A0A087XHX1_POEFO Loading...

Two pore channel protein 2

AlphaFold DB , UniProt , Accession A0A087XHX1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 696 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	29.6	Very low	34.4	Very low	205 Å²	205	117.2 Å²	117.2	100%	1.01	59%	0.591	S	S	*	*				0	-53.2	0	-82.4	-165	-89.6	0	0	111.8	Q3 C4 Y5	M1-Q3 PolarHBondContact O-N 3.48Å; M1-C4 PolarHBondContact O-N 2.94Å; M1-Y5 PolarHBondContact O-N 3.42Å; M1-Y5 VanDerWaalsContact O-N 3.08Å
2	A	29.2	Very low	35.2	Very low	58 Å²	58	118.7 Å²	118.7	48%	0.479	60%	0.6	S	S	.	*	H	α-helix	trans	-48.7	-50.9	174.6	0	0	0	0	0	113.6	C4 Y5 I6	A2-C4 VanDerWaalsContact C-N 3.27Å; A2-C4 PolarHBondContact O-N 3.42Å; A2-C4 VanDerWaalsContact O-N 3.15Å; A2-Y5 PolarHBondContact O-N 3.01Å; A2-Y5 VanDerWaalsContact O-N 3.09Å; A2-I6 WeakPolarHBondContact O-CD1 3.31Å; A2-I6 WeakPolarHBondContact O-CG1 3.42Å; A2-I6 PolarHBondContact O-N 3.44Å
3	Q	28.7	Very low	35.8	Very low	122 Å²	122	111.5 Å²	111.5	57%	0.57	57%	0.566	S	S	*	*	H	α-helix	trans	-59.1	-29.3	179	-148.2	92.1	15.5	0	0	115.3	M1	M1-Q3 PolarHBondContact O-N 3.48Å
4	C	30.3	Very low	37.3	Very low	95 Å²	95	105.5 Å²	105.5	64%	0.642	54%	0.539	S	S	*	.	H	α-helix	trans	-81.3	-36.7	175.7	-89.5	0	0	0	0	111.7	M1 A2 I6 N7	M1-C4 PolarHBondContact O-N 2.94Å; A2-C4 VanDerWaalsContact C-N 3.27Å; A2-C4 PolarHBondContact O-N 3.42Å; A2-C4 VanDerWaalsContact O-N 3.15Å; C4-I6 VanDerWaalsContact C-N 3.29Å; C4-I6 PolarHBondContact O-N 3.42Å; C4-N7 PolarHBondContact O-N 3.28Å
5	Y	35.8	Very low	39.1	Very low	159 Å²	159	101.5 Å²	101.5	62%	0.624	52%	0.524	S	S	*	.	H	α-helix	trans	-64.4	-37.2	176.7	-149.1	-94.3	0	0	0	111.3	M1 A2 N7 Q8	M1-Y5 PolarHBondContact O-N 3.42Å; M1-Y5 VanDerWaalsContact O-N 3.08Å; A2-Y5 PolarHBondContact O-N 3.01Å; A2-Y5 VanDerWaalsContact O-N 3.09Å; Y5-N7 PolarHBondContact O-N 3.44Å; Y5-Q8 PolarHBondContact O-N 2.72Å
6	I	39	Very low	41.2	Very low	13 Å²	13	99.8 Å²	99.8	7%	0.067	52%	0.522	C	S	.	.	H	α-helix	trans	-62.8	-40	178.5	-67.5	168.7	0	0	0	112.5	A2 C4 Q8 C13 L79	A2-I6 WeakPolarHBondContact O-CD1 3.31Å; A2-I6 WeakPolarHBondContact O-CG1 3.42Å; A2-I6 PolarHBondContact O-N 3.44Å; C4-I6 VanDerWaalsContact C-N 3.29Å; C4-I6 PolarHBondContact O-N 3.42Å; I6-Q8 PolarHBondContact O-N 3.36Å; I6-C13 HydrophobicContact CG2-CB 3.96Å; I6-C13 WeakPolarHBondContact CG2-SG 2.97Å; I6-L79 HydrophobicContact CB-CD1 4.21Å; I6-L79 HydrophobicContact CD1-CB 4.17Å; I6-L79 HydrophobicContact CD1-CD1 3.83Å; I6-L79 HydrophobicContact CG1-CB 4.26Å; I6-L79 HydrophobicContact CG1-CD1 3.52Å; I6-L79 HydrophobicContact CG1-CD2 4.16Å; I6-L79 HydrophobicContact CG1-CG 4.18Å; I6-L79 HydrophobicContact CG2-CD1 3.77Å
7	N	36.7	Very low	43.5	Very low	92 Å²	92	106.4 Å²	106.4	49%	0.492	54%	0.538	S	S	.	.	H	α-helix	trans	-73.6	-13	-179.9	-81.7	-27.5	0	0	0	113.9	C4 Y5	C4-N7 PolarHBondContact O-N 3.28Å; Y5-N7 PolarHBondContact O-N 3.44Å
8	Q	38.4	Very low	45.7	Very low	130 Å²	130	105.3 Å²	105.3	61%	0.607	53%	0.533	S	S	*	.	H	α-helix	trans	-102.1	-23	-168.8	-139.7	171.7	-4.7	0	0	113.5	Y5 I6	Y5-Q8 PolarHBondContact O-N 2.72Å; I6-Q8 PolarHBondContact O-N 3.36Å
9	H	34.2	Very low	47.9	Very low	133 Å²	133	100.2 Å²	100.2	62%	0.616	51%	0.507	S	S	*	.	H	α-helix	trans	-121.3	-17.1	-173.1	-87.2	-82.3	0	0	0	115.9
10	F	36.3	Very low	49.9	Very low	95 Å²	95	96.7 Å²	96.7	42%	0.417	50%	0.497	S	S	.	.			trans	-117.7	108.8	-179	-79.9	-86.1	0	0	0	111.7	I12 C13 Y78 L79	F10-I12 PolarHBondContact O-N 3.23Å; F10-I12 VanDerWaalsContact O-N 3.07Å; F10-C13 PolarHBondContact O-N 3.28Å; F10-Y78 HydrophobicContact CZ-CE1 4.47Å; F10-L79 HydrophobicContact CD2-CD2 4.09Å; F10-L79 HydrophobicContact CE2-CD2 4.01Å
11	L	40.1	Very low	51.9	Low	187 Å²	187	96.1 Å²	96.1	98%	0.979	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-11.9	171.1	-112.9	113.3	0	0	0	113.6
12	I	44.4	Very low	54.9	Low	135 Å²	135	87.2 Å²	87.2	69%	0.692	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.2	-12	-172.2	-54.7	171.5	0	0	0	111.7	F10 P14	F10-I12 PolarHBondContact O-N 3.23Å; F10-I12 VanDerWaalsContact O-N 3.07Å; I12-P14 WeakPolarHBondContact O-CD 3.35Å
13	C	42.3	Very low	57.9	Low	25 Å²	25	84.7 Å²	84.7	17%	0.169	43%	0.433	C	S	.	.	S	Bend	trans	-75.7	121	178.5	-153.7	0	0	0	0	109.6	I6 F10 S15 V75	I6-C13 HydrophobicContact CG2-CB 3.96Å; I6-C13 WeakPolarHBondContact CG2-SG 2.97Å; F10-C13 PolarHBondContact O-N 3.28Å; C13-S15 PolarHBondContact O-N 2.94Å; C13-S15 VanDerWaalsContact O-N 3.15Å; C13-V75 HydrophobicContact CB-CG1 4.4Å
14	P	56.6	Low	61	Low	28 Å²	28	81 Å²	81	18%	0.182	42%	0.424	C	S	.	.	P	Polyproline II helix	trans	-57.9	126.6	176.8	21.9	-30.6	0	0	0	108.4	I12 I18	I12-P14 WeakPolarHBondContact O-CD 3.35Å; P14-I18 HydrophobicContact CB-CG2 4.4Å
15	S	65.7	Low	64.1	Low	45 Å²	45	79.7 Å²	79.7	32%	0.315	41%	0.413	S	S	.	.	P	Polyproline II helix	trans	-54.8	145.2	-179.1	78.4	0	0	0	0	109.5	C13 R17 I18 L19	C13-S15 PolarHBondContact O-N 2.94Å; C13-S15 VanDerWaalsContact O-N 3.15Å; S15-R17 PolarHBondContact O-N 3.16Å; S15-I18 WeakPolarHBondContact O-CA 3.26Å; S15-I18 WeakPolarHBondContact O-CB 3.32Å; S15-I18 PolarHBondContact O-N 3.28Å; S15-I18 WeakPolarHBondContact OG-CD1 3.47Å; S15-I18 VanDerWaalsContact OG-CG1 3.26Å; S15-I18 WeakPolarHBondContact OG-CG1 3.3Å; S15-I18 PolarHBondContact OG-N 3.23Å; S15-L19 PolarHBondContact O-N 3.23Å; S15-L19 VanDerWaalsContact O-N 3.08Å
16	P	72	Confident	66.8	Low	75 Å²	75	72.4 Å²	72.4	49%	0.487	39%	0.385	S	S	.	.	H	α-helix	trans	-57.7	-20.4	-178.6	18.5	-30.3	0	0	0	113.3	G20	P16-G20 PolarHBondContact O-N 3.25Å
17	R	79.6	Confident	69.4	Low	212 Å²	212	72.9 Å²	72.9	80%	0.8	39%	0.387	S	S	*	.	H	α-helix	trans	-71.7	-45.3	171.4	-66.6	-176.4	179.2	175.3	0.1	112.2	S15 G20 T21	S15-R17 PolarHBondContact O-N 3.16Å; R17-G20 PolarHBondContact O-N 3.27Å; R17-T21 PolarHBondContact O-N 3.25Å; R17-T21 PolarHBondContact O-OG1 3.44Å
18	I	83.9	Confident	72.2	Confident	86 Å²	86	73.5 Å²	73.5	44%	0.441	39%	0.39	S	S	.	.	H	α-helix	trans	-63.3	-44.4	177.7	-67	164.8	0	0	0	110.4	P14 S15 G20 T21 I22	P14-I18 HydrophobicContact CB-CG2 4.4Å; S15-I18 WeakPolarHBondContact O-CA 3.26Å; S15-I18 WeakPolarHBondContact O-CB 3.32Å; S15-I18 PolarHBondContact O-N 3.28Å; S15-I18 WeakPolarHBondContact OG-CD1 3.47Å; S15-I18 VanDerWaalsContact OG-CG1 3.26Å; S15-I18 WeakPolarHBondContact OG-CG1 3.3Å; S15-I18 PolarHBondContact OG-N 3.23Å; I18-G20 VanDerWaalsContact C-N 3.3Å; I18-G20 PolarHBondContact O-N 3.05Å; I18-T21 WeakPolarHBondContact CA-OG1 3.42Å; I18-T21 PolarHBondContact O-N 3.05Å; I18-T21 PolarHBondContact O-OG1 3.06Å; I18-I22 HydrophobicContact CG2-CD1 3.8Å; I18-I22 WeakPolarHBondContact O-CD1 3.43Å; I18-I22 VanDerWaalsContact O-CG1 3.27Å; I18-I22 WeakPolarHBondContact O-CG1 3.39Å; I18-I22 PolarHBondContact O-N 3.14Å
19	L	87.4	Confident	74.8	Confident	8 Å²	8	68.1 Å²	68.1	4%	0.042	37%	0.365	C	S	.	.	H	α-helix	trans	-62.9	-39.3	176.5	-170.8	66.3	0	0	0	111.5	S15 I22 I23 F69	S15-L19 PolarHBondContact O-N 3.23Å; S15-L19 VanDerWaalsContact O-N 3.08Å; L19-I22 PolarHBondContact O-N 3Å; L19-I23 HydrophobicContact CG-CD1 4.22Å; L19-I23 WeakPolarHBondContact O-CD1 3.39Å; L19-I23 VanDerWaalsContact O-CG1 3.27Å; L19-I23 WeakPolarHBondContact O-CG1 3.34Å; L19-I23 PolarHBondContact O-N 3.21Å; L19-F69 HydrophobicContact CD1-CD1 3.98Å; L19-F69 HydrophobicContact CD1-CE1 3.86Å
20	G	88.6	Confident	77.5	Confident	31 Å²	31	62.2 Å²	62.2	32%	0.32	34%	0.339	S	S	.	.	H	α-helix	trans	-62.2	-41.5	174.9	0	0	0	0	0	113.5	P16 R17 I18 I23 A24	P16-G20 PolarHBondContact O-N 3.25Å; R17-G20 PolarHBondContact O-N 3.27Å; I18-G20 VanDerWaalsContact C-N 3.3Å; I18-G20 PolarHBondContact O-N 3.05Å; G20-I23 PolarHBondContact O-N 3.5Å; G20-A24 PolarHBondContact O-N 3.06Å; G20-A24 VanDerWaalsContact O-N 3.1Å
21	T	90.3	Very high	80.2	Confident	85 Å²	85	61 Å²	61	52%	0.521	33%	0.334	S	S	.	.	H	α-helix	trans	-67.3	-38.6	176.8	48.8	0	0	0	0	112	R17 I18 A24 V25	R17-T21 PolarHBondContact O-N 3.25Å; R17-T21 PolarHBondContact O-OG1 3.44Å; I18-T21 WeakPolarHBondContact CA-OG1 3.42Å; I18-T21 PolarHBondContact O-N 3.05Å; I18-T21 PolarHBondContact O-OG1 3.06Å; T21-A24 WeakPolarHBondContact O-CB 3.26Å; T21-A24 PolarHBondContact O-N 3.45Å; T21-V25 WeakPolarHBondContact O-CG2 3.34Å; T21-V25 PolarHBondContact O-N 3.05Å
22	I	93.3	Very high	82.6	Confident	17 Å²	17	54.5 Å²	54.5	9%	0.087	30%	0.302	C	S	.	.	H	α-helix	trans	-64.1	-44.6	177	-67.2	161.9	0	0	0	110.9	I18 L19 A24 V25 V26 C65 I68 F69	I18-I22 HydrophobicContact CG2-CD1 3.8Å; I18-I22 WeakPolarHBondContact O-CD1 3.43Å; I18-I22 VanDerWaalsContact O-CG1 3.27Å; I18-I22 WeakPolarHBondContact O-CG1 3.39Å; I18-I22 PolarHBondContact O-N 3.14Å; L19-I22 PolarHBondContact O-N 3Å; I22-A24 VanDerWaalsContact C-N 3.27Å; I22-A24 PolarHBondContact O-N 3.26Å; I22-V25 PolarHBondContact O-N 3.49Å; I22-V26 HydrophobicContact CG2-CG2 4.5Å; I22-V26 WeakPolarHBondContact O-CG2 3.46Å; I22-V26 PolarHBondContact O-N 3.36Å; I22-C65 HydrophobicContact CG2-CB 3.97Å; I22-I68 HydrophobicContact CD1-CB 4.09Å; I22-I68 HydrophobicContact CD1-CD1 3.51Å; I22-I68 HydrophobicContact CD1-CG1 4.33Å; I22-I68 HydrophobicContact CD1-CG2 3.5Å; I22-I68 VanDerWaalsContact CD1-CG2 3.5Å; I22-I68 HydrophobicContact CG1-CD1 4.25Å; I22-F69 HydrophobicContact CG2-CE1 4.05Å; I22-F69 HydrophobicContact CG2-CZ 3.88Å
23	I	93.1	Very high	84.6	Confident	6 Å²	6	48.1 Å²	48.1	3%	0.031	27%	0.269	C	S	.	.	H	α-helix	trans	-59	-42.4	175.4	-66.6	163.5	0	0	0	110.6	L19 G20 V26 L27 F69 F127 L128 N131	L19-I23 HydrophobicContact CG-CD1 4.22Å; L19-I23 WeakPolarHBondContact O-CD1 3.39Å; L19-I23 VanDerWaalsContact O-CG1 3.27Å; L19-I23 WeakPolarHBondContact O-CG1 3.34Å; L19-I23 PolarHBondContact O-N 3.21Å; G20-I23 PolarHBondContact O-N 3.5Å; I23-V26 PolarHBondContact O-N 3.43Å; I23-L27 HydrophobicContact CG2-CD1 4.11Å; I23-L27 WeakPolarHBondContact O-CG 3.39Å; I23-L27 PolarHBondContact O-N 3.46Å; I23-L27 VanDerWaalsContact O-N 3.12Å; I23-F69 HydrophobicContact CG1-CE1 3.94Å; I23-F69 HydrophobicContact CG1-CZ 3.97Å; I23-F127 HydrophobicContact CG1-CB 4.22Å; I23-L128 HydrophobicContact CG2-CB 3.89Å; I23-L128 HydrophobicContact CG2-CD1 3.98Å; I23-N131 HydrophobicContact CD1-CB 3.68Å
24	A	93.5	Very high	86.6	Confident	45 Å²	45	50.9 Å²	50.9	37%	0.372	28%	0.276	S	S	.	.	H	α-helix	trans	-62.5	-43.5	176.7	0	0	0	0	0	112	G20 T21 I22 L27 L28	G20-A24 PolarHBondContact O-N 3.06Å; G20-A24 VanDerWaalsContact O-N 3.1Å; T21-A24 WeakPolarHBondContact O-CB 3.26Å; T21-A24 PolarHBondContact O-N 3.45Å; I22-A24 VanDerWaalsContact C-N 3.27Å; I22-A24 PolarHBondContact O-N 3.26Å; A24-L27 PolarHBondContact O-N 2.94Å; A24-L28 WeakPolarHBondContact O-CB 3.31Å; A24-L28 VanDerWaalsContact O-CG 3.27Å; A24-L28 WeakPolarHBondContact O-CG 3.37Å; A24-L28 PolarHBondContact O-N 3.43Å
25	V	94.2	Very high	88.1	Confident	67 Å²	67	50.3 Å²	50.3	41%	0.406	27%	0.273	S	S	.	.	H	α-helix	trans	-60	-47.3	176.7	169.8	0	0	0	0	111.1	T21 I22 L27 L28 L29 V61	T21-V25 WeakPolarHBondContact O-CG2 3.34Å; T21-V25 PolarHBondContact O-N 3.05Å; I22-V25 PolarHBondContact O-N 3.49Å; V25-L27 VanDerWaalsContact C-N 3.3Å; V25-L27 PolarHBondContact O-N 3.4Å; V25-L28 PolarHBondContact O-N 3.21Å; V25-L29 PolarHBondContact O-N 3.04Å; V25-V61 HydrophobicContact CG1-CG1 3.98Å
26	V	93.8	Very high	89.2	Confident	6 Å²	6	48.3 Å²	48.3	4%	0.036	26%	0.258	C	S	.	.	H	α-helix	trans	-61.4	-37.9	179.8	170.4	0	0	0	0	112.4	I22 I23 C65 F69 R124 F127	I22-V26 HydrophobicContact CG2-CG2 4.5Å; I22-V26 WeakPolarHBondContact O-CG2 3.46Å; I22-V26 PolarHBondContact O-N 3.36Å; I23-V26 PolarHBondContact O-N 3.43Å; V26-C65 HydrophobicContact CG2-CB 3.3Å; V26-C65 WeakPolarHBondContact CG2-SG 3.48Å; V26-F69 HydrophobicContact CG2-CE2 4.12Å; V26-F69 HydrophobicContact CG2-CZ 4.36Å; V26-R124 HydrophobicContact CG1-CB 4.06Å; V26-R124 HydrophobicContact CG1-CG 3.58Å; V26-R124 PolarHBondContact O-NH1 3.45Å; V26-F127 HydrophobicContact CG1-CD2 4.47Å
27	L	94.1	Very high	90.1	Very high	23 Å²	23	45.5 Å²	45.5	12%	0.12	24%	0.24	C	C	.	.	H	α-helix	trans	-72.7	-41.4	176.4	-66.7	174.3	0	0	0	111.8	I23 A24 V25 L29 A30 R124 P125 L128 Y520	I23-L27 HydrophobicContact CG2-CD1 4.11Å; I23-L27 WeakPolarHBondContact O-CG 3.39Å; I23-L27 PolarHBondContact O-N 3.46Å; I23-L27 VanDerWaalsContact O-N 3.12Å; A24-L27 PolarHBondContact O-N 2.94Å; V25-L27 VanDerWaalsContact C-N 3.3Å; V25-L27 PolarHBondContact O-N 3.4Å; L27-L29 PolarHBondContact O-N 3.33Å; L27-A30 WeakPolarHBondContact O-CB 3.32Å; L27-A30 PolarHBondContact O-N 3.41Å; L27-R124 HydrophobicContact CD2-CB 4.02Å; L27-P125 HydrophobicContact CD2-CG 4.27Å; L27-L128 HydrophobicContact CD1-CB 4.41Å; L27-L128 HydrophobicContact CD1-CD2 4.24Å; L27-Y520 HydrophobicContact CB-CE2 4.36Å; L27-Y520 HydrophobicContact CD2-CD2 4Å; L27-Y520 HydrophobicContact CD2-CE2 3.83Å
28	L	93.9	Very high	90.4	Very high	104 Å²	104	38.8 Å²	38.8	55%	0.545	22%	0.223	S	C	.	.	H	α-helix	trans	-68.4	-22.1	178.7	-73.4	171.4	0	0	0	113.2	A24 V25 A30 F31	A24-L28 WeakPolarHBondContact O-CB 3.31Å; A24-L28 VanDerWaalsContact O-CG 3.27Å; A24-L28 WeakPolarHBondContact O-CG 3.37Å; A24-L28 PolarHBondContact O-N 3.43Å; V25-L28 PolarHBondContact O-N 3.21Å; L28-A30 PolarHBondContact O-N 3.34Å; L28-A30 VanDerWaalsContact O-N 3.09Å; L28-F31 HydrophobicContact CD2-CD2 4.14Å; L28-F31 HydrophobicContact CD2-CE2 4.09Å; L28-F31 PolarHBondContact O-N 3.38Å
29	L	92.8	Very high	90.5	Very high	18 Å²	18	36.5 Å²	36.5	9%	0.094	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-56.8	-25.8	176.2	-157.8	66.9	0	0	0	112.4	V25 L27 F31 V32 E33 P58 V61 E62	V25-L29 PolarHBondContact O-N 3.04Å; L27-L29 PolarHBondContact O-N 3.33Å; L29-F31 PolarHBondContact O-N 2.9Å; L29-V32 PolarHBondContact O-N 3.23Å; L29-E33 HydrophobicContact CD2-CG 4.5Å; L29-E33 WeakPolarHBondContact CD2-OE1 3.17Å; L29-E33 HydrophobicContact CG-CG 4Å; L29-E33 WeakPolarHBondContact CG-OE1 3.31Å; L29-E33 WeakPolarHBondContact O-CG 3.5Å; L29-E33 PolarHBondContact O-N 3.34Å; L29-P58 HydrophobicContact CD1-CB 4.23Å; L29-P58 HydrophobicContact CD2-CB 4.38Å; L29-P58 HydrophobicContact CG-CB 4.35Å; L29-V61 HydrophobicContact CD1-CB 4.37Å; L29-V61 HydrophobicContact CD1-CG1 4.21Å; L29-E62 HydrophobicContact CD2-CB 4.09Å
30	A	91.4	Very high	90.3	Very high	8 Å²	8	44 Å²	44	7%	0.066	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-60.2	-24	175.2	0	0	0	0	0	114.6	L27 L28 Y520 F572	L27-A30 WeakPolarHBondContact O-CB 3.32Å; L27-A30 PolarHBondContact O-N 3.41Å; L28-A30 PolarHBondContact O-N 3.34Å; L28-A30 VanDerWaalsContact O-N 3.09Å; A30-Y520 HydrophobicContact CB-CE2 3.94Å; A30-F572 HydrophobicContact CB-CD1 3.86Å; A30-F572 HydrophobicContact CB-CD2 4.03Å; A30-F572 HydrophobicContact CB-CE1 3.96Å; A30-F572 HydrophobicContact CB-CE2 4.14Å; A30-F572 HydrophobicContact CB-CG 3.9Å; A30-F572 HydrophobicContact CB-CZ 4.12Å; A30-F572 WeakPolarHBondContact O-CB 3.5Å
31	F	92.6	Very high	90.2	Very high	69 Å²	69	44.7 Å²	44.7	30%	0.303	25%	0.253	S	S	.	.	G	3₁₀ helix	trans	-77.8	-24.2	175.8	-73.1	-88.6	0	0	0	113.1	L28 L29 S37 F572 A573 I576	L28-F31 HydrophobicContact CD2-CD2 4.14Å; L28-F31 HydrophobicContact CD2-CE2 4.09Å; L28-F31 PolarHBondContact O-N 3.38Å; L29-F31 PolarHBondContact O-N 2.9Å; F31-S37 PolarHBondContact O-N 3.23Å; F31-F572 HydrophobicContact CD1-CD1 4.09Å; F31-F572 AromaticContact CD2-CD1 3.88Å; F31-F572 HydrophobicContact CD2-CD1 3.88Å; F31-F572 HydrophobicContact CD2-CE1 4.07Å; F31-F572 AromaticContact CE1-CD1 3.93Å; F31-F572 HydrophobicContact CE1-CD1 3.93Å; F31-F572 HydrophobicContact CE1-CE1 4.43Å; F31-F572 AromaticContact CE2-CD1 3.71Å; F31-F572 HydrophobicContact CE2-CD1 3.71Å; F31-F572 AromaticContact CE2-CE1 3.57Å; F31-F572 HydrophobicContact CE2-CE1 3.57Å; F31-F572 HydrophobicContact CG-CD1 4.07Å; F31-F572 AromaticContact CZ-CD1 3.73Å; F31-F572 HydrophobicContact CZ-CD1 3.73Å; F31-F572 AromaticContact CZ-CE1 3.78Å; F31-F572 HydrophobicContact CZ-CE1 3.78Å; F31-A573 HydrophobicContact CD1-CB 4.15Å; F31-A573 HydrophobicContact CE1-CB 3.91Å; F31-I576 HydrophobicContact CE1-CD1 4.47Å; F31-I576 HydrophobicContact CZ-CD1 3.93Å
32	V	90.4	Very high	90	Very high	52 Å²	52	42.1 Å²	42.1	32%	0.315	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.7	-32.4	-171.7	173	0	0	0	0	111.8	L29 W51 P53	L29-V32 PolarHBondContact O-N 3.23Å; V32-W51 HydrophobicContact CG1-CZ3 3.94Å; V32-P53 WeakPolarHBondContact O-CD 3.32Å; V32-P53 WeakPolarHBondContact O-CG 3.38Å
33	E	87.3	Confident	89.7	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	24%	0.236	C	C	.	.	S	Bend	trans	-64.8	164.9	176.6	-74.1	172.5	-139.7	0	0	113.3	L29 P35 S36 P58 R118 R121 R124	L29-E33 HydrophobicContact CD2-CG 4.5Å; L29-E33 WeakPolarHBondContact CD2-OE1 3.17Å; L29-E33 HydrophobicContact CG-CG 4Å; L29-E33 WeakPolarHBondContact CG-OE1 3.31Å; L29-E33 WeakPolarHBondContact O-CG 3.5Å; L29-E33 PolarHBondContact O-N 3.34Å; E33-P35 CarbonylContact O-C 3.57Å; E33-S36 WeakPolarHBondContact O-CA 3.27Å; E33-S36 PolarHBondContact O-N 3.15Å; E33-S36 VanDerWaalsContact O-N 3.09Å; E33-P58 HydrophobicContact CG-CB 3.7Å; E33-P58 HydrophobicContact CG-CG 4.3Å; E33-R118 IonicContact OE2-NH1 3.87Å; E33-R121 VanDerWaalsContact CB-NH2 3.32Å; E33-R121 IonicContact OE2-CZ 3.32Å; E33-R121 IonicContact OE2-NE 3.81Å; E33-R121 PolarHBondContact OE2-NE 2.9Å; E33-R121 IonicContact OE2-NH2 3.72Å; E33-R121 PolarHBondContact OE2-NH2 2.87Å; E33-R124 IonicContact OE1-CZ 2.74Å; E33-R124 IonicContact OE1-NH1 3.07Å; E33-R124 PolarHBondContact OE1-NH1 3.25Å; E33-R124 IonicContact OE1-NH2 2.6Å; E33-R124 PolarHBondContact OE1-NH2 3.46Å; E33-R124 IonicContact OE2-NH1 3.91Å; E33-R124 IonicContact OE2-NH2 2.65Å; E33-R124 PolarHBondContact OE2-NH2 3.3Å
34	R	84.6	Confident	89.2	Confident	83 Å²	83	42 Å²	42	31%	0.313	24%	0.238	S	C	.	.	S	Bend	trans	-70.4	130.4	174	-65.6	-176.5	172.2	161.2	-3.5	112.1	E52 R121	R34-E52 IonicContact CZ-OE2 3.96Å; R34-E52 IonicContact NE-OE2 2.81Å; R34-E52 PolarHBondContact NE-OE2 2.76Å; R34-E52 IonicContact NH2-OE2 2.81Å; R34-E52 PolarHBondContact NH2-OE2 2.92Å; R34-R121 PolarHBondContact O-NH1 3.4Å; R34-R121 PolarHBondContact O-NH2 2.84Å
35	P	87.2	Confident	88.7	Confident	17 Å²	17	43.1 Å²	43.1	11%	0.11	23%	0.233	C	C	.	.	S	Bend	cis	-73	131.7	-6.9	29.4	-34.1	0	0	0	111.8	E33 I527 D570	E33-P35 CarbonylContact O-C 3.57Å; P35-I527 HydrophobicContact CG-CG2 4.02Å; P35-D570 WeakPolarHBondContact CB-O 3.44Å; P35-D570 WeakPolarHBondContact CG-O 3.29Å
36	S	88.8	Confident	87.7	Confident	2 Å²	2	45.8 Å²	45.8	1%	0.014	24%	0.241	C	C	.	.	P	Polyproline II helix	trans	-78.1	137.9	-175.3	77.7	0	0	0	0	111.2	E33 V38 W51	E33-S36 WeakPolarHBondContact O-CA 3.27Å; E33-S36 PolarHBondContact O-N 3.15Å; E33-S36 VanDerWaalsContact O-N 3.09Å; S36-V38 VanDerWaalsContact C-N 3.26Å; S36-W51 WeakPolarHBondContact CB-O 3.31Å; S36-W51 PolarHBondContact OG-O 3.4Å
37	S	90.4	Very high	86.3	Confident	16 Å²	16	49.3 Å²	49.3	11%	0.112	26%	0.257	C	S	.	.			trans	-88.1	5.2	173.8	-67.1	0	0	0	0	112.8	F31 S39 D571 F572 A573	F31-S37 PolarHBondContact O-N 3.23Å; S37-S39 VanDerWaalsContact C-N 3.29Å; S37-S39 PolarHBondContact O-N 3.03Å; S37-D571 VanDerWaalsContact CB-OD2 3.28Å; S37-D571 WeakPolarHBondContact CB-OD2 3.12Å; S37-D571 WeakPolarHBondContact OG-CB 3.47Å; S37-D571 PolarHBondContact OG-OD2 3.49Å; S37-F572 PolarHBondContact OG-N 2.9Å; S37-A573 PolarHBondContact OG-N 3.02Å
38	V	87.5	Confident	84.7	Confident	71 Å²	71	50.7 Å²	50.7	43%	0.43	27%	0.269	S	S	.	.			trans	-83.8	79.1	-180	-172.5	0	0	0	0	108.5	S36 W51	S36-V38 VanDerWaalsContact C-N 3.26Å; V38-W51 HydrophobicContact CB-CE3 4.44Å; V38-W51 HydrophobicContact CG1-CB 4.48Å; V38-W51 HydrophobicContact CG2-CE3 4.43Å
39	S	85.4	Confident	83.5	Confident	38 Å²	38	51.5 Å²	51.5	27%	0.266	28%	0.283	S	S	.	.	S	Bend	trans	-140.7	161.7	172.4	68.3	0	0	0	0	110.6	S37 S41	S37-S39 VanDerWaalsContact C-N 3.29Å; S37-S39 PolarHBondContact O-N 3.03Å; S39-S41 PolarHBondContact OG-O 3.12Å
40	I	84	Confident	82.7	Confident	165 Å²	165	53.7 Å²	53.7	85%	0.846	29%	0.29	S	S	*	.	S	Bend	trans	-75.7	-33.9	177.6	-65.2	170.1	0	0	0	110.9
41	S	85.3	Confident	82.4	Confident	46 Å²	46	60 Å²	60	32%	0.322	31%	0.312	S	S	.	.			trans	-137.5	145	-179.8	-177.1	0	0	0	0	110	S39 D43	S39-S41 PolarHBondContact OG-O 3.12Å; S41-D43 WeakPolarHBondContact OG-CB 3.34Å; S41-D43 PolarHBondContact OG-N 2.84Å; S41-D43 VanDerWaalsContact OG-N 3.09Å
42	S	86.8	Confident	81.9	Confident	31 Å²	31	61.8 Å²	61.8	22%	0.217	32%	0.322	C	S	.	.			trans	-88.1	-5.5	168.9	61.4	0	0	0	0	112.7	P44 P566 N568	S42-P44 WeakPolarHBondContact O-CD 3.39Å; S42-P566 WeakPolarHBondContact OG-CB 3.43Å; S42-P566 PolarHBondContact OG-O 3.3Å; S42-N568 PolarHBondContact O-ND2 2.8Å
43	D	87.1	Confident	81.6	Confident	9 Å²	9	59.8 Å²	59.8	5%	0.048	31%	0.309	C	S	.	.			trans	-65.7	115.2	179.8	-169.4	-14.2	0	0	0	110.7	S41 R45 H46 Q47 W565 P566	S41-D43 WeakPolarHBondContact OG-CB 3.34Å; S41-D43 PolarHBondContact OG-N 2.84Å; S41-D43 VanDerWaalsContact OG-N 3.09Å; D43-R45 PolarHBondContact O-N 3.44Å; D43-R45 VanDerWaalsContact O-N 3.13Å; D43-R45 VanDerWaalsContact OD1-CB 3.31Å; D43-R45 WeakPolarHBondContact OD1-CB 3.41Å; D43-R45 WeakPolarHBondContact OD1-CG 3.42Å; D43-R45 IonicContact OD1-CZ 3.72Å; D43-R45 PolarHBondContact OD1-N 2.85Å; D43-R45 IonicContact OD1-NE 3.06Å; D43-R45 PolarHBondContact OD1-NE 3.23Å; D43-R45 VanDerWaalsContact OD1-NE 3.09Å; D43-R45 IonicContact OD1-NH2 3.52Å; D43-R45 IonicContact OD2-CZ 3.09Å; D43-R45 IonicContact OD2-NE 2.86Å; D43-R45 PolarHBondContact OD2-NE 3.4Å; D43-R45 VanDerWaalsContact OD2-NE 3.09Å; D43-R45 IonicContact OD2-NH2 3.97Å; D43-R45 PolarHBondContact OD2-NH2 2.85Å; D43-H46 PolarHBondContact O-N 2.59Å; D43-H46 IonicContact OD2-CE1 2.74Å; D43-H46 IonicContact OD2-ND1 3.16Å; D43-H46 PolarHBondContact OD2-ND1 2.71Å; D43-Q47 PolarHBondContact O-N 3.3Å; D43-W565 WeakPolarHBondContact OD1-CB 3.09Å; D43-P566 HydrophobicContact CB-CG 4.04Å
44	P	82.9	Confident	81.5	Confident	11 Å²	11	64 Å²	64	7%	0.071	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-60.6	-22.7	177.8	-23.6	35.2	0	0	0	113.3	S42 P536 W565 N568	S42-P44 WeakPolarHBondContact O-CD 3.39Å; P44-P536 HydrophobicContact CB-CG 4.31Å; P44-W565 WeakPolarHBondContact CD-O 3.27Å; P44-N568 WeakPolarHBondContact CG-ND2 3.4Å
45	R	82.4	Confident	81.3	Confident	69 Å²	69	63.8 Å²	63.8	26%	0.26	35%	0.347	S	S	.	.	G	3₁₀ helix	trans	-72.9	-29.8	-179.2	-60.5	175.4	-63	175.7	2.4	113.3	D43 P536 W565	D43-R45 PolarHBondContact O-N 3.44Å; D43-R45 VanDerWaalsContact O-N 3.13Å; D43-R45 VanDerWaalsContact OD1-CB 3.31Å; D43-R45 WeakPolarHBondContact OD1-CB 3.41Å; D43-R45 WeakPolarHBondContact OD1-CG 3.42Å; D43-R45 IonicContact OD1-CZ 3.72Å; D43-R45 PolarHBondContact OD1-N 2.85Å; D43-R45 IonicContact OD1-NE 3.06Å; D43-R45 PolarHBondContact OD1-NE 3.23Å; D43-R45 VanDerWaalsContact OD1-NE 3.09Å; D43-R45 IonicContact OD1-NH2 3.52Å; D43-R45 IonicContact OD2-CZ 3.09Å; D43-R45 IonicContact OD2-NE 2.86Å; D43-R45 PolarHBondContact OD2-NE 3.4Å; D43-R45 VanDerWaalsContact OD2-NE 3.09Å; D43-R45 IonicContact OD2-NH2 3.97Å; D43-R45 PolarHBondContact OD2-NH2 2.85Å; R45-P536 HydrophobicContact CG-CB 4Å; R45-W565 HydrophobicContact CG-CD2 4.34Å; R45-W565 HydrophobicContact CG-CG 4.23Å; R45-W565 VanDerWaalsContact NE-CD1 3.35Å
46	H	73.5	Confident	81.1	Confident	123 Å²	123	64.4 Å²	64.4	57%	0.569	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-116.2	23.4	-173.2	-60.1	96.8	0	0	0	112	D43 S48	D43-H46 PolarHBondContact O-N 2.59Å; D43-H46 IonicContact OD2-CE1 2.74Å; D43-H46 IonicContact OD2-ND1 3.16Å; D43-H46 PolarHBondContact OD2-ND1 2.71Å; H46-S48 PolarHBondContact O-N 3.12Å; H46-S48 VanDerWaalsContact O-N 3.09Å
47	Q	63.4	Low	81.1	Confident	80 Å²	80	66.3 Å²	66.3	37%	0.374	37%	0.373	S	S	.	.			trans	-67.5	112.4	-164	-170.7	155.9	73.2	0	0	112.2	D43 R50	D43-Q47 PolarHBondContact O-N 3.3Å; Q47-R50 VanDerWaalsContact NE2-CZ 3.28Å
48	S	61.3	Low	81	Confident	53 Å²	53	65.9 Å²	65.9	37%	0.371	37%	0.37	S	S	.	.	P	Polyproline II helix	trans	-70.7	154.5	162.6	55.8	0	0	0	0	110	H46 R50	H46-S48 PolarHBondContact O-N 3.12Å; H46-S48 VanDerWaalsContact O-N 3.09Å; S48-R50 PolarHBondContact O-N 2.65Å; S48-R50 VanDerWaalsContact O-N 3.13Å
49	S	67.9	Low	81.2	Confident	120 Å²	120	62.8 Å²	62.8	84%	0.839	35%	0.351	S	S	*	.	P	Polyproline II helix	trans	-54	121.1	177	45.3	0	0	0	0	110.5
50	R	77.4	Confident	81.4	Confident	65 Å²	65	64.2 Å²	64.2	25%	0.245	36%	0.361	C	S	.	.	P	Polyproline II helix	trans	-64.6	135	175.8	-65.2	177.4	-178.2	148.5	-3.9	108.4	Q47 S48 E52 D570	Q47-R50 VanDerWaalsContact NE2-CZ 3.28Å; S48-R50 PolarHBondContact O-N 2.65Å; S48-R50 VanDerWaalsContact O-N 3.13Å; R50-E52 PolarHBondContact O-N 3.41Å; R50-D570 IonicContact NH2-OD2 3.14Å; R50-D570 PolarHBondContact NH2-OD2 3.17Å
51	W	83.4	Confident	81.9	Confident	139 Å²	139	58.9 Å²	58.9	53%	0.527	34%	0.336	S	S	.	.			trans	-74.2	112.4	173.7	178	76.3	0	0	0	109.1	V32 S36 V38 P53	V32-W51 HydrophobicContact CG1-CZ3 3.94Å; S36-W51 WeakPolarHBondContact CB-O 3.31Å; S36-W51 PolarHBondContact OG-O 3.4Å; V38-W51 HydrophobicContact CB-CE3 4.44Å; V38-W51 HydrophobicContact CG1-CB 4.48Å; V38-W51 HydrophobicContact CG2-CE3 4.43Å; W51-P53 HydrophobicContact CH2-CB 4.02Å; W51-P53 HydrophobicContact CZ3-CB 4.25Å
52	E	82.4	Confident	82.2	Confident	108 Å²	108	57 Å²	57	51%	0.505	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-95.7	130.5	175	-67.1	-172.5	-173.3	0	0	110.7	R34 R50	R34-E52 IonicContact CZ-OE2 3.96Å; R34-E52 IonicContact NE-OE2 2.81Å; R34-E52 PolarHBondContact NE-OE2 2.76Å; R34-E52 IonicContact NH2-OE2 2.81Å; R34-E52 PolarHBondContact NH2-OE2 2.92Å; R50-E52 PolarHBondContact O-N 3.41Å
53	P	84	Confident	82.5	Confident	9 Å²	9	59 Å²	59	6%	0.058	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-67	148.5	174	29.9	-35.6	0	0	0	110.4	V32 W51 P58	V32-P53 WeakPolarHBondContact O-CD 3.32Å; V32-P53 WeakPolarHBondContact O-CG 3.38Å; W51-P53 HydrophobicContact CH2-CB 4.02Å; W51-P53 HydrophobicContact CZ3-CB 4.25Å; P53-P58 HydrophobicContact CG-CG 4.19Å
54	P	86.3	Confident	82.8	Confident	90 Å²	90	63.6 Å²	63.6	58%	0.584	35%	0.352	S	S	*	.	P	Polyproline II helix	trans	-60.8	144.3	172	26.5	-33.5	0	0	0	110.5	G56 A57	P54-G56 PolarHBondContact O-N 3.4Å; P54-A57 HydrophobicContact CG-CB 4.11Å; P54-A57 PolarHBondContact O-N 2.79Å
55	C	79.9	Confident	83.4	Confident	77 Å²	77	63.5 Å²	63.5	52%	0.52	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	130.9	177.5	-63.4	0	0	0	0	110.4	C113	C55-C113 HydrophobicContact CB-CB 4.07Å
56	G	83.3	Confident	83.9	Confident	31 Å²	31	60.7 Å²	60.7	32%	0.32	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	97.7	-22	178.5	0	0	0	0	0	115	P54 E59 S60	P54-G56 PolarHBondContact O-N 3.4Å; G56-E59 WeakPolarHBondContact CA-OE2 3.5Å; G56-E59 PolarHBondContact N-OE2 3.2Å; G56-S60 VanDerWaalsContact O-CB 3.24Å; G56-S60 WeakPolarHBondContact O-CB 3.43Å; G56-S60 PolarHBondContact O-N 3.49Å; G56-S60 PolarHBondContact O-OG 3.01Å
57	A	87.8	Confident	84.9	Confident	41 Å²	41	58.9 Å²	58.9	34%	0.339	34%	0.335	S	S	.	.	H	α-helix	trans	-64.1	-57.2	178.1	0	0	0	0	0	112.6	P54 E59 S60 V61	P54-A57 HydrophobicContact CG-CB 4.11Å; P54-A57 PolarHBondContact O-N 2.79Å; A57-E59 VanDerWaalsContact C-N 3.28Å; A57-E59 PolarHBondContact O-N 2.63Å; A57-S60 PolarHBondContact O-N 3.35Å; A57-S60 PolarHBondContact O-OG 3.43Å; A57-V61 PolarHBondContact O-N 2.91Å
58	P	89.6	Confident	86.3	Confident	8 Å²	8	57 Å²	57	5%	0.052	33%	0.328	C	S	.	.	H	α-helix	trans	-64.8	-34.2	176.2	22.5	-27.6	0	0	0	112	L29 E33 P53 S60 V61 E62	L29-P58 HydrophobicContact CD1-CB 4.23Å; L29-P58 HydrophobicContact CD2-CB 4.38Å; L29-P58 HydrophobicContact CG-CB 4.35Å; E33-P58 HydrophobicContact CG-CB 3.7Å; E33-P58 HydrophobicContact CG-CG 4.3Å; P53-P58 HydrophobicContact CG-CG 4.19Å; P58-S60 VanDerWaalsContact C-N 3.33Å; P58-S60 PolarHBondContact O-N 3.43Å; P58-V61 PolarHBondContact O-N 2.97Å; P58-E62 WeakPolarHBondContact O-CB 3.5Å; P58-E62 PolarHBondContact O-N 3.26Å
59	E	90.1	Very high	87.9	Confident	6 Å²	6	54.6 Å²	54.6	3%	0.028	31%	0.311	C	S	.	.	H	α-helix	trans	-65	-34.3	177.3	-65.3	71.2	-153.6	0	0	112.3	G56 A57 M63 W105 R118	G56-E59 WeakPolarHBondContact CA-OE2 3.5Å; G56-E59 PolarHBondContact N-OE2 3.2Å; A57-E59 VanDerWaalsContact C-N 3.28Å; A57-E59 PolarHBondContact O-N 2.63Å; E59-M63 WeakPolarHBondContact O-CB 3.4Å; E59-M63 PolarHBondContact O-N 3.09Å; E59-W105 PolarHBondContact O-NE1 3.21Å; E59-R118 IonicContact OE1-CZ 2.86Å; E59-R118 IonicContact OE1-NH1 3.89Å; E59-R118 PolarHBondContact OE1-NH1 2.96Å; E59-R118 IonicContact OE1-NH2 3.83Å; E59-R118 PolarHBondContact OE1-NH2 3.09Å; E59-R118 VanDerWaalsContact OE1-NH2 3.16Å
60	S	91.4	Very high	89.1	Confident	68 Å²	68	51.4 Å²	51.4	48%	0.476	29%	0.287	S	S	.	.	H	α-helix	trans	-69.4	-41.9	175.9	72.5	0	0	0	0	112.6	G56 A57 P58 E62 M63 L64	G56-S60 VanDerWaalsContact O-CB 3.24Å; G56-S60 WeakPolarHBondContact O-CB 3.43Å; G56-S60 PolarHBondContact O-N 3.49Å; G56-S60 PolarHBondContact O-OG 3.01Å; A57-S60 PolarHBondContact O-N 3.35Å; A57-S60 PolarHBondContact O-OG 3.43Å; P58-S60 VanDerWaalsContact C-N 3.33Å; P58-S60 PolarHBondContact O-N 3.43Å; S60-E62 VanDerWaalsContact C-N 3.32Å; S60-M63 PolarHBondContact O-N 2.96Å; S60-L64 PolarHBondContact O-N 3.33Å
61	V	92.9	Very high	89.8	Confident	53 Å²	53	53.1 Å²	53.1	32%	0.321	30%	0.301	S	S	.	.	H	α-helix	trans	-64.2	-42.4	175	176.5	0	0	0	0	109.8	V25 L29 A57 P58 L64 C65	V25-V61 HydrophobicContact CG1-CG1 3.98Å; L29-V61 HydrophobicContact CD1-CB 4.37Å; L29-V61 HydrophobicContact CD1-CG1 4.21Å; A57-V61 PolarHBondContact O-N 2.91Å; P58-V61 PolarHBondContact O-N 2.97Å; V61-L64 PolarHBondContact O-N 2.88Å; V61-C65 PolarHBondContact O-N 2.99Å; V61-C65 VanDerWaalsContact O-N 3.09Å; V61-C65 PolarHBondContact O-SG 2.96Å
62	E	92.1	Very high	90.1	Very high	5 Å²	5	46.7 Å²	46.7	2%	0.023	28%	0.277	C	S	.	.	H	α-helix	trans	-64	-42.5	176.9	-172.5	160.8	-148.8	0	0	112.1	L29 P58 S60 L64 C65 L66 R120 R124	L29-E62 HydrophobicContact CD2-CB 4.09Å; P58-E62 WeakPolarHBondContact O-CB 3.5Å; P58-E62 PolarHBondContact O-N 3.26Å; S60-E62 VanDerWaalsContact C-N 3.32Å; E62-L64 PolarHBondContact O-N 3.33Å; E62-C65 PolarHBondContact O-N 3.34Å; E62-L66 HydrophobicContact CG-CD1 4.33Å; E62-L66 WeakPolarHBondContact O-CG 3.26Å; E62-L66 PolarHBondContact O-N 2.96Å; E62-R120 VanDerWaalsContact OE1-CD 3.29Å; E62-R120 WeakPolarHBondContact OE1-CD 3.41Å; E62-R120 IonicContact OE1-NE 3.28Å; E62-R120 WeakPolarHBondContact OE2-CD 3.47Å; E62-R120 IonicContact OE2-CZ 3.76Å; E62-R120 IonicContact OE2-NE 3.23Å; E62-R120 PolarHBondContact OE2-NE 3.23Å; E62-R120 IonicContact OE2-NH2 2.95Å; E62-R124 IonicContact OE1-CZ 2.84Å; E62-R124 VanDerWaalsContact OE1-CZ 3.28Å; E62-R124 IonicContact OE1-NE 2.77Å; E62-R124 PolarHBondContact OE1-NE 3.38Å; E62-R124 VanDerWaalsContact OE1-NE 3.08Å; E62-R124 IonicContact OE1-NH2 2.96Å; E62-R124 PolarHBondContact OE1-NH2 2.94Å; E62-R124 IonicContact OE2-NH2 2.76Å; E62-R124 PolarHBondContact OE2-NH2 3.35Å
63	M	92.8	Very high	90.5	Very high	73 Å²	73	42.7 Å²	42.7	36%	0.36	26%	0.259	S	S	.	.	H	α-helix	trans	-58.7	-47.1	175.4	-171.2	-83.8	-87.8	0	0	111.7	E59 S60 C65 L66 I67 W105	E59-M63 WeakPolarHBondContact O-CB 3.4Å; E59-M63 PolarHBondContact O-N 3.09Å; S60-M63 PolarHBondContact O-N 2.96Å; M63-C65 VanDerWaalsContact C-N 3.29Å; M63-C65 PolarHBondContact O-N 2.98Å; M63-L66 PolarHBondContact O-N 2.85Å; M63-I67 HydrophobicContact CE-CD1 4.37Å; M63-I67 WeakPolarHBondContact O-CG1 3.27Å; M63-I67 PolarHBondContact O-N 3.24Å; M63-I67 HydrophobicContact SD-CD1 3.22Å; M63-I67 WeakPolarHBondContact SD-CD1 3.31Å; M63-I67 HydrophobicContact SD-CG1 3.8Å; M63-W105 HydrophobicContact CB-CH2 4.48Å; M63-W105 HydrophobicContact CB-CZ2 3.63Å; M63-W105 HydrophobicContact CG-CH2 3.85Å; M63-W105 HydrophobicContact CG-CZ2 3.49Å; M63-W105 VanDerWaalsContact CG-CZ2 3.49Å
64	L	94.1	Very high	90.9	Very high	106 Å²	106	45 Å²	45	56%	0.555	28%	0.279	S	S	*	.	H	α-helix	trans	-57.8	-43.1	176.2	-176.7	69.3	0	0	0	111.6	S60 V61 E62 I67 I68	S60-L64 PolarHBondContact O-N 3.33Å; V61-L64 PolarHBondContact O-N 2.88Å; E62-L64 PolarHBondContact O-N 3.33Å; L64-I67 PolarHBondContact O-N 2.89Å; L64-I68 HydrophobicContact CG-CD1 4.46Å; L64-I68 WeakPolarHBondContact O-CG1 3.11Å; L64-I68 PolarHBondContact O-N 3.4Å
65	C	94.1	Very high	91	Very high	9 Å²	9	42.1 Å²	42.1	6%	0.061	26%	0.26	C	S	.	.	H	α-helix	trans	-65.2	-42.1	177.4	-62.7	0	0	0	0	112.2	I22 V26 V61 E62 M63 I68 F69	I22-C65 HydrophobicContact CG2-CB 3.97Å; V26-C65 HydrophobicContact CG2-CB 3.3Å; V26-C65 WeakPolarHBondContact CG2-SG 3.48Å; V61-C65 PolarHBondContact O-N 2.99Å; V61-C65 VanDerWaalsContact O-N 3.09Å; V61-C65 PolarHBondContact O-SG 2.96Å; E62-C65 PolarHBondContact O-N 3.34Å; M63-C65 VanDerWaalsContact C-N 3.29Å; M63-C65 PolarHBondContact O-N 2.98Å; C65-I68 PolarHBondContact O-N 3.16Å; C65-F69 HydrophobicContact CB-CE2 4.41Å; C65-F69 VanDerWaalsContact O-CD2 3.31Å; C65-F69 WeakPolarHBondContact O-CD2 3.42Å; C65-F69 WeakPolarHBondContact O-CG 3.38Å; C65-F69 PolarHBondContact O-N 3.33Å
66	L	94	Very high	91.3	Very high	11 Å²	11	39.6 Å²	39.6	6%	0.058	24%	0.24	C	C	.	.	H	α-helix	trans	-63.8	-40.2	177.8	-71.8	175.1	0	0	0	111.9	E62 M63 I68 F69 C70 V102 W105 F127	E62-L66 HydrophobicContact CG-CD1 4.33Å; E62-L66 WeakPolarHBondContact O-CG 3.26Å; E62-L66 PolarHBondContact O-N 2.96Å; M63-L66 PolarHBondContact O-N 2.85Å; L66-I68 VanDerWaalsContact C-N 3.29Å; L66-I68 PolarHBondContact O-N 3.4Å; L66-F69 HydrophobicContact CD2-CD2 4.45Å; L66-F69 PolarHBondContact O-N 3.48Å; L66-C70 PolarHBondContact O-N 3.48Å; L66-C70 PolarHBondContact O-SG 3.01Å; L66-C70 VanDerWaalsContact O-SG 3.35Å; L66-V102 HydrophobicContact CD1-CG2 4.48Å; L66-W105 HydrophobicContact CD1-CB 4.24Å; L66-W105 HydrophobicContact CD1-CG 4.45Å; L66-F127 HydrophobicContact CD2-CZ 4.49Å
67	I	94.4	Very high	91.5	Very high	84 Å²	84	39.5 Å²	39.5	43%	0.431	23%	0.234	S	C	.	.	H	α-helix	trans	-56.8	-46	173.1	-71.9	-178.9	0	0	0	110.4	M63 L64 F69 C70 L71	M63-I67 HydrophobicContact CE-CD1 4.37Å; M63-I67 WeakPolarHBondContact O-CG1 3.27Å; M63-I67 PolarHBondContact O-N 3.24Å; M63-I67 HydrophobicContact SD-CD1 3.22Å; M63-I67 WeakPolarHBondContact SD-CD1 3.31Å; M63-I67 HydrophobicContact SD-CG1 3.8Å; L64-I67 PolarHBondContact O-N 2.89Å; I67-F69 VanDerWaalsContact C-N 3.32Å; I67-F69 PolarHBondContact O-N 3.19Å; I67-C70 WeakPolarHBondContact O-CB 3.34Å; I67-C70 PolarHBondContact O-N 2.87Å; I67-L71 HydrophobicContact CG2-CD1 4.08Å; I67-L71 HydrophobicContact CG2-CG 4.46Å; I67-L71 WeakPolarHBondContact O-CG 3.43Å; I67-L71 PolarHBondContact O-N 3.38Å
68	I	93.5	Very high	91.5	Very high	42 Å²	42	46.3 Å²	46.3	22%	0.215	25%	0.252	C	S	.	.	H	α-helix	trans	-66.5	-36.2	-179	-59.7	164.7	0	0	0	111.2	I22 L64 C65 L66 L71 D72	I22-I68 HydrophobicContact CD1-CB 4.09Å; I22-I68 HydrophobicContact CD1-CD1 3.51Å; I22-I68 HydrophobicContact CD1-CG1 4.33Å; I22-I68 HydrophobicContact CD1-CG2 3.5Å; I22-I68 VanDerWaalsContact CD1-CG2 3.5Å; I22-I68 HydrophobicContact CG1-CD1 4.25Å; L64-I68 HydrophobicContact CG-CD1 4.46Å; L64-I68 WeakPolarHBondContact O-CG1 3.11Å; L64-I68 PolarHBondContact O-N 3.4Å; C65-I68 PolarHBondContact O-N 3.16Å; L66-I68 VanDerWaalsContact C-N 3.29Å; L66-I68 PolarHBondContact O-N 3.4Å; I68-L71 PolarHBondContact O-N 3.31Å; I68-D72 WeakPolarHBondContact O-CB 3.28Å; I68-D72 PolarHBondContact O-N 3.39Å
69	F	94	Very high	91.3	Very high	2 Å²	2	48.4 Å²	48.4	1%	0.009	26%	0.263	C	S	.	.	H	α-helix	trans	-67.1	-38.1	173.1	-66.6	-38	0	0	0	113	L19 I22 I23 V26 C65 L66 I67 D72 L73 Y94 I98 F127	L19-F69 HydrophobicContact CD1-CD1 3.98Å; L19-F69 HydrophobicContact CD1-CE1 3.86Å; I22-F69 HydrophobicContact CG2-CE1 4.05Å; I22-F69 HydrophobicContact CG2-CZ 3.88Å; I23-F69 HydrophobicContact CG1-CE1 3.94Å; I23-F69 HydrophobicContact CG1-CZ 3.97Å; V26-F69 HydrophobicContact CG2-CE2 4.12Å; V26-F69 HydrophobicContact CG2-CZ 4.36Å; C65-F69 HydrophobicContact CB-CE2 4.41Å; C65-F69 VanDerWaalsContact O-CD2 3.31Å; C65-F69 WeakPolarHBondContact O-CD2 3.42Å; C65-F69 WeakPolarHBondContact O-CG 3.38Å; C65-F69 PolarHBondContact O-N 3.33Å; L66-F69 HydrophobicContact CD2-CD2 4.45Å; L66-F69 PolarHBondContact O-N 3.48Å; I67-F69 VanDerWaalsContact C-N 3.32Å; I67-F69 PolarHBondContact O-N 3.19Å; F69-D72 PolarHBondContact O-N 3.32Å; F69-L73 WeakPolarHBondContact O-CB 3.29Å; F69-L73 PolarHBondContact O-N 2.99Å; F69-Y94 WeakPolarHBondContact CB-OH 3.5Å; F69-Y94 WeakPolarHBondContact CD1-OH 3.08Å; F69-I98 HydrophobicContact CB-CD1 4.06Å; F69-I98 HydrophobicContact CB-CG1 4.39Å; F69-F127 HydrophobicContact CD2-CD1 4.28Å; F69-F127 HydrophobicContact CD2-CD2 4.3Å; F69-F127 HydrophobicContact CD2-CE1 4.1Å; F69-F127 HydrophobicContact CD2-CE2 4.15Å; F69-F127 HydrophobicContact CD2-CG 4.37Å; F69-F127 HydrophobicContact CD2-CZ 4.04Å; F69-F127 HydrophobicContact CE2-CB 4.48Å; F69-F127 HydrophobicContact CE2-CD1 4.24Å; F69-F127 AromaticContact CE2-CD2 3.66Å; F69-F127 HydrophobicContact CE2-CD2 3.66Å; F69-F127 HydrophobicContact CE2-CE1 4.39Å; F69-F127 AromaticContact CE2-CE2 3.85Å; F69-F127 HydrophobicContact CE2-CE2 3.85Å; F69-F127 AromaticContact CE2-CG 3.87Å; F69-F127 HydrophobicContact CE2-CG 3.87Å; F69-F127 HydrophobicContact CE2-CZ 4.2Å; F69-F127 HydrophobicContact CZ-CB 4.11Å; F69-F127 HydrophobicContact CZ-CD2 4.11Å; F69-F127 AromaticContact CZ-CG 4Å; F69-F127 HydrophobicContact CZ-CG 4Å
70	C	93.4	Very high	90.9	Very high	52 Å²	52	51 Å²	51	35%	0.351	28%	0.276	S	S	.	.	H	α-helix	trans	-62.1	-43.2	172.2	-72	0	0	0	0	111.5	L66 I67 L73 A74 I98	L66-C70 PolarHBondContact O-N 3.48Å; L66-C70 PolarHBondContact O-SG 3.01Å; L66-C70 VanDerWaalsContact O-SG 3.35Å; I67-C70 WeakPolarHBondContact O-CB 3.34Å; I67-C70 PolarHBondContact O-N 2.87Å; C70-L73 PolarHBondContact O-N 3.16Å; C70-A74 WeakPolarHBondContact O-CB 3.23Å; C70-A74 PolarHBondContact O-N 3.43Å; C70-I98 VanDerWaalsContact SG-CG2 3.52Å
71	L	92.1	Very high	90.7	Very high	102 Å²	102	49.2 Å²	49.2	53%	0.534	27%	0.269	S	S	.	.	H	α-helix	trans	-63.6	-44.5	175.3	-70.3	172.4	0	0	0	111.8	I67 I68 L73 A74 V75	I67-L71 HydrophobicContact CG2-CD1 4.08Å; I67-L71 HydrophobicContact CG2-CG 4.46Å; I67-L71 WeakPolarHBondContact O-CG 3.43Å; I67-L71 PolarHBondContact O-N 3.38Å; I68-L71 PolarHBondContact O-N 3.31Å; L71-L73 PolarHBondContact O-N 3.31Å; L71-A74 PolarHBondContact O-N 3.23Å; L71-V75 WeakPolarHBondContact O-CB 3.29Å; L71-V75 VanDerWaalsContact O-CG2 3.25Å; L71-V75 WeakPolarHBondContact O-CG2 3.38Å; L71-V75 PolarHBondContact O-N 3.2Å
72	D	90.4	Very high	90.2	Very high	4 Å²	4	53.9 Å²	53.9	2%	0.021	28%	0.281	C	S	.	.	H	α-helix	trans	-60.4	-43.2	175.1	173.3	80	0	0	0	111.9	I68 F69 K76 Y94	I68-D72 WeakPolarHBondContact O-CB 3.28Å; I68-D72 PolarHBondContact O-N 3.39Å; F69-D72 PolarHBondContact O-N 3.32Å; D72-K76 VanDerWaalsContact CG-NZ 3.27Å; D72-K76 WeakPolarHBondContact O-CB 3.33Å; D72-K76 WeakPolarHBondContact O-CG 3.34Å; D72-K76 PolarHBondContact O-N 3.47Å; D72-K76 WeakPolarHBondContact OD1-CE 3.35Å; D72-K76 IonicContact OD1-NZ 2.73Å; D72-K76 PolarHBondContact OD1-NZ 3.07Å; D72-K76 VanDerWaalsContact OD1-NZ 3.07Å; D72-K76 VanDerWaalsContact OD2-CE 3.32Å; D72-K76 WeakPolarHBondContact OD2-CE 2.95Å; D72-K76 IonicContact OD2-NZ 2.98Å; D72-K76 PolarHBondContact OD2-NZ 3.48Å; D72-Y94 WeakPolarHBondContact OD2-CE1 3.37Å; D72-Y94 PolarHBondContact OD2-OH 3.02Å
73	L	90.8	Very high	90	Very high	23 Å²	23	60.9 Å²	60.9	12%	0.12	31%	0.314	C	S	.	.	H	α-helix	trans	-62.9	-44.6	175.2	179	66.3	0	0	0	111.6	F69 C70 L71 K76 S77 F85 Y94 T95 I98	F69-L73 WeakPolarHBondContact O-CB 3.29Å; F69-L73 PolarHBondContact O-N 2.99Å; C70-L73 PolarHBondContact O-N 3.16Å; L71-L73 PolarHBondContact O-N 3.31Å; L73-K76 PolarHBondContact O-N 3.26Å; L73-S77 VanDerWaalsContact O-CB 3.28Å; L73-S77 WeakPolarHBondContact O-CB 3.47Å; L73-S77 PolarHBondContact O-N 3.05Å; L73-F85 HydrophobicContact CD1-CE2 3.89Å; L73-F85 HydrophobicContact CD1-CZ 4.11Å; L73-Y94 HydrophobicContact CB-CD1 4.37Å; L73-Y94 HydrophobicContact CB-CE1 4.06Å; L73-Y94 HydrophobicContact CD1-CD1 3.76Å; L73-Y94 HydrophobicContact CD1-CE1 4.29Å; L73-T95 HydrophobicContact CD2-CG2 4.13Å; L73-I98 HydrophobicContact CB-CD1 4.14Å; L73-I98 HydrophobicContact CD2-CD1 3.99Å
74	A	90.9	Very high	89.5	Confident	58 Å²	58	60.1 Å²	60.1	48%	0.479	31%	0.309	S	S	.	.	H	α-helix	trans	-61.7	-46	178.9	0	0	0	0	0	111.5	C70 L71 S77 Y78	C70-A74 WeakPolarHBondContact O-CB 3.23Å; C70-A74 PolarHBondContact O-N 3.43Å; L71-A74 PolarHBondContact O-N 3.23Å; A74-S77 PolarHBondContact O-N 3.4Å; A74-Y78 WeakPolarHBondContact O-CB 3.26Å; A74-Y78 PolarHBondContact O-N 3.24Å
75	V	88.9	Confident	89.2	Confident	30 Å²	30	55.8 Å²	55.8	18%	0.182	29%	0.286	C	S	.	.	H	α-helix	trans	-61.2	-46.7	176.4	170.3	0	0	0	0	110.5	C13 L71 S77 Y78 L79	C13-V75 HydrophobicContact CB-CG1 4.4Å; L71-V75 WeakPolarHBondContact O-CB 3.29Å; L71-V75 VanDerWaalsContact O-CG2 3.25Å; L71-V75 WeakPolarHBondContact O-CG2 3.38Å; L71-V75 PolarHBondContact O-N 3.2Å; V75-S77 PolarHBondContact O-N 3.3Å; V75-Y78 PolarHBondContact O-N 3.34Å; V75-L79 HydrophobicContact CG1-CD1 3.52Å; V75-L79 WeakPolarHBondContact O-CB 3.47Å; V75-L79 VanDerWaalsContact O-CD1 3.29Å; V75-L79 WeakPolarHBondContact O-CD1 3.44Å; V75-L79 WeakPolarHBondContact O-CG 3.48Å; V75-L79 PolarHBondContact O-N 2.95Å
76	K	86.9	Confident	88.9	Confident	23 Å²	23	63.1 Å²	63.1	10%	0.1	31%	0.312	C	S	.	.	H	α-helix	trans	-63.4	-40.5	176.4	-76.9	172.2	-178.5	160.8	0	112.9	D72 L73 L79 I80 L91	D72-K76 VanDerWaalsContact CG-NZ 3.27Å; D72-K76 WeakPolarHBondContact O-CB 3.33Å; D72-K76 WeakPolarHBondContact O-CG 3.34Å; D72-K76 PolarHBondContact O-N 3.47Å; D72-K76 WeakPolarHBondContact OD1-CE 3.35Å; D72-K76 IonicContact OD1-NZ 2.73Å; D72-K76 PolarHBondContact OD1-NZ 3.07Å; D72-K76 VanDerWaalsContact OD1-NZ 3.07Å; D72-K76 VanDerWaalsContact OD2-CE 3.32Å; D72-K76 WeakPolarHBondContact OD2-CE 2.95Å; D72-K76 IonicContact OD2-NZ 2.98Å; D72-K76 PolarHBondContact OD2-NZ 3.48Å; L73-K76 PolarHBondContact O-N 3.26Å; K76-L79 PolarHBondContact O-N 3.24Å; K76-I80 HydrophobicContact CB-CD1 4.41Å; K76-I80 WeakPolarHBondContact O-CB 3.28Å; K76-I80 WeakPolarHBondContact O-CD1 3.31Å; K76-I80 VanDerWaalsContact O-CG1 3.29Å; K76-I80 WeakPolarHBondContact O-CG1 3.36Å; K76-I80 PolarHBondContact O-N 3.08Å; K76-L91 HydrophobicContact CD-CD2 4.42Å
77	S	87.8	Confident	88.6	Confident	29 Å²	29	69.2 Å²	69.2	20%	0.203	34%	0.338	C	S	.	.	H	α-helix	trans	-63.1	-44.6	178	-172.6	0	0	0	0	111.1	L73 A74 V75 G81	L73-S77 VanDerWaalsContact O-CB 3.28Å; L73-S77 WeakPolarHBondContact O-CB 3.47Å; L73-S77 PolarHBondContact O-N 3.05Å; A74-S77 PolarHBondContact O-N 3.4Å; V75-S77 PolarHBondContact O-N 3.3Å; S77-G81 PolarHBondContact O-N 3.42Å
78	Y	87.6	Confident	88.3	Confident	184 Å²	184	67.1 Å²	67.1	72%	0.722	33%	0.331	S	S	*	.	H	α-helix	trans	-63.3	-44.2	177	-177.3	-101.9	0	0	0	112.6	F10 A74 V75	F10-Y78 HydrophobicContact CZ-CE1 4.47Å; A74-Y78 WeakPolarHBondContact O-CB 3.26Å; A74-Y78 PolarHBondContact O-N 3.24Å; V75-Y78 PolarHBondContact O-N 3.34Å
79	L	84.4	Confident	88.2	Confident	52 Å²	52	73.3 Å²	73.3	27%	0.272	36%	0.357	S	S	.	.	H	α-helix	trans	-76.6	-33.3	-174.2	-76.3	156.2	0	0	0	114.7	I6 F10 V75 K76	I6-L79 HydrophobicContact CB-CD1 4.21Å; I6-L79 HydrophobicContact CD1-CB 4.17Å; I6-L79 HydrophobicContact CD1-CD1 3.83Å; I6-L79 HydrophobicContact CG1-CB 4.26Å; I6-L79 HydrophobicContact CG1-CD1 3.52Å; I6-L79 HydrophobicContact CG1-CD2 4.16Å; I6-L79 HydrophobicContact CG1-CG 4.18Å; I6-L79 HydrophobicContact CG2-CD1 3.77Å; F10-L79 HydrophobicContact CD2-CD2 4.09Å; F10-L79 HydrophobicContact CE2-CD2 4.01Å; V75-L79 HydrophobicContact CG1-CD1 3.52Å; V75-L79 WeakPolarHBondContact O-CB 3.47Å; V75-L79 VanDerWaalsContact O-CD1 3.29Å; V75-L79 WeakPolarHBondContact O-CD1 3.44Å; V75-L79 WeakPolarHBondContact O-CG 3.48Å; V75-L79 PolarHBondContact O-N 2.95Å; K76-L79 PolarHBondContact O-N 3.24Å
80	I	83.2	Confident	88	Confident	61 Å²	61	77 Å²	77	31%	0.313	37%	0.371	S	S	.	.	H	α-helix	trans	-82.8	-26	-177.5	-67	169.2	0	0	0	111	K76 E84 L91	K76-I80 HydrophobicContact CB-CD1 4.41Å; K76-I80 WeakPolarHBondContact O-CB 3.28Å; K76-I80 WeakPolarHBondContact O-CD1 3.31Å; K76-I80 VanDerWaalsContact O-CG1 3.29Å; K76-I80 WeakPolarHBondContact O-CG1 3.36Å; K76-I80 PolarHBondContact O-N 3.08Å; I80-E84 HydrophobicContact CG2-CB 3.59Å; I80-L91 HydrophobicContact CD1-CD1 3.64Å
81	G	85.6	Confident	87.9	Confident	31 Å²	31	75.1 Å²	75.1	32%	0.32	36%	0.357	S	S	.	.			trans	83.7	150.4	-172	0	0	0	0	0	112.3	S77 E83 F85	S77-G81 PolarHBondContact O-N 3.42Å; G81-E83 PolarHBondContact O-N 3.2Å; G81-F85 VanDerWaalsContact O-CB 3.31Å; G81-F85 WeakPolarHBondContact O-CB 3.37Å; G81-F85 PolarHBondContact O-N 2.76Å
82	W	84.2	Confident	87.9	Confident	150 Å²	150	73.8 Å²	73.8	57%	0.568	35%	0.349	S	S	*	.	H	α-helix	trans	-65.4	-35.6	-170.2	-173.3	-112.6	0	0	0	114.2	F85 R86	W82-F85 HydrophobicContact CE3-CD1 4.4Å; W82-F85 HydrophobicContact CZ3-CD1 4.3Å; W82-F85 HydrophobicContact CZ3-CE1 4.47Å; W82-F85 WeakPolarHBondContact O-CB 3.42Å; W82-F85 PolarHBondContact O-N 3.43Å; W82-R86 PolarHBondContact O-N 3Å
83	E	86.2	Confident	88.1	Confident	152 Å²	152	76 Å²	76	71%	0.71	37%	0.365	S	S	*	.	H	α-helix	trans	-68.3	-46.1	-179	-62.9	-167.8	167.8	0	0	112.2	G81 F85 R86 K87	G81-E83 PolarHBondContact O-N 3.2Å; E83-F85 VanDerWaalsContact C-N 3.34Å; E83-R86 PolarHBondContact O-N 2.93Å; E83-K87 PolarHBondContact O-N 2.93Å
84	E	83.4	Confident	88.2	Confident	57 Å²	57	75.1 Å²	75.1	27%	0.266	36%	0.361	S	S	.	.	H	α-helix	trans	-71.5	-31.1	177	-72.9	-56.9	139.3	0	0	111.9	I80 R86 K87 S88 H679	I80-E84 HydrophobicContact CG2-CB 3.59Å; E84-R86 VanDerWaalsContact C-N 3.33Å; E84-R86 PolarHBondContact O-N 3.28Å; E84-K87 PolarHBondContact O-N 3.39Å; E84-K87 IonicContact OE1-NZ 3.54Å; E84-K87 PolarHBondContact OE1-NZ 3.3Å; E84-S88 PolarHBondContact O-N 2.84Å; E84-H679 IonicContact OE1-CE1 2.8Å
85	F	87.1	Confident	88.3	Confident	15 Å²	15	74.4 Å²	74.4	7%	0.066	35%	0.35	C	S	.	.	H	α-helix	trans	-57.2	-45.8	172.4	-177.4	-89.6	0	0	0	111.8	L73 G81 W82 E83 K87 S88 L91 T95	L73-F85 HydrophobicContact CD1-CE2 3.89Å; L73-F85 HydrophobicContact CD1-CZ 4.11Å; G81-F85 VanDerWaalsContact O-CB 3.31Å; G81-F85 WeakPolarHBondContact O-CB 3.37Å; G81-F85 PolarHBondContact O-N 2.76Å; W82-F85 HydrophobicContact CE3-CD1 4.4Å; W82-F85 HydrophobicContact CZ3-CD1 4.3Å; W82-F85 HydrophobicContact CZ3-CE1 4.47Å; W82-F85 WeakPolarHBondContact O-CB 3.42Å; W82-F85 PolarHBondContact O-N 3.43Å; E83-F85 VanDerWaalsContact C-N 3.34Å; F85-K87 VanDerWaalsContact C-N 3.31Å; F85-K87 PolarHBondContact O-N 3.01Å; F85-S88 PolarHBondContact O-N 3.49Å; F85-L91 HydrophobicContact CD2-CB 3.97Å; F85-L91 HydrophobicContact CD2-CD1 3.78Å; F85-L91 HydrophobicContact CD2-CG 4.38Å; F85-L91 HydrophobicContact CE2-CB 3.73Å; F85-L91 HydrophobicContact CE2-CD1 4.24Å; F85-L91 HydrophobicContact CE2-CG 4.38Å; F85-L91 HydrophobicContact CZ-CB 4.2Å; F85-T95 WeakPolarHBondContact CZ-OG1 3.49Å
86	R	88.1	Confident	88.6	Confident	164 Å²	164	76.6 Å²	76.6	62%	0.619	36%	0.363	S	S	*	.	H	α-helix	trans	-68.6	-24.3	178.1	-79.9	-176.6	170.1	175.2	-3.3	114	W82 E83 E84 I92	W82-R86 PolarHBondContact O-N 3Å; E83-R86 PolarHBondContact O-N 2.93Å; E84-R86 VanDerWaalsContact C-N 3.33Å; E84-R86 PolarHBondContact O-N 3.28Å; R86-I92 WeakPolarHBondContact O-CD1 3.25Å
87	K	88.1	Confident	89.1	Confident	138 Å²	138	76.2 Å²	76.2	60%	0.6	36%	0.363	S	S	*	.	H	α-helix	trans	-75.7	-27.9	174.3	-67.3	178.3	-169	165	0	112.1	E83 E84 F85 K89	E83-K87 PolarHBondContact O-N 2.93Å; E84-K87 PolarHBondContact O-N 3.39Å; E84-K87 IonicContact OE1-NZ 3.54Å; E84-K87 PolarHBondContact OE1-NZ 3.3Å; F85-K87 VanDerWaalsContact C-N 3.31Å; F85-K87 PolarHBondContact O-N 3.01Å; K87-K89 PolarHBondContact O-N 3.36Å
88	S	86.9	Confident	89.4	Confident	41 Å²	41	75.2 Å²	75.2	29%	0.287	36%	0.355	S	S	.	.			trans	-83.3	98.4	-176.4	-174.5	0	0	0	0	112.7	E84 F85 W90 L91 I92	E84-S88 PolarHBondContact O-N 2.84Å; F85-S88 PolarHBondContact O-N 3.49Å; S88-W90 PolarHBondContact O-N 2.79Å; S88-W90 VanDerWaalsContact O-N 3.1Å; S88-L91 PolarHBondContact O-N 3.22Å; S88-I92 PolarHBondContact O-N 3Å
89	K	91.4	Very high	89.8	Confident	172 Å²	172	69.8 Å²	69.8	75%	0.748	34%	0.344	S	S	*	.	H	α-helix	trans	-51.9	-35.2	175.3	-63.3	-174.9	-179.7	-176.5	0	113.3	K87 I92 S93	K87-K89 PolarHBondContact O-N 3.36Å; K89-I92 PolarHBondContact O-N 2.83Å; K89-S93 WeakPolarHBondContact O-CB 3.45Å; K89-S93 PolarHBondContact O-N 3.34Å; K89-S93 PolarHBondContact O-OG 3.09Å; K89-S93 VanDerWaalsContact O-OG 3.11Å
90	W	91	Very high	90.3	Very high	79 Å²	79	70.8 Å²	70.8	30%	0.299	35%	0.348	S	S	.	.	H	α-helix	trans	-66.8	-35.3	178.7	-79.8	103.9	0	0	0	113.5	S88 Y94 F126 L129 Q130 K136 L139	S88-W90 PolarHBondContact O-N 2.79Å; S88-W90 VanDerWaalsContact O-N 3.1Å; W90-Y94 WeakPolarHBondContact O-CB 3.4Å; W90-Y94 PolarHBondContact O-N 3.5Å; W90-F126 HydrophobicContact CE3-CE2 4.1Å; W90-F126 AromaticContact CE3-CZ 3.93Å; W90-F126 HydrophobicContact CE3-CZ 3.93Å; W90-F126 AromaticContact CZ3-CE2 3.83Å; W90-F126 HydrophobicContact CZ3-CE2 3.83Å; W90-F126 HydrophobicContact CZ3-CZ 4.12Å; W90-L129 HydrophobicContact CZ3-CB 4.3Å; W90-Q130 VanDerWaalsContact CE3-OE1 3.29Å; W90-Q130 PolarHBondContact O-NE2 3.44Å; W90-Q130 VanDerWaalsContact O-NE2 3.16Å; W90-Q130 PolarHBondContact O-OE1 3.48Å; W90-K136 HydrophobicContact CD2-CD 3.85Å; W90-K136 HydrophobicContact CD2-CG 4.21Å; W90-K136 HydrophobicContact CE3-CD 4.28Å; W90-K136 HydrophobicContact CE3-CG 4.42Å; W90-K136 HydrophobicContact CG-CD 4.2Å; W90-K136 HydrophobicContact CH2-CG 3.85Å; W90-K136 HydrophobicContact CZ2-CB 3.95Å; W90-K136 HydrophobicContact CZ2-CD 4.14Å; W90-K136 HydrophobicContact CZ2-CG 3.6Å; W90-K136 HydrophobicContact CZ3-CG 4.25Å; W90-L139 HydrophobicContact CH2-CD2 4.13Å
91	L	90.6	Very high	90.8	Very high	13 Å²	13	68 Å²	68	7%	0.068	33%	0.334	C	S	.	.	H	α-helix	trans	-76.6	-36.5	177.9	-69.8	172.3	0	0	0	111.4	K76 I80 F85 S88 Y94 T95	K76-L91 HydrophobicContact CD-CD2 4.42Å; I80-L91 HydrophobicContact CD1-CD1 3.64Å; F85-L91 HydrophobicContact CD2-CB 3.97Å; F85-L91 HydrophobicContact CD2-CD1 3.78Å; F85-L91 HydrophobicContact CD2-CG 4.38Å; F85-L91 HydrophobicContact CE2-CB 3.73Å; F85-L91 HydrophobicContact CE2-CD1 4.24Å; F85-L91 HydrophobicContact CE2-CG 4.38Å; F85-L91 HydrophobicContact CZ-CB 4.2Å; S88-L91 PolarHBondContact O-N 3.22Å; L91-Y94 PolarHBondContact O-N 3.31Å; L91-T95 PolarHBondContact O-N 3.36Å; L91-T95 PolarHBondContact O-OG1 3.15Å
92	I	93.3	Very high	91.2	Very high	73 Å²	73	68.8 Å²	68.8	37%	0.374	33%	0.333	S	S	.	.	H	α-helix	trans	-61.2	-51.7	172.1	-64.4	169.8	0	0	0	110.1	R86 S88 K89 Y94 T95 V96	R86-I92 WeakPolarHBondContact O-CD1 3.25Å; S88-I92 PolarHBondContact O-N 3Å; K89-I92 PolarHBondContact O-N 2.83Å; I92-Y94 PolarHBondContact O-N 3.44Å; I92-T95 WeakPolarHBondContact O-CB 3.25Å; I92-T95 PolarHBondContact O-N 3.26Å; I92-T95 VanDerWaalsContact O-N 3.1Å; I92-V96 WeakPolarHBondContact O-CG2 3.5Å; I92-V96 PolarHBondContact O-N 3.16Å
93	S	92.9	Very high	91.6	Very high	51 Å²	51	65.9 Å²	65.9	36%	0.357	33%	0.331	S	S	.	.	H	α-helix	trans	-59.1	-36.5	176.3	-63.8	0	0	0	0	112.3	K89 V96 V97	K89-S93 WeakPolarHBondContact O-CB 3.45Å; K89-S93 PolarHBondContact O-N 3.34Å; K89-S93 PolarHBondContact O-OG 3.09Å; K89-S93 VanDerWaalsContact O-OG 3.11Å; S93-V96 PolarHBondContact O-N 2.97Å; S93-V97 WeakPolarHBondContact O-CB 3.3Å; S93-V97 VanDerWaalsContact O-CG2 3.31Å; S93-V97 WeakPolarHBondContact O-CG2 3.4Å; S93-V97 PolarHBondContact O-N 2.68Å
94	Y	94	Very high	91.9	Very high	5 Å²	5	59.1 Å²	59.1	2%	0.02	30%	0.3	C	S	.	.	H	α-helix	trans	-64.4	-40	175.7	-172.3	-143.8	0	0	0	112.7	F69 D72 L73 W90 L91 I92 V97 I98 F126 F127 Q130	F69-Y94 WeakPolarHBondContact CB-OH 3.5Å; F69-Y94 WeakPolarHBondContact CD1-OH 3.08Å; D72-Y94 WeakPolarHBondContact OD2-CE1 3.37Å; D72-Y94 PolarHBondContact OD2-OH 3.02Å; L73-Y94 HydrophobicContact CB-CD1 4.37Å; L73-Y94 HydrophobicContact CB-CE1 4.06Å; L73-Y94 HydrophobicContact CD1-CD1 3.76Å; L73-Y94 HydrophobicContact CD1-CE1 4.29Å; W90-Y94 WeakPolarHBondContact O-CB 3.4Å; W90-Y94 PolarHBondContact O-N 3.5Å; L91-Y94 PolarHBondContact O-N 3.31Å; I92-Y94 PolarHBondContact O-N 3.44Å; Y94-V97 PolarHBondContact O-N 3.28Å; Y94-I98 HydrophobicContact CD1-CD1 4.31Å; Y94-I98 HydrophobicContact CD2-CD1 3.9Å; Y94-I98 HydrophobicContact CD2-CG1 4.2Å; Y94-I98 HydrophobicContact CE1-CD1 4.02Å; Y94-I98 HydrophobicContact CE2-CD1 3.54Å; Y94-I98 HydrophobicContact CE2-CG1 3.96Å; Y94-I98 HydrophobicContact CG-CD1 4.27Å; Y94-I98 WeakPolarHBondContact O-CG1 3.34Å; Y94-I98 PolarHBondContact O-N 2.84Å; Y94-F126 HydrophobicContact CD2-CE1 4.25Å; Y94-F127 HydrophobicContact CD2-CD1 4.11Å; Y94-F127 HydrophobicContact CD2-CE1 4.17Å; Y94-F127 AromaticContact CE2-CD1 3.54Å; Y94-F127 HydrophobicContact CE2-CD1 3.54Å; Y94-F127 AromaticContact CE2-CE1 3.69Å; Y94-F127 HydrophobicContact CE2-CE1 3.69Å; Y94-Q130 HydrophobicContact CD1-CG 4.16Å; Y94-Q130 HydrophobicContact CD2-CG 4.04Å; Y94-Q130 HydrophobicContact CE2-CG 4.49Å; Y94-Q130 HydrophobicContact CG-CG 3.87Å
95	T	93.7	Very high	92.3	Very high	42 Å²	42	58.6 Å²	58.6	26%	0.258	30%	0.296	S	S	.	.	H	α-helix	trans	-62.8	-47.8	174.6	-50.4	0	0	0	0	110.9	L73 F85 L91 I92 V97 I98 C99	L73-T95 HydrophobicContact CD2-CG2 4.13Å; F85-T95 WeakPolarHBondContact CZ-OG1 3.49Å; L91-T95 PolarHBondContact O-N 3.36Å; L91-T95 PolarHBondContact O-OG1 3.15Å; I92-T95 WeakPolarHBondContact O-CB 3.25Å; I92-T95 PolarHBondContact O-N 3.26Å; I92-T95 VanDerWaalsContact O-N 3.1Å; T95-V97 PolarHBondContact O-N 3Å; T95-I98 PolarHBondContact O-N 3.43Å; T95-C99 PolarHBondContact O-N 3.2Å; T95-C99 PolarHBondContact O-SG 3.2Å
96	V	95.1	Very high	92.5	Very high	76 Å²	76	63 Å²	63	46%	0.461	32%	0.318	S	S	.	.	H	α-helix	trans	-60.1	-45.1	178.6	173.2	0	0	0	0	111.5	I92 S93 C99 I100	I92-V96 WeakPolarHBondContact O-CG2 3.5Å; I92-V96 PolarHBondContact O-N 3.16Å; S93-V96 PolarHBondContact O-N 2.97Å; V96-C99 PolarHBondContact O-N 3.37Å; V96-I100 HydrophobicContact CG1-CD1 3.82Å; V96-I100 HydrophobicContact CG1-CG1 4.48Å; V96-I100 WeakPolarHBondContact O-CG1 3.43Å; V96-I100 PolarHBondContact O-N 3.42Å
97	V	95.8	Very high	92.7	Very high	16 Å²	16	59 Å²	59	10%	0.097	31%	0.308	C	S	.	.	H	α-helix	trans	-62.7	-45.3	178.7	167.2	0	0	0	0	111.3	S93 Y94 T95 C99 I100 S101 V123 F126 F127	S93-V97 WeakPolarHBondContact O-CB 3.3Å; S93-V97 VanDerWaalsContact O-CG2 3.31Å; S93-V97 WeakPolarHBondContact O-CG2 3.4Å; S93-V97 PolarHBondContact O-N 2.68Å; Y94-V97 PolarHBondContact O-N 3.28Å; T95-V97 PolarHBondContact O-N 3Å; V97-C99 VanDerWaalsContact C-N 3.34Å; V97-C99 PolarHBondContact O-N 3.26Å; V97-I100 PolarHBondContact O-N 3.46Å; V97-S101 PolarHBondContact O-N 2.7Å; V97-S101 PolarHBondContact O-OG 3.31Å; V97-S101 VanDerWaalsContact O-OG 3.06Å; V97-V123 HydrophobicContact CG1-CB 3.93Å; V97-V123 HydrophobicContact CG1-CG2 4.03Å; V97-F126 HydrophobicContact CB-CD1 4.07Å; V97-F126 HydrophobicContact CG1-CB 4.41Å; V97-F126 HydrophobicContact CG1-CD1 4.15Å; V97-F126 HydrophobicContact CG2-CB 4.35Å; V97-F126 HydrophobicContact CG2-CD1 3.77Å; V97-F126 HydrophobicContact CG2-CE1 4.24Å; V97-F126 HydrophobicContact CG2-CG 3.94Å; V97-F127 HydrophobicContact CG1-CE1 3.72Å; V97-F127 HydrophobicContact CG1-CZ 3.79Å
98	I	95.3	Very high	92.7	Very high	8 Å²	8	52.4 Å²	52.4	4%	0.041	28%	0.279	C	S	.	.	H	α-helix	trans	-60.6	-44.8	176	-71.2	168.6	0	0	0	110.7	F69 C70 L73 Y94 T95 I100 S101 V102 F127	F69-I98 HydrophobicContact CB-CD1 4.06Å; F69-I98 HydrophobicContact CB-CG1 4.39Å; C70-I98 VanDerWaalsContact SG-CG2 3.52Å; L73-I98 HydrophobicContact CB-CD1 4.14Å; L73-I98 HydrophobicContact CD2-CD1 3.99Å; Y94-I98 HydrophobicContact CD1-CD1 4.31Å; Y94-I98 HydrophobicContact CD2-CD1 3.9Å; Y94-I98 HydrophobicContact CD2-CG1 4.2Å; Y94-I98 HydrophobicContact CE1-CD1 4.02Å; Y94-I98 HydrophobicContact CE2-CD1 3.54Å; Y94-I98 HydrophobicContact CE2-CG1 3.96Å; Y94-I98 HydrophobicContact CG-CD1 4.27Å; Y94-I98 WeakPolarHBondContact O-CG1 3.34Å; Y94-I98 PolarHBondContact O-N 2.84Å; T95-I98 PolarHBondContact O-N 3.43Å; I98-I100 PolarHBondContact O-N 3.49Å; I98-S101 PolarHBondContact O-N 2.95Å; I98-V102 HydrophobicContact CG2-CG2 4.26Å; I98-V102 VanDerWaalsContact O-CG2 3.32Å; I98-V102 WeakPolarHBondContact O-CG2 3.22Å; I98-V102 PolarHBondContact O-N 2.94Å; I98-F127 HydrophobicContact CG1-CE1 4.06Å
99	C	94.8	Very high	92.8	Very high	70 Å²	70	53.8 Å²	53.8	47%	0.473	29%	0.286	S	S	.	.	H	α-helix	trans	-59.3	-46.9	177.8	-69.5	0	0	0	0	112.1	T95 V96 V97 S101 V102 V103	T95-C99 PolarHBondContact O-N 3.2Å; T95-C99 PolarHBondContact O-SG 3.2Å; V96-C99 PolarHBondContact O-N 3.37Å; V97-C99 VanDerWaalsContact C-N 3.34Å; V97-C99 PolarHBondContact O-N 3.26Å; C99-S101 VanDerWaalsContact C-N 3.35Å; C99-S101 PolarHBondContact O-N 2.92Å; C99-V102 PolarHBondContact O-N 3.28Å; C99-V103 WeakPolarHBondContact O-CG2 3.39Å; C99-V103 PolarHBondContact O-N 3.07Å
100	I	95	Very high	92.7	Very high	73 Å²	73	50.3 Å²	50.3	37%	0.374	28%	0.284	S	S	.	.	H	α-helix	trans	-60.4	-45.3	176.7	-67.9	167.6	0	0	0	110.5	V96 V97 I98 V102 V103 D104 V119	V96-I100 HydrophobicContact CG1-CD1 3.82Å; V96-I100 HydrophobicContact CG1-CG1 4.48Å; V96-I100 WeakPolarHBondContact O-CG1 3.43Å; V96-I100 PolarHBondContact O-N 3.42Å; V97-I100 PolarHBondContact O-N 3.46Å; I98-I100 PolarHBondContact O-N 3.49Å; I100-V102 PolarHBondContact O-N 3.45Å; I100-V103 PolarHBondContact O-N 2.88Å; I100-D104 WeakPolarHBondContact O-CB 3.43Å; I100-D104 PolarHBondContact O-N 3.35Å; I100-V119 HydrophobicContact CG2-CG1 4.47Å
101	S	94.3	Very high	92.6	Very high	1 Å²	1	51.6 Å²	51.6	1%	0.007	29%	0.294	C	S	.	.	H	α-helix	trans	-64.2	-36.8	179.1	-61	0	0	0	0	113.3	V97 I98 C99 W105 V123	V97-S101 PolarHBondContact O-N 2.7Å; V97-S101 PolarHBondContact O-OG 3.31Å; V97-S101 VanDerWaalsContact O-OG 3.06Å; I98-S101 PolarHBondContact O-N 2.95Å; C99-S101 VanDerWaalsContact C-N 3.35Å; C99-S101 PolarHBondContact O-N 2.92Å; S101-W105 VanDerWaalsContact O-CB 3.26Å; S101-W105 WeakPolarHBondContact O-CB 3.38Å; S101-W105 PolarHBondContact O-N 3.33Å; S101-V123 WeakPolarHBondContact OG-CG2 3.37Å
102	V	94.3	Very high	92.3	Very high	48 Å²	48	59 Å²	59	29%	0.291	33%	0.328	S	S	.	.	H	α-helix	trans	-68.8	-42.4	176.5	170.7	0	0	0	0	111	L66 I98 C99 I100 W105 M106	L66-V102 HydrophobicContact CD1-CG2 4.48Å; I98-V102 HydrophobicContact CG2-CG2 4.26Å; I98-V102 VanDerWaalsContact O-CG2 3.32Å; I98-V102 WeakPolarHBondContact O-CG2 3.22Å; I98-V102 PolarHBondContact O-N 2.94Å; C99-V102 PolarHBondContact O-N 3.28Å; I100-V102 PolarHBondContact O-N 3.45Å; V102-W105 PolarHBondContact O-N 2.89Å; V102-M106 HydrophobicContact CG1-CE 4.49Å; V102-M106 VanDerWaalsContact O-CG 3.24Å; V102-M106 WeakPolarHBondContact O-CG 3.31Å; V102-M106 PolarHBondContact O-N 3.47Å
103	V	93.4	Very high	91.8	Very high	89 Å²	89	56.1 Å²	56.1	54%	0.539	31%	0.314	S	S	.	.	H	α-helix	trans	-63.5	-47.9	177.2	172.9	0	0	0	0	110.9	C99 I100 W105 M106 L107	C99-V103 WeakPolarHBondContact O-CG2 3.39Å; C99-V103 PolarHBondContact O-N 3.07Å; I100-V103 PolarHBondContact O-N 2.88Å; V103-W105 VanDerWaalsContact C-N 3.32Å; V103-W105 PolarHBondContact O-N 2.82Å; V103-M106 PolarHBondContact O-N 3.48Å; V103-L107 HydrophobicContact CG1-CD1 4.18Å; V103-L107 WeakPolarHBondContact O-CG 3.34Å; V103-L107 PolarHBondContact O-N 3.48Å
104	D	92.6	Very high	91.2	Very high	11 Å²	11	59.7 Å²	59.7	6%	0.059	33%	0.33	C	S	.	.	H	α-helix	trans	-62	-39	177.6	-165.3	79.6	0	0	0	111.6	I100 L107 S108 V119 R120	I100-D104 WeakPolarHBondContact O-CB 3.43Å; I100-D104 PolarHBondContact O-N 3.35Å; D104-L107 PolarHBondContact O-N 3.1Å; D104-S108 WeakPolarHBondContact O-CB 3.4Å; D104-S108 PolarHBondContact O-N 2.97Å; D104-V119 PolarHBondContact OD1-N 2.94Å; D104-V119 PolarHBondContact OD2-N 3.36Å; D104-R120 HydrophobicContact CB-CB 4.15Å; D104-R120 WeakPolarHBondContact OD2-CB 3.44Å; D104-R120 WeakPolarHBondContact OD2-CD 3.37Å; D104-R120 WeakPolarHBondContact OD2-CG 3.42Å; D104-R120 IonicContact OD2-CZ 2.7Å; D104-R120 PolarHBondContact OD2-N 3.24Å; D104-R120 IonicContact OD2-NE 2.97Å; D104-R120 IonicContact OD2-NH1 3.73Å; D104-R120 PolarHBondContact OD2-NH1 3.41Å
105	W	91.8	Very high	90.5	Very high	45 Å²	45	61 Å²	61	17%	0.17	34%	0.336	C	S	.	.	H	α-helix	trans	-62.8	-45.5	174	-179.9	86.5	0	0	0	112.3	E59 M63 L66 S101 V102 V103 L107 S108 V109	E59-W105 PolarHBondContact O-NE1 3.21Å; M63-W105 HydrophobicContact CB-CH2 4.48Å; M63-W105 HydrophobicContact CB-CZ2 3.63Å; M63-W105 HydrophobicContact CG-CH2 3.85Å; M63-W105 HydrophobicContact CG-CZ2 3.49Å; M63-W105 VanDerWaalsContact CG-CZ2 3.49Å; L66-W105 HydrophobicContact CD1-CB 4.24Å; L66-W105 HydrophobicContact CD1-CG 4.45Å; S101-W105 VanDerWaalsContact O-CB 3.26Å; S101-W105 WeakPolarHBondContact O-CB 3.38Å; S101-W105 PolarHBondContact O-N 3.33Å; V102-W105 PolarHBondContact O-N 2.89Å; V103-W105 VanDerWaalsContact C-N 3.32Å; V103-W105 PolarHBondContact O-N 2.82Å; W105-L107 VanDerWaalsContact C-N 3.31Å; W105-L107 PolarHBondContact O-N 3.01Å; W105-S108 PolarHBondContact O-N 3.48Å; W105-V109 HydrophobicContact CD2-CG2 4.15Å; W105-V109 HydrophobicContact CH2-CG2 4.23Å; W105-V109 HydrophobicContact CZ2-CG2 3.81Å; W105-V109 WeakPolarHBondContact O-CG2 3.49Å; W105-V109 PolarHBondContact O-N 3.09Å
106	M	91.1	Very high	89.7	Confident	108 Å²	108	67.8 Å²	67.8	53%	0.532	36%	0.362	S	S	.	.	H	α-helix	trans	-60.6	-41.3	176.9	-69.7	-71.2	177.3	0	0	111.7	V102 V103 S110	V102-M106 HydrophobicContact CG1-CE 4.49Å; V102-M106 VanDerWaalsContact O-CG 3.24Å; V102-M106 WeakPolarHBondContact O-CG 3.31Å; V102-M106 PolarHBondContact O-N 3.47Å; V103-M106 PolarHBondContact O-N 3.48Å; M106-S110 WeakPolarHBondContact O-CB 3.3Å; M106-S110 PolarHBondContact O-N 2.93Å
107	L	91.3	Very high	89	Confident	79 Å²	79	69.1 Å²	69.1	41%	0.414	37%	0.366	S	S	.	.	H	α-helix	trans	-62.9	-46.9	175.3	-70.4	170.9	0	0	0	111.4	V103 D104 W105 V109 S110 M111	V103-L107 HydrophobicContact CG1-CD1 4.18Å; V103-L107 WeakPolarHBondContact O-CG 3.34Å; V103-L107 PolarHBondContact O-N 3.48Å; D104-L107 PolarHBondContact O-N 3.1Å; W105-L107 VanDerWaalsContact C-N 3.31Å; W105-L107 PolarHBondContact O-N 3.01Å; L107-V109 VanDerWaalsContact C-N 3.33Å; L107-V109 PolarHBondContact O-N 3.28Å; L107-S110 PolarHBondContact O-N 3.47Å; L107-S110 VanDerWaalsContact O-N 3.15Å; L107-M111 WeakPolarHBondContact O-CG 3.37Å; L107-M111 PolarHBondContact O-N 3.43Å
108	S	88.7	Confident	88.6	Confident	0 Å²	0	68.8 Å²	68.8	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-60.5	-41.6	-179.7	-142.6	0	0	0	0	112.6	D104 W105 M111 C113 E115 R120	D104-S108 WeakPolarHBondContact O-CB 3.4Å; D104-S108 PolarHBondContact O-N 2.97Å; W105-S108 PolarHBondContact O-N 3.48Å; S108-M111 PolarHBondContact O-N 3.25Å; S108-C113 WeakPolarHBondContact O-CA 3.29Å; S108-C113 PolarHBondContact O-N 3.15Å; S108-E115 VanDerWaalsContact CB-OE2 3.29Å; S108-E115 WeakPolarHBondContact CB-OE2 3.39Å; S108-E115 PolarHBondContact OG-OE2 3.41Å; S108-R120 PolarHBondContact OG-NH1 3.36Å; S108-R120 PolarHBondContact OG-NH2 3.47Å
109	V	88.4	Confident	88.3	Confident	70 Å²	70	71.7 Å²	71.7	42%	0.424	38%	0.381	S	S	.	.	H	α-helix	trans	-68.9	-40.4	175.5	174	0	0	0	0	111.1	W105 L107 M111 E112	W105-V109 HydrophobicContact CD2-CG2 4.15Å; W105-V109 HydrophobicContact CH2-CG2 4.23Å; W105-V109 HydrophobicContact CZ2-CG2 3.81Å; W105-V109 WeakPolarHBondContact O-CG2 3.49Å; W105-V109 PolarHBondContact O-N 3.09Å; L107-V109 VanDerWaalsContact C-N 3.33Å; L107-V109 PolarHBondContact O-N 3.28Å; V109-M111 PolarHBondContact O-N 3.21Å; V109-E112 PolarHBondContact O-N 3.4Å
110	S	89.8	Confident	88	Confident	100 Å²	100	68.3 Å²	68.3	70%	0.699	36%	0.358	S	S	*	.	H	α-helix	trans	-65.6	-25.4	178.1	-173.5	0	0	0	0	113.5	M106 L107	M106-S110 WeakPolarHBondContact O-CB 3.3Å; M106-S110 PolarHBondContact O-N 2.93Å; L107-S110 PolarHBondContact O-N 3.47Å; L107-S110 VanDerWaalsContact O-N 3.15Å
111	M	87.8	Confident	87.9	Confident	105 Å²	105	65.9 Å²	65.9	52%	0.517	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.4	20.7	178.3	-64.6	-170.4	-178.9	0	0	113.1	L107 S108 V109 C113 D114	L107-M111 WeakPolarHBondContact O-CG 3.37Å; L107-M111 PolarHBondContact O-N 3.43Å; S108-M111 PolarHBondContact O-N 3.25Å; V109-M111 PolarHBondContact O-N 3.21Å; M111-C113 PolarHBondContact O-N 2.6Å; M111-D114 PolarHBondContact O-N 2.78Å
112	E	85.9	Confident	87.8	Confident	169 Å²	169	68.5 Å²	68.5	79%	0.79	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.8	32.7	179.3	-60	-176.4	172.8	0	0	113.6	V109 D114	V109-E112 PolarHBondContact O-N 3.4Å; E112-D114 VanDerWaalsContact C-N 3.3Å; E112-D114 PolarHBondContact O-N 2.89Å
113	C	81.2	Confident	87.7	Confident	12 Å²	12	67.6 Å²	67.6	8%	0.081	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	67.2	15.4	-178.9	-51.3	0	0	0	0	116.2	C55 S108 M111 E115 R118	C55-C113 HydrophobicContact CB-CB 4.07Å; S108-C113 WeakPolarHBondContact O-CA 3.29Å; S108-C113 PolarHBondContact O-N 3.15Å; M111-C113 PolarHBondContact O-N 2.6Å; C113-E115 VanDerWaalsContact C-N 3.26Å; C113-E115 PolarHBondContact O-N 3.41Å; C113-R118 PolarHBondContact O-NH2 2.97Å
114	D	81.1	Confident	87.7	Confident	126 Å²	126	63.4 Å²	63.4	67%	0.674	33%	0.327	S	S	*	.			trans	-87.6	15.7	177.8	-161.4	30	0	0	0	114.2	M111 E112 K116	M111-D114 PolarHBondContact O-N 2.78Å; E112-D114 VanDerWaalsContact C-N 3.3Å; E112-D114 PolarHBondContact O-N 2.89Å; D114-K116 PolarHBondContact O-N 3.39Å
115	E	80.1	Confident	87.9	Confident	32 Å²	32	63 Å²	63	15%	0.15	33%	0.325	C	S	.	.			trans	-75.9	113.3	177	-176.4	-179.2	-142.3	0	0	111.3	S108 C113 L117 R118 R120	S108-E115 VanDerWaalsContact CB-OE2 3.29Å; S108-E115 WeakPolarHBondContact CB-OE2 3.39Å; S108-E115 PolarHBondContact OG-OE2 3.41Å; C113-E115 VanDerWaalsContact C-N 3.26Å; C113-E115 PolarHBondContact O-N 3.41Å; E115-L117 WeakPolarHBondContact CG-O 3.37Å; E115-R118 HydrophobicContact CG-CG 4.41Å; E115-R120 IonicContact OE2-NH1 3.55Å; E115-R120 PolarHBondContact OE2-NH1 3.03Å
116	K	75.2	Confident	88	Confident	185 Å²	185	62.6 Å²	62.6	80%	0.804	32%	0.324	S	S	*	.	S	Bend	trans	-70.1	-35	176.7	-65.4	-176.1	179.1	-178.8	0	113.3	D114	D114-K116 PolarHBondContact O-N 3.39Å
117	L	81.1	Confident	88.1	Confident	105 Å²	105	57.8 Å²	57.8	55%	0.55	30%	0.301	S	S	.	.			trans	-111.7	97	-175.2	-69.6	171.8	0	0	0	110.9	E115 W528	E115-L117 WeakPolarHBondContact CG-O 3.37Å; L117-W528 HydrophobicContact CD2-CB 4.34Å; L117-W528 HydrophobicContact CD2-CD2 4.4Å; L117-W528 HydrophobicContact CD2-CG 4.08Å
118	R	86.6	Confident	88.2	Confident	9 Å²	9	56 Å²	56	3%	0.034	29%	0.291	C	S	.	.			trans	-96.9	92.5	-179.1	-62.8	175.7	-178.6	-150.6	-5.6	111.2	E33 E59 C113 E115 R120 R121 W528	E33-R118 IonicContact OE2-NH1 3.87Å; E59-R118 IonicContact OE1-CZ 2.86Å; E59-R118 IonicContact OE1-NH1 3.89Å; E59-R118 PolarHBondContact OE1-NH1 2.96Å; E59-R118 IonicContact OE1-NH2 3.83Å; E59-R118 PolarHBondContact OE1-NH2 3.09Å; E59-R118 VanDerWaalsContact OE1-NH2 3.16Å; C113-R118 PolarHBondContact O-NH2 2.97Å; E115-R118 HydrophobicContact CG-CG 4.41Å; R118-R120 HydrophobicContact CB-CG 4.47Å; R118-R120 PolarHBondContact O-N 3.07Å; R118-R120 VanDerWaalsContact O-N 3.16Å; R118-R121 HydrophobicContact CB-CG 4.24Å; R118-R121 PolarHBondContact O-N 2.84Å; R118-W528 WeakPolarHBondContact O-CZ2 3.38Å
119	V	88.9	Confident	88.4	Confident	68 Å²	68	57 Å²	57	41%	0.412	30%	0.296	S	S	.	.	H	α-helix	trans	-60.6	-30.1	-174.1	179.8	0	0	0	0	111.8	I100 D104 R121 L122	I100-V119 HydrophobicContact CG2-CG1 4.47Å; D104-V119 PolarHBondContact OD1-N 2.94Å; D104-V119 PolarHBondContact OD2-N 3.36Å; V119-R121 PolarHBondContact O-N 3.13Å; V119-R121 VanDerWaalsContact O-N 3.11Å; V119-L122 PolarHBondContact O-N 3.01Å; V119-L122 VanDerWaalsContact O-N 3.16Å
120	R	90.5	Very high	88.5	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-54.8	-31.5	178.8	67	-165	176.5	-97.6	12.4	113.9	E62 D104 S108 E115 R118 L122 V123 R124	E62-R120 VanDerWaalsContact OE1-CD 3.29Å; E62-R120 WeakPolarHBondContact OE1-CD 3.41Å; E62-R120 IonicContact OE1-NE 3.28Å; E62-R120 WeakPolarHBondContact OE2-CD 3.47Å; E62-R120 IonicContact OE2-CZ 3.76Å; E62-R120 IonicContact OE2-NE 3.23Å; E62-R120 PolarHBondContact OE2-NE 3.23Å; E62-R120 IonicContact OE2-NH2 2.95Å; D104-R120 HydrophobicContact CB-CB 4.15Å; D104-R120 WeakPolarHBondContact OD2-CB 3.44Å; D104-R120 WeakPolarHBondContact OD2-CD 3.37Å; D104-R120 WeakPolarHBondContact OD2-CG 3.42Å; D104-R120 IonicContact OD2-CZ 2.7Å; D104-R120 PolarHBondContact OD2-N 3.24Å; D104-R120 IonicContact OD2-NE 2.97Å; D104-R120 IonicContact OD2-NH1 3.73Å; D104-R120 PolarHBondContact OD2-NH1 3.41Å; S108-R120 PolarHBondContact OG-NH1 3.36Å; S108-R120 PolarHBondContact OG-NH2 3.47Å; E115-R120 IonicContact OE2-NH1 3.55Å; E115-R120 PolarHBondContact OE2-NH1 3.03Å; R118-R120 HydrophobicContact CB-CG 4.47Å; R118-R120 PolarHBondContact O-N 3.07Å; R118-R120 VanDerWaalsContact O-N 3.16Å; R120-L122 PolarHBondContact O-N 3.06Å; R120-V123 WeakPolarHBondContact O-CG2 3.35Å; R120-V123 PolarHBondContact O-N 2.74Å; R120-R124 WeakPolarHBondContact O-CG 3.46Å; R120-R124 PolarHBondContact O-N 3.06Å
121	R	91.3	Very high	88.4	Confident	21 Å²	21	52 Å²	52	8%	0.079	26%	0.259	C	S	.	.	H	α-helix	trans	-58.4	-49.1	179.5	-68.5	-176.8	177.2	167.2	5.2	111	E33 R34 R118 V119 V123 R124 Y520 V524	E33-R121 VanDerWaalsContact CB-NH2 3.32Å; E33-R121 IonicContact OE2-CZ 3.32Å; E33-R121 IonicContact OE2-NE 3.81Å; E33-R121 PolarHBondContact OE2-NE 2.9Å; E33-R121 IonicContact OE2-NH2 3.72Å; E33-R121 PolarHBondContact OE2-NH2 2.87Å; R34-R121 PolarHBondContact O-NH1 3.4Å; R34-R121 PolarHBondContact O-NH2 2.84Å; R118-R121 HydrophobicContact CB-CG 4.24Å; R118-R121 PolarHBondContact O-N 2.84Å; V119-R121 PolarHBondContact O-N 3.13Å; V119-R121 VanDerWaalsContact O-N 3.11Å; R121-V123 PolarHBondContact O-N 2.76Å; R121-V123 VanDerWaalsContact O-N 3.13Å; R121-R124 PolarHBondContact O-N 2.6Å; R121-R124 VanDerWaalsContact O-N 3.15Å; R121-Y520 VanDerWaalsContact O-CE1 3.23Å; R121-Y520 WeakPolarHBondContact O-CE1 3.4Å; R121-V524 HydrophobicContact CB-CG1 3.84Å; R121-V524 HydrophobicContact CB-CG2 4.27Å
122	L	92.4	Very high	88.3	Confident	57 Å²	57	48.7 Å²	48.7	30%	0.298	25%	0.246	S	C	.	.	H	α-helix	trans	-59.1	-31	-176.6	-167.6	70.6	0	0	0	112.8	V119 R120 P125 V521 W528	V119-L122 PolarHBondContact O-N 3.01Å; V119-L122 VanDerWaalsContact O-N 3.16Å; R120-L122 PolarHBondContact O-N 3.06Å; L122-P125 WeakPolarHBondContact O-CD 3.46Å; L122-V521 HydrophobicContact CD1-CB 4.46Å; L122-V521 HydrophobicContact CD1-CG1 3.89Å; L122-W528 HydrophobicContact CB-CH2 3.71Å; L122-W528 HydrophobicContact CB-CZ2 4.3Å; L122-W528 HydrophobicContact CB-CZ3 4.44Å; L122-W528 HydrophobicContact CD2-CH2 4.04Å; L122-W528 HydrophobicContact CD2-CZ3 4.01Å; L122-W528 HydrophobicContact CG-CH2 4.34Å
123	V	93.2	Very high	88.2	Confident	28 Å²	28	44.8 Å²	44.8	17%	0.17	24%	0.238	C	C	.	.	H	α-helix	trans	-89.5	-14.3	-177.3	-59.8	0	0	0	0	114.1	V97 S101 R120 R121 P125 F126	V97-V123 HydrophobicContact CG1-CB 3.93Å; V97-V123 HydrophobicContact CG1-CG2 4.03Å; S101-V123 WeakPolarHBondContact OG-CG2 3.37Å; R120-V123 WeakPolarHBondContact O-CG2 3.35Å; R120-V123 PolarHBondContact O-N 2.74Å; R121-V123 PolarHBondContact O-N 2.76Å; R121-V123 VanDerWaalsContact O-N 3.13Å; V123-P125 VanDerWaalsContact C-CD 3.46Å; V123-F126 WeakPolarHBondContact O-CB 3.47Å; V123-F126 PolarHBondContact O-N 2.96Å
124	R	93.8	Very high	88.1	Confident	2 Å²	2	48.2 Å²	48.2	1%	0.008	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-41.5	-179.8	-72.1	173	-178.1	174.2	13.7	114.5	V26 L27 E33 E62 R120 R121 F126 F127 Y520	V26-R124 HydrophobicContact CG1-CB 4.06Å; V26-R124 HydrophobicContact CG1-CG 3.58Å; V26-R124 PolarHBondContact O-NH1 3.45Å; L27-R124 HydrophobicContact CD2-CB 4.02Å; E33-R124 IonicContact OE1-CZ 2.74Å; E33-R124 IonicContact OE1-NH1 3.07Å; E33-R124 PolarHBondContact OE1-NH1 3.25Å; E33-R124 IonicContact OE1-NH2 2.6Å; E33-R124 PolarHBondContact OE1-NH2 3.46Å; E33-R124 IonicContact OE2-NH1 3.91Å; E33-R124 IonicContact OE2-NH2 2.65Å; E33-R124 PolarHBondContact OE2-NH2 3.3Å; E62-R124 IonicContact OE1-CZ 2.84Å; E62-R124 VanDerWaalsContact OE1-CZ 3.28Å; E62-R124 IonicContact OE1-NE 2.77Å; E62-R124 PolarHBondContact OE1-NE 3.38Å; E62-R124 VanDerWaalsContact OE1-NE 3.08Å; E62-R124 IonicContact OE1-NH2 2.96Å; E62-R124 PolarHBondContact OE1-NH2 2.94Å; E62-R124 IonicContact OE2-NH2 2.76Å; E62-R124 PolarHBondContact OE2-NH2 3.35Å; R120-R124 WeakPolarHBondContact O-CG 3.46Å; R120-R124 PolarHBondContact O-N 3.06Å; R121-R124 PolarHBondContact O-N 2.6Å; R121-R124 VanDerWaalsContact O-N 3.15Å; R124-F126 PolarHBondContact O-N 2.89Å; R124-F127 HydrophobicContact CB-CD2 4.48Å; R124-F127 HydrophobicContact CG-CE2 4.5Å; R124-F127 WeakPolarHBondContact O-CB 3.32Å; R124-F127 VanDerWaalsContact O-CD2 3.26Å; R124-F127 WeakPolarHBondContact O-CD2 3.2Å; R124-F127 PolarHBondContact O-N 3.23Å; R124-Y520 HydrophobicContact CB-CE1 4.49Å; R124-Y520 WeakPolarHBondContact CD-OH 3.27Å
125	P	95.3	Very high	88.3	Confident	3 Å²	3	42.5 Å²	42.5	2%	0.019	22%	0.224	C	C	.	.	H	α-helix	trans	-59.2	-21.2	176.8	-27.2	37.7	0	0	0	114.2	L27 L122 V123 F127 L128 L129 V517 Y520 V521	L27-P125 HydrophobicContact CD2-CG 4.27Å; L122-P125 WeakPolarHBondContact O-CD 3.46Å; V123-P125 VanDerWaalsContact C-CD 3.46Å; P125-F127 PolarHBondContact O-N 2.87Å; P125-L128 WeakPolarHBondContact O-CB 3.36Å; P125-L128 PolarHBondContact O-N 2.9Å; P125-L129 PolarHBondContact O-N 3.4Å; P125-V517 HydrophobicContact CB-CB 4.07Å; P125-V517 HydrophobicContact CB-CG1 3.69Å; P125-V517 HydrophobicContact CB-CG2 3.83Å; P125-Y520 HydrophobicContact CG-CD1 3.19Å; P125-Y520 HydrophobicContact CG-CE1 3.82Å; P125-Y520 HydrophobicContact CG-CG 3.6Å; P125-V521 HydrophobicContact CG-CG2 4.27Å
126	F	94.8	Very high	88.6	Confident	36 Å²	36	43.1 Å²	43.1	16%	0.158	23%	0.226	C	C	.	.	H	α-helix	trans	-60.9	-33	174.5	-173.9	-93.1	0	0	0	112	W90 Y94 V97 V123 R124 L128 L129 Q130	W90-F126 HydrophobicContact CE3-CE2 4.1Å; W90-F126 AromaticContact CE3-CZ 3.93Å; W90-F126 HydrophobicContact CE3-CZ 3.93Å; W90-F126 AromaticContact CZ3-CE2 3.83Å; W90-F126 HydrophobicContact CZ3-CE2 3.83Å; W90-F126 HydrophobicContact CZ3-CZ 4.12Å; Y94-F126 HydrophobicContact CD2-CE1 4.25Å; V97-F126 HydrophobicContact CB-CD1 4.07Å; V97-F126 HydrophobicContact CG1-CB 4.41Å; V97-F126 HydrophobicContact CG1-CD1 4.15Å; V97-F126 HydrophobicContact CG2-CB 4.35Å; V97-F126 HydrophobicContact CG2-CD1 3.77Å; V97-F126 HydrophobicContact CG2-CE1 4.24Å; V97-F126 HydrophobicContact CG2-CG 3.94Å; V123-F126 WeakPolarHBondContact O-CB 3.47Å; V123-F126 PolarHBondContact O-N 2.96Å; R124-F126 PolarHBondContact O-N 2.89Å; F126-L128 VanDerWaalsContact C-N 3.3Å; F126-L128 PolarHBondContact O-N 3.38Å; F126-L129 PolarHBondContact O-N 2.92Å; F126-Q130 HydrophobicContact CD1-CB 4.37Å; F126-Q130 HydrophobicContact CE1-CB 4.03Å; F126-Q130 HydrophobicContact CE1-CG 4.45Å; F126-Q130 VanDerWaalsContact O-CB 3.32Å; F126-Q130 WeakPolarHBondContact O-CB 3.31Å; F126-Q130 PolarHBondContact O-N 3.38Å
127	F	93.3	Very high	88.9	Confident	7 Å²	7	37.5 Å²	37.5	3%	0.031	20%	0.202	C	C	.	.	H	α-helix	trans	-62.7	-37.4	176.9	-58.1	-48.7	0	0	0	112.1	I23 V26 L66 F69 Y94 V97 I98 R124 P125 N131	I23-F127 HydrophobicContact CG1-CB 4.22Å; V26-F127 HydrophobicContact CG1-CD2 4.47Å; L66-F127 HydrophobicContact CD2-CZ 4.49Å; F69-F127 HydrophobicContact CD2-CD1 4.28Å; F69-F127 HydrophobicContact CD2-CD2 4.3Å; F69-F127 HydrophobicContact CD2-CE1 4.1Å; F69-F127 HydrophobicContact CD2-CE2 4.15Å; F69-F127 HydrophobicContact CD2-CG 4.37Å; F69-F127 HydrophobicContact CD2-CZ 4.04Å; F69-F127 HydrophobicContact CE2-CB 4.48Å; F69-F127 HydrophobicContact CE2-CD1 4.24Å; F69-F127 AromaticContact CE2-CD2 3.66Å; F69-F127 HydrophobicContact CE2-CD2 3.66Å; F69-F127 HydrophobicContact CE2-CE1 4.39Å; F69-F127 AromaticContact CE2-CE2 3.85Å; F69-F127 HydrophobicContact CE2-CE2 3.85Å; F69-F127 AromaticContact CE2-CG 3.87Å; F69-F127 HydrophobicContact CE2-CG 3.87Å; F69-F127 HydrophobicContact CE2-CZ 4.2Å; F69-F127 HydrophobicContact CZ-CB 4.11Å; F69-F127 HydrophobicContact CZ-CD2 4.11Å; F69-F127 AromaticContact CZ-CG 4Å; F69-F127 HydrophobicContact CZ-CG 4Å; Y94-F127 HydrophobicContact CD2-CD1 4.11Å; Y94-F127 HydrophobicContact CD2-CE1 4.17Å; Y94-F127 AromaticContact CE2-CD1 3.54Å; Y94-F127 HydrophobicContact CE2-CD1 3.54Å; Y94-F127 AromaticContact CE2-CE1 3.69Å; Y94-F127 HydrophobicContact CE2-CE1 3.69Å; V97-F127 HydrophobicContact CG1-CE1 3.72Å; V97-F127 HydrophobicContact CG1-CZ 3.79Å; I98-F127 HydrophobicContact CG1-CE1 4.06Å; R124-F127 HydrophobicContact CB-CD2 4.48Å; R124-F127 HydrophobicContact CG-CE2 4.5Å; R124-F127 WeakPolarHBondContact O-CB 3.32Å; R124-F127 VanDerWaalsContact O-CD2 3.26Å; R124-F127 WeakPolarHBondContact O-CD2 3.2Å; R124-F127 PolarHBondContact O-N 3.23Å; P125-F127 PolarHBondContact O-N 2.87Å; F127-N131 PolarHBondContact O-N 2.93Å
128	L	92.9	Very high	88.9	Confident	42 Å²	42	33 Å²	33	22%	0.22	18%	0.178	C	C	.	.	H	α-helix	trans	-66.6	-45.6	173.8	-175.5	65.6	0	0	0	111.6	I23 L27 P125 F126 Q130 N131 S132 M135 V517	I23-L128 HydrophobicContact CG2-CB 3.89Å; I23-L128 HydrophobicContact CG2-CD1 3.98Å; L27-L128 HydrophobicContact CD1-CB 4.41Å; L27-L128 HydrophobicContact CD1-CD2 4.24Å; P125-L128 WeakPolarHBondContact O-CB 3.36Å; P125-L128 PolarHBondContact O-N 2.9Å; F126-L128 VanDerWaalsContact C-N 3.3Å; F126-L128 PolarHBondContact O-N 3.38Å; L128-Q130 VanDerWaalsContact C-N 3.32Å; L128-Q130 PolarHBondContact O-N 3.43Å; L128-N131 PolarHBondContact O-N 3.38Å; L128-S132 PolarHBondContact O-N 3.32Å; L128-M135 HydrophobicContact CD2-CE 3.89Å; L128-M135 HydrophobicContact CG-CE 3.81Å; L128-M135 HydrophobicContact CG-SD 4.11Å; L128-V517 HydrophobicContact CD2-CG2 4.03Å
129	L	92.3	Very high	88.8	Confident	19 Å²	19	35.6 Å²	35.6	10%	0.099	19%	0.193	C	C	.	.	H	α-helix	trans	-61.5	-39.8	176.4	-71.2	171.3	0	0	0	112.2	W90 P125 F126 M135 K136 V517	W90-L129 HydrophobicContact CZ3-CB 4.3Å; P125-L129 PolarHBondContact O-N 3.4Å; F126-L129 PolarHBondContact O-N 2.92Å; L129-M135 HydrophobicContact CD2-CB 4.23Å; L129-M135 HydrophobicContact CD2-CE 3.75Å; L129-M135 HydrophobicContact CG-CE 4.42Å; L129-K136 VanDerWaalsContact O-CE 3.28Å; L129-K136 WeakPolarHBondContact O-CE 3.28Å; L129-K136 WeakPolarHBondContact O-CG 3.38Å; L129-V517 HydrophobicContact CD1-CG1 4.08Å; L129-V517 HydrophobicContact CD2-CG2 4.3Å; L129-V517 HydrophobicContact CG-CG1 4.46Å; L129-V517 HydrophobicContact CG-CG2 4.08Å
130	Q	90.8	Very high	88.6	Confident	13 Å²	13	39.8 Å²	39.8	6%	0.061	21%	0.206	C	C	.	.	H	α-helix	trans	-68.2	-38	-177.1	177.4	62.9	-13.8	0	0	112.4	W90 Y94 F126 L128 K136	W90-Q130 VanDerWaalsContact CE3-OE1 3.29Å; W90-Q130 PolarHBondContact O-NE2 3.44Å; W90-Q130 VanDerWaalsContact O-NE2 3.16Å; W90-Q130 PolarHBondContact O-OE1 3.48Å; Y94-Q130 HydrophobicContact CD1-CG 4.16Å; Y94-Q130 HydrophobicContact CD2-CG 4.04Å; Y94-Q130 HydrophobicContact CE2-CG 4.49Å; Y94-Q130 HydrophobicContact CG-CG 3.87Å; F126-Q130 HydrophobicContact CD1-CB 4.37Å; F126-Q130 HydrophobicContact CE1-CB 4.03Å; F126-Q130 HydrophobicContact CE1-CG 4.45Å; F126-Q130 VanDerWaalsContact O-CB 3.32Å; F126-Q130 WeakPolarHBondContact O-CB 3.31Å; F126-Q130 PolarHBondContact O-N 3.38Å; L128-Q130 VanDerWaalsContact C-N 3.32Å; L128-Q130 PolarHBondContact O-N 3.43Å; Q130-K136 WeakPolarHBondContact O-CE 3.31Å; Q130-K136 PolarHBondContact O-NZ 3.46Å; Q130-K136 VanDerWaalsContact OE1-CE 3.28Å
131	N	87.8	Confident	87.9	Confident	54 Å²	54	39.9 Å²	39.9	29%	0.289	21%	0.206	S	C	.	.	H	α-helix	trans	-76.1	-35.3	-178.7	-169	31.4	0	0	0	112.5	I23 F127 L128 S133	I23-N131 HydrophobicContact CD1-CB 3.68Å; F127-N131 PolarHBondContact O-N 2.93Å; L128-N131 PolarHBondContact O-N 3.38Å; N131-S133 PolarHBondContact O-N 2.98Å
132	S	86.6	Confident	87.5	Confident	34 Å²	34	40.3 Å²	40.3	24%	0.238	21%	0.209	C	C	.	.			trans	-88.7	105.7	-174.9	-179.9	0	0	0	0	112.9	L128 L134 M135 K136	L128-S132 PolarHBondContact O-N 3.32Å; S132-L134 PolarHBondContact O-N 3.1Å; S132-M135 WeakPolarHBondContact CB-SD 3.48Å; S132-M135 PolarHBondContact O-N 3.43Å; S132-M135 VanDerWaalsContact OG-CG 3.26Å; S132-M135 WeakPolarHBondContact OG-CG 3.34Å; S132-M135 PolarHBondContact OG-N 2.65Å; S132-K136 WeakPolarHBondContact O-CG 3.39Å; S132-K136 PolarHBondContact O-N 3.05Å; S132-K136 VanDerWaalsContact O-N 3.15Å
133	S	82.2	Confident	87.1	Confident	88 Å²	88	45.3 Å²	45.3	62%	0.615	23%	0.229	S	C	*	.	H	α-helix	trans	-61.3	-29.6	174.4	62.2	0	0	0	0	113.3	N131 K137	N131-S133 PolarHBondContact O-N 2.98Å; S133-K137 WeakPolarHBondContact O-CG 3.28Å; S133-K137 PolarHBondContact O-N 3.16Å
134	L	79.4	Confident	86.7	Confident	84 Å²	84	53 Å²	53	44%	0.44	26%	0.255	S	S	.	.	H	α-helix	trans	-73	-39.9	179.3	-169.8	61.7	0	0	0	110.5	S132 K136 K137 T138 A510	S132-L134 PolarHBondContact O-N 3.1Å; L134-K136 VanDerWaalsContact C-N 3.35Å; L134-K136 PolarHBondContact O-N 3.11Å; L134-K137 WeakPolarHBondContact O-CB 3.09Å; L134-K137 PolarHBondContact O-N 2.75Å; L134-T138 PolarHBondContact O-N 2.97Å; L134-T138 PolarHBondContact O-OG1 3.04Å; L134-T138 VanDerWaalsContact O-OG1 3.14Å; L134-A510 HydrophobicContact CB-CB 3.78Å; L134-A510 HydrophobicContact CD2-CB 3.4Å; L134-A510 VanDerWaalsContact CD2-CB 3.4Å; L134-A510 HydrophobicContact CG-CB 3.31Å
135	M	85.9	Confident	86.1	Confident	5 Å²	5	53.5 Å²	53.5	3%	0.025	26%	0.258	C	S	.	.	H	α-helix	trans	-64.4	-37.3	174.8	-69.3	168.6	69.6	0	0	112.4	L128 L129 S132 K137 T138 L139 A510 G513 I514 V517	L128-M135 HydrophobicContact CD2-CE 3.89Å; L128-M135 HydrophobicContact CG-CE 3.81Å; L128-M135 HydrophobicContact CG-SD 4.11Å; L129-M135 HydrophobicContact CD2-CB 4.23Å; L129-M135 HydrophobicContact CD2-CE 3.75Å; L129-M135 HydrophobicContact CG-CE 4.42Å; S132-M135 WeakPolarHBondContact CB-SD 3.48Å; S132-M135 PolarHBondContact O-N 3.43Å; S132-M135 VanDerWaalsContact OG-CG 3.26Å; S132-M135 WeakPolarHBondContact OG-CG 3.34Å; S132-M135 PolarHBondContact OG-N 2.65Å; M135-K137 VanDerWaalsContact C-N 3.31Å; M135-K137 PolarHBondContact O-N 3.36Å; M135-T138 VanDerWaalsContact CA-OG1 3.23Å; M135-T138 WeakPolarHBondContact CA-OG1 3.44Å; M135-T138 PolarHBondContact O-N 3.07Å; M135-T138 PolarHBondContact O-OG1 3.15Å; M135-L139 WeakPolarHBondContact O-CB 3.09Å; M135-L139 PolarHBondContact O-N 3.29Å; M135-A510 HydrophobicContact CG-CB 3.97Å; M135-A510 WeakPolarHBondContact CG-O 3.32Å; M135-G513 VanDerWaalsContact CE-O 3.32Å; M135-G513 WeakPolarHBondContact CE-O 3.44Å; M135-I514 HydrophobicContact CB-CG1 4.45Å; M135-I514 HydrophobicContact CE-CG1 4.31Å; M135-I514 HydrophobicContact CG-CG1 4.4Å; M135-V517 HydrophobicContact CE-CG2 4.05Å
136	K	86.9	Confident	85.6	Confident	46 Å²	46	57.2 Å²	57.2	20%	0.2	28%	0.278	C	S	.	.	H	α-helix	trans	-60.8	-40.6	173.4	-66.1	179.9	174.4	175.9	0	112.3	W90 L129 Q130 S132 L134 K140	W90-K136 HydrophobicContact CD2-CD 3.85Å; W90-K136 HydrophobicContact CD2-CG 4.21Å; W90-K136 HydrophobicContact CE3-CD 4.28Å; W90-K136 HydrophobicContact CE3-CG 4.42Å; W90-K136 HydrophobicContact CG-CD 4.2Å; W90-K136 HydrophobicContact CH2-CG 3.85Å; W90-K136 HydrophobicContact CZ2-CB 3.95Å; W90-K136 HydrophobicContact CZ2-CD 4.14Å; W90-K136 HydrophobicContact CZ2-CG 3.6Å; W90-K136 HydrophobicContact CZ3-CG 4.25Å; L129-K136 VanDerWaalsContact O-CE 3.28Å; L129-K136 WeakPolarHBondContact O-CE 3.28Å; L129-K136 WeakPolarHBondContact O-CG 3.38Å; Q130-K136 WeakPolarHBondContact O-CE 3.31Å; Q130-K136 PolarHBondContact O-NZ 3.46Å; Q130-K136 VanDerWaalsContact OE1-CE 3.28Å; S132-K136 WeakPolarHBondContact O-CG 3.39Å; S132-K136 PolarHBondContact O-N 3.05Å; S132-K136 VanDerWaalsContact O-N 3.15Å; L134-K136 VanDerWaalsContact C-N 3.35Å; L134-K136 PolarHBondContact O-N 3.11Å; K136-K140 WeakPolarHBondContact O-CB 3.47Å; K136-K140 PolarHBondContact O-N 2.95Å
137	K	81.1	Confident	85.2	Confident	66 Å²	66	59.8 Å²	59.8	29%	0.287	30%	0.298	S	S	.	.	H	α-helix	trans	-67.8	-42	177	-71.2	178.7	-179.1	-173.6	0	111.4	S133 L134 M135 K140 C141 Y250	S133-K137 WeakPolarHBondContact O-CG 3.28Å; S133-K137 PolarHBondContact O-N 3.16Å; L134-K137 WeakPolarHBondContact O-CB 3.09Å; L134-K137 PolarHBondContact O-N 2.75Å; M135-K137 VanDerWaalsContact C-N 3.31Å; M135-K137 PolarHBondContact O-N 3.36Å; K137-K140 PolarHBondContact O-N 3.26Å; K137-C141 PolarHBondContact O-N 2.87Å; K137-Y250 PolarHBondContact O-OH 2.93Å
138	T	81.1	Confident	84.8	Confident	10 Å²	10	63.5 Å²	63.5	6%	0.061	32%	0.315	C	S	.	.	H	α-helix	trans	-71.4	-35.9	179.1	48.5	0	0	0	0	111.9	L134 M135 C141 I142 A510 F511 I514	L134-T138 PolarHBondContact O-N 2.97Å; L134-T138 PolarHBondContact O-OG1 3.04Å; L134-T138 VanDerWaalsContact O-OG1 3.14Å; M135-T138 VanDerWaalsContact CA-OG1 3.23Å; M135-T138 WeakPolarHBondContact CA-OG1 3.44Å; M135-T138 PolarHBondContact O-N 3.07Å; M135-T138 PolarHBondContact O-OG1 3.15Å; T138-C141 WeakPolarHBondContact O-CB 3.41Å; T138-C141 PolarHBondContact O-N 3.39Å; T138-I142 WeakPolarHBondContact O-CG1 3.2Å; T138-I142 PolarHBondContact O-N 3.1Å; T138-A510 HydrophobicContact CG2-CB 4.43Å; T138-F511 HydrophobicContact CG2-CE1 3.87Å; T138-F511 HydrophobicContact CG2-CE2 3.93Å; T138-F511 HydrophobicContact CG2-CZ 3.47Å; T138-F511 VanDerWaalsContact CG2-CZ 3.47Å; T138-I514 WeakPolarHBondContact OG1-CD1 3.41Å
139	L	85.1	Confident	84.5	Confident	65 Å²	65	61.8 Å²	61.8	34%	0.34	31%	0.306	S	S	.	.	H	α-helix	trans	-66	-40.4	172.5	-170.4	68.9	0	0	0	111.9	W90 M135 C141 I142 K143	W90-L139 HydrophobicContact CH2-CD2 4.13Å; M135-L139 WeakPolarHBondContact O-CB 3.09Å; M135-L139 PolarHBondContact O-N 3.29Å; L139-C141 VanDerWaalsContact C-N 3.25Å; L139-C141 PolarHBondContact O-N 2.76Å; L139-I142 PolarHBondContact O-N 3.14Å; L139-K143 WeakPolarHBondContact O-CB 3.35Å; L139-K143 PolarHBondContact O-N 3.12Å
140	K	83.5	Confident	84.3	Confident	156 Å²	156	63.2 Å²	63.2	68%	0.678	32%	0.321	S	S	*	.	H	α-helix	trans	-61.7	-35.7	173.1	-172.4	177.5	-179.5	-178	0	111.7	K136 K137 R144	K136-K140 WeakPolarHBondContact O-CB 3.47Å; K136-K140 PolarHBondContact O-N 2.95Å; K137-K140 PolarHBondContact O-N 3.26Å; K140-R144 PolarHBondContact O-N 3.24Å; K140-R144 VanDerWaalsContact O-N 3.15Å
141	C	76.9	Confident	84.2	Confident	1 Å²	1	66 Å²	66	1%	0.007	34%	0.342	C	S	.	.	H	α-helix	trans	-59.6	-59.4	171.8	-177.2	0	0	0	0	110.8	K137 T138 L139 K143 R144 T145 Y250	K137-C141 PolarHBondContact O-N 2.87Å; T138-C141 WeakPolarHBondContact O-CB 3.41Å; T138-C141 PolarHBondContact O-N 3.39Å; L139-C141 VanDerWaalsContact C-N 3.25Å; L139-C141 PolarHBondContact O-N 2.76Å; C141-K143 PolarHBondContact O-N 2.93Å; C141-R144 WeakPolarHBondContact O-CA 3.49Å; C141-R144 WeakPolarHBondContact O-CB 3.22Å; C141-R144 PolarHBondContact O-N 2.79Å; C141-T145 WeakPolarHBondContact O-CG2 3.2Å; C141-T145 PolarHBondContact O-N 3.35Å; C141-T145 PolarHBondContact O-OG1 3.36Å; C141-Y250 HydrophobicContact CB-CD1 3.46Å; C141-Y250 VanDerWaalsContact CB-CD1 3.46Å; C141-Y250 HydrophobicContact CB-CD2 4.17Å; C141-Y250 HydrophobicContact CB-CE1 3.39Å; C141-Y250 HydrophobicContact CB-CE2 4.12Å; C141-Y250 HydrophobicContact CB-CG 3.83Å; C141-Y250 VanDerWaalsContact SG-CB 3.52Å; C141-Y250 WeakPolarHBondContact SG-CD1 3.35Å
142	I	81.4	Confident	84.2	Confident	30 Å²	30	63.8 Å²	63.8	15%	0.154	33%	0.33	C	S	.	.	H	α-helix	trans	-55.9	-41.6	-176.9	-65.5	165.9	0	0	0	110.5	T138 L139 R144 T145 L146 I514 M617 L621	T138-I142 WeakPolarHBondContact O-CG1 3.2Å; T138-I142 PolarHBondContact O-N 3.1Å; L139-I142 PolarHBondContact O-N 3.14Å; I142-R144 VanDerWaalsContact C-N 3.32Å; I142-R144 PolarHBondContact O-N 3.28Å; I142-T145 WeakPolarHBondContact CA-OG1 3.35Å; I142-T145 PolarHBondContact O-N 2.9Å; I142-T145 PolarHBondContact O-OG1 2.79Å; I142-L146 PolarHBondContact O-N 3.11Å; I142-I514 HydrophobicContact CD1-CD1 4.22Å; I142-M617 HydrophobicContact CG2-CE 4.06Å; I142-L621 HydrophobicContact CD1-CD1 4.41Å; I142-L621 HydrophobicContact CG1-CD1 4.16Å
143	K	85.8	Confident	84.4	Confident	163 Å²	163	64.1 Å²	64.1	71%	0.709	33%	0.329	S	S	*	.	H	α-helix	trans	-61.1	-38.7	175.8	-177.9	176.7	178.1	174.1	0	112.8	L139 C141	L139-K143 WeakPolarHBondContact O-CB 3.35Å; L139-K143 PolarHBondContact O-N 3.12Å; C141-K143 PolarHBondContact O-N 2.93Å
144	R	82.9	Confident	84.8	Confident	188 Å²	188	65.2 Å²	65.2	71%	0.709	33%	0.327	S	S	*	.	H	α-helix	trans	-73.7	-31.2	-179.6	-173.2	177.9	177.7	176.9	0.2	112	K140 C141 I142 P147	K140-R144 PolarHBondContact O-N 3.24Å; K140-R144 VanDerWaalsContact O-N 3.15Å; C141-R144 WeakPolarHBondContact O-CA 3.49Å; C141-R144 WeakPolarHBondContact O-CB 3.22Å; C141-R144 PolarHBondContact O-N 2.79Å; I142-R144 VanDerWaalsContact C-N 3.32Å; I142-R144 PolarHBondContact O-N 3.28Å; R144-P147 VanDerWaalsContact O-CD 3.3Å; R144-P147 WeakPolarHBondContact O-CD 3.13Å
145	T	81.5	Confident	85.4	Confident	13 Å²	13	65.1 Å²	65.1	8%	0.08	33%	0.327	C	S	.	.	H	α-helix	trans	-83.2	-19	179	60	0	0	0	0	113	C141 I142 P147 E148 I149 Q246	C141-T145 WeakPolarHBondContact O-CG2 3.2Å; C141-T145 PolarHBondContact O-N 3.35Å; C141-T145 PolarHBondContact O-OG1 3.36Å; I142-T145 WeakPolarHBondContact CA-OG1 3.35Å; I142-T145 PolarHBondContact O-N 2.9Å; I142-T145 PolarHBondContact O-OG1 2.79Å; T145-P147 VanDerWaalsContact C-CD 3.42Å; T145-E148 PolarHBondContact O-N 2.95Å; T145-I149 WeakPolarHBondContact O-CG1 3.32Å; T145-I149 PolarHBondContact O-N 2.65Å; T145-Q246 HydrophobicContact CG2-CB 3.7Å
146	L	84.9	Confident	85.7	Confident	82 Å²	82	65.3 Å²	65.3	43%	0.429	33%	0.328	S	S	.	.	H	α-helix	trans	-54.4	-40	-177.7	-168.1	66.4	0	0	0	115.3	I142 E148 I149 A150 M617	I142-L146 PolarHBondContact O-N 3.11Å; L146-E148 VanDerWaalsContact C-N 3.31Å; L146-E148 PolarHBondContact O-N 3.3Å; L146-I149 PolarHBondContact O-N 2.92Å; L146-A150 WeakPolarHBondContact O-CB 3.49Å; L146-A150 PolarHBondContact O-N 3.5Å; L146-M617 HydrophobicContact CD1-CE 4.09Å; L146-M617 HydrophobicContact CD1-SD 4.43Å
147	P	87.4	Confident	86	Confident	89 Å²	89	65.1 Å²	65.1	58%	0.578	34%	0.335	S	S	*	.	H	α-helix	trans	-62.2	-36.1	179.8	-23.6	35.2	0	0	0	113.6	R144 T145 A150 S151	R144-P147 VanDerWaalsContact O-CD 3.3Å; R144-P147 WeakPolarHBondContact O-CD 3.13Å; T145-P147 VanDerWaalsContact C-CD 3.42Å; P147-A150 WeakPolarHBondContact O-CB 3.37Å; P147-A150 PolarHBondContact O-N 3.03Å; P147-S151 PolarHBondContact O-N 3.23Å
148	E	84.8	Confident	86.7	Confident	85 Å²	85	67 Å²	67	40%	0.397	35%	0.348	S	S	.	.	H	α-helix	trans	-75.7	-38.1	177.5	-64	-170.2	-154.6	0	0	111.9	T145 L146 A150 S151 Q246	T145-E148 PolarHBondContact O-N 2.95Å; L146-E148 VanDerWaalsContact C-N 3.31Å; L146-E148 PolarHBondContact O-N 3.3Å; E148-A150 PolarHBondContact O-N 3.35Å; E148-S151 PolarHBondContact O-N 2.93Å; E148-S151 PolarHBondContact O-OG 3.34Å; E148-Q246 VanDerWaalsContact OE1-CD 3.22Å; E148-Q246 PolarHBondContact OE1-NE2 3.26Å; E148-Q246 PolarHBondContact OE1-OE1 3.2Å; E148-Q246 WeakPolarHBondContact OE2-CG 3.24Å; E148-Q246 PolarHBondContact OE2-NE2 2.87Å
149	I	86.1	Confident	87.4	Confident	6 Å²	6	67.4 Å²	67.4	3%	0.031	35%	0.349	C	S	.	.	H	α-helix	trans	-60.9	-38.2	172.5	-63.8	171.2	0	0	0	109.8	T145 L146 S151 V152 I153 L239 I243 M617	T145-I149 WeakPolarHBondContact O-CG1 3.32Å; T145-I149 PolarHBondContact O-N 2.65Å; L146-I149 PolarHBondContact O-N 2.92Å; I149-S151 VanDerWaalsContact C-N 3.32Å; I149-S151 PolarHBondContact O-N 2.86Å; I149-V152 PolarHBondContact O-N 3.12Å; I149-I153 HydrophobicContact CG2-CD1 3.66Å; I149-I153 HydrophobicContact CG2-CG1 4.24Å; I149-I153 WeakPolarHBondContact O-CG1 3.34Å; I149-I153 PolarHBondContact O-N 2.91Å; I149-L239 HydrophobicContact CG2-CD1 4.11Å; I149-I243 HydrophobicContact CD1-CG1 3.95Å; I149-I243 HydrophobicContact CG1-CG1 3.98Å; I149-M617 HydrophobicContact CD1-CE 4.19Å
150	A	89	Confident	87.9	Confident	49 Å²	49	65 Å²	65	41%	0.405	34%	0.336	S	S	.	.	H	α-helix	trans	-63.2	-33.6	179.5	0	0	0	0	0	113.3	L146 P147 E148 V152 I153 L154	L146-A150 WeakPolarHBondContact O-CB 3.49Å; L146-A150 PolarHBondContact O-N 3.5Å; P147-A150 WeakPolarHBondContact O-CB 3.37Å; P147-A150 PolarHBondContact O-N 3.03Å; E148-A150 PolarHBondContact O-N 3.35Å; A150-V152 VanDerWaalsContact C-N 3.33Å; A150-V152 PolarHBondContact O-N 2.98Å; A150-I153 PolarHBondContact O-N 3.4Å; A150-L154 WeakPolarHBondContact O-CB 3.37Å; A150-L154 PolarHBondContact O-N 3.47Å
151	S	88.8	Confident	88.5	Confident	72 Å²	72	60.9 Å²	60.9	50%	0.503	33%	0.326	S	S	.	.	H	α-helix	trans	-67.2	-35.5	177.9	70.4	0	0	0	0	112.1	P147 E148 I149 L154 L155	P147-S151 PolarHBondContact O-N 3.23Å; E148-S151 PolarHBondContact O-N 2.93Å; E148-S151 PolarHBondContact O-OG 3.34Å; I149-S151 VanDerWaalsContact C-N 3.32Å; I149-S151 PolarHBondContact O-N 2.86Å; S151-L154 WeakPolarHBondContact O-CB 3.48Å; S151-L154 PolarHBondContact O-N 3.24Å; S151-L155 PolarHBondContact O-N 3.45Å; S151-L155 VanDerWaalsContact O-N 3.08Å
152	V	87.8	Confident	89.4	Confident	7 Å²	7	65.8 Å²	65.8	4%	0.042	35%	0.352	C	S	.	.	H	α-helix	trans	-75.7	-40.3	176.4	-172.5	0	0	0	0	111.2	I149 A150 L154 L155 L156 L239 I242	I149-V152 PolarHBondContact O-N 3.12Å; A150-V152 VanDerWaalsContact C-N 3.33Å; A150-V152 PolarHBondContact O-N 2.98Å; V152-L154 PolarHBondContact O-N 3.33Å; V152-L155 WeakPolarHBondContact O-CB 3.4Å; V152-L155 PolarHBondContact O-N 3.26Å; V152-L155 VanDerWaalsContact O-N 3.15Å; V152-L156 WeakPolarHBondContact O-CB 3.31Å; V152-L156 PolarHBondContact O-N 2.94Å; V152-L239 HydrophobicContact CB-CD1 3.91Å; V152-L239 HydrophobicContact CG1-CB 3.9Å; V152-L239 HydrophobicContact CG1-CD1 3.84Å; V152-L239 HydrophobicContact CG1-CG 4.4Å; V152-I242 HydrophobicContact CG2-CD1 3.26Å; V152-I242 HydrophobicContact CG2-CG1 4.49Å
153	I	89.5	Confident	90.1	Very high	42 Å²	42	65.5 Å²	65.5	22%	0.215	35%	0.349	C	S	.	.	H	α-helix	trans	-59.8	-38.8	172.5	-68.5	169.4	0	0	0	110.2	I149 A150 L156 A157 L612	I149-I153 HydrophobicContact CG2-CD1 3.66Å; I149-I153 HydrophobicContact CG2-CG1 4.24Å; I149-I153 WeakPolarHBondContact O-CG1 3.34Å; I149-I153 PolarHBondContact O-N 2.91Å; A150-I153 PolarHBondContact O-N 3.4Å; I153-L156 WeakPolarHBondContact O-CB 3.45Å; I153-L156 PolarHBondContact O-N 2.95Å; I153-A157 WeakPolarHBondContact O-CB 3.35Å; I153-A157 PolarHBondContact O-N 3.47Å; I153-L612 HydrophobicContact CD1-CD1 3.94Å; I153-L612 HydrophobicContact CD1-CD2 4.28Å; I153-L612 HydrophobicContact CD1-CG 4.42Å; I153-L612 HydrophobicContact CG1-CD1 4.23Å
154	L	92.1	Very high	90.6	Very high	110 Å²	110	57.8 Å²	57.8	58%	0.576	32%	0.316	S	S	*	.	H	α-helix	trans	-62.9	-44.9	174.4	179.9	66.9	0	0	0	111.5	A150 S151 V152 L156 A157 L158	A150-L154 WeakPolarHBondContact O-CB 3.37Å; A150-L154 PolarHBondContact O-N 3.47Å; S151-L154 WeakPolarHBondContact O-CB 3.48Å; S151-L154 PolarHBondContact O-N 3.24Å; V152-L154 PolarHBondContact O-N 3.33Å; L154-L156 VanDerWaalsContact C-N 3.29Å; L154-L156 PolarHBondContact O-N 3.2Å; L154-A157 PolarHBondContact O-N 2.9Å; L154-L158 HydrophobicContact CG-CD1 4.48Å; L154-L158 WeakPolarHBondContact O-CG 3.26Å; L154-L158 PolarHBondContact O-N 3.48Å
155	L	91.4	Very high	91.2	Very high	82 Å²	82	53.9 Å²	53.9	43%	0.429	31%	0.307	S	S	.	.	H	α-helix	trans	-60.5	-40.2	175.4	-177.2	61.9	0	0	0	111.8	S151 V152 L158 H159 L235	S151-L155 PolarHBondContact O-N 3.45Å; S151-L155 VanDerWaalsContact O-N 3.08Å; V152-L155 WeakPolarHBondContact O-CB 3.4Å; V152-L155 PolarHBondContact O-N 3.26Å; V152-L155 VanDerWaalsContact O-N 3.15Å; L155-L158 PolarHBondContact O-N 3.01Å; L155-H159 PolarHBondContact O-N 3.39Å; L155-L235 HydrophobicContact CD2-CD2 3.51Å; L155-L235 HydrophobicContact CG-CD2 3.86Å
156	L	92.3	Very high	91.9	Very high	9 Å²	9	56.3 Å²	56.3	5%	0.047	32%	0.322	C	S	.	.	H	α-helix	trans	-65	-42.4	175.2	-174.8	65	0	0	0	112.3	V152 I153 L154 L158 H159 L160 L201 L235 M236 W611	V152-L156 WeakPolarHBondContact O-CB 3.31Å; V152-L156 PolarHBondContact O-N 2.94Å; I153-L156 WeakPolarHBondContact O-CB 3.45Å; I153-L156 PolarHBondContact O-N 2.95Å; L154-L156 VanDerWaalsContact C-N 3.29Å; L154-L156 PolarHBondContact O-N 3.2Å; L156-L158 VanDerWaalsContact C-N 3.34Å; L156-H159 WeakPolarHBondContact O-CB 3.47Å; L156-H159 PolarHBondContact O-N 3.21Å; L156-L160 WeakPolarHBondContact O-CG 3.1Å; L156-L160 PolarHBondContact O-N 3.08Å; L156-L201 HydrophobicContact CD1-CD1 3.82Å; L156-L201 HydrophobicContact CD1-CD2 3.66Å; L156-L201 HydrophobicContact CD1-CG 4.38Å; L156-L201 HydrophobicContact CD2-CD2 3.88Å; L156-L201 HydrophobicContact CG-CD2 4Å; L156-L235 HydrophobicContact CD1-CB 4.12Å; L156-L235 HydrophobicContact CD1-CD1 3.93Å; L156-M236 HydrophobicContact CD2-SD 4.14Å; L156-W611 HydrophobicContact CD2-CH2 4.5Å
157	A	93.3	Very high	92.3	Very high	43 Å²	43	52.4 Å²	52.4	36%	0.355	30%	0.301	S	S	.	.	H	α-helix	trans	-62.6	-42	175.2	0	0	0	0	0	111.4	I153 L154 L160 C161	I153-A157 WeakPolarHBondContact O-CB 3.35Å; I153-A157 PolarHBondContact O-N 3.47Å; L154-A157 PolarHBondContact O-N 2.9Å; A157-L160 PolarHBondContact O-N 3.33Å; A157-C161 WeakPolarHBondContact O-CB 3.32Å; A157-C161 PolarHBondContact O-N 2.85Å; A157-C161 PolarHBondContact O-SG 3.23Å
158	L	95.1	Very high	92.6	Very high	106 Å²	106	50.3 Å²	50.3	56%	0.555	28%	0.284	S	S	*	.	H	α-helix	trans	-62.4	-42.7	174.7	-71.5	172	0	0	0	111.9	L154 L155 L156 C161 L162	L154-L158 HydrophobicContact CG-CD1 4.48Å; L154-L158 WeakPolarHBondContact O-CG 3.26Å; L154-L158 PolarHBondContact O-N 3.48Å; L155-L158 PolarHBondContact O-N 3.01Å; L156-L158 VanDerWaalsContact C-N 3.34Å; L158-C161 PolarHBondContact O-N 2.93Å; L158-L162 VanDerWaalsContact O-CB 3.32Å; L158-L162 WeakPolarHBondContact O-CB 3.35Å; L158-L162 PolarHBondContact O-N 2.82Å
159	H	95.4	Very high	93	Very high	17 Å²	17	52.9 Å²	52.9	8%	0.079	30%	0.3	C	S	.	.	H	α-helix	trans	-59.3	-48.4	174.6	174.3	69.3	0	0	0	111.5	L155 L156 L162 F163 F227 L235	L155-H159 PolarHBondContact O-N 3.39Å; L156-H159 WeakPolarHBondContact O-CB 3.47Å; L156-H159 PolarHBondContact O-N 3.21Å; H159-L162 PolarHBondContact O-N 3.24Å; H159-F163 AromaticContact CE1-CD2 3.39Å; H159-F163 WeakPolarHBondContact CE1-CD2 3.38Å; H159-F163 AromaticContact CE1-CE2 3.28Å; H159-F163 WeakPolarHBondContact CE1-CE2 3.37Å; H159-F163 AromaticContact ND1-CD2 3.46Å; H159-F163 WeakPolarHBondContact ND1-CD2 3.46Å; H159-F163 AromaticContact ND1-CE2 3.41Å; H159-F163 WeakPolarHBondContact ND1-CE2 3.47Å; H159-F163 WeakPolarHBondContact O-CD2 3.49Å; H159-F163 PolarHBondContact O-N 3.45Å; H159-F227 AromaticContact CD2-CE2 3.86Å; H159-F227 AromaticContact CE1-CD2 3.83Å; H159-F227 AromaticContact NE2-CD2 3.33Å; H159-F227 VanDerWaalsContact NE2-CD2 3.33Å; H159-F227 WeakPolarHBondContact NE2-CD2 3.41Å; H159-F227 AromaticContact NE2-CE2 3.38Å; H159-F227 WeakPolarHBondContact NE2-CE2 3.09Å; H159-F227 PolarHBondContact NE2-O 3.01Å; H159-L235 HydrophobicContact CB-CD1 3.73Å
160	L	95.8	Very high	93.2	Very high	15 Å²	15	56.1 Å²	56.1	8%	0.079	32%	0.317	C	S	.	.	H	α-helix	trans	-58.7	-52.4	176	-73.1	170.5	0	0	0	111.2	L156 A157 L162 F163 T164 L194 L197 L198 L201 F227	L156-L160 WeakPolarHBondContact O-CG 3.1Å; L156-L160 PolarHBondContact O-N 3.08Å; A157-L160 PolarHBondContact O-N 3.33Å; L160-L162 PolarHBondContact O-N 3.48Å; L160-F163 PolarHBondContact O-N 3.27Å; L160-T164 WeakPolarHBondContact O-CB 3.23Å; L160-T164 PolarHBondContact O-N 3.39Å; L160-T164 PolarHBondContact O-OG1 3.42Å; L160-L194 HydrophobicContact CB-CD1 4.01Å; L160-L197 HydrophobicContact CD2-CB 4.39Å; L160-L198 HydrophobicContact CD1-CD1 3.84Å; L160-L201 HydrophobicContact CD1-CD2 4.35Å; L160-L201 HydrophobicContact CD2-CB 4.42Å; L160-L201 HydrophobicContact CD2-CD2 4.4Å; L160-F227 HydrophobicContact CD2-CE2 4.09Å; L160-F227 HydrophobicContact CD2-CZ 3.87Å
161	C	95.8	Very high	93.3	Very high	69 Å²	69	54.3 Å²	54.3	47%	0.466	30%	0.3	S	S	.	.	H	α-helix	trans	-59.3	-43.4	-179.3	-69.6	0	0	0	0	112.7	A157 L158 T164 M165	A157-C161 WeakPolarHBondContact O-CB 3.32Å; A157-C161 PolarHBondContact O-N 2.85Å; A157-C161 PolarHBondContact O-SG 3.23Å; L158-C161 PolarHBondContact O-N 2.93Å; C161-T164 PolarHBondContact O-N 3.4Å; C161-M165 WeakPolarHBondContact O-CG 3.44Å; C161-M165 PolarHBondContact O-N 3.2Å
162	L	96.5	Very high	93.1	Very high	104 Å²	104	53.1 Å²	53.1	55%	0.545	30%	0.295	S	S	.	.	H	α-helix	trans	-62.1	-50.4	178.8	-176.4	151.1	0	0	0	111.1	L158 H159 L160 T164 M165 V166	L158-L162 VanDerWaalsContact O-CB 3.32Å; L158-L162 WeakPolarHBondContact O-CB 3.35Å; L158-L162 PolarHBondContact O-N 2.82Å; H159-L162 PolarHBondContact O-N 3.24Å; L160-L162 PolarHBondContact O-N 3.48Å; L162-T164 VanDerWaalsContact C-N 3.32Å; L162-T164 PolarHBondContact O-N 3.17Å; L162-M165 PolarHBondContact O-N 3.3Å; L162-V166 HydrophobicContact CD2-CG2 4.07Å; L162-V166 WeakPolarHBondContact O-CG2 3.44Å; L162-V166 PolarHBondContact O-N 3.15Å
163	F	96.9	Very high	93	Very high	24 Å²	24	59.4 Å²	59.4	11%	0.105	32%	0.321	C	S	.	.	H	α-helix	trans	-70.3	-28.7	-179.5	-84.8	-98	0	0	0	112.7	H159 L160 G167 L197 F223 I226 F227 I230	H159-F163 AromaticContact CE1-CD2 3.39Å; H159-F163 WeakPolarHBondContact CE1-CD2 3.38Å; H159-F163 AromaticContact CE1-CE2 3.28Å; H159-F163 WeakPolarHBondContact CE1-CE2 3.37Å; H159-F163 AromaticContact ND1-CD2 3.46Å; H159-F163 WeakPolarHBondContact ND1-CD2 3.46Å; H159-F163 AromaticContact ND1-CE2 3.41Å; H159-F163 WeakPolarHBondContact ND1-CE2 3.47Å; H159-F163 WeakPolarHBondContact O-CD2 3.49Å; H159-F163 PolarHBondContact O-N 3.45Å; L160-F163 PolarHBondContact O-N 3.27Å; F163-G167 WeakPolarHBondContact O-CA 3.44Å; F163-G167 PolarHBondContact O-N 2.97Å; F163-L197 VanDerWaalsContact C-CD1 3.48Å; F163-L197 HydrophobicContact CB-CD1 3.99Å; F163-F223 HydrophobicContact CB-CZ 4.49Å; F163-F223 HydrophobicContact CD1-CD2 4.21Å; F163-F223 AromaticContact CD1-CE2 3.57Å; F163-F223 HydrophobicContact CD1-CE2 3.57Å; F163-F223 AromaticContact CD1-CZ 3.94Å; F163-F223 HydrophobicContact CD1-CZ 3.94Å; F163-F223 HydrophobicContact CE1-CD2 4.43Å; F163-F223 HydrophobicContact CE1-CE2 4.21Å; F163-I226 HydrophobicContact CE1-CG2 4.27Å; F163-I226 HydrophobicContact CZ-CG2 3.98Å; F163-F227 HydrophobicContact CB-CD2 3.71Å; F163-F227 HydrophobicContact CB-CE2 4.07Å; F163-F227 HydrophobicContact CD1-CB 3.88Å; F163-F227 AromaticContact CD1-CD2 3.79Å; F163-F227 HydrophobicContact CD1-CD2 3.79Å; F163-F227 HydrophobicContact CD1-CG 4.3Å; F163-F227 HydrophobicContact CD2-CD2 4.19Å; F163-F227 HydrophobicContact CE1-CB 3.96Å; F163-F227 HydrophobicContact CE1-CD2 4.46Å; F163-F227 AromaticContact CG-CD2 3.63Å; F163-F227 HydrophobicContact CG-CD2 3.63Å; F163-F227 HydrophobicContact CG-CE2 4.39Å; F163-I230 HydrophobicContact CZ-CD1 4.31Å
164	T	96.4	Very high	92.7	Very high	1 Å²	1	61.4 Å²	61.4	1%	0.006	33%	0.332	C	S	.	.	H	α-helix	trans	-62.2	-46.2	170.3	-60.3	0	0	0	0	110.9	L160 C161 L162 G167 M168 L190 L194	L160-T164 WeakPolarHBondContact O-CB 3.23Å; L160-T164 PolarHBondContact O-N 3.39Å; L160-T164 PolarHBondContact O-OG1 3.42Å; C161-T164 PolarHBondContact O-N 3.4Å; L162-T164 VanDerWaalsContact C-N 3.32Å; L162-T164 PolarHBondContact O-N 3.17Å; T164-G167 PolarHBondContact O-N 2.84Å; T164-M168 HydrophobicContact CG2-CE 4.3Å; T164-M168 WeakPolarHBondContact O-CG 3.3Å; T164-M168 PolarHBondContact O-N 3.23Å; T164-L190 HydrophobicContact CG2-CD1 3.77Å; T164-L194 HydrophobicContact CG2-CB 4.28Å
165	M	95.4	Very high	92	Very high	107 Å²	107	61.3 Å²	61.3	53%	0.527	35%	0.348	S	S	.	.	H	α-helix	trans	-65.5	-44.9	178	-67.5	-61.8	-69	0	0	111.8	C161 L162 M168 L169 L190	C161-M165 WeakPolarHBondContact O-CG 3.44Å; C161-M165 PolarHBondContact O-N 3.2Å; L162-M165 PolarHBondContact O-N 3.3Å; M165-M168 PolarHBondContact O-N 3.04Å; M165-M168 HydrophobicContact SD-CE 3.62Å; M165-L169 WeakPolarHBondContact O-CG 3.47Å; M165-L169 PolarHBondContact O-N 3.47Å; M165-L169 VanDerWaalsContact O-N 3.17Å; M165-L190 HydrophobicContact SD-CD1 4.38Å
166	V	95.5	Very high	91.4	Very high	64 Å²	64	61.5 Å²	61.5	39%	0.388	35%	0.349	S	S	.	.	H	α-helix	trans	-62.2	-43.8	176	174.2	0	0	0	0	111.1	L162 L169 L170 F223	L162-V166 HydrophobicContact CD2-CG2 4.07Å; L162-V166 WeakPolarHBondContact O-CG2 3.44Å; L162-V166 PolarHBondContact O-N 3.15Å; V166-L169 PolarHBondContact O-N 3Å; V166-L170 WeakPolarHBondContact O-CB 3.26Å; V166-L170 PolarHBondContact O-N 3.39Å; V166-F223 HydrophobicContact CB-CE2 4.28Å; V166-F223 HydrophobicContact CG1-CD2 4.27Å; V166-F223 HydrophobicContact CG1-CE2 3.84Å
167	G	93.8	Very high	90.6	Very high	0 Å²	0	68.8 Å²	68.8	0%	0	38%	0.383	C	S	.	.	H	α-helix	trans	-63.1	-42.7	179.1	0	0	0	0	0	112.9	F163 T164 L169 L170 F171	F163-G167 WeakPolarHBondContact O-CA 3.44Å; F163-G167 PolarHBondContact O-N 2.97Å; T164-G167 PolarHBondContact O-N 2.84Å; G167-L169 VanDerWaalsContact C-N 3.29Å; G167-L169 PolarHBondContact O-N 3.25Å; G167-L170 PolarHBondContact O-N 3.32Å; G167-F171 WeakPolarHBondContact O-CB 3.17Å; G167-F171 VanDerWaalsContact O-CD2 3.29Å; G167-F171 WeakPolarHBondContact O-CD2 3.39Å; G167-F171 PolarHBondContact O-N 3.24Å
168	M	93.2	Very high	89.6	Confident	45 Å²	45	76.5 Å²	76.5	22%	0.222	41%	0.408	C	S	.	.	H	α-helix	trans	-65.2	-31.4	175.5	-72.1	-169.6	-54.9	0	0	113.2	T164 M165 A172 L190 S193	T164-M168 HydrophobicContact CG2-CE 4.3Å; T164-M168 WeakPolarHBondContact O-CG 3.3Å; T164-M168 PolarHBondContact O-N 3.23Å; M165-M168 PolarHBondContact O-N 3.04Å; M165-M168 HydrophobicContact SD-CE 3.62Å; M168-A172 PolarHBondContact O-N 3.14Å; M168-L190 HydrophobicContact CE-CB 4.43Å; M168-L190 HydrophobicContact CE-CD1 3.71Å; M168-L190 HydrophobicContact SD-CB 4.38Å; M168-L190 HydrophobicContact SD-CD1 4.49Å; M168-S193 WeakPolarHBondContact CG-OG 3.37Å
169	L	92.5	Very high	88.7	Confident	139 Å²	139	76.2 Å²	76.2	73%	0.728	40%	0.403	S	S	*	.	H	α-helix	trans	-75.6	-39.5	174.3	-70.7	172.3	0	0	0	112.1	M165 V166 G167	M165-L169 WeakPolarHBondContact O-CG 3.47Å; M165-L169 PolarHBondContact O-N 3.47Å; M165-L169 VanDerWaalsContact O-N 3.17Å; V166-L169 PolarHBondContact O-N 3Å; G167-L169 VanDerWaalsContact C-N 3.29Å; G167-L169 PolarHBondContact O-N 3.25Å
170	L	91.1	Very high	88	Confident	73 Å²	73	76 Å²	76	38%	0.382	40%	0.402	S	S	.	.	H	α-helix	trans	-72.4	-40.1	-178	-170	65.8	0	0	0	112.1	V166 G167 Y220 F223	V166-L170 WeakPolarHBondContact O-CB 3.26Å; V166-L170 PolarHBondContact O-N 3.39Å; G167-L170 PolarHBondContact O-N 3.32Å; L170-Y220 HydrophobicContact CD1-CD1 4.47Å; L170-Y220 HydrophobicContact CD1-CE1 3.94Å; L170-Y220 HydrophobicContact CD2-CD1 4.02Å; L170-Y220 HydrophobicContact CD2-CE1 4.26Å; L170-Y220 HydrophobicContact CG-CD1 4.18Å; L170-Y220 HydrophobicContact CG-CE1 3.9Å; L170-F223 HydrophobicContact CD2-CB 4.12Å; L170-F223 HydrophobicContact CD2-CD2 4.11Å; L170-F223 HydrophobicContact CD2-CG 4.1Å
171	F	90.4	Very high	87.4	Confident	12 Å²	12	76.6 Å²	76.6	5%	0.053	41%	0.412	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.3	41.2	-178.9	-52	-59.9	0	0	0	111.4	G167 E182 W183 F187 A213 Y220 F223 F224	G167-F171 WeakPolarHBondContact O-CB 3.17Å; G167-F171 VanDerWaalsContact O-CD2 3.29Å; G167-F171 WeakPolarHBondContact O-CD2 3.39Å; G167-F171 PolarHBondContact O-N 3.24Å; F171-E182 HydrophobicContact CB-CB 4.4Å; F171-E182 HydrophobicContact CD1-CB 4.49Å; F171-E182 HydrophobicContact CG-CB 4.48Å; F171-W183 WeakPolarHBondContact O-CB 3.21Å; F171-W183 VanDerWaalsContact O-CD1 3.32Å; F171-F187 HydrophobicContact CB-CB 4.08Å; F171-F187 HydrophobicContact CB-CD2 4.15Å; F171-F187 HydrophobicContact CB-CG 4.2Å; F171-F187 HydrophobicContact CD2-CD1 4.3Å; F171-F187 AromaticContact CD2-CD2 3.59Å; F171-F187 HydrophobicContact CD2-CD2 3.59Å; F171-F187 HydrophobicContact CD2-CE1 4.34Å; F171-F187 AromaticContact CD2-CE2 3.63Å; F171-F187 HydrophobicContact CD2-CE2 3.63Å; F171-F187 AromaticContact CD2-CG 3.94Å; F171-F187 HydrophobicContact CD2-CG 3.94Å; F171-F187 HydrophobicContact CD2-CZ 4.02Å; F171-F187 HydrophobicContact CE2-CD2 4.36Å; F171-F187 AromaticContact CE2-CE2 3.94Å; F171-F187 HydrophobicContact CE2-CE2 3.94Å; F171-F187 HydrophobicContact CE2-CZ 4.15Å; F171-F187 HydrophobicContact CG-CD2 4.15Å; F171-A213 HydrophobicContact CE1-CB 3.82Å; F171-A213 HydrophobicContact CZ-CB 4.17Å; F171-Y220 AromaticContact CE1-CD1 3.59Å; F171-Y220 HydrophobicContact CE1-CD1 3.59Å; F171-Y220 HydrophobicContact CE1-CD2 4.3Å; F171-Y220 AromaticContact CE1-CE1 4Å; F171-Y220 HydrophobicContact CE1-CE1 4Å; F171-Y220 AromaticContact CE1-CG 3.78Å; F171-Y220 HydrophobicContact CE1-CG 3.78Å; F171-Y220 HydrophobicContact CZ-CD1 4.15Å; F171-Y220 HydrophobicContact CZ-CG 4.39Å; F171-F223 AromaticContact CE2-CD1 3.85Å; F171-F223 HydrophobicContact CE2-CD1 3.85Å; F171-F223 AromaticContact CE2-CE1 3.94Å; F171-F223 HydrophobicContact CE2-CE1 3.94Å; F171-F223 HydrophobicContact CE2-CG 4.49Å; F171-F223 HydrophobicContact CZ-CD1 4.2Å; F171-F224 HydrophobicContact CE2-CE2 4.19Å; F171-F224 AromaticContact CE2-CZ 3.88Å; F171-F224 HydrophobicContact CE2-CZ 3.88Å; F171-F224 AromaticContact CZ-CE2 3.8Å; F171-F224 HydrophobicContact CZ-CE2 3.8Å; F171-F224 AromaticContact CZ-CZ 3.95Å; F171-F224 HydrophobicContact CZ-CZ 3.95Å
172	A	85.7	Confident	86.8	Confident	47 Å²	47	73.5 Å²	73.5	39%	0.388	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-67.6	156.3	175.2	0	0	0	0	0	111.6	M168 N174	M168-A172 PolarHBondContact O-N 3.14Å; A172-N174 PolarHBondContact O-N 3.15Å
173	K	85.6	Confident	86.4	Confident	139 Å²	139	71.1 Å²	71.1	60%	0.604	37%	0.374	S	S	*	.	P	Polyproline II helix	trans	-58.7	120	179.8	-169.6	-176.3	-176.9	-178.8	0	111.1	W183	K173-W183 HydrophobicContact CB-CD2 3.81Å; K173-W183 HydrophobicContact CB-CE3 4.31Å; K173-W183 HydrophobicContact CB-CG 4.18Å; K173-W183 HydrophobicContact CB-CH2 4.49Å; K173-W183 HydrophobicContact CB-CZ2 4.02Å; K173-W183 HydrophobicContact CD-CE3 4.46Å; K173-W183 HydrophobicContact CD-CH2 3.66Å; K173-W183 HydrophobicContact CD-CZ2 3.84Å; K173-W183 HydrophobicContact CD-CZ3 3.99Å; K173-W183 HydrophobicContact CG-CD2 4.03Å; K173-W183 HydrophobicContact CG-CE3 3.99Å; K173-W183 HydrophobicContact CG-CH2 4.08Å; K173-W183 HydrophobicContact CG-CZ2 4.11Å; K173-W183 HydrophobicContact CG-CZ3 4.02Å
174	N	82.9	Confident	85.9	Confident	83 Å²	83	75.3 Å²	75.3	44%	0.444	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-93.6	160.9	173	-72.1	-47.3	0	0	0	111.5	A172 D176 N180	A172-N174 PolarHBondContact O-N 3.15Å; N174-D176 PolarHBondContact O-N 2.89Å; N174-N180 WeakPolarHBondContact CA-OD1 3.19Å; N174-N180 WeakPolarHBondContact CB-OD1 3.36Å; N174-N180 PolarHBondContact N-OD1 3Å; N174-N180 PolarHBondContact O-ND2 2.94Å; N174-N180 PolarHBondContact O-OD1 3.21Å
175	A	77.6	Confident	85.4	Confident	109 Å²	109	80.4 Å²	80.4	90%	0.901	42%	0.421	S	S	*	.	S	Bend	trans	-64.6	-30.6	174.8	0	0	0	0	0	112.4	Q177	A175-Q177 PolarHBondContact O-N 3Å
176	D	78.4	Confident	85.1	Confident	85 Å²	85	76.9 Å²	76.9	46%	0.455	40%	0.403	S	S	.	.			trans	-81.5	110.9	178.9	-64.7	-28.7	0	0	0	111.4	N174 K178 K179 N180	N174-D176 PolarHBondContact O-N 2.89Å; D176-K178 PolarHBondContact O-N 3.33Å; D176-K179 HydrophobicContact CB-CB 4.25Å; D176-K179 HydrophobicContact CB-CD 3.96Å; D176-K179 HydrophobicContact CB-CG 3.97Å; D176-K179 PolarHBondContact O-N 2.98Å; D176-K179 WeakPolarHBondContact OD2-CE 3.49Å; D176-K179 IonicContact OD2-NZ 2.73Å; D176-K179 PolarHBondContact OD2-NZ 3.32Å; D176-N180 PolarHBondContact O-ND2 3.2Å
177	Q	74.7	Confident	85	Confident	163 Å²	163	73.9 Å²	73.9	76%	0.762	39%	0.385	S	S	*	.	G	3₁₀ helix	trans	-60.3	-30.3	-179	-165.7	159.7	-6.7	0	0	113.6	A175 K179 N180	A175-Q177 PolarHBondContact O-N 3Å; Q177-K179 PolarHBondContact O-N 3.03Å; Q177-N180 PolarHBondContact O-N 3.4Å
178	K	73.9	Confident	84.8	Confident	204 Å²	204	78.8 Å²	78.8	89%	0.887	41%	0.406	S	S	*	.	G	3₁₀ helix	trans	-67.3	-18.5	175.5	-67.1	-176.4	179.7	179.8	0	114	D176	D176-K178 PolarHBondContact O-N 3.33Å
179	K	76.1	Confident	84.7	Confident	101 Å²	101	81 Å²	81	44%	0.439	42%	0.419	S	S	.	.	G	3₁₀ helix	trans	-96.8	-0.9	178.5	-61.7	-177.7	-177.7	153.5	0	113	D176 Q177 L216	D176-K179 HydrophobicContact CB-CB 4.25Å; D176-K179 HydrophobicContact CB-CD 3.96Å; D176-K179 HydrophobicContact CB-CG 3.97Å; D176-K179 PolarHBondContact O-N 2.98Å; D176-K179 WeakPolarHBondContact OD2-CE 3.49Å; D176-K179 IonicContact OD2-NZ 2.73Å; D176-K179 PolarHBondContact OD2-NZ 3.32Å; Q177-K179 PolarHBondContact O-N 3.03Å; K179-L216 HydrophobicContact CB-CD1 4.15Å; K179-L216 HydrophobicContact CB-CD2 4.36Å; K179-L216 HydrophobicContact CG-CD2 4.04Å; K179-L216 WeakPolarHBondContact O-CD1 3.46Å
180	N	80.4	Confident	84.6	Confident	11 Å²	11	79.3 Å²	79.3	6%	0.059	41%	0.41	C	S	.	.			trans	-96.4	7.1	-172.1	-69.9	-20.3	0	0	0	114.3	N174 D176 Q177 E182 W183 E184	N174-N180 WeakPolarHBondContact CA-OD1 3.19Å; N174-N180 WeakPolarHBondContact CB-OD1 3.36Å; N174-N180 PolarHBondContact N-OD1 3Å; N174-N180 PolarHBondContact O-ND2 2.94Å; N174-N180 PolarHBondContact O-OD1 3.21Å; D176-N180 PolarHBondContact O-ND2 3.2Å; Q177-N180 PolarHBondContact O-N 3.4Å; N180-E182 VanDerWaalsContact C-N 3.35Å; N180-E182 PolarHBondContact O-N 3.46Å; N180-W183 HydrophobicContact CB-CE3 4.32Å; N180-W183 PolarHBondContact O-N 3.02Å; N180-E184 WeakPolarHBondContact O-CB 3.28Å; N180-E184 PolarHBondContact O-N 3.43Å
181	G	81.6	Confident	84.6	Confident	28 Å²	28	79.8 Å²	79.8	29%	0.289	42%	0.416	S	S	.	.	H	α-helix	trans	-55.2	-46.4	-177.7	0	0	0	0	0	113.2	E184 L185	G181-E184 PolarHBondContact O-N 3.31Å; G181-L185 WeakPolarHBondContact O-CB 3.1Å; G181-L185 VanDerWaalsContact O-CG 3.29Å; G181-L185 WeakPolarHBondContact O-CG 3.38Å; G181-L185 PolarHBondContact O-N 2.89Å; G181-L185 VanDerWaalsContact O-N 3.1Å
182	E	84.9	Confident	84.6	Confident	4 Å²	4	81.3 Å²	81.3	2%	0.019	43%	0.427	C	S	.	.	H	α-helix	trans	-63.5	-46.9	176.4	-76.7	-58.7	155.9	0	0	113.8	F171 N180 E184 H186 F187 P212 A213	F171-E182 HydrophobicContact CB-CB 4.4Å; F171-E182 HydrophobicContact CD1-CB 4.49Å; F171-E182 HydrophobicContact CG-CB 4.48Å; N180-E182 VanDerWaalsContact C-N 3.35Å; N180-E182 PolarHBondContact O-N 3.46Å; E182-E184 VanDerWaalsContact C-N 3.28Å; E182-E184 PolarHBondContact O-N 3.13Å; E182-H186 PolarHBondContact O-N 3.41Å; E182-H186 IonicContact OE2-CD2 3.08Å; E182-F187 PolarHBondContact O-N 2.6Å; E182-F187 VanDerWaalsContact O-N 3.08Å; E182-P212 HydrophobicContact CG-CB 3.82Å; E182-P212 VanDerWaalsContact OE1-C 3.28Å; E182-P212 VanDerWaalsContact OE1-CA 3.28Å; E182-P212 WeakPolarHBondContact OE1-CA 3.49Å; E182-P212 WeakPolarHBondContact OE1-CB 3.19Å; E182-P212 WeakPolarHBondContact OE1-CD 3.27Å; E182-P212 WeakPolarHBondContact OE1-CG 3.47Å; E182-P212 VanDerWaalsContact OE1-N 3.15Å; E182-A213 VanDerWaalsContact CD-N 3.32Å; E182-A213 HydrophobicContact CG-CB 3.53Å; E182-A213 PolarHBondContact OE1-N 3.37Å
183	W	88.3	Confident	85.1	Confident	54 Å²	54	79.1 Å²	79.1	21%	0.205	41%	0.408	C	S	.	.	H	α-helix	trans	-61	-42.2	-179.6	172.7	73.8	0	0	0	110.6	F171 K173 N180 F187 K188	F171-W183 WeakPolarHBondContact O-CB 3.21Å; F171-W183 VanDerWaalsContact O-CD1 3.32Å; K173-W183 HydrophobicContact CB-CD2 3.81Å; K173-W183 HydrophobicContact CB-CE3 4.31Å; K173-W183 HydrophobicContact CB-CG 4.18Å; K173-W183 HydrophobicContact CB-CH2 4.49Å; K173-W183 HydrophobicContact CB-CZ2 4.02Å; K173-W183 HydrophobicContact CD-CE3 4.46Å; K173-W183 HydrophobicContact CD-CH2 3.66Å; K173-W183 HydrophobicContact CD-CZ2 3.84Å; K173-W183 HydrophobicContact CD-CZ3 3.99Å; K173-W183 HydrophobicContact CG-CD2 4.03Å; K173-W183 HydrophobicContact CG-CE3 3.99Å; K173-W183 HydrophobicContact CG-CH2 4.08Å; K173-W183 HydrophobicContact CG-CZ2 4.11Å; K173-W183 HydrophobicContact CG-CZ3 4.02Å; N180-W183 HydrophobicContact CB-CE3 4.32Å; N180-W183 PolarHBondContact O-N 3.02Å; W183-F187 CarbonylContact O-C 3.5Å; W183-K188 HydrophobicContact CH2-CG 4.49Å; W183-K188 HydrophobicContact CZ2-CG 4.07Å; W183-K188 WeakPolarHBondContact O-CA 3.5Å; W183-K188 VanDerWaalsContact O-CB 3.24Å; W183-K188 WeakPolarHBondContact O-CB 3.5Å; W183-K188 PolarHBondContact O-N 3.45Å
184	E	86.1	Confident	85.5	Confident	112 Å²	112	75.5 Å²	75.5	52%	0.523	40%	0.395	S	S	.	.	H	α-helix	trans	-72.3	-40.1	-176.7	-173.4	164.4	-162.5	0	0	112.7	N180 G181 E182	N180-E184 WeakPolarHBondContact O-CB 3.28Å; N180-E184 PolarHBondContact O-N 3.43Å; G181-E184 PolarHBondContact O-N 3.31Å; E182-E184 VanDerWaalsContact C-N 3.28Å; E182-E184 PolarHBondContact O-N 3.13Å
185	L	85.6	Confident	86	Confident	108 Å²	108	72.7 Å²	72.7	57%	0.565	38%	0.381	S	S	*	.	H	α-helix	trans	-84.6	-42.8	-174.9	-67.1	171.2	0	0	0	113.6	G181 P212	G181-L185 WeakPolarHBondContact O-CB 3.1Å; G181-L185 VanDerWaalsContact O-CG 3.29Å; G181-L185 WeakPolarHBondContact O-CG 3.38Å; G181-L185 PolarHBondContact O-N 2.89Å; G181-L185 VanDerWaalsContact O-N 3.1Å; L185-P212 HydrophobicContact CD1-CG 4.41Å
186	H	89.9	Confident	86.8	Confident	33 Å²	33	68.2 Å²	68.2	15%	0.153	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121.6	-42.3	-166.9	-60.8	-45.5	0	0	0	113.1	E182 T192 S193 V209	E182-H186 PolarHBondContact O-N 3.41Å; E182-H186 IonicContact OE2-CD2 3.08Å; H186-T192 CarbonylContact O-C 3.53Å; H186-S193 VanDerWaalsContact O-CA 3.23Å; H186-S193 WeakPolarHBondContact O-CA 3.42Å; H186-S193 PolarHBondContact O-N 3.29Å; H186-V209 HydrophobicContact CB-CG2 4.38Å
187	F	92.6	Very high	87.6	Confident	2 Å²	2	64.1 Å²	64.1	1%	0.009	32%	0.321	C	S	.	.	S	Bend	trans	-105.7	20.7	-168	-67	-81.4	0	0	0	115.7	F171 E182 W183 S193 L197 F223 F224	F171-F187 HydrophobicContact CB-CB 4.08Å; F171-F187 HydrophobicContact CB-CD2 4.15Å; F171-F187 HydrophobicContact CB-CG 4.2Å; F171-F187 HydrophobicContact CD2-CD1 4.3Å; F171-F187 AromaticContact CD2-CD2 3.59Å; F171-F187 HydrophobicContact CD2-CD2 3.59Å; F171-F187 HydrophobicContact CD2-CE1 4.34Å; F171-F187 AromaticContact CD2-CE2 3.63Å; F171-F187 HydrophobicContact CD2-CE2 3.63Å; F171-F187 AromaticContact CD2-CG 3.94Å; F171-F187 HydrophobicContact CD2-CG 3.94Å; F171-F187 HydrophobicContact CD2-CZ 4.02Å; F171-F187 HydrophobicContact CE2-CD2 4.36Å; F171-F187 AromaticContact CE2-CE2 3.94Å; F171-F187 HydrophobicContact CE2-CE2 3.94Å; F171-F187 HydrophobicContact CE2-CZ 4.15Å; F171-F187 HydrophobicContact CG-CD2 4.15Å; E182-F187 PolarHBondContact O-N 2.6Å; E182-F187 VanDerWaalsContact O-N 3.08Å; W183-F187 CarbonylContact O-C 3.5Å; F187-S193 VanDerWaalsContact CA-OG 3.26Å; F187-S193 WeakPolarHBondContact CA-OG 3.41Å; F187-L197 HydrophobicContact CE1-CD1 4.3Å; F187-L197 HydrophobicContact CE1-CD2 4.24Å; F187-L197 HydrophobicContact CE1-CG 4.18Å; F187-L197 HydrophobicContact CZ-CD2 4.04Å; F187-L197 HydrophobicContact CZ-CG 4.43Å; F187-F223 HydrophobicContact CZ-CE1 4.29Å; F187-F224 HydrophobicContact CE2-CE1 4.21Å; F187-F224 HydrophobicContact CE2-CZ 4.12Å; F187-F224 HydrophobicContact CZ-CE1 4.14Å; F187-F224 HydrophobicContact CZ-CZ 4.41Å
188	K	89.5	Confident	88.6	Confident	103 Å²	103	57.1 Å²	57.1	45%	0.448	29%	0.289	S	S	.	.	S	Bend	trans	-67.8	-46.2	-173	-169	174.9	179.9	175.2	0	113.9	W183	W183-K188 HydrophobicContact CH2-CG 4.49Å; W183-K188 HydrophobicContact CZ2-CG 4.07Å; W183-K188 WeakPolarHBondContact O-CA 3.5Å; W183-K188 VanDerWaalsContact O-CB 3.24Å; W183-K188 WeakPolarHBondContact O-CB 3.5Å; W183-K188 PolarHBondContact O-N 3.45Å
189	N	91.3	Very high	89.6	Confident	92 Å²	92	47.5 Å²	47.5	49%	0.492	25%	0.247	S	C	.	.	S	Bend	trans	-138.2	152.4	-171.4	-69.6	-33	0	0	0	109.8	T191 T192 S193	N189-T191 VanDerWaalsContact C-N 3.29Å; N189-T191 PolarHBondContact O-N 3.28Å; N189-T191 VanDerWaalsContact O-N 3.16Å; N189-T192 PolarHBondContact O-N 2.99Å; N189-S193 WeakPolarHBondContact O-CB 3.32Å; N189-S193 PolarHBondContact O-N 3Å; N189-S193 PolarHBondContact O-OG 3.27Å
190	L	91.1	Very high	90.5	Very high	103 Å²	103	42.8 Å²	42.8	54%	0.539	23%	0.227	S	C	.	.	H	α-helix	trans	-49.4	-46.9	-179.5	-178.1	68	0	0	0	113	T164 M165 M168 L194	T164-L190 HydrophobicContact CG2-CD1 3.77Å; M165-L190 HydrophobicContact SD-CD1 4.38Å; M168-L190 HydrophobicContact CE-CB 4.43Å; M168-L190 HydrophobicContact CE-CD1 3.71Å; M168-L190 HydrophobicContact SD-CB 4.38Å; M168-L190 HydrophobicContact SD-CD1 4.49Å; L190-L194 WeakPolarHBondContact O-CB 3.45Å; L190-L194 PolarHBondContact O-N 3.16Å
191	T	90.9	Very high	91.2	Very high	82 Å²	82	42.3 Å²	42.3	50%	0.503	22%	0.224	S	C	.	.	H	α-helix	trans	-65.2	-43.4	-179.2	-48.2	0	0	0	0	112.4	N189 T195	N189-T191 VanDerWaalsContact C-N 3.29Å; N189-T191 PolarHBondContact O-N 3.28Å; N189-T191 VanDerWaalsContact O-N 3.16Å; T191-T195 WeakPolarHBondContact O-CB 3.36Å; T191-T195 PolarHBondContact O-N 3.16Å; T191-T195 PolarHBondContact O-OG1 2.98Å
192	T	90.5	Very high	91.8	Very high	45 Å²	45	41.9 Å²	41.9	28%	0.276	22%	0.216	S	C	.	.	H	α-helix	trans	-67.2	-47.8	178.9	-48.4	0	0	0	0	110.4	H186 N189 L194 T195 S196	H186-T192 CarbonylContact O-C 3.53Å; N189-T192 PolarHBondContact O-N 2.99Å; T192-L194 VanDerWaalsContact C-N 3.35Å; T192-L194 PolarHBondContact O-N 2.94Å; T192-T195 WeakPolarHBondContact O-CB 3.39Å; T192-T195 PolarHBondContact O-N 3.34Å; T192-T195 VanDerWaalsContact O-N 3.11Å; T192-S196 PolarHBondContact O-N 3.14Å; T192-S196 PolarHBondContact O-OG 3.18Å
193	S	94.4	Very high	92.2	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-59	-44.1	177.4	-52.4	0	0	0	0	112.1	M168 H186 F187 N189 L197	M168-S193 WeakPolarHBondContact CG-OG 3.37Å; H186-S193 VanDerWaalsContact O-CA 3.23Å; H186-S193 WeakPolarHBondContact O-CA 3.42Å; H186-S193 PolarHBondContact O-N 3.29Å; F187-S193 VanDerWaalsContact CA-OG 3.26Å; F187-S193 WeakPolarHBondContact CA-OG 3.41Å; N189-S193 WeakPolarHBondContact O-CB 3.32Å; N189-S193 PolarHBondContact O-N 3Å; N189-S193 PolarHBondContact O-OG 3.27Å; S193-L197 WeakPolarHBondContact O-CG 3.22Å; S193-L197 PolarHBondContact O-N 3.39Å
194	L	94.6	Very high	92.4	Very high	63 Å²	63	43.3 Å²	43.3	33%	0.33	23%	0.233	S	C	.	.	H	α-helix	trans	-64.4	-41.6	176	-177.3	65.3	0	0	0	111.3	L160 T164 L190 T192 L198	L160-L194 HydrophobicContact CB-CD1 4.01Å; T164-L194 HydrophobicContact CG2-CB 4.28Å; L190-L194 WeakPolarHBondContact O-CB 3.45Å; L190-L194 PolarHBondContact O-N 3.16Å; T192-L194 VanDerWaalsContact C-N 3.35Å; T192-L194 PolarHBondContact O-N 2.94Å; L194-L198 WeakPolarHBondContact O-CB 3.26Å; L194-L198 PolarHBondContact O-N 2.89Å
195	T	94	Very high	92.7	Very high	25 Å²	25	38.1 Å²	38.1	15%	0.153	21%	0.209	C	C	.	.	H	α-helix	trans	-65.5	-45.9	178.1	-53.8	0	0	0	0	110.9	T191 T192 L197 L198 V199 M592	T191-T195 WeakPolarHBondContact O-CB 3.36Å; T191-T195 PolarHBondContact O-N 3.16Å; T191-T195 PolarHBondContact O-OG1 2.98Å; T192-T195 WeakPolarHBondContact O-CB 3.39Å; T192-T195 PolarHBondContact O-N 3.34Å; T192-T195 VanDerWaalsContact O-N 3.11Å; T195-L197 PolarHBondContact O-N 3.4Å; T195-L198 PolarHBondContact O-N 2.89Å; T195-V199 VanDerWaalsContact O-CG2 3.29Å; T195-V199 WeakPolarHBondContact O-CG2 3.39Å; T195-V199 PolarHBondContact O-N 3.15Å; T195-M592 HydrophobicContact CG2-CE 3.34Å; T195-M592 HydrophobicContact CG2-SD 3.91Å
196	S	94.1	Very high	93	Very high	14 Å²	14	37.2 Å²	37.2	10%	0.098	20%	0.204	C	C	.	.	H	α-helix	trans	-62.2	-41.2	178.9	-64.2	0	0	0	0	112.4	T192 L200 N205	T192-S196 PolarHBondContact O-N 3.14Å; T192-S196 PolarHBondContact O-OG 3.18Å; S196-L200 WeakPolarHBondContact O-CB 3.04Å; S196-L200 PolarHBondContact O-N 2.94Å; S196-N205 PolarHBondContact O-ND2 2.99Å; S196-N205 VanDerWaalsContact O-ND2 3.11Å
197	L	95.8	Very high	93.2	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-72.6	-32.8	174.7	-68.7	-174.9	0	0	0	112.9	L160 F163 F187 S193 T195 L200 L201 F223 F227	L160-L197 HydrophobicContact CD2-CB 4.39Å; F163-L197 VanDerWaalsContact C-CD1 3.48Å; F163-L197 HydrophobicContact CB-CD1 3.99Å; F187-L197 HydrophobicContact CE1-CD1 4.3Å; F187-L197 HydrophobicContact CE1-CD2 4.24Å; F187-L197 HydrophobicContact CE1-CG 4.18Å; F187-L197 HydrophobicContact CZ-CD2 4.04Å; F187-L197 HydrophobicContact CZ-CG 4.43Å; S193-L197 WeakPolarHBondContact O-CG 3.22Å; S193-L197 PolarHBondContact O-N 3.39Å; T195-L197 PolarHBondContact O-N 3.4Å; L197-L200 HydrophobicContact CD2-CD2 4.1Å; L197-L200 PolarHBondContact O-N 3.26Å; L197-L201 PolarHBondContact O-N 3.39Å; L197-F223 HydrophobicContact CD2-CE1 4.43Å; L197-F227 HydrophobicContact CB-CE2 4.3Å; L197-F227 HydrophobicContact CB-CZ 3.99Å; L197-F227 HydrophobicContact CD2-CE1 4.45Å; L197-F227 HydrophobicContact CD2-CZ 4.41Å; L197-F227 VanDerWaalsContact O-CZ 3.24Å; L197-F227 WeakPolarHBondContact O-CZ 3.16Å
198	L	95.1	Very high	93.1	Very high	16 Å²	16	43.3 Å²	43.3	8%	0.084	24%	0.242	C	C	.	.	H	α-helix	trans	-64.7	-40.6	173.2	179.4	64.2	0	0	0	111.7	L160 L194 T195 L200 L201 W588 V608 W611	L160-L198 HydrophobicContact CD1-CD1 3.84Å; L194-L198 WeakPolarHBondContact O-CB 3.26Å; L194-L198 PolarHBondContact O-N 2.89Å; T195-L198 PolarHBondContact O-N 2.89Å; L198-L200 VanDerWaalsContact C-N 3.33Å; L198-L201 HydrophobicContact CD1-CD2 4.32Å; L198-L201 WeakPolarHBondContact O-CB 3.18Å; L198-L201 PolarHBondContact O-N 3.39Å; L198-W588 HydrophobicContact CD2-CH2 4.39Å; L198-V608 HydrophobicContact CD2-CB 4.48Å; L198-V608 HydrophobicContact CD2-CG1 4.11Å; L198-V608 HydrophobicContact CD2-CG2 3.5Å; L198-W611 HydrophobicContact CD1-CH2 3.85Å; L198-W611 HydrophobicContact CD1-CZ3 3.82Å
199	V	95.1	Very high	93.2	Very high	2 Å²	2	38.4 Å²	38.4	1%	0.012	22%	0.221	C	C	.	.	H	α-helix	trans	-68.9	-34.2	174	177.3	0	0	0	0	111.1	T195 T202 T203 A204 N205 W588 Q589 M592	T195-V199 VanDerWaalsContact O-CG2 3.29Å; T195-V199 WeakPolarHBondContact O-CG2 3.39Å; T195-V199 PolarHBondContact O-N 3.15Å; V199-T202 CarbonylContact O-C 3.55Å; V199-T202 PolarHBondContact O-N 3.43Å; V199-T202 PolarHBondContact O-OG1 2.91Å; V199-T203 PolarHBondContact O-N 3Å; V199-A204 HydrophobicContact CG1-CB 3.86Å; V199-A204 PolarHBondContact O-N 3.43Å; V199-N205 HydrophobicContact CG1-CB 3.72Å; V199-W588 HydrophobicContact CG2-CH2 4.46Å; V199-W588 HydrophobicContact CG2-CZ2 3.78Å; V199-Q589 HydrophobicContact CG1-CB 3.84Å; V199-Q589 HydrophobicContact CG1-CG 4.27Å; V199-Q589 HydrophobicContact CG2-CB 4.01Å; V199-M592 HydrophobicContact CG2-CE 3.65Å
200	L	95.2	Very high	93.3	Very high	1 Å²	1	35.6 Å²	35.6	1%	0.005	21%	0.205	C	C	.	.	H	α-helix	trans	-69	-33.8	174.5	-179.6	59.5	0	0	0	112.5	S196 L197 L198 T202 T203 N205 N206 V209 F224 F227	S196-L200 WeakPolarHBondContact O-CB 3.04Å; S196-L200 PolarHBondContact O-N 2.94Å; L197-L200 HydrophobicContact CD2-CD2 4.1Å; L197-L200 PolarHBondContact O-N 3.26Å; L198-L200 VanDerWaalsContact C-N 3.33Å; L200-T202 PolarHBondContact O-N 2.96Å; L200-T203 WeakPolarHBondContact O-CA 3.49Å; L200-T203 PolarHBondContact O-N 3.37Å; L200-N205 WeakPolarHBondContact CA-OD1 3.4Å; L200-N205 WeakPolarHBondContact CB-OD1 3.43Å; L200-N205 PolarHBondContact N-OD1 2.96Å; L200-N206 HydrophobicContact CD1-CB 4.09Å; L200-V209 HydrophobicContact CB-CG1 4.4Å; L200-V209 HydrophobicContact CD1-CG1 3.8Å; L200-V209 HydrophobicContact CD2-CG1 3.99Å; L200-V209 HydrophobicContact CG-CG1 4.27Å; L200-F224 HydrophobicContact CD2-CD1 3.64Å; L200-F224 HydrophobicContact CD2-CE1 4.38Å; L200-F227 HydrophobicContact CB-CD1 4.48Å; L200-F227 HydrophobicContact CB-CE1 3.9Å; L200-F227 HydrophobicContact CD2-CD1 3.51Å; L200-F227 HydrophobicContact CD2-CE1 3.76Å; L200-F227 HydrophobicContact CD2-CG 4.5Å; L200-F227 HydrophobicContact CG-CD1 3.79Å; L200-F227 HydrophobicContact CG-CE1 3.67Å
201	L	94.8	Very high	93.3	Very high	1 Å²	1	34.9 Å²	34.9	1%	0.005	20%	0.2	C	C	.	.	H	α-helix	trans	-57.2	-34.3	174.1	177.4	70.7	0	0	0	111.1	L156 L160 L197 L198 T203 F227 T232 M236 W611	L156-L201 HydrophobicContact CD1-CD1 3.82Å; L156-L201 HydrophobicContact CD1-CD2 3.66Å; L156-L201 HydrophobicContact CD1-CG 4.38Å; L156-L201 HydrophobicContact CD2-CD2 3.88Å; L156-L201 HydrophobicContact CG-CD2 4Å; L160-L201 HydrophobicContact CD1-CD2 4.35Å; L160-L201 HydrophobicContact CD2-CB 4.42Å; L160-L201 HydrophobicContact CD2-CD2 4.4Å; L197-L201 PolarHBondContact O-N 3.39Å; L198-L201 HydrophobicContact CD1-CD2 4.32Å; L198-L201 WeakPolarHBondContact O-CB 3.18Å; L198-L201 PolarHBondContact O-N 3.39Å; L201-T203 VanDerWaalsContact C-N 3.33Å; L201-F227 HydrophobicContact CB-CE1 4.37Å; L201-F227 HydrophobicContact CB-CZ 4.18Å; L201-T232 PolarHBondContact O-OG1 3.23Å; L201-M236 HydrophobicContact CD1-CG 4.3Å; L201-M236 HydrophobicContact CD2-SD 4.31Å; L201-M236 HydrophobicContact CG-SD 4.44Å; L201-W611 HydrophobicContact CD2-CH2 4.05Å; L201-W611 HydrophobicContact CD2-CZ2 4.33Å
202	T	93.6	Very high	93.3	Very high	19 Å²	19	32.3 Å²	32.3	12%	0.117	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.9	3	174.4	71.9	0	0	0	0	113.6	V199 L200 A204 V585 W588 W611	V199-T202 CarbonylContact O-C 3.55Å; V199-T202 PolarHBondContact O-N 3.43Å; V199-T202 PolarHBondContact O-OG1 2.91Å; L200-T202 PolarHBondContact O-N 2.96Å; T202-A204 PolarHBondContact O-N 2.93Å; T202-A204 VanDerWaalsContact O-N 3.14Å; T202-V585 VanDerWaalsContact CB-CG1 3.41Å; T202-V585 HydrophobicContact CG2-CG1 3.72Å; T202-V585 WeakPolarHBondContact OG1-CG1 3.29Å; T202-W588 PolarHBondContact OG1-NE1 3.12Å; T202-W611 HydrophobicContact CG2-CZ2 3.71Å; T202-W611 VanDerWaalsContact CG2-NE1 3.31Å
203	T	94.4	Very high	93.3	Very high	72 Å²	72	30.1 Å²	30.1	44%	0.442	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.9	16.4	-179.2	65.5	0	0	0	0	115.6	V199 L200 L201 N205 T232	V199-T203 PolarHBondContact O-N 3Å; L200-T203 WeakPolarHBondContact O-CA 3.49Å; L200-T203 PolarHBondContact O-N 3.37Å; L201-T203 VanDerWaalsContact C-N 3.33Å; T203-N205 VanDerWaalsContact C-N 3.34Å; T203-N205 PolarHBondContact O-N 3.18Å; T203-T232 HydrophobicContact CG2-CG2 3.99Å
204	A	92.4	Very high	93.2	Very high	16 Å²	16	35.5 Å²	35.5	13%	0.132	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-18.9	-171.9	0	0	0	0	0	113.7	V199 T202	V199-A204 HydrophobicContact CG1-CB 3.86Å; V199-A204 PolarHBondContact O-N 3.43Å; T202-A204 PolarHBondContact O-N 2.93Å; T202-A204 VanDerWaalsContact O-N 3.14Å
205	N	92.5	Very high	93	Very high	3 Å²	3	37 Å²	37	2%	0.016	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.3	17.3	178.8	65.1	-8.8	0	0	0	112.9	S196 V199 L200 T203 P207 D208 V209 Q589	S196-N205 PolarHBondContact O-ND2 2.99Å; S196-N205 VanDerWaalsContact O-ND2 3.11Å; V199-N205 HydrophobicContact CG1-CB 3.72Å; L200-N205 WeakPolarHBondContact CA-OD1 3.4Å; L200-N205 WeakPolarHBondContact CB-OD1 3.43Å; L200-N205 PolarHBondContact N-OD1 2.96Å; T203-N205 VanDerWaalsContact C-N 3.34Å; T203-N205 PolarHBondContact O-N 3.18Å; N205-P207 CarbonylContact O-C 3.56Å; N205-D208 PolarHBondContact O-N 2.9Å; N205-V209 PolarHBondContact O-N 3.46Å; N205-Q589 VanDerWaalsContact CB-OE1 3.31Å
206	N	92	Very high	92.7	Very high	89 Å²	89	39.6 Å²	39.6	48%	0.476	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.5	125.5	169.7	-179.7	62.9	0	0	0	108.4	L200	L200-N206 HydrophobicContact CD1-CB 4.09Å
207	P	93.7	Very high	92.5	Very high	65 Å²	65	42.4 Å²	42.4	42%	0.422	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	cis	-92.8	-7.6	15	35.9	-36.6	0	0	0	116.7	N205 V209 M210 I211	N205-P207 CarbonylContact O-C 3.56Å; P207-V209 VanDerWaalsContact C-N 3.32Å; P207-V209 PolarHBondContact O-N 3.36Å; P207-V209 VanDerWaalsContact O-N 3.15Å; P207-M210 PolarHBondContact O-N 3.18Å; P207-I211 HydrophobicContact CB-CD1 4.01Å; P207-I211 HydrophobicContact CB-CG1 4.23Å; P207-I211 HydrophobicContact CG-CD1 3.94Å; P207-I211 WeakPolarHBondContact O-CG1 3.27Å; P207-I211 PolarHBondContact O-N 3.09Å
208	D	90.6	Very high	92.4	Very high	99 Å²	99	51.7 Å²	51.7	53%	0.529	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.6	-42.1	-166.9	-59.2	-24.7	0	0	0	114.9	N205 M210 I211 P212	N205-D208 PolarHBondContact O-N 2.9Å; D208-M210 PolarHBondContact O-N 3.41Å; D208-I211 PolarHBondContact O-N 3.05Å; D208-P212 WeakPolarHBondContact O-CD 3.12Å
209	V	92.1	Very high	92.3	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-16.1	-177.6	71.6	0	0	0	0	114.7	H186 L200 N205 P207 F224	H186-V209 HydrophobicContact CB-CG2 4.38Å; L200-V209 HydrophobicContact CB-CG1 4.4Å; L200-V209 HydrophobicContact CD1-CG1 3.8Å; L200-V209 HydrophobicContact CD2-CG1 3.99Å; L200-V209 HydrophobicContact CG-CG1 4.27Å; N205-V209 PolarHBondContact O-N 3.46Å; P207-V209 VanDerWaalsContact C-N 3.32Å; P207-V209 PolarHBondContact O-N 3.36Å; P207-V209 VanDerWaalsContact O-N 3.15Å; V209-F224 HydrophobicContact CG1-CD1 4.47Å; V209-F224 HydrophobicContact CG1-CE1 4.4Å; V209-F224 HydrophobicContact CG2-CE1 4.34Å; V209-F224 WeakPolarHBondContact O-CZ 3.48Å
210	M	92.3	Very high	92.1	Very high	33 Å²	33	57.7 Å²	57.7	16%	0.163	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.8	-21.9	-177.3	173.8	173.9	67.9	0	0	112.5	P207 D208 A213 Y214 A221 F224	P207-M210 PolarHBondContact O-N 3.18Å; D208-M210 PolarHBondContact O-N 3.41Å; M210-A213 PolarHBondContact O-N 3.22Å; M210-Y214 VanDerWaalsContact O-CB 3.27Å; M210-Y214 WeakPolarHBondContact O-CB 3.45Å; M210-Y214 PolarHBondContact O-N 3.16Å; M210-A221 HydrophobicContact SD-CB 3.8Å; M210-F224 HydrophobicContact CB-CB 4.45Å; M210-F224 HydrophobicContact CB-CD1 4.37Å; M210-F224 HydrophobicContact CB-CD2 3.74Å; M210-F224 HydrophobicContact CB-CE2 3.98Å; M210-F224 HydrophobicContact CB-CG 3.94Å; M210-F224 HydrophobicContact CB-CZ 4.37Å; M210-F224 HydrophobicContact CG-CB 4.34Å; M210-F224 HydrophobicContact CG-CD2 3.42Å; M210-F224 VanDerWaalsContact CG-CD2 3.42Å; M210-F224 HydrophobicContact CG-CE2 3.85Å; M210-F224 HydrophobicContact CG-CG 3.98Å; M210-F224 HydrophobicContact SD-CB 3.77Å; M210-F224 HydrophobicContact SD-CD2 3.83Å; M210-F224 HydrophobicContact SD-CG 4.08Å
211	I	92	Very high	92.1	Very high	87 Å²	87	58.2 Å²	58.2	45%	0.446	31%	0.307	S	S	.	.	H	α-helix	trans	-58.5	-50.3	-169.9	-75.2	167.9	0	0	0	112.3	P207 D208 A213 Y214 S215	P207-I211 HydrophobicContact CB-CD1 4.01Å; P207-I211 HydrophobicContact CB-CG1 4.23Å; P207-I211 HydrophobicContact CG-CD1 3.94Å; P207-I211 WeakPolarHBondContact O-CG1 3.27Å; P207-I211 PolarHBondContact O-N 3.09Å; D208-I211 PolarHBondContact O-N 3.05Å; I211-A213 VanDerWaalsContact C-N 3.3Å; I211-A213 PolarHBondContact O-N 3.06Å; I211-Y214 PolarHBondContact O-N 3.01Å; I211-S215 WeakPolarHBondContact O-CB 3.26Å; I211-S215 PolarHBondContact O-N 3.16Å
212	P	90.8	Very high	92.1	Very high	28 Å²	28	62.9 Å²	62.9	18%	0.182	33%	0.331	C	S	.	.	H	α-helix	trans	-58.2	-38.5	178.6	-14.3	20.3	0	0	0	113.1	E182 L185 D208 S215 L216	E182-P212 HydrophobicContact CG-CB 3.82Å; E182-P212 VanDerWaalsContact OE1-C 3.28Å; E182-P212 VanDerWaalsContact OE1-CA 3.28Å; E182-P212 WeakPolarHBondContact OE1-CA 3.49Å; E182-P212 WeakPolarHBondContact OE1-CB 3.19Å; E182-P212 WeakPolarHBondContact OE1-CD 3.27Å; E182-P212 WeakPolarHBondContact OE1-CG 3.47Å; E182-P212 VanDerWaalsContact OE1-N 3.15Å; L185-P212 HydrophobicContact CD1-CG 4.41Å; D208-P212 WeakPolarHBondContact O-CD 3.12Å; P212-S215 PolarHBondContact O-OG 3.15Å; P212-L216 WeakPolarHBondContact O-CG 3.4Å
213	A	89.9	Confident	92.2	Very high	0 Å²	0	62.9 Å²	62.9	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-68.7	-48.1	178.2	0	0	0	0	0	110.5	F171 E182 M210 I211 S215 L216 N217 Y220 F224	F171-A213 HydrophobicContact CE1-CB 3.82Å; F171-A213 HydrophobicContact CZ-CB 4.17Å; E182-A213 VanDerWaalsContact CD-N 3.32Å; E182-A213 HydrophobicContact CG-CB 3.53Å; E182-A213 PolarHBondContact OE1-N 3.37Å; M210-A213 PolarHBondContact O-N 3.22Å; I211-A213 VanDerWaalsContact C-N 3.3Å; I211-A213 PolarHBondContact O-N 3.06Å; A213-S215 VanDerWaalsContact C-N 3.27Å; A213-S215 PolarHBondContact O-N 3.16Å; A213-L216 WeakPolarHBondContact O-CB 3.38Å; A213-L216 PolarHBondContact O-N 3.11Å; A213-N217 PolarHBondContact O-N 3.33Å; A213-Y220 HydrophobicContact CB-CD2 4.35Å; A213-Y220 HydrophobicContact CB-CG 4.35Å; A213-Y220 WeakPolarHBondContact O-CD2 3.45Å; A213-F224 HydrophobicContact CB-CE2 3.9Å; A213-F224 HydrophobicContact CB-CZ 4.46Å
214	Y	91.6	Very high	92.2	Very high	113 Å²	113	59.7 Å²	59.7	44%	0.443	31%	0.31	S	S	.	.	H	α-helix	trans	-64.1	-34.5	-176.7	-177.5	-113.9	0	0	0	112.1	M210 I211 L216 N217 R218 A221	M210-Y214 VanDerWaalsContact O-CB 3.27Å; M210-Y214 WeakPolarHBondContact O-CB 3.45Å; M210-Y214 PolarHBondContact O-N 3.16Å; I211-Y214 PolarHBondContact O-N 3.01Å; Y214-L216 PolarHBondContact O-N 3.27Å; Y214-N217 CarbonylContact O-C 3.55Å; Y214-R218 HydrophobicContact CE2-CB 3.96Å; Y214-R218 HydrophobicContact CE2-CG 3.99Å; Y214-A221 HydrophobicContact CD2-CB 3.77Å; Y214-A221 HydrophobicContact CE2-CB 4.06Å
215	S	90.9	Very high	92.4	Very high	93 Å²	93	63.2 Å²	63.2	65%	0.65	33%	0.325	S	S	*	.	H	α-helix	trans	-64.8	-27.5	174.8	77.7	0	0	0	0	113.1	I211 P212 A213	I211-S215 WeakPolarHBondContact O-CB 3.26Å; I211-S215 PolarHBondContact O-N 3.16Å; P212-S215 PolarHBondContact O-OG 3.15Å; A213-S215 VanDerWaalsContact C-N 3.27Å; A213-S215 PolarHBondContact O-N 3.16Å
216	L	88.8	Confident	92.6	Very high	80 Å²	80	66.7 Å²	66.7	42%	0.419	34%	0.343	S	S	.	.	H	α-helix	trans	-82.7	-48.4	176.7	-62.8	174.4	0	0	0	111.9	K179 P212 A213 Y214	K179-L216 HydrophobicContact CB-CD1 4.15Å; K179-L216 HydrophobicContact CB-CD2 4.36Å; K179-L216 HydrophobicContact CG-CD2 4.04Å; K179-L216 WeakPolarHBondContact O-CD1 3.46Å; P212-L216 WeakPolarHBondContact O-CG 3.4Å; A213-L216 WeakPolarHBondContact O-CB 3.38Å; A213-L216 PolarHBondContact O-N 3.11Å; Y214-L216 PolarHBondContact O-N 3.27Å
217	N	89.6	Confident	92.8	Very high	74 Å²	74	62.5 Å²	62.5	40%	0.396	32%	0.321	S	S	.	.			trans	-149.9	126.8	177.7	-173.3	-10.4	0	0	0	110.6	A213 Y214 C219 Y220	A213-N217 PolarHBondContact O-N 3.33Å; Y214-N217 CarbonylContact O-C 3.55Å; N217-C219 PolarHBondContact O-N 3.43Å; N217-C219 VanDerWaalsContact O-N 3.14Å; N217-C219 WeakPolarHBondContact OD1-CB 3.48Å; N217-C219 PolarHBondContact OD1-N 3.13Å; N217-Y220 HydrophobicContact CB-CD2 3.63Å; N217-Y220 HydrophobicContact CB-CE2 3.71Å; N217-Y220 HydrophobicContact CB-CG 4.5Å; N217-Y220 PolarHBondContact O-N 3.06Å
218	R	92.9	Very high	92.8	Very high	194 Å²	194	60.4 Å²	60.4	73%	0.732	31%	0.308	S	S	*	.	G	3₁₀ helix	trans	-57.9	-28.4	177.5	-62.9	-177.4	-176	176.4	0.5	112.9	Y214 Y220 A221	Y214-R218 HydrophobicContact CE2-CB 3.96Å; Y214-R218 HydrophobicContact CE2-CG 3.99Å; R218-Y220 PolarHBondContact O-N 2.96Å; R218-A221 WeakPolarHBondContact O-CB 3.41Å; R218-A221 PolarHBondContact O-N 3.4Å
219	C	92.9	Very high	93.1	Very high	78 Å²	78	59.7 Å²	59.7	53%	0.527	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-64.6	-25.3	178	-65.5	0	0	0	0	113.4	N217 A221 I222	N217-C219 PolarHBondContact O-N 3.43Å; N217-C219 VanDerWaalsContact O-N 3.14Å; N217-C219 WeakPolarHBondContact OD1-CB 3.48Å; N217-C219 PolarHBondContact OD1-N 3.13Å; C219-A221 PolarHBondContact O-N 3.49Å; C219-I222 VanDerWaalsContact O-CB 3.31Å; C219-I222 WeakPolarHBondContact O-CB 3.38Å; C219-I222 WeakPolarHBondContact O-CG1 3.32Å; C219-I222 PolarHBondContact O-N 3.02Å; C219-I222 VanDerWaalsContact O-N 3.09Å
220	Y	91.9	Very high	93.2	Very high	66 Å²	66	62.8 Å²	62.8	26%	0.259	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-66.2	-20.6	177.7	-68.8	-52	0	0	0	113	L170 F171 A213 N217 R218 I222 F223 F224	L170-Y220 HydrophobicContact CD1-CD1 4.47Å; L170-Y220 HydrophobicContact CD1-CE1 3.94Å; L170-Y220 HydrophobicContact CD2-CD1 4.02Å; L170-Y220 HydrophobicContact CD2-CE1 4.26Å; L170-Y220 HydrophobicContact CG-CD1 4.18Å; L170-Y220 HydrophobicContact CG-CE1 3.9Å; F171-Y220 AromaticContact CE1-CD1 3.59Å; F171-Y220 HydrophobicContact CE1-CD1 3.59Å; F171-Y220 HydrophobicContact CE1-CD2 4.3Å; F171-Y220 AromaticContact CE1-CE1 4Å; F171-Y220 HydrophobicContact CE1-CE1 4Å; F171-Y220 AromaticContact CE1-CG 3.78Å; F171-Y220 HydrophobicContact CE1-CG 3.78Å; F171-Y220 HydrophobicContact CZ-CD1 4.15Å; F171-Y220 HydrophobicContact CZ-CG 4.39Å; A213-Y220 HydrophobicContact CB-CD2 4.35Å; A213-Y220 HydrophobicContact CB-CG 4.35Å; A213-Y220 WeakPolarHBondContact O-CD2 3.45Å; N217-Y220 HydrophobicContact CB-CD2 3.63Å; N217-Y220 HydrophobicContact CB-CE2 3.71Å; N217-Y220 HydrophobicContact CB-CG 4.5Å; N217-Y220 PolarHBondContact O-N 3.06Å; R218-Y220 PolarHBondContact O-N 2.96Å; Y220-I222 PolarHBondContact O-N 3.37Å; Y220-F223 WeakPolarHBondContact O-CB 2.97Å; Y220-F223 PolarHBondContact O-N 3.19Å; Y220-F224 WeakPolarHBondContact O-CD2 3.49Å
221	A	93.9	Very high	93.3	Very high	12 Å²	12	61.2 Å²	61.2	10%	0.099	31%	0.311	C	S	.	.	H	α-helix	trans	-59.3	-29.3	172.3	0	0	0	0	0	112.7	M210 Y214 R218 C219 F223 F224 I225	M210-A221 HydrophobicContact SD-CB 3.8Å; Y214-A221 HydrophobicContact CD2-CB 3.77Å; Y214-A221 HydrophobicContact CE2-CB 4.06Å; R218-A221 WeakPolarHBondContact O-CB 3.41Å; R218-A221 PolarHBondContact O-N 3.4Å; C219-A221 PolarHBondContact O-N 3.49Å; A221-F223 VanDerWaalsContact C-N 3.26Å; A221-F223 PolarHBondContact O-N 3.26Å; A221-F224 PolarHBondContact O-N 3.4Å; A221-I225 HydrophobicContact CB-CD1 4.28Å; A221-I225 WeakPolarHBondContact O-CB 3.34Å; A221-I225 VanDerWaalsContact O-CG1 3.23Å; A221-I225 WeakPolarHBondContact O-CG1 3.37Å; A221-I225 PolarHBondContact O-N 3.32Å
222	I	95.4	Very high	93.2	Very high	99 Å²	99	58.3 Å²	58.3	51%	0.508	30%	0.298	S	S	.	.	H	α-helix	trans	-60.4	-38.2	179.5	-61.2	172	0	0	0	110.7	C219 Y220 I226	C219-I222 VanDerWaalsContact O-CB 3.31Å; C219-I222 WeakPolarHBondContact O-CB 3.38Å; C219-I222 WeakPolarHBondContact O-CG1 3.32Å; C219-I222 PolarHBondContact O-N 3.02Å; C219-I222 VanDerWaalsContact O-N 3.09Å; Y220-I222 PolarHBondContact O-N 3.37Å; I222-I226 HydrophobicContact CG2-CD1 3.56Å; I222-I226 HydrophobicContact CG2-CG1 4.19Å; I222-I226 WeakPolarHBondContact O-CB 3.36Å; I222-I226 VanDerWaalsContact O-CG1 3.23Å; I222-I226 WeakPolarHBondContact O-CG1 3.44Å; I222-I226 PolarHBondContact O-N 2.96Å
223	F	95.5	Very high	93.2	Very high	20 Å²	20	64.5 Å²	64.5	9%	0.088	32%	0.318	C	S	.	.	H	α-helix	trans	-60.4	-51.9	178	171	-97.4	0	0	0	111.6	F163 V166 L170 F171 F187 L197 Y220 A221 I226 F227	F163-F223 HydrophobicContact CB-CZ 4.49Å; F163-F223 HydrophobicContact CD1-CD2 4.21Å; F163-F223 AromaticContact CD1-CE2 3.57Å; F163-F223 HydrophobicContact CD1-CE2 3.57Å; F163-F223 AromaticContact CD1-CZ 3.94Å; F163-F223 HydrophobicContact CD1-CZ 3.94Å; F163-F223 HydrophobicContact CE1-CD2 4.43Å; F163-F223 HydrophobicContact CE1-CE2 4.21Å; V166-F223 HydrophobicContact CB-CE2 4.28Å; V166-F223 HydrophobicContact CG1-CD2 4.27Å; V166-F223 HydrophobicContact CG1-CE2 3.84Å; L170-F223 HydrophobicContact CD2-CB 4.12Å; L170-F223 HydrophobicContact CD2-CD2 4.11Å; L170-F223 HydrophobicContact CD2-CG 4.1Å; F171-F223 AromaticContact CE2-CD1 3.85Å; F171-F223 HydrophobicContact CE2-CD1 3.85Å; F171-F223 AromaticContact CE2-CE1 3.94Å; F171-F223 HydrophobicContact CE2-CE1 3.94Å; F171-F223 HydrophobicContact CE2-CG 4.49Å; F171-F223 HydrophobicContact CZ-CD1 4.2Å; F187-F223 HydrophobicContact CZ-CE1 4.29Å; L197-F223 HydrophobicContact CD2-CE1 4.43Å; Y220-F223 WeakPolarHBondContact O-CB 2.97Å; Y220-F223 PolarHBondContact O-N 3.19Å; A221-F223 VanDerWaalsContact C-N 3.26Å; A221-F223 PolarHBondContact O-N 3.26Å; F223-I226 PolarHBondContact O-N 2.98Å; F223-F227 WeakPolarHBondContact O-CB 3.48Å; F223-F227 PolarHBondContact O-N 3.18Å
224	F	95.4	Very high	93.3	Very high	4 Å²	4	67.9 Å²	67.9	2%	0.018	34%	0.341	C	S	.	.	H	α-helix	trans	-69.7	-35.4	-178.2	-62.1	-79	0	0	0	112.8	F171 F187 L200 V209 M210 A213 Y220 A221 S228	F171-F224 HydrophobicContact CE2-CE2 4.19Å; F171-F224 AromaticContact CE2-CZ 3.88Å; F171-F224 HydrophobicContact CE2-CZ 3.88Å; F171-F224 AromaticContact CZ-CE2 3.8Å; F171-F224 HydrophobicContact CZ-CE2 3.8Å; F171-F224 AromaticContact CZ-CZ 3.95Å; F171-F224 HydrophobicContact CZ-CZ 3.95Å; F187-F224 HydrophobicContact CE2-CE1 4.21Å; F187-F224 HydrophobicContact CE2-CZ 4.12Å; F187-F224 HydrophobicContact CZ-CE1 4.14Å; F187-F224 HydrophobicContact CZ-CZ 4.41Å; L200-F224 HydrophobicContact CD2-CD1 3.64Å; L200-F224 HydrophobicContact CD2-CE1 4.38Å; V209-F224 HydrophobicContact CG1-CD1 4.47Å; V209-F224 HydrophobicContact CG1-CE1 4.4Å; V209-F224 HydrophobicContact CG2-CE1 4.34Å; V209-F224 WeakPolarHBondContact O-CZ 3.48Å; M210-F224 HydrophobicContact CB-CB 4.45Å; M210-F224 HydrophobicContact CB-CD1 4.37Å; M210-F224 HydrophobicContact CB-CD2 3.74Å; M210-F224 HydrophobicContact CB-CE2 3.98Å; M210-F224 HydrophobicContact CB-CG 3.94Å; M210-F224 HydrophobicContact CB-CZ 4.37Å; M210-F224 HydrophobicContact CG-CB 4.34Å; M210-F224 HydrophobicContact CG-CD2 3.42Å; M210-F224 VanDerWaalsContact CG-CD2 3.42Å; M210-F224 HydrophobicContact CG-CE2 3.85Å; M210-F224 HydrophobicContact CG-CG 3.98Å; M210-F224 HydrophobicContact SD-CB 3.77Å; M210-F224 HydrophobicContact SD-CD2 3.83Å; M210-F224 HydrophobicContact SD-CG 4.08Å; A213-F224 HydrophobicContact CB-CE2 3.9Å; A213-F224 HydrophobicContact CB-CZ 4.46Å; Y220-F224 WeakPolarHBondContact O-CD2 3.49Å; A221-F224 PolarHBondContact O-N 3.4Å; F224-S228 WeakPolarHBondContact O-CB 3.48Å; F224-S228 PolarHBondContact O-N 3.25Å; F224-S228 PolarHBondContact O-OG 2.75Å
225	I	95.8	Very high	93.3	Very high	90 Å²	90	63.3 Å²	63.3	46%	0.462	32%	0.324	S	S	.	.	H	α-helix	trans	-64.7	-48.5	174.4	-69.6	167.8	0	0	0	110.7	A221 F227 S228 I229	A221-I225 HydrophobicContact CB-CD1 4.28Å; A221-I225 WeakPolarHBondContact O-CB 3.34Å; A221-I225 VanDerWaalsContact O-CG1 3.23Å; A221-I225 WeakPolarHBondContact O-CG1 3.37Å; A221-I225 PolarHBondContact O-N 3.32Å; I225-F227 VanDerWaalsContact C-N 3.34Å; I225-F227 PolarHBondContact O-N 3.33Å; I225-S228 PolarHBondContact O-N 3.19Å; I225-I229 HydrophobicContact CG2-CD1 3.67Å; I225-I229 HydrophobicContact CG2-CG1 4.35Å; I225-I229 VanDerWaalsContact O-CG1 3.3Å; I225-I229 WeakPolarHBondContact O-CG1 3.5Å; I225-I229 PolarHBondContact O-N 2.92Å
226	I	96.3	Very high	93.2	Very high	77 Å²	77	60.3 Å²	60.3	40%	0.395	30%	0.3	S	S	.	.	H	α-helix	trans	-61.9	-44	178.5	-70.6	173.2	0	0	0	110.6	F163 I222 F223 S228 I229 I230	F163-I226 HydrophobicContact CE1-CG2 4.27Å; F163-I226 HydrophobicContact CZ-CG2 3.98Å; I222-I226 HydrophobicContact CG2-CD1 3.56Å; I222-I226 HydrophobicContact CG2-CG1 4.19Å; I222-I226 WeakPolarHBondContact O-CB 3.36Å; I222-I226 VanDerWaalsContact O-CG1 3.23Å; I222-I226 WeakPolarHBondContact O-CG1 3.44Å; I222-I226 PolarHBondContact O-N 2.96Å; F223-I226 PolarHBondContact O-N 2.98Å; I226-S228 VanDerWaalsContact C-N 3.33Å; I226-S228 PolarHBondContact O-N 3.14Å; I226-I229 PolarHBondContact O-N 3.49Å; I226-I230 HydrophobicContact CG2-CD1 3.7Å; I226-I230 HydrophobicContact CG2-CG1 4.47Å; I226-I230 WeakPolarHBondContact O-CG1 3.41Å; I226-I230 PolarHBondContact O-N 3.49Å
227	F	96.3	Very high	93.2	Very high	0 Å²	0	61 Å²	61	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-56	-47.8	174.9	174.5	-97.3	0	0	0	111.5	H159 L160 F163 L197 L200 L201 F223 I225 I230 G231	H159-F227 AromaticContact CD2-CE2 3.86Å; H159-F227 AromaticContact CE1-CD2 3.83Å; H159-F227 AromaticContact NE2-CD2 3.33Å; H159-F227 VanDerWaalsContact NE2-CD2 3.33Å; H159-F227 WeakPolarHBondContact NE2-CD2 3.41Å; H159-F227 AromaticContact NE2-CE2 3.38Å; H159-F227 WeakPolarHBondContact NE2-CE2 3.09Å; H159-F227 PolarHBondContact NE2-O 3.01Å; L160-F227 HydrophobicContact CD2-CE2 4.09Å; L160-F227 HydrophobicContact CD2-CZ 3.87Å; F163-F227 HydrophobicContact CB-CD2 3.71Å; F163-F227 HydrophobicContact CB-CE2 4.07Å; F163-F227 HydrophobicContact CD1-CB 3.88Å; F163-F227 AromaticContact CD1-CD2 3.79Å; F163-F227 HydrophobicContact CD1-CD2 3.79Å; F163-F227 HydrophobicContact CD1-CG 4.3Å; F163-F227 HydrophobicContact CD2-CD2 4.19Å; F163-F227 HydrophobicContact CE1-CB 3.96Å; F163-F227 HydrophobicContact CE1-CD2 4.46Å; F163-F227 AromaticContact CG-CD2 3.63Å; F163-F227 HydrophobicContact CG-CD2 3.63Å; F163-F227 HydrophobicContact CG-CE2 4.39Å; L197-F227 HydrophobicContact CB-CE2 4.3Å; L197-F227 HydrophobicContact CB-CZ 3.99Å; L197-F227 HydrophobicContact CD2-CE1 4.45Å; L197-F227 HydrophobicContact CD2-CZ 4.41Å; L197-F227 VanDerWaalsContact O-CZ 3.24Å; L197-F227 WeakPolarHBondContact O-CZ 3.16Å; L200-F227 HydrophobicContact CB-CD1 4.48Å; L200-F227 HydrophobicContact CB-CE1 3.9Å; L200-F227 HydrophobicContact CD2-CD1 3.51Å; L200-F227 HydrophobicContact CD2-CE1 3.76Å; L200-F227 HydrophobicContact CD2-CG 4.5Å; L200-F227 HydrophobicContact CG-CD1 3.79Å; L200-F227 HydrophobicContact CG-CE1 3.67Å; L201-F227 HydrophobicContact CB-CE1 4.37Å; L201-F227 HydrophobicContact CB-CZ 4.18Å; F223-F227 WeakPolarHBondContact O-CB 3.48Å; F223-F227 PolarHBondContact O-N 3.18Å; I225-F227 VanDerWaalsContact C-N 3.34Å; I225-F227 PolarHBondContact O-N 3.33Å; F227-I230 PolarHBondContact O-N 3.07Å; F227-G231 WeakPolarHBondContact O-CA 3.44Å; F227-G231 PolarHBondContact O-N 3.18Å
228	S	94.6	Very high	93.2	Very high	21 Å²	21	61.2 Å²	61.2	15%	0.147	31%	0.306	C	S	.	.	H	α-helix	trans	-70.4	-36.4	-177	-54.3	0	0	0	0	112.8	F224 I225 I226 T232 Y233	F224-S228 WeakPolarHBondContact O-CB 3.48Å; F224-S228 PolarHBondContact O-N 3.25Å; F224-S228 PolarHBondContact O-OG 2.75Å; I225-S228 PolarHBondContact O-N 3.19Å; I226-S228 VanDerWaalsContact C-N 3.33Å; I226-S228 PolarHBondContact O-N 3.14Å; S228-T232 WeakPolarHBondContact O-CA 3.48Å; S228-T232 VanDerWaalsContact O-CB 3.27Å; S228-T232 WeakPolarHBondContact O-CB 3.5Å; S228-T232 PolarHBondContact O-N 3.46Å; S228-Y233 PolarHBondContact O-N 3.49Å
229	I	95.3	Very high	92.8	Very high	84 Å²	84	52 Å²	52	43%	0.431	27%	0.271	S	S	.	.	I	π-helix	trans	-61.5	-51.4	174	-69.9	170.7	0	0	0	110.5	I225 I226 Y233 C234	I225-I229 HydrophobicContact CG2-CD1 3.67Å; I225-I229 HydrophobicContact CG2-CG1 4.35Å; I225-I229 VanDerWaalsContact O-CG1 3.3Å; I225-I229 WeakPolarHBondContact O-CG1 3.5Å; I225-I229 PolarHBondContact O-N 2.92Å; I226-I229 PolarHBondContact O-N 3.49Å; I229-Y233 WeakPolarHBondContact O-CB 3.24Å; I229-Y233 PolarHBondContact O-N 2.88Å; I229-C234 PolarHBondContact O-N 3.37Å; I229-C234 PolarHBondContact O-SG 2.87Å
230	I	95.4	Very high	92.5	Very high	66 Å²	66	50 Å²	50	34%	0.338	26%	0.256	S	S	.	.	I	π-helix	trans	-70.1	-50.7	-177.6	-62.5	171.6	0	0	0	110.4	F163 I226 F227 C234 L235	F163-I230 HydrophobicContact CZ-CD1 4.31Å; I226-I230 HydrophobicContact CG2-CD1 3.7Å; I226-I230 HydrophobicContact CG2-CG1 4.47Å; I226-I230 WeakPolarHBondContact O-CG1 3.41Å; I226-I230 PolarHBondContact O-N 3.49Å; F227-I230 PolarHBondContact O-N 3.07Å; I230-C234 VanDerWaalsContact O-CB 3.3Å; I230-C234 WeakPolarHBondContact O-CB 3.33Å; I230-C234 PolarHBondContact O-N 3.46Å; I230-L235 HydrophobicContact CG2-CD1 4.38Å; I230-L235 WeakPolarHBondContact O-CG 3.49Å; I230-L235 PolarHBondContact O-N 2.98Å
231	G	93.2	Very high	92.3	Very high	0 Å²	0	49 Å²	49	0%	0	26%	0.261	C	S	.	.	I	π-helix	trans	-68.2	-65.3	-176.6	0	0	0	0	0	112.8	F227 L235 M236	F227-G231 WeakPolarHBondContact O-CA 3.44Å; F227-G231 PolarHBondContact O-N 3.18Å; G231-L235 WeakPolarHBondContact O-CB 3.29Å; G231-L235 PolarHBondContact O-N 3.27Å; G231-M236 WeakPolarHBondContact O-CG 3.37Å; G231-M236 PolarHBondContact O-N 3.38Å
232	T	90.4	Very high	91.9	Very high	26 Å²	26	50.2 Å²	50.2	16%	0.16	27%	0.266	C	S	.	.	I	π-helix	trans	-75.7	-47.7	-170.9	-47.8	0	0	0	0	111.9	L201 T203 S228 M236	L201-T232 PolarHBondContact O-OG1 3.23Å; T203-T232 HydrophobicContact CG2-CG2 3.99Å; S228-T232 WeakPolarHBondContact O-CA 3.48Å; S228-T232 VanDerWaalsContact O-CB 3.27Å; S228-T232 WeakPolarHBondContact O-CB 3.5Å; S228-T232 PolarHBondContact O-N 3.46Å; T232-M236 WeakPolarHBondContact O-CB 3.39Å
233	Y	90.4	Very high	91.4	Very high	157 Å²	157	45.9 Å²	45.9	62%	0.616	24%	0.244	S	C	*	.	I	π-helix	trans	-84.7	-35.7	-173.4	-66.5	-73.9	0	0	0	113.9	S228 I229 N237	S228-Y233 PolarHBondContact O-N 3.49Å; I229-Y233 WeakPolarHBondContact O-CB 3.24Å; I229-Y233 PolarHBondContact O-N 2.88Å; Y233-N237 WeakPolarHBondContact O-CB 3.15Å; Y233-N237 PolarHBondContact O-ND2 3.24Å
234	C	92.1	Very high	90.8	Very high	71 Å²	71	47.2 Å²	47.2	48%	0.48	25%	0.248	S	C	.	.	I	π-helix	trans	-88.6	-62.3	177.1	-59.4	0	0	0	0	111.8	I229 I230 L238	I229-C234 PolarHBondContact O-N 3.37Å; I229-C234 PolarHBondContact O-SG 2.87Å; I230-C234 VanDerWaalsContact O-CB 3.3Å; I230-C234 WeakPolarHBondContact O-CB 3.33Å; I230-C234 PolarHBondContact O-N 3.46Å; C234-L238 WeakPolarHBondContact O-CB 3.23Å; C234-L238 PolarHBondContact O-N 3.42Å
235	L	91.6	Very high	90.2	Very high	17 Å²	17	51.3 Å²	51.3	9%	0.089	27%	0.271	C	S	.	.	I	π-helix	trans	-70.5	-44.7	-169.7	-64.4	176.6	0	0	0	113.3	L155 L156 H159 I230 G231 L238 L239	L155-L235 HydrophobicContact CD2-CD2 3.51Å; L155-L235 HydrophobicContact CG-CD2 3.86Å; L156-L235 HydrophobicContact CD1-CB 4.12Å; L156-L235 HydrophobicContact CD1-CD1 3.93Å; H159-L235 HydrophobicContact CB-CD1 3.73Å; I230-L235 HydrophobicContact CG2-CD1 4.38Å; I230-L235 WeakPolarHBondContact O-CG 3.49Å; I230-L235 PolarHBondContact O-N 2.98Å; G231-L235 WeakPolarHBondContact O-CB 3.29Å; G231-L235 PolarHBondContact O-N 3.27Å; L235-L238 PolarHBondContact O-N 3.38Å; L235-L239 WeakPolarHBondContact O-CB 3.41Å; L235-L239 PolarHBondContact O-N 3.08Å
236	M	89.3	Confident	89.5	Confident	30 Å²	30	50 Å²	50	15%	0.148	26%	0.262	C	S	.	.	I	π-helix	trans	-66.8	-39.8	179.6	-60.5	-70.3	-87.8	0	0	112	L156 L201 G231 T232 L239 T240 W611 V616	L156-M236 HydrophobicContact CD2-SD 4.14Å; L201-M236 HydrophobicContact CD1-CG 4.3Å; L201-M236 HydrophobicContact CD2-SD 4.31Å; L201-M236 HydrophobicContact CG-SD 4.44Å; G231-M236 WeakPolarHBondContact O-CG 3.37Å; G231-M236 PolarHBondContact O-N 3.38Å; T232-M236 WeakPolarHBondContact O-CB 3.39Å; M236-L239 WeakPolarHBondContact O-CB 3.27Å; M236-L239 PolarHBondContact O-N 3.31Å; M236-T240 PolarHBondContact O-N 3.37Å; M236-T240 PolarHBondContact O-OG1 3.22Å; M236-T240 VanDerWaalsContact O-OG1 3.08Å; M236-W611 HydrophobicContact CE-CZ2 3.92Å; M236-V616 HydrophobicContact CE-CG2 4.03Å
237	N	88.9	Confident	88.6	Confident	94 Å²	94	46.8 Å²	46.8	50%	0.503	25%	0.246	S	C	.	.	H	α-helix	trans	-70.8	-36.4	175.9	-70.7	-35	0	0	0	112.7	Y233 L239 T240 A241	Y233-N237 WeakPolarHBondContact O-CB 3.15Å; Y233-N237 PolarHBondContact O-ND2 3.24Å; N237-L239 VanDerWaalsContact C-N 3.29Å; N237-L239 PolarHBondContact O-N 3.49Å; N237-T240 WeakPolarHBondContact O-CB 3.35Å; N237-T240 PolarHBondContact O-N 3.42Å; N237-A241 PolarHBondContact O-N 2.99Å
238	L	89.1	Confident	87.7	Confident	80 Å²	80	50.7 Å²	50.7	42%	0.419	26%	0.26	S	S	.	.	H	α-helix	trans	-61.2	-41.4	172.3	178.7	64.6	0	0	0	110.9	C234 L235 A241 I242	C234-L238 WeakPolarHBondContact O-CB 3.23Å; C234-L238 PolarHBondContact O-N 3.42Å; L235-L238 PolarHBondContact O-N 3.38Å; L238-A241 PolarHBondContact O-N 3.44Å; L238-I242 HydrophobicContact CD1-CD1 4.09Å; L238-I242 HydrophobicContact CD1-CG1 4.43Å; L238-I242 HydrophobicContact CG-CD1 3.92Å; L238-I242 WeakPolarHBondContact O-CG1 3.2Å; L238-I242 PolarHBondContact O-N 3.4Å
239	L	85.9	Confident	86.8	Confident	1 Å²	1	51.5 Å²	51.5	1%	0.005	27%	0.272	C	S	.	.	H	α-helix	trans	-60.1	-46.3	174.9	-179.4	61.1	0	0	0	111.4	I149 V152 L235 M236 N237 A241 I242 I243 V616	I149-L239 HydrophobicContact CG2-CD1 4.11Å; V152-L239 HydrophobicContact CB-CD1 3.91Å; V152-L239 HydrophobicContact CG1-CB 3.9Å; V152-L239 HydrophobicContact CG1-CD1 3.84Å; V152-L239 HydrophobicContact CG1-CG 4.4Å; L235-L239 WeakPolarHBondContact O-CB 3.41Å; L235-L239 PolarHBondContact O-N 3.08Å; M236-L239 WeakPolarHBondContact O-CB 3.27Å; M236-L239 PolarHBondContact O-N 3.31Å; N237-L239 VanDerWaalsContact C-N 3.29Å; N237-L239 PolarHBondContact O-N 3.49Å; L239-A241 VanDerWaalsContact C-N 3.31Å; L239-A241 PolarHBondContact O-N 2.84Å; L239-I242 PolarHBondContact O-N 3.29Å; L239-I243 HydrophobicContact CD1-CD1 4.1Å; L239-I243 HydrophobicContact CD1-CG1 4.39Å; L239-I243 HydrophobicContact CG-CD1 3.99Å; L239-I243 WeakPolarHBondContact O-CB 3.38Å; L239-I243 VanDerWaalsContact O-CG1 3.27Å; L239-I243 WeakPolarHBondContact O-CG1 3.34Å; L239-I243 PolarHBondContact O-N 3.01Å; L239-V616 HydrophobicContact CD2-CG1 3.22Å; L239-V616 HydrophobicContact CG-CG1 4.32Å
240	T	85.8	Confident	85.7	Confident	35 Å²	35	49.4 Å²	49.4	22%	0.215	26%	0.259	C	S	.	.	H	α-helix	trans	-57.9	-43.3	173.9	-54.9	0	0	0	0	111.7	M236 N237 I243 Y244 N620	M236-T240 PolarHBondContact O-N 3.37Å; M236-T240 PolarHBondContact O-OG1 3.22Å; M236-T240 VanDerWaalsContact O-OG1 3.08Å; N237-T240 WeakPolarHBondContact O-CB 3.35Å; N237-T240 PolarHBondContact O-N 3.42Å; T240-I243 PolarHBondContact O-N 2.86Å; T240-Y244 WeakPolarHBondContact O-CB 3.47Å; T240-Y244 PolarHBondContact O-N 3.32Å; T240-N620 HydrophobicContact CG2-CB 4.24Å; T240-N620 PolarHBondContact OG1-ND2 3.26Å; T240-N620 PolarHBondContact OG1-OD1 2.97Å
241	A	87.4	Confident	84.5	Confident	45 Å²	45	47.4 Å²	47.4	37%	0.372	25%	0.249	S	C	.	.	H	α-helix	trans	-65.2	-41	178.6	0	0	0	0	0	112.9	N237 L238 L239 Y244 N245	N237-A241 PolarHBondContact O-N 2.99Å; L238-A241 PolarHBondContact O-N 3.44Å; L239-A241 VanDerWaalsContact C-N 3.31Å; L239-A241 PolarHBondContact O-N 2.84Å; A241-Y244 PolarHBondContact O-N 3.01Å; A241-N245 WeakPolarHBondContact O-CB 3.44Å; A241-N245 PolarHBondContact O-N 2.93Å
242	I	86.6	Confident	83.7	Confident	38 Å²	38	48.9 Å²	48.9	20%	0.195	26%	0.256	C	S	.	.	H	α-helix	trans	-66.9	-45.1	177.3	-71.7	167.4	0	0	0	110.6	V152 L238 L239 Y244 N245 Q246	V152-I242 HydrophobicContact CG2-CD1 3.26Å; V152-I242 HydrophobicContact CG2-CG1 4.49Å; L238-I242 HydrophobicContact CD1-CD1 4.09Å; L238-I242 HydrophobicContact CD1-CG1 4.43Å; L238-I242 HydrophobicContact CG-CD1 3.92Å; L238-I242 WeakPolarHBondContact O-CG1 3.2Å; L238-I242 PolarHBondContact O-N 3.4Å; L239-I242 PolarHBondContact O-N 3.29Å; I242-Y244 VanDerWaalsContact C-N 3.3Å; I242-Y244 PolarHBondContact O-N 3.41Å; I242-N245 PolarHBondContact O-N 3.35Å; I242-Q246 HydrophobicContact CG2-CG 4.49Å; I242-Q246 WeakPolarHBondContact O-CB 3.37Å; I242-Q246 WeakPolarHBondContact O-CG 3.44Å; I242-Q246 PolarHBondContact O-N 3.09Å
243	I	83.7	Confident	83	Confident	7 Å²	7	51.9 Å²	51.9	4%	0.036	27%	0.27	C	S	.	.	H	α-helix	trans	-57.1	-46.7	174.6	-69.4	168.6	0	0	0	110.1	I149 L239 T240 F247 N620 L621	I149-I243 HydrophobicContact CD1-CG1 3.95Å; I149-I243 HydrophobicContact CG1-CG1 3.98Å; L239-I243 HydrophobicContact CD1-CD1 4.1Å; L239-I243 HydrophobicContact CD1-CG1 4.39Å; L239-I243 HydrophobicContact CG-CD1 3.99Å; L239-I243 WeakPolarHBondContact O-CB 3.38Å; L239-I243 VanDerWaalsContact O-CG1 3.27Å; L239-I243 WeakPolarHBondContact O-CG1 3.34Å; L239-I243 PolarHBondContact O-N 3.01Å; T240-I243 PolarHBondContact O-N 2.86Å; I243-F247 WeakPolarHBondContact O-CB 3.33Å; I243-F247 PolarHBondContact O-N 3.47Å; I243-N620 HydrophobicContact CD1-CB 4.03Å; I243-L621 HydrophobicContact CG2-CB 4.3Å
244	Y	82.8	Confident	82.2	Confident	49 Å²	49	45.6 Å²	45.6	19%	0.192	25%	0.249	C	C	.	.	H	α-helix	trans	-58.9	-52.7	177.5	171.1	-98.6	0	0	0	112.4	T240 A241 I242 Q246 F247 R248 A624 L627 E628	T240-Y244 WeakPolarHBondContact O-CB 3.47Å; T240-Y244 PolarHBondContact O-N 3.32Å; A241-Y244 PolarHBondContact O-N 3.01Å; I242-Y244 VanDerWaalsContact C-N 3.3Å; I242-Y244 PolarHBondContact O-N 3.41Å; Y244-Q246 PolarHBondContact O-N 3.19Å; Y244-F247 PolarHBondContact O-N 3.27Å; Y244-R248 WeakPolarHBondContact O-CB 3.44Å; Y244-R248 PolarHBondContact O-N 3.48Å; Y244-A624 HydrophobicContact CD2-CB 3.67Å; Y244-A624 HydrophobicContact CG-CB 4.38Å; Y244-L627 HydrophobicContact CD2-CD2 4.48Å; Y244-L627 HydrophobicContact CE2-CD2 3.68Å; Y244-E628 PolarHBondContact OH-OE2 3.16Å; Y244-E628 VanDerWaalsContact OH-OE2 3.09Å
245	N	83.4	Confident	81.3	Confident	90 Å²	90	42.7 Å²	42.7	48%	0.481	23%	0.229	S	C	.	.	H	α-helix	trans	-61.4	-44.7	-177	-79.7	-23.9	0	0	0	112.1	A241 I242 R248 G249	A241-N245 WeakPolarHBondContact O-CB 3.44Å; A241-N245 PolarHBondContact O-N 2.93Å; I242-N245 PolarHBondContact O-N 3.35Å; N245-R248 PolarHBondContact O-N 3Å; N245-G249 PolarHBondContact O-N 3.02Å
246	Q	81.7	Confident	80.8	Confident	62 Å²	62	43.7 Å²	43.7	29%	0.29	23%	0.233	S	C	.	.	H	α-helix	trans	-67.2	-40.2	180	-74.4	-53.7	-31.4	0	0	112.6	T145 E148 I242 Y244 Y250	T145-Q246 HydrophobicContact CG2-CB 3.7Å; E148-Q246 VanDerWaalsContact OE1-CD 3.22Å; E148-Q246 PolarHBondContact OE1-NE2 3.26Å; E148-Q246 PolarHBondContact OE1-OE1 3.2Å; E148-Q246 WeakPolarHBondContact OE2-CG 3.24Å; E148-Q246 PolarHBondContact OE2-NE2 2.87Å; I242-Q246 HydrophobicContact CG2-CG 4.49Å; I242-Q246 WeakPolarHBondContact O-CB 3.37Å; I242-Q246 WeakPolarHBondContact O-CG 3.44Å; I242-Q246 PolarHBondContact O-N 3.09Å; Y244-Q246 PolarHBondContact O-N 3.19Å; Q246-Y250 PolarHBondContact O-N 2.84Å; Q246-Y250 VanDerWaalsContact O-N 3.16Å
247	F	76.3	Confident	80.2	Confident	10 Å²	10	45.1 Å²	45.1	4%	0.044	24%	0.244	C	C	.	.	H	α-helix	trans	-68	-42.6	177.9	-177.6	-98.7	0	0	0	112.1	I243 Y244 Y250 L251 F511 L621 L625	I243-F247 WeakPolarHBondContact O-CB 3.33Å; I243-F247 PolarHBondContact O-N 3.47Å; Y244-F247 PolarHBondContact O-N 3.27Å; F247-Y250 PolarHBondContact O-N 3.36Å; F247-L251 HydrophobicContact CD1-CD1 4.07Å; F247-L251 HydrophobicContact CD1-CG 4.28Å; F247-L251 HydrophobicContact CE1-CD1 3.3Å; F247-L251 HydrophobicContact CE1-CD2 4.23Å; F247-L251 HydrophobicContact CE1-CG 3.62Å; F247-L251 HydrophobicContact CE2-CG 4.46Å; F247-L251 HydrophobicContact CZ-CD1 3.8Å; F247-L251 HydrophobicContact CZ-CD2 3.85Å; F247-L251 HydrophobicContact CZ-CG 3.7Å; F247-L251 PolarHBondContact O-N 3.33Å; F247-F511 HydrophobicContact CE1-CZ 4.48Å; F247-F511 AromaticContact CE2-CE1 3.57Å; F247-F511 HydrophobicContact CE2-CE1 3.57Å; F247-F511 AromaticContact CE2-CZ 3.42Å; F247-F511 HydrophobicContact CE2-CZ 3.42Å; F247-F511 VanDerWaalsContact CE2-CZ 3.42Å; F247-F511 AromaticContact CZ-CE1 3.73Å; F247-F511 HydrophobicContact CZ-CE1 3.73Å; F247-F511 HydrophobicContact CZ-CE2 4.03Å; F247-F511 AromaticContact CZ-CZ 3.23Å; F247-F511 HydrophobicContact CZ-CZ 3.23Å; F247-L621 HydrophobicContact CD2-CD1 4.12Å; F247-L621 HydrophobicContact CD2-CG 4.42Å; F247-L621 HydrophobicContact CE2-CD1 4.4Å; F247-L625 HydrophobicContact CD1-CG 4.31Å; F247-L625 HydrophobicContact CE1-CD1 4.08Å; F247-L625 HydrophobicContact CE1-CD2 3.3Å; F247-L625 HydrophobicContact CE1-CG 3.4Å; F247-L625 HydrophobicContact CZ-CD1 3.92Å; F247-L625 HydrophobicContact CZ-CD2 3.54Å; F247-L625 HydrophobicContact CZ-CG 3.73Å
248	R	77.8	Confident	79.7	Confident	82 Å²	82	42.2 Å²	42.2	31%	0.309	23%	0.231	S	C	.	.	H	α-helix	trans	-60.8	-48	175.3	-178.6	177.3	165	-142.1	-8.2	111.8	Y244 N245 Y250 L251 L252 E628 F658	Y244-R248 WeakPolarHBondContact O-CB 3.44Å; Y244-R248 PolarHBondContact O-N 3.48Å; N245-R248 PolarHBondContact O-N 3Å; R248-Y250 PolarHBondContact O-N 2.72Å; R248-L251 PolarHBondContact O-N 3.25Å; R248-L252 PolarHBondContact O-N 2.81Å; R248-L252 VanDerWaalsContact O-N 3.14Å; R248-E628 IonicContact NE-OE1 3.23Å; R248-F658 HydrophobicContact CG-CE1 4.38Å
249	G	75.4	Confident	79.2	Confident	38 Å²	38	39.5 Å²	39.5	39%	0.392	22%	0.216	S	C	.	.	H	α-helix	trans	-56.8	-38.8	176.6	0	0	0	0	0	112.5	N245 M253	N245-G249 PolarHBondContact O-N 3.02Å; G249-M253 VanDerWaalsContact O-CG 3.31Å; G249-M253 WeakPolarHBondContact O-CG 3.04Å; G249-M253 PolarHBondContact O-N 3.28Å
250	Y	71.7	Confident	79.1	Confident	40 Å²	40	40.6 Å²	40.6	16%	0.157	22%	0.222	C	C	.	.	H	α-helix	trans	-72	-42	175.4	179.8	-91.9	0	0	0	113.9	K137 C141 Q246 F247 R248 L252 M253 S254	K137-Y250 PolarHBondContact O-OH 2.93Å; C141-Y250 HydrophobicContact CB-CD1 3.46Å; C141-Y250 VanDerWaalsContact CB-CD1 3.46Å; C141-Y250 HydrophobicContact CB-CD2 4.17Å; C141-Y250 HydrophobicContact CB-CE1 3.39Å; C141-Y250 HydrophobicContact CB-CE2 4.12Å; C141-Y250 HydrophobicContact CB-CG 3.83Å; C141-Y250 VanDerWaalsContact SG-CB 3.52Å; C141-Y250 WeakPolarHBondContact SG-CD1 3.35Å; Q246-Y250 PolarHBondContact O-N 2.84Å; Q246-Y250 VanDerWaalsContact O-N 3.16Å; F247-Y250 PolarHBondContact O-N 3.36Å; R248-Y250 PolarHBondContact O-N 2.72Å; Y250-L252 PolarHBondContact O-N 3.32Å; Y250-M253 PolarHBondContact O-N 2.97Å; Y250-M253 VanDerWaalsContact O-N 3.13Å; Y250-S254 WeakPolarHBondContact O-CB 3.16Å; Y250-S254 PolarHBondContact O-N 3.4Å
251	L	71.9	Confident	78.9	Confident	24 Å²	24	46.4 Å²	46.4	13%	0.126	24%	0.24	C	C	.	.	H	α-helix	trans	-54.7	-44.3	177.3	-82.5	-176.1	0	0	0	110.6	F247 R248 S254 V255 L625 F658	F247-L251 HydrophobicContact CD1-CD1 4.07Å; F247-L251 HydrophobicContact CD1-CG 4.28Å; F247-L251 HydrophobicContact CE1-CD1 3.3Å; F247-L251 HydrophobicContact CE1-CD2 4.23Å; F247-L251 HydrophobicContact CE1-CG 3.62Å; F247-L251 HydrophobicContact CE2-CG 4.46Å; F247-L251 HydrophobicContact CZ-CD1 3.8Å; F247-L251 HydrophobicContact CZ-CD2 3.85Å; F247-L251 HydrophobicContact CZ-CG 3.7Å; F247-L251 PolarHBondContact O-N 3.33Å; R248-L251 PolarHBondContact O-N 3.25Å; L251-S254 PolarHBondContact O-N 2.94Å; L251-V255 WeakPolarHBondContact O-CG2 3.41Å; L251-V255 PolarHBondContact O-N 3.3Å; L251-L625 HydrophobicContact CD1-CD2 4.19Å; L251-F658 HydrophobicContact CB-CE2 3.87Å; L251-F658 HydrophobicContact CB-CZ 3.83Å; L251-F658 HydrophobicContact CD1-CE2 4.35Å; L251-F658 HydrophobicContact CD1-CZ 4.19Å
252	L	75.3	Confident	78.8	Confident	30 Å²	30	47 Å²	47	16%	0.157	23%	0.232	C	C	.	.	H	α-helix	trans	-58.6	-50.8	175.2	-168.8	151.8	0	0	0	111.4	R248 Y250 S254 V255 Q256 F658 Q661	R248-L252 PolarHBondContact O-N 2.81Å; R248-L252 VanDerWaalsContact O-N 3.14Å; Y250-L252 PolarHBondContact O-N 3.32Å; L252-S254 VanDerWaalsContact C-N 3.32Å; L252-S254 PolarHBondContact O-N 3.36Å; L252-V255 PolarHBondContact O-N 3.18Å; L252-Q256 WeakPolarHBondContact O-CB 3.49Å; L252-Q256 PolarHBondContact O-N 3.42Å; L252-F658 HydrophobicContact CB-CD1 4.12Å; L252-F658 HydrophobicContact CB-CE1 4.46Å; L252-F658 HydrophobicContact CB-CG 4.49Å; L252-F658 HydrophobicContact CD1-CD1 4.12Å; L252-F658 HydrophobicContact CG-CD1 4.27Å; L252-Q661 HydrophobicContact CD1-CB 3.84Å
253	M	76.2	Confident	78.7	Confident	90 Å²	90	46 Å²	46	44%	0.443	23%	0.226	S	C	.	.	H	α-helix	trans	-60.7	-37.8	177	-70.6	-70.6	130.7	0	0	113.3	G249 Y250 T257	G249-M253 VanDerWaalsContact O-CG 3.31Å; G249-M253 WeakPolarHBondContact O-CG 3.04Å; G249-M253 PolarHBondContact O-N 3.28Å; Y250-M253 PolarHBondContact O-N 2.97Å; Y250-M253 VanDerWaalsContact O-N 3.13Å; M253-T257 WeakPolarHBondContact O-CB 3.43Å; M253-T257 PolarHBondContact O-N 2.81Å; M253-T257 PolarHBondContact O-OG1 2.73Å
254	S	73.8	Confident	78.8	Confident	25 Å²	25	46.7 Å²	46.7	18%	0.175	23%	0.23	C	C	.	.	H	α-helix	trans	-67.8	-41.3	177.9	172.4	0	0	0	0	111.5	Y250 L251 L252 S258	Y250-S254 WeakPolarHBondContact O-CB 3.16Å; Y250-S254 PolarHBondContact O-N 3.4Å; L251-S254 PolarHBondContact O-N 2.94Å; L252-S254 VanDerWaalsContact C-N 3.32Å; L252-S254 PolarHBondContact O-N 3.36Å; S254-S258 PolarHBondContact O-N 2.69Å
255	V	73.8	Confident	79	Confident	9 Å²	9	46.1 Å²	46.1	6%	0.055	24%	0.239	C	C	.	.	H	α-helix	trans	-66	-46.3	174.3	173.9	0	0	0	0	110.4	L251 L252 T257 S258 I259 V654 Q655 F658 I662	L251-V255 WeakPolarHBondContact O-CG2 3.41Å; L251-V255 PolarHBondContact O-N 3.3Å; L252-V255 PolarHBondContact O-N 3.18Å; V255-T257 PolarHBondContact O-N 3.04Å; V255-S258 WeakPolarHBondContact O-CA 3.42Å; V255-S258 VanDerWaalsContact O-CB 3.28Å; V255-S258 WeakPolarHBondContact O-CB 3.23Å; V255-S258 PolarHBondContact O-N 3.42Å; V255-I259 HydrophobicContact CG1-CD1 3.99Å; V255-I259 PolarHBondContact O-N 3.36Å; V255-V654 HydrophobicContact CG2-CG1 4.15Å; V255-Q655 HydrophobicContact CG1-CB 4.11Å; V255-Q655 HydrophobicContact CG1-CG 4.2Å; V255-F658 HydrophobicContact CG2-CD2 4.02Å; V255-I662 HydrophobicContact CB-CD1 4.28Å; V255-I662 HydrophobicContact CG1-CD1 3.39Å
256	Q	80	Confident	79.2	Confident	38 Å²	38	42.8 Å²	42.8	18%	0.178	22%	0.221	C	C	.	.	H	α-helix	trans	-56.4	-48.4	175.8	-174.5	177.6	0.3	0	0	111.3	L252 S258 I259 I260	L252-Q256 WeakPolarHBondContact O-CB 3.49Å; L252-Q256 PolarHBondContact O-N 3.42Å; Q256-S258 PolarHBondContact O-N 2.71Å; Q256-I259 PolarHBondContact O-N 3.35Å; Q256-I259 VanDerWaalsContact O-N 3.09Å; Q256-I260 HydrophobicContact CG-CD1 3.92Å; Q256-I260 HydrophobicContact CG-CG1 4.47Å; Q256-I260 VanDerWaalsContact O-CG1 3.3Å; Q256-I260 WeakPolarHBondContact O-CG1 3.48Å; Q256-I260 PolarHBondContact O-N 3.12Å
257	T	77.7	Confident	79.4	Confident	61 Å²	61	40.9 Å²	40.9	37%	0.374	21%	0.211	S	C	.	.	H	α-helix	trans	-58.4	-36.9	175.4	-56.6	0	0	0	0	111.9	M253 V255 R261	M253-T257 WeakPolarHBondContact O-CB 3.43Å; M253-T257 PolarHBondContact O-N 2.81Å; M253-T257 PolarHBondContact O-OG1 2.73Å; V255-T257 PolarHBondContact O-N 3.04Å; T257-R261 WeakPolarHBondContact O-CB 3.43Å; T257-R261 VanDerWaalsContact O-CG 3.25Å; T257-R261 WeakPolarHBondContact O-CG 3.47Å; T257-R261 PolarHBondContact O-N 2.91Å
258	S	77	Confident	79.8	Confident	33 Å²	33	41.3 Å²	41.3	23%	0.231	22%	0.216	C	C	.	.	H	α-helix	trans	-67.4	-39.8	177.2	-166.4	0	0	0	0	112.2	S254 V255 Q256 R262 Q655	S254-S258 PolarHBondContact O-N 2.69Å; V255-S258 WeakPolarHBondContact O-CA 3.42Å; V255-S258 VanDerWaalsContact O-CB 3.28Å; V255-S258 WeakPolarHBondContact O-CB 3.23Å; V255-S258 PolarHBondContact O-N 3.42Å; Q256-S258 PolarHBondContact O-N 2.71Å; S258-R262 PolarHBondContact O-N 3.27Å; S258-R262 VanDerWaalsContact O-N 3.13Å; S258-Q655 PolarHBondContact OG-NE2 3.08Å
259	I	79.1	Confident	80.2	Confident	23 Å²	23	39.4 Å²	39.4	12%	0.118	22%	0.218	C	C	.	.	H	α-helix	trans	-68.9	-45.1	176.7	-70.2	166.3	0	0	0	110.2	V255 Q256 R261 R262 R263 I662	V255-I259 HydrophobicContact CG1-CD1 3.99Å; V255-I259 PolarHBondContact O-N 3.36Å; Q256-I259 PolarHBondContact O-N 3.35Å; Q256-I259 VanDerWaalsContact O-N 3.09Å; I259-R261 VanDerWaalsContact C-N 3.33Å; I259-R261 PolarHBondContact O-N 3.1Å; I259-R262 WeakPolarHBondContact O-CB 3.23Å; I259-R262 PolarHBondContact O-N 3.23Å; I259-R263 HydrophobicContact CG2-CG 4.13Å; I259-R263 WeakPolarHBondContact O-CG 3.29Å; I259-R263 PolarHBondContact O-N 3.03Å; I259-I662 HydrophobicContact CD1-CD1 3.67Å; I259-I662 HydrophobicContact CD1-CG2 3.91Å
260	I	83.3	Confident	80.8	Confident	23 Å²	23	37.7 Å²	37.7	12%	0.118	20%	0.2	C	C	.	.	H	α-helix	trans	-54.8	-49.9	175.5	-69.1	168.3	0	0	0	110.2	Q256 R262 R263 L264 P665	Q256-I260 HydrophobicContact CG-CD1 3.92Å; Q256-I260 HydrophobicContact CG-CG1 4.47Å; Q256-I260 VanDerWaalsContact O-CG1 3.3Å; Q256-I260 WeakPolarHBondContact O-CG1 3.48Å; Q256-I260 PolarHBondContact O-N 3.12Å; I260-R262 VanDerWaalsContact C-N 3.28Å; I260-R262 PolarHBondContact O-N 3.43Å; I260-R263 PolarHBondContact O-N 2.97Å; I260-L264 VanDerWaalsContact O-CB 3.26Å; I260-L264 WeakPolarHBondContact O-CB 2.95Å; I260-L264 PolarHBondContact O-N 3.24Å; I260-P665 HydrophobicContact CG1-CB 4.16Å; I260-P665 HydrophobicContact CG1-CG 4.21Å
261	R	82.7	Confident	81.3	Confident	158 Å²	158	36.2 Å²	36.2	60%	0.596	19%	0.194	S	C	*	.	H	α-helix	trans	-59.4	-38.5	177.4	-73.7	173.7	-172.7	-167.3	1.9	113	T257 I259 G265	T257-R261 WeakPolarHBondContact O-CB 3.43Å; T257-R261 VanDerWaalsContact O-CG 3.25Å; T257-R261 WeakPolarHBondContact O-CG 3.47Å; T257-R261 PolarHBondContact O-N 2.91Å; I259-R261 VanDerWaalsContact C-N 3.33Å; I259-R261 PolarHBondContact O-N 3.1Å; R261-G265 PolarHBondContact O-N 3.1Å
262	R	84.1	Confident	81.9	Confident	57 Å²	57	38.8 Å²	38.8	22%	0.215	21%	0.211	C	C	.	.	H	α-helix	trans	-66.2	-48.8	176.9	-173.5	177.2	73.9	178.8	9	110.7	S258 I259 I260 G265 I266 D334	S258-R262 PolarHBondContact O-N 3.27Å; S258-R262 VanDerWaalsContact O-N 3.13Å; I259-R262 WeakPolarHBondContact O-CB 3.23Å; I259-R262 PolarHBondContact O-N 3.23Å; I260-R262 VanDerWaalsContact C-N 3.28Å; I260-R262 PolarHBondContact O-N 3.43Å; R262-G265 PolarHBondContact O-N 2.96Å; R262-I266 HydrophobicContact CG-CD1 4.03Å; R262-I266 WeakPolarHBondContact O-CG1 3.44Å; R262-I266 PolarHBondContact O-N 3.33Å; R262-D334 IonicContact CZ-OD1 3.05Å; R262-D334 VanDerWaalsContact CZ-OD1 3.23Å; R262-D334 IonicContact CZ-OD2 2.71Å; R262-D334 IonicContact NH1-OD1 2.79Å; R262-D334 PolarHBondContact NH1-OD1 2.93Å; R262-D334 IonicContact NH1-OD2 3.17Å; R262-D334 VanDerWaalsContact NH2-CG 3.26Å; R262-D334 IonicContact NH2-OD1 2.92Å; R262-D334 PolarHBondContact NH2-OD1 3.47Å; R262-D334 IonicContact NH2-OD2 2.65Å; R262-D334 PolarHBondContact NH2-OD2 3.39Å
263	R	84.9	Confident	82.3	Confident	18 Å²	18	38.9 Å²	38.9	7%	0.068	21%	0.211	C	C	.	.	H	α-helix	trans	-62.8	-42.4	178.6	-66.8	-64.7	-173.9	-157.3	2.5	111.5	I259 I260 G265 I266 R267 D331 P665 L670	I259-R263 HydrophobicContact CG2-CG 4.13Å; I259-R263 WeakPolarHBondContact O-CG 3.29Å; I259-R263 PolarHBondContact O-N 3.03Å; I260-R263 PolarHBondContact O-N 2.97Å; R263-G265 PolarHBondContact O-N 3.39Å; R263-I266 PolarHBondContact O-N 3.15Å; R263-R267 WeakPolarHBondContact O-CB 3.44Å; R263-R267 PolarHBondContact O-N 2.91Å; R263-D331 IonicContact CZ-OD1 2.68Å; R263-D331 VanDerWaalsContact CZ-OD1 3.28Å; R263-D331 IonicContact NH1-OD1 3.74Å; R263-D331 PolarHBondContact NH1-OD1 2.96Å; R263-D331 IonicContact NH2-OD1 2.78Å; R263-D331 PolarHBondContact NH2-OD1 2.92Å; R263-P665 HydrophobicContact CB-CG 4.24Å; R263-P665 HydrophobicContact CG-CG 4.19Å; R263-L670 HydrophobicContact CB-CD1 4.2Å; R263-L670 HydrophobicContact CB-CD2 4.07Å
264	L	85.6	Confident	82.5	Confident	21 Å²	21	35 Å²	35	11%	0.11	19%	0.193	C	C	.	.	H	α-helix	trans	-60.7	-44.1	174.5	-172.9	69.9	0	0	0	111.6	I260 R267 A268 L670 Q673 L674	I260-L264 VanDerWaalsContact O-CB 3.26Å; I260-L264 WeakPolarHBondContact O-CB 2.95Å; I260-L264 PolarHBondContact O-N 3.24Å; L264-R267 PolarHBondContact O-N 3.45Å; L264-A268 WeakPolarHBondContact O-CB 3.47Å; L264-A268 PolarHBondContact O-N 2.76Å; L264-L670 HydrophobicContact CB-CD2 4.06Å; L264-L670 HydrophobicContact CD1-CD2 4.28Å; L264-L670 WeakPolarHBondContact CD1-O 3.27Å; L264-Q673 HydrophobicContact CD1-CB 4.27Å; L264-L674 HydrophobicContact CD1-CB 4.11Å; L264-L674 HydrophobicContact CD1-CD1 3.85Å; L264-L674 HydrophobicContact CG-CD1 4.32Å
265	G	87.1	Confident	82.4	Confident	37 Å²	37	36.9 Å²	36.9	38%	0.381	21%	0.206	S	C	.	.	H	α-helix	trans	-63.4	-41.4	176.3	0	0	0	0	0	113.3	R261 R262 R263 A269	R261-G265 PolarHBondContact O-N 3.1Å; R262-G265 PolarHBondContact O-N 2.96Å; R263-G265 PolarHBondContact O-N 3.39Å; G265-A269 WeakPolarHBondContact O-CB 3.39Å; G265-A269 PolarHBondContact O-N 3.17Å
266	I	87.4	Confident	81.9	Confident	19 Å²	19	44.3 Å²	44.3	10%	0.097	24%	0.239	C	C	.	.	H	α-helix	trans	-64.7	-43.4	175.1	-65.9	162.2	0	0	0	110.3	R262 R263 A269 F270 F326 F330	R262-I266 HydrophobicContact CG-CD1 4.03Å; R262-I266 WeakPolarHBondContact O-CG1 3.44Å; R262-I266 PolarHBondContact O-N 3.33Å; R263-I266 PolarHBondContact O-N 3.15Å; I266-A269 PolarHBondContact O-N 2.96Å; I266-F270 PolarHBondContact O-N 3.47Å; I266-F326 HydrophobicContact CG2-CD1 3.93Å; I266-F326 HydrophobicContact CG2-CE1 3.77Å; I266-F330 HydrophobicContact CD1-CB 3.64Å; I266-F330 HydrophobicContact CD1-CD2 4.42Å; I266-F330 HydrophobicContact CD1-CG 3.98Å; I266-F330 HydrophobicContact CG1-CB 4.32Å; I266-F330 HydrophobicContact CG1-CD2 4.25Å; I266-F330 HydrophobicContact CG1-CG 4.11Å; I266-F330 HydrophobicContact CG2-CD2 3.75Å; I266-F330 HydrophobicContact CG2-CE2 4.24Å; I266-F330 HydrophobicContact CG2-CG 4.38Å
267	R	86.4	Confident	80.9	Confident	23 Å²	23	45.1 Å²	45.1	9%	0.087	25%	0.245	C	C	.	.	H	α-helix	trans	-64.1	-43.5	177.6	-179.2	60.2	-179.2	142.9	4.9	112.1	R263 L264 A269 F270 H271 E284	R263-R267 WeakPolarHBondContact O-CB 3.44Å; R263-R267 PolarHBondContact O-N 2.91Å; L264-R267 PolarHBondContact O-N 3.45Å; R267-A269 VanDerWaalsContact C-N 3.35Å; R267-F270 VanDerWaalsContact NH1-CE1 3.33Å; R267-F270 WeakPolarHBondContact O-CB 3.36Å; R267-F270 PolarHBondContact O-N 2.86Å; R267-H271 PolarHBondContact O-N 3.13Å; R267-E284 IonicContact CZ-OE2 4Å; R267-E284 VanDerWaalsContact CZ-OE2 3.26Å; R267-E284 IonicContact NH1-OE1 2.67Å; R267-E284 IonicContact NH1-OE2 3.16Å; R267-E284 PolarHBondContact NH1-OE2 2.77Å; R267-E284 IonicContact NH2-OE1 3.45Å; R267-E284 PolarHBondContact NH2-OE1 3.28Å; R267-E284 VanDerWaalsContact NH2-OE1 3.14Å; R267-E284 IonicContact NH2-OE2 3.14Å; R267-E284 PolarHBondContact NH2-OE2 2.98Å
268	A	85.1	Confident	79.7	Confident	18 Å²	18	45.6 Å²	45.6	15%	0.149	25%	0.251	C	S	.	.	H	α-helix	trans	-61	-44.1	175.6	0	0	0	0	0	111.5	L264 H271 V272 L674 L680	L264-A268 WeakPolarHBondContact O-CB 3.47Å; L264-A268 PolarHBondContact O-N 2.76Å; A268-H271 PolarHBondContact O-N 3.2Å; A268-V272 WeakPolarHBondContact O-CG2 3.36Å; A268-V272 PolarHBondContact O-N 2.77Å; A268-L674 HydrophobicContact CB-CD1 3.75Å; A268-L680 HydrophobicContact CB-CD2 4.46Å
269	A	86.6	Confident	78.4	Confident	43 Å²	43	53 Å²	53	36%	0.355	28%	0.282	S	S	.	.	H	α-helix	trans	-62.4	-42.6	177	0	0	0	0	0	112.1	G265 I266 R267 V272 L273	G265-A269 WeakPolarHBondContact O-CB 3.39Å; G265-A269 PolarHBondContact O-N 3.17Å; I266-A269 PolarHBondContact O-N 2.96Å; R267-A269 VanDerWaalsContact C-N 3.35Å; A269-V272 PolarHBondContact O-N 3.05Å; A269-L273 WeakPolarHBondContact O-CB 3.36Å; A269-L273 VanDerWaalsContact O-CG 3.26Å; A269-L273 WeakPolarHBondContact O-CG 3.33Å; A269-L273 PolarHBondContact O-N 3.23Å
270	F	87.1	Confident	76.9	Confident	2 Å²	2	58.1 Å²	58.1	1%	0.009	31%	0.314	C	S	.	.	H	α-helix	trans	-58.9	-47.6	175.1	179.4	-93.9	0	0	0	111.8	I266 R267 V272 L273 S274 E284 V286 R323 F326	I266-F270 PolarHBondContact O-N 3.47Å; R267-F270 VanDerWaalsContact NH1-CE1 3.33Å; R267-F270 WeakPolarHBondContact O-CB 3.36Å; R267-F270 PolarHBondContact O-N 2.86Å; F270-V272 PolarHBondContact O-N 3.05Å; F270-L273 PolarHBondContact O-N 3.14Å; F270-S274 PolarHBondContact O-N 3.16Å; F270-S274 PolarHBondContact O-OG 2.8Å; F270-E284 HydrophobicContact CE1-CB 3.63Å; F270-E284 WeakPolarHBondContact CE1-OE2 3.46Å; F270-E284 HydrophobicContact CZ-CB 4.04Å; F270-E284 VanDerWaalsContact CZ-O 3.27Å; F270-E284 WeakPolarHBondContact CZ-O 3.27Å; F270-V286 HydrophobicContact CD2-CB 4.44Å; F270-V286 HydrophobicContact CD2-CG2 3.49Å; F270-V286 VanDerWaalsContact CD2-CG2 3.49Å; F270-V286 HydrophobicContact CE2-CB 4.27Å; F270-V286 HydrophobicContact CE2-CG2 3.51Å; F270-V286 HydrophobicContact CG-CG2 4.19Å; F270-V286 HydrophobicContact CZ-CG2 4.23Å; F270-R323 HydrophobicContact CE1-CB 3.93Å; F270-R323 HydrophobicContact CE1-CG 4.29Å; F270-R323 HydrophobicContact CE2-CB 4.24Å; F270-R323 VanDerWaalsContact CZ-CA 3.47Å; F270-R323 HydrophobicContact CZ-CB 3.68Å; F270-R323 HydrophobicContact CZ-CG 4.44Å; F270-F326 HydrophobicContact CB-CD1 3.77Å; F270-F326 HydrophobicContact CB-CE1 3.71Å; F270-F326 HydrophobicContact CB-CZ 4.42Å; F270-F326 HydrophobicContact CD2-CB 3.67Å; F270-F326 AromaticContact CD2-CD1 3.65Å; F270-F326 HydrophobicContact CD2-CD1 3.65Å; F270-F326 HydrophobicContact CD2-CD2 4.14Å; F270-F326 HydrophobicContact CD2-CE1 4.26Å; F270-F326 AromaticContact CD2-CG 3.56Å; F270-F326 HydrophobicContact CD2-CG 3.56Å; F270-F326 HydrophobicContact CE2-CB 3.94Å; F270-F326 HydrophobicContact CE2-CG 4.29Å; F270-F326 HydrophobicContact CG-CD1 4.14Å; F270-F326 HydrophobicContact CG-CE1 4.5Å; F270-F326 HydrophobicContact CG-CG 4.48Å
271	H	83.1	Confident	75.2	Confident	9 Å²	9	65.9 Å²	65.9	4%	0.042	35%	0.35	C	S	.	.	H	α-helix	trans	-62	-43	-179.9	-175.3	-82.4	0	0	0	112.3	R267 A268 L273 S274 C275 L682 W684	R267-H271 PolarHBondContact O-N 3.13Å; A268-H271 PolarHBondContact O-N 3.2Å; H271-L273 VanDerWaalsContact C-N 3.31Å; H271-L273 PolarHBondContact O-N 2.74Å; H271-S274 WeakPolarHBondContact CA-OG 3.49Å; H271-S274 PolarHBondContact O-N 2.96Å; H271-S274 PolarHBondContact O-OG 2.79Å; H271-C275 PolarHBondContact CE1-SG 3.44Å; H271-C275 PolarHBondContact O-N 2.85Å; H271-C275 PolarHBondContact O-SG 3.11Å; H271-L682 VanDerWaalsContact ND1-CD1 3.31Å; H271-L682 WeakPolarHBondContact ND1-CD1 3.49Å; H271-L682 WeakPolarHBondContact ND1-CD2 3.39Å; H271-W684 AromaticContact CD2-CH2 3.3Å; H271-W684 WeakPolarHBondContact CD2-CH2 3.31Å; H271-W684 AromaticContact CD2-CZ3 3.26Å; H271-W684 WeakPolarHBondContact CD2-CZ3 3.31Å; H271-W684 AromaticContact CE1-CH2 3.96Å; H271-W684 AromaticContact CE1-CZ3 3.92Å; H271-W684 AromaticContact CG-CH2 3.96Å; H271-W684 AromaticContact NE2-CE3 3.4Å; H271-W684 AromaticContact NE2-CH2 3.32Å; H271-W684 VanDerWaalsContact NE2-CH2 3.32Å; H271-W684 WeakPolarHBondContact NE2-CH2 3.42Å; H271-W684 AromaticContact NE2-CZ3 2.97Å; H271-W684 WeakPolarHBondContact NE2-CZ3 3.29Å
272	V	83.9	Confident	73.8	Confident	78 Å²	78	63.5 Å²	63.5	47%	0.473	36%	0.364	S	S	.	.	H	α-helix	trans	-64.6	-38	177.2	173.7	0	0	0	0	111.4	A268 A269 F270 L682	A268-V272 WeakPolarHBondContact O-CG2 3.36Å; A268-V272 PolarHBondContact O-N 2.77Å; A269-V272 PolarHBondContact O-N 3.05Å; F270-V272 PolarHBondContact O-N 3.05Å; V272-L682 HydrophobicContact CG2-CD2 4.08Å
273	L	83.4	Confident	72.7	Confident	31 Å²	31	67.8 Å²	67.8	16%	0.162	39%	0.386	C	S	.	.	H	α-helix	trans	-74.7	-28	179.8	-71.6	170.3	0	0	0	113.3	A269 F270 H271 V286 A290 V294 F326	A269-L273 WeakPolarHBondContact O-CB 3.36Å; A269-L273 VanDerWaalsContact O-CG 3.26Å; A269-L273 WeakPolarHBondContact O-CG 3.33Å; A269-L273 PolarHBondContact O-N 3.23Å; F270-L273 PolarHBondContact O-N 3.14Å; H271-L273 VanDerWaalsContact C-N 3.31Å; H271-L273 PolarHBondContact O-N 2.74Å; L273-V286 HydrophobicContact CB-CG1 3.84Å; L273-V286 HydrophobicContact CB-CG2 3.95Å; L273-V286 HydrophobicContact CD1-CG1 4.28Å; L273-A290 HydrophobicContact CD2-CB 4.41Å; L273-V294 HydrophobicContact CD2-CG2 4.24Å; L273-F326 HydrophobicContact CD1-CE2 4.27Å; L273-F326 HydrophobicContact CD1-CZ 4.2Å
274	S	80.5	Confident	72.1	Confident	8 Å²	8	69.8 Å²	69.8	6%	0.056	40%	0.396	C	S	.	.	H	α-helix	trans	-77.5	-40.7	174.9	61.3	0	0	0	0	111.8	F270 H271 H276 N277 S278	F270-S274 PolarHBondContact O-N 3.16Å; F270-S274 PolarHBondContact O-OG 2.8Å; H271-S274 WeakPolarHBondContact CA-OG 3.49Å; H271-S274 PolarHBondContact O-N 2.96Å; H271-S274 PolarHBondContact O-OG 2.79Å; S274-H276 PolarHBondContact O-N 3.18Å; S274-N277 PolarHBondContact O-N 2.88Å; S274-S278 PolarHBondContact O-N 3.49Å
275	C	70.8	Confident	71.9	Confident	66 Å²	66	71.6 Å²	71.6	45%	0.446	41%	0.406	S	S	.	.	H	α-helix	trans	-60.9	-28.2	177.7	-73.8	0	0	0	0	114	H271 N277	H271-C275 PolarHBondContact CE1-SG 3.44Å; H271-C275 PolarHBondContact O-N 2.85Å; H271-C275 PolarHBondContact O-SG 3.11Å; C275-N277 PolarHBondContact O-N 3.32Å
276	H	65.1	Low	71.8	Confident	165 Å²	165	69.9 Å²	69.9	76%	0.764	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-16.2	177.5	-163.4	66.2	0	0	0	113	S274	S274-H276 PolarHBondContact O-N 3.18Å
277	N	56.9	Low	71.7	Confident	54 Å²	54	74.2 Å²	74.2	29%	0.289	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.1	-10.1	-167.9	-74.9	-31.6	0	0	0	115.6	S274 C275 Q279	S274-N277 PolarHBondContact O-N 2.88Å; C275-N277 PolarHBondContact O-N 3.32Å; N277-Q279 PolarHBondContact O-N 3.13Å
278	S	52.8	Low	71.7	Confident	71 Å²	71	73.2 Å²	73.2	50%	0.497	40%	0.4	S	S	.	.			trans	-91.8	102.1	-172.3	50.4	0	0	0	0	114.1	S274	S274-S278 PolarHBondContact O-N 3.49Å
279	Q	50.7	Low	71.7	Confident	190 Å²	190	78 Å²	78	89%	0.888	42%	0.422	S	S	*	.	S	Bend	trans	-100.7	-7.2	157.3	-82	-170.4	-16	0	0	113.5	N277	N277-Q279 PolarHBondContact O-N 3.13Å
280	T	46.6	Very low	71.6	Confident	129 Å²	129	77 Å²	77	79%	0.791	42%	0.415	S	S	*	.	S	Bend	trans	-138.6	150.2	-176.2	4.7	0	0	0	0	112.6
281	E	48.1	Very low	71.7	Confident	187 Å²	187	77.2 Å²	77.2	87%	0.874	42%	0.416	S	S	*	.	S	Bend	trans	-69.9	157.8	-148	-65.8	170.6	151.7	0	0	118.2	Q283	E281-Q283 PolarHBondContact O-N 3.47Å
282	A	53.6	Low	71.9	Confident	107 Å²	107	78.9 Å²	78.9	88%	0.884	43%	0.425	S	S	*	.	S	Bend	trans	75.9	-19.8	155.9	0	0	0	0	0	121.8
283	Q	61.3	Low	72.1	Confident	147 Å²	147	80.8 Å²	80.8	69%	0.687	43%	0.429	S	S	*	.			trans	-124.7	119.7	180	-72.3	-178	-17.5	0	0	113.4	E281 L285	E281-Q283 PolarHBondContact O-N 3.47Å; Q283-L285 HydrophobicContact CB-CD1 3.85Å; Q283-L285 HydrophobicContact CB-CG 4.06Å; Q283-L285 PolarHBondContact O-N 3.38Å
284	E	72.1	Confident	72.3	Confident	61 Å²	61	82.4 Å²	82.4	29%	0.285	44%	0.44	S	S	.	.			trans	-67.6	100.9	170.5	-63	-178.2	157.5	0	0	109.1	R267 F270	R267-E284 IonicContact CZ-OE2 4Å; R267-E284 VanDerWaalsContact CZ-OE2 3.26Å; R267-E284 IonicContact NH1-OE1 2.67Å; R267-E284 IonicContact NH1-OE2 3.16Å; R267-E284 PolarHBondContact NH1-OE2 2.77Å; R267-E284 IonicContact NH2-OE1 3.45Å; R267-E284 PolarHBondContact NH2-OE1 3.28Å; R267-E284 VanDerWaalsContact NH2-OE1 3.14Å; R267-E284 IonicContact NH2-OE2 3.14Å; R267-E284 PolarHBondContact NH2-OE2 2.98Å; F270-E284 HydrophobicContact CE1-CB 3.63Å; F270-E284 WeakPolarHBondContact CE1-OE2 3.46Å; F270-E284 HydrophobicContact CZ-CB 4.04Å; F270-E284 VanDerWaalsContact CZ-O 3.27Å; F270-E284 WeakPolarHBondContact CZ-O 3.27Å
285	L	81.9	Confident	72.7	Confident	59 Å²	59	82.4 Å²	82.4	31%	0.309	44%	0.439	S	S	.	.			trans	-122.2	142.3	-178	-70.9	158.8	0	0	0	110.8	Q283 Y320	Q283-L285 HydrophobicContact CB-CD1 3.85Å; Q283-L285 HydrophobicContact CB-CG 4.06Å; Q283-L285 PolarHBondContact O-N 3.38Å; L285-Y320 HydrophobicContact CB-CD1 4.14Å
286	V	84.9	Confident	73.5	Confident	0 Å²	0	82.7 Å²	82.7	0%	0	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	130	178.5	175.9	0	0	0	0	110.4	F270 L273 V291 Y320 M321	F270-V286 HydrophobicContact CD2-CB 4.44Å; F270-V286 HydrophobicContact CD2-CG2 3.49Å; F270-V286 VanDerWaalsContact CD2-CG2 3.49Å; F270-V286 HydrophobicContact CE2-CB 4.27Å; F270-V286 HydrophobicContact CE2-CG2 3.51Å; F270-V286 HydrophobicContact CG-CG2 4.19Å; F270-V286 HydrophobicContact CZ-CG2 4.23Å; L273-V286 HydrophobicContact CB-CG1 3.84Å; L273-V286 HydrophobicContact CB-CG2 3.95Å; L273-V286 HydrophobicContact CD1-CG1 4.28Å; V286-V291 HydrophobicContact CG1-CG2 3.64Å; V286-Y320 CarbonylContact O-C 3.5Å; V286-Y320 WeakPolarHBondContact O-CA 3.41Å; V286-M321 PolarHBondContact N-O 2.88Å; V286-M321 PolarHBondContact O-N 2.67Å
287	R	84.9	Confident	74.5	Confident	111 Å²	111	83.9 Å²	83.9	42%	0.419	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	134.9	175	-74	-176.6	179.5	167.4	4.3	111.5	D289 A290 V291 G319 Y320	R287-D289 VanDerWaalsContact C-N 3.28Å; R287-D289 PolarHBondContact O-N 3.27Å; R287-A290 HydrophobicContact CB-CB 4.46Å; R287-A290 PolarHBondContact O-N 3.15Å; R287-V291 PolarHBondContact O-N 3.14Å; R287-G319 WeakPolarHBondContact CA-O 3.34Å; R287-Y320 HydrophobicContact CG-CD1 3.8Å; R287-Y320 HydrophobicContact CG-CE1 3.36Å; R287-Y320 PolarHBondContact NE-OH 3.42Å
288	V	86	Confident	76	Confident	2 Å²	2	83.9 Å²	83.9	1%	0.012	44%	0.441	C	S	.	.	H	α-helix	trans	-61.4	-37.5	179.5	-176.7	0	0	0	0	111.9	A290 V291 L292 S312 F315 G319 M321	V288-A290 VanDerWaalsContact C-N 3.3Å; V288-A290 PolarHBondContact O-N 3.25Å; V288-V291 WeakPolarHBondContact O-CB 3.37Å; V288-V291 PolarHBondContact O-N 2.92Å; V288-V291 VanDerWaalsContact O-N 3.09Å; V288-L292 HydrophobicContact CG1-CD1 4.19Å; V288-L292 HydrophobicContact CG1-CG 4.38Å; V288-L292 PolarHBondContact O-N 3.39Å; V288-S312 VanDerWaalsContact CG1-O 3.31Å; V288-S312 WeakPolarHBondContact CG1-O 3.29Å; V288-F315 HydrophobicContact CG2-CB 4.33Å; V288-G319 PolarHBondContact N-O 2.87Å; V288-G319 VanDerWaalsContact N-O 3.12Å; V288-M321 HydrophobicContact CB-CE 4.32Å; V288-M321 HydrophobicContact CG1-CE 3.91Å; V288-M321 HydrophobicContact CG2-CE 3.72Å; V288-M321 HydrophobicContact CG2-CG 4.01Å; V288-M321 HydrophobicContact CG2-SD 4.3Å
289	D	84.9	Confident	77.4	Confident	118 Å²	118	87.8 Å²	87.8	63%	0.631	46%	0.457	S	S	*	.	H	α-helix	trans	-61.1	-38.3	179.2	-62.1	-34.5	0	0	0	112.8	R287 V291 L292 Q293	R287-D289 VanDerWaalsContact C-N 3.28Å; R287-D289 PolarHBondContact O-N 3.27Å; D289-V291 VanDerWaalsContact C-N 3.33Å; D289-L292 PolarHBondContact O-N 3.3Å; D289-Q293 WeakPolarHBondContact O-CB 3.24Å; D289-Q293 PolarHBondContact O-N 3.41Å
290	A	85.8	Confident	78.9	Confident	23 Å²	23	81.1 Å²	81.1	19%	0.19	43%	0.426	C	S	.	.	H	α-helix	trans	-65.7	-39.3	176.7	0	0	0	0	0	110.9	L273 R287 V288 Q293 V294	L273-A290 HydrophobicContact CD2-CB 4.41Å; R287-A290 HydrophobicContact CB-CB 4.46Å; R287-A290 PolarHBondContact O-N 3.15Å; V288-A290 VanDerWaalsContact C-N 3.3Å; V288-A290 PolarHBondContact O-N 3.25Å; A290-Q293 PolarHBondContact O-N 2.94Å; A290-V294 VanDerWaalsContact O-CG2 3.29Å; A290-V294 WeakPolarHBondContact O-CG2 3.38Å; A290-V294 PolarHBondContact O-N 2.97Å
291	V	87.6	Confident	80.5	Confident	5 Å²	5	81.9 Å²	81.9	3%	0.03	42%	0.418	C	S	.	.	H	α-helix	trans	-64.1	-46.9	175.5	-177.4	0	0	0	0	110.6	V286 R287 V288 D289 Q293 V294 M295 M321 F326	V286-V291 HydrophobicContact CG1-CG2 3.64Å; R287-V291 PolarHBondContact O-N 3.14Å; V288-V291 WeakPolarHBondContact O-CB 3.37Å; V288-V291 PolarHBondContact O-N 2.92Å; V288-V291 VanDerWaalsContact O-N 3.09Å; D289-V291 VanDerWaalsContact C-N 3.33Å; V291-Q293 VanDerWaalsContact C-N 3.33Å; V291-Q293 PolarHBondContact O-N 2.92Å; V291-V294 PolarHBondContact O-N 3.13Å; V291-M295 HydrophobicContact CG1-CG 4.26Å; V291-M295 WeakPolarHBondContact O-CB 3.37Å; V291-M295 VanDerWaalsContact O-CG 3.27Å; V291-M295 WeakPolarHBondContact O-CG 3.44Å; V291-M295 PolarHBondContact O-N 3.46Å; V291-M321 HydrophobicContact CG2-SD 4.45Å; V291-F326 HydrophobicContact CG1-CE2 4.48Å; V291-F326 HydrophobicContact CG2-CD2 4.3Å; V291-F326 HydrophobicContact CG2-CE2 3.88Å
292	L	87.6	Confident	82.2	Confident	44 Å²	44	83.7 Å²	83.7	23%	0.23	42%	0.417	C	S	.	.	H	α-helix	trans	-60.6	-42	177.3	-70.5	173	0	0	0	112	V288 D289 M295 S296 T309 S312 Q313	V288-L292 HydrophobicContact CG1-CD1 4.19Å; V288-L292 HydrophobicContact CG1-CG 4.38Å; V288-L292 PolarHBondContact O-N 3.39Å; D289-L292 PolarHBondContact O-N 3.3Å; L292-M295 PolarHBondContact O-N 3.2Å; L292-S296 PolarHBondContact O-N 3.34Å; L292-T309 HydrophobicContact CD2-CG2 3.65Å; L292-S312 VanDerWaalsContact CD2-OG 3.23Å; L292-S312 WeakPolarHBondContact CD2-OG 3.15Å; L292-Q313 HydrophobicContact CD2-CG 4.26Å
293	Q	87.8	Confident	83.5	Confident	119 Å²	119	83.4 Å²	83.4	56%	0.556	40%	0.396	S	S	*	.	H	α-helix	trans	-63.5	-44.2	176.5	-168.4	-176.8	18.2	0	0	111.7	D289 A290 V291 S296	D289-Q293 WeakPolarHBondContact O-CB 3.24Å; D289-Q293 PolarHBondContact O-N 3.41Å; A290-Q293 PolarHBondContact O-N 2.94Å; V291-Q293 VanDerWaalsContact C-N 3.33Å; V291-Q293 PolarHBondContact O-N 2.92Å; Q293-S296 WeakPolarHBondContact O-CB 3.5Å; Q293-S296 PolarHBondContact O-N 3.39Å; Q293-S296 PolarHBondContact O-OG 3.47Å
294	V	88.9	Confident	84.5	Confident	65 Å²	65	79 Å²	79	39%	0.394	37%	0.373	S	S	.	.	H	α-helix	trans	-62.5	-49.2	175.1	170.6	0	0	0	0	110.4	L273 A290 V291 S296 R297 V298	L273-V294 HydrophobicContact CD2-CG2 4.24Å; A290-V294 VanDerWaalsContact O-CG2 3.29Å; A290-V294 WeakPolarHBondContact O-CG2 3.38Å; A290-V294 PolarHBondContact O-N 2.97Å; V291-V294 PolarHBondContact O-N 3.13Å; V294-S296 PolarHBondContact O-N 3.42Å; V294-R297 PolarHBondContact O-N 3.32Å; V294-V298 HydrophobicContact CG1-CG2 3.93Å; V294-V298 WeakPolarHBondContact O-CG2 3.34Å; V294-V298 PolarHBondContact O-N 3.09Å
295	M	88.6	Confident	85.2	Confident	7 Å²	7	78.7 Å²	78.7	3%	0.034	37%	0.371	C	S	.	.	H	α-helix	trans	-58.8	-33.6	179.5	-71.4	-52.3	-58.2	0	0	112.1	V291 L292 R297 V298 M300 K305 I308	V291-M295 HydrophobicContact CG1-CG 4.26Å; V291-M295 WeakPolarHBondContact O-CB 3.37Å; V291-M295 VanDerWaalsContact O-CG 3.27Å; V291-M295 WeakPolarHBondContact O-CG 3.44Å; V291-M295 PolarHBondContact O-N 3.46Å; L292-M295 PolarHBondContact O-N 3.2Å; M295-R297 VanDerWaalsContact C-N 3.27Å; M295-R297 PolarHBondContact O-N 3.35Å; M295-V298 PolarHBondContact O-N 3.19Å; M295-M300 HydrophobicContact CE-CE 4.06Å; M295-M300 HydrophobicContact CE-SD 3.5Å; M295-M300 WeakPolarHBondContact CE-SD 3.49Å; M295-K305 HydrophobicContact CE-CG 4.47Å; M295-K305 WeakPolarHBondContact O-CE 3.29Å; M295-K305 PolarHBondContact O-NZ 3.14Å; M295-I308 HydrophobicContact CE-CB 4.03Å; M295-I308 HydrophobicContact CE-CD1 4.02Å; M295-I308 HydrophobicContact CE-CG2 3.6Å; M295-I308 HydrophobicContact CG-CG2 4.06Å; M295-I308 HydrophobicContact SD-CG2 3.86Å
296	S	86.7	Confident	85.4	Confident	72 Å²	72	78.7 Å²	78.7	50%	0.503	38%	0.376	S	S	.	.	H	α-helix	trans	-60.4	-34.7	174.7	83.1	0	0	0	0	112.9	L292 Q293 V294 K305	L292-S296 PolarHBondContact O-N 3.34Å; Q293-S296 WeakPolarHBondContact O-CB 3.5Å; Q293-S296 PolarHBondContact O-N 3.39Å; Q293-S296 PolarHBondContact O-OG 3.47Å; V294-S296 PolarHBondContact O-N 3.42Å; S296-K305 PolarHBondContact O-NZ 2.84Å
297	R	87.6	Confident	85.5	Confident	190 Å²	190	79.8 Å²	79.8	72%	0.717	39%	0.385	S	S	*	.	H	α-helix	trans	-90.6	-24.2	-178.9	-64.4	-173.5	176.9	-172.2	-0.1	113.8	V294 M295 N299	V294-R297 PolarHBondContact O-N 3.32Å; M295-R297 VanDerWaalsContact C-N 3.27Å; M295-R297 PolarHBondContact O-N 3.35Å; R297-N299 PolarHBondContact O-N 3.29Å
298	V	87.4	Confident	85.6	Confident	55 Å²	55	74.5 Å²	74.5	33%	0.333	37%	0.365	S	S	.	.			trans	-65.6	131.1	179.8	173.5	0	0	0	0	110.6	V294 M295 M300 K305	V294-V298 HydrophobicContact CG1-CG2 3.93Å; V294-V298 WeakPolarHBondContact O-CG2 3.34Å; V294-V298 PolarHBondContact O-N 3.09Å; M295-V298 PolarHBondContact O-N 3.19Å; V298-M300 HydrophobicContact CG1-CB 4.42Å; V298-M300 HydrophobicContact CG1-CE 4.45Å; V298-M300 HydrophobicContact CG1-CG 4.1Å; V298-K305 PolarHBondContact O-NZ 3.41Å
299	N	82.3	Confident	85.6	Confident	153 Å²	153	76 Å²	76	82%	0.818	38%	0.375	S	S	*	.			trans	-86.1	106.3	172	-173.1	10.6	0	0	0	110	R297	R297-N299 PolarHBondContact O-N 3.29Å
300	M	82.1	Confident	85.8	Confident	49 Å²	49	74.3 Å²	74.3	24%	0.241	37%	0.368	C	S	.	.			trans	-147.9	168.1	174.7	53	160.3	38.8	0	0	110.2	M295 V298 R302 K305 I308 L333	M295-M300 HydrophobicContact CE-CE 4.06Å; M295-M300 HydrophobicContact CE-SD 3.5Å; M295-M300 WeakPolarHBondContact CE-SD 3.49Å; V298-M300 HydrophobicContact CG1-CB 4.42Å; V298-M300 HydrophobicContact CG1-CE 4.45Å; V298-M300 HydrophobicContact CG1-CG 4.1Å; M300-R302 PolarHBondContact O-N 3.45Å; M300-K305 HydrophobicContact CG-CB 3.84Å; M300-K305 HydrophobicContact CG-CD 4.36Å; M300-K305 HydrophobicContact CG-CG 4.3Å; M300-K305 WeakPolarHBondContact SD-CA 3.26Å; M300-K305 HydrophobicContact SD-CB 3.7Å; M300-K305 HydrophobicContact SD-CG 4.27Å; M300-K305 PolarHBondContact SD-N 2.85Å; M300-K305 VanDerWaalsContact SD-N 3.4Å; M300-I308 HydrophobicContact CE-CD1 3.85Å; M300-I308 HydrophobicContact SD-CD1 4.15Å; M300-L333 HydrophobicContact CE-CD2 4.21Å
301	K	80.6	Confident	85.8	Confident	146 Å²	146	73.6 Å²	73.6	64%	0.635	36%	0.363	S	S	*	.			trans	-56.8	135.3	176.5	-62.1	-177.8	-177.5	173.2	0	109.4	F303 Y304 K305	K301-F303 PolarHBondContact O-N 2.92Å; K301-F303 VanDerWaalsContact O-N 3.11Å; K301-Y304 HydrophobicContact CB-CD2 3.96Å; K301-Y304 HydrophobicContact CD-CD2 4.22Å; K301-Y304 HydrophobicContact CD-CE2 3.98Å; K301-Y304 HydrophobicContact CG-CD2 4.46Å; K301-Y304 PolarHBondContact O-N 3.22Å; K301-Y304 VanDerWaalsContact O-N 3.14Å; K301-K305 PolarHBondContact O-N 2.91Å; K301-K305 VanDerWaalsContact O-N 3.1Å
302	R	82.7	Confident	85.8	Confident	225 Å²	225	73.4 Å²	73.4	85%	0.849	36%	0.361	S	S	*	.	H	α-helix	trans	-51.7	-39	-174.8	-71.5	-175.1	-177.9	175.9	-0	113.2	M300 K305 S306	M300-R302 PolarHBondContact O-N 3.45Å; R302-K305 WeakPolarHBondContact O-CB 3.36Å; R302-K305 PolarHBondContact O-N 3.13Å; R302-S306 PolarHBondContact O-N 2.8Å; R302-S306 PolarHBondContact O-OG 3.04Å; R302-S306 VanDerWaalsContact O-OG 3.12Å
303	F	81.3	Confident	85.7	Confident	101 Å²	101	76.2 Å²	76.2	44%	0.443	37%	0.373	S	S	.	.	H	α-helix	trans	-61.9	-51.1	179.1	176.7	-91.8	0	0	0	113.3	K301 K305 S306 A307 C337	K301-F303 PolarHBondContact O-N 2.92Å; K301-F303 VanDerWaalsContact O-N 3.11Å; F303-K305 VanDerWaalsContact C-N 3.26Å; F303-K305 PolarHBondContact O-N 3.28Å; F303-S306 WeakPolarHBondContact CA-OG 3.36Å; F303-S306 PolarHBondContact O-N 3.16Å; F303-S306 PolarHBondContact O-OG 3.49Å; F303-A307 WeakPolarHBondContact O-CB 3.19Å; F303-A307 PolarHBondContact O-N 2.91Å; F303-C337 HydrophobicContact CD1-CB 4.26Å; F303-C337 WeakPolarHBondContact CD1-SG 3.33Å; F303-C337 HydrophobicContact CE1-CB 4Å; F303-C337 WeakPolarHBondContact CE1-SG 3.39Å; F303-C337 HydrophobicContact CZ-CB 4.23Å
304	Y	82.9	Confident	85.5	Confident	53 Å²	53	77.5 Å²	77.5	21%	0.208	38%	0.379	C	S	.	.	H	α-helix	trans	-65.1	-36.3	177.9	-64.9	-58.4	0	0	0	111	K301 A307 I308 L333	K301-Y304 HydrophobicContact CB-CD2 3.96Å; K301-Y304 HydrophobicContact CD-CD2 4.22Å; K301-Y304 HydrophobicContact CD-CE2 3.98Å; K301-Y304 HydrophobicContact CG-CD2 4.46Å; K301-Y304 PolarHBondContact O-N 3.22Å; K301-Y304 VanDerWaalsContact O-N 3.14Å; Y304-A307 PolarHBondContact O-N 2.94Å; Y304-I308 WeakPolarHBondContact O-CB 3.13Å; Y304-I308 WeakPolarHBondContact O-CG1 3.36Å; Y304-I308 PolarHBondContact O-N 3.39Å; Y304-L333 HydrophobicContact CD1-CD2 4.27Å; Y304-L333 HydrophobicContact CG-CD2 4.1Å
305	K	86.9	Confident	85.2	Confident	55 Å²	55	76.3 Å²	76.3	24%	0.239	37%	0.369	C	S	.	.	H	α-helix	trans	-59.7	-49.6	174.3	-168.5	167.4	171.3	151.1	0	111.1	M295 S296 V298 M300 K301 R302 F303 T309	M295-K305 HydrophobicContact CE-CG 4.47Å; M295-K305 WeakPolarHBondContact O-CE 3.29Å; M295-K305 PolarHBondContact O-NZ 3.14Å; S296-K305 PolarHBondContact O-NZ 2.84Å; V298-K305 PolarHBondContact O-NZ 3.41Å; M300-K305 HydrophobicContact CG-CB 3.84Å; M300-K305 HydrophobicContact CG-CD 4.36Å; M300-K305 HydrophobicContact CG-CG 4.3Å; M300-K305 WeakPolarHBondContact SD-CA 3.26Å; M300-K305 HydrophobicContact SD-CB 3.7Å; M300-K305 HydrophobicContact SD-CG 4.27Å; M300-K305 PolarHBondContact SD-N 2.85Å; M300-K305 VanDerWaalsContact SD-N 3.4Å; K301-K305 PolarHBondContact O-N 2.91Å; K301-K305 VanDerWaalsContact O-N 3.1Å; R302-K305 WeakPolarHBondContact O-CB 3.36Å; R302-K305 PolarHBondContact O-N 3.13Å; F303-K305 VanDerWaalsContact C-N 3.26Å; F303-K305 PolarHBondContact O-N 3.28Å; K305-T309 VanDerWaalsContact O-CB 3.3Å; K305-T309 WeakPolarHBondContact O-CB 3.45Å; K305-T309 PolarHBondContact O-N 3.06Å; K305-T309 PolarHBondContact O-OG1 2.86Å
306	S	86	Confident	84.6	Confident	60 Å²	60	78.6 Å²	78.6	42%	0.42	39%	0.389	S	S	.	.	H	α-helix	trans	-64.3	-42.4	178.4	52.6	0	0	0	0	112.1	R302 F303 T309 V310	R302-S306 PolarHBondContact O-N 2.8Å; R302-S306 PolarHBondContact O-OG 3.04Å; R302-S306 VanDerWaalsContact O-OG 3.12Å; F303-S306 WeakPolarHBondContact CA-OG 3.36Å; F303-S306 PolarHBondContact O-N 3.16Å; F303-S306 PolarHBondContact O-OG 3.49Å; S306-T309 PolarHBondContact O-N 3.48Å; S306-V310 WeakPolarHBondContact O-CB 3.19Å; S306-V310 VanDerWaalsContact O-CG2 3.29Å; S306-V310 WeakPolarHBondContact O-CG2 3.4Å; S306-V310 PolarHBondContact O-N 3.44Å
307	A	86.3	Confident	83.9	Confident	22 Å²	22	84.6 Å²	84.6	18%	0.182	41%	0.409	C	S	.	.	H	α-helix	trans	-61.2	-48	179.1	0	0	0	0	0	112	F303 Y304 T309 V310 A311 E332	F303-A307 WeakPolarHBondContact O-CB 3.19Å; F303-A307 PolarHBondContact O-N 2.91Å; Y304-A307 PolarHBondContact O-N 2.94Å; A307-T309 VanDerWaalsContact C-N 3.33Å; A307-T309 PolarHBondContact O-N 3.41Å; A307-V310 PolarHBondContact O-N 3.49Å; A307-A311 WeakPolarHBondContact O-CB 3.32Å; A307-A311 PolarHBondContact O-N 2.97Å; A307-E332 HydrophobicContact CB-CB 4.46Å
308	I	86.9	Confident	83.4	Confident	0 Å²	0	81.5 Å²	81.5	0%	0	40%	0.402	C	S	.	.	H	α-helix	trans	-63.3	-40.8	176.2	-67.9	170.2	0	0	0	110.8	M295 M300 Y304 A311 S312 I329 F330 E332 L333	M295-I308 HydrophobicContact CE-CB 4.03Å; M295-I308 HydrophobicContact CE-CD1 4.02Å; M295-I308 HydrophobicContact CE-CG2 3.6Å; M295-I308 HydrophobicContact CG-CG2 4.06Å; M295-I308 HydrophobicContact SD-CG2 3.86Å; M300-I308 HydrophobicContact CE-CD1 3.85Å; M300-I308 HydrophobicContact SD-CD1 4.15Å; Y304-I308 WeakPolarHBondContact O-CB 3.13Å; Y304-I308 WeakPolarHBondContact O-CG1 3.36Å; Y304-I308 PolarHBondContact O-N 3.39Å; I308-A311 PolarHBondContact O-N 3.33Å; I308-S312 WeakPolarHBondContact O-CB 3.36Å; I308-S312 PolarHBondContact O-N 3.35Å; I308-S312 PolarHBondContact O-OG 3.36Å; I308-I329 HydrophobicContact CB-CG2 4.35Å; I308-I329 HydrophobicContact CG2-CG2 3.67Å; I308-F330 HydrophobicContact CD1-CD1 4.33Å; I308-F330 HydrophobicContact CD1-CE1 4.47Å; I308-E332 HydrophobicContact CG1-CB 4.38Å; I308-L333 HydrophobicContact CD1-CD1 4.49Å; I308-L333 HydrophobicContact CD1-CD2 4.07Å; I308-L333 HydrophobicContact CD1-CG 4.08Å
309	T	87.3	Confident	83	Confident	35 Å²	35	80.1 Å²	80.1	22%	0.215	40%	0.4	C	S	.	.	H	α-helix	trans	-63.4	-46.8	178.9	-54.5	0	0	0	0	110.7	L292 K305 S306 A307 S312 Q313	L292-T309 HydrophobicContact CD2-CG2 3.65Å; K305-T309 VanDerWaalsContact O-CB 3.3Å; K305-T309 WeakPolarHBondContact O-CB 3.45Å; K305-T309 PolarHBondContact O-N 3.06Å; K305-T309 PolarHBondContact O-OG1 2.86Å; S306-T309 PolarHBondContact O-N 3.48Å; A307-T309 VanDerWaalsContact C-N 3.33Å; A307-T309 PolarHBondContact O-N 3.41Å; T309-S312 WeakPolarHBondContact CA-OG 3.25Å; T309-S312 PolarHBondContact O-N 3.06Å; T309-S312 PolarHBondContact O-OG 3.12Å; T309-Q313 VanDerWaalsContact O-CG 3.31Å; T309-Q313 WeakPolarHBondContact O-CG 3.33Å; T309-Q313 PolarHBondContact O-N 3.25Å
310	V	88.3	Confident	83.1	Confident	81 Å²	81	77.6 Å²	77.6	49%	0.491	38%	0.38	S	S	.	.	H	α-helix	trans	-63.8	-45.3	177.2	171.8	0	0	0	0	110.9	S306 A307 S312 Q313 Q314	S306-V310 WeakPolarHBondContact O-CB 3.19Å; S306-V310 VanDerWaalsContact O-CG2 3.29Å; S306-V310 WeakPolarHBondContact O-CG2 3.4Å; S306-V310 PolarHBondContact O-N 3.44Å; A307-V310 PolarHBondContact O-N 3.49Å; V310-S312 VanDerWaalsContact C-N 3.28Å; V310-S312 PolarHBondContact O-N 3.04Å; V310-Q313 PolarHBondContact O-N 2.68Å; V310-Q313 VanDerWaalsContact O-N 3.16Å; V310-Q314 PolarHBondContact O-N 2.87Å
311	A	86.9	Confident	83.2	Confident	9 Å²	9	75.3 Å²	75.3	7%	0.074	37%	0.368	C	S	.	.	H	α-helix	trans	-61.1	-37.1	176.1	0	0	0	0	0	112	A307 I308 Q314 F315 I329 E332	A307-A311 WeakPolarHBondContact O-CB 3.32Å; A307-A311 PolarHBondContact O-N 2.97Å; I308-A311 PolarHBondContact O-N 3.33Å; A311-Q314 PolarHBondContact O-N 3.03Å; A311-F315 VanDerWaalsContact O-CD2 3.27Å; A311-F315 WeakPolarHBondContact O-CD2 3.46Å; A311-F315 WeakPolarHBondContact O-CE2 3.05Å; A311-I329 HydrophobicContact CB-CG1 4.41Å; A311-I329 HydrophobicContact CB-CG2 4.23Å; A311-E332 HydrophobicContact CB-CG 4.21Å
312	S	86.1	Confident	83.4	Confident	0 Å²	0	71.7 Å²	71.7	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-70	-33.8	175.6	64.3	0	0	0	0	113.3	V288 L292 I308 T309 V310 Q314 F315 M321	V288-S312 VanDerWaalsContact CG1-O 3.31Å; V288-S312 WeakPolarHBondContact CG1-O 3.29Å; L292-S312 VanDerWaalsContact CD2-OG 3.23Å; L292-S312 WeakPolarHBondContact CD2-OG 3.15Å; I308-S312 WeakPolarHBondContact O-CB 3.36Å; I308-S312 PolarHBondContact O-N 3.35Å; I308-S312 PolarHBondContact O-OG 3.36Å; T309-S312 WeakPolarHBondContact CA-OG 3.25Å; T309-S312 PolarHBondContact O-N 3.06Å; T309-S312 PolarHBondContact O-OG 3.12Å; V310-S312 VanDerWaalsContact C-N 3.28Å; V310-S312 PolarHBondContact O-N 3.04Å; S312-Q314 VanDerWaalsContact C-N 3.28Å; S312-Q314 PolarHBondContact O-N 3.23Å; S312-F315 PolarHBondContact O-N 3.02Å; S312-M321 VanDerWaalsContact O-CE 3.26Å; S312-M321 WeakPolarHBondContact O-CE 3.09Å
313	Q	85.7	Confident	83.5	Confident	103 Å²	103	64.6 Å²	64.6	48%	0.481	33%	0.329	S	S	.	.	H	α-helix	trans	-68.3	-25	177.8	-75.9	171	-20.5	0	0	113.1	L292 T309 V310 F315 A316	L292-Q313 HydrophobicContact CD2-CG 4.26Å; T309-Q313 VanDerWaalsContact O-CG 3.31Å; T309-Q313 WeakPolarHBondContact O-CG 3.33Å; T309-Q313 PolarHBondContact O-N 3.25Å; V310-Q313 PolarHBondContact O-N 2.68Å; V310-Q313 VanDerWaalsContact O-N 3.16Å; Q313-F315 PolarHBondContact O-N 3.11Å; Q313-A316 WeakPolarHBondContact O-CB 3.45Å; Q313-A316 PolarHBondContact O-N 3.4Å
314	Q	84.8	Confident	83.6	Confident	146 Å²	146	66.5 Å²	66.5	68%	0.682	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-24.5	174.3	-69	178.9	-16.7	0	0	113	V310 A311 S312	V310-Q314 PolarHBondContact O-N 2.87Å; A311-Q314 PolarHBondContact O-N 3.03Å; S312-Q314 VanDerWaalsContact C-N 3.28Å; S312-Q314 PolarHBondContact O-N 3.23Å
315	F	82.7	Confident	83.8	Confident	41 Å²	41	66.8 Å²	66.8	18%	0.18	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.3	6.5	176.7	-56.9	-84.4	0	0	0	112.6	V288 A311 S312 Q313 E317 Q318 G319 M321 Q325 I329	V288-F315 HydrophobicContact CG2-CB 4.33Å; A311-F315 VanDerWaalsContact O-CD2 3.27Å; A311-F315 WeakPolarHBondContact O-CD2 3.46Å; A311-F315 WeakPolarHBondContact O-CE2 3.05Å; S312-F315 PolarHBondContact O-N 3.02Å; Q313-F315 PolarHBondContact O-N 3.11Å; F315-E317 PolarHBondContact O-N 3.39Å; F315-Q318 PolarHBondContact O-N 3.25Å; F315-Q318 VanDerWaalsContact O-N 3.12Å; F315-G319 PolarHBondContact O-N 3.34Å; F315-M321 HydrophobicContact CB-CE 3.66Å; F315-M321 HydrophobicContact CB-CG 4.11Å; F315-M321 HydrophobicContact CD2-CE 3.81Å; F315-M321 HydrophobicContact CG-CE 4.06Å; F315-M321 HydrophobicContact CG-CG 4.42Å; F315-Q325 HydrophobicContact CE1-CB 4.34Å; F315-Q325 HydrophobicContact CE1-CG 4.16Å; F315-Q325 HydrophobicContact CZ-CB 4.49Å; F315-I329 HydrophobicContact CD2-CD1 4.22Å; F315-I329 HydrophobicContact CE2-CD1 4.31Å; F315-I329 HydrophobicContact CE2-CG1 4.24Å
316	A	74.7	Confident	83.9	Confident	55 Å²	55	64.4 Å²	64.4	46%	0.455	33%	0.332	S	S	.	.	G	3₁₀ helix	trans	-62.7	-31.6	-179	0	0	0	0	0	112.4	Q313 Q318 G319	Q313-A316 WeakPolarHBondContact O-CB 3.45Å; Q313-A316 PolarHBondContact O-N 3.4Å; A316-Q318 VanDerWaalsContact C-N 3.28Å; A316-Q318 PolarHBondContact O-N 3.45Å; A316-G319 PolarHBondContact O-N 3.04Å
317	E	73.4	Confident	83.9	Confident	198 Å²	198	65.3 Å²	65.3	93%	0.925	33%	0.326	S	S	*	.	G	3₁₀ helix	trans	-65.5	-30	176	-63.9	-173.1	172.6	0	0	112.9	F315	F315-E317 PolarHBondContact O-N 3.39Å
318	Q	76.5	Confident	83.9	Confident	124 Å²	124	71.1 Å²	71.1	58%	0.579	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-84.1	-17	178	-67.4	173.5	-4.2	0	0	112.2	F315 A316 Y320	F315-Q318 PolarHBondContact O-N 3.25Å; F315-Q318 VanDerWaalsContact O-N 3.12Å; A316-Q318 VanDerWaalsContact C-N 3.28Å; A316-Q318 PolarHBondContact O-N 3.45Å; Q318-Y320 PolarHBondContact O-N 2.95Å
319	G	79.6	Confident	84	Confident	27 Å²	27	71.3 Å²	71.3	28%	0.278	35%	0.349	S	S	.	.	S	Bend	trans	68.9	-25	179.4	0	0	0	0	0	115.4	R287 V288 F315 A316	R287-G319 WeakPolarHBondContact CA-O 3.34Å; V288-G319 PolarHBondContact N-O 2.87Å; V288-G319 VanDerWaalsContact N-O 3.12Å; F315-G319 PolarHBondContact O-N 3.34Å; A316-G319 PolarHBondContact O-N 3.04Å
320	Y	82.9	Confident	84	Confident	100 Å²	100	71.1 Å²	71.1	39%	0.392	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	151.1	-177.9	-62.3	-89.3	0	0	0	111.7	L285 V286 R287 Q318	L285-Y320 HydrophobicContact CB-CD1 4.14Å; V286-Y320 CarbonylContact O-C 3.5Å; V286-Y320 WeakPolarHBondContact O-CA 3.41Å; R287-Y320 HydrophobicContact CG-CD1 3.8Å; R287-Y320 HydrophobicContact CG-CE1 3.36Å; R287-Y320 PolarHBondContact NE-OH 3.42Å; Q318-Y320 PolarHBondContact O-N 2.95Å
321	M	84.8	Confident	83.7	Confident	0 Å²	0	69.6 Å²	69.6	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	132.4	175.3	-71	169.7	179.5	0	0	110.8	V286 V288 V291 S312 F315 I329	V286-M321 PolarHBondContact N-O 2.88Å; V286-M321 PolarHBondContact O-N 2.67Å; V288-M321 HydrophobicContact CB-CE 4.32Å; V288-M321 HydrophobicContact CG1-CE 3.91Å; V288-M321 HydrophobicContact CG2-CE 3.72Å; V288-M321 HydrophobicContact CG2-CG 4.01Å; V288-M321 HydrophobicContact CG2-SD 4.3Å; V291-M321 HydrophobicContact CG2-SD 4.45Å; S312-M321 VanDerWaalsContact O-CE 3.26Å; S312-M321 WeakPolarHBondContact O-CE 3.09Å; F315-M321 HydrophobicContact CB-CE 3.66Å; F315-M321 HydrophobicContact CB-CG 4.11Å; F315-M321 HydrophobicContact CD2-CE 3.81Å; F315-M321 HydrophobicContact CG-CE 4.06Å; F315-M321 HydrophobicContact CG-CG 4.42Å; M321-I329 HydrophobicContact CE-CD1 3.34Å; M321-I329 HydrophobicContact SD-CD1 3.4Å; M321-I329 WeakPolarHBondContact SD-CD1 3.46Å
322	D	85.7	Confident	83.4	Confident	70 Å²	70	71.3 Å²	71.3	37%	0.374	34%	0.34	S	S	.	.			trans	-77.2	164.2	166.7	177.3	42.7	0	0	0	111.2	Q324 Q325 F326	D322-Q324 VanDerWaalsContact C-N 3.34Å; D322-Q324 PolarHBondContact O-N 2.79Å; D322-Q325 WeakPolarHBondContact O-CB 3.43Å; D322-Q325 PolarHBondContact O-N 2.8Å; D322-Q325 VanDerWaalsContact O-N 3.16Å; D322-F326 WeakPolarHBondContact O-CB 2.96Å; D322-F326 PolarHBondContact O-N 2.97Å
323	R	83.5	Confident	83.1	Confident	77 Å²	77	73.7 Å²	73.7	29%	0.291	35%	0.353	S	S	.	.	H	α-helix	trans	-52.1	-45.7	-179.6	-177.3	-179.7	65.7	-148.1	6.8	113.6	F270 F326 R327 E667	F270-R323 HydrophobicContact CE1-CB 3.93Å; F270-R323 HydrophobicContact CE1-CG 4.29Å; F270-R323 HydrophobicContact CE2-CB 4.24Å; F270-R323 VanDerWaalsContact CZ-CA 3.47Å; F270-R323 HydrophobicContact CZ-CB 3.68Å; F270-R323 HydrophobicContact CZ-CG 4.44Å; R323-F326 PolarHBondContact O-N 3.29Å; R323-R327 PolarHBondContact O-N 3.16Å; R323-E667 IonicContact CZ-OE1 3.2Å; R323-E667 IonicContact CZ-OE2 2.91Å; R323-E667 IonicContact NE-OE1 2.59Å; R323-E667 IonicContact NE-OE2 3.6Å; R323-E667 IonicContact NH1-OE1 2.85Å; R323-E667 PolarHBondContact NH1-OE1 2.91Å; R323-E667 IonicContact NH1-OE2 3.26Å; R323-E667 VanDerWaalsContact NH2-CD 3.25Å; R323-E667 IonicContact NH2-OE1 2.79Å; R323-E667 PolarHBondContact NH2-OE1 3.49Å; R323-E667 VanDerWaalsContact NH2-OE1 3.17Å; R323-E667 IonicContact NH2-OE2 3.85Å; R323-E667 PolarHBondContact NH2-OE2 3.44Å
324	Q	84.9	Confident	82.4	Confident	141 Å²	141	70.1 Å²	70.1	66%	0.659	34%	0.337	S	S	*	.	H	α-helix	trans	-68.1	-40.2	-179	-67.6	-171.7	-0.7	0	0	111.3	D322 R327 K328	D322-Q324 VanDerWaalsContact C-N 3.34Å; D322-Q324 PolarHBondContact O-N 2.79Å; Q324-R327 PolarHBondContact O-N 2.7Å; Q324-K328 WeakPolarHBondContact O-CB 3.42Å; Q324-K328 PolarHBondContact O-N 2.82Å
325	Q	86.8	Confident	81.8	Confident	58 Å²	58	68.4 Å²	68.4	27%	0.271	33%	0.327	S	S	.	.	H	α-helix	trans	-64	-44.6	176.7	-62.4	172.8	-27.7	0	0	110.7	F315 D322 R327 K328 I329	F315-Q325 HydrophobicContact CE1-CB 4.34Å; F315-Q325 HydrophobicContact CE1-CG 4.16Å; F315-Q325 HydrophobicContact CZ-CB 4.49Å; D322-Q325 WeakPolarHBondContact O-CB 3.43Å; D322-Q325 PolarHBondContact O-N 2.8Å; D322-Q325 VanDerWaalsContact O-N 3.16Å; Q325-R327 PolarHBondContact O-N 3.08Å; Q325-K328 WeakPolarHBondContact O-CB 3.48Å; Q325-K328 PolarHBondContact O-N 3.41Å; Q325-I329 WeakPolarHBondContact O-CG1 3.47Å; Q325-I329 PolarHBondContact O-N 3.03Å
326	F	88	Confident	80.8	Confident	5 Å²	5	70.6 Å²	70.6	2%	0.022	34%	0.341	C	S	.	.	H	α-helix	trans	-60.5	-44.2	175.8	-173.3	-98.4	0	0	0	112.1	I266 F270 L273 V291 D322 R323 K328 I329 F330	I266-F326 HydrophobicContact CG2-CD1 3.93Å; I266-F326 HydrophobicContact CG2-CE1 3.77Å; F270-F326 HydrophobicContact CB-CD1 3.77Å; F270-F326 HydrophobicContact CB-CE1 3.71Å; F270-F326 HydrophobicContact CB-CZ 4.42Å; F270-F326 HydrophobicContact CD2-CB 3.67Å; F270-F326 AromaticContact CD2-CD1 3.65Å; F270-F326 HydrophobicContact CD2-CD1 3.65Å; F270-F326 HydrophobicContact CD2-CD2 4.14Å; F270-F326 HydrophobicContact CD2-CE1 4.26Å; F270-F326 AromaticContact CD2-CG 3.56Å; F270-F326 HydrophobicContact CD2-CG 3.56Å; F270-F326 HydrophobicContact CE2-CB 3.94Å; F270-F326 HydrophobicContact CE2-CG 4.29Å; F270-F326 HydrophobicContact CG-CD1 4.14Å; F270-F326 HydrophobicContact CG-CE1 4.5Å; F270-F326 HydrophobicContact CG-CG 4.48Å; L273-F326 HydrophobicContact CD1-CE2 4.27Å; L273-F326 HydrophobicContact CD1-CZ 4.2Å; V291-F326 HydrophobicContact CG1-CE2 4.48Å; V291-F326 HydrophobicContact CG2-CD2 4.3Å; V291-F326 HydrophobicContact CG2-CE2 3.88Å; D322-F326 WeakPolarHBondContact O-CB 2.96Å; D322-F326 PolarHBondContact O-N 2.97Å; R323-F326 PolarHBondContact O-N 3.29Å; F326-K328 VanDerWaalsContact C-N 3.33Å; F326-K328 PolarHBondContact O-N 3.05Å; F326-I329 PolarHBondContact O-N 3.2Å; F326-F330 HydrophobicContact CD1-CD2 4.37Å; F326-F330 HydrophobicContact CD1-CE2 4.06Å; F326-F330 HydrophobicContact CD2-CE2 4.44Å; F326-F330 HydrophobicContact CE1-CD2 4.19Å; F326-F330 AromaticContact CE1-CE2 3.56Å; F326-F330 HydrophobicContact CE1-CE2 3.56Å; F326-F330 HydrophobicContact CE1-CZ 4.5Å; F326-F330 AromaticContact CE2-CE2 3.98Å; F326-F330 HydrophobicContact CE2-CE2 3.98Å; F326-F330 HydrophobicContact CG-CE2 4.49Å; F326-F330 AromaticContact CZ-CE2 3.53Å; F326-F330 HydrophobicContact CZ-CE2 3.53Å; F326-F330 HydrophobicContact CZ-CZ 4.16Å; F326-F330 VanDerWaalsContact O-CD2 3.28Å; F326-F330 WeakPolarHBondContact O-CD2 3.36Å
327	R	86	Confident	80.1	Confident	79 Å²	79	69.6 Å²	69.6	30%	0.298	33%	0.33	S	S	.	.	H	α-helix	trans	-59.6	-43.6	175.1	177.9	-179	166.7	-179.2	-4.4	111.7	R323 Q324 Q325 I329 F330 D331 E664	R323-R327 PolarHBondContact O-N 3.16Å; Q324-R327 PolarHBondContact O-N 2.7Å; Q325-R327 PolarHBondContact O-N 3.08Å; R327-I329 VanDerWaalsContact C-N 3.3Å; R327-I329 PolarHBondContact O-N 3.36Å; R327-F330 PolarHBondContact O-N 3.28Å; R327-F330 VanDerWaalsContact O-N 3.09Å; R327-D331 PolarHBondContact O-N 3.49Å; R327-E664 IonicContact CZ-OE2 3.19Å; R327-E664 IonicContact NH1-OE2 2.98Å; R327-E664 IonicContact NH2-OE1 3.67Å; R327-E664 PolarHBondContact NH2-OE1 3.39Å; R327-E664 IonicContact NH2-OE2 2.78Å; R327-E664 PolarHBondContact NH2-OE2 3.42Å
328	K	85.7	Confident	79.4	Confident	145 Å²	145	65 Å²	65	63%	0.63	31%	0.311	S	S	*	.	H	α-helix	trans	-62.8	-35.2	-174.8	-157.1	174.4	-172	176.8	0	112.7	Q324 Q325 F326 F330 D331	Q324-K328 WeakPolarHBondContact O-CB 3.42Å; Q324-K328 PolarHBondContact O-N 2.82Å; Q325-K328 WeakPolarHBondContact O-CB 3.48Å; Q325-K328 PolarHBondContact O-N 3.41Å; F326-K328 VanDerWaalsContact C-N 3.33Å; F326-K328 PolarHBondContact O-N 3.05Å; K328-F330 VanDerWaalsContact C-N 3.25Å; K328-F330 PolarHBondContact O-N 2.76Å; K328-D331 WeakPolarHBondContact O-CB 3.28Å; K328-D331 PolarHBondContact O-N 2.99Å
329	I	89.1	Confident	78.8	Confident	4 Å²	4	65.3 Å²	65.3	2%	0.021	31%	0.31	C	S	.	.	H	α-helix	trans	-61.3	-36.1	175.8	-66.3	164.2	0	0	0	111.3	I308 A311 F315 M321 Q325 F326 R327 D331 E332	I308-I329 HydrophobicContact CB-CG2 4.35Å; I308-I329 HydrophobicContact CG2-CG2 3.67Å; A311-I329 HydrophobicContact CB-CG1 4.41Å; A311-I329 HydrophobicContact CB-CG2 4.23Å; F315-I329 HydrophobicContact CD2-CD1 4.22Å; F315-I329 HydrophobicContact CE2-CD1 4.31Å; F315-I329 HydrophobicContact CE2-CG1 4.24Å; M321-I329 HydrophobicContact CE-CD1 3.34Å; M321-I329 HydrophobicContact SD-CD1 3.4Å; M321-I329 WeakPolarHBondContact SD-CD1 3.46Å; Q325-I329 WeakPolarHBondContact O-CG1 3.47Å; Q325-I329 PolarHBondContact O-N 3.03Å; F326-I329 PolarHBondContact O-N 3.2Å; R327-I329 VanDerWaalsContact C-N 3.3Å; R327-I329 PolarHBondContact O-N 3.36Å; I329-D331 VanDerWaalsContact C-N 3.29Å; I329-D331 PolarHBondContact O-N 3.09Å; I329-E332 WeakPolarHBondContact O-CB 3.49Å; I329-E332 WeakPolarHBondContact O-CG 3.26Å; I329-E332 PolarHBondContact O-N 3.36Å
330	F	87.1	Confident	78.2	Confident	30 Å²	30	72.5 Å²	72.5	13%	0.132	34%	0.337	C	S	.	.	H	α-helix	trans	-79.8	-8.8	177.4	-70.2	-76.1	0	0	0	113.7	I266 I308 F326 R327 K328 E332 L333	I266-F330 HydrophobicContact CD1-CB 3.64Å; I266-F330 HydrophobicContact CD1-CD2 4.42Å; I266-F330 HydrophobicContact CD1-CG 3.98Å; I266-F330 HydrophobicContact CG1-CB 4.32Å; I266-F330 HydrophobicContact CG1-CD2 4.25Å; I266-F330 HydrophobicContact CG1-CG 4.11Å; I266-F330 HydrophobicContact CG2-CD2 3.75Å; I266-F330 HydrophobicContact CG2-CE2 4.24Å; I266-F330 HydrophobicContact CG2-CG 4.38Å; I308-F330 HydrophobicContact CD1-CD1 4.33Å; I308-F330 HydrophobicContact CD1-CE1 4.47Å; F326-F330 HydrophobicContact CD1-CD2 4.37Å; F326-F330 HydrophobicContact CD1-CE2 4.06Å; F326-F330 HydrophobicContact CD2-CE2 4.44Å; F326-F330 HydrophobicContact CE1-CD2 4.19Å; F326-F330 AromaticContact CE1-CE2 3.56Å; F326-F330 HydrophobicContact CE1-CE2 3.56Å; F326-F330 HydrophobicContact CE1-CZ 4.5Å; F326-F330 AromaticContact CE2-CE2 3.98Å; F326-F330 HydrophobicContact CE2-CE2 3.98Å; F326-F330 HydrophobicContact CG-CE2 4.49Å; F326-F330 AromaticContact CZ-CE2 3.53Å; F326-F330 HydrophobicContact CZ-CE2 3.53Å; F326-F330 HydrophobicContact CZ-CZ 4.16Å; F326-F330 VanDerWaalsContact O-CD2 3.28Å; F326-F330 WeakPolarHBondContact O-CD2 3.36Å; R327-F330 PolarHBondContact O-N 3.28Å; R327-F330 VanDerWaalsContact O-N 3.09Å; K328-F330 VanDerWaalsContact C-N 3.25Å; K328-F330 PolarHBondContact O-N 2.76Å; F330-E332 PolarHBondContact O-N 3.48Å; F330-L333 HydrophobicContact CB-CD1 4.31Å; F330-L333 HydrophobicContact CD1-CD1 3.91Å; F330-L333 VanDerWaalsContact O-CB 3.31Å; F330-L333 WeakPolarHBondContact O-CB 3.44Å; F330-L333 PolarHBondContact O-N 3.37Å
331	D	82.5	Confident	77.8	Confident	49 Å²	49	71.3 Å²	71.3	26%	0.262	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-72.1	-14.1	169.8	-61.8	-32	0	0	0	111.4	R263 R327 K328 I329 L333 D334	R263-D331 IonicContact CZ-OD1 2.68Å; R263-D331 VanDerWaalsContact CZ-OD1 3.28Å; R263-D331 IonicContact NH1-OD1 3.74Å; R263-D331 PolarHBondContact NH1-OD1 2.96Å; R263-D331 IonicContact NH2-OD1 2.78Å; R263-D331 PolarHBondContact NH2-OD1 2.92Å; R327-D331 PolarHBondContact O-N 3.49Å; K328-D331 WeakPolarHBondContact O-CB 3.28Å; K328-D331 PolarHBondContact O-N 2.99Å; I329-D331 VanDerWaalsContact C-N 3.29Å; I329-D331 PolarHBondContact O-N 3.09Å; D331-L333 PolarHBondContact O-N 2.8Å; D331-D334 WeakPolarHBondContact O-CA 3.46Å; D331-D334 WeakPolarHBondContact O-CB 3.43Å; D331-D334 PolarHBondContact O-N 3.06Å
332	E	81.6	Confident	77.6	Confident	46 Å²	46	73.8 Å²	73.8	22%	0.215	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	-61.1	-23.3	168.1	-64.7	-59.6	148.9	0	0	112.8	A307 I308 A311 I329 F330 D334 K335	A307-E332 HydrophobicContact CB-CB 4.46Å; I308-E332 HydrophobicContact CG1-CB 4.38Å; A311-E332 HydrophobicContact CB-CG 4.21Å; I329-E332 WeakPolarHBondContact O-CB 3.49Å; I329-E332 WeakPolarHBondContact O-CG 3.26Å; I329-E332 PolarHBondContact O-N 3.36Å; F330-E332 PolarHBondContact O-N 3.48Å; E332-D334 PolarHBondContact O-N 3.37Å; E332-K335 PolarHBondContact O-N 3.02Å; E332-K335 WeakPolarHBondContact OE1-CE 3.32Å; E332-K335 IonicContact OE1-NZ 3.52Å; E332-K335 PolarHBondContact OE1-NZ 3.43Å; E332-K335 WeakPolarHBondContact OE2-CD 3.46Å; E332-K335 VanDerWaalsContact OE2-CE 3.22Å; E332-K335 WeakPolarHBondContact OE2-CE 3.39Å; E332-K335 IonicContact OE2-NZ 3.71Å; E332-K335 PolarHBondContact OE2-NZ 3.41Å
333	L	79.5	Confident	77.3	Confident	50 Å²	50	76.3 Å²	76.3	26%	0.262	37%	0.371	S	S	.	.	G	3₁₀ helix	trans	-66.2	-20.4	172	-68.7	163.6	0	0	0	112.3	M300 Y304 I308 F330 D331	M300-L333 HydrophobicContact CE-CD2 4.21Å; Y304-L333 HydrophobicContact CD1-CD2 4.27Å; Y304-L333 HydrophobicContact CG-CD2 4.1Å; I308-L333 HydrophobicContact CD1-CD1 4.49Å; I308-L333 HydrophobicContact CD1-CD2 4.07Å; I308-L333 HydrophobicContact CD1-CG 4.08Å; F330-L333 HydrophobicContact CB-CD1 4.31Å; F330-L333 HydrophobicContact CD1-CD1 3.91Å; F330-L333 VanDerWaalsContact O-CB 3.31Å; F330-L333 WeakPolarHBondContact O-CB 3.44Å; F330-L333 PolarHBondContact O-N 3.37Å; D331-L333 PolarHBondContact O-N 2.8Å
334	D	71.1	Confident	77.1	Confident	27 Å²	27	77.1 Å²	77.1	14%	0.144	38%	0.38	C	S	.	.	G	3₁₀ helix	trans	-92.9	-0.3	178.9	-65.3	-27.4	0	0	0	113.2	R262 D331 E332 F656	R262-D334 IonicContact CZ-OD1 3.05Å; R262-D334 VanDerWaalsContact CZ-OD1 3.23Å; R262-D334 IonicContact CZ-OD2 2.71Å; R262-D334 IonicContact NH1-OD1 2.79Å; R262-D334 PolarHBondContact NH1-OD1 2.93Å; R262-D334 IonicContact NH1-OD2 3.17Å; R262-D334 VanDerWaalsContact NH2-CG 3.26Å; R262-D334 IonicContact NH2-OD1 2.92Å; R262-D334 PolarHBondContact NH2-OD1 3.47Å; R262-D334 IonicContact NH2-OD2 2.65Å; R262-D334 PolarHBondContact NH2-OD2 3.39Å; D331-D334 WeakPolarHBondContact O-CA 3.46Å; D331-D334 WeakPolarHBondContact O-CB 3.43Å; D331-D334 PolarHBondContact O-N 3.06Å; E332-D334 PolarHBondContact O-N 3.37Å; D334-F656 HydrophobicContact CB-CE1 4.09Å; D334-F656 HydrophobicContact CB-CZ 3.94Å; D334-F656 WeakPolarHBondContact O-CE1 3.4Å; D334-F656 WeakPolarHBondContact O-CZ 3.35Å
335	K	71.3	Confident	76.9	Confident	111 Å²	111	72.3 Å²	72.3	48%	0.483	36%	0.361	S	S	.	.	S	Bend	trans	-89.1	139.1	177.8	-64.5	-167.1	-165.4	159	0	111.8	E332	E332-K335 PolarHBondContact O-N 3.02Å; E332-K335 WeakPolarHBondContact OE1-CE 3.32Å; E332-K335 IonicContact OE1-NZ 3.52Å; E332-K335 PolarHBondContact OE1-NZ 3.43Å; E332-K335 WeakPolarHBondContact OE2-CD 3.46Å; E332-K335 VanDerWaalsContact OE2-CE 3.22Å; E332-K335 WeakPolarHBondContact OE2-CE 3.39Å; E332-K335 IonicContact OE2-NZ 3.71Å; E332-K335 PolarHBondContact OE2-NZ 3.41Å
336	D	61.3	Low	76.6	Confident	86 Å²	86	78.6 Å²	78.6	46%	0.46	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-72.1	135.5	179.1	-64.9	-31.2	0	0	0	110.7
337	C	60.1	Low	76.4	Confident	35 Å²	35	80.9 Å²	80.9	24%	0.236	40%	0.4	C	S	.	.	P	Polyproline II helix	trans	-86.7	121.6	-179.3	-52.7	0	0	0	0	110.2	F303	F303-C337 HydrophobicContact CD1-CB 4.26Å; F303-C337 WeakPolarHBondContact CD1-SG 3.33Å; F303-C337 HydrophobicContact CE1-CB 4Å; F303-C337 WeakPolarHBondContact CE1-SG 3.39Å; F303-C337 HydrophobicContact CZ-CB 4.23Å
338	I	60.4	Low	76.2	Confident	102 Å²	102	84.3 Å²	84.3	52%	0.523	43%	0.43	S	S	.	.	P	Polyproline II helix	trans	-91.4	118.7	169	-57.7	172.2	0	0	0	107.8	E340 K647	I338-E340 PolarHBondContact O-N 3.05Å; I338-K647 HydrophobicContact CD1-CD 4.26Å; I338-K647 HydrophobicContact CD1-CG 4.27Å
339	K	62.1	Low	76.3	Confident	130 Å²	130	79.2 Å²	79.2	57%	0.565	41%	0.412	S	S	*	.			trans	-78.2	114.2	170.1	-75.9	-172.5	-179.8	-177.3	0	108.8	Y650	K339-Y650 HydrophobicContact CB-CE1 4.26Å; K339-Y650 HydrophobicContact CD-CE1 4.08Å; K339-Y650 HydrophobicContact CG-CE1 4.26Å
340	E	68.3	Low	76.1	Confident	178 Å²	178	82.3 Å²	82.3	83%	0.832	44%	0.438	S	S	*	.	P	Polyproline II helix	trans	-75.7	136.6	170	-69.1	178.3	179.1	0	0	110.4	I338	I338-E340 PolarHBondContact O-N 3.05Å
341	H	75.1	Confident	76	Confident	74 Å²	74	85.9 Å²	85.9	34%	0.343	46%	0.463	S	S	.	.	P	Polyproline II helix	trans	-77.8	143.8	175.5	-66.6	-62.4	0	0	0	109.9	S428 Y429	H341-S428 WeakPolarHBondContact ND1-CB 3.37Å; H341-S428 PolarHBondContact ND1-OG 3.43Å; H341-Y429 AromaticContact CD2-CE1 3.87Å; H341-Y429 AromaticContact CD2-CZ 3.88Å; H341-Y429 AromaticContact CE1-CD1 3.88Å; H341-Y429 AromaticContact CE1-CE1 3.74Å; H341-Y429 AromaticContact CG-CZ 3.91Å; H341-Y429 AromaticContact NE2-CE1 3.54Å
342	P	79.8	Confident	76	Confident	52 Å²	52	86.5 Å²	86.5	34%	0.338	47%	0.466	S	S	.	.	P	Polyproline II helix	trans	-63.3	148.7	177.7	28.6	-34.8	0	0	0	110.5	R424	P342-R424 HydrophobicContact CG-CB 4.34Å
343	P	78.7	Confident	76.2	Confident	123 Å²	123	88.8 Å²	88.8	80%	0.799	48%	0.476	S	S	*	.	P	Polyproline II helix	trans	-63.7	152.8	178	27.5	-34.6	0	0	0	111.4
344	L	80.1	Confident	76.4	Confident	94 Å²	94	94.1 Å²	94.1	49%	0.492	50%	0.497	S	S	.	.	P	Polyproline II helix	trans	-59.5	142.5	177.4	-70.7	160.7	0	0	0	111.1	A420 F421	L344-A420 WeakPolarHBondContact CD2-O 3.4Å; L344-F421 HydrophobicContact CD2-CD1 3.76Å; L344-F421 HydrophobicContact CD2-CE1 4.32Å
345	P	80.8	Confident	77	Confident	40 Å²	40	96.4 Å²	96.4	26%	0.26	51%	0.509	S	S	.	.	P	Polyproline II helix	trans	-64.4	139.3	175.4	27.1	-33.5	0	0	0	110.7	Y347 Q356	P345-Y347 HydrophobicContact CG-CE2 4.19Å; P345-Q356 PolarHBondContact O-NE2 3.43Å; P345-Q356 PolarHBondContact O-OE1 2.85Å
346	Q	80.9	Confident	77.7	Confident	191 Å²	191	92.1 Å²	92.1	89%	0.893	49%	0.491	S	S	*	.	P	Polyproline II helix	trans	-94	119.2	175.3	-69.5	-179.3	-4.7	0	0	110
347	Y	83.1	Confident	78.8	Confident	53 Å²	53	92.7 Å²	92.7	21%	0.208	50%	0.497	C	S	.	.	P	Polyproline II helix	trans	-91	144.4	174.6	-65.4	-72.8	0	0	0	111.1	P345 L352 Q353 Q356 F419	P345-Y347 HydrophobicContact CG-CE2 4.19Å; Y347-L352 HydrophobicContact CD1-CB 4.42Å; Y347-L352 HydrophobicContact CD1-CD1 4.16Å; Y347-L352 HydrophobicContact CD2-CB 4.32Å; Y347-L352 HydrophobicContact CG-CB 3.91Å; Y347-L352 HydrophobicContact CG-CD1 4.41Å; Y347-Q353 PolarHBondContact O-NE2 2.92Å; Y347-Q356 HydrophobicContact CD2-CB 4.43Å; Y347-Q356 HydrophobicContact CE2-CB 4.44Å; Y347-Q356 HydrophobicContact CE2-CG 4.43Å; Y347-F419 HydrophobicContact CD2-CZ 4.48Å; Y347-F419 HydrophobicContact CE1-CE2 4.02Å; Y347-F419 HydrophobicContact CE1-CZ 4.36Å; Y347-F419 HydrophobicContact CE2-CE1 4.27Å; Y347-F419 HydrophobicContact CE2-CE2 4.31Å; Y347-F419 AromaticContact CE2-CZ 3.98Å; Y347-F419 HydrophobicContact CE2-CZ 3.98Å; Y347-F419 AromaticContact CZ-CE2 3.76Å; Y347-F419 AromaticContact CZ-CZ 3.91Å; Y347-F419 PolarHBondContact OH-O 3.36Å
348	T	80.7	Confident	80.1	Confident	151 Å²	151	95.5 Å²	95.5	93%	0.926	51%	0.513	S	S	*	.	S	Bend	trans	-75.9	-24.1	-177.9	49.8	0	0	0	0	113.6
349	S	89.3	Confident	81.2	Confident	38 Å²	38	93.5 Å²	93.5	27%	0.266	50%	0.501	S	S	.	.	S	Bend	trans	-98.1	140.6	-179.1	73.3	0	0	0	0	112.9	T351 L352 Q353	S349-T351 PolarHBondContact O-N 3.47Å; S349-T351 PolarHBondContact OG-OG1 3.36Å; S349-L352 PolarHBondContact O-N 3.23Å; S349-L352 WeakPolarHBondContact OG-CB 3.44Å; S349-L352 WeakPolarHBondContact OG-CD1 3.47Å; S349-L352 WeakPolarHBondContact OG-CG 3.16Å; S349-L352 PolarHBondContact OG-N 2.86Å; S349-Q353 WeakPolarHBondContact O-CG 3.39Å; S349-Q353 PolarHBondContact O-N 3.36Å; S349-Q353 VanDerWaalsContact O-N 3.17Å
350	A	84.8	Confident	82.2	Confident	69 Å²	69	89.4 Å²	89.4	57%	0.57	49%	0.489	S	S	*	.	H	α-helix	trans	-64.3	-27.2	180	0	0	0	0	0	113.2	K354	A350-K354 WeakPolarHBondContact O-CG 3.39Å; A350-K354 PolarHBondContact O-N 3.2Å
351	T	85.3	Confident	83	Confident	104 Å²	104	85.4 Å²	85.4	64%	0.638	47%	0.47	S	S	*	.	H	α-helix	trans	-70.9	-44.3	176.3	49.4	0	0	0	0	111.6	S349 Q353 K354 L355	S349-T351 PolarHBondContact O-N 3.47Å; S349-T351 PolarHBondContact OG-OG1 3.36Å; T351-Q353 VanDerWaalsContact C-N 3.31Å; T351-Q353 PolarHBondContact O-N 2.84Å; T351-K354 PolarHBondContact O-N 3.49Å; T351-L355 WeakPolarHBondContact O-CB 3.26Å; T351-L355 PolarHBondContact O-N 3.42Å
352	L	82.8	Confident	83.4	Confident	62 Å²	62	89.4 Å²	89.4	33%	0.325	48%	0.483	S	S	.	.	H	α-helix	trans	-66.9	-34.1	177.6	-66.4	172.2	0	0	0	111.6	Y347 S349 L355 Q356 F419	Y347-L352 HydrophobicContact CD1-CB 4.42Å; Y347-L352 HydrophobicContact CD1-CD1 4.16Å; Y347-L352 HydrophobicContact CD2-CB 4.32Å; Y347-L352 HydrophobicContact CG-CB 3.91Å; Y347-L352 HydrophobicContact CG-CD1 4.41Å; S349-L352 PolarHBondContact O-N 3.23Å; S349-L352 WeakPolarHBondContact OG-CB 3.44Å; S349-L352 WeakPolarHBondContact OG-CD1 3.47Å; S349-L352 WeakPolarHBondContact OG-CG 3.16Å; S349-L352 PolarHBondContact OG-N 2.86Å; L352-L355 PolarHBondContact O-N 2.78Å; L352-Q356 VanDerWaalsContact O-CB 3.32Å; L352-Q356 WeakPolarHBondContact O-CB 3.32Å; L352-Q356 PolarHBondContact O-N 3.11Å; L352-F419 HydrophobicContact CB-CZ 4.3Å; L352-F419 HydrophobicContact CD2-CE2 4.01Å; L352-F419 HydrophobicContact CD2-CZ 3.59Å; L352-F419 HydrophobicContact CG-CZ 4.46Å
353	Q	84.5	Confident	83.6	Confident	95 Å²	95	94.9 Å²	94.9	44%	0.444	50%	0.498	S	S	.	.	H	α-helix	trans	-65.1	-45.2	173.8	-70	177.6	0.6	0	0	112.4	Y347 S349 T351 L355 Q356 V357	Y347-Q353 PolarHBondContact O-NE2 2.92Å; S349-Q353 WeakPolarHBondContact O-CG 3.39Å; S349-Q353 PolarHBondContact O-N 3.36Å; S349-Q353 VanDerWaalsContact O-N 3.17Å; T351-Q353 VanDerWaalsContact C-N 3.31Å; T351-Q353 PolarHBondContact O-N 2.84Å; Q353-L355 VanDerWaalsContact C-N 3.29Å; Q353-L355 PolarHBondContact O-N 3.06Å; Q353-Q356 WeakPolarHBondContact O-CB 3.02Å; Q353-Q356 PolarHBondContact O-N 3.43Å; Q353-V357 WeakPolarHBondContact O-CG2 3.49Å; Q353-V357 PolarHBondContact O-N 2.91Å; Q353-V357 VanDerWaalsContact O-N 3.11Å
354	K	84.4	Confident	84	Confident	161 Å²	161	90.7 Å²	90.7	70%	0.7	47%	0.469	S	S	*	.	H	α-helix	trans	-60.3	-42.3	174.3	-74.8	-178.7	-179	-178.2	0	111.6	A350 T351 V357 V358	A350-K354 WeakPolarHBondContact O-CG 3.39Å; A350-K354 PolarHBondContact O-N 3.2Å; T351-K354 PolarHBondContact O-N 3.49Å; K354-V357 PolarHBondContact O-N 2.95Å; K354-V358 WeakPolarHBondContact O-CG2 3.35Å; K354-V358 PolarHBondContact O-N 3.36Å; K354-V358 VanDerWaalsContact O-N 3.16Å
355	L	84	Confident	84.1	Confident	76 Å²	76	88.1 Å²	88.1	40%	0.398	46%	0.457	S	S	.	.	H	α-helix	trans	-67	-37.5	-179.7	-154.8	126.5	0	0	0	111.7	T351 L352 Q353 V358 F359 F419	T351-L355 WeakPolarHBondContact O-CB 3.26Å; T351-L355 PolarHBondContact O-N 3.42Å; L352-L355 PolarHBondContact O-N 2.78Å; Q353-L355 VanDerWaalsContact C-N 3.29Å; Q353-L355 PolarHBondContact O-N 3.06Å; L355-V358 PolarHBondContact O-N 3.48Å; L355-F359 HydrophobicContact CD2-CD2 3.53Å; L355-F359 HydrophobicContact CD2-CE2 3.08Å; L355-F359 HydrophobicContact CD2-CZ 3.76Å; L355-F359 HydrophobicContact CG-CD2 4.22Å; L355-F359 HydrophobicContact CG-CE2 3.85Å; L355-F359 HydrophobicContact CG-CZ 4.11Å; L355-F359 WeakPolarHBondContact O-CB 3.39Å; L355-F359 VanDerWaalsContact O-CG 3.31Å; L355-F359 WeakPolarHBondContact O-CG 3.36Å; L355-F359 PolarHBondContact O-N 3.11Å; L355-F419 HydrophobicContact CD2-CD1 4.17Å; L355-F419 HydrophobicContact CD2-CE1 3.56Å; L355-F419 HydrophobicContact CD2-CZ 4.14Å
356	Q	86.4	Confident	84.4	Confident	20 Å²	20	89 Å²	89	9%	0.093	46%	0.462	C	S	.	.	H	α-helix	trans	-61.7	-43.8	172.9	-177.9	179.6	22	0	0	112.2	P345 Y347 L352 Q353 V358 F359 S360 A420	P345-Q356 PolarHBondContact O-NE2 3.43Å; P345-Q356 PolarHBondContact O-OE1 2.85Å; Y347-Q356 HydrophobicContact CD2-CB 4.43Å; Y347-Q356 HydrophobicContact CE2-CB 4.44Å; Y347-Q356 HydrophobicContact CE2-CG 4.43Å; L352-Q356 VanDerWaalsContact O-CB 3.32Å; L352-Q356 WeakPolarHBondContact O-CB 3.32Å; L352-Q356 PolarHBondContact O-N 3.11Å; Q353-Q356 WeakPolarHBondContact O-CB 3.02Å; Q353-Q356 PolarHBondContact O-N 3.43Å; Q356-V358 PolarHBondContact O-N 3.2Å; Q356-F359 PolarHBondContact O-N 3.27Å; Q356-S360 VanDerWaalsContact O-CB 3.25Å; Q356-S360 WeakPolarHBondContact O-CB 3.29Å; Q356-S360 PolarHBondContact O-N 3.3Å; Q356-S360 PolarHBondContact O-OG 2.98Å; Q356-A420 PolarHBondContact NE2-O 3.33Å; Q356-A420 VanDerWaalsContact NE2-O 3.15Å
357	V	84.2	Confident	84.8	Confident	98 Å²	98	84.2 Å²	84.2	59%	0.594	44%	0.442	S	S	*	.	H	α-helix	trans	-60.6	-46.4	176.9	173.4	0	0	0	0	110.6	Q353 K354 F359 S360 H361	Q353-V357 WeakPolarHBondContact O-CG2 3.49Å; Q353-V357 PolarHBondContact O-N 2.91Å; Q353-V357 VanDerWaalsContact O-N 3.11Å; K354-V357 PolarHBondContact O-N 2.95Å; V357-F359 PolarHBondContact O-N 3.05Å; V357-S360 PolarHBondContact O-N 2.99Å; V357-S360 PolarHBondContact O-OG 3.09Å; V357-H361 PolarHBondContact O-N 3.42Å
358	V	86.1	Confident	85	Confident	95 Å²	95	81.8 Å²	81.8	58%	0.576	43%	0.432	S	S	*	.	H	α-helix	trans	-60.5	-47.6	177.5	174.6	0	0	0	0	111.5	K354 L355 Q356 S360 H361	K354-V358 WeakPolarHBondContact O-CG2 3.35Å; K354-V358 PolarHBondContact O-N 3.36Å; K354-V358 VanDerWaalsContact O-N 3.16Å; L355-V358 PolarHBondContact O-N 3.48Å; Q356-V358 PolarHBondContact O-N 3.2Å; V358-S360 VanDerWaalsContact C-N 3.34Å; V358-S360 PolarHBondContact O-N 3.36Å; V358-H361 VanDerWaalsContact O-CB 3.27Å; V358-H361 WeakPolarHBondContact O-CB 3.22Å; V358-H361 PolarHBondContact O-N 3.04Å
359	F	84.4	Confident	85.3	Confident	59 Å²	59	75.8 Å²	75.8	26%	0.259	40%	0.395	S	S	.	.	H	α-helix	trans	-74.6	-22.1	-176.9	-69.7	-15.9	0	0	0	114.5	L355 Q356 V357 H361 L364 V416 F419 A420	L355-F359 HydrophobicContact CD2-CD2 3.53Å; L355-F359 HydrophobicContact CD2-CE2 3.08Å; L355-F359 HydrophobicContact CD2-CZ 3.76Å; L355-F359 HydrophobicContact CG-CD2 4.22Å; L355-F359 HydrophobicContact CG-CE2 3.85Å; L355-F359 HydrophobicContact CG-CZ 4.11Å; L355-F359 WeakPolarHBondContact O-CB 3.39Å; L355-F359 VanDerWaalsContact O-CG 3.31Å; L355-F359 WeakPolarHBondContact O-CG 3.36Å; L355-F359 PolarHBondContact O-N 3.11Å; Q356-F359 PolarHBondContact O-N 3.27Å; V357-F359 PolarHBondContact O-N 3.05Å; F359-H361 VanDerWaalsContact C-N 3.25Å; F359-L364 HydrophobicContact CD1-CD1 4.28Å; F359-V416 HydrophobicContact CB-CG1 3.61Å; F359-V416 HydrophobicContact CD1-CG1 3.69Å; F359-V416 HydrophobicContact CD2-CB 4.42Å; F359-V416 HydrophobicContact CD2-CG1 3.49Å; F359-V416 VanDerWaalsContact CD2-CG1 3.49Å; F359-V416 HydrophobicContact CD2-CG2 4.45Å; F359-V416 HydrophobicContact CE1-CG1 4.14Å; F359-V416 HydrophobicContact CE2-CG1 3.9Å; F359-V416 HydrophobicContact CE2-CG2 4.05Å; F359-V416 HydrophobicContact CG-CG1 3.34Å; F359-V416 HydrophobicContact CZ-CG1 4.24Å; F359-V416 HydrophobicContact CZ-CG2 4.17Å; F359-F419 AromaticContact CD2-CD1 3.95Å; F359-F419 HydrophobicContact CD2-CD1 3.95Å; F359-F419 HydrophobicContact CD2-CE1 4.4Å; F359-F419 HydrophobicContact CE2-CD1 4.44Å; F359-A420 HydrophobicContact CB-CB 3.95Å
360	S	82.1	Confident	85.3	Confident	45 Å²	45	79.3 Å²	79.3	32%	0.315	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-10.1	172.2	71.6	0	0	0	0	113.5	Q356 V357 V358	Q356-S360 VanDerWaalsContact O-CB 3.25Å; Q356-S360 WeakPolarHBondContact O-CB 3.29Å; Q356-S360 PolarHBondContact O-N 3.3Å; Q356-S360 PolarHBondContact O-OG 2.98Å; V357-S360 PolarHBondContact O-N 2.99Å; V357-S360 PolarHBondContact O-OG 3.09Å; V358-S360 VanDerWaalsContact C-N 3.34Å; V358-S360 PolarHBondContact O-N 3.36Å
361	H	85.6	Confident	85.6	Confident	93 Å²	93	77.2 Å²	77.2	43%	0.431	39%	0.39	S	S	.	.	S	Bend	trans	-69.8	143.1	-173.5	-157.1	-61.3	0	0	0	112.1	V357 V358 F359 Y363 L364	V357-H361 PolarHBondContact O-N 3.42Å; V358-H361 VanDerWaalsContact O-CB 3.27Å; V358-H361 WeakPolarHBondContact O-CB 3.22Å; V358-H361 PolarHBondContact O-N 3.04Å; F359-H361 VanDerWaalsContact C-N 3.25Å; H361-Y363 AromaticContact CE1-CD2 3.15Å; H361-Y363 WeakPolarHBondContact CE1-CD2 3.21Å; H361-Y363 AromaticContact CE1-CE2 3.21Å; H361-Y363 WeakPolarHBondContact CE1-CE2 3.42Å; H361-Y363 AromaticContact CG-CD2 3.91Å; H361-Y363 AromaticContact ND1-CD2 3.13Å; H361-Y363 WeakPolarHBondContact ND1-CD2 3.42Å; H361-Y363 AromaticContact ND1-CE2 3.74Å; H361-Y363 AromaticContact ND1-CG 3.83Å; H361-Y363 PolarHBondContact ND1-N 3.19Å; H361-Y363 AromaticContact NE2-CD2 3.9Å; H361-Y363 AromaticContact NE2-CE2 3.86Å; H361-Y363 PolarHBondContact O-N 3.26Å; H361-L364 PolarHBondContact O-N 3.46Å; H361-L364 VanDerWaalsContact O-N 3.08Å
362	Y	82.8	Confident	85.7	Confident	158 Å²	158	72.5 Å²	72.5	62%	0.62	36%	0.361	S	S	*	.	H	α-helix	trans	-50.8	-29.1	177.1	178.5	-107.4	0	0	0	114.6	L364 T365 V366	Y362-L364 PolarHBondContact O-N 3.18Å; Y362-T365 WeakPolarHBondContact O-CB 3.39Å; Y362-T365 PolarHBondContact O-N 3.05Å; Y362-T365 VanDerWaalsContact O-N 3.07Å; Y362-V366 HydrophobicContact CD1-CG2 3.79Å; Y362-V366 HydrophobicContact CE1-CG2 3.32Å; Y362-V366 HydrophobicContact CE2-CG2 4.46Å; Y362-V366 PolarHBondContact O-N 3.32Å
363	Y	85.4	Confident	85.9	Confident	168 Å²	168	73.1 Å²	73.1	66%	0.659	37%	0.365	S	S	*	.	H	α-helix	trans	-62	-30.2	-179.6	-72.2	-61	0	0	0	113.1	H361 T365 V366 L367	H361-Y363 AromaticContact CE1-CD2 3.15Å; H361-Y363 WeakPolarHBondContact CE1-CD2 3.21Å; H361-Y363 AromaticContact CE1-CE2 3.21Å; H361-Y363 WeakPolarHBondContact CE1-CE2 3.42Å; H361-Y363 AromaticContact CG-CD2 3.91Å; H361-Y363 AromaticContact ND1-CD2 3.13Å; H361-Y363 WeakPolarHBondContact ND1-CD2 3.42Å; H361-Y363 AromaticContact ND1-CE2 3.74Å; H361-Y363 AromaticContact ND1-CG 3.83Å; H361-Y363 PolarHBondContact ND1-N 3.19Å; H361-Y363 AromaticContact NE2-CD2 3.9Å; H361-Y363 AromaticContact NE2-CE2 3.86Å; H361-Y363 PolarHBondContact O-N 3.26Å; Y363-T365 VanDerWaalsContact C-N 3.26Å; Y363-T365 PolarHBondContact O-N 3.31Å; Y363-V366 PolarHBondContact O-N 2.8Å; Y363-L367 WeakPolarHBondContact O-CB 2.99Å; Y363-L367 PolarHBondContact O-N 3.26Å
364	L	85.4	Confident	86.2	Confident	34 Å²	34	70.9 Å²	70.9	18%	0.178	36%	0.362	C	S	.	.	H	α-helix	trans	-66	-33.7	177.5	-169	137.9	0	0	0	111.6	F359 H361 Y362 G368 E413 V416 K417	F359-L364 HydrophobicContact CD1-CD1 4.28Å; H361-L364 PolarHBondContact O-N 3.46Å; H361-L364 VanDerWaalsContact O-N 3.08Å; Y362-L364 PolarHBondContact O-N 3.18Å; L364-G368 PolarHBondContact O-N 3.45Å; L364-E413 HydrophobicContact CD2-CG 4.1Å; L364-V416 HydrophobicContact CD1-CG1 3.49Å; L364-V416 VanDerWaalsContact CD1-CG1 3.49Å; L364-K417 HydrophobicContact CD2-CD 4.48Å; L364-K417 HydrophobicContact CD2-CG 3.99Å
365	T	83.3	Confident	86.3	Confident	41 Å²	41	63.2 Å²	63.2	25%	0.252	33%	0.329	S	S	.	.	H	α-helix	trans	-71.8	-42.1	174.6	-58.5	0	0	0	0	111.2	Y362 Y363 L367 G368 N369	Y362-T365 WeakPolarHBondContact O-CB 3.39Å; Y362-T365 PolarHBondContact O-N 3.05Å; Y362-T365 VanDerWaalsContact O-N 3.07Å; Y363-T365 VanDerWaalsContact C-N 3.26Å; Y363-T365 PolarHBondContact O-N 3.31Å; T365-L367 PolarHBondContact O-N 2.87Å; T365-G368 PolarHBondContact O-N 2.77Å; T365-N369 VanDerWaalsContact O-CG 3.23Å; T365-N369 PolarHBondContact O-N 3.02Å; T365-N369 PolarHBondContact O-OD1 3.48Å
366	V	86.6	Confident	86.5	Confident	59 Å²	59	60.6 Å²	60.6	36%	0.358	32%	0.316	S	S	.	.	H	α-helix	trans	-61	-44	174.9	177.7	0	0	0	0	111.4	Y362 Y363 N369 L370	Y362-V366 HydrophobicContact CD1-CG2 3.79Å; Y362-V366 HydrophobicContact CE1-CG2 3.32Å; Y362-V366 HydrophobicContact CE2-CG2 4.46Å; Y362-V366 PolarHBondContact O-N 3.32Å; Y363-V366 PolarHBondContact O-N 2.8Å; V366-N369 PolarHBondContact O-N 3.23Å; V366-L370 PolarHBondContact O-N 3.11Å
367	L	89.3	Confident	86.6	Confident	90 Å²	90	64.7 Å²	64.7	47%	0.471	34%	0.338	S	S	.	.	H	α-helix	trans	-61.4	-46.5	176.3	-177.7	69.7	0	0	0	111.3	Y363 T365 N369 L370 V371 F409	Y363-L367 WeakPolarHBondContact O-CB 2.99Å; Y363-L367 PolarHBondContact O-N 3.26Å; T365-L367 PolarHBondContact O-N 2.87Å; L367-N369 VanDerWaalsContact C-N 3.26Å; L367-N369 PolarHBondContact O-N 3.47Å; L367-L370 WeakPolarHBondContact O-CB 3.04Å; L367-L370 PolarHBondContact O-N 2.99Å; L367-V371 WeakPolarHBondContact O-CG2 3.46Å; L367-V371 PolarHBondContact O-N 3.01Å; L367-F409 HydrophobicContact CD2-CZ 4.47Å; L367-F409 HydrophobicContact CG-CZ 4.42Å
368	G	87.8	Confident	86.8	Confident	1 Å²	1	61.6 Å²	61.6	1%	0.01	32%	0.32	C	S	.	.	H	α-helix	trans	-58.1	-39.6	175.6	0	0	0	0	0	112.5	L364 T365 V371 A372	L364-G368 PolarHBondContact O-N 3.45Å; T365-G368 PolarHBondContact O-N 2.77Å; G368-V371 PolarHBondContact O-N 2.86Å; G368-A372 WeakPolarHBondContact O-CB 3.2Å; G368-A372 PolarHBondContact O-N 3.46Å
369	N	87.2	Confident	86.7	Confident	25 Å²	25	57.1 Å²	57.1	13%	0.134	29%	0.293	C	S	.	.	H	α-helix	trans	-68.9	-40	176.9	-67.6	-6.8	0	0	0	112.3	T365 V366 L367 A372 L373 R486 D490	T365-N369 VanDerWaalsContact O-CG 3.23Å; T365-N369 PolarHBondContact O-N 3.02Å; T365-N369 PolarHBondContact O-OD1 3.48Å; V366-N369 PolarHBondContact O-N 3.23Å; L367-N369 VanDerWaalsContact C-N 3.26Å; L367-N369 PolarHBondContact O-N 3.47Å; N369-A372 PolarHBondContact O-N 3.2Å; N369-L373 PolarHBondContact O-N 2.92Å; N369-R486 PolarHBondContact OD1-NE 3.27Å; N369-D490 PolarHBondContact ND2-OD2 3.19Å
370	L	89.4	Confident	86.8	Confident	113 Å²	113	57.3 Å²	57.3	59%	0.592	30%	0.301	S	S	*	.	H	α-helix	trans	-61.2	-44.9	174.6	-171.7	82.8	0	0	0	111.1	V366 L367 L373 A374	V366-L370 PolarHBondContact O-N 3.11Å; L367-L370 WeakPolarHBondContact O-CB 3.04Å; L367-L370 PolarHBondContact O-N 2.99Å; L370-L373 PolarHBondContact O-N 3.37Å; L370-A374 WeakPolarHBondContact O-CB 3.13Å; L370-A374 PolarHBondContact O-N 3.49Å
371	V	90.3	Very high	87	Confident	25 Å²	25	59 Å²	59	15%	0.152	31%	0.309	C	S	.	.	H	α-helix	trans	-66.6	-39.5	178	174.2	0	0	0	0	111.3	L367 G368 A374 N375 F406 F409 Y410	L367-V371 WeakPolarHBondContact O-CG2 3.46Å; L367-V371 PolarHBondContact O-N 3.01Å; G368-V371 PolarHBondContact O-N 2.86Å; V371-A374 PolarHBondContact O-N 2.95Å; V371-N375 WeakPolarHBondContact O-CB 3.27Å; V371-N375 PolarHBondContact O-N 2.95Å; V371-F406 HydrophobicContact CG1-CD1 3.88Å; V371-F406 HydrophobicContact CG1-CE1 3.95Å; V371-F409 HydrophobicContact CB-CD1 4.23Å; V371-F409 HydrophobicContact CB-CE1 3.75Å; V371-F409 HydrophobicContact CB-CZ 4.09Å; V371-F409 HydrophobicContact CG1-CD1 3.61Å; V371-F409 HydrophobicContact CG1-CE1 3.67Å; V371-F409 HydrophobicContact CG1-CG 4.18Å; V371-F409 HydrophobicContact CG1-CZ 4.27Å; V371-F409 HydrophobicContact CG2-CD1 4.49Å; V371-F409 HydrophobicContact CG2-CE1 3.87Å; V371-F409 HydrophobicContact CG2-CE2 4.12Å; V371-F409 HydrophobicContact CG2-CZ 3.66Å; V371-Y410 HydrophobicContact CG1-CE1 4.33Å
372	A	87.1	Confident	86.9	Confident	4 Å²	4	55.9 Å²	55.9	3%	0.033	30%	0.296	C	S	.	.	H	α-helix	trans	-61.1	-43.4	173.7	0	0	0	0	0	112	G368 N369 N375 V376	G368-A372 WeakPolarHBondContact O-CB 3.2Å; G368-A372 PolarHBondContact O-N 3.46Å; N369-A372 PolarHBondContact O-N 3.2Å; A372-N375 PolarHBondContact O-N 3.41Å; A372-V376 WeakPolarHBondContact O-CG2 3.44Å; A372-V376 PolarHBondContact O-N 3.34Å
373	L	88.2	Confident	86.8	Confident	76 Å²	76	52.2 Å²	52.2	40%	0.398	29%	0.286	S	S	.	.	H	α-helix	trans	-63.1	-44.7	175.3	-175.4	68.9	0	0	0	111.6	N369 L370 N375 V376 L377 F484	N369-L373 PolarHBondContact O-N 2.92Å; L370-L373 PolarHBondContact O-N 3.37Å; L373-N375 VanDerWaalsContact C-N 3.31Å; L373-N375 PolarHBondContact O-N 3.45Å; L373-V376 PolarHBondContact O-N 2.93Å; L373-L377 HydrophobicContact CG-CD1 4.3Å; L373-L377 WeakPolarHBondContact O-CG 3.47Å; L373-L377 PolarHBondContact O-N 3.36Å; L373-F484 HydrophobicContact CD1-CE2 4.11Å
374	A	89.7	Confident	86.9	Confident	47 Å²	47	49.1 Å²	49.1	39%	0.388	29%	0.285	S	S	.	.	H	α-helix	trans	-60.9	-39.9	176.7	0	0	0	0	0	112.1	L370 V371 L377 C378	L370-A374 WeakPolarHBondContact O-CB 3.13Å; L370-A374 PolarHBondContact O-N 3.49Å; V371-A374 PolarHBondContact O-N 2.95Å; A374-L377 PolarHBondContact O-N 3.08Å; A374-C378 VanDerWaalsContact O-CB 3.31Å; A374-C378 WeakPolarHBondContact O-CB 3.34Å; A374-C378 PolarHBondContact O-N 3.04Å
375	N	87.9	Confident	86.9	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-63.7	-46.3	176.4	-168.5	0.3	0	0	0	111.7	V371 A372 L373 L377 C378 I379 F406 Y410 I480	V371-N375 WeakPolarHBondContact O-CB 3.27Å; V371-N375 PolarHBondContact O-N 2.95Å; A372-N375 PolarHBondContact O-N 3.41Å; L373-N375 VanDerWaalsContact C-N 3.31Å; L373-N375 PolarHBondContact O-N 3.45Å; N375-L377 PolarHBondContact O-N 3.44Å; N375-C378 WeakPolarHBondContact O-CB 3.44Å; N375-C378 PolarHBondContact O-N 2.88Å; N375-I379 WeakPolarHBondContact O-CG1 3.44Å; N375-I379 PolarHBondContact O-N 3.02Å; N375-F406 HydrophobicContact CB-CD1 3.87Å; N375-F406 HydrophobicContact CB-CD2 4.04Å; N375-F406 HydrophobicContact CB-CE1 3.74Å; N375-F406 HydrophobicContact CB-CE2 3.9Å; N375-F406 HydrophobicContact CB-CG 4.03Å; N375-F406 HydrophobicContact CB-CZ 3.76Å; N375-F406 VanDerWaalsContact CG-CG 3.5Å; N375-F406 WeakPolarHBondContact ND2-CB 3.38Å; N375-F406 WeakPolarHBondContact ND2-CG 3.29Å; N375-F406 WeakPolarHBondContact OD1-CD2 3.49Å; N375-F406 VanDerWaalsContact OD1-CE2 3.32Å; N375-F406 WeakPolarHBondContact OD1-CE2 3.34Å; N375-Y410 WeakPolarHBondContact CB-OH 3.47Å; N375-Y410 PolarHBondContact ND2-OH 2.95Å; N375-I480 VanDerWaalsContact ND2-CG2 3.26Å; N375-I480 WeakPolarHBondContact ND2-CG2 3.28Å
376	V	87.5	Confident	86.8	Confident	22 Å²	22	52.3 Å²	52.3	13%	0.133	30%	0.3	C	S	.	.	H	α-helix	trans	-60.6	-45.3	175.8	173.6	0	0	0	0	111.2	A372 L373 C378 I379 C380 F484	A372-V376 WeakPolarHBondContact O-CG2 3.44Å; A372-V376 PolarHBondContact O-N 3.34Å; L373-V376 PolarHBondContact O-N 2.93Å; V376-C378 VanDerWaalsContact C-N 3.33Å; V376-C378 PolarHBondContact O-N 3.29Å; V376-I379 PolarHBondContact O-N 2.96Å; V376-C380 WeakPolarHBondContact O-CB 3.36Å; V376-C380 PolarHBondContact O-N 3.27Å; V376-C380 PolarHBondContact O-SG 3.39Å; V376-F484 HydrophobicContact CG2-CB 4.01Å; V376-F484 HydrophobicContact CG2-CD2 4.19Å; V376-F484 HydrophobicContact CG2-CG 4.48Å
377	L	89.1	Confident	86.6	Confident	106 Å²	106	53.7 Å²	53.7	56%	0.555	31%	0.313	S	S	*	.	H	α-helix	trans	-60.3	-43.1	176.5	-71.2	172.5	0	0	0	111.6	L373 A374 N375 C380 T381	L373-L377 HydrophobicContact CG-CD1 4.3Å; L373-L377 WeakPolarHBondContact O-CG 3.47Å; L373-L377 PolarHBondContact O-N 3.36Å; A374-L377 PolarHBondContact O-N 3.08Å; N375-L377 PolarHBondContact O-N 3.44Å; L377-C380 PolarHBondContact O-N 3.29Å; L377-T381 WeakPolarHBondContact O-CG2 3.35Å; L377-T381 PolarHBondContact O-N 2.94Å; L377-T381 PolarHBondContact O-OG1 2.78Å
378	C	86.9	Confident	86.2	Confident	32 Å²	32	58.3 Å²	58.3	22%	0.216	33%	0.332	C	S	.	.	H	α-helix	trans	-62.4	-43.6	177.3	-173	0	0	0	0	112.3	A374 N375 V376 T381 I382 F406	A374-C378 VanDerWaalsContact O-CB 3.31Å; A374-C378 WeakPolarHBondContact O-CB 3.34Å; A374-C378 PolarHBondContact O-N 3.04Å; N375-C378 WeakPolarHBondContact O-CB 3.44Å; N375-C378 PolarHBondContact O-N 2.88Å; V376-C378 VanDerWaalsContact C-N 3.33Å; V376-C378 PolarHBondContact O-N 3.29Å; C378-T381 PolarHBondContact O-N 2.77Å; C378-T381 PolarHBondContact O-OG1 3.19Å; C378-I382 WeakPolarHBondContact O-CB 3.25Å; C378-I382 WeakPolarHBondContact O-CD1 3.37Å; C378-I382 VanDerWaalsContact O-CG1 3.23Å; C378-I382 WeakPolarHBondContact O-CG1 3.47Å; C378-I382 PolarHBondContact O-N 3.42Å; C378-F406 HydrophobicContact CB-CE2 4.49Å
379	I	84.8	Confident	85.8	Confident	2 Å²	2	62.9 Å²	62.9	1%	0.01	35%	0.351	C	S	.	.	H	α-helix	trans	-66.6	-42.1	176.1	-69.6	175.1	0	0	0	110.9	N375 V376 T381 I382 L383 N477 I480	N375-I379 WeakPolarHBondContact O-CG1 3.44Å; N375-I379 PolarHBondContact O-N 3.02Å; V376-I379 PolarHBondContact O-N 2.96Å; I379-T381 PolarHBondContact O-N 3.25Å; I379-I382 PolarHBondContact O-N 3.32Å; I379-L383 HydrophobicContact CG2-CD1 3.69Å; I379-L383 HydrophobicContact CG2-CG 4.06Å; I379-L383 WeakPolarHBondContact O-CB 3.44Å; I379-L383 VanDerWaalsContact O-CG 3.27Å; I379-L383 WeakPolarHBondContact O-CG 3.28Å; I379-L383 PolarHBondContact O-N 2.92Å; I379-N477 HydrophobicContact CG2-CB 4.4Å; I379-I480 HydrophobicContact CD1-CB 3.6Å; I379-I480 HydrophobicContact CD1-CD1 3.68Å; I379-I480 HydrophobicContact CD1-CG1 4.24Å; I379-I480 HydrophobicContact CD1-CG2 3.31Å
380	C	85.7	Confident	85	Confident	62 Å²	62	64.3 Å²	64.3	42%	0.419	36%	0.363	S	S	.	.	H	α-helix	trans	-58.8	-46	176.5	-73.8	0	0	0	0	111.6	V376 L377 L383 V384	V376-C380 WeakPolarHBondContact O-CB 3.36Å; V376-C380 PolarHBondContact O-N 3.27Å; V376-C380 PolarHBondContact O-SG 3.39Å; L377-C380 PolarHBondContact O-N 3.29Å; C380-L383 PolarHBondContact O-N 3.03Å; C380-V384 VanDerWaalsContact O-CG2 3.3Å; C380-V384 WeakPolarHBondContact O-CG2 3.41Å; C380-V384 PolarHBondContact O-N 3.34Å
381	T	86.9	Confident	83.9	Confident	80 Å²	80	62.7 Å²	62.7	49%	0.491	36%	0.358	S	S	.	.	H	α-helix	trans	-65	-42.6	178	57.2	0	0	0	0	111.8	L377 C378 I379 L383 V384 L385	L377-T381 WeakPolarHBondContact O-CG2 3.35Å; L377-T381 PolarHBondContact O-N 2.94Å; L377-T381 PolarHBondContact O-OG1 2.78Å; C378-T381 PolarHBondContact O-N 2.77Å; C378-T381 PolarHBondContact O-OG1 3.19Å; I379-T381 PolarHBondContact O-N 3.25Å; T381-L383 PolarHBondContact O-N 2.71Å; T381-V384 PolarHBondContact O-N 2.78Å; T381-L385 WeakPolarHBondContact O-CB 3.46Å; T381-L385 VanDerWaalsContact O-CG 3.28Å; T381-L385 WeakPolarHBondContact O-CG 3.32Å; T381-L385 PolarHBondContact O-N 2.86Å
382	I	82.7	Confident	82.6	Confident	28 Å²	28	70.6 Å²	70.6	14%	0.144	39%	0.393	C	S	.	.	H	α-helix	trans	-65.6	-38.9	178	-66.9	167.8	0	0	0	111.5	C378 I379 L385 N386 L399 I402	C378-I382 WeakPolarHBondContact O-CB 3.25Å; C378-I382 WeakPolarHBondContact O-CD1 3.37Å; C378-I382 VanDerWaalsContact O-CG1 3.23Å; C378-I382 WeakPolarHBondContact O-CG1 3.47Å; C378-I382 PolarHBondContact O-N 3.42Å; I379-I382 PolarHBondContact O-N 3.32Å; I382-L385 PolarHBondContact O-N 3.3Å; I382-N386 VanDerWaalsContact CG2-ND2 3.27Å; I382-N386 WeakPolarHBondContact CG2-ND2 3.2Å; I382-N386 VanDerWaalsContact O-CB 3.27Å; I382-N386 WeakPolarHBondContact O-CB 3.37Å; I382-N386 PolarHBondContact O-N 2.94Å; I382-N386 PolarHBondContact O-ND2 3.4Å; I382-N386 VanDerWaalsContact O-ND2 3.11Å; I382-L399 HydrophobicContact CD1-CD1 3.98Å; I382-L399 HydrophobicContact CG2-CD1 4.18Å; I382-L399 HydrophobicContact CG2-CD2 4.36Å; I382-I402 HydrophobicContact CD1-CD1 3.89Å
383	L	82.3	Confident	81.6	Confident	81 Å²	81	76.4 Å²	76.4	42%	0.424	42%	0.42	S	S	.	.	H	α-helix	trans	-64.5	-41.7	175.9	-77.2	173.6	0	0	0	111.5	I379 C380 T381 N386 S387	I379-L383 HydrophobicContact CG2-CD1 3.69Å; I379-L383 HydrophobicContact CG2-CG 4.06Å; I379-L383 WeakPolarHBondContact O-CB 3.44Å; I379-L383 VanDerWaalsContact O-CG 3.27Å; I379-L383 WeakPolarHBondContact O-CG 3.28Å; I379-L383 PolarHBondContact O-N 2.92Å; C380-L383 PolarHBondContact O-N 3.03Å; T381-L383 PolarHBondContact O-N 2.71Å; L383-N386 PolarHBondContact O-N 2.98Å; L383-S387 WeakPolarHBondContact O-CB 3.27Å; L383-S387 PolarHBondContact O-N 2.95Å
384	V	86.8	Confident	80.7	Confident	104 Å²	104	74.4 Å²	74.4	63%	0.63	41%	0.407	S	S	*	.	H	α-helix	trans	-65	-47.5	176.1	171.1	0	0	0	0	110.7	C380 T381 N386 S387	C380-V384 VanDerWaalsContact O-CG2 3.3Å; C380-V384 WeakPolarHBondContact O-CG2 3.41Å; C380-V384 PolarHBondContact O-N 3.34Å; T381-V384 PolarHBondContact O-N 2.78Å; V384-N386 PolarHBondContact O-N 3.09Å; V384-S387 WeakPolarHBondContact O-CB 3.5Å; V384-S387 PolarHBondContact O-N 2.99Å; V384-S387 VanDerWaalsContact O-N 3.12Å; V384-S387 PolarHBondContact O-OG 3.16Å
385	L	84.8	Confident	79.6	Confident	125 Å²	125	77.5 Å²	77.5	65%	0.654	42%	0.417	S	S	*	.	H	α-helix	trans	-63.3	-29	179.3	-72.5	171	0	0	0	113.3	T381 I382	T381-L385 WeakPolarHBondContact O-CB 3.46Å; T381-L385 VanDerWaalsContact O-CG 3.28Å; T381-L385 WeakPolarHBondContact O-CG 3.32Å; T381-L385 PolarHBondContact O-N 2.86Å; I382-L385 PolarHBondContact O-N 3.3Å
386	N	81.2	Confident	78.8	Confident	16 Å²	16	79.2 Å²	79.2	9%	0.086	43%	0.426	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.8	1.4	178.1	-70.2	-36.5	0	0	0	113.6	I382 L383 V384 E388 K389 R394	I382-N386 VanDerWaalsContact CG2-ND2 3.27Å; I382-N386 WeakPolarHBondContact CG2-ND2 3.2Å; I382-N386 VanDerWaalsContact O-CB 3.27Å; I382-N386 WeakPolarHBondContact O-CB 3.37Å; I382-N386 PolarHBondContact O-N 2.94Å; I382-N386 PolarHBondContact O-ND2 3.4Å; I382-N386 VanDerWaalsContact O-ND2 3.11Å; L383-N386 PolarHBondContact O-N 2.98Å; V384-N386 PolarHBondContact O-N 3.09Å; N386-E388 VanDerWaalsContact C-N 3.33Å; N386-E388 PolarHBondContact O-N 3.22Å; N386-K389 PolarHBondContact O-N 3.18Å; N386-R394 HydrophobicContact CB-CG 4.3Å
387	S	82.4	Confident	78.2	Confident	89 Å²	89	85 Å²	85	62%	0.622	45%	0.447	S	S	*	.	S	Bend	trans	-69.4	-31.2	-175.5	64.9	0	0	0	0	113.1	L383 V384	L383-S387 WeakPolarHBondContact O-CB 3.27Å; L383-S387 PolarHBondContact O-N 2.95Å; V384-S387 WeakPolarHBondContact O-CB 3.5Å; V384-S387 PolarHBondContact O-N 2.99Å; V384-S387 VanDerWaalsContact O-N 3.12Å; V384-S387 PolarHBondContact O-OG 3.16Å
388	E	80.9	Confident	77.7	Confident	187 Å²	187	84.8 Å²	84.8	87%	0.874	45%	0.445	S	S	*	.	S	Bend	trans	-90.4	-13.1	178.3	-64.2	-178.3	171.8	0	0	113.5	N386	N386-E388 VanDerWaalsContact C-N 3.33Å; N386-E388 PolarHBondContact O-N 3.22Å
389	K	80.3	Confident	77.3	Confident	97 Å²	97	83.5 Å²	83.5	42%	0.422	44%	0.436	S	S	.	.	S	Bend	trans	-87.7	138.6	-177.1	-64.8	-174.1	179.3	-175.5	0	111.5	N386 R394	N386-K389 PolarHBondContact O-N 3.18Å; K389-R394 HydrophobicContact CB-CG 3.97Å
390	S	70	Confident	77	Confident	55 Å²	55	85 Å²	85	39%	0.385	44%	0.443	S	S	.	.			trans	-66.2	161.1	173.7	68.1	0	0	0	0	111.6	E392 E393 R394	S390-E392 PolarHBondContact O-N 3.48Å; S390-E392 VanDerWaalsContact O-N 3.13Å; S390-E393 PolarHBondContact N-OE2 3.37Å; S390-E393 PolarHBondContact O-N 3.05Å; S390-E393 VanDerWaalsContact OG-CG 3.29Å; S390-E393 WeakPolarHBondContact OG-CG 3.39Å; S390-E393 PolarHBondContact OG-OE2 2.95Å; S390-R394 VanDerWaalsContact O-CG 3.31Å; S390-R394 WeakPolarHBondContact O-CG 3.38Å
391	T	66.3	Low	76.8	Confident	78 Å²	78	84.8 Å²	84.8	48%	0.479	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-25.6	-176.3	-56.9	0	0	0	0	112.8	W470	T391-W470 HydrophobicContact CG2-CB 4.23Å; T391-W470 HydrophobicContact CG2-CD2 4.27Å; T391-W470 HydrophobicContact CG2-CG 3.92Å
392	E	64.2	Low	76.7	Confident	191 Å²	191	83 Å²	83	89%	0.893	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-29.2	-179.3	-59.3	-175.9	174.7	0	0	113	S390 R394	S390-E392 PolarHBondContact O-N 3.48Å; S390-E392 VanDerWaalsContact O-N 3.13Å; E392-R394 VanDerWaalsContact C-N 3.31Å; E392-R394 PolarHBondContact O-N 3.47Å
393	E	65.2	Low	76.8	Confident	126 Å²	126	81.8 Å²	81.8	59%	0.589	42%	0.42	S	S	*	.	S	Bend	trans	-87.9	2.2	-179.3	-67.1	166.1	150.6	0	0	113.5	S390	S390-E393 PolarHBondContact N-OE2 3.37Å; S390-E393 PolarHBondContact O-N 3.05Å; S390-E393 VanDerWaalsContact OG-CG 3.29Å; S390-E393 WeakPolarHBondContact OG-CG 3.39Å; S390-E393 PolarHBondContact OG-OE2 2.95Å
394	R	68.8	Low	77	Confident	34 Å²	34	81.5 Å²	81.5	13%	0.128	42%	0.418	C	S	.	.			trans	-88.3	119	-175.5	-78.3	172.4	62.1	159.4	5.1	111.8	N386 K389 S390 E392 N396	N386-R394 HydrophobicContact CB-CG 4.3Å; K389-R394 HydrophobicContact CB-CG 3.97Å; S390-R394 VanDerWaalsContact O-CG 3.31Å; S390-R394 WeakPolarHBondContact O-CG 3.38Å; E392-R394 VanDerWaalsContact C-N 3.31Å; E392-R394 PolarHBondContact O-N 3.47Å; R394-N396 VanDerWaalsContact C-N 3.32Å; R394-N396 PolarHBondContact O-N 2.9Å; R394-N396 PolarHBondContact O-ND2 2.86Å
395	D	66.6	Low	77.2	Confident	112 Å²	112	80.2 Å²	80.2	60%	0.599	41%	0.414	S	S	*	.			trans	-71.1	83.7	170.4	-73	-31.7	0	0	0	111.4	Y397	D395-Y397 PolarHBondContact O-N 3.15Å
396	N	71.4	Confident	77.5	Confident	36 Å²	36	76 Å²	76	19%	0.193	39%	0.39	C	S	.	.	H	α-helix	trans	-72.1	-16.8	179.7	-64	-44.4	0	0	0	113	R394 L399 E400 L469	R394-N396 VanDerWaalsContact C-N 3.32Å; R394-N396 PolarHBondContact O-N 2.9Å; R394-N396 PolarHBondContact O-ND2 2.86Å; N396-L399 PolarHBondContact O-N 2.65Å; N396-E400 PolarHBondContact O-N 3.15Å; N396-L469 HydrophobicContact CB-CD2 4.38Å
397	Y	75.8	Confident	77.9	Confident	145 Å²	145	75.5 Å²	75.5	57%	0.569	39%	0.387	S	S	*	.	H	α-helix	trans	-64.5	-46.3	-177.3	-179.6	-100.5	0	0	0	113.2	D395 L399 E400 V401	D395-Y397 PolarHBondContact O-N 3.15Å; Y397-L399 VanDerWaalsContact C-N 3.31Å; Y397-L399 PolarHBondContact O-N 3.38Å; Y397-E400 PolarHBondContact O-N 3.28Å; Y397-V401 HydrophobicContact CD1-CG2 4.42Å; Y397-V401 HydrophobicContact CE1-CG2 4.02Å; Y397-V401 HydrophobicContact CE2-CG2 4.4Å; Y397-V401 WeakPolarHBondContact O-CG2 3.38Å; Y397-V401 PolarHBondContact O-N 3.19Å
398	I	77.6	Confident	78.3	Confident	100 Å²	100	75.7 Å²	75.7	51%	0.513	38%	0.381	S	S	.	.	H	α-helix	trans	-63	-42.5	-179.3	-64.9	173.5	0	0	0	110.2	V401 I402	I398-V401 PolarHBondContact O-N 3.25Å; I398-I402 HydrophobicContact CG2-CD1 3.77Å; I398-I402 HydrophobicContact CG2-CG1 4.45Å; I398-I402 VanDerWaalsContact O-CG1 3.28Å; I398-I402 WeakPolarHBondContact O-CG1 3.18Å; I398-I402 PolarHBondContact O-N 3.05Å
399	L	78.1	Confident	78.9	Confident	5 Å²	5	69.7 Å²	69.7	3%	0.026	35%	0.352	C	S	.	.	H	α-helix	trans	-63.7	-40.5	178	179.4	59.1	0	0	0	112	I382 N396 Y397 I402 N403 V473	I382-L399 HydrophobicContact CD1-CD1 3.98Å; I382-L399 HydrophobicContact CG2-CD1 4.18Å; I382-L399 HydrophobicContact CG2-CD2 4.36Å; N396-L399 PolarHBondContact O-N 2.65Å; Y397-L399 VanDerWaalsContact C-N 3.31Å; Y397-L399 PolarHBondContact O-N 3.38Å; L399-I402 PolarHBondContact O-N 3.21Å; L399-N403 VanDerWaalsContact O-CB 3.29Å; L399-N403 WeakPolarHBondContact O-CB 3.18Å; L399-N403 PolarHBondContact O-N 2.97Å; L399-N403 PolarHBondContact O-ND2 2.95Å; L399-V473 HydrophobicContact CD2-CG1 3.73Å; L399-V473 HydrophobicContact CG-CG1 4.32Å
400	E	78.3	Confident	79.4	Confident	35 Å²	35	65.2 Å²	65.2	16%	0.164	33%	0.332	C	S	.	.	H	α-helix	trans	-62.4	-44.2	175.6	-170.1	-172.8	171	0	0	111.9	N396 Y397 N403 L404	N396-E400 PolarHBondContact O-N 3.15Å; Y397-E400 PolarHBondContact O-N 3.28Å; E400-N403 PolarHBondContact O-N 3.31Å; E400-L404 WeakPolarHBondContact O-CB 3.16Å; E400-L404 PolarHBondContact O-N 3.26Å
401	V	83.3	Confident	80.4	Confident	57 Å²	57	65.4 Å²	65.4	35%	0.345	33%	0.329	S	S	.	.	H	α-helix	trans	-62.9	-45.5	177.7	173.7	0	0	0	0	111	Y397 I398 L404 C405	Y397-V401 HydrophobicContact CD1-CG2 4.42Å; Y397-V401 HydrophobicContact CE1-CG2 4.02Å; Y397-V401 HydrophobicContact CE2-CG2 4.4Å; Y397-V401 WeakPolarHBondContact O-CG2 3.38Å; Y397-V401 PolarHBondContact O-N 3.19Å; I398-V401 PolarHBondContact O-N 3.25Å; V401-L404 PolarHBondContact O-N 2.86Å; V401-C405 PolarHBondContact O-N 3.45Å; V401-C405 PolarHBondContact O-SG 3.35Å
402	I	84.6	Confident	81.6	Confident	42 Å²	42	64.5 Å²	64.5	22%	0.215	33%	0.325	C	S	.	.	H	α-helix	trans	-60.9	-47.3	177.2	-70.7	171.1	0	0	0	110.6	I382 I398 L399 L404 C405 F406	I382-I402 HydrophobicContact CD1-CD1 3.89Å; I398-I402 HydrophobicContact CG2-CD1 3.77Å; I398-I402 HydrophobicContact CG2-CG1 4.45Å; I398-I402 VanDerWaalsContact O-CG1 3.28Å; I398-I402 WeakPolarHBondContact O-CG1 3.18Å; I398-I402 PolarHBondContact O-N 3.05Å; L399-I402 PolarHBondContact O-N 3.21Å; I402-L404 VanDerWaalsContact C-N 3.33Å; I402-L404 PolarHBondContact O-N 3.43Å; I402-C405 WeakPolarHBondContact O-CB 3.32Å; I402-C405 PolarHBondContact O-N 3.02Å; I402-F406 HydrophobicContact CG2-CD2 3.67Å; I402-F406 HydrophobicContact CG2-CE2 3.4Å; I402-F406 VanDerWaalsContact CG2-CE2 3.4Å; I402-F406 WeakPolarHBondContact O-CD2 3.31Å; I402-F406 PolarHBondContact O-N 3.42Å
403	N	84.8	Confident	82.9	Confident	2 Å²	2	55.7 Å²	55.7	1%	0.011	29%	0.285	C	S	.	.	H	α-helix	trans	-60.7	-42.4	178.2	-76.6	-15.7	0	0	0	111.7	L399 E400 F406 I407 N477 I480	L399-N403 VanDerWaalsContact O-CB 3.29Å; L399-N403 WeakPolarHBondContact O-CB 3.18Å; L399-N403 PolarHBondContact O-N 2.97Å; L399-N403 PolarHBondContact O-ND2 2.95Å; E400-N403 PolarHBondContact O-N 3.31Å; N403-F406 PolarHBondContact O-N 3.39Å; N403-I407 WeakPolarHBondContact O-CB 3.31Å; N403-I407 WeakPolarHBondContact O-CG1 3.44Å; N403-I407 PolarHBondContact O-N 3.06Å; N403-N477 PolarHBondContact ND2-OD1 2.93Å; N403-I480 WeakPolarHBondContact OD1-CD1 3.23Å
404	L	86.6	Confident	84.2	Confident	75 Å²	75	51 Å²	51	39%	0.393	26%	0.263	S	S	.	.	H	α-helix	trans	-60.6	-47	175.5	179.9	64.5	0	0	0	111.7	E400 V401 I402 F406 I407 L408 Q446	E400-L404 WeakPolarHBondContact O-CB 3.16Å; E400-L404 PolarHBondContact O-N 3.26Å; V401-L404 PolarHBondContact O-N 2.86Å; I402-L404 VanDerWaalsContact C-N 3.33Å; I402-L404 PolarHBondContact O-N 3.43Å; L404-F406 VanDerWaalsContact C-N 3.33Å; L404-F406 PolarHBondContact O-N 2.92Å; L404-I407 PolarHBondContact O-N 2.92Å; L404-L408 HydrophobicContact CD1-CD1 4.34Å; L404-L408 HydrophobicContact CD1-CG 4.3Å; L404-L408 HydrophobicContact CG-CD1 4.15Å; L404-L408 VanDerWaalsContact O-CG 3.32Å; L404-L408 WeakPolarHBondContact O-CG 3.5Å; L404-L408 PolarHBondContact O-N 3.09Å; L404-Q446 HydrophobicContact CD1-CG 4.1Å
405	C	89.8	Confident	85.3	Confident	78 Å²	78	52.4 Å²	52.4	53%	0.527	28%	0.278	S	S	.	.	H	α-helix	trans	-57.5	-45.4	177.9	-73	0	0	0	0	111.9	V401 I402 L408 F409	V401-C405 PolarHBondContact O-N 3.45Å; V401-C405 PolarHBondContact O-SG 3.35Å; I402-C405 WeakPolarHBondContact O-CB 3.32Å; I402-C405 PolarHBondContact O-N 3.02Å; C405-L408 PolarHBondContact O-N 3.44Å; C405-F409 PolarHBondContact O-N 3.06Å; C405-F409 VanDerWaalsContact O-N 3.08Å
406	F	90.8	Very high	86.5	Confident	36 Å²	36	48.5 Å²	48.5	16%	0.158	26%	0.258	C	S	.	.	H	α-helix	trans	-65.9	-44.4	176.6	-74.9	-60.2	0	0	0	112.2	V371 N375 C378 I402 N403 L404 L408 F409 Y410	V371-F406 HydrophobicContact CG1-CD1 3.88Å; V371-F406 HydrophobicContact CG1-CE1 3.95Å; N375-F406 HydrophobicContact CB-CD1 3.87Å; N375-F406 HydrophobicContact CB-CD2 4.04Å; N375-F406 HydrophobicContact CB-CE1 3.74Å; N375-F406 HydrophobicContact CB-CE2 3.9Å; N375-F406 HydrophobicContact CB-CG 4.03Å; N375-F406 HydrophobicContact CB-CZ 3.76Å; N375-F406 VanDerWaalsContact CG-CG 3.5Å; N375-F406 WeakPolarHBondContact ND2-CB 3.38Å; N375-F406 WeakPolarHBondContact ND2-CG 3.29Å; N375-F406 WeakPolarHBondContact OD1-CD2 3.49Å; N375-F406 VanDerWaalsContact OD1-CE2 3.32Å; N375-F406 WeakPolarHBondContact OD1-CE2 3.34Å; C378-F406 HydrophobicContact CB-CE2 4.49Å; I402-F406 HydrophobicContact CG2-CD2 3.67Å; I402-F406 HydrophobicContact CG2-CE2 3.4Å; I402-F406 VanDerWaalsContact CG2-CE2 3.4Å; I402-F406 WeakPolarHBondContact O-CD2 3.31Å; I402-F406 PolarHBondContact O-N 3.42Å; N403-F406 PolarHBondContact O-N 3.39Å; L404-F406 VanDerWaalsContact C-N 3.33Å; L404-F406 PolarHBondContact O-N 2.92Å; F406-L408 VanDerWaalsContact C-N 3.29Å; F406-L408 PolarHBondContact O-N 3.37Å; F406-F409 WeakPolarHBondContact O-CB 3.49Å; F406-F409 PolarHBondContact O-N 2.91Å; F406-F409 VanDerWaalsContact O-N 3.15Å; F406-Y410 VanDerWaalsContact C-CD2 3.4Å; F406-Y410 HydrophobicContact CB-CD2 4.3Å; F406-Y410 HydrophobicContact CB-CE2 3.79Å; F406-Y410 WeakPolarHBondContact O-CD2 3.09Å; F406-Y410 PolarHBondContact O-N 3.02Å
407	I	89.6	Confident	87.3	Confident	5 Å²	5	47 Å²	47	3%	0.026	25%	0.249	C	C	.	.	H	α-helix	trans	-59.7	-40.4	177.8	-68.3	168	0	0	0	111.5	N403 L404 Y410 L411 L442 L443 Q446	N403-I407 WeakPolarHBondContact O-CB 3.31Å; N403-I407 WeakPolarHBondContact O-CG1 3.44Å; N403-I407 PolarHBondContact O-N 3.06Å; L404-I407 PolarHBondContact O-N 2.92Å; I407-Y410 WeakPolarHBondContact O-CB 3.36Å; I407-Y410 PolarHBondContact O-N 2.84Å; I407-L411 PolarHBondContact O-N 3.31Å; I407-L442 HydrophobicContact CD1-CB 4.2Å; I407-L442 HydrophobicContact CG1-CB 4.22Å; I407-L443 HydrophobicContact CG2-CB 4.39Å; I407-L443 HydrophobicContact CG2-CD1 4.08Å; I407-Q446 HydrophobicContact CD1-CB 3.83Å; I407-Q446 HydrophobicContact CD1-CG 4.08Å
408	L	91.7	Very high	88.1	Confident	94 Å²	94	42.1 Å²	42.1	49%	0.492	23%	0.233	S	C	.	.	H	α-helix	trans	-64.7	-41.5	175.3	-70.8	174.4	0	0	0	112.3	L404 C405 F406 Y410 L411 S412	L404-L408 HydrophobicContact CD1-CD1 4.34Å; L404-L408 HydrophobicContact CD1-CG 4.3Å; L404-L408 HydrophobicContact CG-CD1 4.15Å; L404-L408 VanDerWaalsContact O-CG 3.32Å; L404-L408 WeakPolarHBondContact O-CG 3.5Å; L404-L408 PolarHBondContact O-N 3.09Å; C405-L408 PolarHBondContact O-N 3.44Å; F406-L408 VanDerWaalsContact C-N 3.29Å; F406-L408 PolarHBondContact O-N 3.37Å; L408-Y410 VanDerWaalsContact C-N 3.28Å; L408-Y410 PolarHBondContact O-N 3.41Å; L408-L411 PolarHBondContact O-N 2.97Å; L408-S412 PolarHBondContact O-N 2.89Å
409	F	92.4	Very high	88.6	Confident	61 Å²	61	40.1 Å²	40.1	27%	0.268	22%	0.221	S	C	.	.	H	α-helix	trans	-59.7	-41.3	172.4	176.5	-88.1	0	0	0	111.6	L367 V371 C405 F406 S412 E413	L367-F409 HydrophobicContact CD2-CZ 4.47Å; L367-F409 HydrophobicContact CG-CZ 4.42Å; V371-F409 HydrophobicContact CB-CD1 4.23Å; V371-F409 HydrophobicContact CB-CE1 3.75Å; V371-F409 HydrophobicContact CB-CZ 4.09Å; V371-F409 HydrophobicContact CG1-CD1 3.61Å; V371-F409 HydrophobicContact CG1-CE1 3.67Å; V371-F409 HydrophobicContact CG1-CG 4.18Å; V371-F409 HydrophobicContact CG1-CZ 4.27Å; V371-F409 HydrophobicContact CG2-CD1 4.49Å; V371-F409 HydrophobicContact CG2-CE1 3.87Å; V371-F409 HydrophobicContact CG2-CE2 4.12Å; V371-F409 HydrophobicContact CG2-CZ 3.66Å; C405-F409 PolarHBondContact O-N 3.06Å; C405-F409 VanDerWaalsContact O-N 3.08Å; F406-F409 WeakPolarHBondContact O-CB 3.49Å; F406-F409 PolarHBondContact O-N 2.91Å; F406-F409 VanDerWaalsContact O-N 3.15Å; F409-S412 PolarHBondContact O-N 2.65Å; F409-S412 PolarHBondContact O-OG 3.35Å; F409-E413 WeakPolarHBondContact O-CB 3.32Å; F409-E413 PolarHBondContact O-N 3.16Å
410	Y	91.1	Very high	89	Confident	3 Å²	3	39.9 Å²	39.9	1%	0.012	22%	0.22	C	C	.	.	H	α-helix	trans	-69.3	-35.2	179.5	-63.3	-43.6	0	0	0	113.3	V371 N375 F406 I407 L408 M414 R483	V371-Y410 HydrophobicContact CG1-CE1 4.33Å; N375-Y410 WeakPolarHBondContact CB-OH 3.47Å; N375-Y410 PolarHBondContact ND2-OH 2.95Å; F406-Y410 VanDerWaalsContact C-CD2 3.4Å; F406-Y410 HydrophobicContact CB-CD2 4.3Å; F406-Y410 HydrophobicContact CB-CE2 3.79Å; F406-Y410 WeakPolarHBondContact O-CD2 3.09Å; F406-Y410 PolarHBondContact O-N 3.02Å; I407-Y410 WeakPolarHBondContact O-CB 3.36Å; I407-Y410 PolarHBondContact O-N 2.84Å; L408-Y410 VanDerWaalsContact C-N 3.28Å; L408-Y410 PolarHBondContact O-N 3.41Å; Y410-M414 WeakPolarHBondContact O-CB 3.43Å; Y410-M414 PolarHBondContact O-N 3.45Å; Y410-R483 VanDerWaalsContact CB-NH1 3.27Å; Y410-R483 VanDerWaalsContact CE2-NH1 3.27Å; Y410-R483 VanDerWaalsContact CG-NH2 3.32Å
411	L	92.3	Very high	89.4	Confident	58 Å²	58	40.4 Å²	40.4	30%	0.304	22%	0.221	S	C	.	.	H	α-helix	trans	-65.4	-40.9	172.7	-175.8	66.6	0	0	0	111.1	I407 L408 M414 S415 L443	I407-L411 PolarHBondContact O-N 3.31Å; L408-L411 PolarHBondContact O-N 2.97Å; L411-M414 HydrophobicContact CD1-CE 3.91Å; L411-M414 PolarHBondContact O-N 2.97Å; L411-S415 WeakPolarHBondContact O-CB 3.33Å; L411-S415 PolarHBondContact O-N 2.92Å; L411-S415 PolarHBondContact O-OG 3.17Å; L411-L443 HydrophobicContact CD1-CD2 4.31Å
412	S	91.6	Very high	89.5	Confident	59 Å²	59	38.4 Å²	38.4	41%	0.413	21%	0.212	S	C	.	.	H	α-helix	trans	-67.7	-43.1	177.1	75.5	0	0	0	0	111.4	L408 F409 M414 S415 V416	L408-S412 PolarHBondContact O-N 2.89Å; F409-S412 PolarHBondContact O-N 2.65Å; F409-S412 PolarHBondContact O-OG 3.35Å; S412-M414 PolarHBondContact O-N 3.33Å; S412-S415 PolarHBondContact O-N 2.85Å; S412-V416 WeakPolarHBondContact O-CB 3.2Å; S412-V416 VanDerWaalsContact O-CG2 3.3Å; S412-V416 WeakPolarHBondContact O-CG2 3.38Å; S412-V416 PolarHBondContact O-N 3.46Å
413	E	91.8	Very high	89.6	Confident	7 Å²	7	44.5 Å²	44.5	3%	0.033	23%	0.233	C	C	.	.	H	α-helix	trans	-57.1	-47.4	174.2	-168.4	-162.9	160	0	0	111.6	L364 F409 S415 V416 K417 R486	L364-E413 HydrophobicContact CD2-CG 4.1Å; F409-E413 WeakPolarHBondContact O-CB 3.32Å; F409-E413 PolarHBondContact O-N 3.16Å; E413-S415 PolarHBondContact O-N 3.4Å; E413-V416 PolarHBondContact O-N 3.43Å; E413-K417 HydrophobicContact CG-CD 4.5Å; E413-K417 WeakPolarHBondContact O-CG 3.25Å; E413-K417 PolarHBondContact O-N 3.28Å; E413-K417 VanDerWaalsContact OE1-CE 3.23Å; E413-K417 WeakPolarHBondContact OE1-CE 3.49Å; E413-K417 IonicContact OE1-NZ 3.28Å; E413-K417 PolarHBondContact OE1-NZ 2.85Å; E413-R486 IonicContact OE1-CZ 3.94Å; E413-R486 IonicContact OE1-NH1 2.71Å; E413-R486 PolarHBondContact OE1-NH1 2.98Å; E413-R486 IonicContact OE1-NH2 3.09Å; E413-R486 PolarHBondContact OE1-NH2 2.88Å; E413-R486 IonicContact OE2-CZ 3.35Å; E413-R486 IonicContact OE2-NH1 3.42Å; E413-R486 PolarHBondContact OE2-NH1 3.21Å; E413-R486 IonicContact OE2-NH2 2.77Å
414	M	91.7	Very high	89.7	Confident	28 Å²	28	54.4 Å²	54.4	14%	0.138	27%	0.27	C	S	.	.	H	α-helix	trans	-61	-45.3	177.6	-177.3	-179.3	78.2	0	0	111.3	Y410 L411 S412 V416 K417 I418 Y426 T439	Y410-M414 WeakPolarHBondContact O-CB 3.43Å; Y410-M414 PolarHBondContact O-N 3.45Å; L411-M414 HydrophobicContact CD1-CE 3.91Å; L411-M414 PolarHBondContact O-N 2.97Å; S412-M414 PolarHBondContact O-N 3.33Å; M414-V416 VanDerWaalsContact C-N 3.34Å; M414-V416 PolarHBondContact O-N 3.44Å; M414-K417 PolarHBondContact O-N 3.15Å; M414-I418 HydrophobicContact CG-CD1 3.84Å; M414-I418 HydrophobicContact CG-CG1 4.49Å; M414-I418 VanDerWaalsContact O-CG1 3.31Å; M414-I418 WeakPolarHBondContact O-CG1 3.45Å; M414-I418 PolarHBondContact O-N 3.16Å; M414-Y426 HydrophobicContact CG-CE2 4.49Å; M414-T439 PolarHBondContact SD-OG1 3.45Å
415	S	91.8	Very high	89.7	Confident	62 Å²	62	51 Å²	51	43%	0.434	25%	0.254	S	S	.	.	H	α-helix	trans	-61.5	-43.2	179.5	-58	0	0	0	0	111.5	L411 S412 E413 I418 F419	L411-S415 WeakPolarHBondContact O-CB 3.33Å; L411-S415 PolarHBondContact O-N 2.92Å; L411-S415 PolarHBondContact O-OG 3.17Å; S412-S415 PolarHBondContact O-N 2.85Å; E413-S415 PolarHBondContact O-N 3.4Å; S415-I418 PolarHBondContact O-N 2.86Å; S415-F419 WeakPolarHBondContact O-CB 3.29Å; S415-F419 PolarHBondContact O-N 3.37Å
416	V	91.6	Very high	89.6	Confident	31 Å²	31	47.7 Å²	47.7	19%	0.188	23%	0.23	C	C	.	.	H	α-helix	trans	-63	-43.8	176.6	167.9	0	0	0	0	111.6	F359 L364 S412 E413 M414 F419 A420	F359-V416 HydrophobicContact CB-CG1 3.61Å; F359-V416 HydrophobicContact CD1-CG1 3.69Å; F359-V416 HydrophobicContact CD2-CB 4.42Å; F359-V416 HydrophobicContact CD2-CG1 3.49Å; F359-V416 VanDerWaalsContact CD2-CG1 3.49Å; F359-V416 HydrophobicContact CD2-CG2 4.45Å; F359-V416 HydrophobicContact CE1-CG1 4.14Å; F359-V416 HydrophobicContact CE2-CG1 3.9Å; F359-V416 HydrophobicContact CE2-CG2 4.05Å; F359-V416 HydrophobicContact CG-CG1 3.34Å; F359-V416 HydrophobicContact CZ-CG1 4.24Å; F359-V416 HydrophobicContact CZ-CG2 4.17Å; L364-V416 HydrophobicContact CD1-CG1 3.49Å; L364-V416 VanDerWaalsContact CD1-CG1 3.49Å; S412-V416 WeakPolarHBondContact O-CB 3.2Å; S412-V416 VanDerWaalsContact O-CG2 3.3Å; S412-V416 WeakPolarHBondContact O-CG2 3.38Å; S412-V416 PolarHBondContact O-N 3.46Å; E413-V416 PolarHBondContact O-N 3.43Å; M414-V416 VanDerWaalsContact C-N 3.34Å; M414-V416 PolarHBondContact O-N 3.44Å; V416-F419 PolarHBondContact O-N 3.49Å; V416-A420 WeakPolarHBondContact O-CB 3.33Å; V416-A420 PolarHBondContact O-N 3.11Å
417	K	89.3	Confident	89.4	Confident	3 Å²	3	49.6 Å²	49.6	1%	0.013	24%	0.241	C	C	.	.	H	α-helix	trans	-66.1	-40	177.1	-75.6	178.2	170.7	172.8	0	112.7	L364 E413 M414 F419 A420 F421 Y426 R486	L364-K417 HydrophobicContact CD2-CD 4.48Å; L364-K417 HydrophobicContact CD2-CG 3.99Å; E413-K417 HydrophobicContact CG-CD 4.5Å; E413-K417 WeakPolarHBondContact O-CG 3.25Å; E413-K417 PolarHBondContact O-N 3.28Å; E413-K417 VanDerWaalsContact OE1-CE 3.23Å; E413-K417 WeakPolarHBondContact OE1-CE 3.49Å; E413-K417 IonicContact OE1-NZ 3.28Å; E413-K417 PolarHBondContact OE1-NZ 2.85Å; M414-K417 PolarHBondContact O-N 3.15Å; K417-F419 VanDerWaalsContact C-N 3.3Å; K417-A420 PolarHBondContact O-N 3.28Å; K417-F421 HydrophobicContact CB-CD2 4.34Å; K417-F421 HydrophobicContact CG-CE2 4.48Å; K417-F421 VanDerWaalsContact O-CD2 3.31Å; K417-F421 WeakPolarHBondContact O-CD2 3.36Å; K417-F421 PolarHBondContact O-N 2.86Å; K417-Y426 HydrophobicContact CB-CD2 3.8Å; K417-Y426 HydrophobicContact CB-CE2 3.76Å; K417-Y426 HydrophobicContact CD-CE2 4.23Å; K417-R486 VanDerWaalsContact NZ-NH2 3.14Å
418	I	90.9	Very high	89.2	Confident	44 Å²	44	51 Å²	51	23%	0.226	25%	0.252	C	S	.	.	H	α-helix	trans	-63.8	-39.5	175.4	-68.9	168.2	0	0	0	110.3	M414 S415 G422 W423 Y426	M414-I418 HydrophobicContact CG-CD1 3.84Å; M414-I418 HydrophobicContact CG-CG1 4.49Å; M414-I418 VanDerWaalsContact O-CG1 3.31Å; M414-I418 WeakPolarHBondContact O-CG1 3.45Å; M414-I418 PolarHBondContact O-N 3.16Å; S415-I418 PolarHBondContact O-N 2.86Å; I418-G422 CarbonylContact O-C 3.44Å; I418-G422 WeakPolarHBondContact O-CA 3.4Å; I418-G422 PolarHBondContact O-N 2.88Å; I418-W423 HydrophobicContact CD1-CE3 4.5Å; I418-W423 HydrophobicContact CD1-CZ3 4.34Å; I418-W423 HydrophobicContact CG2-CE3 4.45Å; I418-Y426 HydrophobicContact CG1-CD1 4.18Å; I418-Y426 HydrophobicContact CG1-CD2 3.92Å; I418-Y426 HydrophobicContact CG1-CE2 4.3Å; I418-Y426 HydrophobicContact CG1-CG 3.85Å
419	F	89.4	Confident	88.7	Confident	58 Å²	58	50.7 Å²	50.7	25%	0.254	24%	0.244	S	C	.	.	H	α-helix	trans	-64.9	-42.6	174.5	177.3	-91.6	0	0	0	112.3	Y347 L352 L355 F359 S415 V416 K417	Y347-F419 HydrophobicContact CD2-CZ 4.48Å; Y347-F419 HydrophobicContact CE1-CE2 4.02Å; Y347-F419 HydrophobicContact CE1-CZ 4.36Å; Y347-F419 HydrophobicContact CE2-CE1 4.27Å; Y347-F419 HydrophobicContact CE2-CE2 4.31Å; Y347-F419 AromaticContact CE2-CZ 3.98Å; Y347-F419 HydrophobicContact CE2-CZ 3.98Å; Y347-F419 AromaticContact CZ-CE2 3.76Å; Y347-F419 AromaticContact CZ-CZ 3.91Å; Y347-F419 PolarHBondContact OH-O 3.36Å; L352-F419 HydrophobicContact CB-CZ 4.3Å; L352-F419 HydrophobicContact CD2-CE2 4.01Å; L352-F419 HydrophobicContact CD2-CZ 3.59Å; L352-F419 HydrophobicContact CG-CZ 4.46Å; L355-F419 HydrophobicContact CD2-CD1 4.17Å; L355-F419 HydrophobicContact CD2-CE1 3.56Å; L355-F419 HydrophobicContact CD2-CZ 4.14Å; F359-F419 AromaticContact CD2-CD1 3.95Å; F359-F419 HydrophobicContact CD2-CD1 3.95Å; F359-F419 HydrophobicContact CD2-CE1 4.4Å; F359-F419 HydrophobicContact CE2-CD1 4.44Å; S415-F419 WeakPolarHBondContact O-CB 3.29Å; S415-F419 PolarHBondContact O-N 3.37Å; V416-F419 PolarHBondContact O-N 3.49Å; K417-F419 VanDerWaalsContact C-N 3.3Å
420	A	86.9	Confident	88.2	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-69.7	-49.4	-178.2	0	0	0	0	0	113.1	L344 Q356 F359 V416 K417	L344-A420 WeakPolarHBondContact CD2-O 3.4Å; Q356-A420 PolarHBondContact NE2-O 3.33Å; Q356-A420 VanDerWaalsContact NE2-O 3.15Å; F359-A420 HydrophobicContact CB-CB 3.95Å; V416-A420 WeakPolarHBondContact O-CB 3.33Å; V416-A420 PolarHBondContact O-N 3.11Å; K417-A420 PolarHBondContact O-N 3.28Å
421	F	84.7	Confident	87.7	Confident	46 Å²	46	55.8 Å²	55.8	20%	0.202	27%	0.268	C	S	.	.	H	α-helix	trans	-93.2	-13	-174	-61.7	-64.9	0	0	0	114.1	L344 K417 G425	L344-F421 HydrophobicContact CD2-CD1 3.76Å; L344-F421 HydrophobicContact CD2-CE1 4.32Å; K417-F421 HydrophobicContact CB-CD2 4.34Å; K417-F421 HydrophobicContact CG-CE2 4.48Å; K417-F421 VanDerWaalsContact O-CD2 3.31Å; K417-F421 WeakPolarHBondContact O-CD2 3.36Å; K417-F421 PolarHBondContact O-N 2.86Å; F421-G425 WeakPolarHBondContact O-CA 3.33Å
422	G	86.7	Confident	87.4	Confident	15 Å²	15	53.9 Å²	53.9	16%	0.155	26%	0.258	C	S	.	.	H	α-helix	trans	71.5	162.9	-166.7	0	0	0	0	0	112.4	I418 R424 G425 Y426	I418-G422 CarbonylContact O-C 3.44Å; I418-G422 WeakPolarHBondContact O-CA 3.4Å; I418-G422 PolarHBondContact O-N 2.88Å; G422-R424 VanDerWaalsContact C-N 3.32Å; G422-R424 PolarHBondContact O-N 3.42Å; G422-G425 PolarHBondContact O-N 3.47Å; G422-Y426 WeakPolarHBondContact O-CB 3.38Å; G422-Y426 PolarHBondContact O-N 3.33Å
423	W	87.1	Confident	87.2	Confident	169 Å²	169	54.7 Å²	54.7	64%	0.64	26%	0.256	S	S	*	.	H	α-helix	trans	-56.1	-43.5	-178.2	-179.7	-106.9	0	0	0	113.3	I418 L427	I418-W423 HydrophobicContact CD1-CE3 4.5Å; I418-W423 HydrophobicContact CD1-CZ3 4.34Å; I418-W423 HydrophobicContact CG2-CE3 4.45Å; W423-L427 HydrophobicContact CD2-CD1 4.2Å; W423-L427 HydrophobicContact CG-CD1 4.43Å; W423-L427 HydrophobicContact CZ2-CD1 3.88Å; W423-L427 WeakPolarHBondContact O-CG 3.44Å; W423-L427 PolarHBondContact O-N 3.17Å
424	R	86.4	Confident	87	Confident	210 Å²	210	58 Å²	58	79%	0.792	27%	0.271	S	S	*	.	H	α-helix	trans	-71.9	-36.1	179.5	-67.1	-176.3	-178.3	166.4	1.7	112.7	P342 G422 S428	P342-R424 HydrophobicContact CG-CB 4.34Å; G422-R424 VanDerWaalsContact C-N 3.32Å; G422-R424 PolarHBondContact O-N 3.42Å; R424-S428 PolarHBondContact O-N 2.95Å
425	G	86.1	Confident	86.7	Confident	5 Å²	5	56.7 Å²	56.7	5%	0.052	27%	0.265	C	S	.	.	H	α-helix	trans	-67.2	-46.2	175.7	0	0	0	0	0	111.6	F421 G422 L427 S428 Y429	F421-G425 WeakPolarHBondContact O-CA 3.33Å; G422-G425 PolarHBondContact O-N 3.47Å; G425-L427 PolarHBondContact O-N 3.24Å; G425-S428 WeakPolarHBondContact O-CB 3.41Å; G425-S428 PolarHBondContact O-N 3.06Å; G425-Y429 VanDerWaalsContact O-CD2 3.28Å; G425-Y429 WeakPolarHBondContact O-CD2 3.28Å
426	Y	87.6	Confident	86.6	Confident	8 Å²	8	54.1 Å²	54.1	3%	0.031	25%	0.247	C	C	.	.	H	α-helix	trans	-56.9	-49.9	177.4	-175.6	-92.2	0	0	0	112.3	M414 K417 I418 G422 S428 Y429 N432 G436	M414-Y426 HydrophobicContact CG-CE2 4.49Å; K417-Y426 HydrophobicContact CB-CD2 3.8Å; K417-Y426 HydrophobicContact CB-CE2 3.76Å; K417-Y426 HydrophobicContact CD-CE2 4.23Å; I418-Y426 HydrophobicContact CG1-CD1 4.18Å; I418-Y426 HydrophobicContact CG1-CD2 3.92Å; I418-Y426 HydrophobicContact CG1-CE2 4.3Å; I418-Y426 HydrophobicContact CG1-CG 3.85Å; G422-Y426 WeakPolarHBondContact O-CB 3.38Å; G422-Y426 PolarHBondContact O-N 3.33Å; Y426-S428 PolarHBondContact O-N 3.45Å; Y426-Y429 PolarHBondContact O-N 2.84Å; Y426-N432 HydrophobicContact CD2-CB 4.04Å; Y426-N432 HydrophobicContact CE1-CB 4.21Å; Y426-N432 HydrophobicContact CE2-CB 3.72Å; Y426-N432 HydrophobicContact CG-CB 4.43Å; Y426-N432 PolarHBondContact OH-O 2.87Å; Y426-G436 WeakPolarHBondContact OH-CA 3.27Å; Y426-G436 PolarHBondContact OH-N 3.02Å
427	L	87.6	Confident	86.6	Confident	75 Å²	75	59 Å²	59	39%	0.393	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-13.1	178.4	-71	176	0	0	0	114	W423 G425 Y429 I433	W423-L427 HydrophobicContact CD2-CD1 4.2Å; W423-L427 HydrophobicContact CG-CD1 4.43Å; W423-L427 HydrophobicContact CZ2-CD1 3.88Å; W423-L427 WeakPolarHBondContact O-CG 3.44Å; W423-L427 PolarHBondContact O-N 3.17Å; G425-L427 PolarHBondContact O-N 3.24Å; L427-Y429 VanDerWaalsContact C-N 3.35Å; L427-I433 HydrophobicContact CD2-CG1 4.3Å; L427-I433 WeakPolarHBondContact O-CD1 3.46Å
428	S	84.6	Confident	86.6	Confident	35 Å²	35	59.3 Å²	59.3	25%	0.245	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-25.2	176.9	-165.2	0	0	0	0	112.7	H341 R424 G425 Y426	H341-S428 WeakPolarHBondContact ND1-CB 3.37Å; H341-S428 PolarHBondContact ND1-OG 3.43Å; R424-S428 PolarHBondContact O-N 2.95Å; G425-S428 WeakPolarHBondContact O-CB 3.41Å; G425-S428 PolarHBondContact O-N 3.06Å; Y426-S428 PolarHBondContact O-N 3.45Å
429	Y	81.9	Confident	86.5	Confident	87 Å²	87	57.5 Å²	57.5	34%	0.341	26%	0.259	S	S	.	.			trans	-92.8	117.5	-179.1	-68.7	-82.5	0	0	0	111.1	H341 G425 Y426 L427 S431 N432 I433	H341-Y429 AromaticContact CD2-CE1 3.87Å; H341-Y429 AromaticContact CD2-CZ 3.88Å; H341-Y429 AromaticContact CE1-CD1 3.88Å; H341-Y429 AromaticContact CE1-CE1 3.74Å; H341-Y429 AromaticContact CG-CZ 3.91Å; H341-Y429 AromaticContact NE2-CE1 3.54Å; G425-Y429 VanDerWaalsContact O-CD2 3.28Å; G425-Y429 WeakPolarHBondContact O-CD2 3.28Å; Y426-Y429 PolarHBondContact O-N 2.84Å; L427-Y429 VanDerWaalsContact C-N 3.35Å; Y429-S431 VanDerWaalsContact C-N 3.32Å; Y429-S431 PolarHBondContact O-N 3.33Å; Y429-N432 WeakPolarHBondContact CB-ND2 3.36Å; Y429-N432 PolarHBondContact O-N 3.07Å; Y429-I433 WeakPolarHBondContact O-CG1 3.39Å; Y429-I433 PolarHBondContact O-N 2.82Å
430	R	80.4	Confident	86.6	Confident	135 Å²	135	58 Å²	58	51%	0.509	27%	0.267	S	S	.	.	H	α-helix	trans	-61.4	-35.7	-179.5	-72.3	-168.2	176.2	125.8	-8.4	113.9	N432 I433 F434	R430-N432 VanDerWaalsContact C-N 3.33Å; R430-I433 PolarHBondContact O-N 3.31Å; R430-F434 PolarHBondContact O-N 3.49Å
431	S	81	Confident	86.8	Confident	37 Å²	37	60.2 Å²	60.2	26%	0.259	28%	0.28	S	S	.	.	H	α-helix	trans	-62.8	-42.4	176.9	-172.7	0	0	0	0	111.1	Y429 F434 D435	Y429-S431 VanDerWaalsContact C-N 3.32Å; Y429-S431 PolarHBondContact O-N 3.33Å; S431-F434 PolarHBondContact O-N 3.28Å; S431-D435 WeakPolarHBondContact O-CB 3.41Å; S431-D435 PolarHBondContact O-N 3.48Å
432	N	86.1	Confident	87	Confident	18 Å²	18	58 Å²	58	10%	0.096	27%	0.271	C	S	.	.	H	α-helix	trans	-68.4	-38.7	176.4	-69.2	-22	0	0	0	112	Y426 Y429 R430 F434 D435 G436	Y426-N432 HydrophobicContact CD2-CB 4.04Å; Y426-N432 HydrophobicContact CE1-CB 4.21Å; Y426-N432 HydrophobicContact CE2-CB 3.72Å; Y426-N432 HydrophobicContact CG-CB 4.43Å; Y426-N432 PolarHBondContact OH-O 2.87Å; Y429-N432 WeakPolarHBondContact CB-ND2 3.36Å; Y429-N432 PolarHBondContact O-N 3.07Å; R430-N432 VanDerWaalsContact C-N 3.33Å; N432-F434 VanDerWaalsContact C-N 3.33Å; N432-F434 PolarHBondContact O-N 2.82Å; N432-D435 PolarHBondContact O-N 3.05Å; N432-G436 PolarHBondContact O-N 3.39Å
433	I	88	Confident	87.2	Confident	75 Å²	75	59.8 Å²	59.8	39%	0.385	28%	0.276	S	S	.	.	H	α-helix	trans	-59.4	-44.6	174.2	-65	162.9	0	0	0	111.1	L427 Y429 R430 F437	L427-I433 HydrophobicContact CD2-CG1 4.3Å; L427-I433 WeakPolarHBondContact O-CD1 3.46Å; Y429-I433 WeakPolarHBondContact O-CG1 3.39Å; Y429-I433 PolarHBondContact O-N 2.82Å; R430-I433 PolarHBondContact O-N 3.31Å; I433-F437 VanDerWaalsContact O-CB 3.28Å; I433-F437 WeakPolarHBondContact O-CB 3.48Å; I433-F437 PolarHBondContact O-N 2.98Å
434	F	86.8	Confident	87.3	Confident	78 Å²	78	56.9 Å²	56.9	34%	0.342	27%	0.272	S	S	.	.	H	α-helix	trans	-63.9	-48	178.5	174.5	-103.7	0	0	0	111.8	R430 S431 N432 F437 L438 L485	R430-F434 PolarHBondContact O-N 3.49Å; S431-F434 PolarHBondContact O-N 3.28Å; N432-F434 VanDerWaalsContact C-N 3.33Å; N432-F434 PolarHBondContact O-N 2.82Å; F434-F437 PolarHBondContact O-N 3.09Å; F434-L438 HydrophobicContact CD1-CD1 4.14Å; F434-L438 HydrophobicContact CE1-CD1 3.49Å; F434-L438 VanDerWaalsContact CE1-CD1 3.49Å; F434-L438 HydrophobicContact CE1-CG 4.49Å; F434-L438 HydrophobicContact CE2-CD1 4.02Å; F434-L438 HydrophobicContact CE2-CG 4.36Å; F434-L438 HydrophobicContact CZ-CD1 3.43Å; F434-L438 VanDerWaalsContact CZ-CD1 3.43Å; F434-L438 HydrophobicContact CZ-CG 4.25Å; F434-L438 PolarHBondContact O-N 3.19Å; F434-L485 HydrophobicContact CE1-CB 4.24Å; F434-L485 HydrophobicContact CZ-CB 4.22Å; F434-L485 HydrophobicContact CZ-CD1 4.41Å
435	D	86.6	Confident	87.3	Confident	0 Å²	0	48 Å²	48	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-63.4	-44.9	179	-171.2	52.5	0	0	0	111.8	S431 N432 F437 L438 T439 R483 R486	S431-D435 WeakPolarHBondContact O-CB 3.41Å; S431-D435 PolarHBondContact O-N 3.48Å; N432-D435 PolarHBondContact O-N 3.05Å; D435-F437 PolarHBondContact O-N 3.05Å; D435-L438 PolarHBondContact O-N 3.35Å; D435-T439 WeakPolarHBondContact O-CG2 3.5Å; D435-T439 PolarHBondContact O-N 2.8Å; D435-R483 IonicContact OD1-CZ 3.04Å; D435-R483 VanDerWaalsContact OD1-CZ 3.23Å; D435-R483 IonicContact OD1-NE 3.16Å; D435-R483 PolarHBondContact OD1-NE 3.47Å; D435-R483 IonicContact OD1-NH2 2.69Å; D435-R483 PolarHBondContact OD1-NH2 2.99Å; D435-R483 IonicContact OD2-NH2 2.73Å; D435-R486 IonicContact OD1-NH1 2.72Å; D435-R486 IonicContact OD2-CZ 3.94Å; D435-R486 IonicContact OD2-NH1 3.98Å; D435-R486 PolarHBondContact OD2-NH1 3.49Å
436	G	89.5	Confident	87.2	Confident	7 Å²	7	48.3 Å²	48.3	7%	0.072	24%	0.24	C	C	.	.	H	α-helix	trans	-65.5	-34.8	176.2	0	0	0	0	0	113.6	Y426 N432 T439 V440	Y426-G436 WeakPolarHBondContact OH-CA 3.27Å; Y426-G436 PolarHBondContact OH-N 3.02Å; N432-G436 PolarHBondContact O-N 3.39Å; G436-T439 WeakPolarHBondContact CA-OG1 3.3Å; G436-T439 PolarHBondContact O-OG1 2.95Å; G436-V440 VanDerWaalsContact O-CG2 3.25Å; G436-V440 WeakPolarHBondContact O-CG2 3.43Å; G436-V440 PolarHBondContact O-N 3.22Å; G436-V440 VanDerWaalsContact O-N 3.16Å
437	F	90.7	Very high	87.2	Confident	133 Å²	133	52 Å²	52	58%	0.583	26%	0.26	S	S	*	.	H	α-helix	trans	-64.3	-47.2	172.1	174.6	-100.2	0	0	0	111.1	I433 F434 D435 T439 V440 V441	I433-F437 VanDerWaalsContact O-CB 3.28Å; I433-F437 WeakPolarHBondContact O-CB 3.48Å; I433-F437 PolarHBondContact O-N 2.98Å; F434-F437 PolarHBondContact O-N 3.09Å; D435-F437 PolarHBondContact O-N 3.05Å; F437-T439 PolarHBondContact O-N 2.82Å; F437-V440 PolarHBondContact O-N 2.61Å; F437-V441 HydrophobicContact CD1-CG2 4.46Å; F437-V441 HydrophobicContact CD2-CG2 4.46Å; F437-V441 HydrophobicContact CE1-CG2 4.03Å; F437-V441 HydrophobicContact CE2-CG2 4.03Å; F437-V441 HydrophobicContact CZ-CG2 3.8Å; F437-V441 WeakPolarHBondContact O-CG2 3.21Å; F437-V441 PolarHBondContact O-N 3.28Å
438	L	89	Confident	87	Confident	10 Å²	10	50.1 Å²	50.1	5%	0.052	26%	0.255	C	S	.	.	H	α-helix	trans	-63.3	-39.8	177.2	-73.3	179.1	0	0	0	112.4	F434 D435 V440 V441 L442 R483	F434-L438 HydrophobicContact CD1-CD1 4.14Å; F434-L438 HydrophobicContact CE1-CD1 3.49Å; F434-L438 VanDerWaalsContact CE1-CD1 3.49Å; F434-L438 HydrophobicContact CE1-CG 4.49Å; F434-L438 HydrophobicContact CE2-CD1 4.02Å; F434-L438 HydrophobicContact CE2-CG 4.36Å; F434-L438 HydrophobicContact CZ-CD1 3.43Å; F434-L438 VanDerWaalsContact CZ-CD1 3.43Å; F434-L438 HydrophobicContact CZ-CG 4.25Å; F434-L438 PolarHBondContact O-N 3.19Å; D435-L438 PolarHBondContact O-N 3.35Å; L438-V440 VanDerWaalsContact C-N 3.35Å; L438-V440 PolarHBondContact O-N 3.25Å; L438-V441 PolarHBondContact O-N 3.26Å; L438-L442 WeakPolarHBondContact O-CB 3.2Å; L438-L442 VanDerWaalsContact O-CG 3.23Å; L438-L442 WeakPolarHBondContact O-CG 3.42Å; L438-L442 PolarHBondContact O-N 3.05Å; L438-R483 HydrophobicContact CD1-CB 4.22Å; L438-R483 HydrophobicContact CD1-CG 4.23Å
439	T	90.3	Very high	86.8	Confident	7 Å²	7	48.6 Å²	48.6	4%	0.043	24%	0.244	C	C	.	.	H	α-helix	trans	-61.5	-43.2	177	61.8	0	0	0	0	112	M414 D435 G436 F437 L442 L443	M414-T439 PolarHBondContact SD-OG1 3.45Å; D435-T439 WeakPolarHBondContact O-CG2 3.5Å; D435-T439 PolarHBondContact O-N 2.8Å; G436-T439 WeakPolarHBondContact CA-OG1 3.3Å; G436-T439 PolarHBondContact O-OG1 2.95Å; F437-T439 PolarHBondContact O-N 2.82Å; T439-L442 PolarHBondContact O-N 3.06Å; T439-L443 VanDerWaalsContact O-CB 3.3Å; T439-L443 WeakPolarHBondContact O-CB 3.36Å; T439-L443 PolarHBondContact O-N 3.49Å
440	V	91.5	Very high	86.7	Confident	69 Å²	69	48.7 Å²	48.7	42%	0.418	25%	0.246	S	C	.	.	H	α-helix	trans	-66.4	-44.2	179.7	171.3	0	0	0	0	110.8	G436 F437 L438 L443 I444	G436-V440 VanDerWaalsContact O-CG2 3.25Å; G436-V440 WeakPolarHBondContact O-CG2 3.43Å; G436-V440 PolarHBondContact O-N 3.22Å; G436-V440 VanDerWaalsContact O-N 3.16Å; F437-V440 PolarHBondContact O-N 2.61Å; L438-V440 VanDerWaalsContact C-N 3.35Å; L438-V440 PolarHBondContact O-N 3.25Å; V440-L443 PolarHBondContact O-N 3.12Å; V440-I444 HydrophobicContact CG1-CD1 3.81Å; V440-I444 HydrophobicContact CG1-CG1 4.48Å; V440-I444 VanDerWaalsContact O-CG1 3.27Å; V440-I444 WeakPolarHBondContact O-CG1 3.28Å; V440-I444 PolarHBondContact O-N 2.65Å
441	V	90.4	Very high	86.7	Confident	45 Å²	45	46.6 Å²	46.6	27%	0.273	24%	0.244	S	C	.	.	H	α-helix	trans	-62.9	-45.1	176.8	175	0	0	0	0	111.1	F437 L438 L443 I444 L445 L479	F437-V441 HydrophobicContact CD1-CG2 4.46Å; F437-V441 HydrophobicContact CD2-CG2 4.46Å; F437-V441 HydrophobicContact CE1-CG2 4.03Å; F437-V441 HydrophobicContact CE2-CG2 4.03Å; F437-V441 HydrophobicContact CZ-CG2 3.8Å; F437-V441 WeakPolarHBondContact O-CG2 3.21Å; F437-V441 PolarHBondContact O-N 3.28Å; L438-V441 PolarHBondContact O-N 3.26Å; V441-L443 VanDerWaalsContact C-N 3.34Å; V441-L443 PolarHBondContact O-N 2.89Å; V441-I444 PolarHBondContact O-N 3.14Å; V441-L445 WeakPolarHBondContact O-CB 3.37Å; V441-L445 PolarHBondContact O-N 2.96Å; V441-L479 HydrophobicContact CG1-CD1 3.72Å
442	L	89.2	Confident	86.3	Confident	1 Å²	1	48 Å²	48	1%	0.005	25%	0.252	C	S	.	.	H	α-helix	trans	-61.3	-41.4	176.6	-74.6	170	0	0	0	111.9	I407 L438 T439 L445 Q446 V476 L479 I480	I407-L442 HydrophobicContact CD1-CB 4.2Å; I407-L442 HydrophobicContact CG1-CB 4.22Å; L438-L442 WeakPolarHBondContact O-CB 3.2Å; L438-L442 VanDerWaalsContact O-CG 3.23Å; L438-L442 WeakPolarHBondContact O-CG 3.42Å; L438-L442 PolarHBondContact O-N 3.05Å; T439-L442 PolarHBondContact O-N 3.06Å; L442-L445 PolarHBondContact O-N 3.39Å; L442-Q446 WeakPolarHBondContact O-CB 3.41Å; L442-Q446 PolarHBondContact O-N 3.42Å; L442-V476 HydrophobicContact CD2-CG1 4.13Å; L442-L479 HydrophobicContact CD2-CB 3.62Å; L442-L479 HydrophobicContact CD2-CD1 4.31Å; L442-L479 HydrophobicContact CG-CB 4.39Å; L442-I480 HydrophobicContact CD1-CG1 4.34Å; L442-I480 HydrophobicContact CD2-CG1 3.93Å
443	L	90	Very high	85.6	Confident	51 Å²	51	51.2 Å²	51.2	27%	0.267	26%	0.263	S	S	.	.	H	α-helix	trans	-64	-47.2	177.2	-178	69.6	0	0	0	111.6	I407 L411 T439 V440 V441 L445 Q446 I447	I407-L443 HydrophobicContact CG2-CB 4.39Å; I407-L443 HydrophobicContact CG2-CD1 4.08Å; L411-L443 HydrophobicContact CD1-CD2 4.31Å; T439-L443 VanDerWaalsContact O-CB 3.3Å; T439-L443 WeakPolarHBondContact O-CB 3.36Å; T439-L443 PolarHBondContact O-N 3.49Å; V440-L443 PolarHBondContact O-N 3.12Å; V441-L443 VanDerWaalsContact C-N 3.34Å; V441-L443 PolarHBondContact O-N 2.89Å; L443-L445 VanDerWaalsContact C-N 3.29Å; L443-L445 PolarHBondContact O-N 3.36Å; L443-Q446 PolarHBondContact O-N 2.91Å; L443-I447 HydrophobicContact CD1-CD1 4.14Å; L443-I447 HydrophobicContact CD1-CG1 4.48Å; L443-I447 HydrophobicContact CG-CD1 3.87Å; L443-I447 WeakPolarHBondContact O-CB 3.3Å; L443-I447 VanDerWaalsContact O-CG1 3.27Å; L443-I447 WeakPolarHBondContact O-CG1 3.43Å; L443-I447 PolarHBondContact O-N 3.18Å
444	I	89.4	Confident	84.7	Confident	109 Å²	109	53.8 Å²	53.8	56%	0.559	27%	0.268	S	S	*	.	H	α-helix	trans	-58.6	-45	177.7	-70.1	165.9	0	0	0	110.2	V440 V441 I447 A448	V440-I444 HydrophobicContact CG1-CD1 3.81Å; V440-I444 HydrophobicContact CG1-CG1 4.48Å; V440-I444 VanDerWaalsContact O-CG1 3.27Å; V440-I444 WeakPolarHBondContact O-CG1 3.28Å; V440-I444 PolarHBondContact O-N 2.65Å; V441-I444 PolarHBondContact O-N 3.14Å; I444-I447 PolarHBondContact O-N 3.17Å; I444-A448 WeakPolarHBondContact O-CB 3.47Å; I444-A448 PolarHBondContact O-N 3.26Å
445	L	86.6	Confident	83.2	Confident	22 Å²	22	55.4 Å²	55.4	12%	0.115	28%	0.279	C	S	.	.	H	α-helix	trans	-66	-41.3	179.8	-171.8	60.9	0	0	0	112	V441 L442 L443 A448 I449 M472 L475 V476 L479	V441-L445 WeakPolarHBondContact O-CB 3.37Å; V441-L445 PolarHBondContact O-N 2.96Å; L442-L445 PolarHBondContact O-N 3.39Å; L443-L445 VanDerWaalsContact C-N 3.29Å; L443-L445 PolarHBondContact O-N 3.36Å; L445-A448 WeakPolarHBondContact O-CB 3.46Å; L445-A448 PolarHBondContact O-N 3.38Å; L445-I449 HydrophobicContact CG-CD1 4.36Å; L445-I449 VanDerWaalsContact O-CG1 3.29Å; L445-I449 WeakPolarHBondContact O-CG1 3.17Å; L445-I449 PolarHBondContact O-N 3.03Å; L445-M472 HydrophobicContact CD1-SD 3.91Å; L445-L475 HydrophobicContact CD1-CD2 4.35Å; L445-L475 HydrophobicContact CD2-CB 4.45Å; L445-L475 HydrophobicContact CD2-CD2 3.26Å; L445-L475 HydrophobicContact CD2-CG 4.44Å; L445-L475 HydrophobicContact CG-CD2 4.46Å; L445-V476 HydrophobicContact CB-CG2 4.34Å; L445-V476 HydrophobicContact CD2-CB 4.11Å; L445-V476 HydrophobicContact CD2-CG2 3.26Å; L445-V476 HydrophobicContact CG-CG2 3.53Å; L445-L479 HydrophobicContact CD2-CD1 4.01Å
446	Q	84.7	Confident	81.7	Confident	12 Å²	12	59.3 Å²	59.3	6%	0.056	31%	0.305	C	S	.	.	H	α-helix	trans	-65.2	-40.8	176.3	-171.4	64.7	28.2	0	0	112.1	L404 I407 L442 L443 A448 I449 F450	L404-Q446 HydrophobicContact CD1-CG 4.1Å; I407-Q446 HydrophobicContact CD1-CB 3.83Å; I407-Q446 HydrophobicContact CD1-CG 4.08Å; L442-Q446 WeakPolarHBondContact O-CB 3.41Å; L442-Q446 PolarHBondContact O-N 3.42Å; L443-Q446 PolarHBondContact O-N 2.91Å; Q446-A448 VanDerWaalsContact C-N 3.35Å; Q446-I449 PolarHBondContact O-N 3.46Å; Q446-F450 WeakPolarHBondContact O-CB 3.48Å; Q446-F450 PolarHBondContact O-N 3.35Å
447	I	86.1	Confident	79.7	Confident	85 Å²	85	70 Å²	70	44%	0.436	35%	0.345	S	S	.	.	H	α-helix	trans	-63.8	-42.5	174.2	-68.5	168.3	0	0	0	110.2	L443 I444 I449 F450 I451	L443-I447 HydrophobicContact CD1-CD1 4.14Å; L443-I447 HydrophobicContact CD1-CG1 4.48Å; L443-I447 HydrophobicContact CG-CD1 3.87Å; L443-I447 WeakPolarHBondContact O-CB 3.3Å; L443-I447 VanDerWaalsContact O-CG1 3.27Å; L443-I447 WeakPolarHBondContact O-CG1 3.43Å; L443-I447 PolarHBondContact O-N 3.18Å; I444-I447 PolarHBondContact O-N 3.17Å; I447-I449 VanDerWaalsContact C-N 3.34Å; I447-I449 PolarHBondContact O-N 2.7Å; I447-F450 PolarHBondContact O-N 2.65Å; I447-I451 HydrophobicContact CG2-CD1 3.6Å; I447-I451 HydrophobicContact CG2-CG1 4.26Å; I447-I451 VanDerWaalsContact O-CG1 3.29Å; I447-I451 WeakPolarHBondContact O-CG1 3.3Å; I447-I451 PolarHBondContact O-N 3.31Å
448	A	84.2	Confident	77.3	Confident	36 Å²	36	68 Å²	68	30%	0.298	35%	0.347	S	S	.	.	H	α-helix	trans	-61.5	-41.2	176.8	0	0	0	0	0	112	I444 L445 Q446 T452	I444-A448 WeakPolarHBondContact O-CB 3.47Å; I444-A448 PolarHBondContact O-N 3.26Å; L445-A448 WeakPolarHBondContact O-CB 3.46Å; L445-A448 PolarHBondContact O-N 3.38Å; Q446-A448 VanDerWaalsContact C-N 3.35Å; A448-T452 VanDerWaalsContact O-CB 3.29Å; A448-T452 WeakPolarHBondContact O-CB 3.4Å; A448-T452 PolarHBondContact O-N 3.27Å; A448-T452 PolarHBondContact O-OG1 3.1Å
449	I	79.7	Confident	75	Confident	3 Å²	3	76.4 Å²	76.4	2%	0.015	39%	0.386	C	S	.	.	H	α-helix	trans	-61.9	-49.1	174	-69.3	165.2	0	0	0	110.3	L445 Q446 I447 I451 T452 Y453 M472 V473 V476	L445-I449 HydrophobicContact CG-CD1 4.36Å; L445-I449 VanDerWaalsContact O-CG1 3.29Å; L445-I449 WeakPolarHBondContact O-CG1 3.17Å; L445-I449 PolarHBondContact O-N 3.03Å; Q446-I449 PolarHBondContact O-N 3.46Å; I447-I449 VanDerWaalsContact C-N 3.34Å; I447-I449 PolarHBondContact O-N 2.7Å; I449-I451 PolarHBondContact O-N 2.97Å; I449-T452 PolarHBondContact O-N 3.24Å; I449-Y453 HydrophobicContact CG2-CD2 4.07Å; I449-Y453 WeakPolarHBondContact O-CB 3.49Å; I449-Y453 WeakPolarHBondContact O-CD2 3.29Å; I449-Y453 PolarHBondContact O-N 3.36Å; I449-M472 HydrophobicContact CD1-CB 4.06Å; I449-M472 HydrophobicContact CG1-CB 3.87Å; I449-V473 HydrophobicContact CD1-CG2 4.41Å; I449-V476 HydrophobicContact CD1-CG2 3.55Å
450	F	80.1	Confident	72.7	Confident	89 Å²	89	83.3 Å²	83.3	39%	0.39	42%	0.418	S	S	.	.	H	α-helix	trans	-59.9	-43.9	-179.8	-174.9	-89.8	0	0	0	112.4	Q446 I447 R454 L455	Q446-F450 WeakPolarHBondContact O-CB 3.48Å; Q446-F450 PolarHBondContact O-N 3.35Å; I447-F450 PolarHBondContact O-N 2.65Å; F450-R454 HydrophobicContact CD2-CB 4.41Å; F450-R454 HydrophobicContact CE2-CG 4.48Å; F450-R454 VanDerWaalsContact O-CB 3.24Å; F450-R454 WeakPolarHBondContact O-CB 3.29Å; F450-R454 PolarHBondContact O-N 2.89Å; F450-L455 HydrophobicContact CD1-CD1 4.26Å; F450-L455 HydrophobicContact CE1-CD1 4.24Å; F450-L455 HydrophobicContact CE1-CG 4.5Å; F450-L455 PolarHBondContact O-N 3.16Å
451	I	80	Confident	70.6	Confident	91 Å²	91	87 Å²	87	47%	0.467	44%	0.443	S	S	.	.	H	α-helix	trans	-66.6	-44.3	177.9	-66.3	169.1	0	0	0	111.5	I447 I449 L455	I447-I451 HydrophobicContact CG2-CD1 3.6Å; I447-I451 HydrophobicContact CG2-CG1 4.26Å; I447-I451 VanDerWaalsContact O-CG1 3.29Å; I447-I451 WeakPolarHBondContact O-CG1 3.3Å; I447-I451 PolarHBondContact O-N 3.31Å; I449-I451 PolarHBondContact O-N 2.97Å; I451-L455 HydrophobicContact CB-CD1 4.22Å; I451-L455 HydrophobicContact CG1-CD1 3.85Å; I451-L455 HydrophobicContact CG2-CD1 4.37Å; I451-L455 WeakPolarHBondContact O-CB 3.5Å
452	T	74.4	Confident	68.4	Low	67 Å²	67	88.8 Å²	88.8	41%	0.411	46%	0.458	S	S	.	.	H	α-helix	trans	-73	-36.7	-173.7	-51.9	0	0	0	0	112	A448 I449	A448-T452 VanDerWaalsContact O-CB 3.29Å; A448-T452 WeakPolarHBondContact O-CB 3.4Å; A448-T452 PolarHBondContact O-N 3.27Å; A448-T452 PolarHBondContact O-OG1 3.1Å; I449-T452 PolarHBondContact O-N 3.24Å
453	Y	71	Confident	66.3	Low	85 Å²	85	93.8 Å²	93.8	33%	0.333	49%	0.493	S	S	.	.	H	α-helix	trans	-109.1	-18.2	-168.5	-65.1	-69.6	0	0	0	115.3	I449 M467 L469	I449-Y453 HydrophobicContact CG2-CD2 4.07Å; I449-Y453 WeakPolarHBondContact O-CB 3.49Å; I449-Y453 WeakPolarHBondContact O-CD2 3.29Å; I449-Y453 PolarHBondContact O-N 3.36Å; Y453-M467 PolarHBondContact OH-O 3.41Å; Y453-M467 VanDerWaalsContact OH-O 3.12Å; Y453-L469 HydrophobicContact CD1-CB 3.94Å; Y453-L469 HydrophobicContact CD1-CD1 3.58Å; Y453-L469 HydrophobicContact CD1-CG 4.02Å; Y453-L469 HydrophobicContact CD2-CB 4.22Å; Y453-L469 HydrophobicContact CD2-CD1 4.05Å; Y453-L469 HydrophobicContact CD2-CG 3.89Å; Y453-L469 HydrophobicContact CE1-CB 3.51Å; Y453-L469 HydrophobicContact CE1-CD1 4.08Å; Y453-L469 HydrophobicContact CE1-CG 4.09Å; Y453-L469 HydrophobicContact CE2-CB 3.83Å; Y453-L469 HydrophobicContact CE2-CG 3.97Å; Y453-L469 HydrophobicContact CG-CB 4.28Å; Y453-L469 HydrophobicContact CG-CD1 3.57Å; Y453-L469 HydrophobicContact CG-CG 3.93Å; Y453-L469 VanDerWaalsContact CZ-CB 3.47Å; Y453-L469 VanDerWaalsContact OH-CA 3.28Å; Y453-L469 WeakPolarHBondContact OH-CA 3.29Å; Y453-L469 PolarHBondContact OH-N 3.38Å
454	R	68.4	Low	64.2	Low	129 Å²	129	103 Å²	103	49%	0.487	52%	0.524	S	S	.	.	H	α-helix	trans	-114.8	-25.8	-175.7	-152.4	-173.6	-118.8	-155.4	5.4	114.2	F450	F450-R454 HydrophobicContact CD2-CB 4.41Å; F450-R454 HydrophobicContact CE2-CG 4.48Å; F450-R454 VanDerWaalsContact O-CB 3.24Å; F450-R454 WeakPolarHBondContact O-CB 3.29Å; F450-R454 PolarHBondContact O-N 2.89Å
455	L	56.3	Low	62.4	Low	112 Å²	112	99.9 Å²	99.9	59%	0.586	52%	0.519	S	S	*	.	S	Bend	trans	-80.3	-30.9	-176.5	-97.7	157.2	0	0	0	115.1	F450 I451 Y457	F450-L455 HydrophobicContact CD1-CD1 4.26Å; F450-L455 HydrophobicContact CE1-CD1 4.24Å; F450-L455 HydrophobicContact CE1-CG 4.5Å; F450-L455 PolarHBondContact O-N 3.16Å; I451-L455 HydrophobicContact CB-CD1 4.22Å; I451-L455 HydrophobicContact CG1-CD1 3.85Å; I451-L455 HydrophobicContact CG2-CD1 4.37Å; I451-L455 WeakPolarHBondContact O-CB 3.5Å; L455-Y457 PolarHBondContact O-N 3.47Å
456	P	53.9	Low	60.9	Low	83 Å²	83	106.5 Å²	106.5	54%	0.539	56%	0.56	S	S	.	*			trans	-85.2	97.7	168.6	28.7	-24.9	0	0	0	110.3	S458	P456-S458 PolarHBondContact O-N 3.05Å
457	Y	47.9	Very low	59.6	Low	231 Å²	231	108.4 Å²	108.4	91%	0.906	57%	0.57	S	S	*	*			trans	-77.6	5	173.7	-168.6	-102.6	0	0	0	113.2	L455	L455-Y457 PolarHBondContact O-N 3.47Å
458	S	40.3	Very low	58.8	Low	91 Å²	91	107 Å²	107	64%	0.636	57%	0.567	S	S	*	*	S	Bend	trans	-144	123.7	-177.3	63.6	0	0	0	0	113.8	P456	P456-S458 PolarHBondContact O-N 3.05Å
459	Q	41.6	Very low	58	Low	187 Å²	187	107.9 Å²	107.9	87%	0.874	57%	0.567	S	S	*	*	S	Bend	trans	79.5	121.1	153.7	-78.6	172.5	-22.5	0	0	120.2
460	E	41.7	Very low	57.3	Low	152 Å²	152	110.8 Å²	110.8	71%	0.71	58%	0.578	S	S	*	*			trans	67	116.8	160.9	-61	-158.1	177.4	0	0	120.2	S462	E460-S462 PolarHBondContact O-N 3.48Å
461	P	47.7	Very low	56.9	Low	146 Å²	146	109.6 Å²	109.6	95%	0.948	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.8	21.1	-179.4	34.7	-35.2	0	0	0	113.9
462	S	43.3	Very low	56.5	Low	82 Å²	82	107.5 Å²	107.5	57%	0.573	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.2	-11.2	-167	57.5	0	0	0	0	114.7	E460 R464	E460-S462 PolarHBondContact O-N 3.48Å; S462-R464 PolarHBondContact O-N 2.83Å
463	S	44.1	Very low	56.4	Low	107 Å²	107	104.6 Å²	104.6	75%	0.748	54%	0.544	S	S	*	.	S	Bend	trans	-82.8	88.8	173.8	66.4	0	0	0	0	110.5	G465	S463-G465 PolarHBondContact O-N 2.68Å
464	R	47.5	Very low	56.6	Low	243 Å²	243	105.1 Å²	105.1	92%	0.917	55%	0.546	S	S	*	.			trans	-42.1	99.8	172.1	-67.6	174.8	173.2	166.7	-2.7	111.6	S462	S462-R464 PolarHBondContact O-N 2.83Å
465	G	51.1	Low	57	Low	44 Å²	44	102.1 Å²	102.1	45%	0.454	54%	0.539	S	S	.	.			trans	-54.4	148.2	147	0	0	0	0	0	108.1	S463 M467	S463-G465 PolarHBondContact O-N 2.68Å; G465-M467 PolarHBondContact O-N 3.05Å
466	V	54.2	Low	58.2	Low	162 Å²	162	96.8 Å²	96.8	98%	0.982	51%	0.511	S	S	*	.	S	Bend	trans	-54.9	-18.5	-177.9	-174.6	0	0	0	0	112.2
467	M	59.2	Low	59.4	Low	51 Å²	51	93.2 Å²	93.2	25%	0.251	49%	0.488	S	S	.	.	S	Bend	trans	-147.7	137	-178.7	-165.9	165	177.2	0	0	110	Y453 G465 E471 M472 L475	Y453-M467 PolarHBondContact OH-O 3.41Å; Y453-M467 VanDerWaalsContact OH-O 3.12Å; G465-M467 PolarHBondContact O-N 3.05Å; M467-E471 HydrophobicContact CE-CB 3.64Å; M467-E471 WeakPolarHBondContact CE-O 3.35Å; M467-E471 HydrophobicContact CG-CB 3.41Å; M467-E471 VanDerWaalsContact CG-CB 3.41Å; M467-E471 HydrophobicContact CG-CG 4.4Å; M467-E471 HydrophobicContact SD-CB 4.38Å; M467-M472 HydrophobicContact CB-CE 3.96Å; M467-M472 HydrophobicContact CB-CG 4.37Å; M467-M472 HydrophobicContact CB-SD 4.22Å; M467-M472 HydrophobicContact CG-CG 4.27Å; M467-M472 HydrophobicContact CG-SD 4.18Å; M467-M472 HydrophobicContact SD-SD 3.88Å; M467-L475 HydrophobicContact CE-CB 4.17Å; M467-L475 HydrophobicContact CE-CD1 3.77Å
468	S	67.9	Low	61	Low	55 Å²	55	87.3 Å²	87.3	39%	0.385	47%	0.469	S	S	.	.			trans	-69.3	160.9	-178.1	64	0	0	0	0	113.1	W470 E471 M472	S468-W470 PolarHBondContact O-N 3.27Å; S468-E471 WeakPolarHBondContact CB-OE2 3.14Å; S468-E471 PolarHBondContact N-OE2 3.3Å; S468-E471 PolarHBondContact O-N 3.35Å; S468-E471 VanDerWaalsContact O-N 3.08Å; S468-E471 WeakPolarHBondContact OG-CB 3.37Å; S468-E471 WeakPolarHBondContact OG-CG 3.25Å; S468-E471 PolarHBondContact OG-N 3.02Å; S468-E471 PolarHBondContact OG-OE2 3.28Å; S468-M472 PolarHBondContact O-N 3.41Å
469	L	67.5	Low	63	Low	55 Å²	55	84.5 Å²	84.5	29%	0.288	45%	0.447	S	S	.	.	H	α-helix	trans	-54.7	-46.3	-178.4	-172.2	159.6	0	0	0	110.1	N396 Y453 E471 M472 V473	N396-L469 HydrophobicContact CB-CD2 4.38Å; Y453-L469 HydrophobicContact CD1-CB 3.94Å; Y453-L469 HydrophobicContact CD1-CD1 3.58Å; Y453-L469 HydrophobicContact CD1-CG 4.02Å; Y453-L469 HydrophobicContact CD2-CB 4.22Å; Y453-L469 HydrophobicContact CD2-CD1 4.05Å; Y453-L469 HydrophobicContact CD2-CG 3.89Å; Y453-L469 HydrophobicContact CE1-CB 3.51Å; Y453-L469 HydrophobicContact CE1-CD1 4.08Å; Y453-L469 HydrophobicContact CE1-CG 4.09Å; Y453-L469 HydrophobicContact CE2-CB 3.83Å; Y453-L469 HydrophobicContact CE2-CG 3.97Å; Y453-L469 HydrophobicContact CG-CB 4.28Å; Y453-L469 HydrophobicContact CG-CD1 3.57Å; Y453-L469 HydrophobicContact CG-CG 3.93Å; Y453-L469 VanDerWaalsContact CZ-CB 3.47Å; Y453-L469 VanDerWaalsContact OH-CA 3.28Å; Y453-L469 WeakPolarHBondContact OH-CA 3.29Å; Y453-L469 PolarHBondContact OH-N 3.38Å; L469-E471 PolarHBondContact O-N 3.19Å; L469-M472 PolarHBondContact O-N 3.49Å; L469-V473 HydrophobicContact CD2-CG2 3.77Å; L469-V473 WeakPolarHBondContact O-CG2 3.46Å; L469-V473 PolarHBondContact O-N 3.4Å
470	W	66.2	Low	64.9	Low	64 Å²	64	75.7 Å²	75.7	24%	0.242	41%	0.406	C	S	.	.	H	α-helix	trans	-63.8	-40.4	-179.7	-176.1	80.4	0	0	0	112.6	T391 S468 V473 R474	T391-W470 HydrophobicContact CG2-CB 4.23Å; T391-W470 HydrophobicContact CG2-CD2 4.27Å; T391-W470 HydrophobicContact CG2-CG 3.92Å; S468-W470 PolarHBondContact O-N 3.27Å; W470-V473 PolarHBondContact O-N 2.93Å; W470-R474 WeakPolarHBondContact O-CB 3.34Å; W470-R474 PolarHBondContact O-N 3.33Å
471	E	70.4	Confident	66.8	Low	65 Å²	65	71.8 Å²	71.8	30%	0.304	39%	0.392	S	S	.	.	H	α-helix	trans	-66	-39.8	175.9	-72.3	171.2	141.3	0	0	111.7	M467 S468 L469 R474 L475	M467-E471 HydrophobicContact CE-CB 3.64Å; M467-E471 WeakPolarHBondContact CE-O 3.35Å; M467-E471 HydrophobicContact CG-CB 3.41Å; M467-E471 VanDerWaalsContact CG-CB 3.41Å; M467-E471 HydrophobicContact CG-CG 4.4Å; M467-E471 HydrophobicContact SD-CB 4.38Å; S468-E471 WeakPolarHBondContact CB-OE2 3.14Å; S468-E471 PolarHBondContact N-OE2 3.3Å; S468-E471 PolarHBondContact O-N 3.35Å; S468-E471 VanDerWaalsContact O-N 3.08Å; S468-E471 WeakPolarHBondContact OG-CB 3.37Å; S468-E471 WeakPolarHBondContact OG-CG 3.25Å; S468-E471 PolarHBondContact OG-N 3.02Å; S468-E471 PolarHBondContact OG-OE2 3.28Å; L469-E471 PolarHBondContact O-N 3.19Å; E471-R474 WeakPolarHBondContact O-CB 3.4Å; E471-R474 PolarHBondContact O-N 3.03Å; E471-L475 WeakPolarHBondContact O-CB 3.36Å; E471-L475 PolarHBondContact O-N 3.35Å
472	M	72.7	Confident	68.5	Low	47 Å²	47	70.3 Å²	70.3	23%	0.232	37%	0.371	C	S	.	.	H	α-helix	trans	-64.1	-45.9	174.4	-69.5	-65.9	-156.2	0	0	111.7	L445 I449 M467 S468 L469 R474 L475 V476	L445-M472 HydrophobicContact CD1-SD 3.91Å; I449-M472 HydrophobicContact CD1-CB 4.06Å; I449-M472 HydrophobicContact CG1-CB 3.87Å; M467-M472 HydrophobicContact CB-CE 3.96Å; M467-M472 HydrophobicContact CB-CG 4.37Å; M467-M472 HydrophobicContact CB-SD 4.22Å; M467-M472 HydrophobicContact CG-CG 4.27Å; M467-M472 HydrophobicContact CG-SD 4.18Å; M467-M472 HydrophobicContact SD-SD 3.88Å; S468-M472 PolarHBondContact O-N 3.41Å; L469-M472 PolarHBondContact O-N 3.49Å; M472-R474 VanDerWaalsContact C-N 3.34Å; M472-R474 PolarHBondContact O-N 3.46Å; M472-L475 WeakPolarHBondContact O-CB 3.43Å; M472-L475 PolarHBondContact O-N 2.88Å; M472-V476 WeakPolarHBondContact O-CG2 3.45Å; M472-V476 PolarHBondContact O-N 3.01Å
473	V	72.1	Confident	70.3	Confident	6 Å²	6	66.6 Å²	66.6	4%	0.036	34%	0.344	C	S	.	.	H	α-helix	trans	-63.4	-39.6	175.4	170.2	0	0	0	0	111.2	L399 I449 L469 W470 L475 V476 N477	L399-V473 HydrophobicContact CD2-CG1 3.73Å; L399-V473 HydrophobicContact CG-CG1 4.32Å; I449-V473 HydrophobicContact CD1-CG2 4.41Å; L469-V473 HydrophobicContact CD2-CG2 3.77Å; L469-V473 WeakPolarHBondContact O-CG2 3.46Å; L469-V473 PolarHBondContact O-N 3.4Å; W470-V473 PolarHBondContact O-N 2.93Å; V473-L475 VanDerWaalsContact C-N 3.32Å; V473-L475 PolarHBondContact O-N 3.22Å; V473-V476 WeakPolarHBondContact O-CB 3.49Å; V473-V476 PolarHBondContact O-N 3.29Å; V473-N477 PolarHBondContact O-N 3.06Å; V473-N477 PolarHBondContact O-ND2 3.46Å; V473-N477 PolarHBondContact O-OD1 2.9Å
474	R	74.4	Confident	72	Confident	96 Å²	96	65.5 Å²	65.5	36%	0.362	33%	0.327	S	S	.	.	H	α-helix	trans	-60.5	-41.9	173.1	-178	-179.1	67.8	-173.9	-1.2	111.2	W470 E471 M472 N477 M478	W470-R474 WeakPolarHBondContact O-CB 3.34Å; W470-R474 PolarHBondContact O-N 3.33Å; E471-R474 WeakPolarHBondContact O-CB 3.4Å; E471-R474 PolarHBondContact O-N 3.03Å; M472-R474 VanDerWaalsContact C-N 3.34Å; M472-R474 PolarHBondContact O-N 3.46Å; R474-N477 PolarHBondContact O-N 2.9Å; R474-M478 HydrophobicContact CG-CE 3.97Å; R474-M478 WeakPolarHBondContact O-CG 3.42Å; R474-M478 PolarHBondContact O-N 3.38Å
475	L	77.5	Confident	73.7	Confident	65 Å²	65	57.6 Å²	57.6	34%	0.34	30%	0.302	S	S	.	.	H	α-helix	trans	-66.1	-41.7	177.2	-166.2	149.2	0	0	0	111.5	L445 M467 E471 M472 V473 N477 M478 L479	L445-L475 HydrophobicContact CD1-CD2 4.35Å; L445-L475 HydrophobicContact CD2-CB 4.45Å; L445-L475 HydrophobicContact CD2-CD2 3.26Å; L445-L475 HydrophobicContact CD2-CG 4.44Å; L445-L475 HydrophobicContact CG-CD2 4.46Å; M467-L475 HydrophobicContact CE-CB 4.17Å; M467-L475 HydrophobicContact CE-CD1 3.77Å; E471-L475 WeakPolarHBondContact O-CB 3.36Å; E471-L475 PolarHBondContact O-N 3.35Å; M472-L475 WeakPolarHBondContact O-CB 3.43Å; M472-L475 PolarHBondContact O-N 2.88Å; V473-L475 VanDerWaalsContact C-N 3.32Å; V473-L475 PolarHBondContact O-N 3.22Å; L475-N477 PolarHBondContact O-N 2.87Å; L475-M478 PolarHBondContact O-N 2.98Å; L475-L479 HydrophobicContact CD2-CD1 3.62Å; L475-L479 HydrophobicContact CD2-CG 4.15Å; L475-L479 WeakPolarHBondContact O-CG 3.19Å; L475-L479 PolarHBondContact O-N 3.49Å
476	V	80.4	Confident	75.2	Confident	1 Å²	1	55.8 Å²	55.8	1%	0.006	28%	0.281	C	S	.	.	H	α-helix	trans	-55.6	-51.3	170.6	174.6	0	0	0	0	110.2	L442 L445 I449 M472 V473 M478 L479 I480	L442-V476 HydrophobicContact CD2-CG1 4.13Å; L445-V476 HydrophobicContact CB-CG2 4.34Å; L445-V476 HydrophobicContact CD2-CB 4.11Å; L445-V476 HydrophobicContact CD2-CG2 3.26Å; L445-V476 HydrophobicContact CG-CG2 3.53Å; I449-V476 HydrophobicContact CD1-CG2 3.55Å; M472-V476 WeakPolarHBondContact O-CG2 3.45Å; M472-V476 PolarHBondContact O-N 3.01Å; V473-V476 WeakPolarHBondContact O-CB 3.49Å; V473-V476 PolarHBondContact O-N 3.29Å; V476-M478 VanDerWaalsContact C-N 3.34Å; V476-M478 PolarHBondContact O-N 2.97Å; V476-L479 WeakPolarHBondContact O-CB 3.29Å; V476-L479 PolarHBondContact O-N 2.83Å; V476-L479 VanDerWaalsContact O-N 3.12Å; V476-I480 HydrophobicContact CG1-CD1 3.78Å; V476-I480 HydrophobicContact CG1-CG1 4.31Å; V476-I480 WeakPolarHBondContact O-CG1 3.23Å; V476-I480 PolarHBondContact O-N 3.18Å
477	N	79.6	Confident	76.4	Confident	8 Å²	8	49.4 Å²	49.4	4%	0.043	24%	0.242	C	C	.	.	H	α-helix	trans	-62.4	-40.5	-177.8	-63.6	-23.5	0	0	0	111.9	I379 N403 V473 R474 L475 L479 I480 V481	I379-N477 HydrophobicContact CG2-CB 4.4Å; N403-N477 PolarHBondContact ND2-OD1 2.93Å; V473-N477 PolarHBondContact O-N 3.06Å; V473-N477 PolarHBondContact O-ND2 3.46Å; V473-N477 PolarHBondContact O-OD1 2.9Å; R474-N477 PolarHBondContact O-N 2.9Å; L475-N477 PolarHBondContact O-N 2.87Å; N477-L479 PolarHBondContact O-N 2.91Å; N477-I480 PolarHBondContact O-N 2.68Å; N477-V481 WeakPolarHBondContact O-CG2 3.38Å; N477-V481 PolarHBondContact O-N 3.11Å
478	M	81.1	Confident	77.4	Confident	107 Å²	107	48.7 Å²	48.7	53%	0.527	24%	0.238	S	C	.	.	H	α-helix	trans	-60.4	-44.3	173.5	-74.1	178.3	175.3	0	0	111.6	R474 L475 V476 I480 V481 F482	R474-M478 HydrophobicContact CG-CE 3.97Å; R474-M478 WeakPolarHBondContact O-CG 3.42Å; R474-M478 PolarHBondContact O-N 3.38Å; L475-M478 PolarHBondContact O-N 2.98Å; V476-M478 VanDerWaalsContact C-N 3.34Å; V476-M478 PolarHBondContact O-N 2.97Å; M478-I480 VanDerWaalsContact C-N 3.33Å; M478-I480 PolarHBondContact O-N 3.2Å; M478-V481 PolarHBondContact O-N 3.21Å; M478-F482 WeakPolarHBondContact O-CD2 3.35Å; M478-F482 PolarHBondContact O-N 3.4Å
479	L	83.3	Confident	77.7	Confident	32 Å²	32	48 Å²	48	17%	0.168	23%	0.233	C	C	.	.	H	α-helix	trans	-65.1	-34.1	176.2	-70.6	177	0	0	0	112.9	V441 L442 L445 L475 V476 N477 F482 R483	V441-L479 HydrophobicContact CG1-CD1 3.72Å; L442-L479 HydrophobicContact CD2-CB 3.62Å; L442-L479 HydrophobicContact CD2-CD1 4.31Å; L442-L479 HydrophobicContact CG-CB 4.39Å; L445-L479 HydrophobicContact CD2-CD1 4.01Å; L475-L479 HydrophobicContact CD2-CD1 3.62Å; L475-L479 HydrophobicContact CD2-CG 4.15Å; L475-L479 WeakPolarHBondContact O-CG 3.19Å; L475-L479 PolarHBondContact O-N 3.49Å; V476-L479 WeakPolarHBondContact O-CB 3.29Å; V476-L479 PolarHBondContact O-N 2.83Å; V476-L479 VanDerWaalsContact O-N 3.12Å; N477-L479 PolarHBondContact O-N 2.91Å; L479-F482 HydrophobicContact CD2-CD2 4.39Å; L479-F482 WeakPolarHBondContact O-CB 3.31Å; L479-F482 PolarHBondContact O-N 3.21Å; L479-R483 PolarHBondContact O-N 3.44Å
480	I	81.2	Confident	78	Confident	2 Å²	2	49 Å²	49	1%	0.01	24%	0.239	C	C	.	.	H	α-helix	trans	-65.9	-41.4	173.1	-64.5	168.2	0	0	0	110.5	N375 I379 N403 L442 V476 N477 M478 F482 R483	N375-I480 VanDerWaalsContact ND2-CG2 3.26Å; N375-I480 WeakPolarHBondContact ND2-CG2 3.28Å; I379-I480 HydrophobicContact CD1-CB 3.6Å; I379-I480 HydrophobicContact CD1-CD1 3.68Å; I379-I480 HydrophobicContact CD1-CG1 4.24Å; I379-I480 HydrophobicContact CD1-CG2 3.31Å; N403-I480 WeakPolarHBondContact OD1-CD1 3.23Å; L442-I480 HydrophobicContact CD1-CG1 4.34Å; L442-I480 HydrophobicContact CD2-CG1 3.93Å; V476-I480 HydrophobicContact CG1-CD1 3.78Å; V476-I480 HydrophobicContact CG1-CG1 4.31Å; V476-I480 WeakPolarHBondContact O-CG1 3.23Å; V476-I480 PolarHBondContact O-N 3.18Å; N477-I480 PolarHBondContact O-N 2.68Å; M478-I480 VanDerWaalsContact C-N 3.33Å; M478-I480 PolarHBondContact O-N 3.2Å; I480-F482 VanDerWaalsContact C-N 3.33Å; I480-F482 PolarHBondContact O-N 3.39Å; I480-R483 WeakPolarHBondContact O-CB 3.35Å; I480-R483 PolarHBondContact O-N 2.98Å
481	V	81.7	Confident	78.6	Confident	69 Å²	69	50.2 Å²	50.2	42%	0.418	25%	0.248	S	C	.	.	H	α-helix	trans	-61.4	-41.4	174.4	174.6	0	0	0	0	111	N477 M478 R483 F484	N477-V481 WeakPolarHBondContact O-CG2 3.38Å; N477-V481 PolarHBondContact O-N 3.11Å; M478-V481 PolarHBondContact O-N 3.21Å; V481-R483 PolarHBondContact O-N 3.24Å; V481-R483 VanDerWaalsContact O-N 3.13Å; V481-F484 WeakPolarHBondContact O-CB 3.48Å; V481-F484 PolarHBondContact O-N 3.06Å
482	F	82.4	Confident	78.8	Confident	116 Å²	116	53 Å²	53	51%	0.509	26%	0.26	S	S	.	.	H	α-helix	trans	-58.5	-25.8	174.1	-80.3	-65	0	0	0	113.3	M478 L479 I480 F484 L485	M478-F482 WeakPolarHBondContact O-CD2 3.35Å; M478-F482 PolarHBondContact O-N 3.4Å; L479-F482 HydrophobicContact CD2-CD2 4.39Å; L479-F482 WeakPolarHBondContact O-CB 3.31Å; L479-F482 PolarHBondContact O-N 3.21Å; I480-F482 VanDerWaalsContact C-N 3.33Å; I480-F482 PolarHBondContact O-N 3.39Å; F482-F484 VanDerWaalsContact C-N 3.25Å; F482-F484 PolarHBondContact O-N 2.78Å; F482-L485 HydrophobicContact CD1-CD1 4.03Å; F482-L485 VanDerWaalsContact O-CB 3.23Å; F482-L485 WeakPolarHBondContact O-CB 3.26Å; F482-L485 WeakPolarHBondContact O-CG 3.35Å; F482-L485 PolarHBondContact O-N 3.35Å
483	R	81.1	Confident	78.9	Confident	3 Å²	3	55.6 Å²	55.6	1%	0.011	27%	0.274	C	S	.	.	H	α-helix	trans	-67.5	-25.3	177.4	-160.2	179	-169.3	146.9	-5.2	113.6	Y410 D435 L438 L479 I480 V481 L485 R486	Y410-R483 VanDerWaalsContact CB-NH1 3.27Å; Y410-R483 VanDerWaalsContact CE2-NH1 3.27Å; Y410-R483 VanDerWaalsContact CG-NH2 3.32Å; D435-R483 IonicContact OD1-CZ 3.04Å; D435-R483 VanDerWaalsContact OD1-CZ 3.23Å; D435-R483 IonicContact OD1-NE 3.16Å; D435-R483 PolarHBondContact OD1-NE 3.47Å; D435-R483 IonicContact OD1-NH2 2.69Å; D435-R483 PolarHBondContact OD1-NH2 2.99Å; D435-R483 IonicContact OD2-NH2 2.73Å; L438-R483 HydrophobicContact CD1-CB 4.22Å; L438-R483 HydrophobicContact CD1-CG 4.23Å; L479-R483 PolarHBondContact O-N 3.44Å; I480-R483 WeakPolarHBondContact O-CB 3.35Å; I480-R483 PolarHBondContact O-N 2.98Å; V481-R483 PolarHBondContact O-N 3.24Å; V481-R483 VanDerWaalsContact O-N 3.13Å; R483-L485 PolarHBondContact O-N 3.03Å; R483-R486 VanDerWaalsContact O-CB 3.28Å; R483-R486 WeakPolarHBondContact O-CB 3.44Å; R483-R486 PolarHBondContact O-N 2.73Å
484	F	80.9	Confident	79.1	Confident	85 Å²	85	59.5 Å²	59.5	37%	0.373	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-53.7	-27.9	172.5	-178.3	-104.8	0	0	0	112.4	L373 V376 V481 F482 R486 I487	L373-F484 HydrophobicContact CD1-CE2 4.11Å; V376-F484 HydrophobicContact CG2-CB 4.01Å; V376-F484 HydrophobicContact CG2-CD2 4.19Å; V376-F484 HydrophobicContact CG2-CG 4.48Å; V481-F484 WeakPolarHBondContact O-CB 3.48Å; V481-F484 PolarHBondContact O-N 3.06Å; F482-F484 VanDerWaalsContact C-N 3.25Å; F482-F484 PolarHBondContact O-N 2.78Å; F484-R486 PolarHBondContact O-N 3.05Å; F484-I487 HydrophobicContact CD2-CD1 3.74Å; F484-I487 HydrophobicContact CE2-CD1 3.64Å; F484-I487 PolarHBondContact O-N 2.84Å
485	L	82.8	Confident	79.1	Confident	76 Å²	76	55.4 Å²	55.4	40%	0.398	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-58.9	-17.7	175.9	-59.8	176.9	0	0	0	113.3	F434 F482 R483 I487 I488 P489	F434-L485 HydrophobicContact CE1-CB 4.24Å; F434-L485 HydrophobicContact CZ-CB 4.22Å; F434-L485 HydrophobicContact CZ-CD1 4.41Å; F482-L485 HydrophobicContact CD1-CD1 4.03Å; F482-L485 VanDerWaalsContact O-CB 3.23Å; F482-L485 WeakPolarHBondContact O-CB 3.26Å; F482-L485 WeakPolarHBondContact O-CG 3.35Å; F482-L485 PolarHBondContact O-N 3.35Å; R483-L485 PolarHBondContact O-N 3.03Å; L485-I487 PolarHBondContact O-N 3.11Å; L485-I488 HydrophobicContact CB-CD1 4.2Å; L485-I488 HydrophobicContact CD2-CD1 3.39Å; L485-I488 HydrophobicContact CG-CD1 4.4Å; L485-I488 WeakPolarHBondContact O-CB 3.23Å; L485-I488 PolarHBondContact O-N 2.86Å; L485-P489 WeakPolarHBondContact O-CD 3.24Å
486	R	81.7	Confident	79	Confident	6 Å²	6	53 Å²	53	2%	0.023	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-61.8	-24.1	172.4	175.7	177	159.9	-174.8	-10.7	113.2	N369 E413 K417 D435 R483 F484 I488 P489	N369-R486 PolarHBondContact OD1-NE 3.27Å; E413-R486 IonicContact OE1-CZ 3.94Å; E413-R486 IonicContact OE1-NH1 2.71Å; E413-R486 PolarHBondContact OE1-NH1 2.98Å; E413-R486 IonicContact OE1-NH2 3.09Å; E413-R486 PolarHBondContact OE1-NH2 2.88Å; E413-R486 IonicContact OE2-CZ 3.35Å; E413-R486 IonicContact OE2-NH1 3.42Å; E413-R486 PolarHBondContact OE2-NH1 3.21Å; E413-R486 IonicContact OE2-NH2 2.77Å; K417-R486 VanDerWaalsContact NZ-NH2 3.14Å; D435-R486 IonicContact OD1-NH1 2.72Å; D435-R486 IonicContact OD2-CZ 3.94Å; D435-R486 IonicContact OD2-NH1 3.98Å; D435-R486 PolarHBondContact OD2-NH1 3.49Å; R483-R486 VanDerWaalsContact O-CB 3.28Å; R483-R486 WeakPolarHBondContact O-CB 3.44Å; R483-R486 PolarHBondContact O-N 2.73Å; F484-R486 PolarHBondContact O-N 3.05Å; R486-I488 VanDerWaalsContact C-N 3.33Å; R486-P489 VanDerWaalsContact O-CD 3.26Å; R486-P489 WeakPolarHBondContact O-CD 3.41Å
487	I	81.4	Confident	79	Confident	29 Å²	29	55.2 Å²	55.2	15%	0.149	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-75.8	-25.4	178.9	-60.6	176.8	0	0	0	111.2	F484 L485 D490 I491	F484-I487 HydrophobicContact CD2-CD1 3.74Å; F484-I487 HydrophobicContact CE2-CD1 3.64Å; F484-I487 PolarHBondContact O-N 2.84Å; L485-I487 PolarHBondContact O-N 3.11Å; I487-D490 PolarHBondContact O-N 3.26Å; I487-D490 VanDerWaalsContact O-N 3.15Å; I487-I491 HydrophobicContact CG2-CD1 4.12Å
488	I	79.1	Confident	79	Confident	35 Å²	35	56.4 Å²	56.4	18%	0.179	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-56.4	-47.1	-175.2	-68.3	175.9	0	0	0	113.1	L485 R486 D490 I491 M494 A495 A498	L485-I488 HydrophobicContact CB-CD1 4.2Å; L485-I488 HydrophobicContact CD2-CD1 3.39Å; L485-I488 HydrophobicContact CG-CD1 4.4Å; L485-I488 WeakPolarHBondContact O-CB 3.23Å; L485-I488 PolarHBondContact O-N 2.86Å; R486-I488 VanDerWaalsContact C-N 3.33Å; I488-D490 PolarHBondContact O-N 3.21Å; I488-I491 PolarHBondContact O-N 3.23Å; I488-M494 HydrophobicContact CG1-CE 4.43Å; I488-M494 HydrophobicContact CG2-CB 4.07Å; I488-A495 PolarHBondContact O-N 3.2Å; I488-A498 HydrophobicContact CG2-CB 3.62Å
489	P	75.3	Confident	78.6	Confident	42 Å²	42	52.3 Å²	52.3	27%	0.273	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-65.6	-19.1	-179.6	-23.3	36.1	0	0	0	115.3	L485 R486 R649	L485-P489 WeakPolarHBondContact O-CD 3.24Å; R486-P489 VanDerWaalsContact O-CD 3.26Å; R486-P489 WeakPolarHBondContact O-CD 3.41Å; P489-R649 PolarHBondContact O-NH2 2.93Å
490	D	73.4	Confident	78.2	Confident	76 Å²	76	51.3 Å²	51.3	41%	0.406	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-84.7	-25.6	-177.2	-63.7	-22.2	0	0	0	111.7	N369 I487 I488	N369-D490 PolarHBondContact ND2-OD2 3.19Å; I487-D490 PolarHBondContact O-N 3.26Å; I487-D490 VanDerWaalsContact O-N 3.15Å; I488-D490 PolarHBondContact O-N 3.21Å
491	I	79.1	Confident	78.2	Confident	88 Å²	88	55.6 Å²	55.6	45%	0.451	29%	0.291	S	S	.	.	S	Bend	trans	-89.5	114.4	174.7	-59	172.2	0	0	0	108.8	I487 I488 L493 M494 A495	I487-I491 HydrophobicContact CG2-CD1 4.12Å; I488-I491 PolarHBondContact O-N 3.23Å; I491-L493 VanDerWaalsContact C-N 3.34Å; I491-L493 PolarHBondContact O-N 3.39Å; I491-M494 HydrophobicContact CB-CB 4.07Å; I491-M494 HydrophobicContact CB-CG 4.26Å; I491-M494 HydrophobicContact CG2-CB 4.16Å; I491-M494 HydrophobicContact CG2-CG 3.97Å; I491-M494 PolarHBondContact O-N 3.14Å; I491-M494 VanDerWaalsContact O-N 3.09Å; I491-A495 WeakPolarHBondContact O-CB 3.46Å; I491-A495 PolarHBondContact O-N 3.28Å
492	K	73.4	Confident	78	Confident	124 Å²	124	58 Å²	58	54%	0.539	30%	0.301	S	S	.	.	H	α-helix	trans	-49.1	-48.7	-175.2	-64.2	-179	-171.9	171.3	0	114	A495 L496 V642	K492-A495 PolarHBondContact O-N 3Å; K492-L496 PolarHBondContact O-N 3.03Å; K492-V642 HydrophobicContact CD-CG1 4.47Å
493	L	75.6	Confident	77.5	Confident	101 Å²	101	53 Å²	53	53%	0.529	28%	0.28	S	S	.	.	H	α-helix	trans	-64.7	-45.3	-179	-171.8	73	0	0	0	111.8	I491 L496 V497 W634	I491-L493 VanDerWaalsContact C-N 3.34Å; I491-L493 PolarHBondContact O-N 3.39Å; L493-L496 WeakPolarHBondContact O-CB 3.38Å; L493-L496 PolarHBondContact O-N 3.43Å; L493-V497 WeakPolarHBondContact O-CG2 3.34Å; L493-V497 PolarHBondContact O-N 3.41Å; L493-W634 HydrophobicContact CD1-CH2 3.88Å; L493-W634 HydrophobicContact CD1-CZ3 3.71Å
494	M	75.4	Confident	77.3	Confident	89 Å²	89	53.4 Å²	53.4	44%	0.438	28%	0.282	S	S	.	.	H	α-helix	trans	-70.4	-35.7	-179.8	-68.4	-66.4	-78.6	0	0	111.8	I488 I491 L496 V497 A498	I488-M494 HydrophobicContact CG1-CE 4.43Å; I488-M494 HydrophobicContact CG2-CB 4.07Å; I491-M494 HydrophobicContact CB-CB 4.07Å; I491-M494 HydrophobicContact CB-CG 4.26Å; I491-M494 HydrophobicContact CG2-CB 4.16Å; I491-M494 HydrophobicContact CG2-CG 3.97Å; I491-M494 PolarHBondContact O-N 3.14Å; I491-M494 VanDerWaalsContact O-N 3.09Å; M494-L496 VanDerWaalsContact C-N 3.34Å; M494-V497 PolarHBondContact O-N 3.47Å; M494-A498 VanDerWaalsContact O-CB 3.29Å; M494-A498 WeakPolarHBondContact O-CB 3.26Å; M494-A498 PolarHBondContact O-N 3.43Å
495	A	75.9	Confident	77	Confident	10 Å²	10	54.3 Å²	54.3	8%	0.083	29%	0.294	C	S	.	.	H	α-helix	trans	-63.6	-40	173	0	0	0	0	0	111.6	I488 I491 K492 S499	I488-A495 PolarHBondContact O-N 3.2Å; I491-A495 WeakPolarHBondContact O-CB 3.46Å; I491-A495 PolarHBondContact O-N 3.28Å; K492-A495 PolarHBondContact O-N 3Å; A495-S499 WeakPolarHBondContact O-CB 3.46Å; A495-S499 PolarHBondContact O-N 3.5Å; A495-S499 PolarHBondContact O-OG 3.16Å
496	L	75	Confident	76.5	Confident	13 Å²	13	55 Å²	55	7%	0.068	29%	0.294	C	S	.	.	H	α-helix	trans	-59.6	-55.6	173	-179.8	65.8	0	0	0	109.8	K492 L493 M494 A498 S499 T500 W634 S637	K492-L496 PolarHBondContact O-N 3.03Å; L493-L496 WeakPolarHBondContact O-CB 3.38Å; L493-L496 PolarHBondContact O-N 3.43Å; M494-L496 VanDerWaalsContact C-N 3.34Å; L496-A498 PolarHBondContact O-N 3.07Å; L496-S499 PolarHBondContact O-N 2.95Å; L496-S499 PolarHBondContact O-OG 3.17Å; L496-T500 HydrophobicContact CD1-CG2 4.2Å; L496-T500 HydrophobicContact CG-CG2 4.26Å; L496-T500 WeakPolarHBondContact O-CG2 3.48Å; L496-T500 PolarHBondContact O-N 3.24Å; L496-W634 HydrophobicContact CD2-CE3 3.92Å; L496-W634 HydrophobicContact CD2-CZ3 4.22Å; L496-S637 VanDerWaalsContact CD2-OG 3.29Å; L496-S637 WeakPolarHBondContact CD2-OG 3.46Å
497	V	79.9	Confident	75.9	Confident	49 Å²	49	56.5 Å²	56.5	30%	0.297	30%	0.302	S	S	.	.	H	α-helix	trans	-58.2	-46.5	179.4	176.3	0	0	0	0	112.1	L493 M494 S499 T500 L501 F630	L493-V497 WeakPolarHBondContact O-CG2 3.34Å; L493-V497 PolarHBondContact O-N 3.41Å; M494-V497 PolarHBondContact O-N 3.47Å; V497-S499 VanDerWaalsContact C-N 3.33Å; V497-S499 PolarHBondContact O-N 3.23Å; V497-T500 PolarHBondContact O-N 3.4Å; V497-T500 PolarHBondContact O-OG1 3.47Å; V497-L501 HydrophobicContact CG1-CD1 4.14Å; V497-L501 WeakPolarHBondContact O-CG 3.4Å; V497-L501 PolarHBondContact O-N 2.98Å; V497-F630 HydrophobicContact CG2-CE2 4.44Å
498	A	78.6	Confident	75.7	Confident	32 Å²	32	55.7 Å²	55.7	26%	0.264	30%	0.298	S	S	.	.	H	α-helix	trans	-64	-39.7	179	0	0	0	0	0	111.9	I488 M494 L496 L501 L502	I488-A498 HydrophobicContact CG2-CB 3.62Å; M494-A498 VanDerWaalsContact O-CB 3.29Å; M494-A498 WeakPolarHBondContact O-CB 3.26Å; M494-A498 PolarHBondContact O-N 3.43Å; L496-A498 PolarHBondContact O-N 3.07Å; A498-L501 PolarHBondContact O-N 2.88Å; A498-L502 WeakPolarHBondContact O-CG 3.27Å; A498-L502 PolarHBondContact O-N 3.31Å
499	S	73.6	Confident	75.8	Confident	22 Å²	22	62.8 Å²	62.8	15%	0.154	32%	0.323	C	S	.	.	H	α-helix	trans	-69.5	-33.6	176.2	77.8	0	0	0	0	112.7	A495 L496 V497 D503 K633	A495-S499 WeakPolarHBondContact O-CB 3.46Å; A495-S499 PolarHBondContact O-N 3.5Å; A495-S499 PolarHBondContact O-OG 3.16Å; L496-S499 PolarHBondContact O-N 2.95Å; L496-S499 PolarHBondContact O-OG 3.17Å; V497-S499 VanDerWaalsContact C-N 3.33Å; V497-S499 PolarHBondContact O-N 3.23Å; S499-D503 WeakPolarHBondContact O-CB 3.43Å; S499-D503 PolarHBondContact O-N 3.43Å; S499-D503 VanDerWaalsContact O-N 3.11Å; S499-K633 PolarHBondContact O-NZ 3.39Å
500	T	75.7	Confident	76.1	Confident	11 Å²	11	61 Å²	61	7%	0.067	31%	0.311	C	S	.	.	H	α-helix	trans	-65.8	-45.9	175.2	68.9	0	0	0	0	109.9	L496 V497 D503 L504 F630 K633	L496-T500 HydrophobicContact CD1-CG2 4.2Å; L496-T500 HydrophobicContact CG-CG2 4.26Å; L496-T500 WeakPolarHBondContact O-CG2 3.48Å; L496-T500 PolarHBondContact O-N 3.24Å; V497-T500 PolarHBondContact O-N 3.4Å; V497-T500 PolarHBondContact O-OG1 3.47Å; T500-D503 PolarHBondContact O-N 2.79Å; T500-L504 WeakPolarHBondContact O-CB 3.46Å; T500-L504 PolarHBondContact O-N 3.4Å; T500-F630 HydrophobicContact CG2-CD2 4.46Å; T500-K633 HydrophobicContact CG2-CB 3.75Å; T500-K633 HydrophobicContact CG2-CD 3.27Å; T500-K633 HydrophobicContact CG2-CG 4.15Å
501	L	79.4	Confident	76.6	Confident	91 Å²	91	57.9 Å²	57.9	48%	0.476	29%	0.294	S	S	.	.	H	α-helix	trans	-62.9	-44.4	177	-68.4	175.1	0	0	0	112.9	V497 A498 L504 V505	V497-L501 HydrophobicContact CG1-CD1 4.14Å; V497-L501 WeakPolarHBondContact O-CG 3.4Å; V497-L501 PolarHBondContact O-N 2.98Å; A498-L501 PolarHBondContact O-N 2.88Å; L501-L504 HydrophobicContact CD2-CD2 4.42Å; L501-L504 WeakPolarHBondContact O-CB 3.29Å; L501-L504 PolarHBondContact O-N 3.26Å; L501-V505 WeakPolarHBondContact O-CG2 3.46Å; L501-V505 PolarHBondContact O-N 2.72Å; L501-V505 VanDerWaalsContact O-N 3.09Å
502	L	77.4	Confident	77	Confident	119 Å²	119	56 Å²	56	62%	0.623	29%	0.292	S	S	*	.	H	α-helix	trans	-67.1	-39.6	179.6	-73.7	174.9	0	0	0	112.8	A498 V505	A498-L502 WeakPolarHBondContact O-CG 3.27Å; A498-L502 PolarHBondContact O-N 3.31Å; L502-V505 PolarHBondContact O-N 3.21Å
503	D	72.7	Confident	77.7	Confident	13 Å²	13	50.7 Å²	50.7	7%	0.07	27%	0.272	C	S	.	.	H	α-helix	trans	-72.8	-33.9	176.4	-73.7	-24.8	0	0	0	111.8	S499 T500 V505 K506 N507 K633	S499-D503 WeakPolarHBondContact O-CB 3.43Å; S499-D503 PolarHBondContact O-N 3.43Å; S499-D503 VanDerWaalsContact O-N 3.11Å; T500-D503 PolarHBondContact O-N 2.79Å; D503-V505 VanDerWaalsContact C-N 3.32Å; D503-V505 PolarHBondContact O-N 3.24Å; D503-K506 WeakPolarHBondContact O-CB 3.49Å; D503-K506 PolarHBondContact O-N 3.4Å; D503-K506 VanDerWaalsContact O-N 3.14Å; D503-K506 IonicContact OD1-NZ 2.65Å; D503-K506 PolarHBondContact OD1-NZ 3.08Å; D503-K506 VanDerWaalsContact OD1-NZ 3.16Å; D503-N507 PolarHBondContact O-N 3.44Å; D503-N507 PolarHBondContact O-ND2 3.44Å; D503-K633 IonicContact OD2-NZ 2.74Å; D503-K633 PolarHBondContact OD2-NZ 2.82Å
504	L	76.3	Confident	78.4	Confident	11 Å²	11	46.2 Å²	46.2	6%	0.058	25%	0.248	C	C	.	.	H	α-helix	trans	-55.8	-46.2	171.2	175.5	78.1	0	0	0	110.7	T500 L501 K506 N507 L508 I626 N629	T500-L504 WeakPolarHBondContact O-CB 3.46Å; T500-L504 PolarHBondContact O-N 3.4Å; L501-L504 HydrophobicContact CD2-CD2 4.42Å; L501-L504 WeakPolarHBondContact O-CB 3.29Å; L501-L504 PolarHBondContact O-N 3.26Å; L504-K506 VanDerWaalsContact C-N 3.25Å; L504-K506 PolarHBondContact O-N 3.15Å; L504-N507 CarbonylContact O-C 2.92Å; L504-N507 PolarHBondContact O-N 2.88Å; L504-L508 HydrophobicContact CD1-CD1 3.67Å; L504-L508 HydrophobicContact CD1-CD2 4.16Å; L504-L508 HydrophobicContact CD1-CG 3.7Å; L504-L508 HydrophobicContact CD2-CD1 3.95Å; L504-L508 HydrophobicContact CG-CD1 3.51Å; L504-L508 HydrophobicContact CG-CG 3.83Å; L504-L508 VanDerWaalsContact O-CB 3.29Å; L504-L508 WeakPolarHBondContact O-CB 3.36Å; L504-L508 VanDerWaalsContact O-CG 3.23Å; L504-L508 WeakPolarHBondContact O-CG 3.13Å; L504-L508 PolarHBondContact O-N 2.99Å; L504-I626 HydrophobicContact CD1-CG1 4.15Å; L504-I626 HydrophobicContact CD2-CD1 3.98Å; L504-I626 HydrophobicContact CD2-CG1 3.59Å; L504-I626 HydrophobicContact CG-CG1 4.47Å; L504-N629 HydrophobicContact CD1-CB 3.93Å; L504-N629 WeakPolarHBondContact CD1-ND2 3.45Å
505	V	74.6	Confident	79.2	Confident	104 Å²	104	44 Å²	44	63%	0.63	24%	0.238	S	C	*	.	H	α-helix	trans	-56.7	-38.8	177.9	172.3	0	0	0	0	112	L501 L502 D503 R509	L501-V505 WeakPolarHBondContact O-CG2 3.46Å; L501-V505 PolarHBondContact O-N 2.72Å; L501-V505 VanDerWaalsContact O-N 3.09Å; L502-V505 PolarHBondContact O-N 3.21Å; D503-V505 VanDerWaalsContact C-N 3.32Å; D503-V505 PolarHBondContact O-N 3.24Å; V505-R509 PolarHBondContact O-N 3.46Å
506	K	72.7	Confident	80	Confident	90 Å²	90	47.1 Å²	47.1	39%	0.391	26%	0.256	S	S	.	.	H	α-helix	trans	-67.3	-43	176.4	-61.8	174	-168	157.7	0	111.4	D503 L504 L508 R509 E651	D503-K506 WeakPolarHBondContact O-CB 3.49Å; D503-K506 PolarHBondContact O-N 3.4Å; D503-K506 VanDerWaalsContact O-N 3.14Å; D503-K506 IonicContact OD1-NZ 2.65Å; D503-K506 PolarHBondContact OD1-NZ 3.08Å; D503-K506 VanDerWaalsContact OD1-NZ 3.16Å; L504-K506 VanDerWaalsContact C-N 3.25Å; L504-K506 PolarHBondContact O-N 3.15Å; K506-L508 VanDerWaalsContact C-N 3.34Å; K506-R509 PolarHBondContact O-N 3Å; K506-E651 IonicContact NZ-OE1 2.99Å; K506-E651 PolarHBondContact NZ-OE1 2.98Å
507	N	69.9	Low	80.9	Confident	37 Å²	37	47.3 Å²	47.3	20%	0.198	26%	0.257	C	S	.	.	H	α-helix	trans	-70.4	-30.8	-179.4	-65.8	-20.1	0	0	0	112.2	D503 L504 R509 N629 V654	D503-N507 PolarHBondContact O-N 3.44Å; D503-N507 PolarHBondContact O-ND2 3.44Å; L504-N507 CarbonylContact O-C 2.92Å; L504-N507 PolarHBondContact O-N 2.88Å; N507-R509 VanDerWaalsContact C-N 3.34Å; N507-R509 PolarHBondContact O-N 2.97Å; N507-N629 PolarHBondContact ND2-OD1 3.23Å; N507-V654 HydrophobicContact CB-CG2 4.08Å
508	L	77.3	Confident	81.6	Confident	13 Å²	13	46.2 Å²	46.2	7%	0.068	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-0.7	-179.7	-69.3	-171.7	0	0	0	114.4	L504 K506 A510 F511 A512 F622 L625	L504-L508 HydrophobicContact CD1-CD1 3.67Å; L504-L508 HydrophobicContact CD1-CD2 4.16Å; L504-L508 HydrophobicContact CD1-CG 3.7Å; L504-L508 HydrophobicContact CD2-CD1 3.95Å; L504-L508 HydrophobicContact CG-CD1 3.51Å; L504-L508 HydrophobicContact CG-CG 3.83Å; L504-L508 VanDerWaalsContact O-CB 3.29Å; L504-L508 WeakPolarHBondContact O-CB 3.36Å; L504-L508 VanDerWaalsContact O-CG 3.23Å; L504-L508 WeakPolarHBondContact O-CG 3.13Å; L504-L508 PolarHBondContact O-N 2.99Å; K506-L508 VanDerWaalsContact C-N 3.34Å; L508-A510 VanDerWaalsContact C-N 3.26Å; L508-A510 PolarHBondContact O-N 2.77Å; L508-A510 VanDerWaalsContact O-N 3.14Å; L508-F511 HydrophobicContact CD2-CB 4.27Å; L508-F511 HydrophobicContact CD2-CD2 3.91Å; L508-F511 HydrophobicContact CD2-CG 4.31Å; L508-F511 CarbonylContact O-C 3.55Å; L508-F511 WeakPolarHBondContact O-CA 3.42Å; L508-F511 WeakPolarHBondContact O-CB 3.38Å; L508-F511 PolarHBondContact O-N 3.43Å; L508-A512 PolarHBondContact O-N 2.9Å; L508-F622 HydrophobicContact CD1-CD2 3.92Å; L508-F622 HydrophobicContact CD1-CE2 3.41Å; L508-F622 VanDerWaalsContact CD1-CE2 3.41Å; L508-F622 HydrophobicContact CD1-CZ 4.29Å; L508-L625 HydrophobicContact CD2-CB 3.9Å; L508-L625 HydrophobicContact CD2-CD1 3.62Å; L508-L625 HydrophobicContact CD2-CD2 4.14Å; L508-L625 HydrophobicContact CD2-CG 4.12Å
509	R	81.7	Confident	82.4	Confident	184 Å²	184	46 Å²	46	69%	0.694	24%	0.244	S	C	*	.	H	α-helix	trans	-52.8	-41.7	-176.7	-173	-176	-59	-178.7	0.8	113.5	V505 K506 N507 G513	V505-R509 PolarHBondContact O-N 3.46Å; K506-R509 PolarHBondContact O-N 3Å; N507-R509 VanDerWaalsContact C-N 3.34Å; N507-R509 PolarHBondContact O-N 2.97Å; R509-G513 PolarHBondContact O-N 2.95Å
510	A	81.1	Confident	83.5	Confident	3 Å²	3	45.4 Å²	45.4	3%	0.025	24%	0.238	C	C	.	.	H	α-helix	trans	-74.1	-29.4	177.5	0	0	0	0	0	113.7	L134 M135 T138 L508 I514	L134-A510 HydrophobicContact CB-CB 3.78Å; L134-A510 HydrophobicContact CD2-CB 3.4Å; L134-A510 VanDerWaalsContact CD2-CB 3.4Å; L134-A510 HydrophobicContact CG-CB 3.31Å; M135-A510 HydrophobicContact CG-CB 3.97Å; M135-A510 WeakPolarHBondContact CG-O 3.32Å; T138-A510 HydrophobicContact CG2-CB 4.43Å; L508-A510 VanDerWaalsContact C-N 3.26Å; L508-A510 PolarHBondContact O-N 2.77Å; L508-A510 VanDerWaalsContact O-N 3.14Å; A510-I514 PolarHBondContact O-N 3.46Å
511	F	83.1	Confident	84.4	Confident	12 Å²	12	47.2 Å²	47.2	5%	0.053	25%	0.249	C	C	.	.	H	α-helix	trans	-68.4	-55.2	172	-70.9	-76.6	0	0	0	109.6	T138 F247 L508 G513 I514 L515 W618 L621 L625	T138-F511 HydrophobicContact CG2-CE1 3.87Å; T138-F511 HydrophobicContact CG2-CE2 3.93Å; T138-F511 HydrophobicContact CG2-CZ 3.47Å; T138-F511 VanDerWaalsContact CG2-CZ 3.47Å; F247-F511 HydrophobicContact CE1-CZ 4.48Å; F247-F511 AromaticContact CE2-CE1 3.57Å; F247-F511 HydrophobicContact CE2-CE1 3.57Å; F247-F511 AromaticContact CE2-CZ 3.42Å; F247-F511 HydrophobicContact CE2-CZ 3.42Å; F247-F511 VanDerWaalsContact CE2-CZ 3.42Å; F247-F511 AromaticContact CZ-CE1 3.73Å; F247-F511 HydrophobicContact CZ-CE1 3.73Å; F247-F511 HydrophobicContact CZ-CE2 4.03Å; F247-F511 AromaticContact CZ-CZ 3.23Å; F247-F511 HydrophobicContact CZ-CZ 3.23Å; L508-F511 HydrophobicContact CD2-CB 4.27Å; L508-F511 HydrophobicContact CD2-CD2 3.91Å; L508-F511 HydrophobicContact CD2-CG 4.31Å; L508-F511 CarbonylContact O-C 3.55Å; L508-F511 WeakPolarHBondContact O-CA 3.42Å; L508-F511 WeakPolarHBondContact O-CB 3.38Å; L508-F511 PolarHBondContact O-N 3.43Å; F511-G513 PolarHBondContact O-N 3.13Å; F511-G513 VanDerWaalsContact O-N 3.13Å; F511-I514 WeakPolarHBondContact O-CA 3.37Å; F511-I514 WeakPolarHBondContact O-CB 3.3Å; F511-I514 PolarHBondContact O-N 2.97Å; F511-L515 PolarHBondContact O-N 2.96Å; F511-W618 VanDerWaalsContact C-CH2 3.43Å; F511-W618 HydrophobicContact CB-CH2 3.94Å; F511-W618 HydrophobicContact CB-CZ2 4.47Å; F511-W618 WeakPolarHBondContact O-CH2 3.21Å; F511-W618 WeakPolarHBondContact O-CZ2 3.15Å; F511-L621 HydrophobicContact CD1-CD2 3.48Å; F511-L621 VanDerWaalsContact CD1-CD2 3.48Å; F511-L621 HydrophobicContact CE1-CD2 3.73Å; F511-L621 HydrophobicContact CG-CD2 4.44Å; F511-L625 HydrophobicContact CB-CD1 4.38Å; F511-L625 HydrophobicContact CD1-CD1 3.61Å; F511-L625 HydrophobicContact CD2-CD1 3.55Å; F511-L625 HydrophobicContact CD2-CD2 4.39Å; F511-L625 HydrophobicContact CE1-CD1 3.74Å; F511-L625 HydrophobicContact CE2-CD1 3.66Å; F511-L625 HydrophobicContact CE2-CD2 3.95Å; F511-L625 HydrophobicContact CE2-CG 4.47Å; F511-L625 HydrophobicContact CG-CD1 3.54Å; F511-L625 HydrophobicContact CZ-CD1 3.79Å; F511-L625 HydrophobicContact CZ-CD2 4.34Å
512	A	86.8	Confident	85.3	Confident	49 Å²	49	44.5 Å²	44.5	41%	0.405	23%	0.233	S	C	.	.	H	α-helix	trans	-51.7	-39.2	174.6	0	0	0	0	0	112.1	L508 I514 L515 V516	L508-A512 PolarHBondContact O-N 2.9Å; A512-I514 PolarHBondContact O-N 3.02Å; A512-L515 WeakPolarHBondContact O-CB 3.23Å; A512-L515 PolarHBondContact O-N 2.91Å; A512-V516 WeakPolarHBondContact O-CG2 3.47Å; A512-V516 PolarHBondContact O-N 2.9Å
513	G	89.9	Confident	86.2	Confident	11 Å²	11	38.8 Å²	38.8	11%	0.113	20%	0.204	C	C	.	.	H	α-helix	trans	-60	-41.8	172.9	0	0	0	0	0	114	M135 R509 F511 V517	M135-G513 VanDerWaalsContact CE-O 3.32Å; M135-G513 WeakPolarHBondContact CE-O 3.44Å; R509-G513 PolarHBondContact O-N 2.95Å; F511-G513 PolarHBondContact O-N 3.13Å; F511-G513 VanDerWaalsContact O-N 3.13Å; G513-V517 WeakPolarHBondContact O-CG2 3.11Å; G513-V517 PolarHBondContact O-N 3.23Å
514	I	90.3	Very high	87.2	Confident	7 Å²	7	38.4 Å²	38.4	4%	0.036	20%	0.202	C	C	.	.	H	α-helix	trans	-66.7	-38.9	174	-69.3	172.5	0	0	0	110.9	M135 T138 I142 A510 F511 A512 V516 V517 V518 W618	M135-I514 HydrophobicContact CB-CG1 4.45Å; M135-I514 HydrophobicContact CE-CG1 4.31Å; M135-I514 HydrophobicContact CG-CG1 4.4Å; T138-I514 WeakPolarHBondContact OG1-CD1 3.41Å; I142-I514 HydrophobicContact CD1-CD1 4.22Å; A510-I514 PolarHBondContact O-N 3.46Å; F511-I514 WeakPolarHBondContact O-CA 3.37Å; F511-I514 WeakPolarHBondContact O-CB 3.3Å; F511-I514 PolarHBondContact O-N 2.97Å; A512-I514 PolarHBondContact O-N 3.02Å; I514-V516 VanDerWaalsContact C-N 3.32Å; I514-V516 PolarHBondContact O-N 3.08Å; I514-V517 WeakPolarHBondContact O-CB 3.18Å; I514-V517 PolarHBondContact O-N 3.29Å; I514-V517 VanDerWaalsContact O-N 3.15Å; I514-V518 HydrophobicContact CG2-CG2 4.3Å; I514-V518 WeakPolarHBondContact O-CG2 3.33Å; I514-V518 PolarHBondContact O-N 2.82Å; I514-W618 HydrophobicContact CB-CZ2 4.31Å; I514-W618 HydrophobicContact CG2-CZ2 4.41Å
515	L	90.8	Very high	88.1	Confident	42 Å²	42	42.2 Å²	42.2	22%	0.22	22%	0.218	C	C	.	.	H	α-helix	trans	-57.3	-49	176.4	-169.3	52.6	0	0	0	110.7	F511 A512 V517 V518 Y519 W618	F511-L515 PolarHBondContact O-N 2.96Å; A512-L515 WeakPolarHBondContact O-CB 3.23Å; A512-L515 PolarHBondContact O-N 2.91Å; L515-V517 VanDerWaalsContact C-N 3.26Å; L515-V517 PolarHBondContact O-N 2.92Å; L515-V518 PolarHBondContact O-N 2.99Å; L515-V518 VanDerWaalsContact O-N 3.1Å; L515-Y519 HydrophobicContact CD1-CD2 3.6Å; L515-Y519 HydrophobicContact CD1-CE2 3.49Å; L515-Y519 VanDerWaalsContact CD1-CE2 3.49Å; L515-Y519 HydrophobicContact CD2-CE2 4.27Å; L515-Y519 HydrophobicContact CG-CD2 3.68Å; L515-Y519 HydrophobicContact CG-CE2 3.76Å; L515-Y519 WeakPolarHBondContact O-CD2 3.38Å; L515-Y519 PolarHBondContact O-N 3.41Å; L515-W618 HydrophobicContact CB-CD2 4.41Å; L515-W618 HydrophobicContact CB-CE3 4.44Å; L515-W618 HydrophobicContact CB-CH2 3.5Å; L515-W618 HydrophobicContact CB-CZ2 3.43Å; L515-W618 VanDerWaalsContact CB-CZ2 3.43Å; L515-W618 HydrophobicContact CB-CZ3 4.01Å; L515-W618 HydrophobicContact CD1-CD2 3.55Å; L515-W618 HydrophobicContact CD1-CE3 3.75Å; L515-W618 HydrophobicContact CD1-CG 3.97Å; L515-W618 HydrophobicContact CD1-CH2 4.34Å; L515-W618 HydrophobicContact CD1-CZ2 4.15Å; L515-W618 HydrophobicContact CD1-CZ3 4.13Å; L515-W618 HydrophobicContact CD2-CE3 4.12Å; L515-W618 HydrophobicContact CD2-CH2 4.13Å; L515-W618 HydrophobicContact CD2-CZ3 3.79Å; L515-W618 HydrophobicContact CG-CD2 4.42Å; L515-W618 HydrophobicContact CG-CE3 4.32Å; L515-W618 HydrophobicContact CG-CH2 4.2Å; L515-W618 HydrophobicContact CG-CZ2 4.28Å; L515-W618 HydrophobicContact CG-CZ3 4.19Å; L515-W618 VanDerWaalsContact N-CZ2 3.35Å
516	V	93.3	Very high	89.1	Confident	76 Å²	76	37.2 Å²	37.2	46%	0.461	19%	0.188	S	C	.	.	H	α-helix	trans	-57.6	-41.4	177.7	171	0	0	0	0	110.8	A512 I514 Y520	A512-V516 WeakPolarHBondContact O-CG2 3.47Å; A512-V516 PolarHBondContact O-N 2.9Å; I514-V516 VanDerWaalsContact C-N 3.32Å; I514-V516 PolarHBondContact O-N 3.08Å; V516-Y520 WeakPolarHBondContact O-CB 3.38Å; V516-Y520 PolarHBondContact O-N 3.25Å
517	V	93.9	Very high	90.1	Very high	17 Å²	17	33.3 Å²	33.3	10%	0.103	17%	0.171	C	C	.	.	H	α-helix	trans	-61.6	-46.3	175.3	168.7	0	0	0	0	111.9	P125 L128 L129 M135 G513 I514 L515 Y520 V521	P125-V517 HydrophobicContact CB-CB 4.07Å; P125-V517 HydrophobicContact CB-CG1 3.69Å; P125-V517 HydrophobicContact CB-CG2 3.83Å; L128-V517 HydrophobicContact CD2-CG2 4.03Å; L129-V517 HydrophobicContact CD1-CG1 4.08Å; L129-V517 HydrophobicContact CD2-CG2 4.3Å; L129-V517 HydrophobicContact CG-CG1 4.46Å; L129-V517 HydrophobicContact CG-CG2 4.08Å; M135-V517 HydrophobicContact CE-CG2 4.05Å; G513-V517 WeakPolarHBondContact O-CG2 3.11Å; G513-V517 PolarHBondContact O-N 3.23Å; I514-V517 WeakPolarHBondContact O-CB 3.18Å; I514-V517 PolarHBondContact O-N 3.29Å; I514-V517 VanDerWaalsContact O-N 3.15Å; L515-V517 VanDerWaalsContact C-N 3.26Å; L515-V517 PolarHBondContact O-N 2.92Å; V517-Y520 PolarHBondContact O-N 2.92Å; V517-V521 WeakPolarHBondContact O-CG2 3.47Å; V517-V521 PolarHBondContact O-N 3.38Å
518	V	94.3	Very high	91.1	Very high	27 Å²	27	34.6 Å²	34.6	16%	0.164	17%	0.173	C	C	.	.	H	α-helix	trans	-65.1	-47.2	-179.4	171	0	0	0	0	111	I514 L515 Y520 V521 F522 W610 T613	I514-V518 HydrophobicContact CG2-CG2 4.3Å; I514-V518 WeakPolarHBondContact O-CG2 3.33Å; I514-V518 PolarHBondContact O-N 2.82Å; L515-V518 PolarHBondContact O-N 2.99Å; L515-V518 VanDerWaalsContact O-N 3.1Å; V518-Y520 VanDerWaalsContact C-N 3.34Å; V518-Y520 PolarHBondContact O-N 3.46Å; V518-V521 PolarHBondContact O-N 2.95Å; V518-F522 HydrophobicContact CG1-CD2 4.09Å; V518-F522 HydrophobicContact CG1-CE2 4.29Å; V518-F522 WeakPolarHBondContact O-CD2 3.46Å; V518-F522 PolarHBondContact O-N 3.11Å; V518-W610 HydrophobicContact CG1-CH2 4.43Å; V518-W610 HydrophobicContact CG1-CZ3 3.76Å; V518-T613 HydrophobicContact CG1-CG2 3.84Å
519	Y	95.8	Very high	91.9	Very high	27 Å²	27	38 Å²	38	11%	0.106	19%	0.191	C	C	.	.	H	α-helix	trans	-57.1	-46.5	173.8	-95.2	-87.6	0	0	0	112	L515 V521 F522 A523 I576 L579 M583 W610	L515-Y519 HydrophobicContact CD1-CD2 3.6Å; L515-Y519 HydrophobicContact CD1-CE2 3.49Å; L515-Y519 VanDerWaalsContact CD1-CE2 3.49Å; L515-Y519 HydrophobicContact CD2-CE2 4.27Å; L515-Y519 HydrophobicContact CG-CD2 3.68Å; L515-Y519 HydrophobicContact CG-CE2 3.76Å; L515-Y519 WeakPolarHBondContact O-CD2 3.38Å; L515-Y519 PolarHBondContact O-N 3.41Å; Y519-V521 PolarHBondContact O-N 3.33Å; Y519-F522 PolarHBondContact O-N 2.97Å; Y519-A523 WeakPolarHBondContact O-CB 3.22Å; Y519-A523 PolarHBondContact O-N 2.77Å; Y519-I576 HydrophobicContact CD1-CG2 4.5Å; Y519-L579 HydrophobicContact CD1-CB 4.02Å; Y519-L579 HydrophobicContact CD1-CD1 4.25Å; Y519-L579 HydrophobicContact CE1-CB 3.74Å; Y519-M583 HydrophobicContact CE2-SD 4.21Å; Y519-M583 WeakPolarHBondContact OH-CE 3.44Å; Y519-M583 PolarHBondContact OH-SD 3.44Å; Y519-W610 AromaticContact CD1-CH2 3.84Å; Y519-W610 HydrophobicContact CD1-CH2 3.84Å; Y519-W610 HydrophobicContact CD1-CZ2 4.15Å; Y519-W610 AromaticContact CD2-CH2 3.89Å; Y519-W610 HydrophobicContact CD2-CH2 3.89Å; Y519-W610 AromaticContact CE1-CH2 3.85Å; Y519-W610 HydrophobicContact CE1-CH2 3.85Å; Y519-W610 AromaticContact CE1-CZ2 3.71Å; Y519-W610 HydrophobicContact CE1-CZ2 3.71Å; Y519-W610 AromaticContact CE2-CH2 3.9Å; Y519-W610 HydrophobicContact CE2-CH2 3.9Å; Y519-W610 HydrophobicContact CE2-CZ2 4.14Å; Y519-W610 AromaticContact CG-CH2 3.87Å; Y519-W610 HydrophobicContact CG-CH2 3.87Å; Y519-W610 AromaticContact CZ-CH2 3.88Å; Y519-W610 AromaticContact CZ-CZ2 3.7Å
520	Y	96.1	Very high	92.5	Very high	9 Å²	9	29.7 Å²	29.7	4%	0.035	16%	0.16	C	C	.	.	H	α-helix	trans	-61.5	-46.4	-178.4	-169.2	-73.8	0	0	0	111.6	L27 A30 R121 R124 P125 V516 V517 V518 A523 V524 F572	L27-Y520 HydrophobicContact CB-CE2 4.36Å; L27-Y520 HydrophobicContact CD2-CD2 4Å; L27-Y520 HydrophobicContact CD2-CE2 3.83Å; A30-Y520 HydrophobicContact CB-CE2 3.94Å; R121-Y520 VanDerWaalsContact O-CE1 3.23Å; R121-Y520 WeakPolarHBondContact O-CE1 3.4Å; R124-Y520 HydrophobicContact CB-CE1 4.49Å; R124-Y520 WeakPolarHBondContact CD-OH 3.27Å; P125-Y520 HydrophobicContact CG-CD1 3.19Å; P125-Y520 HydrophobicContact CG-CE1 3.82Å; P125-Y520 HydrophobicContact CG-CG 3.6Å; V516-Y520 WeakPolarHBondContact O-CB 3.38Å; V516-Y520 PolarHBondContact O-N 3.25Å; V517-Y520 PolarHBondContact O-N 2.92Å; V518-Y520 VanDerWaalsContact C-N 3.34Å; V518-Y520 PolarHBondContact O-N 3.46Å; Y520-A523 PolarHBondContact O-N 3.47Å; Y520-V524 HydrophobicContact CD1-CG2 3.94Å; Y520-V524 HydrophobicContact CE1-CG2 3.63Å; Y520-V524 WeakPolarHBondContact O-CG2 3.44Å; Y520-V524 PolarHBondContact O-N 2.9Å; Y520-F572 HydrophobicContact CD2-CE1 4.45Å; Y520-F572 HydrophobicContact CD2-CE2 4Å; Y520-F572 AromaticContact CD2-CZ 3.47Å; Y520-F572 HydrophobicContact CD2-CZ 3.47Å; Y520-F572 VanDerWaalsContact CD2-CZ 3.47Å; Y520-F572 HydrophobicContact CE2-CE1 4.47Å; Y520-F572 HydrophobicContact CE2-CE2 4.1Å; Y520-F572 AromaticContact CE2-CZ 3.69Å; Y520-F572 HydrophobicContact CE2-CZ 3.69Å; Y520-F572 HydrophobicContact CG-CE2 4.38Å; Y520-F572 HydrophobicContact CG-CZ 4.18Å
521	V	95.8	Very high	93	Very high	49 Å²	49	34.5 Å²	34.5	30%	0.297	18%	0.182	S	C	.	.	H	α-helix	trans	-62	-47.5	179.2	168.1	0	0	0	0	110.9	L122 P125 V517 V518 Y519 F525	L122-V521 HydrophobicContact CD1-CB 4.46Å; L122-V521 HydrophobicContact CD1-CG1 3.89Å; P125-V521 HydrophobicContact CG-CG2 4.27Å; V517-V521 WeakPolarHBondContact O-CG2 3.47Å; V517-V521 PolarHBondContact O-N 3.38Å; V518-V521 PolarHBondContact O-N 2.95Å; Y519-V521 PolarHBondContact O-N 3.33Å; V521-F525 VanDerWaalsContact O-CB 3.25Å; V521-F525 WeakPolarHBondContact O-CB 3.36Å; V521-F525 PolarHBondContact O-N 2.88Å
522	F	96.6	Very high	93.2	Very high	34 Å²	34	35.4 Å²	35.4	15%	0.149	19%	0.194	C	C	.	.	H	α-helix	trans	-68.2	-38.5	178.6	-87.4	-95	0	0	0	112.5	V518 Y519 F525 G526 L579 Y606 C609 W610 T613	V518-F522 HydrophobicContact CG1-CD2 4.09Å; V518-F522 HydrophobicContact CG1-CE2 4.29Å; V518-F522 WeakPolarHBondContact O-CD2 3.46Å; V518-F522 PolarHBondContact O-N 3.11Å; Y519-F522 PolarHBondContact O-N 2.97Å; F522-F525 PolarHBondContact O-N 2.94Å; F522-G526 PolarHBondContact O-N 3.25Å; F522-L579 HydrophobicContact CB-CD1 3.91Å; F522-L579 HydrophobicContact CB-CD2 4.34Å; F522-Y606 AromaticContact CD1-CE2 3.86Å; F522-Y606 HydrophobicContact CD1-CE2 3.86Å; F522-Y606 PolarHBondContact O-OH 3.03Å; F522-C609 HydrophobicContact CE1-CB 4.48Å; F522-W610 HydrophobicContact CB-CE3 3.75Å; F522-W610 HydrophobicContact CB-CZ3 3.7Å; F522-W610 HydrophobicContact CD1-CB 4.08Å; F522-W610 HydrophobicContact CD1-CD2 4.3Å; F522-W610 AromaticContact CD1-CE3 3.56Å; F522-W610 HydrophobicContact CD1-CE3 3.56Å; F522-W610 HydrophobicContact CD1-CZ3 4.33Å; F522-W610 AromaticContact CD2-CE3 3.61Å; F522-W610 HydrophobicContact CD2-CE3 3.61Å; F522-W610 AromaticContact CD2-CZ3 3.68Å; F522-W610 HydrophobicContact CD2-CZ3 3.68Å; F522-W610 HydrophobicContact CE1-CB 3.92Å; F522-W610 AromaticContact CE1-CE3 3.97Å; F522-W610 HydrophobicContact CE1-CE3 3.97Å; F522-W610 HydrophobicContact CE2-CE3 4.01Å; F522-W610 HydrophobicContact CE2-CZ3 4.35Å; F522-W610 HydrophobicContact CG-CD2 4.41Å; F522-W610 AromaticContact CG-CE3 3.35Å; F522-W610 HydrophobicContact CG-CE3 3.35Å; F522-W610 AromaticContact CG-CZ3 3.65Å; F522-W610 HydrophobicContact CG-CZ3 3.65Å; F522-W610 HydrophobicContact CZ-CE3 4.17Å; F522-T613 HydrophobicContact CE2-CG2 4.33Å
523	A	96.4	Very high	93.3	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-63.1	-47.9	177.9	0	0	0	0	0	111.4	Y519 Y520 F525 G526 I527 F572 A575 I576 L579	Y519-A523 WeakPolarHBondContact O-CB 3.22Å; Y519-A523 PolarHBondContact O-N 2.77Å; Y520-A523 PolarHBondContact O-N 3.47Å; A523-F525 PolarHBondContact O-N 3.07Å; A523-G526 PolarHBondContact O-N 3.36Å; A523-I527 VanDerWaalsContact O-CG1 3.27Å; A523-I527 WeakPolarHBondContact O-CG1 3.23Å; A523-I527 PolarHBondContact O-N 2.93Å; A523-F572 HydrophobicContact CB-CD2 4.09Å; A523-F572 HydrophobicContact CB-CE2 3.77Å; A523-A575 HydrophobicContact CB-CB 4.03Å; A523-I576 HydrophobicContact CB-CG1 4.44Å; A523-L579 HydrophobicContact CB-CD1 3.91Å
524	V	94.9	Very high	93.2	Very high	5 Å²	5	33.8 Å²	33.8	3%	0.03	18%	0.179	C	C	.	.	H	α-helix	trans	-63.2	-42.7	176.6	173.3	0	0	0	0	111.2	R121 Y520 G526 I527 W528 F572	R121-V524 HydrophobicContact CB-CG1 3.84Å; R121-V524 HydrophobicContact CB-CG2 4.27Å; Y520-V524 HydrophobicContact CD1-CG2 3.94Å; Y520-V524 HydrophobicContact CE1-CG2 3.63Å; Y520-V524 WeakPolarHBondContact O-CG2 3.44Å; Y520-V524 PolarHBondContact O-N 2.9Å; V524-G526 VanDerWaalsContact C-N 3.34Å; V524-I527 PolarHBondContact O-N 3.43Å; V524-W528 HydrophobicContact CG1-CD2 4.32Å; V524-W528 HydrophobicContact CG1-CZ2 3.82Å; V524-W528 PolarHBondContact O-N 3.03Å; V524-W528 VanDerWaalsContact O-N 3.08Å; V524-F572 HydrophobicContact CG2-CE2 4.18Å
525	F	94.6	Very high	92.7	Very high	90 Å²	90	40.7 Å²	40.7	40%	0.395	21%	0.209	S	C	.	.	H	α-helix	trans	-65.6	-37.4	177.3	-169.4	-123.5	0	0	0	112.2	V521 F522 A523 W528 L529 Y606	V521-F525 VanDerWaalsContact O-CB 3.25Å; V521-F525 WeakPolarHBondContact O-CB 3.36Å; V521-F525 PolarHBondContact O-N 2.88Å; F522-F525 PolarHBondContact O-N 2.94Å; A523-F525 PolarHBondContact O-N 3.07Å; F525-W528 HydrophobicContact CD2-CE3 4.15Å; F525-W528 PolarHBondContact O-N 3.42Å; F525-L529 HydrophobicContact CD1-CD1 3.95Å; F525-L529 HydrophobicContact CE1-CD1 3.57Å; F525-L529 HydrophobicContact CE2-CD1 4.29Å; F525-L529 HydrophobicContact CE2-CG 4.45Å; F525-L529 HydrophobicContact CG-CD1 4.44Å; F525-L529 HydrophobicContact CZ-CD1 3.76Å; F525-L529 HydrophobicContact CZ-CG 4.36Å; F525-L529 WeakPolarHBondContact O-CG 3.3Å; F525-L529 PolarHBondContact O-N 2.9Å; F525-Y606 AromaticContact CD1-CD2 3.79Å; F525-Y606 HydrophobicContact CD1-CD2 3.79Å; F525-Y606 AromaticContact CD1-CE2 3.77Å; F525-Y606 HydrophobicContact CD1-CE2 3.77Å; F525-Y606 HydrophobicContact CE1-CD2 4.06Å; F525-Y606 HydrophobicContact CE1-CE2 4.49Å
526	G	95	Very high	92	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-64.6	-43.4	174.9	0	0	0	0	0	112.7	F522 A523 V524 W528 L529 F530 Y606	F522-G526 PolarHBondContact O-N 3.25Å; A523-G526 PolarHBondContact O-N 3.36Å; V524-G526 VanDerWaalsContact C-N 3.34Å; G526-W528 PolarHBondContact O-N 3.49Å; G526-L529 PolarHBondContact O-N 3.33Å; G526-F530 WeakPolarHBondContact O-CB 3.33Å; G526-F530 WeakPolarHBondContact O-CD2 3.35Å; G526-F530 PolarHBondContact O-N 2.89Å; G526-Y606 WeakPolarHBondContact CA-OH 3.36Å
527	I	93.8	Very high	90.9	Very high	7 Å²	7	39 Å²	39	4%	0.036	20%	0.202	C	C	.	.	H	α-helix	trans	-59.6	-47.6	173.9	-64.6	161.4	0	0	0	109.9	P35 A523 V524 L529 F530 E531 F569 F572 A575	P35-I527 HydrophobicContact CG-CG2 4.02Å; A523-I527 VanDerWaalsContact O-CG1 3.27Å; A523-I527 WeakPolarHBondContact O-CG1 3.23Å; A523-I527 PolarHBondContact O-N 2.93Å; V524-I527 PolarHBondContact O-N 3.43Å; I527-L529 PolarHBondContact O-N 2.74Å; I527-L529 VanDerWaalsContact O-N 3.16Å; I527-F530 PolarHBondContact O-N 2.77Å; I527-E531 HydrophobicContact CG2-CB 4.18Å; I527-E531 WeakPolarHBondContact O-CB 3.49Å; I527-E531 PolarHBondContact O-N 2.98Å; I527-F569 WeakPolarHBondContact CG1-O 3.47Å; I527-F572 HydrophobicContact CD1-CB 4.27Å; I527-F572 HydrophobicContact CD1-CD2 4.2Å; I527-A575 HydrophobicContact CD1-CB 4.38Å; I527-A575 HydrophobicContact CG1-CB 4.21Å
528	W	92.3	Very high	89.3	Confident	65 Å²	65	43.6 Å²	43.6	25%	0.246	23%	0.232	C	C	.	.	H	α-helix	trans	-58.4	-31.6	178.4	-68.8	-7.4	0	0	0	114.2	L117 R118 L122 V524 F525 G526	L117-W528 HydrophobicContact CD2-CB 4.34Å; L117-W528 HydrophobicContact CD2-CD2 4.4Å; L117-W528 HydrophobicContact CD2-CG 4.08Å; R118-W528 WeakPolarHBondContact O-CZ2 3.38Å; L122-W528 HydrophobicContact CB-CH2 3.71Å; L122-W528 HydrophobicContact CB-CZ2 4.3Å; L122-W528 HydrophobicContact CB-CZ3 4.44Å; L122-W528 HydrophobicContact CD2-CH2 4.04Å; L122-W528 HydrophobicContact CD2-CZ3 4.01Å; L122-W528 HydrophobicContact CG-CH2 4.34Å; V524-W528 HydrophobicContact CG1-CD2 4.32Å; V524-W528 HydrophobicContact CG1-CZ2 3.82Å; V524-W528 PolarHBondContact O-N 3.03Å; V524-W528 VanDerWaalsContact O-N 3.08Å; F525-W528 HydrophobicContact CD2-CE3 4.15Å; F525-W528 PolarHBondContact O-N 3.42Å; G526-W528 PolarHBondContact O-N 3.49Å
529	L	93.1	Very high	87.3	Confident	85 Å²	85	50 Å²	50	45%	0.445	26%	0.26	S	S	.	.	H	α-helix	trans	-90.1	-33.2	-177.8	-67.8	177.2	0	0	0	113.4	F525 G526 I527 Y606	F525-L529 HydrophobicContact CD1-CD1 3.95Å; F525-L529 HydrophobicContact CE1-CD1 3.57Å; F525-L529 HydrophobicContact CE2-CD1 4.29Å; F525-L529 HydrophobicContact CE2-CG 4.45Å; F525-L529 HydrophobicContact CG-CD1 4.44Å; F525-L529 HydrophobicContact CZ-CD1 3.76Å; F525-L529 HydrophobicContact CZ-CG 4.36Å; F525-L529 WeakPolarHBondContact O-CG 3.3Å; F525-L529 PolarHBondContact O-N 2.9Å; G526-L529 PolarHBondContact O-N 3.33Å; I527-L529 PolarHBondContact O-N 2.74Å; I527-L529 VanDerWaalsContact O-N 3.16Å; L529-Y606 HydrophobicContact CD1-CD2 4.1Å
530	F	94.1	Very high	85.2	Confident	9 Å²	9	51.8 Å²	51.8	4%	0.039	27%	0.271	C	S	.	.	H	α-helix	trans	-130.2	4.6	-161.5	-53.3	-56.6	0	0	0	114.8	G526 I527 G532 A533 F569 Y595 T599 Y606	G526-F530 WeakPolarHBondContact O-CB 3.33Å; G526-F530 WeakPolarHBondContact O-CD2 3.35Å; G526-F530 PolarHBondContact O-N 2.89Å; I527-F530 PolarHBondContact O-N 2.77Å; F530-G532 PolarHBondContact O-N 3.3Å; F530-A533 WeakPolarHBondContact O-CB 3.13Å; F530-A533 PolarHBondContact O-N 3.19Å; F530-A533 VanDerWaalsContact O-N 3.12Å; F530-F569 HydrophobicContact CB-CB 3.81Å; F530-F569 HydrophobicContact CB-CD2 3.72Å; F530-F569 HydrophobicContact CB-CG 4.06Å; F530-F569 AromaticContact CD2-CD2 3.55Å; F530-F569 HydrophobicContact CD2-CD2 3.55Å; F530-F569 AromaticContact CD2-CE2 3.74Å; F530-F569 HydrophobicContact CD2-CE2 3.74Å; F530-F569 HydrophobicContact CD2-CG 4.19Å; F530-F569 HydrophobicContact CE2-CE2 4.33Å; F530-F569 AromaticContact CG-CD2 3.99Å; F530-F569 HydrophobicContact CG-CD2 3.99Å; F530-Y595 HydrophobicContact CB-CD1 4.11Å; F530-Y595 HydrophobicContact CB-CE1 3.76Å; F530-Y595 AromaticContact CD1-CD1 3.89Å; F530-Y595 HydrophobicContact CD1-CD1 3.89Å; F530-Y595 HydrophobicContact CD1-CE1 4.41Å; F530-Y595 HydrophobicContact CE1-CD1 4.48Å; F530-Y595 AromaticContact CG-CD1 3.96Å; F530-Y595 HydrophobicContact CG-CD1 3.96Å; F530-Y595 HydrophobicContact CG-CE1 4.07Å; F530-T599 HydrophobicContact CD1-CG2 3.95Å; F530-T599 HydrophobicContact CE1-CG2 4.48Å; F530-Y606 AromaticContact CE2-CD1 3.6Å; F530-Y606 HydrophobicContact CE2-CD1 3.6Å; F530-Y606 HydrophobicContact CE2-CD2 4.26Å; F530-Y606 AromaticContact CE2-CE1 3.88Å; F530-Y606 HydrophobicContact CE2-CE1 3.88Å; F530-Y606 HydrophobicContact CE2-CE2 4.5Å; F530-Y606 AromaticContact CE2-CG 3.8Å; F530-Y606 HydrophobicContact CE2-CG 3.8Å; F530-Y606 HydrophobicContact CZ-CD1 4.22Å; F530-Y606 HydrophobicContact CZ-CG 4.21Å
531	E	91.3	Very high	82.7	Confident	103 Å²	103	55.8 Å²	55.8	48%	0.481	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	124.7	175.4	179.9	179.2	179.3	0	0	111.2	I527 A533	I527-E531 HydrophobicContact CG2-CB 4.18Å; I527-E531 WeakPolarHBondContact O-CB 3.49Å; I527-E531 PolarHBondContact O-N 2.98Å; E531-A533 PolarHBondContact O-N 3.06Å
532	G	88	Confident	80.2	Confident	31 Å²	31	58.4 Å²	58.4	32%	0.32	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.4	13.2	178.3	0	0	0	0	0	115	F530 K535 D570	F530-G532 PolarHBondContact O-N 3.3Å; G532-K535 WeakPolarHBondContact O-CE 3.48Å; G532-D570 WeakPolarHBondContact CA-OD1 3.38Å; G532-D570 PolarHBondContact N-OD1 2.88Å
533	A	89.2	Confident	77.7	Confident	22 Å²	22	64.1 Å²	64.1	18%	0.182	34%	0.341	C	S	.	.			trans	-67.9	-39.5	178	0	0	0	0	0	112.5	F530 E531 Y595 T599	F530-A533 WeakPolarHBondContact O-CB 3.13Å; F530-A533 PolarHBondContact O-N 3.19Å; F530-A533 VanDerWaalsContact O-N 3.12Å; E531-A533 PolarHBondContact O-N 3.06Å; A533-Y595 HydrophobicContact CB-CE1 4.47Å; A533-T599 HydrophobicContact CB-CG2 3.54Å
534	I	87.8	Confident	74.9	Confident	4 Å²	4	67.6 Å²	67.6	2%	0.021	37%	0.365	C	S	.	.	S	Bend	trans	-94.8	106.1	-178.9	-58.7	-177.6	0	0	0	108.7	Y559 W565 Y595 Y598	I534-Y559 HydrophobicContact CD1-CE1 4.02Å; I534-Y559 HydrophobicContact CD1-CE2 4.26Å; I534-Y559 WeakPolarHBondContact CD1-OH 3.5Å; I534-Y559 HydrophobicContact CG2-CE1 3.95Å; I534-W565 HydrophobicContact CG2-CE3 3.74Å; I534-W565 HydrophobicContact CG2-CZ3 3.69Å; I534-Y595 HydrophobicContact CD1-CE1 3.95Å; I534-Y595 HydrophobicContact CD1-CE2 3.87Å; I534-Y595 WeakPolarHBondContact CD1-OH 3.47Å; I534-Y595 HydrophobicContact CG1-CE1 4.14Å; I534-Y598 HydrophobicContact CG1-CD2 4.35Å
535	K	80.9	Confident	72.4	Confident	153 Å²	153	75.6 Å²	75.6	67%	0.665	41%	0.406	S	S	*	.	P	Polyproline II helix	trans	-103.8	137.7	177.8	-65.7	-177.9	-178.3	177.7	0	110.7	G532	G532-K535 WeakPolarHBondContact O-CE 3.48Å
536	P	74.1	Confident	69.7	Low	44 Å²	44	77.2 Å²	77.2	29%	0.286	42%	0.419	S	S	.	.	P	Polyproline II helix	trans	-65.4	149.7	173.9	30.4	-35.2	0	0	0	109.8	P44 R45	P44-P536 HydrophobicContact CB-CG 4.31Å; R45-P536 HydrophobicContact CG-CB 4Å
537	P	70.3	Confident	67.2	Low	37 Å²	37	85.7 Å²	85.7	24%	0.24	47%	0.465	C	S	.	.	P	Polyproline II helix	trans	-59	138.2	175.4	20.9	-29.3	0	0	0	110.5	Q539 M540	P537-Q539 PolarHBondContact O-N 3.37Å; P537-M540 PolarHBondContact O-N 3.45Å; P537-M540 VanDerWaalsContact O-N 3.11Å
538	P	60.2	Low	64.8	Low	114 Å²	114	90.8 Å²	90.8	74%	0.74	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-20.7	-167.1	17.3	-29.7	0	0	0	114.8	S541	P538-S541 PolarHBondContact O-OG 3.13Å; P538-S541 VanDerWaalsContact O-OG 3.09Å
539	Q	54.3	Low	62.5	Low	161 Å²	161	93.9 Å²	93.9	75%	0.752	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	-7.4	-176.1	-66.6	169.6	-6.9	0	0	114.5	P537	P537-Q539 PolarHBondContact O-N 3.37Å
540	M	50.6	Low	60.3	Low	66 Å²	66	93.6 Å²	93.6	33%	0.325	53%	0.528	S	S	.	.	S	Bend	trans	-87.1	-17.8	177.3	-155.7	89.1	-175.5	0	0	112.9	P537 V542 F543	P537-M540 PolarHBondContact O-N 3.45Å; P537-M540 VanDerWaalsContact O-N 3.11Å; M540-V542 PolarHBondContact O-N 3.05Å; M540-F543 HydrophobicContact CE-CD2 3.93Å; M540-F543 HydrophobicContact CE-CE2 3.32Å; M540-F543 HydrophobicContact CE-CZ 4.02Å; M540-F543 HydrophobicContact CG-CD2 4.22Å; M540-F543 HydrophobicContact CG-CE2 4.22Å; M540-F543 HydrophobicContact SD-CD2 4.12Å; M540-F543 HydrophobicContact SD-CE2 3.52Å; M540-F543 VanDerWaalsContact SD-CE2 3.52Å
541	S	44.3	Very low	58.2	Low	92 Å²	92	100.7 Å²	100.7	64%	0.643	57%	0.566	S	S	*	*	S	Bend	trans	-71.2	-11.5	-179.6	64.5	0	0	0	0	113.9	P538	P538-S541 PolarHBondContact O-OG 3.13Å; P538-S541 VanDerWaalsContact O-OG 3.09Å
542	V	43.6	Very low	56.6	Low	104 Å²	104	102.3 Å²	102.3	63%	0.63	57%	0.572	S	S	*	*			trans	-122.5	71.4	175.4	-171.1	0	0	0	0	108.1	M540 S544	M540-V542 PolarHBondContact O-N 3.05Å; V542-S544 PolarHBondContact O-N 2.95Å
543	F	43.4	Very low	55.4	Low	155 Å²	155	106.4 Å²	106.4	68%	0.68	60%	0.595	S	S	*	*			trans	-78.2	74.5	163.4	-113.2	-91.8	0	0	0	108.8	M540	M540-F543 HydrophobicContact CE-CD2 3.93Å; M540-F543 HydrophobicContact CE-CE2 3.32Å; M540-F543 HydrophobicContact CE-CZ 4.02Å; M540-F543 HydrophobicContact CG-CD2 4.22Å; M540-F543 HydrophobicContact CG-CE2 4.22Å; M540-F543 HydrophobicContact SD-CD2 4.12Å; M540-F543 HydrophobicContact SD-CE2 3.52Å; M540-F543 VanDerWaalsContact SD-CE2 3.52Å
544	S	36.7	Very low	54.5	Low	72 Å²	72	107.4 Å²	107.4	50%	0.503	60%	0.6	S	S	.	*			trans	-62	134.2	149.2	42	0	0	0	0	107.8	V542 D546	V542-S544 PolarHBondContact O-N 2.95Å; S544-D546 PolarHBondContact O-N 3.03Å
545	L	44	Very low	54	Low	173 Å²	173	112.5 Å²	112.5	91%	0.906	63%	0.631	S	S	*	*	S	Bend	trans	-67.8	45.1	-176.3	-163.5	113.1	0	0	0	113.1
546	D	37.6	Very low	53.9	Low	124 Å²	124	110.2 Å²	110.2	66%	0.663	63%	0.632	S	S	*	*			trans	-115.2	117.5	176.8	-75.4	-30.7	0	0	0	109.7	S544 T548	S544-D546 PolarHBondContact O-N 3.03Å; D546-T548 PolarHBondContact O-N 2.99Å; D546-T548 PolarHBondContact O-OG1 2.74Å
547	N	42.8	Very low	54.2	Low	178 Å²	178	110.6 Å²	110.6	95%	0.952	64%	0.644	S	S	*	*			trans	-51.7	74	176.5	-84	-25.4	0	0	0	113.1
548	T	42.4	Very low	55	Low	114 Å²	114	109.9 Å²	109.9	70%	0.699	64%	0.639	S	S	*	*			trans	-125.3	90.2	167.1	-23.9	0	0	0	0	106.2	D546 S550	D546-T548 PolarHBondContact O-N 2.99Å; D546-T548 PolarHBondContact O-OG1 2.74Å; T548-S550 PolarHBondContact O-N 2.72Å
549	T	44.2	Very low	56.3	Low	131 Å²	131	104.6 Å²	104.6	80%	0.804	61%	0.605	S	S	*	*			trans	-59.3	92.2	165.5	43.7	0	0	0	0	107.7	N551	T549-N551 PolarHBondContact O-N 2.91Å
550	S	47.4	Very low	57.8	Low	79 Å²	79	98.1 Å²	98.1	55%	0.552	58%	0.575	S	S	*	*			trans	-65.3	115.5	169.2	55.5	0	0	0	0	107.6	T548 F552	T548-S550 PolarHBondContact O-N 2.72Å; S550-F552 PolarHBondContact O-N 3.08Å
551	N	50.1	Low	59.5	Low	157 Å²	157	99.2 Å²	99.2	84%	0.84	58%	0.579	S	S	*	*			trans	-66.6	79.2	176.5	-74.9	-21.8	0	0	0	110.3	T549 S553	T549-N551 PolarHBondContact O-N 2.91Å; N551-S553 PolarHBondContact O-N 2.93Å
552	F	57.1	Low	61.6	Low	137 Å²	137	98.4 Å²	98.4	60%	0.601	57%	0.567	S	S	*	*			trans	-78.6	96.4	167.4	-164.1	-111.8	0	0	0	107.7	S550 T554	S550-F552 PolarHBondContact O-N 3.08Å; F552-T554 HydrophobicContact CD1-CG2 3.38Å; F552-T554 HydrophobicContact CE1-CG2 3.2Å; F552-T554 HydrophobicContact CZ-CG2 4.32Å; F552-T554 PolarHBondContact O-N 2.94Å
553	S	63.3	Low	63.7	Low	117 Å²	117	94.6 Å²	94.6	82%	0.818	55%	0.549	S	S	*	.			trans	-78.5	85.7	176.8	65.3	0	0	0	0	109.8	N551	N551-S553 PolarHBondContact O-N 2.93Å
554	T	70.2	Confident	66	Low	44 Å²	44	89.7 Å²	89.7	27%	0.27	53%	0.526	S	S	.	.	P	Polyproline II helix	trans	-76.7	144.3	165.3	44.3	0	0	0	0	110.5	F552 C556 E560	F552-T554 HydrophobicContact CD1-CG2 3.38Å; F552-T554 HydrophobicContact CE1-CG2 3.2Å; F552-T554 HydrophobicContact CZ-CG2 4.32Å; F552-T554 PolarHBondContact O-N 2.94Å; T554-C556 PolarHBondContact O-N 3Å; T554-E560 HydrophobicContact CG2-CB 3.8Å
555	V	77	Confident	68.5	Low	111 Å²	111	86.8 Å²	86.8	67%	0.673	50%	0.504	S	S	*	.	P	Polyproline II helix	trans	-62.4	131.3	167.5	-178.3	0	0	0	0	108.7	T558	V555-T558 HydrophobicContact CB-CG2 3.93Å; V555-T558 HydrophobicContact CG1-CG2 4.36Å; V555-T558 WeakPolarHBondContact O-CB 3.39Å; V555-T558 WeakPolarHBondContact O-CG2 3.3Å; V555-T558 PolarHBondContact O-OG1 3.44Å
556	C	78.8	Confident	70.7	Confident	104 Å²	104	80.4 Å²	80.4	70%	0.703	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	145.3	176.2	-64.5	0	0	0	0	111.3	T554	T554-C556 PolarHBondContact O-N 3Å
557	G	80.4	Confident	73.4	Confident	52 Å²	52	75.6 Å²	75.6	54%	0.536	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.9	0.4	-177.6	0	0	0	0	0	114.9
558	T	85.8	Confident	75.8	Confident	22 Å²	22	67.1 Å²	67.1	14%	0.135	40%	0.402	C	S	.	.	S	Bend	trans	-88.5	159.5	-179	58.6	0	0	0	0	112.8	V555 E560 Q561 L562	V555-T558 HydrophobicContact CB-CG2 3.93Å; V555-T558 HydrophobicContact CG1-CG2 4.36Å; V555-T558 WeakPolarHBondContact O-CB 3.39Å; V555-T558 WeakPolarHBondContact O-CG2 3.3Å; V555-T558 PolarHBondContact O-OG1 3.44Å; T558-E560 WeakPolarHBondContact CB-OE2 3.19Å; T558-E560 PolarHBondContact O-N 2.98Å; T558-E560 PolarHBondContact OG1-OE2 3.47Å; T558-Q561 PolarHBondContact O-N 3.32Å; T558-Q561 VanDerWaalsContact O-N 3.16Å; T558-L562 WeakPolarHBondContact O-CG 3.46Å; T558-L562 PolarHBondContact O-N 3.05Å
559	Y	87.6	Confident	78.3	Confident	4 Å²	4	61.7 Å²	61.7	2%	0.016	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.6	-40.4	176.7	174.7	-86.9	0	0	0	112.6	I534 G563 Y564 W565 N567 F591 A594	I534-Y559 HydrophobicContact CD1-CE1 4.02Å; I534-Y559 HydrophobicContact CD1-CE2 4.26Å; I534-Y559 WeakPolarHBondContact CD1-OH 3.5Å; I534-Y559 HydrophobicContact CG2-CE1 3.95Å; Y559-G563 PolarHBondContact O-N 3.38Å; Y559-Y564 VanDerWaalsContact CD2-CB 3.45Å; Y559-Y564 HydrophobicContact CD2-CD2 4.15Å; Y559-Y564 HydrophobicContact CD2-CG 4.33Å; Y559-Y564 WeakPolarHBondContact CE2-O 3.2Å; Y559-Y564 VanDerWaalsContact CZ-C 3.45Å; Y559-Y564 VanDerWaalsContact CZ-O 3.26Å; Y559-Y564 PolarHBondContact O-N 2.85Å; Y559-Y564 PolarHBondContact OH-O 3.35Å; Y559-W565 HydrophobicContact CE1-CD2 4.23Å; Y559-W565 HydrophobicContact CE1-CE3 4.09Å; Y559-W565 HydrophobicContact CE1-CZ3 4.48Å; Y559-W565 WeakPolarHBondContact OH-CA 3.24Å; Y559-N567 PolarHBondContact OH-O 3.24Å; Y559-F591 AromaticContact CD2-CD1 4Å; Y559-F591 HydrophobicContact CD2-CD1 4Å; Y559-F591 HydrophobicContact CD2-CE1 4.28Å; Y559-F591 AromaticContact CE2-CD1 3.9Å; Y559-F591 HydrophobicContact CE2-CD1 3.9Å; Y559-F591 HydrophobicContact CE2-CE1 4.07Å; Y559-A594 HydrophobicContact CD1-CB 4.47Å; Y559-A594 HydrophobicContact CD2-CB 4.02Å; Y559-A594 HydrophobicContact CG-CB 3.85Å
560	E	86.2	Confident	80.5	Confident	25 Å²	25	56 Å²	56	12%	0.117	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-43.5	-178.7	-61.1	83.9	175.8	0	0	112	T554 T558 G563 W565 Y598	T554-E560 HydrophobicContact CG2-CB 3.8Å; T558-E560 WeakPolarHBondContact CB-OE2 3.19Å; T558-E560 PolarHBondContact O-N 2.98Å; T558-E560 PolarHBondContact OG1-OE2 3.47Å; E560-G563 PolarHBondContact O-N 2.93Å; E560-W565 HydrophobicContact CB-CH2 4.42Å; E560-W565 HydrophobicContact CB-CZ2 3.71Å; E560-W565 HydrophobicContact CG-CH2 3.76Å; E560-W565 HydrophobicContact CG-CZ2 3.57Å; E560-W565 PolarHBondContact O-NE1 2.94Å; E560-Y598 PolarHBondContact OE1-OH 3.41Å
561	Q	87.3	Confident	82.7	Confident	88 Å²	88	52.4 Å²	52.4	41%	0.411	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-35.7	-178.1	-172.7	-112.9	-18.7	0	0	112.2	T558 G563	T558-Q561 PolarHBondContact O-N 3.32Å; T558-Q561 VanDerWaalsContact O-N 3.16Å; Q561-G563 PolarHBondContact O-N 3.49Å
562	L	87.7	Confident	84.8	Confident	75 Å²	75	45.5 Å²	45.5	39%	0.393	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-8.7	176.5	-66.7	172.6	0	0	0	113.2	T558 Y564	T558-L562 WeakPolarHBondContact O-CG 3.46Å; T558-L562 PolarHBondContact O-N 3.05Å; L562-Y564 HydrophobicContact CB-CD1 4.08Å; L562-Y564 HydrophobicContact CB-CD2 4.06Å; L562-Y564 HydrophobicContact CB-CE1 3.93Å; L562-Y564 HydrophobicContact CB-CE2 3.92Å; L562-Y564 HydrophobicContact CB-CG 4.15Å; L562-Y564 HydrophobicContact CD1-CD2 4.26Å; L562-Y564 HydrophobicContact CD1-CE2 3.53Å; L562-Y564 HydrophobicContact CG-CE2 4.37Å
563	G	87.5	Confident	86.5	Confident	25 Å²	25	40.5 Å²	40.5	26%	0.258	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.1	26.7	176.8	0	0	0	0	0	114	Y559 E560 Q561 W565 P566	Y559-G563 PolarHBondContact O-N 3.38Å; E560-G563 PolarHBondContact O-N 2.93Å; Q561-G563 PolarHBondContact O-N 3.49Å; G563-W565 PolarHBondContact O-N 3.18Å; G563-W565 VanDerWaalsContact O-N 3.07Å; G563-P566 WeakPolarHBondContact O-CD 3.4Å
564	Y	91.8	Very high	88	Confident	51 Å²	51	35.1 Å²	35.1	20%	0.2	22%	0.217	C	C	.	.			trans	-74.1	8.5	-176.3	-70.3	-17.2	0	0	0	115.3	Y559 L562 P566 N567 N587 A590 F591	Y559-Y564 VanDerWaalsContact CD2-CB 3.45Å; Y559-Y564 HydrophobicContact CD2-CD2 4.15Å; Y559-Y564 HydrophobicContact CD2-CG 4.33Å; Y559-Y564 WeakPolarHBondContact CE2-O 3.2Å; Y559-Y564 VanDerWaalsContact CZ-C 3.45Å; Y559-Y564 VanDerWaalsContact CZ-O 3.26Å; Y559-Y564 PolarHBondContact O-N 2.85Å; Y559-Y564 PolarHBondContact OH-O 3.35Å; L562-Y564 HydrophobicContact CB-CD1 4.08Å; L562-Y564 HydrophobicContact CB-CD2 4.06Å; L562-Y564 HydrophobicContact CB-CE1 3.93Å; L562-Y564 HydrophobicContact CB-CE2 3.92Å; L562-Y564 HydrophobicContact CB-CG 4.15Å; L562-Y564 HydrophobicContact CD1-CD2 4.26Å; L562-Y564 HydrophobicContact CD1-CE2 3.53Å; L562-Y564 HydrophobicContact CG-CE2 4.37Å; Y564-P566 VanDerWaalsContact C-N 3.33Å; Y564-P566 WeakPolarHBondContact O-CD 3.45Å; Y564-P566 VanDerWaalsContact O-N 3.11Å; Y564-N567 WeakPolarHBondContact O-CB 3.1Å; Y564-N567 PolarHBondContact O-N 3.32Å; Y564-N587 PolarHBondContact OH-ND2 3.28Å; Y564-A590 HydrophobicContact CD2-CB 4.4Å; Y564-A590 HydrophobicContact CE2-CB 4.18Å; Y564-F591 AromaticContact CD2-CE1 3.81Å; Y564-F591 HydrophobicContact CD2-CE1 3.81Å; Y564-F591 HydrophobicContact CD2-CZ 4.01Å; Y564-F591 HydrophobicContact CE2-CZ 4.29Å; Y564-F591 HydrophobicContact CG-CE1 4.03Å; Y564-F591 HydrophobicContact CG-CZ 4.32Å
565	W	89.1	Confident	89.2	Confident	11 Å²	11	33 Å²	33	4%	0.042	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-43.9	-39.8	178.9	-57.2	96.4	0	0	0	116.8	D43 P44 R45 I534 Y559 E560 G563 N567 N568	D43-W565 WeakPolarHBondContact OD1-CB 3.09Å; P44-W565 WeakPolarHBondContact CD-O 3.27Å; R45-W565 HydrophobicContact CG-CD2 4.34Å; R45-W565 HydrophobicContact CG-CG 4.23Å; R45-W565 VanDerWaalsContact NE-CD1 3.35Å; I534-W565 HydrophobicContact CG2-CE3 3.74Å; I534-W565 HydrophobicContact CG2-CZ3 3.69Å; Y559-W565 HydrophobicContact CE1-CD2 4.23Å; Y559-W565 HydrophobicContact CE1-CE3 4.09Å; Y559-W565 HydrophobicContact CE1-CZ3 4.48Å; Y559-W565 WeakPolarHBondContact OH-CA 3.24Å; E560-W565 HydrophobicContact CB-CH2 4.42Å; E560-W565 HydrophobicContact CB-CZ2 3.71Å; E560-W565 HydrophobicContact CG-CH2 3.76Å; E560-W565 HydrophobicContact CG-CZ2 3.57Å; E560-W565 PolarHBondContact O-NE1 2.94Å; G563-W565 PolarHBondContact O-N 3.18Å; G563-W565 VanDerWaalsContact O-N 3.07Å; W565-N567 PolarHBondContact O-N 3.21Å; W565-N568 PolarHBondContact O-ND2 3.48Å; W565-N568 VanDerWaalsContact O-ND2 3.08Å
566	P	91	Very high	90.1	Very high	39 Å²	39	30 Å²	30	25%	0.253	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-18.4	177.8	-20.1	32.9	0	0	0	114.5	S42 D43 G563 Y564 N568	S42-P566 WeakPolarHBondContact OG-CB 3.43Å; S42-P566 PolarHBondContact OG-O 3.3Å; D43-P566 HydrophobicContact CB-CG 4.04Å; G563-P566 WeakPolarHBondContact O-CD 3.4Å; Y564-P566 VanDerWaalsContact C-N 3.33Å; Y564-P566 WeakPolarHBondContact O-CD 3.45Å; Y564-P566 VanDerWaalsContact O-N 3.11Å; P566-N568 PolarHBondContact O-N 3.24Å
567	N	93.5	Very high	90.9	Very high	24 Å²	24	29.2 Å²	29.2	13%	0.128	17%	0.172	C	C	.	.			trans	-91.8	78.8	-176.1	-67.1	-5.4	0	0	0	110.2	Y559 Y564 W565 L578 D581 F591	Y559-N567 PolarHBondContact OH-O 3.24Å; Y564-N567 WeakPolarHBondContact O-CB 3.1Å; Y564-N567 PolarHBondContact O-N 3.32Å; W565-N567 PolarHBondContact O-N 3.21Å; N567-L578 HydrophobicContact CB-CD1 4.04Å; N567-D581 PolarHBondContact ND2-OD2 3.09Å; N567-F591 HydrophobicContact CB-CE1 3.84Å; N567-F591 HydrophobicContact CB-CZ 4.44Å
568	N	92.8	Very high	91.6	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	15%	0.146	C	C	.	.			trans	-128.7	175.9	-176.8	60.5	57.6	0	0	0	113.2	S42 P44 W565 P566 D570 A574 A575 Y595	S42-N568 PolarHBondContact O-ND2 2.8Å; P44-N568 WeakPolarHBondContact CG-ND2 3.4Å; W565-N568 PolarHBondContact O-ND2 3.48Å; W565-N568 VanDerWaalsContact O-ND2 3.08Å; P566-N568 PolarHBondContact O-N 3.24Å; N568-D570 WeakPolarHBondContact OD1-CB 3.31Å; N568-D570 PolarHBondContact OD1-N 2.94Å; N568-D570 VanDerWaalsContact OD1-N 3.14Å; N568-A574 CarbonylContact O-C 3.56Å; N568-A574 VanDerWaalsContact O-C 3.26Å; N568-A574 WeakPolarHBondContact O-CB 3.39Å; N568-A575 PolarHBondContact O-N 3.09Å; N568-Y595 VanDerWaalsContact CA-OH 3.3Å; N568-Y595 WeakPolarHBondContact CA-OH 3.34Å
569	F	94.7	Very high	92.1	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.14	C	C	.	.	S	Bend	trans	-104.6	22.6	175.6	-76.2	-69.7	0	0	0	112.5	I527 F530 D571 A575 L578 L579 Y595 Y606 F607	I527-F569 WeakPolarHBondContact CG1-O 3.47Å; F530-F569 HydrophobicContact CB-CB 3.81Å; F530-F569 HydrophobicContact CB-CD2 3.72Å; F530-F569 HydrophobicContact CB-CG 4.06Å; F530-F569 AromaticContact CD2-CD2 3.55Å; F530-F569 HydrophobicContact CD2-CD2 3.55Å; F530-F569 AromaticContact CD2-CE2 3.74Å; F530-F569 HydrophobicContact CD2-CE2 3.74Å; F530-F569 HydrophobicContact CD2-CG 4.19Å; F530-F569 HydrophobicContact CE2-CE2 4.33Å; F530-F569 AromaticContact CG-CD2 3.99Å; F530-F569 HydrophobicContact CG-CD2 3.99Å; F569-D571 VanDerWaalsContact C-N 3.34Å; F569-A575 HydrophobicContact CD1-CB 3.65Å; F569-A575 HydrophobicContact CE1-CB 4.1Å; F569-L578 HydrophobicContact CD1-CD2 4.35Å; F569-L578 HydrophobicContact CD2-CD2 3.52Å; F569-L578 HydrophobicContact CE1-CD2 4.09Å; F569-L578 HydrophobicContact CE2-CD2 3.22Å; F569-L578 HydrophobicContact CE2-CG 4.22Å; F569-L578 HydrophobicContact CG-CD2 4.07Å; F569-L578 HydrophobicContact CZ-CD2 3.5Å; F569-L578 HydrophobicContact CZ-CG 4.09Å; F569-L579 HydrophobicContact CE1-CD2 4.41Å; F569-L579 HydrophobicContact CE1-CG 4.3Å; F569-L579 HydrophobicContact CZ-CD2 4.35Å; F569-Y595 AromaticContact CD2-CE1 3.83Å; F569-Y595 HydrophobicContact CD2-CE1 3.83Å; F569-Y595 HydrophobicContact CD2-CE2 4.28Å; F569-Y595 AromaticContact CD2-CZ 3.59Å; F569-Y595 WeakPolarHBondContact CD2-OH 3.47Å; F569-Y595 HydrophobicContact CE2-CE1 4.45Å; F569-Y595 HydrophobicContact CE2-CE2 4.29Å; F569-Y595 PolarHBondContact N-OH 2.91Å; F569-Y606 HydrophobicContact CE1-CE1 4.43Å; F569-Y606 WeakPolarHBondContact CE1-OH 3.4Å; F569-Y606 HydrophobicContact CE2-CE1 4.11Å; F569-Y606 AromaticContact CZ-CE1 3.65Å; F569-Y606 HydrophobicContact CZ-CE1 3.65Å; F569-Y606 AromaticContact CZ-CZ 3.97Å; F569-Y606 WeakPolarHBondContact CZ-OH 3.45Å; F569-F607 HydrophobicContact CE2-CE1 4.35Å; F569-F607 HydrophobicContact CE2-CZ 4.06Å
570	D	92.1	Very high	92.5	Very high	11 Å²	11	31.1 Å²	31.1	6%	0.059	16%	0.161	C	C	.	.	S	Bend	trans	-74.2	-26.6	-176.4	-75.3	-0	0	0	0	113.2	P35 R50 G532 N568	P35-D570 WeakPolarHBondContact CB-O 3.44Å; P35-D570 WeakPolarHBondContact CG-O 3.29Å; R50-D570 IonicContact NH2-OD2 3.14Å; R50-D570 PolarHBondContact NH2-OD2 3.17Å; G532-D570 WeakPolarHBondContact CA-OD1 3.38Å; G532-D570 PolarHBondContact N-OD1 2.88Å; N568-D570 WeakPolarHBondContact OD1-CB 3.31Å; N568-D570 PolarHBondContact OD1-N 2.94Å; N568-D570 VanDerWaalsContact OD1-N 3.14Å
571	D	92.2	Very high	92.9	Very high	4 Å²	4	32 Å²	32	2%	0.021	17%	0.167	C	C	.	.	S	Bend	trans	-143.6	165.5	179.6	74.6	-91.3	0	0	0	111.4	S37 F569 A573 A574 A575	S37-D571 VanDerWaalsContact CB-OD2 3.28Å; S37-D571 WeakPolarHBondContact CB-OD2 3.12Å; S37-D571 WeakPolarHBondContact OG-CB 3.47Å; S37-D571 PolarHBondContact OG-OD2 3.49Å; F569-D571 VanDerWaalsContact C-N 3.34Å; D571-A573 PolarHBondContact O-N 3.13Å; D571-A573 WeakPolarHBondContact OD2-CB 3.37Å; D571-A573 PolarHBondContact OD2-N 2.89Å; D571-A574 PolarHBondContact O-N 3.22Å; D571-A574 WeakPolarHBondContact OD1-CB 3.41Å; D571-A574 PolarHBondContact OD2-N 3.28Å; D571-A575 VanDerWaalsContact O-CB 3.29Å; D571-A575 WeakPolarHBondContact O-CB 3.23Å; D571-A575 PolarHBondContact O-N 3.09Å
572	F	93.9	Very high	93.3	Very high	11 Å²	11	27.9 Å²	27.9	5%	0.048	15%	0.148	C	C	.	.	H	α-helix	trans	-65.7	-37.8	-173.5	-171.5	-106.8	0	0	0	113.9	A30 F31 S37 Y520 A523 V524 I527 I576	A30-F572 HydrophobicContact CB-CD1 3.86Å; A30-F572 HydrophobicContact CB-CD2 4.03Å; A30-F572 HydrophobicContact CB-CE1 3.96Å; A30-F572 HydrophobicContact CB-CE2 4.14Å; A30-F572 HydrophobicContact CB-CG 3.9Å; A30-F572 HydrophobicContact CB-CZ 4.12Å; A30-F572 WeakPolarHBondContact O-CB 3.5Å; F31-F572 HydrophobicContact CD1-CD1 4.09Å; F31-F572 AromaticContact CD2-CD1 3.88Å; F31-F572 HydrophobicContact CD2-CD1 3.88Å; F31-F572 HydrophobicContact CD2-CE1 4.07Å; F31-F572 AromaticContact CE1-CD1 3.93Å; F31-F572 HydrophobicContact CE1-CD1 3.93Å; F31-F572 HydrophobicContact CE1-CE1 4.43Å; F31-F572 AromaticContact CE2-CD1 3.71Å; F31-F572 HydrophobicContact CE2-CD1 3.71Å; F31-F572 AromaticContact CE2-CE1 3.57Å; F31-F572 HydrophobicContact CE2-CE1 3.57Å; F31-F572 HydrophobicContact CG-CD1 4.07Å; F31-F572 AromaticContact CZ-CD1 3.73Å; F31-F572 HydrophobicContact CZ-CD1 3.73Å; F31-F572 AromaticContact CZ-CE1 3.78Å; F31-F572 HydrophobicContact CZ-CE1 3.78Å; S37-F572 PolarHBondContact OG-N 2.9Å; Y520-F572 HydrophobicContact CD2-CE1 4.45Å; Y520-F572 HydrophobicContact CD2-CE2 4Å; Y520-F572 AromaticContact CD2-CZ 3.47Å; Y520-F572 HydrophobicContact CD2-CZ 3.47Å; Y520-F572 VanDerWaalsContact CD2-CZ 3.47Å; Y520-F572 HydrophobicContact CE2-CE1 4.47Å; Y520-F572 HydrophobicContact CE2-CE2 4.1Å; Y520-F572 AromaticContact CE2-CZ 3.69Å; Y520-F572 HydrophobicContact CE2-CZ 3.69Å; Y520-F572 HydrophobicContact CG-CE2 4.38Å; Y520-F572 HydrophobicContact CG-CZ 4.18Å; A523-F572 HydrophobicContact CB-CD2 4.09Å; A523-F572 HydrophobicContact CB-CE2 3.77Å; V524-F572 HydrophobicContact CG2-CE2 4.18Å; I527-F572 HydrophobicContact CD1-CB 4.27Å; I527-F572 HydrophobicContact CD1-CD2 4.2Å; F572-I576 HydrophobicContact CD1-CD1 3.83Å; F572-I576 HydrophobicContact CE1-CD1 3.44Å; F572-I576 VanDerWaalsContact CE1-CD1 3.44Å; F572-I576 HydrophobicContact CE1-CG1 4.42Å; F572-I576 HydrophobicContact CZ-CD1 3.85Å; F572-I576 HydrophobicContact CZ-CG1 4.47Å; F572-I576 WeakPolarHBondContact O-CG1 3.38Å; F572-I576 PolarHBondContact O-N 2.77Å; F572-I576 VanDerWaalsContact O-N 3.15Å
573	A	93.9	Very high	93.6	Very high	33 Å²	33	25.9 Å²	25.9	27%	0.273	14%	0.137	S	C	.	.	H	α-helix	trans	-69.2	-47.4	176.9	0	0	0	0	0	111.3	F31 S37 D571 A575 I576 I577	F31-A573 HydrophobicContact CD1-CB 4.15Å; F31-A573 HydrophobicContact CE1-CB 3.91Å; S37-A573 PolarHBondContact OG-N 3.02Å; D571-A573 PolarHBondContact O-N 3.13Å; D571-A573 WeakPolarHBondContact OD2-CB 3.37Å; D571-A573 PolarHBondContact OD2-N 2.89Å; A573-A575 VanDerWaalsContact C-N 3.31Å; A573-A575 PolarHBondContact O-N 3.07Å; A573-I576 PolarHBondContact O-N 3.09Å; A573-I577 WeakPolarHBondContact O-CG1 3.29Å; A573-I577 PolarHBondContact O-N 3.26Å; A573-I577 VanDerWaalsContact O-N 3.17Å
574	A	93.9	Very high	93.9	Very high	3 Å²	3	29 Å²	29	3%	0.025	15%	0.147	C	C	.	.	H	α-helix	trans	-59	-42.6	175.5	0	0	0	0	0	111.9	N568 D571 I576 I577 L578	N568-A574 CarbonylContact O-C 3.56Å; N568-A574 VanDerWaalsContact O-C 3.26Å; N568-A574 WeakPolarHBondContact O-CB 3.39Å; D571-A574 PolarHBondContact O-N 3.22Å; D571-A574 WeakPolarHBondContact OD1-CB 3.41Å; D571-A574 PolarHBondContact OD2-N 3.28Å; A574-I576 VanDerWaalsContact C-N 3.34Å; A574-I576 PolarHBondContact O-N 3.09Å; A574-I577 PolarHBondContact O-N 3.46Å; A574-L578 PolarHBondContact O-N 2.57Å
575	A	95.9	Very high	94	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-59.6	-41	176.5	0	0	0	0	0	112.5	A523 I527 N568 F569 D571 A573 L579	A523-A575 HydrophobicContact CB-CB 4.03Å; I527-A575 HydrophobicContact CD1-CB 4.38Å; I527-A575 HydrophobicContact CG1-CB 4.21Å; N568-A575 PolarHBondContact O-N 3.09Å; F569-A575 HydrophobicContact CD1-CB 3.65Å; F569-A575 HydrophobicContact CE1-CB 4.1Å; D571-A575 VanDerWaalsContact O-CB 3.29Å; D571-A575 WeakPolarHBondContact O-CB 3.23Å; D571-A575 PolarHBondContact O-N 3.09Å; A573-A575 VanDerWaalsContact C-N 3.31Å; A573-A575 PolarHBondContact O-N 3.07Å; A575-L579 WeakPolarHBondContact O-CB 3.38Å; A575-L579 WeakPolarHBondContact O-CG 3.5Å; A575-L579 PolarHBondContact O-N 3.41Å
576	I	96.1	Very high	94.1	Very high	48 Å²	48	31.7 Å²	31.7	25%	0.246	17%	0.166	C	C	.	.	H	α-helix	trans	-63.4	-43.6	176.5	-71.8	166.6	0	0	0	111.1	F31 Y519 A523 F572 A573 A574 L579 Y580	F31-I576 HydrophobicContact CE1-CD1 4.47Å; F31-I576 HydrophobicContact CZ-CD1 3.93Å; Y519-I576 HydrophobicContact CD1-CG2 4.5Å; A523-I576 HydrophobicContact CB-CG1 4.44Å; F572-I576 HydrophobicContact CD1-CD1 3.83Å; F572-I576 HydrophobicContact CE1-CD1 3.44Å; F572-I576 VanDerWaalsContact CE1-CD1 3.44Å; F572-I576 HydrophobicContact CE1-CG1 4.42Å; F572-I576 HydrophobicContact CZ-CD1 3.85Å; F572-I576 HydrophobicContact CZ-CG1 4.47Å; F572-I576 WeakPolarHBondContact O-CG1 3.38Å; F572-I576 PolarHBondContact O-N 2.77Å; F572-I576 VanDerWaalsContact O-N 3.15Å; A573-I576 PolarHBondContact O-N 3.09Å; A574-I576 VanDerWaalsContact C-N 3.34Å; A574-I576 PolarHBondContact O-N 3.09Å; I576-L579 PolarHBondContact O-N 2.92Å; I576-Y580 WeakPolarHBondContact O-CB 3.33Å; I576-Y580 PolarHBondContact O-N 3.48Å
577	I	95.6	Very high	94.2	Very high	88 Å²	88	32.4 Å²	32.4	45%	0.451	17%	0.167	S	C	.	.	H	α-helix	trans	-66	-45.5	179.6	-61.7	-57.6	0	0	0	110.9	A573 A574 L579 Y580 D581	A573-I577 WeakPolarHBondContact O-CG1 3.29Å; A573-I577 PolarHBondContact O-N 3.26Å; A573-I577 VanDerWaalsContact O-N 3.17Å; A574-I577 PolarHBondContact O-N 3.46Å; I577-L579 VanDerWaalsContact C-N 3.32Å; I577-L579 PolarHBondContact O-N 3.29Å; I577-Y580 WeakPolarHBondContact O-CA 3.41Å; I577-Y580 WeakPolarHBondContact O-CB 3.44Å; I577-Y580 PolarHBondContact O-N 2.93Å; I577-Y580 VanDerWaalsContact O-N 3.1Å; I577-D581 PolarHBondContact O-N 3.17Å
578	L	95.3	Very high	94.2	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-60	-42.4	175.9	174.4	60.5	0	0	0	111.8	N567 F569 A574 Y580 D581 V582 F591 Y595	N567-L578 HydrophobicContact CB-CD1 4.04Å; F569-L578 HydrophobicContact CD1-CD2 4.35Å; F569-L578 HydrophobicContact CD2-CD2 3.52Å; F569-L578 HydrophobicContact CE1-CD2 4.09Å; F569-L578 HydrophobicContact CE2-CD2 3.22Å; F569-L578 HydrophobicContact CE2-CG 4.22Å; F569-L578 HydrophobicContact CG-CD2 4.07Å; F569-L578 HydrophobicContact CZ-CD2 3.5Å; F569-L578 HydrophobicContact CZ-CG 4.09Å; A574-L578 PolarHBondContact O-N 2.57Å; L578-Y580 VanDerWaalsContact C-N 3.31Å; L578-Y580 PolarHBondContact O-N 2.91Å; L578-D581 PolarHBondContact O-N 3.41Å; L578-V582 HydrophobicContact CD1-CG2 4.29Å; L578-V582 WeakPolarHBondContact O-CG2 3.44Å; L578-V582 PolarHBondContact O-N 3.21Å; L578-F591 HydrophobicContact CD1-CB 4.39Å; L578-F591 HydrophobicContact CD1-CD1 3.72Å; L578-F591 HydrophobicContact CD1-CD2 4.29Å; L578-F591 HydrophobicContact CD1-CE1 4.04Å; L578-F591 HydrophobicContact CD1-CG 3.88Å; L578-F591 HydrophobicContact CD1-CZ 4.48Å; L578-Y595 HydrophobicContact CD2-CE2 3.94Å
579	L	97	Very high	94.1	Very high	1 Å²	1	33.8 Å²	33.8	1%	0.005	17%	0.173	C	C	.	.	H	α-helix	trans	-63.9	-36.2	175.3	-73.9	175.4	0	0	0	112.5	Y519 F522 A523 F569 A575 I576 I577 M583 W610	Y519-L579 HydrophobicContact CD1-CB 4.02Å; Y519-L579 HydrophobicContact CD1-CD1 4.25Å; Y519-L579 HydrophobicContact CE1-CB 3.74Å; F522-L579 HydrophobicContact CB-CD1 3.91Å; F522-L579 HydrophobicContact CB-CD2 4.34Å; A523-L579 HydrophobicContact CB-CD1 3.91Å; F569-L579 HydrophobicContact CE1-CD2 4.41Å; F569-L579 HydrophobicContact CE1-CG 4.3Å; F569-L579 HydrophobicContact CZ-CD2 4.35Å; A575-L579 WeakPolarHBondContact O-CB 3.38Å; A575-L579 WeakPolarHBondContact O-CG 3.5Å; A575-L579 PolarHBondContact O-N 3.41Å; I576-L579 PolarHBondContact O-N 2.92Å; I577-L579 VanDerWaalsContact C-N 3.32Å; I577-L579 PolarHBondContact O-N 3.29Å; L579-M583 WeakPolarHBondContact O-CB 3.29Å; L579-M583 PolarHBondContact O-N 2.93Å; L579-W610 HydrophobicContact CB-CH2 4.35Å; L579-W610 HydrophobicContact CB-CZ2 3.73Å; L579-W610 HydrophobicContact CD1-CH2 4.47Å; L579-W610 HydrophobicContact CD2-CD2 3.71Å; L579-W610 HydrophobicContact CD2-CE3 4.21Å; L579-W610 HydrophobicContact CD2-CG 3.91Å; L579-W610 HydrophobicContact CD2-CZ2 4.16Å; L579-W610 HydrophobicContact CG-CZ2 4.38Å; L579-W610 PolarHBondContact O-NE1 3.14Å
580	Y	95.8	Very high	94	Very high	116 Å²	116	34.4 Å²	34.4	46%	0.455	18%	0.178	S	C	.	.	H	α-helix	trans	-64.9	-45.7	173.9	172.6	-96.7	0	0	0	111.7	I576 I577 L578 V582 M583 I584	I576-Y580 WeakPolarHBondContact O-CB 3.33Å; I576-Y580 PolarHBondContact O-N 3.48Å; I577-Y580 WeakPolarHBondContact O-CA 3.41Å; I577-Y580 WeakPolarHBondContact O-CB 3.44Å; I577-Y580 PolarHBondContact O-N 2.93Å; I577-Y580 VanDerWaalsContact O-N 3.1Å; L578-Y580 VanDerWaalsContact C-N 3.31Å; L578-Y580 PolarHBondContact O-N 2.91Å; Y580-V582 VanDerWaalsContact C-N 3.32Å; Y580-V582 PolarHBondContact O-N 3.35Å; Y580-M583 HydrophobicContact CD2-CE 3.71Å; Y580-M583 HydrophobicContact CE2-CE 3.97Å; Y580-M583 WeakPolarHBondContact O-CB 3.49Å; Y580-M583 PolarHBondContact O-N 3.32Å; Y580-M583 VanDerWaalsContact O-N 3.09Å; Y580-I584 HydrophobicContact CD1-CD1 4.12Å; Y580-I584 HydrophobicContact CE1-CD1 3.48Å; Y580-I584 VanDerWaalsContact CE1-CD1 3.48Å; Y580-I584 HydrophobicContact CE2-CD1 4.31Å; Y580-I584 PolarHBondContact O-N 2.86Å
581	D	94.4	Very high	94.1	Very high	44 Å²	44	34.2 Å²	34.2	24%	0.235	18%	0.177	C	C	.	.	H	α-helix	trans	-60.9	-42.1	177.5	-71.1	-14.1	0	0	0	111.3	N567 I577 L578 I584 F591	N567-D581 PolarHBondContact ND2-OD2 3.09Å; I577-D581 PolarHBondContact O-N 3.17Å; L578-D581 PolarHBondContact O-N 3.41Å; D581-I584 PolarHBondContact O-N 3.21Å; D581-F591 HydrophobicContact CB-CE2 4.23Å; D581-F591 HydrophobicContact CB-CZ 4.48Å
582	V	95	Very high	94.2	Very high	1 Å²	1	34.2 Å²	34.2	1%	0.006	18%	0.177	C	C	.	.	H	α-helix	trans	-69.1	-32.4	175	-178.9	0	0	0	0	112	L578 Y580 I584 V585 W588 F591 F607	L578-V582 HydrophobicContact CD1-CG2 4.29Å; L578-V582 WeakPolarHBondContact O-CG2 3.44Å; L578-V582 PolarHBondContact O-N 3.21Å; Y580-V582 VanDerWaalsContact C-N 3.32Å; Y580-V582 PolarHBondContact O-N 3.35Å; V582-I584 VanDerWaalsContact C-N 3.28Å; V582-I584 PolarHBondContact O-N 3.49Å; V582-V585 PolarHBondContact O-N 3.32Å; V582-W588 HydrophobicContact CG1-CB 4.33Å; V582-W588 HydrophobicContact CG1-CE3 4.41Å; V582-F591 HydrophobicContact CG2-CD2 4.02Å; V582-F607 HydrophobicContact CG1-CD1 4.31Å; V582-F607 HydrophobicContact CG2-CD1 4.15Å; V582-F607 HydrophobicContact CG2-CE1 4.18Å
583	M	94.8	Very high	94.1	Very high	33 Å²	33	38.8 Å²	38.8	16%	0.163	20%	0.198	C	C	.	.	H	α-helix	trans	-63.3	-33.2	176.5	179.6	-173.3	70.9	0	0	112.2	Y519 L579 Y580 V585 W610 V619	Y519-M583 HydrophobicContact CE2-SD 4.21Å; Y519-M583 WeakPolarHBondContact OH-CE 3.44Å; Y519-M583 PolarHBondContact OH-SD 3.44Å; L579-M583 WeakPolarHBondContact O-CB 3.29Å; L579-M583 PolarHBondContact O-N 2.93Å; Y580-M583 HydrophobicContact CD2-CE 3.71Å; Y580-M583 HydrophobicContact CE2-CE 3.97Å; Y580-M583 WeakPolarHBondContact O-CB 3.49Å; Y580-M583 PolarHBondContact O-N 3.32Å; Y580-M583 VanDerWaalsContact O-N 3.09Å; M583-V585 WeakPolarHBondContact O-CG2 3.37Å; M583-V585 PolarHBondContact O-N 2.99Å; M583-W610 HydrophobicContact CB-CZ2 4.48Å; M583-V619 HydrophobicContact CG-CG2 4.27Å
584	I	92.7	Very high	94	Very high	92 Å²	92	37.4 Å²	37.4	47%	0.472	19%	0.187	S	C	.	.	H	α-helix	trans	-70.9	-21.3	175.6	-64.3	172.7	0	0	0	111.6	Y580 D581 V582 N586	Y580-I584 HydrophobicContact CD1-CD1 4.12Å; Y580-I584 HydrophobicContact CE1-CD1 3.48Å; Y580-I584 VanDerWaalsContact CE1-CD1 3.48Å; Y580-I584 HydrophobicContact CE2-CD1 4.31Å; Y580-I584 PolarHBondContact O-N 2.86Å; D581-I584 PolarHBondContact O-N 3.21Å; V582-I584 VanDerWaalsContact C-N 3.28Å; V582-I584 PolarHBondContact O-N 3.49Å; I584-N586 HydrophobicContact CG2-CB 4.29Å; I584-N586 PolarHBondContact O-N 3.37Å
585	V	93.8	Very high	94	Very high	15 Å²	15	37.3 Å²	37.3	9%	0.091	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.5	4	176.5	-160.3	0	0	0	0	114.2	T202 V582 M583 W588 S615	T202-V585 VanDerWaalsContact CB-CG1 3.41Å; T202-V585 HydrophobicContact CG2-CG1 3.72Å; T202-V585 WeakPolarHBondContact OG1-CG1 3.29Å; V582-V585 PolarHBondContact O-N 3.32Å; M583-V585 WeakPolarHBondContact O-CG2 3.37Å; M583-V585 PolarHBondContact O-N 2.99Å; V585-W588 HydrophobicContact CG1-CG 4.24Å; V585-S615 WeakPolarHBondContact CG2-OG 3.27Å
586	N	91.9	Very high	93.9	Very high	103 Å²	103	37.7 Å²	37.7	55%	0.551	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.5	135	173.7	-170	25.6	0	0	0	111.1	I584 W588	I584-N586 HydrophobicContact CG2-CB 4.29Å; I584-N586 PolarHBondContact O-N 3.37Å; N586-W588 PolarHBondContact O-N 2.91Å
587	N	92.1	Very high	93.6	Very high	53 Å²	53	41.7 Å²	41.7	28%	0.283	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.2	17.4	-178.8	-68.1	-14.1	0	0	0	115.5	Y564 Q589 A590	Y564-N587 PolarHBondContact OH-ND2 3.28Å; N587-Q589 PolarHBondContact O-N 3.46Å; N587-Q589 VanDerWaalsContact O-N 3.07Å; N587-A590 WeakPolarHBondContact O-CB 3.33Å; N587-A590 PolarHBondContact O-N 3.22Å
588	W	93.8	Very high	93.3	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-64.2	-22.5	-173.1	79.7	-75.2	0	0	0	113.2	L198 V199 T202 V582 V585 N586 A590 F591 M592 F607 V608	L198-W588 HydrophobicContact CD2-CH2 4.39Å; V199-W588 HydrophobicContact CG2-CH2 4.46Å; V199-W588 HydrophobicContact CG2-CZ2 3.78Å; T202-W588 PolarHBondContact OG1-NE1 3.12Å; V582-W588 HydrophobicContact CG1-CB 4.33Å; V582-W588 HydrophobicContact CG1-CE3 4.41Å; V585-W588 HydrophobicContact CG1-CG 4.24Å; N586-W588 PolarHBondContact O-N 2.91Å; W588-A590 PolarHBondContact O-N 3.03Å; W588-F591 PolarHBondContact O-N 3.5Å; W588-M592 HydrophobicContact CE3-CB 4.37Å; W588-M592 HydrophobicContact CE3-CE 4.38Å; W588-M592 HydrophobicContact CE3-SD 4.47Å; W588-M592 HydrophobicContact CH2-CE 3.86Å; W588-M592 HydrophobicContact CH2-SD 3.9Å; W588-M592 HydrophobicContact CZ2-CE 4.35Å; W588-M592 HydrophobicContact CZ3-CB 4.38Å; W588-M592 HydrophobicContact CZ3-CE 3.87Å; W588-M592 HydrophobicContact CZ3-SD 3.64Å; W588-M592 PolarHBondContact O-N 3.39Å; W588-F607 HydrophobicContact CE3-CB 4.47Å; W588-F607 HydrophobicContact CZ3-CB 4.08Å; W588-V608 HydrophobicContact CH2-CG2 4.35Å
589	Q	92.3	Very high	93.2	Very high	54 Å²	54	44.4 Å²	44.4	25%	0.252	21%	0.212	S	C	.	.	H	α-helix	trans	-57	-35.7	171.6	62.4	175	-10.7	0	0	113	V199 N205 N587 M592 E593	V199-Q589 HydrophobicContact CG1-CB 3.84Å; V199-Q589 HydrophobicContact CG1-CG 4.27Å; V199-Q589 HydrophobicContact CG2-CB 4.01Å; N205-Q589 VanDerWaalsContact CB-OE1 3.31Å; N587-Q589 PolarHBondContact O-N 3.46Å; N587-Q589 VanDerWaalsContact O-N 3.07Å; Q589-M592 PolarHBondContact O-N 3.01Å; Q589-E593 WeakPolarHBondContact O-CB 3.35Å; Q589-E593 PolarHBondContact O-N 3.27Å
590	A	92.4	Very high	93	Very high	13 Å²	13	46.9 Å²	46.9	11%	0.107	23%	0.229	C	C	.	.	H	α-helix	trans	-67.1	-39.4	-179.7	0	0	0	0	0	111.2	Y564 N587 W588 A594	Y564-A590 HydrophobicContact CD2-CB 4.4Å; Y564-A590 HydrophobicContact CE2-CB 4.18Å; N587-A590 WeakPolarHBondContact O-CB 3.33Å; N587-A590 PolarHBondContact O-N 3.22Å; W588-A590 PolarHBondContact O-N 3.03Å; A590-A594 WeakPolarHBondContact O-CB 3.48Å; A590-A594 PolarHBondContact O-N 2.89Å
591	F	94.1	Very high	92.7	Very high	6 Å²	6	46.4 Å²	46.4	3%	0.026	23%	0.231	C	C	.	.	H	α-helix	trans	-67.6	-49.7	174.3	-56.5	-61	0	0	0	111	Y559 Y564 N567 L578 D581 V582 W588 E593 A594 Y595 F607	Y559-F591 AromaticContact CD2-CD1 4Å; Y559-F591 HydrophobicContact CD2-CD1 4Å; Y559-F591 HydrophobicContact CD2-CE1 4.28Å; Y559-F591 AromaticContact CE2-CD1 3.9Å; Y559-F591 HydrophobicContact CE2-CD1 3.9Å; Y559-F591 HydrophobicContact CE2-CE1 4.07Å; Y564-F591 AromaticContact CD2-CE1 3.81Å; Y564-F591 HydrophobicContact CD2-CE1 3.81Å; Y564-F591 HydrophobicContact CD2-CZ 4.01Å; Y564-F591 HydrophobicContact CE2-CZ 4.29Å; Y564-F591 HydrophobicContact CG-CE1 4.03Å; Y564-F591 HydrophobicContact CG-CZ 4.32Å; N567-F591 HydrophobicContact CB-CE1 3.84Å; N567-F591 HydrophobicContact CB-CZ 4.44Å; L578-F591 HydrophobicContact CD1-CB 4.39Å; L578-F591 HydrophobicContact CD1-CD1 3.72Å; L578-F591 HydrophobicContact CD1-CD2 4.29Å; L578-F591 HydrophobicContact CD1-CE1 4.04Å; L578-F591 HydrophobicContact CD1-CG 3.88Å; L578-F591 HydrophobicContact CD1-CZ 4.48Å; D581-F591 HydrophobicContact CB-CE2 4.23Å; D581-F591 HydrophobicContact CB-CZ 4.48Å; V582-F591 HydrophobicContact CG2-CD2 4.02Å; W588-F591 PolarHBondContact O-N 3.5Å; F591-E593 VanDerWaalsContact C-N 3.32Å; F591-E593 PolarHBondContact O-N 3.01Å; F591-A594 PolarHBondContact O-N 3.47Å; F591-Y595 VanDerWaalsContact O-CD2 3.29Å; F591-Y595 WeakPolarHBondContact O-CD2 3.22Å; F591-Y595 PolarHBondContact O-N 2.93Å; F591-F607 HydrophobicContact CB-CE1 4.46Å
592	M	94	Very high	92.6	Very high	5 Å²	5	54.2 Å²	54.2	3%	0.025	26%	0.258	C	S	.	.	H	α-helix	trans	-58.2	-43.3	-179.7	178.2	178.9	49.7	0	0	111.9	T195 V199 W588 Q589 S596 K604 F607	T195-M592 HydrophobicContact CG2-CE 3.34Å; T195-M592 HydrophobicContact CG2-SD 3.91Å; V199-M592 HydrophobicContact CG2-CE 3.65Å; W588-M592 HydrophobicContact CE3-CB 4.37Å; W588-M592 HydrophobicContact CE3-CE 4.38Å; W588-M592 HydrophobicContact CE3-SD 4.47Å; W588-M592 HydrophobicContact CH2-CE 3.86Å; W588-M592 HydrophobicContact CH2-SD 3.9Å; W588-M592 HydrophobicContact CZ2-CE 4.35Å; W588-M592 HydrophobicContact CZ3-CB 4.38Å; W588-M592 HydrophobicContact CZ3-CE 3.87Å; W588-M592 HydrophobicContact CZ3-SD 3.64Å; W588-M592 PolarHBondContact O-N 3.39Å; Q589-M592 PolarHBondContact O-N 3.01Å; M592-S596 VanDerWaalsContact O-CB 3.29Å; M592-S596 WeakPolarHBondContact O-CB 3.45Å; M592-S596 PolarHBondContact O-N 3.43Å; M592-K604 HydrophobicContact CG-CB 4.32Å; M592-K604 HydrophobicContact CG-CG 3.78Å; M592-K604 HydrophobicContact SD-CB 4.24Å; M592-K604 HydrophobicContact SD-CG 4.07Å; M592-F607 HydrophobicContact CB-CB 4.46Å; M592-F607 HydrophobicContact CB-CD2 4.32Å; M592-F607 HydrophobicContact CB-CG 4.37Å; M592-F607 HydrophobicContact CG-CB 4.42Å; M592-F607 HydrophobicContact CG-CD2 4.39Å
593	E	91.1	Very high	92.5	Very high	107 Å²	107	54.3 Å²	54.3	50%	0.5	26%	0.259	S	S	.	.	H	α-helix	trans	-69.4	-41.3	177.8	-165.9	-173.8	153.6	0	0	112.2	Q589 F591 S596 R597	Q589-E593 WeakPolarHBondContact O-CB 3.35Å; Q589-E593 PolarHBondContact O-N 3.27Å; F591-E593 VanDerWaalsContact C-N 3.32Å; F591-E593 PolarHBondContact O-N 3.01Å; E593-S596 WeakPolarHBondContact O-CB 3.42Å; E593-S596 PolarHBondContact O-N 2.82Å; E593-R597 WeakPolarHBondContact O-CB 3.26Å; E593-R597 PolarHBondContact O-N 3.36Å; E593-R597 IonicContact OE1-NH2 3.89Å; E593-R597 PolarHBondContact OE1-NH2 3.1Å
594	A	92.3	Very high	92.5	Very high	4 Å²	4	54.2 Å²	54.2	3%	0.033	26%	0.257	C	S	.	.	H	α-helix	trans	-58.7	-51.8	176.8	0	0	0	0	0	111.2	Y559 A590 F591 S596 R597 Y598	Y559-A594 HydrophobicContact CD1-CB 4.47Å; Y559-A594 HydrophobicContact CD2-CB 4.02Å; Y559-A594 HydrophobicContact CG-CB 3.85Å; A590-A594 WeakPolarHBondContact O-CB 3.48Å; A590-A594 PolarHBondContact O-N 2.89Å; F591-A594 PolarHBondContact O-N 3.47Å; A594-S596 VanDerWaalsContact C-N 3.3Å; A594-S596 PolarHBondContact O-N 3.15Å; A594-R597 WeakPolarHBondContact O-CB 3.35Å; A594-R597 PolarHBondContact O-N 3.47Å; A594-R597 VanDerWaalsContact O-N 3.11Å; A594-Y598 HydrophobicContact CB-CD2 4.4Å; A594-Y598 WeakPolarHBondContact O-CD2 2.87Å; A594-Y598 PolarHBondContact O-N 2.9Å
595	Y	93.9	Very high	92.6	Very high	1 Å²	1	53.5 Å²	53.5	0%	0.004	26%	0.257	C	S	.	.	H	α-helix	trans	-66.5	-31.7	178.8	-80	-79.3	0	0	0	112.9	F530 A533 I534 N568 F569 L578 F591 R597 T599 F607	F530-Y595 HydrophobicContact CB-CD1 4.11Å; F530-Y595 HydrophobicContact CB-CE1 3.76Å; F530-Y595 AromaticContact CD1-CD1 3.89Å; F530-Y595 HydrophobicContact CD1-CD1 3.89Å; F530-Y595 HydrophobicContact CD1-CE1 4.41Å; F530-Y595 HydrophobicContact CE1-CD1 4.48Å; F530-Y595 AromaticContact CG-CD1 3.96Å; F530-Y595 HydrophobicContact CG-CD1 3.96Å; F530-Y595 HydrophobicContact CG-CE1 4.07Å; A533-Y595 HydrophobicContact CB-CE1 4.47Å; I534-Y595 HydrophobicContact CD1-CE1 3.95Å; I534-Y595 HydrophobicContact CD1-CE2 3.87Å; I534-Y595 WeakPolarHBondContact CD1-OH 3.47Å; I534-Y595 HydrophobicContact CG1-CE1 4.14Å; N568-Y595 VanDerWaalsContact CA-OH 3.3Å; N568-Y595 WeakPolarHBondContact CA-OH 3.34Å; F569-Y595 AromaticContact CD2-CE1 3.83Å; F569-Y595 HydrophobicContact CD2-CE1 3.83Å; F569-Y595 HydrophobicContact CD2-CE2 4.28Å; F569-Y595 AromaticContact CD2-CZ 3.59Å; F569-Y595 WeakPolarHBondContact CD2-OH 3.47Å; F569-Y595 HydrophobicContact CE2-CE1 4.45Å; F569-Y595 HydrophobicContact CE2-CE2 4.29Å; F569-Y595 PolarHBondContact N-OH 2.91Å; L578-Y595 HydrophobicContact CD2-CE2 3.94Å; F591-Y595 VanDerWaalsContact O-CD2 3.29Å; F591-Y595 WeakPolarHBondContact O-CD2 3.22Å; F591-Y595 PolarHBondContact O-N 2.93Å; Y595-R597 VanDerWaalsContact C-N 3.3Å; Y595-R597 PolarHBondContact O-N 3.22Å; Y595-T599 PolarHBondContact O-N 2.83Å; Y595-T599 PolarHBondContact O-OG1 3.32Å; Y595-F607 HydrophobicContact CD2-CE1 4.48Å; Y595-F607 AromaticContact CD2-CE2 3.9Å; Y595-F607 HydrophobicContact CD2-CE2 3.9Å; Y595-F607 AromaticContact CD2-CZ 3.42Å; Y595-F607 HydrophobicContact CD2-CZ 3.42Å; Y595-F607 VanDerWaalsContact CD2-CZ 3.42Å; Y595-F607 HydrophobicContact CE2-CZ 4.02Å; Y595-F607 AromaticContact CG-CE2 3.9Å; Y595-F607 HydrophobicContact CG-CE2 3.9Å; Y595-F607 AromaticContact CG-CZ 3.84Å; Y595-F607 HydrophobicContact CG-CZ 3.84Å
596	S	92.8	Very high	92.7	Very high	7 Å²	7	53.4 Å²	53.4	5%	0.049	26%	0.255	C	S	.	.	H	α-helix	trans	-60.2	-41.6	171.6	-160.9	0	0	0	0	111.9	M592 E593 A594 S600 E601 S603 K604	M592-S596 VanDerWaalsContact O-CB 3.29Å; M592-S596 WeakPolarHBondContact O-CB 3.45Å; M592-S596 PolarHBondContact O-N 3.43Å; E593-S596 WeakPolarHBondContact O-CB 3.42Å; E593-S596 PolarHBondContact O-N 2.82Å; A594-S596 VanDerWaalsContact C-N 3.3Å; A594-S596 PolarHBondContact O-N 3.15Å; S596-S600 WeakPolarHBondContact CA-O 3.5Å; S596-S600 CarbonylContact O-C 3.44Å; S596-S600 PolarHBondContact O-N 2.85Å; S596-E601 WeakPolarHBondContact OG-CA 3.41Å; S596-E601 PolarHBondContact OG-OE1 3.23Å; S596-E601 PolarHBondContact OG-OE2 3.08Å; S596-S603 VanDerWaalsContact CA-OG 3.3Å; S596-S603 WeakPolarHBondContact CA-OG 3.37Å; S596-S603 PolarHBondContact N-OG 3.32Å; S596-K604 VanDerWaalsContact OG-CE 3.29Å; S596-K604 WeakPolarHBondContact OG-CE 3.34Å
597	R	90.6	Very high	92.9	Very high	133 Å²	133	48.6 Å²	48.6	50%	0.502	23%	0.229	S	C	.	.	H	α-helix	trans	-73.8	-42	-180	-169.7	-176	-61.4	166	0.9	112.8	E593 A594 Y595	E593-R597 WeakPolarHBondContact O-CB 3.26Å; E593-R597 PolarHBondContact O-N 3.36Å; E593-R597 IonicContact OE1-NH2 3.89Å; E593-R597 PolarHBondContact OE1-NH2 3.1Å; A594-R597 WeakPolarHBondContact O-CB 3.35Å; A594-R597 PolarHBondContact O-N 3.47Å; A594-R597 VanDerWaalsContact O-N 3.11Å; Y595-R597 VanDerWaalsContact C-N 3.3Å; Y595-R597 PolarHBondContact O-N 3.22Å
598	Y	89.8	Confident	93.1	Very high	87 Å²	87	48.2 Å²	48.2	34%	0.341	23%	0.228	S	C	.	.	H	α-helix	trans	-81.8	-22.3	-176.6	-74	-67.2	0	0	0	113.9	I534 E560 A594	I534-Y598 HydrophobicContact CG1-CD2 4.35Å; E560-Y598 PolarHBondContact OE1-OH 3.41Å; A594-Y598 HydrophobicContact CB-CD2 4.4Å; A594-Y598 WeakPolarHBondContact O-CD2 2.87Å; A594-Y598 PolarHBondContact O-N 2.9Å
599	T	92.3	Very high	93.1	Very high	58 Å²	58	51 Å²	51	36%	0.356	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-122.7	-79.3	-177.8	65.4	0	0	0	0	113	F530 A533 Y595	F530-T599 HydrophobicContact CD1-CG2 3.95Å; F530-T599 HydrophobicContact CE1-CG2 4.48Å; A533-T599 HydrophobicContact CB-CG2 3.54Å; Y595-T599 PolarHBondContact O-N 2.83Å; Y595-T599 PolarHBondContact O-OG1 3.32Å
600	S	92.8	Very high	93.3	Very high	52 Å²	52	48.4 Å²	48.4	36%	0.364	24%	0.235	S	C	.	.			trans	-163.4	158.7	178.6	67.1	0	0	0	0	111.1	S596 W602 S603	S596-S600 WeakPolarHBondContact CA-O 3.5Å; S596-S600 CarbonylContact O-C 3.44Å; S596-S600 PolarHBondContact O-N 2.85Å; S600-W602 PolarHBondContact O-N 3.34Å; S600-W602 VanDerWaalsContact O-N 3.15Å; S600-S603 VanDerWaalsContact O-CB 3.25Å; S600-S603 WeakPolarHBondContact O-CB 3.39Å; S600-S603 PolarHBondContact O-N 3.49Å; S600-S603 PolarHBondContact O-OG 3.42Å
601	E	89.8	Confident	93.4	Very high	106 Å²	106	48.2 Å²	48.2	50%	0.495	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-24.5	174.1	-67	-66.4	127.8	0	0	113.7	S596 S603 K604	S596-E601 WeakPolarHBondContact OG-CA 3.41Å; S596-E601 PolarHBondContact OG-OE1 3.23Å; S596-E601 PolarHBondContact OG-OE2 3.08Å; E601-S603 PolarHBondContact O-N 3.48Å; E601-K604 WeakPolarHBondContact O-CB 3.38Å; E601-K604 WeakPolarHBondContact O-CG 3.29Å; E601-K604 PolarHBondContact O-N 2.91Å; E601-K604 WeakPolarHBondContact OE2-CE 3.46Å; E601-K604 IonicContact OE2-NZ 3.6Å; E601-K604 PolarHBondContact OE2-NZ 3.35Å
602	W	91.9	Very high	93.3	Very high	208 Å²	208	50.2 Å²	50.2	79%	0.788	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-18.8	176.6	-67.4	108	0	0	0	113.4	S600 K604 V605	S600-W602 PolarHBondContact O-N 3.34Å; S600-W602 VanDerWaalsContact O-N 3.15Å; W602-K604 PolarHBondContact O-N 2.95Å; W602-V605 HydrophobicContact CE3-CG2 4.08Å; W602-V605 WeakPolarHBondContact O-CB 3.38Å; W602-V605 PolarHBondContact O-N 3.15Å
603	S	94.4	Very high	93.2	Very high	4 Å²	4	51.9 Å²	51.9	3%	0.028	25%	0.253	C	S	.	.	H	α-helix	trans	-58.1	-28.2	173.4	64.3	0	0	0	0	112.4	S596 S600 E601 V605 Y606 F607	S596-S603 VanDerWaalsContact CA-OG 3.3Å; S596-S603 WeakPolarHBondContact CA-OG 3.37Å; S596-S603 PolarHBondContact N-OG 3.32Å; S600-S603 VanDerWaalsContact O-CB 3.25Å; S600-S603 WeakPolarHBondContact O-CB 3.39Å; S600-S603 PolarHBondContact O-N 3.49Å; S600-S603 PolarHBondContact O-OG 3.42Å; E601-S603 PolarHBondContact O-N 3.48Å; S603-V605 PolarHBondContact O-N 3.23Å; S603-Y606 WeakPolarHBondContact O-CB 3.46Å; S603-Y606 PolarHBondContact O-N 2.91Å; S603-F607 VanDerWaalsContact O-CD2 3.32Å; S603-F607 WeakPolarHBondContact O-CD2 3.4Å; S603-F607 PolarHBondContact O-N 3.36Å
604	K	94.1	Very high	93.2	Very high	31 Å²	31	46.9 Å²	46.9	14%	0.135	23%	0.23	C	C	.	.	H	α-helix	trans	-56.1	-37.8	173.8	-66.4	177.7	172.8	164.6	0	112	M592 S596 E601 W602 Y606 F607 V608	M592-K604 HydrophobicContact CG-CB 4.32Å; M592-K604 HydrophobicContact CG-CG 3.78Å; M592-K604 HydrophobicContact SD-CB 4.24Å; M592-K604 HydrophobicContact SD-CG 4.07Å; S596-K604 VanDerWaalsContact OG-CE 3.29Å; S596-K604 WeakPolarHBondContact OG-CE 3.34Å; E601-K604 WeakPolarHBondContact O-CB 3.38Å; E601-K604 WeakPolarHBondContact O-CG 3.29Å; E601-K604 PolarHBondContact O-N 2.91Å; E601-K604 WeakPolarHBondContact OE2-CE 3.46Å; E601-K604 IonicContact OE2-NZ 3.6Å; E601-K604 PolarHBondContact OE2-NZ 3.35Å; W602-K604 PolarHBondContact O-N 2.95Å; K604-Y606 VanDerWaalsContact C-N 3.29Å; K604-Y606 PolarHBondContact O-N 2.92Å; K604-F607 PolarHBondContact O-N 3.37Å; K604-V608 WeakPolarHBondContact O-CB 3.35Å; K604-V608 VanDerWaalsContact O-CG2 3.27Å; K604-V608 WeakPolarHBondContact O-CG2 3.42Å; K604-V608 PolarHBondContact O-N 2.89Å
605	V	94.6	Very high	93.1	Very high	77 Å²	77	47.9 Å²	47.9	47%	0.467	24%	0.237	S	C	.	.	H	α-helix	trans	-60.8	-40.7	178.4	-179.8	0	0	0	0	110.7	W602 S603 V608 C609	W602-V605 HydrophobicContact CE3-CG2 4.08Å; W602-V605 WeakPolarHBondContact O-CB 3.38Å; W602-V605 PolarHBondContact O-N 3.15Å; S603-V605 PolarHBondContact O-N 3.23Å; V605-V608 PolarHBondContact O-N 2.95Å; V605-C609 VanDerWaalsContact O-CB 3.29Å; V605-C609 WeakPolarHBondContact O-CB 3.4Å; V605-C609 PolarHBondContact O-N 3.32Å; V605-C609 PolarHBondContact O-SG 3.04Å
606	Y	96.3	Very high	92.9	Very high	13 Å²	13	47.9 Å²	47.9	5%	0.051	24%	0.237	C	C	.	.	H	α-helix	trans	-60.2	-49.4	176.8	171.7	-90.5	0	0	0	111.9	F522 F525 G526 L529 F530 F569 S603 K604 V608 C609 W610	F522-Y606 AromaticContact CD1-CE2 3.86Å; F522-Y606 HydrophobicContact CD1-CE2 3.86Å; F522-Y606 PolarHBondContact O-OH 3.03Å; F525-Y606 AromaticContact CD1-CD2 3.79Å; F525-Y606 HydrophobicContact CD1-CD2 3.79Å; F525-Y606 AromaticContact CD1-CE2 3.77Å; F525-Y606 HydrophobicContact CD1-CE2 3.77Å; F525-Y606 HydrophobicContact CE1-CD2 4.06Å; F525-Y606 HydrophobicContact CE1-CE2 4.49Å; G526-Y606 WeakPolarHBondContact CA-OH 3.36Å; L529-Y606 HydrophobicContact CD1-CD2 4.1Å; F530-Y606 AromaticContact CE2-CD1 3.6Å; F530-Y606 HydrophobicContact CE2-CD1 3.6Å; F530-Y606 HydrophobicContact CE2-CD2 4.26Å; F530-Y606 AromaticContact CE2-CE1 3.88Å; F530-Y606 HydrophobicContact CE2-CE1 3.88Å; F530-Y606 HydrophobicContact CE2-CE2 4.5Å; F530-Y606 AromaticContact CE2-CG 3.8Å; F530-Y606 HydrophobicContact CE2-CG 3.8Å; F530-Y606 HydrophobicContact CZ-CD1 4.22Å; F530-Y606 HydrophobicContact CZ-CG 4.21Å; F569-Y606 HydrophobicContact CE1-CE1 4.43Å; F569-Y606 WeakPolarHBondContact CE1-OH 3.4Å; F569-Y606 HydrophobicContact CE2-CE1 4.11Å; F569-Y606 AromaticContact CZ-CE1 3.65Å; F569-Y606 HydrophobicContact CZ-CE1 3.65Å; F569-Y606 AromaticContact CZ-CZ 3.97Å; F569-Y606 WeakPolarHBondContact CZ-OH 3.45Å; S603-Y606 WeakPolarHBondContact O-CB 3.46Å; S603-Y606 PolarHBondContact O-N 2.91Å; K604-Y606 VanDerWaalsContact C-N 3.29Å; K604-Y606 PolarHBondContact O-N 2.92Å; Y606-V608 PolarHBondContact O-N 3.21Å; Y606-C609 PolarHBondContact O-N 2.87Å; Y606-W610 PolarHBondContact O-N 3.05Å
607	F	96.2	Very high	92.5	Very high	2 Å²	2	49.3 Å²	49.3	1%	0.009	24%	0.243	C	C	.	.	H	α-helix	trans	-65.5	-38.9	179.3	-70.9	-76.1	0	0	0	112.6	F569 V582 W588 F591 M592 Y595 S603 K604 W610 W611	F569-F607 HydrophobicContact CE2-CE1 4.35Å; F569-F607 HydrophobicContact CE2-CZ 4.06Å; V582-F607 HydrophobicContact CG1-CD1 4.31Å; V582-F607 HydrophobicContact CG2-CD1 4.15Å; V582-F607 HydrophobicContact CG2-CE1 4.18Å; W588-F607 HydrophobicContact CE3-CB 4.47Å; W588-F607 HydrophobicContact CZ3-CB 4.08Å; F591-F607 HydrophobicContact CB-CE1 4.46Å; M592-F607 HydrophobicContact CB-CB 4.46Å; M592-F607 HydrophobicContact CB-CD2 4.32Å; M592-F607 HydrophobicContact CB-CG 4.37Å; M592-F607 HydrophobicContact CG-CB 4.42Å; M592-F607 HydrophobicContact CG-CD2 4.39Å; Y595-F607 HydrophobicContact CD2-CE1 4.48Å; Y595-F607 AromaticContact CD2-CE2 3.9Å; Y595-F607 HydrophobicContact CD2-CE2 3.9Å; Y595-F607 AromaticContact CD2-CZ 3.42Å; Y595-F607 HydrophobicContact CD2-CZ 3.42Å; Y595-F607 VanDerWaalsContact CD2-CZ 3.42Å; Y595-F607 HydrophobicContact CE2-CZ 4.02Å; Y595-F607 AromaticContact CG-CE2 3.9Å; Y595-F607 HydrophobicContact CG-CE2 3.9Å; Y595-F607 AromaticContact CG-CZ 3.84Å; Y595-F607 HydrophobicContact CG-CZ 3.84Å; S603-F607 VanDerWaalsContact O-CD2 3.32Å; S603-F607 WeakPolarHBondContact O-CD2 3.4Å; S603-F607 PolarHBondContact O-N 3.36Å; K604-F607 PolarHBondContact O-N 3.37Å; F607-W610 PolarHBondContact O-N 3.36Å; F607-W611 WeakPolarHBondContact O-CB 3.45Å; F607-W611 PolarHBondContact O-N 3.2Å
608	V	94.9	Very high	92.4	Very high	44 Å²	44	44 Å²	44	27%	0.267	22%	0.223	S	C	.	.	H	α-helix	trans	-66.6	-42.5	176.2	174.4	0	0	0	0	111.3	L198 W588 K604 V605 Y606 W610 W611 L612	L198-V608 HydrophobicContact CD2-CB 4.48Å; L198-V608 HydrophobicContact CD2-CG1 4.11Å; L198-V608 HydrophobicContact CD2-CG2 3.5Å; W588-V608 HydrophobicContact CH2-CG2 4.35Å; K604-V608 WeakPolarHBondContact O-CB 3.35Å; K604-V608 VanDerWaalsContact O-CG2 3.27Å; K604-V608 WeakPolarHBondContact O-CG2 3.42Å; K604-V608 PolarHBondContact O-N 2.89Å; V605-V608 PolarHBondContact O-N 2.95Å; Y606-V608 PolarHBondContact O-N 3.21Å; V608-W610 VanDerWaalsContact C-N 3.32Å; V608-W610 PolarHBondContact O-N 3.05Å; V608-W611 HydrophobicContact CG1-CE3 4.38Å; V608-W611 PolarHBondContact O-N 3.22Å; V608-L612 WeakPolarHBondContact O-CB 2.97Å; V608-L612 PolarHBondContact O-N 2.64Å
609	C	95.1	Very high	92.3	Very high	59 Å²	59	42.4 Å²	42.4	40%	0.399	22%	0.222	S	C	.	.	H	α-helix	trans	-61.8	-40.8	174.3	-74.8	0	0	0	0	111.8	F522 V605 Y606 T613	F522-C609 HydrophobicContact CE1-CB 4.48Å; V605-C609 VanDerWaalsContact O-CB 3.29Å; V605-C609 WeakPolarHBondContact O-CB 3.4Å; V605-C609 PolarHBondContact O-N 3.32Å; V605-C609 PolarHBondContact O-SG 3.04Å; Y606-C609 PolarHBondContact O-N 2.87Å; C609-T613 WeakPolarHBondContact O-CB 3.08Å; C609-T613 PolarHBondContact O-N 3.37Å; C609-T613 PolarHBondContact O-OG1 2.89Å
610	W	96.2	Very high	91.9	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-64	-49.9	174.4	176	-115.3	0	0	0	111.5	V518 Y519 F522 L579 M583 Y606 F607 V608 L612 T613 S614	V518-W610 HydrophobicContact CG1-CH2 4.43Å; V518-W610 HydrophobicContact CG1-CZ3 3.76Å; Y519-W610 AromaticContact CD1-CH2 3.84Å; Y519-W610 HydrophobicContact CD1-CH2 3.84Å; Y519-W610 HydrophobicContact CD1-CZ2 4.15Å; Y519-W610 AromaticContact CD2-CH2 3.89Å; Y519-W610 HydrophobicContact CD2-CH2 3.89Å; Y519-W610 AromaticContact CE1-CH2 3.85Å; Y519-W610 HydrophobicContact CE1-CH2 3.85Å; Y519-W610 AromaticContact CE1-CZ2 3.71Å; Y519-W610 HydrophobicContact CE1-CZ2 3.71Å; Y519-W610 AromaticContact CE2-CH2 3.9Å; Y519-W610 HydrophobicContact CE2-CH2 3.9Å; Y519-W610 HydrophobicContact CE2-CZ2 4.14Å; Y519-W610 AromaticContact CG-CH2 3.87Å; Y519-W610 HydrophobicContact CG-CH2 3.87Å; Y519-W610 AromaticContact CZ-CH2 3.88Å; Y519-W610 AromaticContact CZ-CZ2 3.7Å; F522-W610 HydrophobicContact CB-CE3 3.75Å; F522-W610 HydrophobicContact CB-CZ3 3.7Å; F522-W610 HydrophobicContact CD1-CB 4.08Å; F522-W610 HydrophobicContact CD1-CD2 4.3Å; F522-W610 AromaticContact CD1-CE3 3.56Å; F522-W610 HydrophobicContact CD1-CE3 3.56Å; F522-W610 HydrophobicContact CD1-CZ3 4.33Å; F522-W610 AromaticContact CD2-CE3 3.61Å; F522-W610 HydrophobicContact CD2-CE3 3.61Å; F522-W610 AromaticContact CD2-CZ3 3.68Å; F522-W610 HydrophobicContact CD2-CZ3 3.68Å; F522-W610 HydrophobicContact CE1-CB 3.92Å; F522-W610 AromaticContact CE1-CE3 3.97Å; F522-W610 HydrophobicContact CE1-CE3 3.97Å; F522-W610 HydrophobicContact CE2-CE3 4.01Å; F522-W610 HydrophobicContact CE2-CZ3 4.35Å; F522-W610 HydrophobicContact CG-CD2 4.41Å; F522-W610 AromaticContact CG-CE3 3.35Å; F522-W610 HydrophobicContact CG-CE3 3.35Å; F522-W610 AromaticContact CG-CZ3 3.65Å; F522-W610 HydrophobicContact CG-CZ3 3.65Å; F522-W610 HydrophobicContact CZ-CE3 4.17Å; L579-W610 HydrophobicContact CB-CH2 4.35Å; L579-W610 HydrophobicContact CB-CZ2 3.73Å; L579-W610 HydrophobicContact CD1-CH2 4.47Å; L579-W610 HydrophobicContact CD2-CD2 3.71Å; L579-W610 HydrophobicContact CD2-CE3 4.21Å; L579-W610 HydrophobicContact CD2-CG 3.91Å; L579-W610 HydrophobicContact CD2-CZ2 4.16Å; L579-W610 HydrophobicContact CG-CZ2 4.38Å; L579-W610 PolarHBondContact O-NE1 3.14Å; M583-W610 HydrophobicContact CB-CZ2 4.48Å; Y606-W610 PolarHBondContact O-N 3.05Å; F607-W610 PolarHBondContact O-N 3.36Å; V608-W610 VanDerWaalsContact C-N 3.32Å; V608-W610 PolarHBondContact O-N 3.05Å; W610-L612 VanDerWaalsContact C-N 3.32Å; W610-L612 PolarHBondContact O-N 2.98Å; W610-T613 PolarHBondContact O-N 3.25Å; W610-T613 VanDerWaalsContact O-N 3.11Å; W610-S614 PolarHBondContact NE1-OG 3.04Å; W610-S614 WeakPolarHBondContact O-CB 3.5Å; W610-S614 PolarHBondContact O-N 3.32Å; W610-S614 PolarHBondContact O-OG 3.06Å
611	W	94.2	Very high	91.4	Very high	9 Å²	9	39.3 Å²	39.3	3%	0.034	20%	0.199	C	C	.	.	H	α-helix	trans	-55.5	-45.1	178	164	77.1	0	0	0	112.4	L156 L198 L201 T202 M236 F607 V608 T613 S615 V616	L156-W611 HydrophobicContact CD2-CH2 4.5Å; L198-W611 HydrophobicContact CD1-CH2 3.85Å; L198-W611 HydrophobicContact CD1-CZ3 3.82Å; L201-W611 HydrophobicContact CD2-CH2 4.05Å; L201-W611 HydrophobicContact CD2-CZ2 4.33Å; T202-W611 HydrophobicContact CG2-CZ2 3.71Å; T202-W611 VanDerWaalsContact CG2-NE1 3.31Å; M236-W611 HydrophobicContact CE-CZ2 3.92Å; F607-W611 WeakPolarHBondContact O-CB 3.45Å; F607-W611 PolarHBondContact O-N 3.2Å; V608-W611 HydrophobicContact CG1-CE3 4.38Å; V608-W611 PolarHBondContact O-N 3.22Å; W611-T613 VanDerWaalsContact C-N 3.34Å; W611-T613 PolarHBondContact O-N 3.28Å; W611-S615 WeakPolarHBondContact O-CB 3.4Å; W611-S615 PolarHBondContact O-N 3.09Å; W611-V616 HydrophobicContact CD2-CG2 4.05Å; W611-V616 HydrophobicContact CE3-CG2 4.42Å; W611-V616 HydrophobicContact CH2-CG2 3.94Å; W611-V616 HydrophobicContact CZ2-CG2 3.5Å; W611-V616 HydrophobicContact CZ3-CG2 4.37Å; W611-V616 PolarHBondContact O-N 3.11Å; W611-V616 VanDerWaalsContact O-N 3.11Å
612	L	91.8	Very high	91.1	Very high	48 Å²	48	38.1 Å²	38.1	25%	0.251	19%	0.193	S	C	.	.	I	π-helix	trans	-62.9	-42.8	177.4	-171.2	74.3	0	0	0	111.3	I153 V608 W610 V616 M617	I153-L612 HydrophobicContact CD1-CD1 3.94Å; I153-L612 HydrophobicContact CD1-CD2 4.28Å; I153-L612 HydrophobicContact CD1-CG 4.42Å; I153-L612 HydrophobicContact CG1-CD1 4.23Å; V608-L612 WeakPolarHBondContact O-CB 2.97Å; V608-L612 PolarHBondContact O-N 2.64Å; W610-L612 VanDerWaalsContact C-N 3.32Å; W610-L612 PolarHBondContact O-N 2.98Å; L612-V616 HydrophobicContact CD1-CB 4.36Å; L612-V616 HydrophobicContact CD1-CG1 4.23Å; L612-V616 WeakPolarHBondContact O-CB 3.27Å; L612-M617 WeakPolarHBondContact O-CG 3.4Å; L612-M617 PolarHBondContact O-N 2.94Å
613	T	91.4	Very high	90.7	Very high	40 Å²	40	31.5 Å²	31.5	25%	0.245	18%	0.175	C	C	.	.	I	π-helix	trans	-74.9	-39.2	-177	-53.7	0	0	0	0	112.2	V518 F522 C609 W610 W611 M617 W618	V518-T613 HydrophobicContact CG1-CG2 3.84Å; F522-T613 HydrophobicContact CE2-CG2 4.33Å; C609-T613 WeakPolarHBondContact O-CB 3.08Å; C609-T613 PolarHBondContact O-N 3.37Å; C609-T613 PolarHBondContact O-OG1 2.89Å; W610-T613 PolarHBondContact O-N 3.25Å; W610-T613 VanDerWaalsContact O-N 3.11Å; W611-T613 VanDerWaalsContact C-N 3.34Å; W611-T613 PolarHBondContact O-N 3.28Å; T613-M617 WeakPolarHBondContact O-CB 3.28Å; T613-W618 WeakPolarHBondContact O-CB 3.48Å; T613-W618 PolarHBondContact O-N 2.82Å
614	S	92.8	Very high	89.9	Confident	1 Å²	1	31.6 Å²	31.6	1%	0.007	18%	0.176	C	C	.	.	I	π-helix	trans	-91.6	-67.5	-172.2	68.3	0	0	0	0	111.9	W610 W618 V619	W610-S614 PolarHBondContact NE1-OG 3.04Å; W610-S614 WeakPolarHBondContact O-CB 3.5Å; W610-S614 PolarHBondContact O-N 3.32Å; W610-S614 PolarHBondContact O-OG 3.06Å; S614-W618 CarbonylContact O-C 3.46Å; S614-W618 VanDerWaalsContact O-CA 3.26Å; S614-W618 WeakPolarHBondContact O-CA 3.43Å; S614-W618 WeakPolarHBondContact O-CB 3.41Å; S614-W618 PolarHBondContact O-N 3.39Å; S614-V619 PolarHBondContact O-N 2.91Å
615	S	90.1	Very high	89.1	Confident	26 Å²	26	30.4 Å²	30.4	18%	0.182	17%	0.171	C	C	.	.	I	π-helix	trans	-68.3	-50.8	-176.5	-173.6	0	0	0	0	111.4	V585 W611 V619	V585-S615 WeakPolarHBondContact CG2-OG 3.27Å; W611-S615 WeakPolarHBondContact O-CB 3.4Å; W611-S615 PolarHBondContact O-N 3.09Å; S615-V619 WeakPolarHBondContact O-CB 3.42Å
616	V	88.3	Confident	88.4	Confident	1 Å²	1	29.3 Å²	29.3	1%	0.006	16%	0.162	C	C	.	.	I	π-helix	trans	-75.9	-47.7	-172.1	175.3	0	0	0	0	112.5	M236 L239 W611 L612 N620	M236-V616 HydrophobicContact CE-CG2 4.03Å; L239-V616 HydrophobicContact CD2-CG1 3.22Å; L239-V616 HydrophobicContact CG-CG1 4.32Å; W611-V616 HydrophobicContact CD2-CG2 4.05Å; W611-V616 HydrophobicContact CE3-CG2 4.42Å; W611-V616 HydrophobicContact CH2-CG2 3.94Å; W611-V616 HydrophobicContact CZ2-CG2 3.5Å; W611-V616 HydrophobicContact CZ3-CG2 4.37Å; W611-V616 PolarHBondContact O-N 3.11Å; W611-V616 VanDerWaalsContact O-N 3.11Å; L612-V616 HydrophobicContact CD1-CB 4.36Å; L612-V616 HydrophobicContact CD1-CG1 4.23Å; L612-V616 WeakPolarHBondContact O-CB 3.27Å; V616-N620 WeakPolarHBondContact O-CB 3.31Å; V616-N620 PolarHBondContact O-ND2 3.06Å
617	M	85.8	Confident	87.7	Confident	36 Å²	36	32.3 Å²	32.3	18%	0.177	18%	0.179	C	C	.	.	I	π-helix	trans	-84.2	-48.6	179.6	-72.1	-172.5	67.1	0	0	112.5	I142 L146 I149 L612 T613 L621	I142-M617 HydrophobicContact CG2-CE 4.06Å; L146-M617 HydrophobicContact CD1-CE 4.09Å; L146-M617 HydrophobicContact CD1-SD 4.43Å; I149-M617 HydrophobicContact CD1-CE 4.19Å; L612-M617 WeakPolarHBondContact O-CG 3.4Å; L612-M617 PolarHBondContact O-N 2.94Å; T613-M617 WeakPolarHBondContact O-CB 3.28Å; M617-L621 VanDerWaalsContact O-CB 3.23Å; M617-L621 WeakPolarHBondContact O-CB 3.44Å; M617-L621 PolarHBondContact O-N 2.79Å; M617-L621 VanDerWaalsContact O-N 3.11Å
618	W	86.8	Confident	86.8	Confident	22 Å²	22	33.4 Å²	33.4	8%	0.083	18%	0.184	C	C	.	.	I	π-helix	trans	-80.8	-47.2	-165.5	-128	99.9	0	0	0	113.6	F511 I514 L515 T613 S614 N620 L621 F622	F511-W618 VanDerWaalsContact C-CH2 3.43Å; F511-W618 HydrophobicContact CB-CH2 3.94Å; F511-W618 HydrophobicContact CB-CZ2 4.47Å; F511-W618 WeakPolarHBondContact O-CH2 3.21Å; F511-W618 WeakPolarHBondContact O-CZ2 3.15Å; I514-W618 HydrophobicContact CB-CZ2 4.31Å; I514-W618 HydrophobicContact CG2-CZ2 4.41Å; L515-W618 HydrophobicContact CB-CD2 4.41Å; L515-W618 HydrophobicContact CB-CE3 4.44Å; L515-W618 HydrophobicContact CB-CH2 3.5Å; L515-W618 HydrophobicContact CB-CZ2 3.43Å; L515-W618 VanDerWaalsContact CB-CZ2 3.43Å; L515-W618 HydrophobicContact CB-CZ3 4.01Å; L515-W618 HydrophobicContact CD1-CD2 3.55Å; L515-W618 HydrophobicContact CD1-CE3 3.75Å; L515-W618 HydrophobicContact CD1-CG 3.97Å; L515-W618 HydrophobicContact CD1-CH2 4.34Å; L515-W618 HydrophobicContact CD1-CZ2 4.15Å; L515-W618 HydrophobicContact CD1-CZ3 4.13Å; L515-W618 HydrophobicContact CD2-CE3 4.12Å; L515-W618 HydrophobicContact CD2-CH2 4.13Å; L515-W618 HydrophobicContact CD2-CZ3 3.79Å; L515-W618 HydrophobicContact CG-CD2 4.42Å; L515-W618 HydrophobicContact CG-CE3 4.32Å; L515-W618 HydrophobicContact CG-CH2 4.2Å; L515-W618 HydrophobicContact CG-CZ2 4.28Å; L515-W618 HydrophobicContact CG-CZ3 4.19Å; L515-W618 VanDerWaalsContact N-CZ2 3.35Å; T613-W618 WeakPolarHBondContact O-CB 3.48Å; T613-W618 PolarHBondContact O-N 2.82Å; S614-W618 CarbonylContact O-C 3.46Å; S614-W618 VanDerWaalsContact O-CA 3.26Å; S614-W618 WeakPolarHBondContact O-CA 3.43Å; S614-W618 WeakPolarHBondContact O-CB 3.41Å; S614-W618 PolarHBondContact O-N 3.39Å; W618-N620 VanDerWaalsContact C-N 3.32Å; W618-N620 PolarHBondContact O-N 2.84Å; W618-L621 PolarHBondContact O-N 3.08Å; W618-F622 HydrophobicContact CE3-CB 4.38Å; W618-F622 HydrophobicContact CZ3-CB 4.36Å; W618-F622 HydrophobicContact CZ3-CD2 4.34Å; W618-F622 WeakPolarHBondContact O-CB 3.48Å; W618-F622 PolarHBondContact O-N 2.69Å
619	V	88.1	Confident	85.9	Confident	54 Å²	54	32 Å²	32	33%	0.327	18%	0.175	S	C	.	.	I	π-helix	trans	-61.7	-43.5	177.7	177.4	0	0	0	0	110.1	M583 S614 S615 L621 F622 V623	M583-V619 HydrophobicContact CG-CG2 4.27Å; S614-V619 PolarHBondContact O-N 2.91Å; S615-V619 WeakPolarHBondContact O-CB 3.42Å; V619-L621 PolarHBondContact O-N 3.12Å; V619-F622 WeakPolarHBondContact O-CB 3.08Å; V619-F622 PolarHBondContact O-N 3.31Å; V619-V623 HydrophobicContact CG1-CG2 4.34Å; V619-V623 WeakPolarHBondContact O-CG2 3.39Å; V619-V623 PolarHBondContact O-N 3.06Å
620	N	85.3	Confident	85.1	Confident	28 Å²	28	32.7 Å²	32.7	15%	0.15	17%	0.171	C	C	.	.	H	α-helix	trans	-63.5	-40.6	176.9	-74	-30	0	0	0	112.9	T240 I243 V616 W618 F622 V623 A624	T240-N620 HydrophobicContact CG2-CB 4.24Å; T240-N620 PolarHBondContact OG1-ND2 3.26Å; T240-N620 PolarHBondContact OG1-OD1 2.97Å; I243-N620 HydrophobicContact CD1-CB 4.03Å; V616-N620 WeakPolarHBondContact O-CB 3.31Å; V616-N620 PolarHBondContact O-ND2 3.06Å; W618-N620 VanDerWaalsContact C-N 3.32Å; W618-N620 PolarHBondContact O-N 2.84Å; N620-F622 VanDerWaalsContact C-N 3.32Å; N620-F622 PolarHBondContact O-N 3.4Å; N620-V623 PolarHBondContact O-N 2.95Å; N620-A624 WeakPolarHBondContact O-CB 3.41Å; N620-A624 PolarHBondContact O-N 3.35Å
621	L	81.4	Confident	84.3	Confident	16 Å²	16	36 Å²	36	8%	0.084	19%	0.188	C	C	.	.	H	α-helix	trans	-64.1	-38.6	173.9	-178.6	147.9	0	0	0	111.8	I142 I243 F247 F511 M617 W618 V619 L625	I142-L621 HydrophobicContact CD1-CD1 4.41Å; I142-L621 HydrophobicContact CG1-CD1 4.16Å; I243-L621 HydrophobicContact CG2-CB 4.3Å; F247-L621 HydrophobicContact CD2-CD1 4.12Å; F247-L621 HydrophobicContact CD2-CG 4.42Å; F247-L621 HydrophobicContact CE2-CD1 4.4Å; F511-L621 HydrophobicContact CD1-CD2 3.48Å; F511-L621 VanDerWaalsContact CD1-CD2 3.48Å; F511-L621 HydrophobicContact CE1-CD2 3.73Å; F511-L621 HydrophobicContact CG-CD2 4.44Å; M617-L621 VanDerWaalsContact O-CB 3.23Å; M617-L621 WeakPolarHBondContact O-CB 3.44Å; M617-L621 PolarHBondContact O-N 2.79Å; M617-L621 VanDerWaalsContact O-N 3.11Å; W618-L621 PolarHBondContact O-N 3.08Å; V619-L621 PolarHBondContact O-N 3.12Å; L621-L625 HydrophobicContact CD2-CD1 3.64Å; L621-L625 PolarHBondContact O-N 2.97Å; L621-L625 VanDerWaalsContact O-N 3.13Å
622	F	82.8	Confident	83.3	Confident	81 Å²	81	37.4 Å²	37.4	36%	0.355	19%	0.193	S	C	.	.	H	α-helix	trans	-66.6	-45.5	176.8	-178.9	-103.1	0	0	0	111.7	L508 W618 V619 N620 A624 L625 I626	L508-F622 HydrophobicContact CD1-CD2 3.92Å; L508-F622 HydrophobicContact CD1-CE2 3.41Å; L508-F622 VanDerWaalsContact CD1-CE2 3.41Å; L508-F622 HydrophobicContact CD1-CZ 4.29Å; W618-F622 HydrophobicContact CE3-CB 4.38Å; W618-F622 HydrophobicContact CZ3-CB 4.36Å; W618-F622 HydrophobicContact CZ3-CD2 4.34Å; W618-F622 WeakPolarHBondContact O-CB 3.48Å; W618-F622 PolarHBondContact O-N 2.69Å; V619-F622 WeakPolarHBondContact O-CB 3.08Å; V619-F622 PolarHBondContact O-N 3.31Å; N620-F622 VanDerWaalsContact C-N 3.32Å; N620-F622 PolarHBondContact O-N 3.4Å; F622-A624 PolarHBondContact O-N 2.93Å; F622-L625 WeakPolarHBondContact O-CB 3.28Å; F622-L625 PolarHBondContact O-N 3.38Å; F622-I626 HydrophobicContact CD1-CD1 3.77Å; F622-I626 HydrophobicContact CD1-CG1 4.49Å; F622-I626 HydrophobicContact CE1-CD1 3.25Å; F622-I626 HydrophobicContact CE1-CG1 4.28Å; F622-I626 HydrophobicContact CE2-CD1 4.34Å; F622-I626 HydrophobicContact CZ-CD1 3.59Å; F622-I626 HydrophobicContact CZ-CG1 4.41Å; F622-I626 WeakPolarHBondContact O-CG1 3.29Å; F622-I626 PolarHBondContact O-N 2.96Å
623	V	83.3	Confident	82.2	Confident	70 Å²	70	35.6 Å²	35.6	42%	0.424	18%	0.184	S	C	.	.	H	α-helix	trans	-60	-45.3	175.4	171.6	0	0	0	0	110.9	V619 N620 L625 I626 L627	V619-V623 HydrophobicContact CG1-CG2 4.34Å; V619-V623 WeakPolarHBondContact O-CG2 3.39Å; V619-V623 PolarHBondContact O-N 3.06Å; N620-V623 PolarHBondContact O-N 2.95Å; V623-L625 VanDerWaalsContact C-N 3.29Å; V623-L625 PolarHBondContact O-N 3.49Å; V623-I626 PolarHBondContact O-N 2.89Å; V623-L627 WeakPolarHBondContact O-CB 3.46Å; V623-L627 PolarHBondContact O-N 3.27Å
624	A	79.6	Confident	81.4	Confident	5 Å²	5	37.8 Å²	37.8	4%	0.041	19%	0.188	C	C	.	.	H	α-helix	trans	-55	-44.4	175.9	0	0	0	0	0	112.5	Y244 N620 F622 E628	Y244-A624 HydrophobicContact CD2-CB 3.67Å; Y244-A624 HydrophobicContact CG-CB 4.38Å; N620-A624 WeakPolarHBondContact O-CB 3.41Å; N620-A624 PolarHBondContact O-N 3.35Å; F622-A624 PolarHBondContact O-N 2.93Å; A624-E628 PolarHBondContact O-N 3.39Å; A624-E628 VanDerWaalsContact O-N 3.13Å
625	L	76.6	Confident	80.6	Confident	6 Å²	6	42.1 Å²	42.1	3%	0.031	21%	0.211	C	C	.	.	H	α-helix	trans	-65.7	-42.4	177.5	-86.5	161.9	0	0	0	113.3	F247 L251 L508 F511 L621 F622 V623 L627 N629	F247-L625 HydrophobicContact CD1-CG 4.31Å; F247-L625 HydrophobicContact CE1-CD1 4.08Å; F247-L625 HydrophobicContact CE1-CD2 3.3Å; F247-L625 HydrophobicContact CE1-CG 3.4Å; F247-L625 HydrophobicContact CZ-CD1 3.92Å; F247-L625 HydrophobicContact CZ-CD2 3.54Å; F247-L625 HydrophobicContact CZ-CG 3.73Å; L251-L625 HydrophobicContact CD1-CD2 4.19Å; L508-L625 HydrophobicContact CD2-CB 3.9Å; L508-L625 HydrophobicContact CD2-CD1 3.62Å; L508-L625 HydrophobicContact CD2-CD2 4.14Å; L508-L625 HydrophobicContact CD2-CG 4.12Å; F511-L625 HydrophobicContact CB-CD1 4.38Å; F511-L625 HydrophobicContact CD1-CD1 3.61Å; F511-L625 HydrophobicContact CD2-CD1 3.55Å; F511-L625 HydrophobicContact CD2-CD2 4.39Å; F511-L625 HydrophobicContact CE1-CD1 3.74Å; F511-L625 HydrophobicContact CE2-CD1 3.66Å; F511-L625 HydrophobicContact CE2-CD2 3.95Å; F511-L625 HydrophobicContact CE2-CG 4.47Å; F511-L625 HydrophobicContact CG-CD1 3.54Å; F511-L625 HydrophobicContact CZ-CD1 3.79Å; F511-L625 HydrophobicContact CZ-CD2 4.34Å; L621-L625 HydrophobicContact CD2-CD1 3.64Å; L621-L625 PolarHBondContact O-N 2.97Å; L621-L625 VanDerWaalsContact O-N 3.13Å; F622-L625 WeakPolarHBondContact O-CB 3.28Å; F622-L625 PolarHBondContact O-N 3.38Å; V623-L625 VanDerWaalsContact C-N 3.29Å; V623-L625 PolarHBondContact O-N 3.49Å; L625-L627 VanDerWaalsContact C-N 3.34Å; L625-N629 WeakPolarHBondContact O-CB 3.35Å; L625-N629 PolarHBondContact O-N 3.43Å; L625-N629 VanDerWaalsContact O-N 3.14Å; L625-N629 PolarHBondContact O-ND2 3.39Å
626	I	80.6	Confident	79.5	Confident	54 Å²	54	44.8 Å²	44.8	28%	0.277	22%	0.217	S	C	.	.	H	α-helix	trans	-62.2	-47.7	177.5	-68.9	-174.6	0	0	0	110	L504 F622 V623 E628 N629 F630	L504-I626 HydrophobicContact CD1-CG1 4.15Å; L504-I626 HydrophobicContact CD2-CD1 3.98Å; L504-I626 HydrophobicContact CD2-CG1 3.59Å; L504-I626 HydrophobicContact CG-CG1 4.47Å; F622-I626 HydrophobicContact CD1-CD1 3.77Å; F622-I626 HydrophobicContact CD1-CG1 4.49Å; F622-I626 HydrophobicContact CE1-CD1 3.25Å; F622-I626 HydrophobicContact CE1-CG1 4.28Å; F622-I626 HydrophobicContact CE2-CD1 4.34Å; F622-I626 HydrophobicContact CZ-CD1 3.59Å; F622-I626 HydrophobicContact CZ-CG1 4.41Å; F622-I626 WeakPolarHBondContact O-CG1 3.29Å; F622-I626 PolarHBondContact O-N 2.96Å; V623-I626 PolarHBondContact O-N 2.89Å; I626-E628 PolarHBondContact O-N 2.91Å; I626-N629 PolarHBondContact O-N 3.37Å; I626-F630 VanDerWaalsContact O-CB 3.26Å; I626-F630 WeakPolarHBondContact O-CB 3.49Å; I626-F630 PolarHBondContact O-N 3.02Å
627	L	80.6	Confident	78.3	Confident	77 Å²	77	45.7 Å²	45.7	40%	0.403	22%	0.223	S	C	.	.	H	α-helix	trans	-60	-46.2	-177.1	-172.2	130.6	0	0	0	111.3	Y244 V623 L625 F630 I631	Y244-L627 HydrophobicContact CD2-CD2 4.48Å; Y244-L627 HydrophobicContact CE2-CD2 3.68Å; V623-L627 WeakPolarHBondContact O-CB 3.46Å; V623-L627 PolarHBondContact O-N 3.27Å; L625-L627 VanDerWaalsContact C-N 3.34Å; L627-F630 PolarHBondContact O-N 3.48Å; L627-I631 HydrophobicContact CD2-CD1 3.37Å; L627-I631 HydrophobicContact CD2-CG1 4.48Å; L627-I631 HydrophobicContact CG-CD1 3.71Å; L627-I631 HydrophobicContact CG-CG1 4.4Å; L627-I631 WeakPolarHBondContact O-CB 3.37Å; L627-I631 VanDerWaalsContact O-CG1 3.24Å; L627-I631 WeakPolarHBondContact O-CG1 3.32Å; L627-I631 PolarHBondContact O-N 2.89Å
628	E	77.5	Confident	77.3	Confident	24 Å²	24	50.2 Å²	50.2	11%	0.112	24%	0.244	C	C	.	.	H	α-helix	trans	-63	-45.7	177.2	-170	70.6	-171.6	0	0	112.2	Y244 R248 A624 I626 F630 Y632 F658	Y244-E628 PolarHBondContact OH-OE2 3.16Å; Y244-E628 VanDerWaalsContact OH-OE2 3.09Å; R248-E628 IonicContact NE-OE1 3.23Å; A624-E628 PolarHBondContact O-N 3.39Å; A624-E628 VanDerWaalsContact O-N 3.13Å; I626-E628 PolarHBondContact O-N 2.91Å; E628-F630 VanDerWaalsContact C-N 3.3Å; E628-F630 PolarHBondContact O-N 3.2Å; E628-Y632 WeakPolarHBondContact O-CB 3.24Å; E628-Y632 PolarHBondContact O-N 2.8Å; E628-Y632 VanDerWaalsContact O-N 3.09Å; E628-F658 HydrophobicContact CG-CZ 4.12Å; E628-F658 WeakPolarHBondContact OE1-CE1 3.44Å
629	N	75.9	Confident	75.8	Confident	14 Å²	14	54.2 Å²	54.2	8%	0.075	28%	0.275	C	S	.	.	H	α-helix	trans	-64.4	-37	178.3	-81.6	-79.1	0	0	0	112	L504 N507 L625 I626 K633 M657	L504-N629 HydrophobicContact CD1-CB 3.93Å; L504-N629 WeakPolarHBondContact CD1-ND2 3.45Å; N507-N629 PolarHBondContact ND2-OD1 3.23Å; L625-N629 WeakPolarHBondContact O-CB 3.35Å; L625-N629 PolarHBondContact O-N 3.43Å; L625-N629 VanDerWaalsContact O-N 3.14Å; L625-N629 PolarHBondContact O-ND2 3.39Å; I626-N629 PolarHBondContact O-N 3.37Å; N629-K633 PolarHBondContact O-N 2.67Å; N629-M657 WeakPolarHBondContact OD1-CE 3.44Å
630	F	77.3	Confident	74	Confident	75 Å²	75	54.2 Å²	54.2	33%	0.329	28%	0.276	S	S	.	.	H	α-helix	trans	-72.6	-50.7	-179.9	-177.8	-95.9	0	0	0	111.4	V497 T500 I626 L627 E628 Y632 K633 W634	V497-F630 HydrophobicContact CG2-CE2 4.44Å; T500-F630 HydrophobicContact CG2-CD2 4.46Å; I626-F630 VanDerWaalsContact O-CB 3.26Å; I626-F630 WeakPolarHBondContact O-CB 3.49Å; I626-F630 PolarHBondContact O-N 3.02Å; L627-F630 PolarHBondContact O-N 3.48Å; E628-F630 VanDerWaalsContact C-N 3.3Å; E628-F630 PolarHBondContact O-N 3.2Å; F630-Y632 VanDerWaalsContact C-N 3.32Å; F630-Y632 PolarHBondContact O-N 2.93Å; F630-K633 PolarHBondContact O-N 3.43Å; F630-K633 VanDerWaalsContact O-N 3.16Å; F630-W634 HydrophobicContact CE1-CB 4.3Å; F630-W634 HydrophobicContact CE1-CD2 4.35Å; F630-W634 HydrophobicContact CE1-CE3 4.1Å; F630-W634 HydrophobicContact CE1-CG 4.46Å; F630-W634 HydrophobicContact CE2-CE3 4.44Å; F630-W634 HydrophobicContact CZ-CD2 4.34Å; F630-W634 AromaticContact CZ-CE3 3.64Å; F630-W634 HydrophobicContact CZ-CE3 3.64Å; F630-W634 HydrophobicContact CZ-CZ3 4.19Å; F630-W634 VanDerWaalsContact O-CB 3.29Å; F630-W634 WeakPolarHBondContact O-CB 3.2Å; F630-W634 PolarHBondContact O-N 2.98Å
631	I	79.4	Confident	72.3	Confident	68 Å²	68	55.7 Å²	55.7	35%	0.349	29%	0.289	S	S	.	.	H	α-helix	trans	-56.2	-48.7	178.7	-71	171.7	0	0	0	110.1	L627 K633 W634 D635	L627-I631 HydrophobicContact CD2-CD1 3.37Å; L627-I631 HydrophobicContact CD2-CG1 4.48Å; L627-I631 HydrophobicContact CG-CD1 3.71Å; L627-I631 HydrophobicContact CG-CG1 4.4Å; L627-I631 WeakPolarHBondContact O-CB 3.37Å; L627-I631 VanDerWaalsContact O-CG1 3.24Å; L627-I631 WeakPolarHBondContact O-CG1 3.32Å; L627-I631 PolarHBondContact O-N 2.89Å; I631-K633 VanDerWaalsContact C-N 3.31Å; I631-K633 PolarHBondContact O-N 3.34Å; I631-W634 WeakPolarHBondContact O-CB 3.29Å; I631-W634 PolarHBondContact O-N 3.42Å; I631-W634 VanDerWaalsContact O-N 3.13Å; I631-D635 PolarHBondContact O-N 3.41Å
632	Y	73	Confident	70.6	Confident	39 Å²	39	59.3 Å²	59.3	15%	0.153	31%	0.312	C	S	.	.	H	α-helix	trans	-57.1	-43.6	179	175.1	-97.6	0	0	0	113	E628 F630 R636 T652 F656 M657	E628-Y632 WeakPolarHBondContact O-CB 3.24Å; E628-Y632 PolarHBondContact O-N 2.8Å; E628-Y632 VanDerWaalsContact O-N 3.09Å; F630-Y632 VanDerWaalsContact C-N 3.32Å; F630-Y632 PolarHBondContact O-N 2.93Å; Y632-R636 WeakPolarHBondContact O-CB 3.38Å; Y632-R636 PolarHBondContact O-N 3.25Å; Y632-R636 PolarHBondContact OH-NE 3.38Å; Y632-R636 PolarHBondContact OH-NH2 3.44Å; Y632-T652 HydrophobicContact CD1-CG2 4.11Å; Y632-T652 HydrophobicContact CE1-CG2 3.4Å; Y632-F656 VanDerWaalsContact OH-C 3.28Å; Y632-F656 PolarHBondContact OH-O 3.41Å; Y632-M657 HydrophobicContact CD1-CB 4.4Å; Y632-M657 HydrophobicContact CD1-CG 3.61Å; Y632-M657 HydrophobicContact CD2-CB 4.06Å; Y632-M657 HydrophobicContact CD2-CG 4.16Å; Y632-M657 HydrophobicContact CE1-CG 3.91Å; Y632-M657 HydrophobicContact CE2-CB 4.29Å; Y632-M657 HydrophobicContact CE2-CG 4.43Å; Y632-M657 WeakPolarHBondContact CE2-O 3.32Å; Y632-M657 HydrophobicContact CG-CB 4.09Å; Y632-M657 HydrophobicContact CG-CG 3.71Å
633	K	69.2	Low	68.9	Low	11 Å²	11	60.6 Å²	60.6	5%	0.048	33%	0.326	C	S	.	.	H	α-helix	trans	-73	-35.5	178.4	-80.2	-167.8	169.7	-158.2	0	112.3	S499 T500 D503 N629 F630 I631 S637	S499-K633 PolarHBondContact O-NZ 3.39Å; T500-K633 HydrophobicContact CG2-CB 3.75Å; T500-K633 HydrophobicContact CG2-CD 3.27Å; T500-K633 HydrophobicContact CG2-CG 4.15Å; D503-K633 IonicContact OD2-NZ 2.74Å; D503-K633 PolarHBondContact OD2-NZ 2.82Å; N629-K633 PolarHBondContact O-N 2.67Å; F630-K633 PolarHBondContact O-N 3.43Å; F630-K633 VanDerWaalsContact O-N 3.16Å; I631-K633 VanDerWaalsContact C-N 3.31Å; I631-K633 PolarHBondContact O-N 3.34Å; K633-S637 WeakPolarHBondContact O-CB 3.27Å; K633-S637 PolarHBondContact O-N 2.9Å; K633-S637 PolarHBondContact O-OG 3.07Å
634	W	75.1	Confident	67.2	Low	86 Å²	86	59.3 Å²	59.3	33%	0.326	32%	0.317	S	S	.	.	H	α-helix	trans	-63	-52.8	178.3	-177.1	-92.5	0	0	0	110.9	L493 L496 F630 I631 R636 S637 H638	L493-W634 HydrophobicContact CD1-CH2 3.88Å; L493-W634 HydrophobicContact CD1-CZ3 3.71Å; L496-W634 HydrophobicContact CD2-CE3 3.92Å; L496-W634 HydrophobicContact CD2-CZ3 4.22Å; F630-W634 HydrophobicContact CE1-CB 4.3Å; F630-W634 HydrophobicContact CE1-CD2 4.35Å; F630-W634 HydrophobicContact CE1-CE3 4.1Å; F630-W634 HydrophobicContact CE1-CG 4.46Å; F630-W634 HydrophobicContact CE2-CE3 4.44Å; F630-W634 HydrophobicContact CZ-CD2 4.34Å; F630-W634 AromaticContact CZ-CE3 3.64Å; F630-W634 HydrophobicContact CZ-CE3 3.64Å; F630-W634 HydrophobicContact CZ-CZ3 4.19Å; F630-W634 VanDerWaalsContact O-CB 3.29Å; F630-W634 WeakPolarHBondContact O-CB 3.2Å; F630-W634 PolarHBondContact O-N 2.98Å; I631-W634 WeakPolarHBondContact O-CB 3.29Å; I631-W634 PolarHBondContact O-N 3.42Å; I631-W634 VanDerWaalsContact O-N 3.13Å; W634-R636 VanDerWaalsContact C-N 3.31Å; W634-R636 PolarHBondContact O-N 3.23Å; W634-S637 PolarHBondContact O-N 3.32Å; W634-S637 PolarHBondContact O-OG 3.31Å; W634-H638 AromaticContact CD1-CD2 3.95Å; W634-H638 AromaticContact CE2-CD2 3.42Å; W634-H638 VanDerWaalsContact CE2-CD2 3.42Å; W634-H638 AromaticContact CE2-NE2 3.48Å; W634-H638 AromaticContact CH2-NE2 3.97Å; W634-H638 AromaticContact CZ2-CD2 3.69Å; W634-H638 AromaticContact CZ2-NE2 3.21Å; W634-H638 WeakPolarHBondContact CZ2-NE2 3.21Å; W634-H638 AromaticContact NE1-CD2 3.34Å; W634-H638 PolarHBondContact NE1-CD2 3.05Å; W634-H638 VanDerWaalsContact NE1-CD2 3.34Å; W634-H638 AromaticContact NE1-NE2 3.7Å; W634-H638 PolarHBondContact O-N 3.24Å
635	D	75.6	Confident	65.6	Low	92 Å²	92	60.9 Å²	60.9	49%	0.492	33%	0.326	S	S	.	.	H	α-helix	trans	-57.6	-46	179.4	-70.8	-16.7	0	0	0	110.7	I631 S637 H638 S639	I631-D635 PolarHBondContact O-N 3.41Å; D635-S637 VanDerWaalsContact C-N 3.31Å; D635-S637 PolarHBondContact O-N 2.92Å; D635-H638 PolarHBondContact O-N 3Å; D635-S639 PolarHBondContact O-N 2.87Å; D635-S639 PolarHBondContact O-OG 3.33Å; D635-S639 VanDerWaalsContact O-OG 3.06Å
636	R	66.6	Low	64.1	Low	82 Å²	82	67.2 Å²	67.2	31%	0.309	36%	0.356	S	S	.	.	H	α-helix	trans	-65.9	-32.5	178.2	-159.8	128.3	78.1	117.3	6.5	113.5	Y632 W634	Y632-R636 WeakPolarHBondContact O-CB 3.38Å; Y632-R636 PolarHBondContact O-N 3.25Å; Y632-R636 PolarHBondContact OH-NE 3.38Å; Y632-R636 PolarHBondContact OH-NH2 3.44Å; W634-R636 VanDerWaalsContact C-N 3.31Å; W634-R636 PolarHBondContact O-N 3.23Å
637	S	64.4	Low	62.4	Low	20 Å²	20	70.2 Å²	70.2	14%	0.14	37%	0.366	C	S	.	.	H	α-helix	trans	-71.8	-32.7	176.6	77	0	0	0	0	112.8	L496 K633 W634 D635	L496-S637 VanDerWaalsContact CD2-OG 3.29Å; L496-S637 WeakPolarHBondContact CD2-OG 3.46Å; K633-S637 WeakPolarHBondContact O-CB 3.27Å; K633-S637 PolarHBondContact O-N 2.9Å; K633-S637 PolarHBondContact O-OG 3.07Å; W634-S637 PolarHBondContact O-N 3.32Å; W634-S637 PolarHBondContact O-OG 3.31Å; D635-S637 VanDerWaalsContact C-N 3.31Å; D635-S637 PolarHBondContact O-N 2.92Å
638	H	64	Low	60.8	Low	131 Å²	131	68 Å²	68	61%	0.606	36%	0.355	S	S	*	.	H	α-helix	trans	-77.8	-28.7	177.2	-98.2	-79.3	0	0	0	112.8	W634 D635 C640	W634-H638 AromaticContact CD1-CD2 3.95Å; W634-H638 AromaticContact CE2-CD2 3.42Å; W634-H638 VanDerWaalsContact CE2-CD2 3.42Å; W634-H638 AromaticContact CE2-NE2 3.48Å; W634-H638 AromaticContact CH2-NE2 3.97Å; W634-H638 AromaticContact CZ2-CD2 3.69Å; W634-H638 AromaticContact CZ2-NE2 3.21Å; W634-H638 WeakPolarHBondContact CZ2-NE2 3.21Å; W634-H638 AromaticContact NE1-CD2 3.34Å; W634-H638 PolarHBondContact NE1-CD2 3.05Å; W634-H638 VanDerWaalsContact NE1-CD2 3.34Å; W634-H638 AromaticContact NE1-NE2 3.7Å; W634-H638 PolarHBondContact O-N 3.24Å; D635-H638 PolarHBondContact O-N 3Å; H638-C640 VanDerWaalsContact C-N 3.33Å
639	S	56.5	Low	59.2	Low	105 Å²	105	71.2 Å²	71.2	73%	0.734	37%	0.366	S	S	*	.	S	Bend	trans	-80.9	-4.9	177	-55.6	0	0	0	0	114.7	D635	D635-S639 PolarHBondContact O-N 2.87Å; D635-S639 PolarHBondContact O-OG 3.33Å; D635-S639 VanDerWaalsContact O-OG 3.06Å
640	C	49.9	Very low	57.7	Low	54 Å²	54	73.1 Å²	73.1	37%	0.365	37%	0.373	S	S	.	.	S	Bend	trans	-120.2	152.8	-174.1	-77.8	0	0	0	0	113.7	H638 D644 I648	H638-C640 VanDerWaalsContact C-N 3.33Å; C640-D644 HydrophobicContact CB-CB 3.88Å; C640-I648 HydrophobicContact CB-CD1 4.18Å
641	S	48.4	Very low	56.4	Low	60 Å²	60	74 Å²	74	42%	0.42	38%	0.377	S	S	.	.			trans	-75	162.3	-179.2	76.2	0	0	0	0	112.3	T643 D644	S641-T643 PolarHBondContact O-N 3.45Å; S641-T643 VanDerWaalsContact O-N 3.12Å; S641-T643 PolarHBondContact OG-OG1 3.42Å; S641-T643 VanDerWaalsContact OG-OG1 3.11Å; S641-D644 PolarHBondContact N-OD2 3.22Å; S641-D644 WeakPolarHBondContact O-CB 3.49Å; S641-D644 PolarHBondContact O-N 3.47Å; S641-D644 PolarHBondContact OG-OD2 2.91Å
642	V	47.3	Very low	54.9	Low	92 Å²	92	71.3 Å²	71.3	56%	0.558	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-54.6	-34	-176.3	172.2	0	0	0	0	113.7	K492 D644 V645	K492-V642 HydrophobicContact CD-CG1 4.47Å; V642-D644 VanDerWaalsContact C-N 3.26Å; V642-D644 PolarHBondContact O-N 3.25Å; V642-V645 PolarHBondContact O-N 3.42Å
643	T	46	Very low	53.9	Low	107 Å²	107	71.6 Å²	71.6	66%	0.656	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-72	-17.7	177.1	37.2	0	0	0	0	113.5	S641	S641-T643 PolarHBondContact O-N 3.45Å; S641-T643 VanDerWaalsContact O-N 3.12Å; S641-T643 PolarHBondContact OG-OG1 3.42Å; S641-T643 VanDerWaalsContact OG-OG1 3.11Å
644	D	46.9	Very low	52.9	Low	43 Å²	43	73.1 Å²	73.1	23%	0.23	38%	0.382	C	S	.	.	G	3₁₀ helix	trans	-88	-15.3	179.2	-60.2	-47.7	0	0	0	112.5	C640 S641 V642 E646 K647 I648	C640-D644 HydrophobicContact CB-CB 3.88Å; S641-D644 PolarHBondContact N-OD2 3.22Å; S641-D644 WeakPolarHBondContact O-CB 3.49Å; S641-D644 PolarHBondContact O-N 3.47Å; S641-D644 PolarHBondContact OG-OD2 2.91Å; V642-D644 VanDerWaalsContact C-N 3.26Å; V642-D644 PolarHBondContact O-N 3.25Å; D644-E646 VanDerWaalsContact C-N 3.33Å; D644-E646 PolarHBondContact O-N 3.29Å; D644-K647 CarbonylContact O-C 3.26Å; D644-K647 WeakPolarHBondContact O-CA 3.4Å; D644-K647 WeakPolarHBondContact O-CB 3.48Å; D644-K647 PolarHBondContact O-N 2.96Å; D644-K647 IonicContact OD1-NZ 3.66Å; D644-I648 VanDerWaalsContact O-CG1 3.26Å; D644-I648 WeakPolarHBondContact O-CG1 3.32Å; D644-I648 PolarHBondContact O-N 3.42Å
645	V	46.9	Very low	51.7	Low	39 Å²	39	72 Å²	72	24%	0.236	38%	0.381	C	S	.	.	H	α-helix	trans	-66.5	-33.2	178.8	-177.6	0	0	0	0	112.1	V642 I648 R649	V642-V645 PolarHBondContact O-N 3.42Å; V645-I648 PolarHBondContact O-N 2.73Å; V645-R649 PolarHBondContact O-N 2.97Å
646	E	44.8	Very low	50.8	Low	139 Å²	139	69.1 Å²	69.1	65%	0.65	36%	0.364	S	S	*	.	H	α-helix	trans	-71.2	-29.7	170.6	-84.4	-173.6	143.4	0	0	112.8	D644 R649	D644-E646 VanDerWaalsContact C-N 3.33Å; D644-E646 PolarHBondContact O-N 3.29Å; E646-R649 WeakPolarHBondContact O-CB 3.18Å
647	K	45.3	Very low	50.3	Low	116 Å²	116	66.1 Å²	66.1	50%	0.504	35%	0.354	S	S	.	.	H	α-helix	trans	-71.1	-38	171.1	-72.9	177.1	-178.4	166.3	0	111.8	I338 D644 R649 Y650	I338-K647 HydrophobicContact CD1-CD 4.26Å; I338-K647 HydrophobicContact CD1-CG 4.27Å; D644-K647 CarbonylContact O-C 3.26Å; D644-K647 WeakPolarHBondContact O-CA 3.4Å; D644-K647 WeakPolarHBondContact O-CB 3.48Å; D644-K647 PolarHBondContact O-N 2.96Å; D644-K647 IonicContact OD1-NZ 3.66Å; K647-R649 PolarHBondContact O-N 2.77Å; K647-Y650 PolarHBondContact O-N 3.3Å
648	I	46.5	Very low	50	Low	31 Å²	31	65.3 Å²	65.3	16%	0.159	35%	0.347	C	S	.	.	H	α-helix	trans	-61.9	-23.3	176.6	-69	164.5	0	0	0	112.1	C640 D644 V645 Y650	C640-I648 HydrophobicContact CB-CD1 4.18Å; D644-I648 VanDerWaalsContact O-CG1 3.26Å; D644-I648 WeakPolarHBondContact O-CG1 3.32Å; D644-I648 PolarHBondContact O-N 3.42Å; V645-I648 PolarHBondContact O-N 2.73Å; I648-Y650 PolarHBondContact O-N 3.38Å; I648-Y650 VanDerWaalsContact O-N 3.14Å
649	R	44.8	Very low	49.9	Very low	92 Å²	92	64.7 Å²	64.7	35%	0.347	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-13	179.4	-166.8	174.8	-80.9	-177.5	-5.3	113.5	P489 V645 E646 K647 E651	P489-R649 PolarHBondContact O-NH2 2.93Å; V645-R649 PolarHBondContact O-N 2.97Å; E646-R649 WeakPolarHBondContact O-CB 3.18Å; K647-R649 PolarHBondContact O-N 2.77Å; R649-E651 PolarHBondContact O-N 3.04Å
650	Y	43.2	Very low	50	Low	54 Å²	54	69.2 Å²	69.2	21%	0.212	35%	0.352	C	S	.	.	S	Bend	trans	-101.4	69.3	-179.7	-70.7	-77.1	0	0	0	112.7	K339 K647 I648	K339-Y650 HydrophobicContact CB-CE1 4.26Å; K339-Y650 HydrophobicContact CD-CE1 4.08Å; K339-Y650 HydrophobicContact CG-CE1 4.26Å; K647-Y650 PolarHBondContact O-N 3.3Å; I648-Y650 PolarHBondContact O-N 3.38Å; I648-Y650 VanDerWaalsContact O-N 3.14Å
651	E	51	Low	50.4	Low	92 Å²	92	71.5 Å²	71.5	43%	0.43	36%	0.358	S	S	.	.			trans	62.1	102.8	153.4	-61.5	-172.8	156.6	0	0	118.6	K506 R649	K506-E651 IonicContact NZ-OE1 2.99Å; K506-E651 PolarHBondContact NZ-OE1 2.98Å; R649-E651 PolarHBondContact O-N 3.04Å
652	T	47.1	Very low	51.2	Low	13 Å²	13	69.7 Å²	69.7	8%	0.08	34%	0.343	C	S	.	.			trans	-79.3	118.3	164.8	-52.2	0	0	0	0	110.6	Y632 F656 M657	Y632-T652 HydrophobicContact CD1-CG2 4.11Å; Y632-T652 HydrophobicContact CE1-CG2 3.4Å; T652-F656 HydrophobicContact CG2-CB 4.35Å; T652-M657 HydrophobicContact CG2-CE 4.14Å; T652-M657 HydrophobicContact CG2-CG 4.28Å
653	S	52.5	Low	52.2	Low	45 Å²	45	72.2 Å²	72.2	32%	0.315	35%	0.349	S	S	.	.			trans	-77.5	144	162.5	83.5	0	0	0	0	109.8	Q655 F656	S653-Q655 PolarHBondContact O-N 3.2Å; S653-F656 PolarHBondContact O-N 2.79Å; S653-F656 WeakPolarHBondContact OG-CD2 3.49Å; S653-F656 WeakPolarHBondContact OG-CE2 3.19Å
654	V	48	Very low	53.5	Low	43 Å²	43	72.6 Å²	72.6	26%	0.261	34%	0.343	S	S	.	.	H	α-helix	trans	-50	-24.6	177.5	179.5	0	0	0	0	112.5	V255 N507 F656 M657 F658	V255-V654 HydrophobicContact CG2-CG1 4.15Å; N507-V654 HydrophobicContact CB-CG2 4.08Å; V654-F656 VanDerWaalsContact C-N 3.29Å; V654-F656 PolarHBondContact O-N 3.29Å; V654-M657 HydrophobicContact CB-CE 4.47Å; V654-M657 HydrophobicContact CG1-SD 4.38Å; V654-M657 HydrophobicContact CG2-CE 4.15Å; V654-M657 WeakPolarHBondContact O-CB 3.37Å; V654-M657 PolarHBondContact O-N 3.48Å; V654-F658 HydrophobicContact CG1-CE2 4.49Å
655	Q	50.8	Low	54.9	Low	63 Å²	63	71.2 Å²	71.2	29%	0.294	34%	0.337	S	S	.	.	H	α-helix	trans	-65.5	-29.3	177.7	-63.1	179.9	-27.5	0	0	113.6	V255 S258 S653	V255-Q655 HydrophobicContact CG1-CB 4.11Å; V255-Q655 HydrophobicContact CG1-CG 4.2Å; S258-Q655 PolarHBondContact OG-NE2 3.08Å; S653-Q655 PolarHBondContact O-N 3.2Å
656	F	55.8	Low	56.4	Low	30 Å²	30	73 Å²	73	13%	0.132	35%	0.347	C	S	.	.	H	α-helix	trans	-80.2	-19.2	177.8	-70.9	-77.7	0	0	0	113.7	D334 Y632 T652 S653 V654 F658 K659	D334-F656 HydrophobicContact CB-CE1 4.09Å; D334-F656 HydrophobicContact CB-CZ 3.94Å; D334-F656 WeakPolarHBondContact O-CE1 3.4Å; D334-F656 WeakPolarHBondContact O-CZ 3.35Å; Y632-F656 VanDerWaalsContact OH-C 3.28Å; Y632-F656 PolarHBondContact OH-O 3.41Å; T652-F656 HydrophobicContact CG2-CB 4.35Å; S653-F656 PolarHBondContact O-N 2.79Å; S653-F656 WeakPolarHBondContact OG-CD2 3.49Å; S653-F656 WeakPolarHBondContact OG-CE2 3.19Å; V654-F656 VanDerWaalsContact C-N 3.29Å; V654-F656 PolarHBondContact O-N 3.29Å; F656-F658 PolarHBondContact O-N 3.06Å; F656-K659 HydrophobicContact CD1-CD 3.96Å; F656-K659 HydrophobicContact CE1-CD 4.28Å; F656-K659 PolarHBondContact O-N 3.27Å
657	M	56	Low	57.7	Low	20 Å²	20	70.3 Å²	70.3	10%	0.099	34%	0.335	C	S	.	.	H	α-helix	trans	-60	-37.7	179.1	-68.1	173.2	-158	0	0	112.3	N629 Y632 T652 V654	N629-M657 WeakPolarHBondContact OD1-CE 3.44Å; Y632-M657 HydrophobicContact CD1-CB 4.4Å; Y632-M657 HydrophobicContact CD1-CG 3.61Å; Y632-M657 HydrophobicContact CD2-CB 4.06Å; Y632-M657 HydrophobicContact CD2-CG 4.16Å; Y632-M657 HydrophobicContact CE1-CG 3.91Å; Y632-M657 HydrophobicContact CE2-CB 4.29Å; Y632-M657 HydrophobicContact CE2-CG 4.43Å; Y632-M657 WeakPolarHBondContact CE2-O 3.32Å; Y632-M657 HydrophobicContact CG-CB 4.09Å; Y632-M657 HydrophobicContact CG-CG 3.71Å; T652-M657 HydrophobicContact CG2-CE 4.14Å; T652-M657 HydrophobicContact CG2-CG 4.28Å; V654-M657 HydrophobicContact CB-CE 4.47Å; V654-M657 HydrophobicContact CG1-SD 4.38Å; V654-M657 HydrophobicContact CG2-CE 4.15Å; V654-M657 WeakPolarHBondContact O-CB 3.37Å; V654-M657 PolarHBondContact O-N 3.48Å
658	F	58.4	Low	59.2	Low	2 Å²	2	72.6 Å²	72.6	1%	0.009	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.3	6.6	-173.8	-62.3	-76.7	0	0	0	112.9	R248 L251 L252 V255 E628 V654 F656 E660 Q661 I662	R248-F658 HydrophobicContact CG-CE1 4.38Å; L251-F658 HydrophobicContact CB-CE2 3.87Å; L251-F658 HydrophobicContact CB-CZ 3.83Å; L251-F658 HydrophobicContact CD1-CE2 4.35Å; L251-F658 HydrophobicContact CD1-CZ 4.19Å; L252-F658 HydrophobicContact CB-CD1 4.12Å; L252-F658 HydrophobicContact CB-CE1 4.46Å; L252-F658 HydrophobicContact CB-CG 4.49Å; L252-F658 HydrophobicContact CD1-CD1 4.12Å; L252-F658 HydrophobicContact CG-CD1 4.27Å; V255-F658 HydrophobicContact CG2-CD2 4.02Å; E628-F658 HydrophobicContact CG-CZ 4.12Å; E628-F658 WeakPolarHBondContact OE1-CE1 3.44Å; V654-F658 HydrophobicContact CG1-CE2 4.49Å; F656-F658 PolarHBondContact O-N 3.06Å; F658-E660 VanDerWaalsContact C-N 3.27Å; F658-E660 PolarHBondContact O-N 3.04Å; F658-E660 VanDerWaalsContact O-N 3.16Å; F658-Q661 CarbonylContact O-C 3.48Å; F658-Q661 PolarHBondContact O-N 3.48Å; F658-I662 VanDerWaalsContact C-CD1 3.47Å; F658-I662 HydrophobicContact CB-CD1 3.7Å; F658-I662 HydrophobicContact CB-CG1 4.1Å; F658-I662 WeakPolarHBondContact O-CD1 3.4Å; F658-I662 WeakPolarHBondContact O-CG1 3.45Å; F658-I662 PolarHBondContact O-N 3.34Å; F658-I662 VanDerWaalsContact O-N 3.12Å
659	K	61.9	Low	60.8	Low	118 Å²	118	74.8 Å²	74.8	51%	0.513	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-55.4	-39.3	-169.6	-170.6	173.7	177.2	178.3	0	113.4	F656 Q661	F656-K659 HydrophobicContact CD1-CD 3.96Å; F656-K659 HydrophobicContact CE1-CD 4.28Å; F656-K659 PolarHBondContact O-N 3.27Å; K659-Q661 VanDerWaalsContact C-N 3.31Å; K659-Q661 PolarHBondContact O-N 3.07Å
660	E	58.6	Low	62.4	Low	200 Å²	200	71.2 Å²	71.2	94%	0.935	35%	0.345	S	S	*	.	G	3₁₀ helix	trans	-72.6	-23.6	178.6	-65.6	-177.7	176.3	0	0	113.5	F658	F658-E660 VanDerWaalsContact C-N 3.27Å; F658-E660 PolarHBondContact O-N 3.04Å; F658-E660 VanDerWaalsContact O-N 3.16Å
661	Q	57.9	Low	64	Low	102 Å²	102	70 Å²	70	48%	0.477	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-96.8	-0.8	-179.2	-63.4	175	-5.7	0	0	112.5	L252 F658 K659	L252-Q661 HydrophobicContact CD1-CB 3.84Å; F658-Q661 CarbonylContact O-C 3.48Å; F658-Q661 PolarHBondContact O-N 3.48Å; K659-Q661 VanDerWaalsContact C-N 3.31Å; K659-Q661 PolarHBondContact O-N 3.07Å
662	I	64.6	Low	65.3	Low	22 Å²	22	68.6 Å²	68.6	11%	0.113	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-94	121.7	-176.7	-71.8	157.6	0	0	0	110	V255 I259 F658 E664	V255-I662 HydrophobicContact CB-CD1 4.28Å; V255-I662 HydrophobicContact CG1-CD1 3.39Å; I259-I662 HydrophobicContact CD1-CD1 3.67Å; I259-I662 HydrophobicContact CD1-CG2 3.91Å; F658-I662 VanDerWaalsContact C-CD1 3.47Å; F658-I662 HydrophobicContact CB-CD1 3.7Å; F658-I662 HydrophobicContact CB-CG1 4.1Å; F658-I662 WeakPolarHBondContact O-CD1 3.4Å; F658-I662 WeakPolarHBondContact O-CG1 3.45Å; F658-I662 PolarHBondContact O-N 3.34Å; F658-I662 VanDerWaalsContact O-N 3.12Å; I662-E664 PolarHBondContact O-N 3.37Å
663	Q	69.8	Low	66.6	Low	146 Å²	146	70.9 Å²	70.9	68%	0.682	35%	0.352	S	S	*	.	P	Polyproline II helix	trans	-70.3	125.4	168.5	-168	170	11.1	0	0	109.7
664	E	72.4	Confident	67.8	Low	115 Å²	115	68.9 Å²	68.9	54%	0.537	34%	0.338	S	S	.	.	P	Polyproline II helix	trans	-67.2	131.8	170.8	-65	-154.5	140.7	0	0	109.5	R327 I662 T666	R327-E664 IonicContact CZ-OE2 3.19Å; R327-E664 IonicContact NH1-OE2 2.98Å; R327-E664 IonicContact NH2-OE1 3.67Å; R327-E664 PolarHBondContact NH2-OE1 3.39Å; R327-E664 IonicContact NH2-OE2 2.78Å; R327-E664 PolarHBondContact NH2-OE2 3.42Å; I662-E664 PolarHBondContact O-N 3.37Å; E664-T666 PolarHBondContact O-N 3.11Å
665	P	76.5	Confident	68.9	Low	13 Å²	13	70.9 Å²	70.9	8%	0.084	35%	0.345	C	S	.	.	P	Polyproline II helix	trans	-63.2	136.8	179.1	25.2	-32.6	0	0	0	110.2	I260 R263 L670	I260-P665 HydrophobicContact CG1-CB 4.16Å; I260-P665 HydrophobicContact CG1-CG 4.21Å; R263-P665 HydrophobicContact CB-CG 4.24Å; R263-P665 HydrophobicContact CG-CG 4.19Å; P665-L670 HydrophobicContact CB-CD2 4.29Å; P665-L670 HydrophobicContact CB-CG 4.2Å; P665-L670 HydrophobicContact CG-CD1 4.33Å; P665-L670 HydrophobicContact CG-CD2 4.28Å; P665-L670 HydrophobicContact CG-CG 4.4Å
666	T	78.6	Confident	69.9	Low	76 Å²	76	74.9 Å²	74.9	47%	0.466	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-69.8	156.2	175.5	55.7	0	0	0	0	109.9	E664 E668 E669 L670	E664-T666 PolarHBondContact O-N 3.11Å; T666-E668 VanDerWaalsContact C-N 3.32Å; T666-E668 PolarHBondContact O-N 2.99Å; T666-E669 PolarHBondContact O-N 3.31Å; T666-E669 WeakPolarHBondContact OG1-CB 3.4Å; T666-L670 PolarHBondContact O-N 3.01Å; T666-L670 VanDerWaalsContact O-N 3.16Å
667	E	72.7	Confident	70.5	Confident	83 Å²	83	77.3 Å²	77.3	39%	0.388	38%	0.375	S	S	.	.	H	α-helix	trans	-64.7	-40.3	-179.4	-170.5	-178.6	149.4	0	0	112.2	R323 E669 L670 V671	R323-E667 IonicContact CZ-OE1 3.2Å; R323-E667 IonicContact CZ-OE2 2.91Å; R323-E667 IonicContact NE-OE1 2.59Å; R323-E667 IonicContact NE-OE2 3.6Å; R323-E667 IonicContact NH1-OE1 2.85Å; R323-E667 PolarHBondContact NH1-OE1 2.91Å; R323-E667 IonicContact NH1-OE2 3.26Å; R323-E667 VanDerWaalsContact NH2-CD 3.25Å; R323-E667 IonicContact NH2-OE1 2.79Å; R323-E667 PolarHBondContact NH2-OE1 3.49Å; R323-E667 VanDerWaalsContact NH2-OE1 3.17Å; R323-E667 IonicContact NH2-OE2 3.85Å; R323-E667 PolarHBondContact NH2-OE2 3.44Å; E667-E669 VanDerWaalsContact C-N 3.29Å; E667-E669 PolarHBondContact O-N 3.33Å; E667-L670 PolarHBondContact O-N 3.49Å; E667-V671 HydrophobicContact CG-CG2 4.39Å; E667-V671 WeakPolarHBondContact O-CG2 3.27Å; E667-V671 PolarHBondContact O-N 3.4Å
668	E	76.7	Confident	70.7	Confident	164 Å²	164	80.5 Å²	80.5	77%	0.766	40%	0.397	S	S	*	.	H	α-helix	trans	-59.3	-40.8	176.4	-63.7	175.2	-174.8	0	0	111.6	T666 V671 C672	T666-E668 VanDerWaalsContact C-N 3.32Å; T666-E668 PolarHBondContact O-N 2.99Å; E668-V671 PolarHBondContact O-N 2.99Å; E668-C672 WeakPolarHBondContact O-CB 3.47Å; E668-C672 PolarHBondContact O-N 3.04Å
669	E	78.9	Confident	70.8	Confident	77 Å²	77	86.3 Å²	86.3	36%	0.36	42%	0.424	S	S	.	.	H	α-helix	trans	-64.2	-44.2	176.3	-171.8	-175.1	177.6	0	0	111.4	T666 E667 Q673	T666-E669 PolarHBondContact O-N 3.31Å; T666-E669 WeakPolarHBondContact OG1-CB 3.4Å; E667-E669 VanDerWaalsContact C-N 3.29Å; E667-E669 PolarHBondContact O-N 3.33Å; E669-Q673 WeakPolarHBondContact O-CB 3.28Å; E669-Q673 VanDerWaalsContact O-CG 3.31Å; E669-Q673 WeakPolarHBondContact O-CG 3.42Å; E669-Q673 PolarHBondContact O-N 2.96Å; E669-Q673 PolarHBondContact OE1-NE2 3.45Å
670	L	78.6	Confident	70.6	Confident	18 Å²	18	83.2 Å²	83.2	9%	0.094	41%	0.413	C	S	.	.	H	α-helix	trans	-64.1	-43.5	177.4	-70.4	170.4	0	0	0	111.8	R263 L264 P665 T666 E667 L674	R263-L670 HydrophobicContact CB-CD1 4.2Å; R263-L670 HydrophobicContact CB-CD2 4.07Å; L264-L670 HydrophobicContact CB-CD2 4.06Å; L264-L670 HydrophobicContact CD1-CD2 4.28Å; L264-L670 WeakPolarHBondContact CD1-O 3.27Å; P665-L670 HydrophobicContact CB-CD2 4.29Å; P665-L670 HydrophobicContact CB-CG 4.2Å; P665-L670 HydrophobicContact CG-CD1 4.33Å; P665-L670 HydrophobicContact CG-CD2 4.28Å; P665-L670 HydrophobicContact CG-CG 4.4Å; T666-L670 PolarHBondContact O-N 3.01Å; T666-L670 VanDerWaalsContact O-N 3.16Å; E667-L670 PolarHBondContact O-N 3.49Å; L670-L674 VanDerWaalsContact O-CB 3.31Å; L670-L674 WeakPolarHBondContact O-CB 3.48Å; L670-L674 PolarHBondContact O-N 2.91Å
671	V	76.8	Confident	70.5	Confident	27 Å²	27	82.2 Å²	82.2	16%	0.164	41%	0.408	C	S	.	.	H	α-helix	trans	-67.5	-44.9	179.3	173.2	0	0	0	0	110.4	E667 E668 Q673 L674 H675	E667-V671 HydrophobicContact CG-CG2 4.39Å; E667-V671 WeakPolarHBondContact O-CG2 3.27Å; E667-V671 PolarHBondContact O-N 3.4Å; E668-V671 PolarHBondContact O-N 2.99Å; V671-Q673 PolarHBondContact O-N 2.81Å; V671-L674 WeakPolarHBondContact O-CB 3.32Å; V671-L674 PolarHBondContact O-N 3.32Å; V671-L674 VanDerWaalsContact O-N 3.15Å; V671-H675 WeakPolarHBondContact CG1-CE1 3.44Å; V671-H675 WeakPolarHBondContact CG1-ND1 3.28Å; V671-H675 PolarHBondContact O-N 3.38Å; V671-H675 PolarHBondContact O-ND1 3.18Å
672	C	78.6	Confident	70.5	Confident	63 Å²	63	78.9 Å²	78.9	43%	0.426	39%	0.393	S	S	.	.	H	α-helix	trans	-61.2	-45.3	177.1	-173	0	0	0	0	111.9	E668 L674 H675 Q676	E668-C672 WeakPolarHBondContact O-CB 3.47Å; E668-C672 PolarHBondContact O-N 3.04Å; C672-L674 VanDerWaalsContact C-N 3.28Å; C672-L674 PolarHBondContact O-N 2.92Å; C672-H675 PolarHBondContact O-N 3.46Å; C672-Q676 WeakPolarHBondContact O-CG 3.3Å; C672-Q676 PolarHBondContact O-N 3.34Å
673	Q	75.6	Confident	69.7	Low	61 Å²	61	87 Å²	87	29%	0.285	43%	0.431	S	S	.	.	H	α-helix	trans	-63.4	-33.8	174.6	-74.8	-177.3	16.8	0	0	112.7	L264 E669 V671 Q676 H677	L264-Q673 HydrophobicContact CD1-CB 4.27Å; E669-Q673 WeakPolarHBondContact O-CB 3.28Å; E669-Q673 VanDerWaalsContact O-CG 3.31Å; E669-Q673 WeakPolarHBondContact O-CG 3.42Å; E669-Q673 PolarHBondContact O-N 2.96Å; E669-Q673 PolarHBondContact OE1-NE2 3.45Å; V671-Q673 PolarHBondContact O-N 2.81Å; Q673-Q676 PolarHBondContact O-N 2.78Å; Q673-H677 PolarHBondContact O-N 3.2Å
674	L	76.4	Confident	68.7	Low	4 Å²	4	83.5 Å²	83.5	2%	0.021	41%	0.411	C	S	.	.	H	α-helix	trans	-67.9	-40.8	175.6	-159.6	72.5	0	0	0	111.5	L264 A268 L670 V671 C672 Q676 H677 L680 L682 W684	L264-L674 HydrophobicContact CD1-CB 4.11Å; L264-L674 HydrophobicContact CD1-CD1 3.85Å; L264-L674 HydrophobicContact CG-CD1 4.32Å; A268-L674 HydrophobicContact CB-CD1 3.75Å; L670-L674 VanDerWaalsContact O-CB 3.31Å; L670-L674 WeakPolarHBondContact O-CB 3.48Å; L670-L674 PolarHBondContact O-N 2.91Å; V671-L674 WeakPolarHBondContact O-CB 3.32Å; V671-L674 PolarHBondContact O-N 3.32Å; V671-L674 VanDerWaalsContact O-N 3.15Å; C672-L674 VanDerWaalsContact C-N 3.28Å; C672-L674 PolarHBondContact O-N 2.92Å; L674-Q676 VanDerWaalsContact C-N 3.3Å; L674-Q676 PolarHBondContact O-N 2.81Å; L674-H677 WeakPolarHBondContact O-CB 3.48Å; L674-H677 PolarHBondContact O-N 3.13Å; L674-L680 HydrophobicContact CD1-CD2 3.4Å; L674-L680 HydrophobicContact CD2-CD2 4.23Å; L674-L680 HydrophobicContact CG-CD2 3.64Å; L674-L682 HydrophobicContact CD2-CD1 3.92Å; L674-L682 HydrophobicContact CG-CD1 4.36Å; L674-W684 HydrophobicContact CD2-CH2 4.09Å; L674-W684 HydrophobicContact CD2-CZ2 3.93Å
675	H	70.9	Confident	67.4	Low	85 Å²	85	88.4 Å²	88.4	39%	0.394	43%	0.425	S	S	.	.	H	α-helix	trans	-64.6	-33.7	176.1	-79.4	74.8	0	0	0	112.7	V671 C672 H677 W684	V671-H675 WeakPolarHBondContact CG1-CE1 3.44Å; V671-H675 WeakPolarHBondContact CG1-ND1 3.28Å; V671-H675 PolarHBondContact O-N 3.38Å; V671-H675 PolarHBondContact O-ND1 3.18Å; C672-H675 PolarHBondContact O-N 3.46Å; H675-H677 VanDerWaalsContact C-N 3.28Å; H675-H677 PolarHBondContact O-N 3.48Å; H675-W684 AromaticContact CE1-CE2 3.74Å; H675-W684 AromaticContact CE1-CZ2 3.78Å; H675-W684 AromaticContact NE2-CD2 3.83Å; H675-W684 AromaticContact NE2-CE2 3.76Å; H675-W684 AromaticContact NE2-NE1 3.84Å
676	Q	71.4	Confident	65.6	Low	146 Å²	146	94.8 Å²	94.8	68%	0.682	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-0.3	178.3	-66.3	177.1	6.9	0	0	113.2	C672 Q673 L674 P678	C672-Q676 WeakPolarHBondContact O-CG 3.3Å; C672-Q676 PolarHBondContact O-N 3.34Å; Q673-Q676 PolarHBondContact O-N 2.78Å; L674-Q676 VanDerWaalsContact C-N 3.3Å; L674-Q676 PolarHBondContact O-N 2.81Å; Q676-P678 WeakPolarHBondContact O-CD 3.23Å
677	H	68.7	Low	63.9	Low	82 Å²	82	99.7 Å²	99.7	38%	0.38	47%	0.471	S	S	.	.			trans	-79.4	119	-170.9	-143.4	-69.1	0	0	0	111.6	Q673 L674 H675 H679 L680	Q673-H677 PolarHBondContact O-N 3.2Å; L674-H677 WeakPolarHBondContact O-CB 3.48Å; L674-H677 PolarHBondContact O-N 3.13Å; H675-H677 VanDerWaalsContact C-N 3.28Å; H675-H677 PolarHBondContact O-N 3.48Å; H677-H679 PolarHBondContact O-N 3.18Å; H677-L680 HydrophobicContact CB-CB 4.25Å; H677-L680 PolarHBondContact O-N 3.23Å
678	P	61.3	Low	62.4	Low	87 Å²	87	100.7 Å²	100.7	57%	0.565	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-8	-166.9	26	-36.2	0	0	0	115.7	Q676	Q676-P678 WeakPolarHBondContact O-CD 3.23Å
679	H	60	Low	60.6	Low	124 Å²	124	99.2 Å²	99.2	57%	0.574	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.2	5.5	-175.4	-56.2	-58.6	0	0	0	112.7	E84 H677	E84-H679 IonicContact OE1-CE1 2.8Å; H677-H679 PolarHBondContact O-N 3.18Å
680	L	58.3	Low	58.6	Low	53 Å²	53	101.6 Å²	101.6	28%	0.277	48%	0.484	S	S	.	.			trans	-121.8	82.2	-178.3	-159	88.2	0	0	0	108.4	A268 L674 H677 L682	A268-L680 HydrophobicContact CB-CD2 4.46Å; L674-L680 HydrophobicContact CD1-CD2 3.4Å; L674-L680 HydrophobicContact CD2-CD2 4.23Å; L674-L680 HydrophobicContact CG-CD2 3.64Å; H677-L680 HydrophobicContact CB-CB 4.25Å; H677-L680 PolarHBondContact O-N 3.23Å; L680-L682 HydrophobicContact CD2-CD1 3.41Å; L680-L682 VanDerWaalsContact CD2-CD1 3.41Å; L680-L682 HydrophobicContact CD2-CG 3.82Å; L680-L682 HydrophobicContact CG-CD1 4.09Å; L680-L682 HydrophobicContact CG-CD2 4.43Å; L680-L682 HydrophobicContact CG-CG 3.91Å; L680-L682 PolarHBondContact O-N 2.88Å; L680-L682 VanDerWaalsContact O-N 3.16Å
681	H	56.9	Low	56.8	Low	179 Å²	179	105.4 Å²	105.4	83%	0.829	50%	0.503	S	S	*	.			trans	-82.5	87.9	169.9	-67.8	-66.6	0	0	0	108.3
682	L	56.3	Low	54.9	Low	31 Å²	31	114.3 Å²	114.3	16%	0.162	53%	0.534	C	S	.	.			trans	-84.2	127.8	167.5	-66.5	167.8	0	0	0	107.6	H271 V272 L674 L680 W684	H271-L682 VanDerWaalsContact ND1-CD1 3.31Å; H271-L682 WeakPolarHBondContact ND1-CD1 3.49Å; H271-L682 WeakPolarHBondContact ND1-CD2 3.39Å; V272-L682 HydrophobicContact CG2-CD2 4.08Å; L674-L682 HydrophobicContact CD2-CD1 3.92Å; L674-L682 HydrophobicContact CG-CD1 4.36Å; L680-L682 HydrophobicContact CD2-CD1 3.41Å; L680-L682 VanDerWaalsContact CD2-CD1 3.41Å; L680-L682 HydrophobicContact CD2-CG 3.82Å; L680-L682 HydrophobicContact CG-CD1 4.09Å; L680-L682 HydrophobicContact CG-CD2 4.43Å; L680-L682 HydrophobicContact CG-CG 3.91Å; L680-L682 PolarHBondContact O-N 2.88Å; L680-L682 VanDerWaalsContact O-N 3.16Å; L682-W684 VanDerWaalsContact C-N 3.35Å; L682-W684 HydrophobicContact CB-CD2 4.4Å; L682-W684 HydrophobicContact CB-CZ2 4.15Å; L682-W684 HydrophobicContact CD1-CH2 4.1Å; L682-W684 HydrophobicContact CD1-CZ2 3.42Å; L682-W684 VanDerWaalsContact CD1-CZ2 3.42Å; L682-W684 HydrophobicContact CG-CZ2 4.43Å; L682-W684 PolarHBondContact O-N 3.35Å
683	E	47.9	Very low	52.8	Low	194 Å²	194	115.6 Å²	115.6	91%	0.907	54%	0.543	S	S	*	.			trans	-69.7	95.6	166.3	-79.9	-176.4	164.7	0	0	108.1
684	W	49.2	Very low	50.9	Low	72 Å²	72	116.9 Å²	116.9	27%	0.273	56%	0.559	S	S	.	*			trans	-81.4	122.9	173.4	-61.4	97.6	0	0	0	108.9	H271 L674 H675 L682 H686	H271-W684 AromaticContact CD2-CH2 3.3Å; H271-W684 WeakPolarHBondContact CD2-CH2 3.31Å; H271-W684 AromaticContact CD2-CZ3 3.26Å; H271-W684 WeakPolarHBondContact CD2-CZ3 3.31Å; H271-W684 AromaticContact CE1-CH2 3.96Å; H271-W684 AromaticContact CE1-CZ3 3.92Å; H271-W684 AromaticContact CG-CH2 3.96Å; H271-W684 AromaticContact NE2-CE3 3.4Å; H271-W684 AromaticContact NE2-CH2 3.32Å; H271-W684 VanDerWaalsContact NE2-CH2 3.32Å; H271-W684 WeakPolarHBondContact NE2-CH2 3.42Å; H271-W684 AromaticContact NE2-CZ3 2.97Å; H271-W684 WeakPolarHBondContact NE2-CZ3 3.29Å; L674-W684 HydrophobicContact CD2-CH2 4.09Å; L674-W684 HydrophobicContact CD2-CZ2 3.93Å; H675-W684 AromaticContact CE1-CE2 3.74Å; H675-W684 AromaticContact CE1-CZ2 3.78Å; H675-W684 AromaticContact NE2-CD2 3.83Å; H675-W684 AromaticContact NE2-CE2 3.76Å; H675-W684 AromaticContact NE2-NE1 3.84Å; L682-W684 VanDerWaalsContact C-N 3.35Å; L682-W684 HydrophobicContact CB-CD2 4.4Å; L682-W684 HydrophobicContact CB-CZ2 4.15Å; L682-W684 HydrophobicContact CD1-CH2 4.1Å; L682-W684 HydrophobicContact CD1-CZ2 3.42Å; L682-W684 VanDerWaalsContact CD1-CZ2 3.42Å; L682-W684 HydrophobicContact CG-CZ2 4.43Å; L682-W684 PolarHBondContact O-N 3.35Å; W684-H686 PolarHBondContact O-N 3.48Å
685	R	45.3	Very low	49	Very low	217 Å²	217	123.7 Å²	123.7	82%	0.819	60%	0.595	S	S	*	*			trans	-80.7	116.4	179.1	-155.3	-179.1	-92.9	-174	-3.8	109.7	E687	R685-E687 VanDerWaalsContact C-N 3.3Å; R685-E687 PolarHBondContact O-N 3.43Å
686	H	38.4	Very low	47.3	Very low	148 Å²	148	130.7 Å²	130.7	69%	0.685	63%	0.627	S	S	*	*	S	Bend	trans	11.8	-11.9	171.9	-83	-71.1	0	0	0	125.5	W684 Q689	W684-H686 PolarHBondContact O-N 3.48Å; H686-Q689 PolarHBondContact CE1-OE1 3.03Å; H686-Q689 PolarHBondContact ND1-OE1 3.12Å
687	E	43.4	Very low	46.1	Very low	179 Å²	179	130 Å²	130	84%	0.836	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.2	-15.3	-175.9	-81.5	-176.7	149.1	0	0	115	R685	R685-E687 VanDerWaalsContact C-N 3.3Å; R685-E687 PolarHBondContact O-N 3.43Å
688	H	41.4	Very low	44.9	Very low	103 Å²	103	132.5 Å²	132.5	48%	0.477	64%	0.637	S	S	.	*	T	Hydrogen-bonded Turn	trans	-96.2	3.7	179.2	-77.7	-49.4	0	0	0	115.5	N690 I691	H688-N690 PolarHBondContact O-N 3.27Å; H688-I691 PolarHBondContact O-N 3.45Å
689	Q	38.1	Very low	44	Very low	133 Å²	133	135 Å²	135	62%	0.621	64%	0.641	S	S	*	*	G	3₁₀ helix	trans	-64.9	-19.6	175.3	-90.4	178.3	-27.2	0	0	113.6	H686 I691 R692	H686-Q689 PolarHBondContact CE1-OE1 3.03Å; H686-Q689 PolarHBondContact ND1-OE1 3.12Å; Q689-I691 VanDerWaalsContact C-N 3.29Å; Q689-I691 PolarHBondContact O-N 2.74Å; Q689-R692 PolarHBondContact O-N 2.69Å
690	N	37	Very low	43.1	Very low	128 Å²	128	135.6 Å²	135.6	68%	0.684	65%	0.645	S	S	*	*	G	3₁₀ helix	trans	-74.6	-9.2	176.9	-88.5	-7.4	0	0	0	115	H688 S693	H688-N690 PolarHBondContact O-N 3.27Å; N690-S693 PolarHBondContact O-OG 2.76Å
691	I	42.1	Very low	42.1	Very low	98 Å²	98	140.8 Å²	140.8	50%	0.503	67%	0.668	S	S	.	*	G	3₁₀ helix	trans	-83.5	-20.6	176.4	-59.1	174.2	0	0	0	111	H688 Q689 S693 S694	H688-I691 PolarHBondContact O-N 3.45Å; Q689-I691 VanDerWaalsContact C-N 3.29Å; Q689-I691 PolarHBondContact O-N 2.74Å; I691-S693 VanDerWaalsContact C-N 3.28Å; I691-S693 PolarHBondContact O-N 3.49Å; I691-S694 PolarHBondContact O-OG 3.45Å
692	R	35.7	Very low	41.2	Very low	214 Å²	214	138.3 Å²	138.3	81%	0.808	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.6	-20.6	175.6	-146.2	179	-161.1	179.9	5.4	112.8	Q689	Q689-R692 PolarHBondContact O-N 2.69Å
693	S	35.4	Very low	40.1	Very low	89 Å²	89	145.9 Å²	145.9	62%	0.622	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.4	-12.2	179.6	47.3	0	0	0	0	114.4	N690 I691	N690-S693 PolarHBondContact O-OG 2.76Å; I691-S693 VanDerWaalsContact C-N 3.28Å; I691-S693 PolarHBondContact O-N 3.49Å
694	S	34.2	Very low	39.5	Very low	89 Å²	89	142.2 Å²	142.2	62%	0.622	68%	0.676	S	S	*	*	S	Bend	trans	-101.1	0.5	-177.9	68	0	0	0	0	114.6	I691	I691-S694 PolarHBondContact O-OG 3.45Å
695	L	38	Very low	38.7	Very low	146 Å²	146	148.1 Å²	148.1	76%	0.764	71%	0.71	S	S	*	*			trans	-134.6	23.4	-173.8	-94	152.6	0	0	0	113
696	H	35.1	Very low	38.1	Very low	233 Å²	233	141.8 Å²	141.8	100%	1.079	70%	0.7	S	S	*	*			trans	-100.7	0	167.4	-117.8	-50.3	0	0	0	111.8

Retrieved 696 of 696 residues in 180.2 ms (Link to these results)

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