Y123-I175 HydrophobicContact CE1-CB 4.5Å; Y123-I175 HydrophobicContact CE1-CD1 4.43Å; Y123-I175 HydrophobicContact CE1-CG2 3.44Å; Y123-I175 VanDerWaalsContact CE1-CG2 3.44Å; Y123-I175 HydrophobicContact CE2-CG2 4.42Å; Y123-F195 AromaticContact CD2-CE1 3.8Å; Y123-F195 HydrophobicContact CD2-CE1 3.8Å; Y123-F195 HydrophobicContact CD2-CZ 4.22Å; Y123-F195 HydrophobicContact CG-CE1 4.39Å
124	E	91	Very high	88.3	Confident	68 Å²	68	56.5 Å²	56.5	32%	0.318	28%	0.281	S	S	.	.	H	α-helix	trans	-68.3	-46.2	175.8	-68.2	93.9	138.8	0	0	111.8	D122 A126 A127 S128 R194 L198	D122-E124 VanDerWaalsContact C-N 3.27Å; D122-E124 PolarHBondContact O-N 3.24Å; D122-E124 PolarHBondContact OD1-N 3.02Å; E124-A126 VanDerWaalsContact C-N 3.34Å; E124-A127 PolarHBondContact O-N 2.91Å; E124-S128 WeakPolarHBondContact O-CB 3.35Å; E124-S128 PolarHBondContact O-N 3.42Å; E124-R194 WeakPolarHBondContact OE1-CD 3.39Å; E124-R194 WeakPolarHBondContact OE1-CG 3.18Å; E124-R194 IonicContact OE1-CZ 3.59Å; E124-R194 IonicContact OE1-NE 3.37Å; E124-R194 PolarHBondContact OE1-NE 3.09Å; E124-R194 IonicContact OE1-NH2 3.66Å; E124-R194 PolarHBondContact OE1-NH2 3.13Å; E124-R194 IonicContact OE2-CZ 2.9Å; E124-R194 IonicContact OE2-NE 3.62Å; E124-R194 PolarHBondContact OE2-NE 2.74Å; E124-R194 IonicContact OE2-NH2 2.7Å; E124-R194 PolarHBondContact OE2-NH2 3.48Å; E124-L198 HydrophobicContact CB-CD2 4.49Å; E124-L198 HydrophobicContact CG-CD2 4.08Å
125	Q	89.3	Confident	88	Confident	108 Å²	108	60.9 Å²	60.9	51%	0.505	31%	0.308	S	S	.	.	H	α-helix	trans	-67	-40.5	175.7	-70.7	-168.2	37.6	0	0	111	A117 D122 A127 S128 H129	A117-Q125 HydrophobicContact CB-CB 4Å; D122-Q125 PolarHBondContact O-N 3.25Å; D122-Q125 PolarHBondContact OD1-N 3Å; D122-Q125 VanDerWaalsContact OD2-CD 3.3Å; D122-Q125 WeakPolarHBondContact OD2-CG 3.3Å; D122-Q125 PolarHBondContact OD2-NE2 3.44Å; Q125-A127 VanDerWaalsContact C-N 3.33Å; Q125-A127 PolarHBondContact O-N 3.2Å; Q125-S128 WeakPolarHBondContact O-CB 3.11Å; Q125-S128 PolarHBondContact O-N 2.96Å; Q125-H129 PolarHBondContact O-CD2 3.05Å; Q125-H129 PolarHBondContact O-N 3.33Å
126	A	89.2	Confident	87.8	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-58.5	-46	174.4	0	0	0	0	0	111.1	A117 M118 D122 E124 S128 H129 V130 L172	A117-A126 HydrophobicContact CB-CB 3.87Å; M118-A126 HydrophobicContact CG-CB 4.18Å; M118-A126 HydrophobicContact SD-CB 4.06Å; D122-A126 PolarHBondContact O-N 2.86Å; D122-A126 VanDerWaalsContact O-N 3.14Å; E124-A126 VanDerWaalsContact C-N 3.34Å; A126-S128 PolarHBondContact O-N 3.47Å; A126-H129 PolarHBondContact O-N 2.85Å; A126-V130 WeakPolarHBondContact O-CG2 3.26Å; A126-V130 PolarHBondContact O-N 3.48Å; A126-L172 HydrophobicContact CB-CD1 4.09Å; A126-L172 HydrophobicContact CB-CD2 3.84Å
127	A	90	Very high	87.2	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-65.7	-37.4	178	0	0	0	0	0	112.3	Y123 E124 Q125 V130 H131 L172 L198 Q201 L202	Y123-A127 WeakPolarHBondContact O-CB 3.2Å; Y123-A127 PolarHBondContact O-N 3.23Å; E124-A127 PolarHBondContact O-N 2.91Å; Q125-A127 VanDerWaalsContact C-N 3.33Å; Q125-A127 PolarHBondContact O-N 3.2Å; A127-V130 PolarHBondContact O-N 3.44Å; A127-H131 WeakPolarHBondContact O-CB 3.22Å; A127-H131 PolarHBondContact O-N 3.39Å; A127-L172 HydrophobicContact CB-CD2 4.21Å; A127-L198 HydrophobicContact CB-CB 4.47Å; A127-L198 HydrophobicContact CB-CD2 4Å; A127-Q201 HydrophobicContact CB-CB 4.33Å; A127-Q201 VanDerWaalsContact CB-OE1 3.31Å; A127-L202 HydrophobicContact CB-CD2 4.21Å
128	S	89.8	Confident	86.3	Confident	66 Å²	66	61.7 Å²	61.7	46%	0.462	31%	0.313	S	S	.	.	H	α-helix	trans	-60.8	-45.7	173.8	-175.9	0	0	0	0	112	E124 Q125 A126 H131 R132	E124-S128 WeakPolarHBondContact O-CB 3.35Å; E124-S128 PolarHBondContact O-N 3.42Å; Q125-S128 WeakPolarHBondContact O-CB 3.11Å; Q125-S128 PolarHBondContact O-N 2.96Å; A126-S128 PolarHBondContact O-N 3.47Å; S128-H131 PolarHBondContact O-N 3Å; S128-R132 PolarHBondContact O-N 3.32Å
129	H	88.2	Confident	85.5	Confident	41 Å²	41	65.4 Å²	65.4	19%	0.19	33%	0.333	C	S	.	.	H	α-helix	trans	-69.3	-38.6	177.3	-72.3	-65.1	0	0	0	113	C110 V114 Q125 A126 R132 F133	C110-H129 HydrophobicContact CB-CB 4.24Å; V114-H129 HydrophobicContact CG2-CB 3.33Å; Q125-H129 PolarHBondContact O-CD2 3.05Å; Q125-H129 PolarHBondContact O-N 3.33Å; A126-H129 PolarHBondContact O-N 2.85Å; H129-R132 PolarHBondContact O-N 3.41Å; H129-F133 PolarHBondContact O-N 3.41Å
130	V	87.3	Confident	84.7	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-65.3	-41.9	173.6	171.3	0	0	0	0	110.8	V114 A126 A127 R132 F133 L134 M165 E169 L172 L202	V114-V130 HydrophobicContact CG1-CG2 4.44Å; V114-V130 HydrophobicContact CG2-CG2 3.87Å; A126-V130 WeakPolarHBondContact O-CG2 3.26Å; A126-V130 PolarHBondContact O-N 3.48Å; A127-V130 PolarHBondContact O-N 3.44Å; V130-R132 PolarHBondContact O-N 2.94Å; V130-F133 WeakPolarHBondContact O-CA 3.31Å; V130-F133 WeakPolarHBondContact O-CB 3.44Å; V130-F133 PolarHBondContact O-N 3.03Å; V130-F133 VanDerWaalsContact O-N 3.15Å; V130-L134 HydrophobicContact CG1-CD1 4.01Å; V130-L134 HydrophobicContact CG1-CG 4.31Å; V130-L134 WeakPolarHBondContact O-CG 3.29Å; V130-L134 PolarHBondContact O-N 3.19Å; V130-M165 HydrophobicContact CG2-CE 4.31Å; V130-E169 HydrophobicContact CG1-CB 4.13Å; V130-E169 HydrophobicContact CG1-CG 3.88Å; V130-L172 HydrophobicContact CB-CD2 4.26Å; V130-L172 HydrophobicContact CG2-CD2 3.8Å; V130-L202 HydrophobicContact CB-CD2 4Å; V130-L202 HydrophobicContact CG1-CD2 3.65Å
131	H	87.8	Confident	83.7	Confident	78 Å²	78	56.7 Å²	56.7	36%	0.361	28%	0.276	S	S	.	.	H	α-helix	trans	-59.4	-48.3	175.7	-175.6	62.5	0	0	0	111.1	A127 S128 F133 L134 T135 Q201	A127-H131 WeakPolarHBondContact O-CB 3.22Å; A127-H131 PolarHBondContact O-N 3.39Å; S128-H131 PolarHBondContact O-N 3Å; H131-F133 VanDerWaalsContact C-N 3.27Å; H131-F133 PolarHBondContact O-N 3.13Å; H131-L134 PolarHBondContact O-N 3.44Å; H131-L134 VanDerWaalsContact O-N 3.11Å; H131-T135 WeakPolarHBondContact O-CG2 3.47Å; H131-T135 PolarHBondContact O-N 3.37Å; H131-T135 VanDerWaalsContact O-N 3.09Å; H131-T135 PolarHBondContact O-OG1 2.88Å; H131-Q201 WeakPolarHBondContact CA-O 3.32Å; H131-Q201 HydrophobicContact CB-CB 4.05Å; H131-Q201 WeakPolarHBondContact CB-O 3.29Å; H131-Q201 PolarHBondContact ND1-O 3.21Å; H131-Q201 VanDerWaalsContact ND1-O 3.07Å
132	R	86.5	Confident	83	Confident	111 Å²	111	54.8 Å²	54.8	42%	0.419	27%	0.27	S	S	.	.	H	α-helix	trans	-55.1	-46.2	175.1	-169.4	171.6	-176.2	175	0.1	110.3	D106 S128 H129 V130 L134 T135 L136	D106-R132 IonicContact OD1-CZ 2.69Å; D106-R132 IonicContact OD1-NH2 2.78Å; D106-R132 PolarHBondContact OD1-NH2 3.18Å; D106-R132 IonicContact OD2-CZ 3.72Å; D106-R132 IonicContact OD2-NE 2.79Å; D106-R132 IonicContact OD2-NH2 3.41Å; D106-R132 PolarHBondContact OD2-NH2 3.31Å; S128-R132 PolarHBondContact O-N 3.32Å; H129-R132 PolarHBondContact O-N 3.41Å; V130-R132 PolarHBondContact O-N 2.94Å; R132-L134 PolarHBondContact O-N 3.08Å; R132-T135 PolarHBondContact O-N 3.29Å; R132-T135 VanDerWaalsContact O-N 3.11Å; R132-T135 PolarHBondContact O-OG1 3.31Å; R132-L136 WeakPolarHBondContact O-CD1 3.27Å; R132-L136 PolarHBondContact O-N 3.12Å
133	F	85.5	Confident	81.8	Confident	6 Å²	6	54 Å²	54	3%	0.026	27%	0.27	C	S	.	.	H	α-helix	trans	-57.1	-44.2	174.7	168.1	-103.9	0	0	0	114.6	L107 H129 V130 H131 T135 L136 L141 M165 K166	L107-F133 HydrophobicContact CD1-CD2 3.48Å; L107-F133 VanDerWaalsContact CD1-CD2 3.48Å; L107-F133 HydrophobicContact CD1-CE2 3.7Å; H129-F133 PolarHBondContact O-N 3.41Å; V130-F133 WeakPolarHBondContact O-CA 3.31Å; V130-F133 WeakPolarHBondContact O-CB 3.44Å; V130-F133 PolarHBondContact O-N 3.03Å; V130-F133 VanDerWaalsContact O-N 3.15Å; H131-F133 VanDerWaalsContact C-N 3.27Å; H131-F133 PolarHBondContact O-N 3.13Å; F133-T135 PolarHBondContact O-N 3.13Å; F133-L136 PolarHBondContact O-N 2.99Å; F133-L141 HydrophobicContact CD2-CD2 4.11Å; F133-L141 HydrophobicContact CE2-CD2 3.44Å; F133-L141 VanDerWaalsContact CE2-CD2 3.44Å; F133-L141 HydrophobicContact CZ-CD2 4.17Å; F133-M165 HydrophobicContact CB-CE 3.35Å; F133-M165 HydrophobicContact CD1-CB 4.12Å; F133-M165 HydrophobicContact CD1-CE 4.12Å; F133-M165 HydrophobicContact CD2-CB 3.86Å; F133-M165 HydrophobicContact CD2-CE 4.19Å; F133-M165 HydrophobicContact CD2-CG 4.09Å; F133-M165 HydrophobicContact CE1-CB 3.95Å; F133-M165 HydrophobicContact CE2-CB 3.65Å; F133-M165 HydrophobicContact CE2-CG 4.27Å; F133-M165 HydrophobicContact CG-CB 4.07Å; F133-M165 HydrophobicContact CG-CE 3.64Å; F133-M165 HydrophobicContact CG-CG 4.38Å; F133-M165 HydrophobicContact CZ-CB 3.71Å; F133-K166 HydrophobicContact CE1-CG 4.44Å; F133-K166 HydrophobicContact CZ-CG 4.21Å
134	L	83.3	Confident	80.6	Confident	35 Å²	35	53.6 Å²	53.6	18%	0.183	27%	0.27	C	S	.	.	H	α-helix	trans	-65.6	-24.7	178	-66.5	171.7	0	0	0	112.2	V130 H131 R132 E203	V130-L134 HydrophobicContact CG1-CD1 4.01Å; V130-L134 HydrophobicContact CG1-CG 4.31Å; V130-L134 WeakPolarHBondContact O-CG 3.29Å; V130-L134 PolarHBondContact O-N 3.19Å; H131-L134 PolarHBondContact O-N 3.44Å; H131-L134 VanDerWaalsContact O-N 3.11Å; R132-L134 PolarHBondContact O-N 3.08Å; L134-E203 HydrophobicContact CD1-CB 4.48Å; L134-E203 HydrophobicContact CD1-CG 3.93Å
135	T	83.3	Confident	79.4	Confident	94 Å²	94	52.6 Å²	52.6	58%	0.577	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	-6.5	175.8	62.2	0	0	0	0	115.1	H131 R132 F133	H131-T135 WeakPolarHBondContact O-CG2 3.47Å; H131-T135 PolarHBondContact O-N 3.37Å; H131-T135 VanDerWaalsContact O-N 3.09Å; H131-T135 PolarHBondContact O-OG1 2.88Å; R132-T135 PolarHBondContact O-N 3.29Å; R132-T135 VanDerWaalsContact O-N 3.11Å; R132-T135 PolarHBondContact O-OG1 3.31Å; F133-T135 PolarHBondContact O-N 3.13Å
136	L	82.6	Confident	78.2	Confident	23 Å²	23	54.8 Å²	54.8	12%	0.12	28%	0.276	C	S	.	.	S	Bend	trans	-67.4	149.3	176.9	-90.5	89.8	0	0	0	111.8	D103 L107 R132 F133 V140	D103-L136 HydrophobicContact CB-CD2 4.08Å; D103-L136 VanDerWaalsContact O-CD2 3.28Å; D103-L136 WeakPolarHBondContact O-CD2 3.48Å; L107-L136 HydrophobicContact CB-CD2 4.07Å; R132-L136 WeakPolarHBondContact O-CD1 3.27Å; R132-L136 PolarHBondContact O-N 3.12Å; F133-L136 PolarHBondContact O-N 2.99Å; L136-V140 HydrophobicContact CD2-CG1 4.31Å
137	D	75.8	Confident	76.9	Confident	81 Å²	81	58.9 Å²	58.9	43%	0.433	30%	0.3	S	S	.	.			trans	-60.7	136.5	174.9	-173.4	5.1	0	0	0	111.4	N139 V140 L141	D137-N139 PolarHBondContact O-N 3.46Å; D137-N139 PolarHBondContact OD1-N 3.44Å; D137-N139 PolarHBondContact OD1-ND2 3.07Å; D137-N139 PolarHBondContact OD2-ND2 3.43Å; D137-V140 HydrophobicContact CB-CG2 4.17Å; D137-V140 WeakPolarHBondContact O-CB 3.3Å; D137-V140 PolarHBondContact O-N 2.77Å; D137-V140 VanDerWaalsContact O-N 3.12Å; D137-L141 PolarHBondContact O-N 3.48Å
138	R	72.3	Confident	75.3	Confident	157 Å²	157	59.6 Å²	59.6	59%	0.592	31%	0.307	S	S	*	.	H	α-helix	trans	-59.6	-35.2	179.1	-168.5	65.7	63.1	-174	0.2	111.8	V140 L141 D142	R138-V140 VanDerWaalsContact C-N 3.25Å; R138-V140 PolarHBondContact O-N 2.97Å; R138-L141 WeakPolarHBondContact O-CB 3.34Å; R138-L141 PolarHBondContact O-N 3.48Å; R138-L141 VanDerWaalsContact O-N 3.13Å; R138-D142 PolarHBondContact O-N 3.25Å
139	N	71	Confident	73.8	Confident	108 Å²	108	59.3 Å²	59.3	58%	0.578	31%	0.305	S	S	*	.	H	α-helix	trans	-61	-36.6	178.5	-61.6	-41.9	0	0	0	112	D137 A143	D137-N139 PolarHBondContact O-N 3.46Å; D137-N139 PolarHBondContact OD1-N 3.44Å; D137-N139 PolarHBondContact OD1-ND2 3.07Å; D137-N139 PolarHBondContact OD2-ND2 3.43Å; N139-A143 VanDerWaalsContact O-CB 3.31Å; N139-A143 WeakPolarHBondContact O-CB 3.41Å; N139-A143 PolarHBondContact O-N 3.32Å
140	V	70.2	Confident	72.3	Confident	3 Å²	3	63.3 Å²	63.3	2%	0.018	33%	0.326	C	S	.	.	H	α-helix	trans	-67.4	-41.9	176.5	-178.9	0	0	0	0	110.7	F100 D103 I104 L136 D137 R138 S144	F100-V140 HydrophobicContact CD2-CB 4.44Å; F100-V140 HydrophobicContact CD2-CG2 3.78Å; F100-V140 HydrophobicContact CE2-CB 4.38Å; F100-V140 HydrophobicContact CE2-CG1 4.46Å; F100-V140 HydrophobicContact CE2-CG2 4.19Å; D103-V140 HydrophobicContact CB-CB 4.31Å; D103-V140 HydrophobicContact CB-CG1 3.81Å; D103-V140 HydrophobicContact CB-CG2 3.73Å; D103-V140 WeakPolarHBondContact OD2-CG2 3.4Å; I104-V140 HydrophobicContact CG1-CG1 3.82Å; L136-V140 HydrophobicContact CD2-CG1 4.31Å; D137-V140 HydrophobicContact CB-CG2 4.17Å; D137-V140 WeakPolarHBondContact O-CB 3.3Å; D137-V140 PolarHBondContact O-N 2.77Å; D137-V140 VanDerWaalsContact O-N 3.12Å; R138-V140 VanDerWaalsContact C-N 3.25Å; R138-V140 PolarHBondContact O-N 2.97Å; V140-S144 WeakPolarHBondContact O-CB 3.45Å; V140-S144 PolarHBondContact O-N 3.15Å
141	L	68.2	Low	70.6	Confident	10 Å²	10	66.9 Å²	66.9	5%	0.052	35%	0.351	C	S	.	.	H	α-helix	trans	-63.1	-43.5	177.8	-61.5	176	0	0	0	111.4	F133 D137 R138 S145 V162	F133-L141 HydrophobicContact CD2-CD2 4.11Å; F133-L141 HydrophobicContact CE2-CD2 3.44Å; F133-L141 VanDerWaalsContact CE2-CD2 3.44Å; F133-L141 HydrophobicContact CZ-CD2 4.17Å; D137-L141 PolarHBondContact O-N 3.48Å; R138-L141 WeakPolarHBondContact O-CB 3.34Å; R138-L141 PolarHBondContact O-N 3.48Å; R138-L141 VanDerWaalsContact O-N 3.13Å; L141-S145 WeakPolarHBondContact O-CB 3.46Å; L141-S145 PolarHBondContact O-N 2.87Å; L141-S145 PolarHBondContact O-OG 3.45Å; L141-V162 HydrophobicContact CD2-CG1 4.41Å; L141-V162 HydrophobicContact CD2-CG2 4.08Å
142	D	70.8	Confident	68.8	Low	92 Å²	92	66.1 Å²	66.1	49%	0.492	35%	0.349	S	S	.	.	H	α-helix	trans	-68.8	-44.5	179.9	-68.8	-18.9	0	0	0	111.1	R138 S145 Y146	R138-D142 PolarHBondContact O-N 3.25Å; D142-S145 PolarHBondContact O-N 2.9Å; D142-S145 PolarHBondContact O-OG 3Å; D142-Y146 WeakPolarHBondContact O-CB 3.2Å; D142-Y146 PolarHBondContact O-N 3.22Å
143	A	65.4	Low	67.2	Low	30 Å²	30	69.2 Å²	69.2	25%	0.248	37%	0.368	C	S	.	.	H	α-helix	trans	-67.5	-38.7	177.4	0	0	0	0	0	112.9	F100 N139 S145 Y146 V147	F100-A143 HydrophobicContact CE2-CB 3.55Å; F100-A143 HydrophobicContact CZ-CB 3.41Å; F100-A143 VanDerWaalsContact CZ-CB 3.41Å; N139-A143 VanDerWaalsContact O-CB 3.31Å; N139-A143 WeakPolarHBondContact O-CB 3.41Å; N139-A143 PolarHBondContact O-N 3.32Å; A143-S145 VanDerWaalsContact C-N 3.34Å; A143-Y146 PolarHBondContact O-N 3.29Å; A143-V147 WeakPolarHBondContact O-CB 3.42Å; A143-V147 VanDerWaalsContact O-CG2 3.29Å; A143-V147 WeakPolarHBondContact O-CG2 3.46Å; A143-V147 PolarHBondContact O-N 3.43Å
144	S	65.8	Low	65.3	Low	14 Å²	14	73.7 Å²	73.7	10%	0.098	40%	0.4	C	S	.	.	H	α-helix	trans	-61.9	-41.6	173.1	-179.9	0	0	0	0	111.5	L107 V140 G148	L107-S144 WeakPolarHBondContact CD2-OG 3.35Å; V140-S144 WeakPolarHBondContact O-CB 3.45Å; V140-S144 PolarHBondContact O-N 3.15Å; S144-G148 PolarHBondContact O-N 3.41Å
145	S	64.4	Low	63.6	Low	47 Å²	47	75.6 Å²	75.6	33%	0.329	43%	0.428	S	S	.	.	H	α-helix	trans	-64.5	-39.3	174.4	78.4	0	0	0	0	112.1	L141 D142 A143 S149	L141-S145 WeakPolarHBondContact O-CB 3.46Å; L141-S145 PolarHBondContact O-N 2.87Å; L141-S145 PolarHBondContact O-OG 3.45Å; D142-S145 PolarHBondContact O-N 2.9Å; D142-S145 PolarHBondContact O-OG 3Å; A143-S145 VanDerWaalsContact C-N 3.34Å; S145-S149 WeakPolarHBondContact O-CB 3.42Å; S145-S149 PolarHBondContact O-N 2.9Å; S145-S149 PolarHBondContact O-OG 3.25Å
146	Y	65.4	Low	61.9	Low	155 Å²	155	73.8 Å²	73.8	61%	0.608	42%	0.423	S	S	*	.	H	α-helix	trans	-66	-51.1	176.9	-177	-98.2	0	0	0	111.9	D142 A143 G148 S149 M150	D142-Y146 WeakPolarHBondContact O-CB 3.2Å; D142-Y146 PolarHBondContact O-N 3.22Å; A143-Y146 PolarHBondContact O-N 3.29Å; Y146-G148 VanDerWaalsContact C-N 3.3Å; Y146-G148 PolarHBondContact O-N 3.44Å; Y146-S149 PolarHBondContact O-N 3.38Å; Y146-S149 PolarHBondContact O-OG 2.84Å; Y146-M150 HydrophobicContact CE1-SD 4.44Å; Y146-M150 PolarHBondContact O-N 3.14Å
147	V	61.6	Low	60.3	Low	86 Å²	86	79.8 Å²	79.8	52%	0.521	46%	0.461	S	S	.	.	H	α-helix	trans	-61	-40.5	176.9	174.2	0	0	0	0	111.1	A143 M150 S151	A143-V147 WeakPolarHBondContact O-CB 3.42Å; A143-V147 VanDerWaalsContact O-CG2 3.29Å; A143-V147 WeakPolarHBondContact O-CG2 3.46Å; A143-V147 PolarHBondContact O-N 3.43Å; V147-M150 PolarHBondContact O-N 3.21Å; V147-S151 PolarHBondContact O-N 3.36Å; V147-S151 VanDerWaalsContact O-N 3.08Å; V147-S151 PolarHBondContact O-OG 3.33Å
148	G	56.9	Low	59.4	Low	14 Å²	14	79.8 Å²	79.8	14%	0.144	47%	0.467	C	S	.	.	H	α-helix	trans	-61	-47.7	174	0	0	0	0	0	112.2	S144 Y146 M150 S151 L152	S144-G148 PolarHBondContact O-N 3.41Å; Y146-G148 VanDerWaalsContact C-N 3.3Å; Y146-G148 PolarHBondContact O-N 3.44Å; G148-M150 VanDerWaalsContact C-N 3.29Å; G148-M150 PolarHBondContact O-N 3.18Å; G148-S151 WeakPolarHBondContact O-CB 3.45Å; G148-S151 PolarHBondContact O-N 3.29Å; G148-S151 VanDerWaalsContact O-N 3.12Å; G148-L152 WeakPolarHBondContact O-CB 3.36Å; G148-L152 WeakPolarHBondContact O-CG 3.46Å; G148-L152 PolarHBondContact O-N 2.95Å
149	S	58.2	Low	59	Low	60 Å²	60	76.5 Å²	76.5	42%	0.42	46%	0.458	S	S	.	.	H	α-helix	trans	-62.4	-33.6	178.3	75.9	0	0	0	0	113.3	S145 Y146 L152 Q153	S145-S149 WeakPolarHBondContact O-CB 3.42Å; S145-S149 PolarHBondContact O-N 2.9Å; S145-S149 PolarHBondContact O-OG 3.25Å; Y146-S149 PolarHBondContact O-N 3.38Å; Y146-S149 PolarHBondContact O-OG 2.84Å; S149-L152 PolarHBondContact O-N 3.19Å; S149-Q153 PolarHBondContact O-N 3.44Å
150	M	55	Low	59.2	Low	126 Å²	126	71.7 Å²	71.7	62%	0.621	43%	0.433	S	S	*	.	H	α-helix	trans	-71	-37	175.7	-148.2	171.6	105.8	0	0	111.4	Y146 V147 G148	Y146-M150 HydrophobicContact CE1-SD 4.44Å; Y146-M150 PolarHBondContact O-N 3.14Å; V147-M150 PolarHBondContact O-N 3.21Å; G148-M150 VanDerWaalsContact C-N 3.29Å; G148-M150 PolarHBondContact O-N 3.18Å
151	S	52.2	Low	59.5	Low	75 Å²	75	73.3 Å²	73.3	52%	0.524	44%	0.444	S	S	.	.	H	α-helix	trans	-69.9	-33.9	174.5	-49.2	0	0	0	0	111.9	V147 G148 Q153 S154	V147-S151 PolarHBondContact O-N 3.36Å; V147-S151 VanDerWaalsContact O-N 3.08Å; V147-S151 PolarHBondContact O-OG 3.33Å; G148-S151 WeakPolarHBondContact O-CB 3.45Å; G148-S151 PolarHBondContact O-N 3.29Å; G148-S151 VanDerWaalsContact O-N 3.12Å; S151-Q153 VanDerWaalsContact C-N 3.27Å; S151-Q153 PolarHBondContact O-N 2.92Å; S151-S154 WeakPolarHBondContact O-CB 3.19Å; S151-S154 PolarHBondContact O-N 2.84Å
152	L	50.7	Low	60.2	Low	62 Å²	62	73.1 Å²	73.1	33%	0.325	44%	0.443	S	S	.	.	H	α-helix	trans	-67.1	-20.7	178.5	-81.5	169.6	0	0	0	113.8	G148 S149 S154 G155 A156 S158 T160	G148-L152 WeakPolarHBondContact O-CB 3.36Å; G148-L152 WeakPolarHBondContact O-CG 3.46Å; G148-L152 PolarHBondContact O-N 2.95Å; S149-L152 PolarHBondContact O-N 3.19Å; L152-S154 PolarHBondContact O-N 3.28Å; L152-S154 VanDerWaalsContact O-N 3.13Å; L152-G155 PolarHBondContact O-N 2.8Å; L152-A156 WeakPolarHBondContact CD2-O 3.38Å; L152-S158 WeakPolarHBondContact CD2-O 3.4Å; L152-T160 HydrophobicContact CD1-CG2 3.81Å
153	Q	51.9	Low	60.7	Low	176 Å²	176	73.4 Å²	73.4	82%	0.822	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-19.5	167.5	-71.3	-172.6	-4.9	0	0	111.9	S149 S151 G155	S149-Q153 PolarHBondContact O-N 3.44Å; S151-Q153 VanDerWaalsContact C-N 3.27Å; S151-Q153 PolarHBondContact O-N 2.92Å; Q153-G155 VanDerWaalsContact C-N 3.28Å; Q153-G155 PolarHBondContact O-N 2.81Å
154	S	47.2	Very low	61.6	Low	99 Å²	99	73.2 Å²	73.2	69%	0.692	44%	0.439	S	S	*	.	S	Bend	trans	-86.1	52.9	171.2	-176.4	0	0	0	0	112.6	S151 L152 A156	S151-S154 WeakPolarHBondContact O-CB 3.19Å; S151-S154 PolarHBondContact O-N 2.84Å; L152-S154 PolarHBondContact O-N 3.28Å; L152-S154 VanDerWaalsContact O-N 3.13Å; S154-A156 PolarHBondContact O-N 3.09Å
155	G	46.7	Very low	62.6	Low	76 Å²	76	72.6 Å²	72.6	78%	0.784	44%	0.435	S	S	*	.	S	Bend	trans	57.7	-1.9	157.6	0	0	0	0	0	119.5	L152 Q153	L152-G155 PolarHBondContact O-N 2.8Å; Q153-G155 VanDerWaalsContact C-N 3.28Å; Q153-G155 PolarHBondContact O-N 2.81Å
156	A	46.6	Very low	63.6	Low	55 Å²	55	75 Å²	75	46%	0.455	44%	0.439	S	S	.	.			trans	-89.1	121.1	178.1	0	0	0	0	0	107.6	L152 S154 S158	L152-A156 WeakPolarHBondContact CD2-O 3.38Å; S154-A156 PolarHBondContact O-N 3.09Å; A156-S158 PolarHBondContact O-N 3.27Å
157	T	49.5	Very low	64.7	Low	150 Å²	150	73.4 Å²	73.4	92%	0.92	44%	0.436	S	S	*	.			trans	-68.8	32.2	173.1	55	0	0	0	0	112.4	E159	T157-E159 PolarHBondContact O-N 3.12Å
158	S	56.8	Low	65.9	Low	80 Å²	80	70.1 Å²	70.1	56%	0.559	42%	0.417	S	S	*	.			trans	-80.9	111.7	-171.9	-169.9	0	0	0	0	109.7	L152 A156 T160	L152-S158 WeakPolarHBondContact CD2-O 3.4Å; A156-S158 PolarHBondContact O-N 3.27Å; S158-T160 PolarHBondContact O-N 3.41Å
159	E	64.5	Low	67.5	Low	88 Å²	88	70.9 Å²	70.9	41%	0.411	42%	0.417	S	S	.	.			trans	-48	133.3	168.9	-170.2	171	-167.3	0	0	110	T157 E163 A164	T157-E159 PolarHBondContact O-N 3.12Å; E159-E163 HydrophobicContact CG-CB 3.64Å; E159-A164 HydrophobicContact CG-CB 4.04Å; E159-A164 WeakPolarHBondContact OE1-CA 3.3Å; E159-A164 PolarHBondContact OE1-N 3.34Å
160	T	74.7	Confident	69	Low	8 Å²	8	75.3 Å²	75.3	5%	0.049	43%	0.429	C	S	.	.			trans	-67.3	150.2	176.4	61.5	0	0	0	0	109.5	L152 S158 V162 E163 A164	L152-T160 HydrophobicContact CD1-CG2 3.81Å; S158-T160 PolarHBondContact O-N 3.41Å; T160-V162 PolarHBondContact O-N 2.97Å; T160-V162 VanDerWaalsContact O-N 3.09Å; T160-E163 PolarHBondContact N-OE2 2.98Å; T160-E163 PolarHBondContact O-N 3.23Å; T160-E163 WeakPolarHBondContact OG1-CB 3.44Å; T160-E163 WeakPolarHBondContact OG1-CG 3.41Å; T160-E163 PolarHBondContact OG1-N 3.18Å; T160-E163 PolarHBondContact OG1-OE2 3.49Å; T160-A164 PolarHBondContact O-N 3.08Å
161	P	77.7	Confident	70.8	Confident	37 Å²	37	74.1 Å²	74.1	24%	0.24	42%	0.422	C	S	.	.	H	α-helix	trans	-54.3	-33.7	178.2	-26.9	34.6	0	0	0	113.1	L107 M165	L107-P161 HydrophobicContact CD2-CB 4.21Å; L107-P161 HydrophobicContact CG-CB 4.22Å; P161-M165 WeakPolarHBondContact O-CB 3.14Å; P161-M165 VanDerWaalsContact O-CG 3.31Å; P161-M165 WeakPolarHBondContact O-CG 3.24Å; P161-M165 PolarHBondContact O-N 3.45Å
162	V	81.1	Confident	72.7	Confident	5 Å²	5	70.6 Å²	70.6	3%	0.03	40%	0.397	C	S	.	.	H	α-helix	trans	-68.5	-43.2	176.8	179.7	0	0	0	0	111.8	L107 L141 T160 K166	L107-V162 HydrophobicContact CD2-CG2 3.88Å; L141-V162 HydrophobicContact CD2-CG1 4.41Å; L141-V162 HydrophobicContact CD2-CG2 4.08Å; T160-V162 PolarHBondContact O-N 2.97Å; T160-V162 VanDerWaalsContact O-N 3.09Å; V162-K166 HydrophobicContact CG1-CD 4.28Å; V162-K166 WeakPolarHBondContact O-CB 3.27Å; V162-K166 VanDerWaalsContact O-CG 3.31Å; V162-K166 WeakPolarHBondContact O-CG 3.47Å; V162-K166 PolarHBondContact O-N 3.04Å
163	E	82.3	Confident	74.7	Confident	99 Å²	99	69.1 Å²	69.1	46%	0.463	39%	0.388	S	S	.	.	H	α-helix	trans	-64.7	-45.1	175.8	-73.6	163.2	156.4	0	0	111.2	E159 T160 M165 K166 K167	E159-E163 HydrophobicContact CG-CB 3.64Å; T160-E163 PolarHBondContact N-OE2 2.98Å; T160-E163 PolarHBondContact O-N 3.23Å; T160-E163 WeakPolarHBondContact OG1-CB 3.44Å; T160-E163 WeakPolarHBondContact OG1-CG 3.41Å; T160-E163 PolarHBondContact OG1-N 3.18Å; T160-E163 PolarHBondContact OG1-OE2 3.49Å; E163-M165 VanDerWaalsContact C-N 3.32Å; E163-M165 PolarHBondContact O-N 3.08Å; E163-K166 PolarHBondContact O-N 3.33Å; E163-K167 WeakPolarHBondContact O-CB 3.37Å; E163-K167 PolarHBondContact O-N 3.43Å
164	A	84.1	Confident	76.6	Confident	25 Å²	25	65.8 Å²	65.8	21%	0.207	37%	0.372	C	S	.	.	H	α-helix	trans	-59	-44	177.1	0	0	0	0	0	111.5	T111 E159 T160 K167 A168	T111-A164 HydrophobicContact CG2-CB 3.98Å; E159-A164 HydrophobicContact CG-CB 4.04Å; E159-A164 WeakPolarHBondContact OE1-CA 3.3Å; E159-A164 PolarHBondContact OE1-N 3.34Å; T160-A164 PolarHBondContact O-N 3.08Å; A164-K167 PolarHBondContact O-N 3.15Å; A164-A168 WeakPolarHBondContact O-CB 3.49Å; A164-A168 PolarHBondContact O-N 3.05Å
165	M	86	Confident	78.8	Confident	1 Å²	1	62.8 Å²	62.8	1%	0.005	35%	0.348	C	S	.	.	H	α-helix	trans	-66.8	-40.9	175.8	-77.4	-60	-71.9	0	0	113	L107 C110 T111 V114 V130 F133 P161 E163 K167 A168 E169	L107-M165 HydrophobicContact CD1-CG 4.19Å; C110-M165 HydrophobicContact CB-CE 4.02Å; T111-M165 VanDerWaalsContact CA-SD 3.52Å; T111-M165 HydrophobicContact CG2-CG 4.31Å; T111-M165 WeakPolarHBondContact OG1-CG 3.48Å; V114-M165 HydrophobicContact CB-SD 4.18Å; V114-M165 HydrophobicContact CG2-CE 3.8Å; V114-M165 HydrophobicContact CG2-SD 3.9Å; V130-M165 HydrophobicContact CG2-CE 4.31Å; F133-M165 HydrophobicContact CB-CE 3.35Å; F133-M165 HydrophobicContact CD1-CB 4.12Å; F133-M165 HydrophobicContact CD1-CE 4.12Å; F133-M165 HydrophobicContact CD2-CB 3.86Å; F133-M165 HydrophobicContact CD2-CE 4.19Å; F133-M165 HydrophobicContact CD2-CG 4.09Å; F133-M165 HydrophobicContact CE1-CB 3.95Å; F133-M165 HydrophobicContact CE2-CB 3.65Å; F133-M165 HydrophobicContact CE2-CG 4.27Å; F133-M165 HydrophobicContact CG-CB 4.07Å; F133-M165 HydrophobicContact CG-CE 3.64Å; F133-M165 HydrophobicContact CG-CG 4.38Å; F133-M165 HydrophobicContact CZ-CB 3.71Å; P161-M165 WeakPolarHBondContact O-CB 3.14Å; P161-M165 VanDerWaalsContact O-CG 3.31Å; P161-M165 WeakPolarHBondContact O-CG 3.24Å; P161-M165 PolarHBondContact O-N 3.45Å; E163-M165 VanDerWaalsContact C-N 3.32Å; E163-M165 PolarHBondContact O-N 3.08Å; M165-K167 VanDerWaalsContact C-N 3.3Å; M165-K167 PolarHBondContact O-N 3.27Å; M165-A168 PolarHBondContact O-N 3.12Å; M165-E169 VanDerWaalsContact O-CB 3.25Å; M165-E169 WeakPolarHBondContact O-CB 3.42Å; M165-E169 PolarHBondContact O-N 3.12Å
166	K	86.5	Confident	81	Confident	97 Å²	97	59.2 Å²	59.2	42%	0.422	31%	0.311	S	S	.	.	H	α-helix	trans	-64	-36	174.6	-76.4	175.9	180	175.4	0	112.3	F133 V162 E163 K170	F133-K166 HydrophobicContact CE1-CG 4.44Å; F133-K166 HydrophobicContact CZ-CG 4.21Å; V162-K166 HydrophobicContact CG1-CD 4.28Å; V162-K166 WeakPolarHBondContact O-CB 3.27Å; V162-K166 VanDerWaalsContact O-CG 3.31Å; V162-K166 WeakPolarHBondContact O-CG 3.47Å; V162-K166 PolarHBondContact O-N 3.04Å; E163-K166 PolarHBondContact O-N 3.33Å; K166-K170 WeakPolarHBondContact O-CG 3.49Å; K166-K170 PolarHBondContact O-N 2.99Å
167	K	88	Confident	83.2	Confident	123 Å²	123	57.6 Å²	57.6	54%	0.535	30%	0.295	S	S	.	.	H	α-helix	trans	-67.6	-47.9	175	-175.5	-177.9	175.2	-172.4	0	110.5	E163 A164 M165 E169 K170 E171	E163-K167 WeakPolarHBondContact O-CB 3.37Å; E163-K167 PolarHBondContact O-N 3.43Å; A164-K167 PolarHBondContact O-N 3.15Å; M165-K167 VanDerWaalsContact C-N 3.3Å; M165-K167 PolarHBondContact O-N 3.27Å; K167-E169 VanDerWaalsContact C-N 3.34Å; K167-E169 PolarHBondContact O-N 2.65Å; K167-K170 PolarHBondContact O-N 3.36Å; K167-E171 WeakPolarHBondContact O-CB 3.43Å; K167-E171 PolarHBondContact O-N 3.46Å
168	A	87.8	Confident	85.3	Confident	16 Å²	16	53.8 Å²	53.8	13%	0.132	27%	0.269	C	S	.	.	H	α-helix	trans	-64.7	-36.3	177.8	0	0	0	0	0	112.5	V114 A164 M165 E171 L172	V114-A168 HydrophobicContact CG1-CB 3.6Å; A164-A168 WeakPolarHBondContact O-CB 3.49Å; A164-A168 PolarHBondContact O-N 3.05Å; M165-A168 PolarHBondContact O-N 3.12Å; A168-E171 PolarHBondContact O-N 3.45Å; A168-L172 WeakPolarHBondContact O-CB 3.43Å; A168-L172 PolarHBondContact O-N 3.26Å
169	E	89.4	Confident	87	Confident	31 Å²	31	52.9 Å²	52.9	15%	0.145	26%	0.256	C	S	.	.	H	α-helix	trans	-58	-49.4	172.3	-178.2	-151.9	147	0	0	110.9	V130 M165 K167 K173	V130-E169 HydrophobicContact CG1-CB 4.13Å; V130-E169 HydrophobicContact CG1-CG 3.88Å; M165-E169 VanDerWaalsContact O-CB 3.25Å; M165-E169 WeakPolarHBondContact O-CB 3.42Å; M165-E169 PolarHBondContact O-N 3.12Å; K167-E169 VanDerWaalsContact C-N 3.34Å; K167-E169 PolarHBondContact O-N 2.65Å; E169-K173 HydrophobicContact CG-CD 4.11Å; E169-K173 VanDerWaalsContact O-CB 3.3Å; E169-K173 WeakPolarHBondContact O-CB 3.41Å; E169-K173 WeakPolarHBondContact O-CG 3.22Å; E169-K173 PolarHBondContact O-N 3.29Å; E169-K173 WeakPolarHBondContact OE1-CE 3.46Å; E169-K173 IonicContact OE1-NZ 3.32Å; E169-K173 PolarHBondContact OE1-NZ 3Å
170	K	90.6	Very high	88.4	Confident	152 Å²	152	48.8 Å²	48.8	66%	0.661	24%	0.236	S	C	*	.	H	α-helix	trans	-63.9	-42.9	178.1	-73.1	176.7	-178.2	179.1	0	112.2	K166 K167 Q174	K166-K170 WeakPolarHBondContact O-CG 3.49Å; K166-K170 PolarHBondContact O-N 2.99Å; K167-K170 PolarHBondContact O-N 3.36Å; K170-Q174 PolarHBondContact O-N 3Å; K170-Q174 VanDerWaalsContact O-N 3.09Å
171	E	91.7	Very high	89.3	Confident	102 Å²	102	51.5 Å²	51.5	48%	0.477	25%	0.25	S	S	.	.	H	α-helix	trans	-64	-48.1	178.6	-171.1	175.4	170.8	0	0	111.2	M118 K167 A168 K173 Q174 I175	M118-E171 HydrophobicContact CE-CB 4.18Å; M118-E171 HydrophobicContact CE-CG 3.77Å; K167-E171 WeakPolarHBondContact O-CB 3.43Å; K167-E171 PolarHBondContact O-N 3.46Å; A168-E171 PolarHBondContact O-N 3.45Å; E171-K173 PolarHBondContact O-N 3.08Å; E171-Q174 PolarHBondContact O-N 2.92Å; E171-I175 HydrophobicContact CG-CD1 3.91Å; E171-I175 VanDerWaalsContact O-CG1 3.29Å; E171-I175 WeakPolarHBondContact O-CG1 3.33Å; E171-I175 PolarHBondContact O-N 2.99Å
172	L	92.1	Very high	90.1	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-63.4	-41.8	177.5	-179	61.9	0	0	0	112	M118 Y123 A126 A127 V130 A168 Q174 I175 V176 L202	M118-L172 HydrophobicContact CE-CB 4.39Å; M118-L172 HydrophobicContact SD-CB 4.07Å; M118-L172 HydrophobicContact SD-CD1 3.8Å; M118-L172 HydrophobicContact SD-CG 4.41Å; Y123-L172 HydrophobicContact CD1-CD1 3.83Å; Y123-L172 HydrophobicContact CG-CD1 4.48Å; A126-L172 HydrophobicContact CB-CD1 4.09Å; A126-L172 HydrophobicContact CB-CD2 3.84Å; A127-L172 HydrophobicContact CB-CD2 4.21Å; V130-L172 HydrophobicContact CB-CD2 4.26Å; V130-L172 HydrophobicContact CG2-CD2 3.8Å; A168-L172 WeakPolarHBondContact O-CB 3.43Å; A168-L172 PolarHBondContact O-N 3.26Å; L172-Q174 VanDerWaalsContact C-N 3.3Å; L172-Q174 PolarHBondContact O-N 3.3Å; L172-I175 PolarHBondContact O-N 3.22Å; L172-V176 HydrophobicContact CD1-CG2 3.99Å; L172-V176 HydrophobicContact CG-CG2 4.32Å; L172-V176 WeakPolarHBondContact O-CB 3.48Å; L172-V176 VanDerWaalsContact O-CG2 3.31Å; L172-V176 WeakPolarHBondContact O-CG2 3.44Å; L172-V176 PolarHBondContact O-N 3.45Å; L172-L202 HydrophobicContact CD2-CD1 4.45Å; L172-L202 HydrophobicContact CD2-CD2 3.7Å; L172-L202 HydrophobicContact CG-CD1 4.16Å; L172-L202 HydrophobicContact CG-CD2 4.24Å
173	K	92.6	Very high	90.7	Very high	32 Å²	32	52.6 Å²	52.6	14%	0.139	25%	0.253	C	S	.	.	H	α-helix	trans	-56.2	-45.5	174	-79.9	174	173	-175.2	0	111.5	E169 E171 V177 L202 Q204	E169-K173 HydrophobicContact CG-CD 4.11Å; E169-K173 VanDerWaalsContact O-CB 3.3Å; E169-K173 WeakPolarHBondContact O-CB 3.41Å; E169-K173 WeakPolarHBondContact O-CG 3.22Å; E169-K173 PolarHBondContact O-N 3.29Å; E169-K173 WeakPolarHBondContact OE1-CE 3.46Å; E169-K173 IonicContact OE1-NZ 3.32Å; E169-K173 PolarHBondContact OE1-NZ 3Å; E171-K173 PolarHBondContact O-N 3.08Å; K173-V177 WeakPolarHBondContact O-CG2 3.5Å; K173-V177 PolarHBondContact O-N 3.36Å; K173-L202 WeakPolarHBondContact CE-O 3.38Å; K173-L202 HydrophobicContact CG-CB 4.13Å; K173-L202 HydrophobicContact CG-CD1 4.2Å; K173-L202 PolarHBondContact NZ-O 2.7Å; K173-L202 VanDerWaalsContact NZ-O 3.17Å; K173-Q204 HydrophobicContact CD-CG 4.3Å; K173-Q204 HydrophobicContact CG-CG 4.4Å
174	Q	93.1	Very high	91.2	Very high	106 Å²	106	49.5 Å²	49.5	50%	0.495	24%	0.241	S	C	.	.	H	α-helix	trans	-67.1	-45.5	178.2	-172.3	58.4	48.3	0	0	111.6	K170 E171 L172 V176 V177 D178	K170-Q174 PolarHBondContact O-N 3Å; K170-Q174 VanDerWaalsContact O-N 3.09Å; E171-Q174 PolarHBondContact O-N 2.92Å; L172-Q174 VanDerWaalsContact C-N 3.3Å; L172-Q174 PolarHBondContact O-N 3.3Å; Q174-V176 PolarHBondContact O-N 3.26Å; Q174-V177 WeakPolarHBondContact O-CB 3.44Å; Q174-V177 PolarHBondContact O-N 2.67Å; Q174-D178 PolarHBondContact NE2-OD1 3.24Å; Q174-D178 PolarHBondContact NE2-OD2 2.63Å; Q174-D178 VanDerWaalsContact O-CG 3.28Å; Q174-D178 PolarHBondContact O-N 3.33Å
175	I	92.3	Very high	91.6	Very high	36 Å²	36	56.4 Å²	56.4	19%	0.185	27%	0.269	C	S	.	.	H	α-helix	trans	-62.1	-42.3	179.2	-67.4	166.8	0	0	0	111.4	M118 Y123 E171 L172 V177 D178 K179	M118-I175 HydrophobicContact CE-CD1 3.62Å; Y123-I175 HydrophobicContact CD1-CG2 4.02Å; Y123-I175 HydrophobicContact CE1-CB 4.5Å; Y123-I175 HydrophobicContact CE1-CD1 4.43Å; Y123-I175 HydrophobicContact CE1-CG2 3.44Å; Y123-I175 VanDerWaalsContact CE1-CG2 3.44Å; Y123-I175 HydrophobicContact CE2-CG2 4.42Å; E171-I175 HydrophobicContact CG-CD1 3.91Å; E171-I175 VanDerWaalsContact O-CG1 3.29Å; E171-I175 WeakPolarHBondContact O-CG1 3.33Å; E171-I175 PolarHBondContact O-N 2.99Å; L172-I175 PolarHBondContact O-N 3.22Å; I175-V177 VanDerWaalsContact C-N 3.31Å; I175-V177 PolarHBondContact O-N 2.69Å; I175-D178 PolarHBondContact O-N 3.48Å; I175-K179 HydrophobicContact CG2-CG 3.88Å; I175-K179 VanDerWaalsContact O-CB 3.27Å; I175-K179 WeakPolarHBondContact O-CB 3.11Å; I175-K179 VanDerWaalsContact O-CG 3.24Å; I175-K179 WeakPolarHBondContact O-CG 3.36Å; I175-K179 PolarHBondContact O-N 2.95Å
176	V	93	Very high	91.9	Very high	0 Å²	0	64.5 Å²	64.5	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-62.7	-40.2	177.7	169.1	0	0	0	0	110.9	L172 Q174 F180 L198 F199 L202	L172-V176 HydrophobicContact CD1-CG2 3.99Å; L172-V176 HydrophobicContact CG-CG2 4.32Å; L172-V176 WeakPolarHBondContact O-CB 3.48Å; L172-V176 VanDerWaalsContact O-CG2 3.31Å; L172-V176 WeakPolarHBondContact O-CG2 3.44Å; L172-V176 PolarHBondContact O-N 3.45Å; Q174-V176 PolarHBondContact O-N 3.26Å; V176-F180 WeakPolarHBondContact O-CB 3.47Å; V176-F180 PolarHBondContact O-N 2.72Å; V176-L198 HydrophobicContact CG1-CB 4.3Å; V176-L198 HydrophobicContact CG2-CD1 4.3Å; V176-F199 HydrophobicContact CG1-CD2 4.39Å; V176-F199 HydrophobicContact CG1-CE1 4.28Å; V176-F199 HydrophobicContact CG1-CE2 4.12Å; V176-F199 HydrophobicContact CG1-CZ 4.06Å; V176-L202 HydrophobicContact CB-CD1 4.22Å; V176-L202 HydrophobicContact CG1-CD1 4.49Å; V176-L202 HydrophobicContact CG2-CD1 3.9Å
177	V	93.8	Very high	92	Very high	21 Å²	21	64.1 Å²	64.1	13%	0.127	30%	0.302	C	S	.	.	H	α-helix	trans	-62	-50	173.7	164.7	0	0	0	0	111.3	K173 Q174 I175 F180 D181 F199	K173-V177 WeakPolarHBondContact O-CG2 3.5Å; K173-V177 PolarHBondContact O-N 3.36Å; Q174-V177 WeakPolarHBondContact O-CB 3.44Å; Q174-V177 PolarHBondContact O-N 2.67Å; I175-V177 VanDerWaalsContact C-N 3.31Å; I175-V177 PolarHBondContact O-N 2.69Å; V177-F180 PolarHBondContact O-N 3.38Å; V177-D181 VanDerWaalsContact O-CG 3.31Å; V177-D181 PolarHBondContact O-N 2.95Å; V177-F199 HydrophobicContact CG2-CE1 3.85Å; V177-F199 HydrophobicContact CG2-CZ 4.3Å
178	D	94.1	Very high	92.2	Very high	70 Å²	70	61.2 Å²	61.2	37%	0.374	29%	0.292	S	S	.	.	H	α-helix	trans	-66	-42.6	-176.8	-64.9	-22.3	0	0	0	111.4	Q174 I175 D181 E182	Q174-D178 PolarHBondContact NE2-OD1 3.24Å; Q174-D178 PolarHBondContact NE2-OD2 2.63Å; Q174-D178 VanDerWaalsContact O-CG 3.28Å; Q174-D178 PolarHBondContact O-N 3.33Å; I175-D178 PolarHBondContact O-N 3.48Å; D178-D181 PolarHBondContact O-N 2.89Å; D178-E182 WeakPolarHBondContact O-CB 3.46Å; D178-E182 WeakPolarHBondContact O-CG 3.47Å; D178-E182 PolarHBondContact O-N 3.18Å
179	K	92	Very high	92.2	Very high	62 Å²	62	64.5 Å²	64.5	27%	0.27	31%	0.307	S	S	.	.	H	α-helix	trans	-68.4	-34.5	176.7	-68.9	-67.2	170.6	-156	0	112.8	I175 E182 A183 F195	I175-K179 HydrophobicContact CG2-CG 3.88Å; I175-K179 VanDerWaalsContact O-CB 3.27Å; I175-K179 WeakPolarHBondContact O-CB 3.11Å; I175-K179 VanDerWaalsContact O-CG 3.24Å; I175-K179 WeakPolarHBondContact O-CG 3.36Å; I175-K179 PolarHBondContact O-N 2.95Å; K179-E182 IonicContact NZ-OE1 2.59Å; K179-E182 PolarHBondContact NZ-OE1 2.96Å; K179-E182 IonicContact NZ-OE2 3.54Å; K179-E182 PolarHBondContact NZ-OE2 3.32Å; K179-E182 VanDerWaalsContact NZ-OE2 3.09Å; K179-A183 VanDerWaalsContact O-CB 3.31Å; K179-A183 WeakPolarHBondContact O-CB 3.38Å; K179-A183 PolarHBondContact O-N 3Å; K179-F195 HydrophobicContact CB-CD1 4.24Å; K179-F195 HydrophobicContact CB-CD2 4.22Å; K179-F195 HydrophobicContact CB-CE1 3.83Å; K179-F195 HydrophobicContact CB-CE2 3.82Å; K179-F195 HydrophobicContact CB-CG 4.44Å; K179-F195 HydrophobicContact CB-CZ 3.62Å; K179-F195 HydrophobicContact CG-CE1 4.41Å; K179-F195 HydrophobicContact CG-CZ 4.19Å
180	F	93.8	Very high	92.3	Very high	1 Å²	1	66.3 Å²	66.3	0%	0.004	33%	0.327	C	S	.	.	H	α-helix	trans	-64.1	-45.8	171.6	-175.8	-86.7	0	0	0	110.8	V176 V177 A183 V184 I192 F195 F196 F199 K211 F212	V176-F180 WeakPolarHBondContact O-CB 3.47Å; V176-F180 PolarHBondContact O-N 2.72Å; V177-F180 PolarHBondContact O-N 3.38Å; F180-A183 PolarHBondContact O-N 3.11Å; F180-V184 HydrophobicContact CD1-CG2 3.93Å; F180-V184 HydrophobicContact CE1-CG2 3.5Å; F180-V184 VanDerWaalsContact CE1-CG2 3.5Å; F180-V184 HydrophobicContact CZ-CG2 4.02Å; F180-V184 WeakPolarHBondContact O-CG2 3.31Å; F180-V184 PolarHBondContact O-N 3.35Å; F180-I192 HydrophobicContact CE2-CG2 3.74Å; F180-I192 HydrophobicContact CZ-CG2 3.95Å; F180-F195 HydrophobicContact CB-CB 4.19Å; F180-F195 HydrophobicContact CD2-CB 3.95Å; F180-F196 HydrophobicContact CE2-CB 4.12Å; F180-F199 HydrophobicContact CB-CE2 4.18Å; F180-F199 HydrophobicContact CB-CZ 4.16Å; F180-F199 AromaticContact CD2-CE2 3.78Å; F180-F199 HydrophobicContact CD2-CE2 3.78Å; F180-F199 HydrophobicContact CD2-CZ 4.49Å; F180-F199 HydrophobicContact CE2-CE2 4.34Å; F180-F199 AromaticContact CG-CE2 3.93Å; F180-F199 HydrophobicContact CG-CE2 3.93Å; F180-F199 HydrophobicContact CG-CZ 4.19Å; F180-K211 HydrophobicContact CD1-CB 4.07Å; F180-K211 HydrophobicContact CD1-CD 4.21Å; F180-K211 HydrophobicContact CE1-CB 3.63Å; F180-K211 HydrophobicContact CZ-CB 4.36Å; F180-F212 HydrophobicContact CZ-CB 4.05Å; F180-F212 HydrophobicContact CZ-CD2 4.2Å
181	D	94.4	Very high	92.3	Very high	65 Å²	65	60.4 Å²	60.4	35%	0.348	31%	0.305	S	S	.	.	H	α-helix	trans	-66.2	-39.4	179.1	-69.4	-15.3	0	0	0	111.7	V177 D178 A183 V184 Q185 K211	V177-D181 VanDerWaalsContact O-CG 3.31Å; V177-D181 PolarHBondContact O-N 2.95Å; D178-D181 PolarHBondContact O-N 2.89Å; D181-A183 VanDerWaalsContact C-N 3.34Å; D181-A183 PolarHBondContact O-N 3.22Å; D181-V184 PolarHBondContact O-N 3.24Å; D181-Q185 PolarHBondContact O-N 3.29Å; D181-K211 IonicContact OD1-NZ 2.64Å; D181-K211 PolarHBondContact OD1-NZ 3.23Å; D181-K211 IonicContact OD2-NZ 3.52Å; D181-K211 PolarHBondContact OD2-NZ 2.97Å
182	E	94.3	Very high	92.2	Very high	60 Å²	60	55.6 Å²	55.6	28%	0.28	28%	0.282	S	S	.	.	H	α-helix	trans	-59.1	-42.9	170.1	-77.3	179.2	-154.5	0	0	111.9	D178 K179 Q185 R186	D178-E182 WeakPolarHBondContact O-CB 3.46Å; D178-E182 WeakPolarHBondContact O-CG 3.47Å; D178-E182 PolarHBondContact O-N 3.18Å; K179-E182 IonicContact NZ-OE1 2.59Å; K179-E182 PolarHBondContact NZ-OE1 2.96Å; K179-E182 IonicContact NZ-OE2 3.54Å; K179-E182 PolarHBondContact NZ-OE2 3.32Å; K179-E182 VanDerWaalsContact NZ-OE2 3.09Å; E182-Q185 PolarHBondContact O-N 3.19Å; E182-R186 WeakPolarHBondContact O-CG 3.46Å; E182-R186 PolarHBondContact O-N 2.94Å; E182-R186 VanDerWaalsContact O-N 3.11Å; E182-R186 IonicContact OE2-CZ 2.67Å; E182-R186 IonicContact OE2-NH2 2.62Å; E182-R186 PolarHBondContact OE2-NH2 3.49Å
183	A	92.7	Very high	92.1	Very high	6 Å²	6	58 Å²	58	5%	0.05	29%	0.294	C	S	.	.	H	α-helix	trans	-67.8	-39.4	179.4	0	0	0	0	0	111.9	K179 F180 D181 Q185 R186 D187 D188 I192	K179-A183 VanDerWaalsContact O-CB 3.31Å; K179-A183 WeakPolarHBondContact O-CB 3.38Å; K179-A183 PolarHBondContact O-N 3Å; F180-A183 PolarHBondContact O-N 3.11Å; D181-A183 VanDerWaalsContact C-N 3.34Å; D181-A183 PolarHBondContact O-N 3.22Å; A183-Q185 VanDerWaalsContact C-N 3.35Å; A183-R186 PolarHBondContact O-N 2.76Å; A183-D187 PolarHBondContact O-N 2.93Å; A183-D187 VanDerWaalsContact O-N 3.1Å; A183-D188 PolarHBondContact O-N 3.38Å; A183-I192 HydrophobicContact CB-CG1 3.85Å
184	V	92.5	Very high	92.1	Very high	33 Å²	33	61 Å²	61	20%	0.2	30%	0.304	C	S	.	.	H	α-helix	trans	-60.8	-43.8	172.3	167	0	0	0	0	110.9	F180 D181 R186 D187 I192 Y215	F180-V184 HydrophobicContact CD1-CG2 3.93Å; F180-V184 HydrophobicContact CE1-CG2 3.5Å; F180-V184 VanDerWaalsContact CE1-CG2 3.5Å; F180-V184 HydrophobicContact CZ-CG2 4.02Å; F180-V184 WeakPolarHBondContact O-CG2 3.31Å; F180-V184 PolarHBondContact O-N 3.35Å; D181-V184 PolarHBondContact O-N 3.24Å; V184-R186 VanDerWaalsContact C-N 3.28Å; V184-R186 PolarHBondContact O-N 3.32Å; V184-D187 PolarHBondContact O-N 2.97Å; V184-D187 VanDerWaalsContact O-N 3.16Å; V184-I192 HydrophobicContact CG2-CD1 4.14Å; V184-I192 HydrophobicContact CG2-CG1 4.09Å; V184-Y215 HydrophobicContact CG1-CD2 3.97Å; V184-Y215 HydrophobicContact CG2-CD2 4.21Å; V184-Y215 HydrophobicContact CG2-CG 4.3Å
185	Q	92.4	Very high	92	Very high	170 Å²	170	56.4 Å²	56.4	79%	0.794	28%	0.282	S	S	*	.	H	α-helix	trans	-63.8	-33	178.3	-168.9	-178.3	20.2	0	0	112.7	D181 E182 A183 D187	D181-Q185 PolarHBondContact O-N 3.29Å; E182-Q185 PolarHBondContact O-N 3.19Å; A183-Q185 VanDerWaalsContact C-N 3.35Å; Q185-D187 VanDerWaalsContact C-N 3.35Å
186	R	92.6	Very high	92	Very high	172 Å²	172	54.7 Å²	54.7	65%	0.649	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-2	177.7	-63.6	177	-151.6	166.9	12.1	113.8	E182 A183 V184 D188	E182-R186 WeakPolarHBondContact O-CG 3.46Å; E182-R186 PolarHBondContact O-N 2.94Å; E182-R186 VanDerWaalsContact O-N 3.11Å; E182-R186 IonicContact OE2-CZ 2.67Å; E182-R186 IonicContact OE2-NH2 2.62Å; E182-R186 PolarHBondContact OE2-NH2 3.49Å; A183-R186 PolarHBondContact O-N 2.76Å; V184-R186 VanDerWaalsContact C-N 3.28Å; V184-R186 PolarHBondContact O-N 3.32Å; R186-D188 PolarHBondContact O-N 3.07Å
187	D	88.7	Confident	92	Very high	88 Å²	88	57.8 Å²	57.8	47%	0.471	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.3	35.2	-169.9	-161.7	32.4	0	0	0	113.3	A183 V184 Q185 I189 Y215	A183-D187 PolarHBondContact O-N 2.93Å; A183-D187 VanDerWaalsContact O-N 3.1Å; V184-D187 PolarHBondContact O-N 2.97Å; V184-D187 VanDerWaalsContact O-N 3.16Å; Q185-D187 VanDerWaalsContact C-N 3.35Å; D187-I189 PolarHBondContact O-N 3.34Å; D187-I189 VanDerWaalsContact O-N 3.12Å; D187-Y215 WeakPolarHBondContact OD1-CE2 3.4Å; D187-Y215 PolarHBondContact OD1-OH 3.4Å
188	D	91.7	Very high	91.9	Very high	63 Å²	63	57 Å²	57	34%	0.337	28%	0.282	S	S	.	.			trans	-82.5	92.5	178	-180	0.2	0	0	0	110.2	A183 R186 A190 S191 I192	A183-D188 PolarHBondContact O-N 3.38Å; R186-D188 PolarHBondContact O-N 3.07Å; D188-A190 PolarHBondContact O-N 3.39Å; D188-A190 PolarHBondContact OD1-N 2.97Å; D188-S191 PolarHBondContact O-N 3.45Å; D188-S191 PolarHBondContact OD1-N 3.49Å; D188-S191 WeakPolarHBondContact OD2-CB 3.19Å; D188-S191 PolarHBondContact OD2-OG 2.98Å; D188-I192 WeakPolarHBondContact O-CB 3.31Å; D188-I192 WeakPolarHBondContact O-CG1 3.4Å; D188-I192 PolarHBondContact O-N 3.3Å
189	I	89.1	Confident	91.9	Very high	85 Å²	85	53.7 Å²	53.7	44%	0.436	26%	0.264	S	S	.	.	H	α-helix	trans	-54.4	-37.2	-179	-57	174.8	0	0	0	112	D187 Q193	D187-I189 PolarHBondContact O-N 3.34Å; D187-I189 VanDerWaalsContact O-N 3.12Å; I189-Q193 WeakPolarHBondContact O-CG 3.4Å; I189-Q193 PolarHBondContact O-N 3.02Å; I189-Q193 VanDerWaalsContact O-N 3.08Å
190	A	90.4	Very high	91.9	Very high	69 Å²	69	51.5 Å²	51.5	57%	0.57	26%	0.256	S	S	*	.	H	α-helix	trans	-70.5	-46.7	-177	0	0	0	0	0	111	D188 Q193 R194	D188-A190 PolarHBondContact O-N 3.39Å; D188-A190 PolarHBondContact OD1-N 2.97Å; A190-Q193 PolarHBondContact O-N 3.05Å; A190-R194 WeakPolarHBondContact O-CB 3.42Å; A190-R194 PolarHBondContact O-N 3.37Å
191	S	90.3	Very high	91.6	Very high	28 Å²	28	54 Å²	54	20%	0.196	27%	0.268	C	S	.	.	H	α-helix	trans	-65.9	-40.4	176.1	-67.4	0	0	0	0	112.1	D188 Q193 R194 F195	D188-S191 PolarHBondContact O-N 3.45Å; D188-S191 PolarHBondContact OD1-N 3.49Å; D188-S191 WeakPolarHBondContact OD2-CB 3.19Å; D188-S191 PolarHBondContact OD2-OG 2.98Å; S191-Q193 VanDerWaalsContact C-N 3.35Å; S191-Q193 PolarHBondContact O-N 2.64Å; S191-R194 WeakPolarHBondContact O-CB 3.34Å; S191-R194 PolarHBondContact O-N 3.07Å; S191-F195 WeakPolarHBondContact O-CD2 3.25Å; S191-F195 PolarHBondContact O-N 2.89Å
192	I	91.5	Very high	91.4	Very high	1 Å²	1	51 Å²	51	1%	0.005	25%	0.252	C	S	.	.	H	α-helix	trans	-56.8	-49.2	175.1	-67.8	166	0	0	0	110.2	F180 A183 V184 D188 R194 F196 F212 Y215	F180-I192 HydrophobicContact CE2-CG2 3.74Å; F180-I192 HydrophobicContact CZ-CG2 3.95Å; A183-I192 HydrophobicContact CB-CG1 3.85Å; V184-I192 HydrophobicContact CG2-CD1 4.14Å; V184-I192 HydrophobicContact CG2-CG1 4.09Å; D188-I192 WeakPolarHBondContact O-CB 3.31Å; D188-I192 WeakPolarHBondContact O-CG1 3.4Å; D188-I192 PolarHBondContact O-N 3.3Å; I192-R194 PolarHBondContact O-N 3.4Å; I192-F196 WeakPolarHBondContact O-CB 3.48Å; I192-F196 PolarHBondContact O-N 2.76Å; I192-F212 HydrophobicContact CG2-CD2 3.75Å; I192-F212 HydrophobicContact CG2-CE2 3.73Å; I192-Y215 HydrophobicContact CD1-CD1 4.4Å; I192-Y215 HydrophobicContact CD1-CD2 4.18Å; I192-Y215 HydrophobicContact CD1-CE1 4.03Å; I192-Y215 HydrophobicContact CD1-CE2 3.76Å; I192-Y215 HydrophobicContact CD1-CG 4.47Å; I192-Y215 HydrophobicContact CG2-CD1 4.38Å
193	Q	89.2	Confident	91.1	Very high	50 Å²	50	54.2 Å²	54.2	23%	0.234	27%	0.267	C	S	.	.	H	α-helix	trans	-66.5	-37	178.5	-73.1	-175.8	14.5	0	0	113	I189 A190 S191 K197	I189-Q193 WeakPolarHBondContact O-CG 3.4Å; I189-Q193 PolarHBondContact O-N 3.02Å; I189-Q193 VanDerWaalsContact O-N 3.08Å; A190-Q193 PolarHBondContact O-N 3.05Å; S191-Q193 VanDerWaalsContact C-N 3.35Å; S191-Q193 PolarHBondContact O-N 2.64Å; Q193-K197 VanDerWaalsContact O-CG 3.3Å; Q193-K197 WeakPolarHBondContact O-CG 3.33Å; Q193-K197 PolarHBondContact O-N 2.92Å
194	R	91.6	Very high	91	Very high	94 Å²	94	55.5 Å²	55.5	36%	0.355	27%	0.272	S	S	.	.	H	α-helix	trans	-59.7	-55.6	176.5	-179.2	-173.8	170.5	-162.4	0	110.6	E124 A190 S191 I192 K197	E124-R194 WeakPolarHBondContact OE1-CD 3.39Å; E124-R194 WeakPolarHBondContact OE1-CG 3.18Å; E124-R194 IonicContact OE1-CZ 3.59Å; E124-R194 IonicContact OE1-NE 3.37Å; E124-R194 PolarHBondContact OE1-NE 3.09Å; E124-R194 IonicContact OE1-NH2 3.66Å; E124-R194 PolarHBondContact OE1-NH2 3.13Å; E124-R194 IonicContact OE2-CZ 2.9Å; E124-R194 IonicContact OE2-NE 3.62Å; E124-R194 PolarHBondContact OE2-NE 2.74Å; E124-R194 IonicContact OE2-NH2 2.7Å; E124-R194 PolarHBondContact OE2-NH2 3.48Å; A190-R194 WeakPolarHBondContact O-CB 3.42Å; A190-R194 PolarHBondContact O-N 3.37Å; S191-R194 WeakPolarHBondContact O-CB 3.34Å; S191-R194 PolarHBondContact O-N 3.07Å; I192-R194 PolarHBondContact O-N 3.4Å; R194-K197 PolarHBondContact O-N 3.44Å
195	F	91.6	Very high	90.9	Very high	10 Å²	10	57 Å²	57	4%	0.044	28%	0.277	C	S	.	.	H	α-helix	trans	-70.3	-31.9	179.7	-67.1	-64.1	0	0	0	112.6	Y123 K179 F180 S191 K197 L198 F199	Y123-F195 AromaticContact CD2-CE1 3.8Å; Y123-F195 HydrophobicContact CD2-CE1 3.8Å; Y123-F195 HydrophobicContact CD2-CZ 4.22Å; Y123-F195 HydrophobicContact CG-CE1 4.39Å; K179-F195 HydrophobicContact CB-CD1 4.24Å; K179-F195 HydrophobicContact CB-CD2 4.22Å; K179-F195 HydrophobicContact CB-CE1 3.83Å; K179-F195 HydrophobicContact CB-CE2 3.82Å; K179-F195 HydrophobicContact CB-CG 4.44Å; K179-F195 HydrophobicContact CB-CZ 3.62Å; K179-F195 HydrophobicContact CG-CE1 4.41Å; K179-F195 HydrophobicContact CG-CZ 4.19Å; F180-F195 HydrophobicContact CB-CB 4.19Å; F180-F195 HydrophobicContact CD2-CB 3.95Å; S191-F195 WeakPolarHBondContact O-CD2 3.25Å; S191-F195 PolarHBondContact O-N 2.89Å; F195-K197 PolarHBondContact O-N 3.47Å; F195-L198 HydrophobicContact CD1-CD1 4.05Å; F195-L198 WeakPolarHBondContact O-CB 3.46Å; F195-L198 PolarHBondContact O-N 2.62Å; F195-F199 WeakPolarHBondContact O-CD2 3.31Å
196	F	93	Very high	90.9	Very high	1 Å²	1	53.5 Å²	53.5	0%	0.004	26%	0.264	C	S	.	.	H	α-helix	trans	-57.4	-35.9	174	-177.9	-118.3	0	0	0	112.3	F180 I192 L198 F212 I266 V267 Y271	F180-F196 HydrophobicContact CE2-CB 4.12Å; I192-F196 WeakPolarHBondContact O-CB 3.48Å; I192-F196 PolarHBondContact O-N 2.76Å; F196-L198 PolarHBondContact O-N 2.84Å; F196-F212 HydrophobicContact CD1-CD1 4.26Å; F196-F212 HydrophobicContact CD1-CE1 4.38Å; F196-F212 HydrophobicContact CD1-CG 4.47Å; F196-F212 HydrophobicContact CD2-CB 3.43Å; F196-F212 VanDerWaalsContact CD2-CB 3.43Å; F196-F212 HydrophobicContact CD2-CD1 4.01Å; F196-F212 HydrophobicContact CD2-CD2 4.26Å; F196-F212 AromaticContact CD2-CG 3.66Å; F196-F212 HydrophobicContact CD2-CG 3.66Å; F196-F212 AromaticContact CE1-CD1 3.87Å; F196-F212 HydrophobicContact CE1-CD1 3.87Å; F196-F212 HydrophobicContact CE1-CE1 4.06Å; F196-F212 HydrophobicContact CE1-CG 4.45Å; F196-F212 HydrophobicContact CE2-CB 3.35Å; F196-F212 AromaticContact CE2-CD1 3.6Å; F196-F212 HydrophobicContact CE2-CD1 3.6Å; F196-F212 AromaticContact CE2-CG 3.63Å; F196-F212 HydrophobicContact CE2-CG 3.63Å; F196-F212 HydrophobicContact CG-CB 4.33Å; F196-F212 HydrophobicContact CG-CD1 4.33Å; F196-F212 HydrophobicContact CG-CD2 4.37Å; F196-F212 HydrophobicContact CG-CG 4.1Å; F196-F212 HydrophobicContact CZ-CB 4.19Å; F196-F212 AromaticContact CZ-CD1 3.52Å; F196-F212 HydrophobicContact CZ-CD1 3.52Å; F196-F212 HydrophobicContact CZ-CE1 4.16Å; F196-F212 HydrophobicContact CZ-CG 4.05Å; F196-I266 HydrophobicContact CD1-CG2 4.31Å; F196-I266 HydrophobicContact CE1-CG2 4.36Å; F196-V267 HydrophobicContact CE1-CG2 4.18Å; F196-V267 HydrophobicContact CZ-CG2 4.22Å; F196-Y271 AromaticContact CD1-CE2 3.9Å; F196-Y271 HydrophobicContact CD1-CE2 3.9Å; F196-Y271 HydrophobicContact CD2-CE2 4.04Å; F196-Y271 AromaticContact CD2-CZ 3.81Å; F196-Y271 WeakPolarHBondContact CD2-OH 3.41Å; F196-Y271 HydrophobicContact CE1-CD2 4.04Å; F196-Y271 AromaticContact CE1-CE2 3.42Å; F196-Y271 HydrophobicContact CE1-CE2 3.42Å; F196-Y271 VanDerWaalsContact CE1-CE2 3.42Å; F196-Y271 HydrophobicContact CE2-CE1 4.21Å; F196-Y271 AromaticContact CE2-CE2 3.57Å; F196-Y271 HydrophobicContact CE2-CE2 3.57Å; F196-Y271 AromaticContact CE2-CZ 3.34Å; F196-Y271 WeakPolarHBondContact CE2-OH 3.42Å; F196-Y271 HydrophobicContact CG-CE2 4.19Å; F196-Y271 AromaticContact CZ-CD2 3.88Å; F196-Y271 HydrophobicContact CZ-CD2 3.88Å; F196-Y271 HydrophobicContact CZ-CE1 4.38Å; F196-Y271 AromaticContact CZ-CE2 3.23Å; F196-Y271 HydrophobicContact CZ-CE2 3.23Å; F196-Y271 AromaticContact CZ-CZ 3.51Å; F196-Y271 WeakPolarHBondContact O-CE2 3.27Å; F196-Y271 PolarHBondContact O-OH 3.06Å
197	K	92.5	Very high	90.8	Very high	64 Å²	64	48.8 Å²	48.8	28%	0.278	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-15.6	177.5	-68.7	167.5	-177.7	-176.3	0	113.8	Q193 R194 F195 P200 I266 Y270	Q193-K197 VanDerWaalsContact O-CG 3.3Å; Q193-K197 WeakPolarHBondContact O-CG 3.33Å; Q193-K197 PolarHBondContact O-N 2.92Å; R194-K197 PolarHBondContact O-N 3.44Å; F195-K197 PolarHBondContact O-N 3.47Å; K197-P200 WeakPolarHBondContact O-CD 3.41Å; K197-I266 HydrophobicContact CG-CG2 4.44Å; K197-Y270 HydrophobicContact CB-CD1 4.04Å; K197-Y270 HydrophobicContact CB-CE1 4.04Å; K197-Y270 HydrophobicContact CB-CG 4.42Å; K197-Y270 HydrophobicContact CD-CE1 4.17Å; K197-Y270 HydrophobicContact CD-CE2 3.92Å; K197-Y270 HydrophobicContact CG-CD1 4.13Å; K197-Y270 HydrophobicContact CG-CD2 4.01Å; K197-Y270 HydrophobicContact CG-CE1 4.03Å; K197-Y270 HydrophobicContact CG-CE2 3.9Å; K197-Y270 HydrophobicContact CG-CG 4.13Å
198	L	92.6	Very high	91	Very high	5 Å²	5	44.6 Å²	44.6	3%	0.026	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88	-28.2	-176.3	-57.6	-173.8	0	0	0	113.3	E124 A127 V176 F195 F196 Q201 L202	E124-L198 HydrophobicContact CB-CD2 4.49Å; E124-L198 HydrophobicContact CG-CD2 4.08Å; A127-L198 HydrophobicContact CB-CB 4.47Å; A127-L198 HydrophobicContact CB-CD2 4Å; V176-L198 HydrophobicContact CG1-CB 4.3Å; V176-L198 HydrophobicContact CG2-CD1 4.3Å; F195-L198 HydrophobicContact CD1-CD1 4.05Å; F195-L198 WeakPolarHBondContact O-CB 3.46Å; F195-L198 PolarHBondContact O-N 2.62Å; F196-L198 PolarHBondContact O-N 2.84Å; L198-Q201 WeakPolarHBondContact O-CB 3.3Å; L198-Q201 PolarHBondContact O-N 2.94Å; L198-Q201 VanDerWaalsContact O-N 3.08Å; L198-L202 PolarHBondContact O-N 2.95Å
199	F	93.8	Very high	91.1	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-42.9	179.3	-75.3	-82.2	0	0	0	114.2	V176 V177 F180 F195 Q201 L202 E203 Q204 I207 K211 Y271	V176-F199 HydrophobicContact CG1-CD2 4.39Å; V176-F199 HydrophobicContact CG1-CE1 4.28Å; V176-F199 HydrophobicContact CG1-CE2 4.12Å; V176-F199 HydrophobicContact CG1-CZ 4.06Å; V177-F199 HydrophobicContact CG2-CE1 3.85Å; V177-F199 HydrophobicContact CG2-CZ 4.3Å; F180-F199 HydrophobicContact CB-CE2 4.18Å; F180-F199 HydrophobicContact CB-CZ 4.16Å; F180-F199 AromaticContact CD2-CE2 3.78Å; F180-F199 HydrophobicContact CD2-CE2 3.78Å; F180-F199 HydrophobicContact CD2-CZ 4.49Å; F180-F199 HydrophobicContact CE2-CE2 4.34Å; F180-F199 AromaticContact CG-CE2 3.93Å; F180-F199 HydrophobicContact CG-CE2 3.93Å; F180-F199 HydrophobicContact CG-CZ 4.19Å; F195-F199 WeakPolarHBondContact O-CD2 3.31Å; F199-Q201 VanDerWaalsContact C-N 3.33Å; F199-Q201 PolarHBondContact O-N 3.5Å; F199-L202 PolarHBondContact O-N 2.89Å; F199-E203 PolarHBondContact O-N 3.21Å; F199-Q204 HydrophobicContact CB-CB 4.5Å; F199-Q204 HydrophobicContact CD1-CB 3.94Å; F199-Q204 CarbonylContact O-C 3.52Å; F199-Q204 WeakPolarHBondContact O-CA 3.02Å; F199-Q204 PolarHBondContact O-N 3.46Å; F199-I207 HydrophobicContact CD1-CB 4.5Å; F199-I207 HydrophobicContact CD1-CG2 4.42Å; F199-I207 HydrophobicContact CE1-CG2 3.97Å; F199-K211 HydrophobicContact CZ-CD 4.22Å; F199-Y271 WeakPolarHBondContact CB-OH 3.16Å
200	P	91.1	Very high	91.3	Very high	16 Å²	16	41 Å²	41	10%	0.104	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-37.1	176.5	-24.4	36.1	0	0	0	113.8	K197 L202 E203 Q205 Y270 Y271	K197-P200 WeakPolarHBondContact O-CD 3.41Å; P200-L202 PolarHBondContact O-N 3.31Å; P200-E203 PolarHBondContact O-N 3.25Å; P200-E203 VanDerWaalsContact O-N 3.12Å; P200-Q205 HydrophobicContact CB-CG 3.87Å; P200-Q205 HydrophobicContact CG-CG 4.25Å; P200-Y270 WeakPolarHBondContact CB-O 3.31Å; P200-Y270 WeakPolarHBondContact CG-O 3.47Å; P200-Y271 HydrophobicContact CG-CD1 3.67Å; P200-Y271 HydrophobicContact CG-CD2 3.66Å; P200-Y271 HydrophobicContact CG-CE1 3.56Å; P200-Y271 HydrophobicContact CG-CE2 3.49Å; P200-Y271 VanDerWaalsContact CG-CE2 3.49Å; P200-Y271 HydrophobicContact CG-CG 3.75Å; P200-Y271 VanDerWaalsContact CG-CZ 3.47Å
201	Q	88.7	Confident	91.4	Very high	55 Å²	55	40.3 Å²	40.3	26%	0.257	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-27.3	178.3	-68.5	-174	-26.5	0	0	111.8	A127 H131 L198 F199	A127-Q201 HydrophobicContact CB-CB 4.33Å; A127-Q201 VanDerWaalsContact CB-OE1 3.31Å; H131-Q201 WeakPolarHBondContact CA-O 3.32Å; H131-Q201 HydrophobicContact CB-CB 4.05Å; H131-Q201 WeakPolarHBondContact CB-O 3.29Å; H131-Q201 PolarHBondContact ND1-O 3.21Å; H131-Q201 VanDerWaalsContact ND1-O 3.07Å; L198-Q201 WeakPolarHBondContact O-CB 3.3Å; L198-Q201 PolarHBondContact O-N 2.94Å; L198-Q201 VanDerWaalsContact O-N 3.08Å; F199-Q201 VanDerWaalsContact C-N 3.33Å; F199-Q201 PolarHBondContact O-N 3.5Å
202	L	90	Very high	91.6	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96	14	178.8	-55.8	178.1	0	0	0	113.4	A127 V130 L172 K173 V176 L198 F199 P200 Q204	A127-L202 HydrophobicContact CB-CD2 4.21Å; V130-L202 HydrophobicContact CB-CD2 4Å; V130-L202 HydrophobicContact CG1-CD2 3.65Å; L172-L202 HydrophobicContact CD2-CD1 4.45Å; L172-L202 HydrophobicContact CD2-CD2 3.7Å; L172-L202 HydrophobicContact CG-CD1 4.16Å; L172-L202 HydrophobicContact CG-CD2 4.24Å; K173-L202 WeakPolarHBondContact CE-O 3.38Å; K173-L202 HydrophobicContact CG-CB 4.13Å; K173-L202 HydrophobicContact CG-CD1 4.2Å; K173-L202 PolarHBondContact NZ-O 2.7Å; K173-L202 VanDerWaalsContact NZ-O 3.17Å; V176-L202 HydrophobicContact CB-CD1 4.22Å; V176-L202 HydrophobicContact CG1-CD1 4.49Å; V176-L202 HydrophobicContact CG2-CD1 3.9Å; L198-L202 PolarHBondContact O-N 2.95Å; F199-L202 PolarHBondContact O-N 2.89Å; P200-L202 PolarHBondContact O-N 3.31Å; L202-Q204 PolarHBondContact O-N 3.04Å; L202-Q204 VanDerWaalsContact O-N 3.15Å
203	E	88.3	Confident	91.7	Very high	129 Å²	129	39 Å²	39	60%	0.603	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.6	27.2	-174.2	-63.7	-178.7	159.2	0	0	113.6	L134 F199 P200	L134-E203 HydrophobicContact CD1-CB 4.48Å; L134-E203 HydrophobicContact CD1-CG 3.93Å; F199-E203 PolarHBondContact O-N 3.21Å; P200-E203 PolarHBondContact O-N 3.25Å; P200-E203 VanDerWaalsContact O-N 3.12Å
204	Q	90	Very high	92	Very high	33 Å²	33	39.4 Å²	39.4	15%	0.154	20%	0.202	C	C	.	.			trans	-111.7	37.2	179.5	-72	-169	-31.8	0	0	112.2	K173 F199 L202 D206 I207 G208	K173-Q204 HydrophobicContact CD-CG 4.3Å; K173-Q204 HydrophobicContact CG-CG 4.4Å; F199-Q204 HydrophobicContact CB-CB 4.5Å; F199-Q204 HydrophobicContact CD1-CB 3.94Å; F199-Q204 CarbonylContact O-C 3.52Å; F199-Q204 WeakPolarHBondContact O-CA 3.02Å; F199-Q204 PolarHBondContact O-N 3.46Å; L202-Q204 PolarHBondContact O-N 3.04Å; L202-Q204 VanDerWaalsContact O-N 3.15Å; Q204-D206 VanDerWaalsContact C-N 3.32Å; Q204-D206 PolarHBondContact O-N 3.25Å; Q204-I207 HydrophobicContact CB-CB 4.38Å; Q204-I207 HydrophobicContact CB-CD1 4.29Å; Q204-I207 HydrophobicContact CG-CD1 4.08Å; Q204-I207 PolarHBondContact O-N 3.42Å; Q204-G208 PolarHBondContact O-N 3.08Å
205	Q	90.8	Very high	92.1	Very high	64 Å²	64	35.7 Å²	35.7	30%	0.299	19%	0.188	S	C	.	.	H	α-helix	trans	-54.2	-45.2	-177.6	-68.3	-179.8	-24.6	0	0	112.7	P200 I207 G208 I209 Y271	P200-Q205 HydrophobicContact CB-CG 3.87Å; P200-Q205 HydrophobicContact CG-CG 4.25Å; Q205-I207 PolarHBondContact O-N 3.4Å; Q205-G208 PolarHBondContact O-N 2.91Å; Q205-I209 WeakPolarHBondContact O-CD1 3.09Å; Q205-I209 WeakPolarHBondContact O-CG1 3.07Å; Q205-I209 PolarHBondContact O-N 2.59Å; Q205-Y271 HydrophobicContact CB-CD1 3.9Å; Q205-Y271 HydrophobicContact CB-CE1 4.2Å; Q205-Y271 HydrophobicContact CG-CD1 4.08Å; Q205-Y271 PolarHBondContact NE2-O 3.24Å; Q205-Y271 WeakPolarHBondContact O-CE1 3.38Å
206	D	90.9	Very high	92.3	Very high	97 Å²	97	35.5 Å²	35.5	52%	0.519	19%	0.188	S	C	.	.	H	α-helix	trans	-66.9	-37.6	-177.5	-65.8	-43.2	0	0	0	112.7	Q204 S210 K275	Q204-D206 VanDerWaalsContact C-N 3.32Å; Q204-D206 PolarHBondContact O-N 3.25Å; D206-S210 WeakPolarHBondContact O-CB 3.49Å; D206-S210 PolarHBondContact O-N 3.06Å; D206-S210 PolarHBondContact O-OG 3.24Å; D206-K275 IonicContact OD1-NZ 3.55Å; D206-K275 PolarHBondContact OD1-NZ 3.2Å; D206-K275 IonicContact OD2-NZ 3.76Å
207	I	91.3	Very high	92.4	Very high	72 Å²	72	37.6 Å²	37.6	37%	0.369	20%	0.197	S	C	.	.	H	α-helix	trans	-67.4	-46.2	177	-59.9	174.2	0	0	0	109.5	F199 Q204 Q205 S210 K211	F199-I207 HydrophobicContact CD1-CB 4.5Å; F199-I207 HydrophobicContact CD1-CG2 4.42Å; F199-I207 HydrophobicContact CE1-CG2 3.97Å; Q204-I207 HydrophobicContact CB-CB 4.38Å; Q204-I207 HydrophobicContact CB-CD1 4.29Å; Q204-I207 HydrophobicContact CG-CD1 4.08Å; Q204-I207 PolarHBondContact O-N 3.42Å; Q205-I207 PolarHBondContact O-N 3.4Å; I207-S210 PolarHBondContact O-N 3.1Å; I207-K211 HydrophobicContact CG2-CD 4.1Å; I207-K211 HydrophobicContact CG2-CG 4.49Å; I207-K211 WeakPolarHBondContact O-CB 3.46Å; I207-K211 PolarHBondContact O-N 3.29Å
208	G	92.6	Very high	92.4	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-59.7	-49.5	179.4	0	0	0	0	0	112.6	Q204 Q205 S210 K211 F212	Q204-G208 PolarHBondContact O-N 3.08Å; Q205-G208 PolarHBondContact O-N 2.91Å; G208-S210 VanDerWaalsContact C-N 3.35Å; G208-S210 PolarHBondContact O-N 2.52Å; G208-K211 PolarHBondContact O-N 3.16Å; G208-F212 VanDerWaalsContact O-CB 3.29Å; G208-F212 WeakPolarHBondContact O-CB 3.5Å; G208-F212 PolarHBondContact O-N 3.36Å
209	I	93.8	Very high	92.4	Very high	1 Å²	1	44 Å²	44	1%	0.005	23%	0.226	C	C	.	.	H	α-helix	trans	-63.5	-41.2	177.1	-69.6	158	0	0	0	111.3	Q205 G213 Y271 K275 V278 I282	Q205-I209 WeakPolarHBondContact O-CD1 3.09Å; Q205-I209 WeakPolarHBondContact O-CG1 3.07Å; Q205-I209 PolarHBondContact O-N 2.59Å; I209-G213 WeakPolarHBondContact O-CA 3.18Å; I209-G213 PolarHBondContact O-N 3.45Å; I209-Y271 HydrophobicContact CD1-CD1 3.39Å; I209-Y271 HydrophobicContact CD1-CE1 3.91Å; I209-Y271 HydrophobicContact CD1-CG 4.12Å; I209-Y271 HydrophobicContact CG1-CD1 3.49Å; I209-Y271 VanDerWaalsContact CG1-CD1 3.49Å; I209-Y271 HydrophobicContact CG1-CE1 3.53Å; I209-Y271 HydrophobicContact CG1-CG 4.19Å; I209-K275 HydrophobicContact CD1-CB 3.45Å; I209-K275 VanDerWaalsContact CD1-CB 3.45Å; I209-K275 HydrophobicContact CD1-CD 3.56Å; I209-K275 HydrophobicContact CD1-CG 3.5Å; I209-V278 HydrophobicContact CG2-CG1 4.07Å; I209-I282 HydrophobicContact CG2-CD1 3.69Å
210	S	93.1	Very high	92.5	Very high	72 Å²	72	44.2 Å²	44.2	50%	0.503	23%	0.228	S	C	.	.	H	α-helix	trans	-64.9	-44.4	-179.9	-62.2	0	0	0	0	111.8	D206 I207 G208 A214	D206-S210 WeakPolarHBondContact O-CB 3.49Å; D206-S210 PolarHBondContact O-N 3.06Å; D206-S210 PolarHBondContact O-OG 3.24Å; I207-S210 PolarHBondContact O-N 3.1Å; G208-S210 VanDerWaalsContact C-N 3.35Å; G208-S210 PolarHBondContact O-N 2.52Å; S210-A214 WeakPolarHBondContact O-CB 3.2Å; S210-A214 PolarHBondContact O-N 3.21Å
211	K	93.7	Very high	92.7	Very high	54 Å²	54	44.7 Å²	44.7	24%	0.235	23%	0.233	C	C	.	.	H	α-helix	trans	-68.3	-46.3	178.2	-78.1	-177.5	168	-79.8	0	112.5	F180 D181 F199 I207 G208 G213 A214 Y215	F180-K211 HydrophobicContact CD1-CB 4.07Å; F180-K211 HydrophobicContact CD1-CD 4.21Å; F180-K211 HydrophobicContact CE1-CB 3.63Å; F180-K211 HydrophobicContact CZ-CB 4.36Å; D181-K211 IonicContact OD1-NZ 2.64Å; D181-K211 PolarHBondContact OD1-NZ 3.23Å; D181-K211 IonicContact OD2-NZ 3.52Å; D181-K211 PolarHBondContact OD2-NZ 2.97Å; F199-K211 HydrophobicContact CZ-CD 4.22Å; I207-K211 HydrophobicContact CG2-CD 4.1Å; I207-K211 HydrophobicContact CG2-CG 4.49Å; I207-K211 WeakPolarHBondContact O-CB 3.46Å; I207-K211 PolarHBondContact O-N 3.29Å; G208-K211 PolarHBondContact O-N 3.16Å; K211-G213 VanDerWaalsContact C-N 3.29Å; K211-G213 PolarHBondContact O-N 3.33Å; K211-A214 PolarHBondContact O-N 3.36Å; K211-Y215 PolarHBondContact O-N 3.24Å
212	F	94.3	Very high	92.9	Very high	3 Å²	3	45.4 Å²	45.4	1%	0.013	24%	0.244	C	C	.	.	H	α-helix	trans	-65	-38	175.8	-173.8	-121.2	0	0	0	111.9	F180 I192 F196 G208 Y215 L216 Q263 F279	F180-F212 HydrophobicContact CZ-CB 4.05Å; F180-F212 HydrophobicContact CZ-CD2 4.2Å; I192-F212 HydrophobicContact CG2-CD2 3.75Å; I192-F212 HydrophobicContact CG2-CE2 3.73Å; F196-F212 HydrophobicContact CD1-CD1 4.26Å; F196-F212 HydrophobicContact CD1-CE1 4.38Å; F196-F212 HydrophobicContact CD1-CG 4.47Å; F196-F212 HydrophobicContact CD2-CB 3.43Å; F196-F212 VanDerWaalsContact CD2-CB 3.43Å; F196-F212 HydrophobicContact CD2-CD1 4.01Å; F196-F212 HydrophobicContact CD2-CD2 4.26Å; F196-F212 AromaticContact CD2-CG 3.66Å; F196-F212 HydrophobicContact CD2-CG 3.66Å; F196-F212 AromaticContact CE1-CD1 3.87Å; F196-F212 HydrophobicContact CE1-CD1 3.87Å; F196-F212 HydrophobicContact CE1-CE1 4.06Å; F196-F212 HydrophobicContact CE1-CG 4.45Å; F196-F212 HydrophobicContact CE2-CB 3.35Å; F196-F212 AromaticContact CE2-CD1 3.6Å; F196-F212 HydrophobicContact CE2-CD1 3.6Å; F196-F212 AromaticContact CE2-CG 3.63Å; F196-F212 HydrophobicContact CE2-CG 3.63Å; F196-F212 HydrophobicContact CG-CB 4.33Å; F196-F212 HydrophobicContact CG-CD1 4.33Å; F196-F212 HydrophobicContact CG-CD2 4.37Å; F196-F212 HydrophobicContact CG-CG 4.1Å; F196-F212 HydrophobicContact CZ-CB 4.19Å; F196-F212 AromaticContact CZ-CD1 3.52Å; F196-F212 HydrophobicContact CZ-CD1 3.52Å; F196-F212 HydrophobicContact CZ-CE1 4.16Å; F196-F212 HydrophobicContact CZ-CG 4.05Å; G208-F212 VanDerWaalsContact O-CB 3.29Å; G208-F212 WeakPolarHBondContact O-CB 3.5Å; G208-F212 PolarHBondContact O-N 3.36Å; F212-Y215 HydrophobicContact CD2-CD1 4.21Å; F212-Y215 HydrophobicContact CE2-CD1 4.13Å; F212-Y215 PolarHBondContact O-N 2.93Å; F212-L216 HydrophobicContact CD1-CD1 4.01Å; F212-L216 HydrophobicContact CE1-CD1 3.59Å; F212-L216 HydrophobicContact CE1-CG 4.3Å; F212-L216 HydrophobicContact CE2-CD1 4.49Å; F212-L216 HydrophobicContact CE2-CD2 4.48Å; F212-L216 HydrophobicContact CE2-CG 4.36Å; F212-L216 HydrophobicContact CZ-CD1 3.86Å; F212-L216 HydrophobicContact CZ-CD2 4.3Å; F212-L216 HydrophobicContact CZ-CG 4.18Å; F212-L216 WeakPolarHBondContact O-CG 3.47Å; F212-L216 PolarHBondContact O-N 2.79Å; F212-Q263 HydrophobicContact CE1-CB 4.42Å; F212-Q263 HydrophobicContact CE1-CG 4.21Å; F212-Q263 HydrophobicContact CZ-CG 4.09Å; F212-F279 AromaticContact CD1-CE2 3.99Å; F212-F279 HydrophobicContact CD1-CE2 3.99Å; F212-F279 AromaticContact CE1-CE2 3.93Å; F212-F279 HydrophobicContact CE1-CE2 3.93Å; F212-F279 HydrophobicContact CE1-CZ 4.36Å
213	G	93.6	Very high	93	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-55.6	-49.6	169.8	0	0	0	0	0	112.5	I209 K211 Y215 L216 K217	I209-G213 WeakPolarHBondContact O-CA 3.18Å; I209-G213 PolarHBondContact O-N 3.45Å; K211-G213 VanDerWaalsContact C-N 3.29Å; K211-G213 PolarHBondContact O-N 3.33Å; G213-Y215 PolarHBondContact O-N 2.97Å; G213-L216 PolarHBondContact O-N 2.88Å; G213-K217 WeakPolarHBondContact O-CB 3.26Å; G213-K217 VanDerWaalsContact O-CG 3.28Å; G213-K217 WeakPolarHBondContact O-CG 3.5Å; G213-K217 PolarHBondContact O-N 2.96Å
214	A	94.1	Very high	93.1	Very high	57 Å²	57	42.6 Å²	42.6	47%	0.471	24%	0.236	S	C	.	.	H	α-helix	trans	-60.8	-42.8	177.5	0	0	0	0	0	112.7	S210 K211 K217 Q218	S210-A214 WeakPolarHBondContact O-CB 3.2Å; S210-A214 PolarHBondContact O-N 3.21Å; K211-A214 PolarHBondContact O-N 3.36Å; A214-K217 PolarHBondContact O-N 3.33Å; A214-Q218 PolarHBondContact O-N 2.93Å
215	Y	94.7	Very high	93.2	Very high	16 Å²	16	44.1 Å²	44.1	6%	0.063	24%	0.243	C	C	.	.	H	α-helix	trans	-57.9	-49.2	173.2	165.6	-106.7	0	0	0	111.8	V184 D187 I192 K211 F212 G213 K217 Q218 K219	V184-Y215 HydrophobicContact CG1-CD2 3.97Å; V184-Y215 HydrophobicContact CG2-CD2 4.21Å; V184-Y215 HydrophobicContact CG2-CG 4.3Å; D187-Y215 WeakPolarHBondContact OD1-CE2 3.4Å; D187-Y215 PolarHBondContact OD1-OH 3.4Å; I192-Y215 HydrophobicContact CD1-CD1 4.4Å; I192-Y215 HydrophobicContact CD1-CD2 4.18Å; I192-Y215 HydrophobicContact CD1-CE1 4.03Å; I192-Y215 HydrophobicContact CD1-CE2 3.76Å; I192-Y215 HydrophobicContact CD1-CG 4.47Å; I192-Y215 HydrophobicContact CG2-CD1 4.38Å; K211-Y215 PolarHBondContact O-N 3.24Å; F212-Y215 HydrophobicContact CD2-CD1 4.21Å; F212-Y215 HydrophobicContact CE2-CD1 4.13Å; F212-Y215 PolarHBondContact O-N 2.93Å; G213-Y215 PolarHBondContact O-N 2.97Å; Y215-K217 PolarHBondContact O-N 3.12Å; Y215-Q218 WeakPolarHBondContact O-CB 3.26Å; Y215-Q218 PolarHBondContact O-N 2.94Å; Y215-K219 PolarHBondContact O-N 3.41Å; Y215-K219 PolarHBondContact OH-NZ 3.1Å
216	L	94.7	Very high	93.1	Very high	7 Å²	7	47.1 Å²	47.1	4%	0.037	26%	0.257	C	S	.	.	H	α-helix	trans	-67.1	-36.3	179.3	-68.1	-179.7	0	0	0	112.4	F212 G213 Q218 K219 I220 I259 F279 L283	F212-L216 HydrophobicContact CD1-CD1 4.01Å; F212-L216 HydrophobicContact CE1-CD1 3.59Å; F212-L216 HydrophobicContact CE1-CG 4.3Å; F212-L216 HydrophobicContact CE2-CD1 4.49Å; F212-L216 HydrophobicContact CE2-CD2 4.48Å; F212-L216 HydrophobicContact CE2-CG 4.36Å; F212-L216 HydrophobicContact CZ-CD1 3.86Å; F212-L216 HydrophobicContact CZ-CD2 4.3Å; F212-L216 HydrophobicContact CZ-CG 4.18Å; F212-L216 WeakPolarHBondContact O-CG 3.47Å; F212-L216 PolarHBondContact O-N 2.79Å; G213-L216 PolarHBondContact O-N 2.88Å; L216-Q218 VanDerWaalsContact C-N 3.33Å; L216-Q218 PolarHBondContact O-N 3.48Å; L216-K219 PolarHBondContact O-N 3.35Å; L216-I220 WeakPolarHBondContact O-CB 3.41Å; L216-I220 VanDerWaalsContact O-CG1 3.28Å; L216-I220 WeakPolarHBondContact O-CG1 3.47Å; L216-I220 PolarHBondContact O-N 3.4Å; L216-I259 HydrophobicContact CD1-CG2 3.95Å; L216-I259 HydrophobicContact CD2-CG2 4.02Å; L216-I259 HydrophobicContact CG-CG2 4.5Å; L216-F279 HydrophobicContact CD1-CE2 3.51Å; L216-F279 HydrophobicContact CD1-CZ 3.69Å; L216-L283 HydrophobicContact CB-CD2 3.77Å; L216-L283 HydrophobicContact CD1-CD2 3.9Å
217	K	95.2	Very high	93	Very high	45 Å²	45	44.2 Å²	44.2	20%	0.196	24%	0.242	C	C	.	.	H	α-helix	trans	-57.9	-46.6	172.1	-74.7	-174.6	163.8	175.6	0	110.6	G213 A214 Y215 K219 I220 A221 I282 E285 Q286	G213-K217 WeakPolarHBondContact O-CB 3.26Å; G213-K217 VanDerWaalsContact O-CG 3.28Å; G213-K217 WeakPolarHBondContact O-CG 3.5Å; G213-K217 PolarHBondContact O-N 2.96Å; A214-K217 PolarHBondContact O-N 3.33Å; Y215-K217 PolarHBondContact O-N 3.12Å; K217-K219 VanDerWaalsContact C-N 3.34Å; K217-K219 PolarHBondContact O-N 3.47Å; K217-I220 PolarHBondContact O-N 3.26Å; K217-A221 VanDerWaalsContact O-CB 3.29Å; K217-A221 WeakPolarHBondContact O-CB 3.42Å; K217-A221 PolarHBondContact O-N 3.44Å; K217-I282 HydrophobicContact CD-CG2 4.06Å; K217-I282 WeakPolarHBondContact CE-O 3.28Å; K217-I282 HydrophobicContact CG-CG2 3.99Å; K217-E285 IonicContact NZ-OE1 2.86Å; K217-E285 IonicContact NZ-OE2 3.22Å; K217-E285 PolarHBondContact NZ-OE2 3.48Å; K217-Q286 HydrophobicContact CB-CB 4.34Å; K217-Q286 HydrophobicContact CB-CG 4.34Å; K217-Q286 HydrophobicContact CG-CB 4.01Å
218	Q	94.2	Very high	92.9	Very high	131 Å²	131	42.2 Å²	42.2	61%	0.612	23%	0.23	S	C	*	.	H	α-helix	trans	-61.6	-41.4	176.7	-173.8	-179.4	9.8	0	0	112.1	A214 Y215 L216 A221 S222	A214-Q218 PolarHBondContact O-N 2.93Å; Y215-Q218 WeakPolarHBondContact O-CB 3.26Å; Y215-Q218 PolarHBondContact O-N 2.94Å; L216-Q218 VanDerWaalsContact C-N 3.33Å; L216-Q218 PolarHBondContact O-N 3.48Å; Q218-A221 PolarHBondContact O-N 2.99Å; Q218-S222 WeakPolarHBondContact O-CB 3.44Å; Q218-S222 PolarHBondContact O-N 3.46Å
219	K	92.5	Very high	92.7	Very high	72 Å²	72	46.3 Å²	46.3	31%	0.313	25%	0.252	S	S	.	.	H	α-helix	trans	-65.8	-43.2	178	-169.2	167.8	-168.2	153.3	0	112.7	Y215 L216 K217 S222 T223	Y215-K219 PolarHBondContact O-N 3.41Å; Y215-K219 PolarHBondContact OH-NZ 3.1Å; L216-K219 PolarHBondContact O-N 3.35Å; K217-K219 VanDerWaalsContact C-N 3.34Å; K217-K219 PolarHBondContact O-N 3.47Å; K219-S222 PolarHBondContact O-N 3.01Å; K219-T223 WeakPolarHBondContact O-CB 3.46Å; K219-T223 PolarHBondContact O-N 3.44Å; K219-T223 PolarHBondContact O-OG1 3.35Å
220	I	94.7	Very high	92.4	Very high	5 Å²	5	49.2 Å²	49.2	3%	0.026	27%	0.27	C	S	.	.	H	α-helix	trans	-64	-42.9	174.3	-68.6	164.5	0	0	0	109.9	L216 K217 T223 G224 L252 V256 I259 L283 Q286	L216-I220 WeakPolarHBondContact O-CB 3.41Å; L216-I220 VanDerWaalsContact O-CG1 3.28Å; L216-I220 WeakPolarHBondContact O-CG1 3.47Å; L216-I220 PolarHBondContact O-N 3.4Å; K217-I220 PolarHBondContact O-N 3.26Å; I220-T223 PolarHBondContact O-N 3.5Å; I220-G224 WeakPolarHBondContact O-CA 3.27Å; I220-G224 PolarHBondContact O-N 3.21Å; I220-L252 HydrophobicContact CG2-CD1 4.07Å; I220-V256 HydrophobicContact CD1-CG2 4.06Å; I220-V256 HydrophobicContact CG1-CG2 4.26Å; I220-V256 HydrophobicContact CG2-CG2 3.99Å; I220-I259 HydrophobicContact CD1-CD1 4.12Å; I220-I259 HydrophobicContact CG1-CD1 3.62Å; I220-L283 HydrophobicContact CD1-CD2 3.82Å; I220-Q286 HydrophobicContact CB-CG 3.98Å; I220-Q286 HydrophobicContact CG2-CB 4.29Å; I220-Q286 HydrophobicContact CG2-CG 3.71Å
221	A	94.9	Very high	92	Very high	26 Å²	26	46.2 Å²	46.2	22%	0.215	25%	0.249	C	C	.	.	H	α-helix	trans	-61.7	-46.1	177.4	0	0	0	0	0	111.9	K217 Q218 G224 E225	K217-A221 VanDerWaalsContact O-CB 3.29Å; K217-A221 WeakPolarHBondContact O-CB 3.42Å; K217-A221 PolarHBondContact O-N 3.44Å; Q218-A221 PolarHBondContact O-N 2.99Å; A221-G224 PolarHBondContact O-N 2.88Å; A221-E225 VanDerWaalsContact O-CB 3.27Å; A221-E225 WeakPolarHBondContact O-CB 3.36Å; A221-E225 PolarHBondContact O-N 3.09Å
222	S	93.2	Very high	91.6	Very high	69 Å²	69	44.8 Å²	44.8	48%	0.483	25%	0.247	S	C	.	.	H	α-helix	trans	-63.8	-44.3	178.7	-179.2	0	0	0	0	112.2	Q218 K219 Q226	Q218-S222 WeakPolarHBondContact O-CB 3.44Å; Q218-S222 PolarHBondContact O-N 3.46Å; K219-S222 PolarHBondContact O-N 3.01Å; S222-Q226 WeakPolarHBondContact O-CG 3.39Å; S222-Q226 PolarHBondContact O-N 3.44Å
223	T	91.6	Very high	91.2	Very high	67 Å²	67	49.6 Å²	49.6	41%	0.411	28%	0.281	S	S	.	.	H	α-helix	trans	-68.3	-41.1	177.2	-50.9	0	0	0	0	111.3	K219 I220 Q226 N227	K219-T223 WeakPolarHBondContact O-CB 3.46Å; K219-T223 PolarHBondContact O-N 3.44Å; K219-T223 PolarHBondContact O-OG1 3.35Å; I220-T223 PolarHBondContact O-N 3.5Å; T223-Q226 PolarHBondContact O-N 3Å; T223-N227 PolarHBondContact O-N 3.49Å; T223-N227 VanDerWaalsContact O-N 3.11Å; T223-N227 PolarHBondContact O-ND2 3.34Å
224	G	90.7	Very high	90.5	Very high	3 Å²	3	51.6 Å²	51.6	3%	0.031	30%	0.302	C	S	.	.	H	α-helix	trans	-61.5	-44	176.4	0	0	0	0	0	111.9	I220 A221 N227 F228	I220-G224 WeakPolarHBondContact O-CA 3.27Å; I220-G224 PolarHBondContact O-N 3.21Å; A221-G224 PolarHBondContact O-N 2.88Å; G224-N227 PolarHBondContact O-N 2.93Å; G224-F228 WeakPolarHBondContact O-CB 3.33Å; G224-F228 PolarHBondContact O-N 2.78Å
225	E	92.6	Very high	89.7	Confident	66 Å²	66	49.9 Å²	49.9	31%	0.308	29%	0.29	S	S	.	.	H	α-helix	trans	-59.7	-47.6	175.8	-178	63.8	-164.3	0	0	111.4	A221 N227 F228 L229 R293	A221-E225 VanDerWaalsContact O-CB 3.27Å; A221-E225 WeakPolarHBondContact O-CB 3.36Å; A221-E225 PolarHBondContact O-N 3.09Å; E225-N227 PolarHBondContact O-N 3.18Å; E225-F228 PolarHBondContact O-N 3.32Å; E225-L229 HydrophobicContact CG-CD1 4.01Å; E225-L229 HydrophobicContact CG-CG 4.37Å; E225-L229 WeakPolarHBondContact O-CB 3.34Å; E225-L229 VanDerWaalsContact O-CG 3.26Å; E225-L229 WeakPolarHBondContact O-CG 3.25Å; E225-L229 PolarHBondContact O-N 3.06Å; E225-R293 IonicContact OE1-NH2 3.09Å; E225-R293 IonicContact OE2-CZ 3.84Å; E225-R293 IonicContact OE2-NH1 3.27Å; E225-R293 PolarHBondContact OE2-NH1 3.14Å; E225-R293 IonicContact OE2-NH2 2.8Å; E225-R293 PolarHBondContact OE2-NH2 3.27Å
226	Q	89	Confident	88.7	Confident	126 Å²	126	56.4 Å²	56.4	59%	0.589	33%	0.326	S	S	*	.	H	α-helix	trans	-59.6	-47.6	178.1	-73.5	-174.7	-23.2	0	0	111.8	S222 T223 F228 L229 V230	S222-Q226 WeakPolarHBondContact O-CG 3.39Å; S222-Q226 PolarHBondContact O-N 3.44Å; T223-Q226 PolarHBondContact O-N 3Å; Q226-F228 VanDerWaalsContact C-N 3.35Å; Q226-F228 PolarHBondContact O-N 3.44Å; Q226-L229 PolarHBondContact O-N 2.93Å; Q226-V230 WeakPolarHBondContact O-CG2 3.39Å; Q226-V230 PolarHBondContact O-N 2.86Å
227	N	87.7	Confident	88	Confident	37 Å²	37	59.8 Å²	59.8	20%	0.198	34%	0.344	C	S	.	.	H	α-helix	trans	-65.7	-38.9	178.9	-68.3	-24.3	0	0	0	112	T223 G224 E225 V230 A231	T223-N227 PolarHBondContact O-N 3.49Å; T223-N227 VanDerWaalsContact O-N 3.11Å; T223-N227 PolarHBondContact O-ND2 3.34Å; G224-N227 PolarHBondContact O-N 2.93Å; E225-N227 PolarHBondContact O-N 3.18Å; N227-V230 PolarHBondContact O-N 3.05Å; N227-A231 PolarHBondContact O-N 3.2Å
228	F	89.7	Confident	87.1	Confident	30 Å²	30	63.9 Å²	63.9	13%	0.132	37%	0.372	C	S	.	.	H	α-helix	trans	-63.6	-46.1	176.8	174.5	-98.6	0	0	0	111.6	G224 E225 Q226 V230 A231 A232 R293 I294 C297	G224-F228 WeakPolarHBondContact O-CB 3.33Å; G224-F228 PolarHBondContact O-N 2.78Å; E225-F228 PolarHBondContact O-N 3.32Å; Q226-F228 VanDerWaalsContact C-N 3.35Å; Q226-F228 PolarHBondContact O-N 3.44Å; F228-V230 VanDerWaalsContact C-N 3.31Å; F228-V230 PolarHBondContact O-N 3.31Å; F228-A231 PolarHBondContact O-N 3.44Å; F228-A232 HydrophobicContact CE1-CB 4.24Å; F228-A232 HydrophobicContact CZ-CB 4.34Å; F228-A232 VanDerWaalsContact O-CB 3.3Å; F228-A232 WeakPolarHBondContact O-CB 3.31Å; F228-A232 PolarHBondContact O-N 3.32Å; F228-R293 HydrophobicContact CD2-CB 4.23Å; F228-R293 HydrophobicContact CE2-CB 4.03Å; F228-R293 WeakPolarHBondContact CE2-O 3.34Å; F228-I294 HydrophobicContact CD2-CG1 4.09Å; F228-C297 HydrophobicContact CE2-CB 3.67Å; F228-C297 HydrophobicContact CZ-CB 4.08Å
229	L	89.5	Confident	86.4	Confident	85 Å²	85	62.2 Å²	62.2	45%	0.445	38%	0.375	S	S	.	.	H	α-helix	trans	-61.8	-38.8	179.6	-73.4	173.7	0	0	0	112.1	E225 Q226 A232 S233	E225-L229 HydrophobicContact CG-CD1 4.01Å; E225-L229 HydrophobicContact CG-CG 4.37Å; E225-L229 WeakPolarHBondContact O-CB 3.34Å; E225-L229 VanDerWaalsContact O-CG 3.26Å; E225-L229 WeakPolarHBondContact O-CG 3.25Å; E225-L229 PolarHBondContact O-N 3.06Å; Q226-L229 PolarHBondContact O-N 2.93Å; L229-A232 PolarHBondContact O-N 3.21Å; L229-S233 VanDerWaalsContact O-CB 3.25Å; L229-S233 WeakPolarHBondContact O-CB 3.48Å; L229-S233 PolarHBondContact O-N 3.48Å; L229-S233 PolarHBondContact O-OG 3.26Å
230	V	86.4	Confident	85.9	Confident	63 Å²	63	64.2 Å²	64.2	38%	0.382	38%	0.381	S	S	.	.	H	α-helix	trans	-61.5	-47.6	174.8	173.5	0	0	0	0	110.6	Q226 N227 F228 S233 G235	Q226-V230 WeakPolarHBondContact O-CG2 3.39Å; Q226-V230 PolarHBondContact O-N 2.86Å; N227-V230 PolarHBondContact O-N 3.05Å; F228-V230 VanDerWaalsContact C-N 3.31Å; F228-V230 PolarHBondContact O-N 3.31Å; V230-S233 PolarHBondContact O-N 3.5Å; V230-G235 WeakPolarHBondContact O-CA 3.34Å; V230-G235 PolarHBondContact O-N 3.43Å
231	A	85.2	Confident	85.2	Confident	8 Å²	8	65.4 Å²	65.4	7%	0.066	39%	0.392	C	S	.	.	H	α-helix	trans	-66.3	-43.2	178.5	0	0	0	0	0	112.6	N227 F228 S233 G234 F245 A248	N227-A231 PolarHBondContact O-N 3.2Å; F228-A231 PolarHBondContact O-N 3.44Å; A231-S233 VanDerWaalsContact C-N 3.26Å; A231-S233 PolarHBondContact O-N 2.82Å; A231-G234 PolarHBondContact O-N 3.5Å; A231-G234 VanDerWaalsContact O-N 3.14Å; A231-F245 HydrophobicContact CB-CD1 4.3Å; A231-F245 HydrophobicContact CB-CE1 4.36Å; A231-A248 HydrophobicContact CB-CB 3.83Å
232	A	85.3	Confident	84.7	Confident	25 Å²	25	68.3 Å²	68.3	21%	0.207	40%	0.403	C	S	.	.	H	α-helix	trans	-64.1	-31.1	179.8	0	0	0	0	0	112.8	F228 L229 G234	F228-A232 HydrophobicContact CE1-CB 4.24Å; F228-A232 HydrophobicContact CZ-CB 4.34Å; F228-A232 VanDerWaalsContact O-CB 3.3Å; F228-A232 WeakPolarHBondContact O-CB 3.31Å; F228-A232 PolarHBondContact O-N 3.32Å; L229-A232 PolarHBondContact O-N 3.21Å; A232-G234 VanDerWaalsContact C-N 3.27Å; A232-G234 PolarHBondContact O-N 2.65Å
233	S	85.1	Confident	84.5	Confident	104 Å²	104	66.6 Å²	66.6	73%	0.727	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	0.4	178.2	-55	0	0	0	0	113.9	L229 V230 A231	L229-S233 VanDerWaalsContact O-CB 3.25Å; L229-S233 WeakPolarHBondContact O-CB 3.48Å; L229-S233 PolarHBondContact O-N 3.48Å; L229-S233 PolarHBondContact O-OG 3.26Å; V230-S233 PolarHBondContact O-N 3.5Å; A231-S233 VanDerWaalsContact C-N 3.26Å; A231-S233 PolarHBondContact O-N 2.82Å
234	G	79.4	Confident	84.4	Confident	41 Å²	41	64.4 Å²	64.4	42%	0.423	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	95.6	8	178.5	0	0	0	0	0	115	A231 A232 L244	A231-G234 PolarHBondContact O-N 3.5Å; A231-G234 VanDerWaalsContact O-N 3.14Å; A232-G234 VanDerWaalsContact C-N 3.27Å; A232-G234 PolarHBondContact O-N 2.65Å; G234-L244 WeakPolarHBondContact O-CD1 3.28Å
235	G	77.1	Confident	84.4	Confident	22 Å²	22	64.5 Å²	64.5	23%	0.227	38%	0.375	C	S	.	.			trans	74.1	169	-179.9	0	0	0	0	0	114.1	V230	V230-G235 WeakPolarHBondContact O-CA 3.34Å; V230-G235 PolarHBondContact O-N 3.43Å
236	N	74.6	Confident	84.4	Confident	153 Å²	153	61.5 Å²	61.5	82%	0.818	36%	0.361	S	S	*	.	S	Bend	trans	-95.1	-20.1	177.4	-60.1	-15.2	0	0	0	112.1
237	D	79.2	Confident	84.6	Confident	78 Å²	78	57.1 Å²	57.1	42%	0.417	34%	0.342	S	S	.	.			trans	-117.9	112.7	-173.8	-174.5	-8.4	0	0	0	110.4	S239 R240 A241	D237-S239 PolarHBondContact O-N 3.47Å; D237-S239 VanDerWaalsContact OD1-CB 3.32Å; D237-S239 WeakPolarHBondContact OD1-CB 3.43Å; D237-S239 PolarHBondContact OD1-N 3.35Å; D237-S239 PolarHBondContact OD1-OG 3.19Å; D237-S239 PolarHBondContact OD2-OG 2.97Å; D237-R240 HydrophobicContact CB-CB 4.45Å; D237-R240 HydrophobicContact CB-CG 4.45Å; D237-R240 PolarHBondContact O-N 3.05Å; D237-R240 VanDerWaalsContact O-N 3.13Å; D237-A241 PolarHBondContact O-N 3.23Å
238	V	76.9	Confident	84.9	Confident	131 Å²	131	55.5 Å²	55.5	79%	0.794	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-61.2	-31.8	179.6	-177.2	0	0	0	0	111.4	R240 A241	V238-R240 PolarHBondContact O-N 3.48Å; V238-A241 VanDerWaalsContact O-CB 3.28Å; V238-A241 WeakPolarHBondContact O-CB 3.48Å; V238-A241 PolarHBondContact O-N 2.99Å
239	S	77.9	Confident	85.2	Confident	95 Å²	95	54.1 Å²	54.1	66%	0.664	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-65.9	-25.3	180	74.6	0	0	0	0	112.7	D237	D237-S239 PolarHBondContact O-N 3.47Å; D237-S239 VanDerWaalsContact OD1-CB 3.32Å; D237-S239 WeakPolarHBondContact OD1-CB 3.43Å; D237-S239 PolarHBondContact OD1-N 3.35Å; D237-S239 PolarHBondContact OD1-OG 3.19Å; D237-S239 PolarHBondContact OD2-OG 2.97Å
240	R	83	Confident	85.4	Confident	114 Å²	114	50.9 Å²	50.9	43%	0.43	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	-103.2	8.2	-179.4	-57.9	-170.2	70	98.6	3.6	113.3	D237 V238 N242 V243 L244 D247	D237-R240 HydrophobicContact CB-CB 4.45Å; D237-R240 HydrophobicContact CB-CG 4.45Å; D237-R240 PolarHBondContact O-N 3.05Å; D237-R240 VanDerWaalsContact O-N 3.13Å; V238-R240 PolarHBondContact O-N 3.48Å; R240-N242 PolarHBondContact O-N 2.84Å; R240-V243 HydrophobicContact CB-CG2 3.99Å; R240-V243 WeakPolarHBondContact O-CG2 3.42Å; R240-V243 PolarHBondContact O-N 3.38Å; R240-L244 WeakPolarHBondContact O-CD2 3.42Å; R240-L244 WeakPolarHBondContact O-CG 3.05Å; R240-L244 PolarHBondContact O-N 3.44Å; R240-D247 IonicContact CZ-OD1 3.93Å; R240-D247 IonicContact CZ-OD2 3.88Å; R240-D247 IonicContact NE-OD2 3.35Å; R240-D247 PolarHBondContact NE-OD2 3.12Å; R240-D247 IonicContact NH2-OD1 3.23Å; R240-D247 PolarHBondContact NH2-OD1 3.33Å; R240-D247 IonicContact NH2-OD2 3.59Å; R240-D247 PolarHBondContact NH2-OD2 2.89Å
241	A	80.8	Confident	85.8	Confident	31 Å²	31	52.2 Å²	52.2	26%	0.256	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-26.6	-179.9	0	0	0	0	0	113.7	D237 V238 L244 R302	D237-A241 PolarHBondContact O-N 3.23Å; V238-A241 VanDerWaalsContact O-CB 3.28Å; V238-A241 WeakPolarHBondContact O-CB 3.48Å; V238-A241 PolarHBondContact O-N 2.99Å; A241-L244 WeakPolarHBondContact O-CD1 3.47Å; A241-L244 WeakPolarHBondContact O-CG 3.33Å; A241-R302 PolarHBondContact O-NH2 3Å
242	N	84	Confident	86.4	Confident	87 Å²	87	52.2 Å²	52.2	47%	0.465	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-7.6	-178.9	-70.1	-18.6	0	0	0	114.7	R240 V335 E339	R240-N242 PolarHBondContact O-N 2.84Å; N242-V335 HydrophobicContact CB-CG1 3.46Å; N242-V335 VanDerWaalsContact CB-CG1 3.46Å; N242-E339 WeakPolarHBondContact O-CG 3.39Å
243	V	88.4	Confident	86.9	Confident	33 Å²	33	51.3 Å²	51.3	20%	0.2	31%	0.307	C	S	.	.	S	Bend	trans	-131.6	14	-178.7	-64.2	0	0	0	0	112.5	R240 F245 A246 D247 E339 L342	R240-V243 HydrophobicContact CB-CG2 3.99Å; R240-V243 WeakPolarHBondContact O-CG2 3.42Å; R240-V243 PolarHBondContact O-N 3.38Å; V243-F245 VanDerWaalsContact C-N 3.3Å; V243-F245 PolarHBondContact O-N 3.47Å; V243-A246 WeakPolarHBondContact O-CB 3.29Å; V243-A246 PolarHBondContact O-N 3Å; V243-A246 VanDerWaalsContact O-N 3.12Å; V243-D247 PolarHBondContact O-N 3.25Å; V243-E339 VanDerWaalsContact C-OE1 3.31Å; V243-E339 WeakPolarHBondContact CA-OE1 3.5Å; V243-L342 HydrophobicContact CG1-CD1 3.73Å
244	L	89.3	Confident	87.5	Confident	20 Å²	20	51.4 Å²	51.4	11%	0.105	30%	0.296	C	S	.	.	H	α-helix	trans	-53.1	-44.6	-174	-66.6	172.7	0	0	0	113.2	G234 R240 A241 D247 A248 E339	G234-L244 WeakPolarHBondContact O-CD1 3.28Å; R240-L244 WeakPolarHBondContact O-CD2 3.42Å; R240-L244 WeakPolarHBondContact O-CG 3.05Å; R240-L244 PolarHBondContact O-N 3.44Å; A241-L244 WeakPolarHBondContact O-CD1 3.47Å; A241-L244 WeakPolarHBondContact O-CG 3.33Å; L244-D247 PolarHBondContact O-N 2.65Å; L244-A248 WeakPolarHBondContact O-CB 3.47Å; L244-A248 PolarHBondContact O-N 3.35Å; L244-E339 PolarHBondContact N-OE1 3.45Å
245	F	92.2	Very high	88.2	Confident	5 Å²	5	50.7 Å²	50.7	2%	0.022	29%	0.289	C	S	.	.	H	α-helix	trans	-77.8	-33.3	-176.8	-63.5	-75.4	0	0	0	111.3	A231 V243 D247 L249 I294 C297 F298 K301 E339	A231-F245 HydrophobicContact CB-CD1 4.3Å; A231-F245 HydrophobicContact CB-CE1 4.36Å; V243-F245 VanDerWaalsContact C-N 3.3Å; V243-F245 PolarHBondContact O-N 3.47Å; F245-D247 VanDerWaalsContact C-N 3.31Å; F245-L249 WeakPolarHBondContact O-CB 3.33Å; F245-L249 PolarHBondContact O-N 2.84Å; F245-I294 HydrophobicContact CB-CG2 4.3Å; F245-I294 HydrophobicContact CD1-CG2 4.33Å; F245-C297 HydrophobicContact CE1-CB 3.96Å; F245-F298 HydrophobicContact CB-CB 3.96Å; F245-F298 HydrophobicContact CB-CD2 3.84Å; F245-F298 HydrophobicContact CB-CG 4.28Å; F245-F298 HydrophobicContact CD1-CB 3.97Å; F245-F298 HydrophobicContact CD2-CB 4.05Å; F245-F298 AromaticContact CD2-CD2 3.65Å; F245-F298 HydrophobicContact CD2-CD2 3.65Å; F245-F298 HydrophobicContact CD2-CG 4.35Å; F245-F298 HydrophobicContact CE2-CD2 4.46Å; F245-F298 HydrophobicContact CG-CB 3.72Å; F245-F298 AromaticContact CG-CD2 3.91Å; F245-F298 HydrophobicContact CG-CD2 3.91Å; F245-F298 HydrophobicContact CG-CG 4.3Å; F245-K301 HydrophobicContact CE2-CB 4.19Å; F245-K301 HydrophobicContact CZ-CB 3.97Å; F245-K301 HydrophobicContact CZ-CG 4.05Å; F245-E339 PolarHBondContact N-OE1 3.35Å
246	A	92.6	Very high	89.1	Confident	3 Å²	3	49.8 Å²	49.8	3%	0.025	28%	0.279	C	S	.	.	H	α-helix	trans	-63.4	-39	171.7	0	0	0	0	0	111.4	V243 T250 E339 L342 L343	V243-A246 WeakPolarHBondContact O-CB 3.29Å; V243-A246 PolarHBondContact O-N 3Å; V243-A246 VanDerWaalsContact O-N 3.12Å; A246-T250 WeakPolarHBondContact O-CB 3.45Å; A246-T250 PolarHBondContact O-N 3.43Å; A246-T250 PolarHBondContact O-OG1 2.94Å; A246-E339 HydrophobicContact CB-CG 4.39Å; A246-L342 HydrophobicContact CB-CB 4Å; A246-L343 HydrophobicContact CB-CD2 4.25Å; A246-L343 HydrophobicContact CB-CG 4.29Å
247	D	92.3	Very high	90.2	Very high	34 Å²	34	43.2 Å²	43.2	18%	0.182	25%	0.245	C	C	.	.	H	α-helix	trans	-68.7	-46.4	176.2	-70.6	-19.2	0	0	0	112.2	R240 V243 L244 F245 L249 T250 L251	R240-D247 IonicContact CZ-OD1 3.93Å; R240-D247 IonicContact CZ-OD2 3.88Å; R240-D247 IonicContact NE-OD2 3.35Å; R240-D247 PolarHBondContact NE-OD2 3.12Å; R240-D247 IonicContact NH2-OD1 3.23Å; R240-D247 PolarHBondContact NH2-OD1 3.33Å; R240-D247 IonicContact NH2-OD2 3.59Å; R240-D247 PolarHBondContact NH2-OD2 2.89Å; V243-D247 PolarHBondContact O-N 3.25Å; L244-D247 PolarHBondContact O-N 2.65Å; F245-D247 VanDerWaalsContact C-N 3.31Å; D247-L249 VanDerWaalsContact C-N 3.28Å; D247-L249 PolarHBondContact O-N 3.23Å; D247-T250 WeakPolarHBondContact O-CB 2.98Å; D247-T250 PolarHBondContact O-N 3.33Å; D247-T250 VanDerWaalsContact O-N 3.1Å; D247-L251 WeakPolarHBondContact O-CG 3.43Å; D247-L251 PolarHBondContact O-N 3.35Å
248	A	93.3	Very high	91	Very high	4 Å²	4	47 Å²	47	3%	0.033	25%	0.254	C	S	.	.	H	α-helix	trans	-58.5	-42.8	175.8	0	0	0	0	0	111.7	A231 L244 L251 L252 I294	A231-A248 HydrophobicContact CB-CB 3.83Å; L244-A248 WeakPolarHBondContact O-CB 3.47Å; L244-A248 PolarHBondContact O-N 3.35Å; A248-L251 PolarHBondContact O-N 3.41Å; A248-L252 PolarHBondContact O-N 2.81Å; A248-L252 VanDerWaalsContact O-N 3.09Å; A248-I294 HydrophobicContact CB-CD1 4.17Å; A248-I294 HydrophobicContact CB-CG2 4.49Å
249	L	96	Very high	91.9	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-65.5	-40.9	175.1	-174.7	62.2	0	0	0	111.4	F245 D247 L252 L253 A291 I294 F295 L343 V347	F245-L249 WeakPolarHBondContact O-CB 3.33Å; F245-L249 PolarHBondContact O-N 2.84Å; D247-L249 VanDerWaalsContact C-N 3.28Å; D247-L249 PolarHBondContact O-N 3.23Å; L249-L252 HydrophobicContact CD1-CD2 4.48Å; L249-L252 PolarHBondContact O-N 3.29Å; L249-L253 HydrophobicContact CD1-CD1 4.02Å; L249-L253 HydrophobicContact CD1-CD2 4.36Å; L249-L253 HydrophobicContact CD1-CG 3.97Å; L249-L253 HydrophobicContact CD2-CD1 4.33Å; L249-L253 HydrophobicContact CG-CD1 3.79Å; L249-L253 HydrophobicContact CG-CG 4.14Å; L249-L253 WeakPolarHBondContact O-CB 3.4Å; L249-L253 VanDerWaalsContact O-CG 3.25Å; L249-L253 WeakPolarHBondContact O-CG 3.34Å; L249-L253 PolarHBondContact O-N 3.36Å; L249-A291 HydrophobicContact CD1-CB 3.84Å; L249-I294 HydrophobicContact CB-CG2 4.34Å; L249-F295 HydrophobicContact CD1-CE2 4.44Å; L249-F295 HydrophobicContact CD2-CE2 4.08Å; L249-F295 HydrophobicContact CD2-CZ 3.91Å; L249-L343 HydrophobicContact CB-CD2 4.01Å; L249-L343 HydrophobicContact CD2-CB 4.45Å; L249-L343 HydrophobicContact CD2-CD2 3.53Å; L249-L343 HydrophobicContact CG-CD2 4.42Å; L249-V347 HydrophobicContact CD2-CG2 3.79Å
250	T	94.8	Very high	92.8	Very high	17 Å²	17	38.1 Å²	38.1	10%	0.104	19%	0.194	C	C	.	.	H	α-helix	trans	-58.9	-49.7	177.1	-57.2	0	0	0	0	110.7	A246 D247 L252 L253 E254 R346	A246-T250 WeakPolarHBondContact O-CB 3.45Å; A246-T250 PolarHBondContact O-N 3.43Å; A246-T250 PolarHBondContact O-OG1 2.94Å; D247-T250 WeakPolarHBondContact O-CB 2.98Å; D247-T250 PolarHBondContact O-N 3.33Å; D247-T250 VanDerWaalsContact O-N 3.1Å; T250-L252 VanDerWaalsContact C-N 3.32Å; T250-L252 PolarHBondContact O-N 3.46Å; T250-L253 PolarHBondContact O-N 3Å; T250-E254 HydrophobicContact CG2-CG 4.18Å; T250-E254 WeakPolarHBondContact CG2-OE1 3.28Å; T250-E254 WeakPolarHBondContact O-CB 3.46Å; T250-E254 WeakPolarHBondContact O-CG 3.32Å; T250-E254 PolarHBondContact O-N 3.37Å; T250-R346 WeakPolarHBondContact OG1-CD 3.38Å; T250-R346 VanDerWaalsContact OG1-CG 3.31Å; T250-R346 WeakPolarHBondContact OG1-CG 3.35Å; T250-R346 PolarHBondContact OG1-NE 3.49Å
251	L	94.9	Very high	93.3	Very high	92 Å²	92	36.6 Å²	36.6	48%	0.482	19%	0.192	S	C	.	.	H	α-helix	trans	-60.9	-40.6	179.3	-69.2	172.9	0	0	0	112.2	D247 A248 G255	D247-L251 WeakPolarHBondContact O-CG 3.43Å; D247-L251 PolarHBondContact O-N 3.35Å; A248-L251 PolarHBondContact O-N 3.41Å; L251-G255 PolarHBondContact O-N 2.8Å
252	L	96.4	Very high	94	Very high	8 Å²	8	39.1 Å²	39.1	4%	0.042	20%	0.204	C	C	.	.	H	α-helix	trans	-62.8	-53.1	175	175.2	65.7	0	0	0	111.4	I220 A248 L249 T250 G255 V256 E290 A291 I294	I220-L252 HydrophobicContact CG2-CD1 4.07Å; A248-L252 PolarHBondContact O-N 2.81Å; A248-L252 VanDerWaalsContact O-N 3.09Å; L249-L252 HydrophobicContact CD1-CD2 4.48Å; L249-L252 PolarHBondContact O-N 3.29Å; T250-L252 VanDerWaalsContact C-N 3.32Å; T250-L252 PolarHBondContact O-N 3.46Å; L252-G255 PolarHBondContact O-N 2.9Å; L252-V256 HydrophobicContact CD1-CG2 4.24Å; L252-V256 VanDerWaalsContact O-CG2 3.32Å; L252-V256 WeakPolarHBondContact O-CG2 3.44Å; L252-V256 PolarHBondContact O-N 3.28Å; L252-E290 HydrophobicContact CD1-CB 3.87Å; L252-E290 HydrophobicContact CD1-CG 4.37Å; L252-E290 HydrophobicContact CD2-CB 3.63Å; L252-E290 HydrophobicContact CG-CB 4.42Å; L252-A291 HydrophobicContact CD2-CB 3.86Å; L252-A291 VanDerWaalsContact CD2-N 3.32Å; L252-I294 HydrophobicContact CB-CD1 4.41Å; L252-I294 HydrophobicContact CD2-CD1 3.97Å
253	L	97.3	Very high	94.4	Very high	6 Å²	6	35.9 Å²	35.9	3%	0.031	19%	0.186	C	C	.	.	H	α-helix	trans	-66.6	-43.1	-175	-66.1	178.2	0	0	0	112	L249 T250 G255 V256 A257 R346 V347 Y350 L392	L249-L253 HydrophobicContact CD1-CD1 4.02Å; L249-L253 HydrophobicContact CD1-CD2 4.36Å; L249-L253 HydrophobicContact CD1-CG 3.97Å; L249-L253 HydrophobicContact CD2-CD1 4.33Å; L249-L253 HydrophobicContact CG-CD1 3.79Å; L249-L253 HydrophobicContact CG-CG 4.14Å; L249-L253 WeakPolarHBondContact O-CB 3.4Å; L249-L253 VanDerWaalsContact O-CG 3.25Å; L249-L253 WeakPolarHBondContact O-CG 3.34Å; L249-L253 PolarHBondContact O-N 3.36Å; T250-L253 PolarHBondContact O-N 3Å; L253-G255 VanDerWaalsContact C-N 3.34Å; L253-V256 PolarHBondContact O-N 3.37Å; L253-A257 WeakPolarHBondContact O-CB 3.3Å; L253-A257 PolarHBondContact O-N 2.96Å; L253-R346 HydrophobicContact CD1-CB 4.24Å; L253-V347 HydrophobicContact CD1-CG2 4.04Å; L253-Y350 HydrophobicContact CB-CD2 4.02Å; L253-Y350 HydrophobicContact CB-CG 4.19Å; L253-Y350 HydrophobicContact CD1-CG 4.42Å; L253-Y350 HydrophobicContact CD2-CD1 3.87Å; L253-Y350 HydrophobicContact CD2-CD2 4.12Å; L253-Y350 HydrophobicContact CD2-CE1 4.17Å; L253-Y350 HydrophobicContact CD2-CE2 4.41Å; L253-Y350 HydrophobicContact CD2-CG 3.83Å; L253-Y350 HydrophobicContact CG-CG 4.36Å; L253-L392 HydrophobicContact CD2-CD2 3.85Å
254	E	96.2	Very high	94.7	Very high	106 Å²	106	34.7 Å²	34.7	50%	0.495	18%	0.178	S	C	.	.	H	α-helix	trans	-65.7	-38.1	174.7	-72.1	-173.9	-176.4	0	0	111.7	T250 A257 R258	T250-E254 HydrophobicContact CG2-CG 4.18Å; T250-E254 WeakPolarHBondContact CG2-OE1 3.28Å; T250-E254 WeakPolarHBondContact O-CB 3.46Å; T250-E254 WeakPolarHBondContact O-CG 3.32Å; T250-E254 PolarHBondContact O-N 3.37Å; E254-A257 PolarHBondContact O-N 3.46Å; E254-R258 VanDerWaalsContact O-CB 3.3Å; E254-R258 WeakPolarHBondContact O-CB 3.11Å; E254-R258 PolarHBondContact O-N 3.24Å
255	G	95.3	Very high	94.8	Very high	26 Å²	26	37.1 Å²	37.1	27%	0.268	20%	0.195	S	C	.	.	H	α-helix	trans	-60.1	-49.5	174.4	0	0	0	0	0	111.9	L251 L252 L253 R258 I259	L251-G255 PolarHBondContact O-N 2.8Å; L252-G255 PolarHBondContact O-N 2.9Å; L253-G255 VanDerWaalsContact C-N 3.34Å; G255-R258 PolarHBondContact O-N 2.9Å; G255-I259 VanDerWaalsContact O-CG1 3.31Å; G255-I259 WeakPolarHBondContact O-CG1 3.49Å; G255-I259 PolarHBondContact O-N 2.8Å
256	V	96.8	Very high	94.8	Very high	3 Å²	3	38.3 Å²	38.3	2%	0.018	20%	0.201	C	C	.	.	H	α-helix	trans	-64.4	-43.1	176.6	175.8	0	0	0	0	111.1	I220 L252 L253 R258 I259 F260 L283 C287 Y350	I220-V256 HydrophobicContact CD1-CG2 4.06Å; I220-V256 HydrophobicContact CG1-CG2 4.26Å; I220-V256 HydrophobicContact CG2-CG2 3.99Å; L252-V256 HydrophobicContact CD1-CG2 4.24Å; L252-V256 VanDerWaalsContact O-CG2 3.32Å; L252-V256 WeakPolarHBondContact O-CG2 3.44Å; L252-V256 PolarHBondContact O-N 3.28Å; L253-V256 PolarHBondContact O-N 3.37Å; V256-R258 VanDerWaalsContact C-N 3.33Å; V256-R258 PolarHBondContact O-N 2.52Å; V256-I259 PolarHBondContact O-N 2.92Å; V256-F260 WeakPolarHBondContact O-CB 3.38Å; V256-F260 PolarHBondContact O-N 2.84Å; V256-L283 HydrophobicContact CG1-CB 4.37Å; V256-C287 HydrophobicContact CG1-CB 4.35Å; V256-C287 HydrophobicContact CG2-CB 4.16Å; V256-Y350 HydrophobicContact CB-CE2 4.43Å; V256-Y350 HydrophobicContact CG1-CE2 4.23Å; V256-Y350 WeakPolarHBondContact CG1-OH 3.49Å
257	A	96.7	Very high	94.9	Very high	14 Å²	14	38.1 Å²	38.1	12%	0.116	20%	0.2	C	C	.	.	H	α-helix	trans	-60	-42.4	177.5	0	0	0	0	0	111.8	L253 E254 F260 E261 Y350 F353	L253-A257 WeakPolarHBondContact O-CB 3.3Å; L253-A257 PolarHBondContact O-N 2.96Å; E254-A257 PolarHBondContact O-N 3.46Å; A257-F260 PolarHBondContact O-N 3.45Å; A257-E261 VanDerWaalsContact O-CB 3.28Å; A257-E261 WeakPolarHBondContact O-CB 3.35Å; A257-E261 PolarHBondContact O-N 3.13Å; A257-Y350 HydrophobicContact CB-CD2 4.28Å; A257-Y350 HydrophobicContact CB-CE2 4.34Å; A257-F353 HydrophobicContact CB-CD1 3.86Å; A257-F353 HydrophobicContact CB-CE1 3.58Å; A257-F353 HydrophobicContact CB-CG 4.49Å; A257-F353 HydrophobicContact CB-CZ 3.96Å; A257-F353 WeakPolarHBondContact O-CZ 3.12Å
258	R	96.6	Very high	94.9	Very high	157 Å²	157	39.2 Å²	39.2	59%	0.592	20%	0.204	S	C	*	.	H	α-helix	trans	-66.7	-42.8	176.8	-172	-176.2	-59.9	160.5	5.1	112.2	E254 G255 V256 F260 E261 V262	E254-R258 VanDerWaalsContact O-CB 3.3Å; E254-R258 WeakPolarHBondContact O-CB 3.11Å; E254-R258 PolarHBondContact O-N 3.24Å; G255-R258 PolarHBondContact O-N 2.9Å; V256-R258 VanDerWaalsContact C-N 3.33Å; V256-R258 PolarHBondContact O-N 2.52Å; R258-F260 VanDerWaalsContact C-N 3.3Å; R258-F260 PolarHBondContact O-N 3.25Å; R258-E261 PolarHBondContact O-N 2.8Å; R258-V262 HydrophobicContact CG-CG2 4.46Å; R258-V262 VanDerWaalsContact O-CG2 3.32Å; R258-V262 WeakPolarHBondContact O-CG2 3.37Å; R258-V262 PolarHBondContact O-N 3.32Å
259	I	95.2	Very high	94.7	Very high	38 Å²	38	42.7 Å²	42.7	20%	0.195	23%	0.233	C	C	.	.	H	α-helix	trans	-58.4	-47.7	174.9	-70	166.7	0	0	0	109.6	L216 I220 G255 V256 V262 Q263 L283	L216-I259 HydrophobicContact CD1-CG2 3.95Å; L216-I259 HydrophobicContact CD2-CG2 4.02Å; L216-I259 HydrophobicContact CG-CG2 4.5Å; I220-I259 HydrophobicContact CD1-CD1 4.12Å; I220-I259 HydrophobicContact CG1-CD1 3.62Å; G255-I259 VanDerWaalsContact O-CG1 3.31Å; G255-I259 WeakPolarHBondContact O-CG1 3.49Å; G255-I259 PolarHBondContact O-N 2.8Å; V256-I259 PolarHBondContact O-N 2.92Å; I259-V262 PolarHBondContact O-N 3.27Å; I259-Q263 HydrophobicContact CG2-CG 4.47Å; I259-Q263 WeakPolarHBondContact O-CB 3.14Å; I259-Q263 VanDerWaalsContact O-CG 3.28Å; I259-Q263 WeakPolarHBondContact O-CG 3.38Å; I259-Q263 PolarHBondContact O-N 3.28Å; I259-L283 HydrophobicContact CG2-CD1 4.1Å
260	F	95.9	Very high	94.5	Very high	2 Å²	2	47.6 Å²	47.6	1%	0.009	25%	0.252	C	S	.	.	H	α-helix	trans	-61.4	-48.5	177.6	-173.4	-100.3	0	0	0	111.4	V256 A257 R258 V262 Q263 Q264 V276 F279 W280 L283 F353 L354 R357 I358	V256-F260 WeakPolarHBondContact O-CB 3.38Å; V256-F260 PolarHBondContact O-N 2.84Å; A257-F260 PolarHBondContact O-N 3.45Å; R258-F260 VanDerWaalsContact C-N 3.3Å; R258-F260 PolarHBondContact O-N 3.25Å; F260-V262 VanDerWaalsContact C-N 3.32Å; F260-V262 PolarHBondContact O-N 3.07Å; F260-Q263 PolarHBondContact O-N 2.82Å; F260-Q264 HydrophobicContact CD1-CB 4.47Å; F260-Q264 HydrophobicContact CE1-CB 4.26Å; F260-Q264 HydrophobicContact CE1-CG 4.3Å; F260-Q264 VanDerWaalsContact CE1-OE1 3.28Å; F260-Q264 HydrophobicContact CZ-CB 4.36Å; F260-Q264 HydrophobicContact CZ-CG 4.32Å; F260-Q264 WeakPolarHBondContact O-CA 3.03Å; F260-Q264 WeakPolarHBondContact O-CB 3.49Å; F260-Q264 PolarHBondContact O-N 3.3Å; F260-V276 HydrophobicContact CE2-CG1 4.29Å; F260-V276 HydrophobicContact CZ-CG1 3.95Å; F260-F279 AromaticContact CD2-CD1 3.91Å; F260-F279 HydrophobicContact CD2-CD1 3.91Å; F260-F279 AromaticContact CD2-CE1 3.79Å; F260-F279 HydrophobicContact CD2-CE1 3.79Å; F260-F279 AromaticContact CE2-CD1 3.88Å; F260-F279 HydrophobicContact CE2-CD1 3.88Å; F260-F279 HydrophobicContact CE2-CE1 4.21Å; F260-W280 HydrophobicContact CD2-CB 4.47Å; F260-W280 HydrophobicContact CE2-CB 3.75Å; F260-W280 HydrophobicContact CE2-CG 4.49Å; F260-W280 HydrophobicContact CZ-CB 4.36Å; F260-L283 HydrophobicContact CB-CD1 4.18Å; F260-L283 HydrophobicContact CD2-CD1 4.11Å; F260-F353 HydrophobicContact CD1-CE1 4.24Å; F260-L354 HydrophobicContact CD1-CD2 4.49Å; F260-R357 HydrophobicContact CE1-CB 4.03Å; F260-I358 HydrophobicContact CE1-CG1 4.09Å; F260-I358 HydrophobicContact CZ-CD1 3.99Å; F260-I358 HydrophobicContact CZ-CG1 3.73Å
261	E	95.2	Very high	94.3	Very high	83 Å²	83	47 Å²	47	39%	0.388	25%	0.248	S	C	.	.	H	α-helix	trans	-57.3	-40.9	179.9	-177.9	171.4	-140.6	0	0	113.4	A257 R258 P265 F353 R357	A257-E261 VanDerWaalsContact O-CB 3.28Å; A257-E261 WeakPolarHBondContact O-CB 3.35Å; A257-E261 PolarHBondContact O-N 3.13Å; R258-E261 PolarHBondContact O-N 2.8Å; E261-P265 WeakPolarHBondContact O-CD 3.4Å; E261-F353 HydrophobicContact CB-CZ 4.18Å; E261-R357 IonicContact OE1-CZ 3.33Å; E261-R357 IonicContact OE1-NH2 3.24Å; E261-R357 PolarHBondContact OE1-NH2 3.05Å
262	V	94.6	Very high	94	Very high	84 Å²	84	43.7 Å²	43.7	51%	0.509	24%	0.236	S	C	.	.	H	α-helix	trans	-75.9	-38.9	-179.3	173.6	0	0	0	0	111.7	R258 I259 F260	R258-V262 HydrophobicContact CG-CG2 4.46Å; R258-V262 VanDerWaalsContact O-CG2 3.32Å; R258-V262 WeakPolarHBondContact O-CG2 3.37Å; R258-V262 PolarHBondContact O-N 3.32Å; I259-V262 PolarHBondContact O-N 3.27Å; F260-V262 VanDerWaalsContact C-N 3.32Å; F260-V262 PolarHBondContact O-N 3.07Å
263	Q	93.2	Very high	93.6	Very high	18 Å²	18	45 Å²	45	8%	0.084	24%	0.243	C	C	.	.	H	α-helix	trans	-88.9	-24.8	-173.7	-60.9	-55.7	-36.5	0	0	113.4	F212 I259 F260 I266 V267 F279	F212-Q263 HydrophobicContact CE1-CB 4.42Å; F212-Q263 HydrophobicContact CE1-CG 4.21Å; F212-Q263 HydrophobicContact CZ-CG 4.09Å; I259-Q263 HydrophobicContact CG2-CG 4.47Å; I259-Q263 WeakPolarHBondContact O-CB 3.14Å; I259-Q263 VanDerWaalsContact O-CG 3.28Å; I259-Q263 WeakPolarHBondContact O-CG 3.38Å; I259-Q263 PolarHBondContact O-N 3.28Å; F260-Q263 PolarHBondContact O-N 2.82Å; Q263-I266 WeakPolarHBondContact O-CB 3.32Å; Q263-I266 PolarHBondContact O-N 3.48Å; Q263-I266 VanDerWaalsContact O-N 3.07Å; Q263-V267 PolarHBondContact O-N 3.06Å; Q263-F279 HydrophobicContact CB-CE1 3.95Å; Q263-F279 HydrophobicContact CB-CZ 3.62Å; Q263-F279 HydrophobicContact CG-CZ 4.33Å
264	Q	93.3	Very high	93.1	Very high	8 Å²	8	48.2 Å²	48.2	4%	0.037	26%	0.26	C	S	.	.	H	α-helix	trans	-52.1	-49.1	-178	169.8	-179.3	18.1	0	0	113.2	F260 I266 V267 E268 V276 S361	F260-Q264 HydrophobicContact CD1-CB 4.47Å; F260-Q264 HydrophobicContact CE1-CB 4.26Å; F260-Q264 HydrophobicContact CE1-CG 4.3Å; F260-Q264 VanDerWaalsContact CE1-OE1 3.28Å; F260-Q264 HydrophobicContact CZ-CB 4.36Å; F260-Q264 HydrophobicContact CZ-CG 4.32Å; F260-Q264 WeakPolarHBondContact O-CA 3.03Å; F260-Q264 WeakPolarHBondContact O-CB 3.49Å; F260-Q264 PolarHBondContact O-N 3.3Å; Q264-I266 PolarHBondContact O-N 3.06Å; Q264-V267 PolarHBondContact O-N 3.28Å; Q264-E268 HydrophobicContact CG-CG 4.34Å; Q264-E268 WeakPolarHBondContact CG-OE1 3.37Å; Q264-E268 PolarHBondContact NE2-OE1 2.85Å; Q264-E268 WeakPolarHBondContact O-CB 3.39Å; Q264-E268 WeakPolarHBondContact O-CG 3.42Å; Q264-E268 PolarHBondContact O-N 3.42Å; Q264-V276 HydrophobicContact CG-CG1 4.45Å; Q264-S361 PolarHBondContact NE2-OG 3.01Å
265	P	93	Very high	92.8	Very high	72 Å²	72	44.4 Å²	44.4	47%	0.468	24%	0.242	S	C	.	.	H	α-helix	trans	-62.2	-31.4	179.6	-23.7	34.7	0	0	0	113.6	E261 A269	E261-P265 WeakPolarHBondContact O-CD 3.4Å; P265-A269 VanDerWaalsContact O-CB 3.25Å; P265-A269 WeakPolarHBondContact O-CB 3.37Å; P265-A269 PolarHBondContact O-N 2.91Å
266	I	91.6	Very high	92.7	Very high	29 Å²	29	43.1 Å²	43.1	15%	0.149	23%	0.229	C	C	.	.	H	α-helix	trans	-71.9	-44	177.9	-57.6	174.6	0	0	0	109.5	F196 K197 Q263 Q264 A269 Y270	F196-I266 HydrophobicContact CD1-CG2 4.31Å; F196-I266 HydrophobicContact CE1-CG2 4.36Å; K197-I266 HydrophobicContact CG-CG2 4.44Å; Q263-I266 WeakPolarHBondContact O-CB 3.32Å; Q263-I266 PolarHBondContact O-N 3.48Å; Q263-I266 VanDerWaalsContact O-N 3.07Å; Q264-I266 PolarHBondContact O-N 3.06Å; I266-A269 PolarHBondContact O-N 3.1Å; I266-Y270 HydrophobicContact CG2-CD2 3.97Å; I266-Y270 HydrophobicContact CG2-CE2 4.37Å; I266-Y270 WeakPolarHBondContact O-CD2 3.28Å; I266-Y270 PolarHBondContact O-N 3.44Å; I266-Y270 VanDerWaalsContact O-N 3.09Å
267	V	93.9	Very high	92.5	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-63.2	-44.7	176.1	-179.7	0	0	0	0	110.4	F196 Q263 Q264 A269 Y271 G272 K275 V276 F279	F196-V267 HydrophobicContact CE1-CG2 4.18Å; F196-V267 HydrophobicContact CZ-CG2 4.22Å; Q263-V267 PolarHBondContact O-N 3.06Å; Q264-V267 PolarHBondContact O-N 3.28Å; V267-A269 PolarHBondContact O-N 3.26Å; V267-Y271 WeakPolarHBondContact O-CA 3.46Å; V267-Y271 VanDerWaalsContact O-CB 3.31Å; V267-Y271 WeakPolarHBondContact O-CB 3.28Å; V267-Y271 PolarHBondContact O-N 2.82Å; V267-G272 PolarHBondContact O-N 3.33Å; V267-G272 VanDerWaalsContact O-N 3.13Å; V267-K275 HydrophobicContact CG1-CB 4.34Å; V267-V276 HydrophobicContact CB-CG2 4.5Å; V267-V276 HydrophobicContact CG1-CG2 4.02Å; V267-F279 HydrophobicContact CG1-CB 4.28Å; V267-F279 HydrophobicContact CG2-CD1 4.08Å; V267-F279 HydrophobicContact CG2-CD2 4.28Å; V267-F279 HydrophobicContact CG2-CE1 4.33Å; V267-F279 HydrophobicContact CG2-CE2 4.49Å; V267-F279 HydrophobicContact CG2-CG 4.06Å
268	E	92	Very high	92.3	Very high	56 Å²	56	46.1 Å²	46.1	26%	0.262	25%	0.245	S	C	.	.	H	α-helix	trans	-59.4	-45.3	177.4	-76	173.3	-172.9	0	0	112.7	Q264 G272 V276 S361	Q264-E268 HydrophobicContact CG-CG 4.34Å; Q264-E268 WeakPolarHBondContact CG-OE1 3.37Å; Q264-E268 PolarHBondContact NE2-OE1 2.85Å; Q264-E268 WeakPolarHBondContact O-CB 3.39Å; Q264-E268 WeakPolarHBondContact O-CG 3.42Å; Q264-E268 PolarHBondContact O-N 3.42Å; E268-G272 PolarHBondContact O-N 3.35Å; E268-V276 HydrophobicContact CB-CG2 4.46Å; E268-V276 HydrophobicContact CG-CG2 3.39Å; E268-S361 WeakPolarHBondContact OE1-CB 3.16Å; E268-S361 PolarHBondContact OE1-OG 3.38Å
269	A	90.8	Very high	92.2	Very high	78 Å²	78	38.7 Å²	38.7	65%	0.645	22%	0.217	S	C	*	.	H	α-helix	trans	-72.7	-37.8	-175.8	0	0	0	0	0	113.7	P265 I266 V267	P265-A269 VanDerWaalsContact O-CB 3.25Å; P265-A269 WeakPolarHBondContact O-CB 3.37Å; P265-A269 PolarHBondContact O-N 2.91Å; I266-A269 PolarHBondContact O-N 3.1Å; V267-A269 PolarHBondContact O-N 3.26Å
270	Y	89.9	Confident	92.2	Very high	102 Å²	102	37 Å²	37	40%	0.4	21%	0.208	S	C	.	.	H	α-helix	trans	-104.6	-31.3	-171.7	-69.4	-88.1	0	0	0	114.2	K197 P200 I266	K197-Y270 HydrophobicContact CB-CD1 4.04Å; K197-Y270 HydrophobicContact CB-CE1 4.04Å; K197-Y270 HydrophobicContact CB-CG 4.42Å; K197-Y270 HydrophobicContact CD-CE1 4.17Å; K197-Y270 HydrophobicContact CD-CE2 3.92Å; K197-Y270 HydrophobicContact CG-CD1 4.13Å; K197-Y270 HydrophobicContact CG-CD2 4.01Å; K197-Y270 HydrophobicContact CG-CE1 4.03Å; K197-Y270 HydrophobicContact CG-CE2 3.9Å; K197-Y270 HydrophobicContact CG-CG 4.13Å; P200-Y270 WeakPolarHBondContact CB-O 3.31Å; P200-Y270 WeakPolarHBondContact CG-O 3.47Å; I266-Y270 HydrophobicContact CG2-CD2 3.97Å; I266-Y270 HydrophobicContact CG2-CE2 4.37Å; I266-Y270 WeakPolarHBondContact O-CD2 3.28Å; I266-Y270 PolarHBondContact O-N 3.44Å; I266-Y270 VanDerWaalsContact O-N 3.09Å
271	Y	92.6	Very high	92.1	Very high	5 Å²	5	38.7 Å²	38.7	2%	0.02	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.5	-26.6	-176.1	-73.5	-100.1	0	0	0	113	F196 F199 P200 Q205 I209 V267	F196-Y271 AromaticContact CD1-CE2 3.9Å; F196-Y271 HydrophobicContact CD1-CE2 3.9Å; F196-Y271 HydrophobicContact CD2-CE2 4.04Å; F196-Y271 AromaticContact CD2-CZ 3.81Å; F196-Y271 WeakPolarHBondContact CD2-OH 3.41Å; F196-Y271 HydrophobicContact CE1-CD2 4.04Å; F196-Y271 AromaticContact CE1-CE2 3.42Å; F196-Y271 HydrophobicContact CE1-CE2 3.42Å; F196-Y271 VanDerWaalsContact CE1-CE2 3.42Å; F196-Y271 HydrophobicContact CE2-CE1 4.21Å; F196-Y271 AromaticContact CE2-CE2 3.57Å; F196-Y271 HydrophobicContact CE2-CE2 3.57Å; F196-Y271 AromaticContact CE2-CZ 3.34Å; F196-Y271 WeakPolarHBondContact CE2-OH 3.42Å; F196-Y271 HydrophobicContact CG-CE2 4.19Å; F196-Y271 AromaticContact CZ-CD2 3.88Å; F196-Y271 HydrophobicContact CZ-CD2 3.88Å; F196-Y271 HydrophobicContact CZ-CE1 4.38Å; F196-Y271 AromaticContact CZ-CE2 3.23Å; F196-Y271 HydrophobicContact CZ-CE2 3.23Å; F196-Y271 AromaticContact CZ-CZ 3.51Å; F196-Y271 WeakPolarHBondContact O-CE2 3.27Å; F196-Y271 PolarHBondContact O-OH 3.06Å; F199-Y271 WeakPolarHBondContact CB-OH 3.16Å; P200-Y271 HydrophobicContact CG-CD1 3.67Å; P200-Y271 HydrophobicContact CG-CD2 3.66Å; P200-Y271 HydrophobicContact CG-CE1 3.56Å; P200-Y271 HydrophobicContact CG-CE2 3.49Å; P200-Y271 VanDerWaalsContact CG-CE2 3.49Å; P200-Y271 HydrophobicContact CG-CG 3.75Å; P200-Y271 VanDerWaalsContact CG-CZ 3.47Å; Q205-Y271 HydrophobicContact CB-CD1 3.9Å; Q205-Y271 HydrophobicContact CB-CE1 4.2Å; Q205-Y271 HydrophobicContact CG-CD1 4.08Å; Q205-Y271 PolarHBondContact NE2-O 3.24Å; Q205-Y271 WeakPolarHBondContact O-CE1 3.38Å; I209-Y271 HydrophobicContact CD1-CD1 3.39Å; I209-Y271 HydrophobicContact CD1-CE1 3.91Å; I209-Y271 HydrophobicContact CD1-CG 4.12Å; I209-Y271 HydrophobicContact CG1-CD1 3.49Å; I209-Y271 VanDerWaalsContact CG1-CD1 3.49Å; I209-Y271 HydrophobicContact CG1-CE1 3.53Å; I209-Y271 HydrophobicContact CG1-CG 4.19Å; V267-Y271 WeakPolarHBondContact O-CA 3.46Å; V267-Y271 VanDerWaalsContact O-CB 3.31Å; V267-Y271 WeakPolarHBondContact O-CB 3.28Å; V267-Y271 PolarHBondContact O-N 2.82Å
272	G	88.2	Confident	92.1	Very high	23 Å²	23	35.8 Å²	35.8	24%	0.237	21%	0.207	C	C	.	.			trans	100.3	165.9	-176.8	0	0	0	0	0	113.3	V267 E268 D274 K275	V267-G272 PolarHBondContact O-N 3.33Å; V267-G272 VanDerWaalsContact O-N 3.13Å; E268-G272 PolarHBondContact O-N 3.35Å; G272-D274 PolarHBondContact O-N 3.05Å; G272-K275 PolarHBondContact O-N 2.74Å
273	I	87.3	Confident	92.2	Very high	35 Å²	35	31.8 Å²	31.8	18%	0.179	18%	0.183	C	C	.	.	H	α-helix	trans	-71.5	-31.1	-171	-65.5	161.3	0	0	0	111.9	K275 V276 L362 L365	I273-K275 VanDerWaalsContact C-N 3.28Å; I273-K275 PolarHBondContact O-N 3.46Å; I273-V276 WeakPolarHBondContact O-CB 3.45Å; I273-V276 PolarHBondContact O-N 2.86Å; I273-L362 HydrophobicContact CG2-CD1 4.37Å; I273-L365 HydrophobicContact CB-CD2 4.15Å; I273-L365 HydrophobicContact CD1-CD2 3.46Å; I273-L365 VanDerWaalsContact CD1-CD2 3.46Å; I273-L365 HydrophobicContact CD1-CG 3.93Å; I273-L365 HydrophobicContact CG1-CD2 4.39Å; I273-L365 HydrophobicContact CG2-CD1 4.03Å; I273-L365 HydrophobicContact CG2-CD2 4.19Å; I273-L365 HydrophobicContact CG2-CG 4.15Å
274	D	86.9	Confident	92.4	Very high	74 Å²	74	31.2 Å²	31.2	40%	0.396	18%	0.18	S	C	.	.	H	α-helix	trans	-60.5	-39.5	175.1	63.3	-48.8	0	0	0	111.7	G272 V276 L277	G272-D274 PolarHBondContact O-N 3.05Å; D274-V276 VanDerWaalsContact C-N 3.29Å; D274-V276 PolarHBondContact O-N 2.81Å; D274-L277 PolarHBondContact O-N 3.39Å
275	K	90.6	Very high	92.5	Very high	25 Å²	25	35.5 Å²	35.5	11%	0.109	20%	0.2	C	C	.	.	H	α-helix	trans	-73.2	-18	179.3	-64.9	-49	-179.9	179.3	0	113.9	D206 I209 V267 G272 I273 L277 V278 F279	D206-K275 IonicContact OD1-NZ 3.55Å; D206-K275 PolarHBondContact OD1-NZ 3.2Å; D206-K275 IonicContact OD2-NZ 3.76Å; I209-K275 HydrophobicContact CD1-CB 3.45Å; I209-K275 VanDerWaalsContact CD1-CB 3.45Å; I209-K275 HydrophobicContact CD1-CD 3.56Å; I209-K275 HydrophobicContact CD1-CG 3.5Å; V267-K275 HydrophobicContact CG1-CB 4.34Å; G272-K275 PolarHBondContact O-N 2.74Å; I273-K275 VanDerWaalsContact C-N 3.28Å; I273-K275 PolarHBondContact O-N 3.46Å; K275-L277 VanDerWaalsContact C-N 3.28Å; K275-L277 PolarHBondContact O-N 2.71Å; K275-V278 PolarHBondContact O-N 2.65Å; K275-F279 VanDerWaalsContact O-CB 3.31Å; K275-F279 WeakPolarHBondContact O-CB 3.49Å; K275-F279 PolarHBondContact O-N 3.03Å
276	V	92.5	Very high	92.6	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-62.7	-37.3	172.7	-179.7	0	0	0	0	111.2	F260 Q264 V267 E268 I273 D274 F279 W280	F260-V276 HydrophobicContact CE2-CG1 4.29Å; F260-V276 HydrophobicContact CZ-CG1 3.95Å; Q264-V276 HydrophobicContact CG-CG1 4.45Å; V267-V276 HydrophobicContact CB-CG2 4.5Å; V267-V276 HydrophobicContact CG1-CG2 4.02Å; E268-V276 HydrophobicContact CB-CG2 4.46Å; E268-V276 HydrophobicContact CG-CG2 3.39Å; I273-V276 WeakPolarHBondContact O-CB 3.45Å; I273-V276 PolarHBondContact O-N 2.86Å; D274-V276 VanDerWaalsContact C-N 3.29Å; D274-V276 PolarHBondContact O-N 2.81Å; V276-F279 PolarHBondContact O-N 3.49Å; V276-W280 WeakPolarHBondContact O-CB 3.31Å; V276-W280 PolarHBondContact O-N 2.84Å
277	L	92.7	Very high	92.8	Very high	17 Å²	17	31.8 Å²	31.8	9%	0.089	18%	0.176	C	C	.	.	H	α-helix	trans	-69.5	-39.1	177.6	-65.6	179.5	0	0	0	111.9	D274 K275 S281 I358 L362 M379 F383	D274-L277 PolarHBondContact O-N 3.39Å; K275-L277 VanDerWaalsContact C-N 3.28Å; K275-L277 PolarHBondContact O-N 2.71Å; L277-S281 WeakPolarHBondContact O-CB 3.14Å; L277-S281 PolarHBondContact O-N 2.68Å; L277-S281 PolarHBondContact O-OG 3.18Å; L277-I358 HydrophobicContact CD2-CG2 3.6Å; L277-L362 HydrophobicContact CD2-CD1 4.35Å; L277-M379 HydrophobicContact CD1-CB 4.03Å; L277-M379 HydrophobicContact CD1-CG 4.15Å; L277-M379 HydrophobicContact CD1-SD 4.28Å; L277-F383 HydrophobicContact CD2-CB 4.07Å; L277-F383 HydrophobicContact CD2-CD2 4.15Å; L277-F383 HydrophobicContact CD2-CG 4.27Å
278	V	92.9	Very high	93	Very high	63 Å²	63	32.9 Å²	32.9	38%	0.382	18%	0.182	S	C	.	.	H	α-helix	trans	-64.1	-46.7	174.1	-178	0	0	0	0	109.9	I209 K275 W280 S281 I282	I209-V278 HydrophobicContact CG2-CG1 4.07Å; K275-V278 PolarHBondContact O-N 2.65Å; V278-W280 PolarHBondContact O-N 3.03Å; V278-S281 WeakPolarHBondContact O-CB 3.35Å; V278-S281 PolarHBondContact O-N 3.31Å; V278-I282 HydrophobicContact CG1-CD1 4.23Å; V278-I282 WeakPolarHBondContact O-CG1 3.46Å; V278-I282 PolarHBondContact O-N 2.91Å
279	F	94.9	Very high	93.2	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-58.4	-48.9	176.4	177.4	-113.3	0	0	0	112.2	F212 L216 F260 Q263 V267 K275 V276 S281 I282 L283	F212-F279 AromaticContact CD1-CE2 3.99Å; F212-F279 HydrophobicContact CD1-CE2 3.99Å; F212-F279 AromaticContact CE1-CE2 3.93Å; F212-F279 HydrophobicContact CE1-CE2 3.93Å; F212-F279 HydrophobicContact CE1-CZ 4.36Å; L216-F279 HydrophobicContact CD1-CE2 3.51Å; L216-F279 HydrophobicContact CD1-CZ 3.69Å; F260-F279 AromaticContact CD2-CD1 3.91Å; F260-F279 HydrophobicContact CD2-CD1 3.91Å; F260-F279 AromaticContact CD2-CE1 3.79Å; F260-F279 HydrophobicContact CD2-CE1 3.79Å; F260-F279 AromaticContact CE2-CD1 3.88Å; F260-F279 HydrophobicContact CE2-CD1 3.88Å; F260-F279 HydrophobicContact CE2-CE1 4.21Å; Q263-F279 HydrophobicContact CB-CE1 3.95Å; Q263-F279 HydrophobicContact CB-CZ 3.62Å; Q263-F279 HydrophobicContact CG-CZ 4.33Å; V267-F279 HydrophobicContact CG1-CB 4.28Å; V267-F279 HydrophobicContact CG2-CD1 4.08Å; V267-F279 HydrophobicContact CG2-CD2 4.28Å; V267-F279 HydrophobicContact CG2-CE1 4.33Å; V267-F279 HydrophobicContact CG2-CE2 4.49Å; V267-F279 HydrophobicContact CG2-CG 4.06Å; K275-F279 VanDerWaalsContact O-CB 3.31Å; K275-F279 WeakPolarHBondContact O-CB 3.49Å; K275-F279 PolarHBondContact O-N 3.03Å; V276-F279 PolarHBondContact O-N 3.49Å; F279-S281 VanDerWaalsContact C-N 3.34Å; F279-S281 PolarHBondContact O-N 2.89Å; F279-I282 PolarHBondContact O-N 3.14Å; F279-L283 HydrophobicContact CD1-CD1 4.46Å; F279-L283 HydrophobicContact CE1-CD1 3.8Å; F279-L283 HydrophobicContact CE2-CD1 4.35Å; F279-L283 HydrophobicContact CE2-CD2 4.47Å; F279-L283 HydrophobicContact CE2-CG 4.43Å; F279-L283 HydrophobicContact CZ-CD1 3.73Å; F279-L283 HydrophobicContact CZ-CG 4.29Å; F279-L283 PolarHBondContact O-N 2.94Å
280	W	94.9	Very high	93.4	Very high	4 Å²	4	31 Å²	31	2%	0.015	16%	0.161	C	C	.	.	H	α-helix	trans	-57.3	-46.4	174.3	167	71.3	0	0	0	111.7	F260 V276 V278 I282 L283 Q284 L354 I358 F383 Q386 L387	F260-W280 HydrophobicContact CD2-CB 4.47Å; F260-W280 HydrophobicContact CE2-CB 3.75Å; F260-W280 HydrophobicContact CE2-CG 4.49Å; F260-W280 HydrophobicContact CZ-CB 4.36Å; V276-W280 WeakPolarHBondContact O-CB 3.31Å; V276-W280 PolarHBondContact O-N 2.84Å; V278-W280 PolarHBondContact O-N 3.03Å; W280-I282 VanDerWaalsContact C-N 3.28Å; W280-I282 PolarHBondContact O-N 2.88Å; W280-L283 PolarHBondContact O-N 3.45Å; W280-L283 VanDerWaalsContact O-N 3.13Å; W280-Q284 HydrophobicContact CH2-CG 4.43Å; W280-Q284 HydrophobicContact CZ2-CB 4.06Å; W280-Q284 HydrophobicContact CZ2-CG 3.77Å; W280-Q284 VanDerWaalsContact O-CB 3.32Å; W280-Q284 WeakPolarHBondContact O-CB 3.33Å; W280-Q284 PolarHBondContact O-N 3.33Å; W280-L354 VanDerWaalsContact NE1-CD1 3.34Å; W280-I358 HydrophobicContact CB-CD1 3.93Å; W280-I358 HydrophobicContact CD2-CD1 3.97Å; W280-I358 HydrophobicContact CG-CD1 3.55Å; W280-F383 HydrophobicContact CD2-CD2 4.17Å; W280-F383 AromaticContact CD2-CE2 3.85Å; W280-F383 HydrophobicContact CD2-CE2 3.85Å; W280-F383 AromaticContact CE2-CE2 3.72Å; W280-F383 AromaticContact CE3-CD2 3.81Å; W280-F383 HydrophobicContact CE3-CD2 3.81Å; W280-F383 AromaticContact CE3-CE2 3.97Å; W280-F383 HydrophobicContact CE3-CE2 3.97Å; W280-F383 AromaticContact CH2-CD2 3.9Å; W280-F383 HydrophobicContact CH2-CD2 3.9Å; W280-F383 AromaticContact CH2-CE2 3.85Å; W280-F383 HydrophobicContact CH2-CE2 3.85Å; W280-F383 HydrophobicContact CZ2-CD2 4.27Å; W280-F383 AromaticContact CZ2-CE2 3.74Å; W280-F383 HydrophobicContact CZ2-CE2 3.74Å; W280-F383 AromaticContact CZ3-CD2 3.67Å; W280-F383 HydrophobicContact CZ3-CD2 3.67Å; W280-F383 AromaticContact CZ3-CE2 3.97Å; W280-F383 HydrophobicContact CZ3-CE2 3.97Å; W280-Q386 HydrophobicContact CH2-CB 3.89Å; W280-Q386 HydrophobicContact CZ3-CB 3.96Å; W280-L387 HydrophobicContact CH2-CB 4.37Å; W280-L387 HydrophobicContact CH2-CD1 4.31Å; W280-L387 HydrophobicContact CZ2-CB 4.43Å; W280-L387 HydrophobicContact CZ2-CD1 3.56Å
281	S	94.1	Very high	93.7	Very high	36 Å²	36	26.1 Å²	26.1	25%	0.252	14%	0.142	S	C	.	.	H	α-helix	trans	-58.6	-40.4	-178.8	-62	0	0	0	0	112	L277 V278 F279 Q284 E285	L277-S281 WeakPolarHBondContact O-CB 3.14Å; L277-S281 PolarHBondContact O-N 2.68Å; L277-S281 PolarHBondContact O-OG 3.18Å; V278-S281 WeakPolarHBondContact O-CB 3.35Å; V278-S281 PolarHBondContact O-N 3.31Å; F279-S281 VanDerWaalsContact C-N 3.34Å; F279-S281 PolarHBondContact O-N 2.89Å; S281-Q284 PolarHBondContact O-N 3.36Å; S281-E285 WeakPolarHBondContact O-CB 3.39Å; S281-E285 PolarHBondContact O-N 2.98Å
282	I	94.8	Very high	93.8	Very high	22 Å²	22	26.3 Å²	26.3	11%	0.113	15%	0.146	C	C	.	.	H	α-helix	trans	-62.4	-46.1	176.1	-69.2	169.3	0	0	0	111.1	I209 K217 V278 F279 W280 E285 Q286	I209-I282 HydrophobicContact CG2-CD1 3.69Å; K217-I282 HydrophobicContact CD-CG2 4.06Å; K217-I282 WeakPolarHBondContact CE-O 3.28Å; K217-I282 HydrophobicContact CG-CG2 3.99Å; V278-I282 HydrophobicContact CG1-CD1 4.23Å; V278-I282 WeakPolarHBondContact O-CG1 3.46Å; V278-I282 PolarHBondContact O-N 2.91Å; F279-I282 PolarHBondContact O-N 3.14Å; W280-I282 VanDerWaalsContact C-N 3.28Å; W280-I282 PolarHBondContact O-N 2.88Å; I282-E285 PolarHBondContact O-N 3.21Å; I282-Q286 PolarHBondContact O-N 3.08Å
283	L	96.1	Very high	94.1	Very high	1 Å²	1	29.1 Å²	29.1	1%	0.005	15%	0.149	C	C	.	.	H	α-helix	trans	-68.5	-40.7	178.3	-60.2	-172.3	0	0	0	111.7	L216 I220 V256 I259 F260 F279 W280 E285 Q286 C287	L216-L283 HydrophobicContact CB-CD2 3.77Å; L216-L283 HydrophobicContact CD1-CD2 3.9Å; I220-L283 HydrophobicContact CD1-CD2 3.82Å; V256-L283 HydrophobicContact CG1-CB 4.37Å; I259-L283 HydrophobicContact CG2-CD1 4.1Å; F260-L283 HydrophobicContact CB-CD1 4.18Å; F260-L283 HydrophobicContact CD2-CD1 4.11Å; F279-L283 HydrophobicContact CD1-CD1 4.46Å; F279-L283 HydrophobicContact CE1-CD1 3.8Å; F279-L283 HydrophobicContact CE2-CD1 4.35Å; F279-L283 HydrophobicContact CE2-CD2 4.47Å; F279-L283 HydrophobicContact CE2-CG 4.43Å; F279-L283 HydrophobicContact CZ-CD1 3.73Å; F279-L283 HydrophobicContact CZ-CG 4.29Å; F279-L283 PolarHBondContact O-N 2.94Å; W280-L283 PolarHBondContact O-N 3.45Å; W280-L283 VanDerWaalsContact O-N 3.13Å; L283-E285 VanDerWaalsContact C-N 3.28Å; L283-E285 PolarHBondContact O-N 3.29Å; L283-Q286 PolarHBondContact O-N 2.87Å; L283-C287 WeakPolarHBondContact O-CB 3.43Å; L283-C287 PolarHBondContact O-N 2.77Å
284	Q	96.4	Very high	94.5	Very high	5 Å²	5	27.6 Å²	27.6	2%	0.023	14%	0.141	C	C	.	.	H	α-helix	trans	-62.9	-36.8	178.6	-174.2	62.1	60.4	0	0	111.2	W280 S281 C287 N288 Y350	W280-Q284 HydrophobicContact CH2-CG 4.43Å; W280-Q284 HydrophobicContact CZ2-CB 4.06Å; W280-Q284 HydrophobicContact CZ2-CG 3.77Å; W280-Q284 VanDerWaalsContact O-CB 3.32Å; W280-Q284 WeakPolarHBondContact O-CB 3.33Å; W280-Q284 PolarHBondContact O-N 3.33Å; S281-Q284 PolarHBondContact O-N 3.36Å; Q284-C287 PolarHBondContact O-N 2.86Å; Q284-N288 PolarHBondContact NE2-OD1 3.4Å; Q284-N288 WeakPolarHBondContact O-CB 3.24Å; Q284-N288 PolarHBondContact O-N 2.96Å; Q284-N288 PolarHBondContact O-ND2 2.92Å; Q284-Y350 PolarHBondContact OE1-OH 3.06Å
285	E	95.9	Very high	94.9	Very high	99 Å²	99	24.2 Å²	24.2	46%	0.463	12%	0.123	S	C	.	.	H	α-helix	trans	-59.2	-47.8	175.1	-169.2	-173.1	161.6	0	0	111.7	K217 S281 I282 L283 N288 I289	K217-E285 IonicContact NZ-OE1 2.86Å; K217-E285 IonicContact NZ-OE2 3.22Å; K217-E285 PolarHBondContact NZ-OE2 3.48Å; S281-E285 WeakPolarHBondContact O-CB 3.39Å; S281-E285 PolarHBondContact O-N 2.98Å; I282-E285 PolarHBondContact O-N 3.21Å; L283-E285 VanDerWaalsContact C-N 3.28Å; L283-E285 PolarHBondContact O-N 3.29Å; E285-N288 WeakPolarHBondContact O-CB 3.47Å; E285-N288 PolarHBondContact O-N 3.2Å; E285-I289 WeakPolarHBondContact O-CG1 3.49Å; E285-I289 PolarHBondContact O-N 3.15Å
286	Q	95.6	Very high	95.1	Very high	23 Å²	23	26.2 Å²	26.2	11%	0.107	14%	0.135	C	C	.	.	H	α-helix	trans	-69.3	-39.8	177	-167.2	64.3	31.3	0	0	112.2	K217 I220 I282 L283 N288 I289 E290	K217-Q286 HydrophobicContact CB-CB 4.34Å; K217-Q286 HydrophobicContact CB-CG 4.34Å; K217-Q286 HydrophobicContact CG-CB 4.01Å; I220-Q286 HydrophobicContact CB-CG 3.98Å; I220-Q286 HydrophobicContact CG2-CB 4.29Å; I220-Q286 HydrophobicContact CG2-CG 3.71Å; I282-Q286 PolarHBondContact O-N 3.08Å; L283-Q286 PolarHBondContact O-N 2.87Å; Q286-N288 PolarHBondContact O-N 3.38Å; Q286-I289 PolarHBondContact O-N 3.38Å; Q286-I289 VanDerWaalsContact O-N 3.1Å; Q286-E290 PolarHBondContact NE2-OE1 3.33Å; Q286-E290 PolarHBondContact O-N 3.24Å
287	C	96.5	Very high	95.1	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-56.7	-41.5	174.8	-176.2	0	0	0	0	111.2	V256 L283 Q284 I289 A291	V256-C287 HydrophobicContact CG1-CB 4.35Å; V256-C287 HydrophobicContact CG2-CB 4.16Å; L283-C287 WeakPolarHBondContact O-CB 3.43Å; L283-C287 PolarHBondContact O-N 2.77Å; Q284-C287 PolarHBondContact O-N 2.86Å; C287-I289 VanDerWaalsContact C-N 3.34Å; C287-I289 PolarHBondContact O-N 3.5Å; C287-A291 WeakPolarHBondContact O-CB 3.45Å; C287-A291 PolarHBondContact O-N 3.17Å
288	N	97	Very high	95.2	Very high	22 Å²	22	26.2 Å²	26.2	12%	0.118	14%	0.136	C	C	.	.	H	α-helix	trans	-62.1	-38.7	176.4	-72.1	-30.6	0	0	0	112.7	Q284 E285 Q286 G292 N391 L392	Q284-N288 PolarHBondContact NE2-OD1 3.4Å; Q284-N288 WeakPolarHBondContact O-CB 3.24Å; Q284-N288 PolarHBondContact O-N 2.96Å; Q284-N288 PolarHBondContact O-ND2 2.92Å; E285-N288 WeakPolarHBondContact O-CB 3.47Å; E285-N288 PolarHBondContact O-N 3.2Å; Q286-N288 PolarHBondContact O-N 3.38Å; N288-G292 WeakPolarHBondContact O-CA 3.28Å; N288-G292 PolarHBondContact O-N 2.83Å; N288-N391 HydrophobicContact CB-CB 4.09Å; N288-L392 WeakPolarHBondContact OD1-CB 3.46Å; N288-L392 PolarHBondContact OD1-N 2.94Å; N288-L392 VanDerWaalsContact OD1-N 3.16Å
289	I	96	Very high	95.3	Very high	85 Å²	85	24.1 Å²	24.1	44%	0.436	12%	0.122	S	C	.	.	H	α-helix	trans	-66.2	-54.5	178.8	-66.8	167.3	0	0	0	109.8	E285 Q286 C287 G292 R293	E285-I289 WeakPolarHBondContact O-CG1 3.49Å; E285-I289 PolarHBondContact O-N 3.15Å; Q286-I289 PolarHBondContact O-N 3.38Å; Q286-I289 VanDerWaalsContact O-N 3.1Å; C287-I289 VanDerWaalsContact C-N 3.34Å; C287-I289 PolarHBondContact O-N 3.5Å; I289-G292 PolarHBondContact O-N 3.34Å; I289-R293 PolarHBondContact O-N 2.91Å; I289-R293 VanDerWaalsContact O-N 3.1Å
290	E	95.3	Very high	95.1	Very high	9 Å²	9	30 Å²	30	4%	0.042	15%	0.154	C	C	.	.	H	α-helix	trans	-68.2	-41	-176.6	-58	-49.1	151.8	0	0	112.1	L252 Q286 G292 R293 I294	L252-E290 HydrophobicContact CD1-CB 3.87Å; L252-E290 HydrophobicContact CD1-CG 4.37Å; L252-E290 HydrophobicContact CD2-CB 3.63Å; L252-E290 HydrophobicContact CG-CB 4.42Å; Q286-E290 PolarHBondContact NE2-OE1 3.33Å; Q286-E290 PolarHBondContact O-N 3.24Å; E290-G292 VanDerWaalsContact C-N 3.29Å; E290-G292 PolarHBondContact O-N 3.39Å; E290-R293 PolarHBondContact O-N 3.2Å; E290-R293 IonicContact OE2-CZ 2.73Å; E290-R293 IonicContact OE2-NH1 3.69Å; E290-R293 PolarHBondContact OE2-NH1 2.7Å; E290-I294 WeakPolarHBondContact O-CG1 3.41Å; E290-I294 PolarHBondContact O-N 3.16Å; E290-I294 VanDerWaalsContact O-N 3.13Å
291	A	96.3	Very high	94.9	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-63.3	-40.2	174.6	0	0	0	0	0	110.7	L249 L252 C287 R293 I294 F295 L392	L249-A291 HydrophobicContact CD1-CB 3.84Å; L252-A291 HydrophobicContact CD2-CB 3.86Å; L252-A291 VanDerWaalsContact CD2-N 3.32Å; C287-A291 WeakPolarHBondContact O-CB 3.45Å; C287-A291 PolarHBondContact O-N 3.17Å; A291-R293 VanDerWaalsContact C-N 3.32Å; A291-R293 PolarHBondContact O-N 3.48Å; A291-I294 WeakPolarHBondContact O-CB 3.22Å; A291-I294 PolarHBondContact O-N 3.02Å; A291-I294 VanDerWaalsContact O-N 3.15Å; A291-F295 WeakPolarHBondContact O-CD2 3.44Å; A291-F295 PolarHBondContact O-N 3.43Å; A291-L392 HydrophobicContact CB-CD1 3.81Å
292	G	95.6	Very high	94.7	Very high	9 Å²	9	37.2 Å²	37.2	9%	0.093	18%	0.179	C	C	.	.	H	α-helix	trans	-54.5	-46.3	175.1	0	0	0	0	0	112.5	N288 I289 E290 I294 F295 D296	N288-G292 WeakPolarHBondContact O-CA 3.28Å; N288-G292 PolarHBondContact O-N 2.83Å; I289-G292 PolarHBondContact O-N 3.34Å; E290-G292 VanDerWaalsContact C-N 3.29Å; E290-G292 PolarHBondContact O-N 3.39Å; G292-I294 PolarHBondContact O-N 2.93Å; G292-F295 PolarHBondContact O-N 3.47Å; G292-D296 VanDerWaalsContact O-CG 3.29Å; G292-D296 PolarHBondContact O-N 2.99Å
293	R	94.8	Very high	94.5	Very high	82 Å²	82	41.9 Å²	41.9	31%	0.309	20%	0.2	S	C	.	.	H	α-helix	trans	-62.1	-41.8	176.1	-66.6	173.6	65.5	-164.3	4	112.6	E225 F228 I289 E290 A291 D296 C297	E225-R293 IonicContact OE1-NH2 3.09Å; E225-R293 IonicContact OE2-CZ 3.84Å; E225-R293 IonicContact OE2-NH1 3.27Å; E225-R293 PolarHBondContact OE2-NH1 3.14Å; E225-R293 IonicContact OE2-NH2 2.8Å; E225-R293 PolarHBondContact OE2-NH2 3.27Å; F228-R293 HydrophobicContact CD2-CB 4.23Å; F228-R293 HydrophobicContact CE2-CB 4.03Å; F228-R293 WeakPolarHBondContact CE2-O 3.34Å; I289-R293 PolarHBondContact O-N 2.91Å; I289-R293 VanDerWaalsContact O-N 3.1Å; E290-R293 PolarHBondContact O-N 3.2Å; E290-R293 IonicContact OE2-CZ 2.73Å; E290-R293 IonicContact OE2-NH1 3.69Å; E290-R293 PolarHBondContact OE2-NH1 2.7Å; A291-R293 VanDerWaalsContact C-N 3.32Å; A291-R293 PolarHBondContact O-N 3.48Å; R293-D296 PolarHBondContact O-N 2.84Å; R293-C297 WeakPolarHBondContact O-CB 3.3Å; R293-C297 PolarHBondContact O-N 3.04Å
294	I	94.9	Very high	94.2	Very high	3 Å²	3	41.8 Å²	41.8	2%	0.015	20%	0.2	C	C	.	.	H	α-helix	trans	-61.7	-46.3	175.9	-64.9	167.9	0	0	0	110.2	F228 F245 A248 L249 L252 E290 A291 G292 C297 F298	F228-I294 HydrophobicContact CD2-CG1 4.09Å; F245-I294 HydrophobicContact CB-CG2 4.3Å; F245-I294 HydrophobicContact CD1-CG2 4.33Å; A248-I294 HydrophobicContact CB-CD1 4.17Å; A248-I294 HydrophobicContact CB-CG2 4.49Å; L249-I294 HydrophobicContact CB-CG2 4.34Å; L252-I294 HydrophobicContact CB-CD1 4.41Å; L252-I294 HydrophobicContact CD2-CD1 3.97Å; E290-I294 WeakPolarHBondContact O-CG1 3.41Å; E290-I294 PolarHBondContact O-N 3.16Å; E290-I294 VanDerWaalsContact O-N 3.13Å; A291-I294 WeakPolarHBondContact O-CB 3.22Å; A291-I294 PolarHBondContact O-N 3.02Å; A291-I294 VanDerWaalsContact O-N 3.15Å; G292-I294 PolarHBondContact O-N 2.93Å; I294-C297 PolarHBondContact O-N 3.31Å; I294-F298 VanDerWaalsContact O-CB 3.29Å; I294-F298 WeakPolarHBondContact O-CB 3.49Å; I294-F298 PolarHBondContact O-N 3Å
295	F	95.6	Very high	93.8	Very high	4 Å²	4	47.1 Å²	47.1	2%	0.018	22%	0.223	C	C	.	.	H	α-helix	trans	-61.3	-47.2	176	-82.9	-73.1	0	0	0	111.7	L249 A291 G292 C297 F298 M299 L343 V347 L392 R395 V396 L399	L249-F295 HydrophobicContact CD1-CE2 4.44Å; L249-F295 HydrophobicContact CD2-CE2 4.08Å; L249-F295 HydrophobicContact CD2-CZ 3.91Å; A291-F295 WeakPolarHBondContact O-CD2 3.44Å; A291-F295 PolarHBondContact O-N 3.43Å; G292-F295 PolarHBondContact O-N 3.47Å; F295-C297 PolarHBondContact O-N 3.38Å; F295-F298 WeakPolarHBondContact O-CB 3.47Å; F295-F298 PolarHBondContact O-N 2.87Å; F295-M299 WeakPolarHBondContact O-CB 3.32Å; F295-M299 WeakPolarHBondContact O-CG 3.3Å; F295-M299 PolarHBondContact O-N 3.41Å; F295-L343 HydrophobicContact CE1-CB 4.45Å; F295-L343 HydrophobicContact CE1-CD1 4.49Å; F295-V347 HydrophobicContact CZ-CG2 4.36Å; F295-L392 HydrophobicContact CE2-CD1 3.66Å; F295-L392 HydrophobicContact CZ-CD1 4.46Å; F295-R395 HydrophobicContact CD2-CB 4.03Å; F295-R395 HydrophobicContact CD2-CG 4.48Å; F295-R395 HydrophobicContact CE2-CB 4.33Å; F295-R395 HydrophobicContact CG-CB 4.18Å; F295-V396 HydrophobicContact CZ-CG2 3.98Å; F295-L399 HydrophobicContact CD1-CD2 4.37Å; F295-L399 HydrophobicContact CE1-CD2 3.74Å
296	D	94.6	Very high	93.3	Very high	66 Å²	66	45 Å²	45	35%	0.353	22%	0.219	S	C	.	.	H	α-helix	trans	-60.2	-46.7	179.6	-70.3	-31.2	0	0	0	111.1	G292 R293 F298 M299 D300 R395	G292-D296 VanDerWaalsContact O-CG 3.29Å; G292-D296 PolarHBondContact O-N 2.99Å; R293-D296 PolarHBondContact O-N 2.84Å; D296-F298 PolarHBondContact O-N 3.45Å; D296-M299 PolarHBondContact O-N 2.92Å; D296-D300 PolarHBondContact O-N 3.43Å; D296-R395 IonicContact OD1-CZ 2.65Å; D296-R395 VanDerWaalsContact OD1-CZ 3.26Å; D296-R395 IonicContact OD1-NH1 2.67Å; D296-R395 PolarHBondContact OD1-NH1 2.95Å; D296-R395 IonicContact OD1-NH2 3.35Å; D296-R395 PolarHBondContact OD1-NH2 2.88Å; D296-R395 IonicContact OD2-CZ 3.92Å; D296-R395 IonicContact OD2-NH2 3.36Å; D296-R395 PolarHBondContact OD2-NH2 3.13Å
297	C	93	Very high	92.9	Very high	18 Å²	18	46 Å²	46	12%	0.122	22%	0.223	C	C	.	.	H	α-helix	trans	-64.7	-40.1	177.5	-167.1	0	0	0	0	112.7	F228 F245 R293 I294 F295 D300 K301	F228-C297 HydrophobicContact CE2-CB 3.67Å; F228-C297 HydrophobicContact CZ-CB 4.08Å; F245-C297 HydrophobicContact CE1-CB 3.96Å; R293-C297 WeakPolarHBondContact O-CB 3.3Å; R293-C297 PolarHBondContact O-N 3.04Å; I294-C297 PolarHBondContact O-N 3.31Å; F295-C297 PolarHBondContact O-N 3.38Å; C297-D300 PolarHBondContact O-N 3.23Å; C297-K301 VanDerWaalsContact O-CB 3.25Å; C297-K301 WeakPolarHBondContact O-CB 3.28Å; C297-K301 VanDerWaalsContact O-CG 3.31Å; C297-K301 WeakPolarHBondContact O-CG 3.32Å; C297-K301 PolarHBondContact O-N 2.93Å
298	F	94.5	Very high	92.3	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-59.2	-49.2	172.9	167.3	-99	0	0	0	111.1	F245 I294 F295 D296 D300 R302 V304 L336 E339 M340 L343 L399	F245-F298 HydrophobicContact CB-CB 3.96Å; F245-F298 HydrophobicContact CB-CD2 3.84Å; F245-F298 HydrophobicContact CB-CG 4.28Å; F245-F298 HydrophobicContact CD1-CB 3.97Å; F245-F298 HydrophobicContact CD2-CB 4.05Å; F245-F298 AromaticContact CD2-CD2 3.65Å; F245-F298 HydrophobicContact CD2-CD2 3.65Å; F245-F298 HydrophobicContact CD2-CG 4.35Å; F245-F298 HydrophobicContact CE2-CD2 4.46Å; F245-F298 HydrophobicContact CG-CB 3.72Å; F245-F298 AromaticContact CG-CD2 3.91Å; F245-F298 HydrophobicContact CG-CD2 3.91Å; F245-F298 HydrophobicContact CG-CG 4.3Å; I294-F298 VanDerWaalsContact O-CB 3.29Å; I294-F298 WeakPolarHBondContact O-CB 3.49Å; I294-F298 PolarHBondContact O-N 3Å; F295-F298 WeakPolarHBondContact O-CB 3.47Å; F295-F298 PolarHBondContact O-N 2.87Å; D296-F298 PolarHBondContact O-N 3.45Å; F298-D300 VanDerWaalsContact C-N 3.3Å; F298-D300 PolarHBondContact O-N 2.87Å; F298-R302 HydrophobicContact CD2-CG 3.66Å; F298-R302 HydrophobicContact CE2-CB 4.36Å; F298-R302 HydrophobicContact CE2-CG 3.6Å; F298-R302 HydrophobicContact CG-CG 4.43Å; F298-R302 HydrophobicContact CZ-CG 4.32Å; F298-R302 VanDerWaalsContact O-CB 3.22Å; F298-R302 WeakPolarHBondContact O-CB 3.34Å; F298-R302 WeakPolarHBondContact O-CG 3.22Å; F298-R302 PolarHBondContact O-N 3.3Å; F298-V304 HydrophobicContact CD1-CG2 4.39Å; F298-V304 HydrophobicContact CE1-CG2 3.78Å; F298-V304 HydrophobicContact CZ-CG2 4.14Å; F298-L336 HydrophobicContact CE2-CD1 3.99Å; F298-L336 HydrophobicContact CZ-CD1 3.67Å; F298-E339 HydrophobicContact CE2-CB 4.34Å; F298-E339 HydrophobicContact CE2-CG 3.88Å; F298-E339 WeakPolarHBondContact CE2-OE2 3.47Å; F298-M340 HydrophobicContact CE1-CG 4.27Å; F298-M340 HydrophobicContact CZ-CG 3.78Å; F298-L343 HydrophobicContact CD1-CD1 3.93Å; F298-L343 HydrophobicContact CD2-CD1 3.95Å; F298-L343 HydrophobicContact CE1-CD1 3.84Å; F298-L343 HydrophobicContact CE2-CD1 3.85Å; F298-L343 HydrophobicContact CG-CD1 3.98Å; F298-L343 HydrophobicContact CZ-CD1 3.81Å; F298-L399 HydrophobicContact CE1-CD1 3.82Å
299	M	93.7	Very high	91.6	Very high	18 Å²	18	52.8 Å²	52.8	9%	0.089	26%	0.26	C	S	.	.	H	α-helix	trans	-60.4	-40.9	-178.5	-71	-61	-74.5	0	0	111.8	F295 D296 Q303 V304 K305 L399 L402	F295-M299 WeakPolarHBondContact O-CB 3.32Å; F295-M299 WeakPolarHBondContact O-CG 3.3Å; F295-M299 PolarHBondContact O-N 3.41Å; D296-M299 PolarHBondContact O-N 2.92Å; M299-Q303 WeakPolarHBondContact O-CA 3.49Å; M299-Q303 PolarHBondContact O-N 2.66Å; M299-Q303 VanDerWaalsContact O-N 3.12Å; M299-V304 HydrophobicContact CE-CB 3.86Å; M299-V304 HydrophobicContact CE-CG1 4.07Å; M299-V304 PolarHBondContact O-N 3.28Å; M299-V304 HydrophobicContact SD-CB 3.75Å; M299-V304 HydrophobicContact SD-CG1 4.06Å; M299-V304 HydrophobicContact SD-CG2 3.84Å; M299-K305 HydrophobicContact CE-CD 4.16Å; M299-K305 HydrophobicContact CE-CG 3.65Å; M299-L399 HydrophobicContact SD-CD1 4.1Å; M299-L402 HydrophobicContact CE-CD1 3.32Å; M299-L402 HydrophobicContact SD-CD1 4.47Å
300	D	92	Very high	90.7	Very high	123 Å²	123	51.4 Å²	51.4	66%	0.658	25%	0.254	S	S	*	.	H	α-helix	trans	-73.1	-52.9	179.1	-69.9	-16	0	0	0	112	D296 C297 F298 R302 Q303	D296-D300 PolarHBondContact O-N 3.43Å; C297-D300 PolarHBondContact O-N 3.23Å; F298-D300 VanDerWaalsContact C-N 3.3Å; F298-D300 PolarHBondContact O-N 2.87Å; D300-R302 VanDerWaalsContact C-N 3.34Å; D300-R302 PolarHBondContact O-N 3.01Å; D300-Q303 WeakPolarHBondContact O-CG 3.09Å; D300-Q303 PolarHBondContact O-N 3.39Å; D300-Q303 VanDerWaalsContact O-N 3.16Å
301	K	89.4	Confident	89.7	Confident	130 Å²	130	51.4 Å²	51.4	57%	0.565	26%	0.255	S	S	*	.	H	α-helix	trans	-66.3	-34.7	-176.5	-72.4	-79.1	-171.7	170.2	0	112.6	F245 C297	F245-K301 HydrophobicContact CE2-CB 4.19Å; F245-K301 HydrophobicContact CZ-CB 3.97Å; F245-K301 HydrophobicContact CZ-CG 4.05Å; C297-K301 VanDerWaalsContact O-CB 3.25Å; C297-K301 WeakPolarHBondContact O-CB 3.28Å; C297-K301 VanDerWaalsContact O-CG 3.31Å; C297-K301 WeakPolarHBondContact O-CG 3.32Å; C297-K301 PolarHBondContact O-N 2.93Å
302	R	90.6	Very high	88.2	Confident	63 Å²	63	53 Å²	53	24%	0.238	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-5.6	177	-57.2	-54.5	-169.5	-141.9	-0.2	113.4	A241 F298 D300 V304 L336 E339	A241-R302 PolarHBondContact O-NH2 3Å; F298-R302 HydrophobicContact CD2-CG 3.66Å; F298-R302 HydrophobicContact CE2-CB 4.36Å; F298-R302 HydrophobicContact CE2-CG 3.6Å; F298-R302 HydrophobicContact CG-CG 4.43Å; F298-R302 HydrophobicContact CZ-CG 4.32Å; F298-R302 VanDerWaalsContact O-CB 3.22Å; F298-R302 WeakPolarHBondContact O-CB 3.34Å; F298-R302 WeakPolarHBondContact O-CG 3.22Å; F298-R302 PolarHBondContact O-N 3.3Å; D300-R302 VanDerWaalsContact C-N 3.34Å; D300-R302 PolarHBondContact O-N 3.01Å; R302-V304 HydrophobicContact CB-CG2 3.81Å; R302-V304 PolarHBondContact O-N 3.1Å; R302-L336 HydrophobicContact CB-CD1 3.72Å; R302-L336 HydrophobicContact CG-CD1 3.97Å; R302-E339 IonicContact CZ-OE2 2.67Å; R302-E339 IonicContact NE-OE2 3.83Å; R302-E339 PolarHBondContact NE-OE2 2.89Å; R302-E339 IonicContact NH2-OE1 2.64Å; R302-E339 PolarHBondContact NH2-OE1 2.85Å; R302-E339 IonicContact NH2-OE2 2.89Å; R302-E339 PolarHBondContact NH2-OE2 2.89Å; R302-E339 VanDerWaalsContact NH2-OE2 3.13Å
303	Q	90	Very high	85.9	Confident	119 Å²	119	56.1 Å²	56.1	56%	0.556	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	52	39.6	179.9	-55.3	179.1	17	0	0	112.8	M299 D300 K305 S306 K307	M299-Q303 WeakPolarHBondContact O-CA 3.49Å; M299-Q303 PolarHBondContact O-N 2.66Å; M299-Q303 VanDerWaalsContact O-N 3.12Å; D300-Q303 WeakPolarHBondContact O-CG 3.09Å; D300-Q303 PolarHBondContact O-N 3.39Å; D300-Q303 VanDerWaalsContact O-N 3.16Å; Q303-K305 VanDerWaalsContact C-N 3.33Å; Q303-K305 PolarHBondContact O-N 2.86Å; Q303-S306 WeakPolarHBondContact O-CB 3.42Å; Q303-S306 PolarHBondContact O-N 3.13Å; Q303-S306 VanDerWaalsContact O-N 3.13Å; Q303-K307 PolarHBondContact O-N 3.36Å
304	V	89.7	Confident	83.5	Confident	0 Å²	0	60 Å²	60	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-58.4	-44.9	-169.9	-177.4	0	0	0	0	111.5	F298 M299 R302 S306 K307 C308 L336 M340 L402 L406	F298-V304 HydrophobicContact CD1-CG2 4.39Å; F298-V304 HydrophobicContact CE1-CG2 3.78Å; F298-V304 HydrophobicContact CZ-CG2 4.14Å; M299-V304 HydrophobicContact CE-CB 3.86Å; M299-V304 HydrophobicContact CE-CG1 4.07Å; M299-V304 PolarHBondContact O-N 3.28Å; M299-V304 HydrophobicContact SD-CB 3.75Å; M299-V304 HydrophobicContact SD-CG1 4.06Å; M299-V304 HydrophobicContact SD-CG2 3.84Å; R302-V304 HydrophobicContact CB-CG2 3.81Å; R302-V304 PolarHBondContact O-N 3.1Å; V304-S306 PolarHBondContact O-N 3.15Å; V304-K307 PolarHBondContact O-N 3.33Å; V304-C308 WeakPolarHBondContact O-CB 3.16Å; V304-C308 PolarHBondContact O-N 3.41Å; V304-L336 HydrophobicContact CG2-CD1 4.12Å; V304-L336 HydrophobicContact CG2-CD2 4.37Å; V304-M340 HydrophobicContact CG1-CE 3.91Å; V304-L402 HydrophobicContact CG1-CB 4.41Å; V304-L402 HydrophobicContact CG1-CD1 4.21Å; V304-L406 HydrophobicContact CG1-CD1 4Å
305	K	88.3	Confident	81	Confident	116 Å²	116	66.4 Å²	66.4	50%	0.504	37%	0.37	S	S	.	.	H	α-helix	trans	-64.3	-40.9	179.5	-67.8	-175.9	176.1	-176	0	112	M299 Q303 C308 L309 E398 L402	M299-K305 HydrophobicContact CE-CD 4.16Å; M299-K305 HydrophobicContact CE-CG 3.65Å; Q303-K305 VanDerWaalsContact C-N 3.33Å; Q303-K305 PolarHBondContact O-N 2.86Å; K305-C308 PolarHBondContact O-N 3.26Å; K305-L309 PolarHBondContact O-N 3.48Å; K305-E398 VanDerWaalsContact CE-OE1 3.32Å; K305-E398 WeakPolarHBondContact CE-OE1 3.43Å; K305-E398 IonicContact NZ-OE1 2.71Å; K305-E398 PolarHBondContact NZ-OE1 3.02Å; K305-L402 HydrophobicContact CG-CD1 4.39Å
306	S	86.7	Confident	78.1	Confident	54 Å²	54	68.7 Å²	68.7	38%	0.378	39%	0.394	S	S	.	.	H	α-helix	trans	-63.5	-47.2	176.5	-177	0	0	0	0	111.3	Q303 V304 C308 L309 N310	Q303-S306 WeakPolarHBondContact O-CB 3.42Å; Q303-S306 PolarHBondContact O-N 3.13Å; Q303-S306 VanDerWaalsContact O-N 3.13Å; V304-S306 PolarHBondContact O-N 3.15Å; S306-C308 VanDerWaalsContact C-N 3.32Å; S306-C308 PolarHBondContact O-N 2.81Å; S306-L309 PolarHBondContact O-N 3.43Å; S306-N310 VanDerWaalsContact O-CG 3.31Å; S306-N310 PolarHBondContact O-N 3.49Å
307	K	86.8	Confident	75.3	Confident	46 Å²	46	75.2 Å²	75.2	20%	0.2	42%	0.422	C	S	.	.	H	α-helix	trans	-59	-43.6	176.1	-71.5	-179.6	171.5	-168.2	0	111.6	Q303 V304 L309 N310 S311 V328 L333 L336 L406	Q303-K307 PolarHBondContact O-N 3.36Å; V304-K307 PolarHBondContact O-N 3.33Å; K307-L309 PolarHBondContact O-N 3.45Å; K307-N310 PolarHBondContact O-N 3.22Å; K307-S311 WeakPolarHBondContact O-CB 3.37Å; K307-S311 PolarHBondContact O-N 3.11Å; K307-S311 PolarHBondContact O-OG 2.84Å; K307-V328 HydrophobicContact CB-CG2 4.45Å; K307-V328 HydrophobicContact CG-CG1 4.42Å; K307-V328 HydrophobicContact CG-CG2 4.4Å; K307-L333 HydrophobicContact CB-CD2 4.31Å; K307-L333 HydrophobicContact CD-CD2 3.85Å; K307-L336 HydrophobicContact CD-CD2 3.73Å; K307-L406 HydrophobicContact CB-CD2 4.3Å
308	C	83.4	Confident	72.7	Confident	25 Å²	25	79.3 Å²	79.3	17%	0.169	45%	0.451	C	S	.	.	H	α-helix	trans	-63.3	-40.8	177.7	-168.2	0	0	0	0	112.5	V304 K305 S306 S311 G312 L402 L406	V304-C308 WeakPolarHBondContact O-CB 3.16Å; V304-C308 PolarHBondContact O-N 3.41Å; K305-C308 PolarHBondContact O-N 3.26Å; S306-C308 VanDerWaalsContact C-N 3.32Å; S306-C308 PolarHBondContact O-N 2.81Å; C308-S311 PolarHBondContact O-N 2.94Å; C308-G312 PolarHBondContact O-N 2.86Å; C308-G312 VanDerWaalsContact O-N 3.13Å; C308-L402 HydrophobicContact CB-CD2 4.25Å; C308-L406 HydrophobicContact CB-CD2 4.17Å; C308-L406 HydrophobicContact CB-CG 4.29Å
309	L	81.8	Confident	70.2	Confident	138 Å²	138	86.4 Å²	86.4	72%	0.723	49%	0.488	S	S	*	.	H	α-helix	trans	-65	-42.6	177.1	-171.8	65.9	0	0	0	111.5	K305 S306 K307 S311 G312	K305-L309 PolarHBondContact O-N 3.48Å; S306-L309 PolarHBondContact O-N 3.43Å; K307-L309 PolarHBondContact O-N 3.45Å; L309-S311 VanDerWaalsContact C-N 3.31Å; L309-S311 PolarHBondContact O-N 3.3Å; L309-G312 PolarHBondContact O-N 2.95Å
310	N	77	Confident	67.4	Low	56 Å²	56	95.2 Å²	95.2	30%	0.299	53%	0.526	S	S	.	.	H	α-helix	trans	-72.2	-24.4	179	-64.9	-13.1	0	0	0	112.8	S306 K307 V325 V328	S306-N310 VanDerWaalsContact O-CG 3.31Å; S306-N310 PolarHBondContact O-N 3.49Å; K307-N310 PolarHBondContact O-N 3.22Å; N310-V325 HydrophobicContact CB-CG1 3.82Å; N310-V328 HydrophobicContact CB-CG2 3.8Å
311	S	75.8	Confident	65.1	Low	9 Å²	9	94.5 Å²	94.5	6%	0.063	53%	0.526	C	S	.	.	H	α-helix	trans	-76.4	-29.5	172.8	-71.9	0	0	0	0	113.3	K307 C308 L309 G313 Y409	K307-S311 WeakPolarHBondContact O-CB 3.37Å; K307-S311 PolarHBondContact O-N 3.11Å; K307-S311 PolarHBondContact O-OG 2.84Å; C308-S311 PolarHBondContact O-N 2.94Å; L309-S311 VanDerWaalsContact C-N 3.31Å; L309-S311 PolarHBondContact O-N 3.3Å; S311-G313 PolarHBondContact O-N 2.89Å; S311-G313 VanDerWaalsContact O-N 3.09Å; S311-Y409 VanDerWaalsContact CB-CD2 3.47Å; S311-Y409 VanDerWaalsContact CB-CG 3.43Å; S311-Y409 WeakPolarHBondContact O-CD2 3.37Å; S311-Y409 WeakPolarHBondContact OG-CD1 3.44Å; S311-Y409 WeakPolarHBondContact OG-CE1 3.26Å
312	G	63.2	Low	62.9	Low	35 Å²	35	94.4 Å²	94.4	36%	0.361	54%	0.542	S	S	.	.			trans	-83.4	68.3	-173	0	0	0	0	0	114.6	C308 L309 N314 V315	C308-G312 PolarHBondContact O-N 2.86Å; C308-G312 VanDerWaalsContact O-N 3.13Å; L309-G312 PolarHBondContact O-N 2.95Å; G312-N314 PolarHBondContact O-N 3.46Å; G312-V315 PolarHBondContact O-N 3.35Å
313	G	47.4	Very low	60.6	Low	73 Å²	73	93.7 Å²	93.7	75%	0.753	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.2	-7.1	177.4	0	0	0	0	0	116.3	S311	S311-G313 PolarHBondContact O-N 2.89Å; S311-G313 VanDerWaalsContact O-N 3.09Å
314	N	44.7	Very low	58.5	Low	163 Å²	163	97.4 Å²	97.4	87%	0.872	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.1	-8.8	-177.8	-75.6	-8	0	0	0	114.7	G312 G316	G312-N314 PolarHBondContact O-N 3.46Å; N314-G316 VanDerWaalsContact C-N 3.3Å; N314-G316 PolarHBondContact O-N 3.42Å
315	V	42.7	Very low	56.7	Low	139 Å²	139	101.8 Å²	101.8	84%	0.842	60%	0.598	S	S	*	*	S	Bend	trans	-84.7	81.9	176	-172.6	0	0	0	0	108.3	G312	G312-V315 PolarHBondContact O-N 3.35Å
316	G	35.1	Very low	55.4	Low	51 Å²	51	104.5 Å²	104.5	53%	0.526	61%	0.612	S	S	.	*			trans	100.1	90.5	168.8	0	0	0	0	0	113.9	N314 S318	N314-G316 VanDerWaalsContact C-N 3.3Å; N314-G316 PolarHBondContact O-N 3.42Å; G316-S318 PolarHBondContact O-N 3.43Å
317	Q	36.1	Very low	54.6	Low	204 Å²	204	107.6 Å²	107.6	95%	0.953	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.4	13.1	152.7	-117.1	174.4	25.6	0	0	114.5
318	S	37.6	Very low	54.3	Low	104 Å²	104	106.2 Å²	106.2	73%	0.727	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.1	-3.7	-173.7	-164.2	0	0	0	0	115	G316	G316-S318 PolarHBondContact O-N 3.43Å
319	L	41.6	Very low	54.2	Low	149 Å²	149	108.1 Å²	108.1	78%	0.78	62%	0.623	S	S	*	*			trans	-125.9	68.7	175.3	-67.8	170.7	0	0	0	110.4	V321	L319-V321 PolarHBondContact O-N 2.9Å
320	K	36	Very low	54.2	Low	202 Å²	202	102.3 Å²	102.3	88%	0.878	59%	0.593	S	S	*	*			trans	-65.9	67.3	153.5	-70.9	-176.3	178.4	178.8	0	108.8
321	V	43.5	Very low	54.5	Low	108 Å²	108	105.1 Å²	105.1	66%	0.655	61%	0.608	S	S	*	*			trans	-81.4	121.4	157.6	179.8	0	0	0	0	104.7	L319 G323	L319-V321 PolarHBondContact O-N 2.9Å; V321-G323 PolarHBondContact O-N 3.24Å
322	S	42.3	Very low	55	Low	129 Å²	129	109.4 Å²	109.4	90%	0.902	63%	0.63	S	S	*	*	S	Bend	trans	-61.9	23.2	-175.5	48.4	0	0	0	0	115.6
323	G	43.6	Very low	56.3	Low	47 Å²	47	107.8 Å²	107.8	49%	0.485	61%	0.613	S	S	.	*	S	Bend	trans	-81.7	125.8	166.9	0	0	0	0	0	108.7	V321 V325	V321-G323 PolarHBondContact O-N 3.24Å; G323-V325 PolarHBondContact O-N 2.93Å
324	Q	45.4	Very low	58.3	Low	197 Å²	197	105.7 Å²	105.7	92%	0.921	59%	0.585	S	S	*	*			trans	-56.5	98.3	160.2	-68.9	174.7	-20.9	0	0	106.3	E326	Q324-E326 PolarHBondContact O-N 2.92Å
325	V	52.8	Low	60.5	Low	93 Å²	93	100.9 Å²	100.9	56%	0.564	56%	0.561	S	S	*	*			trans	-62.1	107.5	173.5	178	0	0	0	0	104.9	N310 G323 K327	N310-V325 HydrophobicContact CB-CG1 3.82Å; G323-V325 PolarHBondContact O-N 2.93Å; V325-K327 PolarHBondContact O-N 2.95Å
326	E	59.8	Low	62.9	Low	172 Å²	172	94.6 Å²	94.6	80%	0.804	52%	0.523	S	S	*	.			trans	-61.3	109.3	179.8	-164.8	172.1	-167.6	0	0	107	Q324 V328	Q324-E326 PolarHBondContact O-N 2.92Å; E326-V328 PolarHBondContact O-N 3.33Å
327	K	70.1	Confident	65.8	Low	119 Å²	119	92.2 Å²	92.2	52%	0.517	50%	0.498	S	S	.	.	P	Polyproline II helix	trans	-65.5	122.5	-174.5	-174.7	175.3	-175.1	177.6	0	107.9	V325 D329 Y409 E413	V325-K327 PolarHBondContact O-N 2.95Å; K327-D329 PolarHBondContact O-N 3.19Å; K327-Y409 VanDerWaalsContact CE-OH 3.3Å; K327-Y409 WeakPolarHBondContact CE-OH 3.39Å; K327-Y409 WeakPolarHBondContact CG-OH 3.5Å; K327-E413 WeakPolarHBondContact CE-OE1 3.1Å; K327-E413 WeakPolarHBondContact CE-OE2 3.43Å; K327-E413 IonicContact NZ-OE1 3.2Å; K327-E413 PolarHBondContact NZ-OE1 2.94Å; K327-E413 IonicContact NZ-OE2 3Å; K327-E413 PolarHBondContact NZ-OE2 2.61Å
328	V	80	Confident	68.5	Low	18 Å²	18	85.1 Å²	85.1	11%	0.109	47%	0.468	C	S	.	.	P	Polyproline II helix	trans	-62.5	126.5	-179.8	-175	0	0	0	0	109.2	K307 N310 E326 P330 L333 Y409	K307-V328 HydrophobicContact CB-CG2 4.45Å; K307-V328 HydrophobicContact CG-CG1 4.42Å; K307-V328 HydrophobicContact CG-CG2 4.4Å; N310-V328 HydrophobicContact CB-CG2 3.8Å; E326-V328 PolarHBondContact O-N 3.33Å; V328-P330 WeakPolarHBondContact O-CD 3.4Å; V328-L333 HydrophobicContact CG1-CD1 4.27Å; V328-L333 HydrophobicContact CG1-CD2 3.83Å; V328-L333 HydrophobicContact CG1-CG 3.91Å; V328-Y409 HydrophobicContact CB-CE1 4.5Å; V328-Y409 PolarHBondContact O-OH 3.36Å
329	D	81.3	Confident	71.2	Confident	65 Å²	65	80.2 Å²	80.2	35%	0.348	43%	0.434	S	S	.	.	P	Polyproline II helix	trans	-64	124.9	173.9	-168.7	-25.9	0	0	0	108.7	K327 L331 D332	K327-D329 PolarHBondContact O-N 3.19Å; D329-L331 PolarHBondContact O-N 2.85Å; D329-L331 VanDerWaalsContact O-N 3.14Å; D329-L331 PolarHBondContact OD1-N 3.41Å; D329-D332 PolarHBondContact O-N 2.98Å; D329-D332 VanDerWaalsContact O-N 3.1Å
330	P	81.7	Confident	73.8	Confident	16 Å²	16	73.1 Å²	73.1	10%	0.104	40%	0.397	C	S	.	.	H	α-helix	trans	-51.4	-34.3	174.4	-27.9	35.5	0	0	0	113.3	V328 D332 L333 D334 Y410 E413	V328-P330 WeakPolarHBondContact O-CD 3.4Å; P330-D332 VanDerWaalsContact C-N 3.28Å; P330-D332 PolarHBondContact O-N 3.26Å; P330-L333 WeakPolarHBondContact O-CB 3.36Å; P330-L333 PolarHBondContact O-N 3Å; P330-D334 PolarHBondContact O-N 3.4Å; P330-Y410 HydrophobicContact CB-CD2 3.82Å; P330-Y410 HydrophobicContact CB-CE2 4.15Å; P330-Y410 WeakPolarHBondContact O-CD2 3.35Å; P330-Y410 WeakPolarHBondContact O-CE2 3.47Å; P330-E413 HydrophobicContact CB-CB 4.38Å; P330-E413 HydrophobicContact CG-CB 3.36Å; P330-E413 HydrophobicContact CG-CG 4.28Å
331	L	84.8	Confident	76.6	Confident	114 Å²	114	63.6 Å²	63.6	60%	0.597	36%	0.355	S	S	*	.	H	α-helix	trans	-63.4	-35.4	-178.6	-171	60.7	0	0	0	112.4	D329 L333 D334	D329-L331 PolarHBondContact O-N 2.85Å; D329-L331 VanDerWaalsContact O-N 3.14Å; D329-L331 PolarHBondContact OD1-N 3.41Å; L331-L333 PolarHBondContact O-N 3.46Å; L331-D334 WeakPolarHBondContact O-CB 3.45Å; L331-D334 PolarHBondContact O-N 2.87Å; L331-D334 VanDerWaalsContact O-N 3.15Å
332	D	84.6	Confident	79	Confident	100 Å²	100	60.3 Å²	60.3	54%	0.535	33%	0.334	S	S	.	.	H	α-helix	trans	-70.2	-16.2	177.5	-64.9	-22.5	0	0	0	113	D329 P330	D329-D332 PolarHBondContact O-N 2.98Å; D329-D332 VanDerWaalsContact O-N 3.1Å; P330-D332 VanDerWaalsContact C-N 3.28Å; P330-D332 PolarHBondContact O-N 3.26Å
333	L	90.7	Very high	81.5	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-84.9	-21.7	174.6	-62.6	178.7	0	0	0	112.2	K307 V328 P330 L331 V335 L336 L337 L406 Y409 Y410	K307-L333 HydrophobicContact CB-CD2 4.31Å; K307-L333 HydrophobicContact CD-CD2 3.85Å; V328-L333 HydrophobicContact CG1-CD1 4.27Å; V328-L333 HydrophobicContact CG1-CD2 3.83Å; V328-L333 HydrophobicContact CG1-CG 3.91Å; P330-L333 WeakPolarHBondContact O-CB 3.36Å; P330-L333 PolarHBondContact O-N 3Å; L331-L333 PolarHBondContact O-N 3.46Å; L333-V335 PolarHBondContact O-N 3.39Å; L333-L336 HydrophobicContact CD2-CD2 4.34Å; L333-L336 PolarHBondContact O-N 3.03Å; L333-L336 VanDerWaalsContact O-N 3.16Å; L333-L337 HydrophobicContact CB-CD1 4.05Å; L333-L337 HydrophobicContact CB-CG 4.4Å; L333-L337 WeakPolarHBondContact O-CB 3.36Å; L333-L337 WeakPolarHBondContact O-CG 3.4Å; L333-L337 PolarHBondContact O-N 3.28Å; L333-L406 HydrophobicContact CD1-CD2 4.39Å; L333-L406 HydrophobicContact CD2-CD2 4.21Å; L333-Y409 HydrophobicContact CD1-CD1 3.55Å; L333-Y409 HydrophobicContact CD1-CE1 3.84Å; L333-Y410 HydrophobicContact CB-CD2 4.21Å
334	D	90	Very high	83.9	Confident	30 Å²	30	52.3 Å²	52.3	16%	0.16	27%	0.27	C	S	.	.	H	α-helix	trans	-61	-45.8	-170.1	-161.5	61.8	0	0	0	112.9	P330 L331 T338 Y410 K443 R447	P330-D334 PolarHBondContact O-N 3.4Å; L331-D334 WeakPolarHBondContact O-CB 3.45Å; L331-D334 PolarHBondContact O-N 2.87Å; L331-D334 VanDerWaalsContact O-N 3.15Å; D334-T338 PolarHBondContact O-N 3.09Å; D334-T338 PolarHBondContact O-OG1 3.49Å; D334-Y410 HydrophobicContact CB-CE2 4.16Å; D334-Y410 PolarHBondContact OD1-OH 2.93Å; D334-K443 VanDerWaalsContact OD1-CE 3.29Å; D334-K443 WeakPolarHBondContact OD1-CE 3.38Å; D334-K443 IonicContact OD1-NZ 2.66Å; D334-K443 PolarHBondContact OD1-NZ 3.3Å; D334-K443 IonicContact OD2-NZ 2.87Å; D334-K443 PolarHBondContact OD2-NZ 2.9Å; D334-R447 PolarHBondContact O-NH1 2.86Å; D334-R447 IonicContact OD1-CZ 2.65Å; D334-R447 IonicContact OD1-NH1 3.01Å; D334-R447 PolarHBondContact OD1-NH1 3.46Å; D334-R447 IonicContact OD1-NH2 3.26Å
335	V	91.1	Very high	86.2	Confident	62 Å²	62	44.7 Å²	44.7	38%	0.376	24%	0.235	S	C	.	.	H	α-helix	trans	-67.6	-43.6	177.1	178.1	0	0	0	0	110.7	N242 L333 T338 E339	N242-V335 HydrophobicContact CB-CG1 3.46Å; N242-V335 VanDerWaalsContact CB-CG1 3.46Å; L333-V335 PolarHBondContact O-N 3.39Å; V335-T338 WeakPolarHBondContact O-CB 3.24Å; V335-T338 PolarHBondContact O-N 2.9Å; V335-E339 PolarHBondContact O-N 2.97Å
336	L	93	Very high	88.1	Confident	7 Å²	7	43.6 Å²	43.6	4%	0.037	22%	0.221	C	C	.	.	H	α-helix	trans	-61.5	-49.4	180	176.6	58.7	0	0	0	111.4	F298 R302 V304 K307 L333 T338 E339 M340	F298-L336 HydrophobicContact CE2-CD1 3.99Å; F298-L336 HydrophobicContact CZ-CD1 3.67Å; R302-L336 HydrophobicContact CB-CD1 3.72Å; R302-L336 HydrophobicContact CG-CD1 3.97Å; V304-L336 HydrophobicContact CG2-CD1 4.12Å; V304-L336 HydrophobicContact CG2-CD2 4.37Å; K307-L336 HydrophobicContact CD-CD2 3.73Å; L333-L336 HydrophobicContact CD2-CD2 4.34Å; L333-L336 PolarHBondContact O-N 3.03Å; L333-L336 VanDerWaalsContact O-N 3.16Å; L336-T338 PolarHBondContact O-N 3.39Å; L336-E339 PolarHBondContact O-N 3.33Å; L336-E339 VanDerWaalsContact O-N 3.1Å; L336-M340 HydrophobicContact CD1-CG 4.26Å; L336-M340 HydrophobicContact CD1-SD 4.44Å; L336-M340 HydrophobicContact CG-CG 4.4Å; L336-M340 HydrophobicContact CG-SD 4.05Å; L336-M340 VanDerWaalsContact O-CG 3.23Å; L336-M340 WeakPolarHBondContact O-CG 3.21Å; L336-M340 PolarHBondContact O-N 3.48Å
337	L	95.5	Very high	89.8	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-58.5	-35.7	178.6	-71.3	168.7	0	0	0	111.3	L333 M340 T341 Y403 L406 E407 Y410	L333-L337 HydrophobicContact CB-CD1 4.05Å; L333-L337 HydrophobicContact CB-CG 4.4Å; L333-L337 WeakPolarHBondContact O-CB 3.36Å; L333-L337 WeakPolarHBondContact O-CG 3.4Å; L333-L337 PolarHBondContact O-N 3.28Å; L337-M340 HydrophobicContact CD2-SD 4.23Å; L337-M340 PolarHBondContact O-N 3.38Å; L337-T341 WeakPolarHBondContact O-CG2 3.25Å; L337-T341 PolarHBondContact O-N 3.47Å; L337-T341 VanDerWaalsContact O-N 3.11Å; L337-T341 PolarHBondContact O-OG1 2.87Å; L337-Y403 HydrophobicContact CB-CE2 4.1Å; L337-Y403 HydrophobicContact CD2-CD2 3.63Å; L337-Y403 HydrophobicContact CD2-CE2 3.72Å; L337-L406 HydrophobicContact CD2-CB 3.76Å; L337-E407 HydrophobicContact CD2-CB 4.09Å; L337-Y410 HydrophobicContact CD1-CD1 4.36Å; L337-Y410 HydrophobicContact CD1-CD2 4.23Å; L337-Y410 HydrophobicContact CD1-CG 3.85Å
338	T	94.2	Very high	90.9	Very high	55 Å²	55	31.6 Å²	31.6	34%	0.337	17%	0.167	S	C	.	.	H	α-helix	trans	-69.6	-43	175.8	-52.6	0	0	0	0	111.8	D334 V335 L336 M340 T341 L342	D334-T338 PolarHBondContact O-N 3.09Å; D334-T338 PolarHBondContact O-OG1 3.49Å; V335-T338 WeakPolarHBondContact O-CB 3.24Å; V335-T338 PolarHBondContact O-N 2.9Å; L336-T338 PolarHBondContact O-N 3.39Å; T338-M340 VanDerWaalsContact C-N 3.3Å; T338-M340 PolarHBondContact O-N 2.96Å; T338-T341 PolarHBondContact O-N 3.24Å; T338-T341 PolarHBondContact O-OG1 3.19Å; T338-T341 VanDerWaalsContact O-OG1 3.09Å; T338-L342 HydrophobicContact CG2-CD1 4.42Å; T338-L342 VanDerWaalsContact O-CG 3.29Å; T338-L342 WeakPolarHBondContact O-CG 3.45Å; T338-L342 PolarHBondContact O-N 3.21Å
339	E	94.1	Very high	91.5	Very high	2 Å²	2	35.2 Å²	35.2	1%	0.009	18%	0.184	C	C	.	.	H	α-helix	trans	-63	-38.3	174.6	-166.6	170.9	-154.8	0	0	111.3	N242 V243 L244 F245 A246 F298 R302 V335 L336 L342 L343	N242-E339 WeakPolarHBondContact O-CG 3.39Å; V243-E339 VanDerWaalsContact C-OE1 3.31Å; V243-E339 WeakPolarHBondContact CA-OE1 3.5Å; L244-E339 PolarHBondContact N-OE1 3.45Å; F245-E339 PolarHBondContact N-OE1 3.35Å; A246-E339 HydrophobicContact CB-CG 4.39Å; F298-E339 HydrophobicContact CE2-CB 4.34Å; F298-E339 HydrophobicContact CE2-CG 3.88Å; F298-E339 WeakPolarHBondContact CE2-OE2 3.47Å; R302-E339 IonicContact CZ-OE2 2.67Å; R302-E339 IonicContact NE-OE2 3.83Å; R302-E339 PolarHBondContact NE-OE2 2.89Å; R302-E339 IonicContact NH2-OE1 2.64Å; R302-E339 PolarHBondContact NH2-OE1 2.85Å; R302-E339 IonicContact NH2-OE2 2.89Å; R302-E339 PolarHBondContact NH2-OE2 2.89Å; R302-E339 VanDerWaalsContact NH2-OE2 3.13Å; V335-E339 PolarHBondContact O-N 2.97Å; L336-E339 PolarHBondContact O-N 3.33Å; L336-E339 VanDerWaalsContact O-N 3.1Å; E339-L342 PolarHBondContact O-N 3.41Å; E339-L343 WeakPolarHBondContact O-CG 3.34Å; E339-L343 PolarHBondContact O-N 3.28Å
340	M	96.2	Very high	92.2	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-61.3	-47.8	176.1	-66.6	172.5	87.1	0	0	112	F298 V304 L336 L337 T338 L342 L343 Q344 L399 L402 Y403 L406	F298-M340 HydrophobicContact CE1-CG 4.27Å; F298-M340 HydrophobicContact CZ-CG 3.78Å; V304-M340 HydrophobicContact CG1-CE 3.91Å; L336-M340 HydrophobicContact CD1-CG 4.26Å; L336-M340 HydrophobicContact CD1-SD 4.44Å; L336-M340 HydrophobicContact CG-CG 4.4Å; L336-M340 HydrophobicContact CG-SD 4.05Å; L336-M340 VanDerWaalsContact O-CG 3.23Å; L336-M340 WeakPolarHBondContact O-CG 3.21Å; L336-M340 PolarHBondContact O-N 3.48Å; L337-M340 HydrophobicContact CD2-SD 4.23Å; L337-M340 PolarHBondContact O-N 3.38Å; T338-M340 VanDerWaalsContact C-N 3.3Å; T338-M340 PolarHBondContact O-N 2.96Å; M340-L342 VanDerWaalsContact C-N 3.31Å; M340-L342 PolarHBondContact O-N 2.97Å; M340-L343 PolarHBondContact O-N 3.37Å; M340-Q344 VanDerWaalsContact O-CG 3.26Å; M340-Q344 WeakPolarHBondContact O-CG 3.39Å; M340-Q344 PolarHBondContact O-N 3.39Å; M340-Q344 VanDerWaalsContact O-N 3.13Å; M340-L399 HydrophobicContact CE-CD1 3.39Å; M340-L399 HydrophobicContact CE-CG 4.18Å; M340-L399 HydrophobicContact CG-CD1 4.09Å; M340-L402 HydrophobicContact CE-CB 4.19Å; M340-Y403 HydrophobicContact CB-CD2 4.03Å; M340-Y403 HydrophobicContact SD-CD2 4.31Å; M340-L406 HydrophobicContact CE-CD1 4.26Å; M340-L406 HydrophobicContact SD-CD1 4.2Å
341	T	94.5	Very high	92.7	Very high	1 Å²	1	32.7 Å²	32.7	1%	0.006	17%	0.169	C	C	.	.	H	α-helix	trans	-68.6	-32	178.9	58.3	0	0	0	0	112.2	L337 T338 Q344 M345 Y403 R447	L337-T341 WeakPolarHBondContact O-CG2 3.25Å; L337-T341 PolarHBondContact O-N 3.47Å; L337-T341 VanDerWaalsContact O-N 3.11Å; L337-T341 PolarHBondContact O-OG1 2.87Å; T338-T341 PolarHBondContact O-N 3.24Å; T338-T341 PolarHBondContact O-OG1 3.19Å; T338-T341 VanDerWaalsContact O-OG1 3.09Å; T341-Q344 WeakPolarHBondContact O-CB 3.32Å; T341-Q344 PolarHBondContact O-N 2.81Å; T341-M345 WeakPolarHBondContact O-CB 3.35Å; T341-M345 PolarHBondContact O-N 3.45Å; T341-Y403 HydrophobicContact CG2-CD2 3.95Å; T341-Y403 HydrophobicContact CG2-CE1 4.14Å; T341-Y403 HydrophobicContact CG2-CE2 3.33Å; T341-Y403 VanDerWaalsContact CG2-CZ 3.44Å; T341-R447 HydrophobicContact CG2-CG 3.97Å; T341-R447 WeakPolarHBondContact CG2-O 3.4Å
342	L	93.5	Very high	93	Very high	40 Å²	40	31.9 Å²	31.9	21%	0.209	16%	0.158	C	C	.	.	H	α-helix	trans	-63.8	-45.8	172.1	-72.4	172.3	0	0	0	111.9	V243 A246 T338 E339 M340 Q344 M345 R346	V243-L342 HydrophobicContact CG1-CD1 3.73Å; A246-L342 HydrophobicContact CB-CB 4Å; T338-L342 HydrophobicContact CG2-CD1 4.42Å; T338-L342 VanDerWaalsContact O-CG 3.29Å; T338-L342 WeakPolarHBondContact O-CG 3.45Å; T338-L342 PolarHBondContact O-N 3.21Å; E339-L342 PolarHBondContact O-N 3.41Å; M340-L342 VanDerWaalsContact C-N 3.31Å; M340-L342 PolarHBondContact O-N 2.97Å; L342-Q344 VanDerWaalsContact C-N 3.29Å; L342-Q344 PolarHBondContact O-N 3.49Å; L342-M345 WeakPolarHBondContact O-CB 3.17Å; L342-M345 PolarHBondContact O-N 3Å; L342-R346 VanDerWaalsContact O-CG 3.29Å; L342-R346 WeakPolarHBondContact O-CG 3.13Å; L342-R346 PolarHBondContact O-N 3.47Å
343	L	95.5	Very high	93.6	Very high	1 Å²	1	29.3 Å²	29.3	1%	0.005	14%	0.142	C	C	.	.	H	α-helix	trans	-56	-45.8	175	-73.7	165.9	0	0	0	111.3	A246 L249 F295 F298 E339 M340 R346 V347 L399	A246-L343 HydrophobicContact CB-CD2 4.25Å; A246-L343 HydrophobicContact CB-CG 4.29Å; L249-L343 HydrophobicContact CB-CD2 4.01Å; L249-L343 HydrophobicContact CD2-CB 4.45Å; L249-L343 HydrophobicContact CD2-CD2 3.53Å; L249-L343 HydrophobicContact CG-CD2 4.42Å; F295-L343 HydrophobicContact CE1-CB 4.45Å; F295-L343 HydrophobicContact CE1-CD1 4.49Å; F298-L343 HydrophobicContact CD1-CD1 3.93Å; F298-L343 HydrophobicContact CD2-CD1 3.95Å; F298-L343 HydrophobicContact CE1-CD1 3.84Å; F298-L343 HydrophobicContact CE2-CD1 3.85Å; F298-L343 HydrophobicContact CG-CD1 3.98Å; F298-L343 HydrophobicContact CZ-CD1 3.81Å; E339-L343 WeakPolarHBondContact O-CG 3.34Å; E339-L343 PolarHBondContact O-N 3.28Å; M340-L343 PolarHBondContact O-N 3.37Å; L343-R346 PolarHBondContact O-N 3.49Å; L343-V347 PolarHBondContact O-N 2.73Å; L343-L399 HydrophobicContact CB-CD2 4Å; L343-L399 HydrophobicContact CD1-CD2 3.98Å
344	Q	94.2	Very high	93.8	Very high	6 Å²	6	29.3 Å²	29.3	3%	0.028	14%	0.142	C	C	.	.	H	α-helix	trans	-59.1	-49	176.1	-65.3	-71.7	-41.3	0	0	111.7	M340 T341 L342 R346 V347 D348 V396	M340-Q344 VanDerWaalsContact O-CG 3.26Å; M340-Q344 WeakPolarHBondContact O-CG 3.39Å; M340-Q344 PolarHBondContact O-N 3.39Å; M340-Q344 VanDerWaalsContact O-N 3.13Å; T341-Q344 WeakPolarHBondContact O-CB 3.32Å; T341-Q344 PolarHBondContact O-N 2.81Å; L342-Q344 VanDerWaalsContact C-N 3.29Å; L342-Q344 PolarHBondContact O-N 3.49Å; Q344-R346 VanDerWaalsContact C-N 3.3Å; Q344-R346 PolarHBondContact O-N 3.34Å; Q344-V347 PolarHBondContact O-N 3.46Å; Q344-D348 PolarHBondContact O-N 2.75Å; Q344-V396 PolarHBondContact NE2-O 2.99Å
345	M	92.4	Very high	93.9	Very high	38 Å²	38	31.5 Å²	31.5	19%	0.187	15%	0.154	C	C	.	.	H	α-helix	trans	-57.8	-43.1	-179.6	-164.6	173.6	107.7	0	0	112	T341 L342 D348 M349 S450	T341-M345 WeakPolarHBondContact O-CB 3.35Å; T341-M345 PolarHBondContact O-N 3.45Å; L342-M345 WeakPolarHBondContact O-CB 3.17Å; L342-M345 PolarHBondContact O-N 3Å; M345-D348 PolarHBondContact O-N 3.36Å; M345-M349 HydrophobicContact CE-CE 3.35Å; M345-M349 HydrophobicContact CE-SD 4.34Å; M345-M349 HydrophobicContact CG-CE 3.91Å; M345-M349 VanDerWaalsContact O-CG 3.31Å; M345-M349 WeakPolarHBondContact O-CG 3.29Å; M345-M349 PolarHBondContact O-N 3.47Å; M345-M349 HydrophobicContact SD-CE 4.19Å; M345-S450 VanDerWaalsContact CB-O 3.28Å; M345-S450 WeakPolarHBondContact CB-O 3.44Å; M345-S450 WeakPolarHBondContact CG-O 3.15Å
346	R	93.8	Very high	94	Very high	70 Å²	70	38.8 Å²	38.8	26%	0.264	18%	0.175	S	C	.	.	H	α-helix	trans	-65.4	-41.3	-179.5	-65.6	-62	-178.7	-128	-6.6	112.1	T250 L253 L342 L343 Q344 Y350	T250-R346 WeakPolarHBondContact OG1-CD 3.38Å; T250-R346 VanDerWaalsContact OG1-CG 3.31Å; T250-R346 WeakPolarHBondContact OG1-CG 3.35Å; T250-R346 PolarHBondContact OG1-NE 3.49Å; L253-R346 HydrophobicContact CD1-CB 4.24Å; L342-R346 VanDerWaalsContact O-CG 3.29Å; L342-R346 WeakPolarHBondContact O-CG 3.13Å; L342-R346 PolarHBondContact O-N 3.47Å; L343-R346 PolarHBondContact O-N 3.49Å; Q344-R346 VanDerWaalsContact C-N 3.3Å; Q344-R346 PolarHBondContact O-N 3.34Å; R346-Y350 PolarHBondContact O-N 2.92Å; R346-Y350 VanDerWaalsContact O-N 3.11Å
347	V	95.6	Very high	94	Very high	2 Å²	2	43.1 Å²	43.1	1%	0.012	19%	0.191	C	C	.	.	H	α-helix	trans	-67.8	-44.6	175.3	-178.4	0	0	0	0	111	L249 L253 F295 L343 Q344 M349 Y350 M351 L392 V396	L249-V347 HydrophobicContact CD2-CG2 3.79Å; L253-V347 HydrophobicContact CD1-CG2 4.04Å; F295-V347 HydrophobicContact CZ-CG2 4.36Å; L343-V347 PolarHBondContact O-N 2.73Å; Q344-V347 PolarHBondContact O-N 3.46Å; V347-M349 VanDerWaalsContact C-N 3.31Å; V347-M349 PolarHBondContact O-N 3.4Å; V347-Y350 WeakPolarHBondContact O-CB 3.49Å; V347-Y350 PolarHBondContact O-N 2.9Å; V347-Y350 VanDerWaalsContact O-N 3.14Å; V347-M351 HydrophobicContact CG1-CE 3.71Å; V347-M351 HydrophobicContact CG1-CG 3.94Å; V347-M351 VanDerWaalsContact O-CG 3.24Å; V347-M351 WeakPolarHBondContact O-CG 3.49Å; V347-M351 PolarHBondContact O-N 3.14Å; V347-L392 HydrophobicContact CG1-CD1 4.22Å; V347-L392 HydrophobicContact CG1-CD2 4.02Å; V347-L392 HydrophobicContact CG1-CG 3.82Å; V347-L392 HydrophobicContact CG2-CD1 3.81Å; V347-L392 HydrophobicContact CG2-CG 4.32Å; V347-V396 HydrophobicContact CB-CG2 3.71Å; V347-V396 HydrophobicContact CG1-CG2 3.71Å; V347-V396 HydrophobicContact CG2-CG2 3.58Å
348	D	92.1	Very high	93.8	Very high	36 Å²	36	43.1 Å²	43.1	19%	0.193	19%	0.191	C	C	.	.	H	α-helix	trans	-59	-42.4	178.1	178.3	80.6	0	0	0	111.6	Q344 M345 Y350 M351 R352 S452 R556	Q344-D348 PolarHBondContact O-N 2.75Å; M345-D348 PolarHBondContact O-N 3.36Å; D348-Y350 PolarHBondContact O-N 2.96Å; D348-M351 PolarHBondContact O-N 3.11Å; D348-R352 WeakPolarHBondContact O-CG 3.42Å; D348-R352 PolarHBondContact O-N 3.3Å; D348-R352 IonicContact OD1-NE 2.72Å; D348-R352 IonicContact OD2-CZ 3.37Å; D348-R352 IonicContact OD2-NE 2.63Å; D348-R352 PolarHBondContact OD2-NE 3.38Å; D348-R352 IonicContact OD2-NH2 3.76Å; D348-R352 PolarHBondContact OD2-NH2 2.78Å; D348-S452 WeakPolarHBondContact OD2-CB 3.07Å; D348-R556 IonicContact OD1-NH2 3.41Å; D348-R556 PolarHBondContact OD1-NH2 2.8Å; D348-R556 IonicContact OD2-NH2 2.64Å
349	M	92	Very high	93.6	Very high	94 Å²	94	41.6 Å²	41.6	46%	0.463	19%	0.186	S	C	.	.	H	α-helix	trans	-59.2	-46.2	173.7	-74.2	-179.2	178.8	0	0	112.7	M345 V347 R352 F353	M345-M349 HydrophobicContact CE-CE 3.35Å; M345-M349 HydrophobicContact CE-SD 4.34Å; M345-M349 HydrophobicContact CG-CE 3.91Å; M345-M349 VanDerWaalsContact O-CG 3.31Å; M345-M349 WeakPolarHBondContact O-CG 3.29Å; M345-M349 PolarHBondContact O-N 3.47Å; M345-M349 HydrophobicContact SD-CE 4.19Å; V347-M349 VanDerWaalsContact C-N 3.31Å; V347-M349 PolarHBondContact O-N 3.4Å; M349-R352 PolarHBondContact O-N 3.3Å; M349-F353 WeakPolarHBondContact O-CB 3.31Å; M349-F353 PolarHBondContact O-N 3.33Å
350	Y	96.1	Very high	93.4	Very high	10 Å²	10	43.4 Å²	43.4	4%	0.039	21%	0.205	C	C	.	.	H	α-helix	trans	-61.3	-45.7	176.6	172.7	-102.9	0	0	0	112	L253 V256 A257 Q284 R346 V347 D348 R352 F353 L354 L392	L253-Y350 HydrophobicContact CB-CD2 4.02Å; L253-Y350 HydrophobicContact CB-CG 4.19Å; L253-Y350 HydrophobicContact CD1-CG 4.42Å; L253-Y350 HydrophobicContact CD2-CD1 3.87Å; L253-Y350 HydrophobicContact CD2-CD2 4.12Å; L253-Y350 HydrophobicContact CD2-CE1 4.17Å; L253-Y350 HydrophobicContact CD2-CE2 4.41Å; L253-Y350 HydrophobicContact CD2-CG 3.83Å; L253-Y350 HydrophobicContact CG-CG 4.36Å; V256-Y350 HydrophobicContact CB-CE2 4.43Å; V256-Y350 HydrophobicContact CG1-CE2 4.23Å; V256-Y350 WeakPolarHBondContact CG1-OH 3.49Å; A257-Y350 HydrophobicContact CB-CD2 4.28Å; A257-Y350 HydrophobicContact CB-CE2 4.34Å; Q284-Y350 PolarHBondContact OE1-OH 3.06Å; R346-Y350 PolarHBondContact O-N 2.92Å; R346-Y350 VanDerWaalsContact O-N 3.11Å; V347-Y350 WeakPolarHBondContact O-CB 3.49Å; V347-Y350 PolarHBondContact O-N 2.9Å; V347-Y350 VanDerWaalsContact O-N 3.14Å; D348-Y350 PolarHBondContact O-N 2.96Å; Y350-R352 VanDerWaalsContact C-N 3.34Å; Y350-R352 PolarHBondContact O-N 2.85Å; Y350-F353 WeakPolarHBondContact O-CB 3.25Å; Y350-F353 PolarHBondContact O-N 3.25Å; Y350-L354 HydrophobicContact CD1-CD1 3.97Å; Y350-L354 HydrophobicContact CE1-CD1 3.33Å; Y350-L354 HydrophobicContact CE1-CG 4.15Å; Y350-L354 HydrophobicContact CE2-CD1 4.25Å; Y350-L354 HydrophobicContact CE2-CD2 4.44Å; Y350-L354 HydrophobicContact CE2-CG 4.27Å; Y350-L354 VanDerWaalsContact CZ-CD1 3.5Å; Y350-L354 WeakPolarHBondContact O-CG 3.25Å; Y350-L354 PolarHBondContact O-N 3.35Å; Y350-L392 HydrophobicContact CD1-CD2 4.19Å; Y350-L392 HydrophobicContact CE1-CD2 4.2Å
351	M	93.8	Very high	93	Very high	19 Å²	19	44 Å²	44	9%	0.094	21%	0.209	C	C	.	.	H	α-helix	trans	-63.7	-38.8	177.8	-64.1	-58.8	177.7	0	0	111.6	V347 D348 L354 N355 L387 L392 S393	V347-M351 HydrophobicContact CG1-CE 3.71Å; V347-M351 HydrophobicContact CG1-CG 3.94Å; V347-M351 VanDerWaalsContact O-CG 3.24Å; V347-M351 WeakPolarHBondContact O-CG 3.49Å; V347-M351 PolarHBondContact O-N 3.14Å; D348-M351 PolarHBondContact O-N 3.11Å; M351-L354 PolarHBondContact O-N 3.03Å; M351-L354 HydrophobicContact SD-CD1 4.46Å; M351-N355 WeakPolarHBondContact O-CB 3.36Å; M351-N355 PolarHBondContact O-N 3.38Å; M351-N355 PolarHBondContact O-ND2 3.4Å; M351-L387 HydrophobicContact CE-CD1 4.47Å; M351-L387 HydrophobicContact SD-CD1 3.3Å; M351-L387 WeakPolarHBondContact SD-CD1 3.38Å; M351-L387 HydrophobicContact SD-CD2 4.25Å; M351-L387 HydrophobicContact SD-CG 3.68Å; M351-L392 HydrophobicContact CE-CB 4.15Å; M351-L392 HydrophobicContact CE-CD2 3.64Å; M351-L392 HydrophobicContact CE-CG 3.78Å; M351-S393 WeakPolarHBondContact CE-OG 3.23Å
352	R	91.4	Very high	92.7	Very high	96 Å²	96	44 Å²	44	36%	0.362	21%	0.209	S	C	.	.	H	α-helix	trans	-65.9	-40.1	174	-71.7	-173.8	-155.6	-173.9	17.5	112.1	D348 M349 Y350 N355 R356	D348-R352 WeakPolarHBondContact O-CG 3.42Å; D348-R352 PolarHBondContact O-N 3.3Å; D348-R352 IonicContact OD1-NE 2.72Å; D348-R352 IonicContact OD2-CZ 3.37Å; D348-R352 IonicContact OD2-NE 2.63Å; D348-R352 PolarHBondContact OD2-NE 3.38Å; D348-R352 IonicContact OD2-NH2 3.76Å; D348-R352 PolarHBondContact OD2-NH2 2.78Å; M349-R352 PolarHBondContact O-N 3.3Å; Y350-R352 VanDerWaalsContact C-N 3.34Å; Y350-R352 PolarHBondContact O-N 2.85Å; R352-N355 PolarHBondContact O-N 3.22Å; R352-R356 WeakPolarHBondContact O-CB 3.32Å; R352-R356 PolarHBondContact O-N 2.99Å
353	F	95.4	Very high	92.5	Very high	47 Å²	47	45 Å²	45	21%	0.206	22%	0.223	C	C	.	.	H	α-helix	trans	-57.9	-49.6	173.8	164	-91.8	0	0	0	110.8	A257 F260 E261 M349 Y350 R356 R357	A257-F353 HydrophobicContact CB-CD1 3.86Å; A257-F353 HydrophobicContact CB-CE1 3.58Å; A257-F353 HydrophobicContact CB-CG 4.49Å; A257-F353 HydrophobicContact CB-CZ 3.96Å; A257-F353 WeakPolarHBondContact O-CZ 3.12Å; F260-F353 HydrophobicContact CD1-CE1 4.24Å; E261-F353 HydrophobicContact CB-CZ 4.18Å; M349-F353 WeakPolarHBondContact O-CB 3.31Å; M349-F353 PolarHBondContact O-N 3.33Å; Y350-F353 WeakPolarHBondContact O-CB 3.25Å; Y350-F353 PolarHBondContact O-N 3.25Å; F353-R356 PolarHBondContact O-N 3.16Å; F353-R357 HydrophobicContact CD1-CG 4.48Å; F353-R357 HydrophobicContact CD2-CG 4.03Å; F353-R357 HydrophobicContact CE1-CG 4.1Å; F353-R357 HydrophobicContact CE2-CG 3.64Å; F353-R357 HydrophobicContact CG-CG 4.44Å; F353-R357 HydrophobicContact CZ-CG 3.67Å; F353-R357 WeakPolarHBondContact O-CB 3.47Å; F353-R357 WeakPolarHBondContact O-CG 3.3Å; F353-R357 PolarHBondContact O-N 3.39Å
354	L	95.5	Very high	92	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-60.6	-48.5	178.2	-71	178.3	0	0	0	111.9	F260 W280 Y350 M351 R356 R357 I358 F383 L387	F260-L354 HydrophobicContact CD1-CD2 4.49Å; W280-L354 VanDerWaalsContact NE1-CD1 3.34Å; Y350-L354 HydrophobicContact CD1-CD1 3.97Å; Y350-L354 HydrophobicContact CE1-CD1 3.33Å; Y350-L354 HydrophobicContact CE1-CG 4.15Å; Y350-L354 HydrophobicContact CE2-CD1 4.25Å; Y350-L354 HydrophobicContact CE2-CD2 4.44Å; Y350-L354 HydrophobicContact CE2-CG 4.27Å; Y350-L354 VanDerWaalsContact CZ-CD1 3.5Å; Y350-L354 WeakPolarHBondContact O-CG 3.25Å; Y350-L354 PolarHBondContact O-N 3.35Å; M351-L354 PolarHBondContact O-N 3.03Å; M351-L354 HydrophobicContact SD-CD1 4.46Å; L354-R356 VanDerWaalsContact C-N 3.28Å; L354-R356 PolarHBondContact O-N 3.4Å; L354-R357 PolarHBondContact O-N 3.13Å; L354-I358 WeakPolarHBondContact O-CB 3.31Å; L354-I358 PolarHBondContact O-N 2.89Å; L354-F383 HydrophobicContact CB-CZ 4.28Å; L354-L387 HydrophobicContact CB-CD1 4.48Å; L354-L387 HydrophobicContact CD1-CD1 3.66Å
355	N	92.8	Very high	91.6	Very high	76 Å²	76	51.3 Å²	51.3	41%	0.406	26%	0.26	S	S	.	.	H	α-helix	trans	-56.6	-42.5	176.5	-80.2	-57.4	0	0	0	112	M351 R352 G359 F383 L387	M351-N355 WeakPolarHBondContact O-CB 3.36Å; M351-N355 PolarHBondContact O-N 3.38Å; M351-N355 PolarHBondContact O-ND2 3.4Å; R352-N355 PolarHBondContact O-N 3.22Å; N355-G359 VanDerWaalsContact O-CA 3.28Å; N355-G359 WeakPolarHBondContact O-CA 3.34Å; N355-G359 PolarHBondContact O-N 3.12Å; N355-F383 WeakPolarHBondContact OD1-CE1 3.44Å; N355-L387 VanDerWaalsContact ND2-CD2 3.28Å; N355-L387 WeakPolarHBondContact ND2-CD2 3.45Å; N355-L387 WeakPolarHBondContact OD1-CD2 3.28Å
356	R	92.2	Very high	91.2	Very high	215 Å²	215	52.7 Å²	52.7	81%	0.811	27%	0.272	S	S	*	.	H	α-helix	trans	-68.3	-42.9	178.8	-174.9	177.4	-179.4	-176.1	-0.5	112.1	R352 F353 L354 G360	R352-R356 WeakPolarHBondContact O-CB 3.32Å; R352-R356 PolarHBondContact O-N 2.99Å; F353-R356 PolarHBondContact O-N 3.16Å; L354-R356 VanDerWaalsContact C-N 3.28Å; L354-R356 PolarHBondContact O-N 3.4Å; R356-G360 PolarHBondContact O-N 3.21Å
357	R	92.6	Very high	90.7	Very high	98 Å²	98	53.5 Å²	53.5	37%	0.37	28%	0.279	S	S	.	.	H	α-helix	trans	-70.2	-53.8	-177.4	-74.7	-71.9	-177.6	-171.8	-1.7	111.7	F260 E261 F353 L354 G360 S361	F260-R357 HydrophobicContact CE1-CB 4.03Å; E261-R357 IonicContact OE1-CZ 3.33Å; E261-R357 IonicContact OE1-NH2 3.24Å; E261-R357 PolarHBondContact OE1-NH2 3.05Å; F353-R357 HydrophobicContact CD1-CG 4.48Å; F353-R357 HydrophobicContact CD2-CG 4.03Å; F353-R357 HydrophobicContact CE1-CG 4.1Å; F353-R357 HydrophobicContact CE2-CG 3.64Å; F353-R357 HydrophobicContact CG-CG 4.44Å; F353-R357 HydrophobicContact CZ-CG 3.67Å; F353-R357 WeakPolarHBondContact O-CB 3.47Å; F353-R357 WeakPolarHBondContact O-CG 3.3Å; F353-R357 PolarHBondContact O-N 3.39Å; L354-R357 PolarHBondContact O-N 3.13Å; R357-G360 PolarHBondContact O-N 3.24Å; R357-S361 PolarHBondContact O-N 2.84Å; R357-S361 VanDerWaalsContact O-N 3.08Å; R357-S361 PolarHBondContact O-OG 2.66Å
358	I	92.3	Very high	90.3	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-70	-43.7	-178.8	-68.7	169.8	0	0	0	109.9	F260 L277 W280 L354 G360 S361 L362 F383	F260-I358 HydrophobicContact CE1-CG1 4.09Å; F260-I358 HydrophobicContact CZ-CD1 3.99Å; F260-I358 HydrophobicContact CZ-CG1 3.73Å; L277-I358 HydrophobicContact CD2-CG2 3.6Å; W280-I358 HydrophobicContact CB-CD1 3.93Å; W280-I358 HydrophobicContact CD2-CD1 3.97Å; W280-I358 HydrophobicContact CG-CD1 3.55Å; L354-I358 WeakPolarHBondContact O-CB 3.31Å; L354-I358 PolarHBondContact O-N 2.89Å; I358-G360 VanDerWaalsContact C-N 3.27Å; I358-G360 PolarHBondContact O-N 2.99Å; I358-S361 PolarHBondContact O-N 3.1Å; I358-S361 VanDerWaalsContact O-N 3.14Å; I358-L362 HydrophobicContact CG2-CD1 3.6Å; I358-L362 WeakPolarHBondContact O-CD1 3.44Å; I358-L362 PolarHBondContact O-N 3.39Å; I358-F383 HydrophobicContact CB-CE1 4.12Å; I358-F383 HydrophobicContact CB-CE2 4.3Å; I358-F383 HydrophobicContact CB-CZ 3.99Å; I358-F383 HydrophobicContact CD1-CD2 3.93Å; I358-F383 HydrophobicContact CD1-CE2 3.25Å; I358-F383 HydrophobicContact CD1-CZ 3.6Å; I358-F383 HydrophobicContact CG1-CE2 4.34Å; I358-F383 HydrophobicContact CG1-CZ 4.35Å; I358-F383 HydrophobicContact CG2-CD1 3.91Å; I358-F383 HydrophobicContact CG2-CD2 4.06Å; I358-F383 HydrophobicContact CG2-CE1 4Å; I358-F383 HydrophobicContact CG2-CE2 4.15Å; I358-F383 HydrophobicContact CG2-CG 3.94Å; I358-F383 HydrophobicContact CG2-CZ 4.11Å
359	G	89.6	Confident	90.2	Very high	23 Å²	23	61 Å²	61	24%	0.237	32%	0.322	C	S	.	.	H	α-helix	trans	-59.1	-38.1	174.3	0	0	0	0	0	112.9	N355 A363	N355-G359 VanDerWaalsContact O-CA 3.28Å; N355-G359 WeakPolarHBondContact O-CA 3.34Å; N355-G359 PolarHBondContact O-N 3.12Å; G359-A363 WeakPolarHBondContact O-CB 3.4Å; G359-A363 PolarHBondContact O-N 3.13Å
360	G	89.7	Confident	90	Very high	39 Å²	39	62.2 Å²	62.2	40%	0.402	33%	0.326	S	S	.	.	H	α-helix	trans	-63.4	-42.4	173.9	0	0	0	0	0	113	R356 R357 I358 A363	R356-G360 PolarHBondContact O-N 3.21Å; R357-G360 PolarHBondContact O-N 3.24Å; I358-G360 VanDerWaalsContact C-N 3.27Å; I358-G360 PolarHBondContact O-N 2.99Å; G360-A363 WeakPolarHBondContact O-CB 3.47Å; G360-A363 PolarHBondContact O-N 3.3Å
361	S	88.4	Confident	89.6	Confident	12 Å²	12	69.1 Å²	69.1	8%	0.084	36%	0.358	C	S	.	.	H	α-helix	trans	-72.1	-38.1	178.5	-60.9	0	0	0	0	113.4	Q264 E268 R357 I358 A363 T364	Q264-S361 PolarHBondContact NE2-OG 3.01Å; E268-S361 WeakPolarHBondContact OE1-CB 3.16Å; E268-S361 PolarHBondContact OE1-OG 3.38Å; R357-S361 PolarHBondContact O-N 2.84Å; R357-S361 VanDerWaalsContact O-N 3.08Å; R357-S361 PolarHBondContact O-OG 2.66Å; I358-S361 PolarHBondContact O-N 3.1Å; I358-S361 VanDerWaalsContact O-N 3.14Å; S361-A363 PolarHBondContact O-N 3.46Å; S361-T364 PolarHBondContact O-N 2.88Å; S361-T364 PolarHBondContact O-OG1 3.19Å
362	L	88.6	Confident	89.3	Confident	1 Å²	1	74.2 Å²	74.2	1%	0.005	38%	0.377	C	S	.	.	H	α-helix	trans	-69.2	-24.5	173.8	-84.1	73.5	0	0	0	111.4	I273 L277 I358 T364 L365 K376 M379 L380	I273-L362 HydrophobicContact CG2-CD1 4.37Å; L277-L362 HydrophobicContact CD2-CD1 4.35Å; I358-L362 HydrophobicContact CG2-CD1 3.6Å; I358-L362 WeakPolarHBondContact O-CD1 3.44Å; I358-L362 PolarHBondContact O-N 3.39Å; L362-T364 PolarHBondContact O-N 3.5Å; L362-L365 HydrophobicContact CG-CD1 4.41Å; L362-L365 WeakPolarHBondContact O-CB 3.35Å; L362-L365 PolarHBondContact O-N 3.25Å; L362-K376 WeakPolarHBondContact O-CE 3.28Å; L362-M379 HydrophobicContact CD2-CB 3.6Å; L362-L380 HydrophobicContact CB-CD2 4.1Å; L362-L380 HydrophobicContact CB-CG 4.39Å; L362-L380 HydrophobicContact CD2-CD2 3.78Å; L362-L380 HydrophobicContact CD2-CG 3.75Å
363	A	87.5	Confident	89.2	Confident	61 Å²	61	74 Å²	74	50%	0.504	38%	0.378	S	S	.	.	H	α-helix	trans	-66.7	-23.5	175.9	0	0	0	0	0	113.4	G359 G360 S361 L365	G359-A363 WeakPolarHBondContact O-CB 3.4Å; G359-A363 PolarHBondContact O-N 3.13Å; G360-A363 WeakPolarHBondContact O-CB 3.47Å; G360-A363 PolarHBondContact O-N 3.3Å; S361-A363 PolarHBondContact O-N 3.46Å; A363-L365 VanDerWaalsContact C-N 3.29Å; A363-L365 PolarHBondContact O-N 3.12Å
364	T	86.6	Confident	88.9	Confident	102 Å²	102	76.8 Å²	76.8	63%	0.626	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-11.2	178.9	68.8	0	0	0	0	113.5	S361 L362	S361-T364 PolarHBondContact O-N 2.88Å; S361-T364 PolarHBondContact O-OG1 3.19Å; L362-T364 PolarHBondContact O-N 3.5Å
365	L	86	Confident	88.5	Confident	38 Å²	38	83 Å²	83	20%	0.199	42%	0.419	C	S	.	.	S	Bend	trans	-64.8	132.7	177.8	-73	169	0	0	0	111.2	I273 L362 A363 K376 M379	I273-L365 HydrophobicContact CB-CD2 4.15Å; I273-L365 HydrophobicContact CD1-CD2 3.46Å; I273-L365 VanDerWaalsContact CD1-CD2 3.46Å; I273-L365 HydrophobicContact CD1-CG 3.93Å; I273-L365 HydrophobicContact CG1-CD2 4.39Å; I273-L365 HydrophobicContact CG2-CD1 4.03Å; I273-L365 HydrophobicContact CG2-CD2 4.19Å; I273-L365 HydrophobicContact CG2-CG 4.15Å; L362-L365 HydrophobicContact CG-CD1 4.41Å; L362-L365 WeakPolarHBondContact O-CB 3.35Å; L362-L365 PolarHBondContact O-N 3.25Å; A363-L365 VanDerWaalsContact C-N 3.29Å; A363-L365 PolarHBondContact O-N 3.12Å; L365-K376 HydrophobicContact CB-CD 4.46Å; L365-M379 HydrophobicContact CD1-CE 4.29Å; L365-M379 HydrophobicContact CD1-SD 4.38Å
366	P	83.1	Confident	88.3	Confident	67 Å²	67	80.7 Å²	80.7	44%	0.435	41%	0.405	S	S	.	.			trans	-60.4	137.8	176.3	-22	31.6	0	0	0	112.5	D368 R372	P366-D368 WeakPolarHBondContact CB-OD2 3.29Å; P366-R372 WeakPolarHBondContact O-CB 3.41Å
367	E	83	Confident	88.2	Confident	88 Å²	88	77.1 Å²	77.1	41%	0.411	40%	0.398	S	S	.	.			trans	-111.2	21.6	-178.9	-73	-170.4	-177.4	0	0	112.9	T369 K373 K376	E367-T369 VanDerWaalsContact C-N 3.27Å; E367-T369 PolarHBondContact O-N 3.4Å; E367-K373 HydrophobicContact CB-CD 4.46Å; E367-K373 HydrophobicContact CB-CG 3.77Å; E367-K373 HydrophobicContact CG-CG 4.04Å; E367-K373 WeakPolarHBondContact O-CE 3.46Å; E367-K376 HydrophobicContact CG-CD 4.1Å; E367-K376 WeakPolarHBondContact OE1-CD 3.48Å; E367-K376 VanDerWaalsContact OE1-CE 3.31Å; E367-K376 WeakPolarHBondContact OE1-CE 3.4Å; E367-K376 IonicContact OE1-NZ 3.92Å; E367-K376 PolarHBondContact OE1-NZ 3.16Å
368	D	87.5	Confident	88.1	Confident	133 Å²	133	77.4 Å²	77.4	71%	0.711	41%	0.407	S	S	*	.	S	Bend	trans	-66.5	-29.8	-169.8	-46.3	-49.9	0	0	0	113.2	P366 R372	P366-D368 WeakPolarHBondContact CB-OD2 3.29Å; D368-R372 IonicContact OD2-NH1 2.65Å; D368-R372 PolarHBondContact OD2-NH1 2.81Å
369	T	89.2	Confident	88	Confident	63 Å²	63	78.7 Å²	78.7	39%	0.387	41%	0.413	S	S	.	.	S	Bend	trans	-113.2	148.9	178.8	63.6	0	0	0	0	111.3	E367 E371 R372 K373	E367-T369 VanDerWaalsContact C-N 3.27Å; E367-T369 PolarHBondContact O-N 3.4Å; T369-E371 VanDerWaalsContact C-N 3.26Å; T369-E371 PolarHBondContact O-N 3.11Å; T369-R372 PolarHBondContact O-N 2.99Å; T369-R372 VanDerWaalsContact O-N 3.1Å; T369-R372 VanDerWaalsContact OG1-CG 3.27Å; T369-R372 WeakPolarHBondContact OG1-CG 3.31Å; T369-R372 PolarHBondContact OG1-N 3.19Å; T369-K373 PolarHBondContact O-N 2.93Å; T369-K373 VanDerWaalsContact O-N 3.12Å
370	Q	88.2	Confident	88	Confident	118 Å²	118	80.9 Å²	80.9	55%	0.551	42%	0.419	S	S	*	.	H	α-helix	trans	-57	-40.9	176.9	-177.6	60.2	18.9	0	0	111.7	R372 K373 E374	Q370-R372 VanDerWaalsContact C-N 3.33Å; Q370-R372 PolarHBondContact O-N 3.14Å; Q370-K373 WeakPolarHBondContact O-CB 3.39Å; Q370-K373 PolarHBondContact O-N 3.26Å; Q370-E374 WeakPolarHBondContact CG-OE1 3.22Å; Q370-E374 PolarHBondContact NE2-OE1 3.14Å; Q370-E374 WeakPolarHBondContact O-CG 3.33Å; Q370-E374 PolarHBondContact O-N 3.41Å
371	E	87.7	Confident	88.1	Confident	155 Å²	155	84 Å²	84	72%	0.724	43%	0.426	S	S	*	.	H	α-helix	trans	-59.4	-39.6	176.1	-64.1	178.4	176	0	0	112.9	T369 E374 K375	T369-E371 VanDerWaalsContact C-N 3.26Å; T369-E371 PolarHBondContact O-N 3.11Å; E371-E374 PolarHBondContact O-N 2.77Å; E371-K375 WeakPolarHBondContact O-CB 3.42Å; E371-K375 PolarHBondContact O-N 3.05Å
372	R	87.8	Confident	88.3	Confident	127 Å²	127	87.9 Å²	87.9	48%	0.479	44%	0.442	S	S	.	.	H	α-helix	trans	-70.2	-38.1	177.7	-75	176	-178.8	179.9	-0	112	P366 D368 T369 Q370 K375 K376	P366-R372 WeakPolarHBondContact O-CB 3.41Å; D368-R372 IonicContact OD2-NH1 2.65Å; D368-R372 PolarHBondContact OD2-NH1 2.81Å; T369-R372 PolarHBondContact O-N 2.99Å; T369-R372 VanDerWaalsContact O-N 3.1Å; T369-R372 VanDerWaalsContact OG1-CG 3.27Å; T369-R372 WeakPolarHBondContact OG1-CG 3.31Å; T369-R372 PolarHBondContact OG1-N 3.19Å; Q370-R372 VanDerWaalsContact C-N 3.33Å; Q370-R372 PolarHBondContact O-N 3.14Å; R372-K375 PolarHBondContact O-N 3.32Å; R372-K376 WeakPolarHBondContact O-CB 3.47Å; R372-K376 PolarHBondContact O-N 2.9Å
373	K	88.6	Confident	88.5	Confident	91 Å²	91	88 Å²	88	40%	0.396	44%	0.443	S	S	.	.	H	α-helix	trans	-60.2	-47.7	173.1	-70.3	-176.3	-178.5	-178.1	0	111.1	E367 T369 Q370 K376 Q377	E367-K373 HydrophobicContact CB-CD 4.46Å; E367-K373 HydrophobicContact CB-CG 3.77Å; E367-K373 HydrophobicContact CG-CG 4.04Å; E367-K373 WeakPolarHBondContact O-CE 3.46Å; T369-K373 PolarHBondContact O-N 2.93Å; T369-K373 VanDerWaalsContact O-N 3.12Å; Q370-K373 WeakPolarHBondContact O-CB 3.39Å; Q370-K373 PolarHBondContact O-N 3.26Å; K373-K376 PolarHBondContact O-N 2.98Å; K373-Q377 WeakPolarHBondContact O-CB 3.42Å; K373-Q377 PolarHBondContact O-N 3.25Å
374	E	90.4	Very high	88.8	Confident	105 Å²	105	86 Å²	86	49%	0.491	43%	0.428	S	S	.	.	H	α-helix	trans	-62.4	-44.9	178.2	-73.3	172	-170.3	0	0	111.5	Q370 E371 K376 Q377 D378	Q370-E374 WeakPolarHBondContact CG-OE1 3.22Å; Q370-E374 PolarHBondContact NE2-OE1 3.14Å; Q370-E374 WeakPolarHBondContact O-CG 3.33Å; Q370-E374 PolarHBondContact O-N 3.41Å; E371-E374 PolarHBondContact O-N 2.77Å; E374-K376 PolarHBondContact O-N 2.68Å; E374-Q377 PolarHBondContact O-N 3.36Å; E374-D378 WeakPolarHBondContact O-CB 3.41Å; E374-D378 PolarHBondContact O-N 3.36Å
375	K	87.3	Confident	89.1	Confident	132 Å²	132	85.4 Å²	85.4	57%	0.574	42%	0.42	S	S	*	.	H	α-helix	trans	-61.2	-42.4	176.5	-163.5	-171.7	-178.1	177.8	0	112.4	E371 R372 D378 M379	E371-K375 WeakPolarHBondContact O-CB 3.42Å; E371-K375 PolarHBondContact O-N 3.05Å; R372-K375 PolarHBondContact O-N 3.32Å; K375-D378 PolarHBondContact O-N 3.05Å; K375-M379 HydrophobicContact CD-CE 3.75Å; K375-M379 HydrophobicContact CG-CE 3.59Å; K375-M379 WeakPolarHBondContact O-CG 3.3Å; K375-M379 PolarHBondContact O-N 3.18Å
376	K	88.6	Confident	89.5	Confident	26 Å²	26	86.2 Å²	86.2	11%	0.113	42%	0.423	C	S	.	.	H	α-helix	trans	-62.9	-44.2	175.5	175.7	-179.6	174.1	174.4	0	111.3	L362 L365 E367 R372 K373 E374 M379 L380	L362-K376 WeakPolarHBondContact O-CE 3.28Å; L365-K376 HydrophobicContact CB-CD 4.46Å; E367-K376 HydrophobicContact CG-CD 4.1Å; E367-K376 WeakPolarHBondContact OE1-CD 3.48Å; E367-K376 VanDerWaalsContact OE1-CE 3.31Å; E367-K376 WeakPolarHBondContact OE1-CE 3.4Å; E367-K376 IonicContact OE1-NZ 3.92Å; E367-K376 PolarHBondContact OE1-NZ 3.16Å; R372-K376 WeakPolarHBondContact O-CB 3.47Å; R372-K376 PolarHBondContact O-N 2.9Å; K373-K376 PolarHBondContact O-N 2.98Å; E374-K376 PolarHBondContact O-N 2.68Å; K376-M379 PolarHBondContact O-N 3.31Å; K376-L380 HydrophobicContact CG-CD1 4.25Å; K376-L380 WeakPolarHBondContact O-CG 3.37Å; K376-L380 PolarHBondContact O-N 3.45Å
377	Q	89.9	Confident	90	Very high	141 Å²	141	83.4 Å²	83.4	66%	0.659	40%	0.404	S	S	*	.	H	α-helix	trans	-65.1	-41.1	178.5	-173.8	174.4	-2.7	0	0	111.7	K373 E374 L380 L381	K373-Q377 WeakPolarHBondContact O-CB 3.42Å; K373-Q377 PolarHBondContact O-N 3.25Å; E374-Q377 PolarHBondContact O-N 3.36Å; Q377-L380 PolarHBondContact O-N 3.28Å; Q377-L381 WeakPolarHBondContact O-CB 3.39Å; Q377-L381 PolarHBondContact O-N 3.48Å
378	D	90.7	Very high	90.4	Very high	103 Å²	103	89 Å²	89	55%	0.551	42%	0.422	S	S	*	.	H	α-helix	trans	-62.7	-44.3	175.5	-173.8	47.7	0	0	0	111.5	E374 K375 L380 L381 H382	E374-D378 WeakPolarHBondContact O-CB 3.41Å; E374-D378 PolarHBondContact O-N 3.36Å; K375-D378 PolarHBondContact O-N 3.05Å; D378-L380 PolarHBondContact O-N 2.61Å; D378-L381 PolarHBondContact O-N 2.9Å; D378-H382 VanDerWaalsContact O-CB 3.28Å; D378-H382 WeakPolarHBondContact O-CB 3.36Å; D378-H382 PolarHBondContact O-N 3.2Å
379	M	89.7	Confident	90.6	Very high	27 Å²	27	86.9 Å²	86.9	13%	0.133	41%	0.413	C	S	.	.	H	α-helix	trans	-60.8	-44.5	174.4	-73.8	-171.4	-129.7	0	0	112.8	L277 L362 L365 K375 K376 L381 H382 F383	L277-M379 HydrophobicContact CD1-CB 4.03Å; L277-M379 HydrophobicContact CD1-CG 4.15Å; L277-M379 HydrophobicContact CD1-SD 4.28Å; L362-M379 HydrophobicContact CD2-CB 3.6Å; L365-M379 HydrophobicContact CD1-CE 4.29Å; L365-M379 HydrophobicContact CD1-SD 4.38Å; K375-M379 HydrophobicContact CD-CE 3.75Å; K375-M379 HydrophobicContact CG-CE 3.59Å; K375-M379 WeakPolarHBondContact O-CG 3.3Å; K375-M379 PolarHBondContact O-N 3.18Å; K376-M379 PolarHBondContact O-N 3.31Å; M379-L381 VanDerWaalsContact C-N 3.35Å; M379-H382 PolarHBondContact O-N 3.41Å; M379-F383 WeakPolarHBondContact O-CB 3.39Å; M379-F383 PolarHBondContact O-N 3.33Å
380	L	90	Very high	90.9	Very high	69 Å²	69	84.5 Å²	84.5	36%	0.361	40%	0.399	S	S	.	.	H	α-helix	trans	-62.9	-42.5	177	-78.3	168.4	0	0	0	111.7	L362 K376 Q377 D378 G384	L362-L380 HydrophobicContact CB-CD2 4.1Å; L362-L380 HydrophobicContact CB-CG 4.39Å; L362-L380 HydrophobicContact CD2-CD2 3.78Å; L362-L380 HydrophobicContact CD2-CG 3.75Å; K376-L380 HydrophobicContact CG-CD1 4.25Å; K376-L380 WeakPolarHBondContact O-CG 3.37Å; K376-L380 PolarHBondContact O-N 3.45Å; Q377-L380 PolarHBondContact O-N 3.28Å; D378-L380 PolarHBondContact O-N 2.61Å; L380-G384 PolarHBondContact O-N 3.46Å
381	L	91.9	Very high	91.3	Very high	104 Å²	104	82.9 Å²	82.9	55%	0.545	40%	0.395	S	S	.	.	H	α-helix	trans	-64.4	-48.1	177.6	179.5	62.8	0	0	0	110.8	Q377 D378 M379 G384 I385	Q377-L381 WeakPolarHBondContact O-CB 3.39Å; Q377-L381 PolarHBondContact O-N 3.48Å; D378-L381 PolarHBondContact O-N 2.9Å; M379-L381 VanDerWaalsContact C-N 3.35Å; L381-G384 PolarHBondContact O-N 3.28Å; L381-I385 HydrophobicContact CD1-CD1 4.03Å; L381-I385 HydrophobicContact CD1-CG1 4.36Å; L381-I385 HydrophobicContact CG-CD1 3.93Å; L381-I385 VanDerWaalsContact O-CG1 3.3Å; L381-I385 WeakPolarHBondContact O-CG1 3.27Å; L381-I385 PolarHBondContact O-N 3.35Å
382	H	91.3	Very high	91.6	Very high	94 Å²	94	75.6 Å²	75.6	44%	0.435	36%	0.36	S	S	.	.	H	α-helix	trans	-59.8	-49.4	179.6	-171.8	76.9	0	0	0	111.7	D378 M379 G384 I385 Q386	D378-H382 VanDerWaalsContact O-CB 3.28Å; D378-H382 WeakPolarHBondContact O-CB 3.36Å; D378-H382 PolarHBondContact O-N 3.2Å; M379-H382 PolarHBondContact O-N 3.41Å; H382-G384 PolarHBondContact O-N 3.45Å; H382-I385 PolarHBondContact O-N 3.02Å; H382-Q386 VanDerWaalsContact CD2-CD 3.46Å; H382-Q386 PolarHBondContact CD2-OE1 3.4Å; H382-Q386 PolarHBondContact NE2-NE2 3.05Å; H382-Q386 PolarHBondContact NE2-OE1 3.11Å; H382-Q386 WeakPolarHBondContact O-CG 3.26Å; H382-Q386 PolarHBondContact O-N 3Å
383	F	93.9	Very high	92	Very high	4 Å²	4	70.4 Å²	70.4	2%	0.018	34%	0.344	C	S	.	.	H	α-helix	trans	-58.2	-46.8	174.7	168.1	-108.3	0	0	0	111.7	L277 W280 L354 N355 I358 M379 I385 Q386 L387	L277-F383 HydrophobicContact CD2-CB 4.07Å; L277-F383 HydrophobicContact CD2-CD2 4.15Å; L277-F383 HydrophobicContact CD2-CG 4.27Å; W280-F383 HydrophobicContact CD2-CD2 4.17Å; W280-F383 AromaticContact CD2-CE2 3.85Å; W280-F383 HydrophobicContact CD2-CE2 3.85Å; W280-F383 AromaticContact CE2-CE2 3.72Å; W280-F383 AromaticContact CE3-CD2 3.81Å; W280-F383 HydrophobicContact CE3-CD2 3.81Å; W280-F383 AromaticContact CE3-CE2 3.97Å; W280-F383 HydrophobicContact CE3-CE2 3.97Å; W280-F383 AromaticContact CH2-CD2 3.9Å; W280-F383 HydrophobicContact CH2-CD2 3.9Å; W280-F383 AromaticContact CH2-CE2 3.85Å; W280-F383 HydrophobicContact CH2-CE2 3.85Å; W280-F383 HydrophobicContact CZ2-CD2 4.27Å; W280-F383 AromaticContact CZ2-CE2 3.74Å; W280-F383 HydrophobicContact CZ2-CE2 3.74Å; W280-F383 AromaticContact CZ3-CD2 3.67Å; W280-F383 HydrophobicContact CZ3-CD2 3.67Å; W280-F383 AromaticContact CZ3-CE2 3.97Å; W280-F383 HydrophobicContact CZ3-CE2 3.97Å; L354-F383 HydrophobicContact CB-CZ 4.28Å; N355-F383 WeakPolarHBondContact OD1-CE1 3.44Å; I358-F383 HydrophobicContact CB-CE1 4.12Å; I358-F383 HydrophobicContact CB-CE2 4.3Å; I358-F383 HydrophobicContact CB-CZ 3.99Å; I358-F383 HydrophobicContact CD1-CD2 3.93Å; I358-F383 HydrophobicContact CD1-CE2 3.25Å; I358-F383 HydrophobicContact CD1-CZ 3.6Å; I358-F383 HydrophobicContact CG1-CE2 4.34Å; I358-F383 HydrophobicContact CG1-CZ 4.35Å; I358-F383 HydrophobicContact CG2-CD1 3.91Å; I358-F383 HydrophobicContact CG2-CD2 4.06Å; I358-F383 HydrophobicContact CG2-CE1 4Å; I358-F383 HydrophobicContact CG2-CE2 4.15Å; I358-F383 HydrophobicContact CG2-CG 3.94Å; I358-F383 HydrophobicContact CG2-CZ 4.11Å; M379-F383 WeakPolarHBondContact O-CB 3.39Å; M379-F383 PolarHBondContact O-N 3.33Å; F383-I385 VanDerWaalsContact C-N 3.32Å; F383-I385 PolarHBondContact O-N 3.49Å; F383-Q386 PolarHBondContact O-N 3.44Å; F383-L387 HydrophobicContact CE1-CD2 4.24Å; F383-L387 HydrophobicContact CE2-CB 4.46Å; F383-L387 HydrophobicContact CE2-CD1 4.42Å; F383-L387 HydrophobicContact CZ-CB 4.48Å; F383-L387 HydrophobicContact CZ-CD1 4.39Å; F383-L387 HydrophobicContact CZ-CD2 3.89Å; F383-L387 WeakPolarHBondContact O-CB 3.46Å; F383-L387 PolarHBondContact O-N 3.13Å
384	G	92.9	Very high	92.3	Very high	19 Å²	19	73.6 Å²	73.6	20%	0.196	35%	0.353	C	S	.	.	H	α-helix	trans	-60.1	-39.5	178.8	0	0	0	0	0	113	L380 L381 H382 R388	L380-G384 PolarHBondContact O-N 3.46Å; L381-G384 PolarHBondContact O-N 3.28Å; H382-G384 PolarHBondContact O-N 3.45Å; G384-R388 WeakPolarHBondContact O-CB 3.45Å; G384-R388 VanDerWaalsContact O-CG 3.24Å; G384-R388 WeakPolarHBondContact O-CG 3.36Å; G384-R388 PolarHBondContact O-N 3.1Å
385	I	93.9	Very high	92.5	Very high	89 Å²	89	72 Å²	72	46%	0.456	34%	0.343	S	S	.	.	H	α-helix	trans	-65.5	-53.8	174.3	-68.4	166.3	0	0	0	109.7	L381 H382 F383 L387 R388 T389	L381-I385 HydrophobicContact CD1-CD1 4.03Å; L381-I385 HydrophobicContact CD1-CG1 4.36Å; L381-I385 HydrophobicContact CG-CD1 3.93Å; L381-I385 VanDerWaalsContact O-CG1 3.3Å; L381-I385 WeakPolarHBondContact O-CG1 3.27Å; L381-I385 PolarHBondContact O-N 3.35Å; H382-I385 PolarHBondContact O-N 3.02Å; F383-I385 VanDerWaalsContact C-N 3.32Å; F383-I385 PolarHBondContact O-N 3.49Å; I385-L387 VanDerWaalsContact C-N 3.3Å; I385-L387 PolarHBondContact O-N 2.88Å; I385-R388 PolarHBondContact O-N 2.96Å; I385-T389 HydrophobicContact CG2-CG2 4.17Å; I385-T389 WeakPolarHBondContact O-CG2 3.45Å; I385-T389 PolarHBondContact O-N 3.34Å; I385-T389 PolarHBondContact O-OG1 3.06Å
386	Q	93.1	Very high	92.9	Very high	56 Å²	56	66.3 Å²	66.3	26%	0.262	32%	0.319	S	S	.	.	H	α-helix	trans	-56.9	-42.8	-178.4	-74	-178.3	-41	0	0	112.4	W280 H382 F383 R388 T389 C390	W280-Q386 HydrophobicContact CH2-CB 3.89Å; W280-Q386 HydrophobicContact CZ3-CB 3.96Å; H382-Q386 VanDerWaalsContact CD2-CD 3.46Å; H382-Q386 PolarHBondContact CD2-OE1 3.4Å; H382-Q386 PolarHBondContact NE2-NE2 3.05Å; H382-Q386 PolarHBondContact NE2-OE1 3.11Å; H382-Q386 WeakPolarHBondContact O-CG 3.26Å; H382-Q386 PolarHBondContact O-N 3Å; F383-Q386 PolarHBondContact O-N 3.44Å; Q386-R388 VanDerWaalsContact C-N 3.35Å; Q386-R388 PolarHBondContact O-N 3.26Å; Q386-T389 PolarHBondContact O-N 3.45Å; Q386-C390 WeakPolarHBondContact O-CB 3.42Å; Q386-C390 PolarHBondContact O-N 3.29Å
387	L	94.1	Very high	93.1	Very high	7 Å²	7	71 Å²	71	4%	0.037	34%	0.341	C	S	.	.	H	α-helix	trans	-63.2	-41.4	177.7	-168.7	70.5	0	0	0	111.4	W280 M351 L354 N355 F383 I385 C390 S393	W280-L387 HydrophobicContact CH2-CB 4.37Å; W280-L387 HydrophobicContact CH2-CD1 4.31Å; W280-L387 HydrophobicContact CZ2-CB 4.43Å; W280-L387 HydrophobicContact CZ2-CD1 3.56Å; M351-L387 HydrophobicContact CE-CD1 4.47Å; M351-L387 HydrophobicContact SD-CD1 3.3Å; M351-L387 WeakPolarHBondContact SD-CD1 3.38Å; M351-L387 HydrophobicContact SD-CD2 4.25Å; M351-L387 HydrophobicContact SD-CG 3.68Å; L354-L387 HydrophobicContact CB-CD1 4.48Å; L354-L387 HydrophobicContact CD1-CD1 3.66Å; N355-L387 VanDerWaalsContact ND2-CD2 3.28Å; N355-L387 WeakPolarHBondContact ND2-CD2 3.45Å; N355-L387 WeakPolarHBondContact OD1-CD2 3.28Å; F383-L387 HydrophobicContact CE1-CD2 4.24Å; F383-L387 HydrophobicContact CE2-CB 4.46Å; F383-L387 HydrophobicContact CE2-CD1 4.42Å; F383-L387 HydrophobicContact CZ-CB 4.48Å; F383-L387 HydrophobicContact CZ-CD1 4.39Å; F383-L387 HydrophobicContact CZ-CD2 3.89Å; F383-L387 WeakPolarHBondContact O-CB 3.46Å; F383-L387 PolarHBondContact O-N 3.13Å; I385-L387 VanDerWaalsContact C-N 3.3Å; I385-L387 PolarHBondContact O-N 2.88Å; L387-C390 PolarHBondContact O-SG 2.79Å; L387-S393 PolarHBondContact O-OG 3.39Å
388	R	91.6	Very high	93.3	Very high	207 Å²	207	68.1 Å²	68.1	78%	0.781	33%	0.328	S	S	*	.	H	α-helix	trans	-73.4	-32.2	178.8	-71.8	177.8	-173.7	-79.9	1	113.1	G384 I385 Q386 S393	G384-R388 WeakPolarHBondContact O-CB 3.45Å; G384-R388 VanDerWaalsContact O-CG 3.24Å; G384-R388 WeakPolarHBondContact O-CG 3.36Å; G384-R388 PolarHBondContact O-N 3.1Å; I385-R388 PolarHBondContact O-N 2.96Å; Q386-R388 VanDerWaalsContact C-N 3.35Å; Q386-R388 PolarHBondContact O-N 3.26Å; R388-S393 VanDerWaalsContact O-CB 3.22Å; R388-S393 WeakPolarHBondContact O-CB 3.46Å
389	T	92.9	Very high	93.5	Very high	87 Å²	87	63.3 Å²	63.3	53%	0.534	30%	0.302	S	S	.	.	H	α-helix	trans	-93.8	-7.3	-177.3	59.6	0	0	0	0	113.9	I385 Q386	I385-T389 HydrophobicContact CG2-CG2 4.17Å; I385-T389 WeakPolarHBondContact O-CG2 3.45Å; I385-T389 PolarHBondContact O-N 3.34Å; I385-T389 PolarHBondContact O-OG1 3.06Å; Q386-T389 PolarHBondContact O-N 3.45Å
390	C	94.7	Very high	93.7	Very high	14 Å²	14	62.5 Å²	62.5	10%	0.095	30%	0.298	C	S	.	.	S	Bend	trans	-60.1	156.4	179.8	75	0	0	0	0	111.9	Q386 L387 L392 S393 R394	Q386-C390 WeakPolarHBondContact O-CB 3.42Å; Q386-C390 PolarHBondContact O-N 3.29Å; L387-C390 PolarHBondContact O-SG 2.79Å; C390-L392 VanDerWaalsContact C-N 3.26Å; C390-L392 PolarHBondContact O-N 2.84Å; C390-S393 PolarHBondContact O-N 2.7Å; C390-S393 VanDerWaalsContact O-N 3.14Å; C390-S393 PolarHBondContact SG-N 3.35Å; C390-S393 PolarHBondContact SG-OG 2.97Å; C390-S393 VanDerWaalsContact SG-OG 3.38Å; C390-R394 PolarHBondContact O-N 2.69Å
391	N	95.6	Very high	93.9	Very high	84 Å²	84	61 Å²	61	45%	0.449	30%	0.299	S	S	.	.	H	α-helix	trans	-59.8	-37.7	-176.6	-73.4	-36.9	0	0	0	112.1	N288 S393 R394 R395	N288-N391 HydrophobicContact CB-CB 4.09Å; N391-S393 PolarHBondContact O-N 3.46Å; N391-R394 PolarHBondContact O-N 3.47Å; N391-R395 WeakPolarHBondContact O-CG 3.29Å; N391-R395 PolarHBondContact O-N 3.21Å
392	L	95.7	Very high	94.1	Very high	1 Å²	1	57.4 Å²	57.4	1%	0.005	28%	0.281	C	S	.	.	H	α-helix	trans	-57.7	-49.2	175.5	179.6	56	0	0	0	111.8	L253 N288 A291 F295 V347 Y350 M351 C390 R394 R395 V396	L253-L392 HydrophobicContact CD2-CD2 3.85Å; N288-L392 WeakPolarHBondContact OD1-CB 3.46Å; N288-L392 PolarHBondContact OD1-N 2.94Å; N288-L392 VanDerWaalsContact OD1-N 3.16Å; A291-L392 HydrophobicContact CB-CD1 3.81Å; F295-L392 HydrophobicContact CE2-CD1 3.66Å; F295-L392 HydrophobicContact CZ-CD1 4.46Å; V347-L392 HydrophobicContact CG1-CD1 4.22Å; V347-L392 HydrophobicContact CG1-CD2 4.02Å; V347-L392 HydrophobicContact CG1-CG 3.82Å; V347-L392 HydrophobicContact CG2-CD1 3.81Å; V347-L392 HydrophobicContact CG2-CG 4.32Å; Y350-L392 HydrophobicContact CD1-CD2 4.19Å; Y350-L392 HydrophobicContact CE1-CD2 4.2Å; M351-L392 HydrophobicContact CE-CB 4.15Å; M351-L392 HydrophobicContact CE-CD2 3.64Å; M351-L392 HydrophobicContact CE-CG 3.78Å; C390-L392 VanDerWaalsContact C-N 3.26Å; C390-L392 PolarHBondContact O-N 2.84Å; L392-R394 VanDerWaalsContact C-N 3.32Å; L392-R394 PolarHBondContact O-N 3.39Å; L392-R395 PolarHBondContact O-N 2.95Å; L392-V396 WeakPolarHBondContact O-CG2 3.5Å; L392-V396 PolarHBondContact O-N 2.81Å
393	S	94.5	Very high	94.3	Very high	18 Å²	18	53 Å²	53	13%	0.126	26%	0.26	C	S	.	.	H	α-helix	trans	-60	-40.5	175.8	-68.2	0	0	0	0	112.3	M351 L387 R388 C390 N391 V396 Q397	M351-S393 WeakPolarHBondContact CE-OG 3.23Å; L387-S393 PolarHBondContact O-OG 3.39Å; R388-S393 VanDerWaalsContact O-CB 3.22Å; R388-S393 WeakPolarHBondContact O-CB 3.46Å; C390-S393 PolarHBondContact O-N 2.7Å; C390-S393 VanDerWaalsContact O-N 3.14Å; C390-S393 PolarHBondContact SG-N 3.35Å; C390-S393 PolarHBondContact SG-OG 2.97Å; C390-S393 VanDerWaalsContact SG-OG 3.38Å; N391-S393 PolarHBondContact O-N 3.46Å; S393-V396 PolarHBondContact O-N 3.21Å; S393-Q397 WeakPolarHBondContact O-CG 3.47Å; S393-Q397 PolarHBondContact O-N 3.41Å
394	R	95.6	Very high	94.4	Very high	159 Å²	159	54.5 Å²	54.5	60%	0.6	27%	0.268	S	S	*	.	H	α-helix	trans	-63.8	-44.3	176.4	-68.4	174.8	60.5	-172	-0.2	112.6	C390 N391 L392 V396 Q397 E398	C390-R394 PolarHBondContact O-N 2.69Å; N391-R394 PolarHBondContact O-N 3.47Å; L392-R394 VanDerWaalsContact C-N 3.32Å; L392-R394 PolarHBondContact O-N 3.39Å; R394-V396 VanDerWaalsContact C-N 3.3Å; R394-V396 PolarHBondContact O-N 2.93Å; R394-Q397 PolarHBondContact O-N 3.03Å; R394-E398 PolarHBondContact O-N 2.82Å
395	R	95	Very high	94.5	Very high	71 Å²	71	56.3 Å²	56.3	27%	0.268	28%	0.278	S	S	.	.	H	α-helix	trans	-62.6	-39.3	177.3	-67.5	-52.9	-166.2	123.6	13.6	111.7	F295 D296 N391 L392 E398 L399	F295-R395 HydrophobicContact CD2-CB 4.03Å; F295-R395 HydrophobicContact CD2-CG 4.48Å; F295-R395 HydrophobicContact CE2-CB 4.33Å; F295-R395 HydrophobicContact CG-CB 4.18Å; D296-R395 IonicContact OD1-CZ 2.65Å; D296-R395 VanDerWaalsContact OD1-CZ 3.26Å; D296-R395 IonicContact OD1-NH1 2.67Å; D296-R395 PolarHBondContact OD1-NH1 2.95Å; D296-R395 IonicContact OD1-NH2 3.35Å; D296-R395 PolarHBondContact OD1-NH2 2.88Å; D296-R395 IonicContact OD2-CZ 3.92Å; D296-R395 IonicContact OD2-NH2 3.36Å; D296-R395 PolarHBondContact OD2-NH2 3.13Å; N391-R395 WeakPolarHBondContact O-CG 3.29Å; N391-R395 PolarHBondContact O-N 3.21Å; L392-R395 PolarHBondContact O-N 2.95Å; R395-E398 PolarHBondContact O-N 3.29Å; R395-L399 WeakPolarHBondContact O-CB 3.39Å; R395-L399 PolarHBondContact O-N 3.39Å
396	V	95	Very high	94.5	Very high	13 Å²	13	52.1 Å²	52.1	8%	0.079	26%	0.256	C	S	.	.	H	α-helix	trans	-62.7	-44.9	174.6	165.6	0	0	0	0	111.3	F295 Q344 V347 L392 S393 R394 L399 L400	F295-V396 HydrophobicContact CZ-CG2 3.98Å; Q344-V396 PolarHBondContact NE2-O 2.99Å; V347-V396 HydrophobicContact CB-CG2 3.71Å; V347-V396 HydrophobicContact CG1-CG2 3.71Å; V347-V396 HydrophobicContact CG2-CG2 3.58Å; L392-V396 WeakPolarHBondContact O-CG2 3.5Å; L392-V396 PolarHBondContact O-N 2.81Å; S393-V396 PolarHBondContact O-N 3.21Å; R394-V396 VanDerWaalsContact C-N 3.3Å; R394-V396 PolarHBondContact O-N 2.93Å; V396-L399 PolarHBondContact O-N 3.23Å; V396-L400 WeakPolarHBondContact O-CB 3.49Å; V396-L400 PolarHBondContact O-N 3.48Å
397	Q	93.3	Very high	94.7	Very high	124 Å²	124	49.4 Å²	49.4	58%	0.579	24%	0.244	S	C	*	.	H	α-helix	trans	-65.2	-39.8	176.5	-67.7	-61.9	-35.7	0	0	112.8	S393 R394 L400 G401	S393-Q397 WeakPolarHBondContact O-CG 3.47Å; S393-Q397 PolarHBondContact O-N 3.41Å; R394-Q397 PolarHBondContact O-N 3.03Å; Q397-L400 PolarHBondContact O-N 2.77Å; Q397-G401 PolarHBondContact O-N 3.07Å
398	E	93.9	Very high	94.7	Very high	80 Å²	80	52.5 Å²	52.5	37%	0.374	26%	0.258	S	S	.	.	H	α-helix	trans	-60.1	-48.1	173.1	-176.4	-175.6	174.5	0	0	111	K305 R394 R395 L400 G401 L402	K305-E398 VanDerWaalsContact CE-OE1 3.32Å; K305-E398 WeakPolarHBondContact CE-OE1 3.43Å; K305-E398 IonicContact NZ-OE1 2.71Å; K305-E398 PolarHBondContact NZ-OE1 3.02Å; R394-E398 PolarHBondContact O-N 2.82Å; R395-E398 PolarHBondContact O-N 3.29Å; E398-L400 VanDerWaalsContact C-N 3.28Å; E398-L400 PolarHBondContact O-N 3.08Å; E398-G401 PolarHBondContact O-N 3.3Å; E398-L402 WeakPolarHBondContact O-CG 3.48Å; E398-L402 PolarHBondContact O-N 3.3Å; E398-L402 VanDerWaalsContact O-N 3.16Å
399	L	95	Very high	94.9	Very high	3 Å²	3	43.1 Å²	43.1	2%	0.016	22%	0.222	C	C	.	.	H	α-helix	trans	-62.7	-36.6	178.1	-179.6	67.2	0	0	0	111.8	F295 F298 M299 M340 L343 R395 V396 L402 Y403	F295-L399 HydrophobicContact CD1-CD2 4.37Å; F295-L399 HydrophobicContact CE1-CD2 3.74Å; F298-L399 HydrophobicContact CE1-CD1 3.82Å; M299-L399 HydrophobicContact SD-CD1 4.1Å; M340-L399 HydrophobicContact CE-CD1 3.39Å; M340-L399 HydrophobicContact CE-CG 4.18Å; M340-L399 HydrophobicContact CG-CD1 4.09Å; L343-L399 HydrophobicContact CB-CD2 4Å; L343-L399 HydrophobicContact CD1-CD2 3.98Å; R395-L399 WeakPolarHBondContact O-CB 3.39Å; R395-L399 PolarHBondContact O-N 3.39Å; V396-L399 PolarHBondContact O-N 3.23Å; L399-L402 PolarHBondContact O-N 3.4Å; L399-Y403 WeakPolarHBondContact O-CB 3.4Å; L399-Y403 PolarHBondContact O-N 3.3Å
400	L	94.7	Very high	95	Very high	9 Å²	9	39.7 Å²	39.7	5%	0.047	20%	0.2	C	C	.	.	H	α-helix	trans	-65.3	-42.9	178.1	-173	63.9	0	0	0	111.7	V396 Q397 E398 L402 Y403 I404 C456	V396-L400 WeakPolarHBondContact O-CB 3.49Å; V396-L400 PolarHBondContact O-N 3.48Å; Q397-L400 PolarHBondContact O-N 2.77Å; E398-L400 VanDerWaalsContact C-N 3.28Å; E398-L400 PolarHBondContact O-N 3.08Å; L400-L402 VanDerWaalsContact C-N 3.34Å; L400-L402 PolarHBondContact O-N 3.38Å; L400-Y403 HydrophobicContact CD1-CD1 4.35Å; L400-Y403 WeakPolarHBondContact O-CB 3.44Å; L400-Y403 PolarHBondContact O-N 3.01Å; L400-I404 HydrophobicContact CG-CD1 4.3Å; L400-I404 WeakPolarHBondContact O-CG1 3.44Å; L400-I404 PolarHBondContact O-N 3.48Å; L400-C456 HydrophobicContact CD1-CB 3.83Å
401	G	94	Very high	95.1	Very high	37 Å²	37	39 Å²	39	38%	0.381	20%	0.195	S	C	.	.	H	α-helix	trans	-59.4	-45.1	174.7	0	0	0	0	0	112.2	Q397 E398 I404 S405	Q397-G401 PolarHBondContact O-N 3.07Å; E398-G401 PolarHBondContact O-N 3.3Å; G401-I404 PolarHBondContact O-N 2.89Å; G401-S405 PolarHBondContact O-N 3.11Å; G401-S405 PolarHBondContact O-OG 2.81Å
402	L	94.8	Very high	95.1	Very high	30 Å²	30	38.2 Å²	38.2	16%	0.157	19%	0.186	C	C	.	.	H	α-helix	trans	-66	-38.6	176.4	-65	174.5	0	0	0	112.5	M299 V304 K305 C308 M340 E398 L399 L400 S405 L406	M299-L402 HydrophobicContact CE-CD1 3.32Å; M299-L402 HydrophobicContact SD-CD1 4.47Å; V304-L402 HydrophobicContact CG1-CB 4.41Å; V304-L402 HydrophobicContact CG1-CD1 4.21Å; K305-L402 HydrophobicContact CG-CD1 4.39Å; C308-L402 HydrophobicContact CB-CD2 4.25Å; M340-L402 HydrophobicContact CE-CB 4.19Å; E398-L402 WeakPolarHBondContact O-CG 3.48Å; E398-L402 PolarHBondContact O-N 3.3Å; E398-L402 VanDerWaalsContact O-N 3.16Å; L399-L402 PolarHBondContact O-N 3.4Å; L400-L402 VanDerWaalsContact C-N 3.34Å; L400-L402 PolarHBondContact O-N 3.38Å; L402-S405 PolarHBondContact O-N 2.86Å; L402-L406 WeakPolarHBondContact O-CB 3.28Å; L402-L406 WeakPolarHBondContact O-CG 3.35Å; L402-L406 PolarHBondContact O-N 3.18Å
403	Y	96.1	Very high	94.9	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-58.6	-49.8	175.4	168.9	-97.8	0	0	0	110.8	L337 M340 T341 L399 L400 S405 L406 E407 A448 C456	L337-Y403 HydrophobicContact CB-CE2 4.1Å; L337-Y403 HydrophobicContact CD2-CD2 3.63Å; L337-Y403 HydrophobicContact CD2-CE2 3.72Å; M340-Y403 HydrophobicContact CB-CD2 4.03Å; M340-Y403 HydrophobicContact SD-CD2 4.31Å; T341-Y403 HydrophobicContact CG2-CD2 3.95Å; T341-Y403 HydrophobicContact CG2-CE1 4.14Å; T341-Y403 HydrophobicContact CG2-CE2 3.33Å; T341-Y403 VanDerWaalsContact CG2-CZ 3.44Å; L399-Y403 WeakPolarHBondContact O-CB 3.4Å; L399-Y403 PolarHBondContact O-N 3.3Å; L400-Y403 HydrophobicContact CD1-CD1 4.35Å; L400-Y403 WeakPolarHBondContact O-CB 3.44Å; L400-Y403 PolarHBondContact O-N 3.01Å; Y403-S405 VanDerWaalsContact C-N 3.31Å; Y403-S405 PolarHBondContact O-N 3.34Å; Y403-L406 PolarHBondContact O-N 3.32Å; Y403-E407 HydrophobicContact CE1-CB 4.27Å; Y403-E407 HydrophobicContact CE1-CG 4.34Å; Y403-E407 HydrophobicContact CE2-CB 4.24Å; Y403-E407 HydrophobicContact CE2-CG 4.37Å; Y403-E407 WeakPolarHBondContact CE2-OE2 3.46Å; Y403-E407 VanDerWaalsContact O-CB 3.22Å; Y403-E407 WeakPolarHBondContact O-CB 3.21Å; Y403-E407 PolarHBondContact O-N 3.2Å; Y403-E407 VanDerWaalsContact OH-CD 3.31Å; Y403-E407 PolarHBondContact OH-OE2 3.5Å; Y403-A448 HydrophobicContact CE1-CB 4.32Å; Y403-A448 WeakPolarHBondContact OH-CA 3.36Å; Y403-A448 PolarHBondContact OH-N 2.97Å; Y403-C456 VanDerWaalsContact CD1-SG 3.56Å; Y403-C456 WeakPolarHBondContact CE1-SG 3.3Å
404	I	96.4	Very high	94.9	Very high	36 Å²	36	38.9 Å²	38.9	19%	0.185	19%	0.189	C	C	.	.	H	α-helix	trans	-57.2	-46.6	-179	-70.9	167.9	0	0	0	110.7	L400 G401 E407 E408 A459 M460	L400-I404 HydrophobicContact CG-CD1 4.3Å; L400-I404 WeakPolarHBondContact O-CG1 3.44Å; L400-I404 PolarHBondContact O-N 3.48Å; G401-I404 PolarHBondContact O-N 2.89Å; I404-E407 PolarHBondContact O-N 2.97Å; I404-E408 WeakPolarHBondContact O-CB 3.2Å; I404-E408 PolarHBondContact O-N 2.87Å; I404-A459 HydrophobicContact CD1-CB 4.26Å; I404-A459 HydrophobicContact CG2-CB 4.17Å; I404-M460 HydrophobicContact CB-CE 3.99Å; I404-M460 HydrophobicContact CG1-CE 4.05Å; I404-M460 HydrophobicContact CG2-CE 3.69Å
405	S	94.3	Very high	94.9	Very high	58 Å²	58	31.3 Å²	31.3	41%	0.406	16%	0.16	S	C	.	.	H	α-helix	trans	-64.4	-41	178.7	-57.8	0	0	0	0	113.3	G401 L402 Y403 Y409	G401-S405 PolarHBondContact O-N 3.11Å; G401-S405 PolarHBondContact O-OG 2.81Å; L402-S405 PolarHBondContact O-N 2.86Å; Y403-S405 VanDerWaalsContact C-N 3.31Å; Y403-S405 PolarHBondContact O-N 3.34Å; S405-Y409 PolarHBondContact O-N 3.43Å
406	L	94.7	Very high	94.8	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-72.2	-37.5	179	-75.5	174.1	0	0	0	112.5	V304 K307 C308 L333 L337 M340 L402 Y403 Y409 Y410	V304-L406 HydrophobicContact CG1-CD1 4Å; K307-L406 HydrophobicContact CB-CD2 4.3Å; C308-L406 HydrophobicContact CB-CD2 4.17Å; C308-L406 HydrophobicContact CB-CG 4.29Å; L333-L406 HydrophobicContact CD1-CD2 4.39Å; L333-L406 HydrophobicContact CD2-CD2 4.21Å; L337-L406 HydrophobicContact CD2-CB 3.76Å; M340-L406 HydrophobicContact CE-CD1 4.26Å; M340-L406 HydrophobicContact SD-CD1 4.2Å; L402-L406 WeakPolarHBondContact O-CB 3.28Å; L402-L406 WeakPolarHBondContact O-CG 3.35Å; L402-L406 PolarHBondContact O-N 3.18Å; Y403-L406 PolarHBondContact O-N 3.32Å; L406-Y409 PolarHBondContact O-N 3.32Å; L406-Y410 WeakPolarHBondContact O-CB 3.49Å; L406-Y410 PolarHBondContact O-N 3.48Å
407	E	96.3	Very high	94.7	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-68.3	-40.7	178.3	-170	71.8	-122.1	0	0	110.9	L337 Y403 I404 Y410 M411 C444 R447 M460	L337-E407 HydrophobicContact CD2-CB 4.09Å; Y403-E407 HydrophobicContact CE1-CB 4.27Å; Y403-E407 HydrophobicContact CE1-CG 4.34Å; Y403-E407 HydrophobicContact CE2-CB 4.24Å; Y403-E407 HydrophobicContact CE2-CG 4.37Å; Y403-E407 WeakPolarHBondContact CE2-OE2 3.46Å; Y403-E407 VanDerWaalsContact O-CB 3.22Å; Y403-E407 WeakPolarHBondContact O-CB 3.21Å; Y403-E407 PolarHBondContact O-N 3.2Å; Y403-E407 VanDerWaalsContact OH-CD 3.31Å; Y403-E407 PolarHBondContact OH-OE2 3.5Å; I404-E407 PolarHBondContact O-N 2.97Å; E407-Y410 PolarHBondContact O-N 3.23Å; E407-M411 WeakPolarHBondContact O-CB 3.43Å; E407-M411 PolarHBondContact O-N 3.47Å; E407-C444 HydrophobicContact CG-CB 4.47Å; E407-C444 WeakPolarHBondContact OE1-CB 3.28Å; E407-C444 PolarHBondContact OE1-SG 3.18Å; E407-C444 VanDerWaalsContact OE1-SG 3.35Å; E407-R447 IonicContact OE1-CZ 2.68Å; E407-R447 IonicContact OE1-NE 2.7Å; E407-R447 PolarHBondContact OE1-NE 3.44Å; E407-R447 IonicContact OE1-NH2 3.94Å; E407-R447 PolarHBondContact OE1-NH2 2.93Å; E407-R447 IonicContact OE2-CZ 3.55Å; E407-R447 IonicContact OE2-NE 3.92Å; E407-R447 PolarHBondContact OE2-NE 2.91Å; E407-R447 IonicContact OE2-NH2 3.4Å; E407-R447 PolarHBondContact OE2-NH2 2.97Å; E407-M460 HydrophobicContact CB-CE 4.1Å; E407-M460 HydrophobicContact CB-SD 3.75Å; E407-M460 HydrophobicContact CG-CE 4.27Å; E407-M460 HydrophobicContact CG-CG 4.24Å; E407-M460 HydrophobicContact CG-SD 3.3Å; E407-M460 WeakPolarHBondContact CG-SD 3.42Å
408	E	95.4	Very high	94.7	Very high	72 Å²	72	29.7 Å²	29.7	34%	0.336	16%	0.155	S	C	.	.	H	α-helix	trans	-58.9	-47.9	171.5	-179.7	-172.6	179.8	0	0	111.3	I404 M411 R412 H463	I404-E408 WeakPolarHBondContact O-CB 3.2Å; I404-E408 PolarHBondContact O-N 2.87Å; E408-M411 PolarHBondContact O-N 3.46Å; E408-R412 WeakPolarHBondContact O-CB 3.49Å; E408-R412 PolarHBondContact O-N 3.26Å; E408-H463 VanDerWaalsContact CD-ND1 3.28Å; E408-H463 HydrophobicContact CG-CB 4.41Å; E408-H463 IonicContact OE1-CE1 2.65Å; E408-H463 IonicContact OE1-ND1 3.99Å; E408-H463 PolarHBondContact OE1-ND1 3.32Å; E408-H463 IonicContact OE2-CE1 3.47Å; E408-H463 PolarHBondContact OE2-CE1 3.25Å; E408-H463 IonicContact OE2-ND1 3.58Å; E408-H463 IonicContact OE2-NE2 2.74Å
409	Y	94.3	Very high	94.6	Very high	9 Å²	9	26.9 Å²	26.9	4%	0.035	14%	0.143	C	C	.	.	H	α-helix	trans	-59.8	-47.8	177	172.8	-91.8	0	0	0	111.6	S311 K327 V328 L333 S405 L406 M411 R412 E413	S311-Y409 VanDerWaalsContact CB-CD2 3.47Å; S311-Y409 VanDerWaalsContact CB-CG 3.43Å; S311-Y409 WeakPolarHBondContact O-CD2 3.37Å; S311-Y409 WeakPolarHBondContact OG-CD1 3.44Å; S311-Y409 WeakPolarHBondContact OG-CE1 3.26Å; K327-Y409 VanDerWaalsContact CE-OH 3.3Å; K327-Y409 WeakPolarHBondContact CE-OH 3.39Å; K327-Y409 WeakPolarHBondContact CG-OH 3.5Å; V328-Y409 HydrophobicContact CB-CE1 4.5Å; V328-Y409 PolarHBondContact O-OH 3.36Å; L333-Y409 HydrophobicContact CD1-CD1 3.55Å; L333-Y409 HydrophobicContact CD1-CE1 3.84Å; S405-Y409 PolarHBondContact O-N 3.43Å; L406-Y409 PolarHBondContact O-N 3.32Å; Y409-M411 VanDerWaalsContact C-N 3.34Å; Y409-M411 PolarHBondContact O-N 2.65Å; Y409-R412 VanDerWaalsContact CD2-NH2 3.25Å; Y409-R412 PolarHBondContact O-N 2.95Å; Y409-E413 HydrophobicContact CD1-CG 4.43Å; Y409-E413 HydrophobicContact CD2-CG 4.13Å; Y409-E413 HydrophobicContact CE1-CG 4.06Å; Y409-E413 HydrophobicContact CE2-CG 3.71Å; Y409-E413 HydrophobicContact CG-CG 4.45Å; Y409-E413 WeakPolarHBondContact O-CB 3.21Å; Y409-E413 WeakPolarHBondContact O-CG 3.22Å; Y409-E413 PolarHBondContact O-N 3.05Å
410	Y	95.8	Very high	94.4	Very high	15 Å²	15	34.6 Å²	34.6	6%	0.059	18%	0.176	C	C	.	.	H	α-helix	trans	-55.8	-49	176.8	172.5	-92.9	0	0	0	111.3	P330 L333 D334 L337 L406 E407 S414 K443 R447	P330-Y410 HydrophobicContact CB-CD2 3.82Å; P330-Y410 HydrophobicContact CB-CE2 4.15Å; P330-Y410 WeakPolarHBondContact O-CD2 3.35Å; P330-Y410 WeakPolarHBondContact O-CE2 3.47Å; L333-Y410 HydrophobicContact CB-CD2 4.21Å; D334-Y410 HydrophobicContact CB-CE2 4.16Å; D334-Y410 PolarHBondContact OD1-OH 2.93Å; L337-Y410 HydrophobicContact CD1-CD1 4.36Å; L337-Y410 HydrophobicContact CD1-CD2 4.23Å; L337-Y410 HydrophobicContact CD1-CG 3.85Å; L406-Y410 WeakPolarHBondContact O-CB 3.49Å; L406-Y410 PolarHBondContact O-N 3.48Å; E407-Y410 PolarHBondContact O-N 3.23Å; Y410-S414 WeakPolarHBondContact O-CB 3.3Å; Y410-S414 PolarHBondContact O-N 3.48Å; Y410-S414 PolarHBondContact O-OG 3.28Å; Y410-K443 PolarHBondContact OH-NZ 3.12Å; Y410-R447 VanDerWaalsContact CD1-NH2 3.34Å; Y410-R447 VanDerWaalsContact CE1-NH2 3.34Å
411	M	96.5	Very high	94.1	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-62.3	-48.3	-178.5	-167.2	-169.2	-61.5	0	0	110.9	E407 E408 Y409 S414 I415 I440 I441 C444 M460 A464 L467	E407-M411 WeakPolarHBondContact O-CB 3.43Å; E407-M411 PolarHBondContact O-N 3.47Å; E408-M411 PolarHBondContact O-N 3.46Å; Y409-M411 VanDerWaalsContact C-N 3.34Å; Y409-M411 PolarHBondContact O-N 2.65Å; M411-S414 PolarHBondContact O-N 3.35Å; M411-I415 HydrophobicContact CG-CD1 4.02Å; M411-I415 WeakPolarHBondContact O-CB 3.48Å; M411-I415 VanDerWaalsContact O-CG1 3.25Å; M411-I415 WeakPolarHBondContact O-CG1 3.21Å; M411-I415 PolarHBondContact O-N 3.01Å; M411-I440 HydrophobicContact CG-CG2 4.33Å; M411-I441 HydrophobicContact SD-CG1 4.36Å; M411-C444 HydrophobicContact CE-CB 3.44Å; M411-C444 VanDerWaalsContact CE-CB 3.44Å; M411-C444 HydrophobicContact CG-CB 4.47Å; M411-M460 HydrophobicContact CE-SD 4.25Å; M411-A464 HydrophobicContact CE-CB 4.28Å; M411-A464 HydrophobicContact SD-CB 3.95Å; M411-L467 HydrophobicContact CB-CD1 3.96Å; M411-L467 HydrophobicContact CG-CD1 3.78Å; M411-L467 HydrophobicContact SD-CD1 3.63Å
412	R	95	Very high	93.9	Very high	68 Å²	68	40.1 Å²	40.1	26%	0.257	20%	0.195	S	C	.	.	H	α-helix	trans	-61.1	-49.3	-179.3	-177.9	172.2	55.8	66.6	4.6	112.3	E408 Y409 I415 Q416 L467	E408-R412 WeakPolarHBondContact O-CB 3.49Å; E408-R412 PolarHBondContact O-N 3.26Å; Y409-R412 VanDerWaalsContact CD2-NH2 3.25Å; Y409-R412 PolarHBondContact O-N 2.95Å; R412-I415 PolarHBondContact O-N 3.31Å; R412-Q416 WeakPolarHBondContact O-CG 3.19Å; R412-Q416 PolarHBondContact O-N 3.35Å; R412-L467 HydrophobicContact CB-CD1 4.01Å; R412-L467 HydrophobicContact CB-CD2 3.72Å; R412-L467 HydrophobicContact CG-CD2 3.65Å
413	E	93.1	Very high	93.4	Very high	18 Å²	18	46.3 Å²	46.3	8%	0.084	22%	0.217	C	C	.	.	H	α-helix	trans	-69.9	-37	-178.4	-69.6	-64	155.7	0	0	112.3	K327 P330 Y409 Q416 K417	K327-E413 WeakPolarHBondContact CE-OE1 3.1Å; K327-E413 WeakPolarHBondContact CE-OE2 3.43Å; K327-E413 IonicContact NZ-OE1 3.2Å; K327-E413 PolarHBondContact NZ-OE1 2.94Å; K327-E413 IonicContact NZ-OE2 3Å; K327-E413 PolarHBondContact NZ-OE2 2.61Å; P330-E413 HydrophobicContact CB-CB 4.38Å; P330-E413 HydrophobicContact CG-CB 3.36Å; P330-E413 HydrophobicContact CG-CG 4.28Å; Y409-E413 HydrophobicContact CD1-CG 4.43Å; Y409-E413 HydrophobicContact CD2-CG 4.13Å; Y409-E413 HydrophobicContact CE1-CG 4.06Å; Y409-E413 HydrophobicContact CE2-CG 3.71Å; Y409-E413 HydrophobicContact CG-CG 4.45Å; Y409-E413 WeakPolarHBondContact O-CB 3.21Å; Y409-E413 WeakPolarHBondContact O-CG 3.22Å; Y409-E413 PolarHBondContact O-N 3.05Å; E413-Q416 PolarHBondContact O-N 2.99Å; E413-K417 VanDerWaalsContact O-CB 3.31Å; E413-K417 WeakPolarHBondContact O-CB 3.45Å; E413-K417 PolarHBondContact O-N 3.24Å
414	S	94.7	Very high	92.7	Very high	15 Å²	15	49.9 Å²	49.9	11%	0.105	23%	0.231	C	C	.	.	H	α-helix	trans	-62.6	-43.9	174.2	-61.2	0	0	0	0	111.2	Y410 M411 K417 A418	Y410-S414 WeakPolarHBondContact O-CB 3.3Å; Y410-S414 PolarHBondContact O-N 3.48Å; Y410-S414 PolarHBondContact O-OG 3.28Å; M411-S414 PolarHBondContact O-N 3.35Å; S414-K417 PolarHBondContact O-N 3.48Å; S414-A418 WeakPolarHBondContact O-CB 3.36Å; S414-A418 PolarHBondContact O-N 3.32Å
415	I	95.4	Very high	91.8	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-62.8	-45.6	175.3	-70.9	169.5	0	0	0	110.7	M411 R412 K417 A418 L419 V437 I440 I441 L467 C471	M411-I415 HydrophobicContact CG-CD1 4.02Å; M411-I415 WeakPolarHBondContact O-CB 3.48Å; M411-I415 VanDerWaalsContact O-CG1 3.25Å; M411-I415 WeakPolarHBondContact O-CG1 3.21Å; M411-I415 PolarHBondContact O-N 3.01Å; R412-I415 PolarHBondContact O-N 3.31Å; I415-K417 VanDerWaalsContact C-N 3.28Å; I415-K417 PolarHBondContact O-N 2.81Å; I415-A418 PolarHBondContact O-N 3.19Å; I415-L419 HydrophobicContact CG2-CD1 4.22Å; I415-L419 WeakPolarHBondContact O-CG 3.21Å; I415-L419 PolarHBondContact O-N 3.46Å; I415-V437 HydrophobicContact CD1-CG1 4.46Å; I415-V437 HydrophobicContact CG1-CG1 4.31Å; I415-V437 HydrophobicContact CG2-CG2 4.19Å; I415-I440 HydrophobicContact CG1-CG2 4.17Å; I415-I441 HydrophobicContact CD1-CD1 4.24Å; I415-I441 HydrophobicContact CD1-CG1 4.04Å; I415-L467 HydrophobicContact CD1-CB 4.01Å; I415-L467 HydrophobicContact CD1-CD1 4.3Å; I415-C471 HydrophobicContact CG2-CB 4.45Å
416	Q	93.2	Very high	90.7	Very high	59 Å²	59	57.4 Å²	57.4	28%	0.276	26%	0.261	S	S	.	.	H	α-helix	trans	-62.7	-35.1	177.2	-73.5	-179.4	3.7	0	0	112.7	R412 E413 K420	R412-Q416 WeakPolarHBondContact O-CG 3.19Å; R412-Q416 PolarHBondContact O-N 3.35Å; E413-Q416 PolarHBondContact O-N 2.99Å; Q416-K420 WeakPolarHBondContact O-CG 3.41Å; Q416-K420 PolarHBondContact O-N 3Å
417	K	91.9	Very high	89.7	Confident	103 Å²	103	64.5 Å²	64.5	45%	0.448	30%	0.299	S	S	.	.	H	α-helix	trans	-70.5	-42.6	175.6	-170.5	173.8	-177.7	176.5	0	111.2	E413 S414 I415 L419 K420 L421	E413-K417 VanDerWaalsContact O-CB 3.31Å; E413-K417 WeakPolarHBondContact O-CB 3.45Å; E413-K417 PolarHBondContact O-N 3.24Å; S414-K417 PolarHBondContact O-N 3.48Å; I415-K417 VanDerWaalsContact C-N 3.28Å; I415-K417 PolarHBondContact O-N 2.81Å; K417-L419 VanDerWaalsContact C-N 3.32Å; K417-L419 PolarHBondContact O-N 3.09Å; K417-K420 PolarHBondContact O-N 3.31Å; K417-K420 VanDerWaalsContact O-N 3.09Å; K417-L421 HydrophobicContact CG-CD1 3.88Å; K417-L421 HydrophobicContact CG-CG 4.39Å; K417-L421 WeakPolarHBondContact O-CG 3.36Å; K417-L421 PolarHBondContact O-N 3.2Å
418	A	92.4	Very high	89	Confident	11 Å²	11	66.4 Å²	66.4	9%	0.091	32%	0.316	C	S	.	.	H	α-helix	trans	-58.5	-43.6	174.1	0	0	0	0	0	111.7	S414 I415 K420 L421 E422 D436 V437 I440	S414-A418 WeakPolarHBondContact O-CB 3.36Å; S414-A418 PolarHBondContact O-N 3.32Å; I415-A418 PolarHBondContact O-N 3.19Å; A418-K420 PolarHBondContact O-N 3.03Å; A418-L421 PolarHBondContact O-N 2.75Å; A418-E422 PolarHBondContact O-N 3.09Å; A418-D436 HydrophobicContact CB-CB 3.88Å; A418-V437 HydrophobicContact CB-CG2 4.44Å; A418-I440 HydrophobicContact CB-CD1 4.01Å
419	L	92.3	Very high	88.5	Confident	22 Å²	22	66.3 Å²	66.3	12%	0.115	32%	0.317	C	S	.	.	H	α-helix	trans	-62.5	-28.4	175.5	-72.4	174	0	0	0	113.8	I415 K417 I433 Y472 E475	I415-L419 HydrophobicContact CG2-CD1 4.22Å; I415-L419 WeakPolarHBondContact O-CG 3.21Å; I415-L419 PolarHBondContact O-N 3.46Å; K417-L419 VanDerWaalsContact C-N 3.32Å; K417-L419 PolarHBondContact O-N 3.09Å; L419-I433 HydrophobicContact CD2-CB 4.39Å; L419-I433 HydrophobicContact CD2-CD1 4.47Å; L419-I433 HydrophobicContact CD2-CG2 4.39Å; L419-Y472 HydrophobicContact CD2-CD2 4.01Å; L419-Y472 HydrophobicContact CD2-CE2 4.33Å; L419-E475 HydrophobicContact CD1-CB 4.38Å; L419-E475 HydrophobicContact CD1-CG 4.41Å; L419-E475 HydrophobicContact CD2-CG 4.22Å
420	K	91	Very high	88.2	Confident	165 Å²	165	68 Å²	68	72%	0.717	33%	0.329	S	S	*	.	H	α-helix	trans	-85.4	-31.9	177.8	-71.7	171.3	-176.3	176.2	0	113.2	Q416 K417 A418 E422	Q416-K420 WeakPolarHBondContact O-CG 3.41Å; Q416-K420 PolarHBondContact O-N 3Å; K417-K420 PolarHBondContact O-N 3.31Å; K417-K420 VanDerWaalsContact O-N 3.09Å; A418-K420 PolarHBondContact O-N 3.03Å; K420-E422 PolarHBondContact O-N 2.86Å
421	L	89.6	Confident	88	Confident	119 Å²	119	67.5 Å²	67.5	62%	0.623	33%	0.328	S	S	*	.	S	Bend	trans	-93.6	24	-179.8	-63.6	179.6	0	0	0	112	K417 A418 Y423	K417-L421 HydrophobicContact CG-CD1 3.88Å; K417-L421 HydrophobicContact CG-CG 4.39Å; K417-L421 WeakPolarHBondContact O-CG 3.36Å; K417-L421 PolarHBondContact O-N 3.2Å; A418-L421 PolarHBondContact O-N 2.75Å; L421-Y423 PolarHBondContact O-N 2.99Å
422	E	87.9	Confident	87.8	Confident	43 Å²	43	68.9 Å²	68.9	20%	0.201	34%	0.338	C	S	.	.			trans	-50.4	125.4	176.8	171.4	167.3	-174.6	0	0	111.2	A418 K420 R424 S431 I433 R479	A418-E422 PolarHBondContact O-N 3.09Å; K420-E422 PolarHBondContact O-N 2.86Å; E422-R424 HydrophobicContact CG-CG 4.43Å; E422-R424 IonicContact OE1-CZ 3.25Å; E422-R424 VanDerWaalsContact OE1-CZ 3.31Å; E422-R424 IonicContact OE1-NE 2.79Å; E422-R424 PolarHBondContact OE1-NE 2.82Å; E422-R424 IonicContact OE1-NH2 2.8Å; E422-R424 PolarHBondContact OE1-NH2 3.16Å; E422-R424 IonicContact OE2-NH2 3.04Å; E422-S431 WeakPolarHBondContact CG-OG 3.32Å; E422-S431 WeakPolarHBondContact OE1-CB 3.49Å; E422-S431 PolarHBondContact OE1-OG 3.35Å; E422-I433 HydrophobicContact CB-CG2 3.69Å; E422-I433 HydrophobicContact CG-CG2 3.8Å; E422-R479 IonicContact OE1-NH1 2.84Å; E422-R479 PolarHBondContact OE1-NH1 2.98Å; E422-R479 IonicContact OE2-CZ 3.07Å; E422-R479 IonicContact OE2-NH1 3.45Å; E422-R479 PolarHBondContact OE2-NH1 3.44Å; E422-R479 IonicContact OE2-NH2 2.68Å; E422-R479 PolarHBondContact OE2-NH2 2.85Å
423	Y	85.5	Confident	87.8	Confident	160 Å²	160	65.6 Å²	65.6	63%	0.627	33%	0.325	S	S	*	.			trans	-121.5	144.2	173.7	178.3	-101	0	0	0	110.4	L421 S432	L421-Y423 PolarHBondContact O-N 2.99Å; Y423-S432 PolarHBondContact N-OG 3.2Å; Y423-S432 WeakPolarHBondContact O-CB 3.36Å; Y423-S432 PolarHBondContact O-N 3.26Å; Y423-S432 VanDerWaalsContact O-N 3.07Å; Y423-S432 PolarHBondContact O-OG 3.27Å
424	R	81.1	Confident	87.8	Confident	74 Å²	74	65 Å²	65	28%	0.279	32%	0.323	S	S	.	.			trans	-130.9	126.2	-178.5	-59.3	-178.7	-169.8	155.3	-3.8	109.5	E422 D523	E422-R424 HydrophobicContact CG-CG 4.43Å; E422-R424 IonicContact OE1-CZ 3.25Å; E422-R424 VanDerWaalsContact OE1-CZ 3.31Å; E422-R424 IonicContact OE1-NE 2.79Å; E422-R424 PolarHBondContact OE1-NE 2.82Å; E422-R424 IonicContact OE1-NH2 2.8Å; E422-R424 PolarHBondContact OE1-NH2 3.16Å; E422-R424 IonicContact OE2-NH2 3.04Å; R424-D523 IonicContact CZ-OD1 3.31Å; R424-D523 IonicContact NH1-OD1 3.18Å; R424-D523 PolarHBondContact NH1-OD1 2.95Å; R424-D523 IonicContact NH2-OD1 2.74Å; R424-D523 PolarHBondContact NH2-OD1 3.02Å
425	D	77.2	Confident	87.7	Confident	87 Å²	87	69.7 Å²	69.7	47%	0.465	35%	0.347	S	S	.	.			trans	-76.8	149	168	-167	2	0	0	0	109.6	N427 A428	D425-N427 PolarHBondContact O-N 2.81Å; D425-A428 HydrophobicContact CB-CB 3.86Å; D425-A428 PolarHBondContact O-N 3.25Å
426	E	71.5	Confident	87.7	Confident	165 Å²	165	72.6 Å²	72.6	77%	0.771	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-33.5	-176.4	-69.8	-169.5	161.2	0	0	112.1	R522	E426-R522 PolarHBondContact O-NH2 3.39Å
427	N	74.2	Confident	87.9	Confident	149 Å²	149	69.8 Å²	69.8	80%	0.797	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.1	-5.6	-177.1	-63.3	-38	0	0	0	114	D425	D425-N427 PolarHBondContact O-N 2.81Å
428	A	80.8	Confident	88.1	Confident	41 Å²	41	65.7 Å²	65.7	34%	0.339	33%	0.331	S	S	.	.			trans	-81.7	135.2	-177.8	0	0	0	0	0	111.4	D425 C430	D425-A428 HydrophobicContact CB-CB 3.86Å; D425-A428 PolarHBondContact O-N 3.25Å; A428-C430 VanDerWaalsContact C-N 3.29Å; A428-C430 WeakPolarHBondContact CB-O 3.39Å
429	L	85.2	Confident	88.3	Confident	69 Å²	69	71.8 Å²	71.8	36%	0.361	36%	0.356	S	S	.	.	S	Bend	trans	-75.1	-22.8	173	-70	178.8	0	0	0	112.6	N529	L429-N529 HydrophobicContact CB-CB 4.47Å; L429-N529 WeakPolarHBondContact O-CB 2.92Å; L429-N529 PolarHBondContact O-ND2 3.16Å
430	C	88.8	Confident	88.5	Confident	45 Å²	45	71.7 Å²	71.7	30%	0.304	36%	0.355	S	S	.	.	S	Bend	trans	-117.9	161.1	-177	-57.7	0	0	0	0	110.9	A428 D530	A428-C430 VanDerWaalsContact C-N 3.29Å; A428-C430 WeakPolarHBondContact CB-O 3.39Å; C430-D530 WeakPolarHBondContact CA-OD1 3.45Å; C430-D530 VanDerWaalsContact CB-OD1 3.29Å; C430-D530 WeakPolarHBondContact CB-OD1 3.5Å
431	S	90.9	Very high	88.8	Confident	4 Å²	4	63.8 Å²	63.8	3%	0.028	32%	0.321	C	S	.	.			trans	-94.2	154.7	176.7	179	0	0	0	0	111.7	E422 I433 V434 D530	E422-S431 WeakPolarHBondContact CG-OG 3.32Å; E422-S431 WeakPolarHBondContact OE1-CB 3.49Å; E422-S431 PolarHBondContact OE1-OG 3.35Å; S431-I433 PolarHBondContact O-N 3.06Å; S431-I433 VanDerWaalsContact O-N 3.09Å; S431-V434 PolarHBondContact O-N 3.25Å; S431-D530 VanDerWaalsContact CB-OD2 3.23Å; S431-D530 WeakPolarHBondContact CB-OD2 3.42Å; S431-D530 PolarHBondContact N-OD1 3.11Å
432	S	92.7	Very high	89.2	Confident	29 Å²	29	62 Å²	62	20%	0.203	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-22.8	177.9	75.4	0	0	0	0	113.2	Y423 V434 D435 D436	Y423-S432 PolarHBondContact N-OG 3.2Å; Y423-S432 WeakPolarHBondContact O-CB 3.36Å; Y423-S432 PolarHBondContact O-N 3.26Å; Y423-S432 VanDerWaalsContact O-N 3.07Å; Y423-S432 PolarHBondContact O-OG 3.27Å; S432-V434 PolarHBondContact O-N 3.13Å; S432-V434 VanDerWaalsContact O-N 3.09Å; S432-D435 PolarHBondContact O-N 2.7Å; S432-D435 VanDerWaalsContact O-N 3.16Å; S432-D436 VanDerWaalsContact O-CG 3.3Å; S432-D436 PolarHBondContact O-N 2.95Å; S432-D436 PolarHBondContact OG-OD2 3.25Å
433	I	94	Very high	89.5	Confident	0 Å²	0	63 Å²	63	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-56.8	-30.1	-176.7	67.3	-178.2	0	0	0	112.9	L419 E422 S431 V437 Y472 L476	L419-I433 HydrophobicContact CD2-CB 4.39Å; L419-I433 HydrophobicContact CD2-CD1 4.47Å; L419-I433 HydrophobicContact CD2-CG2 4.39Å; E422-I433 HydrophobicContact CB-CG2 3.69Å; E422-I433 HydrophobicContact CG-CG2 3.8Å; S431-I433 PolarHBondContact O-N 3.06Å; S431-I433 VanDerWaalsContact O-N 3.09Å; I433-V437 VanDerWaalsContact O-CB 3.24Å; I433-V437 WeakPolarHBondContact O-CB 3.48Å; I433-V437 WeakPolarHBondContact O-CG2 3.22Å; I433-V437 PolarHBondContact O-N 2.92Å; I433-Y472 HydrophobicContact CB-CE2 4.49Å; I433-Y472 HydrophobicContact CD1-CE2 4.22Å; I433-Y472 HydrophobicContact CG1-CE2 4.2Å; I433-L476 HydrophobicContact CD1-CD2 3.82Å
434	V	93.7	Very high	90.1	Very high	4 Å²	4	55.4 Å²	55.4	2%	0.024	28%	0.28	C	S	.	.	H	α-helix	trans	-64.2	-59.6	178.1	-178.2	0	0	0	0	108.4	S431 S432 D436 V437 F438 Y472 D530 A533	S431-V434 PolarHBondContact O-N 3.25Å; S432-V434 PolarHBondContact O-N 3.13Å; S432-V434 VanDerWaalsContact O-N 3.09Å; V434-D436 VanDerWaalsContact C-N 3.33Å; V434-D436 PolarHBondContact O-N 2.82Å; V434-V437 PolarHBondContact O-N 2.89Å; V434-F438 HydrophobicContact CG1-CD2 3.95Å; V434-F438 HydrophobicContact CG1-CE2 4.16Å; V434-F438 WeakPolarHBondContact O-CD2 3.13Å; V434-F438 PolarHBondContact O-N 3.39Å; V434-F438 VanDerWaalsContact O-N 3.13Å; V434-Y472 WeakPolarHBondContact CG2-OH 3.35Å; V434-D530 HydrophobicContact CG2-CB 3.73Å; V434-A533 HydrophobicContact CG1-CB 4.06Å; V434-A533 HydrophobicContact CG2-CB 4.36Å
435	D	93	Very high	90.8	Very high	114 Å²	114	51.9 Å²	51.9	61%	0.61	27%	0.267	S	S	*	.	H	α-helix	trans	-61.3	-42.5	-177.7	-68.6	-39.6	0	0	0	111.9	S432 F439	S432-D435 PolarHBondContact O-N 2.7Å; S432-D435 VanDerWaalsContact O-N 3.16Å; D435-F439 WeakPolarHBondContact O-CB 3.33Å; D435-F439 PolarHBondContact O-N 2.97Å
436	D	94.9	Very high	91.6	Very high	62 Å²	62	52.5 Å²	52.5	33%	0.332	26%	0.263	S	S	.	.	H	α-helix	trans	-62.4	-49	-179	-67.2	-33.5	0	0	0	112.1	A418 S432 V434 F439 I440	A418-D436 HydrophobicContact CB-CB 3.88Å; S432-D436 VanDerWaalsContact O-CG 3.3Å; S432-D436 PolarHBondContact O-N 2.95Å; S432-D436 PolarHBondContact OG-OD2 3.25Å; V434-D436 VanDerWaalsContact C-N 3.33Å; V434-D436 PolarHBondContact O-N 2.82Å; D436-F439 PolarHBondContact O-N 3.33Å; D436-I440 WeakPolarHBondContact O-CD1 3.42Å; D436-I440 WeakPolarHBondContact O-CG1 3.48Å; D436-I440 PolarHBondContact O-N 2.78Å
437	V	97	Very high	92.7	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-65.9	-46.2	-178	170.3	0	0	0	0	111	I415 A418 I433 V434 F439 I440 I441 L468 Y472	I415-V437 HydrophobicContact CD1-CG1 4.46Å; I415-V437 HydrophobicContact CG1-CG1 4.31Å; I415-V437 HydrophobicContact CG2-CG2 4.19Å; A418-V437 HydrophobicContact CB-CG2 4.44Å; I433-V437 VanDerWaalsContact O-CB 3.24Å; I433-V437 WeakPolarHBondContact O-CB 3.48Å; I433-V437 WeakPolarHBondContact O-CG2 3.22Å; I433-V437 PolarHBondContact O-N 2.92Å; V434-V437 PolarHBondContact O-N 2.89Å; V437-F439 VanDerWaalsContact C-N 3.33Å; V437-F439 PolarHBondContact O-N 2.68Å; V437-I440 PolarHBondContact O-N 3.09Å; V437-I441 HydrophobicContact CG1-CD1 3.94Å; V437-I441 WeakPolarHBondContact O-CG1 3.41Å; V437-I441 PolarHBondContact O-N 3.16Å; V437-L468 HydrophobicContact CG1-CD2 4.08Å; V437-Y472 HydrophobicContact CB-CD2 4.36Å; V437-Y472 HydrophobicContact CB-CE2 4.38Å; V437-Y472 HydrophobicContact CG1-CD1 4.44Å; V437-Y472 HydrophobicContact CG1-CD2 4.16Å; V437-Y472 HydrophobicContact CG1-CG 4.11Å; V437-Y472 HydrophobicContact CG2-CD2 3.9Å; V437-Y472 HydrophobicContact CG2-CE2 4.04Å
438	F	96.7	Very high	93.7	Very high	16 Å²	16	38.3 Å²	38.3	7%	0.07	19%	0.191	C	C	.	.	H	α-helix	trans	-69.5	-31.9	179.4	-76.3	-76.2	0	0	0	112.2	V434 R442 L468 Y472 C537 L538 L541	V434-F438 HydrophobicContact CG1-CD2 3.95Å; V434-F438 HydrophobicContact CG1-CE2 4.16Å; V434-F438 WeakPolarHBondContact O-CD2 3.13Å; V434-F438 PolarHBondContact O-N 3.39Å; V434-F438 VanDerWaalsContact O-N 3.13Å; F438-R442 VanDerWaalsContact O-CB 3.24Å; F438-R442 WeakPolarHBondContact O-CB 3.26Å; F438-R442 PolarHBondContact O-N 3.26Å; F438-L468 HydrophobicContact CE1-CD2 4.23Å; F438-L468 HydrophobicContact CZ-CD2 4.21Å; F438-Y472 HydrophobicContact CE2-CE1 4.14Å; F438-C537 HydrophobicContact CB-CB 4.46Å; F438-C537 HydrophobicContact CD1-CB 3.92Å; F438-C537 HydrophobicContact CD2-CB 3.49Å; F438-C537 VanDerWaalsContact CD2-CB 3.49Å; F438-C537 HydrophobicContact CE1-CB 4.01Å; F438-C537 HydrophobicContact CE2-CB 3.64Å; F438-C537 HydrophobicContact CG-CB 3.69Å; F438-C537 HydrophobicContact CZ-CB 3.9Å; F438-L538 HydrophobicContact CE1-CB 4.46Å; F438-L538 HydrophobicContact CE1-CD2 3.69Å; F438-L538 HydrophobicContact CE1-CG 3.71Å; F438-L538 HydrophobicContact CZ-CD2 4.1Å; F438-L538 HydrophobicContact CZ-CG 3.76Å; F438-L541 HydrophobicContact CD1-CD2 3.92Å; F438-L541 HydrophobicContact CE1-CD2 4.41Å
439	F	95.9	Very high	94.2	Very high	139 Å²	139	36.9 Å²	36.9	61%	0.61	18%	0.178	S	C	*	.	H	α-helix	trans	-63.8	-48.2	171.6	177.5	-95.5	0	0	0	111.7	D435 D436 V437 I441 R442 K443	D435-F439 WeakPolarHBondContact O-CB 3.33Å; D435-F439 PolarHBondContact O-N 2.97Å; D436-F439 PolarHBondContact O-N 3.33Å; V437-F439 VanDerWaalsContact C-N 3.33Å; V437-F439 PolarHBondContact O-N 2.68Å; F439-I441 PolarHBondContact O-N 2.82Å; F439-R442 PolarHBondContact O-N 3.32Å; F439-K443 HydrophobicContact CE1-CD 4.39Å; F439-K443 WeakPolarHBondContact O-CB 3.42Å; F439-K443 PolarHBondContact O-N 3.28Å
440	I	96.8	Very high	94.4	Very high	20 Å²	20	36 Å²	36	10%	0.103	18%	0.177	C	C	.	.	H	α-helix	trans	-58.6	-49.3	178.6	-70.6	159.6	0	0	0	110.5	M411 I415 A418 D436 V437 R442 K443 C444	M411-I440 HydrophobicContact CG-CG2 4.33Å; I415-I440 HydrophobicContact CG1-CG2 4.17Å; A418-I440 HydrophobicContact CB-CD1 4.01Å; D436-I440 WeakPolarHBondContact O-CD1 3.42Å; D436-I440 WeakPolarHBondContact O-CG1 3.48Å; D436-I440 PolarHBondContact O-N 2.78Å; V437-I440 PolarHBondContact O-N 3.09Å; I440-R442 PolarHBondContact O-N 2.92Å; I440-K443 WeakPolarHBondContact O-CB 3.33Å; I440-K443 PolarHBondContact O-N 3.45Å; I440-C444 PolarHBondContact O-N 3.14Å; I440-C444 PolarHBondContact O-SG 3.03Å
441	I	97.6	Very high	94.5	Very high	0 Å²	0	34 Å²	34	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-60.1	-48.5	-179.8	-72.4	170.1	0	0	0	110.9	M411 I415 V437 F439 K443 C444 I445 A464 L468 L541	M411-I441 HydrophobicContact SD-CG1 4.36Å; I415-I441 HydrophobicContact CD1-CD1 4.24Å; I415-I441 HydrophobicContact CD1-CG1 4.04Å; V437-I441 HydrophobicContact CG1-CD1 3.94Å; V437-I441 WeakPolarHBondContact O-CG1 3.41Å; V437-I441 PolarHBondContact O-N 3.16Å; F439-I441 PolarHBondContact O-N 2.82Å; I441-K443 VanDerWaalsContact C-N 3.31Å; I441-K443 PolarHBondContact O-N 3.4Å; I441-C444 PolarHBondContact O-N 2.82Å; I441-I445 HydrophobicContact CG2-CD1 3.58Å; I441-I445 WeakPolarHBondContact O-CG1 3.37Å; I441-I445 PolarHBondContact O-N 3.49Å; I441-A464 HydrophobicContact CG1-CB 4.46Å; I441-A464 HydrophobicContact CG2-CB 3.66Å; I441-L468 HydrophobicContact CD1-CD1 3.73Å; I441-L468 HydrophobicContact CD1-CD2 3.44Å; I441-L468 VanDerWaalsContact CD1-CD2 3.44Å; I441-L468 HydrophobicContact CD1-CG 3.4Å; I441-L468 VanDerWaalsContact CD1-CG 3.4Å; I441-L541 HydrophobicContact CG2-CD2 3.71Å
442	R	96.7	Very high	94.2	Very high	80 Å²	80	34.4 Å²	34.4	30%	0.302	17%	0.166	S	C	.	.	H	α-helix	trans	-59.6	-42	178	-177.3	169.6	167.7	79.8	-14	111.7	F438 F439 I440 R446 L541 D548	F438-R442 VanDerWaalsContact O-CB 3.24Å; F438-R442 WeakPolarHBondContact O-CB 3.26Å; F438-R442 PolarHBondContact O-N 3.26Å; F439-R442 PolarHBondContact O-N 3.32Å; I440-R442 PolarHBondContact O-N 2.92Å; R442-R446 VanDerWaalsContact O-CB 3.29Å; R442-R446 WeakPolarHBondContact O-CB 3.29Å; R442-R446 VanDerWaalsContact O-CG 3.31Å; R442-R446 WeakPolarHBondContact O-CG 3.43Å; R442-R446 PolarHBondContact O-N 2.91Å; R442-L541 HydrophobicContact CB-CD1 3.72Å; R442-L541 HydrophobicContact CG-CD1 4.04Å; R442-D548 IonicContact NH1-OD2 3.31Å
443	K	95.8	Very high	94	Very high	66 Å²	66	34.2 Å²	34.2	29%	0.287	17%	0.165	S	C	.	.	H	α-helix	trans	-60.3	-49.4	177.5	-175.6	-174.6	-177.9	-170.3	0	111.3	D334 Y410 F439 I440 I441 R446 R447	D334-K443 VanDerWaalsContact OD1-CE 3.29Å; D334-K443 WeakPolarHBondContact OD1-CE 3.38Å; D334-K443 IonicContact OD1-NZ 2.66Å; D334-K443 PolarHBondContact OD1-NZ 3.3Å; D334-K443 IonicContact OD2-NZ 2.87Å; D334-K443 PolarHBondContact OD2-NZ 2.9Å; Y410-K443 PolarHBondContact OH-NZ 3.12Å; F439-K443 HydrophobicContact CE1-CD 4.39Å; F439-K443 WeakPolarHBondContact O-CB 3.42Å; F439-K443 PolarHBondContact O-N 3.28Å; I440-K443 WeakPolarHBondContact O-CB 3.33Å; I440-K443 PolarHBondContact O-N 3.45Å; I441-K443 VanDerWaalsContact C-N 3.31Å; I441-K443 PolarHBondContact O-N 3.4Å; K443-R446 PolarHBondContact O-N 3.42Å; K443-R447 WeakPolarHBondContact O-CB 3.39Å; K443-R447 PolarHBondContact O-N 3.25Å
444	C	97	Very high	93.8	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-64	-45.4	-178.1	-60.8	0	0	0	0	111.8	E407 M411 I440 I441 R446 R447 A448	E407-C444 HydrophobicContact CG-CB 4.47Å; E407-C444 WeakPolarHBondContact OE1-CB 3.28Å; E407-C444 PolarHBondContact OE1-SG 3.18Å; E407-C444 VanDerWaalsContact OE1-SG 3.35Å; M411-C444 HydrophobicContact CE-CB 3.44Å; M411-C444 VanDerWaalsContact CE-CB 3.44Å; M411-C444 HydrophobicContact CG-CB 4.47Å; I440-C444 PolarHBondContact O-N 3.14Å; I440-C444 PolarHBondContact O-SG 3.03Å; I441-C444 PolarHBondContact O-N 2.82Å; C444-R446 PolarHBondContact O-N 3.42Å; C444-R447 PolarHBondContact O-N 3.04Å; C444-A448 PolarHBondContact O-N 2.91Å
445	I	96.2	Very high	93.6	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-65.8	-41	178.7	-62.5	163.2	0	0	0	111	I441 A448 L449 M460 L461 A464 L545 F549 F571	I441-I445 HydrophobicContact CG2-CD1 3.58Å; I441-I445 WeakPolarHBondContact O-CG1 3.37Å; I441-I445 PolarHBondContact O-N 3.49Å; I445-A448 WeakPolarHBondContact O-CB 3.2Å; I445-A448 PolarHBondContact O-N 2.87Å; I445-L449 PolarHBondContact O-N 2.91Å; I445-M460 HydrophobicContact CG1-CB 4.37Å; I445-L461 HydrophobicContact CD1-CD2 3.87Å; I445-L461 HydrophobicContact CG1-CD2 4.4Å; I445-L461 HydrophobicContact CG2-CD2 4.05Å; I445-L461 HydrophobicContact CG2-CG 4.5Å; I445-A464 HydrophobicContact CD1-CB 3.98Å; I445-L545 HydrophobicContact CB-CD2 4.09Å; I445-L545 HydrophobicContact CD1-CD1 3.69Å; I445-L545 HydrophobicContact CG2-CD1 4.17Å; I445-L545 HydrophobicContact CG2-CD2 3.59Å; I445-L545 HydrophobicContact CG2-CG 4.48Å; I445-F549 HydrophobicContact CG2-CE1 4.35Å; I445-F549 HydrophobicContact CG2-CZ 4.31Å; I445-F571 HydrophobicContact CD1-CZ 4.31Å
446	R	94.2	Very high	93.6	Very high	99 Å²	99	34.1 Å²	34.1	37%	0.374	16%	0.164	S	C	.	.	H	α-helix	trans	-66.4	-35.5	175.8	-77.9	-178.8	161.5	-151.6	-17.7	113.2	R442 K443 C444 L449 D548	R442-R446 VanDerWaalsContact O-CB 3.29Å; R442-R446 WeakPolarHBondContact O-CB 3.29Å; R442-R446 VanDerWaalsContact O-CG 3.31Å; R442-R446 WeakPolarHBondContact O-CG 3.43Å; R442-R446 PolarHBondContact O-N 2.91Å; K443-R446 PolarHBondContact O-N 3.42Å; C444-R446 PolarHBondContact O-N 3.42Å; R446-L449 WeakPolarHBondContact O-CB 3.39Å; R446-L449 PolarHBondContact O-N 3.04Å; R446-D548 IonicContact CZ-OD1 2.6Å; R446-D548 IonicContact CZ-OD2 3.1Å; R446-D548 IonicContact NE-OD1 3.98Å; R446-D548 IonicContact NE-OD2 2.68Å; R446-D548 PolarHBondContact NE-OD2 3.1Å; R446-D548 IonicContact NH2-OD1 3.47Å; R446-D548 PolarHBondContact NH2-OD1 2.97Å; R446-D548 IonicContact NH2-OD2 3.41Å; R446-D548 PolarHBondContact NH2-OD2 3.27Å
447	R	94.9	Very high	93.6	Very high	17 Å²	17	31.2 Å²	31.2	6%	0.064	15%	0.149	C	C	.	.	H	α-helix	trans	-64.4	-43.5	171.6	-179.8	163	57.8	-150.3	-3.1	110.7	D334 T341 E407 Y410 K443 C444 L449 S450	D334-R447 PolarHBondContact O-NH1 2.86Å; D334-R447 IonicContact OD1-CZ 2.65Å; D334-R447 IonicContact OD1-NH1 3.01Å; D334-R447 PolarHBondContact OD1-NH1 3.46Å; D334-R447 IonicContact OD1-NH2 3.26Å; T341-R447 HydrophobicContact CG2-CG 3.97Å; T341-R447 WeakPolarHBondContact CG2-O 3.4Å; E407-R447 IonicContact OE1-CZ 2.68Å; E407-R447 IonicContact OE1-NE 2.7Å; E407-R447 PolarHBondContact OE1-NE 3.44Å; E407-R447 IonicContact OE1-NH2 3.94Å; E407-R447 PolarHBondContact OE1-NH2 2.93Å; E407-R447 IonicContact OE2-CZ 3.55Å; E407-R447 IonicContact OE2-NE 3.92Å; E407-R447 PolarHBondContact OE2-NE 2.91Å; E407-R447 IonicContact OE2-NH2 3.4Å; E407-R447 PolarHBondContact OE2-NH2 2.97Å; Y410-R447 VanDerWaalsContact CD1-NH2 3.34Å; Y410-R447 VanDerWaalsContact CE1-NH2 3.34Å; K443-R447 WeakPolarHBondContact O-CB 3.39Å; K443-R447 PolarHBondContact O-N 3.25Å; C444-R447 PolarHBondContact O-N 3.04Å; R447-L449 VanDerWaalsContact C-N 3.26Å; R447-L449 PolarHBondContact O-N 3.3Å; R447-S450 WeakPolarHBondContact O-CB 3.35Å; R447-S450 PolarHBondContact O-N 2.9Å
448	A	94.8	Very high	93.4	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-61.3	-32.8	175.8	0	0	0	0	0	113	Y403 C444 I445 S450 S451 V457 M460	Y403-A448 HydrophobicContact CE1-CB 4.32Å; Y403-A448 WeakPolarHBondContact OH-CA 3.36Å; Y403-A448 PolarHBondContact OH-N 2.97Å; C444-A448 PolarHBondContact O-N 2.91Å; I445-A448 WeakPolarHBondContact O-CB 3.2Å; I445-A448 PolarHBondContact O-N 2.87Å; A448-S450 PolarHBondContact O-N 3.41Å; A448-S451 VanDerWaalsContact O-CB 3.27Å; A448-S451 WeakPolarHBondContact O-CB 3.12Å; A448-S451 PolarHBondContact O-N 2.99Å; A448-S451 PolarHBondContact O-OG 2.96Å; A448-V457 HydrophobicContact CB-CG2 4.39Å; A448-M460 HydrophobicContact CB-CB 4.08Å; A448-M460 HydrophobicContact CB-CG 3.55Å
449	L	92	Very high	93.3	Very high	11 Å²	11	31.8 Å²	31.8	6%	0.058	16%	0.157	C	C	.	.	H	α-helix	trans	-58.7	-32.6	171.7	-77.6	169.8	0	0	0	112.9	I445 R446 R447 S451 S452 V457 D548 F549	I445-L449 PolarHBondContact O-N 2.91Å; R446-L449 WeakPolarHBondContact O-CB 3.39Å; R446-L449 PolarHBondContact O-N 3.04Å; R447-L449 VanDerWaalsContact C-N 3.26Å; R447-L449 PolarHBondContact O-N 3.3Å; L449-S451 PolarHBondContact O-N 3.49Å; L449-S452 PolarHBondContact O-N 3.38Å; L449-V457 HydrophobicContact CD2-CG1 4.16Å; L449-V457 HydrophobicContact CD2-CG2 3.74Å; L449-V457 HydrophobicContact CG-CG2 4.16Å; L449-D548 HydrophobicContact CD1-CB 3.85Å; L449-F549 HydrophobicContact CD1-CD1 3.76Å; L449-F549 HydrophobicContact CD1-CE1 3.71Å; L449-F549 HydrophobicContact CD2-CD1 3.35Å; L449-F549 HydrophobicContact CD2-CE1 3.48Å; L449-F549 VanDerWaalsContact CD2-CE1 3.48Å; L449-F549 HydrophobicContact CG-CD1 4.03Å; L449-F549 HydrophobicContact CG-CE1 3.81Å
450	S	89.7	Confident	93.3	Very high	49 Å²	49	25.1 Å²	25.1	34%	0.343	13%	0.128	S	C	.	.	H	α-helix	trans	-66.6	-23.2	177.7	-56	0	0	0	0	112	M345 R447 A448 S452	M345-S450 VanDerWaalsContact CB-O 3.28Å; M345-S450 WeakPolarHBondContact CB-O 3.44Å; M345-S450 WeakPolarHBondContact CG-O 3.15Å; R447-S450 WeakPolarHBondContact O-CB 3.35Å; R447-S450 PolarHBondContact O-N 2.9Å; A448-S450 PolarHBondContact O-N 3.41Å; S450-S452 PolarHBondContact O-N 3.4Å
451	S	89.5	Confident	93.3	Very high	3 Å²	3	24.2 Å²	24.2	2%	0.021	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-15.1	173.1	77	0	0	0	0	113.5	A448 L449 S453	A448-S451 VanDerWaalsContact O-CB 3.27Å; A448-S451 WeakPolarHBondContact O-CB 3.12Å; A448-S451 PolarHBondContact O-N 2.99Å; A448-S451 PolarHBondContact O-OG 2.96Å; L449-S451 PolarHBondContact O-N 3.49Å; S451-S453 PolarHBondContact O-N 3.35Å; S451-S453 PolarHBondContact OG-N 2.88Å
452	S	84.1	Confident	93.2	Very high	14 Å²	14	27.1 Å²	27.1	10%	0.098	14%	0.139	C	C	.	.			trans	59.5	8.8	-174.7	-61.7	0	0	0	0	115.3	D348 L449 S450 R556	D348-S452 WeakPolarHBondContact OD2-CB 3.07Å; L449-S452 PolarHBondContact O-N 3.38Å; S450-S452 PolarHBondContact O-N 3.4Å; S452-R556 PolarHBondContact O-NH2 3Å
453	S	88.5	Confident	93.2	Very high	24 Å²	24	25.2 Å²	25.2	17%	0.168	13%	0.133	C	C	.	.			trans	-97.4	121.9	177.9	173.2	0	0	0	0	111.4	S451 D455 C456 V457	S451-S453 PolarHBondContact O-N 3.35Å; S451-S453 PolarHBondContact OG-N 2.88Å; S453-D455 VanDerWaalsContact C-N 3.35Å; S453-C456 WeakPolarHBondContact O-CB 3.36Å; S453-C456 PolarHBondContact O-N 3.41Å; S453-C456 PolarHBondContact OG-N 2.79Å; S453-V457 WeakPolarHBondContact O-CG2 3.29Å; S453-V457 PolarHBondContact O-N 3.44Å; S453-V457 VanDerWaalsContact O-N 3.14Å
454	V	89.8	Confident	93.3	Very high	8 Å²	8	22 Å²	22	5%	0.048	12%	0.12	C	C	.	.	H	α-helix	trans	-66.1	-39.6	179.4	174.3	0	0	0	0	111	C456 V457 G458 E560 L564	V454-C456 VanDerWaalsContact C-N 3.3Å; V454-C456 PolarHBondContact O-N 3.35Å; V454-V457 PolarHBondContact O-N 2.65Å; V454-G458 PolarHBondContact O-N 3.35Å; V454-E560 HydrophobicContact CG1-CB 4.29Å; V454-E560 HydrophobicContact CG2-CB 4Å; V454-E560 HydrophobicContact CG2-CG 4.09Å; V454-L564 HydrophobicContact CG1-CD1 4.19Å; V454-L564 HydrophobicContact CG1-CD2 3.97Å; V454-L564 HydrophobicContact CG1-CG 3.82Å
455	D	90.6	Very high	93.3	Very high	108 Å²	108	22.3 Å²	22.3	58%	0.578	12%	0.121	S	C	*	.	H	α-helix	trans	-66.8	-34.8	179.2	-56.5	-52.3	0	0	0	111.4	S453 G458 A459 K563	S453-D455 VanDerWaalsContact C-N 3.35Å; D455-G458 PolarHBondContact O-N 3.13Å; D455-A459 WeakPolarHBondContact O-CB 3.08Å; D455-A459 PolarHBondContact O-N 2.99Å; D455-K563 IonicContact OD1-NZ 2.69Å
456	C	93.2	Very high	93.4	Very high	0 Å²	0	25 Å²	25	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-65.1	-47.2	174.6	-173.4	0	0	0	0	112.3	L400 Y403 S453 V454 G458 A459 M460	L400-C456 HydrophobicContact CD1-CB 3.83Å; Y403-C456 VanDerWaalsContact CD1-SG 3.56Å; Y403-C456 WeakPolarHBondContact CE1-SG 3.3Å; S453-C456 WeakPolarHBondContact O-CB 3.36Å; S453-C456 PolarHBondContact O-N 3.41Å; S453-C456 PolarHBondContact OG-N 2.79Å; V454-C456 VanDerWaalsContact C-N 3.3Å; V454-C456 PolarHBondContact O-N 3.35Å; C456-G458 VanDerWaalsContact C-N 3.34Å; C456-A459 PolarHBondContact O-N 3.15Å; C456-M460 PolarHBondContact O-N 2.87Å
457	V	93.9	Very high	93.5	Very high	2 Å²	2	20.8 Å²	20.8	1%	0.012	13%	0.125	C	C	.	.	H	α-helix	trans	-62.7	-44.3	176.1	176.1	0	0	0	0	110.2	A448 L449 S453 V454 A459 M460 L461 F549 L564	A448-V457 HydrophobicContact CB-CG2 4.39Å; L449-V457 HydrophobicContact CD2-CG1 4.16Å; L449-V457 HydrophobicContact CD2-CG2 3.74Å; L449-V457 HydrophobicContact CG-CG2 4.16Å; S453-V457 WeakPolarHBondContact O-CG2 3.29Å; S453-V457 PolarHBondContact O-N 3.44Å; S453-V457 VanDerWaalsContact O-N 3.14Å; V454-V457 PolarHBondContact O-N 2.65Å; V457-A459 PolarHBondContact O-N 3.47Å; V457-M460 PolarHBondContact O-N 2.62Å; V457-L461 HydrophobicContact CG1-CD1 4.12Å; V457-L461 HydrophobicContact CG1-CG 4.45Å; V457-L461 WeakPolarHBondContact O-CG 3.42Å; V457-L461 PolarHBondContact O-N 3.1Å; V457-F549 HydrophobicContact CG1-CE1 3.66Å; V457-F549 HydrophobicContact CG1-CE2 4.4Å; V457-F549 HydrophobicContact CG1-CZ 3.56Å; V457-L564 HydrophobicContact CB-CD2 4.09Å; V457-L564 HydrophobicContact CG1-CD2 3.78Å
458	G	93.2	Very high	93.6	Very high	7 Å²	7	20 Å²	20	7%	0.072	12%	0.122	C	C	.	.	H	α-helix	trans	-58	-45.1	174.9	0	0	0	0	0	112.6	V454 D455 C456 M460 L461 N462	V454-G458 PolarHBondContact O-N 3.35Å; D455-G458 PolarHBondContact O-N 3.13Å; C456-G458 VanDerWaalsContact C-N 3.34Å; G458-M460 PolarHBondContact O-N 2.96Å; G458-L461 PolarHBondContact O-N 2.7Å; G458-N462 PolarHBondContact O-N 2.92Å; G458-N462 PolarHBondContact O-ND2 3.2Å; G458-N462 PolarHBondContact O-OD1 3.44Å
459	A	95.2	Very high	93.7	Very high	20 Å²	20	22 Å²	22	17%	0.165	13%	0.131	C	C	.	.	H	α-helix	trans	-59.2	-46.7	174.3	0	0	0	0	0	111.5	I404 D455 C456 V457 L461 N462 H463	I404-A459 HydrophobicContact CD1-CB 4.26Å; I404-A459 HydrophobicContact CG2-CB 4.17Å; D455-A459 WeakPolarHBondContact O-CB 3.08Å; D455-A459 PolarHBondContact O-N 2.99Å; C456-A459 PolarHBondContact O-N 3.15Å; V457-A459 PolarHBondContact O-N 3.47Å; A459-L461 PolarHBondContact O-N 2.69Å; A459-N462 PolarHBondContact O-N 2.78Å; A459-H463 PolarHBondContact O-CD2 2.99Å; A459-H463 PolarHBondContact O-N 2.67Å
460	M	96.5	Very high	93.8	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-65.3	-35.6	179	-71.7	-50.2	113.7	0	0	113.9	I404 E407 M411 I445 A448 C456 V457 G458 A464	I404-M460 HydrophobicContact CB-CE 3.99Å; I404-M460 HydrophobicContact CG1-CE 4.05Å; I404-M460 HydrophobicContact CG2-CE 3.69Å; E407-M460 HydrophobicContact CB-CE 4.1Å; E407-M460 HydrophobicContact CB-SD 3.75Å; E407-M460 HydrophobicContact CG-CE 4.27Å; E407-M460 HydrophobicContact CG-CG 4.24Å; E407-M460 HydrophobicContact CG-SD 3.3Å; E407-M460 WeakPolarHBondContact CG-SD 3.42Å; M411-M460 HydrophobicContact CE-SD 4.25Å; I445-M460 HydrophobicContact CG1-CB 4.37Å; A448-M460 HydrophobicContact CB-CB 4.08Å; A448-M460 HydrophobicContact CB-CG 3.55Å; C456-M460 PolarHBondContact O-N 2.87Å; V457-M460 PolarHBondContact O-N 2.62Å; G458-M460 PolarHBondContact O-N 2.96Å; M460-A464 VanDerWaalsContact O-CB 3.28Å; M460-A464 WeakPolarHBondContact O-CB 3.17Å; M460-A464 PolarHBondContact O-N 3.13Å
461	L	96.4	Very high	94	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-61.9	-47.1	172.5	-70.6	166.6	0	0	0	110.8	I445 V457 G458 A459 H463 A464 C465 L545 F549 L564 C567 L568 F571	I445-L461 HydrophobicContact CD1-CD2 3.87Å; I445-L461 HydrophobicContact CG1-CD2 4.4Å; I445-L461 HydrophobicContact CG2-CD2 4.05Å; I445-L461 HydrophobicContact CG2-CG 4.5Å; V457-L461 HydrophobicContact CG1-CD1 4.12Å; V457-L461 HydrophobicContact CG1-CG 4.45Å; V457-L461 WeakPolarHBondContact O-CG 3.42Å; V457-L461 PolarHBondContact O-N 3.1Å; G458-L461 PolarHBondContact O-N 2.7Å; A459-L461 PolarHBondContact O-N 2.69Å; L461-H463 PolarHBondContact O-N 3.29Å; L461-A464 WeakPolarHBondContact O-CB 3.28Å; L461-A464 PolarHBondContact O-N 3.14Å; L461-C465 PolarHBondContact O-N 3.33Å; L461-C465 PolarHBondContact O-SG 3.3Å; L461-L545 HydrophobicContact CD2-CD1 3.97Å; L461-F549 HydrophobicContact CD1-CE2 3.94Å; L461-F549 HydrophobicContact CD1-CZ 3.88Å; L461-F549 HydrophobicContact CD2-CZ 4.19Å; L461-F549 HydrophobicContact CG-CZ 4.42Å; L461-L564 HydrophobicContact CD1-CD2 4.33Å; L461-C567 HydrophobicContact CB-CB 4.04Å; L461-C567 HydrophobicContact CD1-CB 3.53Å; L461-C567 HydrophobicContact CG-CB 4.44Å; L461-L568 HydrophobicContact CD2-CD2 4.04Å; L461-F571 HydrophobicContact CD2-CE2 3.65Å; L461-F571 HydrophobicContact CD2-CZ 4.2Å
462	N	95.8	Very high	94.3	Very high	61 Å²	61	24 Å²	24	33%	0.326	14%	0.143	S	C	.	.	H	α-helix	trans	-62.7	-44.2	178.9	-62.5	-17.8	0	0	0	111.5	G458 A459 C465 S466 Q570	G458-N462 PolarHBondContact O-N 2.92Å; G458-N462 PolarHBondContact O-ND2 3.2Å; G458-N462 PolarHBondContact O-OD1 3.44Å; A459-N462 PolarHBondContact O-N 2.78Å; N462-C465 PolarHBondContact O-N 2.59Å; N462-S466 WeakPolarHBondContact O-CB 3.41Å; N462-S466 PolarHBondContact O-N 2.99Å; N462-Q570 PolarHBondContact OD1-NE2 3.41Å; N462-Q570 PolarHBondContact OD1-OE1 3.11Å
463	H	96.4	Very high	94.9	Very high	40 Å²	40	23.6 Å²	23.6	19%	0.185	14%	0.139	C	C	.	.	H	α-helix	trans	-62.8	-41.4	175.5	-68.8	-59.3	0	0	0	111.7	E408 A459 L461 S466 L467	E408-H463 VanDerWaalsContact CD-ND1 3.28Å; E408-H463 HydrophobicContact CG-CB 4.41Å; E408-H463 IonicContact OE1-CE1 2.65Å; E408-H463 IonicContact OE1-ND1 3.99Å; E408-H463 PolarHBondContact OE1-ND1 3.32Å; E408-H463 IonicContact OE2-CE1 3.47Å; E408-H463 PolarHBondContact OE2-CE1 3.25Å; E408-H463 IonicContact OE2-ND1 3.58Å; E408-H463 IonicContact OE2-NE2 2.74Å; A459-H463 PolarHBondContact O-CD2 2.99Å; A459-H463 PolarHBondContact O-N 2.67Å; L461-H463 PolarHBondContact O-N 3.29Å; H463-S466 PolarHBondContact O-N 3.37Å; H463-L467 WeakPolarHBondContact O-CB 3.45Å; H463-L467 VanDerWaalsContact O-CG 3.26Å; H463-L467 WeakPolarHBondContact O-CG 3.42Å; H463-L467 PolarHBondContact O-N 3.15Å
464	A	97.8	Very high	95.2	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-61	-48.2	176	0	0	0	0	0	112	M411 I441 I445 M460 L461 S466 L467 L468 F571	M411-A464 HydrophobicContact CE-CB 4.28Å; M411-A464 HydrophobicContact SD-CB 3.95Å; I441-A464 HydrophobicContact CG1-CB 4.46Å; I441-A464 HydrophobicContact CG2-CB 3.66Å; I445-A464 HydrophobicContact CD1-CB 3.98Å; M460-A464 VanDerWaalsContact O-CB 3.28Å; M460-A464 WeakPolarHBondContact O-CB 3.17Å; M460-A464 PolarHBondContact O-N 3.13Å; L461-A464 WeakPolarHBondContact O-CB 3.28Å; L461-A464 PolarHBondContact O-N 3.14Å; A464-S466 PolarHBondContact O-N 3.46Å; A464-L467 PolarHBondContact O-N 3.19Å; A464-L468 WeakPolarHBondContact O-CB 3.29Å; A464-L468 VanDerWaalsContact O-CG 3.31Å; A464-L468 WeakPolarHBondContact O-CG 3.49Å; A464-L468 PolarHBondContact O-N 2.69Å; A464-F571 HydrophobicContact CB-CZ 4.48Å
465	C	97.4	Very high	95.3	Very high	5 Å²	5	29.7 Å²	29.7	3%	0.034	17%	0.171	C	C	.	.	H	α-helix	trans	-59.7	-46.9	175.6	-71.7	0	0	0	0	111.3	L461 N462 L467 L468 E469 Q570 F571 V574	L461-C465 PolarHBondContact O-N 3.33Å; L461-C465 PolarHBondContact O-SG 3.3Å; N462-C465 PolarHBondContact O-N 2.59Å; C465-L467 PolarHBondContact O-N 3.44Å; C465-L468 PolarHBondContact O-N 2.99Å; C465-E469 WeakPolarHBondContact O-CG 3.43Å; C465-E469 PolarHBondContact O-N 3.35Å; C465-Q570 HydrophobicContact CB-CB 4.36Å; C465-F571 VanDerWaalsContact SG-CE2 3.54Å; C465-V574 HydrophobicContact CB-CG2 3.98Å
466	S	96.9	Very high	95.4	Very high	58 Å²	58	24.6 Å²	24.6	41%	0.406	14%	0.143	S	C	.	.	H	α-helix	trans	-57.9	-47.6	176.8	-175.3	0	0	0	0	111.7	N462 H463 A464 E469 T470	N462-S466 WeakPolarHBondContact O-CB 3.41Å; N462-S466 PolarHBondContact O-N 2.99Å; H463-S466 PolarHBondContact O-N 3.37Å; A464-S466 PolarHBondContact O-N 3.46Å; S466-E469 PolarHBondContact O-N 3.27Å; S466-T470 WeakPolarHBondContact O-CB 3.24Å; S466-T470 WeakPolarHBondContact O-CG2 3.31Å; S466-T470 PolarHBondContact O-N 3.42Å; S466-T470 PolarHBondContact O-OG1 2.74Å
467	L	96.8	Very high	95.4	Very high	9 Å²	9	30.9 Å²	30.9	5%	0.047	17%	0.171	C	C	.	.	H	α-helix	trans	-68.9	-35.2	-178.3	-71.2	171.1	0	0	0	112.5	M411 R412 I415 H463 A464 C465 E469 C471 Y472	M411-L467 HydrophobicContact CB-CD1 3.96Å; M411-L467 HydrophobicContact CG-CD1 3.78Å; M411-L467 HydrophobicContact SD-CD1 3.63Å; R412-L467 HydrophobicContact CB-CD1 4.01Å; R412-L467 HydrophobicContact CB-CD2 3.72Å; R412-L467 HydrophobicContact CG-CD2 3.65Å; I415-L467 HydrophobicContact CD1-CB 4.01Å; I415-L467 HydrophobicContact CD1-CD1 4.3Å; H463-L467 WeakPolarHBondContact O-CB 3.45Å; H463-L467 VanDerWaalsContact O-CG 3.26Å; H463-L467 WeakPolarHBondContact O-CG 3.42Å; H463-L467 PolarHBondContact O-N 3.15Å; A464-L467 PolarHBondContact O-N 3.19Å; C465-L467 PolarHBondContact O-N 3.44Å; L467-E469 VanDerWaalsContact C-N 3.3Å; L467-E469 PolarHBondContact O-N 3.37Å; L467-C471 WeakPolarHBondContact O-CA 3.47Å; L467-C471 VanDerWaalsContact O-CB 3.28Å; L467-C471 WeakPolarHBondContact O-CB 3.31Å; L467-C471 PolarHBondContact O-N 2.86Å; L467-Y472 PolarHBondContact O-N 3.11Å; L467-Y472 VanDerWaalsContact O-N 3.14Å
468	L	97.6	Very high	95.2	Very high	1 Å²	1	32.2 Å²	32.2	1%	0.005	19%	0.185	C	C	.	.	I	π-helix	trans	-59.2	-43.7	170.4	-77.5	165.1	0	0	0	110.8	V437 F438 I441 A464 C465 Y472 L473 L538 F571 V574	V437-L468 HydrophobicContact CG1-CD2 4.08Å; F438-L468 HydrophobicContact CE1-CD2 4.23Å; F438-L468 HydrophobicContact CZ-CD2 4.21Å; I441-L468 HydrophobicContact CD1-CD1 3.73Å; I441-L468 HydrophobicContact CD1-CD2 3.44Å; I441-L468 VanDerWaalsContact CD1-CD2 3.44Å; I441-L468 HydrophobicContact CD1-CG 3.4Å; I441-L468 VanDerWaalsContact CD1-CG 3.4Å; A464-L468 WeakPolarHBondContact O-CB 3.29Å; A464-L468 VanDerWaalsContact O-CG 3.31Å; A464-L468 WeakPolarHBondContact O-CG 3.49Å; A464-L468 PolarHBondContact O-N 2.69Å; C465-L468 PolarHBondContact O-N 2.99Å; L468-Y472 HydrophobicContact CD2-CD1 3.92Å; L468-Y472 HydrophobicContact CD2-CG 4.46Å; L468-Y472 WeakPolarHBondContact O-CB 3.25Å; L468-Y472 PolarHBondContact O-N 3.5Å; L468-L473 WeakPolarHBondContact O-CB 3.43Å; L468-L473 VanDerWaalsContact O-CG 3.31Å; L468-L473 WeakPolarHBondContact O-CG 3.38Å; L468-L473 PolarHBondContact O-N 2.73Å; L468-L538 HydrophobicContact CD1-CD2 3.87Å; L468-F571 HydrophobicContact CD1-CE1 4.11Å; L468-V574 HydrophobicContact CB-CG1 3.84Å; L468-V574 HydrophobicContact CD1-CG1 4.3Å
469	E	95.5	Very high	95	Very high	41 Å²	41	33.8 Å²	33.8	19%	0.192	19%	0.189	C	C	.	.	I	π-helix	trans	-73.8	-52.5	179.7	-65.7	-168.6	154.3	0	0	113.2	C465 S466 L467 T474 V574 R577	C465-E469 WeakPolarHBondContact O-CG 3.43Å; C465-E469 PolarHBondContact O-N 3.35Å; S466-E469 PolarHBondContact O-N 3.27Å; L467-E469 VanDerWaalsContact C-N 3.3Å; L467-E469 PolarHBondContact O-N 3.37Å; E469-T474 PolarHBondContact O-N 3.03Å; E469-T474 PolarHBondContact O-OG1 2.81Å; E469-V574 HydrophobicContact CG-CG1 4.41Å; E469-V574 HydrophobicContact CG-CG2 3.9Å; E469-R577 IonicContact OE1-CZ 2.61Å; E469-R577 IonicContact OE1-NE 2.75Å; E469-R577 IonicContact OE1-NH1 2.86Å; E469-R577 PolarHBondContact OE1-NH1 3.01Å; E469-R577 IonicContact OE1-NH2 2.66Å; E469-R577 IonicContact OE2-CZ 2.95Å; E469-R577 IonicContact OE2-NH1 2.84Å; E469-R577 PolarHBondContact OE2-NH1 3.33Å; E469-R577 IonicContact OE2-NH2 3.58Å
470	T	94.5	Very high	94.7	Very high	80 Å²	80	33.3 Å²	33.3	49%	0.491	18%	0.183	S	C	.	.	I	π-helix	trans	-82	-27.1	-168.5	62.4	0	0	0	0	113.5	S466 T474	S466-T470 WeakPolarHBondContact O-CB 3.24Å; S466-T470 WeakPolarHBondContact O-CG2 3.31Å; S466-T470 PolarHBondContact O-N 3.42Å; S466-T470 PolarHBondContact O-OG1 2.74Å; T470-T474 WeakPolarHBondContact O-CB 3.33Å; T470-T474 PolarHBondContact O-OG1 3.19Å
471	C	93.7	Very high	94.1	Very high	26 Å²	26	39 Å²	39	18%	0.176	21%	0.208	C	C	.	.	I	π-helix	trans	-106.4	-59.1	179.4	-61.4	0	0	0	0	110.9	I415 L467 E475	I415-C471 HydrophobicContact CG2-CB 4.45Å; L467-C471 WeakPolarHBondContact O-CA 3.47Å; L467-C471 VanDerWaalsContact O-CB 3.28Å; L467-C471 WeakPolarHBondContact O-CB 3.31Å; L467-C471 PolarHBondContact O-N 2.86Å; C471-E475 VanDerWaalsContact O-CB 3.31Å; C471-E475 WeakPolarHBondContact O-CB 3.46Å; C471-E475 PolarHBondContact O-N 2.86Å; C471-E475 VanDerWaalsContact O-N 3.13Å
472	Y	96.5	Very high	92.9	Very high	1 Å²	1	42 Å²	42	0%	0.004	23%	0.227	C	C	.	.	I	π-helix	trans	-73	-60.9	-169.8	-177.1	-119	0	0	0	113.2	L419 I433 V434 V437 F438 L467 L468 T474 E475 L476 S534	L419-Y472 HydrophobicContact CD2-CD2 4.01Å; L419-Y472 HydrophobicContact CD2-CE2 4.33Å; I433-Y472 HydrophobicContact CB-CE2 4.49Å; I433-Y472 HydrophobicContact CD1-CE2 4.22Å; I433-Y472 HydrophobicContact CG1-CE2 4.2Å; V434-Y472 WeakPolarHBondContact CG2-OH 3.35Å; V437-Y472 HydrophobicContact CB-CD2 4.36Å; V437-Y472 HydrophobicContact CB-CE2 4.38Å; V437-Y472 HydrophobicContact CG1-CD1 4.44Å; V437-Y472 HydrophobicContact CG1-CD2 4.16Å; V437-Y472 HydrophobicContact CG1-CG 4.11Å; V437-Y472 HydrophobicContact CG2-CD2 3.9Å; V437-Y472 HydrophobicContact CG2-CE2 4.04Å; F438-Y472 HydrophobicContact CE2-CE1 4.14Å; L467-Y472 PolarHBondContact O-N 3.11Å; L467-Y472 VanDerWaalsContact O-N 3.14Å; L468-Y472 HydrophobicContact CD2-CD1 3.92Å; L468-Y472 HydrophobicContact CD2-CG 4.46Å; L468-Y472 WeakPolarHBondContact O-CB 3.25Å; L468-Y472 PolarHBondContact O-N 3.5Å; Y472-T474 PolarHBondContact O-N 2.92Å; Y472-E475 WeakPolarHBondContact O-CB 3.31Å; Y472-E475 PolarHBondContact O-N 2.9Å; Y472-E475 VanDerWaalsContact O-N 3.11Å; Y472-L476 HydrophobicContact CD1-CD1 4.26Å; Y472-L476 HydrophobicContact CE1-CD1 3.73Å; Y472-L476 HydrophobicContact CE2-CD1 4.21Å; Y472-L476 HydrophobicContact CE2-CD2 4.29Å; Y472-L476 HydrophobicContact CE2-CG 4.3Å; Y472-L476 WeakPolarHBondContact O-CG 3.38Å; Y472-L476 PolarHBondContact O-N 3.36Å; Y472-S534 WeakPolarHBondContact CE1-OG 3.47Å; Y472-S534 PolarHBondContact OH-OG 3.24Å
473	L	96	Very high	91.6	Very high	4 Å²	4	42.9 Å²	42.9	2%	0.021	24%	0.243	C	C	.	.	I	π-helix	trans	-64.1	-31.4	-179.6	-68.2	-176	0	0	0	112.3	L468 L476 K477 V574 R577 C578 I581	L468-L473 WeakPolarHBondContact O-CB 3.43Å; L468-L473 VanDerWaalsContact O-CG 3.31Å; L468-L473 WeakPolarHBondContact O-CG 3.38Å; L468-L473 PolarHBondContact O-N 2.73Å; L473-L476 HydrophobicContact CD2-CD1 4.32Å; L473-K477 WeakPolarHBondContact O-CB 3.4Å; L473-K477 PolarHBondContact O-N 2.88Å; L473-V574 HydrophobicContact CD1-CG1 3.83Å; L473-R577 HydrophobicContact CD1-CB 4.24Å; L473-R577 HydrophobicContact CD1-CG 4.3Å; L473-C578 HydrophobicContact CD1-CB 4.33Å; L473-C578 HydrophobicContact CD2-CB 3.96Å; L473-I581 HydrophobicContact CB-CD1 3.91Å; L473-I581 HydrophobicContact CD2-CD1 4.34Å; L473-I581 HydrophobicContact CG-CD1 4.49Å
474	T	95.1	Very high	90.3	Very high	82 Å²	82	42.8 Å²	42.8	50%	0.503	24%	0.244	S	C	.	.	H	α-helix	trans	-65.4	-41.4	174.5	-65	0	0	0	0	111.5	E469 T470 Y472 G478	E469-T474 PolarHBondContact O-N 3.03Å; E469-T474 PolarHBondContact O-OG1 2.81Å; T470-T474 WeakPolarHBondContact O-CB 3.33Å; T470-T474 PolarHBondContact O-OG1 3.19Å; Y472-T474 PolarHBondContact O-N 2.92Å; T474-G478 PolarHBondContact O-N 3.47Å
475	E	92.2	Very high	88.9	Confident	79 Å²	79	43.7 Å²	43.7	37%	0.369	25%	0.249	S	C	.	.	H	α-helix	trans	-64.5	-48.6	174.3	-179.3	59.9	-155.4	0	0	111.4	L419 C471 Y472 K477 G478 R479	L419-E475 HydrophobicContact CD1-CB 4.38Å; L419-E475 HydrophobicContact CD1-CG 4.41Å; L419-E475 HydrophobicContact CD2-CG 4.22Å; C471-E475 VanDerWaalsContact O-CB 3.31Å; C471-E475 WeakPolarHBondContact O-CB 3.46Å; C471-E475 PolarHBondContact O-N 2.86Å; C471-E475 VanDerWaalsContact O-N 3.13Å; Y472-E475 WeakPolarHBondContact O-CB 3.31Å; Y472-E475 PolarHBondContact O-N 2.9Å; Y472-E475 VanDerWaalsContact O-N 3.11Å; E475-K477 VanDerWaalsContact C-N 3.35Å; E475-K477 PolarHBondContact O-N 2.97Å; E475-G478 WeakPolarHBondContact O-CA 3.44Å; E475-G478 PolarHBondContact O-N 3.04Å; E475-R479 WeakPolarHBondContact O-CG 3.48Å; E475-R479 PolarHBondContact O-N 3.33Å; E475-R479 VanDerWaalsContact O-N 3.13Å; E475-R479 IonicContact OE1-CZ 3.3Å; E475-R479 IonicContact OE1-NE 3.13Å; E475-R479 PolarHBondContact OE1-NE 3.03Å; E475-R479 IonicContact OE1-NH2 2.69Å; E475-R479 PolarHBondContact OE1-NH2 3.47Å
476	L	93.5	Very high	86.9	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-58.7	-45.8	177.1	-61.9	-176	0	0	0	111.8	I433 Y472 L473 G478 R479 L480 T527 D530	I433-L476 HydrophobicContact CD1-CD2 3.82Å; Y472-L476 HydrophobicContact CD1-CD1 4.26Å; Y472-L476 HydrophobicContact CE1-CD1 3.73Å; Y472-L476 HydrophobicContact CE2-CD1 4.21Å; Y472-L476 HydrophobicContact CE2-CD2 4.29Å; Y472-L476 HydrophobicContact CE2-CG 4.3Å; Y472-L476 WeakPolarHBondContact O-CG 3.38Å; Y472-L476 PolarHBondContact O-N 3.36Å; L473-L476 HydrophobicContact CD2-CD1 4.32Å; L476-G478 VanDerWaalsContact C-N 3.25Å; L476-G478 PolarHBondContact O-N 3.3Å; L476-R479 PolarHBondContact O-N 3.39Å; L476-R479 VanDerWaalsContact O-N 3.12Å; L476-L480 PolarHBondContact O-N 3.24Å; L476-L480 VanDerWaalsContact O-N 3.11Å; L476-T527 HydrophobicContact CB-CG2 4.08Å; L476-T527 HydrophobicContact CD2-CG2 3.98Å; L476-T527 WeakPolarHBondContact O-CG2 3.47Å; L476-D530 HydrophobicContact CD2-CB 4.42Å
477	K	93.2	Very high	84.8	Confident	132 Å²	132	47.3 Å²	47.3	57%	0.574	26%	0.259	S	S	*	.	H	α-helix	trans	-61.3	-35.6	175.1	-175.4	-179.7	178.6	-177.8	0	112	L473 E475 R479 L480 I581	L473-K477 WeakPolarHBondContact O-CB 3.4Å; L473-K477 PolarHBondContact O-N 2.88Å; E475-K477 VanDerWaalsContact C-N 3.35Å; E475-K477 PolarHBondContact O-N 2.97Å; K477-R479 VanDerWaalsContact C-N 3.25Å; K477-R479 PolarHBondContact O-N 3.46Å; K477-L480 PolarHBondContact O-N 3Å; K477-I581 HydrophobicContact CB-CD1 4.19Å; K477-I581 HydrophobicContact CB-CG1 4.39Å; K477-I581 HydrophobicContact CB-CG2 4.4Å; K477-I581 HydrophobicContact CD-CG1 4.48Å
478	G	89.8	Confident	82.5	Confident	30 Å²	30	48.4 Å²	48.4	31%	0.309	27%	0.273	S	S	.	.	H	α-helix	trans	-62.8	-31.3	176	0	0	0	0	0	113.5	T474 E475 L476 K481	T474-G478 PolarHBondContact O-N 3.47Å; E475-G478 WeakPolarHBondContact O-CA 3.44Å; E475-G478 PolarHBondContact O-N 3.04Å; L476-G478 VanDerWaalsContact C-N 3.25Å; L476-G478 PolarHBondContact O-N 3.3Å; G478-K481 VanDerWaalsContact O-CD 3.32Å; G478-K481 WeakPolarHBondContact O-CD 3.15Å; G478-K481 WeakPolarHBondContact O-CE 3.38Å; G478-K481 WeakPolarHBondContact O-CG 3.46Å
479	R	88.9	Confident	79.8	Confident	41 Å²	41	50.9 Å²	50.9	16%	0.155	29%	0.29	C	S	.	.	H	α-helix	trans	-84.7	-24.8	178.4	-65.4	171.4	-177.7	-155.8	-2.6	113.4	E422 E475 L476 K477 K481 N484 T527	E422-R479 IonicContact OE1-NH1 2.84Å; E422-R479 PolarHBondContact OE1-NH1 2.98Å; E422-R479 IonicContact OE2-CZ 3.07Å; E422-R479 IonicContact OE2-NH1 3.45Å; E422-R479 PolarHBondContact OE2-NH1 3.44Å; E422-R479 IonicContact OE2-NH2 2.68Å; E422-R479 PolarHBondContact OE2-NH2 2.85Å; E475-R479 WeakPolarHBondContact O-CG 3.48Å; E475-R479 PolarHBondContact O-N 3.33Å; E475-R479 VanDerWaalsContact O-N 3.13Å; E475-R479 IonicContact OE1-CZ 3.3Å; E475-R479 IonicContact OE1-NE 3.13Å; E475-R479 PolarHBondContact OE1-NE 3.03Å; E475-R479 IonicContact OE1-NH2 2.69Å; E475-R479 PolarHBondContact OE1-NH2 3.47Å; L476-R479 PolarHBondContact O-N 3.39Å; L476-R479 VanDerWaalsContact O-N 3.12Å; K477-R479 VanDerWaalsContact C-N 3.25Å; K477-R479 PolarHBondContact O-N 3.46Å; R479-K481 VanDerWaalsContact C-N 3.26Å; R479-K481 PolarHBondContact O-N 3.35Å; R479-N484 PolarHBondContact O-ND2 3.47Å; R479-T527 HydrophobicContact CB-CG2 3.81Å
480	L	89.1	Confident	77.3	Confident	10 Å²	10	55.1 Å²	55.1	5%	0.052	31%	0.314	C	S	.	.			trans	-83.9	57.3	174.7	-65	174.2	0	0	0	113	L476 K477 F524 T527 L528 I581 Q588	L476-L480 PolarHBondContact O-N 3.24Å; L476-L480 VanDerWaalsContact O-N 3.11Å; K477-L480 PolarHBondContact O-N 3Å; L480-F524 HydrophobicContact CB-CE2 4.16Å; L480-F524 HydrophobicContact CD2-CD1 4.21Å; L480-F524 HydrophobicContact CD2-CD2 4Å; L480-F524 HydrophobicContact CD2-CE1 4.06Å; L480-F524 HydrophobicContact CD2-CE2 3.86Å; L480-F524 HydrophobicContact CD2-CG 4.18Å; L480-F524 HydrophobicContact CD2-CZ 3.88Å; L480-T527 HydrophobicContact CD1-CG2 4.32Å; L480-T527 HydrophobicContact CD2-CG2 3.94Å; L480-T527 HydrophobicContact CG-CG2 3.75Å; L480-L528 HydrophobicContact CD1-CD1 4.31Å; L480-L528 HydrophobicContact CD2-CB 4.07Å; L480-L528 HydrophobicContact CD2-CD1 4.36Å; L480-I581 HydrophobicContact CD1-CG2 3.52Å; L480-Q588 PolarHBondContact O-NE2 3.47Å; L480-Q588 VanDerWaalsContact O-NE2 3.11Å; L480-Q588 PolarHBondContact O-OE1 3.14Å
481	K	83.8	Confident	74.8	Confident	118 Å²	118	54.4 Å²	54.4	51%	0.513	32%	0.316	S	S	.	.			trans	-102.5	141.8	175.3	-71.9	175.7	-176.6	168.4	0	111	G478 R479 A483 N484	G478-K481 VanDerWaalsContact O-CD 3.32Å; G478-K481 WeakPolarHBondContact O-CD 3.15Å; G478-K481 WeakPolarHBondContact O-CE 3.38Å; G478-K481 WeakPolarHBondContact O-CG 3.46Å; R479-K481 VanDerWaalsContact C-N 3.26Å; R479-K481 PolarHBondContact O-N 3.35Å; K481-A483 PolarHBondContact O-N 2.71Å; K481-A483 VanDerWaalsContact O-N 3.09Å; K481-N484 WeakPolarHBondContact O-CB 3.31Å; K481-N484 PolarHBondContact O-N 2.64Å
482	P	70.8	Confident	72.6	Confident	64 Å²	64	56.5 Å²	56.5	42%	0.416	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-56.1	-30.4	175.9	-27.3	35.2	0	0	0	113.8	N484 L485 Q588	P482-N484 PolarHBondContact O-N 3.02Å; P482-L485 WeakPolarHBondContact O-CB 3.44Å; P482-L485 PolarHBondContact O-N 3.35Å; P482-Q588 HydrophobicContact CG-CG 4.21Å
483	A	68.3	Low	70.2	Confident	80 Å²	80	58.7 Å²	58.7	66%	0.661	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	-62.3	-20.2	177.1	0	0	0	0	0	113.7	K481	K481-A483 PolarHBondContact O-N 2.71Å; K481-A483 VanDerWaalsContact O-N 3.09Å
484	N	68.6	Low	67.7	Low	37 Å²	37	66.2 Å²	66.2	20%	0.198	37%	0.373	C	S	.	.	G	3₁₀ helix	trans	-85.7	-12.8	175.9	-62.3	-13.4	0	0	0	111.9	R479 K481 P482 I486 K520 S521	R479-N484 PolarHBondContact O-ND2 3.47Å; K481-N484 WeakPolarHBondContact O-CB 3.31Å; K481-N484 PolarHBondContact O-N 2.64Å; P482-N484 PolarHBondContact O-N 3.02Å; N484-I486 PolarHBondContact O-N 2.9Å; N484-K520 HydrophobicContact CB-CB 4.35Å; N484-K520 CarbonylContact O-C 3.58Å; N484-K520 VanDerWaalsContact O-C 3.27Å; N484-S521 WeakPolarHBondContact O-CA 3.38Å; N484-S521 PolarHBondContact O-N 3.35Å
485	L	68.4	Low	65.6	Low	20 Å²	20	66 Å²	66	11%	0.105	37%	0.374	C	S	.	.			trans	-84.9	81.9	172.7	-66.8	171.5	0	0	0	109.7	P482 Y487 F524 Q588 L589 N592	P482-L485 WeakPolarHBondContact O-CB 3.44Å; P482-L485 PolarHBondContact O-N 3.35Å; L485-Y487 PolarHBondContact O-N 3.43Å; L485-Y487 VanDerWaalsContact O-N 3.12Å; L485-F524 HydrophobicContact CD1-CD2 4.41Å; L485-F524 HydrophobicContact CD1-CE1 4.31Å; L485-F524 HydrophobicContact CD1-CE2 4Å; L485-F524 HydrophobicContact CD1-CZ 3.95Å; L485-F524 HydrophobicContact CD2-CB 4.07Å; L485-F524 HydrophobicContact CD2-CD1 3.55Å; L485-F524 HydrophobicContact CD2-CD2 3.96Å; L485-F524 HydrophobicContact CD2-CE1 3.93Å; L485-F524 HydrophobicContact CD2-CE2 4.28Å; L485-F524 HydrophobicContact CD2-CG 3.57Å; L485-F524 HydrophobicContact CD2-CZ 4.27Å; L485-F524 HydrophobicContact CG-CD1 4.29Å; L485-F524 HydrophobicContact CG-CD2 3.86Å; L485-F524 HydrophobicContact CG-CE1 4.4Å; L485-F524 HydrophobicContact CG-CE2 3.96Å; L485-F524 HydrophobicContact CG-CG 4.03Å; L485-F524 HydrophobicContact CG-CZ 4.24Å; L485-Q588 HydrophobicContact CD1-CB 4.2Å; L485-L589 HydrophobicContact CD1-CD2 4.2Å; L485-L589 HydrophobicContact CD2-CD2 3.6Å; L485-N592 HydrophobicContact CD1-CB 4.31Å
486	I	56.5	Low	63.6	Low	93 Å²	93	65.7 Å²	65.7	48%	0.477	38%	0.378	S	S	.	.			trans	-85.4	69.9	161.3	-60.7	167.6	0	0	0	106.7	N484 G488 G517	N484-I486 PolarHBondContact O-N 2.9Å; I486-G488 PolarHBondContact O-N 3.48Å; I486-G517 VanDerWaalsContact CD1-CA 3.42Å
487	Y	51.1	Low	61.3	Low	45 Å²	45	67.4 Å²	67.4	18%	0.176	39%	0.392	C	S	.	.			trans	-84.8	74.6	175	-157.6	-81.3	0	0	0	108.8	L485 F525 C593 R597 V637 T640 M641	L485-Y487 PolarHBondContact O-N 3.43Å; L485-Y487 VanDerWaalsContact O-N 3.12Å; Y487-F525 HydrophobicContact CD2-CZ 4.42Å; Y487-F525 HydrophobicContact CE2-CZ 4.31Å; Y487-C593 WeakPolarHBondContact CB-SG 3.48Å; Y487-C593 HydrophobicContact CD1-CB 3.96Å; Y487-C593 HydrophobicContact CD2-CB 4.18Å; Y487-C593 HydrophobicContact CE1-CB 4.47Å; Y487-C593 HydrophobicContact CG-CB 3.77Å; Y487-R597 PolarHBondContact O-NH2 3.4Å; Y487-V637 HydrophobicContact CE1-CG1 4.23Å; Y487-V637 PolarHBondContact OH-O 3.38Å; Y487-T640 WeakPolarHBondContact OH-CB 3.28Å; Y487-M641 HydrophobicContact CD2-CE 4.23Å; Y487-M641 HydrophobicContact CE1-CE 4.45Å; Y487-M641 HydrophobicContact CE2-CE 3.73Å; Y487-M641 HydrophobicContact CE2-CG 4.35Å
488	G	48.6	Very low	59.2	Low	32 Å²	32	63.9 Å²	63.9	33%	0.33	39%	0.387	S	S	.	.			trans	-95.5	128.2	168.7	0	0	0	0	0	109.9	I486 D492	I486-G488 PolarHBondContact O-N 3.48Å; G488-D492 VanDerWaalsContact CA-OD2 3.3Å; G488-D492 WeakPolarHBondContact CA-OD2 3.34Å
489	S	42.8	Very low	57.4	Low	54 Å²	54	65.2 Å²	65.2	38%	0.378	40%	0.396	S	S	.	.			trans	-51.6	162.1	163.8	165.4	0	0	0	0	109.3	A491 D492 A493	S489-A491 CarbonylContact O-C 3.52Å; S489-A491 PolarHBondContact O-N 2.9Å; S489-A491 PolarHBondContact OG-N 3.44Å; S489-A491 VanDerWaalsContact OG-N 3.1Å; S489-D492 PolarHBondContact N-OD2 3.23Å; S489-D492 CarbonylContact O-C 3.55Å; S489-D492 WeakPolarHBondContact O-CA 3.24Å; S489-D492 PolarHBondContact O-N 3.06Å; S489-A493 PolarHBondContact O-N 2.81Å
490	L	41.6	Very low	55.4	Low	130 Å²	130	64.3 Å²	64.3	68%	0.681	40%	0.397	S	S	*	.	H	α-helix	trans	-47.6	-28.9	164.8	-157.2	86	0	0	0	110.9	A493 Y494	L490-A493 CarbonylContact O-C 3.27Å; L490-Y494 HydrophobicContact CD2-CD2 4Å; L490-Y494 HydrophobicContact CD2-CE2 3.72Å; L490-Y494 HydrophobicContact CG-CD2 3.89Å; L490-Y494 HydrophobicContact CG-CE2 4Å; L490-Y494 WeakPolarHBondContact O-CA 3.46Å; L490-Y494 WeakPolarHBondContact O-CB 3.31Å; L490-Y494 WeakPolarHBondContact O-CD2 3.16Å; L490-Y494 PolarHBondContact O-N 2.89Å
491	A	43.3	Very low	53.4	Low	64 Å²	64	72.1 Å²	72.1	53%	0.529	43%	0.427	S	S	.	.	H	α-helix	trans	-68.2	-38.7	172.4	0	0	0	0	0	114.5	S489 Y494 S495	S489-A491 CarbonylContact O-C 3.52Å; S489-A491 PolarHBondContact O-N 2.9Å; S489-A491 PolarHBondContact OG-N 3.44Å; S489-A491 VanDerWaalsContact OG-N 3.1Å; A491-Y494 CarbonylContact O-C 3.58Å; A491-Y494 PolarHBondContact O-N 3.5Å; A491-S495 VanDerWaalsContact O-CB 3.29Å; A491-S495 WeakPolarHBondContact O-CB 3.36Å; A491-S495 PolarHBondContact O-N 3.34Å
492	D	47.1	Very low	51.9	Low	71 Å²	71	69 Å²	69	38%	0.38	42%	0.423	S	S	.	.	H	α-helix	trans	-76.5	-34.3	173.4	-63.1	-46.5	0	0	0	110.6	G488 S489 Y494 S495 T496 R597	G488-D492 VanDerWaalsContact CA-OD2 3.3Å; G488-D492 WeakPolarHBondContact CA-OD2 3.34Å; S489-D492 PolarHBondContact N-OD2 3.23Å; S489-D492 CarbonylContact O-C 3.55Å; S489-D492 WeakPolarHBondContact O-CA 3.24Å; S489-D492 PolarHBondContact O-N 3.06Å; D492-Y494 VanDerWaalsContact C-N 3.32Å; D492-S495 PolarHBondContact O-N 2.89Å; D492-T496 WeakPolarHBondContact O-CA 3.21Å; D492-T496 WeakPolarHBondContact O-CB 3.07Å; D492-T496 PolarHBondContact O-N 3.17Å; D492-T496 PolarHBondContact O-OG1 3.43Å; D492-R597 IonicContact OD2-NH2 2.78Å; D492-R597 PolarHBondContact OD2-NH2 2.81Å
493	A	44.5	Very low	51	Low	46 Å²	46	67.7 Å²	67.7	38%	0.38	42%	0.415	S	S	.	.	H	α-helix	trans	-65.3	-37.3	169.9	0	0	0	0	0	110.4	S489 L490 A497	S489-A493 PolarHBondContact O-N 2.81Å; L490-A493 CarbonylContact O-C 3.27Å; A493-A497 WeakPolarHBondContact O-CA 3.45Å; A493-A497 WeakPolarHBondContact O-CB 3.47Å; A493-A497 PolarHBondContact O-N 3.14Å
494	Y	45.1	Very low	50.2	Low	163 Å²	163	66.4 Å²	66.4	64%	0.639	40%	0.399	S	S	*	.	H	α-helix	trans	-71.3	-38.2	171.5	-100.6	-75.4	0	0	0	111.3	L490 A491 D492 A497 A498	L490-Y494 HydrophobicContact CD2-CD2 4Å; L490-Y494 HydrophobicContact CD2-CE2 3.72Å; L490-Y494 HydrophobicContact CG-CD2 3.89Å; L490-Y494 HydrophobicContact CG-CE2 4Å; L490-Y494 WeakPolarHBondContact O-CA 3.46Å; L490-Y494 WeakPolarHBondContact O-CB 3.31Å; L490-Y494 WeakPolarHBondContact O-CD2 3.16Å; L490-Y494 PolarHBondContact O-N 2.89Å; A491-Y494 CarbonylContact O-C 3.58Å; A491-Y494 PolarHBondContact O-N 3.5Å; D492-Y494 VanDerWaalsContact C-N 3.32Å; Y494-A497 PolarHBondContact O-N 2.99Å; Y494-A498 WeakPolarHBondContact O-CA 2.95Å; Y494-A498 WeakPolarHBondContact O-CB 3.48Å; Y494-A498 PolarHBondContact O-N 3.13Å
495	S	50.4	Low	49.6	Very low	76 Å²	76	70.4 Å²	70.4	53%	0.531	43%	0.425	S	S	.	.	H	α-helix	trans	-66.6	-43.1	175.2	-176.4	0	0	0	0	110.5	A491 D492 A498 A499	A491-S495 VanDerWaalsContact O-CB 3.29Å; A491-S495 WeakPolarHBondContact O-CB 3.36Å; A491-S495 PolarHBondContact O-N 3.34Å; D492-S495 PolarHBondContact O-N 2.89Å; S495-A498 PolarHBondContact O-N 3.39Å; S495-A499 WeakPolarHBondContact O-CB 3.46Å; S495-A499 PolarHBondContact O-N 2.78Å
496	T	50.6	Low	48.9	Very low	73 Å²	73	77.4 Å²	77.4	45%	0.448	46%	0.457	S	S	.	.	H	α-helix	trans	-68.3	-41.2	174.8	-55	0	0	0	0	110.7	D492 A499 A500	D492-T496 WeakPolarHBondContact O-CA 3.21Å; D492-T496 WeakPolarHBondContact O-CB 3.07Å; D492-T496 PolarHBondContact O-N 3.17Å; D492-T496 PolarHBondContact O-OG1 3.43Å; T496-A499 PolarHBondContact O-N 3.34Å; T496-A500 WeakPolarHBondContact O-CB 3.32Å; T496-A500 PolarHBondContact O-N 3.48Å
497	A	44.2	Very low	48.9	Very low	36 Å²	36	80.6 Å²	80.6	30%	0.298	47%	0.47	S	S	.	.	H	α-helix	trans	-69.1	-35.5	175.4	0	0	0	0	0	111.3	A493 Y494 A500 Y501	A493-A497 WeakPolarHBondContact O-CA 3.45Å; A493-A497 WeakPolarHBondContact O-CB 3.47Å; A493-A497 PolarHBondContact O-N 3.14Å; Y494-A497 PolarHBondContact O-N 2.99Å; A497-A500 PolarHBondContact O-N 3.36Å; A497-Y501 VanDerWaalsContact O-CB 3.26Å; A497-Y501 WeakPolarHBondContact O-CB 3.28Å; A497-Y501 PolarHBondContact O-N 3.44Å
498	A	49.1	Very low	48.6	Very low	58 Å²	58	81.5 Å²	81.5	48%	0.479	49%	0.493	S	S	.	.	H	α-helix	trans	-70.1	-41.8	174.3	0	0	0	0	0	110.7	Y494 S495 Y501 A502	Y494-A498 WeakPolarHBondContact O-CA 2.95Å; Y494-A498 WeakPolarHBondContact O-CB 3.48Å; Y494-A498 PolarHBondContact O-N 3.13Å; S495-A498 PolarHBondContact O-N 3.39Å; A498-Y501 PolarHBondContact O-N 2.96Å; A498-A502 VanDerWaalsContact O-CB 3.29Å; A498-A502 WeakPolarHBondContact O-CB 3.43Å; A498-A502 PolarHBondContact O-N 3.41Å
499	A	51.8	Low	48.1	Very low	59 Å²	59	87.6 Å²	87.6	49%	0.488	51%	0.511	S	S	.	.	H	α-helix	trans	-64.8	-40.4	172.3	0	0	0	0	0	111.3	S495 T496 A502 S503	S495-A499 WeakPolarHBondContact O-CB 3.46Å; S495-A499 PolarHBondContact O-N 2.78Å; T496-A499 PolarHBondContact O-N 3.34Å; A499-A502 PolarHBondContact O-N 3.13Å; A499-S503 WeakPolarHBondContact O-CB 3.27Å; A499-S503 PolarHBondContact O-N 2.86Å
500	A	47	Very low	48	Very low	21 Å²	21	91.8 Å²	91.8	17%	0.174	53%	0.527	C	S	.	.	H	α-helix	trans	-65.8	-44.8	174.2	0	0	0	0	0	111	T496 A497 A502 S503 V504	T496-A500 WeakPolarHBondContact O-CB 3.32Å; T496-A500 PolarHBondContact O-N 3.48Å; A497-A500 PolarHBondContact O-N 3.36Å; A500-A502 PolarHBondContact O-N 3.49Å; A500-S503 CarbonylContact O-C 3.57Å; A500-S503 PolarHBondContact O-N 2.95Å; A500-S503 VanDerWaalsContact O-N 3.15Å; A500-S503 PolarHBondContact O-OG 3.36Å; A500-V504 VanDerWaalsContact O-CG2 3.26Å; A500-V504 WeakPolarHBondContact O-CG2 3.35Å; A500-V504 PolarHBondContact O-N 3.06Å
501	Y	46.7	Very low	48	Very low	174 Å²	174	88.8 Å²	88.8	68%	0.682	52%	0.517	S	S	*	.	H	α-helix	trans	-60.8	-43.4	174	-109.3	-85.3	0	0	0	111.4	A497 A498 S503 V504 V505	A497-Y501 VanDerWaalsContact O-CB 3.26Å; A497-Y501 WeakPolarHBondContact O-CB 3.28Å; A497-Y501 PolarHBondContact O-N 3.44Å; A498-Y501 PolarHBondContact O-N 2.96Å; Y501-S503 VanDerWaalsContact C-N 3.3Å; Y501-S503 PolarHBondContact O-N 3.44Å; Y501-V504 PolarHBondContact O-N 3.29Å; Y501-V505 VanDerWaalsContact O-CG2 3.3Å; Y501-V505 WeakPolarHBondContact O-CG2 3.45Å; Y501-V505 PolarHBondContact O-N 3.29Å
502	A	53.2	Low	47.8	Very low	53 Å²	53	90.2 Å²	90.2	44%	0.438	52%	0.52	S	S	.	.	H	α-helix	trans	-61	-40.7	174.4	0	0	0	0	0	111.3	A498 A499 A500 V505 Q506	A498-A502 VanDerWaalsContact O-CB 3.29Å; A498-A502 WeakPolarHBondContact O-CB 3.43Å; A498-A502 PolarHBondContact O-N 3.41Å; A499-A502 PolarHBondContact O-N 3.13Å; A500-A502 PolarHBondContact O-N 3.49Å; A502-V505 PolarHBondContact O-N 3.27Å; A502-Q506 PolarHBondContact O-N 2.87Å
503	S	51.4	Low	47.5	Very low	36 Å²	36	88.9 Å²	88.9	25%	0.252	52%	0.523	S	S	.	.	H	α-helix	trans	-69.2	-32.5	175	81.4	0	0	0	0	113.3	A499 A500 Y501 Q506 Q507	A499-S503 WeakPolarHBondContact O-CB 3.27Å; A499-S503 PolarHBondContact O-N 2.86Å; A500-S503 CarbonylContact O-C 3.57Å; A500-S503 PolarHBondContact O-N 2.95Å; A500-S503 VanDerWaalsContact O-N 3.15Å; A500-S503 PolarHBondContact O-OG 3.36Å; Y501-S503 VanDerWaalsContact C-N 3.3Å; Y501-S503 PolarHBondContact O-N 3.44Å; S503-Q506 PolarHBondContact O-N 2.93Å; S503-Q507 WeakPolarHBondContact O-CA 3.45Å; S503-Q507 WeakPolarHBondContact O-CB 3.4Å; S503-Q507 PolarHBondContact O-N 3.26Å
504	V	51.6	Low	47.3	Very low	53 Å²	53	89.4 Å²	89.4	32%	0.321	53%	0.527	S	S	.	.	H	α-helix	trans	-67.8	-44.1	174	168.6	0	0	0	0	109.9	A500 Y501 Q506 G508 K509	A500-V504 VanDerWaalsContact O-CG2 3.26Å; A500-V504 WeakPolarHBondContact O-CG2 3.35Å; A500-V504 PolarHBondContact O-N 3.06Å; Y501-V504 PolarHBondContact O-N 3.29Å; V504-Q506 VanDerWaalsContact C-N 3.28Å; V504-Q506 PolarHBondContact O-N 2.67Å; V504-G508 WeakPolarHBondContact O-CA 3.21Å; V504-G508 PolarHBondContact O-N 3.36Å; V504-K509 VanDerWaalsContact CG2-O 3.25Å; V504-K509 WeakPolarHBondContact CG2-O 3.48Å
505	V	56.2	Low	47.1	Very low	121 Å²	121	87.8 Å²	87.8	73%	0.733	53%	0.528	S	S	*	.	H	α-helix	trans	-63.6	-34.3	176.8	172.5	0	0	0	0	111.4	Y501 A502	Y501-V505 VanDerWaalsContact O-CG2 3.3Å; Y501-V505 WeakPolarHBondContact O-CG2 3.45Å; Y501-V505 PolarHBondContact O-N 3.29Å; A502-V505 PolarHBondContact O-N 3.27Å
506	Q	54.7	Low	46.8	Very low	168 Å²	168	87.8 Å²	87.8	79%	0.785	52%	0.522	S	S	*	.	H	α-helix	trans	-90.9	-33	-179.7	-75.3	-168.5	-20.6	0	0	115.5	A502 S503 V504	A502-Q506 PolarHBondContact O-N 2.87Å; S503-Q506 PolarHBondContact O-N 2.93Å; V504-Q506 VanDerWaalsContact C-N 3.28Å; V504-Q506 PolarHBondContact O-N 2.67Å
507	Q	56.9	Low	46.9	Very low	159 Å²	159	84.4 Å²	84.4	74%	0.743	50%	0.502	S	S	*	.	H	α-helix	trans	-129.6	2.2	-169.8	-69.5	-171.2	-5.5	0	0	114.9	S503 K509	S503-Q507 WeakPolarHBondContact O-CA 3.45Å; S503-Q507 WeakPolarHBondContact O-CB 3.4Å; S503-Q507 PolarHBondContact O-N 3.26Å; Q507-K509 PolarHBondContact O-N 2.99Å
508	G	44.9	Very low	47.6	Very low	65 Å²	65	84.9 Å²	84.9	67%	0.67	51%	0.51	S	S	*	.			trans	64	14.4	171.2	0	0	0	0	0	115.6	V504	V504-G508 WeakPolarHBondContact O-CA 3.21Å; V504-G508 PolarHBondContact O-N 3.36Å
509	K	36.6	Very low	48.4	Very low	160 Å²	160	86.3 Å²	86.3	70%	0.696	51%	0.509	S	S	*	.			trans	-106.6	124.2	175.6	-86.8	-176.7	175.3	178.3	0	110.9	V504 Q507 S511	V504-K509 VanDerWaalsContact CG2-O 3.25Å; V504-K509 WeakPolarHBondContact CG2-O 3.48Å; Q507-K509 PolarHBondContact O-N 2.99Å; K509-S511 PolarHBondContact O-N 3.49Å
510	I	40.5	Very low	49.4	Very low	141 Å²	141	86.8 Å²	86.8	72%	0.723	50%	0.5	S	S	*	.			trans	-71.4	108.9	170.2	-58.8	171.5	0	0	0	107.6	T512	I510-T512 HydrophobicContact CG2-CG2 4.33Å; I510-T512 PolarHBondContact O-N 3.46Å; I510-T512 VanDerWaalsContact O-N 3.14Å
511	S	41.8	Very low	50.9	Low	67 Å²	67	86.5 Å²	86.5	47%	0.469	50%	0.497	S	S	.	.			trans	-76.4	96.1	169.9	-70.2	0	0	0	0	108.6	K509 G513	K509-S511 PolarHBondContact O-N 3.49Å; S511-G513 PolarHBondContact O-N 2.88Å
512	T	39.9	Very low	52.5	Low	95 Å²	95	82.5 Å²	82.5	58%	0.583	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-1.7	175	49.7	0	0	0	0	113.8	I510 A514 I515 D516	I510-T512 HydrophobicContact CG2-CG2 4.33Å; I510-T512 PolarHBondContact O-N 3.46Å; I510-T512 VanDerWaalsContact O-N 3.14Å; T512-A514 VanDerWaalsContact C-N 3.26Å; T512-A514 PolarHBondContact O-N 3.23Å; T512-I515 PolarHBondContact O-N 3.33Å; T512-D516 PolarHBondContact O-N 3.43Å
513	G	40.1	Very low	54	Low	43 Å²	43	82.3 Å²	82.3	44%	0.443	47%	0.472	S	S	.	.	H	α-helix	trans	-61.8	-22.4	-175.1	0	0	0	0	0	115.8	S511 G517	S511-G513 PolarHBondContact O-N 2.88Å; G513-G517 PolarHBondContact O-N 2.95Å
514	A	40.2	Very low	55.8	Low	57 Å²	57	80.6 Å²	80.6	47%	0.471	46%	0.46	S	S	.	.	H	α-helix	trans	-73.1	-38	176.4	0	0	0	0	0	112.5	T512 G518	T512-A514 VanDerWaalsContact C-N 3.26Å; T512-A514 PolarHBondContact O-N 3.23Å; A514-G518 PolarHBondContact O-N 3.06Å
515	I	42	Very low	57.6	Low	128 Å²	128	78.4 Å²	78.4	66%	0.656	45%	0.447	S	S	*	.	H	α-helix	trans	-69.4	-47.4	174	-60.3	173	0	0	0	108.9	T512 G517 G518 D519	T512-I515 PolarHBondContact O-N 3.33Å; I515-G517 PolarHBondContact O-N 3.3Å; I515-G518 PolarHBondContact O-N 3.21Å; I515-G518 VanDerWaalsContact O-N 3.17Å; I515-D519 PolarHBondContact O-N 2.84Å
516	D	43.6	Very low	59.3	Low	77 Å²	77	73 Å²	73	41%	0.412	41%	0.414	S	S	.	.	H	α-helix	trans	-63.5	-24.2	-179.4	-156.8	37	0	0	0	112.6	T512 K520	T512-D516 PolarHBondContact O-N 3.43Å; D516-K520 WeakPolarHBondContact O-CD 3.47Å; D516-K520 VanDerWaalsContact O-CG 3.25Å; D516-K520 WeakPolarHBondContact O-CG 3.18Å; D516-K520 PolarHBondContact O-N 3.49Å; D516-K520 IonicContact OD1-NZ 2.69Å; D516-K520 WeakPolarHBondContact OD2-CE 3.18Å; D516-K520 IonicContact OD2-NZ 3.75Å; D516-K520 PolarHBondContact OD2-NZ 3.48Å
517	G	51.7	Low	61.1	Low	2 Å²	2	65 Å²	65	2%	0.021	38%	0.377	C	S	.	.	H	α-helix	trans	-77.9	-35.3	176.2	0	0	0	0	0	114.4	I486 G513 I515 S521	I486-G517 VanDerWaalsContact CD1-CA 3.42Å; G513-G517 PolarHBondContact O-N 2.95Å; I515-G517 PolarHBondContact O-N 3.3Å; G517-S521 PolarHBondContact O-N 2.87Å
518	G	60.2	Low	62.8	Low	45 Å²	45	57.5 Å²	57.5	46%	0.464	34%	0.341	S	S	.	.	H	α-helix	trans	-63.5	-45.6	174.3	0	0	0	0	0	111.6	A514 I515 S521 R522	A514-G518 PolarHBondContact O-N 3.06Å; I515-G518 PolarHBondContact O-N 3.21Å; I515-G518 VanDerWaalsContact O-N 3.17Å; G518-S521 PolarHBondContact O-N 3.31Å; G518-R522 PolarHBondContact O-N 2.84Å
519	D	66.6	Low	65.2	Low	88 Å²	88	54.5 Å²	54.5	47%	0.471	31%	0.31	S	S	.	.	H	α-helix	trans	-63.6	-45	178.2	-74.5	-18.9	0	0	0	111.8	I515 S521 R522 D523	I515-D519 PolarHBondContact O-N 2.84Å; D519-S521 VanDerWaalsContact C-N 3.33Å; D519-S521 PolarHBondContact O-N 3.15Å; D519-R522 WeakPolarHBondContact O-CB 3.32Å; D519-R522 PolarHBondContact O-N 2.9Å; D519-R522 VanDerWaalsContact O-N 3.16Å; D519-D523 VanDerWaalsContact O-CG 3.24Å; D519-D523 PolarHBondContact O-N 3.29Å
520	K	72.5	Confident	68	Low	70 Å²	70	46.9 Å²	46.9	30%	0.304	28%	0.277	S	S	.	.	H	α-helix	trans	-63.8	-35.5	176.8	-73.1	172.2	-166.9	164.6	0	113.6	N484 D516 D523 F524	N484-K520 HydrophobicContact CB-CB 4.35Å; N484-K520 CarbonylContact O-C 3.58Å; N484-K520 VanDerWaalsContact O-C 3.27Å; D516-K520 WeakPolarHBondContact O-CD 3.47Å; D516-K520 VanDerWaalsContact O-CG 3.25Å; D516-K520 WeakPolarHBondContact O-CG 3.18Å; D516-K520 PolarHBondContact O-N 3.49Å; D516-K520 IonicContact OD1-NZ 2.69Å; D516-K520 WeakPolarHBondContact OD2-CE 3.18Å; D516-K520 IonicContact OD2-NZ 3.75Å; D516-K520 PolarHBondContact OD2-NZ 3.48Å; K520-D523 WeakPolarHBondContact O-CB 3.42Å; K520-D523 PolarHBondContact O-N 2.91Å; K520-F524 PolarHBondContact O-N 3.01Å; K520-F524 VanDerWaalsContact O-N 3.12Å
521	S	77.1	Confident	70.6	Confident	14 Å²	14	40.1 Å²	40.1	10%	0.098	24%	0.242	C	C	.	.	H	α-helix	trans	-68.1	-41.5	175	-172	0	0	0	0	110.7	N484 G517 G518 D519 D523 F524 F525	N484-S521 WeakPolarHBondContact O-CA 3.38Å; N484-S521 PolarHBondContact O-N 3.35Å; G517-S521 PolarHBondContact O-N 2.87Å; G518-S521 PolarHBondContact O-N 3.31Å; D519-S521 VanDerWaalsContact C-N 3.33Å; D519-S521 PolarHBondContact O-N 3.15Å; S521-D523 VanDerWaalsContact C-N 3.32Å; S521-F524 WeakPolarHBondContact O-CB 3.47Å; S521-F524 PolarHBondContact O-N 3.13Å; S521-F525 WeakPolarHBondContact O-CD2 3.44Å; S521-F525 PolarHBondContact O-N 3.09Å
522	R	81	Confident	73.2	Confident	90 Å²	90	38.7 Å²	38.7	34%	0.34	23%	0.229	S	C	.	.	H	α-helix	trans	-60.7	-42.9	174	-174.3	-178.9	175.5	-171.7	-0.8	110.9	E426 G518 D519 F524 F525 V526	E426-R522 PolarHBondContact O-NH2 3.39Å; G518-R522 PolarHBondContact O-N 2.84Å; D519-R522 WeakPolarHBondContact O-CB 3.32Å; D519-R522 PolarHBondContact O-N 2.9Å; D519-R522 VanDerWaalsContact O-N 3.16Å; R522-F524 VanDerWaalsContact C-N 3.26Å; R522-F524 PolarHBondContact O-N 3.11Å; R522-F525 PolarHBondContact O-N 3.09Å; R522-F525 VanDerWaalsContact O-N 3.17Å; R522-V526 HydrophobicContact CG-CG2 4.36Å; R522-V526 WeakPolarHBondContact O-CG2 3.4Å; R522-V526 PolarHBondContact O-N 3Å
523	D	84.6	Confident	75.8	Confident	49 Å²	49	35 Å²	35	26%	0.262	21%	0.209	S	C	.	.	H	α-helix	trans	-56.6	-40.3	176	-70.4	-4.3	0	0	0	112.2	R424 D519 K520 S521 T527	R424-D523 IonicContact CZ-OD1 3.31Å; R424-D523 IonicContact NH1-OD1 3.18Å; R424-D523 PolarHBondContact NH1-OD1 2.95Å; R424-D523 IonicContact NH2-OD1 2.74Å; R424-D523 PolarHBondContact NH2-OD1 3.02Å; D519-D523 VanDerWaalsContact O-CG 3.24Å; D519-D523 PolarHBondContact O-N 3.29Å; K520-D523 WeakPolarHBondContact O-CB 3.42Å; K520-D523 PolarHBondContact O-N 2.91Å; S521-D523 VanDerWaalsContact C-N 3.32Å; D523-T527 VanDerWaalsContact O-CB 3.25Å; D523-T527 WeakPolarHBondContact O-CB 3.42Å; D523-T527 PolarHBondContact O-N 2.64Å; D523-T527 PolarHBondContact O-OG1 2.89Å
524	F	89.4	Confident	78.5	Confident	0 Å²	0	33 Å²	33	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-62.8	-47.5	177.4	-172.7	-77.8	0	0	0	111.6	L480 L485 K520 S521 R522 T527 L528 Q588 L589	L480-F524 HydrophobicContact CB-CE2 4.16Å; L480-F524 HydrophobicContact CD2-CD1 4.21Å; L480-F524 HydrophobicContact CD2-CD2 4Å; L480-F524 HydrophobicContact CD2-CE1 4.06Å; L480-F524 HydrophobicContact CD2-CE2 3.86Å; L480-F524 HydrophobicContact CD2-CG 4.18Å; L480-F524 HydrophobicContact CD2-CZ 3.88Å; L485-F524 HydrophobicContact CD1-CD2 4.41Å; L485-F524 HydrophobicContact CD1-CE1 4.31Å; L485-F524 HydrophobicContact CD1-CE2 4Å; L485-F524 HydrophobicContact CD1-CZ 3.95Å; L485-F524 HydrophobicContact CD2-CB 4.07Å; L485-F524 HydrophobicContact CD2-CD1 3.55Å; L485-F524 HydrophobicContact CD2-CD2 3.96Å; L485-F524 HydrophobicContact CD2-CE1 3.93Å; L485-F524 HydrophobicContact CD2-CE2 4.28Å; L485-F524 HydrophobicContact CD2-CG 3.57Å; L485-F524 HydrophobicContact CD2-CZ 4.27Å; L485-F524 HydrophobicContact CG-CD1 4.29Å; L485-F524 HydrophobicContact CG-CD2 3.86Å; L485-F524 HydrophobicContact CG-CE1 4.4Å; L485-F524 HydrophobicContact CG-CE2 3.96Å; L485-F524 HydrophobicContact CG-CG 4.03Å; L485-F524 HydrophobicContact CG-CZ 4.24Å; K520-F524 PolarHBondContact O-N 3.01Å; K520-F524 VanDerWaalsContact O-N 3.12Å; S521-F524 WeakPolarHBondContact O-CB 3.47Å; S521-F524 PolarHBondContact O-N 3.13Å; R522-F524 VanDerWaalsContact C-N 3.26Å; R522-F524 PolarHBondContact O-N 3.11Å; F524-T527 PolarHBondContact O-N 3.4Å; F524-L528 HydrophobicContact CE1-CD2 4.34Å; F524-L528 WeakPolarHBondContact O-CB 3.47Å; F524-L528 PolarHBondContact O-N 3.4Å; F524-Q588 HydrophobicContact CZ-CB 4.18Å; F524-L589 HydrophobicContact CD1-CD2 4.06Å; F524-L589 HydrophobicContact CE1-CD1 4.31Å; F524-L589 HydrophobicContact CE1-CD2 3.7Å; F524-L589 HydrophobicContact CE1-CG 3.78Å
525	F	89.6	Confident	81.1	Confident	8 Å²	8	31 Å²	31	4%	0.035	17%	0.17	C	C	.	.	H	α-helix	trans	-64.6	-45.4	-180	-73.8	-71.7	0	0	0	111.9	Y487 S521 R522 L528 N529 L589 M641 Q644 L645	Y487-F525 HydrophobicContact CD2-CZ 4.42Å; Y487-F525 HydrophobicContact CE2-CZ 4.31Å; S521-F525 WeakPolarHBondContact O-CD2 3.44Å; S521-F525 PolarHBondContact O-N 3.09Å; R522-F525 PolarHBondContact O-N 3.09Å; R522-F525 VanDerWaalsContact O-N 3.17Å; F525-L528 PolarHBondContact O-N 3.09Å; F525-N529 PolarHBondContact O-N 3.32Å; F525-N529 PolarHBondContact O-ND2 3.36Å; F525-L589 HydrophobicContact CE1-CD1 4.01Å; F525-L589 HydrophobicContact CE1-CD2 3.81Å; F525-L589 HydrophobicContact CZ-CD2 3.95Å; F525-M641 HydrophobicContact CE1-CG 4.27Å; F525-M641 HydrophobicContact CZ-CG 4.29Å; F525-Q644 HydrophobicContact CB-CB 4.06Å; F525-Q644 HydrophobicContact CD1-CB 3.84Å; F525-Q644 HydrophobicContact CD2-CB 4.26Å; F525-Q644 HydrophobicContact CD2-CG 4.49Å; F525-Q644 HydrophobicContact CE1-CB 4.37Å; F525-Q644 HydrophobicContact CG-CB 3.81Å; F525-L645 HydrophobicContact CD1-CD2 3.79Å; F525-L645 HydrophobicContact CD1-CG 4.11Å; F525-L645 HydrophobicContact CE1-CD2 4.32Å; F525-L645 HydrophobicContact CE1-CG 4.35Å
526	V	90.8	Very high	83.6	Confident	8 Å²	8	30.4 Å²	30.4	5%	0.048	17%	0.165	C	C	.	.	H	α-helix	trans	-60.6	-48	176.6	174.9	0	0	0	0	110.6	R522 L528 N529 D530	R522-V526 HydrophobicContact CG-CG2 4.36Å; R522-V526 WeakPolarHBondContact O-CG2 3.4Å; R522-V526 PolarHBondContact O-N 3Å; V526-L528 PolarHBondContact O-N 3.27Å; V526-N529 CarbonylContact O-C 3.59Å; V526-N529 WeakPolarHBondContact O-CB 3.45Å; V526-N529 PolarHBondContact O-N 3.31Å; V526-N529 VanDerWaalsContact O-N 3.12Å; V526-D530 PolarHBondContact O-N 3.48Å
527	T	92.5	Very high	86	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-60	-36.8	178.2	-57.2	0	0	0	0	111.9	L476 R479 L480 D523 F524 D530 C531	L476-T527 HydrophobicContact CB-CG2 4.08Å; L476-T527 HydrophobicContact CD2-CG2 3.98Å; L476-T527 WeakPolarHBondContact O-CG2 3.47Å; R479-T527 HydrophobicContact CB-CG2 3.81Å; L480-T527 HydrophobicContact CD1-CG2 4.32Å; L480-T527 HydrophobicContact CD2-CG2 3.94Å; L480-T527 HydrophobicContact CG-CG2 3.75Å; D523-T527 VanDerWaalsContact O-CB 3.25Å; D523-T527 WeakPolarHBondContact O-CB 3.42Å; D523-T527 PolarHBondContact O-N 2.64Å; D523-T527 PolarHBondContact O-OG1 2.89Å; F524-T527 PolarHBondContact O-N 3.4Å; T527-D530 WeakPolarHBondContact O-CB 3.22Å; T527-D530 PolarHBondContact O-N 3.16Å; T527-C531 PolarHBondContact O-N 3.37Å; T527-C531 PolarHBondContact O-SG 2.76Å
528	L	94	Very high	88.1	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-68.1	-42.4	177.8	-169.4	60	0	0	0	111.1	L480 F524 F525 V526 D530 C531 N532 V586 L589 L645 L649	L480-L528 HydrophobicContact CD1-CD1 4.31Å; L480-L528 HydrophobicContact CD2-CB 4.07Å; L480-L528 HydrophobicContact CD2-CD1 4.36Å; F524-L528 HydrophobicContact CE1-CD2 4.34Å; F524-L528 WeakPolarHBondContact O-CB 3.47Å; F524-L528 PolarHBondContact O-N 3.4Å; F525-L528 PolarHBondContact O-N 3.09Å; V526-L528 PolarHBondContact O-N 3.27Å; L528-D530 VanDerWaalsContact C-N 3.33Å; L528-C531 WeakPolarHBondContact O-CB 3.45Å; L528-C531 PolarHBondContact O-N 3.32Å; L528-N532 PolarHBondContact O-N 2.98Å; L528-V586 HydrophobicContact CD2-CG2 4.1Å; L528-L589 HydrophobicContact CD2-CD1 3.7Å; L528-L645 HydrophobicContact CD2-CD2 3.92Å; L528-L649 HydrophobicContact CG-CD1 3.92Å; L528-L649 HydrophobicContact CG-CD2 4.27Å; L528-L649 WeakPolarHBondContact O-CD1 3.32Å
529	N	94.7	Very high	89.7	Confident	2 Å²	2	27.9 Å²	27.9	1%	0.011	14%	0.139	C	C	.	.	H	α-helix	trans	-62.6	-39.4	172.2	-68.3	-36.3	0	0	0	112	L429 F525 V526 C531 N532 A533 Q644 S646 L649	L429-N529 HydrophobicContact CB-CB 4.47Å; L429-N529 WeakPolarHBondContact O-CB 2.92Å; L429-N529 PolarHBondContact O-ND2 3.16Å; F525-N529 PolarHBondContact O-N 3.32Å; F525-N529 PolarHBondContact O-ND2 3.36Å; V526-N529 CarbonylContact O-C 3.59Å; V526-N529 WeakPolarHBondContact O-CB 3.45Å; V526-N529 PolarHBondContact O-N 3.31Å; V526-N529 VanDerWaalsContact O-N 3.12Å; N529-C531 VanDerWaalsContact C-N 3.28Å; N529-C531 PolarHBondContact O-N 2.92Å; N529-N532 WeakPolarHBondContact O-CA 3.21Å; N529-N532 WeakPolarHBondContact O-CB 3.32Å; N529-N532 PolarHBondContact O-N 2.95Å; N529-A533 PolarHBondContact O-N 3.11Å; N529-Q644 PolarHBondContact ND2-O 2.86Å; N529-S646 PolarHBondContact OD1-N 3.18Å; N529-L649 WeakPolarHBondContact OD1-CD1 3.5Å
530	D	95.3	Very high	91.1	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-60.2	-39.6	175.5	-68.5	-24.2	0	0	0	111.2	C430 S431 V434 L476 V526 T527 L528 N532 A533 S534	C430-D530 WeakPolarHBondContact CA-OD1 3.45Å; C430-D530 VanDerWaalsContact CB-OD1 3.29Å; C430-D530 WeakPolarHBondContact CB-OD1 3.5Å; S431-D530 VanDerWaalsContact CB-OD2 3.23Å; S431-D530 WeakPolarHBondContact CB-OD2 3.42Å; S431-D530 PolarHBondContact N-OD1 3.11Å; V434-D530 HydrophobicContact CG2-CB 3.73Å; L476-D530 HydrophobicContact CD2-CB 4.42Å; V526-D530 PolarHBondContact O-N 3.48Å; T527-D530 WeakPolarHBondContact O-CB 3.22Å; T527-D530 PolarHBondContact O-N 3.16Å; L528-D530 VanDerWaalsContact C-N 3.33Å; D530-N532 VanDerWaalsContact C-N 3.32Å; D530-N532 PolarHBondContact O-N 3.4Å; D530-A533 PolarHBondContact O-N 3.24Å; D530-S534 WeakPolarHBondContact O-CB 3.43Å; D530-S534 PolarHBondContact O-N 3.04Å; D530-S534 PolarHBondContact O-OG 3.29Å
531	C	95.9	Very high	92.2	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-63	-39.3	174.3	-63.9	0	0	0	0	111.5	T527 L528 N529 S534 S535 C578 M582	T527-C531 PolarHBondContact O-N 3.37Å; T527-C531 PolarHBondContact O-SG 2.76Å; L528-C531 WeakPolarHBondContact O-CB 3.45Å; L528-C531 PolarHBondContact O-N 3.32Å; N529-C531 VanDerWaalsContact C-N 3.28Å; N529-C531 PolarHBondContact O-N 2.92Å; C531-S534 WeakPolarHBondContact O-CB 3.48Å; C531-S534 PolarHBondContact O-N 3.3Å; C531-S535 PolarHBondContact O-N 3.46Å; C531-C578 PolarHBondContact O-SG 3.33Å; C531-M582 HydrophobicContact CB-CG 3.27Å; C531-M582 HydrophobicContact CB-SD 4.01Å
532	N	95.3	Very high	93	Very high	36 Å²	36	28.4 Å²	28.4	19%	0.193	13%	0.132	C	C	.	.	H	α-helix	trans	-67.6	-47.9	177.1	-176.5	70.1	0	0	0	112.1	L528 N529 D530 S534 S535 E536 M582 S646 L649	L528-N532 PolarHBondContact O-N 2.98Å; N529-N532 WeakPolarHBondContact O-CA 3.21Å; N529-N532 WeakPolarHBondContact O-CB 3.32Å; N529-N532 PolarHBondContact O-N 2.95Å; D530-N532 VanDerWaalsContact C-N 3.32Å; D530-N532 PolarHBondContact O-N 3.4Å; N532-S534 PolarHBondContact O-N 3.47Å; N532-S535 PolarHBondContact O-N 3.44Å; N532-E536 PolarHBondContact O-N 2.79Å; N532-M582 WeakPolarHBondContact CA-SD 3.48Å; N532-M582 HydrophobicContact CB-SD 3.65Å; N532-M582 PolarHBondContact N-SD 2.96Å; N532-S646 PolarHBondContact ND2-OG 2.83Å; N532-L649 HydrophobicContact CB-CD1 3.77Å; N532-L649 HydrophobicContact CB-CD2 4.22Å; N532-L649 HydrophobicContact CB-CG 3.86Å
533	A	95.2	Very high	93.7	Very high	19 Å²	19	29.3 Å²	29.3	16%	0.157	14%	0.138	C	C	.	.	H	α-helix	trans	-59.5	-38.4	174	0	0	0	0	0	111.5	V434 N529 D530 S535 E536 C537	V434-A533 HydrophobicContact CG1-CB 4.06Å; V434-A533 HydrophobicContact CG2-CB 4.36Å; N529-A533 PolarHBondContact O-N 3.11Å; D530-A533 PolarHBondContact O-N 3.24Å; A533-S535 PolarHBondContact O-N 3.17Å; A533-E536 PolarHBondContact O-N 3.29Å; A533-C537 WeakPolarHBondContact O-CB 3.25Å; A533-C537 PolarHBondContact O-N 2.85Å; A533-C537 PolarHBondContact O-SG 3.22Å
534	S	96.4	Very high	94.1	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-62.1	-39.5	176.2	-64.9	0	0	0	0	112.9	Y472 D530 C531 N532 E536 C537 L538	Y472-S534 WeakPolarHBondContact CE1-OG 3.47Å; Y472-S534 PolarHBondContact OH-OG 3.24Å; D530-S534 WeakPolarHBondContact O-CB 3.43Å; D530-S534 PolarHBondContact O-N 3.04Å; D530-S534 PolarHBondContact O-OG 3.29Å; C531-S534 WeakPolarHBondContact O-CB 3.48Å; C531-S534 PolarHBondContact O-N 3.3Å; N532-S534 PolarHBondContact O-N 3.47Å; S534-E536 VanDerWaalsContact C-N 3.32Å; S534-E536 PolarHBondContact O-N 3.07Å; S534-C537 PolarHBondContact O-N 3.39Å; S534-L538 WeakPolarHBondContact O-CB 3.23Å; S534-L538 VanDerWaalsContact O-CG 3.27Å; S534-L538 WeakPolarHBondContact O-CG 3.29Å; S534-L538 PolarHBondContact O-N 3.49Å
535	S	95	Very high	94.3	Very high	14 Å²	14	27.7 Å²	27.7	10%	0.098	13%	0.133	C	C	.	.	H	α-helix	trans	-63.2	-39.6	176.6	-165.6	0	0	0	0	111.7	C531 N532 A533 E539 N579	C531-S535 PolarHBondContact O-N 3.46Å; N532-S535 PolarHBondContact O-N 3.44Å; A533-S535 PolarHBondContact O-N 3.17Å; S535-E539 PolarHBondContact O-N 3.35Å; S535-N579 PolarHBondContact OG-OD1 3.18Å
536	E	93.8	Very high	94.3	Very high	117 Å²	117	28.9 Å²	28.9	55%	0.547	15%	0.145	S	C	.	.	H	α-helix	trans	-69.7	-41.1	174.1	-162.3	-165.1	145.5	0	0	112.1	N532 A533 S534 L538 E539 R540	N532-E536 PolarHBondContact O-N 2.79Å; A533-E536 PolarHBondContact O-N 3.29Å; S534-E536 VanDerWaalsContact C-N 3.32Å; S534-E536 PolarHBondContact O-N 3.07Å; E536-L538 PolarHBondContact O-N 2.7Å; E536-E539 PolarHBondContact O-N 3.11Å; E536-R540 WeakPolarHBondContact O-CB 3.15Å; E536-R540 PolarHBondContact O-N 3.12Å; E536-R540 IonicContact OE1-CZ 3.97Å; E536-R540 IonicContact OE1-NH2 3.64Å; E536-R540 PolarHBondContact OE1-NH2 3.03Å; E536-R540 IonicContact OE2-NH2 3.25Å
537	C	94.7	Very high	94.3	Very high	9 Å²	9	36.9 Å²	36.9	6%	0.061	17%	0.174	C	C	.	.	H	α-helix	trans	-63.7	-37.8	176.6	-73.4	0	0	0	0	112.8	F438 A533 S534 R540 L541	F438-C537 HydrophobicContact CB-CB 4.46Å; F438-C537 HydrophobicContact CD1-CB 3.92Å; F438-C537 HydrophobicContact CD2-CB 3.49Å; F438-C537 VanDerWaalsContact CD2-CB 3.49Å; F438-C537 HydrophobicContact CE1-CB 4.01Å; F438-C537 HydrophobicContact CE2-CB 3.64Å; F438-C537 HydrophobicContact CG-CB 3.69Å; F438-C537 HydrophobicContact CZ-CB 3.9Å; A533-C537 WeakPolarHBondContact O-CB 3.25Å; A533-C537 PolarHBondContact O-N 2.85Å; A533-C537 PolarHBondContact O-SG 3.22Å; S534-C537 PolarHBondContact O-N 3.39Å; C537-R540 PolarHBondContact O-N 3.34Å; C537-R540 PolarHBondContact SG-NH1 3.18Å; C537-L541 WeakPolarHBondContact O-CB 3.42Å; C537-L541 PolarHBondContact O-N 3.27Å
538	L	96	Very high	94.1	Very high	3 Å²	3	38.1 Å²	38.1	2%	0.016	18%	0.18	C	C	.	.	H	α-helix	trans	-59.3	-48.1	173	-78.1	164.5	0	0	0	111.3	F438 L468 S534 E536 R540 L541 K542 F571 V574 Q575 C578	F438-L538 HydrophobicContact CE1-CB 4.46Å; F438-L538 HydrophobicContact CE1-CD2 3.69Å; F438-L538 HydrophobicContact CE1-CG 3.71Å; F438-L538 HydrophobicContact CZ-CD2 4.1Å; F438-L538 HydrophobicContact CZ-CG 3.76Å; L468-L538 HydrophobicContact CD1-CD2 3.87Å; S534-L538 WeakPolarHBondContact O-CB 3.23Å; S534-L538 VanDerWaalsContact O-CG 3.27Å; S534-L538 WeakPolarHBondContact O-CG 3.29Å; S534-L538 PolarHBondContact O-N 3.49Å; E536-L538 PolarHBondContact O-N 2.7Å; L538-R540 PolarHBondContact O-N 3.38Å; L538-L541 PolarHBondContact O-N 3.42Å; L538-K542 WeakPolarHBondContact O-CB 3.41Å; L538-K542 PolarHBondContact O-N 3.39Å; L538-F571 HydrophobicContact CD2-CD1 3.87Å; L538-F571 HydrophobicContact CD2-CE1 4.44Å; L538-V574 HydrophobicContact CD1-CG1 4.05Å; L538-V574 HydrophobicContact CD2-CB 4.42Å; L538-V574 HydrophobicContact CD2-CG1 3.99Å; L538-Q575 HydrophobicContact CD1-CB 4.16Å; L538-Q575 HydrophobicContact CD1-CG 4.49Å; L538-C578 HydrophobicContact CD1-CB 4.26Å
539	E	94.3	Very high	93.8	Very high	59 Å²	59	38.7 Å²	38.7	28%	0.276	18%	0.183	S	C	.	.	H	α-helix	trans	-63.7	-43.7	179.7	-176.7	64	-170.8	0	0	111.6	S535 E536 K543	S535-E539 PolarHBondContact O-N 3.35Å; E536-E539 PolarHBondContact O-N 3.11Å; E539-K543 HydrophobicContact CG-CD 4.37Å; E539-K543 WeakPolarHBondContact O-CB 3.2Å; E539-K543 WeakPolarHBondContact O-CG 3.47Å; E539-K543 PolarHBondContact O-N 2.87Å; E539-K543 WeakPolarHBondContact OE1-CE 3.48Å; E539-K543 IonicContact OE1-NZ 3.69Å; E539-K543 PolarHBondContact OE1-NZ 3.35Å
540	R	95.1	Very high	93.3	Very high	126 Å²	126	41.7 Å²	41.7	48%	0.475	20%	0.199	S	C	.	.	H	α-helix	trans	-65.2	-41.5	177	-164.8	-175.3	-47.8	100.3	2.9	111.7	E536 C537 L538 G544	E536-R540 WeakPolarHBondContact O-CB 3.15Å; E536-R540 PolarHBondContact O-N 3.12Å; E536-R540 IonicContact OE1-CZ 3.97Å; E536-R540 IonicContact OE1-NH2 3.64Å; E536-R540 PolarHBondContact OE1-NH2 3.03Å; E536-R540 IonicContact OE2-NH2 3.25Å; C537-R540 PolarHBondContact O-N 3.34Å; C537-R540 PolarHBondContact SG-NH1 3.18Å; L538-R540 PolarHBondContact O-N 3.38Å; R540-G544 PolarHBondContact O-N 2.95Å
541	L	95.4	Very high	92.8	Very high	9 Å²	9	47.7 Å²	47.7	5%	0.047	23%	0.231	C	C	.	.	H	α-helix	trans	-63.2	-50.5	177.6	177.6	62.1	0	0	0	110.4	F438 I441 R442 C537 L538 K543 G544 L545 F571	F438-L541 HydrophobicContact CD1-CD2 3.92Å; F438-L541 HydrophobicContact CE1-CD2 4.41Å; I441-L541 HydrophobicContact CG2-CD2 3.71Å; R442-L541 HydrophobicContact CB-CD1 3.72Å; R442-L541 HydrophobicContact CG-CD1 4.04Å; C537-L541 WeakPolarHBondContact O-CB 3.42Å; C537-L541 PolarHBondContact O-N 3.27Å; L538-L541 PolarHBondContact O-N 3.42Å; L541-K543 PolarHBondContact O-N 2.66Å; L541-G544 PolarHBondContact O-N 2.84Å; L541-L545 HydrophobicContact CD1-CD1 3.82Å; L541-L545 HydrophobicContact CD1-CD2 4.42Å; L541-L545 HydrophobicContact CD1-CG 3.93Å; L541-L545 HydrophobicContact CG-CD1 3.87Å; L541-L545 HydrophobicContact CG-CG 4.35Å; L541-L545 WeakPolarHBondContact O-CB 3.47Å; L541-L545 VanDerWaalsContact O-CG 3.29Å; L541-L545 WeakPolarHBondContact O-CG 3.45Å; L541-L545 PolarHBondContact O-N 3.44Å; L541-F571 HydrophobicContact CD2-CD1 4.49Å; L541-F571 HydrophobicContact CD2-CE1 3.66Å; L541-F571 HydrophobicContact CD2-CZ 4.31Å; L541-F571 HydrophobicContact CG-CE1 4.33Å
542	K	95	Very high	91.9	Very high	47 Å²	47	51.1 Å²	51.1	20%	0.204	25%	0.252	C	S	.	.	H	α-helix	trans	-56.2	-50.7	178.4	-173.3	-171.2	-176.1	-171.4	0	111.6	L538 G544 L545 A546 L568 F571 D572	L538-K542 WeakPolarHBondContact O-CB 3.41Å; L538-K542 PolarHBondContact O-N 3.39Å; K542-G544 VanDerWaalsContact C-N 3.34Å; K542-G544 PolarHBondContact O-N 3.38Å; K542-L545 PolarHBondContact O-N 2.68Å; K542-A546 PolarHBondContact O-N 2.75Å; K542-L568 WeakPolarHBondContact CE-O 3.45Å; K542-F571 HydrophobicContact CB-CB 4.44Å; K542-F571 HydrophobicContact CD-CB 4.32Å; K542-F571 HydrophobicContact CG-CB 4.39Å; K542-D572 IonicContact NZ-OD1 3.96Å; K542-D572 PolarHBondContact NZ-OD1 3.01Å; K542-D572 IonicContact NZ-OD2 2.69Å; K542-D572 PolarHBondContact NZ-OD2 3.34Å
543	K	94	Very high	90.8	Very high	110 Å²	110	50.5 Å²	50.5	48%	0.478	25%	0.248	S	C	.	.	H	α-helix	trans	-62	-40.2	176.9	-75.9	173.8	173	153.3	0	112.6	E539 L541 R547	E539-K543 HydrophobicContact CG-CD 4.37Å; E539-K543 WeakPolarHBondContact O-CB 3.2Å; E539-K543 WeakPolarHBondContact O-CG 3.47Å; E539-K543 PolarHBondContact O-N 2.87Å; E539-K543 WeakPolarHBondContact OE1-CE 3.48Å; E539-K543 IonicContact OE1-NZ 3.69Å; E539-K543 PolarHBondContact OE1-NZ 3.35Å; L541-K543 PolarHBondContact O-N 2.66Å; K543-R547 WeakPolarHBondContact O-CG 3.46Å; K543-R547 PolarHBondContact O-N 3.07Å
544	G	94.2	Very high	89.5	Confident	14 Å²	14	53.5 Å²	53.5	14%	0.144	27%	0.268	C	S	.	.	H	α-helix	trans	-64.5	-43.3	177.7	0	0	0	0	0	112.6	R540 L541 K542 R547 D548	R540-G544 PolarHBondContact O-N 2.95Å; L541-G544 PolarHBondContact O-N 2.84Å; K542-G544 VanDerWaalsContact C-N 3.34Å; K542-G544 PolarHBondContact O-N 3.38Å; G544-R547 PolarHBondContact O-N 3.25Å; G544-D548 PolarHBondContact O-N 2.76Å; G544-D548 VanDerWaalsContact O-N 3.11Å
545	L	92.8	Very high	88.2	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-68.7	-40	178.3	-68.2	174	0	0	0	112.1	I445 L461 L541 K542 R547 D548 F549 L568 F571	I445-L545 HydrophobicContact CB-CD2 4.09Å; I445-L545 HydrophobicContact CD1-CD1 3.69Å; I445-L545 HydrophobicContact CG2-CD1 4.17Å; I445-L545 HydrophobicContact CG2-CD2 3.59Å; I445-L545 HydrophobicContact CG2-CG 4.48Å; L461-L545 HydrophobicContact CD2-CD1 3.97Å; L541-L545 HydrophobicContact CD1-CD1 3.82Å; L541-L545 HydrophobicContact CD1-CD2 4.42Å; L541-L545 HydrophobicContact CD1-CG 3.93Å; L541-L545 HydrophobicContact CG-CD1 3.87Å; L541-L545 HydrophobicContact CG-CG 4.35Å; L541-L545 WeakPolarHBondContact O-CB 3.47Å; L541-L545 VanDerWaalsContact O-CG 3.29Å; L541-L545 WeakPolarHBondContact O-CG 3.45Å; L541-L545 PolarHBondContact O-N 3.44Å; K542-L545 PolarHBondContact O-N 2.68Å; L545-R547 VanDerWaalsContact C-N 3.3Å; L545-R547 PolarHBondContact O-N 2.68Å; L545-D548 PolarHBondContact O-N 3.18Å; L545-F549 HydrophobicContact CB-CE1 4.46Å; L545-F549 HydrophobicContact CB-CE2 4.49Å; L545-F549 HydrophobicContact CB-CZ 4.17Å; L545-F549 VanDerWaalsContact O-CD1 3.22Å; L545-F549 WeakPolarHBondContact O-CD1 3.49Å; L545-F549 WeakPolarHBondContact O-CG 3.4Å; L545-F549 PolarHBondContact O-N 2.95Å; L545-L568 HydrophobicContact CB-CD2 4.03Å; L545-L568 HydrophobicContact CD1-CD2 4.45Å; L545-F571 HydrophobicContact CD1-CZ 4.38Å
546	A	90.6	Very high	87.1	Confident	34 Å²	34	65.3 Å²	65.3	28%	0.281	32%	0.316	S	S	.	.	H	α-helix	trans	-57.5	-42.9	175	0	0	0	0	0	112.1	K542 F549 D550 L568	K542-A546 PolarHBondContact O-N 2.75Å; A546-F549 PolarHBondContact O-N 2.88Å; A546-D550 PolarHBondContact O-N 3.48Å; A546-L568 HydrophobicContact CB-CD1 4.08Å
547	R	90.5	Very high	86.2	Confident	175 Å²	175	62.6 Å²	62.6	66%	0.66	31%	0.31	S	S	*	.	H	α-helix	trans	-64.2	-45.4	174.6	-68.5	176.9	-171.5	168.5	2	112.4	K543 G544 L545 F549 D550 D551	K543-R547 WeakPolarHBondContact O-CG 3.46Å; K543-R547 PolarHBondContact O-N 3.07Å; G544-R547 PolarHBondContact O-N 3.25Å; L545-R547 VanDerWaalsContact C-N 3.3Å; L545-R547 PolarHBondContact O-N 2.68Å; R547-F549 PolarHBondContact O-N 3.13Å; R547-D550 PolarHBondContact O-N 3.3Å; R547-D551 PolarHBondContact O-N 2.88Å
548	D	88.9	Confident	85.5	Confident	26 Å²	26	68 Å²	68	14%	0.139	33%	0.334	C	S	.	.	H	α-helix	trans	-59.7	-35.1	177.7	-64.8	-28.1	0	0	0	111.2	R442 R446 L449 G544 L545 V552	R442-D548 IonicContact NH1-OD2 3.31Å; R446-D548 IonicContact CZ-OD1 2.6Å; R446-D548 IonicContact CZ-OD2 3.1Å; R446-D548 IonicContact NE-OD1 3.98Å; R446-D548 IonicContact NE-OD2 2.68Å; R446-D548 PolarHBondContact NE-OD2 3.1Å; R446-D548 IonicContact NH2-OD1 3.47Å; R446-D548 PolarHBondContact NH2-OD1 2.97Å; R446-D548 IonicContact NH2-OD2 3.41Å; R446-D548 PolarHBondContact NH2-OD2 3.27Å; L449-D548 HydrophobicContact CD1-CB 3.85Å; G544-D548 PolarHBondContact O-N 2.76Å; G544-D548 VanDerWaalsContact O-N 3.11Å; L545-D548 PolarHBondContact O-N 3.18Å; D548-V552 WeakPolarHBondContact O-CB 3.46Å; D548-V552 WeakPolarHBondContact O-CG2 3.35Å; D548-V552 PolarHBondContact O-N 3.19Å; D548-V552 VanDerWaalsContact O-N 3.14Å
549	F	86.4	Confident	85	Confident	12 Å²	12	71.1 Å²	71.1	5%	0.053	36%	0.356	C	S	.	.	H	α-helix	trans	-70.3	-42.6	176.5	-61.9	-10.4	0	0	0	111.9	I445 L449 V457 L461 L545 A546 R547 D551 V552 L553 L564 L568	I445-F549 HydrophobicContact CG2-CE1 4.35Å; I445-F549 HydrophobicContact CG2-CZ 4.31Å; L449-F549 HydrophobicContact CD1-CD1 3.76Å; L449-F549 HydrophobicContact CD1-CE1 3.71Å; L449-F549 HydrophobicContact CD2-CD1 3.35Å; L449-F549 HydrophobicContact CD2-CE1 3.48Å; L449-F549 VanDerWaalsContact CD2-CE1 3.48Å; L449-F549 HydrophobicContact CG-CD1 4.03Å; L449-F549 HydrophobicContact CG-CE1 3.81Å; V457-F549 HydrophobicContact CG1-CE1 3.66Å; V457-F549 HydrophobicContact CG1-CE2 4.4Å; V457-F549 HydrophobicContact CG1-CZ 3.56Å; L461-F549 HydrophobicContact CD1-CE2 3.94Å; L461-F549 HydrophobicContact CD1-CZ 3.88Å; L461-F549 HydrophobicContact CD2-CZ 4.19Å; L461-F549 HydrophobicContact CG-CZ 4.42Å; L545-F549 HydrophobicContact CB-CE1 4.46Å; L545-F549 HydrophobicContact CB-CE2 4.49Å; L545-F549 HydrophobicContact CB-CZ 4.17Å; L545-F549 VanDerWaalsContact O-CD1 3.22Å; L545-F549 WeakPolarHBondContact O-CD1 3.49Å; L545-F549 WeakPolarHBondContact O-CG 3.4Å; L545-F549 PolarHBondContact O-N 2.95Å; A546-F549 PolarHBondContact O-N 2.88Å; R547-F549 PolarHBondContact O-N 3.13Å; F549-D551 VanDerWaalsContact C-N 3.3Å; F549-D551 PolarHBondContact O-N 3.15Å; F549-V552 PolarHBondContact O-N 3.48Å; F549-L553 HydrophobicContact CB-CD1 4.41Å; F549-L553 WeakPolarHBondContact O-CA 3.44Å; F549-L553 WeakPolarHBondContact O-CB 3.21Å; F549-L553 PolarHBondContact O-N 3.01Å; F549-L564 HydrophobicContact CD2-CB 4.22Å; F549-L564 HydrophobicContact CD2-CD1 4.23Å; F549-L564 HydrophobicContact CE2-CB 4.39Å; F549-L564 HydrophobicContact CE2-CD2 4.47Å; F549-L564 HydrophobicContact CG-CD1 4.42Å; F549-L568 HydrophobicContact CD2-CD1 3.73Å; F549-L568 HydrophobicContact CD2-CG 4.34Å; F549-L568 HydrophobicContact CE2-CD1 3.65Å; F549-L568 HydrophobicContact CE2-CD2 3.83Å; F549-L568 HydrophobicContact CE2-CG 3.76Å; F549-L568 HydrophobicContact CZ-CD2 4.45Å
550	D	84.8	Confident	84.5	Confident	65 Å²	65	70.8 Å²	70.8	35%	0.348	36%	0.355	S	S	.	.	H	α-helix	trans	-58.6	-43.2	174.9	-79.8	-35.9	0	0	0	111.7	A546 R547 S554 R561	A546-D550 PolarHBondContact O-N 3.48Å; R547-D550 PolarHBondContact O-N 3.3Å; D550-S554 WeakPolarHBondContact O-CA 3.46Å; D550-S554 WeakPolarHBondContact O-CB 3.39Å; D550-S554 PolarHBondContact O-N 3.27Å; D550-S554 VanDerWaalsContact O-N 3.11Å; D550-R561 IonicContact OD1-CZ 3.05Å; D550-R561 IonicContact OD1-NH1 3.73Å; D550-R561 PolarHBondContact OD1-NH1 3.45Å; D550-R561 IonicContact OD1-NH2 2.71Å; D550-R561 PolarHBondContact OD1-NH2 3.26Å; D550-R561 IonicContact OD2-NH2 3.13Å
551	D	84	Confident	83.9	Confident	127 Å²	127	70 Å²	70	68%	0.679	35%	0.352	S	S	*	.	H	α-helix	trans	-65.6	-47.4	-179.8	-70.4	-22.6	0	0	0	112.1	R547 F549	R547-D551 PolarHBondContact O-N 2.88Å; F549-D551 VanDerWaalsContact C-N 3.3Å; F549-D551 PolarHBondContact O-N 3.15Å
552	V	77.8	Confident	83.6	Confident	72 Å²	72	74.8 Å²	74.8	44%	0.436	37%	0.374	S	S	.	.	H	α-helix	trans	-82.5	-32.7	-173.6	178.4	0	0	0	0	112.5	D548 F549	D548-V552 WeakPolarHBondContact O-CB 3.46Å; D548-V552 WeakPolarHBondContact O-CG2 3.35Å; D548-V552 PolarHBondContact O-N 3.19Å; D548-V552 VanDerWaalsContact O-N 3.14Å; F549-V552 PolarHBondContact O-N 3.48Å
553	L	71.8	Confident	83.2	Confident	22 Å²	22	77.6 Å²	77.6	12%	0.115	39%	0.386	C	S	.	.	H	α-helix	trans	-112.9	9.7	-169.8	-52.9	173.7	0	0	0	113.8	F549 K555 R556 L564	F549-L553 HydrophobicContact CB-CD1 4.41Å; F549-L553 WeakPolarHBondContact O-CA 3.44Å; F549-L553 WeakPolarHBondContact O-CB 3.21Å; F549-L553 PolarHBondContact O-N 3.01Å; L553-K555 PolarHBondContact O-N 3.22Å; L553-R556 HydrophobicContact CB-CB 4.36Å; L553-R556 HydrophobicContact CB-CG 4.01Å; L553-R556 HydrophobicContact CD2-CG 3.95Å; L553-R556 VanDerWaalsContact O-CB 3.3Å; L553-R556 WeakPolarHBondContact O-CB 3.45Å; L553-R556 PolarHBondContact O-N 3.11Å; L553-L564 HydrophobicContact CD1-CD1 3.17Å
554	S	68.3	Low	82.9	Confident	83 Å²	83	72.7 Å²	72.7	58%	0.58	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.5	-25	176.8	50.8	0	0	0	0	116	D550	D550-S554 WeakPolarHBondContact O-CA 3.46Å; D550-S554 WeakPolarHBondContact O-CB 3.39Å; D550-S554 PolarHBondContact O-N 3.27Å; D550-S554 VanDerWaalsContact O-N 3.11Å
555	K	68.4	Low	82.7	Confident	193 Å²	193	76 Å²	76	84%	0.839	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.7	9.2	-179	-61.4	-177.4	-178.8	175.8	0	114.3	L553	L553-K555 PolarHBondContact O-N 3.22Å
556	R	71.8	Confident	82.7	Confident	69 Å²	69	79.8 Å²	79.8	26%	0.26	41%	0.406	S	S	.	.	S	Bend	trans	-88.8	169.5	-179.5	-71.6	-76.8	-169.3	-166	5.1	111.4	D348 S452 L553 E560	D348-R556 IonicContact OD1-NH2 3.41Å; D348-R556 PolarHBondContact OD1-NH2 2.8Å; D348-R556 IonicContact OD2-NH2 2.64Å; S452-R556 PolarHBondContact O-NH2 3Å; L553-R556 HydrophobicContact CB-CB 4.36Å; L553-R556 HydrophobicContact CB-CG 4.01Å; L553-R556 HydrophobicContact CD2-CG 3.95Å; L553-R556 VanDerWaalsContact O-CB 3.3Å; L553-R556 WeakPolarHBondContact O-CB 3.45Å; L553-R556 PolarHBondContact O-N 3.11Å; R556-E560 HydrophobicContact CB-CB 4.46Å; R556-E560 WeakPolarHBondContact CB-OE2 3.44Å; R556-E560 WeakPolarHBondContact CD-OE2 3.25Å
557	S	75.6	Confident	82.7	Confident	59 Å²	59	79 Å²	79	41%	0.413	40%	0.398	S	S	.	.			trans	-71.2	152.9	-178.9	64.9	0	0	0	0	112.1	S559 E560 R561	S557-S559 PolarHBondContact O-N 3.27Å; S557-E560 PolarHBondContact N-OE2 2.93Å; S557-E560 PolarHBondContact O-N 3.09Å; S557-E560 VanDerWaalsContact O-N 3.11Å; S557-E560 VanDerWaalsContact OG-CD 3.29Å; S557-E560 VanDerWaalsContact OG-CG 3.28Å; S557-E560 WeakPolarHBondContact OG-CG 3.46Å; S557-E560 PolarHBondContact OG-N 2.81Å; S557-E560 PolarHBondContact OG-OE2 3.18Å; S557-R561 PolarHBondContact O-N 3.12Å
558	E	80.8	Confident	82.8	Confident	122 Å²	122	70.9 Å²	70.9	57%	0.57	37%	0.368	S	S	*	.	H	α-helix	trans	-57.6	-35.8	176.3	-174.8	59.9	-161.8	0	0	112.2	E560 R561 Q562	E558-E560 PolarHBondContact O-N 3.23Å; E558-R561 WeakPolarHBondContact O-CB 3.41Å; E558-R561 PolarHBondContact O-N 3.26Å; E558-Q562 WeakPolarHBondContact O-CG 3.45Å; E558-Q562 PolarHBondContact O-N 2.98Å
559	S	84.1	Confident	83	Confident	69 Å²	69	71.7 Å²	71.7	48%	0.483	38%	0.378	S	S	.	.	H	α-helix	trans	-64.1	-39.7	176.7	177.7	0	0	0	0	112.7	S557 R561 Q562 K563	S557-S559 PolarHBondContact O-N 3.27Å; S559-R561 VanDerWaalsContact C-N 3.34Å; S559-Q562 PolarHBondContact O-N 3.12Å; S559-K563 WeakPolarHBondContact O-CG 3.26Å; S559-K563 PolarHBondContact O-N 2.98Å
560	E	83.7	Confident	83.3	Confident	52 Å²	52	74.1 Å²	74.1	24%	0.243	39%	0.39	C	S	.	.	H	α-helix	trans	-67.5	-37.4	176.8	-76.1	166.4	137.7	0	0	111.6	V454 R556 S557 E558 K563 L564	V454-E560 HydrophobicContact CG1-CB 4.29Å; V454-E560 HydrophobicContact CG2-CB 4Å; V454-E560 HydrophobicContact CG2-CG 4.09Å; R556-E560 HydrophobicContact CB-CB 4.46Å; R556-E560 WeakPolarHBondContact CB-OE2 3.44Å; R556-E560 WeakPolarHBondContact CD-OE2 3.25Å; S557-E560 PolarHBondContact N-OE2 2.93Å; S557-E560 PolarHBondContact O-N 3.09Å; S557-E560 VanDerWaalsContact O-N 3.11Å; S557-E560 VanDerWaalsContact OG-CD 3.29Å; S557-E560 VanDerWaalsContact OG-CG 3.28Å; S557-E560 WeakPolarHBondContact OG-CG 3.46Å; S557-E560 PolarHBondContact OG-N 2.81Å; S557-E560 PolarHBondContact OG-OE2 3.18Å; E558-E560 PolarHBondContact O-N 3.23Å; E560-K563 PolarHBondContact O-N 3.43Å; E560-L564 PolarHBondContact O-N 2.69Å
561	R	83.9	Confident	83.8	Confident	110 Å²	110	71.1 Å²	71.1	42%	0.415	37%	0.374	S	S	.	.	H	α-helix	trans	-62.2	-48.1	175.1	-171.6	177.6	179.2	109.2	9.3	111.4	D550 S557 E558 S559 K563 L564 D565	D550-R561 IonicContact OD1-CZ 3.05Å; D550-R561 IonicContact OD1-NH1 3.73Å; D550-R561 PolarHBondContact OD1-NH1 3.45Å; D550-R561 IonicContact OD1-NH2 2.71Å; D550-R561 PolarHBondContact OD1-NH2 3.26Å; D550-R561 IonicContact OD2-NH2 3.13Å; S557-R561 PolarHBondContact O-N 3.12Å; E558-R561 WeakPolarHBondContact O-CB 3.41Å; E558-R561 PolarHBondContact O-N 3.26Å; S559-R561 VanDerWaalsContact C-N 3.34Å; R561-K563 VanDerWaalsContact C-N 3.29Å; R561-K563 PolarHBondContact O-N 2.85Å; R561-L564 PolarHBondContact O-N 2.93Å; R561-D565 PolarHBondContact O-N 3.05Å
562	Q	87.7	Confident	84.3	Confident	110 Å²	110	67.6 Å²	67.6	51%	0.514	36%	0.355	S	S	.	.	H	α-helix	trans	-59.9	-36.6	177.8	-71.5	174	3.1	0	0	113.2	E558 S559 D565 S566	E558-Q562 WeakPolarHBondContact O-CG 3.45Å; E558-Q562 PolarHBondContact O-N 2.98Å; S559-Q562 PolarHBondContact O-N 3.12Å; Q562-D565 PolarHBondContact O-N 3.31Å; Q562-S566 PolarHBondContact O-N 2.92Å
563	K	88	Confident	85.1	Confident	106 Å²	106	67.4 Å²	67.4	46%	0.461	35%	0.351	S	S	.	.	H	α-helix	trans	-61.2	-43.7	174.1	-73.2	177.1	178.4	-174.3	0	111.8	D455 S559 E560 R561 S566 C567	D455-K563 IonicContact OD1-NZ 2.69Å; S559-K563 WeakPolarHBondContact O-CG 3.26Å; S559-K563 PolarHBondContact O-N 2.98Å; E560-K563 PolarHBondContact O-N 3.43Å; R561-K563 VanDerWaalsContact C-N 3.29Å; R561-K563 PolarHBondContact O-N 2.85Å; K563-S566 WeakPolarHBondContact O-CB 3.34Å; K563-S566 PolarHBondContact O-N 3.47Å; K563-C567 PolarHBondContact O-N 2.6Å; K563-C567 VanDerWaalsContact O-N 3.08Å
564	L	87.9	Confident	86.2	Confident	6 Å²	6	66.4 Å²	66.4	3%	0.031	35%	0.346	C	S	.	.	H	α-helix	trans	-69.9	-39.7	179.3	-69.1	175.1	0	0	0	112.3	V454 V457 L461 F549 L553 E560 R561 S566 C567 L568	V454-L564 HydrophobicContact CG1-CD1 4.19Å; V454-L564 HydrophobicContact CG1-CD2 3.97Å; V454-L564 HydrophobicContact CG1-CG 3.82Å; V457-L564 HydrophobicContact CB-CD2 4.09Å; V457-L564 HydrophobicContact CG1-CD2 3.78Å; L461-L564 HydrophobicContact CD1-CD2 4.33Å; F549-L564 HydrophobicContact CD2-CB 4.22Å; F549-L564 HydrophobicContact CD2-CD1 4.23Å; F549-L564 HydrophobicContact CE2-CB 4.39Å; F549-L564 HydrophobicContact CE2-CD2 4.47Å; F549-L564 HydrophobicContact CG-CD1 4.42Å; L553-L564 HydrophobicContact CD1-CD1 3.17Å; E560-L564 PolarHBondContact O-N 2.69Å; R561-L564 PolarHBondContact O-N 2.93Å; L564-S566 VanDerWaalsContact C-N 3.25Å; L564-S566 PolarHBondContact O-N 2.84Å; L564-C567 PolarHBondContact O-N 3Å; L564-C567 VanDerWaalsContact O-N 3.09Å; L564-L568 WeakPolarHBondContact O-CG 3.29Å; L564-L568 PolarHBondContact O-N 3.28Å
565	D	89.6	Confident	87.6	Confident	83 Å²	83	64.3 Å²	64.3	44%	0.444	33%	0.327	S	S	.	.	H	α-helix	trans	-60	-39.9	174.5	-69.6	-27	0	0	0	110.8	R561 Q562 L568 A569	R561-D565 PolarHBondContact O-N 3.05Å; Q562-D565 PolarHBondContact O-N 3.31Å; D565-L568 PolarHBondContact O-N 3.48Å; D565-A569 PolarHBondContact O-N 3.31Å
566	S	91.3	Very high	88.9	Confident	80 Å²	80	63 Å²	63	56%	0.559	32%	0.317	S	S	*	.	H	α-helix	trans	-64.6	-37.2	173.5	-174.6	0	0	0	0	113.1	Q562 K563 L564	Q562-S566 PolarHBondContact O-N 2.92Å; K563-S566 WeakPolarHBondContact O-CB 3.34Å; K563-S566 PolarHBondContact O-N 3.47Å; L564-S566 VanDerWaalsContact C-N 3.25Å; L564-S566 PolarHBondContact O-N 2.84Å
567	C	91.7	Very high	90	Very high	17 Å²	17	65.7 Å²	65.7	12%	0.115	33%	0.327	C	S	.	.	H	α-helix	trans	-70.5	-38.5	174.4	-74.6	0	0	0	0	111.8	L461 K563 L564 A569 Q570	L461-C567 HydrophobicContact CB-CB 4.04Å; L461-C567 HydrophobicContact CD1-CB 3.53Å; L461-C567 HydrophobicContact CG-CB 4.44Å; K563-C567 PolarHBondContact O-N 2.6Å; K563-C567 VanDerWaalsContact O-N 3.08Å; L564-C567 PolarHBondContact O-N 3Å; L564-C567 VanDerWaalsContact O-N 3.09Å; C567-A569 VanDerWaalsContact C-N 3.29Å; C567-A569 PolarHBondContact O-N 3.47Å; C567-Q570 WeakPolarHBondContact O-CB 3.47Å; C567-Q570 PolarHBondContact O-N 3.48Å
568	L	92.2	Very high	91	Very high	6 Å²	6	62.9 Å²	62.9	3%	0.031	31%	0.307	C	S	.	.	H	α-helix	trans	-66	-31.2	175.9	-76.9	174	0	0	0	112.6	L461 K542 L545 A546 F549 L564 D565 Q570 F571	L461-L568 HydrophobicContact CD2-CD2 4.04Å; K542-L568 WeakPolarHBondContact CE-O 3.45Å; L545-L568 HydrophobicContact CB-CD2 4.03Å; L545-L568 HydrophobicContact CD1-CD2 4.45Å; A546-L568 HydrophobicContact CB-CD1 4.08Å; F549-L568 HydrophobicContact CD2-CD1 3.73Å; F549-L568 HydrophobicContact CD2-CG 4.34Å; F549-L568 HydrophobicContact CE2-CD1 3.65Å; F549-L568 HydrophobicContact CE2-CD2 3.83Å; F549-L568 HydrophobicContact CE2-CG 3.76Å; F549-L568 HydrophobicContact CZ-CD2 4.45Å; L564-L568 WeakPolarHBondContact O-CG 3.29Å; L564-L568 PolarHBondContact O-N 3.28Å; D565-L568 PolarHBondContact O-N 3.48Å; L568-Q570 PolarHBondContact O-N 3.45Å; L568-F571 WeakPolarHBondContact O-CB 3.4Å; L568-F571 PolarHBondContact O-N 3.16Å; L568-F571 VanDerWaalsContact O-N 3.13Å
569	A	92.7	Very high	91.7	Very high	43 Å²	43	59.9 Å²	59.9	36%	0.355	30%	0.295	S	S	.	.	H	α-helix	trans	-61.7	-24.7	176	0	0	0	0	0	112.9	D565 C567 F571 D572	D565-A569 PolarHBondContact O-N 3.31Å; C567-A569 VanDerWaalsContact C-N 3.29Å; C567-A569 PolarHBondContact O-N 3.47Å; A569-F571 PolarHBondContact O-N 3.41Å; A569-D572 VanDerWaalsContact O-CB 3.28Å; A569-D572 WeakPolarHBondContact O-CB 3.44Å; A569-D572 PolarHBondContact O-N 2.94Å
570	Q	93	Very high	92.3	Very high	63 Å²	63	59.5 Å²	59.5	29%	0.294	30%	0.297	S	S	.	.	H	α-helix	trans	-63.5	-23.3	175.8	-64.4	178.5	26.6	0	0	112.7	N462 C465 C567 L568 D572 D573 V574	N462-Q570 PolarHBondContact OD1-NE2 3.41Å; N462-Q570 PolarHBondContact OD1-OE1 3.11Å; C465-Q570 HydrophobicContact CB-CB 4.36Å; C567-Q570 WeakPolarHBondContact O-CB 3.47Å; C567-Q570 PolarHBondContact O-N 3.48Å; L568-Q570 PolarHBondContact O-N 3.45Å; Q570-D572 PolarHBondContact O-N 3.32Å; Q570-D573 WeakPolarHBondContact O-CB 3.48Å; Q570-D573 PolarHBondContact O-N 3.46Å; Q570-D573 VanDerWaalsContact O-N 3.15Å; Q570-V574 PolarHBondContact O-N 2.92Å
571	F	94.9	Very high	92.8	Very high	2 Å²	2	57.9 Å²	57.9	1%	0.009	29%	0.289	C	S	.	.	H	α-helix	trans	-63.9	-27.4	173.1	-77.4	-95.7	0	0	0	112.3	I445 L461 A464 C465 L468 L538 L541 K542 L545 L568 A569 D573 V574 Q575	I445-F571 HydrophobicContact CD1-CZ 4.31Å; L461-F571 HydrophobicContact CD2-CE2 3.65Å; L461-F571 HydrophobicContact CD2-CZ 4.2Å; A464-F571 HydrophobicContact CB-CZ 4.48Å; C465-F571 VanDerWaalsContact SG-CE2 3.54Å; L468-F571 HydrophobicContact CD1-CE1 4.11Å; L538-F571 HydrophobicContact CD2-CD1 3.87Å; L538-F571 HydrophobicContact CD2-CE1 4.44Å; L541-F571 HydrophobicContact CD2-CD1 4.49Å; L541-F571 HydrophobicContact CD2-CE1 3.66Å; L541-F571 HydrophobicContact CD2-CZ 4.31Å; L541-F571 HydrophobicContact CG-CE1 4.33Å; K542-F571 HydrophobicContact CB-CB 4.44Å; K542-F571 HydrophobicContact CD-CB 4.32Å; K542-F571 HydrophobicContact CG-CB 4.39Å; L545-F571 HydrophobicContact CD1-CZ 4.38Å; L568-F571 WeakPolarHBondContact O-CB 3.4Å; L568-F571 PolarHBondContact O-N 3.16Å; L568-F571 VanDerWaalsContact O-N 3.13Å; A569-F571 PolarHBondContact O-N 3.41Å; F571-D573 VanDerWaalsContact C-N 3.29Å; F571-D573 PolarHBondContact O-N 2.89Å; F571-V574 PolarHBondContact O-N 2.96Å; F571-Q575 WeakPolarHBondContact O-CB 3.37Å; F571-Q575 PolarHBondContact O-N 2.97Å
572	D	94.8	Very high	93.3	Very high	52 Å²	52	53.3 Å²	53.3	28%	0.278	27%	0.273	S	S	.	.	H	α-helix	trans	-67.6	-33.7	175.8	-60.5	-38.8	0	0	0	111.1	K542 A569 Q570 Q575 R576	K542-D572 IonicContact NZ-OD1 3.96Å; K542-D572 PolarHBondContact NZ-OD1 3.01Å; K542-D572 IonicContact NZ-OD2 2.69Å; K542-D572 PolarHBondContact NZ-OD2 3.34Å; A569-D572 VanDerWaalsContact O-CB 3.28Å; A569-D572 WeakPolarHBondContact O-CB 3.44Å; A569-D572 PolarHBondContact O-N 2.94Å; Q570-D572 PolarHBondContact O-N 3.32Å; D572-Q575 PolarHBondContact O-N 3.18Å; D572-R576 WeakPolarHBondContact O-CB 3.35Å; D572-R576 VanDerWaalsContact O-CG 3.28Å; D572-R576 WeakPolarHBondContact O-CG 3.21Å; D572-R576 PolarHBondContact O-N 2.93Å
573	D	94.4	Very high	93.6	Very high	68 Å²	68	51.7 Å²	51.7	36%	0.364	27%	0.265	S	S	.	.	H	α-helix	trans	-67.8	-44.9	176.6	-61.4	-15.3	0	0	0	110.9	Q570 F571 Q575 R576 R577	Q570-D573 WeakPolarHBondContact O-CB 3.48Å; Q570-D573 PolarHBondContact O-N 3.46Å; Q570-D573 VanDerWaalsContact O-N 3.15Å; F571-D573 VanDerWaalsContact C-N 3.29Å; F571-D573 PolarHBondContact O-N 2.89Å; D573-Q575 VanDerWaalsContact C-N 3.32Å; D573-Q575 PolarHBondContact O-N 3.11Å; D573-R576 PolarHBondContact O-N 2.79Å; D573-R576 IonicContact OD1-CZ 3.35Å; D573-R576 IonicContact OD1-NE 3.31Å; D573-R576 IonicContact OD1-NH2 3.93Å; D573-R576 PolarHBondContact OD1-NH2 3.04Å; D573-R577 PolarHBondContact O-N 2.9Å
574	V	96.3	Very high	93.9	Very high	1 Å²	1	51.1 Å²	51.1	1%	0.006	27%	0.267	C	S	.	.	H	α-helix	trans	-61.4	-43	174.9	-175.8	0	0	0	0	110.4	C465 L468 E469 L473 L538 Q570 F571 R577 C578	C465-V574 HydrophobicContact CB-CG2 3.98Å; L468-V574 HydrophobicContact CB-CG1 3.84Å; L468-V574 HydrophobicContact CD1-CG1 4.3Å; E469-V574 HydrophobicContact CG-CG1 4.41Å; E469-V574 HydrophobicContact CG-CG2 3.9Å; L473-V574 HydrophobicContact CD1-CG1 3.83Å; L538-V574 HydrophobicContact CD1-CG1 4.05Å; L538-V574 HydrophobicContact CD2-CB 4.42Å; L538-V574 HydrophobicContact CD2-CG1 3.99Å; Q570-V574 PolarHBondContact O-N 2.92Å; F571-V574 PolarHBondContact O-N 2.96Å; V574-R577 PolarHBondContact O-N 3.32Å; V574-C578 WeakPolarHBondContact O-CB 3.49Å; V574-C578 PolarHBondContact O-N 3.37Å
575	Q	96.1	Very high	94.1	Very high	39 Å²	39	50.9 Å²	50.9	18%	0.182	27%	0.266	C	S	.	.	H	α-helix	trans	-64.6	-44.1	178.2	-168.1	-178.4	20.3	0	0	111.9	L538 F571 D572 D573 R577 C578 N579	L538-Q575 HydrophobicContact CD1-CB 4.16Å; L538-Q575 HydrophobicContact CD1-CG 4.49Å; F571-Q575 WeakPolarHBondContact O-CB 3.37Å; F571-Q575 PolarHBondContact O-N 2.97Å; D572-Q575 PolarHBondContact O-N 3.18Å; D573-Q575 VanDerWaalsContact C-N 3.32Å; D573-Q575 PolarHBondContact O-N 3.11Å; Q575-R577 VanDerWaalsContact C-N 3.27Å; Q575-R577 PolarHBondContact O-N 3.06Å; Q575-C578 WeakPolarHBondContact O-CB 3.11Å; Q575-C578 PolarHBondContact O-N 3.12Å; Q575-N579 WeakPolarHBondContact O-CB 3.44Å; Q575-N579 VanDerWaalsContact O-CG 3.23Å; Q575-N579 PolarHBondContact O-N 3.28Å; Q575-N579 PolarHBondContact O-ND2 3.26Å
576	R	95.8	Very high	94.3	Very high	167 Å²	167	47 Å²	47	63%	0.63	25%	0.245	S	C	*	.	H	α-helix	trans	-58.4	-40.4	174	-75.3	-173.3	-67	155.9	-9.4	111.7	D572 D573 N579 A580	D572-R576 WeakPolarHBondContact O-CB 3.35Å; D572-R576 VanDerWaalsContact O-CG 3.28Å; D572-R576 WeakPolarHBondContact O-CG 3.21Å; D572-R576 PolarHBondContact O-N 2.93Å; D573-R576 PolarHBondContact O-N 2.79Å; D573-R576 IonicContact OD1-CZ 3.35Å; D573-R576 IonicContact OD1-NE 3.31Å; D573-R576 IonicContact OD1-NH2 3.93Å; D573-R576 PolarHBondContact OD1-NH2 3.04Å; R576-N579 PolarHBondContact O-N 3.28Å; R576-A580 PolarHBondContact O-N 3.17Å
577	R	95.4	Very high	94.4	Very high	124 Å²	124	44.1 Å²	44.1	47%	0.468	23%	0.228	S	C	.	.	H	α-helix	trans	-69.1	-40.4	177.2	-168.1	165.9	-64.5	161.6	15.9	112.4	E469 L473 D573 V574 Q575 A580 I581	E469-R577 IonicContact OE1-CZ 2.61Å; E469-R577 IonicContact OE1-NE 2.75Å; E469-R577 IonicContact OE1-NH1 2.86Å; E469-R577 PolarHBondContact OE1-NH1 3.01Å; E469-R577 IonicContact OE1-NH2 2.66Å; E469-R577 IonicContact OE2-CZ 2.95Å; E469-R577 IonicContact OE2-NH1 2.84Å; E469-R577 PolarHBondContact OE2-NH1 3.33Å; E469-R577 IonicContact OE2-NH2 3.58Å; L473-R577 HydrophobicContact CD1-CB 4.24Å; L473-R577 HydrophobicContact CD1-CG 4.3Å; D573-R577 PolarHBondContact O-N 2.9Å; V574-R577 PolarHBondContact O-N 3.32Å; Q575-R577 VanDerWaalsContact C-N 3.27Å; Q575-R577 PolarHBondContact O-N 3.06Å; R577-A580 PolarHBondContact O-N 3.17Å; R577-I581 HydrophobicContact CG-CD1 4.47Å; R577-I581 WeakPolarHBondContact O-CG1 3.34Å; R577-I581 PolarHBondContact O-N 3.16Å
578	C	96.5	Very high	94.4	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-59.3	-48	173.1	-172	0	0	0	0	111	L473 C531 L538 V574 Q575 A580 I581 M582	L473-C578 HydrophobicContact CD1-CB 4.33Å; L473-C578 HydrophobicContact CD2-CB 3.96Å; C531-C578 PolarHBondContact O-SG 3.33Å; L538-C578 HydrophobicContact CD1-CB 4.26Å; V574-C578 WeakPolarHBondContact O-CB 3.49Å; V574-C578 PolarHBondContact O-N 3.37Å; Q575-C578 WeakPolarHBondContact O-CB 3.11Å; Q575-C578 PolarHBondContact O-N 3.12Å; C578-A580 VanDerWaalsContact C-N 3.33Å; C578-A580 PolarHBondContact O-N 3.37Å; C578-I581 WeakPolarHBondContact O-CB 3.27Å; C578-I581 PolarHBondContact O-N 2.96Å; C578-I581 VanDerWaalsContact O-N 3.11Å; C578-M582 PolarHBondContact O-N 2.81Å
579	N	95.9	Very high	94.3	Very high	59 Å²	59	44.2 Å²	44.2	32%	0.316	23%	0.227	S	C	.	.	H	α-helix	trans	-61	-39.4	176.6	-66.5	-16	0	0	0	112.4	S535 Q575 R576 I581 M582 E583	S535-N579 PolarHBondContact OG-OD1 3.18Å; Q575-N579 WeakPolarHBondContact O-CB 3.44Å; Q575-N579 VanDerWaalsContact O-CG 3.23Å; Q575-N579 PolarHBondContact O-N 3.28Å; Q575-N579 PolarHBondContact O-ND2 3.26Å; R576-N579 PolarHBondContact O-N 3.28Å; N579-I581 VanDerWaalsContact C-N 3.33Å; N579-I581 PolarHBondContact O-N 3.43Å; N579-M582 HydrophobicContact CB-CE 4.22Å; N579-M582 WeakPolarHBondContact O-CB 3.49Å; N579-M582 PolarHBondContact O-N 3.28Å; N579-M582 WeakPolarHBondContact OD1-CE 3.44Å; N579-E583 WeakPolarHBondContact O-CG 3.47Å; N579-E583 PolarHBondContact O-N 2.96Å
580	A	95.9	Very high	94.2	Very high	62 Å²	62	42.5 Å²	42.5	51%	0.512	21%	0.212	S	C	.	.	H	α-helix	trans	-64.5	-36.4	175.2	0	0	0	0	0	112.9	R576 R577 C578 N584	R576-A580 PolarHBondContact O-N 3.17Å; R577-A580 PolarHBondContact O-N 3.17Å; C578-A580 VanDerWaalsContact C-N 3.33Å; C578-A580 PolarHBondContact O-N 3.37Å; A580-N584 WeakPolarHBondContact O-CB 3.24Å; A580-N584 PolarHBondContact O-N 3.09Å; A580-N584 VanDerWaalsContact O-N 3.11Å
581	I	95.3	Very high	94.1	Very high	18 Å²	18	44 Å²	44	9%	0.092	22%	0.219	C	C	.	.	H	α-helix	trans	-65.9	-44	174.7	-68.5	164.2	0	0	0	110.1	L473 K477 L480 R577 C578 N579 N584 G585	L473-I581 HydrophobicContact CB-CD1 3.91Å; L473-I581 HydrophobicContact CD2-CD1 4.34Å; L473-I581 HydrophobicContact CG-CD1 4.49Å; K477-I581 HydrophobicContact CB-CD1 4.19Å; K477-I581 HydrophobicContact CB-CG1 4.39Å; K477-I581 HydrophobicContact CB-CG2 4.4Å; K477-I581 HydrophobicContact CD-CG1 4.48Å; L480-I581 HydrophobicContact CD1-CG2 3.52Å; R577-I581 HydrophobicContact CG-CD1 4.47Å; R577-I581 WeakPolarHBondContact O-CG1 3.34Å; R577-I581 PolarHBondContact O-N 3.16Å; C578-I581 WeakPolarHBondContact O-CB 3.27Å; C578-I581 PolarHBondContact O-N 2.96Å; C578-I581 VanDerWaalsContact O-N 3.11Å; N579-I581 VanDerWaalsContact C-N 3.33Å; N579-I581 PolarHBondContact O-N 3.43Å; I581-N584 PolarHBondContact O-N 3.08Å; I581-G585 PolarHBondContact O-N 3.35Å
582	M	94.2	Very high	93.8	Very high	13 Å²	13	47.1 Å²	47.1	6%	0.064	24%	0.236	C	C	.	.	H	α-helix	trans	-59.4	-51.5	175.3	-70.9	-164.7	-75.8	0	0	112.8	C531 N532 C578 N579 N584 G585 V586 L649	C531-M582 HydrophobicContact CB-CG 3.27Å; C531-M582 HydrophobicContact CB-SD 4.01Å; N532-M582 WeakPolarHBondContact CA-SD 3.48Å; N532-M582 HydrophobicContact CB-SD 3.65Å; N532-M582 PolarHBondContact N-SD 2.96Å; C578-M582 PolarHBondContact O-N 2.81Å; N579-M582 HydrophobicContact CB-CE 4.22Å; N579-M582 WeakPolarHBondContact O-CB 3.49Å; N579-M582 PolarHBondContact O-N 3.28Å; N579-M582 WeakPolarHBondContact OD1-CE 3.44Å; M582-N584 PolarHBondContact O-N 3.46Å; M582-G585 WeakPolarHBondContact O-CA 3.4Å; M582-G585 PolarHBondContact O-N 2.8Å; M582-V586 WeakPolarHBondContact O-CG2 3.49Å; M582-V586 PolarHBondContact O-N 3.33Å; M582-L649 HydrophobicContact SD-CD2 4.27Å
583	E	94.3	Very high	93.3	Very high	77 Å²	77	44.7 Å²	44.7	36%	0.36	22%	0.223	S	C	.	.	H	α-helix	trans	-61.8	-34.8	-178.7	-75.5	-60.8	137.4	0	0	112	N579 G587 S652 R656	N579-E583 WeakPolarHBondContact O-CG 3.47Å; N579-E583 PolarHBondContact O-N 2.96Å; E583-G587 PolarHBondContact O-N 2.91Å; E583-S652 PolarHBondContact OE1-OG 2.79Å; E583-R656 IonicContact OE2-CZ 3.17Å; E583-R656 VanDerWaalsContact OE2-CZ 3.31Å; E583-R656 IonicContact OE2-NE 3.31Å; E583-R656 PolarHBondContact OE2-NE 3.26Å; E583-R656 VanDerWaalsContact OE2-NE 3.1Å; E583-R656 IonicContact OE2-NH2 2.7Å; E583-R656 PolarHBondContact OE2-NH2 3.43Å
584	N	93.8	Very high	93.2	Very high	93 Å²	93	41.5 Å²	41.5	50%	0.497	21%	0.206	S	C	.	.	H	α-helix	trans	-65.5	-46.3	171.2	-169.3	-39.6	0	0	0	111.2	A580 I581 M582 V586 G587 Q588	A580-N584 WeakPolarHBondContact O-CB 3.24Å; A580-N584 PolarHBondContact O-N 3.09Å; A580-N584 VanDerWaalsContact O-N 3.11Å; I581-N584 PolarHBondContact O-N 3.08Å; M582-N584 PolarHBondContact O-N 3.46Å; N584-V586 PolarHBondContact O-N 2.85Å; N584-G587 CarbonylContact O-C 3.59Å; N584-G587 WeakPolarHBondContact O-CA 2.93Å; N584-G587 PolarHBondContact O-N 3.13Å; N584-G587 VanDerWaalsContact O-N 3.13Å; N584-Q588 WeakPolarHBondContact O-CG 3.25Å; N584-Q588 PolarHBondContact O-N 2.69Å; N584-Q588 PolarHBondContact OD1-NE2 3.04Å
585	G	92.9	Very high	93	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.01	22%	0.215	C	C	.	.	H	α-helix	trans	-58.3	-46.1	177.1	0	0	0	0	0	113.2	I581 M582 G587 Q588 L589	I581-G585 PolarHBondContact O-N 3.35Å; M582-G585 WeakPolarHBondContact O-CA 3.4Å; M582-G585 PolarHBondContact O-N 2.8Å; G585-G587 VanDerWaalsContact C-N 3.33Å; G585-G587 PolarHBondContact O-N 2.79Å; G585-Q588 WeakPolarHBondContact O-CB 3.33Å; G585-Q588 PolarHBondContact O-N 3.31Å; G585-L589 PolarHBondContact O-N 3.16Å; G585-L589 VanDerWaalsContact O-N 3.15Å
586	V	93.9	Very high	92.7	Very high	1 Å²	1	44.8 Å²	44.8	1%	0.006	23%	0.226	C	C	.	.	H	α-helix	trans	-62.9	-41.9	173.8	-178.6	0	0	0	0	110.7	L528 M582 N584 Q588 L589 V590 L649 L653	L528-V586 HydrophobicContact CD2-CG2 4.1Å; M582-V586 WeakPolarHBondContact O-CG2 3.49Å; M582-V586 PolarHBondContact O-N 3.33Å; N584-V586 PolarHBondContact O-N 2.85Å; V586-Q588 VanDerWaalsContact C-N 3.28Å; V586-Q588 PolarHBondContact O-N 3.39Å; V586-L589 WeakPolarHBondContact O-CB 3.28Å; V586-L589 PolarHBondContact O-N 3.28Å; V586-L589 VanDerWaalsContact O-N 3.16Å; V586-V590 PolarHBondContact O-N 3.12Å; V586-V590 VanDerWaalsContact O-N 3.11Å; V586-L649 HydrophobicContact CG2-CD2 3.99Å; V586-L653 HydrophobicContact CG1-CB 4.04Å; V586-L653 HydrophobicContact CG1-CD1 4.09Å
587	G	92.8	Very high	92.4	Very high	20 Å²	20	39 Å²	39	21%	0.206	20%	0.204	C	C	.	.	H	α-helix	trans	-57	-39.1	173.9	0	0	0	0	0	113.2	E583 N584 G585 V590 Q591	E583-G587 PolarHBondContact O-N 2.91Å; N584-G587 CarbonylContact O-C 3.59Å; N584-G587 WeakPolarHBondContact O-CA 2.93Å; N584-G587 PolarHBondContact O-N 3.13Å; N584-G587 VanDerWaalsContact O-N 3.13Å; G585-G587 VanDerWaalsContact C-N 3.33Å; G585-G587 PolarHBondContact O-N 2.79Å; G587-V590 PolarHBondContact O-N 3.19Å; G587-Q591 VanDerWaalsContact O-CB 3.26Å; G587-Q591 WeakPolarHBondContact O-CB 3.36Å; G587-Q591 PolarHBondContact O-N 2.96Å
588	Q	90.6	Very high	92.3	Very high	26 Å²	26	33.2 Å²	33.2	12%	0.121	18%	0.182	C	C	.	.	H	α-helix	trans	-67	-37.8	175.8	-68.9	179	29.3	0	0	112.6	L480 P482 L485 F524 N584 G585 V586 Q591 N592	L480-Q588 PolarHBondContact O-NE2 3.47Å; L480-Q588 VanDerWaalsContact O-NE2 3.11Å; L480-Q588 PolarHBondContact O-OE1 3.14Å; P482-Q588 HydrophobicContact CG-CG 4.21Å; L485-Q588 HydrophobicContact CD1-CB 4.2Å; F524-Q588 HydrophobicContact CZ-CB 4.18Å; N584-Q588 WeakPolarHBondContact O-CG 3.25Å; N584-Q588 PolarHBondContact O-N 2.69Å; N584-Q588 PolarHBondContact OD1-NE2 3.04Å; G585-Q588 WeakPolarHBondContact O-CB 3.33Å; G585-Q588 PolarHBondContact O-N 3.31Å; V586-Q588 VanDerWaalsContact C-N 3.28Å; V586-Q588 PolarHBondContact O-N 3.39Å; Q588-Q591 PolarHBondContact O-N 3.47Å; Q588-N592 VanDerWaalsContact O-CB 3.29Å; Q588-N592 WeakPolarHBondContact O-CB 3.45Å; Q588-N592 PolarHBondContact O-N 3.27Å; Q588-N592 PolarHBondContact O-ND2 2.96Å
589	L	90.6	Very high	92.2	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-61.4	-45.6	174	-69.6	175.5	0	0	0	111.3	L485 F524 F525 L528 G585 V586 C593 V594 L645 L653	L485-L589 HydrophobicContact CD1-CD2 4.2Å; L485-L589 HydrophobicContact CD2-CD2 3.6Å; F524-L589 HydrophobicContact CD1-CD2 4.06Å; F524-L589 HydrophobicContact CE1-CD1 4.31Å; F524-L589 HydrophobicContact CE1-CD2 3.7Å; F524-L589 HydrophobicContact CE1-CG 3.78Å; F525-L589 HydrophobicContact CE1-CD1 4.01Å; F525-L589 HydrophobicContact CE1-CD2 3.81Å; F525-L589 HydrophobicContact CZ-CD2 3.95Å; L528-L589 HydrophobicContact CD2-CD1 3.7Å; G585-L589 PolarHBondContact O-N 3.16Å; G585-L589 VanDerWaalsContact O-N 3.15Å; V586-L589 WeakPolarHBondContact O-CB 3.28Å; V586-L589 PolarHBondContact O-N 3.28Å; V586-L589 VanDerWaalsContact O-N 3.16Å; L589-C593 WeakPolarHBondContact O-CA 3.17Å; L589-C593 WeakPolarHBondContact O-CB 3.42Å; L589-C593 PolarHBondContact O-N 3.23Å; L589-V594 PolarHBondContact O-N 3.35Å; L589-L645 HydrophobicContact CD1-CD1 4.24Å; L589-L645 HydrophobicContact CD1-CD2 4.31Å; L589-L653 HydrophobicContact CB-CD1 4.11Å
590	V	92.1	Very high	92	Very high	7 Å²	7	42.1 Å²	42.1	4%	0.042	22%	0.224	C	C	.	.	I	π-helix	trans	-64.3	-48.8	177.7	178.6	0	0	0	0	110.7	V586 G587 N592 V594 K595 L653 R656 V657 E660	V586-V590 PolarHBondContact O-N 3.12Å; V586-V590 VanDerWaalsContact O-N 3.11Å; G587-V590 PolarHBondContact O-N 3.19Å; V590-N592 PolarHBondContact O-N 3.15Å; V590-V594 PolarHBondContact O-N 3.36Å; V590-K595 VanDerWaalsContact O-CB 3.25Å; V590-K595 WeakPolarHBondContact O-CB 3.5Å; V590-K595 PolarHBondContact O-N 3.22Å; V590-L653 HydrophobicContact CG2-CD1 3.56Å; V590-R656 HydrophobicContact CG2-CB 3.82Å; V590-V657 HydrophobicContact CG2-CG2 4.1Å; V590-E660 HydrophobicContact CG1-CB 4.02Å; V590-E660 HydrophobicContact CG1-CG 4.2Å
591	Q	90.9	Very high	91.9	Very high	94 Å²	94	39.3 Å²	39.3	44%	0.439	20%	0.2	S	C	.	.	I	π-helix	trans	-67.5	-36.6	-174.4	-179.9	58	37.7	0	0	113.2	G587 Q588	G587-Q591 VanDerWaalsContact O-CB 3.26Å; G587-Q591 WeakPolarHBondContact O-CB 3.36Å; G587-Q591 PolarHBondContact O-N 2.96Å; Q588-Q591 PolarHBondContact O-N 3.47Å
592	N	87.1	Confident	91.8	Very high	67 Å²	67	38.5 Å²	38.5	36%	0.358	20%	0.197	S	C	.	.	I	π-helix	trans	-102.3	-29.3	-172.7	-58.4	-48.7	0	0	0	113.6	L485 Q588 V590	L485-N592 HydrophobicContact CD1-CB 4.31Å; Q588-N592 VanDerWaalsContact O-CB 3.29Å; Q588-N592 WeakPolarHBondContact O-CB 3.45Å; Q588-N592 PolarHBondContact O-N 3.27Å; Q588-N592 PolarHBondContact O-ND2 2.96Å; V590-N592 PolarHBondContact O-N 3.15Å
593	C	85.6	Confident	91.7	Very high	1 Å²	1	41 Å²	41	1%	0.007	21%	0.21	C	C	.	.	I	π-helix	trans	-105.3	-44.5	-174.5	-50.7	0	0	0	0	112.4	Y487 L589 R597 M641	Y487-C593 WeakPolarHBondContact CB-SG 3.48Å; Y487-C593 HydrophobicContact CD1-CB 3.96Å; Y487-C593 HydrophobicContact CD2-CB 4.18Å; Y487-C593 HydrophobicContact CE1-CB 4.47Å; Y487-C593 HydrophobicContact CG-CB 3.77Å; L589-C593 WeakPolarHBondContact O-CA 3.17Å; L589-C593 WeakPolarHBondContact O-CB 3.42Å; L589-C593 PolarHBondContact O-N 3.23Å; C593-R597 PolarHBondContact O-NH1 3.09Å; C593-M641 HydrophobicContact CB-CE 3.38Å
594	V	90.7	Very high	91.6	Very high	2 Å²	2	38.5 Å²	38.5	1%	0.012	20%	0.2	C	C	.	.	I	π-helix	trans	-85.7	-54.3	-175.7	-175.1	0	0	0	0	111.4	L589 V590 R597 L598 L634 V637 M641 V657	L589-V594 PolarHBondContact O-N 3.35Å; V590-V594 PolarHBondContact O-N 3.36Å; V594-R597 PolarHBondContact O-N 3.44Å; V594-L598 HydrophobicContact CG1-CB 4.48Å; V594-L598 HydrophobicContact CG1-CD2 4.41Å; V594-L598 VanDerWaalsContact O-CB 3.3Å; V594-L598 WeakPolarHBondContact O-CB 3.25Å; V594-L598 PolarHBondContact O-N 3.14Å; V594-L634 HydrophobicContact CG1-CD2 4.05Å; V594-V637 HydrophobicContact CG2-CG1 3.96Å; V594-M641 HydrophobicContact CG2-CE 4.17Å; V594-M641 HydrophobicContact CG2-SD 4.34Å; V594-V657 HydrophobicContact CB-CG2 4.42Å; V594-V657 HydrophobicContact CG1-CG1 4.18Å; V594-V657 HydrophobicContact CG1-CG2 4.02Å; V594-V657 HydrophobicContact CG2-CG2 4.03Å
595	K	92.5	Very high	91.5	Very high	46 Å²	46	34.1 Å²	34.1	20%	0.2	18%	0.177	C	C	.	.	H	α-helix	trans	-57.2	-42	-171	-176.6	-176.9	-168.5	138.6	0	114.7	V590 L598 K599 E660 L664	V590-K595 VanDerWaalsContact O-CB 3.25Å; V590-K595 WeakPolarHBondContact O-CB 3.5Å; V590-K595 PolarHBondContact O-N 3.22Å; K595-L598 PolarHBondContact O-N 3.38Å; K595-K599 VanDerWaalsContact O-CB 3.29Å; K595-K599 WeakPolarHBondContact O-CB 3.42Å; K595-K599 PolarHBondContact O-N 3.15Å; K595-E660 HydrophobicContact CB-CG 4.29Å; K595-E660 HydrophobicContact CD-CG 4.41Å; K595-E660 WeakPolarHBondContact CD-OE1 3.4Å; K595-E660 WeakPolarHBondContact CE-OE1 3.46Å; K595-E660 HydrophobicContact CG-CG 4.14Å; K595-E660 IonicContact NZ-OE1 3.88Å; K595-E660 PolarHBondContact NZ-OE1 3.4Å; K595-E660 IonicContact NZ-OE2 2.99Å; K595-E660 PolarHBondContact NZ-OE2 3.42Å; K595-L664 HydrophobicContact CG-CD1 4.28Å
596	P	90.3	Very high	91.5	Very high	62 Å²	62	38.6 Å²	38.6	40%	0.403	20%	0.196	S	C	.	.	H	α-helix	trans	-64	-41.6	178.2	-23.7	36.1	0	0	0	112.9	K599 L600	P596-K599 PolarHBondContact O-N 3.31Å; P596-L600 WeakPolarHBondContact O-CG 3.47Å; P596-L600 PolarHBondContact O-N 2.91Å
597	R	89.9	Confident	91.2	Very high	47 Å²	47	44.8 Å²	44.8	18%	0.177	23%	0.229	C	C	.	.	H	α-helix	trans	-69.9	-43.8	177.8	-67.1	179.6	176	78	7.6	111.2	Y487 D492 C593 V594 K599 L600 A601 T633 V637	Y487-R597 PolarHBondContact O-NH2 3.4Å; D492-R597 IonicContact OD2-NH2 2.78Å; D492-R597 PolarHBondContact OD2-NH2 2.81Å; C593-R597 PolarHBondContact O-NH1 3.09Å; V594-R597 PolarHBondContact O-N 3.44Å; R597-K599 VanDerWaalsContact C-N 3.26Å; R597-K599 PolarHBondContact O-N 2.74Å; R597-L600 WeakPolarHBondContact O-CB 3.31Å; R597-L600 PolarHBondContact O-N 2.83Å; R597-L600 VanDerWaalsContact O-N 3.17Å; R597-A601 PolarHBondContact O-N 2.9Å; R597-T633 HydrophobicContact CB-CG2 3.73Å; R597-V637 VanDerWaalsContact CD-CG2 3.42Å
598	L	93.6	Very high	90.9	Very high	1 Å²	1	45.4 Å²	45.4	1%	0.005	23%	0.227	C	C	.	.	H	α-helix	trans	-61.4	-36.9	175.7	-174.2	57.9	0	0	0	111.5	V594 K595 A601 T602 I630 L634 T661 L664	V594-L598 HydrophobicContact CG1-CB 4.48Å; V594-L598 HydrophobicContact CG1-CD2 4.41Å; V594-L598 VanDerWaalsContact O-CB 3.3Å; V594-L598 WeakPolarHBondContact O-CB 3.25Å; V594-L598 PolarHBondContact O-N 3.14Å; K595-L598 PolarHBondContact O-N 3.38Å; L598-A601 PolarHBondContact O-N 3.38Å; L598-T602 VanDerWaalsContact O-CB 3.29Å; L598-T602 WeakPolarHBondContact O-CB 3.4Å; L598-T602 PolarHBondContact O-N 3.47Å; L598-T602 PolarHBondContact O-OG1 3.34Å; L598-I630 HydrophobicContact CD1-CG1 4.44Å; L598-I630 HydrophobicContact CD1-CG2 3.8Å; L598-L634 HydrophobicContact CD1-CD2 4.14Å; L598-L634 HydrophobicContact CD1-CG 4.3Å; L598-L634 HydrophobicContact CD2-CD2 4.49Å; L598-T661 HydrophobicContact CD1-CG2 4.41Å; L598-T661 WeakPolarHBondContact CD2-OG1 3.38Å; L598-L664 HydrophobicContact CB-CD1 4.04Å; L598-L664 HydrophobicContact CD2-CD1 3.76Å; L598-L664 HydrophobicContact CG-CD1 3.68Å
599	K	93.6	Very high	90.8	Very high	120 Å²	120	47.2 Å²	47.2	52%	0.522	24%	0.24	S	C	.	.	H	α-helix	trans	-62.8	-45.4	173.6	-172.9	-179	176.2	-171	0	111.8	K595 P596 R597 A601 T602 D603	K595-K599 VanDerWaalsContact O-CB 3.29Å; K595-K599 WeakPolarHBondContact O-CB 3.42Å; K595-K599 PolarHBondContact O-N 3.15Å; P596-K599 PolarHBondContact O-N 3.31Å; R597-K599 VanDerWaalsContact C-N 3.26Å; R597-K599 PolarHBondContact O-N 2.74Å; K599-A601 VanDerWaalsContact C-N 3.33Å; K599-A601 PolarHBondContact O-N 3.33Å; K599-T602 CarbonylContact O-C 3.55Å; K599-T602 PolarHBondContact O-N 2.83Å; K599-D603 VanDerWaalsContact O-CG 3.23Å; K599-D603 PolarHBondContact O-N 3.27Å
600	L	91.8	Very high	90.8	Very high	126 Å²	126	48.5 Å²	48.5	66%	0.66	25%	0.245	S	C	*	.	H	α-helix	trans	-60.8	-41.6	175.1	-67.5	172.5	0	0	0	112.1	P596 R597 T602 D603	P596-L600 WeakPolarHBondContact O-CG 3.47Å; P596-L600 PolarHBondContact O-N 2.91Å; R597-L600 WeakPolarHBondContact O-CB 3.31Å; R597-L600 PolarHBondContact O-N 2.83Å; R597-L600 VanDerWaalsContact O-N 3.17Å; L600-T602 VanDerWaalsContact C-N 3.35Å; L600-D603 PolarHBondContact O-N 2.92Å
601	A	93.5	Very high	90.7	Very high	3 Å²	3	49.7 Å²	49.7	3%	0.025	25%	0.254	C	S	.	.	H	α-helix	trans	-65	-40.5	174.6	0	0	0	0	0	111.7	R597 L598 K599 D603 T604 I630 T633	R597-A601 PolarHBondContact O-N 2.9Å; L598-A601 PolarHBondContact O-N 3.38Å; K599-A601 VanDerWaalsContact C-N 3.33Å; K599-A601 PolarHBondContact O-N 3.33Å; A601-D603 VanDerWaalsContact C-N 3.32Å; A601-D603 PolarHBondContact O-N 3.04Å; A601-T604 WeakPolarHBondContact O-CB 3.38Å; A601-T604 WeakPolarHBondContact O-CG2 3.4Å; A601-T604 PolarHBondContact O-N 3.27Å; A601-T604 PolarHBondContact O-OG1 3.41Å; A601-I630 HydrophobicContact CB-CG1 4.13Å; A601-T633 HydrophobicContact CB-CG2 4.2Å; A601-T633 WeakPolarHBondContact CB-OG1 3.27Å
602	T	93.9	Very high	90.7	Very high	2 Å²	2	45.3 Å²	45.3	1%	0.012	23%	0.234	C	C	.	.	H	α-helix	trans	-70.4	-29.8	179.2	-50	0	0	0	0	111.5	L598 K599 L600 T604 F605 F626 L664 V665 V668	L598-T602 VanDerWaalsContact O-CB 3.29Å; L598-T602 WeakPolarHBondContact O-CB 3.4Å; L598-T602 PolarHBondContact O-N 3.47Å; L598-T602 PolarHBondContact O-OG1 3.34Å; K599-T602 CarbonylContact O-C 3.55Å; K599-T602 PolarHBondContact O-N 2.83Å; L600-T602 VanDerWaalsContact C-N 3.35Å; T602-T604 PolarHBondContact O-N 3.46Å; T602-F605 WeakPolarHBondContact O-CB 3.49Å; T602-F605 PolarHBondContact O-N 3.02Å; T602-F605 VanDerWaalsContact O-N 3.08Å; T602-F626 HydrophobicContact CG2-CE2 4.14Å; T602-F626 HydrophobicContact CG2-CZ 4.34Å; T602-L664 HydrophobicContact CG2-CB 4.37Å; T602-V665 HydrophobicContact CG2-CG2 4.47Å; T602-V668 HydrophobicContact CG2-CB 4.12Å; T602-V668 HydrophobicContact CG2-CG1 3.59Å; T602-V668 HydrophobicContact CG2-CG2 3.39Å
603	D	92.4	Very high	90.9	Very high	64 Å²	64	45.5 Å²	45.5	34%	0.342	24%	0.235	S	C	.	.	H	α-helix	trans	-66.7	-17.1	176.1	-72.7	-25.6	0	0	0	112.4	K599 L600 A601 F605 F606	K599-D603 VanDerWaalsContact O-CG 3.23Å; K599-D603 PolarHBondContact O-N 3.27Å; L600-D603 PolarHBondContact O-N 2.92Å; A601-D603 VanDerWaalsContact C-N 3.32Å; A601-D603 PolarHBondContact O-N 3.04Å; D603-F605 PolarHBondContact O-N 2.8Å; D603-F605 VanDerWaalsContact O-N 3.12Å; D603-F606 PolarHBondContact O-N 3.5Å
604	T	91.3	Very high	91.1	Very high	25 Å²	25	52.9 Å²	52.9	15%	0.153	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-61.3	-17.9	170.7	68	0	0	0	0	113.1	A601 T602 F606 N607 S629	A601-T604 WeakPolarHBondContact O-CB 3.38Å; A601-T604 WeakPolarHBondContact O-CG2 3.4Å; A601-T604 PolarHBondContact O-N 3.27Å; A601-T604 PolarHBondContact O-OG1 3.41Å; T602-T604 PolarHBondContact O-N 3.46Å; T604-F606 PolarHBondContact O-N 3.2Å; T604-N607 WeakPolarHBondContact O-CB 3.19Å; T604-N607 PolarHBondContact O-N 3.17Å; T604-S629 WeakPolarHBondContact CG2-OG 3.31Å
605	F	92.1	Very high	91	Very high	2 Å²	2	57.4 Å²	57.4	1%	0.009	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-49.4	-42.5	171.5	-170.1	-106	0	0	0	112	T602 D603 N607 H610 F626 V668 V669 Y674 L682	T602-F605 WeakPolarHBondContact O-CB 3.49Å; T602-F605 PolarHBondContact O-N 3.02Å; T602-F605 VanDerWaalsContact O-N 3.08Å; D603-F605 PolarHBondContact O-N 2.8Å; D603-F605 VanDerWaalsContact O-N 3.12Å; F605-N607 PolarHBondContact O-N 3.17Å; F605-H610 AromaticContact CD1-CE1 3.86Å; F605-H610 AromaticContact CD1-NE2 3.39Å; F605-H610 WeakPolarHBondContact CD1-NE2 3.37Å; F605-H610 AromaticContact CD2-CE1 3.69Å; F605-H610 AromaticContact CE1-CD2 3.61Å; F605-H610 AromaticContact CE1-CE1 3.5Å; F605-H610 AromaticContact CE1-NE2 3.04Å; F605-H610 WeakPolarHBondContact CE1-NE2 3.33Å; F605-H610 AromaticContact CE2-CE1 3.29Å; F605-H610 WeakPolarHBondContact CE2-CE1 3.4Å; F605-H610 AromaticContact CE2-ND1 3.83Å; F605-H610 AromaticContact CE2-NE2 3.78Å; F605-H610 AromaticContact CG-CE1 3.92Å; F605-H610 AromaticContact CG-NE2 3.88Å; F605-H610 AromaticContact CZ-CD2 3.7Å; F605-H610 AromaticContact CZ-CE1 3.14Å; F605-H610 WeakPolarHBondContact CZ-CE1 3.49Å; F605-H610 AromaticContact CZ-CG 3.89Å; F605-H610 AromaticContact CZ-ND1 3.56Å; F605-H610 AromaticContact CZ-NE2 3.2Å; F605-H610 WeakPolarHBondContact CZ-NE2 3.25Å; F605-H610 PolarHBondContact O-CE1 3.06Å; F605-H610 PolarHBondContact O-NE2 3.06Å; F605-F626 HydrophobicContact CB-CD2 3.82Å; F605-F626 HydrophobicContact CB-CE2 3.61Å; F605-F626 HydrophobicContact CB-CZ 4.33Å; F605-F626 HydrophobicContact CD2-CD1 4.13Å; F605-F626 AromaticContact CD2-CD2 3.99Å; F605-F626 HydrophobicContact CD2-CD2 3.99Å; F605-F626 AromaticContact CD2-CE1 3.95Å; F605-F626 HydrophobicContact CD2-CE1 3.95Å; F605-F626 AromaticContact CD2-CE2 3.81Å; F605-F626 HydrophobicContact CD2-CE2 3.81Å; F605-F626 HydrophobicContact CD2-CG 4.14Å; F605-F626 AromaticContact CD2-CZ 3.78Å; F605-F626 HydrophobicContact CD2-CZ 3.78Å; F605-F626 HydrophobicContact CG-CD2 4.44Å; F605-F626 HydrophobicContact CG-CE2 4.15Å; F605-F626 HydrophobicContact CG-CZ 4.42Å; F605-V668 HydrophobicContact CB-CB 4.2Å; F605-V668 HydrophobicContact CB-CG2 3.95Å; F605-V668 HydrophobicContact CD1-CB 3.86Å; F605-V668 HydrophobicContact CD1-CG2 3.95Å; F605-V668 HydrophobicContact CD2-CG2 4.26Å; F605-V668 HydrophobicContact CG-CB 4.11Å; F605-V668 HydrophobicContact CG-CG2 3.77Å; F605-V669 HydrophobicContact CE2-CG2 4.39Å; F605-V669 HydrophobicContact CZ-CG2 4.29Å; F605-Y674 HydrophobicContact CZ-CE1 4.1Å; F605-Y674 AromaticContact CZ-CZ 3.98Å; F605-Y674 WeakPolarHBondContact CZ-OH 3.29Å; F605-L682 HydrophobicContact CE2-CD1 4.04Å
606	F	91.6	Very high	90.9	Very high	95 Å²	95	58.8 Å²	58.8	42%	0.417	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-78.2	-2.7	-175.8	-57.5	-66.7	0	0	0	114.5	D603 T604 V668 K671	D603-F606 PolarHBondContact O-N 3.5Å; T604-F606 PolarHBondContact O-N 3.2Å; F606-V668 HydrophobicContact CE2-CB 4.17Å; F606-V668 HydrophobicContact CE2-CG1 3.81Å; F606-V668 HydrophobicContact CZ-CB 3.86Å; F606-V668 HydrophobicContact CZ-CG1 3.92Å; F606-K671 HydrophobicContact CE1-CB 3.96Å; F606-K671 HydrophobicContact CZ-CB 4.09Å; F606-K671 HydrophobicContact CZ-CD 4Å
607	N	89.4	Confident	91	Very high	131 Å²	131	56.8 Å²	56.8	70%	0.701	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-83	-16.2	179.5	-64.5	-20.6	0	0	0	112.8	T604 F605	T604-N607 WeakPolarHBondContact O-CB 3.19Å; T604-N607 PolarHBondContact O-N 3.17Å; F605-N607 PolarHBondContact O-N 3.17Å
608	E	86.2	Confident	91	Very high	33 Å²	33	58.1 Å²	58.1	15%	0.154	31%	0.305	C	S	.	.	S	Bend	trans	-115.1	154.8	-176.7	-63.9	-174.7	159.3	0	0	110.9	L620 V625	E608-L620 HydrophobicContact CB-CD2 3.98Å; E608-L620 HydrophobicContact CG-CD2 3.96Å; E608-V625 WeakPolarHBondContact OE1-CG2 3.35Å
609	T	88.4	Confident	90.8	Very high	64 Å²	64	64.8 Å²	64.8	39%	0.393	34%	0.336	S	S	.	.			trans	-78.1	136.5	174.3	-179.4	0	0	0	0	110.6	S611 P612 L620	T609-S611 PolarHBondContact OG1-N 3.14Å; T609-P612 HydrophobicContact CG2-CB 4.39Å; T609-L620 HydrophobicContact CG2-CD1 3.98Å
610	H	89.9	Confident	90.7	Very high	26 Å²	26	60.1 Å²	60.1	12%	0.12	32%	0.317	C	S	.	.	S	Bend	trans	-102.3	9.2	173.2	-50.8	-58.7	0	0	0	112.9	F605 T673 Y674 N675 G678	F605-H610 AromaticContact CD1-CE1 3.86Å; F605-H610 AromaticContact CD1-NE2 3.39Å; F605-H610 WeakPolarHBondContact CD1-NE2 3.37Å; F605-H610 AromaticContact CD2-CE1 3.69Å; F605-H610 AromaticContact CE1-CD2 3.61Å; F605-H610 AromaticContact CE1-CE1 3.5Å; F605-H610 AromaticContact CE1-NE2 3.04Å; F605-H610 WeakPolarHBondContact CE1-NE2 3.33Å; F605-H610 AromaticContact CE2-CE1 3.29Å; F605-H610 WeakPolarHBondContact CE2-CE1 3.4Å; F605-H610 AromaticContact CE2-ND1 3.83Å; F605-H610 AromaticContact CE2-NE2 3.78Å; F605-H610 AromaticContact CG-CE1 3.92Å; F605-H610 AromaticContact CG-NE2 3.88Å; F605-H610 AromaticContact CZ-CD2 3.7Å; F605-H610 AromaticContact CZ-CE1 3.14Å; F605-H610 WeakPolarHBondContact CZ-CE1 3.49Å; F605-H610 AromaticContact CZ-CG 3.89Å; F605-H610 AromaticContact CZ-ND1 3.56Å; F605-H610 AromaticContact CZ-NE2 3.2Å; F605-H610 WeakPolarHBondContact CZ-NE2 3.25Å; F605-H610 PolarHBondContact O-CE1 3.06Å; F605-H610 PolarHBondContact O-NE2 3.06Å; H610-T673 CarbonylContact C-O 3.54Å; H610-T673 WeakPolarHBondContact CB-O 3.47Å; H610-Y674 HydrophobicContact CB-CD1 3.63Å; H610-Y674 HydrophobicContact CB-CE1 3.68Å; H610-Y674 HydrophobicContact CB-CG 4.44Å; H610-Y674 AromaticContact CG-CE1 3.94Å; H610-Y674 WeakPolarHBondContact O-CA 3.2Å; H610-N675 PolarHBondContact O-N 3.47Å; H610-G678 WeakPolarHBondContact O-CA 3.25Å
611	S	90.7	Very high	90.5	Very high	32 Å²	32	58 Å²	58	22%	0.224	30%	0.303	C	S	.	.	S	Bend	trans	-124.6	59	172	-63.8	0	0	0	0	111.4	T609 T673 N675	T609-S611 PolarHBondContact OG1-N 3.14Å; S611-T673 PolarHBondContact OG-O 2.87Å; S611-T673 VanDerWaalsContact OG-O 3.09Å; S611-N675 PolarHBondContact O-ND2 3.01Å; S611-N675 PolarHBondContact OG-N 3.33Å
612	P	91.4	Very high	90.3	Very high	2 Å²	2	62.1 Å²	62.1	1%	0.013	34%	0.338	C	S	.	.			trans	-74.6	154.4	-173	31.8	-37.5	0	0	0	113.2	T609 E616 Y617 L620 N675 L677	T609-P612 HydrophobicContact CG2-CB 4.39Å; P612-E616 WeakPolarHBondContact CA-OE2 3.35Å; P612-E616 HydrophobicContact CB-CB 3.72Å; P612-Y617 HydrophobicContact CG-CD2 4.5Å; P612-L620 HydrophobicContact CB-CD1 4.04Å; P612-L620 HydrophobicContact CG-CD1 4.45Å; P612-N675 WeakPolarHBondContact CD-OD1 3.32Å; P612-N675 PolarHBondContact O-ND2 3.2Å; P612-L677 HydrophobicContact CG-CB 4.09Å
613	N	90.5	Very high	89.9	Confident	72 Å²	72	70 Å²	70	39%	0.385	37%	0.367	S	S	.	.			trans	-79.8	176	159.6	61.7	37.9	0	0	0	111.2	T615 E616 Y617	N613-T615 VanDerWaalsContact C-N 3.3Å; N613-T615 PolarHBondContact O-N 3.22Å; N613-T615 PolarHBondContact OD1-N 3.07Å; N613-T615 PolarHBondContact OD1-OG1 3.08Å; N613-E616 PolarHBondContact N-OE2 2.76Å; N613-E616 VanDerWaalsContact ND2-CD 3.26Å; N613-E616 PolarHBondContact ND2-OE1 3.2Å; N613-E616 PolarHBondContact O-N 3.27Å; N613-E616 VanDerWaalsContact OD1-CB 3.28Å; N613-E616 WeakPolarHBondContact OD1-CB 3.29Å; N613-E616 WeakPolarHBondContact OD1-CG 3.24Å; N613-E616 PolarHBondContact OD1-N 3.37Å; N613-Y617 VanDerWaalsContact O-CB 3.24Å; N613-Y617 WeakPolarHBondContact O-CB 3Å; N613-Y617 PolarHBondContact O-N 3.2Å
614	E	89.4	Confident	89.7	Confident	156 Å²	156	67.9 Å²	67.9	73%	0.729	36%	0.356	S	S	*	.	H	α-helix	trans	-59.9	-36.1	-176.6	-70.9	179.7	177.5	0	0	113.8	S618 L677	E614-S618 PolarHBondContact O-N 3.42Å; E614-S618 PolarHBondContact O-OG 3.28Å; E614-L677 HydrophobicContact CG-CD1 4.15Å
615	T	89.5	Confident	89.6	Confident	97 Å²	97	68.6 Å²	68.6	60%	0.595	36%	0.36	S	S	*	.	H	α-helix	trans	-71.3	-46.7	177.8	43.4	0	0	0	0	111.8	N613 Y617 S618 E619	N613-T615 VanDerWaalsContact C-N 3.3Å; N613-T615 PolarHBondContact O-N 3.22Å; N613-T615 PolarHBondContact OD1-N 3.07Å; N613-T615 PolarHBondContact OD1-OG1 3.08Å; T615-Y617 VanDerWaalsContact C-N 3.32Å; T615-Y617 PolarHBondContact O-N 3.09Å; T615-S618 PolarHBondContact O-N 3.42Å; T615-E619 PolarHBondContact O-N 2.92Å; T615-E619 VanDerWaalsContact O-N 3.16Å
616	E	90.5	Very high	89.6	Confident	74 Å²	74	68.7 Å²	68.7	35%	0.346	36%	0.36	S	S	.	.	H	α-helix	trans	-64.2	-38.1	176.5	-72.8	164	-168.2	0	0	111.3	P612 N613 S618 E619 L620	P612-E616 WeakPolarHBondContact CA-OE2 3.35Å; P612-E616 HydrophobicContact CB-CB 3.72Å; N613-E616 PolarHBondContact N-OE2 2.76Å; N613-E616 VanDerWaalsContact ND2-CD 3.26Å; N613-E616 PolarHBondContact ND2-OE1 3.2Å; N613-E616 PolarHBondContact O-N 3.27Å; N613-E616 VanDerWaalsContact OD1-CB 3.28Å; N613-E616 WeakPolarHBondContact OD1-CB 3.29Å; N613-E616 WeakPolarHBondContact OD1-CG 3.24Å; N613-E616 PolarHBondContact OD1-N 3.37Å; E616-S618 VanDerWaalsContact C-N 3.32Å; E616-S618 PolarHBondContact O-N 3.35Å; E616-E619 PolarHBondContact O-N 3.23Å; E616-L620 WeakPolarHBondContact O-CB 3.5Å; E616-L620 WeakPolarHBondContact O-CG 3.28Å; E616-L620 PolarHBondContact O-N 2.94Å
617	Y	90.9	Very high	89.8	Confident	21 Å²	21	64.2 Å²	64.2	8%	0.082	34%	0.341	C	S	.	.	H	α-helix	trans	-59.9	-44.1	176.5	169.6	-87.4	0	0	0	110.9	P612 N613 T615 E619 L620 E621 L677 L680 L681 K684	P612-Y617 HydrophobicContact CG-CD2 4.5Å; N613-Y617 VanDerWaalsContact O-CB 3.24Å; N613-Y617 WeakPolarHBondContact O-CB 3Å; N613-Y617 PolarHBondContact O-N 3.2Å; T615-Y617 VanDerWaalsContact C-N 3.32Å; T615-Y617 PolarHBondContact O-N 3.09Å; Y617-E619 PolarHBondContact O-N 3.24Å; Y617-L620 PolarHBondContact O-N 3.1Å; Y617-E621 WeakPolarHBondContact CE1-OE2 3.48Å; Y617-E621 VanDerWaalsContact O-CB 3.26Å; Y617-E621 WeakPolarHBondContact O-CB 3.29Å; Y617-E621 PolarHBondContact O-N 3.01Å; Y617-E621 PolarHBondContact OH-OE2 3.4Å; Y617-L677 HydrophobicContact CD2-CB 3.84Å; Y617-L677 HydrophobicContact CD2-CD2 4.35Å; Y617-L677 WeakPolarHBondContact CD2-O 3.48Å; Y617-L677 WeakPolarHBondContact CE2-O 3.42Å; Y617-L677 HydrophobicContact CG-CB 4.29Å; Y617-L677 HydrophobicContact CG-CD2 4.4Å; Y617-L680 HydrophobicContact CE2-CD2 4.45Å; Y617-L681 HydrophobicContact CD2-CB 4.24Å; Y617-L681 HydrophobicContact CE2-CB 3.89Å; Y617-K684 PolarHBondContact OH-NZ 3.47Å
618	S	90.3	Very high	90	Very high	74 Å²	74	63.9 Å²	63.9	52%	0.517	34%	0.335	S	S	.	.	H	α-helix	trans	-66	-37.6	178.8	-56.8	0	0	0	0	112.2	E614 T615 E616 A622	E614-S618 PolarHBondContact O-N 3.42Å; E614-S618 PolarHBondContact O-OG 3.28Å; T615-S618 PolarHBondContact O-N 3.42Å; E616-S618 VanDerWaalsContact C-N 3.32Å; E616-S618 PolarHBondContact O-N 3.35Å; S618-A622 WeakPolarHBondContact O-CB 3.26Å; S618-A622 PolarHBondContact O-N 2.85Å
619	E	90.5	Very high	90.3	Very high	141 Å²	141	63.7 Å²	63.7	66%	0.659	34%	0.337	S	S	*	.	H	α-helix	trans	-69.9	-43.4	176.3	-70.2	179.4	179.4	0	0	112.5	T615 E616 Y617 A622 R623	T615-E619 PolarHBondContact O-N 2.92Å; T615-E619 VanDerWaalsContact O-N 3.16Å; E616-E619 PolarHBondContact O-N 3.23Å; Y617-E619 PolarHBondContact O-N 3.24Å; E619-A622 PolarHBondContact O-N 3.26Å; E619-R623 WeakPolarHBondContact O-CB 3.46Å; E619-R623 PolarHBondContact O-N 3.13Å; E619-R623 VanDerWaalsContact O-N 3.13Å
620	L	89.6	Confident	90.7	Very high	23 Å²	23	60.6 Å²	60.6	12%	0.12	32%	0.319	C	S	.	.	H	α-helix	trans	-67.5	-40	177.9	-69.8	170.9	0	0	0	111.8	E608 T609 P612 E616 Y617 A622 R623 N624 L681	E608-L620 HydrophobicContact CB-CD2 3.98Å; E608-L620 HydrophobicContact CG-CD2 3.96Å; T609-L620 HydrophobicContact CG2-CD1 3.98Å; P612-L620 HydrophobicContact CB-CD1 4.04Å; P612-L620 HydrophobicContact CG-CD1 4.45Å; E616-L620 WeakPolarHBondContact O-CB 3.5Å; E616-L620 WeakPolarHBondContact O-CG 3.28Å; E616-L620 PolarHBondContact O-N 2.94Å; Y617-L620 PolarHBondContact O-N 3.1Å; L620-A622 VanDerWaalsContact C-N 3.31Å; L620-A622 PolarHBondContact O-N 3.42Å; L620-R623 PolarHBondContact O-N 3.07Å; L620-N624 PolarHBondContact O-N 3.17Å; L620-L681 HydrophobicContact CB-CD2 3.76Å; L620-L681 HydrophobicContact CD1-CD2 4.31Å
621	E	88.6	Confident	91	Very high	80 Å²	80	60.8 Å²	60.8	37%	0.374	32%	0.322	S	S	.	.	H	α-helix	trans	-61.5	-39.1	174.8	-179.4	167.5	-161.4	0	0	111.6	Y617 L681 K684	Y617-E621 WeakPolarHBondContact CE1-OE2 3.48Å; Y617-E621 VanDerWaalsContact O-CB 3.26Å; Y617-E621 WeakPolarHBondContact O-CB 3.29Å; Y617-E621 PolarHBondContact O-N 3.01Å; Y617-E621 PolarHBondContact OH-OE2 3.4Å; E621-L681 HydrophobicContact CB-CD1 4.06Å; E621-K684 IonicContact OE1-NZ 3.08Å; E621-K684 PolarHBondContact OE1-NZ 3.44Å; E621-K684 IonicContact OE2-NZ 2.75Å; E621-K684 PolarHBondContact OE2-NZ 2.94Å
622	A	88.4	Confident	91.1	Very high	90 Å²	90	62.2 Å²	62.2	74%	0.744	33%	0.331	S	S	*	.	H	α-helix	trans	-72.6	-30.7	178.8	0	0	0	0	0	113.7	S618 E619 L620	S618-A622 WeakPolarHBondContact O-CB 3.26Å; S618-A622 PolarHBondContact O-N 2.85Å; E619-A622 PolarHBondContact O-N 3.26Å; L620-A622 VanDerWaalsContact C-N 3.31Å; L620-A622 PolarHBondContact O-N 3.42Å
623	R	87.1	Confident	91.2	Very high	168 Å²	168	63.6 Å²	63.6	63%	0.634	34%	0.34	S	S	*	.	H	α-helix	trans	-90	-38.1	-174.8	-161.6	-170.8	173.4	-173.7	-6.7	113.7	E619 L620 V625	E619-R623 WeakPolarHBondContact O-CB 3.46Å; E619-R623 PolarHBondContact O-N 3.13Å; E619-R623 VanDerWaalsContact O-N 3.13Å; L620-R623 PolarHBondContact O-N 3.07Å; R623-V625 VanDerWaalsContact C-N 3.26Å; R623-V625 HydrophobicContact CB-CG2 4.35Å; R623-V625 HydrophobicContact CG-CG2 3.48Å; R623-V625 VanDerWaalsContact CG-CG2 3.48Å; R623-V625 PolarHBondContact O-N 3.49Å
624	N	87.2	Confident	91.4	Very high	20 Å²	20	60.2 Å²	60.2	11%	0.107	32%	0.322	C	S	.	.			trans	40.9	42	176	-157	10.3	0	0	0	116.8	L620 F626 V627 E628 Q685 E688	L620-N624 PolarHBondContact O-N 3.17Å; N624-F626 VanDerWaalsContact C-N 3.26Å; N624-F626 PolarHBondContact O-N 3.43Å; N624-V627 PolarHBondContact O-N 3.32Å; N624-V627 WeakPolarHBondContact OD1-CB 3.33Å; N624-V627 WeakPolarHBondContact OD1-CG2 3.3Å; N624-E628 PolarHBondContact O-N 3.23Å; N624-Q685 WeakPolarHBondContact OD1-CG 3.4Å; N624-Q685 PolarHBondContact OD1-NE2 3.18Å; N624-Q685 VanDerWaalsContact OD1-NE2 3.11Å; N624-E688 PolarHBondContact ND2-OE2 3.21Å
625	V	89.8	Confident	91.5	Very high	40 Å²	40	56.4 Å²	56.4	24%	0.242	31%	0.307	C	S	.	.	H	α-helix	trans	-59.6	-36.4	-171.3	-176.7	0	0	0	0	112.5	E608 R623 E628 S629	E608-V625 WeakPolarHBondContact OE1-CG2 3.35Å; R623-V625 VanDerWaalsContact C-N 3.26Å; R623-V625 HydrophobicContact CB-CG2 4.35Å; R623-V625 HydrophobicContact CG-CG2 3.48Å; R623-V625 VanDerWaalsContact CG-CG2 3.48Å; R623-V625 PolarHBondContact O-N 3.49Å; V625-E628 PolarHBondContact O-N 3.02Å; V625-S629 WeakPolarHBondContact O-CB 3.43Å; V625-S629 PolarHBondContact O-N 3.02Å
626	F	92.7	Very high	91.5	Very high	3 Å²	3	57 Å²	57	1%	0.013	31%	0.306	C	S	.	.	H	α-helix	trans	-60.8	-48	-178.1	174.6	-116.5	0	0	0	112.3	T602 F605 N624 S629 I630 V665 V668 L689	T602-F626 HydrophobicContact CG2-CE2 4.14Å; T602-F626 HydrophobicContact CG2-CZ 4.34Å; F605-F626 HydrophobicContact CB-CD2 3.82Å; F605-F626 HydrophobicContact CB-CE2 3.61Å; F605-F626 HydrophobicContact CB-CZ 4.33Å; F605-F626 HydrophobicContact CD2-CD1 4.13Å; F605-F626 AromaticContact CD2-CD2 3.99Å; F605-F626 HydrophobicContact CD2-CD2 3.99Å; F605-F626 AromaticContact CD2-CE1 3.95Å; F605-F626 HydrophobicContact CD2-CE1 3.95Å; F605-F626 AromaticContact CD2-CE2 3.81Å; F605-F626 HydrophobicContact CD2-CE2 3.81Å; F605-F626 HydrophobicContact CD2-CG 4.14Å; F605-F626 AromaticContact CD2-CZ 3.78Å; F605-F626 HydrophobicContact CD2-CZ 3.78Å; F605-F626 HydrophobicContact CG-CD2 4.44Å; F605-F626 HydrophobicContact CG-CE2 4.15Å; F605-F626 HydrophobicContact CG-CZ 4.42Å; N624-F626 VanDerWaalsContact C-N 3.26Å; N624-F626 PolarHBondContact O-N 3.43Å; F626-S629 PolarHBondContact O-N 3.48Å; F626-I630 HydrophobicContact CD2-CD1 4.24Å; F626-I630 HydrophobicContact CE1-CD1 4.09Å; F626-I630 HydrophobicContact CE2-CD1 3.63Å; F626-I630 HydrophobicContact CE2-CG1 4.5Å; F626-I630 HydrophobicContact CZ-CD1 3.55Å; F626-I630 PolarHBondContact O-N 2.64Å; F626-V665 HydrophobicContact CE1-CG1 4.35Å; F626-V665 HydrophobicContact CZ-CG1 4.21Å; F626-V665 HydrophobicContact CZ-CG2 4.21Å; F626-V668 HydrophobicContact CZ-CG2 4.36Å; F626-L689 HydrophobicContact CE1-CD1 4.13Å
627	V	94.1	Very high	91.4	Very high	2 Å²	2	53.8 Å²	53.8	1%	0.012	29%	0.291	C	S	.	.	H	α-helix	trans	-68	-46.2	178.7	176.6	0	0	0	0	110	N624 S629 I630 V631 Q685 E688 L689	N624-V627 PolarHBondContact O-N 3.32Å; N624-V627 WeakPolarHBondContact OD1-CB 3.33Å; N624-V627 WeakPolarHBondContact OD1-CG2 3.3Å; V627-S629 VanDerWaalsContact C-N 3.29Å; V627-S629 PolarHBondContact O-N 3.49Å; V627-I630 PolarHBondContact O-N 3.22Å; V627-V631 HydrophobicContact CG1-CG2 4.08Å; V627-V631 WeakPolarHBondContact O-CB 3.29Å; V627-V631 VanDerWaalsContact O-CG2 3.31Å; V627-V631 WeakPolarHBondContact O-CG2 3.49Å; V627-V631 PolarHBondContact O-N 2.81Å; V627-Q685 HydrophobicContact CG2-CB 3.57Å; V627-Q685 HydrophobicContact CG2-CG 3.76Å; V627-E688 HydrophobicContact CG1-CB 4.4Å; V627-E688 HydrophobicContact CG1-CG 4.02Å; V627-L689 HydrophobicContact CB-CD2 4.42Å; V627-L689 HydrophobicContact CB-CG 4.48Å; V627-L689 HydrophobicContact CG1-CD2 3.84Å; V627-L689 HydrophobicContact CG1-CG 4.05Å; V627-L689 HydrophobicContact CG2-CD1 4.35Å; V627-L689 HydrophobicContact CG2-CG 4.07Å
628	E	93.8	Very high	91.4	Very high	124 Å²	124	53 Å²	53	58%	0.579	29%	0.288	S	S	*	.	H	α-helix	trans	-59.5	-39.1	177.8	-69.8	-170	162.8	0	0	112.4	N624 V625 V631 S632	N624-E628 PolarHBondContact O-N 3.23Å; V625-E628 PolarHBondContact O-N 3.02Å; E628-V631 PolarHBondContact O-N 2.96Å; E628-S632 WeakPolarHBondContact O-CB 3.19Å; E628-S632 PolarHBondContact O-N 2.77Å
629	S	93.7	Very high	91.3	Very high	28 Å²	28	52.1 Å²	52.1	20%	0.196	29%	0.286	C	S	.	.	H	α-helix	trans	-62.5	-44.8	177.7	-175	0	0	0	0	111.7	T604 V625 F626 V627 T633	T604-S629 WeakPolarHBondContact CG2-OG 3.31Å; V625-S629 WeakPolarHBondContact O-CB 3.43Å; V625-S629 PolarHBondContact O-N 3.02Å; F626-S629 PolarHBondContact O-N 3.48Å; V627-S629 VanDerWaalsContact C-N 3.29Å; V627-S629 PolarHBondContact O-N 3.49Å; S629-T633 VanDerWaalsContact O-CB 3.25Å; S629-T633 WeakPolarHBondContact O-CB 3.16Å; S629-T633 PolarHBondContact O-N 2.92Å; S629-T633 PolarHBondContact O-OG1 3.33Å
630	I	96.4	Very high	90.9	Very high	0 Å²	0	49 Å²	49	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-67.6	-49.6	177.4	-69	172.4	0	0	0	110.6	L598 A601 F626 V627 T633 L634 T661 V665 L689	L598-I630 HydrophobicContact CD1-CG1 4.44Å; L598-I630 HydrophobicContact CD1-CG2 3.8Å; A601-I630 HydrophobicContact CB-CG1 4.13Å; F626-I630 HydrophobicContact CD2-CD1 4.24Å; F626-I630 HydrophobicContact CE1-CD1 4.09Å; F626-I630 HydrophobicContact CE2-CD1 3.63Å; F626-I630 HydrophobicContact CE2-CG1 4.5Å; F626-I630 HydrophobicContact CZ-CD1 3.55Å; F626-I630 PolarHBondContact O-N 2.64Å; V627-I630 PolarHBondContact O-N 3.22Å; I630-T633 PolarHBondContact O-N 3.29Å; I630-L634 HydrophobicContact CG2-CD1 3.84Å; I630-L634 HydrophobicContact CG2-CG 4.32Å; I630-L634 WeakPolarHBondContact O-CB 3.19Å; I630-L634 VanDerWaalsContact O-CG 3.32Å; I630-L634 WeakPolarHBondContact O-CG 3.5Å; I630-L634 PolarHBondContact O-N 3.12Å; I630-T661 HydrophobicContact CG2-CG2 4.16Å; I630-V665 HydrophobicContact CD1-CG2 3.95Å; I630-L689 HydrophobicContact CB-CD2 3.99Å; I630-L689 HydrophobicContact CD1-CD1 4.05Å; I630-L689 HydrophobicContact CD1-CD2 4.42Å; I630-L689 HydrophobicContact CG2-CD2 3.75Å
631	V	95.5	Very high	90.8	Very high	30 Å²	30	47.9 Å²	47.9	18%	0.182	27%	0.271	C	S	.	.	H	α-helix	trans	-58.9	-50.5	-179.6	168.6	0	0	0	0	110.8	V627 E628 T633 L634 D635 L689 Y692	V627-V631 HydrophobicContact CG1-CG2 4.08Å; V627-V631 WeakPolarHBondContact O-CB 3.29Å; V627-V631 VanDerWaalsContact O-CG2 3.31Å; V627-V631 WeakPolarHBondContact O-CG2 3.49Å; V627-V631 PolarHBondContact O-N 2.81Å; E628-V631 PolarHBondContact O-N 2.96Å; V631-T633 VanDerWaalsContact C-N 3.31Å; V631-T633 PolarHBondContact O-N 3.25Å; V631-L634 PolarHBondContact O-N 3.34Å; V631-L634 VanDerWaalsContact O-N 3.16Å; V631-D635 PolarHBondContact O-N 2.86Å; V631-L689 HydrophobicContact CG2-CD2 4.26Å; V631-Y692 HydrophobicContact CB-CE1 4.47Å; V631-Y692 HydrophobicContact CG1-CD2 4.05Å; V631-Y692 HydrophobicContact CG1-CE1 4.39Å; V631-Y692 HydrophobicContact CG1-CE2 3.65Å; V631-Y692 HydrophobicContact CG2-CD1 3.86Å; V631-Y692 HydrophobicContact CG2-CD2 4.19Å; V631-Y692 HydrophobicContact CG2-CE1 4.1Å; V631-Y692 HydrophobicContact CG2-CE2 4.41Å; V631-Y692 HydrophobicContact CG2-CG 3.91Å
632	S	93.6	Very high	90.9	Very high	61 Å²	61	50.5 Å²	50.5	43%	0.427	28%	0.281	S	S	.	.	H	α-helix	trans	-60.7	-40.4	178.2	-176.2	0	0	0	0	112	E628 N636	E628-S632 WeakPolarHBondContact O-CB 3.19Å; E628-S632 PolarHBondContact O-N 2.77Å; S632-N636 WeakPolarHBondContact O-CB 3.3Å; S632-N636 PolarHBondContact O-N 2.91Å; S632-N636 PolarHBondContact O-ND2 3.17Å
633	T	93.1	Very high	90.8	Very high	32 Å²	32	52.6 Å²	52.6	20%	0.196	28%	0.279	C	S	.	.	H	α-helix	trans	-64.5	-42.7	176.8	-63	0	0	0	0	111.7	R597 A601 S629 I630 V631 V637	R597-T633 HydrophobicContact CB-CG2 3.73Å; A601-T633 HydrophobicContact CB-CG2 4.2Å; A601-T633 WeakPolarHBondContact CB-OG1 3.27Å; S629-T633 VanDerWaalsContact O-CB 3.25Å; S629-T633 WeakPolarHBondContact O-CB 3.16Å; S629-T633 PolarHBondContact O-N 2.92Å; S629-T633 PolarHBondContact O-OG1 3.33Å; I630-T633 PolarHBondContact O-N 3.29Å; V631-T633 VanDerWaalsContact C-N 3.31Å; V631-T633 PolarHBondContact O-N 3.25Å; T633-V637 WeakPolarHBondContact O-CG2 3.5Å; T633-V637 PolarHBondContact O-N 2.92Å; T633-V637 VanDerWaalsContact O-N 3.15Å
634	L	94	Very high	90.8	Very high	1 Å²	1	47.8 Å²	47.8	1%	0.005	26%	0.264	C	S	.	.	H	α-helix	trans	-67.9	-46.3	178.6	-70.8	178.3	0	0	0	111.6	V594 L598 I630 V631 N636 V637 L638 V657 Y692 L693	V594-L634 HydrophobicContact CG1-CD2 4.05Å; L598-L634 HydrophobicContact CD1-CD2 4.14Å; L598-L634 HydrophobicContact CD1-CG 4.3Å; L598-L634 HydrophobicContact CD2-CD2 4.49Å; I630-L634 HydrophobicContact CG2-CD1 3.84Å; I630-L634 HydrophobicContact CG2-CG 4.32Å; I630-L634 WeakPolarHBondContact O-CB 3.19Å; I630-L634 VanDerWaalsContact O-CG 3.32Å; I630-L634 WeakPolarHBondContact O-CG 3.5Å; I630-L634 PolarHBondContact O-N 3.12Å; V631-L634 PolarHBondContact O-N 3.34Å; V631-L634 VanDerWaalsContact O-N 3.16Å; L634-N636 VanDerWaalsContact C-N 3.31Å; L634-N636 PolarHBondContact O-N 3.48Å; L634-V637 PolarHBondContact O-N 3.09Å; L634-L638 HydrophobicContact CB-CD1 4.24Å; L634-L638 WeakPolarHBondContact O-CB 3.22Å; L634-L638 WeakPolarHBondContact O-CG 3.13Å; L634-L638 PolarHBondContact O-N 3.22Å; L634-V657 HydrophobicContact CD2-CG1 3.61Å; L634-Y692 HydrophobicContact CB-CE1 4.21Å; L634-Y692 HydrophobicContact CD1-CE1 3.95Å; L634-L693 HydrophobicContact CD1-CD2 4.09Å
635	D	92.6	Very high	91.1	Very high	76 Å²	76	47.3 Å²	47.3	41%	0.406	26%	0.261	S	S	.	.	H	α-helix	trans	-55.6	-46.9	176.1	-78.3	-24.6	0	0	0	111.2	V631 V637 A639 Y692	V631-D635 PolarHBondContact O-N 2.86Å; D635-V637 PolarHBondContact O-N 2.99Å; D635-A639 WeakPolarHBondContact O-CB 3.45Å; D635-A639 PolarHBondContact O-N 2.68Å; D635-Y692 VanDerWaalsContact CG-OH 3.25Å; D635-Y692 PolarHBondContact OD1-OH 3.27Å
636	N	88.4	Confident	91.2	Very high	108 Å²	108	46.3 Å²	46.3	58%	0.578	26%	0.256	S	S	*	.	H	α-helix	trans	-62.7	-43.6	-179.7	-75.9	-41	0	0	0	112.8	S632 L634	S632-N636 WeakPolarHBondContact O-CB 3.3Å; S632-N636 PolarHBondContact O-N 2.91Å; S632-N636 PolarHBondContact O-ND2 3.17Å; L634-N636 VanDerWaalsContact C-N 3.31Å; L634-N636 PolarHBondContact O-N 3.48Å
637	V	88.4	Confident	91.2	Very high	7 Å²	7	54.1 Å²	54.1	4%	0.042	29%	0.293	C	S	.	.	H	α-helix	trans	-76.3	-40.9	-178.2	177.7	0	0	0	0	111.4	Y487 V594 R597 T633 L634 D635 M641	Y487-V637 HydrophobicContact CE1-CG1 4.23Å; Y487-V637 PolarHBondContact OH-O 3.38Å; V594-V637 HydrophobicContact CG2-CG1 3.96Å; R597-V637 VanDerWaalsContact CD-CG2 3.42Å; T633-V637 WeakPolarHBondContact O-CG2 3.5Å; T633-V637 PolarHBondContact O-N 2.92Å; T633-V637 VanDerWaalsContact O-N 3.15Å; L634-V637 PolarHBondContact O-N 3.09Å; D635-V637 PolarHBondContact O-N 2.99Å; V637-M641 HydrophobicContact CG1-CE 3.65Å; V637-M641 HydrophobicContact CG1-SD 4.17Å; V637-M641 WeakPolarHBondContact O-CG 2.96Å; V637-M641 PolarHBondContact O-N 2.84Å
638	L	90.8	Very high	91.1	Very high	4 Å²	4	57.7 Å²	57.7	2%	0.021	32%	0.316	C	S	.	.	H	α-helix	trans	-72.6	-32.1	-177.4	-67.6	172.6	0	0	0	112.4	L634 T640 M641 K642 Y650 L653 L654 V657 L696	L634-L638 HydrophobicContact CB-CD1 4.24Å; L634-L638 WeakPolarHBondContact O-CB 3.22Å; L634-L638 WeakPolarHBondContact O-CG 3.13Å; L634-L638 PolarHBondContact O-N 3.22Å; L638-T640 VanDerWaalsContact C-N 3.33Å; L638-T640 PolarHBondContact O-N 3.39Å; L638-M641 PolarHBondContact O-N 3.33Å; L638-K642 VanDerWaalsContact O-CB 3.31Å; L638-K642 WeakPolarHBondContact O-CB 3.38Å; L638-K642 PolarHBondContact O-N 2.98Å; L638-Y650 HydrophobicContact CD2-CE2 4.38Å; L638-L653 HydrophobicContact CD2-CD2 4.13Å; L638-L654 HydrophobicContact CD1-CD2 3.7Å; L638-L654 HydrophobicContact CD2-CD2 3.86Å; L638-L654 HydrophobicContact CG-CD2 4.37Å; L638-V657 HydrophobicContact CD2-CG2 4.4Å; L638-L696 HydrophobicContact CD1-CD1 4.05Å
639	A	88.2	Confident	91.1	Very high	57 Å²	57	52.1 Å²	52.1	47%	0.471	29%	0.29	S	S	.	.	H	α-helix	trans	-57.7	-44.1	177.8	0	0	0	0	0	112.3	D635	D635-A639 WeakPolarHBondContact O-CB 3.45Å; D635-A639 PolarHBondContact O-N 2.68Å
640	T	82.5	Confident	91.1	Very high	75 Å²	75	52.3 Å²	52.3	46%	0.46	29%	0.286	S	S	.	.	H	α-helix	trans	-69.1	-42.3	177.6	-48.5	0	0	0	0	111.7	Y487 L638 L643	Y487-T640 WeakPolarHBondContact OH-CB 3.28Å; L638-T640 VanDerWaalsContact C-N 3.33Å; L638-T640 PolarHBondContact O-N 3.39Å; T640-L643 PolarHBondContact O-N 3.43Å
641	M	88.4	Confident	91	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-68.9	-34.6	-179.1	-66.9	-177.9	-179.2	0	0	112.8	Y487 F525 C593 V594 V637 L638 L643 Q644 L645 L653	Y487-M641 HydrophobicContact CD2-CE 4.23Å; Y487-M641 HydrophobicContact CE1-CE 4.45Å; Y487-M641 HydrophobicContact CE2-CE 3.73Å; Y487-M641 HydrophobicContact CE2-CG 4.35Å; F525-M641 HydrophobicContact CE1-CG 4.27Å; F525-M641 HydrophobicContact CZ-CG 4.29Å; C593-M641 HydrophobicContact CB-CE 3.38Å; V594-M641 HydrophobicContact CG2-CE 4.17Å; V594-M641 HydrophobicContact CG2-SD 4.34Å; V637-M641 HydrophobicContact CG1-CE 3.65Å; V637-M641 HydrophobicContact CG1-SD 4.17Å; V637-M641 WeakPolarHBondContact O-CG 2.96Å; V637-M641 PolarHBondContact O-N 2.84Å; L638-M641 PolarHBondContact O-N 3.33Å; M641-L643 PolarHBondContact O-N 3.38Å; M641-Q644 PolarHBondContact O-N 3.5Å; M641-L645 HydrophobicContact CB-CD1 4.19Å; M641-L645 WeakPolarHBondContact O-CB 3.46Å; M641-L645 WeakPolarHBondContact O-CG 3.26Å; M641-L645 PolarHBondContact O-N 3.19Å; M641-L653 HydrophobicContact CB-CD2 4.06Å; M641-L653 HydrophobicContact CG-CD2 4.49Å; M641-L653 HydrophobicContact SD-CD2 3.62Å
642	K	89.6	Confident	90.8	Very high	134 Å²	134	54.3 Å²	54.3	58%	0.583	30%	0.304	S	S	*	.	H	α-helix	trans	-59.2	-33.3	177.8	-173.2	176.1	179.6	179.3	0	112.6	L638 Q644 Y650	L638-K642 VanDerWaalsContact O-CB 3.31Å; L638-K642 WeakPolarHBondContact O-CB 3.38Å; L638-K642 PolarHBondContact O-N 2.98Å; K642-Q644 VanDerWaalsContact C-N 3.31Å; K642-Y650 HydrophobicContact CB-CD2 4.1Å; K642-Y650 HydrophobicContact CB-CE1 4.35Å; K642-Y650 HydrophobicContact CB-CE2 3.6Å; K642-Y650 HydrophobicContact CD-CE1 4.02Å; K642-Y650 HydrophobicContact CG-CD1 4.3Å; K642-Y650 HydrophobicContact CG-CD2 4.42Å; K642-Y650 HydrophobicContact CG-CE1 3.95Å; K642-Y650 HydrophobicContact CG-CE2 4.09Å
643	L	86.9	Confident	90.9	Very high	134 Å²	134	51.4 Å²	51.4	70%	0.702	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-16.7	178.6	-63.5	176.1	0	0	0	113.3	T640 M641	T640-L643 PolarHBondContact O-N 3.43Å; M641-L643 PolarHBondContact O-N 3.38Å
644	Q	88	Confident	91	Very high	68 Å²	68	50.2 Å²	50.2	32%	0.318	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.7	-12.8	-172.6	-62.1	-65.9	-71	0	0	113	F525 N529 M641 K642	F525-Q644 HydrophobicContact CB-CB 4.06Å; F525-Q644 HydrophobicContact CD1-CB 3.84Å; F525-Q644 HydrophobicContact CD2-CB 4.26Å; F525-Q644 HydrophobicContact CD2-CG 4.49Å; F525-Q644 HydrophobicContact CE1-CB 4.37Å; F525-Q644 HydrophobicContact CG-CB 3.81Å; N529-Q644 PolarHBondContact ND2-O 2.86Å; M641-Q644 PolarHBondContact O-N 3.5Å; K642-Q644 VanDerWaalsContact C-N 3.31Å
645	L	91.8	Very high	91	Very high	9 Å²	9	52.6 Å²	52.6	5%	0.047	29%	0.289	C	S	.	.	S	Bend	trans	-110.4	142.4	-177.3	-67.6	173.6	0	0	0	111.1	F525 L528 L589 M641 L649 L653	F525-L645 HydrophobicContact CD1-CD2 3.79Å; F525-L645 HydrophobicContact CD1-CG 4.11Å; F525-L645 HydrophobicContact CE1-CD2 4.32Å; F525-L645 HydrophobicContact CE1-CG 4.35Å; L528-L645 HydrophobicContact CD2-CD2 3.92Å; L589-L645 HydrophobicContact CD1-CD1 4.24Å; L589-L645 HydrophobicContact CD1-CD2 4.31Å; M641-L645 HydrophobicContact CB-CD1 4.19Å; M641-L645 WeakPolarHBondContact O-CB 3.46Å; M641-L645 WeakPolarHBondContact O-CG 3.26Å; M641-L645 PolarHBondContact O-N 3.19Å; L645-L649 HydrophobicContact CB-CB 4.37Å; L645-L649 HydrophobicContact CD2-CB 4.35Å; L645-L649 HydrophobicContact CD2-CD1 4.35Å; L645-L653 HydrophobicContact CD1-CD2 3.69Å
646	S	92.3	Very high	91.1	Very high	19 Å²	19	53.5 Å²	53.5	13%	0.133	29%	0.287	C	S	.	.			trans	-61.7	153.3	165.5	63.7	0	0	0	0	111.5	N529 N532 L649 Y650	N529-S646 PolarHBondContact OD1-N 3.18Å; N532-S646 PolarHBondContact ND2-OG 2.83Å; S646-L649 PolarHBondContact O-N 3.25Å; S646-L649 VanDerWaalsContact O-N 3.11Å; S646-L649 WeakPolarHBondContact OG-CD1 3.35Å; S646-L649 WeakPolarHBondContact OG-CG 3.34Å; S646-Y650 PolarHBondContact O-N 2.81Å
647	E	92.6	Very high	91.4	Very high	168 Å²	168	48.4 Å²	48.4	79%	0.785	26%	0.26	S	S	*	.	H	α-helix	trans	-53.2	-44.6	-176.4	-177.1	179.5	-173.8	0	0	114.1	L649 Y650 A651	E647-L649 PolarHBondContact O-N 3.38Å; E647-Y650 PolarHBondContact O-N 2.84Å; E647-A651 PolarHBondContact O-N 3.19Å
648	P	92.1	Very high	91.7	Very high	77 Å²	77	48.1 Å²	48.1	50%	0.5	26%	0.258	S	S	.	.	H	α-helix	trans	-64.5	-39.6	177.7	-21.4	34.3	0	0	0	113	A651 S652	P648-A651 PolarHBondContact O-N 3.18Å; P648-S652 PolarHBondContact O-N 2.68Å
649	L	93.6	Very high	91.9	Very high	6 Å²	6	49.3 Å²	49.3	3%	0.031	27%	0.268	C	S	.	.	H	α-helix	trans	-67.7	-40.4	177.3	-73.2	175	0	0	0	111.4	L528 N529 N532 M582 V586 L645 S646 E647 A651 S652 L653	L528-L649 HydrophobicContact CG-CD1 3.92Å; L528-L649 HydrophobicContact CG-CD2 4.27Å; L528-L649 WeakPolarHBondContact O-CD1 3.32Å; N529-L649 WeakPolarHBondContact OD1-CD1 3.5Å; N532-L649 HydrophobicContact CB-CD1 3.77Å; N532-L649 HydrophobicContact CB-CD2 4.22Å; N532-L649 HydrophobicContact CB-CG 3.86Å; M582-L649 HydrophobicContact SD-CD2 4.27Å; V586-L649 HydrophobicContact CG2-CD2 3.99Å; L645-L649 HydrophobicContact CB-CB 4.37Å; L645-L649 HydrophobicContact CD2-CB 4.35Å; L645-L649 HydrophobicContact CD2-CD1 4.35Å; S646-L649 PolarHBondContact O-N 3.25Å; S646-L649 VanDerWaalsContact O-N 3.11Å; S646-L649 WeakPolarHBondContact OG-CD1 3.35Å; S646-L649 WeakPolarHBondContact OG-CG 3.34Å; E647-L649 PolarHBondContact O-N 3.38Å; L649-A651 VanDerWaalsContact C-N 3.35Å; L649-S652 PolarHBondContact O-N 3.34Å; L649-L653 WeakPolarHBondContact O-CB 3.26Å; L649-L653 PolarHBondContact O-N 2.79Å
650	Y	94.6	Very high	92.3	Very high	33 Å²	33	48.2 Å²	48.2	13%	0.129	25%	0.253	C	S	.	.	H	α-helix	trans	-63.5	-41.5	175.9	-173.6	-111.1	0	0	0	111.2	L638 K642 S646 E647 S652 L653 L654	L638-Y650 HydrophobicContact CD2-CE2 4.38Å; K642-Y650 HydrophobicContact CB-CD2 4.1Å; K642-Y650 HydrophobicContact CB-CE1 4.35Å; K642-Y650 HydrophobicContact CB-CE2 3.6Å; K642-Y650 HydrophobicContact CD-CE1 4.02Å; K642-Y650 HydrophobicContact CG-CD1 4.3Å; K642-Y650 HydrophobicContact CG-CD2 4.42Å; K642-Y650 HydrophobicContact CG-CE1 3.95Å; K642-Y650 HydrophobicContact CG-CE2 4.09Å; S646-Y650 PolarHBondContact O-N 2.81Å; E647-Y650 PolarHBondContact O-N 2.84Å; Y650-S652 PolarHBondContact O-N 2.72Å; Y650-L653 HydrophobicContact CD2-CD2 4.29Å; Y650-L653 WeakPolarHBondContact O-CB 3.44Å; Y650-L653 PolarHBondContact O-N 2.92Å; Y650-L654 HydrophobicContact CD1-CD1 3.84Å; Y650-L654 HydrophobicContact CD1-CG 4.28Å; Y650-L654 HydrophobicContact CE1-CD1 3.44Å; Y650-L654 VanDerWaalsContact CE1-CD1 3.44Å; Y650-L654 HydrophobicContact CE1-CD2 4.33Å; Y650-L654 HydrophobicContact CE1-CG 3.96Å; Y650-L654 HydrophobicContact CE2-CD2 4.37Å; Y650-L654 HydrophobicContact CE2-CG 4.38Å; Y650-L654 WeakPolarHBondContact O-CB 3.09Å; Y650-L654 VanDerWaalsContact O-CG 3.28Å; Y650-L654 WeakPolarHBondContact O-CG 3.28Å; Y650-L654 PolarHBondContact O-N 3.47Å
651	A	93.2	Very high	92.9	Very high	45 Å²	45	44.6 Å²	44.6	37%	0.372	23%	0.231	S	C	.	.	H	α-helix	trans	-62.4	-40.6	173.5	0	0	0	0	0	112.8	E647 P648 L649 L654 N655	E647-A651 PolarHBondContact O-N 3.19Å; P648-A651 PolarHBondContact O-N 3.18Å; L649-A651 VanDerWaalsContact C-N 3.35Å; A651-L654 PolarHBondContact O-N 2.97Å; A651-N655 PolarHBondContact O-N 2.69Å; A651-N655 VanDerWaalsContact O-N 3.15Å; A651-N655 PolarHBondContact O-ND2 3.4Å
652	S	93.2	Very high	93.3	Very high	26 Å²	26	44.8 Å²	44.8	18%	0.182	23%	0.233	C	C	.	.	H	α-helix	trans	-64.4	-43.4	174.3	-177.6	0	0	0	0	111.7	E583 P648 L649 Y650 L654 N655 R656	E583-S652 PolarHBondContact OE1-OG 2.79Å; P648-S652 PolarHBondContact O-N 2.68Å; L649-S652 PolarHBondContact O-N 3.34Å; Y650-S652 PolarHBondContact O-N 2.72Å; S652-L654 PolarHBondContact O-N 2.77Å; S652-N655 PolarHBondContact O-N 2.73Å; S652-R656 PolarHBondContact O-N 2.77Å; S652-R656 VanDerWaalsContact O-N 3.14Å
653	L	95	Very high	93.6	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-57	-50.9	174.6	177.6	71.6	0	0	0	110.9	V586 L589 V590 L638 M641 L645 L649 Y650 N655 R656 V657	V586-L653 HydrophobicContact CG1-CB 4.04Å; V586-L653 HydrophobicContact CG1-CD1 4.09Å; L589-L653 HydrophobicContact CB-CD1 4.11Å; V590-L653 HydrophobicContact CG2-CD1 3.56Å; L638-L653 HydrophobicContact CD2-CD2 4.13Å; M641-L653 HydrophobicContact CB-CD2 4.06Å; M641-L653 HydrophobicContact CG-CD2 4.49Å; M641-L653 HydrophobicContact SD-CD2 3.62Å; L645-L653 HydrophobicContact CD1-CD2 3.69Å; L649-L653 WeakPolarHBondContact O-CB 3.26Å; L649-L653 PolarHBondContact O-N 2.79Å; Y650-L653 HydrophobicContact CD2-CD2 4.29Å; Y650-L653 WeakPolarHBondContact O-CB 3.44Å; Y650-L653 PolarHBondContact O-N 2.92Å; L653-N655 VanDerWaalsContact C-N 3.34Å; L653-N655 PolarHBondContact O-N 3.45Å; L653-R656 PolarHBondContact O-N 2.71Å; L653-R656 VanDerWaalsContact O-N 3.09Å; L653-V657 HydrophobicContact CD1-CG2 4.26Å; L653-V657 HydrophobicContact CG-CG2 4.24Å; L653-V657 WeakPolarHBondContact O-CG2 3.38Å; L653-V657 PolarHBondContact O-N 3.15Å
654	L	95.1	Very high	94	Very high	8 Å²	8	35.7 Å²	35.7	4%	0.042	19%	0.193	C	C	.	.	H	α-helix	trans	-59.2	-42.1	-178.7	-74.1	179.4	0	0	0	112.7	L638 Y650 A651 S652 R656 V657 A658 L696	L638-L654 HydrophobicContact CD1-CD2 3.7Å; L638-L654 HydrophobicContact CD2-CD2 3.86Å; L638-L654 HydrophobicContact CG-CD2 4.37Å; Y650-L654 HydrophobicContact CD1-CD1 3.84Å; Y650-L654 HydrophobicContact CD1-CG 4.28Å; Y650-L654 HydrophobicContact CE1-CD1 3.44Å; Y650-L654 VanDerWaalsContact CE1-CD1 3.44Å; Y650-L654 HydrophobicContact CE1-CD2 4.33Å; Y650-L654 HydrophobicContact CE1-CG 3.96Å; Y650-L654 HydrophobicContact CE2-CD2 4.37Å; Y650-L654 HydrophobicContact CE2-CG 4.38Å; Y650-L654 WeakPolarHBondContact O-CB 3.09Å; Y650-L654 VanDerWaalsContact O-CG 3.28Å; Y650-L654 WeakPolarHBondContact O-CG 3.28Å; Y650-L654 PolarHBondContact O-N 3.47Å; A651-L654 PolarHBondContact O-N 2.97Å; S652-L654 PolarHBondContact O-N 2.77Å; L654-R656 VanDerWaalsContact C-N 3.32Å; L654-R656 PolarHBondContact O-N 2.89Å; L654-V657 PolarHBondContact O-N 3.42Å; L654-A658 PolarHBondContact O-N 2.73Å; L654-L696 HydrophobicContact CD1-CB 4.49Å; L654-L696 WeakPolarHBondContact CD1-O 3.04Å; L654-L696 HydrophobicContact CD2-CB 4.37Å
655	N	93	Very high	94.4	Very high	50 Å²	50	32.4 Å²	32.4	27%	0.267	18%	0.178	S	C	.	.	H	α-helix	trans	-61.8	-39.4	175.3	-82.4	-63.2	0	0	0	112.4	A651 S652 L653 A659	A651-N655 PolarHBondContact O-N 2.69Å; A651-N655 VanDerWaalsContact O-N 3.15Å; A651-N655 PolarHBondContact O-ND2 3.4Å; S652-N655 PolarHBondContact O-N 2.73Å; L653-N655 VanDerWaalsContact C-N 3.34Å; L653-N655 PolarHBondContact O-N 3.45Å; N655-A659 PolarHBondContact O-N 3.41Å
656	R	94.4	Very high	94.6	Very high	96 Å²	96	33.4 Å²	33.4	36%	0.362	18%	0.182	S	C	.	.	H	α-helix	trans	-72.7	-36.6	176.8	-71.6	175.8	167.7	-82.8	1.2	112.4	E583 V590 S652 L653 L654 A659 E660	E583-R656 IonicContact OE2-CZ 3.17Å; E583-R656 VanDerWaalsContact OE2-CZ 3.31Å; E583-R656 IonicContact OE2-NE 3.31Å; E583-R656 PolarHBondContact OE2-NE 3.26Å; E583-R656 VanDerWaalsContact OE2-NE 3.1Å; E583-R656 IonicContact OE2-NH2 2.7Å; E583-R656 PolarHBondContact OE2-NH2 3.43Å; V590-R656 HydrophobicContact CG2-CB 3.82Å; S652-R656 PolarHBondContact O-N 2.77Å; S652-R656 VanDerWaalsContact O-N 3.14Å; L653-R656 PolarHBondContact O-N 2.71Å; L653-R656 VanDerWaalsContact O-N 3.09Å; L654-R656 VanDerWaalsContact C-N 3.32Å; L654-R656 PolarHBondContact O-N 2.89Å; R656-A659 PolarHBondContact O-N 3.48Å; R656-E660 PolarHBondContact O-N 3.43Å
657	V	95.7	Very high	94.8	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.006	20%	0.199	C	C	.	.	H	α-helix	trans	-62.7	-45.6	173.4	170.3	0	0	0	0	110.5	V590 V594 L634 L638 L653 L654 A659 E660 T661	V590-V657 HydrophobicContact CG2-CG2 4.1Å; V594-V657 HydrophobicContact CB-CG2 4.42Å; V594-V657 HydrophobicContact CG1-CG1 4.18Å; V594-V657 HydrophobicContact CG1-CG2 4.02Å; V594-V657 HydrophobicContact CG2-CG2 4.03Å; L634-V657 HydrophobicContact CD2-CG1 3.61Å; L638-V657 HydrophobicContact CD2-CG2 4.4Å; L653-V657 HydrophobicContact CD1-CG2 4.26Å; L653-V657 HydrophobicContact CG-CG2 4.24Å; L653-V657 WeakPolarHBondContact O-CG2 3.38Å; L653-V657 PolarHBondContact O-N 3.15Å; L654-V657 PolarHBondContact O-N 3.42Å; V657-A659 VanDerWaalsContact C-N 3.3Å; V657-A659 PolarHBondContact O-N 2.79Å; V657-E660 PolarHBondContact O-N 3.05Å; V657-T661 PolarHBondContact O-N 2.89Å; V657-T661 PolarHBondContact O-OG1 3.2Å
658	A	95.1	Very high	94.9	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-58.2	-42.3	176.3	0	0	0	0	0	112.4	L654 A662 L693	L654-A658 PolarHBondContact O-N 2.73Å; A658-A662 PolarHBondContact O-N 2.97Å; A658-A662 VanDerWaalsContact O-N 3.09Å; A658-L693 HydrophobicContact CB-CB 4.3Å; A658-L693 HydrophobicContact CB-CD1 4.38Å; A658-L693 HydrophobicContact CB-CD2 4.21Å
659	A	94.9	Very high	95	Very high	30 Å²	30	26.6 Å²	26.6	25%	0.248	14%	0.141	C	C	.	.	H	α-helix	trans	-64.2	-44.1	175.5	0	0	0	0	0	112.8	N655 R656 V657 A662 V663 K704	N655-A659 PolarHBondContact O-N 3.41Å; R656-A659 PolarHBondContact O-N 3.48Å; V657-A659 VanDerWaalsContact C-N 3.3Å; V657-A659 PolarHBondContact O-N 2.79Å; A659-A662 PolarHBondContact O-N 3.46Å; A659-V663 WeakPolarHBondContact O-CG2 3.36Å; A659-V663 PolarHBondContact O-N 2.77Å; A659-V663 VanDerWaalsContact O-N 3.15Å; A659-K704 HydrophobicContact CB-CB 4.48Å; A659-K704 HydrophobicContact CB-CD 4.04Å; A659-K704 HydrophobicContact CB-CG 4.12Å
660	E	95.7	Very high	95	Very high	33 Å²	33	27.8 Å²	27.8	15%	0.154	15%	0.146	C	C	.	.	H	α-helix	trans	-67.8	-37.7	178.7	-169.1	68.8	-142.6	0	0	111.8	V590 K595 R656 V657 V663 L664	V590-E660 HydrophobicContact CG1-CB 4.02Å; V590-E660 HydrophobicContact CG1-CG 4.2Å; K595-E660 HydrophobicContact CB-CG 4.29Å; K595-E660 HydrophobicContact CD-CG 4.41Å; K595-E660 WeakPolarHBondContact CD-OE1 3.4Å; K595-E660 WeakPolarHBondContact CE-OE1 3.46Å; K595-E660 HydrophobicContact CG-CG 4.14Å; K595-E660 IonicContact NZ-OE1 3.88Å; K595-E660 PolarHBondContact NZ-OE1 3.4Å; K595-E660 IonicContact NZ-OE2 2.99Å; K595-E660 PolarHBondContact NZ-OE2 3.42Å; R656-E660 PolarHBondContact O-N 3.43Å; V657-E660 PolarHBondContact O-N 3.05Å; E660-V663 PolarHBondContact O-N 2.95Å; E660-L664 HydrophobicContact CG-CD1 4.22Å; E660-L664 HydrophobicContact CG-CG 4.49Å; E660-L664 WeakPolarHBondContact O-CG 3.46Å; E660-L664 PolarHBondContact O-N 3.48Å
661	T	96.1	Very high	94.9	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-60.7	-48.9	174	-54.9	0	0	0	0	111.4	L598 I630 V657 V663 L664 V665 L693 F705	L598-T661 HydrophobicContact CD1-CG2 4.41Å; L598-T661 WeakPolarHBondContact CD2-OG1 3.38Å; I630-T661 HydrophobicContact CG2-CG2 4.16Å; V657-T661 PolarHBondContact O-N 2.89Å; V657-T661 PolarHBondContact O-OG1 3.2Å; T661-V663 VanDerWaalsContact C-N 3.29Å; T661-V663 PolarHBondContact O-N 3Å; T661-L664 PolarHBondContact O-N 3.45Å; T661-V665 HydrophobicContact CG2-CG2 4.11Å; T661-V665 WeakPolarHBondContact O-CB 3.42Å; T661-V665 VanDerWaalsContact O-CG2 3.26Å; T661-V665 WeakPolarHBondContact O-CG2 3.31Å; T661-V665 PolarHBondContact O-N 3.17Å; T661-L693 HydrophobicContact CG2-CD1 3.85Å; T661-F705 HydrophobicContact CG2-CZ 4.48Å
662	A	95.6	Very high	94.8	Very high	4 Å²	4	31.5 Å²	31.5	3%	0.033	16%	0.156	C	C	.	.	H	α-helix	trans	-57.2	-43.6	177.5	0	0	0	0	0	111.8	A658 A659 E666 K704 F705	A658-A662 PolarHBondContact O-N 2.97Å; A658-A662 VanDerWaalsContact O-N 3.09Å; A659-A662 PolarHBondContact O-N 3.46Å; A662-E666 WeakPolarHBondContact O-CB 3.5Å; A662-E666 PolarHBondContact O-N 3.23Å; A662-K704 HydrophobicContact CB-CB 4.46Å; A662-K704 VanDerWaalsContact CB-O 3.24Å; A662-K704 WeakPolarHBondContact CB-O 3.29Å; A662-F705 HydrophobicContact CB-CD1 4.24Å; A662-F705 HydrophobicContact CB-CD2 4.37Å; A662-F705 HydrophobicContact CB-CE1 4.1Å; A662-F705 HydrophobicContact CB-CE2 4.23Å; A662-F705 HydrophobicContact CB-CG 4.34Å; A662-F705 HydrophobicContact CB-CZ 4.06Å
663	V	95.9	Very high	94.8	Very high	61 Å²	61	34.3 Å²	34.3	37%	0.37	17%	0.173	S	C	.	.	H	α-helix	trans	-66	-41.1	178.5	170.1	0	0	0	0	112.6	A659 E660 T661 K667	A659-V663 WeakPolarHBondContact O-CG2 3.36Å; A659-V663 PolarHBondContact O-N 2.77Å; A659-V663 VanDerWaalsContact O-N 3.15Å; E660-V663 PolarHBondContact O-N 2.95Å; T661-V663 VanDerWaalsContact C-N 3.29Å; T661-V663 PolarHBondContact O-N 3Å; V663-K667 HydrophobicContact CG1-CD 4.26Å; V663-K667 VanDerWaalsContact O-CG 3.29Å; V663-K667 WeakPolarHBondContact O-CG 3.4Å; V663-K667 PolarHBondContact O-N 3.35Å; V663-K667 VanDerWaalsContact O-N 3.12Å
664	L	96.7	Very high	94.8	Very high	15 Å²	15	34.3 Å²	34.3	8%	0.079	17%	0.173	C	C	.	.	H	α-helix	trans	-71	-41.9	179.7	-73.8	176.1	0	0	0	111.8	K595 L598 T602 E660 T661 K667 V668	K595-L664 HydrophobicContact CG-CD1 4.28Å; L598-L664 HydrophobicContact CB-CD1 4.04Å; L598-L664 HydrophobicContact CD2-CD1 3.76Å; L598-L664 HydrophobicContact CG-CD1 3.68Å; T602-L664 HydrophobicContact CG2-CB 4.37Å; E660-L664 HydrophobicContact CG-CD1 4.22Å; E660-L664 HydrophobicContact CG-CG 4.49Å; E660-L664 WeakPolarHBondContact O-CG 3.46Å; E660-L664 PolarHBondContact O-N 3.48Å; T661-L664 PolarHBondContact O-N 3.45Å; L664-K667 WeakPolarHBondContact O-CB 3.49Å; L664-K667 PolarHBondContact O-N 3.08Å; L664-V668 PolarHBondContact O-N 3.31Å
665	V	96.4	Very high	94.6	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-62.7	-45.8	175.9	176.6	0	0	0	0	110.2	T602 F626 I630 T661 K667 V668 V669 V686 L689 L708	T602-V665 HydrophobicContact CG2-CG2 4.47Å; F626-V665 HydrophobicContact CE1-CG1 4.35Å; F626-V665 HydrophobicContact CZ-CG1 4.21Å; F626-V665 HydrophobicContact CZ-CG2 4.21Å; I630-V665 HydrophobicContact CD1-CG2 3.95Å; T661-V665 HydrophobicContact CG2-CG2 4.11Å; T661-V665 WeakPolarHBondContact O-CB 3.42Å; T661-V665 VanDerWaalsContact O-CG2 3.26Å; T661-V665 WeakPolarHBondContact O-CG2 3.31Å; T661-V665 PolarHBondContact O-N 3.17Å; V665-K667 VanDerWaalsContact C-N 3.27Å; V665-K667 PolarHBondContact O-N 2.86Å; V665-V668 WeakPolarHBondContact O-CG2 3.41Å; V665-V668 PolarHBondContact O-N 3.44Å; V665-V669 HydrophobicContact CG1-CG2 4.12Å; V665-V669 WeakPolarHBondContact O-CB 3.25Å; V665-V669 VanDerWaalsContact O-CG2 3.25Å; V665-V669 WeakPolarHBondContact O-CG2 3.36Å; V665-V669 PolarHBondContact O-N 3.2Å; V665-V686 HydrophobicContact CG1-CG2 4.42Å; V665-L689 HydrophobicContact CG2-CD1 4.23Å; V665-L708 HydrophobicContact CB-CD2 3.9Å; V665-L708 HydrophobicContact CG1-CD1 4.45Å; V665-L708 HydrophobicContact CG1-CD2 3.58Å
666	E	95.5	Very high	94.5	Very high	29 Å²	29	36.9 Å²	36.9	14%	0.136	18%	0.18	C	C	.	.	H	α-helix	trans	-56.4	-42.6	174.7	-170.4	-175.7	144.9	0	0	111.6	A662 V668 V669 M670 R707 L708	A662-E666 WeakPolarHBondContact O-CB 3.5Å; A662-E666 PolarHBondContact O-N 3.23Å; E666-V668 PolarHBondContact O-N 2.96Å; E666-V669 PolarHBondContact O-N 3.45Å; E666-M670 HydrophobicContact CG-CG 4.26Å; E666-M670 WeakPolarHBondContact O-CB 3.26Å; E666-M670 WeakPolarHBondContact O-CG 3.48Å; E666-M670 PolarHBondContact O-N 3.24Å; E666-R707 IonicContact OE1-CZ 3.46Å; E666-R707 VanDerWaalsContact OE1-CZ 3.25Å; E666-R707 IonicContact OE1-NE 3.13Å; E666-R707 PolarHBondContact OE1-NE 2.8Å; E666-R707 IonicContact OE1-NH2 2.88Å; E666-R707 PolarHBondContact OE1-NH2 3.43Å; E666-R707 IonicContact OE2-NE 3.77Å; E666-R707 PolarHBondContact OE2-NE 3.04Å; E666-L708 HydrophobicContact CB-CD1 4.04Å; E666-L708 HydrophobicContact CG-CD1 4.37Å
667	K	95.5	Very high	94.4	Very high	113 Å²	113	34.6 Å²	34.6	49%	0.491	18%	0.175	S	C	.	.	H	α-helix	trans	-64	-34.4	-180	-79.6	171.9	-178.2	171.3	0	114.3	V663 L664 V665 K671	V663-K667 HydrophobicContact CG1-CD 4.26Å; V663-K667 VanDerWaalsContact O-CG 3.29Å; V663-K667 WeakPolarHBondContact O-CG 3.4Å; V663-K667 PolarHBondContact O-N 3.35Å; V663-K667 VanDerWaalsContact O-N 3.12Å; L664-K667 WeakPolarHBondContact O-CB 3.49Å; L664-K667 PolarHBondContact O-N 3.08Å; V665-K667 VanDerWaalsContact C-N 3.27Å; V665-K667 PolarHBondContact O-N 2.86Å; K667-K671 WeakPolarHBondContact O-CG 3.48Å
668	V	95	Very high	94.2	Very high	8 Å²	8	34.6 Å²	34.6	5%	0.048	18%	0.175	C	C	.	.	H	α-helix	trans	-80.7	-37	175.9	-63.2	0	0	0	0	111.4	T602 F605 F606 F626 L664 V665 E666 M670 K671 G672	T602-V668 HydrophobicContact CG2-CB 4.12Å; T602-V668 HydrophobicContact CG2-CG1 3.59Å; T602-V668 HydrophobicContact CG2-CG2 3.39Å; F605-V668 HydrophobicContact CB-CB 4.2Å; F605-V668 HydrophobicContact CB-CG2 3.95Å; F605-V668 HydrophobicContact CD1-CB 3.86Å; F605-V668 HydrophobicContact CD1-CG2 3.95Å; F605-V668 HydrophobicContact CD2-CG2 4.26Å; F605-V668 HydrophobicContact CG-CB 4.11Å; F605-V668 HydrophobicContact CG-CG2 3.77Å; F606-V668 HydrophobicContact CE2-CB 4.17Å; F606-V668 HydrophobicContact CE2-CG1 3.81Å; F606-V668 HydrophobicContact CZ-CB 3.86Å; F606-V668 HydrophobicContact CZ-CG1 3.92Å; F626-V668 HydrophobicContact CZ-CG2 4.36Å; L664-V668 PolarHBondContact O-N 3.31Å; V665-V668 WeakPolarHBondContact O-CG2 3.41Å; V665-V668 PolarHBondContact O-N 3.44Å; E666-V668 PolarHBondContact O-N 2.96Å; V668-M670 VanDerWaalsContact C-N 3.3Å; V668-M670 PolarHBondContact O-N 2.97Å; V668-K671 WeakPolarHBondContact O-CB 3.35Å; V668-K671 PolarHBondContact O-N 3.3Å; V668-G672 PolarHBondContact O-N 3.28Å
669	V	94.8	Very high	94.1	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-58.7	-44.1	175.4	165	0	0	0	0	110.9	F605 V665 E666 K671 G672 Y674 L682 L708 V711 L715	F605-V669 HydrophobicContact CE2-CG2 4.39Å; F605-V669 HydrophobicContact CZ-CG2 4.29Å; V665-V669 HydrophobicContact CG1-CG2 4.12Å; V665-V669 WeakPolarHBondContact O-CB 3.25Å; V665-V669 VanDerWaalsContact O-CG2 3.25Å; V665-V669 WeakPolarHBondContact O-CG2 3.36Å; V665-V669 PolarHBondContact O-N 3.2Å; E666-V669 PolarHBondContact O-N 3.45Å; V669-K671 PolarHBondContact O-N 3.1Å; V669-G672 PolarHBondContact O-N 2.99Å; V669-Y674 VanDerWaalsContact CA-OH 3.23Å; V669-Y674 WeakPolarHBondContact CA-OH 3.23Å; V669-Y674 PolarHBondContact O-OH 3.32Å; V669-L682 HydrophobicContact CB-CD2 4.36Å; V669-L682 HydrophobicContact CG1-CD2 3.65Å; V669-L682 HydrophobicContact CG2-CD1 3.68Å; V669-L682 HydrophobicContact CG2-CD2 3.78Å; V669-L682 HydrophobicContact CG2-CG 4.33Å; V669-L708 HydrophobicContact CG2-CD1 4.49Å; V669-V711 HydrophobicContact CG1-CG1 3.79Å; V669-L715 HydrophobicContact CG1-CD1 4.06Å
670	M	93.8	Very high	94	Very high	31 Å²	31	36.2 Å²	36.2	15%	0.153	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-6	178.4	-69.4	-62.1	-70.2	0	0	114.6	E666 V668 V711 Q743 V744 L747	E666-M670 HydrophobicContact CG-CG 4.26Å; E666-M670 WeakPolarHBondContact O-CB 3.26Å; E666-M670 WeakPolarHBondContact O-CG 3.48Å; E666-M670 PolarHBondContact O-N 3.24Å; V668-M670 VanDerWaalsContact C-N 3.3Å; V668-M670 PolarHBondContact O-N 2.97Å; M670-V711 HydrophobicContact SD-CG1 4.31Å; M670-Q743 HydrophobicContact CE-CB 4.24Å; M670-Q743 HydrophobicContact CE-CG 3.72Å; M670-V744 HydrophobicContact CE-CG2 3.97Å; M670-V744 HydrophobicContact SD-CG2 3.66Å; M670-L747 HydrophobicContact SD-CD1 4.21Å
671	K	93.1	Very high	93.9	Very high	152 Å²	152	35.1 Å²	35.1	66%	0.661	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105.8	-6.5	175.3	-65.6	175.2	-179.6	-179.3	0	113.4	F606 K667 V668 V669	F606-K671 HydrophobicContact CE1-CB 3.96Å; F606-K671 HydrophobicContact CZ-CB 4.09Å; F606-K671 HydrophobicContact CZ-CD 4Å; K667-K671 WeakPolarHBondContact O-CG 3.48Å; V668-K671 WeakPolarHBondContact O-CB 3.35Å; V668-K671 PolarHBondContact O-N 3.3Å; V669-K671 PolarHBondContact O-N 3.1Å
672	G	90.1	Very high	93.8	Very high	5 Å²	5	35.2 Å²	35.2	5%	0.052	18%	0.175	C	C	.	.			trans	-84.5	170.1	-179.8	0	0	0	0	0	113.5	V668 V669 L747	V668-G672 PolarHBondContact O-N 3.28Å; V669-G672 PolarHBondContact O-N 2.99Å; G672-L747 WeakPolarHBondContact O-CD2 3.4Å
673	T	92.5	Very high	93.7	Very high	85 Å²	85	35.7 Å²	35.7	52%	0.521	18%	0.177	S	C	.	.			trans	-127.9	130.4	170.1	52.9	0	0	0	0	109.6	H610 S611 L747	H610-T673 CarbonylContact C-O 3.54Å; H610-T673 WeakPolarHBondContact CB-O 3.47Å; S611-T673 PolarHBondContact OG-O 2.87Å; S611-T673 VanDerWaalsContact OG-O 3.09Å; T673-L747 CarbonylContact C-O 3.54Å; T673-L747 WeakPolarHBondContact CA-O 3.37Å
674	Y	95.2	Very high	93.6	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.175	C	C	.	.	B	Isolated β-bridge	trans	-121.8	148.4	-166.4	-56	-89.8	0	0	0	112.2	F605 H610 V669 L682 L715 L747 R748 I749	F605-Y674 HydrophobicContact CZ-CE1 4.1Å; F605-Y674 AromaticContact CZ-CZ 3.98Å; F605-Y674 WeakPolarHBondContact CZ-OH 3.29Å; H610-Y674 HydrophobicContact CB-CD1 3.63Å; H610-Y674 HydrophobicContact CB-CE1 3.68Å; H610-Y674 HydrophobicContact CB-CG 4.44Å; H610-Y674 AromaticContact CG-CE1 3.94Å; H610-Y674 WeakPolarHBondContact O-CA 3.2Å; V669-Y674 VanDerWaalsContact CA-OH 3.23Å; V669-Y674 WeakPolarHBondContact CA-OH 3.23Å; V669-Y674 PolarHBondContact O-OH 3.32Å; Y674-L682 HydrophobicContact CE1-CB 4.45Å; Y674-L682 HydrophobicContact CE1-CD2 3.75Å; Y674-L715 HydrophobicContact CD2-CD1 3.99Å; Y674-L715 HydrophobicContact CD2-CD2 3.77Å; Y674-L715 HydrophobicContact CE2-CD1 3.91Å; Y674-L715 HydrophobicContact CE2-CD2 4.35Å; Y674-L715 HydrophobicContact CG-CD1 4.35Å; Y674-L715 HydrophobicContact CG-CD2 4.27Å; Y674-L747 HydrophobicContact CD2-CB 3.87Å; Y674-L747 HydrophobicContact CE2-CB 4.24Å; Y674-L747 HydrophobicContact CE2-CD1 4.19Å; Y674-L747 PolarHBondContact N-O 3.13Å; Y674-R748 CarbonylContact O-C 3.58Å; Y674-R748 VanDerWaalsContact O-CA 3.24Å; Y674-R748 WeakPolarHBondContact O-CA 3.21Å; Y674-I749 WeakPolarHBondContact O-CG1 3.24Å; Y674-I749 PolarHBondContact O-N 3.45Å
675	N	92.6	Very high	93.5	Very high	31 Å²	31	36 Å²	36	17%	0.166	17%	0.173	C	C	.	.			trans	-104.7	-177.2	154.5	69.2	6.8	0	0	0	109.3	H610 S611 P612 L677 G678 G679 I749	H610-N675 PolarHBondContact O-N 3.47Å; S611-N675 PolarHBondContact O-ND2 3.01Å; S611-N675 PolarHBondContact OG-N 3.33Å; P612-N675 WeakPolarHBondContact CD-OD1 3.32Å; P612-N675 PolarHBondContact O-ND2 3.2Å; N675-L677 PolarHBondContact O-N 3.48Å; N675-L677 PolarHBondContact OD1-N 3.34Å; N675-G678 PolarHBondContact O-N 2.93Å; N675-G678 PolarHBondContact OD1-N 3.1Å; N675-G679 PolarHBondContact O-N 3.02Å; N675-I749 HydrophobicContact CB-CD1 4.35Å; N675-I749 HydrophobicContact CB-CG1 4.31Å
676	R	89.9	Confident	93.4	Very high	81 Å²	81	36 Å²	36	31%	0.306	17%	0.173	S	C	.	.	H	α-helix	trans	-55.2	-45.2	178.8	-175.5	58.1	164	133.8	-15.2	113.9	G679 L680 N716 D718	R676-G679 PolarHBondContact O-N 3Å; R676-L680 PolarHBondContact O-N 2.92Å; R676-N716 VanDerWaalsContact NH1-C 3.34Å; R676-N716 VanDerWaalsContact NH1-CA 3.26Å; R676-N716 VanDerWaalsContact NH1-CB 3.3Å; R676-N716 PolarHBondContact NH1-O 3.12Å; R676-N716 PolarHBondContact NH1-OD1 3.25Å; R676-N716 PolarHBondContact NH2-O 3.03Å; R676-D718 IonicContact CZ-OD1 3.41Å; R676-D718 IonicContact NE-OD1 2.69Å; R676-D718 PolarHBondContact NE-OD1 2.81Å; R676-D718 IonicContact NH2-OD1 2.84Å; R676-D718 PolarHBondContact NH2-OD1 2.84Å; R676-D718 IonicContact NH2-OD2 3.2Å
677	L	91.5	Very high	93.3	Very high	47 Å²	47	39.6 Å²	39.6	25%	0.246	19%	0.185	C	C	.	.	H	α-helix	trans	-66.6	-39.1	-179.4	-67.9	178.5	0	0	0	111.6	P612 E614 Y617 N675 L680 L681	P612-L677 HydrophobicContact CG-CB 4.09Å; E614-L677 HydrophobicContact CG-CD1 4.15Å; Y617-L677 HydrophobicContact CD2-CB 3.84Å; Y617-L677 HydrophobicContact CD2-CD2 4.35Å; Y617-L677 WeakPolarHBondContact CD2-O 3.48Å; Y617-L677 WeakPolarHBondContact CE2-O 3.42Å; Y617-L677 HydrophobicContact CG-CB 4.29Å; Y617-L677 HydrophobicContact CG-CD2 4.4Å; N675-L677 PolarHBondContact O-N 3.48Å; N675-L677 PolarHBondContact OD1-N 3.34Å; L677-L680 PolarHBondContact O-N 3.38Å; L677-L681 WeakPolarHBondContact O-CB 3.49Å; L677-L681 PolarHBondContact O-N 3.01Å
678	G	92.7	Very high	93.3	Very high	2 Å²	2	38.7 Å²	38.7	2%	0.021	18%	0.183	C	C	.	.	H	α-helix	trans	-66.7	-38.1	174.6	0	0	0	0	0	113.5	H610 N675 L680 L681 L682	H610-G678 WeakPolarHBondContact O-CA 3.25Å; N675-G678 PolarHBondContact O-N 2.93Å; N675-G678 PolarHBondContact OD1-N 3.1Å; G678-L680 VanDerWaalsContact C-N 3.34Å; G678-L681 PolarHBondContact O-N 3.05Å; G678-L682 WeakPolarHBondContact O-CB 3.33Å; G678-L682 PolarHBondContact O-N 2.89Å
679	G	92.6	Very high	93.3	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-61.3	-41.9	171.1	0	0	0	0	0	112.2	N675 R676 D683 N716	N675-G679 PolarHBondContact O-N 3.02Å; R676-G679 PolarHBondContact O-N 3Å; G679-D683 VanDerWaalsContact O-CB 3.29Å; G679-D683 WeakPolarHBondContact O-CB 3.35Å; G679-D683 PolarHBondContact O-N 3.33Å; G679-N716 PolarHBondContact O-ND2 3.08Å; G679-N716 PolarHBondContact O-OD1 2.62Å
680	L	92.9	Very high	93.2	Very high	63 Å²	63	38.7 Å²	38.7	33%	0.33	18%	0.184	S	C	.	.	H	α-helix	trans	-66.8	-42.7	178.8	-176.4	66.9	0	0	0	111.6	Y617 R676 L677 G678 D683 K684 N716	Y617-L680 HydrophobicContact CE2-CD2 4.45Å; R676-L680 PolarHBondContact O-N 2.92Å; L677-L680 PolarHBondContact O-N 3.38Å; G678-L680 VanDerWaalsContact C-N 3.34Å; L680-D683 PolarHBondContact O-N 3.39Å; L680-K684 PolarHBondContact O-N 2.91Å; L680-K684 VanDerWaalsContact O-N 3.13Å; L680-N716 WeakPolarHBondContact CA-OD1 3.39Å; L680-N716 PolarHBondContact N-OD1 3.22Å
681	L	93	Very high	93.2	Very high	10 Å²	10	41.3 Å²	41.3	5%	0.052	20%	0.198	C	C	.	.	H	α-helix	trans	-61.4	-50.8	176	-178.2	62.3	0	0	0	110.9	Y617 L620 E621 L677 G678 D683 K684 Q685	Y617-L681 HydrophobicContact CD2-CB 4.24Å; Y617-L681 HydrophobicContact CE2-CB 3.89Å; L620-L681 HydrophobicContact CB-CD2 3.76Å; L620-L681 HydrophobicContact CD1-CD2 4.31Å; E621-L681 HydrophobicContact CB-CD1 4.06Å; L677-L681 WeakPolarHBondContact O-CB 3.49Å; L677-L681 PolarHBondContact O-N 3.01Å; G678-L681 PolarHBondContact O-N 3.05Å; L681-D683 VanDerWaalsContact C-N 3.26Å; L681-D683 PolarHBondContact O-N 3.48Å; L681-K684 WeakPolarHBondContact O-CB 3.2Å; L681-K684 PolarHBondContact O-N 3.2Å; L681-K684 VanDerWaalsContact O-N 3.1Å; L681-Q685 WeakPolarHBondContact O-CG 3.29Å; L681-Q685 PolarHBondContact O-N 3.22Å
682	L	94.1	Very high	93.3	Very high	2 Å²	2	35.8 Å²	35.8	1%	0.01	17%	0.174	C	C	.	.	H	α-helix	trans	-57.6	-40.9	179	176.8	64.9	0	0	0	111.8	F605 V669 Y674 G678 K684 Q685 V686 T712 L715	F605-L682 HydrophobicContact CE2-CD1 4.04Å; V669-L682 HydrophobicContact CB-CD2 4.36Å; V669-L682 HydrophobicContact CG1-CD2 3.65Å; V669-L682 HydrophobicContact CG2-CD1 3.68Å; V669-L682 HydrophobicContact CG2-CD2 3.78Å; V669-L682 HydrophobicContact CG2-CG 4.33Å; Y674-L682 HydrophobicContact CE1-CB 4.45Å; Y674-L682 HydrophobicContact CE1-CD2 3.75Å; G678-L682 WeakPolarHBondContact O-CB 3.33Å; G678-L682 PolarHBondContact O-N 2.89Å; L682-K684 VanDerWaalsContact C-N 3.34Å; L682-K684 PolarHBondContact O-N 3.5Å; L682-Q685 WeakPolarHBondContact O-CB 3.45Å; L682-Q685 PolarHBondContact O-N 2.96Å; L682-V686 HydrophobicContact CD1-CG2 3.99Å; L682-V686 HydrophobicContact CG-CG2 4.25Å; L682-V686 WeakPolarHBondContact O-CB 3.3Å; L682-V686 WeakPolarHBondContact O-CG2 3.43Å; L682-V686 PolarHBondContact O-N 2.92Å; L682-T712 HydrophobicContact CD2-CG2 4.23Å; L682-T712 HydrophobicContact CG-CG2 4.11Å; L682-L715 HydrophobicContact CD2-CD1 3.64Å
683	D	94.6	Very high	93.5	Very high	15 Å²	15	35.6 Å²	35.6	8%	0.08	17%	0.171	C	C	.	.	H	α-helix	trans	-66.9	-34.8	179.6	-170.5	36	0	0	0	112.3	G679 L680 L681 R687 T712 N716	G679-D683 VanDerWaalsContact O-CB 3.29Å; G679-D683 WeakPolarHBondContact O-CB 3.35Å; G679-D683 PolarHBondContact O-N 3.33Å; L680-D683 PolarHBondContact O-N 3.39Å; L681-D683 VanDerWaalsContact C-N 3.26Å; L681-D683 PolarHBondContact O-N 3.48Å; D683-R687 WeakPolarHBondContact O-CB 3.17Å; D683-R687 WeakPolarHBondContact O-CG 3.29Å; D683-R687 VanDerWaalsContact O-CZ 3.32Å; D683-R687 PolarHBondContact O-N 3.45Å; D683-R687 VanDerWaalsContact O-N 3.15Å; D683-R687 PolarHBondContact O-NE 2.87Å; D683-R687 VanDerWaalsContact O-NE 3.16Å; D683-R687 PolarHBondContact O-NH2 2.9Å; D683-R687 IonicContact OD1-CZ 3.7Å; D683-R687 IonicContact OD1-NH1 3.32Å; D683-R687 PolarHBondContact OD1-NH1 3.18Å; D683-R687 IonicContact OD1-NH2 3.47Å; D683-R687 IonicContact OD2-CZ 3.12Å; D683-R687 IonicContact OD2-NH1 3.41Å; D683-R687 PolarHBondContact OD2-NH1 3.36Å; D683-R687 IonicContact OD2-NH2 3.61Å; D683-R687 PolarHBondContact OD2-NH2 3.25Å; D683-T712 WeakPolarHBondContact OD1-CB 3.14Å; D683-T712 PolarHBondContact OD1-OG1 3.46Å; D683-N716 WeakPolarHBondContact CB-ND2 3.37Å; D683-N716 PolarHBondContact OD2-ND2 3.23Å
684	K	93.9	Very high	93.5	Very high	76 Å²	76	32.6 Å²	32.6	33%	0.33	15%	0.153	S	C	.	.	H	α-helix	trans	-63.8	-47	168.1	-72.5	177.2	175.2	175.4	0	111.4	Y617 E621 L680 L681 L682 V686 R687 E688	Y617-K684 PolarHBondContact OH-NZ 3.47Å; E621-K684 IonicContact OE1-NZ 3.08Å; E621-K684 PolarHBondContact OE1-NZ 3.44Å; E621-K684 IonicContact OE2-NZ 2.75Å; E621-K684 PolarHBondContact OE2-NZ 2.94Å; L680-K684 PolarHBondContact O-N 2.91Å; L680-K684 VanDerWaalsContact O-N 3.13Å; L681-K684 WeakPolarHBondContact O-CB 3.2Å; L681-K684 PolarHBondContact O-N 3.2Å; L681-K684 VanDerWaalsContact O-N 3.1Å; L682-K684 VanDerWaalsContact C-N 3.34Å; L682-K684 PolarHBondContact O-N 3.5Å; K684-V686 PolarHBondContact O-N 2.88Å; K684-R687 PolarHBondContact O-N 2.63Å; K684-E688 WeakPolarHBondContact O-CB 3.17Å; K684-E688 PolarHBondContact O-N 2.89Å
685	Q	94.4	Very high	93.3	Very high	6 Å²	6	37 Å²	37	3%	0.028	18%	0.184	C	C	.	.	H	α-helix	trans	-61.5	-45	-179.9	-68.7	178.3	-35.4	0	0	112.7	N624 V627 L681 L682 E688 L689	N624-Q685 WeakPolarHBondContact OD1-CG 3.4Å; N624-Q685 PolarHBondContact OD1-NE2 3.18Å; N624-Q685 VanDerWaalsContact OD1-NE2 3.11Å; V627-Q685 HydrophobicContact CG2-CB 3.57Å; V627-Q685 HydrophobicContact CG2-CG 3.76Å; L681-Q685 WeakPolarHBondContact O-CG 3.29Å; L681-Q685 PolarHBondContact O-N 3.22Å; L682-Q685 WeakPolarHBondContact O-CB 3.45Å; L682-Q685 PolarHBondContact O-N 2.96Å; Q685-E688 PolarHBondContact O-N 3.4Å; Q685-L689 WeakPolarHBondContact O-CG 2.99Å; Q685-L689 PolarHBondContact O-N 2.8Å
686	V	94.6	Very high	93.2	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-64.4	-41.5	177.3	168.7	0	0	0	0	111	V665 L682 K684 E688 L689 A690 F705 L708 T712	V665-V686 HydrophobicContact CG1-CG2 4.42Å; L682-V686 HydrophobicContact CD1-CG2 3.99Å; L682-V686 HydrophobicContact CG-CG2 4.25Å; L682-V686 WeakPolarHBondContact O-CB 3.3Å; L682-V686 WeakPolarHBondContact O-CG2 3.43Å; L682-V686 PolarHBondContact O-N 2.92Å; K684-V686 PolarHBondContact O-N 2.88Å; V686-E688 VanDerWaalsContact C-N 3.33Å; V686-E688 PolarHBondContact O-N 2.84Å; V686-L689 PolarHBondContact O-N 3.47Å; V686-A690 VanDerWaalsContact O-CB 3.26Å; V686-A690 WeakPolarHBondContact O-CB 3.23Å; V686-A690 PolarHBondContact O-N 3.4Å; V686-F705 HydrophobicContact CG1-CD1 4.35Å; V686-L708 HydrophobicContact CG1-CD2 3.85Å; V686-L708 HydrophobicContact CG1-CG 3.84Å; V686-L708 HydrophobicContact CG2-CD2 3.97Å; V686-L708 HydrophobicContact CG2-CG 4.11Å; V686-T712 HydrophobicContact CB-CG2 4.01Å; V686-T712 HydrophobicContact CG1-CG2 4.23Å; V686-T712 HydrophobicContact CG2-CG2 3.74Å
687	R	93.5	Very high	93.1	Very high	105 Å²	105	35.5 Å²	35.5	40%	0.396	18%	0.183	S	C	.	.	H	α-helix	trans	-62.2	-40.7	174.5	-81.1	-175.3	-77	-100.6	-0.1	112.3	D683 K684 A690 N691	D683-R687 WeakPolarHBondContact O-CB 3.17Å; D683-R687 WeakPolarHBondContact O-CG 3.29Å; D683-R687 VanDerWaalsContact O-CZ 3.32Å; D683-R687 PolarHBondContact O-N 3.45Å; D683-R687 VanDerWaalsContact O-N 3.15Å; D683-R687 PolarHBondContact O-NE 2.87Å; D683-R687 VanDerWaalsContact O-NE 3.16Å; D683-R687 PolarHBondContact O-NH2 2.9Å; D683-R687 IonicContact OD1-CZ 3.7Å; D683-R687 IonicContact OD1-NH1 3.32Å; D683-R687 PolarHBondContact OD1-NH1 3.18Å; D683-R687 IonicContact OD1-NH2 3.47Å; D683-R687 IonicContact OD2-CZ 3.12Å; D683-R687 IonicContact OD2-NH1 3.41Å; D683-R687 PolarHBondContact OD2-NH1 3.36Å; D683-R687 IonicContact OD2-NH2 3.61Å; D683-R687 PolarHBondContact OD2-NH2 3.25Å; K684-R687 PolarHBondContact O-N 2.63Å; R687-A690 PolarHBondContact O-N 3.45Å; R687-N691 WeakPolarHBondContact O-CB 3.44Å; R687-N691 PolarHBondContact O-N 2.72Å; R687-N691 PolarHBondContact O-ND2 2.79Å; R687-N691 VanDerWaalsContact O-ND2 3.16Å
688	E	94.7	Very high	92.9	Very high	93 Å²	93	34.8 Å²	34.8	44%	0.435	19%	0.187	S	C	.	.	H	α-helix	trans	-64.9	-47.5	177.5	-169.3	175.7	176.1	0	0	111.7	N624 V627 K684 Q685 V686 A690 N691 Y692	N624-E688 PolarHBondContact ND2-OE2 3.21Å; V627-E688 HydrophobicContact CG1-CB 4.4Å; V627-E688 HydrophobicContact CG1-CG 4.02Å; K684-E688 WeakPolarHBondContact O-CB 3.17Å; K684-E688 PolarHBondContact O-N 2.89Å; Q685-E688 PolarHBondContact O-N 3.4Å; V686-E688 VanDerWaalsContact C-N 3.33Å; V686-E688 PolarHBondContact O-N 2.84Å; E688-A690 VanDerWaalsContact C-N 3.35Å; E688-A690 PolarHBondContact O-N 2.94Å; E688-N691 PolarHBondContact O-N 3.36Å; E688-Y692 PolarHBondContact O-N 2.84Å
689	L	94.6	Very high	92.4	Very high	1 Å²	1	43.4 Å²	43.4	1%	0.005	22%	0.219	C	C	.	.	H	α-helix	trans	-59.8	-43.4	174.2	-74	171.7	0	0	0	112.3	F626 V627 I630 V631 V665 Q685 V686 N691 Y692 L693	F626-L689 HydrophobicContact CE1-CD1 4.13Å; V627-L689 HydrophobicContact CB-CD2 4.42Å; V627-L689 HydrophobicContact CB-CG 4.48Å; V627-L689 HydrophobicContact CG1-CD2 3.84Å; V627-L689 HydrophobicContact CG1-CG 4.05Å; V627-L689 HydrophobicContact CG2-CD1 4.35Å; V627-L689 HydrophobicContact CG2-CG 4.07Å; I630-L689 HydrophobicContact CB-CD2 3.99Å; I630-L689 HydrophobicContact CD1-CD1 4.05Å; I630-L689 HydrophobicContact CD1-CD2 4.42Å; I630-L689 HydrophobicContact CG2-CD2 3.75Å; V631-L689 HydrophobicContact CG2-CD2 4.26Å; V665-L689 HydrophobicContact CG2-CD1 4.23Å; Q685-L689 WeakPolarHBondContact O-CG 2.99Å; Q685-L689 PolarHBondContact O-N 2.8Å; V686-L689 PolarHBondContact O-N 3.47Å; L689-N691 VanDerWaalsContact C-N 3.34Å; L689-N691 PolarHBondContact O-N 3.07Å; L689-Y692 PolarHBondContact O-N 2.58Å; L689-L693 PolarHBondContact O-N 3.16Å
690	A	93.7	Very high	92.1	Very high	8 Å²	8	45.8 Å²	45.8	7%	0.066	24%	0.239	C	C	.	.	H	α-helix	trans	-62.8	-41.6	176.7	0	0	0	0	0	111.2	V686 R687 E688 T694 F705	V686-A690 VanDerWaalsContact O-CB 3.26Å; V686-A690 WeakPolarHBondContact O-CB 3.23Å; V686-A690 PolarHBondContact O-N 3.4Å; R687-A690 PolarHBondContact O-N 3.45Å; E688-A690 VanDerWaalsContact C-N 3.35Å; E688-A690 PolarHBondContact O-N 2.94Å; A690-T694 VanDerWaalsContact O-CB 3.28Å; A690-T694 WeakPolarHBondContact O-CB 3.48Å; A690-T694 PolarHBondContact O-N 3.17Å; A690-T694 PolarHBondContact O-OG1 3.07Å; A690-F705 HydrophobicContact CB-CB 4.25Å; A690-F705 HydrophobicContact CB-CD1 3.97Å; A690-F705 HydrophobicContact CB-CD2 4.13Å; A690-F705 HydrophobicContact CB-CE1 4.44Å; A690-F705 HydrophobicContact CB-CG 3.83Å
691	N	93.9	Very high	91.7	Very high	85 Å²	85	42.8 Å²	42.8	46%	0.455	22%	0.223	S	C	.	.	H	α-helix	trans	-67.2	-40.9	177.1	-75.4	-30.1	0	0	0	112.4	R687 E688 L689 T694 S695	R687-N691 WeakPolarHBondContact O-CB 3.44Å; R687-N691 PolarHBondContact O-N 2.72Å; R687-N691 PolarHBondContact O-ND2 2.79Å; R687-N691 VanDerWaalsContact O-ND2 3.16Å; E688-N691 PolarHBondContact O-N 3.36Å; L689-N691 VanDerWaalsContact C-N 3.34Å; L689-N691 PolarHBondContact O-N 3.07Å; N691-T694 WeakPolarHBondContact O-CB 3.45Å; N691-T694 PolarHBondContact O-N 3.15Å; N691-S695 PolarHBondContact O-N 2.85Å
692	Y	94.9	Very high	91.4	Very high	37 Å²	37	47.6 Å²	47.6	15%	0.145	24%	0.241	C	C	.	.	H	α-helix	trans	-61.6	-47.4	174.2	168.4	-100.3	0	0	0	111.7	V631 L634 D635 E688 L689 T694 S695 L696	V631-Y692 HydrophobicContact CB-CE1 4.47Å; V631-Y692 HydrophobicContact CG1-CD2 4.05Å; V631-Y692 HydrophobicContact CG1-CE1 4.39Å; V631-Y692 HydrophobicContact CG1-CE2 3.65Å; V631-Y692 HydrophobicContact CG2-CD1 3.86Å; V631-Y692 HydrophobicContact CG2-CD2 4.19Å; V631-Y692 HydrophobicContact CG2-CE1 4.1Å; V631-Y692 HydrophobicContact CG2-CE2 4.41Å; V631-Y692 HydrophobicContact CG2-CG 3.91Å; L634-Y692 HydrophobicContact CB-CE1 4.21Å; L634-Y692 HydrophobicContact CD1-CE1 3.95Å; D635-Y692 VanDerWaalsContact CG-OH 3.25Å; D635-Y692 PolarHBondContact OD1-OH 3.27Å; E688-Y692 PolarHBondContact O-N 2.84Å; L689-Y692 PolarHBondContact O-N 2.58Å; Y692-T694 VanDerWaalsContact C-N 3.29Å; Y692-T694 PolarHBondContact O-N 3.35Å; Y692-S695 PolarHBondContact O-N 2.96Å; Y692-S695 PolarHBondContact O-OG 3.48Å; Y692-L696 HydrophobicContact CD1-CD1 4.34Å; Y692-L696 HydrophobicContact CE1-CD1 3.64Å; Y692-L696 HydrophobicContact CE2-CD1 4.02Å; Y692-L696 HydrophobicContact CE2-CG 4.44Å; Y692-L696 VanDerWaalsContact CZ-CD1 3.46Å; Y692-L696 PolarHBondContact O-N 3.1Å
693	L	93	Very high	91.2	Very high	1 Å²	1	53.6 Å²	53.6	1%	0.005	27%	0.269	C	S	.	.	H	α-helix	trans	-68.8	-30.4	177.2	-76.3	162.3	0	0	0	112.7	L634 A658 T661 L689 S695 L696 S697 S701 F705	L634-L693 HydrophobicContact CD1-CD2 4.09Å; A658-L693 HydrophobicContact CB-CB 4.3Å; A658-L693 HydrophobicContact CB-CD1 4.38Å; A658-L693 HydrophobicContact CB-CD2 4.21Å; T661-L693 HydrophobicContact CG2-CD1 3.85Å; L689-L693 PolarHBondContact O-N 3.16Å; L693-S695 VanDerWaalsContact C-N 3.34Å; L693-L696 PolarHBondContact O-N 2.74Å; L693-S697 WeakPolarHBondContact O-CB 3.41Å; L693-S697 PolarHBondContact O-N 2.67Å; L693-S697 PolarHBondContact O-OG 2.67Å; L693-S701 PolarHBondContact O-OG 3.01Å; L693-F705 HydrophobicContact CB-CE2 4.32Å; L693-F705 HydrophobicContact CD1-CE2 3.62Å; L693-F705 HydrophobicContact CD1-CZ 3.37Å
694	T	92.7	Very high	91.1	Very high	21 Å²	21	57.5 Å²	57.5	13%	0.129	29%	0.285	C	S	.	.	H	α-helix	trans	-64.8	-38.1	171.9	-57.6	0	0	0	0	111.6	A690 N691 Y692 L696 G698 S701 R702	A690-T694 VanDerWaalsContact O-CB 3.28Å; A690-T694 WeakPolarHBondContact O-CB 3.48Å; A690-T694 PolarHBondContact O-N 3.17Å; A690-T694 PolarHBondContact O-OG1 3.07Å; N691-T694 WeakPolarHBondContact O-CB 3.45Å; N691-T694 PolarHBondContact O-N 3.15Å; Y692-T694 VanDerWaalsContact C-N 3.29Å; Y692-T694 PolarHBondContact O-N 3.35Å; T694-L696 VanDerWaalsContact C-N 3.3Å; T694-L696 PolarHBondContact O-N 3.47Å; T694-G698 CarbonylContact O-C 3.59Å; T694-G698 VanDerWaalsContact O-CA 3.24Å; T694-G698 WeakPolarHBondContact O-CA 3.46Å; T694-G698 PolarHBondContact O-N 2.81Å; T694-S701 VanDerWaalsContact CA-OG 3.29Å; T694-S701 WeakPolarHBondContact CA-OG 3.4Å; T694-S701 PolarHBondContact N-OG 3.27Å; T694-R702 HydrophobicContact CG2-CG 4.2Å; T694-R702 VanDerWaalsContact OG1-CG 3.25Å; T694-R702 WeakPolarHBondContact OG1-CG 3.33Å
695	S	92.4	Very high	91	Very high	93 Å²	93	53.9 Å²	53.9	65%	0.65	27%	0.269	S	S	*	.	H	α-helix	trans	-69.4	-29.4	178.2	76.8	0	0	0	0	112.4	N691 Y692 L693	N691-S695 PolarHBondContact O-N 2.85Å; Y692-S695 PolarHBondContact O-N 2.96Å; Y692-S695 PolarHBondContact O-OG 3.48Å; L693-S695 VanDerWaalsContact C-N 3.34Å
696	L	89.9	Confident	90.9	Very high	58 Å²	58	55.9 Å²	55.9	30%	0.304	28%	0.284	S	S	.	.	H	α-helix	trans	-81.7	-52.9	176.9	-68.1	178.3	0	0	0	113.5	L638 L654 Y692 L693 T694	L638-L696 HydrophobicContact CD1-CD1 4.05Å; L654-L696 HydrophobicContact CD1-CB 4.49Å; L654-L696 WeakPolarHBondContact CD1-O 3.04Å; L654-L696 HydrophobicContact CD2-CB 4.37Å; Y692-L696 HydrophobicContact CD1-CD1 4.34Å; Y692-L696 HydrophobicContact CE1-CD1 3.64Å; Y692-L696 HydrophobicContact CE2-CD1 4.02Å; Y692-L696 HydrophobicContact CE2-CG 4.44Å; Y692-L696 VanDerWaalsContact CZ-CD1 3.46Å; Y692-L696 PolarHBondContact O-N 3.1Å; L693-L696 PolarHBondContact O-N 2.74Å; T694-L696 VanDerWaalsContact C-N 3.3Å; T694-L696 PolarHBondContact O-N 3.47Å
697	S	86.8	Confident	90.8	Very high	22 Å²	22	59 Å²	59	15%	0.154	30%	0.296	C	S	.	.	H	α-helix	trans	-99.6	-8.4	-168.1	65.6	0	0	0	0	114.4	L693 S701	L693-S697 WeakPolarHBondContact O-CB 3.41Å; L693-S697 PolarHBondContact O-N 2.67Å; L693-S697 PolarHBondContact O-OG 2.67Å; S697-S701 WeakPolarHBondContact OG-CB 3.24Å; S697-S701 PolarHBondContact OG-OG 2.89Å
698	G	87.6	Confident	90.9	Very high	33 Å²	33	54 Å²	54	34%	0.34	28%	0.277	S	S	.	.			trans	86.9	-177.3	-174.3	0	0	0	0	0	113.6	T694 A700 S701	T694-G698 CarbonylContact O-C 3.59Å; T694-G698 VanDerWaalsContact O-CA 3.24Å; T694-G698 WeakPolarHBondContact O-CA 3.46Å; T694-G698 PolarHBondContact O-N 2.81Å; G698-A700 VanDerWaalsContact C-N 3.29Å; G698-A700 PolarHBondContact O-N 3.5Å; G698-S701 PolarHBondContact O-N 3.25Å; G698-S701 PolarHBondContact O-OG 3.05Å
699	W	83.9	Confident	90.7	Very high	183 Å²	183	52 Å²	52	69%	0.693	27%	0.269	S	S	*	.	G	3₁₀ helix	trans	-64.4	-27.5	-167.2	-158.1	72.2	0	0	0	114.5	S701 R702	W699-S701 PolarHBondContact O-N 3.2Å; W699-S701 VanDerWaalsContact O-N 3.14Å; W699-R702 VanDerWaalsContact NE1-NH1 3.19Å; W699-R702 WeakPolarHBondContact O-CB 3.39Å; W699-R702 PolarHBondContact O-N 3.21Å; W699-R702 VanDerWaalsContact O-N 3.12Å
700	A	84.6	Confident	90.6	Very high	50 Å²	50	52.7 Å²	52.7	41%	0.413	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-62.1	-20.4	179.8	0	0	0	0	0	113.8	G698 R702	G698-A700 VanDerWaalsContact C-N 3.29Å; G698-A700 PolarHBondContact O-N 3.5Å; A700-R702 VanDerWaalsContact C-N 3.32Å; A700-R702 PolarHBondContact O-N 3.15Å
701	S	85.7	Confident	90.6	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-71.1	-23.6	175.9	56.5	0	0	0	0	114.2	L693 T694 S697 G698 W699 E703 K704	L693-S701 PolarHBondContact O-OG 3.01Å; T694-S701 VanDerWaalsContact CA-OG 3.29Å; T694-S701 WeakPolarHBondContact CA-OG 3.4Å; T694-S701 PolarHBondContact N-OG 3.27Å; S697-S701 WeakPolarHBondContact OG-CB 3.24Å; S697-S701 PolarHBondContact OG-OG 2.89Å; G698-S701 PolarHBondContact O-N 3.25Å; G698-S701 PolarHBondContact O-OG 3.05Å; W699-S701 PolarHBondContact O-N 3.2Å; W699-S701 VanDerWaalsContact O-N 3.14Å; S701-E703 PolarHBondContact O-N 3.29Å; S701-K704 VanDerWaalsContact O-CB 3.27Å; S701-K704 WeakPolarHBondContact O-CB 3.41Å; S701-K704 PolarHBondContact O-N 3.47Å
702	R	86.4	Confident	90.6	Very high	111 Å²	111	48.2 Å²	48.2	42%	0.419	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-59.5	-36.4	178	-73.3	-170.3	168.1	168.2	-2.7	112.2	T694 W699 A700 K704 F705 S706	T694-R702 HydrophobicContact CG2-CG 4.2Å; T694-R702 VanDerWaalsContact OG1-CG 3.25Å; T694-R702 WeakPolarHBondContact OG1-CG 3.33Å; W699-R702 VanDerWaalsContact NE1-NH1 3.19Å; W699-R702 WeakPolarHBondContact O-CB 3.39Å; W699-R702 PolarHBondContact O-N 3.21Å; W699-R702 VanDerWaalsContact O-N 3.12Å; A700-R702 VanDerWaalsContact C-N 3.32Å; A700-R702 PolarHBondContact O-N 3.15Å; R702-K704 PolarHBondContact O-N 2.73Å; R702-F705 PolarHBondContact O-N 3.12Å; R702-S706 PolarHBondContact O-N 3.43Å
703	E	89.3	Confident	90.4	Very high	128 Å²	128	48.8 Å²	48.8	60%	0.598	26%	0.256	S	S	*	.	G	3₁₀ helix	trans	-60.9	-28.6	176.6	-63.4	-176.6	173.7	0	0	112.3	S701 F705 S706	S701-E703 PolarHBondContact O-N 3.29Å; E703-F705 PolarHBondContact O-N 2.69Å; E703-S706 WeakPolarHBondContact O-CB 3.09Å; E703-S706 PolarHBondContact O-N 2.99Å; E703-S706 PolarHBondContact O-OG 2.95Å
704	K	91.9	Very high	90.4	Very high	96 Å²	96	48.7 Å²	48.7	42%	0.417	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-69.3	-24.9	177.3	-51.1	-52.3	179	-163.4	0	112.3	A659 A662 S701 R702	A659-K704 HydrophobicContact CB-CB 4.48Å; A659-K704 HydrophobicContact CB-CD 4.04Å; A659-K704 HydrophobicContact CB-CG 4.12Å; A662-K704 HydrophobicContact CB-CB 4.46Å; A662-K704 VanDerWaalsContact CB-O 3.24Å; A662-K704 WeakPolarHBondContact CB-O 3.29Å; S701-K704 VanDerWaalsContact O-CB 3.27Å; S701-K704 WeakPolarHBondContact O-CB 3.41Å; S701-K704 PolarHBondContact O-N 3.47Å; R702-K704 PolarHBondContact O-N 2.73Å
705	F	93.4	Very high	90.4	Very high	1 Å²	1	47.7 Å²	47.7	0%	0.004	25%	0.25	C	C	.	.	G	3₁₀ helix	trans	-91.4	-6.6	178.1	-75.1	-94	0	0	0	113.4	T661 A662 V686 A690 L693 R702 E703 R707 L708 N709	T661-F705 HydrophobicContact CG2-CZ 4.48Å; A662-F705 HydrophobicContact CB-CD1 4.24Å; A662-F705 HydrophobicContact CB-CD2 4.37Å; A662-F705 HydrophobicContact CB-CE1 4.1Å; A662-F705 HydrophobicContact CB-CE2 4.23Å; A662-F705 HydrophobicContact CB-CG 4.34Å; A662-F705 HydrophobicContact CB-CZ 4.06Å; V686-F705 HydrophobicContact CG1-CD1 4.35Å; A690-F705 HydrophobicContact CB-CB 4.25Å; A690-F705 HydrophobicContact CB-CD1 3.97Å; A690-F705 HydrophobicContact CB-CD2 4.13Å; A690-F705 HydrophobicContact CB-CE1 4.44Å; A690-F705 HydrophobicContact CB-CG 3.83Å; L693-F705 HydrophobicContact CB-CE2 4.32Å; L693-F705 HydrophobicContact CD1-CE2 3.62Å; L693-F705 HydrophobicContact CD1-CZ 3.37Å; R702-F705 PolarHBondContact O-N 3.12Å; E703-F705 PolarHBondContact O-N 2.69Å; F705-R707 VanDerWaalsContact C-N 3.29Å; F705-R707 PolarHBondContact O-N 3Å; F705-L708 HydrophobicContact CD1-CD2 3.99Å; F705-L708 HydrophobicContact CE1-CD2 4.2Å; F705-L708 PolarHBondContact O-N 3.28Å; F705-N709 VanDerWaalsContact O-CG 3.3Å; F705-N709 PolarHBondContact O-N 3.31Å; F705-N709 PolarHBondContact O-ND2 3.28Å
706	S	91.8	Very high	90.4	Very high	48 Å²	48	44 Å²	44	34%	0.336	22%	0.223	S	C	.	.	H	α-helix	trans	-53.7	-43.4	-175.7	-64	0	0	0	0	113.5	R702 E703 N709 Q710	R702-S706 PolarHBondContact O-N 3.43Å; E703-S706 WeakPolarHBondContact O-CB 3.09Å; E703-S706 PolarHBondContact O-N 2.99Å; E703-S706 PolarHBondContact O-OG 2.95Å; S706-N709 PolarHBondContact O-N 3.19Å; S706-Q710 PolarHBondContact O-N 3.13Å; S706-Q710 VanDerWaalsContact O-N 3.13Å
707	R	92.5	Very high	90.4	Very high	64 Å²	64	41.5 Å²	41.5	24%	0.242	21%	0.21	C	C	.	.	H	α-helix	trans	-69.7	-40.3	178.7	-175	173.9	152.1	102.6	4.1	112.1	E666 F705 Q710 V711 L735 L736 E740	E666-R707 IonicContact OE1-CZ 3.46Å; E666-R707 VanDerWaalsContact OE1-CZ 3.25Å; E666-R707 IonicContact OE1-NE 3.13Å; E666-R707 PolarHBondContact OE1-NE 2.8Å; E666-R707 IonicContact OE1-NH2 2.88Å; E666-R707 PolarHBondContact OE1-NH2 3.43Å; E666-R707 IonicContact OE2-NE 3.77Å; E666-R707 PolarHBondContact OE2-NE 3.04Å; F705-R707 VanDerWaalsContact C-N 3.29Å; F705-R707 PolarHBondContact O-N 3Å; R707-Q710 WeakPolarHBondContact O-CB 3.43Å; R707-Q710 PolarHBondContact O-N 3.1Å; R707-V711 PolarHBondContact O-N 3.12Å; R707-L735 HydrophobicContact CB-CB 4.39Å; R707-L735 HydrophobicContact CB-CD1 3.98Å; R707-L735 HydrophobicContact CG-CB 4.34Å; R707-L735 PolarHBondContact NH1-O 3.4Å; R707-L736 HydrophobicContact CG-CD2 3.7Å; R707-L736 VanDerWaalsContact NH1-CD2 3.28Å; R707-E740 IonicContact CZ-OE1 2.67Å; R707-E740 VanDerWaalsContact CZ-OE1 3.3Å; R707-E740 IonicContact NH1-OE1 2.65Å; R707-E740 PolarHBondContact NH1-OE1 3.25Å; R707-E740 IonicContact NH1-OE2 3.46Å; R707-E740 PolarHBondContact NH1-OE2 2.73Å; R707-E740 VanDerWaalsContact NH1-OE2 3.13Å; R707-E740 IonicContact NH2-OE1 3.7Å; R707-E740 PolarHBondContact NH2-OE1 3.11Å; R707-E740 IonicContact NH2-OE2 3.03Å
708	L	94.5	Very high	90.4	Very high	1 Å²	1	45.5 Å²	45.5	1%	0.005	23%	0.229	C	C	.	.	H	α-helix	trans	-66.8	-37.9	175.9	-177.7	57.2	0	0	0	111.9	V665 E666 V669 V686 F705 Q710 V711 T712	V665-L708 HydrophobicContact CB-CD2 3.9Å; V665-L708 HydrophobicContact CG1-CD1 4.45Å; V665-L708 HydrophobicContact CG1-CD2 3.58Å; E666-L708 HydrophobicContact CB-CD1 4.04Å; E666-L708 HydrophobicContact CG-CD1 4.37Å; V669-L708 HydrophobicContact CG2-CD1 4.49Å; V686-L708 HydrophobicContact CG1-CD2 3.85Å; V686-L708 HydrophobicContact CG1-CG 3.84Å; V686-L708 HydrophobicContact CG2-CD2 3.97Å; V686-L708 HydrophobicContact CG2-CG 4.11Å; F705-L708 HydrophobicContact CD1-CD2 3.99Å; F705-L708 HydrophobicContact CE1-CD2 4.2Å; F705-L708 PolarHBondContact O-N 3.28Å; L708-Q710 VanDerWaalsContact C-N 3.29Å; L708-Q710 PolarHBondContact O-N 3.48Å; L708-V711 WeakPolarHBondContact O-CA 3.48Å; L708-V711 WeakPolarHBondContact O-CB 3.5Å; L708-V711 PolarHBondContact O-N 3.15Å; L708-V711 VanDerWaalsContact O-N 3.1Å; L708-T712 PolarHBondContact O-N 3.16Å
709	N	92.4	Very high	90.4	Very high	52 Å²	52	46.1 Å²	46.1	28%	0.278	23%	0.229	S	C	.	.	H	α-helix	trans	-62.1	-37.3	173.5	-70.4	-29.1	0	0	0	111.6	F705 S706 V711 T712 C713	F705-N709 VanDerWaalsContact O-CG 3.3Å; F705-N709 PolarHBondContact O-N 3.31Å; F705-N709 PolarHBondContact O-ND2 3.28Å; S706-N709 PolarHBondContact O-N 3.19Å; N709-V711 VanDerWaalsContact C-N 3.32Å; N709-V711 PolarHBondContact O-N 2.67Å; N709-T712 WeakPolarHBondContact CA-OG1 3.29Å; N709-T712 PolarHBondContact O-N 3.47Å; N709-T712 PolarHBondContact O-OG1 2.65Å; N709-C713 WeakPolarHBondContact O-CB 3.04Å; N709-C713 PolarHBondContact O-N 3.29Å; N709-C713 PolarHBondContact O-SG 2.99Å
710	Q	91.9	Very high	90.4	Very high	14 Å²	14	37.8 Å²	37.8	7%	0.065	20%	0.198	C	C	.	.	H	α-helix	trans	-63.5	-38.2	173	-79.8	177.7	6.3	0	0	112.3	S706 R707 L708 L714 V733 W734 L736	S706-Q710 PolarHBondContact O-N 3.13Å; S706-Q710 VanDerWaalsContact O-N 3.13Å; R707-Q710 WeakPolarHBondContact O-CB 3.43Å; R707-Q710 PolarHBondContact O-N 3.1Å; L708-Q710 VanDerWaalsContact C-N 3.29Å; L708-Q710 PolarHBondContact O-N 3.48Å; Q710-L714 WeakPolarHBondContact O-CG 3.39Å; Q710-L714 PolarHBondContact O-N 2.82Å; Q710-L714 VanDerWaalsContact O-N 3.1Å; Q710-V733 PolarHBondContact NE2-O 2.85Å; Q710-W734 HydrophobicContact CB-CE3 4.28Å; Q710-W734 HydrophobicContact CB-CH2 3.8Å; Q710-W734 HydrophobicContact CB-CZ3 3.51Å; Q710-W734 HydrophobicContact CG-CE3 4.13Å; Q710-W734 HydrophobicContact CG-CH2 4.02Å; Q710-W734 HydrophobicContact CG-CZ3 3.77Å; Q710-L736 HydrophobicContact CB-CD1 4.42Å; Q710-L736 HydrophobicContact CB-CG 4.45Å
711	V	94.1	Very high	90.5	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-63.7	-46.9	173.2	175.1	0	0	0	0	110.7	V669 M670 R707 L708 N709 C713 L714 L715 L736 V744	V669-V711 HydrophobicContact CG1-CG1 3.79Å; M670-V711 HydrophobicContact SD-CG1 4.31Å; R707-V711 PolarHBondContact O-N 3.12Å; L708-V711 WeakPolarHBondContact O-CA 3.48Å; L708-V711 WeakPolarHBondContact O-CB 3.5Å; L708-V711 PolarHBondContact O-N 3.15Å; L708-V711 VanDerWaalsContact O-N 3.1Å; N709-V711 VanDerWaalsContact C-N 3.32Å; N709-V711 PolarHBondContact O-N 2.67Å; V711-C713 PolarHBondContact O-N 3.5Å; V711-L714 PolarHBondContact O-N 2.93Å; V711-L715 HydrophobicContact CG1-CD1 4.13Å; V711-L715 WeakPolarHBondContact O-CG 3.2Å; V711-L715 PolarHBondContact O-N 3.2Å; V711-L736 HydrophobicContact CG2-CD1 3.9Å; V711-L736 HydrophobicContact CG2-CD2 4.25Å; V711-V744 HydrophobicContact CG1-CG1 3.95Å; V711-V744 HydrophobicContact CG1-CG2 4.06Å; V711-V744 HydrophobicContact CG2-CG2 4.12Å
712	T	93.4	Very high	90.5	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-66.4	-36.1	179	63.2	0	0	0	0	112.6	L682 D683 V686 L708 N709 L715 N716	L682-T712 HydrophobicContact CD2-CG2 4.23Å; L682-T712 HydrophobicContact CG-CG2 4.11Å; D683-T712 WeakPolarHBondContact OD1-CB 3.14Å; D683-T712 PolarHBondContact OD1-OG1 3.46Å; V686-T712 HydrophobicContact CB-CG2 4.01Å; V686-T712 HydrophobicContact CG1-CG2 4.23Å; V686-T712 HydrophobicContact CG2-CG2 3.74Å; L708-T712 PolarHBondContact O-N 3.16Å; N709-T712 WeakPolarHBondContact CA-OG1 3.29Å; N709-T712 PolarHBondContact O-N 3.47Å; N709-T712 PolarHBondContact O-OG1 2.65Å; T712-L715 PolarHBondContact O-N 2.97Å; T712-N716 WeakPolarHBondContact O-CB 3.5Å; T712-N716 PolarHBondContact O-N 3.18Å; T712-N716 VanDerWaalsContact O-N 3.12Å
713	C	91.1	Very high	90.5	Very high	48 Å²	48	41.9 Å²	41.9	32%	0.324	21%	0.206	S	C	.	.	H	α-helix	trans	-59.7	-46.4	172.2	-73	0	0	0	0	111.9	N709 V711 L715 N716 V717 F726	N709-C713 WeakPolarHBondContact O-CB 3.04Å; N709-C713 PolarHBondContact O-N 3.29Å; N709-C713 PolarHBondContact O-SG 2.99Å; V711-C713 PolarHBondContact O-N 3.5Å; C713-L715 VanDerWaalsContact C-N 3.33Å; C713-L715 PolarHBondContact O-N 2.95Å; C713-N716 CarbonylContact O-C 3.54Å; C713-N716 WeakPolarHBondContact O-CA 3.21Å; C713-N716 PolarHBondContact O-N 3.23Å; C713-V717 PolarHBondContact O-N 3.25Å; C713-F726 HydrophobicContact CB-CE1 3.71Å; C713-F726 HydrophobicContact CB-CZ 4.05Å
714	L	91.6	Very high	90.2	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-65.9	-35	177	-73.3	171.1	0	0	0	112.8	Q710 V711 N716 V717 A723 W734 L736 V741 V744 L745	Q710-L714 WeakPolarHBondContact O-CG 3.39Å; Q710-L714 PolarHBondContact O-N 2.82Å; Q710-L714 VanDerWaalsContact O-N 3.1Å; V711-L714 PolarHBondContact O-N 2.93Å; L714-N716 PolarHBondContact O-N 3.28Å; L714-V717 VanDerWaalsContact O-CG2 3.23Å; L714-V717 WeakPolarHBondContact O-CG2 3.13Å; L714-A723 HydrophobicContact CD2-CB 4.23Å; L714-W734 HydrophobicContact CD1-CH2 3.65Å; L714-W734 HydrophobicContact CD1-CZ3 4Å; L714-W734 HydrophobicContact CD2-CH2 4.1Å; L714-W734 HydrophobicContact CD2-CZ2 4.41Å; L714-W734 HydrophobicContact CG-CH2 3.72Å; L714-W734 HydrophobicContact CG-CZ2 4.47Å; L714-L736 HydrophobicContact CD1-CD1 3.74Å; L714-V741 HydrophobicContact CD1-CB 4.25Å; L714-V741 HydrophobicContact CD1-CG1 3.91Å; L714-V741 HydrophobicContact CD1-CG2 4.11Å; L714-V741 HydrophobicContact CD2-CG1 4.08Å; L714-V744 HydrophobicContact CB-CB 4.43Å; L714-V744 HydrophobicContact CB-CG1 3.63Å; L714-V744 HydrophobicContact CD1-CB 4.21Å; L714-V744 HydrophobicContact CD1-CG1 4.19Å; L714-L745 HydrophobicContact CB-CD2 4.48Å; L714-L745 HydrophobicContact CD2-CD2 4.4Å
715	L	92.6	Very high	89.9	Confident	0 Å²	0	41 Å²	41	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-69.5	-11.1	172.6	-68.8	175	0	0	0	112.7	V669 Y674 L682 V711 T712 C713 V744 L747 R748	V669-L715 HydrophobicContact CG1-CD1 4.06Å; Y674-L715 HydrophobicContact CD2-CD1 3.99Å; Y674-L715 HydrophobicContact CD2-CD2 3.77Å; Y674-L715 HydrophobicContact CE2-CD1 3.91Å; Y674-L715 HydrophobicContact CE2-CD2 4.35Å; Y674-L715 HydrophobicContact CG-CD1 4.35Å; Y674-L715 HydrophobicContact CG-CD2 4.27Å; L682-L715 HydrophobicContact CD2-CD1 3.64Å; V711-L715 HydrophobicContact CG1-CD1 4.13Å; V711-L715 WeakPolarHBondContact O-CG 3.2Å; V711-L715 PolarHBondContact O-N 3.2Å; T712-L715 PolarHBondContact O-N 2.97Å; C713-L715 VanDerWaalsContact C-N 3.33Å; C713-L715 PolarHBondContact O-N 2.95Å; L715-V744 HydrophobicContact CD2-CG1 3.91Å; L715-V744 HydrophobicContact CG-CG1 3.84Å; L715-L747 HydrophobicContact CD2-CB 4.08Å; L715-R748 HydrophobicContact CD2-CG 4.06Å; L715-R748 WeakPolarHBondContact O-CD 3.09Å; L715-R748 PolarHBondContact O-NH1 3.16Å
716	N	92.5	Very high	89.3	Confident	16 Å²	16	44.3 Å²	44.3	9%	0.086	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110	15	-179.6	-86.6	-29.1	0	0	0	114.8	R676 G679 L680 D683 T712 C713 L714	R676-N716 VanDerWaalsContact NH1-C 3.34Å; R676-N716 VanDerWaalsContact NH1-CA 3.26Å; R676-N716 VanDerWaalsContact NH1-CB 3.3Å; R676-N716 PolarHBondContact NH1-O 3.12Å; R676-N716 PolarHBondContact NH1-OD1 3.25Å; R676-N716 PolarHBondContact NH2-O 3.03Å; G679-N716 PolarHBondContact O-ND2 3.08Å; G679-N716 PolarHBondContact O-OD1 2.62Å; L680-N716 WeakPolarHBondContact CA-OD1 3.39Å; L680-N716 PolarHBondContact N-OD1 3.22Å; D683-N716 WeakPolarHBondContact CB-ND2 3.37Å; D683-N716 PolarHBondContact OD2-ND2 3.23Å; T712-N716 WeakPolarHBondContact O-CB 3.5Å; T712-N716 PolarHBondContact O-N 3.18Å; T712-N716 VanDerWaalsContact O-N 3.12Å; C713-N716 CarbonylContact O-C 3.54Å; C713-N716 WeakPolarHBondContact O-CA 3.21Å; C713-N716 PolarHBondContact O-N 3.23Å; L714-N716 PolarHBondContact O-N 3.28Å
717	V	91.2	Very high	88.8	Confident	5 Å²	5	43.1 Å²	43.1	3%	0.03	21%	0.208	C	C	.	.			trans	-75.8	147.7	170.2	-57.7	0	0	0	0	111	C713 L714 E722 A723 L745 R748 L751	C713-V717 PolarHBondContact O-N 3.25Å; L714-V717 VanDerWaalsContact O-CG2 3.23Å; L714-V717 WeakPolarHBondContact O-CG2 3.13Å; V717-E722 HydrophobicContact CB-CB 4.48Å; V717-A723 HydrophobicContact CB-CB 4.4Å; V717-A723 HydrophobicContact CG1-CB 4.01Å; V717-A723 HydrophobicContact CG2-CB 4.17Å; V717-L745 HydrophobicContact CG2-CD2 3.87Å; V717-R748 PolarHBondContact O-NH1 3.35Å; V717-R748 PolarHBondContact O-NH2 3.49Å; V717-L751 HydrophobicContact CG2-CD1 4.05Å
718	D	86.5	Confident	88.3	Confident	105 Å²	105	45 Å²	45	56%	0.561	22%	0.22	S	C	*	.	S	Bend	trans	-85.1	-27.1	174.1	-66.7	-27.4	0	0	0	111.3	R676 E722	R676-D718 IonicContact CZ-OD1 3.41Å; R676-D718 IonicContact NE-OD1 2.69Å; R676-D718 PolarHBondContact NE-OD1 2.81Å; R676-D718 IonicContact NH2-OD1 2.84Å; R676-D718 PolarHBondContact NH2-OD1 2.84Å; R676-D718 IonicContact NH2-OD2 3.2Å; D718-E722 WeakPolarHBondContact CB-OE2 3.44Å; D718-E722 PolarHBondContact N-OE2 2.78Å
719	S	86.6	Confident	87.6	Confident	47 Å²	47	47 Å²	47	33%	0.329	23%	0.233	S	C	.	.	S	Bend	trans	-148	160	178.2	72.2	0	0	0	0	113.3	R721 E722 A723	S719-R721 PolarHBondContact O-N 3.46Å; S719-R721 PolarHBondContact OG-N 3.19Å; S719-E722 PolarHBondContact O-N 3.28Å; S719-E722 PolarHBondContact OG-N 3.22Å; S719-A723 PolarHBondContact O-N 2.84Å; S719-A723 VanDerWaalsContact O-N 3.15Å
720	V	84.7	Confident	86.6	Confident	7 Å²	7	52.7 Å²	52.7	4%	0.042	26%	0.264	C	S	.	.	H	α-helix	trans	-62.1	-24.6	174.1	-176.1	0	0	0	0	111.7	K724 L751 P752 E755 I756 I759	V720-K724 PolarHBondContact O-N 3.49Å; V720-L751 HydrophobicContact CG2-CB 4.44Å; V720-L751 HydrophobicContact CG2-CD2 4.28Å; V720-P752 HydrophobicContact CG2-CG 4.43Å; V720-E755 HydrophobicContact CB-CB 4.05Å; V720-E755 HydrophobicContact CG1-CB 4.06Å; V720-E755 HydrophobicContact CG2-CB 3.94Å; V720-I756 HydrophobicContact CG2-CG1 3.83Å; V720-I759 HydrophobicContact CG1-CB 4.14Å; V720-I759 HydrophobicContact CG1-CD1 3.76Å; V720-I759 HydrophobicContact CG1-CG1 4.16Å
721	R	86.2	Confident	85.7	Confident	174 Å²	174	57.8 Å²	57.8	66%	0.657	30%	0.296	S	S	*	.	H	α-helix	trans	-70.9	-44.8	175.2	-63.3	-177.8	-175.6	-177.9	0.7	111.9	S719 A723 K724 E725	S719-R721 PolarHBondContact O-N 3.46Å; S719-R721 PolarHBondContact OG-N 3.19Å; R721-A723 VanDerWaalsContact C-N 3.3Å; R721-A723 PolarHBondContact O-N 2.88Å; R721-K724 WeakPolarHBondContact O-CA 3.48Å; R721-K724 WeakPolarHBondContact O-CB 3.39Å; R721-K724 PolarHBondContact O-N 2.88Å; R721-K724 VanDerWaalsContact O-N 3.08Å; R721-E725 PolarHBondContact O-N 3.39Å
722	E	86.6	Confident	84.6	Confident	73 Å²	73	60.1 Å²	60.1	34%	0.341	31%	0.31	S	S	.	.	H	α-helix	trans	-61.6	-40.3	175	-174.3	-173.5	-177.1	0	0	111.1	V717 D718 S719 K724 E725 F726	V717-E722 HydrophobicContact CB-CB 4.48Å; D718-E722 WeakPolarHBondContact CB-OE2 3.44Å; D718-E722 PolarHBondContact N-OE2 2.78Å; S719-E722 PolarHBondContact O-N 3.28Å; S719-E722 PolarHBondContact OG-N 3.22Å; E722-K724 VanDerWaalsContact C-N 3.27Å; E722-K724 PolarHBondContact O-N 3.44Å; E722-E725 PolarHBondContact O-N 3.47Å; E722-F726 WeakPolarHBondContact O-CB 3.31Å; E722-F726 PolarHBondContact O-N 2.83Å
723	A	85.3	Confident	83.9	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-58.2	-40.7	173	0	0	0	0	0	112.2	L714 V717 S719 R721 C727 L745	L714-A723 HydrophobicContact CD2-CB 4.23Å; V717-A723 HydrophobicContact CB-CB 4.4Å; V717-A723 HydrophobicContact CG1-CB 4.01Å; V717-A723 HydrophobicContact CG2-CB 4.17Å; S719-A723 PolarHBondContact O-N 2.84Å; S719-A723 VanDerWaalsContact O-N 3.15Å; R721-A723 VanDerWaalsContact C-N 3.3Å; R721-A723 PolarHBondContact O-N 2.88Å; A723-C727 WeakPolarHBondContact O-CB 3.34Å; A723-C727 PolarHBondContact O-N 3.37Å; A723-C727 PolarHBondContact O-SG 2.96Å; A723-L745 HydrophobicContact CB-CD1 3.96Å; A723-L745 HydrophobicContact CB-CD2 3.8Å
724	K	84.8	Confident	83.5	Confident	70 Å²	70	66.4 Å²	66.4	30%	0.304	34%	0.341	S	S	.	.	H	α-helix	trans	-64.8	-46.8	175.8	-172.8	-176.8	174	-177.3	0	111.5	V720 R721 E722 F726 C727 Q728 I759 Q760	V720-K724 PolarHBondContact O-N 3.49Å; R721-K724 WeakPolarHBondContact O-CA 3.48Å; R721-K724 WeakPolarHBondContact O-CB 3.39Å; R721-K724 PolarHBondContact O-N 2.88Å; R721-K724 VanDerWaalsContact O-N 3.08Å; E722-K724 VanDerWaalsContact C-N 3.27Å; E722-K724 PolarHBondContact O-N 3.44Å; K724-F726 VanDerWaalsContact C-N 3.31Å; K724-F726 PolarHBondContact O-N 2.69Å; K724-C727 PolarHBondContact O-N 2.96Å; K724-Q728 HydrophobicContact CG-CG 4.39Å; K724-Q728 WeakPolarHBondContact O-CB 3.38Å; K724-Q728 VanDerWaalsContact O-CG 3.27Å; K724-Q728 WeakPolarHBondContact O-CG 3.38Å; K724-Q728 PolarHBondContact O-N 3.3Å; K724-I759 HydrophobicContact CB-CD1 4Å; K724-I759 HydrophobicContact CB-CG1 4.17Å; K724-I759 HydrophobicContact CG-CG1 4.43Å; K724-Q760 VanDerWaalsContact CE-O 3.31Å; K724-Q760 WeakPolarHBondContact CE-O 3.48Å
725	E	84.3	Confident	83.3	Confident	136 Å²	136	70.4 Å²	70.4	64%	0.636	36%	0.362	S	S	*	.	H	α-helix	trans	-60.3	-42.2	177.8	-70.9	173.6	-171.1	0	0	111.3	R721 E722 Q728 S729	R721-E725 PolarHBondContact O-N 3.39Å; E722-E725 PolarHBondContact O-N 3.47Å; E725-Q728 PolarHBondContact O-N 2.8Å; E725-S729 PolarHBondContact O-N 2.95Å; E725-S729 VanDerWaalsContact O-N 3.08Å
726	F	81.2	Confident	83	Confident	70 Å²	70	71.1 Å²	71.1	31%	0.307	37%	0.366	S	S	.	.	H	α-helix	trans	-67.5	-35.3	176.9	-168.1	-112.1	0	0	0	112.7	C713 E722 K724 W734	C713-F726 HydrophobicContact CB-CE1 3.71Å; C713-F726 HydrophobicContact CB-CZ 4.05Å; E722-F726 WeakPolarHBondContact O-CB 3.31Å; E722-F726 PolarHBondContact O-N 2.83Å; K724-F726 VanDerWaalsContact C-N 3.31Å; K724-F726 PolarHBondContact O-N 2.69Å; F726-W734 HydrophobicContact CD1-CH2 4.42Å; F726-W734 AromaticContact CD1-CZ2 3.57Å; F726-W734 HydrophobicContact CD1-CZ2 3.57Å; F726-W734 HydrophobicContact CE1-CH2 4.26Å; F726-W734 AromaticContact CE1-CZ2 3.59Å; F726-W734 HydrophobicContact CE1-CZ2 3.59Å; F726-W734 PolarHBondContact O-NE1 2.72Å
727	C	81.7	Confident	82.9	Confident	24 Å²	24	72.3 Å²	72.3	16%	0.162	38%	0.375	C	S	.	.	H	α-helix	trans	-72	-28.2	173.2	-71.9	0	0	0	0	114.1	A723 K724 L761	A723-C727 WeakPolarHBondContact O-CB 3.34Å; A723-C727 PolarHBondContact O-N 3.37Å; A723-C727 PolarHBondContact O-SG 2.96Å; K724-C727 PolarHBondContact O-N 2.96Å; C727-L761 HydrophobicContact CB-CD2 3.5Å; C727-L761 VanDerWaalsContact CB-CD2 3.5Å
728	Q	82.2	Confident	82.6	Confident	104 Å²	104	75.2 Å²	75.2	49%	0.486	39%	0.394	S	S	.	.	H	α-helix	trans	-90	-5.4	179.3	-69.9	-176	-23.1	0	0	113.5	K724 E725 D730	K724-Q728 HydrophobicContact CG-CG 4.39Å; K724-Q728 WeakPolarHBondContact O-CB 3.38Å; K724-Q728 VanDerWaalsContact O-CG 3.27Å; K724-Q728 WeakPolarHBondContact O-CG 3.38Å; K724-Q728 PolarHBondContact O-N 3.3Å; E725-Q728 PolarHBondContact O-N 2.8Å; Q728-D730 PolarHBondContact O-N 2.91Å
729	S	78.7	Confident	82.7	Confident	42 Å²	42	73.9 Å²	73.9	29%	0.294	39%	0.393	S	S	.	.			trans	-68.4	122.4	178.3	-174.8	0	0	0	0	111.3	E725 T731	E725-S729 PolarHBondContact O-N 2.95Å; E725-S729 VanDerWaalsContact O-N 3.08Å; S729-T731 PolarHBondContact O-N 3.38Å; S729-T731 PolarHBondContact OG-OG1 3.27Å
730	D	71.9	Confident	82.9	Confident	172 Å²	172	74 Å²	74	92%	0.92	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-8	176.3	-71.1	-35.7	0	0	0	113.7	Q728	Q728-D730 PolarHBondContact O-N 2.91Å
731	T	73.1	Confident	83.1	Confident	120 Å²	120	73.8 Å²	73.8	74%	0.736	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-15.8	-174.6	58.4	0	0	0	0	114.7	S729	S729-T731 PolarHBondContact O-N 3.38Å; S729-T731 PolarHBondContact OG-OG1 3.27Å
732	V	70.9	Confident	83.3	Confident	50 Å²	50	69.7 Å²	69.7	30%	0.303	37%	0.372	S	S	.	.	S	Bend	trans	-125.7	123.7	-172.9	-177.2	0	0	0	0	110.6	W734	V732-W734 PolarHBondContact O-N 3.37Å; V732-W734 VanDerWaalsContact O-N 3.09Å
733	V	79.2	Confident	83.5	Confident	126 Å²	126	71 Å²	71	76%	0.764	38%	0.378	S	S	*	.			trans	-71.5	104.2	170.4	-178.4	0	0	0	0	108.8	Q710 L735	Q710-V733 PolarHBondContact NE2-O 2.85Å; V733-L735 PolarHBondContact O-N 3.45Å
734	W	81.6	Confident	83.9	Confident	53 Å²	53	71 Å²	71	20%	0.201	38%	0.378	C	S	.	.			trans	-72	123.3	-179.6	-96.2	102.9	0	0	0	112.3	Q710 L714 F726 V732 L736 V741	Q710-W734 HydrophobicContact CB-CE3 4.28Å; Q710-W734 HydrophobicContact CB-CH2 3.8Å; Q710-W734 HydrophobicContact CB-CZ3 3.51Å; Q710-W734 HydrophobicContact CG-CE3 4.13Å; Q710-W734 HydrophobicContact CG-CH2 4.02Å; Q710-W734 HydrophobicContact CG-CZ3 3.77Å; L714-W734 HydrophobicContact CD1-CH2 3.65Å; L714-W734 HydrophobicContact CD1-CZ3 4Å; L714-W734 HydrophobicContact CD2-CH2 4.1Å; L714-W734 HydrophobicContact CD2-CZ2 4.41Å; L714-W734 HydrophobicContact CG-CH2 3.72Å; L714-W734 HydrophobicContact CG-CZ2 4.47Å; F726-W734 HydrophobicContact CD1-CH2 4.42Å; F726-W734 AromaticContact CD1-CZ2 3.57Å; F726-W734 HydrophobicContact CD1-CZ2 3.57Å; F726-W734 HydrophobicContact CE1-CH2 4.26Å; F726-W734 AromaticContact CE1-CZ2 3.59Å; F726-W734 HydrophobicContact CE1-CZ2 3.59Å; F726-W734 PolarHBondContact O-NE1 2.72Å; V732-W734 PolarHBondContact O-N 3.37Å; V732-W734 VanDerWaalsContact O-N 3.09Å; W734-L736 HydrophobicContact CE3-CB 3.86Å; W734-L736 HydrophobicContact CE3-CG 4.12Å; W734-L736 HydrophobicContact CZ3-CB 3.84Å; W734-L736 HydrophobicContact CZ3-CD1 3.66Å; W734-L736 HydrophobicContact CZ3-CG 3.71Å; W734-V741 HydrophobicContact CZ3-CG2 4.47Å
735	L	86.9	Confident	84.3	Confident	85 Å²	85	67.7 Å²	67.7	45%	0.445	36%	0.364	S	S	.	.			trans	-99	-12.4	179.7	-59	172.9	0	0	0	112.6	R707 V733	R707-L735 HydrophobicContact CB-CB 4.39Å; R707-L735 HydrophobicContact CB-CD1 3.98Å; R707-L735 HydrophobicContact CG-CB 4.34Å; R707-L735 PolarHBondContact NH1-O 3.4Å; V733-L735 PolarHBondContact O-N 3.45Å
736	L	87.7	Confident	84.6	Confident	14 Å²	14	64.4 Å²	64.4	7%	0.073	36%	0.359	C	S	.	.	S	Bend	trans	-92.1	136.2	175.8	-58.1	-172.7	0	0	0	110.6	R707 Q710 V711 L714 W734 E740 V741 V744	R707-L736 HydrophobicContact CG-CD2 3.7Å; R707-L736 VanDerWaalsContact NH1-CD2 3.28Å; Q710-L736 HydrophobicContact CB-CD1 4.42Å; Q710-L736 HydrophobicContact CB-CG 4.45Å; V711-L736 HydrophobicContact CG2-CD1 3.9Å; V711-L736 HydrophobicContact CG2-CD2 4.25Å; L714-L736 HydrophobicContact CD1-CD1 3.74Å; W734-L736 HydrophobicContact CE3-CB 3.86Å; W734-L736 HydrophobicContact CE3-CG 4.12Å; W734-L736 HydrophobicContact CZ3-CB 3.84Å; W734-L736 HydrophobicContact CZ3-CD1 3.66Å; W734-L736 HydrophobicContact CZ3-CG 3.71Å; L736-E740 HydrophobicContact CB-CB 4.17Å; L736-E740 HydrophobicContact CD2-CB 4.45Å; L736-V741 HydrophobicContact CB-CG2 3.92Å; L736-V744 HydrophobicContact CD1-CG2 4.26Å
737	S	88.7	Confident	85.2	Confident	41 Å²	41	62 Å²	62	29%	0.287	35%	0.35	S	S	.	.			trans	-70.3	156.8	169.5	62	0	0	0	0	111.7	S739 E740 V741	S737-S739 PolarHBondContact O-N 3.09Å; S737-S739 VanDerWaalsContact O-N 3.08Å; S737-S739 PolarHBondContact OG-OG 3.05Å; S737-E740 WeakPolarHBondContact CB-OE2 3.4Å; S737-E740 PolarHBondContact N-OE2 3.47Å; S737-E740 WeakPolarHBondContact O-CB 3.36Å; S737-E740 PolarHBondContact O-N 2.94Å; S737-E740 VanDerWaalsContact OG-CD 3.26Å; S737-E740 WeakPolarHBondContact OG-CG 3.42Å; S737-E740 PolarHBondContact OG-N 3.3Å; S737-E740 PolarHBondContact OG-OE2 2.96Å; S737-V741 WeakPolarHBondContact O-CG2 3.41Å; S737-V741 PolarHBondContact O-N 3.04Å
738	P	85.5	Confident	85.8	Confident	66 Å²	66	61.2 Å²	61.2	43%	0.429	34%	0.344	S	S	.	.	H	α-helix	trans	-56.3	-27.7	176	-28.7	36.2	0	0	0	114.4	R742 L761	P738-R742 WeakPolarHBondContact O-CG 3.45Å; P738-R742 PolarHBondContact O-N 3.19Å; P738-R742 PolarHBondContact O-NH1 2.82Å; P738-R742 VanDerWaalsContact O-NH1 3.09Å; P738-L761 HydrophobicContact CB-CB 4.22Å; P738-L761 HydrophobicContact CB-CD1 4.2Å
739	S	88	Confident	86.1	Confident	78 Å²	78	61.5 Å²	61.5	55%	0.545	35%	0.347	S	S	.	.	H	α-helix	trans	-69.2	-43.2	172	36.6	0	0	0	0	112.4	S737 R742 Q743	S737-S739 PolarHBondContact O-N 3.09Å; S737-S739 VanDerWaalsContact O-N 3.08Å; S737-S739 PolarHBondContact OG-OG 3.05Å; S739-R742 PolarHBondContact O-N 3.02Å; S739-Q743 PolarHBondContact O-N 3.5Å
740	E	90.9	Very high	86.6	Confident	48 Å²	48	63.2 Å²	63.2	22%	0.224	35%	0.353	C	S	.	.	H	α-helix	trans	-68.3	-39.2	178.7	-70.7	167.1	134.4	0	0	111.2	R707 L736 S737 R742 Q743 V744	R707-E740 IonicContact CZ-OE1 2.67Å; R707-E740 VanDerWaalsContact CZ-OE1 3.3Å; R707-E740 IonicContact NH1-OE1 2.65Å; R707-E740 PolarHBondContact NH1-OE1 3.25Å; R707-E740 IonicContact NH1-OE2 3.46Å; R707-E740 PolarHBondContact NH1-OE2 2.73Å; R707-E740 VanDerWaalsContact NH1-OE2 3.13Å; R707-E740 IonicContact NH2-OE1 3.7Å; R707-E740 PolarHBondContact NH2-OE1 3.11Å; R707-E740 IonicContact NH2-OE2 3.03Å; L736-E740 HydrophobicContact CB-CB 4.17Å; L736-E740 HydrophobicContact CD2-CB 4.45Å; S737-E740 WeakPolarHBondContact CB-OE2 3.4Å; S737-E740 PolarHBondContact N-OE2 3.47Å; S737-E740 WeakPolarHBondContact O-CB 3.36Å; S737-E740 PolarHBondContact O-N 2.94Å; S737-E740 VanDerWaalsContact OG-CD 3.26Å; S737-E740 WeakPolarHBondContact OG-CG 3.42Å; S737-E740 PolarHBondContact OG-N 3.3Å; S737-E740 PolarHBondContact OG-OE2 2.96Å; E740-R742 VanDerWaalsContact C-N 3.35Å; E740-R742 PolarHBondContact O-N 3.23Å; E740-Q743 WeakPolarHBondContact O-CA 3.34Å; E740-Q743 WeakPolarHBondContact O-CB 3.2Å; E740-Q743 PolarHBondContact O-N 2.88Å; E740-Q743 VanDerWaalsContact O-N 3.1Å; E740-V744 WeakPolarHBondContact O-CG2 3.49Å; E740-V744 PolarHBondContact O-N 3.15Å
741	V	89.8	Confident	87.4	Confident	4 Å²	4	55.7 Å²	55.7	2%	0.024	31%	0.313	C	S	.	.	H	α-helix	trans	-58.2	-47.2	174.6	176.2	0	0	0	0	111	L714 W734 L736 S737 Q743 V744 L745 L761	L714-V741 HydrophobicContact CD1-CB 4.25Å; L714-V741 HydrophobicContact CD1-CG1 3.91Å; L714-V741 HydrophobicContact CD1-CG2 4.11Å; L714-V741 HydrophobicContact CD2-CG1 4.08Å; W734-V741 HydrophobicContact CZ3-CG2 4.47Å; L736-V741 HydrophobicContact CB-CG2 3.92Å; S737-V741 WeakPolarHBondContact O-CG2 3.41Å; S737-V741 PolarHBondContact O-N 3.04Å; V741-Q743 VanDerWaalsContact C-N 3.29Å; V741-Q743 PolarHBondContact O-N 3.44Å; V741-V744 PolarHBondContact O-N 3.06Å; V741-L745 HydrophobicContact CG1-CD1 4.16Å; V741-L745 WeakPolarHBondContact O-CG 3.5Å; V741-L745 PolarHBondContact O-N 3.25Å; V741-L761 HydrophobicContact CB-CD1 3.59Å; V741-L761 HydrophobicContact CG1-CD1 3.47Å; V741-L761 VanDerWaalsContact CG1-CD1 3.47Å; V741-L761 HydrophobicContact CG1-CD2 4.25Å; V741-L761 HydrophobicContact CG2-CD1 4.25Å
742	R	90.1	Very high	88	Confident	88 Å²	88	53.3 Å²	53.3	33%	0.332	30%	0.299	S	S	.	.	H	α-helix	trans	-62.5	-37.5	175.7	-69.9	-177.6	-164.9	98.7	-1.9	112.1	P738 S739 E740 A746 I756 I759	P738-R742 WeakPolarHBondContact O-CG 3.45Å; P738-R742 PolarHBondContact O-N 3.19Å; P738-R742 PolarHBondContact O-NH1 2.82Å; P738-R742 VanDerWaalsContact O-NH1 3.09Å; S739-R742 PolarHBondContact O-N 3.02Å; E740-R742 VanDerWaalsContact C-N 3.35Å; E740-R742 PolarHBondContact O-N 3.23Å; R742-A746 VanDerWaalsContact O-CB 3.28Å; R742-A746 WeakPolarHBondContact O-CB 3.04Å; R742-A746 PolarHBondContact O-N 2.89Å; R742-I756 HydrophobicContact CB-CG2 4.26Å; R742-I756 HydrophobicContact CG-CG2 4.44Å; R742-I759 HydrophobicContact CG-CG2 3.95Å; R742-I759 PolarHBondContact NH2-O 2.95Å
743	Q	92	Very high	88.6	Confident	101 Å²	101	52.9 Å²	52.9	47%	0.472	31%	0.305	S	S	.	.	H	α-helix	trans	-63.4	-46.6	176.5	-173.8	-179.9	-0.3	0	0	111.2	M670 S739 E740 V741 A746 L747	M670-Q743 HydrophobicContact CE-CB 4.24Å; M670-Q743 HydrophobicContact CE-CG 3.72Å; S739-Q743 PolarHBondContact O-N 3.5Å; E740-Q743 WeakPolarHBondContact O-CA 3.34Å; E740-Q743 WeakPolarHBondContact O-CB 3.2Å; E740-Q743 PolarHBondContact O-N 2.88Å; E740-Q743 VanDerWaalsContact O-N 3.1Å; V741-Q743 VanDerWaalsContact C-N 3.29Å; V741-Q743 PolarHBondContact O-N 3.44Å; Q743-A746 PolarHBondContact O-N 2.98Å; Q743-L747 WeakPolarHBondContact O-CG 3.26Å; Q743-L747 PolarHBondContact O-N 2.63Å
744	V	93	Very high	88.9	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-62.5	-46.9	178.1	176.3	0	0	0	0	111.1	M670 V711 L714 L715 L736 E740 V741 A746 L747	M670-V744 HydrophobicContact CE-CG2 3.97Å; M670-V744 HydrophobicContact SD-CG2 3.66Å; V711-V744 HydrophobicContact CG1-CG1 3.95Å; V711-V744 HydrophobicContact CG1-CG2 4.06Å; V711-V744 HydrophobicContact CG2-CG2 4.12Å; L714-V744 HydrophobicContact CB-CB 4.43Å; L714-V744 HydrophobicContact CB-CG1 3.63Å; L714-V744 HydrophobicContact CD1-CB 4.21Å; L714-V744 HydrophobicContact CD1-CG1 4.19Å; L715-V744 HydrophobicContact CD2-CG1 3.91Å; L715-V744 HydrophobicContact CG-CG1 3.84Å; L736-V744 HydrophobicContact CD1-CG2 4.26Å; E740-V744 WeakPolarHBondContact O-CG2 3.49Å; E740-V744 PolarHBondContact O-N 3.15Å; V741-V744 PolarHBondContact O-N 3.06Å; V744-A746 PolarHBondContact O-N 3.33Å; V744-L747 VanDerWaalsContact O-CB 3.31Å; V744-L747 WeakPolarHBondContact O-CB 3.47Å; V744-L747 PolarHBondContact O-N 2.69Å
745	L	92.1	Very high	89.1	Confident	0 Å²	0	54 Å²	54	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-61.4	-35	176.8	-68.4	174.6	0	0	0	112	L714 V717 A723 V741 L747 R748 L751 I756 I759	L714-L745 HydrophobicContact CB-CD2 4.48Å; L714-L745 HydrophobicContact CD2-CD2 4.4Å; V717-L745 HydrophobicContact CG2-CD2 3.87Å; A723-L745 HydrophobicContact CB-CD1 3.96Å; A723-L745 HydrophobicContact CB-CD2 3.8Å; V741-L745 HydrophobicContact CG1-CD1 4.16Å; V741-L745 WeakPolarHBondContact O-CG 3.5Å; V741-L745 PolarHBondContact O-N 3.25Å; L745-L747 PolarHBondContact O-N 3.5Å; L745-R748 WeakPolarHBondContact O-CB 3.28Å; L745-R748 PolarHBondContact O-N 3.47Å; L745-R748 VanDerWaalsContact O-N 3.12Å; L745-L751 HydrophobicContact CB-CD1 4.39Å; L745-L751 HydrophobicContact CD2-CD1 3.83Å; L745-I756 HydrophobicContact CB-CD1 4Å; L745-I756 HydrophobicContact CB-CG1 4.17Å; L745-I756 HydrophobicContact CB-CG2 3.97Å; L745-I756 WeakPolarHBondContact O-CD1 3.36Å; L745-I759 HydrophobicContact CD1-CD1 4.14Å
746	A	92.3	Very high	89	Confident	66 Å²	66	50.5 Å²	50.5	55%	0.545	29%	0.289	S	S	.	.	H	α-helix	trans	-69.8	-13.4	177.2	0	0	0	0	0	113.6	R742 Q743 V744 R748	R742-A746 VanDerWaalsContact O-CB 3.28Å; R742-A746 WeakPolarHBondContact O-CB 3.04Å; R742-A746 PolarHBondContact O-N 2.89Å; Q743-A746 PolarHBondContact O-N 2.98Å; V744-A746 PolarHBondContact O-N 3.33Å; A746-R748 VanDerWaalsContact C-N 3.26Å
747	L	93.4	Very high	88.7	Confident	21 Å²	21	59.8 Å²	59.8	11%	0.11	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-18.6	171.4	-51	177.9	0	0	0	111.8	M670 G672 T673 Y674 L715 Q743 V744 L745	M670-L747 HydrophobicContact SD-CD1 4.21Å; G672-L747 WeakPolarHBondContact O-CD2 3.4Å; T673-L747 CarbonylContact C-O 3.54Å; T673-L747 WeakPolarHBondContact CA-O 3.37Å; Y674-L747 HydrophobicContact CD2-CB 3.87Å; Y674-L747 HydrophobicContact CE2-CB 4.24Å; Y674-L747 HydrophobicContact CE2-CD1 4.19Å; Y674-L747 PolarHBondContact N-O 3.13Å; L715-L747 HydrophobicContact CD2-CB 4.08Å; Q743-L747 WeakPolarHBondContact O-CG 3.26Å; Q743-L747 PolarHBondContact O-N 2.63Å; V744-L747 VanDerWaalsContact O-CB 3.31Å; V744-L747 WeakPolarHBondContact O-CB 3.47Å; V744-L747 PolarHBondContact O-N 2.69Å; L745-L747 PolarHBondContact O-N 3.5Å
748	R	93	Very high	88.5	Confident	7 Å²	7	65.8 Å²	65.8	3%	0.026	35%	0.345	C	S	.	.	B	Isolated β-bridge	trans	-82.3	114.2	175.5	-79	-79.5	-63.6	-90	-9.5	110.7	Y674 L715 V717 L745 A746 D750 L751	Y674-R748 CarbonylContact O-C 3.58Å; Y674-R748 VanDerWaalsContact O-CA 3.24Å; Y674-R748 WeakPolarHBondContact O-CA 3.21Å; L715-R748 HydrophobicContact CD2-CG 4.06Å; L715-R748 WeakPolarHBondContact O-CD 3.09Å; L715-R748 PolarHBondContact O-NH1 3.16Å; V717-R748 PolarHBondContact O-NH1 3.35Å; V717-R748 PolarHBondContact O-NH2 3.49Å; L745-R748 WeakPolarHBondContact O-CB 3.28Å; L745-R748 PolarHBondContact O-N 3.47Å; L745-R748 VanDerWaalsContact O-N 3.12Å; A746-R748 VanDerWaalsContact C-N 3.26Å; R748-D750 VanDerWaalsContact C-N 3.27Å; R748-D750 IonicContact CZ-OD1 2.72Å; R748-D750 IonicContact CZ-OD2 3.39Å; R748-D750 IonicContact NE-OD1 2.63Å; R748-D750 PolarHBondContact NE-OD1 3.19Å; R748-D750 IonicContact NE-OD2 3.47Å; R748-D750 PolarHBondContact NE-OD2 2.77Å; R748-D750 IonicContact NH2-OD1 3.44Å; R748-D750 PolarHBondContact NH2-OD1 3.03Å; R748-D750 IonicContact NH2-OD2 3.51Å; R748-D750 PolarHBondContact NH2-OD2 3.28Å; R748-D750 PolarHBondContact O-N 3.37Å; R748-L751 HydrophobicContact CB-CB 4.13Å; R748-L751 HydrophobicContact CB-CD1 3.71Å; R748-L751 HydrophobicContact CB-CG 3.74Å; R748-L751 HydrophobicContact CG-CD1 4.1Å; R748-L751 HydrophobicContact CG-CG 4.42Å; R748-L751 PolarHBondContact O-N 2.82Å
749	I	89.9	Confident	88.2	Confident	109 Å²	109	63.2 Å²	63.2	56%	0.559	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-22.3	-176.1	63.2	177.7	0	0	0	113.6	Y674 N675	Y674-I749 WeakPolarHBondContact O-CG1 3.24Å; Y674-I749 PolarHBondContact O-N 3.45Å; N675-I749 HydrophobicContact CB-CD1 4.35Å; N675-I749 HydrophobicContact CB-CG1 4.31Å
750	D	87.9	Confident	87.6	Confident	79 Å²	79	66.7 Å²	66.7	42%	0.422	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-12.7	-178	56.5	-33.6	0	0	0	113.3	R748	R748-D750 VanDerWaalsContact C-N 3.27Å; R748-D750 IonicContact CZ-OD1 2.72Å; R748-D750 IonicContact CZ-OD2 3.39Å; R748-D750 IonicContact NE-OD1 2.63Å; R748-D750 PolarHBondContact NE-OD1 3.19Å; R748-D750 IonicContact NE-OD2 3.47Å; R748-D750 PolarHBondContact NE-OD2 2.77Å; R748-D750 IonicContact NH2-OD1 3.44Å; R748-D750 PolarHBondContact NH2-OD1 3.03Å; R748-D750 IonicContact NH2-OD2 3.51Å; R748-D750 PolarHBondContact NH2-OD2 3.28Å; R748-D750 PolarHBondContact O-N 3.37Å
751	L	88.7	Confident	86.8	Confident	14 Å²	14	68 Å²	68	7%	0.073	34%	0.343	C	S	.	.	S	Bend	trans	-81.6	135.4	175.2	-70.2	-178.2	0	0	0	111.4	V717 V720 L745 R748 G753 I756	V717-L751 HydrophobicContact CG2-CD1 4.05Å; V720-L751 HydrophobicContact CG2-CB 4.44Å; V720-L751 HydrophobicContact CG2-CD2 4.28Å; L745-L751 HydrophobicContact CB-CD1 4.39Å; L745-L751 HydrophobicContact CD2-CD1 3.83Å; R748-L751 HydrophobicContact CB-CB 4.13Å; R748-L751 HydrophobicContact CB-CD1 3.71Å; R748-L751 HydrophobicContact CB-CG 3.74Å; R748-L751 HydrophobicContact CG-CD1 4.1Å; R748-L751 HydrophobicContact CG-CG 4.42Å; R748-L751 PolarHBondContact O-N 2.82Å; L751-G753 PolarHBondContact O-N 3.3Å; L751-I756 HydrophobicContact CB-CD1 3.93Å
752	P	85.4	Confident	86.7	Confident	69 Å²	69	71.2 Å²	71.2	45%	0.448	36%	0.359	S	S	.	.			trans	-68.4	108.7	-179	24.6	-31.8	0	0	0	111.5	V720 N754 E755 I756	V720-P752 HydrophobicContact CG2-CG 4.43Å; P752-N754 PolarHBondContact O-N 2.83Å; P752-E755 HydrophobicContact CB-CG 4.29Å; P752-E755 HydrophobicContact CG-CB 4.06Å; P752-E755 HydrophobicContact CG-CG 3.89Å; P752-E755 PolarHBondContact O-N 3.34Å; P752-I756 PolarHBondContact O-N 3.27Å
753	G	83.5	Confident	86.5	Confident	41 Å²	41	70.3 Å²	70.3	42%	0.423	36%	0.36	S	S	.	.	H	α-helix	trans	-55.5	-25.5	-178.8	0	0	0	0	0	115.3	L751 R757	L751-G753 PolarHBondContact O-N 3.3Å; G753-R757 WeakPolarHBondContact O-CG 3.48Å; G753-R757 PolarHBondContact O-N 3.24Å
754	N	85.6	Confident	86.2	Confident	120 Å²	120	68.6 Å²	68.6	64%	0.642	35%	0.354	S	S	*	.	H	α-helix	trans	-68.3	-35.9	174.2	-68.8	-24.5	0	0	0	112.8	P752 K758	P752-N754 PolarHBondContact O-N 2.83Å; N754-K758 WeakPolarHBondContact O-CG 3.5Å; N754-K758 PolarHBondContact O-N 3.46Å
755	E	85.9	Confident	85.8	Confident	84 Å²	84	72.6 Å²	72.6	39%	0.393	38%	0.375	S	S	.	.	H	α-helix	trans	-75.1	-38.8	176.3	-66.2	-125.6	139.9	0	0	110.7	V720 P752 R757 K758 I759	V720-E755 HydrophobicContact CB-CB 4.05Å; V720-E755 HydrophobicContact CG1-CB 4.06Å; V720-E755 HydrophobicContact CG2-CB 3.94Å; P752-E755 HydrophobicContact CB-CG 4.29Å; P752-E755 HydrophobicContact CG-CB 4.06Å; P752-E755 HydrophobicContact CG-CG 3.89Å; P752-E755 PolarHBondContact O-N 3.34Å; E755-R757 VanDerWaalsContact C-N 3.28Å; E755-R757 PolarHBondContact O-N 3.44Å; E755-K758 CarbonylContact O-C 3.51Å; E755-K758 PolarHBondContact O-N 3.29Å; E755-I759 PolarHBondContact O-N 3.16Å
756	I	85	Confident	85.4	Confident	10 Å²	10	77.2 Å²	77.2	5%	0.051	40%	0.398	C	S	.	.	H	α-helix	trans	-59	-39.3	176.6	-57.7	172.9	0	0	0	111.2	V720 R742 L745 L751 P752 K758 I759	V720-I756 HydrophobicContact CG2-CG1 3.83Å; R742-I756 HydrophobicContact CB-CG2 4.26Å; R742-I756 HydrophobicContact CG-CG2 4.44Å; L745-I756 HydrophobicContact CB-CD1 4Å; L745-I756 HydrophobicContact CB-CG1 4.17Å; L745-I756 HydrophobicContact CB-CG2 3.97Å; L745-I756 WeakPolarHBondContact O-CD1 3.36Å; L751-I756 HydrophobicContact CB-CD1 3.93Å; P752-I756 PolarHBondContact O-N 3.27Å; I756-K758 VanDerWaalsContact C-N 3.32Å; I756-K758 PolarHBondContact O-N 2.86Å; I756-I759 WeakPolarHBondContact O-CG2 3.22Å
757	R	82.6	Confident	84.9	Confident	209 Å²	209	77.9 Å²	77.9	79%	0.789	39%	0.388	S	S	*	.	H	α-helix	trans	-69.9	-28	176.1	-70.7	178	-174.2	178	2.6	113.3	G753 E755	G753-R757 WeakPolarHBondContact O-CG 3.48Å; G753-R757 PolarHBondContact O-N 3.24Å; E755-R757 VanDerWaalsContact C-N 3.28Å; E755-R757 PolarHBondContact O-N 3.44Å
758	K	82.9	Confident	84.3	Confident	168 Å²	168	82 Å²	82	73%	0.73	41%	0.408	S	S	*	.	H	α-helix	trans	-91.4	-8.5	-178.3	-70.6	178.1	-178.2	-178.7	0	113.5	N754 E755 I756 Q760	N754-K758 WeakPolarHBondContact O-CG 3.5Å; N754-K758 PolarHBondContact O-N 3.46Å; E755-K758 CarbonylContact O-C 3.51Å; E755-K758 PolarHBondContact O-N 3.29Å; I756-K758 VanDerWaalsContact C-N 3.32Å; I756-K758 PolarHBondContact O-N 2.86Å; K758-Q760 PolarHBondContact O-N 3.22Å
759	I	79.7	Confident	83.7	Confident	12 Å²	12	87.8 Å²	87.8	6%	0.062	44%	0.438	C	S	.	.			trans	-61.4	120.2	179.7	-158.9	177.9	0	0	0	110.3	V720 K724 R742 L745 E755 I756 L761	V720-I759 HydrophobicContact CG1-CB 4.14Å; V720-I759 HydrophobicContact CG1-CD1 3.76Å; V720-I759 HydrophobicContact CG1-CG1 4.16Å; K724-I759 HydrophobicContact CB-CD1 4Å; K724-I759 HydrophobicContact CB-CG1 4.17Å; K724-I759 HydrophobicContact CG-CG1 4.43Å; R742-I759 HydrophobicContact CG-CG2 3.95Å; R742-I759 PolarHBondContact NH2-O 2.95Å; L745-I759 HydrophobicContact CD1-CD1 4.14Å; E755-I759 PolarHBondContact O-N 3.16Å; I756-I759 WeakPolarHBondContact O-CG2 3.22Å; I759-L761 HydrophobicContact CD1-CD2 3.81Å; I759-L761 HydrophobicContact CD1-CG 4.22Å; I759-L761 HydrophobicContact CG1-CD2 4.18Å; I759-L761 HydrophobicContact CG1-CG 4.22Å; I759-L761 HydrophobicContact CG2-CD1 4.24Å; I759-L761 HydrophobicContact CG2-CG 4.18Å
760	Q	75.1	Confident	83.1	Confident	150 Å²	150	86 Å²	86	70%	0.701	43%	0.428	S	S	*	.			trans	-92.3	107.7	169.2	-70	179	-10.2	0	0	107	K724 K758	K724-Q760 VanDerWaalsContact CE-O 3.31Å; K724-Q760 WeakPolarHBondContact CE-O 3.48Å; K758-Q760 PolarHBondContact O-N 3.22Å
761	L	75.4	Confident	82.7	Confident	76 Å²	76	86.6 Å²	86.6	40%	0.398	43%	0.428	S	S	.	.			trans	-98.5	0	176.4	-67.4	167.3	0	0	0	109.2	C727 P738 V741 I759	C727-L761 HydrophobicContact CB-CD2 3.5Å; C727-L761 VanDerWaalsContact CB-CD2 3.5Å; P738-L761 HydrophobicContact CB-CB 4.22Å; P738-L761 HydrophobicContact CB-CD1 4.2Å; V741-L761 HydrophobicContact CB-CD1 3.59Å; V741-L761 HydrophobicContact CG1-CD1 3.47Å; V741-L761 VanDerWaalsContact CG1-CD1 3.47Å; V741-L761 HydrophobicContact CG1-CD2 4.25Å; V741-L761 HydrophobicContact CG2-CD1 4.25Å; I759-L761 HydrophobicContact CD1-CD2 3.81Å; I759-L761 HydrophobicContact CD1-CG 4.22Å; I759-L761 HydrophobicContact CG1-CD2 4.18Å; I759-L761 HydrophobicContact CG1-CG 4.22Å; I759-L761 HydrophobicContact CG2-CD1 4.24Å; I759-L761 HydrophobicContact CG2-CG 4.18Å

Retrieved 761 of 761 residues in 380.1 ms (Link to these results)

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