A0A060WQH5_ONCMY Loading...

vesicle-fusing ATPase

AlphaFold DB , UniProt , Accession A0A060WQH5, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110530405, Length 527 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	36.7	Very low	52.7	Low	245 Å²	245	133.2 Å²	133.2	100%	1.207	68%	0.683	S	S	*	*				0	107.9	0	-86.8	169.7	162	0	0	108.4	L3	M1-L3 PolarHBondContact O-N 3.18Å
2	K	35.8	Very low	54.9	Low	218 Å²	218	128.4 Å²	128.4	95%	0.948	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-77.1	116.1	170	-81.7	179.3	174.9	177.7	0	107.3
3	L	32.9	Very low	56.7	Low	158 Å²	158	118.5 Å²	118.5	83%	0.827	60%	0.603	S	S	*	*	P	Polyproline II helix	trans	-59.7	141.4	170.2	-76.9	155.6	0	0	0	109.3	M1 M5	M1-L3 PolarHBondContact O-N 3.18Å; L3-M5 PolarHBondContact O-N 3.13Å
4	P	41.7	Very low	58.7	Low	119 Å²	119	114.7 Å²	114.7	77%	0.773	58%	0.584	S	S	*	*	P	Polyproline II helix	trans	-68.8	128.9	178.7	27.9	-30.7	0	0	0	109.6	E6	P4-E6 PolarHBondContact O-N 3.48Å
5	M	39.8	Very low	60.5	Low	183 Å²	183	110.5 Å²	110.5	90%	0.901	57%	0.573	S	S	*	*	P	Polyproline II helix	trans	-64.8	122.2	173	-68.4	-86.4	-80.3	0	0	109	L3	L3-M5 PolarHBondContact O-N 3.13Å
6	E	46.9	Very low	62.1	Low	153 Å²	153	105.7 Å²	105.7	72%	0.715	55%	0.55	S	S	*	*	P	Polyproline II helix	trans	-57.4	132.9	171.8	-92	-114.7	175.1	0	0	110.3	P4 T8 K12	P4-E6 PolarHBondContact O-N 3.48Å; E6-T8 PolarHBondContact O-N 3.42Å; E6-K12 IonicContact OE2-NZ 3.67Å; E6-K12 PolarHBondContact OE2-NZ 3.42Å
7	P	53.5	Low	63.5	Low	62 Å²	62	99.8 Å²	99.8	40%	0.403	52%	0.52	S	S	.	.	P	Polyproline II helix	trans	-66.6	136.6	178.7	22.4	-27.5	0	0	0	110.7	Q11 K12	P7-Q11 HydrophobicContact CB-CB 3.88Å; P7-K12 HydrophobicContact CB-CG 4.49Å; P7-K12 HydrophobicContact CG-CG 4.21Å; P7-K12 WeakPolarHBondContact O-CE 3.08Å
8	T	70	Confident	65	Low	84 Å²	84	100.8 Å²	100.8	52%	0.515	52%	0.522	S	S	.	.	P	Polyproline II helix	trans	-56.1	152.3	175.1	46.9	0	0	0	0	111.1	E6 L10 Q11 K12	E6-T8 PolarHBondContact O-N 3.42Å; T8-L10 PolarHBondContact O-N 3.39Å; T8-Q11 WeakPolarHBondContact O-CA 3.44Å; T8-Q11 WeakPolarHBondContact O-CB 3.48Å; T8-Q11 PolarHBondContact O-N 3.42Å; T8-Q11 WeakPolarHBondContact OG1-CG 3.35Å; T8-Q11 PolarHBondContact OG1-OE1 3.25Å; T8-Q11 VanDerWaalsContact OG1-OE1 3.1Å; T8-K12 PolarHBondContact O-N 3.02Å; T8-K12 VanDerWaalsContact O-N 3.13Å
9	N	70.6	Confident	66.4	Low	77 Å²	77	101.4 Å²	101.4	41%	0.412	52%	0.52	S	S	.	.	H	α-helix	trans	-52.4	-32.5	179.9	-72	-31.1	0	0	0	113	K12 A13 I46	N9-K12 PolarHBondContact O-N 3.25Å; N9-A13 PolarHBondContact O-N 2.91Å; N9-I46 HydrophobicContact CB-CG1 4.32Å
10	L	73.4	Confident	67.5	Low	58 Å²	58	96.4 Å²	96.4	30%	0.304	49%	0.494	S	S	.	.	H	α-helix	trans	-66.9	-40.1	174.5	-173	63.8	0	0	0	113	T8 K12 A13 I14 F43 I46	T8-L10 PolarHBondContact O-N 3.39Å; L10-K12 VanDerWaalsContact C-N 3.33Å; L10-A13 PolarHBondContact O-N 3.47Å; L10-I14 HydrophobicContact CD1-CD1 4.49Å; L10-I14 HydrophobicContact CG-CD1 4.06Å; L10-I14 VanDerWaalsContact O-CG1 3.25Å; L10-I14 WeakPolarHBondContact O-CG1 3.38Å; L10-I14 PolarHBondContact O-N 3.12Å; L10-F43 HydrophobicContact CD1-CD1 4.43Å; L10-F43 HydrophobicContact CD1-CE1 3.94Å; L10-I46 HydrophobicContact CB-CD1 4.42Å; L10-I46 HydrophobicContact CD1-CD1 4.13Å
11	Q	78.4	Confident	68.6	Low	108 Å²	108	93.9 Å²	93.9	51%	0.505	49%	0.486	S	S	.	.	H	α-helix	trans	-65.7	-37.4	174.9	-73.4	169.3	-34.1	0	0	111.5	P7 T8 I14 A15	P7-Q11 HydrophobicContact CB-CB 3.88Å; T8-Q11 WeakPolarHBondContact O-CA 3.44Å; T8-Q11 WeakPolarHBondContact O-CB 3.48Å; T8-Q11 PolarHBondContact O-N 3.42Å; T8-Q11 WeakPolarHBondContact OG1-CG 3.35Å; T8-Q11 PolarHBondContact OG1-OE1 3.25Å; T8-Q11 VanDerWaalsContact OG1-OE1 3.1Å; Q11-I14 PolarHBondContact O-N 2.98Å; Q11-A15 WeakPolarHBondContact O-CB 3.39Å; Q11-A15 PolarHBondContact O-N 3.1Å
12	K	79.3	Confident	71.2	Confident	76 Å²	76	88.4 Å²	88.4	33%	0.33	46%	0.457	S	S	.	.	H	α-helix	trans	-63.6	-43.6	173.6	-65.5	-179.4	-177.7	173.7	0	111.2	E6 P7 T8 N9 L10 A15 V16	E6-K12 IonicContact OE2-NZ 3.67Å; E6-K12 PolarHBondContact OE2-NZ 3.42Å; P7-K12 HydrophobicContact CB-CG 4.49Å; P7-K12 HydrophobicContact CG-CG 4.21Å; P7-K12 WeakPolarHBondContact O-CE 3.08Å; T8-K12 PolarHBondContact O-N 3.02Å; T8-K12 VanDerWaalsContact O-N 3.13Å; N9-K12 PolarHBondContact O-N 3.25Å; L10-K12 VanDerWaalsContact C-N 3.33Å; K12-A15 PolarHBondContact O-N 3.43Å; K12-V16 WeakPolarHBondContact O-CG2 3.46Å; K12-V16 PolarHBondContact O-N 2.91Å; K12-V16 VanDerWaalsContact O-N 3.14Å
13	A	78.4	Confident	73.8	Confident	0 Å²	0	79.4 Å²	79.4	0%	0	42%	0.418	C	S	.	.	H	α-helix	trans	-64.2	-40.1	176.5	0	0	0	0	0	112.9	N9 L10 V16 A17 F43 I46	N9-A13 PolarHBondContact O-N 2.91Å; L10-A13 PolarHBondContact O-N 3.47Å; A13-V16 PolarHBondContact O-N 3.5Å; A13-A17 PolarHBondContact O-N 3.26Å; A13-A17 VanDerWaalsContact O-N 3.11Å; A13-F43 HydrophobicContact CB-CD1 3.99Å; A13-F43 HydrophobicContact CB-CD2 4.36Å; A13-F43 HydrophobicContact CB-CE1 3.72Å; A13-F43 HydrophobicContact CB-CE2 4.1Å; A13-F43 HydrophobicContact CB-CG 4.3Å; A13-F43 HydrophobicContact CB-CZ 3.77Å; A13-I46 HydrophobicContact CB-CD1 3.65Å
14	I	84.3	Confident	76.6	Confident	65 Å²	65	72.7 Å²	72.7	33%	0.333	38%	0.383	S	S	.	.	H	α-helix	trans	-65.5	-41	175.8	-68.4	165.5	0	0	0	111.1	L10 Q11 V16 A17 Q18 F43	L10-I14 HydrophobicContact CD1-CD1 4.49Å; L10-I14 HydrophobicContact CG-CD1 4.06Å; L10-I14 VanDerWaalsContact O-CG1 3.25Å; L10-I14 WeakPolarHBondContact O-CG1 3.38Å; L10-I14 PolarHBondContact O-N 3.12Å; Q11-I14 PolarHBondContact O-N 2.98Å; I14-V16 VanDerWaalsContact C-N 3.35Å; I14-V16 PolarHBondContact O-N 2.87Å; I14-A17 PolarHBondContact O-N 3.44Å; I14-Q18 HydrophobicContact CG2-CG 4.35Å; I14-Q18 WeakPolarHBondContact O-CG 3.35Å; I14-Q18 PolarHBondContact O-N 3.31Å; I14-F43 HydrophobicContact CG1-CE1 4.42Å; I14-F43 HydrophobicContact CG1-CZ 4.11Å
15	A	85.7	Confident	78.9	Confident	51 Å²	51	74.6 Å²	74.6	42%	0.421	38%	0.382	S	S	.	.	H	α-helix	trans	-62.6	-40.3	177.7	0	0	0	0	0	112.3	Q11 K12 Q18 K19	Q11-A15 WeakPolarHBondContact O-CB 3.39Å; Q11-A15 PolarHBondContact O-N 3.1Å; K12-A15 PolarHBondContact O-N 3.43Å; A15-Q18 PolarHBondContact O-N 3.16Å; A15-K19 WeakPolarHBondContact O-CB 3.38Å; A15-K19 PolarHBondContact O-N 2.87Å
16	V	86.4	Confident	81.2	Confident	34 Å²	34	69.1 Å²	69.1	21%	0.206	37%	0.366	C	S	.	.	H	α-helix	trans	-65.6	-40.4	175.3	178.3	0	0	0	0	111.2	K12 A13 I14 K19 A20 H38 A39	K12-V16 WeakPolarHBondContact O-CG2 3.46Å; K12-V16 PolarHBondContact O-N 2.91Å; K12-V16 VanDerWaalsContact O-N 3.14Å; A13-V16 PolarHBondContact O-N 3.5Å; I14-V16 VanDerWaalsContact C-N 3.35Å; I14-V16 PolarHBondContact O-N 2.87Å; V16-K19 WeakPolarHBondContact O-CB 3.48Å; V16-K19 PolarHBondContact O-N 3.04Å; V16-A20 PolarHBondContact O-N 3.36Å; V16-H38 HydrophobicContact CG1-CB 4.28Å; V16-A39 HydrophobicContact CB-CB 4.47Å; V16-A39 HydrophobicContact CG1-CB 4Å
17	A	86.7	Confident	83	Confident	5 Å²	5	63.3 Å²	63.3	4%	0.041	35%	0.347	C	S	.	.	H	α-helix	trans	-67.7	-37.3	176.5	0	0	0	0	0	113	A13 I14 K19 A20 S21 A39 F43 Y67	A13-A17 PolarHBondContact O-N 3.26Å; A13-A17 VanDerWaalsContact O-N 3.11Å; I14-A17 PolarHBondContact O-N 3.44Å; A17-K19 VanDerWaalsContact C-N 3.34Å; A17-A20 PolarHBondContact O-N 3.37Å; A17-S21 PolarHBondContact O-N 3.13Å; A17-A39 HydrophobicContact CB-CB 4.07Å; A17-F43 HydrophobicContact CB-CE2 4.14Å; A17-Y67 HydrophobicContact CB-CE2 4.1Å
18	Q	90.6	Very high	84.7	Confident	119 Å²	119	64.9 Å²	64.9	56%	0.556	35%	0.352	S	S	*	.	H	α-helix	trans	-64.5	-40.7	173.6	-75.6	175.2	-23.6	0	0	111.3	I14 A15 S21 Q22	I14-Q18 HydrophobicContact CG2-CG 4.35Å; I14-Q18 WeakPolarHBondContact O-CG 3.35Å; I14-Q18 PolarHBondContact O-N 3.31Å; A15-Q18 PolarHBondContact O-N 3.16Å; Q18-S21 PolarHBondContact O-N 3.21Å; Q18-Q22 WeakPolarHBondContact O-CG 3.43Å; Q18-Q22 PolarHBondContact O-N 2.88Å
19	K	90.3	Very high	85.7	Confident	112 Å²	112	63.7 Å²	63.7	49%	0.487	34%	0.338	S	S	.	.	H	α-helix	trans	-61.6	-45.3	173.8	-170.6	-173.3	-178.9	-145	0	111.8	A15 V16 A17 S21 Q22 E23	A15-K19 WeakPolarHBondContact O-CB 3.38Å; A15-K19 PolarHBondContact O-N 2.87Å; V16-K19 WeakPolarHBondContact O-CB 3.48Å; V16-K19 PolarHBondContact O-N 3.04Å; A17-K19 VanDerWaalsContact C-N 3.34Å; K19-S21 VanDerWaalsContact C-N 3.29Å; K19-S21 PolarHBondContact O-N 2.91Å; K19-Q22 WeakPolarHBondContact O-CB 3.34Å; K19-Q22 PolarHBondContact O-N 3.34Å; K19-Q22 VanDerWaalsContact O-N 3.15Å; K19-E23 WeakPolarHBondContact CE-OE1 3.35Å; K19-E23 IonicContact NZ-OE1 2.7Å; K19-E23 PolarHBondContact NZ-OE1 3.14Å; K19-E23 WeakPolarHBondContact O-CG 3.43Å; K19-E23 PolarHBondContact O-N 3.09Å
20	A	88.9	Confident	86.5	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-58	-41.9	176.2	0	0	0	0	0	112	V16 A17 E23 D24 Y36	V16-A20 PolarHBondContact O-N 3.36Å; A17-A20 PolarHBondContact O-N 3.37Å; A20-E23 PolarHBondContact O-N 3.39Å; A20-D24 WeakPolarHBondContact O-CB 3.47Å; A20-D24 PolarHBondContact O-N 2.84Å; A20-Y36 HydrophobicContact CB-CD1 3.52Å; A20-Y36 HydrophobicContact CB-CD2 4.07Å; A20-Y36 HydrophobicContact CB-CE1 3.68Å; A20-Y36 HydrophobicContact CB-CE2 4.23Å; A20-Y36 HydrophobicContact CB-CG 3.71Å
21	S	90.9	Very high	87.2	Confident	45 Å²	45	66.8 Å²	66.8	32%	0.315	35%	0.349	S	S	.	.	H	α-helix	trans	-67.3	-34.8	177.1	-174.4	0	0	0	0	113.1	A17 Q18 K19 Q25 Y36	A17-S21 PolarHBondContact O-N 3.13Å; Q18-S21 PolarHBondContact O-N 3.21Å; K19-S21 VanDerWaalsContact C-N 3.29Å; K19-S21 PolarHBondContact O-N 2.91Å; S21-Q25 VanDerWaalsContact O-CG 3.31Å; S21-Q25 WeakPolarHBondContact O-CG 3.32Å; S21-Q25 PolarHBondContact O-N 3.23Å; S21-Y36 WeakPolarHBondContact CA-OH 3.37Å
22	Q	91.4	Very high	87.7	Confident	130 Å²	130	61.6 Å²	61.6	61%	0.607	33%	0.325	S	S	*	.	H	α-helix	trans	-68	-40.6	173.6	-71.7	172	-0.7	0	0	111.9	Q18 K19 Q25 A26	Q18-Q22 WeakPolarHBondContact O-CG 3.43Å; Q18-Q22 PolarHBondContact O-N 2.88Å; K19-Q22 WeakPolarHBondContact O-CB 3.34Å; K19-Q22 PolarHBondContact O-N 3.34Å; K19-Q22 VanDerWaalsContact O-N 3.15Å; Q22-Q25 PolarHBondContact O-N 3.17Å; Q22-A26 VanDerWaalsContact O-CB 3.24Å; Q22-A26 WeakPolarHBondContact O-CB 3.17Å; Q22-A26 PolarHBondContact O-N 2.86Å
23	E	90.1	Very high	88.2	Confident	28 Å²	28	58.7 Å²	58.7	13%	0.131	31%	0.312	C	S	.	.	H	α-helix	trans	-65.9	-37.9	176.7	-70.6	167.1	172.9	0	0	111.7	K19 A20 A26 G27 N28 E31 A32 S35	K19-E23 WeakPolarHBondContact CE-OE1 3.35Å; K19-E23 IonicContact NZ-OE1 2.7Å; K19-E23 PolarHBondContact NZ-OE1 3.14Å; K19-E23 WeakPolarHBondContact O-CG 3.43Å; K19-E23 PolarHBondContact O-N 3.09Å; A20-E23 PolarHBondContact O-N 3.39Å; E23-A26 PolarHBondContact O-N 3.02Å; E23-G27 PolarHBondContact O-N 2.84Å; E23-N28 PolarHBondContact O-N 2.94Å; E23-E31 VanDerWaalsContact OE2-O 3.13Å; E23-A32 HydrophobicContact CB-CB 3.91Å; E23-S35 WeakPolarHBondContact OE2-CB 3.39Å; E23-S35 PolarHBondContact OE2-OG 2.93Å
24	D	90.4	Very high	88.7	Confident	17 Å²	17	64.2 Å²	64.2	9%	0.091	34%	0.337	C	S	.	.	H	α-helix	trans	-62.7	-47.5	174	-169.7	-10.1	0	0	0	111.1	A20 A26 G27 A32 Y36 R70	A20-D24 WeakPolarHBondContact O-CB 3.47Å; A20-D24 PolarHBondContact O-N 2.84Å; D24-A26 VanDerWaalsContact C-N 3.32Å; D24-A26 PolarHBondContact O-N 2.98Å; D24-G27 PolarHBondContact O-N 3.32Å; D24-A32 HydrophobicContact CB-CB 4.02Å; D24-Y36 HydrophobicContact CB-CE2 4.03Å; D24-Y36 WeakPolarHBondContact OD2-CE2 3.19Å; D24-Y36 PolarHBondContact OD2-OH 3.16Å; D24-R70 IonicContact OD1-CZ 2.81Å; D24-R70 IonicContact OD1-NE 2.7Å; D24-R70 IonicContact OD1-NH2 3.23Å; D24-R70 PolarHBondContact OD1-NH2 3.27Å; D24-R70 IonicContact OD2-CZ 3.95Å; D24-R70 IonicContact OD2-NE 2.84Å; D24-R70 PolarHBondContact OD2-NE 3.36Å; D24-R70 IonicContact OD2-NH2 2.7Å; D24-R70 PolarHBondContact OD2-NH2 3.28Å
25	Q	90.6	Very high	88.9	Confident	159 Å²	159	61.9 Å²	61.9	74%	0.743	33%	0.326	S	S	*	.	H	α-helix	trans	-66.9	-30.9	176.2	-71.9	174.7	6.4	0	0	113.3	S21 Q22 G27	S21-Q25 VanDerWaalsContact O-CG 3.31Å; S21-Q25 WeakPolarHBondContact O-CG 3.32Å; S21-Q25 PolarHBondContact O-N 3.23Å; Q22-Q25 PolarHBondContact O-N 3.17Å; Q25-G27 PolarHBondContact O-N 3.09Å
26	A	87.6	Confident	89.2	Confident	68 Å²	68	60 Å²	60	56%	0.562	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-3.9	177.3	0	0	0	0	0	113.5	Q22 E23 D24 N28	Q22-A26 VanDerWaalsContact O-CB 3.24Å; Q22-A26 WeakPolarHBondContact O-CB 3.17Å; Q22-A26 PolarHBondContact O-N 2.86Å; E23-A26 PolarHBondContact O-N 3.02Å; D24-A26 VanDerWaalsContact C-N 3.32Å; D24-A26 PolarHBondContact O-N 2.98Å; A26-N28 VanDerWaalsContact C-N 3.28Å; A26-N28 PolarHBondContact O-N 3.31Å
27	G	85.8	Confident	89.3	Confident	31 Å²	31	62 Å²	62	32%	0.32	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.1	10.8	-178.7	0	0	0	0	0	114.4	E23 D24 Q25 Y29	E23-G27 PolarHBondContact O-N 2.84Å; D24-G27 PolarHBondContact O-N 3.32Å; Q25-G27 PolarHBondContact O-N 3.09Å; G27-Y29 WeakPolarHBondContact O-CD2 3.18Å; G27-Y29 PolarHBondContact O-N 2.87Å
28	N	90.1	Very high	89.4	Confident	95 Å²	95	65.9 Å²	65.9	51%	0.508	33%	0.332	S	S	.	.			trans	-86	61.4	177.1	-69	-27.9	0	0	0	110.1	E23 A26 Q30 E31 A32	E23-N28 PolarHBondContact O-N 2.94Å; A26-N28 VanDerWaalsContact C-N 3.28Å; A26-N28 PolarHBondContact O-N 3.31Å; N28-Q30 VanDerWaalsContact C-N 3.33Å; N28-Q30 PolarHBondContact O-N 3.32Å; N28-E31 PolarHBondContact O-N 2.98Å; N28-A32 PolarHBondContact O-N 3.25Å
29	Y	89.4	Confident	89.2	Confident	59 Å²	59	60.2 Å²	60.2	23%	0.231	31%	0.306	C	S	.	.	H	α-helix	trans	-60.1	-35.7	-166.4	-55.6	-54.8	0	0	0	114.3	G27 E31 I33 L74 Y77 L78	G27-Y29 WeakPolarHBondContact O-CD2 3.18Å; G27-Y29 PolarHBondContact O-N 2.87Å; Y29-E31 VanDerWaalsContact C-N 3.34Å; Y29-E31 PolarHBondContact O-N 3.5Å; Y29-I33 WeakPolarHBondContact O-CD1 3.21Å; Y29-I33 VanDerWaalsContact O-CG1 3.24Å; Y29-I33 WeakPolarHBondContact O-CG1 3.44Å; Y29-I33 PolarHBondContact O-N 2.8Å; Y29-L74 HydrophobicContact CD1-CD2 3.47Å; Y29-L74 VanDerWaalsContact CD1-CD2 3.47Å; Y29-L74 HydrophobicContact CE1-CD2 4Å; Y29-L74 HydrophobicContact CG-CD2 4.18Å; Y29-Y77 AromaticContact CD2-CD1 3.92Å; Y29-Y77 HydrophobicContact CD2-CD1 3.92Å; Y29-Y77 AromaticContact CD2-CE1 3.74Å; Y29-Y77 HydrophobicContact CD2-CE1 3.74Å; Y29-Y77 AromaticContact CE2-CD1 3.93Å; Y29-Y77 HydrophobicContact CE2-CD1 3.93Å; Y29-Y77 AromaticContact CE2-CE1 3.36Å; Y29-Y77 HydrophobicContact CE2-CE1 3.36Å; Y29-L78 HydrophobicContact CD2-CD2 4.36Å
30	Q	88	Confident	89.2	Confident	118 Å²	118	55.4 Å²	55.4	55%	0.551	29%	0.285	S	S	*	.	H	α-helix	trans	-63.2	-39.2	176.1	-73.3	-171.5	-15.6	0	0	112.4	N28 K34 L78	N28-Q30 VanDerWaalsContact C-N 3.33Å; N28-Q30 PolarHBondContact O-N 3.32Å; Q30-K34 PolarHBondContact O-N 3.07Å; Q30-L78 HydrophobicContact CG-CD1 3.73Å
31	E	88.3	Confident	89.1	Confident	82 Å²	82	62.4 Å²	62.4	38%	0.383	32%	0.316	S	S	.	.	H	α-helix	trans	-81.9	-33.6	-178.2	-54.7	-44.2	-119.7	0	0	111.2	E23 N28 Y29 I33 K34 S35	E23-E31 VanDerWaalsContact OE2-O 3.13Å; N28-E31 PolarHBondContact O-N 2.98Å; Y29-E31 VanDerWaalsContact C-N 3.34Å; Y29-E31 PolarHBondContact O-N 3.5Å; E31-I33 VanDerWaalsContact C-N 3.32Å; E31-I33 PolarHBondContact O-N 3.23Å; E31-K34 PolarHBondContact O-N 3.01Å; E31-K34 IonicContact OE1-NZ 2.93Å; E31-K34 PolarHBondContact OE1-NZ 3.14Å; E31-K34 VanDerWaalsContact OE1-NZ 3.16Å; E31-K34 WeakPolarHBondContact OE2-CD 3.38Å; E31-K34 VanDerWaalsContact OE2-CE 3.29Å; E31-K34 WeakPolarHBondContact OE2-CE 3.49Å; E31-K34 IonicContact OE2-NZ 2.75Å; E31-K34 PolarHBondContact OE2-NZ 3.19Å; E31-S35 WeakPolarHBondContact O-CB 3.32Å; E31-S35 PolarHBondContact O-N 3.03Å; E31-S35 PolarHBondContact O-OG 2.59Å
32	A	88.9	Confident	88.7	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-56.5	-44.9	169.4	0	0	0	0	0	111.8	E23 D24 N28 K34 S35 Y36 L74	E23-A32 HydrophobicContact CB-CB 3.91Å; D24-A32 HydrophobicContact CB-CB 4.02Å; N28-A32 PolarHBondContact O-N 3.25Å; A32-K34 PolarHBondContact O-N 3.24Å; A32-S35 PolarHBondContact O-N 3.16Å; A32-Y36 HydrophobicContact CB-CD2 4.46Å; A32-Y36 HydrophobicContact CB-CE2 4.38Å; A32-Y36 WeakPolarHBondContact O-CB 3Å; A32-Y36 WeakPolarHBondContact O-CD2 3.47Å; A32-Y36 PolarHBondContact O-N 3.08Å; A32-L74 HydrophobicContact CB-CD1 4.09Å
33	I	89.4	Confident	88.3	Confident	14 Å²	14	59.4 Å²	59.4	7%	0.072	29%	0.293	C	S	.	.	H	α-helix	trans	-58.7	-49.5	176.6	-73.2	160.5	0	0	0	111.1	Y29 E31 S35 Y36 Q37 V71 L74 Q75 L78	Y29-I33 WeakPolarHBondContact O-CD1 3.21Å; Y29-I33 VanDerWaalsContact O-CG1 3.24Å; Y29-I33 WeakPolarHBondContact O-CG1 3.44Å; Y29-I33 PolarHBondContact O-N 2.8Å; E31-I33 VanDerWaalsContact C-N 3.32Å; E31-I33 PolarHBondContact O-N 3.23Å; I33-S35 VanDerWaalsContact C-N 3.33Å; I33-S35 PolarHBondContact O-N 3.32Å; I33-Y36 PolarHBondContact O-N 3.45Å; I33-Q37 VanDerWaalsContact O-CG 3.31Å; I33-Q37 WeakPolarHBondContact O-CG 3.47Å; I33-Q37 PolarHBondContact O-N 3.4Å; I33-V71 HydrophobicContact CG2-CG1 3.93Å; I33-L74 HydrophobicContact CD1-CB 3.85Å; I33-L74 HydrophobicContact CG1-CB 3.75Å; I33-L74 HydrophobicContact CG1-CD1 4.2Å; I33-Q75 HydrophobicContact CD1-CG 3.72Å; I33-Q75 HydrophobicContact CG1-CG 4.39Å; I33-L78 HydrophobicContact CD1-CD1 3.74Å
34	K	89.8	Confident	88	Confident	117 Å²	117	62.2 Å²	62.2	51%	0.509	31%	0.309	S	S	.	.	H	α-helix	trans	-60.4	-44.3	178.5	-68.6	174.3	-169.9	156.5	0	111.2	Q30 E31 A32 Q37 H38	Q30-K34 PolarHBondContact O-N 3.07Å; E31-K34 PolarHBondContact O-N 3.01Å; E31-K34 IonicContact OE1-NZ 2.93Å; E31-K34 PolarHBondContact OE1-NZ 3.14Å; E31-K34 VanDerWaalsContact OE1-NZ 3.16Å; E31-K34 WeakPolarHBondContact OE2-CD 3.38Å; E31-K34 VanDerWaalsContact OE2-CE 3.29Å; E31-K34 WeakPolarHBondContact OE2-CE 3.49Å; E31-K34 IonicContact OE2-NZ 2.75Å; E31-K34 PolarHBondContact OE2-NZ 3.19Å; A32-K34 PolarHBondContact O-N 3.24Å; K34-Q37 PolarHBondContact O-N 3.14Å; K34-H38 WeakPolarHBondContact O-CB 3.19Å; K34-H38 PolarHBondContact O-N 2.75Å
35	S	88	Confident	87.5	Confident	15 Å²	15	66.7 Å²	66.7	11%	0.105	33%	0.329	C	S	.	.	H	α-helix	trans	-68.2	-39.2	-179.1	-67.9	0	0	0	0	112.8	E23 E31 A32 I33 H38 A39	E23-S35 WeakPolarHBondContact OE2-CB 3.39Å; E23-S35 PolarHBondContact OE2-OG 2.93Å; E31-S35 WeakPolarHBondContact O-CB 3.32Å; E31-S35 PolarHBondContact O-N 3.03Å; E31-S35 PolarHBondContact O-OG 2.59Å; A32-S35 PolarHBondContact O-N 3.16Å; I33-S35 VanDerWaalsContact C-N 3.33Å; I33-S35 PolarHBondContact O-N 3.32Å; S35-H38 PolarHBondContact O-N 2.96Å; S35-A39 WeakPolarHBondContact O-CB 3.29Å; S35-A39 PolarHBondContact O-N 2.85Å
36	Y	91.3	Very high	87	Confident	13 Å²	13	59.3 Å²	59.3	5%	0.051	29%	0.294	C	S	.	.	H	α-helix	trans	-64.7	-45	173.4	-79.3	-57.9	0	0	0	111.9	A20 S21 D24 A32 I33 H38 A39 V40 Y67 R70 V71 L74	A20-Y36 HydrophobicContact CB-CD1 3.52Å; A20-Y36 HydrophobicContact CB-CD2 4.07Å; A20-Y36 HydrophobicContact CB-CE1 3.68Å; A20-Y36 HydrophobicContact CB-CE2 4.23Å; A20-Y36 HydrophobicContact CB-CG 3.71Å; S21-Y36 WeakPolarHBondContact CA-OH 3.37Å; D24-Y36 HydrophobicContact CB-CE2 4.03Å; D24-Y36 WeakPolarHBondContact OD2-CE2 3.19Å; D24-Y36 PolarHBondContact OD2-OH 3.16Å; A32-Y36 HydrophobicContact CB-CD2 4.46Å; A32-Y36 HydrophobicContact CB-CE2 4.38Å; A32-Y36 WeakPolarHBondContact O-CB 3Å; A32-Y36 WeakPolarHBondContact O-CD2 3.47Å; A32-Y36 PolarHBondContact O-N 3.08Å; I33-Y36 PolarHBondContact O-N 3.45Å; Y36-H38 VanDerWaalsContact C-N 3.28Å; Y36-H38 PolarHBondContact O-N 2.87Å; Y36-A39 PolarHBondContact O-N 3.18Å; Y36-V40 WeakPolarHBondContact O-CG2 3.29Å; Y36-V40 PolarHBondContact O-N 3.45Å; Y36-Y67 AromaticContact CD1-CD1 3.6Å; Y36-Y67 HydrophobicContact CD1-CD1 3.6Å; Y36-Y67 HydrophobicContact CD1-CE1 4.27Å; Y36-Y67 AromaticContact CD1-CG 3.94Å; Y36-Y67 HydrophobicContact CD1-CG 3.94Å; Y36-Y67 AromaticContact CE1-CD1 3.64Å; Y36-Y67 HydrophobicContact CE1-CD1 3.64Å; Y36-Y67 HydrophobicContact CE1-CE1 4.01Å; Y36-Y67 HydrophobicContact CE1-CG 4.44Å; Y36-R70 HydrophobicContact CE2-CG 3.99Å; Y36-V71 HydrophobicContact CD2-CG2 4.43Å; Y36-V71 HydrophobicContact CG-CG2 4.34Å; Y36-L74 HydrophobicContact CD2-CD1 4.44Å; Y36-L74 HydrophobicContact CE2-CD1 4.25Å
37	Q	89.4	Confident	86.6	Confident	75 Å²	75	57.1 Å²	57.1	35%	0.35	27%	0.274	S	S	.	.	H	α-helix	trans	-61.2	-37.6	175.3	-71.3	177.3	-7.6	0	0	112	I33 K34 K41 V71	I33-Q37 VanDerWaalsContact O-CG 3.31Å; I33-Q37 WeakPolarHBondContact O-CG 3.47Å; I33-Q37 PolarHBondContact O-N 3.4Å; K34-Q37 PolarHBondContact O-N 3.14Å; Q37-K41 WeakPolarHBondContact O-CG 3.45Å; Q37-K41 PolarHBondContact O-N 3.47Å; Q37-V71 HydrophobicContact CG-CG1 4.31Å; Q37-V71 HydrophobicContact CG-CG2 4.21Å
38	H	88.7	Confident	86.1	Confident	87 Å²	87	64.2 Å²	64.2	40%	0.403	30%	0.296	S	S	.	.	H	α-helix	trans	-67.6	-42.7	175.5	-159	103.4	0	0	0	111.7	V16 K34 S35 Y36 V40 K41 Y42	V16-H38 HydrophobicContact CG1-CB 4.28Å; K34-H38 WeakPolarHBondContact O-CB 3.19Å; K34-H38 PolarHBondContact O-N 2.75Å; S35-H38 PolarHBondContact O-N 2.96Å; Y36-H38 VanDerWaalsContact C-N 3.28Å; Y36-H38 PolarHBondContact O-N 2.87Å; H38-V40 PolarHBondContact O-N 3.25Å; H38-K41 PolarHBondContact O-N 2.96Å; H38-Y42 AromaticContact CD2-CD2 3.52Å; H38-Y42 AromaticContact CD2-CE2 3.29Å; H38-Y42 WeakPolarHBondContact CD2-CE2 3.16Å; H38-Y42 AromaticContact CE1-CE2 3.92Å; H38-Y42 AromaticContact NE2-CD2 3.75Å; H38-Y42 AromaticContact NE2-CE2 2.99Å; H38-Y42 WeakPolarHBondContact NE2-CE2 3.4Å; H38-Y42 AromaticContact NE2-CZ 3.61Å; H38-Y42 VanDerWaalsContact O-CD2 3.28Å; H38-Y42 WeakPolarHBondContact O-CD2 3Å; H38-Y42 PolarHBondContact O-N 2.85Å; H38-Y42 VanDerWaalsContact O-N 3.14Å
39	A	86.4	Confident	85.4	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-59.1	-44.9	175	0	0	0	0	0	111.8	V16 A17 S35 Y36 K41 Y42 F43	V16-A39 HydrophobicContact CB-CB 4.47Å; V16-A39 HydrophobicContact CG1-CB 4Å; A17-A39 HydrophobicContact CB-CB 4.07Å; S35-A39 WeakPolarHBondContact O-CB 3.29Å; S35-A39 PolarHBondContact O-N 2.85Å; Y36-A39 PolarHBondContact O-N 3.18Å; A39-K41 PolarHBondContact O-N 3.41Å; A39-Y42 PolarHBondContact O-N 2.69Å; A39-Y42 VanDerWaalsContact O-N 3.16Å; A39-F43 HydrophobicContact CB-CD2 4.47Å; A39-F43 HydrophobicContact CB-CE2 4.43Å; A39-F43 WeakPolarHBondContact O-CD2 3.39Å; A39-F43 PolarHBondContact O-N 3.27Å
40	V	89.6	Confident	84.5	Confident	10 Å²	10	64.6 Å²	64.6	6%	0.061	30%	0.304	C	S	.	.	H	α-helix	trans	-59.2	-45.3	177.5	171.5	0	0	0	0	111.5	Y36 H38 Y42 F43 L44 C64 Y67 L68	Y36-V40 WeakPolarHBondContact O-CG2 3.29Å; Y36-V40 PolarHBondContact O-N 3.45Å; H38-V40 PolarHBondContact O-N 3.25Å; V40-Y42 VanDerWaalsContact C-N 3.29Å; V40-Y42 PolarHBondContact O-N 2.84Å; V40-F43 PolarHBondContact O-N 2.85Å; V40-L44 HydrophobicContact CG1-CD1 3.89Å; V40-L44 HydrophobicContact CG1-CG 4.34Å; V40-L44 WeakPolarHBondContact O-CB 3.29Å; V40-L44 WeakPolarHBondContact O-CG 3.49Å; V40-L44 PolarHBondContact O-N 2.89Å; V40-C64 HydrophobicContact CG1-CB 4.19Å; V40-C64 HydrophobicContact CG2-CB 4.43Å; V40-Y67 HydrophobicContact CG2-CD2 4.21Å; V40-Y67 HydrophobicContact CG2-CG 4.48Å; V40-L68 HydrophobicContact CG1-CD1 4.39Å; V40-L68 HydrophobicContact CG1-CD2 4.43Å; V40-L68 HydrophobicContact CG1-CG 4.39Å; V40-L68 HydrophobicContact CG2-CD2 4.4Å; V40-L68 HydrophobicContact CG2-CG 4.21Å
41	K	86.9	Confident	83.7	Confident	147 Å²	147	63.2 Å²	63.2	64%	0.639	31%	0.305	S	S	*	.	H	α-helix	trans	-58.2	-41.7	176.1	-73	176.1	-175.7	175.4	0	111.9	Q37 H38 A39 H45	Q37-K41 WeakPolarHBondContact O-CG 3.45Å; Q37-K41 PolarHBondContact O-N 3.47Å; H38-K41 PolarHBondContact O-N 2.96Å; A39-K41 PolarHBondContact O-N 3.41Å; K41-H45 WeakPolarHBondContact O-CB 3.34Å; K41-H45 PolarHBondContact O-N 3.42Å
42	Y	82.8	Confident	82.6	Confident	106 Å²	106	64.1 Å²	64.1	42%	0.416	31%	0.309	S	S	.	.	H	α-helix	trans	-67.6	-43.6	178.1	-88.4	-111.7	0	0	0	112.4	H38 A39 V40 H45 I46	H38-Y42 AromaticContact CD2-CD2 3.52Å; H38-Y42 AromaticContact CD2-CE2 3.29Å; H38-Y42 WeakPolarHBondContact CD2-CE2 3.16Å; H38-Y42 AromaticContact CE1-CE2 3.92Å; H38-Y42 AromaticContact NE2-CD2 3.75Å; H38-Y42 AromaticContact NE2-CE2 2.99Å; H38-Y42 WeakPolarHBondContact NE2-CE2 3.4Å; H38-Y42 AromaticContact NE2-CZ 3.61Å; H38-Y42 VanDerWaalsContact O-CD2 3.28Å; H38-Y42 WeakPolarHBondContact O-CD2 3Å; H38-Y42 PolarHBondContact O-N 2.85Å; H38-Y42 VanDerWaalsContact O-N 3.14Å; A39-Y42 PolarHBondContact O-N 2.69Å; A39-Y42 VanDerWaalsContact O-N 3.16Å; V40-Y42 VanDerWaalsContact C-N 3.29Å; V40-Y42 PolarHBondContact O-N 2.84Å; Y42-H45 WeakPolarHBondContact O-CB 3.32Å; Y42-H45 PolarHBondContact O-N 3.05Å; Y42-I46 WeakPolarHBondContact O-CG1 3.46Å; Y42-I46 PolarHBondContact O-N 3.21Å
43	F	83.5	Confident	81.9	Confident	6 Å²	6	66.2 Å²	66.2	3%	0.026	33%	0.331	C	S	.	.	H	α-helix	trans	-64.8	-40.8	177.7	-81.4	-61.5	0	0	0	112.6	L10 A13 I14 A17 A39 V40 H45 I46 V47 I60 C64 Y67	L10-F43 HydrophobicContact CD1-CD1 4.43Å; L10-F43 HydrophobicContact CD1-CE1 3.94Å; A13-F43 HydrophobicContact CB-CD1 3.99Å; A13-F43 HydrophobicContact CB-CD2 4.36Å; A13-F43 HydrophobicContact CB-CE1 3.72Å; A13-F43 HydrophobicContact CB-CE2 4.1Å; A13-F43 HydrophobicContact CB-CG 4.3Å; A13-F43 HydrophobicContact CB-CZ 3.77Å; I14-F43 HydrophobicContact CG1-CE1 4.42Å; I14-F43 HydrophobicContact CG1-CZ 4.11Å; A17-F43 HydrophobicContact CB-CE2 4.14Å; A39-F43 HydrophobicContact CB-CD2 4.47Å; A39-F43 HydrophobicContact CB-CE2 4.43Å; A39-F43 WeakPolarHBondContact O-CD2 3.39Å; A39-F43 PolarHBondContact O-N 3.27Å; V40-F43 PolarHBondContact O-N 2.85Å; F43-H45 VanDerWaalsContact C-N 3.34Å; F43-I46 HydrophobicContact CD1-CD1 4.43Å; F43-I46 PolarHBondContact O-N 3.25Å; F43-V47 WeakPolarHBondContact O-CG2 3.42Å; F43-V47 PolarHBondContact O-N 3.2Å; F43-V47 VanDerWaalsContact O-N 3.1Å; F43-I60 HydrophobicContact CB-CG2 3.69Å; F43-I60 HydrophobicContact CD1-CG2 3.89Å; F43-I60 HydrophobicContact CG-CG2 4.13Å; F43-C64 WeakPolarHBondContact CB-SG 3.46Å; F43-Y67 HydrophobicContact CD2-CE2 4.2Å; F43-Y67 AromaticContact CE2-CE2 3.89Å; F43-Y67 HydrophobicContact CE2-CE2 3.89Å
44	L	82.6	Confident	81	Confident	88 Å²	88	75 Å²	75	46%	0.461	37%	0.369	S	S	.	.	H	α-helix	trans	-66.5	-36.3	174.5	-68.8	175.9	0	0	0	112.2	V40 I46 V47 K48	V40-L44 HydrophobicContact CG1-CD1 3.89Å; V40-L44 HydrophobicContact CG1-CG 4.34Å; V40-L44 WeakPolarHBondContact O-CB 3.29Å; V40-L44 WeakPolarHBondContact O-CG 3.49Å; V40-L44 PolarHBondContact O-N 2.89Å; L44-I46 VanDerWaalsContact C-N 3.34Å; L44-V47 PolarHBondContact O-N 2.79Å; L44-K48 PolarHBondContact O-N 3.48Å; L44-K48 VanDerWaalsContact O-N 3.14Å
45	H	81.6	Confident	80.3	Confident	110 Å²	110	76.8 Å²	76.8	51%	0.509	38%	0.379	S	S	.	.	H	α-helix	trans	-63.1	-39.3	172.9	-174	-85.1	0	0	0	111.8	K41 Y42 F43 K48 C49	K41-H45 WeakPolarHBondContact O-CB 3.34Å; K41-H45 PolarHBondContact O-N 3.42Å; Y42-H45 WeakPolarHBondContact O-CB 3.32Å; Y42-H45 PolarHBondContact O-N 3.05Å; F43-H45 VanDerWaalsContact C-N 3.34Å; H45-K48 PolarHBondContact O-N 2.84Å; H45-C49 PolarHBondContact CE1-SG 3.43Å; H45-C49 WeakPolarHBondContact O-CB 3.23Å; H45-C49 PolarHBondContact O-N 2.74Å
46	I	78.6	Confident	79.7	Confident	4 Å²	4	77.1 Å²	77.1	2%	0.021	38%	0.384	C	S	.	.	H	α-helix	trans	-63.5	-44	175.1	-68.2	162.5	0	0	0	111.2	N9 L10 A13 Y42 F43 L44 K48 C49 Q50 I60	N9-I46 HydrophobicContact CB-CG1 4.32Å; L10-I46 HydrophobicContact CB-CD1 4.42Å; L10-I46 HydrophobicContact CD1-CD1 4.13Å; A13-I46 HydrophobicContact CB-CD1 3.65Å; Y42-I46 WeakPolarHBondContact O-CG1 3.46Å; Y42-I46 PolarHBondContact O-N 3.21Å; F43-I46 HydrophobicContact CD1-CD1 4.43Å; F43-I46 PolarHBondContact O-N 3.25Å; L44-I46 VanDerWaalsContact C-N 3.34Å; I46-K48 PolarHBondContact O-N 3.01Å; I46-C49 PolarHBondContact O-N 3.19Å; I46-Q50 CarbonylContact O-C 3.26Å; I46-Q50 VanDerWaalsContact O-C 3.26Å; I46-Q50 WeakPolarHBondContact O-CA 3.44Å; I46-Q50 PolarHBondContact O-N 2.9Å; I46-I60 HydrophobicContact CG2-CD1 4.41Å
47	V	79.1	Confident	79.1	Confident	22 Å²	22	77.6 Å²	77.6	13%	0.133	39%	0.388	C	S	.	.	H	α-helix	trans	-59.6	-32.8	176.2	173.2	0	0	0	0	111.6	F43 L44 N57 I60	F43-V47 WeakPolarHBondContact O-CG2 3.42Å; F43-V47 PolarHBondContact O-N 3.2Å; F43-V47 VanDerWaalsContact O-N 3.1Å; L44-V47 PolarHBondContact O-N 2.79Å; V47-N57 HydrophobicContact CG1-CB 4.32Å; V47-I60 HydrophobicContact CG2-CB 3.94Å; V47-I60 HydrophobicContact CG2-CD1 4.15Å; V47-I60 HydrophobicContact CG2-CG2 3.6Å
48	K	76.9	Confident	78.7	Confident	180 Å²	180	78.3 Å²	78.3	78%	0.783	39%	0.391	S	S	*	.	H	α-helix	trans	-79.4	-39.9	179.8	-167.3	177.9	-179.2	-179	0	113.4	L44 H45 I46	L44-K48 PolarHBondContact O-N 3.48Å; L44-K48 VanDerWaalsContact O-N 3.14Å; H45-K48 PolarHBondContact O-N 2.84Å; I46-K48 PolarHBondContact O-N 3.01Å
49	C	73.8	Confident	78.3	Confident	72 Å²	72	80.6 Å²	80.6	49%	0.486	40%	0.4	S	S	.	.	H	α-helix	trans	-102.7	-24.1	-170.4	-64.2	0	0	0	0	114.4	H45 I46	H45-C49 PolarHBondContact CE1-SG 3.43Å; H45-C49 WeakPolarHBondContact O-CB 3.23Å; H45-C49 PolarHBondContact O-N 2.74Å; I46-C49 PolarHBondContact O-N 3.19Å
50	Q	70.9	Confident	78.1	Confident	90 Å²	90	81.3 Å²	81.3	42%	0.421	40%	0.403	S	S	.	.	S	Bend	trans	-143.1	69.7	-176.6	-68.9	-176.4	-30.2	0	0	110.7	I46 Q52	I46-Q50 CarbonylContact O-C 3.26Å; I46-Q50 VanDerWaalsContact O-C 3.26Å; I46-Q50 WeakPolarHBondContact O-CA 3.44Å; I46-Q50 PolarHBondContact O-N 2.9Å; Q50-Q52 PolarHBondContact O-N 2.92Å; Q50-Q52 PolarHBondContact O-NE2 3.46Å; Q50-Q52 VanDerWaalsContact O-NE2 3.08Å
51	P	70.7	Confident	77.8	Confident	89 Å²	89	87.1 Å²	87.1	58%	0.578	42%	0.424	S	S	*	.			trans	-61.3	127.2	-173.8	23.3	-32.3	0	0	0	112.1	G53	P51-G53 VanDerWaalsContact C-N 3.3Å; P51-G53 PolarHBondContact O-N 2.76Å
52	Q	65.4	Low	77.8	Confident	101 Å²	101	84.3 Å²	84.3	47%	0.472	42%	0.416	S	S	.	.			trans	-92.8	30.6	-174.8	-61.3	-65	-53.6	0	0	112.8	Q50 G56 N57 I60	Q50-Q52 PolarHBondContact O-N 2.92Å; Q50-Q52 PolarHBondContact O-NE2 3.46Å; Q50-Q52 VanDerWaalsContact O-NE2 3.08Å; Q52-G56 WeakPolarHBondContact O-CA 3.39Å; Q52-N57 PolarHBondContact N-OD1 3.16Å; Q52-I60 HydrophobicContact CG-CD1 4.12Å
53	G	74.8	Confident	77.9	Confident	44 Å²	44	84.4 Å²	84.4	45%	0.454	42%	0.419	S	S	.	.	H	α-helix	trans	72.4	172.4	-169.2	0	0	0	0	0	113.5	P51 E55 G56 N57	P51-G53 VanDerWaalsContact C-N 3.3Å; P51-G53 PolarHBondContact O-N 2.76Å; G53-E55 PolarHBondContact O-N 2.88Å; G53-G56 PolarHBondContact O-N 3.12Å; G53-N57 WeakPolarHBondContact O-CB 3.41Å; G53-N57 VanDerWaalsContact O-CG 3.29Å; G53-N57 PolarHBondContact O-N 2.93Å
54	K	70.9	Confident	78.1	Confident	200 Å²	200	84.3 Å²	84.3	87%	0.87	42%	0.419	S	S	*	.	H	α-helix	trans	-60.9	-46	-175	-72.3	-174.3	178.7	-179.6	0	112.6	Q58	K54-Q58 WeakPolarHBondContact O-CB 3.39Å; K54-Q58 PolarHBondContact O-N 3.26Å; K54-Q58 VanDerWaalsContact O-N 3.14Å
55	E	74.5	Confident	78.4	Confident	154 Å²	154	86.4 Å²	86.4	72%	0.72	42%	0.424	S	S	*	.	H	α-helix	trans	-71	-38.8	178.9	-72.2	-173.6	162.8	0	0	113.2	G53 Q58 K59	G53-E55 PolarHBondContact O-N 2.88Å; E55-Q58 PolarHBondContact O-N 3.18Å; E55-K59 WeakPolarHBondContact O-CG 3.49Å; E55-K59 PolarHBondContact O-N 2.78Å
56	G	75.8	Confident	78.8	Confident	21 Å²	21	86.7 Å²	86.7	22%	0.216	43%	0.429	C	S	.	.	H	α-helix	trans	-66.7	-42.1	178.4	0	0	0	0	0	112.2	Q52 G53 Q58 K59 I60	Q52-G56 WeakPolarHBondContact O-CA 3.39Å; G53-G56 PolarHBondContact O-N 3.12Å; G56-Q58 VanDerWaalsContact C-N 3.34Å; G56-Q58 PolarHBondContact O-N 3.45Å; G56-K59 PolarHBondContact O-N 3.34Å; G56-I60 WeakPolarHBondContact O-CG1 2.98Å; G56-I60 PolarHBondContact O-N 2.92Å; G56-I60 VanDerWaalsContact O-N 3.13Å
57	N	78.2	Confident	79.3	Confident	24 Å²	24	88.5 Å²	88.5	13%	0.128	44%	0.436	C	S	.	.	H	α-helix	trans	-67	-34.9	175.9	-72.5	-10.6	0	0	0	112.3	V47 Q52 G53 I60 R61	V47-N57 HydrophobicContact CG1-CB 4.32Å; Q52-N57 PolarHBondContact N-OD1 3.16Å; G53-N57 WeakPolarHBondContact O-CB 3.41Å; G53-N57 VanDerWaalsContact O-CG 3.29Å; G53-N57 PolarHBondContact O-N 2.93Å; N57-I60 PolarHBondContact O-N 3.45Å; N57-R61 WeakPolarHBondContact O-CG 3.38Å; N57-R61 PolarHBondContact O-N 3.02Å
58	Q	80.8	Confident	79.7	Confident	89 Å²	89	91.1 Å²	91.1	42%	0.416	45%	0.449	S	S	.	.	H	α-helix	trans	-65.1	-46.7	175	-170.3	58.4	39.6	0	0	111.2	K54 E55 G56 I60 R61 D62	K54-Q58 WeakPolarHBondContact O-CB 3.39Å; K54-Q58 PolarHBondContact O-N 3.26Å; K54-Q58 VanDerWaalsContact O-N 3.14Å; E55-Q58 PolarHBondContact O-N 3.18Å; G56-Q58 VanDerWaalsContact C-N 3.34Å; G56-Q58 PolarHBondContact O-N 3.45Å; Q58-I60 PolarHBondContact O-N 2.93Å; Q58-R61 WeakPolarHBondContact O-CB 3.29Å; Q58-R61 PolarHBondContact O-N 3.16Å; Q58-D62 PolarHBondContact NE2-OD1 2.96Å; Q58-D62 VanDerWaalsContact O-CG 3.22Å; Q58-D62 PolarHBondContact O-N 3.16Å
59	K	81.7	Confident	80.3	Confident	136 Å²	136	85.9 Å²	85.9	59%	0.591	43%	0.429	S	S	*	.	H	α-helix	trans	-58	-35.3	175.4	-72.7	174.5	-179.2	174.2	0	113.1	E55 G56 K63	E55-K59 WeakPolarHBondContact O-CG 3.49Å; E55-K59 PolarHBondContact O-N 2.78Å; G56-K59 PolarHBondContact O-N 3.34Å; K59-K63 WeakPolarHBondContact O-CG 3.26Å; K59-K63 PolarHBondContact O-N 2.81Å
60	I	82	Confident	81.1	Confident	14 Å²	14	86.7 Å²	86.7	7%	0.072	42%	0.422	C	S	.	.	H	α-helix	trans	-69.9	-41.6	175.9	-66.6	167.6	0	0	0	110.9	F43 I46 V47 Q52 G56 N57 Q58 K63 C64	F43-I60 HydrophobicContact CB-CG2 3.69Å; F43-I60 HydrophobicContact CD1-CG2 3.89Å; F43-I60 HydrophobicContact CG-CG2 4.13Å; I46-I60 HydrophobicContact CG2-CD1 4.41Å; V47-I60 HydrophobicContact CG2-CB 3.94Å; V47-I60 HydrophobicContact CG2-CD1 4.15Å; V47-I60 HydrophobicContact CG2-CG2 3.6Å; Q52-I60 HydrophobicContact CG-CD1 4.12Å; G56-I60 WeakPolarHBondContact O-CG1 2.98Å; G56-I60 PolarHBondContact O-N 2.92Å; G56-I60 VanDerWaalsContact O-N 3.13Å; N57-I60 PolarHBondContact O-N 3.45Å; Q58-I60 PolarHBondContact O-N 2.93Å; I60-K63 PolarHBondContact O-N 3.03Å; I60-C64 PolarHBondContact O-N 3.32Å; I60-C64 PolarHBondContact O-SG 3.49Å
61	R	83.5	Confident	82	Confident	133 Å²	133	82.7 Å²	82.7	50%	0.502	40%	0.404	S	S	.	.	H	α-helix	trans	-64.7	-41.1	176.6	-72.7	176.1	-178.3	173.8	-1.2	112.1	N57 Q58 K63 C64 K65	N57-R61 WeakPolarHBondContact O-CG 3.38Å; N57-R61 PolarHBondContact O-N 3.02Å; Q58-R61 WeakPolarHBondContact O-CB 3.29Å; Q58-R61 PolarHBondContact O-N 3.16Å; R61-K63 VanDerWaalsContact C-N 3.33Å; R61-K63 PolarHBondContact O-N 3.14Å; R61-C64 WeakPolarHBondContact O-CB 3.31Å; R61-C64 PolarHBondContact O-N 2.85Å; R61-K65 PolarHBondContact O-N 3.46Å
62	D	86.1	Confident	82.8	Confident	87 Å²	87	84.6 Å²	84.6	47%	0.465	41%	0.405	S	S	.	.	H	α-helix	trans	-63.5	-39.8	177.5	-60.3	-23.9	0	0	0	111.2	Q58 K65 L66	Q58-D62 PolarHBondContact NE2-OD1 2.96Å; Q58-D62 VanDerWaalsContact O-CG 3.22Å; Q58-D62 PolarHBondContact O-N 3.16Å; D62-K65 PolarHBondContact O-N 3.42Å; D62-L66 PolarHBondContact O-N 3.35Å; D62-L66 VanDerWaalsContact O-N 3.13Å
63	K	85.3	Confident	84	Confident	108 Å²	108	84.7 Å²	84.7	47%	0.47	41%	0.405	S	S	.	.	H	α-helix	trans	-65.8	-39.5	172.3	-77.9	-174.1	177.3	-174.5	0	113.2	K59 I60 R61 K65 L66 Y67	K59-K63 WeakPolarHBondContact O-CG 3.26Å; K59-K63 PolarHBondContact O-N 2.81Å; I60-K63 PolarHBondContact O-N 3.03Å; R61-K63 VanDerWaalsContact C-N 3.33Å; R61-K63 PolarHBondContact O-N 3.14Å; K63-K65 VanDerWaalsContact C-N 3.28Å; K63-K65 PolarHBondContact O-N 3.36Å; K63-L66 PolarHBondContact O-N 3.17Å; K63-Y67 HydrophobicContact CB-CE2 4.4Å; K63-Y67 VanDerWaalsContact O-CD2 3.26Å; K63-Y67 WeakPolarHBondContact O-CD2 3.37Å; K63-Y67 PolarHBondContact O-N 3.16Å; K63-Y67 VanDerWaalsContact O-N 3.13Å
64	C	87.4	Confident	84.5	Confident	5 Å²	5	82.8 Å²	82.8	3%	0.034	39%	0.385	C	S	.	.	H	α-helix	trans	-62.3	-39.5	176.2	-68.1	0	0	0	0	111.4	V40 F43 I60 R61 Y67 L68	V40-C64 HydrophobicContact CG1-CB 4.19Å; V40-C64 HydrophobicContact CG2-CB 4.43Å; F43-C64 WeakPolarHBondContact CB-SG 3.46Å; I60-C64 PolarHBondContact O-N 3.32Å; I60-C64 PolarHBondContact O-SG 3.49Å; R61-C64 WeakPolarHBondContact O-CB 3.31Å; R61-C64 PolarHBondContact O-N 2.85Å; C64-Y67 PolarHBondContact O-N 3.07Å; C64-L68 WeakPolarHBondContact O-CG 3.43Å; C64-L68 PolarHBondContact O-N 3.29Å
65	K	88.2	Confident	85.3	Confident	132 Å²	132	77 Å²	77	57%	0.574	36%	0.361	S	S	*	.	H	α-helix	trans	-60.9	-48.6	175.5	-170	179.6	177.4	-174.8	0	111.2	R61 D62 K63 Y67 L68 D69	R61-K65 PolarHBondContact O-N 3.46Å; D62-K65 PolarHBondContact O-N 3.42Å; K63-K65 VanDerWaalsContact C-N 3.28Å; K63-K65 PolarHBondContact O-N 3.36Å; K65-Y67 VanDerWaalsContact C-N 3.27Å; K65-Y67 PolarHBondContact O-N 2.85Å; K65-L68 PolarHBondContact O-N 2.93Å; K65-D69 VanDerWaalsContact O-CG 3.25Å; K65-D69 PolarHBondContact O-N 3.06Å
66	L	89.7	Confident	85.7	Confident	115 Å²	115	74.6 Å²	74.6	60%	0.602	35%	0.35	S	S	*	.	H	α-helix	trans	-56.7	-38.6	177.2	-173.5	68.1	0	0	0	113.1	D62 K63 R70	D62-L66 PolarHBondContact O-N 3.35Å; D62-L66 VanDerWaalsContact O-N 3.13Å; K63-L66 PolarHBondContact O-N 3.17Å; L66-R70 PolarHBondContact O-N 3.24Å; L66-R70 VanDerWaalsContact O-N 3.14Å
67	Y	89.6	Confident	86	Confident	42 Å²	42	78.8 Å²	78.8	17%	0.165	36%	0.36	C	S	.	.	H	α-helix	trans	-72.1	-34.2	177	-62.4	-35.7	0	0	0	113.3	A17 Y36 V40 F43 K63 C64 K65 V71	A17-Y67 HydrophobicContact CB-CE2 4.1Å; Y36-Y67 AromaticContact CD1-CD1 3.6Å; Y36-Y67 HydrophobicContact CD1-CD1 3.6Å; Y36-Y67 HydrophobicContact CD1-CE1 4.27Å; Y36-Y67 AromaticContact CD1-CG 3.94Å; Y36-Y67 HydrophobicContact CD1-CG 3.94Å; Y36-Y67 AromaticContact CE1-CD1 3.64Å; Y36-Y67 HydrophobicContact CE1-CD1 3.64Å; Y36-Y67 HydrophobicContact CE1-CE1 4.01Å; Y36-Y67 HydrophobicContact CE1-CG 4.44Å; V40-Y67 HydrophobicContact CG2-CD2 4.21Å; V40-Y67 HydrophobicContact CG2-CG 4.48Å; F43-Y67 HydrophobicContact CD2-CE2 4.2Å; F43-Y67 AromaticContact CE2-CE2 3.89Å; F43-Y67 HydrophobicContact CE2-CE2 3.89Å; K63-Y67 HydrophobicContact CB-CE2 4.4Å; K63-Y67 VanDerWaalsContact O-CD2 3.26Å; K63-Y67 WeakPolarHBondContact O-CD2 3.37Å; K63-Y67 PolarHBondContact O-N 3.16Å; K63-Y67 VanDerWaalsContact O-N 3.13Å; C64-Y67 PolarHBondContact O-N 3.07Å; K65-Y67 VanDerWaalsContact C-N 3.27Å; K65-Y67 PolarHBondContact O-N 2.85Å; Y67-V71 VanDerWaalsContact O-CG2 3.29Å; Y67-V71 WeakPolarHBondContact O-CG2 3.34Å; Y67-V71 PolarHBondContact O-N 3.36Å; Y67-V71 VanDerWaalsContact O-N 3.09Å
68	L	87.8	Confident	86.1	Confident	78 Å²	78	79.4 Å²	79.4	41%	0.408	36%	0.363	S	S	.	.	H	α-helix	trans	-69.9	-43.2	175.3	-71.5	170.8	0	0	0	111.2	V40 C64 K65 R70 V71 E72	V40-L68 HydrophobicContact CG1-CD1 4.39Å; V40-L68 HydrophobicContact CG1-CD2 4.43Å; V40-L68 HydrophobicContact CG1-CG 4.39Å; V40-L68 HydrophobicContact CG2-CD2 4.4Å; V40-L68 HydrophobicContact CG2-CG 4.21Å; C64-L68 WeakPolarHBondContact O-CG 3.43Å; C64-L68 PolarHBondContact O-N 3.29Å; K65-L68 PolarHBondContact O-N 2.93Å; L68-R70 VanDerWaalsContact C-N 3.27Å; L68-R70 PolarHBondContact O-N 2.91Å; L68-V71 WeakPolarHBondContact O-CB 3.3Å; L68-V71 PolarHBondContact O-N 3.31Å; L68-E72 PolarHBondContact O-N 3.43Å; L68-E72 VanDerWaalsContact O-N 3.07Å
69	D	90	Very high	85.7	Confident	70 Å²	70	81.4 Å²	81.4	37%	0.374	37%	0.372	S	S	.	.	H	α-helix	trans	-58.3	-42.3	175.5	-62.1	-13.8	0	0	0	110.3	K65 V71 E72 E73	K65-D69 VanDerWaalsContact O-CG 3.25Å; K65-D69 PolarHBondContact O-N 3.06Å; D69-V71 PolarHBondContact O-N 2.84Å; D69-E72 PolarHBondContact O-N 2.97Å; D69-E73 PolarHBondContact O-N 2.65Å; D69-E73 VanDerWaalsContact O-N 3.15Å
70	R	90.4	Very high	85.2	Confident	89 Å²	89	81.4 Å²	81.4	34%	0.336	37%	0.372	S	S	.	.	H	α-helix	trans	-66.8	-32.8	175.8	-173.2	56.9	176	170.4	5.7	113.6	D24 Y36 L66 L68 E73 L74	D24-R70 IonicContact OD1-CZ 2.81Å; D24-R70 IonicContact OD1-NE 2.7Å; D24-R70 IonicContact OD1-NH2 3.23Å; D24-R70 PolarHBondContact OD1-NH2 3.27Å; D24-R70 IonicContact OD2-CZ 3.95Å; D24-R70 IonicContact OD2-NE 2.84Å; D24-R70 PolarHBondContact OD2-NE 3.36Å; D24-R70 IonicContact OD2-NH2 2.7Å; D24-R70 PolarHBondContact OD2-NH2 3.28Å; Y36-R70 HydrophobicContact CE2-CG 3.99Å; L66-R70 PolarHBondContact O-N 3.24Å; L66-R70 VanDerWaalsContact O-N 3.14Å; L68-R70 VanDerWaalsContact C-N 3.27Å; L68-R70 PolarHBondContact O-N 2.91Å; R70-E73 WeakPolarHBondContact CD-OE2 3.49Å; R70-E73 IonicContact CZ-OE2 2.82Å; R70-E73 IonicContact NE-OE2 3.65Å; R70-E73 IonicContact NH1-OE2 2.86Å; R70-E73 PolarHBondContact NH1-OE2 3.21Å; R70-L74 HydrophobicContact CG-CD1 4.43Å; R70-L74 VanDerWaalsContact O-CG 3.32Å; R70-L74 WeakPolarHBondContact O-CG 3.26Å; R70-L74 PolarHBondContact O-N 3.11Å; R70-L74 VanDerWaalsContact O-N 3.11Å
71	V	89.4	Confident	84.6	Confident	5 Å²	5	86.9 Å²	86.9	3%	0.03	40%	0.396	C	S	.	.	H	α-helix	trans	-65.5	-43.1	175.3	162.8	0	0	0	0	110.7	I33 Y36 Q37 Y67 L68 D69 L74 Q75	I33-V71 HydrophobicContact CG2-CG1 3.93Å; Y36-V71 HydrophobicContact CD2-CG2 4.43Å; Y36-V71 HydrophobicContact CG-CG2 4.34Å; Q37-V71 HydrophobicContact CG-CG1 4.31Å; Q37-V71 HydrophobicContact CG-CG2 4.21Å; Y67-V71 VanDerWaalsContact O-CG2 3.29Å; Y67-V71 WeakPolarHBondContact O-CG2 3.34Å; Y67-V71 PolarHBondContact O-N 3.36Å; Y67-V71 VanDerWaalsContact O-N 3.09Å; L68-V71 WeakPolarHBondContact O-CB 3.3Å; L68-V71 PolarHBondContact O-N 3.31Å; D69-V71 PolarHBondContact O-N 2.84Å; V71-L74 PolarHBondContact O-N 2.89Å; V71-Q75 HydrophobicContact CG1-CG 4.41Å; V71-Q75 WeakPolarHBondContact O-CB 3.45Å; V71-Q75 VanDerWaalsContact O-CG 3.3Å; V71-Q75 WeakPolarHBondContact O-CG 3.36Å; V71-Q75 PolarHBondContact O-N 2.65Å
72	E	87.9	Confident	83.3	Confident	129 Å²	129	87.6 Å²	87.6	60%	0.603	41%	0.405	S	S	*	.	H	α-helix	trans	-61.7	-44.8	176.8	-70	-179.4	179	0	0	111.2	L68 D69 L74 Q75 E76	L68-E72 PolarHBondContact O-N 3.43Å; L68-E72 VanDerWaalsContact O-N 3.07Å; D69-E72 PolarHBondContact O-N 2.97Å; E72-L74 VanDerWaalsContact C-N 3.35Å; E72-L74 PolarHBondContact O-N 3.42Å; E72-Q75 PolarHBondContact O-N 3.29Å; E72-E76 PolarHBondContact O-N 3.39Å
73	E	89.2	Confident	81.6	Confident	103 Å²	103	89.5 Å²	89.5	48%	0.481	42%	0.419	S	S	.	.	H	α-helix	trans	-58.1	-43.7	175.5	-71.4	177.1	-179.4	0	0	112.8	D69 R70 Y77	D69-E73 PolarHBondContact O-N 2.65Å; D69-E73 VanDerWaalsContact O-N 3.15Å; R70-E73 WeakPolarHBondContact CD-OE2 3.49Å; R70-E73 IonicContact CZ-OE2 2.82Å; R70-E73 IonicContact NE-OE2 3.65Å; R70-E73 IonicContact NH1-OE2 2.86Å; R70-E73 PolarHBondContact NH1-OE2 3.21Å; E73-Y77 WeakPolarHBondContact O-CB 3.38Å; E73-Y77 PolarHBondContact O-N 3.02Å
74	L	87.1	Confident	79.5	Confident	4 Å²	4	87.6 Å²	87.6	2%	0.021	43%	0.43	C	S	.	.	H	α-helix	trans	-71.1	-34.4	-179.4	-71	179.2	0	0	0	112.4	Y29 A32 I33 Y36 R70 V71 E72 Y77 L78	Y29-L74 HydrophobicContact CD1-CD2 3.47Å; Y29-L74 VanDerWaalsContact CD1-CD2 3.47Å; Y29-L74 HydrophobicContact CE1-CD2 4Å; Y29-L74 HydrophobicContact CG-CD2 4.18Å; A32-L74 HydrophobicContact CB-CD1 4.09Å; I33-L74 HydrophobicContact CD1-CB 3.85Å; I33-L74 HydrophobicContact CG1-CB 3.75Å; I33-L74 HydrophobicContact CG1-CD1 4.2Å; Y36-L74 HydrophobicContact CD2-CD1 4.44Å; Y36-L74 HydrophobicContact CE2-CD1 4.25Å; R70-L74 HydrophobicContact CG-CD1 4.43Å; R70-L74 VanDerWaalsContact O-CG 3.32Å; R70-L74 WeakPolarHBondContact O-CG 3.26Å; R70-L74 PolarHBondContact O-N 3.11Å; R70-L74 VanDerWaalsContact O-N 3.11Å; V71-L74 PolarHBondContact O-N 2.89Å; E72-L74 VanDerWaalsContact C-N 3.35Å; E72-L74 PolarHBondContact O-N 3.42Å; L74-Y77 PolarHBondContact O-N 2.97Å; L74-L78 WeakPolarHBondContact O-CG 3.42Å; L74-L78 PolarHBondContact O-N 3.4Å; L74-L78 VanDerWaalsContact O-N 3.11Å
75	Q	85.9	Confident	77.1	Confident	80 Å²	80	91.9 Å²	91.9	37%	0.374	46%	0.46	S	S	.	.	H	α-helix	trans	-65.8	-46	174.4	-75.2	176.9	-36.6	0	0	111	I33 V71 E72 Y77 L78 E79	I33-Q75 HydrophobicContact CD1-CG 3.72Å; I33-Q75 HydrophobicContact CG1-CG 4.39Å; V71-Q75 HydrophobicContact CG1-CG 4.41Å; V71-Q75 WeakPolarHBondContact O-CB 3.45Å; V71-Q75 VanDerWaalsContact O-CG 3.3Å; V71-Q75 WeakPolarHBondContact O-CG 3.36Å; V71-Q75 PolarHBondContact O-N 2.65Å; E72-Q75 PolarHBondContact O-N 3.29Å; Q75-Y77 VanDerWaalsContact C-N 3.28Å; Q75-Y77 PolarHBondContact O-N 3.4Å; Q75-L78 PolarHBondContact O-N 3.31Å; Q75-E79 PolarHBondContact O-N 3.1Å
76	E	83.1	Confident	74.3	Confident	103 Å²	103	94.8 Å²	94.8	48%	0.481	48%	0.475	S	S	.	.	H	α-helix	trans	-63.1	-35.9	177.2	-162.3	-171	164.4	0	0	111.8	E72 K80	E72-E76 PolarHBondContact O-N 3.39Å; E76-K80 VanDerWaalsContact CD-NZ 3.34Å; E76-K80 VanDerWaalsContact O-CG 3.31Å; E76-K80 WeakPolarHBondContact O-CG 3.39Å; E76-K80 PolarHBondContact O-N 3.46Å; E76-K80 VanDerWaalsContact O-N 3.15Å; E76-K80 WeakPolarHBondContact OE1-CE 3.45Å; E76-K80 IonicContact OE1-NZ 3.84Å; E76-K80 PolarHBondContact OE1-NZ 2.93Å
77	Y	82.3	Confident	71.8	Confident	108 Å²	108	95.1 Å²	95.1	42%	0.424	49%	0.485	S	S	.	.	H	α-helix	trans	-65.5	-40.8	174.8	180	-93.3	0	0	0	112.7	Y29 E73 L74 Q75 K80 K81	Y29-Y77 AromaticContact CD2-CD1 3.92Å; Y29-Y77 HydrophobicContact CD2-CD1 3.92Å; Y29-Y77 AromaticContact CD2-CE1 3.74Å; Y29-Y77 HydrophobicContact CD2-CE1 3.74Å; Y29-Y77 AromaticContact CE2-CD1 3.93Å; Y29-Y77 HydrophobicContact CE2-CD1 3.93Å; Y29-Y77 AromaticContact CE2-CE1 3.36Å; Y29-Y77 HydrophobicContact CE2-CE1 3.36Å; E73-Y77 WeakPolarHBondContact O-CB 3.38Å; E73-Y77 PolarHBondContact O-N 3.02Å; L74-Y77 PolarHBondContact O-N 2.97Å; Q75-Y77 VanDerWaalsContact C-N 3.28Å; Q75-Y77 PolarHBondContact O-N 3.4Å; Y77-K80 PolarHBondContact O-N 2.83Å; Y77-K81 HydrophobicContact CE1-CD 4.26Å; Y77-K81 PolarHBondContact O-N 3.3Å
78	L	80	Confident	69.4	Low	37 Å²	37	99.1 Å²	99.1	19%	0.194	51%	0.513	C	S	.	.	H	α-helix	trans	-69.2	-41.2	178.3	-75.3	172.5	0	0	0	112.1	Y29 Q30 I33 L74 Q75 K80 K81 E82	Y29-L78 HydrophobicContact CD2-CD2 4.36Å; Q30-L78 HydrophobicContact CG-CD1 3.73Å; I33-L78 HydrophobicContact CD1-CD1 3.74Å; L74-L78 WeakPolarHBondContact O-CG 3.42Å; L74-L78 PolarHBondContact O-N 3.4Å; L74-L78 VanDerWaalsContact O-N 3.11Å; Q75-L78 PolarHBondContact O-N 3.31Å; L78-K80 VanDerWaalsContact C-N 3.31Å; L78-K80 PolarHBondContact O-N 3.29Å; L78-K81 PolarHBondContact O-N 3.33Å; L78-E82 PolarHBondContact O-N 3.45Å; L78-E82 VanDerWaalsContact O-N 3.1Å
79	E	73.3	Confident	66.8	Low	131 Å²	131	103.2 Å²	103.2	61%	0.612	53%	0.534	S	S	*	.	H	α-helix	trans	-60.3	-40.9	174.9	-74.5	-179.6	174.5	0	0	111.8	Q75 K81 V83	Q75-E79 PolarHBondContact O-N 3.1Å; E79-K81 VanDerWaalsContact C-N 3.25Å; E79-K81 PolarHBondContact O-N 3.18Å; E79-V83 WeakPolarHBondContact O-CG2 3.08Å
80	K	72.1	Confident	64.6	Low	136 Å²	136	105.4 Å²	105.4	59%	0.591	55%	0.546	S	S	*	.	H	α-helix	trans	-65.9	-26.4	175.4	-73.6	171.2	-174.9	165.8	0	113.3	E76 Y77 L78	E76-K80 VanDerWaalsContact CD-NZ 3.34Å; E76-K80 VanDerWaalsContact O-CG 3.31Å; E76-K80 WeakPolarHBondContact O-CG 3.39Å; E76-K80 PolarHBondContact O-N 3.46Å; E76-K80 VanDerWaalsContact O-N 3.15Å; E76-K80 WeakPolarHBondContact OE1-CE 3.45Å; E76-K80 IonicContact OE1-NZ 3.84Å; E76-K80 PolarHBondContact OE1-NZ 2.93Å; Y77-K80 PolarHBondContact O-N 2.83Å; L78-K80 VanDerWaalsContact C-N 3.31Å; L78-K80 PolarHBondContact O-N 3.29Å
81	K	69.1	Low	62.4	Low	130 Å²	130	105.8 Å²	105.8	57%	0.565	56%	0.56	S	S	*	*	H	α-helix	trans	-83.8	-32.4	-178.4	-156.3	177.3	-178.3	-179.7	0	112.5	Y77 L78 E79 V83 G84	Y77-K81 HydrophobicContact CE1-CD 4.26Å; Y77-K81 PolarHBondContact O-N 3.3Å; L78-K81 PolarHBondContact O-N 3.33Å; E79-K81 VanDerWaalsContact C-N 3.25Å; E79-K81 PolarHBondContact O-N 3.18Å; K81-V83 VanDerWaalsContact C-N 3.28Å; K81-V83 PolarHBondContact O-N 2.96Å; K81-G84 PolarHBondContact O-N 3.32Å
82	E	54.8	Low	61	Low	148 Å²	148	106.8 Å²	106.8	69%	0.692	57%	0.566	S	S	*	*	H	α-helix	trans	-69.6	-23.8	175.8	-75.6	-176.4	162.1	0	0	113.2	L78 G84	L78-E82 PolarHBondContact O-N 3.45Å; L78-E82 VanDerWaalsContact O-N 3.1Å; E82-G84 VanDerWaalsContact C-N 3.26Å; E82-G84 PolarHBondContact O-N 2.94Å
83	V	51.5	Low	59.8	Low	127 Å²	127	106 Å²	106	77%	0.77	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.3	-7.5	177.6	-179.4	0	0	0	0	112.7	E79 K81	E79-V83 WeakPolarHBondContact O-CG2 3.08Å; K81-V83 VanDerWaalsContact C-N 3.28Å; K81-V83 PolarHBondContact O-N 2.96Å
84	G	40.1	Very low	58.9	Low	67 Å²	67	107 Å²	107	69%	0.691	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.3	6.7	-170.1	0	0	0	0	0	118	K81 E82	K81-G84 PolarHBondContact O-N 3.32Å; E82-G84 VanDerWaalsContact C-N 3.26Å; E82-G84 PolarHBondContact O-N 2.94Å
85	S	38.6	Very low	58.2	Low	96 Å²	96	109 Å²	109	67%	0.671	58%	0.576	S	S	*	*			trans	-144.4	85.1	-175	53.6	0	0	0	0	114.9
86	Q	29.3	Very low	57.9	Low	192 Å²	192	108.5 Å²	108.5	90%	0.897	57%	0.571	S	S	*	*	S	Bend	trans	-177	151.9	139.2	-101.4	173.9	14	0	0	111.4
87	P	36.3	Very low	57.9	Low	123 Å²	123	109.5 Å²	109.5	80%	0.799	57%	0.574	S	S	*	*			trans	-81.8	137.9	-169.8	32	-31.3	0	0	0	114
88	T	38.6	Very low	58	Low	125 Å²	125	109.1 Å²	109.1	77%	0.767	58%	0.575	S	S	*	*			trans	-33.7	121.4	178.8	54.1	0	0	0	0	120.4
89	I	34.9	Very low	58.1	Low	165 Å²	165	107.4 Å²	107.4	85%	0.846	57%	0.566	S	S	*	*				-146.5	119.4	123.4	-55.5	-175.6	0	0	0	107	P91	I89-P91 VanDerWaalsContact O-CD 3.25Å; I89-P91 WeakPolarHBondContact O-CD 3.34Å
90	N	42.5	Very low	58.8	Low	116 Å²	116	104.5 Å²	104.5	62%	0.62	55%	0.553	S	S	*	*			trans	-77.1	113	-173.3	-76.4	-22.5	0	0	0	112.4	T92	N90-T92 VanDerWaalsContact C-N 3.25Å; N90-T92 PolarHBondContact O-N 2.79Å
91	P	45	Very low	59.6	Low	96 Å²	96	102.6 Å²	102.6	62%	0.623	55%	0.55	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-13.6	-178.2	-17	32	0	0	0	114.9	I89	I89-P91 VanDerWaalsContact O-CD 3.25Å; I89-P91 WeakPolarHBondContact O-CD 3.34Å
92	T	58.7	Low	60.5	Low	27 Å²	27	98 Å²	98	17%	0.166	53%	0.532	C	S	.	.	H	α-helix	trans	-86.5	-27.7	-167.3	49.8	0	0	0	0	114	N90 E94 E95 Y96 E136	N90-T92 VanDerWaalsContact C-N 3.25Å; N90-T92 PolarHBondContact O-N 2.79Å; T92-E94 VanDerWaalsContact C-N 3.34Å; T92-E94 PolarHBondContact O-N 2.82Å; T92-E95 PolarHBondContact O-N 2.92Å; T92-Y96 PolarHBondContact O-N 3.34Å; T92-Y96 VanDerWaalsContact O-N 3.12Å; T92-E136 WeakPolarHBondContact CB-OE1 3.13Å; T92-E136 HydrophobicContact CG2-CB 4.32Å; T92-E136 HydrophobicContact CG2-CG 4.49Å; T92-E136 WeakPolarHBondContact OG1-CG 3.47Å; T92-E136 PolarHBondContact OG1-OE1 3.01Å
93	E	63.3	Low	62.1	Low	113 Å²	113	91.1 Å²	91.1	53%	0.528	50%	0.5	S	S	.	.	H	α-helix	trans	-73	-30.2	-178	-162.3	-179.6	166.4	0	0	111.8	K97 E136	E93-K97 PolarHBondContact O-N 3.39Å; E93-E136 WeakPolarHBondContact CA-OE1 3.35Å; E93-E136 PolarHBondContact N-OE1 3.2Å
94	E	70.2	Confident	63.9	Low	123 Å²	123	88 Å²	88	58%	0.575	48%	0.483	S	S	*	.	H	α-helix	trans	-66.9	-38.5	170.5	-78	-165.2	176.7	0	0	112.4	T92 Y96 K97 K98	T92-E94 VanDerWaalsContact C-N 3.34Å; T92-E94 PolarHBondContact O-N 2.82Å; E94-Y96 VanDerWaalsContact C-N 3.34Å; E94-K97 PolarHBondContact O-N 2.88Å; E94-K98 WeakPolarHBondContact O-CB 3.43Å; E94-K98 VanDerWaalsContact O-CG 3.29Å; E94-K98 WeakPolarHBondContact O-CG 3.36Å; E94-K98 PolarHBondContact O-N 3.03Å; E94-K98 IonicContact OE2-NZ 3.22Å; E94-K98 PolarHBondContact OE2-NZ 2.92Å
95	E	73.4	Confident	66.4	Low	45 Å²	45	90.4 Å²	90.4	21%	0.21	48%	0.475	C	S	.	.	H	α-helix	trans	-69.1	-35.5	179.8	-67.6	-178.1	155.8	0	0	111.5	T92 K98 A99 H131 V132	T92-E95 PolarHBondContact O-N 2.92Å; E95-K98 PolarHBondContact O-N 2.77Å; E95-A99 WeakPolarHBondContact O-CB 3.41Å; E95-A99 PolarHBondContact O-N 2.9Å; E95-H131 IonicContact OE1-CE1 3.02Å; E95-H131 IonicContact OE1-ND1 3.62Å; E95-H131 IonicContact OE2-CE1 3.39Å; E95-H131 PolarHBondContact OE2-CE1 3.04Å; E95-H131 IonicContact OE2-CG 3.24Å; E95-H131 IonicContact OE2-ND1 2.64Å; E95-H131 PolarHBondContact OE2-ND1 3.29Å; E95-V132 HydrophobicContact CB-CG2 4.15Å
96	Y	79.9	Confident	68.7	Low	70 Å²	70	85.8 Å²	85.8	28%	0.275	44%	0.443	S	S	.	.	H	α-helix	trans	-65.6	-42.6	173	-175.2	-114.6	0	0	0	112.5	T92 E94 A99 I100 F129 V132 I146	T92-Y96 PolarHBondContact O-N 3.34Å; T92-Y96 VanDerWaalsContact O-N 3.12Å; E94-Y96 VanDerWaalsContact C-N 3.34Å; Y96-A99 WeakPolarHBondContact O-CB 3.36Å; Y96-A99 PolarHBondContact O-N 3.13Å; Y96-I100 HydrophobicContact CD1-CD1 4.04Å; Y96-I100 HydrophobicContact CE1-CD1 3.58Å; Y96-I100 HydrophobicContact CE2-CD1 4.39Å; Y96-I100 WeakPolarHBondContact O-CG1 3.49Å; Y96-I100 PolarHBondContact O-N 2.81Å; Y96-F129 HydrophobicContact CD2-CD1 4.29Å; Y96-F129 HydrophobicContact CD2-CE1 4.09Å; Y96-F129 HydrophobicContact CE2-CD1 4.17Å; Y96-F129 AromaticContact CE2-CE1 3.77Å; Y96-F129 HydrophobicContact CE2-CE1 3.77Å; Y96-V132 HydrophobicContact CD2-CB 4.5Å; Y96-V132 HydrophobicContact CD2-CG1 3.83Å; Y96-V132 HydrophobicContact CD2-CG2 4.39Å; Y96-V132 HydrophobicContact CG-CG1 4.35Å; Y96-I146 HydrophobicContact CD2-CD1 4.42Å; Y96-I146 HydrophobicContact CE2-CD1 3.85Å; Y96-I146 HydrophobicContact CE2-CG1 4.1Å
97	K	82.1	Confident	71.6	Confident	125 Å²	125	78.9 Å²	78.9	54%	0.543	42%	0.419	S	S	.	.	H	α-helix	trans	-62.5	-44.1	173.4	-75.7	177.5	-178.3	167.9	0	111.8	E93 E94 A99 I100 D101	E93-K97 PolarHBondContact O-N 3.39Å; E94-K97 PolarHBondContact O-N 2.88Å; K97-A99 VanDerWaalsContact C-N 3.3Å; K97-A99 PolarHBondContact O-N 3.19Å; K97-I100 PolarHBondContact O-N 2.63Å; K97-D101 PolarHBondContact O-N 3.23Å
98	K	83.6	Confident	74.1	Confident	100 Å²	100	78.8 Å²	78.8	44%	0.435	41%	0.407	S	S	.	.	H	α-helix	trans	-59	-39.3	175	-75.3	168.2	-175.3	158.4	0	112.1	E94 E95 D101 L102	E94-K98 WeakPolarHBondContact O-CB 3.43Å; E94-K98 VanDerWaalsContact O-CG 3.29Å; E94-K98 WeakPolarHBondContact O-CG 3.36Å; E94-K98 PolarHBondContact O-N 3.03Å; E94-K98 IonicContact OE2-NZ 3.22Å; E94-K98 PolarHBondContact OE2-NZ 2.92Å; E95-K98 PolarHBondContact O-N 2.77Å; K98-D101 PolarHBondContact O-N 3.37Å; K98-L102 WeakPolarHBondContact O-CB 3.44Å; K98-L102 VanDerWaalsContact O-CG 3.28Å; K98-L102 WeakPolarHBondContact O-CG 3.47Å; K98-L102 PolarHBondContact O-N 3.21Å
99	A	83.2	Confident	76.5	Confident	0 Å²	0	75.8 Å²	75.8	0%	0	39%	0.385	C	S	.	.	H	α-helix	trans	-62.9	-42.1	176.8	0	0	0	0	0	112.4	E95 Y96 K97 A103 F129	E95-A99 WeakPolarHBondContact O-CB 3.41Å; E95-A99 PolarHBondContact O-N 2.9Å; Y96-A99 WeakPolarHBondContact O-CB 3.36Å; Y96-A99 PolarHBondContact O-N 3.13Å; K97-A99 VanDerWaalsContact C-N 3.3Å; K97-A99 PolarHBondContact O-N 3.19Å; A99-A103 WeakPolarHBondContact O-CB 3.25Å; A99-A103 PolarHBondContact O-N 3.04Å; A99-F129 HydrophobicContact CB-CD1 3.71Å; A99-F129 HydrophobicContact CB-CD2 3.98Å; A99-F129 HydrophobicContact CB-CE1 3.62Å; A99-F129 HydrophobicContact CB-CE2 3.87Å; A99-F129 HydrophobicContact CB-CG 3.88Å; A99-F129 HydrophobicContact CB-CZ 3.7Å
100	I	87	Confident	78.9	Confident	70 Å²	70	68.8 Å²	68.8	36%	0.359	35%	0.349	S	S	.	.	H	α-helix	trans	-66.7	-44.2	177.4	-66.7	170.6	0	0	0	111	Y96 K97 L102 A103 S104 F129	Y96-I100 HydrophobicContact CD1-CD1 4.04Å; Y96-I100 HydrophobicContact CE1-CD1 3.58Å; Y96-I100 HydrophobicContact CE2-CD1 4.39Å; Y96-I100 WeakPolarHBondContact O-CG1 3.49Å; Y96-I100 PolarHBondContact O-N 2.81Å; K97-I100 PolarHBondContact O-N 2.63Å; I100-L102 PolarHBondContact O-N 3.05Å; I100-A103 PolarHBondContact O-N 2.8Å; I100-S104 WeakPolarHBondContact O-CB 3.49Å; I100-S104 PolarHBondContact O-N 3.38Å; I100-F129 HydrophobicContact CG1-CE1 4.18Å; I100-F129 HydrophobicContact CG1-CZ 4.01Å
101	D	88.9	Confident	81.1	Confident	96 Å²	96	72.2 Å²	72.2	51%	0.513	36%	0.358	S	S	.	.	H	α-helix	trans	-63.3	-42	179.5	-73.7	-14.1	0	0	0	111.8	K97 K98 S104 K105	K97-D101 PolarHBondContact O-N 3.23Å; K98-D101 PolarHBondContact O-N 3.37Å; D101-S104 PolarHBondContact O-N 2.87Å; D101-K105 WeakPolarHBondContact O-CB 3.39Å; D101-K105 WeakPolarHBondContact O-CG 3.46Å; D101-K105 PolarHBondContact O-N 2.77Å
102	L	88.7	Confident	83.1	Confident	35 Å²	35	71 Å²	71	18%	0.183	36%	0.356	C	S	.	.	H	α-helix	trans	-65.3	-41.4	176	-73	170.3	0	0	0	111.9	K98 I100 K105 A106 L121 H124 A125 Y128	K98-L102 WeakPolarHBondContact O-CB 3.44Å; K98-L102 VanDerWaalsContact O-CG 3.28Å; K98-L102 WeakPolarHBondContact O-CG 3.47Å; K98-L102 PolarHBondContact O-N 3.21Å; I100-L102 PolarHBondContact O-N 3.05Å; L102-K105 PolarHBondContact O-N 2.99Å; L102-A106 WeakPolarHBondContact O-CB 3.37Å; L102-A106 PolarHBondContact O-N 3.32Å; L102-L121 HydrophobicContact CD2-CD2 3.91Å; L102-H124 HydrophobicContact CD1-CB 4.42Å; L102-A125 HydrophobicContact CB-CB 3.98Å; L102-Y128 HydrophobicContact CD1-CD2 3.62Å; L102-Y128 HydrophobicContact CD1-CE2 3.78Å
103	A	87.6	Confident	84.4	Confident	3 Å²	3	76.3 Å²	76.3	3%	0.025	38%	0.379	C	S	.	.	H	α-helix	trans	-65.8	-38	176.2	0	0	0	0	0	112.5	A99 I100 A106 A107 A125 F129 Y153	A99-A103 WeakPolarHBondContact O-CB 3.25Å; A99-A103 PolarHBondContact O-N 3.04Å; I100-A103 PolarHBondContact O-N 2.8Å; A103-A106 PolarHBondContact O-N 3.19Å; A103-A107 PolarHBondContact O-N 2.88Å; A103-A107 VanDerWaalsContact O-N 3.1Å; A103-A125 HydrophobicContact CB-CB 4.04Å; A103-F129 HydrophobicContact CB-CE2 4.16Å; A103-Y153 HydrophobicContact CB-CD2 4.47Å; A103-Y153 HydrophobicContact CB-CE1 4.37Å; A103-Y153 HydrophobicContact CB-CE2 3.77Å
104	S	90.9	Very high	85.5	Confident	61 Å²	61	74.3 Å²	74.3	43%	0.427	37%	0.372	S	S	.	.	H	α-helix	trans	-66.4	-43.6	175.9	-167.8	0	0	0	0	111.6	I100 D101 A107 Q108	I100-S104 WeakPolarHBondContact O-CB 3.49Å; I100-S104 PolarHBondContact O-N 3.38Å; D101-S104 PolarHBondContact O-N 2.87Å; S104-A107 PolarHBondContact O-N 2.86Å; S104-Q108 WeakPolarHBondContact O-CG 2.87Å; S104-Q108 PolarHBondContact O-N 3.05Å; S104-Q108 VanDerWaalsContact O-N 3.11Å
105	K	90.9	Very high	86.2	Confident	117 Å²	117	70.2 Å²	70.2	51%	0.509	35%	0.351	S	S	.	.	H	α-helix	trans	-61.9	-42.4	173.5	-73.4	175.6	-176.8	177.6	0	111.9	D101 L102 A107 Q108 E109 L121	D101-K105 WeakPolarHBondContact O-CB 3.39Å; D101-K105 WeakPolarHBondContact O-CG 3.46Å; D101-K105 PolarHBondContact O-N 2.77Å; L102-K105 PolarHBondContact O-N 2.99Å; K105-A107 VanDerWaalsContact C-N 3.31Å; K105-A107 PolarHBondContact O-N 3.29Å; K105-Q108 PolarHBondContact O-N 3.02Å; K105-Q108 VanDerWaalsContact O-N 3.14Å; K105-E109 WeakPolarHBondContact O-CG 3.16Å; K105-E109 PolarHBondContact O-N 3.48Å; K105-L121 HydrophobicContact CB-CD1 4.21Å
106	A	88.6	Confident	86.7	Confident	0 Å²	0	73 Å²	73	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-57.9	-43.1	176.3	0	0	0	0	0	112	L102 A103 Q108 E109 D110 L121 Y122	L102-A106 WeakPolarHBondContact O-CB 3.37Å; L102-A106 PolarHBondContact O-N 3.32Å; A103-A106 PolarHBondContact O-N 3.19Å; A106-Q108 VanDerWaalsContact C-N 3.35Å; A106-Q108 PolarHBondContact O-N 3.05Å; A106-E109 PolarHBondContact O-N 3.34Å; A106-D110 VanDerWaalsContact O-CB 3.3Å; A106-D110 WeakPolarHBondContact O-CB 3.37Å; A106-D110 PolarHBondContact O-N 3.47Å; A106-L121 HydrophobicContact CB-CB 3.63Å; A106-Y122 HydrophobicContact CB-CD1 3.68Å; A106-Y122 HydrophobicContact CB-CD2 3.88Å; A106-Y122 HydrophobicContact CB-CE1 3.72Å; A106-Y122 HydrophobicContact CB-CE2 3.92Å; A106-Y122 HydrophobicContact CB-CG 3.75Å
107	A	88.9	Confident	86.9	Confident	47 Å²	47	72.3 Å²	72.3	39%	0.388	37%	0.367	S	S	.	.	H	α-helix	trans	-67.8	-32	177.4	0	0	0	0	0	113.3	A103 S104 K105 K111 Y122	A103-A107 PolarHBondContact O-N 2.88Å; A103-A107 VanDerWaalsContact O-N 3.1Å; S104-A107 PolarHBondContact O-N 2.86Å; K105-A107 VanDerWaalsContact C-N 3.31Å; K105-A107 PolarHBondContact O-N 3.29Å; A107-K111 WeakPolarHBondContact O-CB 3.29Å; A107-K111 PolarHBondContact O-N 3.28Å; A107-K111 VanDerWaalsContact O-N 3.09Å; A107-Y122 WeakPolarHBondContact CA-OH 3.35Å
108	Q	90.1	Very high	87	Confident	120 Å²	120	66.3 Å²	66.3	56%	0.561	34%	0.341	S	S	*	.	H	α-helix	trans	-69.3	-45.6	174.5	-70.3	174	13.9	0	0	111.5	S104 K105 A106 D110 K111 A112	S104-Q108 WeakPolarHBondContact O-CG 2.87Å; S104-Q108 PolarHBondContact O-N 3.05Å; S104-Q108 VanDerWaalsContact O-N 3.11Å; K105-Q108 PolarHBondContact O-N 3.02Å; K105-Q108 VanDerWaalsContact O-N 3.14Å; A106-Q108 VanDerWaalsContact C-N 3.35Å; A106-Q108 PolarHBondContact O-N 3.05Å; Q108-D110 VanDerWaalsContact C-N 3.34Å; Q108-K111 PolarHBondContact O-N 2.86Å; Q108-A112 WeakPolarHBondContact O-CB 3.45Å; Q108-A112 PolarHBondContact O-N 3.39Å
109	E	87.3	Confident	87.1	Confident	63 Å²	63	62.7 Å²	62.7	29%	0.294	33%	0.326	S	S	.	.	H	α-helix	trans	-65.5	-37	176.9	-68.2	-60.5	145.2	0	0	112	K105 A106 A112 Q113 N114 E117 A118 L121	K105-E109 WeakPolarHBondContact O-CG 3.16Å; K105-E109 PolarHBondContact O-N 3.48Å; A106-E109 PolarHBondContact O-N 3.34Å; E109-A112 CarbonylContact O-C 3.53Å; E109-A112 PolarHBondContact O-N 2.96Å; E109-Q113 PolarHBondContact O-N 2.77Å; E109-Q113 VanDerWaalsContact O-N 3.13Å; E109-N114 HydrophobicContact CB-CB 4.43Å; E109-N114 PolarHBondContact O-N 3.49Å; E109-N114 VanDerWaalsContact OE2-CB 3.27Å; E109-N114 WeakPolarHBondContact OE2-CB 3.48Å; E109-N114 PolarHBondContact OE2-ND2 3.32Å; E109-E117 HydrophobicContact CG-CG 4.41Å; E109-A118 HydrophobicContact CB-CB 4.02Å; E109-L121 HydrophobicContact CG-CD1 3.96Å
110	D	86.8	Confident	87.3	Confident	18 Å²	18	69 Å²	69	10%	0.096	35%	0.35	C	S	.	.	H	α-helix	trans	-63.4	-42.3	173.9	-171.4	13.1	0	0	0	111.5	A106 Q108 A112 Q113 Y115 A118 Y122 R156	A106-D110 VanDerWaalsContact O-CB 3.3Å; A106-D110 WeakPolarHBondContact O-CB 3.37Å; A106-D110 PolarHBondContact O-N 3.47Å; Q108-D110 VanDerWaalsContact C-N 3.34Å; D110-A112 VanDerWaalsContact C-N 3.3Å; D110-A112 PolarHBondContact O-N 2.86Å; D110-Q113 PolarHBondContact O-N 2.99Å; D110-Q113 VanDerWaalsContact O-N 3.14Å; D110-Y115 WeakPolarHBondContact OD1-CE1 3.39Å; D110-A118 HydrophobicContact CB-CB 4.01Å; D110-Y122 HydrophobicContact CB-CE2 4.21Å; D110-R156 IonicContact OD1-CZ 2.64Å; D110-R156 IonicContact OD1-NE 2.91Å; D110-R156 IonicContact OD1-NH2 3.19Å; D110-R156 PolarHBondContact OD1-NH2 3.04Å; D110-R156 IonicContact OD2-CZ 2.72Å; D110-R156 VanDerWaalsContact OD2-CZ 3.22Å; D110-R156 IonicContact OD2-NE 3.82Å; D110-R156 PolarHBondContact OD2-NE 3.13Å; D110-R156 IonicContact OD2-NH2 3.55Å; D110-R156 PolarHBondContact OD2-NH2 2.98Å
111	K	88.7	Confident	87.2	Confident	188 Å²	188	66.8 Å²	66.8	82%	0.817	34%	0.339	S	S	*	.	H	α-helix	trans	-67.3	-31.4	173.5	-168	176.6	-178.6	-179.5	0	112.5	A107 Q108 Q113	A107-K111 WeakPolarHBondContact O-CB 3.29Å; A107-K111 PolarHBondContact O-N 3.28Å; A107-K111 VanDerWaalsContact O-N 3.09Å; Q108-K111 PolarHBondContact O-N 2.86Å; K111-Q113 PolarHBondContact O-N 3.19Å
112	A	86.9	Confident	87.1	Confident	69 Å²	69	62.9 Å²	62.9	57%	0.57	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	2.8	174.4	0	0	0	0	0	113.5	Q108 E109 D110 N114	Q108-A112 WeakPolarHBondContact O-CB 3.45Å; Q108-A112 PolarHBondContact O-N 3.39Å; E109-A112 CarbonylContact O-C 3.53Å; E109-A112 PolarHBondContact O-N 2.96Å; D110-A112 VanDerWaalsContact C-N 3.3Å; D110-A112 PolarHBondContact O-N 2.86Å; A112-N114 PolarHBondContact O-N 2.94Å
113	Q	85.4	Confident	86.9	Confident	140 Å²	140	65.2 Å²	65.2	65%	0.654	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.5	20.1	-178.2	-51.5	-173.1	-36	0	0	114.6	E109 D110 K111 Y115	E109-Q113 PolarHBondContact O-N 2.77Å; E109-Q113 VanDerWaalsContact O-N 3.13Å; D110-Q113 PolarHBondContact O-N 2.99Å; D110-Q113 VanDerWaalsContact O-N 3.14Å; K111-Q113 PolarHBondContact O-N 3.19Å; Q113-Y115 VanDerWaalsContact C-N 3.33Å; Q113-Y115 HydrophobicContact CB-CE1 4.43Å; Q113-Y115 HydrophobicContact CB-CE2 3.97Å; Q113-Y115 WeakPolarHBondContact CG-OH 3.45Å; Q113-Y115 WeakPolarHBondContact O-CD2 3.34Å; Q113-Y115 PolarHBondContact O-N 3.23Å
114	N	85.9	Confident	86.8	Confident	70 Å²	70	69 Å²	69	37%	0.374	34%	0.344	S	S	.	.			trans	-90.4	71.1	175.1	-167.8	9.1	0	0	0	110.1	E109 A112 D116 E117 A118	E109-N114 HydrophobicContact CB-CB 4.43Å; E109-N114 PolarHBondContact O-N 3.49Å; E109-N114 VanDerWaalsContact OE2-CB 3.27Å; E109-N114 WeakPolarHBondContact OE2-CB 3.48Å; E109-N114 PolarHBondContact OE2-ND2 3.32Å; A112-N114 PolarHBondContact O-N 2.94Å; N114-D116 PolarHBondContact O-N 3.42Å; N114-E117 PolarHBondContact O-N 2.84Å; N114-A118 WeakPolarHBondContact O-CB 3.41Å; N114-A118 PolarHBondContact O-N 2.96Å
115	Y	85.4	Confident	86.5	Confident	37 Å²	37	66.1 Å²	66.1	15%	0.145	32%	0.324	C	S	.	.	H	α-helix	trans	-68.7	-29.7	-165.5	-58.6	-54.3	0	0	0	114.6	D110 Q113 L119 L160 Y163	D110-Y115 WeakPolarHBondContact OD1-CE1 3.39Å; Q113-Y115 VanDerWaalsContact C-N 3.33Å; Q113-Y115 HydrophobicContact CB-CE1 4.43Å; Q113-Y115 HydrophobicContact CB-CE2 3.97Å; Q113-Y115 WeakPolarHBondContact CG-OH 3.45Å; Q113-Y115 WeakPolarHBondContact O-CD2 3.34Å; Q113-Y115 PolarHBondContact O-N 3.23Å; Y115-L119 VanDerWaalsContact O-CB 3.31Å; Y115-L119 WeakPolarHBondContact O-CB 3.38Å; Y115-L119 PolarHBondContact O-N 3.47Å; Y115-L160 HydrophobicContact CD1-CD2 3.33Å; Y115-L160 HydrophobicContact CE1-CD2 3.94Å; Y115-L160 HydrophobicContact CG-CD2 4Å; Y115-Y163 AromaticContact CD2-CD1 3.86Å; Y115-Y163 HydrophobicContact CD2-CD1 3.86Å; Y115-Y163 AromaticContact CD2-CE1 3.55Å; Y115-Y163 HydrophobicContact CD2-CE1 3.55Å; Y115-Y163 HydrophobicContact CE2-CD1 4.09Å; Y115-Y163 AromaticContact CE2-CE1 3.46Å; Y115-Y163 HydrophobicContact CE2-CE1 3.46Å; Y115-Y163 VanDerWaalsContact CE2-CE1 3.46Å; Y115-Y163 HydrophobicContact CG-CD1 4.4Å; Y115-Y163 HydrophobicContact CG-CE1 4.49Å
116	D	83.1	Confident	86.2	Confident	103 Å²	103	60.9 Å²	60.9	55%	0.551	30%	0.301	S	S	*	.	H	α-helix	trans	-66.7	-45.5	177.1	-67.6	-77.2	0	0	0	111.7	N114 R120	N114-D116 PolarHBondContact O-N 3.42Å; D116-R120 PolarHBondContact O-N 3.43Å
117	E	84.1	Confident	85.9	Confident	56 Å²	56	66.7 Å²	66.7	26%	0.262	33%	0.329	S	S	.	.	H	α-helix	trans	-74	-37.8	178.4	-172.5	58.9	-164.9	0	0	111.5	E109 N114 L119 R120 L121	E109-E117 HydrophobicContact CG-CG 4.41Å; N114-E117 PolarHBondContact O-N 2.84Å; E117-L119 VanDerWaalsContact C-N 3.34Å; E117-L119 PolarHBondContact O-N 3.46Å; E117-R120 PolarHBondContact O-N 2.76Å; E117-R120 IonicContact OE1-CZ 3.48Å; E117-R120 IonicContact OE1-NE 3.04Å; E117-R120 PolarHBondContact OE1-NE 3.26Å; E117-R120 IonicContact OE1-NH2 3.22Å; E117-R120 PolarHBondContact OE1-NH2 3.32Å; E117-R120 IonicContact OE2-CZ 3.14Å; E117-R120 IonicContact OE2-NE 2.88Å; E117-R120 PolarHBondContact OE2-NE 3.35Å; E117-R120 IonicContact OE2-NH2 3.3Å; E117-R120 PolarHBondContact OE2-NH2 3.13Å; E117-L121 HydrophobicContact CG-CD1 4.04Å; E117-L121 HydrophobicContact CG-CG 4.46Å; E117-L121 WeakPolarHBondContact O-CB 3.45Å; E117-L121 VanDerWaalsContact O-CG 3.3Å; E117-L121 WeakPolarHBondContact O-CG 3.38Å; E117-L121 PolarHBondContact O-N 3.33Å
118	A	85.3	Confident	85.6	Confident	0 Å²	0	68.6 Å²	68.6	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-59.1	-43.4	173.2	0	0	0	0	0	111.9	E109 D110 N114 R120 L121 Y122 L160	E109-A118 HydrophobicContact CB-CB 4.02Å; D110-A118 HydrophobicContact CB-CB 4.01Å; N114-A118 WeakPolarHBondContact O-CB 3.41Å; N114-A118 PolarHBondContact O-N 2.96Å; A118-R120 PolarHBondContact O-N 2.85Å; A118-L121 PolarHBondContact O-N 3.25Å; A118-Y122 HydrophobicContact CB-CE2 4.49Å; A118-Y122 WeakPolarHBondContact O-CB 3.38Å; A118-Y122 WeakPolarHBondContact O-CD2 3.22Å; A118-Y122 PolarHBondContact O-N 2.96Å; A118-L160 HydrophobicContact CB-CD1 4.06Å
119	L	85.6	Confident	85.1	Confident	24 Å²	24	63 Å²	63	13%	0.126	30%	0.3	C	S	.	.	H	α-helix	trans	-59.8	-45.7	177.1	179.1	64.4	0	0	0	111.7	Y115 E117 Y122 Q123 A157 L160 K161 L164	Y115-L119 VanDerWaalsContact O-CB 3.31Å; Y115-L119 WeakPolarHBondContact O-CB 3.38Å; Y115-L119 PolarHBondContact O-N 3.47Å; E117-L119 VanDerWaalsContact C-N 3.34Å; E117-L119 PolarHBondContact O-N 3.46Å; L119-Y122 PolarHBondContact O-N 3.42Å; L119-Q123 WeakPolarHBondContact O-CG 3.44Å; L119-Q123 PolarHBondContact O-N 3.03Å; L119-Q123 VanDerWaalsContact O-N 3.11Å; L119-A157 HydrophobicContact CD1-CB 3.78Å; L119-A157 WeakPolarHBondContact CD1-O 3.47Å; L119-L160 HydrophobicContact CD1-CB 4.49Å; L119-K161 HydrophobicContact CD1-CB 4.3Å; L119-K161 HydrophobicContact CD2-CB 4.26Å; L119-L164 HydrophobicContact CD2-CD1 4.12Å
120	R	86.5	Confident	84.7	Confident	133 Å²	133	64.4 Å²	64.4	50%	0.502	31%	0.309	S	S	.	.	H	α-helix	trans	-62.2	-46	178	-171.7	176.7	75.9	138.1	4.1	111.6	D116 E117 A118 Q123 H124	D116-R120 PolarHBondContact O-N 3.43Å; E117-R120 PolarHBondContact O-N 2.76Å; E117-R120 IonicContact OE1-CZ 3.48Å; E117-R120 IonicContact OE1-NE 3.04Å; E117-R120 PolarHBondContact OE1-NE 3.26Å; E117-R120 IonicContact OE1-NH2 3.22Å; E117-R120 PolarHBondContact OE1-NH2 3.32Å; E117-R120 IonicContact OE2-CZ 3.14Å; E117-R120 IonicContact OE2-NE 2.88Å; E117-R120 PolarHBondContact OE2-NE 3.35Å; E117-R120 IonicContact OE2-NH2 3.3Å; E117-R120 PolarHBondContact OE2-NH2 3.13Å; A118-R120 PolarHBondContact O-N 2.85Å; R120-Q123 PolarHBondContact O-N 3.04Å; R120-H124 PolarHBondContact O-CD2 2.87Å; R120-H124 VanDerWaalsContact O-CD2 3.32Å; R120-H124 PolarHBondContact O-N 3.46Å
121	L	86.1	Confident	84.2	Confident	22 Å²	22	66.9 Å²	66.9	12%	0.115	32%	0.32	C	S	.	.	H	α-helix	trans	-67.2	-38.3	-179.7	-69	171.1	0	0	0	112.3	L102 K105 A106 E109 E117 A118 H124 A125	L102-L121 HydrophobicContact CD2-CD2 3.91Å; K105-L121 HydrophobicContact CB-CD1 4.21Å; A106-L121 HydrophobicContact CB-CB 3.63Å; E109-L121 HydrophobicContact CG-CD1 3.96Å; E117-L121 HydrophobicContact CG-CD1 4.04Å; E117-L121 HydrophobicContact CG-CG 4.46Å; E117-L121 WeakPolarHBondContact O-CB 3.45Å; E117-L121 VanDerWaalsContact O-CG 3.3Å; E117-L121 WeakPolarHBondContact O-CG 3.38Å; E117-L121 PolarHBondContact O-N 3.33Å; A118-L121 PolarHBondContact O-N 3.25Å; L121-H124 PolarHBondContact O-N 3.12Å; L121-A125 WeakPolarHBondContact O-CB 3.48Å; L121-A125 PolarHBondContact O-N 3.02Å
122	Y	87.4	Confident	83.6	Confident	15 Å²	15	58.1 Å²	58.1	6%	0.059	28%	0.282	C	S	.	.	H	α-helix	trans	-62.8	-42.8	173.3	-82.7	-57.9	0	0	0	112.1	A106 A107 D110 A118 L119 A125 V126 Y153 R156 L160	A106-Y122 HydrophobicContact CB-CD1 3.68Å; A106-Y122 HydrophobicContact CB-CD2 3.88Å; A106-Y122 HydrophobicContact CB-CE1 3.72Å; A106-Y122 HydrophobicContact CB-CE2 3.92Å; A106-Y122 HydrophobicContact CB-CG 3.75Å; A107-Y122 WeakPolarHBondContact CA-OH 3.35Å; D110-Y122 HydrophobicContact CB-CE2 4.21Å; A118-Y122 HydrophobicContact CB-CE2 4.49Å; A118-Y122 WeakPolarHBondContact O-CB 3.38Å; A118-Y122 WeakPolarHBondContact O-CD2 3.22Å; A118-Y122 PolarHBondContact O-N 2.96Å; L119-Y122 PolarHBondContact O-N 3.42Å; Y122-A125 PolarHBondContact O-N 3.14Å; Y122-V126 VanDerWaalsContact O-CG2 3.29Å; Y122-V126 WeakPolarHBondContact O-CG2 3.3Å; Y122-V126 PolarHBondContact O-N 3.28Å; Y122-V126 VanDerWaalsContact O-N 3.08Å; Y122-Y153 AromaticContact CD1-CD1 3.83Å; Y122-Y153 HydrophobicContact CD1-CD1 3.83Å; Y122-Y153 HydrophobicContact CD1-CG 4.03Å; Y122-Y153 AromaticContact CE1-CD1 3.55Å; Y122-Y153 HydrophobicContact CE1-CD1 3.55Å; Y122-Y153 HydrophobicContact CE1-CE1 4.14Å; Y122-Y153 HydrophobicContact CE1-CG 4.23Å; Y122-R156 HydrophobicContact CE2-CG 3.97Å; Y122-L160 HydrophobicContact CD2-CD1 4Å; Y122-L160 HydrophobicContact CE2-CD1 4.04Å
123	Q	84.1	Confident	83	Confident	84 Å²	84	55.4 Å²	55.4	39%	0.393	26%	0.258	S	S	.	.	H	α-helix	trans	-63.9	-43.3	177	-72.8	175	-3.8	0	0	112.2	L119 R120 V126 Q127	L119-Q123 WeakPolarHBondContact O-CG 3.44Å; L119-Q123 PolarHBondContact O-N 3.03Å; L119-Q123 VanDerWaalsContact O-N 3.11Å; R120-Q123 PolarHBondContact O-N 3.04Å; Q123-V126 PolarHBondContact O-N 3.17Å; Q123-Q127 WeakPolarHBondContact O-CG 3.41Å; Q123-Q127 PolarHBondContact O-N 3.06Å; Q123-Q127 VanDerWaalsContact O-N 3.12Å
124	H	84.5	Confident	82.3	Confident	82 Å²	82	56 Å²	56	38%	0.38	26%	0.259	S	S	.	.	H	α-helix	trans	-64.8	-43.8	176.3	-83.6	-129.9	0	0	0	111.8	L102 R120 L121 V126 Q127 Y128	L102-H124 HydrophobicContact CD1-CB 4.42Å; R120-H124 PolarHBondContact O-CD2 2.87Å; R120-H124 VanDerWaalsContact O-CD2 3.32Å; R120-H124 PolarHBondContact O-N 3.46Å; L121-H124 PolarHBondContact O-N 3.12Å; H124-V126 VanDerWaalsContact C-N 3.32Å; H124-V126 PolarHBondContact O-N 3.43Å; H124-Q127 PolarHBondContact O-N 3.45Å; H124-Y128 VanDerWaalsContact O-CD2 3.25Å; H124-Y128 WeakPolarHBondContact O-CD2 3.4Å; H124-Y128 PolarHBondContact O-N 2.84Å; H124-Y128 VanDerWaalsContact O-N 3.13Å
125	A	84.3	Confident	81.3	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-58.7	-43	177.1	0	0	0	0	0	111.9	L102 A103 L121 Y122 Y128 F129	L102-A125 HydrophobicContact CB-CB 3.98Å; A103-A125 HydrophobicContact CB-CB 4.04Å; L121-A125 WeakPolarHBondContact O-CB 3.48Å; L121-A125 PolarHBondContact O-N 3.02Å; Y122-A125 PolarHBondContact O-N 3.14Å; A125-Y128 PolarHBondContact O-N 2.86Å; A125-F129 HydrophobicContact CB-CE2 4.49Å; A125-F129 WeakPolarHBondContact O-CD2 3.25Å; A125-F129 PolarHBondContact O-N 3.19Å
126	V	85.8	Confident	80.2	Confident	7 Å²	7	60 Å²	60	4%	0.042	27%	0.272	C	S	.	.	H	α-helix	trans	-64.1	-40.3	177.2	172.3	0	0	0	0	111.9	Y122 Q123 H124 Y128 F129 L130 C150 L154	Y122-V126 VanDerWaalsContact O-CG2 3.29Å; Y122-V126 WeakPolarHBondContact O-CG2 3.3Å; Y122-V126 PolarHBondContact O-N 3.28Å; Y122-V126 VanDerWaalsContact O-N 3.08Å; Q123-V126 PolarHBondContact O-N 3.17Å; H124-V126 VanDerWaalsContact C-N 3.32Å; H124-V126 PolarHBondContact O-N 3.43Å; V126-Y128 PolarHBondContact O-N 3.09Å; V126-F129 PolarHBondContact O-N 3.45Å; V126-L130 HydrophobicContact CG1-CD1 3.88Å; V126-L130 HydrophobicContact CG1-CG 4.29Å; V126-L130 WeakPolarHBondContact O-CB 3.43Å; V126-L130 VanDerWaalsContact O-CG 3.3Å; V126-L130 WeakPolarHBondContact O-CG 3.49Å; V126-L130 PolarHBondContact O-N 3.44Å; V126-C150 HydrophobicContact CG1-CB 4.49Å; V126-L154 HydrophobicContact CG1-CD1 4.12Å; V126-L154 HydrophobicContact CG1-CD2 4.05Å; V126-L154 HydrophobicContact CG1-CG 4Å; V126-L154 HydrophobicContact CG2-CD2 4.31Å; V126-L154 HydrophobicContact CG2-CG 4.07Å
127	Q	82.6	Confident	78.7	Confident	123 Å²	123	55.9 Å²	55.9	58%	0.575	25%	0.253	S	S	*	.	H	α-helix	trans	-60.1	-44.6	175.9	-74.1	178	1.2	0	0	111.9	Q123 H124 L130 H131	Q123-Q127 WeakPolarHBondContact O-CG 3.41Å; Q123-Q127 PolarHBondContact O-N 3.06Å; Q123-Q127 VanDerWaalsContact O-N 3.12Å; H124-Q127 PolarHBondContact O-N 3.45Å; Q127-L130 PolarHBondContact O-N 3.45Å; Q127-H131 PolarHBondContact O-N 3.29Å
128	Y	80.9	Confident	77.3	Confident	87 Å²	87	63 Å²	63	34%	0.341	29%	0.286	S	S	.	.	H	α-helix	trans	-67.1	-40.6	176.3	-78	-74.9	0	0	0	112.5	L102 H124 A125 V126 L130 H131 V132	L102-Y128 HydrophobicContact CD1-CD2 3.62Å; L102-Y128 HydrophobicContact CD1-CE2 3.78Å; H124-Y128 VanDerWaalsContact O-CD2 3.25Å; H124-Y128 WeakPolarHBondContact O-CD2 3.4Å; H124-Y128 PolarHBondContact O-N 2.84Å; H124-Y128 VanDerWaalsContact O-N 3.13Å; A125-Y128 PolarHBondContact O-N 2.86Å; V126-Y128 PolarHBondContact O-N 3.09Å; Y128-L130 VanDerWaalsContact C-N 3.33Å; Y128-L130 PolarHBondContact O-N 3.48Å; Y128-H131 WeakPolarHBondContact O-CB 3.31Å; Y128-H131 PolarHBondContact O-N 3.11Å; Y128-V132 WeakPolarHBondContact O-CG2 3.49Å; Y128-V132 PolarHBondContact O-N 3.06Å
129	F	81.4	Confident	76.1	Confident	2 Å²	2	64.6 Å²	64.6	1%	0.009	30%	0.303	C	S	.	.	H	α-helix	trans	-63.4	-37.1	174.9	-78.9	-58.9	0	0	0	113	Y96 A99 I100 A103 A125 V126 H131 V132 V133 I146 C150 Y153	Y96-F129 HydrophobicContact CD2-CD1 4.29Å; Y96-F129 HydrophobicContact CD2-CE1 4.09Å; Y96-F129 HydrophobicContact CE2-CD1 4.17Å; Y96-F129 AromaticContact CE2-CE1 3.77Å; Y96-F129 HydrophobicContact CE2-CE1 3.77Å; A99-F129 HydrophobicContact CB-CD1 3.71Å; A99-F129 HydrophobicContact CB-CD2 3.98Å; A99-F129 HydrophobicContact CB-CE1 3.62Å; A99-F129 HydrophobicContact CB-CE2 3.87Å; A99-F129 HydrophobicContact CB-CG 3.88Å; A99-F129 HydrophobicContact CB-CZ 3.7Å; I100-F129 HydrophobicContact CG1-CE1 4.18Å; I100-F129 HydrophobicContact CG1-CZ 4.01Å; A103-F129 HydrophobicContact CB-CE2 4.16Å; A125-F129 HydrophobicContact CB-CE2 4.49Å; A125-F129 WeakPolarHBondContact O-CD2 3.25Å; A125-F129 PolarHBondContact O-N 3.19Å; V126-F129 PolarHBondContact O-N 3.45Å; F129-H131 VanDerWaalsContact C-N 3.35Å; F129-V132 PolarHBondContact O-N 3.32Å; F129-V133 VanDerWaalsContact O-CG2 3.3Å; F129-V133 WeakPolarHBondContact O-CG2 3.35Å; F129-V133 PolarHBondContact O-N 3.39Å; F129-I146 HydrophobicContact CB-CG2 3.85Å; F129-I146 HydrophobicContact CD1-CG2 3.66Å; F129-I146 HydrophobicContact CG-CG2 4.07Å; F129-C150 WeakPolarHBondContact CB-SG 3.42Å; F129-Y153 HydrophobicContact CD2-CD2 4.32Å; F129-Y153 HydrophobicContact CD2-CE2 4.23Å; F129-Y153 HydrophobicContact CE2-CD2 4.13Å; F129-Y153 AromaticContact CE2-CE2 3.63Å; F129-Y153 HydrophobicContact CE2-CE2 3.63Å; F129-Y153 HydrophobicContact CZ-CE2 4.38Å
130	L	78.3	Confident	74.9	Confident	92 Å²	92	69.5 Å²	69.5	48%	0.482	33%	0.329	S	S	.	.	H	α-helix	trans	-67.5	-36.1	174.6	-72.6	170.5	0	0	0	111.9	V126 Q127 Y128 V133 K134	V126-L130 HydrophobicContact CG1-CD1 3.88Å; V126-L130 HydrophobicContact CG1-CG 4.29Å; V126-L130 WeakPolarHBondContact O-CB 3.43Å; V126-L130 VanDerWaalsContact O-CG 3.3Å; V126-L130 WeakPolarHBondContact O-CG 3.49Å; V126-L130 PolarHBondContact O-N 3.44Å; Q127-L130 PolarHBondContact O-N 3.45Å; Y128-L130 VanDerWaalsContact C-N 3.33Å; Y128-L130 PolarHBondContact O-N 3.48Å; L130-V133 PolarHBondContact O-N 3.01Å; L130-K134 WeakPolarHBondContact O-CB 3.31Å; L130-K134 PolarHBondContact O-N 3.06Å; L130-K134 VanDerWaalsContact O-N 3.07Å
131	H	76.3	Confident	74.1	Confident	71 Å²	71	71.9 Å²	71.9	33%	0.329	34%	0.343	S	S	.	.	H	α-helix	trans	-61.8	-48.3	173	-163.1	-99.7	0	0	0	111.1	E95 Q127 Y128 F129 V133 K134 Y135	E95-H131 IonicContact OE1-CE1 3.02Å; E95-H131 IonicContact OE1-ND1 3.62Å; E95-H131 IonicContact OE2-CE1 3.39Å; E95-H131 PolarHBondContact OE2-CE1 3.04Å; E95-H131 IonicContact OE2-CG 3.24Å; E95-H131 IonicContact OE2-ND1 2.64Å; E95-H131 PolarHBondContact OE2-ND1 3.29Å; Q127-H131 PolarHBondContact O-N 3.29Å; Y128-H131 WeakPolarHBondContact O-CB 3.31Å; Y128-H131 PolarHBondContact O-N 3.11Å; F129-H131 VanDerWaalsContact C-N 3.35Å; H131-V133 PolarHBondContact O-N 2.97Å; H131-K134 WeakPolarHBondContact O-CB 3.34Å; H131-K134 PolarHBondContact O-N 3.15Å; H131-K134 VanDerWaalsContact O-N 3.08Å; H131-Y135 AromaticContact CD2-CD2 3.77Å; H131-Y135 AromaticContact CD2-CE2 3.55Å; H131-Y135 AromaticContact CE1-CD2 3.63Å; H131-Y135 AromaticContact CE1-CE2 3.88Å; H131-Y135 AromaticContact CG-CD2 3.96Å; H131-Y135 AromaticContact ND1-CD2 3.86Å; H131-Y135 AromaticContact NE2-CD2 3.55Å; H131-Y135 AromaticContact NE2-CE2 3.31Å; H131-Y135 VanDerWaalsContact NE2-CE2 3.31Å; H131-Y135 WeakPolarHBondContact NE2-CE2 3.49Å; H131-Y135 VanDerWaalsContact O-CD2 3.27Å; H131-Y135 WeakPolarHBondContact O-CD2 3.42Å; H131-Y135 PolarHBondContact O-N 3.02Å
132	V	74.9	Confident	73.1	Confident	3 Å²	3	73.3 Å²	73.3	2%	0.018	36%	0.358	C	S	.	.	H	α-helix	trans	-60.9	-41.3	176.8	172.6	0	0	0	0	112.1	E95 Y96 Y128 F129 K134 Y135 E136 I146	E95-V132 HydrophobicContact CB-CG2 4.15Å; Y96-V132 HydrophobicContact CD2-CB 4.5Å; Y96-V132 HydrophobicContact CD2-CG1 3.83Å; Y96-V132 HydrophobicContact CD2-CG2 4.39Å; Y96-V132 HydrophobicContact CG-CG1 4.35Å; Y128-V132 WeakPolarHBondContact O-CG2 3.49Å; Y128-V132 PolarHBondContact O-N 3.06Å; F129-V132 PolarHBondContact O-N 3.32Å; V132-K134 VanDerWaalsContact C-N 3.26Å; V132-K134 PolarHBondContact O-N 3.16Å; V132-Y135 PolarHBondContact O-N 3.43Å; V132-E136 HydrophobicContact CG1-CB 4.1Å; V132-E136 WeakPolarHBondContact CG1-OE2 3.43Å; V132-E136 WeakPolarHBondContact O-CB 3.42Å; V132-E136 PolarHBondContact O-N 3.03Å; V132-I146 HydrophobicContact CG1-CD1 4.26Å
133	V	75.7	Confident	72.3	Confident	12 Å²	12	75.2 Å²	75.2	7%	0.073	37%	0.366	C	S	.	.	H	α-helix	trans	-63.4	-33.4	176	168.7	0	0	0	0	112.2	F129 L130 H131 K143 I146	F129-V133 VanDerWaalsContact O-CG2 3.3Å; F129-V133 WeakPolarHBondContact O-CG2 3.35Å; F129-V133 PolarHBondContact O-N 3.39Å; L130-V133 PolarHBondContact O-N 3.01Å; H131-V133 PolarHBondContact O-N 2.97Å; V133-K143 HydrophobicContact CG1-CG 4.42Å; V133-I146 HydrophobicContact CG2-CB 3.81Å; V133-I146 HydrophobicContact CG2-CD1 4.44Å; V133-I146 HydrophobicContact CG2-CG2 3.46Å; V133-I146 VanDerWaalsContact CG2-CG2 3.46Å
134	K	71.2	Confident	71.9	Confident	152 Å²	152	77.3 Å²	77.3	66%	0.661	38%	0.376	S	S	*	.	H	α-helix	trans	-75.3	-36.3	-179.3	-172.8	177.8	175.5	-161	0	112.4	L130 H131 V132	L130-K134 WeakPolarHBondContact O-CB 3.31Å; L130-K134 PolarHBondContact O-N 3.06Å; L130-K134 VanDerWaalsContact O-N 3.07Å; H131-K134 WeakPolarHBondContact O-CB 3.34Å; H131-K134 PolarHBondContact O-N 3.15Å; H131-K134 VanDerWaalsContact O-N 3.08Å; V132-K134 VanDerWaalsContact C-N 3.26Å; V132-K134 PolarHBondContact O-N 3.16Å
135	Y	64.3	Low	71.4	Confident	130 Å²	130	76.4 Å²	76.4	51%	0.51	38%	0.379	S	S	.	.	H	α-helix	trans	-113.2	-22.1	-168.6	-65.8	-74.6	0	0	0	116	H131 V132	H131-Y135 AromaticContact CD2-CD2 3.77Å; H131-Y135 AromaticContact CD2-CE2 3.55Å; H131-Y135 AromaticContact CE1-CD2 3.63Å; H131-Y135 AromaticContact CE1-CE2 3.88Å; H131-Y135 AromaticContact CG-CD2 3.96Å; H131-Y135 AromaticContact ND1-CD2 3.86Å; H131-Y135 AromaticContact NE2-CD2 3.55Å; H131-Y135 AromaticContact NE2-CE2 3.31Å; H131-Y135 VanDerWaalsContact NE2-CE2 3.31Å; H131-Y135 WeakPolarHBondContact NE2-CE2 3.49Å; H131-Y135 VanDerWaalsContact O-CD2 3.27Å; H131-Y135 WeakPolarHBondContact O-CD2 3.42Å; H131-Y135 PolarHBondContact O-N 3.02Å; V132-Y135 PolarHBondContact O-N 3.43Å
136	E	62.8	Low	71.1	Confident	61 Å²	61	77 Å²	77	29%	0.285	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.8	-32.8	-167.5	-160.5	171	-141	0	0	115.7	T92 E93 V132 Q138	T92-E136 WeakPolarHBondContact CB-OE1 3.13Å; T92-E136 HydrophobicContact CG2-CB 4.32Å; T92-E136 HydrophobicContact CG2-CG 4.49Å; T92-E136 WeakPolarHBondContact OG1-CG 3.47Å; T92-E136 PolarHBondContact OG1-OE1 3.01Å; E93-E136 WeakPolarHBondContact CA-OE1 3.35Å; E93-E136 PolarHBondContact N-OE1 3.2Å; V132-E136 HydrophobicContact CG1-CB 4.1Å; V132-E136 WeakPolarHBondContact CG1-OE2 3.43Å; V132-E136 WeakPolarHBondContact O-CB 3.42Å; V132-E136 PolarHBondContact O-N 3.03Å; E136-Q138 PolarHBondContact O-N 3.36Å
137	A	51.6	Low	70.8	Confident	18 Å²	18	83.4 Å²	83.4	15%	0.149	41%	0.406	C	S	.	.			trans	-82.4	93.7	-162.8	0	0	0	0	0	114.3	G139 K143	A137-G139 VanDerWaalsContact C-N 3.27Å; A137-G139 PolarHBondContact O-N 3.01Å; A137-G139 VanDerWaalsContact O-N 3.09Å; A137-K143 HydrophobicContact CB-CD 4.11Å; A137-K143 HydrophobicContact CB-CG 3.38Å; A137-K143 WeakPolarHBondContact O-CE 3.45Å; A137-K143 PolarHBondContact O-NZ 3.23Å
138	Q	53.8	Low	70.8	Confident	205 Å²	205	80.5 Å²	80.5	96%	0.958	40%	0.402	S	S	*	.			trans	-74.7	80.5	156.1	-67.9	-165.8	-4.8	0	0	109.3	E136	E136-Q138 PolarHBondContact O-N 3.36Å
139	G	59.8	Low	70.7	Confident	34 Å²	34	80 Å²	80	35%	0.351	40%	0.402	S	S	.	.	S	Bend	trans	155.7	119.3	173.7	0	0	0	0	0	113.6	A137 K141 A142 K143	A137-G139 VanDerWaalsContact C-N 3.27Å; A137-G139 PolarHBondContact O-N 3.01Å; A137-G139 VanDerWaalsContact O-N 3.09Å; G139-K141 VanDerWaalsContact C-N 3.27Å; G139-K141 PolarHBondContact O-N 3.19Å; G139-A142 PolarHBondContact O-N 3.44Å; G139-K143 PolarHBondContact O-N 2.93Å
140	D	62	Low	70.7	Confident	126 Å²	126	80.2 Å²	80.2	67%	0.674	40%	0.404	S	S	*	.	H	α-helix	trans	-61.6	-31.3	-175.2	-72.4	-38.6	0	0	0	113.8	Q144	D140-Q144 VanDerWaalsContact O-CG 3.3Å; D140-Q144 WeakPolarHBondContact O-CG 3.49Å; D140-Q144 PolarHBondContact O-N 3.48Å; D140-Q144 VanDerWaalsContact O-N 3.1Å
141	K	69.1	Low	70.9	Confident	183 Å²	183	78.7 Å²	78.7	80%	0.796	40%	0.404	S	S	*	.	H	α-helix	trans	-69.3	-38.2	178.8	-70.3	-176.5	179	178.2	0	113.1	G139 Q144 S145	G139-K141 VanDerWaalsContact C-N 3.27Å; G139-K141 PolarHBondContact O-N 3.19Å; K141-Q144 PolarHBondContact O-N 3.39Å; K141-S145 PolarHBondContact O-N 3.44Å; K141-S145 VanDerWaalsContact O-N 3.1Å
142	A	64.6	Low	71.3	Confident	52 Å²	52	81.5 Å²	81.5	43%	0.43	42%	0.418	S	S	.	.	H	α-helix	trans	-70	-40.5	178.1	0	0	0	0	0	111.2	G139 Q144 S145 I146	G139-A142 PolarHBondContact O-N 3.44Å; A142-Q144 VanDerWaalsContact C-N 3.33Å; A142-Q144 PolarHBondContact O-N 3.29Å; A142-S145 PolarHBondContact O-N 2.93Å; A142-I146 WeakPolarHBondContact O-CG1 2.98Å; A142-I146 PolarHBondContact O-N 3.47Å
143	K	70.3	Confident	71.8	Confident	56 Å²	56	83.5 Å²	83.5	24%	0.243	43%	0.425	C	S	.	.	H	α-helix	trans	-59.5	-42.5	173	-71.7	-177	173.2	158.4	0	112.2	V133 A137 G139 R147	V133-K143 HydrophobicContact CG1-CG 4.42Å; A137-K143 HydrophobicContact CB-CD 4.11Å; A137-K143 HydrophobicContact CB-CG 3.38Å; A137-K143 WeakPolarHBondContact O-CE 3.45Å; A137-K143 PolarHBondContact O-NZ 3.23Å; G139-K143 PolarHBondContact O-N 2.93Å; K143-R147 VanDerWaalsContact O-CB 3.31Å; K143-R147 WeakPolarHBondContact O-CB 3.35Å; K143-R147 VanDerWaalsContact O-CG 3.24Å; K143-R147 WeakPolarHBondContact O-CG 3.36Å; K143-R147 PolarHBondContact O-N 3.24Å
144	Q	75.9	Confident	72.2	Confident	127 Å²	127	86.7 Å²	86.7	59%	0.593	44%	0.441	S	S	*	.	H	α-helix	trans	-64.8	-42.7	178	-75.3	173	6.2	0	0	111.8	D140 K141 A142 R147 A148	D140-Q144 VanDerWaalsContact O-CG 3.3Å; D140-Q144 WeakPolarHBondContact O-CG 3.49Å; D140-Q144 PolarHBondContact O-N 3.48Å; D140-Q144 VanDerWaalsContact O-N 3.1Å; K141-Q144 PolarHBondContact O-N 3.39Å; A142-Q144 VanDerWaalsContact C-N 3.33Å; A142-Q144 PolarHBondContact O-N 3.29Å; Q144-R147 PolarHBondContact O-N 3.43Å; Q144-A148 WeakPolarHBondContact O-CB 3.4Å; Q144-A148 PolarHBondContact O-N 3.04Å
145	S	74.9	Confident	72.9	Confident	64 Å²	64	83 Å²	83	45%	0.448	43%	0.429	S	S	.	.	H	α-helix	trans	-63	-43.5	176.8	-174.3	0	0	0	0	112.5	K141 A142 A148 K149	K141-S145 PolarHBondContact O-N 3.44Å; K141-S145 VanDerWaalsContact O-N 3.1Å; A142-S145 PolarHBondContact O-N 2.93Å; S145-A148 PolarHBondContact O-N 2.99Å; S145-K149 PolarHBondContact O-N 3.35Å; S145-K149 VanDerWaalsContact O-N 3.17Å
146	I	77.6	Confident	73.8	Confident	12 Å²	12	81.1 Å²	81.1	6%	0.062	42%	0.421	C	S	.	.	H	α-helix	trans	-69.1	-39.9	178.2	-61.8	167.4	0	0	0	111.3	Y96 F129 V132 V133 A142 A148 K149 C150	Y96-I146 HydrophobicContact CD2-CD1 4.42Å; Y96-I146 HydrophobicContact CE2-CD1 3.85Å; Y96-I146 HydrophobicContact CE2-CG1 4.1Å; F129-I146 HydrophobicContact CB-CG2 3.85Å; F129-I146 HydrophobicContact CD1-CG2 3.66Å; F129-I146 HydrophobicContact CG-CG2 4.07Å; V132-I146 HydrophobicContact CG1-CD1 4.26Å; V133-I146 HydrophobicContact CG2-CB 3.81Å; V133-I146 HydrophobicContact CG2-CD1 4.44Å; V133-I146 HydrophobicContact CG2-CG2 3.46Å; V133-I146 VanDerWaalsContact CG2-CG2 3.46Å; A142-I146 WeakPolarHBondContact O-CG1 2.98Å; A142-I146 PolarHBondContact O-N 3.47Å; I146-A148 VanDerWaalsContact C-N 3.35Å; I146-A148 PolarHBondContact O-N 2.77Å; I146-K149 PolarHBondContact O-N 3.08Å; I146-C150 PolarHBondContact O-N 2.92Å; I146-C150 PolarHBondContact O-SG 2.75Å
147	R	79.1	Confident	74.8	Confident	142 Å²	142	78.6 Å²	78.6	54%	0.536	41%	0.41	S	S	.	.	H	α-helix	trans	-63.7	-38.2	175.1	-76.5	176.2	-178.6	156	0.8	112.6	K143 Q144 C150 A151	K143-R147 VanDerWaalsContact O-CB 3.31Å; K143-R147 WeakPolarHBondContact O-CB 3.35Å; K143-R147 VanDerWaalsContact O-CG 3.24Å; K143-R147 WeakPolarHBondContact O-CG 3.36Å; K143-R147 PolarHBondContact O-N 3.24Å; Q144-R147 PolarHBondContact O-N 3.43Å; R147-C150 PolarHBondContact O-N 3.13Å; R147-A151 PolarHBondContact O-N 2.86Å
148	A	82.5	Confident	76.2	Confident	61 Å²	61	83.7 Å²	83.7	50%	0.504	43%	0.431	S	S	.	.	H	α-helix	trans	-62	-44.3	175	0	0	0	0	0	111.4	Q144 S145 I146 A151 E152	Q144-A148 WeakPolarHBondContact O-CB 3.4Å; Q144-A148 PolarHBondContact O-N 3.04Å; S145-A148 PolarHBondContact O-N 2.99Å; I146-A148 VanDerWaalsContact C-N 3.35Å; I146-A148 PolarHBondContact O-N 2.77Å; A148-A151 PolarHBondContact O-N 3.39Å; A148-E152 PolarHBondContact O-N 3.32Å; A148-E152 VanDerWaalsContact O-N 3.1Å
149	K	78.5	Confident	77.8	Confident	77 Å²	77	79.3 Å²	79.3	34%	0.335	41%	0.409	S	S	.	.	H	α-helix	trans	-64	-39.2	174.4	-69.8	-178	179.6	-177	0	112.9	S145 I146 A151 E152 Y153	S145-K149 PolarHBondContact O-N 3.35Å; S145-K149 VanDerWaalsContact O-N 3.17Å; I146-K149 PolarHBondContact O-N 3.08Å; K149-A151 VanDerWaalsContact C-N 3.31Å; K149-A151 PolarHBondContact O-N 2.88Å; K149-E152 PolarHBondContact O-N 3.5Å; K149-Y153 HydrophobicContact CB-CE2 4.12Å; K149-Y153 WeakPolarHBondContact O-CD2 3.07Å; K149-Y153 PolarHBondContact O-N 2.93Å
150	C	81.4	Confident	78.9	Confident	6 Å²	6	77.8 Å²	77.8	4%	0.041	39%	0.393	C	S	.	.	H	α-helix	trans	-60.8	-42.1	174.8	-66.8	0	0	0	0	111.8	V126 F129 I146 R147 E152 Y153 L154	V126-C150 HydrophobicContact CG1-CB 4.49Å; F129-C150 WeakPolarHBondContact CB-SG 3.42Å; I146-C150 PolarHBondContact O-N 2.92Å; I146-C150 PolarHBondContact O-SG 2.75Å; R147-C150 PolarHBondContact O-N 3.13Å; C150-E152 VanDerWaalsContact C-N 3.34Å; C150-Y153 PolarHBondContact O-N 2.62Å; C150-L154 WeakPolarHBondContact O-CB 3.29Å; C150-L154 VanDerWaalsContact O-CG 3.27Å; C150-L154 WeakPolarHBondContact O-CG 3.32Å; C150-L154 PolarHBondContact O-N 2.9Å
151	A	82.3	Confident	80	Confident	60 Å²	60	76.5 Å²	76.5	50%	0.496	38%	0.381	S	S	.	.	H	α-helix	trans	-63.5	-40.7	177.6	0	0	0	0	0	111.8	R147 A148 K149 L154 D155	R147-A151 PolarHBondContact O-N 2.86Å; A148-A151 PolarHBondContact O-N 3.39Å; K149-A151 VanDerWaalsContact C-N 3.31Å; K149-A151 PolarHBondContact O-N 2.88Å; A151-L154 PolarHBondContact O-N 3.08Å; A151-D155 WeakPolarHBondContact O-CB 2.95Å; A151-D155 PolarHBondContact O-N 3.5Å
152	E	84.9	Confident	80.6	Confident	130 Å²	130	72 Å²	72	61%	0.607	37%	0.365	S	S	*	.	H	α-helix	trans	-63.1	-45.3	175.8	-171.4	-177.8	172.6	0	0	112.2	A148 K149 C150 D155 R156	A148-E152 PolarHBondContact O-N 3.32Å; A148-E152 VanDerWaalsContact O-N 3.1Å; K149-E152 PolarHBondContact O-N 3.5Å; C150-E152 VanDerWaalsContact C-N 3.34Å; E152-D155 PolarHBondContact O-N 3.17Å; E152-R156 PolarHBondContact O-N 2.67Å
153	Y	86.3	Confident	81.4	Confident	45 Å²	45	75.1 Å²	75.1	18%	0.176	37%	0.367	C	S	.	.	H	α-helix	trans	-68.4	-34.7	178	-62.2	-34.8	0	0	0	112.9	A103 Y122 F129 K149 C150 A157	A103-Y153 HydrophobicContact CB-CD2 4.47Å; A103-Y153 HydrophobicContact CB-CE1 4.37Å; A103-Y153 HydrophobicContact CB-CE2 3.77Å; Y122-Y153 AromaticContact CD1-CD1 3.83Å; Y122-Y153 HydrophobicContact CD1-CD1 3.83Å; Y122-Y153 HydrophobicContact CD1-CG 4.03Å; Y122-Y153 AromaticContact CE1-CD1 3.55Å; Y122-Y153 HydrophobicContact CE1-CD1 3.55Å; Y122-Y153 HydrophobicContact CE1-CE1 4.14Å; Y122-Y153 HydrophobicContact CE1-CG 4.23Å; F129-Y153 HydrophobicContact CD2-CD2 4.32Å; F129-Y153 HydrophobicContact CD2-CE2 4.23Å; F129-Y153 HydrophobicContact CE2-CD2 4.13Å; F129-Y153 AromaticContact CE2-CE2 3.63Å; F129-Y153 HydrophobicContact CE2-CE2 3.63Å; F129-Y153 HydrophobicContact CZ-CE2 4.38Å; K149-Y153 HydrophobicContact CB-CE2 4.12Å; K149-Y153 WeakPolarHBondContact O-CD2 3.07Å; K149-Y153 PolarHBondContact O-N 2.93Å; C150-Y153 PolarHBondContact O-N 2.62Å; Y153-A157 VanDerWaalsContact O-CB 3.29Å; Y153-A157 WeakPolarHBondContact O-CB 3.5Å; Y153-A157 PolarHBondContact O-N 3.24Å
154	L	84.6	Confident	81.9	Confident	79 Å²	79	73.3 Å²	73.3	41%	0.414	36%	0.36	S	S	.	.	H	α-helix	trans	-67.4	-45.2	174.6	-77	169.7	0	0	0	112	V126 C150 A151 R156 A157 E158	V126-L154 HydrophobicContact CG1-CD1 4.12Å; V126-L154 HydrophobicContact CG1-CD2 4.05Å; V126-L154 HydrophobicContact CG1-CG 4Å; V126-L154 HydrophobicContact CG2-CD2 4.31Å; V126-L154 HydrophobicContact CG2-CG 4.07Å; C150-L154 WeakPolarHBondContact O-CB 3.29Å; C150-L154 VanDerWaalsContact O-CG 3.27Å; C150-L154 WeakPolarHBondContact O-CG 3.32Å; C150-L154 PolarHBondContact O-N 2.9Å; A151-L154 PolarHBondContact O-N 3.08Å; L154-R156 VanDerWaalsContact C-N 3.3Å; L154-R156 PolarHBondContact O-N 3.38Å; L154-A157 WeakPolarHBondContact O-CB 3.4Å; L154-A157 PolarHBondContact O-N 3.17Å; L154-E158 PolarHBondContact O-N 2.87Å
155	D	84.1	Confident	82	Confident	75 Å²	75	72.5 Å²	72.5	40%	0.401	36%	0.355	S	S	.	.	H	α-helix	trans	-60.9	-40.2	176.1	176.2	70.2	0	0	0	111.4	A151 E152 E158 K159	A151-D155 WeakPolarHBondContact O-CB 2.95Å; A151-D155 PolarHBondContact O-N 3.5Å; E152-D155 PolarHBondContact O-N 3.17Å; D155-E158 PolarHBondContact O-N 2.92Å; D155-K159 WeakPolarHBondContact O-CG 3.38Å; D155-K159 PolarHBondContact O-N 3.05Å; D155-K159 VanDerWaalsContact O-N 3.11Å; D155-K159 IonicContact OD1-NZ 3.24Å; D155-K159 VanDerWaalsContact OD2-CE 3.31Å; D155-K159 WeakPolarHBondContact OD2-CE 3.49Å; D155-K159 IonicContact OD2-NZ 3.99Å; D155-K159 PolarHBondContact OD2-NZ 3.47Å
156	R	84.8	Confident	82.2	Confident	91 Å²	91	77.1 Å²	77.1	34%	0.343	37%	0.366	S	S	.	.	H	α-helix	trans	-66.2	-42.5	174.6	-172.4	59	179.6	155.8	5.3	112.3	D110 Y122 E152 L154 E158 K159 L160	D110-R156 IonicContact OD1-CZ 2.64Å; D110-R156 IonicContact OD1-NE 2.91Å; D110-R156 IonicContact OD1-NH2 3.19Å; D110-R156 PolarHBondContact OD1-NH2 3.04Å; D110-R156 IonicContact OD2-CZ 2.72Å; D110-R156 VanDerWaalsContact OD2-CZ 3.22Å; D110-R156 IonicContact OD2-NE 3.82Å; D110-R156 PolarHBondContact OD2-NE 3.13Å; D110-R156 IonicContact OD2-NH2 3.55Å; D110-R156 PolarHBondContact OD2-NH2 2.98Å; Y122-R156 HydrophobicContact CE2-CG 3.97Å; E152-R156 PolarHBondContact O-N 2.67Å; L154-R156 VanDerWaalsContact C-N 3.3Å; L154-R156 PolarHBondContact O-N 3.38Å; R156-E158 VanDerWaalsContact C-N 3.34Å; R156-E158 PolarHBondContact O-N 3.22Å; R156-K159 PolarHBondContact O-N 3.47Å; R156-L160 HydrophobicContact CG-CD1 4.47Å; R156-L160 WeakPolarHBondContact O-CG 3.41Å; R156-L160 PolarHBondContact O-N 3.3Å
157	A	82.6	Confident	81.9	Confident	7 Å²	7	82.8 Å²	82.8	6%	0.058	39%	0.391	C	S	.	.	H	α-helix	trans	-61.8	-39.2	176.8	0	0	0	0	0	112.2	L119 Y153 L154 L160 K161	L119-A157 HydrophobicContact CD1-CB 3.78Å; L119-A157 WeakPolarHBondContact CD1-O 3.47Å; Y153-A157 VanDerWaalsContact O-CB 3.29Å; Y153-A157 WeakPolarHBondContact O-CB 3.5Å; Y153-A157 PolarHBondContact O-N 3.24Å; L154-A157 WeakPolarHBondContact O-CB 3.4Å; L154-A157 PolarHBondContact O-N 3.17Å; A157-L160 PolarHBondContact O-N 3.33Å; A157-K161 WeakPolarHBondContact O-CB 3.08Å; A157-K161 PolarHBondContact O-N 2.72Å
158	E	82	Confident	81	Confident	126 Å²	126	84 Å²	84	59%	0.589	40%	0.402	S	S	*	.	H	α-helix	trans	-64.9	-44.4	175	-75.3	-177.7	174.7	0	0	111.9	L154 D155 R156 L160 K161 D162	L154-E158 PolarHBondContact O-N 2.87Å; D155-E158 PolarHBondContact O-N 2.92Å; R156-E158 VanDerWaalsContact C-N 3.34Å; R156-E158 PolarHBondContact O-N 3.22Å; E158-L160 VanDerWaalsContact C-N 3.33Å; E158-L160 PolarHBondContact O-N 3.15Å; E158-K161 WeakPolarHBondContact O-CB 3.34Å; E158-K161 PolarHBondContact O-N 3.35Å; E158-D162 PolarHBondContact O-N 3.22Å
159	K	87.1	Confident	79.9	Confident	112 Å²	112	89.8 Å²	89.8	49%	0.487	42%	0.416	S	S	.	.	H	α-helix	trans	-59.8	-40.9	174.9	-72.5	168.2	-179.6	165.4	0	112.6	D155 R156 Y163	D155-K159 WeakPolarHBondContact O-CG 3.38Å; D155-K159 PolarHBondContact O-N 3.05Å; D155-K159 VanDerWaalsContact O-N 3.11Å; D155-K159 IonicContact OD1-NZ 3.24Å; D155-K159 VanDerWaalsContact OD2-CE 3.31Å; D155-K159 WeakPolarHBondContact OD2-CE 3.49Å; D155-K159 IonicContact OD2-NZ 3.99Å; D155-K159 PolarHBondContact OD2-NZ 3.47Å; R156-K159 PolarHBondContact O-N 3.47Å; K159-Y163 WeakPolarHBondContact O-CB 3.41Å; K159-Y163 PolarHBondContact O-N 3.4Å
160	L	82.9	Confident	78.2	Confident	3 Å²	3	89.6 Å²	89.6	2%	0.016	43%	0.429	C	S	.	.	H	α-helix	trans	-66.8	-41.2	175.9	-72.3	178.5	0	0	0	111.9	Y115 A118 L119 Y122 R156 A157 E158 D162 Y163 L164	Y115-L160 HydrophobicContact CD1-CD2 3.33Å; Y115-L160 HydrophobicContact CE1-CD2 3.94Å; Y115-L160 HydrophobicContact CG-CD2 4Å; A118-L160 HydrophobicContact CB-CD1 4.06Å; L119-L160 HydrophobicContact CD1-CB 4.49Å; Y122-L160 HydrophobicContact CD2-CD1 4Å; Y122-L160 HydrophobicContact CE2-CD1 4.04Å; R156-L160 HydrophobicContact CG-CD1 4.47Å; R156-L160 WeakPolarHBondContact O-CG 3.41Å; R156-L160 PolarHBondContact O-N 3.3Å; A157-L160 PolarHBondContact O-N 3.33Å; E158-L160 VanDerWaalsContact C-N 3.33Å; E158-L160 PolarHBondContact O-N 3.15Å; L160-D162 VanDerWaalsContact C-N 3.35Å; L160-D162 PolarHBondContact O-N 3Å; L160-Y163 PolarHBondContact O-N 3.17Å; L160-L164 WeakPolarHBondContact O-CG 3.44Å; L160-L164 PolarHBondContact O-N 3.4Å
161	K	84.7	Confident	76.2	Confident	99 Å²	99	95 Å²	95	43%	0.43	46%	0.464	S	S	.	.	H	α-helix	trans	-62.8	-40.9	176.9	-172.1	178.7	-176.5	179.3	0	112	L119 A157 E158 L164 K165	L119-K161 HydrophobicContact CD1-CB 4.3Å; L119-K161 HydrophobicContact CD2-CB 4.26Å; A157-K161 WeakPolarHBondContact O-CB 3.08Å; A157-K161 PolarHBondContact O-N 2.72Å; E158-K161 WeakPolarHBondContact O-CB 3.34Å; E158-K161 PolarHBondContact O-N 3.35Å; K161-L164 PolarHBondContact O-N 2.76Å; K161-K165 WeakPolarHBondContact O-CB 3.36Å; K161-K165 WeakPolarHBondContact O-CG 3.21Å; K161-K165 PolarHBondContact O-N 3.38Å
162	D	81.4	Confident	74.4	Confident	87 Å²	87	98.3 Å²	98.3	47%	0.465	48%	0.48	S	S	.	.	H	α-helix	trans	-70.9	-35.2	176.4	-75.3	-14	0	0	0	112.3	E158 L160 K166	E158-D162 PolarHBondContact O-N 3.22Å; L160-D162 VanDerWaalsContact C-N 3.35Å; L160-D162 PolarHBondContact O-N 3Å; D162-K166 WeakPolarHBondContact O-CB 3.37Å; D162-K166 WeakPolarHBondContact O-CG 3.32Å; D162-K166 PolarHBondContact O-N 3.01Å
163	Y	81.5	Confident	71.9	Confident	119 Å²	119	97 Å²	97	47%	0.467	49%	0.492	S	S	.	.	H	α-helix	trans	-63.4	-44.9	172.4	-177.4	-97	0	0	0	111.9	Y115 K159 L160 K166 K167	Y115-Y163 AromaticContact CD2-CD1 3.86Å; Y115-Y163 HydrophobicContact CD2-CD1 3.86Å; Y115-Y163 AromaticContact CD2-CE1 3.55Å; Y115-Y163 HydrophobicContact CD2-CE1 3.55Å; Y115-Y163 HydrophobicContact CE2-CD1 4.09Å; Y115-Y163 AromaticContact CE2-CE1 3.46Å; Y115-Y163 HydrophobicContact CE2-CE1 3.46Å; Y115-Y163 VanDerWaalsContact CE2-CE1 3.46Å; Y115-Y163 HydrophobicContact CG-CD1 4.4Å; Y115-Y163 HydrophobicContact CG-CE1 4.49Å; K159-Y163 WeakPolarHBondContact O-CB 3.41Å; K159-Y163 PolarHBondContact O-N 3.4Å; L160-Y163 PolarHBondContact O-N 3.17Å; Y163-K166 PolarHBondContact O-N 2.75Å; Y163-K167 PolarHBondContact O-N 3.06Å
164	L	80.3	Confident	69.1	Low	18 Å²	18	104.9 Å²	104.9	9%	0.094	53%	0.527	C	S	.	.	H	α-helix	trans	-63.8	-43.7	176.3	-71.8	169.8	0	0	0	112	L119 L160 K161 K166 K167 E168	L119-L164 HydrophobicContact CD2-CD1 4.12Å; L160-L164 WeakPolarHBondContact O-CG 3.44Å; L160-L164 PolarHBondContact O-N 3.4Å; K161-L164 PolarHBondContact O-N 2.76Å; L164-K166 VanDerWaalsContact C-N 3.28Å; L164-K166 PolarHBondContact O-N 3.44Å; L164-K167 WeakPolarHBondContact O-CB 3.32Å; L164-K167 PolarHBondContact O-N 2.94Å; L164-K167 VanDerWaalsContact O-N 3.11Å; L164-E168 PolarHBondContact O-N 3.44Å
165	K	78.8	Confident	67.4	Low	110 Å²	110	106.5 Å²	106.5	48%	0.478	54%	0.542	S	S	.	.	H	α-helix	trans	-61.5	-33	174.1	-79.2	178.3	176.2	180	0	113.7	K161 K169	K161-K165 WeakPolarHBondContact O-CB 3.36Å; K161-K165 WeakPolarHBondContact O-CG 3.21Å; K161-K165 PolarHBondContact O-N 3.38Å; K165-K169 WeakPolarHBondContact O-CG 3.23Å
166	K	78.9	Confident	64.7	Low	160 Å²	160	109.8 Å²	109.8	70%	0.696	57%	0.565	S	S	*	*	H	α-helix	trans	-73.9	-35.7	174.3	-75.7	175.8	-178.4	179.2	0	111.5	D162 Y163 L164 K169	D162-K166 WeakPolarHBondContact O-CB 3.37Å; D162-K166 WeakPolarHBondContact O-CG 3.32Å; D162-K166 PolarHBondContact O-N 3.01Å; Y163-K166 PolarHBondContact O-N 2.75Å; L164-K166 VanDerWaalsContact C-N 3.28Å; L164-K166 PolarHBondContact O-N 3.44Å; K166-K169 PolarHBondContact O-N 3.24Å
167	K	70.5	Confident	61.9	Low	132 Å²	132	114.4 Å²	114.4	57%	0.574	59%	0.588	S	S	*	*	H	α-helix	trans	-67.9	-37.7	176.2	-168.4	179.8	176.8	-174.5	0	112.6	Y163 L164 K169	Y163-K167 PolarHBondContact O-N 3.06Å; L164-K167 WeakPolarHBondContact O-CB 3.32Å; L164-K167 PolarHBondContact O-N 2.94Å; L164-K167 VanDerWaalsContact O-N 3.11Å; K167-K169 PolarHBondContact O-N 3.24Å
168	E	60.5	Low	59.2	Low	166 Å²	166	122.5 Å²	122.5	78%	0.776	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.2	-18.1	175.5	-74.8	-175.8	150.7	0	0	113.8	L164	L164-E168 PolarHBondContact O-N 3.44Å
169	K	58.9	Low	56.5	Low	184 Å²	184	121.6 Å²	121.6	80%	0.8	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.5	4.2	-179.1	-74.3	-175.5	177.6	-174.1	0	114.8	K165 K166 K167	K165-K169 WeakPolarHBondContact O-CG 3.23Å; K166-K169 PolarHBondContact O-N 3.24Å; K167-K169 PolarHBondContact O-N 3.24Å
170	A	42.9	Very low	53.5	Low	72 Å²	72	125.2 Å²	125.2	60%	0.595	65%	0.65	S	S	*	*	S	Bend	trans	-99.6	129.8	176.6	0	0	0	0	0	112
171	P	40.5	Very low	50.8	Low	119 Å²	119	129.1 Å²	129.1	77%	0.773	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-77.6	159.5	176.9	31.3	-32.5	0	0	0	112.2
172	P	43.8	Very low	47.9	Very low	130 Å²	130	132 Å²	132	84%	0.844	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-90.2	129.2	-174.1	34.3	-29.5	0	0	0	111.7
173	A	33.1	Very low	45.3	Very low	104 Å²	104	133.6 Å²	133.6	86%	0.86	71%	0.711	S	S	*	*			trans	-162.5	152.6	151.2	0	0	0	0	0	113.5
174	K	27.4	Very low	42.7	Very low	209 Å²	209	136.6 Å²	136.6	91%	0.909	73%	0.727	S	S	*	*			trans	-73.7	175.6	-173.8	-97	-177	-177.6	178.6	0	114.3
175	P	48.2	Very low	40.1	Very low	113 Å²	113	139.2 Å²	139.2	73%	0.734	76%	0.758	S	S	*	*			trans	-100.1	146.9	-138.2	38	-33.5	0	0	0	114.4
176	V	27.1	Very low	37.7	Very low	145 Å²	145	142.1 Å²	142.1	88%	0.879	78%	0.779	S	S	*	*			trans	-151.1	142.9	152.7	-171.9	0	0	0	0	111.5
177	K	26.1	Very low	35.2	Very low	188 Å²	188	143.6 Å²	143.6	82%	0.817	79%	0.789	S	S	*	*			trans	-30.8	152.6	174.7	-70.3	171	168.8	179.3	0	121.4
178	E	26.3	Very low	33.3	Very low	177 Å²	177	142.8 Å²	142.8	83%	0.827	80%	0.8	S	S	*	*			trans	-14.1	133.2	147.5	-65	168.7	146.8	0	0	117.4
179	S	24.7	Very low	32.1	Very low	107 Å²	107	142.3 Å²	142.3	75%	0.748	80%	0.802	S	S	*	*				171.1	134.1	107.5	-71.9	0	0	0	0	113.2
180	Q	24.4	Very low	31	Very low	188 Å²	188	142.6 Å²	142.6	88%	0.879	81%	0.806	S	S	*	*			trans	54.9	116.7	139.8	-66.9	-179.1	2.9	0	0	123.4
181	A	27.1	Very low	30.7	Very low	84 Å²	84	142.2 Å²	142.2	69%	0.694	81%	0.81	S	S	*	*				74.4	143.5	116.4	0	0	0	0	0	123.6
182	D	24.4	Very low	30.9	Very low	161 Å²	161	142.4 Å²	142.4	86%	0.861	80%	0.804	S	S	*	*			trans	76.2	142.8	164.1	-59.4	-17.2	0	0	0	118.1
183	D	25	Very low	31.3	Very low	119 Å²	119	139.5 Å²	139.5	64%	0.636	78%	0.782	S	S	*	*			cis	-165.3	149.9	-15	178	29.5	0	0	0	104.6
184	K	28.3	Very low	32.4	Very low	183 Å²	183	139.3 Å²	139.3	80%	0.796	77%	0.772	S	S	*	*			trans	41.7	126.5	159	-82.9	164.4	-155.5	136.7	0	123.3
185	G	24.6	Very low	33.6	Very low	73 Å²	73	135.7 Å²	135.7	75%	0.753	76%	0.758	S	S	*	*			trans	-172.1	77.7	154.6	0	0	0	0	0	113	E187	G185-E187 PolarHBondContact O-N 2.72Å
186	N	28.1	Very low	33.9	Very low	171 Å²	171	137.2 Å²	137.2	91%	0.914	75%	0.753	S	S	*	*			trans	-6.6	110.6	161.5	-130.5	18.2	0	0	0	116.9
187	E	28	Very low	35.3	Very low	191 Å²	191	135 Å²	135	89%	0.893	73%	0.732	S	S	*	*			trans	-124.4	118.2	154	-88.5	-174.3	168.1	0	0	108.9	G185 D189	G185-E187 PolarHBondContact O-N 2.72Å; E187-D189 PolarHBondContact O-N 3.18Å
188	S	29.9	Very low	36.7	Very low	115 Å²	115	133.6 Å²	133.6	80%	0.804	73%	0.725	S	S	*	*			trans	-60.6	118	174.6	43.3	0	0	0	0	110.6	E190	S188-E190 PolarHBondContact O-N 2.95Å
189	D	35.3	Very low	37.9	Very low	156 Å²	156	126.5 Å²	126.5	83%	0.834	69%	0.692	S	S	*	*			trans	-58.3	104.6	164.2	-166	16	0	0	0	110	E187	E187-D189 PolarHBondContact O-N 3.18Å
190	E	35	Very low	39.3	Very low	189 Å²	189	126.8 Å²	126.8	88%	0.883	68%	0.681	S	S	*	*			trans	-108.8	113	157.9	-87.8	-161.4	168.6	0	0	108.7	S188	S188-E190 PolarHBondContact O-N 2.95Å
191	G	36.3	Very low	40.9	Very low	65 Å²	65	123.6 Å²	123.6	67%	0.67	67%	0.67	S	S	*	*			trans	-56.4	136.3	-168.3	0	0	0	0	0	114.8	D193	G191-D193 PolarHBondContact O-N 3.14Å
192	D	46.8	Very low	42.3	Very low	122 Å²	122	124 Å²	124	65%	0.652	66%	0.658	S	S	*	*			trans	-70	86	174.5	-151	-0.2	0	0	0	109.3	P194 K197	D192-P194 WeakPolarHBondContact O-CD 3.43Å; D192-K197 VanDerWaalsContact CG-NZ 3.32Å; D192-K197 VanDerWaalsContact OD1-CE 3.3Å; D192-K197 WeakPolarHBondContact OD1-CE 3.46Å; D192-K197 IonicContact OD1-NZ 2.63Å; D192-K197 WeakPolarHBondContact OD2-CE 3.49Å; D192-K197 IonicContact OD2-NZ 3.18Å; D192-K197 PolarHBondContact OD2-NZ 3.45Å
193	D	51.4	Low	43.7	Very low	70 Å²	70	116.8 Å²	116.8	37%	0.374	62%	0.619	S	S	.	*			trans	-60.5	117.1	-175.7	-179.1	10.2	0	0	0	111.7	G191 E195 K196 K197	G191-D193 PolarHBondContact O-N 3.14Å; D193-E195 PolarHBondContact O-N 3.31Å; D193-E195 VanDerWaalsContact O-N 3.16Å; D193-E195 PolarHBondContact OD1-N 3.25Å; D193-K196 HydrophobicContact CB-CB 4.31Å; D193-K196 WeakPolarHBondContact O-CB 3.38Å; D193-K196 PolarHBondContact O-N 3.38Å; D193-K197 PolarHBondContact O-N 3.41Å
194	P	56.1	Low	45.3	Very low	100 Å²	100	114.7 Å²	114.7	65%	0.649	61%	0.614	S	S	*	*	H	α-helix	trans	-61.1	-22.1	178.6	23.1	-32.3	0	0	0	113.2	D192 K198	D192-P194 WeakPolarHBondContact O-CD 3.43Å; P194-K198 WeakPolarHBondContact O-CB 3.44Å; P194-K198 PolarHBondContact O-N 3.25Å; P194-K198 VanDerWaalsContact O-N 3.14Å
195	E	53.2	Low	47	Very low	132 Å²	132	109.1 Å²	109.1	62%	0.617	61%	0.609	S	S	*	*	H	α-helix	trans	-70	-37.8	172.5	-67.4	-164.6	163.1	0	0	112.2	D193 K197 K198 F199	D193-E195 PolarHBondContact O-N 3.31Å; D193-E195 VanDerWaalsContact O-N 3.16Å; D193-E195 PolarHBondContact OD1-N 3.25Å; E195-K197 PolarHBondContact O-N 3.3Å; E195-K198 PolarHBondContact O-N 2.98Å; E195-F199 VanDerWaalsContact O-CB 3.25Å; E195-F199 WeakPolarHBondContact O-CB 3.48Å; E195-F199 PolarHBondContact O-N 3.33Å
196	K	53.2	Low	48.9	Very low	145 Å²	145	106.7 Å²	106.7	63%	0.63	58%	0.581	S	S	*	*	H	α-helix	trans	-61.4	-43	175	-99.8	180	177.4	174.8	0	111.7	D193 F199 Q200	D193-K196 HydrophobicContact CB-CB 4.31Å; D193-K196 WeakPolarHBondContact O-CB 3.38Å; D193-K196 PolarHBondContact O-N 3.38Å; K196-F199 PolarHBondContact O-N 2.93Å; K196-Q200 VanDerWaalsContact O-CB 3.29Å; K196-Q200 WeakPolarHBondContact O-CB 3.42Å; K196-Q200 VanDerWaalsContact O-CG 3.29Å; K196-Q200 WeakPolarHBondContact O-CG 3.44Å; K196-Q200 PolarHBondContact O-N 3.33Å
197	K	57.1	Low	50.9	Low	100 Å²	100	98.8 Å²	98.8	44%	0.435	54%	0.539	S	S	.	.	H	α-helix	trans	-67.9	-41.8	177.6	-78.8	-178.6	-178.1	167.4	0	112.6	D192 D193 E195 F199 Q200 N201	D192-K197 VanDerWaalsContact CG-NZ 3.32Å; D192-K197 VanDerWaalsContact OD1-CE 3.3Å; D192-K197 WeakPolarHBondContact OD1-CE 3.46Å; D192-K197 IonicContact OD1-NZ 2.63Å; D192-K197 WeakPolarHBondContact OD2-CE 3.49Å; D192-K197 IonicContact OD2-NZ 3.18Å; D192-K197 PolarHBondContact OD2-NZ 3.45Å; D193-K197 PolarHBondContact O-N 3.41Å; E195-K197 PolarHBondContact O-N 3.3Å; K197-F199 VanDerWaalsContact C-N 3.32Å; K197-F199 PolarHBondContact O-N 3.31Å; K197-Q200 PolarHBondContact O-N 2.8Å; K197-N201 PolarHBondContact O-N 3.48Å
198	K	56	Low	53.2	Low	157 Å²	157	93.4 Å²	93.4	68%	0.683	52%	0.519	S	S	*	.	H	α-helix	trans	-64.9	-38.8	176.8	-165	176.7	-179	-176.4	0	111.7	P194 E195 N201 Q202	P194-K198 WeakPolarHBondContact O-CB 3.44Å; P194-K198 PolarHBondContact O-N 3.25Å; P194-K198 VanDerWaalsContact O-N 3.14Å; E195-K198 PolarHBondContact O-N 2.98Å; K198-N201 PolarHBondContact O-N 3.42Å; K198-Q202 PolarHBondContact O-N 3.16Å; K198-Q202 VanDerWaalsContact O-N 3.14Å
199	F	50.9	Low	55.7	Low	28 Å²	28	92.9 Å²	92.9	12%	0.123	51%	0.505	C	S	.	.	H	α-helix	trans	-73.4	-37.4	176.1	-161.3	-98.7	0	0	0	112.2	E195 K196 K197 N201 Q202 L203 E294 K297 L298 N301	E195-F199 VanDerWaalsContact O-CB 3.25Å; E195-F199 WeakPolarHBondContact O-CB 3.48Å; E195-F199 PolarHBondContact O-N 3.33Å; K196-F199 PolarHBondContact O-N 2.93Å; K197-F199 VanDerWaalsContact C-N 3.32Å; K197-F199 PolarHBondContact O-N 3.31Å; F199-N201 VanDerWaalsContact C-N 3.26Å; F199-N201 PolarHBondContact O-N 3.02Å; F199-Q202 PolarHBondContact O-N 2.96Å; F199-Q202 VanDerWaalsContact O-N 3.13Å; F199-L203 HydrophobicContact CD1-CD1 3.54Å; F199-L203 HydrophobicContact CD1-CD2 4.49Å; F199-L203 HydrophobicContact CD1-CG 3.89Å; F199-L203 HydrophobicContact CE1-CD1 3.79Å; F199-L203 HydrophobicContact CE1-CD2 3.97Å; F199-L203 HydrophobicContact CE1-CG 3.85Å; F199-L203 WeakPolarHBondContact O-CB 3.49Å; F199-L203 WeakPolarHBondContact O-CG 3.46Å; F199-L203 PolarHBondContact O-N 2.64Å; F199-E294 HydrophobicContact CE2-CB 4.48Å; F199-K297 HydrophobicContact CE1-CB 3.89Å; F199-K297 HydrophobicContact CE2-CB 4.09Å; F199-K297 HydrophobicContact CZ-CB 3.44Å; F199-K297 VanDerWaalsContact CZ-CB 3.44Å; F199-L298 HydrophobicContact CZ-CB 4.22Å; F199-N301 WeakPolarHBondContact CD1-ND2 3.42Å; F199-N301 HydrophobicContact CE1-CB 4.35Å; F199-N301 WeakPolarHBondContact CE1-ND2 3.5Å
200	Q	53.3	Low	57.9	Low	113 Å²	113	87.9 Å²	87.9	53%	0.528	48%	0.477	S	S	.	.	H	α-helix	trans	-59.1	-36.1	169.8	-83.3	179.1	-10.4	0	0	112.4	K196 K197 L203 S204	K196-Q200 VanDerWaalsContact O-CB 3.29Å; K196-Q200 WeakPolarHBondContact O-CB 3.42Å; K196-Q200 VanDerWaalsContact O-CG 3.29Å; K196-Q200 WeakPolarHBondContact O-CG 3.44Å; K196-Q200 PolarHBondContact O-N 3.33Å; K197-Q200 PolarHBondContact O-N 2.8Å; Q200-L203 WeakPolarHBondContact O-CB 3.45Å; Q200-L203 PolarHBondContact O-N 2.99Å; Q200-S204 PolarHBondContact O-N 3.48Å; Q200-S204 PolarHBondContact O-OG 2.93Å; Q200-S204 VanDerWaalsContact O-OG 3.11Å
201	N	58.8	Low	60.2	Low	121 Å²	121	85.9 Å²	85.9	65%	0.647	47%	0.465	S	S	*	.	H	α-helix	trans	-72.6	-29.7	174.3	-72.7	-12.9	0	0	0	113.5	K197 K198 F199 S204	K197-N201 PolarHBondContact O-N 3.48Å; K198-N201 PolarHBondContact O-N 3.42Å; F199-N201 VanDerWaalsContact C-N 3.26Å; F199-N201 PolarHBondContact O-N 3.02Å; N201-S204 WeakPolarHBondContact CA-OG 3.47Å; N201-S204 PolarHBondContact O-OG 3.49Å
202	Q	55.8	Low	62.4	Low	94 Å²	94	83.3 Å²	83.3	44%	0.439	44%	0.436	S	S	.	.	H	α-helix	trans	-72.6	-37.2	168.9	-80.4	175.5	-45.1	0	0	111.7	K198 F199 G205 A206	K198-Q202 PolarHBondContact O-N 3.16Å; K198-Q202 VanDerWaalsContact O-N 3.14Å; F199-Q202 PolarHBondContact O-N 2.96Å; F199-Q202 VanDerWaalsContact O-N 3.13Å; Q202-G205 PolarHBondContact O-N 3.01Å; Q202-A206 PolarHBondContact O-N 3.28Å
203	L	55.6	Low	64.3	Low	8 Å²	8	83.7 Å²	83.7	4%	0.042	44%	0.438	C	S	.	.	H	α-helix	trans	-62.8	-41.2	176.7	-74.5	163.4	0	0	0	112	F199 Q200 G205 A206 I207 L298 N301	F199-L203 HydrophobicContact CD1-CD1 3.54Å; F199-L203 HydrophobicContact CD1-CD2 4.49Å; F199-L203 HydrophobicContact CD1-CG 3.89Å; F199-L203 HydrophobicContact CE1-CD1 3.79Å; F199-L203 HydrophobicContact CE1-CD2 3.97Å; F199-L203 HydrophobicContact CE1-CG 3.85Å; F199-L203 WeakPolarHBondContact O-CB 3.49Å; F199-L203 WeakPolarHBondContact O-CG 3.46Å; F199-L203 PolarHBondContact O-N 2.64Å; Q200-L203 WeakPolarHBondContact O-CB 3.45Å; Q200-L203 PolarHBondContact O-N 2.99Å; L203-G205 PolarHBondContact O-N 3.11Å; L203-A206 PolarHBondContact O-N 2.95Å; L203-I207 HydrophobicContact CB-CD1 4.38Å; L203-I207 HydrophobicContact CD2-CD1 3.55Å; L203-I207 WeakPolarHBondContact O-CB 3.22Å; L203-I207 PolarHBondContact O-N 3.22Å; L203-L298 HydrophobicContact CD2-CD2 4.24Å; L203-L298 HydrophobicContact CD2-CG 3.91Å; L203-N301 HydrophobicContact CD1-CB 3.7Å; L203-N301 HydrophobicContact CD2-CB 3.86Å; L203-N301 HydrophobicContact CG-CB 4.47Å
204	S	58.5	Low	66	Low	76 Å²	76	81.4 Å²	81.4	53%	0.531	43%	0.426	S	S	.	.	H	α-helix	trans	-68.4	-18.7	177.1	48.4	0	0	0	0	113.7	Q200 N201	Q200-S204 PolarHBondContact O-N 3.48Å; Q200-S204 PolarHBondContact O-OG 2.93Å; Q200-S204 VanDerWaalsContact O-OG 3.11Å; N201-S204 WeakPolarHBondContact CA-OG 3.47Å; N201-S204 PolarHBondContact O-OG 3.49Å
205	G	62.8	Low	67.6	Low	66 Å²	66	82 Å²	82	68%	0.68	42%	0.418	S	S	*	.	H	α-helix	trans	-83.5	-35.5	172.4	0	0	0	0	0	114.2	Q202 L203	Q202-G205 PolarHBondContact O-N 3.01Å; L203-G205 PolarHBondContact O-N 3.11Å
206	A	64.3	Low	69.2	Low	21 Å²	21	76.7 Å²	76.7	17%	0.174	39%	0.393	C	S	.	.	H	α-helix	trans	-93.9	-28.1	-175.9	0	0	0	0	0	113.8	Q202 L203 L298	Q202-A206 PolarHBondContact O-N 3.28Å; L203-A206 PolarHBondContact O-N 2.95Å; A206-L298 HydrophobicContact CB-CD1 4.16Å
207	I	71.7	Confident	70.8	Confident	6 Å²	6	76.3 Å²	76.3	3%	0.031	40%	0.398	C	S	.	.	S	Bend	trans	-104	108.9	-179	-57.5	171.4	0	0	0	108.3	L203 M209 F280 I282 L298 L302 L305	L203-I207 HydrophobicContact CB-CD1 4.38Å; L203-I207 HydrophobicContact CD2-CD1 3.55Å; L203-I207 WeakPolarHBondContact O-CB 3.22Å; L203-I207 PolarHBondContact O-N 3.22Å; I207-M209 HydrophobicContact CG2-CG 4.4Å; I207-M209 PolarHBondContact O-N 3.29Å; I207-F280 HydrophobicContact CG2-CB 4.37Å; I207-F280 HydrophobicContact CG2-CD1 3.64Å; I207-F280 HydrophobicContact CG2-CE1 4.49Å; I207-I282 HydrophobicContact CG1-CD1 4.25Å; I207-L298 HydrophobicContact CD1-CD2 4.15Å; I207-L298 HydrophobicContact CG1-CD2 4.25Å; I207-L302 HydrophobicContact CD1-CB 3.97Å; I207-L302 HydrophobicContact CD1-CD1 3.88Å; I207-L302 HydrophobicContact CG1-CD1 4.21Å; I207-L302 HydrophobicContact CG2-CD1 3.9Å; I207-L305 HydrophobicContact CD1-CD1 4.34Å
208	V	75.7	Confident	72.1	Confident	78 Å²	78	74.5 Å²	74.5	47%	0.473	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	105.7	174.4	-177.4	0	0	0	0	108.3	E210 S281	V208-E210 HydrophobicContact CG1-CB 4.4Å; V208-E210 HydrophobicContact CG1-CG 4.43Å; V208-S281 PolarHBondContact N-O 2.88Å; V208-S281 PolarHBondContact O-N 3.22Å
209	M	82.8	Confident	73.5	Confident	104 Å²	104	67.7 Å²	67.7	51%	0.512	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	111.2	167.3	-67.2	-172.9	-69.5	0	0	108.9	I207 F280	I207-M209 HydrophobicContact CG2-CG 4.4Å; I207-M209 PolarHBondContact O-N 3.29Å; M209-F280 HydrophobicContact CG-CD1 3.65Å; M209-F280 HydrophobicContact CG-CE1 3.49Å; M209-F280 VanDerWaalsContact CG-CE1 3.49Å; M209-F280 HydrophobicContact CG-CZ 4.42Å; M209-F280 HydrophobicContact SD-CD1 4.32Å; M209-F280 HydrophobicContact SD-CE1 3.55Å; M209-F280 VanDerWaalsContact SD-CE1 3.55Å; M209-F280 HydrophobicContact SD-CZ 4.23Å
210	E	81.4	Confident	75.2	Confident	50 Å²	50	67 Å²	67	23%	0.234	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	156.6	177.8	58.6	176.9	-172.7	0	0	111.9	V208 K268 F279	V208-E210 HydrophobicContact CG1-CB 4.4Å; V208-E210 HydrophobicContact CG1-CG 4.43Å; E210-K268 VanDerWaalsContact OE1-CE 3.26Å; E210-K268 WeakPolarHBondContact OE1-CE 3.33Å; E210-K268 IonicContact OE1-NZ 2.9Å; E210-K268 PolarHBondContact OE1-NZ 3.48Å; E210-K268 IonicContact OE2-NZ 3.96Å; E210-K268 PolarHBondContact OE2-NZ 2.9Å; E210-F279 HydrophobicContact CG-CB 4.31Å; E210-F279 HydrophobicContact CG-CD1 3.66Å; E210-F279 HydrophobicContact CG-CG 4.46Å; E210-F279 PolarHBondContact N-O 3.41Å; E210-F279 WeakPolarHBondContact O-CB 3.44Å; E210-F279 PolarHBondContact O-N 3.49Å; E210-F279 WeakPolarHBondContact OE1-CD1 3.14Å; E210-F279 WeakPolarHBondContact OE1-CE1 3.38Å
211	K	82.1	Confident	76.8	Confident	147 Å²	147	62.8 Å²	62.8	64%	0.639	35%	0.351	S	S	*	.			trans	-112	89.7	163.7	-77.4	-179.3	171.5	-173.2	0	106.4
212	P	82.7	Confident	78.2	Confident	11 Å²	11	58.5 Å²	58.5	7%	0.071	33%	0.328	C	S	.	.			trans	-62.3	152.1	-179.1	25.2	-30.7	0	0	0	109.8	K268 A271 T272 F279	P212-K268 HydrophobicContact CB-CB 3.85Å; P212-K268 HydrophobicContact CB-CG 4.26Å; P212-K268 HydrophobicContact CG-CB 4.17Å; P212-K268 WeakPolarHBondContact CG-O 3.5Å; P212-A271 HydrophobicContact CG-CB 3.77Å; P212-T272 PolarHBondContact O-OG1 3.31Å; P212-F279 HydrophobicContact CG-CB 4.33Å; P212-F279 HydrophobicContact CG-CG 4.47Å
213	N	86.3	Confident	79.7	Confident	130 Å²	130	58.8 Å²	58.8	70%	0.695	33%	0.329	S	S	*	.			trans	-122.9	55.3	175.3	-174.2	27.9	0	0	0	109.5
214	I	87.9	Confident	81.3	Confident	23 Å²	23	59.7 Å²	59.7	12%	0.118	34%	0.34	C	S	.	.			trans	-112.6	124.5	178.1	-65.3	165.1	0	0	0	106.7	D218 V219 Y265 K268 A269 T272	I214-D218 HydrophobicContact CG2-CB 4.14Å; I214-V219 HydrophobicContact CG2-CG2 4.44Å; I214-Y265 HydrophobicContact CD1-CD2 3.73Å; I214-Y265 HydrophobicContact CD1-CE2 3.4Å; I214-Y265 HydrophobicContact CD1-CG 4.47Å; I214-Y265 HydrophobicContact CG1-CE2 4.03Å; I214-Y265 HydrophobicContact CG2-CD1 4.16Å; I214-Y265 HydrophobicContact CG2-CE1 3.57Å; I214-Y265 HydrophobicContact CG2-CE2 4.23Å; I214-K268 HydrophobicContact CD1-CB 3.67Å; I214-K268 HydrophobicContact CD1-CD 3.85Å; I214-K268 HydrophobicContact CD1-CG 4.41Å; I214-A269 HydrophobicContact CB-CB 4.48Å; I214-A269 HydrophobicContact CG2-CB 3.85Å; I214-A269 WeakPolarHBondContact O-CA 3.34Å; I214-T272 PolarHBondContact N-OG1 3.11Å; I214-T272 VanDerWaalsContact N-OG1 3.11Å; I214-T272 WeakPolarHBondContact O-CB 3.22Å; I214-T272 WeakPolarHBondContact O-CG2 3.4Å; I214-T272 PolarHBondContact O-OG1 2.79Å; I214-T272 VanDerWaalsContact O-OG1 3.14Å
215	K	88.9	Confident	82.8	Confident	111 Å²	111	56.1 Å²	56.1	48%	0.483	32%	0.315	S	S	.	.			trans	-96.9	165.3	-179.2	-62.6	-178.5	-179.9	179.8	0	111.1	N217 D218	K215-N217 PolarHBondContact O-N 3.26Å; K215-N217 VanDerWaalsContact O-N 3.16Å; K215-D218 PolarHBondContact N-OD2 3.13Å; K215-D218 WeakPolarHBondContact O-CB 3.42Å; K215-D218 PolarHBondContact O-N 3.09Å
216	W	88.6	Confident	84.2	Confident	21 Å²	21	53.5 Å²	53.5	8%	0.08	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-56.1	-32.6	173.7	-68.8	121.1	0	0	0	113.8	D218 V219 K226 L229 K230 I234 L266 A269 V270 E273	W216-D218 VanDerWaalsContact C-N 3.26Å; W216-D218 PolarHBondContact O-N 3.45Å; W216-V219 PolarHBondContact O-N 3.21Å; W216-K226 HydrophobicContact CE3-CB 4.42Å; W216-K226 HydrophobicContact CE3-CD 4.39Å; W216-K226 HydrophobicContact CE3-CG 3.86Å; W216-K226 HydrophobicContact CZ3-CB 4.4Å; W216-K226 HydrophobicContact CZ3-CG 3.99Å; W216-K226 PolarHBondContact O-NZ 2.89Å; W216-L229 HydrophobicContact CH2-CB 4.08Å; W216-K230 HydrophobicContact CZ2-CG 4.09Å; W216-I234 HydrophobicContact CZ2-CG1 4.37Å; W216-L266 HydrophobicContact CE3-CD1 4.46Å; W216-L266 HydrophobicContact CZ3-CD1 3.74Å; W216-A269 HydrophobicContact CE3-CB 4.28Å; W216-A269 HydrophobicContact CZ3-CB 4.36Å; W216-V270 HydrophobicContact CH2-CB 4.33Å; W216-V270 HydrophobicContact CH2-CG2 3.49Å; W216-V270 VanDerWaalsContact CH2-CG2 3.49Å; W216-V270 HydrophobicContact CZ2-CG2 4.28Å; W216-V270 HydrophobicContact CZ3-CG2 4.22Å; W216-E273 HydrophobicContact CD2-CG 4.17Å; W216-E273 HydrophobicContact CG-CG 4Å; W216-E273 HydrophobicContact CZ2-CB 4.16Å; W216-E273 HydrophobicContact CZ2-CG 4.41Å; W216-E273 PolarHBondContact N-OE1 3.39Å; W216-E273 VanDerWaalsContact NE1-CB 3.34Å; W216-E273 PolarHBondContact NE1-OE2 2.98Å
217	N	86.4	Confident	85.5	Confident	138 Å²	138	58.6 Å²	58.6	74%	0.738	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-72.4	-20.5	-179.9	-66.2	-11.4	0	0	0	112.9	K215 V219	K215-N217 PolarHBondContact O-N 3.26Å; K215-N217 VanDerWaalsContact O-N 3.16Å; N217-V219 VanDerWaalsContact C-N 3.26Å
218	D	83.8	Confident	86.5	Confident	62 Å²	62	58.8 Å²	58.8	33%	0.332	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-80.6	-14.9	176.7	-54.2	-36.4	0	0	0	111	I214 K215 W216 Y265	I214-D218 HydrophobicContact CG2-CB 4.14Å; K215-D218 PolarHBondContact N-OD2 3.13Å; K215-D218 WeakPolarHBondContact O-CB 3.42Å; K215-D218 PolarHBondContact O-N 3.09Å; W216-D218 VanDerWaalsContact C-N 3.26Å; W216-D218 PolarHBondContact O-N 3.45Å; D218-Y265 HydrophobicContact CB-CE1 4.41Å
219	V	86.5	Confident	87.3	Confident	13 Å²	13	55 Å²	55	8%	0.079	29%	0.285	C	S	.	.	S	Bend	trans	-94.2	113.8	176	-171.8	0	0	0	0	109.9	I214 W216 N217 L222 K226 Y265 L266 A269	I214-V219 HydrophobicContact CG2-CG2 4.44Å; W216-V219 PolarHBondContact O-N 3.21Å; N217-V219 VanDerWaalsContact C-N 3.26Å; V219-L222 HydrophobicContact CG1-CD1 4.39Å; V219-K226 VanDerWaalsContact O-CE 3.29Å; V219-K226 WeakPolarHBondContact O-CE 3.19Å; V219-K226 PolarHBondContact O-NZ 3.15Å; V219-Y265 HydrophobicContact CG2-CD1 3.94Å; V219-Y265 HydrophobicContact CG2-CE1 4.1Å; V219-L266 HydrophobicContact CG1-CD1 4.08Å; V219-A269 HydrophobicContact CG2-CB 3.75Å
220	A	85.8	Confident	87.7	Confident	13 Å²	13	53.8 Å²	53.8	11%	0.107	28%	0.277	C	S	.	.			trans	-78.3	126.2	-178.7	0	0	0	0	0	112.5	F391 M392	A220-F391 HydrophobicContact CB-CB 4.49Å; A220-F391 HydrophobicContact CB-CD1 3.43Å; A220-F391 VanDerWaalsContact CB-CD1 3.43Å; A220-F391 HydrophobicContact CB-CE1 4.02Å; A220-F391 HydrophobicContact CB-CG 4.32Å; A220-M392 HydrophobicContact CB-CE 4.02Å; A220-M392 HydrophobicContact CB-CG 4.04Å
221	G	86.4	Confident	88.2	Confident	25 Å²	25	56.7 Å²	56.7	26%	0.258	29%	0.29	S	S	.	.	S	Bend	trans	68.3	-148.9	178.3	0	0	0	0	0	113.4	E223 K226	G221-E223 VanDerWaalsContact C-N 3.33Å; G221-E223 PolarHBondContact O-N 2.85Å; G221-K226 WeakPolarHBondContact O-CE 3.43Å; G221-K226 PolarHBondContact O-NZ 3.11Å
222	L	87.4	Confident	88.5	Confident	31 Å²	31	50 Å²	50	16%	0.162	26%	0.262	C	S	.	.			trans	59	37.7	179.2	-57	174.9	0	0	0	113.6	V219 G224 A225 K226 I381 P382	V219-L222 HydrophobicContact CG1-CD1 4.39Å; L222-G224 VanDerWaalsContact C-N 3.35Å; L222-G224 PolarHBondContact O-N 2.89Å; L222-A225 HydrophobicContact CB-CB 4.29Å; L222-A225 PolarHBondContact O-N 3.2Å; L222-K226 WeakPolarHBondContact O-CB 3.36Å; L222-K226 VanDerWaalsContact O-CG 3.31Å; L222-K226 WeakPolarHBondContact O-CG 3.09Å; L222-K226 PolarHBondContact O-N 3.16Å; L222-I381 HydrophobicContact CD1-CG2 3.89Å; L222-I381 HydrophobicContact CD2-CG2 3.93Å; L222-P382 HydrophobicContact CD2-CG 4.04Å
223	E	88.4	Confident	88.9	Confident	101 Å²	101	49.8 Å²	49.8	47%	0.472	26%	0.261	S	S	.	.	H	α-helix	trans	-61.3	-40.8	-173.4	-64.8	-51.8	143.1	0	0	113	G221 K226 E227	G221-E223 VanDerWaalsContact C-N 3.33Å; G221-E223 PolarHBondContact O-N 2.85Å; E223-K226 PolarHBondContact O-N 3.43Å; E223-K226 IonicContact OE1-NZ 2.8Å; E223-K226 PolarHBondContact OE1-NZ 2.69Å; E223-K226 IonicContact OE2-NZ 2.67Å; E223-E227 WeakPolarHBondContact O-CG 3.44Å; E223-E227 PolarHBondContact O-N 3.08Å
224	G	88.3	Confident	89	Confident	26 Å²	26	45.2 Å²	45.2	27%	0.268	24%	0.236	S	C	.	.	H	α-helix	trans	-56.4	-57.6	171.6	0	0	0	0	0	111.5	L222 K226 E227 A228 G527	L222-G224 VanDerWaalsContact C-N 3.35Å; L222-G224 PolarHBondContact O-N 2.89Å; G224-K226 PolarHBondContact O-N 3.35Å; G224-K226 VanDerWaalsContact O-N 3.17Å; G224-E227 CarbonylContact O-C 3.59Å; G224-E227 WeakPolarHBondContact O-CA 3.33Å; G224-E227 WeakPolarHBondContact O-CB 3.32Å; G224-E227 PolarHBondContact O-N 3.08Å; G224-A228 PolarHBondContact O-N 3.28Å; G224-G527 WeakPolarHBondContact CA-OXT 3.24Å
225	A	90.9	Very high	89.2	Confident	2 Å²	2	47 Å²	47	2%	0.017	25%	0.245	C	C	.	.	H	α-helix	trans	-58.7	-35.2	-178.8	0	0	0	0	0	112.8	L222 L229 L266 I379 I381 G527	L222-A225 HydrophobicContact CB-CB 4.29Å; L222-A225 PolarHBondContact O-N 3.2Å; A225-L229 WeakPolarHBondContact O-CB 3.46Å; A225-L229 WeakPolarHBondContact O-CD1 3.44Å; A225-L229 WeakPolarHBondContact O-CG 3.49Å; A225-L229 PolarHBondContact O-N 3.23Å; A225-L266 HydrophobicContact CB-CD2 4.44Å; A225-I379 HydrophobicContact CB-CG2 3.83Å; A225-I381 HydrophobicContact CB-CD1 3.49Å; A225-I381 VanDerWaalsContact CB-CD1 3.49Å; A225-G527 VanDerWaalsContact N-C 3.29Å; A225-G527 PolarHBondContact N-OXT 3.21Å; A225-G527 VanDerWaalsContact N-OXT 3.13Å
226	K	91.7	Very high	89.2	Confident	11 Å²	11	42.5 Å²	42.5	5%	0.048	23%	0.227	C	C	.	.	H	α-helix	trans	-64.4	-44.7	172.4	-73.1	172	177.8	170.9	0	111.5	W216 V219 G221 L222 E223 G224 L229 K230 L266	W216-K226 HydrophobicContact CE3-CB 4.42Å; W216-K226 HydrophobicContact CE3-CD 4.39Å; W216-K226 HydrophobicContact CE3-CG 3.86Å; W216-K226 HydrophobicContact CZ3-CB 4.4Å; W216-K226 HydrophobicContact CZ3-CG 3.99Å; W216-K226 PolarHBondContact O-NZ 2.89Å; V219-K226 VanDerWaalsContact O-CE 3.29Å; V219-K226 WeakPolarHBondContact O-CE 3.19Å; V219-K226 PolarHBondContact O-NZ 3.15Å; G221-K226 WeakPolarHBondContact O-CE 3.43Å; G221-K226 PolarHBondContact O-NZ 3.11Å; L222-K226 WeakPolarHBondContact O-CB 3.36Å; L222-K226 VanDerWaalsContact O-CG 3.31Å; L222-K226 WeakPolarHBondContact O-CG 3.09Å; L222-K226 PolarHBondContact O-N 3.16Å; E223-K226 PolarHBondContact O-N 3.43Å; E223-K226 IonicContact OE1-NZ 2.8Å; E223-K226 PolarHBondContact OE1-NZ 2.69Å; E223-K226 IonicContact OE2-NZ 2.67Å; G224-K226 PolarHBondContact O-N 3.35Å; G224-K226 VanDerWaalsContact O-N 3.17Å; K226-L229 PolarHBondContact O-N 3.35Å; K226-K230 WeakPolarHBondContact O-CB 3.4Å; K226-K230 WeakPolarHBondContact O-CG 3.26Å; K226-K230 PolarHBondContact O-N 3.37Å; K226-L266 HydrophobicContact CG-CD1 4.3Å
227	E	92.3	Very high	89.1	Confident	128 Å²	128	44.2 Å²	44.2	60%	0.598	24%	0.238	S	C	*	.	H	α-helix	trans	-62.6	-46.9	176.3	-75.5	-178.5	176.7	0	0	111.5	E223 G224 L229 K230 E231	E223-E227 WeakPolarHBondContact O-CG 3.44Å; E223-E227 PolarHBondContact O-N 3.08Å; G224-E227 CarbonylContact O-C 3.59Å; G224-E227 WeakPolarHBondContact O-CA 3.33Å; G224-E227 WeakPolarHBondContact O-CB 3.32Å; G224-E227 PolarHBondContact O-N 3.08Å; E227-L229 VanDerWaalsContact C-N 3.28Å; E227-L229 PolarHBondContact O-N 3.5Å; E227-K230 PolarHBondContact O-N 2.98Å; E227-K230 VanDerWaalsContact O-N 3.16Å; E227-E231 WeakPolarHBondContact O-CB 3.46Å; E227-E231 PolarHBondContact O-N 3.18Å
228	A	91.9	Very high	89.1	Confident	9 Å²	9	44.4 Å²	44.4	7%	0.074	23%	0.232	C	C	.	.	H	α-helix	trans	-58.4	-39.3	176.2	0	0	0	0	0	112.2	G224 A232 I379	G224-A228 PolarHBondContact O-N 3.28Å; A228-A232 WeakPolarHBondContact O-CB 3.04Å; A228-A232 PolarHBondContact O-N 2.97Å; A228-I379 HydrophobicContact CB-CD1 3.88Å; A228-I379 HydrophobicContact CB-CG1 4.33Å; A228-I379 HydrophobicContact CB-CG2 4.48Å
229	L	92.4	Very high	89.4	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-74	-37.7	175.5	-76.8	166.5	0	0	0	113.1	W216 A225 K226 E227 E231 A232 V233 I253 L255 L266 V270 L358 I379	W216-L229 HydrophobicContact CH2-CB 4.08Å; A225-L229 WeakPolarHBondContact O-CB 3.46Å; A225-L229 WeakPolarHBondContact O-CD1 3.44Å; A225-L229 WeakPolarHBondContact O-CG 3.49Å; A225-L229 PolarHBondContact O-N 3.23Å; K226-L229 PolarHBondContact O-N 3.35Å; E227-L229 VanDerWaalsContact C-N 3.28Å; E227-L229 PolarHBondContact O-N 3.5Å; L229-E231 VanDerWaalsContact C-N 3.32Å; L229-E231 PolarHBondContact O-N 3.49Å; L229-A232 PolarHBondContact O-N 2.92Å; L229-V233 HydrophobicContact CD2-CG2 4.38Å; L229-V233 WeakPolarHBondContact O-CB 3.13Å; L229-V233 PolarHBondContact O-N 2.74Å; L229-I253 HydrophobicContact CD2-CD1 4.45Å; L229-I253 HydrophobicContact CD2-CG2 4.27Å; L229-L255 HydrophobicContact CD1-CD2 4.36Å; L229-L255 HydrophobicContact CD2-CD2 4.27Å; L229-L266 HydrophobicContact CD1-CD1 4.06Å; L229-L266 HydrophobicContact CD1-CD2 3.49Å; L229-L266 VanDerWaalsContact CD1-CD2 3.49Å; L229-L266 HydrophobicContact CD1-CG 3.57Å; L229-V270 HydrophobicContact CB-CG2 4.09Å; L229-V270 HydrophobicContact CD1-CG2 3.7Å; L229-V270 HydrophobicContact CD2-CG2 4Å; L229-V270 HydrophobicContact CG-CG2 4.15Å; L229-L358 HydrophobicContact CD2-CD2 4.37Å; L229-I379 HydrophobicContact CD2-CD1 3.82Å; L229-I379 HydrophobicContact CG-CD1 3.81Å
230	K	92.3	Very high	89.5	Confident	78 Å²	78	48.5 Å²	48.5	34%	0.339	25%	0.254	S	S	.	.	I	π-helix	trans	-60.8	-43.8	173.5	-76.5	168	-175.3	171.5	0	110.7	W216 K226 E227 I234 L235	W216-K230 HydrophobicContact CZ2-CG 4.09Å; K226-K230 WeakPolarHBondContact O-CB 3.4Å; K226-K230 WeakPolarHBondContact O-CG 3.26Å; K226-K230 PolarHBondContact O-N 3.37Å; E227-K230 PolarHBondContact O-N 2.98Å; E227-K230 VanDerWaalsContact O-N 3.16Å; K230-I234 HydrophobicContact CG-CG1 4.42Å; K230-I234 CarbonylContact O-C 2.97Å; K230-I234 WeakPolarHBondContact O-CA 3.2Å; K230-I234 WeakPolarHBondContact O-CB 3.29Å; K230-I234 PolarHBondContact O-N 2.95Å; K230-L235 PolarHBondContact O-N 3.07Å
231	E	91.3	Very high	89.7	Confident	111 Å²	111	53.6 Å²	53.6	52%	0.519	28%	0.275	S	S	.	.	I	π-helix	trans	-65	-46.3	175.4	-169.9	-166.2	169.3	0	0	111.5	E227 L229 L235	E227-E231 WeakPolarHBondContact O-CB 3.46Å; E227-E231 PolarHBondContact O-N 3.18Å; L229-E231 VanDerWaalsContact C-N 3.32Å; L229-E231 PolarHBondContact O-N 3.49Å; E231-L235 HydrophobicContact CG-CD2 4.29Å; E231-L235 WeakPolarHBondContact O-CB 3.37Å
232	A	89.1	Confident	89.9	Confident	5 Å²	5	55.6 Å²	55.6	4%	0.041	28%	0.28	C	S	.	.	I	π-helix	trans	-75.5	-31.5	-173.3	0	0	0	0	0	114	A228 L229 I253	A228-A232 WeakPolarHBondContact O-CB 3.04Å; A228-A232 PolarHBondContact O-N 2.97Å; L229-A232 PolarHBondContact O-N 2.92Å; A232-I253 HydrophobicContact CB-CD1 3.58Å
233	V	89.9	Confident	90	Very high	8 Å²	8	56.9 Å²	56.9	5%	0.048	28%	0.284	C	S	.	.	I	π-helix	trans	-116.8	-46.9	-170.9	-172.5	0	0	0	0	112.7	L229 P236 I237 I253 V270 A274 I313 L356	L229-V233 HydrophobicContact CD2-CG2 4.38Å; L229-V233 WeakPolarHBondContact O-CB 3.13Å; L229-V233 PolarHBondContact O-N 2.74Å; V233-P236 WeakPolarHBondContact O-CD 3.3Å; V233-I237 HydrophobicContact CG1-CD1 4.39Å; V233-I237 WeakPolarHBondContact O-CD1 3.41Å; V233-I237 WeakPolarHBondContact O-CG1 3.29Å; V233-I253 HydrophobicContact CG2-CD1 3.58Å; V233-V270 HydrophobicContact CB-CG1 3.99Å; V233-V270 HydrophobicContact CG1-CG1 3.7Å; V233-V270 HydrophobicContact CG2-CG1 3.98Å; V233-A274 HydrophobicContact CG1-CB 4.13Å; V233-I313 HydrophobicContact CG1-CD1 4.47Å; V233-L356 HydrophobicContact CB-CD2 4.22Å; V233-L356 HydrophobicContact CG1-CD2 3.76Å; V233-L356 HydrophobicContact CG2-CD2 3.46Å; V233-L356 VanDerWaalsContact CG2-CD2 3.46Å
234	I	89.6	Confident	89.8	Confident	33 Å²	33	55.5 Å²	55.5	17%	0.169	28%	0.283	C	S	.	.	I	π-helix	trans	-81.3	-39.9	-172.2	-51.1	-57.9	0	0	0	111.2	W216 K230 I237 K238 E273 A274	W216-I234 HydrophobicContact CZ2-CG1 4.37Å; K230-I234 HydrophobicContact CG-CG1 4.42Å; K230-I234 CarbonylContact O-C 2.97Å; K230-I234 WeakPolarHBondContact O-CA 3.2Å; K230-I234 WeakPolarHBondContact O-CB 3.29Å; K230-I234 PolarHBondContact O-N 2.95Å; I234-I237 PolarHBondContact O-N 3.19Å; I234-K238 WeakPolarHBondContact O-CB 3.37Å; I234-K238 PolarHBondContact O-N 3.18Å; I234-E273 HydrophobicContact CD1-CB 4.08Å; I234-A274 HydrophobicContact CD1-CB 3.89Å
235	L	91	Very high	89.8	Confident	61 Å²	61	57.9 Å²	57.9	32%	0.319	31%	0.307	S	S	.	.	H	α-helix	trans	-60.1	-44.3	-178.4	-167	74.5	0	0	0	113.1	K230 E231 I237 K238 F239 F243	K230-L235 PolarHBondContact O-N 3.07Å; E231-L235 HydrophobicContact CG-CD2 4.29Å; E231-L235 WeakPolarHBondContact O-CB 3.37Å; L235-I237 VanDerWaalsContact C-N 3.35Å; L235-I237 PolarHBondContact O-N 3.06Å; L235-K238 PolarHBondContact O-N 2.85Å; L235-F239 HydrophobicContact CD1-CD2 3.68Å; L235-F239 HydrophobicContact CD1-CE2 4.12Å; L235-F239 PolarHBondContact O-N 3.16Å; L235-F243 HydrophobicContact CB-CE2 4.42Å; L235-F243 HydrophobicContact CB-CZ 4.38Å; L235-F243 HydrophobicContact CD2-CE2 4.28Å; L235-F243 HydrophobicContact CD2-CZ 4.05Å; L235-F243 HydrophobicContact CG-CE2 4.06Å; L235-F243 HydrophobicContact CG-CZ 4.21Å
236	P	88.2	Confident	89.6	Confident	16 Å²	16	67.7 Å²	67.7	10%	0.104	35%	0.35	C	S	.	.	H	α-helix	trans	-62.5	-38.8	175.1	-18.5	28.5	0	0	0	114.1	V233 P240 F243 P249	V233-P236 WeakPolarHBondContact O-CD 3.3Å; P236-P240 WeakPolarHBondContact O-CA 3.33Å; P236-F243 VanDerWaalsContact CA-CD2 3.49Å; P236-F243 HydrophobicContact CB-CD1 4.28Å; P236-F243 HydrophobicContact CB-CD2 3.93Å; P236-F243 HydrophobicContact CB-CE1 4.25Å; P236-F243 HydrophobicContact CB-CE2 3.91Å; P236-F243 HydrophobicContact CB-CG 4.11Å; P236-F243 HydrophobicContact CB-CZ 4.07Å; P236-F243 HydrophobicContact CG-CD1 4.25Å; P236-F243 HydrophobicContact CG-CD2 4.36Å; P236-F243 HydrophobicContact CG-CE1 3.77Å; P236-F243 HydrophobicContact CG-CE2 3.9Å; P236-F243 HydrophobicContact CG-CZ 3.57Å; P236-P249 HydrophobicContact CB-CB 3.8Å; P236-P249 HydrophobicContact CB-CG 4.49Å; P236-P249 HydrophobicContact CG-CB 3.77Å
237	I	86.4	Confident	89.5	Confident	58 Å²	58	74.1 Å²	74.1	30%	0.297	37%	0.374	S	S	.	.	H	α-helix	trans	-69.2	-42.4	179.7	-64.8	172.6	0	0	0	110.3	V233 I234 L235 A274 N275	V233-I237 HydrophobicContact CG1-CD1 4.39Å; V233-I237 WeakPolarHBondContact O-CD1 3.41Å; V233-I237 WeakPolarHBondContact O-CG1 3.29Å; I234-I237 PolarHBondContact O-N 3.19Å; L235-I237 VanDerWaalsContact C-N 3.35Å; L235-I237 PolarHBondContact O-N 3.06Å; I237-A274 HydrophobicContact CD1-CB 3.73Å; I237-N275 HydrophobicContact CG2-CB 4.33Å; I237-N275 WeakPolarHBondContact CG2-ND2 3.45Å
238	K	87.7	Confident	89.3	Confident	142 Å²	142	72.5 Å²	72.5	62%	0.617	37%	0.373	S	S	*	.	H	α-helix	trans	-75	-36.6	-177.2	-169.8	172.7	-178.7	176	0	112.8	I234 L235	I234-K238 WeakPolarHBondContact O-CB 3.37Å; I234-K238 PolarHBondContact O-N 3.18Å; L235-K238 PolarHBondContact O-N 2.85Å
239	F	89.9	Confident	89.2	Confident	77 Å²	77	73.9 Å²	73.9	34%	0.338	38%	0.381	S	S	.	.			trans	-132	67.1	-175	-56	-64.7	0	0	0	112	L235 H241 L242	L235-F239 HydrophobicContact CD1-CD2 3.68Å; L235-F239 HydrophobicContact CD1-CE2 4.12Å; L235-F239 PolarHBondContact O-N 3.16Å; F239-H241 AromaticContact CD1-CE1 3.84Å; F239-H241 PolarHBondContact O-N 3.41Å; F239-H241 VanDerWaalsContact O-N 3.1Å; F239-L242 HydrophobicContact CB-CD1 3.7Å; F239-L242 HydrophobicContact CB-CG 3.94Å; F239-L242 HydrophobicContact CD2-CD1 4.42Å; F239-L242 HydrophobicContact CG-CD1 4.27Å; F239-L242 WeakPolarHBondContact O-CB 3.47Å; F239-L242 PolarHBondContact O-N 3.17Å
240	P	88.2	Confident	89	Confident	83 Å²	83	79 Å²	79	54%	0.539	40%	0.4	S	S	.	.	G	3₁₀ helix	trans	-60.5	-27.2	-175.6	23.2	-34.3	0	0	0	113.3	P236 L242 F243	P236-P240 WeakPolarHBondContact O-CA 3.33Å; P240-L242 PolarHBondContact O-N 3.4Å; P240-F243 CarbonylContact O-C 3.59Å; P240-F243 PolarHBondContact O-N 3.18Å
241	H	89.9	Confident	88.9	Confident	120 Å²	120	80 Å²	80	56%	0.556	40%	0.402	S	S	*	.	G	3₁₀ helix	trans	-63.2	-24.9	177	65.7	-87.5	0	0	0	113.8	F239 F243 T244	F239-H241 AromaticContact CD1-CE1 3.84Å; F239-H241 PolarHBondContact O-N 3.41Å; F239-H241 VanDerWaalsContact O-N 3.1Å; H241-F243 VanDerWaalsContact C-N 3.26Å; H241-T244 WeakPolarHBondContact O-CG2 3.47Å; H241-T244 PolarHBondContact O-OG1 3.27Å; H241-T244 VanDerWaalsContact O-OG1 3.12Å
242	L	91.2	Very high	89	Confident	68 Å²	68	74.7 Å²	74.7	36%	0.356	38%	0.377	S	S	.	.	G	3₁₀ helix	trans	-72.2	-23.9	173.6	-62.4	-179.6	0	0	0	111.9	F239 P240 T244 R247	F239-L242 HydrophobicContact CB-CD1 3.7Å; F239-L242 HydrophobicContact CB-CG 3.94Å; F239-L242 HydrophobicContact CD2-CD1 4.42Å; F239-L242 HydrophobicContact CG-CD1 4.27Å; F239-L242 WeakPolarHBondContact O-CB 3.47Å; F239-L242 PolarHBondContact O-N 3.17Å; P240-L242 PolarHBondContact O-N 3.4Å; L242-T244 PolarHBondContact O-N 3.41Å; L242-R247 WeakPolarHBondContact O-CD 3.19Å; L242-R247 PolarHBondContact O-NE 3.32Å; L242-R247 VanDerWaalsContact O-NE 3.13Å; L242-R247 PolarHBondContact O-NH1 2.91Å
243	F	88.4	Confident	89.2	Confident	57 Å²	57	74.5 Å²	74.5	25%	0.25	38%	0.375	C	S	.	.	S	Bend	trans	-102.8	58.1	-176.3	-65	-94.1	0	0	0	111	L235 P236 P240 H241 R247	L235-F243 HydrophobicContact CB-CE2 4.42Å; L235-F243 HydrophobicContact CB-CZ 4.38Å; L235-F243 HydrophobicContact CD2-CE2 4.28Å; L235-F243 HydrophobicContact CD2-CZ 4.05Å; L235-F243 HydrophobicContact CG-CE2 4.06Å; L235-F243 HydrophobicContact CG-CZ 4.21Å; P236-F243 VanDerWaalsContact CA-CD2 3.49Å; P236-F243 HydrophobicContact CB-CD1 4.28Å; P236-F243 HydrophobicContact CB-CD2 3.93Å; P236-F243 HydrophobicContact CB-CE1 4.25Å; P236-F243 HydrophobicContact CB-CE2 3.91Å; P236-F243 HydrophobicContact CB-CG 4.11Å; P236-F243 HydrophobicContact CB-CZ 4.07Å; P236-F243 HydrophobicContact CG-CD1 4.25Å; P236-F243 HydrophobicContact CG-CD2 4.36Å; P236-F243 HydrophobicContact CG-CE1 3.77Å; P236-F243 HydrophobicContact CG-CE2 3.9Å; P236-F243 HydrophobicContact CG-CZ 3.57Å; P240-F243 CarbonylContact O-C 3.59Å; P240-F243 PolarHBondContact O-N 3.18Å; H241-F243 VanDerWaalsContact C-N 3.26Å; F243-R247 CarbonylContact C-O 3.54Å; F243-R247 WeakPolarHBondContact CA-O 3.48Å; F243-R247 WeakPolarHBondContact CB-O 3.43Å
244	T	86.1	Confident	89.5	Confident	72 Å²	72	74.1 Å²	74.1	44%	0.442	37%	0.373	S	S	.	.			trans	-115.2	150.7	179.2	50.8	0	0	0	0	111.5	H241 L242 K246 R247	H241-T244 WeakPolarHBondContact O-CG2 3.47Å; H241-T244 PolarHBondContact O-OG1 3.27Å; H241-T244 VanDerWaalsContact O-OG1 3.12Å; L242-T244 PolarHBondContact O-N 3.41Å; T244-K246 PolarHBondContact O-N 3.08Å; T244-R247 PolarHBondContact N-O 3.19Å; T244-R247 PolarHBondContact O-N 3.48Å; T244-R247 PolarHBondContact OG1-NH2 3.3Å
245	G	87.9	Confident	89.8	Confident	76 Å²	76	72.5 Å²	72.5	78%	0.784	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.5	-121.8	-178.7	0	0	0	0	0	111.9	R247	G245-R247 VanDerWaalsContact C-N 3.33Å
246	K	87	Confident	90	Very high	209 Å²	209	69.6 Å²	69.6	91%	0.909	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-9.8	179	-65.9	-172	178.7	-178.1	0	114	T244 T248	T244-K246 PolarHBondContact O-N 3.08Å; K246-T248 PolarHBondContact O-N 2.86Å
247	R	89.3	Confident	90.3	Very high	145 Å²	145	68.9 Å²	68.9	55%	0.547	35%	0.345	S	S	.	.			trans	-85.1	92.7	177.3	-66.5	173.4	-66.6	176.9	4.8	107.9	L242 F243 T244 G245	L242-R247 WeakPolarHBondContact O-CD 3.19Å; L242-R247 PolarHBondContact O-NE 3.32Å; L242-R247 VanDerWaalsContact O-NE 3.13Å; L242-R247 PolarHBondContact O-NH1 2.91Å; F243-R247 CarbonylContact C-O 3.54Å; F243-R247 WeakPolarHBondContact CA-O 3.48Å; F243-R247 WeakPolarHBondContact CB-O 3.43Å; T244-R247 PolarHBondContact N-O 3.19Å; T244-R247 PolarHBondContact O-N 3.48Å; T244-R247 PolarHBondContact OG1-NH2 3.3Å; G245-R247 VanDerWaalsContact C-N 3.33Å
248	T	87.3	Confident	90.7	Very high	95 Å²	95	66.1 Å²	66.1	58%	0.583	33%	0.331	S	S	*	.			trans	-107.7	145.8	178.4	53.6	0	0	0	0	110.3	K246	K246-T248 PolarHBondContact O-N 2.86Å
249	P	89.4	Confident	91	Very high	37 Å²	37	62 Å²	62	24%	0.24	32%	0.319	C	S	.	.			trans	-61.6	153.6	171.8	27.1	-34	0	0	0	111.1	P236	P236-P249 HydrophobicContact CB-CB 3.8Å; P236-P249 HydrophobicContact CB-CG 4.49Å; P236-P249 HydrophobicContact CG-CB 3.77Å
250	W	89.6	Confident	91	Very high	109 Å²	109	59.9 Å²	59.9	41%	0.413	32%	0.318	S	S	.	.			trans	-65.6	135.6	174.3	-58.7	107.9	0	0	0	110.3	I253 L356 E376 K377	W250-I253 HydrophobicContact CB-CG1 4.3Å; W250-L356 WeakPolarHBondContact O-CD1 3.46Å; W250-E376 HydrophobicContact CE3-CB 3.42Å; W250-E376 VanDerWaalsContact CE3-CB 3.42Å; W250-E376 HydrophobicContact CE3-CG 4.3Å; W250-E376 HydrophobicContact CZ3-CB 3.64Å; W250-E376 HydrophobicContact CZ3-CG 4.5Å; W250-K377 HydrophobicContact CD2-CB 4.33Å; W250-K377 HydrophobicContact CG-CB 4.3Å
251	R	88.9	Confident	91.1	Very high	98 Å²	98	56.5 Å²	56.5	37%	0.37	30%	0.296	S	S	.	.	S	Bend	trans	-95.4	-23	179.9	-65.8	-175.3	174.6	-153.4	-6.8	113.2	V357 E376	R251-V357 PolarHBondContact O-N 3.4Å; R251-E376 PolarHBondContact N-OE2 2.94Å
252	G	93.2	Very high	91.1	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	121.2	-179.7	0	0	0	0	0	111.5	V357 E376 K377	G252-V357 WeakPolarHBondContact CA-O 3.44Å; G252-E376 PolarHBondContact O-N 2.93Å; G252-E376 VanDerWaalsContact O-N 3.09Å; G252-K377 PolarHBondContact O-N 3.42Å
253	I	94.8	Very high	91.3	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	127.9	174.8	-58	169.8	0	0	0	109	L229 A232 V233 W250 L255 L356 V357 L358 G359 F375 K377 I379	L229-I253 HydrophobicContact CD2-CD1 4.45Å; L229-I253 HydrophobicContact CD2-CG2 4.27Å; A232-I253 HydrophobicContact CB-CD1 3.58Å; V233-I253 HydrophobicContact CG2-CD1 3.58Å; W250-I253 HydrophobicContact CB-CG1 4.3Å; I253-L255 HydrophobicContact CG2-CD2 4.32Å; I253-L356 HydrophobicContact CD1-CD1 3.89Å; I253-L356 HydrophobicContact CD1-CD2 4.23Å; I253-L356 HydrophobicContact CG1-CD1 4.04Å; I253-V357 PolarHBondContact N-O 2.97Å; I253-L358 HydrophobicContact CB-CD2 3.62Å; I253-L358 HydrophobicContact CD1-CD2 4.33Å; I253-L358 HydrophobicContact CG2-CD2 3.79Å; I253-L358 WeakPolarHBondContact O-CA 3.29Å; I253-G359 PolarHBondContact O-N 2.97Å; I253-F375 VanDerWaalsContact C-CD1 3.45Å; I253-F375 WeakPolarHBondContact O-CD1 3.34Å; I253-K377 CarbonylContact C-O 3.58Å; I253-K377 WeakPolarHBondContact CA-O 3.4Å; I253-K377 HydrophobicContact CG1-CB 4.12Å; I253-I379 HydrophobicContact CG2-CD1 3.78Å; I253-I379 HydrophobicContact CG2-CG1 4.22Å
254	L	95.4	Very high	91.4	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	119.8	175.7	-178.9	70.5	0	0	0	110	I319 T361 L367 F375 K377 R378 I379	L254-I319 HydrophobicContact CD1-CG2 3.96Å; L254-T361 HydrophobicContact CD1-CG2 4.06Å; L254-T361 HydrophobicContact CD2-CG2 4.46Å; L254-T361 HydrophobicContact CG-CG2 4.48Å; L254-L367 HydrophobicContact CD1-CD1 4.21Å; L254-L367 HydrophobicContact CD2-CD1 3.64Å; L254-F375 HydrophobicContact CB-CB 3.7Å; L254-F375 HydrophobicContact CB-CD1 3.93Å; L254-F375 HydrophobicContact CB-CG 3.79Å; L254-K377 PolarHBondContact N-O 3.48Å; L254-R378 HydrophobicContact CB-CG 4.3Å; L254-R378 HydrophobicContact CD2-CG 4.49Å; L254-R378 CarbonylContact O-C 3.4Å; L254-R378 WeakPolarHBondContact O-CA 3.21Å; L254-I379 PolarHBondContact O-N 2.98Å
255	L	96.1	Very high	91.6	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	122.1	167.3	-53.9	-176.7	0	0	0	108.6	L229 I253 K263 L266 A267 G359 A360 T361 I379 I381	L229-L255 HydrophobicContact CD1-CD2 4.36Å; L229-L255 HydrophobicContact CD2-CD2 4.27Å; I253-L255 HydrophobicContact CG2-CD2 4.32Å; L255-K263 HydrophobicContact CB-CB 4.48Å; L255-K263 HydrophobicContact CB-CD 4.37Å; L255-K263 HydrophobicContact CB-CG 4.38Å; L255-L266 HydrophobicContact CD1-CD2 4.49Å; L255-A267 HydrophobicContact CD1-CB 4.38Å; L255-G359 PolarHBondContact N-O 2.96Å; L255-A360 VanDerWaalsContact O-CA 3.3Å; L255-A360 WeakPolarHBondContact O-CA 3.44Å; L255-T361 PolarHBondContact O-N 3.25Å; L255-I379 HydrophobicContact CD2-CB 4.03Å; L255-I379 HydrophobicContact CD2-CD1 4.32Å; L255-I379 HydrophobicContact CD2-CG2 4.5Å; L255-I381 HydrophobicContact CB-CG1 4.37Å; L255-I381 HydrophobicContact CD2-CD1 4.43Å
256	F	95.4	Very high	91.8	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	150.1	177.5	73.9	-85.4	0	0	0	111.4	T361 P364 R378 I379 Y380 I381 L516 F519 T520	F256-T361 WeakPolarHBondContact CA-O 3.46Å; F256-T361 HydrophobicContact CB-CG2 3.82Å; F256-P364 HydrophobicContact CB-CB 3.99Å; F256-P364 HydrophobicContact CB-CG 4.13Å; F256-P364 HydrophobicContact CD2-CB 4.27Å; F256-P364 HydrophobicContact CD2-CG 3.74Å; F256-P364 HydrophobicContact CE2-CG 4.5Å; F256-P364 HydrophobicContact CG-CB 4.21Å; F256-P364 HydrophobicContact CG-CG 4.16Å; F256-R378 HydrophobicContact CD1-CB 4.34Å; F256-R378 HydrophobicContact CE1-CB 4.02Å; F256-I379 WeakPolarHBondContact CD1-O 3.46Å; F256-I379 PolarHBondContact N-O 3.41Å; F256-Y380 AromaticContact CD2-CD2 3.88Å; F256-Y380 HydrophobicContact CD2-CD2 3.88Å; F256-Y380 AromaticContact CE2-CD2 3.51Å; F256-Y380 HydrophobicContact CE2-CD2 3.51Å; F256-Y380 HydrophobicContact CE2-CE2 4.42Å; F256-Y380 HydrophobicContact CE2-CG 4.09Å; F256-Y380 HydrophobicContact CZ-CD2 4.1Å; F256-Y380 HydrophobicContact CZ-CG 4.23Å; F256-Y380 CarbonylContact O-C 3.59Å; F256-Y380 WeakPolarHBondContact O-CA 3.39Å; F256-I381 PolarHBondContact O-N 2.91Å; F256-L516 HydrophobicContact CD2-CD2 4.1Å; F256-F519 HydrophobicContact CD1-CE1 4.48Å; F256-F519 HydrophobicContact CD2-CD1 4.08Å; F256-F519 HydrophobicContact CD2-CE1 4.47Å; F256-F519 HydrophobicContact CE1-CD1 4.47Å; F256-F519 HydrophobicContact CE1-CE1 4.34Å; F256-F519 AromaticContact CE2-CD1 3.71Å; F256-F519 HydrophobicContact CE2-CD1 3.71Å; F256-F519 HydrophobicContact CE2-CE1 4.32Å; F256-F519 AromaticContact CZ-CD1 3.93Å; F256-F519 HydrophobicContact CZ-CD1 3.93Å; F256-F519 HydrophobicContact CZ-CE1 4.25Å; F256-T520 WeakPolarHBondContact CE2-OG1 3.38Å; F256-T520 HydrophobicContact CZ-CG2 4.38Å; F256-T520 WeakPolarHBondContact CZ-OG1 3.4Å
257	G	94.9	Very high	92.1	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.189	C	C	.	.			trans	158.6	-179.9	-179.1	0	0	0	0	0	111.8	K263 T361 N362	G257-K263 PolarHBondContact O-NZ 2.87Å; G257-T361 PolarHBondContact N-O 3.15Å; G257-N362 WeakPolarHBondContact O-CA 3.4Å; G257-N362 PolarHBondContact O-OD1 3.02Å
258	P	94.5	Very high	92.2	Very high	1 Å²	1	32.3 Å²	32.3	1%	0.006	18%	0.175	C	C	.	.	S	Bend	trans	-57.7	154.1	-176.9	-18.6	30.5	0	0	0	112.4	T261 K263 I381 L383 V508 L513 L516	P258-T261 HydrophobicContact CB-CG2 4.03Å; P258-T261 HydrophobicContact CG-CG2 4.27Å; P258-T261 WeakPolarHBondContact O-CG2 3.15Å; P258-T261 PolarHBondContact O-OG1 3.32Å; P258-K263 PolarHBondContact O-NZ 2.88Å; P258-I381 WeakPolarHBondContact CD-O 3.4Å; P258-L383 HydrophobicContact CB-CD2 4.1Å; P258-L383 HydrophobicContact CG-CD2 4.16Å; P258-L383 HydrophobicContact CG-CG 4.16Å; P258-V508 HydrophobicContact CB-CB 4.5Å; P258-V508 HydrophobicContact CB-CG1 3.95Å; P258-V508 HydrophobicContact CB-CG2 3.76Å; P258-V508 HydrophobicContact CG-CG1 4.39Å; P258-L513 HydrophobicContact CG-CD2 3.75Å; P258-L516 HydrophobicContact CB-CD1 4.27Å; P258-L516 HydrophobicContact CG-CD1 3.57Å
259	P	92.4	Very high	92.4	Very high	56 Å²	56	27.8 Å²	27.8	36%	0.364	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	149.8	173.7	27.7	-34.9	0	0	0	110.9	T261 N362 V508	P259-T261 VanDerWaalsContact C-N 3.32Å; P259-T261 PolarHBondContact O-N 3.37Å; P259-N362 WeakPolarHBondContact CA-OD1 3.43Å; P259-V508 HydrophobicContact CG-CG2 4.25Å
260	G	90.1	Very high	92.5	Very high	32 Å²	32	26 Å²	26	33%	0.33	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.6	11.3	175.2	0	0	0	0	0	116.1	G262 G421 A422	G260-G262 VanDerWaalsContact C-N 3.35Å; G260-G421 WeakPolarHBondContact O-CA 3.35Å; G260-G421 PolarHBondContact O-N 3.35Å; G260-A422 PolarHBondContact O-N 3.48Å; G260-A422 VanDerWaalsContact O-N 3.17Å
261	T	91.8	Very high	92.5	Very high	11 Å²	11	20.9 Å²	20.9	7%	0.067	12%	0.116	C	C	.	.	S	Bend	trans	-89.5	6.3	176.6	59.1	0	0	0	0	114.5	P258 P259 I381 P382 L383	P258-T261 HydrophobicContact CB-CG2 4.03Å; P258-T261 HydrophobicContact CG-CG2 4.27Å; P258-T261 WeakPolarHBondContact O-CG2 3.15Å; P258-T261 PolarHBondContact O-OG1 3.32Å; P259-T261 VanDerWaalsContact C-N 3.32Å; P259-T261 PolarHBondContact O-N 3.37Å; T261-I381 WeakPolarHBondContact OG1-CG2 3.19Å; T261-P382 WeakPolarHBondContact CG2-O 3.3Å; T261-L383 HydrophobicContact CG2-CD2 3.99Å
262	G	90.4	Very high	92.5	Very high	33 Å²	33	17 Å²	17	34%	0.34	10%	0.103	S	C	.	.			trans	84	22.1	173.2	0	0	0	0	0	115.6	G260 S264 Y265 L266	G260-G262 VanDerWaalsContact C-N 3.35Å; G262-S264 PolarHBondContact O-N 2.92Å; G262-Y265 CarbonylContact O-C 3.6Å; G262-Y265 WeakPolarHBondContact O-CA 3.48Å; G262-Y265 WeakPolarHBondContact O-CB 3.32Å; G262-Y265 PolarHBondContact O-N 3.22Å; G262-L266 WeakPolarHBondContact O-CB 3.43Å; G262-L266 PolarHBondContact O-N 3.03Å
263	K	93.9	Very high	92.2	Very high	10 Å²	10	20.1 Å²	20.1	4%	0.043	12%	0.118	C	C	.	.	H	α-helix	trans	-49.7	-50	175.8	-67.1	-177	-71.4	-76.7	0	113.2	L255 G257 P258 Y265 L266 A267 A360 T361 N362 I381	L255-K263 HydrophobicContact CB-CB 4.48Å; L255-K263 HydrophobicContact CB-CD 4.37Å; L255-K263 HydrophobicContact CB-CG 4.38Å; G257-K263 PolarHBondContact O-NZ 2.87Å; P258-K263 PolarHBondContact O-NZ 2.88Å; K263-Y265 VanDerWaalsContact C-N 3.32Å; K263-Y265 PolarHBondContact O-N 3.22Å; K263-L266 PolarHBondContact O-N 3.11Å; K263-A267 PolarHBondContact O-N 3.38Å; K263-A360 HydrophobicContact CB-CB 4.19Å; K263-A360 HydrophobicContact CD-CB 4.42Å; K263-T361 WeakPolarHBondContact CE-O 3.48Å; K263-N362 VanDerWaalsContact CE-OD1 3.22Å; K263-N362 WeakPolarHBondContact CE-OD1 3.3Å; K263-N362 PolarHBondContact NZ-OD1 2.85Å; K263-I381 HydrophobicContact CG-CB 4.15Å; K263-I381 HydrophobicContact CG-CG1 4Å; K263-I381 HydrophobicContact CG-CG2 4.32Å
264	S	90.9	Very high	91.7	Very high	39 Å²	39	20.2 Å²	20.2	27%	0.273	12%	0.118	S	C	.	.	H	α-helix	trans	-68.8	-32.2	179.3	-29.8	0	0	0	0	111.8	G262 K268 D317	G262-S264 PolarHBondContact O-N 2.92Å; S264-K268 WeakPolarHBondContact O-CG 3.39Å; S264-K268 PolarHBondContact O-N 2.99Å; S264-D317 PolarHBondContact OG-OD2 3.27Å
265	Y	90.2	Very high	90.9	Very high	102 Å²	102	26.1 Å²	26.1	40%	0.4	15%	0.15	S	C	.	.	H	α-helix	trans	-70.2	-40.9	175.7	-160.5	-104.4	0	0	0	111.7	I214 D218 V219 G262 K263 K268 A269	I214-Y265 HydrophobicContact CD1-CD2 3.73Å; I214-Y265 HydrophobicContact CD1-CE2 3.4Å; I214-Y265 HydrophobicContact CD1-CG 4.47Å; I214-Y265 HydrophobicContact CG1-CE2 4.03Å; I214-Y265 HydrophobicContact CG2-CD1 4.16Å; I214-Y265 HydrophobicContact CG2-CE1 3.57Å; I214-Y265 HydrophobicContact CG2-CE2 4.23Å; D218-Y265 HydrophobicContact CB-CE1 4.41Å; V219-Y265 HydrophobicContact CG2-CD1 3.94Å; V219-Y265 HydrophobicContact CG2-CE1 4.1Å; G262-Y265 CarbonylContact O-C 3.6Å; G262-Y265 WeakPolarHBondContact O-CA 3.48Å; G262-Y265 WeakPolarHBondContact O-CB 3.32Å; G262-Y265 PolarHBondContact O-N 3.22Å; K263-Y265 VanDerWaalsContact C-N 3.32Å; K263-Y265 PolarHBondContact O-N 3.22Å; Y265-K268 PolarHBondContact O-N 3.37Å; Y265-A269 PolarHBondContact O-N 2.82Å
266	L	92.6	Very high	90	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-63.5	-41.7	174.4	-174.2	68.1	0	0	0	111.5	W216 V219 A225 K226 L229 L255 G262 K263 K268 A269 V270 I381	W216-L266 HydrophobicContact CE3-CD1 4.46Å; W216-L266 HydrophobicContact CZ3-CD1 3.74Å; V219-L266 HydrophobicContact CG1-CD1 4.08Å; A225-L266 HydrophobicContact CB-CD2 4.44Å; K226-L266 HydrophobicContact CG-CD1 4.3Å; L229-L266 HydrophobicContact CD1-CD1 4.06Å; L229-L266 HydrophobicContact CD1-CD2 3.49Å; L229-L266 VanDerWaalsContact CD1-CD2 3.49Å; L229-L266 HydrophobicContact CD1-CG 3.57Å; L255-L266 HydrophobicContact CD1-CD2 4.49Å; G262-L266 WeakPolarHBondContact O-CB 3.43Å; G262-L266 PolarHBondContact O-N 3.03Å; K263-L266 PolarHBondContact O-N 3.11Å; L266-K268 VanDerWaalsContact C-N 3.33Å; L266-K268 PolarHBondContact O-N 3.13Å; L266-A269 WeakPolarHBondContact O-CB 3.43Å; L266-A269 PolarHBondContact O-N 3.14Å; L266-V270 VanDerWaalsContact O-CG2 3.3Å; L266-V270 WeakPolarHBondContact O-CG2 3.29Å; L266-V270 PolarHBondContact O-N 2.98Å; L266-I381 HydrophobicContact CD2-CD1 3.63Å; L266-I381 HydrophobicContact CD2-CG1 4.49Å
267	A	92.2	Very high	89.4	Confident	0 Å²	0	30 Å²	30	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-61.6	-39.9	175.5	0	0	0	0	0	112.5	L255 K263 V270 A271 F279 F315 L358	L255-A267 HydrophobicContact CD1-CB 4.38Å; K263-A267 PolarHBondContact O-N 3.38Å; A267-V270 WeakPolarHBondContact O-CB 3.34Å; A267-V270 PolarHBondContact O-N 3.14Å; A267-A271 PolarHBondContact O-N 2.91Å; A267-A271 VanDerWaalsContact O-N 3.16Å; A267-F279 HydrophobicContact CB-CE2 4.34Å; A267-F279 HydrophobicContact CB-CZ 4.24Å; A267-F315 HydrophobicContact CB-CD2 3.42Å; A267-F315 VanDerWaalsContact CB-CD2 3.42Å; A267-F315 HydrophobicContact CB-CE2 3.44Å; A267-F315 VanDerWaalsContact CB-CE2 3.44Å; A267-F315 HydrophobicContact CB-CG 4.09Å; A267-F315 HydrophobicContact CB-CZ 4.14Å; A267-L358 HydrophobicContact CB-CD1 4.31Å
268	K	91.3	Very high	89.1	Confident	56 Å²	56	31.2 Å²	31.2	24%	0.243	18%	0.179	C	C	.	.	H	α-helix	trans	-65.2	-39.9	173.4	-69.2	179.2	-172.7	-124.6	0	111.9	E210 P212 I214 S264 Y265 L266 V270 A271 T272 F279	E210-K268 VanDerWaalsContact OE1-CE 3.26Å; E210-K268 WeakPolarHBondContact OE1-CE 3.33Å; E210-K268 IonicContact OE1-NZ 2.9Å; E210-K268 PolarHBondContact OE1-NZ 3.48Å; E210-K268 IonicContact OE2-NZ 3.96Å; E210-K268 PolarHBondContact OE2-NZ 2.9Å; P212-K268 HydrophobicContact CB-CB 3.85Å; P212-K268 HydrophobicContact CB-CG 4.26Å; P212-K268 HydrophobicContact CG-CB 4.17Å; P212-K268 WeakPolarHBondContact CG-O 3.5Å; I214-K268 HydrophobicContact CD1-CB 3.67Å; I214-K268 HydrophobicContact CD1-CD 3.85Å; I214-K268 HydrophobicContact CD1-CG 4.41Å; S264-K268 WeakPolarHBondContact O-CG 3.39Å; S264-K268 PolarHBondContact O-N 2.99Å; Y265-K268 PolarHBondContact O-N 3.37Å; L266-K268 VanDerWaalsContact C-N 3.33Å; L266-K268 PolarHBondContact O-N 3.13Å; K268-V270 PolarHBondContact O-N 3.07Å; K268-A271 PolarHBondContact O-N 3.41Å; K268-A271 VanDerWaalsContact O-N 3.17Å; K268-T272 PolarHBondContact O-N 3.42Å; K268-T272 PolarHBondContact O-OG1 3.39Å; K268-F279 HydrophobicContact CG-CE1 3.94Å; K268-F279 HydrophobicContact CG-CZ 4.07Å
269	A	91.8	Very high	89	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-61.4	-43.1	175.9	0	0	0	0	0	112.2	I214 W216 V219 Y265 L266 A271 T272 E273	I214-A269 HydrophobicContact CB-CB 4.48Å; I214-A269 HydrophobicContact CG2-CB 3.85Å; I214-A269 WeakPolarHBondContact O-CA 3.34Å; W216-A269 HydrophobicContact CE3-CB 4.28Å; W216-A269 HydrophobicContact CZ3-CB 4.36Å; V219-A269 HydrophobicContact CG2-CB 3.75Å; Y265-A269 PolarHBondContact O-N 2.82Å; L266-A269 WeakPolarHBondContact O-CB 3.43Å; L266-A269 PolarHBondContact O-N 3.14Å; A269-A271 VanDerWaalsContact C-N 3.27Å; A269-A271 PolarHBondContact O-N 3.39Å; A269-T272 PolarHBondContact O-N 3.4Å; A269-E273 WeakPolarHBondContact O-CB 2.85Å; A269-E273 WeakPolarHBondContact O-CG 3.48Å; A269-E273 PolarHBondContact O-N 3.48Å
270	V	91.8	Very high	89	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-55.8	-44.4	173.2	174	0	0	0	0	110.9	W216 L229 V233 L266 A267 K268 E273 A274 I313 L358	W216-V270 HydrophobicContact CH2-CB 4.33Å; W216-V270 HydrophobicContact CH2-CG2 3.49Å; W216-V270 VanDerWaalsContact CH2-CG2 3.49Å; W216-V270 HydrophobicContact CZ2-CG2 4.28Å; W216-V270 HydrophobicContact CZ3-CG2 4.22Å; L229-V270 HydrophobicContact CB-CG2 4.09Å; L229-V270 HydrophobicContact CD1-CG2 3.7Å; L229-V270 HydrophobicContact CD2-CG2 4Å; L229-V270 HydrophobicContact CG-CG2 4.15Å; V233-V270 HydrophobicContact CB-CG1 3.99Å; V233-V270 HydrophobicContact CG1-CG1 3.7Å; V233-V270 HydrophobicContact CG2-CG1 3.98Å; L266-V270 VanDerWaalsContact O-CG2 3.3Å; L266-V270 WeakPolarHBondContact O-CG2 3.29Å; L266-V270 PolarHBondContact O-N 2.98Å; A267-V270 WeakPolarHBondContact O-CB 3.34Å; A267-V270 PolarHBondContact O-N 3.14Å; K268-V270 PolarHBondContact O-N 3.07Å; V270-E273 PolarHBondContact O-N 2.94Å; V270-A274 WeakPolarHBondContact O-CB 3.38Å; V270-A274 PolarHBondContact O-N 3.19Å; V270-I313 HydrophobicContact CG1-CD1 4.1Å; V270-L358 HydrophobicContact CG1-CD1 4.37Å
271	A	89.4	Confident	89.1	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-68.1	-38.7	-177.4	0	0	0	0	0	113.6	P212 A267 K268 A269 E273 S277 F279 I313	P212-A271 HydrophobicContact CG-CB 3.77Å; A267-A271 PolarHBondContact O-N 2.91Å; A267-A271 VanDerWaalsContact O-N 3.16Å; K268-A271 PolarHBondContact O-N 3.41Å; K268-A271 VanDerWaalsContact O-N 3.17Å; A269-A271 VanDerWaalsContact C-N 3.27Å; A269-A271 PolarHBondContact O-N 3.39Å; A271-E273 VanDerWaalsContact C-N 3.34Å; A271-S277 PolarHBondContact O-N 2.99Å; A271-F279 HydrophobicContact CB-CB 3.94Å; A271-F279 HydrophobicContact CB-CD2 3.35Å; A271-F279 HydrophobicContact CB-CE2 4.04Å; A271-F279 HydrophobicContact CB-CG 3.91Å; A271-I313 HydrophobicContact CB-CD1 4.04Å
272	T	89.4	Confident	88.9	Confident	16 Å²	16	27.9 Å²	27.9	10%	0.098	15%	0.152	C	C	.	.	H	α-helix	trans	-60.9	-45.5	172.2	-57.3	0	0	0	0	111	P212 I214 K268 A269 N276	P212-T272 PolarHBondContact O-OG1 3.31Å; I214-T272 PolarHBondContact N-OG1 3.11Å; I214-T272 VanDerWaalsContact N-OG1 3.11Å; I214-T272 WeakPolarHBondContact O-CB 3.22Å; I214-T272 WeakPolarHBondContact O-CG2 3.4Å; I214-T272 PolarHBondContact O-OG1 2.79Å; I214-T272 VanDerWaalsContact O-OG1 3.14Å; K268-T272 PolarHBondContact O-N 3.42Å; K268-T272 PolarHBondContact O-OG1 3.39Å; A269-T272 PolarHBondContact O-N 3.4Å; T272-N276 PolarHBondContact O-N 3.29Å
273	E	87.7	Confident	88.6	Confident	67 Å²	67	27.7 Å²	27.7	31%	0.313	15%	0.146	S	C	.	.	H	α-helix	trans	-79.6	-21.7	-173.3	-64.8	-83.7	175.4	0	0	112.8	W216 I234 A269 V270 A271 N275	W216-E273 HydrophobicContact CD2-CG 4.17Å; W216-E273 HydrophobicContact CG-CG 4Å; W216-E273 HydrophobicContact CZ2-CB 4.16Å; W216-E273 HydrophobicContact CZ2-CG 4.41Å; W216-E273 PolarHBondContact N-OE1 3.39Å; W216-E273 VanDerWaalsContact NE1-CB 3.34Å; W216-E273 PolarHBondContact NE1-OE2 2.98Å; I234-E273 HydrophobicContact CD1-CB 4.08Å; A269-E273 WeakPolarHBondContact O-CB 2.85Å; A269-E273 WeakPolarHBondContact O-CG 3.48Å; A269-E273 PolarHBondContact O-N 3.48Å; V270-E273 PolarHBondContact O-N 2.94Å; A271-E273 VanDerWaalsContact C-N 3.34Å; E273-N275 PolarHBondContact O-N 2.93Å
274	A	84.3	Confident	87.9	Confident	1 Å²	1	27.3 Å²	27.3	1%	0.008	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	57.3	174.2	0	0	0	0	0	111.9	V233 I234 I237 V270 N276 S277 I313	V233-A274 HydrophobicContact CG1-CB 4.13Å; I234-A274 HydrophobicContact CD1-CB 3.89Å; I237-A274 HydrophobicContact CD1-CB 3.73Å; V270-A274 WeakPolarHBondContact O-CB 3.38Å; V270-A274 PolarHBondContact O-N 3.19Å; A274-N276 PolarHBondContact O-N 2.79Å; A274-N276 VanDerWaalsContact O-N 3.16Å; A274-S277 VanDerWaalsContact O-CB 3.29Å; A274-S277 WeakPolarHBondContact O-CB 3.24Å; A274-S277 PolarHBondContact O-N 3.19Å; A274-S277 VanDerWaalsContact O-N 3.08Å; A274-S277 PolarHBondContact O-OG 3.45Å; A274-I313 HydrophobicContact CB-CD1 4.16Å
275	N	78.3	Confident	87.2	Confident	124 Å²	124	28.8 Å²	28.8	66%	0.663	16%	0.155	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.9	35	-178.1	-72	-7.4	0	0	0	113.8	I237 E273 S277	I237-N275 HydrophobicContact CG2-CB 4.33Å; I237-N275 WeakPolarHBondContact CG2-ND2 3.45Å; E273-N275 PolarHBondContact O-N 2.93Å; N275-S277 PolarHBondContact O-N 2.72Å
276	N	78	Confident	86.5	Confident	76 Å²	76	27.7 Å²	27.7	41%	0.406	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.1	36.5	180	-141	97.5	0	0	0	112.8	T272 A274	T272-N276 PolarHBondContact O-N 3.29Å; A274-N276 PolarHBondContact O-N 2.79Å; A274-N276 VanDerWaalsContact O-N 3.16Å
277	S	82.3	Confident	85.5	Confident	5 Å²	5	27.8 Å²	27.8	4%	0.035	16%	0.156	C	C	.	.			trans	-53.6	152.1	179.9	-74.9	0	0	0	0	112.2	A271 A274 N275 F279 P311	A271-S277 PolarHBondContact O-N 2.99Å; A274-S277 VanDerWaalsContact O-CB 3.29Å; A274-S277 WeakPolarHBondContact O-CB 3.24Å; A274-S277 PolarHBondContact O-N 3.19Å; A274-S277 VanDerWaalsContact O-N 3.08Å; A274-S277 PolarHBondContact O-OG 3.45Å; N275-S277 PolarHBondContact O-N 2.72Å; S277-F279 PolarHBondContact O-N 3.49Å; S277-P311 WeakPolarHBondContact CB-O 3.2Å; S277-P311 WeakPolarHBondContact OG-CG 3.44Å
278	T	89	Confident	84.4	Confident	27 Å²	27	31.7 Å²	31.7	17%	0.166	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	121.3	177.4	-50	0	0	0	0	109.5	F280 H309 P311 S312 I313	T278-F280 HydrophobicContact CG2-CD2 4.16Å; T278-F280 HydrophobicContact CG2-CE1 4.49Å; T278-F280 HydrophobicContact CG2-CE2 3.5Å; T278-F280 VanDerWaalsContact CG2-CE2 3.5Å; T278-F280 HydrophobicContact CG2-CZ 3.71Å; T278-H309 HydrophobicContact CG2-CB 4.05Å; T278-H309 PolarHBondContact OG1-O 3.43Å; T278-P311 PolarHBondContact N-O 3.42Å; T278-S312 WeakPolarHBondContact O-CA 3.34Å; T278-I313 PolarHBondContact O-N 2.75Å
279	F	92.2	Very high	83.1	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	116	179.5	-169.7	-106	0	0	0	110.3	E210 P212 A267 K268 A271 S277 I313 F315	E210-F279 HydrophobicContact CG-CB 4.31Å; E210-F279 HydrophobicContact CG-CD1 3.66Å; E210-F279 HydrophobicContact CG-CG 4.46Å; E210-F279 PolarHBondContact N-O 3.41Å; E210-F279 WeakPolarHBondContact O-CB 3.44Å; E210-F279 PolarHBondContact O-N 3.49Å; E210-F279 WeakPolarHBondContact OE1-CD1 3.14Å; E210-F279 WeakPolarHBondContact OE1-CE1 3.38Å; P212-F279 HydrophobicContact CG-CB 4.33Å; P212-F279 HydrophobicContact CG-CG 4.47Å; A267-F279 HydrophobicContact CB-CE2 4.34Å; A267-F279 HydrophobicContact CB-CZ 4.24Å; K268-F279 HydrophobicContact CG-CE1 3.94Å; K268-F279 HydrophobicContact CG-CZ 4.07Å; A271-F279 HydrophobicContact CB-CB 3.94Å; A271-F279 HydrophobicContact CB-CD2 3.35Å; A271-F279 HydrophobicContact CB-CE2 4.04Å; A271-F279 HydrophobicContact CB-CG 3.91Å; S277-F279 PolarHBondContact O-N 3.49Å; F279-I313 HydrophobicContact CD2-CB 4.13Å; F279-I313 HydrophobicContact CD2-CG2 3.92Å; F279-I313 HydrophobicContact CE2-CG2 4.04Å; F279-F315 HydrophobicContact CD2-CB 4.42Å; F279-F315 HydrophobicContact CE1-CB 4.01Å; F279-F315 HydrophobicContact CE1-CD1 4.35Å; F279-F315 HydrophobicContact CE1-CG 4.42Å; F279-F315 HydrophobicContact CE2-CB 3.48Å; F279-F315 VanDerWaalsContact CE2-CB 3.48Å; F279-F315 HydrophobicContact CE2-CG 4.13Å; F279-F315 HydrophobicContact CZ-CB 3.24Å; F279-F315 AromaticContact CZ-CD1 3.84Å; F279-F315 HydrophobicContact CZ-CD1 3.84Å; F279-F315 HydrophobicContact CZ-CD2 4.38Å; F279-F315 AromaticContact CZ-CG 3.57Å; F279-F315 HydrophobicContact CZ-CG 3.57Å
280	F	92.4	Very high	81.5	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	106.5	173.2	-64.3	-88.8	0	0	0	108.2	I207 M209 T278 L302 L305 A306 H309 I313 I314 F315	I207-F280 HydrophobicContact CG2-CB 4.37Å; I207-F280 HydrophobicContact CG2-CD1 3.64Å; I207-F280 HydrophobicContact CG2-CE1 4.49Å; M209-F280 HydrophobicContact CG-CD1 3.65Å; M209-F280 HydrophobicContact CG-CE1 3.49Å; M209-F280 VanDerWaalsContact CG-CE1 3.49Å; M209-F280 HydrophobicContact CG-CZ 4.42Å; M209-F280 HydrophobicContact SD-CD1 4.32Å; M209-F280 HydrophobicContact SD-CE1 3.55Å; M209-F280 VanDerWaalsContact SD-CE1 3.55Å; M209-F280 HydrophobicContact SD-CZ 4.23Å; T278-F280 HydrophobicContact CG2-CD2 4.16Å; T278-F280 HydrophobicContact CG2-CE1 4.49Å; T278-F280 HydrophobicContact CG2-CE2 3.5Å; T278-F280 VanDerWaalsContact CG2-CE2 3.5Å; T278-F280 HydrophobicContact CG2-CZ 3.71Å; F280-L302 HydrophobicContact CB-CD1 4.01Å; F280-L302 HydrophobicContact CD1-CD1 4.26Å; F280-L302 HydrophobicContact CG-CD1 4.35Å; F280-L305 HydrophobicContact CE1-CB 4.04Å; F280-L305 HydrophobicContact CZ-CB 4.29Å; F280-A306 HydrophobicContact CD2-CB 4.16Å; F280-A306 HydrophobicContact CE2-CB 4.01Å; F280-H309 HydrophobicContact CE2-CB 4.13Å; F280-H309 HydrophobicContact CZ-CB 3.92Å; F280-I313 PolarHBondContact N-O 2.7Å; F280-I314 HydrophobicContact CB-CG1 4.48Å; F280-F315 PolarHBondContact O-N 2.86Å
281	S	90.6	Very high	79.8	Confident	27 Å²	27	49.6 Å²	49.6	19%	0.189	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	127.1	175.7	-170.9	0	0	0	0	109.9	V208	V208-S281 PolarHBondContact N-O 2.88Å; V208-S281 PolarHBondContact O-N 3.22Å
282	I	89.2	Confident	78.5	Confident	2 Å²	2	56.5 Å²	56.5	1%	0.01	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	134.7	174.9	-170.2	156.3	0	0	0	110.7	I207 D286 L287 L298 L302 F315 I316 D317	I207-I282 HydrophobicContact CG1-CD1 4.25Å; I282-D286 HydrophobicContact CG1-CB 4.31Å; I282-L287 HydrophobicContact CD1-CD1 3.94Å; I282-L287 HydrophobicContact CD1-CD2 3.35Å; I282-L287 HydrophobicContact CD1-CG 3.43Å; I282-L287 VanDerWaalsContact CD1-CG 3.43Å; I282-L287 HydrophobicContact CG1-CD1 4.16Å; I282-L287 HydrophobicContact CG1-CD2 4.33Å; I282-L287 HydrophobicContact CG1-CG 3.87Å; I282-L287 HydrophobicContact CG2-CD1 4.34Å; I282-L298 HydrophobicContact CD1-CD2 3.85Å; I282-L302 HydrophobicContact CD1-CD2 4.31Å; I282-L302 HydrophobicContact CG2-CD2 4.1Å; I282-F315 PolarHBondContact N-O 3.18Å; I282-I316 HydrophobicContact CG2-CB 4.48Å; I282-I316 HydrophobicContact CG2-CG1 3.84Å; I282-I316 WeakPolarHBondContact O-CA 3.23Å; I282-D317 PolarHBondContact O-N 3.13Å
283	S	84.1	Confident	77.5	Confident	30 Å²	30	57.2 Å²	57.2	21%	0.21	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	143.2	167.4	-176.6	0	0	0	0	109.4	S285 D286	S283-S285 WeakPolarHBondContact CB-OG 3.25Å; S283-S285 PolarHBondContact O-N 3.24Å; S283-S285 PolarHBondContact OG-N 3.44Å; S283-S285 PolarHBondContact OG-OG 3.31Å; S283-D286 WeakPolarHBondContact CB-OD2 3.33Å; S283-D286 PolarHBondContact N-OD2 2.86Å; S283-D286 WeakPolarHBondContact O-CB 3.47Å; S283-D286 PolarHBondContact O-N 3.04Å
284	S	78.3	Confident	77.1	Confident	1 Å²	1	56.9 Å²	56.9	1%	0.007	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-26.6	174	-70	0	0	0	0	113.3	I316 D317 E318 I319 S321 L322	S284-I316 WeakPolarHBondContact OG-CG2 3.44Å; S284-D317 WeakPolarHBondContact CB-O 3.47Å; S284-D317 PolarHBondContact N-O 3.14Å; S284-D317 PolarHBondContact OG-O 3.39Å; S284-E318 WeakPolarHBondContact CB-O 3.27Å; S284-E318 PolarHBondContact OG-O 3.09Å; S284-E318 VanDerWaalsContact OG-O 3.06Å; S284-I319 WeakPolarHBondContact OG-CA 3.4Å; S284-S321 WeakPolarHBondContact CB-OG 3.5Å; S284-L322 WeakPolarHBondContact OG-CD1 3.31Å
285	S	75.8	Confident	76.9	Confident	71 Å²	71	57.1 Å²	57.1	50%	0.497	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-34.2	172.1	55.9	0	0	0	0	113.7	S283 L287 V288	S283-S285 WeakPolarHBondContact CB-OG 3.25Å; S283-S285 PolarHBondContact O-N 3.24Å; S283-S285 PolarHBondContact OG-N 3.44Å; S283-S285 PolarHBondContact OG-OG 3.31Å; S285-L287 PolarHBondContact O-N 3.47Å; S285-V288 PolarHBondContact O-N 3.47Å
286	D	76.2	Confident	77.2	Confident	78 Å²	78	53.7 Å²	53.7	42%	0.417	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-23.1	-175.7	-55	-26.2	0	0	0	111.2	I282 S283 V288	I282-D286 HydrophobicContact CG1-CB 4.31Å; S283-D286 WeakPolarHBondContact CB-OD2 3.33Å; S283-D286 PolarHBondContact N-OD2 2.86Å; S283-D286 WeakPolarHBondContact O-CB 3.47Å; S283-D286 PolarHBondContact O-N 3.04Å; D286-V288 VanDerWaalsContact C-N 3.31Å
287	L	72.1	Confident	77.5	Confident	2 Å²	2	55.6 Å²	55.6	1%	0.01	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-15.2	175.7	-75.3	172.8	0	0	0	113.6	I282 S285 S295 L298 V299 L322	I282-L287 HydrophobicContact CD1-CD1 3.94Å; I282-L287 HydrophobicContact CD1-CD2 3.35Å; I282-L287 HydrophobicContact CD1-CG 3.43Å; I282-L287 VanDerWaalsContact CD1-CG 3.43Å; I282-L287 HydrophobicContact CG1-CD1 4.16Å; I282-L287 HydrophobicContact CG1-CD2 4.33Å; I282-L287 HydrophobicContact CG1-CG 3.87Å; I282-L287 HydrophobicContact CG2-CD1 4.34Å; S285-L287 PolarHBondContact O-N 3.47Å; L287-S295 WeakPolarHBondContact O-CB 3.47Å; L287-S295 PolarHBondContact O-OG 3.22Å; L287-L298 HydrophobicContact CD2-CD1 4.41Å; L287-L298 HydrophobicContact CD2-CD2 3.44Å; L287-L298 VanDerWaalsContact CD2-CD2 3.44Å; L287-L298 HydrophobicContact CD2-CG 4.34Å; L287-V299 HydrophobicContact CD2-CG2 3.82Å; L287-L322 HydrophobicContact CB-CD1 3.94Å; L287-L322 HydrophobicContact CB-CD2 4.05Å; L287-L322 HydrophobicContact CD1-CD1 3.33Å; L287-L322 HydrophobicContact CG-CD1 4.2Å
288	V	69.4	Low	77.7	Confident	82 Å²	82	56.2 Å²	56.2	50%	0.497	29%	0.292	S	S	.	.			trans	-100.3	94.1	-178.3	-175.4	0	0	0	0	109.5	S285 D286 L322	S285-V288 PolarHBondContact O-N 3.47Å; D286-V288 VanDerWaalsContact C-N 3.31Å; V288-L322 HydrophobicContact CG2-CD2 3.75Å
289	S	64.1	Low	77.6	Confident	39 Å²	39	55 Å²	55	27%	0.273	28%	0.284	S	S	.	.			trans	-89.3	154.8	175.9	72.2	0	0	0	0	112.2	W291 S295	S289-W291 PolarHBondContact O-N 2.99Å; S289-W291 PolarHBondContact OG-O 3.2Å; S289-S295 PolarHBondContact N-OG 3.49Å; S289-S295 PolarHBondContact OG-OG 3.08Å
290	K	58.1	Low	77.4	Confident	210 Å²	210	59.3 Å²	59.3	91%	0.913	30%	0.303	S	S	*	.	S	Bend	trans	-70.9	-15.5	175.3	-70.3	-177.2	179.4	177.5	0	113.2
291	W	55.8	Low	77.2	Confident	184 Å²	184	61.9 Å²	61.9	70%	0.697	32%	0.317	S	S	*	.	S	Bend	trans	-101.5	121	-175.2	-62.3	104.1	0	0	0	110.7	S289 G293 E294	S289-W291 PolarHBondContact O-N 2.99Å; S289-W291 PolarHBondContact OG-O 3.2Å; W291-G293 PolarHBondContact O-N 3.47Å; W291-E294 HydrophobicContact CB-CB 4.47Å; W291-E294 HydrophobicContact CB-CG 4Å; W291-E294 WeakPolarHBondContact CB-OE2 3.35Å; W291-E294 PolarHBondContact O-N 2.57Å
292	L	60.6	Low	77.2	Confident	145 Å²	145	60.7 Å²	60.7	76%	0.759	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	126.2	179.8	-81.3	131	0	0	0	111.4	E294	L292-E294 PolarHBondContact O-N 3.4Å
293	G	69.8	Low	77.3	Confident	31 Å²	31	60.6 Å²	60.6	32%	0.32	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.6	-18.6	174.7	0	0	0	0	0	115.9	W291 S295 K297	W291-G293 PolarHBondContact O-N 3.47Å; G293-S295 VanDerWaalsContact C-N 3.34Å; G293-K297 PolarHBondContact O-N 3.44Å
294	E	78.2	Confident	77.5	Confident	60 Å²	60	61.2 Å²	61.2	28%	0.28	31%	0.312	S	S	.	.	H	α-helix	trans	-66.4	-37.8	175.2	-73.6	-172.6	166.7	0	0	111.8	F199 W291 L292 E296 K297 L298	F199-E294 HydrophobicContact CE2-CB 4.48Å; W291-E294 HydrophobicContact CB-CB 4.47Å; W291-E294 HydrophobicContact CB-CG 4Å; W291-E294 WeakPolarHBondContact CB-OE2 3.35Å; W291-E294 PolarHBondContact O-N 2.57Å; L292-E294 PolarHBondContact O-N 3.4Å; E294-E296 PolarHBondContact O-N 2.86Å; E294-K297 PolarHBondContact O-N 3.45Å; E294-L298 PolarHBondContact O-N 2.98Å
295	S	81	Confident	78	Confident	6 Å²	6	63 Å²	63	4%	0.042	32%	0.322	C	S	.	.	H	α-helix	trans	-63.6	-38.5	-179.6	-53.1	0	0	0	0	113.1	L287 S289 G293 L298 V299	L287-S295 WeakPolarHBondContact O-CB 3.47Å; L287-S295 PolarHBondContact O-OG 3.22Å; S289-S295 PolarHBondContact N-OG 3.49Å; S289-S295 PolarHBondContact OG-OG 3.08Å; G293-S295 VanDerWaalsContact C-N 3.34Å; S295-L298 WeakPolarHBondContact O-CB 3.38Å; S295-L298 PolarHBondContact O-N 3.28Å; S295-V299 PolarHBondContact O-N 2.92Å; S295-V299 VanDerWaalsContact O-N 3.14Å
296	E	84.6	Confident	78.7	Confident	52 Å²	52	59.7 Å²	59.7	24%	0.243	30%	0.298	C	S	.	.	H	α-helix	trans	-67.2	-43.1	177	-66.1	169.4	-152	0	0	111.4	E294 L298 V299 K300 R336 E340	E294-E296 PolarHBondContact O-N 2.86Å; E296-L298 PolarHBondContact O-N 3.45Å; E296-V299 PolarHBondContact O-N 3.33Å; E296-K300 PolarHBondContact O-N 3.48Å; E296-R336 HydrophobicContact CG-CB 4.27Å; E296-R336 WeakPolarHBondContact OE1-CB 3.3Å; E296-R336 WeakPolarHBondContact OE1-CD 3.15Å; E296-E340 HydrophobicContact CB-CG 4.5Å
297	K	84.7	Confident	79.4	Confident	115 Å²	115	57.7 Å²	57.7	50%	0.5	29%	0.285	S	S	.	.	H	α-helix	trans	-61	-36.3	174.5	-70.3	-177.9	179.8	-176.9	0	111.2	F199 G293 E294 K300 N301	F199-K297 HydrophobicContact CE1-CB 3.89Å; F199-K297 HydrophobicContact CE2-CB 4.09Å; F199-K297 HydrophobicContact CZ-CB 3.44Å; F199-K297 VanDerWaalsContact CZ-CB 3.44Å; G293-K297 PolarHBondContact O-N 3.44Å; E294-K297 PolarHBondContact O-N 3.45Å; K297-K300 PolarHBondContact O-N 3.37Å; K297-N301 WeakPolarHBondContact O-CB 3.4Å; K297-N301 PolarHBondContact O-N 3.31Å
298	L	84.9	Confident	80.2	Confident	19 Å²	19	64.3 Å²	64.3	10%	0.099	32%	0.316	C	S	.	.	H	α-helix	trans	-63.9	-48	178.2	-162.3	170.5	0	0	0	110.4	F199 L203 A206 I207 I282 L287 E294 S295 E296 K300 N301 L302	F199-L298 HydrophobicContact CZ-CB 4.22Å; L203-L298 HydrophobicContact CD2-CD2 4.24Å; L203-L298 HydrophobicContact CD2-CG 3.91Å; A206-L298 HydrophobicContact CB-CD1 4.16Å; I207-L298 HydrophobicContact CD1-CD2 4.15Å; I207-L298 HydrophobicContact CG1-CD2 4.25Å; I282-L298 HydrophobicContact CD1-CD2 3.85Å; L287-L298 HydrophobicContact CD2-CD1 4.41Å; L287-L298 HydrophobicContact CD2-CD2 3.44Å; L287-L298 VanDerWaalsContact CD2-CD2 3.44Å; L287-L298 HydrophobicContact CD2-CG 4.34Å; E294-L298 PolarHBondContact O-N 2.98Å; S295-L298 WeakPolarHBondContact O-CB 3.38Å; S295-L298 PolarHBondContact O-N 3.28Å; E296-L298 PolarHBondContact O-N 3.45Å; L298-K300 PolarHBondContact O-N 3.22Å; L298-N301 PolarHBondContact O-N 3.47Å; L298-L302 WeakPolarHBondContact O-CB 3.48Å; L298-L302 PolarHBondContact O-N 3Å
299	V	88.4	Confident	81.1	Confident	1 Å²	1	64.4 Å²	64.4	1%	0.006	31%	0.31	C	S	.	.	H	α-helix	trans	-60	-45.4	176.1	175.6	0	0	0	0	111.6	L287 S295 E296 N301 L302 F303 I337 E340 F341 Q344	L287-V299 HydrophobicContact CD2-CG2 3.82Å; S295-V299 PolarHBondContact O-N 2.92Å; S295-V299 VanDerWaalsContact O-N 3.14Å; E296-V299 PolarHBondContact O-N 3.33Å; V299-N301 VanDerWaalsContact C-N 3.33Å; V299-N301 PolarHBondContact O-N 2.92Å; V299-L302 PolarHBondContact O-N 3.21Å; V299-F303 HydrophobicContact CG1-CD2 4.32Å; V299-F303 HydrophobicContact CG1-CE2 4.37Å; V299-F303 WeakPolarHBondContact O-CD2 3.27Å; V299-F303 PolarHBondContact O-N 3.19Å; V299-I337 HydrophobicContact CG2-CG2 4.09Å; V299-E340 HydrophobicContact CB-CG 4.19Å; V299-E340 HydrophobicContact CG1-CG 4.08Å; V299-F341 HydrophobicContact CG1-CB 4.14Å; V299-F341 HydrophobicContact CG1-CD2 4.08Å; V299-Q344 HydrophobicContact CG1-CG 4.18Å
300	K	88.1	Confident	82.2	Confident	90 Å²	90	66.1 Å²	66.1	39%	0.391	31%	0.313	S	S	.	.	H	α-helix	trans	-56.5	-48.9	175.5	-75.5	-177.2	-178.4	179	0	111.6	E296 K297 L298 F303 S304 E340	E296-K300 PolarHBondContact O-N 3.48Å; K297-K300 PolarHBondContact O-N 3.37Å; L298-K300 PolarHBondContact O-N 3.22Å; K300-F303 PolarHBondContact O-N 3.4Å; K300-S304 PolarHBondContact O-N 2.92Å; K300-S304 PolarHBondContact O-OG 3.19Å; K300-S304 VanDerWaalsContact O-OG 3.13Å; K300-E340 WeakPolarHBondContact CE-OE1 3.25Å; K300-E340 WeakPolarHBondContact CE-OE2 3.44Å; K300-E340 HydrophobicContact CG-CG 4.07Å; K300-E340 WeakPolarHBondContact CG-OE1 3.46Å; K300-E340 IonicContact NZ-OE2 2.66Å
301	N	87.1	Confident	83.6	Confident	55 Å²	55	59.1 Å²	59.1	29%	0.294	29%	0.289	S	S	.	.	H	α-helix	trans	-71.6	-33.7	-175.6	-70.2	-7.3	0	0	0	112.5	F199 L203 K297 L298 V299 F303 S304 L305	F199-N301 WeakPolarHBondContact CD1-ND2 3.42Å; F199-N301 HydrophobicContact CE1-CB 4.35Å; F199-N301 WeakPolarHBondContact CE1-ND2 3.5Å; L203-N301 HydrophobicContact CD1-CB 3.7Å; L203-N301 HydrophobicContact CD2-CB 3.86Å; L203-N301 HydrophobicContact CG-CB 4.47Å; K297-N301 WeakPolarHBondContact O-CB 3.4Å; K297-N301 PolarHBondContact O-N 3.31Å; L298-N301 PolarHBondContact O-N 3.47Å; V299-N301 VanDerWaalsContact C-N 3.33Å; V299-N301 PolarHBondContact O-N 2.92Å; N301-F303 VanDerWaalsContact C-N 3.34Å; N301-F303 PolarHBondContact O-N 3.39Å; N301-S304 PolarHBondContact O-N 3.28Å; N301-L305 WeakPolarHBondContact O-CB 3.35Å; N301-L305 VanDerWaalsContact O-CG 3.29Å; N301-L305 WeakPolarHBondContact O-CG 3.38Å; N301-L305 PolarHBondContact O-N 3.28Å
302	L	90	Very high	85.2	Confident	1 Å²	1	50.5 Å²	50.5	1%	0.005	26%	0.257	C	S	.	.	H	α-helix	trans	-55.7	-49.3	170.8	172.4	64.4	0	0	0	111.1	I207 F280 I282 L298 V299 L305 A306 I314	I207-L302 HydrophobicContact CD1-CB 3.97Å; I207-L302 HydrophobicContact CD1-CD1 3.88Å; I207-L302 HydrophobicContact CG1-CD1 4.21Å; I207-L302 HydrophobicContact CG2-CD1 3.9Å; F280-L302 HydrophobicContact CB-CD1 4.01Å; F280-L302 HydrophobicContact CD1-CD1 4.26Å; F280-L302 HydrophobicContact CG-CD1 4.35Å; I282-L302 HydrophobicContact CD1-CD2 4.31Å; I282-L302 HydrophobicContact CG2-CD2 4.1Å; L298-L302 WeakPolarHBondContact O-CB 3.48Å; L298-L302 PolarHBondContact O-N 3Å; V299-L302 PolarHBondContact O-N 3.21Å; L302-L305 PolarHBondContact O-N 3.34Å; L302-A306 WeakPolarHBondContact O-CB 3.38Å; L302-A306 PolarHBondContact O-N 2.91Å; L302-I314 HydrophobicContact CD1-CG2 4.43Å; L302-I314 HydrophobicContact CD2-CG2 3.93Å; L302-I314 HydrophobicContact CG-CD1 4.43Å; L302-I314 HydrophobicContact CG-CG2 4.33Å
303	F	91.1	Very high	86.7	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-69.6	-35.6	178.4	-84.5	-98.8	0	0	0	112.6	V299 K300 N301 A306 R307 I314 F341 Q344 M345 V357	V299-F303 HydrophobicContact CG1-CD2 4.32Å; V299-F303 HydrophobicContact CG1-CE2 4.37Å; V299-F303 WeakPolarHBondContact O-CD2 3.27Å; V299-F303 PolarHBondContact O-N 3.19Å; K300-F303 PolarHBondContact O-N 3.4Å; N301-F303 VanDerWaalsContact C-N 3.34Å; N301-F303 PolarHBondContact O-N 3.39Å; F303-A306 PolarHBondContact O-N 3.02Å; F303-R307 VanDerWaalsContact O-CG 3.25Å; F303-R307 WeakPolarHBondContact O-CG 3.34Å; F303-R307 PolarHBondContact O-N 3.47Å; F303-I314 HydrophobicContact CD1-CD1 3.89Å; F303-I314 HydrophobicContact CD2-CD1 4.21Å; F303-I314 HydrophobicContact CE1-CD1 3.87Å; F303-I314 HydrophobicContact CE2-CD1 4.19Å; F303-I314 HydrophobicContact CG-CD1 4.08Å; F303-I314 HydrophobicContact CZ-CD1 4.03Å; F303-F341 AromaticContact CE2-CD2 3.8Å; F303-F341 HydrophobicContact CE2-CD2 3.8Å; F303-F341 AromaticContact CE2-CE2 3.65Å; F303-F341 HydrophobicContact CE2-CE2 3.65Å; F303-F341 HydrophobicContact CZ-CD2 4.24Å; F303-F341 AromaticContact CZ-CE2 3.79Å; F303-F341 HydrophobicContact CZ-CE2 3.79Å; F303-Q344 HydrophobicContact CB-CB 4.21Å; F303-Q344 HydrophobicContact CB-CG 4.31Å; F303-Q344 HydrophobicContact CD1-CB 3.87Å; F303-Q344 HydrophobicContact CD2-CB 3.58Å; F303-Q344 HydrophobicContact CD2-CG 4.06Å; F303-Q344 HydrophobicContact CE1-CB 4.06Å; F303-Q344 HydrophobicContact CE2-CB 3.78Å; F303-Q344 HydrophobicContact CG-CB 3.62Å; F303-Q344 HydrophobicContact CG-CG 4.17Å; F303-Q344 HydrophobicContact CZ-CB 4.01Å; F303-M345 HydrophobicContact CE1-CG 4.48Å; F303-M345 HydrophobicContact CZ-CG 3.99Å; F303-V357 HydrophobicContact CE1-CG2 3.97Å; F303-V357 HydrophobicContact CZ-CG2 4.01Å
304	S	89.4	Confident	87.9	Confident	44 Å²	44	42.3 Å²	42.3	31%	0.308	21%	0.207	S	C	.	.	H	α-helix	trans	-61.8	-49	173.3	-62.9	0	0	0	0	111.7	K300 N301 A306 R307 E308	K300-S304 PolarHBondContact O-N 2.92Å; K300-S304 PolarHBondContact O-OG 3.19Å; K300-S304 VanDerWaalsContact O-OG 3.13Å; N301-S304 PolarHBondContact O-N 3.28Å; S304-A306 VanDerWaalsContact C-N 3.32Å; S304-A306 PolarHBondContact O-N 3.49Å; S304-R307 WeakPolarHBondContact O-CB 3.47Å; S304-R307 PolarHBondContact O-N 3.47Å; S304-R307 VanDerWaalsContact O-N 3.1Å; S304-E308 WeakPolarHBondContact O-CG 3.43Å; S304-E308 PolarHBondContact O-N 3.05Å
305	L	88.8	Confident	88.7	Confident	39 Å²	39	39.6 Å²	39.6	20%	0.204	19%	0.194	C	C	.	.	H	α-helix	trans	-60.5	-41.7	175.9	-71.7	171.6	0	0	0	111.7	I207 F280 N301 L302 R307 E308 H309	I207-L305 HydrophobicContact CD1-CD1 4.34Å; F280-L305 HydrophobicContact CE1-CB 4.04Å; F280-L305 HydrophobicContact CZ-CB 4.29Å; N301-L305 WeakPolarHBondContact O-CB 3.35Å; N301-L305 VanDerWaalsContact O-CG 3.29Å; N301-L305 WeakPolarHBondContact O-CG 3.38Å; N301-L305 PolarHBondContact O-N 3.28Å; L302-L305 PolarHBondContact O-N 3.34Å; L305-R307 VanDerWaalsContact C-N 3.3Å; L305-R307 PolarHBondContact O-N 3.46Å; L305-E308 PolarHBondContact O-N 3.47Å; L305-H309 WeakPolarHBondContact O-CB 3.28Å; L305-H309 PolarHBondContact O-CD2 3.11Å; L305-H309 VanDerWaalsContact O-CD2 3.31Å; L305-H309 PolarHBondContact O-N 2.64Å
306	A	90.6	Very high	89.3	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-61.9	-38	175.8	0	0	0	0	0	112.3	F280 L302 F303 S304 H309 K310 S312 I314 V355	F280-A306 HydrophobicContact CD2-CB 4.16Å; F280-A306 HydrophobicContact CE2-CB 4.01Å; L302-A306 WeakPolarHBondContact O-CB 3.38Å; L302-A306 PolarHBondContact O-N 2.91Å; F303-A306 PolarHBondContact O-N 3.02Å; S304-A306 VanDerWaalsContact C-N 3.32Å; S304-A306 PolarHBondContact O-N 3.49Å; A306-H309 CarbonylContact O-C 3.43Å; A306-H309 PolarHBondContact O-N 3.24Å; A306-K310 PolarHBondContact O-N 2.98Å; A306-S312 WeakPolarHBondContact O-CB 3.38Å; A306-S312 PolarHBondContact O-OG 2.93Å; A306-I314 HydrophobicContact CB-CD1 3.63Å; A306-I314 HydrophobicContact CB-CG1 3.77Å; A306-V355 HydrophobicContact CB-CG1 4.06Å
307	R	89.7	Confident	89.6	Confident	36 Å²	36	38.9 Å²	38.9	14%	0.136	19%	0.191	C	C	.	.	H	α-helix	trans	-69.6	-33.3	175.2	-70.9	173.1	-164.1	126.2	4.1	112.8	F303 S304 L305 H309 K310 N350 N352 V355	F303-R307 VanDerWaalsContact O-CG 3.25Å; F303-R307 WeakPolarHBondContact O-CG 3.34Å; F303-R307 PolarHBondContact O-N 3.47Å; S304-R307 WeakPolarHBondContact O-CB 3.47Å; S304-R307 PolarHBondContact O-N 3.47Å; S304-R307 VanDerWaalsContact O-N 3.1Å; L305-R307 VanDerWaalsContact C-N 3.3Å; L305-R307 PolarHBondContact O-N 3.46Å; R307-H309 VanDerWaalsContact C-N 3.32Å; R307-K310 WeakPolarHBondContact O-CD 3.24Å; R307-K310 WeakPolarHBondContact O-CE 3.46Å; R307-K310 VanDerWaalsContact O-CG 3.29Å; R307-K310 WeakPolarHBondContact O-CG 3.07Å; R307-N350 PolarHBondContact NH1-ND2 2.94Å; R307-N352 PolarHBondContact NE-OD1 2.88Å; R307-N352 PolarHBondContact NH2-OD1 3.44Å; R307-V355 HydrophobicContact CG-CG2 4.11Å
308	E	89.3	Confident	89.8	Confident	142 Å²	142	38 Å²	38	66%	0.664	19%	0.189	S	C	*	.	H	α-helix	trans	-69.7	-30.7	174.7	-71.3	169.8	-162.4	0	0	112	S304 L305	S304-E308 WeakPolarHBondContact O-CG 3.43Å; S304-E308 PolarHBondContact O-N 3.05Å; L305-E308 PolarHBondContact O-N 3.47Å
309	H	88	Confident	90.1	Very high	83 Å²	83	37.1 Å²	37.1	38%	0.384	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.4	29.5	-176.1	-74.5	-75.2	0	0	0	114.8	T278 F280 L305 A306 R307 P311	T278-H309 HydrophobicContact CG2-CB 4.05Å; T278-H309 PolarHBondContact OG1-O 3.43Å; F280-H309 HydrophobicContact CE2-CB 4.13Å; F280-H309 HydrophobicContact CZ-CB 3.92Å; L305-H309 WeakPolarHBondContact O-CB 3.28Å; L305-H309 PolarHBondContact O-CD2 3.11Å; L305-H309 VanDerWaalsContact O-CD2 3.31Å; L305-H309 PolarHBondContact O-N 2.64Å; A306-H309 CarbonylContact O-C 3.43Å; A306-H309 PolarHBondContact O-N 3.24Å; R307-H309 VanDerWaalsContact C-N 3.32Å; H309-P311 CarbonylContact O-C 3.57Å; H309-P311 VanDerWaalsContact O-O 3.11Å
310	K	87.1	Confident	90	Very high	75 Å²	75	38.5 Å²	38.5	33%	0.326	19%	0.192	S	C	.	.			trans	-59.8	140	177	-69.7	170.3	-174.7	-158.2	0	111.8	A306 R307 D351 D353 V355	A306-K310 PolarHBondContact O-N 2.98Å; R307-K310 WeakPolarHBondContact O-CD 3.24Å; R307-K310 WeakPolarHBondContact O-CE 3.46Å; R307-K310 VanDerWaalsContact O-CG 3.29Å; R307-K310 WeakPolarHBondContact O-CG 3.07Å; K310-D351 PolarHBondContact NZ-O 3.43Å; K310-D351 IonicContact NZ-OD2 3.27Å; K310-D351 PolarHBondContact NZ-OD2 2.98Å; K310-D351 VanDerWaalsContact NZ-OD2 3.09Å; K310-D353 WeakPolarHBondContact CD-O 3.29Å; K310-D353 WeakPolarHBondContact CE-O 3.34Å; K310-D353 PolarHBondContact NZ-O 3.28Å; K310-V355 HydrophobicContact CD-CG2 4.5Å; K310-V355 HydrophobicContact CG-CG2 3.99Å
311	P	87.4	Confident	89.8	Confident	64 Å²	64	37.6 Å²	37.6	42%	0.416	20%	0.197	S	C	.	.	S	Bend	cis	-71.9	135.9	-6.1	31.1	-34.8	0	0	0	111.7	S277 T278 H309	S277-P311 WeakPolarHBondContact CB-O 3.2Å; S277-P311 WeakPolarHBondContact OG-CG 3.44Å; T278-P311 PolarHBondContact N-O 3.42Å; H309-P311 CarbonylContact O-C 3.57Å; H309-P311 VanDerWaalsContact O-O 3.11Å
312	S	90.4	Very high	89.3	Confident	3 Å²	3	35.6 Å²	35.6	2%	0.021	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	151.4	-175.8	62.5	0	0	0	0	113	T278 A306 G354 L356	T278-S312 WeakPolarHBondContact O-CA 3.34Å; A306-S312 WeakPolarHBondContact O-CB 3.38Å; A306-S312 PolarHBondContact O-OG 2.93Å; S312-G354 PolarHBondContact N-O 2.84Å; S312-G354 VanDerWaalsContact N-O 3.16Å; S312-L356 PolarHBondContact O-N 3.49Å
313	I	92.6	Very high	88.5	Confident	4 Å²	4	35.7 Å²	35.7	2%	0.021	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	121.8	177.9	-61.5	-179.6	0	0	0	108	V233 V270 A271 A274 T278 F279 F280 L356 L358	V233-I313 HydrophobicContact CG1-CD1 4.47Å; V270-I313 HydrophobicContact CG1-CD1 4.1Å; A271-I313 HydrophobicContact CB-CD1 4.04Å; A274-I313 HydrophobicContact CB-CD1 4.16Å; T278-I313 PolarHBondContact O-N 2.75Å; F279-I313 HydrophobicContact CD2-CB 4.13Å; F279-I313 HydrophobicContact CD2-CG2 3.92Å; F279-I313 HydrophobicContact CE2-CG2 4.04Å; F280-I313 PolarHBondContact N-O 2.7Å; I313-L356 WeakPolarHBondContact CA-O 3.32Å; I313-L356 HydrophobicContact CD1-CD2 4.47Å; I313-L356 HydrophobicContact CG1-CB 4.39Å; I313-L356 HydrophobicContact CG1-CD2 4.38Å; I313-L358 HydrophobicContact CG2-CB 4.47Å; I313-L358 HydrophobicContact CG2-CD1 3.59Å; I313-L358 HydrophobicContact CG2-CG 4.18Å
314	I	94.3	Very high	87.5	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	112.7	171	-57.3	172.7	0	0	0	107.4	F280 L302 F303 A306 I316 V355 L356 V357 L358	F280-I314 HydrophobicContact CB-CG1 4.48Å; L302-I314 HydrophobicContact CD1-CG2 4.43Å; L302-I314 HydrophobicContact CD2-CG2 3.93Å; L302-I314 HydrophobicContact CG-CD1 4.43Å; L302-I314 HydrophobicContact CG-CG2 4.33Å; F303-I314 HydrophobicContact CD1-CD1 3.89Å; F303-I314 HydrophobicContact CD2-CD1 4.21Å; F303-I314 HydrophobicContact CE1-CD1 3.87Å; F303-I314 HydrophobicContact CE2-CD1 4.19Å; F303-I314 HydrophobicContact CG-CD1 4.08Å; F303-I314 HydrophobicContact CZ-CD1 4.03Å; A306-I314 HydrophobicContact CB-CD1 3.63Å; A306-I314 HydrophobicContact CB-CG1 3.77Å; I314-I316 HydrophobicContact CG2-CD1 4.4Å; I314-I316 HydrophobicContact CG2-CG1 4.11Å; I314-V355 HydrophobicContact CD1-CG1 3.94Å; I314-V355 HydrophobicContact CG1-CG1 4.3Å; I314-L356 PolarHBondContact N-O 3.26Å; I314-V357 CarbonylContact O-C 3.21Å; I314-V357 WeakPolarHBondContact O-CA 3.36Å; I314-L358 PolarHBondContact O-N 3.49Å
315	F	95.1	Very high	86.3	Confident	2 Å²	2	38 Å²	38	1%	0.009	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	125.1	174.8	179.3	-107.5	0	0	0	111.1	A267 F279 F280 I282 D317 L358 A360	A267-F315 HydrophobicContact CB-CD2 3.42Å; A267-F315 VanDerWaalsContact CB-CD2 3.42Å; A267-F315 HydrophobicContact CB-CE2 3.44Å; A267-F315 VanDerWaalsContact CB-CE2 3.44Å; A267-F315 HydrophobicContact CB-CG 4.09Å; A267-F315 HydrophobicContact CB-CZ 4.14Å; F279-F315 HydrophobicContact CD2-CB 4.42Å; F279-F315 HydrophobicContact CE1-CB 4.01Å; F279-F315 HydrophobicContact CE1-CD1 4.35Å; F279-F315 HydrophobicContact CE1-CG 4.42Å; F279-F315 HydrophobicContact CE2-CB 3.48Å; F279-F315 VanDerWaalsContact CE2-CB 3.48Å; F279-F315 HydrophobicContact CE2-CG 4.13Å; F279-F315 HydrophobicContact CZ-CB 3.24Å; F279-F315 AromaticContact CZ-CD1 3.84Å; F279-F315 HydrophobicContact CZ-CD1 3.84Å; F279-F315 HydrophobicContact CZ-CD2 4.38Å; F279-F315 AromaticContact CZ-CG 3.57Å; F279-F315 HydrophobicContact CZ-CG 3.57Å; F280-F315 PolarHBondContact O-N 2.86Å; I282-F315 PolarHBondContact N-O 3.18Å; F315-D317 HydrophobicContact CE1-CB 3.81Å; F315-D317 HydrophobicContact CZ-CB 4.17Å; F315-L358 CarbonylContact C-O 3.56Å; F315-L358 VanDerWaalsContact CA-O 3.31Å; F315-L358 WeakPolarHBondContact CA-O 3.27Å; F315-L358 HydrophobicContact CD2-CB 3.91Å; F315-A360 HydrophobicContact CE2-CB 3.77Å; F315-A360 HydrophobicContact CZ-CB 3.71Å
316	I	92.9	Very high	85	Confident	1 Å²	1	44.9 Å²	44.9	1%	0.005	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	109.3	179.6	-53.2	176.8	0	0	0	108.3	I282 S284 I314 I319 F341 V357 L358 G359 A360	I282-I316 HydrophobicContact CG2-CB 4.48Å; I282-I316 HydrophobicContact CG2-CG1 3.84Å; I282-I316 WeakPolarHBondContact O-CA 3.23Å; S284-I316 WeakPolarHBondContact OG-CG2 3.44Å; I314-I316 HydrophobicContact CG2-CD1 4.4Å; I314-I316 HydrophobicContact CG2-CG1 4.11Å; I316-I319 HydrophobicContact CB-CD1 4.4Å; I316-I319 HydrophobicContact CD1-CD1 4.4Å; I316-I319 HydrophobicContact CG2-CB 4.08Å; I316-I319 HydrophobicContact CG2-CD1 4.29Å; I316-I319 HydrophobicContact CG2-CG1 4.08Å; I316-F341 HydrophobicContact CD1-CD2 4.33Å; I316-F341 HydrophobicContact CD1-CE1 4.24Å; I316-F341 HydrophobicContact CD1-CE2 3.24Å; I316-F341 HydrophobicContact CD1-CZ 3.18Å; I316-V357 HydrophobicContact CD1-CG1 4.32Å; I316-L358 PolarHBondContact N-O 3Å; I316-G359 CarbonylContact O-C 3.44Å; I316-G359 WeakPolarHBondContact O-CA 3.36Å; I316-A360 PolarHBondContact O-N 3.32Å
317	D	91.2	Very high	83.6	Confident	43 Å²	43	47.9 Å²	47.9	23%	0.23	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	151.2	173.8	-144.5	-17.2	0	0	0	111	S264 I282 S284 F315 I319	S264-D317 PolarHBondContact OG-OD2 3.27Å; I282-D317 PolarHBondContact O-N 3.13Å; S284-D317 WeakPolarHBondContact CB-O 3.47Å; S284-D317 PolarHBondContact N-O 3.14Å; S284-D317 PolarHBondContact OG-O 3.39Å; F315-D317 HydrophobicContact CE1-CB 3.81Å; F315-D317 HydrophobicContact CZ-CB 4.17Å; D317-I319 VanDerWaalsContact C-N 3.26Å; D317-I319 PolarHBondContact O-N 2.65Å
318	E	89.5	Confident	82.1	Confident	96 Å²	96	55.3 Å²	55.3	45%	0.449	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.2	44.3	-179.9	-56.7	-173.2	158.5	0	0	113.4	S284 D320 S321 A360	S284-E318 WeakPolarHBondContact CB-O 3.27Å; S284-E318 PolarHBondContact OG-O 3.09Å; S284-E318 VanDerWaalsContact OG-O 3.06Å; E318-D320 PolarHBondContact O-N 3.4Å; E318-S321 WeakPolarHBondContact O-CB 3.36Å; E318-S321 PolarHBondContact O-N 3.09Å; E318-S321 PolarHBondContact O-OG 3.45Å; E318-A360 PolarHBondContact N-O 2.76Å; E318-A360 VanDerWaalsContact N-O 3.13Å
319	I	90.3	Very high	80.9	Confident	1 Å²	1	56.2 Å²	56.2	1%	0.005	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-22.1	-173.5	-166.9	165	0	0	0	113.4	L254 S284 I316 D317 S321 L322 C323 F341 A360 L367 F375	L254-I319 HydrophobicContact CD1-CG2 3.96Å; S284-I319 WeakPolarHBondContact OG-CA 3.4Å; I316-I319 HydrophobicContact CB-CD1 4.4Å; I316-I319 HydrophobicContact CD1-CD1 4.4Å; I316-I319 HydrophobicContact CG2-CB 4.08Å; I316-I319 HydrophobicContact CG2-CD1 4.29Å; I316-I319 HydrophobicContact CG2-CG1 4.08Å; D317-I319 VanDerWaalsContact C-N 3.26Å; D317-I319 PolarHBondContact O-N 2.65Å; I319-S321 PolarHBondContact O-N 2.97Å; I319-L322 PolarHBondContact O-N 3.47Å; I319-C323 HydrophobicContact CG1-CB 4.35Å; I319-C323 VanDerWaalsContact O-CB 3.22Å; I319-C323 WeakPolarHBondContact O-CB 3.46Å; I319-C323 PolarHBondContact O-N 3.15Å; I319-F341 HydrophobicContact CD1-CE1 4.25Å; I319-F341 HydrophobicContact CD1-CZ 4.5Å; I319-A360 PolarHBondContact N-O 3.2Å; I319-L367 HydrophobicContact CG2-CD2 4.11Å; I319-F375 HydrophobicContact CD1-CE2 3.37Å; I319-F375 HydrophobicContact CD1-CZ 3.32Å
320	D	87.3	Confident	80.2	Confident	29 Å²	29	53.8 Å²	53.8	16%	0.155	29%	0.285	C	S	.	.	H	α-helix	trans	-59.8	-28.6	172.9	50.4	-74.3	0	0	0	114.1	E318 L322 C323 G324 T361 I363 L367	E318-D320 PolarHBondContact O-N 3.4Å; D320-L322 VanDerWaalsContact C-N 3.34Å; D320-L322 PolarHBondContact O-N 3.39Å; D320-C323 PolarHBondContact O-N 3.31Å; D320-G324 PolarHBondContact O-N 3.08Å; D320-T361 WeakPolarHBondContact CB-OG1 3.43Å; D320-T361 VanDerWaalsContact CG-OG1 3.22Å; D320-T361 WeakPolarHBondContact OD1-CB 3.35Å; D320-T361 PolarHBondContact OD1-OG1 3Å; D320-I363 HydrophobicContact CB-CD1 4.25Å; D320-I363 HydrophobicContact CB-CG1 3.83Å; D320-I363 WeakPolarHBondContact OD2-CD1 3.5Å; D320-I363 WeakPolarHBondContact OD2-CG1 3.39Å; D320-L367 HydrophobicContact CB-CD2 4.08Å
321	S	83.1	Confident	79.6	Confident	71 Å²	71	53.7 Å²	53.7	50%	0.497	29%	0.293	S	S	.	.	H	α-helix	trans	-71.6	-27.3	177.8	63.5	0	0	0	0	113.2	S284 E318 I319	S284-S321 WeakPolarHBondContact CB-OG 3.5Å; E318-S321 WeakPolarHBondContact O-CB 3.36Å; E318-S321 PolarHBondContact O-N 3.09Å; E318-S321 PolarHBondContact O-OG 3.45Å; I319-S321 PolarHBondContact O-N 2.97Å
322	L	77.9	Confident	79.3	Confident	14 Å²	14	56.4 Å²	56.4	7%	0.073	30%	0.301	C	S	.	.	H	α-helix	trans	-89.5	-32.5	170.8	-77.4	168.7	0	0	0	113.3	S284 L287 V288 I319 D320 I337	S284-L322 WeakPolarHBondContact OG-CD1 3.31Å; L287-L322 HydrophobicContact CB-CD1 3.94Å; L287-L322 HydrophobicContact CB-CD2 4.05Å; L287-L322 HydrophobicContact CD1-CD1 3.33Å; L287-L322 HydrophobicContact CG-CD1 4.2Å; V288-L322 HydrophobicContact CG2-CD2 3.75Å; I319-L322 PolarHBondContact O-N 3.47Å; D320-L322 VanDerWaalsContact C-N 3.34Å; D320-L322 PolarHBondContact O-N 3.39Å; L322-I337 HydrophobicContact CD2-CG2 3.98Å
323	C	73.5	Confident	78.7	Confident	2 Å²	2	57.7 Å²	57.7	1%	0.014	31%	0.311	C	S	.	.	H	α-helix	trans	-113.3	20.6	-164.3	-65.1	0	0	0	0	114.1	I319 D320 L367 D368 I371	I319-C323 HydrophobicContact CG1-CB 4.35Å; I319-C323 VanDerWaalsContact O-CB 3.22Å; I319-C323 WeakPolarHBondContact O-CB 3.46Å; I319-C323 PolarHBondContact O-N 3.15Å; D320-C323 PolarHBondContact O-N 3.31Å; C323-L367 HydrophobicContact CB-CD2 3.85Å; C323-D368 PolarHBondContact O-N 3.13Å; C323-I371 HydrophobicContact CB-CB 4.19Å; C323-I371 HydrophobicContact CB-CD1 4.29Å; C323-I371 HydrophobicContact CB-CG1 3.81Å; C323-I371 HydrophobicContact CB-CG2 3.92Å; C323-I371 VanDerWaalsContact SG-CD1 3.5Å
324	G	70.1	Confident	78.1	Confident	20 Å²	20	58.7 Å²	58.7	21%	0.206	32%	0.32	C	S	.	.	B	Isolated β-bridge	trans	-53.8	156.4	177.6	0	0	0	0	0	113.7	D320 R326 K338 T366	D320-G324 PolarHBondContact O-N 3.08Å; G324-R326 PolarHBondContact O-N 3.44Å; G324-K338 PolarHBondContact O-NZ 2.93Å; G324-T366 CarbonylContact C-O 3.38Å; G324-T366 WeakPolarHBondContact CA-O 3.39Å
325	S	63.3	Low	77.5	Confident	74 Å²	74	63.4 Å²	63.4	52%	0.517	34%	0.338	S	S	.	.			trans	-58.1	130.1	174.6	54.5	0	0	0	0	109.4	S327 T366	S325-S327 PolarHBondContact O-N 3.03Å; S325-T366 PolarHBondContact N-O 3.02Å
326	R	62.4	Low	77	Confident	183 Å²	183	68.9 Å²	68.9	69%	0.691	36%	0.359	S	S	*	.			trans	-49.4	107.4	179.2	-69.1	178.5	179.4	-172.7	-2.9	109.6	G324 D368	G324-R326 PolarHBondContact O-N 3.44Å; R326-D368 IonicContact NE-OD1 3.93Å
327	S	60.7	Low	76.7	Confident	62 Å²	62	69 Å²	69	43%	0.434	36%	0.359	S	S	.	.			trans	-101.9	152.5	170.7	64.6	0	0	0	0	108.6	S325 N329 E330 R335	S325-S327 PolarHBondContact O-N 3.03Å; S327-N329 PolarHBondContact O-N 2.81Å; S327-N329 VanDerWaalsContact O-N 3.11Å; S327-E330 WeakPolarHBondContact O-CB 3.29Å; S327-E330 PolarHBondContact O-N 2.97Å; S327-E330 VanDerWaalsContact O-N 3.08Å; S327-R335 PolarHBondContact O-NH2 3.27Å; S327-R335 VanDerWaalsContact O-NH2 3.15Å
328	E	58.5	Low	76.5	Confident	193 Å²	193	67.5 Å²	67.5	90%	0.902	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-21.5	177.5	-72.1	-175.7	155.7	0	0	112.4
329	N	63.7	Low	76.4	Confident	161 Å²	161	66.7 Å²	66.7	86%	0.861	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	9.1	178.7	-66.8	-21.4	0	0	0	114.3	S327 S331	S327-N329 PolarHBondContact O-N 2.81Å; S327-N329 VanDerWaalsContact O-N 3.11Å; N329-S331 PolarHBondContact O-N 2.93Å
330	E	72.3	Confident	76.4	Confident	32 Å²	32	67.8 Å²	67.8	15%	0.15	36%	0.357	C	S	.	.			trans	-70.7	128.1	178.6	-170.2	-177.1	-159.3	0	0	110.9	S327 A334 R335	S327-E330 WeakPolarHBondContact O-CB 3.29Å; S327-E330 PolarHBondContact O-N 2.97Å; S327-E330 VanDerWaalsContact O-N 3.08Å; E330-A334 HydrophobicContact CG-CB 4.22Å; E330-R335 HydrophobicContact CG-CG 3.99Å; E330-R335 WeakPolarHBondContact OE2-CG 3.4Å; E330-R335 IonicContact OE2-NE 3.41Å; E330-R335 PolarHBondContact OE2-NE 2.89Å
331	S	76	Confident	76.5	Confident	72 Å²	72	66.7 Å²	66.7	50%	0.503	35%	0.351	S	S	.	.			trans	-57.8	138	176.9	176.4	0	0	0	0	111.3	N329 A333 A334 R335	N329-S331 PolarHBondContact O-N 2.93Å; S331-A333 PolarHBondContact O-N 3.49Å; S331-A333 PolarHBondContact OG-N 2.81Å; S331-A334 WeakPolarHBondContact O-CB 3.35Å; S331-A334 PolarHBondContact O-N 2.7Å; S331-A334 VanDerWaalsContact O-N 3.08Å; S331-R335 PolarHBondContact O-N 3.24Å
332	E	79.4	Confident	76.7	Confident	122 Å²	122	64.7 Å²	64.7	57%	0.57	34%	0.335	S	S	*	.	H	α-helix	trans	-54.4	-36.1	172.8	-78.6	-147.9	171.6	0	0	112.3	A334 R335 R336	E332-A334 PolarHBondContact O-N 2.99Å; E332-R335 PolarHBondContact O-N 2.84Å; E332-R336 WeakPolarHBondContact O-CG 3.48Å; E332-R336 PolarHBondContact O-N 2.97Å; E332-R336 IonicContact OE2-CZ 2.82Å; E332-R336 IonicContact OE2-NE 2.71Å; E332-R336 IonicContact OE2-NH2 3.16Å; E332-R336 PolarHBondContact OE2-NH2 3.42Å
333	A	78.3	Confident	77.3	Confident	30 Å²	30	66.9 Å²	66.9	25%	0.248	35%	0.349	C	S	.	.	H	α-helix	trans	-61	-45.4	177.9	0	0	0	0	0	111.4	S331 R335 R336 I337	S331-A333 PolarHBondContact O-N 3.49Å; S331-A333 PolarHBondContact OG-N 2.81Å; A333-R335 VanDerWaalsContact C-N 3.32Å; A333-R335 PolarHBondContact O-N 2.7Å; A333-R336 PolarHBondContact O-N 3.27Å; A333-I337 WeakPolarHBondContact O-CD1 3.11Å; A333-I337 VanDerWaalsContact O-CG1 3.24Å; A333-I337 WeakPolarHBondContact O-CG1 3.31Å; A333-I337 PolarHBondContact O-N 2.91Å
334	A	79.4	Confident	78.1	Confident	25 Å²	25	67.6 Å²	67.6	21%	0.207	35%	0.352	C	S	.	.	H	α-helix	trans	-61.8	-40.8	177.5	0	0	0	0	0	111.7	E330 S331 E332 R336 I337 K338	E330-A334 HydrophobicContact CG-CB 4.22Å; S331-A334 WeakPolarHBondContact O-CB 3.35Å; S331-A334 PolarHBondContact O-N 2.7Å; S331-A334 VanDerWaalsContact O-N 3.08Å; E332-A334 PolarHBondContact O-N 2.99Å; A334-R336 PolarHBondContact O-N 3.46Å; A334-I337 PolarHBondContact O-N 3.1Å; A334-K338 WeakPolarHBondContact O-CB 3.27Å; A334-K338 PolarHBondContact O-N 3.48Å
335	R	82.8	Confident	79	Confident	98 Å²	98	67.4 Å²	67.4	37%	0.37	35%	0.346	S	S	.	.	H	α-helix	trans	-62.1	-40.7	176.5	-70.1	-177.6	-179.8	164.1	7.5	112.7	S327 E330 S331 E332 A333 T339	S327-R335 PolarHBondContact O-NH2 3.27Å; S327-R335 VanDerWaalsContact O-NH2 3.15Å; E330-R335 HydrophobicContact CG-CG 3.99Å; E330-R335 WeakPolarHBondContact OE2-CG 3.4Å; E330-R335 IonicContact OE2-NE 3.41Å; E330-R335 PolarHBondContact OE2-NE 2.89Å; S331-R335 PolarHBondContact O-N 3.24Å; E332-R335 PolarHBondContact O-N 2.84Å; A333-R335 VanDerWaalsContact C-N 3.32Å; A333-R335 PolarHBondContact O-N 2.7Å; R335-T339 WeakPolarHBondContact O-CB 3.29Å; R335-T339 PolarHBondContact O-N 3.44Å; R335-T339 PolarHBondContact O-OG1 3.27Å
336	R	85.3	Confident	79.9	Confident	118 Å²	118	68.9 Å²	68.9	45%	0.445	35%	0.345	S	S	.	.	H	α-helix	trans	-69.1	-43.3	178.1	-64.5	177.1	-165.8	-171.4	4.6	111.7	E296 E332 A333 A334 K338 T339 E340	E296-R336 HydrophobicContact CG-CB 4.27Å; E296-R336 WeakPolarHBondContact OE1-CB 3.3Å; E296-R336 WeakPolarHBondContact OE1-CD 3.15Å; E332-R336 WeakPolarHBondContact O-CG 3.48Å; E332-R336 PolarHBondContact O-N 2.97Å; E332-R336 IonicContact OE2-CZ 2.82Å; E332-R336 IonicContact OE2-NE 2.71Å; E332-R336 IonicContact OE2-NH2 3.16Å; E332-R336 PolarHBondContact OE2-NH2 3.42Å; A333-R336 PolarHBondContact O-N 3.27Å; A334-R336 PolarHBondContact O-N 3.46Å; R336-K338 PolarHBondContact O-N 3.32Å; R336-T339 WeakPolarHBondContact O-CB 3.32Å; R336-T339 PolarHBondContact O-N 3.02Å; R336-E340 WeakPolarHBondContact O-CB 3.28Å; R336-E340 PolarHBondContact O-N 2.94Å
337	I	85.6	Confident	80.5	Confident	4 Å²	4	60.8 Å²	60.8	2%	0.021	32%	0.318	C	S	.	.	H	α-helix	trans	-57.7	-48.4	174.8	-64.4	162.1	0	0	0	110.7	V299 L322 A333 A334 T339 E340 F341	V299-I337 HydrophobicContact CG2-CG2 4.09Å; L322-I337 HydrophobicContact CD2-CG2 3.98Å; A333-I337 WeakPolarHBondContact O-CD1 3.11Å; A333-I337 VanDerWaalsContact O-CG1 3.24Å; A333-I337 WeakPolarHBondContact O-CG1 3.31Å; A333-I337 PolarHBondContact O-N 2.91Å; A334-I337 PolarHBondContact O-N 3.1Å; I337-T339 VanDerWaalsContact C-N 3.31Å; I337-T339 PolarHBondContact O-N 3.12Å; I337-E340 PolarHBondContact O-N 3.42Å; I337-F341 WeakPolarHBondContact O-CB 3.32Å; I337-F341 PolarHBondContact O-N 3.44Å
338	K	86.6	Confident	80.6	Confident	10 Å²	10	62.4 Å²	62.4	4%	0.043	33%	0.325	C	S	.	.	H	α-helix	trans	-60.4	-40.3	177.2	180	176.1	173.6	-178.6	0	112.4	G324 A334 R336 L342 D368	G324-K338 PolarHBondContact O-NZ 2.93Å; A334-K338 WeakPolarHBondContact O-CB 3.27Å; A334-K338 PolarHBondContact O-N 3.48Å; R336-K338 PolarHBondContact O-N 3.32Å; K338-L342 HydrophobicContact CG-CD1 4.44Å; K338-L342 VanDerWaalsContact O-CG 3.31Å; K338-L342 WeakPolarHBondContact O-CG 3.49Å; K338-L342 PolarHBondContact O-N 2.98Å; K338-D368 VanDerWaalsContact NZ-CG 3.31Å; K338-D368 IonicContact NZ-OD1 3.69Å; K338-D368 PolarHBondContact NZ-OD1 3.38Å
339	T	88.3	Confident	80.6	Confident	79 Å²	79	57 Å²	57	49%	0.485	32%	0.321	S	S	.	.	H	α-helix	trans	-65.4	-47	177	-57.9	0	0	0	0	110.8	R335 R336 I337 F341 L342 V343	R335-T339 WeakPolarHBondContact O-CB 3.29Å; R335-T339 PolarHBondContact O-N 3.44Å; R335-T339 PolarHBondContact O-OG1 3.27Å; R336-T339 WeakPolarHBondContact O-CB 3.32Å; R336-T339 PolarHBondContact O-N 3.02Å; I337-T339 VanDerWaalsContact C-N 3.31Å; I337-T339 PolarHBondContact O-N 3.12Å; T339-F341 PolarHBondContact O-N 3.44Å; T339-L342 PolarHBondContact O-N 3.35Å; T339-V343 WeakPolarHBondContact O-CG2 3.45Å; T339-V343 PolarHBondContact O-N 3.35Å
340	E	89.1	Confident	81	Confident	24 Å²	24	53.1 Å²	53.1	11%	0.112	30%	0.301	C	S	.	.	H	α-helix	trans	-60.9	-45.3	177.3	-176.7	55.8	-139.1	0	0	111.4	E296 V299 K300 R336 I337 L342 V343 Q344	E296-E340 HydrophobicContact CB-CG 4.5Å; V299-E340 HydrophobicContact CB-CG 4.19Å; V299-E340 HydrophobicContact CG1-CG 4.08Å; K300-E340 WeakPolarHBondContact CE-OE1 3.25Å; K300-E340 WeakPolarHBondContact CE-OE2 3.44Å; K300-E340 HydrophobicContact CG-CG 4.07Å; K300-E340 WeakPolarHBondContact CG-OE1 3.46Å; K300-E340 IonicContact NZ-OE2 2.66Å; R336-E340 WeakPolarHBondContact O-CB 3.28Å; R336-E340 PolarHBondContact O-N 2.94Å; I337-E340 PolarHBondContact O-N 3.42Å; E340-L342 VanDerWaalsContact C-N 3.34Å; E340-L342 PolarHBondContact O-N 2.9Å; E340-V343 PolarHBondContact O-N 2.96Å; E340-V343 VanDerWaalsContact O-N 3.16Å; E340-Q344 WeakPolarHBondContact O-CG 3.19Å; E340-Q344 PolarHBondContact O-N 3.01Å; E340-Q344 WeakPolarHBondContact OE1-CG 3.14Å; E340-Q344 PolarHBondContact OE1-NE2 3.3Å
341	F	89.8	Confident	81.2	Confident	7 Å²	7	56.4 Å²	56.4	3%	0.031	32%	0.319	C	S	.	.	H	α-helix	trans	-58	-44.8	176.7	-176	-108.1	0	0	0	112.3	V299 F303 I316 I319 I337 T339 V343 Q344 M345 V357 I371	V299-F341 HydrophobicContact CG1-CB 4.14Å; V299-F341 HydrophobicContact CG1-CD2 4.08Å; F303-F341 AromaticContact CE2-CD2 3.8Å; F303-F341 HydrophobicContact CE2-CD2 3.8Å; F303-F341 AromaticContact CE2-CE2 3.65Å; F303-F341 HydrophobicContact CE2-CE2 3.65Å; F303-F341 HydrophobicContact CZ-CD2 4.24Å; F303-F341 AromaticContact CZ-CE2 3.79Å; F303-F341 HydrophobicContact CZ-CE2 3.79Å; I316-F341 HydrophobicContact CD1-CD2 4.33Å; I316-F341 HydrophobicContact CD1-CE1 4.24Å; I316-F341 HydrophobicContact CD1-CE2 3.24Å; I316-F341 HydrophobicContact CD1-CZ 3.18Å; I319-F341 HydrophobicContact CD1-CE1 4.25Å; I319-F341 HydrophobicContact CD1-CZ 4.5Å; I337-F341 WeakPolarHBondContact O-CB 3.32Å; I337-F341 PolarHBondContact O-N 3.44Å; T339-F341 PolarHBondContact O-N 3.44Å; F341-V343 PolarHBondContact O-N 3.42Å; F341-Q344 PolarHBondContact O-N 3.1Å; F341-M345 HydrophobicContact CD1-CG 4.38Å; F341-M345 HydrophobicContact CD1-SD 3.93Å; F341-M345 HydrophobicContact CE1-CG 3.96Å; F341-M345 HydrophobicContact CE1-SD 3.26Å; F341-M345 WeakPolarHBondContact CE1-SD 3.44Å; F341-M345 HydrophobicContact CE2-CG 4.31Å; F341-M345 HydrophobicContact CZ-CG 3.9Å; F341-M345 HydrophobicContact CZ-SD 3.62Å; F341-M345 WeakPolarHBondContact O-CG 3.5Å; F341-M345 PolarHBondContact O-N 2.67Å; F341-V357 HydrophobicContact CZ-CG1 4.1Å; F341-I371 HydrophobicContact CD1-CD1 3.9Å; F341-I371 HydrophobicContact CE1-CD1 4.25Å
342	L	88.6	Confident	81.3	Confident	29 Å²	29	53.3 Å²	53.3	15%	0.152	30%	0.297	C	S	.	.	H	α-helix	trans	-61.9	-40.6	175.7	-77.2	169.7	0	0	0	112.9	K338 T339 E340 Q346 A370 I371 R374	K338-L342 HydrophobicContact CG-CD1 4.44Å; K338-L342 VanDerWaalsContact O-CG 3.31Å; K338-L342 WeakPolarHBondContact O-CG 3.49Å; K338-L342 PolarHBondContact O-N 2.98Å; T339-L342 PolarHBondContact O-N 3.35Å; E340-L342 VanDerWaalsContact C-N 3.34Å; E340-L342 PolarHBondContact O-N 2.9Å; L342-Q346 PolarHBondContact O-N 2.9Å; L342-Q346 VanDerWaalsContact O-N 3.16Å; L342-A370 HydrophobicContact CD1-CB 4.05Å; L342-A370 HydrophobicContact CD2-CB 4.46Å; L342-I371 HydrophobicContact CD1-CD1 4.3Å; L342-I371 HydrophobicContact CD2-CD1 3.39Å; L342-I371 HydrophobicContact CD2-CG1 4.01Å; L342-I371 HydrophobicContact CG-CD1 3.67Å; L342-I371 HydrophobicContact CG-CG1 4.39Å; L342-R374 HydrophobicContact CD2-CG 3.68Å
343	V	89.7	Confident	81.4	Confident	60 Å²	60	51.9 Å²	51.9	36%	0.364	29%	0.293	S	S	.	.	H	α-helix	trans	-63.9	-45.1	176.7	170.5	0	0	0	0	110.2	T339 E340 F341 Q346 G347	T339-V343 WeakPolarHBondContact O-CG2 3.45Å; T339-V343 PolarHBondContact O-N 3.35Å; E340-V343 PolarHBondContact O-N 2.96Å; E340-V343 VanDerWaalsContact O-N 3.16Å; F341-V343 PolarHBondContact O-N 3.42Å; V343-Q346 PolarHBondContact O-N 3.42Å; V343-G347 PolarHBondContact O-N 3.31Å
344	Q	90.1	Very high	81.6	Confident	16 Å²	16	52.3 Å²	52.3	8%	0.075	30%	0.301	C	S	.	.	H	α-helix	trans	-64.8	-42.2	178.2	-68.8	-54.8	-35	0	0	112.8	V299 F303 E340 F341 Q346 G347 N352	V299-Q344 HydrophobicContact CG1-CG 4.18Å; F303-Q344 HydrophobicContact CB-CB 4.21Å; F303-Q344 HydrophobicContact CB-CG 4.31Å; F303-Q344 HydrophobicContact CD1-CB 3.87Å; F303-Q344 HydrophobicContact CD2-CB 3.58Å; F303-Q344 HydrophobicContact CD2-CG 4.06Å; F303-Q344 HydrophobicContact CE1-CB 4.06Å; F303-Q344 HydrophobicContact CE2-CB 3.78Å; F303-Q344 HydrophobicContact CG-CB 3.62Å; F303-Q344 HydrophobicContact CG-CG 4.17Å; F303-Q344 HydrophobicContact CZ-CB 4.01Å; E340-Q344 WeakPolarHBondContact O-CG 3.19Å; E340-Q344 PolarHBondContact O-N 3.01Å; E340-Q344 WeakPolarHBondContact OE1-CG 3.14Å; E340-Q344 PolarHBondContact OE1-NE2 3.3Å; F341-Q344 PolarHBondContact O-N 3.1Å; Q344-Q346 VanDerWaalsContact C-N 3.27Å; Q344-Q346 PolarHBondContact O-N 3.1Å; Q344-G347 PolarHBondContact O-N 3.37Å; Q344-G347 VanDerWaalsContact O-N 3.14Å; Q344-N352 PolarHBondContact O-ND2 2.89Å
345	M	88.3	Confident	82.2	Confident	17 Å²	17	51.7 Å²	51.7	8%	0.084	29%	0.294	C	S	.	.	H	α-helix	trans	-60	-37.5	175.3	-74.6	-172.8	82.1	0	0	112.4	F303 F341 G347 N352 V357 R374 F375	F303-M345 HydrophobicContact CE1-CG 4.48Å; F303-M345 HydrophobicContact CZ-CG 3.99Å; F341-M345 HydrophobicContact CD1-CG 4.38Å; F341-M345 HydrophobicContact CD1-SD 3.93Å; F341-M345 HydrophobicContact CE1-CG 3.96Å; F341-M345 HydrophobicContact CE1-SD 3.26Å; F341-M345 WeakPolarHBondContact CE1-SD 3.44Å; F341-M345 HydrophobicContact CE2-CG 4.31Å; F341-M345 HydrophobicContact CZ-CG 3.9Å; F341-M345 HydrophobicContact CZ-SD 3.62Å; F341-M345 WeakPolarHBondContact O-CG 3.5Å; F341-M345 PolarHBondContact O-N 2.67Å; M345-G347 VanDerWaalsContact C-N 3.27Å; M345-G347 PolarHBondContact O-N 2.89Å; M345-N352 PolarHBondContact O-ND2 3.11Å; M345-V357 HydrophobicContact CE-CB 4.17Å; M345-V357 HydrophobicContact CE-CG1 4.11Å; M345-V357 HydrophobicContact CE-CG2 4.48Å; M345-V357 HydrophobicContact CG-CG2 4.47Å; M345-R374 HydrophobicContact CE-CB 3.71Å; M345-R374 HydrophobicContact SD-CB 3.91Å; M345-F375 HydrophobicContact CE-CD1 4.49Å; M345-F375 HydrophobicContact CE-CE1 4.13Å; M345-F375 HydrophobicContact CE-CE2 4.24Å; M345-F375 HydrophobicContact CE-CZ 3.98Å
346	Q	82	Confident	82.6	Confident	105 Å²	105	47.7 Å²	47.7	49%	0.491	28%	0.28	S	S	.	.	H	α-helix	trans	-71.6	-24.3	179.6	-170.3	163.1	-3.3	0	0	112.6	L342 V343 Q344 V348	L342-Q346 PolarHBondContact O-N 2.9Å; L342-Q346 VanDerWaalsContact O-N 3.16Å; V343-Q346 PolarHBondContact O-N 3.42Å; Q344-Q346 VanDerWaalsContact C-N 3.27Å; Q344-Q346 PolarHBondContact O-N 3.1Å; Q346-V348 VanDerWaalsContact C-N 3.33Å; Q346-V348 HydrophobicContact CB-CG2 4.06Å; Q346-V348 HydrophobicContact CG-CG2 3.74Å
347	G	76.4	Confident	83.1	Confident	13 Å²	13	42.4 Å²	42.4	13%	0.134	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.1	31.8	-178.7	0	0	0	0	0	112.4	V343 Q344 M345 G349 N350 N352	V343-G347 PolarHBondContact O-N 3.31Å; Q344-G347 PolarHBondContact O-N 3.37Å; Q344-G347 VanDerWaalsContact O-N 3.14Å; M345-G347 VanDerWaalsContact C-N 3.27Å; M345-G347 PolarHBondContact O-N 2.89Å; G347-G349 PolarHBondContact O-N 3.48Å; G347-N350 CarbonylContact C-O 3.6Å; G347-N350 PolarHBondContact O-N 2.92Å; G347-N352 VanDerWaalsContact CA-ND2 3.29Å; G347-N352 WeakPolarHBondContact CA-ND2 2.97Å; G347-N352 PolarHBondContact N-ND2 2.8Å
348	V	63.1	Low	83.5	Confident	95 Å²	95	42.2 Å²	42.2	58%	0.576	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	113.3	176.3	-178.3	0	0	0	0	108.4	Q346 N350	Q346-V348 VanDerWaalsContact C-N 3.33Å; Q346-V348 HydrophobicContact CB-CG2 4.06Å; Q346-V348 HydrophobicContact CG-CG2 3.74Å; V348-N350 VanDerWaalsContact C-N 3.34Å
349	G	57.2	Low	83.9	Confident	80 Å²	80	41.7 Å²	41.7	83%	0.825	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.8	1.6	-178	0	0	0	0	0	115.8	G347	G347-G349 PolarHBondContact O-N 3.48Å
350	N	72.9	Confident	84.3	Confident	80 Å²	80	38 Å²	38	43%	0.428	24%	0.235	S	C	.	.	S	Bend	trans	-138.3	141.8	-177.8	-70.5	-46	0	0	0	112.2	R307 G347 V348 N352	R307-N350 PolarHBondContact NH1-ND2 2.94Å; G347-N350 CarbonylContact C-O 3.6Å; G347-N350 PolarHBondContact O-N 2.92Å; V348-N350 VanDerWaalsContact C-N 3.34Å; N350-N352 PolarHBondContact O-N 3.14Å
351	D	75.7	Confident	84.5	Confident	100 Å²	100	36.8 Å²	36.8	54%	0.535	23%	0.229	S	C	.	.			trans	-78.4	107.8	175.2	178.1	35.1	0	0	0	111.8	K310 D353	K310-D351 PolarHBondContact NZ-O 3.43Å; K310-D351 IonicContact NZ-OD2 3.27Å; K310-D351 PolarHBondContact NZ-OD2 2.98Å; K310-D351 VanDerWaalsContact NZ-OD2 3.09Å; D351-D353 VanDerWaalsContact C-N 3.34Å; D351-D353 WeakPolarHBondContact OD1-CB 2.99Å; D351-D353 PolarHBondContact OD1-N 3.23Å
352	N	79.7	Confident	84.7	Confident	8 Å²	8	38.7 Å²	38.7	4%	0.043	24%	0.24	C	C	.	.			trans	-90.5	9.6	173.7	-74.7	-5.9	0	0	0	113	R307 Q344 M345 G347 N350 G354 V355	R307-N352 PolarHBondContact NE-OD1 2.88Å; R307-N352 PolarHBondContact NH2-OD1 3.44Å; Q344-N352 PolarHBondContact O-ND2 2.89Å; M345-N352 PolarHBondContact O-ND2 3.11Å; G347-N352 VanDerWaalsContact CA-ND2 3.29Å; G347-N352 WeakPolarHBondContact CA-ND2 2.97Å; G347-N352 PolarHBondContact N-ND2 2.8Å; N350-N352 PolarHBondContact O-N 3.14Å; N352-G354 PolarHBondContact O-N 3.4Å; N352-V355 PolarHBondContact O-N 3.49Å; N352-V355 VanDerWaalsContact O-N 3.14Å
353	D	81.1	Confident	84.9	Confident	91 Å²	91	40.1 Å²	40.1	49%	0.487	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	137.1	176	-162.4	20.3	0	0	0	110.8	K310 D351 V355	K310-D353 WeakPolarHBondContact CD-O 3.29Å; K310-D353 WeakPolarHBondContact CE-O 3.34Å; K310-D353 PolarHBondContact NZ-O 3.28Å; D351-D353 VanDerWaalsContact C-N 3.34Å; D351-D353 WeakPolarHBondContact OD1-CB 2.99Å; D351-D353 PolarHBondContact OD1-N 3.23Å; D353-V355 VanDerWaalsContact C-N 3.29Å; D353-V355 PolarHBondContact O-N 2.92Å
354	G	82.9	Confident	85	Confident	40 Å²	40	37.3 Å²	37.3	41%	0.412	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.1	9.3	-174.3	0	0	0	0	0	116.6	S312 N352	S312-G354 PolarHBondContact N-O 2.84Å; S312-G354 VanDerWaalsContact N-O 3.16Å; N352-G354 PolarHBondContact O-N 3.4Å
355	V	90.6	Very high	85.1	Confident	11 Å²	11	41 Å²	41	7%	0.067	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	121.5	170.7	-175.8	0	0	0	0	109.7	A306 R307 K310 I314 N352 D353	A306-V355 HydrophobicContact CB-CG1 4.06Å; R307-V355 HydrophobicContact CG-CG2 4.11Å; K310-V355 HydrophobicContact CD-CG2 4.5Å; K310-V355 HydrophobicContact CG-CG2 3.99Å; I314-V355 HydrophobicContact CD1-CG1 3.94Å; I314-V355 HydrophobicContact CG1-CG1 4.3Å; N352-V355 PolarHBondContact O-N 3.49Å; N352-V355 VanDerWaalsContact O-N 3.14Å; D353-V355 VanDerWaalsContact C-N 3.29Å; D353-V355 PolarHBondContact O-N 2.92Å
356	L	92.3	Very high	85.1	Confident	15 Å²	15	41.9 Å²	41.9	8%	0.079	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	133.6	176.1	173.5	66.6	0	0	0	110.7	V233 W250 I253 S312 I313 I314 L358	V233-L356 HydrophobicContact CB-CD2 4.22Å; V233-L356 HydrophobicContact CG1-CD2 3.76Å; V233-L356 HydrophobicContact CG2-CD2 3.46Å; V233-L356 VanDerWaalsContact CG2-CD2 3.46Å; W250-L356 WeakPolarHBondContact O-CD1 3.46Å; I253-L356 HydrophobicContact CD1-CD1 3.89Å; I253-L356 HydrophobicContact CD1-CD2 4.23Å; I253-L356 HydrophobicContact CG1-CD1 4.04Å; S312-L356 PolarHBondContact O-N 3.49Å; I313-L356 WeakPolarHBondContact CA-O 3.32Å; I313-L356 HydrophobicContact CD1-CD2 4.47Å; I313-L356 HydrophobicContact CG1-CB 4.39Å; I313-L356 HydrophobicContact CG1-CD2 4.38Å; I314-L356 PolarHBondContact N-O 3.26Å; L356-L358 HydrophobicContact CD2-CD1 4.41Å; L356-L358 HydrophobicContact CD2-CG 4.19Å; L356-L358 HydrophobicContact CG-CG 4.39Å
357	V	94.4	Very high	85.5	Confident	6 Å²	6	37 Å²	37	4%	0.036	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	117.6	171.4	-174.2	0	0	0	0	110	R251 G252 I253 F303 I314 I316 F341 M345 F375	R251-V357 PolarHBondContact O-N 3.4Å; G252-V357 WeakPolarHBondContact CA-O 3.44Å; I253-V357 PolarHBondContact N-O 2.97Å; F303-V357 HydrophobicContact CE1-CG2 3.97Å; F303-V357 HydrophobicContact CZ-CG2 4.01Å; I314-V357 CarbonylContact O-C 3.21Å; I314-V357 WeakPolarHBondContact O-CA 3.36Å; I316-V357 HydrophobicContact CD1-CG1 4.32Å; F341-V357 HydrophobicContact CZ-CG1 4.1Å; M345-V357 HydrophobicContact CE-CB 4.17Å; M345-V357 HydrophobicContact CE-CG1 4.11Å; M345-V357 HydrophobicContact CE-CG2 4.48Å; M345-V357 HydrophobicContact CG-CG2 4.47Å; V357-F375 HydrophobicContact CG1-CE1 4.04Å; V357-F375 HydrophobicContact CG1-CZ 4.13Å
358	L	95.3	Very high	85.9	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	119.5	171.1	-78.4	169.8	0	0	0	110	L229 I253 A267 V270 I313 I314 F315 I316 L356	L229-L358 HydrophobicContact CD2-CD2 4.37Å; I253-L358 HydrophobicContact CB-CD2 3.62Å; I253-L358 HydrophobicContact CD1-CD2 4.33Å; I253-L358 HydrophobicContact CG2-CD2 3.79Å; I253-L358 WeakPolarHBondContact O-CA 3.29Å; A267-L358 HydrophobicContact CB-CD1 4.31Å; V270-L358 HydrophobicContact CG1-CD1 4.37Å; I313-L358 HydrophobicContact CG2-CB 4.47Å; I313-L358 HydrophobicContact CG2-CD1 3.59Å; I313-L358 HydrophobicContact CG2-CG 4.18Å; I314-L358 PolarHBondContact O-N 3.49Å; F315-L358 CarbonylContact C-O 3.56Å; F315-L358 VanDerWaalsContact CA-O 3.31Å; F315-L358 WeakPolarHBondContact CA-O 3.27Å; F315-L358 HydrophobicContact CD2-CB 3.91Å; I316-L358 PolarHBondContact N-O 3Å; L356-L358 HydrophobicContact CD2-CD1 4.41Å; L356-L358 HydrophobicContact CD2-CG 4.19Å; L356-L358 HydrophobicContact CG-CG 4.39Å
359	G	95.3	Very high	87	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	144.8	171.3	0	0	0	0	0	111.2	I253 L255 I316	I253-G359 PolarHBondContact O-N 2.97Å; L255-G359 PolarHBondContact N-O 2.96Å; I316-G359 CarbonylContact O-C 3.44Å; I316-G359 WeakPolarHBondContact O-CA 3.36Å
360	A	95.4	Very high	88.4	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	139.4	167.9	0	0	0	0	0	111.3	L255 K263 F315 I316 E318 I319	L255-A360 VanDerWaalsContact O-CA 3.3Å; L255-A360 WeakPolarHBondContact O-CA 3.44Å; K263-A360 HydrophobicContact CB-CB 4.19Å; K263-A360 HydrophobicContact CD-CB 4.42Å; F315-A360 HydrophobicContact CE2-CB 3.77Å; F315-A360 HydrophobicContact CZ-CB 3.71Å; I316-A360 PolarHBondContact O-N 3.32Å; E318-A360 PolarHBondContact N-O 2.76Å; E318-A360 VanDerWaalsContact N-O 3.13Å; I319-A360 PolarHBondContact N-O 3.2Å
361	T	94.2	Very high	89.1	Confident	0 Å²	0	29 Å²	29	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	152.2	173.9	-174.8	0	0	0	0	112.3	L254 L255 F256 G257 K263 D320 I363 P364 L367	L254-T361 HydrophobicContact CD1-CG2 4.06Å; L254-T361 HydrophobicContact CD2-CG2 4.46Å; L254-T361 HydrophobicContact CG-CG2 4.48Å; L255-T361 PolarHBondContact O-N 3.25Å; F256-T361 WeakPolarHBondContact CA-O 3.46Å; F256-T361 HydrophobicContact CB-CG2 3.82Å; G257-T361 PolarHBondContact N-O 3.15Å; K263-T361 WeakPolarHBondContact CE-O 3.48Å; D320-T361 WeakPolarHBondContact CB-OG1 3.43Å; D320-T361 VanDerWaalsContact CG-OG1 3.22Å; D320-T361 WeakPolarHBondContact OD1-CB 3.35Å; D320-T361 PolarHBondContact OD1-OG1 3Å; T361-I363 PolarHBondContact OG1-N 3.31Å; T361-I363 VanDerWaalsContact OG1-N 3.13Å; T361-P364 HydrophobicContact CG2-CB 3.88Å; T361-L367 HydrophobicContact CG2-CD1 4.09Å
362	N	94.1	Very high	89.7	Confident	46 Å²	46	26.7 Å²	26.7	25%	0.246	15%	0.151	C	C	.	.	S	Bend	trans	-96.4	-17.4	170.7	-59.3	-45.2	0	0	0	112.8	G257 P259 K263	G257-N362 WeakPolarHBondContact O-CA 3.4Å; G257-N362 PolarHBondContact O-OD1 3.02Å; P259-N362 WeakPolarHBondContact CA-OD1 3.43Å; K263-N362 VanDerWaalsContact CE-OD1 3.22Å; K263-N362 WeakPolarHBondContact CE-OD1 3.3Å; K263-N362 PolarHBondContact NZ-OD1 2.85Å
363	I	92.6	Very high	90.1	Very high	60 Å²	60	34.5 Å²	34.5	31%	0.308	18%	0.18	S	C	.	.			trans	-131.4	62.3	-170.3	54.1	172.5	0	0	0	111.5	D320 T361 W365 T366	D320-I363 HydrophobicContact CB-CD1 4.25Å; D320-I363 HydrophobicContact CB-CG1 3.83Å; D320-I363 WeakPolarHBondContact OD2-CD1 3.5Å; D320-I363 WeakPolarHBondContact OD2-CG1 3.39Å; T361-I363 PolarHBondContact OG1-N 3.31Å; T361-I363 VanDerWaalsContact OG1-N 3.13Å; I363-W365 HydrophobicContact CB-CH2 4.44Å; I363-W365 HydrophobicContact CB-CZ2 3.86Å; I363-W365 HydrophobicContact CG2-CH2 4.12Å; I363-W365 HydrophobicContact CG2-CZ2 3.57Å; I363-W365 PolarHBondContact O-N 3.28Å; I363-T366 HydrophobicContact CB-CG2 4.31Å; I363-T366 HydrophobicContact CD1-CG2 3.87Å; I363-T366 HydrophobicContact CG1-CG2 4.26Å; I363-T366 PolarHBondContact O-N 2.89Å; I363-T366 PolarHBondContact O-OG1 3.39Å
364	P	92.6	Very high	90.5	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.172	C	C	.	.	G	3₁₀ helix	trans	-62.7	-21.1	-168	30	-40.5	0	0	0	114.7	F256 T361 T366 L367 L516 F519	F256-P364 HydrophobicContact CB-CB 3.99Å; F256-P364 HydrophobicContact CB-CG 4.13Å; F256-P364 HydrophobicContact CD2-CB 4.27Å; F256-P364 HydrophobicContact CD2-CG 3.74Å; F256-P364 HydrophobicContact CE2-CG 4.5Å; F256-P364 HydrophobicContact CG-CB 4.21Å; F256-P364 HydrophobicContact CG-CG 4.16Å; T361-P364 HydrophobicContact CG2-CB 3.88Å; P364-T366 VanDerWaalsContact C-N 3.25Å; P364-T366 PolarHBondContact O-N 3.46Å; P364-L367 WeakPolarHBondContact O-CB 3.43Å; P364-L367 PolarHBondContact O-N 2.74Å; P364-L516 HydrophobicContact CG-CD2 4.02Å; P364-F519 HydrophobicContact CB-CD1 3.76Å; P364-F519 HydrophobicContact CB-CD2 4.09Å; P364-F519 HydrophobicContact CB-CE1 3.55Å; P364-F519 HydrophobicContact CB-CE2 3.87Å; P364-F519 HydrophobicContact CB-CG 4.05Å; P364-F519 HydrophobicContact CB-CZ 3.61Å; P364-F519 HydrophobicContact CG-CB 4.26Å; P364-F519 HydrophobicContact CG-CD1 3.62Å; P364-F519 HydrophobicContact CG-CD2 4.07Å; P364-F519 HydrophobicContact CG-CE1 3.97Å; P364-F519 HydrophobicContact CG-CE2 4.37Å; P364-F519 HydrophobicContact CG-CG 3.69Å; P364-F519 HydrophobicContact CG-CZ 4.34Å; P364-F519 WeakPolarHBondContact O-CE2 3.49Å
365	W	90.6	Very high	90.9	Very high	93 Å²	93	32.4 Å²	32.4	35%	0.352	15%	0.153	S	C	.	.	G	3₁₀ helix	trans	-67.7	-19.9	176	53.1	80.6	0	0	0	113.9	I363 L367 K515 L516 F519	I363-W365 HydrophobicContact CB-CH2 4.44Å; I363-W365 HydrophobicContact CB-CZ2 3.86Å; I363-W365 HydrophobicContact CG2-CH2 4.12Å; I363-W365 HydrophobicContact CG2-CZ2 3.57Å; I363-W365 PolarHBondContact O-N 3.28Å; W365-L367 VanDerWaalsContact C-N 3.27Å; W365-K515 HydrophobicContact CE3-CB 3.99Å; W365-K515 HydrophobicContact CH2-CB 3.85Å; W365-K515 HydrophobicContact CH2-CD 4Å; W365-K515 HydrophobicContact CZ2-CB 4.5Å; W365-K515 HydrophobicContact CZ2-CD 3.92Å; W365-K515 HydrophobicContact CZ3-CB 3.56Å; W365-K515 HydrophobicContact CZ3-CD 4.42Å; W365-L516 HydrophobicContact CZ3-CD2 3.9Å; W365-L516 HydrophobicContact CZ3-CG 4.02Å; W365-F519 HydrophobicContact CB-CD2 4.28Å
366	T	89.8	Confident	90.8	Very high	36 Å²	36	36.2 Å²	36.2	22%	0.221	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	-80.1	-12	175.5	64.4	0	0	0	0	112.3	G324 S325 I363 P364	G324-T366 CarbonylContact C-O 3.38Å; G324-T366 WeakPolarHBondContact CA-O 3.39Å; S325-T366 PolarHBondContact N-O 3.02Å; I363-T366 HydrophobicContact CB-CG2 4.31Å; I363-T366 HydrophobicContact CD1-CG2 3.87Å; I363-T366 HydrophobicContact CG1-CG2 4.26Å; I363-T366 PolarHBondContact O-N 2.89Å; I363-T366 PolarHBondContact O-OG1 3.39Å; P364-T366 VanDerWaalsContact C-N 3.25Å; P364-T366 PolarHBondContact O-N 3.46Å
367	L	88.7	Confident	90.8	Very high	3 Å²	3	36.6 Å²	36.6	2%	0.016	17%	0.171	C	C	.	.	B	Isolated β-bridge	trans	-70.3	132.6	-177.2	-66.6	175.5	0	0	0	112.4	L254 I319 D320 C323 T361 P364 W365 R372	L254-L367 HydrophobicContact CD1-CD1 4.21Å; L254-L367 HydrophobicContact CD2-CD1 3.64Å; I319-L367 HydrophobicContact CG2-CD2 4.11Å; D320-L367 HydrophobicContact CB-CD2 4.08Å; C323-L367 HydrophobicContact CB-CD2 3.85Å; T361-L367 HydrophobicContact CG2-CD1 4.09Å; P364-L367 WeakPolarHBondContact O-CB 3.43Å; P364-L367 PolarHBondContact O-N 2.74Å; W365-L367 VanDerWaalsContact C-N 3.27Å; L367-R372 HydrophobicContact CB-CG 3.66Å; L367-R372 HydrophobicContact CD1-CG 4.48Å; L367-R372 PolarHBondContact O-NE 3.33Å
368	D	85.4	Confident	90.8	Very high	20 Å²	20	38.7 Å²	38.7	11%	0.107	18%	0.178	C	C	.	.			trans	-57.6	141.8	173.7	-168.6	114.2	0	0	0	112.1	C323 R326 K338 A370 I371 R372	C323-D368 PolarHBondContact O-N 3.13Å; R326-D368 IonicContact NE-OD1 3.93Å; K338-D368 VanDerWaalsContact NZ-CG 3.31Å; K338-D368 IonicContact NZ-OD1 3.69Å; K338-D368 PolarHBondContact NZ-OD1 3.38Å; D368-A370 PolarHBondContact O-N 3.47Å; D368-A370 WeakPolarHBondContact OD2-CB 3.3Å; D368-A370 PolarHBondContact OD2-N 2.92Å; D368-I371 PolarHBondContact O-N 3.34Å; D368-I371 VanDerWaalsContact O-N 3.13Å; D368-R372 WeakPolarHBondContact O-CG 3.32Å; D368-R372 PolarHBondContact O-N 3.21Å
369	S	85.6	Confident	90.7	Very high	50 Å²	50	38.7 Å²	38.7	35%	0.35	18%	0.178	S	C	.	.	H	α-helix	trans	-55.5	-33.3	178.6	69.2	0	0	0	0	113.9	R373	S369-R373 WeakPolarHBondContact O-CB 3.44Å; S369-R373 VanDerWaalsContact O-CG 3.26Å; S369-R373 WeakPolarHBondContact O-CG 3.34Å; S369-R373 PolarHBondContact O-N 3.08Å
370	A	86.7	Confident	90.6	Very high	31 Å²	31	40.4 Å²	40.4	26%	0.256	19%	0.185	S	C	.	.	H	α-helix	trans	-66.9	-43.1	178.5	0	0	0	0	0	111.6	L342 D368 R373 R374	L342-A370 HydrophobicContact CD1-CB 4.05Å; L342-A370 HydrophobicContact CD2-CB 4.46Å; D368-A370 PolarHBondContact O-N 3.47Å; D368-A370 WeakPolarHBondContact OD2-CB 3.3Å; D368-A370 PolarHBondContact OD2-N 2.92Å; A370-R373 PolarHBondContact O-N 2.95Å; A370-R374 WeakPolarHBondContact O-CG 3.32Å; A370-R374 PolarHBondContact O-N 3.27Å
371	I	87.4	Confident	90.6	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-70	-45.2	177	-66.9	-77.3	0	0	0	109.8	C323 F341 L342 D368 R373 R374 F375	C323-I371 HydrophobicContact CB-CB 4.19Å; C323-I371 HydrophobicContact CB-CD1 4.29Å; C323-I371 HydrophobicContact CB-CG1 3.81Å; C323-I371 HydrophobicContact CB-CG2 3.92Å; C323-I371 VanDerWaalsContact SG-CD1 3.5Å; F341-I371 HydrophobicContact CD1-CD1 3.9Å; F341-I371 HydrophobicContact CE1-CD1 4.25Å; L342-I371 HydrophobicContact CD1-CD1 4.3Å; L342-I371 HydrophobicContact CD2-CD1 3.39Å; L342-I371 HydrophobicContact CD2-CG1 4.01Å; L342-I371 HydrophobicContact CG-CD1 3.67Å; L342-I371 HydrophobicContact CG-CG1 4.39Å; D368-I371 PolarHBondContact O-N 3.34Å; D368-I371 VanDerWaalsContact O-N 3.13Å; I371-R373 PolarHBondContact O-N 3.45Å; I371-R374 PolarHBondContact O-N 3.01Å; I371-F375 HydrophobicContact CG2-CD2 3.77Å; I371-F375 HydrophobicContact CG2-CE2 3.65Å; I371-F375 WeakPolarHBondContact O-CD2 3.4Å; I371-F375 PolarHBondContact O-N 3.17Å; I371-F375 VanDerWaalsContact O-N 3.12Å
372	R	88.6	Confident	90.5	Very high	50 Å²	50	42.7 Å²	42.7	19%	0.189	20%	0.199	C	C	.	.	H	α-helix	trans	-54.5	-38.1	174.9	-72.9	-170.2	-74.3	149.5	-2.4	112.3	L367 D368 F375 R378 F523	L367-R372 HydrophobicContact CB-CG 3.66Å; L367-R372 HydrophobicContact CD1-CG 4.48Å; L367-R372 PolarHBondContact O-NE 3.33Å; D368-R372 WeakPolarHBondContact O-CG 3.32Å; D368-R372 PolarHBondContact O-N 3.21Å; R372-F375 CarbonylContact O-C 3.57Å; R372-F375 PolarHBondContact O-N 3.43Å; R372-R378 PolarHBondContact O-NE 3.04Å; R372-R378 PolarHBondContact O-NH2 3.43Å; R372-F523 VanDerWaalsContact NH1-CZ 3.34Å
373	R	87.8	Confident	90.5	Very high	172 Å²	172	41.8 Å²	41.8	65%	0.649	20%	0.195	S	C	*	.	H	α-helix	trans	-68.9	-27.4	175.7	-76.3	173.2	-177.8	134.8	-1.7	114.2	S369 A370 I371	S369-R373 WeakPolarHBondContact O-CB 3.44Å; S369-R373 VanDerWaalsContact O-CG 3.26Å; S369-R373 WeakPolarHBondContact O-CG 3.34Å; S369-R373 PolarHBondContact O-N 3.08Å; A370-R373 PolarHBondContact O-N 2.95Å; I371-R373 PolarHBondContact O-N 3.45Å
374	R	90.2	Very high	90.5	Very high	88 Å²	88	39.5 Å²	39.5	33%	0.332	18%	0.183	S	C	.	.	H	α-helix	trans	-81.6	-23.7	177.8	-67.9	-70.2	178.1	-99.8	2.5	112.7	L342 M345 A370 I371 E376	L342-R374 HydrophobicContact CD2-CG 3.68Å; M345-R374 HydrophobicContact CE-CB 3.71Å; M345-R374 HydrophobicContact SD-CB 3.91Å; A370-R374 WeakPolarHBondContact O-CG 3.32Å; A370-R374 PolarHBondContact O-N 3.27Å; I371-R374 PolarHBondContact O-N 3.01Å; R374-E376 PolarHBondContact O-N 3.31Å
375	F	92	Very high	90.5	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	22%	0.217	C	C	.	.			trans	-86.7	87.5	164.5	-69.4	-72.3	0	0	0	109.8	I253 L254 I319 M345 V357 I371 R372 R378	I253-F375 VanDerWaalsContact C-CD1 3.45Å; I253-F375 WeakPolarHBondContact O-CD1 3.34Å; L254-F375 HydrophobicContact CB-CB 3.7Å; L254-F375 HydrophobicContact CB-CD1 3.93Å; L254-F375 HydrophobicContact CB-CG 3.79Å; I319-F375 HydrophobicContact CD1-CE2 3.37Å; I319-F375 HydrophobicContact CD1-CZ 3.32Å; M345-F375 HydrophobicContact CE-CD1 4.49Å; M345-F375 HydrophobicContact CE-CE1 4.13Å; M345-F375 HydrophobicContact CE-CE2 4.24Å; M345-F375 HydrophobicContact CE-CZ 3.98Å; V357-F375 HydrophobicContact CG1-CE1 4.04Å; V357-F375 HydrophobicContact CG1-CZ 4.13Å; I371-F375 HydrophobicContact CG2-CD2 3.77Å; I371-F375 HydrophobicContact CG2-CE2 3.65Å; I371-F375 WeakPolarHBondContact O-CD2 3.4Å; I371-F375 PolarHBondContact O-N 3.17Å; I371-F375 VanDerWaalsContact O-N 3.12Å; R372-F375 CarbonylContact O-C 3.57Å; R372-F375 PolarHBondContact O-N 3.43Å; F375-R378 PolarHBondContact O-NE 3.17Å; F375-R378 PolarHBondContact O-NH2 3.48Å
376	E	88.7	Confident	90.7	Very high	90 Å²	90	46.1 Å²	46.1	42%	0.421	22%	0.218	S	C	.	.			trans	-66.2	-43.5	-173.8	-62.4	168.2	152.4	0	0	111.3	W250 R251 G252 R374	W250-E376 HydrophobicContact CE3-CB 3.42Å; W250-E376 VanDerWaalsContact CE3-CB 3.42Å; W250-E376 HydrophobicContact CE3-CG 4.3Å; W250-E376 HydrophobicContact CZ3-CB 3.64Å; W250-E376 HydrophobicContact CZ3-CG 4.5Å; R251-E376 PolarHBondContact N-OE2 2.94Å; G252-E376 PolarHBondContact O-N 2.93Å; G252-E376 VanDerWaalsContact O-N 3.09Å; R374-E376 PolarHBondContact O-N 3.31Å
377	K	91.4	Very high	90.8	Very high	24 Å²	24	51.5 Å²	51.5	10%	0.104	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	131.5	174	-172.4	77.9	176.1	-173.8	0	109.2	W250 G252 I253 L254 I379 Q525	W250-K377 HydrophobicContact CD2-CB 4.33Å; W250-K377 HydrophobicContact CG-CB 4.3Å; G252-K377 PolarHBondContact O-N 3.42Å; I253-K377 CarbonylContact C-O 3.58Å; I253-K377 WeakPolarHBondContact CA-O 3.4Å; I253-K377 HydrophobicContact CG1-CB 4.12Å; L254-K377 PolarHBondContact N-O 3.48Å; K377-I379 HydrophobicContact CG-CD1 4.28Å; K377-I379 HydrophobicContact CG-CG1 4.02Å; K377-Q525 VanDerWaalsContact CE-OE1 3.24Å
378	R	93.8	Very high	91	Very high	49 Å²	49	51.6 Å²	51.6	19%	0.185	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	117	179	-52.9	-178.3	-161.3	95.2	14	108	L254 F256 R372 F375 F523 Q525	L254-R378 HydrophobicContact CB-CG 4.3Å; L254-R378 HydrophobicContact CD2-CG 4.49Å; L254-R378 CarbonylContact O-C 3.4Å; L254-R378 WeakPolarHBondContact O-CA 3.21Å; F256-R378 HydrophobicContact CD1-CB 4.34Å; F256-R378 HydrophobicContact CE1-CB 4.02Å; R372-R378 PolarHBondContact O-NE 3.04Å; R372-R378 PolarHBondContact O-NH2 3.43Å; F375-R378 PolarHBondContact O-NE 3.17Å; F375-R378 PolarHBondContact O-NH2 3.48Å; R378-F523 WeakPolarHBondContact CD-O 3.31Å; R378-F523 PolarHBondContact NH1-O 3.25Å; R378-Q525 PolarHBondContact O-N 3.42Å; R378-Q525 VanDerWaalsContact O-N 3.14Å
379	I	93.9	Very high	91.5	Very high	1 Å²	1	51.2 Å²	51.2	1%	0.005	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	119.9	-172.4	-56.6	177	0	0	0	107.9	A225 A228 L229 I253 L254 L255 F256 K377 I381	A225-I379 HydrophobicContact CB-CG2 3.83Å; A228-I379 HydrophobicContact CB-CD1 3.88Å; A228-I379 HydrophobicContact CB-CG1 4.33Å; A228-I379 HydrophobicContact CB-CG2 4.48Å; L229-I379 HydrophobicContact CD2-CD1 3.82Å; L229-I379 HydrophobicContact CG-CD1 3.81Å; I253-I379 HydrophobicContact CG2-CD1 3.78Å; I253-I379 HydrophobicContact CG2-CG1 4.22Å; L254-I379 PolarHBondContact O-N 2.98Å; L255-I379 HydrophobicContact CD2-CB 4.03Å; L255-I379 HydrophobicContact CD2-CD1 4.32Å; L255-I379 HydrophobicContact CD2-CG2 4.5Å; F256-I379 WeakPolarHBondContact CD1-O 3.46Å; F256-I379 PolarHBondContact N-O 3.41Å; K377-I379 HydrophobicContact CG-CD1 4.28Å; K377-I379 HydrophobicContact CG-CG1 4.02Å; I379-I381 HydrophobicContact CG2-CD1 3.95Å
380	Y	94.1	Very high	91.9	Very high	35 Å²	35	49.2 Å²	49.2	14%	0.137	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	130.4	174.2	178.8	-127.3	0	0	0	110.5	F256 P382 L516 T520	F256-Y380 AromaticContact CD2-CD2 3.88Å; F256-Y380 HydrophobicContact CD2-CD2 3.88Å; F256-Y380 AromaticContact CE2-CD2 3.51Å; F256-Y380 HydrophobicContact CE2-CD2 3.51Å; F256-Y380 HydrophobicContact CE2-CE2 4.42Å; F256-Y380 HydrophobicContact CE2-CG 4.09Å; F256-Y380 HydrophobicContact CZ-CD2 4.1Å; F256-Y380 HydrophobicContact CZ-CG 4.23Å; F256-Y380 CarbonylContact O-C 3.59Å; F256-Y380 WeakPolarHBondContact O-CA 3.39Å; Y380-P382 HydrophobicContact CD1-CB 4.3Å; Y380-P382 HydrophobicContact CE1-CB 3.7Å; Y380-P382 WeakPolarHBondContact O-CD 3.29Å; Y380-L516 HydrophobicContact CE2-CB 4.02Å; Y380-L516 HydrophobicContact CE2-CD1 4.41Å; Y380-T520 HydrophobicContact CG-CG2 4.49Å
381	I	94.5	Very high	92.2	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	23%	0.23	C	C	.	.			trans	-109.4	97.4	176.4	-53	-55.6	0	0	0	108.3	L222 A225 L255 F256 P258 T261 K263 L266 I379	L222-I381 HydrophobicContact CD1-CG2 3.89Å; L222-I381 HydrophobicContact CD2-CG2 3.93Å; A225-I381 HydrophobicContact CB-CD1 3.49Å; A225-I381 VanDerWaalsContact CB-CD1 3.49Å; L255-I381 HydrophobicContact CB-CG1 4.37Å; L255-I381 HydrophobicContact CD2-CD1 4.43Å; F256-I381 PolarHBondContact O-N 2.91Å; P258-I381 WeakPolarHBondContact CD-O 3.4Å; T261-I381 WeakPolarHBondContact OG1-CG2 3.19Å; K263-I381 HydrophobicContact CG-CB 4.15Å; K263-I381 HydrophobicContact CG-CG1 4Å; K263-I381 HydrophobicContact CG-CG2 4.32Å; L266-I381 HydrophobicContact CD2-CD1 3.63Å; L266-I381 HydrophobicContact CD2-CG1 4.49Å; I379-I381 HydrophobicContact CG2-CD1 3.95Å
382	P	93	Very high	92.5	Very high	48 Å²	48	52.9 Å²	52.9	31%	0.312	24%	0.236	S	C	.	.	P	Polyproline II helix	trans	-71.9	173.8	-176.2	29.9	-36.5	0	0	0	113	L222 T261 Y380	L222-P382 HydrophobicContact CD2-CG 4.04Å; T261-P382 WeakPolarHBondContact CG2-O 3.3Å; Y380-P382 HydrophobicContact CD1-CB 4.3Å; Y380-P382 HydrophobicContact CE1-CB 3.7Å; Y380-P382 WeakPolarHBondContact O-CD 3.29Å
383	L	93.8	Very high	92.8	Very high	28 Å²	28	50.5 Å²	50.5	15%	0.147	23%	0.227	C	C	.	.	P	Polyproline II helix	trans	-62.9	148.3	163.9	-69.7	176	0	0	0	110.4	P258 T261 V508 L513	P258-L383 HydrophobicContact CB-CD2 4.1Å; P258-L383 HydrophobicContact CG-CD2 4.16Å; P258-L383 HydrophobicContact CG-CG 4.16Å; T261-L383 HydrophobicContact CG2-CD2 3.99Å; L383-V508 HydrophobicContact CD2-CG2 4.22Å; L383-L513 HydrophobicContact CD1-CD1 3.94Å; L383-L513 HydrophobicContact CD1-CD2 3.92Å; L383-L513 HydrophobicContact CG-CD2 4.24Å
384	P	93	Very high	93	Very high	11 Å²	11	46 Å²	46	7%	0.071	21%	0.212	C	C	.	.	P	Polyproline II helix	trans	-67.6	139.4	-177.8	27.6	-35	0	0	0	112.4	A388 R389 M392 Y419	P384-A388 HydrophobicContact CB-CB 3.91Å; P384-R389 HydrophobicContact CB-CG 3.88Å; P384-R389 HydrophobicContact CG-CG 3.72Å; P384-R389 PolarHBondContact O-NH1 3.3Å; P384-M392 HydrophobicContact CB-CE 3.75Å; P384-M392 HydrophobicContact CB-SD 4.14Å; P384-M392 HydrophobicContact CG-CE 4.21Å; P384-M392 HydrophobicContact CG-SD 4.16Å; P384-Y419 WeakPolarHBondContact CD-O 3.3Å; P384-Y419 WeakPolarHBondContact CG-O 3.24Å
385	E	92.1	Very high	93	Very high	152 Å²	152	45.7 Å²	45.7	71%	0.71	22%	0.217	S	C	*	.	P	Polyproline II helix	trans	-70	166.4	172.4	-62.8	178.3	-173.7	0	0	112.5	H387 A388 R389	E385-H387 VanDerWaalsContact C-N 3.3Å; E385-H387 PolarHBondContact O-N 3.2Å; E385-A388 WeakPolarHBondContact O-CB 3.1Å; E385-A388 PolarHBondContact O-N 3.24Å; E385-R389 WeakPolarHBondContact O-CG 3.46Å; E385-R389 PolarHBondContact O-N 3.35Å
386	E	94.1	Very high	93	Very high	80 Å²	80	49 Å²	49	37%	0.374	23%	0.232	S	C	.	.	H	α-helix	trans	-50	-46.2	-179	-175.5	-172.8	141.2	0	0	113.2	R389 T390 K414	E386-R389 PolarHBondContact O-N 3.47Å; E386-T390 WeakPolarHBondContact O-CB 3.42Å; E386-T390 PolarHBondContact O-N 2.92Å; E386-T390 PolarHBondContact O-OG1 2.98Å; E386-K414 HydrophobicContact CG-CG 3.97Å; E386-K414 WeakPolarHBondContact OE1-CE 3.31Å; E386-K414 WeakPolarHBondContact OE1-CG 3.25Å
387	H	92.7	Very high	93.1	Very high	149 Å²	149	45 Å²	45	69%	0.69	21%	0.214	S	C	*	.	H	α-helix	trans	-67	-40.2	-179.8	-173.4	57.9	0	0	0	111.9	E385 T390 F391	E385-H387 VanDerWaalsContact C-N 3.3Å; E385-H387 PolarHBondContact O-N 3.2Å; H387-T390 WeakPolarHBondContact O-CB 3.28Å; H387-T390 PolarHBondContact O-N 2.83Å; H387-F391 PolarHBondContact O-N 3.34Å
388	A	92.9	Very high	93	Very high	6 Å²	6	46.6 Å²	46.6	5%	0.05	24%	0.236	C	C	.	.	H	α-helix	trans	-63.8	-43.7	175.6	0	0	0	0	0	111.2	P384 E385 T390 F391 M392	P384-A388 HydrophobicContact CB-CB 3.91Å; E385-A388 WeakPolarHBondContact O-CB 3.1Å; E385-A388 PolarHBondContact O-N 3.24Å; A388-T390 PolarHBondContact O-N 2.92Å; A388-F391 PolarHBondContact O-N 3.46Å; A388-M392 VanDerWaalsContact O-CG 3.25Å; A388-M392 WeakPolarHBondContact O-CG 3.35Å; A388-M392 PolarHBondContact O-N 3.14Å
389	R	94.9	Very high	92.8	Very high	12 Å²	12	51.2 Å²	51.2	5%	0.045	27%	0.27	C	S	.	.	H	α-helix	trans	-62.1	-42.1	175.5	-63.9	-171.2	-58.4	-112.5	12.7	112	P384 E385 E386 F391 M392 F393 G413 T416 D417 I424	P384-R389 HydrophobicContact CB-CG 3.88Å; P384-R389 HydrophobicContact CG-CG 3.72Å; P384-R389 PolarHBondContact O-NH1 3.3Å; E385-R389 WeakPolarHBondContact O-CG 3.46Å; E385-R389 PolarHBondContact O-N 3.35Å; E386-R389 PolarHBondContact O-N 3.47Å; R389-F391 VanDerWaalsContact C-N 3.31Å; R389-F391 PolarHBondContact O-N 3.15Å; R389-M392 PolarHBondContact O-N 3.08Å; R389-F393 VanDerWaalsContact O-CD2 3.23Å; R389-F393 WeakPolarHBondContact O-CD2 3.5Å; R389-F393 PolarHBondContact O-N 2.89Å; R389-F393 VanDerWaalsContact O-N 3.08Å; R389-G413 PolarHBondContact NE-O 3.08Å; R389-G413 PolarHBondContact NH2-O 3.33Å; R389-T416 WeakPolarHBondContact CD-O 3.44Å; R389-T416 PolarHBondContact NE-O 3.45Å; R389-T416 VanDerWaalsContact NE-O 3.15Å; R389-D417 IonicContact CZ-OD1 3.19Å; R389-D417 IonicContact NH1-OD1 2.7Å; R389-D417 PolarHBondContact NH1-OD1 2.94Å; R389-D417 IonicContact NH2-OD1 3.61Å; R389-D417 PolarHBondContact NH2-OD1 3.28Å; R389-D417 VanDerWaalsContact NH2-OD1 3.14Å; R389-I424 HydrophobicContact CB-CD1 3.72Å; R389-I424 HydrophobicContact CG-CD1 3.64Å
390	T	94.8	Very high	92.6	Very high	8 Å²	8	54 Å²	54	5%	0.049	29%	0.288	C	S	.	.	H	α-helix	trans	-56.3	-46.7	174.4	-61.1	0	0	0	0	111.2	E386 H387 A388 F393 K394 F409 V410	E386-T390 WeakPolarHBondContact O-CB 3.42Å; E386-T390 PolarHBondContact O-N 2.92Å; E386-T390 PolarHBondContact O-OG1 2.98Å; H387-T390 WeakPolarHBondContact O-CB 3.28Å; H387-T390 PolarHBondContact O-N 2.83Å; A388-T390 PolarHBondContact O-N 2.92Å; T390-F393 PolarHBondContact O-N 3.05Å; T390-K394 PolarHBondContact O-N 3.32Å; T390-F409 HydrophobicContact CG2-CB 3.93Å; T390-V410 HydrophobicContact CG2-CG2 4.04Å
391	F	92.3	Very high	92.2	Very high	82 Å²	82	56.8 Å²	56.8	36%	0.36	31%	0.31	S	S	.	.	H	α-helix	trans	-66.7	-41.5	177.2	-178.6	-90.7	0	0	0	112.3	A220 H387 A388 R389 F393 K394 L395	A220-F391 HydrophobicContact CB-CB 4.49Å; A220-F391 HydrophobicContact CB-CD1 3.43Å; A220-F391 VanDerWaalsContact CB-CD1 3.43Å; A220-F391 HydrophobicContact CB-CE1 4.02Å; A220-F391 HydrophobicContact CB-CG 4.32Å; H387-F391 PolarHBondContact O-N 3.34Å; A388-F391 PolarHBondContact O-N 3.46Å; R389-F391 VanDerWaalsContact C-N 3.31Å; R389-F391 PolarHBondContact O-N 3.15Å; F391-F393 VanDerWaalsContact C-N 3.28Å; F391-F393 PolarHBondContact O-N 3.42Å; F391-K394 WeakPolarHBondContact O-CB 3.34Å; F391-K394 PolarHBondContact O-N 3.15Å; F391-K394 VanDerWaalsContact O-N 3.08Å; F391-L395 HydrophobicContact CD1-CB 4.47Å; F391-L395 HydrophobicContact CE1-CB 4.3Å; F391-L395 HydrophobicContact CE1-CD2 4.28Å; F391-L395 WeakPolarHBondContact O-CB 3.43Å; F391-L395 PolarHBondContact O-N 2.8Å
392	M	93	Very high	92.1	Very high	25 Å²	25	58.8 Å²	58.8	12%	0.123	32%	0.322	C	S	.	.	H	α-helix	trans	-58.7	-37.8	177.7	-72.3	173.3	-176.2	0	0	112.5	A220 P384 A388 R389 L395 H396 I424	A220-M392 HydrophobicContact CB-CE 4.02Å; A220-M392 HydrophobicContact CB-CG 4.04Å; P384-M392 HydrophobicContact CB-CE 3.75Å; P384-M392 HydrophobicContact CB-SD 4.14Å; P384-M392 HydrophobicContact CG-CE 4.21Å; P384-M392 HydrophobicContact CG-SD 4.16Å; A388-M392 VanDerWaalsContact O-CG 3.25Å; A388-M392 WeakPolarHBondContact O-CG 3.35Å; A388-M392 PolarHBondContact O-N 3.14Å; R389-M392 PolarHBondContact O-N 3.08Å; M392-L395 PolarHBondContact O-N 2.92Å; M392-H396 WeakPolarHBondContact O-CB 3.41Å; M392-H396 PolarHBondContact O-CD2 3.22Å; M392-H396 PolarHBondContact O-N 2.89Å; M392-I424 HydrophobicContact CB-CD1 4.31Å; M392-I424 HydrophobicContact CB-CG2 4.09Å; M392-I424 HydrophobicContact SD-CD1 4.05Å
393	F	95	Very high	92.1	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-61.2	-44.3	173.7	-85.1	-70.7	0	0	0	112.5	R389 T390 F391 L397 F409 L412 T416 I424 I427 V428 M497	R389-F393 VanDerWaalsContact O-CD2 3.23Å; R389-F393 WeakPolarHBondContact O-CD2 3.5Å; R389-F393 PolarHBondContact O-N 2.89Å; R389-F393 VanDerWaalsContact O-N 3.08Å; T390-F393 PolarHBondContact O-N 3.05Å; F391-F393 VanDerWaalsContact C-N 3.28Å; F391-F393 PolarHBondContact O-N 3.42Å; F393-L397 WeakPolarHBondContact O-CG 3.17Å; F393-L397 PolarHBondContact O-N 2.94Å; F393-F409 HydrophobicContact CB-CD1 3.77Å; F393-F409 HydrophobicContact CB-CE1 4.22Å; F393-L412 HydrophobicContact CD1-CD1 4.13Å; F393-L412 HydrophobicContact CD2-CB 3.75Å; F393-L412 HydrophobicContact CE1-CB 4.42Å; F393-L412 HydrophobicContact CE1-CD1 4.36Å; F393-L412 HydrophobicContact CE2-CB 3.63Å; F393-L412 HydrophobicContact CG-CB 4.22Å; F393-L412 HydrophobicContact CG-CD1 4.28Å; F393-L412 HydrophobicContact CZ-CB 3.99Å; F393-T416 HydrophobicContact CE2-CG2 3.78Å; F393-T416 HydrophobicContact CZ-CG2 3.66Å; F393-I424 HydrophobicContact CD1-CG2 3.98Å; F393-I424 HydrophobicContact CD2-CG2 4.14Å; F393-I424 HydrophobicContact CE1-CG2 3.96Å; F393-I424 HydrophobicContact CE2-CG1 4.4Å; F393-I424 HydrophobicContact CE2-CG2 4.11Å; F393-I424 HydrophobicContact CG-CG2 4.06Å; F393-I424 HydrophobicContact CZ-CG1 4.47Å; F393-I424 HydrophobicContact CZ-CG2 4.03Å; F393-I427 HydrophobicContact CE1-CG2 3.99Å; F393-I427 HydrophobicContact CZ-CG2 4.43Å; F393-V428 HydrophobicContact CD1-CG2 3.46Å; F393-V428 VanDerWaalsContact CD1-CG2 3.46Å; F393-V428 HydrophobicContact CE1-CG2 3.84Å; F393-M497 HydrophobicContact CD1-CE 3.51Å; F393-M497 HydrophobicContact CE1-CE 3.83Å
394	K	92.5	Very high	92.1	Very high	78 Å²	78	58.7 Å²	58.7	34%	0.339	32%	0.323	S	S	.	.	H	α-helix	trans	-64.5	-44.8	176.2	-63.4	-173.8	-174.3	-169.7	0	111.2	T390 F391 H396 L397 G398 D406 F409	T390-K394 PolarHBondContact O-N 3.32Å; F391-K394 WeakPolarHBondContact O-CB 3.34Å; F391-K394 PolarHBondContact O-N 3.15Å; F391-K394 VanDerWaalsContact O-N 3.08Å; K394-H396 PolarHBondContact O-N 2.7Å; K394-L397 PolarHBondContact O-N 3.39Å; K394-G398 PolarHBondContact O-N 2.66Å; K394-G398 VanDerWaalsContact O-N 3.15Å; K394-D406 WeakPolarHBondContact CE-OD1 3.39Å; K394-D406 IonicContact NZ-OD1 3.94Å; K394-D406 PolarHBondContact NZ-OD1 3.21Å; K394-F409 HydrophobicContact CD-CD2 4.18Å; K394-F409 HydrophobicContact CD-CG 4.31Å; K394-F409 HydrophobicContact CG-CB 4.24Å; K394-F409 HydrophobicContact CG-CD1 3.79Å; K394-F409 HydrophobicContact CG-CD2 3.78Å; K394-F409 HydrophobicContact CG-CE1 4.08Å; K394-F409 HydrophobicContact CG-CE2 4.05Å; K394-F409 HydrophobicContact CG-CG 3.64Å; K394-F409 HydrophobicContact CG-CZ 4.19Å
395	L	90.6	Very high	92.2	Very high	82 Å²	82	63.1 Å²	63.1	43%	0.429	35%	0.347	S	S	.	.	H	α-helix	trans	-58.9	-47.4	179.5	-178.7	66.2	0	0	0	111.7	F391 M392 G398	F391-L395 HydrophobicContact CD1-CB 4.47Å; F391-L395 HydrophobicContact CE1-CB 4.3Å; F391-L395 HydrophobicContact CE1-CD2 4.28Å; F391-L395 WeakPolarHBondContact O-CB 3.43Å; F391-L395 PolarHBondContact O-N 2.8Å; M392-L395 PolarHBondContact O-N 2.92Å; L395-G398 PolarHBondContact O-N 3.19Å
396	H	91.7	Very high	92.2	Very high	69 Å²	69	61.1 Å²	61.1	32%	0.319	34%	0.341	S	S	.	.	H	α-helix	trans	-75.4	-24.1	-176.9	-74.1	-52.4	0	0	0	114.2	M392 K394 V428	M392-H396 WeakPolarHBondContact O-CB 3.41Å; M392-H396 PolarHBondContact O-CD2 3.22Å; M392-H396 PolarHBondContact O-N 2.89Å; K394-H396 PolarHBondContact O-N 2.7Å; H396-V428 HydrophobicContact CB-CB 3.93Å; H396-V428 HydrophobicContact CB-CG1 3.79Å; H396-V428 HydrophobicContact CB-CG2 3.99Å
397	L	91.8	Very high	92.3	Very high	7 Å²	7	60.8 Å²	60.8	4%	0.037	35%	0.347	C	S	.	.	H	α-helix	trans	-74	-29.6	170.1	-78.4	172	0	0	0	112.4	F393 K394 T399 T400 T402 L404 F409 V428 L432 M497	F393-L397 WeakPolarHBondContact O-CG 3.17Å; F393-L397 PolarHBondContact O-N 2.94Å; K394-L397 PolarHBondContact O-N 3.39Å; L397-T399 PolarHBondContact O-N 3.08Å; L397-T400 VanDerWaalsContact O-CB 3.29Å; L397-T400 WeakPolarHBondContact O-CB 3.41Å; L397-T400 PolarHBondContact O-N 3.07Å; L397-T400 VanDerWaalsContact O-N 3.16Å; L397-T400 PolarHBondContact O-OG1 3.36Å; L397-T402 HydrophobicContact CD1-CG2 4.11Å; L397-T402 HydrophobicContact CD2-CG2 3.94Å; L397-L404 HydrophobicContact CD1-CD1 3.78Å; L397-F409 HydrophobicContact CD1-CE1 3.37Å; L397-F409 HydrophobicContact CD1-CZ 3.54Å; L397-V428 HydrophobicContact CD2-CG1 3.78Å; L397-V428 HydrophobicContact CG-CG1 3.88Å; L397-L432 HydrophobicContact CD2-CD2 3.93Å; L397-L432 HydrophobicContact CD2-CG 4.26Å; L397-M497 HydrophobicContact CD1-CE 4.26Å
398	G	89.6	Confident	92.5	Very high	56 Å²	56	55.5 Å²	55.5	58%	0.577	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.2	-130	178.7	0	0	0	0	0	112	K394 L395 T400	K394-G398 PolarHBondContact O-N 2.66Å; K394-G398 VanDerWaalsContact O-N 3.15Å; L395-G398 PolarHBondContact O-N 3.19Å; G398-T400 VanDerWaalsContact C-N 3.33Å
399	T	87.8	Confident	92.6	Very high	146 Å²	146	56 Å²	56	90%	0.896	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	9	-179.8	56	0	0	0	0	113.4	L397	L397-T399 PolarHBondContact O-N 3.08Å
400	T	89.8	Confident	92.7	Very high	61 Å²	61	58.1 Å²	58.1	37%	0.374	34%	0.339	S	S	.	.			trans	-64.7	130	-177.8	-50.5	0	0	0	0	109.6	L397 G398 T402 L432	L397-T400 VanDerWaalsContact O-CB 3.29Å; L397-T400 WeakPolarHBondContact O-CB 3.41Å; L397-T400 PolarHBondContact O-N 3.07Å; L397-T400 VanDerWaalsContact O-N 3.16Å; L397-T400 PolarHBondContact O-OG1 3.36Å; G398-T400 VanDerWaalsContact C-N 3.33Å; T400-T402 WeakPolarHBondContact O-CG2 3.45Å; T400-T402 PolarHBondContact O-N 3.39Å; T400-L432 HydrophobicContact CG2-CD2 3.64Å
401	P	86.8	Confident	92.8	Very high	92 Å²	92	60.4 Å²	60.4	60%	0.597	35%	0.353	S	S	*	.			trans	-58.5	121.9	175.5	-24.8	34.8	0	0	0	111.1	V491	P401-V491 HydrophobicContact CB-CG1 4.17Å
402	T	92.3	Very high	93	Very high	42 Å²	42	56.5 Å²	56.5	26%	0.258	34%	0.336	S	S	.	.	B	Isolated β-bridge	trans	-133.5	159.3	176.7	72.7	0	0	0	0	110.7	L397 T400 L404 V492	L397-T402 HydrophobicContact CD1-CG2 4.11Å; L397-T402 HydrophobicContact CD2-CG2 3.94Å; T400-T402 WeakPolarHBondContact O-CG2 3.45Å; T400-T402 PolarHBondContact O-N 3.39Å; T402-L404 VanDerWaalsContact C-N 3.31Å; T402-L404 PolarHBondContact OG1-N 2.98Å; T402-V492 WeakPolarHBondContact CA-O 3.25Å; T402-V492 HydrophobicContact CG2-CB 4.04Å
403	S	93.1	Very high	93.1	Very high	60 Å²	60	55.3 Å²	55.3	42%	0.42	33%	0.33	S	S	.	.			trans	-93	10	171.7	54.3	0	0	0	0	112.9	V492 C493	S403-V492 PolarHBondContact N-O 3.44Å; S403-V492 PolarHBondContact OG-O 3.47Å; S403-V492 VanDerWaalsContact OG-O 3.08Å; S403-C493 VanDerWaalsContact OG-CA 3.24Å; S403-C493 WeakPolarHBondContact OG-CA 3.42Å; S403-C493 WeakPolarHBondContact OG-CB 3.43Å
404	L	93.4	Very high	93.2	Very high	14 Å²	14	61.2 Å²	61.2	7%	0.073	36%	0.356	C	S	.	.			trans	-84.3	136.1	-176	-61.1	175.4	0	0	0	110.8	L397 T402 D408 F409 M494 M497	L397-L404 HydrophobicContact CD1-CD1 3.78Å; T402-L404 VanDerWaalsContact C-N 3.31Å; T402-L404 PolarHBondContact OG1-N 2.98Å; L404-D408 HydrophobicContact CB-CB 4.4Å; L404-D408 HydrophobicContact CD2-CB 4.09Å; L404-F409 HydrophobicContact CB-CE1 4.42Å; L404-F409 HydrophobicContact CB-CE2 3.99Å; L404-F409 HydrophobicContact CB-CZ 3.78Å; L404-F409 HydrophobicContact CD1-CE1 3.97Å; L404-F409 HydrophobicContact CD1-CZ 4.02Å; L404-M494 HydrophobicContact CD2-CB 3.78Å; L404-M494 HydrophobicContact CD2-SD 4.15Å; L404-M497 HydrophobicContact CD1-CE 4.08Å; L404-M497 HydrophobicContact CD1-CG 3.87Å; L404-M497 HydrophobicContact CD1-SD 4.36Å
405	N	94.3	Very high	93.4	Very high	105 Å²	105	63.4 Å²	63.4	56%	0.561	37%	0.366	S	S	*	.			trans	-102.1	170.2	175.1	-62.4	-26	0	0	0	111.4	S407 D408 F409	N405-S407 PolarHBondContact O-N 3.42Å; N405-D408 PolarHBondContact N-OD2 3.29Å; N405-D408 WeakPolarHBondContact O-CB 3.3Å; N405-D408 PolarHBondContact O-N 3.3Å; N405-F409 WeakPolarHBondContact O-CD2 3.47Å; N405-F409 PolarHBondContact O-N 3.43Å
406	D	93.6	Very high	93.6	Very high	110 Å²	110	59.5 Å²	59.5	59%	0.588	35%	0.345	S	S	*	.	H	α-helix	trans	-55.6	-36.2	178.5	-75.9	-30.7	0	0	0	113.7	K394 D408 F409 V410	K394-D406 WeakPolarHBondContact CE-OD1 3.39Å; K394-D406 IonicContact NZ-OD1 3.94Å; K394-D406 PolarHBondContact NZ-OD1 3.21Å; D406-D408 VanDerWaalsContact C-N 3.29Å; D406-D408 PolarHBondContact O-N 2.99Å; D406-F409 PolarHBondContact O-N 2.97Å; D406-V410 WeakPolarHBondContact O-CG2 3.36Å; D406-V410 PolarHBondContact O-N 3.06Å
407	S	95.6	Very high	93.7	Very high	73 Å²	73	62 Å²	62	51%	0.51	36%	0.361	S	S	.	.	H	α-helix	trans	-64.8	-32.1	175.3	55.1	0	0	0	0	113.2	N405 V410 T411	N405-S407 PolarHBondContact O-N 3.42Å; S407-V410 PolarHBondContact O-N 2.93Å; S407-T411 PolarHBondContact O-N 3.36Å; S407-T411 PolarHBondContact O-OG1 2.93Å
408	D	96	Very high	93.8	Very high	37 Å²	37	62.8 Å²	62.8	20%	0.198	37%	0.371	C	S	.	.	H	α-helix	trans	-71.2	-40.6	179.6	-58.5	-35.7	0	0	0	109.8	L404 N405 D406 V410 T411 L412 M494	L404-D408 HydrophobicContact CB-CB 4.4Å; L404-D408 HydrophobicContact CD2-CB 4.09Å; N405-D408 PolarHBondContact N-OD2 3.29Å; N405-D408 WeakPolarHBondContact O-CB 3.3Å; N405-D408 PolarHBondContact O-N 3.3Å; D406-D408 VanDerWaalsContact C-N 3.29Å; D406-D408 PolarHBondContact O-N 2.99Å; D408-V410 VanDerWaalsContact C-N 3.34Å; D408-V410 PolarHBondContact O-N 3.43Å; D408-T411 CarbonylContact O-C 3.47Å; D408-T411 WeakPolarHBondContact O-CA 3.31Å; D408-T411 WeakPolarHBondContact O-CB 3.42Å; D408-T411 PolarHBondContact O-N 3.29Å; D408-T411 VanDerWaalsContact O-N 3.11Å; D408-L412 WeakPolarHBondContact O-CG 3.32Å; D408-L412 PolarHBondContact O-N 3.17Å; D408-M494 HydrophobicContact CB-SD 4.29Å
409	F	96.2	Very high	94	Very high	16 Å²	16	61.3 Å²	61.3	7%	0.07	35%	0.348	C	S	.	.	H	α-helix	trans	-60.2	-42.8	174.4	-68.7	-61.9	0	0	0	112.7	T390 F393 K394 L397 L404 N405 D406 T411 L412 G413	T390-F409 HydrophobicContact CG2-CB 3.93Å; F393-F409 HydrophobicContact CB-CD1 3.77Å; F393-F409 HydrophobicContact CB-CE1 4.22Å; K394-F409 HydrophobicContact CD-CD2 4.18Å; K394-F409 HydrophobicContact CD-CG 4.31Å; K394-F409 HydrophobicContact CG-CB 4.24Å; K394-F409 HydrophobicContact CG-CD1 3.79Å; K394-F409 HydrophobicContact CG-CD2 3.78Å; K394-F409 HydrophobicContact CG-CE1 4.08Å; K394-F409 HydrophobicContact CG-CE2 4.05Å; K394-F409 HydrophobicContact CG-CG 3.64Å; K394-F409 HydrophobicContact CG-CZ 4.19Å; L397-F409 HydrophobicContact CD1-CE1 3.37Å; L397-F409 HydrophobicContact CD1-CZ 3.54Å; L404-F409 HydrophobicContact CB-CE1 4.42Å; L404-F409 HydrophobicContact CB-CE2 3.99Å; L404-F409 HydrophobicContact CB-CZ 3.78Å; L404-F409 HydrophobicContact CD1-CE1 3.97Å; L404-F409 HydrophobicContact CD1-CZ 4.02Å; N405-F409 WeakPolarHBondContact O-CD2 3.47Å; N405-F409 PolarHBondContact O-N 3.43Å; D406-F409 PolarHBondContact O-N 2.97Å; F409-T411 VanDerWaalsContact C-N 3.3Å; F409-T411 PolarHBondContact O-N 3.44Å; F409-L412 HydrophobicContact CD1-CD1 4.34Å; F409-L412 PolarHBondContact O-N 3.19Å; F409-G413 PolarHBondContact O-N 3.1Å
410	V	96.6	Very high	94.4	Very high	57 Å²	57	54.4 Å²	54.4	35%	0.345	31%	0.306	S	S	.	.	H	α-helix	trans	-62.2	-41.9	174.4	174.2	0	0	0	0	110.5	T390 D406 S407 D408 L412 G413 K414	T390-V410 HydrophobicContact CG2-CG2 4.04Å; D406-V410 WeakPolarHBondContact O-CG2 3.36Å; D406-V410 PolarHBondContact O-N 3.06Å; S407-V410 PolarHBondContact O-N 2.93Å; D408-V410 VanDerWaalsContact C-N 3.34Å; D408-V410 PolarHBondContact O-N 3.43Å; V410-L412 VanDerWaalsContact C-N 3.33Å; V410-L412 PolarHBondContact O-N 2.99Å; V410-G413 PolarHBondContact O-N 3.45Å; V410-K414 HydrophobicContact CG1-CD 4.47Å; V410-K414 WeakPolarHBondContact O-CG 3.26Å; V410-K414 PolarHBondContact O-N 2.93Å
411	T	96.8	Very high	94.5	Very high	56 Å²	56	52.1 Å²	52.1	34%	0.344	29%	0.294	S	S	.	.	H	α-helix	trans	-63	-40.3	177.1	-57.9	0	0	0	0	111.9	S407 D408 F409 K414 K415 M494	S407-T411 PolarHBondContact O-N 3.36Å; S407-T411 PolarHBondContact O-OG1 2.93Å; D408-T411 CarbonylContact O-C 3.47Å; D408-T411 WeakPolarHBondContact O-CA 3.31Å; D408-T411 WeakPolarHBondContact O-CB 3.42Å; D408-T411 PolarHBondContact O-N 3.29Å; D408-T411 VanDerWaalsContact O-N 3.11Å; F409-T411 VanDerWaalsContact C-N 3.3Å; F409-T411 PolarHBondContact O-N 3.44Å; T411-K414 PolarHBondContact O-N 3.02Å; T411-K415 HydrophobicContact CG2-CD 4.36Å; T411-K415 WeakPolarHBondContact O-CG 3.28Å; T411-K415 PolarHBondContact O-N 3.41Å; T411-K415 VanDerWaalsContact O-N 3.09Å; T411-M494 HydrophobicContact CG2-CE 4.01Å
412	L	96.5	Very high	94.8	Very high	0 Å²	0	50 Å²	50	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-64.3	-45.5	174.9	-69	169.5	0	0	0	111.2	F393 D408 F409 V410 K414 K415 T416 M494 M497 L501	F393-L412 HydrophobicContact CD1-CD1 4.13Å; F393-L412 HydrophobicContact CD2-CB 3.75Å; F393-L412 HydrophobicContact CE1-CB 4.42Å; F393-L412 HydrophobicContact CE1-CD1 4.36Å; F393-L412 HydrophobicContact CE2-CB 3.63Å; F393-L412 HydrophobicContact CG-CB 4.22Å; F393-L412 HydrophobicContact CG-CD1 4.28Å; F393-L412 HydrophobicContact CZ-CB 3.99Å; D408-L412 WeakPolarHBondContact O-CG 3.32Å; D408-L412 PolarHBondContact O-N 3.17Å; F409-L412 HydrophobicContact CD1-CD1 4.34Å; F409-L412 PolarHBondContact O-N 3.19Å; V410-L412 VanDerWaalsContact C-N 3.33Å; V410-L412 PolarHBondContact O-N 2.99Å; L412-K414 VanDerWaalsContact C-N 3.28Å; L412-K414 PolarHBondContact O-N 3.26Å; L412-K415 PolarHBondContact O-N 3.34Å; L412-T416 PolarHBondContact O-N 2.9Å; L412-T416 VanDerWaalsContact O-N 3.09Å; L412-T416 PolarHBondContact O-OG1 3.29Å; L412-T416 VanDerWaalsContact O-OG1 3.06Å; L412-M494 HydrophobicContact CD1-SD 4.34Å; L412-M494 HydrophobicContact CD2-CE 3.8Å; L412-M494 HydrophobicContact CD2-SD 3.89Å; L412-M494 HydrophobicContact CG-CE 4.01Å; L412-M494 HydrophobicContact CG-SD 4.07Å; L412-M497 HydrophobicContact CD1-CB 4.34Å; L412-M497 HydrophobicContact CD1-CE 3.58Å; L412-M497 HydrophobicContact CD1-CG 4.29Å; L412-M497 HydrophobicContact CD2-CB 3.9Å; L412-L501 HydrophobicContact CD2-CD1 3.51Å
413	G	95.9	Very high	94.9	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-58.9	-36.2	176.6	0	0	0	0	0	113.7	R389 F409 V410 T416	R389-G413 PolarHBondContact NE-O 3.08Å; R389-G413 PolarHBondContact NH2-O 3.33Å; F409-G413 PolarHBondContact O-N 3.1Å; V410-G413 PolarHBondContact O-N 3.45Å; G413-T416 PolarHBondContact O-OG1 2.98Å
414	K	96.4	Very high	95	Very high	124 Å²	124	45.5 Å²	45.5	54%	0.539	25%	0.254	S	S	.	.	H	α-helix	trans	-68.4	-38.8	172.8	-73	178.2	-179.4	-176.7	0	113	E386 V410 T411 L412 T416	E386-K414 HydrophobicContact CG-CG 3.97Å; E386-K414 WeakPolarHBondContact OE1-CE 3.31Å; E386-K414 WeakPolarHBondContact OE1-CG 3.25Å; V410-K414 HydrophobicContact CG1-CD 4.47Å; V410-K414 WeakPolarHBondContact O-CG 3.26Å; V410-K414 PolarHBondContact O-N 2.93Å; T411-K414 PolarHBondContact O-N 3.02Å; L412-K414 VanDerWaalsContact C-N 3.28Å; L412-K414 PolarHBondContact O-N 3.26Å; K414-T416 VanDerWaalsContact C-N 3.32Å
415	K	95.9	Very high	95.1	Very high	125 Å²	125	46.2 Å²	46.2	54%	0.543	26%	0.26	S	S	.	.	H	α-helix	trans	-75.7	-18.5	-178.3	-77.2	-179.4	175.8	-66.8	0	113.7	T411 L412 L498	T411-K415 HydrophobicContact CG2-CD 4.36Å; T411-K415 WeakPolarHBondContact O-CG 3.28Å; T411-K415 PolarHBondContact O-N 3.41Å; T411-K415 VanDerWaalsContact O-N 3.09Å; L412-K415 PolarHBondContact O-N 3.34Å; K415-L498 HydrophobicContact CD-CD2 3.93Å
416	T	95.8	Very high	95.1	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.5	36.7	-178.2	53.9	0	0	0	0	113.8	R389 F393 L412 G413 K414 G418 Y419 I427 L501	R389-T416 WeakPolarHBondContact CD-O 3.44Å; R389-T416 PolarHBondContact NE-O 3.45Å; R389-T416 VanDerWaalsContact NE-O 3.15Å; F393-T416 HydrophobicContact CE2-CG2 3.78Å; F393-T416 HydrophobicContact CZ-CG2 3.66Å; L412-T416 PolarHBondContact O-N 2.9Å; L412-T416 VanDerWaalsContact O-N 3.09Å; L412-T416 PolarHBondContact O-OG1 3.29Å; L412-T416 VanDerWaalsContact O-OG1 3.06Å; G413-T416 PolarHBondContact O-OG1 2.98Å; K414-T416 VanDerWaalsContact C-N 3.32Å; T416-G418 PolarHBondContact O-N 3.49Å; T416-Y419 VanDerWaalsContact C-CD2 3.42Å; T416-Y419 VanDerWaalsContact CA-CD2 3.49Å; T416-Y419 HydrophobicContact CG2-CD1 4.47Å; T416-Y419 HydrophobicContact CG2-CD2 4.3Å; T416-Y419 HydrophobicContact CG2-CG 4.25Å; T416-Y419 WeakPolarHBondContact O-CB 3.41Å; T416-Y419 WeakPolarHBondContact O-CD2 3.39Å; T416-Y419 PolarHBondContact O-N 2.99Å; T416-Y419 VanDerWaalsContact O-N 3.16Å; T416-I427 HydrophobicContact CG2-CD1 4.29Å; T416-L501 HydrophobicContact CG2-CD2 3.37Å
417	D	94.1	Very high	95.3	Very high	120 Å²	120	39.2 Å²	39.2	64%	0.642	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.7	135.3	174.3	-160.7	39.1	0	0	0	112.1	R389 Y419	R389-D417 IonicContact CZ-OD1 3.19Å; R389-D417 IonicContact NH1-OD1 2.7Å; R389-D417 PolarHBondContact NH1-OD1 2.94Å; R389-D417 IonicContact NH2-OD1 3.61Å; R389-D417 PolarHBondContact NH2-OD1 3.28Å; R389-D417 VanDerWaalsContact NH2-OD1 3.14Å; D417-Y419 VanDerWaalsContact C-N 3.3Å; D417-Y419 WeakPolarHBondContact O-CD2 3.3Å; D417-Y419 PolarHBondContact O-N 3.01Å
418	G	92.6	Very high	95.3	Very high	24 Å²	24	35.8 Å²	35.8	25%	0.247	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.4	-1.5	-173.1	0	0	0	0	0	116	T416	T416-G418 PolarHBondContact O-N 3.49Å
419	Y	95	Very high	95.3	Very high	26 Å²	26	41.8 Å²	41.8	10%	0.102	22%	0.221	C	C	.	.			trans	-81.8	140.6	177.8	-73.7	-114.6	0	0	0	111.6	P384 T416 D417 D423 I427 T504 P506	P384-Y419 WeakPolarHBondContact CD-O 3.3Å; P384-Y419 WeakPolarHBondContact CG-O 3.24Å; T416-Y419 VanDerWaalsContact C-CD2 3.42Å; T416-Y419 VanDerWaalsContact CA-CD2 3.49Å; T416-Y419 HydrophobicContact CG2-CD1 4.47Å; T416-Y419 HydrophobicContact CG2-CD2 4.3Å; T416-Y419 HydrophobicContact CG2-CG 4.25Å; T416-Y419 WeakPolarHBondContact O-CB 3.41Å; T416-Y419 WeakPolarHBondContact O-CD2 3.39Å; T416-Y419 PolarHBondContact O-N 2.99Å; T416-Y419 VanDerWaalsContact O-N 3.16Å; D417-Y419 VanDerWaalsContact C-N 3.3Å; D417-Y419 WeakPolarHBondContact O-CD2 3.3Å; D417-Y419 PolarHBondContact O-N 3.01Å; Y419-D423 HydrophobicContact CD1-CB 3.62Å; Y419-D423 HydrophobicContact CG-CB 4.33Å; Y419-I427 HydrophobicContact CD1-CD1 3.6Å; Y419-I427 HydrophobicContact CE1-CD1 3.63Å; Y419-T504 HydrophobicContact CE1-CG2 4.46Å; Y419-T504 PolarHBondContact OH-O 3.36Å; Y419-P506 HydrophobicContact CD2-CB 4.42Å; Y419-P506 HydrophobicContact CD2-CG 3.85Å; Y419-P506 HydrophobicContact CE1-CG 4.4Å; Y419-P506 HydrophobicContact CE2-CB 4.48Å; Y419-P506 HydrophobicContact CE2-CG 3.52Å; Y419-P506 HydrophobicContact CG-CG 4.46Å
420	S	94.7	Very high	95.2	Very high	1 Å²	1	42.5 Å²	42.5	1%	0.007	23%	0.225	C	C	.	.			trans	-80.3	166.9	170.5	70.9	0	0	0	0	111.8	A422 D423 I424	S420-A422 PolarHBondContact O-N 3.16Å; S420-D423 WeakPolarHBondContact CB-OD2 3.29Å; S420-D423 PolarHBondContact N-OD2 3.49Å; S420-D423 PolarHBondContact O-N 3.1Å; S420-D423 VanDerWaalsContact O-N 3.16Å; S420-D423 PolarHBondContact OG-N 2.94Å; S420-D423 PolarHBondContact OG-OD2 3.04Å; S420-I424 PolarHBondContact O-N 3.45Å; S420-I424 VanDerWaalsContact O-N 3.08Å
421	G	92.7	Very high	95.2	Very high	12 Å²	12	39.8 Å²	39.8	12%	0.124	21%	0.209	C	C	.	.	H	α-helix	trans	-61.1	-34.5	173.4	0	0	0	0	0	112.4	G260 I424 S425	G260-G421 WeakPolarHBondContact O-CA 3.35Å; G260-G421 PolarHBondContact O-N 3.35Å; G421-I424 PolarHBondContact O-N 3.31Å; G421-S425 PolarHBondContact O-N 3.18Å
422	A	92.7	Very high	95.1	Very high	48 Å²	48	39.5 Å²	39.5	40%	0.397	21%	0.205	S	C	.	.	H	α-helix	trans	-63.6	-42.1	173.5	0	0	0	0	0	112.2	G260 S420 S425 V426	G260-A422 PolarHBondContact O-N 3.48Å; G260-A422 VanDerWaalsContact O-N 3.17Å; S420-A422 PolarHBondContact O-N 3.16Å; A422-S425 WeakPolarHBondContact O-CB 3.45Å; A422-S425 PolarHBondContact O-N 3.05Å; A422-V426 WeakPolarHBondContact O-CG2 3.35Å; A422-V426 PolarHBondContact O-N 3.14Å
423	D	95.4	Very high	95.1	Very high	8 Å²	8	43.4 Å²	43.4	4%	0.043	22%	0.224	C	C	.	.	H	α-helix	trans	-64.1	-42.5	177.9	-56.9	-47.3	0	0	0	111	Y419 S420 S425 V426 I427 T507	Y419-D423 HydrophobicContact CD1-CB 3.62Å; Y419-D423 HydrophobicContact CG-CB 4.33Å; S420-D423 WeakPolarHBondContact CB-OD2 3.29Å; S420-D423 PolarHBondContact N-OD2 3.49Å; S420-D423 PolarHBondContact O-N 3.1Å; S420-D423 VanDerWaalsContact O-N 3.16Å; S420-D423 PolarHBondContact OG-N 2.94Å; S420-D423 PolarHBondContact OG-OD2 3.04Å; D423-S425 VanDerWaalsContact C-N 3.34Å; D423-S425 PolarHBondContact O-N 3.4Å; D423-V426 PolarHBondContact O-N 3.06Å; D423-I427 WeakPolarHBondContact O-CD1 3.48Å; D423-I427 WeakPolarHBondContact O-CG1 3.48Å; D423-I427 PolarHBondContact O-N 3.14Å; D423-T507 VanDerWaalsContact OD1-CB 3.28Å; D423-T507 WeakPolarHBondContact OD1-CB 3.31Å; D423-T507 PolarHBondContact OD1-OG1 3.39Å; D423-T507 PolarHBondContact OD2-N 3.49Å
424	I	95.5	Very high	95	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-62	-42.6	175.7	-65.2	170.9	0	0	0	110.8	R389 M392 F393 S420 G421 V426 I427 V428	R389-I424 HydrophobicContact CB-CD1 3.72Å; R389-I424 HydrophobicContact CG-CD1 3.64Å; M392-I424 HydrophobicContact CB-CD1 4.31Å; M392-I424 HydrophobicContact CB-CG2 4.09Å; M392-I424 HydrophobicContact SD-CD1 4.05Å; F393-I424 HydrophobicContact CD1-CG2 3.98Å; F393-I424 HydrophobicContact CD2-CG2 4.14Å; F393-I424 HydrophobicContact CE1-CG2 3.96Å; F393-I424 HydrophobicContact CE2-CG1 4.4Å; F393-I424 HydrophobicContact CE2-CG2 4.11Å; F393-I424 HydrophobicContact CG-CG2 4.06Å; F393-I424 HydrophobicContact CZ-CG1 4.47Å; F393-I424 HydrophobicContact CZ-CG2 4.03Å; S420-I424 PolarHBondContact O-N 3.45Å; S420-I424 VanDerWaalsContact O-N 3.08Å; G421-I424 PolarHBondContact O-N 3.31Å; I424-V426 VanDerWaalsContact C-N 3.27Å; I424-V426 PolarHBondContact O-N 3.18Å; I424-I427 PolarHBondContact O-N 3.04Å; I424-V428 HydrophobicContact CG2-CG2 4.36Å; I424-V428 WeakPolarHBondContact O-CG2 3.34Å; I424-V428 PolarHBondContact O-N 2.88Å
425	S	94.3	Very high	94.9	Very high	28 Å²	28	38.3 Å²	38.3	20%	0.196	20%	0.203	C	C	.	.	H	α-helix	trans	-58.4	-39.9	175.7	-169.6	0	0	0	0	112.3	G421 A422 D423 R429	G421-S425 PolarHBondContact O-N 3.18Å; A422-S425 WeakPolarHBondContact O-CB 3.45Å; A422-S425 PolarHBondContact O-N 3.05Å; D423-S425 VanDerWaalsContact C-N 3.34Å; D423-S425 PolarHBondContact O-N 3.4Å; S425-R429 VanDerWaalsContact O-CB 3.27Å; S425-R429 WeakPolarHBondContact O-CB 3.49Å; S425-R429 PolarHBondContact O-N 2.92Å
426	V	95.6	Very high	94.8	Very high	69 Å²	69	35.3 Å²	35.3	42%	0.418	20%	0.195	S	C	.	.	H	α-helix	trans	-66.6	-44.8	176.5	171.6	0	0	0	0	111.3	A422 D423 I424 V428 R429 D430 T504	A422-V426 WeakPolarHBondContact O-CG2 3.35Å; A422-V426 PolarHBondContact O-N 3.14Å; D423-V426 PolarHBondContact O-N 3.06Å; I424-V426 VanDerWaalsContact C-N 3.27Å; I424-V426 PolarHBondContact O-N 3.18Å; V426-V428 PolarHBondContact O-N 2.97Å; V426-R429 PolarHBondContact O-N 3.42Å; V426-D430 WeakPolarHBondContact O-CB 3.47Å; V426-D430 PolarHBondContact O-N 3.08Å; V426-T504 HydrophobicContact CG1-CG2 4.41Å
427	I	96.4	Very high	94.7	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-57.9	-50.1	177	-67.8	156.4	0	0	0	110.5	F393 T416 Y419 D423 I424 R429 D430 A431 S500 L501 T504	F393-I427 HydrophobicContact CE1-CG2 3.99Å; F393-I427 HydrophobicContact CZ-CG2 4.43Å; T416-I427 HydrophobicContact CG2-CD1 4.29Å; Y419-I427 HydrophobicContact CD1-CD1 3.6Å; Y419-I427 HydrophobicContact CE1-CD1 3.63Å; D423-I427 WeakPolarHBondContact O-CD1 3.48Å; D423-I427 WeakPolarHBondContact O-CG1 3.48Å; D423-I427 PolarHBondContact O-N 3.14Å; I424-I427 PolarHBondContact O-N 3.04Å; I427-R429 VanDerWaalsContact C-N 3.34Å; I427-R429 PolarHBondContact O-N 3.24Å; I427-D430 PolarHBondContact O-N 3.4Å; I427-A431 WeakPolarHBondContact O-CB 3.45Å; I427-A431 PolarHBondContact O-N 3.41Å; I427-S500 WeakPolarHBondContact CA-OG 3.49Å; I427-S500 PolarHBondContact O-OG 2.86Å; I427-L501 HydrophobicContact CD1-CD2 3.52Å; I427-L501 HydrophobicContact CG1-CD2 4.18Å; I427-L501 HydrophobicContact CG2-CD2 3.99Å; I427-L501 HydrophobicContact CG2-CG 4Å; I427-T504 HydrophobicContact CD1-CG2 4.41Å; I427-T504 HydrophobicContact CG1-CG2 3.87Å
428	V	96.2	Very high	94.6	Very high	1 Å²	1	37.6 Å²	37.6	1%	0.006	20%	0.196	C	C	.	.	H	α-helix	trans	-63.8	-42.7	-179.1	176.7	0	0	0	0	110.8	F393 H396 L397 I424 V426 D430 A431 L432 M497	F393-V428 HydrophobicContact CD1-CG2 3.46Å; F393-V428 VanDerWaalsContact CD1-CG2 3.46Å; F393-V428 HydrophobicContact CE1-CG2 3.84Å; H396-V428 HydrophobicContact CB-CB 3.93Å; H396-V428 HydrophobicContact CB-CG1 3.79Å; H396-V428 HydrophobicContact CB-CG2 3.99Å; L397-V428 HydrophobicContact CD2-CG1 3.78Å; L397-V428 HydrophobicContact CG-CG1 3.88Å; I424-V428 HydrophobicContact CG2-CG2 4.36Å; I424-V428 WeakPolarHBondContact O-CG2 3.34Å; I424-V428 PolarHBondContact O-N 2.88Å; V426-V428 PolarHBondContact O-N 2.97Å; V428-D430 PolarHBondContact O-N 2.86Å; V428-A431 PolarHBondContact O-N 3.02Å; V428-L432 HydrophobicContact CG1-CD1 3.88Å; V428-L432 HydrophobicContact CG1-CG 4.25Å; V428-L432 WeakPolarHBondContact O-CB 3.44Å; V428-L432 VanDerWaalsContact O-CG 3.23Å; V428-L432 WeakPolarHBondContact O-CG 3.33Å; V428-L432 PolarHBondContact O-N 3.12Å; V428-M497 HydrophobicContact CG2-CE 4.15Å
429	R	95.5	Very high	94.7	Very high	162 Å²	162	37.1 Å²	37.1	61%	0.611	19%	0.189	S	C	*	.	H	α-helix	trans	-60.8	-43.3	177.4	-172	-175.1	-55.3	171.9	5.4	112.3	S425 V426 I427 L432 M433	S425-R429 VanDerWaalsContact O-CB 3.27Å; S425-R429 WeakPolarHBondContact O-CB 3.49Å; S425-R429 PolarHBondContact O-N 2.92Å; V426-R429 PolarHBondContact O-N 3.42Å; I427-R429 VanDerWaalsContact C-N 3.34Å; I427-R429 PolarHBondContact O-N 3.24Å; R429-L432 PolarHBondContact O-N 3.45Å; R429-M433 WeakPolarHBondContact O-CG 3.35Å; R429-M433 PolarHBondContact O-N 3.41Å
430	D	95.6	Very high	94.7	Very high	31 Å²	31	41.5 Å²	41.5	17%	0.166	21%	0.21	C	C	.	.	H	α-helix	trans	-70.4	-35.1	178.3	175.8	70.8	0	0	0	112.2	V426 I427 V428 M433 Q434 R437 S500	V426-D430 WeakPolarHBondContact O-CB 3.47Å; V426-D430 PolarHBondContact O-N 3.08Å; I427-D430 PolarHBondContact O-N 3.4Å; V428-D430 PolarHBondContact O-N 2.86Å; D430-M433 PolarHBondContact O-N 3.1Å; D430-Q434 PolarHBondContact O-N 3.4Å; D430-R437 IonicContact OD1-CZ 4Å; D430-R437 VanDerWaalsContact OD1-CZ 3.23Å; D430-R437 IonicContact OD1-NH1 3.6Å; D430-R437 PolarHBondContact OD1-NH1 3.36Å; D430-R437 IonicContact OD1-NH2 2.66Å; D430-R437 PolarHBondContact OD1-NH2 3.25Å; D430-R437 IonicContact OD2-NH1 3.78Å; D430-S500 VanDerWaalsContact CB-OG 3.32Å; D430-S500 WeakPolarHBondContact CB-OG 3.11Å; D430-S500 VanDerWaalsContact OD2-CB 3.28Å; D430-S500 WeakPolarHBondContact OD2-CB 3.42Å; D430-S500 PolarHBondContact OD2-OG 3.31Å
431	A	95.9	Very high	94.6	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-64.7	-41.3	171.9	0	0	0	0	0	112.6	I427 V428 M433 Q434 P435 V492 M497	I427-A431 WeakPolarHBondContact O-CB 3.45Å; I427-A431 PolarHBondContact O-N 3.41Å; V428-A431 PolarHBondContact O-N 3.02Å; A431-M433 PolarHBondContact O-N 3.19Å; A431-Q434 WeakPolarHBondContact O-CB 3.49Å; A431-Q434 WeakPolarHBondContact O-CG 3.38Å; A431-Q434 PolarHBondContact O-N 3.22Å; A431-P435 WeakPolarHBondContact O-CD 3.47Å; A431-V492 HydrophobicContact CB-CG1 4.39Å; A431-M497 HydrophobicContact CB-CG 4.38Å; A431-M497 HydrophobicContact CB-SD 3.34Å; A431-M497 WeakPolarHBondContact CB-SD 3.4Å
432	L	95.6	Very high	94.7	Very high	50 Å²	50	46 Å²	46	26%	0.262	24%	0.241	S	C	.	.	H	α-helix	trans	-61.1	-26	174.6	-74	167.2	0	0	0	112.7	L397 T400 V428 R429 P435 V492	L397-L432 HydrophobicContact CD2-CD2 3.93Å; L397-L432 HydrophobicContact CD2-CG 4.26Å; T400-L432 HydrophobicContact CG2-CD2 3.64Å; V428-L432 HydrophobicContact CG1-CD1 3.88Å; V428-L432 HydrophobicContact CG1-CG 4.25Å; V428-L432 WeakPolarHBondContact O-CB 3.44Å; V428-L432 VanDerWaalsContact O-CG 3.23Å; V428-L432 WeakPolarHBondContact O-CG 3.33Å; V428-L432 PolarHBondContact O-N 3.12Å; R429-L432 PolarHBondContact O-N 3.45Å; L432-P435 WeakPolarHBondContact O-CD 3.49Å; L432-V492 HydrophobicContact CD2-CG2 4.12Å
433	M	94.9	Very high	94.7	Very high	83 Å²	83	47.2 Å²	47.2	41%	0.409	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-9.4	174.9	-68.5	-57.1	-60.1	0	0	113.8	R429 D430 A431 V436 R437	R429-M433 WeakPolarHBondContact O-CG 3.35Å; R429-M433 PolarHBondContact O-N 3.41Å; D430-M433 PolarHBondContact O-N 3.1Å; A431-M433 PolarHBondContact O-N 3.19Å; M433-V436 HydrophobicContact CE-CB 3.99Å; M433-V436 HydrophobicContact CE-CG1 3.99Å; M433-V436 HydrophobicContact CE-CG2 4.17Å; M433-V436 PolarHBondContact O-N 2.85Å; M433-V436 HydrophobicContact SD-CG2 4.4Å; M433-R437 WeakPolarHBondContact O-CG 3.49Å; M433-R437 PolarHBondContact O-N 3.04Å
434	Q	94.2	Very high	94.7	Very high	7 Å²	7	48.3 Å²	48.3	3%	0.033	25%	0.248	C	C	.	.	H	α-helix	trans	-64.4	-43.8	-179.3	-62.7	-67	-36.1	0	0	112.9	D430 A431 V436 R437 K438 D496 R499	D430-Q434 PolarHBondContact O-N 3.4Å; A431-Q434 WeakPolarHBondContact O-CB 3.49Å; A431-Q434 WeakPolarHBondContact O-CG 3.38Å; A431-Q434 PolarHBondContact O-N 3.22Å; Q434-V436 VanDerWaalsContact C-N 3.31Å; Q434-V436 PolarHBondContact O-N 2.82Å; Q434-R437 PolarHBondContact O-N 3.13Å; Q434-K438 VanDerWaalsContact O-CG 3.32Å; Q434-K438 WeakPolarHBondContact O-CG 3.49Å; Q434-K438 PolarHBondContact O-N 3.42Å; Q434-D496 HydrophobicContact CB-CB 3.82Å; Q434-D496 WeakPolarHBondContact CB-OD1 3.39Å; Q434-D496 HydrophobicContact CG-CB 3.8Å; Q434-R499 VanDerWaalsContact OE1-CD 3.31Å
435	P	94.1	Very high	94.7	Very high	9 Å²	9	48.3 Å²	48.3	6%	0.058	25%	0.248	C	C	.	.	H	α-helix	trans	-55.9	-43.3	172.1	-30.4	38.4	0	0	0	113.9	A431 L432 R437 K438 V439 P490 V492	A431-P435 WeakPolarHBondContact O-CD 3.47Å; L432-P435 WeakPolarHBondContact O-CD 3.49Å; P435-R437 PolarHBondContact O-N 3.32Å; P435-K438 WeakPolarHBondContact O-CB 3.36Å; P435-K438 PolarHBondContact O-N 3.13Å; P435-V439 WeakPolarHBondContact O-CG2 3.41Å; P435-V439 PolarHBondContact O-N 3.06Å; P435-P490 HydrophobicContact CB-CB 4.23Å; P435-P490 WeakPolarHBondContact CB-O 3.5Å; P435-P490 WeakPolarHBondContact CG-O 3.42Å; P435-V492 HydrophobicContact CG-CG2 3.82Å
436	V	93.9	Very high	94.7	Very high	62 Å²	62	49.9 Å²	49.9	38%	0.376	25%	0.251	S	S	.	.	H	α-helix	trans	-61.5	-47.1	178.3	-178.4	0	0	0	0	110.4	M433 Q434 K438 V439 Q440	M433-V436 HydrophobicContact CE-CB 3.99Å; M433-V436 HydrophobicContact CE-CG1 3.99Å; M433-V436 HydrophobicContact CE-CG2 4.17Å; M433-V436 PolarHBondContact O-N 2.85Å; M433-V436 HydrophobicContact SD-CG2 4.4Å; Q434-V436 VanDerWaalsContact C-N 3.31Å; Q434-V436 PolarHBondContact O-N 2.82Å; V436-K438 VanDerWaalsContact C-N 3.33Å; V436-K438 PolarHBondContact O-N 3.23Å; V436-V439 PolarHBondContact O-N 2.89Å; V436-Q440 WeakPolarHBondContact O-CG 3.44Å; V436-Q440 PolarHBondContact O-N 3.03Å
437	R	93.9	Very high	94.5	Very high	107 Å²	107	54.9 Å²	54.9	40%	0.404	26%	0.263	S	S	.	.	H	α-helix	trans	-61.5	-40.7	176.4	-68.8	170.6	-175.7	161.7	1.4	111.7	D430 M433 Q434 P435 V439 Q440 S441	D430-R437 IonicContact OD1-CZ 4Å; D430-R437 VanDerWaalsContact OD1-CZ 3.23Å; D430-R437 IonicContact OD1-NH1 3.6Å; D430-R437 PolarHBondContact OD1-NH1 3.36Å; D430-R437 IonicContact OD1-NH2 2.66Å; D430-R437 PolarHBondContact OD1-NH2 3.25Å; D430-R437 IonicContact OD2-NH1 3.78Å; M433-R437 WeakPolarHBondContact O-CG 3.49Å; M433-R437 PolarHBondContact O-N 3.04Å; Q434-R437 PolarHBondContact O-N 3.13Å; P435-R437 PolarHBondContact O-N 3.32Å; R437-V439 PolarHBondContact O-N 3.22Å; R437-Q440 PolarHBondContact O-N 3.36Å; R437-S441 WeakPolarHBondContact O-CB 3.31Å; R437-S441 PolarHBondContact O-N 2.95Å; R437-S441 PolarHBondContact O-OG 3.37Å
438	K	92.9	Very high	94.3	Very high	61 Å²	61	56.5 Å²	56.5	27%	0.265	27%	0.273	S	S	.	.	H	α-helix	trans	-59.9	-44.6	175.9	-74.2	170.5	-173.2	167.8	0	111.4	Q434 P435 V436 S441 A442 D496	Q434-K438 VanDerWaalsContact O-CG 3.32Å; Q434-K438 WeakPolarHBondContact O-CG 3.49Å; Q434-K438 PolarHBondContact O-N 3.42Å; P435-K438 WeakPolarHBondContact O-CB 3.36Å; P435-K438 PolarHBondContact O-N 3.13Å; V436-K438 VanDerWaalsContact C-N 3.33Å; V436-K438 PolarHBondContact O-N 3.23Å; K438-S441 PolarHBondContact O-OG 3Å; K438-A442 VanDerWaalsContact O-CB 3.31Å; K438-A442 WeakPolarHBondContact O-CB 3.49Å; K438-A442 PolarHBondContact O-N 3.16Å; K438-D496 VanDerWaalsContact CE-OD1 3.25Å; K438-D496 WeakPolarHBondContact CE-OD1 3.42Å; K438-D496 IonicContact NZ-OD1 3.97Å; K438-D496 PolarHBondContact NZ-OD1 3.4Å; K438-D496 IonicContact NZ-OD2 2.78Å; K438-D496 PolarHBondContact NZ-OD2 3.44Å
439	V	93.9	Very high	93.9	Very high	14 Å²	14	64.3 Å²	64.3	9%	0.085	30%	0.302	C	S	.	.	H	α-helix	trans	-63.5	-46.8	176.2	173.4	0	0	0	0	110.9	P435 V436 R437 S441 A442 F445 P466 W479 L487	P435-V439 WeakPolarHBondContact O-CG2 3.41Å; P435-V439 PolarHBondContact O-N 3.06Å; V436-V439 PolarHBondContact O-N 2.89Å; R437-V439 PolarHBondContact O-N 3.22Å; V439-S441 VanDerWaalsContact C-N 3.34Å; V439-S441 PolarHBondContact O-N 3.45Å; V439-A442 WeakPolarHBondContact O-CB 3.27Å; V439-A442 PolarHBondContact O-N 2.97Å; V439-F445 HydrophobicContact CG1-CE1 4.41Å; V439-F445 HydrophobicContact CG1-CZ 4.34Å; V439-P466 HydrophobicContact CB-CG 4.19Å; V439-P466 HydrophobicContact CG2-CG 3.58Å; V439-W479 HydrophobicContact CG1-CB 3.9Å; V439-L487 HydrophobicContact CG1-CD1 4.04Å; V439-L487 HydrophobicContact CG1-CD2 4.08Å; V439-L487 HydrophobicContact CG2-CD1 4.31Å
440	Q	93.8	Very high	93.3	Very high	119 Å²	119	56.8 Å²	56.8	56%	0.556	27%	0.274	S	S	*	.	H	α-helix	trans	-63.7	-38	-179	-74	178.3	-17.9	0	0	113.1	V436 R437	V436-Q440 WeakPolarHBondContact O-CG 3.44Å; V436-Q440 PolarHBondContact O-N 3.03Å; R437-Q440 PolarHBondContact O-N 3.36Å
441	S	94.1	Very high	92.6	Very high	94 Å²	94	58.8 Å²	58.8	66%	0.657	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	0.2	178.3	67.3	0	0	0	0	114	R437 K438 V439	R437-S441 WeakPolarHBondContact O-CB 3.31Å; R437-S441 PolarHBondContact O-N 2.95Å; R437-S441 PolarHBondContact O-OG 3.37Å; K438-S441 PolarHBondContact O-OG 3Å; V439-S441 VanDerWaalsContact C-N 3.34Å; V439-S441 PolarHBondContact O-N 3.45Å
442	A	93.9	Very high	91.8	Very high	14 Å²	14	61.8 Å²	61.8	12%	0.116	31%	0.305	C	S	.	.			trans	-71.7	134	-177.5	0	0	0	0	0	110.8	K438 V439 F445 P466	K438-A442 VanDerWaalsContact O-CB 3.31Å; K438-A442 WeakPolarHBondContact O-CB 3.49Å; K438-A442 PolarHBondContact O-N 3.16Å; V439-A442 WeakPolarHBondContact O-CB 3.27Å; V439-A442 PolarHBondContact O-N 2.97Å; A442-F445 HydrophobicContact CB-CD2 4.41Å; A442-F445 HydrophobicContact CB-CE1 4.42Å; A442-F445 HydrophobicContact CB-CE2 3.63Å; A442-F445 HydrophobicContact CB-CZ 3.63Å; A442-P466 HydrophobicContact CB-CB 3.82Å; A442-P466 HydrophobicContact CB-CG 4.12Å
443	T	93.9	Very high	90.9	Very high	73 Å²	73	65.5 Å²	65.5	45%	0.448	32%	0.315	S	S	.	.	S	Bend	trans	-103.1	-17	171.7	56.9	0	0	0	0	112.4	E476 M477	T443-E476 WeakPolarHBondContact O-CA 3.5Å; T443-M477 CarbonylContact C-O 3.59Å; T443-M477 VanDerWaalsContact C-O 3.26Å; T443-M477 PolarHBondContact O-N 3.33Å
444	H	95	Very high	90.1	Very high	30 Å²	30	68.7 Å²	68.7	14%	0.139	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	140.3	-177.5	-65.7	66.5	0	0	0	110.3	C467 V475	H444-C467 VanDerWaalsContact C-SG 3.59Å; H444-C467 PolarHBondContact O-N 3.07Å; H444-V475 CarbonylContact C-O 3.26Å; H444-V475 VanDerWaalsContact CA-O 3.31Å; H444-V475 WeakPolarHBondContact CA-O 3.47Å
445	F	95.3	Very high	89.3	Confident	0 Å²	0	71.5 Å²	71.5	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	146.6	176.4	-70.5	-104.2	0	0	0	110.2	V439 A442 L464 T465 P466 C467 V475 M477 W479 V482 L487	V439-F445 HydrophobicContact CG1-CE1 4.41Å; V439-F445 HydrophobicContact CG1-CZ 4.34Å; A442-F445 HydrophobicContact CB-CD2 4.41Å; A442-F445 HydrophobicContact CB-CE1 4.42Å; A442-F445 HydrophobicContact CB-CE2 3.63Å; A442-F445 HydrophobicContact CB-CZ 3.63Å; F445-L464 HydrophobicContact CB-CB 4.41Å; F445-L464 HydrophobicContact CB-CD2 4.3Å; F445-L464 HydrophobicContact CD1-CB 4.4Å; F445-T465 CarbonylContact C-O 3.57Å; F445-T465 WeakPolarHBondContact CA-O 3.35Å; F445-P466 HydrophobicContact CD1-CG 4.26Å; F445-P466 HydrophobicContact CE1-CG 3.75Å; F445-P466 HydrophobicContact CZ-CG 4.32Å; F445-C467 VanDerWaalsContact C-SG 3.51Å; F445-V475 PolarHBondContact N-O 3.18Å; F445-V475 PolarHBondContact O-N 3.13Å; F445-M477 HydrophobicContact CB-CG 3.84Å; F445-M477 HydrophobicContact CB-SD 3.91Å; F445-M477 HydrophobicContact CD2-CG 3.48Å; F445-M477 VanDerWaalsContact CD2-CG 3.48Å; F445-M477 VanDerWaalsContact CD2-O 3.26Å; F445-M477 WeakPolarHBondContact CD2-O 3.18Å; F445-M477 HydrophobicContact CD2-SD 4.37Å; F445-M477 HydrophobicContact CE2-CG 4.38Å; F445-M477 WeakPolarHBondContact CE2-O 3.27Å; F445-M477 HydrophobicContact CG-CG 3.97Å; F445-M477 HydrophobicContact CG-SD 4.31Å; F445-W479 HydrophobicContact CZ-CB 4.14Å; F445-V482 HydrophobicContact CD1-CG2 3.89Å; F445-V482 HydrophobicContact CD2-CG2 4.13Å; F445-V482 HydrophobicContact CE1-CG2 3.89Å; F445-V482 HydrophobicContact CE2-CG2 4.12Å; F445-V482 HydrophobicContact CG-CG2 4.01Å; F445-V482 HydrophobicContact CZ-CG2 4Å; F445-L487 HydrophobicContact CE1-CD1 4.03Å
446	K	93.6	Very high	88.5	Confident	62 Å²	62	75.7 Å²	75.7	27%	0.27	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	152.1	175.1	70.2	-179.8	172.4	-172.4	0	111.3	V448 L464 T465 C467 D471 N473	K446-V448 HydrophobicContact CD-CG1 4.45Å; K446-V448 HydrophobicContact CG-CG1 4.02Å; K446-L464 WeakPolarHBondContact O-CA 3.41Å; K446-T465 HydrophobicContact CG-CG2 3.93Å; K446-T465 PolarHBondContact N-O 3.43Å; K446-T465 PolarHBondContact O-N 3.33Å; K446-C467 HydrophobicContact CB-CB 4.1Å; K446-C467 HydrophobicContact CD-CB 3.8Å; K446-C467 HydrophobicContact CG-CB 3.85Å; K446-D471 VanDerWaalsContact CD-OD2 3.3Å; K446-D471 WeakPolarHBondContact CD-OD2 3.48Å; K446-D471 IonicContact NZ-OD2 3.45Å; K446-D471 PolarHBondContact NZ-OD2 3.13Å; K446-N473 HydrophobicContact CB-CB 4.49Å; K446-N473 WeakPolarHBondContact CB-O 3.26Å
447	R	92.8	Very high	87.9	Confident	173 Å²	173	81.8 Å²	81.8	65%	0.653	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.3	131.8	174.5	-65.4	-174.9	-173.4	-179.2	1.3	110.5	D462 F463 L464	R447-D462 IonicContact NE-OD1 3.43Å; R447-F463 CarbonylContact C-O 3.59Å; R447-F463 WeakPolarHBondContact CA-O 3.28Å; R447-L464 HydrophobicContact CG-CD2 3.73Å
448	V	90.8	Very high	87.4	Confident	35 Å²	35	80.8 Å²	80.8	21%	0.212	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	152.4	-179.5	-65.5	0	0	0	0	110.7	K446 D461 F463 T465 C488	K446-V448 HydrophobicContact CD-CG1 4.45Å; K446-V448 HydrophobicContact CG-CG1 4.02Å; V448-D461 CarbonylContact O-C 3.57Å; V448-F463 HydrophobicContact CG2-CB 4Å; V448-F463 PolarHBondContact N-O 3.24Å; V448-F463 WeakPolarHBondContact O-CB 2.97Å; V448-F463 PolarHBondContact O-N 3.45Å; V448-T465 HydrophobicContact CB-CG2 4.42Å; V448-T465 HydrophobicContact CG1-CG2 3.59Å; V448-T465 HydrophobicContact CG2-CG2 3.92Å; V448-C488 HydrophobicContact CG2-CB 4.17Å
449	R	88.1	Confident	86.8	Confident	165 Å²	165	82 Å²	82	62%	0.623	41%	0.408	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.6	124.9	169.3	-175.9	172.5	-161.7	-168.7	-2.5	109.9	L459 V460 D461	R449-L459 HydrophobicContact CG-CB 4.16Å; R449-V460 WeakPolarHBondContact CA-O 3.39Å; R449-D461 VanDerWaalsContact CB-OD1 3.29Å; R449-D461 WeakPolarHBondContact CB-OD1 3.36Å; R449-D461 WeakPolarHBondContact CD-OD1 3.47Å; R449-D461 WeakPolarHBondContact CG-OD1 3.39Å; R449-D461 IonicContact NE-OD1 3.59Å; R449-D461 PolarHBondContact NE-OD1 3.39Å
450	G	82.9	Confident	86.3	Confident	3 Å²	3	83.8 Å²	83.8	3%	0.031	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	159.8	-178.9	0	0	0	0	0	112.7	L459 V460 F463	G450-L459 WeakPolarHBondContact O-CA 2.99Å; G450-V460 PolarHBondContact N-O 3.46Å; G450-V460 PolarHBondContact O-N 3.5Å; G450-F463 VanDerWaalsContact O-CE2 3.32Å; G450-F463 WeakPolarHBondContact O-CE2 3.34Å
451	P	81.4	Confident	85.9	Confident	74 Å²	74	83.1 Å²	83.1	48%	0.481	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	143.3	171.5	29	-32.3	0	0	0	111.2	P456 L459	P451-P456 HydrophobicContact CB-CB 4.38Å; P451-L459 HydrophobicContact CB-CD2 4.38Å
452	L	79.7	Confident	85.6	Confident	62 Å²	62	81.2 Å²	81.2	33%	0.325	40%	0.402	S	S	.	.			trans	-67.4	139.4	172.4	-163.1	75.4	0	0	0	110.6	D454 N455 I458 V460 F463	L452-D454 VanDerWaalsContact C-N 3.3Å; L452-D454 HydrophobicContact CD2-CB 4.46Å; L452-D454 PolarHBondContact O-N 3.16Å; L452-N455 CarbonylContact O-C 3.53Å; L452-N455 PolarHBondContact O-N 2.71Å; L452-I458 HydrophobicContact CB-CB 4.48Å; L452-I458 PolarHBondContact N-O 3.19Å; L452-V460 HydrophobicContact CD1-CG2 4.04Å; L452-F463 HydrophobicContact CD1-CZ 4.32Å
453	R	76.6	Confident	85.4	Confident	128 Å²	128	81.1 Å²	81.1	48%	0.483	40%	0.399	S	S	.	.	S	Bend	trans	-57.2	-41.8	-179.8	-68.8	-177.5	171.9	175.9	-0.9	112.8	G484 L487 E489	R453-G484 PolarHBondContact NH1-O 2.9Å; R453-L487 PolarHBondContact NH2-O 2.97Å; R453-L487 VanDerWaalsContact NH2-O 3.1Å; R453-E489 IonicContact NH2-OE2 3.67Å; R453-E489 PolarHBondContact NH2-OE2 3.36Å
454	D	76.9	Confident	85.3	Confident	150 Å²	150	78.4 Å²	78.4	80%	0.802	38%	0.382	S	S	*	.	S	Bend	trans	-78.4	-25.5	-178.9	-63.7	-28	0	0	0	113.5	L452	L452-D454 VanDerWaalsContact C-N 3.3Å; L452-D454 HydrophobicContact CD2-CB 4.46Å; L452-D454 PolarHBondContact O-N 3.16Å
455	N	78.5	Confident	85.2	Confident	67 Å²	67	77.9 Å²	77.9	36%	0.358	38%	0.381	S	S	.	.			trans	-148.8	96	-178.4	-164.2	-8.3	0	0	0	111.4	L452 K457 I458	L452-N455 CarbonylContact O-C 3.53Å; L452-N455 PolarHBondContact O-N 2.71Å; N455-K457 PolarHBondContact O-N 3.46Å; N455-I458 HydrophobicContact CB-CD1 4.24Å; N455-I458 HydrophobicContact CB-CG1 4.41Å; N455-I458 PolarHBondContact O-N 3.03Å
456	P	77.5	Confident	85.1	Confident	96 Å²	96	79 Å²	79	62%	0.623	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-13.3	-175.1	-25.6	33.8	0	0	0	115.4	P451	P451-P456 HydrophobicContact CB-CB 4.38Å
457	K	81.1	Confident	85.1	Confident	191 Å²	191	77.1 Å²	77.1	83%	0.83	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-17.9	177.7	-63.8	-178.1	-179.2	177.7	0	113.2	N455	N455-K457 PolarHBondContact O-N 3.46Å
458	I	81.8	Confident	85.1	Confident	86 Å²	86	72.9 Å²	72.9	44%	0.441	38%	0.379	S	S	.	.	S	Bend	trans	-97.1	119.2	179.5	-58.4	177.8	0	0	0	107.9	L452 N455 V460	L452-I458 HydrophobicContact CB-CB 4.48Å; L452-I458 PolarHBondContact N-O 3.19Å; N455-I458 HydrophobicContact CB-CD1 4.24Å; N455-I458 HydrophobicContact CB-CG1 4.41Å; N455-I458 PolarHBondContact O-N 3.03Å; I458-V460 HydrophobicContact CG2-CG2 4.49Å
459	L	82.3	Confident	85.1	Confident	85 Å²	85	75.4 Å²	75.4	45%	0.445	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	131.5	176.4	-65.7	172.1	0	0	0	109.9	R449 G450 P451	R449-L459 HydrophobicContact CG-CB 4.16Å; G450-L459 WeakPolarHBondContact O-CA 2.99Å; P451-L459 HydrophobicContact CB-CD2 4.38Å
460	V	82.9	Confident	85.1	Confident	52 Å²	52	71.1 Å²	71.1	32%	0.315	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	137.1	176.4	-173.1	0	0	0	0	108.8	R449 G450 L452 I458 D462 F463	R449-V460 WeakPolarHBondContact CA-O 3.39Å; G450-V460 PolarHBondContact N-O 3.46Å; G450-V460 PolarHBondContact O-N 3.5Å; L452-V460 HydrophobicContact CD1-CG2 4.04Å; I458-V460 HydrophobicContact CG2-CG2 4.49Å; V460-D462 HydrophobicContact CG1-CB 4.25Å; V460-F463 HydrophobicContact CB-CD2 4.2Å; V460-F463 HydrophobicContact CB-CE2 3.74Å; V460-F463 HydrophobicContact CG2-CE2 4.34Å; V460-F463 WeakPolarHBondContact O-CD2 3.14Å
461	D	84.4	Confident	85.5	Confident	106 Å²	106	72.7 Å²	72.7	57%	0.567	41%	0.411	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.2	6.6	-174.7	-63	-37.4	0	0	0	113.9	V448 R449	V448-D461 CarbonylContact O-C 3.57Å; R449-D461 VanDerWaalsContact CB-OD1 3.29Å; R449-D461 WeakPolarHBondContact CB-OD1 3.36Å; R449-D461 WeakPolarHBondContact CD-OD1 3.47Å; R449-D461 WeakPolarHBondContact CG-OD1 3.39Å; R449-D461 IonicContact NE-OD1 3.59Å; R449-D461 PolarHBondContact NE-OD1 3.39Å
462	D	87.3	Confident	86	Confident	54 Å²	54	75.1 Å²	75.1	29%	0.289	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	18.9	-169.8	-163.9	39.7	0	0	0	113.7	R447 V460 K486	R447-D462 IonicContact NE-OD1 3.43Å; V460-D462 HydrophobicContact CG1-CB 4.25Å; D462-K486 VanDerWaalsContact OD2-CE 3.28Å; D462-K486 WeakPolarHBondContact OD2-CE 3.3Å; D462-K486 IonicContact OD2-NZ 3.39Å; D462-K486 PolarHBondContact OD2-NZ 3.27Å
463	F	90.8	Very high	86.5	Confident	12 Å²	12	77.9 Å²	77.9	5%	0.053	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	148.3	173.5	-73.8	-75.7	0	0	0	111.1	R447 V448 G450 L452 V460 E485 K486 C488	R447-F463 CarbonylContact C-O 3.59Å; R447-F463 WeakPolarHBondContact CA-O 3.28Å; V448-F463 HydrophobicContact CG2-CB 4Å; V448-F463 PolarHBondContact N-O 3.24Å; V448-F463 WeakPolarHBondContact O-CB 2.97Å; V448-F463 PolarHBondContact O-N 3.45Å; G450-F463 VanDerWaalsContact O-CE2 3.32Å; G450-F463 WeakPolarHBondContact O-CE2 3.34Å; L452-F463 HydrophobicContact CD1-CZ 4.32Å; V460-F463 HydrophobicContact CB-CD2 4.2Å; V460-F463 HydrophobicContact CB-CE2 3.74Å; V460-F463 HydrophobicContact CG2-CE2 4.34Å; V460-F463 WeakPolarHBondContact O-CD2 3.14Å; F463-E485 WeakPolarHBondContact CE1-O 3.45Å; F463-K486 CarbonylContact C-O 3.58Å; F463-K486 VanDerWaalsContact CA-O 3.29Å; F463-K486 WeakPolarHBondContact CA-O 3.29Å; F463-K486 WeakPolarHBondContact CD1-O 3.29Å; F463-C488 HydrophobicContact CB-CB 3.75Å; F463-C488 HydrophobicContact CD1-CB 4.29Å; F463-C488 HydrophobicContact CG-CB 4.21Å
464	L	91.6	Very high	87.1	Confident	15 Å²	15	73 Å²	73	8%	0.079	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	129	177.7	-71.1	166.9	0	0	0	109.6	F445 K446 R447 M477 V482 K486 C488	F445-L464 HydrophobicContact CB-CB 4.41Å; F445-L464 HydrophobicContact CB-CD2 4.3Å; F445-L464 HydrophobicContact CD1-CB 4.4Å; K446-L464 WeakPolarHBondContact O-CA 3.41Å; R447-L464 HydrophobicContact CG-CD2 3.73Å; L464-M477 HydrophobicContact CD1-SD 3.98Å; L464-M477 HydrophobicContact CD2-SD 4.48Å; L464-V482 HydrophobicContact CB-CG1 4.03Å; L464-V482 HydrophobicContact CD1-CG1 4.01Å; L464-V482 HydrophobicContact CD1-CG2 4.35Å; L464-K486 PolarHBondContact N-O 3.33Å; L464-C488 PolarHBondContact O-N 2.62Å
465	T	93	Very high	87.9	Confident	19 Å²	19	69.2 Å²	69.2	12%	0.117	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	146.6	175.4	-159.9	0	0	0	0	110.6	F445 K446 V448 C467 C488	F445-T465 CarbonylContact C-O 3.57Å; F445-T465 WeakPolarHBondContact CA-O 3.35Å; K446-T465 HydrophobicContact CG-CG2 3.93Å; K446-T465 PolarHBondContact N-O 3.43Å; K446-T465 PolarHBondContact O-N 3.33Å; V448-T465 HydrophobicContact CB-CG2 4.42Å; V448-T465 HydrophobicContact CG1-CG2 3.59Å; V448-T465 HydrophobicContact CG2-CG2 3.92Å; T465-C467 PolarHBondContact O-N 3.44Å; T465-C488 WeakPolarHBondContact CB-O 3.41Å; T465-C488 PolarHBondContact OG1-O 3.09Å
466	P	94.3	Very high	88.7	Confident	25 Å²	25	73.4 Å²	73.4	16%	0.162	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.3	137.9	174.9	-29.1	36.7	0	0	0	112.8	V439 A442 F445 P490	V439-P466 HydrophobicContact CB-CG 4.19Å; V439-P466 HydrophobicContact CG2-CG 3.58Å; A442-P466 HydrophobicContact CB-CB 3.82Å; A442-P466 HydrophobicContact CB-CG 4.12Å; F445-P466 HydrophobicContact CD1-CG 4.26Å; F445-P466 HydrophobicContact CE1-CG 3.75Å; F445-P466 HydrophobicContact CZ-CG 4.32Å; P466-P490 HydrophobicContact CG-CG 4.14Å
467	C	92.6	Very high	89.4	Confident	21 Å²	21	70.6 Å²	70.6	14%	0.142	41%	0.41	C	S	.	.			trans	-138.5	168.6	176.5	67.9	0	0	0	0	111.8	H444 F445 K446 T465 D471 G474	H444-C467 VanDerWaalsContact C-SG 3.59Å; H444-C467 PolarHBondContact O-N 3.07Å; F445-C467 VanDerWaalsContact C-SG 3.51Å; K446-C467 HydrophobicContact CB-CB 4.1Å; K446-C467 HydrophobicContact CD-CB 3.8Å; K446-C467 HydrophobicContact CG-CB 3.85Å; T465-C467 PolarHBondContact O-N 3.44Å; C467-D471 HydrophobicContact CB-CB 4.11Å; C467-G474 VanDerWaalsContact SG-CA 3.56Å
468	S	92.4	Very high	89.9	Confident	84 Å²	84	64.4 Å²	64.4	59%	0.587	39%	0.388	S	S	*	.			trans	-73.1	148	176	-59.3	0	0	0	0	110.7	G470 D471	S468-G470 PolarHBondContact O-N 3.07Å; S468-D471 VanDerWaalsContact O-CB 3.3Å; S468-D471 WeakPolarHBondContact O-CB 3.36Å; S468-D471 PolarHBondContact O-N 3.24Å
469	P	90.8	Very high	90.5	Very high	89 Å²	89	66.2 Å²	66.2	58%	0.578	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-22.8	177.4	-27	35.1	0	0	0	115.1
470	G	89.4	Confident	91	Very high	74 Å²	74	69 Å²	69	76%	0.763	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.2	5.2	175.9	0	0	0	0	0	115	S468	S468-G470 PolarHBondContact O-N 3.07Å
471	D	91.1	Very high	91.4	Very high	36 Å²	36	72.5 Å²	72.5	19%	0.193	42%	0.415	C	S	.	.			trans	-70.6	125.1	177.4	-165.2	-44.3	0	0	0	109.2	K446 C467 S468 N473 G474	K446-D471 VanDerWaalsContact CD-OD2 3.3Å; K446-D471 WeakPolarHBondContact CD-OD2 3.48Å; K446-D471 IonicContact NZ-OD2 3.45Å; K446-D471 PolarHBondContact NZ-OD2 3.13Å; C467-D471 HydrophobicContact CB-CB 4.11Å; S468-D471 VanDerWaalsContact O-CB 3.3Å; S468-D471 WeakPolarHBondContact O-CB 3.36Å; S468-D471 PolarHBondContact O-N 3.24Å; D471-N473 PolarHBondContact O-N 2.92Å; D471-N473 VanDerWaalsContact O-N 3.08Å; D471-N473 PolarHBondContact OD1-N 3.38Å; D471-N473 VanDerWaalsContact OD1-N 3.15Å; D471-G474 PolarHBondContact O-N 3.35Å
472	P	90.1	Very high	91.7	Very high	126 Å²	126	68.2 Å²	68.2	82%	0.818	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-25.2	-178.3	-25.8	34.1	0	0	0	114.4
473	N	90.1	Very high	91.9	Very high	120 Å²	120	68.8 Å²	68.8	64%	0.642	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.2	10.1	178.3	-59.5	-55.7	0	0	0	112.6	K446 D471	K446-N473 HydrophobicContact CB-CB 4.49Å; K446-N473 WeakPolarHBondContact CB-O 3.26Å; D471-N473 PolarHBondContact O-N 2.92Å; D471-N473 VanDerWaalsContact O-N 3.08Å; D471-N473 PolarHBondContact OD1-N 3.38Å; D471-N473 VanDerWaalsContact OD1-N 3.15Å
474	G	91.2	Very high	91.7	Very high	24 Å²	24	70.7 Å²	70.7	25%	0.247	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	129.1	178.3	0	0	0	0	0	111.3	C467 D471	C467-G474 VanDerWaalsContact SG-CA 3.56Å; D471-G474 PolarHBondContact O-N 3.35Å
475	V	92.8	Very high	91.5	Very high	71 Å²	71	77 Å²	77	43%	0.43	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	126.9	172.3	-178.3	0	0	0	0	107.5	H444 F445 M477	H444-V475 CarbonylContact C-O 3.26Å; H444-V475 VanDerWaalsContact CA-O 3.31Å; H444-V475 WeakPolarHBondContact CA-O 3.47Å; F445-V475 PolarHBondContact N-O 3.18Å; F445-V475 PolarHBondContact O-N 3.13Å; V475-M477 HydrophobicContact CB-CE 3.81Å; V475-M477 HydrophobicContact CG1-CE 3.47Å; V475-M477 VanDerWaalsContact CG1-CE 3.47Å; V475-M477 PolarHBondContact O-N 3.07Å
476	E	94.5	Very high	91.3	Very high	156 Å²	156	80 Å²	80	73%	0.729	46%	0.463	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.3	114.3	175	-170.5	175.3	-168.4	0	0	109.1	T443	T443-E476 WeakPolarHBondContact O-CA 3.5Å
477	M	91.9	Very high	91.1	Very high	36 Å²	36	80.6 Å²	80.6	18%	0.177	47%	0.465	C	S	.	.			trans	-163.7	154.3	176	64.6	179.7	64.6	0	0	109.4	T443 F445 L464 V475 E481 V482	T443-M477 CarbonylContact C-O 3.59Å; T443-M477 VanDerWaalsContact C-O 3.26Å; T443-M477 PolarHBondContact O-N 3.33Å; F445-M477 HydrophobicContact CB-CG 3.84Å; F445-M477 HydrophobicContact CB-SD 3.91Å; F445-M477 HydrophobicContact CD2-CG 3.48Å; F445-M477 VanDerWaalsContact CD2-CG 3.48Å; F445-M477 VanDerWaalsContact CD2-O 3.26Å; F445-M477 WeakPolarHBondContact CD2-O 3.18Å; F445-M477 HydrophobicContact CD2-SD 4.37Å; F445-M477 HydrophobicContact CE2-CG 4.38Å; F445-M477 WeakPolarHBondContact CE2-O 3.27Å; F445-M477 HydrophobicContact CG-CG 3.97Å; F445-M477 HydrophobicContact CG-SD 4.31Å; L464-M477 HydrophobicContact CD1-SD 3.98Å; L464-M477 HydrophobicContact CD2-SD 4.48Å; V475-M477 HydrophobicContact CB-CE 3.81Å; V475-M477 HydrophobicContact CG1-CE 3.47Å; V475-M477 VanDerWaalsContact CG1-CE 3.47Å; V475-M477 PolarHBondContact O-N 3.07Å; M477-E481 WeakPolarHBondContact CA-OE2 3.29Å; M477-E481 HydrophobicContact CB-CB 4.42Å; M477-E481 VanDerWaalsContact CB-OE2 3.27Å; M477-E481 WeakPolarHBondContact CB-OE2 3.38Å; M477-V482 HydrophobicContact CG-CG2 4.4Å; M477-V482 HydrophobicContact SD-CG2 3.89Å
478	T	93.4	Very high	90.9	Very high	62 Å²	62	81.4 Å²	81.4	38%	0.38	47%	0.47	S	S	.	.			trans	-95.9	162.1	175.9	67.6	0	0	0	0	111.1	M480 E481	T478-M480 PolarHBondContact O-N 3.39Å; T478-M480 VanDerWaalsContact O-N 3.08Å; T478-E481 PolarHBondContact N-OE2 3.32Å; T478-E481 PolarHBondContact O-N 2.98Å
479	W	92.6	Very high	90.7	Very high	124 Å²	124	82.3 Å²	82.3	47%	0.47	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-23.4	177.3	70.4	-92.5	0	0	0	113.5	V439 F445 E481 V482	V439-W479 HydrophobicContact CG1-CB 3.9Å; F445-W479 HydrophobicContact CZ-CB 4.14Å; W479-E481 PolarHBondContact O-N 3.07Å; W479-V482 PolarHBondContact O-N 3.35Å
480	M	93.1	Very high	90.7	Very high	143 Å²	143	79.4 Å²	79.4	70%	0.704	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-24.2	176.4	-65.5	-175.4	177.8	0	0	112.7	T478	T478-M480 PolarHBondContact O-N 3.39Å; T478-M480 VanDerWaalsContact O-N 3.08Å
481	E	92.3	Very high	90.8	Very high	126 Å²	126	79.4 Å²	79.4	59%	0.589	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	-13.1	-178.5	-63.4	165	158.5	0	0	112	M477 T478 W479 P483	M477-E481 WeakPolarHBondContact CA-OE2 3.29Å; M477-E481 HydrophobicContact CB-CB 4.42Å; M477-E481 VanDerWaalsContact CB-OE2 3.27Å; M477-E481 WeakPolarHBondContact CB-OE2 3.38Å; T478-E481 PolarHBondContact N-OE2 3.32Å; T478-E481 PolarHBondContact O-N 2.98Å; W479-E481 PolarHBondContact O-N 3.07Å; E481-P483 WeakPolarHBondContact O-CD 3.31Å
482	V	90.9	Very high	91	Very high	15 Å²	15	77.8 Å²	77.8	9%	0.091	42%	0.422	C	S	.	.	S	Bend	trans	-79.9	122.2	178.6	179.8	0	0	0	0	109.8	F445 L464 M477 W479 G484 L487	F445-V482 HydrophobicContact CD1-CG2 3.89Å; F445-V482 HydrophobicContact CD2-CG2 4.13Å; F445-V482 HydrophobicContact CE1-CG2 3.89Å; F445-V482 HydrophobicContact CE2-CG2 4.12Å; F445-V482 HydrophobicContact CG-CG2 4.01Å; F445-V482 HydrophobicContact CZ-CG2 4Å; L464-V482 HydrophobicContact CB-CG1 4.03Å; L464-V482 HydrophobicContact CD1-CG1 4.01Å; L464-V482 HydrophobicContact CD1-CG2 4.35Å; M477-V482 HydrophobicContact CG-CG2 4.4Å; M477-V482 HydrophobicContact SD-CG2 3.89Å; W479-V482 PolarHBondContact O-N 3.35Å; V482-G484 PolarHBondContact O-N 3Å; V482-L487 HydrophobicContact CG1-CB 4.05Å; V482-L487 HydrophobicContact CG1-CD1 4.08Å
483	P	90.3	Very high	91.2	Very high	67 Å²	67	73.2 Å²	73.2	44%	0.435	39%	0.393	S	S	.	.			trans	-60.6	132.7	173.7	-23.3	34.6	0	0	0	111.3	E481 E485 K486 L487	E481-P483 WeakPolarHBondContact O-CD 3.31Å; P483-E485 VanDerWaalsContact C-N 3.25Å; P483-E485 PolarHBondContact O-N 3.29Å; P483-E485 VanDerWaalsContact O-N 3.15Å; P483-K486 HydrophobicContact CB-CB 4.29Å; P483-K486 HydrophobicContact CB-CD 4.33Å; P483-K486 HydrophobicContact CB-CG 4.19Å; P483-K486 HydrophobicContact CG-CD 4.23Å; P483-K486 PolarHBondContact O-N 2.94Å; P483-L487 PolarHBondContact O-N 3.02Å
484	G	87.1	Confident	91.5	Very high	52 Å²	52	69.4 Å²	69.4	54%	0.536	37%	0.372	S	S	.	.	G	3₁₀ helix	trans	-56.4	-34.9	-173.9	0	0	0	0	0	114.8	R453 V482 K486	R453-G484 PolarHBondContact NH1-O 2.9Å; V482-G484 PolarHBondContact O-N 3Å; G484-K486 VanDerWaalsContact C-N 3.29Å; G484-K486 PolarHBondContact O-N 3.09Å
485	E	86.8	Confident	91.6	Very high	146 Å²	146	71.8 Å²	71.8	68%	0.682	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-74.2	-18.4	177.5	-58.9	-51.9	145.6	0	0	113.8	F463 P483	F463-E485 WeakPolarHBondContact CE1-O 3.45Å; P483-E485 VanDerWaalsContact C-N 3.25Å; P483-E485 PolarHBondContact O-N 3.29Å; P483-E485 VanDerWaalsContact O-N 3.15Å
486	K	88.8	Confident	91.8	Very high	82 Å²	82	68.4 Å²	68.4	36%	0.357	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-101.2	-3.8	-178.5	-61	-170	-177.3	-171.9	0	112.6	D462 F463 L464 P483 G484 C488	D462-K486 VanDerWaalsContact OD2-CE 3.28Å; D462-K486 WeakPolarHBondContact OD2-CE 3.3Å; D462-K486 IonicContact OD2-NZ 3.39Å; D462-K486 PolarHBondContact OD2-NZ 3.27Å; F463-K486 CarbonylContact C-O 3.58Å; F463-K486 VanDerWaalsContact CA-O 3.29Å; F463-K486 WeakPolarHBondContact CA-O 3.29Å; F463-K486 WeakPolarHBondContact CD1-O 3.29Å; L464-K486 PolarHBondContact N-O 3.33Å; P483-K486 HydrophobicContact CB-CB 4.29Å; P483-K486 HydrophobicContact CB-CD 4.33Å; P483-K486 HydrophobicContact CB-CG 4.19Å; P483-K486 HydrophobicContact CG-CD 4.23Å; P483-K486 PolarHBondContact O-N 2.94Å; G484-K486 VanDerWaalsContact C-N 3.29Å; G484-K486 PolarHBondContact O-N 3.09Å; K486-C488 PolarHBondContact O-N 3.4Å
487	L	90.8	Very high	91.8	Very high	39 Å²	39	61 Å²	61	20%	0.204	33%	0.329	C	S	.	.	B	Isolated β-bridge	trans	-73.2	119.4	176.7	-178.5	67	0	0	0	109.9	V439 F445 R453 V482 P483	V439-L487 HydrophobicContact CG1-CD1 4.04Å; V439-L487 HydrophobicContact CG1-CD2 4.08Å; V439-L487 HydrophobicContact CG2-CD1 4.31Å; F445-L487 HydrophobicContact CE1-CD1 4.03Å; R453-L487 PolarHBondContact NH2-O 2.97Å; R453-L487 VanDerWaalsContact NH2-O 3.1Å; V482-L487 HydrophobicContact CG1-CB 4.05Å; V482-L487 HydrophobicContact CG1-CD1 4.08Å; P483-L487 PolarHBondContact O-N 3.02Å
488	C	89.3	Confident	92	Very high	37 Å²	37	62.6 Å²	62.6	25%	0.25	34%	0.338	C	S	.	.			trans	-101	104.4	166.2	179.1	0	0	0	0	108.8	V448 F463 L464 T465 K486	V448-C488 HydrophobicContact CG2-CB 4.17Å; F463-C488 HydrophobicContact CB-CB 3.75Å; F463-C488 HydrophobicContact CD1-CB 4.29Å; F463-C488 HydrophobicContact CG-CB 4.21Å; L464-C488 PolarHBondContact O-N 2.62Å; T465-C488 WeakPolarHBondContact CB-O 3.41Å; T465-C488 PolarHBondContact OG1-O 3.09Å; K486-C488 PolarHBondContact O-N 3.4Å
489	E	88.4	Confident	92.1	Very high	104 Å²	104	66.3 Å²	66.3	49%	0.486	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-61.5	140.2	176.7	58.7	-86.6	-162.5	0	0	111.9	R453	R453-E489 IonicContact NH2-OE2 3.67Å; R453-E489 PolarHBondContact NH2-OE2 3.36Å
490	P	90.8	Very high	92.2	Very high	27 Å²	27	60.4 Å²	60.4	18%	0.175	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-59.8	141.4	169.4	-22.5	32.9	0	0	0	111.1	P435 P466	P435-P490 HydrophobicContact CB-CB 4.23Å; P435-P490 WeakPolarHBondContact CB-O 3.5Å; P435-P490 WeakPolarHBondContact CG-O 3.42Å; P466-P490 HydrophobicContact CG-CG 4.14Å
491	V	91.8	Very high	92.2	Very high	74 Å²	74	54.6 Å²	54.6	45%	0.448	30%	0.295	S	S	.	.	P	Polyproline II helix	trans	-75	150	171.9	-62.1	0	0	0	0	110.9	P401 C493	P401-V491 HydrophobicContact CB-CG1 4.17Å; V491-C493 PolarHBondContact O-N 3.1Å
492	V	94.3	Very high	92.3	Very high	3 Å²	3	53.3 Å²	53.3	2%	0.018	30%	0.3	C	S	.	.	B	Isolated β-bridge	trans	-66.5	134.8	172.8	-179.6	0	0	0	0	109.4	T402 S403 A431 L432 P435 D496 M497	T402-V492 WeakPolarHBondContact CA-O 3.25Å; T402-V492 HydrophobicContact CG2-CB 4.04Å; S403-V492 PolarHBondContact N-O 3.44Å; S403-V492 PolarHBondContact OG-O 3.47Å; S403-V492 VanDerWaalsContact OG-O 3.08Å; A431-V492 HydrophobicContact CB-CG1 4.39Å; L432-V492 HydrophobicContact CD2-CG2 4.12Å; P435-V492 HydrophobicContact CG-CG2 3.82Å; V492-D496 HydrophobicContact CG1-CB 4.23Å; V492-M497 HydrophobicContact CG1-CG 4.49Å; V492-M497 HydrophobicContact CG1-SD 4.29Å
493	C	94.4	Very high	92.3	Very high	29 Å²	29	56.4 Å²	56.4	20%	0.196	32%	0.322	C	S	.	.			trans	-129.4	173.3	179.6	67.3	0	0	0	0	112.8	S403 V491 S495 D496 M497	S403-C493 VanDerWaalsContact OG-CA 3.24Å; S403-C493 WeakPolarHBondContact OG-CA 3.42Å; S403-C493 WeakPolarHBondContact OG-CB 3.43Å; V491-C493 PolarHBondContact O-N 3.1Å; C493-S495 PolarHBondContact O-N 3.42Å; C493-S495 PolarHBondContact SG-OG 2.96Å; C493-D496 PolarHBondContact N-OD2 3.14Å; C493-D496 WeakPolarHBondContact O-CB 3.09Å; C493-D496 PolarHBondContact O-N 3.34Å; C493-D496 PolarHBondContact SG-OD2 3.25Å; C493-M497 PolarHBondContact O-N 3.11Å
494	M	95.7	Very high	92.3	Very high	41 Å²	41	54.2 Å²	54.2	20%	0.202	31%	0.308	C	S	.	.	H	α-helix	trans	-60.1	-32.7	-176.3	-172.7	57.9	171	0	0	112.7	L404 D408 T411 L412 D496 M497 L498	L404-M494 HydrophobicContact CD2-CB 3.78Å; L404-M494 HydrophobicContact CD2-SD 4.15Å; D408-M494 HydrophobicContact CB-SD 4.29Å; T411-M494 HydrophobicContact CG2-CE 4.01Å; L412-M494 HydrophobicContact CD1-SD 4.34Å; L412-M494 HydrophobicContact CD2-CE 3.8Å; L412-M494 HydrophobicContact CD2-SD 3.89Å; L412-M494 HydrophobicContact CG-CE 4.01Å; L412-M494 HydrophobicContact CG-SD 4.07Å; M494-D496 VanDerWaalsContact C-N 3.31Å; M494-D496 PolarHBondContact O-N 2.95Å; M494-M497 PolarHBondContact O-N 2.88Å; M494-M497 HydrophobicContact SD-CB 4.43Å; M494-L498 HydrophobicContact CE-CD1 4.4Å; M494-L498 HydrophobicContact CE-CD2 4.04Å; M494-L498 HydrophobicContact CE-CG 4.15Å; M494-L498 HydrophobicContact CG-CD1 4.09Å; M494-L498 HydrophobicContact CG-CG 4.27Å; M494-L498 WeakPolarHBondContact O-CB 3.25Å; M494-L498 VanDerWaalsContact O-CG 3.27Å; M494-L498 WeakPolarHBondContact O-CG 3.36Å; M494-L498 PolarHBondContact O-N 3.3Å; M494-L498 HydrophobicContact SD-CG 4.4Å
495	S	95	Very high	92.5	Very high	73 Å²	73	60 Å²	60	51%	0.51	32%	0.318	S	S	.	.	H	α-helix	trans	-67.7	-31.6	177.1	62.1	0	0	0	0	112.7	C493 R499	C493-S495 PolarHBondContact O-N 3.42Å; C493-S495 PolarHBondContact SG-OG 2.96Å; S495-R499 VanDerWaalsContact O-CB 3.29Å; S495-R499 WeakPolarHBondContact O-CB 3.14Å; S495-R499 PolarHBondContact O-N 3.35Å
496	D	95.2	Very high	92.8	Very high	1 Å²	1	55.7 Å²	55.7	1%	0.005	30%	0.302	C	S	.	.	H	α-helix	trans	-68.4	-42.4	174.4	-65.1	-33	0	0	0	110.7	Q434 K438 V492 C493 M494 R499 S500	Q434-D496 HydrophobicContact CB-CB 3.82Å; Q434-D496 WeakPolarHBondContact CB-OD1 3.39Å; Q434-D496 HydrophobicContact CG-CB 3.8Å; K438-D496 VanDerWaalsContact CE-OD1 3.25Å; K438-D496 WeakPolarHBondContact CE-OD1 3.42Å; K438-D496 IonicContact NZ-OD1 3.97Å; K438-D496 PolarHBondContact NZ-OD1 3.4Å; K438-D496 IonicContact NZ-OD2 2.78Å; K438-D496 PolarHBondContact NZ-OD2 3.44Å; V492-D496 HydrophobicContact CG1-CB 4.23Å; C493-D496 PolarHBondContact N-OD2 3.14Å; C493-D496 WeakPolarHBondContact O-CB 3.09Å; C493-D496 PolarHBondContact O-N 3.34Å; C493-D496 PolarHBondContact SG-OD2 3.25Å; M494-D496 VanDerWaalsContact C-N 3.31Å; M494-D496 PolarHBondContact O-N 2.95Å; D496-R499 PolarHBondContact O-N 2.89Å; D496-S500 PolarHBondContact O-N 3.46Å
497	M	95.6	Very high	92.9	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-63.7	-46.5	175	-60.1	-66.8	-92.5	0	0	111.5	F393 L397 L404 L412 V428 A431 V492 C493 M494 R499 S500 L501	F393-M497 HydrophobicContact CD1-CE 3.51Å; F393-M497 HydrophobicContact CE1-CE 3.83Å; L397-M497 HydrophobicContact CD1-CE 4.26Å; L404-M497 HydrophobicContact CD1-CE 4.08Å; L404-M497 HydrophobicContact CD1-CG 3.87Å; L404-M497 HydrophobicContact CD1-SD 4.36Å; L412-M497 HydrophobicContact CD1-CB 4.34Å; L412-M497 HydrophobicContact CD1-CE 3.58Å; L412-M497 HydrophobicContact CD1-CG 4.29Å; L412-M497 HydrophobicContact CD2-CB 3.9Å; V428-M497 HydrophobicContact CG2-CE 4.15Å; A431-M497 HydrophobicContact CB-CG 4.38Å; A431-M497 HydrophobicContact CB-SD 3.34Å; A431-M497 WeakPolarHBondContact CB-SD 3.4Å; V492-M497 HydrophobicContact CG1-CG 4.49Å; V492-M497 HydrophobicContact CG1-SD 4.29Å; C493-M497 PolarHBondContact O-N 3.11Å; M494-M497 PolarHBondContact O-N 2.88Å; M494-M497 HydrophobicContact SD-CB 4.43Å; M497-R499 VanDerWaalsContact C-N 3.34Å; M497-R499 PolarHBondContact O-N 2.58Å; M497-S500 PolarHBondContact O-N 3.19Å; M497-L501 WeakPolarHBondContact O-CG 3.48Å; M497-L501 PolarHBondContact O-N 3.01Å
498	L	95.8	Very high	92.9	Very high	70 Å²	70	55.2 Å²	55.2	37%	0.366	31%	0.308	S	S	.	.	H	α-helix	trans	-65	-37.2	178.4	-71.4	175.3	0	0	0	112.4	K415 M494 S500 L501 S502	K415-L498 HydrophobicContact CD-CD2 3.93Å; M494-L498 HydrophobicContact CE-CD1 4.4Å; M494-L498 HydrophobicContact CE-CD2 4.04Å; M494-L498 HydrophobicContact CE-CG 4.15Å; M494-L498 HydrophobicContact CG-CD1 4.09Å; M494-L498 HydrophobicContact CG-CG 4.27Å; M494-L498 WeakPolarHBondContact O-CB 3.25Å; M494-L498 VanDerWaalsContact O-CG 3.27Å; M494-L498 WeakPolarHBondContact O-CG 3.36Å; M494-L498 PolarHBondContact O-N 3.3Å; M494-L498 HydrophobicContact SD-CG 4.4Å; L498-S500 VanDerWaalsContact C-N 3.34Å; L498-L501 HydrophobicContact CD2-CD1 4.18Å; L498-L501 PolarHBondContact O-N 2.95Å; L498-S502 PolarHBondContact O-N 3.45Å
499	R	94.6	Very high	93	Very high	139 Å²	139	57.1 Å²	57.1	53%	0.525	32%	0.316	S	S	.	.	H	α-helix	trans	-61	-46.9	172.8	179	-176.8	-69.9	-175.9	-5.6	110.4	Q434 S495 D496 M497 L501 S502 S503	Q434-R499 VanDerWaalsContact OE1-CD 3.31Å; S495-R499 VanDerWaalsContact O-CB 3.29Å; S495-R499 WeakPolarHBondContact O-CB 3.14Å; S495-R499 PolarHBondContact O-N 3.35Å; D496-R499 PolarHBondContact O-N 2.89Å; M497-R499 VanDerWaalsContact C-N 3.34Å; M497-R499 PolarHBondContact O-N 2.58Å; R499-L501 VanDerWaalsContact C-N 3.33Å; R499-L501 PolarHBondContact O-N 2.95Å; R499-S502 PolarHBondContact O-N 3.11Å; R499-S502 VanDerWaalsContact O-N 3.15Å; R499-S502 PolarHBondContact O-OG 3.15Å; R499-S503 PolarHBondContact O-N 3.18Å; R499-S503 PolarHBondContact O-OG 3.41Å
500	S	95.1	Very high	93.1	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-65.5	-36.1	178.8	-167.1	0	0	0	0	113.1	I427 D430 D496 M497 L498 S502 S503 T504	I427-S500 WeakPolarHBondContact CA-OG 3.49Å; I427-S500 PolarHBondContact O-OG 2.86Å; D430-S500 VanDerWaalsContact CB-OG 3.32Å; D430-S500 WeakPolarHBondContact CB-OG 3.11Å; D430-S500 VanDerWaalsContact OD2-CB 3.28Å; D430-S500 WeakPolarHBondContact OD2-CB 3.42Å; D430-S500 PolarHBondContact OD2-OG 3.31Å; D496-S500 PolarHBondContact O-N 3.46Å; M497-S500 PolarHBondContact O-N 3.19Å; L498-S500 VanDerWaalsContact C-N 3.34Å; S500-S502 VanDerWaalsContact C-N 3.32Å; S500-S502 PolarHBondContact O-N 2.78Å; S500-S503 PolarHBondContact O-N 3.11Å; S500-S503 PolarHBondContact O-OG 3.04Å; S500-T504 WeakPolarHBondContact O-CB 3.47Å; S500-T504 PolarHBondContact O-N 3.02Å; S500-T504 VanDerWaalsContact O-N 3.09Å; S500-T504 PolarHBondContact O-OG1 3.46Å
501	L	94.4	Very high	93.2	Very high	21 Å²	21	62.1 Å²	62.1	11%	0.11	34%	0.341	C	S	.	.	H	α-helix	trans	-63.2	-36.8	171.6	-76.7	169.9	0	0	0	112.5	L412 T416 I427 M497 L498 R499 S503 T504	L412-L501 HydrophobicContact CD2-CD1 3.51Å; T416-L501 HydrophobicContact CG2-CD2 3.37Å; I427-L501 HydrophobicContact CD1-CD2 3.52Å; I427-L501 HydrophobicContact CG1-CD2 4.18Å; I427-L501 HydrophobicContact CG2-CD2 3.99Å; I427-L501 HydrophobicContact CG2-CG 4Å; M497-L501 WeakPolarHBondContact O-CG 3.48Å; M497-L501 PolarHBondContact O-N 3.01Å; L498-L501 HydrophobicContact CD2-CD1 4.18Å; L498-L501 PolarHBondContact O-N 2.95Å; R499-L501 VanDerWaalsContact C-N 3.33Å; R499-L501 PolarHBondContact O-N 2.95Å; L501-S503 VanDerWaalsContact C-N 3.31Å; L501-S503 PolarHBondContact O-N 3.14Å; L501-T504 PolarHBondContact O-N 3.23Å; L501-T504 VanDerWaalsContact O-O 3.11Å
502	S	93.1	Very high	93.1	Very high	99 Å²	99	61.2 Å²	61.2	69%	0.692	33%	0.333	S	S	*	.	H	α-helix	trans	-69.9	-27.8	-179.9	74	0	0	0	0	113.5	L498 R499 S500	L498-S502 PolarHBondContact O-N 3.45Å; R499-S502 PolarHBondContact O-N 3.11Å; R499-S502 VanDerWaalsContact O-N 3.15Å; R499-S502 PolarHBondContact O-OG 3.15Å; S500-S502 VanDerWaalsContact C-N 3.32Å; S500-S502 PolarHBondContact O-N 2.78Å
503	S	90.5	Very high	93.1	Very high	81 Å²	81	62.1 Å²	62.1	57%	0.566	34%	0.338	S	S	*	.	H	α-helix	trans	-87.7	-25.6	177.5	54	0	0	0	0	113.1	R499 S500 L501	R499-S503 PolarHBondContact O-N 3.18Å; R499-S503 PolarHBondContact O-OG 3.41Å; S500-S503 PolarHBondContact O-N 3.11Å; S500-S503 PolarHBondContact O-OG 3.04Å; L501-S503 VanDerWaalsContact C-N 3.31Å; L501-S503 PolarHBondContact O-N 3.14Å
504	T	91.9	Very high	93.1	Very high	21 Å²	21	64.8 Å²	64.8	13%	0.129	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-100.1	119.8	-173.9	-49.8	0	0	0	0	111.5	Y419 V426 I427 S500 L501	Y419-T504 HydrophobicContact CE1-CG2 4.46Å; Y419-T504 PolarHBondContact OH-O 3.36Å; V426-T504 HydrophobicContact CG1-CG2 4.41Å; I427-T504 HydrophobicContact CD1-CG2 4.41Å; I427-T504 HydrophobicContact CG1-CG2 3.87Å; S500-T504 WeakPolarHBondContact O-CB 3.47Å; S500-T504 PolarHBondContact O-N 3.02Å; S500-T504 VanDerWaalsContact O-N 3.09Å; S500-T504 PolarHBondContact O-OG1 3.46Å; L501-T504 PolarHBondContact O-N 3.23Å; L501-T504 VanDerWaalsContact O-O 3.11Å
505	K	91.2	Very high	93	Very high	173 Å²	173	66.7 Å²	66.7	75%	0.752	36%	0.358	S	S	*	.	P	Polyproline II helix	trans	-96.4	154.3	174.4	-64.7	-173.1	178.9	-175.7	0	111	T507	K505-T507 PolarHBondContact O-N 3.06Å
506	P	92.4	Very high	92.9	Very high	55 Å²	55	63.4 Å²	63.4	36%	0.357	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-57.4	136.3	171.3	-17.7	27.5	0	0	0	111.3	Y419	Y419-P506 HydrophobicContact CD2-CB 4.42Å; Y419-P506 HydrophobicContact CD2-CG 3.85Å; Y419-P506 HydrophobicContact CE1-CG 4.4Å; Y419-P506 HydrophobicContact CE2-CB 4.48Å; Y419-P506 HydrophobicContact CE2-CG 3.52Å; Y419-P506 HydrophobicContact CG-CG 4.46Å
507	T	90.6	Very high	92.8	Very high	96 Å²	96	70 Å²	70	59%	0.589	36%	0.359	S	S	*	.	S	Bend	trans	-78.4	-26.4	178.4	-62.4	0	0	0	0	112	D423 K505	D423-T507 VanDerWaalsContact OD1-CB 3.28Å; D423-T507 WeakPolarHBondContact OD1-CB 3.31Å; D423-T507 PolarHBondContact OD1-OG1 3.39Å; D423-T507 PolarHBondContact OD2-N 3.49Å; K505-T507 PolarHBondContact O-N 3.06Å
508	V	91.2	Very high	92.7	Very high	16 Å²	16	76.5 Å²	76.5	10%	0.097	39%	0.387	C	S	.	.	S	Bend	trans	-95.6	128.6	-176.6	-173.6	0	0	0	0	109.6	P258 P259 L383 D512 L513	P258-V508 HydrophobicContact CB-CB 4.5Å; P258-V508 HydrophobicContact CB-CG1 3.95Å; P258-V508 HydrophobicContact CB-CG2 3.76Å; P258-V508 HydrophobicContact CG-CG1 4.39Å; P259-V508 HydrophobicContact CG-CG2 4.25Å; L383-V508 HydrophobicContact CD2-CG2 4.22Å; V508-D512 HydrophobicContact CG1-CB 4.49Å; V508-L513 HydrophobicContact CG1-CD2 3.79Å; V508-L513 HydrophobicContact CG1-CG 3.95Å
509	N	91.8	Very high	92.5	Very high	76 Å²	76	73.5 Å²	73.5	41%	0.406	37%	0.371	S	S	.	.			trans	-97.8	161.8	176.1	65.2	57.8	0	0	0	111.7	H511 D512 L513	N509-H511 VanDerWaalsContact C-N 3.26Å; N509-H511 PolarHBondContact O-N 3.1Å; N509-H511 WeakPolarHBondContact OD1-CB 3.38Å; N509-H511 PolarHBondContact OD1-N 3.5Å; N509-H511 VanDerWaalsContact OD1-N 3.13Å; N509-D512 VanDerWaalsContact CG-OD2 3.24Å; N509-D512 PolarHBondContact ND2-OD2 3.07Å; N509-D512 PolarHBondContact O-N 3.34Å; N509-D512 PolarHBondContact OD1-N 2.66Å; N509-D512 PolarHBondContact OD1-OD2 3.41Å; N509-L513 PolarHBondContact O-N 3.39Å
510	D	90.9	Very high	92.3	Very high	126 Å²	126	67.5 Å²	67.5	67%	0.674	35%	0.35	S	S	*	.	H	α-helix	trans	-61.2	-33.5	-178.7	-63.4	-35.4	0	0	0	113.2	D512 L513 D514	D510-D512 PolarHBondContact O-N 3.15Å; D510-L513 WeakPolarHBondContact O-CB 3.32Å; D510-L513 PolarHBondContact O-N 3.47Å; D510-D514 PolarHBondContact O-N 2.98Å
511	H	91.6	Very high	92	Very high	111 Å²	111	73.6 Å²	73.6	51%	0.514	38%	0.383	S	S	.	.	H	α-helix	trans	-67.5	-35.1	179.8	170.1	-96.6	0	0	0	112.6	N509 L513 D514 K515	N509-H511 VanDerWaalsContact C-N 3.26Å; N509-H511 PolarHBondContact O-N 3.1Å; N509-H511 WeakPolarHBondContact OD1-CB 3.38Å; N509-H511 PolarHBondContact OD1-N 3.5Å; N509-H511 VanDerWaalsContact OD1-N 3.13Å; H511-L513 VanDerWaalsContact C-N 3.34Å; H511-D514 PolarHBondContact O-N 3.41Å; H511-K515 WeakPolarHBondContact CE1-CE 3.37Å; H511-K515 PolarHBondContact CE1-NZ 3.36Å; H511-K515 VanDerWaalsContact CE1-NZ 3.26Å; H511-K515 WeakPolarHBondContact O-CG 3.24Å; H511-K515 PolarHBondContact O-N 3.03Å; H511-K515 VanDerWaalsContact O-N 3.12Å
512	D	91	Very high	91.7	Very high	54 Å²	54	77.1 Å²	77.1	29%	0.289	40%	0.402	S	S	.	.	H	α-helix	trans	-69.2	-36.8	173.7	-66.1	-31.2	0	0	0	110.6	V508 N509 D510 K515 L516	V508-D512 HydrophobicContact CG1-CB 4.49Å; N509-D512 VanDerWaalsContact CG-OD2 3.24Å; N509-D512 PolarHBondContact ND2-OD2 3.07Å; N509-D512 PolarHBondContact O-N 3.34Å; N509-D512 PolarHBondContact OD1-N 2.66Å; N509-D512 PolarHBondContact OD1-OD2 3.41Å; D510-D512 PolarHBondContact O-N 3.15Å; D512-K515 PolarHBondContact O-N 3.38Å; D512-L516 WeakPolarHBondContact O-CG 3.31Å; D512-L516 PolarHBondContact O-N 3.32Å
513	L	92.9	Very high	91.3	Very high	22 Å²	22	76.5 Å²	76.5	12%	0.115	39%	0.387	C	S	.	.	H	α-helix	trans	-64.4	-41.5	173	-63.5	177.8	0	0	0	111.9	P258 L383 V508 N509 D510 H511 K515 L516 R517	P258-L513 HydrophobicContact CG-CD2 3.75Å; L383-L513 HydrophobicContact CD1-CD1 3.94Å; L383-L513 HydrophobicContact CD1-CD2 3.92Å; L383-L513 HydrophobicContact CG-CD2 4.24Å; V508-L513 HydrophobicContact CG1-CD2 3.79Å; V508-L513 HydrophobicContact CG1-CG 3.95Å; N509-L513 PolarHBondContact O-N 3.39Å; D510-L513 WeakPolarHBondContact O-CB 3.32Å; D510-L513 PolarHBondContact O-N 3.47Å; H511-L513 VanDerWaalsContact C-N 3.34Å; L513-K515 VanDerWaalsContact C-N 3.34Å; L513-K515 PolarHBondContact O-N 2.96Å; L513-L516 WeakPolarHBondContact O-CB 3.34Å; L513-L516 PolarHBondContact O-N 3.06Å; L513-L516 VanDerWaalsContact O-N 3.17Å; L513-R517 WeakPolarHBondContact O-CG 3.07Å; L513-R517 PolarHBondContact O-N 2.97Å
514	D	93.9	Very high	90.4	Very high	86 Å²	86	73.7 Å²	73.7	46%	0.46	37%	0.37	S	S	.	.	H	α-helix	trans	-65.4	-37.6	178.2	-72.3	-21.4	0	0	0	112.1	D510 H511 L516 R517 K518	D510-D514 PolarHBondContact O-N 2.98Å; H511-D514 PolarHBondContact O-N 3.41Å; D514-L516 VanDerWaalsContact C-N 3.34Å; D514-R517 PolarHBondContact O-N 3.38Å; D514-R517 IonicContact OD1-NH1 3.09Å; D514-R517 PolarHBondContact OD1-NH1 2.99Å; D514-K518 WeakPolarHBondContact O-CB 3.42Å; D514-K518 PolarHBondContact O-N 3.15Å
515	K	94.3	Very high	89.2	Confident	81 Å²	81	77.2 Å²	77.2	35%	0.352	39%	0.385	S	S	.	.	H	α-helix	trans	-63.3	-40.7	171.7	-74.7	177.2	174.4	173.4	0	112.3	W365 H511 D512 L513 F519	W365-K515 HydrophobicContact CE3-CB 3.99Å; W365-K515 HydrophobicContact CH2-CB 3.85Å; W365-K515 HydrophobicContact CH2-CD 4Å; W365-K515 HydrophobicContact CZ2-CB 4.5Å; W365-K515 HydrophobicContact CZ2-CD 3.92Å; W365-K515 HydrophobicContact CZ3-CB 3.56Å; W365-K515 HydrophobicContact CZ3-CD 4.42Å; H511-K515 WeakPolarHBondContact CE1-CE 3.37Å; H511-K515 PolarHBondContact CE1-NZ 3.36Å; H511-K515 VanDerWaalsContact CE1-NZ 3.26Å; H511-K515 WeakPolarHBondContact O-CG 3.24Å; H511-K515 PolarHBondContact O-N 3.03Å; H511-K515 VanDerWaalsContact O-N 3.12Å; D512-K515 PolarHBondContact O-N 3.38Å; L513-K515 VanDerWaalsContact C-N 3.34Å; L513-K515 PolarHBondContact O-N 2.96Å; K515-F519 WeakPolarHBondContact O-CB 3.46Å; K515-F519 PolarHBondContact O-N 2.98Å
516	L	93.4	Very high	87.4	Confident	3 Å²	3	77.1 Å²	77.1	2%	0.016	39%	0.387	C	S	.	.	H	α-helix	trans	-67.3	-42.5	177.6	-73.5	166.2	0	0	0	111.5	F256 P258 P364 W365 Y380 D512 L513 D514 F519 T520	F256-L516 HydrophobicContact CD2-CD2 4.1Å; P258-L516 HydrophobicContact CB-CD1 4.27Å; P258-L516 HydrophobicContact CG-CD1 3.57Å; P364-L516 HydrophobicContact CG-CD2 4.02Å; W365-L516 HydrophobicContact CZ3-CD2 3.9Å; W365-L516 HydrophobicContact CZ3-CG 4.02Å; Y380-L516 HydrophobicContact CE2-CB 4.02Å; Y380-L516 HydrophobicContact CE2-CD1 4.41Å; D512-L516 WeakPolarHBondContact O-CG 3.31Å; D512-L516 PolarHBondContact O-N 3.32Å; L513-L516 WeakPolarHBondContact O-CB 3.34Å; L513-L516 PolarHBondContact O-N 3.06Å; L513-L516 VanDerWaalsContact O-N 3.17Å; D514-L516 VanDerWaalsContact C-N 3.34Å; L516-F519 PolarHBondContact O-N 3.07Å; L516-T520 WeakPolarHBondContact O-CB 3.43Å; L516-T520 PolarHBondContact O-N 3.45Å; L516-T520 PolarHBondContact O-OG1 2.82Å
517	R	91.6	Very high	85	Confident	141 Å²	141	76.5 Å²	76.5	53%	0.532	39%	0.391	S	S	.	.	H	α-helix	trans	-57.9	-51.8	173	-74.8	174	-179.4	158.3	-3.3	110.9	L513 D514 F519 T520 D521	L513-R517 WeakPolarHBondContact O-CG 3.07Å; L513-R517 PolarHBondContact O-N 2.97Å; D514-R517 PolarHBondContact O-N 3.38Å; D514-R517 IonicContact OD1-NH1 3.09Å; D514-R517 PolarHBondContact OD1-NH1 2.99Å; R517-F519 VanDerWaalsContact C-N 3.31Å; R517-F519 PolarHBondContact O-N 3.06Å; R517-T520 CarbonylContact O-C 3.59Å; R517-T520 WeakPolarHBondContact O-CA 3.33Å; R517-T520 VanDerWaalsContact O-CB 3.29Å; R517-T520 WeakPolarHBondContact O-CB 3.47Å; R517-T520 PolarHBondContact O-N 3.3Å; R517-D521 VanDerWaalsContact O-CG 3.31Å; R517-D521 PolarHBondContact O-N 2.86Å
518	K	93.6	Very high	84.7	Confident	136 Å²	136	75.5 Å²	75.5	59%	0.591	38%	0.381	S	S	*	.	H	α-helix	trans	-56.8	-44.2	177.2	-173.9	175.4	-178.3	176	0	112.5	D514 T520 D521 D522	D514-K518 WeakPolarHBondContact O-CB 3.42Å; D514-K518 PolarHBondContact O-N 3.15Å; K518-T520 VanDerWaalsContact C-N 3.29Å; K518-T520 PolarHBondContact O-N 3.34Å; K518-D521 PolarHBondContact O-N 3.35Å; K518-D522 WeakPolarHBondContact O-CB 3.5Å; K518-D522 PolarHBondContact O-N 3.45Å
519	F	92.1	Very high	84.4	Confident	7 Å²	7	78.6 Å²	78.6	3%	0.031	40%	0.396	C	S	.	.	H	α-helix	trans	-64.3	-36.2	175.4	-175.3	-85.9	0	0	0	112.2	F256 P364 W365 K515 L516 R517 F523 G524	F256-F519 HydrophobicContact CD1-CE1 4.48Å; F256-F519 HydrophobicContact CD2-CD1 4.08Å; F256-F519 HydrophobicContact CD2-CE1 4.47Å; F256-F519 HydrophobicContact CE1-CD1 4.47Å; F256-F519 HydrophobicContact CE1-CE1 4.34Å; F256-F519 AromaticContact CE2-CD1 3.71Å; F256-F519 HydrophobicContact CE2-CD1 3.71Å; F256-F519 HydrophobicContact CE2-CE1 4.32Å; F256-F519 AromaticContact CZ-CD1 3.93Å; F256-F519 HydrophobicContact CZ-CD1 3.93Å; F256-F519 HydrophobicContact CZ-CE1 4.25Å; P364-F519 HydrophobicContact CB-CD1 3.76Å; P364-F519 HydrophobicContact CB-CD2 4.09Å; P364-F519 HydrophobicContact CB-CE1 3.55Å; P364-F519 HydrophobicContact CB-CE2 3.87Å; P364-F519 HydrophobicContact CB-CG 4.05Å; P364-F519 HydrophobicContact CB-CZ 3.61Å; P364-F519 HydrophobicContact CG-CB 4.26Å; P364-F519 HydrophobicContact CG-CD1 3.62Å; P364-F519 HydrophobicContact CG-CD2 4.07Å; P364-F519 HydrophobicContact CG-CE1 3.97Å; P364-F519 HydrophobicContact CG-CE2 4.37Å; P364-F519 HydrophobicContact CG-CG 3.69Å; P364-F519 HydrophobicContact CG-CZ 4.34Å; P364-F519 WeakPolarHBondContact O-CE2 3.49Å; W365-F519 HydrophobicContact CB-CD2 4.28Å; K515-F519 WeakPolarHBondContact O-CB 3.46Å; K515-F519 PolarHBondContact O-N 2.98Å; L516-F519 PolarHBondContact O-N 3.07Å; R517-F519 VanDerWaalsContact C-N 3.31Å; R517-F519 PolarHBondContact O-N 3.06Å; F519-F523 AromaticContact CD2-CD2 3.8Å; F519-F523 HydrophobicContact CD2-CD2 3.8Å; F519-F523 HydrophobicContact CE1-CB 4.1Å; F519-F523 HydrophobicContact CE2-CB 4.25Å; F519-F523 AromaticContact CE2-CD2 3.73Å; F519-F523 HydrophobicContact CE2-CD2 3.73Å; F519-F523 HydrophobicContact CE2-CG 4.29Å; F519-F523 HydrophobicContact CG-CD2 4.42Å; F519-F523 HydrophobicContact CZ-CB 3.92Å; F519-F523 HydrophobicContact CZ-CD2 4.27Å; F519-F523 HydrophobicContact CZ-CG 4.42Å; F519-F523 PolarHBondContact O-N 3.46Å; F519-G524 PolarHBondContact O-N 2.91Å
520	T	90.1	Very high	84	Confident	12 Å²	12	78.8 Å²	78.8	7%	0.074	40%	0.395	C	S	.	.	H	α-helix	trans	-65	-45.6	177	-53.6	0	0	0	0	110.7	F256 Y380 L516 R517 K518 G524 E526	F256-T520 WeakPolarHBondContact CE2-OG1 3.38Å; F256-T520 HydrophobicContact CZ-CG2 4.38Å; F256-T520 WeakPolarHBondContact CZ-OG1 3.4Å; Y380-T520 HydrophobicContact CG-CG2 4.49Å; L516-T520 WeakPolarHBondContact O-CB 3.43Å; L516-T520 PolarHBondContact O-N 3.45Å; L516-T520 PolarHBondContact O-OG1 2.82Å; R517-T520 CarbonylContact O-C 3.59Å; R517-T520 WeakPolarHBondContact O-CA 3.33Å; R517-T520 VanDerWaalsContact O-CB 3.29Å; R517-T520 WeakPolarHBondContact O-CB 3.47Å; R517-T520 PolarHBondContact O-N 3.3Å; K518-T520 VanDerWaalsContact C-N 3.29Å; K518-T520 PolarHBondContact O-N 3.34Å; T520-G524 CarbonylContact O-C 3.55Å; T520-G524 VanDerWaalsContact O-CA 3.23Å; T520-G524 WeakPolarHBondContact O-CA 3.42Å; T520-G524 PolarHBondContact O-N 3.42Å; T520-E526 HydrophobicContact CG2-CG 4.43Å
521	D	89.6	Confident	83.6	Confident	129 Å²	129	76 Å²	76	69%	0.69	38%	0.379	S	S	*	.	H	α-helix	trans	-64.1	-42	177.1	-61.1	-22.8	0	0	0	111.9	R517 K518	R517-D521 VanDerWaalsContact O-CG 3.31Å; R517-D521 PolarHBondContact O-N 2.86Å; K518-D521 PolarHBondContact O-N 3.35Å
522	D	87.7	Confident	83.1	Confident	95 Å²	95	73.8 Å²	73.8	51%	0.508	37%	0.37	S	S	.	.	H	α-helix	trans	-76.6	-37.2	-176.3	-71.3	-20.7	0	0	0	112.9	K518	K518-D522 WeakPolarHBondContact O-CB 3.5Å; K518-D522 PolarHBondContact O-N 3.45Å
523	F	84.4	Confident	82.5	Confident	86 Å²	86	75.1 Å²	75.1	38%	0.377	38%	0.376	S	S	.	.	H	α-helix	trans	-142.3	-11.8	-165.8	-56.1	-68.9	0	0	0	115.5	R372 R378 F519	R372-F523 VanDerWaalsContact NH1-CZ 3.34Å; R378-F523 WeakPolarHBondContact CD-O 3.31Å; R378-F523 PolarHBondContact NH1-O 3.25Å; F519-F523 AromaticContact CD2-CD2 3.8Å; F519-F523 HydrophobicContact CD2-CD2 3.8Å; F519-F523 HydrophobicContact CE1-CB 4.1Å; F519-F523 HydrophobicContact CE2-CB 4.25Å; F519-F523 AromaticContact CE2-CD2 3.73Å; F519-F523 HydrophobicContact CE2-CD2 3.73Å; F519-F523 HydrophobicContact CE2-CG 4.29Å; F519-F523 HydrophobicContact CG-CD2 4.42Å; F519-F523 HydrophobicContact CZ-CB 3.92Å; F519-F523 HydrophobicContact CZ-CD2 4.27Å; F519-F523 HydrophobicContact CZ-CG 4.42Å; F519-F523 PolarHBondContact O-N 3.46Å
524	G	72.8	Confident	81.8	Confident	21 Å²	21	78.9 Å²	78.9	22%	0.216	40%	0.395	C	S	.	.			trans	-87.5	174.9	-175	0	0	0	0	0	113.4	F519 T520	F519-G524 PolarHBondContact O-N 2.91Å; T520-G524 CarbonylContact O-C 3.55Å; T520-G524 VanDerWaalsContact O-CA 3.23Å; T520-G524 WeakPolarHBondContact O-CA 3.42Å; T520-G524 PolarHBondContact O-N 3.42Å
525	Q	66.7	Low	80.8	Confident	96 Å²	96	78.4 Å²	78.4	45%	0.449	39%	0.389	S	S	.	.	B	Isolated β-bridge	trans	-118.9	141.6	151.8	-68	-178.4	-7.6	0	0	105.9	K377 R378 G527	K377-Q525 VanDerWaalsContact CE-OE1 3.24Å; R378-Q525 PolarHBondContact O-N 3.42Å; R378-Q525 VanDerWaalsContact O-N 3.14Å; Q525-G527 PolarHBondContact O-N 3.42Å
526	E	52.3	Low	79.7	Confident	170 Å²	170	78.2 Å²	78.2	79%	0.794	39%	0.393	S	S	*	.			trans	-57.5	127.6	169.8	-72.3	-172.9	153.6	0	0	107.9	T520	T520-E526 HydrophobicContact CG2-CG 4.43Å
527	G	42.4	Very low	78.5	Confident	42 Å²	42	85 Å²	85	43%	0.433	43%	0.427	S	S	.	.			trans	-71.9	0	174.3	0	0	0	0	0	108.5	G224 A225 Q525	G224-G527 WeakPolarHBondContact CA-OXT 3.24Å; A225-G527 VanDerWaalsContact N-C 3.29Å; A225-G527 PolarHBondContact N-OXT 3.21Å; A225-G527 VanDerWaalsContact N-OXT 3.13Å; Q525-G527 PolarHBondContact O-N 3.42Å

Retrieved 527 of 527 residues in 480.2 ms (Link to these results)

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