A0A060Y3P0_ONCMY Loading...

MOB kinase activator 1B

AlphaFold DB , UniProt , Accession A0A060Y3P0, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 216 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	33.2	Very low	32.4	Very low	228 Å²	228	156.5 Å²	156.5	100%	1.123	82%	0.819	S	S	*	*				0	106.7	0	-68.1	-169.6	-154.5	0	0	107.6
2	S	23.3	Very low	32.9	Very low	121 Å²	121	152.3 Å²	152.3	85%	0.846	81%	0.805	S	S	*	*			trans	-141.7	109.3	168.7	-69.6	0	0	0	0	106.9	L4	S2-L4 PolarHBondContact O-N 2.82Å
3	F	27.9	Very low	33.3	Very low	175 Å²	175	151.1 Å²	151.1	77%	0.768	79%	0.789	S	S	*	*			trans	-76	116	177.6	-75	-91.8	0	0	0	108.8	F5	F3-F5 HydrophobicContact CB-CD2 4.24Å; F3-F5 HydrophobicContact CB-CE2 4.05Å
4	L	29.6	Very low	33.3	Very low	172 Å²	172	153.7 Å²	153.7	90%	0.901	79%	0.791	S	S	*	*			trans	-89.9	97.7	166.5	-74.3	167.7	0	0	0	107.7	S2 G6	S2-L4 PolarHBondContact O-N 2.82Å; L4-G6 PolarHBondContact O-N 2.57Å; L4-G6 VanDerWaalsContact O-N 3.09Å
5	F	31.3	Very low	33.7	Very low	194 Å²	194	148.7 Å²	148.7	85%	0.851	77%	0.772	S	S	*	*			trans	-67.7	101.4	169.6	-82.7	-89.9	0	0	0	109.5	F3 N7	F3-F5 HydrophobicContact CB-CD2 4.24Å; F3-F5 HydrophobicContact CB-CE2 4.05Å; F5-N7 PolarHBondContact O-N 3.06Å
6	G	26.4	Very low	34	Very low	70 Å²	70	150.7 Å²	150.7	72%	0.722	77%	0.773	S	S	*	*			trans	-81.1	97.5	173.5	0	0	0	0	0	111.3	L4 R8	L4-G6 PolarHBondContact O-N 2.57Å; L4-G6 VanDerWaalsContact O-N 3.09Å; G6-R8 PolarHBondContact O-N 3.43Å
7	N	36.4	Very low	34.6	Very low	145 Å²	145	147 Å²	147	78%	0.775	75%	0.75	S	S	*	*			trans	-46.8	98.6	167.5	-166.3	17.6	0	0	0	112.8	F5	F5-N7 PolarHBondContact O-N 3.06Å
8	R	35.6	Very low	35.5	Very low	237 Å²	237	146.3 Å²	146.3	89%	0.894	75%	0.748	S	S	*	*			trans	-144.2	75.8	170.5	-75.8	-170.1	-179.7	-175.3	1.1	111.1	G6	G6-R8 PolarHBondContact O-N 3.43Å
9	S	40.9	Very low	36.6	Very low	103 Å²	103	139.7 Å²	139.7	72%	0.72	71%	0.714	S	S	*	*	S	Bend	trans	-142.4	-15.9	166	168.5	0	0	0	0	113.7	K11	S9-K11 PolarHBondContact O-N 3.39Å
10	S	35.8	Very low	37.7	Very low	77 Å²	77	136.1 Å²	136.1	54%	0.538	70%	0.701	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.7	13.5	-173	65.3	0	0	0	0	117.2
11	K	36	Very low	38.6	Very low	200 Å²	200	137.2 Å²	137.2	87%	0.87	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.7	-9.9	-171.6	-74.3	-167.3	178.4	-174.5	0	116.3	S9	S9-K11 PolarHBondContact O-N 3.39Å
12	T	38.7	Very low	39.7	Very low	106 Å²	106	129.1 Å²	129.1	65%	0.65	68%	0.678	S	S	*	*	S	Bend	trans	-90.5	-9.8	170.4	40.1	0	0	0	0	112.6	D116	T12-D116 WeakPolarHBondContact CG2-OD1 3.25Å
13	F	38.3	Very low	42.1	Very low	136 Å²	136	124 Å²	124	60%	0.596	64%	0.643	S	S	*	*			trans	-96.1	104	-179.5	-175.8	-118.4	0	0	0	111.1	P15	F13-P15 HydrophobicContact CD1-CG 4.01Å; F13-P15 HydrophobicContact CE1-CB 3.86Å; F13-P15 VanDerWaalsContact CE1-CD 3.46Å; F13-P15 HydrophobicContact CE1-CG 3.35Å; F13-P15 HydrophobicContact CE2-CB 3.88Å; F13-P15 HydrophobicContact CE2-CG 4.24Å; F13-P15 HydrophobicContact CZ-CB 3.41Å; F13-P15 VanDerWaalsContact CZ-CB 3.41Å; F13-P15 HydrophobicContact CZ-CG 3.51Å
14	K	32.3	Very low	44.1	Very low	188 Å²	188	118.9 Å²	118.9	82%	0.817	62%	0.621	S	S	*	*			trans	-106.5	102.6	152.6	-75.4	-175.6	-178.5	173.7	0	107.6	K16	K14-K16 PolarHBondContact O-N 3.11Å
15	P	39.9	Very low	45.6	Very low	78 Å²	78	112 Å²	112	51%	0.506	58%	0.584	S	S	.	*			trans	-69.9	107.7	165.1	27.3	-25.3	0	0	0	107.1	F13	F13-P15 HydrophobicContact CD1-CG 4.01Å; F13-P15 HydrophobicContact CE1-CB 3.86Å; F13-P15 VanDerWaalsContact CE1-CD 3.46Å; F13-P15 HydrophobicContact CE1-CG 3.35Å; F13-P15 HydrophobicContact CE2-CB 3.88Å; F13-P15 HydrophobicContact CE2-CG 4.24Å; F13-P15 HydrophobicContact CZ-CB 3.41Å; F13-P15 VanDerWaalsContact CZ-CB 3.41Å; F13-P15 HydrophobicContact CZ-CG 3.51Å
16	K	37.6	Very low	47.4	Very low	181 Å²	181	105 Å²	105	79%	0.787	55%	0.552	S	S	*	*			trans	168.2	103.1	143.7	-92.7	164	-175.9	-172.3	0	112.7	K14	K14-K16 PolarHBondContact O-N 3.11Å
17	K	44.5	Very low	49.6	Very low	88 Å²	88	107.4 Å²	107.4	38%	0.383	55%	0.545	S	S	.	.				-138	93.7	104.4	-93.2	176.5	178.1	168.4	0	106.4	I19 D127 E129	K17-I19 PolarHBondContact O-N 3.07Å; K17-D127 PolarHBondContact NZ-O 3.23Å; K17-E129 WeakPolarHBondContact CE-OE1 3.19Å; K17-E129 VanDerWaalsContact NZ-CD 3.34Å; K17-E129 IonicContact NZ-OE1 2.73Å; K17-E129 PolarHBondContact NZ-OE1 3.48Å
18	N	51.3	Low	50.9	Low	135 Å²	135	100.9 Å²	100.9	72%	0.722	51%	0.51	S	S	*	.	P	Polyproline II helix	trans	-62.2	126.6	155.6	-70.8	-1.6	0	0	0	104.5	P20	N18-P20 WeakPolarHBondContact O-CD 3.44Å
19	I	55.8	Low	52.3	Low	20 Å²	20	91.1 Å²	91.1	10%	0.103	48%	0.475	C	S	.	.	P	Polyproline II helix	trans	-47.3	121.3	166.8	-56.4	179.6	0	0	0	106.1	K17 E21 S23 Q25 Y26 L29 V59	K17-I19 PolarHBondContact O-N 3.07Å; I19-E21 PolarHBondContact O-N 3.32Å; I19-S23 VanDerWaalsContact CG2-OG 3.3Å; I19-S23 WeakPolarHBondContact CG2-OG 3.1Å; I19-Q25 HydrophobicContact CD1-CB 4.36Å; I19-Q25 HydrophobicContact CG2-CB 3.29Å; I19-Y26 VanDerWaalsContact CG2-N 3.25Å; I19-L29 HydrophobicContact CD1-CB 4.15Å; I19-L29 HydrophobicContact CD1-CD2 3.99Å; I19-V59 HydrophobicContact CD1-CG1 4.16Å; I19-V59 HydrophobicContact CD1-CG2 4.39Å
20	P	58.9	Low	53.7	Low	68 Å²	68	91.3 Å²	91.3	44%	0.442	46%	0.463	S	S	.	.	P	Polyproline II helix	trans	-54.5	128.8	-168.6	-26.5	33.1	0	0	0	110.8	N18 G22 S23 Y26	N18-P20 WeakPolarHBondContact O-CD 3.44Å; P20-G22 PolarHBondContact O-N 3.3Å; P20-S23 VanDerWaalsContact O-CB 3.3Å; P20-S23 WeakPolarHBondContact O-CB 3.32Å; P20-S23 PolarHBondContact O-N 3.49Å; P20-S23 PolarHBondContact O-OG 3.1Å; P20-Y26 VanDerWaalsContact O-CB 3.28Å; P20-Y26 WeakPolarHBondContact O-CB 3.39Å
21	E	55.9	Low	54.9	Low	159 Å²	159	92.7 Å²	92.7	74%	0.743	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	124.5	177.9	-64.4	-169.7	158.3	0	0	109.4	I19 Y26	I19-E21 PolarHBondContact O-N 3.32Å; E21-Y26 HydrophobicContact CB-CE1 4.34Å; E21-Y26 HydrophobicContact CB-CE2 4.41Å; E21-Y26 HydrophobicContact CG-CD2 4.41Å; E21-Y26 HydrophobicContact CG-CE1 4.46Å; E21-Y26 HydrophobicContact CG-CE2 3.81Å
22	G	58.2	Low	55.9	Low	59 Å²	59	83.2 Å²	83.2	61%	0.608	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.9	5.9	-174.6	0	0	0	0	0	115.6	P20	P20-G22 PolarHBondContact O-N 3.3Å
23	S	72.3	Confident	57	Low	14 Å²	14	83 Å²	83	10%	0.098	41%	0.411	C	S	.	.	S	Bend	trans	-80.4	156.8	164.4	65.1	0	0	0	0	111.3	I19 P20 Q25 Y26 E27	I19-S23 VanDerWaalsContact CG2-OG 3.3Å; I19-S23 WeakPolarHBondContact CG2-OG 3.1Å; P20-S23 VanDerWaalsContact O-CB 3.3Å; P20-S23 WeakPolarHBondContact O-CB 3.32Å; P20-S23 PolarHBondContact O-N 3.49Å; P20-S23 PolarHBondContact O-OG 3.1Å; S23-Q25 VanDerWaalsContact C-N 3.32Å; S23-Q25 PolarHBondContact O-N 3.45Å; S23-Y26 WeakPolarHBondContact O-CA 3.26Å; S23-Y26 VanDerWaalsContact O-CB 3.3Å; S23-Y26 WeakPolarHBondContact O-CB 3.3Å; S23-Y26 PolarHBondContact O-N 3.12Å; S23-Y26 WeakPolarHBondContact OG-CB 3.49Å; S23-Y26 PolarHBondContact OG-N 3.29Å; S23-E27 PolarHBondContact O-N 3.34Å; S23-E27 VanDerWaalsContact O-N 3.16Å
24	H	70.3	Confident	57.9	Low	67 Å²	67	80 Å²	80	31%	0.31	41%	0.412	S	S	.	.	H	α-helix	trans	-60.5	-40	177.8	173.3	-105.6	0	0	0	112.4	Y26 E27 L28 E51	H24-Y26 PolarHBondContact O-N 3.02Å; H24-E27 PolarHBondContact O-N 3.3Å; H24-E27 VanDerWaalsContact O-N 3.17Å; H24-L28 PolarHBondContact O-N 3Å; H24-E51 IonicContact CD2-OE1 2.63Å; H24-E51 IonicContact CE1-OE1 3.61Å; H24-E51 IonicContact CE1-OE2 3.74Å; H24-E51 PolarHBondContact CE1-OE2 3.32Å; H24-E51 VanDerWaalsContact NE2-CD 3.29Å; H24-E51 IonicContact NE2-OE1 4Å; H24-E51 PolarHBondContact NE2-OE1 2.83Å; H24-E51 IonicContact NE2-OE2 2.92Å; H24-E51 PolarHBondContact NE2-OE2 3.03Å
25	Q	62.1	Low	59.1	Low	26 Å²	26	72.7 Å²	72.7	12%	0.121	38%	0.383	C	S	.	.	H	α-helix	trans	-56.6	-34.5	170.3	-69.3	-178.9	-10.9	0	0	113.2	I19 S23 L29 E55 V59 P133	I19-Q25 HydrophobicContact CD1-CB 4.36Å; I19-Q25 HydrophobicContact CG2-CB 3.29Å; S23-Q25 VanDerWaalsContact C-N 3.32Å; S23-Q25 PolarHBondContact O-N 3.45Å; Q25-L29 PolarHBondContact O-N 2.64Å; Q25-E55 VanDerWaalsContact CG-CD 3.45Å; Q25-E55 HydrophobicContact CG-CG 4.08Å; Q25-E55 WeakPolarHBondContact CG-OE1 3.29Å; Q25-E55 PolarHBondContact NE2-OE1 3.44Å; Q25-E55 PolarHBondContact NE2-OE2 3.48Å; Q25-V59 HydrophobicContact CB-CG2 3.8Å; Q25-V59 HydrophobicContact CG-CG2 3.93Å; Q25-P133 PolarHBondContact NE2-O 2.89Å
26	Y	69.2	Low	59.9	Low	47 Å²	47	71.2 Å²	71.2	18%	0.184	37%	0.371	C	S	.	.	H	α-helix	trans	-73.8	-36.7	-179.5	175.6	-97.8	0	0	0	111.2	I19 P20 E21 S23 H24 L29 K30	I19-Y26 VanDerWaalsContact CG2-N 3.25Å; P20-Y26 VanDerWaalsContact O-CB 3.28Å; P20-Y26 WeakPolarHBondContact O-CB 3.39Å; E21-Y26 HydrophobicContact CB-CE1 4.34Å; E21-Y26 HydrophobicContact CB-CE2 4.41Å; E21-Y26 HydrophobicContact CG-CD2 4.41Å; E21-Y26 HydrophobicContact CG-CE1 4.46Å; E21-Y26 HydrophobicContact CG-CE2 3.81Å; S23-Y26 WeakPolarHBondContact O-CA 3.26Å; S23-Y26 VanDerWaalsContact O-CB 3.3Å; S23-Y26 WeakPolarHBondContact O-CB 3.3Å; S23-Y26 PolarHBondContact O-N 3.12Å; S23-Y26 WeakPolarHBondContact OG-CB 3.49Å; S23-Y26 PolarHBondContact OG-N 3.29Å; H24-Y26 PolarHBondContact O-N 3.02Å; Y26-L29 PolarHBondContact O-N 3.01Å; Y26-K30 HydrophobicContact CD1-CD 4.44Å; Y26-K30 HydrophobicContact CE1-CD 3.84Å; Y26-K30 VanDerWaalsContact CE1-CE 3.42Å; Y26-K30 HydrophobicContact CE1-CG 4.43Å; Y26-K30 PolarHBondContact O-N 3.4Å; Y26-K30 WeakPolarHBondContact OH-CE 3.33Å; Y26-K30 PolarHBondContact OH-NZ 3.21Å
27	E	70.7	Confident	60.7	Low	122 Å²	122	66.2 Å²	66.2	57%	0.57	37%	0.371	S	S	*	.	H	α-helix	trans	-66.1	-40.3	173.6	-65.7	-178.6	170.6	0	0	111.4	S23 H24 K30 H31	S23-E27 PolarHBondContact O-N 3.34Å; S23-E27 VanDerWaalsContact O-N 3.16Å; H24-E27 PolarHBondContact O-N 3.3Å; H24-E27 VanDerWaalsContact O-N 3.17Å; E27-K30 PolarHBondContact O-N 3.43Å; E27-H31 PolarHBondContact O-N 2.87Å
28	L	63.8	Low	61.2	Low	8 Å²	8	66 Å²	66	4%	0.042	38%	0.38	C	S	.	.	H	α-helix	trans	-60.8	-44.7	173.5	-73	176.8	0	0	0	112.4	H24 K30 H31 A32 P48 E51 E55 W56 V59	H24-L28 PolarHBondContact O-N 3Å; L28-K30 PolarHBondContact O-N 2.86Å; L28-H31 PolarHBondContact O-N 3.19Å; L28-A32 PolarHBondContact O-N 3.23Å; L28-P48 HydrophobicContact CD2-CG 4.46Å; L28-E51 HydrophobicContact CD2-CG 3.91Å; L28-E55 HydrophobicContact CD1-CG 3.82Å; L28-W56 HydrophobicContact CB-CE3 4.29Å; L28-W56 HydrophobicContact CB-CZ3 4.1Å; L28-W56 HydrophobicContact CD1-CE3 4.46Å; L28-W56 HydrophobicContact CD2-CE3 4.03Å; L28-W56 HydrophobicContact CD2-CZ3 4.05Å; L28-V59 HydrophobicContact CB-CG1 4.43Å; L28-V59 HydrophobicContact CB-CG2 4.37Å; L28-V59 HydrophobicContact CD1-CG2 4.46Å
29	L	66.6	Low	61.7	Low	31 Å²	31	62.5 Å²	62.5	16%	0.162	38%	0.376	C	S	.	.	H	α-helix	trans	-60.1	-46.4	176	-177	67.3	0	0	0	111	I19 Q25 Y26 H31 A32 E33 V59 D63	I19-L29 HydrophobicContact CD1-CB 4.15Å; I19-L29 HydrophobicContact CD1-CD2 3.99Å; Q25-L29 PolarHBondContact O-N 2.64Å; Y26-L29 PolarHBondContact O-N 3.01Å; L29-H31 VanDerWaalsContact C-N 3.31Å; L29-H31 PolarHBondContact O-N 2.88Å; L29-A32 WeakPolarHBondContact O-CB 3.45Å; L29-A32 PolarHBondContact O-N 3.22Å; L29-E33 WeakPolarHBondContact O-CG 3.22Å; L29-E33 PolarHBondContact O-N 3.36Å; L29-V59 HydrophobicContact CB-CG1 3.84Å; L29-V59 HydrophobicContact CD1-CG1 4.08Å; L29-D63 HydrophobicContact CD1-CB 3.95Å
30	K	68.8	Low	62.5	Low	107 Å²	107	64.5 Å²	64.5	47%	0.465	39%	0.387	S	S	.	.	H	α-helix	trans	-61	-38.5	176.7	-83.6	-169.1	170.9	174	0	113.1	Y26 E27 L28 A34	Y26-K30 HydrophobicContact CD1-CD 4.44Å; Y26-K30 HydrophobicContact CE1-CD 3.84Å; Y26-K30 VanDerWaalsContact CE1-CE 3.42Å; Y26-K30 HydrophobicContact CE1-CG 4.43Å; Y26-K30 PolarHBondContact O-N 3.4Å; Y26-K30 WeakPolarHBondContact OH-CE 3.33Å; Y26-K30 PolarHBondContact OH-NZ 3.21Å; E27-K30 PolarHBondContact O-N 3.43Å; L28-K30 PolarHBondContact O-N 2.86Å; K30-A34 VanDerWaalsContact O-CB 3.29Å; K30-A34 WeakPolarHBondContact O-CB 3.3Å; K30-A34 PolarHBondContact O-N 2.92Å
31	H	61.1	Low	63.5	Low	106 Å²	106	61.9 Å²	61.9	49%	0.491	37%	0.369	S	S	.	.	H	α-helix	trans	-67.4	-41.4	177.8	-171.1	-103	0	0	0	111.6	E27 L28 L29 T35	E27-H31 PolarHBondContact O-N 2.87Å; L28-H31 PolarHBondContact O-N 3.19Å; L29-H31 VanDerWaalsContact C-N 3.31Å; L29-H31 PolarHBondContact O-N 2.88Å; H31-T35 WeakPolarHBondContact O-CG2 3.48Å; H31-T35 PolarHBondContact O-N 3.26Å; H31-T35 PolarHBondContact O-OG1 2.91Å
32	A	57.3	Low	64.8	Low	2 Å²	2	58.1 Å²	58.1	2%	0.017	35%	0.348	C	S	.	.	H	α-helix	trans	-58.9	-53.1	172.2	0	0	0	0	0	110.6	L28 L29 A34 T35 L36 W56	L28-A32 PolarHBondContact O-N 3.23Å; L29-A32 WeakPolarHBondContact O-CB 3.45Å; L29-A32 PolarHBondContact O-N 3.22Å; A32-A34 PolarHBondContact O-N 3.2Å; A32-T35 PolarHBondContact O-N 2.69Å; A32-T35 VanDerWaalsContact O-N 3.15Å; A32-T35 PolarHBondContact O-OG1 2.89Å; A32-L36 WeakPolarHBondContact O-CG 3.36Å; A32-L36 PolarHBondContact O-N 3.22Å; A32-W56 HydrophobicContact CB-CH2 3.83Å; A32-W56 HydrophobicContact CB-CZ3 4.41Å
33	E	62.7	Low	65.9	Low	100 Å²	100	60.9 Å²	60.9	47%	0.467	35%	0.347	S	S	.	.	H	α-helix	trans	-58.5	-42.2	-179.9	-71.8	175.1	173.2	0	0	113.1	L29 T35 L36	L29-E33 WeakPolarHBondContact O-CG 3.22Å; L29-E33 PolarHBondContact O-N 3.36Å; E33-T35 VanDerWaalsContact C-N 3.3Å; E33-T35 PolarHBondContact O-N 3.47Å; E33-L36 WeakPolarHBondContact O-CB 3.4Å; E33-L36 PolarHBondContact O-N 3.45Å
34	A	56.1	Low	66.5	Low	74 Å²	74	60.5 Å²	60.5	61%	0.612	34%	0.344	S	S	*	.	H	α-helix	trans	-65.3	-33.3	179.2	0	0	0	0	0	112.8	K30 A32	K30-A34 VanDerWaalsContact O-CB 3.29Å; K30-A34 WeakPolarHBondContact O-CB 3.3Å; K30-A34 PolarHBondContact O-N 2.92Å; A32-A34 PolarHBondContact O-N 3.2Å
35	T	57.6	Low	67.5	Low	34 Å²	34	57.4 Å²	57.4	21%	0.209	33%	0.33	C	S	.	.	H	α-helix	trans	-81.7	-19.5	-179.9	52.4	0	0	0	0	112.9	H31 A32 E33 G37 S38 A44	H31-T35 WeakPolarHBondContact O-CG2 3.48Å; H31-T35 PolarHBondContact O-N 3.26Å; H31-T35 PolarHBondContact O-OG1 2.91Å; A32-T35 PolarHBondContact O-N 2.69Å; A32-T35 VanDerWaalsContact O-N 3.15Å; A32-T35 PolarHBondContact O-OG1 2.89Å; E33-T35 VanDerWaalsContact C-N 3.3Å; E33-T35 PolarHBondContact O-N 3.47Å; T35-G37 PolarHBondContact O-N 3.08Å; T35-S38 WeakPolarHBondContact O-CB 3.42Å; T35-S38 PolarHBondContact O-N 2.8Å; T35-S38 VanDerWaalsContact O-N 3.14Å; T35-S38 PolarHBondContact O-OG 3.15Å; T35-A44 WeakPolarHBondContact OG1-CB 2.9Å
36	L	57.9	Low	69	Low	48 Å²	48	60.3 Å²	60.3	25%	0.251	35%	0.345	S	S	.	.	H	α-helix	trans	-60.4	-31.8	172.2	-65	175.6	0	0	0	112.7	A32 E33 S38 L41 H185	A32-L36 WeakPolarHBondContact O-CG 3.36Å; A32-L36 PolarHBondContact O-N 3.22Å; E33-L36 WeakPolarHBondContact O-CB 3.4Å; E33-L36 PolarHBondContact O-N 3.45Å; L36-S38 VanDerWaalsContact C-N 3.3Å; L36-S38 PolarHBondContact O-N 3.32Å; L36-L41 HydrophobicContact CB-CD2 4.35Å; L36-L41 HydrophobicContact CD2-CD2 3.31Å; L36-L41 HydrophobicContact CG-CD2 4.42Å; L36-H185 HydrophobicContact CD2-CB 4.41Å
37	G	54.4	Low	70.2	Confident	76 Å²	76	61 Å²	61	78%	0.784	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-10.9	177.9	0	0	0	0	0	115.2	T35 G39	T35-G37 PolarHBondContact O-N 3.08Å; G37-G39 VanDerWaalsContact C-N 3.33Å; G37-G39 PolarHBondContact O-N 3.42Å
38	S	54	Low	71.2	Confident	82 Å²	82	56.7 Å²	56.7	57%	0.573	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-7.2	-174.2	72.2	0	0	0	0	114.7	T35 L36 N40	T35-S38 WeakPolarHBondContact O-CB 3.42Å; T35-S38 PolarHBondContact O-N 2.8Å; T35-S38 VanDerWaalsContact O-N 3.14Å; T35-S38 PolarHBondContact O-OG 3.15Å; L36-S38 VanDerWaalsContact C-N 3.3Å; L36-S38 PolarHBondContact O-N 3.32Å; S38-N40 VanDerWaalsContact C-N 3.31Å; S38-N40 PolarHBondContact O-N 3.43Å
39	G	61.3	Low	72.6	Confident	62 Å²	62	64.4 Å²	64.4	64%	0.639	38%	0.375	S	S	*	.	S	Bend	trans	84.1	-9.5	177.8	0	0	0	0	0	115.5	G37	G37-G39 VanDerWaalsContact C-N 3.33Å; G37-G39 PolarHBondContact O-N 3.42Å
40	N	72.9	Confident	73.8	Confident	63 Å²	63	67 Å²	67	34%	0.337	41%	0.41	S	S	.	.			trans	-114.3	81.5	175	-167.6	-15	0	0	0	112	S38 R42 M43 A44	S38-N40 VanDerWaalsContact C-N 3.31Å; S38-N40 PolarHBondContact O-N 3.43Å; N40-R42 PolarHBondContact O-N 3.2Å; N40-R42 VanDerWaalsContact O-N 3.13Å; N40-R42 PolarHBondContact OD1-N 3.39Å; N40-M43 PolarHBondContact O-N 2.91Å; N40-M43 VanDerWaalsContact O-N 3.16Å; N40-M43 PolarHBondContact OD1-N 2.97Å; N40-A44 PolarHBondContact O-N 2.73Å
41	L	80.3	Confident	75	Confident	12 Å²	12	64.5 Å²	64.5	6%	0.063	40%	0.4	C	S	.	.	H	α-helix	trans	-61.1	-20.5	-179.8	-66	174.2	0	0	0	113.7	L36 V45 K184 F188	L36-L41 HydrophobicContact CB-CD2 4.35Å; L36-L41 HydrophobicContact CD2-CD2 3.31Å; L36-L41 HydrophobicContact CG-CD2 4.42Å; L41-V45 PolarHBondContact O-N 2.71Å; L41-K184 HydrophobicContact CD1-CB 4.21Å; L41-K184 HydrophobicContact CD1-CD 3.78Å; L41-K184 HydrophobicContact CD1-CG 3.82Å; L41-F188 HydrophobicContact CB-CD2 3.61Å; L41-F188 HydrophobicContact CB-CE2 3.82Å
42	R	82.5	Confident	76.5	Confident	80 Å²	80	63.2 Å²	63.2	30%	0.302	40%	0.396	S	S	.	.	H	α-helix	trans	-69.7	-39.8	176.1	-70.5	-170.8	-178.2	-80.1	-0.8	112	N40 A44 V45 F188 T212 D215	N40-R42 PolarHBondContact O-N 3.2Å; N40-R42 VanDerWaalsContact O-N 3.13Å; N40-R42 PolarHBondContact OD1-N 3.39Å; R42-A44 VanDerWaalsContact C-N 3.32Å; R42-V45 WeakPolarHBondContact O-CG2 3.45Å; R42-F188 HydrophobicContact CG-CD1 4Å; R42-F188 HydrophobicContact CG-CD2 3.9Å; R42-F188 HydrophobicContact CG-CE1 3.88Å; R42-F188 HydrophobicContact CG-CE2 3.74Å; R42-F188 HydrophobicContact CG-CG 4.03Å; R42-F188 HydrophobicContact CG-CZ 3.75Å; R42-T212 PolarHBondContact NH2-O 3.05Å; R42-D215 WeakPolarHBondContact CD-O 3.43Å; R42-D215 HydrophobicContact CG-CB 4.41Å; R42-D215 PolarHBondContact NE-O 2.67Å
43	M	82.9	Confident	78.4	Confident	118 Å²	118	66.4 Å²	66.4	58%	0.581	41%	0.413	S	S	*	.	H	α-helix	trans	-70.5	-34.6	176.3	-69.9	-176.2	69.1	0	0	111.4	N40 V45 M46	N40-M43 PolarHBondContact O-N 2.91Å; N40-M43 VanDerWaalsContact O-N 3.16Å; N40-M43 PolarHBondContact OD1-N 2.97Å; M43-V45 PolarHBondContact O-N 2.82Å; M43-M46 HydrophobicContact CB-CE 4.43Å; M43-M46 HydrophobicContact CG-CE 4.5Å; M43-M46 PolarHBondContact O-N 2.92Å
44	A	83.6	Confident	80	Confident	6 Å²	6	63.8 Å²	63.8	5%	0.05	40%	0.402	C	S	.	.	H	α-helix	trans	-62.7	-27	-179.8	0	0	0	0	0	113.7	T35 N40 R42	T35-A44 WeakPolarHBondContact OG1-CB 2.9Å; N40-A44 PolarHBondContact O-N 2.73Å; R42-A44 VanDerWaalsContact C-N 3.32Å
45	V	92.1	Very high	81.8	Confident	1 Å²	1	61.8 Å²	61.8	1%	0.006	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90	-13.1	-178.7	-62.6	0	0	0	0	114.3	L41 R42 M43 W56 H185 F188 F189 E192 F193	L41-V45 PolarHBondContact O-N 2.71Å; R42-V45 WeakPolarHBondContact O-CG2 3.45Å; M43-V45 PolarHBondContact O-N 2.82Å; V45-W56 PolarHBondContact O-NE1 2.88Å; V45-H185 WeakPolarHBondContact CG1-CD2 3.44Å; V45-F188 HydrophobicContact CG1-CB 4.15Å; V45-F188 HydrophobicContact CG2-CB 3.97Å; V45-F189 HydrophobicContact CB-CB 4.3Å; V45-F189 HydrophobicContact CB-CD2 3.96Å; V45-F189 HydrophobicContact CG1-CB 3.92Å; V45-F189 HydrophobicContact CG1-CD2 4.11Å; V45-E192 HydrophobicContact CG2-CB 4.2Å; V45-E192 HydrophobicContact CG2-CG 4.42Å; V45-F193 VanDerWaalsContact O-CE2 3.24Å; V45-F193 WeakPolarHBondContact O-CE2 3.35Å; V45-F193 WeakPolarHBondContact O-CZ 3.42Å
46	M	92.7	Very high	83.6	Confident	88 Å²	88	60.2 Å²	60.2	43%	0.433	37%	0.37	S	S	.	.	S	Bend	trans	-62.8	146	-178.3	-62.8	-171.9	-43.5	0	0	110.6	M43 P48	M43-M46 HydrophobicContact CB-CE 4.43Å; M43-M46 HydrophobicContact CG-CE 4.5Å; M43-M46 PolarHBondContact O-N 2.92Å; M46-P48 VanDerWaalsContact O-CD 3.3Å; M46-P48 WeakPolarHBondContact O-CD 3.45Å
47	L	94.6	Very high	85.5	Confident	60 Å²	60	58 Å²	58	31%	0.314	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-63.2	122.2	173.2	-179.6	65.7	0	0	0	108.6	E51 L53 W56 F193	L47-E51 HydrophobicContact CD1-CB 3.89Å; L47-E51 HydrophobicContact CG-CB 4.48Å; L47-L53 HydrophobicContact CD2-CB 4.28Å; L47-L53 HydrophobicContact CD2-CD1 4.48Å; L47-W56 HydrophobicContact CD1-CB 3.44Å; L47-W56 VanDerWaalsContact CD1-CB 3.44Å; L47-W56 HydrophobicContact CD1-CG 3.69Å; L47-F193 HydrophobicContact CB-CE1 4.02Å; L47-F193 HydrophobicContact CB-CZ 4.05Å
48	P	93.1	Very high	87.5	Confident	32 Å²	32	54.5 Å²	54.5	21%	0.208	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-63.8	151.5	176.9	-18.9	31.1	0	0	0	111.9	L28 M46 G50 E51 W56	L28-P48 HydrophobicContact CD2-CG 4.46Å; M46-P48 VanDerWaalsContact O-CD 3.3Å; M46-P48 WeakPolarHBondContact O-CD 3.45Å; P48-G50 PolarHBondContact O-N 3.25Å; P48-E51 HydrophobicContact CB-CB 4.39Å; P48-E51 HydrophobicContact CB-CG 3.75Å; P48-E51 HydrophobicContact CG-CG 4.12Å; P48-E51 WeakPolarHBondContact O-CB 3.48Å; P48-E51 PolarHBondContact O-N 3.12Å; P48-E51 VanDerWaalsContact O-N 3.14Å; P48-W56 HydrophobicContact CG-CE3 4.4Å; P48-W56 HydrophobicContact CG-CH2 4.37Å; P48-W56 HydrophobicContact CG-CZ3 4.26Å
49	D	91.4	Very high	89.4	Confident	170 Å²	170	50.7 Å²	50.7	91%	0.909	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	124.9	-177.9	-73.5	-29.8	0	0	0	111.5	E51	D49-E51 VanDerWaalsContact C-N 3.35Å
50	G	92.2	Very high	91	Very high	87 Å²	87	47.7 Å²	47.7	90%	0.897	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.4	-0.4	178.9	0	0	0	0	0	115.1	P48	P48-G50 PolarHBondContact O-N 3.25Å
51	E	93.4	Very high	92.2	Very high	54 Å²	54	44.7 Å²	44.7	25%	0.252	25%	0.249	S	C	.	.			trans	-86.5	153.4	-179.4	-68.9	-61.4	164.2	0	0	113.9	H24 L28 L47 P48 D49	H24-E51 IonicContact CD2-OE1 2.63Å; H24-E51 IonicContact CE1-OE1 3.61Å; H24-E51 IonicContact CE1-OE2 3.74Å; H24-E51 PolarHBondContact CE1-OE2 3.32Å; H24-E51 VanDerWaalsContact NE2-CD 3.29Å; H24-E51 IonicContact NE2-OE1 4Å; H24-E51 PolarHBondContact NE2-OE1 2.83Å; H24-E51 IonicContact NE2-OE2 2.92Å; H24-E51 PolarHBondContact NE2-OE2 3.03Å; L28-E51 HydrophobicContact CD2-CG 3.91Å; L47-E51 HydrophobicContact CD1-CB 3.89Å; L47-E51 HydrophobicContact CG-CB 4.48Å; P48-E51 HydrophobicContact CB-CB 4.39Å; P48-E51 HydrophobicContact CB-CG 3.75Å; P48-E51 HydrophobicContact CG-CG 4.12Å; P48-E51 WeakPolarHBondContact O-CB 3.48Å; P48-E51 PolarHBondContact O-N 3.12Å; P48-E51 VanDerWaalsContact O-N 3.14Å; D49-E51 VanDerWaalsContact C-N 3.35Å
52	D	94.3	Very high	92.9	Very high	79 Å²	79	45.6 Å²	45.6	42%	0.422	26%	0.255	S	S	.	.			trans	-79.9	131.8	175	-179.9	-98.3	0	0	0	111.2	N54 E55 W56	D52-N54 VanDerWaalsContact C-N 3.33Å; D52-N54 PolarHBondContact O-N 3.41Å; D52-N54 WeakPolarHBondContact OD1-CA 3.28Å; D52-N54 VanDerWaalsContact OD1-CB 3.23Å; D52-N54 WeakPolarHBondContact OD1-CB 2.95Å; D52-N54 PolarHBondContact OD1-N 2.92Å; D52-E55 HydrophobicContact CB-CB 4.05Å; D52-E55 PolarHBondContact O-N 3.32Å; D52-E55 PolarHBondContact OD1-N 2.96Å; D52-W56 PolarHBondContact O-N 3.23Å
53	L	95.9	Very high	93.5	Very high	68 Å²	68	42.6 Å²	42.6	36%	0.356	25%	0.245	S	C	.	.	H	α-helix	trans	-62.4	-37.8	-179.1	177	62.4	0	0	0	112.8	L47 V57 M145 F193	L47-L53 HydrophobicContact CD2-CB 4.28Å; L47-L53 HydrophobicContact CD2-CD1 4.48Å; L53-V57 HydrophobicContact CD1-CG2 4.1Å; L53-V57 WeakPolarHBondContact O-CB 3.38Å; L53-V57 VanDerWaalsContact O-CG2 3.3Å; L53-V57 WeakPolarHBondContact O-CG2 3.33Å; L53-V57 PolarHBondContact O-N 2.93Å; L53-M145 HydrophobicContact CD2-CE 4.25Å; L53-M145 HydrophobicContact CG-CE 4.15Å; L53-F193 HydrophobicContact CD1-CD1 3.44Å; L53-F193 VanDerWaalsContact CD1-CD1 3.44Å; L53-F193 HydrophobicContact CD1-CE1 3.55Å; L53-F193 HydrophobicContact CD1-CG 4.21Å; L53-F193 HydrophobicContact CD1-CZ 4.4Å
54	N	96.2	Very high	94.2	Very high	46 Å²	46	37 Å²	37	25%	0.246	22%	0.217	C	C	.	.	H	α-helix	trans	-71.5	-39.2	-179	-60	-46.6	0	0	0	110.7	D52 V57 A58 F140 F144 M145	D52-N54 VanDerWaalsContact C-N 3.33Å; D52-N54 PolarHBondContact O-N 3.41Å; D52-N54 WeakPolarHBondContact OD1-CA 3.28Å; D52-N54 VanDerWaalsContact OD1-CB 3.23Å; D52-N54 WeakPolarHBondContact OD1-CB 2.95Å; D52-N54 PolarHBondContact OD1-N 2.92Å; N54-V57 PolarHBondContact O-N 2.93Å; N54-A58 VanDerWaalsContact O-CB 3.26Å; N54-A58 WeakPolarHBondContact O-CB 3.43Å; N54-A58 PolarHBondContact O-N 3.2Å; N54-F140 HydrophobicContact CB-CB 4.18Å; N54-F140 HydrophobicContact CB-CD1 4.22Å; N54-F140 HydrophobicContact CB-CD2 3.4Å; N54-F140 VanDerWaalsContact CB-CD2 3.4Å; N54-F140 HydrophobicContact CB-CE1 4.49Å; N54-F140 HydrophobicContact CB-CE2 3.73Å; N54-F140 HydrophobicContact CB-CG 3.67Å; N54-F140 HydrophobicContact CB-CZ 4.27Å; N54-F144 HydrophobicContact CB-CD1 3.59Å; N54-F144 HydrophobicContact CB-CE1 3.62Å; N54-F144 HydrophobicContact CB-CG 4.48Å; N54-F144 HydrophobicContact CB-CZ 4.5Å; N54-F144 WeakPolarHBondContact O-CE1 3.39Å; N54-F144 WeakPolarHBondContact O-CZ 3.47Å; N54-F144 WeakPolarHBondContact OD1-CD1 3.38Å; N54-M145 WeakPolarHBondContact OD1-CE 3.33Å
55	E	94.4	Very high	94.9	Very high	32 Å²	32	36.9 Å²	36.9	15%	0.15	22%	0.216	C	C	.	.	H	α-helix	trans	-60.3	-47.8	174.5	-163.4	77.9	154.9	0	0	111	Q25 L28 D52 V57 A58 V59 F140	Q25-E55 VanDerWaalsContact CG-CD 3.45Å; Q25-E55 HydrophobicContact CG-CG 4.08Å; Q25-E55 WeakPolarHBondContact CG-OE1 3.29Å; Q25-E55 PolarHBondContact NE2-OE1 3.44Å; Q25-E55 PolarHBondContact NE2-OE2 3.48Å; L28-E55 HydrophobicContact CD1-CG 3.82Å; D52-E55 HydrophobicContact CB-CB 4.05Å; D52-E55 PolarHBondContact O-N 3.32Å; D52-E55 PolarHBondContact OD1-N 2.96Å; E55-V57 PolarHBondContact O-N 3.5Å; E55-A58 WeakPolarHBondContact O-CB 3.43Å; E55-A58 PolarHBondContact O-N 3.48Å; E55-A58 VanDerWaalsContact O-N 3.15Å; E55-V59 WeakPolarHBondContact O-CG2 3.1Å; E55-V59 PolarHBondContact O-N 2.89Å; E55-F140 HydrophobicContact CB-CE2 4.18Å; E55-F140 WeakPolarHBondContact OE2-CE2 3.46Å; E55-F140 WeakPolarHBondContact OE2-CZ 3.36Å
56	W	95.7	Very high	95	Very high	1 Å²	1	40.2 Å²	40.2	0%	0.004	23%	0.233	C	C	.	.	H	α-helix	trans	-61.3	-43.3	177.9	-172.6	-122.1	0	0	0	112.6	L28 A32 V45 L47 P48 D52 N60 F189 F193	L28-W56 HydrophobicContact CB-CE3 4.29Å; L28-W56 HydrophobicContact CB-CZ3 4.1Å; L28-W56 HydrophobicContact CD1-CE3 4.46Å; L28-W56 HydrophobicContact CD2-CE3 4.03Å; L28-W56 HydrophobicContact CD2-CZ3 4.05Å; A32-W56 HydrophobicContact CB-CH2 3.83Å; A32-W56 HydrophobicContact CB-CZ3 4.41Å; V45-W56 PolarHBondContact O-NE1 2.88Å; L47-W56 HydrophobicContact CD1-CB 3.44Å; L47-W56 VanDerWaalsContact CD1-CB 3.44Å; L47-W56 HydrophobicContact CD1-CG 3.69Å; P48-W56 HydrophobicContact CG-CE3 4.4Å; P48-W56 HydrophobicContact CG-CH2 4.37Å; P48-W56 HydrophobicContact CG-CZ3 4.26Å; D52-W56 PolarHBondContact O-N 3.23Å; W56-N60 VanDerWaalsContact CE2-ND2 3.33Å; W56-N60 WeakPolarHBondContact O-CB 3.3Å; W56-N60 PolarHBondContact O-N 3.41Å; W56-N60 PolarHBondContact O-ND2 3.43Å; W56-F189 AromaticContact CD1-CE2 3.88Å; W56-F189 AromaticContact NE1-CE2 3.59Å; W56-F193 AromaticContact CD1-CE2 3.63Å; W56-F193 AromaticContact CD1-CZ 3.42Å; W56-F193 VanDerWaalsContact CD1-CZ 3.42Å; W56-F193 AromaticContact NE1-CE2 3.68Å; W56-F193 AromaticContact NE1-CZ 3.61Å
57	V	97.3	Very high	95.2	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-66.4	-37	174.8	170.2	0	0	0	0	111.8	L53 N54 E55 T61 F144 M145 A148 F189 L195	L53-V57 HydrophobicContact CD1-CG2 4.1Å; L53-V57 WeakPolarHBondContact O-CB 3.38Å; L53-V57 VanDerWaalsContact O-CG2 3.3Å; L53-V57 WeakPolarHBondContact O-CG2 3.33Å; L53-V57 PolarHBondContact O-N 2.93Å; N54-V57 PolarHBondContact O-N 2.93Å; E55-V57 PolarHBondContact O-N 3.5Å; V57-T61 WeakPolarHBondContact O-CB 3.48Å; V57-T61 PolarHBondContact O-N 3.26Å; V57-T61 PolarHBondContact O-OG1 3.13Å; V57-F144 HydrophobicContact CB-CE1 4.13Å; V57-F144 HydrophobicContact CB-CZ 4.38Å; V57-F144 HydrophobicContact CG1-CE1 3.99Å; V57-F144 HydrophobicContact CG1-CZ 4.09Å; V57-M145 HydrophobicContact CB-CE 4.41Å; V57-M145 HydrophobicContact CG1-CE 4.48Å; V57-M145 HydrophobicContact CG1-SD 4.43Å; V57-M145 HydrophobicContact CG2-CE 4.11Å; V57-A148 HydrophobicContact CG1-CB 3.68Å; V57-F189 HydrophobicContact CB-CZ 4.49Å; V57-F189 HydrophobicContact CG2-CE1 4.25Å; V57-F189 HydrophobicContact CG2-CZ 4.01Å; V57-L195 HydrophobicContact CG1-CD1 4.45Å; V57-L195 HydrophobicContact CG2-CD1 4.36Å
58	A	95.9	Very high	95.3	Very high	3 Å²	3	34.7 Å²	34.7	3%	0.025	21%	0.205	C	C	.	.	H	α-helix	trans	-64.7	-51.3	179.2	0	0	0	0	0	111.4	N54 E55 N60 T61 V62 F132 F140 F144	N54-A58 VanDerWaalsContact O-CB 3.26Å; N54-A58 WeakPolarHBondContact O-CB 3.43Å; N54-A58 PolarHBondContact O-N 3.2Å; E55-A58 WeakPolarHBondContact O-CB 3.43Å; E55-A58 PolarHBondContact O-N 3.48Å; E55-A58 VanDerWaalsContact O-N 3.15Å; A58-N60 PolarHBondContact O-N 2.99Å; A58-T61 PolarHBondContact O-N 3.33Å; A58-V62 WeakPolarHBondContact O-CG2 3.19Å; A58-V62 PolarHBondContact O-N 2.87Å; A58-F132 HydrophobicContact CB-CD1 3.92Å; A58-F132 HydrophobicContact CB-CE1 3.94Å; A58-F140 HydrophobicContact CB-CE1 3.78Å; A58-F140 HydrophobicContact CB-CZ 3.69Å; A58-F144 HydrophobicContact CB-CE2 4.07Å; A58-F144 HydrophobicContact CB-CZ 3.75Å
59	V	94.1	Very high	95.4	Very high	2 Å²	2	36 Å²	36	1%	0.012	21%	0.21	C	C	.	.	H	α-helix	trans	-57.8	-49.8	179.9	172.4	0	0	0	0	110.8	I19 Q25 L28 L29 E55 T61 V62 D63	I19-V59 HydrophobicContact CD1-CG1 4.16Å; I19-V59 HydrophobicContact CD1-CG2 4.39Å; Q25-V59 HydrophobicContact CB-CG2 3.8Å; Q25-V59 HydrophobicContact CG-CG2 3.93Å; L28-V59 HydrophobicContact CB-CG1 4.43Å; L28-V59 HydrophobicContact CB-CG2 4.37Å; L28-V59 HydrophobicContact CD1-CG2 4.46Å; L29-V59 HydrophobicContact CB-CG1 3.84Å; L29-V59 HydrophobicContact CD1-CG1 4.08Å; E55-V59 WeakPolarHBondContact O-CG2 3.1Å; E55-V59 PolarHBondContact O-N 2.89Å; V59-T61 PolarHBondContact O-N 2.8Å; V59-V62 PolarHBondContact O-N 2.97Å; V59-D63 PolarHBondContact O-N 3.34Å
60	N	96.3	Very high	95.6	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-67.9	-34.7	179.6	-77.4	-85.5	0	0	0	112.4	W56 A58 V62 D63 F64 F189	W56-N60 VanDerWaalsContact CE2-ND2 3.33Å; W56-N60 WeakPolarHBondContact O-CB 3.3Å; W56-N60 PolarHBondContact O-N 3.41Å; W56-N60 PolarHBondContact O-ND2 3.43Å; A58-N60 PolarHBondContact O-N 2.99Å; N60-V62 VanDerWaalsContact C-N 3.33Å; N60-V62 PolarHBondContact O-N 3.05Å; N60-D63 PolarHBondContact O-N 2.9Å; N60-F64 HydrophobicContact CB-CD2 4.4Å; N60-F64 HydrophobicContact CB-CE2 3.95Å; N60-F64 WeakPolarHBondContact O-CD2 3.49Å; N60-F64 WeakPolarHBondContact O-CG 3.43Å; N60-F64 PolarHBondContact O-N 3.45Å; N60-F189 HydrophobicContact CB-CD1 4.39Å; N60-F189 HydrophobicContact CB-CD2 3.97Å; N60-F189 HydrophobicContact CB-CE1 3.89Å; N60-F189 HydrophobicContact CB-CE2 3.43Å; N60-F189 VanDerWaalsContact CB-CE2 3.43Å; N60-F189 HydrophobicContact CB-CG 4.43Å; N60-F189 HydrophobicContact CB-CZ 3.41Å; N60-F189 VanDerWaalsContact CB-CZ 3.41Å; N60-F189 WeakPolarHBondContact ND2-CE2 3.34Å
61	T	97.6	Very high	95.7	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-62.8	-40.7	175.5	-62.2	0	0	0	0	111.6	V57 A58 V59 F65 L126 F132 I151 L152	V57-T61 WeakPolarHBondContact O-CB 3.48Å; V57-T61 PolarHBondContact O-N 3.26Å; V57-T61 PolarHBondContact O-OG1 3.13Å; A58-T61 PolarHBondContact O-N 3.33Å; V59-T61 PolarHBondContact O-N 2.8Å; T61-F65 WeakPolarHBondContact O-CB 3.28Å; T61-F65 PolarHBondContact O-N 3.27Å; T61-L126 HydrophobicContact CG2-CD2 4.39Å; T61-F132 HydrophobicContact CG2-CZ 4.35Å; T61-I151 HydrophobicContact CG2-CB 4.22Å; T61-I151 HydrophobicContact CG2-CD1 4.39Å; T61-I151 HydrophobicContact CG2-CG2 3.56Å; T61-L152 HydrophobicContact CG2-CD2 4.43Å
62	V	95.7	Very high	95.8	Very high	31 Å²	31	29.1 Å²	29.1	19%	0.188	15%	0.15	C	C	.	.	H	α-helix	trans	-64.9	-45.2	175.3	173.4	0	0	0	0	110.6	A58 V59 N60 F65 N66 L126 F132	A58-V62 WeakPolarHBondContact O-CG2 3.19Å; A58-V62 PolarHBondContact O-N 2.87Å; V59-V62 PolarHBondContact O-N 2.97Å; N60-V62 VanDerWaalsContact C-N 3.33Å; N60-V62 PolarHBondContact O-N 3.05Å; V62-F65 PolarHBondContact O-N 3.41Å; V62-N66 VanDerWaalsContact O-CG 3.31Å; V62-N66 PolarHBondContact O-N 2.76Å; V62-N66 PolarHBondContact O-ND2 2.99Å; V62-L126 HydrophobicContact CG2-CD1 4.25Å; V62-L126 HydrophobicContact CG2-CD2 3.89Å; V62-F132 HydrophobicContact CG2-CD1 4.45Å
63	D	94.3	Very high	95.9	Very high	16 Å²	16	27.2 Å²	27.2	9%	0.086	15%	0.15	C	C	.	.	H	α-helix	trans	-60.4	-48.9	177.9	-177	31	0	0	0	111.8	L29 V59 N60 F65 N66 Q67	L29-D63 HydrophobicContact CD1-CB 3.95Å; V59-D63 PolarHBondContact O-N 3.34Å; N60-D63 PolarHBondContact O-N 2.9Å; D63-F65 VanDerWaalsContact C-N 3.33Å; D63-F65 PolarHBondContact O-N 3.39Å; D63-N66 PolarHBondContact O-N 2.92Å; D63-N66 VanDerWaalsContact O-N 3.13Å; D63-Q67 WeakPolarHBondContact O-CG 3.17Å; D63-Q67 PolarHBondContact O-N 2.96Å; D63-Q67 PolarHBondContact OD1-NE2 3.2Å; D63-Q67 PolarHBondContact OD2-NE2 3.46Å
64	F	97.8	Very high	95.9	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-60.4	-40.7	175.8	-67.6	-50	0	0	0	112.9	N60 N66 Q67 I68 L152 H185 F186 F189	N60-F64 HydrophobicContact CB-CD2 4.4Å; N60-F64 HydrophobicContact CB-CE2 3.95Å; N60-F64 WeakPolarHBondContact O-CD2 3.49Å; N60-F64 WeakPolarHBondContact O-CG 3.43Å; N60-F64 PolarHBondContact O-N 3.45Å; F64-N66 VanDerWaalsContact C-N 3.34Å; F64-N66 PolarHBondContact O-N 2.96Å; F64-Q67 PolarHBondContact O-N 3.09Å; F64-I68 WeakPolarHBondContact O-CB 3.33Å; F64-I68 WeakPolarHBondContact O-CD1 3.46Å; F64-I68 WeakPolarHBondContact O-CG1 3.28Å; F64-I68 PolarHBondContact O-N 3.01Å; F64-L152 HydrophobicContact CD2-CD2 3.98Å; F64-H185 HydrophobicContact CE1-CB 4.29Å; F64-H185 AromaticContact CE1-CE1 3.72Å; F64-H185 AromaticContact CE1-CG 3.75Å; F64-H185 AromaticContact CE1-ND1 3.43Å; F64-H185 WeakPolarHBondContact CE1-ND1 3.27Å; F64-H185 AromaticContact CZ-CE1 3.72Å; F64-H185 AromaticContact CZ-ND1 3.87Å; F64-H185 AromaticContact CZ-NE2 3.83Å; F64-F186 HydrophobicContact CB-CD2 4.01Å; F64-F186 HydrophobicContact CB-CE2 4.42Å; F64-F186 HydrophobicContact CD1-CB 3.96Å; F64-F186 AromaticContact CD1-CD2 3.81Å; F64-F186 HydrophobicContact CD1-CD2 3.81Å; F64-F186 HydrophobicContact CD1-CG 4.4Å; F64-F186 AromaticContact CD2-CD2 3.93Å; F64-F186 HydrophobicContact CD2-CD2 3.93Å; F64-F186 HydrophobicContact CD2-CE2 4.47Å; F64-F186 VanDerWaalsContact CE1-CA 3.41Å; F64-F186 HydrophobicContact CE1-CB 3.82Å; F64-F186 HydrophobicContact CE1-CD2 4.29Å; F64-F186 HydrophobicContact CE2-CD2 4.41Å; F64-F186 AromaticContact CG-CD2 3.64Å; F64-F186 HydrophobicContact CG-CD2 3.64Å; F64-F186 HydrophobicContact CG-CE2 4.37Å; F64-F186 HydrophobicContact CZ-CB 4.36Å; F64-F189 HydrophobicContact CE2-CB 3.71Å; F64-F189 AromaticContact CE2-CD1 3.62Å; F64-F189 HydrophobicContact CE2-CD1 3.62Å; F64-F189 HydrophobicContact CE2-CD2 4.26Å; F64-F189 HydrophobicContact CE2-CE1 4.34Å; F64-F189 AromaticContact CE2-CG 3.58Å; F64-F189 HydrophobicContact CE2-CG 3.58Å; F64-F189 HydrophobicContact CZ-CB 3.64Å; F64-F189 HydrophobicContact CZ-CD1 4.41Å; F64-F189 HydrophobicContact CZ-CD2 4.49Å; F64-F189 AromaticContact CZ-CG 3.94Å; F64-F189 HydrophobicContact CZ-CG 3.94Å
65	F	98.1	Very high	95.9	Very high	5 Å²	5	24.2 Å²	24.2	2%	0.022	14%	0.136	C	C	.	.	H	α-helix	trans	-58.3	-47.7	174.7	168	-104	0	0	0	111.2	T61 V62 D63 I68 N69 M119 V122 Q123 L126 L155	T61-F65 WeakPolarHBondContact O-CB 3.28Å; T61-F65 PolarHBondContact O-N 3.27Å; V62-F65 PolarHBondContact O-N 3.41Å; D63-F65 VanDerWaalsContact C-N 3.33Å; D63-F65 PolarHBondContact O-N 3.39Å; F65-I68 PolarHBondContact O-N 3.43Å; F65-N69 VanDerWaalsContact O-CB 3.23Å; F65-N69 WeakPolarHBondContact O-CB 3.25Å; F65-N69 PolarHBondContact O-N 3.02Å; F65-M119 HydrophobicContact CD2-SD 4.07Å; F65-M119 HydrophobicContact CE2-CB 4.32Å; F65-M119 HydrophobicContact CE2-SD 3.7Å; F65-V122 HydrophobicContact CB-CG1 4.26Å; F65-V122 HydrophobicContact CD2-CB 3.91Å; F65-V122 HydrophobicContact CD2-CG1 3.38Å; F65-V122 HydrophobicContact CE2-CB 3.93Å; F65-V122 HydrophobicContact CE2-CG1 3.84Å; F65-V122 HydrophobicContact CG-CG1 3.89Å; F65-Q123 HydrophobicContact CZ-CB 4.13Å; F65-L126 HydrophobicContact CB-CD1 4.01Å; F65-L126 HydrophobicContact CD1-CD1 3.56Å; F65-L126 HydrophobicContact CE1-CD1 4.15Å; F65-L126 HydrophobicContact CG-CD1 3.78Å; F65-L155 HydrophobicContact CB-CD1 4.21Å; F65-L155 HydrophobicContact CD2-CD2 4.16Å
66	N	95	Very high	95.9	Very high	70 Å²	70	25.4 Å²	25.4	37%	0.374	15%	0.145	S	C	.	.	H	α-helix	trans	-63.1	-46.3	179.4	-68.8	-32.9	0	0	0	111.9	V62 D63 F64 N69 M70	V62-N66 VanDerWaalsContact O-CG 3.31Å; V62-N66 PolarHBondContact O-N 2.76Å; V62-N66 PolarHBondContact O-ND2 2.99Å; D63-N66 PolarHBondContact O-N 2.92Å; D63-N66 VanDerWaalsContact O-N 3.13Å; F64-N66 VanDerWaalsContact C-N 3.34Å; F64-N66 PolarHBondContact O-N 2.96Å; N66-N69 PolarHBondContact O-N 2.88Å; N66-M70 WeakPolarHBondContact O-CG 3.29Å; N66-M70 PolarHBondContact O-N 2.8Å
67	Q	95.2	Very high	95.8	Very high	32 Å²	32	32 Å²	32	15%	0.15	18%	0.181	C	C	.	.	H	α-helix	trans	-60.3	-47.3	178.3	-70.8	178.2	27.4	0	0	112	D63 F64 N69 M70 L71 S182	D63-Q67 WeakPolarHBondContact O-CG 3.17Å; D63-Q67 PolarHBondContact O-N 2.96Å; D63-Q67 PolarHBondContact OD1-NE2 3.2Å; D63-Q67 PolarHBondContact OD2-NE2 3.46Å; F64-Q67 PolarHBondContact O-N 3.09Å; Q67-N69 VanDerWaalsContact C-N 3.32Å; Q67-N69 PolarHBondContact O-N 3.31Å; Q67-M70 HydrophobicContact CG-CE 4.49Å; Q67-M70 PolarHBondContact O-N 3.46Å; Q67-L71 WeakPolarHBondContact O-CB 3.32Å; Q67-L71 VanDerWaalsContact O-CG 3.3Å; Q67-L71 WeakPolarHBondContact O-CG 3.47Å; Q67-L71 PolarHBondContact O-N 3.02Å; Q67-S182 PolarHBondContact OE1-OG 3.06Å
68	I	97.4	Very high	95.8	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-66.5	-38.2	179.7	-64	165.1	0	0	0	110.6	F64 F65 M70 L71 Y72 M119 L155 V158 Y159	F64-I68 WeakPolarHBondContact O-CB 3.33Å; F64-I68 WeakPolarHBondContact O-CD1 3.46Å; F64-I68 WeakPolarHBondContact O-CG1 3.28Å; F64-I68 PolarHBondContact O-N 3.01Å; F65-I68 PolarHBondContact O-N 3.43Å; I68-M70 VanDerWaalsContact C-N 3.35Å; I68-L71 PolarHBondContact O-N 3.14Å; I68-Y72 WeakPolarHBondContact O-CB 3.14Å; I68-Y72 PolarHBondContact O-N 3.32Å; I68-M119 HydrophobicContact CG2-CE 3.73Å; I68-L155 HydrophobicContact CD1-CB 3.6Å; I68-L155 HydrophobicContact CD1-CD1 4.2Å; I68-L155 HydrophobicContact CD1-CD2 4.02Å; I68-L155 HydrophobicContact CD1-CG 4.13Å; I68-V158 HydrophobicContact CG2-CB 3.66Å; I68-V158 HydrophobicContact CG2-CG1 3.51Å; I68-V158 HydrophobicContact CG2-CG2 4.25Å; I68-Y159 HydrophobicContact CD1-CD2 3.94Å; I68-Y159 HydrophobicContact CD1-CE2 3.33Å; I68-Y159 HydrophobicContact CG1-CD2 4.21Å; I68-Y159 HydrophobicContact CG1-CE1 4.12Å; I68-Y159 HydrophobicContact CG1-CE2 3.49Å; I68-Y159 VanDerWaalsContact CG1-CE2 3.49Å; I68-Y159 VanDerWaalsContact CG1-CZ 3.41Å; I68-Y159 WeakPolarHBondContact CG1-OH 3.45Å
69	N	94.1	Very high	95.9	Very high	61 Å²	61	36 Å²	36	33%	0.326	20%	0.198	S	C	.	.	H	α-helix	trans	-63.5	-41.7	176.7	-168.6	37	0	0	0	111.5	F65 N66 Q67 G73	F65-N69 VanDerWaalsContact O-CB 3.23Å; F65-N69 WeakPolarHBondContact O-CB 3.25Å; F65-N69 PolarHBondContact O-N 3.02Å; N66-N69 PolarHBondContact O-N 2.88Å; Q67-N69 VanDerWaalsContact C-N 3.32Å; Q67-N69 PolarHBondContact O-N 3.31Å; N69-G73 PolarHBondContact O-N 2.86Å
70	M	95.8	Very high	96	Very high	124 Å²	124	38.5 Å²	38.5	61%	0.611	21%	0.214	S	C	*	.	H	α-helix	trans	-65.3	-46.7	174.1	-69.7	-175.6	-64.7	0	0	112.1	N66 Q67 I68 Y72 G73 T74	N66-M70 WeakPolarHBondContact O-CG 3.29Å; N66-M70 PolarHBondContact O-N 2.8Å; Q67-M70 HydrophobicContact CG-CE 4.49Å; Q67-M70 PolarHBondContact O-N 3.46Å; I68-M70 VanDerWaalsContact C-N 3.35Å; M70-Y72 VanDerWaalsContact C-N 3.35Å; M70-Y72 PolarHBondContact O-N 2.88Å; M70-G73 WeakPolarHBondContact O-CA 3.26Å; M70-G73 PolarHBondContact O-N 3.39Å; M70-G73 VanDerWaalsContact O-N 3.14Å; M70-T74 WeakPolarHBondContact O-CG2 3.39Å; M70-T74 PolarHBondContact O-N 3.3Å
71	L	94.1	Very high	96.1	Very high	21 Å²	21	44.5 Å²	44.5	11%	0.11	24%	0.242	C	C	.	.	H	α-helix	trans	-61.4	-40.4	177.6	-75	168	0	0	0	112.4	Q67 I68 G73 T74 Y159 H178 L179	Q67-L71 WeakPolarHBondContact O-CB 3.32Å; Q67-L71 VanDerWaalsContact O-CG 3.3Å; Q67-L71 WeakPolarHBondContact O-CG 3.47Å; Q67-L71 PolarHBondContact O-N 3.02Å; I68-L71 PolarHBondContact O-N 3.14Å; L71-G73 VanDerWaalsContact C-N 3.34Å; L71-T74 PolarHBondContact O-OG1 3.11Å; L71-Y159 HydrophobicContact CD1-CE1 3.97Å; L71-H178 HydrophobicContact CD2-CB 4.41Å; L71-L179 HydrophobicContact CD1-CD1 4.05Å; L71-L179 HydrophobicContact CD2-CB 4.3Å
72	Y	97	Very high	96.1	Very high	20 Å²	20	53.3 Å²	53.3	8%	0.078	28%	0.283	C	S	.	.	H	α-helix	trans	-71.7	-34.8	175.4	-174.1	-107.2	0	0	0	111.4	I68 M70 T74 I75 T76 C79 P112 I115 V158 I162	I68-Y72 WeakPolarHBondContact O-CB 3.14Å; I68-Y72 PolarHBondContact O-N 3.32Å; M70-Y72 VanDerWaalsContact C-N 3.35Å; M70-Y72 PolarHBondContact O-N 2.88Å; Y72-T74 PolarHBondContact O-N 3.32Å; Y72-I75 HydrophobicContact CD2-CD1 3.93Å; Y72-I75 HydrophobicContact CD2-CG1 4.02Å; Y72-I75 HydrophobicContact CE2-CD1 4.13Å; Y72-I75 HydrophobicContact CE2-CG1 4.4Å; Y72-I75 VanDerWaalsContact O-CG1 3.31Å; Y72-I75 WeakPolarHBondContact O-CG1 3.21Å; Y72-I75 PolarHBondContact O-N 3.31Å; Y72-T76 HydrophobicContact CD1-CG2 4.01Å; Y72-T76 HydrophobicContact CE1-CG2 3.9Å; Y72-T76 VanDerWaalsContact O-CG2 3.26Å; Y72-T76 WeakPolarHBondContact O-CG2 3.4Å; Y72-T76 PolarHBondContact O-N 3.04Å; Y72-C79 HydrophobicContact CE2-CB 4.15Å; Y72-C79 PolarHBondContact OH-SG 3.43Å; Y72-P112 WeakPolarHBondContact OH-CA 3.37Å; Y72-I115 HydrophobicContact CD1-CG2 3.65Å; Y72-I115 HydrophobicContact CD2-CD1 3.92Å; Y72-I115 HydrophobicContact CD2-CG2 4.39Å; Y72-I115 HydrophobicContact CE1-CB 4.14Å; Y72-I115 HydrophobicContact CE1-CD1 4.34Å; Y72-I115 HydrophobicContact CE1-CG2 3.53Å; Y72-I115 HydrophobicContact CE2-CD1 3.3Å; Y72-I115 HydrophobicContact CE2-CG2 4.31Å; Y72-I115 HydrophobicContact CG-CG2 4.08Å; Y72-V158 HydrophobicContact CD2-CG1 4.24Å; Y72-V158 HydrophobicContact CG-CG1 4.4Å; Y72-I162 HydrophobicContact CD2-CD1 4.47Å; Y72-I162 HydrophobicContact CD2-CG1 4.45Å
73	G	96.8	Very high	96.1	Very high	40 Å²	40	54.7 Å²	54.7	41%	0.412	29%	0.294	S	S	.	.	H	α-helix	trans	-54.3	-32.8	175.5	0	0	0	0	0	114.2	N69 M70 L71 I75 T76	N69-G73 PolarHBondContact O-N 2.86Å; M70-G73 WeakPolarHBondContact O-CA 3.26Å; M70-G73 PolarHBondContact O-N 3.39Å; M70-G73 VanDerWaalsContact O-N 3.14Å; L71-G73 VanDerWaalsContact C-N 3.34Å; G73-I75 VanDerWaalsContact C-N 3.32Å; G73-T76 PolarHBondContact O-OG1 3.38Å
74	T	96.2	Very high	96.3	Very high	50 Å²	50	54.2 Å²	54.2	31%	0.307	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-20.9	-179.3	67	0	0	0	0	112.6	M70 L71 Y72 L173 E175	M70-T74 WeakPolarHBondContact O-CG2 3.39Å; M70-T74 PolarHBondContact O-N 3.3Å; L71-T74 PolarHBondContact O-OG1 3.11Å; Y72-T74 PolarHBondContact O-N 3.32Å; T74-L173 WeakPolarHBondContact O-CD1 3.49Å; T74-E175 WeakPolarHBondContact CB-OE2 3.44Å; T74-E175 WeakPolarHBondContact CG2-OE1 3.2Å; T74-E175 WeakPolarHBondContact CG2-OE2 3.35Å; T74-E175 PolarHBondContact OG1-OE2 3.38Å
75	I	94.2	Very high	96.3	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.3	5.2	-176.9	65.8	147.9	0	0	0	114.7	Y72 G73 D77 F78 C79 I162 H166 V170 L173	Y72-I75 HydrophobicContact CD2-CD1 3.93Å; Y72-I75 HydrophobicContact CD2-CG1 4.02Å; Y72-I75 HydrophobicContact CE2-CD1 4.13Å; Y72-I75 HydrophobicContact CE2-CG1 4.4Å; Y72-I75 VanDerWaalsContact O-CG1 3.31Å; Y72-I75 WeakPolarHBondContact O-CG1 3.21Å; Y72-I75 PolarHBondContact O-N 3.31Å; G73-I75 VanDerWaalsContact C-N 3.32Å; I75-D77 PolarHBondContact O-N 2.91Å; I75-D77 VanDerWaalsContact O-N 3.14Å; I75-F78 HydrophobicContact CB-CD2 4.14Å; I75-F78 HydrophobicContact CG2-CD2 4.49Å; I75-F78 PolarHBondContact O-N 3.28Å; I75-C79 PolarHBondContact O-N 3.28Å; I75-I162 HydrophobicContact CD1-CG1 3.79Å; I75-I162 HydrophobicContact CD1-CG2 4.42Å; I75-H166 HydrophobicContact CD1-CB 3.59Å; I75-V170 HydrophobicContact CG2-CG2 4.05Å; I75-L173 HydrophobicContact CG2-CD1 4.25Å
76	T	95.2	Very high	96.3	Very high	57 Å²	57	60.3 Å²	60.3	35%	0.35	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-32.9	-175.2	56.1	0	0	0	0	113.1	Y72 G73 F78 C79	Y72-T76 HydrophobicContact CD1-CG2 4.01Å; Y72-T76 HydrophobicContact CE1-CG2 3.9Å; Y72-T76 VanDerWaalsContact O-CG2 3.26Å; Y72-T76 WeakPolarHBondContact O-CG2 3.4Å; Y72-T76 PolarHBondContact O-N 3.04Å; G73-T76 PolarHBondContact O-OG1 3.38Å; T76-F78 PolarHBondContact O-N 2.91Å; T76-C79 PolarHBondContact O-N 3.13Å
77	D	94	Very high	96.4	Very high	140 Å²	140	57 Å²	57	75%	0.749	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-20.2	-179.4	-67	-9.9	0	0	0	112.4	I75	I75-D77 PolarHBondContact O-N 2.91Å; I75-D77 VanDerWaalsContact O-N 3.14Å
78	F	96.4	Very high	96.3	Very high	82 Å²	82	56.1 Å²	56.1	36%	0.36	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-21.8	176.4	-48.9	-79.3	0	0	0	112.8	I75 T76 T80 S83 H166 S169 L173	I75-F78 HydrophobicContact CB-CD2 4.14Å; I75-F78 HydrophobicContact CG2-CD2 4.49Å; I75-F78 PolarHBondContact O-N 3.28Å; T76-F78 PolarHBondContact O-N 2.91Å; F78-T80 PolarHBondContact O-N 3.16Å; F78-S83 PolarHBondContact O-OG 2.87Å; F78-H166 PolarHBondContact O-CE1 3.21Å; F78-S169 WeakPolarHBondContact CG-OG 3.41Å; F78-L173 HydrophobicContact CE2-CD1 4.19Å
79	C	97.9	Very high	95.9	Very high	5 Å²	5	56.1 Å²	56.1	3%	0.034	31%	0.311	C	S	.	.			trans	-94.3	87.6	179.2	-171.7	0	0	0	0	110.6	Y72 I75 T76 P112 H166	Y72-C79 HydrophobicContact CE2-CB 4.15Å; Y72-C79 PolarHBondContact OH-SG 3.43Å; I75-C79 PolarHBondContact O-N 3.28Å; T76-C79 PolarHBondContact O-N 3.13Å; C79-P112 WeakPolarHBondContact O-CB 3.44Å; C79-H166 WeakPolarHBondContact CB-NE2 3.36Å
80	T	97.9	Very high	95.3	Very high	54 Å²	54	53.5 Å²	53.5	33%	0.331	30%	0.298	S	S	.	.			trans	-111.2	167.8	-176.8	72.6	0	0	0	0	111.1	F78 E82 S83 C84	F78-T80 PolarHBondContact O-N 3.16Å; T80-E82 PolarHBondContact O-N 3.01Å; T80-E82 PolarHBondContact OG1-N 2.88Å; T80-S83 PolarHBondContact N-OG 3.34Å; T80-S83 PolarHBondContact O-N 2.97Å; T80-S83 PolarHBondContact O-OG 3.31Å; T80-S83 PolarHBondContact OG1-N 3.36Å; T80-S83 PolarHBondContact OG1-OG 3.26Å; T80-C84 WeakPolarHBondContact O-CA 3.41Å; T80-C84 PolarHBondContact O-N 3.32Å
81	E	97.6	Very high	94.6	Very high	127 Å²	127	54.3 Å²	54.3	59%	0.593	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-22.5	173.2	-57.5	-160.9	151.6	0	0	112.5	P85 S110 P112	E81-P85 VanDerWaalsContact O-CA 3.25Å; E81-P85 WeakPolarHBondContact O-CA 3.49Å; E81-P85 WeakPolarHBondContact O-CB 3.32Å; E81-S110 PolarHBondContact OE1-OG 2.65Å; E81-P112 HydrophobicContact CG-CG 4.29Å
82	E	97.1	Very high	94.1	Very high	185 Å²	185	61.7 Å²	61.7	86%	0.864	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-46	177.1	-63	-179	179.6	0	0	111.8	T80	T80-E82 PolarHBondContact O-N 3.01Å; T80-E82 PolarHBondContact OG1-N 2.88Å
83	S	96.6	Very high	93.9	Very high	60 Å²	60	64.8 Å²	64.8	42%	0.42	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-34	178.7	64.7	0	0	0	0	111.9	F78 T80	F78-S83 PolarHBondContact O-OG 2.87Å; T80-S83 PolarHBondContact N-OG 3.34Å; T80-S83 PolarHBondContact O-N 2.97Å; T80-S83 PolarHBondContact O-OG 3.31Å; T80-S83 PolarHBondContact OG1-N 3.36Å; T80-S83 PolarHBondContact OG1-OG 3.26Å
84	C	97.9	Very high	93.8	Very high	5 Å²	5	67 Å²	67	3%	0.034	36%	0.355	C	S	.	.			trans	-132.3	68.9	-175.4	-67.5	0	0	0	0	111.7	T80 V86 S110 A111 H166	T80-C84 WeakPolarHBondContact O-CA 3.41Å; T80-C84 PolarHBondContact O-N 3.32Å; C84-V86 PolarHBondContact O-N 3.01Å; C84-V86 VanDerWaalsContact O-N 3.12Å; C84-S110 WeakPolarHBondContact O-CA 3.38Å; C84-S110 VanDerWaalsContact O-CB 3.32Å; C84-S110 WeakPolarHBondContact O-CB 3.39Å; C84-A111 HydrophobicContact CB-CB 3.54Å; C84-A111 PolarHBondContact O-N 3.14Å; C84-H166 PolarHBondContact SG-NE2 3.49Å
85	P	97.7	Very high	93.8	Very high	82 Å²	82	65.8 Å²	65.8	53%	0.532	35%	0.345	S	S	.	.	S	Bend	trans	-67.2	-15.1	-177	28.6	-36.9	0	0	0	113.5	E81 S110	E81-P85 VanDerWaalsContact O-CA 3.25Å; E81-P85 WeakPolarHBondContact O-CA 3.49Å; E81-P85 WeakPolarHBondContact O-CB 3.32Å; P85-S110 VanDerWaalsContact O-CA 3.28Å; P85-S110 WeakPolarHBondContact O-CA 3.43Å; P85-S110 PolarHBondContact O-N 3.15Å
86	V	97.3	Very high	93.9	Very high	51 Å²	51	69.3 Å²	69.3	31%	0.309	36%	0.362	S	S	.	.	S	Bend	trans	-134.1	142.6	172.7	-64.4	0	0	0	0	110.5	C84 S88 E94 C109	C84-V86 PolarHBondContact O-N 3.01Å; C84-V86 VanDerWaalsContact O-N 3.12Å; V86-S88 PolarHBondContact O-N 2.92Å; V86-E94 HydrophobicContact CB-CG 4.32Å; V86-C109 WeakPolarHBondContact CA-O 3.19Å
87	M	97.9	Very high	94	Very high	0 Å²	0	66.8 Å²	66.8	0%	0	35%	0.346	C	S	.	.			trans	-69.1	114.8	169.7	-176.7	65.5	-179.6	0	0	110.1	E94 Y95 C109 A111 Y114 I115 R157 H161	M87-E94 WeakPolarHBondContact O-CA 3.36Å; M87-Y95 HydrophobicContact CE-CD2 4.46Å; M87-Y95 HydrophobicContact CG-CD2 3.95Å; M87-Y95 HydrophobicContact CG-CG 4.39Å; M87-Y95 PolarHBondContact O-N 3.33Å; M87-C109 PolarHBondContact N-O 2.68Å; M87-C109 VanDerWaalsContact N-O 3.13Å; M87-A111 HydrophobicContact CB-CB 4.45Å; M87-A111 HydrophobicContact SD-CB 3.71Å; M87-Y114 HydrophobicContact CB-CD1 4.25Å; M87-Y114 HydrophobicContact CB-CD2 3.78Å; M87-Y114 HydrophobicContact CB-CG 3.63Å; M87-Y114 HydrophobicContact CE-CD1 3.92Å; M87-Y114 HydrophobicContact CE-CE1 4.17Å; M87-Y114 HydrophobicContact CG-CD1 3.52Å; M87-Y114 HydrophobicContact CG-CD2 3.82Å; M87-Y114 HydrophobicContact CG-CE1 4Å; M87-Y114 HydrophobicContact CG-CE2 4.27Å; M87-Y114 HydrophobicContact CG-CG 3.43Å; M87-Y114 VanDerWaalsContact CG-CG 3.43Å; M87-Y114 HydrophobicContact SD-CD1 3.88Å; M87-Y114 HydrophobicContact SD-CG 4.14Å; M87-I115 HydrophobicContact CE-CD1 4.12Å; M87-I115 HydrophobicContact CE-CG1 3.94Å; M87-I115 HydrophobicContact SD-CD1 4.08Å; M87-I115 HydrophobicContact SD-CG1 3.97Å; M87-R157 HydrophobicContact CE-CB 4.21Å; M87-R157 WeakPolarHBondContact CE-O 3.42Å; M87-H161 HydrophobicContact CE-CB 3.58Å; M87-H161 HydrophobicContact SD-CB 4.2Å
88	S	93.8	Very high	93.9	Very high	14 Å²	14	61.2 Å²	61.2	10%	0.098	32%	0.319	C	S	.	.	B	Isolated β-bridge	trans	-140.7	161.4	-175.3	66.6	0	0	0	0	112.9	V86 Y93 H161	V86-S88 PolarHBondContact O-N 2.92Å; S88-Y93 CarbonylContact C-O 3.54Å; S88-Y93 WeakPolarHBondContact CA-O 3.41Å; S88-Y93 VanDerWaalsContact CB-O 3.28Å; S88-Y93 WeakPolarHBondContact CB-O 3.48Å; S88-H161 PolarHBondContact O-ND1 3.38Å
89	A	89	Confident	93.5	Very high	1 Å²	1	58.7 Å²	58.7	1%	0.008	31%	0.309	C	S	.	.	S	Bend	trans	-125	80.4	165.9	0	0	0	0	0	108.4	Y93 Y95 A160 P203	A89-Y93 PolarHBondContact N-O 2.96Å; A89-Y93 WeakPolarHBondContact O-CD2 3.46Å; A89-Y95 HydrophobicContact CB-CE2 3.74Å; A89-A160 HydrophobicContact CB-CB 3.65Å; A89-P203 HydrophobicContact CB-CB 3.91Å
90	G	81.3	Confident	92.7	Very high	6 Å²	6	60.8 Å²	60.8	6%	0.062	33%	0.332	C	S	.	.	S	Bend	trans	71.8	-174.6	-172.3	0	0	0	0	0	112.5	K92	G90-K92 PolarHBondContact O-N 3.28Å
91	P	80.4	Confident	92	Very high	140 Å²	140	62.6 Å²	62.6	91%	0.909	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-13.2	-170.2	28.1	-35.7	0	0	0	114.4
92	K	84.9	Confident	91.3	Very high	177 Å²	177	63.3 Å²	63.3	77%	0.77	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.8	-18.9	-173.2	-68.1	-177	-179.6	177.1	0	114.1	G90	G90-K92 PolarHBondContact O-N 3.28Å
93	Y	91.1	Very high	90.7	Very high	85 Å²	85	56.2 Å²	56.2	33%	0.333	32%	0.318	S	S	.	.			trans	-129.7	118	-169.6	-56.1	-74.8	0	0	0	110.5	S88 A89 V202 P203	S88-Y93 CarbonylContact C-O 3.54Å; S88-Y93 WeakPolarHBondContact CA-O 3.41Å; S88-Y93 VanDerWaalsContact CB-O 3.28Å; S88-Y93 WeakPolarHBondContact CB-O 3.48Å; A89-Y93 PolarHBondContact N-O 2.96Å; A89-Y93 WeakPolarHBondContact O-CD2 3.46Å; Y93-V202 WeakPolarHBondContact OH-CG1 3.44Å; Y93-P203 HydrophobicContact CD1-CG 4.04Å; Y93-P203 HydrophobicContact CD2-CB 3.75Å; Y93-P203 HydrophobicContact CD2-CG 3.73Å; Y93-P203 HydrophobicContact CE1-CG 4.24Å; Y93-P203 HydrophobicContact CE2-CB 3.99Å; Y93-P203 HydrophobicContact CE2-CG 3.95Å; Y93-P203 HydrophobicContact CG-CB 4.25Å; Y93-P203 HydrophobicContact CG-CG 3.79Å
94	E	95.9	Very high	90.2	Very high	86 Å²	86	61.2 Å²	61.2	40%	0.402	33%	0.333	S	S	.	.	B	Isolated β-bridge	trans	-117.9	136.1	174.2	-171.8	-175.8	131.2	0	0	108.6	V86 M87 H96 K108	V86-E94 HydrophobicContact CB-CG 4.32Å; M87-E94 WeakPolarHBondContact O-CA 3.36Å; E94-H96 IonicContact OE1-CD2 2.85Å; E94-H96 IonicContact OE1-CE1 2.67Å; E94-H96 IonicContact OE1-NE2 3.81Å; E94-H96 PolarHBondContact OE1-NE2 3.27Å; E94-K108 WeakPolarHBondContact OE1-CE 3.43Å; E94-K108 IonicContact OE1-NZ 2.8Å; E94-K108 PolarHBondContact OE1-NZ 2.76Å; E94-K108 IonicContact OE2-NZ 2.69Å
95	Y	96.1	Very high	89.9	Confident	24 Å²	24	69.5 Å²	69.5	9%	0.094	37%	0.368	C	S	.	.			trans	-111	129.2	-178.5	-57.2	-72.5	0	0	0	110.9	M87 A89 R157	M87-Y95 HydrophobicContact CE-CD2 4.46Å; M87-Y95 HydrophobicContact CG-CD2 3.95Å; M87-Y95 HydrophobicContact CG-CG 4.39Å; M87-Y95 PolarHBondContact O-N 3.33Å; A89-Y95 HydrophobicContact CB-CE2 3.74Å; Y95-R157 HydrophobicContact CD1-CG 4.08Å; Y95-R157 HydrophobicContact CD2-CB 4.39Å; Y95-R157 HydrophobicContact CE1-CG 3.79Å; Y95-R157 HydrophobicContact CE2-CB 4.16Å; Y95-R157 HydrophobicContact CE2-CG 4.26Å; Y95-R157 HydrophobicContact CG-CG 4.43Å
96	H	96	Very high	89.8	Confident	75 Å²	75	69.9 Å²	69.9	35%	0.347	37%	0.371	S	S	.	.			trans	-105.4	144.8	173.3	-59	163	0	0	0	110.2	E94 P106 I107	E94-H96 IonicContact OE1-CD2 2.85Å; E94-H96 IonicContact OE1-CE1 2.67Å; E94-H96 IonicContact OE1-NE2 3.81Å; E94-H96 PolarHBondContact OE1-NE2 3.27Å; H96-P106 HydrophobicContact CB-CB 3.71Å; H96-I107 WeakPolarHBondContact CA-O 3.49Å; H96-I107 WeakPolarHBondContact CB-O 3.49Å
97	W	97	Very high	89.6	Confident	4 Å²	4	70.3 Å²	70.3	2%	0.015	37%	0.37	C	S	.	.	B	Isolated β-bridge	trans	-92.1	133.2	-175.7	-179.6	-104.3	0	0	0	111.8	D99 P106 I107 Y114 Y117 L118 W121	W97-D99 HydrophobicContact CZ2-CB 4.11Å; W97-P106 CarbonylContact O-C 3.55Å; W97-P106 VanDerWaalsContact O-CA 3.29Å; W97-P106 WeakPolarHBondContact O-CA 3.42Å; W97-I107 HydrophobicContact CB-CG1 4.11Å; W97-I107 PolarHBondContact N-O 3.47Å; W97-I107 WeakPolarHBondContact O-CG1 3.33Å; W97-I107 PolarHBondContact O-N 3.5Å; W97-Y114 HydrophobicContact CB-CD2 3.83Å; W97-Y114 HydrophobicContact CB-CE2 3.93Å; W97-Y114 HydrophobicContact CE3-CD2 4.37Å; W97-Y114 HydrophobicContact CE3-CE1 4.26Å; W97-Y114 AromaticContact CE3-CE2 3.97Å; W97-Y114 HydrophobicContact CE3-CE2 3.97Å; W97-Y114 AromaticContact CE3-CZ 3.89Å; W97-Y117 HydrophobicContact CB-CD2 4.41Å; W97-Y117 AromaticContact CD1-CD2 3.61Å; W97-Y117 AromaticContact CD1-CG 3.95Å; W97-Y117 HydrophobicContact CD2-CD2 4.48Å; W97-Y117 VanDerWaalsContact CE2-CB 3.48Å; W97-Y117 AromaticContact CG-CD2 3.91Å; W97-Y117 HydrophobicContact CG-CD2 3.91Å; W97-Y117 HydrophobicContact CG-CG 4.35Å; W97-Y117 WeakPolarHBondContact CZ2-O 3.31Å; W97-Y117 AromaticContact NE1-CG 3.88Å; W97-L118 VanDerWaalsContact CH2-CA 3.49Å; W97-L118 HydrophobicContact CH2-CB 4.18Å; W97-L118 HydrophobicContact CZ3-CB 3.73Å; W97-L118 HydrophobicContact CZ3-CG 4.18Å; W97-W121 HydrophobicContact CH2-CB 3.76Å; W97-W121 HydrophobicContact CH2-CD2 4.46Å; W97-W121 HydrophobicContact CH2-CG 4.06Å; W97-W121 HydrophobicContact CZ2-CB 3.83Å; W97-W121 HydrophobicContact CZ2-CG 4.17Å
98	A	92.5	Very high	89.6	Confident	23 Å²	23	76.9 Å²	76.9	19%	0.19	40%	0.399	C	S	.	.			trans	-155.8	136.6	165.3	0	0	0	0	0	108.5	I103 P106 R154	A98-I103 WeakPolarHBondContact CA-O 3.46Å; A98-I103 WeakPolarHBondContact CB-O 3.19Å; A98-P106 HydrophobicContact CB-CG 4.25Å; A98-R154 PolarHBondContact O-NH2 3.35Å
99	D	86.6	Confident	89.7	Confident	28 Å²	28	76.9 Å²	76.9	15%	0.15	40%	0.399	C	S	.	.			trans	-102.9	-9.8	174.8	61.6	12.1	0	0	0	112.5	W97 T101 N102 I103	W97-D99 HydrophobicContact CZ2-CB 4.11Å; D99-T101 PolarHBondContact O-N 3.47Å; D99-T101 PolarHBondContact OD1-N 3.28Å; D99-T101 PolarHBondContact OD1-OG1 3.16Å; D99-N102 PolarHBondContact OD1-N 3.45Å; D99-N102 WeakPolarHBondContact OD2-CB 3.42Å; D99-N102 PolarHBondContact OD2-ND2 2.93Å; D99-I103 PolarHBondContact N-O 3.38Å; D99-I103 VanDerWaalsContact N-O 3.15Å; D99-I103 PolarHBondContact OD1-N 3.36Å
100	G	81.2	Confident	90.2	Very high	49 Å²	49	77.3 Å²	77.3	51%	0.505	40%	0.402	S	S	.	.	S	Bend	trans	77.8	-7.5	-178.8	0	0	0	0	0	114.3	I103	G100-I103 PolarHBondContact N-O 2.93Å
101	T	83.3	Confident	91	Very high	93 Å²	93	77 Å²	77	57%	0.571	40%	0.399	S	S	*	.	S	Bend	trans	-110.8	-71.4	179.9	51.9	0	0	0	0	110.4	D99	D99-T101 PolarHBondContact O-N 3.47Å; D99-T101 PolarHBondContact OD1-N 3.28Å; D99-T101 PolarHBondContact OD1-OG1 3.16Å
102	N	82.9	Confident	91.8	Very high	141 Å²	141	71.7 Å²	71.7	75%	0.754	37%	0.365	S	S	*	.	S	Bend	trans	-80.8	-39.7	179.9	-54.2	-55.1	0	0	0	111.3	D99	D99-N102 PolarHBondContact OD1-N 3.45Å; D99-N102 WeakPolarHBondContact OD2-CB 3.42Å; D99-N102 PolarHBondContact OD2-ND2 2.93Å
103	I	85.8	Confident	92.4	Very high	36 Å²	36	67.5 Å²	67.5	19%	0.185	35%	0.346	C	S	.	.			trans	-120.3	93.3	-179.3	-59.4	171.6	0	0	0	107.9	A98 D99 G100 K105 I107	A98-I103 WeakPolarHBondContact CA-O 3.46Å; A98-I103 WeakPolarHBondContact CB-O 3.19Å; D99-I103 PolarHBondContact N-O 3.38Å; D99-I103 VanDerWaalsContact N-O 3.15Å; D99-I103 PolarHBondContact OD1-N 3.36Å; G100-I103 PolarHBondContact N-O 2.93Å; I103-K105 VanDerWaalsContact CG2-O 3.28Å; I103-K105 WeakPolarHBondContact CG2-O 3.37Å; I103-I107 HydrophobicContact CD1-CD1 3.92Å; I103-I107 HydrophobicContact CG2-CD1 4.35Å; I103-I107 HydrophobicContact CG2-CG1 4.19Å; I103-I107 HydrophobicContact CG2-CG2 3.99Å
104	K	86.3	Confident	92.8	Very high	166 Å²	166	63.5 Å²	63.5	72%	0.722	33%	0.33	S	S	*	.			trans	-79.1	-31.6	-178.3	-65.1	-176.6	178.6	179.8	0	113.6
105	K	91.1	Very high	92.9	Very high	178 Å²	178	59.4 Å²	59.4	77%	0.774	31%	0.312	S	S	*	.	S	Bend	trans	-102.3	131	179	-70.1	-174.1	178.8	-178.9	0	109.2	I103 I107	I103-K105 VanDerWaalsContact CG2-O 3.28Å; I103-K105 WeakPolarHBondContact CG2-O 3.37Å; K105-I107 PolarHBondContact O-N 2.89Å
106	P	94.5	Very high	92.9	Very high	90 Å²	90	61.6 Å²	61.6	58%	0.584	33%	0.325	S	S	*	.			trans	-53.7	126.3	176.5	-26.7	34.9	0	0	0	112	H96 W97 A98	H96-P106 HydrophobicContact CB-CB 3.71Å; W97-P106 CarbonylContact O-C 3.55Å; W97-P106 VanDerWaalsContact O-CA 3.29Å; W97-P106 WeakPolarHBondContact O-CA 3.42Å; A98-P106 HydrophobicContact CB-CG 4.25Å
107	I	94.9	Very high	93	Very high	60 Å²	60	61.4 Å²	61.4	31%	0.308	32%	0.321	S	S	.	.	B	Isolated β-bridge	trans	-107.9	142.1	176.6	63.6	170.7	0	0	0	110.6	H96 W97 I103 K105 Y117	H96-I107 WeakPolarHBondContact CA-O 3.49Å; H96-I107 WeakPolarHBondContact CB-O 3.49Å; W97-I107 HydrophobicContact CB-CG1 4.11Å; W97-I107 PolarHBondContact N-O 3.47Å; W97-I107 WeakPolarHBondContact O-CG1 3.33Å; W97-I107 PolarHBondContact O-N 3.5Å; I103-I107 HydrophobicContact CD1-CD1 3.92Å; I103-I107 HydrophobicContact CG2-CD1 4.35Å; I103-I107 HydrophobicContact CG2-CG1 4.19Å; I103-I107 HydrophobicContact CG2-CG2 3.99Å; K105-I107 PolarHBondContact O-N 2.89Å; I107-Y117 HydrophobicContact CD1-CE2 4.11Å
108	K	96.8	Very high	93	Very high	138 Å²	138	61.2 Å²	61.2	60%	0.6	32%	0.321	S	S	*	.			trans	-76.4	133.7	165.8	-69.2	-169.8	177.4	-124.5	0	109.2	E94	E94-K108 WeakPolarHBondContact OE1-CE 3.43Å; E94-K108 IonicContact OE1-NZ 2.8Å; E94-K108 PolarHBondContact OE1-NZ 2.76Å; E94-K108 IonicContact OE2-NZ 2.69Å
109	C	96.4	Very high	93.2	Very high	14 Å²	14	60.9 Å²	60.9	10%	0.095	32%	0.316	C	S	.	.			trans	-150.9	162.1	173.1	51.5	0	0	0	0	110.5	V86 M87 K113	V86-C109 WeakPolarHBondContact CA-O 3.19Å; M87-C109 PolarHBondContact N-O 2.68Å; M87-C109 VanDerWaalsContact N-O 3.13Å; C109-K113 HydrophobicContact CB-CB 4.23Å; C109-K113 HydrophobicContact CB-CD 4.03Å; C109-K113 HydrophobicContact CB-CG 4.11Å
110	S	98.4	Very high	93.7	Very high	10 Å²	10	62.5 Å²	62.5	7%	0.07	33%	0.326	C	S	.	.			trans	-58.8	154.7	171.2	58.9	0	0	0	0	111.2	E81 C84 P85 K113 Y114	E81-S110 PolarHBondContact OE1-OG 2.65Å; C84-S110 WeakPolarHBondContact O-CA 3.38Å; C84-S110 VanDerWaalsContact O-CB 3.32Å; C84-S110 WeakPolarHBondContact O-CB 3.39Å; P85-S110 VanDerWaalsContact O-CA 3.28Å; P85-S110 WeakPolarHBondContact O-CA 3.43Å; P85-S110 PolarHBondContact O-N 3.15Å; S110-K113 PolarHBondContact O-N 3.34Å; S110-K113 VanDerWaalsContact OG-CB 3.25Å; S110-K113 WeakPolarHBondContact OG-CB 3.28Å; S110-Y114 WeakPolarHBondContact O-CB 3.22Å; S110-Y114 PolarHBondContact O-N 3.21Å
111	A	98.4	Very high	94.4	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-56.3	-47.9	177.3	0	0	0	0	0	113.6	C84 M87 K113 Y114 I115 H161	C84-A111 HydrophobicContact CB-CB 3.54Å; C84-A111 PolarHBondContact O-N 3.14Å; M87-A111 HydrophobicContact CB-CB 4.45Å; M87-A111 HydrophobicContact SD-CB 3.71Å; A111-K113 VanDerWaalsContact C-N 3.28Å; A111-K113 PolarHBondContact O-N 3.29Å; A111-Y114 WeakPolarHBondContact O-CB 3.17Å; A111-Y114 PolarHBondContact O-N 2.93Å; A111-I115 VanDerWaalsContact O-CG1 3.32Å; A111-I115 WeakPolarHBondContact O-CG1 3.47Å; A111-I115 PolarHBondContact O-N 3.07Å; A111-H161 WeakPolarHBondContact CB-CE1 3.45Å; A111-H161 VanDerWaalsContact CB-NE2 3.32Å; A111-H161 WeakPolarHBondContact CB-NE2 3.47Å
112	P	98.3	Very high	95.1	Very high	29 Å²	29	57.1 Å²	57.1	19%	0.188	28%	0.281	C	S	.	.	H	α-helix	trans	-61.4	-37.3	179	22.8	-34.1	0	0	0	112.5	Y72 C79 E81 I115 D116	Y72-P112 WeakPolarHBondContact OH-CA 3.37Å; C79-P112 WeakPolarHBondContact O-CB 3.44Å; E81-P112 HydrophobicContact CG-CG 4.29Å; P112-I115 PolarHBondContact O-N 3.34Å; P112-D116 WeakPolarHBondContact O-CB 3.35Å; P112-D116 PolarHBondContact O-N 3.14Å
113	K	97.7	Very high	95.7	Very high	88 Å²	88	53 Å²	53	38%	0.383	26%	0.257	S	S	.	.	H	α-helix	trans	-69.9	-38.9	176.8	-174.3	169.1	-175.5	172.5	0	112.7	C109 S110 A111 Y117	C109-K113 HydrophobicContact CB-CB 4.23Å; C109-K113 HydrophobicContact CB-CD 4.03Å; C109-K113 HydrophobicContact CB-CG 4.11Å; S110-K113 PolarHBondContact O-N 3.34Å; S110-K113 VanDerWaalsContact OG-CB 3.25Å; S110-K113 WeakPolarHBondContact OG-CB 3.28Å; A111-K113 VanDerWaalsContact C-N 3.28Å; A111-K113 PolarHBondContact O-N 3.29Å; K113-Y117 HydrophobicContact CD-CE2 4.29Å; K113-Y117 WeakPolarHBondContact CE-OH 3.32Å; K113-Y117 HydrophobicContact CG-CD2 4.23Å; K113-Y117 HydrophobicContact CG-CE2 3.68Å; K113-Y117 VanDerWaalsContact O-CD2 3.23Å; K113-Y117 WeakPolarHBondContact O-CD2 3.34Å; K113-Y117 PolarHBondContact O-N 2.95Å; K113-Y117 VanDerWaalsContact O-N 3.11Å
114	Y	98.4	Very high	96.1	Very high	1 Å²	1	56 Å²	56	0%	0.004	27%	0.273	C	S	.	.	H	α-helix	trans	-61.4	-47.4	173.6	-175.7	-79.8	0	0	0	111.3	M87 W97 S110 A111 D116 Y117 L118 R157	M87-Y114 HydrophobicContact CB-CD1 4.25Å; M87-Y114 HydrophobicContact CB-CD2 3.78Å; M87-Y114 HydrophobicContact CB-CG 3.63Å; M87-Y114 HydrophobicContact CE-CD1 3.92Å; M87-Y114 HydrophobicContact CE-CE1 4.17Å; M87-Y114 HydrophobicContact CG-CD1 3.52Å; M87-Y114 HydrophobicContact CG-CD2 3.82Å; M87-Y114 HydrophobicContact CG-CE1 4Å; M87-Y114 HydrophobicContact CG-CE2 4.27Å; M87-Y114 HydrophobicContact CG-CG 3.43Å; M87-Y114 VanDerWaalsContact CG-CG 3.43Å; M87-Y114 HydrophobicContact SD-CD1 3.88Å; M87-Y114 HydrophobicContact SD-CG 4.14Å; W97-Y114 HydrophobicContact CB-CD2 3.83Å; W97-Y114 HydrophobicContact CB-CE2 3.93Å; W97-Y114 HydrophobicContact CE3-CD2 4.37Å; W97-Y114 HydrophobicContact CE3-CE1 4.26Å; W97-Y114 AromaticContact CE3-CE2 3.97Å; W97-Y114 HydrophobicContact CE3-CE2 3.97Å; W97-Y114 AromaticContact CE3-CZ 3.89Å; S110-Y114 WeakPolarHBondContact O-CB 3.22Å; S110-Y114 PolarHBondContact O-N 3.21Å; A111-Y114 WeakPolarHBondContact O-CB 3.17Å; A111-Y114 PolarHBondContact O-N 2.93Å; Y114-D116 VanDerWaalsContact C-N 3.34Å; Y114-Y117 PolarHBondContact O-N 2.62Å; Y114-L118 HydrophobicContact CD1-CD1 4.27Å; Y114-L118 HydrophobicContact CE1-CB 4.45Å; Y114-L118 HydrophobicContact CE1-CD1 3.64Å; Y114-L118 WeakPolarHBondContact O-CB 3.32Å; Y114-L118 PolarHBondContact O-N 3.19Å; Y114-R157 WeakPolarHBondContact OH-CD 3.49Å; Y114-R157 PolarHBondContact OH-NH1 3.03Å
115	I	98.3	Very high	96.6	Very high	1 Å²	1	50 Å²	50	1%	0.005	25%	0.248	C	C	.	.	H	α-helix	trans	-67.5	-37.8	-177.7	-65.2	169.4	0	0	0	110.2	Y72 M87 A111 P112 L118 M119 V158	Y72-I115 HydrophobicContact CD1-CG2 3.65Å; Y72-I115 HydrophobicContact CD2-CD1 3.92Å; Y72-I115 HydrophobicContact CD2-CG2 4.39Å; Y72-I115 HydrophobicContact CE1-CB 4.14Å; Y72-I115 HydrophobicContact CE1-CD1 4.34Å; Y72-I115 HydrophobicContact CE1-CG2 3.53Å; Y72-I115 HydrophobicContact CE2-CD1 3.3Å; Y72-I115 HydrophobicContact CE2-CG2 4.31Å; Y72-I115 HydrophobicContact CG-CG2 4.08Å; M87-I115 HydrophobicContact CE-CD1 4.12Å; M87-I115 HydrophobicContact CE-CG1 3.94Å; M87-I115 HydrophobicContact SD-CD1 4.08Å; M87-I115 HydrophobicContact SD-CG1 3.97Å; A111-I115 VanDerWaalsContact O-CG1 3.32Å; A111-I115 WeakPolarHBondContact O-CG1 3.47Å; A111-I115 PolarHBondContact O-N 3.07Å; P112-I115 PolarHBondContact O-N 3.34Å; I115-L118 WeakPolarHBondContact O-CB 3.4Å; I115-L118 PolarHBondContact O-N 2.87Å; I115-M119 HydrophobicContact CG2-CE 4.08Å; I115-M119 HydrophobicContact CG2-CG 4.05Å; I115-M119 VanDerWaalsContact O-CG 3.31Å; I115-M119 WeakPolarHBondContact O-CG 3.41Å; I115-M119 PolarHBondContact O-N 2.97Å; I115-V158 HydrophobicContact CD1-CG1 4.38Å; I115-V158 HydrophobicContact CG1-CG2 4.42Å; I115-V158 HydrophobicContact CG2-CG2 4.46Å
116	D	96.8	Very high	96.7	Very high	70 Å²	70	42.1 Å²	42.1	37%	0.374	21%	0.214	S	C	.	.	H	α-helix	trans	-58	-49.5	171.9	-179.4	61.8	0	0	0	112.6	T12 P112 Y114 L118 M119 T120	T12-D116 WeakPolarHBondContact CG2-OD1 3.25Å; P112-D116 WeakPolarHBondContact O-CB 3.35Å; P112-D116 PolarHBondContact O-N 3.14Å; Y114-D116 VanDerWaalsContact C-N 3.34Å; D116-L118 VanDerWaalsContact C-N 3.29Å; D116-L118 PolarHBondContact O-N 2.97Å; D116-M119 PolarHBondContact O-N 3.28Å; D116-T120 WeakPolarHBondContact O-CB 3.41Å; D116-T120 PolarHBondContact O-N 3.39Å; D116-T120 PolarHBondContact O-OG1 3.44Å
117	Y	97	Very high	96.7	Very high	70 Å²	70	41 Å²	41	28%	0.275	20%	0.203	S	C	.	.	H	α-helix	trans	-60.7	-40	174.6	-68.8	-39.2	0	0	0	112.5	W97 I107 K113 Y114 W121	W97-Y117 HydrophobicContact CB-CD2 4.41Å; W97-Y117 AromaticContact CD1-CD2 3.61Å; W97-Y117 AromaticContact CD1-CG 3.95Å; W97-Y117 HydrophobicContact CD2-CD2 4.48Å; W97-Y117 VanDerWaalsContact CE2-CB 3.48Å; W97-Y117 AromaticContact CG-CD2 3.91Å; W97-Y117 HydrophobicContact CG-CD2 3.91Å; W97-Y117 HydrophobicContact CG-CG 4.35Å; W97-Y117 WeakPolarHBondContact CZ2-O 3.31Å; W97-Y117 AromaticContact NE1-CG 3.88Å; I107-Y117 HydrophobicContact CD1-CE2 4.11Å; K113-Y117 HydrophobicContact CD-CE2 4.29Å; K113-Y117 WeakPolarHBondContact CE-OH 3.32Å; K113-Y117 HydrophobicContact CG-CD2 4.23Å; K113-Y117 HydrophobicContact CG-CE2 3.68Å; K113-Y117 VanDerWaalsContact O-CD2 3.23Å; K113-Y117 WeakPolarHBondContact O-CD2 3.34Å; K113-Y117 PolarHBondContact O-N 2.95Å; K113-Y117 VanDerWaalsContact O-N 3.11Å; Y114-Y117 PolarHBondContact O-N 2.62Å; Y117-W121 WeakPolarHBondContact O-CB 3.43Å; Y117-W121 PolarHBondContact O-N 3.27Å
118	L	97.7	Very high	96.6	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-64.3	-51.4	179	-174.7	158	0	0	0	111.5	W97 Y114 I115 D116 W121 V122 R154 L155 V158	W97-L118 VanDerWaalsContact CH2-CA 3.49Å; W97-L118 HydrophobicContact CH2-CB 4.18Å; W97-L118 HydrophobicContact CZ3-CB 3.73Å; W97-L118 HydrophobicContact CZ3-CG 4.18Å; Y114-L118 HydrophobicContact CD1-CD1 4.27Å; Y114-L118 HydrophobicContact CE1-CB 4.45Å; Y114-L118 HydrophobicContact CE1-CD1 3.64Å; Y114-L118 WeakPolarHBondContact O-CB 3.32Å; Y114-L118 PolarHBondContact O-N 3.19Å; I115-L118 WeakPolarHBondContact O-CB 3.4Å; I115-L118 PolarHBondContact O-N 2.87Å; D116-L118 VanDerWaalsContact C-N 3.29Å; D116-L118 PolarHBondContact O-N 2.97Å; L118-W121 PolarHBondContact O-N 3.25Å; L118-V122 HydrophobicContact CD2-CG2 4.01Å; L118-V122 WeakPolarHBondContact O-CG2 3.4Å; L118-V122 PolarHBondContact O-N 2.93Å; L118-R154 HydrophobicContact CD1-CB 3.74Å; L118-R154 WeakPolarHBondContact CD1-O 3.45Å; L118-R154 HydrophobicContact CG-CB 4.02Å; L118-L155 HydrophobicContact CD2-CD2 4.02Å; L118-V158 HydrophobicContact CD1-CG2 4.07Å; L118-V158 HydrophobicContact CD2-CG2 4.12Å
119	M	96.8	Very high	96.4	Very high	17 Å²	17	37.7 Å²	37.7	8%	0.084	19%	0.19	C	C	.	.	H	α-helix	trans	-65.1	-42.3	-177.8	-66.5	-50.5	-174.3	0	0	111.1	F65 I68 I115 D116 W121 V122 Q123 L155 V158	F65-M119 HydrophobicContact CD2-SD 4.07Å; F65-M119 HydrophobicContact CE2-CB 4.32Å; F65-M119 HydrophobicContact CE2-SD 3.7Å; I68-M119 HydrophobicContact CG2-CE 3.73Å; I115-M119 HydrophobicContact CG2-CE 4.08Å; I115-M119 HydrophobicContact CG2-CG 4.05Å; I115-M119 VanDerWaalsContact O-CG 3.31Å; I115-M119 WeakPolarHBondContact O-CG 3.41Å; I115-M119 PolarHBondContact O-N 2.97Å; D116-M119 PolarHBondContact O-N 3.28Å; M119-W121 PolarHBondContact O-N 3.12Å; M119-V122 PolarHBondContact O-N 3.19Å; M119-Q123 WeakPolarHBondContact O-CB 3.33Å; M119-Q123 PolarHBondContact O-N 3Å; M119-L155 HydrophobicContact SD-CD2 4.39Å; M119-V158 HydrophobicContact CE-CG1 4.17Å; M119-V158 HydrophobicContact CE-CG2 4.01Å
120	T	96.2	Very high	96.2	Very high	61 Å²	61	40.3 Å²	40.3	37%	0.374	21%	0.206	S	C	.	.	H	α-helix	trans	-59.7	-48.2	174.5	-57.9	0	0	0	0	110.9	D116 V122 Q123 D124	D116-T120 WeakPolarHBondContact O-CB 3.41Å; D116-T120 PolarHBondContact O-N 3.39Å; D116-T120 PolarHBondContact O-OG1 3.44Å; T120-V122 PolarHBondContact O-N 2.9Å; T120-Q123 PolarHBondContact O-N 2.97Å; T120-D124 PolarHBondContact O-N 3.34Å
121	W	96.9	Very high	96	Very high	30 Å²	30	40.3 Å²	40.3	11%	0.114	21%	0.205	C	C	.	.	H	α-helix	trans	-62.9	-44.2	179	176.9	84.1	0	0	0	112.1	W97 Y117 L118 M119 Q123 D124 Q125 T150 I151	W97-W121 HydrophobicContact CH2-CB 3.76Å; W97-W121 HydrophobicContact CH2-CD2 4.46Å; W97-W121 HydrophobicContact CH2-CG 4.06Å; W97-W121 HydrophobicContact CZ2-CB 3.83Å; W97-W121 HydrophobicContact CZ2-CG 4.17Å; Y117-W121 WeakPolarHBondContact O-CB 3.43Å; Y117-W121 PolarHBondContact O-N 3.27Å; L118-W121 PolarHBondContact O-N 3.25Å; M119-W121 PolarHBondContact O-N 3.12Å; W121-Q123 VanDerWaalsContact C-N 3.35Å; W121-D124 PolarHBondContact O-N 2.9Å; W121-Q125 HydrophobicContact CD2-CG 4.15Å; W121-Q125 HydrophobicContact CE3-CG 4.35Å; W121-Q125 HydrophobicContact CH2-CG 3.97Å; W121-Q125 HydrophobicContact CZ2-CG 3.75Å; W121-Q125 HydrophobicContact CZ3-CG 4.27Å; W121-Q125 WeakPolarHBondContact O-CG 3.3Å; W121-Q125 PolarHBondContact O-N 3.35Å; W121-Q125 VanDerWaalsContact O-N 3.14Å; W121-T150 HydrophobicContact CH2-CG2 3.74Å; W121-T150 HydrophobicContact CZ2-CG2 4.36Å; W121-T150 HydrophobicContact CZ3-CG2 4.49Å; W121-I151 HydrophobicContact CH2-CG1 3.87Å; W121-I151 HydrophobicContact CZ3-CB 4.45Å; W121-I151 HydrophobicContact CZ3-CG1 3.66Å
122	V	97.1	Very high	95.8	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-61.9	-45.9	177.5	174.2	0	0	0	0	110	F65 L118 M119 T120 D124 Q125 L126 I151 L155	F65-V122 HydrophobicContact CB-CG1 4.26Å; F65-V122 HydrophobicContact CD2-CB 3.91Å; F65-V122 HydrophobicContact CD2-CG1 3.38Å; F65-V122 HydrophobicContact CE2-CB 3.93Å; F65-V122 HydrophobicContact CE2-CG1 3.84Å; F65-V122 HydrophobicContact CG-CG1 3.89Å; L118-V122 HydrophobicContact CD2-CG2 4.01Å; L118-V122 WeakPolarHBondContact O-CG2 3.4Å; L118-V122 PolarHBondContact O-N 2.93Å; M119-V122 PolarHBondContact O-N 3.19Å; T120-V122 PolarHBondContact O-N 2.9Å; V122-D124 VanDerWaalsContact C-N 3.33Å; V122-D124 PolarHBondContact O-N 3.27Å; V122-Q125 WeakPolarHBondContact O-CB 3.29Å; V122-Q125 PolarHBondContact O-N 3.18Å; V122-L126 HydrophobicContact CG1-CD1 3.97Å; V122-L126 HydrophobicContact CG1-CG 4.11Å; V122-L126 WeakPolarHBondContact O-CG 3.39Å; V122-L126 PolarHBondContact O-N 3.32Å; V122-I151 HydrophobicContact CG1-CG2 3.69Å; V122-I151 HydrophobicContact CG2-CG2 4.01Å; V122-L155 HydrophobicContact CG2-CD2 4.39Å
123	Q	95.7	Very high	95.5	Very high	55 Å²	55	39.9 Å²	39.9	26%	0.257	20%	0.201	S	C	.	.	H	α-helix	trans	-56	-46.8	177.3	-175.2	65.2	60.5	0	0	111.7	F65 M119 T120 W121 Q125 L126 D127	F65-Q123 HydrophobicContact CZ-CB 4.13Å; M119-Q123 WeakPolarHBondContact O-CB 3.33Å; M119-Q123 PolarHBondContact O-N 3Å; T120-Q123 PolarHBondContact O-N 2.97Å; W121-Q123 VanDerWaalsContact C-N 3.35Å; Q123-Q125 VanDerWaalsContact C-N 3.25Å; Q123-Q125 PolarHBondContact O-N 3.11Å; Q123-L126 PolarHBondContact O-N 2.93Å; Q123-L126 VanDerWaalsContact O-N 3.11Å; Q123-D127 VanDerWaalsContact NE2-CG 3.27Å; Q123-D127 PolarHBondContact NE2-OD1 3.31Å; Q123-D127 PolarHBondContact NE2-OD2 2.98Å; Q123-D127 VanDerWaalsContact NE2-OD2 3.12Å; Q123-D127 WeakPolarHBondContact O-CB 3.49Å; Q123-D127 PolarHBondContact O-N 2.86Å
124	D	95.6	Very high	94.8	Very high	98 Å²	98	37.6 Å²	37.6	52%	0.524	20%	0.196	S	C	.	.	H	α-helix	trans	-58.9	-37.1	177.1	-71	-22.8	0	0	0	112	T120 W121 V122 D128	T120-D124 PolarHBondContact O-N 3.34Å; W121-D124 PolarHBondContact O-N 2.9Å; V122-D124 VanDerWaalsContact C-N 3.33Å; V122-D124 PolarHBondContact O-N 3.27Å; D124-D128 PolarHBondContact O-N 2.81Å
125	Q	95.2	Very high	94.1	Very high	40 Å²	40	44.8 Å²	44.8	19%	0.187	23%	0.227	C	C	.	.	H	α-helix	trans	-69	-41.1	175.2	-59.3	-49	134.5	0	0	112.5	W121 V122 Q123 D127 D128 F132 I151	W121-Q125 HydrophobicContact CD2-CG 4.15Å; W121-Q125 HydrophobicContact CE3-CG 4.35Å; W121-Q125 HydrophobicContact CH2-CG 3.97Å; W121-Q125 HydrophobicContact CZ2-CG 3.75Å; W121-Q125 HydrophobicContact CZ3-CG 4.27Å; W121-Q125 WeakPolarHBondContact O-CG 3.3Å; W121-Q125 PolarHBondContact O-N 3.35Å; W121-Q125 VanDerWaalsContact O-N 3.14Å; V122-Q125 WeakPolarHBondContact O-CB 3.29Å; V122-Q125 PolarHBondContact O-N 3.18Å; Q123-Q125 VanDerWaalsContact C-N 3.25Å; Q123-Q125 PolarHBondContact O-N 3.11Å; Q125-D127 VanDerWaalsContact C-N 3.31Å; Q125-D128 PolarHBondContact O-N 2.99Å; Q125-F132 WeakPolarHBondContact O-CD2 3.38Å; Q125-I151 HydrophobicContact CB-CD1 3.97Å; Q125-I151 HydrophobicContact CG-CD1 4.44Å
126	L	94.1	Very high	93.3	Very high	12 Å²	12	51.6 Å²	51.6	6%	0.063	26%	0.262	C	S	.	.	H	α-helix	trans	-69.6	-29.8	179.2	-62.1	-178.2	0	0	0	112	T61 V62 F65 V122 Q123 F132 I151	T61-L126 HydrophobicContact CG2-CD2 4.39Å; V62-L126 HydrophobicContact CG2-CD1 4.25Å; V62-L126 HydrophobicContact CG2-CD2 3.89Å; F65-L126 HydrophobicContact CB-CD1 4.01Å; F65-L126 HydrophobicContact CD1-CD1 3.56Å; F65-L126 HydrophobicContact CE1-CD1 4.15Å; F65-L126 HydrophobicContact CG-CD1 3.78Å; V122-L126 HydrophobicContact CG1-CD1 3.97Å; V122-L126 HydrophobicContact CG1-CG 4.11Å; V122-L126 WeakPolarHBondContact O-CG 3.39Å; V122-L126 PolarHBondContact O-N 3.32Å; Q123-L126 PolarHBondContact O-N 2.93Å; Q123-L126 VanDerWaalsContact O-N 3.11Å; L126-F132 HydrophobicContact CD2-CD1 3.87Å; L126-F132 HydrophobicContact CD2-CD2 4.14Å; L126-F132 HydrophobicContact CD2-CE1 3.48Å; L126-F132 VanDerWaalsContact CD2-CE1 3.48Å; L126-F132 HydrophobicContact CD2-CE2 3.79Å; L126-F132 HydrophobicContact CD2-CG 4.19Å; L126-F132 HydrophobicContact CD2-CZ 3.45Å; L126-F132 VanDerWaalsContact CD2-CZ 3.45Å; L126-I151 HydrophobicContact CD2-CD1 4.47Å
127	D	93.5	Very high	92.6	Very high	68 Å²	68	52 Å²	52	36%	0.364	28%	0.282	S	S	.	.	H	α-helix	trans	-79.1	-21.4	178.2	-73.4	-20.4	0	0	0	113	K17 Q123 Q125 E129	K17-D127 PolarHBondContact NZ-O 3.23Å; Q123-D127 VanDerWaalsContact NE2-CG 3.27Å; Q123-D127 PolarHBondContact NE2-OD1 3.31Å; Q123-D127 PolarHBondContact NE2-OD2 2.98Å; Q123-D127 VanDerWaalsContact NE2-OD2 3.12Å; Q123-D127 WeakPolarHBondContact O-CB 3.49Å; Q123-D127 PolarHBondContact O-N 2.86Å; Q125-D127 VanDerWaalsContact C-N 3.31Å; D127-E129 PolarHBondContact O-N 3.29Å
128	D	93.7	Very high	92.3	Very high	54 Å²	54	52 Å²	52	29%	0.289	29%	0.289	S	S	.	.			trans	-68.3	99	176.2	-176.6	-4.4	0	0	0	111.2	D124 Q125 T130 L131 F132	D124-D128 PolarHBondContact O-N 2.81Å; Q125-D128 PolarHBondContact O-N 2.99Å; D128-T130 PolarHBondContact O-N 3.46Å; D128-T130 WeakPolarHBondContact OD1-CA 3.43Å; D128-T130 VanDerWaalsContact OD1-CB 3.22Å; D128-T130 WeakPolarHBondContact OD1-CB 3.31Å; D128-T130 WeakPolarHBondContact OD1-CG2 3.4Å; D128-T130 PolarHBondContact OD1-N 2.9Å; D128-T130 PolarHBondContact OD1-OG1 3.47Å; D128-T130 PolarHBondContact OD2-OG1 2.82Å; D128-T130 VanDerWaalsContact OD2-OG1 3.14Å; D128-L131 HydrophobicContact CB-CB 4.26Å; D128-L131 HydrophobicContact CB-CD1 4.17Å; D128-L131 HydrophobicContact CB-CG 4.38Å; D128-L131 PolarHBondContact O-N 2.95Å; D128-L131 WeakPolarHBondContact OD2-CD1 3.45Å; D128-L131 WeakPolarHBondContact OD2-CG 3.17Å; D128-F132 PolarHBondContact O-N 3.47Å
129	E	92.1	Very high	92	Very high	74 Å²	74	57.1 Å²	57.1	35%	0.346	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54	-18.7	175.1	-71.6	-69.1	163.6	0	0	114.3	K17 D127 P133 S134	K17-E129 WeakPolarHBondContact CE-OE1 3.19Å; K17-E129 VanDerWaalsContact NZ-CD 3.34Å; K17-E129 IonicContact NZ-OE1 2.73Å; K17-E129 PolarHBondContact NZ-OE1 3.48Å; D127-E129 PolarHBondContact O-N 3.29Å; E129-P133 WeakPolarHBondContact O-CA 3.4Å; E129-S134 VanDerWaalsContact CD-OG 3.23Å; E129-S134 PolarHBondContact OE1-OG 2.91Å; E129-S134 PolarHBondContact OE2-N 3.48Å; E129-S134 PolarHBondContact OE2-OG 3.32Å
130	T	93	Very high	91.9	Very high	69 Å²	69	57.9 Å²	57.9	42%	0.423	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-17.7	177.1	79.8	0	0	0	0	112.5	D128 K141	D128-T130 PolarHBondContact O-N 3.46Å; D128-T130 WeakPolarHBondContact OD1-CA 3.43Å; D128-T130 VanDerWaalsContact OD1-CB 3.22Å; D128-T130 WeakPolarHBondContact OD1-CB 3.31Å; D128-T130 WeakPolarHBondContact OD1-CG2 3.4Å; D128-T130 PolarHBondContact OD1-N 2.9Å; D128-T130 PolarHBondContact OD1-OG1 3.47Å; D128-T130 PolarHBondContact OD2-OG1 2.82Å; D128-T130 VanDerWaalsContact OD2-OG1 3.14Å; T130-K141 VanDerWaalsContact CB-NZ 3.32Å; T130-K141 WeakPolarHBondContact O-CD 3.37Å; T130-K141 WeakPolarHBondContact O-CE 3.5Å; T130-K141 WeakPolarHBondContact O-CG 3.43Å; T130-K141 WeakPolarHBondContact OG1-CE 3.39Å; T130-K141 PolarHBondContact OG1-NZ 3.41Å
131	L	92.9	Very high	91.8	Very high	10 Å²	10	59.4 Å²	59.4	5%	0.052	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.5	-43.8	175.5	-70.1	173.6	0	0	0	111.6	D128 P133 F140 K141 F144 V147	D128-L131 HydrophobicContact CB-CB 4.26Å; D128-L131 HydrophobicContact CB-CD1 4.17Å; D128-L131 HydrophobicContact CB-CG 4.38Å; D128-L131 PolarHBondContact O-N 2.95Å; D128-L131 WeakPolarHBondContact OD2-CD1 3.45Å; D128-L131 WeakPolarHBondContact OD2-CG 3.17Å; L131-P133 WeakPolarHBondContact O-CD 3.29Å; L131-F140 WeakPolarHBondContact O-CD1 3.24Å; L131-K141 HydrophobicContact CD2-CD 4.01Å; L131-F144 WeakPolarHBondContact O-CD2 3.44Å; L131-V147 HydrophobicContact CD1-CG1 4.42Å; L131-V147 HydrophobicContact CD2-CG2 4.16Å
132	F	94.3	Very high	91.7	Very high	14 Å²	14	70.6 Å²	70.6	6%	0.061	37%	0.369	C	S	.	.	S	Bend	trans	-118.9	78.9	177.5	-74	-100.9	0	0	0	109.1	A58 T61 V62 Q125 L126 D128 S134 F144 I151	A58-F132 HydrophobicContact CB-CD1 3.92Å; A58-F132 HydrophobicContact CB-CE1 3.94Å; T61-F132 HydrophobicContact CG2-CZ 4.35Å; V62-F132 HydrophobicContact CG2-CD1 4.45Å; Q125-F132 WeakPolarHBondContact O-CD2 3.38Å; L126-F132 HydrophobicContact CD2-CD1 3.87Å; L126-F132 HydrophobicContact CD2-CD2 4.14Å; L126-F132 HydrophobicContact CD2-CE1 3.48Å; L126-F132 VanDerWaalsContact CD2-CE1 3.48Å; L126-F132 HydrophobicContact CD2-CE2 3.79Å; L126-F132 HydrophobicContact CD2-CG 4.19Å; L126-F132 HydrophobicContact CD2-CZ 3.45Å; L126-F132 VanDerWaalsContact CD2-CZ 3.45Å; D128-F132 PolarHBondContact O-N 3.47Å; F132-S134 PolarHBondContact O-N 3.45Å; F132-F144 HydrophobicContact CD1-CE2 4.28Å; F132-F144 AromaticContact CE1-CE2 3.85Å; F132-F144 HydrophobicContact CE1-CE2 3.85Å; F132-F144 HydrophobicContact CE1-CZ 4.45Å; F132-F144 HydrophobicContact CE2-CE2 4.2Å; F132-F144 AromaticContact CZ-CE2 3.8Å; F132-F144 HydrophobicContact CZ-CE2 3.8Å; F132-I151 HydrophobicContact CE2-CD1 3.93Å; F132-I151 HydrophobicContact CZ-CD1 3.9Å
133	P	92	Very high	91.6	Very high	6 Å²	6	74.5 Å²	74.5	4%	0.039	39%	0.39	C	S	.	.			trans	-64.1	130	179.6	26.9	-33.4	0	0	0	110.8	Q25 E129 L131 V138 F140	Q25-P133 PolarHBondContact NE2-O 2.89Å; E129-P133 WeakPolarHBondContact O-CA 3.4Å; L131-P133 WeakPolarHBondContact O-CD 3.29Å; P133-V138 HydrophobicContact CB-CB 3.88Å; P133-V138 HydrophobicContact CB-CG1 3.76Å; P133-F140 HydrophobicContact CG-CD1 4.17Å; P133-F140 HydrophobicContact CG-CE1 4.12Å; P133-F140 HydrophobicContact CG-CG 4.41Å; P133-F140 HydrophobicContact CG-CZ 4.29Å
134	S	83.7	Confident	91.7	Very high	39 Å²	39	72 Å²	72	27%	0.273	38%	0.378	S	S	.	.			trans	-94.1	-11.6	175	63.9	0	0	0	0	113.5	E129 F132	E129-S134 VanDerWaalsContact CD-OG 3.23Å; E129-S134 PolarHBondContact OE1-OG 2.91Å; E129-S134 PolarHBondContact OE2-N 3.48Å; E129-S134 PolarHBondContact OE2-OG 3.32Å; F132-S134 PolarHBondContact O-N 3.45Å
135	K	83.5	Confident	91.8	Very high	153 Å²	153	69.5 Å²	69.5	67%	0.665	36%	0.364	S	S	*	.	S	Bend	trans	-95.6	127.7	-176.6	-66.9	-178.3	-176.6	177.3	0	110.9	G137 V138	K135-G137 PolarHBondContact O-N 3.47Å; K135-V138 HydrophobicContact CB-CG2 3.83Å; K135-V138 WeakPolarHBondContact O-CB 3.28Å; K135-V138 PolarHBondContact O-N 2.83Å
136	I	80.6	Confident	91.9	Very high	144 Å²	144	71.3 Å²	71.3	74%	0.738	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	132.8	174.4	-58.6	174.1	0	0	0	109.9
137	G	83.3	Confident	92	Very high	77 Å²	77	71.6 Å²	71.6	79%	0.794	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.4	-1.4	177.9	0	0	0	0	0	115.2	K135	K135-G137 PolarHBondContact O-N 3.47Å
138	V	90.1	Very high	92.2	Very high	70 Å²	70	68.4 Å²	68.4	42%	0.424	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-87.3	119.6	171.2	-179.8	0	0	0	0	109.3	P133 K135	P133-V138 HydrophobicContact CB-CB 3.88Å; P133-V138 HydrophobicContact CB-CG1 3.76Å; K135-V138 HydrophobicContact CB-CG2 3.83Å; K135-V138 WeakPolarHBondContact O-CB 3.28Å; K135-V138 PolarHBondContact O-N 2.83Å
139	P	92.1	Very high	92.4	Very high	109 Å²	109	69.4 Å²	69.4	71%	0.708	37%	0.368	S	S	*	.	P	Polyproline II helix	trans	-75.9	149	-177.6	30.9	-35.2	0	0	0	112.2
140	F	94.6	Very high	92.7	Very high	32 Å²	32	67.8 Å²	67.8	14%	0.14	36%	0.363	C	S	.	.	P	Polyproline II helix	trans	-62	149.3	169.2	-71.3	-87.7	0	0	0	112.3	N54 E55 A58 L131 P133 F144	N54-F140 HydrophobicContact CB-CB 4.18Å; N54-F140 HydrophobicContact CB-CD1 4.22Å; N54-F140 HydrophobicContact CB-CD2 3.4Å; N54-F140 VanDerWaalsContact CB-CD2 3.4Å; N54-F140 HydrophobicContact CB-CE1 4.49Å; N54-F140 HydrophobicContact CB-CE2 3.73Å; N54-F140 HydrophobicContact CB-CG 3.67Å; N54-F140 HydrophobicContact CB-CZ 4.27Å; E55-F140 HydrophobicContact CB-CE2 4.18Å; E55-F140 WeakPolarHBondContact OE2-CE2 3.46Å; E55-F140 WeakPolarHBondContact OE2-CZ 3.36Å; A58-F140 HydrophobicContact CB-CE1 3.78Å; A58-F140 HydrophobicContact CB-CZ 3.69Å; L131-F140 WeakPolarHBondContact O-CD1 3.24Å; P133-F140 HydrophobicContact CG-CD1 4.17Å; P133-F140 HydrophobicContact CG-CE1 4.12Å; P133-F140 HydrophobicContact CG-CG 4.41Å; P133-F140 HydrophobicContact CG-CZ 4.29Å; F140-F144 HydrophobicContact CB-CB 4.05Å; F140-F144 HydrophobicContact CB-CG 4.24Å; F140-F144 HydrophobicContact CD1-CB 4.19Å; F140-F144 HydrophobicContact CD1-CD1 4.11Å; F140-F144 AromaticContact CD1-CD2 3.36Å; F140-F144 HydrophobicContact CD1-CD2 3.36Å; F140-F144 HydrophobicContact CD1-CE1 4.39Å; F140-F144 AromaticContact CD1-CE2 3.66Å; F140-F144 HydrophobicContact CD1-CE2 3.66Å; F140-F144 AromaticContact CD1-CG 3.59Å; F140-F144 HydrophobicContact CD1-CG 3.59Å; F140-F144 HydrophobicContact CD1-CZ 4.17Å; F140-F144 AromaticContact CE1-CD2 3.76Å; F140-F144 HydrophobicContact CE1-CD2 3.76Å; F140-F144 HydrophobicContact CE1-CE1 4.44Å; F140-F144 AromaticContact CE1-CE2 3.53Å; F140-F144 HydrophobicContact CE1-CE2 3.53Å; F140-F144 HydrophobicContact CE1-CG 4.29Å; F140-F144 AromaticContact CE1-CZ 3.91Å; F140-F144 HydrophobicContact CE1-CZ 3.91Å; F140-F144 HydrophobicContact CG-CD1 4.48Å; F140-F144 HydrophobicContact CG-CD2 4.36Å; F140-F144 HydrophobicContact CG-CG 4.18Å
141	K	94.3	Very high	92.9	Very high	94 Å²	94	64.5 Å²	64.5	41%	0.409	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-64.9	150.9	169.7	-81.8	177.8	177.3	171.1	0	111.5	T130 L131 N143 F144	T130-K141 VanDerWaalsContact CB-NZ 3.32Å; T130-K141 WeakPolarHBondContact O-CD 3.37Å; T130-K141 WeakPolarHBondContact O-CE 3.5Å; T130-K141 WeakPolarHBondContact O-CG 3.43Å; T130-K141 WeakPolarHBondContact OG1-CE 3.39Å; T130-K141 PolarHBondContact OG1-NZ 3.41Å; L131-K141 HydrophobicContact CD2-CD 4.01Å; K141-N143 VanDerWaalsContact CB-OD1 3.27Å; K141-N143 WeakPolarHBondContact CB-OD1 3.48Å; K141-N143 PolarHBondContact O-N 3.18Å; K141-F144 WeakPolarHBondContact O-CB 3.39Å; K141-F144 PolarHBondContact O-N 3.34Å
142	R	93.8	Very high	93.2	Very high	265 Å²	265	64 Å²	64	100%	1	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-27.6	177.2	-65.5	-176.6	179.5	176.4	0.1	114.1
143	N	95.5	Very high	93.4	Very high	82 Å²	82	66.3 Å²	66.3	44%	0.439	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	3.8	179.6	71.4	-41.5	0	0	0	113.8	K141 M145 S146 V147	K141-N143 VanDerWaalsContact CB-OD1 3.27Å; K141-N143 WeakPolarHBondContact CB-OD1 3.48Å; K141-N143 PolarHBondContact O-N 3.18Å; N143-M145 VanDerWaalsContact C-N 3.32Å; N143-M145 PolarHBondContact O-N 2.9Å; N143-S146 WeakPolarHBondContact O-CB 3.47Å; N143-S146 PolarHBondContact O-N 2.98Å; N143-V147 PolarHBondContact O-N 3.41Å; N143-V147 VanDerWaalsContact O-N 3.16Å
144	F	97.2	Very high	93.7	Very high	2 Å²	2	67.2 Å²	67.2	1%	0.009	35%	0.353	C	S	.	.	H	α-helix	trans	-49.5	-51.7	-177.4	166.5	-98.3	0	0	0	112.1	N54 V57 A58 L131 F132 F140 K141 S146 V147 A148	N54-F144 HydrophobicContact CB-CD1 3.59Å; N54-F144 HydrophobicContact CB-CE1 3.62Å; N54-F144 HydrophobicContact CB-CG 4.48Å; N54-F144 HydrophobicContact CB-CZ 4.5Å; N54-F144 WeakPolarHBondContact O-CE1 3.39Å; N54-F144 WeakPolarHBondContact O-CZ 3.47Å; N54-F144 WeakPolarHBondContact OD1-CD1 3.38Å; V57-F144 HydrophobicContact CB-CE1 4.13Å; V57-F144 HydrophobicContact CB-CZ 4.38Å; V57-F144 HydrophobicContact CG1-CE1 3.99Å; V57-F144 HydrophobicContact CG1-CZ 4.09Å; A58-F144 HydrophobicContact CB-CE2 4.07Å; A58-F144 HydrophobicContact CB-CZ 3.75Å; L131-F144 WeakPolarHBondContact O-CD2 3.44Å; F132-F144 HydrophobicContact CD1-CE2 4.28Å; F132-F144 AromaticContact CE1-CE2 3.85Å; F132-F144 HydrophobicContact CE1-CE2 3.85Å; F132-F144 HydrophobicContact CE1-CZ 4.45Å; F132-F144 HydrophobicContact CE2-CE2 4.2Å; F132-F144 AromaticContact CZ-CE2 3.8Å; F132-F144 HydrophobicContact CZ-CE2 3.8Å; F140-F144 HydrophobicContact CB-CB 4.05Å; F140-F144 HydrophobicContact CB-CG 4.24Å; F140-F144 HydrophobicContact CD1-CB 4.19Å; F140-F144 HydrophobicContact CD1-CD1 4.11Å; F140-F144 AromaticContact CD1-CD2 3.36Å; F140-F144 HydrophobicContact CD1-CD2 3.36Å; F140-F144 HydrophobicContact CD1-CE1 4.39Å; F140-F144 AromaticContact CD1-CE2 3.66Å; F140-F144 HydrophobicContact CD1-CE2 3.66Å; F140-F144 AromaticContact CD1-CG 3.59Å; F140-F144 HydrophobicContact CD1-CG 3.59Å; F140-F144 HydrophobicContact CD1-CZ 4.17Å; F140-F144 AromaticContact CE1-CD2 3.76Å; F140-F144 HydrophobicContact CE1-CD2 3.76Å; F140-F144 HydrophobicContact CE1-CE1 4.44Å; F140-F144 AromaticContact CE1-CE2 3.53Å; F140-F144 HydrophobicContact CE1-CE2 3.53Å; F140-F144 HydrophobicContact CE1-CG 4.29Å; F140-F144 AromaticContact CE1-CZ 3.91Å; F140-F144 HydrophobicContact CE1-CZ 3.91Å; F140-F144 HydrophobicContact CG-CD1 4.48Å; F140-F144 HydrophobicContact CG-CD2 4.36Å; F140-F144 HydrophobicContact CG-CG 4.18Å; K141-F144 WeakPolarHBondContact O-CB 3.39Å; K141-F144 PolarHBondContact O-N 3.34Å; F144-S146 PolarHBondContact O-N 3.15Å; F144-V147 CarbonylContact O-C 3.58Å; F144-V147 WeakPolarHBondContact O-CA 3.23Å; F144-V147 WeakPolarHBondContact O-CB 3.42Å; F144-V147 PolarHBondContact O-N 2.91Å; F144-A148 HydrophobicContact CE1-CB 4.3Å; F144-A148 HydrophobicContact CZ-CB 4.18Å; F144-A148 PolarHBondContact O-N 2.89Å
145	M	97.7	Very high	94.4	Very high	45 Å²	45	65.4 Å²	65.4	22%	0.222	34%	0.34	C	S	.	.	H	α-helix	trans	-59.4	-36.3	-178	-168.6	57	62.1	0	0	112.4	L53 N54 V57 N143 V147 A148 K149 L195	L53-M145 HydrophobicContact CD2-CE 4.25Å; L53-M145 HydrophobicContact CG-CE 4.15Å; N54-M145 WeakPolarHBondContact OD1-CE 3.33Å; V57-M145 HydrophobicContact CB-CE 4.41Å; V57-M145 HydrophobicContact CG1-CE 4.48Å; V57-M145 HydrophobicContact CG1-SD 4.43Å; V57-M145 HydrophobicContact CG2-CE 4.11Å; N143-M145 VanDerWaalsContact C-N 3.32Å; N143-M145 PolarHBondContact O-N 2.9Å; M145-V147 VanDerWaalsContact C-N 3.32Å; M145-V147 PolarHBondContact O-N 3.33Å; M145-A148 PolarHBondContact O-N 3.31Å; M145-K149 WeakPolarHBondContact O-CB 3.39Å; M145-K149 VanDerWaalsContact O-CG 3.24Å; M145-K149 WeakPolarHBondContact O-CG 3.24Å; M145-K149 PolarHBondContact O-N 3.14Å; M145-L195 HydrophobicContact SD-CD2 3.58Å; M145-L195 VanDerWaalsContact SD-CD2 3.58Å
146	S	97.2	Very high	95.1	Very high	78 Å²	78	58.2 Å²	58.2	55%	0.545	31%	0.309	S	S	.	.	H	α-helix	trans	-65.8	-36.1	175	-174.7	0	0	0	0	112.3	N143 F144 T150	N143-S146 WeakPolarHBondContact O-CB 3.47Å; N143-S146 PolarHBondContact O-N 2.98Å; F144-S146 PolarHBondContact O-N 3.15Å; S146-T150 PolarHBondContact O-N 3.22Å; S146-T150 PolarHBondContact O-OG1 3.19Å
147	V	96.8	Very high	95.9	Very high	19 Å²	19	53 Å²	53	12%	0.115	28%	0.28	C	S	.	.	H	α-helix	trans	-70.7	-48.1	176.7	177.2	0	0	0	0	110	L131 N143 F144 M145 K149 T150 I151	L131-V147 HydrophobicContact CD1-CG1 4.42Å; L131-V147 HydrophobicContact CD2-CG2 4.16Å; N143-V147 PolarHBondContact O-N 3.41Å; N143-V147 VanDerWaalsContact O-N 3.16Å; F144-V147 CarbonylContact O-C 3.58Å; F144-V147 WeakPolarHBondContact O-CA 3.23Å; F144-V147 WeakPolarHBondContact O-CB 3.42Å; F144-V147 PolarHBondContact O-N 2.91Å; M145-V147 VanDerWaalsContact C-N 3.32Å; M145-V147 PolarHBondContact O-N 3.33Å; V147-K149 PolarHBondContact O-N 2.95Å; V147-T150 WeakPolarHBondContact O-CA 3.41Å; V147-T150 WeakPolarHBondContact O-CB 3.25Å; V147-T150 PolarHBondContact O-N 3.49Å; V147-I151 HydrophobicContact CG1-CD1 3.94Å; V147-I151 HydrophobicContact CG1-CG1 4.46Å; V147-I151 WeakPolarHBondContact O-CG1 3.3Å; V147-I151 PolarHBondContact O-N 2.89Å
148	A	98	Very high	96.7	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-56.7	-46.2	177	0	0	0	0	0	112.1	V57 F144 M145 T150 I151 L152	V57-A148 HydrophobicContact CG1-CB 3.68Å; F144-A148 HydrophobicContact CE1-CB 4.3Å; F144-A148 HydrophobicContact CZ-CB 4.18Å; F144-A148 PolarHBondContact O-N 2.89Å; M145-A148 PolarHBondContact O-N 3.31Å; A148-T150 VanDerWaalsContact C-N 3.25Å; A148-T150 PolarHBondContact O-N 3.29Å; A148-I151 PolarHBondContact O-N 3.45Å; A148-L152 WeakPolarHBondContact O-CG 3.31Å; A148-L152 PolarHBondContact O-N 3.28Å
149	K	98.3	Very high	97.1	Very high	76 Å²	76	46 Å²	46	33%	0.33	22%	0.222	S	C	.	.	H	α-helix	trans	-57.4	-38	173.2	-71.7	-170.2	-175.4	-153.2	0	112.8	M145 V147 K153 N194 L195	M145-K149 WeakPolarHBondContact O-CB 3.39Å; M145-K149 VanDerWaalsContact O-CG 3.24Å; M145-K149 WeakPolarHBondContact O-CG 3.24Å; M145-K149 PolarHBondContact O-N 3.14Å; V147-K149 PolarHBondContact O-N 2.95Å; K149-K153 WeakPolarHBondContact O-CB 3.36Å; K149-K153 PolarHBondContact O-N 2.9Å; K149-N194 WeakPolarHBondContact CE-O 3.41Å; K149-N194 PolarHBondContact NZ-O 3.02Å; K149-L195 WeakPolarHBondContact CB-O 3.49Å; K149-L195 HydrophobicContact CG-CB 4.3Å; K149-L195 HydrophobicContact CG-CD2 4.06Å; K149-L195 VanDerWaalsContact CG-O 3.31Å; K149-L195 WeakPolarHBondContact CG-O 3.45Å
150	T	97.5	Very high	97.3	Very high	39 Å²	39	40.9 Å²	40.9	24%	0.239	19%	0.189	C	C	.	.	H	α-helix	trans	-69.9	-41.4	178.3	-58.3	0	0	0	0	111.7	W121 S146 V147 A148 R154	W121-T150 HydrophobicContact CH2-CG2 3.74Å; W121-T150 HydrophobicContact CZ2-CG2 4.36Å; W121-T150 HydrophobicContact CZ3-CG2 4.49Å; S146-T150 PolarHBondContact O-N 3.22Å; S146-T150 PolarHBondContact O-OG1 3.19Å; V147-T150 WeakPolarHBondContact O-CA 3.41Å; V147-T150 WeakPolarHBondContact O-CB 3.25Å; V147-T150 PolarHBondContact O-N 3.49Å; A148-T150 VanDerWaalsContact C-N 3.25Å; A148-T150 PolarHBondContact O-N 3.29Å; T150-R154 WeakPolarHBondContact O-CG 2.94Å; T150-R154 PolarHBondContact O-N 3.18Å; T150-R154 VanDerWaalsContact O-N 3.12Å
151	I	98.3	Very high	97.4	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-60.1	-56.5	174.7	-68	165.9	0	0	0	109.9	T61 W121 V122 Q125 L126 F132 V147 A148 K153 R154 L155	T61-I151 HydrophobicContact CG2-CB 4.22Å; T61-I151 HydrophobicContact CG2-CD1 4.39Å; T61-I151 HydrophobicContact CG2-CG2 3.56Å; W121-I151 HydrophobicContact CH2-CG1 3.87Å; W121-I151 HydrophobicContact CZ3-CB 4.45Å; W121-I151 HydrophobicContact CZ3-CG1 3.66Å; V122-I151 HydrophobicContact CG1-CG2 3.69Å; V122-I151 HydrophobicContact CG2-CG2 4.01Å; Q125-I151 HydrophobicContact CB-CD1 3.97Å; Q125-I151 HydrophobicContact CG-CD1 4.44Å; L126-I151 HydrophobicContact CD2-CD1 4.47Å; F132-I151 HydrophobicContact CE2-CD1 3.93Å; F132-I151 HydrophobicContact CZ-CD1 3.9Å; V147-I151 HydrophobicContact CG1-CD1 3.94Å; V147-I151 HydrophobicContact CG1-CG1 4.46Å; V147-I151 WeakPolarHBondContact O-CG1 3.3Å; V147-I151 PolarHBondContact O-N 2.89Å; A148-I151 PolarHBondContact O-N 3.45Å; I151-K153 VanDerWaalsContact C-N 3.34Å; I151-K153 PolarHBondContact O-N 3.15Å; I151-R154 WeakPolarHBondContact O-CA 3.48Å; I151-R154 WeakPolarHBondContact O-CB 3.34Å; I151-R154 PolarHBondContact O-N 2.76Å; I151-L155 HydrophobicContact CG2-CD1 3.73Å; I151-L155 HydrophobicContact CG2-CG 4.15Å; I151-L155 WeakPolarHBondContact O-CG 3.32Å; I151-L155 PolarHBondContact O-N 2.95Å
152	L	98.6	Very high	97.6	Very high	0 Å²	0	35 Å²	35	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-60.7	-42.4	-177	-66.9	165.7	0	0	0	111.8	T61 F64 A148 R154 L155 F156 F186 V190 L195 I196	T61-L152 HydrophobicContact CG2-CD2 4.43Å; F64-L152 HydrophobicContact CD2-CD2 3.98Å; A148-L152 WeakPolarHBondContact O-CG 3.31Å; A148-L152 PolarHBondContact O-N 3.28Å; L152-R154 VanDerWaalsContact C-N 3.27Å; L152-R154 PolarHBondContact O-N 2.91Å; L152-L155 PolarHBondContact O-N 3.28Å; L152-F156 PolarHBondContact O-N 2.91Å; L152-F186 HydrophobicContact CB-CE2 4.42Å; L152-F186 HydrophobicContact CB-CZ 4.28Å; L152-F186 HydrophobicContact CD2-CD2 4.43Å; L152-F186 HydrophobicContact CD2-CE2 3.65Å; L152-F186 HydrophobicContact CD2-CZ 4.32Å; L152-F186 WeakPolarHBondContact O-CZ 3.32Å; L152-V190 HydrophobicContact CB-CG1 4.38Å; L152-V190 HydrophobicContact CD1-CG1 4.38Å; L152-L195 HydrophobicContact CD1-CB 3.86Å; L152-L195 HydrophobicContact CD1-CD1 3.37Å; L152-L195 HydrophobicContact CD1-CG 4.15Å; L152-I196 HydrophobicContact CB-CD1 4.26Å; L152-I196 HydrophobicContact CB-CG1 4.37Å
153	K	98.1	Very high	97.6	Very high	62 Å²	62	23.5 Å²	23.5	27%	0.27	12%	0.12	S	C	.	.	H	α-helix	trans	-57.9	-39.4	173.7	-179.2	-178.9	67.5	179.9	0	112.7	K149 I151 E200	K149-K153 WeakPolarHBondContact O-CB 3.36Å; K149-K153 PolarHBondContact O-N 2.9Å; I151-K153 VanDerWaalsContact C-N 3.34Å; I151-K153 PolarHBondContact O-N 3.15Å; K153-E200 HydrophobicContact CD-CG 3.93Å; K153-E200 HydrophobicContact CG-CG 4.3Å
154	R	98	Very high	97.5	Very high	26 Å²	26	23.3 Å²	23.3	10%	0.098	12%	0.116	C	C	.	.	H	α-helix	trans	-70.9	-47	177.5	-76.6	176.5	179.7	-162.6	-6.1	110.6	A98 L118 T150 I151 L152 F156 R157	A98-R154 PolarHBondContact O-NH2 3.35Å; L118-R154 HydrophobicContact CD1-CB 3.74Å; L118-R154 WeakPolarHBondContact CD1-O 3.45Å; L118-R154 HydrophobicContact CG-CB 4.02Å; T150-R154 WeakPolarHBondContact O-CG 2.94Å; T150-R154 PolarHBondContact O-N 3.18Å; T150-R154 VanDerWaalsContact O-N 3.12Å; I151-R154 WeakPolarHBondContact O-CA 3.48Å; I151-R154 WeakPolarHBondContact O-CB 3.34Å; I151-R154 PolarHBondContact O-N 2.76Å; L152-R154 VanDerWaalsContact C-N 3.27Å; L152-R154 PolarHBondContact O-N 2.91Å; R154-F156 VanDerWaalsContact C-N 3.26Å; R154-F156 PolarHBondContact O-N 3.47Å; R154-R157 VanDerWaalsContact O-CB 3.22Å; R154-R157 WeakPolarHBondContact O-CB 3.13Å; R154-R157 PolarHBondContact O-N 2.88Å
155	L	98.5	Very high	97.3	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-55.2	-39.4	176.3	-72.6	-179.6	0	0	0	112.7	F65 I68 L118 M119 V122 I151 L152 R157 V158 Y159 F186	F65-L155 HydrophobicContact CB-CD1 4.21Å; F65-L155 HydrophobicContact CD2-CD2 4.16Å; I68-L155 HydrophobicContact CD1-CB 3.6Å; I68-L155 HydrophobicContact CD1-CD1 4.2Å; I68-L155 HydrophobicContact CD1-CD2 4.02Å; I68-L155 HydrophobicContact CD1-CG 4.13Å; L118-L155 HydrophobicContact CD2-CD2 4.02Å; M119-L155 HydrophobicContact SD-CD2 4.39Å; V122-L155 HydrophobicContact CG2-CD2 4.39Å; I151-L155 HydrophobicContact CG2-CD1 3.73Å; I151-L155 HydrophobicContact CG2-CG 4.15Å; I151-L155 WeakPolarHBondContact O-CG 3.32Å; I151-L155 PolarHBondContact O-N 2.95Å; L152-L155 PolarHBondContact O-N 3.28Å; L155-R157 PolarHBondContact O-N 3.2Å; L155-R157 VanDerWaalsContact O-N 3.16Å; L155-V158 WeakPolarHBondContact O-CB 3.43Å; L155-V158 PolarHBondContact O-N 3.48Å; L155-Y159 PolarHBondContact O-N 2.85Å; L155-F186 HydrophobicContact CB-CE2 4.3Å
156	F	98.6	Very high	97.1	Very high	2 Å²	2	25.3 Å²	25.3	1%	0.009	13%	0.125	C	C	.	.	H	α-helix	trans	-54	-34.8	172.7	173.7	-97.3	0	0	0	113.3	L152 R154 V158 Y159 A160 F183 F186 I187 I196 E200 L201 P203 L204 I208	L152-F156 PolarHBondContact O-N 2.91Å; R154-F156 VanDerWaalsContact C-N 3.26Å; R154-F156 PolarHBondContact O-N 3.47Å; F156-V158 PolarHBondContact O-N 2.91Å; F156-Y159 PolarHBondContact O-N 3.16Å; F156-A160 HydrophobicContact CE1-CB 4.21Å; F156-A160 HydrophobicContact CZ-CB 4.48Å; F156-A160 PolarHBondContact O-N 3Å; F156-F183 HydrophobicContact CD2-CE2 4.13Å; F156-F183 AromaticContact CE2-CE2 3.94Å; F156-F183 HydrophobicContact CE2-CE2 3.94Å; F156-F183 HydrophobicContact CE2-CZ 4.15Å; F156-F186 HydrophobicContact CB-CE1 3.99Å; F156-F186 HydrophobicContact CB-CZ 4.09Å; F156-F186 HydrophobicContact CD2-CE1 4.14Å; F156-I187 HydrophobicContact CD2-CD1 4.42Å; F156-I187 HydrophobicContact CE2-CD1 4.28Å; F156-I196 HydrophobicContact CB-CD1 4Å; F156-E200 WeakPolarHBondContact CE1-O 3.38Å; F156-L201 HydrophobicContact CD1-CD2 4.48Å; F156-L201 HydrophobicContact CD2-CD2 3.69Å; F156-L201 HydrophobicContact CE1-CD2 4.39Å; F156-L201 HydrophobicContact CE2-CD2 3.56Å; F156-L201 HydrophobicContact CG-CD2 4.16Å; F156-L201 HydrophobicContact CZ-CB 4.46Å; F156-L201 HydrophobicContact CZ-CD2 3.94Å; F156-P203 HydrophobicContact CE1-CG 4.5Å; F156-L204 HydrophobicContact CE2-CB 4.28Å; F156-L204 HydrophobicContact CE2-CD1 3.87Å; F156-L204 HydrophobicContact CE2-CG 4.38Å; F156-L204 HydrophobicContact CZ-CB 4.02Å; F156-L204 HydrophobicContact CZ-CD1 4.01Å; F156-L204 HydrophobicContact CZ-CG 4.07Å; F156-I208 HydrophobicContact CE2-CD1 4.45Å
157	R	98.4	Very high	96.9	Very high	36 Å²	36	24.6 Å²	24.6	14%	0.136	11%	0.112	C	C	.	.	H	α-helix	trans	-65.9	-28.8	180	-58.1	173	179.3	177.6	-8.2	112	M87 Y95 Y114 R154 L155 H161 E200	M87-R157 HydrophobicContact CE-CB 4.21Å; M87-R157 WeakPolarHBondContact CE-O 3.42Å; Y95-R157 HydrophobicContact CD1-CG 4.08Å; Y95-R157 HydrophobicContact CD2-CB 4.39Å; Y95-R157 HydrophobicContact CE1-CG 3.79Å; Y95-R157 HydrophobicContact CE2-CB 4.16Å; Y95-R157 HydrophobicContact CE2-CG 4.26Å; Y95-R157 HydrophobicContact CG-CG 4.43Å; Y114-R157 WeakPolarHBondContact OH-CD 3.49Å; Y114-R157 PolarHBondContact OH-NH1 3.03Å; R154-R157 VanDerWaalsContact O-CB 3.22Å; R154-R157 WeakPolarHBondContact O-CB 3.13Å; R154-R157 PolarHBondContact O-N 2.88Å; L155-R157 PolarHBondContact O-N 3.2Å; L155-R157 VanDerWaalsContact O-N 3.16Å; R157-H161 WeakPolarHBondContact O-CB 3.4Å; R157-H161 PolarHBondContact O-N 2.99Å; R157-E200 IonicContact NH2-OE2 2.92Å
158	V	98.5	Very high	96.5	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-69.9	-47.1	175.8	-172.4	0	0	0	0	109.7	I68 Y72 I115 L118 M119 L155 F156 A160 H161 I162	I68-V158 HydrophobicContact CG2-CB 3.66Å; I68-V158 HydrophobicContact CG2-CG1 3.51Å; I68-V158 HydrophobicContact CG2-CG2 4.25Å; Y72-V158 HydrophobicContact CD2-CG1 4.24Å; Y72-V158 HydrophobicContact CG-CG1 4.4Å; I115-V158 HydrophobicContact CD1-CG1 4.38Å; I115-V158 HydrophobicContact CG1-CG2 4.42Å; I115-V158 HydrophobicContact CG2-CG2 4.46Å; L118-V158 HydrophobicContact CD1-CG2 4.07Å; L118-V158 HydrophobicContact CD2-CG2 4.12Å; M119-V158 HydrophobicContact CE-CG1 4.17Å; M119-V158 HydrophobicContact CE-CG2 4.01Å; L155-V158 WeakPolarHBondContact O-CB 3.43Å; L155-V158 PolarHBondContact O-N 3.48Å; F156-V158 PolarHBondContact O-N 2.91Å; V158-A160 VanDerWaalsContact C-N 3.34Å; V158-A160 PolarHBondContact O-N 3.33Å; V158-H161 PolarHBondContact O-N 2.86Å; V158-I162 HydrophobicContact CG1-CD1 3.95Å; V158-I162 HydrophobicContact CG1-CG1 4.47Å; V158-I162 VanDerWaalsContact O-CG1 3.25Å; V158-I162 WeakPolarHBondContact O-CG1 3.37Å; V158-I162 PolarHBondContact O-N 2.71Å
159	Y	98.4	Very high	96.3	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-56.3	-48.6	171.2	-74.9	-65.3	0	0	0	111.8	I68 L71 L155 F156 H161 I162 Y163 L179 S182 F183 F186	I68-Y159 HydrophobicContact CD1-CD2 3.94Å; I68-Y159 HydrophobicContact CD1-CE2 3.33Å; I68-Y159 HydrophobicContact CG1-CD2 4.21Å; I68-Y159 HydrophobicContact CG1-CE1 4.12Å; I68-Y159 HydrophobicContact CG1-CE2 3.49Å; I68-Y159 VanDerWaalsContact CG1-CE2 3.49Å; I68-Y159 VanDerWaalsContact CG1-CZ 3.41Å; I68-Y159 WeakPolarHBondContact CG1-OH 3.45Å; L71-Y159 HydrophobicContact CD1-CE1 3.97Å; L155-Y159 PolarHBondContact O-N 2.85Å; F156-Y159 PolarHBondContact O-N 3.16Å; Y159-H161 VanDerWaalsContact C-N 3.26Å; Y159-H161 PolarHBondContact O-N 3.48Å; Y159-I162 PolarHBondContact O-N 3.38Å; Y159-Y163 HydrophobicContact CD1-CE2 4.43Å; Y159-Y163 VanDerWaalsContact O-CD2 3.26Å; Y159-Y163 WeakPolarHBondContact O-CD2 3.33Å; Y159-Y163 PolarHBondContact O-N 2.85Å; Y159-L179 HydrophobicContact CD1-CD1 3.81Å; Y159-L179 HydrophobicContact CE1-CD1 4.03Å; Y159-S182 PolarHBondContact OH-OG 3.05Å; Y159-F183 HydrophobicContact CD1-CB 3.99Å; Y159-F183 AromaticContact CD1-CD2 3.84Å; Y159-F183 HydrophobicContact CD1-CD2 3.84Å; Y159-F183 HydrophobicContact CD1-CG 4.3Å; Y159-F183 AromaticContact CD2-CD2 3.77Å; Y159-F183 HydrophobicContact CD2-CD2 3.77Å; Y159-F183 HydrophobicContact CD2-CE2 4.36Å; Y159-F183 HydrophobicContact CE1-CB 3.9Å; Y159-F183 HydrophobicContact CE1-CD2 4.32Å; Y159-F183 HydrophobicContact CE2-CD2 4.22Å; Y159-F183 AromaticContact CG-CD2 3.56Å; Y159-F183 HydrophobicContact CG-CD2 3.56Å; Y159-F183 HydrophobicContact CG-CE2 4.21Å; Y159-F183 HydrophobicContact CG-CG 4.44Å; Y159-F186 HydrophobicContact CD2-CD1 4.37Å; Y159-F186 HydrophobicContact CD2-CG 4.4Å; Y159-F186 HydrophobicContact CE2-CB 3.95Å; Y159-F186 HydrophobicContact CE2-CD1 4.14Å; Y159-F186 AromaticContact CE2-CD2 3.91Å; Y159-F186 HydrophobicContact CE2-CD2 3.91Å; Y159-F186 HydrophobicContact CE2-CE2 4.46Å; Y159-F186 AromaticContact CE2-CG 3.73Å; Y159-F186 HydrophobicContact CE2-CG 3.73Å
160	A	96.6	Very high	95.8	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-58.1	-41	179.9	0	0	0	0	0	111.9	A89 F156 V158 H164 P203 L204	A89-A160 HydrophobicContact CB-CB 3.65Å; F156-A160 HydrophobicContact CE1-CB 4.21Å; F156-A160 HydrophobicContact CZ-CB 4.48Å; F156-A160 PolarHBondContact O-N 3Å; V158-A160 VanDerWaalsContact C-N 3.34Å; V158-A160 PolarHBondContact O-N 3.33Å; A160-H164 WeakPolarHBondContact O-CB 3.49Å; A160-H164 PolarHBondContact O-CD2 3.04Å; A160-H164 PolarHBondContact O-N 2.86Å; A160-P203 HydrophobicContact CB-CB 4.44Å; A160-L204 HydrophobicContact CB-CD1 4.06Å; A160-L204 HydrophobicContact CB-CG 4.1Å
161	H	98.1	Very high	95.3	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-65.5	-48.5	175.1	-177.2	65.2	0	0	0	112.4	M87 S88 A111 R157 V158 Y159 Y163 H164 Q165 H166	M87-H161 HydrophobicContact CE-CB 3.58Å; M87-H161 HydrophobicContact SD-CB 4.2Å; S88-H161 PolarHBondContact O-ND1 3.38Å; A111-H161 WeakPolarHBondContact CB-CE1 3.45Å; A111-H161 VanDerWaalsContact CB-NE2 3.32Å; A111-H161 WeakPolarHBondContact CB-NE2 3.47Å; R157-H161 WeakPolarHBondContact O-CB 3.4Å; R157-H161 PolarHBondContact O-N 2.99Å; V158-H161 PolarHBondContact O-N 2.86Å; Y159-H161 VanDerWaalsContact C-N 3.26Å; Y159-H161 PolarHBondContact O-N 3.48Å; H161-Y163 PolarHBondContact O-N 3.38Å; H161-H164 PolarHBondContact O-N 3.45Å; H161-Q165 WeakPolarHBondContact O-CB 3.49Å; H161-Q165 PolarHBondContact O-N 3.3Å; H161-H166 AromaticContact CD2-CD2 3.88Å; H161-H166 AromaticContact CE1-NE2 3.98Å; H161-H166 AromaticContact NE2-CD2 3.55Å; H161-H166 AromaticContact NE2-NE2 3.28Å; H161-H166 PolarHBondContact NE2-NE2 3.21Å
162	I	97.1	Very high	95	Very high	2 Å²	2	36.3 Å²	36.3	1%	0.01	17%	0.171	C	C	.	.	H	α-helix	trans	-56.4	-51.8	178.8	-66.3	167.7	0	0	0	110.8	Y72 I75 V158 Y159 H164 H166 F167 V170 L179	Y72-I162 HydrophobicContact CD2-CD1 4.47Å; Y72-I162 HydrophobicContact CD2-CG1 4.45Å; I75-I162 HydrophobicContact CD1-CG1 3.79Å; I75-I162 HydrophobicContact CD1-CG2 4.42Å; V158-I162 HydrophobicContact CG1-CD1 3.95Å; V158-I162 HydrophobicContact CG1-CG1 4.47Å; V158-I162 VanDerWaalsContact O-CG1 3.25Å; V158-I162 WeakPolarHBondContact O-CG1 3.37Å; V158-I162 PolarHBondContact O-N 2.71Å; Y159-I162 PolarHBondContact O-N 3.38Å; I162-H164 VanDerWaalsContact C-N 3.32Å; I162-H164 PolarHBondContact O-N 3.19Å; I162-H166 CarbonylContact O-C 3.33Å; I162-H166 WeakPolarHBondContact O-CA 3.26Å; I162-H166 PolarHBondContact O-N 2.94Å; I162-F167 PolarHBondContact O-N 3.15Å; I162-F167 VanDerWaalsContact O-N 3.08Å; I162-V170 HydrophobicContact CG2-CG2 3.83Å; I162-L179 HydrophobicContact CG2-CD1 4.09Å; I162-L179 HydrophobicContact CG2-CD2 3.73Å
163	Y	95.3	Very high	94.7	Very high	25 Å²	25	39.9 Å²	39.9	10%	0.098	19%	0.19	C	C	.	.	H	α-helix	trans	-63.2	-35.1	-178.9	-83.2	-69.7	0	0	0	113.5	Y159 H161 F167 L179 N180 F183 L204 L207	Y159-Y163 HydrophobicContact CD1-CE2 4.43Å; Y159-Y163 VanDerWaalsContact O-CD2 3.26Å; Y159-Y163 WeakPolarHBondContact O-CD2 3.33Å; Y159-Y163 PolarHBondContact O-N 2.85Å; H161-Y163 PolarHBondContact O-N 3.38Å; Y163-F167 AromaticContact CD1-CD2 3.8Å; Y163-F167 HydrophobicContact CD1-CD2 3.8Å; Y163-F167 HydrophobicContact CD1-CE2 4.06Å; Y163-F167 HydrophobicContact CE1-CD2 4.18Å; Y163-F167 HydrophobicContact CE1-CE2 4Å; Y163-F167 WeakPolarHBondContact O-CB 3.41Å; Y163-L179 HydrophobicContact CD1-CD2 4.03Å; Y163-L179 HydrophobicContact CE1-CD2 3.67Å; Y163-L179 HydrophobicContact CE1-CG 4.06Å; Y163-L179 HydrophobicContact CE2-CD1 4.2Å; Y163-L179 HydrophobicContact CE2-CD2 4.19Å; Y163-L179 HydrophobicContact CE2-CG 4.05Å; Y163-L179 HydrophobicContact CG-CD2 4.44Å; Y163-L179 PolarHBondContact OH-O 3.26Å; Y163-N180 WeakPolarHBondContact OH-CA 3.36Å; Y163-N180 PolarHBondContact OH-OD1 3.14Å; Y163-F183 HydrophobicContact CE2-CB 3.92Å; Y163-F183 AromaticContact CE2-CD1 3.71Å; Y163-F183 HydrophobicContact CE2-CD1 3.71Å; Y163-F183 HydrophobicContact CE2-CD2 4.11Å; Y163-F183 HydrophobicContact CE2-CE1 4.26Å; Y163-F183 AromaticContact CE2-CG 3.64Å; Y163-F183 HydrophobicContact CE2-CG 3.64Å; Y163-F183 AromaticContact CZ-CD1 3.99Å; Y163-F183 WeakPolarHBondContact OH-CB 3.23Å; Y163-L204 HydrophobicContact CD2-CD1 3.92Å; Y163-L204 HydrophobicContact CD2-CD2 4.36Å; Y163-L204 HydrophobicContact CG-CD2 4.37Å; Y163-L207 HydrophobicContact CD1-CD2 3.63Å; Y163-L207 HydrophobicContact CD2-CD2 3.79Å; Y163-L207 HydrophobicContact CE1-CD2 3.54Å; Y163-L207 HydrophobicContact CE2-CD2 3.73Å; Y163-L207 HydrophobicContact CG-CD2 3.76Å
164	H	91.7	Very high	94.5	Very high	78 Å²	78	44.3 Å²	44.3	36%	0.361	21%	0.212	S	C	.	.	H	α-helix	trans	-85.9	-29.6	-177.2	-85.2	-80.2	0	0	0	113.8	A160 H161 I162 P203	A160-H164 WeakPolarHBondContact O-CB 3.49Å; A160-H164 PolarHBondContact O-CD2 3.04Å; A160-H164 PolarHBondContact O-N 2.86Å; H161-H164 PolarHBondContact O-N 3.45Å; I162-H164 VanDerWaalsContact C-N 3.32Å; I162-H164 PolarHBondContact O-N 3.19Å; H164-P203 PolarHBondContact NE2-O 3.09Å
165	Q	93.1	Very high	94.2	Very high	82 Å²	82	45.3 Å²	45.3	38%	0.383	22%	0.217	S	C	.	.	H	α-helix	trans	-116.9	-24.4	-169.1	-57.6	-60.6	-77.8	0	0	113.6	H161	H161-Q165 WeakPolarHBondContact O-CB 3.49Å; H161-Q165 PolarHBondContact O-N 3.3Å
166	H	95.3	Very high	93.7	Very high	7 Å²	7	48.7 Å²	48.7	3%	0.032	23%	0.233	C	C	.	.	S	Bend	trans	-130.5	13.2	-170	-61.2	-63	0	0	0	113.7	I75 F78 C79 C84 H161 I162 D168 S169 V170	I75-H166 HydrophobicContact CD1-CB 3.59Å; F78-H166 PolarHBondContact O-CE1 3.21Å; C79-H166 WeakPolarHBondContact CB-NE2 3.36Å; C84-H166 PolarHBondContact SG-NE2 3.49Å; H161-H166 AromaticContact CD2-CD2 3.88Å; H161-H166 AromaticContact CE1-NE2 3.98Å; H161-H166 AromaticContact NE2-CD2 3.55Å; H161-H166 AromaticContact NE2-NE2 3.28Å; H161-H166 PolarHBondContact NE2-NE2 3.21Å; I162-H166 CarbonylContact O-C 3.33Å; I162-H166 WeakPolarHBondContact O-CA 3.26Å; I162-H166 PolarHBondContact O-N 2.94Å; H166-D168 VanDerWaalsContact C-N 3.26Å; H166-D168 PolarHBondContact O-N 3.46Å; H166-S169 WeakPolarHBondContact O-CB 3.3Å; H166-S169 PolarHBondContact O-N 3.32Å; H166-S169 VanDerWaalsContact O-N 3.09Å; H166-V170 WeakPolarHBondContact O-CG2 3.34Å; H166-V170 PolarHBondContact O-N 3.03Å
167	F	91.4	Very high	93.2	Very high	63 Å²	63	51.3 Å²	51.3	28%	0.276	26%	0.255	S	S	.	.	H	α-helix	trans	-61.9	-35.4	179.6	-167.3	-107.4	0	0	0	112.3	I162 Y163 S169 V170 M171 E176 L179	I162-F167 PolarHBondContact O-N 3.15Å; I162-F167 VanDerWaalsContact O-N 3.08Å; Y163-F167 AromaticContact CD1-CD2 3.8Å; Y163-F167 HydrophobicContact CD1-CD2 3.8Å; Y163-F167 HydrophobicContact CD1-CE2 4.06Å; Y163-F167 HydrophobicContact CE1-CD2 4.18Å; Y163-F167 HydrophobicContact CE1-CE2 4Å; Y163-F167 WeakPolarHBondContact O-CB 3.41Å; F167-S169 VanDerWaalsContact C-N 3.33Å; F167-S169 PolarHBondContact O-N 2.65Å; F167-V170 WeakPolarHBondContact O-CB 3.39Å; F167-V170 PolarHBondContact O-N 2.9Å; F167-M171 HydrophobicContact CD1-CG 4.07Å; F167-M171 HydrophobicContact CD1-SD 3.76Å; F167-M171 HydrophobicContact CE1-CG 3.79Å; F167-M171 HydrophobicContact CE1-SD 3.45Å; F167-M171 WeakPolarHBondContact CE1-SD 3.35Å; F167-M171 HydrophobicContact CZ-CG 4.2Å; F167-M171 HydrophobicContact CZ-SD 4.33Å; F167-M171 WeakPolarHBondContact O-CG 3.46Å; F167-M171 PolarHBondContact O-N 3.42Å; F167-E176 HydrophobicContact CE2-CB 4.39Å; F167-E176 HydrophobicContact CZ-CB 4.37Å; F167-L179 HydrophobicContact CD2-CD2 4.28Å; F167-L179 HydrophobicContact CE2-CD2 4.48Å
168	D	88.5	Confident	92.9	Very high	119 Å²	119	55.6 Å²	55.6	64%	0.636	28%	0.276	S	S	*	.	H	α-helix	trans	-61.4	-41.6	174.1	-66.6	-22.4	0	0	0	111.8	H166 M171 Q172	H166-D168 VanDerWaalsContact C-N 3.26Å; H166-D168 PolarHBondContact O-N 3.46Å; D168-M171 PolarHBondContact O-N 3.31Å; D168-Q172 VanDerWaalsContact O-CG 3.28Å; D168-Q172 WeakPolarHBondContact O-CG 3.02Å; D168-Q172 PolarHBondContact O-N 2.99Å
169	S	93.6	Very high	92.7	Very high	15 Å²	15	55.7 Å²	55.7	11%	0.105	28%	0.277	C	S	.	.	H	α-helix	trans	-64.5	-42.6	174.6	-56.8	0	0	0	0	111.5	F78 H166 F167 M171 Q172 L173	F78-S169 WeakPolarHBondContact CG-OG 3.41Å; H166-S169 WeakPolarHBondContact O-CB 3.3Å; H166-S169 PolarHBondContact O-N 3.32Å; H166-S169 VanDerWaalsContact O-N 3.09Å; F167-S169 VanDerWaalsContact C-N 3.33Å; F167-S169 PolarHBondContact O-N 2.65Å; S169-M171 VanDerWaalsContact C-N 3.32Å; S169-M171 PolarHBondContact O-N 2.89Å; S169-Q172 WeakPolarHBondContact O-CB 3.19Å; S169-Q172 PolarHBondContact O-N 2.87Å; S169-L173 WeakPolarHBondContact O-CG 3.4Å; S169-L173 PolarHBondContact O-N 2.97Å
170	V	89.3	Confident	92.2	Very high	4 Å²	4	57.7 Å²	57.7	2%	0.024	29%	0.288	C	S	.	.	H	α-helix	trans	-59.9	-42.9	175.8	170.9	0	0	0	0	111.2	I75 I162 H166 F167 L173 Q174 E175 E176 L179	I75-V170 HydrophobicContact CG2-CG2 4.05Å; I162-V170 HydrophobicContact CG2-CG2 3.83Å; H166-V170 WeakPolarHBondContact O-CG2 3.34Å; H166-V170 PolarHBondContact O-N 3.03Å; F167-V170 WeakPolarHBondContact O-CB 3.39Å; F167-V170 PolarHBondContact O-N 2.9Å; V170-L173 PolarHBondContact O-N 3.47Å; V170-Q174 PolarHBondContact O-N 3.26Å; V170-Q174 VanDerWaalsContact O-N 3.14Å; V170-E175 HydrophobicContact CG1-CB 4.09Å; V170-E175 PolarHBondContact O-N 3.49Å; V170-E176 HydrophobicContact CG1-CB 4.17Å; V170-L179 HydrophobicContact CG1-CB 4.25Å; V170-L179 HydrophobicContact CG1-CD2 3.94Å; V170-L179 HydrophobicContact CG2-CD2 4.16Å
171	M	86	Confident	92	Very high	101 Å²	101	61.4 Å²	61.4	50%	0.498	31%	0.31	S	S	.	.	H	α-helix	trans	-65.4	-39.1	175.5	-71.8	-176.7	66.8	0	0	112.4	F167 D168 S169 L173 Q174	F167-M171 HydrophobicContact CD1-CG 4.07Å; F167-M171 HydrophobicContact CD1-SD 3.76Å; F167-M171 HydrophobicContact CE1-CG 3.79Å; F167-M171 HydrophobicContact CE1-SD 3.45Å; F167-M171 WeakPolarHBondContact CE1-SD 3.35Å; F167-M171 HydrophobicContact CZ-CG 4.2Å; F167-M171 HydrophobicContact CZ-SD 4.33Å; F167-M171 WeakPolarHBondContact O-CG 3.46Å; F167-M171 PolarHBondContact O-N 3.42Å; D168-M171 PolarHBondContact O-N 3.31Å; S169-M171 VanDerWaalsContact C-N 3.32Å; S169-M171 PolarHBondContact O-N 2.89Å; M171-L173 VanDerWaalsContact C-N 3.26Å; M171-L173 PolarHBondContact O-N 2.91Å; M171-Q174 PolarHBondContact O-N 3.44Å; M171-Q174 VanDerWaalsContact O-N 3.15Å
172	Q	91.7	Very high	91.8	Very high	141 Å²	141	61.9 Å²	61.9	66%	0.659	31%	0.314	S	S	*	.	H	α-helix	trans	-63.4	-34.5	176	-74.3	171.7	17.2	0	0	112.2	D168 S169 Q174	D168-Q172 VanDerWaalsContact O-CG 3.28Å; D168-Q172 WeakPolarHBondContact O-CG 3.02Å; D168-Q172 PolarHBondContact O-N 2.99Å; S169-Q172 WeakPolarHBondContact O-CB 3.19Å; S169-Q172 PolarHBondContact O-N 2.87Å; Q172-Q174 VanDerWaalsContact C-N 3.31Å
173	L	92.8	Very high	91.8	Very high	74 Å²	74	61.9 Å²	61.9	39%	0.387	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-4.9	176.3	-63.9	174.2	0	0	0	113.6	T74 I75 F78 S169 V170 M171 E175	T74-L173 WeakPolarHBondContact O-CD1 3.49Å; I75-L173 HydrophobicContact CG2-CD1 4.25Å; F78-L173 HydrophobicContact CE2-CD1 4.19Å; S169-L173 WeakPolarHBondContact O-CG 3.4Å; S169-L173 PolarHBondContact O-N 2.97Å; V170-L173 PolarHBondContact O-N 3.47Å; M171-L173 VanDerWaalsContact C-N 3.26Å; M171-L173 PolarHBondContact O-N 2.91Å; L173-E175 VanDerWaalsContact C-N 3.26Å; L173-E175 HydrophobicContact CB-CB 4.5Å; L173-E175 HydrophobicContact CB-CG 3.96Å; L173-E175 PolarHBondContact O-N 3.05Å
174	Q	92.8	Very high	91.6	Very high	156 Å²	156	62.4 Å²	62.4	73%	0.729	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.9	34.2	-175.5	-53.8	179	1.8	0	0	113	V170 M171 Q172 E176	V170-Q174 PolarHBondContact O-N 3.26Å; V170-Q174 VanDerWaalsContact O-N 3.14Å; M171-Q174 PolarHBondContact O-N 3.44Å; M171-Q174 VanDerWaalsContact O-N 3.15Å; Q172-Q174 VanDerWaalsContact C-N 3.31Å; Q174-E176 VanDerWaalsContact C-OE2 3.26Å; Q174-E176 WeakPolarHBondContact CA-OE2 3.34Å
175	E	92.1	Very high	91.8	Very high	47 Å²	47	58.9 Å²	58.9	22%	0.22	30%	0.3	C	S	.	.			trans	-102.5	3.3	-177.2	-68.5	-172.3	162.9	0	0	113.5	T74 V170 L173 A177 H178 L179	T74-E175 WeakPolarHBondContact CB-OE2 3.44Å; T74-E175 WeakPolarHBondContact CG2-OE1 3.2Å; T74-E175 WeakPolarHBondContact CG2-OE2 3.35Å; T74-E175 PolarHBondContact OG1-OE2 3.38Å; V170-E175 HydrophobicContact CG1-CB 4.09Å; V170-E175 PolarHBondContact O-N 3.49Å; L173-E175 VanDerWaalsContact C-N 3.26Å; L173-E175 HydrophobicContact CB-CB 4.5Å; L173-E175 HydrophobicContact CB-CG 3.96Å; L173-E175 PolarHBondContact O-N 3.05Å; E175-A177 VanDerWaalsContact C-N 3.25Å; E175-A177 PolarHBondContact O-N 3.13Å; E175-H178 WeakPolarHBondContact O-CB 3.41Å; E175-H178 PolarHBondContact O-N 3.35Å; E175-L179 PolarHBondContact O-N 3.19Å
176	E	89.1	Confident	91.9	Very high	71 Å²	71	55 Å²	55	33%	0.332	28%	0.282	S	S	.	.	H	α-helix	trans	-60.6	-33.8	-175.3	69.3	-78.3	-177.3	0	0	112.7	F167 V170 Q174 N180	F167-E176 HydrophobicContact CE2-CB 4.39Å; F167-E176 HydrophobicContact CZ-CB 4.37Å; V170-E176 HydrophobicContact CG1-CB 4.17Å; Q174-E176 VanDerWaalsContact C-OE2 3.26Å; Q174-E176 WeakPolarHBondContact CA-OE2 3.34Å; E176-N180 WeakPolarHBondContact O-CB 3.45Å; E176-N180 PolarHBondContact O-N 3Å; E176-N180 PolarHBondContact O-ND2 3.25Å
177	A	88.4	Confident	92	Very high	57 Å²	57	54.7 Å²	54.7	47%	0.471	28%	0.28	S	S	.	.	H	α-helix	trans	-66.8	-39.6	175.8	0	0	0	0	0	112	E175 T181	E175-A177 VanDerWaalsContact C-N 3.25Å; E175-A177 PolarHBondContact O-N 3.13Å; A177-T181 VanDerWaalsContact O-CB 3.32Å; A177-T181 WeakPolarHBondContact O-CB 3.46Å; A177-T181 PolarHBondContact O-N 3.37Å; A177-T181 PolarHBondContact O-OG1 2.94Å
178	H	91.5	Very high	92.1	Very high	126 Å²	126	51.8 Å²	51.8	58%	0.583	27%	0.268	S	S	*	.	H	α-helix	trans	-68.2	-47.9	178	-59.6	97	0	0	0	110.6	L71 E175 N180 T181 S182	L71-H178 HydrophobicContact CD2-CB 4.41Å; E175-H178 WeakPolarHBondContact O-CB 3.41Å; E175-H178 PolarHBondContact O-N 3.35Å; H178-N180 PolarHBondContact O-N 3.3Å; H178-T181 PolarHBondContact O-N 2.95Å; H178-S182 VanDerWaalsContact O-CB 3.29Å; H178-S182 WeakPolarHBondContact O-CB 3.39Å; H178-S182 PolarHBondContact O-N 3.31Å
179	L	92.9	Very high	92.5	Very high	1 Å²	1	46.1 Å²	46.1	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-58.7	-47.2	175.9	178.5	64.3	0	0	0	111.6	L71 Y159 I162 Y163 F167 V170 E175 F183	L71-L179 HydrophobicContact CD1-CD1 4.05Å; L71-L179 HydrophobicContact CD2-CB 4.3Å; Y159-L179 HydrophobicContact CD1-CD1 3.81Å; Y159-L179 HydrophobicContact CE1-CD1 4.03Å; I162-L179 HydrophobicContact CG2-CD1 4.09Å; I162-L179 HydrophobicContact CG2-CD2 3.73Å; Y163-L179 HydrophobicContact CD1-CD2 4.03Å; Y163-L179 HydrophobicContact CE1-CD2 3.67Å; Y163-L179 HydrophobicContact CE1-CG 4.06Å; Y163-L179 HydrophobicContact CE2-CD1 4.2Å; Y163-L179 HydrophobicContact CE2-CD2 4.19Å; Y163-L179 HydrophobicContact CE2-CG 4.05Å; Y163-L179 HydrophobicContact CG-CD2 4.44Å; Y163-L179 PolarHBondContact OH-O 3.26Å; F167-L179 HydrophobicContact CD2-CD2 4.28Å; F167-L179 HydrophobicContact CE2-CD2 4.48Å; V170-L179 HydrophobicContact CG1-CB 4.25Å; V170-L179 HydrophobicContact CG1-CD2 3.94Å; V170-L179 HydrophobicContact CG2-CD2 4.16Å; E175-L179 PolarHBondContact O-N 3.19Å; L179-F183 WeakPolarHBondContact O-CB 3.29Å; L179-F183 PolarHBondContact O-N 2.93Å
180	N	89.8	Confident	92.7	Very high	43 Å²	43	45.5 Å²	45.5	23%	0.23	23%	0.233	C	C	.	.	H	α-helix	trans	-64.8	-42.7	-179.6	-75.8	-37.5	0	0	0	112.1	Y163 E176 H178 K184	Y163-N180 WeakPolarHBondContact OH-CA 3.36Å; Y163-N180 PolarHBondContact OH-OD1 3.14Å; E176-N180 WeakPolarHBondContact O-CB 3.45Å; E176-N180 PolarHBondContact O-N 3Å; E176-N180 PolarHBondContact O-ND2 3.25Å; H178-N180 PolarHBondContact O-N 3.3Å; N180-K184 WeakPolarHBondContact O-CB 3.37Å; N180-K184 PolarHBondContact O-N 2.8Å
181	T	91.3	Very high	93	Very high	78 Å²	78	49.2 Å²	49.2	48%	0.479	25%	0.25	S	S	.	.	H	α-helix	trans	-66.2	-47.9	179.5	-57.8	0	0	0	0	111	A177 H178 F183 K184 H185	A177-T181 VanDerWaalsContact O-CB 3.32Å; A177-T181 WeakPolarHBondContact O-CB 3.46Å; A177-T181 PolarHBondContact O-N 3.37Å; A177-T181 PolarHBondContact O-OG1 2.94Å; H178-T181 PolarHBondContact O-N 2.95Å; T181-F183 PolarHBondContact O-N 3.17Å; T181-K184 PolarHBondContact O-N 3.39Å; T181-H185 WeakPolarHBondContact O-CB 3.36Å; T181-H185 PolarHBondContact O-N 3.11Å
182	S	94.9	Very high	93.4	Very high	10 Å²	10	49.2 Å²	49.2	7%	0.07	25%	0.249	C	C	.	.	H	α-helix	trans	-60.2	-46.9	177.1	-177.3	0	0	0	0	111.4	Q67 Y159 H178 K184 H185 F186	Q67-S182 PolarHBondContact OE1-OG 3.06Å; Y159-S182 PolarHBondContact OH-OG 3.05Å; H178-S182 VanDerWaalsContact O-CB 3.29Å; H178-S182 WeakPolarHBondContact O-CB 3.39Å; H178-S182 PolarHBondContact O-N 3.31Å; S182-K184 PolarHBondContact O-N 2.97Å; S182-H185 PolarHBondContact O-N 3.44Å; S182-F186 WeakPolarHBondContact O-CB 3.34Å; S182-F186 PolarHBondContact O-N 3.06Å
183	F	95.4	Very high	93.7	Very high	1 Å²	1	44.3 Å²	44.3	0%	0.004	23%	0.225	C	C	.	.	H	α-helix	trans	-65.2	-40.2	177.7	-178.4	-116.8	0	0	0	112.7	F156 Y159 Y163 L179 T181 F186 I187 L204 L207 I208 L211	F156-F183 HydrophobicContact CD2-CE2 4.13Å; F156-F183 AromaticContact CE2-CE2 3.94Å; F156-F183 HydrophobicContact CE2-CE2 3.94Å; F156-F183 HydrophobicContact CE2-CZ 4.15Å; Y159-F183 HydrophobicContact CD1-CB 3.99Å; Y159-F183 AromaticContact CD1-CD2 3.84Å; Y159-F183 HydrophobicContact CD1-CD2 3.84Å; Y159-F183 HydrophobicContact CD1-CG 4.3Å; Y159-F183 AromaticContact CD2-CD2 3.77Å; Y159-F183 HydrophobicContact CD2-CD2 3.77Å; Y159-F183 HydrophobicContact CD2-CE2 4.36Å; Y159-F183 HydrophobicContact CE1-CB 3.9Å; Y159-F183 HydrophobicContact CE1-CD2 4.32Å; Y159-F183 HydrophobicContact CE2-CD2 4.22Å; Y159-F183 AromaticContact CG-CD2 3.56Å; Y159-F183 HydrophobicContact CG-CD2 3.56Å; Y159-F183 HydrophobicContact CG-CE2 4.21Å; Y159-F183 HydrophobicContact CG-CG 4.44Å; Y163-F183 HydrophobicContact CE2-CB 3.92Å; Y163-F183 AromaticContact CE2-CD1 3.71Å; Y163-F183 HydrophobicContact CE2-CD1 3.71Å; Y163-F183 HydrophobicContact CE2-CD2 4.11Å; Y163-F183 HydrophobicContact CE2-CE1 4.26Å; Y163-F183 AromaticContact CE2-CG 3.64Å; Y163-F183 HydrophobicContact CE2-CG 3.64Å; Y163-F183 AromaticContact CZ-CD1 3.99Å; Y163-F183 WeakPolarHBondContact OH-CB 3.23Å; L179-F183 WeakPolarHBondContact O-CB 3.29Å; L179-F183 PolarHBondContact O-N 2.93Å; T181-F183 PolarHBondContact O-N 3.17Å; F183-F186 WeakPolarHBondContact O-CB 3.2Å; F183-F186 PolarHBondContact O-N 2.99Å; F183-I187 HydrophobicContact CD1-CG1 4.29Å; F183-I187 HydrophobicContact CD2-CG1 4.06Å; F183-I187 HydrophobicContact CE1-CD1 4.49Å; F183-I187 HydrophobicContact CE1-CG1 3.87Å; F183-I187 HydrophobicContact CE2-CD1 3.73Å; F183-I187 HydrophobicContact CE2-CG1 3.62Å; F183-I187 HydrophobicContact CG-CG1 4.38Å; F183-I187 HydrophobicContact CZ-CD1 3.69Å; F183-I187 HydrophobicContact CZ-CG1 3.51Å; F183-I187 WeakPolarHBondContact O-CB 3.33Å; F183-I187 VanDerWaalsContact O-CG1 3.28Å; F183-I187 WeakPolarHBondContact O-CG1 3.37Å; F183-I187 PolarHBondContact O-N 3.29Å; F183-L204 HydrophobicContact CE1-CD1 4.16Å; F183-L204 HydrophobicContact CE2-CD1 3.62Å; F183-L204 HydrophobicContact CZ-CB 4.08Å; F183-L204 HydrophobicContact CZ-CD1 3.38Å; F183-L204 HydrophobicContact CZ-CG 4.4Å; F183-L207 HydrophobicContact CD1-CD2 4.09Å; F183-L207 HydrophobicContact CE1-CD2 3.76Å; F183-L207 HydrophobicContact CE1-CG 4.09Å; F183-I208 HydrophobicContact CE1-CG1 4.04Å; F183-I208 HydrophobicContact CZ-CD1 4.35Å; F183-I208 HydrophobicContact CZ-CG1 3.83Å; F183-L211 HydrophobicContact CD1-CD1 3.66Å; F183-L211 HydrophobicContact CE1-CD1 4.11Å
184	K	92.7	Very high	93.9	Very high	37 Å²	37	46 Å²	46	16%	0.161	24%	0.235	C	C	.	.	H	α-helix	trans	-63.5	-44.3	177	-177	175.1	171.6	-178.8	0	111.3	L41 N180 T181 S182 I187 F188 L211 D215	L41-K184 HydrophobicContact CD1-CB 4.21Å; L41-K184 HydrophobicContact CD1-CD 3.78Å; L41-K184 HydrophobicContact CD1-CG 3.82Å; N180-K184 WeakPolarHBondContact O-CB 3.37Å; N180-K184 PolarHBondContact O-N 2.8Å; T181-K184 PolarHBondContact O-N 3.39Å; S182-K184 PolarHBondContact O-N 2.97Å; K184-I187 PolarHBondContact O-N 3.14Å; K184-F188 HydrophobicContact CD-CE2 4.26Å; K184-F188 HydrophobicContact CG-CD2 4.19Å; K184-F188 HydrophobicContact CG-CE2 3.79Å; K184-F188 HydrophobicContact CG-CZ 4.22Å; K184-F188 PolarHBondContact O-N 3.36Å; K184-L211 WeakPolarHBondContact CE-O 3.49Å; K184-D215 WeakPolarHBondContact CE-OD2 3.5Å; K184-D215 IonicContact NZ-OD1 3.51Å; K184-D215 PolarHBondContact NZ-OD1 2.85Å; K184-D215 IonicContact NZ-OD2 2.71Å; K184-D215 PolarHBondContact NZ-OD2 2.85Å
185	H	94.2	Very high	94.1	Very high	3 Å²	3	38.8 Å²	38.8	1%	0.014	20%	0.201	C	C	.	.	H	α-helix	trans	-58.5	-49.5	173.8	179.6	-151.7	0	0	0	111	L36 V45 F64 T181 S182 I187 F188 F189	L36-H185 HydrophobicContact CD2-CB 4.41Å; V45-H185 WeakPolarHBondContact CG1-CD2 3.44Å; F64-H185 HydrophobicContact CE1-CB 4.29Å; F64-H185 AromaticContact CE1-CE1 3.72Å; F64-H185 AromaticContact CE1-CG 3.75Å; F64-H185 AromaticContact CE1-ND1 3.43Å; F64-H185 WeakPolarHBondContact CE1-ND1 3.27Å; F64-H185 AromaticContact CZ-CE1 3.72Å; F64-H185 AromaticContact CZ-ND1 3.87Å; F64-H185 AromaticContact CZ-NE2 3.83Å; T181-H185 WeakPolarHBondContact O-CB 3.36Å; T181-H185 PolarHBondContact O-N 3.11Å; S182-H185 PolarHBondContact O-N 3.44Å; H185-I187 VanDerWaalsContact C-N 3.34Å; H185-I187 PolarHBondContact O-N 3.39Å; H185-F188 PolarHBondContact O-N 2.97Å; H185-F189 WeakPolarHBondContact O-CB 3.04Å; H185-F189 PolarHBondContact O-N 3.5Å
186	F	97.1	Very high	94.3	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-55	-47.6	176	179.9	-87.7	0	0	0	112.3	F64 L152 L155 F156 Y159 S182 F183 F189 V190 I196	F64-F186 HydrophobicContact CB-CD2 4.01Å; F64-F186 HydrophobicContact CB-CE2 4.42Å; F64-F186 HydrophobicContact CD1-CB 3.96Å; F64-F186 AromaticContact CD1-CD2 3.81Å; F64-F186 HydrophobicContact CD1-CD2 3.81Å; F64-F186 HydrophobicContact CD1-CG 4.4Å; F64-F186 AromaticContact CD2-CD2 3.93Å; F64-F186 HydrophobicContact CD2-CD2 3.93Å; F64-F186 HydrophobicContact CD2-CE2 4.47Å; F64-F186 VanDerWaalsContact CE1-CA 3.41Å; F64-F186 HydrophobicContact CE1-CB 3.82Å; F64-F186 HydrophobicContact CE1-CD2 4.29Å; F64-F186 HydrophobicContact CE2-CD2 4.41Å; F64-F186 AromaticContact CG-CD2 3.64Å; F64-F186 HydrophobicContact CG-CD2 3.64Å; F64-F186 HydrophobicContact CG-CE2 4.37Å; F64-F186 HydrophobicContact CZ-CB 4.36Å; L152-F186 HydrophobicContact CB-CE2 4.42Å; L152-F186 HydrophobicContact CB-CZ 4.28Å; L152-F186 HydrophobicContact CD2-CD2 4.43Å; L152-F186 HydrophobicContact CD2-CE2 3.65Å; L152-F186 HydrophobicContact CD2-CZ 4.32Å; L152-F186 WeakPolarHBondContact O-CZ 3.32Å; L155-F186 HydrophobicContact CB-CE2 4.3Å; F156-F186 HydrophobicContact CB-CE1 3.99Å; F156-F186 HydrophobicContact CB-CZ 4.09Å; F156-F186 HydrophobicContact CD2-CE1 4.14Å; Y159-F186 HydrophobicContact CD2-CD1 4.37Å; Y159-F186 HydrophobicContact CD2-CG 4.4Å; Y159-F186 HydrophobicContact CE2-CB 3.95Å; Y159-F186 HydrophobicContact CE2-CD1 4.14Å; Y159-F186 AromaticContact CE2-CD2 3.91Å; Y159-F186 HydrophobicContact CE2-CD2 3.91Å; Y159-F186 HydrophobicContact CE2-CE2 4.46Å; Y159-F186 AromaticContact CE2-CG 3.73Å; Y159-F186 HydrophobicContact CE2-CG 3.73Å; S182-F186 WeakPolarHBondContact O-CB 3.34Å; S182-F186 PolarHBondContact O-N 3.06Å; F183-F186 WeakPolarHBondContact O-CB 3.2Å; F183-F186 PolarHBondContact O-N 2.99Å; F186-F189 PolarHBondContact O-N 3.31Å; F186-V190 HydrophobicContact CD1-CG1 4.23Å; F186-V190 HydrophobicContact CD1-CG2 4.5Å; F186-V190 HydrophobicContact CE1-CG1 3.82Å; F186-V190 HydrophobicContact CE1-CG2 4.33Å; F186-V190 HydrophobicContact CE2-CG1 4.25Å; F186-V190 HydrophobicContact CZ-CG1 3.83Å; F186-V190 WeakPolarHBondContact O-CG1 3.34Å; F186-V190 WeakPolarHBondContact O-CG2 3.39Å; F186-V190 PolarHBondContact O-N 2.85Å; F186-I196 HydrophobicContact CE1-CD1 3.79Å; F186-I196 HydrophobicContact CZ-CD1 3.76Å
187	I	96	Very high	94.5	Very high	1 Å²	1	39.1 Å²	39.1	1%	0.005	20%	0.203	C	C	.	.	H	α-helix	trans	-65.8	-42.2	-177.9	-71.2	-63.8	0	0	0	112.1	F156 F183 K184 H185 F189 V190 Q191 L201 I208 T212	F156-I187 HydrophobicContact CD2-CD1 4.42Å; F156-I187 HydrophobicContact CE2-CD1 4.28Å; F183-I187 HydrophobicContact CD1-CG1 4.29Å; F183-I187 HydrophobicContact CD2-CG1 4.06Å; F183-I187 HydrophobicContact CE1-CD1 4.49Å; F183-I187 HydrophobicContact CE1-CG1 3.87Å; F183-I187 HydrophobicContact CE2-CD1 3.73Å; F183-I187 HydrophobicContact CE2-CG1 3.62Å; F183-I187 HydrophobicContact CG-CG1 4.38Å; F183-I187 HydrophobicContact CZ-CD1 3.69Å; F183-I187 HydrophobicContact CZ-CG1 3.51Å; F183-I187 WeakPolarHBondContact O-CB 3.33Å; F183-I187 VanDerWaalsContact O-CG1 3.28Å; F183-I187 WeakPolarHBondContact O-CG1 3.37Å; F183-I187 PolarHBondContact O-N 3.29Å; K184-I187 PolarHBondContact O-N 3.14Å; H185-I187 VanDerWaalsContact C-N 3.34Å; H185-I187 PolarHBondContact O-N 3.39Å; I187-F189 VanDerWaalsContact C-N 3.34Å; I187-V190 HydrophobicContact CD1-CG2 4.4Å; I187-V190 WeakPolarHBondContact O-CG2 3.08Å; I187-Q191 HydrophobicContact CG2-CG 4.37Å; I187-Q191 VanDerWaalsContact O-CB 3.3Å; I187-Q191 WeakPolarHBondContact O-CB 3.38Å; I187-Q191 WeakPolarHBondContact O-CG 3.26Å; I187-Q191 PolarHBondContact O-N 2.92Å; I187-L201 HydrophobicContact CD1-CD2 4.14Å; I187-I208 HydrophobicContact CD1-CD1 3.71Å; I187-I208 HydrophobicContact CD1-CG1 3.84Å; I187-I208 HydrophobicContact CG1-CD1 4.48Å; I187-I208 HydrophobicContact CG1-CG1 4.05Å; I187-I208 HydrophobicContact CG2-CG1 4.33Å; I187-I208 HydrophobicContact CG2-CG2 3.89Å; I187-T212 HydrophobicContact CG2-CG2 3.9Å
188	F	95	Very high	94.7	Very high	3 Å²	3	46.7 Å²	46.7	1%	0.013	22%	0.219	C	C	.	.	H	α-helix	trans	-62.8	-43.2	174.9	-71.7	-30.4	0	0	0	111.8	L41 R42 V45 K184 H185 Q191 E192 T212 D215	L41-F188 HydrophobicContact CB-CD2 3.61Å; L41-F188 HydrophobicContact CB-CE2 3.82Å; R42-F188 HydrophobicContact CG-CD1 4Å; R42-F188 HydrophobicContact CG-CD2 3.9Å; R42-F188 HydrophobicContact CG-CE1 3.88Å; R42-F188 HydrophobicContact CG-CE2 3.74Å; R42-F188 HydrophobicContact CG-CG 4.03Å; R42-F188 HydrophobicContact CG-CZ 3.75Å; V45-F188 HydrophobicContact CG1-CB 4.15Å; V45-F188 HydrophobicContact CG2-CB 3.97Å; K184-F188 HydrophobicContact CD-CE2 4.26Å; K184-F188 HydrophobicContact CG-CD2 4.19Å; K184-F188 HydrophobicContact CG-CE2 3.79Å; K184-F188 HydrophobicContact CG-CZ 4.22Å; K184-F188 PolarHBondContact O-N 3.36Å; H185-F188 PolarHBondContact O-N 2.97Å; F188-Q191 PolarHBondContact O-N 3Å; F188-E192 WeakPolarHBondContact O-CB 3.2Å; F188-E192 PolarHBondContact O-N 3.12Å; F188-T212 HydrophobicContact CD1-CG2 4.05Å; F188-T212 HydrophobicContact CE1-CG2 3.41Å; F188-T212 VanDerWaalsContact CE1-CG2 3.41Å; F188-T212 HydrophobicContact CZ-CG2 4.06Å; F188-D215 HydrophobicContact CE2-CB 4.39Å; F188-D215 HydrophobicContact CZ-CB 3.88Å; F188-D215 WeakPolarHBondContact CZ-OD2 3.1Å
189	F	96.7	Very high	94.7	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-61.5	-48.3	179	-169.4	-91	0	0	0	112.5	V45 W56 V57 N60 F64 H185 F186 I187 Q191 E192 F193 L195	V45-F189 HydrophobicContact CB-CB 4.3Å; V45-F189 HydrophobicContact CB-CD2 3.96Å; V45-F189 HydrophobicContact CG1-CB 3.92Å; V45-F189 HydrophobicContact CG1-CD2 4.11Å; W56-F189 AromaticContact CD1-CE2 3.88Å; W56-F189 AromaticContact NE1-CE2 3.59Å; V57-F189 HydrophobicContact CB-CZ 4.49Å; V57-F189 HydrophobicContact CG2-CE1 4.25Å; V57-F189 HydrophobicContact CG2-CZ 4.01Å; N60-F189 HydrophobicContact CB-CD1 4.39Å; N60-F189 HydrophobicContact CB-CD2 3.97Å; N60-F189 HydrophobicContact CB-CE1 3.89Å; N60-F189 HydrophobicContact CB-CE2 3.43Å; N60-F189 VanDerWaalsContact CB-CE2 3.43Å; N60-F189 HydrophobicContact CB-CG 4.43Å; N60-F189 HydrophobicContact CB-CZ 3.41Å; N60-F189 VanDerWaalsContact CB-CZ 3.41Å; N60-F189 WeakPolarHBondContact ND2-CE2 3.34Å; F64-F189 HydrophobicContact CE2-CB 3.71Å; F64-F189 AromaticContact CE2-CD1 3.62Å; F64-F189 HydrophobicContact CE2-CD1 3.62Å; F64-F189 HydrophobicContact CE2-CD2 4.26Å; F64-F189 HydrophobicContact CE2-CE1 4.34Å; F64-F189 AromaticContact CE2-CG 3.58Å; F64-F189 HydrophobicContact CE2-CG 3.58Å; F64-F189 HydrophobicContact CZ-CB 3.64Å; F64-F189 HydrophobicContact CZ-CD1 4.41Å; F64-F189 HydrophobicContact CZ-CD2 4.49Å; F64-F189 AromaticContact CZ-CG 3.94Å; F64-F189 HydrophobicContact CZ-CG 3.94Å; H185-F189 WeakPolarHBondContact O-CB 3.04Å; H185-F189 PolarHBondContact O-N 3.5Å; F186-F189 PolarHBondContact O-N 3.31Å; I187-F189 VanDerWaalsContact C-N 3.34Å; F189-Q191 VanDerWaalsContact C-N 3.29Å; F189-Q191 PolarHBondContact O-N 2.97Å; F189-E192 PolarHBondContact O-N 2.88Å; F189-F193 HydrophobicContact CD1-CD2 4.3Å; F189-F193 HydrophobicContact CD2-CD2 4.21Å; F189-F193 AromaticContact CD2-CE2 3.91Å; F189-F193 HydrophobicContact CD2-CE2 3.91Å; F189-F193 AromaticContact CE1-CD2 3.99Å; F189-F193 HydrophobicContact CE1-CD2 3.99Å; F189-F193 HydrophobicContact CE1-CE2 4.42Å; F189-F193 AromaticContact CE2-CD2 3.87Å; F189-F193 HydrophobicContact CE2-CD2 3.87Å; F189-F193 AromaticContact CE2-CE2 3.46Å; F189-F193 HydrophobicContact CE2-CE2 3.46Å; F189-F193 VanDerWaalsContact CE2-CE2 3.46Å; F189-F193 HydrophobicContact CG-CD2 4.39Å; F189-F193 AromaticContact CZ-CD2 3.71Å; F189-F193 HydrophobicContact CZ-CD2 3.71Å; F189-F193 AromaticContact CZ-CE2 3.72Å; F189-F193 HydrophobicContact CZ-CE2 3.72Å; F189-F193 WeakPolarHBondContact O-CD2 3.23Å; F189-F193 PolarHBondContact O-N 2.92Å; F189-L195 HydrophobicContact CD1-CD1 3.75Å; F189-L195 HydrophobicContact CE1-CD1 3.46Å; F189-L195 VanDerWaalsContact CE1-CD1 3.46Å
190	V	97.2	Very high	94.6	Very high	2 Å²	2	49.5 Å²	49.5	1%	0.012	23%	0.231	C	C	.	.	H	α-helix	trans	-69.4	-27.6	-179.7	-58.4	0	0	0	0	112.8	L152 F186 I187 N194 L195 I196	L152-V190 HydrophobicContact CB-CG1 4.38Å; L152-V190 HydrophobicContact CD1-CG1 4.38Å; F186-V190 HydrophobicContact CD1-CG1 4.23Å; F186-V190 HydrophobicContact CD1-CG2 4.5Å; F186-V190 HydrophobicContact CE1-CG1 3.82Å; F186-V190 HydrophobicContact CE1-CG2 4.33Å; F186-V190 HydrophobicContact CE2-CG1 4.25Å; F186-V190 HydrophobicContact CZ-CG1 3.83Å; F186-V190 WeakPolarHBondContact O-CG1 3.34Å; F186-V190 WeakPolarHBondContact O-CG2 3.39Å; F186-V190 PolarHBondContact O-N 2.85Å; I187-V190 HydrophobicContact CD1-CG2 4.4Å; I187-V190 WeakPolarHBondContact O-CG2 3.08Å; V190-N194 CarbonylContact O-C 3.57Å; V190-N194 WeakPolarHBondContact O-CA 3.36Å; V190-N194 PolarHBondContact O-N 3.45Å; V190-N194 VanDerWaalsContact O-N 3.11Å; V190-L195 HydrophobicContact CB-CB 4.17Å; V190-L195 HydrophobicContact CG1-CB 4.31Å; V190-L195 PolarHBondContact O-N 3.23Å; V190-I196 HydrophobicContact CB-CB 4.49Å; V190-I196 HydrophobicContact CB-CD1 4.13Å; V190-I196 HydrophobicContact CB-CG1 4.09Å; V190-I196 HydrophobicContact CG1-CD1 3.8Å; V190-I196 HydrophobicContact CG1-CG1 4.07Å; V190-I196 HydrophobicContact CG2-CD1 4.23Å
191	Q	94.7	Very high	94.8	Very high	81 Å²	81	47.8 Å²	47.8	38%	0.379	22%	0.222	S	C	.	.	H	α-helix	trans	-73.5	-44.2	174.3	-76.1	178.5	-8.7	0	0	111.7	I187 F188 F189 F193 N194	I187-Q191 HydrophobicContact CG2-CG 4.37Å; I187-Q191 VanDerWaalsContact O-CB 3.3Å; I187-Q191 WeakPolarHBondContact O-CB 3.38Å; I187-Q191 WeakPolarHBondContact O-CG 3.26Å; I187-Q191 PolarHBondContact O-N 2.92Å; F188-Q191 PolarHBondContact O-N 3Å; F189-Q191 VanDerWaalsContact C-N 3.29Å; F189-Q191 PolarHBondContact O-N 2.97Å; Q191-F193 VanDerWaalsContact C-N 3.32Å; Q191-F193 PolarHBondContact O-N 3.06Å; Q191-N194 PolarHBondContact O-N 2.96Å
192	E	95.8	Very high	94.8	Very high	102 Å²	102	47.1 Å²	47.1	48%	0.477	22%	0.217	S	C	.	.	H	α-helix	trans	-55.5	-47	179.9	-176.9	59.5	-157.9	0	0	111.3	V45 F188 F189	V45-E192 HydrophobicContact CG2-CB 4.2Å; V45-E192 HydrophobicContact CG2-CG 4.42Å; F188-E192 WeakPolarHBondContact O-CB 3.2Å; F188-E192 PolarHBondContact O-N 3.12Å; F189-E192 PolarHBondContact O-N 2.88Å
193	F	97.1	Very high	94.5	Very high	37 Å²	37	47.3 Å²	47.3	16%	0.162	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.3	10	-176.6	-56.2	-67.8	0	0	0	114.2	V45 L47 L53 W56 F189 Q191 L195	V45-F193 VanDerWaalsContact O-CE2 3.24Å; V45-F193 WeakPolarHBondContact O-CE2 3.35Å; V45-F193 WeakPolarHBondContact O-CZ 3.42Å; L47-F193 HydrophobicContact CB-CE1 4.02Å; L47-F193 HydrophobicContact CB-CZ 4.05Å; L53-F193 HydrophobicContact CD1-CD1 3.44Å; L53-F193 VanDerWaalsContact CD1-CD1 3.44Å; L53-F193 HydrophobicContact CD1-CE1 3.55Å; L53-F193 HydrophobicContact CD1-CG 4.21Å; L53-F193 HydrophobicContact CD1-CZ 4.4Å; W56-F193 AromaticContact CD1-CE2 3.63Å; W56-F193 AromaticContact CD1-CZ 3.42Å; W56-F193 VanDerWaalsContact CD1-CZ 3.42Å; W56-F193 AromaticContact NE1-CE2 3.68Å; W56-F193 AromaticContact NE1-CZ 3.61Å; F189-F193 HydrophobicContact CD1-CD2 4.3Å; F189-F193 HydrophobicContact CD2-CD2 4.21Å; F189-F193 AromaticContact CD2-CE2 3.91Å; F189-F193 HydrophobicContact CD2-CE2 3.91Å; F189-F193 AromaticContact CE1-CD2 3.99Å; F189-F193 HydrophobicContact CE1-CD2 3.99Å; F189-F193 HydrophobicContact CE1-CE2 4.42Å; F189-F193 AromaticContact CE2-CD2 3.87Å; F189-F193 HydrophobicContact CE2-CD2 3.87Å; F189-F193 AromaticContact CE2-CE2 3.46Å; F189-F193 HydrophobicContact CE2-CE2 3.46Å; F189-F193 VanDerWaalsContact CE2-CE2 3.46Å; F189-F193 HydrophobicContact CG-CD2 4.39Å; F189-F193 AromaticContact CZ-CD2 3.71Å; F189-F193 HydrophobicContact CZ-CD2 3.71Å; F189-F193 AromaticContact CZ-CE2 3.72Å; F189-F193 HydrophobicContact CZ-CE2 3.72Å; F189-F193 WeakPolarHBondContact O-CD2 3.23Å; F189-F193 PolarHBondContact O-N 2.92Å; Q191-F193 VanDerWaalsContact C-N 3.32Å; Q191-F193 PolarHBondContact O-N 3.06Å; F193-L195 VanDerWaalsContact C-N 3.33Å; F193-L195 HydrophobicContact CB-CD1 3.88Å; F193-L195 HydrophobicContact CB-CD2 3.87Å; F193-L195 HydrophobicContact CB-CG 3.66Å; F193-L195 HydrophobicContact CD2-CD1 4.49Å; F193-L195 PolarHBondContact O-N 2.97Å
194	N	96.8	Very high	94.2	Very high	111 Å²	111	47.6 Å²	47.6	59%	0.594	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.4	51.5	-179.2	-170.9	27.4	0	0	0	112.9	K149 V190 Q191	K149-N194 WeakPolarHBondContact CE-O 3.41Å; K149-N194 PolarHBondContact NZ-O 3.02Å; V190-N194 CarbonylContact O-C 3.57Å; V190-N194 WeakPolarHBondContact O-CA 3.36Å; V190-N194 PolarHBondContact O-N 3.45Å; V190-N194 VanDerWaalsContact O-N 3.11Å; Q191-N194 PolarHBondContact O-N 2.96Å
195	L	97.5	Very high	94	Very high	4 Å²	4	48.9 Å²	48.9	2%	0.021	23%	0.226	C	C	.	.			trans	-87.9	-20	-172.5	-58.3	175.5	0	0	0	113	V57 M145 K149 L152 F189 V190 F193	V57-L195 HydrophobicContact CG1-CD1 4.45Å; V57-L195 HydrophobicContact CG2-CD1 4.36Å; M145-L195 HydrophobicContact SD-CD2 3.58Å; M145-L195 VanDerWaalsContact SD-CD2 3.58Å; K149-L195 WeakPolarHBondContact CB-O 3.49Å; K149-L195 HydrophobicContact CG-CB 4.3Å; K149-L195 HydrophobicContact CG-CD2 4.06Å; K149-L195 VanDerWaalsContact CG-O 3.31Å; K149-L195 WeakPolarHBondContact CG-O 3.45Å; L152-L195 HydrophobicContact CD1-CB 3.86Å; L152-L195 HydrophobicContact CD1-CD1 3.37Å; L152-L195 HydrophobicContact CD1-CG 4.15Å; F189-L195 HydrophobicContact CD1-CD1 3.75Å; F189-L195 HydrophobicContact CE1-CD1 3.46Å; F189-L195 VanDerWaalsContact CE1-CD1 3.46Å; V190-L195 HydrophobicContact CB-CB 4.17Å; V190-L195 HydrophobicContact CG1-CB 4.31Å; V190-L195 PolarHBondContact O-N 3.23Å; F193-L195 VanDerWaalsContact C-N 3.33Å; F193-L195 HydrophobicContact CB-CD1 3.88Å; F193-L195 HydrophobicContact CB-CD2 3.87Å; F193-L195 HydrophobicContact CB-CG 3.66Å; F193-L195 HydrophobicContact CD2-CD1 4.49Å; F193-L195 PolarHBondContact O-N 2.97Å
196	I	97.3	Very high	93.4	Very high	11 Å²	11	54.2 Å²	54.2	6%	0.056	26%	0.255	C	S	.	.	S	Bend	trans	-130.4	130.3	177.1	-56.7	179	0	0	0	109.4	L152 F156 F186 V190 E200 L201	L152-I196 HydrophobicContact CB-CD1 4.26Å; L152-I196 HydrophobicContact CB-CG1 4.37Å; F156-I196 HydrophobicContact CB-CD1 4Å; F186-I196 HydrophobicContact CE1-CD1 3.79Å; F186-I196 HydrophobicContact CZ-CD1 3.76Å; V190-I196 HydrophobicContact CB-CB 4.49Å; V190-I196 HydrophobicContact CB-CD1 4.13Å; V190-I196 HydrophobicContact CB-CG1 4.09Å; V190-I196 HydrophobicContact CG1-CD1 3.8Å; V190-I196 HydrophobicContact CG1-CG1 4.07Å; V190-I196 HydrophobicContact CG2-CD1 4.23Å; I196-E200 HydrophobicContact CG2-CB 3.74Å; I196-E200 HydrophobicContact CG2-CG 4.46Å; I196-L201 HydrophobicContact CB-CD2 4.22Å; I196-L201 HydrophobicContact CB-CG 4.48Å; I196-L201 HydrophobicContact CD1-CD2 4.33Å; I196-L201 HydrophobicContact CG2-CD2 3.71Å; I196-L201 HydrophobicContact CG2-CG 3.89Å
197	E	93.4	Very high	92.7	Very high	114 Å²	114	56.2 Å²	56.2	53%	0.533	27%	0.265	S	S	.	.			trans	-66	140.8	175.3	-65.6	-179.6	-153.2	0	0	111.1	K199 E200	E197-K199 HydrophobicContact CB-CG 4.2Å; E197-K199 PolarHBondContact O-N 3.31Å; E197-K199 WeakPolarHBondContact OE2-CD 3.18Å; E197-K199 WeakPolarHBondContact OE2-CE 3.43Å; E197-K199 IonicContact OE2-NZ 3.78Å; E197-K199 PolarHBondContact OE2-NZ 3.17Å; E197-E200 HydrophobicContact CB-CG 4.4Å; E197-E200 WeakPolarHBondContact O-CB 3.08Å; E197-E200 PolarHBondContact O-N 3.4Å
198	R	91.3	Very high	92.3	Very high	215 Å²	215	56.3 Å²	56.3	81%	0.811	27%	0.266	S	S	*	.	H	α-helix	trans	-52.5	-34.9	-179.2	-65.7	-174.2	-179.5	-152.2	-0.5	113.9	E200 L201 V202	R198-E200 PolarHBondContact O-N 3.39Å; R198-L201 PolarHBondContact O-N 3.06Å; R198-L201 VanDerWaalsContact O-N 3.1Å; R198-V202 PolarHBondContact O-N 3Å
199	K	91.4	Very high	91.9	Very high	135 Å²	135	60.9 Å²	60.9	59%	0.587	29%	0.287	S	S	*	.	H	α-helix	trans	-62.7	-28.7	178.9	75.6	-172.5	-170.6	-151.8	0	113.3	E197 V202	E197-K199 HydrophobicContact CB-CG 4.2Å; E197-K199 PolarHBondContact O-N 3.31Å; E197-K199 WeakPolarHBondContact OE2-CD 3.18Å; E197-K199 WeakPolarHBondContact OE2-CE 3.43Å; E197-K199 IonicContact OE2-NZ 3.78Å; E197-K199 PolarHBondContact OE2-NZ 3.17Å; K199-V202 VanDerWaalsContact O-CG2 3.3Å; K199-V202 WeakPolarHBondContact O-CG2 3.41Å
200	E	91.1	Very high	91.1	Very high	51 Å²	51	68.2 Å²	68.2	24%	0.238	32%	0.319	C	S	.	.	H	α-helix	trans	-80.2	-23.2	178.2	-59	-77.2	162.5	0	0	111.2	K153 F156 R157 I196 E197 R198 P203	K153-E200 HydrophobicContact CD-CG 3.93Å; K153-E200 HydrophobicContact CG-CG 4.3Å; F156-E200 WeakPolarHBondContact CE1-O 3.38Å; R157-E200 IonicContact NH2-OE2 2.92Å; I196-E200 HydrophobicContact CG2-CB 3.74Å; I196-E200 HydrophobicContact CG2-CG 4.46Å; E197-E200 HydrophobicContact CB-CG 4.4Å; E197-E200 WeakPolarHBondContact O-CB 3.08Å; E197-E200 PolarHBondContact O-N 3.4Å; R198-E200 PolarHBondContact O-N 3.39Å; E200-P203 VanDerWaalsContact O-CD 3.29Å; E200-P203 WeakPolarHBondContact O-CD 3.14Å
201	L	93.4	Very high	90.1	Very high	8 Å²	8	69.9 Å²	69.9	4%	0.042	33%	0.328	C	S	.	.	H	α-helix	trans	-83.3	-12.6	-179.8	-61.9	177.6	0	0	0	113.7	F156 I187 I196 R198 P203 L204 Q205 I208	F156-L201 HydrophobicContact CD1-CD2 4.48Å; F156-L201 HydrophobicContact CD2-CD2 3.69Å; F156-L201 HydrophobicContact CE1-CD2 4.39Å; F156-L201 HydrophobicContact CE2-CD2 3.56Å; F156-L201 HydrophobicContact CG-CD2 4.16Å; F156-L201 HydrophobicContact CZ-CB 4.46Å; F156-L201 HydrophobicContact CZ-CD2 3.94Å; I187-L201 HydrophobicContact CD1-CD2 4.14Å; I196-L201 HydrophobicContact CB-CD2 4.22Å; I196-L201 HydrophobicContact CB-CG 4.48Å; I196-L201 HydrophobicContact CD1-CD2 4.33Å; I196-L201 HydrophobicContact CG2-CD2 3.71Å; I196-L201 HydrophobicContact CG2-CG 3.89Å; R198-L201 PolarHBondContact O-N 3.06Å; R198-L201 VanDerWaalsContact O-N 3.1Å; L201-P203 VanDerWaalsContact C-N 3.28Å; L201-P203 WeakPolarHBondContact O-CD 3.22Å; L201-P203 VanDerWaalsContact O-N 3.12Å; L201-L204 PolarHBondContact O-N 3.47Å; L201-Q205 PolarHBondContact O-N 2.85Å; L201-I208 HydrophobicContact CB-CD1 3.89Å; L201-I208 HydrophobicContact CD1-CD1 4.48Å; L201-I208 HydrophobicContact CD2-CD1 4.36Å; L201-I208 HydrophobicContact CG-CD1 4.47Å
202	V	91.6	Very high	89.3	Confident	63 Å²	63	66.8 Å²	66.8	38%	0.382	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-48.7	-39.1	-176.7	-175.9	0	0	0	0	114.1	Y93 R198 K199 L204 Q205	Y93-V202 WeakPolarHBondContact OH-CG1 3.44Å; R198-V202 PolarHBondContact O-N 3Å; K199-V202 VanDerWaalsContact O-CG2 3.3Å; K199-V202 WeakPolarHBondContact O-CG2 3.41Å; V202-L204 PolarHBondContact O-N 2.7Å; V202-Q205 PolarHBondContact O-N 3.14Å; V202-Q205 VanDerWaalsContact O-N 3.12Å
203	P	88.9	Confident	88.2	Confident	14 Å²	14	65.9 Å²	65.9	9%	0.091	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-56.2	-23.4	179	-26.5	35.7	0	0	0	115.1	A89 Y93 F156 A160 H164 E200 L201	A89-P203 HydrophobicContact CB-CB 3.91Å; Y93-P203 HydrophobicContact CD1-CG 4.04Å; Y93-P203 HydrophobicContact CD2-CB 3.75Å; Y93-P203 HydrophobicContact CD2-CG 3.73Å; Y93-P203 HydrophobicContact CE1-CG 4.24Å; Y93-P203 HydrophobicContact CE2-CB 3.99Å; Y93-P203 HydrophobicContact CE2-CG 3.95Å; Y93-P203 HydrophobicContact CG-CB 4.25Å; Y93-P203 HydrophobicContact CG-CG 3.79Å; F156-P203 HydrophobicContact CE1-CG 4.5Å; A160-P203 HydrophobicContact CB-CB 4.44Å; H164-P203 PolarHBondContact NE2-O 3.09Å; E200-P203 VanDerWaalsContact O-CD 3.29Å; E200-P203 WeakPolarHBondContact O-CD 3.14Å; L201-P203 VanDerWaalsContact C-N 3.28Å; L201-P203 WeakPolarHBondContact O-CD 3.22Å; L201-P203 VanDerWaalsContact O-N 3.12Å
204	L	89.3	Confident	86.3	Confident	8 Å²	8	73 Å²	73	4%	0.042	35%	0.347	C	S	.	.	G	3₁₀ helix	trans	-123.9	19.1	178.2	-64.7	-178.6	0	0	0	112.9	F156 A160 Y163 F183 L201 V202 D206 L207 I208	F156-L204 HydrophobicContact CE2-CB 4.28Å; F156-L204 HydrophobicContact CE2-CD1 3.87Å; F156-L204 HydrophobicContact CE2-CG 4.38Å; F156-L204 HydrophobicContact CZ-CB 4.02Å; F156-L204 HydrophobicContact CZ-CD1 4.01Å; F156-L204 HydrophobicContact CZ-CG 4.07Å; A160-L204 HydrophobicContact CB-CD1 4.06Å; A160-L204 HydrophobicContact CB-CG 4.1Å; Y163-L204 HydrophobicContact CD2-CD1 3.92Å; Y163-L204 HydrophobicContact CD2-CD2 4.36Å; Y163-L204 HydrophobicContact CG-CD2 4.37Å; F183-L204 HydrophobicContact CE1-CD1 4.16Å; F183-L204 HydrophobicContact CE2-CD1 3.62Å; F183-L204 HydrophobicContact CZ-CB 4.08Å; F183-L204 HydrophobicContact CZ-CD1 3.38Å; F183-L204 HydrophobicContact CZ-CG 4.4Å; L201-L204 PolarHBondContact O-N 3.47Å; V202-L204 PolarHBondContact O-N 2.7Å; L204-D206 PolarHBondContact O-N 2.59Å; L204-L207 HydrophobicContact CD2-CD2 4.27Å; L204-L207 WeakPolarHBondContact O-CB 3.39Å; L204-L207 PolarHBondContact O-N 2.86Å; L204-I208 HydrophobicContact CB-CD1 4.3Å; L204-I208 HydrophobicContact CB-CG1 4.45Å; L204-I208 WeakPolarHBondContact O-CG1 3.3Å; L204-I208 PolarHBondContact O-N 2.96Å
205	Q	88.3	Confident	84.3	Confident	63 Å²	63	69.4 Å²	69.4	29%	0.294	33%	0.328	S	S	.	.	H	α-helix	trans	-53.8	-48.7	-174.2	-175.6	62.9	36	0	0	112.7	L201 V202 L207 I208 E209	L201-Q205 PolarHBondContact O-N 2.85Å; V202-Q205 PolarHBondContact O-N 3.14Å; V202-Q205 VanDerWaalsContact O-N 3.12Å; Q205-L207 VanDerWaalsContact C-N 3.27Å; Q205-L207 PolarHBondContact O-N 3.39Å; Q205-I208 WeakPolarHBondContact O-CB 3.48Å; Q205-I208 PolarHBondContact O-N 3.28Å; Q205-E209 PolarHBondContact NE2-OE1 3.29Å; Q205-E209 WeakPolarHBondContact O-CG 3.3Å; Q205-E209 PolarHBondContact O-N 2.63Å
206	D	81	Confident	82.1	Confident	115 Å²	115	82 Å²	82	62%	0.615	38%	0.375	S	S	*	.	H	α-helix	trans	-62.1	-36.2	-179.8	-60.8	-13.5	0	0	0	112.2	L204 K210	L204-D206 PolarHBondContact O-N 2.59Å; D206-K210 VanDerWaalsContact O-CG 3.26Å; D206-K210 WeakPolarHBondContact O-CG 3.44Å; D206-K210 PolarHBondContact O-N 3.06Å; D206-K210 VanDerWaalsContact O-N 3.11Å
207	L	82.4	Confident	81.3	Confident	42 Å²	42	85.6 Å²	85.6	22%	0.22	39%	0.391	C	S	.	.	H	α-helix	trans	-71.3	-44	177.1	179.2	65.2	0	0	0	110.8	Y163 F183 L204 Q205 E209 K210 L211	Y163-L207 HydrophobicContact CD1-CD2 3.63Å; Y163-L207 HydrophobicContact CD2-CD2 3.79Å; Y163-L207 HydrophobicContact CE1-CD2 3.54Å; Y163-L207 HydrophobicContact CE2-CD2 3.73Å; Y163-L207 HydrophobicContact CG-CD2 3.76Å; F183-L207 HydrophobicContact CD1-CD2 4.09Å; F183-L207 HydrophobicContact CE1-CD2 3.76Å; F183-L207 HydrophobicContact CE1-CG 4.09Å; L204-L207 HydrophobicContact CD2-CD2 4.27Å; L204-L207 WeakPolarHBondContact O-CB 3.39Å; L204-L207 PolarHBondContact O-N 2.86Å; Q205-L207 VanDerWaalsContact C-N 3.27Å; Q205-L207 PolarHBondContact O-N 3.39Å; L207-E209 VanDerWaalsContact C-N 3.3Å; L207-E209 PolarHBondContact O-N 3.46Å; L207-K210 PolarHBondContact O-N 2.89Å; L207-L211 HydrophobicContact CD1-CD1 3.76Å; L207-L211 HydrophobicContact CD1-CG 3.88Å; L207-L211 HydrophobicContact CD2-CD1 4.3Å; L207-L211 HydrophobicContact CG-CD1 3.75Å; L207-L211 HydrophobicContact CG-CG 4.21Å; L207-L211 WeakPolarHBondContact O-CB 3.39Å; L207-L211 WeakPolarHBondContact O-CG 2.87Å; L207-L211 PolarHBondContact O-N 2.83Å
208	I	88.6	Confident	80.7	Confident	4 Å²	4	84.1 Å²	84.1	2%	0.021	38%	0.384	C	S	.	.	H	α-helix	trans	-56	-48.1	175.3	-71.4	165	0	0	0	109.7	F156 F183 I187 L201 L204 Q205 K210 L211 T212	F156-I208 HydrophobicContact CE2-CD1 4.45Å; F183-I208 HydrophobicContact CE1-CG1 4.04Å; F183-I208 HydrophobicContact CZ-CD1 4.35Å; F183-I208 HydrophobicContact CZ-CG1 3.83Å; I187-I208 HydrophobicContact CD1-CD1 3.71Å; I187-I208 HydrophobicContact CD1-CG1 3.84Å; I187-I208 HydrophobicContact CG1-CD1 4.48Å; I187-I208 HydrophobicContact CG1-CG1 4.05Å; I187-I208 HydrophobicContact CG2-CG1 4.33Å; I187-I208 HydrophobicContact CG2-CG2 3.89Å; L201-I208 HydrophobicContact CB-CD1 3.89Å; L201-I208 HydrophobicContact CD1-CD1 4.48Å; L201-I208 HydrophobicContact CD2-CD1 4.36Å; L201-I208 HydrophobicContact CG-CD1 4.47Å; L204-I208 HydrophobicContact CB-CD1 4.3Å; L204-I208 HydrophobicContact CB-CG1 4.45Å; L204-I208 WeakPolarHBondContact O-CG1 3.3Å; L204-I208 PolarHBondContact O-N 2.96Å; Q205-I208 WeakPolarHBondContact O-CB 3.48Å; Q205-I208 PolarHBondContact O-N 3.28Å; I208-K210 PolarHBondContact O-N 3.19Å; I208-L211 PolarHBondContact O-N 3.01Å; I208-T212 HydrophobicContact CG2-CG2 4.34Å; I208-T212 VanDerWaalsContact O-CB 3.3Å; I208-T212 WeakPolarHBondContact O-CB 3.47Å; I208-T212 VanDerWaalsContact O-CG2 3.22Å; I208-T212 WeakPolarHBondContact O-CG2 3.28Å; I208-T212 PolarHBondContact O-N 3.21Å; I208-T212 PolarHBondContact O-OG1 3.21Å
209	E	86.9	Confident	80.1	Confident	98 Å²	98	76.8 Å²	76.8	46%	0.458	36%	0.36	S	S	.	.	H	α-helix	trans	-59.3	-49.4	177.4	-72.7	174.8	-167.2	0	0	111.1	Q205 L207 L211 T212 T213	Q205-E209 PolarHBondContact NE2-OE1 3.29Å; Q205-E209 WeakPolarHBondContact O-CG 3.3Å; Q205-E209 PolarHBondContact O-N 2.63Å; L207-E209 VanDerWaalsContact C-N 3.3Å; L207-E209 PolarHBondContact O-N 3.46Å; E209-L211 PolarHBondContact O-N 3.41Å; E209-T212 PolarHBondContact O-N 3.16Å; E209-T213 VanDerWaalsContact O-CB 3.32Å; E209-T213 WeakPolarHBondContact O-CB 3.3Å; E209-T213 PolarHBondContact O-N 2.7Å; E209-T213 PolarHBondContact O-OG1 3.38Å
210	K	78.6	Confident	79.4	Confident	155 Å²	155	73.4 Å²	73.4	67%	0.674	35%	0.346	S	S	*	.	H	α-helix	trans	-59.6	-43.6	178.7	-73.7	170.2	-175.7	175.3	0	113.5	D206 L207 I208	D206-K210 VanDerWaalsContact O-CG 3.26Å; D206-K210 WeakPolarHBondContact O-CG 3.44Å; D206-K210 PolarHBondContact O-N 3.06Å; D206-K210 VanDerWaalsContact O-N 3.11Å; L207-K210 PolarHBondContact O-N 2.89Å; I208-K210 PolarHBondContact O-N 3.19Å
211	L	76.7	Confident	78.7	Confident	37 Å²	37	74.8 Å²	74.8	19%	0.194	35%	0.353	C	S	.	.	H	α-helix	trans	-77.3	-25.9	-175.1	-69.6	178.9	0	0	0	113.4	F183 K184 L207 I208 E209	F183-L211 HydrophobicContact CD1-CD1 3.66Å; F183-L211 HydrophobicContact CE1-CD1 4.11Å; K184-L211 WeakPolarHBondContact CE-O 3.49Å; L207-L211 HydrophobicContact CD1-CD1 3.76Å; L207-L211 HydrophobicContact CD1-CG 3.88Å; L207-L211 HydrophobicContact CD2-CD1 4.3Å; L207-L211 HydrophobicContact CG-CD1 3.75Å; L207-L211 HydrophobicContact CG-CG 4.21Å; L207-L211 WeakPolarHBondContact O-CB 3.39Å; L207-L211 WeakPolarHBondContact O-CG 2.87Å; L207-L211 PolarHBondContact O-N 2.83Å; I208-L211 PolarHBondContact O-N 3.01Å; E209-L211 PolarHBondContact O-N 3.41Å
212	T	77.7	Confident	77.7	Confident	15 Å²	15	79.3 Å²	79.3	9%	0.092	37%	0.374	C	S	.	.	H	α-helix	trans	-100.8	-12.6	-175.5	63	0	0	0	0	114.2	R42 I187 F188 I208 E209 K214 D215	R42-T212 PolarHBondContact NH2-O 3.05Å; I187-T212 HydrophobicContact CG2-CG2 3.9Å; F188-T212 HydrophobicContact CD1-CG2 4.05Å; F188-T212 HydrophobicContact CE1-CG2 3.41Å; F188-T212 VanDerWaalsContact CE1-CG2 3.41Å; F188-T212 HydrophobicContact CZ-CG2 4.06Å; I208-T212 HydrophobicContact CG2-CG2 4.34Å; I208-T212 VanDerWaalsContact O-CB 3.3Å; I208-T212 WeakPolarHBondContact O-CB 3.47Å; I208-T212 VanDerWaalsContact O-CG2 3.22Å; I208-T212 WeakPolarHBondContact O-CG2 3.28Å; I208-T212 PolarHBondContact O-N 3.21Å; I208-T212 PolarHBondContact O-OG1 3.21Å; E209-T212 PolarHBondContact O-N 3.16Å; T212-K214 VanDerWaalsContact C-N 3.35Å; T212-D215 PolarHBondContact O-N 2.94Å
213	T	72.4	Confident	76.7	Confident	83 Å²	83	80.4 Å²	80.4	51%	0.509	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-70.1	-28.4	-179.7	-62.5	0	0	0	0	112.9	E209 D215 R216	E209-T213 VanDerWaalsContact O-CB 3.32Å; E209-T213 WeakPolarHBondContact O-CB 3.3Å; E209-T213 PolarHBondContact O-N 2.7Å; E209-T213 PolarHBondContact O-OG1 3.38Å; T213-D215 PolarHBondContact O-N 3.17Å; T213-R216 PolarHBondContact O-N 3.03Å
214	K	56.8	Low	75.8	Confident	188 Å²	188	85.5 Å²	85.5	82%	0.817	40%	0.395	S	S	*	.	G	3₁₀ helix	trans	-72.5	-14	179.6	-72.2	-173.4	177.1	-179.3	0	114.1	T212	T212-K214 VanDerWaalsContact C-N 3.35Å
215	D	55.8	Low	74.6	Confident	34 Å²	34	92 Å²	92	18%	0.182	43%	0.425	C	S	.	.	G	3₁₀ helix	trans	-112.8	21.5	-178.1	-38.8	-93	0	0	0	111.7	R42 K184 F188 T212 T213	R42-D215 WeakPolarHBondContact CD-O 3.43Å; R42-D215 HydrophobicContact CG-CB 4.41Å; R42-D215 PolarHBondContact NE-O 2.67Å; K184-D215 WeakPolarHBondContact CE-OD2 3.5Å; K184-D215 IonicContact NZ-OD1 3.51Å; K184-D215 PolarHBondContact NZ-OD1 2.85Å; K184-D215 IonicContact NZ-OD2 2.71Å; K184-D215 PolarHBondContact NZ-OD2 2.85Å; F188-D215 HydrophobicContact CE2-CB 4.39Å; F188-D215 HydrophobicContact CZ-CB 3.88Å; F188-D215 WeakPolarHBondContact CZ-OD2 3.1Å; T212-D215 PolarHBondContact O-N 2.94Å; T213-D215 PolarHBondContact O-N 3.17Å
216	R	50.1	Low	73.4	Confident	270 Å²	270	94.6 Å²	94.6	100%	1.019	44%	0.436	S	S	*	.			trans	-88.8	0	165.4	-88.5	-176.8	137.1	-176.5	-4.1	109.5	T213	T213-R216 PolarHBondContact O-N 3.03Å

Retrieved 216 of 216 residues in 947.7 ms (Link to these results)

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