A0A096LUU7_POEFO Loading...

Solute carrier family 22 member 4

AlphaFold DB , UniProt , Accession A0A096LUU7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 556 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	40.2	Very low	36.5	Very low	210 Å²	210	132.5 Å²	132.5	100%	1.034	67%	0.665	S	S	*	*				0	-23.8	0	-150.8	160	-176.7	0	0	112.2	S5	M1-S5 PolarHBondContact O-OG 3.07Å
2	T	38.1	Very low	37.8	Very low	112 Å²	112	132.7 Å²	132.7	69%	0.687	67%	0.669	S	S	*	*	H	α-helix	trans	-78.4	-30.6	176	21.2	0	0	0	0	115.1	S5 Q6	T2-S5 WeakPolarHBondContact CA-OG 3.36Å; T2-S5 PolarHBondContact O-OG 3.31Å; T2-Q6 PolarHBondContact O-N 2.81Å
3	E	31.9	Very low	39.7	Very low	156 Å²	156	126.8 Å²	126.8	73%	0.729	64%	0.64	S	S	*	*	H	α-helix	trans	-74.6	-37.8	176.3	-74.2	176.4	158.7	0	0	112.7	S5 Q6 E7	E3-S5 VanDerWaalsContact C-N 3.29Å; E3-S5 PolarHBondContact O-N 3.29Å; E3-Q6 PolarHBondContact O-N 3.05Å; E3-E7 PolarHBondContact O-N 3.4Å
4	I	34.2	Very low	42.4	Very low	114 Å²	114	125.1 Å²	125.1	59%	0.585	62%	0.622	S	S	*	*	H	α-helix	trans	-69.6	-26.5	177.5	-62	162.8	0	0	0	111.7	K8	I4-K8 PolarHBondContact O-N 3.26Å
5	S	32.7	Very low	44.8	Very low	59 Å²	59	123.1 Å²	123.1	41%	0.413	62%	0.615	S	S	.	*	H	α-helix	trans	-76	-35.4	171.9	45.6	0	0	0	0	112.7	M1 T2 E3 K8 D9	M1-S5 PolarHBondContact O-OG 3.07Å; T2-S5 WeakPolarHBondContact CA-OG 3.36Å; T2-S5 PolarHBondContact O-OG 3.31Å; E3-S5 VanDerWaalsContact C-N 3.29Å; E3-S5 PolarHBondContact O-N 3.29Å; S5-K8 PolarHBondContact O-N 3Å; S5-D9 PolarHBondContact O-N 3.01Å; S5-D9 VanDerWaalsContact O-N 3.12Å
6	Q	36	Very low	47	Very low	138 Å²	138	116.4 Å²	116.4	65%	0.645	58%	0.58	S	S	*	*	H	α-helix	trans	-68.7	-37.5	174	-80.1	-179.4	-48	0	0	112	T2 E3 K8 D9 D10	T2-Q6 PolarHBondContact O-N 2.81Å; E3-Q6 PolarHBondContact O-N 3.05Å; Q6-K8 VanDerWaalsContact C-N 3.31Å; Q6-K8 PolarHBondContact O-N 3.25Å; Q6-D9 PolarHBondContact O-N 3.46Å; Q6-D10 PolarHBondContact O-N 3.23Å; Q6-D10 VanDerWaalsContact O-N 3.09Å
7	E	32.1	Very low	49.2	Very low	141 Å²	141	111.8 Å²	111.8	66%	0.659	56%	0.558	S	S	*	*	H	α-helix	trans	-70.3	-27.4	178	-151.3	172.9	-159	0	0	112.7	E3	E3-E7 PolarHBondContact O-N 3.4Å
8	K	30.3	Very low	51.1	Low	151 Å²	151	110.3 Å²	110.3	66%	0.657	56%	0.556	S	S	*	*	H	α-helix	trans	-77.9	-34.2	172.1	-98.2	-179.2	173.5	179.4	0	113.9	I4 S5 Q6	I4-K8 PolarHBondContact O-N 3.26Å; S5-K8 PolarHBondContact O-N 3Å; Q6-K8 VanDerWaalsContact C-N 3.31Å; Q6-K8 PolarHBondContact O-N 3.25Å
9	D	39.9	Very low	52.8	Low	120 Å²	120	104.9 Å²	104.9	64%	0.642	53%	0.529	S	S	*	.	H	α-helix	trans	-73.9	-30	175.7	-91.9	-18.7	0	0	0	112.4	S5 Q6 Q11 N12	S5-D9 PolarHBondContact O-N 3.01Å; S5-D9 VanDerWaalsContact O-N 3.12Å; Q6-D9 PolarHBondContact O-N 3.46Å; D9-Q11 PolarHBondContact O-N 3.46Å; D9-N12 PolarHBondContact O-N 3.39Å
10	D	43.3	Very low	54.4	Low	96 Å²	96	100.5 Å²	100.5	51%	0.513	51%	0.507	S	S	.	.	G	3₁₀ helix	trans	-69.7	-21.1	176.2	-119.9	-3.1	0	0	0	113.2	Q6 K332	Q6-D10 PolarHBondContact O-N 3.23Å; Q6-D10 VanDerWaalsContact O-N 3.09Å; D10-K332 IonicContact OD1-NZ 3.54Å; D10-K332 PolarHBondContact OD1-NZ 3.07Å; D10-K332 IonicContact OD2-NZ 3.72Å
11	Q	43.3	Very low	56	Low	161 Å²	161	99.6 Å²	99.6	75%	0.752	51%	0.51	S	S	*	.	G	3₁₀ helix	trans	-79.7	-14.6	177.5	-80.8	-176.1	-11.5	0	0	114.5	D9	D9-Q11 PolarHBondContact O-N 3.46Å
12	N	52.2	Low	58.3	Low	134 Å²	134	91.6 Å²	91.6	72%	0.717	47%	0.47	S	S	*	.	G	3₁₀ helix	trans	-103.6	6.5	-174.5	-140.3	10.6	0	0	0	113.9	D9 R14	D9-N12 PolarHBondContact O-N 3.39Å; N12-R14 PolarHBondContact O-N 3.29Å
13	I	62.3	Low	60.6	Low	57 Å²	57	86.8 Å²	86.8	29%	0.292	44%	0.44	S	S	.	.			trans	-82.8	115.9	-178.9	-68.9	172.4	0	0	0	109.4	E329 K332	I13-E329 HydrophobicContact CG2-CG 4.09Å; I13-K332 HydrophobicContact CD1-CD 3.39Å; I13-K332 HydrophobicContact CG2-CD 4.39Å
14	R	76.9	Confident	63.3	Low	102 Å²	102	81.2 Å²	81.2	39%	0.385	42%	0.424	S	S	.	.			trans	-78.7	136.2	-177.2	-61.7	170.4	-62	162.6	9.4	109.9	N12 I19 I324 E329	N12-R14 PolarHBondContact O-N 3.29Å; R14-I19 HydrophobicContact CB-CD1 4.13Å; R14-I19 HydrophobicContact CB-CG1 3.64Å; R14-I324 PolarHBondContact NH2-O 2.71Å; R14-I324 VanDerWaalsContact NH2-O 3.08Å; R14-E329 IonicContact CZ-OE1 3.46Å; R14-E329 IonicContact NE-OE1 3.64Å; R14-E329 PolarHBondContact NE-OE1 3.4Å; R14-E329 IonicContact NH2-OE1 3.4Å; R14-E329 PolarHBondContact NH2-OE1 3.42Å; R14-E329 IonicContact NH2-OE2 3.85Å
15	D	79	Confident	65.7	Low	96 Å²	96	77.8 Å²	77.8	51%	0.513	41%	0.41	S	S	.	.			trans	-65.9	150.7	169.4	-173.9	24.1	0	0	0	110.7	D17 T18 I19	D15-D17 VanDerWaalsContact C-N 3.26Å; D15-D17 PolarHBondContact O-N 2.96Å; D15-T18 WeakPolarHBondContact O-CA 3.42Å; D15-T18 VanDerWaalsContact O-CB 3.3Å; D15-T18 WeakPolarHBondContact O-CB 3.4Å; D15-T18 PolarHBondContact O-N 2.65Å; D15-I19 WeakPolarHBondContact O-CG1 3.46Å; D15-I19 PolarHBondContact O-N 2.85Å
16	Y	80.3	Confident	68.3	Low	15 Å²	15	81.1 Å²	81.1	6%	0.059	41%	0.414	C	S	.	.	H	α-helix	trans	-56.1	-40.2	-177.6	178.6	-91.4	0	0	0	112.5	T18 I19 T20 P293 R294 Q297 F325	Y16-T18 PolarHBondContact O-N 3.06Å; Y16-I19 PolarHBondContact O-N 3.45Å; Y16-T20 HydrophobicContact CD1-CG2 4.29Å; Y16-T20 HydrophobicContact CD2-CG2 4.42Å; Y16-T20 HydrophobicContact CE1-CG2 3.82Å; Y16-T20 HydrophobicContact CE2-CG2 3.99Å; Y16-T20 PolarHBondContact O-N 2.77Å; Y16-T20 PolarHBondContact O-OG1 3.29Å; Y16-P293 WeakPolarHBondContact OH-CB 3.26Å; Y16-R294 HydrophobicContact CD1-CG 4.39Å; Y16-R294 HydrophobicContact CD2-CB 4.48Å; Y16-R294 HydrophobicContact CD2-CG 4.33Å; Y16-R294 HydrophobicContact CE1-CB 4.13Å; Y16-R294 HydrophobicContact CE1-CG 4.42Å; Y16-R294 HydrophobicContact CE2-CB 4Å; Y16-R294 HydrophobicContact CE2-CG 4.34Å; Y16-R294 HydrophobicContact CG-CG 4.34Å; Y16-R294 PolarHBondContact OH-N 2.92Å; Y16-Q297 VanDerWaalsContact CD2-OE1 3.24Å; Y16-F325 HydrophobicContact CD2-CE1 4.14Å; Y16-F325 HydrophobicContact CD2-CZ 4.47Å; Y16-F325 HydrophobicContact CE2-CE1 4.18Å; Y16-F325 HydrophobicContact CE2-CZ 4.05Å
17	D	83.1	Confident	70.9	Confident	39 Å²	39	75.4 Å²	75.4	21%	0.209	39%	0.392	C	S	.	.	H	α-helix	trans	-67.5	-28.2	178.8	-73.7	-21.4	0	0	0	111.3	D15 S21 P236 R239	D15-D17 VanDerWaalsContact C-N 3.26Å; D15-D17 PolarHBondContact O-N 2.96Å; D17-S21 PolarHBondContact O-N 3.3Å; D17-P236 HydrophobicContact CB-CG 4Å; D17-R239 IonicContact OD1-CZ 2.74Å; D17-R239 IonicContact OD1-NH1 2.95Å; D17-R239 PolarHBondContact OD1-NH1 3.47Å; D17-R239 IonicContact OD1-NH2 2.65Å; D17-R239 PolarHBondContact OD1-NH2 2.91Å; D17-R239 IonicContact OD2-CZ 3.42Å; D17-R239 IonicContact OD2-NH1 3.91Å; D17-R239 PolarHBondContact OD2-NH1 2.95Å; D17-R239 VanDerWaalsContact OD2-NH1 3.12Å; D17-R239 IonicContact OD2-NH2 2.87Å
18	T	83.6	Confident	73.8	Confident	84 Å²	84	76.8 Å²	76.8	52%	0.515	39%	0.391	S	S	.	.	H	α-helix	trans	-73.8	-44	171.8	-53.8	0	0	0	0	111.3	D15 Y16 T20 S21	D15-T18 WeakPolarHBondContact O-CA 3.42Å; D15-T18 VanDerWaalsContact O-CB 3.3Å; D15-T18 WeakPolarHBondContact O-CB 3.4Å; D15-T18 PolarHBondContact O-N 2.65Å; Y16-T18 PolarHBondContact O-N 3.06Å; T18-T20 VanDerWaalsContact C-N 3.27Å; T18-T20 PolarHBondContact O-N 3.12Å; T18-S21 WeakPolarHBondContact O-CB 3.41Å; T18-S21 PolarHBondContact O-N 3.35Å; T18-S21 PolarHBondContact O-OG 3.39Å
19	I	83.7	Confident	76.8	Confident	9 Å²	9	70.3 Å²	70.3	5%	0.046	36%	0.363	C	S	.	.	H	α-helix	trans	-59.4	-39.9	177.7	-65.4	171.3	0	0	0	111.1	R14 D15 Y16 F22 I324 F325	R14-I19 HydrophobicContact CB-CD1 4.13Å; R14-I19 HydrophobicContact CB-CG1 3.64Å; D15-I19 WeakPolarHBondContact O-CG1 3.46Å; D15-I19 PolarHBondContact O-N 2.85Å; Y16-I19 PolarHBondContact O-N 3.45Å; I19-F22 WeakPolarHBondContact O-CD1 3.4Å; I19-F22 WeakPolarHBondContact O-CE1 3.44Å; I19-I324 HydrophobicContact CG2-CG2 3.42Å; I19-I324 VanDerWaalsContact CG2-CG2 3.42Å; I19-I324 WeakPolarHBondContact CG2-O 3.38Å; I19-F325 HydrophobicContact CD1-CD1 4.17Å; I19-F325 HydrophobicContact CD1-CE1 4.39Å; I19-F325 HydrophobicContact CG2-CD1 4.19Å; I19-F325 HydrophobicContact CG2-CE1 3.98Å
20	T	85.4	Confident	79.3	Confident	15 Å²	15	64.8 Å²	64.8	9%	0.092	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	0.6	-176.2	56.4	0	0	0	0	114.2	Y16 T18 F22 L23 L309	Y16-T20 HydrophobicContact CD1-CG2 4.29Å; Y16-T20 HydrophobicContact CD2-CG2 4.42Å; Y16-T20 HydrophobicContact CE1-CG2 3.82Å; Y16-T20 HydrophobicContact CE2-CG2 3.99Å; Y16-T20 PolarHBondContact O-N 2.77Å; Y16-T20 PolarHBondContact O-OG1 3.29Å; T18-T20 VanDerWaalsContact C-N 3.27Å; T18-T20 PolarHBondContact O-N 3.12Å; T20-F22 PolarHBondContact O-N 2.86Å; T20-F22 VanDerWaalsContact O-N 3.14Å; T20-L23 WeakPolarHBondContact O-CB 3.45Å; T20-L23 PolarHBondContact O-N 3.09Å; T20-L23 VanDerWaalsContact O-N 3.08Å; T20-L309 HydrophobicContact CG2-CD1 4.14Å; T20-L309 HydrophobicContact CG2-CD2 4.04Å
21	S	87	Confident	81.7	Confident	82 Å²	82	65 Å²	65	57%	0.573	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-59.1	-27.9	-176.3	64.3	0	0	0	0	114.2	D17 T18 L23 G24	D17-S21 PolarHBondContact O-N 3.3Å; T18-S21 WeakPolarHBondContact O-CB 3.41Å; T18-S21 PolarHBondContact O-N 3.35Å; T18-S21 PolarHBondContact O-OG 3.39Å; S21-L23 PolarHBondContact O-N 3.11Å; S21-G24 PolarHBondContact O-N 2.89Å; S21-G24 VanDerWaalsContact O-N 3.08Å
22	F	88.4	Confident	84.1	Confident	42 Å²	42	61.6 Å²	61.6	18%	0.184	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-60.7	-24.8	176.8	74.3	-86.4	0	0	0	113.2	I19 T20 G24 A313 V318 A320 P321 I324	I19-F22 WeakPolarHBondContact O-CD1 3.4Å; I19-F22 WeakPolarHBondContact O-CE1 3.44Å; T20-F22 PolarHBondContact O-N 2.86Å; T20-F22 VanDerWaalsContact O-N 3.14Å; F22-G24 PolarHBondContact O-N 3.4Å; F22-A313 HydrophobicContact CE2-CB 3.9Å; F22-V318 WeakPolarHBondContact O-CG1 3.42Å; F22-A320 HydrophobicContact CE2-CB 3.97Å; F22-A320 HydrophobicContact CZ-CB 4.48Å; F22-P321 HydrophobicContact CD1-CG 4.49Å; F22-I324 HydrophobicContact CZ-CD1 4.14Å
23	L	87.6	Confident	86.1	Confident	12 Å²	12	55.2 Å²	55.2	6%	0.063	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-70.2	-9.8	177.3	-69.9	175.4	0	0	0	113.7	T20 S21 Q30 L309 A312 A313 N316	T20-L23 WeakPolarHBondContact O-CB 3.45Å; T20-L23 PolarHBondContact O-N 3.09Å; T20-L23 VanDerWaalsContact O-N 3.08Å; S21-L23 PolarHBondContact O-N 3.11Å; L23-Q30 PolarHBondContact O-NE2 3.3Å; L23-L309 HydrophobicContact CD1-CD2 3.7Å; L23-A312 HydrophobicContact CD1-CB 4.19Å; L23-A312 HydrophobicContact CD2-CB 3.88Å; L23-A313 HydrophobicContact CD2-CB 3.91Å; L23-N316 PolarHBondContact O-ND2 3.19Å
24	G	87.6	Confident	87.6	Confident	38 Å²	38	54.4 Å²	54.4	39%	0.392	27%	0.273	S	S	.	.			trans	70.9	-177.9	-174.9	0	0	0	0	0	113.3	S21 F22 Q30	S21-G24 PolarHBondContact O-N 2.89Å; S21-G24 VanDerWaalsContact O-N 3.08Å; F22-G24 PolarHBondContact O-N 3.4Å; G24-Q30 PolarHBondContact O-NE2 3.5Å; G24-Q30 VanDerWaalsContact O-NE2 3.08Å
25	S	84.6	Confident	88.4	Confident	42 Å²	42	54.2 Å²	54.2	29%	0.294	28%	0.279	S	S	.	.	S	Bend	trans	-92.1	-53.6	-177.8	50.3	0	0	0	0	113	Q30 S235 T238	S25-Q30 WeakPolarHBondContact O-CG 3.12Å; S25-S235 WeakPolarHBondContact CA-OG 3.47Å; S25-S235 PolarHBondContact O-OG 2.83Å; S25-T238 PolarHBondContact O-OG1 2.89Å
26	W	88.3	Confident	89.2	Confident	130 Å²	130	49.9 Å²	49.9	49%	0.492	26%	0.257	S	S	.	.	S	Bend	trans	-116.9	53.8	-172.7	-77.4	96.9	0	0	0	113.3	M31 T238 V241	W26-M31 HydrophobicContact CE3-CG 4.26Å; W26-T238 HydrophobicContact CE3-CG2 4.37Å; W26-T238 HydrophobicContact CH2-CG2 4.02Å; W26-T238 HydrophobicContact CZ2-CG2 4.16Å; W26-T238 HydrophobicContact CZ3-CG2 4.12Å; W26-V241 HydrophobicContact CH2-CG1 4.29Å; W26-V241 HydrophobicContact CZ2-CB 4.25Å; W26-V241 HydrophobicContact CZ2-CG1 4.32Å; W26-V241 HydrophobicContact CZ2-CG2 4.17Å
27	G	90.4	Very high	89.8	Confident	17 Å²	17	49.2 Å²	49.2	18%	0.175	25%	0.254	C	S	.	.			trans	-79.3	174.1	173.6	0	0	0	0	0	113.6	F29 Q30 M31 N316	G27-F29 VanDerWaalsContact C-N 3.29Å; G27-F29 PolarHBondContact O-N 2.88Å; G27-Q30 VanDerWaalsContact C-OE1 3.31Å; G27-Q30 VanDerWaalsContact N-OE1 3.08Å; G27-Q30 PolarHBondContact O-N 3.02Å; G27-Q30 PolarHBondContact O-OE1 3.2Å; G27-M31 PolarHBondContact O-N 3.2Å; G27-N316 WeakPolarHBondContact CA-OD1 3.26Å
28	R	92.9	Very high	90.3	Very high	170 Å²	170	47.5 Å²	47.5	64%	0.642	25%	0.246	S	C	*	.	H	α-helix	trans	-62	-37.1	178	-67.5	-178.9	175.3	-168.3	-5.2	112.1	R32 N316	R28-R32 WeakPolarHBondContact O-CB 3.39Å; R28-R32 PolarHBondContact O-N 2.86Å; R28-N316 PolarHBondContact N-OD1 3.17Å
29	F	93.1	Very high	90.8	Very high	16 Å²	16	46.9 Å²	46.9	7%	0.07	24%	0.239	C	C	.	.	H	α-helix	trans	-60.6	-51.4	174.3	175.1	-100.4	0	0	0	110.8	G27 M31 R32 I33 V233 P290 A312 L315 N316	G27-F29 VanDerWaalsContact C-N 3.29Å; G27-F29 PolarHBondContact O-N 2.88Å; F29-M31 VanDerWaalsContact C-N 3.34Å; F29-M31 PolarHBondContact O-N 3Å; F29-R32 WeakPolarHBondContact O-CB 3.41Å; F29-R32 PolarHBondContact O-N 3.31Å; F29-R32 VanDerWaalsContact O-N 3.17Å; F29-I33 HydrophobicContact CD1-CG1 4.44Å; F29-I33 HydrophobicContact CD2-CG1 4.41Å; F29-I33 HydrophobicContact CE1-CG1 4.07Å; F29-I33 HydrophobicContact CE2-CD1 4.18Å; F29-I33 HydrophobicContact CE2-CG1 4.04Å; F29-I33 HydrophobicContact CZ-CD1 4.31Å; F29-I33 HydrophobicContact CZ-CG1 3.86Å; F29-I33 WeakPolarHBondContact O-CG1 3.44Å; F29-I33 PolarHBondContact O-N 3.25Å; F29-V233 HydrophobicContact CE1-CG1 3.86Å; F29-V233 HydrophobicContact CZ-CG1 3.93Å; F29-P290 HydrophobicContact CE2-CG 4.22Å; F29-P290 HydrophobicContact CZ-CG 4.09Å; F29-A312 HydrophobicContact CB-CB 4.24Å; F29-A312 HydrophobicContact CD1-CB 3.69Å; F29-A312 HydrophobicContact CD2-CB 3.69Å; F29-A312 HydrophobicContact CE1-CB 3.89Å; F29-A312 HydrophobicContact CE2-CB 3.88Å; F29-A312 HydrophobicContact CG-CB 3.59Å; F29-A312 HydrophobicContact CZ-CB 3.97Å; F29-L315 HydrophobicContact CB-CB 4.27Å; F29-L315 HydrophobicContact CD2-CD1 3.98Å; F29-N316 WeakPolarHBondContact CB-OD1 3.44Å; F29-N316 PolarHBondContact N-OD1 3.34Å
30	Q	93.2	Very high	91.3	Very high	4 Å²	4	46.5 Å²	46.5	2%	0.019	24%	0.236	C	C	.	.	H	α-helix	trans	-62.1	-41.2	-178.8	-64.9	86.5	-16.6	0	0	111.6	L23 G24 S25 G27 I33 F34 L234 T238 N316	L23-Q30 PolarHBondContact O-NE2 3.3Å; G24-Q30 PolarHBondContact O-NE2 3.5Å; G24-Q30 VanDerWaalsContact O-NE2 3.08Å; S25-Q30 WeakPolarHBondContact O-CG 3.12Å; G27-Q30 VanDerWaalsContact C-OE1 3.31Å; G27-Q30 VanDerWaalsContact N-OE1 3.08Å; G27-Q30 PolarHBondContact O-N 3.02Å; G27-Q30 PolarHBondContact O-OE1 3.2Å; Q30-I33 PolarHBondContact O-N 3.18Å; Q30-F34 VanDerWaalsContact O-CB 3.23Å; Q30-F34 WeakPolarHBondContact O-CB 3.41Å; Q30-F34 PolarHBondContact O-N 3.43Å; Q30-L234 HydrophobicContact CB-CD2 4.15Å; Q30-T238 HydrophobicContact CB-CG2 4.43Å; Q30-N316 PolarHBondContact NE2-ND2 3.2Å; Q30-N316 PolarHBondContact OE1-ND2 3.37Å; Q30-N316 PolarHBondContact OE1-OD1 3.23Å
31	M	92.7	Very high	91.6	Very high	99 Å²	99	45.8 Å²	45.8	49%	0.488	23%	0.232	S	C	.	.	H	α-helix	trans	-63.1	-42.9	174.6	-73	-174.7	69.9	0	0	112.7	W26 G27 F29 I33 F34 L35	W26-M31 HydrophobicContact CE3-CG 4.26Å; G27-M31 PolarHBondContact O-N 3.2Å; F29-M31 VanDerWaalsContact C-N 3.34Å; F29-M31 PolarHBondContact O-N 3Å; M31-I33 PolarHBondContact O-N 3.09Å; M31-F34 PolarHBondContact O-N 3.32Å; M31-L35 WeakPolarHBondContact O-CB 3.37Å; M31-L35 WeakPolarHBondContact O-CG 3.24Å; M31-L35 PolarHBondContact O-N 2.92Å
32	R	94.4	Very high	91.9	Very high	90 Å²	90	44.4 Å²	44.4	34%	0.34	22%	0.218	S	C	.	.	H	α-helix	trans	-58.5	-47.5	176.3	177.5	-174	175.9	170.8	10.4	111	R28 F29 A36 W287 F288	R28-R32 WeakPolarHBondContact O-CB 3.39Å; R28-R32 PolarHBondContact O-N 2.86Å; F29-R32 WeakPolarHBondContact O-CB 3.41Å; F29-R32 PolarHBondContact O-N 3.31Å; F29-R32 VanDerWaalsContact O-N 3.17Å; R32-A36 WeakPolarHBondContact O-CB 3.31Å; R32-A36 PolarHBondContact O-N 3.31Å; R32-W287 PolarHBondContact NH2-O 3.02Å; R32-F288 HydrophobicContact CG-CD1 4.27Å; R32-F288 VanDerWaalsContact NE-CD1 3.31Å
33	I	93.8	Very high	92	Very high	1 Å²	1	42.5 Å²	42.5	1%	0.005	21%	0.21	C	C	.	.	H	α-helix	trans	-66.8	-44.8	179.4	-60.7	-46.2	0	0	0	111.5	F29 Q30 M31 L35 A36 L37 V233 L234 F288 P290	F29-I33 HydrophobicContact CD1-CG1 4.44Å; F29-I33 HydrophobicContact CD2-CG1 4.41Å; F29-I33 HydrophobicContact CE1-CG1 4.07Å; F29-I33 HydrophobicContact CE2-CD1 4.18Å; F29-I33 HydrophobicContact CE2-CG1 4.04Å; F29-I33 HydrophobicContact CZ-CD1 4.31Å; F29-I33 HydrophobicContact CZ-CG1 3.86Å; F29-I33 WeakPolarHBondContact O-CG1 3.44Å; F29-I33 PolarHBondContact O-N 3.25Å; Q30-I33 PolarHBondContact O-N 3.18Å; M31-I33 PolarHBondContact O-N 3.09Å; I33-L35 VanDerWaalsContact C-N 3.34Å; I33-L35 PolarHBondContact O-N 3.23Å; I33-A36 PolarHBondContact O-N 3.45Å; I33-L37 HydrophobicContact CG2-CD1 3.64Å; I33-L37 HydrophobicContact CG2-CG 4.19Å; I33-L37 WeakPolarHBondContact O-CB 3.41Å; I33-L37 WeakPolarHBondContact O-CG 3.34Å; I33-L37 PolarHBondContact O-N 3.44Å; I33-V233 HydrophobicContact CG1-CG1 4.2Å; I33-V233 HydrophobicContact CG2-CB 4.49Å; I33-V233 HydrophobicContact CG2-CG1 4.03Å; I33-L234 HydrophobicContact CB-CD2 4.16Å; I33-L234 HydrophobicContact CG2-CD2 4.09Å; I33-L234 HydrophobicContact CG2-CG 4.48Å; I33-F288 WeakPolarHBondContact CD1-O 3.11Å; I33-P290 HydrophobicContact CD1-CG 3.88Å
34	F	94	Very high	92.1	Very high	39 Å²	39	42.5 Å²	42.5	17%	0.171	21%	0.21	C	C	.	.	H	α-helix	trans	-54.7	-50.3	177.5	-175.5	-76.6	0	0	0	111.3	Q30 M31 G38 L234 T238 V241 F242	Q30-F34 VanDerWaalsContact O-CB 3.23Å; Q30-F34 WeakPolarHBondContact O-CB 3.41Å; Q30-F34 PolarHBondContact O-N 3.43Å; M31-F34 PolarHBondContact O-N 3.32Å; F34-G38 PolarHBondContact O-N 3.14Å; F34-L234 HydrophobicContact CD2-CD1 4.48Å; F34-T238 HydrophobicContact CD2-CG2 4.01Å; F34-V241 HydrophobicContact CE2-CG1 4.16Å; F34-V241 HydrophobicContact CZ-CG1 4.43Å; F34-F242 HydrophobicContact CD2-CB 3.75Å; F34-F242 AromaticContact CD2-CD2 3.65Å; F34-F242 HydrophobicContact CD2-CD2 3.65Å; F34-F242 HydrophobicContact CD2-CG 4.15Å; F34-F242 HydrophobicContact CE2-CB 3.65Å; F34-F242 AromaticContact CE2-CD2 3.83Å; F34-F242 HydrophobicContact CE2-CD2 3.83Å; F34-F242 HydrophobicContact CE2-CG 4.25Å; F34-F242 HydrophobicContact CG-CD2 4.08Å; F34-F242 HydrophobicContact CZ-CD2 4.38Å
35	L	93.8	Very high	92	Very high	99 Å²	99	40.9 Å²	40.9	52%	0.518	19%	0.193	S	C	.	.	H	α-helix	trans	-70.4	-42.1	-179.7	-68.3	173.5	0	0	0	111.9	M31 I33 L37 G38 I39	M31-L35 WeakPolarHBondContact O-CB 3.37Å; M31-L35 WeakPolarHBondContact O-CG 3.24Å; M31-L35 PolarHBondContact O-N 2.92Å; I33-L35 VanDerWaalsContact C-N 3.34Å; I33-L35 PolarHBondContact O-N 3.23Å; L35-L37 PolarHBondContact O-N 3.34Å; L35-G38 PolarHBondContact O-N 3.45Å; L35-I39 WeakPolarHBondContact O-CB 3.4Å; L35-I39 WeakPolarHBondContact O-CD1 3.34Å; L35-I39 WeakPolarHBondContact O-CG1 3.42Å; L35-I39 PolarHBondContact O-N 3.49Å
36	A	95.2	Very high	92	Very high	5 Å²	5	39.8 Å²	39.8	4%	0.041	18%	0.183	C	C	.	.	H	α-helix	trans	-62.1	-44.5	179.5	0	0	0	0	0	112.1	R32 I33 S40 L285 F288 I289	R32-A36 WeakPolarHBondContact O-CB 3.31Å; R32-A36 PolarHBondContact O-N 3.31Å; I33-A36 PolarHBondContact O-N 3.45Å; A36-S40 PolarHBondContact O-N 3.36Å; A36-L285 HydrophobicContact CB-CD2 4.11Å; A36-F288 HydrophobicContact CB-CB 4.03Å; A36-I289 HydrophobicContact CB-CD1 4.44Å; A36-I289 HydrophobicContact CB-CG1 3.9Å
37	L	93.9	Very high	91.8	Very high	0 Å²	0	34 Å²	34	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-71.4	-35.2	175.7	-66.1	174.2	0	0	0	112.2	I33 L35 S40 I41 A226 L229 F242 I289	I33-L37 HydrophobicContact CG2-CD1 3.64Å; I33-L37 HydrophobicContact CG2-CG 4.19Å; I33-L37 WeakPolarHBondContact O-CB 3.41Å; I33-L37 WeakPolarHBondContact O-CG 3.34Å; I33-L37 PolarHBondContact O-N 3.44Å; L35-L37 PolarHBondContact O-N 3.34Å; L37-S40 PolarHBondContact O-N 2.68Å; L37-S40 PolarHBondContact O-OG 3.35Å; L37-I41 WeakPolarHBondContact O-CD1 3.48Å; L37-I41 WeakPolarHBondContact O-CG1 2.99Å; L37-I41 PolarHBondContact O-N 3.01Å; L37-A226 HydrophobicContact CD2-CB 4.3Å; L37-L229 HydrophobicContact CD2-CD2 4.11Å; L37-L229 HydrophobicContact CD2-CG 4.44Å; L37-F242 HydrophobicContact CB-CE2 3.82Å; L37-F242 HydrophobicContact CB-CZ 3.59Å; L37-F242 HydrophobicContact CD1-CE1 4.41Å; L37-F242 HydrophobicContact CD1-CZ 4.01Å; L37-F242 HydrophobicContact CG-CZ 4.47Å; L37-I289 HydrophobicContact CD2-CD1 3.84Å; L37-I289 HydrophobicContact CD2-CG1 4.3Å; L37-I289 HydrophobicContact CD2-CG2 4.23Å
38	G	93	Very high	91.3	Very high	4 Å²	4	33.5 Å²	33.5	4%	0.041	16%	0.157	C	C	.	.	H	α-helix	trans	-60.1	-49.6	171.9	0	0	0	0	0	111.8	F34 L35 S40 I41 I42 S250	F34-G38 PolarHBondContact O-N 3.14Å; L35-G38 PolarHBondContact O-N 3.45Å; G38-S40 VanDerWaalsContact C-N 3.26Å; G38-S40 PolarHBondContact O-N 3.38Å; G38-I41 WeakPolarHBondContact O-CB 3.48Å; G38-I41 PolarHBondContact O-N 3.09Å; G38-I42 PolarHBondContact O-N 3.38Å; G38-S250 VanDerWaalsContact CA-OG 3.28Å; G38-S250 WeakPolarHBondContact CA-OG 2.96Å; G38-S250 VanDerWaalsContact O-CB 3.22Å; G38-S250 WeakPolarHBondContact O-CB 3.3Å; G38-S250 PolarHBondContact O-OG 3.39Å
39	I	94.1	Very high	90.8	Very high	71 Å²	71	26 Å²	26	36%	0.364	13%	0.13	S	C	.	.	H	α-helix	trans	-59.1	-38.9	176.4	-70.1	165.1	0	0	0	111.1	L35 I41 I42 P43 I281 L285	L35-I39 WeakPolarHBondContact O-CB 3.4Å; L35-I39 WeakPolarHBondContact O-CD1 3.34Å; L35-I39 WeakPolarHBondContact O-CG1 3.42Å; L35-I39 PolarHBondContact O-N 3.49Å; I39-I41 PolarHBondContact O-N 3.29Å; I39-I42 PolarHBondContact O-N 2.99Å; I39-P43 WeakPolarHBondContact O-CD 3.44Å; I39-I281 HydrophobicContact CG2-CG2 3.34Å; I39-L285 HydrophobicContact CG2-CD1 4.39Å; I39-L285 HydrophobicContact CG2-CD2 4.3Å
40	S	93.6	Very high	90.7	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-64	-22.4	177.7	93.8	0	0	0	0	113.4	A36 L37 G38 Y282	A36-S40 PolarHBondContact O-N 3.36Å; L37-S40 PolarHBondContact O-N 2.68Å; L37-S40 PolarHBondContact O-OG 3.35Å; G38-S40 VanDerWaalsContact C-N 3.26Å; G38-S40 PolarHBondContact O-N 3.38Å; S40-Y282 WeakPolarHBondContact O-CE1 3.26Å
41	I	92.3	Very high	90.6	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-86.7	-25.9	-179.2	-71.4	161.1	0	0	0	112	L37 G38 I39 N44 Y223 A226 F242 V247	L37-I41 WeakPolarHBondContact O-CD1 3.48Å; L37-I41 WeakPolarHBondContact O-CG1 2.99Å; L37-I41 PolarHBondContact O-N 3.01Å; G38-I41 WeakPolarHBondContact O-CB 3.48Å; G38-I41 PolarHBondContact O-N 3.09Å; I39-I41 PolarHBondContact O-N 3.29Å; I41-N44 VanDerWaalsContact O-CB 3.32Å; I41-N44 WeakPolarHBondContact O-CB 3.4Å; I41-N44 PolarHBondContact O-N 3.03Å; I41-Y223 HydrophobicContact CG1-CD2 4.26Å; I41-Y223 HydrophobicContact CG2-CD2 3.74Å; I41-Y223 HydrophobicContact CG2-CE2 3.7Å; I41-A226 HydrophobicContact CD1-CB 4.36Å; I41-A226 HydrophobicContact CG1-CB 4.21Å; I41-F242 HydrophobicContact CD1-CZ 4.39Å; I41-V247 HydrophobicContact CD1-CB 4.18Å; I41-V247 HydrophobicContact CD1-CG1 4.04Å; I41-V247 HydrophobicContact CD1-CG2 3.8Å
42	I	92.5	Very high	90.6	Very high	53 Å²	53	21.1 Å²	21.1	27%	0.272	11%	0.107	S	C	.	.	H	α-helix	trans	-52.6	-48.8	-176.9	-63.6	173	0	0	0	112.2	G38 I39 N44 G45 F46 G254	G38-I42 PolarHBondContact O-N 3.38Å; I39-I42 PolarHBondContact O-N 2.99Å; I42-N44 PolarHBondContact O-N 2.83Å; I42-N44 VanDerWaalsContact O-N 3.12Å; I42-G45 PolarHBondContact O-N 3.04Å; I42-F46 PolarHBondContact O-N 3.31Å; I42-G254 VanDerWaalsContact O-CA 3.3Å; I42-G254 WeakPolarHBondContact O-CA 3.4Å
43	P	91.8	Very high	90.5	Very high	2 Å²	2	17.1 Å²	17.1	1%	0.013	9%	0.092	C	C	.	.	H	α-helix	trans	-65.2	-18.7	-179.6	-20.3	33	0	0	0	113.8	I39 F46 T47 I281 Y282	I39-P43 WeakPolarHBondContact O-CD 3.44Å; P43-F46 PolarHBondContact O-N 3.12Å; P43-T47 VanDerWaalsContact O-CB 3.3Å; P43-T47 WeakPolarHBondContact O-CB 3.24Å; P43-T47 VanDerWaalsContact O-CG2 3.22Å; P43-T47 WeakPolarHBondContact O-CG2 3.48Å; P43-T47 PolarHBondContact O-N 3.22Å; P43-T47 PolarHBondContact O-OG1 3.18Å; P43-I281 HydrophobicContact CG-CD1 4.39Å; P43-Y282 HydrophobicContact CB-CE1 4.37Å; P43-Y282 WeakPolarHBondContact CB-OH 3.48Å; P43-Y282 HydrophobicContact CG-CE1 3.78Å
44	N	89	Confident	90.5	Very high	13 Å²	13	17 Å²	17	7%	0.07	9%	0.091	C	C	.	.	H	α-helix	trans	-71.5	-40.6	175.2	-66.4	-56.6	0	0	0	112.5	I41 I42 F46 T47 G48 Q192 G219 N222 Y223	I41-N44 VanDerWaalsContact O-CB 3.32Å; I41-N44 WeakPolarHBondContact O-CB 3.4Å; I41-N44 PolarHBondContact O-N 3.03Å; I42-N44 PolarHBondContact O-N 2.83Å; I42-N44 VanDerWaalsContact O-N 3.12Å; N44-F46 PolarHBondContact O-N 3.5Å; N44-T47 WeakPolarHBondContact CA-OG1 3.31Å; N44-T47 PolarHBondContact O-N 3.06Å; N44-G48 PolarHBondContact O-N 3.39Å; N44-Q192 PolarHBondContact OD1-NE2 3.41Å; N44-Q192 VanDerWaalsContact OD1-NE2 3.15Å; N44-G219 PolarHBondContact OD1-O 2.99Å; N44-N222 PolarHBondContact ND2-OD1 2.92Å; N44-N222 PolarHBondContact OD1-ND2 3.43Å; N44-N222 PolarHBondContact OD1-OD1 3.27Å; N44-Y223 HydrophobicContact CB-CD2 4.41Å
45	G	85.4	Confident	90.4	Very high	4 Å²	4	15.4 Å²	15.4	4%	0.041	9%	0.086	C	C	.	.	H	α-helix	trans	-63.1	-35.9	173.1	0	0	0	0	0	111.6	I42 S251	I42-G45 PolarHBondContact O-N 3.04Å; G45-S251 WeakPolarHBondContact CA-O 3.44Å
46	F	83.6	Confident	90.3	Very high	18 Å²	18	11.2 Å²	11.2	8%	0.079	7%	0.065	C	C	.	.	H	α-helix	trans	-69.6	-48.1	176.7	-162.2	-99.2	0	0	0	112.1	I42 P43 N44 G254 A257 M258 V261 M275	I42-F46 PolarHBondContact O-N 3.31Å; P43-F46 PolarHBondContact O-N 3.12Å; N44-F46 PolarHBondContact O-N 3.5Å; F46-G254 WeakPolarHBondContact CD2-O 3.45Å; F46-A257 HydrophobicContact CD2-CB 4.02Å; F46-A257 HydrophobicContact CE2-CB 4.18Å; F46-M258 HydrophobicContact CD2-CB 3.78Å; F46-M258 HydrophobicContact CD2-CG 4.24Å; F46-M258 HydrophobicContact CE2-CB 4.09Å; F46-M258 HydrophobicContact CE2-CG 4.44Å; F46-M258 HydrophobicContact CG-CB 4.36Å; F46-M258 HydrophobicContact CG-CG 4.46Å; F46-M258 WeakPolarHBondContact O-CG 3.43Å; F46-V261 HydrophobicContact CE2-CB 3.99Å; F46-V261 HydrophobicContact CE2-CG2 3.72Å; F46-V261 HydrophobicContact CZ-CB 3.76Å; F46-V261 HydrophobicContact CZ-CG1 3.96Å; F46-V261 HydrophobicContact CZ-CG2 3.75Å; F46-M275 HydrophobicContact CD1-CB 4.45Å; F46-M275 HydrophobicContact CD1-CE 3.31Å; F46-M275 HydrophobicContact CD1-CG 4.25Å; F46-M275 HydrophobicContact CE1-CB 4.23Å; F46-M275 HydrophobicContact CE1-CE 3.63Å; F46-M275 HydrophobicContact CE1-CG 3.8Å; F46-M275 HydrophobicContact CG-CE 4.22Å; F46-M275 WeakPolarHBondContact O-CE 3.22Å
47	T	84.6	Confident	90.1	Very high	8 Å²	8	14.2 Å²	14.2	5%	0.049	8%	0.083	C	C	.	.	H	α-helix	trans	-81.1	-18.2	-177	56.8	0	0	0	0	114.9	P43 N44 I49 Y50 Q192 L196 M275	P43-T47 VanDerWaalsContact O-CB 3.3Å; P43-T47 WeakPolarHBondContact O-CB 3.24Å; P43-T47 VanDerWaalsContact O-CG2 3.22Å; P43-T47 WeakPolarHBondContact O-CG2 3.48Å; P43-T47 PolarHBondContact O-N 3.22Å; P43-T47 PolarHBondContact O-OG1 3.18Å; N44-T47 WeakPolarHBondContact CA-OG1 3.31Å; N44-T47 PolarHBondContact O-N 3.06Å; T47-I49 PolarHBondContact O-N 3.26Å; T47-Y50 WeakPolarHBondContact O-CD1 3.4Å; T47-Y50 WeakPolarHBondContact O-CE1 3.44Å; T47-Q192 PolarHBondContact OG1-NE2 3.49Å; T47-L196 HydrophobicContact CG2-CD1 3.53Å; T47-M275 HydrophobicContact CG2-CE 3.91Å
48	G	79.6	Confident	90	Very high	8 Å²	8	14.4 Å²	14.4	8%	0.082	8%	0.084	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-21	177.1	0	0	0	0	0	113.7	N44	N44-G48 PolarHBondContact O-N 3.39Å
49	I	83.7	Confident	89.9	Confident	13 Å²	13	18.6 Å²	18.6	7%	0.067	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-126.7	-7.3	-161.5	-56.7	173.5	0	0	0	113.7	T47 I51 V52 Y255 I374	T47-I49 PolarHBondContact O-N 3.26Å; I49-I51 PolarHBondContact O-N 3.35Å; I49-V52 HydrophobicContact CG2-CB 4.4Å; I49-V52 HydrophobicContact CG2-CG2 3.81Å; I49-V52 VanDerWaalsContact O-CB 3.31Å; I49-V52 WeakPolarHBondContact O-CB 3.47Å; I49-V52 WeakPolarHBondContact O-CG2 3.43Å; I49-V52 PolarHBondContact O-N 3.44Å; I49-Y255 HydrophobicContact CB-CD2 4.16Å; I49-Y255 HydrophobicContact CB-CE2 4.11Å; I49-Y255 HydrophobicContact CD1-CD1 3.61Å; I49-Y255 HydrophobicContact CD1-CD2 3.18Å; I49-Y255 HydrophobicContact CD1-CE1 3.71Å; I49-Y255 HydrophobicContact CD1-CE2 3.31Å; I49-Y255 HydrophobicContact CD1-CG 3.37Å; I49-Y255 HydrophobicContact CG1-CD2 4.2Å; I49-Y255 HydrophobicContact CG1-CE2 4.23Å; I49-Y255 HydrophobicContact CG2-CD2 4.08Å; I49-Y255 HydrophobicContact CG2-CE2 3.53Å; I49-I374 HydrophobicContact CB-CG2 4.49Å; I49-I374 HydrophobicContact CD1-CD1 4.33Å; I49-I374 HydrophobicContact CD1-CG2 4.1Å; I49-I374 HydrophobicContact CG1-CG2 4.07Å; I49-I374 HydrophobicContact CG2-CG2 3.66Å
50	Y	90.3	Very high	89.8	Confident	1 Å²	1	16.6 Å²	16.6	0%	0.004	10%	0.1	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-23.2	-179.4	73.7	-86.3	0	0	0	115.5	T47 V52 F53 V54 L196 Q199 F212 L272 M275	T47-Y50 WeakPolarHBondContact O-CD1 3.4Å; T47-Y50 WeakPolarHBondContact O-CE1 3.44Å; Y50-V52 PolarHBondContact O-N 3.42Å; Y50-V52 VanDerWaalsContact O-N 3.14Å; Y50-F53 PolarHBondContact O-N 3.33Å; Y50-V54 HydrophobicContact CD2-CB 3.91Å; Y50-V54 HydrophobicContact CD2-CG2 3.58Å; Y50-V54 HydrophobicContact CE2-CB 4.34Å; Y50-V54 HydrophobicContact CE2-CG1 4.48Å; Y50-V54 HydrophobicContact CE2-CG2 4.23Å; Y50-V54 PolarHBondContact O-N 2.99Å; Y50-L196 HydrophobicContact CE1-CD2 4.15Å; Y50-Q199 PolarHBondContact OH-NE2 3Å; Y50-Q199 PolarHBondContact OH-OE1 2.94Å; Y50-F212 AromaticContact CE1-CE2 3.88Å; Y50-F212 HydrophobicContact CE1-CE2 3.88Å; Y50-F212 HydrophobicContact CE2-CE2 4.44Å; Y50-F212 AromaticContact CZ-CE2 3.52Å; Y50-F212 WeakPolarHBondContact OH-CD2 3.37Å; Y50-F212 WeakPolarHBondContact OH-CE2 3.42Å; Y50-L272 HydrophobicContact CD2-CD2 3.99Å; Y50-L272 HydrophobicContact CE2-CD2 3.56Å; Y50-M275 VanDerWaalsContact CB-CE 3.43Å; Y50-M275 WeakPolarHBondContact CB-SD 3.49Å; Y50-M275 HydrophobicContact CD1-CE 3.6Å; Y50-M275 HydrophobicContact CD1-SD 3.45Å; Y50-M275 WeakPolarHBondContact CD1-SD 3.22Å; Y50-M275 HydrophobicContact CD2-SD 3.81Å; Y50-M275 HydrophobicContact CE1-SD 4.16Å; Y50-M275 HydrophobicContact CE2-SD 4.45Å; Y50-M275 HydrophobicContact CG-CE 3.72Å; Y50-M275 HydrophobicContact CG-SD 3.22Å
51	I	91.9	Very high	89.7	Confident	6 Å²	6	18.8 Å²	18.8	3%	0.031	11%	0.11	C	C	.	.	H	α-helix	trans	-58.4	-25.7	177	-167.4	58.8	0	0	0	112	I49 F53 G55 I140 T157 T158 F212 L375	I49-I51 PolarHBondContact O-N 3.35Å; I51-F53 PolarHBondContact O-N 3.49Å; I51-G55 VanDerWaalsContact O-CA 3.29Å; I51-G55 WeakPolarHBondContact O-CA 3.22Å; I51-G55 PolarHBondContact O-N 3.14Å; I51-I140 HydrophobicContact CD1-CD1 4.31Å; I51-T157 HydrophobicContact CD1-CG2 4.35Å; I51-T158 WeakPolarHBondContact CG1-OG1 3.5Å; I51-T158 HydrophobicContact CG2-CG2 4.31Å; I51-F212 HydrophobicContact CB-CE1 4.33Å; I51-F212 HydrophobicContact CB-CZ 3.92Å; I51-F212 HydrophobicContact CD1-CE1 3.73Å; I51-F212 HydrophobicContact CD1-CZ 4.04Å; I51-F212 HydrophobicContact CG1-CE1 3.88Å; I51-F212 HydrophobicContact CG1-CZ 3.99Å; I51-L375 HydrophobicContact CG2-CD2 4.2Å
52	V	91.4	Very high	89.7	Confident	8 Å²	8	18.8 Å²	18.8	5%	0.048	11%	0.11	C	C	.	.	H	α-helix	trans	-58.7	-34.2	173.2	175.7	0	0	0	0	111.9	I49 Y50 I374 L375 S378	I49-V52 HydrophobicContact CG2-CB 4.4Å; I49-V52 HydrophobicContact CG2-CG2 3.81Å; I49-V52 VanDerWaalsContact O-CB 3.31Å; I49-V52 WeakPolarHBondContact O-CB 3.47Å; I49-V52 WeakPolarHBondContact O-CG2 3.43Å; I49-V52 PolarHBondContact O-N 3.44Å; Y50-V52 PolarHBondContact O-N 3.42Å; Y50-V52 VanDerWaalsContact O-N 3.14Å; V52-I374 HydrophobicContact CG2-CG2 4.39Å; V52-L375 HydrophobicContact CG2-CD2 4.01Å; V52-S378 WeakPolarHBondContact CG1-OG 3.43Å
53	F	93.2	Very high	89.6	Confident	6 Å²	6	22.7 Å²	22.7	3%	0.026	12%	0.121	C	C	.	.	H	α-helix	trans	-97.6	-42.5	179.3	-62.2	-80.9	0	0	0	112.1	Y50 I51 G55 A56 Y136 M258 P259 A262 L271 Y385 C388	Y50-F53 PolarHBondContact O-N 3.33Å; I51-F53 PolarHBondContact O-N 3.49Å; F53-G55 PolarHBondContact O-N 3.5Å; F53-A56 WeakPolarHBondContact O-CB 3.27Å; F53-A56 PolarHBondContact O-N 2.81Å; F53-Y136 HydrophobicContact CD1-CE1 4.08Å; F53-M258 HydrophobicContact CB-CE 4.38Å; F53-M258 HydrophobicContact CD2-CE 3.37Å; F53-M258 HydrophobicContact CD2-SD 3.25Å; F53-M258 WeakPolarHBondContact CD2-SD 3.3Å; F53-M258 HydrophobicContact CE2-CE 3.95Å; F53-M258 HydrophobicContact CE2-SD 3.24Å; F53-M258 WeakPolarHBondContact CE2-SD 3.46Å; F53-M258 HydrophobicContact CG-CE 4.14Å; F53-M258 HydrophobicContact CG-SD 4.46Å; F53-M258 HydrophobicContact CZ-SD 4.46Å; F53-P259 HydrophobicContact CE2-CB 4.23Å; F53-P259 HydrophobicContact CZ-CB 3.81Å; F53-A262 HydrophobicContact CB-CB 4.34Å; F53-A262 HydrophobicContact CD1-CB 3.96Å; F53-A262 HydrophobicContact CD2-CB 4.05Å; F53-A262 HydrophobicContact CE1-CB 4.26Å; F53-A262 HydrophobicContact CE2-CB 4.31Å; F53-A262 HydrophobicContact CG-CB 3.83Å; F53-A262 HydrophobicContact CZ-CB 4.41Å; F53-L271 HydrophobicContact CB-CD2 4.08Å; F53-Y385 AromaticContact CD1-CD1 3.86Å; F53-Y385 HydrophobicContact CD1-CD1 3.86Å; F53-Y385 AromaticContact CD1-CE1 3.6Å; F53-Y385 HydrophobicContact CD1-CE1 3.6Å; F53-Y385 AromaticContact CE1-CD1 3.31Å; F53-Y385 HydrophobicContact CE1-CD1 3.31Å; F53-Y385 AromaticContact CE1-CE1 3.58Å; F53-Y385 HydrophobicContact CE1-CE1 3.58Å; F53-Y385 HydrophobicContact CE1-CG 4.14Å; F53-Y385 HydrophobicContact CZ-CD1 4.05Å; F53-C388 HydrophobicContact CE2-CB 4.28Å; F53-C388 HydrophobicContact CZ-CB 3.69Å
54	V	93.8	Very high	89.5	Confident	0 Å²	0	23 Å²	23	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-67.3	-37.1	180	167.2	0	0	0	0	111.7	Y50 T139 I140 F208 W268 L271	Y50-V54 HydrophobicContact CD2-CB 3.91Å; Y50-V54 HydrophobicContact CD2-CG2 3.58Å; Y50-V54 HydrophobicContact CE2-CB 4.34Å; Y50-V54 HydrophobicContact CE2-CG1 4.48Å; Y50-V54 HydrophobicContact CE2-CG2 4.23Å; Y50-V54 PolarHBondContact O-N 2.99Å; V54-T139 VanDerWaalsContact O-CB 3.25Å; V54-T139 WeakPolarHBondContact O-CB 3.47Å; V54-I140 HydrophobicContact CG1-CB 4.44Å; V54-I140 HydrophobicContact CG1-CG1 4.17Å; V54-I140 HydrophobicContact CG1-CG2 3.59Å; V54-I140 VanDerWaalsContact O-CG1 3.26Å; V54-I140 WeakPolarHBondContact O-CG1 3.39Å; V54-I140 PolarHBondContact O-N 3.41Å; V54-F208 HydrophobicContact CG1-CZ 4.27Å; V54-W268 HydrophobicContact CB-CB 4.34Å; V54-W268 HydrophobicContact CG1-CB 4.01Å; V54-W268 HydrophobicContact CG1-CE3 4.47Å; V54-W268 HydrophobicContact CG2-CB 3.96Å; V54-L271 HydrophobicContact CG2-CD2 3.94Å
55	G	92.1	Very high	89.5	Confident	5 Å²	5	23.1 Å²	23.1	5%	0.052	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.5	14.4	176	0	0	0	0	0	113.9	I51 F53 N154	I51-G55 VanDerWaalsContact O-CA 3.29Å; I51-G55 WeakPolarHBondContact O-CA 3.22Å; I51-G55 PolarHBondContact O-N 3.14Å; F53-G55 PolarHBondContact O-N 3.5Å; G55-N154 PolarHBondContact O-ND2 2.95Å; G55-N154 PolarHBondContact O-OD1 3.23Å
56	A	91.6	Very high	89.4	Confident	10 Å²	10	31.6 Å²	31.6	8%	0.083	16%	0.163	C	C	.	.			trans	-66.6	139.3	177.2	0	0	0	0	0	111	F53 P58 Y136 T139	F53-A56 WeakPolarHBondContact O-CB 3.27Å; F53-A56 PolarHBondContact O-N 2.81Å; A56-P58 WeakPolarHBondContact O-CD 3.31Å; A56-Y136 HydrophobicContact CB-CD2 4.06Å; A56-Y136 HydrophobicContact CB-CE1 4.08Å; A56-Y136 HydrophobicContact CB-CE2 3.5Å; A56-Y136 VanDerWaalsContact CB-CE2 3.5Å; A56-T139 HydrophobicContact CB-CG2 4.48Å; A56-T139 WeakPolarHBondContact O-CB 3.4Å; A56-T139 PolarHBondContact O-OG1 2.88Å
57	T	91.2	Very high	89.3	Confident	69 Å²	69	37.1 Å²	37.1	42%	0.423	19%	0.193	S	C	.	.			trans	-98.3	102.8	174.6	-56.1	0	0	0	0	109.1	V141 V147	T57-V141 HydrophobicContact CG2-CG1 4.12Å; T57-V147 HydrophobicContact CG2-CG1 3.97Å
58	P	91.8	Very high	89.1	Confident	4 Å²	4	38.3 Å²	38.3	3%	0.026	20%	0.199	C	C	.	.			trans	-67.5	158.8	173.7	24	-28.5	0	0	0	111.4	A56 H60 Y131 Y136 T142	A56-P58 WeakPolarHBondContact O-CD 3.31Å; P58-H60 PolarHBondContact O-N 3.35Å; P58-H60 PolarHBondContact O-ND1 3.08Å; P58-Y131 HydrophobicContact CG-CD1 3.88Å; P58-Y131 HydrophobicContact CG-CG 4.33Å; P58-Y136 HydrophobicContact CB-CD2 4.36Å; P58-T142 HydrophobicContact CG-CG2 3.43Å; P58-T142 VanDerWaalsContact CG-CG2 3.43Å
59	P	90.3	Very high	89.2	Confident	92 Å²	92	41.2 Å²	41.2	60%	0.597	22%	0.218	S	C	*	.			trans	-52.6	135.3	169.2	-23.8	33.4	0	0	0	110.5	S132	P59-S132 PolarHBondContact O-N 3.18Å
60	H	91.8	Very high	89.4	Confident	28 Å²	28	41.8 Å²	41.8	13%	0.13	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	154.2	-175	57.2	-80.6	0	0	0	112.3	P58 S92 W129 M130 Y131	P58-H60 PolarHBondContact O-N 3.35Å; P58-H60 PolarHBondContact O-ND1 3.08Å; H60-S92 PolarHBondContact CD2-O 3.11Å; H60-S92 WeakPolarHBondContact O-CA 3.45Å; H60-S92 WeakPolarHBondContact O-CB 3.35Å; H60-S92 PolarHBondContact O-OG 2.98Å; H60-W129 AromaticContact CD2-CD1 3.66Å; H60-M130 VanDerWaalsContact CA-O 3.25Å; H60-M130 WeakPolarHBondContact CA-O 3.42Å; H60-Y131 HydrophobicContact CB-CD1 3.44Å; H60-Y131 VanDerWaalsContact CB-CD1 3.44Å; H60-Y131 HydrophobicContact CB-CE1 3.6Å; H60-Y131 HydrophobicContact CB-CG 4.29Å; H60-Y131 AromaticContact CG-CE1 3.86Å
61	E	91.9	Very high	89.2	Confident	47 Å²	47	43.6 Å²	43.6	22%	0.22	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	160	175.7	59.1	-179.7	-168.3	0	0	109.9	R63 R90 W129 M130	E61-R63 PolarHBondContact O-N 2.8Å; E61-R90 IonicContact OE1-NH1 3.12Å; E61-R90 PolarHBondContact OE1-NH1 2.96Å; E61-R90 WeakPolarHBondContact OE2-CD 3.22Å; E61-R90 IonicContact OE2-CZ 2.84Å; E61-R90 IonicContact OE2-NE 3.8Å; E61-R90 IonicContact OE2-NH1 3.44Å; E61-R90 PolarHBondContact OE2-NH1 2.97Å; E61-W129 CarbonylContact O-C 3.56Å; E61-W129 WeakPolarHBondContact O-CA 3.46Å; E61-M130 HydrophobicContact CG-CB 4.28Å; E61-M130 HydrophobicContact CG-CE 4.11Å; E61-M130 PolarHBondContact N-O 3.06Å; E61-M130 VanDerWaalsContact N-O 3.08Å; E61-M130 PolarHBondContact O-N 3.08Å; E61-M130 WeakPolarHBondContact OE1-CE 3.39Å
62	C	92.1	Very high	89	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	136.9	175.3	-66	0	0	0	0	110.8	V79 W94 R95 C125	C62-V79 HydrophobicContact CB-CG2 4.34Å; C62-W94 VanDerWaalsContact SG-C 3.55Å; C62-R95 HydrophobicContact CB-CB 3.95Å; C62-R95 HydrophobicContact CB-CG 4.21Å; C62-C125 WeakPolarHBondContact CA-SG 3.26Å; C62-C125 HydrophobicContact CB-CB 3.75Å; C62-C125 WeakPolarHBondContact CB-SG 3.48Å; C62-C125 WeakPolarHBondContact SG-CB 3.41Å; C62-C125 CovalentContact SG-SG 2.02Å; C62-C125 PolarHBondContact SG-SG 3.41Å
63	R	90.9	Very high	88.7	Confident	134 Å²	134	56.2 Å²	56.2	51%	0.506	29%	0.293	S	S	.	.			trans	-72.4	134.2	173.4	-173.3	177	-178.2	-177.6	0.1	109.9	E61 R95 G128 M130	E61-R63 PolarHBondContact O-N 2.8Å; R63-R95 PolarHBondContact O-NH1 3.15Å; R63-G128 WeakPolarHBondContact CB-O 3.45Å; R63-G128 PolarHBondContact N-O 3.33Å; R63-M130 HydrophobicContact CB-CG 3.95Å; R63-M130 HydrophobicContact CG-CG 3.91Å; R63-M130 HydrophobicContact CG-SD 4.39Å
64	I	89.6	Confident	88.5	Confident	9 Å²	9	55.9 Å²	55.9	5%	0.046	29%	0.292	C	S	.	.			trans	-105.3	111.3	170.8	-55.8	170.6	0	0	0	107.8	I70 R75 V79	I64-I70 HydrophobicContact CG2-CD1 3.76Å; I64-R75 HydrophobicContact CD1-CG 3.83Å; I64-R75 WeakPolarHBondContact CD1-O 3.32Å; I64-R75 HydrophobicContact CG2-CG 4.32Å; I64-R75 PolarHBondContact O-NH2 2.9Å; I64-V79 HydrophobicContact CD1-CG2 4.36Å
65	P	88.4	Confident	88.2	Confident	16 Å²	16	60.2 Å²	60.2	10%	0.104	31%	0.308	C	S	.	.			trans	-54.6	138.8	178.8	-26.7	34.5	0	0	0	113.1	N67 I68 D127	P65-N67 VanDerWaalsContact C-N 3.27Å; P65-N67 WeakPolarHBondContact CB-OD1 3.44Å; P65-N67 PolarHBondContact O-N 2.81Å; P65-I68 HydrophobicContact CB-CD1 4.04Å; P65-I68 HydrophobicContact CB-CG1 4.24Å; P65-I68 HydrophobicContact CG-CD1 3.92Å; P65-I68 PolarHBondContact O-N 3.41Å; P65-D127 HydrophobicContact CG-CB 3.66Å; P65-D127 WeakPolarHBondContact CG-OD2 3.08Å
66	E	83.9	Confident	88	Confident	181 Å²	181	64.8 Å²	64.8	85%	0.846	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-18.8	177.3	-67.4	179.4	-178.2	0	0	113	I68	E66-I68 PolarHBondContact O-N 2.91Å
67	N	81.7	Confident	87.8	Confident	134 Å²	134	65.9 Å²	65.9	72%	0.717	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-12.1	177.7	65.6	-6.7	0	0	0	113.2	P65	P65-N67 VanDerWaalsContact C-N 3.27Å; P65-N67 WeakPolarHBondContact CB-OD1 3.44Å; P65-N67 PolarHBondContact O-N 2.81Å
68	I	80.2	Confident	87.7	Confident	33 Å²	33	62.6 Å²	62.6	17%	0.169	32%	0.317	C	S	.	.	S	Bend	trans	-87.1	113.6	176.9	-66.1	170.7	0	0	0	108	P65 E66 I70 L98 R102	P65-I68 HydrophobicContact CB-CD1 4.04Å; P65-I68 HydrophobicContact CB-CG1 4.24Å; P65-I68 HydrophobicContact CG-CD1 3.92Å; P65-I68 PolarHBondContact O-N 3.41Å; E66-I68 PolarHBondContact O-N 2.91Å; I68-I70 VanDerWaalsContact C-N 3.29Å; I68-I70 HydrophobicContact CG2-CB 4.49Å; I68-I70 HydrophobicContact CG2-CG1 4.24Å; I68-I70 HydrophobicContact CG2-CG2 3.73Å; I68-I70 PolarHBondContact O-N 3.09Å; I68-L98 HydrophobicContact CD1-CB 4.28Å; I68-L98 HydrophobicContact CD1-CD1 3.63Å; I68-R102 HydrophobicContact CG2-CG 4.49Å
69	S	81.8	Confident	87.6	Confident	70 Å²	70	62.6 Å²	62.6	49%	0.49	32%	0.317	S	S	.	.			trans	-74.1	75.8	178.5	63.3	0	0	0	0	111.4
70	I	87.1	Confident	87.6	Confident	24 Å²	24	59.6 Å²	59.6	12%	0.123	30%	0.298	C	S	.	.			trans	-109.8	148.6	172.6	50.2	168	0	0	0	110.7	I64 I68 W74 R75 V101 R102	I64-I70 HydrophobicContact CG2-CD1 3.76Å; I68-I70 VanDerWaalsContact C-N 3.29Å; I68-I70 HydrophobicContact CG2-CB 4.49Å; I68-I70 HydrophobicContact CG2-CG1 4.24Å; I68-I70 HydrophobicContact CG2-CG2 3.73Å; I68-I70 PolarHBondContact O-N 3.09Å; I70-W74 HydrophobicContact CB-CB 4.44Å; I70-R75 HydrophobicContact CD1-CB 3.9Å; I70-R75 HydrophobicContact CD1-CG 4.04Å; I70-R75 HydrophobicContact CG1-CB 4.47Å; I70-V101 HydrophobicContact CG2-CG1 4.06Å; I70-R102 HydrophobicContact CG2-CB 4.29Å
71	S	87.3	Confident	87.3	Confident	40 Å²	40	64 Å²	64	28%	0.28	32%	0.321	S	S	.	.			trans	-66	155.8	174.9	76.5	0	0	0	0	111.3	M73 W74 R75 S105	S71-M73 PolarHBondContact O-N 3.37Å; S71-W74 PolarHBondContact O-N 3.1Å; S71-W74 VanDerWaalsContact O-N 3.15Å; S71-W74 PolarHBondContact OG-N 2.93Å; S71-R75 PolarHBondContact O-N 3.01Å; S71-S105 PolarHBondContact N-OG 3.39Å
72	E	86.4	Confident	86.9	Confident	176 Å²	176	65.4 Å²	65.4	82%	0.822	33%	0.328	S	S	*	.	H	α-helix	trans	-59.3	-34.3	178.9	-169.2	174.6	-174.2	0	0	112.2	R75 N76	E72-R75 PolarHBondContact O-N 3.19Å; E72-N76 PolarHBondContact O-N 3.33Å
73	M	86.8	Confident	86.3	Confident	102 Å²	102	70.2 Å²	70.2	50%	0.502	36%	0.358	S	S	.	.	H	α-helix	trans	-61.6	-48.9	175.1	-64	-171.5	-68.7	0	0	111.7	S71 R75 N76 V77 I110 P111	S71-M73 PolarHBondContact O-N 3.37Å; M73-R75 VanDerWaalsContact C-N 3.31Å; M73-R75 PolarHBondContact O-N 3.18Å; M73-N76 PolarHBondContact O-N 3.04Å; M73-V77 WeakPolarHBondContact O-CG2 3.46Å; M73-V77 PolarHBondContact O-N 3.03Å; M73-I110 HydrophobicContact SD-CG2 4.41Å; M73-P111 HydrophobicContact CB-CG 3.96Å
74	W	88.5	Confident	85.3	Confident	0 Å²	0	67.6 Å²	67.6	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-65.5	-36.7	176.6	-82.7	110.4	0	0	0	111.6	I70 S71 N76 V77 S78 V101 Y104 V109 P111 V117 I120	I70-W74 HydrophobicContact CB-CB 4.44Å; S71-W74 PolarHBondContact O-N 3.1Å; S71-W74 VanDerWaalsContact O-N 3.15Å; S71-W74 PolarHBondContact OG-N 2.93Å; W74-N76 VanDerWaalsContact C-N 3.34Å; W74-N76 PolarHBondContact O-N 3.13Å; W74-V77 PolarHBondContact O-N 3.42Å; W74-S78 WeakPolarHBondContact O-CB 3.34Å; W74-S78 PolarHBondContact O-N 3.44Å; W74-S78 PolarHBondContact O-OG 3.47Å; W74-V101 HydrophobicContact CB-CG1 3.8Å; W74-V101 HydrophobicContact CD2-CG1 3.97Å; W74-V101 HydrophobicContact CE3-CB 4.38Å; W74-V101 HydrophobicContact CE3-CG1 3.68Å; W74-V101 HydrophobicContact CE3-CG2 4.18Å; W74-V101 HydrophobicContact CG-CG1 4.05Å; W74-V101 HydrophobicContact CZ3-CG2 4.34Å; W74-Y104 HydrophobicContact CH2-CD2 4.09Å; W74-Y104 HydrophobicContact CH2-CG 4.41Å; W74-Y104 HydrophobicContact CZ2-CD2 4.36Å; W74-Y104 HydrophobicContact CZ2-CG 4.22Å; W74-V109 HydrophobicContact CZ2-CG1 4.37Å; W74-V109 PolarHBondContact NE1-O 3.2Å; W74-P111 HydrophobicContact CD2-CB 4.13Å; W74-P111 HydrophobicContact CD2-CG 4.32Å; W74-P111 HydrophobicContact CE3-CB 4.05Å; W74-P111 HydrophobicContact CH2-CB 3.97Å; W74-P111 HydrophobicContact CZ2-CB 4.02Å; W74-P111 HydrophobicContact CZ3-CB 3.99Å; W74-V117 HydrophobicContact CH2-CG2 4.47Å; W74-V117 HydrophobicContact CZ3-CG2 4.23Å; W74-I120 HydrophobicContact CH2-CD1 3.73Å; W74-I120 HydrophobicContact CZ3-CD1 3.53Å
75	R	87.5	Confident	84.2	Confident	90 Å²	90	71.5 Å²	71.5	34%	0.34	38%	0.377	S	S	.	.	H	α-helix	trans	-63.2	-37.7	178.2	-161.9	168.2	-157.6	-94.1	1.4	112.9	I64 I70 S71 E72 M73 V77	I64-R75 HydrophobicContact CD1-CG 3.83Å; I64-R75 WeakPolarHBondContact CD1-O 3.32Å; I64-R75 HydrophobicContact CG2-CG 4.32Å; I64-R75 PolarHBondContact O-NH2 2.9Å; I70-R75 HydrophobicContact CD1-CB 3.9Å; I70-R75 HydrophobicContact CD1-CG 4.04Å; I70-R75 HydrophobicContact CG1-CB 4.47Å; S71-R75 PolarHBondContact O-N 3.01Å; E72-R75 PolarHBondContact O-N 3.19Å; M73-R75 VanDerWaalsContact C-N 3.31Å; M73-R75 PolarHBondContact O-N 3.18Å; R75-V77 VanDerWaalsContact C-N 3.27Å; R75-V77 PolarHBondContact O-N 2.78Å
76	N	87.5	Confident	83.2	Confident	101 Å²	101	74.1 Å²	74.1	54%	0.54	41%	0.407	S	S	.	.	H	α-helix	trans	-68.7	-27.8	178	-169.8	31.1	0	0	0	113	E72 M73 W74 R90	E72-N76 PolarHBondContact O-N 3.33Å; M73-N76 PolarHBondContact O-N 3.04Å; W74-N76 VanDerWaalsContact C-N 3.34Å; W74-N76 PolarHBondContact O-N 3.13Å; N76-R90 PolarHBondContact OD1-NH2 3.46Å
77	V	87.9	Confident	82.8	Confident	33 Å²	33	68.4 Å²	68.4	20%	0.2	38%	0.384	C	S	.	.	H	α-helix	trans	-103.1	-11.5	-174	-176.9	0	0	0	0	112.6	M73 W74 R75 V79 L96 V117	M73-V77 WeakPolarHBondContact O-CG2 3.46Å; M73-V77 PolarHBondContact O-N 3.03Å; W74-V77 PolarHBondContact O-N 3.42Å; R75-V77 VanDerWaalsContact C-N 3.27Å; R75-V77 PolarHBondContact O-N 2.78Å; V77-V79 PolarHBondContact O-N 3.48Å; V77-V79 VanDerWaalsContact O-N 3.16Å; V77-L96 WeakPolarHBondContact O-CD1 3.25Å; V77-V117 HydrophobicContact CG1-CB 4.08Å; V77-V117 HydrophobicContact CG1-CG1 3.38Å; V77-V117 HydrophobicContact CG1-CG2 3.76Å
78	S	88.4	Confident	82.7	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	38%	0.376	C	S	.	.	S	Bend	trans	-58	-29.3	-179.9	-67.4	0	0	0	0	113.5	W74 L96	W74-S78 WeakPolarHBondContact O-CB 3.34Å; W74-S78 PolarHBondContact O-N 3.44Å; W74-S78 PolarHBondContact O-OG 3.47Å; S78-L96 PolarHBondContact O-N 3.4Å
79	V	90.6	Very high	82.9	Confident	4 Å²	4	70.9 Å²	70.9	2%	0.024	40%	0.395	C	S	.	.	S	Bend	trans	-103.1	114	171	-174.2	0	0	0	0	107.7	C62 I64 V77 R90 S91	C62-V79 HydrophobicContact CB-CG2 4.34Å; I64-V79 HydrophobicContact CD1-CG2 4.36Å; V77-V79 PolarHBondContact O-N 3.48Å; V77-V79 VanDerWaalsContact O-N 3.16Å; V79-R90 HydrophobicContact CG1-CB 3.81Å; V79-R90 HydrophobicContact CG1-CG 4.36Å; V79-S91 WeakPolarHBondContact CG1-O 3.24Å
80	P	88.6	Confident	83.1	Confident	30 Å²	30	71.8 Å²	71.8	20%	0.195	39%	0.388	C	S	.	.			trans	-65.5	152.1	-176	27.1	-34	0	0	0	111.3	R90 S91 L122	P80-R90 CarbonylContact O-C 3.57Å; P80-R90 WeakPolarHBondContact O-CA 3.49Å; P80-S91 PolarHBondContact O-N 3.4Å; P80-L122 HydrophobicContact CG-CD2 3.91Å
81	L	86.7	Confident	83.1	Confident	120 Å²	120	70.7 Å²	70.7	63%	0.628	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.4	124.9	172.9	-67	172	0	0	0	109.4	T88 K89 R90	L81-T88 HydrophobicContact CB-CG2 3.84Å; L81-T88 HydrophobicContact CD1-CG2 4.22Å; L81-T88 HydrophobicContact CD2-CG2 4.26Å; L81-T88 HydrophobicContact CG-CG2 4.33Å; L81-K89 CarbonylContact C-O 3.59Å; L81-K89 WeakPolarHBondContact CA-O 3.33Å; L81-R90 HydrophobicContact CD2-CG 3.64Å
82	E	83.4	Confident	83.1	Confident	77 Å²	77	70.9 Å²	70.9	36%	0.36	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	137.7	174.2	-70.4	176.5	-163.3	0	0	109.5	V84 K89 S91	E82-V84 HydrophobicContact CB-CG2 4.29Å; E82-V84 PolarHBondContact O-N 3.33Å; E82-K89 PolarHBondContact N-O 3.4Å; E82-K89 PolarHBondContact O-N 2.96Å; E82-S91 WeakPolarHBondContact OE1-CB 3.46Å; E82-S91 PolarHBondContact OE1-OG 3.47Å
83	T	79.5	Confident	83.3	Confident	101 Å²	101	63.6 Å²	63.6	62%	0.62	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.7	101.7	173.2	-54.4	0	0	0	0	108.4
84	V	70.4	Confident	83.5	Confident	78 Å²	78	64.4 Å²	64.4	47%	0.473	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	123.1	177	-175.8	0	0	0	0	108.1	E82 G86 V87	E82-V84 HydrophobicContact CB-CG2 4.29Å; E82-V84 PolarHBondContact O-N 3.33Å; V84-G86 VanDerWaalsContact C-N 3.26Å; V84-G86 PolarHBondContact O-N 3.17Å; V84-V87 PolarHBondContact N-O 2.9Å; V84-V87 PolarHBondContact O-N 2.9Å; V84-V87 VanDerWaalsContact O-O 3.13Å
85	D	64.8	Low	83.7	Confident	91 Å²	91	64.7 Å²	64.7	49%	0.487	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	54	37.1	-178.4	-60.7	-29.7	0	0	0	114.4	V87 I434 R500	D85-V87 PolarHBondContact O-N 2.98Å; D85-I434 HydrophobicContact CB-CD1 4.15Å; D85-I434 WeakPolarHBondContact O-CD1 3.39Å; D85-R500 WeakPolarHBondContact OD2-CD 3.21Å; D85-R500 IonicContact OD2-NH1 3.75Å
86	G	68.9	Low	83.9	Confident	71 Å²	71	60.6 Å²	60.6	73%	0.732	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.9	2.6	-179.5	0	0	0	0	0	114.7	V84	V84-G86 VanDerWaalsContact C-N 3.26Å; V84-G86 PolarHBondContact O-N 3.17Å
87	V	75.1	Confident	84.2	Confident	61 Å²	61	57.5 Å²	57.5	37%	0.37	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	123.4	174.6	-173.6	0	0	0	0	109.4	V84 D85 K89 I434	V84-V87 PolarHBondContact N-O 2.9Å; V84-V87 PolarHBondContact O-N 2.9Å; V84-V87 VanDerWaalsContact O-O 3.13Å; D85-V87 PolarHBondContact O-N 2.98Å; V87-K89 HydrophobicContact CG1-CD 4.46Å; V87-K89 HydrophobicContact CG1-CG 4Å; V87-K89 PolarHBondContact O-N 2.79Å; V87-I434 HydrophobicContact CG2-CD1 4.47Å
88	T	80.1	Confident	84.3	Confident	88 Å²	88	56.3 Å²	56.3	54%	0.54	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	117.5	174.1	-48.8	0	0	0	0	109.5	L81	L81-T88 HydrophobicContact CB-CG2 3.84Å; L81-T88 HydrophobicContact CD1-CG2 4.22Å; L81-T88 HydrophobicContact CD2-CG2 4.26Å; L81-T88 HydrophobicContact CG-CG2 4.33Å
89	K	83.8	Confident	84.3	Confident	132 Å²	132	63 Å²	63	57%	0.574	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.2	156.8	177.5	-65.6	-175.5	-178	175.9	0	109.7	L81 E82 V87	L81-K89 CarbonylContact C-O 3.59Å; L81-K89 WeakPolarHBondContact CA-O 3.33Å; E82-K89 PolarHBondContact N-O 3.4Å; E82-K89 PolarHBondContact O-N 2.96Å; V87-K89 HydrophobicContact CG1-CD 4.46Å; V87-K89 HydrophobicContact CG1-CG 4Å; V87-K89 PolarHBondContact O-N 2.79Å
90	R	85.9	Confident	84.3	Confident	88 Å²	88	64.5 Å²	64.5	33%	0.332	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	143.6	171.5	-76	-179.6	175	176.6	1	110.4	E61 N76 V79 P80 L81 S92	E61-R90 IonicContact OE1-NH1 3.12Å; E61-R90 PolarHBondContact OE1-NH1 2.96Å; E61-R90 WeakPolarHBondContact OE2-CD 3.22Å; E61-R90 IonicContact OE2-CZ 2.84Å; E61-R90 IonicContact OE2-NE 3.8Å; E61-R90 IonicContact OE2-NH1 3.44Å; E61-R90 PolarHBondContact OE2-NH1 2.97Å; N76-R90 PolarHBondContact OD1-NH2 3.46Å; V79-R90 HydrophobicContact CG1-CB 3.81Å; V79-R90 HydrophobicContact CG1-CG 4.36Å; P80-R90 CarbonylContact O-C 3.57Å; P80-R90 WeakPolarHBondContact O-CA 3.49Å; L81-R90 HydrophobicContact CD2-CG 3.64Å; R90-S92 PolarHBondContact O-N 3.26Å
91	S	86.8	Confident	84.3	Confident	2 Å²	2	63.1 Å²	63.1	1%	0.014	34%	0.343	C	S	.	.			trans	-60.1	132.4	176.5	-170.8	0	0	0	0	110.5	V79 P80 E82 W94	V79-S91 WeakPolarHBondContact CG1-O 3.24Å; P80-S91 PolarHBondContact O-N 3.4Å; E82-S91 WeakPolarHBondContact OE1-CB 3.46Å; E82-S91 PolarHBondContact OE1-OG 3.47Å; S91-W94 PolarHBondContact OG-N 3.35Å
92	S	88.1	Confident	84.5	Confident	43 Å²	43	62.3 Å²	62.3	30%	0.301	33%	0.331	S	S	.	.	S	Bend	trans	-85.2	-21.2	-177.6	-68.9	0	0	0	0	113.4	H60 R90 W129	H60-S92 PolarHBondContact CD2-O 3.11Å; H60-S92 WeakPolarHBondContact O-CA 3.45Å; H60-S92 WeakPolarHBondContact O-CB 3.35Å; H60-S92 PolarHBondContact O-OG 2.98Å; R90-S92 PolarHBondContact O-N 3.26Å; S92-W129 PolarHBondContact O-NE1 2.94Å
93	C	90.7	Very high	84.8	Confident	23 Å²	23	62.2 Å²	62.2	16%	0.155	33%	0.333	C	S	.	.	S	Bend	trans	-124	-15.5	-169.4	-65.8	0	0	0	0	114.9	C125 C148	C93-C125 PolarHBondContact O-SG 2.88Å; C93-C148 WeakPolarHBondContact CA-SG 3.27Å; C93-C148 HydrophobicContact CB-CB 3.78Å; C93-C148 WeakPolarHBondContact CB-SG 3.4Å; C93-C148 VanDerWaalsContact SG-CA 3.5Å; C93-C148 WeakPolarHBondContact SG-CB 3.34Å; C93-C148 CovalentContact SG-SG 2.03Å; C93-C148 PolarHBondContact SG-SG 3.08Å
94	W	90.8	Very high	85.3	Confident	120 Å²	120	61 Å²	61	46%	0.455	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	144.5	-176.2	-58.3	98.3	0	0	0	110.4	C62 S91 L122 T124	C62-W94 VanDerWaalsContact SG-C 3.55Å; S91-W94 PolarHBondContact OG-N 3.35Å; W94-L122 HydrophobicContact CB-CD2 4.48Å; W94-L122 HydrophobicContact CE3-CB 4.38Å; W94-T124 HydrophobicContact CE3-CG2 4.12Å; W94-T124 HydrophobicContact CH2-CG2 3.93Å; W94-T124 HydrophobicContact CZ3-CG2 3.62Å
95	R	92.7	Very high	86.2	Confident	5 Å²	5	57.9 Å²	57.9	2%	0.019	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	163.6	169.5	63.5	177.2	-168.5	-167.3	4.9	109.5	C62 R63 L122 E123 D127	C62-R95 HydrophobicContact CB-CB 3.95Å; C62-R95 HydrophobicContact CB-CG 4.21Å; R63-R95 PolarHBondContact O-NH1 3.15Å; R95-L122 CarbonylContact O-C 3.59Å; R95-L122 WeakPolarHBondContact O-CA 3.17Å; R95-E123 HydrophobicContact CG-CG 3.82Å; R95-E123 IonicContact CZ-OE1 3.42Å; R95-E123 VanDerWaalsContact CZ-OE1 3.25Å; R95-E123 PolarHBondContact N-O 3.25Å; R95-E123 IonicContact NE-OE1 2.84Å; R95-E123 PolarHBondContact NE-OE1 3.15Å; R95-E123 IonicContact NH2-OE1 3.73Å; R95-E123 PolarHBondContact NH2-OE1 3.03Å; R95-E123 PolarHBondContact O-N 3.47Å; R95-E123 VanDerWaalsContact O-O 3.13Å; R95-D127 IonicContact CZ-OD2 2.84Å; R95-D127 IonicContact NH1-OD2 3.25Å; R95-D127 PolarHBondContact NH1-OD2 2.85Å; R95-D127 IonicContact NH2-OD2 2.8Å; R95-D127 PolarHBondContact NH2-OD2 3.38Å
96	L	92.1	Very high	87.3	Confident	4 Å²	4	58.5 Å²	58.5	2%	0.021	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	148.4	170	-58.8	178.6	0	0	0	110.3	V77 S78 L98 V101 V117 I120 L122	V77-L96 WeakPolarHBondContact O-CD1 3.25Å; S78-L96 PolarHBondContact O-N 3.4Å; L96-L98 PolarHBondContact O-N 3.3Å; L96-V101 HydrophobicContact CB-CG2 3.73Å; L96-V101 HydrophobicContact CD1-CG2 4.13Å; L96-V117 HydrophobicContact CD1-CG1 3.4Å; L96-V117 HydrophobicContact CD2-CG1 4.3Å; L96-V117 HydrophobicContact CG-CG1 4.43Å; L96-I120 HydrophobicContact CB-CG2 4.04Å; L96-I120 HydrophobicContact CD1-CD1 4.34Å; L96-I120 HydrophobicContact CD2-CB 4.05Å; L96-I120 HydrophobicContact CD2-CG2 4.16Å; L96-I120 HydrophobicContact CG-CG2 4.49Å; L96-L122 HydrophobicContact CD2-CD2 3.85Å
97	N	92.3	Very high	88.3	Confident	36 Å²	36	61.6 Å²	61.6	19%	0.193	30%	0.297	C	S	.	.			trans	-58.3	113.1	174.8	177.5	-94.1	0	0	0	110.9	E99 T100 V101 P121 E123	N97-E99 VanDerWaalsContact C-N 3.27Å; N97-E99 PolarHBondContact O-N 3.15Å; N97-E99 PolarHBondContact OD1-N 2.97Å; N97-T100 PolarHBondContact O-N 3.28Å; N97-T100 WeakPolarHBondContact OD1-CB 3.4Å; N97-T100 PolarHBondContact OD1-N 3.36Å; N97-T100 PolarHBondContact OD1-OG1 2.96Å; N97-V101 WeakPolarHBondContact O-CG2 3.46Å; N97-V101 PolarHBondContact O-N 3.01Å; N97-P121 HydrophobicContact CB-CG 4.05Å; N97-P121 WeakPolarHBondContact CB-O 3.39Å; N97-P121 PolarHBondContact N-O 3.49Å; N97-E123 WeakPolarHBondContact CA-OE2 3.13Å; N97-E123 PolarHBondContact ND2-OE2 2.98Å
98	L	90.7	Very high	88.8	Confident	9 Å²	9	65.6 Å²	65.6	5%	0.047	32%	0.316	C	S	.	.	H	α-helix	trans	-68.1	-26.6	-170.4	-69.6	-171.7	0	0	0	113.1	I68 L96 R102	I68-L98 HydrophobicContact CD1-CB 4.28Å; I68-L98 HydrophobicContact CD1-CD1 3.63Å; L96-L98 PolarHBondContact O-N 3.3Å; L98-R102 WeakPolarHBondContact O-CB 3.06Å; L98-R102 PolarHBondContact O-N 3.23Å
99	E	89.4	Confident	89.1	Confident	139 Å²	139	62.7 Å²	62.7	65%	0.65	30%	0.298	S	S	*	.	H	α-helix	trans	-66.8	-44.9	175.6	-172.5	172	-167	0	0	111.2	N97 R102 N103	N97-E99 VanDerWaalsContact C-N 3.27Å; N97-E99 PolarHBondContact O-N 3.15Å; N97-E99 PolarHBondContact OD1-N 2.97Å; E99-R102 PolarHBondContact O-N 3.14Å; E99-N103 PolarHBondContact O-N 2.72Å; E99-N103 PolarHBondContact O-ND2 3.29Å
100	T	89.2	Confident	89.3	Confident	37 Å²	37	59.7 Å²	59.7	23%	0.227	29%	0.288	C	S	.	.	H	α-helix	trans	-63.6	-46.6	175.5	-56.6	0	0	0	0	111.3	N97 R102 N103 Y104 I120	N97-T100 PolarHBondContact O-N 3.28Å; N97-T100 WeakPolarHBondContact OD1-CB 3.4Å; N97-T100 PolarHBondContact OD1-N 3.36Å; N97-T100 PolarHBondContact OD1-OG1 2.96Å; T100-R102 VanDerWaalsContact C-N 3.31Å; T100-R102 PolarHBondContact O-N 3.21Å; T100-N103 PolarHBondContact O-N 3.42Å; T100-Y104 HydrophobicContact CG2-CD2 3.93Å; T100-Y104 HydrophobicContact CG2-CE2 3.45Å; T100-Y104 VanDerWaalsContact CG2-CE2 3.45Å; T100-Y104 VanDerWaalsContact O-CD2 3.32Å; T100-Y104 WeakPolarHBondContact O-CD2 3.08Å; T100-Y104 PolarHBondContact O-N 2.84Å; T100-Y104 VanDerWaalsContact O-N 3.1Å; T100-I120 HydrophobicContact CG2-CG2 4.04Å
101	V	90.1	Very high	89.4	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-60.4	-40.4	176.4	171.3	0	0	0	0	111.6	I70 W74 L96 N97 Y104 S105 I120	I70-V101 HydrophobicContact CG2-CG1 4.06Å; W74-V101 HydrophobicContact CB-CG1 3.8Å; W74-V101 HydrophobicContact CD2-CG1 3.97Å; W74-V101 HydrophobicContact CE3-CB 4.38Å; W74-V101 HydrophobicContact CE3-CG1 3.68Å; W74-V101 HydrophobicContact CE3-CG2 4.18Å; W74-V101 HydrophobicContact CG-CG1 4.05Å; W74-V101 HydrophobicContact CZ3-CG2 4.34Å; L96-V101 HydrophobicContact CB-CG2 3.73Å; L96-V101 HydrophobicContact CD1-CG2 4.13Å; N97-V101 WeakPolarHBondContact O-CG2 3.46Å; N97-V101 PolarHBondContact O-N 3.01Å; V101-Y104 PolarHBondContact O-N 3.25Å; V101-S105 WeakPolarHBondContact O-CB 3.4Å; V101-S105 PolarHBondContact O-N 3.14Å; V101-I120 HydrophobicContact CG2-CG2 4.47Å
102	R	89.4	Confident	89.3	Confident	103 Å²	103	60.9 Å²	60.9	39%	0.389	30%	0.301	S	S	.	.	H	α-helix	trans	-62.6	-45.2	176.9	-174.7	-176.5	-171.6	178.4	4.1	111.7	I68 I70 L98 E99 T100 S105 Q106	I68-R102 HydrophobicContact CG2-CG 4.49Å; I70-R102 HydrophobicContact CG2-CB 4.29Å; L98-R102 WeakPolarHBondContact O-CB 3.06Å; L98-R102 PolarHBondContact O-N 3.23Å; E99-R102 PolarHBondContact O-N 3.14Å; T100-R102 VanDerWaalsContact C-N 3.31Å; T100-R102 PolarHBondContact O-N 3.21Å; R102-S105 PolarHBondContact O-N 3.3Å; R102-Q106 WeakPolarHBondContact O-CG 3.3Å; R102-Q106 PolarHBondContact O-N 2.95Å
103	N	90.6	Very high	89.2	Confident	75 Å²	75	64 Å²	64	40%	0.401	32%	0.318	S	S	.	.	H	α-helix	trans	-60.6	-46.7	178.4	-71.7	-20.2	0	0	0	111.3	E99 T100 S105 Q106 M107	E99-N103 PolarHBondContact O-N 2.72Å; E99-N103 PolarHBondContact O-ND2 3.29Å; T100-N103 PolarHBondContact O-N 3.42Å; N103-S105 PolarHBondContact O-N 2.58Å; N103-Q106 PolarHBondContact O-N 2.94Å; N103-M107 WeakPolarHBondContact O-CG 3.28Å; N103-M107 PolarHBondContact O-N 3.47Å; N103-M107 VanDerWaalsContact O-N 3.09Å
104	Y	89.5	Confident	88.8	Confident	76 Å²	76	67.5 Å²	67.5	30%	0.298	34%	0.335	S	S	.	.	H	α-helix	trans	-63.3	-41.2	175.6	-69.7	-47.1	0	0	0	113	W74 T100 V101 Q106 M107 N108 V109 V115 I120	W74-Y104 HydrophobicContact CH2-CD2 4.09Å; W74-Y104 HydrophobicContact CH2-CG 4.41Å; W74-Y104 HydrophobicContact CZ2-CD2 4.36Å; W74-Y104 HydrophobicContact CZ2-CG 4.22Å; T100-Y104 HydrophobicContact CG2-CD2 3.93Å; T100-Y104 HydrophobicContact CG2-CE2 3.45Å; T100-Y104 VanDerWaalsContact CG2-CE2 3.45Å; T100-Y104 VanDerWaalsContact O-CD2 3.32Å; T100-Y104 WeakPolarHBondContact O-CD2 3.08Å; T100-Y104 PolarHBondContact O-N 2.84Å; T100-Y104 VanDerWaalsContact O-N 3.1Å; V101-Y104 PolarHBondContact O-N 3.25Å; Y104-Q106 VanDerWaalsContact C-N 3.3Å; Y104-Q106 PolarHBondContact O-N 2.78Å; Y104-M107 PolarHBondContact O-N 2.9Å; Y104-N108 PolarHBondContact O-N 3.27Å; Y104-V109 HydrophobicContact CD1-CG1 4.47Å; Y104-V109 HydrophobicContact CD1-CG2 4.46Å; Y104-V109 WeakPolarHBondContact O-CB 3.13Å; Y104-V109 PolarHBondContact O-N 3.26Å; Y104-V109 VanDerWaalsContact O-N 3.15Å; Y104-V115 HydrophobicContact CD1-CG2 4.22Å; Y104-V115 HydrophobicContact CE1-CG2 4.02Å; Y104-V115 HydrophobicContact CE2-CG1 4.12Å; Y104-I120 HydrophobicContact CD2-CD1 4.18Å; Y104-I120 HydrophobicContact CE2-CD1 4.16Å; Y104-I120 HydrophobicContact CE2-CG1 4.24Å
105	S	88.5	Confident	88.5	Confident	12 Å²	12	63 Å²	63	8%	0.084	32%	0.321	C	S	.	.	H	α-helix	trans	-62.9	-36.9	176.6	-174.7	0	0	0	0	112.5	S71 V101 R102 N103 M107 N108	S71-S105 PolarHBondContact N-OG 3.39Å; V101-S105 WeakPolarHBondContact O-CB 3.4Å; V101-S105 PolarHBondContact O-N 3.14Å; R102-S105 PolarHBondContact O-N 3.3Å; N103-S105 PolarHBondContact O-N 2.58Å; S105-M107 VanDerWaalsContact C-N 3.32Å; S105-N108 PolarHBondContact O-N 3.34Å
106	Q	89.3	Confident	88.2	Confident	105 Å²	105	66.2 Å²	66.2	49%	0.491	34%	0.339	S	S	.	.	H	α-helix	trans	-72	-28.2	177.3	-73.9	178.2	-10.9	0	0	112.4	R102 N103 Y104 N108	R102-Q106 WeakPolarHBondContact O-CG 3.3Å; R102-Q106 PolarHBondContact O-N 2.95Å; N103-Q106 PolarHBondContact O-N 2.94Å; Y104-Q106 VanDerWaalsContact C-N 3.3Å; Y104-Q106 PolarHBondContact O-N 2.78Å; Q106-N108 PolarHBondContact O-N 2.95Å
107	M	88.8	Confident	87.9	Confident	136 Å²	136	66.6 Å²	66.6	67%	0.67	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	4.6	172.8	-66.8	177.6	-173.8	0	0	113.2	N103 Y104 S105 V109	N103-M107 WeakPolarHBondContact O-CG 3.28Å; N103-M107 PolarHBondContact O-N 3.47Å; N103-M107 VanDerWaalsContact O-N 3.09Å; Y104-M107 PolarHBondContact O-N 2.9Å; S105-M107 VanDerWaalsContact C-N 3.32Å; M107-V109 HydrophobicContact CB-CG2 3.73Å; M107-V109 PolarHBondContact O-N 3.24Å
108	N	85.7	Confident	87.5	Confident	144 Å²	144	69.9 Å²	69.9	77%	0.77	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.7	29.2	-175.8	-66	-43.6	0	0	0	114.1	Y104 S105 Q106	Y104-N108 PolarHBondContact O-N 3.27Å; S105-N108 PolarHBondContact O-N 3.34Å; Q106-N108 PolarHBondContact O-N 2.95Å
109	V	87.9	Confident	87.3	Confident	27 Å²	27	76.6 Å²	76.6	16%	0.164	40%	0.398	C	S	.	.	P	Polyproline II helix	trans	-77.1	137.6	177.6	176.1	0	0	0	0	109.7	W74 Y104 M107 D114 V115	W74-V109 HydrophobicContact CZ2-CG1 4.37Å; W74-V109 PolarHBondContact NE1-O 3.2Å; Y104-V109 HydrophobicContact CD1-CG1 4.47Å; Y104-V109 HydrophobicContact CD1-CG2 4.46Å; Y104-V109 WeakPolarHBondContact O-CB 3.13Å; Y104-V109 PolarHBondContact O-N 3.26Å; Y104-V109 VanDerWaalsContact O-N 3.15Å; M107-V109 HydrophobicContact CB-CG2 3.73Å; M107-V109 PolarHBondContact O-N 3.24Å; V109-D114 HydrophobicContact CG1-CB 3.51Å; V109-V115 HydrophobicContact CG1-CB 4.19Å; V109-V115 HydrophobicContact CG1-CG2 3.52Å
110	I	86.7	Confident	87.3	Confident	70 Å²	70	70.3 Å²	70.3	36%	0.359	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-93.4	125.3	-177.6	-55	172.2	0	0	0	110	M73 V113 D114	M73-I110 HydrophobicContact SD-CG2 4.41Å; I110-V113 HydrophobicContact CB-CB 4.1Å; I110-V113 HydrophobicContact CB-CG2 4.46Å; I110-V113 HydrophobicContact CG2-CB 3.97Å; I110-V113 HydrophobicContact CG2-CG2 3.78Å; I110-V113 PolarHBondContact O-N 2.82Å; I110-D114 WeakPolarHBondContact CB-OD2 3.41Å; I110-D114 PolarHBondContact N-OD2 2.74Å; I110-D114 PolarHBondContact O-N 3.46Å
111	P	87.4	Confident	87.4	Confident	13 Å²	13	72.3 Å²	72.3	8%	0.084	38%	0.382	C	S	.	.	B	Isolated β-bridge	trans	-64.6	139.4	179.3	26.4	-33.2	0	0	0	111.5	M73 W74 V113 V117	M73-P111 HydrophobicContact CB-CG 3.96Å; W74-P111 HydrophobicContact CD2-CB 4.13Å; W74-P111 HydrophobicContact CD2-CG 4.32Å; W74-P111 HydrophobicContact CE3-CB 4.05Å; W74-P111 HydrophobicContact CH2-CB 3.97Å; W74-P111 HydrophobicContact CZ2-CB 4.02Å; W74-P111 HydrophobicContact CZ3-CB 3.99Å; P111-V113 PolarHBondContact O-N 3.04Å; P111-V113 VanDerWaalsContact O-N 3.17Å; P111-V117 HydrophobicContact CB-CG2 3.78Å
112	N	85.4	Confident	87.5	Confident	101 Å²	101	76.8 Å²	76.8	54%	0.54	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	62	10.1	-178	-61.5	-42.3	0	0	0	115.8	V115 V117	N112-V115 WeakPolarHBondContact CA-O 3.42Å; N112-V115 PolarHBondContact N-O 2.87Å; N112-V117 VanDerWaalsContact OD1-CB 3.32Å; N112-V117 WeakPolarHBondContact OD1-CB 3.36Å; N112-V117 WeakPolarHBondContact OD1-CG2 3.08Å; N112-V117 PolarHBondContact OD1-N 2.96Å
113	V	85.8	Confident	87.6	Confident	109 Å²	109	73.4 Å²	73.4	66%	0.661	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118	-58.2	171.9	179.6	0	0	0	0	109.1	I110 P111	I110-V113 HydrophobicContact CB-CB 4.1Å; I110-V113 HydrophobicContact CB-CG2 4.46Å; I110-V113 HydrophobicContact CG2-CB 3.97Å; I110-V113 HydrophobicContact CG2-CG2 3.78Å; I110-V113 PolarHBondContact O-N 2.82Å; P111-V113 PolarHBondContact O-N 3.04Å; P111-V113 VanDerWaalsContact O-N 3.17Å
114	D	81.6	Confident	87.7	Confident	96 Å²	96	72.1 Å²	72.1	51%	0.513	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	-29.4	-177.7	-60	-41	0	0	0	112	V109 I110	V109-D114 HydrophobicContact CG1-CB 3.51Å; I110-D114 WeakPolarHBondContact CB-OD2 3.41Å; I110-D114 PolarHBondContact N-OD2 2.74Å; I110-D114 PolarHBondContact O-N 3.46Å
115	V	85.6	Confident	87.7	Confident	27 Å²	27	68.9 Å²	68.9	16%	0.164	38%	0.377	C	S	.	.	B	Isolated β-bridge	trans	-134	131.1	178.5	173.7	0	0	0	0	109.4	Y104 V109 N112 V117 I120	Y104-V115 HydrophobicContact CD1-CG2 4.22Å; Y104-V115 HydrophobicContact CE1-CG2 4.02Å; Y104-V115 HydrophobicContact CE2-CG1 4.12Å; V109-V115 HydrophobicContact CG1-CB 4.19Å; V109-V115 HydrophobicContact CG1-CG2 3.52Å; N112-V115 WeakPolarHBondContact CA-O 3.42Å; N112-V115 PolarHBondContact N-O 2.87Å; V115-V117 PolarHBondContact O-N 3.07Å; V115-I120 HydrophobicContact CG1-CD1 4.32Å; V115-I120 HydrophobicContact CG1-CG1 4.41Å
116	N	86	Confident	87.8	Confident	72 Å²	72	74.3 Å²	74.3	39%	0.385	41%	0.405	S	S	.	.			trans	-72.8	111.9	171.2	-174.2	7.9	0	0	0	109.3	S118 E119	N116-S118 PolarHBondContact O-N 2.65Å; N116-S118 PolarHBondContact OD1-N 3.26Å; N116-S118 PolarHBondContact OD1-OG 3.38Å; N116-E119 HydrophobicContact CB-CG 4.21Å; N116-E119 WeakPolarHBondContact CB-OE1 3.49Å; N116-E119 PolarHBondContact ND2-OE1 3.3Å; N116-E119 PolarHBondContact O-N 3.03Å; N116-E119 VanDerWaalsContact O-N 3.12Å
117	V	85.6	Confident	87.8	Confident	11 Å²	11	72.8 Å²	72.8	7%	0.067	40%	0.4	C	S	.	.	G	3₁₀ helix	trans	-62.8	-29.6	-174.5	173.7	0	0	0	0	111.6	W74 V77 L96 P111 N112 V115 E119 I120	W74-V117 HydrophobicContact CH2-CG2 4.47Å; W74-V117 HydrophobicContact CZ3-CG2 4.23Å; V77-V117 HydrophobicContact CG1-CB 4.08Å; V77-V117 HydrophobicContact CG1-CG1 3.38Å; V77-V117 HydrophobicContact CG1-CG2 3.76Å; L96-V117 HydrophobicContact CD1-CG1 3.4Å; L96-V117 HydrophobicContact CD2-CG1 4.3Å; L96-V117 HydrophobicContact CG-CG1 4.43Å; P111-V117 HydrophobicContact CB-CG2 3.78Å; N112-V117 VanDerWaalsContact OD1-CB 3.32Å; N112-V117 WeakPolarHBondContact OD1-CB 3.36Å; N112-V117 WeakPolarHBondContact OD1-CG2 3.08Å; N112-V117 PolarHBondContact OD1-N 2.96Å; V115-V117 PolarHBondContact O-N 3.07Å; V117-E119 PolarHBondContact O-N 3.13Å; V117-E119 VanDerWaalsContact O-N 3.17Å; V117-I120 WeakPolarHBondContact O-CB 3.31Å; V117-I120 PolarHBondContact O-N 3.05Å; V117-I120 VanDerWaalsContact O-N 3.12Å
118	S	83.9	Confident	88	Confident	105 Å²	105	66.9 Å²	66.9	73%	0.734	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-64.4	-18.4	179.9	-47.5	0	0	0	0	113.4	N116	N116-S118 PolarHBondContact O-N 2.65Å; N116-S118 PolarHBondContact OD1-N 3.26Å; N116-S118 PolarHBondContact OD1-OG 3.38Å
119	E	86.8	Confident	88.3	Confident	150 Å²	150	62.4 Å²	62.4	70%	0.701	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-88.7	-11.5	179.5	-67.4	169.2	-156.5	0	0	112.6	N116 V117	N116-E119 HydrophobicContact CB-CG 4.21Å; N116-E119 WeakPolarHBondContact CB-OE1 3.49Å; N116-E119 PolarHBondContact ND2-OE1 3.3Å; N116-E119 PolarHBondContact O-N 3.03Å; N116-E119 VanDerWaalsContact O-N 3.12Å; V117-E119 PolarHBondContact O-N 3.13Å; V117-E119 VanDerWaalsContact O-N 3.17Å
120	I	88.8	Confident	88.5	Confident	8 Å²	8	64.3 Å²	64.3	4%	0.041	35%	0.354	C	S	.	.	S	Bend	trans	-74.1	132.3	179.4	-60.7	174.3	0	0	0	108.8	W74 L96 T100 V101 Y104 V115 V117 L122	W74-I120 HydrophobicContact CH2-CD1 3.73Å; W74-I120 HydrophobicContact CZ3-CD1 3.53Å; L96-I120 HydrophobicContact CB-CG2 4.04Å; L96-I120 HydrophobicContact CD1-CD1 4.34Å; L96-I120 HydrophobicContact CD2-CB 4.05Å; L96-I120 HydrophobicContact CD2-CG2 4.16Å; L96-I120 HydrophobicContact CG-CG2 4.49Å; T100-I120 HydrophobicContact CG2-CG2 4.04Å; V101-I120 HydrophobicContact CG2-CG2 4.47Å; Y104-I120 HydrophobicContact CD2-CD1 4.18Å; Y104-I120 HydrophobicContact CE2-CD1 4.16Å; Y104-I120 HydrophobicContact CE2-CG1 4.24Å; V115-I120 HydrophobicContact CG1-CD1 4.32Å; V115-I120 HydrophobicContact CG1-CG1 4.41Å; V117-I120 WeakPolarHBondContact O-CB 3.31Å; V117-I120 PolarHBondContact O-N 3.05Å; V117-I120 VanDerWaalsContact O-N 3.12Å; I120-L122 PolarHBondContact O-N 3.12Å
121	P	91.3	Very high	88.9	Confident	78 Å²	78	62.8 Å²	62.8	51%	0.506	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-61.1	138.3	-179.3	23.4	-32.8	0	0	0	111.4	N97	N97-P121 HydrophobicContact CB-CG 4.05Å; N97-P121 WeakPolarHBondContact CB-O 3.39Å; N97-P121 PolarHBondContact N-O 3.49Å
122	L	92	Very high	89.1	Confident	95 Å²	95	63.9 Å²	63.9	50%	0.497	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	145.1	174.4	-67.3	168.3	0	0	0	110.7	P80 W94 R95 L96 I120	P80-L122 HydrophobicContact CG-CD2 3.91Å; W94-L122 HydrophobicContact CB-CD2 4.48Å; W94-L122 HydrophobicContact CE3-CB 4.38Å; R95-L122 CarbonylContact O-C 3.59Å; R95-L122 WeakPolarHBondContact O-CA 3.17Å; L96-L122 HydrophobicContact CD2-CD2 3.85Å; I120-L122 PolarHBondContact O-N 3.12Å
123	E	92.3	Very high	89.5	Confident	32 Å²	32	65.5 Å²	65.5	15%	0.15	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	160.8	171.6	67.4	178.6	-154.4	0	0	110.7	R95 N97	R95-E123 HydrophobicContact CG-CG 3.82Å; R95-E123 IonicContact CZ-OE1 3.42Å; R95-E123 VanDerWaalsContact CZ-OE1 3.25Å; R95-E123 PolarHBondContact N-O 3.25Å; R95-E123 IonicContact NE-OE1 2.84Å; R95-E123 PolarHBondContact NE-OE1 3.15Å; R95-E123 IonicContact NH2-OE1 3.73Å; R95-E123 PolarHBondContact NH2-OE1 3.03Å; R95-E123 PolarHBondContact O-N 3.47Å; R95-E123 VanDerWaalsContact O-O 3.13Å; N97-E123 WeakPolarHBondContact CA-OE2 3.13Å; N97-E123 PolarHBondContact ND2-OE2 2.98Å
124	T	92.1	Very high	89.7	Confident	48 Å²	48	68 Å²	68	29%	0.294	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	161.3	173.3	54.6	0	0	0	0	110.9	W94 L126	W94-T124 HydrophobicContact CE3-CG2 4.12Å; W94-T124 HydrophobicContact CH2-CG2 3.93Å; W94-T124 HydrophobicContact CZ3-CG2 3.62Å; T124-L126 VanDerWaalsContact C-N 3.3Å; T124-L126 PolarHBondContact O-N 2.94Å
125	C	91.2	Very high	90.1	Very high	7 Å²	7	65.8 Å²	65.8	5%	0.047	35%	0.349	C	S	.	.			trans	-70.6	79.2	179.2	-45.3	0	0	0	0	112.3	C62 C93 D127 G128 W129	C62-C125 WeakPolarHBondContact CA-SG 3.26Å; C62-C125 HydrophobicContact CB-CB 3.75Å; C62-C125 WeakPolarHBondContact CB-SG 3.48Å; C62-C125 WeakPolarHBondContact SG-CB 3.41Å; C62-C125 CovalentContact SG-SG 2.02Å; C62-C125 PolarHBondContact SG-SG 3.41Å; C93-C125 PolarHBondContact O-SG 2.88Å; C125-D127 VanDerWaalsContact C-N 3.33Å; C125-D127 PolarHBondContact O-N 3.46Å; C125-G128 PolarHBondContact O-N 2.99Å; C125-W129 HydrophobicContact CB-CD2 4.34Å; C125-W129 HydrophobicContact CB-CZ2 3.92Å; C125-W129 PolarHBondContact SG-NE1 3.38Å
126	L	89.6	Confident	90.4	Very high	126 Å²	126	65.4 Å²	65.4	66%	0.66	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-31.2	-176.9	-60.8	176.6	0	0	0	113.5	T124 G128	T124-L126 VanDerWaalsContact C-N 3.3Å; T124-L126 PolarHBondContact O-N 2.94Å; L126-G128 VanDerWaalsContact C-N 3.3Å; L126-G128 PolarHBondContact O-N 2.83Å
127	D	90.3	Very high	90.8	Very high	73 Å²	73	66.2 Å²	66.2	39%	0.39	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	13.6	-178.8	-57	-73.2	0	0	0	113.6	P65 R95 C125	P65-D127 HydrophobicContact CG-CB 3.66Å; P65-D127 WeakPolarHBondContact CG-OD2 3.08Å; R95-D127 IonicContact CZ-OD2 2.84Å; R95-D127 IonicContact NH1-OD2 3.25Å; R95-D127 PolarHBondContact NH1-OD2 2.85Å; R95-D127 IonicContact NH2-OD2 2.8Å; R95-D127 PolarHBondContact NH2-OD2 3.38Å; C125-D127 VanDerWaalsContact C-N 3.33Å; C125-D127 PolarHBondContact O-N 3.46Å
128	G	91.3	Very high	91.2	Very high	13 Å²	13	66.7 Å²	66.7	13%	0.134	35%	0.35	C	S	.	.			trans	84.6	-161.4	-178.4	0	0	0	0	0	114.1	R63 C125 L126	R63-G128 WeakPolarHBondContact CB-O 3.45Å; R63-G128 PolarHBondContact N-O 3.33Å; C125-G128 PolarHBondContact O-N 2.99Å; L126-G128 VanDerWaalsContact C-N 3.3Å; L126-G128 PolarHBondContact O-N 2.83Å
129	W	93.6	Very high	91.8	Very high	49 Å²	49	61.8 Å²	61.8	19%	0.186	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	154.2	-170.1	-65.2	-93	0	0	0	112.5	H60 E61 S92 C125 Y131 N145 V147 C148	H60-W129 AromaticContact CD2-CD1 3.66Å; E61-W129 CarbonylContact O-C 3.56Å; E61-W129 WeakPolarHBondContact O-CA 3.46Å; S92-W129 PolarHBondContact O-NE1 2.94Å; C125-W129 HydrophobicContact CB-CD2 4.34Å; C125-W129 HydrophobicContact CB-CZ2 3.92Å; C125-W129 PolarHBondContact SG-NE1 3.38Å; W129-Y131 HydrophobicContact CB-CD2 4.42Å; W129-Y131 HydrophobicContact CB-CE1 4.33Å; W129-Y131 HydrophobicContact CB-CE2 3.78Å; W129-N145 HydrophobicContact CE3-CB 3.61Å; W129-N145 HydrophobicContact CZ3-CB 3.53Å; W129-V147 HydrophobicContact CD2-CG2 3.56Å; W129-V147 VanDerWaalsContact CE2-CG2 3.4Å; W129-V147 HydrophobicContact CE3-CG2 4.08Å; W129-V147 HydrophobicContact CG-CG2 3.94Å; W129-V147 HydrophobicContact CH2-CG2 4.35Å; W129-V147 HydrophobicContact CZ2-CG2 3.83Å; W129-V147 HydrophobicContact CZ3-CG2 4.46Å; W129-C148 HydrophobicContact CZ2-CB 4.28Å
130	M	92.3	Very high	92.2	Very high	67 Å²	67	54.6 Å²	54.6	33%	0.33	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	123.4	164.4	-65	-169.9	-52.1	0	0	108.7	H60 E61 R63	H60-M130 VanDerWaalsContact CA-O 3.25Å; H60-M130 WeakPolarHBondContact CA-O 3.42Å; E61-M130 HydrophobicContact CG-CB 4.28Å; E61-M130 HydrophobicContact CG-CE 4.11Å; E61-M130 PolarHBondContact N-O 3.06Å; E61-M130 VanDerWaalsContact N-O 3.08Å; E61-M130 PolarHBondContact O-N 3.08Å; E61-M130 WeakPolarHBondContact OE1-CE 3.39Å; R63-M130 HydrophobicContact CB-CG 3.95Å; R63-M130 HydrophobicContact CG-CG 3.91Å; R63-M130 HydrophobicContact CG-SD 4.39Å
131	Y	94.1	Very high	92.5	Very high	39 Å²	39	54.2 Å²	54.2	15%	0.153	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	137.8	-178.9	-63.6	-80.3	0	0	0	110.6	P58 H60 W129 T142 N145 V147	P58-Y131 HydrophobicContact CG-CD1 3.88Å; P58-Y131 HydrophobicContact CG-CG 4.33Å; H60-Y131 HydrophobicContact CB-CD1 3.44Å; H60-Y131 VanDerWaalsContact CB-CD1 3.44Å; H60-Y131 HydrophobicContact CB-CE1 3.6Å; H60-Y131 HydrophobicContact CB-CG 4.29Å; H60-Y131 AromaticContact CG-CE1 3.86Å; W129-Y131 HydrophobicContact CB-CD2 4.42Å; W129-Y131 HydrophobicContact CB-CE1 4.33Å; W129-Y131 HydrophobicContact CB-CE2 3.78Å; Y131-T142 HydrophobicContact CD1-CG2 3.68Å; Y131-T142 HydrophobicContact CD2-CG2 3.79Å; Y131-T142 HydrophobicContact CE1-CG2 4.21Å; Y131-T142 HydrophobicContact CE2-CG2 4.29Å; Y131-T142 HydrophobicContact CG-CG2 3.47Å; Y131-T142 VanDerWaalsContact CG-CG2 3.47Å; Y131-N145 WeakPolarHBondContact CE2-OD1 3.31Å; Y131-N145 PolarHBondContact OH-OD1 3.45Å; Y131-V147 HydrophobicContact CE1-CG1 3.98Å; Y131-V147 WeakPolarHBondContact OH-CG2 3.27Å
132	S	92.7	Very high	92.6	Very high	35 Å²	35	51.9 Å²	51.9	25%	0.245	26%	0.264	C	S	.	.			trans	-66.1	132.9	171.6	175.5	0	0	0	0	110.8	P59 E134	P59-S132 PolarHBondContact O-N 3.18Å; S132-E134 WeakPolarHBondContact OG-CG 3.29Å; S132-E134 PolarHBondContact OG-N 3.08Å
133	K	92.8	Very high	92.7	Very high	136 Å²	136	51.7 Å²	51.7	59%	0.591	26%	0.261	S	S	*	.			trans	-100.8	10.9	179.6	-64.6	-174.1	176.7	-174.7	0	114.2	Y136	K133-Y136 CarbonylContact C-O 3.58Å; K133-Y136 VanDerWaalsContact CA-O 3.29Å; K133-Y136 WeakPolarHBondContact CA-O 3.38Å
134	E	90.5	Very high	92.9	Very high	160 Å²	160	52.3 Å²	52.3	75%	0.748	26%	0.262	S	S	*	.	S	Bend	trans	-63.9	-45.8	-176.4	-69.8	176.3	-173.7	0	0	112.2	S132	S132-E134 WeakPolarHBondContact OG-CG 3.29Å; S132-E134 PolarHBondContact OG-N 3.08Å
135	V	89.8	Confident	93	Very high	50 Å²	50	52.8 Å²	52.8	30%	0.303	26%	0.263	S	S	.	.	S	Bend	trans	-99.8	-41.9	-174.9	-176.2	0	0	0	0	112.3	P384 Y385	V135-P384 HydrophobicContact CG1-CG 3.78Å; V135-Y385 HydrophobicContact CG1-CE2 3.98Å; V135-Y385 PolarHBondContact O-OH 3.2Å
136	Y	92.7	Very high	93.1	Very high	20 Å²	20	52.7 Å²	52.7	8%	0.078	26%	0.261	C	S	.	.			trans	-125.6	138.2	-175.9	-56	-68.3	0	0	0	109.6	F53 A56 P58 K133 T139 Y385	F53-Y136 HydrophobicContact CD1-CE1 4.08Å; A56-Y136 HydrophobicContact CB-CD2 4.06Å; A56-Y136 HydrophobicContact CB-CE1 4.08Å; A56-Y136 HydrophobicContact CB-CE2 3.5Å; A56-Y136 VanDerWaalsContact CB-CE2 3.5Å; P58-Y136 HydrophobicContact CB-CD2 4.36Å; K133-Y136 CarbonylContact C-O 3.58Å; K133-Y136 VanDerWaalsContact CA-O 3.29Å; K133-Y136 WeakPolarHBondContact CA-O 3.38Å; Y136-T139 HydrophobicContact CD1-CG2 4.42Å; Y136-T139 HydrophobicContact CG-CG2 3.99Å; Y136-Y385 WeakPolarHBondContact CE1-OH 3.28Å
137	Q	93.3	Very high	93.2	Very high	88 Å²	88	46.8 Å²	46.8	41%	0.411	23%	0.231	S	C	.	.	S	Bend	trans	-85.3	-41.7	175.8	-73.7	-64.8	-19.7	0	0	111.5	R266 E267	Q137-R266 HydrophobicContact CB-CB 4.43Å; Q137-R266 HydrophobicContact CG-CB 4.16Å; Q137-R266 PolarHBondContact N-O 3.42Å; Q137-E267 HydrophobicContact CB-CG 3.64Å; Q137-E267 HydrophobicContact CG-CG 4.48Å
138	S	94.2	Very high	93.2	Very high	22 Å²	22	44.2 Å²	44.2	15%	0.154	22%	0.218	C	C	.	.	B	Isolated β-bridge	trans	-154.8	141.1	174.7	61.7	0	0	0	0	110.5	W268	S138-W268 PolarHBondContact O-N 2.89Å; S138-W268 VanDerWaalsContact O-N 3.09Å
139	T	95.6	Very high	93.2	Very high	1 Å²	1	50.8 Å²	50.8	1%	0.006	25%	0.246	C	C	.	.			trans	-132.1	167.7	175.2	75.6	0	0	0	0	110	V54 A56 Y136 V141 T142 E143	V54-T139 VanDerWaalsContact O-CB 3.25Å; V54-T139 WeakPolarHBondContact O-CB 3.47Å; A56-T139 HydrophobicContact CB-CG2 4.48Å; A56-T139 WeakPolarHBondContact O-CB 3.4Å; A56-T139 PolarHBondContact O-OG1 2.88Å; Y136-T139 HydrophobicContact CD1-CG2 4.42Å; Y136-T139 HydrophobicContact CG-CG2 3.99Å; T139-V141 PolarHBondContact O-N 3.08Å; T139-V141 PolarHBondContact OG1-N 3.27Å; T139-T142 PolarHBondContact N-OG1 3.47Å; T139-T142 PolarHBondContact O-N 3.42Å; T139-T142 PolarHBondContact O-OG1 3.32Å; T139-T142 PolarHBondContact OG1-N 2.88Å; T139-E143 PolarHBondContact O-N 2.92Å
140	I	95.6	Very high	93.1	Very high	0 Å²	0	51 Å²	51	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-63.4	-25.4	173.8	59.2	158.8	0	0	0	111.8	I51 V54 W144 L146 T157 F208 W268	I51-I140 HydrophobicContact CD1-CD1 4.31Å; V54-I140 HydrophobicContact CG1-CB 4.44Å; V54-I140 HydrophobicContact CG1-CG1 4.17Å; V54-I140 HydrophobicContact CG1-CG2 3.59Å; V54-I140 VanDerWaalsContact O-CG1 3.26Å; V54-I140 WeakPolarHBondContact O-CG1 3.39Å; V54-I140 PolarHBondContact O-N 3.41Å; I140-W144 HydrophobicContact CB-CE3 3.89Å; I140-W144 HydrophobicContact CB-CZ3 3.62Å; I140-W144 HydrophobicContact CG2-CE3 4.38Å; I140-W144 HydrophobicContact CG2-CH2 4.13Å; I140-W144 HydrophobicContact CG2-CZ3 3.64Å; I140-W144 PolarHBondContact O-N 3.22Å; I140-L146 HydrophobicContact CD1-CD1 4.45Å; I140-T157 HydrophobicContact CD1-CG2 4.31Å; I140-F208 HydrophobicContact CD1-CD1 4.48Å; I140-F208 HydrophobicContact CD1-CE1 3.97Å; I140-F208 HydrophobicContact CD1-CZ 4.31Å; I140-F208 HydrophobicContact CG2-CD2 4.27Å; I140-F208 HydrophobicContact CG2-CE2 3.9Å; I140-F208 HydrophobicContact CG2-CZ 4.09Å; I140-W268 HydrophobicContact CG2-CD2 4.05Å; I140-W268 HydrophobicContact CG2-CE3 4.04Å; I140-W268 HydrophobicContact CG2-CG 4.49Å; I140-W268 HydrophobicContact CG2-CZ3 4.38Å
141	V	94.6	Very high	93	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-70.6	-42.9	175.9	-179.5	0	0	0	0	110.6	T57 T139 N145 L146 V147	T57-V141 HydrophobicContact CG2-CG1 4.12Å; T139-V141 PolarHBondContact O-N 3.08Å; T139-V141 PolarHBondContact OG1-N 3.27Å; V141-N145 VanDerWaalsContact O-CA 3.22Å; V141-N145 WeakPolarHBondContact O-CA 3.45Å; V141-N145 PolarHBondContact O-N 2.89Å; V141-L146 HydrophobicContact CB-CB 4.43Å; V141-L146 HydrophobicContact CG1-CB 4.14Å; V141-L146 HydrophobicContact CG2-CB 4.41Å; V141-L146 PolarHBondContact O-N 3.01Å; V141-V147 HydrophobicContact CG1-CG1 3.59Å
142	T	94.5	Very high	93	Very high	28 Å²	28	52.7 Å²	52.7	17%	0.172	26%	0.255	C	S	.	.	H	α-helix	trans	-73.8	-30.3	178.7	64.2	0	0	0	0	113.2	P58 Y131 T139	P58-T142 HydrophobicContact CG-CG2 3.43Å; P58-T142 VanDerWaalsContact CG-CG2 3.43Å; Y131-T142 HydrophobicContact CD1-CG2 3.68Å; Y131-T142 HydrophobicContact CD2-CG2 3.79Å; Y131-T142 HydrophobicContact CE1-CG2 4.21Å; Y131-T142 HydrophobicContact CE2-CG2 4.29Å; Y131-T142 HydrophobicContact CG-CG2 3.47Å; Y131-T142 VanDerWaalsContact CG-CG2 3.47Å; T139-T142 PolarHBondContact N-OG1 3.47Å; T139-T142 PolarHBondContact O-N 3.42Å; T139-T142 PolarHBondContact O-OG1 3.32Å; T139-T142 PolarHBondContact OG1-N 2.88Å
143	E	94.5	Very high	93.1	Very high	91 Å²	91	52.7 Å²	52.7	43%	0.425	25%	0.251	S	S	.	.	H	α-helix	trans	-70.3	-45.3	-180	-171.1	78.2	-175.6	0	0	111.7	T139 R269	T139-E143 PolarHBondContact O-N 2.92Å; E143-R269 IonicContact OE1-NH2 3.6Å
144	W	94.9	Very high	93.1	Very high	46 Å²	46	47.8 Å²	47.8	17%	0.174	23%	0.231	C	C	.	.	H	α-helix	trans	-110.3	13.4	-174.4	-58	-47.8	0	0	0	113.9	I140 L146 S202 P203 S204 W205 F208 W268	I140-W144 HydrophobicContact CB-CE3 3.89Å; I140-W144 HydrophobicContact CB-CZ3 3.62Å; I140-W144 HydrophobicContact CG2-CE3 4.38Å; I140-W144 HydrophobicContact CG2-CH2 4.13Å; I140-W144 HydrophobicContact CG2-CZ3 3.64Å; I140-W144 PolarHBondContact O-N 3.22Å; W144-L146 HydrophobicContact CB-CD2 3.95Å; W144-L146 HydrophobicContact CB-CG 4.12Å; W144-L146 HydrophobicContact CE3-CD1 4.43Å; W144-L146 PolarHBondContact O-N 3.49Å; W144-S202 WeakPolarHBondContact CH2-OG 3.34Å; W144-P203 PolarHBondContact NE1-O 2.69Å; W144-S204 VanDerWaalsContact CZ2-C 3.47Å; W144-W205 HydrophobicContact CB-CB 4.46Å; W144-W205 HydrophobicContact CD2-CB 3.91Å; W144-W205 HydrophobicContact CE3-CB 3.68Å; W144-W205 HydrophobicContact CE3-CG 4.36Å; W144-W205 HydrophobicContact CG-CB 4.26Å; W144-W205 HydrophobicContact CZ3-CB 4.26Å; W144-F208 HydrophobicContact CH2-CB 3.46Å; W144-F208 VanDerWaalsContact CH2-CB 3.46Å; W144-F208 AromaticContact CH2-CD2 3.85Å; W144-F208 HydrophobicContact CH2-CD2 3.85Å; W144-F208 AromaticContact CH2-CG 3.77Å; W144-F208 HydrophobicContact CH2-CG 3.77Å; W144-F208 HydrophobicContact CZ2-CB 4.45Å; W144-F208 HydrophobicContact CZ3-CB 3.75Å; W144-F208 HydrophobicContact CZ3-CD1 4.35Å; W144-F208 HydrophobicContact CZ3-CD2 4.18Å; W144-F208 AromaticContact CZ3-CG 3.84Å; W144-F208 HydrophobicContact CZ3-CG 3.84Å; W144-W268 HydrophobicContact CH2-CH2 4.41Å
145	N	94.3	Very high	93.2	Very high	58 Å²	58	40.8 Å²	40.8	31%	0.31	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.7	53.9	179.2	-61.4	-49.4	0	0	0	113.4	W129 Y131 V141 V147	W129-N145 HydrophobicContact CE3-CB 3.61Å; W129-N145 HydrophobicContact CZ3-CB 3.53Å; Y131-N145 WeakPolarHBondContact CE2-OD1 3.31Å; Y131-N145 PolarHBondContact OH-OD1 3.45Å; V141-N145 VanDerWaalsContact O-CA 3.22Å; V141-N145 WeakPolarHBondContact O-CA 3.45Å; V141-N145 PolarHBondContact O-N 2.89Å; N145-V147 PolarHBondContact O-N 2.98Å
146	L	93.8	Very high	93.5	Very high	4 Å²	4	40.7 Å²	40.7	2%	0.021	20%	0.197	C	C	.	.			trans	-82.6	46.8	-176.7	-51.8	178.4	0	0	0	112.3	I140 V141 W144 Q151 K153 W205	I140-L146 HydrophobicContact CD1-CD1 4.45Å; V141-L146 HydrophobicContact CB-CB 4.43Å; V141-L146 HydrophobicContact CG1-CB 4.14Å; V141-L146 HydrophobicContact CG2-CB 4.41Å; V141-L146 PolarHBondContact O-N 3.01Å; W144-L146 HydrophobicContact CB-CD2 3.95Å; W144-L146 HydrophobicContact CB-CG 4.12Å; W144-L146 HydrophobicContact CE3-CD1 4.43Å; W144-L146 PolarHBondContact O-N 3.49Å; L146-Q151 WeakPolarHBondContact O-CA 3.43Å; L146-K153 HydrophobicContact CD2-CB 4.17Å; L146-K153 HydrophobicContact CD2-CD 3.8Å; L146-W205 HydrophobicContact CD1-CG 4.48Å; L146-W205 HydrophobicContact CD2-CG 4.23Å
147	V	92.8	Very high	93.6	Very high	3 Å²	3	39.8 Å²	39.8	2%	0.018	19%	0.193	C	C	.	.			trans	-119.7	169.5	-177.4	-62.5	0	0	0	0	111.2	T57 W129 Y131 V141 N145 E149 N150	T57-V147 HydrophobicContact CG2-CG1 3.97Å; W129-V147 HydrophobicContact CD2-CG2 3.56Å; W129-V147 VanDerWaalsContact CE2-CG2 3.4Å; W129-V147 HydrophobicContact CE3-CG2 4.08Å; W129-V147 HydrophobicContact CG-CG2 3.94Å; W129-V147 HydrophobicContact CH2-CG2 4.35Å; W129-V147 HydrophobicContact CZ2-CG2 3.83Å; W129-V147 HydrophobicContact CZ3-CG2 4.46Å; Y131-V147 HydrophobicContact CE1-CG1 3.98Å; Y131-V147 WeakPolarHBondContact OH-CG2 3.27Å; V141-V147 HydrophobicContact CG1-CG1 3.59Å; N145-V147 PolarHBondContact O-N 2.98Å; V147-E149 PolarHBondContact O-N 3.01Å; V147-E149 VanDerWaalsContact O-N 3.16Å; V147-N150 PolarHBondContact O-N 3.26Å
148	C	90	Very high	93.7	Very high	19 Å²	19	36 Å²	36	13%	0.128	18%	0.176	C	C	.	.	G	3₁₀ helix	trans	54.4	-115.5	176.4	-52.2	0	0	0	0	112.2	C93 W129 N150 Q151	C93-C148 WeakPolarHBondContact CA-SG 3.27Å; C93-C148 HydrophobicContact CB-CB 3.78Å; C93-C148 WeakPolarHBondContact CB-SG 3.4Å; C93-C148 VanDerWaalsContact SG-CA 3.5Å; C93-C148 WeakPolarHBondContact SG-CB 3.34Å; C93-C148 CovalentContact SG-SG 2.03Å; C93-C148 PolarHBondContact SG-SG 3.08Å; W129-C148 HydrophobicContact CZ2-CB 4.28Å; C148-N150 PolarHBondContact O-N 3.37Å; C148-Q151 VanDerWaalsContact O-CB 3.28Å; C148-Q151 WeakPolarHBondContact O-CB 3.13Å; C148-Q151 WeakPolarHBondContact O-CG 3.3Å; C148-Q151 PolarHBondContact O-N 3.33Å; C148-Q151 VanDerWaalsContact O-N 3.13Å
149	E	90.4	Very high	93.7	Very high	151 Å²	151	35.1 Å²	35.1	71%	0.706	17%	0.17	S	C	*	.	G	3₁₀ helix	trans	-58.6	-31.4	178.9	-64.7	-178.1	178.1	0	0	113.4	V147 Y152	V147-E149 PolarHBondContact O-N 3.01Å; V147-E149 VanDerWaalsContact O-N 3.16Å; E149-Y152 WeakPolarHBondContact O-CD1 3.2Å; E149-Y152 WeakPolarHBondContact O-CE1 3.47Å
150	N	92.8	Very high	93.8	Very high	53 Å²	53	36.8 Å²	36.8	28%	0.283	18%	0.179	S	C	.	.	G	3₁₀ helix	trans	-93.4	6.1	-178.2	-75.6	-52.5	0	0	0	113.8	V147 C148 Y152 K153	V147-N150 PolarHBondContact O-N 3.26Å; C148-N150 PolarHBondContact O-N 3.37Å; N150-Y152 PolarHBondContact O-N 2.57Å; N150-K153 HydrophobicContact CB-CD 4.14Å; N150-K153 VanDerWaalsContact O-CB 3.25Å; N150-K153 WeakPolarHBondContact O-CB 3.2Å; N150-K153 WeakPolarHBondContact O-CG 3.44Å; N150-K153 PolarHBondContact O-N 3.43Å; N150-K153 WeakPolarHBondContact OD1-CE 3.24Å; N150-K153 PolarHBondContact OD1-NZ 3.42Å; N150-K153 VanDerWaalsContact OD1-NZ 3.17Å
151	Q	90.2	Very high	93.7	Very high	38 Å²	38	37.1 Å²	37.1	18%	0.178	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-28.4	-173.8	67.8	-177.9	-16	0	0	114.5	L146 C148 K153 N154 P155 Y494 F497	L146-Q151 WeakPolarHBondContact O-CA 3.43Å; C148-Q151 VanDerWaalsContact O-CB 3.28Å; C148-Q151 WeakPolarHBondContact O-CB 3.13Å; C148-Q151 WeakPolarHBondContact O-CG 3.3Å; C148-Q151 PolarHBondContact O-N 3.33Å; C148-Q151 VanDerWaalsContact O-N 3.13Å; Q151-K153 PolarHBondContact O-N 3.15Å; Q151-N154 PolarHBondContact O-N 3.34Å; Q151-P155 VanDerWaalsContact O-CD 3.25Å; Q151-P155 WeakPolarHBondContact O-CD 3.34Å; Q151-Y494 HydrophobicContact CB-CE2 4.34Å; Q151-Y494 HydrophobicContact CG-CE2 3.65Å; Q151-Y494 VanDerWaalsContact CG-OH 3.22Å; Q151-Y494 WeakPolarHBondContact CG-OH 3.46Å; Q151-Y494 PolarHBondContact NE2-OH 3.28Å; Q151-Y494 VanDerWaalsContact NE2-OH 3.11Å; Q151-F497 VanDerWaalsContact NE2-CE1 3.26Å
152	Y	93	Very high	93.7	Very high	104 Å²	104	37.3 Å²	37.3	41%	0.408	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-19.7	177.2	72.1	-89.4	0	0	0	112.5	E149 N150 N154 P155 L156	E149-Y152 WeakPolarHBondContact O-CD1 3.2Å; E149-Y152 WeakPolarHBondContact O-CE1 3.47Å; N150-Y152 PolarHBondContact O-N 2.57Å; Y152-N154 VanDerWaalsContact C-N 3.25Å; Y152-N154 PolarHBondContact O-N 3.48Å; Y152-P155 VanDerWaalsContact O-CD 3.28Å; Y152-P155 WeakPolarHBondContact O-CD 3.45Å; Y152-P155 VanDerWaalsContact O-CG 3.3Å; Y152-P155 WeakPolarHBondContact O-CG 3.43Å; Y152-L156 HydrophobicContact CD2-CD2 4.47Å; Y152-L156 HydrophobicContact CE2-CD2 4.41Å; Y152-L156 VanDerWaalsContact O-CB 3.24Å; Y152-L156 WeakPolarHBondContact O-CB 3.48Å; Y152-L156 PolarHBondContact O-N 3.37Å; Y152-L156 VanDerWaalsContact O-N 3.17Å
153	K	95.1	Very high	93.8	Very high	35 Å²	35	38.6 Å²	38.6	15%	0.152	19%	0.186	C	C	.	.	H	α-helix	trans	-65.4	-30	178.9	-67.5	-175.9	176.5	177.5	0	112	L146 N150 Q151 T157 W205	L146-K153 HydrophobicContact CD2-CB 4.17Å; L146-K153 HydrophobicContact CD2-CD 3.8Å; N150-K153 HydrophobicContact CB-CD 4.14Å; N150-K153 VanDerWaalsContact O-CB 3.25Å; N150-K153 WeakPolarHBondContact O-CB 3.2Å; N150-K153 WeakPolarHBondContact O-CG 3.44Å; N150-K153 PolarHBondContact O-N 3.43Å; N150-K153 WeakPolarHBondContact OD1-CE 3.24Å; N150-K153 PolarHBondContact OD1-NZ 3.42Å; N150-K153 VanDerWaalsContact OD1-NZ 3.17Å; Q151-K153 PolarHBondContact O-N 3.15Å; K153-T157 WeakPolarHBondContact O-CB 3.42Å; K153-T157 PolarHBondContact O-N 3.01Å; K153-T157 PolarHBondContact O-OG1 3.46Å; K153-W205 HydrophobicContact CB-CH2 4.35Å; K153-W205 HydrophobicContact CB-CZ2 3.71Å; K153-W205 HydrophobicContact CD-CD2 4.07Å; K153-W205 HydrophobicContact CD-CE3 4.02Å; K153-W205 HydrophobicContact CD-CH2 4.1Å; K153-W205 HydrophobicContact CD-CZ2 4.14Å; K153-W205 HydrophobicContact CD-CZ3 4.04Å; K153-W205 HydrophobicContact CG-CH2 3.96Å; K153-W205 HydrophobicContact CG-CZ2 3.84Å; K153-W205 HydrophobicContact CG-CZ3 4.4Å
154	N	92.1	Very high	93.8	Very high	32 Å²	32	34.2 Å²	34.2	17%	0.171	17%	0.166	C	C	.	.	H	α-helix	trans	-66.8	-56.6	179.1	-165.7	22.8	0	0	0	112.8	G55 Q151 Y152 L156 T157 T158	G55-N154 PolarHBondContact O-ND2 2.95Å; G55-N154 PolarHBondContact O-OD1 3.23Å; Q151-N154 PolarHBondContact O-N 3.34Å; Y152-N154 VanDerWaalsContact C-N 3.25Å; Y152-N154 PolarHBondContact O-N 3.48Å; N154-L156 VanDerWaalsContact C-N 3.27Å; N154-L156 PolarHBondContact O-N 2.85Å; N154-T157 WeakPolarHBondContact O-CB 3.26Å; N154-T157 PolarHBondContact O-N 3.3Å; N154-T157 VanDerWaalsContact O-N 3.11Å; N154-T158 PolarHBondContact O-N 3.04Å
155	P	93.8	Very high	93.7	Very high	13 Å²	13	32 Å²	32	8%	0.084	16%	0.158	C	C	.	.	H	α-helix	trans	-62.2	-35.3	174.8	24.8	-33.9	0	0	0	112.3	Q151 Y152 T157 T158 S159 P490 F491 Y494	Q151-P155 VanDerWaalsContact O-CD 3.25Å; Q151-P155 WeakPolarHBondContact O-CD 3.34Å; Y152-P155 VanDerWaalsContact O-CD 3.28Å; Y152-P155 WeakPolarHBondContact O-CD 3.45Å; Y152-P155 VanDerWaalsContact O-CG 3.3Å; Y152-P155 WeakPolarHBondContact O-CG 3.43Å; P155-T157 VanDerWaalsContact C-N 3.29Å; P155-T157 PolarHBondContact O-N 3.24Å; P155-T158 PolarHBondContact O-N 3.43Å; P155-S159 PolarHBondContact O-N 3.41Å; P155-S159 PolarHBondContact O-OG 2.96Å; P155-P490 HydrophobicContact CB-CB 3.78Å; P155-F491 HydrophobicContact CB-CD1 4.3Å; P155-F491 HydrophobicContact CB-CE1 4.32Å; P155-F491 HydrophobicContact CG-CD1 4.34Å; P155-F491 HydrophobicContact CG-CE1 4.14Å; P155-Y494 HydrophobicContact CG-CD2 3.85Å; P155-Y494 HydrophobicContact CG-CG 3.96Å
156	L	95.8	Very high	93.7	Very high	49 Å²	49	30.6 Å²	30.6	26%	0.257	15%	0.15	S	C	.	.	H	α-helix	trans	-59.5	-38.9	174.4	178.9	62.3	0	0	0	112.4	Y152 N154 T158 S159 I160 W205 F491	Y152-L156 HydrophobicContact CD2-CD2 4.47Å; Y152-L156 HydrophobicContact CE2-CD2 4.41Å; Y152-L156 VanDerWaalsContact O-CB 3.24Å; Y152-L156 WeakPolarHBondContact O-CB 3.48Å; Y152-L156 PolarHBondContact O-N 3.37Å; Y152-L156 VanDerWaalsContact O-N 3.17Å; N154-L156 VanDerWaalsContact C-N 3.27Å; N154-L156 PolarHBondContact O-N 2.85Å; L156-T158 PolarHBondContact O-N 3.1Å; L156-S159 PolarHBondContact O-N 2.91Å; L156-I160 HydrophobicContact CD1-CD1 3.83Å; L156-I160 HydrophobicContact CD1-CG1 4.16Å; L156-I160 HydrophobicContact CG-CD1 3.92Å; L156-I160 WeakPolarHBondContact O-CG1 3.12Å; L156-I160 PolarHBondContact O-N 3.46Å; L156-W205 HydrophobicContact CD2-CH2 4.05Å; L156-W205 HydrophobicContact CD2-CZ2 4.16Å; L156-F491 HydrophobicContact CB-CZ 4.3Å
157	T	95.1	Very high	93.7	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-59.3	-47.3	177.7	-60.8	0	0	0	0	111	I51 I140 K153 N154 P155 I160 H161 W205 F208 L209 F212	I51-T157 HydrophobicContact CD1-CG2 4.35Å; I140-T157 HydrophobicContact CD1-CG2 4.31Å; K153-T157 WeakPolarHBondContact O-CB 3.42Å; K153-T157 PolarHBondContact O-N 3.01Å; K153-T157 PolarHBondContact O-OG1 3.46Å; N154-T157 WeakPolarHBondContact O-CB 3.26Å; N154-T157 PolarHBondContact O-N 3.3Å; N154-T157 VanDerWaalsContact O-N 3.11Å; P155-T157 VanDerWaalsContact C-N 3.29Å; P155-T157 PolarHBondContact O-N 3.24Å; T157-I160 PolarHBondContact O-N 2.91Å; T157-H161 PolarHBondContact O-N 2.77Å; T157-W205 PolarHBondContact OG1-NE1 3.4Å; T157-F208 HydrophobicContact CG2-CD1 4.09Å; T157-F208 HydrophobicContact CG2-CE1 3.73Å; T157-L209 HydrophobicContact CG2-CD1 4.18Å; T157-F212 HydrophobicContact CG2-CD1 3.65Å; T157-F212 HydrophobicContact CG2-CE1 3.97Å
158	T	94	Very high	93.7	Very high	8 Å²	8	34.9 Å²	34.9	5%	0.049	17%	0.17	C	C	.	.	H	α-helix	trans	-67.1	-40.3	176.8	-53.6	0	0	0	0	112	I51 N154 P155 L156 I160 H161 Y162 L375 P490	I51-T158 WeakPolarHBondContact CG1-OG1 3.5Å; I51-T158 HydrophobicContact CG2-CG2 4.31Å; N154-T158 PolarHBondContact O-N 3.04Å; P155-T158 PolarHBondContact O-N 3.43Å; L156-T158 PolarHBondContact O-N 3.1Å; T158-I160 PolarHBondContact O-N 2.97Å; T158-H161 WeakPolarHBondContact O-CB 3.31Å; T158-H161 PolarHBondContact O-N 3.44Å; T158-Y162 HydrophobicContact CG2-CD2 4.18Å; T158-Y162 HydrophobicContact CG2-CE2 3.63Å; T158-Y162 WeakPolarHBondContact O-CD2 3.45Å; T158-Y162 PolarHBondContact O-N 3.45Å; T158-L375 HydrophobicContact CG2-CD1 3.95Å; T158-L375 HydrophobicContact CG2-CD2 3.96Å; T158-P490 HydrophobicContact CG2-CB 4.31Å; T158-P490 HydrophobicContact CG2-CG 3.63Å
159	S	95.8	Very high	93.7	Very high	4 Å²	4	35.4 Å²	35.4	3%	0.028	17%	0.172	C	C	.	.	H	α-helix	trans	-62.1	-41.9	176.3	-68.1	0	0	0	0	112.2	P155 L156 H161 Y162 I163 I487 F491	P155-S159 PolarHBondContact O-N 3.41Å; P155-S159 PolarHBondContact O-OG 2.96Å; L156-S159 PolarHBondContact O-N 2.91Å; S159-H161 VanDerWaalsContact C-N 3.33Å; S159-H161 PolarHBondContact O-N 2.8Å; S159-Y162 PolarHBondContact O-N 3.23Å; S159-Y162 VanDerWaalsContact O-N 3.11Å; S159-I163 WeakPolarHBondContact O-CG1 3.33Å; S159-I163 PolarHBondContact O-N 3.16Å; S159-I487 WeakPolarHBondContact CB-O 3.25Å; S159-I487 PolarHBondContact OG-O 2.97Å; S159-F491 VanDerWaalsContact OG-CE2 3.31Å; S159-F491 WeakPolarHBondContact OG-CE2 3.4Å
160	I	96.1	Very high	93.6	Very high	36 Å²	36	32 Å²	32	19%	0.185	16%	0.158	C	C	.	.	H	α-helix	trans	-66.1	-36.2	178.5	-75.7	171.9	0	0	0	111.8	L156 T157 T158 Y162 I163 G164 L209 F213	L156-I160 HydrophobicContact CD1-CD1 3.83Å; L156-I160 HydrophobicContact CD1-CG1 4.16Å; L156-I160 HydrophobicContact CG-CD1 3.92Å; L156-I160 WeakPolarHBondContact O-CG1 3.12Å; L156-I160 PolarHBondContact O-N 3.46Å; T157-I160 PolarHBondContact O-N 2.91Å; T158-I160 PolarHBondContact O-N 2.97Å; I160-Y162 VanDerWaalsContact C-N 3.32Å; I160-Y162 PolarHBondContact O-N 2.91Å; I160-I163 HydrophobicContact CG1-CD1 4.39Å; I160-I163 PolarHBondContact O-N 2.84Å; I160-G164 PolarHBondContact O-N 3.19Å; I160-L209 HydrophobicContact CB-CD1 3.75Å; I160-L209 HydrophobicContact CB-CG 4.39Å; I160-L209 HydrophobicContact CD1-CD1 3.67Å; I160-L209 HydrophobicContact CD1-CD2 3.57Å; I160-L209 HydrophobicContact CD1-CG 3.8Å; I160-L209 HydrophobicContact CG1-CD1 4.25Å; I160-L209 HydrophobicContact CG2-CD1 3.79Å; I160-L209 HydrophobicContact CG2-CG 4Å; I160-F213 HydrophobicContact CG2-CB 3.95Å; I160-F213 HydrophobicContact CG2-CD2 4.24Å
161	H	94.8	Very high	93.6	Very high	8 Å²	8	35.2 Å²	35.2	4%	0.037	17%	0.17	C	C	.	.	H	α-helix	trans	-57	-46.7	169.5	178.5	77.6	0	0	0	111.6	T157 T158 S159 I163 G164 V165 F212 G216	T157-H161 PolarHBondContact O-N 2.77Å; T158-H161 WeakPolarHBondContact O-CB 3.31Å; T158-H161 PolarHBondContact O-N 3.44Å; S159-H161 VanDerWaalsContact C-N 3.33Å; S159-H161 PolarHBondContact O-N 2.8Å; H161-I163 VanDerWaalsContact C-N 3.33Å; H161-I163 PolarHBondContact O-N 3.44Å; H161-G164 CarbonylContact O-C 3.47Å; H161-G164 WeakPolarHBondContact O-CA 3.5Å; H161-G164 PolarHBondContact O-N 3.26Å; H161-V165 WeakPolarHBondContact O-CG2 3.47Å; H161-V165 PolarHBondContact O-N 3.45Å; H161-F212 HydrophobicContact CB-CD1 3.71Å; H161-F212 HydrophobicContact CB-CD2 4.19Å; H161-F212 HydrophobicContact CB-CE1 3.52Å; H161-F212 HydrophobicContact CB-CE2 4.02Å; H161-F212 HydrophobicContact CB-CG 4.04Å; H161-F212 HydrophobicContact CB-CZ 3.68Å; H161-F212 AromaticContact CE1-CE2 3.55Å; H161-F212 AromaticContact CG-CD2 3.95Å; H161-F212 AromaticContact CG-CE1 3.96Å; H161-F212 AromaticContact CG-CE2 3.55Å; H161-F212 AromaticContact CG-CZ 3.55Å; H161-F212 AromaticContact ND1-CD2 3.27Å; H161-F212 VanDerWaalsContact ND1-CD2 3.27Å; H161-F212 WeakPolarHBondContact ND1-CD2 3.43Å; H161-F212 AromaticContact ND1-CE2 3.09Å; H161-F212 WeakPolarHBondContact ND1-CE2 3.36Å; H161-F212 AromaticContact ND1-CG 3.93Å; H161-F212 AromaticContact ND1-CZ 3.63Å; H161-F212 PolarHBondContact ND1-O 3.41Å; H161-G216 WeakPolarHBondContact CE1-CA 3.3Å; H161-G216 PolarHBondContact CE1-N 3.32Å; H161-G216 VanDerWaalsContact ND1-CA 3.34Å; H161-G216 WeakPolarHBondContact ND1-CA 3.49Å; H161-G216 PolarHBondContact ND1-N 3.43Å
162	Y	94.6	Very high	93.7	Very high	3 Å²	3	33.4 Å²	33.4	1%	0.012	16%	0.162	C	C	.	.	H	α-helix	trans	-67.9	-28.6	177.2	-67.6	-49.3	0	0	0	114	T158 S159 I160 G164 V165 L166 F371 T486 P490	T158-Y162 HydrophobicContact CG2-CD2 4.18Å; T158-Y162 HydrophobicContact CG2-CE2 3.63Å; T158-Y162 WeakPolarHBondContact O-CD2 3.45Å; T158-Y162 PolarHBondContact O-N 3.45Å; S159-Y162 PolarHBondContact O-N 3.23Å; S159-Y162 VanDerWaalsContact O-N 3.11Å; I160-Y162 VanDerWaalsContact C-N 3.32Å; I160-Y162 PolarHBondContact O-N 2.91Å; Y162-G164 VanDerWaalsContact C-N 3.34Å; Y162-V165 HydrophobicContact CD1-CG2 4.43Å; Y162-V165 WeakPolarHBondContact O-CB 3.47Å; Y162-V165 PolarHBondContact O-N 3.39Å; Y162-L166 PolarHBondContact O-N 3.12Å; Y162-F371 HydrophobicContact CE1-CD1 4.08Å; Y162-F371 HydrophobicContact CE1-CE1 4.05Å; Y162-F371 AromaticContact CZ-CD1 3.75Å; Y162-F371 WeakPolarHBondContact OH-CD1 3.26Å; Y162-T486 WeakPolarHBondContact CD2-O 3.49Å; Y162-P490 HydrophobicContact CD2-CG 4.46Å; Y162-P490 HydrophobicContact CE2-CG 4.33Å
163	I	95.8	Very high	93.4	Very high	55 Å²	55	29.6 Å²	29.6	28%	0.282	15%	0.154	S	C	.	.	H	α-helix	trans	-64.5	-43.1	168.4	-63.1	170.4	0	0	0	109.6	S159 I160 H161 V165 L166 F167 F213 I487	S159-I163 WeakPolarHBondContact O-CG1 3.33Å; S159-I163 PolarHBondContact O-N 3.16Å; I160-I163 HydrophobicContact CG1-CD1 4.39Å; I160-I163 PolarHBondContact O-N 2.84Å; H161-I163 VanDerWaalsContact C-N 3.33Å; H161-I163 PolarHBondContact O-N 3.44Å; I163-V165 VanDerWaalsContact C-N 3.31Å; I163-V165 PolarHBondContact O-N 3.36Å; I163-L166 WeakPolarHBondContact O-CB 3.15Å; I163-L166 PolarHBondContact O-N 3.3Å; I163-F167 HydrophobicContact CG2-CD2 3.79Å; I163-F167 HydrophobicContact CG2-CE2 3.62Å; I163-F167 VanDerWaalsContact O-CD2 3.31Å; I163-F167 WeakPolarHBondContact O-CD2 3.38Å; I163-F167 PolarHBondContact O-N 3.11Å; I163-F167 VanDerWaalsContact O-N 3.11Å; I163-F213 HydrophobicContact CG2-CE2 4.03Å; I163-I487 HydrophobicContact CD1-CG2 4.34Å; I163-I487 HydrophobicContact CG1-CD1 3.8Å; I163-I487 HydrophobicContact CG1-CG1 3.97Å; I163-I487 HydrophobicContact CG1-CG2 3.96Å
164	G	95.1	Very high	93	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-56	-45	171.9	0	0	0	0	0	112.2	I160 H161 Y162 L166 F167 G168 F213 A217	I160-G164 PolarHBondContact O-N 3.19Å; H161-G164 CarbonylContact O-C 3.47Å; H161-G164 WeakPolarHBondContact O-CA 3.5Å; H161-G164 PolarHBondContact O-N 3.26Å; Y162-G164 VanDerWaalsContact C-N 3.34Å; G164-L166 PolarHBondContact O-N 3.02Å; G164-F167 PolarHBondContact O-N 3Å; G164-G168 PolarHBondContact O-N 3.27Å; G164-F213 VanDerWaalsContact CA-CD2 3.4Å; G164-F213 WeakPolarHBondContact CA-O 3.35Å; G164-A217 VanDerWaalsContact O-CA 3.25Å; G164-A217 WeakPolarHBondContact O-CA 3.26Å; G164-A217 WeakPolarHBondContact O-CB 3.46Å
165	V	93.4	Very high	93	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-58.3	-45.6	174.5	170	0	0	0	0	112.3	H161 Y162 I163 G168 V169 G216 Y220	H161-V165 WeakPolarHBondContact O-CG2 3.47Å; H161-V165 PolarHBondContact O-N 3.45Å; Y162-V165 HydrophobicContact CD1-CG2 4.43Å; Y162-V165 WeakPolarHBondContact O-CB 3.47Å; Y162-V165 PolarHBondContact O-N 3.39Å; I163-V165 VanDerWaalsContact C-N 3.31Å; I163-V165 PolarHBondContact O-N 3.36Å; V165-G168 PolarHBondContact O-N 2.98Å; V165-V169 HydrophobicContact CG1-CG2 4.41Å; V165-V169 WeakPolarHBondContact O-CG2 3.25Å; V165-V169 PolarHBondContact O-N 3.17Å; V165-G216 WeakPolarHBondContact CG2-O 3.27Å; V165-Y220 HydrophobicContact CB-CD2 4.19Å; V165-Y220 HydrophobicContact CB-CG 4.47Å; V165-Y220 HydrophobicContact CG1-CD1 4.35Å; V165-Y220 HydrophobicContact CG1-CD2 3.78Å; V165-Y220 HydrophobicContact CG1-CG 3.62Å; V165-Y220 HydrophobicContact CG2-CD2 3.3Å; V165-Y220 HydrophobicContact CG2-CE2 3.93Å; V165-Y220 HydrophobicContact CG2-CG 4.01Å
166	L	93.1	Very high	93	Very high	27 Å²	27	35.3 Å²	35.3	14%	0.141	18%	0.181	C	C	.	.	H	α-helix	trans	-58.2	-52.9	178.9	171.5	62.4	0	0	0	111.1	Y162 I163 G164 L170 T480 R483 I487	Y162-L166 PolarHBondContact O-N 3.12Å; I163-L166 WeakPolarHBondContact O-CB 3.15Å; I163-L166 PolarHBondContact O-N 3.3Å; G164-L166 PolarHBondContact O-N 3.02Å; L166-L170 HydrophobicContact CD1-CD1 3.9Å; L166-L170 HydrophobicContact CD1-CG 4.39Å; L166-L170 HydrophobicContact CG-CD1 4.21Å; L166-L170 VanDerWaalsContact O-CG 3.26Å; L166-L170 WeakPolarHBondContact O-CG 3.29Å; L166-L170 PolarHBondContact O-N 3.35Å; L166-T480 HydrophobicContact CD1-CG2 4.16Å; L166-R483 HydrophobicContact CB-CB 4.37Å; L166-R483 HydrophobicContact CD1-CB 3.88Å; L166-R483 HydrophobicContact CD1-CG 4.12Å; L166-I487 HydrophobicContact CD2-CD1 4.16Å
167	F	93.3	Very high	92.6	Very high	91 Å²	91	37.1 Å²	37.1	40%	0.399	19%	0.191	S	C	.	.	H	α-helix	trans	-67.2	-41.1	179.4	-74.9	-68.7	0	0	0	112.1	I163 G164 V169 L170 F171 F213	I163-F167 HydrophobicContact CG2-CD2 3.79Å; I163-F167 HydrophobicContact CG2-CE2 3.62Å; I163-F167 VanDerWaalsContact O-CD2 3.31Å; I163-F167 WeakPolarHBondContact O-CD2 3.38Å; I163-F167 PolarHBondContact O-N 3.11Å; I163-F167 VanDerWaalsContact O-N 3.11Å; G164-F167 PolarHBondContact O-N 3Å; F167-V169 PolarHBondContact O-N 2.91Å; F167-L170 PolarHBondContact O-N 3.24Å; F167-F171 HydrophobicContact CB-CD2 4.14Å; F167-F171 HydrophobicContact CB-CE2 4.08Å; F167-F171 AromaticContact CD1-CE2 3.74Å; F167-F171 HydrophobicContact CD1-CE2 3.74Å; F167-F171 HydrophobicContact CD1-CZ 4.47Å; F167-F171 HydrophobicContact CG-CE2 4.34Å; F167-F171 WeakPolarHBondContact O-CD2 3.31Å; F167-F171 PolarHBondContact O-N 2.83Å; F167-F213 HydrophobicContact CD2-CE2 4.24Å; F167-F213 HydrophobicContact CD2-CZ 4.25Å
168	G	92.9	Very high	92.2	Very high	7 Å²	7	45.7 Å²	45.7	7%	0.072	22%	0.224	C	C	.	.	H	α-helix	trans	-51.9	-56.8	176.7	0	0	0	0	0	111.6	G164 V165 L170 F171 S172 A217 S221	G164-G168 PolarHBondContact O-N 3.27Å; V165-G168 PolarHBondContact O-N 2.98Å; G168-L170 VanDerWaalsContact C-N 3.33Å; G168-L170 PolarHBondContact O-N 3.4Å; G168-F171 PolarHBondContact O-N 3.45Å; G168-S172 WeakPolarHBondContact O-CB 3.36Å; G168-S172 PolarHBondContact O-N 2.98Å; G168-S172 PolarHBondContact O-OG 3.05Å; G168-A217 WeakPolarHBondContact CA-O 3.47Å; G168-S221 WeakPolarHBondContact CA-OG 3.35Å; G168-S221 PolarHBondContact O-OG 2.9Å
169	V	90.6	Very high	92.2	Very high	29 Å²	29	50.6 Å²	50.6	18%	0.176	24%	0.244	C	C	.	.	H	α-helix	trans	-63.7	-39.1	-176.9	173.4	0	0	0	0	111.7	V165 F167 G173 S221 V224	V165-V169 HydrophobicContact CG1-CG2 4.41Å; V165-V169 WeakPolarHBondContact O-CG2 3.25Å; V165-V169 PolarHBondContact O-N 3.17Å; F167-V169 PolarHBondContact O-N 2.91Å; V169-G173 PolarHBondContact O-N 3.13Å; V169-S221 PolarHBondContact N-OG 3.42Å; V169-V224 HydrophobicContact CG1-CG2 4.22Å; V169-V224 HydrophobicContact CG2-CG2 4.26Å
170	L	88.9	Confident	92	Very high	79 Å²	79	50.4 Å²	50.4	41%	0.414	24%	0.243	S	C	.	.	H	α-helix	trans	-63.2	-48.5	178.2	-73.1	172.5	0	0	0	112	L166 F167 G168 Q174	L166-L170 HydrophobicContact CD1-CD1 3.9Å; L166-L170 HydrophobicContact CD1-CG 4.39Å; L166-L170 HydrophobicContact CG-CD1 4.21Å; L166-L170 VanDerWaalsContact O-CG 3.26Å; L166-L170 WeakPolarHBondContact O-CG 3.29Å; L166-L170 PolarHBondContact O-N 3.35Å; F167-L170 PolarHBondContact O-N 3.24Å; G168-L170 VanDerWaalsContact C-N 3.33Å; G168-L170 PolarHBondContact O-N 3.4Å; L170-Q174 WeakPolarHBondContact O-CG 3.44Å
171	F	91.6	Very high	91.9	Very high	121 Å²	121	49.6 Å²	49.6	53%	0.531	24%	0.238	S	C	.	.	H	α-helix	trans	-74.8	-45.4	-179.3	-70.2	-62	0	0	0	111.9	F167 G168 G173 Q174 L175	F167-F171 HydrophobicContact CB-CD2 4.14Å; F167-F171 HydrophobicContact CB-CE2 4.08Å; F167-F171 AromaticContact CD1-CE2 3.74Å; F167-F171 HydrophobicContact CD1-CE2 3.74Å; F167-F171 HydrophobicContact CD1-CZ 4.47Å; F167-F171 HydrophobicContact CG-CE2 4.34Å; F167-F171 WeakPolarHBondContact O-CD2 3.31Å; F167-F171 PolarHBondContact O-N 2.83Å; G168-F171 PolarHBondContact O-N 3.45Å; F171-G173 VanDerWaalsContact C-N 3.28Å; F171-G173 PolarHBondContact O-N 3.09Å; F171-Q174 PolarHBondContact O-N 3.32Å; F171-L175 WeakPolarHBondContact O-CB 3.41Å; F171-L175 VanDerWaalsContact O-CG 3.24Å; F171-L175 WeakPolarHBondContact O-CG 3.44Å; F171-L175 PolarHBondContact O-N 2.87Å
172	S	92.3	Very high	91.9	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-63.8	-34.5	-178.1	78	0	0	0	0	111.9	G168 S176 S221	G168-S172 WeakPolarHBondContact O-CB 3.36Å; G168-S172 PolarHBondContact O-N 2.98Å; G168-S172 PolarHBondContact O-OG 3.05Å; S172-S176 WeakPolarHBondContact O-CB 3.37Å; S172-S176 PolarHBondContact O-N 3.28Å; S172-S221 WeakPolarHBondContact OG-CB 3.27Å; S172-S221 PolarHBondContact OG-OG 3.34Å
173	G	86.6	Confident	92	Very high	24 Å²	24	53.1 Å²	53.1	25%	0.247	26%	0.258	C	S	.	.	H	α-helix	trans	-60.6	-52	174.5	0	0	0	0	0	111.7	V169 F171 L175 S176 D177	V169-G173 PolarHBondContact O-N 3.13Å; F171-G173 VanDerWaalsContact C-N 3.28Å; F171-G173 PolarHBondContact O-N 3.09Å; G173-L175 PolarHBondContact O-N 3.31Å; G173-S176 WeakPolarHBondContact O-CB 3.28Å; G173-S176 PolarHBondContact O-N 3.47Å; G173-D177 PolarHBondContact O-N 3.27Å
174	Q	88.1	Confident	92	Very high	134 Å²	134	51.3 Å²	51.3	63%	0.626	25%	0.249	S	C	*	.	H	α-helix	trans	-63.7	-40.7	177.9	-65.8	-178.7	4.6	0	0	112.6	L170 F171 S176 D177 R178	L170-Q174 WeakPolarHBondContact O-CG 3.44Å; F171-Q174 PolarHBondContact O-N 3.32Å; Q174-S176 VanDerWaalsContact C-N 3.34Å; Q174-D177 PolarHBondContact O-N 3.03Å; Q174-R178 WeakPolarHBondContact O-CB 3.49Å; Q174-R178 PolarHBondContact O-N 2.99Å; Q174-R178 VanDerWaalsContact O-N 3.13Å
175	L	91.9	Very high	92	Very high	65 Å²	65	51.3 Å²	51.3	34%	0.34	25%	0.249	S	C	.	.	H	α-helix	trans	-64.2	-41.9	176	-70.1	173.5	0	0	0	111	F171 G173 D177 R178 F179 I184	F171-L175 WeakPolarHBondContact O-CB 3.41Å; F171-L175 VanDerWaalsContact O-CG 3.24Å; F171-L175 WeakPolarHBondContact O-CG 3.44Å; F171-L175 PolarHBondContact O-N 2.87Å; G173-L175 PolarHBondContact O-N 3.31Å; L175-D177 VanDerWaalsContact C-N 3.34Å; L175-R178 PolarHBondContact O-N 3.31Å; L175-R178 VanDerWaalsContact O-N 3.15Å; L175-F179 HydrophobicContact CB-CD2 4.34Å; L175-F179 HydrophobicContact CD2-CD2 3.82Å; L175-F179 HydrophobicContact CD2-CE2 3.56Å; L175-F179 WeakPolarHBondContact O-CB 3.31Å; L175-F179 WeakPolarHBondContact O-CD2 3.43Å; L175-F179 PolarHBondContact O-N 3.23Å; L175-I184 HydrophobicContact CB-CD1 4.11Å; L175-I184 HydrophobicContact CB-CG1 4.25Å; L175-I184 HydrophobicContact CB-CG2 4.24Å
176	S	92.6	Very high	92.1	Very high	2 Å²	2	52.5 Å²	52.5	1%	0.014	25%	0.254	C	S	.	.	H	α-helix	trans	-63.6	-39.4	177.6	178.6	0	0	0	0	111.7	S172 G173 Q174 R178 G180 R181	S172-S176 WeakPolarHBondContact O-CB 3.37Å; S172-S176 PolarHBondContact O-N 3.28Å; G173-S176 WeakPolarHBondContact O-CB 3.28Å; G173-S176 PolarHBondContact O-N 3.47Å; Q174-S176 VanDerWaalsContact C-N 3.34Å; S176-R178 VanDerWaalsContact C-N 3.28Å; S176-R178 PolarHBondContact O-N 3.16Å; S176-G180 CarbonylContact O-C 3.35Å; S176-G180 VanDerWaalsContact O-C 3.24Å; S176-G180 WeakPolarHBondContact O-CA 3.41Å; S176-G180 PolarHBondContact O-N 3.12Å; S176-G180 VanDerWaalsContact O-N 3.11Å; S176-R181 PolarHBondContact O-NH1 3.32Å; S176-R181 WeakPolarHBondContact OG-CD 3.47Å; S176-R181 PolarHBondContact OG-NH1 3.47Å
177	D	87.8	Confident	92.3	Very high	86 Å²	86	54.8 Å²	54.8	46%	0.46	27%	0.269	S	S	.	.	H	α-helix	trans	-65.6	-30.8	174.3	-72.8	-29.1	0	0	0	112.4	G173 Q174 L175 R181 W295	G173-D177 PolarHBondContact O-N 3.27Å; Q174-D177 PolarHBondContact O-N 3.03Å; L175-D177 VanDerWaalsContact C-N 3.34Å; D177-R181 VanDerWaalsContact N-NH1 3.12Å; D177-R181 IonicContact OD1-CZ 3.98Å; D177-R181 IonicContact OD1-NH1 3.12Å; D177-R181 PolarHBondContact OD1-NH1 2.99Å; D177-R181 IonicContact OD1-NH2 3.14Å; D177-R181 PolarHBondContact OD1-NH2 3.17Å; D177-W295 PolarHBondContact O-NE1 2.92Å
178	R	88.1	Confident	92.4	Very high	181 Å²	181	51.6 Å²	51.6	68%	0.683	26%	0.256	S	S	*	.	H	α-helix	trans	-90.6	-42.3	-175.9	-174.2	174.1	-177.2	172.3	0.5	114	Q174 L175 S176	Q174-R178 WeakPolarHBondContact O-CB 3.49Å; Q174-R178 PolarHBondContact O-N 2.99Å; Q174-R178 VanDerWaalsContact O-N 3.13Å; L175-R178 PolarHBondContact O-N 3.31Å; L175-R178 VanDerWaalsContact O-N 3.15Å; S176-R178 VanDerWaalsContact C-N 3.28Å; S176-R178 PolarHBondContact O-N 3.16Å
179	F	92	Very high	92.5	Very high	111 Å²	111	51.4 Å²	51.4	49%	0.487	25%	0.253	S	S	.	.	H	α-helix	trans	-107	-11.5	-170.2	-65	-69	0	0	0	113.7	L175 I184	L175-F179 HydrophobicContact CB-CD2 4.34Å; L175-F179 HydrophobicContact CD2-CD2 3.82Å; L175-F179 HydrophobicContact CD2-CE2 3.56Å; L175-F179 WeakPolarHBondContact O-CB 3.31Å; L175-F179 WeakPolarHBondContact O-CD2 3.43Å; L175-F179 PolarHBondContact O-N 3.23Å; F179-I184 HydrophobicContact CB-CD1 4.04Å; F179-I184 HydrophobicContact CB-CG1 4.15Å; F179-I184 HydrophobicContact CD2-CD1 4.47Å
180	G	91.8	Very high	92.8	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	26%	0.264	C	S	.	.			trans	115.4	153.2	179.7	0	0	0	0	0	112.4	S176 I184 E291 W295	S176-G180 CarbonylContact O-C 3.35Å; S176-G180 VanDerWaalsContact O-C 3.24Å; S176-G180 WeakPolarHBondContact O-CA 3.41Å; S176-G180 PolarHBondContact O-N 3.12Å; S176-G180 VanDerWaalsContact O-N 3.11Å; G180-I184 WeakPolarHBondContact O-CG1 3.23Å; G180-E291 WeakPolarHBondContact CA-OE2 3.47Å; G180-W295 VanDerWaalsContact CA-CH2 3.5Å; G180-W295 VanDerWaalsContact CA-CZ2 3.45Å
181	R	93.9	Very high	93.1	Very high	18 Å²	18	51 Å²	51	7%	0.068	26%	0.258	C	S	.	.	H	α-helix	trans	-70.4	-46.9	-178.7	-51.8	-55.8	-174.9	-153.6	0.1	110.7	S176 D177 L185 I225 L229 E232 E291	S176-R181 PolarHBondContact O-NH1 3.32Å; S176-R181 WeakPolarHBondContact OG-CD 3.47Å; S176-R181 PolarHBondContact OG-NH1 3.47Å; D177-R181 VanDerWaalsContact N-NH1 3.12Å; D177-R181 IonicContact OD1-CZ 3.98Å; D177-R181 IonicContact OD1-NH1 3.12Å; D177-R181 PolarHBondContact OD1-NH1 2.99Å; D177-R181 IonicContact OD1-NH2 3.14Å; D177-R181 PolarHBondContact OD1-NH2 3.17Å; R181-L185 WeakPolarHBondContact O-CB 3.48Å; R181-L185 PolarHBondContact O-N 2.78Å; R181-I225 HydrophobicContact CB-CG2 4.3Å; R181-I225 WeakPolarHBondContact O-CG2 3.19Å; R181-L229 HydrophobicContact CB-CB 4.13Å; R181-L229 HydrophobicContact CB-CD1 3.84Å; R181-L229 HydrophobicContact CB-CD2 4.29Å; R181-L229 HydrophobicContact CB-CG 4.31Å; R181-L229 HydrophobicContact CG-CD1 4.15Å; R181-E232 IonicContact CZ-OE1 2.83Å; R181-E232 IonicContact NE-OE1 3.18Å; R181-E232 PolarHBondContact NE-OE1 3.27Å; R181-E232 VanDerWaalsContact NE-OE1 3.14Å; R181-E232 IonicContact NE-OE2 2.68Å; R181-E232 PolarHBondContact NE-OE2 2.98Å; R181-E232 IonicContact NH2-OE1 3.21Å; R181-E232 PolarHBondContact NH2-OE1 3.27Å; R181-E291 WeakPolarHBondContact CA-OE1 3.04Å; R181-E291 WeakPolarHBondContact CB-OE1 3.34Å; R181-E291 PolarHBondContact N-OE1 2.92Å; R181-E291 PolarHBondContact N-OE2 3.39Å; R181-E291 VanDerWaalsContact N-OE2 3.14Å
182	K	95.2	Very high	93.2	Very high	35 Å²	35	45.3 Å²	45.3	15%	0.152	23%	0.234	C	C	.	.	H	α-helix	trans	-65	-54.4	-173.8	171.1	-179.1	-178.3	163.8	0	112	I184 L185 F186 W286 I289 E291	K182-I184 VanDerWaalsContact C-N 3.35Å; K182-I184 PolarHBondContact O-N 2.86Å; K182-L185 WeakPolarHBondContact O-CB 3.4Å; K182-L185 PolarHBondContact O-N 3.24Å; K182-F186 HydrophobicContact CG-CD2 4.02Å; K182-F186 HydrophobicContact CG-CE2 4Å; K182-F186 VanDerWaalsContact O-CD2 3.27Å; K182-F186 WeakPolarHBondContact O-CD2 3.29Å; K182-F186 PolarHBondContact O-N 3.14Å; K182-W286 WeakPolarHBondContact CE-O 3.45Å; K182-W286 HydrophobicContact CG-CZ3 4.27Å; K182-W286 PolarHBondContact NZ-O 3.46Å; K182-I289 VanDerWaalsContact CD-O 3.31Å; K182-I289 WeakPolarHBondContact CD-O 3.5Å; K182-I289 VanDerWaalsContact CE-O 3.22Å; K182-I289 WeakPolarHBondContact CE-O 3.08Å; K182-I289 PolarHBondContact NZ-O 3.07Å; K182-E291 HydrophobicContact CB-CB 4.31Å; K182-E291 WeakPolarHBondContact CB-OE2 3.3Å; K182-E291 PolarHBondContact N-OE1 3.42Å; K182-E291 VanDerWaalsContact N-OE1 3.15Å; K182-E291 PolarHBondContact N-OE2 2.71Å
183	P	96.1	Very high	93.3	Very high	50 Å²	50	46.7 Å²	46.7	33%	0.325	24%	0.242	S	C	.	.	H	α-helix	trans	-56.9	-47.2	-178.6	-25.1	33.2	0	0	0	112.6	L185 F186 V187 E291	P183-L185 VanDerWaalsContact C-N 3.35Å; P183-L185 PolarHBondContact O-N 3.01Å; P183-F186 PolarHBondContact O-N 3.26Å; P183-V187 VanDerWaalsContact O-CG2 3.32Å; P183-V187 WeakPolarHBondContact O-CG2 3.06Å; P183-V187 PolarHBondContact O-N 3.4Å; P183-E291 WeakPolarHBondContact CD-OE2 3.43Å
184	I	96.4	Very high	93.8	Very high	17 Å²	17	50.3 Å²	50.3	9%	0.087	26%	0.259	C	S	.	.	H	α-helix	trans	-69.7	-34	-177.1	-56.1	-57.7	0	0	0	111.3	L175 F179 G180 K182 F186 V187 M188 I225	L175-I184 HydrophobicContact CB-CD1 4.11Å; L175-I184 HydrophobicContact CB-CG1 4.25Å; L175-I184 HydrophobicContact CB-CG2 4.24Å; F179-I184 HydrophobicContact CB-CD1 4.04Å; F179-I184 HydrophobicContact CB-CG1 4.15Å; F179-I184 HydrophobicContact CD2-CD1 4.47Å; G180-I184 WeakPolarHBondContact O-CG1 3.23Å; K182-I184 VanDerWaalsContact C-N 3.35Å; K182-I184 PolarHBondContact O-N 2.86Å; I184-F186 PolarHBondContact O-N 3.36Å; I184-V187 PolarHBondContact O-N 3.42Å; I184-M188 HydrophobicContact CG2-CE 4.22Å; I184-M188 HydrophobicContact CG2-CG 4.24Å; I184-M188 WeakPolarHBondContact O-CB 3.37Å; I184-M188 VanDerWaalsContact O-CG 3.25Å; I184-M188 WeakPolarHBondContact O-CG 3.46Å; I184-M188 PolarHBondContact O-N 3.37Å; I184-I225 HydrophobicContact CB-CD1 4.31Å; I184-I225 HydrophobicContact CG2-CD1 3.63Å
185	L	95.5	Very high	94.1	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-54.4	-52.3	171.7	-179	65.4	0	0	0	111.4	R181 K182 P183 M188 M189 N222 I225 A226 L229 I289	R181-L185 WeakPolarHBondContact O-CB 3.48Å; R181-L185 PolarHBondContact O-N 2.78Å; K182-L185 WeakPolarHBondContact O-CB 3.4Å; K182-L185 PolarHBondContact O-N 3.24Å; P183-L185 VanDerWaalsContact C-N 3.35Å; P183-L185 PolarHBondContact O-N 3.01Å; L185-M188 PolarHBondContact O-N 2.96Å; L185-M189 HydrophobicContact CD1-CE 3.68Å; L185-M189 HydrophobicContact CD2-CE 4.07Å; L185-M189 HydrophobicContact CG-CE 3.66Å; L185-M189 HydrophobicContact CG-SD 4.18Å; L185-M189 WeakPolarHBondContact O-CG 3.4Å; L185-M189 PolarHBondContact O-N 3.12Å; L185-N222 HydrophobicContact CD1-CB 3.96Å; L185-N222 WeakPolarHBondContact CD1-O 3.42Å; L185-I225 HydrophobicContact CB-CG2 3.79Å; L185-I225 HydrophobicContact CD1-CB 4.01Å; L185-I225 HydrophobicContact CD1-CG2 4.07Å; L185-I225 HydrophobicContact CG-CG2 4.48Å; L185-A226 HydrophobicContact CD1-CB 3.98Å; L185-L229 HydrophobicContact CD2-CD2 4.16Å; L185-I289 HydrophobicContact CD2-CD1 4.4Å
186	F	96.5	Very high	94.3	Very high	26 Å²	26	41.2 Å²	41.2	11%	0.114	22%	0.217	C	C	.	.	H	α-helix	trans	-72.6	-31.7	-177.9	-76.3	-81.2	0	0	0	113.3	K182 P183 I184 M189 A190 Y282 L285 W286 I289	K182-F186 HydrophobicContact CG-CD2 4.02Å; K182-F186 HydrophobicContact CG-CE2 4Å; K182-F186 VanDerWaalsContact O-CD2 3.27Å; K182-F186 WeakPolarHBondContact O-CD2 3.29Å; K182-F186 PolarHBondContact O-N 3.14Å; P183-F186 PolarHBondContact O-N 3.26Å; I184-F186 PolarHBondContact O-N 3.36Å; F186-M189 HydrophobicContact CD1-SD 3.92Å; F186-M189 HydrophobicContact CE1-SD 4.07Å; F186-M189 HydrophobicContact CG-SD 4.46Å; F186-M189 PolarHBondContact O-N 3.31Å; F186-A190 WeakPolarHBondContact O-CB 3.48Å; F186-A190 PolarHBondContact O-N 3.03Å; F186-Y282 WeakPolarHBondContact CE1-O 3.35Å; F186-L285 HydrophobicContact CE1-CB 4.11Å; F186-L285 VanDerWaalsContact CZ-C 3.47Å; F186-L285 HydrophobicContact CZ-CB 4.02Å; F186-W286 HydrophobicContact CB-CE3 3.93Å; F186-W286 HydrophobicContact CB-CZ3 3.85Å; F186-W286 AromaticContact CD1-CE3 3.91Å; F186-W286 HydrophobicContact CD1-CE3 3.91Å; F186-W286 HydrophobicContact CD2-CD2 4.43Å; F186-W286 AromaticContact CD2-CE3 3.25Å; F186-W286 HydrophobicContact CD2-CE3 3.25Å; F186-W286 AromaticContact CD2-CZ3 3.51Å; F186-W286 HydrophobicContact CD2-CZ3 3.51Å; F186-W286 HydrophobicContact CE1-CB 4.02Å; F186-W286 HydrophobicContact CE1-CE3 4.27Å; F186-W286 AromaticContact CE2-CE3 3.68Å; F186-W286 HydrophobicContact CE2-CE3 3.68Å; F186-W286 HydrophobicContact CE2-CZ3 4.27Å; F186-W286 AromaticContact CG-CE3 3.41Å; F186-W286 HydrophobicContact CG-CE3 3.41Å; F186-W286 VanDerWaalsContact CG-CE3 3.41Å; F186-W286 AromaticContact CG-CZ3 3.76Å; F186-W286 HydrophobicContact CG-CZ3 3.76Å; F186-W286 HydrophobicContact CZ-CB 4.08Å; F186-W286 HydrophobicContact CZ-CE3 4.19Å; F186-W286 VanDerWaalsContact CZ-N 3.29Å; F186-I289 HydrophobicContact CZ-CD1 4.21Å
187	V	96.4	Very high	94.4	Very high	74 Å²	74	43.9 Å²	43.9	45%	0.448	23%	0.233	S	C	.	.	H	α-helix	trans	-60.6	-47	170.3	168.7	0	0	0	0	110.3	P183 I184 M189 A190 V191	P183-V187 VanDerWaalsContact O-CG2 3.32Å; P183-V187 WeakPolarHBondContact O-CG2 3.06Å; P183-V187 PolarHBondContact O-N 3.4Å; I184-V187 PolarHBondContact O-N 3.42Å; V187-M189 PolarHBondContact O-N 3.22Å; V187-A190 PolarHBondContact O-N 3.49Å; V187-V191 HydrophobicContact CG1-CG2 4.47Å; V187-V191 VanDerWaalsContact O-CG2 3.31Å; V187-V191 WeakPolarHBondContact O-CG2 3.31Å; V187-V191 PolarHBondContact O-N 2.93Å
188	M	95.6	Very high	94.8	Very high	25 Å²	25	41.8 Å²	41.8	12%	0.123	23%	0.228	C	C	.	.	H	α-helix	trans	-68.4	-34.8	-179.8	-65.8	-61.5	150.5	0	0	112.5	I184 L185 V191 Q192 N222 I225	I184-M188 HydrophobicContact CG2-CE 4.22Å; I184-M188 HydrophobicContact CG2-CG 4.24Å; I184-M188 WeakPolarHBondContact O-CB 3.37Å; I184-M188 VanDerWaalsContact O-CG 3.25Å; I184-M188 WeakPolarHBondContact O-CG 3.46Å; I184-M188 PolarHBondContact O-N 3.37Å; L185-M188 PolarHBondContact O-N 2.96Å; M188-V191 PolarHBondContact O-N 3.34Å; M188-Q192 PolarHBondContact O-N 2.92Å; M188-N222 HydrophobicContact CB-CB 3.88Å; M188-I225 HydrophobicContact CG-CD1 4.24Å
189	M	95.3	Very high	95.2	Very high	2 Å²	2	33.2 Å²	33.2	1%	0.01	20%	0.195	C	C	.	.	H	α-helix	trans	-61.1	-46	169.2	-74.1	170.1	176.6	0	0	111.8	L185 F186 V187 Q192 T193 N222 Y282	L185-M189 HydrophobicContact CD1-CE 3.68Å; L185-M189 HydrophobicContact CD2-CE 4.07Å; L185-M189 HydrophobicContact CG-CE 3.66Å; L185-M189 HydrophobicContact CG-SD 4.18Å; L185-M189 WeakPolarHBondContact O-CG 3.4Å; L185-M189 PolarHBondContact O-N 3.12Å; F186-M189 HydrophobicContact CD1-SD 3.92Å; F186-M189 HydrophobicContact CE1-SD 4.07Å; F186-M189 HydrophobicContact CG-SD 4.46Å; F186-M189 PolarHBondContact O-N 3.31Å; V187-M189 PolarHBondContact O-N 3.22Å; M189-Q192 PolarHBondContact O-N 3.42Å; M189-T193 PolarHBondContact O-N 3.33Å; M189-T193 PolarHBondContact O-OG1 2.99Å; M189-T193 VanDerWaalsContact O-OG1 3.12Å; M189-N222 HydrophobicContact CG-CB 3.97Å; M189-Y282 HydrophobicContact CB-CD2 3.63Å; M189-Y282 HydrophobicContact CB-CE2 3.85Å; M189-Y282 HydrophobicContact CB-CG 4Å; M189-Y282 HydrophobicContact CE-CD1 4.01Å; M189-Y282 HydrophobicContact CE-CE1 3.98Å; M189-Y282 HydrophobicContact CG-CD1 4.06Å; M189-Y282 HydrophobicContact CG-CD2 3.94Å; M189-Y282 HydrophobicContact CG-CE1 4.05Å; M189-Y282 HydrophobicContact CG-CE2 3.91Å; M189-Y282 HydrophobicContact CG-CG 3.99Å; M189-Y282 HydrophobicContact SD-CD1 3.66Å; M189-Y282 HydrophobicContact SD-CD2 4.37Å; M189-Y282 HydrophobicContact SD-CE1 4.07Å; M189-Y282 HydrophobicContact SD-CG 3.81Å
190	A	95.5	Very high	95.3	Very high	50 Å²	50	28.6 Å²	28.6	41%	0.413	18%	0.176	S	C	.	.	H	α-helix	trans	-63.1	-43.4	177.3	0	0	0	0	0	111.6	F186 V187 Q192 T193 V194	F186-A190 WeakPolarHBondContact O-CB 3.48Å; F186-A190 PolarHBondContact O-N 3.03Å; V187-A190 PolarHBondContact O-N 3.49Å; A190-Q192 VanDerWaalsContact C-N 3.31Å; A190-Q192 PolarHBondContact O-N 2.88Å; A190-T193 PolarHBondContact O-N 3.49Å; A190-V194 VanDerWaalsContact O-CB 3.29Å; A190-V194 WeakPolarHBondContact O-CB 3.34Å; A190-V194 VanDerWaalsContact O-CG2 3.27Å; A190-V194 WeakPolarHBondContact O-CG2 3.46Å; A190-V194 PolarHBondContact O-N 3.04Å
191	V	95.7	Very high	95.5	Very high	49 Å²	49	36 Å²	36	30%	0.297	21%	0.208	S	C	.	.	H	α-helix	trans	-57.5	-44.3	174.8	169.5	0	0	0	0	111	V187 M188 G195 I214	V187-V191 HydrophobicContact CG1-CG2 4.47Å; V187-V191 VanDerWaalsContact O-CG2 3.31Å; V187-V191 WeakPolarHBondContact O-CG2 3.31Å; V187-V191 PolarHBondContact O-N 2.93Å; M188-V191 PolarHBondContact O-N 3.34Å; V191-G195 WeakPolarHBondContact O-CA 3.43Å; V191-G195 PolarHBondContact O-N 3.26Å; V191-I214 HydrophobicContact CG1-CG2 3.63Å
192	Q	94.4	Very high	95.6	Very high	2 Å²	2	35.1 Å²	35.1	1%	0.009	21%	0.205	C	C	.	.	H	α-helix	trans	-63.5	-50.7	176.4	-178.4	-176.8	35	0	0	112	N44 T47 M188 M189 A190 G195 L196 G219 N222 Y282	N44-Q192 PolarHBondContact OD1-NE2 3.41Å; N44-Q192 VanDerWaalsContact OD1-NE2 3.15Å; T47-Q192 PolarHBondContact OG1-NE2 3.49Å; M188-Q192 PolarHBondContact O-N 2.92Å; M189-Q192 PolarHBondContact O-N 3.42Å; A190-Q192 VanDerWaalsContact C-N 3.31Å; A190-Q192 PolarHBondContact O-N 2.88Å; Q192-G195 PolarHBondContact O-N 3.27Å; Q192-L196 HydrophobicContact CG-CD1 4.13Å; Q192-L196 WeakPolarHBondContact O-CB 3.22Å; Q192-L196 VanDerWaalsContact O-CG 3.31Å; Q192-L196 WeakPolarHBondContact O-CG 3.43Å; Q192-L196 PolarHBondContact O-N 2.93Å; Q192-G219 VanDerWaalsContact NE2-CA 3.25Å; Q192-N222 PolarHBondContact OE1-ND2 3.06Å; Q192-Y282 PolarHBondContact OE1-OH 2.94Å
193	T	94.6	Very high	95.6	Very high	30 Å²	30	38.1 Å²	38.1	18%	0.184	23%	0.228	C	C	.	.	H	α-helix	trans	-65.6	-45.3	-177.4	-57.5	0	0	0	0	112.4	M189 A190 L196 T197 G279	M189-T193 PolarHBondContact O-N 3.33Å; M189-T193 PolarHBondContact O-OG1 2.99Å; M189-T193 VanDerWaalsContact O-OG1 3.12Å; A190-T193 PolarHBondContact O-N 3.49Å; T193-L196 PolarHBondContact O-N 3.42Å; T193-T197 WeakPolarHBondContact O-CB 3.31Å; T193-T197 PolarHBondContact O-N 3.15Å; T193-T197 PolarHBondContact O-OG1 3Å; T193-G279 WeakPolarHBondContact OG1-CA 3.33Å
194	V	95.9	Very high	95.6	Very high	99 Å²	99	37.4 Å²	37.4	60%	0.6	22%	0.224	S	C	*	.	H	α-helix	trans	-66.7	-41.8	177	174.5	0	0	0	0	110.3	A190 T197 A198	A190-V194 VanDerWaalsContact O-CB 3.29Å; A190-V194 WeakPolarHBondContact O-CB 3.34Å; A190-V194 VanDerWaalsContact O-CG2 3.27Å; A190-V194 WeakPolarHBondContact O-CG2 3.46Å; A190-V194 PolarHBondContact O-N 3.04Å; V194-T197 PolarHBondContact O-N 3.41Å; V194-A198 WeakPolarHBondContact O-CB 3.32Å; V194-A198 PolarHBondContact O-N 3.02Å
195	G	95.8	Very high	95.6	Very high	6 Å²	6	38 Å²	38	6%	0.062	23%	0.225	C	C	.	.	H	α-helix	trans	-57.7	-49.7	175.2	0	0	0	0	0	112.1	V191 Q192 T197 A198 Q199 I211 V215	V191-G195 WeakPolarHBondContact O-CA 3.43Å; V191-G195 PolarHBondContact O-N 3.26Å; Q192-G195 PolarHBondContact O-N 3.27Å; G195-T197 VanDerWaalsContact C-N 3.31Å; G195-T197 PolarHBondContact O-N 2.72Å; G195-A198 PolarHBondContact O-N 3.15Å; G195-Q199 WeakPolarHBondContact O-CB 3.24Å; G195-Q199 PolarHBondContact O-N 2.85Å; G195-I211 WeakPolarHBondContact O-CG2 3.48Å; G195-V215 VanDerWaalsContact C-CG2 3.41Å
196	L	94.5	Very high	95.6	Very high	3 Å²	3	43 Å²	43	2%	0.016	25%	0.249	C	C	.	.	H	α-helix	trans	-60.4	-41.2	176.3	-74	167.1	0	0	0	112.1	T47 Y50 Q192 T193 Q199 I200 V215 L272 M275 A276	T47-L196 HydrophobicContact CG2-CD1 3.53Å; Y50-L196 HydrophobicContact CE1-CD2 4.15Å; Q192-L196 HydrophobicContact CG-CD1 4.13Å; Q192-L196 WeakPolarHBondContact O-CB 3.22Å; Q192-L196 VanDerWaalsContact O-CG 3.31Å; Q192-L196 WeakPolarHBondContact O-CG 3.43Å; Q192-L196 PolarHBondContact O-N 2.93Å; T193-L196 PolarHBondContact O-N 3.42Å; L196-Q199 VanDerWaalsContact O-CB 3.31Å; L196-Q199 WeakPolarHBondContact O-CB 3.33Å; L196-Q199 PolarHBondContact O-N 2.91Å; L196-I200 PolarHBondContact O-N 2.99Å; L196-V215 HydrophobicContact CD2-CG1 3.88Å; L196-V215 HydrophobicContact CD2-CG2 4.36Å; L196-V215 HydrophobicContact CG-CG1 4.03Å; L196-V215 HydrophobicContact CG-CG2 4.23Å; L196-L272 HydrophobicContact CD2-CD2 4.16Å; L196-M275 HydrophobicContact CD1-CB 4.31Å; L196-A276 HydrophobicContact CB-CB 4.37Å
197	T	95.8	Very high	95.6	Very high	57 Å²	57	44.5 Å²	44.5	35%	0.35	26%	0.26	S	S	.	.	H	α-helix	trans	-63	-45.3	177.5	-53.8	0	0	0	0	111.1	T193 V194 G195 Q199 I200 F201	T193-T197 WeakPolarHBondContact O-CB 3.31Å; T193-T197 PolarHBondContact O-N 3.15Å; T193-T197 PolarHBondContact O-OG1 3Å; V194-T197 PolarHBondContact O-N 3.41Å; G195-T197 VanDerWaalsContact C-N 3.31Å; G195-T197 PolarHBondContact O-N 2.72Å; T197-Q199 PolarHBondContact O-N 2.87Å; T197-I200 WeakPolarHBondContact O-CB 3.46Å; T197-I200 PolarHBondContact O-N 3.36Å; T197-F201 HydrophobicContact CG2-CE2 4.46Å; T197-F201 VanDerWaalsContact O-CD2 3.28Å; T197-F201 WeakPolarHBondContact O-CD2 3.25Å
198	A	96.9	Very high	95.6	Very high	43 Å²	43	41 Å²	41	36%	0.355	24%	0.239	S	C	.	.	H	α-helix	trans	-63	-34	176.2	0	0	0	0	0	112	V194 G195 I200 F201 I211	V194-A198 WeakPolarHBondContact O-CB 3.32Å; V194-A198 PolarHBondContact O-N 3.02Å; G195-A198 PolarHBondContact O-N 3.15Å; A198-I200 VanDerWaalsContact C-N 3.27Å; A198-I200 PolarHBondContact O-N 3.27Å; A198-F201 PolarHBondContact O-N 3.21Å; A198-F201 VanDerWaalsContact O-N 3.14Å; A198-I211 HydrophobicContact CB-CD1 4.1Å; A198-I211 HydrophobicContact CB-CG2 4.29Å
199	Q	95.2	Very high	95.7	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-63.7	-29.8	-179.1	-134.6	-178.3	33.8	0	0	113.3	Y50 G195 L196 T197 F201 S202 F208 I211 F212 L272	Y50-Q199 PolarHBondContact OH-NE2 3Å; Y50-Q199 PolarHBondContact OH-OE1 2.94Å; G195-Q199 WeakPolarHBondContact O-CB 3.24Å; G195-Q199 PolarHBondContact O-N 2.85Å; L196-Q199 VanDerWaalsContact O-CB 3.31Å; L196-Q199 WeakPolarHBondContact O-CB 3.33Å; L196-Q199 PolarHBondContact O-N 2.91Å; T197-Q199 PolarHBondContact O-N 2.87Å; Q199-F201 PolarHBondContact O-N 2.79Å; Q199-S202 WeakPolarHBondContact O-CB 3.15Å; Q199-S202 PolarHBondContact O-N 3.11Å; Q199-S202 PolarHBondContact O-OG 2.9Å; Q199-S202 VanDerWaalsContact O-OG 3.06Å; Q199-F208 HydrophobicContact CG-CD2 3.74Å; Q199-F208 HydrophobicContact CG-CE2 3.72Å; Q199-F208 HydrophobicContact CG-CG 4.49Å; Q199-F208 HydrophobicContact CG-CZ 4.44Å; Q199-I211 HydrophobicContact CB-CG2 3.84Å; Q199-I211 HydrophobicContact CG-CB 4.13Å; Q199-I211 HydrophobicContact CG-CG2 3.69Å; Q199-F212 VanDerWaalsContact NE2-CG 3.33Å; Q199-L272 HydrophobicContact CB-CD1 4.25Å
200	I	95.4	Very high	95.7	Very high	15 Å²	15	46.2 Å²	46.2	8%	0.077	27%	0.267	C	S	.	.	H	α-helix	trans	-59.1	-34.5	176.1	-62.5	159.7	0	0	0	111.1	L196 T197 A198 R269 L272 I273 A276	L196-I200 PolarHBondContact O-N 2.99Å; T197-I200 WeakPolarHBondContact O-CB 3.46Å; T197-I200 PolarHBondContact O-N 3.36Å; A198-I200 VanDerWaalsContact C-N 3.27Å; A198-I200 PolarHBondContact O-N 3.27Å; I200-R269 HydrophobicContact CG2-CB 4.31Å; I200-R269 PolarHBondContact O-NE 3.44Å; I200-L272 HydrophobicContact CD1-CB 4.37Å; I200-L272 HydrophobicContact CG1-CB 3.55Å; I200-L272 HydrophobicContact CG1-CD1 4.3Å; I200-I273 HydrophobicContact CD1-CB 4.41Å; I200-I273 HydrophobicContact CD1-CG1 3.65Å; I200-I273 HydrophobicContact CG1-CG1 4.33Å; I200-I273 HydrophobicContact CG2-CG1 4.33Å; I200-A276 HydrophobicContact CD1-CB 4.35Å
201	F	95.6	Very high	95.8	Very high	154 Å²	154	44.9 Å²	44.9	68%	0.675	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.8	10	-174.5	-57	-74.8	0	0	0	113.4	T197 A198 Q199 P203	T197-F201 HydrophobicContact CG2-CE2 4.46Å; T197-F201 VanDerWaalsContact O-CD2 3.28Å; T197-F201 WeakPolarHBondContact O-CD2 3.25Å; A198-F201 PolarHBondContact O-N 3.21Å; A198-F201 VanDerWaalsContact O-N 3.14Å; Q199-F201 PolarHBondContact O-N 2.79Å; F201-P203 VanDerWaalsContact O-CD 3.29Å; F201-P203 WeakPolarHBondContact O-CD 3.46Å
202	S	96.2	Very high	95.8	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	24%	0.238	C	C	.	.			trans	-63.1	120.5	-179	62.4	0	0	0	0	110.7	W144 Q199	W144-S202 WeakPolarHBondContact CH2-OG 3.34Å; Q199-S202 WeakPolarHBondContact O-CB 3.15Å; Q199-S202 PolarHBondContact O-N 3.11Å; Q199-S202 PolarHBondContact O-OG 2.9Å; Q199-S202 VanDerWaalsContact O-OG 3.06Å
203	P	94.9	Very high	95.8	Very high	98 Å²	98	45.9 Å²	45.9	64%	0.636	25%	0.253	S	S	*	.			trans	-82	-26.2	-178.9	32	-34.4	0	0	0	112.5	W144 F201 V207	W144-P203 PolarHBondContact NE1-O 2.69Å; F201-P203 VanDerWaalsContact O-CD 3.29Å; F201-P203 WeakPolarHBondContact O-CD 3.46Å; P203-V207 HydrophobicContact CG-CG2 4.38Å
204	S	96.3	Very high	95.9	Very high	36 Å²	36	47.9 Å²	47.9	25%	0.252	26%	0.262	S	S	.	.	S	Bend	trans	-135.9	162.9	-178	84.3	0	0	0	0	111.6	W144 E206 V207 F208	W144-S204 VanDerWaalsContact CZ2-C 3.47Å; S204-E206 VanDerWaalsContact C-N 3.3Å; S204-E206 WeakPolarHBondContact CB-OE2 3.36Å; S204-E206 PolarHBondContact O-N 3.32Å; S204-E206 PolarHBondContact OG-OE2 3.05Å; S204-V207 PolarHBondContact O-N 3.35Å; S204-F208 PolarHBondContact O-N 3.37Å
205	W	95.3	Very high	95.8	Very high	28 Å²	28	43.3 Å²	43.3	11%	0.106	23%	0.234	C	C	.	.	H	α-helix	trans	-60.2	-37.9	178.6	170.7	71.6	0	0	0	112.6	W144 L146 K153 L156 T157 F208 L209	W144-W205 HydrophobicContact CB-CB 4.46Å; W144-W205 HydrophobicContact CD2-CB 3.91Å; W144-W205 HydrophobicContact CE3-CB 3.68Å; W144-W205 HydrophobicContact CE3-CG 4.36Å; W144-W205 HydrophobicContact CG-CB 4.26Å; W144-W205 HydrophobicContact CZ3-CB 4.26Å; L146-W205 HydrophobicContact CD1-CG 4.48Å; L146-W205 HydrophobicContact CD2-CG 4.23Å; K153-W205 HydrophobicContact CB-CH2 4.35Å; K153-W205 HydrophobicContact CB-CZ2 3.71Å; K153-W205 HydrophobicContact CD-CD2 4.07Å; K153-W205 HydrophobicContact CD-CE3 4.02Å; K153-W205 HydrophobicContact CD-CH2 4.1Å; K153-W205 HydrophobicContact CD-CZ2 4.14Å; K153-W205 HydrophobicContact CD-CZ3 4.04Å; K153-W205 HydrophobicContact CG-CH2 3.96Å; K153-W205 HydrophobicContact CG-CZ2 3.84Å; K153-W205 HydrophobicContact CG-CZ3 4.4Å; L156-W205 HydrophobicContact CD2-CH2 4.05Å; L156-W205 HydrophobicContact CD2-CZ2 4.16Å; T157-W205 PolarHBondContact OG1-NE1 3.4Å; W205-F208 WeakPolarHBondContact O-CB 3.1Å; W205-F208 PolarHBondContact O-N 3.47Å; W205-L209 HydrophobicContact CH2-CD2 3.9Å; W205-L209 HydrophobicContact CZ2-CD2 3.84Å; W205-L209 HydrophobicContact CZ3-CD2 4.46Å; W205-L209 VanDerWaalsContact O-CB 3.3Å; W205-L209 WeakPolarHBondContact O-CB 3.45Å; W205-L209 PolarHBondContact O-N 3.39Å
206	E	96.1	Very high	95.7	Very high	105 Å²	105	43 Å²	43	49%	0.491	23%	0.231	S	C	.	.	H	α-helix	trans	-66.7	-40.8	-179.1	-56.5	75.1	-164.1	0	0	111.6	S204 L209 L210	S204-E206 VanDerWaalsContact C-N 3.3Å; S204-E206 WeakPolarHBondContact CB-OE2 3.36Å; S204-E206 PolarHBondContact O-N 3.32Å; S204-E206 PolarHBondContact OG-OE2 3.05Å; E206-L209 WeakPolarHBondContact O-CB 3.42Å; E206-L209 PolarHBondContact O-N 3.33Å; E206-L210 PolarHBondContact O-N 3.06Å; E206-L210 VanDerWaalsContact O-N 3.09Å
207	V	96.9	Very high	95.6	Very high	59 Å²	59	43.8 Å²	43.8	36%	0.358	24%	0.238	S	C	.	.	H	α-helix	trans	-67.2	-43	175.8	177.8	0	0	0	0	110.1	P203 S204 L209 L210 I211	P203-V207 HydrophobicContact CG-CG2 4.38Å; S204-V207 PolarHBondContact O-N 3.35Å; V207-L209 VanDerWaalsContact C-N 3.28Å; V207-L209 PolarHBondContact O-N 3.48Å; V207-L210 PolarHBondContact O-N 2.79Å; V207-I211 HydrophobicContact CG1-CD1 3.8Å; V207-I211 HydrophobicContact CG1-CG1 4.48Å; V207-I211 VanDerWaalsContact O-CG1 3.31Å; V207-I211 WeakPolarHBondContact O-CG1 3.47Å; V207-I211 PolarHBondContact O-N 3.21Å
208	F	96.6	Very high	95.4	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-56.3	-45.6	174.5	-179.8	-87	0	0	0	111.4	V54 I140 W144 T157 Q199 S204 W205 I211 F212 W268	V54-F208 HydrophobicContact CG1-CZ 4.27Å; I140-F208 HydrophobicContact CD1-CD1 4.48Å; I140-F208 HydrophobicContact CD1-CE1 3.97Å; I140-F208 HydrophobicContact CD1-CZ 4.31Å; I140-F208 HydrophobicContact CG2-CD2 4.27Å; I140-F208 HydrophobicContact CG2-CE2 3.9Å; I140-F208 HydrophobicContact CG2-CZ 4.09Å; W144-F208 HydrophobicContact CH2-CB 3.46Å; W144-F208 VanDerWaalsContact CH2-CB 3.46Å; W144-F208 AromaticContact CH2-CD2 3.85Å; W144-F208 HydrophobicContact CH2-CD2 3.85Å; W144-F208 AromaticContact CH2-CG 3.77Å; W144-F208 HydrophobicContact CH2-CG 3.77Å; W144-F208 HydrophobicContact CZ2-CB 4.45Å; W144-F208 HydrophobicContact CZ3-CB 3.75Å; W144-F208 HydrophobicContact CZ3-CD1 4.35Å; W144-F208 HydrophobicContact CZ3-CD2 4.18Å; W144-F208 AromaticContact CZ3-CG 3.84Å; W144-F208 HydrophobicContact CZ3-CG 3.84Å; T157-F208 HydrophobicContact CG2-CD1 4.09Å; T157-F208 HydrophobicContact CG2-CE1 3.73Å; Q199-F208 HydrophobicContact CG-CD2 3.74Å; Q199-F208 HydrophobicContact CG-CE2 3.72Å; Q199-F208 HydrophobicContact CG-CG 4.49Å; Q199-F208 HydrophobicContact CG-CZ 4.44Å; S204-F208 PolarHBondContact O-N 3.37Å; W205-F208 WeakPolarHBondContact O-CB 3.1Å; W205-F208 PolarHBondContact O-N 3.47Å; F208-I211 PolarHBondContact O-N 3.05Å; F208-F212 HydrophobicContact CE1-CB 4.3Å; F208-F212 AromaticContact CE1-CD1 3.99Å; F208-F212 HydrophobicContact CE1-CD1 3.99Å; F208-F212 HydrophobicContact CE1-CG 4.23Å; F208-F212 VanDerWaalsContact O-CB 3.25Å; F208-F212 WeakPolarHBondContact O-CB 3.37Å; F208-F212 PolarHBondContact O-N 3.42Å; F208-W268 HydrophobicContact CD2-CZ3 4.44Å; F208-W268 HydrophobicContact CE2-CZ3 4.31Å
209	L	95.9	Very high	94.8	Very high	23 Å²	23	39.3 Å²	39.3	12%	0.12	21%	0.207	C	C	.	.	H	α-helix	trans	-61.3	-46.9	-179.1	-171.3	64.5	0	0	0	112.7	T157 I160 W205 E206 V207 F212 F213	T157-L209 HydrophobicContact CG2-CD1 4.18Å; I160-L209 HydrophobicContact CB-CD1 3.75Å; I160-L209 HydrophobicContact CB-CG 4.39Å; I160-L209 HydrophobicContact CD1-CD1 3.67Å; I160-L209 HydrophobicContact CD1-CD2 3.57Å; I160-L209 HydrophobicContact CD1-CG 3.8Å; I160-L209 HydrophobicContact CG1-CD1 4.25Å; I160-L209 HydrophobicContact CG2-CD1 3.79Å; I160-L209 HydrophobicContact CG2-CG 4Å; W205-L209 HydrophobicContact CH2-CD2 3.9Å; W205-L209 HydrophobicContact CZ2-CD2 3.84Å; W205-L209 HydrophobicContact CZ3-CD2 4.46Å; W205-L209 VanDerWaalsContact O-CB 3.3Å; W205-L209 WeakPolarHBondContact O-CB 3.45Å; W205-L209 PolarHBondContact O-N 3.39Å; E206-L209 WeakPolarHBondContact O-CB 3.42Å; E206-L209 PolarHBondContact O-N 3.33Å; V207-L209 VanDerWaalsContact C-N 3.28Å; V207-L209 PolarHBondContact O-N 3.48Å; L209-F212 PolarHBondContact O-N 2.95Å; L209-F213 PolarHBondContact O-N 3.45Å
210	L	97	Very high	94.5	Very high	114 Å²	114	41.3 Å²	41.3	60%	0.597	21%	0.214	S	C	*	.	H	α-helix	trans	-63.5	-43.5	177.8	-178.8	141.8	0	0	0	111.5	E206 V207 F212 F213 I214	E206-L210 PolarHBondContact O-N 3.06Å; E206-L210 VanDerWaalsContact O-N 3.09Å; V207-L210 PolarHBondContact O-N 2.79Å; L210-F212 VanDerWaalsContact C-N 3.3Å; L210-F212 PolarHBondContact O-N 3.39Å; L210-F213 WeakPolarHBondContact O-CB 3.44Å; L210-F213 PolarHBondContact O-N 2.89Å; L210-I214 HydrophobicContact CD2-CD1 3.98Å; L210-I214 WeakPolarHBondContact O-CG1 3.44Å; L210-I214 PolarHBondContact O-N 3.07Å
211	I	96.8	Very high	94.3	Very high	22 Å²	22	40.6 Å²	40.6	11%	0.113	21%	0.211	C	C	.	.	H	α-helix	trans	-66.2	-37.7	175.7	-63	168.9	0	0	0	110.1	G195 A198 Q199 V207 F208 F213 I214 V215	G195-I211 WeakPolarHBondContact O-CG2 3.48Å; A198-I211 HydrophobicContact CB-CD1 4.1Å; A198-I211 HydrophobicContact CB-CG2 4.29Å; Q199-I211 HydrophobicContact CB-CG2 3.84Å; Q199-I211 HydrophobicContact CG-CB 4.13Å; Q199-I211 HydrophobicContact CG-CG2 3.69Å; V207-I211 HydrophobicContact CG1-CD1 3.8Å; V207-I211 HydrophobicContact CG1-CG1 4.48Å; V207-I211 VanDerWaalsContact O-CG1 3.31Å; V207-I211 WeakPolarHBondContact O-CG1 3.47Å; V207-I211 PolarHBondContact O-N 3.21Å; F208-I211 PolarHBondContact O-N 3.05Å; I211-F213 VanDerWaalsContact C-N 3.33Å; I211-F213 PolarHBondContact O-N 2.95Å; I211-I214 WeakPolarHBondContact O-CB 3.39Å; I211-I214 PolarHBondContact O-N 3.21Å; I211-V215 HydrophobicContact CG2-CG2 4.31Å; I211-V215 WeakPolarHBondContact O-CG2 3.42Å; I211-V215 PolarHBondContact O-N 3.26Å
212	F	95.1	Very high	94	Very high	1 Å²	1	33.2 Å²	33.2	0%	0.004	18%	0.179	C	C	.	.	H	α-helix	trans	-67.1	-34	-179.1	-160.9	-156.6	0	0	0	113.2	Y50 I51 T157 H161 Q199 F208 L209 L210 V215 G216	Y50-F212 AromaticContact CE1-CE2 3.88Å; Y50-F212 HydrophobicContact CE1-CE2 3.88Å; Y50-F212 HydrophobicContact CE2-CE2 4.44Å; Y50-F212 AromaticContact CZ-CE2 3.52Å; Y50-F212 WeakPolarHBondContact OH-CD2 3.37Å; Y50-F212 WeakPolarHBondContact OH-CE2 3.42Å; I51-F212 HydrophobicContact CB-CE1 4.33Å; I51-F212 HydrophobicContact CB-CZ 3.92Å; I51-F212 HydrophobicContact CD1-CE1 3.73Å; I51-F212 HydrophobicContact CD1-CZ 4.04Å; I51-F212 HydrophobicContact CG1-CE1 3.88Å; I51-F212 HydrophobicContact CG1-CZ 3.99Å; T157-F212 HydrophobicContact CG2-CD1 3.65Å; T157-F212 HydrophobicContact CG2-CE1 3.97Å; H161-F212 HydrophobicContact CB-CD1 3.71Å; H161-F212 HydrophobicContact CB-CD2 4.19Å; H161-F212 HydrophobicContact CB-CE1 3.52Å; H161-F212 HydrophobicContact CB-CE2 4.02Å; H161-F212 HydrophobicContact CB-CG 4.04Å; H161-F212 HydrophobicContact CB-CZ 3.68Å; H161-F212 AromaticContact CE1-CE2 3.55Å; H161-F212 AromaticContact CG-CD2 3.95Å; H161-F212 AromaticContact CG-CE1 3.96Å; H161-F212 AromaticContact CG-CE2 3.55Å; H161-F212 AromaticContact CG-CZ 3.55Å; H161-F212 AromaticContact ND1-CD2 3.27Å; H161-F212 VanDerWaalsContact ND1-CD2 3.27Å; H161-F212 WeakPolarHBondContact ND1-CD2 3.43Å; H161-F212 AromaticContact ND1-CE2 3.09Å; H161-F212 WeakPolarHBondContact ND1-CE2 3.36Å; H161-F212 AromaticContact ND1-CG 3.93Å; H161-F212 AromaticContact ND1-CZ 3.63Å; H161-F212 PolarHBondContact ND1-O 3.41Å; Q199-F212 VanDerWaalsContact NE2-CG 3.33Å; F208-F212 HydrophobicContact CE1-CB 4.3Å; F208-F212 AromaticContact CE1-CD1 3.99Å; F208-F212 HydrophobicContact CE1-CD1 3.99Å; F208-F212 HydrophobicContact CE1-CG 4.23Å; F208-F212 VanDerWaalsContact O-CB 3.25Å; F208-F212 WeakPolarHBondContact O-CB 3.37Å; F208-F212 PolarHBondContact O-N 3.42Å; L209-F212 PolarHBondContact O-N 2.95Å; L210-F212 VanDerWaalsContact C-N 3.3Å; L210-F212 PolarHBondContact O-N 3.39Å; F212-V215 HydrophobicContact CD2-CB 4.39Å; F212-V215 PolarHBondContact O-N 3.07Å; F212-G216 PolarHBondContact O-N 3.28Å
213	F	95.9	Very high	93.7	Very high	70 Å²	70	35.2 Å²	35.2	31%	0.307	19%	0.186	S	C	.	.	H	α-helix	trans	-58.2	-46.4	168.2	173.4	-88.8	0	0	0	111.4	I160 I163 G164 F167 L209 L210 I211 G216 A217	I160-F213 HydrophobicContact CG2-CB 3.95Å; I160-F213 HydrophobicContact CG2-CD2 4.24Å; I163-F213 HydrophobicContact CG2-CE2 4.03Å; G164-F213 VanDerWaalsContact CA-CD2 3.4Å; G164-F213 WeakPolarHBondContact CA-O 3.35Å; F167-F213 HydrophobicContact CD2-CE2 4.24Å; F167-F213 HydrophobicContact CD2-CZ 4.25Å; L209-F213 PolarHBondContact O-N 3.45Å; L210-F213 WeakPolarHBondContact O-CB 3.44Å; L210-F213 PolarHBondContact O-N 2.89Å; I211-F213 VanDerWaalsContact C-N 3.33Å; I211-F213 PolarHBondContact O-N 2.95Å; F213-G216 PolarHBondContact O-N 3.37Å; F213-A217 PolarHBondContact O-N 3.49Å
214	I	95.6	Very high	93.5	Very high	73 Å²	73	32.6 Å²	32.6	37%	0.374	17%	0.168	S	C	.	.	H	α-helix	trans	-65.2	-42.6	178.7	-62.7	168	0	0	0	111.1	V191 L210 I211 G216 A217 G218	V191-I214 HydrophobicContact CG1-CG2 3.63Å; L210-I214 HydrophobicContact CD2-CD1 3.98Å; L210-I214 WeakPolarHBondContact O-CG1 3.44Å; L210-I214 PolarHBondContact O-N 3.07Å; I211-I214 WeakPolarHBondContact O-CB 3.39Å; I211-I214 PolarHBondContact O-N 3.21Å; I214-G216 VanDerWaalsContact C-N 3.3Å; I214-G216 PolarHBondContact O-N 3.16Å; I214-A217 WeakPolarHBondContact O-CB 3.45Å; I214-A217 PolarHBondContact O-N 3.21Å; I214-A217 VanDerWaalsContact O-N 3.15Å; I214-G218 PolarHBondContact O-N 3.15Å
215	V	94.4	Very high	93.3	Very high	2 Å²	2	31 Å²	31	1%	0.012	16%	0.157	C	C	.	.	H	α-helix	trans	-59.1	-43.3	175	172	0	0	0	0	110.8	G195 L196 I211 F212 A217 G218 G219	G195-V215 VanDerWaalsContact C-CG2 3.41Å; L196-V215 HydrophobicContact CD2-CG1 3.88Å; L196-V215 HydrophobicContact CD2-CG2 4.36Å; L196-V215 HydrophobicContact CG-CG1 4.03Å; L196-V215 HydrophobicContact CG-CG2 4.23Å; I211-V215 HydrophobicContact CG2-CG2 4.31Å; I211-V215 WeakPolarHBondContact O-CG2 3.42Å; I211-V215 PolarHBondContact O-N 3.26Å; F212-V215 HydrophobicContact CD2-CB 4.39Å; F212-V215 PolarHBondContact O-N 3.07Å; V215-A217 VanDerWaalsContact C-N 3.34Å; V215-A217 PolarHBondContact O-N 3.03Å; V215-G218 PolarHBondContact O-N 3.24Å; V215-G219 PolarHBondContact O-N 2.98Å
216	G	93	Very high	93.1	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-60.7	-42.9	174.2	0	0	0	0	0	112.6	H161 V165 F212 F213 I214 G218	H161-G216 WeakPolarHBondContact CE1-CA 3.3Å; H161-G216 PolarHBondContact CE1-N 3.32Å; H161-G216 VanDerWaalsContact ND1-CA 3.34Å; H161-G216 WeakPolarHBondContact ND1-CA 3.49Å; H161-G216 PolarHBondContact ND1-N 3.43Å; V165-G216 WeakPolarHBondContact CG2-O 3.27Å; F212-G216 PolarHBondContact O-N 3.28Å; F213-G216 PolarHBondContact O-N 3.37Å; I214-G216 VanDerWaalsContact C-N 3.3Å; I214-G216 PolarHBondContact O-N 3.16Å; G216-G218 VanDerWaalsContact C-N 3.3Å; G216-G218 PolarHBondContact O-N 3.09Å
217	A	92.6	Very high	92.9	Very high	20 Å²	20	28.1 Å²	28.1	17%	0.165	14%	0.144	C	C	.	.	H	α-helix	trans	-63.4	-32.6	177.1	0	0	0	0	0	113.2	G164 G168 F213 I214 V215 S221	G164-A217 VanDerWaalsContact O-CA 3.25Å; G164-A217 WeakPolarHBondContact O-CA 3.26Å; G164-A217 WeakPolarHBondContact O-CB 3.46Å; G168-A217 WeakPolarHBondContact CA-O 3.47Å; F213-A217 PolarHBondContact O-N 3.49Å; I214-A217 WeakPolarHBondContact O-CB 3.45Å; I214-A217 PolarHBondContact O-N 3.21Å; I214-A217 VanDerWaalsContact O-N 3.15Å; V215-A217 VanDerWaalsContact C-N 3.34Å; V215-A217 PolarHBondContact O-N 3.03Å; A217-S221 WeakPolarHBondContact O-CB 3.27Å; A217-S221 PolarHBondContact O-OG 2.76Å
218	G	90.9	Very high	92.6	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-82	-42.4	177.3	0	0	0	0	0	114.4	I214 V215 G216 N222	I214-G218 PolarHBondContact O-N 3.15Å; V215-G218 PolarHBondContact O-N 3.24Å; G216-G218 VanDerWaalsContact C-N 3.3Å; G216-G218 PolarHBondContact O-N 3.09Å; G218-N222 PolarHBondContact O-N 3.47Å; G218-N222 VanDerWaalsContact O-N 3.16Å; G218-N222 PolarHBondContact O-ND2 3.19Å
219	G	86.1	Confident	92.4	Very high	5 Å²	5	27.4 Å²	27.4	5%	0.052	14%	0.139	C	C	.	.	H	α-helix	trans	-65.2	-64.9	-169.1	0	0	0	0	0	114.3	N44 Q192 V215 S221 N222 Y223	N44-G219 PolarHBondContact OD1-O 2.99Å; Q192-G219 VanDerWaalsContact NE2-CA 3.25Å; V215-G219 PolarHBondContact O-N 2.98Å; G219-S221 PolarHBondContact O-N 2.93Å; G219-N222 WeakPolarHBondContact CA-ND2 3.35Å; G219-N222 PolarHBondContact O-N 3.43Å; G219-N222 PolarHBondContact O-ND2 2.97Å; G219-N222 PolarHBondContact O-OD1 3.01Å; G219-Y223 PolarHBondContact O-N 2.95Å
220	Y	87.1	Confident	92.1	Very high	42 Å²	42	26.3 Å²	26.3	17%	0.165	13%	0.134	C	C	.	.	H	α-helix	trans	-65.8	-25.8	-178.9	-83.2	-87.6	0	0	0	113.1	V165 Y223 V224 F371	V165-Y220 HydrophobicContact CB-CD2 4.19Å; V165-Y220 HydrophobicContact CB-CG 4.47Å; V165-Y220 HydrophobicContact CG1-CD1 4.35Å; V165-Y220 HydrophobicContact CG1-CD2 3.78Å; V165-Y220 HydrophobicContact CG1-CG 3.62Å; V165-Y220 HydrophobicContact CG2-CD2 3.3Å; V165-Y220 HydrophobicContact CG2-CE2 3.93Å; V165-Y220 HydrophobicContact CG2-CG 4.01Å; Y220-Y223 WeakPolarHBondContact O-CB 3.28Å; Y220-Y223 PolarHBondContact O-N 3.49Å; Y220-V224 WeakPolarHBondContact O-CG2 3.4Å; Y220-V224 PolarHBondContact O-N 3.14Å; Y220-F371 WeakPolarHBondContact OH-CE1 3.37Å
221	S	91.2	Very high	91.7	Very high	0 Å²	0	22 Å²	22	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-62.9	-46.5	174.4	-64.6	0	0	0	0	112.1	G168 V169 S172 A217 G219 Y223 V224 I225	G168-S221 WeakPolarHBondContact CA-OG 3.35Å; G168-S221 PolarHBondContact O-OG 2.9Å; V169-S221 PolarHBondContact N-OG 3.42Å; S172-S221 WeakPolarHBondContact OG-CB 3.27Å; S172-S221 PolarHBondContact OG-OG 3.34Å; A217-S221 WeakPolarHBondContact O-CB 3.27Å; A217-S221 PolarHBondContact O-OG 2.76Å; G219-S221 PolarHBondContact O-N 2.93Å; S221-Y223 VanDerWaalsContact C-N 3.32Å; S221-Y223 PolarHBondContact O-N 3.45Å; S221-V224 PolarHBondContact O-N 3.22Å; S221-I225 WeakPolarHBondContact O-CD1 3.29Å; S221-I225 VanDerWaalsContact O-CG1 3.24Å; S221-I225 WeakPolarHBondContact O-CG1 3.28Å; S221-I225 PolarHBondContact O-N 3.48Å
222	N	90.9	Very high	91.4	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-67.8	-34.9	178.7	78.5	63.7	0	0	0	111.6	N44 L185 M188 M189 Q192 G218 G219 I225 A226	N44-N222 PolarHBondContact ND2-OD1 2.92Å; N44-N222 PolarHBondContact OD1-ND2 3.43Å; N44-N222 PolarHBondContact OD1-OD1 3.27Å; L185-N222 HydrophobicContact CD1-CB 3.96Å; L185-N222 WeakPolarHBondContact CD1-O 3.42Å; M188-N222 HydrophobicContact CB-CB 3.88Å; M189-N222 HydrophobicContact CG-CB 3.97Å; Q192-N222 PolarHBondContact OE1-ND2 3.06Å; G218-N222 PolarHBondContact O-N 3.47Å; G218-N222 VanDerWaalsContact O-N 3.16Å; G218-N222 PolarHBondContact O-ND2 3.19Å; G219-N222 WeakPolarHBondContact CA-ND2 3.35Å; G219-N222 PolarHBondContact O-N 3.43Å; G219-N222 PolarHBondContact O-ND2 2.97Å; G219-N222 PolarHBondContact O-OD1 3.01Å; N222-I225 PolarHBondContact O-N 2.85Å; N222-A226 WeakPolarHBondContact O-CB 3.5Å; N222-A226 PolarHBondContact O-N 3.49Å
223	Y	89.5	Confident	91.2	Very high	41 Å²	41	23 Å²	23	16%	0.161	12%	0.12	C	C	.	.	H	α-helix	trans	-57.4	-50.1	171.8	176.2	-86.7	0	0	0	112.1	I41 N44 G219 Y220 S221 A226 F227 V247	I41-Y223 HydrophobicContact CG1-CD2 4.26Å; I41-Y223 HydrophobicContact CG2-CD2 3.74Å; I41-Y223 HydrophobicContact CG2-CE2 3.7Å; N44-Y223 HydrophobicContact CB-CD2 4.41Å; G219-Y223 PolarHBondContact O-N 2.95Å; Y220-Y223 WeakPolarHBondContact O-CB 3.28Å; Y220-Y223 PolarHBondContact O-N 3.49Å; S221-Y223 VanDerWaalsContact C-N 3.32Å; S221-Y223 PolarHBondContact O-N 3.45Å; Y223-A226 PolarHBondContact O-N 3.24Å; Y223-F227 PolarHBondContact O-N 3.17Å; Y223-V247 HydrophobicContact CE1-CG1 4.33Å; Y223-V247 HydrophobicContact CE2-CG1 3.74Å; Y223-V247 VanDerWaalsContact CZ-CG1 3.49Å; Y223-V247 WeakPolarHBondContact OH-CG1 3.33Å
224	V	89.5	Confident	90.9	Very high	43 Å²	43	19.7 Å²	19.7	26%	0.261	11%	0.105	S	C	.	.	H	α-helix	trans	-65.5	-41.4	-179	173.6	0	0	0	0	111.2	V169 Y220 S221 F227 V228	V169-V224 HydrophobicContact CG1-CG2 4.22Å; V169-V224 HydrophobicContact CG2-CG2 4.26Å; Y220-V224 WeakPolarHBondContact O-CG2 3.4Å; Y220-V224 PolarHBondContact O-N 3.14Å; S221-V224 PolarHBondContact O-N 3.22Å; V224-F227 WeakPolarHBondContact O-CB 3.42Å; V224-F227 PolarHBondContact O-N 3Å; V224-V228 WeakPolarHBondContact O-CG2 3.3Å; V224-V228 PolarHBondContact O-N 3.21Å
225	I	92.1	Very high	90.5	Very high	3 Å²	3	17 Å²	17	2%	0.015	9%	0.093	C	C	.	.	H	α-helix	trans	-66.4	-40.5	178.5	-63.4	162.7	0	0	0	110.9	R181 I184 L185 M188 S221 N222 F227 V228 L229	R181-I225 HydrophobicContact CB-CG2 4.3Å; R181-I225 WeakPolarHBondContact O-CG2 3.19Å; I184-I225 HydrophobicContact CB-CD1 4.31Å; I184-I225 HydrophobicContact CG2-CD1 3.63Å; L185-I225 HydrophobicContact CB-CG2 3.79Å; L185-I225 HydrophobicContact CD1-CB 4.01Å; L185-I225 HydrophobicContact CD1-CG2 4.07Å; L185-I225 HydrophobicContact CG-CG2 4.48Å; M188-I225 HydrophobicContact CG-CD1 4.24Å; S221-I225 WeakPolarHBondContact O-CD1 3.29Å; S221-I225 VanDerWaalsContact O-CG1 3.24Å; S221-I225 WeakPolarHBondContact O-CG1 3.28Å; S221-I225 PolarHBondContact O-N 3.48Å; N222-I225 PolarHBondContact O-N 2.85Å; I225-F227 VanDerWaalsContact C-N 3.32Å; I225-F227 PolarHBondContact O-N 2.98Å; I225-V228 PolarHBondContact O-N 3.44Å; I225-L229 VanDerWaalsContact O-CB 3.3Å; I225-L229 WeakPolarHBondContact O-CB 3.48Å; I225-L229 PolarHBondContact O-N 3.44Å
226	A	92.8	Very high	90	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-62.2	-40.2	175.9	0	0	0	0	0	111.7	L37 I41 L185 N222 Y223 G230	L37-A226 HydrophobicContact CD2-CB 4.3Å; I41-A226 HydrophobicContact CD1-CB 4.36Å; I41-A226 HydrophobicContact CG1-CB 4.21Å; L185-A226 HydrophobicContact CD1-CB 3.98Å; N222-A226 WeakPolarHBondContact O-CB 3.5Å; N222-A226 PolarHBondContact O-N 3.49Å; Y223-A226 PolarHBondContact O-N 3.24Å; A226-G230 PolarHBondContact O-N 2.94Å
227	F	90.7	Very high	89.6	Confident	73 Å²	73	26.7 Å²	26.7	32%	0.32	14%	0.141	S	C	.	.	H	α-helix	trans	-59.1	-50.5	173.6	175.8	-88.8	0	0	0	111.7	Y223 V224 I225 G230 A231 C243 V247	Y223-F227 PolarHBondContact O-N 3.17Å; V224-F227 WeakPolarHBondContact O-CB 3.42Å; V224-F227 PolarHBondContact O-N 3Å; I225-F227 VanDerWaalsContact C-N 3.32Å; I225-F227 PolarHBondContact O-N 2.98Å; F227-G230 PolarHBondContact O-N 3.4Å; F227-A231 WeakPolarHBondContact O-CB 3.21Å; F227-A231 PolarHBondContact O-N 3.49Å; F227-C243 HydrophobicContact CE2-CB 3.65Å; F227-C243 HydrophobicContact CZ-CB 3.97Å; F227-V247 HydrophobicContact CD2-CB 4.45Å; F227-V247 HydrophobicContact CD2-CG1 4.2Å; F227-V247 HydrophobicContact CD2-CG2 4.02Å
228	V	90.2	Very high	89.3	Confident	42 Å²	42	25.7 Å²	25.7	26%	0.255	13%	0.133	S	C	.	.	H	α-helix	trans	-64.3	-43.8	179.8	174.2	0	0	0	0	111.3	V224 I225 G230 A231 E232	V224-V228 WeakPolarHBondContact O-CG2 3.3Å; V224-V228 PolarHBondContact O-N 3.21Å; I225-V228 PolarHBondContact O-N 3.44Å; V228-G230 PolarHBondContact O-N 3.29Å; V228-A231 CarbonylContact O-C 3.6Å; V228-A231 WeakPolarHBondContact O-CA 3.28Å; V228-A231 WeakPolarHBondContact O-CB 3.34Å; V228-A231 PolarHBondContact O-N 2.87Å; V228-A231 VanDerWaalsContact O-N 3.1Å; V228-E232 HydrophobicContact CG1-CG 4.32Å; V228-E232 WeakPolarHBondContact CG1-OE1 3.42Å; V228-E232 WeakPolarHBondContact O-CG 3.47Å; V228-E232 PolarHBondContact O-N 2.83Å
229	L	92.7	Very high	89.1	Confident	1 Å²	1	27.7 Å²	27.7	1%	0.005	14%	0.14	C	C	.	.	H	α-helix	trans	-61.2	-44	178.2	179.7	54.5	0	0	0	111.7	L37 R181 L185 I225 A231 E232 V233 I289	L37-L229 HydrophobicContact CD2-CD2 4.11Å; L37-L229 HydrophobicContact CD2-CG 4.44Å; R181-L229 HydrophobicContact CB-CB 4.13Å; R181-L229 HydrophobicContact CB-CD1 3.84Å; R181-L229 HydrophobicContact CB-CD2 4.29Å; R181-L229 HydrophobicContact CB-CG 4.31Å; R181-L229 HydrophobicContact CG-CD1 4.15Å; L185-L229 HydrophobicContact CD2-CD2 4.16Å; I225-L229 VanDerWaalsContact O-CB 3.3Å; I225-L229 WeakPolarHBondContact O-CB 3.48Å; I225-L229 PolarHBondContact O-N 3.44Å; L229-A231 VanDerWaalsContact C-N 3.28Å; L229-A231 PolarHBondContact O-N 3.38Å; L229-E232 PolarHBondContact O-N 3.25Å; L229-V233 HydrophobicContact CD1-CG2 3.55Å; L229-V233 HydrophobicContact CG-CG2 4.32Å; L229-V233 WeakPolarHBondContact O-CB 3.36Å; L229-V233 VanDerWaalsContact O-CG2 3.27Å; L229-V233 WeakPolarHBondContact O-CG2 3.36Å; L229-V233 PolarHBondContact O-N 2.83Å; L229-I289 HydrophobicContact CD2-CG2 3.48Å; L229-I289 VanDerWaalsContact CD2-CG2 3.48Å
230	G	91.1	Very high	89	Confident	0 Å²	0	32 Å²	32	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-62.3	-38.4	173.7	0	0	0	0	0	112.2	A226 F227 V228 E232 L234	A226-G230 PolarHBondContact O-N 2.94Å; F227-G230 PolarHBondContact O-N 3.4Å; V228-G230 PolarHBondContact O-N 3.29Å; G230-E232 VanDerWaalsContact C-N 3.33Å; G230-E232 PolarHBondContact O-N 3.19Å; G230-L234 VanDerWaalsContact O-CB 3.22Å; G230-L234 WeakPolarHBondContact O-CB 3.38Å; G230-L234 WeakPolarHBondContact O-CD1 3.39Å; G230-L234 VanDerWaalsContact O-CG 3.24Å; G230-L234 WeakPolarHBondContact O-CG 3.21Å; G230-L234 PolarHBondContact O-N 3.24Å; G230-L234 VanDerWaalsContact O-N 3.08Å
231	A	87.6	Confident	88.9	Confident	23 Å²	23	32.4 Å²	32.4	19%	0.19	17%	0.172	C	C	.	.	H	α-helix	trans	-65.7	-33.7	175.9	0	0	0	0	0	113.3	F227 V228 L229 R239	F227-A231 WeakPolarHBondContact O-CB 3.21Å; F227-A231 PolarHBondContact O-N 3.49Å; V228-A231 CarbonylContact O-C 3.6Å; V228-A231 WeakPolarHBondContact O-CA 3.28Å; V228-A231 WeakPolarHBondContact O-CB 3.34Å; V228-A231 PolarHBondContact O-N 2.87Å; V228-A231 VanDerWaalsContact O-N 3.1Å; L229-A231 VanDerWaalsContact C-N 3.28Å; L229-A231 PolarHBondContact O-N 3.38Å; A231-R239 HydrophobicContact CB-CG 4.5Å; A231-R239 VanDerWaalsContact O-CD 3.26Å; A231-R239 WeakPolarHBondContact O-CD 3.49Å; A231-R239 VanDerWaalsContact O-CZ 3.3Å; A231-R239 PolarHBondContact O-NE 2.71Å
232	E	89.7	Confident	88.7	Confident	28 Å²	28	32.4 Å²	32.4	13%	0.131	17%	0.172	C	C	.	.	H	α-helix	trans	-84.9	-29.6	-178.9	-69.1	175.3	-178.8	0	0	113.5	R181 V228 L229 G230 S292 R294	R181-E232 IonicContact CZ-OE1 2.83Å; R181-E232 IonicContact NE-OE1 3.18Å; R181-E232 PolarHBondContact NE-OE1 3.27Å; R181-E232 VanDerWaalsContact NE-OE1 3.14Å; R181-E232 IonicContact NE-OE2 2.68Å; R181-E232 PolarHBondContact NE-OE2 2.98Å; R181-E232 IonicContact NH2-OE1 3.21Å; R181-E232 PolarHBondContact NH2-OE1 3.27Å; V228-E232 HydrophobicContact CG1-CG 4.32Å; V228-E232 WeakPolarHBondContact CG1-OE1 3.42Å; V228-E232 WeakPolarHBondContact O-CG 3.47Å; V228-E232 PolarHBondContact O-N 2.83Å; L229-E232 PolarHBondContact O-N 3.25Å; G230-E232 VanDerWaalsContact C-N 3.33Å; G230-E232 PolarHBondContact O-N 3.19Å; E232-S292 VanDerWaalsContact CB-OG 3.28Å; E232-S292 WeakPolarHBondContact CB-OG 3.19Å; E232-S292 WeakPolarHBondContact OE2-CB 3.28Å; E232-S292 PolarHBondContact OE2-OG 2.72Å; E232-R294 HydrophobicContact CB-CB 4.33Å
233	V	91.1	Very high	88.3	Confident	17 Å²	17	33.6 Å²	33.6	10%	0.103	18%	0.181	C	C	.	.	H	α-helix	trans	-92.1	-34.6	-175.4	176.4	0	0	0	0	112.9	F29 I33 L229	F29-V233 HydrophobicContact CE1-CG1 3.86Å; F29-V233 HydrophobicContact CZ-CG1 3.93Å; I33-V233 HydrophobicContact CG1-CG1 4.2Å; I33-V233 HydrophobicContact CG2-CB 4.49Å; I33-V233 HydrophobicContact CG2-CG1 4.03Å; L229-V233 HydrophobicContact CD1-CG2 3.55Å; L229-V233 HydrophobicContact CG-CG2 4.32Å; L229-V233 WeakPolarHBondContact O-CB 3.36Å; L229-V233 VanDerWaalsContact O-CG2 3.27Å; L229-V233 WeakPolarHBondContact O-CG2 3.36Å; L229-V233 PolarHBondContact O-N 2.83Å
234	L	90.5	Very high	87.7	Confident	1 Å²	1	33.4 Å²	33.4	1%	0.005	19%	0.185	C	C	.	.	S	Bend	trans	-79.4	148.6	-174.5	-64.4	170.8	0	0	0	112.2	Q30 I33 F34 G230 T238 R239 F242	Q30-L234 HydrophobicContact CB-CD2 4.15Å; I33-L234 HydrophobicContact CB-CD2 4.16Å; I33-L234 HydrophobicContact CG2-CD2 4.09Å; I33-L234 HydrophobicContact CG2-CG 4.48Å; F34-L234 HydrophobicContact CD2-CD1 4.48Å; G230-L234 VanDerWaalsContact O-CB 3.22Å; G230-L234 WeakPolarHBondContact O-CB 3.38Å; G230-L234 WeakPolarHBondContact O-CD1 3.39Å; G230-L234 VanDerWaalsContact O-CG 3.24Å; G230-L234 WeakPolarHBondContact O-CG 3.21Å; G230-L234 PolarHBondContact O-N 3.24Å; G230-L234 VanDerWaalsContact O-N 3.08Å; L234-T238 HydrophobicContact CD1-CG2 4.31Å; L234-T238 HydrophobicContact CD2-CG2 4.03Å; L234-R239 HydrophobicContact CB-CB 4.14Å; L234-R239 PolarHBondContact O-NE 2.1Å; L234-R239 PolarHBondContact O-NH2 3.36Å; L234-F242 HydrophobicContact CD1-CB 3.45Å; L234-F242 VanDerWaalsContact CD1-CB 3.45Å; L234-F242 HydrophobicContact CD1-CD1 3.83Å; L234-F242 HydrophobicContact CD1-CD2 4.05Å; L234-F242 HydrophobicContact CD1-CG 3.49Å; L234-F242 VanDerWaalsContact CD1-CG 3.49Å
235	S	86.9	Confident	87.2	Confident	15 Å²	15	34 Å²	34	11%	0.105	19%	0.186	C	C	.	.			trans	-60.5	155.1	173.1	71.7	0	0	0	0	111.1	S25 K237 T238 R239	S25-S235 WeakPolarHBondContact CA-OG 3.47Å; S25-S235 PolarHBondContact O-OG 2.83Å; S235-K237 VanDerWaalsContact C-N 3.32Å; S235-K237 PolarHBondContact O-N 3.41Å; S235-K237 VanDerWaalsContact O-N 3.15Å; S235-T238 PolarHBondContact O-N 3.35Å; S235-T238 VanDerWaalsContact O-N 3.11Å; S235-T238 PolarHBondContact OG-OG1 3.17Å; S235-R239 WeakPolarHBondContact O-CB 3.22Å; S235-R239 PolarHBondContact O-N 3.2Å
236	P	83.4	Confident	86.8	Confident	61 Å²	61	34.2 Å²	34.2	40%	0.396	19%	0.189	S	C	.	.	H	α-helix	trans	-51.7	-43.4	-175	-30.5	35.8	0	0	0	114.9	D17 V240	D17-P236 HydrophobicContact CB-CG 4Å; P236-V240 WeakPolarHBondContact O-CG2 3.49Å; P236-V240 PolarHBondContact O-N 2.83Å
237	K	85.4	Confident	86.3	Confident	145 Å²	145	34.2 Å²	34.2	63%	0.63	19%	0.189	S	C	*	.	H	α-helix	trans	-67.9	-45	179.2	-67	-174.2	-179.8	179.6	0	112.3	S235 V241	S235-K237 VanDerWaalsContact C-N 3.32Å; S235-K237 PolarHBondContact O-N 3.41Å; S235-K237 VanDerWaalsContact O-N 3.15Å; K237-V241 PolarHBondContact O-N 3.14Å
238	T	86.4	Confident	85.9	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-74.3	-33.8	-178.3	-53.2	0	0	0	0	111.7	S25 W26 Q30 F34 L234 S235 V240 V241 F242	S25-T238 PolarHBondContact O-OG1 2.89Å; W26-T238 HydrophobicContact CE3-CG2 4.37Å; W26-T238 HydrophobicContact CH2-CG2 4.02Å; W26-T238 HydrophobicContact CZ2-CG2 4.16Å; W26-T238 HydrophobicContact CZ3-CG2 4.12Å; Q30-T238 HydrophobicContact CB-CG2 4.43Å; F34-T238 HydrophobicContact CD2-CG2 4.01Å; L234-T238 HydrophobicContact CD1-CG2 4.31Å; L234-T238 HydrophobicContact CD2-CG2 4.03Å; S235-T238 PolarHBondContact O-N 3.35Å; S235-T238 VanDerWaalsContact O-N 3.11Å; S235-T238 PolarHBondContact OG-OG1 3.17Å; T238-V240 PolarHBondContact O-N 3.41Å; T238-V241 PolarHBondContact O-N 3.43Å; T238-F242 WeakPolarHBondContact O-CB 3.32Å; T238-F242 PolarHBondContact O-N 3Å
239	R	86.4	Confident	85.7	Confident	41 Å²	41	32.2 Å²	32.2	16%	0.155	18%	0.178	C	C	.	.	H	α-helix	trans	-54.7	-49.4	172.1	179	-176.7	-47.8	166.8	1.8	111.4	D17 A231 L234 S235 V241 F242 C243	D17-R239 IonicContact OD1-CZ 2.74Å; D17-R239 IonicContact OD1-NH1 2.95Å; D17-R239 PolarHBondContact OD1-NH1 3.47Å; D17-R239 IonicContact OD1-NH2 2.65Å; D17-R239 PolarHBondContact OD1-NH2 2.91Å; D17-R239 IonicContact OD2-CZ 3.42Å; D17-R239 IonicContact OD2-NH1 3.91Å; D17-R239 PolarHBondContact OD2-NH1 2.95Å; D17-R239 VanDerWaalsContact OD2-NH1 3.12Å; D17-R239 IonicContact OD2-NH2 2.87Å; A231-R239 HydrophobicContact CB-CG 4.5Å; A231-R239 VanDerWaalsContact O-CD 3.26Å; A231-R239 WeakPolarHBondContact O-CD 3.49Å; A231-R239 VanDerWaalsContact O-CZ 3.3Å; A231-R239 PolarHBondContact O-NE 2.71Å; L234-R239 HydrophobicContact CB-CB 4.14Å; L234-R239 PolarHBondContact O-NE 2.1Å; L234-R239 PolarHBondContact O-NH2 3.36Å; S235-R239 WeakPolarHBondContact O-CB 3.22Å; S235-R239 PolarHBondContact O-N 3.2Å; R239-V241 PolarHBondContact O-N 3.06Å; R239-F242 PolarHBondContact O-N 3.04Å; R239-C243 WeakPolarHBondContact O-CB 3.43Å; R239-C243 PolarHBondContact O-N 2.83Å; R239-C243 PolarHBondContact O-SG 2.87Å; R239-C243 VanDerWaalsContact O-SG 3.37Å
240	V	84.3	Confident	85.6	Confident	96 Å²	96	32.9 Å²	32.9	58%	0.582	18%	0.183	S	C	*	.	H	α-helix	trans	-58.7	-48.1	177.3	172.2	0	0	0	0	110.5	P236 T238 F242 S244	P236-V240 WeakPolarHBondContact O-CG2 3.49Å; P236-V240 PolarHBondContact O-N 2.83Å; T238-V240 PolarHBondContact O-N 3.41Å; V240-F242 PolarHBondContact O-N 2.93Å; V240-S244 WeakPolarHBondContact O-CB 3.3Å; V240-S244 PolarHBondContact O-N 3.29Å; V240-S244 PolarHBondContact O-OG 3.4Å
241	V	85.3	Confident	85.5	Confident	50 Å²	50	34.1 Å²	34.1	30%	0.303	19%	0.192	S	C	.	.	H	α-helix	trans	-64.3	-40.6	179.6	177.9	0	0	0	0	111.9	W26 F34 K237 T238 R239 L245 G246	W26-V241 HydrophobicContact CH2-CG1 4.29Å; W26-V241 HydrophobicContact CZ2-CB 4.25Å; W26-V241 HydrophobicContact CZ2-CG1 4.32Å; W26-V241 HydrophobicContact CZ2-CG2 4.17Å; F34-V241 HydrophobicContact CE2-CG1 4.16Å; F34-V241 HydrophobicContact CZ-CG1 4.43Å; K237-V241 PolarHBondContact O-N 3.14Å; T238-V241 PolarHBondContact O-N 3.43Å; R239-V241 PolarHBondContact O-N 3.06Å; V241-L245 WeakPolarHBondContact O-CB 3.48Å; V241-L245 PolarHBondContact O-N 3.41Å; V241-G246 PolarHBondContact O-N 3.27Å
242	F	87.3	Confident	85.6	Confident	0 Å²	0	33 Å²	33	0%	0	18%	0.183	C	C	.	.	I	π-helix	trans	-65	-52	178.9	179.5	-102.1	0	0	0	112	F34 L37 I41 L234 T238 R239 V240 S244 G246 V247	F34-F242 HydrophobicContact CD2-CB 3.75Å; F34-F242 AromaticContact CD2-CD2 3.65Å; F34-F242 HydrophobicContact CD2-CD2 3.65Å; F34-F242 HydrophobicContact CD2-CG 4.15Å; F34-F242 HydrophobicContact CE2-CB 3.65Å; F34-F242 AromaticContact CE2-CD2 3.83Å; F34-F242 HydrophobicContact CE2-CD2 3.83Å; F34-F242 HydrophobicContact CE2-CG 4.25Å; F34-F242 HydrophobicContact CG-CD2 4.08Å; F34-F242 HydrophobicContact CZ-CD2 4.38Å; L37-F242 HydrophobicContact CB-CE2 3.82Å; L37-F242 HydrophobicContact CB-CZ 3.59Å; L37-F242 HydrophobicContact CD1-CE1 4.41Å; L37-F242 HydrophobicContact CD1-CZ 4.01Å; L37-F242 HydrophobicContact CG-CZ 4.47Å; I41-F242 HydrophobicContact CD1-CZ 4.39Å; L234-F242 HydrophobicContact CD1-CB 3.45Å; L234-F242 VanDerWaalsContact CD1-CB 3.45Å; L234-F242 HydrophobicContact CD1-CD1 3.83Å; L234-F242 HydrophobicContact CD1-CD2 4.05Å; L234-F242 HydrophobicContact CD1-CG 3.49Å; L234-F242 VanDerWaalsContact CD1-CG 3.49Å; T238-F242 WeakPolarHBondContact O-CB 3.32Å; T238-F242 PolarHBondContact O-N 3Å; R239-F242 PolarHBondContact O-N 3.04Å; V240-F242 PolarHBondContact O-N 2.93Å; F242-S244 VanDerWaalsContact C-N 3.32Å; F242-S244 PolarHBondContact O-N 3.25Å; F242-G246 WeakPolarHBondContact O-CA 3.22Å; F242-G246 PolarHBondContact O-N 3.37Å; F242-G246 VanDerWaalsContact O-N 3.1Å; F242-V247 HydrophobicContact CD1-CG2 3.91Å; F242-V247 HydrophobicContact CD2-CG2 4.42Å; F242-V247 HydrophobicContact CE1-CG2 3.43Å; F242-V247 VanDerWaalsContact CE1-CG2 3.43Å; F242-V247 HydrophobicContact CE2-CG2 4.01Å; F242-V247 HydrophobicContact CG-CG2 4.38Å; F242-V247 HydrophobicContact CZ-CG2 3.48Å; F242-V247 VanDerWaalsContact CZ-CG2 3.48Å; F242-V247 WeakPolarHBondContact O-CG2 3.45Å; F242-V247 PolarHBondContact O-N 2.87Å
243	C	81.8	Confident	85.7	Confident	26 Å²	26	36.4 Å²	36.4	18%	0.176	20%	0.201	C	C	.	.	I	π-helix	trans	-68.2	-29.8	-178.3	-67.3	0	0	0	0	113	F227 R239 F248	F227-C243 HydrophobicContact CE2-CB 3.65Å; F227-C243 HydrophobicContact CZ-CB 3.97Å; R239-C243 WeakPolarHBondContact O-CB 3.43Å; R239-C243 PolarHBondContact O-N 2.83Å; R239-C243 PolarHBondContact O-SG 2.87Å; R239-C243 VanDerWaalsContact O-SG 3.37Å; C243-F248 VanDerWaalsContact O-CE2 3.3Å; C243-F248 WeakPolarHBondContact O-CE2 3.28Å
244	S	76.3	Confident	85.8	Confident	36 Å²	36	35.6 Å²	35.6	25%	0.252	20%	0.196	S	C	.	.	I	π-helix	trans	-93.5	-31.1	-176.2	65.1	0	0	0	0	114.5	V240 F242 F248	V240-S244 WeakPolarHBondContact O-CB 3.3Å; V240-S244 PolarHBondContact O-N 3.29Å; V240-S244 PolarHBondContact O-OG 3.4Å; F242-S244 VanDerWaalsContact C-N 3.32Å; F242-S244 PolarHBondContact O-N 3.25Å; S244-F248 WeakPolarHBondContact O-CD2 3.33Å
245	L	79	Confident	85.8	Confident	56 Å²	56	35.7 Å²	35.7	29%	0.293	20%	0.196	S	C	.	.	I	π-helix	trans	-127.1	-49.2	-176.3	-173.2	67.9	0	0	0	112	V241 V247 F248 M249 L403	V241-L245 WeakPolarHBondContact O-CB 3.48Å; V241-L245 PolarHBondContact O-N 3.41Å; L245-V247 PolarHBondContact O-N 3.13Å; L245-F248 PolarHBondContact O-N 3.17Å; L245-M249 HydrophobicContact CD1-CE 4Å; L245-M249 HydrophobicContact CD1-CG 3.56Å; L245-M249 HydrophobicContact CD1-SD 4Å; L245-M249 HydrophobicContact CG-CG 3.72Å; L245-M249 VanDerWaalsContact O-CB 3.28Å; L245-M249 WeakPolarHBondContact O-CB 3.2Å; L245-M249 WeakPolarHBondContact O-CG 3.43Å; L245-M249 PolarHBondContact O-N 3.3Å; L245-L403 HydrophobicContact CB-CD1 4.32Å; L245-L403 HydrophobicContact CD1-CD1 4.15Å
246	G	83.2	Confident	86.2	Confident	7 Å²	7	36.6 Å²	36.6	7%	0.072	20%	0.199	C	C	.	.	I	π-helix	trans	-56.7	-47.6	-172.6	0	0	0	0	0	113.9	V241 F242 S250	V241-G246 PolarHBondContact O-N 3.27Å; F242-G246 WeakPolarHBondContact O-CA 3.22Å; F242-G246 PolarHBondContact O-N 3.37Å; F242-G246 VanDerWaalsContact O-N 3.1Å; G246-S250 WeakPolarHBondContact O-CB 3.09Å; G246-S250 PolarHBondContact O-N 3.42Å; G246-S250 PolarHBondContact O-OG 2.97Å
247	V	83.8	Confident	86.7	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-66.1	-47.9	-179.2	167.2	0	0	0	0	111.6	I41 Y223 F227 F242 L245 S250 S251	I41-V247 HydrophobicContact CD1-CB 4.18Å; I41-V247 HydrophobicContact CD1-CG1 4.04Å; I41-V247 HydrophobicContact CD1-CG2 3.8Å; Y223-V247 HydrophobicContact CE1-CG1 4.33Å; Y223-V247 HydrophobicContact CE2-CG1 3.74Å; Y223-V247 VanDerWaalsContact CZ-CG1 3.49Å; Y223-V247 WeakPolarHBondContact OH-CG1 3.33Å; F227-V247 HydrophobicContact CD2-CB 4.45Å; F227-V247 HydrophobicContact CD2-CG1 4.2Å; F227-V247 HydrophobicContact CD2-CG2 4.02Å; F242-V247 HydrophobicContact CD1-CG2 3.91Å; F242-V247 HydrophobicContact CD2-CG2 4.42Å; F242-V247 HydrophobicContact CE1-CG2 3.43Å; F242-V247 VanDerWaalsContact CE1-CG2 3.43Å; F242-V247 HydrophobicContact CE2-CG2 4.01Å; F242-V247 HydrophobicContact CG-CG2 4.38Å; F242-V247 HydrophobicContact CZ-CG2 3.48Å; F242-V247 VanDerWaalsContact CZ-CG2 3.48Å; F242-V247 WeakPolarHBondContact O-CG2 3.45Å; F242-V247 PolarHBondContact O-N 2.87Å; L245-V247 PolarHBondContact O-N 3.13Å; V247-S250 PolarHBondContact O-N 3.33Å; V247-S251 PolarHBondContact O-N 2.81Å; V247-S251 VanDerWaalsContact O-N 3.09Å
248	F	81.3	Confident	87	Confident	32 Å²	32	28.7 Å²	28.7	14%	0.14	17%	0.167	C	C	.	.	H	α-helix	trans	-68.2	-43	-178.8	-65.8	-72.4	0	0	0	112.1	C243 S244 L245 S250 S251 A252 Y399	C243-F248 VanDerWaalsContact O-CE2 3.3Å; C243-F248 WeakPolarHBondContact O-CE2 3.28Å; S244-F248 WeakPolarHBondContact O-CD2 3.33Å; L245-F248 PolarHBondContact O-N 3.17Å; F248-S250 VanDerWaalsContact C-N 3.34Å; F248-S250 PolarHBondContact O-N 3.32Å; F248-S251 PolarHBondContact O-N 3.17Å; F248-A252 WeakPolarHBondContact O-CB 3.27Å; F248-A252 PolarHBondContact O-N 3.26Å; F248-Y399 HydrophobicContact CB-CD1 4.28Å; F248-Y399 HydrophobicContact CB-CD2 3.93Å; F248-Y399 HydrophobicContact CB-CE1 4.15Å; F248-Y399 HydrophobicContact CB-CE2 3.75Å; F248-Y399 HydrophobicContact CB-CG 4.18Å; F248-Y399 AromaticContact CD1-CE1 3.95Å; F248-Y399 HydrophobicContact CD1-CE1 3.95Å; F248-Y399 AromaticContact CD1-CZ 3.98Å; F248-Y399 HydrophobicContact CG-CD1 4.41Å; F248-Y399 HydrophobicContact CG-CE1 4.17Å
249	M	85.8	Confident	87.3	Confident	41 Å²	41	28.8 Å²	28.8	20%	0.202	17%	0.167	C	C	.	.	H	α-helix	trans	-60.1	-43.9	174.4	-71.4	-62.5	96.3	0	0	111.9	L245 S251 A252 L253 V396 Y399	L245-M249 HydrophobicContact CD1-CE 4Å; L245-M249 HydrophobicContact CD1-CG 3.56Å; L245-M249 HydrophobicContact CD1-SD 4Å; L245-M249 HydrophobicContact CG-CG 3.72Å; L245-M249 VanDerWaalsContact O-CB 3.28Å; L245-M249 WeakPolarHBondContact O-CB 3.2Å; L245-M249 WeakPolarHBondContact O-CG 3.43Å; L245-M249 PolarHBondContact O-N 3.3Å; M249-S251 VanDerWaalsContact C-N 3.31Å; M249-S251 PolarHBondContact O-N 2.59Å; M249-A252 PolarHBondContact O-N 3.21Å; M249-L253 WeakPolarHBondContact O-CG 3.19Å; M249-L253 PolarHBondContact O-N 3.17Å; M249-V396 HydrophobicContact CE-CB 4.21Å; M249-V396 HydrophobicContact CE-CG1 4.1Å; M249-V396 HydrophobicContact CE-CG2 4.1Å; M249-V396 HydrophobicContact SD-CB 4.48Å; M249-V396 HydrophobicContact SD-CG1 3.88Å; M249-V396 HydrophobicContact SD-CG2 4.21Å; M249-Y399 HydrophobicContact CE-CD2 3.29Å; M249-Y399 HydrophobicContact CE-CE2 4.19Å; M249-Y399 HydrophobicContact CE-CG 4.03Å
250	S	90.7	Very high	87.7	Confident	15 Å²	15	30 Å²	30	11%	0.105	18%	0.179	C	C	.	.	H	α-helix	trans	-63.8	-39.8	180	-58	0	0	0	0	111.6	G38 G246 V247 F248 G254	G38-S250 VanDerWaalsContact CA-OG 3.28Å; G38-S250 WeakPolarHBondContact CA-OG 2.96Å; G38-S250 VanDerWaalsContact O-CB 3.22Å; G38-S250 WeakPolarHBondContact O-CB 3.3Å; G38-S250 PolarHBondContact O-OG 3.39Å; G246-S250 WeakPolarHBondContact O-CB 3.09Å; G246-S250 PolarHBondContact O-N 3.42Å; G246-S250 PolarHBondContact O-OG 2.97Å; V247-S250 PolarHBondContact O-N 3.33Å; F248-S250 VanDerWaalsContact C-N 3.34Å; F248-S250 PolarHBondContact O-N 3.32Å; S250-G254 PolarHBondContact O-N 3.29Å
251	S	88.9	Confident	88.2	Confident	27 Å²	27	27.4 Å²	27.4	19%	0.189	16%	0.163	C	C	.	.	H	α-helix	trans	-65.3	-44.3	173.6	-169.4	0	0	0	0	111.7	G45 V247 F248 M249 L253 G254 Y255	G45-S251 WeakPolarHBondContact CA-O 3.44Å; V247-S251 PolarHBondContact O-N 2.81Å; V247-S251 VanDerWaalsContact O-N 3.09Å; F248-S251 PolarHBondContact O-N 3.17Å; M249-S251 VanDerWaalsContact C-N 3.31Å; M249-S251 PolarHBondContact O-N 2.59Å; S251-L253 VanDerWaalsContact C-N 3.33Å; S251-L253 PolarHBondContact O-N 3.07Å; S251-G254 PolarHBondContact O-N 2.95Å; S251-Y255 PolarHBondContact O-N 3.06Å
252	A	89.8	Confident	88.6	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-63	-37.2	178.1	0	0	0	0	0	112.2	F248 M249 Y255 M256 V396 Y399	F248-A252 WeakPolarHBondContact O-CB 3.27Å; F248-A252 PolarHBondContact O-N 3.26Å; M249-A252 PolarHBondContact O-N 3.21Å; A252-Y255 PolarHBondContact O-N 2.67Å; A252-M256 HydrophobicContact CB-CE 4.44Å; A252-M256 WeakPolarHBondContact O-CB 3.2Å; A252-M256 WeakPolarHBondContact O-CE 3.17Å; A252-M256 WeakPolarHBondContact O-CG 3.48Å; A252-M256 PolarHBondContact O-N 3.12Å; A252-V396 HydrophobicContact CB-CG2 4.16Å; A252-Y399 HydrophobicContact CB-CE2 4.42Å
253	L	92.4	Very high	88.9	Confident	98 Å²	98	29.2 Å²	29.2	51%	0.513	17%	0.167	S	C	.	.	H	α-helix	trans	-61.1	-44.6	172.8	-73.3	171.1	0	0	0	111.8	M249 S251 Y255 M256 A257	M249-L253 WeakPolarHBondContact O-CG 3.19Å; M249-L253 PolarHBondContact O-N 3.17Å; S251-L253 VanDerWaalsContact C-N 3.33Å; S251-L253 PolarHBondContact O-N 3.07Å; L253-Y255 VanDerWaalsContact C-N 3.34Å; L253-M256 HydrophobicContact CD2-CE 3.91Å; L253-M256 HydrophobicContact CG-CE 4.44Å; L253-M256 PolarHBondContact O-N 2.83Å; L253-A257 WeakPolarHBondContact O-CB 3.41Å; L253-A257 PolarHBondContact O-N 2.81Å
254	G	92.5	Very high	89.5	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-60.5	-43.8	173.2	0	0	0	0	0	112.5	I42 F46 S250 S251 A257 M258	I42-G254 VanDerWaalsContact O-CA 3.3Å; I42-G254 WeakPolarHBondContact O-CA 3.4Å; F46-G254 WeakPolarHBondContact CD2-O 3.45Å; S250-G254 PolarHBondContact O-N 3.29Å; S251-G254 PolarHBondContact O-N 2.95Å; G254-A257 PolarHBondContact O-N 3.42Å; G254-M258 PolarHBondContact O-N 3.21Å
255	Y	91.9	Very high	90.4	Very high	3 Å²	3	36 Å²	36	1%	0.012	19%	0.192	C	C	.	.	H	α-helix	trans	-64.6	-43.5	177.9	-176	-165.6	0	0	0	111.8	I49 S251 A252 L253 A257 M258 P259 S391 A392	I49-Y255 HydrophobicContact CB-CD2 4.16Å; I49-Y255 HydrophobicContact CB-CE2 4.11Å; I49-Y255 HydrophobicContact CD1-CD1 3.61Å; I49-Y255 HydrophobicContact CD1-CD2 3.18Å; I49-Y255 HydrophobicContact CD1-CE1 3.71Å; I49-Y255 HydrophobicContact CD1-CE2 3.31Å; I49-Y255 HydrophobicContact CD1-CG 3.37Å; I49-Y255 HydrophobicContact CG1-CD2 4.2Å; I49-Y255 HydrophobicContact CG1-CE2 4.23Å; I49-Y255 HydrophobicContact CG2-CD2 4.08Å; I49-Y255 HydrophobicContact CG2-CE2 3.53Å; S251-Y255 PolarHBondContact O-N 3.06Å; A252-Y255 PolarHBondContact O-N 2.67Å; L253-Y255 VanDerWaalsContact C-N 3.34Å; Y255-A257 VanDerWaalsContact C-N 3.33Å; Y255-A257 PolarHBondContact O-N 3.38Å; Y255-M258 WeakPolarHBondContact O-CB 3.4Å; Y255-M258 PolarHBondContact O-N 3.42Å; Y255-P259 WeakPolarHBondContact O-CD 3.4Å; Y255-S391 PolarHBondContact OH-OG 2.68Å; Y255-A392 HydrophobicContact CD1-CB 3.4Å; Y255-A392 VanDerWaalsContact CD1-CB 3.4Å; Y255-A392 HydrophobicContact CD2-CB 3.75Å; Y255-A392 VanDerWaalsContact CE1-CA 3.49Å; Y255-A392 HydrophobicContact CE1-CB 3.64Å; Y255-A392 HydrophobicContact CE2-CB 3.96Å; Y255-A392 HydrophobicContact CG-CB 3.44Å; Y255-A392 VanDerWaalsContact CG-CB 3.44Å
256	M	94.1	Very high	91.1	Very high	34 Å²	34	37.9 Å²	37.9	17%	0.167	20%	0.195	C	C	.	.	H	α-helix	trans	-64.9	-34.5	175.8	-75	-176.6	-75.1	0	0	112.9	A252 L253 M258 P259 V260 F389 A392 A393 V396	A252-M256 HydrophobicContact CB-CE 4.44Å; A252-M256 WeakPolarHBondContact O-CB 3.2Å; A252-M256 WeakPolarHBondContact O-CE 3.17Å; A252-M256 WeakPolarHBondContact O-CG 3.48Å; A252-M256 PolarHBondContact O-N 3.12Å; L253-M256 HydrophobicContact CD2-CE 3.91Å; L253-M256 HydrophobicContact CG-CE 4.44Å; L253-M256 PolarHBondContact O-N 2.83Å; M256-M258 VanDerWaalsContact C-N 3.31Å; M256-M258 PolarHBondContact O-N 2.94Å; M256-P259 WeakPolarHBondContact O-CD 3.17Å; M256-P259 WeakPolarHBondContact O-CG 3.43Å; M256-V260 WeakPolarHBondContact O-CG2 3.37Å; M256-F389 HydrophobicContact CB-CD2 4.32Å; M256-F389 HydrophobicContact CB-CE2 4.04Å; M256-F389 HydrophobicContact CG-CE2 4.34Å; M256-A392 HydrophobicContact CB-CB 4.34Å; M256-A392 HydrophobicContact CG-CB 3.58Å; M256-A393 HydrophobicContact SD-CB 4.15Å; M256-V396 HydrophobicContact CE-CG2 4Å
257	A	93.3	Very high	91.6	Very high	41 Å²	41	41.7 Å²	41.7	34%	0.339	21%	0.211	S	C	.	.	H	α-helix	trans	-68.1	-30.8	177.2	0	0	0	0	0	112.6	F46 L253 G254 Y255 V260 V261	F46-A257 HydrophobicContact CD2-CB 4.02Å; F46-A257 HydrophobicContact CE2-CB 4.18Å; L253-A257 WeakPolarHBondContact O-CB 3.41Å; L253-A257 PolarHBondContact O-N 2.81Å; G254-A257 PolarHBondContact O-N 3.42Å; Y255-A257 VanDerWaalsContact C-N 3.33Å; Y255-A257 PolarHBondContact O-N 3.38Å; A257-V260 WeakPolarHBondContact O-CB 3.33Å; A257-V260 PolarHBondContact O-N 3Å; A257-V261 WeakPolarHBondContact O-CG2 3.33Å; A257-V261 PolarHBondContact O-N 2.82Å
258	M	92.7	Very high	92.1	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-56.9	-56.6	-175.9	-163.6	-77.3	134.4	0	0	114.4	F46 F53 G254 Y255 M256 V260 V261 A262 L271	F46-M258 HydrophobicContact CD2-CB 3.78Å; F46-M258 HydrophobicContact CD2-CG 4.24Å; F46-M258 HydrophobicContact CE2-CB 4.09Å; F46-M258 HydrophobicContact CE2-CG 4.44Å; F46-M258 HydrophobicContact CG-CB 4.36Å; F46-M258 HydrophobicContact CG-CG 4.46Å; F46-M258 WeakPolarHBondContact O-CG 3.43Å; F53-M258 HydrophobicContact CB-CE 4.38Å; F53-M258 HydrophobicContact CD2-CE 3.37Å; F53-M258 HydrophobicContact CD2-SD 3.25Å; F53-M258 WeakPolarHBondContact CD2-SD 3.3Å; F53-M258 HydrophobicContact CE2-CE 3.95Å; F53-M258 HydrophobicContact CE2-SD 3.24Å; F53-M258 WeakPolarHBondContact CE2-SD 3.46Å; F53-M258 HydrophobicContact CG-CE 4.14Å; F53-M258 HydrophobicContact CG-SD 4.46Å; F53-M258 HydrophobicContact CZ-SD 4.46Å; G254-M258 PolarHBondContact O-N 3.21Å; Y255-M258 WeakPolarHBondContact O-CB 3.4Å; Y255-M258 PolarHBondContact O-N 3.42Å; M256-M258 VanDerWaalsContact C-N 3.31Å; M256-M258 PolarHBondContact O-N 2.94Å; M258-V260 VanDerWaalsContact C-N 3.26Å; M258-V260 PolarHBondContact O-N 2.7Å; M258-V261 PolarHBondContact O-N 3.25Å; M258-A262 HydrophobicContact CE-CB 3.81Å; M258-A262 PolarHBondContact O-N 2.89Å; M258-L271 HydrophobicContact CE-CD1 4.14Å; M258-L271 HydrophobicContact CE-CD2 3.83Å; M258-L271 HydrophobicContact CE-CG 4.36Å
259	P	93.7	Very high	92.8	Very high	2 Å²	2	45 Å²	45	1%	0.013	22%	0.223	C	C	.	.	H	α-helix	trans	-65.3	-28.6	178.8	25.9	-34.6	0	0	0	113	F53 Y255 M256 A262 F263 Y385 C388 F389	F53-P259 HydrophobicContact CE2-CB 4.23Å; F53-P259 HydrophobicContact CZ-CB 3.81Å; Y255-P259 WeakPolarHBondContact O-CD 3.4Å; M256-P259 WeakPolarHBondContact O-CD 3.17Å; M256-P259 WeakPolarHBondContact O-CG 3.43Å; P259-A262 PolarHBondContact O-N 3.4Å; P259-F263 WeakPolarHBondContact O-CB 3.32Å; P259-F263 PolarHBondContact O-N 3.38Å; P259-Y385 WeakPolarHBondContact CB-O 3.5Å; P259-C388 HydrophobicContact CB-CB 3.92Å; P259-C388 HydrophobicContact CG-CB 4.34Å; P259-F389 HydrophobicContact CB-CB 4.47Å; P259-F389 HydrophobicContact CG-CB 3.89Å; P259-F389 HydrophobicContact CG-CD2 4.33Å
260	V	94	Very high	93.3	Very high	67 Å²	67	46.6 Å²	46.6	41%	0.406	23%	0.231	S	C	.	.	H	α-helix	trans	-65.2	-46.2	175.6	179	0	0	0	0	110.1	M256 A257 M258 F263 F264 F389	M256-V260 WeakPolarHBondContact O-CG2 3.37Å; A257-V260 WeakPolarHBondContact O-CB 3.33Å; A257-V260 PolarHBondContact O-N 3Å; M258-V260 VanDerWaalsContact C-N 3.26Å; M258-V260 PolarHBondContact O-N 2.7Å; V260-F263 WeakPolarHBondContact O-CB 3.46Å; V260-F263 PolarHBondContact O-N 3.4Å; V260-F264 HydrophobicContact CG1-CE2 4.14Å; V260-F264 WeakPolarHBondContact O-CD2 3.33Å; V260-F389 HydrophobicContact CG2-CD2 4.04Å; V260-F389 HydrophobicContact CG2-CE2 4.26Å
261	V	94.3	Very high	93.4	Very high	41 Å²	41	46.1 Å²	46.1	25%	0.248	23%	0.228	C	C	.	.	H	α-helix	trans	-66.8	-41.4	176.3	177	0	0	0	0	111.2	F46 A257 M258 F263 F264 L265 L271 A274	F46-V261 HydrophobicContact CE2-CB 3.99Å; F46-V261 HydrophobicContact CE2-CG2 3.72Å; F46-V261 HydrophobicContact CZ-CB 3.76Å; F46-V261 HydrophobicContact CZ-CG1 3.96Å; F46-V261 HydrophobicContact CZ-CG2 3.75Å; A257-V261 WeakPolarHBondContact O-CG2 3.33Å; A257-V261 PolarHBondContact O-N 2.82Å; M258-V261 PolarHBondContact O-N 3.25Å; V261-F263 VanDerWaalsContact C-N 3.26Å; V261-F263 PolarHBondContact O-N 3.5Å; V261-F264 PolarHBondContact O-N 3.38Å; V261-L265 HydrophobicContact CG1-CD1 3.76Å; V261-L265 HydrophobicContact CG1-CG 4.31Å; V261-L265 PolarHBondContact O-N 2.94Å; V261-L271 HydrophobicContact CG1-CD1 3.97Å; V261-A274 HydrophobicContact CG1-CB 4.02Å
262	A	93.2	Very high	93.7	Very high	1 Å²	1	44.8 Å²	44.8	1%	0.008	22%	0.219	C	C	.	.	H	α-helix	trans	-62.5	-31.2	178	0	0	0	0	0	113.1	F53 M258 P259 F264 L265 L271 Y385	F53-A262 HydrophobicContact CB-CB 4.34Å; F53-A262 HydrophobicContact CD1-CB 3.96Å; F53-A262 HydrophobicContact CD2-CB 4.05Å; F53-A262 HydrophobicContact CE1-CB 4.26Å; F53-A262 HydrophobicContact CE2-CB 4.31Å; F53-A262 HydrophobicContact CG-CB 3.83Å; F53-A262 HydrophobicContact CZ-CB 4.41Å; M258-A262 HydrophobicContact CE-CB 3.81Å; M258-A262 PolarHBondContact O-N 2.89Å; P259-A262 PolarHBondContact O-N 3.4Å; A262-F264 VanDerWaalsContact C-N 3.3Å; A262-F264 PolarHBondContact O-N 2.84Å; A262-L265 CarbonylContact O-C 3.59Å; A262-L265 PolarHBondContact O-N 3.34Å; A262-L271 HydrophobicContact CB-CD1 4.16Å; A262-L271 HydrophobicContact CB-CD2 4.15Å; A262-Y385 HydrophobicContact CB-CD1 3.93Å; A262-Y385 HydrophobicContact CB-CE1 3.69Å; A262-Y385 VanDerWaalsContact O-CE1 3.27Å; A262-Y385 WeakPolarHBondContact O-CE1 3.41Å
263	F	93.6	Very high	93.9	Very high	86 Å²	86	48.9 Å²	48.9	38%	0.377	24%	0.24	S	C	.	.	H	α-helix	trans	-62.2	-38	175.7	177.3	-98.9	0	0	0	112.6	P259 V260 V261 R266 Y385	P259-F263 WeakPolarHBondContact O-CB 3.32Å; P259-F263 PolarHBondContact O-N 3.38Å; V260-F263 WeakPolarHBondContact O-CB 3.46Å; V260-F263 PolarHBondContact O-N 3.4Å; V261-F263 VanDerWaalsContact C-N 3.26Å; V261-F263 PolarHBondContact O-N 3.5Å; F263-R266 PolarHBondContact O-NE 2.99Å; F263-Y385 HydrophobicContact CB-CD1 4.05Å; F263-Y385 HydrophobicContact CB-CG 4.06Å; F263-Y385 AromaticContact CD2-CD2 3.85Å; F263-Y385 HydrophobicContact CD2-CD2 3.85Å; F263-Y385 HydrophobicContact CD2-CE2 4.35Å; F263-Y385 HydrophobicContact CD2-CG 4.1Å
264	F	94.6	Very high	93.9	Very high	152 Å²	152	45.6 Å²	45.6	67%	0.667	23%	0.227	S	C	*	.	H	α-helix	trans	-83.1	-37.4	176.7	-65.3	-70.5	0	0	0	112.4	V260 V261 A262	V260-F264 HydrophobicContact CG1-CE2 4.14Å; V260-F264 WeakPolarHBondContact O-CD2 3.33Å; V261-F264 PolarHBondContact O-N 3.38Å; A262-F264 VanDerWaalsContact C-N 3.3Å; A262-F264 PolarHBondContact O-N 2.84Å
265	L	95	Very high	93.9	Very high	53 Å²	53	45.6 Å²	45.6	28%	0.277	23%	0.227	S	C	.	.			trans	-107.9	87.1	-177.5	-58	-179.1	0	0	0	110.5	V261 A262 L270 L271 A274	V261-L265 HydrophobicContact CG1-CD1 3.76Å; V261-L265 HydrophobicContact CG1-CG 4.31Å; V261-L265 PolarHBondContact O-N 2.94Å; A262-L265 CarbonylContact O-C 3.59Å; A262-L265 PolarHBondContact O-N 3.34Å; L265-L270 HydrophobicContact CD2-CB 4.48Å; L265-L271 HydrophobicContact CB-CB 4.44Å; L265-L271 HydrophobicContact CB-CD1 4.34Å; L265-A274 HydrophobicContact CD1-CB 3.58Å
266	R	93.6	Very high	93.9	Very high	95 Å²	95	46 Å²	46	36%	0.358	23%	0.231	S	C	.	.			trans	-88.7	0.4	-174.2	-54.6	-178.1	-165.5	175	7.1	114.7	Q137 F263	Q137-R266 HydrophobicContact CB-CB 4.43Å; Q137-R266 HydrophobicContact CG-CB 4.16Å; Q137-R266 PolarHBondContact N-O 3.42Å; F263-R266 PolarHBondContact O-NE 2.99Å
267	E	95.3	Very high	93.8	Very high	88 Å²	88	46.7 Å²	46.7	41%	0.411	24%	0.242	S	C	.	.	B	Isolated β-bridge	trans	-100.9	130.2	172.6	-67.7	179	-140.6	0	0	109.5	Q137 R269 L270 L271	Q137-E267 HydrophobicContact CB-CG 3.64Å; Q137-E267 HydrophobicContact CG-CG 4.48Å; E267-R269 VanDerWaalsContact C-N 3.3Å; E267-R269 PolarHBondContact O-N 3.29Å; E267-L270 HydrophobicContact CB-CB 4.19Å; E267-L270 HydrophobicContact CB-CD1 4.05Å; E267-L270 HydrophobicContact CB-CG 4.08Å; E267-L270 HydrophobicContact CG-CD1 4.31Å; E267-L270 PolarHBondContact O-N 2.58Å; E267-L271 WeakPolarHBondContact O-CB 3.46Å; E267-L271 PolarHBondContact O-N 3.33Å
268	W	94.6	Very high	93.7	Very high	5 Å²	5	45.8 Å²	45.8	2%	0.019	23%	0.233	C	C	.	.	H	α-helix	trans	-60.7	-36.1	-173.3	71.6	-88.3	0	0	0	113.9	V54 S138 I140 W144 F208 L272	V54-W268 HydrophobicContact CB-CB 4.34Å; V54-W268 HydrophobicContact CG1-CB 4.01Å; V54-W268 HydrophobicContact CG1-CE3 4.47Å; V54-W268 HydrophobicContact CG2-CB 3.96Å; S138-W268 PolarHBondContact O-N 2.89Å; S138-W268 VanDerWaalsContact O-N 3.09Å; I140-W268 HydrophobicContact CG2-CD2 4.05Å; I140-W268 HydrophobicContact CG2-CE3 4.04Å; I140-W268 HydrophobicContact CG2-CG 4.49Å; I140-W268 HydrophobicContact CG2-CZ3 4.38Å; W144-W268 HydrophobicContact CH2-CH2 4.41Å; F208-W268 HydrophobicContact CD2-CZ3 4.44Å; F208-W268 HydrophobicContact CE2-CZ3 4.31Å; W268-L272 HydrophobicContact CE3-CD1 3.59Å; W268-L272 HydrophobicContact CE3-CG 4.45Å; W268-L272 HydrophobicContact CZ3-CD1 3.6Å; W268-L272 WeakPolarHBondContact O-CG 3.4Å; W268-L272 PolarHBondContact O-N 3.46Å
269	R	95.3	Very high	93.6	Very high	97 Å²	97	46 Å²	46	37%	0.366	24%	0.235	S	C	.	.	H	α-helix	trans	-68.8	-43.2	177	-69.2	-171	177.1	172	3.3	112.3	E143 I200 E267 L271 L272 I273	E143-R269 IonicContact OE1-NH2 3.6Å; I200-R269 HydrophobicContact CG2-CB 4.31Å; I200-R269 PolarHBondContact O-NE 3.44Å; E267-R269 VanDerWaalsContact C-N 3.3Å; E267-R269 PolarHBondContact O-N 3.29Å; R269-L271 VanDerWaalsContact C-N 3.31Å; R269-L271 PolarHBondContact O-N 2.93Å; R269-L272 PolarHBondContact O-N 3.45Å; R269-I273 WeakPolarHBondContact O-CG1 3.27Å; R269-I273 PolarHBondContact O-N 3.47Å
270	L	95.2	Very high	93.5	Very high	73 Å²	73	51.9 Å²	51.9	38%	0.382	27%	0.266	S	S	.	.	H	α-helix	trans	-64.1	-40.3	176.3	-67.2	-179.1	0	0	0	111.1	L265 E267 I273 A274	L265-L270 HydrophobicContact CD2-CB 4.48Å; E267-L270 HydrophobicContact CB-CB 4.19Å; E267-L270 HydrophobicContact CB-CD1 4.05Å; E267-L270 HydrophobicContact CB-CG 4.08Å; E267-L270 HydrophobicContact CG-CD1 4.31Å; E267-L270 PolarHBondContact O-N 2.58Å; L270-I273 HydrophobicContact CD2-CD1 4.19Å; L270-I273 WeakPolarHBondContact O-CB 3.36Å; L270-I273 PolarHBondContact O-N 2.92Å; L270-A274 PolarHBondContact O-N 3.29Å
271	L	94.4	Very high	93.5	Very high	5 Å²	5	51.8 Å²	51.8	3%	0.026	26%	0.263	C	S	.	.	H	α-helix	trans	-59.3	-48	174.5	-174.5	57.5	0	0	0	110.6	F53 V54 M258 V261 A262 L265 E267 R269 I273 A274 M275	F53-L271 HydrophobicContact CB-CD2 4.08Å; V54-L271 HydrophobicContact CG2-CD2 3.94Å; M258-L271 HydrophobicContact CE-CD1 4.14Å; M258-L271 HydrophobicContact CE-CD2 3.83Å; M258-L271 HydrophobicContact CE-CG 4.36Å; V261-L271 HydrophobicContact CG1-CD1 3.97Å; A262-L271 HydrophobicContact CB-CD1 4.16Å; A262-L271 HydrophobicContact CB-CD2 4.15Å; L265-L271 HydrophobicContact CB-CB 4.44Å; L265-L271 HydrophobicContact CB-CD1 4.34Å; E267-L271 WeakPolarHBondContact O-CB 3.46Å; E267-L271 PolarHBondContact O-N 3.33Å; R269-L271 VanDerWaalsContact C-N 3.31Å; R269-L271 PolarHBondContact O-N 2.93Å; L271-I273 VanDerWaalsContact C-N 3.33Å; L271-I273 PolarHBondContact O-N 3.17Å; L271-A274 WeakPolarHBondContact O-CB 3.33Å; L271-A274 PolarHBondContact O-N 2.94Å; L271-A274 VanDerWaalsContact O-N 3.14Å; L271-M275 WeakPolarHBondContact O-CG 3.39Å; L271-M275 PolarHBondContact O-N 3.49Å
272	L	94.3	Very high	93.4	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-59.8	-35.9	175.2	-75.1	179.5	0	0	0	113.7	Y50 L196 Q199 I200 W268 R269 M275 A276	Y50-L272 HydrophobicContact CD2-CD2 3.99Å; Y50-L272 HydrophobicContact CE2-CD2 3.56Å; L196-L272 HydrophobicContact CD2-CD2 4.16Å; Q199-L272 HydrophobicContact CB-CD1 4.25Å; I200-L272 HydrophobicContact CD1-CB 4.37Å; I200-L272 HydrophobicContact CG1-CB 3.55Å; I200-L272 HydrophobicContact CG1-CD1 4.3Å; W268-L272 HydrophobicContact CE3-CD1 3.59Å; W268-L272 HydrophobicContact CE3-CG 4.45Å; W268-L272 HydrophobicContact CZ3-CD1 3.6Å; W268-L272 WeakPolarHBondContact O-CG 3.4Å; W268-L272 PolarHBondContact O-N 3.46Å; R269-L272 PolarHBondContact O-N 3.45Å; L272-M275 HydrophobicContact CD2-SD 4.04Å; L272-M275 WeakPolarHBondContact O-CB 3.41Å; L272-M275 PolarHBondContact O-N 3.2Å; L272-A276 WeakPolarHBondContact O-CB 3.46Å; L272-A276 PolarHBondContact O-N 3.47Å
273	I	94.7	Very high	93.4	Very high	86 Å²	86	54.4 Å²	54.4	44%	0.441	28%	0.277	S	S	.	.	H	α-helix	trans	-60.2	-46.3	173.4	-70	166.5	0	0	0	110.5	I200 R269 L270 L271 M275 A276 A277	I200-I273 HydrophobicContact CD1-CB 4.41Å; I200-I273 HydrophobicContact CD1-CG1 3.65Å; I200-I273 HydrophobicContact CG1-CG1 4.33Å; I200-I273 HydrophobicContact CG2-CG1 4.33Å; R269-I273 WeakPolarHBondContact O-CG1 3.27Å; R269-I273 PolarHBondContact O-N 3.47Å; L270-I273 HydrophobicContact CD2-CD1 4.19Å; L270-I273 WeakPolarHBondContact O-CB 3.36Å; L270-I273 PolarHBondContact O-N 2.92Å; L271-I273 VanDerWaalsContact C-N 3.33Å; L271-I273 PolarHBondContact O-N 3.17Å; I273-M275 PolarHBondContact O-N 3.46Å; I273-A276 PolarHBondContact O-N 3.11Å; I273-A277 WeakPolarHBondContact O-CB 3.35Å; I273-A277 PolarHBondContact O-N 2.91Å
274	A	92.8	Very high	93.5	Very high	29 Å²	29	53 Å²	53	24%	0.24	28%	0.277	C	S	.	.	H	α-helix	trans	-62	-35.8	176.2	0	0	0	0	0	111.7	V261 L265 L270 L271 S278	V261-A274 HydrophobicContact CG1-CB 4.02Å; L265-A274 HydrophobicContact CD1-CB 3.58Å; L270-A274 PolarHBondContact O-N 3.29Å; L271-A274 WeakPolarHBondContact O-CB 3.33Å; L271-A274 PolarHBondContact O-N 2.94Å; L271-A274 VanDerWaalsContact O-N 3.14Å; A274-S278 PolarHBondContact O-N 2.65Å; A274-S278 VanDerWaalsContact O-N 3.17Å
275	M	90.8	Very high	93.5	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-66.8	-46.4	174.4	-44.5	-157.2	82	0	0	112.3	F46 T47 Y50 L196 L271 L272 I273 A277 S278	F46-M275 HydrophobicContact CD1-CB 4.45Å; F46-M275 HydrophobicContact CD1-CE 3.31Å; F46-M275 HydrophobicContact CD1-CG 4.25Å; F46-M275 HydrophobicContact CE1-CB 4.23Å; F46-M275 HydrophobicContact CE1-CE 3.63Å; F46-M275 HydrophobicContact CE1-CG 3.8Å; F46-M275 HydrophobicContact CG-CE 4.22Å; F46-M275 WeakPolarHBondContact O-CE 3.22Å; T47-M275 HydrophobicContact CG2-CE 3.91Å; Y50-M275 VanDerWaalsContact CB-CE 3.43Å; Y50-M275 WeakPolarHBondContact CB-SD 3.49Å; Y50-M275 HydrophobicContact CD1-CE 3.6Å; Y50-M275 HydrophobicContact CD1-SD 3.45Å; Y50-M275 WeakPolarHBondContact CD1-SD 3.22Å; Y50-M275 HydrophobicContact CD2-SD 3.81Å; Y50-M275 HydrophobicContact CE1-SD 4.16Å; Y50-M275 HydrophobicContact CE2-SD 4.45Å; Y50-M275 HydrophobicContact CG-CE 3.72Å; Y50-M275 HydrophobicContact CG-SD 3.22Å; L196-M275 HydrophobicContact CD1-CB 4.31Å; L271-M275 WeakPolarHBondContact O-CG 3.39Å; L271-M275 PolarHBondContact O-N 3.49Å; L272-M275 HydrophobicContact CD2-SD 4.04Å; L272-M275 WeakPolarHBondContact O-CB 3.41Å; L272-M275 PolarHBondContact O-N 3.2Å; I273-M275 PolarHBondContact O-N 3.46Å; M275-A277 VanDerWaalsContact C-N 3.29Å; M275-A277 PolarHBondContact O-N 3.19Å; M275-S278 WeakPolarHBondContact O-CB 3.4Å; M275-S278 PolarHBondContact O-N 3.21Å; M275-S278 VanDerWaalsContact O-N 3.13Å; M275-S278 PolarHBondContact O-OG 3.37Å
276	A	92.6	Very high	93.5	Very high	12 Å²	12	49 Å²	49	10%	0.099	25%	0.254	C	S	.	.	H	α-helix	trans	-61.5	-40.4	177	0	0	0	0	0	110.9	L196 I200 L272 I273 S278 G279	L196-A276 HydrophobicContact CB-CB 4.37Å; I200-A276 HydrophobicContact CD1-CB 4.35Å; L272-A276 WeakPolarHBondContact O-CB 3.46Å; L272-A276 PolarHBondContact O-N 3.47Å; I273-A276 PolarHBondContact O-N 3.11Å; A276-S278 PolarHBondContact O-N 3.16Å; A276-G279 PolarHBondContact O-N 3.11Å
277	A	92.8	Very high	93.6	Very high	48 Å²	48	52.7 Å²	52.7	40%	0.397	27%	0.268	S	S	.	.	H	α-helix	trans	-61.4	-30.9	175.6	0	0	0	0	0	112.8	I273 M275 G279 L280	I273-A277 WeakPolarHBondContact O-CB 3.35Å; I273-A277 PolarHBondContact O-N 2.91Å; M275-A277 VanDerWaalsContact C-N 3.29Å; M275-A277 PolarHBondContact O-N 3.19Å; A277-G279 PolarHBondContact O-N 2.99Å; A277-L280 VanDerWaalsContact O-CB 3.25Å; A277-L280 WeakPolarHBondContact O-CB 3.33Å; A277-L280 WeakPolarHBondContact O-CG 3.45Å; A277-L280 PolarHBondContact O-N 3.43Å
278	S	91.1	Very high	93.5	Very high	21 Å²	21	52.9 Å²	52.9	15%	0.147	27%	0.268	C	S	.	.	H	α-helix	trans	-61.3	-22.7	173.2	79.1	0	0	0	0	112.9	A274 M275 A276 L280 I281	A274-S278 PolarHBondContact O-N 2.65Å; A274-S278 VanDerWaalsContact O-N 3.17Å; M275-S278 WeakPolarHBondContact O-CB 3.4Å; M275-S278 PolarHBondContact O-N 3.21Å; M275-S278 VanDerWaalsContact O-N 3.13Å; M275-S278 PolarHBondContact O-OG 3.37Å; A276-S278 PolarHBondContact O-N 3.16Å; S278-L280 PolarHBondContact O-N 3.05Å; S278-I281 WeakPolarHBondContact O-CB 3.48Å; S278-I281 VanDerWaalsContact O-CG1 3.28Å; S278-I281 WeakPolarHBondContact O-CG1 3.36Å; S278-I281 PolarHBondContact O-N 3.18Å; S278-I281 VanDerWaalsContact O-N 3.12Å
279	G	90.6	Very high	93.5	Very high	6 Å²	6	52.8 Å²	52.8	6%	0.062	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-63.9	-20.8	171.9	0	0	0	0	0	114.2	T193 A276 A277 I281 Y282	T193-G279 WeakPolarHBondContact OG1-CA 3.33Å; A276-G279 PolarHBondContact O-N 3.11Å; A277-G279 PolarHBondContact O-N 2.99Å; G279-I281 PolarHBondContact O-N 3.43Å; G279-Y282 VanDerWaalsContact O-CB 3.29Å; G279-Y282 WeakPolarHBondContact O-CB 3.25Å; G279-Y282 WeakPolarHBondContact O-CD2 3.5Å; G279-Y282 PolarHBondContact O-N 3.23Å
280	L	92	Very high	93.5	Very high	124 Å²	124	49.3 Å²	49.3	65%	0.649	26%	0.258	S	S	*	.	G	3₁₀ helix	trans	-63.6	-23.2	173.6	-64.6	174.9	0	0	0	112.3	A277 S278 Y282 V283 P284	A277-L280 VanDerWaalsContact O-CB 3.25Å; A277-L280 WeakPolarHBondContact O-CB 3.33Å; A277-L280 WeakPolarHBondContact O-CG 3.45Å; A277-L280 PolarHBondContact O-N 3.43Å; S278-L280 PolarHBondContact O-N 3.05Å; L280-Y282 PolarHBondContact O-N 3.4Å; L280-V283 PolarHBondContact O-N 2.9Å; L280-P284 WeakPolarHBondContact O-CD 3.44Å
281	I	92.8	Very high	93.6	Very high	66 Å²	66	47 Å²	47	34%	0.338	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-60	-29.7	172.8	-62.2	172.7	0	0	0	110.7	I39 P43 S278 G279 V283 P284 L285	I39-I281 HydrophobicContact CG2-CG2 3.34Å; P43-I281 HydrophobicContact CG-CD1 4.39Å; S278-I281 WeakPolarHBondContact O-CB 3.48Å; S278-I281 VanDerWaalsContact O-CG1 3.28Å; S278-I281 WeakPolarHBondContact O-CG1 3.36Å; S278-I281 PolarHBondContact O-N 3.18Å; S278-I281 VanDerWaalsContact O-N 3.12Å; G279-I281 PolarHBondContact O-N 3.43Å; I281-V283 PolarHBondContact O-N 2.84Å; I281-P284 VanDerWaalsContact O-CD 3.31Å; I281-P284 WeakPolarHBondContact O-CD 3.37Å; I281-P284 WeakPolarHBondContact O-CG 3.44Å; I281-L285 WeakPolarHBondContact O-CG 3.22Å
282	Y	93.3	Very high	93.6	Very high	11 Å²	11	46.7 Å²	46.7	4%	0.043	24%	0.243	C	C	.	.	H	α-helix	trans	-71.3	-29.4	-178.1	-58.1	-38.4	0	0	0	113.7	S40 P43 F186 M189 Q192 G279 L280 L285	S40-Y282 WeakPolarHBondContact O-CE1 3.26Å; P43-Y282 HydrophobicContact CB-CE1 4.37Å; P43-Y282 WeakPolarHBondContact CB-OH 3.48Å; P43-Y282 HydrophobicContact CG-CE1 3.78Å; F186-Y282 WeakPolarHBondContact CE1-O 3.35Å; M189-Y282 HydrophobicContact CB-CD2 3.63Å; M189-Y282 HydrophobicContact CB-CE2 3.85Å; M189-Y282 HydrophobicContact CB-CG 4Å; M189-Y282 HydrophobicContact CE-CD1 4.01Å; M189-Y282 HydrophobicContact CE-CE1 3.98Å; M189-Y282 HydrophobicContact CG-CD1 4.06Å; M189-Y282 HydrophobicContact CG-CD2 3.94Å; M189-Y282 HydrophobicContact CG-CE1 4.05Å; M189-Y282 HydrophobicContact CG-CE2 3.91Å; M189-Y282 HydrophobicContact CG-CG 3.99Å; M189-Y282 HydrophobicContact SD-CD1 3.66Å; M189-Y282 HydrophobicContact SD-CD2 4.37Å; M189-Y282 HydrophobicContact SD-CE1 4.07Å; M189-Y282 HydrophobicContact SD-CG 3.81Å; Q192-Y282 PolarHBondContact OE1-OH 2.94Å; G279-Y282 VanDerWaalsContact O-CB 3.29Å; G279-Y282 WeakPolarHBondContact O-CB 3.25Å; G279-Y282 WeakPolarHBondContact O-CD2 3.5Å; G279-Y282 PolarHBondContact O-N 3.23Å; L280-Y282 PolarHBondContact O-N 3.4Å; Y282-L285 HydrophobicContact CD1-CD1 4.21Å; Y282-L285 WeakPolarHBondContact O-CB 3.37Å; Y282-L285 PolarHBondContact O-N 2.66Å; Y282-L285 VanDerWaalsContact O-N 3.15Å
283	V	93.3	Very high	93.4	Very high	86 Å²	86	46.9 Å²	46.9	52%	0.521	24%	0.244	S	C	.	.	H	α-helix	trans	-55.7	-55.7	-176.8	-179.7	0	0	0	0	112.4	L280 I281 L285 W286 W287	L280-V283 PolarHBondContact O-N 2.9Å; I281-V283 PolarHBondContact O-N 2.84Å; V283-L285 PolarHBondContact O-N 3.45Å; V283-W286 PolarHBondContact O-N 3.36Å; V283-W287 HydrophobicContact CG1-CH2 4.19Å; V283-W287 HydrophobicContact CG1-CZ3 4.15Å; V283-W287 VanDerWaalsContact O-CZ3 3.26Å; V283-W287 WeakPolarHBondContact O-CZ3 3.36Å
284	P	95.1	Very high	93.2	Very high	56 Å²	56	47.6 Å²	47.6	36%	0.364	24%	0.242	S	C	.	.	H	α-helix	trans	-61.7	-31.2	179	23.2	-33.7	0	0	0	113.3	L280 I281 W286 W287 F288	L280-P284 WeakPolarHBondContact O-CD 3.44Å; I281-P284 VanDerWaalsContact O-CD 3.31Å; I281-P284 WeakPolarHBondContact O-CD 3.37Å; I281-P284 WeakPolarHBondContact O-CG 3.44Å; P284-W286 PolarHBondContact O-N 3.45Å; P284-W286 VanDerWaalsContact O-N 3.12Å; P284-W287 PolarHBondContact O-N 2.95Å; P284-F288 HydrophobicContact CB-CE2 4.14Å; P284-F288 WeakPolarHBondContact O-CD2 3.33Å; P284-F288 WeakPolarHBondContact O-CE2 3.47Å
285	L	95.1	Very high	93	Very high	8 Å²	8	46.8 Å²	46.8	4%	0.042	23%	0.232	C	C	.	.	H	α-helix	trans	-62.6	-24.3	-173.3	-62.5	178.6	0	0	0	113.4	A36 I39 F186 I281 Y282 V283 W287 F288 I289	A36-L285 HydrophobicContact CB-CD2 4.11Å; I39-L285 HydrophobicContact CG2-CD1 4.39Å; I39-L285 HydrophobicContact CG2-CD2 4.3Å; F186-L285 HydrophobicContact CE1-CB 4.11Å; F186-L285 VanDerWaalsContact CZ-C 3.47Å; F186-L285 HydrophobicContact CZ-CB 4.02Å; I281-L285 WeakPolarHBondContact O-CG 3.22Å; Y282-L285 HydrophobicContact CD1-CD1 4.21Å; Y282-L285 WeakPolarHBondContact O-CB 3.37Å; Y282-L285 PolarHBondContact O-N 2.66Å; Y282-L285 VanDerWaalsContact O-N 3.15Å; V283-L285 PolarHBondContact O-N 3.45Å; L285-W287 PolarHBondContact O-N 3.41Å; L285-F288 PolarHBondContact O-N 3.25Å; L285-I289 HydrophobicContact CB-CD1 3.96Å; L285-I289 PolarHBondContact O-N 3.2Å
286	W	95.1	Very high	93	Very high	112 Å²	112	46.8 Å²	46.8	42%	0.424	23%	0.232	S	C	.	.	H	α-helix	trans	-54.7	-36.4	176.8	179.5	-96.6	0	0	0	112.8	K182 F186 V283 P284	K182-W286 WeakPolarHBondContact CE-O 3.45Å; K182-W286 HydrophobicContact CG-CZ3 4.27Å; K182-W286 PolarHBondContact NZ-O 3.46Å; F186-W286 HydrophobicContact CB-CE3 3.93Å; F186-W286 HydrophobicContact CB-CZ3 3.85Å; F186-W286 AromaticContact CD1-CE3 3.91Å; F186-W286 HydrophobicContact CD1-CE3 3.91Å; F186-W286 HydrophobicContact CD2-CD2 4.43Å; F186-W286 AromaticContact CD2-CE3 3.25Å; F186-W286 HydrophobicContact CD2-CE3 3.25Å; F186-W286 AromaticContact CD2-CZ3 3.51Å; F186-W286 HydrophobicContact CD2-CZ3 3.51Å; F186-W286 HydrophobicContact CE1-CB 4.02Å; F186-W286 HydrophobicContact CE1-CE3 4.27Å; F186-W286 AromaticContact CE2-CE3 3.68Å; F186-W286 HydrophobicContact CE2-CE3 3.68Å; F186-W286 HydrophobicContact CE2-CZ3 4.27Å; F186-W286 AromaticContact CG-CE3 3.41Å; F186-W286 HydrophobicContact CG-CE3 3.41Å; F186-W286 VanDerWaalsContact CG-CE3 3.41Å; F186-W286 AromaticContact CG-CZ3 3.76Å; F186-W286 HydrophobicContact CG-CZ3 3.76Å; F186-W286 HydrophobicContact CZ-CB 4.08Å; F186-W286 HydrophobicContact CZ-CE3 4.19Å; F186-W286 VanDerWaalsContact CZ-N 3.29Å; V283-W286 PolarHBondContact O-N 3.36Å; P284-W286 PolarHBondContact O-N 3.45Å; P284-W286 VanDerWaalsContact O-N 3.12Å
287	W	94.1	Very high	92.6	Very high	174 Å²	174	46.6 Å²	46.6	66%	0.659	23%	0.229	S	C	*	.	H	α-helix	trans	-87	-16.3	-179.9	-58.6	-75	0	0	0	113.5	R32 V283 P284 L285	R32-W287 PolarHBondContact NH2-O 3.02Å; V283-W287 HydrophobicContact CG1-CH2 4.19Å; V283-W287 HydrophobicContact CG1-CZ3 4.15Å; V283-W287 VanDerWaalsContact O-CZ3 3.26Å; V283-W287 WeakPolarHBondContact O-CZ3 3.36Å; P284-W287 PolarHBondContact O-N 2.95Å; L285-W287 PolarHBondContact O-N 3.41Å
288	F	93.6	Very high	92.2	Very high	92 Å²	92	46 Å²	46	40%	0.404	22%	0.223	S	C	.	.	H	α-helix	trans	-92.7	-30.2	178.9	-63.7	-85.2	0	0	0	113.5	R32 I33 A36 P284 L285 P290	R32-F288 HydrophobicContact CG-CD1 4.27Å; R32-F288 VanDerWaalsContact NE-CD1 3.31Å; I33-F288 WeakPolarHBondContact CD1-O 3.11Å; A36-F288 HydrophobicContact CB-CB 4.03Å; P284-F288 HydrophobicContact CB-CE2 4.14Å; P284-F288 WeakPolarHBondContact O-CD2 3.33Å; P284-F288 WeakPolarHBondContact O-CE2 3.47Å; L285-F288 PolarHBondContact O-N 3.25Å; F288-P290 WeakPolarHBondContact O-CD 3.45Å
289	I	95.3	Very high	91.9	Very high	2 Å²	2	47.2 Å²	47.2	1%	0.01	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-96.4	116.4	-175.2	-60.6	172.8	0	0	0	109.4	A36 L37 K182 L185 F186 L229 L285	A36-I289 HydrophobicContact CB-CD1 4.44Å; A36-I289 HydrophobicContact CB-CG1 3.9Å; L37-I289 HydrophobicContact CD2-CD1 3.84Å; L37-I289 HydrophobicContact CD2-CG1 4.3Å; L37-I289 HydrophobicContact CD2-CG2 4.23Å; K182-I289 VanDerWaalsContact CD-O 3.31Å; K182-I289 WeakPolarHBondContact CD-O 3.5Å; K182-I289 VanDerWaalsContact CE-O 3.22Å; K182-I289 WeakPolarHBondContact CE-O 3.08Å; K182-I289 PolarHBondContact NZ-O 3.07Å; L185-I289 HydrophobicContact CD2-CD1 4.4Å; F186-I289 HydrophobicContact CZ-CD1 4.21Å; L229-I289 HydrophobicContact CD2-CG2 3.48Å; L229-I289 VanDerWaalsContact CD2-CG2 3.48Å; L285-I289 HydrophobicContact CB-CD1 3.96Å; L285-I289 PolarHBondContact O-N 3.2Å
290	P	95.4	Very high	91.7	Very high	25 Å²	25	48.6 Å²	48.6	16%	0.162	24%	0.24	C	C	.	.	P	Polyproline II helix	trans	-81.4	169	171.1	35.2	-33.6	0	0	0	110.7	F29 I33 F288 I308	F29-P290 HydrophobicContact CE2-CG 4.22Å; F29-P290 HydrophobicContact CZ-CG 4.09Å; I33-P290 HydrophobicContact CD1-CG 3.88Å; F288-P290 WeakPolarHBondContact O-CD 3.45Å; P290-I308 HydrophobicContact CB-CD1 4.44Å; P290-I308 HydrophobicContact CB-CG2 3.96Å; P290-I308 HydrophobicContact CG-CG2 4.39Å
291	E	95.9	Very high	91.5	Very high	23 Å²	23	47.5 Å²	47.5	11%	0.107	23%	0.227	C	C	.	.	P	Polyproline II helix	trans	-72.1	157.8	166.6	-173.6	55.5	-86	0	0	110.6	G180 R181 K182 P183 P293 W295 L296 I308	G180-E291 WeakPolarHBondContact CA-OE2 3.47Å; R181-E291 WeakPolarHBondContact CA-OE1 3.04Å; R181-E291 WeakPolarHBondContact CB-OE1 3.34Å; R181-E291 PolarHBondContact N-OE1 2.92Å; R181-E291 PolarHBondContact N-OE2 3.39Å; R181-E291 VanDerWaalsContact N-OE2 3.14Å; K182-E291 HydrophobicContact CB-CB 4.31Å; K182-E291 WeakPolarHBondContact CB-OE2 3.3Å; K182-E291 PolarHBondContact N-OE1 3.42Å; K182-E291 VanDerWaalsContact N-OE1 3.15Å; K182-E291 PolarHBondContact N-OE2 2.71Å; P183-E291 WeakPolarHBondContact CD-OE2 3.43Å; E291-P293 VanDerWaalsContact O-CD 3.24Å; E291-P293 WeakPolarHBondContact O-CD 3.3Å; E291-W295 HydrophobicContact CG-CE3 4.04Å; E291-W295 HydrophobicContact CG-CZ3 4.28Å; E291-L296 HydrophobicContact CB-CD1 4.23Å; E291-L296 HydrophobicContact CG-CD1 4.13Å; E291-L296 HydrophobicContact CG-CD2 4.28Å; E291-L296 HydrophobicContact CG-CG 4.02Å; E291-I308 HydrophobicContact CB-CD1 4.33Å
292	S	94.2	Very high	91.3	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.216	C	C	.	.			trans	-66	115.3	176.6	168.8	0	0	0	0	111.6	E232 R294 W295 L296	E232-S292 VanDerWaalsContact CB-OG 3.28Å; E232-S292 WeakPolarHBondContact CB-OG 3.19Å; E232-S292 WeakPolarHBondContact OE2-CB 3.28Å; E232-S292 PolarHBondContact OE2-OG 2.72Å; S292-R294 PolarHBondContact O-N 3.36Å; S292-W295 PolarHBondContact O-N 2.85Å; S292-W295 WeakPolarHBondContact OG-CB 3.48Å; S292-W295 PolarHBondContact OG-N 3.15Å; S292-L296 WeakPolarHBondContact O-CG 3.37Å; S292-L296 PolarHBondContact O-N 3.29Å
293	P	91.9	Very high	91.2	Very high	3 Å²	3	48.3 Å²	48.3	2%	0.019	25%	0.246	C	C	.	.	H	α-helix	trans	-65.3	-30.8	176.7	-14.8	27.3	0	0	0	111.7	Y16 E291 L296 Q297 A305 I308 L309	Y16-P293 WeakPolarHBondContact OH-CB 3.26Å; E291-P293 VanDerWaalsContact O-CD 3.24Å; E291-P293 WeakPolarHBondContact O-CD 3.3Å; P293-L296 PolarHBondContact O-N 3.37Å; P293-Q297 WeakPolarHBondContact O-CB 3.34Å; P293-Q297 PolarHBondContact O-N 2.67Å; P293-A305 HydrophobicContact CB-CB 4.11Å; P293-A305 WeakPolarHBondContact O-CB 3.19Å; P293-I308 HydrophobicContact CG-CB 4.35Å; P293-I308 HydrophobicContact CG-CG2 3.87Å; P293-L309 HydrophobicContact CB-CD1 4.41Å; P293-L309 HydrophobicContact CB-CD2 4.17Å; P293-L309 HydrophobicContact CB-CG 4.11Å; P293-L309 HydrophobicContact CG-CD2 4.09Å; P293-L309 HydrophobicContact CG-CG 4.38Å
294	R	88.7	Confident	91.1	Very high	102 Å²	102	48.5 Å²	48.5	39%	0.385	24%	0.241	S	C	.	.	H	α-helix	trans	-65.9	-41.8	175	-167.5	178	-177.5	168.9	5.1	112	Y16 E232 S292 S298	Y16-R294 HydrophobicContact CD1-CG 4.39Å; Y16-R294 HydrophobicContact CD2-CB 4.48Å; Y16-R294 HydrophobicContact CD2-CG 4.33Å; Y16-R294 HydrophobicContact CE1-CB 4.13Å; Y16-R294 HydrophobicContact CE1-CG 4.42Å; Y16-R294 HydrophobicContact CE2-CB 4Å; Y16-R294 HydrophobicContact CE2-CG 4.34Å; Y16-R294 HydrophobicContact CG-CG 4.34Å; Y16-R294 PolarHBondContact OH-N 2.92Å; E232-R294 HydrophobicContact CB-CB 4.33Å; S292-R294 PolarHBondContact O-N 3.36Å; R294-S298 PolarHBondContact O-N 3.01Å; R294-S298 VanDerWaalsContact O-N 3.1Å
295	W	90.1	Very high	91	Very high	11 Å²	11	45.8 Å²	45.8	4%	0.042	22%	0.223	C	C	.	.	H	α-helix	trans	-67.7	-42.5	174	178.2	87.9	0	0	0	111.6	D177 G180 E291 S292 Q297 S298 Q299	D177-W295 PolarHBondContact O-NE1 2.92Å; G180-W295 VanDerWaalsContact CA-CH2 3.5Å; G180-W295 VanDerWaalsContact CA-CZ2 3.45Å; E291-W295 HydrophobicContact CG-CE3 4.04Å; E291-W295 HydrophobicContact CG-CZ3 4.28Å; S292-W295 PolarHBondContact O-N 2.85Å; S292-W295 WeakPolarHBondContact OG-CB 3.48Å; S292-W295 PolarHBondContact OG-N 3.15Å; W295-Q297 VanDerWaalsContact C-N 3.29Å; W295-Q297 PolarHBondContact O-N 2.93Å; W295-S298 PolarHBondContact O-N 3.46Å; W295-S298 VanDerWaalsContact O-N 3.09Å; W295-S298 PolarHBondContact O-OG 3.09Å; W295-Q299 HydrophobicContact CD2-CG 3.95Å; W295-Q299 HydrophobicContact CE3-CG 4.26Å; W295-Q299 HydrophobicContact CH2-CG 3.86Å; W295-Q299 HydrophobicContact CZ2-CG 3.48Å; W295-Q299 VanDerWaalsContact CZ2-CG 3.48Å; W295-Q299 HydrophobicContact CZ3-CG 4.23Å; W295-Q299 WeakPolarHBondContact O-CG 3.42Å; W295-Q299 PolarHBondContact O-N 3.07Å
296	L	89.9	Confident	90.9	Very high	1 Å²	1	47 Å²	47	1%	0.005	23%	0.229	C	C	.	.	H	α-helix	trans	-59.4	-42.1	176.4	-74.3	168.4	0	0	0	111.6	E291 S292 P293 S298 Q299 G300 R301 E304 A305 I308	E291-L296 HydrophobicContact CB-CD1 4.23Å; E291-L296 HydrophobicContact CG-CD1 4.13Å; E291-L296 HydrophobicContact CG-CD2 4.28Å; E291-L296 HydrophobicContact CG-CG 4.02Å; S292-L296 WeakPolarHBondContact O-CG 3.37Å; S292-L296 PolarHBondContact O-N 3.29Å; P293-L296 PolarHBondContact O-N 3.37Å; L296-S298 PolarHBondContact O-N 2.96Å; L296-Q299 PolarHBondContact O-N 3.26Å; L296-G300 PolarHBondContact O-N 3.07Å; L296-R301 HydrophobicContact CB-CB 4.4Å; L296-R301 HydrophobicContact CD2-CB 4.02Å; L296-R301 WeakPolarHBondContact O-CA 3.11Å; L296-R301 PolarHBondContact O-N 3.17Å; L296-E304 HydrophobicContact CD1-CB 4.04Å; L296-E304 HydrophobicContact CD2-CB 4.29Å; L296-A305 HydrophobicContact CB-CB 3.82Å; L296-A305 HydrophobicContact CD1-CB 4.47Å; L296-I308 HydrophobicContact CD1-CD1 3.57Å
297	Q	85.6	Confident	90.8	Very high	8 Å²	8	44 Å²	44	4%	0.037	23%	0.228	C	C	.	.	H	α-helix	trans	-60.8	-43.5	173.6	-168.4	-170.2	19.1	0	0	111.7	Y16 P293 W295 Q299 G300 F325 I333	Y16-Q297 VanDerWaalsContact CD2-OE1 3.24Å; P293-Q297 WeakPolarHBondContact O-CB 3.34Å; P293-Q297 PolarHBondContact O-N 2.67Å; W295-Q297 VanDerWaalsContact C-N 3.29Å; W295-Q297 PolarHBondContact O-N 2.93Å; Q297-Q299 PolarHBondContact O-N 3.26Å; Q297-G300 PolarHBondContact O-N 2.78Å; Q297-F325 VanDerWaalsContact CD-CE1 3.47Å; Q297-F325 HydrophobicContact CG-CD1 4.28Å; Q297-F325 HydrophobicContact CG-CE1 4.23Å; Q297-F325 HydrophobicContact CG-CZ 4.48Å; Q297-F325 VanDerWaalsContact NE2-CE1 3.32Å; Q297-I333 VanDerWaalsContact CD-CD1 3.45Å; Q297-I333 HydrophobicContact CG-CD1 3.86Å; Q297-I333 VanDerWaalsContact NE2-CD1 3.33Å
298	S	83.4	Confident	90.8	Very high	36 Å²	36	37.4 Å²	37.4	25%	0.252	21%	0.205	S	C	.	.	H	α-helix	trans	-68.9	-19.5	178.9	78.5	0	0	0	0	114.4	R294 W295 L296	R294-S298 PolarHBondContact O-N 3.01Å; R294-S298 VanDerWaalsContact O-N 3.1Å; W295-S298 PolarHBondContact O-N 3.46Å; W295-S298 VanDerWaalsContact O-N 3.09Å; W295-S298 PolarHBondContact O-OG 3.09Å; L296-S298 PolarHBondContact O-N 2.96Å
299	Q	85.4	Confident	90.8	Very high	46 Å²	46	33.2 Å²	33.2	22%	0.215	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	1.9	170.4	-61.9	-54.5	-50.7	0	0	113.7	W295 L296 Q297 R301 R337	W295-Q299 HydrophobicContact CD2-CG 3.95Å; W295-Q299 HydrophobicContact CE3-CG 4.26Å; W295-Q299 HydrophobicContact CH2-CG 3.86Å; W295-Q299 HydrophobicContact CZ2-CG 3.48Å; W295-Q299 VanDerWaalsContact CZ2-CG 3.48Å; W295-Q299 HydrophobicContact CZ3-CG 4.23Å; W295-Q299 WeakPolarHBondContact O-CG 3.42Å; W295-Q299 PolarHBondContact O-N 3.07Å; L296-Q299 PolarHBondContact O-N 3.26Å; Q297-Q299 PolarHBondContact O-N 3.26Å; Q299-R301 HydrophobicContact CB-CG 4.41Å; Q299-R301 PolarHBondContact O-N 3.14Å; Q299-R337 VanDerWaalsContact OE1-CZ 3.26Å
300	G	84.7	Confident	90.7	Very high	34 Å²	34	36.3 Å²	36.3	35%	0.351	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.4	7.3	-175.3	0	0	0	0	0	114.4	L296 Q297 A302	L296-G300 PolarHBondContact O-N 3.07Å; Q297-G300 PolarHBondContact O-N 2.78Å; G300-A302 PolarHBondContact O-N 3.5Å; G300-A302 VanDerWaalsContact O-N 3.09Å
301	R	88.8	Confident	90.6	Very high	102 Å²	102	39 Å²	39	39%	0.385	21%	0.213	S	C	.	.			trans	-87.4	54.8	178.9	-66.3	168.8	66.9	-173.6	3.1	110.9	L296 Q299 A303 E304 A305	L296-R301 HydrophobicContact CB-CB 4.4Å; L296-R301 HydrophobicContact CD2-CB 4.02Å; L296-R301 WeakPolarHBondContact O-CA 3.11Å; L296-R301 PolarHBondContact O-N 3.17Å; Q299-R301 HydrophobicContact CB-CG 4.41Å; Q299-R301 PolarHBondContact O-N 3.14Å; R301-A303 PolarHBondContact O-N 2.99Å; R301-E304 IonicContact CZ-OE1 3.21Å; R301-E304 IonicContact CZ-OE2 3.44Å; R301-E304 IonicContact NE-OE1 2.77Å; R301-E304 PolarHBondContact NE-OE1 3.23Å; R301-E304 IonicContact NE-OE2 3.65Å; R301-E304 IonicContact NH2-OE1 2.85Å; R301-E304 PolarHBondContact NH2-OE1 3.19Å; R301-E304 IonicContact NH2-OE2 2.65Å; R301-E304 PolarHBondContact NH2-OE2 3.28Å; R301-E304 PolarHBondContact O-N 3.27Å; R301-A305 PolarHBondContact O-N 3.45Å
302	A	88.9	Confident	90.5	Very high	14 Å²	14	37.9 Å²	37.9	12%	0.116	21%	0.208	C	C	.	.	H	α-helix	trans	-62	-39.5	-172.7	0	0	0	0	0	113.3	G300 E304 A305 E306 F325 I330	G300-A302 PolarHBondContact O-N 3.5Å; G300-A302 VanDerWaalsContact O-N 3.09Å; A302-E304 VanDerWaalsContact C-N 3.3Å; A302-E304 PolarHBondContact O-N 2.9Å; A302-A305 WeakPolarHBondContact O-CB 3.31Å; A302-A305 PolarHBondContact O-N 3.31Å; A302-A305 VanDerWaalsContact O-N 3.12Å; A302-E306 WeakPolarHBondContact O-CG 3.28Å; A302-E306 PolarHBondContact O-N 3.25Å; A302-F325 HydrophobicContact CB-CD2 4.42Å; A302-I330 HydrophobicContact CB-CD1 3.51Å; A302-I330 HydrophobicContact CB-CG1 4.27Å
303	A	90.2	Very high	90.4	Very high	80 Å²	80	38 Å²	38	66%	0.661	21%	0.209	S	C	*	.	H	α-helix	trans	-59.3	-39.1	-179.5	0	0	0	0	0	113	R301 A307	R301-A303 PolarHBondContact O-N 2.99Å; A303-A307 PolarHBondContact O-N 2.93Å
304	E	92.7	Very high	90.5	Very high	89 Å²	89	44.9 Å²	44.9	42%	0.416	24%	0.239	S	C	.	.	H	α-helix	trans	-71.2	-39.6	176.3	-66.1	-177.4	-125	0	0	111.8	L296 R301 A302 E306 A307 I308	L296-E304 HydrophobicContact CD1-CB 4.04Å; L296-E304 HydrophobicContact CD2-CB 4.29Å; R301-E304 IonicContact CZ-OE1 3.21Å; R301-E304 IonicContact CZ-OE2 3.44Å; R301-E304 IonicContact NE-OE1 2.77Å; R301-E304 PolarHBondContact NE-OE1 3.23Å; R301-E304 IonicContact NE-OE2 3.65Å; R301-E304 IonicContact NH2-OE1 2.85Å; R301-E304 PolarHBondContact NH2-OE1 3.19Å; R301-E304 IonicContact NH2-OE2 2.65Å; R301-E304 PolarHBondContact NH2-OE2 3.28Å; R301-E304 PolarHBondContact O-N 3.27Å; A302-E304 VanDerWaalsContact C-N 3.3Å; A302-E304 PolarHBondContact O-N 2.9Å; E304-E306 VanDerWaalsContact C-N 3.34Å; E304-E306 PolarHBondContact O-N 3.21Å; E304-A307 PolarHBondContact O-N 3.2Å; E304-I308 WeakPolarHBondContact O-CG1 3.4Å; E304-I308 PolarHBondContact O-N 2.87Å
305	A	91.8	Very high	90.7	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-60.5	-44.6	174.4	0	0	0	0	0	111.1	P293 L296 R301 A302 A307 I308 L309 F325	P293-A305 HydrophobicContact CB-CB 4.11Å; P293-A305 WeakPolarHBondContact O-CB 3.19Å; L296-A305 HydrophobicContact CB-CB 3.82Å; L296-A305 HydrophobicContact CD1-CB 4.47Å; R301-A305 PolarHBondContact O-N 3.45Å; A302-A305 WeakPolarHBondContact O-CB 3.31Å; A302-A305 PolarHBondContact O-N 3.31Å; A302-A305 VanDerWaalsContact O-N 3.12Å; A305-A307 PolarHBondContact O-N 3.18Å; A305-I308 PolarHBondContact O-N 3.24Å; A305-L309 WeakPolarHBondContact O-CG 3.32Å; A305-L309 PolarHBondContact O-N 3.31Å; A305-F325 HydrophobicContact CB-CE2 3.69Å; A305-F325 HydrophobicContact CB-CZ 4.38Å
306	E	92.9	Very high	90.8	Very high	34 Å²	34	43.9 Å²	43.9	16%	0.159	24%	0.242	C	C	.	.	H	α-helix	trans	-63.5	-39.8	176.8	-68.2	-157.4	159.4	0	0	112.7	A302 E304 I308 L309 K310 I324 F325	A302-E306 WeakPolarHBondContact O-CG 3.28Å; A302-E306 PolarHBondContact O-N 3.25Å; E304-E306 VanDerWaalsContact C-N 3.34Å; E304-E306 PolarHBondContact O-N 3.21Å; E306-I308 VanDerWaalsContact C-N 3.32Å; E306-I308 PolarHBondContact O-N 3.43Å; E306-L309 PolarHBondContact O-N 3.09Å; E306-K310 WeakPolarHBondContact O-CB 3.25Å; E306-K310 VanDerWaalsContact O-CG 3.31Å; E306-K310 WeakPolarHBondContact O-CG 3.24Å; E306-K310 PolarHBondContact O-N 3.05Å; E306-K310 IonicContact OE2-NZ 3.45Å; E306-K310 PolarHBondContact OE2-NZ 2.87Å; E306-I324 HydrophobicContact CB-CD1 4.47Å; E306-I324 HydrophobicContact CG-CB 4.12Å; E306-I324 HydrophobicContact CG-CD1 4.49Å; E306-I324 PolarHBondContact OE1-N 3.42Å; E306-F325 HydrophobicContact CG-CD2 3.65Å; E306-F325 HydrophobicContact CG-CE2 4.07Å; E306-F325 PolarHBondContact OE1-N 3.3Å; E306-F325 VanDerWaalsContact OE1-N 3.11Å
307	A	93.8	Very high	90.9	Very high	49 Å²	49	51.7 Å²	51.7	41%	0.405	28%	0.275	S	S	.	.	H	α-helix	trans	-58.7	-45.7	176.9	0	0	0	0	0	111.3	A303 E304 A305 L309 K310 D311	A303-A307 PolarHBondContact O-N 2.93Å; E304-A307 PolarHBondContact O-N 3.2Å; A305-A307 PolarHBondContact O-N 3.18Å; A307-L309 PolarHBondContact O-N 3.44Å; A307-K310 PolarHBondContact O-N 3.21Å; A307-D311 PolarHBondContact O-N 3.04Å
308	I	94	Very high	91.2	Very high	34 Å²	34	54.2 Å²	54.2	17%	0.174	29%	0.291	C	S	.	.	H	α-helix	trans	-63.4	-43.3	177.3	-63.4	170.8	0	0	0	111	P290 E291 P293 L296 E304 A305 E306 D311 A312	P290-I308 HydrophobicContact CB-CD1 4.44Å; P290-I308 HydrophobicContact CB-CG2 3.96Å; P290-I308 HydrophobicContact CG-CG2 4.39Å; E291-I308 HydrophobicContact CB-CD1 4.33Å; P293-I308 HydrophobicContact CG-CB 4.35Å; P293-I308 HydrophobicContact CG-CG2 3.87Å; L296-I308 HydrophobicContact CD1-CD1 3.57Å; E304-I308 WeakPolarHBondContact O-CG1 3.4Å; E304-I308 PolarHBondContact O-N 2.87Å; A305-I308 PolarHBondContact O-N 3.24Å; E306-I308 VanDerWaalsContact C-N 3.32Å; E306-I308 PolarHBondContact O-N 3.43Å; I308-D311 PolarHBondContact O-N 3.4Å; I308-A312 WeakPolarHBondContact O-CB 3.3Å; I308-A312 PolarHBondContact O-N 3.35Å
309	L	93.8	Very high	91.5	Very high	5 Å²	5	61.2 Å²	61.2	3%	0.026	32%	0.32	C	S	.	.	H	α-helix	trans	-68.4	-37.9	179.6	-66.7	174	0	0	0	112.4	T20 L23 P293 A305 E306 A307 A312 A313 I324 F325	T20-L309 HydrophobicContact CG2-CD1 4.14Å; T20-L309 HydrophobicContact CG2-CD2 4.04Å; L23-L309 HydrophobicContact CD1-CD2 3.7Å; P293-L309 HydrophobicContact CB-CD1 4.41Å; P293-L309 HydrophobicContact CB-CD2 4.17Å; P293-L309 HydrophobicContact CB-CG 4.11Å; P293-L309 HydrophobicContact CG-CD2 4.09Å; P293-L309 HydrophobicContact CG-CG 4.38Å; A305-L309 WeakPolarHBondContact O-CG 3.32Å; A305-L309 PolarHBondContact O-N 3.31Å; E306-L309 PolarHBondContact O-N 3.09Å; A307-L309 PolarHBondContact O-N 3.44Å; L309-A312 WeakPolarHBondContact O-CB 3.34Å; L309-A312 PolarHBondContact O-N 3.17Å; L309-A313 WeakPolarHBondContact O-CB 3.49Å; L309-A313 PolarHBondContact O-N 3.11Å; L309-I324 HydrophobicContact CB-CD1 3.79Å; L309-I324 HydrophobicContact CD1-CD1 4.32Å; L309-I324 HydrophobicContact CD1-CG2 3.89Å; L309-F325 HydrophobicContact CD1-CE2 3.84Å; L309-F325 HydrophobicContact CD1-CZ 3.6Å
310	K	93.4	Very high	91.6	Very high	66 Å²	66	60.7 Å²	60.7	29%	0.287	32%	0.324	S	S	.	.	H	α-helix	trans	-65	-39.1	174.4	-75.7	173.2	174.8	166.1	0	111.1	E306 A307 A313 K314 A320 D322 I324	E306-K310 WeakPolarHBondContact O-CB 3.25Å; E306-K310 VanDerWaalsContact O-CG 3.31Å; E306-K310 WeakPolarHBondContact O-CG 3.24Å; E306-K310 PolarHBondContact O-N 3.05Å; E306-K310 IonicContact OE2-NZ 3.45Å; E306-K310 PolarHBondContact OE2-NZ 2.87Å; A307-K310 PolarHBondContact O-N 3.21Å; K310-A313 WeakPolarHBondContact O-CB 3.33Å; K310-A313 PolarHBondContact O-N 3.45Å; K310-K314 WeakPolarHBondContact O-CG 3.19Å; K310-K314 PolarHBondContact O-N 3.43Å; K310-A320 HydrophobicContact CG-CB 4.09Å; K310-D322 PolarHBondContact NZ-O 3.1Å; K310-I324 HydrophobicContact CG-CD1 4.12Å
311	D	93.1	Very high	91.6	Very high	81 Å²	81	61.8 Å²	61.8	43%	0.433	33%	0.325	S	S	.	.	H	α-helix	trans	-70.3	-36.1	174.4	-74.7	-14.3	0	0	0	112.7	A307 I308 A313 K314 L315	A307-D311 PolarHBondContact O-N 3.04Å; I308-D311 PolarHBondContact O-N 3.4Å; D311-A313 VanDerWaalsContact C-N 3.3Å; D311-A313 PolarHBondContact O-N 3.29Å; D311-K314 PolarHBondContact O-N 3Å; D311-K314 IonicContact OD1-NZ 3.31Å; D311-K314 PolarHBondContact OD1-NZ 3.27Å; D311-L315 WeakPolarHBondContact O-CG 3.28Å; D311-L315 PolarHBondContact O-N 2.85Å
312	A	93.3	Very high	91.2	Very high	1 Å²	1	64.4 Å²	64.4	1%	0.008	35%	0.346	C	S	.	.	H	α-helix	trans	-60.9	-40.3	170.1	0	0	0	0	0	111.7	L23 F29 I308 L309 L315 N316	L23-A312 HydrophobicContact CD1-CB 4.19Å; L23-A312 HydrophobicContact CD2-CB 3.88Å; F29-A312 HydrophobicContact CB-CB 4.24Å; F29-A312 HydrophobicContact CD1-CB 3.69Å; F29-A312 HydrophobicContact CD2-CB 3.69Å; F29-A312 HydrophobicContact CE1-CB 3.89Å; F29-A312 HydrophobicContact CE2-CB 3.88Å; F29-A312 HydrophobicContact CG-CB 3.59Å; F29-A312 HydrophobicContact CZ-CB 3.97Å; I308-A312 WeakPolarHBondContact O-CB 3.3Å; I308-A312 PolarHBondContact O-N 3.35Å; L309-A312 WeakPolarHBondContact O-CB 3.34Å; L309-A312 PolarHBondContact O-N 3.17Å; A312-L315 PolarHBondContact O-N 3.48Å; A312-N316 WeakPolarHBondContact O-CB 3.31Å; A312-N316 PolarHBondContact O-N 2.66Å
313	A	92.6	Very high	90.8	Very high	2 Å²	2	66.8 Å²	66.8	2%	0.017	37%	0.366	C	S	.	.	H	α-helix	trans	-63.4	-45.7	176.9	0	0	0	0	0	111.8	F22 L23 L309 K310 D311 L315 N316 K317 V318 A320	F22-A313 HydrophobicContact CE2-CB 3.9Å; L23-A313 HydrophobicContact CD2-CB 3.91Å; L309-A313 WeakPolarHBondContact O-CB 3.49Å; L309-A313 PolarHBondContact O-N 3.11Å; K310-A313 WeakPolarHBondContact O-CB 3.33Å; K310-A313 PolarHBondContact O-N 3.45Å; D311-A313 VanDerWaalsContact C-N 3.3Å; D311-A313 PolarHBondContact O-N 3.29Å; A313-L315 VanDerWaalsContact C-N 3.33Å; A313-L315 PolarHBondContact O-N 3.05Å; A313-N316 CarbonylContact O-C 3.48Å; A313-N316 PolarHBondContact O-N 3.33Å; A313-N316 VanDerWaalsContact O-N 3.17Å; A313-K317 PolarHBondContact O-N 3.4Å; A313-V318 CarbonylContact C-O 3.6Å; A313-V318 WeakPolarHBondContact CB-O 3.48Å; A313-V318 PolarHBondContact O-N 3.38Å; A313-A320 HydrophobicContact CB-CB 3.83Å
314	K	93.4	Very high	90.5	Very high	148 Å²	148	63 Å²	63	64%	0.643	34%	0.335	S	S	*	.	H	α-helix	trans	-57.3	-44.7	173.9	-68.7	171.8	-164.6	159.1	0	111.9	K310 D311 N316 K317	K310-K314 WeakPolarHBondContact O-CG 3.19Å; K310-K314 PolarHBondContact O-N 3.43Å; D311-K314 PolarHBondContact O-N 3Å; D311-K314 IonicContact OD1-NZ 3.31Å; D311-K314 PolarHBondContact OD1-NZ 3.27Å; K314-N316 VanDerWaalsContact C-N 3.32Å; K314-N316 PolarHBondContact O-N 3.27Å; K314-K317 PolarHBondContact O-N 2.93Å
315	L	92.4	Very high	90.1	Very high	70 Å²	70	59.3 Å²	59.3	37%	0.366	32%	0.317	S	S	.	.	H	α-helix	trans	-64.4	-36.7	177.9	-80.3	162.9	0	0	0	112.7	F29 D311 A312 A313 K317	F29-L315 HydrophobicContact CB-CB 4.27Å; F29-L315 HydrophobicContact CD2-CD1 3.98Å; D311-L315 WeakPolarHBondContact O-CG 3.28Å; D311-L315 PolarHBondContact O-N 2.85Å; A312-L315 PolarHBondContact O-N 3.48Å; A313-L315 VanDerWaalsContact C-N 3.33Å; A313-L315 PolarHBondContact O-N 3.05Å; L315-K317 VanDerWaalsContact C-N 3.29Å
316	N	93.9	Very high	89.7	Confident	22 Å²	22	61.9 Å²	61.9	12%	0.118	33%	0.333	C	S	.	.	H	α-helix	trans	-82.8	-6.2	177.3	-73.4	-6.7	0	0	0	113.6	L23 G27 R28 F29 Q30 A312 A313 K314 V318	L23-N316 PolarHBondContact O-ND2 3.19Å; G27-N316 WeakPolarHBondContact CA-OD1 3.26Å; R28-N316 PolarHBondContact N-OD1 3.17Å; F29-N316 WeakPolarHBondContact CB-OD1 3.44Å; F29-N316 PolarHBondContact N-OD1 3.34Å; Q30-N316 PolarHBondContact NE2-ND2 3.2Å; Q30-N316 PolarHBondContact OE1-ND2 3.37Å; Q30-N316 PolarHBondContact OE1-OD1 3.23Å; A312-N316 WeakPolarHBondContact O-CB 3.31Å; A312-N316 PolarHBondContact O-N 2.66Å; A313-N316 CarbonylContact O-C 3.48Å; A313-N316 PolarHBondContact O-N 3.33Å; A313-N316 VanDerWaalsContact O-N 3.17Å; K314-N316 VanDerWaalsContact C-N 3.32Å; K314-N316 PolarHBondContact O-N 3.27Å; N316-V318 VanDerWaalsContact C-N 3.31Å; N316-V318 HydrophobicContact CB-CG2 4.12Å
317	K	91.8	Very high	89.1	Confident	164 Å²	164	66.3 Å²	66.3	71%	0.713	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.1	42.8	-174.1	-53.8	-177.8	176.3	-170.8	0	112.4	A313 K314 L315	A313-K317 PolarHBondContact O-N 3.4Å; K314-K317 PolarHBondContact O-N 2.93Å; L315-K317 VanDerWaalsContact C-N 3.29Å
318	V	92	Very high	88.2	Confident	62 Å²	62	67.7 Å²	67.7	38%	0.376	36%	0.359	S	S	.	.			trans	-118.8	145.4	175.6	-171.2	0	0	0	0	109.5	F22 A313 N316	F22-V318 WeakPolarHBondContact O-CG1 3.42Å; A313-V318 CarbonylContact C-O 3.6Å; A313-V318 WeakPolarHBondContact CB-O 3.48Å; A313-V318 PolarHBondContact O-N 3.38Å; N316-V318 VanDerWaalsContact C-N 3.31Å; N316-V318 HydrophobicContact CB-CG2 4.12Å
319	E	88.2	Confident	87.5	Confident	182 Å²	182	66.5 Å²	66.5	85%	0.85	35%	0.352	S	S	*	.	P	Polyproline II helix	trans	-71.5	130.9	174.9	-67.8	-177.8	172.4	0	0	110.5
320	A	87.3	Confident	86.8	Confident	36 Å²	36	67 Å²	67	30%	0.298	36%	0.355	S	S	.	.	P	Polyproline II helix	trans	-94.1	141	176	0	0	0	0	0	109.9	F22 K310 A313	F22-A320 HydrophobicContact CE2-CB 3.97Å; F22-A320 HydrophobicContact CZ-CB 4.48Å; K310-A320 HydrophobicContact CG-CB 4.09Å; A313-A320 HydrophobicContact CB-CB 3.83Å
321	P	86.6	Confident	85.9	Confident	56 Å²	56	69.8 Å²	69.8	36%	0.364	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-58.6	150.2	169.6	-21.2	32.1	0	0	0	112.2	F22 A323	F22-P321 HydrophobicContact CD1-CG 4.49Å; P321-A323 PolarHBondContact O-N 2.67Å
322	D	79.3	Confident	85.1	Confident	157 Å²	157	69.1 Å²	69.1	84%	0.84	36%	0.362	S	S	*	.	S	Bend	trans	-60	-46.9	-180	-70.5	-39	0	0	0	112.1	K310	K310-D322 PolarHBondContact NZ-O 3.1Å
323	A	81.6	Confident	84.3	Confident	64 Å²	64	70.9 Å²	70.9	53%	0.529	37%	0.371	S	S	.	.			trans	-117.4	119.9	171.1	0	0	0	0	0	109.5	P321	P321-A323 PolarHBondContact O-N 2.67Å
324	I	82.7	Confident	83.5	Confident	1 Å²	1	73.9 Å²	73.9	1%	0.005	39%	0.386	C	S	.	.	S	Bend	trans	-89.1	-44.5	-178.2	-62.3	174.6	0	0	0	109	R14 I19 F22 E306 L309 K310	R14-I324 PolarHBondContact NH2-O 2.71Å; R14-I324 VanDerWaalsContact NH2-O 3.08Å; I19-I324 HydrophobicContact CG2-CG2 3.42Å; I19-I324 VanDerWaalsContact CG2-CG2 3.42Å; I19-I324 WeakPolarHBondContact CG2-O 3.38Å; F22-I324 HydrophobicContact CZ-CD1 4.14Å; E306-I324 HydrophobicContact CB-CD1 4.47Å; E306-I324 HydrophobicContact CG-CB 4.12Å; E306-I324 HydrophobicContact CG-CD1 4.49Å; E306-I324 PolarHBondContact OE1-N 3.42Å; L309-I324 HydrophobicContact CB-CD1 3.79Å; L309-I324 HydrophobicContact CD1-CD1 4.32Å; L309-I324 HydrophobicContact CD1-CG2 3.89Å; K310-I324 HydrophobicContact CG-CD1 4.12Å
325	F	84.5	Confident	82.6	Confident	12 Å²	12	71.2 Å²	71.2	5%	0.053	38%	0.382	C	S	.	.	S	Bend	trans	-110	138.7	178.6	-55.5	-63.9	0	0	0	111.4	Y16 I19 Q297 A302 A305 E306 L309 I330	Y16-F325 HydrophobicContact CD2-CE1 4.14Å; Y16-F325 HydrophobicContact CD2-CZ 4.47Å; Y16-F325 HydrophobicContact CE2-CE1 4.18Å; Y16-F325 HydrophobicContact CE2-CZ 4.05Å; I19-F325 HydrophobicContact CD1-CD1 4.17Å; I19-F325 HydrophobicContact CD1-CE1 4.39Å; I19-F325 HydrophobicContact CG2-CD1 4.19Å; I19-F325 HydrophobicContact CG2-CE1 3.98Å; Q297-F325 VanDerWaalsContact CD-CE1 3.47Å; Q297-F325 HydrophobicContact CG-CD1 4.28Å; Q297-F325 HydrophobicContact CG-CE1 4.23Å; Q297-F325 HydrophobicContact CG-CZ 4.48Å; Q297-F325 VanDerWaalsContact NE2-CE1 3.32Å; A302-F325 HydrophobicContact CB-CD2 4.42Å; A305-F325 HydrophobicContact CB-CE2 3.69Å; A305-F325 HydrophobicContact CB-CZ 4.38Å; E306-F325 HydrophobicContact CG-CD2 3.65Å; E306-F325 HydrophobicContact CG-CE2 4.07Å; E306-F325 PolarHBondContact OE1-N 3.3Å; E306-F325 VanDerWaalsContact OE1-N 3.11Å; L309-F325 HydrophobicContact CD1-CE2 3.84Å; L309-F325 HydrophobicContact CD1-CZ 3.6Å; F325-I330 HydrophobicContact CB-CD1 4.43Å; F325-I330 HydrophobicContact CB-CG1 4.49Å
326	T	83.4	Confident	81.4	Confident	54 Å²	54	73.1 Å²	73.1	33%	0.331	39%	0.391	S	S	.	.			trans	-98.1	153	174.7	63.5	0	0	0	0	111.3	E329 I330	T326-E329 PolarHBondContact N-OE2 3.27Å; T326-E329 WeakPolarHBondContact O-CB 3.09Å; T326-E329 PolarHBondContact O-N 3.42Å; T326-E329 WeakPolarHBondContact OG1-CG 3.15Å; T326-E329 PolarHBondContact OG1-OE2 3.29Å; T326-I330 WeakPolarHBondContact O-CG1 3.24Å; T326-I330 PolarHBondContact O-N 3.01Å
327	Q	79.3	Confident	80.2	Confident	127 Å²	127	78 Å²	78	59%	0.593	41%	0.407	S	S	*	.	H	α-helix	trans	-55.8	-45.8	177.2	-76	-63.8	-0.5	0	0	115.2	E329 I330 E331	Q327-E329 VanDerWaalsContact C-N 3.27Å; Q327-E329 PolarHBondContact O-N 3.28Å; Q327-I330 PolarHBondContact O-N 3.45Å; Q327-I330 VanDerWaalsContact O-N 3.07Å; Q327-E331 PolarHBondContact O-N 2.71Å
328	P	76.8	Confident	78.6	Confident	78 Å²	78	76.3 Å²	76.3	51%	0.506	41%	0.406	S	S	.	.	H	α-helix	trans	-62.4	-32.5	176.9	22.7	-34.3	0	0	0	113.1	I330 K332	P328-I330 VanDerWaalsContact C-N 3.34Å; P328-K332 PolarHBondContact O-N 3.25Å; P328-K332 VanDerWaalsContact O-N 3.14Å
329	E	78.2	Confident	77	Confident	9 Å²	9	80.4 Å²	80.4	4%	0.042	42%	0.419	C	S	.	.	H	α-helix	trans	-63.5	-40.1	173.6	-73.1	165.6	168.2	0	0	111.1	I13 R14 T326 Q327 I333	I13-E329 HydrophobicContact CG2-CG 4.09Å; R14-E329 IonicContact CZ-OE1 3.46Å; R14-E329 IonicContact NE-OE1 3.64Å; R14-E329 PolarHBondContact NE-OE1 3.4Å; R14-E329 IonicContact NH2-OE1 3.4Å; R14-E329 PolarHBondContact NH2-OE1 3.42Å; R14-E329 IonicContact NH2-OE2 3.85Å; T326-E329 PolarHBondContact N-OE2 3.27Å; T326-E329 WeakPolarHBondContact O-CB 3.09Å; T326-E329 PolarHBondContact O-N 3.42Å; T326-E329 WeakPolarHBondContact OG1-CG 3.15Å; T326-E329 PolarHBondContact OG1-OE2 3.29Å; Q327-E329 VanDerWaalsContact C-N 3.27Å; Q327-E329 PolarHBondContact O-N 3.28Å; E329-I333 WeakPolarHBondContact O-CD1 3.18Å; E329-I333 VanDerWaalsContact O-CG1 3.24Å; E329-I333 WeakPolarHBondContact O-CG1 3.22Å; E329-I333 PolarHBondContact O-N 3.16Å
330	I	78.3	Confident	75.5	Confident	15 Å²	15	81 Å²	81	8%	0.077	42%	0.419	C	S	.	.	H	α-helix	trans	-68.9	-46.7	179.3	-62.3	164.1	0	0	0	110.8	A302 F325 T326 Q327 P328 K332 I333 L334	A302-I330 HydrophobicContact CB-CD1 3.51Å; A302-I330 HydrophobicContact CB-CG1 4.27Å; F325-I330 HydrophobicContact CB-CD1 4.43Å; F325-I330 HydrophobicContact CB-CG1 4.49Å; T326-I330 WeakPolarHBondContact O-CG1 3.24Å; T326-I330 PolarHBondContact O-N 3.01Å; Q327-I330 PolarHBondContact O-N 3.45Å; Q327-I330 VanDerWaalsContact O-N 3.07Å; P328-I330 VanDerWaalsContact C-N 3.34Å; I330-K332 PolarHBondContact O-N 3.42Å; I330-I333 PolarHBondContact O-N 3.02Å; I330-L334 HydrophobicContact CG2-CD1 4.17Å; I330-L334 WeakPolarHBondContact O-CG 3.24Å; I330-L334 PolarHBondContact O-N 3.32Å; I330-L334 VanDerWaalsContact O-N 3.09Å
331	E	76.3	Confident	74	Confident	125 Å²	125	85.5 Å²	85.5	58%	0.584	43%	0.432	S	S	*	.	H	α-helix	trans	-60.1	-43.9	180	-73.3	-179.9	179.9	0	0	112	Q327 I333 L334 V335	Q327-E331 PolarHBondContact O-N 2.71Å; E331-I333 VanDerWaalsContact C-N 3.33Å; E331-I333 PolarHBondContact O-N 3.46Å; E331-L334 PolarHBondContact O-N 3.5Å; E331-V335 WeakPolarHBondContact O-CG2 3.38Å; E331-V335 PolarHBondContact O-N 3.02Å
332	K	75.5	Confident	72.9	Confident	67 Å²	67	85.9 Å²	85.9	29%	0.291	44%	0.436	S	S	.	.	H	α-helix	trans	-61.4	-40.5	177	-175.4	172.7	179.1	169.8	0	112.4	D10 I13 P328 I330 V335 M336	D10-K332 IonicContact OD1-NZ 3.54Å; D10-K332 PolarHBondContact OD1-NZ 3.07Å; D10-K332 IonicContact OD2-NZ 3.72Å; I13-K332 HydrophobicContact CD1-CD 3.39Å; I13-K332 HydrophobicContact CG2-CD 4.39Å; P328-K332 PolarHBondContact O-N 3.25Å; P328-K332 VanDerWaalsContact O-N 3.14Å; I330-K332 PolarHBondContact O-N 3.42Å; K332-V335 PolarHBondContact O-N 2.94Å; K332-M336 HydrophobicContact CG-CE 4.45Å; K332-M336 WeakPolarHBondContact O-CG 3.45Å; K332-M336 PolarHBondContact O-N 3.49Å
333	I	75.8	Confident	72.2	Confident	38 Å²	38	83.5 Å²	83.5	20%	0.195	42%	0.422	C	S	.	.	H	α-helix	trans	-65.1	-40.9	178.5	-68.5	166.8	0	0	0	110.9	Q297 E329 I330 E331 M336 R337	Q297-I333 VanDerWaalsContact CD-CD1 3.45Å; Q297-I333 HydrophobicContact CG-CD1 3.86Å; Q297-I333 VanDerWaalsContact NE2-CD1 3.33Å; E329-I333 WeakPolarHBondContact O-CD1 3.18Å; E329-I333 VanDerWaalsContact O-CG1 3.24Å; E329-I333 WeakPolarHBondContact O-CG1 3.22Å; E329-I333 PolarHBondContact O-N 3.16Å; I330-I333 PolarHBondContact O-N 3.02Å; E331-I333 VanDerWaalsContact C-N 3.33Å; E331-I333 PolarHBondContact O-N 3.46Å; I333-M336 PolarHBondContact O-N 2.98Å; I333-R337 PolarHBondContact O-N 2.9Å
334	L	75.9	Confident	71.5	Confident	64 Å²	64	86.2 Å²	86.2	34%	0.335	43%	0.427	S	S	.	.	H	α-helix	trans	-62.8	-41.8	176.4	-67.8	172.4	0	0	0	111.6	I330 E331 M336 R337	I330-L334 HydrophobicContact CG2-CD1 4.17Å; I330-L334 WeakPolarHBondContact O-CG 3.24Å; I330-L334 PolarHBondContact O-N 3.32Å; I330-L334 VanDerWaalsContact O-N 3.09Å; E331-L334 PolarHBondContact O-N 3.5Å; L334-M336 PolarHBondContact O-N 3.34Å; L334-R337 WeakPolarHBondContact O-CB 3.28Å; L334-R337 PolarHBondContact O-N 3.36Å
335	V	74.2	Confident	70.8	Confident	93 Å²	93	87.8 Å²	87.8	56%	0.564	44%	0.436	S	S	*	.	H	α-helix	trans	-64.9	-39	175.7	174.2	0	0	0	0	111.9	E331 K332 D338	E331-V335 WeakPolarHBondContact O-CG2 3.38Å; E331-V335 PolarHBondContact O-N 3.02Å; K332-V335 PolarHBondContact O-N 2.94Å; V335-D338 PolarHBondContact O-N 2.96Å
336	M	67.9	Low	70	Confident	109 Å²	109	87.7 Å²	87.7	54%	0.537	44%	0.437	S	S	.	.	H	α-helix	trans	-68.6	-32.8	177.5	-73.4	-162.3	-64.1	0	0	113	K332 I333 L334 D338 K339	K332-M336 HydrophobicContact CG-CE 4.45Å; K332-M336 WeakPolarHBondContact O-CG 3.45Å; K332-M336 PolarHBondContact O-N 3.49Å; I333-M336 PolarHBondContact O-N 2.98Å; L334-M336 PolarHBondContact O-N 3.34Å; M336-D338 PolarHBondContact O-N 3.19Å; M336-K339 PolarHBondContact O-N 3.1Å
337	R	68.1	Low	69.4	Low	124 Å²	124	90.7 Å²	90.7	47%	0.468	45%	0.45	S	S	.	.	H	α-helix	trans	-58	-35.7	176.5	179	-168.9	171.7	167.9	6.2	112.5	Q299 I333 L334 K339	Q299-R337 VanDerWaalsContact OE1-CZ 3.26Å; I333-R337 PolarHBondContact O-N 2.9Å; L334-R337 WeakPolarHBondContact O-CB 3.28Å; L334-R337 PolarHBondContact O-N 3.36Å; R337-K339 VanDerWaalsContact C-N 3.29Å; R337-K339 PolarHBondContact O-N 3.38Å
338	D	58.7	Low	69.1	Low	130 Å²	130	93.2 Å²	93.2	70%	0.695	46%	0.459	S	S	*	.	H	α-helix	trans	-76.9	-15	-176.9	-74.1	-23.5	0	0	0	113.5	V335 M336 K340	V335-D338 PolarHBondContact O-N 2.96Å; M336-D338 PolarHBondContact O-N 3.19Å; D338-K340 PolarHBondContact O-N 2.82Å
339	K	59	Low	69.1	Low	148 Å²	148	91.8 Å²	91.8	64%	0.643	45%	0.451	S	S	*	.			trans	-79.9	84.8	173.5	-69	-175.7	-179.8	177.5	0	110.7	M336 R337	M336-K339 PolarHBondContact O-N 3.1Å; R337-K339 VanDerWaalsContact C-N 3.29Å; R337-K339 PolarHBondContact O-N 3.38Å
340	K	55.2	Low	69.2	Low	194 Å²	194	94.6 Å²	94.6	84%	0.843	47%	0.471	S	S	*	.	P	Polyproline II helix	trans	-77.7	122.2	171.3	-68.2	-175.6	-178.7	178.2	0	111.2	D338	D338-K340 PolarHBondContact O-N 2.82Å
341	F	57.2	Low	69.4	Low	130 Å²	130	95 Å²	95	57%	0.57	47%	0.473	S	S	*	.	P	Polyproline II helix	trans	-85	130.2	167.7	-70.3	-83.3	0	0	0	110.5	V469	F341-V469 HydrophobicContact CD1-CG1 4.09Å; F341-V469 HydrophobicContact CD2-CG1 4.41Å; F341-V469 HydrophobicContact CE1-CG1 3.74Å; F341-V469 HydrophobicContact CE2-CG1 4.09Å; F341-V469 HydrophobicContact CG-CG1 4.41Å; F341-V469 HydrophobicContact CZ-CG1 3.74Å
342	S	62.8	Low	69.7	Low	64 Å²	64	89.5 Å²	89.5	45%	0.448	45%	0.447	S	S	.	.	P	Polyproline II helix	trans	-86	142.9	-176.8	-177.1	0	0	0	0	112.3	L344 V345	S342-L344 PolarHBondContact O-N 3.4Å; S342-L344 VanDerWaalsContact O-N 3.13Å; S342-L344 VanDerWaalsContact OG-CD1 3.31Å; S342-L344 WeakPolarHBondContact OG-CD1 3.44Å; S342-L344 PolarHBondContact OG-N 2.95Å; S342-V345 WeakPolarHBondContact O-CB 3.2Å; S342-V345 VanDerWaalsContact O-CG2 3.31Å; S342-V345 WeakPolarHBondContact O-CG2 3.38Å; S342-V345 PolarHBondContact O-N 2.63Å
343	I	64.9	Low	70.2	Confident	108 Å²	108	90.9 Å²	90.9	55%	0.554	45%	0.454	S	S	*	.	G	3₁₀ helix	trans	-54.4	-29.4	173	-72.8	160.3	0	0	0	111.7	V345 L346 T473	I343-V345 PolarHBondContact O-N 3.33Å; I343-L346 WeakPolarHBondContact O-CB 3.47Å; I343-L346 PolarHBondContact O-N 3.32Å; I343-T473 HydrophobicContact CB-CG2 4.2Å; I343-T473 HydrophobicContact CG1-CG2 3.44Å; I343-T473 VanDerWaalsContact CG1-CG2 3.44Å
344	L	65.9	Low	70.7	Confident	120 Å²	120	90.9 Å²	90.9	63%	0.628	46%	0.456	S	S	*	.	G	3₁₀ helix	trans	-62.9	-15	179.4	-75.3	87.8	0	0	0	113.5	S342 L346 L347	S342-L344 PolarHBondContact O-N 3.4Å; S342-L344 VanDerWaalsContact O-N 3.13Å; S342-L344 VanDerWaalsContact OG-CD1 3.31Å; S342-L344 WeakPolarHBondContact OG-CD1 3.44Å; S342-L344 PolarHBondContact OG-N 2.95Å; L344-L346 PolarHBondContact O-N 2.96Å; L344-L347 PolarHBondContact O-N 2.99Å
345	V	69.2	Low	71.3	Confident	34 Å²	34	87.9 Å²	87.9	21%	0.206	44%	0.44	C	S	.	.	G	3₁₀ helix	trans	-64.2	-29.7	173.4	177.2	0	0	0	0	111.6	S342 I343 L347 K348 I470 L533	S342-V345 WeakPolarHBondContact O-CB 3.2Å; S342-V345 VanDerWaalsContact O-CG2 3.31Å; S342-V345 WeakPolarHBondContact O-CG2 3.38Å; S342-V345 PolarHBondContact O-N 2.63Å; I343-V345 PolarHBondContact O-N 3.33Å; V345-L347 PolarHBondContact O-N 3.23Å; V345-K348 PolarHBondContact O-N 3Å; V345-I470 HydrophobicContact CG1-CG2 4.14Å; V345-L533 HydrophobicContact CG1-CD1 4.4Å
346	L	67.5	Low	72.1	Confident	11 Å²	11	84 Å²	84	6%	0.058	42%	0.418	C	S	.	.	G	3₁₀ helix	trans	-65.5	-26.7	177.8	-71.8	162.6	0	0	0	112.9	I343 L344 K348 I352 I470 T473 A474	I343-L346 WeakPolarHBondContact O-CB 3.47Å; I343-L346 PolarHBondContact O-N 3.32Å; L344-L346 PolarHBondContact O-N 2.96Å; L346-K348 VanDerWaalsContact C-N 3.34Å; L346-I352 HydrophobicContact CD2-CG2 3.77Å; L346-I470 HydrophobicContact CD2-CD1 4.04Å; L346-T473 HydrophobicContact CD1-CG2 3.77Å; L346-A474 HydrophobicContact CD2-CB 4.08Å
347	L	70.3	Confident	73.2	Confident	116 Å²	116	83.3 Å²	83.3	61%	0.607	42%	0.416	S	S	*	.	G	3₁₀ helix	trans	-84.5	-8	-178.1	-60.2	177.7	0	0	0	113.1	L344 V345 F353	L344-L347 PolarHBondContact O-N 2.99Å; V345-L347 PolarHBondContact O-N 3.23Å; L347-F353 HydrophobicContact CD2-CD2 3.61Å; L347-F353 HydrophobicContact CD2-CE2 3.72Å
348	K	72.4	Confident	74.3	Confident	180 Å²	180	78.4 Å²	78.4	78%	0.783	40%	0.399	S	S	*	.	S	Bend	trans	-75.7	-24.3	-172.4	-79.8	-170.3	171.6	-172.9	0	114.9	V345 L346	V345-K348 PolarHBondContact O-N 3Å; L346-K348 VanDerWaalsContact C-N 3.34Å
349	S	77.9	Confident	76	Confident	48 Å²	48	72.3 Å²	72.3	34%	0.336	37%	0.366	S	S	.	.			trans	-126.8	132.4	-175.8	177.2	0	0	0	0	112.1	N351 I352 F353	S349-N351 PolarHBondContact O-N 3.35Å; S349-N351 PolarHBondContact OG-N 2.78Å; S349-I352 PolarHBondContact O-N 3.46Å; S349-I352 VanDerWaalsContact O-N 3.17Å; S349-F353 WeakPolarHBondContact O-CB 3.21Å; S349-F353 PolarHBondContact O-N 3.09Å
350	C	79.8	Confident	77.6	Confident	69 Å²	69	66.4 Å²	66.4	47%	0.466	34%	0.343	S	S	.	.	H	α-helix	trans	-47.9	-43.6	173.8	-175.8	0	0	0	0	111.6	T354 C543	C350-T354 VanDerWaalsContact O-CB 3.27Å; C350-T354 WeakPolarHBondContact O-CB 3.34Å; C350-T354 PolarHBondContact O-N 3.46Å; C350-T354 PolarHBondContact O-OG1 2.88Å; C350-C543 HydrophobicContact CB-CB 4.26Å; C350-C543 WeakPolarHBondContact CB-SG 3.42Å; C350-C543 WeakPolarHBondContact SG-CB 3.24Å; C350-C543 CovalentContact SG-SG 2.1Å; C350-C543 PolarHBondContact SG-SG 3.24Å
351	N	82.8	Confident	79.5	Confident	22 Å²	22	58.8 Å²	58.8	12%	0.118	31%	0.314	C	S	.	.	H	α-helix	trans	-69.7	-46.5	-177.3	-168	49.5	0	0	0	111.7	S349 T355 Q537 L539	S349-N351 PolarHBondContact O-N 3.35Å; S349-N351 PolarHBondContact OG-N 2.78Å; N351-T355 VanDerWaalsContact O-CB 3.22Å; N351-T355 WeakPolarHBondContact O-CB 3.49Å; N351-T355 PolarHBondContact O-N 3.32Å; N351-T355 PolarHBondContact O-OG1 3.23Å; N351-Q537 PolarHBondContact ND2-O 3.46Å; N351-L539 WeakPolarHBondContact OD1-CG 3.46Å; N351-L539 PolarHBondContact OD1-N 3.42Å
352	I	82.9	Confident	81.3	Confident	10 Å²	10	52.6 Å²	52.6	5%	0.051	29%	0.287	C	S	.	.	H	α-helix	trans	-64.9	-46.9	-179.9	-60.5	172.4	0	0	0	110.1	L346 S349 T355 A356 I470 L533 M536	L346-I352 HydrophobicContact CD2-CG2 3.77Å; S349-I352 PolarHBondContact O-N 3.46Å; S349-I352 VanDerWaalsContact O-N 3.17Å; I352-T355 PolarHBondContact O-N 2.88Å; I352-A356 VanDerWaalsContact O-CB 3.27Å; I352-A356 WeakPolarHBondContact O-CB 3.33Å; I352-A356 PolarHBondContact O-N 3.05Å; I352-I470 HydrophobicContact CD1-CD1 4.42Å; I352-I470 HydrophobicContact CG2-CD1 3.88Å; I352-L533 HydrophobicContact CD1-CD2 3.27Å; I352-M536 HydrophobicContact CB-SD 4.34Å; I352-M536 HydrophobicContact CG1-SD 3.55Å; I352-M536 VanDerWaalsContact CG1-SD 3.55Å
353	F	85.9	Confident	82.8	Confident	96 Å²	96	49.6 Å²	49.6	42%	0.421	27%	0.266	S	S	.	.	H	α-helix	trans	-61.6	-49.3	-179.9	177.8	-105.3	0	0	0	111.7	L347 S349 T355 A356 L357	L347-F353 HydrophobicContact CD2-CD2 3.61Å; L347-F353 HydrophobicContact CD2-CE2 3.72Å; S349-F353 WeakPolarHBondContact O-CB 3.21Å; S349-F353 PolarHBondContact O-N 3.09Å; F353-T355 VanDerWaalsContact C-N 3.3Å; F353-T355 PolarHBondContact O-N 3.01Å; F353-A356 PolarHBondContact O-N 3.31Å; F353-L357 HydrophobicContact CE1-CD2 4.48Å; F353-L357 WeakPolarHBondContact O-CB 3.48Å; F353-L357 PolarHBondContact O-N 2.96Å
354	T	86.9	Confident	84.3	Confident	39 Å²	39	47.5 Å²	47.5	24%	0.239	26%	0.255	C	S	.	.	H	α-helix	trans	-64	-39.1	179.4	-53.3	0	0	0	0	111	C350 L357 L358 L539	C350-T354 VanDerWaalsContact O-CB 3.27Å; C350-T354 WeakPolarHBondContact O-CB 3.34Å; C350-T354 PolarHBondContact O-N 3.46Å; C350-T354 PolarHBondContact O-OG1 2.88Å; T354-L357 PolarHBondContact O-N 3.3Å; T354-L358 HydrophobicContact CG2-CD1 4.19Å; T354-L358 HydrophobicContact CG2-CG 4.47Å; T354-L358 WeakPolarHBondContact O-CB 3.5Å; T354-L358 WeakPolarHBondContact O-CG 3.43Å; T354-L358 PolarHBondContact O-N 3.35Å; T354-L539 VanDerWaalsContact CB-CD1 3.43Å; T354-L539 HydrophobicContact CG2-CD1 3.48Å; T354-L539 VanDerWaalsContact CG2-CD1 3.48Å
355	T	88.6	Confident	85.8	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-65.3	-41.9	176.3	-57.8	0	0	0	0	111.6	N351 I352 F353 S359 L465 F466 L521 M536 L539	N351-T355 VanDerWaalsContact O-CB 3.22Å; N351-T355 WeakPolarHBondContact O-CB 3.49Å; N351-T355 PolarHBondContact O-N 3.32Å; N351-T355 PolarHBondContact O-OG1 3.23Å; I352-T355 PolarHBondContact O-N 2.88Å; F353-T355 VanDerWaalsContact C-N 3.3Å; F353-T355 PolarHBondContact O-N 3.01Å; T355-S359 VanDerWaalsContact O-CB 3.25Å; T355-S359 WeakPolarHBondContact O-CB 3.25Å; T355-S359 PolarHBondContact O-N 3Å; T355-S359 PolarHBondContact O-OG 2.96Å; T355-L465 HydrophobicContact CG2-CD1 4.25Å; T355-L465 HydrophobicContact CG2-CD2 3.16Å; T355-L465 HydrophobicContact CG2-CG 3.6Å; T355-F466 HydrophobicContact CG2-CE1 4.14Å; T355-F466 HydrophobicContact CG2-CZ 3.99Å; T355-L521 HydrophobicContact CG2-CD2 4.16Å; T355-M536 HydrophobicContact CG2-CE 3.54Å; T355-L539 WeakPolarHBondContact OG1-CD1 3.37Å; T355-L539 WeakPolarHBondContact OG1-CG 3.49Å
356	A	89.4	Confident	87	Confident	12 Å²	12	40.8 Å²	40.8	10%	0.099	22%	0.218	C	C	.	.	H	α-helix	trans	-64.7	-40.6	174.9	0	0	0	0	0	112.3	I352 F353 S360 F466	I352-A356 VanDerWaalsContact O-CB 3.27Å; I352-A356 WeakPolarHBondContact O-CB 3.33Å; I352-A356 PolarHBondContact O-N 3.05Å; F353-A356 PolarHBondContact O-N 3.31Å; A356-S360 VanDerWaalsContact O-CB 3.22Å; A356-S360 WeakPolarHBondContact O-CB 3.25Å; A356-S360 PolarHBondContact O-N 2.89Å; A356-S360 PolarHBondContact O-OG 3.29Å; A356-F466 HydrophobicContact CB-CE1 4.22Å; A356-F466 HydrophobicContact CB-CZ 4.15Å
357	L	91.2	Very high	88.3	Confident	94 Å²	94	40.3 Å²	40.3	49%	0.492	22%	0.216	S	C	.	.	H	α-helix	trans	-65.4	-49.9	176.9	-177.1	63.6	0	0	0	111.4	F353 T354 S359 S360 S361	F353-L357 HydrophobicContact CE1-CD2 4.48Å; F353-L357 WeakPolarHBondContact O-CB 3.48Å; F353-L357 PolarHBondContact O-N 2.96Å; T354-L357 PolarHBondContact O-N 3.3Å; L357-S359 VanDerWaalsContact C-N 3.35Å; L357-S359 PolarHBondContact O-N 3.48Å; L357-S360 PolarHBondContact O-N 3.19Å; L357-S361 WeakPolarHBondContact O-CB 3.46Å; L357-S361 PolarHBondContact O-N 3.5Å; L357-S361 PolarHBondContact O-OG 3.43Å; L357-S361 VanDerWaalsContact O-OG 3.09Å
358	L	92.6	Very high	89.5	Confident	22 Å²	22	35.3 Å²	35.3	12%	0.115	19%	0.19	C	C	.	.	H	α-helix	trans	-60.2	-45	177	-72.1	173.5	0	0	0	111.6	T354 S361 L362 F517 M520 L521 L539	T354-L358 HydrophobicContact CG2-CD1 4.19Å; T354-L358 HydrophobicContact CG2-CG 4.47Å; T354-L358 WeakPolarHBondContact O-CB 3.5Å; T354-L358 WeakPolarHBondContact O-CG 3.43Å; T354-L358 PolarHBondContact O-N 3.35Å; L358-S361 PolarHBondContact O-N 2.88Å; L358-L362 WeakPolarHBondContact O-CG 3.39Å; L358-L362 PolarHBondContact O-N 2.82Å; L358-F517 HydrophobicContact CD2-CB 4.34Å; L358-F517 HydrophobicContact CD2-CG 4.38Å; L358-M520 HydrophobicContact CD1-CB 3.99Å; L358-M520 HydrophobicContact CD2-SD 4.37Å; L358-L521 HydrophobicContact CB-CD2 4.02Å; L358-L521 HydrophobicContact CD1-CD2 4.05Å; L358-L539 HydrophobicContact CD1-CD2 4.07Å
359	S	92.7	Very high	90.7	Very high	2 Å²	2	26.7 Å²	26.7	1%	0.014	15%	0.152	C	C	.	.	H	α-helix	trans	-62.4	-46.4	176.9	-57.3	0	0	0	0	111	T355 L357 S361 L362 W363 L465	T355-S359 VanDerWaalsContact O-CB 3.25Å; T355-S359 WeakPolarHBondContact O-CB 3.25Å; T355-S359 PolarHBondContact O-N 3Å; T355-S359 PolarHBondContact O-OG 2.96Å; L357-S359 VanDerWaalsContact C-N 3.35Å; L357-S359 PolarHBondContact O-N 3.48Å; S359-S361 VanDerWaalsContact C-N 3.34Å; S359-S361 PolarHBondContact O-N 3.27Å; S359-L362 WeakPolarHBondContact O-CB 3.37Å; S359-L362 PolarHBondContact O-N 3.43Å; S359-L362 VanDerWaalsContact O-N 3.15Å; S359-W363 PolarHBondContact O-N 3Å; S359-L465 VanDerWaalsContact OG-CD2 3.22Å; S359-L465 WeakPolarHBondContact OG-CD2 3.24Å
360	S	93.9	Very high	91.5	Very high	23 Å²	23	25.7 Å²	25.7	16%	0.161	14%	0.141	C	C	.	.	H	α-helix	trans	-61.4	-41.4	179	-61.1	0	0	0	0	112.2	A356 L357 W363 M364	A356-S360 VanDerWaalsContact O-CB 3.22Å; A356-S360 WeakPolarHBondContact O-CB 3.25Å; A356-S360 PolarHBondContact O-N 2.89Å; A356-S360 PolarHBondContact O-OG 3.29Å; L357-S360 PolarHBondContact O-N 3.19Å; S360-W363 PolarHBondContact O-N 3.24Å; S360-M364 WeakPolarHBondContact O-CB 2.97Å; S360-M364 PolarHBondContact O-N 2.98Å
361	S	94.3	Very high	92.1	Very high	34 Å²	34	22.9 Å²	22.9	24%	0.238	12%	0.121	C	C	.	.	H	α-helix	trans	-62.6	-41.9	174.3	-64.1	0	0	0	0	112.2	L357 L358 S359 M364 I365	L357-S361 WeakPolarHBondContact O-CB 3.46Å; L357-S361 PolarHBondContact O-N 3.5Å; L357-S361 PolarHBondContact O-OG 3.43Å; L357-S361 VanDerWaalsContact O-OG 3.09Å; L358-S361 PolarHBondContact O-N 2.88Å; S359-S361 VanDerWaalsContact C-N 3.34Å; S359-S361 PolarHBondContact O-N 3.27Å; S361-M364 PolarHBondContact O-N 3.24Å; S361-I365 VanDerWaalsContact O-CG1 3.28Å; S361-I365 WeakPolarHBondContact O-CG1 3.39Å; S361-I365 PolarHBondContact O-N 3.3Å
362	L	95.1	Very high	92.6	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-61.7	-48	174.5	-74.1	174	0	0	0	111.5	L358 S359 M364 I365 V366 L419 L458 G514 F517 L521	L358-L362 WeakPolarHBondContact O-CG 3.39Å; L358-L362 PolarHBondContact O-N 2.82Å; S359-L362 WeakPolarHBondContact O-CB 3.37Å; S359-L362 PolarHBondContact O-N 3.43Å; S359-L362 VanDerWaalsContact O-N 3.15Å; L362-M364 VanDerWaalsContact C-N 3.29Å; L362-M364 PolarHBondContact O-N 3.05Å; L362-I365 PolarHBondContact O-N 3.26Å; L362-V366 WeakPolarHBondContact O-CG2 3.43Å; L362-V366 PolarHBondContact O-N 2.94Å; L362-L419 HydrophobicContact CD2-CD1 4.26Å; L362-L458 HydrophobicContact CB-CD1 4.05Å; L362-L458 HydrophobicContact CD1-CD1 4.49Å; L362-G514 WeakPolarHBondContact CD2-O 3.47Å; L362-F517 HydrophobicContact CD2-CB 4.1Å; L362-F517 HydrophobicContact CG-CB 4.43Å; L362-L521 HydrophobicContact CD1-CD1 3.53Å
363	W	95.6	Very high	93.1	Very high	2 Å²	2	21.4 Å²	21.4	1%	0.008	11%	0.113	C	C	.	.	H	α-helix	trans	-57.1	-43.1	176.6	-85.1	76	0	0	0	112.3	S359 S360 A367 L458 Y459 T462 M475 C478 A482	S359-W363 PolarHBondContact O-N 3Å; S360-W363 PolarHBondContact O-N 3.24Å; W363-A367 WeakPolarHBondContact O-CB 3.4Å; W363-A367 PolarHBondContact O-N 2.94Å; W363-L458 HydrophobicContact CB-CD2 4.18Å; W363-L458 HydrophobicContact CD2-CD2 3.9Å; W363-L458 HydrophobicContact CD2-CG 4.27Å; W363-L458 HydrophobicContact CG-CD2 3.61Å; W363-L458 HydrophobicContact CG-CG 4.16Å; W363-Y459 AromaticContact CH2-CD1 3.55Å; W363-Y459 HydrophobicContact CH2-CD1 3.55Å; W363-Y459 HydrophobicContact CH2-CD2 4Å; W363-Y459 AromaticContact CH2-CE1 3.34Å; W363-Y459 HydrophobicContact CH2-CE1 3.34Å; W363-Y459 AromaticContact CH2-CE2 3.78Å; W363-Y459 HydrophobicContact CH2-CE2 3.78Å; W363-Y459 AromaticContact CH2-CG 3.87Å; W363-Y459 HydrophobicContact CH2-CG 3.87Å; W363-Y459 AromaticContact CH2-CZ 3.44Å; W363-Y459 VanDerWaalsContact CH2-CZ 3.44Å; W363-Y459 HydrophobicContact CZ2-CD1 4.21Å; W363-Y459 HydrophobicContact CZ2-CE1 4.41Å; W363-Y459 HydrophobicContact CZ2-CG 4.29Å; W363-Y459 HydrophobicContact CZ3-CD1 4.47Å; W363-Y459 HydrophobicContact CZ3-CD2 4.47Å; W363-Y459 AromaticContact CZ3-CE1 3.9Å; W363-Y459 HydrophobicContact CZ3-CE1 3.9Å; W363-Y459 AromaticContact CZ3-CE2 3.86Å; W363-Y459 HydrophobicContact CZ3-CE2 3.86Å; W363-Y459 AromaticContact CZ3-CZ 3.53Å; W363-T462 HydrophobicContact CZ2-CG2 4.45Å; W363-T462 PolarHBondContact NE1-OG1 2.95Å; W363-M475 HydrophobicContact CZ2-CE 4.48Å; W363-C478 HydrophobicContact CB-CB 4.32Å; W363-C478 WeakPolarHBondContact CB-O 3.17Å; W363-C478 HydrophobicContact CD2-CB 3.95Å; W363-C478 HydrophobicContact CG-CB 3.71Å; W363-A482 HydrophobicContact CB-CB 3.97Å; W363-A482 HydrophobicContact CE3-CB 3.74Å
364	M	96	Very high	93.4	Very high	63 Å²	63	17 Å²	17	31%	0.31	9%	0.094	S	C	.	.	H	α-helix	trans	-60.9	-49.8	174.8	-171.5	178.9	68.9	0	0	111.9	S360 S361 L362 M368	S360-M364 WeakPolarHBondContact O-CB 2.97Å; S360-M364 PolarHBondContact O-N 2.98Å; S361-M364 PolarHBondContact O-N 3.24Å; L362-M364 VanDerWaalsContact C-N 3.29Å; L362-M364 PolarHBondContact O-N 3.05Å; M364-M368 WeakPolarHBondContact O-CB 3.45Å; M364-M368 PolarHBondContact O-N 3.3Å
365	I	96.1	Very high	93.6	Very high	13 Å²	13	16 Å²	16	7%	0.067	9%	0.087	C	C	.	.	H	α-helix	trans	-60.6	-48.7	-179.8	-70.4	165.5	0	0	0	111.3	S361 L362 N369 M510 F517	S361-I365 VanDerWaalsContact O-CG1 3.28Å; S361-I365 WeakPolarHBondContact O-CG1 3.39Å; S361-I365 PolarHBondContact O-N 3.3Å; L362-I365 PolarHBondContact O-N 3.26Å; I365-N369 WeakPolarHBondContact O-CB 3.41Å; I365-N369 PolarHBondContact O-N 3.14Å; I365-N369 PolarHBondContact O-ND2 3.29Å; I365-M510 HydrophobicContact CG2-CB 4.32Å; I365-M510 WeakPolarHBondContact CG2-O 2.95Å; I365-F517 HydrophobicContact CD1-CD2 4.22Å; I365-F517 HydrophobicContact CD1-CE2 4.01Å
366	V	95.9	Very high	93.7	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-69.3	-43.8	-176.3	-168.8	0	0	0	0	110.9	L362 M368 N369 Y370 L419 I451 A454 F455 L458	L362-V366 WeakPolarHBondContact O-CG2 3.43Å; L362-V366 PolarHBondContact O-N 2.94Å; V366-M368 PolarHBondContact O-N 2.93Å; V366-N369 PolarHBondContact O-N 3.01Å; V366-Y370 VanDerWaalsContact O-CB 3.24Å; V366-Y370 WeakPolarHBondContact O-CB 3.36Å; V366-Y370 PolarHBondContact O-N 3.17Å; V366-L419 HydrophobicContact CG2-CD2 3.82Å; V366-I451 HydrophobicContact CG1-CG2 4.21Å; V366-A454 HydrophobicContact CG1-CB 4.21Å; V366-F455 HydrophobicContact CB-CD2 4.12Å; V366-F455 HydrophobicContact CG1-CB 3.8Å; V366-F455 HydrophobicContact CG1-CD2 3.63Å; V366-F455 HydrophobicContact CG1-CG 4.22Å; V366-L458 HydrophobicContact CB-CD2 4.24Å; V366-L458 HydrophobicContact CG2-CD2 3.98Å
367	A	95.2	Very high	93.5	Very high	1 Å²	1	15.7 Å²	15.7	1%	0.008	8%	0.084	C	C	.	.	H	α-helix	trans	-61.4	-46.9	177.3	0	0	0	0	0	111.3	W363 N369 Y370 F371 F455 A482 T486	W363-A367 WeakPolarHBondContact O-CB 3.4Å; W363-A367 PolarHBondContact O-N 2.94Å; A367-N369 PolarHBondContact O-N 3.37Å; A367-Y370 PolarHBondContact O-N 2.79Å; A367-F371 VanDerWaalsContact O-CD2 3.26Å; A367-F371 WeakPolarHBondContact O-CD2 3.49Å; A367-F371 PolarHBondContact O-N 2.81Å; A367-F455 HydrophobicContact CB-CE2 4.03Å; A367-A482 HydrophobicContact CB-CB 3.7Å; A367-A482 WeakPolarHBondContact CB-O 3.22Å; A367-T486 HydrophobicContact CB-CG2 3.95Å
368	M	95.6	Very high	93	Very high	11 Å²	11	12.3 Å²	12.3	5%	0.054	7%	0.068	C	C	.	.	H	α-helix	trans	-58.6	-47.2	178.3	-177.1	168.4	53.8	0	0	112.3	M364 V366 A372 I488 S489 I492 M510	M364-M368 WeakPolarHBondContact O-CB 3.45Å; M364-M368 PolarHBondContact O-N 3.3Å; V366-M368 PolarHBondContact O-N 2.93Å; M368-A372 WeakPolarHBondContact O-CB 3.31Å; M368-A372 PolarHBondContact O-N 3.39Å; M368-I488 HydrophobicContact SD-CB 4.4Å; M368-I488 HydrophobicContact SD-CG2 4.09Å; M368-S489 WeakPolarHBondContact O-CB 3.25Å; M368-I492 HydrophobicContact CE-CD1 4.42Å; M368-I492 HydrophobicContact CG-CD1 3.37Å; M368-I492 HydrophobicContact SD-CD1 3.38Å; M368-I492 WeakPolarHBondContact SD-CD1 3.22Å; M368-M510 HydrophobicContact CE-CE 3.32Å; M368-M510 HydrophobicContact CE-SD 3.31Å; M368-M510 WeakPolarHBondContact CE-SD 3.34Å; M368-M510 HydrophobicContact SD-CE 4.07Å; M368-M510 HydrophobicContact SD-SD 4.4Å
369	N	95.9	Very high	92.5	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-63.7	-44.3	175.9	-85.4	-85.6	0	0	0	112.3	I365 V366 A367 F371 A372 L373 I451 M507	I365-N369 WeakPolarHBondContact O-CB 3.41Å; I365-N369 PolarHBondContact O-N 3.14Å; I365-N369 PolarHBondContact O-ND2 3.29Å; V366-N369 PolarHBondContact O-N 3.01Å; A367-N369 PolarHBondContact O-N 3.37Å; N369-F371 PolarHBondContact O-N 2.91Å; N369-A372 PolarHBondContact O-N 3.47Å; N369-L373 WeakPolarHBondContact O-CB 3.22Å; N369-L373 VanDerWaalsContact O-CG 3.27Å; N369-L373 WeakPolarHBondContact O-CG 3.29Å; N369-L373 PolarHBondContact O-N 2.96Å; N369-I451 HydrophobicContact CB-CD1 4.25Å; N369-I451 HydrophobicContact CB-CG1 4.38Å; N369-I451 HydrophobicContact CB-CG2 3.93Å; N369-M507 VanDerWaalsContact OD1-C 3.24Å; N369-M507 VanDerWaalsContact OD1-CA 3.24Å; N369-M507 WeakPolarHBondContact OD1-CA 3.48Å; N369-M507 WeakPolarHBondContact OD1-CB 3.38Å; N369-M507 PolarHBondContact OD1-O 2.69Å
370	Y	94.5	Very high	92.1	Very high	26 Å²	26	16 Å²	16	10%	0.102	9%	0.087	C	C	.	.	H	α-helix	trans	-59.1	-50.2	-179	174	-100	0	0	0	111.6	V366 A367 L373 I374 E395 T452	V366-Y370 VanDerWaalsContact O-CB 3.24Å; V366-Y370 WeakPolarHBondContact O-CB 3.36Å; V366-Y370 PolarHBondContact O-N 3.17Å; A367-Y370 PolarHBondContact O-N 2.79Å; Y370-L373 PolarHBondContact O-N 3.27Å; Y370-I374 HydrophobicContact CD1-CD1 3.93Å; Y370-I374 HydrophobicContact CE1-CD1 3.4Å; Y370-I374 VanDerWaalsContact CE1-CD1 3.4Å; Y370-I374 HydrophobicContact CE2-CD1 4.29Å; Y370-I374 WeakPolarHBondContact O-CG1 3.46Å; Y370-I374 PolarHBondContact O-N 2.98Å; Y370-I374 VanDerWaalsContact O-N 3.15Å; Y370-E395 PolarHBondContact OH-OE1 2.96Å; Y370-T452 HydrophobicContact CE2-CG2 4.43Å
371	F	93.1	Very high	91.4	Very high	11 Å²	11	17 Å²	17	5%	0.048	9%	0.09	C	C	.	.	H	α-helix	trans	-73.3	-35.5	179.5	-74.8	-75.2	0	0	0	112.8	Y162 Y220 A367 N369 L373 I374 L375 T486	Y162-F371 HydrophobicContact CE1-CD1 4.08Å; Y162-F371 HydrophobicContact CE1-CE1 4.05Å; Y162-F371 AromaticContact CZ-CD1 3.75Å; Y162-F371 WeakPolarHBondContact OH-CD1 3.26Å; Y220-F371 WeakPolarHBondContact OH-CE1 3.37Å; A367-F371 VanDerWaalsContact O-CD2 3.26Å; A367-F371 WeakPolarHBondContact O-CD2 3.49Å; A367-F371 PolarHBondContact O-N 2.81Å; N369-F371 PolarHBondContact O-N 2.91Å; F371-L373 VanDerWaalsContact C-N 3.33Å; F371-L373 PolarHBondContact O-N 3.22Å; F371-I374 HydrophobicContact CD1-CD1 4.05Å; F371-I374 HydrophobicContact CE1-CD1 4.37Å; F371-I374 PolarHBondContact O-N 3.27Å; F371-L375 VanDerWaalsContact O-CG 3.28Å; F371-L375 WeakPolarHBondContact O-CG 3.46Å; F371-L375 PolarHBondContact O-N 3.26Å; F371-T486 HydrophobicContact CD2-CG2 3.24Å; F371-T486 HydrophobicContact CE2-CG2 3.33Å; F371-T486 HydrophobicContact CG-CG2 4.2Å; F371-T486 HydrophobicContact CZ-CG2 4.33Å
372	A	94.4	Very high	90.9	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-59.9	-43.6	173.6	0	0	0	0	0	111.3	M368 N369 L375 N376 I493 M507	M368-A372 WeakPolarHBondContact O-CB 3.31Å; M368-A372 PolarHBondContact O-N 3.39Å; N369-A372 PolarHBondContact O-N 3.47Å; A372-L375 PolarHBondContact O-N 2.73Å; A372-N376 VanDerWaalsContact O-CB 3.27Å; A372-N376 WeakPolarHBondContact O-CB 3.47Å; A372-N376 PolarHBondContact O-N 2.6Å; A372-I493 HydrophobicContact CB-CD1 3.89Å; A372-I493 HydrophobicContact CB-CG1 4.23Å; A372-I493 WeakPolarHBondContact O-CD1 3.4Å; A372-M507 HydrophobicContact CB-CG 4.18Å; A372-M507 HydrophobicContact CB-SD 3.41Å; A372-M507 WeakPolarHBondContact CB-SD 2.96Å
373	L	93.3	Very high	90.6	Very high	1 Å²	1	21.8 Å²	21.8	1%	0.005	13%	0.127	C	C	.	.	H	α-helix	trans	-64.2	-40	175.5	-71.4	170.3	0	0	0	113	N369 Y370 F371 L375 N376 T377 I426 E444 K448 I451 M507	N369-L373 WeakPolarHBondContact O-CB 3.22Å; N369-L373 VanDerWaalsContact O-CG 3.27Å; N369-L373 WeakPolarHBondContact O-CG 3.29Å; N369-L373 PolarHBondContact O-N 2.96Å; Y370-L373 PolarHBondContact O-N 3.27Å; F371-L373 VanDerWaalsContact C-N 3.33Å; F371-L373 PolarHBondContact O-N 3.22Å; L373-L375 VanDerWaalsContact C-N 3.34Å; L373-N376 PolarHBondContact O-N 3.48Å; L373-T377 PolarHBondContact O-N 3.46Å; L373-T377 VanDerWaalsContact O-N 3.16Å; L373-T377 PolarHBondContact O-OG1 3.2Å; L373-I426 HydrophobicContact CD1-CD1 3.78Å; L373-I426 HydrophobicContact CD2-CD1 3.97Å; L373-I426 HydrophobicContact CD2-CG1 4.11Å; L373-I426 HydrophobicContact CG-CD1 4.3Å; L373-E444 HydrophobicContact CD2-CG 4.27Å; L373-K448 HydrophobicContact CB-CD 3.93Å; L373-K448 HydrophobicContact CD1-CD 4.37Å; L373-I451 HydrophobicContact CD1-CB 4.13Å; L373-I451 HydrophobicContact CD1-CG1 3.93Å; L373-I451 HydrophobicContact CD1-CG2 4.43Å; L373-M507 HydrophobicContact CD2-CE 4.38Å; L373-M507 HydrophobicContact CD2-SD 4.2Å; L373-M507 HydrophobicContact CG-SD 4.24Å
374	I	91.3	Very high	90.4	Very high	2 Å²	2	22.3 Å²	22.3	1%	0.01	13%	0.131	C	C	.	.	H	α-helix	trans	-56.7	-51.1	172.8	-68.5	168	0	0	0	110.1	I49 V52 Y370 F371 N376 T377	I49-I374 HydrophobicContact CB-CG2 4.49Å; I49-I374 HydrophobicContact CD1-CD1 4.33Å; I49-I374 HydrophobicContact CD1-CG2 4.1Å; I49-I374 HydrophobicContact CG1-CG2 4.07Å; I49-I374 HydrophobicContact CG2-CG2 3.66Å; V52-I374 HydrophobicContact CG2-CG2 4.39Å; Y370-I374 HydrophobicContact CD1-CD1 3.93Å; Y370-I374 HydrophobicContact CE1-CD1 3.4Å; Y370-I374 VanDerWaalsContact CE1-CD1 3.4Å; Y370-I374 HydrophobicContact CE2-CD1 4.29Å; Y370-I374 WeakPolarHBondContact O-CG1 3.46Å; Y370-I374 PolarHBondContact O-N 2.98Å; Y370-I374 VanDerWaalsContact O-N 3.15Å; F371-I374 HydrophobicContact CD1-CD1 4.05Å; F371-I374 HydrophobicContact CE1-CD1 4.37Å; F371-I374 PolarHBondContact O-N 3.27Å; I374-N376 VanDerWaalsContact C-N 3.29Å; I374-N376 PolarHBondContact O-N 3.4Å; I374-T377 WeakPolarHBondContact O-CB 3.4Å; I374-T377 PolarHBondContact O-N 3.35Å; I374-T377 PolarHBondContact O-OG1 3.15Å
375	L	91	Very high	90.3	Very high	19 Å²	19	20 Å²	20	10%	0.099	12%	0.119	C	C	.	.	H	α-helix	trans	-68.4	-28.6	-176.9	-65.1	172.1	0	0	0	112.7	I51 V52 T158 F371 A372 L373 P490 I493	I51-L375 HydrophobicContact CG2-CD2 4.2Å; V52-L375 HydrophobicContact CG2-CD2 4.01Å; T158-L375 HydrophobicContact CG2-CD1 3.95Å; T158-L375 HydrophobicContact CG2-CD2 3.96Å; F371-L375 VanDerWaalsContact O-CG 3.28Å; F371-L375 WeakPolarHBondContact O-CG 3.46Å; F371-L375 PolarHBondContact O-N 3.26Å; A372-L375 PolarHBondContact O-N 2.73Å; L373-L375 VanDerWaalsContact C-N 3.34Å; L375-P490 HydrophobicContact CD1-CB 4.06Å; L375-P490 HydrophobicContact CD1-CG 3.8Å; L375-I493 HydrophobicContact CB-CG1 4.31Å
376	N	90.4	Very high	90.1	Very high	6 Å²	6	24 Å²	24	3%	0.032	14%	0.14	C	C	.	.	H	α-helix	trans	-79.1	-18.8	178	-168.3	64.2	0	0	0	113.5	A372 L373 I374 S378 N379 L380 E444 I493 Y504	A372-N376 VanDerWaalsContact O-CB 3.27Å; A372-N376 WeakPolarHBondContact O-CB 3.47Å; A372-N376 PolarHBondContact O-N 2.6Å; L373-N376 PolarHBondContact O-N 3.48Å; I374-N376 VanDerWaalsContact C-N 3.29Å; I374-N376 PolarHBondContact O-N 3.4Å; N376-S378 PolarHBondContact O-N 3.17Å; N376-S378 VanDerWaalsContact O-N 3.08Å; N376-N379 WeakPolarHBondContact O-CA 3.28Å; N376-N379 WeakPolarHBondContact O-CB 3.45Å; N376-N379 PolarHBondContact O-N 2.93Å; N376-L380 PolarHBondContact O-N 3.03Å; N376-E444 PolarHBondContact ND2-OE2 2.84Å; N376-I493 HydrophobicContact CB-CD1 3.75Å; N376-I493 HydrophobicContact CB-CG1 4.34Å; N376-Y504 WeakPolarHBondContact ND2-CE1 3.12Å; N376-Y504 VanDerWaalsContact ND2-CZ 3.33Å; N376-Y504 PolarHBondContact ND2-OH 2.84Å
377	T	85.6	Confident	90	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	14%	0.141	C	C	.	.	G	3₁₀ helix	trans	-59.7	-29.6	-171.4	-58.5	0	0	0	0	112.6	L373 I374 N379 L380 N387 C388 S391 M445	L373-T377 PolarHBondContact O-N 3.46Å; L373-T377 VanDerWaalsContact O-N 3.16Å; L373-T377 PolarHBondContact O-OG1 3.2Å; I374-T377 WeakPolarHBondContact O-CB 3.4Å; I374-T377 PolarHBondContact O-N 3.35Å; I374-T377 PolarHBondContact O-OG1 3.15Å; T377-N379 VanDerWaalsContact C-N 3.34Å; T377-L380 HydrophobicContact CG2-CD1 4.49Å; T377-N387 HydrophobicContact CG2-CB 3.85Å; T377-N387 WeakPolarHBondContact CG2-O 3.43Å; T377-C388 VanDerWaalsContact CG2-CA 3.49Å; T377-C388 HydrophobicContact CG2-CB 4.29Å; T377-S391 PolarHBondContact OG1-OG 2.89Å; T377-M445 HydrophobicContact CG2-CE 4.5Å
378	S	80.1	Confident	89.9	Confident	22 Å²	22	24.2 Å²	24.2	15%	0.154	14%	0.141	C	C	.	.	G	3₁₀ helix	trans	-75.8	-18.3	174.8	56.2	0	0	0	0	114.4	V52 N376	V52-S378 WeakPolarHBondContact CG1-OG 3.43Å; N376-S378 PolarHBondContact O-N 3.17Å; N376-S378 VanDerWaalsContact O-N 3.08Å
379	N	83.1	Confident	89.8	Confident	91 Å²	91	27.5 Å²	27.5	49%	0.487	16%	0.155	S	C	.	.	G	3₁₀ helix	trans	-91.7	-6.4	-179.4	-61.3	-28.2	0	0	0	112.7	N376 T377	N376-N379 WeakPolarHBondContact O-CA 3.28Å; N376-N379 WeakPolarHBondContact O-CB 3.45Å; N376-N379 PolarHBondContact O-N 2.93Å; T377-N379 VanDerWaalsContact C-N 3.34Å
380	L	83.5	Confident	89.7	Confident	10 Å²	10	30.6 Å²	30.6	5%	0.052	17%	0.171	C	C	.	.	S	Bend	trans	-61.1	150	169.6	-84.3	174.5	0	0	0	111.4	N376 T377 N387 V441 E444 M445	N376-L380 PolarHBondContact O-N 3.03Å; T377-L380 HydrophobicContact CG2-CD1 4.49Å; L380-N387 VanDerWaalsContact CB-ND2 3.32Å; L380-N387 WeakPolarHBondContact CB-ND2 3.22Å; L380-N387 HydrophobicContact CD1-CB 4.3Å; L380-V441 HydrophobicContact CD1-CG2 4.26Å; L380-E444 HydrophobicContact CD1-CB 4.18Å; L380-E444 HydrophobicContact CD1-CG 4.15Å; L380-E444 WeakPolarHBondContact CD1-OE1 3.28Å; L380-E444 WeakPolarHBondContact CD1-OE2 3.46Å; L380-E444 HydrophobicContact CD2-CB 4.35Å; L380-E444 WeakPolarHBondContact CD2-OE2 3.28Å; L380-E444 WeakPolarHBondContact CG-OE2 3.41Å; L380-M445 HydrophobicContact CD1-CE 4.19Å
381	H	79.6	Confident	89.6	Confident	45 Å²	45	29.4 Å²	29.4	21%	0.208	17%	0.167	C	C	.	.	S	Bend	trans	-60.5	148.1	170.7	-61.2	114	0	0	0	111.2	N387 P437 R500	H381-N387 PolarHBondContact O-ND2 3.33Å; H381-P437 HydrophobicContact CB-CB 3.64Å; H381-R500 PolarHBondContact CD2-NH2 3.29Å; H381-R500 VanDerWaalsContact CE1-CZ 3.41Å; H381-R500 PolarHBondContact CE1-NH1 3.44Å; H381-R500 PolarHBondContact CE1-NH2 3.18Å; H381-R500 PolarHBondContact ND1-NH2 3.29Å; H381-R500 VanDerWaalsContact NE2-CZ 3.31Å; H381-R500 PolarHBondContact NE2-NH1 3.02Å; H381-R500 PolarHBondContact NE2-NH2 3.16Å
382	G	83.4	Confident	89.6	Confident	62 Å²	62	28.9 Å²	28.9	64%	0.639	17%	0.165	S	C	*	.	S	Bend	trans	98	-152.5	178.9	0	0	0	0	0	113.3	P384	G382-P384 WeakPolarHBondContact O-CD 3.38Å
383	N	89.4	Confident	89.6	Confident	72 Å²	72	30.3 Å²	30.3	39%	0.385	18%	0.176	S	C	.	.			trans	-85.6	117.9	-175.3	-176.1	-49.7	0	0	0	110.5	Y385 L386 N387	N383-Y385 VanDerWaalsContact C-N 3.3Å; N383-Y385 PolarHBondContact O-N 3.03Å; N383-Y385 WeakPolarHBondContact OD1-CA 3.25Å; N383-Y385 VanDerWaalsContact OD1-CB 3.32Å; N383-Y385 WeakPolarHBondContact OD1-CB 3.33Å; N383-Y385 WeakPolarHBondContact OD1-CD2 2.98Å; N383-Y385 PolarHBondContact OD1-N 3.47Å; N383-L386 HydrophobicContact CB-CB 4.08Å; N383-L386 PolarHBondContact O-N 3.5Å; N383-L386 PolarHBondContact OD1-N 3.5Å; N383-N387 VanDerWaalsContact O-CG 3.27Å; N383-N387 PolarHBondContact O-N 3.13Å
384	P	90.9	Very high	89.6	Confident	14 Å²	14	31.4 Å²	31.4	9%	0.091	18%	0.183	C	C	.	.	H	α-helix	trans	-64.5	-32.3	-175.5	24.6	-33.4	0	0	0	113.1	V135 G382 C388	V135-P384 HydrophobicContact CG1-CG 3.78Å; G382-P384 WeakPolarHBondContact O-CD 3.38Å; P384-C388 VanDerWaalsContact O-CB 3.25Å; P384-C388 WeakPolarHBondContact O-CB 3.25Å; P384-C388 PolarHBondContact O-N 3.42Å
385	Y	93	Very high	89.6	Confident	14 Å²	14	31.3 Å²	31.3	6%	0.055	18%	0.183	C	C	.	.	H	α-helix	trans	-66.8	-45	176.7	-54.5	-77.3	0	0	0	111.1	F53 V135 Y136 P259 A262 F263 N383 C388 F389	F53-Y385 AromaticContact CD1-CD1 3.86Å; F53-Y385 HydrophobicContact CD1-CD1 3.86Å; F53-Y385 AromaticContact CD1-CE1 3.6Å; F53-Y385 HydrophobicContact CD1-CE1 3.6Å; F53-Y385 AromaticContact CE1-CD1 3.31Å; F53-Y385 HydrophobicContact CE1-CD1 3.31Å; F53-Y385 AromaticContact CE1-CE1 3.58Å; F53-Y385 HydrophobicContact CE1-CE1 3.58Å; F53-Y385 HydrophobicContact CE1-CG 4.14Å; F53-Y385 HydrophobicContact CZ-CD1 4.05Å; V135-Y385 HydrophobicContact CG1-CE2 3.98Å; V135-Y385 PolarHBondContact O-OH 3.2Å; Y136-Y385 WeakPolarHBondContact CE1-OH 3.28Å; P259-Y385 WeakPolarHBondContact CB-O 3.5Å; A262-Y385 HydrophobicContact CB-CD1 3.93Å; A262-Y385 HydrophobicContact CB-CE1 3.69Å; A262-Y385 VanDerWaalsContact O-CE1 3.27Å; A262-Y385 WeakPolarHBondContact O-CE1 3.41Å; F263-Y385 HydrophobicContact CB-CD1 4.05Å; F263-Y385 HydrophobicContact CB-CG 4.06Å; F263-Y385 AromaticContact CD2-CD2 3.85Å; F263-Y385 HydrophobicContact CD2-CD2 3.85Å; F263-Y385 HydrophobicContact CD2-CE2 4.35Å; F263-Y385 HydrophobicContact CD2-CG 4.1Å; N383-Y385 VanDerWaalsContact C-N 3.3Å; N383-Y385 PolarHBondContact O-N 3.03Å; N383-Y385 WeakPolarHBondContact OD1-CA 3.25Å; N383-Y385 VanDerWaalsContact OD1-CB 3.32Å; N383-Y385 WeakPolarHBondContact OD1-CB 3.33Å; N383-Y385 WeakPolarHBondContact OD1-CD2 2.98Å; N383-Y385 PolarHBondContact OD1-N 3.47Å; Y385-C388 PolarHBondContact O-N 3.42Å; Y385-F389 WeakPolarHBondContact O-CB 3.36Å; Y385-F389 PolarHBondContact O-N 3.31Å
386	L	93	Very high	89.6	Confident	96 Å²	96	32.2 Å²	32.2	50%	0.503	19%	0.189	S	C	.	.	H	α-helix	trans	-66.6	-44.3	178	-177.7	62.3	0	0	0	111.4	N383 C388 F389 L390	N383-L386 HydrophobicContact CB-CB 4.08Å; N383-L386 PolarHBondContact O-N 3.5Å; N383-L386 PolarHBondContact OD1-N 3.5Å; L386-C388 VanDerWaalsContact C-N 3.31Å; L386-C388 PolarHBondContact O-N 3.17Å; L386-F389 PolarHBondContact O-N 3.44Å; L386-L390 HydrophobicContact CD1-CD1 4.38Å; L386-L390 HydrophobicContact CD1-CG 4.35Å; L386-L390 HydrophobicContact CG-CD1 4.07Å; L386-L390 HydrophobicContact CG-CG 4.47Å; L386-L390 WeakPolarHBondContact O-CG 3.41Å; L386-L390 PolarHBondContact O-N 2.84Å
387	N	92.9	Very high	89.7	Confident	6 Å²	6	34.6 Å²	34.6	3%	0.032	21%	0.205	C	C	.	.	H	α-helix	trans	-59.2	-45.1	177.6	-68.5	-12	0	0	0	110.6	T377 L380 H381 N383 F389 L390 S391 M445	T377-N387 HydrophobicContact CG2-CB 3.85Å; T377-N387 WeakPolarHBondContact CG2-O 3.43Å; L380-N387 VanDerWaalsContact CB-ND2 3.32Å; L380-N387 WeakPolarHBondContact CB-ND2 3.22Å; L380-N387 HydrophobicContact CD1-CB 4.3Å; H381-N387 PolarHBondContact O-ND2 3.33Å; N383-N387 VanDerWaalsContact O-CG 3.27Å; N383-N387 PolarHBondContact O-N 3.13Å; N387-F389 PolarHBondContact O-N 3.49Å; N387-L390 PolarHBondContact O-N 3.38Å; N387-S391 VanDerWaalsContact O-CB 3.28Å; N387-S391 WeakPolarHBondContact O-CB 3.1Å; N387-S391 PolarHBondContact O-N 3.15Å; N387-M445 WeakPolarHBondContact O-CE 3.35Å
388	C	93	Very high	89.9	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-63.2	-40.6	176.4	-170.6	0	0	0	0	112.5	F53 P259 T377 P384 Y385 L386 S391 A392	F53-C388 HydrophobicContact CE2-CB 4.28Å; F53-C388 HydrophobicContact CZ-CB 3.69Å; P259-C388 HydrophobicContact CB-CB 3.92Å; P259-C388 HydrophobicContact CG-CB 4.34Å; T377-C388 VanDerWaalsContact CG2-CA 3.49Å; T377-C388 HydrophobicContact CG2-CB 4.29Å; P384-C388 VanDerWaalsContact O-CB 3.25Å; P384-C388 WeakPolarHBondContact O-CB 3.25Å; P384-C388 PolarHBondContact O-N 3.42Å; Y385-C388 PolarHBondContact O-N 3.42Å; L386-C388 VanDerWaalsContact C-N 3.31Å; L386-C388 PolarHBondContact O-N 3.17Å; C388-S391 WeakPolarHBondContact O-CB 3.27Å; C388-S391 PolarHBondContact O-N 2.9Å; C388-A392 PolarHBondContact O-N 2.94Å
389	F	94.5	Very high	90.3	Very high	80 Å²	80	34.2 Å²	34.2	35%	0.351	20%	0.2	S	C	.	.	H	α-helix	trans	-63.7	-44.9	175.9	-179.6	-94.2	0	0	0	112	M256 P259 V260 Y385 L386 N387 S391 A392 A393	M256-F389 HydrophobicContact CB-CD2 4.32Å; M256-F389 HydrophobicContact CB-CE2 4.04Å; M256-F389 HydrophobicContact CG-CE2 4.34Å; P259-F389 HydrophobicContact CB-CB 4.47Å; P259-F389 HydrophobicContact CG-CB 3.89Å; P259-F389 HydrophobicContact CG-CD2 4.33Å; V260-F389 HydrophobicContact CG2-CD2 4.04Å; V260-F389 HydrophobicContact CG2-CE2 4.26Å; Y385-F389 WeakPolarHBondContact O-CB 3.36Å; Y385-F389 PolarHBondContact O-N 3.31Å; L386-F389 PolarHBondContact O-N 3.44Å; N387-F389 PolarHBondContact O-N 3.49Å; F389-S391 VanDerWaalsContact C-N 3.34Å; F389-S391 PolarHBondContact O-N 2.94Å; F389-A392 PolarHBondContact O-N 3.49Å; F389-A393 WeakPolarHBondContact O-CB 3.45Å; F389-A393 PolarHBondContact O-N 2.88Å
390	L	93.8	Very high	90.5	Very high	66 Å²	66	33.7 Å²	33.7	35%	0.346	20%	0.196	S	C	.	.	H	α-helix	trans	-63.1	-42.4	176.6	-68.2	168.9	0	0	0	111.2	L386 N387 A392 A393 T394 V441 M445	L386-L390 HydrophobicContact CD1-CD1 4.38Å; L386-L390 HydrophobicContact CD1-CG 4.35Å; L386-L390 HydrophobicContact CG-CD1 4.07Å; L386-L390 HydrophobicContact CG-CG 4.47Å; L386-L390 WeakPolarHBondContact O-CG 3.41Å; L386-L390 PolarHBondContact O-N 2.84Å; N387-L390 PolarHBondContact O-N 3.38Å; L390-A392 VanDerWaalsContact C-N 3.33Å; L390-A392 PolarHBondContact O-N 3.47Å; L390-A393 PolarHBondContact O-N 2.9Å; L390-A393 VanDerWaalsContact O-N 3.16Å; L390-T394 WeakPolarHBondContact O-CG2 3.48Å; L390-T394 PolarHBondContact O-N 2.77Å; L390-V441 HydrophobicContact CD1-CG1 4.3Å; L390-M445 HydrophobicContact CB-CE 4Å; L390-M445 HydrophobicContact CB-CG 4.4Å; L390-M445 HydrophobicContact CB-SD 3.98Å
391	S	93.1	Very high	90.8	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.007	21%	0.211	C	C	.	.	H	α-helix	trans	-57.2	-44.4	175.1	-174.3	0	0	0	0	111.5	Y255 T377 N387 C388 F389 T394 M445 K448	Y255-S391 PolarHBondContact OH-OG 2.68Å; T377-S391 PolarHBondContact OG1-OG 2.89Å; N387-S391 VanDerWaalsContact O-CB 3.28Å; N387-S391 WeakPolarHBondContact O-CB 3.1Å; N387-S391 PolarHBondContact O-N 3.15Å; C388-S391 WeakPolarHBondContact O-CB 3.27Å; C388-S391 PolarHBondContact O-N 2.9Å; F389-S391 VanDerWaalsContact C-N 3.34Å; F389-S391 PolarHBondContact O-N 2.94Å; S391-T394 PolarHBondContact O-OG1 3.26Å; S391-M445 VanDerWaalsContact CA-SD 3.55Å; S391-M445 PolarHBondContact N-SD 3.47Å; S391-M445 VanDerWaalsContact N-SD 3.43Å; S391-K448 VanDerWaalsContact OG-CE 3.28Å; S391-K448 WeakPolarHBondContact OG-CE 3.3Å; S391-K448 PolarHBondContact OG-NZ 2.03Å
392	A	92.6	Very high	91.2	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-67.5	-42.8	173.7	0	0	0	0	0	112.9	Y255 M256 C388 F389 L390 T394 E395	Y255-A392 HydrophobicContact CD1-CB 3.4Å; Y255-A392 VanDerWaalsContact CD1-CB 3.4Å; Y255-A392 HydrophobicContact CD2-CB 3.75Å; Y255-A392 VanDerWaalsContact CE1-CA 3.49Å; Y255-A392 HydrophobicContact CE1-CB 3.64Å; Y255-A392 HydrophobicContact CE2-CB 3.96Å; Y255-A392 HydrophobicContact CG-CB 3.44Å; Y255-A392 VanDerWaalsContact CG-CB 3.44Å; M256-A392 HydrophobicContact CB-CB 4.34Å; M256-A392 HydrophobicContact CG-CB 3.58Å; C388-A392 PolarHBondContact O-N 2.94Å; F389-A392 PolarHBondContact O-N 3.49Å; L390-A392 VanDerWaalsContact C-N 3.33Å; L390-A392 PolarHBondContact O-N 3.47Å; A392-T394 VanDerWaalsContact C-N 3.28Å; A392-T394 PolarHBondContact O-N 3.37Å; A392-E395 WeakPolarHBondContact O-CB 3.37Å; A392-E395 PolarHBondContact O-N 3.36Å
393	A	93.8	Very high	91.2	Very high	30 Å²	30	34.6 Å²	34.6	25%	0.248	19%	0.187	C	C	.	.	H	α-helix	trans	-64.5	-31.8	-179.5	0	0	0	0	0	112.5	M256 F389 L390 E395 V396 P397	M256-A393 HydrophobicContact SD-CB 4.15Å; F389-A393 WeakPolarHBondContact O-CB 3.45Å; F389-A393 PolarHBondContact O-N 2.88Å; L390-A393 PolarHBondContact O-N 2.9Å; L390-A393 VanDerWaalsContact O-N 3.16Å; A393-E395 PolarHBondContact O-N 3.19Å; A393-V396 PolarHBondContact O-N 3.11Å; A393-P397 WeakPolarHBondContact O-CD 3.32Å
394	T	93.9	Very high	91.1	Very high	23 Å²	23	36 Å²	36	14%	0.141	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-20.2	177.3	65.2	0	0	0	0	114.1	L390 S391 A392 V396 P397 A398 M445	L390-T394 WeakPolarHBondContact O-CG2 3.48Å; L390-T394 PolarHBondContact O-N 2.77Å; S391-T394 PolarHBondContact O-OG1 3.26Å; A392-T394 VanDerWaalsContact C-N 3.28Å; A392-T394 PolarHBondContact O-N 3.37Å; T394-V396 VanDerWaalsContact C-N 3.35Å; T394-P397 WeakPolarHBondContact O-CD 3.3Å; T394-P397 WeakPolarHBondContact O-CG 3.2Å; T394-A398 WeakPolarHBondContact O-CB 3.24Å; T394-A398 PolarHBondContact O-N 2.82Å; T394-M445 HydrophobicContact CG2-CB 3.87Å; T394-M445 HydrophobicContact CG2-CG 4.19Å; T394-M445 HydrophobicContact CG2-SD 3.98Å
395	E	90.5	Very high	90.9	Very high	1 Å²	1	38.3 Å²	38.3	1%	0.005	21%	0.205	C	C	.	.	H	α-helix	trans	-67	-38.7	177.8	-60.4	-160.8	170.9	0	0	111.8	Y370 A392 A393 A398 Y399 T452	Y370-E395 PolarHBondContact OH-OE1 2.96Å; A392-E395 WeakPolarHBondContact O-CB 3.37Å; A392-E395 PolarHBondContact O-N 3.36Å; A393-E395 PolarHBondContact O-N 3.19Å; E395-A398 WeakPolarHBondContact O-CB 3.47Å; E395-A398 PolarHBondContact O-N 3.17Å; E395-Y399 HydrophobicContact CB-CD2 4.14Å; E395-Y399 HydrophobicContact CB-CE2 3.49Å; E395-Y399 VanDerWaalsContact CB-CE2 3.49Å; E395-Y399 WeakPolarHBondContact O-CD2 3.42Å; E395-Y399 VanDerWaalsContact O-CG 3.23Å; E395-Y399 PolarHBondContact O-N 3.22Å; E395-Y399 PolarHBondContact OE2-OH 2.64Å; E395-T452 HydrophobicContact CB-CG2 4.34Å; E395-T452 HydrophobicContact CG-CG2 4.21Å
396	V	91.2	Very high	90.4	Very high	38 Å²	38	38.9 Å²	38.9	23%	0.23	21%	0.209	C	C	.	.	H	α-helix	trans	-57	-55.8	-177.7	177.2	0	0	0	0	112.8	M249 A252 M256 A393 T394 A398 Y399 I400	M249-V396 HydrophobicContact CE-CB 4.21Å; M249-V396 HydrophobicContact CE-CG1 4.1Å; M249-V396 HydrophobicContact CE-CG2 4.1Å; M249-V396 HydrophobicContact SD-CB 4.48Å; M249-V396 HydrophobicContact SD-CG1 3.88Å; M249-V396 HydrophobicContact SD-CG2 4.21Å; A252-V396 HydrophobicContact CB-CG2 4.16Å; M256-V396 HydrophobicContact CE-CG2 4Å; A393-V396 PolarHBondContact O-N 3.11Å; T394-V396 VanDerWaalsContact C-N 3.35Å; V396-A398 VanDerWaalsContact C-N 3.3Å; V396-A398 PolarHBondContact O-N 3.33Å; V396-Y399 PolarHBondContact O-N 2.88Å; V396-I400 HydrophobicContact CG1-CD1 4.14Å; V396-I400 WeakPolarHBondContact O-CG1 3.45Å; V396-I400 PolarHBondContact O-N 2.99Å
397	P	92.2	Very high	89.9	Confident	56 Å²	56	43.3 Å²	43.3	36%	0.364	22%	0.219	S	C	.	.	H	α-helix	trans	-65.8	-31.9	176.3	26.4	-33.6	0	0	0	112.3	A393 T394 I400 I401	A393-P397 WeakPolarHBondContact O-CD 3.32Å; T394-P397 WeakPolarHBondContact O-CD 3.3Å; T394-P397 WeakPolarHBondContact O-CG 3.2Å; P397-I400 PolarHBondContact O-N 2.99Å; P397-I401 WeakPolarHBondContact O-CB 3.48Å; P397-I401 VanDerWaalsContact O-CG1 3.3Å; P397-I401 WeakPolarHBondContact O-CG1 3.41Å; P397-I401 PolarHBondContact O-N 3.48Å
398	A	91.3	Very high	89.5	Confident	0 Å²	0	50 Å²	50	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-59.7	-48.2	175.5	0	0	0	0	0	111.3	T394 E395 V396 I400 I401 V402 F449 T452	T394-A398 WeakPolarHBondContact O-CB 3.24Å; T394-A398 PolarHBondContact O-N 2.82Å; E395-A398 WeakPolarHBondContact O-CB 3.47Å; E395-A398 PolarHBondContact O-N 3.17Å; V396-A398 VanDerWaalsContact C-N 3.3Å; V396-A398 PolarHBondContact O-N 3.33Å; A398-I400 PolarHBondContact O-N 3.1Å; A398-I401 PolarHBondContact O-N 3.03Å; A398-V402 WeakPolarHBondContact O-CB 3.2Å; A398-V402 WeakPolarHBondContact O-CG2 3.48Å; A398-V402 PolarHBondContact O-N 3.48Å; A398-F449 HydrophobicContact CB-CD2 3.64Å; A398-F449 HydrophobicContact CB-CE2 3.81Å; A398-F449 HydrophobicContact CB-CG 4.41Å; A398-T452 HydrophobicContact CB-CG2 4.01Å
399	Y	87.4	Confident	89.2	Confident	13 Å²	13	52 Å²	52	5%	0.051	26%	0.262	C	S	.	.	H	α-helix	trans	-60.2	-46.8	177.4	-61.2	-43.9	0	0	0	112.1	F248 M249 A252 E395 V396 V402 L403 T452 C456	F248-Y399 HydrophobicContact CB-CD1 4.28Å; F248-Y399 HydrophobicContact CB-CD2 3.93Å; F248-Y399 HydrophobicContact CB-CE1 4.15Å; F248-Y399 HydrophobicContact CB-CE2 3.75Å; F248-Y399 HydrophobicContact CB-CG 4.18Å; F248-Y399 AromaticContact CD1-CE1 3.95Å; F248-Y399 HydrophobicContact CD1-CE1 3.95Å; F248-Y399 AromaticContact CD1-CZ 3.98Å; F248-Y399 HydrophobicContact CG-CD1 4.41Å; F248-Y399 HydrophobicContact CG-CE1 4.17Å; M249-Y399 HydrophobicContact CE-CD2 3.29Å; M249-Y399 HydrophobicContact CE-CE2 4.19Å; M249-Y399 HydrophobicContact CE-CG 4.03Å; A252-Y399 HydrophobicContact CB-CE2 4.42Å; E395-Y399 HydrophobicContact CB-CD2 4.14Å; E395-Y399 HydrophobicContact CB-CE2 3.49Å; E395-Y399 VanDerWaalsContact CB-CE2 3.49Å; E395-Y399 WeakPolarHBondContact O-CD2 3.42Å; E395-Y399 VanDerWaalsContact O-CG 3.23Å; E395-Y399 PolarHBondContact O-N 3.22Å; E395-Y399 PolarHBondContact OE2-OH 2.64Å; V396-Y399 PolarHBondContact O-N 2.88Å; Y399-V402 PolarHBondContact O-N 2.92Å; Y399-L403 VanDerWaalsContact O-CG 3.25Å; Y399-L403 WeakPolarHBondContact O-CG 3.21Å; Y399-L403 PolarHBondContact O-N 3.42Å; Y399-T452 HydrophobicContact CE1-CG2 3.85Å; Y399-C456 WeakPolarHBondContact CD1-SG 3.42Å; Y399-C456 WeakPolarHBondContact CE1-SG 3.39Å
400	I	88.4	Confident	88.9	Confident	81 Å²	81	49.7 Å²	49.7	42%	0.415	26%	0.256	S	S	.	.	H	α-helix	trans	-63.8	-47.3	-179.3	-65	166.5	0	0	0	111.1	V396 P397 A398 L403 L404	V396-I400 HydrophobicContact CG1-CD1 4.14Å; V396-I400 WeakPolarHBondContact O-CG1 3.45Å; V396-I400 PolarHBondContact O-N 2.99Å; P397-I400 PolarHBondContact O-N 2.99Å; A398-I400 PolarHBondContact O-N 3.1Å; I400-L403 PolarHBondContact O-N 3.35Å; I400-L404 WeakPolarHBondContact O-CG 3.45Å; I400-L404 PolarHBondContact O-N 3.44Å
401	I	89.5	Confident	88.6	Confident	70 Å²	70	47.8 Å²	47.8	36%	0.359	24%	0.244	S	C	.	.	H	α-helix	trans	-64.9	-42.8	-178.6	-71	169.4	0	0	0	110.4	P397 A398 L403 L404 L405 F449	P397-I401 WeakPolarHBondContact O-CB 3.48Å; P397-I401 VanDerWaalsContact O-CG1 3.3Å; P397-I401 WeakPolarHBondContact O-CG1 3.41Å; P397-I401 PolarHBondContact O-N 3.48Å; A398-I401 PolarHBondContact O-N 3.03Å; I401-L403 VanDerWaalsContact C-N 3.34Å; I401-L403 PolarHBondContact O-N 2.84Å; I401-L404 PolarHBondContact O-N 3Å; I401-L404 VanDerWaalsContact O-N 3.17Å; I401-L405 HydrophobicContact CG2-CD1 3.72Å; I401-L405 HydrophobicContact CG2-CG 4.06Å; I401-L405 WeakPolarHBondContact O-CG 3.47Å; I401-L405 PolarHBondContact O-N 3.49Å; I401-F449 HydrophobicContact CB-CZ 4.27Å; I401-F449 HydrophobicContact CD1-CE2 3.83Å; I401-F449 HydrophobicContact CD1-CZ 3.7Å; I401-F449 HydrophobicContact CG2-CZ 4.23Å
402	V	86.8	Confident	88.4	Confident	2 Å²	2	50 Å²	50	1%	0.012	25%	0.252	C	S	.	.	H	α-helix	trans	-61.7	-41.5	176.2	167.4	0	0	0	0	111.7	A398 Y399 L404 L405 L406 S453 C456 V457	A398-V402 WeakPolarHBondContact O-CB 3.2Å; A398-V402 WeakPolarHBondContact O-CG2 3.48Å; A398-V402 PolarHBondContact O-N 3.48Å; Y399-V402 PolarHBondContact O-N 2.92Å; V402-L404 PolarHBondContact O-N 3.4Å; V402-L405 PolarHBondContact O-N 3.29Å; V402-L406 HydrophobicContact CG1-CD1 3.63Å; V402-L406 HydrophobicContact CG1-CG 3.84Å; V402-L406 WeakPolarHBondContact O-CB 3.43Å; V402-L406 WeakPolarHBondContact O-CG 3.42Å; V402-L406 PolarHBondContact O-N 3.25Å; V402-S453 VanDerWaalsContact CG2-CB 3.42Å; V402-C456 HydrophobicContact CB-CB 4.4Å; V402-C456 HydrophobicContact CG1-CB 3.77Å; V402-V457 HydrophobicContact CG1-CG2 3.61Å; V402-V457 HydrophobicContact CG2-CG2 4.17Å
403	L	84.9	Confident	88.3	Confident	64 Å²	64	54.1 Å²	54.1	34%	0.335	27%	0.274	S	S	.	.	H	α-helix	trans	-59.3	-37.2	176.6	-70.1	170.8	0	0	0	112.3	L245 Y399 I400 I401	L245-L403 HydrophobicContact CB-CD1 4.32Å; L245-L403 HydrophobicContact CD1-CD1 4.15Å; Y399-L403 VanDerWaalsContact O-CG 3.25Å; Y399-L403 WeakPolarHBondContact O-CG 3.21Å; Y399-L403 PolarHBondContact O-N 3.42Å; I400-L403 PolarHBondContact O-N 3.35Å; I401-L403 VanDerWaalsContact C-N 3.34Å; I401-L403 PolarHBondContact O-N 2.84Å
404	L	86.4	Confident	88.2	Confident	102 Å²	102	53.2 Å²	53.2	53%	0.534	27%	0.265	S	S	.	.	H	α-helix	trans	-71.2	-46.8	174.6	-64.4	173.9	0	0	0	111.7	I400 I401 V402 L406 R407 F408	I400-L404 WeakPolarHBondContact O-CG 3.45Å; I400-L404 PolarHBondContact O-N 3.44Å; I401-L404 PolarHBondContact O-N 3Å; I401-L404 VanDerWaalsContact O-N 3.17Å; V402-L404 PolarHBondContact O-N 3.4Å; L404-L406 VanDerWaalsContact C-N 3.28Å; L404-L406 PolarHBondContact O-N 3.44Å; L404-R407 WeakPolarHBondContact O-CB 3.31Å; L404-R407 PolarHBondContact O-N 3.25Å; L404-F408 WeakPolarHBondContact O-CD2 3.38Å
405	L	85.9	Confident	88.2	Confident	62 Å²	62	52.1 Å²	52.1	33%	0.325	26%	0.259	S	S	.	.	H	α-helix	trans	-60.5	-39	177.9	-72	174.4	0	0	0	111.6	I401 V402 R407 F408 S409	I401-L405 HydrophobicContact CG2-CD1 3.72Å; I401-L405 HydrophobicContact CG2-CG 4.06Å; I401-L405 WeakPolarHBondContact O-CG 3.47Å; I401-L405 PolarHBondContact O-N 3.49Å; V402-L405 PolarHBondContact O-N 3.29Å; L405-R407 PolarHBondContact O-N 3.42Å; L405-R407 VanDerWaalsContact O-N 3.17Å; L405-F408 PolarHBondContact O-N 3.13Å; L405-S409 WeakPolarHBondContact O-CA 3.31Å; L405-S409 VanDerWaalsContact O-CB 3.3Å; L405-S409 WeakPolarHBondContact O-CB 3.25Å; L405-S409 PolarHBondContact O-N 2.87Å
406	L	83.6	Confident	88.4	Confident	25 Å²	25	52.2 Å²	52.2	13%	0.131	26%	0.259	C	S	.	.	H	α-helix	trans	-63.8	-20.6	176.1	-70.9	174.6	0	0	0	111.9	V402 L404 R411 V457 A460	V402-L406 HydrophobicContact CG1-CD1 3.63Å; V402-L406 HydrophobicContact CG1-CG 3.84Å; V402-L406 WeakPolarHBondContact O-CB 3.43Å; V402-L406 WeakPolarHBondContact O-CG 3.42Å; V402-L406 PolarHBondContact O-N 3.25Å; L404-L406 VanDerWaalsContact C-N 3.28Å; L404-L406 PolarHBondContact O-N 3.44Å; L406-R411 VanDerWaalsContact CD2-CD 3.48Å; L406-R411 VanDerWaalsContact CD2-CZ 3.46Å; L406-R411 PolarHBondContact O-NH1 3.42Å; L406-R411 PolarHBondContact O-NH2 3.35Å; L406-V457 HydrophobicContact CD2-CB 4.43Å; L406-V457 HydrophobicContact CD2-CG1 4.16Å; L406-V457 HydrophobicContact CD2-CG2 4.09Å; L406-A460 HydrophobicContact CD1-CB 4.11Å; L406-A460 HydrophobicContact CD2-CB 4.27Å
407	R	83.2	Confident	88.6	Confident	190 Å²	190	53.1 Å²	53.1	72%	0.717	27%	0.271	S	S	*	.	H	α-helix	trans	-81.2	-29.6	176.8	-169.4	171.9	-179.7	-179	-0.9	113.6	L404 L405	L404-R407 WeakPolarHBondContact O-CB 3.31Å; L404-R407 PolarHBondContact O-N 3.25Å; L405-R407 PolarHBondContact O-N 3.42Å; L405-R407 VanDerWaalsContact O-N 3.17Å
408	F	83.5	Confident	88.7	Confident	146 Å²	146	51 Å²	51	64%	0.64	26%	0.258	S	S	*	.	H	α-helix	trans	-121.1	-19.4	-167.2	-58.2	-68.2	0	0	0	114.5	L404 L405	L404-F408 WeakPolarHBondContact O-CD2 3.38Å; L405-F408 PolarHBondContact O-N 3.13Å
409	S	86.4	Confident	88.9	Confident	41 Å²	41	51 Å²	51	29%	0.287	26%	0.258	S	S	.	.	S	Bend	trans	-112.2	147.8	-172	-58.7	0	0	0	0	112.5	L405 R411 H525	L405-S409 WeakPolarHBondContact O-CA 3.31Å; L405-S409 VanDerWaalsContact O-CB 3.3Å; L405-S409 WeakPolarHBondContact O-CB 3.25Å; L405-S409 PolarHBondContact O-N 2.87Å; S409-R411 PolarHBondContact O-N 3.38Å; S409-R411 PolarHBondContact O-NH1 2.98Å; S409-H525 PolarHBondContact O-CD2 2.87Å
410	S	87.8	Confident	89.4	Confident	32 Å²	32	53 Å²	53	22%	0.224	27%	0.269	C	S	.	.			trans	-56.1	130.5	170.9	58.2	0	0	0	0	111.2	R412 L413 C414 E523	S410-R412 VanDerWaalsContact C-N 3.34Å; S410-R412 PolarHBondContact O-N 2.98Å; S410-L413 PolarHBondContact O-N 3.2Å; S410-L413 VanDerWaalsContact OG-CB 3.24Å; S410-L413 WeakPolarHBondContact OG-CB 3.2Å; S410-L413 VanDerWaalsContact OG-CD1 3.27Å; S410-L413 WeakPolarHBondContact OG-CD1 3.37Å; S410-L413 VanDerWaalsContact OG-CG 3.23Å; S410-L413 WeakPolarHBondContact OG-CG 3.43Å; S410-C414 WeakPolarHBondContact O-CB 3.36Å; S410-C414 PolarHBondContact O-N 3.44Å; S410-E523 VanDerWaalsContact CB-OE2 3.32Å; S410-E523 WeakPolarHBondContact CB-OE2 3.08Å
411	R	87.6	Confident	89.7	Confident	26 Å²	26	52.5 Å²	52.5	10%	0.098	27%	0.267	C	S	.	.	H	α-helix	trans	-63.1	-42.5	-172.3	-67.2	-80.4	-179.5	-88.9	6.3	111.7	L406 S409 C414 Q415 F461 E464 E523 T524 H525	L406-R411 VanDerWaalsContact CD2-CD 3.48Å; L406-R411 VanDerWaalsContact CD2-CZ 3.46Å; L406-R411 PolarHBondContact O-NH1 3.42Å; L406-R411 PolarHBondContact O-NH2 3.35Å; S409-R411 PolarHBondContact O-N 3.38Å; S409-R411 PolarHBondContact O-NH1 2.98Å; R411-C414 PolarHBondContact O-N 3.21Å; R411-Q415 WeakPolarHBondContact O-CB 3.15Å; R411-Q415 PolarHBondContact O-N 3.18Å; R411-F461 HydrophobicContact CB-CD2 3.69Å; R411-F461 HydrophobicContact CB-CE2 4.12Å; R411-F461 HydrophobicContact CB-CG 4.33Å; R411-F461 HydrophobicContact CG-CD2 4.48Å; R411-E464 WeakPolarHBondContact CG-OE2 3.23Å; R411-E464 IonicContact CZ-OE1 2.71Å; R411-E464 IonicContact NE-OE1 3.17Å; R411-E464 PolarHBondContact NE-OE1 2.92Å; R411-E464 IonicContact NE-OE2 3.89Å; R411-E464 PolarHBondContact NE-OE2 3.45Å; R411-E464 IonicContact NH2-OE1 3.86Å; R411-E464 PolarHBondContact NH2-OE1 3.05Å; R411-E523 PolarHBondContact N-OE1 3.24Å; R411-T524 WeakPolarHBondContact CG-OG1 3.3Å; R411-H525 HydrophobicContact CG-CB 4.36Å
412	R	90.3	Very high	90	Very high	48 Å²	48	49.2 Å²	49.2	18%	0.181	25%	0.25	C	C	.	.	H	α-helix	trans	-63.4	-47	-179.1	-174.2	179.2	60.9	178.1	-4	112.1	S410 Q415 S416 F461 C518 L521 E523	S410-R412 VanDerWaalsContact C-N 3.34Å; S410-R412 PolarHBondContact O-N 2.98Å; R412-Q415 PolarHBondContact O-N 3.18Å; R412-S416 VanDerWaalsContact O-CB 3.3Å; R412-S416 WeakPolarHBondContact O-CB 3.1Å; R412-S416 PolarHBondContact O-N 3.37Å; R412-F461 HydrophobicContact CB-CZ 4.49Å; R412-C518 WeakPolarHBondContact CD-O 3.17Å; R412-C518 WeakPolarHBondContact CG-O 3.32Å; R412-L521 WeakPolarHBondContact CD-O 3.19Å; R412-E523 WeakPolarHBondContact CB-OE2 3.11Å; R412-E523 PolarHBondContact N-OE2 3.2Å; R412-E523 IonicContact NE-OE2 2.73Å
413	L	90.1	Very high	90.4	Very high	87 Å²	87	49.1 Å²	49.1	46%	0.455	25%	0.249	S	C	.	.	H	α-helix	trans	-68.7	-37.9	178.4	-58.4	-177.9	0	0	0	110.9	S410 Q415 S416 A417 F519	S410-L413 PolarHBondContact O-N 3.2Å; S410-L413 VanDerWaalsContact OG-CB 3.24Å; S410-L413 WeakPolarHBondContact OG-CB 3.2Å; S410-L413 VanDerWaalsContact OG-CD1 3.27Å; S410-L413 WeakPolarHBondContact OG-CD1 3.37Å; S410-L413 VanDerWaalsContact OG-CG 3.23Å; S410-L413 WeakPolarHBondContact OG-CG 3.43Å; L413-Q415 PolarHBondContact O-N 3.27Å; L413-S416 PolarHBondContact O-N 3.18Å; L413-A417 WeakPolarHBondContact O-CB 3.49Å; L413-A417 PolarHBondContact O-N 3.24Å; L413-F519 HydrophobicContact CD2-CE1 4.23Å
414	C	92.4	Very high	90.9	Very high	10 Å²	10	49.9 Å²	49.9	7%	0.068	25%	0.253	C	S	.	.	H	α-helix	trans	-61.1	-45.8	176.5	-165	0	0	0	0	111.3	S410 R411 S418 V457	S410-C414 WeakPolarHBondContact O-CB 3.36Å; S410-C414 PolarHBondContact O-N 3.44Å; R411-C414 PolarHBondContact O-N 3.21Å; C414-S418 VanDerWaalsContact O-CB 3.29Å; C414-S418 WeakPolarHBondContact O-CB 3.46Å; C414-S418 PolarHBondContact O-N 3.18Å; C414-S418 PolarHBondContact O-OG 3.46Å; C414-V457 HydrophobicContact CB-CG1 4.28Å; C414-V457 HydrophobicContact CB-CG2 4.45Å
415	Q	93.8	Very high	91.4	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-62.1	-49.3	176.7	-173.2	66	20	0	0	111.4	R411 R412 L413 S418 L419 A454 V457 L458 C518	R411-Q415 WeakPolarHBondContact O-CB 3.15Å; R411-Q415 PolarHBondContact O-N 3.18Å; R412-Q415 PolarHBondContact O-N 3.18Å; L413-Q415 PolarHBondContact O-N 3.27Å; Q415-S418 PolarHBondContact O-N 3.47Å; Q415-L419 HydrophobicContact CG-CD1 4.36Å; Q415-L419 WeakPolarHBondContact O-CG 3.32Å; Q415-L419 PolarHBondContact O-N 3.11Å; Q415-L419 VanDerWaalsContact O-N 3.1Å; Q415-A454 PolarHBondContact NE2-O 2.91Å; Q415-A454 PolarHBondContact OE1-O 3.49Å; Q415-V457 HydrophobicContact CB-CG1 3.94Å; Q415-L458 VanDerWaalsContact OE1-N 3.15Å; Q415-C518 WeakPolarHBondContact CG-SG 3.27Å
416	S	94.5	Very high	91.7	Very high	3 Å²	3	44.3 Å²	44.3	2%	0.021	22%	0.223	C	C	.	.	H	α-helix	trans	-64.6	-46.2	-177.9	-175.8	0	0	0	0	112.2	R412 L413 S418 L419 L420 S515 F519	R412-S416 VanDerWaalsContact O-CB 3.3Å; R412-S416 WeakPolarHBondContact O-CB 3.1Å; R412-S416 PolarHBondContact O-N 3.37Å; L413-S416 PolarHBondContact O-N 3.18Å; S416-S418 PolarHBondContact O-N 3.4Å; S416-L419 PolarHBondContact O-N 2.96Å; S416-L420 WeakPolarHBondContact O-CG 3.48Å; S416-L420 PolarHBondContact O-N 3.49Å; S416-S515 PolarHBondContact O-OG 3.47Å; S416-S515 PolarHBondContact OG-O 3.43Å; S416-S515 PolarHBondContact OG-OG 3.29Å; S416-F519 VanDerWaalsContact OG-CE2 3.22Å; S416-F519 WeakPolarHBondContact OG-CE2 3.46Å; S416-F519 WeakPolarHBondContact OG-CZ 2.98Å
417	A	94.5	Very high	92.2	Very high	57 Å²	57	45.9 Å²	45.9	47%	0.471	23%	0.231	S	C	.	.	H	α-helix	trans	-64.4	-40.1	178.8	0	0	0	0	0	112.1	L413 L420 L421	L413-A417 WeakPolarHBondContact O-CB 3.49Å; L413-A417 PolarHBondContact O-N 3.24Å; A417-L420 PolarHBondContact O-N 3.17Å; A417-L421 VanDerWaalsContact O-CB 3.28Å; A417-L421 WeakPolarHBondContact O-CB 3.4Å; A417-L421 PolarHBondContact O-N 2.94Å
418	S	94.9	Very high	92.6	Very high	12 Å²	12	38.6 Å²	38.6	8%	0.084	21%	0.208	C	C	.	.	H	α-helix	trans	-65.4	-40.4	177.8	-56.9	0	0	0	0	111.7	C414 Q415 S416 G422 G450	C414-S418 VanDerWaalsContact O-CB 3.29Å; C414-S418 WeakPolarHBondContact O-CB 3.46Å; C414-S418 PolarHBondContact O-N 3.18Å; C414-S418 PolarHBondContact O-OG 3.46Å; Q415-S418 PolarHBondContact O-N 3.47Å; S416-S418 PolarHBondContact O-N 3.4Å; S418-G422 PolarHBondContact O-N 2.96Å; S418-G450 WeakPolarHBondContact CB-O 3.46Å; S418-G450 CarbonylContact O-C 3.45Å
419	L	95.8	Very high	92.8	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-68.7	-39.7	175.2	-75.1	175.5	0	0	0	113	L362 V366 Q415 S416 G423 I451 A454	L362-L419 HydrophobicContact CD2-CD1 4.26Å; V366-L419 HydrophobicContact CG2-CD2 3.82Å; Q415-L419 HydrophobicContact CG-CD1 4.36Å; Q415-L419 WeakPolarHBondContact O-CG 3.32Å; Q415-L419 PolarHBondContact O-N 3.11Å; Q415-L419 VanDerWaalsContact O-N 3.1Å; S416-L419 PolarHBondContact O-N 2.96Å; L419-G423 PolarHBondContact O-N 3.2Å; L419-I451 HydrophobicContact CD2-CD1 4.13Å; L419-A454 HydrophobicContact CD2-CB 3.63Å; L419-A454 HydrophobicContact CG-CB 3.78Å
420	L	96.5	Very high	92.6	Very high	56 Å²	56	33.3 Å²	33.3	29%	0.293	18%	0.184	S	C	.	.	H	α-helix	trans	-64.8	-47.4	174.7	-75	168.8	0	0	0	111.4	S416 A417 G422 G423 I424 V512 S515	S416-L420 WeakPolarHBondContact O-CG 3.48Å; S416-L420 PolarHBondContact O-N 3.49Å; A417-L420 PolarHBondContact O-N 3.17Å; L420-G422 VanDerWaalsContact C-N 3.34Å; L420-G422 PolarHBondContact O-N 2.84Å; L420-G423 PolarHBondContact O-N 3.29Å; L420-I424 HydrophobicContact CB-CD1 4.41Å; L420-I424 VanDerWaalsContact O-CB 3.31Å; L420-I424 WeakPolarHBondContact O-CB 3.4Å; L420-I424 WeakPolarHBondContact O-CG1 3.5Å; L420-I424 PolarHBondContact O-N 3.5Å; L420-V512 HydrophobicContact CD2-CG1 4.14Å; L420-V512 HydrophobicContact CD2-CG2 4.35Å; L420-S515 WeakPolarHBondContact CD1-OG 3.37Å; L420-S515 WeakPolarHBondContact CG-OG 3.36Å
421	L	95.8	Very high	92.4	Very high	70 Å²	70	38.2 Å²	38.2	37%	0.366	21%	0.207	S	C	.	.	H	α-helix	trans	-57.4	-50.3	175.9	179.1	65.2	0	0	0	110.2	A417 M425 V446 F449	A417-L421 VanDerWaalsContact O-CB 3.28Å; A417-L421 WeakPolarHBondContact O-CB 3.4Å; A417-L421 PolarHBondContact O-N 2.94Å; L421-M425 HydrophobicContact CD1-CG 3.98Å; L421-M425 WeakPolarHBondContact O-CB 3.38Å; L421-M425 WeakPolarHBondContact O-CG 3.33Å; L421-M425 PolarHBondContact O-N 2.71Å; L421-M425 VanDerWaalsContact O-N 3.12Å; L421-V446 HydrophobicContact CD1-CG1 4.2Å; L421-V446 HydrophobicContact CG-CG1 4.43Å; L421-F449 HydrophobicContact CD2-CD1 4.44Å
422	G	95.2	Very high	92.3	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-55.3	-56.1	176.5	0	0	0	0	0	112.2	S418 L420 I426	S418-G422 PolarHBondContact O-N 2.96Å; L420-G422 VanDerWaalsContact C-N 3.34Å; L420-G422 PolarHBondContact O-N 2.84Å; G422-I426 WeakPolarHBondContact O-CB 3.25Å; G422-I426 VanDerWaalsContact O-CD1 3.23Å; G422-I426 WeakPolarHBondContact O-CD1 3.46Å; G422-I426 WeakPolarHBondContact O-CG1 3.2Å; G422-I426 PolarHBondContact O-N 2.73Å; G422-I426 VanDerWaalsContact O-N 3.09Å
423	G	95.4	Very high	91.6	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-64.6	-45	-174.9	0	0	0	0	0	114	L419 L420 I426 I427	L419-G423 PolarHBondContact O-N 3.2Å; L420-G423 PolarHBondContact O-N 3.29Å; G423-I426 PolarHBondContact O-N 3.34Å; G423-I427 VanDerWaalsContact O-CG1 3.31Å; G423-I427 WeakPolarHBondContact O-CG1 3.33Å; G423-I427 PolarHBondContact O-N 3.39Å
424	I	95.9	Very high	90.8	Very high	81 Å²	81	38.6 Å²	38.6	42%	0.415	22%	0.218	S	C	.	.	H	α-helix	trans	-65.2	-46.2	180	-65.2	168	0	0	0	110.2	L420 I426 I427 C428 V512	L420-I424 HydrophobicContact CB-CD1 4.41Å; L420-I424 VanDerWaalsContact O-CB 3.31Å; L420-I424 WeakPolarHBondContact O-CB 3.4Å; L420-I424 WeakPolarHBondContact O-CG1 3.5Å; L420-I424 PolarHBondContact O-N 3.5Å; I424-I426 VanDerWaalsContact C-N 3.33Å; I424-I426 PolarHBondContact O-N 3.47Å; I424-I427 PolarHBondContact O-N 3.01Å; I424-C428 PolarHBondContact O-N 2.99Å; I424-C428 PolarHBondContact O-SG 2.92Å; I424-V512 HydrophobicContact CG1-CG2 4.45Å
425	M	95.6	Very high	90.1	Very high	45 Å²	45	44.9 Å²	44.9	22%	0.222	25%	0.251	C	S	.	.	H	α-helix	trans	-62.1	-41.2	179.9	-65.7	-66.5	109.3	0	0	111.7	L421 C428 V429 L443 V446	L421-M425 HydrophobicContact CD1-CG 3.98Å; L421-M425 WeakPolarHBondContact O-CB 3.38Å; L421-M425 WeakPolarHBondContact O-CG 3.33Å; L421-M425 PolarHBondContact O-N 2.71Å; L421-M425 VanDerWaalsContact O-N 3.12Å; M425-C428 WeakPolarHBondContact O-CB 3.28Å; M425-C428 PolarHBondContact O-N 3.41Å; M425-V429 WeakPolarHBondContact O-CG2 3.07Å; M425-V429 PolarHBondContact O-N 2.99Å; M425-V429 VanDerWaalsContact O-N 3.15Å; M425-L443 HydrophobicContact SD-CD2 3.82Å; M425-V446 HydrophobicContact CG-CB 4.31Å; M425-V446 HydrophobicContact CG-CG1 3.81Å; M425-V446 HydrophobicContact SD-CG1 4.2Å
426	I	93.7	Very high	89.7	Confident	1 Å²	1	49.3 Å²	49.3	1%	0.005	27%	0.274	C	S	.	.	H	α-helix	trans	-62.7	-41.7	176.6	-67.1	163	0	0	0	111.5	L373 G422 G423 I424 C428 V429 I451 Y504 M507	L373-I426 HydrophobicContact CD1-CD1 3.78Å; L373-I426 HydrophobicContact CD2-CD1 3.97Å; L373-I426 HydrophobicContact CD2-CG1 4.11Å; L373-I426 HydrophobicContact CG-CD1 4.3Å; G422-I426 WeakPolarHBondContact O-CB 3.25Å; G422-I426 VanDerWaalsContact O-CD1 3.23Å; G422-I426 WeakPolarHBondContact O-CD1 3.46Å; G422-I426 WeakPolarHBondContact O-CG1 3.2Å; G422-I426 PolarHBondContact O-N 2.73Å; G422-I426 VanDerWaalsContact O-N 3.09Å; G423-I426 PolarHBondContact O-N 3.34Å; I424-I426 VanDerWaalsContact C-N 3.33Å; I424-I426 PolarHBondContact O-N 3.47Å; I426-C428 VanDerWaalsContact C-N 3.31Å; I426-C428 PolarHBondContact O-N 2.86Å; I426-V429 WeakPolarHBondContact O-CB 3.33Å; I426-V429 PolarHBondContact O-N 2.86Å; I426-I451 HydrophobicContact CD1-CG1 3.99Å; I426-Y504 HydrophobicContact CG2-CD1 4.05Å; I426-M507 HydrophobicContact CG2-CB 4.11Å; I426-M507 HydrophobicContact CG2-CE 4.39Å
427	I	93.8	Very high	89.2	Confident	58 Å²	58	51.6 Å²	51.6	30%	0.297	29%	0.289	S	S	.	.	H	α-helix	trans	-62.4	-42.5	175.3	-68.1	165.6	0	0	0	110.3	G423 I424 V429 N430	G423-I427 VanDerWaalsContact O-CG1 3.31Å; G423-I427 WeakPolarHBondContact O-CG1 3.33Å; G423-I427 PolarHBondContact O-N 3.39Å; I424-I427 PolarHBondContact O-N 3.01Å; I427-V429 PolarHBondContact O-N 3.35Å; I427-N430 PolarHBondContact O-N 3.22Å
428	C	91.8	Very high	88.9	Confident	37 Å²	37	52.5 Å²	52.5	25%	0.25	30%	0.297	C	S	.	.	H	α-helix	trans	-64.5	-23.2	179.5	-68.8	0	0	0	0	113.6	I424 M425 I426 N430 L431 L443	I424-C428 PolarHBondContact O-N 2.99Å; I424-C428 PolarHBondContact O-SG 2.92Å; M425-C428 WeakPolarHBondContact O-CB 3.28Å; M425-C428 PolarHBondContact O-N 3.41Å; I426-C428 VanDerWaalsContact C-N 3.31Å; I426-C428 PolarHBondContact O-N 2.86Å; C428-N430 PolarHBondContact O-N 3.41Å; C428-L431 WeakPolarHBondContact O-CB 3.12Å; C428-L431 PolarHBondContact O-N 3.43Å; C428-L443 HydrophobicContact CB-CD1 3.62Å
429	V	88.3	Confident	88.7	Confident	10 Å²	10	55 Å²	55	6%	0.061	31%	0.311	C	S	.	.	H	α-helix	trans	-54.6	-38.3	175.1	176.6	0	0	0	0	111.1	M425 I426 I427 L431 I432 L443 E444 Y504	M425-V429 WeakPolarHBondContact O-CG2 3.07Å; M425-V429 PolarHBondContact O-N 2.99Å; M425-V429 VanDerWaalsContact O-N 3.15Å; I426-V429 WeakPolarHBondContact O-CB 3.33Å; I426-V429 PolarHBondContact O-N 2.86Å; I427-V429 PolarHBondContact O-N 3.35Å; V429-L431 VanDerWaalsContact C-N 3.3Å; V429-L431 PolarHBondContact O-N 2.89Å; V429-I432 PolarHBondContact O-N 3.16Å; V429-L443 HydrophobicContact CG2-CB 3.77Å; V429-E444 HydrophobicContact CG2-CB 4.22Å; V429-Y504 HydrophobicContact CB-CD1 4.08Å; V429-Y504 HydrophobicContact CB-CE1 4.24Å; V429-Y504 HydrophobicContact CG1-CD1 4.08Å; V429-Y504 HydrophobicContact CG1-CE1 3.74Å
430	N	81.4	Confident	88.3	Confident	67 Å²	67	55.2 Å²	55.2	36%	0.358	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-22.7	-178.7	-170.8	-101.5	0	0	0	113.9	I427 C428 I432 A501	I427-N430 PolarHBondContact O-N 3.22Å; C428-N430 PolarHBondContact O-N 3.41Å; N430-I432 PolarHBondContact O-N 2.76Å; N430-A501 VanDerWaalsContact CG-CB 3.49Å; N430-A501 WeakPolarHBondContact ND2-CA 3.24Å; N430-A501 WeakPolarHBondContact ND2-CB 3.45Å
431	L	84.1	Confident	88.1	Confident	135 Å²	135	53.3 Å²	53.3	71%	0.707	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-10.7	-179.8	-59.7	175.5	0	0	0	112.6	C428 V429	C428-L431 WeakPolarHBondContact O-CB 3.12Å; C428-L431 PolarHBondContact O-N 3.43Å; V429-L431 VanDerWaalsContact C-N 3.3Å; V429-L431 PolarHBondContact O-N 2.89Å
432	I	84.1	Confident	87.9	Confident	33 Å²	33	55 Å²	55	17%	0.169	31%	0.312	C	S	.	.	S	Bend	trans	-89.6	128.8	-175.9	-62.1	175.6	0	0	0	110.1	V429 N430 L436 V439 L443	V429-I432 PolarHBondContact O-N 3.16Å; N430-I432 PolarHBondContact O-N 2.76Å; I432-L436 HydrophobicContact CG2-CB 4.05Å; I432-V439 HydrophobicContact CD1-CB 3.98Å; I432-V439 HydrophobicContact CD1-CG1 3.54Å; I432-V439 HydrophobicContact CG2-CB 4.38Å; I432-L443 HydrophobicContact CD1-CD1 3.32Å; I432-L443 HydrophobicContact CD1-CG 3.87Å; I432-L443 HydrophobicContact CG1-CD1 4.22Å
433	P	76.6	Confident	87.8	Confident	75 Å²	75	56.6 Å²	56.6	49%	0.487	32%	0.321	S	S	.	.			trans	-67	156.4	175.6	28.2	-34.5	0	0	0	112.5	D435 L436	P433-D435 PolarHBondContact O-N 3.26Å; P433-D435 VanDerWaalsContact O-N 3.09Å; P433-L436 PolarHBondContact O-N 3.35Å
434	I	72.6	Confident	87.7	Confident	61 Å²	61	56.6 Å²	56.6	31%	0.313	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-28.5	-176.3	-62.2	170	0	0	0	112.4	D85 V87 L436	D85-I434 HydrophobicContact CB-CD1 4.15Å; D85-I434 WeakPolarHBondContact O-CD1 3.39Å; V87-I434 HydrophobicContact CG2-CD1 4.47Å; I434-L436 PolarHBondContact O-N 3.33Å
435	D	77.2	Confident	87.6	Confident	141 Å²	141	53.5 Å²	53.5	75%	0.754	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-12.3	-176.1	-53.8	-43.4	0	0	0	114.1	P433 P437	P433-D435 PolarHBondContact O-N 3.26Å; P433-D435 VanDerWaalsContact O-N 3.09Å; D435-P437 VanDerWaalsContact O-CD 3.25Å; D435-P437 WeakPolarHBondContact O-CD 3.38Å
436	L	85.6	Confident	87.6	Confident	93 Å²	93	53.8 Å²	53.8	49%	0.487	31%	0.309	S	S	.	.			trans	-118.9	64	179.9	-64.4	174.2	0	0	0	112.1	I432 P433 I434 A438 V439 S440	I432-L436 HydrophobicContact CG2-CB 4.05Å; P433-L436 PolarHBondContact O-N 3.35Å; I434-L436 PolarHBondContact O-N 3.33Å; L436-A438 VanDerWaalsContact C-N 3.27Å; L436-A438 PolarHBondContact O-N 2.81Å; L436-V439 HydrophobicContact CB-CB 4.41Å; L436-V439 HydrophobicContact CB-CG2 4.08Å; L436-V439 PolarHBondContact O-N 3.39Å; L436-S440 PolarHBondContact O-N 3.44Å
437	P	83.9	Confident	87.7	Confident	52 Å²	52	53.7 Å²	53.7	34%	0.338	31%	0.308	S	S	.	.	H	α-helix	trans	-62.5	-34.7	-176.4	27	-35.3	0	0	0	112.1	H381 D435 V439 S440 V441	H381-P437 HydrophobicContact CB-CB 3.64Å; D435-P437 VanDerWaalsContact O-CD 3.25Å; D435-P437 WeakPolarHBondContact O-CD 3.38Å; P437-V439 VanDerWaalsContact C-N 3.3Å; P437-V439 PolarHBondContact O-N 2.8Å; P437-S440 WeakPolarHBondContact CA-OG 3.46Å; P437-S440 PolarHBondContact O-N 2.84Å; P437-S440 PolarHBondContact O-OG 3.48Å; P437-V441 VanDerWaalsContact O-CG2 3.27Å; P437-V441 WeakPolarHBondContact O-CG2 3.12Å; P437-V441 PolarHBondContact O-N 3.4Å
438	A	88.6	Confident	87.7	Confident	76 Å²	76	51 Å²	51	63%	0.628	29%	0.294	S	S	*	.	H	α-helix	trans	-60.8	-36.9	178.6	0	0	0	0	0	113.1	L436 L442	L436-A438 VanDerWaalsContact C-N 3.27Å; L436-A438 PolarHBondContact O-N 2.81Å; A438-L442 WeakPolarHBondContact O-CB 3.47Å; A438-L442 PolarHBondContact O-N 3.16Å
439	V	90.3	Very high	87.9	Confident	64 Å²	64	51.5 Å²	51.5	39%	0.388	29%	0.292	S	S	.	.	H	α-helix	trans	-75.2	-40.1	-178.6	-169.2	0	0	0	0	110.6	I432 L436 P437 L442 L443	I432-V439 HydrophobicContact CD1-CB 3.98Å; I432-V439 HydrophobicContact CD1-CG1 3.54Å; I432-V439 HydrophobicContact CG2-CB 4.38Å; L436-V439 HydrophobicContact CB-CB 4.41Å; L436-V439 HydrophobicContact CB-CG2 4.08Å; L436-V439 PolarHBondContact O-N 3.39Å; P437-V439 VanDerWaalsContact C-N 3.3Å; P437-V439 PolarHBondContact O-N 2.8Å; V439-L442 PolarHBondContact O-N 3.43Å; V439-L443 PolarHBondContact O-N 3.23Å
440	S	88.4	Confident	88.2	Confident	5 Å²	5	51 Å²	51	4%	0.035	29%	0.289	C	S	.	.	H	α-helix	trans	-63.7	-42.7	174.8	54.6	0	0	0	0	112.1	L436 P437 L443 E444	L436-S440 PolarHBondContact O-N 3.44Å; P437-S440 WeakPolarHBondContact CA-OG 3.46Å; P437-S440 PolarHBondContact O-N 2.84Å; P437-S440 PolarHBondContact O-OG 3.48Å; S440-L443 PolarHBondContact O-N 3.22Å; S440-E444 PolarHBondContact O-N 2.02Å
441	V	91.1	Very high	88.9	Confident	15 Å²	15	47.8 Å²	47.8	9%	0.091	27%	0.272	C	S	.	.	H	α-helix	trans	-59.9	-47.9	172.1	174	0	0	0	0	110.2	L380 L390 P437 L443 E444 M445	L380-V441 HydrophobicContact CD1-CG2 4.26Å; L390-V441 HydrophobicContact CD1-CG1 4.3Å; P437-V441 VanDerWaalsContact O-CG2 3.27Å; P437-V441 WeakPolarHBondContact O-CG2 3.12Å; P437-V441 PolarHBondContact O-N 3.4Å; V441-L443 PolarHBondContact O-N 3.48Å; V441-E444 PolarHBondContact O-N 3.08Å; V441-M445 HydrophobicContact CG1-CE 3.82Å; V441-M445 HydrophobicContact CG1-CG 4.2Å; V441-M445 VanDerWaalsContact O-CG 3.24Å; V441-M445 WeakPolarHBondContact O-CG 3.24Å; V441-M445 PolarHBondContact O-N 3.01Å
442	L	92.6	Very high	89.3	Confident	106 Å²	106	41.5 Å²	41.5	56%	0.555	24%	0.239	S	C	*	.	H	α-helix	trans	-57.6	-47.6	178.7	-179.9	66.6	0	0	0	112.1	A438 V439 E444 M445 V446	A438-L442 WeakPolarHBondContact O-CB 3.47Å; A438-L442 PolarHBondContact O-N 3.16Å; V439-L442 PolarHBondContact O-N 3.43Å; L442-E444 PolarHBondContact O-N 2.83Å; L442-M445 PolarHBondContact O-N 2.74Å; L442-V446 WeakPolarHBondContact O-CG2 3.16Å; L442-V446 PolarHBondContact O-N 3.36Å
443	L	93.1	Very high	89.8	Confident	33 Å²	33	40.1 Å²	40.1	17%	0.173	23%	0.233	C	C	.	.	H	α-helix	trans	-62.2	-41.6	177.3	-74.2	-165.4	0	0	0	112.2	M425 C428 V429 I432 V439 S440 V441 M445 V446 G447	M425-L443 HydrophobicContact SD-CD2 3.82Å; C428-L443 HydrophobicContact CB-CD1 3.62Å; V429-L443 HydrophobicContact CG2-CB 3.77Å; I432-L443 HydrophobicContact CD1-CD1 3.32Å; I432-L443 HydrophobicContact CD1-CG 3.87Å; I432-L443 HydrophobicContact CG1-CD1 4.22Å; V439-L443 PolarHBondContact O-N 3.23Å; S440-L443 PolarHBondContact O-N 3.22Å; V441-L443 PolarHBondContact O-N 3.48Å; L443-M445 VanDerWaalsContact C-N 3.32Å; L443-M445 PolarHBondContact O-N 2.9Å; L443-V446 PolarHBondContact O-N 3.45Å; L443-G447 PolarHBondContact O-N 2.92Å
444	E	92.4	Very high	90.6	Very high	1 Å²	1	36.5 Å²	36.5	1%	0.005	21%	0.209	C	C	.	.	H	α-helix	trans	-62.7	-40.7	175	-174.9	167.6	142	0	0	111.1	L373 N376 L380 V429 S440 V441 L442 G447 K448	L373-E444 HydrophobicContact CD2-CG 4.27Å; N376-E444 PolarHBondContact ND2-OE2 2.84Å; L380-E444 HydrophobicContact CD1-CB 4.18Å; L380-E444 HydrophobicContact CD1-CG 4.15Å; L380-E444 WeakPolarHBondContact CD1-OE1 3.28Å; L380-E444 WeakPolarHBondContact CD1-OE2 3.46Å; L380-E444 HydrophobicContact CD2-CB 4.35Å; L380-E444 WeakPolarHBondContact CD2-OE2 3.28Å; L380-E444 WeakPolarHBondContact CG-OE2 3.41Å; V429-E444 HydrophobicContact CG2-CB 4.22Å; S440-E444 PolarHBondContact O-N 2.02Å; V441-E444 PolarHBondContact O-N 3.08Å; L442-E444 PolarHBondContact O-N 2.83Å; E444-G447 PolarHBondContact O-N 2.85Å; E444-K448 VanDerWaalsContact O-CB 3.24Å; E444-K448 WeakPolarHBondContact O-CB 3.44Å; E444-K448 PolarHBondContact O-N 3.4Å
445	M	94.6	Very high	91.5	Very high	16 Å²	16	35 Å²	35	8%	0.079	20%	0.2	C	C	.	.	H	α-helix	trans	-65.3	-38.7	177.2	-66.5	-46.9	146.6	0	0	112.5	T377 L380 N387 L390 S391 T394 V441 L442 L443 F449	T377-M445 HydrophobicContact CG2-CE 4.5Å; L380-M445 HydrophobicContact CD1-CE 4.19Å; N387-M445 WeakPolarHBondContact O-CE 3.35Å; L390-M445 HydrophobicContact CB-CE 4Å; L390-M445 HydrophobicContact CB-CG 4.4Å; L390-M445 HydrophobicContact CB-SD 3.98Å; S391-M445 VanDerWaalsContact CA-SD 3.55Å; S391-M445 PolarHBondContact N-SD 3.47Å; S391-M445 VanDerWaalsContact N-SD 3.43Å; T394-M445 HydrophobicContact CG2-CB 3.87Å; T394-M445 HydrophobicContact CG2-CG 4.19Å; T394-M445 HydrophobicContact CG2-SD 3.98Å; V441-M445 HydrophobicContact CG1-CE 3.82Å; V441-M445 HydrophobicContact CG1-CG 4.2Å; V441-M445 VanDerWaalsContact O-CG 3.24Å; V441-M445 WeakPolarHBondContact O-CG 3.24Å; V441-M445 PolarHBondContact O-N 3.01Å; L442-M445 PolarHBondContact O-N 2.74Å; L443-M445 VanDerWaalsContact C-N 3.32Å; L443-M445 PolarHBondContact O-N 2.9Å; M445-F449 WeakPolarHBondContact O-CB 3.35Å; M445-F449 PolarHBondContact O-N 2.96Å
446	V	95.5	Very high	92	Very high	50 Å²	50	29 Å²	29	30%	0.303	17%	0.17	S	C	.	.	H	α-helix	trans	-68.5	-39.1	173.4	-179.5	0	0	0	0	110.7	L421 M425 L442 L443 F449 G450	L421-V446 HydrophobicContact CD1-CG1 4.2Å; L421-V446 HydrophobicContact CG-CG1 4.43Å; M425-V446 HydrophobicContact CG-CB 4.31Å; M425-V446 HydrophobicContact CG-CG1 3.81Å; M425-V446 HydrophobicContact SD-CG1 4.2Å; L442-V446 WeakPolarHBondContact O-CG2 3.16Å; L442-V446 PolarHBondContact O-N 3.36Å; L443-V446 PolarHBondContact O-N 3.45Å; V446-F449 WeakPolarHBondContact O-CB 3.35Å; V446-F449 PolarHBondContact O-N 3.21Å; V446-G450 PolarHBondContact O-N 2.95Å
447	G	95.3	Very high	92.2	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-60	-49.3	173.6	0	0	0	0	0	112.1	L443 E444 F449 G450 I451	L443-G447 PolarHBondContact O-N 2.92Å; E444-G447 PolarHBondContact O-N 2.85Å; G447-F449 VanDerWaalsContact C-N 3.35Å; G447-F449 PolarHBondContact O-N 3.38Å; G447-G450 PolarHBondContact O-N 2.83Å; G447-G450 VanDerWaalsContact O-N 3.14Å; G447-I451 WeakPolarHBondContact O-CG1 3.02Å; G447-I451 PolarHBondContact O-N 3.46Å
448	K	94.1	Very high	92.5	Very high	1 Å²	1	22.2 Å²	22.2	0%	0.004	13%	0.131	C	C	.	.	H	α-helix	trans	-55.8	-46.4	173.7	-176.8	94.9	-178.3	-157.8	0	111.8	L373 S391 E444 G450 I451 T452	L373-K448 HydrophobicContact CB-CD 3.93Å; L373-K448 HydrophobicContact CD1-CD 4.37Å; S391-K448 VanDerWaalsContact OG-CE 3.28Å; S391-K448 WeakPolarHBondContact OG-CE 3.3Å; S391-K448 PolarHBondContact OG-NZ 2.03Å; E444-K448 VanDerWaalsContact O-CB 3.24Å; E444-K448 WeakPolarHBondContact O-CB 3.44Å; E444-K448 PolarHBondContact O-N 3.4Å; K448-G450 VanDerWaalsContact C-N 3.33Å; K448-G450 PolarHBondContact O-N 2.82Å; K448-I451 PolarHBondContact O-N 3.14Å; K448-T452 VanDerWaalsContact O-CB 3.28Å; K448-T452 WeakPolarHBondContact O-CB 3.41Å; K448-T452 PolarHBondContact O-N 2.75Å; K448-T452 PolarHBondContact O-OG1 3Å
449	F	95.6	Very high	92.4	Very high	47 Å²	47	22.6 Å²	22.6	21%	0.206	12%	0.117	C	C	.	.	H	α-helix	trans	-57.5	-46.1	175.2	171.3	-87.3	0	0	0	111.5	A398 I401 L421 M445 V446 G447 S453	A398-F449 HydrophobicContact CB-CD2 3.64Å; A398-F449 HydrophobicContact CB-CE2 3.81Å; A398-F449 HydrophobicContact CB-CG 4.41Å; I401-F449 HydrophobicContact CB-CZ 4.27Å; I401-F449 HydrophobicContact CD1-CE2 3.83Å; I401-F449 HydrophobicContact CD1-CZ 3.7Å; I401-F449 HydrophobicContact CG2-CZ 4.23Å; L421-F449 HydrophobicContact CD2-CD1 4.44Å; M445-F449 WeakPolarHBondContact O-CB 3.35Å; M445-F449 PolarHBondContact O-N 2.96Å; V446-F449 WeakPolarHBondContact O-CB 3.35Å; V446-F449 PolarHBondContact O-N 3.21Å; G447-F449 VanDerWaalsContact C-N 3.35Å; G447-F449 PolarHBondContact O-N 3.38Å; F449-S453 VanDerWaalsContact O-CB 3.26Å; F449-S453 WeakPolarHBondContact O-CB 3.27Å; F449-S453 PolarHBondContact O-N 3.2Å; F449-S453 PolarHBondContact O-OG 3.14Å
450	G	95.7	Very high	92.2	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-62.1	-47.2	177.4	0	0	0	0	0	113	S418 V446 G447 K448 S453 A454	S418-G450 WeakPolarHBondContact CB-O 3.46Å; S418-G450 CarbonylContact O-C 3.45Å; V446-G450 PolarHBondContact O-N 2.95Å; G447-G450 PolarHBondContact O-N 2.83Å; G447-G450 VanDerWaalsContact O-N 3.14Å; K448-G450 VanDerWaalsContact C-N 3.33Å; K448-G450 PolarHBondContact O-N 2.82Å; G450-S453 PolarHBondContact O-N 3.11Å; G450-A454 WeakPolarHBondContact O-CB 2.97Å; G450-A454 PolarHBondContact O-N 3.1Å
451	I	95.9	Very high	92.2	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-67.4	-41.2	178.7	-62.7	-57	0	0	0	111.9	V366 N369 L373 L419 I426 G447 K448 S453 A454 F455 A511	V366-I451 HydrophobicContact CG1-CG2 4.21Å; N369-I451 HydrophobicContact CB-CD1 4.25Å; N369-I451 HydrophobicContact CB-CG1 4.38Å; N369-I451 HydrophobicContact CB-CG2 3.93Å; L373-I451 HydrophobicContact CD1-CB 4.13Å; L373-I451 HydrophobicContact CD1-CG1 3.93Å; L373-I451 HydrophobicContact CD1-CG2 4.43Å; L419-I451 HydrophobicContact CD2-CD1 4.13Å; I426-I451 HydrophobicContact CD1-CG1 3.99Å; G447-I451 WeakPolarHBondContact O-CG1 3.02Å; G447-I451 PolarHBondContact O-N 3.46Å; K448-I451 PolarHBondContact O-N 3.14Å; I451-S453 VanDerWaalsContact C-N 3.31Å; I451-S453 PolarHBondContact O-N 3.23Å; I451-A454 WeakPolarHBondContact O-CB 3.32Å; I451-A454 PolarHBondContact O-N 3.21Å; I451-F455 PolarHBondContact O-N 3.42Å; I451-A511 HydrophobicContact CD1-CB 4.04Å
452	T	93.1	Very high	92	Very high	2 Å²	2	20 Å²	20	1%	0.012	10%	0.104	C	C	.	.	H	α-helix	trans	-62.6	-42.6	175.7	-54.6	0	0	0	0	110.4	Y370 E395 A398 Y399 K448 A454 F455 C456	Y370-T452 HydrophobicContact CE2-CG2 4.43Å; E395-T452 HydrophobicContact CB-CG2 4.34Å; E395-T452 HydrophobicContact CG-CG2 4.21Å; A398-T452 HydrophobicContact CB-CG2 4.01Å; Y399-T452 HydrophobicContact CE1-CG2 3.85Å; K448-T452 VanDerWaalsContact O-CB 3.28Å; K448-T452 WeakPolarHBondContact O-CB 3.41Å; K448-T452 PolarHBondContact O-N 2.75Å; K448-T452 PolarHBondContact O-OG1 3Å; T452-A454 PolarHBondContact O-N 2.93Å; T452-F455 WeakPolarHBondContact O-CB 3.26Å; T452-F455 PolarHBondContact O-N 2.95Å; T452-F455 VanDerWaalsContact O-N 3.15Å; T452-C456 PolarHBondContact O-N 2.87Å; T452-C456 VanDerWaalsContact O-N 3.16Å
453	S	92.9	Very high	91.6	Very high	4 Å²	4	16.3 Å²	16.3	3%	0.028	9%	0.089	C	C	.	.	H	α-helix	trans	-61.6	-44.4	175.5	-61.9	0	0	0	0	111.8	V402 F449 G450 I451 F455 C456 V457	V402-S453 VanDerWaalsContact CG2-CB 3.42Å; F449-S453 VanDerWaalsContact O-CB 3.26Å; F449-S453 WeakPolarHBondContact O-CB 3.27Å; F449-S453 PolarHBondContact O-N 3.2Å; F449-S453 PolarHBondContact O-OG 3.14Å; G450-S453 PolarHBondContact O-N 3.11Å; I451-S453 VanDerWaalsContact C-N 3.31Å; I451-S453 PolarHBondContact O-N 3.23Å; S453-F455 VanDerWaalsContact C-N 3.27Å; S453-F455 PolarHBondContact O-N 2.84Å; S453-C456 PolarHBondContact O-N 3.41Å; S453-V457 WeakPolarHBondContact O-CG2 3.45Å; S453-V457 PolarHBondContact O-N 3.05Å
454	A	94.1	Very high	91.2	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-61.9	-33.8	175	0	0	0	0	0	112.4	V366 Q415 L419 G450 I451 T452 L458	V366-A454 HydrophobicContact CG1-CB 4.21Å; Q415-A454 PolarHBondContact NE2-O 2.91Å; Q415-A454 PolarHBondContact OE1-O 3.49Å; L419-A454 HydrophobicContact CD2-CB 3.63Å; L419-A454 HydrophobicContact CG-CB 3.78Å; G450-A454 WeakPolarHBondContact O-CB 2.97Å; G450-A454 PolarHBondContact O-N 3.1Å; I451-A454 WeakPolarHBondContact O-CB 3.32Å; I451-A454 PolarHBondContact O-N 3.21Å; T452-A454 PolarHBondContact O-N 2.93Å; A454-L458 WeakPolarHBondContact O-CB 3.41Å; A454-L458 PolarHBondContact O-N 3.48Å; A454-L458 VanDerWaalsContact O-N 3.1Å
455	F	91.2	Very high	90.9	Very high	28 Å²	28	17.1 Å²	17.1	12%	0.123	9%	0.091	C	C	.	.	H	α-helix	trans	-65.9	-43.8	176.4	-159.5	-112.7	0	0	0	110.9	V366 A367 I451 T452 S453 L458 Y459	V366-F455 HydrophobicContact CB-CD2 4.12Å; V366-F455 HydrophobicContact CG1-CB 3.8Å; V366-F455 HydrophobicContact CG1-CD2 3.63Å; V366-F455 HydrophobicContact CG1-CG 4.22Å; A367-F455 HydrophobicContact CB-CE2 4.03Å; I451-F455 PolarHBondContact O-N 3.42Å; T452-F455 WeakPolarHBondContact O-CB 3.26Å; T452-F455 PolarHBondContact O-N 2.95Å; T452-F455 VanDerWaalsContact O-N 3.15Å; S453-F455 VanDerWaalsContact C-N 3.27Å; S453-F455 PolarHBondContact O-N 2.84Å; F455-L458 WeakPolarHBondContact O-CB 3.48Å; F455-L458 PolarHBondContact O-N 3.35Å; F455-Y459 AromaticContact CD1-CE2 3.91Å; F455-Y459 HydrophobicContact CD1-CE2 3.91Å; F455-Y459 AromaticContact CE1-CE2 3.57Å; F455-Y459 HydrophobicContact CE1-CE2 3.57Å; F455-Y459 AromaticContact CZ-CE2 3.96Å; F455-Y459 HydrophobicContact CZ-CE2 3.96Å; F455-Y459 WeakPolarHBondContact O-CD2 3.45Å; F455-Y459 PolarHBondContact O-N 2.91Å
456	C	88.3	Confident	90.5	Very high	17 Å²	17	16.4 Å²	16.4	12%	0.115	9%	0.088	C	C	.	.	H	α-helix	trans	-67.6	-46.1	178.4	-67.6	0	0	0	0	113.8	Y399 V402 T452 S453 L458 Y459	Y399-C456 WeakPolarHBondContact CD1-SG 3.42Å; Y399-C456 WeakPolarHBondContact CE1-SG 3.39Å; V402-C456 HydrophobicContact CB-CB 4.4Å; V402-C456 HydrophobicContact CG1-CB 3.77Å; T452-C456 PolarHBondContact O-N 2.87Å; T452-C456 VanDerWaalsContact O-N 3.16Å; S453-C456 PolarHBondContact O-N 3.41Å; C456-L458 PolarHBondContact O-N 2.7Å; C456-Y459 PolarHBondContact O-N 2.8Å
457	V	90.1	Very high	89.7	Confident	0 Å²	0	14 Å²	14	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-60.5	-36.3	177.2	175.1	0	0	0	0	110.1	V402 L406 C414 Q415 S453 Y459 A460 F461	V402-V457 HydrophobicContact CG1-CG2 3.61Å; V402-V457 HydrophobicContact CG2-CG2 4.17Å; L406-V457 HydrophobicContact CD2-CB 4.43Å; L406-V457 HydrophobicContact CD2-CG1 4.16Å; L406-V457 HydrophobicContact CD2-CG2 4.09Å; C414-V457 HydrophobicContact CB-CG1 4.28Å; C414-V457 HydrophobicContact CB-CG2 4.45Å; Q415-V457 HydrophobicContact CB-CG1 3.94Å; S453-V457 WeakPolarHBondContact O-CG2 3.45Å; S453-V457 PolarHBondContact O-N 3.05Å; V457-Y459 PolarHBondContact O-N 3.4Å; V457-A460 PolarHBondContact O-N 3.31Å; V457-F461 VanDerWaalsContact O-CB 3.24Å; V457-F461 WeakPolarHBondContact O-CB 3.32Å; V457-F461 PolarHBondContact O-N 3.47Å
458	L	90.8	Very high	88.8	Confident	2 Å²	2	17.2 Å²	17.2	1%	0.01	9%	0.093	C	C	.	.	H	α-helix	trans	-62.1	-38.8	179.6	-172.4	63.6	0	0	0	113.4	L362 W363 V366 Q415 A454 F455 C456 T462	L362-L458 HydrophobicContact CB-CD1 4.05Å; L362-L458 HydrophobicContact CD1-CD1 4.49Å; W363-L458 HydrophobicContact CB-CD2 4.18Å; W363-L458 HydrophobicContact CD2-CD2 3.9Å; W363-L458 HydrophobicContact CD2-CG 4.27Å; W363-L458 HydrophobicContact CG-CD2 3.61Å; W363-L458 HydrophobicContact CG-CG 4.16Å; V366-L458 HydrophobicContact CB-CD2 4.24Å; V366-L458 HydrophobicContact CG2-CD2 3.98Å; Q415-L458 VanDerWaalsContact OE1-N 3.15Å; A454-L458 WeakPolarHBondContact O-CB 3.41Å; A454-L458 PolarHBondContact O-N 3.48Å; A454-L458 VanDerWaalsContact O-N 3.1Å; F455-L458 WeakPolarHBondContact O-CB 3.48Å; F455-L458 PolarHBondContact O-N 3.35Å; C456-L458 PolarHBondContact O-N 2.7Å; L458-T462 VanDerWaalsContact O-CB 3.27Å; L458-T462 WeakPolarHBondContact O-CB 3.25Å; L458-T462 PolarHBondContact O-N 3.26Å; L458-T462 PolarHBondContact O-OG1 3.25Å
459	Y	86.3	Confident	87.8	Confident	83 Å²	83	19.8 Å²	19.8	33%	0.325	11%	0.109	S	C	.	.	H	α-helix	trans	-60.2	-49.6	174.5	-87.2	-92.8	0	0	0	111.5	W363 F455 C456 V457 A463 M475	W363-Y459 AromaticContact CH2-CD1 3.55Å; W363-Y459 HydrophobicContact CH2-CD1 3.55Å; W363-Y459 HydrophobicContact CH2-CD2 4Å; W363-Y459 AromaticContact CH2-CE1 3.34Å; W363-Y459 HydrophobicContact CH2-CE1 3.34Å; W363-Y459 AromaticContact CH2-CE2 3.78Å; W363-Y459 HydrophobicContact CH2-CE2 3.78Å; W363-Y459 AromaticContact CH2-CG 3.87Å; W363-Y459 HydrophobicContact CH2-CG 3.87Å; W363-Y459 AromaticContact CH2-CZ 3.44Å; W363-Y459 VanDerWaalsContact CH2-CZ 3.44Å; W363-Y459 HydrophobicContact CZ2-CD1 4.21Å; W363-Y459 HydrophobicContact CZ2-CE1 4.41Å; W363-Y459 HydrophobicContact CZ2-CG 4.29Å; W363-Y459 HydrophobicContact CZ3-CD1 4.47Å; W363-Y459 HydrophobicContact CZ3-CD2 4.47Å; W363-Y459 AromaticContact CZ3-CE1 3.9Å; W363-Y459 HydrophobicContact CZ3-CE1 3.9Å; W363-Y459 AromaticContact CZ3-CE2 3.86Å; W363-Y459 HydrophobicContact CZ3-CE2 3.86Å; W363-Y459 AromaticContact CZ3-CZ 3.53Å; F455-Y459 AromaticContact CD1-CE2 3.91Å; F455-Y459 HydrophobicContact CD1-CE2 3.91Å; F455-Y459 AromaticContact CE1-CE2 3.57Å; F455-Y459 HydrophobicContact CE1-CE2 3.57Å; F455-Y459 AromaticContact CZ-CE2 3.96Å; F455-Y459 HydrophobicContact CZ-CE2 3.96Å; F455-Y459 WeakPolarHBondContact O-CD2 3.45Å; F455-Y459 PolarHBondContact O-N 2.91Å; C456-Y459 PolarHBondContact O-N 2.8Å; V457-Y459 PolarHBondContact O-N 3.4Å; Y459-A463 PolarHBondContact O-N 2.9Å; Y459-M475 WeakPolarHBondContact O-CE 3.39Å
460	A	85.3	Confident	86.9	Confident	26 Å²	26	17.9 Å²	17.9	22%	0.215	10%	0.101	C	C	.	.	H	α-helix	trans	-64.9	-47.1	179.4	0	0	0	0	0	111.2	L406 V457 T462 A463 E464	L406-A460 HydrophobicContact CD1-CB 4.11Å; L406-A460 HydrophobicContact CD2-CB 4.27Å; V457-A460 PolarHBondContact O-N 3.31Å; A460-T462 PolarHBondContact O-N 2.86Å; A460-A463 PolarHBondContact O-N 2.98Å; A460-E464 WeakPolarHBondContact O-CG 3.24Å; A460-E464 PolarHBondContact O-N 2.72Å; A460-E464 VanDerWaalsContact O-N 3.07Å
461	F	87.9	Confident	86.2	Confident	2 Å²	2	20.2 Å²	20.2	1%	0.009	11%	0.109	C	C	.	.	H	α-helix	trans	-61.8	-43.4	-177.6	-173.1	-143.2	0	0	0	111.9	R411 R412 V457 A463 E464 L465 L521 P522 T524	R411-F461 HydrophobicContact CB-CD2 3.69Å; R411-F461 HydrophobicContact CB-CE2 4.12Å; R411-F461 HydrophobicContact CB-CG 4.33Å; R411-F461 HydrophobicContact CG-CD2 4.48Å; R412-F461 HydrophobicContact CB-CZ 4.49Å; V457-F461 VanDerWaalsContact O-CB 3.24Å; V457-F461 WeakPolarHBondContact O-CB 3.32Å; V457-F461 PolarHBondContact O-N 3.47Å; F461-A463 VanDerWaalsContact C-N 3.35Å; F461-A463 PolarHBondContact O-N 3.49Å; F461-E464 PolarHBondContact O-N 3.38Å; F461-L465 HydrophobicContact CE2-CD1 4.27Å; F461-L465 HydrophobicContact CZ-CD1 4.33Å; F461-L465 WeakPolarHBondContact O-CB 3.31Å; F461-L465 PolarHBondContact O-N 3.09Å; F461-L521 HydrophobicContact CD1-CD1 4.48Å; F461-L521 HydrophobicContact CE1-CB 4.02Å; F461-L521 HydrophobicContact CE1-CD1 3.58Å; F461-L521 HydrophobicContact CE1-CG 4.45Å; F461-L521 HydrophobicContact CZ-CB 3.79Å; F461-L521 HydrophobicContact CZ-CD1 4.2Å; F461-P522 WeakPolarHBondContact CE2-O 3.48Å; F461-P522 WeakPolarHBondContact CZ-O 3.21Å; F461-T524 HydrophobicContact CD2-CG2 4.14Å; F461-T524 WeakPolarHBondContact CD2-OG1 3.48Å; F461-T524 HydrophobicContact CE2-CG2 3.88Å
462	T	87.3	Confident	85.4	Confident	2 Å²	2	26.6 Å²	26.6	1%	0.012	14%	0.144	C	C	.	.	H	α-helix	trans	-64	-39.7	177.4	-53.2	0	0	0	0	111.7	W363 L458 A460 E464 L465 F466 M475	W363-T462 HydrophobicContact CZ2-CG2 4.45Å; W363-T462 PolarHBondContact NE1-OG1 2.95Å; L458-T462 VanDerWaalsContact O-CB 3.27Å; L458-T462 WeakPolarHBondContact O-CB 3.25Å; L458-T462 PolarHBondContact O-N 3.26Å; L458-T462 PolarHBondContact O-OG1 3.25Å; A460-T462 PolarHBondContact O-N 2.86Å; T462-E464 VanDerWaalsContact C-N 3.32Å; T462-E464 PolarHBondContact O-N 3.28Å; T462-L465 PolarHBondContact O-N 3.42Å; T462-F466 HydrophobicContact CG2-CD2 3.93Å; T462-F466 HydrophobicContact CG2-CE2 3.85Å; T462-F466 WeakPolarHBondContact O-CD2 3.16Å; T462-F466 PolarHBondContact O-N 2.88Å; T462-M475 HydrophobicContact CG2-CE 4.36Å
463	A	83.8	Confident	84.8	Confident	29 Å²	29	28.3 Å²	28.3	24%	0.24	15%	0.154	C	C	.	.	H	α-helix	trans	-64.9	-35.5	177.1	0	0	0	0	0	112.5	Y459 A460 F461 R471 M475	Y459-A463 PolarHBondContact O-N 2.9Å; A460-A463 PolarHBondContact O-N 2.98Å; F461-A463 VanDerWaalsContact C-N 3.35Å; F461-A463 PolarHBondContact O-N 3.49Å; A463-R471 WeakPolarHBondContact O-CD 3.31Å; A463-R471 PolarHBondContact O-NE 3.22Å; A463-M475 HydrophobicContact CB-CE 3.94Å
464	E	85.8	Confident	84.4	Confident	42 Å²	42	28.2 Å²	28.2	20%	0.196	15%	0.153	C	C	.	.	H	α-helix	trans	-78.3	-24.1	178.6	-66.3	172	-163.9	0	0	113	R411 A460 F461 T462 T524 L529 P530	R411-E464 WeakPolarHBondContact CG-OE2 3.23Å; R411-E464 IonicContact CZ-OE1 2.71Å; R411-E464 IonicContact NE-OE1 3.17Å; R411-E464 PolarHBondContact NE-OE1 2.92Å; R411-E464 IonicContact NE-OE2 3.89Å; R411-E464 PolarHBondContact NE-OE2 3.45Å; R411-E464 IonicContact NH2-OE1 3.86Å; R411-E464 PolarHBondContact NH2-OE1 3.05Å; A460-E464 WeakPolarHBondContact O-CG 3.24Å; A460-E464 PolarHBondContact O-N 2.72Å; A460-E464 VanDerWaalsContact O-N 3.07Å; F461-E464 PolarHBondContact O-N 3.38Å; T462-E464 VanDerWaalsContact C-N 3.32Å; T462-E464 PolarHBondContact O-N 3.28Å; E464-T524 HydrophobicContact CB-CG2 3.94Å; E464-T524 VanDerWaalsContact OE2-CB 3.24Å; E464-T524 WeakPolarHBondContact OE2-CB 3.29Å; E464-T524 PolarHBondContact OE2-OG1 3.23Å; E464-L529 HydrophobicContact CB-CD2 4.22Å; E464-L529 HydrophobicContact CG-CD2 4.04Å; E464-P530 WeakPolarHBondContact O-CD 3.44Å
465	L	86.3	Confident	83.9	Confident	8 Å²	8	30.4 Å²	30.4	4%	0.042	16%	0.164	C	C	.	.	H	α-helix	trans	-76.8	-38.6	-176.1	-161.7	78.6	0	0	0	113.3	T355 S359 F461 T462 L521 P522 T524	T355-L465 HydrophobicContact CG2-CD1 4.25Å; T355-L465 HydrophobicContact CG2-CD2 3.16Å; T355-L465 HydrophobicContact CG2-CG 3.6Å; S359-L465 VanDerWaalsContact OG-CD2 3.22Å; S359-L465 WeakPolarHBondContact OG-CD2 3.24Å; F461-L465 HydrophobicContact CE2-CD1 4.27Å; F461-L465 HydrophobicContact CZ-CD1 4.33Å; F461-L465 WeakPolarHBondContact O-CB 3.31Å; F461-L465 PolarHBondContact O-N 3.09Å; T462-L465 PolarHBondContact O-N 3.42Å; L465-L521 HydrophobicContact CD2-CD2 4.24Å; L465-P522 HydrophobicContact CD1-CG 3.74Å; L465-T524 HydrophobicContact CD1-CG2 4.35Å
466	F	84.5	Confident	83.6	Confident	1 Å²	1	30.8 Å²	30.8	0%	0.004	18%	0.176	C	C	.	.	S	Bend	trans	-97.7	137.9	-175.8	-67.6	-74.1	0	0	0	112.2	T355 A356 T462 I470 R471 A474 M536	T355-F466 HydrophobicContact CG2-CE1 4.14Å; T355-F466 HydrophobicContact CG2-CZ 3.99Å; A356-F466 HydrophobicContact CB-CE1 4.22Å; A356-F466 HydrophobicContact CB-CZ 4.15Å; T462-F466 HydrophobicContact CG2-CD2 3.93Å; T462-F466 HydrophobicContact CG2-CE2 3.85Å; T462-F466 WeakPolarHBondContact O-CD2 3.16Å; T462-F466 PolarHBondContact O-N 2.88Å; F466-I470 HydrophobicContact CB-CG1 4.44Å; F466-I470 HydrophobicContact CD1-CD1 4.29Å; F466-I470 HydrophobicContact CD1-CG1 4.49Å; F466-R471 HydrophobicContact CB-CB 4.3Å; F466-R471 HydrophobicContact CB-CG 4.49Å; F466-R471 PolarHBondContact O-NE 3.22Å; F466-A474 HydrophobicContact CB-CB 4.13Å; F466-A474 HydrophobicContact CD1-CB 3.55Å; F466-A474 HydrophobicContact CD2-CB 3.56Å; F466-A474 HydrophobicContact CE1-CB 3.81Å; F466-A474 HydrophobicContact CE2-CB 3.83Å; F466-A474 HydrophobicContact CG-CB 3.44Å; F466-A474 VanDerWaalsContact CG-CB 3.44Å; F466-A474 HydrophobicContact CZ-CB 3.96Å; F466-M536 HydrophobicContact CD1-CE 4.13Å; F466-M536 HydrophobicContact CE1-CE 4.13Å
467	P	80.6	Confident	83.6	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	19%	0.185	C	C	.	.			trans	-64.9	149.5	177.5	17.9	-22	0	0	0	112	V469 I470 R471 P530 A532	P467-V469 PolarHBondContact O-N 3.45Å; P467-I470 HydrophobicContact CG-CD1 3.84Å; P467-I470 HydrophobicContact CG-CG1 3.81Å; P467-I470 PolarHBondContact O-N 2.87Å; P467-R471 WeakPolarHBondContact O-CB 3.47Å; P467-R471 PolarHBondContact O-N 3.45Å; P467-P530 WeakPolarHBondContact CA-O 3.28Å; P467-P530 HydrophobicContact CB-CB 4.06Å; P467-P530 HydrophobicContact CB-CG 4.38Å; P467-A532 WeakPolarHBondContact CB-O 3.13Å
468	T	76.3	Confident	83.6	Confident	67 Å²	67	32.1 Å²	32.1	41%	0.411	19%	0.185	S	C	.	.	H	α-helix	trans	-49.2	-38.6	-175.7	51.6	0	0	0	0	112.9	I470 P530 E531	T468-I470 VanDerWaalsContact C-N 3.31Å; T468-I470 PolarHBondContact O-N 3.48Å; T468-P530 PolarHBondContact N-O 3.4Å; T468-P530 VanDerWaalsContact N-O 3.13Å; T468-E531 PolarHBondContact OG1-O 2.9Å; T468-E531 VanDerWaalsContact OG1-O 3.09Å
469	V	71.8	Confident	83.5	Confident	56 Å²	56	33.7 Å²	33.7	34%	0.339	20%	0.196	S	C	.	.	H	α-helix	trans	-61.7	-33.1	-179.3	-153.2	0	0	0	0	113.8	F341 P467 E531	F341-V469 HydrophobicContact CD1-CG1 4.09Å; F341-V469 HydrophobicContact CD2-CG1 4.41Å; F341-V469 HydrophobicContact CE1-CG1 3.74Å; F341-V469 HydrophobicContact CE2-CG1 4.09Å; F341-V469 HydrophobicContact CG-CG1 4.41Å; F341-V469 HydrophobicContact CZ-CG1 3.74Å; P467-V469 PolarHBondContact O-N 3.45Å; V469-E531 WeakPolarHBondContact CG2-O 3.28Å
470	I	76.7	Confident	83.7	Confident	6 Å²	6	32.2 Å²	32.2	3%	0.031	20%	0.196	C	C	.	.	H	α-helix	trans	-117.2	-3.6	-176.7	72.2	-178.1	0	0	0	113.2	V345 L346 I352 F466 P467 T468 N472 T473 A474 L533	V345-I470 HydrophobicContact CG1-CG2 4.14Å; L346-I470 HydrophobicContact CD2-CD1 4.04Å; I352-I470 HydrophobicContact CD1-CD1 4.42Å; I352-I470 HydrophobicContact CG2-CD1 3.88Å; F466-I470 HydrophobicContact CB-CG1 4.44Å; F466-I470 HydrophobicContact CD1-CD1 4.29Å; F466-I470 HydrophobicContact CD1-CG1 4.49Å; P467-I470 HydrophobicContact CG-CD1 3.84Å; P467-I470 HydrophobicContact CG-CG1 3.81Å; P467-I470 PolarHBondContact O-N 2.87Å; T468-I470 VanDerWaalsContact C-N 3.31Å; T468-I470 PolarHBondContact O-N 3.48Å; I470-N472 PolarHBondContact O-N 2.93Å; I470-T473 WeakPolarHBondContact O-CB 3.35Å; I470-T473 PolarHBondContact O-N 2.96Å; I470-T473 VanDerWaalsContact O-N 3.17Å; I470-A474 WeakPolarHBondContact O-CB 3.37Å; I470-A474 PolarHBondContact O-N 3.43Å; I470-L533 HydrophobicContact CD1-CD2 3.9Å; I470-L533 HydrophobicContact CG2-CD2 4.22Å
471	R	81.1	Confident	84	Confident	49 Å²	49	31.8 Å²	31.8	19%	0.185	19%	0.192	C	C	.	.	H	α-helix	trans	-55.2	-48.7	-172.5	-177.8	-176.6	-62.8	159	1	112.5	A463 F466 P467 T473 A474 M475	A463-R471 WeakPolarHBondContact O-CD 3.31Å; A463-R471 PolarHBondContact O-NE 3.22Å; F466-R471 HydrophobicContact CB-CB 4.3Å; F466-R471 HydrophobicContact CB-CG 4.49Å; F466-R471 PolarHBondContact O-NE 3.22Å; P467-R471 WeakPolarHBondContact O-CB 3.47Å; P467-R471 PolarHBondContact O-N 3.45Å; R471-T473 VanDerWaalsContact C-N 3.33Å; R471-T473 PolarHBondContact O-N 2.9Å; R471-A474 PolarHBondContact O-N 2.87Å; R471-M475 VanDerWaalsContact O-CB 3.26Å; R471-M475 WeakPolarHBondContact O-CB 3.23Å; R471-M475 PolarHBondContact O-N 3.01Å
472	N	78.5	Confident	84.3	Confident	135 Å²	135	31.9 Å²	31.9	72%	0.722	19%	0.194	S	C	*	.	H	α-helix	trans	-62.9	-42.5	-179	-70.1	-17.6	0	0	0	111.4	I470 G476	I470-N472 PolarHBondContact O-N 2.93Å; N472-G476 PolarHBondContact O-N 3.31Å
473	T	81.6	Confident	84.5	Confident	38 Å²	38	33.2 Å²	33.2	23%	0.233	20%	0.198	C	C	.	.	H	α-helix	trans	-64.5	-47.5	177.6	-48.8	0	0	0	0	111.4	I343 L346 I470 R471 G476 C477	I343-T473 HydrophobicContact CB-CG2 4.2Å; I343-T473 HydrophobicContact CG1-CG2 3.44Å; I343-T473 VanDerWaalsContact CG1-CG2 3.44Å; L346-T473 HydrophobicContact CD1-CG2 3.77Å; I470-T473 WeakPolarHBondContact O-CB 3.35Å; I470-T473 PolarHBondContact O-N 2.96Å; I470-T473 VanDerWaalsContact O-N 3.17Å; R471-T473 VanDerWaalsContact C-N 3.33Å; R471-T473 PolarHBondContact O-N 2.9Å; T473-G476 PolarHBondContact O-N 3.37Å; T473-C477 PolarHBondContact O-N 3.42Å; T473-C477 PolarHBondContact O-SG 2.91Å; T473-C477 VanDerWaalsContact O-SG 3.4Å
474	A	83.8	Confident	85.1	Confident	1 Å²	1	35.7 Å²	35.7	1%	0.008	21%	0.207	C	C	.	.	H	α-helix	trans	-63.5	-43.7	178.9	0	0	0	0	0	112.1	L346 F466 I470 R471 G476 C477 C478	L346-A474 HydrophobicContact CD2-CB 4.08Å; F466-A474 HydrophobicContact CB-CB 4.13Å; F466-A474 HydrophobicContact CD1-CB 3.55Å; F466-A474 HydrophobicContact CD2-CB 3.56Å; F466-A474 HydrophobicContact CE1-CB 3.81Å; F466-A474 HydrophobicContact CE2-CB 3.83Å; F466-A474 HydrophobicContact CG-CB 3.44Å; F466-A474 VanDerWaalsContact CG-CB 3.44Å; F466-A474 HydrophobicContact CZ-CB 3.96Å; I470-A474 WeakPolarHBondContact O-CB 3.37Å; I470-A474 PolarHBondContact O-N 3.43Å; R471-A474 PolarHBondContact O-N 2.87Å; A474-G476 VanDerWaalsContact C-N 3.33Å; A474-G476 PolarHBondContact O-N 3.05Å; A474-C477 PolarHBondContact O-N 3.34Å; A474-C478 PolarHBondContact O-N 3.48Å; A474-C478 PolarHBondContact O-SG 3.08Å
475	M	85.3	Confident	85.5	Confident	47 Å²	47	33.7 Å²	33.7	23%	0.232	20%	0.197	C	C	.	.	H	α-helix	trans	-64.6	-37.3	175.8	-173.7	168.5	-93.9	0	0	111.5	W363 Y459 T462 A463 R471 C478 S479	W363-M475 HydrophobicContact CZ2-CE 4.48Å; Y459-M475 WeakPolarHBondContact O-CE 3.39Å; T462-M475 HydrophobicContact CG2-CE 4.36Å; A463-M475 HydrophobicContact CB-CE 3.94Å; R471-M475 VanDerWaalsContact O-CB 3.26Å; R471-M475 WeakPolarHBondContact O-CB 3.23Å; R471-M475 PolarHBondContact O-N 3.01Å; M475-C478 PolarHBondContact O-N 3.46Å; M475-S479 VanDerWaalsContact O-CB 3.27Å; M475-S479 WeakPolarHBondContact O-CB 3.35Å; M475-S479 PolarHBondContact O-N 3.29Å
476	G	84.3	Confident	85.9	Confident	35 Å²	35	33.4 Å²	33.4	36%	0.361	20%	0.196	S	C	.	.	H	α-helix	trans	-61.9	-43.4	172.1	0	0	0	0	0	113.2	N472 T473 A474 S479 T480	N472-G476 PolarHBondContact O-N 3.31Å; T473-G476 PolarHBondContact O-N 3.37Å; A474-G476 VanDerWaalsContact C-N 3.33Å; A474-G476 PolarHBondContact O-N 3.05Å; G476-S479 PolarHBondContact O-N 2.88Å; G476-T480 PolarHBondContact O-N 3.23Å; G476-T480 PolarHBondContact O-OG1 3.24Å
477	C	87.2	Confident	86.4	Confident	45 Å²	45	34.9 Å²	34.9	30%	0.304	20%	0.204	S	C	.	.	H	α-helix	trans	-61.7	-47.7	173.4	-68.2	0	0	0	0	111.8	T473 A474 S479 T480 A481	T473-C477 PolarHBondContact O-N 3.42Å; T473-C477 PolarHBondContact O-SG 2.91Å; T473-C477 VanDerWaalsContact O-SG 3.4Å; A474-C477 PolarHBondContact O-N 3.34Å; C477-S479 VanDerWaalsContact C-N 3.34Å; C477-S479 PolarHBondContact O-N 3.05Å; C477-T480 WeakPolarHBondContact O-CB 3.45Å; C477-T480 PolarHBondContact O-N 2.94Å; C477-A481 PolarHBondContact O-N 2.76Å
478	C	90.4	Very high	87.2	Confident	1 Å²	1	38.5 Å²	38.5	1%	0.007	22%	0.222	C	C	.	.	H	α-helix	trans	-61.8	-41.7	178	-65.8	0	0	0	0	111.8	W363 A474 M475 T480 A481 A482	W363-C478 HydrophobicContact CB-CB 4.32Å; W363-C478 WeakPolarHBondContact CB-O 3.17Å; W363-C478 HydrophobicContact CD2-CB 3.95Å; W363-C478 HydrophobicContact CG-CB 3.71Å; A474-C478 PolarHBondContact O-N 3.48Å; A474-C478 PolarHBondContact O-SG 3.08Å; M475-C478 PolarHBondContact O-N 3.46Å; C478-T480 VanDerWaalsContact C-N 3.35Å; C478-T480 PolarHBondContact O-N 3.35Å; C478-A481 PolarHBondContact O-N 2.81Å; C478-A482 PolarHBondContact O-N 3.23Å
479	S	88.3	Confident	88.1	Confident	35 Å²	35	35.3 Å²	35.3	25%	0.245	20%	0.202	C	C	.	.	H	α-helix	trans	-62.9	-41.4	176.6	-170	0	0	0	0	111.7	M475 G476 C477 A481 A482 R483	M475-S479 VanDerWaalsContact O-CB 3.27Å; M475-S479 WeakPolarHBondContact O-CB 3.35Å; M475-S479 PolarHBondContact O-N 3.29Å; G476-S479 PolarHBondContact O-N 2.88Å; C477-S479 VanDerWaalsContact C-N 3.34Å; C477-S479 PolarHBondContact O-N 3.05Å; S479-A481 PolarHBondContact O-N 2.96Å; S479-A482 VanDerWaalsContact O-CB 3.3Å; S479-A482 WeakPolarHBondContact O-CB 3.41Å; S479-A482 PolarHBondContact O-N 2.85Å; S479-R483 WeakPolarHBondContact O-CG 3.24Å; S479-R483 PolarHBondContact O-N 3.44Å
480	T	90.3	Very high	89.1	Confident	52 Å²	52	33 Å²	33	32%	0.319	19%	0.188	S	C	.	.	H	α-helix	trans	-62	-43.4	175.2	-55.8	0	0	0	0	111.2	L166 G476 C477 C478 A482 R483 I484	L166-T480 HydrophobicContact CD1-CG2 4.16Å; G476-T480 PolarHBondContact O-N 3.23Å; G476-T480 PolarHBondContact O-OG1 3.24Å; C477-T480 WeakPolarHBondContact O-CB 3.45Å; C477-T480 PolarHBondContact O-N 2.94Å; C478-T480 VanDerWaalsContact C-N 3.35Å; C478-T480 PolarHBondContact O-N 3.35Å; T480-A482 VanDerWaalsContact C-N 3.35Å; T480-A482 PolarHBondContact O-N 3.22Å; T480-R483 WeakPolarHBondContact O-CB 3.23Å; T480-R483 PolarHBondContact O-N 3.47Å; T480-R483 VanDerWaalsContact O-N 3.14Å; T480-I484 PolarHBondContact O-N 2.87Å
481	A	93.1	Very high	90	Very high	16 Å²	16	36.5 Å²	36.5	13%	0.132	20%	0.204	C	C	.	.	H	α-helix	trans	-62.3	-40	174.1	0	0	0	0	0	112.4	C477 C478 S479 R483 I484 G485	C477-A481 PolarHBondContact O-N 2.76Å; C478-A481 PolarHBondContact O-N 2.81Å; S479-A481 PolarHBondContact O-N 2.96Å; A481-R483 VanDerWaalsContact C-N 3.31Å; A481-R483 PolarHBondContact O-N 2.96Å; A481-I484 WeakPolarHBondContact O-CB 3.29Å; A481-I484 PolarHBondContact O-N 2.63Å; A481-G485 PolarHBondContact O-N 3.36Å
482	A	94.1	Very high	90.6	Very high	5 Å²	5	34.7 Å²	34.7	4%	0.041	20%	0.197	C	C	.	.	H	α-helix	trans	-56.3	-43.8	171.1	0	0	0	0	0	112.1	W363 A367 C478 S479 T480 I484 G485 T486	W363-A482 HydrophobicContact CB-CB 3.97Å; W363-A482 HydrophobicContact CE3-CB 3.74Å; A367-A482 HydrophobicContact CB-CB 3.7Å; A367-A482 WeakPolarHBondContact CB-O 3.22Å; C478-A482 PolarHBondContact O-N 3.23Å; S479-A482 VanDerWaalsContact O-CB 3.3Å; S479-A482 WeakPolarHBondContact O-CB 3.41Å; S479-A482 PolarHBondContact O-N 2.85Å; T480-A482 VanDerWaalsContact C-N 3.35Å; T480-A482 PolarHBondContact O-N 3.22Å; A482-I484 VanDerWaalsContact C-N 3.33Å; A482-I484 PolarHBondContact O-N 2.87Å; A482-G485 CarbonylContact O-C 3.53Å; A482-G485 WeakPolarHBondContact O-CA 3.27Å; A482-G485 PolarHBondContact O-N 2.97Å; A482-T486 VanDerWaalsContact O-CG2 3.32Å; A482-T486 WeakPolarHBondContact O-CG2 3.39Å; A482-T486 PolarHBondContact O-N 2.85Å
483	R	92	Very high	91.3	Very high	29 Å²	29	29.2 Å²	29.2	11%	0.109	17%	0.168	C	C	.	.	H	α-helix	trans	-62.6	-37.3	178	-64.1	-58.1	179.5	-177.4	0.3	112.7	L166 S479 T480 A481 G485 T486 I487	L166-R483 HydrophobicContact CB-CB 4.37Å; L166-R483 HydrophobicContact CD1-CB 3.88Å; L166-R483 HydrophobicContact CD1-CG 4.12Å; S479-R483 WeakPolarHBondContact O-CG 3.24Å; S479-R483 PolarHBondContact O-N 3.44Å; T480-R483 WeakPolarHBondContact O-CB 3.23Å; T480-R483 PolarHBondContact O-N 3.47Å; T480-R483 VanDerWaalsContact O-N 3.14Å; A481-R483 VanDerWaalsContact C-N 3.31Å; A481-R483 PolarHBondContact O-N 2.96Å; R483-G485 VanDerWaalsContact C-N 3.29Å; R483-G485 PolarHBondContact O-N 2.8Å; R483-T486 WeakPolarHBondContact CA-OG1 3.49Å; R483-T486 PolarHBondContact O-N 3.4Å; R483-T486 VanDerWaalsContact O-N 3.11Å; R483-T486 PolarHBondContact O-OG1 3.34Å; R483-I487 WeakPolarHBondContact O-CG1 3.35Å; R483-I487 PolarHBondContact O-N 3.06Å
484	I	94.5	Very high	91.8	Very high	82 Å²	82	29.7 Å²	29.7	42%	0.421	17%	0.166	S	C	.	.	H	α-helix	trans	-58.4	-45.3	171.6	-61.8	170.9	0	0	0	110.1	T480 A481 A482 T486 I487 I488	T480-I484 PolarHBondContact O-N 2.87Å; A481-I484 WeakPolarHBondContact O-CB 3.29Å; A481-I484 PolarHBondContact O-N 2.63Å; A482-I484 VanDerWaalsContact C-N 3.33Å; A482-I484 PolarHBondContact O-N 2.87Å; I484-T486 VanDerWaalsContact C-N 3.31Å; I484-T486 PolarHBondContact O-N 2.85Å; I484-I487 PolarHBondContact O-N 3.24Å; I484-I488 HydrophobicContact CG2-CD1 3.94Å; I484-I488 WeakPolarHBondContact O-CG1 3.17Å; I484-I488 PolarHBondContact O-N 3.46Å; I484-I488 VanDerWaalsContact O-N 3.16Å
485	G	94.8	Very high	92.1	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-57.8	-40.6	173.3	0	0	0	0	0	113.3	A481 A482 R483 I487 I488 S489	A481-G485 PolarHBondContact O-N 3.36Å; A482-G485 CarbonylContact O-C 3.53Å; A482-G485 WeakPolarHBondContact O-CA 3.27Å; A482-G485 PolarHBondContact O-N 2.97Å; R483-G485 VanDerWaalsContact C-N 3.29Å; R483-G485 PolarHBondContact O-N 2.8Å; G485-I487 PolarHBondContact O-N 3.07Å; G485-I488 PolarHBondContact O-N 3.27Å; G485-S489 PolarHBondContact O-N 3.45Å
486	T	94.3	Very high	92.1	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.006	18%	0.181	C	C	.	.	H	α-helix	trans	-64.3	-39.2	176.3	69.1	0	0	0	0	112.8	Y162 A367 F371 A482 R483 I484 I488 S489	Y162-T486 WeakPolarHBondContact CD2-O 3.49Å; A367-T486 HydrophobicContact CB-CG2 3.95Å; F371-T486 HydrophobicContact CD2-CG2 3.24Å; F371-T486 HydrophobicContact CE2-CG2 3.33Å; F371-T486 HydrophobicContact CG-CG2 4.2Å; F371-T486 HydrophobicContact CZ-CG2 4.33Å; A482-T486 VanDerWaalsContact O-CG2 3.32Å; A482-T486 WeakPolarHBondContact O-CG2 3.39Å; A482-T486 PolarHBondContact O-N 2.85Å; R483-T486 WeakPolarHBondContact CA-OG1 3.49Å; R483-T486 PolarHBondContact O-N 3.4Å; R483-T486 VanDerWaalsContact O-N 3.11Å; R483-T486 PolarHBondContact O-OG1 3.34Å; I484-T486 VanDerWaalsContact C-N 3.31Å; I484-T486 PolarHBondContact O-N 2.85Å; T486-I488 VanDerWaalsContact C-N 3.3Å; T486-I488 PolarHBondContact O-N 3Å; T486-S489 WeakPolarHBondContact O-CB 3.32Å; T486-S489 PolarHBondContact O-N 3.27Å; T486-S489 PolarHBondContact O-OG 3.4Å
487	I	96.3	Very high	92	Very high	33 Å²	33	35.3 Å²	35.3	17%	0.169	19%	0.189	C	C	.	.	H	α-helix	trans	-65.5	-35.1	178.9	-67.1	160.6	0	0	0	111	S159 I163 L166 R483 I484 G485 P490	S159-I487 WeakPolarHBondContact CB-O 3.25Å; S159-I487 PolarHBondContact OG-O 2.97Å; I163-I487 HydrophobicContact CD1-CG2 4.34Å; I163-I487 HydrophobicContact CG1-CD1 3.8Å; I163-I487 HydrophobicContact CG1-CG1 3.97Å; I163-I487 HydrophobicContact CG1-CG2 3.96Å; L166-I487 HydrophobicContact CD2-CD1 4.16Å; R483-I487 WeakPolarHBondContact O-CG1 3.35Å; R483-I487 PolarHBondContact O-N 3.06Å; I484-I487 PolarHBondContact O-N 3.24Å; G485-I487 PolarHBondContact O-N 3.07Å; I487-P490 WeakPolarHBondContact O-CD 3.21Å
488	I	95.9	Very high	91.9	Very high	75 Å²	75	39.9 Å²	39.9	39%	0.385	20%	0.2	S	C	.	.	H	α-helix	trans	-78.4	-28.4	179.4	-63.4	167	0	0	0	111.8	M368 I484 G485 T486 F491 I492	M368-I488 HydrophobicContact SD-CB 4.4Å; M368-I488 HydrophobicContact SD-CG2 4.09Å; I484-I488 HydrophobicContact CG2-CD1 3.94Å; I484-I488 WeakPolarHBondContact O-CG1 3.17Å; I484-I488 PolarHBondContact O-N 3.46Å; I484-I488 VanDerWaalsContact O-N 3.16Å; G485-I488 PolarHBondContact O-N 3.27Å; T486-I488 VanDerWaalsContact C-N 3.3Å; T486-I488 PolarHBondContact O-N 3Å; I488-F491 PolarHBondContact O-N 3.48Å; I488-I492 PolarHBondContact O-N 3.41Å
489	S	95.1	Very high	91.7	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-50.8	-40.1	-172.8	71.8	0	0	0	0	116.6	M368 G485 T486 F491 I492 I493	M368-S489 WeakPolarHBondContact O-CB 3.25Å; G485-S489 PolarHBondContact O-N 3.45Å; T486-S489 WeakPolarHBondContact O-CB 3.32Å; T486-S489 PolarHBondContact O-N 3.27Å; T486-S489 PolarHBondContact O-OG 3.4Å; S489-F491 VanDerWaalsContact C-N 3.27Å; S489-F491 PolarHBondContact O-N 3.09Å; S489-I492 WeakPolarHBondContact O-CB 3.4Å; S489-I492 PolarHBondContact O-N 3.12Å; S489-I493 PolarHBondContact O-N 2.89Å
490	P	94.6	Very high	91.4	Very high	7 Å²	7	48.8 Å²	48.8	5%	0.045	23%	0.233	C	C	.	.	H	α-helix	trans	-65.7	-31.7	179.9	-19.4	34.7	0	0	0	112.5	P155 T158 Y162 L375 I487 I492 I493 Y494	P155-P490 HydrophobicContact CB-CB 3.78Å; T158-P490 HydrophobicContact CG2-CB 4.31Å; T158-P490 HydrophobicContact CG2-CG 3.63Å; Y162-P490 HydrophobicContact CD2-CG 4.46Å; Y162-P490 HydrophobicContact CE2-CG 4.33Å; L375-P490 HydrophobicContact CD1-CB 4.06Å; L375-P490 HydrophobicContact CD1-CG 3.8Å; I487-P490 WeakPolarHBondContact O-CD 3.21Å; P490-I492 VanDerWaalsContact C-N 3.32Å; P490-I492 PolarHBondContact O-N 3.48Å; P490-I493 PolarHBondContact O-N 3.43Å; P490-Y494 PolarHBondContact O-N 3.48Å
491	F	94.9	Very high	91.3	Very high	81 Å²	81	47.3 Å²	47.3	36%	0.355	23%	0.226	S	C	.	.	H	α-helix	trans	-73.1	-23.9	178	-73.8	-78.3	0	0	0	112.9	P155 L156 S159 I488 S489 Y494 L495	P155-F491 HydrophobicContact CB-CD1 4.3Å; P155-F491 HydrophobicContact CB-CE1 4.32Å; P155-F491 HydrophobicContact CG-CD1 4.34Å; P155-F491 HydrophobicContact CG-CE1 4.14Å; L156-F491 HydrophobicContact CB-CZ 4.3Å; S159-F491 VanDerWaalsContact OG-CE2 3.31Å; S159-F491 WeakPolarHBondContact OG-CE2 3.4Å; I488-F491 PolarHBondContact O-N 3.48Å; S489-F491 VanDerWaalsContact C-N 3.27Å; S489-F491 PolarHBondContact O-N 3.09Å; F491-Y494 HydrophobicContact CD1-CD1 4.46Å; F491-Y494 WeakPolarHBondContact O-CB 3.41Å; F491-Y494 PolarHBondContact O-N 3.46Å; F491-L495 PolarHBondContact O-N 2.84Å
492	I	94.4	Very high	91.2	Very high	10 Å²	10	49.3 Å²	49.3	5%	0.051	23%	0.234	C	C	.	.	H	α-helix	trans	-66.1	-43.6	171	-66.4	174.2	0	0	0	110	M368 I488 S489 P490 Y494 L495 P503 V506 M507 M510	M368-I492 HydrophobicContact CE-CD1 4.42Å; M368-I492 HydrophobicContact CG-CD1 3.37Å; M368-I492 HydrophobicContact SD-CD1 3.38Å; M368-I492 WeakPolarHBondContact SD-CD1 3.22Å; I488-I492 PolarHBondContact O-N 3.41Å; S489-I492 WeakPolarHBondContact O-CB 3.4Å; S489-I492 PolarHBondContact O-N 3.12Å; P490-I492 VanDerWaalsContact C-N 3.32Å; P490-I492 PolarHBondContact O-N 3.48Å; I492-Y494 VanDerWaalsContact C-N 3.28Å; I492-Y494 PolarHBondContact O-N 3.1Å; I492-L495 WeakPolarHBondContact O-CB 3.18Å; I492-L495 PolarHBondContact O-N 3.4Å; I492-P503 HydrophobicContact CG2-CB 4.39Å; I492-P503 WeakPolarHBondContact O-CG 3.41Å; I492-V506 HydrophobicContact CD1-CG1 4.44Å; I492-V506 HydrophobicContact CG1-CG1 4.48Å; I492-V506 HydrophobicContact CG2-CB 4.45Å; I492-V506 HydrophobicContact CG2-CG1 4.15Å; I492-M507 HydrophobicContact CG2-CG 3.96Å; I492-M510 HydrophobicContact CD1-CE 3.8Å
493	I	91.9	Very high	91.1	Very high	21 Å²	21	49.1 Å²	49.1	11%	0.108	23%	0.233	C	C	.	.	H	α-helix	trans	-66.9	-35.7	177.5	-56.7	-46.1	0	0	0	110.8	A372 L375 N376 S489 P490 L495 G496 P503 M507	A372-I493 HydrophobicContact CB-CD1 3.89Å; A372-I493 HydrophobicContact CB-CG1 4.23Å; A372-I493 WeakPolarHBondContact O-CD1 3.4Å; L375-I493 HydrophobicContact CB-CG1 4.31Å; N376-I493 HydrophobicContact CB-CD1 3.75Å; N376-I493 HydrophobicContact CB-CG1 4.34Å; S489-I493 PolarHBondContact O-N 2.89Å; P490-I493 PolarHBondContact O-N 3.43Å; I493-L495 PolarHBondContact O-N 3.42Å; I493-G496 PolarHBondContact O-N 3.09Å; I493-P503 HydrophobicContact CD1-CB 4.11Å; I493-M507 HydrophobicContact CD1-CE 4.03Å; I493-M507 HydrophobicContact CD1-SD 4.26Å
494	Y	91.6	Very high	91.2	Very high	47 Å²	47	48.5 Å²	48.5	18%	0.184	23%	0.231	C	C	.	.	H	α-helix	trans	-58.2	-28.2	174.3	-177	-110.5	0	0	0	113.8	Q151 P155 P490 F491 I492 G496 F497 Y498	Q151-Y494 HydrophobicContact CB-CE2 4.34Å; Q151-Y494 HydrophobicContact CG-CE2 3.65Å; Q151-Y494 VanDerWaalsContact CG-OH 3.22Å; Q151-Y494 WeakPolarHBondContact CG-OH 3.46Å; Q151-Y494 PolarHBondContact NE2-OH 3.28Å; Q151-Y494 VanDerWaalsContact NE2-OH 3.11Å; P155-Y494 HydrophobicContact CG-CD2 3.85Å; P155-Y494 HydrophobicContact CG-CG 3.96Å; P490-Y494 PolarHBondContact O-N 3.48Å; F491-Y494 HydrophobicContact CD1-CD1 4.46Å; F491-Y494 WeakPolarHBondContact O-CB 3.41Å; F491-Y494 PolarHBondContact O-N 3.46Å; I492-Y494 VanDerWaalsContact C-N 3.28Å; I492-Y494 PolarHBondContact O-N 3.1Å; Y494-G496 PolarHBondContact O-N 3.26Å; Y494-G496 VanDerWaalsContact O-N 3.1Å; Y494-F497 WeakPolarHBondContact O-CB 3.37Å; Y494-F497 PolarHBondContact O-N 3.16Å; Y494-F497 VanDerWaalsContact O-N 3.11Å; Y494-Y498 HydrophobicContact CE1-CE2 4.12Å
495	L	91.1	Very high	91.1	Very high	58 Å²	58	48.1 Å²	48.1	30%	0.304	23%	0.229	S	C	.	.	G	3₁₀ helix	trans	-59.6	-22.3	173.6	-63	173.6	0	0	0	113.1	F491 I492 I493 F497 Y498 F499 L502 P503 V506	F491-L495 PolarHBondContact O-N 2.84Å; I492-L495 WeakPolarHBondContact O-CB 3.18Å; I492-L495 PolarHBondContact O-N 3.4Å; I493-L495 PolarHBondContact O-N 3.42Å; L495-F497 PolarHBondContact O-N 2.88Å; L495-Y498 PolarHBondContact O-N 2.9Å; L495-Y498 VanDerWaalsContact O-N 3.14Å; L495-F499 PolarHBondContact O-N 3.05Å; L495-L502 HydrophobicContact CB-CB 3.97Å; L495-L502 HydrophobicContact CB-CD1 4.44Å; L495-P503 HydrophobicContact CB-CG 4.42Å; L495-V506 HydrophobicContact CD1-CG2 4.25Å
496	G	86	Confident	91.2	Very high	25 Å²	25	50.2 Å²	50.2	26%	0.258	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-61.5	-21.1	177	0	0	0	0	0	113.8	I493 Y494 F499 R500 P503	I493-G496 PolarHBondContact O-N 3.09Å; Y494-G496 PolarHBondContact O-N 3.26Å; Y494-G496 VanDerWaalsContact O-N 3.1Å; G496-F499 WeakPolarHBondContact CA-O 3Å; G496-F499 CarbonylContact O-C 3.56Å; G496-R500 PolarHBondContact O-N 2.8Å; G496-P503 VanDerWaalsContact CA-CG 3.45Å; G496-P503 VanDerWaalsContact N-CG 3.26Å
497	F	82.3	Confident	91.2	Very high	119 Å²	119	50.1 Å²	50.1	52%	0.522	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-65.8	-41.5	173.9	178	-97.9	0	0	0	112.4	Q151 Y494 L495	Q151-F497 VanDerWaalsContact NE2-CE1 3.26Å; Y494-F497 WeakPolarHBondContact O-CB 3.37Å; Y494-F497 PolarHBondContact O-N 3.16Å; Y494-F497 VanDerWaalsContact O-N 3.11Å; L495-F497 PolarHBondContact O-N 2.88Å
498	Y	84.9	Confident	91.1	Very high	140 Å²	140	48.6 Å²	48.6	55%	0.549	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77	-48.6	179.6	-61.7	-79.8	0	0	0	111	Y494 L495	Y494-Y498 HydrophobicContact CE1-CE2 4.12Å; L495-Y498 PolarHBondContact O-N 2.9Å; L495-Y498 VanDerWaalsContact O-N 3.14Å
499	F	84.8	Confident	91.1	Very high	146 Å²	146	48.5 Å²	48.5	64%	0.64	24%	0.236	S	C	*	.			trans	-144.1	120.1	175.3	-67.3	-80.9	0	0	0	108.9	L495 G496 A501 L502	L495-F499 PolarHBondContact O-N 3.05Å; G496-F499 WeakPolarHBondContact CA-O 3Å; G496-F499 CarbonylContact O-C 3.56Å; F499-A501 PolarHBondContact O-N 2.79Å; F499-L502 HydrophobicContact CB-CB 4.45Å; F499-L502 HydrophobicContact CB-CD1 3.77Å; F499-L502 HydrophobicContact CB-CG 3.77Å; F499-L502 HydrophobicContact CD2-CD1 3.74Å; F499-L502 HydrophobicContact CD2-CG 4.44Å; F499-L502 HydrophobicContact CG-CD1 4.22Å; F499-L502 WeakPolarHBondContact O-CB 3.12Å; F499-L502 PolarHBondContact O-N 2.88Å
500	R	82.9	Confident	91.1	Very high	77 Å²	77	50.7 Å²	50.7	29%	0.291	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.8	-29.9	-179.2	-173	171.4	-173	-176.3	7.5	114.2	D85 H381 G496 Y504	D85-R500 WeakPolarHBondContact OD2-CD 3.21Å; D85-R500 IonicContact OD2-NH1 3.75Å; H381-R500 PolarHBondContact CD2-NH2 3.29Å; H381-R500 VanDerWaalsContact CE1-CZ 3.41Å; H381-R500 PolarHBondContact CE1-NH1 3.44Å; H381-R500 PolarHBondContact CE1-NH2 3.18Å; H381-R500 PolarHBondContact ND1-NH2 3.29Å; H381-R500 VanDerWaalsContact NE2-CZ 3.31Å; H381-R500 PolarHBondContact NE2-NH1 3.02Å; H381-R500 PolarHBondContact NE2-NH2 3.16Å; G496-R500 PolarHBondContact O-N 2.8Å; R500-Y504 WeakPolarHBondContact O-CD2 3.41Å
501	A	87.9	Confident	91.2	Very high	22 Å²	22	50.4 Å²	50.4	18%	0.182	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-27.4	179.7	0	0	0	0	0	114.7	N430 F499 Y504 I505	N430-A501 VanDerWaalsContact CG-CB 3.49Å; N430-A501 WeakPolarHBondContact ND2-CA 3.24Å; N430-A501 WeakPolarHBondContact ND2-CB 3.45Å; F499-A501 PolarHBondContact O-N 2.79Å; A501-Y504 PolarHBondContact O-N 3.47Å; A501-I505 HydrophobicContact CB-CD1 3.88Å; A501-I505 WeakPolarHBondContact O-CG1 3.34Å; A501-I505 PolarHBondContact O-N 3.04Å
502	L	91.3	Very high	91.2	Very high	57 Å²	57	49 Å²	49	30%	0.298	24%	0.243	S	C	.	.	H	α-helix	trans	-60	-45.2	-168.8	-80.6	174.2	0	0	0	114.3	L495 F499 Y504 I505 V506	L495-L502 HydrophobicContact CB-CB 3.97Å; L495-L502 HydrophobicContact CB-CD1 4.44Å; F499-L502 HydrophobicContact CB-CB 4.45Å; F499-L502 HydrophobicContact CB-CD1 3.77Å; F499-L502 HydrophobicContact CB-CG 3.77Å; F499-L502 HydrophobicContact CD2-CD1 3.74Å; F499-L502 HydrophobicContact CD2-CG 4.44Å; F499-L502 HydrophobicContact CG-CD1 4.22Å; F499-L502 WeakPolarHBondContact O-CB 3.12Å; F499-L502 PolarHBondContact O-N 2.88Å; L502-Y504 VanDerWaalsContact C-N 3.3Å; L502-Y504 PolarHBondContact O-N 3.44Å; L502-I505 PolarHBondContact O-N 3.37Å; L502-V506 WeakPolarHBondContact O-CB 3.18Å; L502-V506 VanDerWaalsContact O-CG2 3.28Å; L502-V506 WeakPolarHBondContact O-CG2 3.46Å; L502-V506 PolarHBondContact O-N 3.35Å
503	P	92.6	Very high	91.2	Very high	2 Å²	2	51.7 Å²	51.7	1%	0.013	26%	0.261	C	S	.	.	H	α-helix	trans	-56.4	-45.6	178.8	-24.8	33.4	0	0	0	112.1	I492 I493 L495 G496 M507	I492-P503 HydrophobicContact CG2-CB 4.39Å; I492-P503 WeakPolarHBondContact O-CG 3.41Å; I493-P503 HydrophobicContact CD1-CB 4.11Å; L495-P503 HydrophobicContact CB-CG 4.42Å; G496-P503 VanDerWaalsContact CA-CG 3.45Å; G496-P503 VanDerWaalsContact N-CG 3.26Å; P503-M507 HydrophobicContact CB-CE 4.12Å; P503-M507 VanDerWaalsContact O-CB 3.25Å; P503-M507 WeakPolarHBondContact O-CB 3.37Å; P503-M507 VanDerWaalsContact O-CE 3.31Å; P503-M507 WeakPolarHBondContact O-CE 3.31Å; P503-M507 WeakPolarHBondContact O-CG 3.48Å; P503-M507 PolarHBondContact O-N 3.31Å
504	Y	92.4	Very high	91.3	Very high	16 Å²	16	50.7 Å²	50.7	6%	0.063	26%	0.256	C	S	.	.	H	α-helix	trans	-66.8	-42.6	-179.3	-58.9	-82.8	0	0	0	112.3	N376 I426 V429 R500 A501 L502 M507 G508	N376-Y504 WeakPolarHBondContact ND2-CE1 3.12Å; N376-Y504 VanDerWaalsContact ND2-CZ 3.33Å; N376-Y504 PolarHBondContact ND2-OH 2.84Å; I426-Y504 HydrophobicContact CG2-CD1 4.05Å; V429-Y504 HydrophobicContact CB-CD1 4.08Å; V429-Y504 HydrophobicContact CB-CE1 4.24Å; V429-Y504 HydrophobicContact CG1-CD1 4.08Å; V429-Y504 HydrophobicContact CG1-CE1 3.74Å; R500-Y504 WeakPolarHBondContact O-CD2 3.41Å; A501-Y504 PolarHBondContact O-N 3.47Å; L502-Y504 VanDerWaalsContact C-N 3.3Å; L502-Y504 PolarHBondContact O-N 3.44Å; Y504-M507 HydrophobicContact CD1-CE 4.28Å; Y504-G508 PolarHBondContact O-N 3.27Å
505	I	94	Very high	91.4	Very high	74 Å²	74	48.6 Å²	48.6	38%	0.379	25%	0.248	S	C	.	.	H	α-helix	trans	-62.8	-49.5	176.7	-66.3	167.7	0	0	0	110.3	A501 L502 G508 V509	A501-I505 HydrophobicContact CB-CD1 3.88Å; A501-I505 WeakPolarHBondContact O-CG1 3.34Å; A501-I505 PolarHBondContact O-N 3.04Å; L502-I505 PolarHBondContact O-N 3.37Å; I505-G508 PolarHBondContact O-N 2.96Å; I505-V509 HydrophobicContact CG2-CG2 4.17Å; I505-V509 VanDerWaalsContact O-CB 3.31Å; I505-V509 WeakPolarHBondContact O-CB 3.2Å; I505-V509 VanDerWaalsContact O-CG2 3.23Å; I505-V509 WeakPolarHBondContact O-CG2 3.32Å; I505-V509 PolarHBondContact O-N 3.42Å
506	V	95.1	Very high	91.4	Very high	43 Å²	43	47.5 Å²	47.5	26%	0.261	25%	0.251	S	S	.	.	H	α-helix	trans	-61.9	-50.4	-178.7	169.3	0	0	0	0	110.5	I492 L495 L502 G508 M510	I492-V506 HydrophobicContact CD1-CG1 4.44Å; I492-V506 HydrophobicContact CG1-CG1 4.48Å; I492-V506 HydrophobicContact CG2-CB 4.45Å; I492-V506 HydrophobicContact CG2-CG1 4.15Å; L495-V506 HydrophobicContact CD1-CG2 4.25Å; L502-V506 WeakPolarHBondContact O-CB 3.18Å; L502-V506 VanDerWaalsContact O-CG2 3.28Å; L502-V506 WeakPolarHBondContact O-CG2 3.46Å; L502-V506 PolarHBondContact O-N 3.35Å; V506-G508 PolarHBondContact O-N 3.21Å; V506-M510 HydrophobicContact CG1-CE 3.58Å; V506-M510 HydrophobicContact CG1-SD 4.21Å; V506-M510 WeakPolarHBondContact O-CB 3.4Å; V506-M510 WeakPolarHBondContact O-CE 3.32Å; V506-M510 VanDerWaalsContact O-CG 3.25Å; V506-M510 WeakPolarHBondContact O-CG 3.27Å; V506-M510 PolarHBondContact O-N 3.22Å; V506-M510 VanDerWaalsContact O-N 3.09Å
507	M	94.8	Very high	91.6	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-55	-53.5	175.8	-78.1	-171.4	-70.1	0	0	111.7	N369 A372 L373 I426 I492 I493 P503 Y504 M510 A511	N369-M507 VanDerWaalsContact OD1-C 3.24Å; N369-M507 VanDerWaalsContact OD1-CA 3.24Å; N369-M507 WeakPolarHBondContact OD1-CA 3.48Å; N369-M507 WeakPolarHBondContact OD1-CB 3.38Å; N369-M507 PolarHBondContact OD1-O 2.69Å; A372-M507 HydrophobicContact CB-CG 4.18Å; A372-M507 HydrophobicContact CB-SD 3.41Å; A372-M507 WeakPolarHBondContact CB-SD 2.96Å; L373-M507 HydrophobicContact CD2-CE 4.38Å; L373-M507 HydrophobicContact CD2-SD 4.2Å; L373-M507 HydrophobicContact CG-SD 4.24Å; I426-M507 HydrophobicContact CG2-CB 4.11Å; I426-M507 HydrophobicContact CG2-CE 4.39Å; I492-M507 HydrophobicContact CG2-CG 3.96Å; I493-M507 HydrophobicContact CD1-CE 4.03Å; I493-M507 HydrophobicContact CD1-SD 4.26Å; P503-M507 HydrophobicContact CB-CE 4.12Å; P503-M507 VanDerWaalsContact O-CB 3.25Å; P503-M507 WeakPolarHBondContact O-CB 3.37Å; P503-M507 VanDerWaalsContact O-CE 3.31Å; P503-M507 WeakPolarHBondContact O-CE 3.31Å; P503-M507 WeakPolarHBondContact O-CG 3.48Å; P503-M507 PolarHBondContact O-N 3.31Å; Y504-M507 HydrophobicContact CD1-CE 4.28Å; M507-M510 PolarHBondContact O-N 3.26Å; M507-A511 PolarHBondContact O-N 2.98Å
508	G	95.1	Very high	91.9	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-65.4	-44.6	-175.7	0	0	0	0	0	114.1	Y504 I505 V506 M510 A511 V512	Y504-G508 PolarHBondContact O-N 3.27Å; I505-G508 PolarHBondContact O-N 2.96Å; V506-G508 PolarHBondContact O-N 3.21Å; G508-M510 PolarHBondContact O-N 3.27Å; G508-A511 PolarHBondContact O-N 3.42Å; G508-V512 WeakPolarHBondContact O-CG2 3.31Å; G508-V512 PolarHBondContact O-N 2.96Å
509	V	95.6	Very high	92	Very high	74 Å²	74	42.2 Å²	42.2	45%	0.448	22%	0.224	S	C	.	.	H	α-helix	trans	-61.5	-44.9	176.9	170.2	0	0	0	0	110.4	I505 A511 V512 C513	I505-V509 HydrophobicContact CG2-CG2 4.17Å; I505-V509 VanDerWaalsContact O-CB 3.31Å; I505-V509 WeakPolarHBondContact O-CB 3.2Å; I505-V509 VanDerWaalsContact O-CG2 3.23Å; I505-V509 WeakPolarHBondContact O-CG2 3.32Å; I505-V509 PolarHBondContact O-N 3.42Å; V509-A511 VanDerWaalsContact C-N 3.33Å; V509-A511 PolarHBondContact O-N 2.91Å; V509-V512 PolarHBondContact O-N 3.49Å; V509-C513 WeakPolarHBondContact O-CB 3.33Å; V509-C513 PolarHBondContact O-N 3.41Å; V509-C513 PolarHBondContact O-SG 3.42Å
510	M	95.5	Very high	92.1	Very high	46 Å²	46	38.5 Å²	38.5	23%	0.227	21%	0.21	C	C	.	.	H	α-helix	trans	-62.9	-39.6	177.2	-70.5	-173.2	-56.3	0	0	112.4	I365 M368 I492 V506 M507 G508 C513 G514	I365-M510 HydrophobicContact CG2-CB 4.32Å; I365-M510 WeakPolarHBondContact CG2-O 2.95Å; M368-M510 HydrophobicContact CE-CE 3.32Å; M368-M510 HydrophobicContact CE-SD 3.31Å; M368-M510 WeakPolarHBondContact CE-SD 3.34Å; M368-M510 HydrophobicContact SD-CE 4.07Å; M368-M510 HydrophobicContact SD-SD 4.4Å; I492-M510 HydrophobicContact CD1-CE 3.8Å; V506-M510 HydrophobicContact CG1-CE 3.58Å; V506-M510 HydrophobicContact CG1-SD 4.21Å; V506-M510 WeakPolarHBondContact O-CB 3.4Å; V506-M510 WeakPolarHBondContact O-CE 3.32Å; V506-M510 VanDerWaalsContact O-CG 3.25Å; V506-M510 WeakPolarHBondContact O-CG 3.27Å; V506-M510 PolarHBondContact O-N 3.22Å; V506-M510 VanDerWaalsContact O-N 3.09Å; M507-M510 PolarHBondContact O-N 3.26Å; G508-M510 PolarHBondContact O-N 3.27Å; M510-C513 PolarHBondContact O-N 3.15Å; M510-G514 PolarHBondContact O-N 3.26Å
511	A	96	Very high	92.3	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-63.7	-43.1	175.8	0	0	0	0	0	112	I451 M507 G508 V509 G514 S515	I451-A511 HydrophobicContact CD1-CB 4.04Å; M507-A511 PolarHBondContact O-N 2.98Å; G508-A511 PolarHBondContact O-N 3.42Å; V509-A511 VanDerWaalsContact C-N 3.33Å; V509-A511 PolarHBondContact O-N 2.91Å; A511-G514 PolarHBondContact O-N 3.36Å; A511-S515 PolarHBondContact O-N 2.93Å
512	V	95.9	Very high	92.2	Very high	53 Å²	53	34.6 Å²	34.6	32%	0.321	19%	0.192	S	C	.	.	H	α-helix	trans	-64.6	-42.5	175.2	173.4	0	0	0	0	111.4	L420 I424 G508 V509 G514 S515 G516	L420-V512 HydrophobicContact CD2-CG1 4.14Å; L420-V512 HydrophobicContact CD2-CG2 4.35Å; I424-V512 HydrophobicContact CG1-CG2 4.45Å; G508-V512 WeakPolarHBondContact O-CG2 3.31Å; G508-V512 PolarHBondContact O-N 2.96Å; V509-V512 PolarHBondContact O-N 3.49Å; V512-G514 VanDerWaalsContact C-N 3.31Å; V512-G514 PolarHBondContact O-N 3.27Å; V512-S515 WeakPolarHBondContact O-CB 3.45Å; V512-S515 PolarHBondContact O-N 2.88Å; V512-G516 PolarHBondContact O-N 3.05Å
513	C	94.4	Very high	92	Very high	65 Å²	65	33.3 Å²	33.3	44%	0.439	19%	0.185	S	C	.	.	H	α-helix	trans	-61	-40.9	173.2	-69.1	0	0	0	0	111.8	V509 M510 S515 G516 F517	V509-C513 WeakPolarHBondContact O-CB 3.33Å; V509-C513 PolarHBondContact O-N 3.41Å; V509-C513 PolarHBondContact O-SG 3.42Å; M510-C513 PolarHBondContact O-N 3.15Å; C513-S515 VanDerWaalsContact C-N 3.32Å; C513-S515 PolarHBondContact O-N 2.94Å; C513-G516 WeakPolarHBondContact O-CA 3.42Å; C513-G516 PolarHBondContact O-N 3.21Å; C513-F517 PolarHBondContact O-N 2.98Å
514	G	93.7	Very high	91.5	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-60.4	-38.7	174.3	0	0	0	0	0	112.8	L362 M510 A511 V512 G516 F517 C518	L362-G514 WeakPolarHBondContact CD2-O 3.47Å; M510-G514 PolarHBondContact O-N 3.26Å; A511-G514 PolarHBondContact O-N 3.36Å; V512-G514 VanDerWaalsContact C-N 3.31Å; V512-G514 PolarHBondContact O-N 3.27Å; G514-G516 VanDerWaalsContact C-N 3.27Å; G514-G516 PolarHBondContact O-N 3.38Å; G514-F517 PolarHBondContact O-N 3.28Å; G514-C518 PolarHBondContact O-N 3.41Å; G514-C518 PolarHBondContact O-SG 3.26Å
515	S	94.3	Very high	91	Very high	3 Å²	3	36.2 Å²	36.2	2%	0.021	20%	0.199	C	C	.	.	H	α-helix	trans	-58.3	-40.4	171.2	161.2	0	0	0	0	112.1	S416 L420 A511 V512 C513 F517 C518 F519	S416-S515 PolarHBondContact O-OG 3.47Å; S416-S515 PolarHBondContact OG-O 3.43Å; S416-S515 PolarHBondContact OG-OG 3.29Å; L420-S515 WeakPolarHBondContact CD1-OG 3.37Å; L420-S515 WeakPolarHBondContact CG-OG 3.36Å; A511-S515 PolarHBondContact O-N 2.93Å; V512-S515 WeakPolarHBondContact O-CB 3.45Å; V512-S515 PolarHBondContact O-N 2.88Å; C513-S515 VanDerWaalsContact C-N 3.32Å; C513-S515 PolarHBondContact O-N 2.94Å; S515-F517 PolarHBondContact O-N 2.62Å; S515-C518 VanDerWaalsContact O-CB 3.31Å; S515-C518 WeakPolarHBondContact O-CB 3.42Å; S515-C518 PolarHBondContact O-N 3.4Å; S515-F519 WeakPolarHBondContact O-CD2 3.47Å
516	G	90.4	Very high	90	Very high	35 Å²	35	36.5 Å²	36.5	36%	0.361	22%	0.22	S	C	.	.	H	α-helix	trans	-57	-46.9	173.8	0	0	0	0	0	112.9	V512 C513 G514 C518 F519	V512-G516 PolarHBondContact O-N 3.05Å; C513-G516 WeakPolarHBondContact O-CA 3.42Å; C513-G516 PolarHBondContact O-N 3.21Å; G514-G516 VanDerWaalsContact C-N 3.27Å; G514-G516 PolarHBondContact O-N 3.38Å; G516-C518 PolarHBondContact O-N 3.15Å; G516-F519 PolarHBondContact O-N 3.21Å; G516-F519 VanDerWaalsContact O-N 3.11Å
517	F	89.1	Confident	89.2	Confident	74 Å²	74	39.7 Å²	39.7	33%	0.325	23%	0.23	S	C	.	.	H	α-helix	trans	-60.4	-31	177.8	-62.1	-21.1	0	0	0	113	L358 L362 I365 C513 G514 S515 F519 M520	L358-F517 HydrophobicContact CD2-CB 4.34Å; L358-F517 HydrophobicContact CD2-CG 4.38Å; L362-F517 HydrophobicContact CD2-CB 4.1Å; L362-F517 HydrophobicContact CG-CB 4.43Å; I365-F517 HydrophobicContact CD1-CD2 4.22Å; I365-F517 HydrophobicContact CD1-CE2 4.01Å; C513-F517 PolarHBondContact O-N 2.98Å; G514-F517 PolarHBondContact O-N 3.28Å; S515-F517 PolarHBondContact O-N 2.62Å; F517-F519 PolarHBondContact O-N 2.86Å; F517-M520 PolarHBondContact O-N 3.42Å
518	C	88.7	Confident	88.3	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-61.7	-31.1	177.8	-62.3	0	0	0	0	112.3	R412 Q415 G514 S515 G516 M520 L521	R412-C518 WeakPolarHBondContact CD-O 3.17Å; R412-C518 WeakPolarHBondContact CG-O 3.32Å; Q415-C518 WeakPolarHBondContact CG-SG 3.27Å; G514-C518 PolarHBondContact O-N 3.41Å; G514-C518 PolarHBondContact O-SG 3.26Å; S515-C518 VanDerWaalsContact O-CB 3.31Å; S515-C518 WeakPolarHBondContact O-CB 3.42Å; S515-C518 PolarHBondContact O-N 3.4Å; G516-C518 PolarHBondContact O-N 3.15Å; C518-M520 VanDerWaalsContact C-N 3.27Å; C518-M520 PolarHBondContact O-N 3.41Å; C518-L521 PolarHBondContact O-N 3.47Å
519	F	87.1	Confident	87.4	Confident	100 Å²	100	48.6 Å²	48.6	44%	0.439	29%	0.291	S	S	.	.	H	α-helix	trans	-70.4	-22.7	179.5	-71.3	-74.6	0	0	0	113.9	L413 S416 S515 G516 F517 L521	L413-F519 HydrophobicContact CD2-CE1 4.23Å; S416-F519 VanDerWaalsContact OG-CE2 3.22Å; S416-F519 WeakPolarHBondContact OG-CE2 3.46Å; S416-F519 WeakPolarHBondContact OG-CZ 2.98Å; S515-F519 WeakPolarHBondContact O-CD2 3.47Å; G516-F519 PolarHBondContact O-N 3.21Å; G516-F519 VanDerWaalsContact O-N 3.11Å; F517-F519 PolarHBondContact O-N 2.86Å; F519-L521 VanDerWaalsContact C-N 3.33Å
520	M	87.1	Confident	86.4	Confident	68 Å²	68	45.5 Å²	45.5	34%	0.335	27%	0.272	S	S	.	.	H	α-helix	trans	-76.1	-25.1	175.4	-57.9	-175.9	77.3	0	0	112.1	L358 F517 C518 L539 R540	L358-M520 HydrophobicContact CD1-CB 3.99Å; L358-M520 HydrophobicContact CD2-SD 4.37Å; F517-M520 PolarHBondContact O-N 3.42Å; C518-M520 VanDerWaalsContact C-N 3.27Å; C518-M520 PolarHBondContact O-N 3.41Å; M520-L539 WeakPolarHBondContact O-CD2 3.43Å; M520-R540 PolarHBondContact O-N 3.03Å
521	L	87.4	Confident	85.2	Confident	1 Å²	1	49.9 Å²	49.9	1%	0.005	29%	0.292	C	S	.	.	S	Bend	trans	-76.2	145.1	178.6	-65.7	174.3	0	0	0	111.5	T355 L358 L362 R412 F461 L465 C518 F519 L539	T355-L521 HydrophobicContact CG2-CD2 4.16Å; L358-L521 HydrophobicContact CB-CD2 4.02Å; L358-L521 HydrophobicContact CD1-CD2 4.05Å; L362-L521 HydrophobicContact CD1-CD1 3.53Å; R412-L521 WeakPolarHBondContact CD-O 3.19Å; F461-L521 HydrophobicContact CD1-CD1 4.48Å; F461-L521 HydrophobicContact CE1-CB 4.02Å; F461-L521 HydrophobicContact CE1-CD1 3.58Å; F461-L521 HydrophobicContact CE1-CG 4.45Å; F461-L521 HydrophobicContact CZ-CB 3.79Å; F461-L521 HydrophobicContact CZ-CD1 4.2Å; L465-L521 HydrophobicContact CD2-CD2 4.24Å; C518-L521 PolarHBondContact O-N 3.47Å; F519-L521 VanDerWaalsContact C-N 3.33Å; L521-L539 HydrophobicContact CD2-CD2 3.94Å
522	P	86.1	Confident	84.1	Confident	15 Å²	15	51.6 Å²	51.6	10%	0.097	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-69.9	154.5	177	30.3	-36.8	0	0	0	112	F461 L465 Q537	F461-P522 WeakPolarHBondContact CE2-O 3.48Å; F461-P522 WeakPolarHBondContact CZ-O 3.21Å; L465-P522 HydrophobicContact CD1-CG 3.74Å; P522-Q537 HydrophobicContact CB-CB 3.76Å; P522-Q537 HydrophobicContact CG-CB 3.9Å
523	E	86.6	Confident	83	Confident	31 Å²	31	52.9 Å²	52.9	15%	0.145	31%	0.311	C	S	.	.	P	Polyproline II helix	trans	-80.7	128.9	175.2	179.7	57.2	-119	0	0	110.8	S410 R411 R412 H525 K527 Q537	S410-E523 VanDerWaalsContact CB-OE2 3.32Å; S410-E523 WeakPolarHBondContact CB-OE2 3.08Å; R411-E523 PolarHBondContact N-OE1 3.24Å; R412-E523 WeakPolarHBondContact CB-OE2 3.11Å; R412-E523 PolarHBondContact N-OE2 3.2Å; R412-E523 IonicContact NE-OE2 2.73Å; E523-H525 WeakPolarHBondContact OE1-CB 3.49Å; E523-H525 HydrophobicContact CG-CB 4.46Å; E523-H525 PolarHBondContact OE1-N 2.83Å; E523-K527 WeakPolarHBondContact O-CD 3.35Å; E523-K527 VanDerWaalsContact O-CE 3.24Å; E523-K527 WeakPolarHBondContact O-CE 3.36Å; E523-K527 PolarHBondContact O-NZ 2.74Å; E523-Q537 PolarHBondContact O-OE1 3.27Å
524	T	83.3	Confident	81.7	Confident	8 Å²	8	54.5 Å²	54.5	5%	0.049	32%	0.323	C	S	.	.			trans	-105	-14.5	-177.9	56.9	0	0	0	0	113.9	R411 F461 E464 L465 G526 K527	R411-T524 WeakPolarHBondContact CG-OG1 3.3Å; F461-T524 HydrophobicContact CD2-CG2 4.14Å; F461-T524 WeakPolarHBondContact CD2-OG1 3.48Å; F461-T524 HydrophobicContact CE2-CG2 3.88Å; E464-T524 HydrophobicContact CB-CG2 3.94Å; E464-T524 VanDerWaalsContact OE2-CB 3.24Å; E464-T524 WeakPolarHBondContact OE2-CB 3.29Å; E464-T524 PolarHBondContact OE2-OG1 3.23Å; L465-T524 HydrophobicContact CD1-CG2 4.35Å; T524-G526 PolarHBondContact O-N 3.36Å; T524-K527 PolarHBondContact O-N 3.15Å
525	H	80.8	Confident	80.5	Confident	71 Å²	71	58.7 Å²	58.7	33%	0.329	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	128	-176.7	-178.8	-90.5	0	0	0	113	S409 R411 E523 K527	S409-H525 PolarHBondContact O-CD2 2.87Å; R411-H525 HydrophobicContact CG-CB 4.36Å; E523-H525 WeakPolarHBondContact OE1-CB 3.49Å; E523-H525 HydrophobicContact CG-CB 4.46Å; E523-H525 PolarHBondContact OE1-N 2.83Å; H525-K527 PolarHBondContact O-N 2.76Å
526	G	73.6	Confident	79.7	Confident	80 Å²	80	59.3 Å²	59.3	83%	0.825	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.1	10.1	177	0	0	0	0	0	114.8	T524	T524-G526 PolarHBondContact O-N 3.36Å
527	K	78.1	Confident	78.8	Confident	109 Å²	109	59.9 Å²	59.9	47%	0.474	34%	0.342	S	S	.	.	S	Bend	trans	-102.3	152	177.3	-62.9	-177.9	-176.4	171.6	0	110.9	E523 T524 H525	E523-K527 WeakPolarHBondContact O-CD 3.35Å; E523-K527 VanDerWaalsContact O-CE 3.24Å; E523-K527 WeakPolarHBondContact O-CE 3.36Å; E523-K527 PolarHBondContact O-NZ 2.74Å; T524-K527 PolarHBondContact O-N 3.15Å; H525-K527 PolarHBondContact O-N 2.76Å
528	A	75.9	Confident	78.2	Confident	94 Å²	94	62.5 Å²	62.5	78%	0.777	36%	0.355	S	S	*	.	P	Polyproline II helix	trans	-62.4	143.1	174	0	0	0	0	0	110.4
529	L	75.7	Confident	77.4	Confident	93 Å²	93	63.2 Å²	63.2	49%	0.487	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-65.5	129.4	175.5	-73.6	165.7	0	0	0	108.7	E464 E531	E464-L529 HydrophobicContact CB-CD2 4.22Å; E464-L529 HydrophobicContact CG-CD2 4.04Å; L529-E531 PolarHBondContact O-N 3.2Å
530	P	74.6	Confident	76.1	Confident	9 Å²	9	67.3 Å²	67.3	6%	0.058	37%	0.371	C	S	.	.	P	Polyproline II helix	trans	-65	129.3	177.5	24.8	-30.3	0	0	0	109.2	E464 P467 T468 D535	E464-P530 WeakPolarHBondContact O-CD 3.44Å; P467-P530 WeakPolarHBondContact CA-O 3.28Å; P467-P530 HydrophobicContact CB-CB 4.06Å; P467-P530 HydrophobicContact CB-CG 4.38Å; T468-P530 PolarHBondContact N-O 3.4Å; T468-P530 VanDerWaalsContact N-O 3.13Å; P530-D535 HydrophobicContact CB-CB 4.03Å
531	E	71.5	Confident	74.6	Confident	138 Å²	138	66.3 Å²	66.3	65%	0.645	38%	0.378	S	S	*	.			trans	-97.9	-45	178.1	-67.3	-171.6	174.1	0	0	110.1	T468 V469 L529	T468-E531 PolarHBondContact OG1-O 2.9Å; T468-E531 VanDerWaalsContact OG1-O 3.09Å; V469-E531 WeakPolarHBondContact CG2-O 3.28Å; L529-E531 PolarHBondContact O-N 3.2Å
532	A	72.6	Confident	72.7	Confident	37 Å²	37	72 Å²	72	31%	0.306	41%	0.408	S	S	.	.	S	Bend	trans	-103.7	165.4	177.5	0	0	0	0	0	113.1	P467 S534 D535	P467-A532 WeakPolarHBondContact CB-O 3.13Å; A532-S534 PolarHBondContact O-N 3.26Å; A532-D535 PolarHBondContact O-N 3.49Å; A532-D535 VanDerWaalsContact O-N 3.16Å; A532-D535 PolarHBondContact N-OD2 3.38Å
533	L	71.6	Confident	70.9	Confident	79 Å²	79	72.7 Å²	72.7	41%	0.414	41%	0.413	S	S	.	.	G	3₁₀ helix	trans	-61.4	-30	175.6	-73	154.8	0	0	0	112.6	V345 I352 I470 D535	V345-L533 HydrophobicContact CG1-CD1 4.4Å; I352-L533 HydrophobicContact CD1-CD2 3.27Å; I470-L533 HydrophobicContact CD1-CD2 3.9Å; I470-L533 HydrophobicContact CG2-CD2 4.22Å; L533-D535 VanDerWaalsContact C-N 3.27Å; L533-D535 PolarHBondContact O-N 3.18Å
534	S	68.3	Low	69.1	Low	100 Å²	100	73.6 Å²	73.6	70%	0.699	42%	0.421	S	S	*	.	G	3₁₀ helix	trans	-65.6	-29	176.2	47	0	0	0	0	113.2	A532 M536	A532-S534 PolarHBondContact O-N 3.26Å; S534-M536 PolarHBondContact O-N 3.12Å
535	D	68.5	Low	67.4	Low	87 Å²	87	77.6 Å²	77.6	47%	0.465	44%	0.442	S	S	.	.	G	3₁₀ helix	trans	-88	-1	-170.5	-47.3	-22	0	0	0	111.6	P530 A532 L533 Q537	P530-D535 HydrophobicContact CB-CB 4.03Å; A532-D535 PolarHBondContact O-N 3.49Å; A532-D535 VanDerWaalsContact O-N 3.16Å; A532-D535 PolarHBondContact N-OD2 3.38Å; L533-D535 VanDerWaalsContact C-N 3.27Å; L533-D535 PolarHBondContact O-N 3.18Å; D535-Q537 PolarHBondContact O-N 3.17Å
536	M	76.2	Confident	65.9	Low	17 Å²	17	81.3 Å²	81.3	8%	0.084	46%	0.457	C	S	.	.	P	Polyproline II helix	trans	-68.9	129.1	-178.7	-167.2	-178.5	-172.7	0	0	110.9	I352 T355 F466 S534	I352-M536 HydrophobicContact CB-SD 4.34Å; I352-M536 HydrophobicContact CG1-SD 3.55Å; I352-M536 VanDerWaalsContact CG1-SD 3.55Å; T355-M536 HydrophobicContact CG2-CE 3.54Å; F466-M536 HydrophobicContact CD1-CE 4.13Å; F466-M536 HydrophobicContact CE1-CE 4.13Å; S534-M536 PolarHBondContact O-N 3.12Å
537	Q	72.8	Confident	64.5	Low	46 Å²	46	83.3 Å²	83.3	22%	0.215	44%	0.443	C	S	.	.	P	Polyproline II helix	trans	-65.5	139.4	178.3	-65.2	176.3	32	0	0	111.2	N351 P522 E523 D535	N351-Q537 PolarHBondContact ND2-O 3.46Å; P522-Q537 HydrophobicContact CB-CB 3.76Å; P522-Q537 HydrophobicContact CG-CB 3.9Å; E523-Q537 PolarHBondContact O-OE1 3.27Å; D535-Q537 PolarHBondContact O-N 3.17Å
538	Q	75	Confident	62.9	Low	129 Å²	129	84.6 Å²	84.6	60%	0.603	45%	0.449	S	S	*	.	P	Polyproline II helix	trans	-78.5	141.3	179.9	-65	-176.6	0.3	0	0	111.3
539	L	73	Confident	61.6	Low	16 Å²	16	85.6 Å²	85.6	8%	0.084	44%	0.437	C	S	.	.	P	Polyproline II helix	trans	-64.8	149.9	173.7	-71.7	164	0	0	0	112.1	N351 T354 T355 L358 M520 L521 G541	N351-L539 WeakPolarHBondContact OD1-CG 3.46Å; N351-L539 PolarHBondContact OD1-N 3.42Å; T354-L539 VanDerWaalsContact CB-CD1 3.43Å; T354-L539 HydrophobicContact CG2-CD1 3.48Å; T354-L539 VanDerWaalsContact CG2-CD1 3.48Å; T355-L539 WeakPolarHBondContact OG1-CD1 3.37Å; T355-L539 WeakPolarHBondContact OG1-CG 3.49Å; L358-L539 HydrophobicContact CD1-CD2 4.07Å; M520-L539 WeakPolarHBondContact O-CD2 3.43Å; L521-L539 HydrophobicContact CD2-CD2 3.94Å; L539-G541 PolarHBondContact O-N 3.06Å
540	R	59.7	Low	60.3	Low	186 Å²	186	83.3 Å²	83.3	70%	0.702	43%	0.432	S	S	*	.	S	Bend	trans	-81	111.8	172.7	-126	179.9	-178.5	-170.7	-1.4	108.9	M520	M520-R540 PolarHBondContact O-N 3.03Å
541	G	54.5	Low	59	Low	46 Å²	46	87.9 Å²	87.9	47%	0.474	45%	0.453	S	S	.	.	S	Bend	trans	124.9	-36.2	155.6	0	0	0	0	0	119.3	L539	L539-G541 PolarHBondContact O-N 3.06Å
542	N	48.9	Very low	57.8	Low	121 Å²	121	87.9 Å²	87.9	65%	0.647	45%	0.452	S	S	*	.	S	Bend	trans	-117	-42.3	-166.4	-79.1	-0.5	0	0	0	117.2
543	C	47.6	Very low	56.6	Low	30 Å²	30	93.4 Å²	93.4	20%	0.203	47%	0.472	C	S	.	.	H	α-helix	trans	-86.1	-8.1	179.1	-47.4	0	0	0	0	112.7	C350 K547	C350-C543 HydrophobicContact CB-CB 4.26Å; C350-C543 WeakPolarHBondContact CB-SG 3.42Å; C350-C543 WeakPolarHBondContact SG-CB 3.24Å; C350-C543 CovalentContact SG-SG 2.1Å; C350-C543 PolarHBondContact SG-SG 3.24Å; C543-K547 PolarHBondContact O-N 3.05Å
544	V	49.3	Very low	55.5	Low	49 Å²	49	97.7 Å²	97.7	30%	0.297	49%	0.49	S	S	.	.	H	α-helix	trans	-69.1	-38.4	175.6	177.3	0	0	0	0	111.1	K548	V544-K548 HydrophobicContact CG1-CD 4.24Å; V544-K548 WeakPolarHBondContact O-CB 3.44Å; V544-K548 WeakPolarHBondContact O-CG 3.36Å; V544-K548 PolarHBondContact O-N 3.38Å
545	N	47.7	Very low	54.3	Low	93 Å²	93	99.5 Å²	99.5	50%	0.497	49%	0.492	S	S	.	.	H	α-helix	trans	-70.6	-42	179.1	-73.7	-1.2	0	0	0	111.5	K547 K548 E549	N545-K547 PolarHBondContact O-N 3.12Å; N545-K547 VanDerWaalsContact C-N 3.33Å; N545-K548 CarbonylContact O-C 3.24Å; N545-K548 PolarHBondContact O-N 3.43Å; N545-E549 WeakPolarHBondContact O-CB 3.45Å; N545-E549 VanDerWaalsContact O-CG 3.26Å; N545-E549 WeakPolarHBondContact O-CG 3.25Å; N545-E549 PolarHBondContact O-N 3.28Å
546	K	48.5	Very low	53	Low	149 Å²	149	103.4 Å²	103.4	65%	0.648	52%	0.519	S	S	*	.	H	α-helix	trans	-63.4	-34.4	175.8	-83.4	-169.6	172.8	-173.3	0	114.1	A550	K546-A550 VanDerWaalsContact O-CB 3.3Å; K546-A550 WeakPolarHBondContact O-CB 3.13Å; K546-A550 PolarHBondContact O-N 3.26Å
547	K	44.2	Very low	51.9	Low	122 Å²	122	107.7 Å²	107.7	53%	0.53	54%	0.54	S	S	.	.	H	α-helix	trans	-74.7	-37.6	177.3	-147.3	-178.1	-177	-164.5	0	111.4	C543 N545 E551	C543-K547 PolarHBondContact O-N 3.05Å; N545-K547 PolarHBondContact O-N 3.12Å; N545-K547 VanDerWaalsContact C-N 3.33Å; K547-E551 PolarHBondContact O-N 3.2Å; K547-E551 WeakPolarHBondContact O-CG 3.37Å; K547-E551 WeakPolarHBondContact O-CB 3.32Å; K547-E551 VanDerWaalsContact O-CB 3.28Å; K547-E551 VanDerWaalsContact O-CG 3.29Å
548	K	45.5	Very low	50.8	Low	135 Å²	135	110.9 Å²	110.9	59%	0.587	56%	0.557	S	S	*	*	H	α-helix	trans	-67.6	-34.9	171.5	-75.6	-176.2	174.9	-171.2	0	113	V544 N545 H552	V544-K548 HydrophobicContact CG1-CD 4.24Å; V544-K548 WeakPolarHBondContact O-CB 3.44Å; V544-K548 WeakPolarHBondContact O-CG 3.36Å; V544-K548 PolarHBondContact O-N 3.38Å; N545-K548 CarbonylContact O-C 3.24Å; N545-K548 PolarHBondContact O-N 3.43Å; K548-H552 WeakPolarHBondContact O-CB 3.39Å; K548-H552 PolarHBondContact O-N 3.04Å
549	E	47.4	Very low	49.4	Very low	115 Å²	115	109.9 Å²	109.9	54%	0.537	56%	0.555	S	S	.	*	H	α-helix	trans	-70.1	-44.5	174.9	-76.5	165	173.7	0	0	111	N545 H552 E553	N545-E549 WeakPolarHBondContact O-CB 3.45Å; N545-E549 VanDerWaalsContact O-CG 3.26Å; N545-E549 WeakPolarHBondContact O-CG 3.25Å; N545-E549 PolarHBondContact O-N 3.28Å; E549-H552 PolarHBondContact O-N 3.36Å; E549-H552 VanDerWaalsContact O-N 3.14Å; E549-E553 PolarHBondContact O-N 3.36Å
550	A	48.9	Very low	48	Very low	46 Å²	46	115.5 Å²	115.5	38%	0.38	58%	0.583	S	S	.	*	H	α-helix	trans	-66.3	-39.3	175.5	0	0	0	0	0	113	K546 H552 E553 E554	K546-A550 VanDerWaalsContact O-CB 3.3Å; K546-A550 WeakPolarHBondContact O-CB 3.13Å; K546-A550 PolarHBondContact O-N 3.26Å; A550-H552 PolarHBondContact O-N 3.17Å; A550-E553 PolarHBondContact O-N 3.24Å; A550-E554 PolarHBondContact O-N 2.8Å
551	E	48.3	Very low	47.3	Very low	104 Å²	104	111.1 Å²	111.1	49%	0.486	58%	0.575	S	S	.	*	H	α-helix	trans	-70.4	-18.7	172.9	-74.9	170.9	-171.2	0	0	112.4	K547 N555	K547-E551 PolarHBondContact O-N 3.2Å; K547-E551 WeakPolarHBondContact O-CG 3.37Å; K547-E551 WeakPolarHBondContact O-CB 3.32Å; K547-E551 VanDerWaalsContact O-CB 3.28Å; K547-E551 VanDerWaalsContact O-CG 3.29Å; E551-N555 WeakPolarHBondContact O-CB 3.5Å; E551-N555 PolarHBondContact O-ND2 2.94Å
552	H	44.6	Very low	46.8	Very low	138 Å²	138	115.4 Å²	115.4	64%	0.639	58%	0.582	S	S	*	*	H	α-helix	trans	-83	-39.6	172.1	-132	-12	0	0	0	111.7	K548 E549 A550 N555 T556	K548-H552 WeakPolarHBondContact O-CB 3.39Å; K548-H552 PolarHBondContact O-N 3.04Å; E549-H552 PolarHBondContact O-N 3.36Å; E549-H552 VanDerWaalsContact O-N 3.14Å; A550-H552 PolarHBondContact O-N 3.17Å; H552-N555 PolarHBondContact O-N 3.09Å; H552-T556 PolarHBondContact O-N 3.19Å; H552-T556 PolarHBondContact O-OG1 2.89Å
553	E	49	Very low	46.7	Very low	154 Å²	154	115 Å²	115	72%	0.72	58%	0.577	S	S	*	*	H	α-helix	trans	-69.3	-27.9	175.7	-76.9	-179.2	161.8	0	0	113.5	E549 A550 N555	E549-E553 PolarHBondContact O-N 3.36Å; A550-E553 PolarHBondContact O-N 3.24Å; E553-N555 VanDerWaalsContact C-N 3.34Å
554	E	46.8	Very low	46.6	Very low	169 Å²	169	121.5 Å²	121.5	79%	0.79	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.5	-13.9	171.8	-80.8	-176.3	161.7	0	0	113.8	A550	A550-E554 PolarHBondContact O-N 2.8Å
555	N	44.6	Very low	46.4	Very low	138 Å²	138	127.6 Å²	127.6	74%	0.738	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.5	11.6	-179.6	-76	-47	0	0	0	113.5	E551 H552 E553	E551-N555 WeakPolarHBondContact O-CB 3.5Å; E551-N555 PolarHBondContact O-ND2 2.94Å; H552-N555 PolarHBondContact O-N 3.09Å; E553-N555 VanDerWaalsContact C-N 3.34Å
556	T	41	Very low	46.3	Very low	168 Å²	168	130.7 Å²	130.7	100%	1.031	64%	0.644	S	S	*	*			trans	-120.6	0	167.8	24.6	0	0	0	0	109.6	H552	H552-T556 PolarHBondContact O-N 3.19Å; H552-T556 PolarHBondContact O-OG1 2.89Å

Retrieved 556 of 556 residues in 446.2 ms (Link to these results)

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