A0A096N9X5_PAPAN Loading...

EPM2A interacting protein 1

AlphaFold DB , UniProt , Accession A0A096N9X5, Species PAPAN (Papio anubis, Olive baboon), Gene EPM2AIP1, Length 607 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	31.3	Very low	31.5	Very low	227 Å²	227	177.6 Å²	177.6	100%	1.118	85%	0.853	S	S	*	*				0	106.1	0	-94.1	-173.1	175.5	0	0	107
2	W	29.6	Very low	31.9	Very low	226 Å²	226	172.5 Å²	172.5	86%	0.856	84%	0.84	S	S	*	*			cis	-143.8	130.7	5.4	-84.6	60.8	0	0	0	105.6	T4	W2-T4 PolarHBondContact O-N 3.18Å
3	M	26.3	Very low	32.6	Very low	188 Å²	188	170.7 Å²	170.7	93%	0.926	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-71.9	119.6	165	-77.5	-165.5	-91.1	0	0	107.6
4	T	29.6	Very low	33.6	Very low	131 Å²	131	169.1 Å²	169.1	80%	0.804	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-71.6	129.4	168.6	29.2	0	0	0	0	109.1	W2	W2-T4 PolarHBondContact O-N 3.18Å
5	P	31.8	Very low	34.5	Very low	116 Å²	116	162.2 Å²	162.2	75%	0.753	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-69.9	140	177.3	-7.8	22.4	0	0	0	109.9	R7	P5-R7 PolarHBondContact O-N 3.08Å
6	K	31.5	Very low	36	Very low	210 Å²	210	160.8 Å²	160.8	91%	0.913	80%	0.803	S	S	*	*			trans	-57.1	102.5	159.1	-83.4	-178.7	174.7	178.6	0	107.8	S8	K6-S8 VanDerWaalsContact C-N 3.3Å; K6-S8 PolarHBondContact O-N 2.95Å
7	R	31.4	Very low	37.9	Very low	241 Å²	241	156.6 Å²	156.6	91%	0.909	79%	0.788	S	S	*	*			trans	-67.2	96.6	161.1	-87.3	-177.5	172	175.1	-2.7	107	P5 K9	P5-R7 PolarHBondContact O-N 3.08Å; R7-K9 VanDerWaalsContact C-N 3.33Å; R7-K9 PolarHBondContact O-N 3.2Å
8	S	33	Very low	40.2	Very low	107 Å²	107	149.3 Å²	149.3	75%	0.748	75%	0.75	S	S	*	*			trans	-54.3	105.1	149.9	169.1	0	0	0	0	106.2	K6 M10	K6-S8 VanDerWaalsContact C-N 3.3Å; K6-S8 PolarHBondContact O-N 2.95Å; S8-M10 PolarHBondContact O-N 2.96Å; S8-M10 VanDerWaalsContact O-N 3.08Å
9	K	33.8	Very low	42.4	Very low	192 Å²	192	147.4 Å²	147.4	84%	0.835	73%	0.733	S	S	*	*			trans	-69.2	99.4	156.2	-105.3	-175.8	174.2	-176.9	0	104.1	R7 E11	R7-K9 VanDerWaalsContact C-N 3.33Å; R7-K9 PolarHBondContact O-N 3.2Å; K9-E11 PolarHBondContact O-N 2.93Å
10	M	34.6	Very low	44.4	Very low	161 Å²	161	145.2 Å²	145.2	79%	0.793	73%	0.73	S	S	*	*			trans	-54.2	100.9	152.9	-138.5	172.6	79.2	0	0	104.6	S8 V12	S8-M10 PolarHBondContact O-N 2.96Å; S8-M10 VanDerWaalsContact O-N 3.08Å; M10-V12 PolarHBondContact O-N 2.74Å; M10-V12 VanDerWaalsContact O-N 3.11Å
11	E	33.3	Very low	46.4	Very low	155 Å²	155	143.7 Å²	143.7	72%	0.724	72%	0.72	S	S	*	*			trans	-59.5	115	163.5	-82.8	-171.9	150.7	0	0	105	K9 D13	K9-E11 PolarHBondContact O-N 2.93Å; E11-D13 PolarHBondContact O-N 3.49Å
12	V	36.6	Very low	49.1	Very low	116 Å²	116	133.6 Å²	133.6	70%	0.703	67%	0.67	S	S	*	*			trans	-57.3	122.3	165.5	176.5	0	0	0	0	104.9	M10 E14	M10-V12 PolarHBondContact O-N 2.74Å; M10-V12 VanDerWaalsContact O-N 3.11Å; V12-E14 PolarHBondContact O-N 2.75Å
13	D	40.7	Very low	51.9	Low	149 Å²	149	123.2 Å²	123.2	80%	0.797	63%	0.631	S	S	*	*			trans	-63.5	81.6	174.5	-151.3	5.1	0	0	0	107.1	E11 A15	E11-D13 PolarHBondContact O-N 3.49Å; D13-A15 VanDerWaalsContact C-N 3.29Å; D13-A15 PolarHBondContact O-N 2.91Å
14	E	47	Very low	54.8	Low	149 Å²	149	118 Å²	118	70%	0.696	61%	0.605	S	S	*	*			trans	-67.1	98.1	171.7	-83.8	-168.7	163.5	0	0	106.4	V12	V12-E14 PolarHBondContact O-N 2.75Å
15	A	47.2	Very low	57.4	Low	65 Å²	65	117.9 Å²	117.9	54%	0.537	59%	0.59	S	S	.	*			trans	-20.3	127.5	177	0	0	0	0	0	114.5	D13 V17	D13-A15 VanDerWaalsContact C-N 3.29Å; D13-A15 PolarHBondContact O-N 2.91Å; A15-V17 HydrophobicContact CB-CB 3.97Å; A15-V17 HydrophobicContact CB-CG2 3.7Å; A15-V17 PolarHBondContact O-N 2.81Å
16	L	57.8	Low	60.1	Low	139 Å²	139	113.2 Å²	113.2	73%	0.728	56%	0.557	S	S	*	*	S	Bend	trans	-60.3	33.2	164.6	-71.5	157	0	0	0	113	T49	L16-T49 HydrophobicContact CD2-CG2 3.78Å
17	V	68.6	Low	62.8	Low	91 Å²	91	103.2 Å²	103.2	55%	0.552	51%	0.513	S	S	*	.			trans	-110.4	124.8	-167.1	176.8	0	0	0	0	108.7	A15 R19	A15-V17 HydrophobicContact CB-CB 3.97Å; A15-V17 HydrophobicContact CB-CG2 3.7Å; A15-V17 PolarHBondContact O-N 2.81Å; V17-R19 PolarHBondContact O-N 2.92Å
18	F	78.9	Confident	65.5	Low	25 Å²	25	91.7 Å²	91.7	11%	0.11	47%	0.47	C	S	.	.			trans	-52.7	134.8	174.2	177.1	-91.4	0	0	0	111.1	W22 V28 E30 A37	F18-W22 AromaticContact CD2-CE3 3.83Å; F18-W22 HydrophobicContact CD2-CE3 3.83Å; F18-W22 HydrophobicContact CD2-CZ3 4.28Å; F18-W22 HydrophobicContact CE2-CB 4.37Å; F18-W22 HydrophobicContact CE2-CE3 4.06Å; F18-W22 HydrophobicContact CZ-CB 4.41Å; F18-V28 HydrophobicContact CE2-CB 4.36Å; F18-V28 HydrophobicContact CE2-CG2 3.79Å; F18-V28 HydrophobicContact CZ-CG2 4.31Å; F18-V28 WeakPolarHBondContact CZ-O 3.4Å; F18-E30 HydrophobicContact CB-CB 4.29Å; F18-E30 HydrophobicContact CB-CG 4.13Å; F18-E30 HydrophobicContact CD1-CB 3.78Å; F18-E30 HydrophobicContact CD1-CG 4.47Å; F18-E30 HydrophobicContact CD2-CB 4.44Å; F18-E30 HydrophobicContact CE1-CB 4.24Å; F18-E30 HydrophobicContact CG-CB 3.91Å; F18-E30 HydrophobicContact CG-CG 4.3Å; F18-A37 HydrophobicContact CD2-CB 4.01Å; F18-A37 HydrophobicContact CE2-CB 4.08Å
19	R	82.6	Confident	68.2	Low	113 Å²	113	87.7 Å²	87.7	43%	0.426	44%	0.441	S	S	.	.			trans	-101.3	126.9	175.9	-63	-171.3	-177.3	-177.2	3	110.7	V17 E21 W22	V17-R19 PolarHBondContact O-N 2.92Å; R19-E21 PolarHBondContact O-N 2.98Å; R19-E21 VanDerWaalsContact O-N 3.07Å; R19-W22 HydrophobicContact CB-CD2 4.07Å; R19-W22 HydrophobicContact CB-CG 4.17Å; R19-W22 HydrophobicContact CB-CZ2 4.35Å; R19-W22 HydrophobicContact CG-CZ2 4.16Å; R19-W22 VanDerWaalsContact O-CB 3.27Å; R19-W22 WeakPolarHBondContact O-CB 3.34Å; R19-W22 PolarHBondContact O-N 3.04Å
20	P	82.5	Confident	70.7	Confident	102 Å²	102	83.8 Å²	83.8	66%	0.662	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-27.9	179	-27.4	34.8	0	0	0	114.7	W22 T23	P20-W22 PolarHBondContact O-N 3.08Å; P20-T23 WeakPolarHBondContact O-CB 3.18Å; P20-T23 PolarHBondContact O-N 3.11Å; P20-T23 VanDerWaalsContact O-N 3.09Å; P20-T23 PolarHBondContact O-OG1 3.03Å
21	E	85.7	Confident	72.9	Confident	115 Å²	115	76.7 Å²	76.7	54%	0.537	39%	0.392	S	S	.	.	H	α-helix	trans	-59.8	-28.9	175.7	-63.3	179	-160.7	0	0	112.8	R19 T23 Q24 R25	R19-E21 PolarHBondContact O-N 2.98Å; R19-E21 VanDerWaalsContact O-N 3.07Å; E21-T23 PolarHBondContact O-N 3.03Å; E21-Q24 PolarHBondContact O-N 2.74Å; E21-R25 PolarHBondContact O-N 2.81Å
22	W	89.1	Confident	74.7	Confident	14 Å²	14	75.7 Å²	75.7	5%	0.053	40%	0.398	C	S	.	.	H	α-helix	trans	-65.8	-23.9	177.9	-60.5	-9.5	0	0	0	112.3	F18 R19 P20 Y26 L27 V28 E51 V54	F18-W22 AromaticContact CD2-CE3 3.83Å; F18-W22 HydrophobicContact CD2-CE3 3.83Å; F18-W22 HydrophobicContact CD2-CZ3 4.28Å; F18-W22 HydrophobicContact CE2-CB 4.37Å; F18-W22 HydrophobicContact CE2-CE3 4.06Å; F18-W22 HydrophobicContact CZ-CB 4.41Å; R19-W22 HydrophobicContact CB-CD2 4.07Å; R19-W22 HydrophobicContact CB-CG 4.17Å; R19-W22 HydrophobicContact CB-CZ2 4.35Å; R19-W22 HydrophobicContact CG-CZ2 4.16Å; R19-W22 VanDerWaalsContact O-CB 3.27Å; R19-W22 WeakPolarHBondContact O-CB 3.34Å; R19-W22 PolarHBondContact O-N 3.04Å; P20-W22 PolarHBondContact O-N 3.08Å; W22-Y26 HydrophobicContact CB-CD2 4.04Å; W22-Y26 HydrophobicContact CG-CD2 4.13Å; W22-Y26 CarbonylContact O-C 3.51Å; W22-Y26 WeakPolarHBondContact O-CA 3.27Å; W22-Y26 PolarHBondContact O-N 2.94Å; W22-L27 PolarHBondContact O-N 3.16Å; W22-V28 HydrophobicContact CB-CG2 3.6Å; W22-E51 HydrophobicContact CZ2-CB 3.83Å; W22-V54 HydrophobicContact CD2-CG2 3.97Å; W22-V54 HydrophobicContact CE3-CG1 4.21Å; W22-V54 HydrophobicContact CE3-CG2 4.05Å; W22-V54 HydrophobicContact CG-CG2 4.28Å; W22-V54 HydrophobicContact CZ3-CG1 4.4Å; W22-V54 HydrophobicContact CZ3-CG2 4.49Å
23	T	88.1	Confident	76.3	Confident	8 Å²	8	78.5 Å²	78.5	5%	0.049	40%	0.404	C	S	.	.	H	α-helix	trans	-63.5	-43.4	174.6	-56.7	0	0	0	0	111.7	P20 E21 L27 V28 V29 L40 V78	P20-T23 WeakPolarHBondContact O-CB 3.18Å; P20-T23 PolarHBondContact O-N 3.11Å; P20-T23 VanDerWaalsContact O-N 3.09Å; P20-T23 PolarHBondContact O-OG1 3.03Å; E21-T23 PolarHBondContact O-N 3.03Å; T23-L27 WeakPolarHBondContact O-CA 3.35Å; T23-L27 PolarHBondContact O-N 3.07Å; T23-V28 WeakPolarHBondContact CA-O 3.45Å; T23-V28 VanDerWaalsContact CB-O 3.26Å; T23-V28 WeakPolarHBondContact CB-O 3.17Å; T23-V28 PolarHBondContact OG1-O 3.24Å; T23-V29 HydrophobicContact CG2-CG1 4.05Å; T23-L40 HydrophobicContact CG2-CD1 4.35Å; T23-V78 HydrophobicContact CG2-CG1 3.45Å; T23-V78 VanDerWaalsContact CG2-CG1 3.45Å; T23-V78 HydrophobicContact CG2-CG2 4.26Å; T23-V78 WeakPolarHBondContact O-CG2 3.37Å
24	Q	86.3	Confident	77.4	Confident	79 Å²	79	73.4 Å²	73.4	37%	0.369	39%	0.387	S	S	.	.	H	α-helix	trans	-78.9	-37.4	178.7	-64.9	-62.7	-21.7	0	0	111.6	E21 R74	E21-Q24 PolarHBondContact O-N 2.74Å; Q24-R74 PolarHBondContact O-NE 2.75Å; Q24-R74 PolarHBondContact O-NH2 3.04Å
25	R	85.4	Confident	78.6	Confident	129 Å²	129	72.6 Å²	72.6	49%	0.487	39%	0.387	S	S	.	.	H	α-helix	trans	-77.8	-44.5	-177.6	-69	-174.8	176	175.8	4.3	113.7	E21 E51 R74	E21-R25 PolarHBondContact O-N 2.81Å; R25-E51 IonicContact NH1-OE1 2.77Å; R25-R74 PolarHBondContact O-NH2 3.46Å
26	Y	88.2	Confident	80.1	Confident	17 Å²	17	70.5 Å²	70.5	7%	0.067	37%	0.372	C	S	.	.	H	α-helix	trans	-123.1	9.3	-168.1	-51.5	-59.7	0	0	0	114	W22 V28 E51 V54 R55 Y58	W22-Y26 HydrophobicContact CB-CD2 4.04Å; W22-Y26 HydrophobicContact CG-CD2 4.13Å; W22-Y26 CarbonylContact O-C 3.51Å; W22-Y26 WeakPolarHBondContact O-CA 3.27Å; W22-Y26 PolarHBondContact O-N 2.94Å; Y26-V28 VanDerWaalsContact C-N 3.31Å; Y26-V28 WeakPolarHBondContact O-CG1 3.36Å; Y26-V28 PolarHBondContact O-N 3.09Å; Y26-E51 HydrophobicContact CE2-CG 3.64Å; Y26-E51 PolarHBondContact OH-OE1 3.17Å; Y26-E51 VanDerWaalsContact OH-OE1 3.12Å; Y26-V54 HydrophobicContact CD2-CG2 3.73Å; Y26-V54 HydrophobicContact CE2-CG2 4.3Å; Y26-V54 HydrophobicContact CG-CG2 4.23Å; Y26-R55 HydrophobicContact CD1-CB 4.24Å; Y26-R55 HydrophobicContact CD1-CG 4.48Å; Y26-R55 HydrophobicContact CE1-CB 3.73Å; Y26-R55 HydrophobicContact CE1-CG 3.71Å; Y26-Y58 HydrophobicContact CD1-CD1 4.09Å; Y26-Y58 HydrophobicContact CD1-CG 4.06Å; Y26-Y58 WeakPolarHBondContact O-CD2 3.43Å
27	L	87.9	Confident	81.5	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	34%	0.337	C	S	.	.			trans	54.8	42.8	177.5	-54.3	178.6	0	0	0	113.2	W22 T23 L40 V41 Y58 Y65 L77 V78 L81	W22-L27 PolarHBondContact O-N 3.16Å; T23-L27 WeakPolarHBondContact O-CA 3.35Å; T23-L27 PolarHBondContact O-N 3.07Å; L27-L40 WeakPolarHBondContact O-CB 3.26Å; L27-L40 WeakPolarHBondContact O-CG 3.26Å; L27-L40 PolarHBondContact O-N 3.08Å; L27-V41 HydrophobicContact CB-CG2 4.11Å; L27-V41 HydrophobicContact CD1-CG2 3.71Å; L27-Y58 HydrophobicContact CD1-CE2 3.94Å; L27-Y58 HydrophobicContact CG-CE2 4Å; L27-Y65 HydrophobicContact CD1-CD1 4.34Å; L27-Y65 HydrophobicContact CD1-CD2 4.28Å; L27-Y65 HydrophobicContact CD1-CG 3.87Å; L27-L77 HydrophobicContact CD1-CD2 4.04Å; L27-L77 HydrophobicContact CD2-CD2 4.01Å; L27-V78 HydrophobicContact CD2-CG2 3.8Å; L27-L81 HydrophobicContact CB-CD1 4.41Å; L27-L81 HydrophobicContact CD1-CD1 4.01Å; L27-L81 HydrophobicContact CD2-CD1 4.09Å; L27-L81 HydrophobicContact CG-CD1 4.4Å
28	V	88.9	Confident	82.3	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	153.8	178.9	-65.2	0	0	0	0	112.2	F18 W22 T23 Y26 A37 L38 C39 I46 V54	F18-V28 HydrophobicContact CE2-CB 4.36Å; F18-V28 HydrophobicContact CE2-CG2 3.79Å; F18-V28 HydrophobicContact CZ-CG2 4.31Å; F18-V28 WeakPolarHBondContact CZ-O 3.4Å; W22-V28 HydrophobicContact CB-CG2 3.6Å; T23-V28 WeakPolarHBondContact CA-O 3.45Å; T23-V28 VanDerWaalsContact CB-O 3.26Å; T23-V28 WeakPolarHBondContact CB-O 3.17Å; T23-V28 PolarHBondContact OG1-O 3.24Å; Y26-V28 VanDerWaalsContact C-N 3.31Å; Y26-V28 WeakPolarHBondContact O-CG1 3.36Å; Y26-V28 PolarHBondContact O-N 3.09Å; V28-A37 HydrophobicContact CB-CB 4.12Å; V28-A37 HydrophobicContact CG2-CB 4.25Å; V28-L38 CarbonylContact C-O 3.5Å; V28-L38 VanDerWaalsContact CA-O 3.26Å; V28-L38 WeakPolarHBondContact CA-O 3.2Å; V28-C39 HydrophobicContact CG1-CB 4.35Å; V28-I46 HydrophobicContact CG1-CD1 3.89Å; V28-V54 HydrophobicContact CG2-CG1 4.37Å
29	V	88.8	Confident	82.7	Confident	22 Å²	22	60.3 Å²	60.3	13%	0.133	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	158.9	174.9	-69.6	0	0	0	0	111.1	T23 L38 L40	T23-V29 HydrophobicContact CG2-CG1 4.05Å; V29-L38 HydrophobicContact CG2-CB 4.15Å; V29-L38 HydrophobicContact CG2-CD2 4.33Å; V29-L38 PolarHBondContact N-O 2.72Å; V29-L38 PolarHBondContact O-N 3.43Å; V29-L40 HydrophobicContact CB-CD2 4.24Å; V29-L40 HydrophobicContact CG1-CD1 3.81Å; V29-L40 HydrophobicContact CG1-CD2 3.68Å; V29-L40 HydrophobicContact CG1-CG 3.86Å; V29-L40 HydrophobicContact CG2-CD2 3.54Å; V29-L40 HydrophobicContact CG2-CG 4.15Å
30	E	86	Confident	82.7	Confident	111 Å²	111	55 Å²	55	52%	0.519	30%	0.296	S	S	.	.			trans	-66.9	125.5	172.5	-166.4	168.7	-159.3	0	0	109.6	F18	F18-E30 HydrophobicContact CB-CB 4.29Å; F18-E30 HydrophobicContact CB-CG 4.13Å; F18-E30 HydrophobicContact CD1-CB 3.78Å; F18-E30 HydrophobicContact CD1-CG 4.47Å; F18-E30 HydrophobicContact CD2-CB 4.44Å; F18-E30 HydrophobicContact CE1-CB 4.24Å; F18-E30 HydrophobicContact CG-CB 3.91Å; F18-E30 HydrophobicContact CG-CG 4.3Å
31	P	81.3	Confident	82.4	Confident	12 Å²	12	50.8 Å²	50.8	8%	0.078	27%	0.269	C	S	.	.			trans	-70.4	151.4	177.2	28.1	-32	0	0	0	110.6	E33 G34 N35 G36 L38 L45	P31-E33 PolarHBondContact O-N 2.98Å; P31-E33 VanDerWaalsContact O-N 3.08Å; P31-G34 PolarHBondContact O-N 3.42Å; P31-N35 WeakPolarHBondContact CG-O 3.49Å; P31-G36 WeakPolarHBondContact CD-O 3.41Å; P31-L38 HydrophobicContact CB-CB 4.33Å; P31-L45 HydrophobicContact CB-CD1 3.95Å; P31-L45 HydrophobicContact CG-CD1 3.88Å
32	P	70.9	Confident	81.9	Confident	133 Å²	133	47.2 Å²	47.2	86%	0.864	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-21.5	180	22.4	-31.6	0	0	0	113.8	G34	P32-G34 VanDerWaalsContact C-N 3.35Å
33	E	69.8	Low	81.5	Confident	175 Å²	175	51.9 Å²	51.9	82%	0.818	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-0.1	177.4	-61	-179.3	-177.7	0	0	113.4	P31 N35	P31-E33 PolarHBondContact O-N 2.98Å; P31-E33 VanDerWaalsContact O-N 3.08Å; E33-N35 VanDerWaalsContact C-N 3.27Å; E33-N35 PolarHBondContact O-N 2.82Å
34	G	64.6	Low	81.2	Confident	42 Å²	42	58.2 Å²	58.2	43%	0.433	30%	0.296	S	S	.	.	S	Bend	trans	76.4	-5.5	169.7	0	0	0	0	0	116.9	P31 P32	P31-G34 PolarHBondContact O-N 3.42Å; P32-G34 VanDerWaalsContact C-N 3.35Å
35	N	73.1	Confident	81.1	Confident	132 Å²	132	58.9 Å²	58.9	71%	0.706	30%	0.302	S	S	*	.	S	Bend	trans	-107	115.9	-179.9	-74.5	-29.6	0	0	0	112.2	P31 E33	P31-N35 WeakPolarHBondContact CG-O 3.49Å; E33-N35 VanDerWaalsContact C-N 3.27Å; E33-N35 PolarHBondContact O-N 2.82Å
36	G	78.8	Confident	81	Confident	21 Å²	21	53.8 Å²	53.8	22%	0.216	28%	0.284	C	S	.	.	S	Bend	trans	89.9	-157.2	173.8	0	0	0	0	0	114.2	P31 I46	P31-G36 WeakPolarHBondContact CD-O 3.41Å; G36-I46 WeakPolarHBondContact CA-O 3.38Å
37	A	86.5	Confident	80.3	Confident	0 Å²	0	59 Å²	59	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	124.7	179.7	0	0	0	0	0	109.9	F18 V28 I46 A48 V54	F18-A37 HydrophobicContact CD2-CB 4.01Å; F18-A37 HydrophobicContact CE2-CB 4.08Å; V28-A37 HydrophobicContact CB-CB 4.12Å; V28-A37 HydrophobicContact CG2-CB 4.25Å; A37-I46 PolarHBondContact N-O 2.84Å; A37-I46 WeakPolarHBondContact O-CB 3.25Å; A37-I46 PolarHBondContact O-N 3.4Å; A37-A48 HydrophobicContact CB-CB 4.12Å; A37-V54 HydrophobicContact CB-CG1 3.69Å
38	L	85.4	Confident	79.2	Confident	41 Å²	41	59.7 Å²	59.7	22%	0.215	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	120.9	176.1	-179.5	66.2	0	0	0	109.4	V28 V29 P31 L40 R43	V28-L38 CarbonylContact C-O 3.5Å; V28-L38 VanDerWaalsContact CA-O 3.26Å; V28-L38 WeakPolarHBondContact CA-O 3.2Å; V29-L38 HydrophobicContact CG2-CB 4.15Å; V29-L38 HydrophobicContact CG2-CD2 4.33Å; V29-L38 PolarHBondContact N-O 2.72Å; V29-L38 PolarHBondContact O-N 3.43Å; P31-L38 HydrophobicContact CB-CB 4.33Å; L38-L40 PolarHBondContact O-N 3.47Å; L38-R43 WeakPolarHBondContact CD1-O 3.12Å
39	C	86.5	Confident	78	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	126.6	174.1	-177.9	0	0	0	0	110.5	V28 V41 R43 R44 I46 H57 H62	V28-C39 HydrophobicContact CG1-CB 4.35Å; C39-V41 VanDerWaalsContact C-N 3.29Å; C39-V41 PolarHBondContact O-N 2.76Å; C39-V41 PolarHBondContact SG-N 3Å; C39-R43 WeakPolarHBondContact O-CA 3.37Å; C39-R43 PolarHBondContact O-N 2.93Å; C39-R43 VanDerWaalsContact O-N 3.08Å; C39-R44 PolarHBondContact N-O 3.29Å; C39-I46 HydrophobicContact CB-CD1 4.37Å; C39-H57 PolarHBondContact SG-NE2 3.28Å; C39-H57 VanDerWaalsContact SG-NE2 3.42Å; C39-H62 VanDerWaalsContact SG-CD2 3.55Å; C39-H62 PolarHBondContact SG-NE2 3.39Å; C39-H62 VanDerWaalsContact SG-NE2 3.43Å
40	L	82.4	Confident	77.5	Confident	2 Å²	2	67.4 Å²	67.4	1%	0.01	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-23.3	178.7	-69.6	175.4	0	0	0	112.9	T23 L27 V29 L38 V78 L81 R82	T23-L40 HydrophobicContact CG2-CD1 4.35Å; L27-L40 WeakPolarHBondContact O-CB 3.26Å; L27-L40 WeakPolarHBondContact O-CG 3.26Å; L27-L40 PolarHBondContact O-N 3.08Å; V29-L40 HydrophobicContact CB-CD2 4.24Å; V29-L40 HydrophobicContact CG1-CD1 3.81Å; V29-L40 HydrophobicContact CG1-CD2 3.68Å; V29-L40 HydrophobicContact CG1-CG 3.86Å; V29-L40 HydrophobicContact CG2-CD2 3.54Å; V29-L40 HydrophobicContact CG2-CG 4.15Å; L38-L40 PolarHBondContact O-N 3.47Å; L40-V78 HydrophobicContact CD1-CG1 4.33Å; L40-L81 HydrophobicContact CB-CB 3.98Å; L40-L81 HydrophobicContact CB-CD1 4.32Å; L40-L81 HydrophobicContact CD1-CB 4.25Å; L40-R82 HydrophobicContact CD1-CG 4.3Å; L40-R82 HydrophobicContact CD2-CG 4.12Å
41	V	77.1	Confident	77.4	Confident	14 Å²	14	64.9 Å²	64.9	9%	0.085	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-63.1	-178.3	-177.2	0	0	0	0	111.2	L27 C39 Y65 L81 L86	L27-V41 HydrophobicContact CB-CG2 4.11Å; L27-V41 HydrophobicContact CD1-CG2 3.71Å; C39-V41 VanDerWaalsContact C-N 3.29Å; C39-V41 PolarHBondContact O-N 2.76Å; C39-V41 PolarHBondContact SG-N 3Å; V41-Y65 HydrophobicContact CB-CE2 4.46Å; V41-Y65 HydrophobicContact CG1-CE2 3.6Å; V41-Y65 HydrophobicContact CG2-CD2 4.33Å; V41-Y65 HydrophobicContact CG2-CE2 4.03Å; V41-L81 HydrophobicContact CG2-CD1 4.11Å; V41-L81 HydrophobicContact CG2-CD2 4.22Å; V41-L86 HydrophobicContact CG1-CD2 4.2Å; V41-L86 WeakPolarHBondContact O-CD2 3.22Å
42	C	75.5	Confident	77.3	Confident	39 Å²	39	71.5 Å²	71.5	26%	0.264	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-1.1	-176.3	65.3	0	0	0	0	114.6	R44 H57 H62	C42-R44 HydrophobicContact CB-CG 4.25Å; C42-R44 PolarHBondContact O-N 3.32Å; C42-H57 PolarHBondContact SG-CE1 3.22Å; C42-H57 PolarHBondContact SG-NE2 3.3Å; C42-H62 PolarHBondContact SG-NE2 2.96Å
43	R	81.1	Confident	77.9	Confident	113 Å²	113	67.3 Å²	67.3	43%	0.426	34%	0.339	S	S	.	.			trans	56.8	15.3	-176.7	-54.8	-64.1	-179.9	172.5	-6.6	114.6	L38 C39 L81	L38-R43 WeakPolarHBondContact CD1-O 3.12Å; C39-R43 WeakPolarHBondContact O-CA 3.37Å; C39-R43 PolarHBondContact O-N 2.93Å; C39-R43 VanDerWaalsContact O-N 3.08Å; R43-L81 PolarHBondContact NH2-O 3.37Å
44	R	81.4	Confident	78.7	Confident	141 Å²	141	59 Å²	59	53%	0.532	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-79.2	137	174.7	-63.9	-179.1	-171.3	155.1	5.6	109.9	C39 C42 I46 E61	C39-R44 PolarHBondContact N-O 3.29Å; C42-R44 HydrophobicContact CB-CG 4.25Å; C42-R44 PolarHBondContact O-N 3.32Å; R44-I46 PolarHBondContact O-N 3.29Å; R44-E61 IonicContact CZ-OE2 3.74Å; R44-E61 IonicContact NH1-OE2 3.6Å; R44-E61 PolarHBondContact NH1-OE2 2.76Å; R44-E61 IonicContact NH2-OE2 2.75Å
45	L	83.9	Confident	79.8	Confident	93 Å²	93	62.8 Å²	62.8	49%	0.487	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	117.1	169.5	-174.3	69.2	0	0	0	108.8	P31	P31-L45 HydrophobicContact CB-CD1 3.95Å; P31-L45 HydrophobicContact CG-CD1 3.88Å
46	I	82.2	Confident	80.4	Confident	22 Å²	22	65.9 Å²	65.9	11%	0.113	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	119.6	172.8	-48.2	168.1	0	0	0	106	V28 G36 A37 C39 R44 A48 V54 H57	V28-I46 HydrophobicContact CG1-CD1 3.89Å; G36-I46 WeakPolarHBondContact CA-O 3.38Å; A37-I46 PolarHBondContact N-O 2.84Å; A37-I46 WeakPolarHBondContact O-CB 3.25Å; A37-I46 PolarHBondContact O-N 3.4Å; C39-I46 HydrophobicContact CB-CD1 4.37Å; R44-I46 PolarHBondContact O-N 3.29Å; I46-A48 HydrophobicContact CB-CB 4.27Å; I46-A48 HydrophobicContact CG2-CB 3.84Å; I46-A48 PolarHBondContact O-N 3.25Å; I46-V54 HydrophobicContact CD1-CB 4.47Å; I46-V54 HydrophobicContact CD1-CG1 4.09Å; I46-V54 HydrophobicContact CG2-CG1 4.49Å; I46-H57 HydrophobicContact CD1-CB 3.9Å; I46-H57 WeakPolarHBondContact CD1-CD2 3.47Å; I46-H57 HydrophobicContact CG1-CB 4.49Å
47	V	74.4	Confident	80.6	Confident	127 Å²	127	66.3 Å²	66.3	77%	0.77	30%	0.299	S	S	*	.			trans	-72.8	66.1	168.7	-170.9	0	0	0	0	107.8
48	A	64.3	Low	80.5	Confident	14 Å²	14	66.4 Å²	66.4	12%	0.116	30%	0.3	C	S	.	.			trans	-86.4	124.1	-174.3	0	0	0	0	0	109.2	A37 I46 D53 V54	A37-A48 HydrophobicContact CB-CB 4.12Å; I46-A48 HydrophobicContact CB-CB 4.27Å; I46-A48 HydrophobicContact CG2-CB 3.84Å; I46-A48 PolarHBondContact O-N 3.25Å; A48-D53 HydrophobicContact CB-CB 4.21Å; A48-V54 HydrophobicContact CB-CG1 3.48Å; A48-V54 VanDerWaalsContact CB-CG1 3.48Å
49	T	63.8	Low	80.4	Confident	64 Å²	64	68.8 Å²	68.8	39%	0.393	31%	0.31	S	S	.	.	S	Bend	trans	-106.7	-16.6	172.6	58.3	0	0	0	0	111.5	L16 D53	L16-T49 HydrophobicContact CD2-CG2 3.78Å; T49-D53 PolarHBondContact N-OD2 2.96Å; T49-D53 PolarHBondContact OG1-OD2 3.49Å
50	R	77.8	Confident	79.9	Confident	119 Å²	119	72.2 Å²	72.2	45%	0.449	34%	0.338	S	S	.	.	S	Bend	trans	-147.9	159.5	-176.9	-59.7	-177.5	-173.3	-173.5	-2.2	111.4	R52 D53	R50-R52 HydrophobicContact CB-CG 4.07Å; R50-R52 PolarHBondContact O-N 3.42Å; R50-R52 VanDerWaalsContact O-N 3.16Å; R50-D53 PolarHBondContact N-OD2 3.06Å; R50-D53 WeakPolarHBondContact O-CB 3.19Å; R50-D53 PolarHBondContact O-N 3.39Å
51	E	83.8	Confident	79.3	Confident	58 Å²	58	77 Å²	77	27%	0.271	36%	0.361	S	S	.	.	H	α-helix	trans	-54.9	-35.6	178.3	-176	171.2	-173.5	0	0	113	W22 R25 Y26 D53 V54 R55	W22-E51 HydrophobicContact CZ2-CB 3.83Å; R25-E51 IonicContact NH1-OE1 2.77Å; Y26-E51 HydrophobicContact CE2-CG 3.64Å; Y26-E51 PolarHBondContact OH-OE1 3.17Å; Y26-E51 VanDerWaalsContact OH-OE1 3.12Å; E51-D53 PolarHBondContact O-N 3.19Å; E51-V54 WeakPolarHBondContact O-CG2 3.45Å; E51-V54 PolarHBondContact O-N 2.97Å; E51-R55 VanDerWaalsContact O-CB 3.22Å; E51-R55 WeakPolarHBondContact O-CB 3.38Å; E51-R55 PolarHBondContact O-N 2.94Å
52	R	81.1	Confident	79.4	Confident	151 Å²	151	77.1 Å²	77.1	57%	0.57	36%	0.36	S	S	*	.	H	α-helix	trans	-58.5	-29.1	176.9	72.8	-174.9	-179.8	-172.2	-3.4	113.5	R50 R56	R50-R52 HydrophobicContact CB-CG 4.07Å; R50-R52 PolarHBondContact O-N 3.42Å; R50-R52 VanDerWaalsContact O-N 3.16Å; R52-R56 WeakPolarHBondContact O-CB 3.08Å; R52-R56 PolarHBondContact O-N 3.16Å
53	D	82.9	Confident	79.4	Confident	45 Å²	45	81.6 Å²	81.6	24%	0.241	38%	0.377	C	S	.	.	H	α-helix	trans	-77.4	-44.8	-175.1	-53.2	-33.7	0	0	0	110	A48 T49 R50 E51 H57	A48-D53 HydrophobicContact CB-CB 4.21Å; T49-D53 PolarHBondContact N-OD2 2.96Å; T49-D53 PolarHBondContact OG1-OD2 3.49Å; R50-D53 PolarHBondContact N-OD2 3.06Å; R50-D53 WeakPolarHBondContact O-CB 3.19Å; R50-D53 PolarHBondContact O-N 3.39Å; E51-D53 PolarHBondContact O-N 3.19Å; D53-H57 PolarHBondContact O-N 3.18Å
54	V	86.4	Confident	78.7	Confident	0 Å²	0	80.6 Å²	80.6	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-69	-37.4	173.7	-65.4	0	0	0	0	111.9	W22 Y26 V28 A37 I46 A48 E51 H57 Y58	W22-V54 HydrophobicContact CD2-CG2 3.97Å; W22-V54 HydrophobicContact CE3-CG1 4.21Å; W22-V54 HydrophobicContact CE3-CG2 4.05Å; W22-V54 HydrophobicContact CG-CG2 4.28Å; W22-V54 HydrophobicContact CZ3-CG1 4.4Å; W22-V54 HydrophobicContact CZ3-CG2 4.49Å; Y26-V54 HydrophobicContact CD2-CG2 3.73Å; Y26-V54 HydrophobicContact CE2-CG2 4.3Å; Y26-V54 HydrophobicContact CG-CG2 4.23Å; V28-V54 HydrophobicContact CG2-CG1 4.37Å; A37-V54 HydrophobicContact CB-CG1 3.69Å; I46-V54 HydrophobicContact CD1-CB 4.47Å; I46-V54 HydrophobicContact CD1-CG1 4.09Å; I46-V54 HydrophobicContact CG2-CG1 4.49Å; A48-V54 HydrophobicContact CB-CG1 3.48Å; A48-V54 VanDerWaalsContact CB-CG1 3.48Å; E51-V54 WeakPolarHBondContact O-CG2 3.45Å; E51-V54 PolarHBondContact O-N 2.97Å; V54-H57 PolarHBondContact O-N 2.91Å; V54-Y58 WeakPolarHBondContact O-CB 3.47Å; V54-Y58 PolarHBondContact O-N 3.12Å
55	R	87.6	Confident	78.3	Confident	122 Å²	122	74.5 Å²	74.5	46%	0.46	35%	0.351	S	S	.	.	H	α-helix	trans	-62.6	-48.2	175.3	-179	175	-167.5	160.7	7.2	111.9	Y26 E51 H57 Y58 E59	Y26-R55 HydrophobicContact CD1-CB 4.24Å; Y26-R55 HydrophobicContact CD1-CG 4.48Å; Y26-R55 HydrophobicContact CE1-CB 3.73Å; Y26-R55 HydrophobicContact CE1-CG 3.71Å; E51-R55 VanDerWaalsContact O-CB 3.22Å; E51-R55 WeakPolarHBondContact O-CB 3.38Å; E51-R55 PolarHBondContact O-N 2.94Å; R55-H57 VanDerWaalsContact C-N 3.3Å; R55-H57 PolarHBondContact O-N 2.79Å; R55-Y58 PolarHBondContact O-N 2.87Å; R55-Y58 VanDerWaalsContact O-N 3.13Å; R55-E59 HydrophobicContact CG-CG 4.27Å; R55-E59 VanDerWaalsContact CG-OE1 3.31Å; R55-E59 WeakPolarHBondContact CG-OE1 3.4Å; R55-E59 IonicContact CZ-OE1 3.92Å; R55-E59 IonicContact NE-OE1 2.87Å; R55-E59 PolarHBondContact NE-OE1 3.43Å; R55-E59 IonicContact NH2-OE1 3.36Å; R55-E59 WeakPolarHBondContact O-CB 3.33Å; R55-E59 WeakPolarHBondContact O-CG 3.46Å; R55-E59 PolarHBondContact O-N 3.42Å
56	R	85.1	Confident	77.9	Confident	198 Å²	198	74.7 Å²	74.7	75%	0.747	35%	0.35	S	S	*	.	H	α-helix	trans	-60.8	-40.2	178.7	-174.3	-179.8	-176	-175.6	1.7	111.9	R52 A60	R52-R56 WeakPolarHBondContact O-CB 3.08Å; R52-R56 PolarHBondContact O-N 3.16Å; R56-A60 WeakPolarHBondContact O-CB 3.29Å; R56-A60 PolarHBondContact O-N 3.49Å
57	H	84.2	Confident	77.4	Confident	29 Å²	29	80.3 Å²	80.3	13%	0.134	37%	0.369	C	S	.	.	H	α-helix	trans	-63.1	-46.5	173.5	170.6	71	0	0	0	111.7	C39 C42 I46 D53 V54 R55 A60 E61 H62	C39-H57 PolarHBondContact SG-NE2 3.28Å; C39-H57 VanDerWaalsContact SG-NE2 3.42Å; C42-H57 PolarHBondContact SG-CE1 3.22Å; C42-H57 PolarHBondContact SG-NE2 3.3Å; I46-H57 HydrophobicContact CD1-CB 3.9Å; I46-H57 WeakPolarHBondContact CD1-CD2 3.47Å; I46-H57 HydrophobicContact CG1-CB 4.49Å; D53-H57 PolarHBondContact O-N 3.18Å; V54-H57 PolarHBondContact O-N 2.91Å; R55-H57 VanDerWaalsContact C-N 3.3Å; R55-H57 PolarHBondContact O-N 2.79Å; H57-A60 PolarHBondContact O-N 3.46Å; H57-E61 WeakPolarHBondContact O-CB 3.19Å; H57-E61 PolarHBondContact O-N 3.03Å; H57-H62 AromaticContact CE1-NE2 3.81Å; H57-H62 AromaticContact NE2-CD2 3.5Å; H57-H62 AromaticContact NE2-NE2 3.39Å; H57-H62 PolarHBondContact NE2-NE2 3.43Å
58	Y	84	Confident	77.2	Confident	2 Å²	2	76.3 Å²	76.3	1%	0.008	34%	0.341	C	S	.	.	H	α-helix	trans	-62.9	-46.6	-180	178.1	-93	0	0	0	112.3	Y26 L27 V54 R55 A60 H62 E63 E66 R74	Y26-Y58 HydrophobicContact CD1-CD1 4.09Å; Y26-Y58 HydrophobicContact CD1-CG 4.06Å; Y26-Y58 WeakPolarHBondContact O-CD2 3.43Å; L27-Y58 HydrophobicContact CD1-CE2 3.94Å; L27-Y58 HydrophobicContact CG-CE2 4Å; V54-Y58 WeakPolarHBondContact O-CB 3.47Å; V54-Y58 PolarHBondContact O-N 3.12Å; R55-Y58 PolarHBondContact O-N 2.87Å; R55-Y58 VanDerWaalsContact O-N 3.13Å; Y58-A60 PolarHBondContact O-N 3.31Å; Y58-H62 HydrophobicContact CD2-CB 3.9Å; Y58-H62 HydrophobicContact CE2-CB 4.2Å; Y58-H62 HydrophobicContact CG-CB 4.5Å; Y58-H62 CarbonylContact O-C 2.81Å; Y58-H62 WeakPolarHBondContact O-CA 3.46Å; Y58-H62 WeakPolarHBondContact O-CB 3.32Å; Y58-H62 PolarHBondContact O-N 3.24Å; Y58-E63 PolarHBondContact O-N 3.39Å; Y58-E66 HydrophobicContact CE1-CG 4.07Å; Y58-E66 WeakPolarHBondContact CE1-OE1 3.28Å; Y58-E66 PolarHBondContact OH-N 3.3Å; Y58-R74 PolarHBondContact OH-NH1 3.43Å; Y58-R74 PolarHBondContact OH-NH2 3.45Å
59	E	83.4	Confident	77.4	Confident	91 Å²	91	79.5 Å²	79.5	43%	0.425	36%	0.359	S	S	.	.	H	α-helix	trans	-66.3	-35.8	177.8	-70.4	170	175.1	0	0	112	R55	R55-E59 HydrophobicContact CG-CG 4.27Å; R55-E59 VanDerWaalsContact CG-OE1 3.31Å; R55-E59 WeakPolarHBondContact CG-OE1 3.4Å; R55-E59 IonicContact CZ-OE1 3.92Å; R55-E59 IonicContact NE-OE1 2.87Å; R55-E59 PolarHBondContact NE-OE1 3.43Å; R55-E59 IonicContact NH2-OE1 3.36Å; R55-E59 WeakPolarHBondContact O-CB 3.33Å; R55-E59 WeakPolarHBondContact O-CG 3.46Å; R55-E59 PolarHBondContact O-N 3.42Å
60	A	76.1	Confident	77.6	Confident	73 Å²	73	79.2 Å²	79.2	60%	0.603	36%	0.363	S	S	*	.	H	α-helix	trans	-75.6	-36.3	-180	0	0	0	0	0	113.8	R56 H57 Y58	R56-A60 WeakPolarHBondContact O-CB 3.29Å; R56-A60 PolarHBondContact O-N 3.49Å; H57-A60 PolarHBondContact O-N 3.46Å; Y58-A60 PolarHBondContact O-N 3.31Å
61	E	69	Low	76.4	Confident	103 Å²	103	82.1 Å²	82.1	48%	0.481	39%	0.387	S	S	.	.	H	α-helix	trans	-115.9	-21.5	-167.9	-55.9	-80.8	130.1	0	0	113.3	R44 H57	R44-E61 IonicContact CZ-OE2 3.74Å; R44-E61 IonicContact NH1-OE2 3.6Å; R44-E61 PolarHBondContact NH1-OE2 2.76Å; R44-E61 IonicContact NH2-OE2 2.75Å; H57-E61 WeakPolarHBondContact O-CB 3.19Å; H57-E61 PolarHBondContact O-N 3.03Å
62	H	78.9	Confident	75.3	Confident	16 Å²	16	82 Å²	82	7%	0.074	40%	0.401	C	S	.	.			trans	-138.2	16.9	-164	-59.1	-33.7	0	0	0	114.1	C39 C42 H57 Y58 Y64 Y65	C39-H62 VanDerWaalsContact SG-CD2 3.55Å; C39-H62 PolarHBondContact SG-NE2 3.39Å; C39-H62 VanDerWaalsContact SG-NE2 3.43Å; C42-H62 PolarHBondContact SG-NE2 2.96Å; H57-H62 AromaticContact CE1-NE2 3.81Å; H57-H62 AromaticContact NE2-CD2 3.5Å; H57-H62 AromaticContact NE2-NE2 3.39Å; H57-H62 PolarHBondContact NE2-NE2 3.43Å; Y58-H62 HydrophobicContact CD2-CB 3.9Å; Y58-H62 HydrophobicContact CE2-CB 4.2Å; Y58-H62 HydrophobicContact CG-CB 4.5Å; Y58-H62 CarbonylContact O-C 2.81Å; Y58-H62 WeakPolarHBondContact O-CA 3.46Å; Y58-H62 WeakPolarHBondContact O-CB 3.32Å; Y58-H62 PolarHBondContact O-N 3.24Å; H62-Y64 PolarHBondContact O-N 3.47Å; H62-Y64 VanDerWaalsContact O-N 3.08Å; H62-Y65 HydrophobicContact CB-CD2 4.04Å; H62-Y65 HydrophobicContact CB-CE2 4.49Å; H62-Y65 WeakPolarHBondContact O-CD2 3.34Å; H62-Y65 PolarHBondContact O-N 3.01Å
63	E	76	Confident	74.8	Confident	133 Å²	133	79.8 Å²	79.8	62%	0.621	40%	0.397	S	S	*	.	G	3₁₀ helix	trans	-54.5	-31.4	178.7	-172.9	176.9	-151.3	0	0	112.5	Y58 Y65 E66	Y58-E63 PolarHBondContact O-N 3.39Å; E63-Y65 PolarHBondContact O-N 3.42Å; E63-E66 WeakPolarHBondContact O-CB 3.32Å; E63-E66 PolarHBondContact O-N 3.13Å
64	Y	65.9	Low	74.7	Confident	91 Å²	91	78.5 Å²	78.5	36%	0.357	39%	0.389	S	S	.	.	G	3₁₀ helix	trans	-45.7	-33.6	173.8	177.1	-81.9	0	0	0	113.7	H62 E66 R67 Y68 V88	H62-Y64 PolarHBondContact O-N 3.47Å; H62-Y64 VanDerWaalsContact O-N 3.08Å; Y64-E66 VanDerWaalsContact C-N 3.33Å; Y64-E66 PolarHBondContact O-N 3.4Å; Y64-R67 VanDerWaalsContact CZ-NH1 3.26Å; Y64-R67 VanDerWaalsContact CZ-NH2 3.32Å; Y64-R67 PolarHBondContact O-NE 3.37Å; Y64-R67 PolarHBondContact OH-NH1 3.01Å; Y64-R67 VanDerWaalsContact OH-NH1 3.07Å; Y64-Y68 HydrophobicContact CE1-CE2 4.35Å; Y64-V88 HydrophobicContact CD1-CG2 4.21Å; Y64-V88 HydrophobicContact CE1-CG2 3.82Å
65	Y	72.8	Confident	74.4	Confident	13 Å²	13	80.8 Å²	80.8	5%	0.051	41%	0.408	C	S	.	.	G	3₁₀ helix	trans	-80.8	-6.1	-175.7	-65.2	-82.3	0	0	0	114.4	L27 V41 H62 E63 R67 Y68 R74 L77 P87 V88	L27-Y65 HydrophobicContact CD1-CD1 4.34Å; L27-Y65 HydrophobicContact CD1-CD2 4.28Å; L27-Y65 HydrophobicContact CD1-CG 3.87Å; V41-Y65 HydrophobicContact CB-CE2 4.46Å; V41-Y65 HydrophobicContact CG1-CE2 3.6Å; V41-Y65 HydrophobicContact CG2-CD2 4.33Å; V41-Y65 HydrophobicContact CG2-CE2 4.03Å; H62-Y65 HydrophobicContact CB-CD2 4.04Å; H62-Y65 HydrophobicContact CB-CE2 4.49Å; H62-Y65 WeakPolarHBondContact O-CD2 3.34Å; H62-Y65 PolarHBondContact O-N 3.01Å; E63-Y65 PolarHBondContact O-N 3.42Å; Y65-R67 PolarHBondContact O-N 3.5Å; Y65-R67 VanDerWaalsContact O-N 3.13Å; Y65-Y68 AromaticContact CD1-CD2 3.91Å; Y65-Y68 HydrophobicContact CD1-CD2 3.91Å; Y65-Y68 AromaticContact CD1-CE2 3.75Å; Y65-Y68 HydrophobicContact CD1-CE2 3.75Å; Y65-Y68 HydrophobicContact CE1-CE2 4.4Å; Y65-Y68 WeakPolarHBondContact O-CD2 3.33Å; Y65-Y68 PolarHBondContact O-N 3.06Å; Y65-Y68 VanDerWaalsContact O-N 3.12Å; Y65-R74 PolarHBondContact O-NH1 3.4Å; Y65-L77 HydrophobicContact CD1-CD2 4.08Å; Y65-P87 HydrophobicContact CD1-CG 4.44Å; Y65-P87 HydrophobicContact CE1-CB 3.99Å; Y65-P87 HydrophobicContact CE1-CG 3.78Å; Y65-V88 HydrophobicContact CE1-CG2 4.21Å; Y65-V88 VanDerWaalsContact OH-CG2 3.26Å; Y65-V88 WeakPolarHBondContact OH-CG2 3.49Å
66	E	75.9	Confident	73.9	Confident	98 Å²	98	77.5 Å²	77.5	46%	0.458	41%	0.407	S	S	.	.	G	3₁₀ helix	trans	-55.1	-26.8	172	-83.1	-69.8	142.2	0	0	112.7	Y58 E63 Y64 Y68 V69	Y58-E66 HydrophobicContact CE1-CG 4.07Å; Y58-E66 WeakPolarHBondContact CE1-OE1 3.28Å; Y58-E66 PolarHBondContact OH-N 3.3Å; E63-E66 WeakPolarHBondContact O-CB 3.32Å; E63-E66 PolarHBondContact O-N 3.13Å; Y64-E66 VanDerWaalsContact C-N 3.33Å; Y64-E66 PolarHBondContact O-N 3.4Å; E66-Y68 PolarHBondContact O-N 2.91Å; E66-V69 WeakPolarHBondContact O-CB 3.31Å; E66-V69 WeakPolarHBondContact O-CG2 3.19Å; E66-V69 PolarHBondContact O-N 3.49Å
67	R	71.3	Confident	73.5	Confident	139 Å²	139	68 Å²	68	53%	0.525	37%	0.371	S	S	.	.	G	3₁₀ helix	trans	-58.1	-22.4	176.7	75.7	-176.4	73.1	-152.8	-14.3	114.7	Y64 Y65 V69	Y64-R67 VanDerWaalsContact CZ-NH1 3.26Å; Y64-R67 VanDerWaalsContact CZ-NH2 3.32Å; Y64-R67 PolarHBondContact O-NE 3.37Å; Y64-R67 PolarHBondContact OH-NH1 3.01Å; Y64-R67 VanDerWaalsContact OH-NH1 3.07Å; Y65-R67 PolarHBondContact O-N 3.5Å; Y65-R67 VanDerWaalsContact O-N 3.13Å; R67-V69 VanDerWaalsContact C-N 3.35Å
68	Y	70.9	Confident	73.4	Confident	44 Å²	44	66.7 Å²	66.7	17%	0.173	37%	0.365	C	S	.	.	G	3₁₀ helix	trans	-94.4	16.7	-175.7	-59.5	-73.5	0	0	0	113.3	Y64 Y65 E66 A70 R74 L77	Y64-Y68 HydrophobicContact CE1-CE2 4.35Å; Y65-Y68 AromaticContact CD1-CD2 3.91Å; Y65-Y68 HydrophobicContact CD1-CD2 3.91Å; Y65-Y68 AromaticContact CD1-CE2 3.75Å; Y65-Y68 HydrophobicContact CD1-CE2 3.75Å; Y65-Y68 HydrophobicContact CE1-CE2 4.4Å; Y65-Y68 WeakPolarHBondContact O-CD2 3.33Å; Y65-Y68 PolarHBondContact O-N 3.06Å; Y65-Y68 VanDerWaalsContact O-N 3.12Å; E66-Y68 PolarHBondContact O-N 2.91Å; Y68-A70 PolarHBondContact O-N 2.91Å; Y68-R74 WeakPolarHBondContact O-CA 3.45Å; Y68-R74 VanDerWaalsContact O-CB 3.29Å; Y68-R74 WeakPolarHBondContact O-CB 3.44Å; Y68-R74 PolarHBondContact O-N 3.2Å; Y68-R74 VanDerWaalsContact O-N 3.17Å; Y68-L77 HydrophobicContact CD2-CD1 4.12Å; Y68-L77 HydrophobicContact CD2-CD2 3.85Å; Y68-L77 HydrophobicContact CE2-CD1 4.35Å; Y68-L77 HydrophobicContact CG-CD1 4.24Å; Y68-L77 HydrophobicContact CG-CD2 4.05Å
69	V	69.2	Low	73.3	Confident	81 Å²	81	70.8 Å²	70.8	49%	0.491	38%	0.384	S	S	.	.			trans	-75.5	-10.5	-176.5	171.3	0	0	0	0	112.9	E66 R67	E66-V69 WeakPolarHBondContact O-CB 3.31Å; E66-V69 WeakPolarHBondContact O-CG2 3.19Å; E66-V69 PolarHBondContact O-N 3.49Å; R67-V69 VanDerWaalsContact C-N 3.35Å
70	A	66.3	Low	72.7	Confident	58 Å²	58	71.4 Å²	71.4	48%	0.479	38%	0.382	S	S	.	.	S	Bend	trans	-59.5	141.9	175.4	0	0	0	0	0	112.6	Y68 G72 E73	Y68-A70 PolarHBondContact O-N 2.91Å; A70-G72 PolarHBondContact O-N 3.32Å; A70-E73 PolarHBondContact O-N 3.17Å; A70-E73 VanDerWaalsContact O-N 3.16Å
71	D	53.6	Low	72.7	Confident	180 Å²	180	67.9 Å²	67.9	96%	0.963	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	110.9	-172.5	-82.7	-30.5	0	0	0	112.2
72	G	61.3	Low	73.3	Confident	54 Å²	54	69 Å²	69	56%	0.557	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	111.7	-34.4	177.7	0	0	0	0	0	114.9	A70 A76	A70-G72 PolarHBondContact O-N 3.32Å; G72-A76 PolarHBondContact O-N 2.84Å
73	E	69.8	Low	73.1	Confident	105 Å²	105	75.2 Å²	75.2	49%	0.491	38%	0.382	S	S	.	.	H	α-helix	trans	-72.6	-35.3	-177.4	-65.5	-169.2	170.8	0	0	112.3	A70 A76 L77	A70-E73 PolarHBondContact O-N 3.17Å; A70-E73 VanDerWaalsContact O-N 3.16Å; E73-A76 PolarHBondContact O-N 3.13Å; E73-L77 WeakPolarHBondContact O-CB 3.49Å; E73-L77 PolarHBondContact O-N 3.01Å
74	R	80.3	Confident	72.4	Confident	18 Å²	18	70.8 Å²	70.8	7%	0.068	37%	0.372	C	S	.	.	H	α-helix	trans	-65.1	-42.1	179.1	-161.2	67.1	172.7	-175.8	-6.2	112.7	Q24 R25 Y58 Y65 Y68 L77 V78	Q24-R74 PolarHBondContact O-NE 2.75Å; Q24-R74 PolarHBondContact O-NH2 3.04Å; R25-R74 PolarHBondContact O-NH2 3.46Å; Y58-R74 PolarHBondContact OH-NH1 3.43Å; Y58-R74 PolarHBondContact OH-NH2 3.45Å; Y65-R74 PolarHBondContact O-NH1 3.4Å; Y68-R74 WeakPolarHBondContact O-CA 3.45Å; Y68-R74 VanDerWaalsContact O-CB 3.29Å; Y68-R74 WeakPolarHBondContact O-CB 3.44Å; Y68-R74 PolarHBondContact O-N 3.2Å; Y68-R74 VanDerWaalsContact O-N 3.17Å; R74-L77 VanDerWaalsContact O-CB 3.27Å; R74-L77 WeakPolarHBondContact O-CB 3.34Å; R74-L77 PolarHBondContact O-N 3.38Å; R74-V78 WeakPolarHBondContact O-CG2 3.47Å; R74-V78 PolarHBondContact O-N 3.03Å
75	A	80.3	Confident	71.9	Confident	49 Å²	49	71.3 Å²	71.3	41%	0.405	38%	0.382	S	S	.	.	H	α-helix	trans	-66.3	-41.7	178.7	0	0	0	0	0	111.1	L77 V78 E79	A75-L77 VanDerWaalsContact C-N 3.33Å; A75-L77 PolarHBondContact O-N 3.49Å; A75-V78 PolarHBondContact O-N 3.26Å; A75-E79 PolarHBondContact O-N 3.17Å; A75-E79 VanDerWaalsContact O-N 3.13Å
76	A	77.3	Confident	71	Confident	52 Å²	52	74.1 Å²	74.1	43%	0.43	40%	0.397	S	S	.	.	H	α-helix	trans	-64.2	-37.5	173.7	0	0	0	0	0	112.2	G72 E73 E79 R80	G72-A76 PolarHBondContact O-N 2.84Å; E73-A76 PolarHBondContact O-N 3.13Å; A76-E79 PolarHBondContact O-N 3.4Å; A76-R80 VanDerWaalsContact O-CG 3.32Å; A76-R80 WeakPolarHBondContact O-CG 3.22Å; A76-R80 PolarHBondContact O-N 2.75Å
77	L	76.6	Confident	69.5	Low	0 Å²	0	70.5 Å²	70.5	0%	0	38%	0.382	C	S	.	.	H	α-helix	trans	-58.8	-48.6	174.1	-167.2	74.4	0	0	0	112	L27 Y65 Y68 E73 R74 A75 R80 L81 P87	L27-L77 HydrophobicContact CD1-CD2 4.04Å; L27-L77 HydrophobicContact CD2-CD2 4.01Å; Y65-L77 HydrophobicContact CD1-CD2 4.08Å; Y68-L77 HydrophobicContact CD2-CD1 4.12Å; Y68-L77 HydrophobicContact CD2-CD2 3.85Å; Y68-L77 HydrophobicContact CE2-CD1 4.35Å; Y68-L77 HydrophobicContact CG-CD1 4.24Å; Y68-L77 HydrophobicContact CG-CD2 4.05Å; E73-L77 WeakPolarHBondContact O-CB 3.49Å; E73-L77 PolarHBondContact O-N 3.01Å; R74-L77 VanDerWaalsContact O-CB 3.27Å; R74-L77 WeakPolarHBondContact O-CB 3.34Å; R74-L77 PolarHBondContact O-N 3.38Å; A75-L77 VanDerWaalsContact C-N 3.33Å; A75-L77 PolarHBondContact O-N 3.49Å; L77-R80 PolarHBondContact O-N 2.89Å; L77-L81 HydrophobicContact CG-CD1 4.05Å; L77-L81 VanDerWaalsContact O-CB 3.29Å; L77-L81 WeakPolarHBondContact O-CB 3.29Å; L77-L81 VanDerWaalsContact O-CG 3.28Å; L77-L81 WeakPolarHBondContact O-CG 3.42Å; L77-L81 PolarHBondContact O-N 2.81Å; L77-P87 HydrophobicContact CD1-CB 3.3Å; L77-P87 HydrophobicContact CD1-CG 3.08Å; L77-P87 HydrophobicContact CG-CG 3.89Å
78	V	81.9	Confident	68.4	Low	0 Å²	0	66.3 Å²	66.3	0%	0	37%	0.372	C	S	.	.	H	α-helix	trans	-61.5	-44.2	179.6	166.2	0	0	0	0	111.3	T23 L27 L40 R74 A75 L81 R82	T23-V78 HydrophobicContact CG2-CG1 3.45Å; T23-V78 VanDerWaalsContact CG2-CG1 3.45Å; T23-V78 HydrophobicContact CG2-CG2 4.26Å; T23-V78 WeakPolarHBondContact O-CG2 3.37Å; L27-V78 HydrophobicContact CD2-CG2 3.8Å; L40-V78 HydrophobicContact CD1-CG1 4.33Å; R74-V78 WeakPolarHBondContact O-CG2 3.47Å; R74-V78 PolarHBondContact O-N 3.03Å; A75-V78 PolarHBondContact O-N 3.26Å; V78-L81 PolarHBondContact O-N 2.88Å; V78-R82 WeakPolarHBondContact O-CG 3.26Å; V78-R82 PolarHBondContact O-N 2.79Å
79	E	81.9	Confident	67.3	Low	88 Å²	88	67 Å²	67	41%	0.411	39%	0.386	S	S	.	.	H	α-helix	trans	-67	-40.8	179.6	-71.7	-56.6	124.6	0	0	112.4	A75 A76 R82 Q83	A75-E79 PolarHBondContact O-N 3.17Å; A75-E79 VanDerWaalsContact O-N 3.13Å; A76-E79 PolarHBondContact O-N 3.4Å; E79-R82 PolarHBondContact O-N 3.05Å; E79-R82 IonicContact OE1-CZ 3.7Å; E79-R82 IonicContact OE1-NE 3.99Å; E79-R82 IonicContact OE1-NH1 2.76Å; E79-R82 PolarHBondContact OE1-NH1 2.9Å; E79-Q83 WeakPolarHBondContact O-CG 3.37Å; E79-Q83 PolarHBondContact O-N 2.88Å
80	R	71.4	Confident	66.8	Low	104 Å²	104	66.9 Å²	66.9	39%	0.392	39%	0.389	S	S	.	.	H	α-helix	trans	-60.7	-46.4	172.6	-70.7	-175.5	-54.9	174.4	1.3	112	A76 L77 R82 Q83 G84 D85	A76-R80 VanDerWaalsContact O-CG 3.32Å; A76-R80 WeakPolarHBondContact O-CG 3.22Å; A76-R80 PolarHBondContact O-N 2.75Å; L77-R80 PolarHBondContact O-N 2.89Å; R80-R82 VanDerWaalsContact C-N 3.31Å; R80-R82 PolarHBondContact O-N 3.26Å; R80-Q83 WeakPolarHBondContact O-CB 3.27Å; R80-Q83 PolarHBondContact O-N 3.34Å; R80-G84 PolarHBondContact O-N 2.88Å; R80-D85 CarbonylContact C-O 3.4Å; R80-D85 HydrophobicContact CB-CB 4.24Å; R80-D85 PolarHBondContact O-N 3.35Å
81	L	76.9	Confident	66.7	Low	0 Å²	0	65.6 Å²	65.6	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-62.2	-36.1	178.1	-82	171.6	0	0	0	112.8	L27 L40 V41 R43 L77 V78 Q83 G84 D85 L86 P87	L27-L81 HydrophobicContact CB-CD1 4.41Å; L27-L81 HydrophobicContact CD1-CD1 4.01Å; L27-L81 HydrophobicContact CD2-CD1 4.09Å; L27-L81 HydrophobicContact CG-CD1 4.4Å; L40-L81 HydrophobicContact CB-CB 3.98Å; L40-L81 HydrophobicContact CB-CD1 4.32Å; L40-L81 HydrophobicContact CD1-CB 4.25Å; V41-L81 HydrophobicContact CG2-CD1 4.11Å; V41-L81 HydrophobicContact CG2-CD2 4.22Å; R43-L81 PolarHBondContact NH2-O 3.37Å; L77-L81 HydrophobicContact CG-CD1 4.05Å; L77-L81 VanDerWaalsContact O-CB 3.29Å; L77-L81 WeakPolarHBondContact O-CB 3.29Å; L77-L81 VanDerWaalsContact O-CG 3.28Å; L77-L81 WeakPolarHBondContact O-CG 3.42Å; L77-L81 PolarHBondContact O-N 2.81Å; V78-L81 PolarHBondContact O-N 2.88Å; L81-Q83 VanDerWaalsContact C-N 3.3Å; L81-Q83 PolarHBondContact O-N 2.95Å; L81-G84 PolarHBondContact O-N 2.89Å; L81-D85 PolarHBondContact N-O 3.49Å; L81-L86 HydrophobicContact CD2-CD2 3.81Å; L81-P87 HydrophobicContact CD1-CG 4.24Å; L81-P87 HydrophobicContact CD2-CG 4Å; L81-P87 HydrophobicContact CG-CG 3.89Å
82	R	81.7	Confident	67.8	Low	126 Å²	126	59.7 Å²	59.7	48%	0.475	35%	0.345	S	S	.	.	H	α-helix	trans	-63.9	-36.1	172.9	-79.2	173.9	171	178.8	-6.9	112.3	L40 V78 E79 R80 G84	L40-R82 HydrophobicContact CD1-CG 4.3Å; L40-R82 HydrophobicContact CD2-CG 4.12Å; V78-R82 WeakPolarHBondContact O-CG 3.26Å; V78-R82 PolarHBondContact O-N 2.79Å; E79-R82 PolarHBondContact O-N 3.05Å; E79-R82 IonicContact OE1-CZ 3.7Å; E79-R82 IonicContact OE1-NE 3.99Å; E79-R82 IonicContact OE1-NH1 2.76Å; E79-R82 PolarHBondContact OE1-NH1 2.9Å; R80-R82 VanDerWaalsContact C-N 3.31Å; R80-R82 PolarHBondContact O-N 3.26Å; R82-G84 PolarHBondContact O-N 2.89Å
83	Q	74.3	Confident	68.6	Low	146 Å²	146	61.7 Å²	61.7	68%	0.682	35%	0.348	S	S	*	.	H	α-helix	trans	-77.2	-6.5	178.6	-67.5	173.4	8.4	0	0	113.8	E79 R80 L81	E79-Q83 WeakPolarHBondContact O-CG 3.37Å; E79-Q83 PolarHBondContact O-N 2.88Å; R80-Q83 WeakPolarHBondContact O-CB 3.27Å; R80-Q83 PolarHBondContact O-N 3.34Å; L81-Q83 VanDerWaalsContact C-N 3.3Å; L81-Q83 PolarHBondContact O-N 2.95Å
84	G	61.2	Low	69.2	Low	40 Å²	40	63.1 Å²	63.1	41%	0.412	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	101.6	-8.6	-178.8	0	0	0	0	0	114.2	R80 L81 R82 L86	R80-G84 PolarHBondContact O-N 2.88Å; L81-G84 PolarHBondContact O-N 2.89Å; R82-G84 PolarHBondContact O-N 2.89Å; G84-L86 PolarHBondContact O-N 3.11Å
85	D	54.6	Low	69.3	Low	103 Å²	103	63.3 Å²	63.3	55%	0.551	36%	0.356	S	S	*	.			trans	-82.5	105.7	-178.8	-78.8	-20.5	0	0	0	110.4	R80 L81	R80-D85 CarbonylContact C-O 3.4Å; R80-D85 HydrophobicContact CB-CB 4.24Å; R80-D85 PolarHBondContact O-N 3.35Å; L81-D85 PolarHBondContact N-O 3.49Å
86	L	53.6	Low	69.4	Low	72 Å²	72	67.7 Å²	67.7	38%	0.377	36%	0.362	S	S	.	.			trans	-71.8	130.8	173.4	-75.4	162.1	0	0	0	110	V41 L81 G84 V88	V41-L86 HydrophobicContact CG1-CD2 4.2Å; V41-L86 WeakPolarHBondContact O-CD2 3.22Å; L81-L86 HydrophobicContact CD2-CD2 3.81Å; G84-L86 PolarHBondContact O-N 3.11Å; L86-V88 WeakPolarHBondContact CB-O 3.45Å; L86-V88 CarbonylContact O-C 3.57Å; L86-V88 PolarHBondContact O-N 3.1Å
87	P	45.4	Very low	69.8	Low	21 Å²	21	65.5 Å²	65.5	14%	0.136	34%	0.344	C	S	.	.	S	Bend	trans	-81.1	-0.2	-180	-0.8	16.8	0	0	0	113.6	Y65 L77 L81	Y65-P87 HydrophobicContact CD1-CG 4.44Å; Y65-P87 HydrophobicContact CE1-CB 3.99Å; Y65-P87 HydrophobicContact CE1-CG 3.78Å; L77-P87 HydrophobicContact CD1-CB 3.3Å; L77-P87 HydrophobicContact CD1-CG 3.08Å; L77-P87 HydrophobicContact CG-CG 3.89Å; L81-P87 HydrophobicContact CD1-CG 4.24Å; L81-P87 HydrophobicContact CD2-CG 4Å; L81-P87 HydrophobicContact CG-CG 3.89Å
88	V	47.4	Very low	70.2	Confident	52 Å²	52	65.9 Å²	65.9	32%	0.315	35%	0.347	S	S	.	.	S	Bend	trans	-102.5	112.8	153.9	174.8	0	0	0	0	102.6	Y64 Y65 L86 S90	Y64-V88 HydrophobicContact CD1-CG2 4.21Å; Y64-V88 HydrophobicContact CE1-CG2 3.82Å; Y65-V88 HydrophobicContact CE1-CG2 4.21Å; Y65-V88 VanDerWaalsContact OH-CG2 3.26Å; Y65-V88 WeakPolarHBondContact OH-CG2 3.49Å; L86-V88 WeakPolarHBondContact CB-O 3.45Å; L86-V88 CarbonylContact O-C 3.57Å; L86-V88 PolarHBondContact O-N 3.1Å; V88-S90 PolarHBondContact O-N 3.38Å
89	A	49.4	Very low	70.5	Confident	58 Å²	58	70 Å²	70	48%	0.479	36%	0.363	S	S	.	.			trans	-47.6	114.3	167.9	0	0	0	0	0	106.1	L91	A89-L91 PolarHBondContact O-N 3.46Å
90	S	57.2	Low	70.8	Confident	78 Å²	78	67.9 Å²	67.9	55%	0.545	36%	0.361	S	S	.	.			trans	-56.7	113.3	174.2	58.9	0	0	0	0	104.9	V88 T92	V88-S90 PolarHBondContact O-N 3.38Å; S90-T92 PolarHBondContact O-N 2.9Å; S90-T92 VanDerWaalsContact O-N 3.11Å
91	L	64.6	Low	71.7	Confident	32 Å²	32	63 Å²	63	17%	0.168	34%	0.342	C	S	.	.			trans	-48.7	128.5	-176	-70	170.5	0	0	0	107.6	A89 E95 R96 V599	A89-L91 PolarHBondContact O-N 3.46Å; L91-E95 WeakPolarHBondContact CA-OE2 3.34Å; L91-E95 HydrophobicContact CB-CB 3.91Å; L91-E95 HydrophobicContact CD2-CB 3.89Å; L91-E95 HydrophobicContact CG-CB 4.45Å; L91-R96 HydrophobicContact CB-CG 3.6Å; L91-R96 HydrophobicContact CD1-CG 4.35Å; L91-R96 PolarHBondContact O-NE 3.4Å; L91-R96 PolarHBondContact O-NH2 3.22Å; L91-V599 HydrophobicContact CD2-CG1 4.4Å
92	T	76.8	Confident	72.4	Confident	56 Å²	56	63.4 Å²	63.4	34%	0.344	34%	0.344	S	S	.	.			trans	-58.5	159.6	176	78.3	0	0	0	0	109	S90 E94 E95 R96	S90-T92 PolarHBondContact O-N 2.9Å; S90-T92 VanDerWaalsContact O-N 3.11Å; T92-E94 WeakPolarHBondContact CB-OE2 3.46Å; T92-E94 PolarHBondContact O-N 2.92Å; T92-E94 PolarHBondContact OG1-N 3.09Å; T92-E94 PolarHBondContact OG1-OE2 2.92Å; T92-E95 HydrophobicContact CG2-CG 4.44Å; T92-E95 PolarHBondContact N-OE2 3.48Å; T92-E95 PolarHBondContact O-N 3.09Å; T92-E95 WeakPolarHBondContact OG1-CG 3.2Å; T92-E95 PolarHBondContact OG1-N 3.07Å; T92-E95 VanDerWaalsContact OG1-N 3.14Å; T92-R96 WeakPolarHBondContact O-CG 3.29Å; T92-R96 PolarHBondContact O-N 3.19Å
93	P	78.5	Confident	72.8	Confident	96 Å²	96	58.8 Å²	58.8	62%	0.623	34%	0.336	S	S	*	.	H	α-helix	trans	-51	-38.2	173.2	-27.1	36.5	0	0	0	112.6	A97	P93-A97 PolarHBondContact O-N 3.19Å; P93-A97 VanDerWaalsContact O-N 3.09Å
94	E	81.1	Confident	73.7	Confident	135 Å²	135	53.7 Å²	53.7	63%	0.631	31%	0.313	S	S	*	.	H	α-helix	trans	-66.1	-44.6	175.3	-55.9	83.6	-168.6	0	0	112.2	T92 R96 A97 A98	T92-E94 WeakPolarHBondContact CB-OE2 3.46Å; T92-E94 PolarHBondContact O-N 2.92Å; T92-E94 PolarHBondContact OG1-N 3.09Å; T92-E94 PolarHBondContact OG1-OE2 2.92Å; E94-R96 VanDerWaalsContact C-N 3.33Å; E94-R96 PolarHBondContact O-N 3.37Å; E94-A97 PolarHBondContact O-N 3.09Å; E94-A98 WeakPolarHBondContact O-CB 3.4Å; E94-A98 PolarHBondContact O-N 3.12Å
95	E	82.7	Confident	75.1	Confident	22 Å²	22	51.8 Å²	51.8	10%	0.103	29%	0.293	C	S	.	.	H	α-helix	trans	-64.3	-36.8	178.6	-72.8	178.7	150.5	0	0	112.3	L91 T92 A98 R99 V599 N603	L91-E95 WeakPolarHBondContact CA-OE2 3.34Å; L91-E95 HydrophobicContact CB-CB 3.91Å; L91-E95 HydrophobicContact CD2-CB 3.89Å; L91-E95 HydrophobicContact CG-CB 4.45Å; T92-E95 HydrophobicContact CG2-CG 4.44Å; T92-E95 PolarHBondContact N-OE2 3.48Å; T92-E95 PolarHBondContact O-N 3.09Å; T92-E95 WeakPolarHBondContact OG1-CG 3.2Å; T92-E95 PolarHBondContact OG1-N 3.07Å; T92-E95 VanDerWaalsContact OG1-N 3.14Å; E95-A98 PolarHBondContact O-N 3.08Å; E95-R99 WeakPolarHBondContact O-CB 3.39Å; E95-R99 PolarHBondContact O-N 2.69Å; E95-V599 HydrophobicContact CB-CG1 3.57Å; E95-V599 HydrophobicContact CG-CG1 3.69Å; E95-N603 PolarHBondContact OE1-ND2 3.14Å
96	R	82.3	Confident	76.9	Confident	141 Å²	141	48.8 Å²	48.8	53%	0.532	27%	0.274	S	S	.	.	H	α-helix	trans	-65.4	-42.4	173.1	-67.6	-179.6	-158.2	156.7	10.1	111.5	L91 T92 E94 R99 A100	L91-R96 HydrophobicContact CB-CG 3.6Å; L91-R96 HydrophobicContact CD1-CG 4.35Å; L91-R96 PolarHBondContact O-NE 3.4Å; L91-R96 PolarHBondContact O-NH2 3.22Å; T92-R96 WeakPolarHBondContact O-CG 3.29Å; T92-R96 PolarHBondContact O-N 3.19Å; E94-R96 VanDerWaalsContact C-N 3.33Å; E94-R96 PolarHBondContact O-N 3.37Å; R96-R99 PolarHBondContact O-N 2.85Å; R96-A100 WeakPolarHBondContact O-CB 3.48Å; R96-A100 PolarHBondContact O-N 2.79Å
97	A	85.3	Confident	78.7	Confident	5 Å²	5	49.8 Å²	49.8	4%	0.041	28%	0.28	C	S	.	.	H	α-helix	trans	-64.7	-41.8	176.4	0	0	0	0	0	111.4	P93 E94 A100 G101 I143	P93-A97 PolarHBondContact O-N 3.19Å; P93-A97 VanDerWaalsContact O-N 3.09Å; E94-A97 PolarHBondContact O-N 3.09Å; A97-A100 PolarHBondContact O-N 3.04Å; A97-G101 PolarHBondContact O-N 3.08Å; A97-I143 HydrophobicContact CB-CG1 3.96Å
98	A	86.6	Confident	80.7	Confident	9 Å²	9	49.4 Å²	49.4	7%	0.074	28%	0.276	C	S	.	.	H	α-helix	trans	-60.6	-45.8	174.1	0	0	0	0	0	111.8	E94 E95 G101 L102	E94-A98 WeakPolarHBondContact O-CB 3.4Å; E94-A98 PolarHBondContact O-N 3.12Å; E95-A98 PolarHBondContact O-N 3.08Å; A98-G101 PolarHBondContact O-N 2.98Å; A98-L102 WeakPolarHBondContact O-CG 3.33Å; A98-L102 PolarHBondContact O-N 3.05Å
99	R	87.4	Confident	82.7	Confident	86 Å²	86	46.9 Å²	46.9	33%	0.325	26%	0.261	S	S	.	.	H	α-helix	trans	-61.3	-44.4	176	-166	-173.1	-174.5	107.4	-6.3	112	E95 R96 G101 L102 G103 D596 V599	E95-R99 WeakPolarHBondContact O-CB 3.39Å; E95-R99 PolarHBondContact O-N 2.69Å; R96-R99 PolarHBondContact O-N 2.85Å; R99-G101 VanDerWaalsContact C-N 3.34Å; R99-L102 PolarHBondContact O-N 2.63Å; R99-G103 PolarHBondContact O-N 2.95Å; R99-D596 IonicContact CZ-OD1 2.79Å; R99-D596 IonicContact NH1-OD1 2.77Å; R99-D596 PolarHBondContact NH1-OD1 3.32Å; R99-V599 HydrophobicContact CB-CG2 3.83Å; R99-V599 HydrophobicContact CG-CG2 4.3Å
100	A	88.3	Confident	84.6	Confident	44 Å²	44	47.3 Å²	47.3	36%	0.364	26%	0.255	S	S	.	.	H	α-helix	trans	-60.6	-45.7	176.3	0	0	0	0	0	111	R96 A97 L102 G103 L104 I143	R96-A100 WeakPolarHBondContact O-CB 3.48Å; R96-A100 PolarHBondContact O-N 2.79Å; A97-A100 PolarHBondContact O-N 3.04Å; A100-L102 PolarHBondContact O-N 3.12Å; A100-G103 PolarHBondContact O-N 3.24Å; A100-L104 WeakPolarHBondContact O-CG 3.32Å; A100-L104 PolarHBondContact O-N 3.41Å; A100-I143 HydrophobicContact CB-CD1 3.88Å
101	G	91	Very high	86	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-58.8	-45.8	175.4	0	0	0	0	0	113.4	A97 A98 R99 G103 L104 C105	A97-G101 PolarHBondContact O-N 3.08Å; A98-G101 PolarHBondContact O-N 2.98Å; R99-G101 VanDerWaalsContact C-N 3.34Å; G101-G103 PolarHBondContact O-N 3.47Å; G101-L104 PolarHBondContact O-N 3.17Å; G101-C105 PolarHBondContact O-N 3.16Å; G101-C105 PolarHBondContact O-SG 2.82Å
102	L	90.9	Very high	86.6	Confident	9 Å²	9	48.2 Å²	48.2	5%	0.047	25%	0.248	C	C	.	.	H	α-helix	trans	-60.2	-42.9	174	-77.6	163.5	0	0	0	112.1	A98 R99 A100 C105 R106 R153 I157 W595 L598 V599	A98-L102 WeakPolarHBondContact O-CG 3.33Å; A98-L102 PolarHBondContact O-N 3.05Å; R99-L102 PolarHBondContact O-N 2.63Å; A100-L102 PolarHBondContact O-N 3.12Å; L102-C105 PolarHBondContact O-N 3.13Å; L102-R106 PolarHBondContact O-N 3.14Å; L102-R153 HydrophobicContact CD2-CB 3.88Å; L102-R153 HydrophobicContact CD2-CG 3.76Å; L102-R153 HydrophobicContact CG-CG 4.38Å; L102-I157 HydrophobicContact CD2-CD1 4.23Å; L102-I157 HydrophobicContact CD2-CG1 4.17Å; L102-W595 HydrophobicContact CB-CE3 4.19Å; L102-W595 HydrophobicContact CB-CZ3 3.84Å; L102-L598 HydrophobicContact CD1-CB 3.8Å; L102-V599 HydrophobicContact CD1-CG2 3.96Å
103	G	90.6	Very high	86.7	Confident	30 Å²	30	50.8 Å²	50.8	31%	0.309	25%	0.252	S	S	.	.	H	α-helix	trans	-62	-42.7	176.3	0	0	0	0	0	113	R99 A100 G101 R106 L107	R99-G103 PolarHBondContact O-N 2.95Å; A100-G103 PolarHBondContact O-N 3.24Å; G101-G103 PolarHBondContact O-N 3.47Å; G103-R106 PolarHBondContact O-N 3.38Å; G103-L107 PolarHBondContact O-N 2.93Å
104	L	91.9	Very high	86.2	Confident	38 Å²	38	47.1 Å²	47.1	20%	0.199	23%	0.231	C	C	.	.	H	α-helix	trans	-64.6	-42.9	175.2	-68.5	169.4	0	0	0	111.5	A100 G101 L107 L108 V121 M125 I143 L145	A100-L104 WeakPolarHBondContact O-CG 3.32Å; A100-L104 PolarHBondContact O-N 3.41Å; G101-L104 PolarHBondContact O-N 3.17Å; L104-L107 WeakPolarHBondContact O-CB 3.35Å; L104-L107 PolarHBondContact O-N 3.27Å; L104-L108 WeakPolarHBondContact O-CG 3.32Å; L104-L108 PolarHBondContact O-N 3.24Å; L104-V121 HydrophobicContact CD2-CG1 4.18Å; L104-M125 HydrophobicContact CD1-CE 3.66Å; L104-M125 HydrophobicContact CD1-SD 3.58Å; L104-M125 VanDerWaalsContact CD1-SD 3.58Å; L104-M125 HydrophobicContact CD2-SD 4.31Å; L104-I143 HydrophobicContact CD1-CG2 4.31Å; L104-L145 HydrophobicContact CB-CD2 4.21Å; L104-L145 HydrophobicContact CD1-CD1 3.94Å
105	C	92	Very high	85.8	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-62.8	-43.2	175.4	-63.3	0	0	0	0	111.7	G101 L102 L107 L108 A109 T150 R153 I154	G101-C105 PolarHBondContact O-N 3.16Å; G101-C105 PolarHBondContact O-SG 2.82Å; L102-C105 PolarHBondContact O-N 3.13Å; C105-L107 VanDerWaalsContact C-N 3.29Å; C105-L107 PolarHBondContact O-N 3.07Å; C105-L108 WeakPolarHBondContact O-CB 3.48Å; C105-L108 PolarHBondContact O-N 3.48Å; C105-A109 PolarHBondContact O-N 3.45Å; C105-T150 HydrophobicContact CB-CG2 4.34Å; C105-R153 HydrophobicContact CB-CB 4Å; C105-R153 WeakPolarHBondContact SG-CD 3.22Å; C105-I154 HydrophobicContact CB-CD1 4.45Å; C105-I154 HydrophobicContact CB-CG1 4.03Å; C105-I154 WeakPolarHBondContact O-CD1 3.44Å
106	R	91.8	Very high	85.2	Confident	40 Å²	40	44.3 Å²	44.3	15%	0.151	23%	0.231	C	C	.	.	H	α-helix	trans	-58.5	-42.6	173.4	-174.1	-178.6	176.1	-149.5	9.2	111.3	L102 G103 A109 L110 I157 V586 E592 W595	L102-R106 PolarHBondContact O-N 3.14Å; G103-R106 PolarHBondContact O-N 3.38Å; R106-A109 PolarHBondContact O-N 2.84Å; R106-L110 HydrophobicContact CG-CD1 4.14Å; R106-L110 HydrophobicContact CG-CG 4.39Å; R106-L110 WeakPolarHBondContact O-CG 3.42Å; R106-L110 PolarHBondContact O-N 3.21Å; R106-I157 HydrophobicContact CB-CD1 4.02Å; R106-V586 HydrophobicContact CG-CG1 4.01Å; R106-E592 IonicContact CZ-OE1 3.61Å; R106-E592 IonicContact CZ-OE2 2.8Å; R106-E592 VanDerWaalsContact NH1-CD 3.31Å; R106-E592 IonicContact NH1-OE1 2.7Å; R106-E592 PolarHBondContact NH1-OE1 3.31Å; R106-E592 VanDerWaalsContact NH1-OE1 3.08Å; R106-E592 IonicContact NH1-OE2 3.4Å; R106-E592 PolarHBondContact NH1-OE2 2.96Å; R106-E592 IonicContact NH2-OE1 3.78Å; R106-E592 PolarHBondContact NH2-OE1 3.37Å; R106-E592 IonicContact NH2-OE2 3.23Å; R106-W595 HydrophobicContact CB-CH2 3.91Å; R106-W595 VanDerWaalsContact CD-CH2 3.41Å; R106-W595 HydrophobicContact CG-CH2 4.27Å
107	L	91	Very high	85.1	Confident	93 Å²	93	40.1 Å²	40.1	49%	0.487	22%	0.217	S	C	.	.	H	α-helix	trans	-63.2	-42.1	178.5	-177.4	61.9	0	0	0	111.8	G103 L104 C105 L110 K111	G103-L107 PolarHBondContact O-N 2.93Å; L104-L107 WeakPolarHBondContact O-CB 3.35Å; L104-L107 PolarHBondContact O-N 3.27Å; C105-L107 VanDerWaalsContact C-N 3.29Å; C105-L107 PolarHBondContact O-N 3.07Å; L107-L110 PolarHBondContact O-N 3.44Å; L107-K111 WeakPolarHBondContact O-CG 3.4Å; L107-K111 PolarHBondContact O-N 3.49Å; L107-K111 VanDerWaalsContact O-N 3.1Å
108	L	88.9	Confident	85	Confident	13 Å²	13	39.9 Å²	39.9	7%	0.068	22%	0.215	C	C	.	.	H	α-helix	trans	-59.6	-47.1	173.3	-72.9	170.5	0	0	0	111.4	L104 C105 L110 K111 G112 R113 E117 V121 T150	L104-L108 WeakPolarHBondContact O-CG 3.32Å; L104-L108 PolarHBondContact O-N 3.24Å; C105-L108 WeakPolarHBondContact O-CB 3.48Å; C105-L108 PolarHBondContact O-N 3.48Å; L108-L110 PolarHBondContact O-N 2.91Å; L108-K111 CarbonylContact O-C 3.14Å; L108-K111 PolarHBondContact O-N 3.35Å; L108-K111 VanDerWaalsContact O-N 3.15Å; L108-G112 PolarHBondContact O-N 2.9Å; L108-G112 VanDerWaalsContact O-N 3.13Å; L108-R113 HydrophobicContact CB-CB 4.43Å; L108-R113 HydrophobicContact CD2-CB 3.83Å; L108-R113 HydrophobicContact CD2-CG 4.26Å; L108-R113 PolarHBondContact O-N 3.39Å; L108-E117 HydrophobicContact CD2-CB 4.17Å; L108-V121 HydrophobicContact CD2-CG2 3.96Å; L108-T150 HydrophobicContact CD1-CG2 4.11Å
109	A	88.9	Confident	85	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-58.1	-47.8	174.9	0	0	0	0	0	111.9	C105 R106 K111 G112 I154 Y563 L583 V586	C105-A109 PolarHBondContact O-N 3.45Å; R106-A109 PolarHBondContact O-N 2.84Å; A109-K111 PolarHBondContact O-N 3.03Å; A109-K111 VanDerWaalsContact O-N 3.16Å; A109-G112 WeakPolarHBondContact O-CA 3.46Å; A109-G112 PolarHBondContact O-N 3.25Å; A109-I154 HydrophobicContact CB-CD1 3.63Å; A109-I154 HydrophobicContact CB-CG1 4.13Å; A109-I154 HydrophobicContact CB-CG2 4.36Å; A109-Y563 VanDerWaalsContact O-CE2 3.29Å; A109-Y563 WeakPolarHBondContact O-CE2 3.49Å; A109-Y563 PolarHBondContact O-OH 3.39Å; A109-L583 HydrophobicContact CB-CD2 3.67Å; A109-V586 HydrophobicContact CB-CB 4.32Å; A109-V586 HydrophobicContact CB-CG1 3.81Å
110	L	88.7	Confident	85.1	Confident	66 Å²	66	45.2 Å²	45.2	35%	0.346	24%	0.243	S	C	.	.	H	α-helix	trans	-60.7	-26.3	178.5	-74.8	171.2	0	0	0	113.3	R106 L107 L108 Y563 V586	R106-L110 HydrophobicContact CG-CD1 4.14Å; R106-L110 HydrophobicContact CG-CG 4.39Å; R106-L110 WeakPolarHBondContact O-CG 3.42Å; R106-L110 PolarHBondContact O-N 3.21Å; L107-L110 PolarHBondContact O-N 3.44Å; L108-L110 PolarHBondContact O-N 2.91Å; L110-Y563 WeakPolarHBondContact O-CE2 3.36Å; L110-V586 HydrophobicContact CD2-CG1 3.96Å; L110-V586 VanDerWaalsContact CD2-O 3.3Å; L110-V586 WeakPolarHBondContact CD2-O 3.09Å; L110-V586 HydrophobicContact CG-CG1 3.98Å
111	K	86.1	Confident	85.2	Confident	129 Å²	129	44.8 Å²	44.8	56%	0.561	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.9	9.8	175.6	-62.1	-57.4	-177.5	-175.1	0	113.1	L107 L108 A109 R113 N567	L107-K111 WeakPolarHBondContact O-CG 3.4Å; L107-K111 PolarHBondContact O-N 3.49Å; L107-K111 VanDerWaalsContact O-N 3.1Å; L108-K111 CarbonylContact O-C 3.14Å; L108-K111 PolarHBondContact O-N 3.35Å; L108-K111 VanDerWaalsContact O-N 3.15Å; A109-K111 PolarHBondContact O-N 3.03Å; A109-K111 VanDerWaalsContact O-N 3.16Å; K111-R113 HydrophobicContact CB-CG 3.7Å; K111-R113 WeakPolarHBondContact O-CD 3.48Å; K111-R113 WeakPolarHBondContact O-CG 3.4Å; K111-R113 PolarHBondContact O-N 3.07Å; K111-R113 VanDerWaalsContact O-N 3.11Å; K111-N567 PolarHBondContact O-OD1 2.92Å
112	G	78.7	Confident	85.2	Confident	1 Å²	1	47.5 Å²	47.5	1%	0.01	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.6	37.8	-178.6	0	0	0	0	0	112.9	L108 A109 Y563 T570	L108-G112 PolarHBondContact O-N 2.9Å; L108-G112 VanDerWaalsContact O-N 3.13Å; A109-G112 WeakPolarHBondContact O-CA 3.46Å; A109-G112 PolarHBondContact O-N 3.25Å; G112-Y563 VanDerWaalsContact CA-OH 3.28Å; G112-Y563 WeakPolarHBondContact CA-OH 3.39Å; G112-T570 WeakPolarHBondContact O-CB 3.47Å; G112-T570 WeakPolarHBondContact O-CG2 3.44Å; G112-T570 PolarHBondContact O-OG1 3.35Å; G112-T570 VanDerWaalsContact O-OG1 3.13Å
113	R	77.8	Confident	85.3	Confident	110 Å²	110	52.4 Å²	52.4	42%	0.415	27%	0.269	S	S	.	.			trans	-91.3	139.6	178.3	-51.8	-61.3	-94	-173.1	1.7	108.7	L108 K111 E117	L108-R113 HydrophobicContact CB-CB 4.43Å; L108-R113 HydrophobicContact CD2-CB 3.83Å; L108-R113 HydrophobicContact CD2-CG 4.26Å; L108-R113 PolarHBondContact O-N 3.39Å; K111-R113 HydrophobicContact CB-CG 3.7Å; K111-R113 WeakPolarHBondContact O-CD 3.48Å; K111-R113 WeakPolarHBondContact O-CG 3.4Å; K111-R113 PolarHBondContact O-N 3.07Å; K111-R113 VanDerWaalsContact O-N 3.11Å; R113-E117 HydrophobicContact CB-CB 4.39Å; R113-E117 HydrophobicContact CB-CG 4.36Å; R113-E117 IonicContact CZ-OE1 3.92Å; R113-E117 VanDerWaalsContact CZ-OE1 3.23Å; R113-E117 IonicContact CZ-OE2 3.58Å; R113-E117 VanDerWaalsContact CZ-OE2 3.23Å; R113-E117 IonicContact NE-OE1 3.39Å; R113-E117 PolarHBondContact NE-OE1 2.64Å; R113-E117 VanDerWaalsContact NE-OE1 3.1Å; R113-E117 IonicContact NE-OE2 3.54Å; R113-E117 PolarHBondContact NE-OE2 3.44Å; R113-E117 IonicContact NH1-OE1 2.76Å; R113-E117 IonicContact NH2-OE1 3.55Å; R113-E117 PolarHBondContact NH2-OE1 3.12Å; R113-E117 IonicContact NH2-OE2 3.55Å; R113-E117 PolarHBondContact NH2-OE2 3.07Å
114	G	68.4	Low	85.3	Confident	19 Å²	19	54 Å²	54	20%	0.196	28%	0.275	C	S	.	.			trans	-72.9	165.7	-177.9	0	0	0	0	0	112	G116 E117	G114-G116 PolarHBondContact O-N 2.94Å; G114-G116 VanDerWaalsContact O-N 3.14Å; G114-E117 PolarHBondContact O-N 3.36Å; G114-E117 VanDerWaalsContact O-N 3.08Å
115	W	71.4	Confident	85.4	Confident	43 Å²	43	54.1 Å²	54.1	16%	0.163	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-56.3	-31.3	-179.2	-41.8	120.2	0	0	0	114.3	E117 G118 P147 T150 R151 I154 H579	W115-E117 PolarHBondContact O-N 3.07Å; W115-G118 PolarHBondContact O-N 3.42Å; W115-P147 HydrophobicContact CB-CB 3.92Å; W115-T150 HydrophobicContact CE3-CG2 3.76Å; W115-T150 HydrophobicContact CZ3-CG2 4.32Å; W115-T150 WeakPolarHBondContact CZ3-O 3.48Å; W115-R151 HydrophobicContact CD2-CB 3.91Å; W115-R151 HydrophobicContact CD2-CG 4.48Å; W115-R151 VanDerWaalsContact CE3-CA 3.49Å; W115-R151 HydrophobicContact CE3-CB 4.05Å; W115-R151 HydrophobicContact CG-CB 4.4Å; W115-R151 HydrophobicContact CH2-CB 4.11Å; W115-R151 HydrophobicContact CH2-CG 4.07Å; W115-R151 HydrophobicContact CZ2-CB 3.89Å; W115-R151 HydrophobicContact CZ2-CG 3.61Å; W115-R151 HydrophobicContact CZ3-CB 4.15Å; W115-I154 HydrophobicContact CE3-CD1 3.94Å; W115-I154 HydrophobicContact CH2-CB 3.73Å; W115-I154 HydrophobicContact CH2-CD1 4.05Å; W115-I154 HydrophobicContact CH2-CG1 4.36Å; W115-I154 HydrophobicContact CH2-CG2 3.87Å; W115-I154 HydrophobicContact CZ3-CB 3.57Å; W115-I154 HydrophobicContact CZ3-CD1 3.18Å; W115-I154 HydrophobicContact CZ3-CG1 3.72Å; W115-I154 HydrophobicContact CZ3-CG2 4.1Å; W115-H579 AromaticContact CE2-CD2 3.93Å; W115-H579 AromaticContact CE2-CE1 3.11Å; W115-H579 AromaticContact CE2-ND1 3.5Å; W115-H579 AromaticContact CE2-NE2 3.39Å; W115-H579 AromaticContact CH2-CD2 3.32Å; W115-H579 WeakPolarHBondContact CH2-CD2 3.34Å; W115-H579 AromaticContact CH2-CE1 3.87Å; W115-H579 AromaticContact CH2-NE2 3.24Å; W115-H579 WeakPolarHBondContact CH2-NE2 3.37Å; W115-H579 HydrophobicContact CZ2-CB 4.21Å; W115-H579 AromaticContact CZ2-CD2 3.02Å; W115-H579 WeakPolarHBondContact CZ2-CD2 3.09Å; W115-H579 AromaticContact CZ2-CE1 3.06Å; W115-H579 WeakPolarHBondContact CZ2-CE1 3.33Å; W115-H579 AromaticContact CZ2-CG 3.26Å; W115-H579 AromaticContact CZ2-ND1 3.25Å; W115-H579 VanDerWaalsContact CZ2-ND1 3.25Å; W115-H579 WeakPolarHBondContact CZ2-ND1 3.38Å; W115-H579 AromaticContact CZ2-NE2 2.91Å; W115-H579 WeakPolarHBondContact CZ2-NE2 3.19Å; W115-H579 AromaticContact NE1-CE1 3.2Å; W115-H579 PolarHBondContact NE1-CE1 3.16Å; W115-H579 AromaticContact NE1-ND1 3.39Å; W115-H579 PolarHBondContact NE1-ND1 3.01Å; W115-H579 AromaticContact NE1-NE2 3.96Å
116	G	70.7	Confident	85.5	Confident	54 Å²	54	56.1 Å²	56.1	56%	0.557	28%	0.284	S	S	*	.	G	3₁₀ helix	trans	-68.1	-13.1	179.4	0	0	0	0	0	114.7	G114 G118	G114-G116 PolarHBondContact O-N 2.94Å; G114-G116 VanDerWaalsContact O-N 3.14Å; G116-G118 VanDerWaalsContact C-N 3.31Å
117	E	80.3	Confident	85.7	Confident	54 Å²	54	58.4 Å²	58.4	25%	0.252	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-81.9	-9.7	178.4	-65.9	-154.8	-166.5	0	0	113.6	L108 R113 G114 W115 D119 F120 V121	L108-E117 HydrophobicContact CD2-CB 4.17Å; R113-E117 HydrophobicContact CB-CB 4.39Å; R113-E117 HydrophobicContact CB-CG 4.36Å; R113-E117 IonicContact CZ-OE1 3.92Å; R113-E117 VanDerWaalsContact CZ-OE1 3.23Å; R113-E117 IonicContact CZ-OE2 3.58Å; R113-E117 VanDerWaalsContact CZ-OE2 3.23Å; R113-E117 IonicContact NE-OE1 3.39Å; R113-E117 PolarHBondContact NE-OE1 2.64Å; R113-E117 VanDerWaalsContact NE-OE1 3.1Å; R113-E117 IonicContact NE-OE2 3.54Å; R113-E117 PolarHBondContact NE-OE2 3.44Å; R113-E117 IonicContact NH1-OE1 2.76Å; R113-E117 IonicContact NH2-OE1 3.55Å; R113-E117 PolarHBondContact NH2-OE1 3.12Å; R113-E117 IonicContact NH2-OE2 3.55Å; R113-E117 PolarHBondContact NH2-OE2 3.07Å; G114-E117 PolarHBondContact O-N 3.36Å; G114-E117 VanDerWaalsContact O-N 3.08Å; W115-E117 PolarHBondContact O-N 3.07Å; E117-D119 VanDerWaalsContact C-N 3.29Å; E117-D119 PolarHBondContact O-N 3.18Å; E117-F120 PolarHBondContact O-N 3.22Å; E117-V121 PolarHBondContact O-N 3.27Å; E117-V121 VanDerWaalsContact O-N 3.08Å
118	G	84.3	Confident	85.9	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-58.1	-40.4	178	0	0	0	0	0	113	W115 G116 F120 V121 Y122 L145	W115-G118 PolarHBondContact O-N 3.42Å; G116-G118 VanDerWaalsContact C-N 3.31Å; G118-F120 PolarHBondContact O-N 3.2Å; G118-V121 PolarHBondContact O-N 3.34Å; G118-Y122 PolarHBondContact O-N 3.49Å; G118-L145 WeakPolarHBondContact CA-O 3.43Å
119	D	86.5	Confident	86.1	Confident	81 Å²	81	59.9 Å²	59.9	43%	0.433	31%	0.31	S	S	.	.	H	α-helix	trans	-64	-39.8	177.6	-68.2	-17.4	0	0	0	112.1	E117 Y122 Q123	E117-D119 VanDerWaalsContact C-N 3.29Å; E117-D119 PolarHBondContact O-N 3.18Å; D119-Y122 WeakPolarHBondContact O-CB 3.36Å; D119-Y122 PolarHBondContact O-N 3.49Å; D119-Q123 VanDerWaalsContact O-CG 3.3Å; D119-Q123 WeakPolarHBondContact O-CG 3.14Å; D119-Q123 PolarHBondContact O-N 2.91Å
120	F	88.1	Confident	86.4	Confident	125 Å²	125	66 Å²	66	55%	0.548	33%	0.333	S	S	.	.	H	α-helix	trans	-66.1	-41.7	176.8	177	-107.1	0	0	0	111.3	E117 G118 Y122 Q123 C124	E117-F120 PolarHBondContact O-N 3.22Å; G118-F120 PolarHBondContact O-N 3.2Å; F120-Y122 VanDerWaalsContact C-N 3.32Å; F120-Y122 PolarHBondContact O-N 2.98Å; F120-Q123 PolarHBondContact O-N 3.41Å; F120-C124 VanDerWaalsContact CZ-SG 3.59Å; F120-C124 PolarHBondContact O-N 2.89Å; F120-C124 PolarHBondContact O-SG 3.1Å
121	V	91.3	Very high	86.7	Confident	35 Å²	35	70.3 Å²	70.3	21%	0.212	35%	0.352	C	S	.	.	H	α-helix	trans	-62.6	-42.3	174.5	174.4	0	0	0	0	110.8	L104 L108 E117 G118 Q123 C124 M125 L145	L104-V121 HydrophobicContact CD2-CG1 4.18Å; L108-V121 HydrophobicContact CD2-CG2 3.96Å; E117-V121 PolarHBondContact O-N 3.27Å; E117-V121 VanDerWaalsContact O-N 3.08Å; G118-V121 PolarHBondContact O-N 3.34Å; V121-Q123 PolarHBondContact O-N 3.5Å; V121-C124 PolarHBondContact O-N 3.29Å; V121-M125 HydrophobicContact CG1-CE 4.38Å; V121-M125 WeakPolarHBondContact O-CG 3.4Å; V121-M125 PolarHBondContact O-N 3.23Å; V121-M125 VanDerWaalsContact O-N 3.07Å; V121-L145 HydrophobicContact CB-CD1 4.34Å; V121-L145 HydrophobicContact CG1-CD1 4.13Å
122	Y	91.6	Very high	87.1	Confident	58 Å²	58	68.8 Å²	68.8	23%	0.227	35%	0.353	C	S	.	.	H	α-helix	trans	-57	-49.7	175.1	-169.3	-85.5	0	0	0	111.6	G118 D119 F120 C124 M125 E126 L140 I143	G118-Y122 PolarHBondContact O-N 3.49Å; D119-Y122 WeakPolarHBondContact O-CB 3.36Å; D119-Y122 PolarHBondContact O-N 3.49Å; F120-Y122 VanDerWaalsContact C-N 3.32Å; F120-Y122 PolarHBondContact O-N 2.98Å; Y122-C124 VanDerWaalsContact C-N 3.34Å; Y122-C124 PolarHBondContact O-N 3.34Å; Y122-M125 HydrophobicContact CD2-CE 4.41Å; Y122-M125 PolarHBondContact O-N 2.9Å; Y122-E126 WeakPolarHBondContact O-CB 3.28Å; Y122-E126 PolarHBondContact O-N 3.32Å; Y122-L140 HydrophobicContact CE2-CB 3.99Å; Y122-L140 WeakPolarHBondContact CE2-O 3.38Å; Y122-L140 WeakPolarHBondContact OH-CB 3.45Å; Y122-L140 PolarHBondContact OH-O 3.46Å; Y122-I143 WeakPolarHBondContact CD2-O 3.34Å; Y122-I143 WeakPolarHBondContact CE2-O 3.46Å
123	Q	91.3	Very high	87.8	Confident	111 Å²	111	72.3 Å²	72.3	52%	0.519	37%	0.371	S	S	.	.	H	α-helix	trans	-60.3	-41	177.6	-70.7	170.6	10.3	0	0	112.4	D119 F120 V121 M125 E126 V127	D119-Q123 VanDerWaalsContact O-CG 3.3Å; D119-Q123 WeakPolarHBondContact O-CG 3.14Å; D119-Q123 PolarHBondContact O-N 2.91Å; F120-Q123 PolarHBondContact O-N 3.41Å; V121-Q123 PolarHBondContact O-N 3.5Å; Q123-M125 PolarHBondContact O-N 2.96Å; Q123-E126 PolarHBondContact O-N 2.89Å; Q123-V127 WeakPolarHBondContact O-CG2 3.42Å; Q123-V127 PolarHBondContact O-N 3.38Å
124	C	92.6	Very high	88.3	Confident	63 Å²	63	70.8 Å²	70.8	43%	0.426	38%	0.375	S	S	.	.	H	α-helix	trans	-60.6	-44.9	176.6	-68.7	0	0	0	0	112	F120 V121 Y122 E126 L128	F120-C124 VanDerWaalsContact CZ-SG 3.59Å; F120-C124 PolarHBondContact O-N 2.89Å; F120-C124 PolarHBondContact O-SG 3.1Å; V121-C124 PolarHBondContact O-N 3.29Å; Y122-C124 VanDerWaalsContact C-N 3.34Å; Y122-C124 PolarHBondContact O-N 3.34Å; C124-E126 VanDerWaalsContact C-N 3.34Å; C124-L128 PolarHBondContact O-N 2.69Å; C124-L128 VanDerWaalsContact O-N 3.14Å
125	M	93.4	Very high	89.4	Confident	41 Å²	41	75.6 Å²	75.6	20%	0.202	39%	0.393	C	S	.	.	H	α-helix	trans	-66	-38.8	176.7	-64.5	-175	-60.8	0	0	111.7	L104 V121 Y122 Q123 L128 L129 L140 L145	L104-M125 HydrophobicContact CD1-CE 3.66Å; L104-M125 HydrophobicContact CD1-SD 3.58Å; L104-M125 VanDerWaalsContact CD1-SD 3.58Å; L104-M125 HydrophobicContact CD2-SD 4.31Å; V121-M125 HydrophobicContact CG1-CE 4.38Å; V121-M125 WeakPolarHBondContact O-CG 3.4Å; V121-M125 PolarHBondContact O-N 3.23Å; V121-M125 VanDerWaalsContact O-N 3.07Å; Y122-M125 HydrophobicContact CD2-CE 4.41Å; Y122-M125 PolarHBondContact O-N 2.9Å; Q123-M125 PolarHBondContact O-N 2.96Å; M125-L128 PolarHBondContact O-N 3.45Å; M125-L129 WeakPolarHBondContact O-CB 3.34Å; M125-L129 WeakPolarHBondContact O-CG 3.46Å; M125-L129 PolarHBondContact O-N 2.97Å; M125-L140 HydrophobicContact CB-CD1 4.29Å; M125-L140 HydrophobicContact CB-CD2 3.99Å; M125-L140 HydrophobicContact CE-CD2 3.96Å; M125-L140 HydrophobicContact SD-CD2 4.33Å; M125-L145 HydrophobicContact CE-CD1 3.89Å
126	E	93.6	Very high	90.1	Very high	42 Å²	42	78 Å²	78	20%	0.196	41%	0.406	C	S	.	.	H	α-helix	trans	-63.5	-45	179.4	-167.2	-173.7	-140.1	0	0	111.9	Y122 Q123 C124 L129 R130 L140	Y122-E126 WeakPolarHBondContact O-CB 3.28Å; Y122-E126 PolarHBondContact O-N 3.32Å; Q123-E126 PolarHBondContact O-N 2.89Å; C124-E126 VanDerWaalsContact C-N 3.34Å; E126-L129 PolarHBondContact O-N 3.11Å; E126-R130 WeakPolarHBondContact O-CB 3.49Å; E126-R130 VanDerWaalsContact O-CG 3.29Å; E126-R130 WeakPolarHBondContact O-CG 3.18Å; E126-R130 PolarHBondContact O-N 2.83Å; E126-R130 IonicContact OE1-CZ 3.81Å; E126-R130 IonicContact OE1-NH1 3.44Å; E126-R130 PolarHBondContact OE1-NH1 3.47Å; E126-R130 IonicContact OE1-NH2 3.19Å; E126-R130 PolarHBondContact OE1-NH2 3.38Å; E126-R130 IonicContact OE2-CZ 2.75Å; E126-R130 IonicContact OE2-NH1 3.93Å; E126-R130 PolarHBondContact OE2-NH1 2.82Å; E126-R130 IonicContact OE2-NH2 3.12Å; E126-L140 VanDerWaalsContact CA-CD1 3.42Å; E126-L140 HydrophobicContact CB-CD1 3.74Å; E126-L140 HydrophobicContact CG-CD1 4.12Å
127	V	96.3	Very high	90.9	Very high	88 Å²	88	77 Å²	77	53%	0.533	39%	0.389	S	S	.	.	H	α-helix	trans	-61.4	-47.3	174.8	171.5	0	0	0	0	110.7	Q123 L129 R130 E131	Q123-V127 WeakPolarHBondContact O-CG2 3.42Å; Q123-V127 PolarHBondContact O-N 3.38Å; V127-L129 PolarHBondContact O-N 2.76Å; V127-R130 PolarHBondContact O-N 2.75Å; V127-E131 WeakPolarHBondContact O-CG 3.3Å; V127-E131 PolarHBondContact O-N 3.21Å; V127-E131 VanDerWaalsContact O-N 3.1Å
128	L	94.5	Very high	91.3	Very high	109 Å²	109	77.8 Å²	77.8	57%	0.571	40%	0.4	S	S	*	.	H	α-helix	trans	-58.4	-49.1	178.8	177.9	68.8	0	0	0	111.8	C124 M125 E131 V132	C124-L128 PolarHBondContact O-N 2.69Å; C124-L128 VanDerWaalsContact O-N 3.14Å; M125-L128 PolarHBondContact O-N 3.45Å; L128-E131 PolarHBondContact O-N 3Å; L128-V132 HydrophobicContact CD1-CG2 3.87Å; L128-V132 WeakPolarHBondContact O-CB 3.42Å; L128-V132 WeakPolarHBondContact O-CG2 3.46Å; L128-V132 PolarHBondContact O-N 2.89Å
129	L	94.2	Very high	91.3	Very high	29 Å²	29	81.6 Å²	81.6	15%	0.152	42%	0.424	C	S	.	.	H	α-helix	trans	-67.1	-41.8	-179.3	-70.4	177.6	0	0	0	111.2	M125 E126 V127 E131 L133 P134 H136 V137 L140	M125-L129 WeakPolarHBondContact O-CB 3.34Å; M125-L129 WeakPolarHBondContact O-CG 3.46Å; M125-L129 PolarHBondContact O-N 2.97Å; E126-L129 PolarHBondContact O-N 3.11Å; V127-L129 PolarHBondContact O-N 2.76Å; L129-E131 VanDerWaalsContact C-N 3.31Å; L129-E131 PolarHBondContact O-N 3.39Å; L129-L133 HydrophobicContact CD2-CB 4.08Å; L129-L133 HydrophobicContact CD2-CD1 4.35Å; L129-L133 CarbonylContact O-C 3.32Å; L129-L133 WeakPolarHBondContact O-CA 3.38Å; L129-L133 PolarHBondContact O-N 3.35Å; L129-P134 WeakPolarHBondContact O-CA 3.46Å; L129-H136 HydrophobicContact CD2-CB 4.28Å; L129-V137 HydrophobicContact CB-CG2 3.81Å; L129-L140 HydrophobicContact CD1-CD1 3.83Å; L129-L140 HydrophobicContact CD1-CD2 3.91Å; L129-L140 HydrophobicContact CD1-CG 3.63Å
130	R	93.8	Very high	91.4	Very high	127 Å²	127	78.1 Å²	78.1	48%	0.479	41%	0.405	S	S	.	.	H	α-helix	trans	-59.7	-40.3	178.1	-80	179.6	175.1	141.6	6.7	113.1	E126 V127 V137	E126-R130 WeakPolarHBondContact O-CB 3.49Å; E126-R130 VanDerWaalsContact O-CG 3.29Å; E126-R130 WeakPolarHBondContact O-CG 3.18Å; E126-R130 PolarHBondContact O-N 2.83Å; E126-R130 IonicContact OE1-CZ 3.81Å; E126-R130 IonicContact OE1-NH1 3.44Å; E126-R130 PolarHBondContact OE1-NH1 3.47Å; E126-R130 IonicContact OE1-NH2 3.19Å; E126-R130 PolarHBondContact OE1-NH2 3.38Å; E126-R130 IonicContact OE2-CZ 2.75Å; E126-R130 IonicContact OE2-NH1 3.93Å; E126-R130 PolarHBondContact OE2-NH1 2.82Å; E126-R130 IonicContact OE2-NH2 3.12Å; V127-R130 PolarHBondContact O-N 2.75Å; R130-V137 HydrophobicContact CB-CG2 4.46Å; R130-V137 HydrophobicContact CG-CG1 4.46Å; R130-V137 HydrophobicContact CG-CG2 3.83Å
131	E	95.6	Very high	91.3	Very high	158 Å²	158	80 Å²	80	74%	0.738	42%	0.415	S	S	*	.	H	α-helix	trans	-86.6	-33.8	-174.9	-64.2	-60.2	137.2	0	0	113.4	V127 L128 L129	V127-E131 WeakPolarHBondContact O-CG 3.3Å; V127-E131 PolarHBondContact O-N 3.21Å; V127-E131 VanDerWaalsContact O-N 3.1Å; L128-E131 PolarHBondContact O-N 3Å; L129-E131 VanDerWaalsContact C-N 3.31Å; L129-E131 PolarHBondContact O-N 3.39Å
132	V	94.9	Very high	90.9	Very high	96 Å²	96	80.3 Å²	80.3	58%	0.582	43%	0.426	S	S	*	.	H	α-helix	trans	-105.4	-35	-172.5	-171.5	0	0	0	0	112.8	L128	L128-V132 HydrophobicContact CD1-CG2 3.87Å; L128-V132 WeakPolarHBondContact O-CB 3.42Å; L128-V132 WeakPolarHBondContact O-CG2 3.46Å; L128-V132 PolarHBondContact O-N 2.89Å
133	L	92.4	Very high	90.8	Very high	76 Å²	76	78 Å²	78	40%	0.398	42%	0.417	S	S	.	.			trans	-143	59.6	-171.7	-67.3	174.9	0	0	0	111.8	L129 E135 H136	L129-L133 HydrophobicContact CD2-CB 4.08Å; L129-L133 HydrophobicContact CD2-CD1 4.35Å; L129-L133 CarbonylContact O-C 3.32Å; L129-L133 WeakPolarHBondContact O-CA 3.38Å; L129-L133 PolarHBondContact O-N 3.35Å; L133-E135 PolarHBondContact O-N 3.49Å; L133-H136 HydrophobicContact CB-CB 4.31Å; L133-H136 WeakPolarHBondContact O-CB 3.21Å; L133-H136 PolarHBondContact O-N 3.21Å
134	P	89.3	Confident	90.7	Very high	77 Å²	77	76.3 Å²	76.3	50%	0.5	41%	0.412	S	S	.	.	G	3₁₀ helix	trans	-60.9	-30.6	-168.3	21.9	-32.9	0	0	0	113.4	L129 H136 V137	L129-P134 WeakPolarHBondContact O-CA 3.46Å; P134-H136 PolarHBondContact O-N 3.34Å; P134-V137 WeakPolarHBondContact O-CG2 3.48Å; P134-V137 PolarHBondContact O-N 2.93Å
135	E	91.1	Very high	90.5	Very high	121 Å²	121	73.5 Å²	73.5	57%	0.565	39%	0.392	S	S	*	.	G	3₁₀ helix	trans	-62.2	-19.4	174.2	63.3	-74.5	165.3	0	0	113.9	L133	L133-E135 PolarHBondContact O-N 3.49Å
136	H	86.6	Confident	90.4	Very high	93 Å²	93	73.1 Å²	73.1	43%	0.431	39%	0.393	S	S	.	.	G	3₁₀ helix	trans	-101.2	1.1	-178	-69.3	-64.2	0	0	0	114.2	L129 L133 P134 S138 V139	L129-H136 HydrophobicContact CD2-CB 4.28Å; L133-H136 HydrophobicContact CB-CB 4.31Å; L133-H136 WeakPolarHBondContact O-CB 3.21Å; L133-H136 PolarHBondContact O-N 3.21Å; P134-H136 PolarHBondContact O-N 3.34Å; H136-S138 PolarHBondContact O-N 3.07Å; H136-V139 WeakPolarHBondContact O-CB 3.46Å; H136-V139 WeakPolarHBondContact O-CG2 3.41Å; H136-V139 PolarHBondContact O-N 2.85Å; H136-V139 VanDerWaalsContact O-N 3.09Å
137	V	88	Confident	90.1	Very high	33 Å²	33	73.6 Å²	73.6	20%	0.2	40%	0.4	C	S	.	.	G	3₁₀ helix	trans	-58.8	-32.9	-178.8	173.4	0	0	0	0	112.5	L129 R130 P134 V139 L140	L129-V137 HydrophobicContact CB-CG2 3.81Å; R130-V137 HydrophobicContact CB-CG2 4.46Å; R130-V137 HydrophobicContact CG-CG1 4.46Å; R130-V137 HydrophobicContact CG-CG2 3.83Å; P134-V137 WeakPolarHBondContact O-CG2 3.48Å; P134-V137 PolarHBondContact O-N 2.93Å; V137-V139 PolarHBondContact O-N 3.08Å; V137-V139 VanDerWaalsContact O-N 3.12Å; V137-L140 WeakPolarHBondContact O-CB 3.46Å; V137-L140 PolarHBondContact O-N 3.11Å; V137-L140 VanDerWaalsContact O-N 3.09Å
138	S	87	Confident	89.7	Confident	71 Å²	71	74.9 Å²	74.9	50%	0.497	40%	0.4	S	S	.	.	G	3₁₀ helix	trans	-60.6	-21.9	179	56.8	0	0	0	0	113.7	H136 L140 Q141	H136-S138 PolarHBondContact O-N 3.07Å; S138-L140 PolarHBondContact O-N 2.97Å; S138-Q141 WeakPolarHBondContact O-CB 3.39Å; S138-Q141 PolarHBondContact O-N 3.28Å; S138-Q141 VanDerWaalsContact O-N 3.08Å
139	V	86.2	Confident	89.5	Confident	80 Å²	80	70.9 Å²	70.9	49%	0.485	38%	0.379	S	S	.	.	G	3₁₀ helix	trans	-60	-30.1	175.9	177.9	0	0	0	0	111.6	H136 V137 Q141 G142	H136-V139 WeakPolarHBondContact O-CB 3.46Å; H136-V139 WeakPolarHBondContact O-CG2 3.41Å; H136-V139 PolarHBondContact O-N 2.85Å; H136-V139 VanDerWaalsContact O-N 3.09Å; V137-V139 PolarHBondContact O-N 3.08Å; V137-V139 VanDerWaalsContact O-N 3.12Å; V139-Q141 VanDerWaalsContact C-N 3.25Å; V139-Q141 PolarHBondContact O-N 3.38Å; V139-G142 PolarHBondContact O-N 3.02Å
140	L	87.3	Confident	89.2	Confident	7 Å²	7	69.5 Å²	69.5	4%	0.037	37%	0.372	C	S	.	.	G	3₁₀ helix	trans	-70.9	-18.7	178.8	-62.5	-177.8	0	0	0	113.6	Y122 M125 E126 L129 V137 S138 G142 I143	Y122-L140 HydrophobicContact CE2-CB 3.99Å; Y122-L140 WeakPolarHBondContact CE2-O 3.38Å; Y122-L140 WeakPolarHBondContact OH-CB 3.45Å; Y122-L140 PolarHBondContact OH-O 3.46Å; M125-L140 HydrophobicContact CB-CD1 4.29Å; M125-L140 HydrophobicContact CB-CD2 3.99Å; M125-L140 HydrophobicContact CE-CD2 3.96Å; M125-L140 HydrophobicContact SD-CD2 4.33Å; E126-L140 VanDerWaalsContact CA-CD1 3.42Å; E126-L140 HydrophobicContact CB-CD1 3.74Å; E126-L140 HydrophobicContact CG-CD1 4.12Å; L129-L140 HydrophobicContact CD1-CD1 3.83Å; L129-L140 HydrophobicContact CD1-CD2 3.91Å; L129-L140 HydrophobicContact CD1-CG 3.63Å; V137-L140 WeakPolarHBondContact O-CB 3.46Å; V137-L140 PolarHBondContact O-N 3.11Å; V137-L140 VanDerWaalsContact O-N 3.09Å; S138-L140 PolarHBondContact O-N 2.97Å; L140-G142 PolarHBondContact O-N 3.19Å; L140-I143 HydrophobicContact CD2-CD1 4.36Å; L140-I143 PolarHBondContact O-N 3.35Å; L140-I143 VanDerWaalsContact O-N 3.07Å
141	Q	85.8	Confident	88.9	Confident	166 Å²	166	67.1 Å²	67.1	78%	0.776	36%	0.363	S	S	*	.	G	3₁₀ helix	trans	-64.1	-26.5	178.6	-64.5	179	-12.3	0	0	112	S138 V139	S138-Q141 WeakPolarHBondContact O-CB 3.39Å; S138-Q141 PolarHBondContact O-N 3.28Å; S138-Q141 VanDerWaalsContact O-N 3.08Å; V139-Q141 VanDerWaalsContact C-N 3.25Å; V139-Q141 PolarHBondContact O-N 3.38Å
142	G	83.9	Confident	88.7	Confident	41 Å²	41	64.7 Å²	64.7	42%	0.423	35%	0.352	S	S	.	.	G	3₁₀ helix	trans	-84	-4.8	175.8	0	0	0	0	0	114.8	V139 L140	V139-G142 PolarHBondContact O-N 3.02Å; L140-G142 PolarHBondContact O-N 3.19Å
143	I	89.7	Confident	88.5	Confident	8 Å²	8	60.6 Å²	60.6	4%	0.041	33%	0.326	C	S	.	.			trans	-111.9	92.8	-173.8	-52.6	-178.5	0	0	0	110	A97 A100 L104 Y122 L140 L145	A97-I143 HydrophobicContact CB-CG1 3.96Å; A100-I143 HydrophobicContact CB-CD1 3.88Å; L104-I143 HydrophobicContact CD1-CG2 4.31Å; Y122-I143 WeakPolarHBondContact CD2-O 3.34Å; Y122-I143 WeakPolarHBondContact CE2-O 3.46Å; L140-I143 HydrophobicContact CD2-CD1 4.36Å; L140-I143 PolarHBondContact O-N 3.35Å; L140-I143 VanDerWaalsContact O-N 3.07Å; I143-L145 HydrophobicContact CG2-CD1 4.41Å; I143-L145 HydrophobicContact CG2-CD2 4.32Å; I143-L145 HydrophobicContact CG2-CG 4.03Å
144	D	88	Confident	88.4	Confident	77 Å²	77	57 Å²	57	41%	0.412	31%	0.307	S	S	.	.			trans	-82.3	123	170.3	-170.5	-19.7	0	0	0	110.5	S146 I149 R153	D144-S146 WeakPolarHBondContact OD1-CB 3.41Å; D144-S146 PolarHBondContact OD1-N 3.06Å; D144-S146 PolarHBondContact OD1-OG 2.89Å; D144-I149 HydrophobicContact CB-CG1 4.33Å; D144-I149 HydrophobicContact CB-CG2 4.3Å; D144-I149 WeakPolarHBondContact O-CG2 3.35Å; D144-I149 WeakPolarHBondContact OD2-CG1 3.45Å; D144-R153 VanDerWaalsContact O-CZ 3.29Å; D144-R153 PolarHBondContact O-NH1 3.15Å; D144-R153 PolarHBondContact O-NH2 3.1Å
145	L	89.8	Confident	88.6	Confident	3 Å²	3	55.3 Å²	55.3	2%	0.016	29%	0.294	C	S	.	.			trans	-119.4	20.9	175.1	-66	176	0	0	0	112.5	L104 G118 V121 M125 I143 T150	L104-L145 HydrophobicContact CB-CD2 4.21Å; L104-L145 HydrophobicContact CD1-CD1 3.94Å; G118-L145 WeakPolarHBondContact CA-O 3.43Å; V121-L145 HydrophobicContact CB-CD1 4.34Å; V121-L145 HydrophobicContact CG1-CD1 4.13Å; M125-L145 HydrophobicContact CE-CD1 3.89Å; I143-L145 HydrophobicContact CG2-CD1 4.41Å; I143-L145 HydrophobicContact CG2-CD2 4.32Å; I143-L145 HydrophobicContact CG2-CG 4.03Å; L145-T150 PolarHBondContact O-OG1 3.23Å
146	S	89.7	Confident	88.7	Confident	33 Å²	33	51.8 Å²	51.8	23%	0.231	28%	0.283	C	S	.	.			trans	-53.9	154.3	172.9	59.9	0	0	0	0	111.1	D144 E148 I149 T150	D144-S146 WeakPolarHBondContact OD1-CB 3.41Å; D144-S146 PolarHBondContact OD1-N 3.06Å; D144-S146 PolarHBondContact OD1-OG 2.89Å; S146-E148 PolarHBondContact O-N 3.36Å; S146-E148 VanDerWaalsContact O-N 3.15Å; S146-I149 PolarHBondContact O-N 3.44Å; S146-I149 VanDerWaalsContact O-N 3.15Å; S146-I149 WeakPolarHBondContact OG-CG1 3.33Å; S146-T150 WeakPolarHBondContact O-CB 3.37Å; S146-T150 PolarHBondContact O-N 3.15Å; S146-T150 PolarHBondContact O-OG1 3.15Å; S146-T150 VanDerWaalsContact O-OG1 3.06Å
147	P	88	Confident	89	Confident	52 Å²	52	47.4 Å²	47.4	34%	0.338	26%	0.262	S	S	.	.	H	α-helix	trans	-53.4	-39.8	-176.7	-29.2	35.4	0	0	0	113.7	W115 R151	W115-P147 HydrophobicContact CB-CB 3.92Å; P147-R151 WeakPolarHBondContact O-CB 3.37Å; P147-R151 PolarHBondContact O-N 2.74Å
148	E	88.4	Confident	89.3	Confident	115 Å²	115	46.2 Å²	46.2	54%	0.537	26%	0.255	S	S	.	.	H	α-helix	trans	-68.3	-43.1	-179	-139.8	64.5	-152.1	0	0	112.2	S146 R151 Q152	S146-E148 PolarHBondContact O-N 3.36Å; S146-E148 VanDerWaalsContact O-N 3.15Å; E148-R151 WeakPolarHBondContact O-CB 3.26Å; E148-R151 PolarHBondContact O-N 3.08Å; E148-Q152 WeakPolarHBondContact O-CG 3.3Å; E148-Q152 PolarHBondContact O-N 2.84Å
149	I	89.2	Confident	89.7	Confident	26 Å²	26	47.9 Å²	47.9	13%	0.133	26%	0.255	C	S	.	.	H	α-helix	trans	-70.4	-40.1	178.1	-64.5	-59.1	0	0	0	111.2	D144 S146 R151 Q152 R153	D144-I149 HydrophobicContact CB-CG1 4.33Å; D144-I149 HydrophobicContact CB-CG2 4.3Å; D144-I149 WeakPolarHBondContact O-CG2 3.35Å; D144-I149 WeakPolarHBondContact OD2-CG1 3.45Å; S146-I149 PolarHBondContact O-N 3.44Å; S146-I149 VanDerWaalsContact O-N 3.15Å; S146-I149 WeakPolarHBondContact OG-CG1 3.33Å; I149-R151 VanDerWaalsContact C-N 3.28Å; I149-R151 PolarHBondContact O-N 2.93Å; I149-Q152 PolarHBondContact O-N 2.88Å; I149-R153 HydrophobicContact CG2-CG 4.37Å; I149-R153 WeakPolarHBondContact O-CB 3.39Å; I149-R153 WeakPolarHBondContact O-CG 3.42Å; I149-R153 PolarHBondContact O-N 3.15Å
150	T	88.9	Confident	90.1	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-60.6	-42.2	174.8	-58.5	0	0	0	0	110.3	C105 L108 W115 L145 S146 R153 I154	C105-T150 HydrophobicContact CB-CG2 4.34Å; L108-T150 HydrophobicContact CD1-CG2 4.11Å; W115-T150 HydrophobicContact CE3-CG2 3.76Å; W115-T150 HydrophobicContact CZ3-CG2 4.32Å; W115-T150 WeakPolarHBondContact CZ3-O 3.48Å; L145-T150 PolarHBondContact O-OG1 3.23Å; S146-T150 WeakPolarHBondContact O-CB 3.37Å; S146-T150 PolarHBondContact O-N 3.15Å; S146-T150 PolarHBondContact O-OG1 3.15Å; S146-T150 VanDerWaalsContact O-OG1 3.06Å; T150-R153 PolarHBondContact O-N 2.73Å; T150-I154 HydrophobicContact CG2-CD1 4.3Å; T150-I154 PolarHBondContact O-N 3.16Å; T150-I154 VanDerWaalsContact O-N 3.13Å
151	R	87.9	Confident	90.5	Very high	76 Å²	76	44.5 Å²	44.5	29%	0.287	23%	0.234	S	C	.	.	H	α-helix	trans	-56.8	-55.8	173.3	-179.9	177	-177.5	-174	2.2	112.8	W115 P147 E148 I149 R153 I154 L155	W115-R151 HydrophobicContact CD2-CB 3.91Å; W115-R151 HydrophobicContact CD2-CG 4.48Å; W115-R151 VanDerWaalsContact CE3-CA 3.49Å; W115-R151 HydrophobicContact CE3-CB 4.05Å; W115-R151 HydrophobicContact CG-CB 4.4Å; W115-R151 HydrophobicContact CH2-CB 4.11Å; W115-R151 HydrophobicContact CH2-CG 4.07Å; W115-R151 HydrophobicContact CZ2-CB 3.89Å; W115-R151 HydrophobicContact CZ2-CG 3.61Å; W115-R151 HydrophobicContact CZ3-CB 4.15Å; P147-R151 WeakPolarHBondContact O-CB 3.37Å; P147-R151 PolarHBondContact O-N 2.74Å; E148-R151 WeakPolarHBondContact O-CB 3.26Å; E148-R151 PolarHBondContact O-N 3.08Å; I149-R151 VanDerWaalsContact C-N 3.28Å; I149-R151 PolarHBondContact O-N 2.93Å; R151-R153 VanDerWaalsContact C-N 3.32Å; R151-R153 PolarHBondContact O-N 3.07Å; R151-I154 PolarHBondContact O-N 3.48Å; R151-L155 HydrophobicContact CG-CD1 4.17Å; R151-L155 WeakPolarHBondContact O-CG 3.44Å; R151-L155 PolarHBondContact O-N 3.29Å; R151-L155 VanDerWaalsContact O-N 3.12Å
152	Q	90.2	Very high	90.9	Very high	107 Å²	107	40.3 Å²	40.3	50%	0.5	21%	0.211	S	C	.	.	H	α-helix	trans	-58.5	-44.4	-179.4	-73.3	177.9	-9.9	0	0	111.8	E148 I149 I154 L155 S156	E148-Q152 WeakPolarHBondContact O-CG 3.3Å; E148-Q152 PolarHBondContact O-N 2.84Å; I149-Q152 PolarHBondContact O-N 2.88Å; Q152-I154 PolarHBondContact O-N 3.36Å; Q152-L155 PolarHBondContact O-N 2.94Å; Q152-S156 PolarHBondContact O-N 2.98Å; Q152-S156 PolarHBondContact O-OG 2.98Å; Q152-S156 VanDerWaalsContact O-OG 3.07Å
153	R	91.3	Very high	91.4	Very high	10 Å²	10	40.7 Å²	40.7	4%	0.038	21%	0.208	C	C	.	.	H	α-helix	trans	-61.6	-41.9	-179.8	-79.2	179.1	176	158.1	7.5	113.5	L102 C105 D144 I149 T150 R151 L155 S156 I157	L102-R153 HydrophobicContact CD2-CB 3.88Å; L102-R153 HydrophobicContact CD2-CG 3.76Å; L102-R153 HydrophobicContact CG-CG 4.38Å; C105-R153 HydrophobicContact CB-CB 4Å; C105-R153 WeakPolarHBondContact SG-CD 3.22Å; D144-R153 VanDerWaalsContact O-CZ 3.29Å; D144-R153 PolarHBondContact O-NH1 3.15Å; D144-R153 PolarHBondContact O-NH2 3.1Å; I149-R153 HydrophobicContact CG2-CG 4.37Å; I149-R153 WeakPolarHBondContact O-CB 3.39Å; I149-R153 WeakPolarHBondContact O-CG 3.42Å; I149-R153 PolarHBondContact O-N 3.15Å; T150-R153 PolarHBondContact O-N 2.73Å; R151-R153 VanDerWaalsContact C-N 3.32Å; R151-R153 PolarHBondContact O-N 3.07Å; R153-L155 VanDerWaalsContact C-N 3.35Å; R153-S156 PolarHBondContact O-N 3.23Å; R153-I157 WeakPolarHBondContact O-CD1 3.23Å; R153-I157 VanDerWaalsContact O-CG1 3.23Å; R153-I157 WeakPolarHBondContact O-CG1 3.43Å; R153-I157 PolarHBondContact O-N 3.42Å
154	I	91.1	Very high	91.6	Very high	1 Å²	1	42.5 Å²	42.5	1%	0.005	22%	0.216	C	C	.	.	H	α-helix	trans	-67.7	-38.5	177.2	-71.8	174.7	0	0	0	110.6	C105 A109 W115 T150 R151 Q152 I157 D158 A582 L583	C105-I154 HydrophobicContact CB-CD1 4.45Å; C105-I154 HydrophobicContact CB-CG1 4.03Å; C105-I154 WeakPolarHBondContact O-CD1 3.44Å; A109-I154 HydrophobicContact CB-CD1 3.63Å; A109-I154 HydrophobicContact CB-CG1 4.13Å; A109-I154 HydrophobicContact CB-CG2 4.36Å; W115-I154 HydrophobicContact CE3-CD1 3.94Å; W115-I154 HydrophobicContact CH2-CB 3.73Å; W115-I154 HydrophobicContact CH2-CD1 4.05Å; W115-I154 HydrophobicContact CH2-CG1 4.36Å; W115-I154 HydrophobicContact CH2-CG2 3.87Å; W115-I154 HydrophobicContact CZ3-CB 3.57Å; W115-I154 HydrophobicContact CZ3-CD1 3.18Å; W115-I154 HydrophobicContact CZ3-CG1 3.72Å; W115-I154 HydrophobicContact CZ3-CG2 4.1Å; T150-I154 HydrophobicContact CG2-CD1 4.3Å; T150-I154 PolarHBondContact O-N 3.16Å; T150-I154 VanDerWaalsContact O-N 3.13Å; R151-I154 PolarHBondContact O-N 3.48Å; Q152-I154 PolarHBondContact O-N 3.36Å; I154-I157 PolarHBondContact O-N 3.29Å; I154-D158 PolarHBondContact O-N 2.87Å; I154-A582 HydrophobicContact CG2-CB 4.02Å; I154-L583 HydrophobicContact CG2-CD2 4.37Å
155	L	92.4	Very high	91.9	Very high	41 Å²	41	38.9 Å²	38.9	22%	0.215	20%	0.196	C	C	.	.	H	α-helix	trans	-64.1	-40.9	173.9	-67.7	174.7	0	0	0	112	R151 Q152 R153 I157 D158 E159 E578 A582	R151-L155 HydrophobicContact CG-CD1 4.17Å; R151-L155 WeakPolarHBondContact O-CG 3.44Å; R151-L155 PolarHBondContact O-N 3.29Å; R151-L155 VanDerWaalsContact O-N 3.12Å; Q152-L155 PolarHBondContact O-N 2.94Å; R153-L155 VanDerWaalsContact C-N 3.35Å; L155-I157 VanDerWaalsContact C-N 3.33Å; L155-I157 PolarHBondContact O-N 3.45Å; L155-D158 WeakPolarHBondContact O-CB 3.48Å; L155-D158 PolarHBondContact O-N 3.42Å; L155-E159 WeakPolarHBondContact O-CB 3.49Å; L155-E159 PolarHBondContact O-N 3.13Å; L155-E578 HydrophobicContact CD2-CB 4.47Å; L155-A582 HydrophobicContact CD2-CB 4.06Å
156	S	93.6	Very high	92.2	Very high	48 Å²	48	40 Å²	40	34%	0.336	20%	0.201	S	C	.	.	H	α-helix	trans	-62.8	-39.6	173.9	-56.5	0	0	0	0	111.8	Q152 R153 E159 N160 L598	Q152-S156 PolarHBondContact O-N 2.98Å; Q152-S156 PolarHBondContact O-OG 2.98Å; Q152-S156 VanDerWaalsContact O-OG 3.07Å; R153-S156 PolarHBondContact O-N 3.23Å; S156-E159 PolarHBondContact O-N 2.95Å; S156-N160 WeakPolarHBondContact O-CB 3.45Å; S156-N160 PolarHBondContact O-N 3.1Å; S156-L598 WeakPolarHBondContact O-CD2 3.2Å
157	I	93.6	Very high	92.4	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-62.4	-45.5	174.5	-69.1	160.8	0	0	0	110.7	L102 R106 R153 I154 L155 N160 L161 V586 P593 W595 L598	L102-I157 HydrophobicContact CD2-CD1 4.23Å; L102-I157 HydrophobicContact CD2-CG1 4.17Å; R106-I157 HydrophobicContact CB-CD1 4.02Å; R153-I157 WeakPolarHBondContact O-CD1 3.23Å; R153-I157 VanDerWaalsContact O-CG1 3.23Å; R153-I157 WeakPolarHBondContact O-CG1 3.43Å; R153-I157 PolarHBondContact O-N 3.42Å; I154-I157 PolarHBondContact O-N 3.29Å; L155-I157 VanDerWaalsContact C-N 3.33Å; L155-I157 PolarHBondContact O-N 3.45Å; I157-N160 PolarHBondContact O-N 2.94Å; I157-L161 HydrophobicContact CG2-CD1 3.76Å; I157-L161 HydrophobicContact CG2-CG 4.39Å; I157-L161 WeakPolarHBondContact O-CB 3.37Å; I157-L161 VanDerWaalsContact O-CG 3.26Å; I157-L161 WeakPolarHBondContact O-CG 3.34Å; I157-L161 PolarHBondContact O-N 3.27Å; I157-V586 HydrophobicContact CG2-CG2 3.81Å; I157-P593 HydrophobicContact CG2-CB 4.33Å; I157-P593 HydrophobicContact CG2-CG 3.81Å; I157-W595 HydrophobicContact CD1-CZ3 4.47Å; I157-L598 HydrophobicContact CG1-CD1 4.01Å
158	D	94.3	Very high	92.6	Very high	9 Å²	9	45.7 Å²	45.7	5%	0.048	22%	0.218	C	C	.	.	H	α-helix	trans	-58.2	-47.9	174.4	170.5	72.8	0	0	0	111.6	I154 L155 N160 L161 R162 A582 R585	I154-D158 PolarHBondContact O-N 2.87Å; L155-D158 WeakPolarHBondContact O-CB 3.48Å; L155-D158 PolarHBondContact O-N 3.42Å; D158-N160 VanDerWaalsContact C-N 3.34Å; D158-N160 PolarHBondContact O-N 3.01Å; D158-L161 PolarHBondContact O-N 3.42Å; D158-R162 WeakPolarHBondContact O-CB 3.39Å; D158-R162 PolarHBondContact O-N 3.46Å; D158-A582 HydrophobicContact CB-CB 3.51Å; D158-R585 WeakPolarHBondContact OD1-CD 3.24Å; D158-R585 IonicContact OD1-CZ 3.67Å; D158-R585 IonicContact OD1-NE 3.15Å; D158-R585 PolarHBondContact OD1-NE 2.93Å
159	E	95.1	Very high	93	Very high	105 Å²	105	40.3 Å²	40.3	49%	0.491	19%	0.193	S	C	.	.	H	α-helix	trans	-62.1	-41.5	-179.4	-177.8	165.5	-149.5	0	0	112.3	L155 S156 R162 S163	L155-E159 WeakPolarHBondContact O-CB 3.49Å; L155-E159 PolarHBondContact O-N 3.13Å; S156-E159 PolarHBondContact O-N 2.95Å; E159-R162 PolarHBondContact O-N 3.39Å; E159-S163 VanDerWaalsContact O-CB 3.3Å; E159-S163 WeakPolarHBondContact O-CB 3.43Å; E159-S163 PolarHBondContact O-N 3.21Å; E159-S163 PolarHBondContact O-OG 3.26Å
160	N	94.9	Very high	93.2	Very high	17 Å²	17	45.6 Å²	45.6	9%	0.091	21%	0.211	C	C	.	.	H	α-helix	trans	-63	-49.9	175.2	179.7	-86.9	0	0	0	111.2	S156 I157 D158 R162 S163 Q164 G594 L598	S156-N160 WeakPolarHBondContact O-CB 3.45Å; S156-N160 PolarHBondContact O-N 3.1Å; I157-N160 PolarHBondContact O-N 2.94Å; D158-N160 VanDerWaalsContact C-N 3.34Å; D158-N160 PolarHBondContact O-N 3.01Å; N160-R162 VanDerWaalsContact C-N 3.35Å; N160-R162 PolarHBondContact O-N 2.69Å; N160-S163 PolarHBondContact O-N 3.35Å; N160-Q164 WeakPolarHBondContact O-CG 3.39Å; N160-Q164 PolarHBondContact O-N 3.13Å; N160-Q164 PolarHBondContact OD1-NE2 2.86Å; N160-G594 PolarHBondContact OD1-N 3.45Å; N160-L598 HydrophobicContact CB-CD1 4.32Å; N160-L598 HydrophobicContact CB-CD2 3.83Å; N160-L598 HydrophobicContact CB-CG 4.11Å
161	L	93.9	Very high	93.5	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-61	-43.3	177.8	-71.5	167.3	0	0	0	111.7	I157 D158 S163 Q164 L165 R585 V586 T589 M591 P593	I157-L161 HydrophobicContact CG2-CD1 3.76Å; I157-L161 HydrophobicContact CG2-CG 4.39Å; I157-L161 WeakPolarHBondContact O-CB 3.37Å; I157-L161 VanDerWaalsContact O-CG 3.26Å; I157-L161 WeakPolarHBondContact O-CG 3.34Å; I157-L161 PolarHBondContact O-N 3.27Å; D158-L161 PolarHBondContact O-N 3.42Å; L161-S163 PolarHBondContact O-N 3.28Å; L161-Q164 WeakPolarHBondContact O-CB 3.45Å; L161-Q164 PolarHBondContact O-N 2.96Å; L161-L165 PolarHBondContact O-N 3.2Å; L161-R585 HydrophobicContact CB-CG 4.31Å; L161-R585 HydrophobicContact CD1-CG 4.37Å; L161-V586 HydrophobicContact CD1-CG2 4.12Å; L161-T589 HydrophobicContact CD1-CG2 3.98Å; L161-T589 HydrophobicContact CD2-CG2 4.18Å; L161-M591 HydrophobicContact CD2-CB 3.95Å; L161-M591 WeakPolarHBondContact O-CE 3.16Å; L161-P593 HydrophobicContact CD1-CG 4.41Å; L161-P593 HydrophobicContact CD2-CG 4.13Å; L161-P593 HydrophobicContact CG-CG 4.31Å
162	R	95.3	Very high	93.8	Very high	77 Å²	77	47.1 Å²	47.1	29%	0.291	22%	0.224	S	C	.	.	H	α-helix	trans	-62.3	-42.8	177	-176.9	177.9	65.8	-179.6	-2.8	111.3	D158 E159 N160 L165 F166	D158-R162 WeakPolarHBondContact O-CB 3.39Å; D158-R162 PolarHBondContact O-N 3.46Å; E159-R162 PolarHBondContact O-N 3.39Å; N160-R162 VanDerWaalsContact C-N 3.35Å; N160-R162 PolarHBondContact O-N 2.69Å; R162-L165 WeakPolarHBondContact O-CB 3.36Å; R162-L165 PolarHBondContact O-N 3.12Å; R162-F166 HydrophobicContact CG-CD1 4.32Å; R162-F166 HydrophobicContact CG-CD2 4.13Å; R162-F166 HydrophobicContact CG-CE1 3.81Å; R162-F166 HydrophobicContact CG-CE2 3.6Å; R162-F166 HydrophobicContact CG-CG 4.47Å; R162-F166 HydrophobicContact CG-CZ 3.43Å; R162-F166 VanDerWaalsContact CG-CZ 3.43Å; R162-F166 WeakPolarHBondContact O-CB 3.41Å; R162-F166 WeakPolarHBondContact O-CD1 3.42Å; R162-F166 VanDerWaalsContact O-CG 3.25Å; R162-F166 WeakPolarHBondContact O-CG 3.38Å; R162-F166 PolarHBondContact O-N 2.92Å
163	S	94.4	Very high	94	Very high	50 Å²	50	47.7 Å²	47.7	35%	0.35	23%	0.225	S	C	.	.	H	α-helix	trans	-64.6	-41.4	176.7	-61.3	0	0	0	0	111.7	E159 N160 L161 F166 N167	E159-S163 VanDerWaalsContact O-CB 3.3Å; E159-S163 WeakPolarHBondContact O-CB 3.43Å; E159-S163 PolarHBondContact O-N 3.21Å; E159-S163 PolarHBondContact O-OG 3.26Å; N160-S163 PolarHBondContact O-N 3.35Å; L161-S163 PolarHBondContact O-N 3.28Å; S163-F166 PolarHBondContact O-N 3.37Å; S163-N167 WeakPolarHBondContact O-CB 3.48Å; S163-N167 PolarHBondContact O-N 3.26Å; S163-N167 PolarHBondContact O-ND2 3.39Å
164	Q	93.5	Very high	94.1	Very high	45 Å²	45	47.3 Å²	47.3	21%	0.21	22%	0.224	C	C	.	.	H	α-helix	trans	-59.2	-46.7	172.6	-70.7	-173.2	61.9	0	0	111.8	N160 L161 F166 N167 R168 M591 E592	N160-Q164 WeakPolarHBondContact O-CG 3.39Å; N160-Q164 PolarHBondContact O-N 3.13Å; N160-Q164 PolarHBondContact OD1-NE2 2.86Å; L161-Q164 WeakPolarHBondContact O-CB 3.45Å; L161-Q164 PolarHBondContact O-N 2.96Å; Q164-F166 PolarHBondContact O-N 3.08Å; Q164-N167 PolarHBondContact O-N 3.14Å; Q164-R168 WeakPolarHBondContact O-CG 3.1Å; Q164-R168 PolarHBondContact O-N 3.37Å; Q164-R168 VanDerWaalsContact O-N 3.12Å; Q164-M591 HydrophobicContact CB-SD 4.22Å; Q164-E592 PolarHBondContact NE2-O 2.9Å
165	L	95.1	Very high	94.3	Very high	2 Å²	2	47.2 Å²	47.2	1%	0.01	22%	0.224	C	C	.	.	H	α-helix	trans	-58.6	-48.5	175.8	177.8	63.2	0	0	0	111.2	L161 R162 N167 R168 A169 I195 Q205 D207 L208 M591	L161-L165 PolarHBondContact O-N 3.2Å; R162-L165 WeakPolarHBondContact O-CB 3.36Å; R162-L165 PolarHBondContact O-N 3.12Å; L165-N167 VanDerWaalsContact C-N 3.32Å; L165-N167 PolarHBondContact O-N 2.99Å; L165-R168 PolarHBondContact O-N 2.94Å; L165-A169 VanDerWaalsContact O-CB 3.25Å; L165-A169 WeakPolarHBondContact O-CB 3.38Å; L165-A169 PolarHBondContact O-N 3.07Å; L165-I195 HydrophobicContact CD1-CG2 4.25Å; L165-I195 HydrophobicContact CD2-CG2 4.3Å; L165-Q205 HydrophobicContact CD1-CG 4.1Å; L165-D207 HydrophobicContact CD1-CB 3.84Å; L165-D207 HydrophobicContact CD2-CB 3.9Å; L165-D207 HydrophobicContact CG-CB 4.45Å; L165-L208 WeakPolarHBondContact CD2-O 3.06Å; L165-M591 HydrophobicContact CB-CE 3.78Å
166	F	95.5	Very high	94.4	Very high	25 Å²	25	45.3 Å²	45.3	11%	0.11	21%	0.214	C	C	.	.	H	α-helix	trans	-67.4	-34.3	-176.6	-68.4	-0.3	0	0	0	112.3	R162 S163 Q164 A169 R170 L209 T233 A234	R162-F166 HydrophobicContact CG-CD1 4.32Å; R162-F166 HydrophobicContact CG-CD2 4.13Å; R162-F166 HydrophobicContact CG-CE1 3.81Å; R162-F166 HydrophobicContact CG-CE2 3.6Å; R162-F166 HydrophobicContact CG-CG 4.47Å; R162-F166 HydrophobicContact CG-CZ 3.43Å; R162-F166 VanDerWaalsContact CG-CZ 3.43Å; R162-F166 WeakPolarHBondContact O-CB 3.41Å; R162-F166 WeakPolarHBondContact O-CD1 3.42Å; R162-F166 VanDerWaalsContact O-CG 3.25Å; R162-F166 WeakPolarHBondContact O-CG 3.38Å; R162-F166 PolarHBondContact O-N 2.92Å; S163-F166 PolarHBondContact O-N 3.37Å; Q164-F166 PolarHBondContact O-N 3.08Å; F166-A169 PolarHBondContact O-N 3.24Å; F166-R170 WeakPolarHBondContact O-CG 3.05Å; F166-R170 PolarHBondContact O-N 3.49Å; F166-L209 HydrophobicContact CE1-CD1 4.13Å; F166-T233 HydrophobicContact CE2-CG2 3.8Å; F166-T233 HydrophobicContact CZ-CG2 4.47Å; F166-A234 HydrophobicContact CD1-CB 3.57Å; F166-A234 HydrophobicContact CE1-CB 3.64Å; F166-A234 HydrophobicContact CG-CB 4.12Å; F166-A234 HydrophobicContact CZ-CB 4.22Å
167	N	93.6	Very high	94.5	Very high	92 Å²	92	43 Å²	43	49%	0.492	20%	0.198	S	C	.	.	H	α-helix	trans	-62.5	-46.1	172.8	-72.7	-24.4	0	0	0	111	S163 Q164 L165	S163-N167 WeakPolarHBondContact O-CB 3.48Å; S163-N167 PolarHBondContact O-N 3.26Å; S163-N167 PolarHBondContact O-ND2 3.39Å; Q164-N167 PolarHBondContact O-N 3.14Å; L165-N167 VanDerWaalsContact C-N 3.32Å; L165-N167 PolarHBondContact O-N 2.99Å
168	R	93.4	Very high	94.5	Very high	114 Å²	114	43 Å²	43	43%	0.43	20%	0.198	S	C	.	.	H	α-helix	trans	-66.2	-38.5	175.1	-66.2	178.1	-174.3	-169.5	1	112.4	Q164 L165 R170 D171 F172	Q164-R168 WeakPolarHBondContact O-CG 3.1Å; Q164-R168 PolarHBondContact O-N 3.37Å; Q164-R168 VanDerWaalsContact O-N 3.12Å; L165-R168 PolarHBondContact O-N 2.94Å; R168-R170 PolarHBondContact O-N 3.46Å; R168-D171 PolarHBondContact O-N 3.07Å; R168-F172 HydrophobicContact CB-CE1 4.07Å; R168-F172 HydrophobicContact CB-CZ 4.27Å; R168-F172 WeakPolarHBondContact O-CD1 3.46Å; R168-F172 PolarHBondContact O-N 3.3Å
169	A	95.3	Very high	94.4	Very high	1 Å²	1	42.8 Å²	42.8	1%	0.008	20%	0.197	C	C	.	.	H	α-helix	trans	-60.2	-33.8	-174.8	0	0	0	0	0	113.5	L165 F166 D171 F172 L236	L165-A169 VanDerWaalsContact O-CB 3.25Å; L165-A169 WeakPolarHBondContact O-CB 3.38Å; L165-A169 PolarHBondContact O-N 3.07Å; F166-A169 PolarHBondContact O-N 3.24Å; A169-D171 PolarHBondContact O-N 3.46Å; A169-F172 HydrophobicContact CB-CD2 4.12Å; A169-F172 HydrophobicContact CB-CE2 3.9Å; A169-F172 WeakPolarHBondContact O-CB 3.32Å; A169-F172 PolarHBondContact O-N 2.98Å; A169-L236 HydrophobicContact CB-CD1 4.38Å; A169-L236 HydrophobicContact CB-CD2 3.94Å; A169-L236 HydrophobicContact CB-CG 4.07Å; A169-L236 WeakPolarHBondContact O-CD2 3.28Å
170	R	94.7	Very high	94	Very high	137 Å²	137	38.2 Å²	38.2	52%	0.517	18%	0.175	S	C	.	.	H	α-helix	trans	-61.4	-30.8	176.3	-68.8	167	-175.4	-177.7	2.7	112.7	F166 R168 R240	F166-R170 WeakPolarHBondContact O-CG 3.05Å; F166-R170 PolarHBondContact O-N 3.49Å; R168-R170 PolarHBondContact O-N 3.46Å; R170-R240 PolarHBondContact O-NH1 3.14Å
171	D	94	Very high	93.3	Very high	103 Å²	103	38.3 Å²	38.3	55%	0.551	18%	0.176	S	C	*	.	H	α-helix	trans	-93.3	-8.5	-176.8	-66.7	-33.5	0	0	0	113.7	R168 A169 K173	R168-D171 PolarHBondContact O-N 3.07Å; A169-D171 PolarHBondContact O-N 3.46Å; D171-K173 PolarHBondContact O-N 3.45Å
172	F	95.3	Very high	92.3	Very high	5 Å²	5	38.7 Å²	38.7	2%	0.022	18%	0.178	C	C	.	.			trans	-56	128.8	177	-67.2	-18.6	0	0	0	111.5	R168 A169 I195 V198 Q205 L236 R240	R168-F172 HydrophobicContact CB-CE1 4.07Å; R168-F172 HydrophobicContact CB-CZ 4.27Å; R168-F172 WeakPolarHBondContact O-CD1 3.46Å; R168-F172 PolarHBondContact O-N 3.3Å; A169-F172 HydrophobicContact CB-CD2 4.12Å; A169-F172 HydrophobicContact CB-CE2 3.9Å; A169-F172 WeakPolarHBondContact O-CB 3.32Å; A169-F172 PolarHBondContact O-N 2.98Å; F172-I195 HydrophobicContact CD2-CD1 4.25Å; F172-I195 HydrophobicContact CE2-CD1 3.99Å; F172-I195 HydrophobicContact CE2-CG1 4.5Å; F172-V198 CarbonylContact C-O 3.56Å; F172-V198 VanDerWaalsContact CA-O 3.28Å; F172-V198 WeakPolarHBondContact CA-O 3.36Å; F172-Q205 HydrophobicContact CE1-CB 4.18Å; F172-Q205 HydrophobicContact CZ-CB 3.9Å; F172-Q205 HydrophobicContact CZ-CG 4.32Å; F172-L236 HydrophobicContact CD2-CD2 4.01Å; F172-R240 WeakPolarHBondContact O-CD 3.34Å; F172-R240 PolarHBondContact O-NH1 3.33Å
173	K	93.1	Very high	90.7	Very high	120 Å²	120	35.6 Å²	35.6	52%	0.522	17%	0.169	S	C	.	.	S	Bend	trans	-77.6	-32.3	172.7	-61.9	-52.4	-172.8	-161	0	111.8	D171 V198 C545	D171-K173 PolarHBondContact O-N 3.45Å; K173-V198 PolarHBondContact N-O 3.41Å; K173-C545 HydrophobicContact CB-CB 4.22Å
174	A	93.8	Very high	89.2	Confident	1 Å²	1	34.4 Å²	34.4	1%	0.008	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	150.8	178.3	0	0	0	0	0	109.6	V198 R240 V242 C545 K546	A174-V198 PolarHBondContact O-N 2.85Å; A174-R240 WeakPolarHBondContact CA-O 3.35Å; A174-V242 HydrophobicContact CB-CG2 3.74Å; A174-C545 HydrophobicContact CB-CB 4.46Å; A174-K546 HydrophobicContact CB-CG 4.15Å
175	Y	95.4	Very high	86.9	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	161.7	170.8	69.8	-86.8	0	0	0	111.8	L177 I195 R196 L231 L236 S237 R240 M241 V242	Y175-L177 HydrophobicContact CD2-CD2 4.15Å; Y175-L177 HydrophobicContact CD2-CG 4.4Å; Y175-L177 HydrophobicContact CE2-CD2 4.21Å; Y175-L177 HydrophobicContact CE2-CG 4.23Å; Y175-I195 HydrophobicContact CD2-CD1 4.07Å; Y175-I195 HydrophobicContact CD2-CG1 4.33Å; Y175-I195 HydrophobicContact CG-CD1 4.19Å; Y175-R196 CarbonylContact C-O 3.47Å; Y175-R196 WeakPolarHBondContact CA-O 3.17Å; Y175-R196 WeakPolarHBondContact CB-O 3.3Å; Y175-L231 HydrophobicContact CE2-CD2 3.99Å; Y175-L236 HydrophobicContact CD1-CD2 3.77Å; Y175-L236 HydrophobicContact CE1-CB 4.12Å; Y175-L236 HydrophobicContact CE1-CD2 3.87Å; Y175-L236 HydrophobicContact CG-CD2 4.24Å; Y175-S237 WeakPolarHBondContact CE1-O 3.18Å; Y175-S237 PolarHBondContact OH-O 3.04Å; Y175-R240 HydrophobicContact CD1-CB 4Å; Y175-R240 HydrophobicContact CE1-CB 3.89Å; Y175-R240 PolarHBondContact N-O 3.16Å; Y175-M241 HydrophobicContact CD2-CG 4.43Å; Y175-M241 HydrophobicContact CE1-CB 4.32Å; Y175-M241 HydrophobicContact CE2-CB 3.91Å; Y175-M241 HydrophobicContact CE2-CG 3.88Å; Y175-M241 HydrophobicContact CE2-SD 4.29Å; Y175-M241 CarbonylContact O-C 3.54Å; Y175-M241 WeakPolarHBondContact O-CA 3.28Å; Y175-V242 PolarHBondContact O-N 2.83Å
176	S	95.4	Very high	84.7	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	160.3	167.1	-56.1	0	0	0	0	110.4	I195 R196 G243 S549	S176-I195 WeakPolarHBondContact O-CA 3.04Å; S176-R196 PolarHBondContact N-O 2.81Å; S176-R196 PolarHBondContact O-N 3.32Å; S176-G243 WeakPolarHBondContact CA-O 3.35Å; S176-G243 WeakPolarHBondContact CB-O 3.41Å; S176-G243 VanDerWaalsContact OG-CA 3.26Å; S176-G243 WeakPolarHBondContact OG-CA 3.27Å; S176-G243 PolarHBondContact OG-N 3.19Å; S176-S549 WeakPolarHBondContact CB-O 3.48Å; S176-S549 PolarHBondContact OG-O 3.23Å
177	L	95.5	Very high	82.9	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	144.5	172.9	-59.4	-178.6	0	0	0	111.2	Y175 L179 V193 F194 I195 L209 I227 L231 M241 G243 L244 T245 M263	Y175-L177 HydrophobicContact CD2-CD2 4.15Å; Y175-L177 HydrophobicContact CD2-CG 4.4Å; Y175-L177 HydrophobicContact CE2-CD2 4.21Å; Y175-L177 HydrophobicContact CE2-CG 4.23Å; L177-L179 HydrophobicContact CB-CD2 4.4Å; L177-V193 HydrophobicContact CD1-CG1 4.43Å; L177-V193 HydrophobicContact CD2-CG1 4.42Å; L177-F194 VanDerWaalsContact CA-O 3.27Å; L177-F194 WeakPolarHBondContact CA-O 3.29Å; L177-I195 HydrophobicContact CD2-CB 4.09Å; L177-I195 HydrophobicContact CD2-CG1 4.23Å; L177-L209 HydrophobicContact CD2-CD2 4.13Å; L177-I227 HydrophobicContact CD1-CG2 4.11Å; L177-L231 HydrophobicContact CD1-CD1 4.35Å; L177-L231 HydrophobicContact CD1-CD2 4.16Å; L177-L231 HydrophobicContact CD2-CD2 4.25Å; L177-M241 HydrophobicContact CD1-SD 4.4Å; L177-G243 PolarHBondContact N-O 3.29Å; L177-G243 VanDerWaalsContact N-O 3.09Å; L177-L244 HydrophobicContact CB-CD1 3.93Å; L177-L244 CarbonylContact O-C 3.48Å; L177-L244 WeakPolarHBondContact O-CA 3.45Å; L177-T245 PolarHBondContact O-N 3.39Å; L177-M263 HydrophobicContact CD1-CE 3.8Å
178	A	93.3	Very high	81.3	Confident	1 Å²	1	32.9 Å²	32.9	1%	0.008	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	123.9	165.2	0	0	0	0	0	109.4	V193 F194 T245 F551	A178-V193 WeakPolarHBondContact O-CA 3.29Å; A178-F194 HydrophobicContact CB-CB 4.18Å; A178-F194 HydrophobicContact CB-CD2 4.33Å; A178-F194 PolarHBondContact N-O 2.9Å; A178-F194 PolarHBondContact O-N 3.09Å; A178-T245 WeakPolarHBondContact CA-OG1 3.29Å; A178-T245 WeakPolarHBondContact CB-OG1 3.38Å; A178-F551 HydrophobicContact CB-CD1 4.46Å; A178-F551 HydrophobicContact CB-CD2 4.18Å; A178-F551 HydrophobicContact CB-CE1 4.05Å; A178-F551 HydrophobicContact CB-CE2 3.74Å; A178-F551 HydrophobicContact CB-CZ 3.66Å
179	L	91.8	Very high	80.5	Confident	4 Å²	4	31.2 Å²	31.2	2%	0.021	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	109	-177	-58.3	-170.6	0	0	0	109.6	L177 L191 V193 I227 L244 T245 T246 T247 M252 L259 M263	L177-L179 HydrophobicContact CB-CD2 4.4Å; L179-L191 HydrophobicContact CB-CD1 3.98Å; L179-V193 HydrophobicContact CD2-CB 4.3Å; L179-V193 HydrophobicContact CD2-CG1 3.82Å; L179-V193 HydrophobicContact CD2-CG2 3.98Å; L179-I227 HydrophobicContact CD1-CD1 4.24Å; L179-I227 HydrophobicContact CD2-CD1 4.12Å; L179-L244 HydrophobicContact CD1-CD1 3.7Å; L179-L244 HydrophobicContact CD1-CG 4.45Å; L179-L244 HydrophobicContact CG-CD1 3.73Å; L179-T245 PolarHBondContact N-O 3.3Å; L179-T246 HydrophobicContact CB-CG2 4.15Å; L179-T246 HydrophobicContact CD1-CG2 4.33Å; L179-T246 WeakPolarHBondContact O-CA 3.37Å; L179-T247 PolarHBondContact O-N 2.83Å; L179-M252 HydrophobicContact CB-SD 4.43Å; L179-M252 HydrophobicContact CD1-SD 4.43Å; L179-L259 HydrophobicContact CD1-CD2 3.54Å; L179-L259 HydrophobicContact CD1-CG 4.21Å; L179-M263 HydrophobicContact CD1-SD 4.01Å
180	D	86.8	Confident	80	Confident	8 Å²	8	32.7 Å²	32.7	4%	0.043	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	104.8	-176.9	-157.6	-27.4	0	0	0	111.5	Q182 L191 L192 F194 T247 H283	D180-Q182 WeakPolarHBondContact OD1-CB 3.22Å; D180-Q182 PolarHBondContact OD1-N 2.97Å; D180-Q182 VanDerWaalsContact OD1-N 3.1Å; D180-L191 WeakPolarHBondContact O-CA 3.25Å; D180-L191 WeakPolarHBondContact O-CD1 3.5Å; D180-L192 HydrophobicContact CB-CB 4.35Å; D180-L192 PolarHBondContact N-O 2.91Å; D180-L192 PolarHBondContact O-N 3.33Å; D180-F194 HydrophobicContact CB-CE2 4.39Å; D180-T247 WeakPolarHBondContact OD1-CG2 3.26Å; D180-H283 VanDerWaalsContact CG-NE2 3.3Å; D180-H283 IonicContact OD1-NE2 3.23Å; D180-H283 PolarHBondContact OD1-NE2 3.42Å; D180-H283 IonicContact OD2-CD2 3.23Å; D180-H283 IonicContact OD2-CE1 3.26Å; D180-H283 IonicContact OD2-NE2 3.08Å; D180-H283 PolarHBondContact OD2-NE2 3.01Å
181	D	80.6	Confident	79.7	Confident	19 Å²	19	26.1 Å²	26.1	10%	0.102	14%	0.136	C	C	.	.			trans	-105.2	20.4	175.1	74.7	-19	0	0	0	113.3	A183 L191 T247 T249 M252	D181-A183 PolarHBondContact O-N 3.3Å; D181-L191 HydrophobicContact CB-CD1 4.24Å; D181-T247 VanDerWaalsContact OD1-CB 3.27Å; D181-T247 WeakPolarHBondContact OD1-CB 3.48Å; D181-T247 WeakPolarHBondContact OD1-CG2 3.4Å; D181-T247 PolarHBondContact OD1-OG1 3.11Å; D181-T249 WeakPolarHBondContact OD1-CG2 3.31Å; D181-T249 PolarHBondContact OD1-OG1 3.32Å; D181-T249 PolarHBondContact OD2-OG1 3.09Å; D181-M252 HydrophobicContact CB-CE 3.47Å; D181-M252 VanDerWaalsContact CB-CE 3.47Å; D181-M252 WeakPolarHBondContact OD2-CE 3.27Å
182	Q	72.8	Confident	79.6	Confident	9 Å²	9	21.8 Å²	21.8	4%	0.042	11%	0.112	C	C	.	.			trans	-58.6	132.6	175.6	-79.9	-151.7	-22.6	0	0	111	D180 F184 T247 H283 E285 L286	D180-Q182 WeakPolarHBondContact OD1-CB 3.22Å; D180-Q182 PolarHBondContact OD1-N 2.97Å; D180-Q182 VanDerWaalsContact OD1-N 3.1Å; Q182-F184 HydrophobicContact CB-CE1 4.03Å; Q182-F184 HydrophobicContact CB-CE2 4.22Å; Q182-F184 HydrophobicContact CB-CZ 3.66Å; Q182-F184 VanDerWaalsContact O-CD2 3.31Å; Q182-F184 WeakPolarHBondContact O-CD2 3.03Å; Q182-F184 VanDerWaalsContact O-CE2 3.26Å; Q182-F184 WeakPolarHBondContact O-CE2 3.48Å; Q182-T247 HydrophobicContact CG-CG2 3.89Å; Q182-H283 PolarHBondContact NE2-CE1 3.48Å; Q182-H283 VanDerWaalsContact NE2-CG 3.32Å; Q182-H283 PolarHBondContact NE2-ND1 3.05Å; Q182-H283 PolarHBondContact OE1-CE1 2.88Å; Q182-H283 PolarHBondContact OE1-ND1 3.45Å; Q182-E285 PolarHBondContact NE2-OE1 2.94Å; Q182-E285 VanDerWaalsContact NE2-OE1 3.08Å; Q182-L286 HydrophobicContact CG-CD1 4.24Å
183	A	62.3	Low	79.6	Confident	12 Å²	12	21.5 Å²	21.5	10%	0.099	11%	0.111	C	C	.	.			trans	-76.6	127.2	178.2	0	0	0	0	0	110.5	D181 E188 N340	D181-A183 PolarHBondContact O-N 3.3Å; A183-E188 HydrophobicContact CB-CB 4.38Å; A183-E188 HydrophobicContact CB-CG 4.42Å; A183-N340 PolarHBondContact O-ND2 2.84Å
184	F	61.9	Low	79.8	Confident	24 Å²	24	15.8 Å²	15.8	11%	0.105	9%	0.086	C	C	.	.	B	Isolated β-bridge	trans	-119.7	159.3	175	-54.5	-64.2	0	0	0	112.2	Q182 A186 Y187 E188 F561 L564	Q182-F184 HydrophobicContact CB-CE1 4.03Å; Q182-F184 HydrophobicContact CB-CE2 4.22Å; Q182-F184 HydrophobicContact CB-CZ 3.66Å; Q182-F184 VanDerWaalsContact O-CD2 3.31Å; Q182-F184 WeakPolarHBondContact O-CD2 3.03Å; Q182-F184 VanDerWaalsContact O-CE2 3.26Å; Q182-F184 WeakPolarHBondContact O-CE2 3.48Å; F184-A186 PolarHBondContact O-N 2.9Å; F184-Y187 CarbonylContact O-C 3.44Å; F184-Y187 PolarHBondContact O-N 3.5Å; F184-E188 WeakPolarHBondContact O-CG 3.27Å; F184-E188 PolarHBondContact O-N 3.26Å; F184-F561 AromaticContact CD1-CD2 3.98Å; F184-F561 HydrophobicContact CD1-CD2 3.98Å; F184-F561 AromaticContact CD1-CE2 3.75Å; F184-F561 HydrophobicContact CD1-CE2 3.75Å; F184-F561 AromaticContact CE1-CD2 3.2Å; F184-F561 HydrophobicContact CE1-CD2 3.2Å; F184-F561 AromaticContact CE1-CE2 3.32Å; F184-F561 HydrophobicContact CE1-CE2 3.32Å; F184-F561 AromaticContact CZ-CD2 3.74Å; F184-F561 HydrophobicContact CZ-CD2 3.74Å; F184-F561 HydrophobicContact CZ-CE2 4.3Å; F184-L564 HydrophobicContact CB-CD2 3.28Å; F184-L564 HydrophobicContact CB-CG 4.49Å; F184-L564 HydrophobicContact CD1-CD2 3.98Å; F184-L564 HydrophobicContact CD2-CD2 3.41Å; F184-L564 VanDerWaalsContact CD2-CD2 3.41Å; F184-L564 HydrophobicContact CE2-CD2 4.23Å; F184-L564 HydrophobicContact CG-CD2 3.25Å
185	V	46.3	Very low	79.9	Confident	10 Å²	10	15.8 Å²	15.8	6%	0.061	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	127.8	-179.6	-176.7	0	0	0	0	109.2	Y187 H329 R332 C337 Q568	V185-Y187 PolarHBondContact O-N 3.34Å; V185-H329 HydrophobicContact CG2-CB 4.25Å; V185-R332 HydrophobicContact CG1-CB 3.97Å; V185-R332 WeakPolarHBondContact CG1-O 3.5Å; V185-C337 HydrophobicContact CG2-CB 3.44Å; V185-C337 VanDerWaalsContact CG2-CB 3.44Å; V185-C337 WeakPolarHBondContact CG2-SG 3.4Å; V185-C337 PolarHBondContact N-SG 3.44Å; V185-Q568 HydrophobicContact CB-CG 4.44Å
186	A	48.1	Very low	79.8	Confident	45 Å²	45	16.3 Å²	16.3	37%	0.372	9%	0.088	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.7	-8.1	-172.7	0	0	0	0	0	116.7	F184 S572	F184-A186 PolarHBondContact O-N 2.9Å; A186-S572 VanDerWaalsContact CB-CB 3.44Å
187	Y	57.8	Low	79.8	Confident	17 Å²	17	16.3 Å²	16.3	7%	0.067	9%	0.088	C	C	.	.	B	Isolated β-bridge	trans	-134.9	46.8	-176.5	-67.8	-78.8	0	0	0	112.1	F184 V185 N189 Y190 L564 L571 L580	F184-Y187 CarbonylContact O-C 3.44Å; F184-Y187 PolarHBondContact O-N 3.5Å; V185-Y187 PolarHBondContact O-N 3.34Å; Y187-N189 PolarHBondContact O-N 3.38Å; Y187-Y190 AromaticContact CD1-CD2 3.67Å; Y187-Y190 HydrophobicContact CD1-CD2 3.67Å; Y187-Y190 AromaticContact CD1-CE2 3.45Å; Y187-Y190 HydrophobicContact CD1-CE2 3.45Å; Y187-Y190 VanDerWaalsContact CD1-CE2 3.45Å; Y187-Y190 HydrophobicContact CE1-CE2 4.09Å; Y187-Y190 HydrophobicContact CG-CD2 4.39Å; Y187-Y190 HydrophobicContact CG-CE2 4.48Å; Y187-L564 HydrophobicContact CD2-CD1 3.84Å; Y187-L564 HydrophobicContact CE2-CD1 4.23Å; Y187-L571 HydrophobicContact CE2-CB 3.79Å; Y187-L571 WeakPolarHBondContact CE2-O 3.48Å; Y187-L571 PolarHBondContact OH-O 3.06Å; Y187-L580 HydrophobicContact CD1-CD1 4.15Å; Y187-L580 HydrophobicContact CD1-CD2 3.66Å; Y187-L580 HydrophobicContact CE1-CD1 3.47Å; Y187-L580 VanDerWaalsContact CE1-CD1 3.47Å; Y187-L580 HydrophobicContact CE1-CD2 3.47Å; Y187-L580 VanDerWaalsContact CE1-CD2 3.47Å; Y187-L580 HydrophobicContact CE1-CG 4.07Å; Y187-L580 HydrophobicContact CE2-CD1 4.37Å
188	E	60.6	Low	79.7	Confident	61 Å²	61	16.3 Å²	16.3	29%	0.285	9%	0.088	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-9.4	-174.8	-62.9	176.7	-164.8	0	0	114.3	A183 F184 N334	A183-E188 HydrophobicContact CB-CB 4.38Å; A183-E188 HydrophobicContact CB-CG 4.42Å; F184-E188 WeakPolarHBondContact O-CG 3.27Å; F184-E188 PolarHBondContact O-N 3.26Å; E188-N334 WeakPolarHBondContact OE1-CB 2.87Å; E188-N334 VanDerWaalsContact OE1-CG 3.29Å; E188-N334 PolarHBondContact OE1-ND2 3.08Å; E188-N334 PolarHBondContact OE2-ND2 3.44Å
189	N	76.1	Confident	79.7	Confident	79 Å²	79	16.3 Å²	16.3	42%	0.422	9%	0.088	S	C	.	.	T	Hydrogen-bonded Turn	trans	-125.8	42.4	-171.5	-65.3	-42.3	0	0	0	111	Y187 N213 L214 T215	Y187-N189 PolarHBondContact O-N 3.38Å; N189-N213 CarbonylContact O-C 3.47Å; N189-L214 HydrophobicContact CB-CB 4.02Å; N189-L214 WeakPolarHBondContact O-CA 3.28Å; N189-L214 VanDerWaalsContact O-CB 3.27Å; N189-L214 WeakPolarHBondContact O-CB 3.48Å; N189-L214 WeakPolarHBondContact O-CG 3.34Å; N189-L214 PolarHBondContact O-N 3.27Å; N189-T215 VanDerWaalsContact CB-OG1 3.27Å; N189-T215 WeakPolarHBondContact CB-OG1 3.24Å; N189-T215 PolarHBondContact ND2-OG1 3.3Å; N189-T215 VanDerWaalsContact ND2-OG1 3.11Å
190	Y	85.6	Confident	79.4	Confident	31 Å²	31	18.9 Å²	18.9	12%	0.122	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	145.8	172.4	-70.8	-89.5	0	0	0	111.1	Y187 I211 I212 N213 D577 L580	Y187-Y190 AromaticContact CD1-CD2 3.67Å; Y187-Y190 HydrophobicContact CD1-CD2 3.67Å; Y187-Y190 AromaticContact CD1-CE2 3.45Å; Y187-Y190 HydrophobicContact CD1-CE2 3.45Å; Y187-Y190 VanDerWaalsContact CD1-CE2 3.45Å; Y187-Y190 HydrophobicContact CE1-CE2 4.09Å; Y187-Y190 HydrophobicContact CG-CD2 4.39Å; Y187-Y190 HydrophobicContact CG-CE2 4.48Å; Y190-I211 HydrophobicContact CD1-CG2 3.5Å; Y190-I211 VanDerWaalsContact CD1-CG2 3.5Å; Y190-I211 HydrophobicContact CE1-CG2 4.36Å; Y190-I211 HydrophobicContact CG-CG2 4.08Å; Y190-I212 CarbonylContact C-O 3.42Å; Y190-I212 VanDerWaalsContact CA-O 3.31Å; Y190-I212 WeakPolarHBondContact CA-O 3.41Å; Y190-N213 HydrophobicContact CD1-CB 4.02Å; Y190-N213 HydrophobicContact CE1-CB 3.61Å; Y190-N213 PolarHBondContact OH-ND2 3.23Å; Y190-D577 PolarHBondContact OH-OD1 3.42Å; Y190-L580 HydrophobicContact CD1-CD2 4.09Å; Y190-L580 HydrophobicContact CD2-CD2 4.37Å; Y190-L580 HydrophobicContact CE1-CD2 3.78Å; Y190-L580 HydrophobicContact CE2-CD2 4.14Å; Y190-L580 HydrophobicContact CG-CD2 4.33Å
191	L	88.6	Confident	79.3	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	115.5	167.8	166.1	62	0	0	0	107.6	L179 D180 D181 V193 I212 L214 L223 I227 M252 L259	L179-L191 HydrophobicContact CB-CD1 3.98Å; D180-L191 WeakPolarHBondContact O-CA 3.25Å; D180-L191 WeakPolarHBondContact O-CD1 3.5Å; D181-L191 HydrophobicContact CB-CD1 4.24Å; L191-V193 HydrophobicContact CD2-CG2 4.44Å; L191-V193 HydrophobicContact CG-CG2 4.11Å; L191-I212 HydrophobicContact CB-CB 4.32Å; L191-I212 HydrophobicContact CD2-CD1 4.28Å; L191-I212 PolarHBondContact N-O 3.42Å; L191-I212 PolarHBondContact O-N 2.94Å; L191-L214 HydrophobicContact CB-CD2 3.79Å; L191-L214 HydrophobicContact CB-CG 4.38Å; L191-L223 HydrophobicContact CD2-CD2 4.42Å; L191-I227 HydrophobicContact CD2-CD1 4.26Å; L191-M252 HydrophobicContact CD1-CE 3.84Å; L191-M252 HydrophobicContact CD2-CE 4.34Å; L191-L259 HydrophobicContact CD2-CD2 4.36Å
192	L	91.8	Very high	79.6	Confident	11 Å²	11	25.2 Å²	25.2	6%	0.058	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	129.6	172	-67.2	78.6	0	0	0	108.1	D180 F194 A560 F584	D180-L192 HydrophobicContact CB-CB 4.35Å; D180-L192 PolarHBondContact N-O 2.91Å; D180-L192 PolarHBondContact O-N 3.33Å; L192-F194 HydrophobicContact CB-CD2 4.41Å; L192-F194 HydrophobicContact CB-CE2 3.63Å; L192-F194 HydrophobicContact CB-CZ 3.82Å; L192-F194 HydrophobicContact CD2-CE1 4.48Å; L192-F194 HydrophobicContact CD2-CE2 4.15Å; L192-F194 HydrophobicContact CD2-CZ 3.59Å; L192-F194 HydrophobicContact CG-CZ 4.36Å; L192-A560 HydrophobicContact CD2-CB 3.97Å; L192-F584 HydrophobicContact CD2-CD1 3.81Å; L192-F584 HydrophobicContact CD2-CE1 3.78Å
193	V	94.8	Very high	80.3	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	108.9	178	-174.9	0	0	0	0	107.4	L177 A178 L179 L191 L209 T210 I212 I227	L177-V193 HydrophobicContact CD1-CG1 4.43Å; L177-V193 HydrophobicContact CD2-CG1 4.42Å; A178-V193 WeakPolarHBondContact O-CA 3.29Å; L179-V193 HydrophobicContact CD2-CB 4.3Å; L179-V193 HydrophobicContact CD2-CG1 3.82Å; L179-V193 HydrophobicContact CD2-CG2 3.98Å; L191-V193 HydrophobicContact CD2-CG2 4.44Å; L191-V193 HydrophobicContact CG-CG2 4.11Å; V193-L209 HydrophobicContact CB-CB 4.49Å; V193-L209 HydrophobicContact CG1-CB 4.16Å; V193-L209 HydrophobicContact CG1-CD2 3.98Å; V193-L209 WeakPolarHBondContact O-CA 3.28Å; V193-L209 VanDerWaalsContact O-CB 3.32Å; V193-L209 WeakPolarHBondContact O-CB 3.46Å; V193-L209 PolarHBondContact O-N 2.94Å; V193-T210 HydrophobicContact CB-CG2 3.82Å; V193-T210 HydrophobicContact CG1-CG2 4.46Å; V193-T210 HydrophobicContact CG2-CG2 3.88Å; V193-T210 PolarHBondContact N-O 3.41Å; V193-T210 PolarHBondContact O-N 2.87Å; V193-I212 HydrophobicContact CG2-CD1 3.87Å; V193-I212 HydrophobicContact CG2-CG1 4.45Å; V193-I227 HydrophobicContact CG2-CG1 4.27Å
194	F	95.8	Very high	81.6	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	154.6	173.4	-52.9	-82.4	0	0	0	110.5	L177 A178 D180 L192 D207 L208 F551 I556 C557 A560	L177-F194 VanDerWaalsContact CA-O 3.27Å; L177-F194 WeakPolarHBondContact CA-O 3.29Å; A178-F194 HydrophobicContact CB-CB 4.18Å; A178-F194 HydrophobicContact CB-CD2 4.33Å; A178-F194 PolarHBondContact N-O 2.9Å; A178-F194 PolarHBondContact O-N 3.09Å; D180-F194 HydrophobicContact CB-CE2 4.39Å; L192-F194 HydrophobicContact CB-CD2 4.41Å; L192-F194 HydrophobicContact CB-CE2 3.63Å; L192-F194 HydrophobicContact CB-CZ 3.82Å; L192-F194 HydrophobicContact CD2-CE1 4.48Å; L192-F194 HydrophobicContact CD2-CE2 4.15Å; L192-F194 HydrophobicContact CD2-CZ 3.59Å; L192-F194 HydrophobicContact CG-CZ 4.36Å; F194-D207 WeakPolarHBondContact CA-O 3.5Å; F194-L208 HydrophobicContact CD1-CB 4.18Å; F194-L208 HydrophobicContact CD1-CD1 3.85Å; F194-L208 HydrophobicContact CE1-CB 4.29Å; F194-L208 HydrophobicContact CE1-CD1 3.65Å; F194-L208 HydrophobicContact CZ-CD1 4.28Å; F194-F551 HydrophobicContact CB-CZ 4.26Å; F194-I556 HydrophobicContact CB-CD1 4.38Å; F194-I556 HydrophobicContact CB-CG2 4.13Å; F194-I556 HydrophobicContact CD1-CB 4.49Å; F194-I556 HydrophobicContact CD1-CD1 3.53Å; F194-I556 HydrophobicContact CD1-CG1 3.63Å; F194-I556 HydrophobicContact CD1-CG2 4.12Å; F194-I556 HydrophobicContact CD2-CG2 4.47Å; F194-I556 HydrophobicContact CE1-CD1 4.17Å; F194-I556 HydrophobicContact CE1-CG1 3.84Å; F194-I556 HydrophobicContact CG-CD1 4.27Å; F194-I556 HydrophobicContact CG-CG1 4.36Å; F194-I556 HydrophobicContact CG-CG2 3.99Å; F194-C557 HydrophobicContact CE2-CB 4.47Å; F194-A560 HydrophobicContact CE1-CB 4.27Å; F194-A560 HydrophobicContact CZ-CB 3.71Å
195	I	96.2	Very high	83	Confident	1 Å²	1	31.6 Å²	31.6	1%	0.005	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	138.1	174.2	-176.6	165.3	0	0	0	109.8	L165 F172 Y175 S176 L177 E206 D207 L209 L236	L165-I195 HydrophobicContact CD1-CG2 4.25Å; L165-I195 HydrophobicContact CD2-CG2 4.3Å; F172-I195 HydrophobicContact CD2-CD1 4.25Å; F172-I195 HydrophobicContact CE2-CD1 3.99Å; F172-I195 HydrophobicContact CE2-CG1 4.5Å; Y175-I195 HydrophobicContact CD2-CD1 4.07Å; Y175-I195 HydrophobicContact CD2-CG1 4.33Å; Y175-I195 HydrophobicContact CG-CD1 4.19Å; S176-I195 WeakPolarHBondContact O-CA 3.04Å; L177-I195 HydrophobicContact CD2-CB 4.09Å; L177-I195 HydrophobicContact CD2-CG1 4.23Å; I195-E206 VanDerWaalsContact O-CA 3.29Å; I195-E206 WeakPolarHBondContact O-CA 3.32Å; I195-D207 PolarHBondContact N-O 3.27Å; I195-D207 PolarHBondContact O-N 2.91Å; I195-L209 HydrophobicContact CB-CB 4.39Å; I195-L209 HydrophobicContact CG2-CB 4.27Å; I195-L236 HydrophobicContact CD1-CD1 3.3Å; I195-L236 HydrophobicContact CD1-CD2 4.1Å; I195-L236 HydrophobicContact CD1-CG 4.35Å
196	R	95	Very high	85.2	Confident	10 Å²	10	32.7 Å²	32.7	4%	0.038	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	108.6	161.9	-179.3	177.3	-179	115.1	-12.6	108.1	Y175 S176 V204 Q205 E206 A548 L550 F551 D552	Y175-R196 CarbonylContact C-O 3.47Å; Y175-R196 WeakPolarHBondContact CA-O 3.17Å; Y175-R196 WeakPolarHBondContact CB-O 3.3Å; S176-R196 PolarHBondContact N-O 2.81Å; S176-R196 PolarHBondContact O-N 3.32Å; R196-V204 HydrophobicContact CG-CG1 3.89Å; R196-Q205 CarbonylContact C-O 3.44Å; R196-Q205 WeakPolarHBondContact CA-O 3.02Å; R196-E206 HydrophobicContact CB-CG 4.01Å; R196-E206 VanDerWaalsContact CD-OE1 3.29Å; R196-E206 WeakPolarHBondContact CD-OE1 3.49Å; R196-E206 HydrophobicContact CG-CG 3.82Å; R196-E206 IonicContact CZ-OE1 3.88Å; R196-E206 IonicContact NE-OE1 3.1Å; R196-E206 IonicContact NH1-OE1 3.36Å; R196-E206 PolarHBondContact NH1-OE1 3.34Å; R196-A548 PolarHBondContact NE-O 2.89Å; R196-A548 PolarHBondContact NH2-O 3.08Å; R196-L550 WeakPolarHBondContact CD-O 3.48Å; R196-L550 PolarHBondContact NE-O 2.91Å; R196-F551 HydrophobicContact CB-CD1 4.2Å; R196-F551 HydrophobicContact CB-CD2 4.03Å; R196-F551 HydrophobicContact CB-CE1 3.82Å; R196-F551 HydrophobicContact CB-CE2 3.61Å; R196-F551 HydrophobicContact CB-CG 4.31Å; R196-F551 HydrophobicContact CB-CZ 3.52Å; R196-D552 IonicContact CZ-OD1 3.74Å; R196-D552 VanDerWaalsContact CZ-OD1 3.31Å; R196-D552 IonicContact CZ-OD2 3.77Å; R196-D552 IonicContact NH1-OD1 3.18Å; R196-D552 PolarHBondContact NH1-OD1 3.36Å; R196-D552 IonicContact NH1-OD2 3.81Å; R196-D552 IonicContact NH2-OD1 2.56Å; R196-D552 PolarHBondContact NH2-OD1 3.46Å; R196-D552 IonicContact NH2-OD2 2.72Å; R196-D552 PolarHBondContact NH2-OD2 3.13Å
197	G	94.6	Very high	87.4	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	152.2	-178.7	0	0	0	0	0	112.5	V204 Q205	G197-V204 WeakPolarHBondContact O-CA 3.24Å; G197-Q205 PolarHBondContact N-O 3.24Å; G197-Q205 PolarHBondContact O-N 2.99Å
198	V	93.7	Very high	89.2	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	121.1	179.6	-174.3	0	0	0	0	109.7	F172 K173 A174 L202 E203 V204 C545 A548	F172-V198 CarbonylContact C-O 3.56Å; F172-V198 VanDerWaalsContact CA-O 3.28Å; F172-V198 WeakPolarHBondContact CA-O 3.36Å; K173-V198 PolarHBondContact N-O 3.41Å; A174-V198 PolarHBondContact O-N 2.85Å; V198-L202 HydrophobicContact CG1-CD1 4.06Å; V198-E203 WeakPolarHBondContact CA-O 3.1Å; V198-V204 HydrophobicContact CG2-CG2 4.26Å; V198-C545 HydrophobicContact CG1-CB 4.23Å; V198-A548 HydrophobicContact CG1-CB 4.14Å; V198-A548 HydrophobicContact CG2-CB 3.7Å
199	G	91.8	Very high	90.9	Very high	1 Å²	1	27 Å²	27	1%	0.01	14%	0.138	C	C	.	.			trans	-82.5	-175.2	178.3	0	0	0	0	0	114.2	E201 L202 E203	G199-E201 VanDerWaalsContact C-N 3.26Å; G199-E201 PolarHBondContact O-N 3.33Å; G199-L202 PolarHBondContact O-N 3.33Å; G199-E203 VanDerWaalsContact CA-CD 3.41Å; G199-E203 VanDerWaalsContact CA-OE1 3.29Å; G199-E203 WeakPolarHBondContact CA-OE1 3.27Å; G199-E203 WeakPolarHBondContact CA-OE2 2.91Å; G199-E203 PolarHBondContact N-O 3.04Å
200	P	86.1	Confident	91.8	Very high	59 Å²	59	24.3 Å²	24.3	38%	0.383	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-26.1	-175.1	-19.6	31.8	0	0	0	114.7	E203	P200-E203 VanDerWaalsContact CD-OE1 3.27Å; P200-E203 WeakPolarHBondContact CD-OE1 3.36Å
201	E	85.3	Confident	92.1	Very high	148 Å²	148	23.7 Å²	23.7	69%	0.692	12%	0.122	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.9	15.6	-178.4	-57.7	-169.9	170.9	0	0	112.5	G199 E203 A530	G199-E201 VanDerWaalsContact C-N 3.26Å; G199-E201 PolarHBondContact O-N 3.33Å; E201-E203 WeakPolarHBondContact CA-OE2 3.25Å; E201-E203 WeakPolarHBondContact CB-OE2 3.48Å; E201-E203 PolarHBondContact N-OE2 3.35Å; E201-E203 PolarHBondContact O-N 2.68Å; E201-A530 WeakPolarHBondContact O-CB 3.19Å
202	L	86.6	Confident	92.2	Very high	12 Å²	12	24 Å²	24	6%	0.063	12%	0.124	C	C	.	.			trans	65.3	18.1	-176	-76.2	-75.2	0	0	0	113.1	V198 G199 V204 A530 A544 C545 A548	V198-L202 HydrophobicContact CG1-CD1 4.06Å; G199-L202 PolarHBondContact O-N 3.33Å; L202-V204 PolarHBondContact O-N 2.78Å; L202-A530 HydrophobicContact CB-CB 4.13Å; L202-A544 HydrophobicContact CD1-CB 4.14Å; L202-C545 HydrophobicContact CD1-CB 4.35Å; L202-C545 WeakPolarHBondContact CD2-SG 3.18Å; L202-A548 HydrophobicContact CD1-CB 4.26Å
203	E	87.3	Confident	92	Very high	95 Å²	95	24.2 Å²	24.2	44%	0.444	13%	0.125	S	C	.	.			trans	-66.3	121.7	168.7	72.5	-76.3	-161.9	0	0	109.9	V198 G199 P200 E201	V198-E203 WeakPolarHBondContact CA-O 3.1Å; G199-E203 VanDerWaalsContact CA-CD 3.41Å; G199-E203 VanDerWaalsContact CA-OE1 3.29Å; G199-E203 WeakPolarHBondContact CA-OE1 3.27Å; G199-E203 WeakPolarHBondContact CA-OE2 2.91Å; G199-E203 PolarHBondContact N-O 3.04Å; P200-E203 VanDerWaalsContact CD-OE1 3.27Å; P200-E203 WeakPolarHBondContact CD-OE1 3.36Å; E201-E203 WeakPolarHBondContact CA-OE2 3.25Å; E201-E203 WeakPolarHBondContact CB-OE2 3.48Å; E201-E203 PolarHBondContact N-OE2 3.35Å; E201-E203 PolarHBondContact O-N 2.68Å
204	V	89.4	Confident	91.4	Very high	64 Å²	64	24.9 Å²	24.9	39%	0.388	13%	0.129	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	129	179.8	-177.7	0	0	0	0	108.7	R196 G197 V198 L202 A548	R196-V204 HydrophobicContact CG-CG1 3.89Å; G197-V204 WeakPolarHBondContact O-CA 3.24Å; V198-V204 HydrophobicContact CG2-CG2 4.26Å; L202-V204 PolarHBondContact O-N 2.78Å; V204-A548 HydrophobicContact CG2-CB 4.39Å
205	Q	91.1	Very high	90.7	Very high	20 Å²	20	28.8 Å²	28.8	9%	0.093	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	121.8	172.1	-179.1	66.3	57.8	0	0	109.4	L165 F172 R196 G197	L165-Q205 HydrophobicContact CD1-CG 4.1Å; F172-Q205 HydrophobicContact CE1-CB 4.18Å; F172-Q205 HydrophobicContact CZ-CB 3.9Å; F172-Q205 HydrophobicContact CZ-CG 4.32Å; R196-Q205 CarbonylContact C-O 3.44Å; R196-Q205 WeakPolarHBondContact CA-O 3.02Å; G197-Q205 PolarHBondContact N-O 3.24Å; G197-Q205 PolarHBondContact O-N 2.99Å
206	E	92.9	Very high	89.7	Confident	33 Å²	33	35 Å²	35	15%	0.154	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	134.3	166.2	-65	-165.5	153.3	0	0	110.1	I195 R196 F551 I556	I195-E206 VanDerWaalsContact O-CA 3.29Å; I195-E206 WeakPolarHBondContact O-CA 3.32Å; R196-E206 HydrophobicContact CB-CG 4.01Å; R196-E206 VanDerWaalsContact CD-OE1 3.29Å; R196-E206 WeakPolarHBondContact CD-OE1 3.49Å; R196-E206 HydrophobicContact CG-CG 3.82Å; R196-E206 IonicContact CZ-OE1 3.88Å; R196-E206 IonicContact NE-OE1 3.1Å; R196-E206 IonicContact NH1-OE1 3.36Å; R196-E206 PolarHBondContact NH1-OE1 3.34Å; E206-F551 WeakPolarHBondContact OE1-CD1 3.38Å; E206-I556 HydrophobicContact CB-CD1 4.25Å
207	D	94.6	Very high	88.9	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.1	168.6	173.8	-144.8	-59.6	0	0	0	111.8	L165 F194 I195 L209 I556 R585 T589 M591	L165-D207 HydrophobicContact CD1-CB 3.84Å; L165-D207 HydrophobicContact CD2-CB 3.9Å; L165-D207 HydrophobicContact CG-CB 4.45Å; F194-D207 WeakPolarHBondContact CA-O 3.5Å; I195-D207 PolarHBondContact N-O 3.27Å; I195-D207 PolarHBondContact O-N 2.91Å; D207-L209 PolarHBondContact O-N 2.58Å; D207-I556 VanDerWaalsContact CA-CD1 3.41Å; D207-R585 IonicContact OD1-NH1 2.63Å; D207-R585 PolarHBondContact OD1-NH1 2.97Å; D207-T589 VanDerWaalsContact OD2-CB 3.27Å; D207-T589 WeakPolarHBondContact OD2-CB 3.38Å; D207-T589 PolarHBondContact OD2-OG1 3.02Å; D207-M591 WeakPolarHBondContact OD2-CE 3.46Å
208	L	96	Very high	87.9	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	121.7	168.3	-178.8	68.8	0	0	0	109.4	L165 F194 I211 Q581 F584 R585	L165-L208 WeakPolarHBondContact CD2-O 3.06Å; F194-L208 HydrophobicContact CD1-CB 4.18Å; F194-L208 HydrophobicContact CD1-CD1 3.85Å; F194-L208 HydrophobicContact CE1-CB 4.29Å; F194-L208 HydrophobicContact CE1-CD1 3.65Å; F194-L208 HydrophobicContact CZ-CD1 4.28Å; L208-I211 HydrophobicContact CD1-CG1 4.11Å; L208-I211 HydrophobicContact CD2-CD1 4.18Å; L208-I211 HydrophobicContact CD2-CG1 3.97Å; L208-Q581 HydrophobicContact CD2-CG 4.35Å; L208-F584 HydrophobicContact CD2-CB 3.85Å; L208-R585 HydrophobicContact CD2-CB 4.21Å; L208-R585 VanDerWaalsContact O-CZ 3.26Å; L208-R585 PolarHBondContact O-NH1 3.12Å; L208-R585 PolarHBondContact O-NH2 3.22Å; L208-R585 VanDerWaalsContact O-NH2 3.09Å
209	L	96.4	Very high	87.5	Confident	4 Å²	4	47.5 Å²	47.5	2%	0.021	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	-56	171.7	-178.6	63.7	0	0	0	110.2	F166 L177 V193 I195 D207 A230 L231 A234 L236 R585	F166-L209 HydrophobicContact CE1-CD1 4.13Å; L177-L209 HydrophobicContact CD2-CD2 4.13Å; V193-L209 HydrophobicContact CB-CB 4.49Å; V193-L209 HydrophobicContact CG1-CB 4.16Å; V193-L209 HydrophobicContact CG1-CD2 3.98Å; V193-L209 WeakPolarHBondContact O-CA 3.28Å; V193-L209 VanDerWaalsContact O-CB 3.32Å; V193-L209 WeakPolarHBondContact O-CB 3.46Å; V193-L209 PolarHBondContact O-N 2.94Å; I195-L209 HydrophobicContact CB-CB 4.39Å; I195-L209 HydrophobicContact CG2-CB 4.27Å; D207-L209 PolarHBondContact O-N 2.58Å; L209-A230 HydrophobicContact CD2-CB 4.29Å; L209-A230 HydrophobicContact CG-CB 4.34Å; L209-L231 HydrophobicContact CD2-CD2 3.79Å; L209-L231 HydrophobicContact CD2-CG 4.4Å; L209-A234 HydrophobicContact CD1-CB 3.86Å; L209-L236 HydrophobicContact CD1-CD1 4.44Å; L209-R585 PolarHBondContact O-NH2 3Å
210	T	94.7	Very high	87.2	Confident	22 Å²	22	48.7 Å²	48.7	14%	0.135	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.1	164.5	-177.2	-170.4	0	0	0	0	111.5	V193 I212 A230	V193-T210 HydrophobicContact CB-CG2 3.82Å; V193-T210 HydrophobicContact CG1-CG2 4.46Å; V193-T210 HydrophobicContact CG2-CG2 3.88Å; V193-T210 PolarHBondContact N-O 3.41Å; V193-T210 PolarHBondContact O-N 2.87Å; T210-I212 HydrophobicContact CG2-CD1 4.34Å; T210-I212 HydrophobicContact CG2-CG1 4.12Å; T210-A230 HydrophobicContact CG2-CB 3.64Å
211	I	92.1	Very high	87.2	Confident	17 Å²	17	48 Å²	48	9%	0.087	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	131	166.3	-49.9	-174.8	0	0	0	108.5	Y190 L208 L580 Q581 F584	Y190-I211 HydrophobicContact CD1-CG2 3.5Å; Y190-I211 VanDerWaalsContact CD1-CG2 3.5Å; Y190-I211 HydrophobicContact CE1-CG2 4.36Å; Y190-I211 HydrophobicContact CG-CG2 4.08Å; L208-I211 HydrophobicContact CD1-CG1 4.11Å; L208-I211 HydrophobicContact CD2-CD1 4.18Å; L208-I211 HydrophobicContact CD2-CG1 3.97Å; I211-L580 HydrophobicContact CD1-CG 4.28Å; I211-Q581 HydrophobicContact CD1-CB 4.34Å; I211-Q581 HydrophobicContact CG1-CB 4.41Å; I211-Q581 HydrophobicContact CG1-CG 4.38Å; I211-F584 HydrophobicContact CD1-CB 3.84Å; I211-F584 HydrophobicContact CD1-CD2 4Å; I211-F584 HydrophobicContact CD1-CG 3.94Å
212	I	90.3	Very high	87.3	Confident	8 Å²	8	42.4 Å²	42.4	4%	0.041	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	121.1	-178.8	-59.6	166.8	0	0	0	109.8	Y190 L191 V193 T210 L214 H217 L223 A226 I227	Y190-I212 CarbonylContact C-O 3.42Å; Y190-I212 VanDerWaalsContact CA-O 3.31Å; Y190-I212 WeakPolarHBondContact CA-O 3.41Å; L191-I212 HydrophobicContact CB-CB 4.32Å; L191-I212 HydrophobicContact CD2-CD1 4.28Å; L191-I212 PolarHBondContact N-O 3.42Å; L191-I212 PolarHBondContact O-N 2.94Å; V193-I212 HydrophobicContact CG2-CD1 3.87Å; V193-I212 HydrophobicContact CG2-CG1 4.45Å; T210-I212 HydrophobicContact CG2-CD1 4.34Å; T210-I212 HydrophobicContact CG2-CG1 4.12Å; I212-L214 PolarHBondContact O-N 3.44Å; I212-H217 HydrophobicContact CG2-CB 4.15Å; I212-L223 HydrophobicContact CG2-CD2 3.82Å; I212-A226 HydrophobicContact CD1-CB 3.84Å; I212-A226 HydrophobicContact CG1-CB 4.12Å; I212-A226 HydrophobicContact CG2-CB 4.12Å; I212-I227 HydrophobicContact CD1-CD1 4.41Å; I212-I227 HydrophobicContact CD1-CG1 3.52Å
213	N	87.9	Confident	87.4	Confident	15 Å²	15	41.8 Å²	41.8	8%	0.08	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	108	174	-171.2	-29.8	0	0	0	111.1	N189 Y190 T215 H216 H217 D577	N189-N213 CarbonylContact O-C 3.47Å; Y190-N213 HydrophobicContact CD1-CB 4.02Å; Y190-N213 HydrophobicContact CE1-CB 3.61Å; Y190-N213 PolarHBondContact OH-ND2 3.23Å; N213-T215 VanDerWaalsContact C-N 3.26Å; N213-T215 PolarHBondContact O-N 2.94Å; N213-T215 VanDerWaalsContact OD1-CB 3.24Å; N213-T215 WeakPolarHBondContact OD1-CB 3.37Å; N213-T215 PolarHBondContact OD1-N 2.92Å; N213-T215 PolarHBondContact OD1-OG1 3.49Å; N213-H216 PolarHBondContact O-N 2.85Å; N213-H217 PolarHBondContact O-N 2.86Å; N213-H217 PolarHBondContact O-ND1 2.89Å; N213-D577 VanDerWaalsContact CB-OD2 3.26Å; N213-D577 WeakPolarHBondContact CB-OD2 3.47Å; N213-D577 PolarHBondContact ND2-OD1 3.37Å; N213-D577 PolarHBondContact ND2-OD2 2.93Å
214	L	81.9	Confident	87.5	Confident	13 Å²	13	37.9 Å²	37.9	7%	0.068	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-18.7	-179.3	-54.1	-179.4	0	0	0	113.2	N189 L191 I212 H216 H217 F218 L223	N189-L214 HydrophobicContact CB-CB 4.02Å; N189-L214 WeakPolarHBondContact O-CA 3.28Å; N189-L214 VanDerWaalsContact O-CB 3.27Å; N189-L214 WeakPolarHBondContact O-CB 3.48Å; N189-L214 WeakPolarHBondContact O-CG 3.34Å; N189-L214 PolarHBondContact O-N 3.27Å; L191-L214 HydrophobicContact CB-CD2 3.79Å; L191-L214 HydrophobicContact CB-CG 4.38Å; I212-L214 PolarHBondContact O-N 3.44Å; L214-H216 VanDerWaalsContact C-N 3.26Å; L214-H216 PolarHBondContact O-N 3.33Å; L214-H217 CarbonylContact O-C 3.41Å; L214-H217 PolarHBondContact O-N 2.9Å; L214-F218 PolarHBondContact O-N 3.3Å; L214-L223 HydrophobicContact CD2-CD1 4.12Å; L214-L223 HydrophobicContact CD2-CD2 3.22Å; L214-L223 HydrophobicContact CD2-CG 4.28Å
215	T	80	Confident	87.6	Confident	83 Å²	83	38.4 Å²	38.4	51%	0.509	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-35	174.4	-57.2	0	0	0	0	110.8	N189 N213	N189-T215 VanDerWaalsContact CB-OG1 3.27Å; N189-T215 WeakPolarHBondContact CB-OG1 3.24Å; N189-T215 PolarHBondContact ND2-OG1 3.3Å; N189-T215 VanDerWaalsContact ND2-OG1 3.11Å; N213-T215 VanDerWaalsContact C-N 3.26Å; N213-T215 PolarHBondContact O-N 2.94Å; N213-T215 VanDerWaalsContact OD1-CB 3.24Å; N213-T215 WeakPolarHBondContact OD1-CB 3.37Å; N213-T215 PolarHBondContact OD1-N 2.92Å; N213-T215 PolarHBondContact OD1-OG1 3.49Å
216	H	76.3	Confident	87.7	Confident	130 Å²	130	38.2 Å²	38.2	60%	0.602	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.5	-21.5	174.4	-59.4	-56.6	0	0	0	112.8	N213 L214	N213-H216 PolarHBondContact O-N 2.85Å; L214-H216 VanDerWaalsContact C-N 3.26Å; L214-H216 PolarHBondContact O-N 3.33Å
217	H	76.8	Confident	87.8	Confident	59 Å²	59	36.6 Å²	36.6	27%	0.273	21%	0.213	S	C	.	.			trans	-120.4	66.6	-175.4	-56.4	86.9	0	0	0	112.2	I212 N213 L214 A222 L223	I212-H217 HydrophobicContact CG2-CB 4.15Å; N213-H217 PolarHBondContact O-N 2.86Å; N213-H217 PolarHBondContact O-ND1 2.89Å; L214-H217 CarbonylContact O-C 3.41Å; L214-H217 PolarHBondContact O-N 2.9Å; H217-A222 HydrophobicContact CB-CB 4.1Å; H217-L223 HydrophobicContact CB-CD2 3.65Å; H217-L223 HydrophobicContact CB-CG 4.34Å; H217-L223 WeakPolarHBondContact O-CD2 3.1Å
218	F	75	Confident	87.7	Confident	164 Å²	164	39.1 Å²	39.1	72%	0.719	23%	0.226	S	C	*	.			trans	-76.2	-25.5	-173.1	58.6	-90.1	0	0	0	114.4	L214 R251	L214-F218 PolarHBondContact O-N 3.3Å; F218-R251 PolarHBondContact O-NH1 2.65Å
219	S	84.6	Confident	87.7	Confident	51 Å²	51	45.1 Å²	45.1	36%	0.357	25%	0.254	S	S	.	.	S	Bend	trans	-94.5	150.9	-178.6	77.9	0	0	0	0	112.3	G221 A222 L223	S219-G221 PolarHBondContact O-N 2.59Å; S219-A222 PolarHBondContact O-N 3.39Å; S219-A222 VanDerWaalsContact O-N 3.13Å; S219-A222 WeakPolarHBondContact OG-CB 3.38Å; S219-A222 PolarHBondContact OG-N 2.99Å; S219-A222 VanDerWaalsContact OG-N 3.14Å; S219-L223 WeakPolarHBondContact O-CG 3.23Å; S219-L223 PolarHBondContact O-N 3.47Å; S219-L223 VanDerWaalsContact O-N 3.09Å
220	V	85	Confident	87.7	Confident	25 Å²	25	45.5 Å²	45.5	15%	0.152	26%	0.258	C	S	.	.	H	α-helix	trans	-60.9	-33.4	176.5	174.2	0	0	0	0	111.9	L223 M224 R251 S257 L259 Y262	V220-L223 PolarHBondContact O-N 3.11Å; V220-M224 WeakPolarHBondContact O-CB 3.25Å; V220-M224 PolarHBondContact O-N 2.77Å; V220-R251 HydrophobicContact CG2-CG 4.47Å; V220-S257 WeakPolarHBondContact CG1-O 3.41Å; V220-S257 VanDerWaalsContact CG2-O 3.31Å; V220-S257 WeakPolarHBondContact CG2-O 3.44Å; V220-L259 HydrophobicContact CG1-CB 4.05Å; V220-L259 HydrophobicContact CG1-CD1 4.19Å; V220-Y262 HydrophobicContact CG1-CD2 3.54Å; V220-Y262 HydrophobicContact CG1-CE2 3.87Å; V220-Y262 HydrophobicContact CG1-CG 4.47Å
221	G	86.8	Confident	87.7	Confident	46 Å²	46	44.6 Å²	44.6	47%	0.474	25%	0.253	S	S	.	.	H	α-helix	trans	-64.7	-41	174.1	0	0	0	0	0	113.4	S219 M224 S225	S219-G221 PolarHBondContact O-N 2.59Å; G221-M224 PolarHBondContact O-N 3.32Å; G221-S225 PolarHBondContact O-N 2.79Å
222	A	87.2	Confident	87.9	Confident	29 Å²	29	51.2 Å²	51.2	24%	0.24	28%	0.283	C	S	.	.	H	α-helix	trans	-65.6	-41.6	176.2	0	0	0	0	0	111.5	H217 S219 S225 A226	H217-A222 HydrophobicContact CB-CB 4.1Å; S219-A222 PolarHBondContact O-N 3.39Å; S219-A222 VanDerWaalsContact O-N 3.13Å; S219-A222 WeakPolarHBondContact OG-CB 3.38Å; S219-A222 PolarHBondContact OG-N 2.99Å; S219-A222 VanDerWaalsContact OG-N 3.14Å; A222-S225 PolarHBondContact O-N 3.49Å; A222-A226 PolarHBondContact O-N 2.87Å
223	L	89.3	Confident	88.2	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-62.1	-45.5	175	-65.1	173.8	0	0	0	112.1	L191 I212 L214 H217 S219 V220 S225 A226 I227 R251	L191-L223 HydrophobicContact CD2-CD2 4.42Å; I212-L223 HydrophobicContact CG2-CD2 3.82Å; L214-L223 HydrophobicContact CD2-CD1 4.12Å; L214-L223 HydrophobicContact CD2-CD2 3.22Å; L214-L223 HydrophobicContact CD2-CG 4.28Å; H217-L223 HydrophobicContact CB-CD2 3.65Å; H217-L223 HydrophobicContact CB-CG 4.34Å; H217-L223 WeakPolarHBondContact O-CD2 3.1Å; S219-L223 WeakPolarHBondContact O-CG 3.23Å; S219-L223 PolarHBondContact O-N 3.47Å; S219-L223 VanDerWaalsContact O-N 3.09Å; V220-L223 PolarHBondContact O-N 3.11Å; L223-S225 VanDerWaalsContact C-N 3.31Å; L223-S225 PolarHBondContact O-N 2.78Å; L223-A226 PolarHBondContact O-N 3.49Å; L223-I227 WeakPolarHBondContact O-CG1 3.27Å; L223-I227 PolarHBondContact O-N 3.13Å; L223-R251 HydrophobicContact CD1-CG 4.37Å
224	M	89.9	Confident	88.5	Confident	12 Å²	12	54.1 Å²	54.1	6%	0.059	30%	0.302	C	S	.	.	H	α-helix	trans	-59.5	-43.9	176.8	-175.2	58.7	177.9	0	0	111.2	V220 G221 A226 I227 L228 L259 M263 K266	V220-M224 WeakPolarHBondContact O-CB 3.25Å; V220-M224 PolarHBondContact O-N 2.77Å; G221-M224 PolarHBondContact O-N 3.32Å; M224-A226 PolarHBondContact O-N 3.5Å; M224-I227 PolarHBondContact O-N 3.31Å; M224-L228 HydrophobicContact CE-CD1 4.01Å; M224-L228 HydrophobicContact CE-CD2 3.82Å; M224-L228 HydrophobicContact CE-CG 3.92Å; M224-L228 HydrophobicContact CG-CD1 4.17Å; M224-L228 HydrophobicContact CG-CG 4.39Å; M224-L228 WeakPolarHBondContact O-CB 3.48Å; M224-L228 VanDerWaalsContact O-CG 3.26Å; M224-L228 WeakPolarHBondContact O-CG 3.36Å; M224-L228 PolarHBondContact O-N 2.88Å; M224-L228 HydrophobicContact SD-CG 4.32Å; M224-L259 HydrophobicContact CB-CD1 3.95Å; M224-L259 HydrophobicContact SD-CD1 4.05Å; M224-M263 HydrophobicContact CE-CB 4.34Å; M224-M263 HydrophobicContact CE-CG 3.79Å; M224-M263 HydrophobicContact SD-CG 3.45Å; M224-M263 WeakPolarHBondContact SD-CG 3.36Å; M224-K266 HydrophobicContact CE-CB 3.85Å; M224-K266 HydrophobicContact CE-CG 3.79Å
225	S	91.2	Very high	89.2	Confident	75 Å²	75	55.2 Å²	55.2	52%	0.524	32%	0.316	S	S	.	.	H	α-helix	trans	-59.4	-46.2	177.1	-166	0	0	0	0	112.1	G221 A222 L223 I227 L228 E229	G221-S225 PolarHBondContact O-N 2.79Å; A222-S225 PolarHBondContact O-N 3.49Å; L223-S225 VanDerWaalsContact C-N 3.31Å; L223-S225 PolarHBondContact O-N 2.78Å; S225-I227 PolarHBondContact O-N 2.98Å; S225-L228 PolarHBondContact O-N 3.2Å; S225-E229 WeakPolarHBondContact O-CB 3.46Å; S225-E229 PolarHBondContact O-N 3.39Å
226	A	93.3	Very high	89.9	Confident	16 Å²	16	52 Å²	52	13%	0.132	30%	0.296	C	S	.	.	H	α-helix	trans	-63.7	-39.4	178.9	0	0	0	0	0	112.4	I212 A222 L223 M224 A230	I212-A226 HydrophobicContact CD1-CB 3.84Å; I212-A226 HydrophobicContact CG1-CB 4.12Å; I212-A226 HydrophobicContact CG2-CB 4.12Å; A222-A226 PolarHBondContact O-N 2.87Å; L223-A226 PolarHBondContact O-N 3.49Å; M224-A226 PolarHBondContact O-N 3.5Å; A226-A230 PolarHBondContact O-N 3.4Å
227	I	94.3	Very high	90.6	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-65.6	-45.1	175	-66.6	170	0	0	0	110.8	L177 L179 L191 V193 I212 L223 M224 S225 E229 A230 L231 L259 M263	L177-I227 HydrophobicContact CD1-CG2 4.11Å; L179-I227 HydrophobicContact CD1-CD1 4.24Å; L179-I227 HydrophobicContact CD2-CD1 4.12Å; L191-I227 HydrophobicContact CD2-CD1 4.26Å; V193-I227 HydrophobicContact CG2-CG1 4.27Å; I212-I227 HydrophobicContact CD1-CD1 4.41Å; I212-I227 HydrophobicContact CD1-CG1 3.52Å; L223-I227 WeakPolarHBondContact O-CG1 3.27Å; L223-I227 PolarHBondContact O-N 3.13Å; M224-I227 PolarHBondContact O-N 3.31Å; S225-I227 PolarHBondContact O-N 2.98Å; I227-E229 VanDerWaalsContact C-N 3.32Å; I227-E229 PolarHBondContact O-N 3.26Å; I227-A230 PolarHBondContact O-N 3.06Å; I227-L231 HydrophobicContact CG2-CD1 4.07Å; I227-L231 HydrophobicContact CG2-CG 4.33Å; I227-L231 VanDerWaalsContact O-CG 3.31Å; I227-L231 WeakPolarHBondContact O-CG 3.48Å; I227-L231 PolarHBondContact O-N 3.4Å; I227-L259 HydrophobicContact CD1-CD1 4.31Å; I227-L259 HydrophobicContact CD1-CD2 3.75Å; I227-L259 HydrophobicContact CD1-CG 4.47Å; I227-M263 HydrophobicContact CG2-CE 4.17Å
228	L	93.7	Very high	91.2	Very high	53 Å²	53	47 Å²	47	28%	0.277	28%	0.279	S	S	.	.	H	α-helix	trans	-62.2	-39.8	178.7	-71.5	178.6	0	0	0	112.2	M224 S225 L231 Q232 L238	M224-L228 HydrophobicContact CE-CD1 4.01Å; M224-L228 HydrophobicContact CE-CD2 3.82Å; M224-L228 HydrophobicContact CE-CG 3.92Å; M224-L228 HydrophobicContact CG-CD1 4.17Å; M224-L228 HydrophobicContact CG-CG 4.39Å; M224-L228 WeakPolarHBondContact O-CB 3.48Å; M224-L228 VanDerWaalsContact O-CG 3.26Å; M224-L228 WeakPolarHBondContact O-CG 3.36Å; M224-L228 PolarHBondContact O-N 2.88Å; M224-L228 HydrophobicContact SD-CG 4.32Å; S225-L228 PolarHBondContact O-N 3.2Å; L228-L231 HydrophobicContact CD2-CD1 4.5Å; L228-L231 PolarHBondContact O-N 3.09Å; L228-Q232 WeakPolarHBondContact O-CB 3.43Å; L228-Q232 PolarHBondContact O-N 3.21Å; L228-L238 HydrophobicContact CD2-CD1 3.75Å; L228-L238 HydrophobicContact CD2-CD2 4Å; L228-L238 HydrophobicContact CD2-CG 4.23Å
229	E	95.2	Very high	91.8	Very high	125 Å²	125	45 Å²	45	58%	0.584	27%	0.272	S	S	*	.	H	α-helix	trans	-63.4	-43.5	174.8	-176	175.8	-179.8	0	0	111.6	S225 I227 L231 Q232 T233	S225-E229 WeakPolarHBondContact O-CB 3.46Å; S225-E229 PolarHBondContact O-N 3.39Å; I227-E229 VanDerWaalsContact C-N 3.32Å; I227-E229 PolarHBondContact O-N 3.26Å; E229-L231 PolarHBondContact O-N 3.04Å; E229-Q232 PolarHBondContact O-N 2.91Å; E229-T233 WeakPolarHBondContact O-CB 3.48Å; E229-T233 PolarHBondContact O-N 3.31Å; E229-T233 PolarHBondContact O-OG1 2.98Å
230	A	95.4	Very high	92.1	Very high	13 Å²	13	47.4 Å²	47.4	11%	0.107	27%	0.273	C	S	.	.	H	α-helix	trans	-62.4	-43.1	175.5	0	0	0	0	0	112.1	L209 T210 A226 I227 T233 A234	L209-A230 HydrophobicContact CD2-CB 4.29Å; L209-A230 HydrophobicContact CG-CB 4.34Å; T210-A230 HydrophobicContact CG2-CB 3.64Å; A226-A230 PolarHBondContact O-N 3.4Å; I227-A230 PolarHBondContact O-N 3.06Å; A230-T233 PolarHBondContact O-N 3.32Å; A230-A234 WeakPolarHBondContact O-CB 3.42Å; A230-A234 PolarHBondContact O-N 3.36Å
231	L	96.1	Very high	92.5	Very high	3 Å²	3	46.5 Å²	46.5	2%	0.016	27%	0.267	C	S	.	.	H	α-helix	trans	-62.6	-45	175.5	-70	174.5	0	0	0	111.8	Y175 L177 L209 I227 L228 E229 T233 A234 G235 L236 L238	Y175-L231 HydrophobicContact CE2-CD2 3.99Å; L177-L231 HydrophobicContact CD1-CD1 4.35Å; L177-L231 HydrophobicContact CD1-CD2 4.16Å; L177-L231 HydrophobicContact CD2-CD2 4.25Å; L209-L231 HydrophobicContact CD2-CD2 3.79Å; L209-L231 HydrophobicContact CD2-CG 4.4Å; I227-L231 HydrophobicContact CG2-CD1 4.07Å; I227-L231 HydrophobicContact CG2-CG 4.33Å; I227-L231 VanDerWaalsContact O-CG 3.31Å; I227-L231 WeakPolarHBondContact O-CG 3.48Å; I227-L231 PolarHBondContact O-N 3.4Å; L228-L231 HydrophobicContact CD2-CD1 4.5Å; L228-L231 PolarHBondContact O-N 3.09Å; E229-L231 PolarHBondContact O-N 3.04Å; L231-T233 PolarHBondContact O-N 3.21Å; L231-A234 PolarHBondContact O-N 3.31Å; L231-G235 PolarHBondContact O-N 2.96Å; L231-G235 VanDerWaalsContact O-N 3.16Å; L231-L236 HydrophobicContact CB-CB 4.33Å; L231-L236 HydrophobicContact CD2-CB 4.02Å; L231-L236 HydrophobicContact CD2-CD1 3.71Å; L231-L236 PolarHBondContact O-N 2.77Å; L231-L238 HydrophobicContact CD1-CD2 3.73Å
232	Q	95.5	Very high	92.8	Very high	156 Å²	156	44.7 Å²	44.7	73%	0.729	25%	0.247	S	C	*	.	H	α-helix	trans	-62.2	-44.3	178.1	-176.1	176.4	8.6	0	0	111.3	L228 E229 A234 G235	L228-Q232 WeakPolarHBondContact O-CB 3.43Å; L228-Q232 PolarHBondContact O-N 3.21Å; E229-Q232 PolarHBondContact O-N 2.91Å; Q232-A234 VanDerWaalsContact C-N 3.29Å; Q232-A234 PolarHBondContact O-N 2.86Å; Q232-G235 PolarHBondContact O-N 2.9Å
233	T	95.9	Very high	93.1	Very high	84 Å²	84	43.3 Å²	43.3	52%	0.515	24%	0.235	S	C	.	.	H	α-helix	trans	-61.8	-39	178	-55.6	0	0	0	0	111.5	F166 E229 A230 L231 G235	F166-T233 HydrophobicContact CE2-CG2 3.8Å; F166-T233 HydrophobicContact CZ-CG2 4.47Å; E229-T233 WeakPolarHBondContact O-CB 3.48Å; E229-T233 PolarHBondContact O-N 3.31Å; E229-T233 PolarHBondContact O-OG1 2.98Å; A230-T233 PolarHBondContact O-N 3.32Å; L231-T233 PolarHBondContact O-N 3.21Å; T233-G235 PolarHBondContact O-N 2.94Å
234	A	96.1	Very high	93.2	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-6.1	175.3	0	0	0	0	0	114.2	F166 L209 A230 L231 Q232 L236	F166-A234 HydrophobicContact CD1-CB 3.57Å; F166-A234 HydrophobicContact CE1-CB 3.64Å; F166-A234 HydrophobicContact CG-CB 4.12Å; F166-A234 HydrophobicContact CZ-CB 4.22Å; L209-A234 HydrophobicContact CD1-CB 3.86Å; A230-A234 WeakPolarHBondContact O-CB 3.42Å; A230-A234 PolarHBondContact O-N 3.36Å; L231-A234 PolarHBondContact O-N 3.31Å; Q232-A234 VanDerWaalsContact C-N 3.29Å; Q232-A234 PolarHBondContact O-N 2.86Å; A234-L236 HydrophobicContact CB-CD1 3.8Å; A234-L236 HydrophobicContact CB-CG 4.11Å
235	G	95.4	Very high	93.3	Very high	36 Å²	36	42.9 Å²	42.9	37%	0.371	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.8	24.5	-176.8	0	0	0	0	0	114	L231 Q232 T233	L231-G235 PolarHBondContact O-N 2.96Å; L231-G235 VanDerWaalsContact O-N 3.16Å; Q232-G235 PolarHBondContact O-N 2.9Å; T233-G235 PolarHBondContact O-N 2.94Å
236	L	94.7	Very high	93.1	Very high	14 Å²	14	39.4 Å²	39.4	7%	0.073	21%	0.209	C	C	.	.			trans	-93.4	127.6	-178.3	-69.4	163.2	0	0	0	111.3	A169 F172 Y175 I195 L209 L231 A234	A169-L236 HydrophobicContact CB-CD1 4.38Å; A169-L236 HydrophobicContact CB-CD2 3.94Å; A169-L236 HydrophobicContact CB-CG 4.07Å; A169-L236 WeakPolarHBondContact O-CD2 3.28Å; F172-L236 HydrophobicContact CD2-CD2 4.01Å; Y175-L236 HydrophobicContact CD1-CD2 3.77Å; Y175-L236 HydrophobicContact CE1-CB 4.12Å; Y175-L236 HydrophobicContact CE1-CD2 3.87Å; Y175-L236 HydrophobicContact CG-CD2 4.24Å; I195-L236 HydrophobicContact CD1-CD1 3.3Å; I195-L236 HydrophobicContact CD1-CD2 4.1Å; I195-L236 HydrophobicContact CD1-CG 4.35Å; L209-L236 HydrophobicContact CD1-CD1 4.44Å; L231-L236 HydrophobicContact CB-CB 4.33Å; L231-L236 HydrophobicContact CD2-CB 4.02Å; L231-L236 HydrophobicContact CD2-CD1 3.71Å; L231-L236 PolarHBondContact O-N 2.77Å; A234-L236 HydrophobicContact CB-CD1 3.8Å; A234-L236 HydrophobicContact CB-CG 4.11Å
237	S	90.9	Very high	92.5	Very high	45 Å²	45	38.8 Å²	38.8	32%	0.315	20%	0.204	S	C	.	.			trans	-87.4	136	171.9	174.9	0	0	0	0	110.9	Y175 Q239 R240	Y175-S237 WeakPolarHBondContact CE1-O 3.18Å; Y175-S237 PolarHBondContact OH-O 3.04Å; S237-Q239 PolarHBondContact O-N 2.92Å; S237-Q239 VanDerWaalsContact O-N 3.15Å; S237-Q239 PolarHBondContact OG-N 3.34Å; S237-R240 PolarHBondContact O-N 2.89Å; S237-R240 VanDerWaalsContact O-N 3.13Å
238	L	89.8	Confident	91.9	Very high	40 Å²	40	39.6 Å²	39.6	21%	0.209	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-57.9	-26.3	173.3	-72.3	173	0	0	0	113.1	L228 L231 R240 M241 K266	L228-L238 HydrophobicContact CD2-CD1 3.75Å; L228-L238 HydrophobicContact CD2-CD2 4Å; L228-L238 HydrophobicContact CD2-CG 4.23Å; L231-L238 HydrophobicContact CD1-CD2 3.73Å; L238-R240 PolarHBondContact O-N 3.36Å; L238-M241 HydrophobicContact CD2-CE 4.44Å; L238-M241 VanDerWaalsContact O-CB 3.29Å; L238-M241 WeakPolarHBondContact O-CB 3.15Å; L238-M241 PolarHBondContact O-N 3.01Å; L238-M241 VanDerWaalsContact O-N 3.11Å; L238-K266 HydrophobicContact CD1-CB 4.21Å
239	Q	87.6	Confident	91.2	Very high	122 Å²	122	39.2 Å²	39.2	57%	0.57	21%	0.207	S	C	*	.	G	3₁₀ helix	trans	-66.7	-19.6	180	-62.9	178.1	-3.4	0	0	113.5	S237	S237-Q239 PolarHBondContact O-N 2.92Å; S237-Q239 VanDerWaalsContact O-N 3.15Å; S237-Q239 PolarHBondContact OG-N 3.34Å
240	R	90.7	Very high	90.4	Very high	101 Å²	101	40.1 Å²	40.1	38%	0.381	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	-94.1	-2.4	177.4	-55.3	-172.4	-171.1	163.7	4.1	112.7	R170 F172 A174 Y175 S237 L238	R170-R240 PolarHBondContact O-NH1 3.14Å; F172-R240 WeakPolarHBondContact O-CD 3.34Å; F172-R240 PolarHBondContact O-NH1 3.33Å; A174-R240 WeakPolarHBondContact CA-O 3.35Å; Y175-R240 HydrophobicContact CD1-CB 4Å; Y175-R240 HydrophobicContact CE1-CB 3.89Å; Y175-R240 PolarHBondContact N-O 3.16Å; S237-R240 PolarHBondContact O-N 2.89Å; S237-R240 VanDerWaalsContact O-N 3.13Å; L238-R240 PolarHBondContact O-N 3.36Å
241	M	93.2	Very high	89.7	Confident	7 Å²	7	43.9 Å²	43.9	3%	0.034	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	131.5	177.5	-168	169.9	68.3	0	0	110.1	Y175 L177 L238 M263 A267 V275	Y175-M241 HydrophobicContact CD2-CG 4.43Å; Y175-M241 HydrophobicContact CE1-CB 4.32Å; Y175-M241 HydrophobicContact CE2-CB 3.91Å; Y175-M241 HydrophobicContact CE2-CG 3.88Å; Y175-M241 HydrophobicContact CE2-SD 4.29Å; Y175-M241 CarbonylContact O-C 3.54Å; Y175-M241 WeakPolarHBondContact O-CA 3.28Å; L177-M241 HydrophobicContact CD1-SD 4.4Å; L238-M241 HydrophobicContact CD2-CE 4.44Å; L238-M241 VanDerWaalsContact O-CB 3.29Å; L238-M241 WeakPolarHBondContact O-CB 3.15Å; L238-M241 PolarHBondContact O-N 3.01Å; L238-M241 VanDerWaalsContact O-N 3.11Å; M241-M263 HydrophobicContact CE-CE 4.12Å; M241-M263 HydrophobicContact SD-CE 3.82Å; M241-A267 HydrophobicContact CE-CB 3.64Å; M241-V275 HydrophobicContact CE-CB 4.42Å; M241-V275 HydrophobicContact CE-CG1 3.99Å; M241-V275 HydrophobicContact CE-CG2 3.58Å
242	V	93.1	Very high	89.2	Confident	7 Å²	7	43.8 Å²	43.8	4%	0.042	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	-44.9	-177.5	-178.4	0	0	0	0	111.3	A174 Y175 V275 I276 K546 S549 L550	A174-V242 HydrophobicContact CB-CG2 3.74Å; Y175-V242 PolarHBondContact O-N 2.83Å; V242-V275 WeakPolarHBondContact O-CA 3.42Å; V242-I276 PolarHBondContact O-N 2.98Å; V242-K546 HydrophobicContact CG1-CB 4.08Å; V242-K546 HydrophobicContact CG2-CB 3.98Å; V242-K546 HydrophobicContact CG2-CG 3.9Å; V242-S549 WeakPolarHBondContact CB-OG 3.43Å; V242-S549 WeakPolarHBondContact CG2-OG 3.41Å; V242-L550 HydrophobicContact CG1-CD2 3.93Å; V242-L550 HydrophobicContact CG1-CG 4.39Å
243	G	92.9	Very high	88.7	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	157.1	-174.2	0	0	0	0	0	113.9	S176 L177 I276	S176-G243 WeakPolarHBondContact CA-O 3.35Å; S176-G243 WeakPolarHBondContact CB-O 3.41Å; S176-G243 VanDerWaalsContact OG-CA 3.26Å; S176-G243 WeakPolarHBondContact OG-CA 3.27Å; S176-G243 PolarHBondContact OG-N 3.19Å; L177-G243 PolarHBondContact N-O 3.29Å; L177-G243 VanDerWaalsContact N-O 3.09Å; G243-I276 CarbonylContact C-O 3.59Å; G243-I276 VanDerWaalsContact CA-O 3.24Å; G243-I276 WeakPolarHBondContact CA-O 3.4Å
244	L	92.8	Very high	87.9	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	118.6	172.3	-173.4	62.5	0	0	0	108.7	L177 L179 T246 V260 M263 V275 I276 H277 Y278	L177-L244 HydrophobicContact CB-CD1 3.93Å; L177-L244 CarbonylContact O-C 3.48Å; L177-L244 WeakPolarHBondContact O-CA 3.45Å; L179-L244 HydrophobicContact CD1-CD1 3.7Å; L179-L244 HydrophobicContact CD1-CG 4.45Å; L179-L244 HydrophobicContact CG-CD1 3.73Å; L244-T246 HydrophobicContact CD2-CG2 4.42Å; L244-T246 HydrophobicContact CG-CG2 4.06Å; L244-V260 HydrophobicContact CD2-CB 4.2Å; L244-V260 HydrophobicContact CD2-CG1 4.3Å; L244-V260 HydrophobicContact CD2-CG2 3.78Å; L244-M263 HydrophobicContact CD1-CE 4.22Å; L244-M263 HydrophobicContact CD1-SD 3.88Å; L244-M263 HydrophobicContact CD2-CB 4.21Å; L244-M263 HydrophobicContact CD2-SD 3.71Å; L244-M263 HydrophobicContact CG-SD 4.48Å; L244-V275 HydrophobicContact CB-CG1 3.96Å; L244-I276 PolarHBondContact N-O 3.32Å; L244-H277 VanDerWaalsContact O-CA 3.31Å; L244-H277 WeakPolarHBondContact O-CA 3.36Å; L244-H277 PolarHBondContact O-CD2 3.39Å; L244-H277 VanDerWaalsContact O-CD2 3.31Å; L244-Y278 PolarHBondContact O-N 3.37Å
245	T	91.1	Very high	86.4	Confident	3 Å²	3	42.9 Å²	42.9	2%	0.018	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	139	171.1	69.7	0	0	0	0	110.3	L177 A178 L179 Y278 F551	L177-T245 PolarHBondContact O-N 3.39Å; A178-T245 WeakPolarHBondContact CA-OG1 3.29Å; A178-T245 WeakPolarHBondContact CB-OG1 3.38Å; L179-T245 PolarHBondContact N-O 3.3Å; T245-Y278 VanDerWaalsContact CA-O 3.32Å; T245-Y278 WeakPolarHBondContact CA-O 3.47Å; T245-Y278 HydrophobicContact CG2-CD1 4.39Å; T245-Y278 HydrophobicContact CG2-CD2 3.81Å; T245-Y278 HydrophobicContact CG2-CE1 3.85Å; T245-Y278 HydrophobicContact CG2-CE2 3.2Å; T245-Y278 HydrophobicContact CG2-CG 4.37Å; T245-Y278 WeakPolarHBondContact CG2-OH 3.32Å; T245-F551 HydrophobicContact CG2-CB 3.98Å; T245-F551 HydrophobicContact CG2-CD2 4.17Å; T245-F551 HydrophobicContact CG2-CG 4.36Å
246	T	88.2	Confident	85	Confident	2 Å²	2	48.1 Å²	48.1	1%	0.012	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	164.5	179.2	75.8	0	0	0	0	111.9	L179 L244 H248 M252 V260 H277 Y278 S279 G280	L179-T246 HydrophobicContact CB-CG2 4.15Å; L179-T246 HydrophobicContact CD1-CG2 4.33Å; L179-T246 WeakPolarHBondContact O-CA 3.37Å; L244-T246 HydrophobicContact CD2-CG2 4.42Å; L244-T246 HydrophobicContact CG-CG2 4.06Å; T246-H248 PolarHBondContact O-CD2 3.23Å; T246-H248 PolarHBondContact O-N 3.01Å; T246-H248 PolarHBondContact OG1-CD2 3Å; T246-H248 VanDerWaalsContact OG1-CD2 3.26Å; T246-H248 PolarHBondContact OG1-N 3.41Å; T246-M252 HydrophobicContact CG2-CB 4.27Å; T246-V260 HydrophobicContact CG2-CG2 3.71Å; T246-H277 PolarHBondContact OG1-NE2 3.27Å; T246-H277 VanDerWaalsContact OG1-NE2 3.1Å; T246-Y278 PolarHBondContact N-O 3.02Å; T246-S279 WeakPolarHBondContact O-CA 3.43Å; T246-G280 PolarHBondContact O-N 3.17Å
247	T	80.2	Confident	84.1	Confident	3 Å²	3	51 Å²	51	2%	0.018	26%	0.26	C	S	.	.			trans	-66.1	-5.9	168.1	52.9	0	0	0	0	114	L179 D180 D181 Q182 T249	L179-T247 PolarHBondContact O-N 2.83Å; D180-T247 WeakPolarHBondContact OD1-CG2 3.26Å; D181-T247 VanDerWaalsContact OD1-CB 3.27Å; D181-T247 WeakPolarHBondContact OD1-CB 3.48Å; D181-T247 WeakPolarHBondContact OD1-CG2 3.4Å; D181-T247 PolarHBondContact OD1-OG1 3.11Å; Q182-T247 HydrophobicContact CG-CG2 3.89Å; T247-T249 PolarHBondContact O-N 2.7Å; T247-T249 VanDerWaalsContact O-N 3.11Å; T247-T249 WeakPolarHBondContact OG1-CG2 3.27Å
248	H	80.9	Confident	83.7	Confident	18 Å²	18	48.8 Å²	48.8	8%	0.083	25%	0.245	C	C	.	.			trans	57.5	20.9	-176.2	-85	-123	0	0	0	115.4	T246 I253 H277 S279 H474	T246-H248 PolarHBondContact O-CD2 3.23Å; T246-H248 PolarHBondContact O-N 3.01Å; T246-H248 PolarHBondContact OG1-CD2 3Å; T246-H248 VanDerWaalsContact OG1-CD2 3.26Å; T246-H248 PolarHBondContact OG1-N 3.41Å; H248-I253 HydrophobicContact CB-CD1 4.18Å; H248-I253 HydrophobicContact CB-CG2 4.39Å; H248-I253 WeakPolarHBondContact O-CD1 3.45Å; H248-I253 WeakPolarHBondContact O-CG1 3.36Å; H248-H277 AromaticContact CD2-CE1 3.8Å; H248-H277 AromaticContact CD2-NE2 3.57Å; H248-H277 AromaticContact CE1-CE1 3.3Å; H248-H277 PolarHBondContact CE1-CE1 3.09Å; H248-H277 AromaticContact CE1-NE2 3.82Å; H248-H277 AromaticContact NE2-CE1 3Å; H248-H277 PolarHBondContact NE2-CE1 2.9Å; H248-H277 AromaticContact NE2-NE2 3.05Å; H248-H277 PolarHBondContact NE2-NE2 3.41Å; H248-S279 WeakPolarHBondContact CD2-CA 3.31Å; H248-S279 VanDerWaalsContact CD2-CB 3.41Å; H248-S279 WeakPolarHBondContact CD2-CB 3.5Å; H248-S279 VanDerWaalsContact NE2-CA 3.29Å; H248-S279 WeakPolarHBondContact NE2-CA 3.3Å; H248-S279 PolarHBondContact NE2-N 3.44Å; H248-H474 VanDerWaalsContact CB-NE2 3.25Å; H248-H474 WeakPolarHBondContact CB-NE2 3.46Å; H248-H474 AromaticContact CE1-CD2 3.72Å; H248-H474 AromaticContact CE1-CG 3.87Å; H248-H474 AromaticContact CG-CD2 3.25Å; H248-H474 AromaticContact CG-NE2 3.47Å; H248-H474 AromaticContact ND1-CD2 3.04Å; H248-H474 PolarHBondContact ND1-CD2 3.28Å; H248-H474 AromaticContact ND1-CE1 3.88Å; H248-H474 AromaticContact ND1-CG 3.5Å; H248-H474 AromaticContact ND1-ND1 3.98Å; H248-H474 AromaticContact ND1-NE2 3.29Å; H248-H474 PolarHBondContact ND1-NE2 3.41Å
249	T	79.2	Confident	83.7	Confident	44 Å²	44	46.9 Å²	46.9	27%	0.27	24%	0.235	S	C	.	.			trans	-62.8	157.9	170.2	67.5	0	0	0	0	110.8	D181 T247 R251 M252 I253	D181-T249 WeakPolarHBondContact OD1-CG2 3.31Å; D181-T249 PolarHBondContact OD1-OG1 3.32Å; D181-T249 PolarHBondContact OD2-OG1 3.09Å; T247-T249 PolarHBondContact O-N 2.7Å; T247-T249 VanDerWaalsContact O-N 3.11Å; T247-T249 WeakPolarHBondContact OG1-CG2 3.27Å; T249-R251 PolarHBondContact O-N 3.26Å; T249-R251 VanDerWaalsContact O-N 3.09Å; T249-M252 WeakPolarHBondContact O-CA 3.2Å; T249-M252 WeakPolarHBondContact O-CB 3.42Å; T249-M252 PolarHBondContact O-N 2.66Å; T249-M252 WeakPolarHBondContact OG1-CG 3.19Å; T249-I253 WeakPolarHBondContact O-CG1 3.34Å; T249-I253 PolarHBondContact O-N 3.39Å
250	L	78.4	Confident	83.7	Confident	145 Å²	145	41.2 Å²	41.2	76%	0.759	21%	0.209	S	C	*	.	H	α-helix	trans	-55.3	-30.9	177.3	-70.5	174.6	0	0	0	113	M252 G254	L250-M252 VanDerWaalsContact C-N 3.29Å; L250-M252 PolarHBondContact O-N 2.79Å; L250-G254 WeakPolarHBondContact O-CA 3.5Å; L250-G254 PolarHBondContact O-N 2.97Å
251	R	81.4	Confident	83.6	Confident	92 Å²	92	38.5 Å²	38.5	35%	0.347	21%	0.205	S	C	.	.	H	α-helix	trans	-62.9	-36.7	174.2	-177	-173.7	-67.3	-85.9	1.8	111.7	F218 V220 L223 T249 L259	F218-R251 PolarHBondContact O-NH1 2.65Å; V220-R251 HydrophobicContact CG2-CG 4.47Å; L223-R251 HydrophobicContact CD1-CG 4.37Å; T249-R251 PolarHBondContact O-N 3.26Å; T249-R251 VanDerWaalsContact O-N 3.09Å; R251-L259 PolarHBondContact O-N 3.4Å
252	M	85.9	Confident	83.3	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-80.4	-47.5	-179.3	-62.8	-58.1	162.2	0	0	112.5	L179 D181 L191 T246 T249 L250 G258 L259 V260	L179-M252 HydrophobicContact CB-SD 4.43Å; L179-M252 HydrophobicContact CD1-SD 4.43Å; D181-M252 HydrophobicContact CB-CE 3.47Å; D181-M252 VanDerWaalsContact CB-CE 3.47Å; D181-M252 WeakPolarHBondContact OD2-CE 3.27Å; L191-M252 HydrophobicContact CD1-CE 3.84Å; L191-M252 HydrophobicContact CD2-CE 4.34Å; T246-M252 HydrophobicContact CG2-CB 4.27Å; T249-M252 WeakPolarHBondContact O-CA 3.2Å; T249-M252 WeakPolarHBondContact O-CB 3.42Å; T249-M252 PolarHBondContact O-N 2.66Å; T249-M252 WeakPolarHBondContact OG1-CG 3.19Å; L250-M252 VanDerWaalsContact C-N 3.29Å; L250-M252 PolarHBondContact O-N 2.79Å; M252-G258 CarbonylContact O-C 3.52Å; M252-L259 PolarHBondContact O-N 3.38Å; M252-L259 VanDerWaalsContact O-N 3.08Å; M252-L259 HydrophobicContact SD-CB 4.27Å; M252-L259 HydrophobicContact SD-CD2 3.89Å; M252-V260 WeakPolarHBondContact O-CB 3.34Å; M252-V260 VanDerWaalsContact O-CG2 3.29Å; M252-V260 WeakPolarHBondContact O-CG2 3.4Å; M252-V260 PolarHBondContact O-N 3.38Å
253	I	84.6	Confident	83.1	Confident	38 Å²	38	42.3 Å²	42.3	20%	0.195	22%	0.219	C	C	.	.	H	α-helix	trans	-111.8	10.9	-167.1	66	163.6	0	0	0	115.1	H248 T249 E255 V260 H277	H248-I253 HydrophobicContact CB-CD1 4.18Å; H248-I253 HydrophobicContact CB-CG2 4.39Å; H248-I253 WeakPolarHBondContact O-CD1 3.45Å; H248-I253 WeakPolarHBondContact O-CG1 3.36Å; T249-I253 WeakPolarHBondContact O-CG1 3.34Å; T249-I253 PolarHBondContact O-N 3.39Å; I253-E255 PolarHBondContact O-N 3.26Å; I253-V260 HydrophobicContact CG2-CG2 4.25Å; I253-H277 VanDerWaalsContact CG2-CE1 3.44Å; I253-H277 WeakPolarHBondContact CG2-CE1 3.48Å
254	G	78.6	Confident	82.8	Confident	11 Å²	11	46 Å²	46	11%	0.113	23%	0.233	C	C	.	.			trans	-48.2	125.9	177.7	0	0	0	0	0	112.4	L250 N256 S257 G258	L250-G254 WeakPolarHBondContact O-CA 3.5Å; L250-G254 PolarHBondContact O-N 2.97Å; G254-N256 PolarHBondContact O-N 3.17Å; G254-S257 PolarHBondContact O-N 3.26Å; G254-G258 WeakPolarHBondContact O-CA 3.48Å; G254-G258 PolarHBondContact O-N 2.87Å
255	E	65.1	Low	82.5	Confident	173 Å²	173	52.5 Å²	52.5	81%	0.808	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	-33.1	-163.1	-160.6	168	-169.3	0	0	113.9	I253	I253-E255 PolarHBondContact O-N 3.26Å
256	N	65.4	Low	82.1	Confident	146 Å²	146	58.6 Å²	58.6	78%	0.781	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-132.9	8.8	178.1	-63.6	-54.9	0	0	0	114.4	G254	G254-N256 PolarHBondContact O-N 3.17Å
257	S	76.1	Confident	81.8	Confident	73 Å²	73	58.9 Å²	58.9	51%	0.51	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-145.1	1.1	-174.9	59.1	0	0	0	0	113.6	V220 G254	V220-S257 WeakPolarHBondContact CG1-O 3.41Å; V220-S257 VanDerWaalsContact CG2-O 3.31Å; V220-S257 WeakPolarHBondContact CG2-O 3.44Å; G254-S257 PolarHBondContact O-N 3.26Å
258	G	83.5	Confident	81.6	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	32%	0.324	C	S	.	.	S	Bend	trans	-78.6	150.3	178.8	0	0	0	0	0	112.4	M252 G254 V260 S261 Y262	M252-G258 CarbonylContact O-C 3.52Å; G254-G258 WeakPolarHBondContact O-CA 3.48Å; G254-G258 PolarHBondContact O-N 2.87Å; G258-V260 PolarHBondContact O-N 3.33Å; G258-S261 PolarHBondContact O-N 2.88Å; G258-S261 VanDerWaalsContact O-N 3.12Å; G258-Y262 WeakPolarHBondContact O-CD2 3.25Å; G258-Y262 PolarHBondContact O-N 3.03Å
259	L	88	Confident	81	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-55.7	-37.8	-178.9	-175.4	58.1	0	0	0	112.9	L179 L191 V220 M224 I227 R251 M252 S261 Y262 M263	L179-L259 HydrophobicContact CD1-CD2 3.54Å; L179-L259 HydrophobicContact CD1-CG 4.21Å; L191-L259 HydrophobicContact CD2-CD2 4.36Å; V220-L259 HydrophobicContact CG1-CB 4.05Å; V220-L259 HydrophobicContact CG1-CD1 4.19Å; M224-L259 HydrophobicContact CB-CD1 3.95Å; M224-L259 HydrophobicContact SD-CD1 4.05Å; I227-L259 HydrophobicContact CD1-CD1 4.31Å; I227-L259 HydrophobicContact CD1-CD2 3.75Å; I227-L259 HydrophobicContact CD1-CG 4.47Å; R251-L259 PolarHBondContact O-N 3.4Å; M252-L259 PolarHBondContact O-N 3.38Å; M252-L259 VanDerWaalsContact O-N 3.08Å; M252-L259 HydrophobicContact SD-CB 4.27Å; M252-L259 HydrophobicContact SD-CD2 3.89Å; L259-S261 PolarHBondContact O-N 3.46Å; L259-Y262 PolarHBondContact O-N 3.46Å; L259-M263 HydrophobicContact CD1-CG 4.27Å; L259-M263 HydrophobicContact CG-CG 4.38Å; L259-M263 HydrophobicContact CG-SD 4.29Å; L259-M263 WeakPolarHBondContact O-CB 3.39Å; L259-M263 WeakPolarHBondContact O-CG 3.37Å; L259-M263 PolarHBondContact O-N 3.17Å
260	V	89.4	Confident	79.9	Confident	3 Å²	3	67.9 Å²	67.9	2%	0.018	35%	0.351	C	S	.	.	H	α-helix	trans	-59.8	-44.2	177.9	172.7	0	0	0	0	111.7	L244 T246 M252 I253 G258 M263 R264 H277	L244-V260 HydrophobicContact CD2-CB 4.2Å; L244-V260 HydrophobicContact CD2-CG1 4.3Å; L244-V260 HydrophobicContact CD2-CG2 3.78Å; T246-V260 HydrophobicContact CG2-CG2 3.71Å; M252-V260 WeakPolarHBondContact O-CB 3.34Å; M252-V260 VanDerWaalsContact O-CG2 3.29Å; M252-V260 WeakPolarHBondContact O-CG2 3.4Å; M252-V260 PolarHBondContact O-N 3.38Å; I253-V260 HydrophobicContact CG2-CG2 4.25Å; G258-V260 PolarHBondContact O-N 3.33Å; V260-M263 PolarHBondContact O-N 2.92Å; V260-R264 WeakPolarHBondContact O-CB 3.5Å; V260-R264 WeakPolarHBondContact O-CG 3.42Å; V260-R264 PolarHBondContact O-N 3.25Å; V260-H277 HydrophobicContact CG1-CB 3.85Å
261	S	87.4	Confident	78.8	Confident	43 Å²	43	69.1 Å²	69.1	30%	0.301	36%	0.359	S	S	.	.	H	α-helix	trans	-63.8	-44.5	-179.7	-60.6	0	0	0	0	111	G258 L259 R264 E265	G258-S261 PolarHBondContact O-N 2.88Å; G258-S261 VanDerWaalsContact O-N 3.12Å; L259-S261 PolarHBondContact O-N 3.46Å; S261-R264 PolarHBondContact O-N 3.43Å; S261-E265 PolarHBondContact O-N 3.49Å
262	Y	86.8	Confident	77.9	Confident	94 Å²	94	66.7 Å²	66.7	37%	0.369	36%	0.356	S	S	.	.	H	α-helix	trans	-64.1	-42.8	175.6	-77.8	-76.9	0	0	0	112.9	V220 G258 L259 E265 K266	V220-Y262 HydrophobicContact CG1-CD2 3.54Å; V220-Y262 HydrophobicContact CG1-CE2 3.87Å; V220-Y262 HydrophobicContact CG1-CG 4.47Å; G258-Y262 WeakPolarHBondContact O-CD2 3.25Å; G258-Y262 PolarHBondContact O-N 3.03Å; L259-Y262 PolarHBondContact O-N 3.46Å; Y262-E265 PolarHBondContact O-N 3.42Å; Y262-K266 WeakPolarHBondContact O-CG 3.49Å; Y262-K266 PolarHBondContact O-N 3.35Å; Y262-K266 VanDerWaalsContact O-N 3.08Å
263	M	88.4	Confident	76.9	Confident	0 Å²	0	70.1 Å²	70.1	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-63.7	-43.2	177.9	-75.2	-168.4	80.9	0	0	111.8	L177 L179 M224 I227 M241 L244 L259 V260 K266 A267	L177-M263 HydrophobicContact CD1-CE 3.8Å; L179-M263 HydrophobicContact CD1-SD 4.01Å; M224-M263 HydrophobicContact CE-CB 4.34Å; M224-M263 HydrophobicContact CE-CG 3.79Å; M224-M263 HydrophobicContact SD-CG 3.45Å; M224-M263 WeakPolarHBondContact SD-CG 3.36Å; I227-M263 HydrophobicContact CG2-CE 4.17Å; M241-M263 HydrophobicContact CE-CE 4.12Å; M241-M263 HydrophobicContact SD-CE 3.82Å; L244-M263 HydrophobicContact CD1-CE 4.22Å; L244-M263 HydrophobicContact CD1-SD 3.88Å; L244-M263 HydrophobicContact CD2-CB 4.21Å; L244-M263 HydrophobicContact CD2-SD 3.71Å; L244-M263 HydrophobicContact CG-SD 4.48Å; L259-M263 HydrophobicContact CD1-CG 4.27Å; L259-M263 HydrophobicContact CG-CG 4.38Å; L259-M263 HydrophobicContact CG-SD 4.29Å; L259-M263 WeakPolarHBondContact O-CB 3.39Å; L259-M263 WeakPolarHBondContact O-CG 3.37Å; L259-M263 PolarHBondContact O-N 3.17Å; V260-M263 PolarHBondContact O-N 2.92Å; M263-K266 PolarHBondContact O-N 3.34Å; M263-A267 VanDerWaalsContact O-CB 3.25Å; M263-A267 WeakPolarHBondContact O-CB 3.45Å; M263-A267 PolarHBondContact O-N 3.1Å
264	R	87.8	Confident	76.7	Confident	79 Å²	79	74.4 Å²	74.4	30%	0.298	39%	0.392	S	S	.	.	H	α-helix	trans	-59.7	-48.5	174.9	-83.4	172.6	168.2	168.5	-9.2	111.7	V260 S261 K266 A267 V268 V275 D477	V260-R264 WeakPolarHBondContact O-CB 3.5Å; V260-R264 WeakPolarHBondContact O-CG 3.42Å; V260-R264 PolarHBondContact O-N 3.25Å; S261-R264 PolarHBondContact O-N 3.43Å; R264-K266 VanDerWaalsContact C-N 3.29Å; R264-K266 PolarHBondContact O-N 3.36Å; R264-A267 PolarHBondContact O-N 2.94Å; R264-V268 WeakPolarHBondContact O-CG2 3.5Å; R264-V268 PolarHBondContact O-N 3.33Å; R264-V275 HydrophobicContact CG-CB 4.05Å; R264-V275 PolarHBondContact NE-O 3.49Å; R264-D477 IonicContact CZ-OD2 2.69Å; R264-D477 VanDerWaalsContact NH2-CG 3.27Å; R264-D477 IonicContact NH2-OD1 3.17Å; R264-D477 PolarHBondContact NH2-OD1 2.89Å; R264-D477 IonicContact NH2-OD2 2.7Å; R264-D477 PolarHBondContact NH2-OD2 2.94Å
265	E	85.4	Confident	77.3	Confident	135 Å²	135	74.3 Å²	74.3	63%	0.631	39%	0.389	S	S	*	.	H	α-helix	trans	-57	-42.7	178.7	-171.1	-172.5	168.8	0	0	111.8	S261 Y262	S261-E265 PolarHBondContact O-N 3.49Å; Y262-E265 PolarHBondContact O-N 3.42Å
266	K	83.3	Confident	78.5	Confident	131 Å²	131	66.3 Å²	66.3	57%	0.57	35%	0.352	S	S	*	.	H	α-helix	trans	-74.8	-28.5	179.2	-70.2	-67.2	-176.5	-177.3	0	114.2	M224 L238 Y262 M263 R264 V268	M224-K266 HydrophobicContact CE-CB 3.85Å; M224-K266 HydrophobicContact CE-CG 3.79Å; L238-K266 HydrophobicContact CD1-CB 4.21Å; Y262-K266 WeakPolarHBondContact O-CG 3.49Å; Y262-K266 PolarHBondContact O-N 3.35Å; Y262-K266 VanDerWaalsContact O-N 3.08Å; M263-K266 PolarHBondContact O-N 3.34Å; R264-K266 VanDerWaalsContact C-N 3.29Å; R264-K266 PolarHBondContact O-N 3.36Å; K266-V268 VanDerWaalsContact C-N 3.31Å
267	A	82.3	Confident	79.8	Confident	8 Å²	8	60.2 Å²	60.2	7%	0.066	32%	0.319	C	S	.	.	H	α-helix	trans	-82.3	-8.2	178.7	0	0	0	0	0	113.2	M241 M263 R264 S269 V275	M241-A267 HydrophobicContact CE-CB 3.64Å; M263-A267 VanDerWaalsContact O-CB 3.25Å; M263-A267 WeakPolarHBondContact O-CB 3.45Å; M263-A267 PolarHBondContact O-N 3.1Å; R264-A267 PolarHBondContact O-N 2.94Å; A267-S269 PolarHBondContact O-N 3.04Å; A267-V275 HydrophobicContact CB-CG2 3.53Å
268	V	76.6	Confident	80.4	Confident	113 Å²	113	56.7 Å²	56.7	69%	0.685	29%	0.294	S	S	*	.			trans	-62	121.6	176.7	-177.1	0	0	0	0	110.1	R264 K266	R264-V268 WeakPolarHBondContact O-CG2 3.5Å; R264-V268 PolarHBondContact O-N 3.33Å; K266-V268 VanDerWaalsContact C-N 3.31Å
269	S	66.8	Low	80.3	Confident	29 Å²	29	56.8 Å²	56.8	20%	0.203	30%	0.295	C	S	.	.			trans	-145.1	144.1	171.7	172.1	0	0	0	0	109.5	A267 N271 C272	A267-S269 PolarHBondContact O-N 3.04Å; S269-N271 PolarHBondContact O-N 3.14Å; S269-C272 VanDerWaalsContact CB-SG 3.52Å; S269-C272 WeakPolarHBondContact O-CB 3.28Å; S269-C272 PolarHBondContact O-N 3Å
270	P	56.2	Low	79.6	Confident	112 Å²	112	56.9 Å²	56.9	73%	0.727	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	128.3	174.2	-21.7	31.7	0	0	0	110
271	N	56.6	Low	78.7	Confident	171 Å²	171	56.8 Å²	56.8	91%	0.914	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	73	12.3	-178.4	-45.4	-46.5	0	0	0	116.7	S269	S269-N271 PolarHBondContact O-N 3.14Å
272	C	61.3	Low	77.3	Confident	42 Å²	42	55.5 Å²	55.5	28%	0.284	29%	0.285	S	S	.	.	P	Polyproline II helix	trans	-92.6	154.6	171.9	-65.8	0	0	0	0	111.7	S269	S269-C272 VanDerWaalsContact CB-SG 3.52Å; S269-C272 WeakPolarHBondContact O-CB 3.28Å; S269-C272 PolarHBondContact O-N 3Å
273	W	65.2	Low	76.2	Confident	72 Å²	72	51.2 Å²	51.2	27%	0.273	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-70.7	144.5	173.9	-150.5	-65.9	0	0	0	108.5	V275 V543 K546	W273-V275 PolarHBondContact O-N 2.97Å; W273-V543 HydrophobicContact CH2-CG1 3.93Å; W273-V543 HydrophobicContact CZ3-CG1 4.02Å; W273-V543 HydrophobicContact CZ3-CG2 4.35Å; W273-K546 HydrophobicContact CD2-CD 4.3Å; W273-K546 HydrophobicContact CE3-CD 3.39Å; W273-K546 HydrophobicContact CZ3-CD 3.81Å
274	N	81.1	Confident	75.1	Confident	128 Å²	128	51.3 Å²	51.3	68%	0.684	27%	0.268	S	S	*	.	P	Polyproline II helix	trans	-62.5	131.9	169.4	-72.1	-20.8	0	0	0	109.3	I276	N274-I276 WeakPolarHBondContact O-CD1 3.32Å; N274-I276 PolarHBondContact O-N 3.22Å
275	V	90	Very high	73.6	Confident	9 Å²	9	48.8 Å²	48.8	6%	0.055	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-61.9	116.5	178.2	-179.7	0	0	0	0	109.4	M241 V242 L244 R264 A267 W273 H277	M241-V275 HydrophobicContact CE-CB 4.42Å; M241-V275 HydrophobicContact CE-CG1 3.99Å; M241-V275 HydrophobicContact CE-CG2 3.58Å; V242-V275 WeakPolarHBondContact O-CA 3.42Å; L244-V275 HydrophobicContact CB-CG1 3.96Å; R264-V275 HydrophobicContact CG-CB 4.05Å; R264-V275 PolarHBondContact NE-O 3.49Å; A267-V275 HydrophobicContact CB-CG2 3.53Å; W273-V275 PolarHBondContact O-N 2.97Å; V275-H277 PolarHBondContact O-N 3.35Å
276	I	91.7	Very high	72.4	Confident	5 Å²	5	44.6 Å²	44.6	3%	0.026	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	112	-178.7	-56.4	-57.8	0	0	0	107.9	V242 G243 L244 N274 Y278 D477 L478 I481 L550	V242-I276 PolarHBondContact O-N 2.98Å; G243-I276 CarbonylContact C-O 3.59Å; G243-I276 VanDerWaalsContact CA-O 3.24Å; G243-I276 WeakPolarHBondContact CA-O 3.4Å; L244-I276 PolarHBondContact N-O 3.32Å; N274-I276 WeakPolarHBondContact O-CD1 3.32Å; N274-I276 PolarHBondContact O-N 3.22Å; I276-Y278 HydrophobicContact CG2-CD1 4.03Å; I276-Y278 HydrophobicContact CG2-CE1 4.24Å; I276-D477 HydrophobicContact CG2-CB 3.86Å; I276-L478 HydrophobicContact CG2-CD2 3.9Å; I276-I481 HydrophobicContact CD1-CD1 4.4Å; I276-I481 HydrophobicContact CD1-CG2 3.67Å; I276-I481 HydrophobicContact CG1-CD1 4.18Å; I276-I481 HydrophobicContact CG2-CD1 4.01Å; I276-L550 HydrophobicContact CB-CD2 4.25Å; I276-L550 HydrophobicContact CG2-CD2 4.45Å
277	H	92	Very high	71.5	Confident	17 Å²	17	39 Å²	39	8%	0.079	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	134	178	167.9	-111.7	0	0	0	111.1	L244 T246 H248 I253 V260 V275 D477	L244-H277 VanDerWaalsContact O-CA 3.31Å; L244-H277 WeakPolarHBondContact O-CA 3.36Å; L244-H277 PolarHBondContact O-CD2 3.39Å; L244-H277 VanDerWaalsContact O-CD2 3.31Å; T246-H277 PolarHBondContact OG1-NE2 3.27Å; T246-H277 VanDerWaalsContact OG1-NE2 3.1Å; H248-H277 AromaticContact CD2-CE1 3.8Å; H248-H277 AromaticContact CD2-NE2 3.57Å; H248-H277 AromaticContact CE1-CE1 3.3Å; H248-H277 PolarHBondContact CE1-CE1 3.09Å; H248-H277 AromaticContact CE1-NE2 3.82Å; H248-H277 AromaticContact NE2-CE1 3Å; H248-H277 PolarHBondContact NE2-CE1 2.9Å; H248-H277 AromaticContact NE2-NE2 3.05Å; H248-H277 PolarHBondContact NE2-NE2 3.41Å; I253-H277 VanDerWaalsContact CG2-CE1 3.44Å; I253-H277 WeakPolarHBondContact CG2-CE1 3.48Å; V260-H277 HydrophobicContact CG1-CB 3.85Å; V275-H277 PolarHBondContact O-N 3.35Å; H277-D477 PolarHBondContact N-OD2 3.02Å; H277-D477 WeakPolarHBondContact O-CB 3.26Å
278	Y	89.4	Confident	70.2	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	165.7	175.3	53	-77.6	0	0	0	110.6	L244 T245 T246 I276 F281 H474 L478 L550 F551	L244-Y278 PolarHBondContact O-N 3.37Å; T245-Y278 VanDerWaalsContact CA-O 3.32Å; T245-Y278 WeakPolarHBondContact CA-O 3.47Å; T245-Y278 HydrophobicContact CG2-CD1 4.39Å; T245-Y278 HydrophobicContact CG2-CD2 3.81Å; T245-Y278 HydrophobicContact CG2-CE1 3.85Å; T245-Y278 HydrophobicContact CG2-CE2 3.2Å; T245-Y278 HydrophobicContact CG2-CG 4.37Å; T245-Y278 WeakPolarHBondContact CG2-OH 3.32Å; T246-Y278 PolarHBondContact N-O 3.02Å; I276-Y278 HydrophobicContact CG2-CD1 4.03Å; I276-Y278 HydrophobicContact CG2-CE1 4.24Å; Y278-F281 HydrophobicContact CD2-CZ 4.29Å; Y278-F281 AromaticContact CE2-CE2 3.98Å; Y278-F281 HydrophobicContact CE2-CE2 3.98Å; Y278-F281 AromaticContact CE2-CZ 3.94Å; Y278-F281 HydrophobicContact CE2-CZ 3.94Å; Y278-H474 VanDerWaalsContact CA-O 3.28Å; Y278-H474 WeakPolarHBondContact CA-O 3.11Å; Y278-L478 HydrophobicContact CD1-CD1 4.2Å; Y278-L478 HydrophobicContact CD1-CD2 3.79Å; Y278-L478 HydrophobicContact CD1-CG 3.85Å; Y278-L478 HydrophobicContact CD2-CD1 3.73Å; Y278-L478 HydrophobicContact CD2-CG 4.28Å; Y278-L478 HydrophobicContact CE1-CD2 3.94Å; Y278-L478 HydrophobicContact CE1-CG 4.44Å; Y278-L478 HydrophobicContact CE2-CD1 4.2Å; Y278-L478 HydrophobicContact CG-CD1 3.72Å; Y278-L478 HydrophobicContact CG-CD2 4.18Å; Y278-L478 HydrophobicContact CG-CG 3.77Å; Y278-L550 HydrophobicContact CE1-CD2 4.18Å; Y278-F551 PolarHBondContact OH-N 2.85Å; Y278-F551 PolarHBondContact OH-O 3.11Å; Y278-F551 VanDerWaalsContact OH-O 3.07Å
279	S	81.8	Confident	68.6	Low	1 Å²	1	35.9 Å²	35.9	1%	0.007	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	138.3	176.1	-162.9	0	0	0	0	110.5	T246 H248 H474 F475	T246-S279 WeakPolarHBondContact O-CA 3.43Å; H248-S279 WeakPolarHBondContact CD2-CA 3.31Å; H248-S279 VanDerWaalsContact CD2-CB 3.41Å; H248-S279 WeakPolarHBondContact CD2-CB 3.5Å; H248-S279 VanDerWaalsContact NE2-CA 3.29Å; H248-S279 WeakPolarHBondContact NE2-CA 3.3Å; H248-S279 PolarHBondContact NE2-N 3.44Å; S279-H474 PolarHBondContact N-O 3.08Å; S279-H474 VanDerWaalsContact N-O 3.13Å; S279-F475 WeakPolarHBondContact O-CE1 3.27Å
280	G	72.6	Confident	67.2	Low	2 Å²	2	43.3 Å²	43.3	2%	0.021	23%	0.226	C	C	.	.			trans	-55.3	141.9	167.8	0	0	0	0	0	110.2	T246 L282	T246-G280 PolarHBondContact O-N 3.17Å; G280-L282 PolarHBondContact O-N 3.16Å
281	F	71.2	Confident	66.4	Low	2 Å²	2	40.4 Å²	40.4	1%	0.009	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-14.7	-175.5	-63.1	-62.6	0	0	0	115.3	Y278 L398 A408 I412 F475 L478 F551 N554	Y278-F281 HydrophobicContact CD2-CZ 4.29Å; Y278-F281 AromaticContact CE2-CE2 3.98Å; Y278-F281 HydrophobicContact CE2-CE2 3.98Å; Y278-F281 AromaticContact CE2-CZ 3.94Å; Y278-F281 HydrophobicContact CE2-CZ 3.94Å; F281-L398 HydrophobicContact CB-CB 3.96Å; F281-L398 HydrophobicContact CB-CD1 3.88Å; F281-L398 HydrophobicContact CB-CG 4.36Å; F281-L398 HydrophobicContact CD1-CD1 3.91Å; F281-L398 HydrophobicContact CD1-CD2 3.79Å; F281-L398 HydrophobicContact CD1-CG 4.32Å; F281-L398 HydrophobicContact CE1-CD2 4.24Å; F281-L398 HydrophobicContact CG-CB 4.41Å; F281-L398 HydrophobicContact CG-CD1 4.29Å; F281-L398 HydrophobicContact CG-CD2 4.33Å; F281-A408 HydrophobicContact CD1-CB 4.46Å; F281-A408 HydrophobicContact CE1-CB 3.9Å; F281-A408 HydrophobicContact CE2-CB 4.01Å; F281-A408 HydrophobicContact CZ-CB 3.65Å; F281-I412 HydrophobicContact CD1-CD1 4.44Å; F281-I412 HydrophobicContact CD1-CG1 4.44Å; F281-I412 HydrophobicContact CE1-CG1 4.24Å; F281-F475 HydrophobicContact CD1-CE1 4.26Å; F281-F475 HydrophobicContact CE1-CE1 4.08Å; F281-L478 HydrophobicContact CZ-CD1 4.48Å; F281-F551 WeakPolarHBondContact CE2-O 3.31Å; F281-N554 HydrophobicContact CB-CB 4.37Å; F281-N554 PolarHBondContact N-ND2 3.06Å; F281-N554 PolarHBondContact N-OD1 3.36Å
282	L	57.5	Low	66.2	Low	16 Å²	16	32.4 Å²	32.4	8%	0.084	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-31.9	-174.4	-178.7	58.3	0	0	0	113.5	G280 L284 N554 C557 E558	G280-L282 PolarHBondContact O-N 3.16Å; L282-L284 VanDerWaalsContact C-N 3.32Å; L282-L284 PolarHBondContact O-N 2.82Å; L282-N554 HydrophobicContact CB-CB 3.68Å; L282-N554 WeakPolarHBondContact CB-ND2 3.5Å; L282-N554 PolarHBondContact N-ND2 3.41Å; L282-C557 HydrophobicContact CD2-CB 4.13Å; L282-E558 HydrophobicContact CD1-CG 3.59Å; L282-E558 WeakPolarHBondContact CD1-OE1 3.26Å; L282-E558 HydrophobicContact CD2-CG 3.92Å; L282-E558 WeakPolarHBondContact CD2-OE1 3.28Å; L282-E558 HydrophobicContact CG-CG 4.29Å; L282-E558 WeakPolarHBondContact CG-OE1 3.48Å
283	H	63.7	Low	66.3	Low	4 Å²	4	34 Å²	34	2%	0.019	17%	0.167	C	C	.	.			trans	-100.5	29.7	-163.7	-59.4	-38.9	0	0	0	112.5	D180 Q182 E285 L286	D180-H283 VanDerWaalsContact CG-NE2 3.3Å; D180-H283 IonicContact OD1-NE2 3.23Å; D180-H283 PolarHBondContact OD1-NE2 3.42Å; D180-H283 IonicContact OD2-CD2 3.23Å; D180-H283 IonicContact OD2-CE1 3.26Å; D180-H283 IonicContact OD2-NE2 3.08Å; D180-H283 PolarHBondContact OD2-NE2 3.01Å; Q182-H283 PolarHBondContact NE2-CE1 3.48Å; Q182-H283 VanDerWaalsContact NE2-CG 3.32Å; Q182-H283 PolarHBondContact NE2-ND1 3.05Å; Q182-H283 PolarHBondContact OE1-CE1 2.88Å; Q182-H283 PolarHBondContact OE1-ND1 3.45Å; H283-E285 WeakPolarHBondContact CA-OE2 3.13Å; H283-E285 IonicContact ND1-OE1 3.99Å; H283-E285 PolarHBondContact O-N 3.03Å; H283-E285 VanDerWaalsContact O-N 3.14Å; H283-L286 HydrophobicContact CB-CD1 3.94Å; H283-L286 HydrophobicContact CB-CG 4.16Å; H283-L286 VanDerWaalsContact O-CB 3.31Å; H283-L286 WeakPolarHBondContact O-CB 3.32Å; H283-L286 PolarHBondContact O-N 3.35Å
284	L	63.8	Low	66.4	Low	1 Å²	1	31.2 Å²	31.2	1%	0.005	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-62.1	-20.5	-179.6	-61.9	177.8	0	0	0	111.7	L282 L286 L287 L391 L394 L398 F471 F475	L282-L284 VanDerWaalsContact C-N 3.32Å; L282-L284 PolarHBondContact O-N 2.82Å; L284-L286 PolarHBondContact O-N 3.33Å; L284-L287 HydrophobicContact CB-CD1 4.08Å; L284-L287 HydrophobicContact CD2-CD1 3.82Å; L284-L287 WeakPolarHBondContact O-CB 3.35Å; L284-L287 WeakPolarHBondContact O-CD1 3.26Å; L284-L287 WeakPolarHBondContact O-CG 3.48Å; L284-L287 PolarHBondContact O-N 3.1Å; L284-L287 VanDerWaalsContact O-N 3.14Å; L284-L391 HydrophobicContact CB-CD2 4.35Å; L284-L394 HydrophobicContact CD1-CB 4.42Å; L284-L394 HydrophobicContact CD1-CD2 3.45Å; L284-L394 VanDerWaalsContact CD1-CD2 3.45Å; L284-L394 HydrophobicContact CD1-CG 3.74Å; L284-L398 HydrophobicContact CD1-CD1 3.84Å; L284-F471 HydrophobicContact CD1-CZ 4.49Å; L284-F471 HydrophobicContact CD2-CE1 4.28Å; L284-F471 HydrophobicContact CD2-CZ 4.26Å; L284-F475 HydrophobicContact CD2-CE2 4.21Å; L284-F475 HydrophobicContact CD2-CZ 3.93Å
285	E	57.8	Low	65.8	Low	27 Å²	27	28.7 Å²	28.7	13%	0.126	14%	0.144	C	C	.	.	G	3₁₀ helix	trans	-71.5	-16.1	175	81.8	-78.5	177.1	0	0	113.8	Q182 H283 L287 R343 M388	Q182-E285 PolarHBondContact NE2-OE1 2.94Å; Q182-E285 VanDerWaalsContact NE2-OE1 3.08Å; H283-E285 WeakPolarHBondContact CA-OE2 3.13Å; H283-E285 IonicContact ND1-OE1 3.99Å; H283-E285 PolarHBondContact O-N 3.03Å; H283-E285 VanDerWaalsContact O-N 3.14Å; E285-L287 VanDerWaalsContact C-N 3.26Å; E285-R343 HydrophobicContact CB-CB 3.81Å; E285-R343 WeakPolarHBondContact CB-O 3.37Å; E285-R343 HydrophobicContact CG-CB 3.72Å; E285-R343 PolarHBondContact O-NH1 3.01Å; E285-M388 HydrophobicContact CB-CE 3.69Å
286	L	60.6	Low	65.4	Low	46 Å²	46	32.5 Å²	32.5	24%	0.241	16%	0.162	C	C	.	.	G	3₁₀ helix	trans	-79.7	-6.2	170.4	-58.2	-174.8	0	0	0	113	Q182 H283 L284 S288	Q182-L286 HydrophobicContact CG-CD1 4.24Å; H283-L286 HydrophobicContact CB-CD1 3.94Å; H283-L286 HydrophobicContact CB-CG 4.16Å; H283-L286 VanDerWaalsContact O-CB 3.31Å; H283-L286 WeakPolarHBondContact O-CB 3.32Å; H283-L286 PolarHBondContact O-N 3.35Å; L284-L286 PolarHBondContact O-N 3.33Å; L286-S288 PolarHBondContact O-N 2.81Å
287	L	63.4	Low	65	Low	14 Å²	14	32.4 Å²	32.4	7%	0.073	16%	0.161	C	C	.	.			trans	-70.7	73.7	174.1	-57.8	174.3	0	0	0	110	L284 E285 L467 E470 F471 H474	L284-L287 HydrophobicContact CB-CD1 4.08Å; L284-L287 HydrophobicContact CD2-CD1 3.82Å; L284-L287 WeakPolarHBondContact O-CB 3.35Å; L284-L287 WeakPolarHBondContact O-CD1 3.26Å; L284-L287 WeakPolarHBondContact O-CG 3.48Å; L284-L287 PolarHBondContact O-N 3.1Å; L284-L287 VanDerWaalsContact O-N 3.14Å; E285-L287 VanDerWaalsContact C-N 3.26Å; L287-L467 HydrophobicContact CB-CD1 3.91Å; L287-L467 HydrophobicContact CD1-CD1 4.29Å; L287-E470 HydrophobicContact CD2-CB 4.43Å; L287-F471 HydrophobicContact CD1-CD2 3.8Å; L287-F471 HydrophobicContact CD1-CE1 4.45Å; L287-F471 HydrophobicContact CD1-CE2 3.36Å; L287-F471 HydrophobicContact CD1-CZ 3.73Å; L287-H474 HydrophobicContact CD2-CB 4.46Å; L287-H474 WeakPolarHBondContact CD2-CD2 3.39Å; L287-H474 VanDerWaalsContact CD2-CE1 3.42Å; L287-H474 WeakPolarHBondContact CD2-CE1 3.38Å; L287-H474 VanDerWaalsContact CD2-NE2 3.25Å; L287-H474 WeakPolarHBondContact CD2-NE2 3.31Å
288	S	54.7	Low	64.4	Low	40 Å²	40	31.7 Å²	31.7	28%	0.28	16%	0.158	S	C	.	.			trans	-86.1	128.4	-178.9	63	0	0	0	0	112.5	L286	L286-S288 PolarHBondContact O-N 2.81Å
289	S	44.2	Very low	63.9	Low	16 Å²	16	35.2 Å²	35.2	11%	0.112	18%	0.177	C	C	.	.			trans	-86.2	140.3	163.8	173.5	0	0	0	0	110.6	R466	S289-R466 WeakPolarHBondContact OG-CD 3.45Å
290	Y	37.5	Very low	64.2	Low	185 Å²	185	35.6 Å²	35.6	73%	0.725	18%	0.179	S	C	*	.	S	Bend	trans	-81.7	-1.9	179.7	-66	-85.7	0	0	0	115.4
291	D	38.6	Very low	65	Low	51 Å²	51	35.5 Å²	35.5	27%	0.273	18%	0.178	S	C	.	.	S	Bend	trans	-101.1	-34	-170.2	-90.3	-0	0	0	0	116.7	M462 R466	D291-M462 WeakPolarHBondContact OD2-CG 3.36Å; D291-R466 IonicContact OD1-CZ 3.82Å; D291-R466 IonicContact OD1-NE 3.66Å; D291-R466 IonicContact OD1-NH1 3.67Å; D291-R466 PolarHBondContact OD1-NH1 3.42Å; D291-R466 IonicContact OD1-NH2 2.69Å; D291-R466 PolarHBondContact OD1-NH2 3.45Å; D291-R466 IonicContact OD2-CZ 3.61Å; D291-R466 IonicContact OD2-NE 2.8Å; D291-R466 PolarHBondContact OD2-NE 2.92Å; D291-R466 IonicContact OD2-NH1 3.32Å; D291-R466 PolarHBondContact OD2-NH1 3.48Å; D291-R466 VanDerWaalsContact OD2-NH1 3.17Å; D291-R466 IonicContact OD2-NH2 3.83Å; D291-R466 PolarHBondContact OD2-NH2 3.12Å
292	V	52.5	Low	65.5	Low	2 Å²	2	36 Å²	36	1%	0.012	18%	0.182	C	C	.	.	S	Bend	trans	-84.9	130.4	156.5	162.9	0	0	0	0	104.2	V294 I297 V463	V292-V294 HydrophobicContact CB-CG2 4.14Å; V292-V294 HydrophobicContact CG1-CG2 3.73Å; V292-V294 PolarHBondContact O-N 3.37Å; V292-I297 HydrophobicContact CG1-CD1 4.18Å; V292-V463 HydrophobicContact CB-CG2 3.9Å; V292-V463 HydrophobicContact CG2-CB 4.43Å; V292-V463 HydrophobicContact CG2-CG2 3.2Å
293	D	62.2	Low	66.8	Low	76 Å²	76	41.2 Å²	41.2	41%	0.406	21%	0.206	S	C	.	.			trans	-74.5	64.8	174.7	-158	-14.4	0	0	0	108.7	N295 Q296 I297	D293-N295 PolarHBondContact O-N 2.98Å; D293-Q296 HydrophobicContact CB-CB 3.71Å; D293-Q296 WeakPolarHBondContact O-CA 3.4Å; D293-Q296 WeakPolarHBondContact O-CB 3.24Å; D293-Q296 PolarHBondContact O-N 3.41Å; D293-Q296 WeakPolarHBondContact OD1-CB 3.45Å; D293-Q296 PolarHBondContact OD1-N 3.5Å; D293-Q296 WeakPolarHBondContact OD2-CB 3.49Å; D293-I297 PolarHBondContact O-N 3.02Å
294	V	67.9	Low	68	Low	14 Å²	14	41.4 Å²	41.4	9%	0.085	21%	0.206	C	C	.	.	H	α-helix	trans	-52.9	-35.1	173.8	176.5	0	0	0	0	108.2	V292 I297 V298 L384	V292-V294 HydrophobicContact CB-CG2 4.14Å; V292-V294 HydrophobicContact CG1-CG2 3.73Å; V292-V294 PolarHBondContact O-N 3.37Å; V294-I297 PolarHBondContact O-N 3.48Å; V294-V298 HydrophobicContact CG1-CG2 4.04Å; V294-V298 WeakPolarHBondContact O-CB 3.29Å; V294-V298 WeakPolarHBondContact O-CG2 3.07Å; V294-V298 PolarHBondContact O-N 3.39Å; V294-L384 HydrophobicContact CG1-CD1 3.95Å; V294-L384 HydrophobicContact CG1-CD2 4.03Å; V294-L384 HydrophobicContact CG2-CD1 3.97Å
295	N	69.8	Low	69.1	Low	74 Å²	74	41.6 Å²	41.6	40%	0.396	21%	0.207	S	C	.	.	H	α-helix	trans	-65.2	-46	175	-64.7	-32.1	0	0	0	111.4	D293 V298 N299 R343	D293-N295 PolarHBondContact O-N 2.98Å; N295-V298 PolarHBondContact O-N 2.96Å; N295-N299 WeakPolarHBondContact O-CB 3.38Å; N295-N299 PolarHBondContact O-N 3.46Å; N295-N299 PolarHBondContact O-ND2 3.47Å; N295-N299 PolarHBondContact O-OD1 3.01Å; N295-R343 PolarHBondContact OD1-NH2 3.42Å; N295-R343 VanDerWaalsContact OD1-NH2 3.12Å
296	Q	80.4	Confident	70.3	Confident	90 Å²	90	43.9 Å²	43.9	42%	0.421	22%	0.223	S	C	.	.	H	α-helix	trans	-59.7	-47.3	174	-177	-174.1	10.6	0	0	111.9	D293 N299 T300	D293-Q296 HydrophobicContact CB-CB 3.71Å; D293-Q296 WeakPolarHBondContact O-CA 3.4Å; D293-Q296 WeakPolarHBondContact O-CB 3.24Å; D293-Q296 PolarHBondContact O-N 3.41Å; D293-Q296 WeakPolarHBondContact OD1-CB 3.45Å; D293-Q296 PolarHBondContact OD1-N 3.5Å; D293-Q296 WeakPolarHBondContact OD2-CB 3.49Å; Q296-N299 PolarHBondContact O-N 3.24Å; Q296-T300 WeakPolarHBondContact O-CB 3.47Å; Q296-T300 PolarHBondContact O-N 3.38Å; Q296-T300 PolarHBondContact O-OG1 3.24Å
297	I	83.3	Confident	71.6	Confident	3 Å²	3	43.5 Å²	43.5	2%	0.015	22%	0.221	C	C	.	.	H	α-helix	trans	-60.9	-49.6	178.8	-64.7	170	0	0	0	110.4	V292 D293 V294 N299 T300 I301 W377 D380 F381 L384	V292-I297 HydrophobicContact CG1-CD1 4.18Å; D293-I297 PolarHBondContact O-N 3.02Å; V294-I297 PolarHBondContact O-N 3.48Å; I297-N299 VanDerWaalsContact C-N 3.35Å; I297-N299 PolarHBondContact O-N 2.86Å; I297-T300 PolarHBondContact O-N 3.24Å; I297-I301 HydrophobicContact CG2-CD1 3.63Å; I297-I301 HydrophobicContact CG2-CG1 4.44Å; I297-I301 WeakPolarHBondContact O-CB 2.93Å; I297-I301 WeakPolarHBondContact O-CG1 3.42Å; I297-I301 PolarHBondContact O-N 3.4Å; I297-W377 HydrophobicContact CB-CZ2 4.45Å; I297-W377 HydrophobicContact CG1-CZ2 4.37Å; I297-W377 HydrophobicContact CG2-CZ2 4.08Å; I297-D380 HydrophobicContact CD1-CB 3.66Å; I297-F381 HydrophobicContact CG2-CB 4.46Å; I297-F381 HydrophobicContact CG2-CD2 3.98Å; I297-F381 HydrophobicContact CG2-CG 4.46Å; I297-L384 HydrophobicContact CB-CD2 4.22Å; I297-L384 HydrophobicContact CD1-CD2 4.38Å; I297-L384 HydrophobicContact CG2-CD2 3.85Å
298	V	79.1	Confident	72.8	Confident	2 Å²	2	43 Å²	43	1%	0.012	22%	0.218	C	C	.	.	H	α-helix	trans	-63.6	-38.9	179.3	170.6	0	0	0	0	111.5	V294 N295 S302 N339 L342 L384	V294-V298 HydrophobicContact CG1-CG2 4.04Å; V294-V298 WeakPolarHBondContact O-CB 3.29Å; V294-V298 WeakPolarHBondContact O-CG2 3.07Å; V294-V298 PolarHBondContact O-N 3.39Å; N295-V298 PolarHBondContact O-N 2.96Å; V298-S302 VanDerWaalsContact O-CB 3.24Å; V298-S302 WeakPolarHBondContact O-CB 3.36Å; V298-S302 PolarHBondContact O-N 3.42Å; V298-S302 PolarHBondContact O-OG 2.73Å; V298-N339 HydrophobicContact CG1-CB 4.17Å; V298-N339 WeakPolarHBondContact CG1-OD1 3.39Å; V298-L342 HydrophobicContact CG1-CB 4Å; V298-L342 HydrophobicContact CG1-CD1 3.81Å; V298-L342 WeakPolarHBondContact O-CD1 3.3Å; V298-L384 HydrophobicContact CG2-CD2 4.48Å
299	N	80.2	Confident	74.3	Confident	73 Å²	73	43.3 Å²	43.3	39%	0.39	22%	0.215	S	C	.	.	H	α-helix	trans	-68.5	-45	177.1	-70.6	-22.6	0	0	0	111.4	N295 Q296 I297 I301 S302 E303	N295-N299 WeakPolarHBondContact O-CB 3.38Å; N295-N299 PolarHBondContact O-N 3.46Å; N295-N299 PolarHBondContact O-ND2 3.47Å; N295-N299 PolarHBondContact O-OD1 3.01Å; Q296-N299 PolarHBondContact O-N 3.24Å; I297-N299 VanDerWaalsContact C-N 3.35Å; I297-N299 PolarHBondContact O-N 2.86Å; N299-I301 PolarHBondContact O-N 3.18Å; N299-S302 VanDerWaalsContact O-CB 3.26Å; N299-S302 WeakPolarHBondContact O-CB 3.42Å; N299-S302 PolarHBondContact O-N 2.86Å; N299-E303 WeakPolarHBondContact O-CG 3.46Å; N299-E303 PolarHBondContact O-N 3.02Å
300	T	87.9	Confident	76.3	Confident	10 Å²	10	47 Å²	47	6%	0.061	24%	0.237	C	C	.	.	H	α-helix	trans	-60	-46.9	175.4	-65.9	0	0	0	0	110.7	Q296 I297 S302 E303 W304 H371 W377	Q296-T300 WeakPolarHBondContact O-CB 3.47Å; Q296-T300 PolarHBondContact O-N 3.38Å; Q296-T300 PolarHBondContact O-OG1 3.24Å; I297-T300 PolarHBondContact O-N 3.24Å; T300-S302 VanDerWaalsContact C-N 3.29Å; T300-S302 PolarHBondContact O-N 2.65Å; T300-E303 WeakPolarHBondContact O-CB 3.29Å; T300-E303 PolarHBondContact O-N 3.41Å; T300-W304 HydrophobicContact CG2-CD2 4.28Å; T300-W304 HydrophobicContact CG2-CH2 4.19Å; T300-W304 HydrophobicContact CG2-CZ2 3.49Å; T300-W304 VanDerWaalsContact CG2-CZ2 3.49Å; T300-W304 PolarHBondContact O-N 3.26Å; T300-H371 PolarHBondContact OG1-NE2 3.19Å; T300-W377 HydrophobicContact CG2-CZ2 3.99Å
301	I	87.8	Confident	78.7	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-63.8	-37.9	177.4	-69.1	169.7	0	0	0	110.9	I297 N299 E303 W304 I305 L342 L348 I351 W377 F381	I297-I301 HydrophobicContact CG2-CD1 3.63Å; I297-I301 HydrophobicContact CG2-CG1 4.44Å; I297-I301 WeakPolarHBondContact O-CB 2.93Å; I297-I301 WeakPolarHBondContact O-CG1 3.42Å; I297-I301 PolarHBondContact O-N 3.4Å; N299-I301 PolarHBondContact O-N 3.18Å; I301-E303 VanDerWaalsContact C-N 3.34Å; I301-E303 PolarHBondContact O-N 3.02Å; I301-W304 HydrophobicContact CG1-CE3 4.08Å; I301-W304 HydrophobicContact CG1-CZ3 4.13Å; I301-W304 WeakPolarHBondContact O-CB 3.4Å; I301-W304 PolarHBondContact O-N 3.25Å; I301-I305 HydrophobicContact CG2-CD1 3.94Å; I301-I305 WeakPolarHBondContact O-CG1 3.49Å; I301-I305 PolarHBondContact O-N 3.45Å; I301-L342 HydrophobicContact CB-CD1 4.31Å; I301-L342 HydrophobicContact CG2-CD1 3.95Å; I301-L342 HydrophobicContact CG2-CD2 3.59Å; I301-L342 HydrophobicContact CG2-CG 4.44Å; I301-L348 HydrophobicContact CD1-CD1 3.65Å; I301-I351 HydrophobicContact CG2-CD1 3.56Å; I301-I351 HydrophobicContact CG2-CG2 3.95Å; I301-W377 HydrophobicContact CG1-CH2 4.44Å; I301-F381 HydrophobicContact CD1-CD2 3.83Å; I301-F381 HydrophobicContact CD1-CE2 3.36Å; I301-F381 HydrophobicContact CD1-CZ 3.77Å
302	S	82.3	Confident	81	Confident	12 Å²	12	43.2 Å²	43.2	8%	0.084	22%	0.217	C	C	.	.	H	α-helix	trans	-58	-45.6	174.1	-71.6	0	0	0	0	111.9	V298 N299 T300 W304 I305 V306 L338 N339 L342	V298-S302 VanDerWaalsContact O-CB 3.24Å; V298-S302 WeakPolarHBondContact O-CB 3.36Å; V298-S302 PolarHBondContact O-N 3.42Å; V298-S302 PolarHBondContact O-OG 2.73Å; N299-S302 VanDerWaalsContact O-CB 3.26Å; N299-S302 WeakPolarHBondContact O-CB 3.42Å; N299-S302 PolarHBondContact O-N 2.86Å; T300-S302 VanDerWaalsContact C-N 3.29Å; T300-S302 PolarHBondContact O-N 2.65Å; S302-W304 VanDerWaalsContact C-N 3.33Å; S302-W304 PolarHBondContact O-N 3.48Å; S302-I305 PolarHBondContact O-N 2.85Å; S302-V306 WeakPolarHBondContact O-CG2 3.37Å; S302-V306 PolarHBondContact O-N 3.2Å; S302-L338 VanDerWaalsContact CB-CD2 3.41Å; S302-L338 WeakPolarHBondContact OG-CD2 3.46Å; S302-N339 PolarHBondContact OG-OD1 3.38Å; S302-L342 WeakPolarHBondContact OG-CD1 3.49Å
303	E	85.4	Confident	82.6	Confident	125 Å²	125	46 Å²	46	58%	0.584	24%	0.235	S	C	*	.	H	α-helix	trans	-61.2	-41.1	175.3	-69.6	174.7	-176	0	0	111.8	N299 T300 I301 I305 V306 L307	N299-E303 WeakPolarHBondContact O-CG 3.46Å; N299-E303 PolarHBondContact O-N 3.02Å; T300-E303 WeakPolarHBondContact O-CB 3.29Å; T300-E303 PolarHBondContact O-N 3.41Å; I301-E303 VanDerWaalsContact C-N 3.34Å; I301-E303 PolarHBondContact O-N 3.02Å; E303-I305 PolarHBondContact O-N 3.03Å; E303-V306 PolarHBondContact O-N 3.39Å; E303-L307 WeakPolarHBondContact O-CG 3.33Å; E303-L307 PolarHBondContact O-N 3.36Å
304	W	89.4	Confident	83.8	Confident	9 Å²	9	53.9 Å²	53.9	3%	0.034	26%	0.259	C	S	.	.	H	α-helix	trans	-61.7	-43.5	175.2	-61.9	-12.3	0	0	0	111.9	T300 I301 S302 V306 L307 I308 L358 L362 H371 F372 W377	T300-W304 HydrophobicContact CG2-CD2 4.28Å; T300-W304 HydrophobicContact CG2-CH2 4.19Å; T300-W304 HydrophobicContact CG2-CZ2 3.49Å; T300-W304 VanDerWaalsContact CG2-CZ2 3.49Å; T300-W304 PolarHBondContact O-N 3.26Å; I301-W304 HydrophobicContact CG1-CE3 4.08Å; I301-W304 HydrophobicContact CG1-CZ3 4.13Å; I301-W304 WeakPolarHBondContact O-CB 3.4Å; I301-W304 PolarHBondContact O-N 3.25Å; S302-W304 VanDerWaalsContact C-N 3.33Å; S302-W304 PolarHBondContact O-N 3.48Å; W304-V306 VanDerWaalsContact C-N 3.32Å; W304-V306 PolarHBondContact O-N 3.49Å; W304-L307 WeakPolarHBondContact O-CB 3.14Å; W304-L307 PolarHBondContact O-N 3.01Å; W304-L307 VanDerWaalsContact O-N 3.12Å; W304-I308 VanDerWaalsContact O-CG1 3.26Å; W304-I308 WeakPolarHBondContact O-CG1 3.41Å; W304-I308 PolarHBondContact O-N 2.79Å; W304-L358 HydrophobicContact CE3-CD1 4.48Å; W304-L362 HydrophobicContact CD2-CD1 4.17Å; W304-L362 HydrophobicContact CG-CD1 4.16Å; W304-L362 HydrophobicContact CG-CD2 4.49Å; W304-L362 HydrophobicContact CZ2-CD1 4.38Å; W304-H371 HydrophobicContact CH2-CB 4.21Å; W304-H371 HydrophobicContact CZ2-CB 3.88Å; W304-F372 HydrophobicContact CE3-CZ 4.5Å; W304-F372 HydrophobicContact CH2-CD2 4.43Å; W304-F372 HydrophobicContact CH2-CE1 4.38Å; W304-F372 AromaticContact CH2-CE2 3.56Å; W304-F372 HydrophobicContact CH2-CE2 3.56Å; W304-F372 AromaticContact CH2-CZ 3.54Å; W304-F372 HydrophobicContact CH2-CZ 3.54Å; W304-F372 HydrophobicContact CZ2-CD2 4.4Å; W304-F372 AromaticContact CZ2-CE2 3.61Å; W304-F372 HydrophobicContact CZ2-CE2 3.61Å; W304-F372 HydrophobicContact CZ2-CZ 4.06Å; W304-F372 HydrophobicContact CZ3-CE2 4.2Å; W304-F372 AromaticContact CZ3-CZ 3.8Å; W304-F372 HydrophobicContact CZ3-CZ 3.8Å; W304-W377 AromaticContact CH2-CH2 3.26Å; W304-W377 HydrophobicContact CH2-CH2 3.26Å; W304-W377 HydrophobicContact CH2-CZ2 4.02Å; W304-W377 AromaticContact CH2-CZ3 3.67Å; W304-W377 HydrophobicContact CH2-CZ3 3.67Å; W304-W377 HydrophobicContact CZ2-CH2 4.18Å; W304-W377 AromaticContact CZ3-CH2 3.67Å; W304-W377 HydrophobicContact CZ3-CH2 3.67Å; W304-W377 HydrophobicContact CZ3-CZ3 4.28Å
305	I	85.9	Confident	84.8	Confident	5 Å²	5	57.3 Å²	57.3	3%	0.026	27%	0.27	C	S	.	.	H	α-helix	trans	-61.3	-42.1	176.8	-71.1	157.9	0	0	0	111.2	I301 S302 E303 L307 I308 K309 L338 W341 L342 I351	I301-I305 HydrophobicContact CG2-CD1 3.94Å; I301-I305 WeakPolarHBondContact O-CG1 3.49Å; I301-I305 PolarHBondContact O-N 3.45Å; S302-I305 PolarHBondContact O-N 2.85Å; E303-I305 PolarHBondContact O-N 3.03Å; I305-L307 VanDerWaalsContact C-N 3.29Å; I305-L307 PolarHBondContact O-N 3.36Å; I305-I308 PolarHBondContact O-N 3.3Å; I305-K309 HydrophobicContact CG2-CD 4.4Å; I305-K309 HydrophobicContact CG2-CG 4.4Å; I305-K309 WeakPolarHBondContact O-CB 3.49Å; I305-K309 WeakPolarHBondContact O-CG 3.12Å; I305-K309 PolarHBondContact O-N 2.68Å; I305-L338 HydrophobicContact CD1-CD1 4.23Å; I305-L338 HydrophobicContact CG2-CD1 4.11Å; I305-W341 HydrophobicContact CD1-CE3 4.47Å; I305-W341 HydrophobicContact CD1-CZ3 3.76Å; I305-W341 HydrophobicContact CG2-CZ3 4.46Å; I305-L342 HydrophobicContact CD1-CD1 4.18Å; I305-L342 HydrophobicContact CD1-CD2 3.62Å; I305-L342 HydrophobicContact CD1-CG 4.21Å; I305-I351 HydrophobicContact CD1-CD1 3.77Å; I305-I351 HydrophobicContact CG1-CD1 4.36Å
306	V	83.9	Confident	85.8	Confident	74 Å²	74	58.5 Å²	58.5	45%	0.448	28%	0.282	S	S	.	.	H	α-helix	trans	-60.6	-40.8	175.4	172.9	0	0	0	0	110.9	S302 E303 W304 K309 T310	S302-V306 WeakPolarHBondContact O-CG2 3.37Å; S302-V306 PolarHBondContact O-N 3.2Å; E303-V306 PolarHBondContact O-N 3.39Å; W304-V306 VanDerWaalsContact C-N 3.32Å; W304-V306 PolarHBondContact O-N 3.49Å; V306-K309 PolarHBondContact O-N 3.04Å; V306-T310 WeakPolarHBondContact O-CB 3.12Å; V306-T310 WeakPolarHBondContact O-CG2 3.28Å; V306-T310 PolarHBondContact O-N 2.83Å; V306-T310 VanDerWaalsContact O-N 3.07Å; V306-T310 PolarHBondContact O-OG1 3.48Å
307	L	88.2	Confident	86.3	Confident	38 Å²	38	58.8 Å²	58.8	20%	0.199	28%	0.283	C	S	.	.	H	α-helix	trans	-65.4	-41.1	174.7	-71.2	172.3	0	0	0	112.5	E303 W304 I305 T310 R311 F361 L362 A367	E303-L307 WeakPolarHBondContact O-CG 3.33Å; E303-L307 PolarHBondContact O-N 3.36Å; W304-L307 WeakPolarHBondContact O-CB 3.14Å; W304-L307 PolarHBondContact O-N 3.01Å; W304-L307 VanDerWaalsContact O-N 3.12Å; I305-L307 VanDerWaalsContact C-N 3.29Å; I305-L307 PolarHBondContact O-N 3.36Å; L307-T310 WeakPolarHBondContact CA-OG1 3.31Å; L307-T310 PolarHBondContact O-N 3.34Å; L307-T310 PolarHBondContact O-OG1 2.97Å; L307-T310 VanDerWaalsContact O-OG1 3.14Å; L307-R311 PolarHBondContact O-N 3.34Å; L307-F361 HydrophobicContact CB-CE1 4.15Å; L307-L362 HydrophobicContact CD1-CD2 3.66Å; L307-A367 HydrophobicContact CD1-CB 3.83Å
308	I	88.8	Confident	86.7	Confident	4 Å²	4	58.7 Å²	58.7	2%	0.021	28%	0.282	C	S	.	.	I	π-helix	trans	-62.5	-45.6	175.8	-64.8	162.5	0	0	0	110.2	W304 I305 T310 G312 V313 F318 L321 L322 L358 F361	W304-I308 VanDerWaalsContact O-CG1 3.26Å; W304-I308 WeakPolarHBondContact O-CG1 3.41Å; W304-I308 PolarHBondContact O-N 2.79Å; I305-I308 PolarHBondContact O-N 3.3Å; I308-T310 PolarHBondContact O-N 2.65Å; I308-G312 CarbonylContact O-C 3.32Å; I308-G312 VanDerWaalsContact O-C 3.25Å; I308-G312 WeakPolarHBondContact O-CA 3.39Å; I308-G312 PolarHBondContact O-N 3.27Å; I308-V313 PolarHBondContact O-N 3.29Å; I308-F318 HydrophobicContact CD1-CD1 4.4Å; I308-F318 HydrophobicContact CD1-CE1 4.45Å; I308-F318 HydrophobicContact CG1-CD2 4.25Å; I308-F318 HydrophobicContact CG1-CE2 4.24Å; I308-F318 HydrophobicContact CG1-CZ 4.5Å; I308-F318 HydrophobicContact CG2-CB 3.71Å; I308-F318 HydrophobicContact CG2-CD2 3.72Å; I308-F318 HydrophobicContact CG2-CE2 4.5Å; I308-F318 HydrophobicContact CG2-CG 3.74Å; I308-L321 HydrophobicContact CD1-CD2 3.94Å; I308-L322 HydrophobicContact CG2-CD1 4.28Å; I308-L322 HydrophobicContact CG2-CD2 3.98Å; I308-L322 HydrophobicContact CG2-CG 4.13Å; I308-L358 HydrophobicContact CD1-CD2 3.31Å; I308-L358 HydrophobicContact CG1-CD2 4.14Å; I308-F361 HydrophobicContact CB-CE1 4.44Å; I308-F361 HydrophobicContact CG1-CD1 4.1Å; I308-F361 HydrophobicContact CG1-CE1 3.73Å
309	K	84.3	Confident	87.2	Confident	46 Å²	46	62.2 Å²	62.2	20%	0.2	30%	0.299	C	S	.	.	I	π-helix	trans	-64.9	-22.8	177.4	-75.2	-166.2	175.8	-162.3	0	114	I305 V306 V313 L322 S325 V333	I305-K309 HydrophobicContact CG2-CD 4.4Å; I305-K309 HydrophobicContact CG2-CG 4.4Å; I305-K309 WeakPolarHBondContact O-CB 3.49Å; I305-K309 WeakPolarHBondContact O-CG 3.12Å; I305-K309 PolarHBondContact O-N 2.68Å; V306-K309 PolarHBondContact O-N 3.04Å; K309-V313 VanDerWaalsContact C-CG2 3.45Å; K309-V313 WeakPolarHBondContact O-CG2 3.17Å; K309-L322 HydrophobicContact CG-CD2 3.73Å; K309-S325 WeakPolarHBondContact CE-OG 3.43Å; K309-S325 PolarHBondContact NZ-OG 2.72Å; K309-V333 HydrophobicContact CD-CG2 3.97Å
310	T	86.3	Confident	87.7	Confident	95 Å²	95	63.2 Å²	63.2	58%	0.583	31%	0.308	S	S	*	.	I	π-helix	trans	-99.9	-34.3	-179.2	51.1	0	0	0	0	113.3	V306 L307 I308	V306-T310 WeakPolarHBondContact O-CB 3.12Å; V306-T310 WeakPolarHBondContact O-CG2 3.28Å; V306-T310 PolarHBondContact O-N 2.83Å; V306-T310 VanDerWaalsContact O-N 3.07Å; V306-T310 PolarHBondContact O-OG1 3.48Å; L307-T310 WeakPolarHBondContact CA-OG1 3.31Å; L307-T310 PolarHBondContact O-N 3.34Å; L307-T310 PolarHBondContact O-OG1 2.97Å; L307-T310 VanDerWaalsContact O-OG1 3.14Å; I308-T310 PolarHBondContact O-N 2.65Å
311	R	89.1	Confident	87.6	Confident	155 Å²	155	62.9 Å²	62.9	59%	0.585	31%	0.306	S	S	*	.	I	π-helix	trans	-127.2	-15.9	-171.1	-56.8	-179	-175.2	-174.9	1.5	114	L307 F361 V365	L307-R311 PolarHBondContact O-N 3.34Å; R311-F361 HydrophobicContact CB-CE2 4.28Å; R311-F361 HydrophobicContact CB-CZ 4.02Å; R311-V365 HydrophobicContact CB-CG1 4.11Å; R311-V365 PolarHBondContact NH1-O 3.28Å
312	G	87.3	Confident	87.5	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	31%	0.307	C	S	.	.	I	π-helix	trans	-105	-1.6	-176.4	0	0	0	0	0	115.1	I308 R314 R315	I308-G312 CarbonylContact O-C 3.32Å; I308-G312 VanDerWaalsContact O-C 3.25Å; I308-G312 WeakPolarHBondContact O-CA 3.39Å; I308-G312 PolarHBondContact O-N 3.27Å; G312-R314 PolarHBondContact O-N 3.25Å; G312-R315 VanDerWaalsContact O-CB 3.3Å; G312-R315 WeakPolarHBondContact O-CB 3.09Å; G312-R315 PolarHBondContact O-N 3.19Å
313	V	85	Confident	87.6	Confident	62 Å²	62	66.6 Å²	66.6	38%	0.376	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-31	-169.1	-177.8	0	0	0	0	114.6	I308 K309 Q319	I308-V313 PolarHBondContact O-N 3.29Å; K309-V313 VanDerWaalsContact C-CG2 3.45Å; K309-V313 WeakPolarHBondContact O-CG2 3.17Å; V313-Q319 PolarHBondContact O-NE2 2.81Å
314	R	88.3	Confident	87.4	Confident	241 Å²	241	61.8 Å²	61.8	91%	0.909	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	0	-178	-60.9	-175.8	-175.9	-174.9	0.8	113.9	G312	G312-R314 PolarHBondContact O-N 3.25Å
315	R	89	Confident	86.9	Confident	85 Å²	85	61.4 Å²	61.4	32%	0.321	30%	0.304	S	S	.	.			trans	-81.8	125.2	-177.5	-68.7	-162.2	177.3	-153.3	3.9	110.5	G312 E317 F318 Q319 S364	G312-R315 VanDerWaalsContact O-CB 3.3Å; G312-R315 WeakPolarHBondContact O-CB 3.09Å; G312-R315 PolarHBondContact O-N 3.19Å; R315-E317 WeakPolarHBondContact CB-OE2 3.38Å; R315-E317 PolarHBondContact O-N 2.69Å; R315-F318 HydrophobicContact CB-CD2 3.82Å; R315-F318 HydrophobicContact CB-CE2 4.36Å; R315-F318 HydrophobicContact CG-CD2 4.47Å; R315-F318 PolarHBondContact O-N 3.34Å; R315-Q319 PolarHBondContact O-NE2 3.2Å; R315-S364 PolarHBondContact NH2-OG 2.75Å
316	P	90.2	Very high	86.4	Confident	100 Å²	100	66.3 Å²	66.3	65%	0.649	33%	0.326	S	S	*	.	G	3₁₀ helix	trans	-56.7	-36.7	-179.1	-26.8	35.6	0	0	0	113.5	F318 Q319	P316-F318 PolarHBondContact O-N 3.44Å; P316-Q319 WeakPolarHBondContact O-CG 3.46Å; P316-Q319 PolarHBondContact O-N 2.98Å
317	E	91.8	Very high	85.8	Confident	95 Å²	95	66 Å²	66	44%	0.444	33%	0.328	S	S	.	.	G	3₁₀ helix	trans	-64.8	-28	-175.4	-51.7	81.8	-176.2	0	0	112.1	R315 E357	R315-E317 WeakPolarHBondContact CB-OE2 3.38Å; R315-E317 PolarHBondContact O-N 2.69Å; E317-E357 HydrophobicContact CB-CB 4.44Å; E317-E357 HydrophobicContact CB-CG 4.22Å; E317-E357 HydrophobicContact CG-CG 4.12Å
318	F	91.6	Very high	84.9	Confident	1 Å²	1	65.8 Å²	65.8	0%	0.004	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-95.6	-3	-179.6	-57.8	-39.6	0	0	0	113.9	I308 R315 P316 T320 L321 L322 L354 E357 L358 F361	I308-F318 HydrophobicContact CD1-CD1 4.4Å; I308-F318 HydrophobicContact CD1-CE1 4.45Å; I308-F318 HydrophobicContact CG1-CD2 4.25Å; I308-F318 HydrophobicContact CG1-CE2 4.24Å; I308-F318 HydrophobicContact CG1-CZ 4.5Å; I308-F318 HydrophobicContact CG2-CB 3.71Å; I308-F318 HydrophobicContact CG2-CD2 3.72Å; I308-F318 HydrophobicContact CG2-CE2 4.5Å; I308-F318 HydrophobicContact CG2-CG 3.74Å; R315-F318 HydrophobicContact CB-CD2 3.82Å; R315-F318 HydrophobicContact CB-CE2 4.36Å; R315-F318 HydrophobicContact CG-CD2 4.47Å; R315-F318 PolarHBondContact O-N 3.34Å; P316-F318 PolarHBondContact O-N 3.44Å; F318-T320 VanDerWaalsContact C-N 3.33Å; F318-T320 PolarHBondContact O-N 3.49Å; F318-L321 PolarHBondContact O-N 3.22Å; F318-L322 HydrophobicContact CB-CD1 4.08Å; F318-L322 HydrophobicContact CB-CG 4.41Å; F318-L322 WeakPolarHBondContact O-CB 3.32Å; F318-L322 VanDerWaalsContact O-CG 3.28Å; F318-L322 WeakPolarHBondContact O-CG 3.42Å; F318-L322 PolarHBondContact O-N 3.32Å; F318-L354 HydrophobicContact CD1-CD1 4.27Å; F318-E357 HydrophobicContact CE1-CB 4.32Å; F318-L358 HydrophobicContact CD1-CD2 4.43Å; F318-L358 HydrophobicContact CE1-CD2 3.59Å; F318-L358 HydrophobicContact CE1-CG 4.02Å; F318-L358 HydrophobicContact CZ-CD2 3.88Å; F318-L358 HydrophobicContact CZ-CG 4.46Å; F318-F361 HydrophobicContact CE2-CB 3.78Å; F318-F361 AromaticContact CE2-CD1 3.89Å; F318-F361 HydrophobicContact CE2-CD1 3.89Å; F318-F361 AromaticContact CE2-CD2 3.99Å; F318-F361 HydrophobicContact CE2-CD2 3.99Å; F318-F361 HydrophobicContact CE2-CE1 4.48Å; F318-F361 AromaticContact CE2-CG 3.6Å; F318-F361 HydrophobicContact CE2-CG 3.6Å; F318-F361 HydrophobicContact CZ-CB 3.69Å; F318-F361 HydrophobicContact CZ-CD1 4.14Å; F318-F361 AromaticContact CZ-CG 3.95Å; F318-F361 HydrophobicContact CZ-CG 3.95Å
319	Q	89.5	Confident	83.7	Confident	77 Å²	77	66 Å²	66	36%	0.36	33%	0.327	S	S	.	.	H	α-helix	trans	-61.5	-40.3	-175.2	-66	-55	-56.5	0	0	112.6	V313 R315 P316 L322 T323	V313-Q319 PolarHBondContact O-NE2 2.81Å; R315-Q319 PolarHBondContact O-NE2 3.2Å; P316-Q319 WeakPolarHBondContact O-CG 3.46Å; P316-Q319 PolarHBondContact O-N 2.98Å; Q319-L322 PolarHBondContact O-N 3.09Å; Q319-T323 VanDerWaalsContact O-CB 3.27Å; Q319-T323 WeakPolarHBondContact O-CB 3.12Å; Q319-T323 PolarHBondContact O-N 2.97Å; Q319-T323 PolarHBondContact O-OG1 2.82Å
320	T	89.1	Confident	82.7	Confident	93 Å²	93	64.8 Å²	64.8	57%	0.571	33%	0.327	S	S	*	.	H	α-helix	trans	-62.2	-45.9	177.1	-52.2	0	0	0	0	111.3	F318 T323 E324 L350	F318-T320 VanDerWaalsContact C-N 3.33Å; F318-T320 PolarHBondContact O-N 3.49Å; T320-T323 PolarHBondContact O-N 2.87Å; T320-E324 WeakPolarHBondContact O-CB 3.16Å; T320-E324 PolarHBondContact O-N 2.82Å; T320-L350 HydrophobicContact CG2-CD1 4.36Å; T320-L350 HydrophobicContact CG2-CD2 4.02Å
321	L	87.1	Confident	81.4	Confident	4 Å²	4	69.2 Å²	69.2	2%	0.021	34%	0.341	C	S	.	.	H	α-helix	trans	-65.9	-41.2	178.9	179.2	65.3	0	0	0	111.8	I308 F318 S325 W341 L350 I351 L354	I308-L321 HydrophobicContact CD1-CD2 3.94Å; F318-L321 PolarHBondContact O-N 3.22Å; L321-S325 VanDerWaalsContact O-CB 3.32Å; L321-S325 WeakPolarHBondContact O-CB 3.34Å; L321-S325 PolarHBondContact O-N 2.95Å; L321-W341 HydrophobicContact CD1-CH2 3.87Å; L321-W341 HydrophobicContact CD1-CZ2 4.46Å; L321-L350 HydrophobicContact CB-CD2 4.03Å; L321-L350 HydrophobicContact CD1-CD2 4.04Å; L321-L350 HydrophobicContact CD1-CG 4.47Å; L321-I351 HydrophobicContact CD1-CD1 4.13Å; L321-I351 HydrophobicContact CD1-CG1 3.6Å; L321-I351 HydrophobicContact CD2-CG1 4.06Å; L321-L354 HydrophobicContact CB-CD1 4.31Å; L321-L354 HydrophobicContact CD2-CD1 4.46Å
322	L	85.8	Confident	79.9	Confident	6 Å²	6	69.4 Å²	69.4	3%	0.031	34%	0.342	C	S	.	.	H	α-helix	trans	-65.9	-44.5	176.9	-73.5	166.9	0	0	0	111.3	I308 K309 F318 Q319 E324 S325 E326	I308-L322 HydrophobicContact CG2-CD1 4.28Å; I308-L322 HydrophobicContact CG2-CD2 3.98Å; I308-L322 HydrophobicContact CG2-CG 4.13Å; K309-L322 HydrophobicContact CG-CD2 3.73Å; F318-L322 HydrophobicContact CB-CD1 4.08Å; F318-L322 HydrophobicContact CB-CG 4.41Å; F318-L322 WeakPolarHBondContact O-CB 3.32Å; F318-L322 VanDerWaalsContact O-CG 3.28Å; F318-L322 WeakPolarHBondContact O-CG 3.42Å; F318-L322 PolarHBondContact O-N 3.32Å; Q319-L322 PolarHBondContact O-N 3.09Å; L322-E324 PolarHBondContact O-N 3.02Å; L322-S325 PolarHBondContact O-N 3.2Å; L322-E326 WeakPolarHBondContact O-CB 3.41Å; L322-E326 VanDerWaalsContact O-CG 3.31Å; L322-E326 WeakPolarHBondContact O-CG 3.12Å; L322-E326 PolarHBondContact O-N 2.87Å
323	T	84.4	Confident	78.5	Confident	84 Å²	84	72 Å²	72	52%	0.515	36%	0.358	S	S	.	.	H	α-helix	trans	-61.1	-44.6	176.8	-56.5	0	0	0	0	111	Q319 T320 E326 S327	Q319-T323 VanDerWaalsContact O-CB 3.27Å; Q319-T323 WeakPolarHBondContact O-CB 3.12Å; Q319-T323 PolarHBondContact O-N 2.97Å; Q319-T323 PolarHBondContact O-OG1 2.82Å; T320-T323 PolarHBondContact O-N 2.87Å; T323-E326 PolarHBondContact O-N 2.85Å; T323-S327 WeakPolarHBondContact O-CB 3.43Å; T323-S327 PolarHBondContact O-N 2.77Å; T323-S327 PolarHBondContact O-OG 3.47Å
324	E	81.6	Confident	77.3	Confident	24 Å²	24	71.9 Å²	71.9	11%	0.112	36%	0.355	C	S	.	.	H	α-helix	trans	-63.2	-44.5	176.1	-171.8	164.7	-141.4	0	0	111	T320 L322 S327 E328 W341 K346 L350	T320-E324 WeakPolarHBondContact O-CB 3.16Å; T320-E324 PolarHBondContact O-N 2.82Å; L322-E324 PolarHBondContact O-N 3.02Å; E324-S327 PolarHBondContact O-N 3.23Å; E324-S327 PolarHBondContact O-OG 3.42Å; E324-E328 WeakPolarHBondContact O-CB 3.37Å; E324-E328 WeakPolarHBondContact O-CG 3.26Å; E324-E328 PolarHBondContact O-N 3.26Å; E324-E328 VanDerWaalsContact O-N 3.08Å; E324-W341 HydrophobicContact CB-CZ2 4.3Å; E324-W341 HydrophobicContact CG-CZ2 4.03Å; E324-K346 WeakPolarHBondContact OE1-CE 3.46Å; E324-K346 IonicContact OE1-NZ 2.64Å; E324-K346 PolarHBondContact OE1-NZ 2.89Å; E324-L350 VanDerWaalsContact OE2-CD2 3.29Å; E324-L350 WeakPolarHBondContact OE2-CD2 3.42Å
325	S	78.1	Confident	75.9	Confident	1 Å²	1	62.2 Å²	62.2	1%	0.007	33%	0.33	C	S	.	.	H	α-helix	trans	-65.4	-40.2	177.7	-160.9	0	0	0	0	113.5	K309 L321 L322 S327 E328 H329 W341	K309-S325 WeakPolarHBondContact CE-OG 3.43Å; K309-S325 PolarHBondContact NZ-OG 2.72Å; L321-S325 VanDerWaalsContact O-CB 3.32Å; L321-S325 WeakPolarHBondContact O-CB 3.34Å; L321-S325 PolarHBondContact O-N 2.95Å; L322-S325 PolarHBondContact O-N 3.2Å; S325-S327 VanDerWaalsContact C-N 3.35Å; S325-E328 PolarHBondContact O-N 2.71Å; S325-H329 WeakPolarHBondContact O-CB 3.36Å; S325-H329 PolarHBondContact O-N 2.93Å; S325-W341 WeakPolarHBondContact OG-CH2 3.49Å
326	E	75	Confident	74.6	Confident	107 Å²	107	66.2 Å²	66.2	50%	0.5	35%	0.345	S	S	.	.	H	α-helix	trans	-68.1	-36.1	176.2	-76.5	174.5	-172.6	0	0	111.2	L322 T323 E328 G330	L322-E326 WeakPolarHBondContact O-CB 3.41Å; L322-E326 VanDerWaalsContact O-CG 3.31Å; L322-E326 WeakPolarHBondContact O-CG 3.12Å; L322-E326 PolarHBondContact O-N 2.87Å; T323-E326 PolarHBondContact O-N 2.85Å; E326-E328 VanDerWaalsContact C-N 3.28Å; E326-E328 PolarHBondContact O-N 3.41Å; E326-G330 WeakPolarHBondContact O-CA 3.4Å; E326-G330 PolarHBondContact O-N 2.82Å
327	S	72.4	Confident	73.4	Confident	68 Å²	68	61.7 Å²	61.7	48%	0.476	32%	0.316	S	S	.	.	H	α-helix	trans	-66.4	-30.7	174	75.3	0	0	0	0	113	T323 E324 S325 T565	T323-S327 WeakPolarHBondContact O-CB 3.43Å; T323-S327 PolarHBondContact O-N 2.77Å; T323-S327 PolarHBondContact O-OG 3.47Å; E324-S327 PolarHBondContact O-N 3.23Å; E324-S327 PolarHBondContact O-OG 3.42Å; S325-S327 VanDerWaalsContact C-N 3.35Å; S327-T565 WeakPolarHBondContact O-CG2 3.3Å
328	E	67.6	Low	72.1	Confident	33 Å²	33	57.2 Å²	57.2	15%	0.154	30%	0.295	C	S	.	.	H	α-helix	trans	-93.7	-27	-175.7	-73.2	-83.5	-166.3	0	0	114.3	E324 S325 E326 R344 T565 Q568	E324-E328 WeakPolarHBondContact O-CB 3.37Å; E324-E328 WeakPolarHBondContact O-CG 3.26Å; E324-E328 PolarHBondContact O-N 3.26Å; E324-E328 VanDerWaalsContact O-N 3.08Å; S325-E328 PolarHBondContact O-N 2.71Å; E326-E328 VanDerWaalsContact C-N 3.28Å; E326-E328 PolarHBondContact O-N 3.41Å; E328-R344 VanDerWaalsContact CD-NH1 3.35Å; E328-R344 IonicContact OE1-CZ 3.02Å; E328-R344 IonicContact OE1-NH1 3.39Å; E328-R344 PolarHBondContact OE1-NH1 3.32Å; E328-R344 IonicContact OE2-NH1 2.75Å; E328-R344 PolarHBondContact OE2-NH1 3.02Å; E328-T565 HydrophobicContact CG-CG2 4.33Å; E328-T565 WeakPolarHBondContact OE2-CG2 3.43Å; E328-Q568 VanDerWaalsContact C-OE1 3.31Å; E328-Q568 PolarHBondContact O-OE1 2.94Å
329	H	63.7	Low	70.9	Confident	9 Å²	9	59 Å²	59	4%	0.042	31%	0.305	C	S	.	.	H	α-helix	trans	-131.4	-2.2	-171.4	-57.1	-38.9	0	0	0	113.9	V185 S325 R332 V333 W341 Q568	V185-H329 HydrophobicContact CG2-CB 4.25Å; S325-H329 WeakPolarHBondContact O-CB 3.36Å; S325-H329 PolarHBondContact O-N 2.93Å; H329-R332 PolarHBondContact O-N 2.91Å; H329-V333 HydrophobicContact CB-CG2 4.49Å; H329-W341 VanDerWaalsContact CE1-CB 3.47Å; H329-W341 WeakPolarHBondContact CE1-CB 3.26Å; H329-W341 AromaticContact CE1-CG 3.88Å; H329-W341 WeakPolarHBondContact NE2-CB 3.14Å; H329-W341 AromaticContact NE2-CD2 3.44Å; H329-W341 AromaticContact NE2-CE3 3.66Å; H329-W341 AromaticContact NE2-CG 3.24Å; H329-Q568 PolarHBondContact O-NE2 3.47Å; H329-Q568 PolarHBondContact O-OE1 3.17Å
330	G	64.1	Low	69.7	Low	20 Å²	20	57 Å²	57	21%	0.206	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	52.4	-147.8	-171.2	0	0	0	0	0	111.7	E326 R332	E326-G330 WeakPolarHBondContact O-CA 3.4Å; E326-G330 PolarHBondContact O-N 2.82Å; G330-R332 VanDerWaalsContact C-N 3.32Å; G330-R332 PolarHBondContact O-N 3.48Å
331	E	58.8	Low	68.7	Low	188 Å²	188	52.8 Å²	52.8	88%	0.879	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-16.7	177.5	-63.6	-175.6	172.1	0	0	113.6
332	R	57.7	Low	67.7	Low	160 Å²	160	52.6 Å²	52.6	60%	0.604	27%	0.269	S	S	*	.			trans	-103.3	122.7	-173.1	-63.5	178.6	93	172.6	5.1	110.8	V185 H329 G330	V185-R332 HydrophobicContact CG1-CB 3.97Å; V185-R332 WeakPolarHBondContact CG1-O 3.5Å; H329-R332 PolarHBondContact O-N 2.91Å; G330-R332 VanDerWaalsContact C-N 3.32Å; G330-R332 PolarHBondContact O-N 3.48Å
333	V	58.1	Low	66.8	Low	54 Å²	54	53.4 Å²	53.4	33%	0.327	27%	0.272	S	S	.	.			trans	-115.1	118.7	175.3	-175.8	0	0	0	0	109.5	K309 H329 L338	K309-V333 HydrophobicContact CD-CG2 3.97Å; H329-V333 HydrophobicContact CB-CG2 4.49Å; V333-L338 HydrophobicContact CG1-CB 4.01Å; V333-L338 HydrophobicContact CG1-CD1 3.88Å; V333-L338 HydrophobicContact CG1-CD2 3.98Å; V333-L338 HydrophobicContact CG1-CG 4.22Å
334	N	59.9	Low	66.1	Low	60 Å²	60	52.7 Å²	52.7	32%	0.321	26%	0.259	S	S	.	.			trans	-99.4	138.4	160.4	-174.8	-27.9	0	0	0	108.6	E188 R336 C337 L338	E188-N334 WeakPolarHBondContact OE1-CB 2.87Å; E188-N334 VanDerWaalsContact OE1-CG 3.29Å; E188-N334 PolarHBondContact OE1-ND2 3.08Å; E188-N334 PolarHBondContact OE2-ND2 3.44Å; N334-R336 PolarHBondContact O-N 2.93Å; N334-R336 PolarHBondContact OD1-N 3.35Å; N334-C337 WeakPolarHBondContact O-CB 3.41Å; N334-C337 PolarHBondContact O-N 3.15Å; N334-L338 PolarHBondContact O-N 2.93Å
335	G	58.7	Low	65.5	Low	38 Å²	38	51.6 Å²	51.6	39%	0.392	26%	0.255	S	S	.	.	H	α-helix	trans	-51.1	-33.9	174.6	0	0	0	0	0	114.5	L338 N339	G335-L338 PolarHBondContact O-N 3.47Å; G335-N339 WeakPolarHBondContact O-CB 3.44Å; G335-N339 PolarHBondContact O-N 2.86Å; G335-N339 PolarHBondContact O-ND2 2.75Å; G335-N339 PolarHBondContact O-OD1 2.89Å
336	R	61.8	Low	65.6	Low	169 Å²	169	57.4 Å²	57.4	64%	0.638	28%	0.28	S	S	*	.	H	α-helix	trans	-64.1	-42.9	173.6	-83.5	-170.8	179.8	-147.9	0.1	113.1	N334 N339 N340	N334-R336 PolarHBondContact O-N 2.93Å; N334-R336 PolarHBondContact OD1-N 3.35Å; R336-N339 PolarHBondContact O-N 2.9Å; R336-N340 PolarHBondContact O-N 3.02Å
337	C	63.7	Low	65.9	Low	4 Å²	4	52.4 Å²	52.4	3%	0.027	26%	0.257	C	S	.	.	H	α-helix	trans	-70.5	-38.6	179.5	-60.5	0	0	0	0	111	V185 N334 N339 N340 W341	V185-C337 HydrophobicContact CG2-CB 3.44Å; V185-C337 VanDerWaalsContact CG2-CB 3.44Å; V185-C337 WeakPolarHBondContact CG2-SG 3.4Å; V185-C337 PolarHBondContact N-SG 3.44Å; N334-C337 WeakPolarHBondContact O-CB 3.41Å; N334-C337 PolarHBondContact O-N 3.15Å; C337-N339 VanDerWaalsContact C-N 3.31Å; C337-N339 PolarHBondContact O-N 3.23Å; C337-N340 PolarHBondContact O-N 3.5Å; C337-W341 WeakPolarHBondContact O-CB 3.48Å; C337-W341 PolarHBondContact O-N 2.87Å
338	L	65.8	Low	66.5	Low	2 Å²	2	49.2 Å²	49.2	1%	0.01	23%	0.234	C	C	.	.	H	α-helix	trans	-62.4	-40.2	175.7	-164.2	67.9	0	0	0	111.4	S302 I305 V333 N334 G335 W341 L342	S302-L338 VanDerWaalsContact CB-CD2 3.41Å; S302-L338 WeakPolarHBondContact OG-CD2 3.46Å; I305-L338 HydrophobicContact CD1-CD1 4.23Å; I305-L338 HydrophobicContact CG2-CD1 4.11Å; V333-L338 HydrophobicContact CG1-CB 4.01Å; V333-L338 HydrophobicContact CG1-CD1 3.88Å; V333-L338 HydrophobicContact CG1-CD2 3.98Å; V333-L338 HydrophobicContact CG1-CG 4.22Å; N334-L338 PolarHBondContact O-N 2.93Å; G335-L338 PolarHBondContact O-N 3.47Å; L338-W341 HydrophobicContact CD1-CE3 3.65Å; L338-W341 HydrophobicContact CD1-CZ3 3.89Å; L338-W341 PolarHBondContact O-N 3.39Å; L338-L342 HydrophobicContact CG-CD1 4.26Å; L338-L342 WeakPolarHBondContact O-CB 3.45Å; L338-L342 VanDerWaalsContact O-CG 3.25Å; L338-L342 WeakPolarHBondContact O-CG 3.2Å; L338-L342 PolarHBondContact O-N 3.02Å
339	N	65.3	Low	67.5	Low	39 Å²	39	52.4 Å²	52.4	21%	0.209	25%	0.248	C	C	.	.	H	α-helix	trans	-62.9	-43.1	175.2	-72.3	-5.8	0	0	0	112.3	V298 S302 G335 R336 C337 R343	V298-N339 HydrophobicContact CG1-CB 4.17Å; V298-N339 WeakPolarHBondContact CG1-OD1 3.39Å; S302-N339 PolarHBondContact OG-OD1 3.38Å; G335-N339 WeakPolarHBondContact O-CB 3.44Å; G335-N339 PolarHBondContact O-N 2.86Å; G335-N339 PolarHBondContact O-ND2 2.75Å; G335-N339 PolarHBondContact O-OD1 2.89Å; R336-N339 PolarHBondContact O-N 2.9Å; C337-N339 VanDerWaalsContact C-N 3.31Å; C337-N339 PolarHBondContact O-N 3.23Å; N339-R343 WeakPolarHBondContact O-CD 3.22Å; N339-R343 WeakPolarHBondContact O-CG 3.4Å; N339-R343 PolarHBondContact O-N 2.74Å
340	N	65.3	Low	68.8	Low	35 Å²	35	53.6 Å²	53.6	19%	0.187	25%	0.254	C	S	.	.	H	α-helix	trans	-65.5	-39.5	176.6	-68.8	-10.6	0	0	0	111.6	A183 R336 C337 R343	A183-N340 PolarHBondContact O-ND2 2.84Å; R336-N340 PolarHBondContact O-N 3.02Å; C337-N340 PolarHBondContact O-N 3.5Å; N340-R343 PolarHBondContact O-N 3.37Å
341	W	68.9	Low	70.1	Confident	3 Å²	3	52.8 Å²	52.8	1%	0.011	25%	0.245	C	C	.	.	H	α-helix	trans	-68.6	-40	177.4	177.7	63.1	0	0	0	113.5	I305 L321 E324 S325 H329 C337 L338 R343 R344 T347	I305-W341 HydrophobicContact CD1-CE3 4.47Å; I305-W341 HydrophobicContact CD1-CZ3 3.76Å; I305-W341 HydrophobicContact CG2-CZ3 4.46Å; L321-W341 HydrophobicContact CD1-CH2 3.87Å; L321-W341 HydrophobicContact CD1-CZ2 4.46Å; E324-W341 HydrophobicContact CB-CZ2 4.3Å; E324-W341 HydrophobicContact CG-CZ2 4.03Å; S325-W341 WeakPolarHBondContact OG-CH2 3.49Å; H329-W341 VanDerWaalsContact CE1-CB 3.47Å; H329-W341 WeakPolarHBondContact CE1-CB 3.26Å; H329-W341 AromaticContact CE1-CG 3.88Å; H329-W341 WeakPolarHBondContact NE2-CB 3.14Å; H329-W341 AromaticContact NE2-CD2 3.44Å; H329-W341 AromaticContact NE2-CE3 3.66Å; H329-W341 AromaticContact NE2-CG 3.24Å; C337-W341 WeakPolarHBondContact O-CB 3.48Å; C337-W341 PolarHBondContact O-N 2.87Å; L338-W341 HydrophobicContact CD1-CE3 3.65Å; L338-W341 HydrophobicContact CD1-CZ3 3.89Å; L338-W341 PolarHBondContact O-N 3.39Å; W341-R343 PolarHBondContact O-N 2.95Å; W341-R344 VanDerWaalsContact O-CB 3.23Å; W341-R344 WeakPolarHBondContact O-CB 3.42Å; W341-R344 WeakPolarHBondContact O-CG 3.42Å; W341-R344 PolarHBondContact O-N 3.3Å; W341-T347 HydrophobicContact CD2-CG2 3.73Å; W341-T347 VanDerWaalsContact CE2-CG2 3.42Å; W341-T347 HydrophobicContact CE3-CG2 3.95Å; W341-T347 HydrophobicContact CG-CG2 4.46Å; W341-T347 HydrophobicContact CH2-CG2 3.65Å; W341-T347 HydrophobicContact CZ2-CG2 3.38Å; W341-T347 HydrophobicContact CZ3-CG2 3.94Å; W341-T347 PolarHBondContact NE1-OG1 3.34Å; W341-T347 VanDerWaalsContact NE1-OG1 3.13Å
342	L	64.6	Low	71.8	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-66.6	-21.6	175.6	-76.7	176.6	0	0	0	113.3	V298 I301 S302 I305 L338 R344 T347 I351	V298-L342 HydrophobicContact CG1-CB 4Å; V298-L342 HydrophobicContact CG1-CD1 3.81Å; V298-L342 WeakPolarHBondContact O-CD1 3.3Å; I301-L342 HydrophobicContact CB-CD1 4.31Å; I301-L342 HydrophobicContact CG2-CD1 3.95Å; I301-L342 HydrophobicContact CG2-CD2 3.59Å; I301-L342 HydrophobicContact CG2-CG 4.44Å; S302-L342 WeakPolarHBondContact OG-CD1 3.49Å; I305-L342 HydrophobicContact CD1-CD1 4.18Å; I305-L342 HydrophobicContact CD1-CD2 3.62Å; I305-L342 HydrophobicContact CD1-CG 4.21Å; L338-L342 HydrophobicContact CG-CD1 4.26Å; L338-L342 WeakPolarHBondContact O-CB 3.45Å; L338-L342 VanDerWaalsContact O-CG 3.25Å; L338-L342 WeakPolarHBondContact O-CG 3.2Å; L338-L342 PolarHBondContact O-N 3.02Å; L342-R344 PolarHBondContact O-N 3.42Å; L342-T347 HydrophobicContact CD2-CG2 4.22Å; L342-I351 HydrophobicContact CD2-CD1 3.39Å
343	R	67.3	Low	73.5	Confident	24 Å²	24	40.1 Å²	40.1	9%	0.091	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	4.3	172.2	-70.7	169.6	-179.5	-81.4	-5.7	112.3	E285 N295 N339 N340 W341 M388	E285-R343 HydrophobicContact CB-CB 3.81Å; E285-R343 WeakPolarHBondContact CB-O 3.37Å; E285-R343 HydrophobicContact CG-CB 3.72Å; E285-R343 PolarHBondContact O-NH1 3.01Å; N295-R343 PolarHBondContact OD1-NH2 3.42Å; N295-R343 VanDerWaalsContact OD1-NH2 3.12Å; N339-R343 WeakPolarHBondContact O-CD 3.22Å; N339-R343 WeakPolarHBondContact O-CG 3.4Å; N339-R343 PolarHBondContact O-N 2.74Å; N340-R343 PolarHBondContact O-N 3.37Å; W341-R343 PolarHBondContact O-N 2.95Å; R343-M388 HydrophobicContact CB-CE 3.85Å; R343-M388 HydrophobicContact CG-CE 4.36Å; R343-M388 WeakPolarHBondContact O-CE 3.47Å
344	R	69.3	Low	75.2	Confident	68 Å²	68	38.5 Å²	38.5	26%	0.257	19%	0.19	S	C	.	.	S	Bend	trans	-85.1	123.1	166.6	-60.7	-178.6	174.2	-148.4	-23.9	109.8	E328 W341 L342 K346 T347 L348 F561	E328-R344 VanDerWaalsContact CD-NH1 3.35Å; E328-R344 IonicContact OE1-CZ 3.02Å; E328-R344 IonicContact OE1-NH1 3.39Å; E328-R344 PolarHBondContact OE1-NH1 3.32Å; E328-R344 IonicContact OE2-NH1 2.75Å; E328-R344 PolarHBondContact OE2-NH1 3.02Å; W341-R344 VanDerWaalsContact O-CB 3.23Å; W341-R344 WeakPolarHBondContact O-CB 3.42Å; W341-R344 WeakPolarHBondContact O-CG 3.42Å; W341-R344 PolarHBondContact O-N 3.3Å; L342-R344 PolarHBondContact O-N 3.42Å; R344-K346 PolarHBondContact O-N 3.16Å; R344-K346 VanDerWaalsContact O-N 3.14Å; R344-T347 PolarHBondContact O-N 2.89Å; R344-T347 VanDerWaalsContact O-N 3.15Å; R344-L348 PolarHBondContact O-N 3.15Å; R344-F561 VanDerWaalsContact CZ-CE1 3.48Å; R344-F561 VanDerWaalsContact CZ-CZ 3.44Å; R344-F561 VanDerWaalsContact NH1-CE1 3.27Å
345	G	68.7	Low	76.9	Confident	1 Å²	1	36.2 Å²	36.2	1%	0.01	18%	0.177	C	C	.	.	H	α-helix	trans	-51	-41.1	-178.6	0	0	0	0	0	113.4	L348 K349	G345-L348 PolarHBondContact O-N 2.79Å; G345-K349 WeakPolarHBondContact O-CB 3.48Å; G345-K349 PolarHBondContact O-N 2.47Å
346	K	80.7	Confident	78.5	Confident	123 Å²	123	40.8 Å²	40.8	54%	0.535	19%	0.186	S	C	.	.	H	α-helix	trans	-61.2	-48.3	179.6	-172.4	-175.1	171	-131.7	0	113.4	E324 R344 K349 L350	E324-K346 WeakPolarHBondContact OE1-CE 3.46Å; E324-K346 IonicContact OE1-NZ 2.64Å; E324-K346 PolarHBondContact OE1-NZ 2.89Å; R344-K346 PolarHBondContact O-N 3.16Å; R344-K346 VanDerWaalsContact O-N 3.14Å; K346-K349 PolarHBondContact O-N 3.5Å; K346-L350 PolarHBondContact O-N 2.75Å
347	T	80.8	Confident	80.1	Confident	2 Å²	2	36.4 Å²	36.4	1%	0.012	17%	0.173	C	C	.	.	H	α-helix	trans	-64.3	-47.3	179.9	-56.9	0	0	0	0	110.8	W341 L342 R344 K349 L350 I351	W341-T347 HydrophobicContact CD2-CG2 3.73Å; W341-T347 VanDerWaalsContact CE2-CG2 3.42Å; W341-T347 HydrophobicContact CE3-CG2 3.95Å; W341-T347 HydrophobicContact CG-CG2 4.46Å; W341-T347 HydrophobicContact CH2-CG2 3.65Å; W341-T347 HydrophobicContact CZ2-CG2 3.38Å; W341-T347 HydrophobicContact CZ3-CG2 3.94Å; W341-T347 PolarHBondContact NE1-OG1 3.34Å; W341-T347 VanDerWaalsContact NE1-OG1 3.13Å; L342-T347 HydrophobicContact CD2-CG2 4.22Å; R344-T347 PolarHBondContact O-N 2.89Å; R344-T347 VanDerWaalsContact O-N 3.15Å; T347-K349 VanDerWaalsContact C-N 3.29Å; T347-K349 PolarHBondContact O-N 3.4Å; T347-L350 WeakPolarHBondContact O-CB 3.47Å; T347-L350 PolarHBondContact O-N 3.03Å; T347-L350 VanDerWaalsContact O-N 3.17Å; T347-I351 HydrophobicContact CG2-CD1 4.06Å; T347-I351 WeakPolarHBondContact O-CG1 3.11Å; T347-I351 PolarHBondContact O-N 2.78Å
348	L	84.9	Confident	81.5	Confident	1 Å²	1	36.2 Å²	36.2	1%	0.005	17%	0.172	C	C	.	.	H	α-helix	trans	-63.4	-39.4	-177.9	-162.6	65.4	0	0	0	111.4	I301 R344 G345 I351 F352 F381 L384 V385 M388	I301-L348 HydrophobicContact CD1-CD1 3.65Å; R344-L348 PolarHBondContact O-N 3.15Å; G345-L348 PolarHBondContact O-N 2.79Å; L348-I351 PolarHBondContact O-N 3.02Å; L348-F352 WeakPolarHBondContact O-CB 3.36Å; L348-F352 PolarHBondContact O-N 2.76Å; L348-F381 HydrophobicContact CD1-CE2 3.77Å; L348-F381 HydrophobicContact CG-CE2 4Å; L348-L384 HydrophobicContact CD2-CB 4.44Å; L348-L384 HydrophobicContact CD2-CD2 3.93Å; L348-L384 HydrophobicContact CD2-CG 3.72Å; L348-V385 HydrophobicContact CD2-CG2 4.06Å; L348-V385 HydrophobicContact CG-CG2 3.81Å; L348-M388 HydrophobicContact CD2-CB 4.35Å; L348-M388 HydrophobicContact CD2-CG 3.88Å
349	K	90.1	Very high	82.9	Confident	101 Å²	101	39.4 Å²	39.4	44%	0.439	19%	0.187	S	C	.	.	H	α-helix	trans	-64.4	-38.6	174.1	-170.6	175.9	-171.8	174.9	0	112.8	G345 K346 T347 F352 S353 V385 E389	G345-K349 WeakPolarHBondContact O-CB 3.48Å; G345-K349 PolarHBondContact O-N 2.47Å; K346-K349 PolarHBondContact O-N 3.5Å; T347-K349 VanDerWaalsContact C-N 3.29Å; T347-K349 PolarHBondContact O-N 3.4Å; K349-F352 WeakPolarHBondContact O-CB 3.26Å; K349-F352 PolarHBondContact O-N 2.75Å; K349-S353 PolarHBondContact O-N 2.94Å; K349-V385 HydrophobicContact CB-CG1 3.97Å; K349-V385 HydrophobicContact CG-CG1 4.17Å; K349-E389 IonicContact NZ-OE1 3.65Å; K349-E389 PolarHBondContact NZ-OE1 3.1Å
350	L	90.4	Very high	84.3	Confident	34 Å²	34	40.3 Å²	40.3	18%	0.178	20%	0.199	C	C	.	.	H	α-helix	trans	-63	-48	173.9	178	62.1	0	0	0	111.2	T320 L321 E324 K346 T347 F352 S353 L354	T320-L350 HydrophobicContact CG2-CD1 4.36Å; T320-L350 HydrophobicContact CG2-CD2 4.02Å; L321-L350 HydrophobicContact CB-CD2 4.03Å; L321-L350 HydrophobicContact CD1-CD2 4.04Å; L321-L350 HydrophobicContact CD1-CG 4.47Å; E324-L350 VanDerWaalsContact OE2-CD2 3.29Å; E324-L350 WeakPolarHBondContact OE2-CD2 3.42Å; K346-L350 PolarHBondContact O-N 2.75Å; T347-L350 WeakPolarHBondContact O-CB 3.47Å; T347-L350 PolarHBondContact O-N 3.03Å; T347-L350 VanDerWaalsContact O-N 3.17Å; L350-F352 VanDerWaalsContact C-N 3.28Å; L350-F352 PolarHBondContact O-N 3.3Å; L350-S353 PolarHBondContact O-N 3.33Å; L350-S353 VanDerWaalsContact O-N 3.14Å; L350-S353 PolarHBondContact O-OG 3.17Å; L350-L354 HydrophobicContact CD1-CD1 4.4Å; L350-L354 HydrophobicContact CG-CD1 4.4Å; L350-L354 WeakPolarHBondContact O-CG 2.92Å; L350-L354 PolarHBondContact O-N 3.23Å
351	I	91.1	Very high	85.8	Confident	3 Å²	3	38.7 Å²	38.7	2%	0.015	19%	0.191	C	C	.	.	H	α-helix	trans	-60.8	-42.2	177	-64.4	169.2	0	0	0	110.5	I301 I305 L321 L342 T347 L348 S353 L354 L358 F381	I301-I351 HydrophobicContact CG2-CD1 3.56Å; I301-I351 HydrophobicContact CG2-CG2 3.95Å; I305-I351 HydrophobicContact CD1-CD1 3.77Å; I305-I351 HydrophobicContact CG1-CD1 4.36Å; L321-I351 HydrophobicContact CD1-CD1 4.13Å; L321-I351 HydrophobicContact CD1-CG1 3.6Å; L321-I351 HydrophobicContact CD2-CG1 4.06Å; L342-I351 HydrophobicContact CD2-CD1 3.39Å; T347-I351 HydrophobicContact CG2-CD1 4.06Å; T347-I351 WeakPolarHBondContact O-CG1 3.11Å; T347-I351 PolarHBondContact O-N 2.78Å; L348-I351 PolarHBondContact O-N 3.02Å; I351-S353 VanDerWaalsContact C-N 3.33Å; I351-S353 PolarHBondContact O-N 3.19Å; I351-L354 PolarHBondContact O-N 3.43Å; I351-L354 VanDerWaalsContact O-N 3.11Å; I351-L358 HydrophobicContact CG2-CD1 3.82Å; I351-L358 WeakPolarHBondContact O-CD1 3.38Å; I351-F381 HydrophobicContact CG2-CZ 4.07Å
352	F	94.1	Very high	87	Confident	7 Å²	7	38.6 Å²	38.6	3%	0.031	19%	0.19	C	C	.	.	H	α-helix	trans	-58	-44.6	175	-177.3	-96.3	0	0	0	111.2	L348 K349 L350 L354 R355 F381 V385 A436 V440	L348-F352 WeakPolarHBondContact O-CB 3.36Å; L348-F352 PolarHBondContact O-N 2.76Å; K349-F352 WeakPolarHBondContact O-CB 3.26Å; K349-F352 PolarHBondContact O-N 2.75Å; L350-F352 VanDerWaalsContact C-N 3.28Å; L350-F352 PolarHBondContact O-N 3.3Å; F352-L354 PolarHBondContact O-N 3.21Å; F352-L354 VanDerWaalsContact O-N 3.14Å; F352-R355 VanDerWaalsContact CD2-NH1 3.28Å; F352-R355 VanDerWaalsContact CE2-CZ 3.43Å; F352-R355 WeakPolarHBondContact O-CB 3.22Å; F352-R355 WeakPolarHBondContact O-CG 3.47Å; F352-R355 PolarHBondContact O-N 2.73Å; F352-R355 PolarHBondContact O-NH1 3.13Å; F352-F381 HydrophobicContact CB-CE1 4.19Å; F352-F381 HydrophobicContact CB-CE2 4.34Å; F352-F381 HydrophobicContact CB-CZ 3.8Å; F352-F381 AromaticContact CD2-CD1 3.85Å; F352-F381 HydrophobicContact CD2-CD1 3.85Å; F352-F381 HydrophobicContact CD2-CD2 4.47Å; F352-F381 AromaticContact CD2-CE1 3.76Å; F352-F381 HydrophobicContact CD2-CE1 3.76Å; F352-F381 HydrophobicContact CD2-CE2 4.36Å; F352-F381 HydrophobicContact CD2-CG 4.22Å; F352-F381 HydrophobicContact CD2-CZ 4.02Å; F352-F381 HydrophobicContact CE2-CD1 4.46Å; F352-F381 HydrophobicContact CG-CE1 4.44Å; F352-F381 HydrophobicContact CG-CZ 4.43Å; F352-V385 HydrophobicContact CB-CG1 4.43Å; F352-V385 HydrophobicContact CB-CG2 3.67Å; F352-V385 HydrophobicContact CD2-CG2 3.81Å; F352-V385 HydrophobicContact CG-CG1 4.43Å; F352-V385 HydrophobicContact CG-CG2 3.83Å; F352-A436 HydrophobicContact CD1-CB 4Å; F352-A436 HydrophobicContact CE1-CB 3.44Å; F352-A436 VanDerWaalsContact CE1-CB 3.44Å; F352-A436 HydrophobicContact CE2-CB 4.13Å; F352-A436 HydrophobicContact CZ-CB 3.53Å; F352-A436 VanDerWaalsContact CZ-O 3.24Å; F352-A436 WeakPolarHBondContact CZ-O 3.41Å; F352-V440 HydrophobicContact CE2-CG2 3.77Å; F352-V440 HydrophobicContact CZ-CG2 3.76Å
353	S	94.4	Very high	88.4	Confident	74 Å²	74	43.1 Å²	43.1	52%	0.517	22%	0.218	S	C	.	.	H	α-helix	trans	-62.6	-22.1	178	73.9	0	0	0	0	114.4	K349 L350 I351	K349-S353 PolarHBondContact O-N 2.94Å; L350-S353 PolarHBondContact O-N 3.33Å; L350-S353 VanDerWaalsContact O-N 3.14Å; L350-S353 PolarHBondContact O-OG 3.17Å; I351-S353 VanDerWaalsContact C-N 3.33Å; I351-S353 PolarHBondContact O-N 3.19Å
354	L	94.2	Very high	89.7	Confident	20 Å²	20	45.2 Å²	45.2	11%	0.105	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96	11.3	-178.7	-63.7	170.1	0	0	0	113.3	F318 L321 L350 I351 F352 K356 E357 L358	F318-L354 HydrophobicContact CD1-CD1 4.27Å; L321-L354 HydrophobicContact CB-CD1 4.31Å; L321-L354 HydrophobicContact CD2-CD1 4.46Å; L350-L354 HydrophobicContact CD1-CD1 4.4Å; L350-L354 HydrophobicContact CG-CD1 4.4Å; L350-L354 WeakPolarHBondContact O-CG 2.92Å; L350-L354 PolarHBondContact O-N 3.23Å; I351-L354 PolarHBondContact O-N 3.43Å; I351-L354 VanDerWaalsContact O-N 3.11Å; F352-L354 PolarHBondContact O-N 3.21Å; F352-L354 VanDerWaalsContact O-N 3.14Å; L354-K356 VanDerWaalsContact C-N 3.29Å; L354-K356 PolarHBondContact O-N 3.45Å; L354-E357 WeakPolarHBondContact CA-OE2 3.23Å; L354-E357 PolarHBondContact O-N 3.42Å; L354-L358 HydrophobicContact CB-CD1 4.16Å; L354-L358 HydrophobicContact CB-CG 4.17Å; L354-L358 WeakPolarHBondContact O-CB 3.01Å; L354-L358 WeakPolarHBondContact O-CG 3.22Å; L354-L358 PolarHBondContact O-N 3.18Å
355	R	94.4	Very high	90.8	Very high	12 Å²	12	43.5 Å²	43.5	5%	0.045	23%	0.233	C	C	.	.	H	α-helix	trans	-50.5	-44.2	-173.5	-85.2	-178.7	-24.5	-86.6	14.9	113.6	F352 L358 E359 F372 F381 E439 E443	F352-R355 VanDerWaalsContact CD2-NH1 3.28Å; F352-R355 VanDerWaalsContact CE2-CZ 3.43Å; F352-R355 WeakPolarHBondContact O-CB 3.22Å; F352-R355 WeakPolarHBondContact O-CG 3.47Å; F352-R355 PolarHBondContact O-N 2.73Å; F352-R355 PolarHBondContact O-NH1 3.13Å; R355-L358 PolarHBondContact O-N 3.03Å; R355-E359 PolarHBondContact O-N 3.29Å; R355-F372 HydrophobicContact CB-CE1 4.01Å; R355-F372 HydrophobicContact CG-CE1 4.2Å; R355-F372 WeakPolarHBondContact O-CE1 3.41Å; R355-F381 HydrophobicContact CG-CD1 4.38Å; R355-F381 HydrophobicContact CG-CE1 3.83Å; R355-E439 IonicContact CZ-OE1 2.75Å; R355-E439 IonicContact NH1-OE1 3.23Å; R355-E439 PolarHBondContact NH1-OE1 3.49Å; R355-E439 IonicContact NH2-OE1 3.1Å; R355-E439 PolarHBondContact NH2-OE1 3.26Å; R355-E443 IonicContact NH2-OE2 2.93Å; R355-E443 PolarHBondContact NH2-OE2 2.96Å
356	K	92.9	Very high	91.9	Very high	134 Å²	134	46.9 Å²	46.9	58%	0.583	27%	0.268	S	S	*	.	H	α-helix	trans	-71.5	-42	-175.9	-68.2	174.1	-178.2	159.6	0	111.4	L354 L358 E359 A360 E443	L354-K356 VanDerWaalsContact C-N 3.29Å; L354-K356 PolarHBondContact O-N 3.45Å; K356-L358 VanDerWaalsContact C-N 3.34Å; K356-E359 PolarHBondContact O-N 2.9Å; K356-A360 WeakPolarHBondContact O-CB 3.27Å; K356-A360 PolarHBondContact O-N 3.37Å; K356-E443 VanDerWaalsContact CE-OE1 3.23Å; K356-E443 WeakPolarHBondContact CE-OE1 3.26Å; K356-E443 IonicContact NZ-OE1 2.68Å; K356-E443 PolarHBondContact NZ-OE1 3.47Å
357	E	95.1	Very high	92.4	Very high	77 Å²	77	42.3 Å²	42.3	36%	0.36	25%	0.253	S	S	.	.	H	α-helix	trans	-65.4	-39.4	175.3	-63.8	74.6	-168.5	0	0	111.1	E317 F318 L354 F361	E317-E357 HydrophobicContact CB-CB 4.44Å; E317-E357 HydrophobicContact CB-CG 4.22Å; E317-E357 HydrophobicContact CG-CG 4.12Å; F318-E357 HydrophobicContact CE1-CB 4.32Å; L354-E357 WeakPolarHBondContact CA-OE2 3.23Å; L354-E357 PolarHBondContact O-N 3.42Å; E357-F361 VanDerWaalsContact O-CB 3.26Å; E357-F361 WeakPolarHBondContact O-CB 3.41Å; E357-F361 PolarHBondContact O-N 3.13Å
358	L	94.3	Very high	92.9	Very high	1 Å²	1	46.6 Å²	46.6	1%	0.005	28%	0.28	C	S	.	.	H	α-helix	trans	-63	-47.8	174.7	-74.6	170.3	0	0	0	111.4	W304 I308 F318 I351 L354 R355 K356 A360 F361 L362 F372	W304-L358 HydrophobicContact CE3-CD1 4.48Å; I308-L358 HydrophobicContact CD1-CD2 3.31Å; I308-L358 HydrophobicContact CG1-CD2 4.14Å; F318-L358 HydrophobicContact CD1-CD2 4.43Å; F318-L358 HydrophobicContact CE1-CD2 3.59Å; F318-L358 HydrophobicContact CE1-CG 4.02Å; F318-L358 HydrophobicContact CZ-CD2 3.88Å; F318-L358 HydrophobicContact CZ-CG 4.46Å; I351-L358 HydrophobicContact CG2-CD1 3.82Å; I351-L358 WeakPolarHBondContact O-CD1 3.38Å; L354-L358 HydrophobicContact CB-CD1 4.16Å; L354-L358 HydrophobicContact CB-CG 4.17Å; L354-L358 WeakPolarHBondContact O-CB 3.01Å; L354-L358 WeakPolarHBondContact O-CG 3.22Å; L354-L358 PolarHBondContact O-N 3.18Å; R355-L358 PolarHBondContact O-N 3.03Å; K356-L358 VanDerWaalsContact C-N 3.34Å; L358-A360 PolarHBondContact O-N 2.86Å; L358-F361 PolarHBondContact O-N 2.8Å; L358-L362 WeakPolarHBondContact O-CB 3.2Å; L358-L362 VanDerWaalsContact O-CG 3.25Å; L358-L362 WeakPolarHBondContact O-CG 3.17Å; L358-L362 PolarHBondContact O-N 3.14Å; L358-F372 HydrophobicContact CB-CZ 4.02Å
359	E	95	Very high	93.2	Very high	69 Å²	69	48.2 Å²	48.2	32%	0.322	29%	0.289	S	S	.	.	H	α-helix	trans	-58.1	-51	176.3	-174.2	178.6	-166.7	0	0	111	R355 K356 F361 L362 V363 T369 F372	R355-E359 PolarHBondContact O-N 3.29Å; K356-E359 PolarHBondContact O-N 2.9Å; E359-F361 VanDerWaalsContact C-N 3.29Å; E359-F361 PolarHBondContact O-N 3.12Å; E359-L362 PolarHBondContact O-N 3.41Å; E359-V363 WeakPolarHBondContact O-CG2 3.42Å; E359-V363 PolarHBondContact O-N 3.19Å; E359-T369 HydrophobicContact CG-CG2 4.39Å; E359-F372 HydrophobicContact CB-CB 4.49Å; E359-F372 HydrophobicContact CB-CD1 3.86Å; E359-F372 HydrophobicContact CB-CD2 3.95Å; E359-F372 HydrophobicContact CB-CE1 4.03Å; E359-F372 HydrophobicContact CB-CE2 4.13Å; E359-F372 HydrophobicContact CB-CG 3.82Å; E359-F372 HydrophobicContact CB-CZ 4.15Å; E359-F372 HydrophobicContact CG-CB 3.97Å; E359-F372 HydrophobicContact CG-CD1 4.27Å; E359-F372 HydrophobicContact CG-CD2 3.95Å; E359-F372 HydrophobicContact CG-CG 3.79Å; E359-F372 WeakPolarHBondContact OE1-CB 3.32Å
360	A	94.4	Very high	93.3	Very high	58 Å²	58	47.6 Å²	47.6	48%	0.479	29%	0.294	S	S	.	.	H	α-helix	trans	-59.9	-38.7	178.2	0	0	0	0	0	112.4	K356 L358 S364	K356-A360 WeakPolarHBondContact O-CB 3.27Å; K356-A360 PolarHBondContact O-N 3.37Å; L358-A360 PolarHBondContact O-N 2.86Å; A360-S364 WeakPolarHBondContact O-CB 3.29Å; A360-S364 PolarHBondContact O-N 2.88Å; A360-S364 VanDerWaalsContact O-N 3.09Å
361	F	95.4	Very high	93.4	Very high	1 Å²	1	47.3 Å²	47.3	0%	0.004	29%	0.292	C	S	.	.	H	α-helix	trans	-63.7	-49.4	174.5	168	-113.2	0	0	0	111.9	L307 I308 R311 F318 E357 L358 E359 V363 S364 V365	L307-F361 HydrophobicContact CB-CE1 4.15Å; I308-F361 HydrophobicContact CB-CE1 4.44Å; I308-F361 HydrophobicContact CG1-CD1 4.1Å; I308-F361 HydrophobicContact CG1-CE1 3.73Å; R311-F361 HydrophobicContact CB-CE2 4.28Å; R311-F361 HydrophobicContact CB-CZ 4.02Å; F318-F361 HydrophobicContact CE2-CB 3.78Å; F318-F361 AromaticContact CE2-CD1 3.89Å; F318-F361 HydrophobicContact CE2-CD1 3.89Å; F318-F361 AromaticContact CE2-CD2 3.99Å; F318-F361 HydrophobicContact CE2-CD2 3.99Å; F318-F361 HydrophobicContact CE2-CE1 4.48Å; F318-F361 AromaticContact CE2-CG 3.6Å; F318-F361 HydrophobicContact CE2-CG 3.6Å; F318-F361 HydrophobicContact CZ-CB 3.69Å; F318-F361 HydrophobicContact CZ-CD1 4.14Å; F318-F361 AromaticContact CZ-CG 3.95Å; F318-F361 HydrophobicContact CZ-CG 3.95Å; E357-F361 VanDerWaalsContact O-CB 3.26Å; E357-F361 WeakPolarHBondContact O-CB 3.41Å; E357-F361 PolarHBondContact O-N 3.13Å; L358-F361 PolarHBondContact O-N 2.8Å; E359-F361 VanDerWaalsContact C-N 3.29Å; E359-F361 PolarHBondContact O-N 3.12Å; F361-V363 VanDerWaalsContact C-N 3.33Å; F361-V363 PolarHBondContact O-N 3.41Å; F361-S364 WeakPolarHBondContact O-CB 3.33Å; F361-S364 PolarHBondContact O-N 2.87Å; F361-S364 PolarHBondContact O-OG 3.23Å; F361-V365 HydrophobicContact CD2-CG1 4.06Å; F361-V365 HydrophobicContact CE2-CG1 3.56Å; F361-V365 HydrophobicContact CZ-CG1 4Å; F361-V365 HydrophobicContact CZ-CG2 4.45Å; F361-V365 PolarHBondContact O-N 3.21Å; F361-V365 VanDerWaalsContact O-N 3.1Å
362	L	94.3	Very high	93.4	Very high	1 Å²	1	48.2 Å²	48.2	1%	0.005	30%	0.296	C	S	.	.	H	α-helix	trans	-60.5	-42.1	-179.4	-70	170.1	0	0	0	111.6	W304 L307 L358 E359 S364 V365 G366 A367 T369 F372	W304-L362 HydrophobicContact CD2-CD1 4.17Å; W304-L362 HydrophobicContact CG-CD1 4.16Å; W304-L362 HydrophobicContact CG-CD2 4.49Å; W304-L362 HydrophobicContact CZ2-CD1 4.38Å; L307-L362 HydrophobicContact CD1-CD2 3.66Å; L358-L362 WeakPolarHBondContact O-CB 3.2Å; L358-L362 VanDerWaalsContact O-CG 3.25Å; L358-L362 WeakPolarHBondContact O-CG 3.17Å; L358-L362 PolarHBondContact O-N 3.14Å; E359-L362 PolarHBondContact O-N 3.41Å; L362-S364 VanDerWaalsContact C-N 3.33Å; L362-S364 PolarHBondContact O-N 2.77Å; L362-V365 WeakPolarHBondContact O-CG2 3.3Å; L362-V365 PolarHBondContact O-N 3.12Å; L362-G366 PolarHBondContact O-N 3.37Å; L362-A367 HydrophobicContact CB-CB 4.2Å; L362-A367 HydrophobicContact CD2-CB 3.71Å; L362-A367 PolarHBondContact O-N 3.47Å; L362-T369 HydrophobicContact CB-CG2 3.63Å; L362-T369 HydrophobicContact CD1-CG2 4.47Å; L362-F372 HydrophobicContact CD1-CE2 3.67Å; L362-F372 HydrophobicContact CD1-CZ 4.46Å
363	V	94.9	Very high	93.1	Very high	94 Å²	94	52.5 Å²	52.5	57%	0.57	33%	0.326	S	S	*	.	H	α-helix	trans	-56.8	-47.7	171.2	173.9	0	0	0	0	110.8	E359 F361 V365 G366 T369	E359-V363 WeakPolarHBondContact O-CG2 3.42Å; E359-V363 PolarHBondContact O-N 3.19Å; F361-V363 VanDerWaalsContact C-N 3.33Å; F361-V363 PolarHBondContact O-N 3.41Å; V363-V365 PolarHBondContact O-N 2.77Å; V363-G366 PolarHBondContact O-N 3.19Å; V363-G366 VanDerWaalsContact O-N 3.13Å; V363-T369 HydrophobicContact CG2-CG2 3.84Å
364	S	94	Very high	93	Very high	68 Å²	68	52.6 Å²	52.6	48%	0.476	32%	0.321	S	S	.	.	H	α-helix	trans	-65.1	-23.4	-176.8	75.8	0	0	0	0	114.4	R315 A360 F361 L362	R315-S364 PolarHBondContact NH2-OG 2.75Å; A360-S364 WeakPolarHBondContact O-CB 3.29Å; A360-S364 PolarHBondContact O-N 2.88Å; A360-S364 VanDerWaalsContact O-N 3.09Å; F361-S364 WeakPolarHBondContact O-CB 3.33Å; F361-S364 PolarHBondContact O-N 2.87Å; F361-S364 PolarHBondContact O-OG 3.23Å; L362-S364 VanDerWaalsContact C-N 3.33Å; L362-S364 PolarHBondContact O-N 2.77Å
365	V	93.2	Very high	92.8	Very high	32 Å²	32	54.9 Å²	54.9	19%	0.194	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102	5.9	177.9	-58.2	0	0	0	0	113.4	R311 F361 L362 V363 A367	R311-V365 HydrophobicContact CB-CG1 4.11Å; R311-V365 PolarHBondContact NH1-O 3.28Å; F361-V365 HydrophobicContact CD2-CG1 4.06Å; F361-V365 HydrophobicContact CE2-CG1 3.56Å; F361-V365 HydrophobicContact CZ-CG1 4Å; F361-V365 HydrophobicContact CZ-CG2 4.45Å; F361-V365 PolarHBondContact O-N 3.21Å; F361-V365 VanDerWaalsContact O-N 3.1Å; L362-V365 WeakPolarHBondContact O-CG2 3.3Å; L362-V365 PolarHBondContact O-N 3.12Å; V363-V365 PolarHBondContact O-N 2.77Å; V365-A367 VanDerWaalsContact C-N 3.31Å; V365-A367 HydrophobicContact CG2-CB 3.91Å; V365-A367 PolarHBondContact O-N 2.98Å
366	G	90.9	Very high	92.6	Very high	73 Å²	73	57.4 Å²	57.4	75%	0.753	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.8	26.8	-179.4	0	0	0	0	0	114.1	L362 V363	L362-G366 PolarHBondContact O-N 3.37Å; V363-G366 PolarHBondContact O-N 3.19Å; V363-G366 VanDerWaalsContact O-N 3.13Å
367	A	92.5	Very high	92.5	Very high	26 Å²	26	51.4 Å²	51.4	22%	0.215	32%	0.316	C	S	.	.			trans	-89.6	158.9	175.9	0	0	0	0	0	111.5	L307 L362 V365 T369	L307-A367 HydrophobicContact CD1-CB 3.83Å; L362-A367 HydrophobicContact CB-CB 4.2Å; L362-A367 HydrophobicContact CD2-CB 3.71Å; L362-A367 PolarHBondContact O-N 3.47Å; V365-A367 VanDerWaalsContact C-N 3.31Å; V365-A367 HydrophobicContact CG2-CB 3.91Å; V365-A367 PolarHBondContact O-N 2.98Å; A367-T369 PolarHBondContact O-N 3.41Å
368	T	90.2	Very high	92.4	Very high	93 Å²	93	48.7 Å²	48.7	57%	0.571	30%	0.304	S	S	*	.			trans	-68.4	128.7	-177.9	-52.1	0	0	0	0	111.9	V370	T368-V370 HydrophobicContact CG2-CB 4.07Å; T368-V370 HydrophobicContact CG2-CG1 3.54Å; T368-V370 HydrophobicContact CG2-CG2 3.66Å
369	T	91.5	Very high	92.3	Very high	34 Å²	34	48.6 Å²	48.6	21%	0.209	30%	0.304	C	S	.	.			trans	-113	14.9	177.7	55.8	0	0	0	0	114.1	E359 L362 V363 A367 H371 F372	E359-T369 HydrophobicContact CG-CG2 4.39Å; L362-T369 HydrophobicContact CB-CG2 3.63Å; L362-T369 HydrophobicContact CD1-CG2 4.47Å; V363-T369 HydrophobicContact CG2-CG2 3.84Å; A367-T369 PolarHBondContact O-N 3.41Å; T369-H371 PolarHBondContact O-N 3.46Å; T369-F372 PolarHBondContact O-N 3.18Å
370	V	92.1	Very high	92	Very high	88 Å²	88	45.8 Å²	45.8	53%	0.533	29%	0.291	S	S	.	.	H	α-helix	trans	-51.2	-34.1	-176.9	-63.3	0	0	0	0	113.4	T368 F372 S373 D374	T368-V370 HydrophobicContact CG2-CB 4.07Å; T368-V370 HydrophobicContact CG2-CG1 3.54Å; T368-V370 HydrophobicContact CG2-CG2 3.66Å; V370-F372 VanDerWaalsContact C-N 3.31Å; V370-F372 PolarHBondContact O-N 3.5Å; V370-S373 PolarHBondContact O-N 2.96Å; V370-S373 VanDerWaalsContact O-N 3.11Å; V370-D374 PolarHBondContact O-N 3.3Å
371	H	91.6	Very high	91.9	Very high	29 Å²	29	43 Å²	43	13%	0.134	27%	0.268	C	S	.	.	H	α-helix	trans	-64.1	-29.9	179.2	-56.3	88.6	0	0	0	113.5	T300 W304 T369 S373 D374 W377	T300-H371 PolarHBondContact OG1-NE2 3.19Å; W304-H371 HydrophobicContact CH2-CB 4.21Å; W304-H371 HydrophobicContact CZ2-CB 3.88Å; T369-H371 PolarHBondContact O-N 3.46Å; H371-S373 VanDerWaalsContact C-N 3.32Å; H371-D374 PolarHBondContact O-N 3Å; H371-W377 HydrophobicContact CB-CD2 3.81Å; H371-W377 HydrophobicContact CB-CE3 3.82Å; H371-W377 HydrophobicContact CB-CG 4.31Å; H371-W377 HydrophobicContact CB-CH2 4.49Å; H371-W377 HydrophobicContact CB-CZ2 4.44Å; H371-W377 HydrophobicContact CB-CZ3 4.18Å; H371-W377 AromaticContact CD2-CD1 3.67Å; H371-W377 AromaticContact CD2-CD2 3.94Å; H371-W377 AromaticContact CD2-CE2 3.61Å; H371-W377 AromaticContact CD2-CG 3.98Å; H371-W377 AromaticContact CD2-NE1 3.41Å; H371-W377 PolarHBondContact CD2-NE1 3.4Å
372	F	91.4	Very high	91.8	Very high	22 Å²	22	43 Å²	43	10%	0.096	27%	0.268	C	S	.	.	H	α-helix	trans	-79.5	-16.9	175.9	-66.4	-82.8	0	0	0	112.7	W304 R355 L358 E359 L362 T369 V370 L378	W304-F372 HydrophobicContact CE3-CZ 4.5Å; W304-F372 HydrophobicContact CH2-CD2 4.43Å; W304-F372 HydrophobicContact CH2-CE1 4.38Å; W304-F372 AromaticContact CH2-CE2 3.56Å; W304-F372 HydrophobicContact CH2-CE2 3.56Å; W304-F372 AromaticContact CH2-CZ 3.54Å; W304-F372 HydrophobicContact CH2-CZ 3.54Å; W304-F372 HydrophobicContact CZ2-CD2 4.4Å; W304-F372 AromaticContact CZ2-CE2 3.61Å; W304-F372 HydrophobicContact CZ2-CE2 3.61Å; W304-F372 HydrophobicContact CZ2-CZ 4.06Å; W304-F372 HydrophobicContact CZ3-CE2 4.2Å; W304-F372 AromaticContact CZ3-CZ 3.8Å; W304-F372 HydrophobicContact CZ3-CZ 3.8Å; R355-F372 HydrophobicContact CB-CE1 4.01Å; R355-F372 HydrophobicContact CG-CE1 4.2Å; R355-F372 WeakPolarHBondContact O-CE1 3.41Å; L358-F372 HydrophobicContact CB-CZ 4.02Å; E359-F372 HydrophobicContact CB-CB 4.49Å; E359-F372 HydrophobicContact CB-CD1 3.86Å; E359-F372 HydrophobicContact CB-CD2 3.95Å; E359-F372 HydrophobicContact CB-CE1 4.03Å; E359-F372 HydrophobicContact CB-CE2 4.13Å; E359-F372 HydrophobicContact CB-CG 3.82Å; E359-F372 HydrophobicContact CB-CZ 4.15Å; E359-F372 HydrophobicContact CG-CB 3.97Å; E359-F372 HydrophobicContact CG-CD1 4.27Å; E359-F372 HydrophobicContact CG-CD2 3.95Å; E359-F372 HydrophobicContact CG-CG 3.79Å; E359-F372 WeakPolarHBondContact OE1-CB 3.32Å; L362-F372 HydrophobicContact CD1-CE2 3.67Å; L362-F372 HydrophobicContact CD1-CZ 4.46Å; T369-F372 PolarHBondContact O-N 3.18Å; V370-F372 VanDerWaalsContact C-N 3.31Å; V370-F372 PolarHBondContact O-N 3.5Å; F372-L378 HydrophobicContact CD1-CD2 4.42Å
373	S	88.5	Confident	91.7	Very high	97 Å²	97	43.1 Å²	43.1	68%	0.678	27%	0.268	S	S	*	.	H	α-helix	trans	-93.1	-14.1	171.3	-54.8	0	0	0	0	112.7	V370 H371 K375	V370-S373 PolarHBondContact O-N 2.96Å; V370-S373 VanDerWaalsContact O-N 3.11Å; H371-S373 VanDerWaalsContact C-N 3.32Å; S373-K375 PolarHBondContact O-N 3.11Å
374	D	91.4	Very high	91.3	Very high	75 Å²	75	39 Å²	39	40%	0.401	24%	0.243	S	C	.	.			trans	-86.9	105.2	179.7	-174.3	-19	0	0	0	110.6	V370 H371 Q376 W377 L378	V370-D374 PolarHBondContact O-N 3.3Å; H371-D374 PolarHBondContact O-N 3Å; D374-Q376 VanDerWaalsContact C-N 3.3Å; D374-Q376 PolarHBondContact O-N 2.99Å; D374-Q376 WeakPolarHBondContact OD1-CB 3.42Å; D374-Q376 PolarHBondContact OD1-N 3.32Å; D374-W377 HydrophobicContact CB-CB 3.77Å; D374-W377 PolarHBondContact O-N 3.07Å; D374-W377 PolarHBondContact OD1-N 2.95Å; D374-W377 VanDerWaalsContact OD1-N 3.07Å; D374-L378 PolarHBondContact O-N 3.31Å
375	K	90.6	Very high	91.2	Very high	68 Å²	68	36 Å²	36	30%	0.296	22%	0.221	S	C	.	.	H	α-helix	trans	-57	-42.6	178.4	-60.9	178.2	179	176.3	0	112.2	S373 C379 L444 N448 D451	S373-K375 PolarHBondContact O-N 3.11Å; K375-C379 PolarHBondContact O-N 3.01Å; K375-C379 VanDerWaalsContact O-N 3.08Å; K375-C379 PolarHBondContact O-SG 3.37Å; K375-L444 HydrophobicContact CB-CD1 4.02Å; K375-L444 HydrophobicContact CG-CD1 4.26Å; K375-L444 HydrophobicContact CG-CD2 4.07Å; K375-N448 VanDerWaalsContact CE-ND2 3.28Å; K375-N448 WeakPolarHBondContact CE-ND2 3.4Å; K375-D451 IonicContact NZ-OD2 2.65Å; K375-D451 PolarHBondContact NZ-OD2 2.68Å
376	Q	89.4	Confident	91.2	Very high	65 Å²	65	34.8 Å²	34.8	30%	0.304	21%	0.214	S	C	.	.	H	α-helix	trans	-69.6	-41.6	-176.9	-174.9	61.4	56.3	0	0	110.1	D374 C379 D380 Y460	D374-Q376 VanDerWaalsContact C-N 3.3Å; D374-Q376 PolarHBondContact O-N 2.99Å; D374-Q376 WeakPolarHBondContact OD1-CB 3.42Å; D374-Q376 PolarHBondContact OD1-N 3.32Å; Q376-C379 PolarHBondContact O-N 3.15Å; Q376-D380 PolarHBondContact NE2-OD1 2.67Å; Q376-D380 WeakPolarHBondContact O-CB 3.05Å; Q376-D380 VanDerWaalsContact O-CG 3.23Å; Q376-D380 PolarHBondContact O-N 3.21Å; Q376-Y460 PolarHBondContact NE2-OH 2.94Å
377	W	91.1	Very high	91.1	Very high	9 Å²	9	32 Å²	32	3%	0.034	18%	0.182	C	C	.	.	H	α-helix	trans	-62.7	-43.4	177.3	-168.5	92.7	0	0	0	112	I297 T300 I301 W304 H371 D374 D380 F381	I297-W377 HydrophobicContact CB-CZ2 4.45Å; I297-W377 HydrophobicContact CG1-CZ2 4.37Å; I297-W377 HydrophobicContact CG2-CZ2 4.08Å; T300-W377 HydrophobicContact CG2-CZ2 3.99Å; I301-W377 HydrophobicContact CG1-CH2 4.44Å; W304-W377 AromaticContact CH2-CH2 3.26Å; W304-W377 HydrophobicContact CH2-CH2 3.26Å; W304-W377 HydrophobicContact CH2-CZ2 4.02Å; W304-W377 AromaticContact CH2-CZ3 3.67Å; W304-W377 HydrophobicContact CH2-CZ3 3.67Å; W304-W377 HydrophobicContact CZ2-CH2 4.18Å; W304-W377 AromaticContact CZ3-CH2 3.67Å; W304-W377 HydrophobicContact CZ3-CH2 3.67Å; W304-W377 HydrophobicContact CZ3-CZ3 4.28Å; H371-W377 HydrophobicContact CB-CD2 3.81Å; H371-W377 HydrophobicContact CB-CE3 3.82Å; H371-W377 HydrophobicContact CB-CG 4.31Å; H371-W377 HydrophobicContact CB-CH2 4.49Å; H371-W377 HydrophobicContact CB-CZ2 4.44Å; H371-W377 HydrophobicContact CB-CZ3 4.18Å; H371-W377 AromaticContact CD2-CD1 3.67Å; H371-W377 AromaticContact CD2-CD2 3.94Å; H371-W377 AromaticContact CD2-CE2 3.61Å; H371-W377 AromaticContact CD2-CG 3.98Å; H371-W377 AromaticContact CD2-NE1 3.41Å; H371-W377 PolarHBondContact CD2-NE1 3.4Å; D374-W377 HydrophobicContact CB-CB 3.77Å; D374-W377 PolarHBondContact O-N 3.07Å; D374-W377 PolarHBondContact OD1-N 2.95Å; D374-W377 VanDerWaalsContact OD1-N 3.07Å; W377-D380 PolarHBondContact O-N 2.88Å; W377-F381 HydrophobicContact CE3-CB 4.22Å; W377-F381 HydrophobicContact CH2-CB 4.17Å; W377-F381 AromaticContact CH2-CD1 3.85Å; W377-F381 HydrophobicContact CH2-CD1 3.85Å; W377-F381 HydrophobicContact CH2-CE1 4.44Å; W377-F381 HydrophobicContact CH2-CG 4.03Å; W377-F381 HydrophobicContact CZ3-CB 3.9Å; W377-F381 AromaticContact CZ3-CD1 3.64Å; W377-F381 HydrophobicContact CZ3-CD1 3.64Å; W377-F381 HydrophobicContact CZ3-CE1 4.47Å; W377-F381 HydrophobicContact CZ3-CG 4.01Å; W377-F381 WeakPolarHBondContact O-CB 3.49Å; W377-F381 PolarHBondContact O-N 3.14Å
378	L	92.7	Very high	90.7	Very high	19 Å²	19	31.2 Å²	31.2	10%	0.099	17%	0.174	C	C	.	.	H	α-helix	trans	-63.3	-42.1	176.9	-73.3	173.6	0	0	0	112.3	F372 D374 F381 G382 V440	F372-L378 HydrophobicContact CD1-CD2 4.42Å; D374-L378 PolarHBondContact O-N 3.31Å; L378-F381 PolarHBondContact O-N 3.17Å; L378-G382 PolarHBondContact O-N 2.98Å; L378-V440 HydrophobicContact CB-CG1 3.68Å
379	C	92.3	Very high	90.6	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-64.6	-43.3	175.3	-69.1	0	0	0	0	111	K375 Q376 F381 G382 F383 L437 F455 Y460	K375-C379 PolarHBondContact O-N 3.01Å; K375-C379 VanDerWaalsContact O-N 3.08Å; K375-C379 PolarHBondContact O-SG 3.37Å; Q376-C379 PolarHBondContact O-N 3.15Å; C379-F381 VanDerWaalsContact C-N 3.3Å; C379-F381 PolarHBondContact O-N 3.48Å; C379-G382 PolarHBondContact O-N 3.06Å; C379-F383 WeakPolarHBondContact O-CB 3.47Å; C379-F383 PolarHBondContact O-N 3.14Å; C379-L437 HydrophobicContact CB-CD1 3.79Å; C379-L437 WeakPolarHBondContact O-CD1 3.27Å; C379-F455 HydrophobicContact CB-CB 4.19Å; C379-Y460 WeakPolarHBondContact CB-OH 3.09Å
380	D	90.4	Very high	90.5	Very high	10 Å²	10	27.3 Å²	27.3	5%	0.053	15%	0.147	C	C	.	.	H	α-helix	trans	-63.1	-37.1	176.4	-69	-2.8	0	0	0	111.6	I297 Q376 W377 L384 R459 Y460	I297-D380 HydrophobicContact CD1-CB 3.66Å; Q376-D380 PolarHBondContact NE2-OD1 2.67Å; Q376-D380 WeakPolarHBondContact O-CB 3.05Å; Q376-D380 VanDerWaalsContact O-CG 3.23Å; Q376-D380 PolarHBondContact O-N 3.21Å; W377-D380 PolarHBondContact O-N 2.88Å; D380-L384 VanDerWaalsContact O-CB 3.31Å; D380-L384 WeakPolarHBondContact O-CB 3.43Å; D380-L384 PolarHBondContact O-N 2.8Å; D380-R459 IonicContact OD1-NE 2.79Å; D380-R459 PolarHBondContact OD1-NE 3.3Å; D380-R459 IonicContact OD2-CZ 2.73Å; D380-R459 IonicContact OD2-NE 3.38Å; D380-R459 PolarHBondContact OD2-NE 2.93Å; D380-R459 VanDerWaalsContact OD2-NE 3.1Å; D380-R459 IonicContact OD2-NH2 3.31Å; D380-R459 PolarHBondContact OD2-NH2 3.43Å; D380-Y460 PolarHBondContact N-OH 2.62Å; D380-Y460 WeakPolarHBondContact OD1-CE1 3.44Å; D380-Y460 PolarHBondContact OD1-OH 3.07Å
381	F	91.1	Very high	90.2	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-66.3	-47.2	175.6	-179	-151.7	0	0	0	111.9	I297 I301 L348 I351 F352 R355 W377 L378 C379 L384 V385	I297-F381 HydrophobicContact CG2-CB 4.46Å; I297-F381 HydrophobicContact CG2-CD2 3.98Å; I297-F381 HydrophobicContact CG2-CG 4.46Å; I301-F381 HydrophobicContact CD1-CD2 3.83Å; I301-F381 HydrophobicContact CD1-CE2 3.36Å; I301-F381 HydrophobicContact CD1-CZ 3.77Å; L348-F381 HydrophobicContact CD1-CE2 3.77Å; L348-F381 HydrophobicContact CG-CE2 4Å; I351-F381 HydrophobicContact CG2-CZ 4.07Å; F352-F381 HydrophobicContact CB-CE1 4.19Å; F352-F381 HydrophobicContact CB-CE2 4.34Å; F352-F381 HydrophobicContact CB-CZ 3.8Å; F352-F381 AromaticContact CD2-CD1 3.85Å; F352-F381 HydrophobicContact CD2-CD1 3.85Å; F352-F381 HydrophobicContact CD2-CD2 4.47Å; F352-F381 AromaticContact CD2-CE1 3.76Å; F352-F381 HydrophobicContact CD2-CE1 3.76Å; F352-F381 HydrophobicContact CD2-CE2 4.36Å; F352-F381 HydrophobicContact CD2-CG 4.22Å; F352-F381 HydrophobicContact CD2-CZ 4.02Å; F352-F381 HydrophobicContact CE2-CD1 4.46Å; F352-F381 HydrophobicContact CG-CE1 4.44Å; F352-F381 HydrophobicContact CG-CZ 4.43Å; R355-F381 HydrophobicContact CG-CD1 4.38Å; R355-F381 HydrophobicContact CG-CE1 3.83Å; W377-F381 HydrophobicContact CE3-CB 4.22Å; W377-F381 HydrophobicContact CH2-CB 4.17Å; W377-F381 AromaticContact CH2-CD1 3.85Å; W377-F381 HydrophobicContact CH2-CD1 3.85Å; W377-F381 HydrophobicContact CH2-CE1 4.44Å; W377-F381 HydrophobicContact CH2-CG 4.03Å; W377-F381 HydrophobicContact CZ3-CB 3.9Å; W377-F381 AromaticContact CZ3-CD1 3.64Å; W377-F381 HydrophobicContact CZ3-CD1 3.64Å; W377-F381 HydrophobicContact CZ3-CE1 4.47Å; W377-F381 HydrophobicContact CZ3-CG 4.01Å; W377-F381 WeakPolarHBondContact O-CB 3.49Å; W377-F381 PolarHBondContact O-N 3.14Å; L378-F381 PolarHBondContact O-N 3.17Å; C379-F381 VanDerWaalsContact C-N 3.3Å; C379-F381 PolarHBondContact O-N 3.48Å; F381-L384 PolarHBondContact O-N 3.13Å; F381-V385 HydrophobicContact CD2-CG2 3.99Å; F381-V385 HydrophobicContact CE2-CG2 3.74Å; F381-V385 HydrophobicContact CZ-CG2 4.45Å; F381-V385 VanDerWaalsContact O-CG2 3.27Å; F381-V385 WeakPolarHBondContact O-CG2 3.48Å; F381-V385 PolarHBondContact O-N 3.23Å
382	G	93.3	Very high	89.8	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-60.9	-45.2	175.5	0	0	0	0	0	112.4	L378 C379 L384 V385 D386 A436	L378-G382 PolarHBondContact O-N 2.98Å; C379-G382 PolarHBondContact O-N 3.06Å; G382-L384 VanDerWaalsContact C-N 3.35Å; G382-L384 PolarHBondContact O-N 2.8Å; G382-V385 WeakPolarHBondContact O-CB 3.41Å; G382-V385 PolarHBondContact O-N 3Å; G382-D386 PolarHBondContact O-N 3.05Å; G382-D386 VanDerWaalsContact O-N 3.16Å; G382-A436 WeakPolarHBondContact O-CB 3.32Å
383	F	91.7	Very high	89.6	Confident	3 Å²	3	28 Å²	28	1%	0.013	14%	0.142	C	C	.	.	H	α-helix	trans	-59.9	-43.3	175.4	176.2	-99.5	0	0	0	112.4	C379 D386 I387 F434 L437 Y460 V463 I464	C379-F383 WeakPolarHBondContact O-CB 3.47Å; C379-F383 PolarHBondContact O-N 3.14Å; F383-D386 PolarHBondContact O-N 2.84Å; F383-I387 HydrophobicContact CD1-CG1 4.25Å; F383-I387 HydrophobicContact CD2-CG1 4.43Å; F383-I387 HydrophobicContact CE1-CG1 3.69Å; F383-I387 HydrophobicContact CE2-CD1 4.11Å; F383-I387 HydrophobicContact CE2-CG1 3.9Å; F383-I387 HydrophobicContact CZ-CD1 3.84Å; F383-I387 HydrophobicContact CZ-CG1 3.49Å; F383-I387 VanDerWaalsContact CZ-CG1 3.49Å; F383-I387 WeakPolarHBondContact O-CG1 3.26Å; F383-I387 PolarHBondContact O-N 3.02Å; F383-F434 AromaticContact CD2-CD1 3.99Å; F383-F434 HydrophobicContact CD2-CD1 3.99Å; F383-F434 AromaticContact CD2-CE1 3.88Å; F383-F434 HydrophobicContact CD2-CE1 3.88Å; F383-F434 HydrophobicContact CE2-CD1 4.17Å; F383-F434 AromaticContact CE2-CE1 3.57Å; F383-F434 HydrophobicContact CE2-CE1 3.57Å; F383-F434 HydrophobicContact CE2-CZ 4.2Å; F383-L437 HydrophobicContact CB-CD2 4.27Å; F383-L437 HydrophobicContact CD2-CD2 4.25Å; F383-Y460 HydrophobicContact CB-CD1 3.94Å; F383-Y460 HydrophobicContact CB-CE1 3.75Å; F383-Y460 AromaticContact CD1-CD1 3.51Å; F383-Y460 HydrophobicContact CD1-CD1 3.51Å; F383-Y460 AromaticContact CD1-CE1 3.95Å; F383-Y460 HydrophobicContact CD1-CE1 3.95Å; F383-Y460 HydrophobicContact CD1-CG 4.34Å; F383-Y460 AromaticContact CD2-CD1 3.73Å; F383-Y460 HydrophobicContact CD2-CD1 3.73Å; F383-Y460 HydrophobicContact CD2-CD2 4.34Å; F383-Y460 HydrophobicContact CD2-CE1 4.4Å; F383-Y460 AromaticContact CD2-CG 3.75Å; F383-Y460 HydrophobicContact CD2-CG 3.75Å; F383-Y460 AromaticContact CE1-CD1 3.9Å; F383-Y460 HydrophobicContact CE1-CD1 3.9Å; F383-Y460 HydrophobicContact CE2-CD1 4.1Å; F383-Y460 AromaticContact CE2-CG 3.99Å; F383-Y460 HydrophobicContact CE2-CG 3.99Å; F383-Y460 AromaticContact CG-CD1 3.41Å; F383-Y460 HydrophobicContact CG-CD1 3.41Å; F383-Y460 VanDerWaalsContact CG-CD1 3.41Å; F383-Y460 AromaticContact CG-CE1 3.76Å; F383-Y460 HydrophobicContact CG-CE1 3.76Å; F383-Y460 AromaticContact CG-CG 3.93Å; F383-Y460 HydrophobicContact CG-CG 3.93Å; F383-Y460 HydrophobicContact CZ-CD1 4.18Å; F383-Y460 HydrophobicContact CZ-CG 4.38Å; F383-V463 HydrophobicContact CE1-CB 4Å; F383-V463 HydrophobicContact CE1-CG1 3.77Å; F383-V463 HydrophobicContact CE1-CG2 4.47Å; F383-V463 HydrophobicContact CZ-CB 4.3Å; F383-V463 HydrophobicContact CZ-CG1 4.32Å; F383-I464 HydrophobicContact CE2-CD1 4.16Å; F383-I464 HydrophobicContact CE2-CG1 4.27Å; F383-I464 HydrophobicContact CZ-CD1 4.23Å; F383-I464 HydrophobicContact CZ-CG1 3.84Å
384	L	88.3	Confident	89.4	Confident	9 Å²	9	23.5 Å²	23.5	5%	0.047	11%	0.11	C	C	.	.	H	α-helix	trans	-62.7	-43.3	177.8	-177.4	62.9	0	0	0	111.4	V294 I297 V298 L348 D380 F381 G382 D386 I387 M388	V294-L384 HydrophobicContact CG1-CD1 3.95Å; V294-L384 HydrophobicContact CG1-CD2 4.03Å; V294-L384 HydrophobicContact CG2-CD1 3.97Å; I297-L384 HydrophobicContact CB-CD2 4.22Å; I297-L384 HydrophobicContact CD1-CD2 4.38Å; I297-L384 HydrophobicContact CG2-CD2 3.85Å; V298-L384 HydrophobicContact CG2-CD2 4.48Å; L348-L384 HydrophobicContact CD2-CB 4.44Å; L348-L384 HydrophobicContact CD2-CD2 3.93Å; L348-L384 HydrophobicContact CD2-CG 3.72Å; D380-L384 VanDerWaalsContact O-CB 3.31Å; D380-L384 WeakPolarHBondContact O-CB 3.43Å; D380-L384 PolarHBondContact O-N 2.8Å; F381-L384 PolarHBondContact O-N 3.13Å; G382-L384 VanDerWaalsContact C-N 3.35Å; G382-L384 PolarHBondContact O-N 2.8Å; L384-D386 VanDerWaalsContact C-N 3.29Å; L384-D386 PolarHBondContact O-N 3.34Å; L384-I387 PolarHBondContact O-N 2.84Å; L384-M388 HydrophobicContact CD1-CG 3.91Å; L384-M388 HydrophobicContact CD1-SD 3.99Å; L384-M388 HydrophobicContact CG-CG 4.13Å; L384-M388 WeakPolarHBondContact O-CB 3.12Å; L384-M388 VanDerWaalsContact O-CG 3.24Å; L384-M388 WeakPolarHBondContact O-CG 2.91Å; L384-M388 PolarHBondContact O-N 3.11Å
385	V	90.7	Very high	88.9	Confident	3 Å²	3	21.4 Å²	21.4	2%	0.018	10%	0.101	C	C	.	.	H	α-helix	trans	-54.9	-47	175.7	170.5	0	0	0	0	111	L348 K349 F352 F381 G382 E389 A436	L348-V385 HydrophobicContact CD2-CG2 4.06Å; L348-V385 HydrophobicContact CG-CG2 3.81Å; K349-V385 HydrophobicContact CB-CG1 3.97Å; K349-V385 HydrophobicContact CG-CG1 4.17Å; F352-V385 HydrophobicContact CB-CG1 4.43Å; F352-V385 HydrophobicContact CB-CG2 3.67Å; F352-V385 HydrophobicContact CD2-CG2 3.81Å; F352-V385 HydrophobicContact CG-CG1 4.43Å; F352-V385 HydrophobicContact CG-CG2 3.83Å; F381-V385 HydrophobicContact CD2-CG2 3.99Å; F381-V385 HydrophobicContact CE2-CG2 3.74Å; F381-V385 HydrophobicContact CZ-CG2 4.45Å; F381-V385 VanDerWaalsContact O-CG2 3.27Å; F381-V385 WeakPolarHBondContact O-CG2 3.48Å; F381-V385 PolarHBondContact O-N 3.23Å; G382-V385 WeakPolarHBondContact O-CB 3.41Å; G382-V385 PolarHBondContact O-N 3Å; V385-E389 WeakPolarHBondContact O-CB 3.43Å; V385-E389 PolarHBondContact O-N 3.35Å; V385-A436 HydrophobicContact CB-CB 3.95Å; V385-A436 HydrophobicContact CG1-CB 3.8Å
386	D	92.6	Very high	88.5	Confident	7 Å²	7	23.4 Å²	23.4	4%	0.037	11%	0.111	C	C	.	.	H	α-helix	trans	-65.3	-45.6	-179.7	-66.2	-39.2	0	0	0	111.8	G382 F383 L384 M388 E389 H390 F434 P435 A436 L437	G382-D386 PolarHBondContact O-N 3.05Å; G382-D386 VanDerWaalsContact O-N 3.16Å; F383-D386 PolarHBondContact O-N 2.84Å; L384-D386 VanDerWaalsContact C-N 3.29Å; L384-D386 PolarHBondContact O-N 3.34Å; D386-M388 PolarHBondContact O-N 2.96Å; D386-E389 WeakPolarHBondContact O-CB 3.46Å; D386-E389 PolarHBondContact O-N 3.13Å; D386-H390 PolarHBondContact O-CD2 3.05Å; D386-H390 PolarHBondContact O-N 2.95Å; D386-F434 HydrophobicContact CB-CB 4.44Å; D386-F434 HydrophobicContact CB-CD1 3.75Å; D386-F434 VanDerWaalsContact CG-CA 3.48Å; D386-F434 WeakPolarHBondContact OD2-CA 3.48Å; D386-F434 WeakPolarHBondContact OD2-CB 3.32Å; D386-P435 WeakPolarHBondContact OD1-CD 3.48Å; D386-P435 WeakPolarHBondContact OD1-CG 3.18Å; D386-A436 VanDerWaalsContact OD1-CB 3.24Å; D386-A436 WeakPolarHBondContact OD1-CB 3.49Å; D386-A436 PolarHBondContact OD1-N 3.29Å; D386-A436 PolarHBondContact OD2-N 3.32Å; D386-L437 PolarHBondContact OD2-N 3.09Å
387	I	88.8	Confident	88.2	Confident	14 Å²	14	23.2 Å²	23.2	7%	0.072	11%	0.111	C	C	.	.	H	α-helix	trans	-63.3	-43	177.7	-68.1	-64.3	0	0	0	112.1	F383 L384 E389 H390 L391 F434 I464 L467	F383-I387 HydrophobicContact CD1-CG1 4.25Å; F383-I387 HydrophobicContact CD2-CG1 4.43Å; F383-I387 HydrophobicContact CE1-CG1 3.69Å; F383-I387 HydrophobicContact CE2-CD1 4.11Å; F383-I387 HydrophobicContact CE2-CG1 3.9Å; F383-I387 HydrophobicContact CZ-CD1 3.84Å; F383-I387 HydrophobicContact CZ-CG1 3.49Å; F383-I387 VanDerWaalsContact CZ-CG1 3.49Å; F383-I387 WeakPolarHBondContact O-CG1 3.26Å; F383-I387 PolarHBondContact O-N 3.02Å; L384-I387 PolarHBondContact O-N 2.84Å; I387-E389 VanDerWaalsContact C-N 3.26Å; I387-E389 PolarHBondContact O-N 3.15Å; I387-H390 PolarHBondContact O-N 2.94Å; I387-L391 HydrophobicContact CG2-CD1 4.16Å; I387-L391 WeakPolarHBondContact O-CG 3.31Å; I387-L391 PolarHBondContact O-N 2.79Å; I387-F434 HydrophobicContact CD1-CE1 4.01Å; I387-I464 HydrophobicContact CD1-CG1 4.34Å; I387-L467 HydrophobicContact CG2-CD2 4Å
388	M	85	Confident	87.7	Confident	11 Å²	11	22.9 Å²	22.9	5%	0.054	11%	0.11	C	C	.	.	H	α-helix	trans	-67.2	-30.1	178.5	-62.8	-43.8	-68.7	0	0	111.9	E285 R343 L348 L384 D386 L391 R392	E285-M388 HydrophobicContact CB-CE 3.69Å; R343-M388 HydrophobicContact CB-CE 3.85Å; R343-M388 HydrophobicContact CG-CE 4.36Å; R343-M388 WeakPolarHBondContact O-CE 3.47Å; L348-M388 HydrophobicContact CD2-CB 4.35Å; L348-M388 HydrophobicContact CD2-CG 3.88Å; L384-M388 HydrophobicContact CD1-CG 3.91Å; L384-M388 HydrophobicContact CD1-SD 3.99Å; L384-M388 HydrophobicContact CG-CG 4.13Å; L384-M388 WeakPolarHBondContact O-CB 3.12Å; L384-M388 VanDerWaalsContact O-CG 3.24Å; L384-M388 WeakPolarHBondContact O-CG 2.91Å; L384-M388 PolarHBondContact O-N 3.11Å; D386-M388 PolarHBondContact O-N 2.96Å; M388-L391 HydrophobicContact CE-CD1 4.34Å; M388-L391 HydrophobicContact SD-CD1 4.09Å; M388-R392 WeakPolarHBondContact O-CB 3.47Å; M388-R392 PolarHBondContact O-N 3.23Å
389	E	87.4	Confident	86.5	Confident	19 Å²	19	24.1 Å²	24.1	9%	0.089	13%	0.126	C	C	.	.	H	α-helix	trans	-68.1	-46.1	173.1	-174.1	74.7	152.1	0	0	111.7	K349 V385 D386 I387 L391 R392 E393	K349-E389 IonicContact NZ-OE1 3.65Å; K349-E389 PolarHBondContact NZ-OE1 3.1Å; V385-E389 WeakPolarHBondContact O-CB 3.43Å; V385-E389 PolarHBondContact O-N 3.35Å; D386-E389 WeakPolarHBondContact O-CB 3.46Å; D386-E389 PolarHBondContact O-N 3.13Å; I387-E389 VanDerWaalsContact C-N 3.26Å; I387-E389 PolarHBondContact O-N 3.15Å; E389-L391 VanDerWaalsContact C-N 3.29Å; E389-L391 PolarHBondContact O-N 3.28Å; E389-R392 WeakPolarHBondContact O-CB 3.44Å; E389-R392 PolarHBondContact O-N 2.85Å; E389-R392 VanDerWaalsContact O-N 3.08Å; E389-R392 IonicContact OE1-CZ 2.96Å; E389-R392 IonicContact OE1-NE 2.65Å; E389-R392 IonicContact OE1-NH2 3.72Å; E389-R392 PolarHBondContact OE1-NH2 2.91Å; E389-R392 IonicContact OE2-CZ 2.73Å; E389-R392 IonicContact OE2-NE 2.74Å; E389-R392 PolarHBondContact OE2-NE 2.85Å; E389-R392 IonicContact OE2-NH2 3.38Å; E389-R392 PolarHBondContact OE2-NH2 3.27Å; E389-R392 VanDerWaalsContact OE2-NH2 3.12Å; E389-E393 PolarHBondContact O-N 3.19Å
390	H	89.6	Confident	85.2	Confident	26 Å²	26	29.6 Å²	29.6	12%	0.12	16%	0.16	C	C	.	.	H	α-helix	trans	-59.5	-39.1	175.3	-73.5	-56.3	0	0	0	112.4	D386 I387 L394 F415 F422 D433	D386-H390 PolarHBondContact O-CD2 3.05Å; D386-H390 PolarHBondContact O-N 2.95Å; I387-H390 PolarHBondContact O-N 2.94Å; H390-L394 PolarHBondContact O-N 3.28Å; H390-F415 HydrophobicContact CB-CE2 3.95Å; H390-F415 HydrophobicContact CB-CZ 4.14Å; H390-F415 WeakPolarHBondContact O-CE2 3.44Å; H390-F422 HydrophobicContact CB-CE2 4.23Å; H390-F422 AromaticContact CD2-CE2 3.7Å; H390-F422 AromaticContact CD2-CZ 3.74Å; H390-F422 AromaticContact CE1-CZ 3.52Å; H390-F422 AromaticContact CG-CE2 3.75Å; H390-F422 AromaticContact CG-CZ 3.74Å; H390-F422 AromaticContact ND1-CZ 3.57Å; H390-F422 AromaticContact NE2-CZ 3.61Å; H390-D433 PolarHBondContact NE2-O 3.02Å
391	L	85.8	Confident	83.7	Confident	8 Å²	8	30 Å²	30	4%	0.042	16%	0.163	C	C	.	.	H	α-helix	trans	-67.6	-36	174.4	-70.3	171.4	0	0	0	112.4	L284 I387 M388 E389 L394 S395 F415 L467 F471	L284-L391 HydrophobicContact CB-CD2 4.35Å; I387-L391 HydrophobicContact CG2-CD1 4.16Å; I387-L391 WeakPolarHBondContact O-CG 3.31Å; I387-L391 PolarHBondContact O-N 2.79Å; M388-L391 HydrophobicContact CE-CD1 4.34Å; M388-L391 HydrophobicContact SD-CD1 4.09Å; E389-L391 VanDerWaalsContact C-N 3.29Å; E389-L391 PolarHBondContact O-N 3.28Å; L391-L394 PolarHBondContact O-N 3Å; L391-S395 PolarHBondContact O-N 2.87Å; L391-F415 HydrophobicContact CD2-CE1 3.75Å; L391-F415 HydrophobicContact CD2-CZ 3.79Å; L391-F415 HydrophobicContact CG-CZ 4.33Å; L391-L467 HydrophobicContact CD2-CD2 4.48Å; L391-F471 HydrophobicContact CD2-CE2 3.82Å; L391-F471 HydrophobicContact CD2-CZ 3.76Å
392	R	83.6	Confident	82.2	Confident	70 Å²	70	36.7 Å²	36.7	26%	0.264	19%	0.193	S	C	.	.	H	α-helix	trans	-63.8	-46.4	174.5	-178.5	-176.9	69	86.2	2.1	111.3	M388 E389 L394 S395 E396	M388-R392 WeakPolarHBondContact O-CB 3.47Å; M388-R392 PolarHBondContact O-N 3.23Å; E389-R392 WeakPolarHBondContact O-CB 3.44Å; E389-R392 PolarHBondContact O-N 2.85Å; E389-R392 VanDerWaalsContact O-N 3.08Å; E389-R392 IonicContact OE1-CZ 2.96Å; E389-R392 IonicContact OE1-NE 2.65Å; E389-R392 IonicContact OE1-NH2 3.72Å; E389-R392 PolarHBondContact OE1-NH2 2.91Å; E389-R392 IonicContact OE2-CZ 2.73Å; E389-R392 IonicContact OE2-NE 2.74Å; E389-R392 PolarHBondContact OE2-NE 2.85Å; E389-R392 IonicContact OE2-NH2 3.38Å; E389-R392 PolarHBondContact OE2-NH2 3.27Å; E389-R392 VanDerWaalsContact OE2-NH2 3.12Å; R392-L394 VanDerWaalsContact C-N 3.3Å; R392-L394 PolarHBondContact O-N 2.88Å; R392-S395 WeakPolarHBondContact O-CB 3.18Å; R392-S395 PolarHBondContact O-N 3.44Å; R392-S395 VanDerWaalsContact O-N 3.11Å; R392-E396 IonicContact CZ-OE1 2.61Å; R392-E396 IonicContact NH1-OE1 2.71Å; R392-E396 PolarHBondContact NH1-OE1 2.91Å; R392-E396 IonicContact NH1-OE2 3.75Å; R392-E396 PolarHBondContact O-N 2.99Å
393	E	86.4	Confident	80.6	Confident	76 Å²	76	38.9 Å²	38.9	36%	0.355	21%	0.206	S	C	.	.	H	α-helix	trans	-58.3	-43.6	177.2	-70.6	178.7	180	0	0	111.5	E389 S395 E396 E397	E389-E393 PolarHBondContact O-N 3.19Å; E393-S395 PolarHBondContact O-N 3.28Å; E393-E396 PolarHBondContact O-N 3.33Å; E393-E397 WeakPolarHBondContact O-CG 3.35Å; E393-E397 PolarHBondContact O-N 3.5Å
394	L	85.8	Confident	79.8	Confident	2 Å²	2	39 Å²	39	1%	0.01	21%	0.206	C	C	.	.	H	α-helix	trans	-61	-44.2	173.8	174	61.8	0	0	0	112	L284 H390 L391 R392 E396 E397 L398 H411 I412 F415 F471	L284-L394 HydrophobicContact CD1-CB 4.42Å; L284-L394 HydrophobicContact CD1-CD2 3.45Å; L284-L394 VanDerWaalsContact CD1-CD2 3.45Å; L284-L394 HydrophobicContact CD1-CG 3.74Å; H390-L394 PolarHBondContact O-N 3.28Å; L391-L394 PolarHBondContact O-N 3Å; R392-L394 VanDerWaalsContact C-N 3.3Å; R392-L394 PolarHBondContact O-N 2.88Å; L394-E396 VanDerWaalsContact C-N 3.28Å; L394-E396 PolarHBondContact O-N 3.47Å; L394-E397 WeakPolarHBondContact O-CB 3.31Å; L394-E397 PolarHBondContact O-N 3.25Å; L394-L398 HydrophobicContact CD1-CD1 3.96Å; L394-L398 HydrophobicContact CD1-CD2 4.5Å; L394-L398 HydrophobicContact CD1-CG 4.08Å; L394-L398 HydrophobicContact CG-CD1 3.83Å; L394-L398 HydrophobicContact CG-CG 4.4Å; L394-L398 WeakPolarHBondContact O-CG 3.47Å; L394-L398 PolarHBondContact O-N 2.92Å; L394-H411 HydrophobicContact CD1-CB 4Å; L394-I412 HydrophobicContact CD1-CD1 4.34Å; L394-I412 HydrophobicContact CD2-CD1 3.99Å; L394-I412 HydrophobicContact CG-CD1 4.48Å; L394-F415 HydrophobicContact CB-CD2 4.05Å; L394-F415 HydrophobicContact CB-CE2 4.29Å; L394-F415 HydrophobicContact CB-CG 4.48Å; L394-F415 HydrophobicContact CD1-CB 4.15Å; L394-F415 HydrophobicContact CD2-CB 3.79Å; L394-F415 HydrophobicContact CD2-CD1 3.72Å; L394-F415 HydrophobicContact CD2-CD2 3.96Å; L394-F415 HydrophobicContact CD2-CE1 4.25Å; L394-F415 HydrophobicContact CD2-CE2 4.47Å; L394-F415 HydrophobicContact CD2-CG 3.55Å; L394-F415 HydrophobicContact CG-CB 4.49Å; L394-F415 HydrophobicContact CG-CD2 4.45Å; L394-F415 HydrophobicContact CG-CG 4.41Å; L394-F471 HydrophobicContact CD2-CE1 3.68Å; L394-F471 HydrophobicContact CD2-CZ 3.76Å
395	S	80.7	Confident	79.4	Confident	31 Å²	31	38.6 Å²	38.6	22%	0.217	20%	0.204	C	C	.	.	H	α-helix	trans	-58.7	-39.9	176.9	-173.3	0	0	0	0	112	L391 R392 E393 L398 G399	L391-S395 PolarHBondContact O-N 2.87Å; R392-S395 WeakPolarHBondContact O-CB 3.18Å; R392-S395 PolarHBondContact O-N 3.44Å; R392-S395 VanDerWaalsContact O-N 3.11Å; E393-S395 PolarHBondContact O-N 3.28Å; S395-L398 PolarHBondContact O-N 3.29Å; S395-G399 PolarHBondContact O-N 3.44Å
396	E	81.6	Confident	79.1	Confident	109 Å²	109	38.6 Å²	38.6	51%	0.509	21%	0.205	S	C	.	.	H	α-helix	trans	-64.9	-41.9	174.7	-70.8	174.9	-175.4	0	0	112.3	R392 E393 L394 L398 G399	R392-E396 IonicContact CZ-OE1 2.61Å; R392-E396 IonicContact NH1-OE1 2.71Å; R392-E396 PolarHBondContact NH1-OE1 2.91Å; R392-E396 IonicContact NH1-OE2 3.75Å; R392-E396 PolarHBondContact O-N 2.99Å; E393-E396 PolarHBondContact O-N 3.33Å; L394-E396 VanDerWaalsContact C-N 3.28Å; L394-E396 PolarHBondContact O-N 3.47Å; E396-L398 VanDerWaalsContact C-N 3.3Å; E396-L398 PolarHBondContact O-N 3.4Å; E396-G399 PolarHBondContact O-N 3.32Å
397	E	82.9	Confident	78.6	Confident	62 Å²	62	40.4 Å²	40.4	29%	0.29	22%	0.22	S	C	.	.	H	α-helix	trans	-60.4	-39	174.3	-71.1	179.2	-167.9	0	0	111.8	E393 L394 G399 H411 K418	E393-E397 WeakPolarHBondContact O-CG 3.35Å; E393-E397 PolarHBondContact O-N 3.5Å; L394-E397 WeakPolarHBondContact O-CB 3.31Å; L394-E397 PolarHBondContact O-N 3.25Å; E397-G399 VanDerWaalsContact C-N 3.29Å; E397-G399 PolarHBondContact O-N 3.05Å; E397-H411 IonicContact OE2-CE1 3.5Å; E397-H411 IonicContact OE2-CG 3.13Å; E397-H411 IonicContact OE2-ND1 3.56Å; E397-H411 PolarHBondContact OE2-ND1 3.26Å; E397-K418 IonicContact OE1-NZ 3.1Å
398	L	80.4	Confident	78.4	Confident	2 Å²	2	39.7 Å²	39.7	1%	0.01	22%	0.217	C	C	.	.	H	α-helix	trans	-72.8	-19.1	179.9	-64	165.6	0	0	0	113.3	F281 L284 L394 S395 E396 V400 A408 H411 I412	F281-L398 HydrophobicContact CB-CB 3.96Å; F281-L398 HydrophobicContact CB-CD1 3.88Å; F281-L398 HydrophobicContact CB-CG 4.36Å; F281-L398 HydrophobicContact CD1-CD1 3.91Å; F281-L398 HydrophobicContact CD1-CD2 3.79Å; F281-L398 HydrophobicContact CD1-CG 4.32Å; F281-L398 HydrophobicContact CE1-CD2 4.24Å; F281-L398 HydrophobicContact CG-CB 4.41Å; F281-L398 HydrophobicContact CG-CD1 4.29Å; F281-L398 HydrophobicContact CG-CD2 4.33Å; L284-L398 HydrophobicContact CD1-CD1 3.84Å; L394-L398 HydrophobicContact CD1-CD1 3.96Å; L394-L398 HydrophobicContact CD1-CD2 4.5Å; L394-L398 HydrophobicContact CD1-CG 4.08Å; L394-L398 HydrophobicContact CG-CD1 3.83Å; L394-L398 HydrophobicContact CG-CG 4.4Å; L394-L398 WeakPolarHBondContact O-CG 3.47Å; L394-L398 PolarHBondContact O-N 2.92Å; S395-L398 PolarHBondContact O-N 3.29Å; E396-L398 VanDerWaalsContact C-N 3.3Å; E396-L398 PolarHBondContact O-N 3.4Å; L398-V400 VanDerWaalsContact C-N 3.29Å; L398-V400 PolarHBondContact O-N 3.25Å; L398-A408 HydrophobicContact CD2-CB 3.78Å; L398-A408 WeakPolarHBondContact CD2-O 3.27Å; L398-H411 HydrophobicContact CD2-CB 3.96Å; L398-I412 HydrophobicContact CD1-CD1 3.77Å; L398-I412 HydrophobicContact CD2-CD1 4.21Å; L398-I412 HydrophobicContact CD2-CG1 4.19Å
399	G	68.6	Low	78.6	Confident	44 Å²	44	39.3 Å²	39.3	45%	0.454	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-7.5	178.7	0	0	0	0	0	115.3	S395 E396 E397	S395-G399 PolarHBondContact O-N 3.44Å; E396-G399 PolarHBondContact O-N 3.32Å; E397-G399 VanDerWaalsContact C-N 3.29Å; E397-G399 PolarHBondContact O-N 3.05Å
400	V	65.7	Low	78.6	Confident	116 Å²	116	42.1 Å²	42.1	70%	0.703	23%	0.23	S	C	*	.	S	Bend	trans	-98.7	-20.3	-171	-174.3	0	0	0	0	113.3	L398	L398-V400 VanDerWaalsContact C-N 3.29Å; L398-V400 PolarHBondContact O-N 3.25Å
401	S	58.3	Low	78.6	Confident	18 Å²	18	44 Å²	44	13%	0.126	24%	0.239	C	C	.	.			trans	-74.8	133.3	-173.1	-176.8	0	0	0	0	112.6	F404 D552	S401-F404 PolarHBondContact OG-O 2.94Å; S401-D552 WeakPolarHBondContact CB-O 3.31Å
402	K	58.7	Low	78.7	Confident	141 Å²	141	43.6 Å²	43.6	61%	0.613	24%	0.237	S	C	*	.			trans	-133.3	16.9	-176.2	-73.8	-160.2	173.5	-160.8	0	115.6
403	V	60.1	Low	79.1	Confident	45 Å²	45	41.1 Å²	41.1	27%	0.273	23%	0.23	S	C	.	.	S	Bend	trans	-132.1	-47.2	-179.7	-159	0	0	0	0	114	L525 D552	V403-L525 HydrophobicContact CG1-CB 3.71Å; V403-D552 PolarHBondContact N-OD2 2.68Å
404	F	74.3	Confident	79.4	Confident	6 Å²	6	40.9 Å²	40.9	3%	0.026	23%	0.234	C	C	.	.			trans	-150.4	152	177.3	-69.7	-62.2	0	0	0	112.6	S401 A406 A407 L525 Y529 V547 A548 D552	S401-F404 PolarHBondContact OG-O 2.94Å; F404-A406 PolarHBondContact O-N 3.44Å; F404-A407 PolarHBondContact O-N 2.98Å; F404-L525 HydrophobicContact CD2-CB 4.04Å; F404-L525 HydrophobicContact CD2-CD1 3.71Å; F404-L525 HydrophobicContact CE2-CB 3.57Å; F404-L525 HydrophobicContact CE2-CD1 4.04Å; F404-L525 HydrophobicContact CE2-CG 4.41Å; F404-Y529 AromaticContact CE2-CD2 3.9Å; F404-Y529 HydrophobicContact CE2-CD2 3.9Å; F404-Y529 AromaticContact CE2-CE2 3.86Å; F404-Y529 HydrophobicContact CE2-CE2 3.86Å; F404-Y529 AromaticContact CZ-CD2 3.79Å; F404-Y529 HydrophobicContact CZ-CD2 3.79Å; F404-Y529 HydrophobicContact CZ-CE2 4.06Å; F404-V547 HydrophobicContact CB-CG1 4.44Å; F404-V547 HydrophobicContact CD1-CB 4.29Å; F404-V547 HydrophobicContact CD1-CG1 3.67Å; F404-V547 HydrophobicContact CE1-CB 4.29Å; F404-V547 HydrophobicContact CE1-CG1 4.11Å; F404-V547 HydrophobicContact CG-CG1 4.2Å; F404-A548 HydrophobicContact CD1-CB 4.22Å; F404-A548 VanDerWaalsContact CE1-CA 3.44Å; F404-A548 HydrophobicContact CE1-CB 3.58Å; F404-D552 PolarHBondContact N-OD2 3.29Å
405	A	80.8	Confident	79.7	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-60.7	-14.9	178.3	0	0	0	0	0	114.2	A408 F409 L550 F551 D552	A405-A408 PolarHBondContact O-N 2.84Å; A405-F409 VanDerWaalsContact O-CB 3.3Å; A405-F409 WeakPolarHBondContact O-CB 3.46Å; A405-F409 PolarHBondContact O-N 3.04Å; A405-L550 HydrophobicContact CB-CB 3.9Å; A405-F551 WeakPolarHBondContact CB-O 3.45Å; A405-D552 HydrophobicContact CB-CB 4.5Å
406	A	83.3	Confident	80.2	Confident	4 Å²	4	40.6 Å²	40.6	3%	0.033	23%	0.229	C	C	.	.	H	α-helix	trans	-60.8	-45.4	178.2	0	0	0	0	0	113	F404 F409 D410 L485 S489	F404-A406 PolarHBondContact O-N 3.44Å; A406-F409 CarbonylContact O-C 3.57Å; A406-F409 PolarHBondContact O-N 3.33Å; A406-D410 PolarHBondContact O-N 3.06Å; A406-L485 HydrophobicContact CB-CB 3.85Å; A406-S489 WeakPolarHBondContact CB-OG 3.46Å
407	A	82.6	Confident	80.8	Confident	44 Å²	44	39.7 Å²	39.7	36%	0.364	23%	0.231	S	C	.	.	H	α-helix	trans	-64	-45.4	179.8	0	0	0	0	0	110.9	F404 F409 D410 H411	F404-A407 PolarHBondContact O-N 2.98Å; A407-F409 VanDerWaalsContact C-N 3.3Å; A407-F409 PolarHBondContact O-N 2.7Å; A407-D410 WeakPolarHBondContact O-CB 3.46Å; A407-D410 PolarHBondContact O-N 3.27Å; A407-H411 PolarHBondContact O-CD2 3.33Å; A407-H411 PolarHBondContact O-N 2.77Å
408	A	85.5	Confident	81.3	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-59.1	-42.6	173.5	0	0	0	0	0	111.7	F281 L398 A405 D410 H411 I412 D552	F281-A408 HydrophobicContact CD1-CB 4.46Å; F281-A408 HydrophobicContact CE1-CB 3.9Å; F281-A408 HydrophobicContact CE2-CB 4.01Å; F281-A408 HydrophobicContact CZ-CB 3.65Å; L398-A408 HydrophobicContact CD2-CB 3.78Å; L398-A408 WeakPolarHBondContact CD2-O 3.27Å; A405-A408 PolarHBondContact O-N 2.84Å; A408-D410 VanDerWaalsContact C-N 3.32Å; A408-D410 PolarHBondContact O-N 3.15Å; A408-H411 WeakPolarHBondContact O-CB 3.46Å; A408-H411 PolarHBondContact O-N 2.86Å; A408-I412 PolarHBondContact O-N 3.3Å; A408-I412 VanDerWaalsContact O-N 3.14Å; A408-D552 VanDerWaalsContact CB-O 3.31Å; A408-D552 WeakPolarHBondContact CB-O 3.42Å
409	F	88.1	Confident	82	Confident	2 Å²	2	39.7 Å²	39.7	1%	0.009	23%	0.23	C	C	.	.	H	α-helix	trans	-68.5	-28.2	178.1	-171.8	-123.7	0	0	0	113.5	A405 A406 A407 I412 C413 F475 L478 R479 K482 L485	A405-F409 VanDerWaalsContact O-CB 3.3Å; A405-F409 WeakPolarHBondContact O-CB 3.46Å; A405-F409 PolarHBondContact O-N 3.04Å; A406-F409 CarbonylContact O-C 3.57Å; A406-F409 PolarHBondContact O-N 3.33Å; A407-F409 VanDerWaalsContact C-N 3.3Å; A407-F409 PolarHBondContact O-N 2.7Å; F409-I412 HydrophobicContact CD2-CB 4.18Å; F409-I412 HydrophobicContact CD2-CG2 4.29Å; F409-I412 HydrophobicContact CE2-CG2 4.29Å; F409-I412 WeakPolarHBondContact O-CB 3.24Å; F409-I412 PolarHBondContact O-N 3.37Å; F409-C413 PolarHBondContact O-N 3.26Å; F409-C413 PolarHBondContact O-SG 2.95Å; F409-F475 HydrophobicContact CD2-CB 4.46Å; F409-F475 HydrophobicContact CE2-CB 3.85Å; F409-L478 HydrophobicContact CB-CD1 4.42Å; F409-L478 HydrophobicContact CD1-CB 4.39Å; F409-L478 HydrophobicContact CD2-CB 3.77Å; F409-L478 HydrophobicContact CD2-CD1 3.87Å; F409-L478 HydrophobicContact CE1-CB 4.35Å; F409-L478 HydrophobicContact CE2-CB 3.77Å; F409-L478 HydrophobicContact CG-CB 4.12Å; F409-L478 HydrophobicContact CG-CD1 4.29Å; F409-L478 HydrophobicContact CZ-CB 4.06Å; F409-R479 HydrophobicContact CZ-CB 3.85Å; F409-R479 HydrophobicContact CZ-CG 4.42Å; F409-K482 HydrophobicContact CD1-CG 4.43Å; F409-K482 HydrophobicContact CE1-CB 4.02Å; F409-K482 HydrophobicContact CE1-CD 3.96Å; F409-K482 HydrophobicContact CE1-CG 3.96Å; F409-L485 HydrophobicContact CB-CD1 4.44Å; F409-L485 HydrophobicContact CD1-CD1 4.06Å; F409-L485 HydrophobicContact CG-CD1 4.49Å
410	D	88.2	Confident	83.2	Confident	78 Å²	78	40.4 Å²	40.4	42%	0.417	22%	0.223	S	C	.	.	H	α-helix	trans	-67.3	-37.9	172.2	-76.8	-23.5	0	0	0	111.8	A406 A407 A408 C413 T414	A406-D410 PolarHBondContact O-N 3.06Å; A407-D410 WeakPolarHBondContact O-CB 3.46Å; A407-D410 PolarHBondContact O-N 3.27Å; A408-D410 VanDerWaalsContact C-N 3.32Å; A408-D410 PolarHBondContact O-N 3.15Å; D410-C413 PolarHBondContact O-N 3.19Å; D410-T414 WeakPolarHBondContact O-CB 3.33Å; D410-T414 PolarHBondContact O-N 2.93Å; D410-T414 PolarHBondContact O-OG1 2.98Å
411	H	88.9	Confident	84.6	Confident	65 Å²	65	38.4 Å²	38.4	30%	0.301	21%	0.208	S	C	.	.	H	α-helix	trans	-61.5	-44.3	171.2	-71.7	-72.8	0	0	0	111.4	L394 E397 L398 A407 A408 T414 F415	L394-H411 HydrophobicContact CD1-CB 4Å; E397-H411 IonicContact OE2-CE1 3.5Å; E397-H411 IonicContact OE2-CG 3.13Å; E397-H411 IonicContact OE2-ND1 3.56Å; E397-H411 PolarHBondContact OE2-ND1 3.26Å; L398-H411 HydrophobicContact CD2-CB 3.96Å; A407-H411 PolarHBondContact O-CD2 3.33Å; A407-H411 PolarHBondContact O-N 2.77Å; A408-H411 WeakPolarHBondContact O-CB 3.46Å; A408-H411 PolarHBondContact O-N 2.86Å; H411-T414 PolarHBondContact O-N 3.12Å; H411-F415 PolarHBondContact O-N 3.36Å
412	I	89.3	Confident	86.3	Confident	0 Å²	0	38 Å²	38	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-58	-51.1	173.4	-64.2	-61.2	0	0	0	111.3	F281 L394 L398 A408 F409 T414 F415 E416 F471 F475	F281-I412 HydrophobicContact CD1-CD1 4.44Å; F281-I412 HydrophobicContact CD1-CG1 4.44Å; F281-I412 HydrophobicContact CE1-CG1 4.24Å; L394-I412 HydrophobicContact CD1-CD1 4.34Å; L394-I412 HydrophobicContact CD2-CD1 3.99Å; L394-I412 HydrophobicContact CG-CD1 4.48Å; L398-I412 HydrophobicContact CD1-CD1 3.77Å; L398-I412 HydrophobicContact CD2-CD1 4.21Å; L398-I412 HydrophobicContact CD2-CG1 4.19Å; A408-I412 PolarHBondContact O-N 3.3Å; A408-I412 VanDerWaalsContact O-N 3.14Å; F409-I412 HydrophobicContact CD2-CB 4.18Å; F409-I412 HydrophobicContact CD2-CG2 4.29Å; F409-I412 HydrophobicContact CE2-CG2 4.29Å; F409-I412 WeakPolarHBondContact O-CB 3.24Å; F409-I412 PolarHBondContact O-N 3.37Å; I412-T414 VanDerWaalsContact C-N 3.27Å; I412-T414 PolarHBondContact O-N 2.9Å; I412-F415 WeakPolarHBondContact O-CB 3.37Å; I412-F415 PolarHBondContact O-N 3.23Å; I412-F415 VanDerWaalsContact O-N 3.16Å; I412-E416 WeakPolarHBondContact O-CG 3.45Å; I412-E416 PolarHBondContact O-N 3.13Å; I412-F471 HydrophobicContact CD1-CE1 4.05Å; I412-F471 HydrophobicContact CG2-CD1 4.02Å; I412-F471 HydrophobicContact CG2-CE1 4.44Å; I412-F475 HydrophobicContact CD1-CE1 4.25Å; I412-F475 HydrophobicContact CD1-CE2 3.81Å; I412-F475 HydrophobicContact CD1-CZ 3.65Å; I412-F475 HydrophobicContact CG1-CE1 4.26Å; I412-F475 HydrophobicContact CG1-CE2 4.29Å; I412-F475 HydrophobicContact CG1-CZ 4.11Å; I412-F475 HydrophobicContact CG2-CB 4.42Å; I412-F475 HydrophobicContact CG2-CD2 3.54Å; I412-F475 HydrophobicContact CG2-CE2 3.88Å; I412-F475 HydrophobicContact CG2-CG 3.91Å; I412-F475 HydrophobicContact CG2-CZ 4.48Å
413	C	90.7	Very high	88	Confident	18 Å²	18	33.2 Å²	33.2	12%	0.122	18%	0.184	C	C	.	.	H	α-helix	trans	-59.7	-39.2	178.6	-70.4	0	0	0	0	111.8	F409 D410 E416 V417 K482	F409-C413 PolarHBondContact O-N 3.26Å; F409-C413 PolarHBondContact O-SG 2.95Å; D410-C413 PolarHBondContact O-N 3.19Å; C413-E416 PolarHBondContact O-N 3.45Å; C413-V417 WeakPolarHBondContact O-CG2 3.07Å; C413-V417 PolarHBondContact O-N 2.99Å; C413-K482 PolarHBondContact SG-NZ 3.31Å; C413-K482 VanDerWaalsContact SG-NZ 3.43Å
414	T	92.6	Very high	89.6	Confident	72 Å²	72	38 Å²	38	44%	0.442	20%	0.197	S	C	.	.	H	α-helix	trans	-65.2	-41.7	177.6	-60.1	0	0	0	0	110.9	D410 H411 I412 V417 K418	D410-T414 WeakPolarHBondContact O-CB 3.33Å; D410-T414 PolarHBondContact O-N 2.93Å; D410-T414 PolarHBondContact O-OG1 2.98Å; H411-T414 PolarHBondContact O-N 3.12Å; I412-T414 VanDerWaalsContact C-N 3.27Å; I412-T414 PolarHBondContact O-N 2.9Å; T414-V417 WeakPolarHBondContact O-CB 3.46Å; T414-V417 PolarHBondContact O-N 3.16Å; T414-K418 PolarHBondContact O-N 2.88Å
415	F	91.7	Very high	90.6	Very high	6 Å²	6	39.8 Å²	39.8	3%	0.026	21%	0.206	C	C	.	.	H	α-helix	trans	-64.2	-40.3	175.8	-168.8	-101.2	0	0	0	112.5	H390 L391 L394 H411 I412 V417 K418 L419 F471	H390-F415 HydrophobicContact CB-CE2 3.95Å; H390-F415 HydrophobicContact CB-CZ 4.14Å; H390-F415 WeakPolarHBondContact O-CE2 3.44Å; L391-F415 HydrophobicContact CD2-CE1 3.75Å; L391-F415 HydrophobicContact CD2-CZ 3.79Å; L391-F415 HydrophobicContact CG-CZ 4.33Å; L394-F415 HydrophobicContact CB-CD2 4.05Å; L394-F415 HydrophobicContact CB-CE2 4.29Å; L394-F415 HydrophobicContact CB-CG 4.48Å; L394-F415 HydrophobicContact CD1-CB 4.15Å; L394-F415 HydrophobicContact CD2-CB 3.79Å; L394-F415 HydrophobicContact CD2-CD1 3.72Å; L394-F415 HydrophobicContact CD2-CD2 3.96Å; L394-F415 HydrophobicContact CD2-CE1 4.25Å; L394-F415 HydrophobicContact CD2-CE2 4.47Å; L394-F415 HydrophobicContact CD2-CG 3.55Å; L394-F415 HydrophobicContact CG-CB 4.49Å; L394-F415 HydrophobicContact CG-CD2 4.45Å; L394-F415 HydrophobicContact CG-CG 4.41Å; H411-F415 PolarHBondContact O-N 3.36Å; I412-F415 WeakPolarHBondContact O-CB 3.37Å; I412-F415 PolarHBondContact O-N 3.23Å; I412-F415 VanDerWaalsContact O-N 3.16Å; F415-V417 PolarHBondContact O-N 2.76Å; F415-K418 HydrophobicContact CD2-CD 4.29Å; F415-K418 CarbonylContact O-C 3.52Å; F415-K418 WeakPolarHBondContact O-CA 3.35Å; F415-K418 WeakPolarHBondContact O-CB 3.49Å; F415-K418 PolarHBondContact O-N 3.04Å; F415-L419 HydrophobicContact CD1-CD1 4.14Å; F415-L419 HydrophobicContact CD1-CD2 4.33Å; F415-L419 HydrophobicContact CD1-CG 4.04Å; F415-L419 HydrophobicContact CE1-CD1 4.03Å; F415-L419 HydrophobicContact CE1-CD2 3.68Å; F415-L419 HydrophobicContact CE1-CG 3.89Å; F415-L419 HydrophobicContact CZ-CD2 4.02Å; F415-L419 WeakPolarHBondContact O-CG 3.49Å; F415-L419 PolarHBondContact O-N 3.26Å; F415-F471 HydrophobicContact CD1-CD1 4.48Å; F415-F471 AromaticContact CD1-CE1 3.79Å; F415-F471 HydrophobicContact CD1-CE1 3.79Å; F415-F471 AromaticContact CD1-CE2 3.96Å; F415-F471 HydrophobicContact CD1-CE2 3.96Å; F415-F471 AromaticContact CD1-CZ 3.49Å; F415-F471 HydrophobicContact CD1-CZ 3.49Å; F415-F471 VanDerWaalsContact CD1-CZ 3.49Å; F415-F471 HydrophobicContact CE1-CE1 4.32Å; F415-F471 AromaticContact CE1-CE2 3.73Å; F415-F471 HydrophobicContact CE1-CE2 3.73Å; F415-F471 AromaticContact CE1-CZ 3.55Å; F415-F471 HydrophobicContact CE1-CZ 3.55Å
416	E	91.5	Very high	91.3	Very high	20 Å²	20	39.8 Å²	39.8	9%	0.093	21%	0.206	C	C	.	.	H	α-helix	trans	-58.5	-37.3	173.1	-69.1	-178.5	142.2	0	0	112	I412 C413 L419 N420 F471 R479	I412-E416 WeakPolarHBondContact O-CG 3.45Å; I412-E416 PolarHBondContact O-N 3.13Å; C413-E416 PolarHBondContact O-N 3.45Å; E416-L419 PolarHBondContact O-N 3.41Å; E416-N420 PolarHBondContact O-N 3.03Å; E416-N420 PolarHBondContact O-ND2 3.27Å; E416-F471 HydrophobicContact CG-CB 4.01Å; E416-F471 HydrophobicContact CG-CD1 4.33Å; E416-F471 HydrophobicContact CG-CG 4.41Å; E416-F471 WeakPolarHBondContact OE1-CB 3.46Å; E416-R479 IonicContact OE1-CZ 2.7Å; E416-R479 IonicContact OE1-NH2 2.78Å; E416-R479 PolarHBondContact OE1-NH2 3.07Å; E416-R479 IonicContact OE2-CZ 2.82Å; E416-R479 IonicContact OE2-NH2 2.68Å; E416-R479 PolarHBondContact OE2-NH2 3.44Å
417	V	94.3	Very high	91.7	Very high	90 Å²	90	45.9 Å²	45.9	55%	0.545	23%	0.233	S	C	.	.	H	α-helix	trans	-67.3	-41	172.2	177.7	0	0	0	0	111.2	C413 T414 F415 L419 N420 L421	C413-V417 WeakPolarHBondContact O-CG2 3.07Å; C413-V417 PolarHBondContact O-N 2.99Å; T414-V417 WeakPolarHBondContact O-CB 3.46Å; T414-V417 PolarHBondContact O-N 3.16Å; F415-V417 PolarHBondContact O-N 2.76Å; V417-L419 VanDerWaalsContact C-N 3.32Å; V417-L419 PolarHBondContact O-N 3.03Å; V417-N420 WeakPolarHBondContact O-CB 3.34Å; V417-N420 PolarHBondContact O-N 3.39Å; V417-N420 VanDerWaalsContact O-N 3.12Å; V417-L421 PolarHBondContact O-N 3.03Å
418	K	94.8	Very high	92.2	Very high	65 Å²	65	50 Å²	50	28%	0.283	25%	0.245	S	C	.	.	H	α-helix	trans	-58	-42.2	173.3	-68.9	179.6	179.6	176.3	0	111.6	E397 T414 F415 N420 L421 F422	E397-K418 IonicContact OE1-NZ 3.1Å; T414-K418 PolarHBondContact O-N 2.88Å; F415-K418 HydrophobicContact CD2-CD 4.29Å; F415-K418 CarbonylContact O-C 3.52Å; F415-K418 WeakPolarHBondContact O-CA 3.35Å; F415-K418 WeakPolarHBondContact O-CB 3.49Å; F415-K418 PolarHBondContact O-N 3.04Å; K418-N420 PolarHBondContact O-N 3.32Å; K418-L421 WeakPolarHBondContact O-CA 3.46Å; K418-L421 WeakPolarHBondContact O-CB 3.49Å; K418-L421 PolarHBondContact O-N 3.08Å; K418-F422 HydrophobicContact CB-CE2 4.44Å; K418-F422 HydrophobicContact CB-CZ 4.27Å; K418-F422 WeakPolarHBondContact O-CG 3.15Å; K418-F422 PolarHBondContact O-N 3.36Å
419	L	93.2	Very high	92.5	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-58.9	-34.8	176	-64.6	-179.7	0	0	0	112.6	F415 E416 V417 F422 Q423 I464 L467 Q468 F471	F415-L419 HydrophobicContact CD1-CD1 4.14Å; F415-L419 HydrophobicContact CD1-CD2 4.33Å; F415-L419 HydrophobicContact CD1-CG 4.04Å; F415-L419 HydrophobicContact CE1-CD1 4.03Å; F415-L419 HydrophobicContact CE1-CD2 3.68Å; F415-L419 HydrophobicContact CE1-CG 3.89Å; F415-L419 HydrophobicContact CZ-CD2 4.02Å; F415-L419 WeakPolarHBondContact O-CG 3.49Å; F415-L419 PolarHBondContact O-N 3.26Å; E416-L419 PolarHBondContact O-N 3.41Å; V417-L419 VanDerWaalsContact C-N 3.32Å; V417-L419 PolarHBondContact O-N 3.03Å; L419-F422 HydrophobicContact CD2-CD2 4.02Å; L419-F422 HydrophobicContact CD2-CE2 4.42Å; L419-F422 PolarHBondContact O-N 3.14Å; L419-Q423 WeakPolarHBondContact O-CG 3.37Å; L419-Q423 PolarHBondContact O-N 3.11Å; L419-Q423 VanDerWaalsContact O-N 3.11Å; L419-I464 HydrophobicContact CB-CG2 3.95Å; L419-I464 HydrophobicContact CD2-CG2 4.1Å; L419-I464 VanDerWaalsContact O-CG2 3.28Å; L419-I464 WeakPolarHBondContact O-CG2 3.39Å; L419-L467 HydrophobicContact CD1-CD2 4.34Å; L419-L467 HydrophobicContact CD1-CG 4.1Å; L419-L467 HydrophobicContact CD2-CD2 3.86Å; L419-L467 HydrophobicContact CD2-CG 4.49Å; L419-Q468 HydrophobicContact CD1-CB 4.09Å; L419-F471 HydrophobicContact CD1-CD2 4.17Å; L419-F471 HydrophobicContact CD1-CE2 4.5Å
420	N	93.9	Very high	92.8	Very high	59 Å²	59	58.8 Å²	58.8	32%	0.316	29%	0.286	S	S	.	.	H	α-helix	trans	-68.6	-36.2	173.8	-70.8	-73.4	0	0	0	112.2	E416 V417 K418 R424 Q468	E416-N420 PolarHBondContact O-N 3.03Å; E416-N420 PolarHBondContact O-ND2 3.27Å; V417-N420 WeakPolarHBondContact O-CB 3.34Å; V417-N420 PolarHBondContact O-N 3.39Å; V417-N420 VanDerWaalsContact O-N 3.12Å; K418-N420 PolarHBondContact O-N 3.32Å; N420-R424 PolarHBondContact O-N 2.68Å; N420-Q468 PolarHBondContact ND2-NE2 3.49Å; N420-Q468 PolarHBondContact OD1-NE2 3.03Å; N420-Q468 PolarHBondContact OD1-OE1 3.19Å
421	L	95.3	Very high	93.1	Very high	74 Å²	74	55.8 Å²	55.8	39%	0.387	27%	0.27	S	S	.	.	H	α-helix	trans	-66.7	-43.2	173.9	-64.8	173.8	0	0	0	111.1	V417 K418 Q423 R424 H425	V417-L421 PolarHBondContact O-N 3.03Å; K418-L421 WeakPolarHBondContact O-CA 3.46Å; K418-L421 WeakPolarHBondContact O-CB 3.49Å; K418-L421 PolarHBondContact O-N 3.08Å; L421-Q423 VanDerWaalsContact C-N 3.31Å; L421-Q423 PolarHBondContact O-N 3.2Å; L421-R424 WeakPolarHBondContact O-CB 3.39Å; L421-R424 PolarHBondContact O-N 2.94Å; L421-R424 VanDerWaalsContact O-N 3.11Å; L421-H425 PolarHBondContact O-N 3.39Å
422	F	95.6	Very high	93.4	Very high	9 Å²	9	56.9 Å²	56.9	4%	0.039	28%	0.281	C	S	.	.	H	α-helix	trans	-57.9	-41.1	176.1	-67.8	-11.8	0	0	0	112.5	H390 K418 L419 R424 H425 I426 D433 F434 I464	H390-F422 HydrophobicContact CB-CE2 4.23Å; H390-F422 AromaticContact CD2-CE2 3.7Å; H390-F422 AromaticContact CD2-CZ 3.74Å; H390-F422 AromaticContact CE1-CZ 3.52Å; H390-F422 AromaticContact CG-CE2 3.75Å; H390-F422 AromaticContact CG-CZ 3.74Å; H390-F422 AromaticContact ND1-CZ 3.57Å; H390-F422 AromaticContact NE2-CZ 3.61Å; K418-F422 HydrophobicContact CB-CE2 4.44Å; K418-F422 HydrophobicContact CB-CZ 4.27Å; K418-F422 WeakPolarHBondContact O-CG 3.15Å; K418-F422 PolarHBondContact O-N 3.36Å; L419-F422 HydrophobicContact CD2-CD2 4.02Å; L419-F422 HydrophobicContact CD2-CE2 4.42Å; L419-F422 PolarHBondContact O-N 3.14Å; F422-R424 PolarHBondContact O-N 3.44Å; F422-H425 PolarHBondContact O-N 2.97Å; F422-I426 WeakPolarHBondContact O-CG1 3.46Å; F422-I426 PolarHBondContact O-N 3.14Å; F422-D433 HydrophobicContact CD1-CB 3.96Å; F422-D433 HydrophobicContact CE1-CB 3.67Å; F422-F434 HydrophobicContact CB-CE2 4.32Å; F422-F434 HydrophobicContact CB-CZ 3.89Å; F422-F434 HydrophobicContact CG-CZ 4.08Å; F422-I464 HydrophobicContact CB-CD1 3.98Å; F422-I464 HydrophobicContact CB-CG2 4.39Å
423	Q	93.5	Very high	93.6	Very high	40 Å²	40	59.1 Å²	59.1	19%	0.187	29%	0.293	C	S	.	.	H	α-helix	trans	-59.1	-45.2	174.4	-75.1	172.9	54.5	0	0	112.3	L419 L421 I426 E427 Q461 I464	L419-Q423 WeakPolarHBondContact O-CG 3.37Å; L419-Q423 PolarHBondContact O-N 3.11Å; L419-Q423 VanDerWaalsContact O-N 3.11Å; L421-Q423 VanDerWaalsContact C-N 3.31Å; L421-Q423 PolarHBondContact O-N 3.2Å; Q423-I426 PolarHBondContact O-N 2.92Å; Q423-E427 PolarHBondContact O-N 3.13Å; Q423-Q461 PolarHBondContact O-NE2 3.11Å; Q423-Q461 VanDerWaalsContact O-NE2 3.16Å; Q423-I464 HydrophobicContact CG-CB 3.78Å; Q423-I464 HydrophobicContact CG-CD1 4.39Å; Q423-I464 HydrophobicContact CG-CG2 3.58Å
424	R	94.8	Very high	93.9	Very high	145 Å²	145	58.2 Å²	58.2	55%	0.547	29%	0.287	S	S	.	.	H	α-helix	trans	-65.1	-44.4	177.2	-68	179.7	-177.9	150.4	3	112	N420 L421 F422 I426 E427 E428	N420-R424 PolarHBondContact O-N 2.68Å; L421-R424 WeakPolarHBondContact O-CB 3.39Å; L421-R424 PolarHBondContact O-N 2.94Å; L421-R424 VanDerWaalsContact O-N 3.11Å; F422-R424 PolarHBondContact O-N 3.44Å; R424-I426 VanDerWaalsContact C-N 3.33Å; R424-I426 PolarHBondContact O-N 3.4Å; R424-E427 WeakPolarHBondContact O-CA 3.48Å; R424-E427 WeakPolarHBondContact O-CB 3.41Å; R424-E427 PolarHBondContact O-N 2.88Å; R424-E427 VanDerWaalsContact O-N 3.09Å; R424-E428 WeakPolarHBondContact O-CG 3.48Å; R424-E428 PolarHBondContact O-N 2.99Å
425	H	94.9	Very high	94.1	Very high	45 Å²	45	57.7 Å²	57.7	21%	0.208	29%	0.285	C	S	.	.	H	α-helix	trans	-61.7	-41.7	178.4	-71.5	175.4	0	0	0	111.7	L421 F422 E427 E428 K429 N430 D433	L421-H425 PolarHBondContact O-N 3.39Å; F422-H425 PolarHBondContact O-N 2.97Å; H425-E427 PolarHBondContact O-N 3.39Å; H425-E428 CarbonylContact O-C 3.6Å; H425-E428 PolarHBondContact O-N 3.24Å; H425-K429 PolarHBondContact O-N 3.47Å; H425-K429 VanDerWaalsContact O-N 3.14Å; H425-N430 CarbonylContact C-O 3.25Å; H425-N430 HydrophobicContact CB-CB 4.27Å; H425-N430 WeakPolarHBondContact CB-O 3.16Å; H425-N430 WeakPolarHBondContact O-CA 3.44Å; H425-N430 WeakPolarHBondContact O-CB 3.42Å; H425-N430 PolarHBondContact O-N 3.07Å; H425-D433 IonicContact CE1-OD2 3.01Å; H425-D433 PolarHBondContact CE1-OD2 3.18Å; H425-D433 IonicContact CG-OD2 3.97Å; H425-D433 IonicContact ND1-OD2 3.44Å; H425-D433 PolarHBondContact ND1-OD2 3.39Å
426	I	94.3	Very high	94.3	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-62.3	-41.8	172.4	-68.5	-64.7	0	0	0	111.4	F422 Q423 R424 E428 K429 L431 F434 L437 P457 Q461 I464	F422-I426 WeakPolarHBondContact O-CG1 3.46Å; F422-I426 PolarHBondContact O-N 3.14Å; Q423-I426 PolarHBondContact O-N 2.92Å; R424-I426 VanDerWaalsContact C-N 3.33Å; R424-I426 PolarHBondContact O-N 3.4Å; I426-E428 VanDerWaalsContact C-N 3.32Å; I426-E428 PolarHBondContact O-N 3.22Å; I426-K429 WeakPolarHBondContact O-CA 3.49Å; I426-K429 PolarHBondContact O-N 3.05Å; I426-L431 HydrophobicContact CD1-CD2 4.08Å; I426-F434 HydrophobicContact CD1-CD2 3.77Å; I426-F434 HydrophobicContact CD1-CE1 4.43Å; I426-F434 HydrophobicContact CD1-CE2 3.58Å; I426-F434 HydrophobicContact CD1-CG 4.27Å; I426-F434 HydrophobicContact CD1-CZ 3.93Å; I426-F434 HydrophobicContact CG1-CD2 4.35Å; I426-F434 HydrophobicContact CG1-CE2 3.66Å; I426-F434 HydrophobicContact CG1-CZ 3.87Å; I426-L437 HydrophobicContact CD1-CD2 4.35Å; I426-P457 HydrophobicContact CG2-CB 3.85Å; I426-P457 VanDerWaalsContact CG2-O 3.24Å; I426-P457 WeakPolarHBondContact CG2-O 3.41Å; I426-Q461 HydrophobicContact CB-CG 4.21Å; I426-Q461 HydrophobicContact CG2-CG 3.77Å; I426-I464 HydrophobicContact CG1-CD1 3.96Å
427	E	92.7	Very high	94.5	Very high	131 Å²	131	56.8 Å²	56.8	61%	0.612	28%	0.282	S	S	*	.	H	α-helix	trans	-55.4	-48	176.1	-156.3	176.2	167	0	0	111.8	Q423 R424 H425 K429 Q461	Q423-E427 PolarHBondContact O-N 3.13Å; R424-E427 WeakPolarHBondContact O-CA 3.48Å; R424-E427 WeakPolarHBondContact O-CB 3.41Å; R424-E427 PolarHBondContact O-N 2.88Å; R424-E427 VanDerWaalsContact O-N 3.09Å; H425-E427 PolarHBondContact O-N 3.39Å; E427-K429 PolarHBondContact O-N 2.89Å; E427-Q461 VanDerWaalsContact CG-NE2 3.35Å
428	E	93.3	Very high	94.6	Very high	132 Å²	132	57.6 Å²	57.6	62%	0.617	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	0.2	-179.9	-66.1	172.2	177.5	0	0	112.5	R424 H425 I426 N430	R424-E428 WeakPolarHBondContact O-CG 3.48Å; R424-E428 PolarHBondContact O-N 2.99Å; H425-E428 CarbonylContact O-C 3.6Å; H425-E428 PolarHBondContact O-N 3.24Å; I426-E428 VanDerWaalsContact C-N 3.32Å; I426-E428 PolarHBondContact O-N 3.22Å; E428-N430 HydrophobicContact CB-CB 4.32Å; E428-N430 PolarHBondContact O-N 2.87Å
429	K	91.9	Very high	94.7	Very high	135 Å²	135	58.6 Å²	58.6	59%	0.587	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.8	26.5	-171.8	-55	178.9	-178.9	-180	0	113	H425 I426 E427 L431 F455 P457	H425-K429 PolarHBondContact O-N 3.47Å; H425-K429 VanDerWaalsContact O-N 3.14Å; I426-K429 WeakPolarHBondContact O-CA 3.49Å; I426-K429 PolarHBondContact O-N 3.05Å; E427-K429 PolarHBondContact O-N 2.89Å; K429-L431 PolarHBondContact O-N 3.39Å; K429-F455 HydrophobicContact CB-CZ 4.38Å; K429-F455 HydrophobicContact CG-CZ 4.43Å; K429-P457 HydrophobicContact CG-CG 4.13Å
430	N	93.9	Very high	94.7	Very high	51 Å²	51	58.7 Å²	58.7	27%	0.273	28%	0.281	S	S	.	.			trans	-84.8	106.2	174.5	179.2	3.1	0	0	0	109.6	H425 E428 T432	H425-N430 CarbonylContact C-O 3.25Å; H425-N430 HydrophobicContact CB-CB 4.27Å; H425-N430 WeakPolarHBondContact CB-O 3.16Å; H425-N430 WeakPolarHBondContact O-CA 3.44Å; H425-N430 WeakPolarHBondContact O-CB 3.42Å; H425-N430 PolarHBondContact O-N 3.07Å; E428-N430 HydrophobicContact CB-CB 4.32Å; E428-N430 PolarHBondContact O-N 2.87Å; N430-T432 VanDerWaalsContact C-N 3.32Å; N430-T432 PolarHBondContact O-N 2.88Å; N430-T432 VanDerWaalsContact OD1-CB 3.26Å; N430-T432 WeakPolarHBondContact OD1-CB 3.5Å; N430-T432 PolarHBondContact OD1-N 3.45Å; N430-T432 VanDerWaalsContact OD1-N 3.08Å; N430-T432 PolarHBondContact OD1-OG1 3.05Å
431	L	95.1	Very high	94.7	Very high	15 Å²	15	56 Å²	56	8%	0.079	27%	0.267	C	S	.	.			trans	-94.8	25.5	-178.7	-56	180	0	0	0	113	I426 K429 D433 F434 L437 R438 V441 F455	I426-L431 HydrophobicContact CD1-CD2 4.08Å; K429-L431 PolarHBondContact O-N 3.39Å; L431-D433 VanDerWaalsContact C-N 3.32Å; L431-D433 PolarHBondContact O-N 3.45Å; L431-F434 HydrophobicContact CB-CB 4.37Å; L431-F434 HydrophobicContact CD2-CB 4.37Å; L431-F434 CarbonylContact O-C 3.56Å; L431-F434 PolarHBondContact O-N 2.81Å; L431-F434 VanDerWaalsContact O-N 3.12Å; L431-L437 HydrophobicContact CD1-CG 4.21Å; L431-L437 HydrophobicContact CD2-CD2 3.73Å; L431-L437 HydrophobicContact CD2-CG 4.18Å; L431-R438 HydrophobicContact CB-CB 3.81Å; L431-R438 HydrophobicContact CB-CG 4.25Å; L431-R438 HydrophobicContact CD1-CB 4.18Å; L431-V441 HydrophobicContact CD1-CB 4.1Å; L431-V441 HydrophobicContact CD1-CG1 4.26Å; L431-V441 HydrophobicContact CD1-CG2 3.95Å; L431-F455 HydrophobicContact CD1-CE1 4.01Å; L431-F455 HydrophobicContact CD1-CZ 4.38Å; L431-F455 HydrophobicContact CD2-CE1 4.31Å; L431-F455 HydrophobicContact CD2-CE2 4.43Å; L431-F455 HydrophobicContact CD2-CZ 3.83Å; L431-F455 HydrophobicContact CG-CE1 4.49Å; L431-F455 HydrophobicContact CG-CZ 4.4Å
432	T	94.3	Very high	94.6	Very high	87 Å²	87	55.4 Å²	55.4	53%	0.534	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-41	-178.1	-63.1	0	0	0	0	112.2	N430 F434	N430-T432 VanDerWaalsContact C-N 3.32Å; N430-T432 PolarHBondContact O-N 2.88Å; N430-T432 VanDerWaalsContact OD1-CB 3.26Å; N430-T432 WeakPolarHBondContact OD1-CB 3.5Å; N430-T432 PolarHBondContact OD1-N 3.45Å; N430-T432 VanDerWaalsContact OD1-N 3.08Å; N430-T432 PolarHBondContact OD1-OG1 3.05Å; T432-F434 VanDerWaalsContact C-N 3.27Å; T432-F434 PolarHBondContact O-N 3.22Å
433	D	94.4	Very high	94.4	Very high	47 Å²	47	57 Å²	57	25%	0.251	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	3.7	177.5	-58.4	-41.3	0	0	0	113.5	H390 F422 H425 L431 P435	H390-D433 PolarHBondContact NE2-O 3.02Å; F422-D433 HydrophobicContact CD1-CB 3.96Å; F422-D433 HydrophobicContact CE1-CB 3.67Å; H425-D433 IonicContact CE1-OD2 3.01Å; H425-D433 PolarHBondContact CE1-OD2 3.18Å; H425-D433 IonicContact CG-OD2 3.97Å; H425-D433 IonicContact ND1-OD2 3.44Å; H425-D433 PolarHBondContact ND1-OD2 3.39Å; L431-D433 VanDerWaalsContact C-N 3.32Å; L431-D433 PolarHBondContact O-N 3.45Å; D433-P435 VanDerWaalsContact C-CD 3.43Å; D433-P435 WeakPolarHBondContact O-CD 2.87Å
434	F	96.4	Very high	94.3	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	27%	0.265	C	S	.	.			trans	-127.6	63.9	-175.5	-61	-83	0	0	0	110.9	F383 D386 I387 F422 I426 L431 T432 A436 L437 R438 I464	F383-F434 AromaticContact CD2-CD1 3.99Å; F383-F434 HydrophobicContact CD2-CD1 3.99Å; F383-F434 AromaticContact CD2-CE1 3.88Å; F383-F434 HydrophobicContact CD2-CE1 3.88Å; F383-F434 HydrophobicContact CE2-CD1 4.17Å; F383-F434 AromaticContact CE2-CE1 3.57Å; F383-F434 HydrophobicContact CE2-CE1 3.57Å; F383-F434 HydrophobicContact CE2-CZ 4.2Å; D386-F434 HydrophobicContact CB-CB 4.44Å; D386-F434 HydrophobicContact CB-CD1 3.75Å; D386-F434 VanDerWaalsContact CG-CA 3.48Å; D386-F434 WeakPolarHBondContact OD2-CA 3.48Å; D386-F434 WeakPolarHBondContact OD2-CB 3.32Å; I387-F434 HydrophobicContact CD1-CE1 4.01Å; F422-F434 HydrophobicContact CB-CE2 4.32Å; F422-F434 HydrophobicContact CB-CZ 3.89Å; F422-F434 HydrophobicContact CG-CZ 4.08Å; I426-F434 HydrophobicContact CD1-CD2 3.77Å; I426-F434 HydrophobicContact CD1-CE1 4.43Å; I426-F434 HydrophobicContact CD1-CE2 3.58Å; I426-F434 HydrophobicContact CD1-CG 4.27Å; I426-F434 HydrophobicContact CD1-CZ 3.93Å; I426-F434 HydrophobicContact CG1-CD2 4.35Å; I426-F434 HydrophobicContact CG1-CE2 3.66Å; I426-F434 HydrophobicContact CG1-CZ 3.87Å; L431-F434 HydrophobicContact CB-CB 4.37Å; L431-F434 HydrophobicContact CD2-CB 4.37Å; L431-F434 CarbonylContact O-C 3.56Å; L431-F434 PolarHBondContact O-N 2.81Å; L431-F434 VanDerWaalsContact O-N 3.12Å; T432-F434 VanDerWaalsContact C-N 3.27Å; T432-F434 PolarHBondContact O-N 3.22Å; F434-A436 PolarHBondContact O-N 3.21Å; F434-L437 HydrophobicContact CB-CB 4.01Å; F434-L437 HydrophobicContact CB-CD2 4.44Å; F434-L437 PolarHBondContact O-N 2.97Å; F434-R438 VanDerWaalsContact O-CB 3.28Å; F434-R438 WeakPolarHBondContact O-CB 3.43Å; F434-R438 PolarHBondContact O-N 3.08Å; F434-I464 HydrophobicContact CZ-CD1 4.14Å
435	P	96.8	Very high	94	Very high	60 Å²	60	53.4 Å²	53.4	39%	0.39	26%	0.26	S	S	.	.	H	α-helix	trans	-61.8	-37.5	-174.1	24.5	-34.8	0	0	0	113.8	D386 D433 R438 E439	D386-P435 WeakPolarHBondContact OD1-CD 3.48Å; D386-P435 WeakPolarHBondContact OD1-CG 3.18Å; D433-P435 VanDerWaalsContact C-CD 3.43Å; D433-P435 WeakPolarHBondContact O-CD 2.87Å; P435-R438 PolarHBondContact O-N 2.98Å; P435-E439 PolarHBondContact O-N 2.8Å
436	A	96.2	Very high	93.6	Very high	7 Å²	7	58.4 Å²	58.4	6%	0.058	28%	0.283	C	S	.	.	H	α-helix	trans	-70.1	-45.7	178.7	0	0	0	0	0	111	F352 G382 V385 D386 F434 R438 E439 V440	F352-A436 HydrophobicContact CD1-CB 4Å; F352-A436 HydrophobicContact CE1-CB 3.44Å; F352-A436 VanDerWaalsContact CE1-CB 3.44Å; F352-A436 HydrophobicContact CE2-CB 4.13Å; F352-A436 HydrophobicContact CZ-CB 3.53Å; F352-A436 VanDerWaalsContact CZ-O 3.24Å; F352-A436 WeakPolarHBondContact CZ-O 3.41Å; G382-A436 WeakPolarHBondContact O-CB 3.32Å; V385-A436 HydrophobicContact CB-CB 3.95Å; V385-A436 HydrophobicContact CG1-CB 3.8Å; D386-A436 VanDerWaalsContact OD1-CB 3.24Å; D386-A436 WeakPolarHBondContact OD1-CB 3.49Å; D386-A436 PolarHBondContact OD1-N 3.29Å; D386-A436 PolarHBondContact OD2-N 3.32Å; F434-A436 PolarHBondContact O-N 3.21Å; A436-R438 VanDerWaalsContact C-N 3.3Å; A436-R438 PolarHBondContact O-N 3.5Å; A436-E439 WeakPolarHBondContact O-CB 3.29Å; A436-E439 PolarHBondContact O-N 3.31Å; A436-V440 PolarHBondContact O-N 3.34Å
437	L	95.6	Very high	93.1	Very high	0 Å²	0	65 Å²	65	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-60.1	-41.7	172.6	177.9	57.7	0	0	0	111.5	C379 F383 D386 I426 L431 F434 E439 V440 V441 Y460	C379-L437 HydrophobicContact CB-CD1 3.79Å; C379-L437 WeakPolarHBondContact O-CD1 3.27Å; F383-L437 HydrophobicContact CB-CD2 4.27Å; F383-L437 HydrophobicContact CD2-CD2 4.25Å; D386-L437 PolarHBondContact OD2-N 3.09Å; I426-L437 HydrophobicContact CD1-CD2 4.35Å; L431-L437 HydrophobicContact CD1-CG 4.21Å; L431-L437 HydrophobicContact CD2-CD2 3.73Å; L431-L437 HydrophobicContact CD2-CG 4.18Å; F434-L437 HydrophobicContact CB-CB 4.01Å; F434-L437 HydrophobicContact CB-CD2 4.44Å; F434-L437 PolarHBondContact O-N 2.97Å; L437-E439 VanDerWaalsContact C-N 3.34Å; L437-E439 PolarHBondContact O-N 3.21Å; L437-V440 PolarHBondContact O-N 2.87Å; L437-V441 HydrophobicContact CD1-CG2 3.94Å; L437-V441 HydrophobicContact CG-CG2 4.27Å; L437-V441 WeakPolarHBondContact O-CB 3.24Å; L437-V441 VanDerWaalsContact O-CG2 3.24Å; L437-V441 WeakPolarHBondContact O-CG2 3.45Å; L437-V441 PolarHBondContact O-N 2.97Å; L437-Y460 HydrophobicContact CD1-CE2 4.24Å; L437-Y460 HydrophobicContact CD2-CD2 4.07Å; L437-Y460 HydrophobicContact CD2-CE2 3.96Å
438	R	96.1	Very high	92.5	Very high	108 Å²	108	61.9 Å²	61.9	41%	0.408	30%	0.301	S	S	.	.	H	α-helix	trans	-58.7	-45.3	176.8	-175.7	176.8	64.1	-161.7	-4	111.8	L431 F434 P435 A436 V441 D442	L431-R438 HydrophobicContact CB-CB 3.81Å; L431-R438 HydrophobicContact CB-CG 4.25Å; L431-R438 HydrophobicContact CD1-CB 4.18Å; F434-R438 VanDerWaalsContact O-CB 3.28Å; F434-R438 WeakPolarHBondContact O-CB 3.43Å; F434-R438 PolarHBondContact O-N 3.08Å; P435-R438 PolarHBondContact O-N 2.98Å; A436-R438 VanDerWaalsContact C-N 3.3Å; A436-R438 PolarHBondContact O-N 3.5Å; R438-V441 PolarHBondContact O-N 3.47Å; R438-D442 WeakPolarHBondContact O-CB 3.46Å; R438-D442 PolarHBondContact O-N 3.22Å
439	E	96.1	Very high	91.4	Very high	86 Å²	86	64.6 Å²	64.6	40%	0.402	31%	0.311	S	S	.	.	H	α-helix	trans	-56.3	-51.3	177.3	-173	-173.2	128	0	0	111.2	R355 P435 A436 L437 V441 D442 E443	R355-E439 IonicContact CZ-OE1 2.75Å; R355-E439 IonicContact NH1-OE1 3.23Å; R355-E439 PolarHBondContact NH1-OE1 3.49Å; R355-E439 IonicContact NH2-OE1 3.1Å; R355-E439 PolarHBondContact NH2-OE1 3.26Å; P435-E439 PolarHBondContact O-N 2.8Å; A436-E439 WeakPolarHBondContact O-CB 3.29Å; A436-E439 PolarHBondContact O-N 3.31Å; L437-E439 VanDerWaalsContact C-N 3.34Å; L437-E439 PolarHBondContact O-N 3.21Å; E439-V441 PolarHBondContact O-N 3.33Å; E439-D442 PolarHBondContact O-N 3.26Å; E439-E443 WeakPolarHBondContact O-CG 3.32Å; E439-E443 PolarHBondContact O-N 2.93Å
440	V	94.7	Very high	90.4	Very high	2 Å²	2	67.2 Å²	67.2	1%	0.012	33%	0.326	C	S	.	.	H	α-helix	trans	-60.2	-46	177.5	169.3	0	0	0	0	111.4	F352 L378 A436 L437 D442 E443 L444	F352-V440 HydrophobicContact CE2-CG2 3.77Å; F352-V440 HydrophobicContact CZ-CG2 3.76Å; L378-V440 HydrophobicContact CB-CG1 3.68Å; A436-V440 PolarHBondContact O-N 3.34Å; L437-V440 PolarHBondContact O-N 2.87Å; V440-D442 VanDerWaalsContact C-N 3.3Å; V440-D442 PolarHBondContact O-N 3.27Å; V440-E443 PolarHBondContact O-N 3.22Å; V440-L444 HydrophobicContact CG1-CD1 3.79Å; V440-L444 HydrophobicContact CG1-CG 4.25Å; V440-L444 WeakPolarHBondContact O-CB 3.28Å; V440-L444 VanDerWaalsContact O-CG 3.3Å; V440-L444 WeakPolarHBondContact O-CG 3.5Å; V440-L444 PolarHBondContact O-N 3.43Å
441	V	93.4	Very high	89.4	Confident	2 Å²	2	67.3 Å²	67.3	1%	0.012	33%	0.326	C	S	.	.	H	α-helix	trans	-61.2	-42.2	-178.9	166.8	0	0	0	0	110.8	L431 L437 R438 E439 L444 K445 I454 F455	L431-V441 HydrophobicContact CD1-CB 4.1Å; L431-V441 HydrophobicContact CD1-CG1 4.26Å; L431-V441 HydrophobicContact CD1-CG2 3.95Å; L437-V441 HydrophobicContact CD1-CG2 3.94Å; L437-V441 HydrophobicContact CG-CG2 4.27Å; L437-V441 WeakPolarHBondContact O-CB 3.24Å; L437-V441 VanDerWaalsContact O-CG2 3.24Å; L437-V441 WeakPolarHBondContact O-CG2 3.45Å; L437-V441 PolarHBondContact O-N 2.97Å; R438-V441 PolarHBondContact O-N 3.47Å; E439-V441 PolarHBondContact O-N 3.33Å; V441-L444 PolarHBondContact O-N 3.3Å; V441-K445 HydrophobicContact CG1-CD 4.42Å; V441-K445 VanDerWaalsContact O-CG 3.31Å; V441-K445 WeakPolarHBondContact O-CG 3.19Å; V441-K445 PolarHBondContact O-N 2.5Å; V441-I454 HydrophobicContact CB-CG2 4.29Å; V441-I454 HydrophobicContact CG1-CG2 4.15Å; V441-I454 HydrophobicContact CG2-CG2 4.08Å; V441-F455 HydrophobicContact CG1-CD1 4.41Å; V441-F455 HydrophobicContact CG2-CD1 3.59Å; V441-F455 HydrophobicContact CG2-CE1 4.17Å; V441-F455 HydrophobicContact CG2-CG 4.35Å
442	D	92.5	Very high	88.1	Confident	61 Å²	61	75.7 Å²	75.7	33%	0.326	37%	0.365	S	S	.	.	H	α-helix	trans	-71.6	-36.3	179.5	-69.3	-20.2	0	0	0	112.2	R438 E439 V440 K445 Q446	R438-D442 WeakPolarHBondContact O-CB 3.46Å; R438-D442 PolarHBondContact O-N 3.22Å; E439-D442 PolarHBondContact O-N 3.26Å; V440-D442 VanDerWaalsContact C-N 3.3Å; V440-D442 PolarHBondContact O-N 3.27Å; D442-K445 PolarHBondContact O-N 3.49Å; D442-K445 IonicContact OD1-NZ 3.39Å; D442-K445 PolarHBondContact OD1-NZ 2.82Å; D442-K445 VanDerWaalsContact OD1-NZ 3.1Å; D442-Q446 VanDerWaalsContact O-CG 3.3Å; D442-Q446 WeakPolarHBondContact O-CG 3.32Å; D442-Q446 PolarHBondContact O-N 3.21Å; D442-Q446 VanDerWaalsContact O-N 3.16Å
443	E	92	Very high	87.3	Confident	43 Å²	43	78.1 Å²	78.1	20%	0.201	37%	0.368	C	S	.	.	H	α-helix	trans	-60.2	-46.2	170.4	-72.4	-176.8	145.7	0	0	111.3	R355 K356 E439 V440 Q446 Q447	R355-E443 IonicContact NH2-OE2 2.93Å; R355-E443 PolarHBondContact NH2-OE2 2.96Å; K356-E443 VanDerWaalsContact CE-OE1 3.23Å; K356-E443 WeakPolarHBondContact CE-OE1 3.26Å; K356-E443 IonicContact NZ-OE1 2.68Å; K356-E443 PolarHBondContact NZ-OE1 3.47Å; E439-E443 WeakPolarHBondContact O-CG 3.32Å; E439-E443 PolarHBondContact O-N 2.93Å; V440-E443 PolarHBondContact O-N 3.22Å; E443-Q446 PolarHBondContact O-N 2.86Å; E443-Q447 WeakPolarHBondContact O-CG 3.49Å; E443-Q447 PolarHBondContact O-N 3.14Å; E443-Q447 VanDerWaalsContact O-N 3.16Å
444	L	90.3	Very high	86.7	Confident	8 Å²	8	76.8 Å²	76.8	4%	0.042	36%	0.36	C	S	.	.	H	α-helix	trans	-67.7	-35.8	179.2	-70.2	177.3	0	0	0	112.7	K375 V440 V441 Q446 Q447 N448 I454	K375-L444 HydrophobicContact CB-CD1 4.02Å; K375-L444 HydrophobicContact CG-CD1 4.26Å; K375-L444 HydrophobicContact CG-CD2 4.07Å; V440-L444 HydrophobicContact CG1-CD1 3.79Å; V440-L444 HydrophobicContact CG1-CG 4.25Å; V440-L444 WeakPolarHBondContact O-CB 3.28Å; V440-L444 VanDerWaalsContact O-CG 3.3Å; V440-L444 WeakPolarHBondContact O-CG 3.5Å; V440-L444 PolarHBondContact O-N 3.43Å; V441-L444 PolarHBondContact O-N 3.3Å; L444-Q446 VanDerWaalsContact C-N 3.31Å; L444-Q446 PolarHBondContact O-N 2.81Å; L444-Q447 PolarHBondContact O-N 3.26Å; L444-N448 PolarHBondContact O-N 3.41Å; L444-I454 HydrophobicContact CB-CG2 3.79Å; L444-I454 HydrophobicContact CD1-CG2 3.79Å; L444-I454 HydrophobicContact CG-CG2 4.45Å
445	K	89	Confident	86.3	Confident	102 Å²	102	77.8 Å²	77.8	44%	0.443	37%	0.365	S	S	.	.	H	α-helix	trans	-60.2	-40.9	172.2	-77.1	175.2	-166.7	152.9	0	111.9	V441 D442 Q447 N448 K449 I454	V441-K445 HydrophobicContact CG1-CD 4.42Å; V441-K445 VanDerWaalsContact O-CG 3.31Å; V441-K445 WeakPolarHBondContact O-CG 3.19Å; V441-K445 PolarHBondContact O-N 2.5Å; D442-K445 PolarHBondContact O-N 3.49Å; D442-K445 IonicContact OD1-NZ 3.39Å; D442-K445 PolarHBondContact OD1-NZ 2.82Å; D442-K445 VanDerWaalsContact OD1-NZ 3.1Å; K445-Q447 VanDerWaalsContact C-N 3.34Å; K445-N448 CarbonylContact O-C 3.59Å; K445-K449 PolarHBondContact O-N 2.84Å; K445-I454 HydrophobicContact CB-CD1 4Å; K445-I454 HydrophobicContact CD-CD1 4.2Å; K445-I454 HydrophobicContact CG-CD1 3.06Å
446	Q	87.3	Confident	85.9	Confident	149 Å²	149	76.9 Å²	76.9	70%	0.696	36%	0.357	S	S	*	.	H	α-helix	trans	-67.8	-37.9	-179.6	-70.8	173.2	24.4	0	0	111.5	D442 E443 L444	D442-Q446 VanDerWaalsContact O-CG 3.3Å; D442-Q446 WeakPolarHBondContact O-CG 3.32Å; D442-Q446 PolarHBondContact O-N 3.21Å; D442-Q446 VanDerWaalsContact O-N 3.16Å; E443-Q446 PolarHBondContact O-N 2.86Å; L444-Q446 VanDerWaalsContact C-N 3.31Å; L444-Q446 PolarHBondContact O-N 2.81Å
447	Q	83.9	Confident	85.6	Confident	140 Å²	140	77.3 Å²	77.3	65%	0.654	36%	0.359	S	S	*	.	H	α-helix	trans	-76.1	-38.5	178.7	-66.5	174.5	5.9	0	0	113	E443 L444 K445	E443-Q447 WeakPolarHBondContact O-CG 3.49Å; E443-Q447 PolarHBondContact O-N 3.14Å; E443-Q447 VanDerWaalsContact O-N 3.16Å; L444-Q447 PolarHBondContact O-N 3.26Å; K445-Q447 VanDerWaalsContact C-N 3.34Å
448	N	78.6	Confident	85.3	Confident	64 Å²	64	82.1 Å²	82.1	34%	0.342	39%	0.385	S	S	.	.			trans	-126.7	73.1	-173.4	-66.6	-63.3	0	0	0	111.7	K375 L444 K445 E450 D451	K375-N448 VanDerWaalsContact CE-ND2 3.28Å; K375-N448 WeakPolarHBondContact CE-ND2 3.4Å; L444-N448 PolarHBondContact O-N 3.41Å; K445-N448 CarbonylContact O-C 3.59Å; N448-E450 PolarHBondContact O-N 3.12Å; N448-D451 HydrophobicContact CB-CB 4.1Å; N448-D451 PolarHBondContact O-N 3.01Å; N448-D451 VanDerWaalsContact O-N 3.1Å
449	K	71.5	Confident	84.8	Confident	189 Å²	189	80.6 Å²	80.6	82%	0.822	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-21.4	-175	-67.3	-177.1	179.7	178	0	115.4	K445	K445-K449 PolarHBondContact O-N 2.84Å
450	E	70.6	Confident	84.5	Confident	191 Å²	191	76.5 Å²	76.5	89%	0.893	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	-10.6	-178.2	-61.6	-169	166.3	0	0	113.6	N448 Q452	N448-E450 PolarHBondContact O-N 3.12Å; E450-Q452 PolarHBondContact O-N 3.07Å
451	D	73.1	Confident	84.3	Confident	53 Å²	53	78.3 Å²	78.3	28%	0.283	37%	0.368	S	S	.	.			trans	-84.2	106.7	-176.8	-166	-11	0	0	0	111.1	K375 N448 K453	K375-D451 IonicContact NZ-OD2 2.65Å; K375-D451 PolarHBondContact NZ-OD2 2.68Å; N448-D451 HydrophobicContact CB-CB 4.1Å; N448-D451 PolarHBondContact O-N 3.01Å; N448-D451 VanDerWaalsContact O-N 3.1Å; D451-K453 VanDerWaalsContact C-N 3.35Å; D451-K453 PolarHBondContact OD1-N 3.42Å
452	Q	66.5	Low	84	Confident	191 Å²	191	83 Å²	83	89%	0.893	39%	0.391	S	S	*	.	S	Bend	trans	-81.9	-12.5	179.5	-65.7	-176.8	2.1	0	0	113.2	E450	E450-Q452 PolarHBondContact O-N 3.07Å
453	K	78.3	Confident	83.7	Confident	138 Å²	138	80.8 Å²	80.8	60%	0.6	38%	0.38	S	S	*	.			trans	-122.8	69.7	-176.6	-160	-178.7	-177.9	-175	0	111.2	D451 D456	D451-K453 VanDerWaalsContact C-N 3.35Å; D451-K453 PolarHBondContact OD1-N 3.42Å; K453-D456 WeakPolarHBondContact CE-OD1 3.34Å; K453-D456 IonicContact NZ-OD1 3.93Å; K453-D456 PolarHBondContact NZ-OD1 2.97Å
454	I	82.8	Confident	83.5	Confident	18 Å²	18	78.8 Å²	78.8	9%	0.092	37%	0.37	C	S	.	.	S	Bend	trans	-71.2	-33.9	-178.4	-64	175.8	0	0	0	112.7	V441 L444 K445	V441-I454 HydrophobicContact CB-CG2 4.29Å; V441-I454 HydrophobicContact CG1-CG2 4.15Å; V441-I454 HydrophobicContact CG2-CG2 4.08Å; L444-I454 HydrophobicContact CB-CG2 3.79Å; L444-I454 HydrophobicContact CD1-CG2 3.79Å; L444-I454 HydrophobicContact CG-CG2 4.45Å; K445-I454 HydrophobicContact CB-CD1 4Å; K445-I454 HydrophobicContact CD-CD1 4.2Å; K445-I454 HydrophobicContact CG-CD1 3.06Å
455	F	86.9	Confident	83.5	Confident	21 Å²	21	80.4 Å²	80.4	9%	0.092	38%	0.382	C	S	.	.	S	Bend	trans	-143	163.4	173.2	78.4	-88.1	0	0	0	110.7	C379 K429 L431 V441 P457 Y460	C379-F455 HydrophobicContact CB-CB 4.19Å; K429-F455 HydrophobicContact CB-CZ 4.38Å; K429-F455 HydrophobicContact CG-CZ 4.43Å; L431-F455 HydrophobicContact CD1-CE1 4.01Å; L431-F455 HydrophobicContact CD1-CZ 4.38Å; L431-F455 HydrophobicContact CD2-CE1 4.31Å; L431-F455 HydrophobicContact CD2-CE2 4.43Å; L431-F455 HydrophobicContact CD2-CZ 3.83Å; L431-F455 HydrophobicContact CG-CE1 4.49Å; L431-F455 HydrophobicContact CG-CZ 4.4Å; V441-F455 HydrophobicContact CG1-CD1 4.41Å; V441-F455 HydrophobicContact CG2-CD1 3.59Å; V441-F455 HydrophobicContact CG2-CE1 4.17Å; V441-F455 HydrophobicContact CG2-CG 4.35Å; F455-P457 HydrophobicContact CD2-CG 4.38Å; F455-P457 HydrophobicContact CE2-CB 4.37Å; F455-P457 HydrophobicContact CE2-CG 3.85Å; F455-P457 HydrophobicContact CZ-CG 4.41Å; F455-P457 WeakPolarHBondContact O-CD 3.2Å; F455-Y460 HydrophobicContact CB-CE2 3.98Å; F455-Y460 AromaticContact CD2-CD2 3.68Å; F455-Y460 HydrophobicContact CD2-CD2 3.68Å; F455-Y460 AromaticContact CD2-CE2 3.52Å; F455-Y460 HydrophobicContact CD2-CE2 3.52Å; F455-Y460 HydrophobicContact CE2-CD2 4.16Å; F455-Y460 HydrophobicContact CE2-CE2 4.39Å; F455-Y460 HydrophobicContact CG-CE2 4.1Å
456	D	87.6	Confident	83.3	Confident	42 Å²	42	79.4 Å²	79.4	23%	0.225	38%	0.375	C	S	.	.			trans	-106.8	105.2	-178.3	-164.7	37.1	0	0	0	111	K453 D458 R459	K453-D456 WeakPolarHBondContact CE-OD1 3.34Å; K453-D456 IonicContact NZ-OD1 3.93Å; K453-D456 PolarHBondContact NZ-OD1 2.97Å; D456-D458 VanDerWaalsContact C-N 3.31Å; D456-D458 PolarHBondContact O-N 3.28Å; D456-R459 HydrophobicContact CB-CB 4.13Å; D456-R459 WeakPolarHBondContact O-CB 3.31Å; D456-R459 PolarHBondContact O-N 3.03Å
457	P	90.1	Very high	83.2	Confident	15 Å²	15	72.8 Å²	72.8	10%	0.097	35%	0.345	C	S	.	.	H	α-helix	trans	-56.7	-41.4	-179.8	-28.3	36.5	0	0	0	113.7	I426 K429 F455 R459 Y460 Q461	I426-P457 HydrophobicContact CG2-CB 3.85Å; I426-P457 VanDerWaalsContact CG2-O 3.24Å; I426-P457 WeakPolarHBondContact CG2-O 3.41Å; K429-P457 HydrophobicContact CG-CG 4.13Å; F455-P457 HydrophobicContact CD2-CG 4.38Å; F455-P457 HydrophobicContact CE2-CB 4.37Å; F455-P457 HydrophobicContact CE2-CG 3.85Å; F455-P457 HydrophobicContact CZ-CG 4.41Å; F455-P457 WeakPolarHBondContact O-CD 3.2Å; P457-R459 VanDerWaalsContact C-N 3.26Å; P457-R459 PolarHBondContact O-N 3.49Å; P457-Y460 PolarHBondContact O-N 3Å; P457-Y460 VanDerWaalsContact O-N 3.12Å; P457-Q461 WeakPolarHBondContact O-CG 3.14Å; P457-Q461 PolarHBondContact O-N 3.09Å
458	D	89.1	Confident	83.4	Confident	102 Å²	102	67.5 Å²	67.5	55%	0.545	32%	0.32	S	S	.	.	H	α-helix	trans	-60.4	-38	-176.5	-62.1	-20.5	0	0	0	111.7	D456 M462	D456-D458 VanDerWaalsContact C-N 3.31Å; D456-D458 PolarHBondContact O-N 3.28Å; D458-M462 WeakPolarHBondContact O-CB 3.25Å; D458-M462 PolarHBondContact O-N 3.36Å
459	R	87.3	Confident	83.8	Confident	76 Å²	76	70.3 Å²	70.3	29%	0.287	33%	0.329	S	S	.	.	H	α-helix	trans	-59.6	-48.3	175.4	-178.5	177.7	176.4	73.1	-3.3	111.4	D380 D456 P457 M462 V463	D380-R459 IonicContact OD1-NE 2.79Å; D380-R459 PolarHBondContact OD1-NE 3.3Å; D380-R459 IonicContact OD2-CZ 2.73Å; D380-R459 IonicContact OD2-NE 3.38Å; D380-R459 PolarHBondContact OD2-NE 2.93Å; D380-R459 VanDerWaalsContact OD2-NE 3.1Å; D380-R459 IonicContact OD2-NH2 3.31Å; D380-R459 PolarHBondContact OD2-NH2 3.43Å; D456-R459 HydrophobicContact CB-CB 4.13Å; D456-R459 WeakPolarHBondContact O-CB 3.31Å; D456-R459 PolarHBondContact O-N 3.03Å; P457-R459 VanDerWaalsContact C-N 3.26Å; P457-R459 PolarHBondContact O-N 3.49Å; R459-M462 PolarHBondContact O-N 3.45Å; R459-V463 VanDerWaalsContact O-CG2 3.31Å; R459-V463 WeakPolarHBondContact O-CG2 3.25Å; R459-V463 PolarHBondContact O-N 3.19Å
460	Y	89.2	Confident	84.5	Confident	0 Å²	0	63 Å²	63	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-73.5	-36.4	-178.7	-61.5	-43.4	0	0	0	112.7	Q376 C379 D380 F383 L437 F455 P457 M462 V463 I464	Q376-Y460 PolarHBondContact NE2-OH 2.94Å; C379-Y460 WeakPolarHBondContact CB-OH 3.09Å; D380-Y460 PolarHBondContact N-OH 2.62Å; D380-Y460 WeakPolarHBondContact OD1-CE1 3.44Å; D380-Y460 PolarHBondContact OD1-OH 3.07Å; F383-Y460 HydrophobicContact CB-CD1 3.94Å; F383-Y460 HydrophobicContact CB-CE1 3.75Å; F383-Y460 AromaticContact CD1-CD1 3.51Å; F383-Y460 HydrophobicContact CD1-CD1 3.51Å; F383-Y460 AromaticContact CD1-CE1 3.95Å; F383-Y460 HydrophobicContact CD1-CE1 3.95Å; F383-Y460 HydrophobicContact CD1-CG 4.34Å; F383-Y460 AromaticContact CD2-CD1 3.73Å; F383-Y460 HydrophobicContact CD2-CD1 3.73Å; F383-Y460 HydrophobicContact CD2-CD2 4.34Å; F383-Y460 HydrophobicContact CD2-CE1 4.4Å; F383-Y460 AromaticContact CD2-CG 3.75Å; F383-Y460 HydrophobicContact CD2-CG 3.75Å; F383-Y460 AromaticContact CE1-CD1 3.9Å; F383-Y460 HydrophobicContact CE1-CD1 3.9Å; F383-Y460 HydrophobicContact CE2-CD1 4.1Å; F383-Y460 AromaticContact CE2-CG 3.99Å; F383-Y460 HydrophobicContact CE2-CG 3.99Å; F383-Y460 AromaticContact CG-CD1 3.41Å; F383-Y460 HydrophobicContact CG-CD1 3.41Å; F383-Y460 VanDerWaalsContact CG-CD1 3.41Å; F383-Y460 AromaticContact CG-CE1 3.76Å; F383-Y460 HydrophobicContact CG-CE1 3.76Å; F383-Y460 AromaticContact CG-CG 3.93Å; F383-Y460 HydrophobicContact CG-CG 3.93Å; F383-Y460 HydrophobicContact CZ-CD1 4.18Å; F383-Y460 HydrophobicContact CZ-CG 4.38Å; L437-Y460 HydrophobicContact CD1-CE2 4.24Å; L437-Y460 HydrophobicContact CD2-CD2 4.07Å; L437-Y460 HydrophobicContact CD2-CE2 3.96Å; F455-Y460 HydrophobicContact CB-CE2 3.98Å; F455-Y460 AromaticContact CD2-CD2 3.68Å; F455-Y460 HydrophobicContact CD2-CD2 3.68Å; F455-Y460 AromaticContact CD2-CE2 3.52Å; F455-Y460 HydrophobicContact CD2-CE2 3.52Å; F455-Y460 HydrophobicContact CE2-CD2 4.16Å; F455-Y460 HydrophobicContact CE2-CE2 4.39Å; F455-Y460 HydrophobicContact CG-CE2 4.1Å; P457-Y460 PolarHBondContact O-N 3Å; P457-Y460 VanDerWaalsContact O-N 3.12Å; Y460-M462 VanDerWaalsContact C-N 3.28Å; Y460-M462 PolarHBondContact O-N 3.27Å; Y460-V463 WeakPolarHBondContact O-CB 3.26Å; Y460-V463 PolarHBondContact O-N 3.42Å; Y460-I464 WeakPolarHBondContact O-CG1 3.47Å; Y460-I464 PolarHBondContact O-N 3.47Å
461	Q	90.1	Very high	85.3	Confident	40 Å²	40	54 Å²	54	19%	0.187	26%	0.256	C	S	.	.	H	α-helix	trans	-58.2	-42.3	171.2	-74.7	-176	-7.6	0	0	112.2	Q423 I426 E427 P457 V463 I464 C465	Q423-Q461 PolarHBondContact O-NE2 3.11Å; Q423-Q461 VanDerWaalsContact O-NE2 3.16Å; I426-Q461 HydrophobicContact CB-CG 4.21Å; I426-Q461 HydrophobicContact CG2-CG 3.77Å; E427-Q461 VanDerWaalsContact CG-NE2 3.35Å; P457-Q461 WeakPolarHBondContact O-CG 3.14Å; P457-Q461 PolarHBondContact O-N 3.09Å; Q461-V463 VanDerWaalsContact C-N 3.26Å; Q461-V463 PolarHBondContact O-N 3.32Å; Q461-I464 PolarHBondContact O-N 2.99Å; Q461-C465 VanDerWaalsContact O-CB 3.25Å; Q461-C465 WeakPolarHBondContact O-CB 3.33Å; Q461-C465 PolarHBondContact O-N 3.08Å
462	M	87.3	Confident	86	Confident	101 Å²	101	55.4 Å²	55.4	50%	0.498	26%	0.261	S	S	.	.	H	α-helix	trans	-61	-38.1	178.4	-164	172.4	-50.5	0	0	111.8	D291 D458 R459 Y460 R466	D291-M462 WeakPolarHBondContact OD2-CG 3.36Å; D458-M462 WeakPolarHBondContact O-CB 3.25Å; D458-M462 PolarHBondContact O-N 3.36Å; R459-M462 PolarHBondContact O-N 3.45Å; Y460-M462 VanDerWaalsContact C-N 3.28Å; Y460-M462 PolarHBondContact O-N 3.27Å; M462-R466 WeakPolarHBondContact O-CG 3.34Å; M462-R466 PolarHBondContact O-N 3.31Å
463	V	85.5	Confident	87	Confident	13 Å²	13	52.8 Å²	52.8	8%	0.079	24%	0.243	C	C	.	.	H	α-helix	trans	-67.1	-46.4	176.5	-178.8	0	0	0	0	111.2	V292 F383 R459 Y460 Q461 C465 R466 L467	V292-V463 HydrophobicContact CB-CG2 3.9Å; V292-V463 HydrophobicContact CG2-CB 4.43Å; V292-V463 HydrophobicContact CG2-CG2 3.2Å; F383-V463 HydrophobicContact CE1-CB 4Å; F383-V463 HydrophobicContact CE1-CG1 3.77Å; F383-V463 HydrophobicContact CE1-CG2 4.47Å; F383-V463 HydrophobicContact CZ-CB 4.3Å; F383-V463 HydrophobicContact CZ-CG1 4.32Å; R459-V463 VanDerWaalsContact O-CG2 3.31Å; R459-V463 WeakPolarHBondContact O-CG2 3.25Å; R459-V463 PolarHBondContact O-N 3.19Å; Y460-V463 WeakPolarHBondContact O-CB 3.26Å; Y460-V463 PolarHBondContact O-N 3.42Å; Q461-V463 VanDerWaalsContact C-N 3.26Å; Q461-V463 PolarHBondContact O-N 3.32Å; V463-C465 VanDerWaalsContact C-N 3.34Å; V463-C465 PolarHBondContact O-N 3.15Å; V463-R466 PolarHBondContact O-N 3.47Å; V463-L467 PolarHBondContact O-N 2.84Å
464	I	89.3	Confident	87.4	Confident	1 Å²	1	46.6 Å²	46.6	1%	0.005	22%	0.216	C	C	.	.	H	α-helix	trans	-64	-42.2	178.5	-58.9	162.9	0	0	0	110.5	F383 I387 L419 F422 Q423 I426 F434 Y460 Q461 R466 L467 Q468	F383-I464 HydrophobicContact CE2-CD1 4.16Å; F383-I464 HydrophobicContact CE2-CG1 4.27Å; F383-I464 HydrophobicContact CZ-CD1 4.23Å; F383-I464 HydrophobicContact CZ-CG1 3.84Å; I387-I464 HydrophobicContact CD1-CG1 4.34Å; L419-I464 HydrophobicContact CB-CG2 3.95Å; L419-I464 HydrophobicContact CD2-CG2 4.1Å; L419-I464 VanDerWaalsContact O-CG2 3.28Å; L419-I464 WeakPolarHBondContact O-CG2 3.39Å; F422-I464 HydrophobicContact CB-CD1 3.98Å; F422-I464 HydrophobicContact CB-CG2 4.39Å; Q423-I464 HydrophobicContact CG-CB 3.78Å; Q423-I464 HydrophobicContact CG-CD1 4.39Å; Q423-I464 HydrophobicContact CG-CG2 3.58Å; I426-I464 HydrophobicContact CG1-CD1 3.96Å; F434-I464 HydrophobicContact CZ-CD1 4.14Å; Y460-I464 WeakPolarHBondContact O-CG1 3.47Å; Y460-I464 PolarHBondContact O-N 3.47Å; Q461-I464 PolarHBondContact O-N 2.99Å; I464-R466 VanDerWaalsContact C-N 3.29Å; I464-R466 PolarHBondContact O-N 3.22Å; I464-L467 PolarHBondContact O-N 3.3Å; I464-Q468 WeakPolarHBondContact O-CB 3.39Å; I464-Q468 PolarHBondContact O-N 2.63Å
465	C	88.9	Confident	87.7	Confident	42 Å²	42	45.8 Å²	45.8	28%	0.284	21%	0.212	S	C	.	.	H	α-helix	trans	-60.2	-39.1	176	177.1	0	0	0	0	111.8	Q461 V463 Q468 K469	Q461-C465 VanDerWaalsContact O-CB 3.25Å; Q461-C465 WeakPolarHBondContact O-CB 3.33Å; Q461-C465 PolarHBondContact O-N 3.08Å; V463-C465 VanDerWaalsContact C-N 3.34Å; V463-C465 PolarHBondContact O-N 3.15Å; C465-Q468 PolarHBondContact O-N 2.87Å; C465-K469 WeakPolarHBondContact O-CG 3.5Å; C465-K469 PolarHBondContact O-N 3.43Å
466	R	84.9	Confident	87.9	Confident	81 Å²	81	51.5 Å²	51.5	31%	0.306	24%	0.237	S	C	.	.	H	α-helix	trans	-68.7	-44	173.9	-77.3	-178.7	172.4	-165	6.6	112.6	S289 D291 M462 V463 I464 Q468 K469 E470	S289-R466 WeakPolarHBondContact OG-CD 3.45Å; D291-R466 IonicContact OD1-CZ 3.82Å; D291-R466 IonicContact OD1-NE 3.66Å; D291-R466 IonicContact OD1-NH1 3.67Å; D291-R466 PolarHBondContact OD1-NH1 3.42Å; D291-R466 IonicContact OD1-NH2 2.69Å; D291-R466 PolarHBondContact OD1-NH2 3.45Å; D291-R466 IonicContact OD2-CZ 3.61Å; D291-R466 IonicContact OD2-NE 2.8Å; D291-R466 PolarHBondContact OD2-NE 2.92Å; D291-R466 IonicContact OD2-NH1 3.32Å; D291-R466 PolarHBondContact OD2-NH1 3.48Å; D291-R466 VanDerWaalsContact OD2-NH1 3.17Å; D291-R466 IonicContact OD2-NH2 3.83Å; D291-R466 PolarHBondContact OD2-NH2 3.12Å; M462-R466 WeakPolarHBondContact O-CG 3.34Å; M462-R466 PolarHBondContact O-N 3.31Å; V463-R466 PolarHBondContact O-N 3.47Å; I464-R466 VanDerWaalsContact C-N 3.29Å; I464-R466 PolarHBondContact O-N 3.22Å; R466-Q468 PolarHBondContact O-N 3.43Å; R466-K469 WeakPolarHBondContact O-CB 3.27Å; R466-K469 PolarHBondContact O-N 2.88Å; R466-K469 VanDerWaalsContact O-N 3.13Å; R466-E470 WeakPolarHBondContact O-CG 3.36Å; R466-E470 PolarHBondContact O-N 3.26Å
467	L	86.1	Confident	88.1	Confident	10 Å²	10	51 Å²	51	5%	0.052	23%	0.234	C	C	.	.	H	α-helix	trans	-56.2	-44.1	174.6	-176.6	59.4	0	0	0	110.4	L287 I387 L391 L419 V463 I464 K469 E470 F471	L287-L467 HydrophobicContact CB-CD1 3.91Å; L287-L467 HydrophobicContact CD1-CD1 4.29Å; I387-L467 HydrophobicContact CG2-CD2 4Å; L391-L467 HydrophobicContact CD2-CD2 4.48Å; L419-L467 HydrophobicContact CD1-CD2 4.34Å; L419-L467 HydrophobicContact CD1-CG 4.1Å; L419-L467 HydrophobicContact CD2-CD2 3.86Å; L419-L467 HydrophobicContact CD2-CG 4.49Å; V463-L467 PolarHBondContact O-N 2.84Å; I464-L467 PolarHBondContact O-N 3.3Å; L467-K469 PolarHBondContact O-N 2.98Å; L467-E470 WeakPolarHBondContact O-CA 3.36Å; L467-E470 WeakPolarHBondContact O-CB 3.43Å; L467-E470 PolarHBondContact O-N 2.99Å; L467-E470 VanDerWaalsContact O-N 3.11Å; L467-F471 HydrophobicContact CD1-CD2 3.97Å; L467-F471 HydrophobicContact CD1-CE2 3.76Å; L467-F471 HydrophobicContact CG-CD2 4.03Å; L467-F471 HydrophobicContact CG-CE2 3.97Å; L467-F471 WeakPolarHBondContact O-CD2 3.37Å; L467-F471 PolarHBondContact O-N 2.63Å
468	Q	88.1	Confident	88.1	Confident	29 Å²	29	50.3 Å²	50.3	14%	0.136	23%	0.229	C	C	.	.	H	α-helix	trans	-59	-46.2	175	-175.6	177.9	-3.4	0	0	112.5	L419 N420 I464 C465 R466 E470 F471 E472	L419-Q468 HydrophobicContact CD1-CB 4.09Å; N420-Q468 PolarHBondContact ND2-NE2 3.49Å; N420-Q468 PolarHBondContact OD1-NE2 3.03Å; N420-Q468 PolarHBondContact OD1-OE1 3.19Å; I464-Q468 WeakPolarHBondContact O-CB 3.39Å; I464-Q468 PolarHBondContact O-N 2.63Å; C465-Q468 PolarHBondContact O-N 2.87Å; R466-Q468 PolarHBondContact O-N 3.43Å; Q468-E470 VanDerWaalsContact C-N 3.26Å; Q468-E470 PolarHBondContact O-N 3.21Å; Q468-F471 PolarHBondContact O-N 3.35Å; Q468-E472 WeakPolarHBondContact O-CG 3.26Å; Q468-E472 PolarHBondContact O-N 3.44Å
469	K	87.6	Confident	88.2	Confident	124 Å²	124	49.4 Å²	49.4	54%	0.539	22%	0.218	S	C	.	.	H	α-helix	trans	-61	-35.6	174.4	-72	175.2	-177.6	176.2	0	112.5	C465 R466 L467 E472 R473	C465-K469 WeakPolarHBondContact O-CG 3.5Å; C465-K469 PolarHBondContact O-N 3.43Å; R466-K469 WeakPolarHBondContact O-CB 3.27Å; R466-K469 PolarHBondContact O-N 2.88Å; R466-K469 VanDerWaalsContact O-N 3.13Å; L467-K469 PolarHBondContact O-N 2.98Å; K469-E472 PolarHBondContact O-N 2.95Å; K469-R473 WeakPolarHBondContact O-CB 3.34Å; K469-R473 PolarHBondContact O-N 3.29Å
470	E	85.3	Confident	88.3	Confident	36 Å²	36	54.1 Å²	54.1	17%	0.168	24%	0.241	C	C	.	.	H	α-helix	trans	-66.1	-46.7	175.3	-72.6	-56.1	144.3	0	0	111.4	L287 R466 L467 Q468 E472 R473 H474	L287-E470 HydrophobicContact CD2-CB 4.43Å; R466-E470 WeakPolarHBondContact O-CG 3.36Å; R466-E470 PolarHBondContact O-N 3.26Å; L467-E470 WeakPolarHBondContact O-CA 3.36Å; L467-E470 WeakPolarHBondContact O-CB 3.43Å; L467-E470 PolarHBondContact O-N 2.99Å; L467-E470 VanDerWaalsContact O-N 3.11Å; Q468-E470 VanDerWaalsContact C-N 3.26Å; Q468-E470 PolarHBondContact O-N 3.21Å; E470-E472 VanDerWaalsContact C-N 3.31Å; E470-E472 PolarHBondContact O-N 2.9Å; E470-R473 WeakPolarHBondContact O-CB 3.44Å; E470-R473 PolarHBondContact O-N 2.98Å; E470-R473 IonicContact OE1-CZ 3.62Å; E470-R473 IonicContact OE1-NE 2.86Å; E470-R473 IonicContact OE1-NH2 2.92Å; E470-R473 PolarHBondContact OE1-NH2 3.2Å; E470-R473 IonicContact OE2-CZ 3.7Å; E470-R473 IonicContact OE2-NE 3.62Å; E470-R473 PolarHBondContact OE2-NE 3.45Å; E470-R473 IonicContact OE2-NH2 2.72Å; E470-R473 PolarHBondContact OE2-NH2 2.85Å; E470-H474 WeakPolarHBondContact O-CB 3.49Å; E470-H474 PolarHBondContact O-N 3.12Å; E470-H474 PolarHBondContact O-ND1 3.3Å; E470-H474 IonicContact OE2-CE1 2.65Å; E470-H474 PolarHBondContact OE2-CE1 2.85Å; E470-H474 IonicContact OE2-ND1 3.74Å; E470-H474 PolarHBondContact OE2-ND1 3.45Å
471	F	87.4	Confident	88.3	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-56.3	-45.5	171.5	-90.3	-96.6	0	0	0	111.9	L284 L287 L391 L394 I412 F415 E416 L419 L467 Q468 R473 H474 F475	L284-F471 HydrophobicContact CD1-CZ 4.49Å; L284-F471 HydrophobicContact CD2-CE1 4.28Å; L284-F471 HydrophobicContact CD2-CZ 4.26Å; L287-F471 HydrophobicContact CD1-CD2 3.8Å; L287-F471 HydrophobicContact CD1-CE1 4.45Å; L287-F471 HydrophobicContact CD1-CE2 3.36Å; L287-F471 HydrophobicContact CD1-CZ 3.73Å; L391-F471 HydrophobicContact CD2-CE2 3.82Å; L391-F471 HydrophobicContact CD2-CZ 3.76Å; L394-F471 HydrophobicContact CD2-CE1 3.68Å; L394-F471 HydrophobicContact CD2-CZ 3.76Å; I412-F471 HydrophobicContact CD1-CE1 4.05Å; I412-F471 HydrophobicContact CG2-CD1 4.02Å; I412-F471 HydrophobicContact CG2-CE1 4.44Å; F415-F471 HydrophobicContact CD1-CD1 4.48Å; F415-F471 AromaticContact CD1-CE1 3.79Å; F415-F471 HydrophobicContact CD1-CE1 3.79Å; F415-F471 AromaticContact CD1-CE2 3.96Å; F415-F471 HydrophobicContact CD1-CE2 3.96Å; F415-F471 AromaticContact CD1-CZ 3.49Å; F415-F471 HydrophobicContact CD1-CZ 3.49Å; F415-F471 VanDerWaalsContact CD1-CZ 3.49Å; F415-F471 HydrophobicContact CE1-CE1 4.32Å; F415-F471 AromaticContact CE1-CE2 3.73Å; F415-F471 HydrophobicContact CE1-CE2 3.73Å; F415-F471 AromaticContact CE1-CZ 3.55Å; F415-F471 HydrophobicContact CE1-CZ 3.55Å; E416-F471 HydrophobicContact CG-CB 4.01Å; E416-F471 HydrophobicContact CG-CD1 4.33Å; E416-F471 HydrophobicContact CG-CG 4.41Å; E416-F471 WeakPolarHBondContact OE1-CB 3.46Å; L419-F471 HydrophobicContact CD1-CD2 4.17Å; L419-F471 HydrophobicContact CD1-CE2 4.5Å; L467-F471 HydrophobicContact CD1-CD2 3.97Å; L467-F471 HydrophobicContact CD1-CE2 3.76Å; L467-F471 HydrophobicContact CG-CD2 4.03Å; L467-F471 HydrophobicContact CG-CE2 3.97Å; L467-F471 WeakPolarHBondContact O-CD2 3.37Å; L467-F471 PolarHBondContact O-N 2.63Å; Q468-F471 PolarHBondContact O-N 3.35Å; F471-R473 VanDerWaalsContact C-N 3.28Å; F471-R473 PolarHBondContact O-N 3.4Å; F471-H474 PolarHBondContact O-N 3.43Å; F471-F475 HydrophobicContact CD1-CD2 4.01Å; F471-F475 AromaticContact CD1-CE2 3.72Å; F471-F475 HydrophobicContact CD1-CE2 3.72Å; F471-F475 HydrophobicContact CE1-CE2 4.05Å; F471-F475 WeakPolarHBondContact O-CD2 3.35Å; F471-F475 PolarHBondContact O-N 3.3Å
472	E	88.4	Confident	88.2	Confident	84 Å²	84	55.3 Å²	55.3	39%	0.393	25%	0.246	S	C	.	.	H	α-helix	trans	-58.2	-42.3	177.9	-75.4	173.8	-169.1	0	0	112.2	Q468 K469 E470 K476 R479	Q468-E472 WeakPolarHBondContact O-CG 3.26Å; Q468-E472 PolarHBondContact O-N 3.44Å; K469-E472 PolarHBondContact O-N 2.95Å; E470-E472 VanDerWaalsContact C-N 3.31Å; E470-E472 PolarHBondContact O-N 2.9Å; E472-K476 WeakPolarHBondContact O-CA 3.42Å; E472-K476 WeakPolarHBondContact O-CB 3.47Å; E472-K476 PolarHBondContact O-N 3.43Å; E472-R479 PolarHBondContact O-NH1 3.24Å; E472-R479 VanDerWaalsContact O-NH1 3.15Å
473	R	87.1	Confident	88.2	Confident	135 Å²	135	55.5 Å²	55.5	51%	0.509	24%	0.244	S	C	.	.	H	α-helix	trans	-68	-45.1	176.5	-177.9	175	75	147.8	3	112.2	K469 E470 F471 F475	K469-R473 WeakPolarHBondContact O-CB 3.34Å; K469-R473 PolarHBondContact O-N 3.29Å; E470-R473 WeakPolarHBondContact O-CB 3.44Å; E470-R473 PolarHBondContact O-N 2.98Å; E470-R473 IonicContact OE1-CZ 3.62Å; E470-R473 IonicContact OE1-NE 2.86Å; E470-R473 IonicContact OE1-NH2 2.92Å; E470-R473 PolarHBondContact OE1-NH2 3.2Å; E470-R473 IonicContact OE2-CZ 3.7Å; E470-R473 IonicContact OE2-NE 3.62Å; E470-R473 PolarHBondContact OE2-NE 3.45Å; E470-R473 IonicContact OE2-NH2 2.72Å; E470-R473 PolarHBondContact OE2-NH2 2.85Å; F471-R473 VanDerWaalsContact C-N 3.28Å; F471-R473 PolarHBondContact O-N 3.4Å; R473-F475 VanDerWaalsContact C-N 3.32Å; R473-F475 PolarHBondContact O-N 3.42Å
474	H	86.6	Confident	88.3	Confident	9 Å²	9	56.5 Å²	56.5	4%	0.042	25%	0.249	C	C	.	.	H	α-helix	trans	-70.7	-27.5	-173.5	-77.8	65.4	0	0	0	113.1	H248 Y278 S279 L287 E470 F471	H248-H474 VanDerWaalsContact CB-NE2 3.25Å; H248-H474 WeakPolarHBondContact CB-NE2 3.46Å; H248-H474 AromaticContact CE1-CD2 3.72Å; H248-H474 AromaticContact CE1-CG 3.87Å; H248-H474 AromaticContact CG-CD2 3.25Å; H248-H474 AromaticContact CG-NE2 3.47Å; H248-H474 AromaticContact ND1-CD2 3.04Å; H248-H474 PolarHBondContact ND1-CD2 3.28Å; H248-H474 AromaticContact ND1-CE1 3.88Å; H248-H474 AromaticContact ND1-CG 3.5Å; H248-H474 AromaticContact ND1-ND1 3.98Å; H248-H474 AromaticContact ND1-NE2 3.29Å; H248-H474 PolarHBondContact ND1-NE2 3.41Å; Y278-H474 VanDerWaalsContact CA-O 3.28Å; Y278-H474 WeakPolarHBondContact CA-O 3.11Å; S279-H474 PolarHBondContact N-O 3.08Å; S279-H474 VanDerWaalsContact N-O 3.13Å; L287-H474 HydrophobicContact CD2-CB 4.46Å; L287-H474 WeakPolarHBondContact CD2-CD2 3.39Å; L287-H474 VanDerWaalsContact CD2-CE1 3.42Å; L287-H474 WeakPolarHBondContact CD2-CE1 3.38Å; L287-H474 VanDerWaalsContact CD2-NE2 3.25Å; L287-H474 WeakPolarHBondContact CD2-NE2 3.31Å; E470-H474 WeakPolarHBondContact O-CB 3.49Å; E470-H474 PolarHBondContact O-N 3.12Å; E470-H474 PolarHBondContact O-ND1 3.3Å; E470-H474 IonicContact OE2-CE1 2.65Å; E470-H474 PolarHBondContact OE2-CE1 2.85Å; E470-H474 IonicContact OE2-ND1 3.74Å; E470-H474 PolarHBondContact OE2-ND1 3.45Å; F471-H474 PolarHBondContact O-N 3.43Å
475	F	88.8	Confident	88.3	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118.3	20.8	-178.6	-56.5	-74.1	0	0	0	113.3	S279 F281 L284 F409 I412 F471 R473 D477 L478 R479	S279-F475 WeakPolarHBondContact O-CE1 3.27Å; F281-F475 HydrophobicContact CD1-CE1 4.26Å; F281-F475 HydrophobicContact CE1-CE1 4.08Å; L284-F475 HydrophobicContact CD2-CE2 4.21Å; L284-F475 HydrophobicContact CD2-CZ 3.93Å; F409-F475 HydrophobicContact CD2-CB 4.46Å; F409-F475 HydrophobicContact CE2-CB 3.85Å; I412-F475 HydrophobicContact CD1-CE1 4.25Å; I412-F475 HydrophobicContact CD1-CE2 3.81Å; I412-F475 HydrophobicContact CD1-CZ 3.65Å; I412-F475 HydrophobicContact CG1-CE1 4.26Å; I412-F475 HydrophobicContact CG1-CE2 4.29Å; I412-F475 HydrophobicContact CG1-CZ 4.11Å; I412-F475 HydrophobicContact CG2-CB 4.42Å; I412-F475 HydrophobicContact CG2-CD2 3.54Å; I412-F475 HydrophobicContact CG2-CE2 3.88Å; I412-F475 HydrophobicContact CG2-CG 3.91Å; I412-F475 HydrophobicContact CG2-CZ 4.48Å; F471-F475 HydrophobicContact CD1-CD2 4.01Å; F471-F475 AromaticContact CD1-CE2 3.72Å; F471-F475 HydrophobicContact CD1-CE2 3.72Å; F471-F475 HydrophobicContact CE1-CE2 4.05Å; F471-F475 WeakPolarHBondContact O-CD2 3.35Å; F471-F475 PolarHBondContact O-N 3.3Å; R473-F475 VanDerWaalsContact C-N 3.32Å; R473-F475 PolarHBondContact O-N 3.42Å; F475-D477 VanDerWaalsContact C-N 3.33Å; F475-D477 PolarHBondContact O-N 3.19Å; F475-L478 HydrophobicContact CD1-CD1 4.01Å; F475-L478 PolarHBondContact O-N 2.94Å; F475-R479 PolarHBondContact O-N 2.71Å
476	K	91	Very high	88.2	Confident	142 Å²	142	57.4 Å²	57.4	62%	0.617	25%	0.249	S	C	*	.	H	α-helix	trans	-54.7	-45.3	-177.4	-177.7	-176.6	173.9	-175.2	0	112.7	E472 R479 F480	E472-K476 WeakPolarHBondContact O-CA 3.42Å; E472-K476 WeakPolarHBondContact O-CB 3.47Å; E472-K476 PolarHBondContact O-N 3.43Å; K476-R479 WeakPolarHBondContact O-CB 3.46Å; K476-R479 PolarHBondContact O-N 2.61Å; K476-F480 PolarHBondContact O-N 3.07Å
477	D	91.2	Very high	88.5	Confident	32 Å²	32	53.7 Å²	53.7	17%	0.171	24%	0.235	C	C	.	.	H	α-helix	trans	-71.7	-39.4	-178.3	-72.5	18.1	0	0	0	112.3	R264 I276 H277 F475 R479 F480 I481	R264-D477 IonicContact CZ-OD2 2.69Å; R264-D477 VanDerWaalsContact NH2-CG 3.27Å; R264-D477 IonicContact NH2-OD1 3.17Å; R264-D477 PolarHBondContact NH2-OD1 2.89Å; R264-D477 IonicContact NH2-OD2 2.7Å; R264-D477 PolarHBondContact NH2-OD2 2.94Å; I276-D477 HydrophobicContact CG2-CB 3.86Å; H277-D477 PolarHBondContact N-OD2 3.02Å; H277-D477 WeakPolarHBondContact O-CB 3.26Å; F475-D477 VanDerWaalsContact C-N 3.33Å; F475-D477 PolarHBondContact O-N 3.19Å; D477-R479 PolarHBondContact O-N 3.47Å; D477-F480 WeakPolarHBondContact O-CA 3.32Å; D477-F480 VanDerWaalsContact O-CB 3.3Å; D477-F480 WeakPolarHBondContact O-CB 3.33Å; D477-F480 PolarHBondContact O-N 3.01Å; D477-I481 PolarHBondContact O-N 3.37Å; D477-I481 VanDerWaalsContact O-N 3.07Å
478	L	90.2	Very high	88.6	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-60.4	-39.3	173.2	-70.6	-174.5	0	0	0	110.9	I276 Y278 F281 F409 F475 F480 I481 K482 L485 L550	I276-L478 HydrophobicContact CG2-CD2 3.9Å; Y278-L478 HydrophobicContact CD1-CD1 4.2Å; Y278-L478 HydrophobicContact CD1-CD2 3.79Å; Y278-L478 HydrophobicContact CD1-CG 3.85Å; Y278-L478 HydrophobicContact CD2-CD1 3.73Å; Y278-L478 HydrophobicContact CD2-CG 4.28Å; Y278-L478 HydrophobicContact CE1-CD2 3.94Å; Y278-L478 HydrophobicContact CE1-CG 4.44Å; Y278-L478 HydrophobicContact CE2-CD1 4.2Å; Y278-L478 HydrophobicContact CG-CD1 3.72Å; Y278-L478 HydrophobicContact CG-CD2 4.18Å; Y278-L478 HydrophobicContact CG-CG 3.77Å; F281-L478 HydrophobicContact CZ-CD1 4.48Å; F409-L478 HydrophobicContact CB-CD1 4.42Å; F409-L478 HydrophobicContact CD1-CB 4.39Å; F409-L478 HydrophobicContact CD2-CB 3.77Å; F409-L478 HydrophobicContact CD2-CD1 3.87Å; F409-L478 HydrophobicContact CE1-CB 4.35Å; F409-L478 HydrophobicContact CE2-CB 3.77Å; F409-L478 HydrophobicContact CG-CB 4.12Å; F409-L478 HydrophobicContact CG-CD1 4.29Å; F409-L478 HydrophobicContact CZ-CB 4.06Å; F475-L478 HydrophobicContact CD1-CD1 4.01Å; F475-L478 PolarHBondContact O-N 2.94Å; L478-F480 VanDerWaalsContact C-N 3.3Å; L478-F480 PolarHBondContact O-N 3.39Å; L478-I481 HydrophobicContact CD2-CD1 4.2Å; L478-I481 CarbonylContact O-C 3.55Å; L478-I481 WeakPolarHBondContact O-CG1 3.37Å; L478-I481 PolarHBondContact O-N 2.96Å; L478-K482 PolarHBondContact O-N 3.18Å; L478-L485 HydrophobicContact CD2-CD1 4.36Å; L478-L550 HydrophobicContact CD2-CD1 4.44Å
479	R	91.4	Very high	88.6	Confident	82 Å²	82	53.4 Å²	53.4	31%	0.309	24%	0.237	S	C	.	.	H	α-helix	trans	-62.7	-38.2	173.6	-166.7	174	-67.3	106.2	5	112.1	F409 E416 E472 F475 K476 D477 I481 K482	F409-R479 HydrophobicContact CZ-CB 3.85Å; F409-R479 HydrophobicContact CZ-CG 4.42Å; E416-R479 IonicContact OE1-CZ 2.7Å; E416-R479 IonicContact OE1-NH2 2.78Å; E416-R479 PolarHBondContact OE1-NH2 3.07Å; E416-R479 IonicContact OE2-CZ 2.82Å; E416-R479 IonicContact OE2-NH2 2.68Å; E416-R479 PolarHBondContact OE2-NH2 3.44Å; E472-R479 PolarHBondContact O-NH1 3.24Å; E472-R479 VanDerWaalsContact O-NH1 3.15Å; F475-R479 PolarHBondContact O-N 2.71Å; K476-R479 WeakPolarHBondContact O-CB 3.46Å; K476-R479 PolarHBondContact O-N 2.61Å; D477-R479 PolarHBondContact O-N 3.47Å; R479-I481 VanDerWaalsContact C-N 3.32Å; R479-I481 PolarHBondContact O-N 2.72Å; R479-K482 VanDerWaalsContact O-CB 3.29Å; R479-K482 WeakPolarHBondContact O-CB 3.41Å; R479-K482 PolarHBondContact O-N 3.18Å
480	F	90.3	Very high	88.7	Confident	176 Å²	176	50.1 Å²	50.1	77%	0.772	23%	0.225	S	C	*	.	H	α-helix	trans	-62	-39.2	176.2	-179.2	-96.8	0	0	0	112	K476 D477 L478	K476-F480 PolarHBondContact O-N 3.07Å; D477-F480 WeakPolarHBondContact O-CA 3.32Å; D477-F480 VanDerWaalsContact O-CB 3.3Å; D477-F480 WeakPolarHBondContact O-CB 3.33Å; D477-F480 PolarHBondContact O-N 3.01Å; L478-F480 VanDerWaalsContact C-N 3.3Å; L478-F480 PolarHBondContact O-N 3.39Å
481	I	88.9	Confident	89	Confident	5 Å²	5	48.6 Å²	48.6	3%	0.026	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.8	12.1	177.5	65.9	163	0	0	0	114	I276 D477 L478 R479 K483 D484 L485 L550	I276-I481 HydrophobicContact CD1-CD1 4.4Å; I276-I481 HydrophobicContact CD1-CG2 3.67Å; I276-I481 HydrophobicContact CG1-CD1 4.18Å; I276-I481 HydrophobicContact CG2-CD1 4.01Å; D477-I481 PolarHBondContact O-N 3.37Å; D477-I481 VanDerWaalsContact O-N 3.07Å; L478-I481 HydrophobicContact CD2-CD1 4.2Å; L478-I481 CarbonylContact O-C 3.55Å; L478-I481 WeakPolarHBondContact O-CG1 3.37Å; L478-I481 PolarHBondContact O-N 2.96Å; R479-I481 VanDerWaalsContact C-N 3.32Å; R479-I481 PolarHBondContact O-N 2.72Å; I481-K483 PolarHBondContact O-N 3.16Å; I481-K483 VanDerWaalsContact O-N 3.13Å; I481-D484 WeakPolarHBondContact O-CA 3.41Å; I481-D484 WeakPolarHBondContact O-CB 3.49Å; I481-D484 PolarHBondContact O-N 3.38Å; I481-L485 HydrophobicContact CD1-CD1 4.28Å; I481-L485 HydrophobicContact CD1-CD2 4.06Å; I481-L485 HydrophobicContact CD1-CG 4.09Å; I481-L485 HydrophobicContact CG1-CD1 4.17Å; I481-L485 HydrophobicContact CG1-CG 4.15Å; I481-L485 PolarHBondContact O-N 3.43Å; I481-L550 HydrophobicContact CD1-CD1 3.79Å
482	K	88.9	Confident	89.3	Confident	60 Å²	60	49.7 Å²	49.7	26%	0.261	22%	0.223	S	C	.	.	H	α-helix	trans	-53.4	-41.1	-173.7	-177.8	172.3	-178.8	157.1	0	112.9	F409 C413 L478 R479 D484 L485 E486	F409-K482 HydrophobicContact CD1-CG 4.43Å; F409-K482 HydrophobicContact CE1-CB 4.02Å; F409-K482 HydrophobicContact CE1-CD 3.96Å; F409-K482 HydrophobicContact CE1-CG 3.96Å; C413-K482 PolarHBondContact SG-NZ 3.31Å; C413-K482 VanDerWaalsContact SG-NZ 3.43Å; L478-K482 PolarHBondContact O-N 3.18Å; R479-K482 VanDerWaalsContact O-CB 3.29Å; R479-K482 WeakPolarHBondContact O-CB 3.41Å; R479-K482 PolarHBondContact O-N 3.18Å; K482-D484 VanDerWaalsContact C-N 3.31Å; K482-D484 PolarHBondContact O-N 3.34Å; K482-L485 WeakPolarHBondContact O-CB 3.43Å; K482-L485 PolarHBondContact O-N 2.95Å; K482-E486 WeakPolarHBondContact CE-OE1 3.33Å; K482-E486 HydrophobicContact CG-CG 4.4Å; K482-E486 WeakPolarHBondContact O-CG 3.28Å; K482-E486 PolarHBondContact O-N 3.3Å
483	K	86.9	Confident	89.5	Confident	104 Å²	104	51.2 Å²	51.2	45%	0.452	23%	0.234	S	C	.	.	H	α-helix	trans	-66.4	-33.7	179.5	-71	-72.3	161	-152.1	0	112.7	I481 E486 L487 F494	I481-K483 PolarHBondContact O-N 3.16Å; I481-K483 VanDerWaalsContact O-N 3.13Å; K483-E486 WeakPolarHBondContact CD-OE2 3.36Å; K483-E486 IonicContact NZ-OE1 2.69Å; K483-E486 IonicContact NZ-OE2 3.35Å; K483-E486 PolarHBondContact NZ-OE2 2.9Å; K483-L487 WeakPolarHBondContact O-CB 3.09Å; K483-L487 PolarHBondContact O-N 3.31Å; K483-F494 HydrophobicContact CD-CE2 4.48Å; K483-F494 WeakPolarHBondContact O-CE2 3.41Å
484	D	87	Confident	89.8	Confident	34 Å²	34	45.7 Å²	45.7	18%	0.182	21%	0.214	C	C	.	.	H	α-helix	trans	-68.8	-45.8	173.8	-58.3	-37.5	0	0	0	109.6	I481 K482 E486 L487 F488	I481-D484 WeakPolarHBondContact O-CA 3.41Å; I481-D484 WeakPolarHBondContact O-CB 3.49Å; I481-D484 PolarHBondContact O-N 3.38Å; K482-D484 VanDerWaalsContact C-N 3.31Å; K482-D484 PolarHBondContact O-N 3.34Å; D484-E486 VanDerWaalsContact C-N 3.34Å; D484-E486 PolarHBondContact O-N 3.02Å; D484-L487 WeakPolarHBondContact O-CB 3.24Å; D484-L487 PolarHBondContact O-N 3.31Å; D484-F488 VanDerWaalsContact O-CD2 3.26Å; D484-F488 WeakPolarHBondContact O-CD2 3.46Å; D484-F488 PolarHBondContact O-N 3.22Å; D484-F488 VanDerWaalsContact O-N 3.13Å
485	L	88.4	Confident	90.1	Very high	3 Å²	3	51 Å²	51	2%	0.016	24%	0.237	C	C	.	.	H	α-helix	trans	-57	-44.9	175.5	-63.8	179.3	0	0	0	112.4	A406 F409 L478 I481 K482 F488 S489 V547 L550	A406-L485 HydrophobicContact CB-CB 3.85Å; F409-L485 HydrophobicContact CB-CD1 4.44Å; F409-L485 HydrophobicContact CD1-CD1 4.06Å; F409-L485 HydrophobicContact CG-CD1 4.49Å; L478-L485 HydrophobicContact CD2-CD1 4.36Å; I481-L485 HydrophobicContact CD1-CD1 4.28Å; I481-L485 HydrophobicContact CD1-CD2 4.06Å; I481-L485 HydrophobicContact CD1-CG 4.09Å; I481-L485 HydrophobicContact CG1-CD1 4.17Å; I481-L485 HydrophobicContact CG1-CG 4.15Å; I481-L485 PolarHBondContact O-N 3.43Å; K482-L485 WeakPolarHBondContact O-CB 3.43Å; K482-L485 PolarHBondContact O-N 2.95Å; L485-F488 PolarHBondContact O-N 2.94Å; L485-S489 WeakPolarHBondContact O-CB 3.45Å; L485-S489 PolarHBondContact O-N 3.22Å; L485-S489 PolarHBondContact O-OG 3.32Å; L485-V547 HydrophobicContact CD2-CG1 3.81Å; L485-L550 HydrophobicContact CD2-CD1 4.19Å
486	E	88.1	Confident	90.3	Very high	59 Å²	59	52.9 Å²	52.9	28%	0.276	25%	0.249	S	C	.	.	H	α-helix	trans	-61.8	-43	176.3	-74.8	172.3	-171.5	0	0	112.1	K482 K483 D484 F488 S489 N490 F494	K482-E486 WeakPolarHBondContact CE-OE1 3.33Å; K482-E486 HydrophobicContact CG-CG 4.4Å; K482-E486 WeakPolarHBondContact O-CG 3.28Å; K482-E486 PolarHBondContact O-N 3.3Å; K483-E486 WeakPolarHBondContact CD-OE2 3.36Å; K483-E486 IonicContact NZ-OE1 2.69Å; K483-E486 IonicContact NZ-OE2 3.35Å; K483-E486 PolarHBondContact NZ-OE2 2.9Å; D484-E486 VanDerWaalsContact C-N 3.34Å; D484-E486 PolarHBondContact O-N 3.02Å; E486-F488 VanDerWaalsContact C-N 3.35Å; E486-F488 PolarHBondContact O-N 3.27Å; E486-S489 PolarHBondContact O-N 3.26Å; E486-N490 PolarHBondContact O-N 3.45Å; E486-F494 HydrophobicContact CB-CD2 4.31Å; E486-F494 HydrophobicContact CB-CE2 4.13Å
487	L	90.3	Very high	90.3	Very high	3 Å²	3	53 Å²	53	2%	0.016	25%	0.252	C	S	.	.	H	α-helix	trans	-58.6	-45.4	178.1	168.6	62.9	0	0	0	111.7	K483 D484 N490 P491 F494 A499 V503 L507	K483-L487 WeakPolarHBondContact O-CB 3.09Å; K483-L487 PolarHBondContact O-N 3.31Å; D484-L487 WeakPolarHBondContact O-CB 3.24Å; D484-L487 PolarHBondContact O-N 3.31Å; L487-N490 CarbonylContact O-C 3.45Å; L487-P491 WeakPolarHBondContact O-CA 3.29Å; L487-P491 WeakPolarHBondContact O-CB 3.49Å; L487-F494 VanDerWaalsContact CA-CD2 3.44Å; L487-F494 HydrophobicContact CB-CD1 4.18Å; L487-F494 HydrophobicContact CB-CD2 3.79Å; L487-F494 HydrophobicContact CB-CE1 4.19Å; L487-F494 HydrophobicContact CB-CE2 3.81Å; L487-F494 HydrophobicContact CB-CG 3.96Å; L487-F494 HydrophobicContact CB-CZ 4Å; L487-F494 HydrophobicContact CD1-CB 3.83Å; L487-F494 HydrophobicContact CD1-CD1 3.5Å; L487-F494 VanDerWaalsContact CD1-CD1 3.5Å; L487-F494 HydrophobicContact CD1-CD2 4.34Å; L487-F494 HydrophobicContact CD1-CE1 4.08Å; L487-F494 HydrophobicContact CD1-CG 3.63Å; L487-F494 HydrophobicContact CG-CD1 4.34Å; L487-F494 HydrophobicContact CG-CG 4.4Å; L487-A499 HydrophobicContact CD2-CB 4.31Å; L487-V503 HydrophobicContact CD2-CG1 4.14Å; L487-L507 HydrophobicContact CD1-CD1 3.7Å; L487-L507 HydrophobicContact CD1-CD2 3.54Å; L487-L507 HydrophobicContact CD1-CG 4.25Å
488	F	88.8	Confident	90.3	Very high	3 Å²	3	58 Å²	58	1%	0.013	27%	0.269	C	S	.	.	H	α-helix	trans	-82.1	-17	-177.6	-73	-85.7	0	0	0	113.6	D484 L485 E486 Y529 I540 V543 A544 V547	D484-F488 VanDerWaalsContact O-CD2 3.26Å; D484-F488 WeakPolarHBondContact O-CD2 3.46Å; D484-F488 PolarHBondContact O-N 3.22Å; D484-F488 VanDerWaalsContact O-N 3.13Å; L485-F488 PolarHBondContact O-N 2.94Å; E486-F488 VanDerWaalsContact C-N 3.35Å; E486-F488 PolarHBondContact O-N 3.27Å; F488-Y529 VanDerWaalsContact CA-OH 3.3Å; F488-Y529 WeakPolarHBondContact CA-OH 3.43Å; F488-Y529 AromaticContact CD1-CE1 3.87Å; F488-Y529 HydrophobicContact CD1-CE1 3.87Å; F488-Y529 HydrophobicContact CD1-CE2 4.38Å; F488-Y529 AromaticContact CD1-CZ 3.71Å; F488-Y529 HydrophobicContact CE1-CE1 4.27Å; F488-Y529 VanDerWaalsContact O-CE2 3.31Å; F488-Y529 WeakPolarHBondContact O-CE2 3.45Å; F488-Y529 PolarHBondContact O-OH 3.04Å; F488-I540 HydrophobicContact CE1-CG2 4.04Å; F488-I540 WeakPolarHBondContact CE1-O 3.26Å; F488-V543 HydrophobicContact CD2-CG1 3.99Å; F488-V543 HydrophobicContact CE1-CB 4.03Å; F488-V543 HydrophobicContact CE1-CG1 4.17Å; F488-V543 HydrophobicContact CE2-CB 3.86Å; F488-V543 HydrophobicContact CE2-CG1 3.19Å; F488-V543 HydrophobicContact CZ-CB 3.39Å; F488-V543 HydrophobicContact CZ-CG1 3.32Å; F488-V543 HydrophobicContact CZ-CG2 4.37Å; F488-A544 HydrophobicContact CD1-CB 3.95Å; F488-A544 HydrophobicContact CE1-CB 4.06Å; F488-V547 HydrophobicContact CB-CG1 4.36Å; F488-V547 HydrophobicContact CB-CG2 4.49Å; F488-V547 HydrophobicContact CD2-CG2 4.03Å; F488-V547 HydrophobicContact CG-CG2 4.27Å
489	S	88.1	Confident	90.3	Very high	30 Å²	30	58.1 Å²	58.1	21%	0.21	27%	0.27	C	S	.	.	H	α-helix	trans	-80.2	-35.7	172.7	-56.5	0	0	0	0	112	A406 L485 E486 Y520	A406-S489 WeakPolarHBondContact CB-OG 3.46Å; L485-S489 WeakPolarHBondContact O-CB 3.45Å; L485-S489 PolarHBondContact O-N 3.22Å; L485-S489 PolarHBondContact O-OG 3.32Å; E486-S489 PolarHBondContact O-N 3.26Å; S489-Y520 PolarHBondContact O-OH 3.34Å; S489-Y520 VanDerWaalsContact O-OH 3.08Å
490	N	89.3	Confident	90.2	Very high	56 Å²	56	56.7 Å²	56.7	30%	0.299	27%	0.271	S	S	.	.			trans	-139.8	68.3	-178.8	-164.2	-15.2	0	0	0	112.2	E486 L487 F492 N493 F494	E486-N490 PolarHBondContact O-N 3.45Å; L487-N490 CarbonylContact O-C 3.45Å; N490-F492 PolarHBondContact O-N 3.01Å; N490-N493 PolarHBondContact ND2-ND2 3.29Å; N490-N493 PolarHBondContact O-N 3.14Å; N490-N493 WeakPolarHBondContact OD1-CB 3.42Å; N490-N493 PolarHBondContact OD1-N 3.38Å; N490-F494 WeakPolarHBondContact O-CB 3.47Å; N490-F494 PolarHBondContact O-N 3.04Å; N490-F494 VanDerWaalsContact O-N 3.13Å
491	P	92.3	Very high	90.1	Very high	3 Å²	3	54.8 Å²	54.8	2%	0.019	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-26.6	-173.8	26.3	-36.9	0	0	0	113	L487 L507 L510 Q511 Y520 F528 Y529	L487-P491 WeakPolarHBondContact O-CA 3.29Å; L487-P491 WeakPolarHBondContact O-CB 3.49Å; P491-L507 HydrophobicContact CB-CD1 4.29Å; P491-L507 WeakPolarHBondContact O-CD1 3.43Å; P491-L510 HydrophobicContact CB-CD2 4.17Å; P491-Q511 PolarHBondContact O-NE2 3.48Å; P491-Y520 HydrophobicContact CG-CD2 4.42Å; P491-Y520 HydrophobicContact CG-CE2 4.07Å; P491-F528 HydrophobicContact CG-CE1 4.27Å; P491-Y529 VanDerWaalsContact CG-OH 3.32Å; P491-Y529 WeakPolarHBondContact CG-OH 3.23Å
492	F	93.9	Very high	90.1	Very high	24 Å²	24	58.1 Å²	58.1	11%	0.105	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-29.1	-176.9	-75.2	-87.1	0	0	0	114.3	N490 L510 L516 W517 Y520 F528	N490-F492 PolarHBondContact O-N 3.01Å; F492-L510 HydrophobicContact CD1-CD2 4.17Å; F492-L510 HydrophobicContact CD2-CD2 4.12Å; F492-L510 HydrophobicContact CE1-CD2 3.74Å; F492-L510 WeakPolarHBondContact CE1-O 3.24Å; F492-L510 HydrophobicContact CE2-CD2 3.66Å; F492-L510 HydrophobicContact CG-CD2 4.34Å; F492-L510 HydrophobicContact CZ-CD2 3.45Å; F492-L510 VanDerWaalsContact CZ-CD2 3.45Å; F492-L510 HydrophobicContact CZ-CG 4.3Å; F492-L516 HydrophobicContact CZ-CB 4.01Å; F492-W517 HydrophobicContact CB-CE3 3.54Å; F492-W517 HydrophobicContact CB-CH2 4.34Å; F492-W517 HydrophobicContact CB-CZ3 3.27Å; F492-W517 HydrophobicContact CD1-CB 4.24Å; F492-W517 HydrophobicContact CD1-CD2 4.25Å; F492-W517 AromaticContact CD1-CE3 3.45Å; F492-W517 HydrophobicContact CD1-CE3 3.45Å; F492-W517 VanDerWaalsContact CD1-CE3 3.45Å; F492-W517 HydrophobicContact CD1-CZ3 4.14Å; F492-W517 AromaticContact CD2-CE3 3.61Å; F492-W517 HydrophobicContact CD2-CE3 3.61Å; F492-W517 AromaticContact CD2-CZ3 3.94Å; F492-W517 HydrophobicContact CD2-CZ3 3.94Å; F492-W517 HydrophobicContact CE1-CB 3.74Å; F492-W517 AromaticContact CE1-CE3 4Å; F492-W517 HydrophobicContact CE1-CE3 4Å; F492-W517 HydrophobicContact CE2-CE3 4.14Å; F492-W517 HydrophobicContact CG-CD2 4.4Å; F492-W517 AromaticContact CG-CE3 3.24Å; F492-W517 HydrophobicContact CG-CE3 3.24Å; F492-W517 AromaticContact CG-CZ3 3.54Å; F492-W517 HydrophobicContact CG-CZ3 3.54Å; F492-W517 HydrophobicContact CZ-CB 4.11Å; F492-W517 HydrophobicContact CZ-CE3 4.32Å; F492-Y520 AromaticContact CD2-CD1 3.76Å; F492-Y520 HydrophobicContact CD2-CD1 3.76Å; F492-Y520 HydrophobicContact CD2-CD2 4.05Å; F492-Y520 HydrophobicContact CD2-CE1 4.22Å; F492-Y520 HydrophobicContact CD2-CE2 4.45Å; F492-Y520 AromaticContact CD2-CG 3.68Å; F492-Y520 HydrophobicContact CD2-CG 3.68Å; F492-Y520 HydrophobicContact CE2-CD1 4.13Å; F492-Y520 HydrophobicContact CE2-CD2 4.02Å; F492-Y520 AromaticContact CE2-CG 3.63Å; F492-Y520 HydrophobicContact CE2-CG 3.63Å; F492-F528 HydrophobicContact CE2-CE1 4.35Å; F492-F528 HydrophobicContact CE2-CE2 4.12Å; F492-F528 AromaticContact CE2-CZ 3.65Å; F492-F528 HydrophobicContact CE2-CZ 3.65Å; F492-F528 HydrophobicContact CZ-CE2 4.42Å; F492-F528 HydrophobicContact CZ-CZ 4.08Å
493	N	92.5	Very high	90.2	Very high	115 Å²	115	55.5 Å²	55.5	62%	0.615	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.7	-5.6	176.6	-64.7	-15.6	0	0	0	113.1	N490	N490-N493 PolarHBondContact ND2-ND2 3.29Å; N490-N493 PolarHBondContact O-N 3.14Å; N490-N493 WeakPolarHBondContact OD1-CB 3.42Å; N490-N493 PolarHBondContact OD1-N 3.38Å
494	F	93.6	Very high	90.5	Very high	19 Å²	19	55.1 Å²	55.1	8%	0.083	28%	0.276	C	S	.	.	S	Bend	trans	-71.6	131.1	178.8	-167.3	-88.1	0	0	0	111.5	K483 E486 L487 N490 P496 A499 L507 Q511	K483-F494 HydrophobicContact CD-CE2 4.48Å; K483-F494 WeakPolarHBondContact O-CE2 3.41Å; E486-F494 HydrophobicContact CB-CD2 4.31Å; E486-F494 HydrophobicContact CB-CE2 4.13Å; L487-F494 VanDerWaalsContact CA-CD2 3.44Å; L487-F494 HydrophobicContact CB-CD1 4.18Å; L487-F494 HydrophobicContact CB-CD2 3.79Å; L487-F494 HydrophobicContact CB-CE1 4.19Å; L487-F494 HydrophobicContact CB-CE2 3.81Å; L487-F494 HydrophobicContact CB-CG 3.96Å; L487-F494 HydrophobicContact CB-CZ 4Å; L487-F494 HydrophobicContact CD1-CB 3.83Å; L487-F494 HydrophobicContact CD1-CD1 3.5Å; L487-F494 VanDerWaalsContact CD1-CD1 3.5Å; L487-F494 HydrophobicContact CD1-CD2 4.34Å; L487-F494 HydrophobicContact CD1-CE1 4.08Å; L487-F494 HydrophobicContact CD1-CG 3.63Å; L487-F494 HydrophobicContact CG-CD1 4.34Å; L487-F494 HydrophobicContact CG-CG 4.4Å; N490-F494 WeakPolarHBondContact O-CB 3.47Å; N490-F494 PolarHBondContact O-N 3.04Å; N490-F494 VanDerWaalsContact O-N 3.13Å; F494-P496 WeakPolarHBondContact O-CD 3.48Å; F494-A499 HydrophobicContact CD1-CB 4.44Å; F494-A499 HydrophobicContact CE1-CB 3.91Å; F494-L507 HydrophobicContact CD1-CD2 4.1Å; F494-Q511 PolarHBondContact O-NE2 3.05Å
495	K	93.3	Very high	90.8	Very high	122 Å²	122	59 Å²	59	53%	0.53	30%	0.301	S	S	.	.			trans	-73.3	122.9	-179.9	-60.9	-169.7	-171.4	173.8	0	110.8	E497 Y498	K495-E497 PolarHBondContact O-N 3.3Å; K495-Y498 HydrophobicContact CB-CD2 3.76Å; K495-Y498 HydrophobicContact CB-CE2 4.02Å; K495-Y498 HydrophobicContact CD-CD2 4.34Å; K495-Y498 HydrophobicContact CD-CE2 3.73Å; K495-Y498 HydrophobicContact CG-CD2 4.39Å; K495-Y498 HydrophobicContact CG-CE2 4.25Å; K495-Y498 PolarHBondContact O-N 2.56Å
496	P	91.5	Very high	91.2	Very high	39 Å²	39	59.7 Å²	59.7	25%	0.253	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-58.2	-26	-178	-28.2	36.6	0	0	0	114.9	F494 Y498 A499 R504 L507 Q511	F494-P496 WeakPolarHBondContact O-CD 3.48Å; P496-Y498 PolarHBondContact O-N 3.36Å; P496-A499 PolarHBondContact O-N 3.41Å; P496-A499 VanDerWaalsContact O-N 3.15Å; P496-R504 WeakPolarHBondContact O-CD 3.33Å; P496-R504 WeakPolarHBondContact O-CG 3.36Å; P496-R504 PolarHBondContact O-NE 3Å; P496-L507 HydrophobicContact CB-CD2 4.41Å; P496-L507 HydrophobicContact CG-CD2 4.43Å; P496-Q511 VanDerWaalsContact CG-OE1 3.3Å
497	E	91.7	Very high	91.5	Very high	145 Å²	145	56.9 Å²	56.9	68%	0.678	29%	0.291	S	S	*	.	G	3₁₀ helix	trans	-60.7	-30.9	177	-63.9	168.8	-138.7	0	0	113.2	K495 R504	K495-E497 PolarHBondContact O-N 3.3Å; E497-R504 PolarHBondContact O-NH2 2.91Å
498	Y	90.8	Very high	91.7	Very high	137 Å²	137	60.3 Å²	60.3	54%	0.537	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	-88.5	-8	179.2	-57.4	-43.2	0	0	0	113.3	K495 P496	K495-Y498 HydrophobicContact CB-CD2 3.76Å; K495-Y498 HydrophobicContact CB-CE2 4.02Å; K495-Y498 HydrophobicContact CD-CD2 4.34Å; K495-Y498 HydrophobicContact CD-CE2 3.73Å; K495-Y498 HydrophobicContact CG-CD2 4.39Å; K495-Y498 HydrophobicContact CG-CE2 4.25Å; K495-Y498 PolarHBondContact O-N 2.56Å; P496-Y498 PolarHBondContact O-N 3.36Å
499	A	89.9	Confident	92.1	Very high	2 Å²	2	64.7 Å²	64.7	2%	0.017	33%	0.331	C	S	.	.	S	Bend	trans	-80.5	151.9	-179.7	0	0	0	0	0	110.8	L487 F494 P496 R504 L507	L487-A499 HydrophobicContact CD2-CB 4.31Å; F494-A499 HydrophobicContact CD1-CB 4.44Å; F494-A499 HydrophobicContact CE1-CB 3.91Å; P496-A499 PolarHBondContact O-N 3.41Å; P496-A499 VanDerWaalsContact O-N 3.15Å; A499-R504 HydrophobicContact CB-CG 4.11Å; A499-R504 PolarHBondContact O-NE 3.28Å; A499-R504 PolarHBondContact O-NH2 3.25Å; A499-L507 HydrophobicContact CB-CD2 3.85Å
500	P	88.8	Confident	92.5	Very high	52 Å²	52	63.3 Å²	63.3	34%	0.338	32%	0.321	S	S	.	.			trans	-54.9	141.5	169.8	-24.2	33.6	0	0	0	111.4	S502 V503 R504	P500-S502 PolarHBondContact O-N 3.5Å; P500-S502 VanDerWaalsContact O-N 3.12Å; P500-V503 HydrophobicContact CB-CG2 4.2Å; P500-V503 HydrophobicContact CG-CG2 4.39Å; P500-V503 PolarHBondContact O-N 2.94Å; P500-R504 WeakPolarHBondContact O-CG 3.33Å; P500-R504 PolarHBondContact O-N 3.24Å
501	I	88.8	Confident	92.8	Very high	136 Å²	136	63.1 Å²	63.1	70%	0.697	32%	0.318	S	S	*	.	H	α-helix	trans	-53.1	-40	-174.7	-64.2	172.1	0	0	0	111.8	V503 R504	I501-V503 PolarHBondContact O-N 3.12Å; I501-R504 PolarHBondContact O-N 2.8Å
502	S	88.8	Confident	92.9	Very high	75 Å²	75	66.8 Å²	66.8	52%	0.524	35%	0.349	S	S	.	.	H	α-helix	trans	-60.5	-29.8	177.6	50.7	0	0	0	0	113.6	P500 I539	P500-S502 PolarHBondContact O-N 3.5Å; P500-S502 VanDerWaalsContact O-N 3.12Å; S502-I539 WeakPolarHBondContact O-CD1 3.3Å
503	V	91.4	Very high	93	Very high	4 Å²	4	68.1 Å²	68.1	2%	0.024	36%	0.357	C	S	.	.	H	α-helix	trans	-92.6	-25.4	-175.8	-173.4	0	0	0	0	112.1	L487 P500 I501 V505 E506 L507 I539 I540	L487-V503 HydrophobicContact CD2-CG1 4.14Å; P500-V503 HydrophobicContact CB-CG2 4.2Å; P500-V503 HydrophobicContact CG-CG2 4.39Å; P500-V503 PolarHBondContact O-N 2.94Å; I501-V503 PolarHBondContact O-N 3.12Å; V503-V505 VanDerWaalsContact C-N 3.32Å; V503-V505 PolarHBondContact O-N 3.26Å; V503-E506 PolarHBondContact O-N 3.11Å; V503-L507 HydrophobicContact CG1-CB 4.41Å; V503-L507 WeakPolarHBondContact O-CB 3.25Å; V503-L507 PolarHBondContact O-N 3.36Å; V503-I539 HydrophobicContact CG2-CG2 3.85Å; V503-I540 HydrophobicContact CG1-CD1 4.46Å; V503-I540 HydrophobicContact CG1-CG1 3.89Å
504	R	93.4	Very high	93.1	Very high	96 Å²	96	67.2 Å²	67.2	36%	0.362	36%	0.356	S	S	.	.	H	α-helix	trans	-54	-42	-170	-69.2	-174.1	-173	176.7	-2.1	114.6	P496 E497 A499 P500 I501 L507 T508	P496-R504 WeakPolarHBondContact O-CD 3.33Å; P496-R504 WeakPolarHBondContact O-CG 3.36Å; P496-R504 PolarHBondContact O-NE 3Å; E497-R504 PolarHBondContact O-NH2 2.91Å; A499-R504 HydrophobicContact CB-CG 4.11Å; A499-R504 PolarHBondContact O-NE 3.28Å; A499-R504 PolarHBondContact O-NH2 3.25Å; P500-R504 WeakPolarHBondContact O-CG 3.33Å; P500-R504 PolarHBondContact O-N 3.24Å; I501-R504 PolarHBondContact O-N 2.8Å; R504-L507 PolarHBondContact O-N 3.09Å; R504-T508 WeakPolarHBondContact O-CB 3.28Å; R504-T508 PolarHBondContact O-N 2.99Å; R504-T508 PolarHBondContact O-OG1 3.2Å
505	V	93.9	Very high	93.1	Very high	115 Å²	115	71.8 Å²	71.8	70%	0.697	38%	0.381	S	S	*	.	H	α-helix	trans	-66.7	-49.6	-177.7	177.3	0	0	0	0	110.4	V503 L507 T508 K509	V503-V505 VanDerWaalsContact C-N 3.32Å; V503-V505 PolarHBondContact O-N 3.26Å; V505-L507 VanDerWaalsContact C-N 3.31Å; V505-L507 PolarHBondContact O-N 3.44Å; V505-T508 PolarHBondContact O-N 3.18Å; V505-K509 WeakPolarHBondContact O-CB 3.38Å; V505-K509 PolarHBondContact O-N 2.87Å
506	E	95.6	Very high	93.2	Very high	18 Å²	18	66.8 Å²	66.8	8%	0.084	36%	0.36	C	S	.	.	H	α-helix	trans	-63	-39.4	176.8	-72.5	-171.2	-163.6	0	0	111.7	V503 K509 L510 Y537 P538 I539 I540	V503-E506 PolarHBondContact O-N 3.11Å; E506-K509 PolarHBondContact O-N 3.1Å; E506-L510 VanDerWaalsContact O-CB 3.32Å; E506-L510 WeakPolarHBondContact O-CB 3.09Å; E506-L510 PolarHBondContact O-N 3.06Å; E506-Y537 HydrophobicContact CB-CD1 4.22Å; E506-Y537 VanDerWaalsContact OE2-CA 3.23Å; E506-Y537 WeakPolarHBondContact OE2-CA 3.45Å; E506-P538 WeakPolarHBondContact OE1-CD 3.31Å; E506-P538 WeakPolarHBondContact OE1-CG 3.27Å; E506-I539 VanDerWaalsContact OE1-CB 3.32Å; E506-I539 WeakPolarHBondContact OE1-CB 3.24Å; E506-I539 VanDerWaalsContact OE1-CG1 3.26Å; E506-I539 WeakPolarHBondContact OE1-CG1 3.42Å; E506-I539 PolarHBondContact OE1-N 3.1Å; E506-I539 PolarHBondContact OE2-N 3.2Å; E506-I539 VanDerWaalsContact OE2-N 3.1Å; E506-I540 HydrophobicContact CB-CD1 3.67Å; E506-I540 HydrophobicContact CB-CG1 3.87Å; E506-I540 WeakPolarHBondContact OE2-CG1 3.24Å; E506-I540 PolarHBondContact OE2-N 3.21Å
507	L	95.5	Very high	93.3	Very high	1 Å²	1	69 Å²	69	1%	0.005	36%	0.364	C	S	.	.	H	α-helix	trans	-63.7	-46.8	178.4	-179.3	61.5	0	0	0	111.6	L487 P491 F494 P496 A499 V503 R504 V505 K509 L510 Q511 I540	L487-L507 HydrophobicContact CD1-CD1 3.7Å; L487-L507 HydrophobicContact CD1-CD2 3.54Å; L487-L507 HydrophobicContact CD1-CG 4.25Å; P491-L507 HydrophobicContact CB-CD1 4.29Å; P491-L507 WeakPolarHBondContact O-CD1 3.43Å; F494-L507 HydrophobicContact CD1-CD2 4.1Å; P496-L507 HydrophobicContact CB-CD2 4.41Å; P496-L507 HydrophobicContact CG-CD2 4.43Å; A499-L507 HydrophobicContact CB-CD2 3.85Å; V503-L507 HydrophobicContact CG1-CB 4.41Å; V503-L507 WeakPolarHBondContact O-CB 3.25Å; V503-L507 PolarHBondContact O-N 3.36Å; R504-L507 PolarHBondContact O-N 3.09Å; V505-L507 VanDerWaalsContact C-N 3.31Å; V505-L507 PolarHBondContact O-N 3.44Å; L507-K509 VanDerWaalsContact C-N 3.29Å; L507-K509 PolarHBondContact O-N 3.02Å; L507-L510 WeakPolarHBondContact O-CB 3.16Å; L507-L510 PolarHBondContact O-N 3.41Å; L507-L510 VanDerWaalsContact O-N 3.16Å; L507-Q511 HydrophobicContact CD1-CG 4.24Å; L507-Q511 HydrophobicContact CG-CG 4.45Å; L507-Q511 WeakPolarHBondContact O-CB 3.25Å; L507-Q511 VanDerWaalsContact O-CG 3.28Å; L507-Q511 WeakPolarHBondContact O-CG 3.31Å; L507-Q511 PolarHBondContact O-N 3.46Å; L507-I540 HydrophobicContact CB-CD1 4.44Å
508	T	94.8	Very high	93.3	Very high	74 Å²	74	65.5 Å²	65.5	45%	0.454	35%	0.349	S	S	.	.	H	α-helix	trans	-61.9	-41.7	177.9	-52.9	0	0	0	0	110.6	R504 V505 Q511 A512	R504-T508 WeakPolarHBondContact O-CB 3.28Å; R504-T508 PolarHBondContact O-N 2.99Å; R504-T508 PolarHBondContact O-OG1 3.2Å; V505-T508 PolarHBondContact O-N 3.18Å; T508-Q511 PolarHBondContact O-N 3.46Å; T508-A512 WeakPolarHBondContact O-CB 3.11Å; T508-A512 PolarHBondContact O-N 3.22Å
509	K	95.8	Very high	93.4	Very high	96 Å²	96	62.3 Å²	62.3	42%	0.417	34%	0.339	S	S	.	.	H	α-helix	trans	-63.6	-39.7	175.1	-178.2	-172.6	169.7	-172.3	0	112	V505 E506 L507 S536 Y537	V505-K509 WeakPolarHBondContact O-CB 3.38Å; V505-K509 PolarHBondContact O-N 2.87Å; E506-K509 PolarHBondContact O-N 3.1Å; L507-K509 VanDerWaalsContact C-N 3.29Å; L507-K509 PolarHBondContact O-N 3.02Å; K509-S536 PolarHBondContact NZ-O 2.64Å; K509-S536 PolarHBondContact NZ-OG 3.19Å; K509-Y537 HydrophobicContact CB-CE1 4.26Å; K509-Y537 HydrophobicContact CD-CE1 4Å; K509-Y537 HydrophobicContact CG-CE1 4.06Å
510	L	96.1	Very high	93.5	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-65	-48.5	176.6	-178	152.9	0	0	0	110.4	P491 F492 E506 L507 A512 N513 L516 F528 L532 Y537 I540	P491-L510 HydrophobicContact CB-CD2 4.17Å; F492-L510 HydrophobicContact CD1-CD2 4.17Å; F492-L510 HydrophobicContact CD2-CD2 4.12Å; F492-L510 HydrophobicContact CE1-CD2 3.74Å; F492-L510 WeakPolarHBondContact CE1-O 3.24Å; F492-L510 HydrophobicContact CE2-CD2 3.66Å; F492-L510 HydrophobicContact CG-CD2 4.34Å; F492-L510 HydrophobicContact CZ-CD2 3.45Å; F492-L510 VanDerWaalsContact CZ-CD2 3.45Å; F492-L510 HydrophobicContact CZ-CG 4.3Å; E506-L510 VanDerWaalsContact O-CB 3.32Å; E506-L510 WeakPolarHBondContact O-CB 3.09Å; E506-L510 PolarHBondContact O-N 3.06Å; L507-L510 WeakPolarHBondContact O-CB 3.16Å; L507-L510 PolarHBondContact O-N 3.41Å; L507-L510 VanDerWaalsContact O-N 3.16Å; L510-A512 VanDerWaalsContact C-N 3.31Å; L510-A512 PolarHBondContact O-N 3.42Å; L510-N513 WeakPolarHBondContact O-CB 3.22Å; L510-N513 PolarHBondContact O-N 2.76Å; L510-N513 VanDerWaalsContact O-N 3.09Å; L510-L516 HydrophobicContact CG-CD1 4.33Å; L510-F528 HydrophobicContact CD1-CE1 4.36Å; L510-F528 HydrophobicContact CD1-CZ 4.15Å; L510-F528 HydrophobicContact CD2-CZ 4.41Å; L510-F528 HydrophobicContact CG-CZ 4.46Å; L510-L532 HydrophobicContact CD1-CD1 4.1Å; L510-L532 HydrophobicContact CD1-CD2 4.35Å; L510-Y537 HydrophobicContact CB-CD1 4.36Å; L510-Y537 HydrophobicContact CB-CE1 3.76Å; L510-I540 HydrophobicContact CB-CD1 4.38Å; L510-I540 HydrophobicContact CD1-CD1 3.91Å; L510-I540 HydrophobicContact CD1-CG2 4.35Å
511	Q	95.8	Very high	93.6	Very high	52 Å²	52	70 Å²	70	24%	0.243	36%	0.362	C	S	.	.	H	α-helix	trans	-63.2	-33.6	-179.5	-73.5	177.7	-13.6	0	0	113.4	P491 F494 P496 L507 T508 N513	P491-Q511 PolarHBondContact O-NE2 3.48Å; F494-Q511 PolarHBondContact O-NE2 3.05Å; P496-Q511 VanDerWaalsContact CG-OE1 3.3Å; L507-Q511 HydrophobicContact CD1-CG 4.24Å; L507-Q511 HydrophobicContact CG-CG 4.45Å; L507-Q511 WeakPolarHBondContact O-CB 3.25Å; L507-Q511 VanDerWaalsContact O-CG 3.28Å; L507-Q511 WeakPolarHBondContact O-CG 3.31Å; L507-Q511 PolarHBondContact O-N 3.46Å; T508-Q511 PolarHBondContact O-N 3.46Å; Q511-N513 PolarHBondContact O-N 3.46Å
512	A	95.3	Very high	93.7	Very high	80 Å²	80	70.4 Å²	70.4	66%	0.661	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-9.7	176.7	0	0	0	0	0	113.8	T508 L510	T508-A512 WeakPolarHBondContact O-CB 3.11Å; T508-A512 PolarHBondContact O-N 3.22Å; L510-A512 VanDerWaalsContact C-N 3.31Å; L510-A512 PolarHBondContact O-N 3.42Å
513	N	95.6	Very high	93.7	Very high	53 Å²	53	70.2 Å²	70.2	28%	0.283	35%	0.354	S	S	.	.			trans	-93.6	105.6	-174.5	-171.3	-32.8	0	0	0	111.9	L510 Q511 N515 L516 W517	L510-N513 WeakPolarHBondContact O-CB 3.22Å; L510-N513 PolarHBondContact O-N 2.76Å; L510-N513 VanDerWaalsContact O-N 3.09Å; Q511-N513 PolarHBondContact O-N 3.46Å; N513-N515 VanDerWaalsContact C-N 3.3Å; N513-N515 PolarHBondContact O-N 3.29Å; N513-N515 WeakPolarHBondContact OD1-CB 3.39Å; N513-N515 PolarHBondContact OD1-N 3.5Å; N513-L516 HydrophobicContact CB-CB 4.11Å; N513-L516 HydrophobicContact CB-CD1 3.93Å; N513-L516 HydrophobicContact CB-CG 4.07Å; N513-L516 PolarHBondContact O-N 3.2Å; N513-L516 PolarHBondContact OD1-N 2.85Å; N513-L516 VanDerWaalsContact OD1-N 3.16Å; N513-W517 PolarHBondContact O-N 2.79Å
514	T	93.9	Very high	93.4	Very high	96 Å²	96	73.4 Å²	73.4	59%	0.589	37%	0.37	S	S	*	.	H	α-helix	trans	-63.5	-31.4	-179.7	-45.3	0	0	0	0	113.5	W517 N518	T514-W517 PolarHBondContact O-N 2.97Å; T514-N518 VanDerWaalsContact O-CG 3.3Å; T514-N518 PolarHBondContact O-N 2.98Å; T514-N518 PolarHBondContact O-ND2 3.43Å
515	N	94.6	Very high	93	Very high	114 Å²	114	70.5 Å²	70.5	61%	0.61	36%	0.362	S	S	*	.	H	α-helix	trans	-69.3	-45.3	178.3	-66.7	-21	0	0	0	110.6	N513 W517 N518 E519	N513-N515 VanDerWaalsContact C-N 3.3Å; N513-N515 PolarHBondContact O-N 3.29Å; N513-N515 WeakPolarHBondContact OD1-CB 3.39Å; N513-N515 PolarHBondContact OD1-N 3.5Å; N515-W517 VanDerWaalsContact C-N 3.29Å; N515-W517 PolarHBondContact O-N 3.09Å; N515-N518 PolarHBondContact O-N 3.08Å; N515-N518 VanDerWaalsContact O-N 3.14Å; N515-E519 PolarHBondContact O-N 3.12Å
516	L	94.9	Very high	92.6	Very high	18 Å²	18	66 Å²	66	9%	0.094	34%	0.338	C	S	.	.	H	α-helix	trans	-62.7	-36.9	175.4	-66.9	-179.7	0	0	0	111.7	F492 L510 N513 N518 E519 Y520 F528 L532 Y537	F492-L516 HydrophobicContact CZ-CB 4.01Å; L510-L516 HydrophobicContact CG-CD1 4.33Å; N513-L516 HydrophobicContact CB-CB 4.11Å; N513-L516 HydrophobicContact CB-CD1 3.93Å; N513-L516 HydrophobicContact CB-CG 4.07Å; N513-L516 PolarHBondContact O-N 3.2Å; N513-L516 PolarHBondContact OD1-N 2.85Å; N513-L516 VanDerWaalsContact OD1-N 3.16Å; L516-N518 VanDerWaalsContact C-N 3.34Å; L516-N518 PolarHBondContact O-N 3.47Å; L516-E519 PolarHBondContact O-N 2.94Å; L516-Y520 WeakPolarHBondContact O-CB 3.18Å; L516-Y520 PolarHBondContact O-N 3.24Å; L516-F528 HydrophobicContact CB-CE2 4.21Å; L516-F528 WeakPolarHBondContact O-CE2 3.11Å; L516-L532 HydrophobicContact CD1-CD2 3.97Å; L516-L532 HydrophobicContact CD2-CD2 3.82Å; L516-Y537 HydrophobicContact CD1-CE2 3.82Å; L516-Y537 WeakPolarHBondContact CD1-OH 3.17Å
517	W	93.1	Very high	92.3	Very high	86 Å²	86	70.3 Å²	70.3	33%	0.326	36%	0.358	S	S	.	.	H	α-helix	trans	-60.5	-43.1	173.1	173.9	-113.5	0	0	0	112.4	F492 N513 T514 N515 Y520 R521	F492-W517 HydrophobicContact CB-CE3 3.54Å; F492-W517 HydrophobicContact CB-CH2 4.34Å; F492-W517 HydrophobicContact CB-CZ3 3.27Å; F492-W517 HydrophobicContact CD1-CB 4.24Å; F492-W517 HydrophobicContact CD1-CD2 4.25Å; F492-W517 AromaticContact CD1-CE3 3.45Å; F492-W517 HydrophobicContact CD1-CE3 3.45Å; F492-W517 VanDerWaalsContact CD1-CE3 3.45Å; F492-W517 HydrophobicContact CD1-CZ3 4.14Å; F492-W517 AromaticContact CD2-CE3 3.61Å; F492-W517 HydrophobicContact CD2-CE3 3.61Å; F492-W517 AromaticContact CD2-CZ3 3.94Å; F492-W517 HydrophobicContact CD2-CZ3 3.94Å; F492-W517 HydrophobicContact CE1-CB 3.74Å; F492-W517 AromaticContact CE1-CE3 4Å; F492-W517 HydrophobicContact CE1-CE3 4Å; F492-W517 HydrophobicContact CE2-CE3 4.14Å; F492-W517 HydrophobicContact CG-CD2 4.4Å; F492-W517 AromaticContact CG-CE3 3.24Å; F492-W517 HydrophobicContact CG-CE3 3.24Å; F492-W517 AromaticContact CG-CZ3 3.54Å; F492-W517 HydrophobicContact CG-CZ3 3.54Å; F492-W517 HydrophobicContact CZ-CB 4.11Å; F492-W517 HydrophobicContact CZ-CE3 4.32Å; N513-W517 PolarHBondContact O-N 2.79Å; T514-W517 PolarHBondContact O-N 2.97Å; N515-W517 VanDerWaalsContact C-N 3.29Å; N515-W517 PolarHBondContact O-N 3.09Å; W517-Y520 AromaticContact CE3-CD1 3.99Å; W517-Y520 HydrophobicContact CE3-CD1 3.99Å; W517-Y520 AromaticContact CZ3-CD1 3.83Å; W517-Y520 HydrophobicContact CZ3-CD1 3.83Å; W517-Y520 HydrophobicContact CZ3-CE1 4.07Å; W517-Y520 PolarHBondContact O-N 3.01Å; W517-R521 WeakPolarHBondContact O-CG 3.35Å; W517-R521 PolarHBondContact O-N 2.84Å
518	N	93.3	Very high	92.1	Very high	70 Å²	70	70.3 Å²	70.3	37%	0.374	36%	0.358	S	S	.	.	H	α-helix	trans	-66.1	-40.2	177.2	-69.3	-29.6	0	0	0	111.7	T514 N515 L516 R521 I522	T514-N518 VanDerWaalsContact O-CG 3.3Å; T514-N518 PolarHBondContact O-N 2.98Å; T514-N518 PolarHBondContact O-ND2 3.43Å; N515-N518 PolarHBondContact O-N 3.08Å; N515-N518 VanDerWaalsContact O-N 3.14Å; L516-N518 VanDerWaalsContact C-N 3.34Å; L516-N518 PolarHBondContact O-N 3.47Å; N518-R521 PolarHBondContact O-N 2.9Å; N518-I522 WeakPolarHBondContact O-CG1 3.45Å
519	E	93.3	Very high	92	Very high	70 Å²	70	66.8 Å²	66.8	33%	0.327	34%	0.337	S	S	.	.	H	α-helix	trans	-63.4	-45.2	175.2	-72	-170.4	-160.9	0	0	112.4	N515 L516 R521 I522 K523 F528	N515-E519 PolarHBondContact O-N 3.12Å; L516-E519 PolarHBondContact O-N 2.94Å; E519-R521 PolarHBondContact O-N 3.27Å; E519-I522 PolarHBondContact O-N 3.4Å; E519-K523 HydrophobicContact CB-CD 4.32Å; E519-K523 WeakPolarHBondContact O-CB 3.36Å; E519-K523 PolarHBondContact O-N 3.39Å; E519-K523 IonicContact OE2-NZ 2.63Å; E519-K523 PolarHBondContact OE2-NZ 3.03Å; E519-F528 HydrophobicContact CB-CD2 4.46Å
520	Y	91.8	Very high	91.7	Very high	42 Å²	42	63.8 Å²	63.8	17%	0.165	33%	0.33	C	S	.	.	H	α-helix	trans	-56	-32.3	177.6	173.4	-99.9	0	0	0	113.1	S489 P491 F492 L516 W517 I522 L525 F528	S489-Y520 PolarHBondContact O-OH 3.34Å; S489-Y520 VanDerWaalsContact O-OH 3.08Å; P491-Y520 HydrophobicContact CG-CD2 4.42Å; P491-Y520 HydrophobicContact CG-CE2 4.07Å; F492-Y520 AromaticContact CD2-CD1 3.76Å; F492-Y520 HydrophobicContact CD2-CD1 3.76Å; F492-Y520 HydrophobicContact CD2-CD2 4.05Å; F492-Y520 HydrophobicContact CD2-CE1 4.22Å; F492-Y520 HydrophobicContact CD2-CE2 4.45Å; F492-Y520 AromaticContact CD2-CG 3.68Å; F492-Y520 HydrophobicContact CD2-CG 3.68Å; F492-Y520 HydrophobicContact CE2-CD1 4.13Å; F492-Y520 HydrophobicContact CE2-CD2 4.02Å; F492-Y520 AromaticContact CE2-CG 3.63Å; F492-Y520 HydrophobicContact CE2-CG 3.63Å; L516-Y520 WeakPolarHBondContact O-CB 3.18Å; L516-Y520 PolarHBondContact O-N 3.24Å; W517-Y520 AromaticContact CE3-CD1 3.99Å; W517-Y520 HydrophobicContact CE3-CD1 3.99Å; W517-Y520 AromaticContact CZ3-CD1 3.83Å; W517-Y520 HydrophobicContact CZ3-CD1 3.83Å; W517-Y520 HydrophobicContact CZ3-CE1 4.07Å; W517-Y520 PolarHBondContact O-N 3.01Å; Y520-I522 VanDerWaalsContact C-N 3.32Å; Y520-L525 HydrophobicContact CD2-CD2 4.12Å; Y520-L525 HydrophobicContact CE2-CD2 3.33Å; Y520-F528 AromaticContact CD2-CD1 3.97Å; Y520-F528 HydrophobicContact CD2-CD1 3.97Å; Y520-F528 HydrophobicContact CD2-CD2 4.39Å; Y520-F528 HydrophobicContact CD2-CE1 4.14Å; Y520-F528 HydrophobicContact CD2-CG 4.09Å; Y520-F528 HydrophobicContact CD2-CZ 4.43Å
521	R	90.1	Very high	91.4	Very high	174 Å²	174	66 Å²	66	66%	0.657	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-17	180	-71.3	178.6	65.5	-158.3	-0.4	114.1	W517 N518 E519	W517-R521 WeakPolarHBondContact O-CG 3.35Å; W517-R521 PolarHBondContact O-N 2.84Å; N518-R521 PolarHBondContact O-N 2.9Å; E519-R521 PolarHBondContact O-N 3.27Å
522	I	90.9	Very high	91.3	Very high	145 Å²	145	63.7 Å²	63.7	74%	0.744	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.1	-37.4	-172.6	-58.9	169.8	0	0	0	110.8	N518 E519 Y520	N518-I522 WeakPolarHBondContact O-CG1 3.45Å; E519-I522 PolarHBondContact O-N 3.4Å; Y520-I522 VanDerWaalsContact C-N 3.32Å
523	K	87.9	Confident	91.1	Very high	71 Å²	71	62.4 Å²	62.4	31%	0.309	33%	0.328	S	S	.	.	S	Bend	trans	-85.5	153.2	-180	-65.9	179.3	179	175.1	0	111	E519 Q527 F528	E519-K523 HydrophobicContact CB-CD 4.32Å; E519-K523 WeakPolarHBondContact O-CB 3.36Å; E519-K523 PolarHBondContact O-N 3.39Å; E519-K523 IonicContact OE2-NZ 2.63Å; E519-K523 PolarHBondContact OE2-NZ 3.03Å; K523-Q527 HydrophobicContact CB-CB 3.95Å; K523-Q527 HydrophobicContact CD-CB 4.29Å; K523-Q527 HydrophobicContact CG-CB 4.35Å; K523-F528 HydrophobicContact CB-CB 4.4Å
524	D	86.1	Confident	90.8	Very high	70 Å²	70	62.9 Å²	62.9	37%	0.374	34%	0.339	S	S	.	.			trans	-67.3	163.6	161.4	69	76.3	0	0	0	110.6	G526 Q527 F528	D524-G526 VanDerWaalsContact C-N 3.29Å; D524-G526 PolarHBondContact O-N 3.45Å; D524-G526 WeakPolarHBondContact OD1-CA 3.29Å; D524-G526 PolarHBondContact OD1-N 3.08Å; D524-Q527 PolarHBondContact O-N 2.93Å; D524-Q527 PolarHBondContact OD1-N 3.22Å; D524-Q527 WeakPolarHBondContact OD2-CG 3.47Å; D524-Q527 PolarHBondContact OD2-NE2 3.18Å; D524-Q527 VanDerWaalsContact OD2-NE2 3.15Å; D524-Q527 PolarHBondContact OD2-OE1 3.48Å; D524-F528 WeakPolarHBondContact O-CB 3.44Å; D524-F528 PolarHBondContact O-N 3.36Å
525	L	86	Confident	90.6	Very high	36 Å²	36	67 Å²	67	19%	0.188	35%	0.352	C	S	.	.	H	α-helix	trans	-63.5	-35.7	-173.5	-58.6	166.4	0	0	0	112.3	V403 F404 Y520 F528 Y529	V403-L525 HydrophobicContact CG1-CB 3.71Å; F404-L525 HydrophobicContact CD2-CB 4.04Å; F404-L525 HydrophobicContact CD2-CD1 3.71Å; F404-L525 HydrophobicContact CE2-CB 3.57Å; F404-L525 HydrophobicContact CE2-CD1 4.04Å; F404-L525 HydrophobicContact CE2-CG 4.41Å; Y520-L525 HydrophobicContact CD2-CD2 4.12Å; Y520-L525 HydrophobicContact CE2-CD2 3.33Å; L525-F528 PolarHBondContact O-N 3.2Å; L525-Y529 HydrophobicContact CB-CD2 4.47Å; L525-Y529 HydrophobicContact CB-CE2 4.46Å; L525-Y529 WeakPolarHBondContact O-CD2 3.47Å; L525-Y529 PolarHBondContact O-N 3.14Å
526	G	84.9	Confident	90.5	Very high	19 Å²	19	63.8 Å²	63.8	20%	0.196	34%	0.338	C	S	.	.	H	α-helix	trans	-61.5	-51.4	177.4	0	0	0	0	0	110.8	D524 F528 Y529 A530	D524-G526 VanDerWaalsContact C-N 3.29Å; D524-G526 PolarHBondContact O-N 3.45Å; D524-G526 WeakPolarHBondContact OD1-CA 3.29Å; D524-G526 PolarHBondContact OD1-N 3.08Å; G526-F528 VanDerWaalsContact C-N 3.31Å; G526-F528 PolarHBondContact O-N 2.9Å; G526-Y529 PolarHBondContact O-N 3.28Å; G526-A530 VanDerWaalsContact O-CB 3.28Å; G526-A530 WeakPolarHBondContact O-CB 3.41Å; G526-A530 PolarHBondContact O-N 3.13Å
527	Q	88.3	Confident	90.4	Very high	109 Å²	109	63.4 Å²	63.4	51%	0.509	34%	0.336	S	S	.	.	H	α-helix	trans	-60.6	-37.4	175.4	-73.1	177.4	1.7	0	0	113.3	K523 D524 G531	K523-Q527 HydrophobicContact CB-CB 3.95Å; K523-Q527 HydrophobicContact CD-CB 4.29Å; K523-Q527 HydrophobicContact CG-CB 4.35Å; D524-Q527 PolarHBondContact O-N 2.93Å; D524-Q527 PolarHBondContact OD1-N 3.22Å; D524-Q527 WeakPolarHBondContact OD2-CG 3.47Å; D524-Q527 PolarHBondContact OD2-NE2 3.18Å; D524-Q527 VanDerWaalsContact OD2-NE2 3.15Å; D524-Q527 PolarHBondContact OD2-OE1 3.48Å; Q527-G531 PolarHBondContact O-N 3.13Å; Q527-G531 VanDerWaalsContact O-N 3.09Å
528	F	91.9	Very high	90.4	Very high	1 Å²	1	62.5 Å²	62.5	0%	0.004	34%	0.341	C	S	.	.	H	α-helix	trans	-62.7	-51.8	176.1	170.6	-104.1	0	0	0	111.2	P491 F492 L510 L516 E519 Y520 K523 D524 L525 G526 A530 G531 L532	P491-F528 HydrophobicContact CG-CE1 4.27Å; F492-F528 HydrophobicContact CE2-CE1 4.35Å; F492-F528 HydrophobicContact CE2-CE2 4.12Å; F492-F528 AromaticContact CE2-CZ 3.65Å; F492-F528 HydrophobicContact CE2-CZ 3.65Å; F492-F528 HydrophobicContact CZ-CE2 4.42Å; F492-F528 HydrophobicContact CZ-CZ 4.08Å; L510-F528 HydrophobicContact CD1-CE1 4.36Å; L510-F528 HydrophobicContact CD1-CZ 4.15Å; L510-F528 HydrophobicContact CD2-CZ 4.41Å; L510-F528 HydrophobicContact CG-CZ 4.46Å; L516-F528 HydrophobicContact CB-CE2 4.21Å; L516-F528 WeakPolarHBondContact O-CE2 3.11Å; E519-F528 HydrophobicContact CB-CD2 4.46Å; Y520-F528 AromaticContact CD2-CD1 3.97Å; Y520-F528 HydrophobicContact CD2-CD1 3.97Å; Y520-F528 HydrophobicContact CD2-CD2 4.39Å; Y520-F528 HydrophobicContact CD2-CE1 4.14Å; Y520-F528 HydrophobicContact CD2-CG 4.09Å; Y520-F528 HydrophobicContact CD2-CZ 4.43Å; K523-F528 HydrophobicContact CB-CB 4.4Å; D524-F528 WeakPolarHBondContact O-CB 3.44Å; D524-F528 PolarHBondContact O-N 3.36Å; L525-F528 PolarHBondContact O-N 3.2Å; G526-F528 VanDerWaalsContact C-N 3.31Å; G526-F528 PolarHBondContact O-N 2.9Å; F528-A530 PolarHBondContact O-N 3.03Å; F528-G531 PolarHBondContact O-N 3.43Å; F528-L532 HydrophobicContact CE2-CD2 4.35Å; F528-L532 HydrophobicContact CZ-CD2 4.09Å; F528-L532 PolarHBondContact O-N 2.95Å
529	Y	91.9	Very high	90.4	Very high	1 Å²	1	62.3 Å²	62.3	0%	0.004	34%	0.339	C	S	.	.	H	α-helix	trans	-67.1	-36.4	179.5	-75.8	-65.4	0	0	0	112.6	F404 F488 P491 L525 G526 G531 L532 I540 K541 A544	F404-Y529 AromaticContact CE2-CD2 3.9Å; F404-Y529 HydrophobicContact CE2-CD2 3.9Å; F404-Y529 AromaticContact CE2-CE2 3.86Å; F404-Y529 HydrophobicContact CE2-CE2 3.86Å; F404-Y529 AromaticContact CZ-CD2 3.79Å; F404-Y529 HydrophobicContact CZ-CD2 3.79Å; F404-Y529 HydrophobicContact CZ-CE2 4.06Å; F488-Y529 VanDerWaalsContact CA-OH 3.3Å; F488-Y529 WeakPolarHBondContact CA-OH 3.43Å; F488-Y529 AromaticContact CD1-CE1 3.87Å; F488-Y529 HydrophobicContact CD1-CE1 3.87Å; F488-Y529 HydrophobicContact CD1-CE2 4.38Å; F488-Y529 AromaticContact CD1-CZ 3.71Å; F488-Y529 HydrophobicContact CE1-CE1 4.27Å; F488-Y529 VanDerWaalsContact O-CE2 3.31Å; F488-Y529 WeakPolarHBondContact O-CE2 3.45Å; F488-Y529 PolarHBondContact O-OH 3.04Å; P491-Y529 VanDerWaalsContact CG-OH 3.32Å; P491-Y529 WeakPolarHBondContact CG-OH 3.23Å; L525-Y529 HydrophobicContact CB-CD2 4.47Å; L525-Y529 HydrophobicContact CB-CE2 4.46Å; L525-Y529 WeakPolarHBondContact O-CD2 3.47Å; L525-Y529 PolarHBondContact O-N 3.14Å; G526-Y529 PolarHBondContact O-N 3.28Å; Y529-G531 VanDerWaalsContact C-N 3.29Å; Y529-G531 PolarHBondContact O-N 3.29Å; Y529-L532 HydrophobicContact CD1-CD1 3.71Å; Y529-L532 HydrophobicContact CE1-CD1 4.26Å; Y529-L532 PolarHBondContact O-N 3.1Å; Y529-I540 HydrophobicContact CD1-CG2 4.05Å; Y529-I540 HydrophobicContact CE1-CG2 3.74Å; Y529-K541 VanDerWaalsContact O-CE 3.27Å; Y529-K541 WeakPolarHBondContact O-CE 3.34Å; Y529-A544 HydrophobicContact CD1-CB 3.73Å; Y529-A544 HydrophobicContact CD2-CB 4.28Å; Y529-A544 HydrophobicContact CE1-CB 4.26Å; Y529-A544 HydrophobicContact CG-CB 3.76Å
530	A	89.9	Confident	90.3	Very high	32 Å²	32	59.2 Å²	59.2	26%	0.264	33%	0.325	S	S	.	.	H	α-helix	trans	-55.1	-45.8	172.5	0	0	0	0	0	111.6	E201 L202 G526 F528 L532 K541	E201-A530 WeakPolarHBondContact O-CB 3.19Å; L202-A530 HydrophobicContact CB-CB 4.13Å; G526-A530 VanDerWaalsContact O-CB 3.28Å; G526-A530 WeakPolarHBondContact O-CB 3.41Å; G526-A530 PolarHBondContact O-N 3.13Å; F528-A530 PolarHBondContact O-N 3.03Å; A530-L532 VanDerWaalsContact C-N 3.27Å; A530-L532 PolarHBondContact O-N 3.49Å; A530-K541 PolarHBondContact O-NZ 3.38Å
531	G	90.8	Very high	90.3	Very high	46 Å²	46	58.6 Å²	58.6	47%	0.474	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-10.1	-178	0	0	0	0	0	115.7	Q527 F528 Y529	Q527-G531 PolarHBondContact O-N 3.13Å; Q527-G531 VanDerWaalsContact O-N 3.09Å; F528-G531 PolarHBondContact O-N 3.43Å; Y529-G531 VanDerWaalsContact C-N 3.29Å; Y529-G531 PolarHBondContact O-N 3.29Å
532	L	92.6	Very high	90.2	Very high	4 Å²	4	52 Å²	52	2%	0.021	31%	0.309	C	S	.	.	S	Bend	trans	-65.6	141.3	176	-65	-179.1	0	0	0	111.1	L510 L516 F528 Y529 A530 A534 Y537 I540 K541	L510-L532 HydrophobicContact CD1-CD1 4.1Å; L510-L532 HydrophobicContact CD1-CD2 4.35Å; L516-L532 HydrophobicContact CD1-CD2 3.97Å; L516-L532 HydrophobicContact CD2-CD2 3.82Å; F528-L532 HydrophobicContact CE2-CD2 4.35Å; F528-L532 HydrophobicContact CZ-CD2 4.09Å; F528-L532 PolarHBondContact O-N 2.95Å; Y529-L532 HydrophobicContact CD1-CD1 3.71Å; Y529-L532 HydrophobicContact CE1-CD1 4.26Å; Y529-L532 PolarHBondContact O-N 3.1Å; A530-L532 VanDerWaalsContact C-N 3.27Å; A530-L532 PolarHBondContact O-N 3.49Å; L532-A534 PolarHBondContact O-N 2.76Å; L532-Y537 HydrophobicContact CB-CD2 4.35Å; L532-Y537 HydrophobicContact CD2-CD2 4.29Å; L532-I540 HydrophobicContact CD1-CG2 3.76Å; L532-K541 HydrophobicContact CB-CD 4.06Å; L532-K541 HydrophobicContact CB-CG 3.93Å; L532-K541 HydrophobicContact CD1-CG 4.48Å; L532-K541 WeakPolarHBondContact O-CD 3.48Å; L532-K541 WeakPolarHBondContact O-CE 3.48Å; L532-K541 PolarHBondContact O-NZ 3.36Å
533	S	91.3	Very high	90.1	Very high	53 Å²	53	46 Å²	46	37%	0.371	28%	0.279	S	S	.	.			trans	-66.5	122.8	172.9	161.6	0	0	0	0	110.4	E535 S536 Y537	S533-E535 PolarHBondContact O-N 3.14Å; S533-E535 PolarHBondContact OG-N 2.96Å; S533-S536 PolarHBondContact O-N 3.5Å; S533-S536 PolarHBondContact OG-N 3.47Å; S533-Y537 PolarHBondContact O-N 3.37Å
534	A	88.6	Confident	90.2	Very high	64 Å²	64	42.6 Å²	42.6	53%	0.529	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-26.3	178.4	0	0	0	0	0	112.9	L532 P538 K541	L532-A534 PolarHBondContact O-N 2.76Å; A534-P538 WeakPolarHBondContact O-CA 3.48Å; A534-P538 WeakPolarHBondContact O-CB 3.25Å; A534-P538 WeakPolarHBondContact O-CD 3.44Å; A534-K541 HydrophobicContact CB-CD 4.32Å
535	E	90.7	Very high	90.5	Very high	182 Å²	182	39.6 Å²	39.6	85%	0.85	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-36.5	175.7	-61.7	-179.4	172	0	0	112	S533	S533-E535 PolarHBondContact O-N 3.14Å; S533-E535 PolarHBondContact OG-N 2.96Å
536	S	92	Very high	90.7	Very high	46 Å²	46	41 Å²	41	32%	0.322	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-25.2	-175.6	-86.9	0	0	0	0	114.7	K509 S533 P538	K509-S536 PolarHBondContact NZ-O 2.64Å; K509-S536 PolarHBondContact NZ-OG 3.19Å; S533-S536 PolarHBondContact O-N 3.5Å; S533-S536 PolarHBondContact OG-N 3.47Å; S536-P538 VanDerWaalsContact C-CD 3.48Å
537	Y	94.1	Very high	90.9	Very high	10 Å²	10	40.4 Å²	40.4	4%	0.039	25%	0.246	C	C	.	.			trans	-137	47.5	-175.8	-56.4	-78.6	0	0	0	112.9	E506 K509 L510 L516 L532 S533 I539 I540 K541	E506-Y537 HydrophobicContact CB-CD1 4.22Å; E506-Y537 VanDerWaalsContact OE2-CA 3.23Å; E506-Y537 WeakPolarHBondContact OE2-CA 3.45Å; K509-Y537 HydrophobicContact CB-CE1 4.26Å; K509-Y537 HydrophobicContact CD-CE1 4Å; K509-Y537 HydrophobicContact CG-CE1 4.06Å; L510-Y537 HydrophobicContact CB-CD1 4.36Å; L510-Y537 HydrophobicContact CB-CE1 3.76Å; L516-Y537 HydrophobicContact CD1-CE2 3.82Å; L516-Y537 WeakPolarHBondContact CD1-OH 3.17Å; L532-Y537 HydrophobicContact CB-CD2 4.35Å; L532-Y537 HydrophobicContact CD2-CD2 4.29Å; S533-Y537 PolarHBondContact O-N 3.37Å; Y537-I539 VanDerWaalsContact C-N 3.32Å; Y537-I539 PolarHBondContact O-N 2.89Å; Y537-I540 HydrophobicContact CD1-CD1 4.38Å; Y537-K541 WeakPolarHBondContact O-CG 3.45Å; Y537-K541 PolarHBondContact O-N 3.46Å
538	P	92.5	Very high	90.9	Very high	68 Å²	68	35.4 Å²	35.4	44%	0.442	22%	0.223	S	C	.	.	H	α-helix	trans	-61.2	-37.3	-176.4	23.5	-33.5	0	0	0	113.3	E506 A534 S536 G542	E506-P538 WeakPolarHBondContact OE1-CD 3.31Å; E506-P538 WeakPolarHBondContact OE1-CG 3.27Å; A534-P538 WeakPolarHBondContact O-CA 3.48Å; A534-P538 WeakPolarHBondContact O-CB 3.25Å; A534-P538 WeakPolarHBondContact O-CD 3.44Å; S536-P538 VanDerWaalsContact C-CD 3.48Å; P538-G542 PolarHBondContact O-N 3.11Å
539	I	92.1	Very high	91	Very high	66 Å²	66	35.3 Å²	35.3	34%	0.338	22%	0.223	S	C	.	.	H	α-helix	trans	-74.4	-47.3	-177.1	-58.1	171.1	0	0	0	109.9	S502 V503 E506 Y537 K541 G542 V543	S502-I539 WeakPolarHBondContact O-CD1 3.3Å; V503-I539 HydrophobicContact CG2-CG2 3.85Å; E506-I539 VanDerWaalsContact OE1-CB 3.32Å; E506-I539 WeakPolarHBondContact OE1-CB 3.24Å; E506-I539 VanDerWaalsContact OE1-CG1 3.26Å; E506-I539 WeakPolarHBondContact OE1-CG1 3.42Å; E506-I539 PolarHBondContact OE1-N 3.1Å; E506-I539 PolarHBondContact OE2-N 3.2Å; E506-I539 VanDerWaalsContact OE2-N 3.1Å; Y537-I539 VanDerWaalsContact C-N 3.32Å; Y537-I539 PolarHBondContact O-N 2.89Å; I539-K541 PolarHBondContact O-N 3.11Å; I539-G542 PolarHBondContact O-N 3.47Å; I539-V543 HydrophobicContact CG2-CG2 4.48Å; I539-V543 WeakPolarHBondContact O-CG2 3.4Å; I539-V543 PolarHBondContact O-N 3.19Å
540	I	92.4	Very high	91	Very high	4 Å²	4	35.4 Å²	35.4	2%	0.021	22%	0.223	C	C	.	.	H	α-helix	trans	-59.7	-46.5	177.1	-73.1	-178.2	0	0	0	110.5	F488 V503 E506 L507 L510 Y529 L532 Y537 G542 V543 A544	F488-I540 HydrophobicContact CE1-CG2 4.04Å; F488-I540 WeakPolarHBondContact CE1-O 3.26Å; V503-I540 HydrophobicContact CG1-CD1 4.46Å; V503-I540 HydrophobicContact CG1-CG1 3.89Å; E506-I540 HydrophobicContact CB-CD1 3.67Å; E506-I540 HydrophobicContact CB-CG1 3.87Å; E506-I540 WeakPolarHBondContact OE2-CG1 3.24Å; E506-I540 PolarHBondContact OE2-N 3.21Å; L507-I540 HydrophobicContact CB-CD1 4.44Å; L510-I540 HydrophobicContact CB-CD1 4.38Å; L510-I540 HydrophobicContact CD1-CD1 3.91Å; L510-I540 HydrophobicContact CD1-CG2 4.35Å; Y529-I540 HydrophobicContact CD1-CG2 4.05Å; Y529-I540 HydrophobicContact CE1-CG2 3.74Å; L532-I540 HydrophobicContact CD1-CG2 3.76Å; Y537-I540 HydrophobicContact CD1-CD1 4.38Å; I540-G542 PolarHBondContact O-N 3.38Å; I540-V543 PolarHBondContact O-N 3.29Å; I540-A544 VanDerWaalsContact O-CB 3.26Å; I540-A544 WeakPolarHBondContact O-CB 3.44Å; I540-A544 PolarHBondContact O-N 3.16Å
541	K	90.9	Very high	91	Very high	29 Å²	29	34 Å²	34	13%	0.126	21%	0.211	C	C	.	.	H	α-helix	trans	-60.9	-44.9	176.1	-74	-163.9	92.2	159.3	0	111.8	Y529 A530 L532 A534 Y537 I539 V543 A544 C545	Y529-K541 VanDerWaalsContact O-CE 3.27Å; Y529-K541 WeakPolarHBondContact O-CE 3.34Å; A530-K541 PolarHBondContact O-NZ 3.38Å; L532-K541 HydrophobicContact CB-CD 4.06Å; L532-K541 HydrophobicContact CB-CG 3.93Å; L532-K541 HydrophobicContact CD1-CG 4.48Å; L532-K541 WeakPolarHBondContact O-CD 3.48Å; L532-K541 WeakPolarHBondContact O-CE 3.48Å; L532-K541 PolarHBondContact O-NZ 3.36Å; A534-K541 HydrophobicContact CB-CD 4.32Å; Y537-K541 WeakPolarHBondContact O-CG 3.45Å; Y537-K541 PolarHBondContact O-N 3.46Å; I539-K541 PolarHBondContact O-N 3.11Å; K541-V543 VanDerWaalsContact C-N 3.34Å; K541-V543 PolarHBondContact O-N 3.35Å; K541-A544 PolarHBondContact O-N 3.26Å; K541-C545 PolarHBondContact O-N 3.47Å; K541-C545 PolarHBondContact O-SG 2.94Å; K541-C545 VanDerWaalsContact O-SG 3.34Å
542	G	89.4	Confident	90.7	Very high	35 Å²	35	31.8 Å²	31.8	36%	0.361	19%	0.189	S	C	.	.	H	α-helix	trans	-60.9	-40	-179.8	0	0	0	0	0	113.4	P538 I539 I540	P538-G542 PolarHBondContact O-N 3.11Å; I539-G542 PolarHBondContact O-N 3.47Å; I540-G542 PolarHBondContact O-N 3.38Å
543	V	88.9	Confident	90.2	Very high	19 Å²	19	31.7 Å²	31.7	12%	0.115	19%	0.188	C	C	.	.	H	α-helix	trans	-75.3	-37.5	176.1	-177.3	0	0	0	0	111.2	W273 F488 I539 I540 K541 C545 K546 V547	W273-V543 HydrophobicContact CH2-CG1 3.93Å; W273-V543 HydrophobicContact CZ3-CG1 4.02Å; W273-V543 HydrophobicContact CZ3-CG2 4.35Å; F488-V543 HydrophobicContact CD2-CG1 3.99Å; F488-V543 HydrophobicContact CE1-CB 4.03Å; F488-V543 HydrophobicContact CE1-CG1 4.17Å; F488-V543 HydrophobicContact CE2-CB 3.86Å; F488-V543 HydrophobicContact CE2-CG1 3.19Å; F488-V543 HydrophobicContact CZ-CB 3.39Å; F488-V543 HydrophobicContact CZ-CG1 3.32Å; F488-V543 HydrophobicContact CZ-CG2 4.37Å; I539-V543 HydrophobicContact CG2-CG2 4.48Å; I539-V543 WeakPolarHBondContact O-CG2 3.4Å; I539-V543 PolarHBondContact O-N 3.19Å; I540-V543 PolarHBondContact O-N 3.29Å; K541-V543 VanDerWaalsContact C-N 3.34Å; K541-V543 PolarHBondContact O-N 3.35Å; V543-C545 VanDerWaalsContact C-N 3.29Å; V543-C545 PolarHBondContact O-N 3.45Å; V543-K546 WeakPolarHBondContact O-CB 3.42Å; V543-K546 PolarHBondContact O-N 2.89Å; V543-V547 HydrophobicContact CG1-CG2 4.24Å; V543-V547 WeakPolarHBondContact O-CG2 3.45Å; V543-V547 PolarHBondContact O-N 3.4Å
544	A	89.9	Confident	89.5	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-57.3	-41.2	174.3	0	0	0	0	0	111.7	L202 F488 Y529 I540 K541 K546 V547 A548	L202-A544 HydrophobicContact CD1-CB 4.14Å; F488-A544 HydrophobicContact CD1-CB 3.95Å; F488-A544 HydrophobicContact CE1-CB 4.06Å; Y529-A544 HydrophobicContact CD1-CB 3.73Å; Y529-A544 HydrophobicContact CD2-CB 4.28Å; Y529-A544 HydrophobicContact CE1-CB 4.26Å; Y529-A544 HydrophobicContact CG-CB 3.76Å; I540-A544 VanDerWaalsContact O-CB 3.26Å; I540-A544 WeakPolarHBondContact O-CB 3.44Å; I540-A544 PolarHBondContact O-N 3.16Å; K541-A544 PolarHBondContact O-N 3.26Å; A544-K546 VanDerWaalsContact C-N 3.29Å; A544-K546 PolarHBondContact O-N 3.43Å; A544-V547 PolarHBondContact O-N 3.16Å; A544-A548 VanDerWaalsContact O-CB 3.24Å; A544-A548 WeakPolarHBondContact O-CB 3.45Å; A544-A548 PolarHBondContact O-N 3.33Å
545	C	90.6	Very high	89.2	Confident	8 Å²	8	29.3 Å²	29.3	5%	0.054	16%	0.161	C	C	.	.	H	α-helix	trans	-58.4	-40.9	173.8	-66.8	0	0	0	0	112.4	K173 A174 V198 L202 K541 V543 A548 S549	K173-C545 HydrophobicContact CB-CB 4.22Å; A174-C545 HydrophobicContact CB-CB 4.46Å; V198-C545 HydrophobicContact CG1-CB 4.23Å; L202-C545 HydrophobicContact CD1-CB 4.35Å; L202-C545 WeakPolarHBondContact CD2-SG 3.18Å; K541-C545 PolarHBondContact O-N 3.47Å; K541-C545 PolarHBondContact O-SG 2.94Å; K541-C545 VanDerWaalsContact O-SG 3.34Å; V543-C545 VanDerWaalsContact C-N 3.29Å; V543-C545 PolarHBondContact O-N 3.45Å; C545-A548 PolarHBondContact O-N 3.15Å; C545-S549 PolarHBondContact O-N 3.39Å
546	K	90.3	Very high	89	Confident	66 Å²	66	20.8 Å²	20.8	29%	0.287	12%	0.121	S	C	.	.	H	α-helix	trans	-69.2	-44.9	-179.8	-65.3	-179.7	-177.8	-178.2	0	111.3	A174 V242 W273 V543 A544 A548 S549	A174-K546 HydrophobicContact CB-CG 4.15Å; V242-K546 HydrophobicContact CG1-CB 4.08Å; V242-K546 HydrophobicContact CG2-CB 3.98Å; V242-K546 HydrophobicContact CG2-CG 3.9Å; W273-K546 HydrophobicContact CD2-CD 4.3Å; W273-K546 HydrophobicContact CE3-CD 3.39Å; W273-K546 HydrophobicContact CZ3-CD 3.81Å; V543-K546 WeakPolarHBondContact O-CB 3.42Å; V543-K546 PolarHBondContact O-N 2.89Å; A544-K546 VanDerWaalsContact C-N 3.29Å; A544-K546 PolarHBondContact O-N 3.43Å; K546-A548 VanDerWaalsContact C-N 3.32Å; K546-A548 PolarHBondContact O-N 3.4Å; K546-S549 PolarHBondContact O-N 2.88Å; K546-S549 PolarHBondContact O-OG 3.3Å
547	V	89.6	Confident	88.6	Confident	6 Å²	6	18.9 Å²	18.9	4%	0.036	11%	0.108	C	C	.	.	H	α-helix	trans	-64.4	-38.9	176.4	-179.8	0	0	0	0	110.8	F404 L485 F488 V543 A544 S549 L550	F404-V547 HydrophobicContact CB-CG1 4.44Å; F404-V547 HydrophobicContact CD1-CB 4.29Å; F404-V547 HydrophobicContact CD1-CG1 3.67Å; F404-V547 HydrophobicContact CE1-CB 4.29Å; F404-V547 HydrophobicContact CE1-CG1 4.11Å; F404-V547 HydrophobicContact CG-CG1 4.2Å; L485-V547 HydrophobicContact CD2-CG1 3.81Å; F488-V547 HydrophobicContact CB-CG1 4.36Å; F488-V547 HydrophobicContact CB-CG2 4.49Å; F488-V547 HydrophobicContact CD2-CG2 4.03Å; F488-V547 HydrophobicContact CG-CG2 4.27Å; V543-V547 HydrophobicContact CG1-CG2 4.24Å; V543-V547 WeakPolarHBondContact O-CG2 3.45Å; V543-V547 PolarHBondContact O-N 3.4Å; A544-V547 PolarHBondContact O-N 3.16Å; V547-S549 VanDerWaalsContact C-N 3.28Å; V547-S549 PolarHBondContact O-N 3.23Å; V547-L550 PolarHBondContact O-N 2.91Å
548	A	89.7	Confident	87.9	Confident	3 Å²	3	21.6 Å²	21.6	3%	0.025	12%	0.121	C	C	.	.	H	α-helix	trans	-63.3	-32.6	175.3	0	0	0	0	0	112.6	R196 V198 L202 V204 F404 A544 C545 K546 L550	R196-A548 PolarHBondContact NE-O 2.89Å; R196-A548 PolarHBondContact NH2-O 3.08Å; V198-A548 HydrophobicContact CG1-CB 4.14Å; V198-A548 HydrophobicContact CG2-CB 3.7Å; L202-A548 HydrophobicContact CD1-CB 4.26Å; V204-A548 HydrophobicContact CG2-CB 4.39Å; F404-A548 HydrophobicContact CD1-CB 4.22Å; F404-A548 VanDerWaalsContact CE1-CA 3.44Å; F404-A548 HydrophobicContact CE1-CB 3.58Å; A544-A548 VanDerWaalsContact O-CB 3.24Å; A544-A548 WeakPolarHBondContact O-CB 3.45Å; A544-A548 PolarHBondContact O-N 3.33Å; C545-A548 PolarHBondContact O-N 3.15Å; K546-A548 VanDerWaalsContact C-N 3.32Å; K546-A548 PolarHBondContact O-N 3.4Å; A548-L550 VanDerWaalsContact C-N 3.28Å; A548-L550 PolarHBondContact O-N 3.37Å
549	S	92.5	Very high	87.6	Confident	0 Å²	0	21 Å²	21	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-75.9	-15.6	-178.3	70.9	0	0	0	0	113.8	S176 V242 C545 K546 V547	S176-S549 WeakPolarHBondContact CB-O 3.48Å; S176-S549 PolarHBondContact OG-O 3.23Å; V242-S549 WeakPolarHBondContact CB-OG 3.43Å; V242-S549 WeakPolarHBondContact CG2-OG 3.41Å; C545-S549 PolarHBondContact O-N 3.39Å; K546-S549 PolarHBondContact O-N 2.88Å; K546-S549 PolarHBondContact O-OG 3.3Å; V547-S549 VanDerWaalsContact C-N 3.28Å; V547-S549 PolarHBondContact O-N 3.23Å
550	L	92.4	Very high	87.4	Confident	3 Å²	3	18 Å²	18	2%	0.016	10%	0.096	C	C	.	.	S	Bend	trans	-68.4	134.8	172.2	-63.9	177.7	0	0	0	108.4	R196 V242 I276 Y278 A405 L478 I481 L485 V547 A548 D552	R196-L550 WeakPolarHBondContact CD-O 3.48Å; R196-L550 PolarHBondContact NE-O 2.91Å; V242-L550 HydrophobicContact CG1-CD2 3.93Å; V242-L550 HydrophobicContact CG1-CG 4.39Å; I276-L550 HydrophobicContact CB-CD2 4.25Å; I276-L550 HydrophobicContact CG2-CD2 4.45Å; Y278-L550 HydrophobicContact CE1-CD2 4.18Å; A405-L550 HydrophobicContact CB-CB 3.9Å; L478-L550 HydrophobicContact CD2-CD1 4.44Å; I481-L550 HydrophobicContact CD1-CD1 3.79Å; L485-L550 HydrophobicContact CD2-CD1 4.19Å; V547-L550 PolarHBondContact O-N 2.91Å; A548-L550 VanDerWaalsContact C-N 3.28Å; A548-L550 PolarHBondContact O-N 3.37Å; L550-D552 PolarHBondContact O-N 2.88Å
551	F	90.1	Very high	86.8	Confident	1 Å²	1	18.9 Å²	18.9	0%	0.004	10%	0.1	C	C	.	.			trans	-56.6	127.5	170.8	-79.2	-90.6	0	0	0	109.3	A178 F194 R196 E206 T245 Y278 F281 A405 I556	A178-F551 HydrophobicContact CB-CD1 4.46Å; A178-F551 HydrophobicContact CB-CD2 4.18Å; A178-F551 HydrophobicContact CB-CE1 4.05Å; A178-F551 HydrophobicContact CB-CE2 3.74Å; A178-F551 HydrophobicContact CB-CZ 3.66Å; F194-F551 HydrophobicContact CB-CZ 4.26Å; R196-F551 HydrophobicContact CB-CD1 4.2Å; R196-F551 HydrophobicContact CB-CD2 4.03Å; R196-F551 HydrophobicContact CB-CE1 3.82Å; R196-F551 HydrophobicContact CB-CE2 3.61Å; R196-F551 HydrophobicContact CB-CG 4.31Å; R196-F551 HydrophobicContact CB-CZ 3.52Å; E206-F551 WeakPolarHBondContact OE1-CD1 3.38Å; T245-F551 HydrophobicContact CG2-CB 3.98Å; T245-F551 HydrophobicContact CG2-CD2 4.17Å; T245-F551 HydrophobicContact CG2-CG 4.36Å; Y278-F551 PolarHBondContact OH-N 2.85Å; Y278-F551 PolarHBondContact OH-O 3.11Å; Y278-F551 VanDerWaalsContact OH-O 3.07Å; F281-F551 WeakPolarHBondContact CE2-O 3.31Å; A405-F551 WeakPolarHBondContact CB-O 3.45Å; F551-I556 HydrophobicContact CE1-CG2 4.03Å
552	D	83.8	Confident	86.3	Confident	1 Å²	1	19 Å²	19	1%	0.005	10%	0.104	C	C	.	.			trans	-107.1	-8	-179.5	61.9	-7	0	0	0	112.9	R196 S401 V403 F404 A405 A408 L550	R196-D552 IonicContact CZ-OD1 3.74Å; R196-D552 VanDerWaalsContact CZ-OD1 3.31Å; R196-D552 IonicContact CZ-OD2 3.77Å; R196-D552 IonicContact NH1-OD1 3.18Å; R196-D552 PolarHBondContact NH1-OD1 3.36Å; R196-D552 IonicContact NH1-OD2 3.81Å; R196-D552 IonicContact NH2-OD1 2.56Å; R196-D552 PolarHBondContact NH2-OD1 3.46Å; R196-D552 IonicContact NH2-OD2 2.72Å; R196-D552 PolarHBondContact NH2-OD2 3.13Å; S401-D552 WeakPolarHBondContact CB-O 3.31Å; V403-D552 PolarHBondContact N-OD2 2.68Å; F404-D552 PolarHBondContact N-OD2 3.29Å; A405-D552 HydrophobicContact CB-CB 4.5Å; A408-D552 VanDerWaalsContact CB-O 3.31Å; A408-D552 WeakPolarHBondContact CB-O 3.42Å; L550-D552 PolarHBondContact O-N 2.88Å
553	S	81.8	Confident	86.1	Confident	2 Å²	2	18 Å²	18	1%	0.014	9%	0.09	C	C	.	.			trans	-154.9	172.4	173.2	73	0	0	0	0	108.6	Q555	S553-Q555 WeakPolarHBondContact OG-CB 3.48Å; S553-Q555 PolarHBondContact OG-N 3.48Å
554	N	76.7	Confident	85.7	Confident	10 Å²	10	17.2 Å²	17.2	5%	0.053	9%	0.085	C	C	.	.			trans	-103.7	25.9	170.4	-83.6	28.5	0	0	0	112	F281 L282 I556 C557 E558	F281-N554 HydrophobicContact CB-CB 4.37Å; F281-N554 PolarHBondContact N-ND2 3.06Å; F281-N554 PolarHBondContact N-OD1 3.36Å; L282-N554 HydrophobicContact CB-CB 3.68Å; L282-N554 WeakPolarHBondContact CB-ND2 3.5Å; L282-N554 PolarHBondContact N-ND2 3.41Å; N554-I556 VanDerWaalsContact C-N 3.28Å; N554-I556 PolarHBondContact O-N 3.18Å; N554-C557 HydrophobicContact CB-CB 4.36Å; N554-C557 WeakPolarHBondContact O-CB 3.49Å; N554-C557 PolarHBondContact O-N 3.4Å; N554-C557 VanDerWaalsContact O-N 3.09Å; N554-E558 PolarHBondContact O-N 3.25Å
555	Q	82.3	Confident	85	Confident	57 Å²	57	18.2 Å²	18.2	27%	0.266	9%	0.091	S	C	.	.	H	α-helix	trans	-57	-40.2	-171.5	-168.8	179.1	11.7	0	0	112.7	S553 E558 K559	S553-Q555 WeakPolarHBondContact OG-CB 3.48Å; S553-Q555 PolarHBondContact OG-N 3.48Å; Q555-E558 PolarHBondContact O-N 2.92Å; Q555-K559 WeakPolarHBondContact O-CG 3.3Å; Q555-K559 PolarHBondContact O-N 3.3Å
556	I	86.5	Confident	84.5	Confident	3 Å²	3	27.2 Å²	27.2	2%	0.015	12%	0.124	C	C	.	.	H	α-helix	trans	-68.2	-40.6	178.3	-166.4	168.2	0	0	0	112.8	F194 E206 D207 F551 N554 E558 K559 A560	F194-I556 HydrophobicContact CB-CD1 4.38Å; F194-I556 HydrophobicContact CB-CG2 4.13Å; F194-I556 HydrophobicContact CD1-CB 4.49Å; F194-I556 HydrophobicContact CD1-CD1 3.53Å; F194-I556 HydrophobicContact CD1-CG1 3.63Å; F194-I556 HydrophobicContact CD1-CG2 4.12Å; F194-I556 HydrophobicContact CD2-CG2 4.47Å; F194-I556 HydrophobicContact CE1-CD1 4.17Å; F194-I556 HydrophobicContact CE1-CG1 3.84Å; F194-I556 HydrophobicContact CG-CD1 4.27Å; F194-I556 HydrophobicContact CG-CG1 4.36Å; F194-I556 HydrophobicContact CG-CG2 3.99Å; E206-I556 HydrophobicContact CB-CD1 4.25Å; D207-I556 VanDerWaalsContact CA-CD1 3.41Å; F551-I556 HydrophobicContact CE1-CG2 4.03Å; N554-I556 VanDerWaalsContact C-N 3.28Å; N554-I556 PolarHBondContact O-N 3.18Å; I556-E558 VanDerWaalsContact C-N 3.31Å; I556-E558 PolarHBondContact O-N 2.73Å; I556-K559 PolarHBondContact O-N 2.88Å; I556-A560 PolarHBondContact O-N 2.97Å
557	C	83.9	Confident	83.9	Confident	6 Å²	6	25.1 Å²	25.1	4%	0.041	12%	0.116	C	C	.	.	H	α-helix	trans	-61.6	-42.4	172.6	-64.5	0	0	0	0	110.6	F194 L282 N554 A560 F561	F194-C557 HydrophobicContact CE2-CB 4.47Å; L282-C557 HydrophobicContact CD2-CB 4.13Å; N554-C557 HydrophobicContact CB-CB 4.36Å; N554-C557 WeakPolarHBondContact O-CB 3.49Å; N554-C557 PolarHBondContact O-N 3.4Å; N554-C557 VanDerWaalsContact O-N 3.09Å; C557-A560 WeakPolarHBondContact O-CB 3.46Å; C557-A560 PolarHBondContact O-N 3.42Å; C557-F561 WeakPolarHBondContact O-CB 3.35Å; C557-F561 PolarHBondContact O-N 2.9Å
558	E	80.4	Confident	83.2	Confident	67 Å²	67	25.4 Å²	25.4	31%	0.313	12%	0.117	S	C	.	.	H	α-helix	trans	-65.4	-38.1	177.2	-86.7	-62.9	92.4	0	0	113.4	L282 N554 Q555 I556 S562	L282-E558 HydrophobicContact CD1-CG 3.59Å; L282-E558 WeakPolarHBondContact CD1-OE1 3.26Å; L282-E558 HydrophobicContact CD2-CG 3.92Å; L282-E558 WeakPolarHBondContact CD2-OE1 3.28Å; L282-E558 HydrophobicContact CG-CG 4.29Å; L282-E558 WeakPolarHBondContact CG-OE1 3.48Å; N554-E558 PolarHBondContact O-N 3.25Å; Q555-E558 PolarHBondContact O-N 2.92Å; I556-E558 VanDerWaalsContact C-N 3.31Å; I556-E558 PolarHBondContact O-N 2.73Å; E558-S562 WeakPolarHBondContact O-CB 3.41Å; E558-S562 PolarHBondContact O-N 2.82Å; E558-S562 PolarHBondContact O-OG 3.37Å
559	K	86.2	Confident	82.2	Confident	56 Å²	56	31.6 Å²	31.6	24%	0.243	15%	0.145	C	C	.	.	H	α-helix	trans	-61.5	-46.5	172	-75.7	175.3	-176.7	175.1	0	110.4	Q555 I556 Y563 T588 E590	Q555-K559 WeakPolarHBondContact O-CG 3.3Å; Q555-K559 PolarHBondContact O-N 3.3Å; I556-K559 PolarHBondContact O-N 2.88Å; K559-Y563 WeakPolarHBondContact O-CB 3.24Å; K559-Y563 PolarHBondContact O-N 3.04Å; K559-T588 HydrophobicContact CB-CG2 4.24Å; K559-E590 VanDerWaalsContact NZ-CG 3.33Å; K559-E590 IonicContact NZ-OE1 3.89Å; K559-E590 PolarHBondContact NZ-OE1 3.43Å
560	A	87.1	Confident	81.3	Confident	3 Å²	3	32.8 Å²	32.8	3%	0.025	15%	0.152	C	C	.	.	H	α-helix	trans	-61.8	-47.2	178.5	0	0	0	0	0	111.3	L192 F194 I556 C557 Y563 L564 F584 T588	L192-A560 HydrophobicContact CD2-CB 3.97Å; F194-A560 HydrophobicContact CE1-CB 4.27Å; F194-A560 HydrophobicContact CZ-CB 3.71Å; I556-A560 PolarHBondContact O-N 2.97Å; C557-A560 WeakPolarHBondContact O-CB 3.46Å; C557-A560 PolarHBondContact O-N 3.42Å; A560-Y563 PolarHBondContact O-N 2.85Å; A560-L564 PolarHBondContact O-N 2.96Å; A560-F584 HydrophobicContact CB-CD1 3.95Å; A560-F584 HydrophobicContact CB-CE1 3.97Å; A560-T588 HydrophobicContact CB-CG2 3.71Å
561	F	79.5	Confident	80.4	Confident	21 Å²	21	32.7 Å²	32.7	9%	0.092	15%	0.152	C	C	.	.	H	α-helix	trans	-58.7	-55.5	176.3	179.9	-87.4	0	0	0	111.1	F184 R344 C557 Y563 L564 T565	F184-F561 AromaticContact CD1-CD2 3.98Å; F184-F561 HydrophobicContact CD1-CD2 3.98Å; F184-F561 AromaticContact CD1-CE2 3.75Å; F184-F561 HydrophobicContact CD1-CE2 3.75Å; F184-F561 AromaticContact CE1-CD2 3.2Å; F184-F561 HydrophobicContact CE1-CD2 3.2Å; F184-F561 AromaticContact CE1-CE2 3.32Å; F184-F561 HydrophobicContact CE1-CE2 3.32Å; F184-F561 AromaticContact CZ-CD2 3.74Å; F184-F561 HydrophobicContact CZ-CD2 3.74Å; F184-F561 HydrophobicContact CZ-CE2 4.3Å; R344-F561 VanDerWaalsContact CZ-CE1 3.48Å; R344-F561 VanDerWaalsContact CZ-CZ 3.44Å; R344-F561 VanDerWaalsContact NH1-CE1 3.27Å; C557-F561 WeakPolarHBondContact O-CB 3.35Å; C557-F561 PolarHBondContact O-N 2.9Å; F561-Y563 VanDerWaalsContact C-N 3.26Å; F561-Y563 PolarHBondContact O-N 3.02Å; F561-L564 WeakPolarHBondContact O-CB 3.4Å; F561-L564 PolarHBondContact O-N 2.65Å; F561-L564 VanDerWaalsContact O-N 3.09Å; F561-T565 WeakPolarHBondContact CE1-OG1 3.45Å; F561-T565 WeakPolarHBondContact CZ-OG1 3.33Å; F561-T565 PolarHBondContact O-N 3.01Å; F561-T565 PolarHBondContact O-OG1 3.37Å
562	S	81.1	Confident	79.2	Confident	32 Å²	32	34.1 Å²	34.1	22%	0.224	16%	0.162	C	C	.	.	H	α-helix	trans	-58.6	-38.6	-179.8	-70.6	0	0	0	0	112.5	E558 R566	E558-S562 WeakPolarHBondContact O-CB 3.41Å; E558-S562 PolarHBondContact O-N 2.82Å; E558-S562 PolarHBondContact O-OG 3.37Å; S562-R566 WeakPolarHBondContact O-CB 3.41Å; S562-R566 WeakPolarHBondContact O-CD 3.46Å; S562-R566 WeakPolarHBondContact O-CG 3.5Å; S562-R566 PolarHBondContact O-N 3.41Å; S562-R566 VanDerWaalsContact O-N 3.11Å
563	Y	85.4	Confident	78.6	Confident	13 Å²	13	39.1 Å²	39.1	5%	0.051	19%	0.185	C	C	.	.	H	α-helix	trans	-65	-44.6	176.7	176.9	-99.8	0	0	0	111.5	A109 L110 G112 K559 A560 F561 N567 L571 L583 A587	A109-Y563 VanDerWaalsContact O-CE2 3.29Å; A109-Y563 WeakPolarHBondContact O-CE2 3.49Å; A109-Y563 PolarHBondContact O-OH 3.39Å; L110-Y563 WeakPolarHBondContact O-CE2 3.36Å; G112-Y563 VanDerWaalsContact CA-OH 3.28Å; G112-Y563 WeakPolarHBondContact CA-OH 3.39Å; K559-Y563 WeakPolarHBondContact O-CB 3.24Å; K559-Y563 PolarHBondContact O-N 3.04Å; A560-Y563 PolarHBondContact O-N 2.85Å; F561-Y563 VanDerWaalsContact C-N 3.26Å; F561-Y563 PolarHBondContact O-N 3.02Å; Y563-N567 VanDerWaalsContact CD2-ND2 3.25Å; Y563-N567 WeakPolarHBondContact CD2-ND2 3.33Å; Y563-N567 WeakPolarHBondContact CE2-ND2 3.35Å; Y563-N567 WeakPolarHBondContact O-CB 3.49Å; Y563-N567 PolarHBondContact O-N 2.86Å; Y563-N567 PolarHBondContact O-ND2 3.45Å; Y563-L571 HydrophobicContact CD1-CD1 4.22Å; Y563-L571 HydrophobicContact CE1-CD1 3.91Å; Y563-L571 HydrophobicContact CE1-CD2 4.48Å; Y563-L583 HydrophobicContact CE1-CB 4.21Å; Y563-A587 HydrophobicContact CD1-CB 3.7Å; Y563-A587 HydrophobicContact CD2-CB 3.28Å; Y563-A587 HydrophobicContact CE1-CB 3.92Å; Y563-A587 HydrophobicContact CE2-CB 3.51Å; Y563-A587 HydrophobicContact CG-CB 3.37Å
564	L	79.9	Confident	77.9	Confident	4 Å²	4	45.5 Å²	45.5	2%	0.021	23%	0.227	C	C	.	.	H	α-helix	trans	-62	-51.2	177.3	-179.5	62.8	0	0	0	111.6	F184 Y187 A560 F561 R566 N567 Q568 L571 F584	F184-L564 HydrophobicContact CB-CD2 3.28Å; F184-L564 HydrophobicContact CB-CG 4.49Å; F184-L564 HydrophobicContact CD1-CD2 3.98Å; F184-L564 HydrophobicContact CD2-CD2 3.41Å; F184-L564 VanDerWaalsContact CD2-CD2 3.41Å; F184-L564 HydrophobicContact CE2-CD2 4.23Å; F184-L564 HydrophobicContact CG-CD2 3.25Å; Y187-L564 HydrophobicContact CD2-CD1 3.84Å; Y187-L564 HydrophobicContact CE2-CD1 4.23Å; A560-L564 PolarHBondContact O-N 2.96Å; F561-L564 WeakPolarHBondContact O-CB 3.4Å; F561-L564 PolarHBondContact O-N 2.65Å; F561-L564 VanDerWaalsContact O-N 3.09Å; L564-R566 PolarHBondContact O-N 3.46Å; L564-N567 CarbonylContact O-C 3.53Å; L564-N567 PolarHBondContact O-N 3.39Å; L564-Q568 WeakPolarHBondContact O-CA 3.38Å; L564-Q568 WeakPolarHBondContact O-CB 3.39Å; L564-Q568 PolarHBondContact O-N 2.97Å; L564-L571 HydrophobicContact CD1-CB 4.21Å; L564-L571 HydrophobicContact CD1-CD1 3.63Å; L564-F584 HydrophobicContact CB-CE1 4.47Å; L564-F584 HydrophobicContact CB-CZ 4.03Å; L564-F584 HydrophobicContact CD1-CZ 4.11Å; L564-F584 HydrophobicContact CD2-CZ 4.4Å; L564-F584 HydrophobicContact CG-CZ 4.42Å
565	T	75.4	Confident	77.8	Confident	20 Å²	20	47.2 Å²	47.2	12%	0.123	24%	0.235	C	C	.	.	H	α-helix	trans	-55.2	-49.8	-179.9	-63.6	0	0	0	0	111.9	S327 E328 F561 N567	S327-T565 WeakPolarHBondContact O-CG2 3.3Å; E328-T565 HydrophobicContact CG-CG2 4.33Å; E328-T565 WeakPolarHBondContact OE2-CG2 3.43Å; F561-T565 WeakPolarHBondContact CE1-OG1 3.45Å; F561-T565 WeakPolarHBondContact CZ-OG1 3.33Å; F561-T565 PolarHBondContact O-N 3.01Å; F561-T565 PolarHBondContact O-OG1 3.37Å; T565-N567 PolarHBondContact O-N 2.91Å
566	R	79.6	Confident	77.9	Confident	197 Å²	197	47.5 Å²	47.5	74%	0.743	24%	0.241	S	C	*	.	H	α-helix	trans	-64.4	-29.1	-178.7	-71.3	171.6	-169.7	166.1	5.8	113.4	S562 L564	S562-R566 WeakPolarHBondContact O-CB 3.41Å; S562-R566 WeakPolarHBondContact O-CD 3.46Å; S562-R566 WeakPolarHBondContact O-CG 3.5Å; S562-R566 PolarHBondContact O-N 3.41Å; S562-R566 VanDerWaalsContact O-N 3.11Å; L564-R566 PolarHBondContact O-N 3.46Å
567	N	78.8	Confident	77.8	Confident	23 Å²	23	50.4 Å²	50.4	12%	0.123	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.3	17.7	-170.7	-57.7	-50.3	0	0	0	112.8	K111 Y563 L564 T565 H569 T570 L571	K111-N567 PolarHBondContact O-OD1 2.92Å; Y563-N567 VanDerWaalsContact CD2-ND2 3.25Å; Y563-N567 WeakPolarHBondContact CD2-ND2 3.33Å; Y563-N567 WeakPolarHBondContact CE2-ND2 3.35Å; Y563-N567 WeakPolarHBondContact O-CB 3.49Å; Y563-N567 PolarHBondContact O-N 2.86Å; Y563-N567 PolarHBondContact O-ND2 3.45Å; L564-N567 CarbonylContact O-C 3.53Å; L564-N567 PolarHBondContact O-N 3.39Å; T565-N567 PolarHBondContact O-N 2.91Å; N567-H569 VanDerWaalsContact C-N 3.32Å; N567-H569 PolarHBondContact O-N 2.71Å; N567-T570 PolarHBondContact O-N 3.49Å; N567-T570 VanDerWaalsContact O-N 3.1Å; N567-L571 HydrophobicContact CB-CD1 3.8Å; N567-L571 HydrophobicContact CB-CG 4.07Å; N567-L571 WeakPolarHBondContact O-CB 3.41Å; N567-L571 WeakPolarHBondContact O-CG 3.48Å; N567-L571 PolarHBondContact O-N 2.76Å
568	Q	73.4	Confident	77.9	Confident	11 Å²	11	56.4 Å²	56.4	5%	0.051	28%	0.284	C	S	.	.	H	α-helix	trans	-60.9	-38.1	-167.4	-164.3	-158.1	-34.9	0	0	113.4	V185 E328 H329 L564 T570 L571 S572	V185-Q568 HydrophobicContact CB-CG 4.44Å; E328-Q568 VanDerWaalsContact C-OE1 3.31Å; E328-Q568 PolarHBondContact O-OE1 2.94Å; H329-Q568 PolarHBondContact O-NE2 3.47Å; H329-Q568 PolarHBondContact O-OE1 3.17Å; L564-Q568 WeakPolarHBondContact O-CA 3.38Å; L564-Q568 WeakPolarHBondContact O-CB 3.39Å; L564-Q568 PolarHBondContact O-N 2.97Å; Q568-T570 VanDerWaalsContact C-N 3.34Å; Q568-T570 PolarHBondContact O-N 3.26Å; Q568-L571 PolarHBondContact O-N 3.47Å; Q568-S572 WeakPolarHBondContact O-CB 3.43Å; Q568-S572 PolarHBondContact O-N 3.34Å; Q568-S572 PolarHBondContact O-OG 2.81Å
569	H	70.6	Confident	78.2	Confident	133 Å²	133	53.5 Å²	53.5	62%	0.616	27%	0.271	S	S	*	.	H	α-helix	trans	-57.9	-47.1	176.5	174.5	-86.5	0	0	0	111.4	N567 S572	N567-H569 VanDerWaalsContact C-N 3.32Å; N567-H569 PolarHBondContact O-N 2.71Å; H569-S572 PolarHBondContact O-OG 3.23Å
570	T	72.1	Confident	78.1	Confident	26 Å²	26	51 Å²	51	16%	0.16	26%	0.26	C	S	.	.	H	α-helix	trans	-71.1	-46.3	179.1	-44.8	0	0	0	0	111.7	G112 N567 Q568 S572 Q573	G112-T570 WeakPolarHBondContact O-CB 3.47Å; G112-T570 WeakPolarHBondContact O-CG2 3.44Å; G112-T570 PolarHBondContact O-OG1 3.35Å; G112-T570 VanDerWaalsContact O-OG1 3.13Å; N567-T570 PolarHBondContact O-N 3.49Å; N567-T570 VanDerWaalsContact O-N 3.1Å; Q568-T570 VanDerWaalsContact C-N 3.34Å; Q568-T570 PolarHBondContact O-N 3.26Å; T570-S572 VanDerWaalsContact C-N 3.25Å; T570-S572 PolarHBondContact O-N 3.03Å; T570-Q573 PolarHBondContact O-N 2.83Å
571	L	74.1	Confident	78.3	Confident	1 Å²	1	52.1 Å²	52.1	1%	0.005	27%	0.265	C	S	.	.	H	α-helix	trans	-66	-30.5	-179	-66.3	173.5	0	0	0	110.4	Y187 Y563 L564 N567 Q568 Q573 L575 L583	Y187-L571 HydrophobicContact CE2-CB 3.79Å; Y187-L571 WeakPolarHBondContact CE2-O 3.48Å; Y187-L571 PolarHBondContact OH-O 3.06Å; Y563-L571 HydrophobicContact CD1-CD1 4.22Å; Y563-L571 HydrophobicContact CE1-CD1 3.91Å; Y563-L571 HydrophobicContact CE1-CD2 4.48Å; L564-L571 HydrophobicContact CD1-CB 4.21Å; L564-L571 HydrophobicContact CD1-CD1 3.63Å; N567-L571 HydrophobicContact CB-CD1 3.8Å; N567-L571 HydrophobicContact CB-CG 4.07Å; N567-L571 WeakPolarHBondContact O-CB 3.41Å; N567-L571 WeakPolarHBondContact O-CG 3.48Å; N567-L571 PolarHBondContact O-N 2.76Å; Q568-L571 PolarHBondContact O-N 3.47Å; L571-Q573 PolarHBondContact O-N 3.02Å; L571-L575 HydrophobicContact CD2-CD1 4.12Å; L571-L583 HydrophobicContact CD2-CD1 3.45Å; L571-L583 VanDerWaalsContact CD2-CD1 3.45Å
572	S	65.3	Low	78.9	Confident	31 Å²	31	51.1 Å²	51.1	22%	0.217	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-3.5	-179.7	71	0	0	0	0	116.1	A186 Q568 H569 T570	A186-S572 VanDerWaalsContact CB-CB 3.44Å; Q568-S572 WeakPolarHBondContact O-CB 3.43Å; Q568-S572 PolarHBondContact O-N 3.34Å; Q568-S572 PolarHBondContact O-OG 2.81Å; H569-S572 PolarHBondContact O-OG 3.23Å; T570-S572 VanDerWaalsContact C-N 3.25Å; T570-S572 PolarHBondContact O-N 3.03Å
573	Q	70.4	Confident	79.3	Confident	106 Å²	106	49.8 Å²	49.8	50%	0.495	25%	0.251	S	S	.	.	S	Bend	trans	-76.5	157.6	172.6	-61.4	-172.7	-2.5	0	0	111.2	T570 L571 L575	T570-Q573 PolarHBondContact O-N 2.83Å; L571-Q573 PolarHBondContact O-N 3.02Å; Q573-L575 PolarHBondContact O-N 3.21Å
574	P	67.3	Low	79.5	Confident	136 Å²	136	49.5 Å²	49.5	88%	0.883	25%	0.25	S	C	*	.			trans	-61.9	107.4	178.3	-18.9	31.3	0	0	0	111.1
575	L	75.1	Confident	80.2	Confident	45 Å²	45	49.3 Å²	49.3	24%	0.236	25%	0.249	C	C	.	.			trans	-110.5	153.3	172.5	-57.8	-174.7	0	0	0	109.6	L571 Q573 H579 L583	L571-L575 HydrophobicContact CD2-CD1 4.12Å; Q573-L575 PolarHBondContact O-N 3.21Å; L575-H579 WeakPolarHBondContact CD2-ND1 3.43Å; L575-L583 HydrophobicContact CD1-CD1 4.19Å
576	T	83.6	Confident	81	Confident	63 Å²	63	48.5 Å²	48.5	39%	0.387	24%	0.244	S	C	.	.			trans	-75.3	150.2	167.2	59.9	0	0	0	0	109.9	E578 H579 L580	T576-E578 PolarHBondContact O-N 2.97Å; T576-H579 WeakPolarHBondContact O-CB 3.45Å; T576-H579 PolarHBondContact O-N 3.09Å; T576-H579 PolarHBondContact OG1-N 3.42Å; T576-L580 PolarHBondContact O-N 2.99Å
577	D	84.6	Confident	81.5	Confident	65 Å²	65	40.1 Å²	40.1	35%	0.348	22%	0.216	S	C	.	.	H	α-helix	trans	-53.4	-40.6	178.2	-67	9.8	0	0	0	111.9	Y190 N213 H579 L580 Q581	Y190-D577 PolarHBondContact OH-OD1 3.42Å; N213-D577 VanDerWaalsContact CB-OD2 3.26Å; N213-D577 WeakPolarHBondContact CB-OD2 3.47Å; N213-D577 PolarHBondContact ND2-OD1 3.37Å; N213-D577 PolarHBondContact ND2-OD2 2.93Å; D577-H579 VanDerWaalsContact C-N 3.33Å; D577-H579 PolarHBondContact O-N 3.18Å; D577-L580 PolarHBondContact O-N 3.49Å; D577-Q581 WeakPolarHBondContact O-CB 3.48Å; D577-Q581 PolarHBondContact O-N 3.05Å
578	E	87.1	Confident	82.2	Confident	131 Å²	131	39.1 Å²	39.1	61%	0.612	21%	0.211	S	C	*	.	H	α-helix	trans	-59.2	-41.3	175.7	-69.9	177.7	175.3	0	0	113.1	L155 T576 Q581 A582	L155-E578 HydrophobicContact CD2-CB 4.47Å; T576-E578 PolarHBondContact O-N 2.97Å; E578-Q581 PolarHBondContact O-N 2.86Å; E578-A582 WeakPolarHBondContact O-CB 3.31Å; E578-A582 PolarHBondContact O-N 2.92Å
579	H	84.9	Confident	83	Confident	7 Å²	7	39.3 Å²	39.3	3%	0.032	21%	0.213	C	C	.	.	H	α-helix	trans	-71.4	-43.4	179.9	173.2	-158.8	0	0	0	110.7	W115 L575 T576 D577 Q581 A582 L583	W115-H579 AromaticContact CE2-CD2 3.93Å; W115-H579 AromaticContact CE2-CE1 3.11Å; W115-H579 AromaticContact CE2-ND1 3.5Å; W115-H579 AromaticContact CE2-NE2 3.39Å; W115-H579 AromaticContact CH2-CD2 3.32Å; W115-H579 WeakPolarHBondContact CH2-CD2 3.34Å; W115-H579 AromaticContact CH2-CE1 3.87Å; W115-H579 AromaticContact CH2-NE2 3.24Å; W115-H579 WeakPolarHBondContact CH2-NE2 3.37Å; W115-H579 HydrophobicContact CZ2-CB 4.21Å; W115-H579 AromaticContact CZ2-CD2 3.02Å; W115-H579 WeakPolarHBondContact CZ2-CD2 3.09Å; W115-H579 AromaticContact CZ2-CE1 3.06Å; W115-H579 WeakPolarHBondContact CZ2-CE1 3.33Å; W115-H579 AromaticContact CZ2-CG 3.26Å; W115-H579 AromaticContact CZ2-ND1 3.25Å; W115-H579 VanDerWaalsContact CZ2-ND1 3.25Å; W115-H579 WeakPolarHBondContact CZ2-ND1 3.38Å; W115-H579 AromaticContact CZ2-NE2 2.91Å; W115-H579 WeakPolarHBondContact CZ2-NE2 3.19Å; W115-H579 AromaticContact NE1-CE1 3.2Å; W115-H579 PolarHBondContact NE1-CE1 3.16Å; W115-H579 AromaticContact NE1-ND1 3.39Å; W115-H579 PolarHBondContact NE1-ND1 3.01Å; W115-H579 AromaticContact NE1-NE2 3.96Å; L575-H579 WeakPolarHBondContact CD2-ND1 3.43Å; T576-H579 WeakPolarHBondContact O-CB 3.45Å; T576-H579 PolarHBondContact O-N 3.09Å; T576-H579 PolarHBondContact OG1-N 3.42Å; D577-H579 VanDerWaalsContact C-N 3.33Å; D577-H579 PolarHBondContact O-N 3.18Å; H579-Q581 VanDerWaalsContact C-N 3.25Å; H579-Q581 PolarHBondContact O-N 3.35Å; H579-A582 PolarHBondContact O-N 3.22Å; H579-A582 VanDerWaalsContact O-N 3.14Å; H579-L583 VanDerWaalsContact NE2-CD1 3.27Å; H579-L583 WeakPolarHBondContact NE2-CD1 3.47Å; H579-L583 WeakPolarHBondContact NE2-CG 3.49Å; H579-L583 PolarHBondContact O-N 3.18Å
580	L	85.8	Confident	83.9	Confident	4 Å²	4	39.1 Å²	39.1	2%	0.021	21%	0.213	C	C	.	.	H	α-helix	trans	-55.4	-47.6	175	-172.8	68.5	0	0	0	110.5	Y187 Y190 I211 T576 D577 A582 L583 F584	Y187-L580 HydrophobicContact CD1-CD1 4.15Å; Y187-L580 HydrophobicContact CD1-CD2 3.66Å; Y187-L580 HydrophobicContact CE1-CD1 3.47Å; Y187-L580 VanDerWaalsContact CE1-CD1 3.47Å; Y187-L580 HydrophobicContact CE1-CD2 3.47Å; Y187-L580 VanDerWaalsContact CE1-CD2 3.47Å; Y187-L580 HydrophobicContact CE1-CG 4.07Å; Y187-L580 HydrophobicContact CE2-CD1 4.37Å; Y190-L580 HydrophobicContact CD1-CD2 4.09Å; Y190-L580 HydrophobicContact CD2-CD2 4.37Å; Y190-L580 HydrophobicContact CE1-CD2 3.78Å; Y190-L580 HydrophobicContact CE2-CD2 4.14Å; Y190-L580 HydrophobicContact CG-CD2 4.33Å; I211-L580 HydrophobicContact CD1-CG 4.28Å; T576-L580 PolarHBondContact O-N 2.99Å; D577-L580 PolarHBondContact O-N 3.49Å; L580-A582 VanDerWaalsContact C-N 3.34Å; L580-A582 PolarHBondContact O-N 3.1Å; L580-L583 PolarHBondContact O-N 3.39Å; L580-F584 HydrophobicContact CD1-CD2 3.84Å; L580-F584 HydrophobicContact CD1-CE2 3.57Å; L580-F584 HydrophobicContact CG-CD2 3.97Å; L580-F584 HydrophobicContact CG-CE2 4.04Å; L580-F584 WeakPolarHBondContact O-CD2 3.48Å; L580-F584 PolarHBondContact O-N 3.12Å
581	Q	90	Very high	84.6	Confident	26 Å²	26	38.2 Å²	38.2	12%	0.121	21%	0.207	C	C	.	.	H	α-helix	trans	-58.2	-45.3	176.7	-175	172.2	-61.9	0	0	112.2	L208 I211 D577 E578 H579 L583 F584 R585	L208-Q581 HydrophobicContact CD2-CG 4.35Å; I211-Q581 HydrophobicContact CD1-CB 4.34Å; I211-Q581 HydrophobicContact CG1-CB 4.41Å; I211-Q581 HydrophobicContact CG1-CG 4.38Å; D577-Q581 WeakPolarHBondContact O-CB 3.48Å; D577-Q581 PolarHBondContact O-N 3.05Å; E578-Q581 PolarHBondContact O-N 2.86Å; H579-Q581 VanDerWaalsContact C-N 3.25Å; H579-Q581 PolarHBondContact O-N 3.35Å; Q581-L583 PolarHBondContact O-N 3.33Å; Q581-F584 PolarHBondContact O-N 2.83Å; Q581-R585 WeakPolarHBondContact O-CB 3.49Å; Q581-R585 PolarHBondContact O-N 3.49Å
582	A	91.5	Very high	85.2	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-60.4	-44.3	178.5	0	0	0	0	0	112.7	I154 L155 D158 E578 H579 L580 R585 V586	I154-A582 HydrophobicContact CG2-CB 4.02Å; L155-A582 HydrophobicContact CD2-CB 4.06Å; D158-A582 HydrophobicContact CB-CB 3.51Å; E578-A582 WeakPolarHBondContact O-CB 3.31Å; E578-A582 PolarHBondContact O-N 2.92Å; H579-A582 PolarHBondContact O-N 3.22Å; H579-A582 VanDerWaalsContact O-N 3.14Å; L580-A582 VanDerWaalsContact C-N 3.34Å; L580-A582 PolarHBondContact O-N 3.1Å; A582-R585 PolarHBondContact O-N 3.02Å; A582-V586 WeakPolarHBondContact O-CB 3.25Å; A582-V586 VanDerWaalsContact O-CG2 3.28Å; A582-V586 WeakPolarHBondContact O-CG2 3.28Å; A582-V586 PolarHBondContact O-N 3.41Å
583	L	90.6	Very high	86.2	Confident	4 Å²	4	42 Å²	42	2%	0.021	22%	0.221	C	C	.	.	H	α-helix	trans	-63.4	-47.9	177.6	-71.7	-175.8	0	0	0	112.1	A109 I154 Y563 L571 L575 H579 L580 Q581 R585 V586 A587	A109-L583 HydrophobicContact CB-CD2 3.67Å; I154-L583 HydrophobicContact CG2-CD2 4.37Å; Y563-L583 HydrophobicContact CE1-CB 4.21Å; L571-L583 HydrophobicContact CD2-CD1 3.45Å; L571-L583 VanDerWaalsContact CD2-CD1 3.45Å; L575-L583 HydrophobicContact CD1-CD1 4.19Å; H579-L583 VanDerWaalsContact NE2-CD1 3.27Å; H579-L583 WeakPolarHBondContact NE2-CD1 3.47Å; H579-L583 WeakPolarHBondContact NE2-CG 3.49Å; H579-L583 PolarHBondContact O-N 3.18Å; L580-L583 PolarHBondContact O-N 3.39Å; Q581-L583 PolarHBondContact O-N 3.33Å; L583-R585 PolarHBondContact O-N 3.29Å; L583-V586 PolarHBondContact O-N 3.26Å; L583-A587 VanDerWaalsContact O-CB 3.22Å; L583-A587 WeakPolarHBondContact O-CB 3.07Å; L583-A587 PolarHBondContact O-N 3.36Å
584	F	90.4	Very high	86.8	Confident	7 Å²	7	37.8 Å²	37.8	3%	0.031	21%	0.206	C	C	.	.	H	α-helix	trans	-64.2	-40.2	178.9	-90.1	-93.1	0	0	0	111.8	L192 L208 I211 A560 L564 L580 Q581 A587 T588	L192-F584 HydrophobicContact CD2-CD1 3.81Å; L192-F584 HydrophobicContact CD2-CE1 3.78Å; L208-F584 HydrophobicContact CD2-CB 3.85Å; I211-F584 HydrophobicContact CD1-CB 3.84Å; I211-F584 HydrophobicContact CD1-CD2 4Å; I211-F584 HydrophobicContact CD1-CG 3.94Å; A560-F584 HydrophobicContact CB-CD1 3.95Å; A560-F584 HydrophobicContact CB-CE1 3.97Å; L564-F584 HydrophobicContact CB-CE1 4.47Å; L564-F584 HydrophobicContact CB-CZ 4.03Å; L564-F584 HydrophobicContact CD1-CZ 4.11Å; L564-F584 HydrophobicContact CD2-CZ 4.4Å; L564-F584 HydrophobicContact CG-CZ 4.42Å; L580-F584 HydrophobicContact CD1-CD2 3.84Å; L580-F584 HydrophobicContact CD1-CE2 3.57Å; L580-F584 HydrophobicContact CG-CD2 3.97Å; L580-F584 HydrophobicContact CG-CE2 4.04Å; L580-F584 WeakPolarHBondContact O-CD2 3.48Å; L580-F584 PolarHBondContact O-N 3.12Å; Q581-F584 PolarHBondContact O-N 2.83Å; F584-A587 PolarHBondContact O-N 3.3Å; F584-T588 WeakPolarHBondContact O-CB 3.19Å; F584-T588 VanDerWaalsContact O-CG2 3.27Å; F584-T588 WeakPolarHBondContact O-CG2 3.31Å; F584-T588 PolarHBondContact O-N 2.75Å; F584-T588 PolarHBondContact O-OG1 2.76Å
585	R	93.4	Very high	87.5	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-59.9	-52.8	174.8	-176.4	175.5	-55.7	-72.5	-6.4	110.9	D158 L161 D207 L208 L209 Q581 A582 L583 A587 T588 T589	D158-R585 WeakPolarHBondContact OD1-CD 3.24Å; D158-R585 IonicContact OD1-CZ 3.67Å; D158-R585 IonicContact OD1-NE 3.15Å; D158-R585 PolarHBondContact OD1-NE 2.93Å; L161-R585 HydrophobicContact CB-CG 4.31Å; L161-R585 HydrophobicContact CD1-CG 4.37Å; D207-R585 IonicContact OD1-NH1 2.63Å; D207-R585 PolarHBondContact OD1-NH1 2.97Å; L208-R585 HydrophobicContact CD2-CB 4.21Å; L208-R585 VanDerWaalsContact O-CZ 3.26Å; L208-R585 PolarHBondContact O-NH1 3.12Å; L208-R585 PolarHBondContact O-NH2 3.22Å; L208-R585 VanDerWaalsContact O-NH2 3.09Å; L209-R585 PolarHBondContact O-NH2 3Å; Q581-R585 WeakPolarHBondContact O-CB 3.49Å; Q581-R585 PolarHBondContact O-N 3.49Å; A582-R585 PolarHBondContact O-N 3.02Å; L583-R585 PolarHBondContact O-N 3.29Å; R585-A587 PolarHBondContact O-N 3.28Å; R585-T588 PolarHBondContact O-N 3.21Å; R585-T589 VanDerWaalsContact O-CB 3.31Å; R585-T589 WeakPolarHBondContact O-CB 3.43Å; R585-T589 VanDerWaalsContact O-CG2 3.26Å; R585-T589 WeakPolarHBondContact O-CG2 3.47Å; R585-T589 PolarHBondContact O-N 3.32Å
586	V	92.3	Very high	87.7	Confident	2 Å²	2	33.3 Å²	33.3	1%	0.012	17%	0.172	C	C	.	.	H	α-helix	trans	-58.7	-37	179.2	170.6	0	0	0	0	111.7	R106 A109 L110 I157 L161 A582 L583	R106-V586 HydrophobicContact CG-CG1 4.01Å; A109-V586 HydrophobicContact CB-CB 4.32Å; A109-V586 HydrophobicContact CB-CG1 3.81Å; L110-V586 HydrophobicContact CD2-CG1 3.96Å; L110-V586 VanDerWaalsContact CD2-O 3.3Å; L110-V586 WeakPolarHBondContact CD2-O 3.09Å; L110-V586 HydrophobicContact CG-CG1 3.98Å; I157-V586 HydrophobicContact CG2-CG2 3.81Å; L161-V586 HydrophobicContact CD1-CG2 4.12Å; A582-V586 WeakPolarHBondContact O-CB 3.25Å; A582-V586 VanDerWaalsContact O-CG2 3.28Å; A582-V586 WeakPolarHBondContact O-CG2 3.28Å; A582-V586 PolarHBondContact O-N 3.41Å; L583-V586 PolarHBondContact O-N 3.26Å
587	A	91.1	Very high	87.5	Confident	21 Å²	21	34.2 Å²	34.2	17%	0.174	17%	0.174	C	C	.	.	H	α-helix	trans	-75.8	-27.8	-178.7	0	0	0	0	0	114.8	Y563 L583 F584 R585	Y563-A587 HydrophobicContact CD1-CB 3.7Å; Y563-A587 HydrophobicContact CD2-CB 3.28Å; Y563-A587 HydrophobicContact CE1-CB 3.92Å; Y563-A587 HydrophobicContact CE2-CB 3.51Å; Y563-A587 HydrophobicContact CG-CB 3.37Å; L583-A587 VanDerWaalsContact O-CB 3.22Å; L583-A587 WeakPolarHBondContact O-CB 3.07Å; L583-A587 PolarHBondContact O-N 3.36Å; F584-A587 PolarHBondContact O-N 3.3Å; R585-A587 PolarHBondContact O-N 3.28Å
588	T	91.5	Very high	87.4	Confident	2 Å²	2	31.7 Å²	31.7	1%	0.012	16%	0.161	C	C	.	.	H	α-helix	trans	-104.8	-29.6	-171	55.7	0	0	0	0	113.5	K559 A560 F584 R585	K559-T588 HydrophobicContact CB-CG2 4.24Å; A560-T588 HydrophobicContact CB-CG2 3.71Å; F584-T588 WeakPolarHBondContact O-CB 3.19Å; F584-T588 VanDerWaalsContact O-CG2 3.27Å; F584-T588 WeakPolarHBondContact O-CG2 3.31Å; F584-T588 PolarHBondContact O-N 2.75Å; F584-T588 PolarHBondContact O-OG1 2.76Å; R585-T588 PolarHBondContact O-N 3.21Å
589	T	91.4	Very high	87.1	Confident	16 Å²	16	25.6 Å²	25.6	10%	0.098	13%	0.132	C	C	.	.			trans	-64.3	144.5	-177.5	-167.5	0	0	0	0	112.2	L161 D207 R585 M591	L161-T589 HydrophobicContact CD1-CG2 3.98Å; L161-T589 HydrophobicContact CD2-CG2 4.18Å; D207-T589 VanDerWaalsContact OD2-CB 3.27Å; D207-T589 WeakPolarHBondContact OD2-CB 3.38Å; D207-T589 PolarHBondContact OD2-OG1 3.02Å; R585-T589 VanDerWaalsContact O-CB 3.31Å; R585-T589 WeakPolarHBondContact O-CB 3.43Å; R585-T589 VanDerWaalsContact O-CG2 3.26Å; R585-T589 WeakPolarHBondContact O-CG2 3.47Å; R585-T589 PolarHBondContact O-N 3.32Å; T589-M591 WeakPolarHBondContact OG1-CB 3.45Å; T589-M591 PolarHBondContact OG1-N 3.07Å
590	E	88.2	Confident	86.4	Confident	129 Å²	129	30.5 Å²	30.5	60%	0.603	15%	0.151	S	C	*	.			trans	-96.5	-2.6	165.8	-59.3	-166.2	159.4	0	0	112.1	K559	K559-E590 VanDerWaalsContact NZ-CG 3.33Å; K559-E590 IonicContact NZ-OE1 3.89Å; K559-E590 PolarHBondContact NZ-OE1 3.43Å
591	M	87.7	Confident	85.2	Confident	6 Å²	6	36 Å²	36	3%	0.03	18%	0.176	C	C	.	.	P	Polyproline II helix	trans	-76.7	144.8	176.6	-60.6	-168.5	-74.1	0	0	111.2	L161 Q164 L165 D207 T589	L161-M591 HydrophobicContact CD2-CB 3.95Å; L161-M591 WeakPolarHBondContact O-CE 3.16Å; Q164-M591 HydrophobicContact CB-SD 4.22Å; L165-M591 HydrophobicContact CB-CE 3.78Å; D207-M591 WeakPolarHBondContact OD2-CE 3.46Å; T589-M591 WeakPolarHBondContact OG1-CB 3.45Å; T589-M591 PolarHBondContact OG1-N 3.07Å
592	E	86.8	Confident	83.5	Confident	108 Å²	108	39.6 Å²	39.6	51%	0.505	19%	0.189	S	C	.	.	P	Polyproline II helix	trans	-89.6	136.7	169.9	-76.4	-64	131.2	0	0	110.3	R106 Q164	R106-E592 IonicContact CZ-OE1 3.61Å; R106-E592 IonicContact CZ-OE2 2.8Å; R106-E592 VanDerWaalsContact NH1-CD 3.31Å; R106-E592 IonicContact NH1-OE1 2.7Å; R106-E592 PolarHBondContact NH1-OE1 3.31Å; R106-E592 VanDerWaalsContact NH1-OE1 3.08Å; R106-E592 IonicContact NH1-OE2 3.4Å; R106-E592 PolarHBondContact NH1-OE2 2.96Å; R106-E592 IonicContact NH2-OE1 3.78Å; R106-E592 PolarHBondContact NH2-OE1 3.37Å; R106-E592 IonicContact NH2-OE2 3.23Å; Q164-E592 PolarHBondContact NE2-O 2.9Å
593	P	86.7	Confident	81.3	Confident	4 Å²	4	44.5 Å²	44.5	3%	0.026	22%	0.215	C	C	.	.	P	Polyproline II helix	trans	-59.2	142.8	172.2	-22.3	33.3	0	0	0	111.3	I157 L161 W595 L598	I157-P593 HydrophobicContact CG2-CB 4.33Å; I157-P593 HydrophobicContact CG2-CG 3.81Å; L161-P593 HydrophobicContact CD1-CG 4.41Å; L161-P593 HydrophobicContact CD2-CG 4.13Å; L161-P593 HydrophobicContact CG-CG 4.31Å; P593-W595 HydrophobicContact CB-CD2 4.26Å; P593-W595 HydrophobicContact CB-CE3 4.37Å; P593-W595 HydrophobicContact CB-CH2 4.38Å; P593-W595 HydrophobicContact CB-CZ2 4.23Å; P593-W595 HydrophobicContact CB-CZ3 4.41Å; P593-W595 HydrophobicContact CG-CH2 4.06Å; P593-W595 HydrophobicContact CG-CZ2 3.87Å; P593-W595 PolarHBondContact O-N 3.07Å; P593-W595 PolarHBondContact O-NE1 3.23Å; P593-L598 HydrophobicContact CB-CD1 3.86Å
594	G	83.1	Confident	78.7	Confident	17 Å²	17	53 Å²	53	18%	0.175	25%	0.254	C	S	.	.			trans	-69.4	77.7	170.1	0	0	0	0	0	110.4	N160 D596 D597 L598	N160-G594 PolarHBondContact OD1-N 3.45Å; G594-D596 PolarHBondContact O-N 3.44Å; G594-D597 PolarHBondContact O-N 3.04Å; G594-L598 PolarHBondContact O-N 2.75Å; G594-L598 VanDerWaalsContact O-N 3.07Å
595	W	82.4	Confident	76.1	Confident	42 Å²	42	56.5 Å²	56.5	16%	0.159	28%	0.28	C	S	.	.	H	α-helix	trans	-57.3	-34.3	-172.2	-62.7	109.6	0	0	0	113.8	L102 R106 I157 P593 L598 V599	L102-W595 HydrophobicContact CB-CE3 4.19Å; L102-W595 HydrophobicContact CB-CZ3 3.84Å; R106-W595 HydrophobicContact CB-CH2 3.91Å; R106-W595 VanDerWaalsContact CD-CH2 3.41Å; R106-W595 HydrophobicContact CG-CH2 4.27Å; I157-W595 HydrophobicContact CD1-CZ3 4.47Å; P593-W595 HydrophobicContact CB-CD2 4.26Å; P593-W595 HydrophobicContact CB-CE3 4.37Å; P593-W595 HydrophobicContact CB-CH2 4.38Å; P593-W595 HydrophobicContact CB-CZ2 4.23Å; P593-W595 HydrophobicContact CB-CZ3 4.41Å; P593-W595 HydrophobicContact CG-CH2 4.06Å; P593-W595 HydrophobicContact CG-CZ2 3.87Å; P593-W595 PolarHBondContact O-N 3.07Å; P593-W595 PolarHBondContact O-NE1 3.23Å; W595-L598 HydrophobicContact CE3-CD1 4.3Å; W595-V599 WeakPolarHBondContact O-CG2 3.37Å; W595-V599 PolarHBondContact O-N 3.1Å
596	D	79.4	Confident	73	Confident	46 Å²	46	63.1 Å²	63.1	25%	0.246	32%	0.315	C	S	.	.	H	α-helix	trans	-70.1	-38.8	179.1	-65.8	-14.3	0	0	0	111.2	R99 G594 V599 R600	R99-D596 IonicContact CZ-OD1 2.79Å; R99-D596 IonicContact NH1-OD1 2.77Å; R99-D596 PolarHBondContact NH1-OD1 3.32Å; G594-D596 PolarHBondContact O-N 3.44Å; D596-V599 PolarHBondContact O-N 3.11Å; D596-R600 WeakPolarHBondContact O-CB 3.46Å; D596-R600 VanDerWaalsContact O-CG 3.28Å; D596-R600 WeakPolarHBondContact O-CG 3.44Å; D596-R600 PolarHBondContact O-N 2.8Å; D596-R600 VanDerWaalsContact O-N 3.12Å
597	D	79.1	Confident	70.1	Confident	82 Å²	82	72.3 Å²	72.3	44%	0.439	38%	0.375	S	S	.	.	H	α-helix	trans	-67.2	-46.3	178.8	-53.9	-32.3	0	0	0	110.1	G594 V599 R600 E601	G594-D597 PolarHBondContact O-N 3.04Å; D597-V599 PolarHBondContact O-N 2.82Å; D597-R600 PolarHBondContact O-N 2.7Å; D597-R600 VanDerWaalsContact O-N 3.1Å; D597-E601 WeakPolarHBondContact O-CG 3.41Å; D597-E601 PolarHBondContact O-N 2.69Å
598	L	82.6	Confident	69	Low	12 Å²	12	74.9 Å²	74.9	6%	0.063	39%	0.385	C	S	.	.	H	α-helix	trans	-59.7	-32.4	177.4	-74.5	170.3	0	0	0	113.7	L102 S156 I157 N160 P593 G594 W595	L102-L598 HydrophobicContact CD1-CB 3.8Å; S156-L598 WeakPolarHBondContact O-CD2 3.2Å; I157-L598 HydrophobicContact CG1-CD1 4.01Å; N160-L598 HydrophobicContact CB-CD1 4.32Å; N160-L598 HydrophobicContact CB-CD2 3.83Å; N160-L598 HydrophobicContact CB-CG 4.11Å; P593-L598 HydrophobicContact CB-CD1 3.86Å; G594-L598 PolarHBondContact O-N 2.75Å; G594-L598 VanDerWaalsContact O-N 3.07Å; W595-L598 HydrophobicContact CE3-CD1 4.3Å
599	V	80.6	Confident	67.9	Low	2 Å²	2	78.7 Å²	78.7	1%	0.012	41%	0.405	C	S	.	.	H	α-helix	trans	-78.3	-36.1	177.9	170.9	0	0	0	0	110.9	L91 E95 R99 L102 W595 D596 D597	L91-V599 HydrophobicContact CD2-CG1 4.4Å; E95-V599 HydrophobicContact CB-CG1 3.57Å; E95-V599 HydrophobicContact CG-CG1 3.69Å; R99-V599 HydrophobicContact CB-CG2 3.83Å; R99-V599 HydrophobicContact CG-CG2 4.3Å; L102-V599 HydrophobicContact CD1-CG2 3.96Å; W595-V599 WeakPolarHBondContact O-CG2 3.37Å; W595-V599 PolarHBondContact O-N 3.1Å; D596-V599 PolarHBondContact O-N 3.11Å; D597-V599 PolarHBondContact O-N 2.82Å
600	R	69.8	Low	66.6	Low	110 Å²	110	82.2 Å²	82.2	42%	0.415	42%	0.422	S	S	.	.	H	α-helix	trans	-81.4	-37.6	-176.4	-70.8	175.9	-171.3	154.8	8.2	113.9	D596 D597 R602 N603	D596-R600 WeakPolarHBondContact O-CB 3.46Å; D596-R600 VanDerWaalsContact O-CG 3.28Å; D596-R600 WeakPolarHBondContact O-CG 3.44Å; D596-R600 PolarHBondContact O-N 2.8Å; D596-R600 VanDerWaalsContact O-N 3.12Å; D597-R600 PolarHBondContact O-N 2.7Å; D597-R600 VanDerWaalsContact O-N 3.1Å; R600-R602 PolarHBondContact O-N 3.17Å; R600-R602 VanDerWaalsContact O-N 3.11Å; R600-N603 PolarHBondContact O-N 2.72Å
601	E	61.2	Low	65.3	Low	119 Å²	119	79.4 Å²	79.4	56%	0.556	41%	0.411	S	S	*	.	H	α-helix	trans	-58.3	-25.4	176.3	-76.6	177.2	172.9	0	0	112.5	D597 N603 S605	D597-E601 WeakPolarHBondContact O-CG 3.41Å; D597-E601 PolarHBondContact O-N 2.69Å; E601-N603 VanDerWaalsContact C-N 3.31Å; E601-N603 PolarHBondContact O-N 2.92Å; E601-S605 PolarHBondContact O-OG 2.7Å
602	R	53.5	Low	63.9	Low	103 Å²	103	84 Å²	84	39%	0.389	44%	0.435	S	S	.	.	H	α-helix	trans	-70.9	-23.1	176.4	-150.5	178.7	-170.3	-151.8	-2	113.7	R600	R600-R602 PolarHBondContact O-N 3.17Å; R600-R602 VanDerWaalsContact O-N 3.11Å
603	N	45	Very low	62.4	Low	103 Å²	103	82.4 Å²	82.4	55%	0.551	43%	0.43	S	S	*	.	H	α-helix	trans	-84.9	-19.3	-179.8	-71.4	-19.8	0	0	0	112.6	E95 R600 E601	E95-N603 PolarHBondContact OE1-ND2 3.14Å; R600-N603 PolarHBondContact O-N 2.72Å; E601-N603 VanDerWaalsContact C-N 3.31Å; E601-N603 PolarHBondContact O-N 2.92Å
604	E	36.5	Very low	60.6	Low	181 Å²	181	88 Å²	88	85%	0.846	46%	0.459	S	S	*	.	H	α-helix	trans	-87	-16.4	177.1	-65.5	-172.7	168	0	0	113.1
605	S	35.7	Very low	58.9	Low	81 Å²	81	93.5 Å²	93.5	57%	0.566	48%	0.481	S	S	*	.	S	Bend	trans	-100	3.5	-174.1	36.1	0	0	0	0	114.9	E601 P607	E601-S605 PolarHBondContact O-OG 2.7Å; S605-P607 WeakPolarHBondContact O-CD 3.33Å
606	N	29.2	Very low	56.9	Low	140 Å²	140	97.8 Å²	97.8	75%	0.749	51%	0.508	S	S	*	.			trans	-113.1	92.6	169.8	-98.4	-10.8	0	0	0	110.4
607	P	30.6	Very low	54.9	Low	194 Å²	194	102.5 Å²	102.5	100%	1.26	53%	0.531	S	S	*	.			trans	-70.2	0	164.3	28.7	-32.1	0	0	0	113	S605	S605-P607 WeakPolarHBondContact O-CD 3.33Å

Retrieved 607 of 607 residues in 1495.4 ms (Link to these results)

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