A0A077Z905_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z905, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 215 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	37	Very low	37.5	Very low	248 Å²	248	119.7 Å²	119.7	100%	1.222	69%	0.686	S	S	*	*				0	74.3	0	-67.3	-178	169.2	0	0	108.2
2	A	39.7	Very low	38.1	Very low	115 Å²	115	118.2 Å²	118.2	95%	0.95	69%	0.688	S	S	*	*			trans	-114	34.8	-167.5	0	0	0	0	0	112.8
3	G	33.8	Very low	38.5	Very low	54 Å²	54	114.4 Å²	114.4	56%	0.557	67%	0.672	S	S	*	*	S	Bend	trans	-118.2	-13.2	-170.4	0	0	0	0	0	116.5
4	E	35.4	Very low	38.6	Very low	169 Å²	169	111.4 Å²	111.4	79%	0.79	66%	0.658	S	S	*	*	S	Bend	trans	-92.7	-24.6	-170.3	-74.1	175.3	159.4	0	0	114	A6	E4-A6 PolarHBondContact O-N 3.38Å
5	N	37.3	Very low	39.1	Very low	122 Å²	122	105.7 Å²	105.7	65%	0.652	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	-17.9	-172.9	-68.8	-8	0	0	0	115.1
6	A	36.1	Very low	39.3	Very low	70 Å²	70	107.9 Å²	107.9	58%	0.579	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.3	-18.3	-174.7	0	0	0	0	0	113.8	E4	E4-A6 PolarHBondContact O-N 3.38Å
7	I	36.3	Very low	39.4	Very low	133 Å²	133	113.2 Å²	113.2	68%	0.682	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.9	-29.6	-174.7	-58.4	176.8	0	0	0	111.1
8	M	36.4	Very low	40.2	Very low	98 Å²	98	109.2 Å²	109.2	48%	0.483	61%	0.614	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75.2	-34.6	-177.1	-65.9	-67.4	-135.2	0	0	113.8	N10 D11	M8-N10 PolarHBondContact O-N 2.97Å; M8-D11 PolarHBondContact O-N 3.37Å
9	L	38.2	Very low	41.2	Very low	103 Å²	103	108.8 Å²	108.8	54%	0.539	63%	0.626	S	S	.	*	T	Hydrogen-bonded Turn	trans	-68	-23.4	-177.3	-72.4	171.2	0	0	0	113.4
10	N	38	Very low	42.5	Very low	136 Å²	136	104.9 Å²	104.9	73%	0.727	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.6	0.3	-179.7	-86.7	-12.3	0	0	0	113.7	M8 S12	M8-N10 PolarHBondContact O-N 2.97Å; N10-S12 VanDerWaalsContact C-N 3.25Å; N10-S12 PolarHBondContact O-N 3.45Å
11	D	44.5	Very low	43.8	Very low	69 Å²	69	100 Å²	100	37%	0.369	58%	0.579	S	S	.	*			trans	-75.5	88	176.1	-151	-24.9	0	0	0	110.3	M8 S13 R27	M8-D11 PolarHBondContact O-N 3.37Å; D11-S13 PolarHBondContact O-N 3.47Å; D11-S13 WeakPolarHBondContact OD1-CB 3.4Å; D11-S13 PolarHBondContact OD1-N 3.38Å; D11-S13 PolarHBondContact OD1-OG 3.43Å; D11-R27 IonicContact OD2-CZ 2.84Å; D11-R27 IonicContact OD2-NH1 3.06Å; D11-R27 IonicContact OD2-NH2 3.71Å; D11-R27 PolarHBondContact OD2-NH2 3.22Å
12	S	44.2	Very low	45.5	Very low	101 Å²	101	89.9 Å²	89.9	71%	0.706	53%	0.533	S	S	*	.			trans	-80.9	6.5	173.3	-56.9	0	0	0	0	112	N10	N10-S12 VanDerWaalsContact C-N 3.25Å; N10-S12 PolarHBondContact O-N 3.45Å
13	S	43.4	Very low	47.2	Very low	69 Å²	69	89.8 Å²	89.8	48%	0.483	51%	0.512	S	S	.	.			trans	-61.2	134.7	179.6	-57.8	0	0	0	0	109.6	D11 L15	D11-S13 PolarHBondContact O-N 3.47Å; D11-S13 WeakPolarHBondContact OD1-CB 3.4Å; D11-S13 PolarHBondContact OD1-N 3.38Å; D11-S13 PolarHBondContact OD1-OG 3.43Å; S13-L15 PolarHBondContact O-N 3.22Å
14	P	39.5	Very low	49	Very low	72 Å²	72	88.4 Å²	88.4	47%	0.468	49%	0.49	S	S	.	.			trans	-55.8	130.6	172.7	-23.1	33.2	0	0	0	109.9	L16 Y17	P14-L16 HydrophobicContact CB-CB 4.34Å; P14-L16 PolarHBondContact O-N 2.86Å; P14-Y17 HydrophobicContact CB-CD2 4.06Å; P14-Y17 HydrophobicContact CB-CE2 4.14Å; P14-Y17 HydrophobicContact CG-CD2 4.18Å; P14-Y17 HydrophobicContact CG-CE2 3.9Å; P14-Y17 PolarHBondContact O-N 3.05Å
15	L	46.5	Very low	51	Low	26 Å²	26	80.3 Å²	80.3	14%	0.136	45%	0.453	C	S	.	.	G	3₁₀ helix	trans	-57.2	-15.2	174.8	-68.1	158.6	0	0	0	112.4	S13 Y17 R24 R27 F28	S13-L15 PolarHBondContact O-N 3.22Å; L15-Y17 PolarHBondContact O-N 3.22Å; L15-R24 WeakPolarHBondContact O-CD 3.41Å; L15-R24 VanDerWaalsContact O-CG 3.29Å; L15-R24 WeakPolarHBondContact O-CG 3.5Å; L15-R27 HydrophobicContact CD2-CG 4.36Å; L15-F28 HydrophobicContact CD1-CD2 3.54Å; L15-F28 HydrophobicContact CD1-CE2 4.23Å
16	L	43	Very low	53	Low	142 Å²	142	76.8 Å²	76.8	74%	0.743	44%	0.437	S	S	*	.	G	3₁₀ helix	trans	-64.2	-14.1	178	-74.4	161.6	0	0	0	115.1	P14	P14-L16 HydrophobicContact CB-CB 4.34Å; P14-L16 PolarHBondContact O-N 2.86Å
17	Y	41.3	Very low	54.9	Low	197 Å²	197	76.8 Å²	76.8	77%	0.773	42%	0.422	S	S	*	.	G	3₁₀ helix	trans	-90.3	-4.6	-176	-75	-71.8	0	0	0	115.7	P14 L15	P14-Y17 HydrophobicContact CB-CD2 4.06Å; P14-Y17 HydrophobicContact CB-CE2 4.14Å; P14-Y17 HydrophobicContact CG-CD2 4.18Å; P14-Y17 HydrophobicContact CG-CE2 3.9Å; P14-Y17 PolarHBondContact O-N 3.05Å; L15-Y17 PolarHBondContact O-N 3.22Å
18	E	52.1	Low	56.8	Low	42 Å²	42	70.5 Å²	70.5	20%	0.196	39%	0.39	C	S	.	.			trans	-86.9	132.7	179	-78.1	171.1	-160.3	0	0	111.7	A20 R24 R27	E18-A20 PolarHBondContact O-N 3.21Å; E18-R24 HydrophobicContact CB-CG 3.44Å; E18-R24 VanDerWaalsContact CB-CG 3.44Å; E18-R24 HydrophobicContact CG-CG 4.43Å; E18-R24 PolarHBondContact O-NE 2.85Å; E18-R24 VanDerWaalsContact OE2-CA 3.24Å; E18-R24 WeakPolarHBondContact OE2-CA 3.43Å; E18-R24 PolarHBondContact OE2-N 2.89Å; E18-R27 WeakPolarHBondContact OE1-CD 3.44Å; E18-R27 IonicContact OE1-CZ 3.41Å; E18-R27 IonicContact OE1-NE 3.71Å; E18-R27 IonicContact OE1-NH1 2.71Å; E18-R27 PolarHBondContact OE1-NH1 3.35Å
19	A	59.3	Low	58.8	Low	102 Å²	102	66.1 Å²	66.1	84%	0.843	37%	0.369	S	S	*	.	S	Bend	trans	-71.4	-28.9	-171.5	0	0	0	0	0	113.3
20	A	68.7	Low	60.9	Low	29 Å²	29	65.7 Å²	65.7	24%	0.24	36%	0.364	C	S	.	.			trans	-105.1	131.7	-179.3	0	0	0	0	0	111	E18 S22 E23 R24	E18-A20 PolarHBondContact O-N 3.21Å; A20-S22 PolarHBondContact O-N 2.82Å; A20-E23 HydrophobicContact CB-CB 4.3Å; A20-E23 HydrophobicContact CB-CG 4.03Å; A20-E23 PolarHBondContact O-N 3.08Å; A20-R24 PolarHBondContact O-N 3.04Å
21	A	69.1	Low	62.9	Low	2 Å²	2	62.4 Å²	62.4	2%	0.017	34%	0.343	C	S	.	.	H	α-helix	trans	-62.1	-31	175.5	0	0	0	0	0	112.8	R24 I25 V55 M59	A21-R24 PolarHBondContact O-N 3.39Å; A21-I25 WeakPolarHBondContact O-CG1 3.3Å; A21-I25 PolarHBondContact O-N 3.09Å; A21-I25 VanDerWaalsContact O-N 3.08Å; A21-V55 HydrophobicContact CB-CG1 4.27Å; A21-M59 HydrophobicContact CB-CB 3.65Å; A21-M59 HydrophobicContact CB-CG 4.09Å
22	S	72.4	Confident	64.2	Low	36 Å²	36	59.5 Å²	59.5	25%	0.252	33%	0.328	S	S	.	.	H	α-helix	trans	-67	-39	176.6	55.3	0	0	0	0	113.5	A20 S26	A20-S22 PolarHBondContact O-N 2.82Å; S22-S26 WeakPolarHBondContact O-CB 3.16Å; S22-S26 PolarHBondContact O-N 3.2Å; S22-S26 PolarHBondContact O-OG 2.66Å
23	E	75.6	Confident	65.8	Low	113 Å²	113	60.6 Å²	60.6	53%	0.528	32%	0.32	S	S	.	.	H	α-helix	trans	-64.6	-45.2	176	-70.9	176.7	173.7	0	0	110	A20 I25 S26 R27	A20-E23 HydrophobicContact CB-CB 4.3Å; A20-E23 HydrophobicContact CB-CG 4.03Å; A20-E23 PolarHBondContact O-N 3.08Å; E23-I25 PolarHBondContact O-N 2.99Å; E23-S26 PolarHBondContact O-N 3.06Å; E23-R27 WeakPolarHBondContact O-CB 3.48Å; E23-R27 PolarHBondContact O-N 3.41Å
24	R	71	Confident	67.6	Low	25 Å²	25	61.4 Å²	61.4	9%	0.094	32%	0.317	C	S	.	.	H	α-helix	trans	-56.9	-48.2	177.3	-72.2	-176.8	-78.9	170.7	-5.1	112.4	L15 E18 A20 A21 F28 V55	L15-R24 WeakPolarHBondContact O-CD 3.41Å; L15-R24 VanDerWaalsContact O-CG 3.29Å; L15-R24 WeakPolarHBondContact O-CG 3.5Å; E18-R24 HydrophobicContact CB-CG 3.44Å; E18-R24 VanDerWaalsContact CB-CG 3.44Å; E18-R24 HydrophobicContact CG-CG 4.43Å; E18-R24 PolarHBondContact O-NE 2.85Å; E18-R24 VanDerWaalsContact OE2-CA 3.24Å; E18-R24 WeakPolarHBondContact OE2-CA 3.43Å; E18-R24 PolarHBondContact OE2-N 2.89Å; A20-R24 PolarHBondContact O-N 3.04Å; A21-R24 PolarHBondContact O-N 3.39Å; R24-F28 VanDerWaalsContact O-CB 3.27Å; R24-F28 WeakPolarHBondContact O-CB 3.5Å; R24-F28 PolarHBondContact O-N 3.46Å; R24-V55 HydrophobicContact CB-CG1 3.65Å
25	I	78	Confident	69.5	Low	0 Å²	0	60.5 Å²	60.5	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-64	-46.3	178.2	-69.3	165.9	0	0	0	110.5	A21 E23 R27 F28 L29 L52 V55 Y56 M59 Y76	A21-I25 WeakPolarHBondContact O-CG1 3.3Å; A21-I25 PolarHBondContact O-N 3.09Å; A21-I25 VanDerWaalsContact O-N 3.08Å; E23-I25 PolarHBondContact O-N 2.99Å; I25-R27 VanDerWaalsContact C-N 3.34Å; I25-R27 PolarHBondContact O-N 3.4Å; I25-F28 WeakPolarHBondContact O-CB 3.46Å; I25-F28 PolarHBondContact O-N 3Å; I25-L29 HydrophobicContact CG2-CD1 3.59Å; I25-L29 HydrophobicContact CG2-CG 4.19Å; I25-L29 VanDerWaalsContact O-CG 3.22Å; I25-L29 WeakPolarHBondContact O-CG 3.17Å; I25-L29 PolarHBondContact O-N 2.83Å; I25-L52 HydrophobicContact CB-CD1 4.29Å; I25-L52 HydrophobicContact CG1-CD1 4.05Å; I25-L52 HydrophobicContact CG2-CD1 3.97Å; I25-V55 HydrophobicContact CD1-CG1 4.15Å; I25-V55 HydrophobicContact CG1-CB 4.28Å; I25-V55 HydrophobicContact CG1-CG1 3.65Å; I25-Y56 HydrophobicContact CD1-CD2 4.2Å; I25-M59 HydrophobicContact CD1-CB 4.12Å; I25-M59 HydrophobicContact CD1-CE 3.33Å; I25-M59 HydrophobicContact CD1-CG 4.49Å; I25-M59 HydrophobicContact CD1-SD 3.62Å; I25-Y76 HydrophobicContact CB-CD1 4.43Å; I25-Y76 HydrophobicContact CB-CE1 4.38Å; I25-Y76 HydrophobicContact CG2-CD1 3.29Å; I25-Y76 HydrophobicContact CG2-CE1 3.57Å; I25-Y76 HydrophobicContact CG2-CG 3.87Å
26	S	79.3	Confident	71	Confident	47 Å²	47	63 Å²	63	33%	0.329	33%	0.325	S	S	.	.	H	α-helix	trans	-59.1	-46.7	-178.8	-59.2	0	0	0	0	111.8	S22 E23 F28 L29 E30 Y76	S22-S26 WeakPolarHBondContact O-CB 3.16Å; S22-S26 PolarHBondContact O-N 3.2Å; S22-S26 PolarHBondContact O-OG 2.66Å; E23-S26 PolarHBondContact O-N 3.06Å; S26-F28 VanDerWaalsContact C-N 3.3Å; S26-F28 PolarHBondContact O-N 3.15Å; S26-L29 PolarHBondContact O-N 2.95Å; S26-E30 WeakPolarHBondContact O-CB 3.25Å; S26-E30 PolarHBondContact O-N 3.28Å; S26-Y76 PolarHBondContact OG-OH 3.37Å
27	R	76.6	Confident	72.6	Confident	70 Å²	70	63.1 Å²	63.1	26%	0.264	33%	0.326	S	S	.	.	H	α-helix	trans	-63.7	-39.3	178.1	-174.2	177.9	-169.7	149.8	18.8	112.2	D11 L15 E18 E23 I25 E30 K31	D11-R27 IonicContact OD2-CZ 2.84Å; D11-R27 IonicContact OD2-NH1 3.06Å; D11-R27 IonicContact OD2-NH2 3.71Å; D11-R27 PolarHBondContact OD2-NH2 3.22Å; L15-R27 HydrophobicContact CD2-CG 4.36Å; E18-R27 WeakPolarHBondContact OE1-CD 3.44Å; E18-R27 IonicContact OE1-CZ 3.41Å; E18-R27 IonicContact OE1-NE 3.71Å; E18-R27 IonicContact OE1-NH1 2.71Å; E18-R27 PolarHBondContact OE1-NH1 3.35Å; E23-R27 WeakPolarHBondContact O-CB 3.48Å; E23-R27 PolarHBondContact O-N 3.41Å; I25-R27 VanDerWaalsContact C-N 3.34Å; I25-R27 PolarHBondContact O-N 3.4Å; R27-E30 PolarHBondContact O-N 3.35Å; R27-K31 WeakPolarHBondContact O-CB 3.45Å; R27-K31 PolarHBondContact O-N 3.49Å
28	F	76.3	Confident	74.1	Confident	2 Å²	2	57.5 Å²	57.5	1%	0.009	32%	0.316	C	S	.	.	H	α-helix	trans	-63.5	-46.7	176.9	-173.8	-84.5	0	0	0	111.9	L15 R24 I25 S26 E30 K31 I32 D48 L52	L15-F28 HydrophobicContact CD1-CD2 3.54Å; L15-F28 HydrophobicContact CD1-CE2 4.23Å; R24-F28 VanDerWaalsContact O-CB 3.27Å; R24-F28 WeakPolarHBondContact O-CB 3.5Å; R24-F28 PolarHBondContact O-N 3.46Å; I25-F28 WeakPolarHBondContact O-CB 3.46Å; I25-F28 PolarHBondContact O-N 3Å; S26-F28 VanDerWaalsContact C-N 3.3Å; S26-F28 PolarHBondContact O-N 3.15Å; F28-E30 VanDerWaalsContact C-N 3.29Å; F28-E30 PolarHBondContact O-N 2.86Å; F28-K31 WeakPolarHBondContact O-CB 3.4Å; F28-K31 PolarHBondContact O-N 2.77Å; F28-K31 VanDerWaalsContact O-N 3.16Å; F28-I32 HydrophobicContact CD1-CD1 3.84Å; F28-I32 HydrophobicContact CD1-CG1 4.26Å; F28-I32 HydrophobicContact CE1-CD1 3.07Å; F28-I32 HydrophobicContact CE1-CG1 3.73Å; F28-I32 HydrophobicContact CZ-CD1 3.71Å; F28-I32 HydrophobicContact CZ-CG1 4.1Å; F28-I32 PolarHBondContact O-N 3.12Å; F28-D48 VanDerWaalsContact CE2-CA 3.49Å; F28-D48 HydrophobicContact CE2-CB 3.37Å; F28-D48 WeakPolarHBondContact CE2-O 3.31Å; F28-D48 HydrophobicContact CZ-CB 3.37Å; F28-D48 WeakPolarHBondContact CZ-O 3.37Å; F28-L52 HydrophobicContact CB-CD1 4.17Å; F28-L52 HydrophobicContact CD1-CB 3.55Å; F28-L52 HydrophobicContact CD1-CD1 3.59Å; F28-L52 HydrophobicContact CD1-CD2 3.55Å; F28-L52 HydrophobicContact CD1-CG 3.71Å; F28-L52 HydrophobicContact CD2-CB 4.34Å; F28-L52 HydrophobicContact CE1-CB 3.38Å; F28-L52 HydrophobicContact CE1-CD1 4.26Å; F28-L52 HydrophobicContact CE1-CD2 3.5Å; F28-L52 HydrophobicContact CE1-CG 3.85Å; F28-L52 HydrophobicContact CE2-CB 4.27Å; F28-L52 HydrophobicContact CG-CB 4.03Å; F28-L52 HydrophobicContact CG-CD1 4Å; F28-L52 HydrophobicContact CG-CG 4.42Å; F28-L52 HydrophobicContact CZ-CB 3.84Å
29	L	78.8	Confident	75.1	Confident	6 Å²	6	56.3 Å²	56.3	3%	0.031	31%	0.309	C	S	.	.	H	α-helix	trans	-63.3	-38.2	177.3	-65	167.8	0	0	0	111.3	I25 S26 K33 L52 Y76 E79 Y83	I25-L29 HydrophobicContact CG2-CD1 3.59Å; I25-L29 HydrophobicContact CG2-CG 4.19Å; I25-L29 VanDerWaalsContact O-CG 3.22Å; I25-L29 WeakPolarHBondContact O-CG 3.17Å; I25-L29 PolarHBondContact O-N 2.83Å; S26-L29 PolarHBondContact O-N 2.95Å; L29-K33 WeakPolarHBondContact O-CB 3.26Å; L29-K33 WeakPolarHBondContact O-CD 3.44Å; L29-K33 WeakPolarHBondContact O-CG 3.44Å; L29-K33 PolarHBondContact O-N 2.79Å; L29-L52 HydrophobicContact CD2-CD2 4.07Å; L29-Y76 HydrophobicContact CD1-CD1 3.64Å; L29-Y76 HydrophobicContact CD1-CE1 3.86Å; L29-E79 HydrophobicContact CD1-CB 4.31Å; L29-E79 WeakPolarHBondContact CD1-OE2 3.47Å; L29-E79 HydrophobicContact CD2-CB 3.86Å; L29-E79 WeakPolarHBondContact CD2-OE2 3.27Å; L29-Y83 HydrophobicContact CD2-CD2 3.76Å; L29-Y83 HydrophobicContact CD2-CE2 3.48Å; L29-Y83 VanDerWaalsContact CD2-CE2 3.48Å
30	E	82.4	Confident	75.6	Confident	93 Å²	93	54.6 Å²	54.6	44%	0.435	28%	0.284	S	S	.	.	H	α-helix	trans	-63.8	-44	172.5	-171.7	177.9	-169.2	0	0	111.6	S26 R27 F28 I32 K33 M34	S26-E30 WeakPolarHBondContact O-CB 3.25Å; S26-E30 PolarHBondContact O-N 3.28Å; R27-E30 PolarHBondContact O-N 3.35Å; F28-E30 VanDerWaalsContact C-N 3.29Å; F28-E30 PolarHBondContact O-N 2.86Å; E30-I32 PolarHBondContact O-N 3.47Å; E30-K33 PolarHBondContact O-N 3.21Å; E30-M34 HydrophobicContact CG-CG 4.44Å; E30-M34 WeakPolarHBondContact O-CB 3.35Å; E30-M34 WeakPolarHBondContact O-CG 3.2Å; E30-M34 PolarHBondContact O-N 2.82Å
31	K	78.5	Confident	75.4	Confident	67 Å²	67	57.6 Å²	57.6	29%	0.291	30%	0.296	S	S	.	.	H	α-helix	trans	-56	-51.1	175.4	-176.4	-170.3	179.3	-164.4	0	110.6	R27 F28 K33 M34 M35 D48	R27-K31 WeakPolarHBondContact O-CB 3.45Å; R27-K31 PolarHBondContact O-N 3.49Å; F28-K31 WeakPolarHBondContact O-CB 3.4Å; F28-K31 PolarHBondContact O-N 2.77Å; F28-K31 VanDerWaalsContact O-N 3.16Å; K31-K33 PolarHBondContact O-N 3.44Å; K31-M34 PolarHBondContact O-N 2.79Å; K31-M35 HydrophobicContact CD-CE 4.44Å; K31-M35 HydrophobicContact CG-CE 3.94Å; K31-M35 VanDerWaalsContact O-CG 3.29Å; K31-M35 WeakPolarHBondContact O-CG 3.36Å; K31-M35 PolarHBondContact O-N 2.93Å; K31-D48 IonicContact NZ-OD1 2.58Å; K31-D48 PolarHBondContact NZ-OD1 3.25Å; K31-D48 IonicContact NZ-OD2 3.48Å; K31-D48 PolarHBondContact NZ-OD2 3.48Å
32	I	72.6	Confident	75	Confident	8 Å²	8	59 Å²	59	4%	0.041	31%	0.306	C	S	.	.	H	α-helix	trans	-61.6	-45.6	178.6	-62.5	176.8	0	0	0	111.2	F28 E30 M34 M35 Y39 F45 V49 Y83	F28-I32 HydrophobicContact CD1-CD1 3.84Å; F28-I32 HydrophobicContact CD1-CG1 4.26Å; F28-I32 HydrophobicContact CE1-CD1 3.07Å; F28-I32 HydrophobicContact CE1-CG1 3.73Å; F28-I32 HydrophobicContact CZ-CD1 3.71Å; F28-I32 HydrophobicContact CZ-CG1 4.1Å; F28-I32 PolarHBondContact O-N 3.12Å; E30-I32 PolarHBondContact O-N 3.47Å; I32-M34 PolarHBondContact O-N 3.1Å; I32-M34 VanDerWaalsContact O-N 3.13Å; I32-M35 PolarHBondContact O-N 2.7Å; I32-Y39 HydrophobicContact CG1-CE1 4.21Å; I32-Y39 HydrophobicContact CG2-CE1 4.46Å; I32-F45 HydrophobicContact CD1-CD2 4.34Å; I32-F45 HydrophobicContact CD1-CE2 3.94Å; I32-F45 HydrophobicContact CG1-CE2 4.49Å; I32-F45 HydrophobicContact CG2-CE2 4.11Å; I32-V49 HydrophobicContact CD1-CG2 4.33Å; I32-Y83 HydrophobicContact CB-CE1 4.18Å; I32-Y83 HydrophobicContact CD1-CD1 3.89Å; I32-Y83 HydrophobicContact CD1-CD2 3.98Å; I32-Y83 HydrophobicContact CD1-CE1 4.05Å; I32-Y83 HydrophobicContact CD1-CE2 4.12Å; I32-Y83 HydrophobicContact CD1-CG 3.85Å; I32-Y83 HydrophobicContact CG2-CD1 4.06Å; I32-Y83 HydrophobicContact CG2-CE1 3.34Å
33	K	76.9	Confident	74.5	Confident	125 Å²	125	59.9 Å²	59.9	54%	0.543	31%	0.31	S	S	.	.	H	α-helix	trans	-59.7	-24.8	179.4	-74.1	168.7	-175.4	169.3	0	113	L29 E30 K31 E79	L29-K33 WeakPolarHBondContact O-CB 3.26Å; L29-K33 WeakPolarHBondContact O-CD 3.44Å; L29-K33 WeakPolarHBondContact O-CG 3.44Å; L29-K33 PolarHBondContact O-N 2.79Å; E30-K33 PolarHBondContact O-N 3.21Å; K31-K33 PolarHBondContact O-N 3.44Å; K33-E79 IonicContact NZ-OE1 2.65Å; K33-E79 PolarHBondContact NZ-OE1 3.27Å; K33-E79 IonicContact NZ-OE2 3.82Å; K33-E79 PolarHBondContact NZ-OE2 2.91Å
34	M	81.8	Confident	74	Confident	85 Å²	85	56 Å²	56	42%	0.419	29%	0.292	S	S	.	.	H	α-helix	trans	-92.4	-10.6	179.3	-69.1	-67.9	-70	0	0	113.9	E30 K31 I32	E30-M34 HydrophobicContact CG-CG 4.44Å; E30-M34 WeakPolarHBondContact O-CB 3.35Å; E30-M34 WeakPolarHBondContact O-CG 3.2Å; E30-M34 PolarHBondContact O-N 2.82Å; K31-M34 PolarHBondContact O-N 2.79Å; I32-M34 PolarHBondContact O-N 3.1Å; I32-M34 VanDerWaalsContact O-N 3.13Å
35	M	80.2	Confident	73.9	Confident	53 Å²	53	54.9 Å²	54.9	26%	0.261	29%	0.287	S	S	.	.	S	Bend	trans	-79.5	150.7	179.3	-73.2	-67	-177.3	0	0	111.5	K31 I32 Y39	K31-M35 HydrophobicContact CD-CE 4.44Å; K31-M35 HydrophobicContact CG-CE 3.94Å; K31-M35 VanDerWaalsContact O-CG 3.29Å; K31-M35 WeakPolarHBondContact O-CG 3.36Å; K31-M35 PolarHBondContact O-N 2.93Å; I32-M35 PolarHBondContact O-N 2.7Å; M35-Y39 HydrophobicContact CB-CD1 3.33Å; M35-Y39 HydrophobicContact CB-CD2 4.33Å; M35-Y39 HydrophobicContact CB-CE1 3.94Å; M35-Y39 HydrophobicContact CB-CG 3.54Å; M35-Y39 HydrophobicContact CE-CE2 4.41Å; M35-Y39 HydrophobicContact CG-CD1 3.58Å; M35-Y39 HydrophobicContact CG-CD2 4.09Å; M35-Y39 HydrophobicContact CG-CE1 3.7Å; M35-Y39 HydrophobicContact CG-CE2 4.23Å; M35-Y39 HydrophobicContact CG-CG 3.76Å; M35-Y39 HydrophobicContact SD-CD2 4.22Å; M35-Y39 HydrophobicContact SD-CE2 4.43Å; M35-Y39 HydrophobicContact SD-CG 4.36Å
36	P	78.3	Confident	73.2	Confident	79 Å²	79	57.3 Å²	57.3	51%	0.513	30%	0.296	S	S	.	.			trans	-63.3	153.6	174.5	27.7	-34.7	0	0	0	111.1	S38 Y39	P36-S38 PolarHBondContact O-N 3.5Å; P36-S38 VanDerWaalsContact O-N 3.08Å; P36-Y39 WeakPolarHBondContact O-CB 3.49Å; P36-Y39 PolarHBondContact O-N 3.36Å
37	D	74.8	Confident	72.6	Confident	144 Å²	144	56.4 Å²	56.4	77%	0.77	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-53.3	-36.7	-178.3	-62	-26.5	0	0	0	112.9	Y39 Q40	D37-Y39 PolarHBondContact O-N 2.64Å; D37-Q40 PolarHBondContact O-N 2.64Å
38	S	74	Confident	72.3	Confident	79 Å²	79	53.2 Å²	53.2	55%	0.552	28%	0.277	S	S	*	.	G	3₁₀ helix	trans	-63.1	-10.2	176.4	65.3	0	0	0	0	114.7	P36 Q40	P36-S38 PolarHBondContact O-N 3.5Å; P36-S38 VanDerWaalsContact O-N 3.08Å; S38-Q40 VanDerWaalsContact C-N 3.34Å
39	Y	72.3	Confident	71.9	Confident	17 Å²	17	53.4 Å²	53.4	7%	0.067	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-71.2	-31.5	176	170.3	-108.8	0	0	0	111.6	I32 M35 P36 D37 D41 S42 Q44 F45 D48	I32-Y39 HydrophobicContact CG1-CE1 4.21Å; I32-Y39 HydrophobicContact CG2-CE1 4.46Å; M35-Y39 HydrophobicContact CB-CD1 3.33Å; M35-Y39 HydrophobicContact CB-CD2 4.33Å; M35-Y39 HydrophobicContact CB-CE1 3.94Å; M35-Y39 HydrophobicContact CB-CG 3.54Å; M35-Y39 HydrophobicContact CE-CE2 4.41Å; M35-Y39 HydrophobicContact CG-CD1 3.58Å; M35-Y39 HydrophobicContact CG-CD2 4.09Å; M35-Y39 HydrophobicContact CG-CE1 3.7Å; M35-Y39 HydrophobicContact CG-CE2 4.23Å; M35-Y39 HydrophobicContact CG-CG 3.76Å; M35-Y39 HydrophobicContact SD-CD2 4.22Å; M35-Y39 HydrophobicContact SD-CE2 4.43Å; M35-Y39 HydrophobicContact SD-CG 4.36Å; P36-Y39 WeakPolarHBondContact O-CB 3.49Å; P36-Y39 PolarHBondContact O-N 3.36Å; D37-Y39 PolarHBondContact O-N 2.64Å; Y39-D41 PolarHBondContact O-N 3.47Å; Y39-S42 WeakPolarHBondContact CD2-OG 3.28Å; Y39-S42 WeakPolarHBondContact O-CB 3.27Å; Y39-S42 PolarHBondContact O-N 3.12Å; Y39-S42 PolarHBondContact O-OG 2.89Å; Y39-Q44 HydrophobicContact CE2-CB 4.17Å; Y39-Q44 HydrophobicContact CE2-CG 4.03Å; Y39-F45 HydrophobicContact CD1-CB 4.11Å; Y39-F45 AromaticContact CD1-CD2 3.94Å; Y39-F45 HydrophobicContact CD1-CD2 3.94Å; Y39-F45 HydrophobicContact CD1-CG 4.43Å; Y39-F45 HydrophobicContact CD2-CB 4.41Å; Y39-F45 HydrophobicContact CE1-CB 3.88Å; Y39-F45 AromaticContact CE1-CD2 3.56Å; Y39-F45 HydrophobicContact CE1-CD2 3.56Å; Y39-F45 HydrophobicContact CE1-CG 4.2Å; Y39-F45 HydrophobicContact CE2-CB 4.17Å; Y39-F45 HydrophobicContact CG-CB 4.38Å; Y39-F45 WeakPolarHBondContact O-CB 3.49Å; Y39-D48 VanDerWaalsContact OH-CB 3.31Å; Y39-D48 WeakPolarHBondContact OH-CB 3.24Å; Y39-D48 VanDerWaalsContact OH-CG 3.25Å; Y39-D48 PolarHBondContact OH-OD2 2.94Å
40	Q	69.6	Low	71.2	Confident	66 Å²	66	54.8 Å²	54.8	31%	0.308	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-35.3	178.1	-64.6	-177.2	13.1	0	0	111.5	D37 S38 S42 F45	D37-Q40 PolarHBondContact O-N 2.64Å; S38-Q40 VanDerWaalsContact C-N 3.34Å; Q40-S42 PolarHBondContact O-N 3.23Å; Q40-S42 VanDerWaalsContact O-N 3.17Å; Q40-F45 HydrophobicContact CB-CD1 4.41Å; Q40-F45 HydrophobicContact CB-CE1 4.34Å; Q40-F45 HydrophobicContact CG-CE2 4.27Å; Q40-F45 HydrophobicContact CG-CZ 4.28Å; Q40-F45 WeakPolarHBondContact O-CD1 3.24Å
41	D	65.1	Low	70.7	Confident	92 Å²	92	54.4 Å²	54.4	49%	0.492	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-9	176.3	-47.3	-27.9	0	0	0	113.4	Y39	Y39-D41 PolarHBondContact O-N 3.47Å
42	S	61.8	Low	70.4	Confident	32 Å²	32	51.3 Å²	51.3	22%	0.224	28%	0.276	C	S	.	.	S	Bend	trans	-88	149.9	-171.1	80.8	0	0	0	0	113.6	Y39 Q40 Q44 F45	Y39-S42 WeakPolarHBondContact CD2-OG 3.28Å; Y39-S42 WeakPolarHBondContact O-CB 3.27Å; Y39-S42 PolarHBondContact O-N 3.12Å; Y39-S42 PolarHBondContact O-OG 2.89Å; Q40-S42 PolarHBondContact O-N 3.23Å; Q40-S42 VanDerWaalsContact O-N 3.17Å; S42-Q44 PolarHBondContact O-N 3.46Å; S42-F45 WeakPolarHBondContact O-CB 3.46Å; S42-F45 PolarHBondContact O-N 3.3Å; S42-F45 VanDerWaalsContact O-N 3.16Å; S42-F45 PolarHBondContact OG-N 2.97Å; S42-F45 VanDerWaalsContact OG-N 3.11Å
43	V	61	Low	70.3	Confident	55 Å²	55	52.7 Å²	52.7	33%	0.333	29%	0.288	S	S	.	.	H	α-helix	trans	-59.3	-35.1	170.7	179.5	0	0	0	0	111.3	F45 R46 V47 L154	V43-F45 VanDerWaalsContact C-N 3.29Å; V43-F45 PolarHBondContact O-N 3.43Å; V43-R46 PolarHBondContact O-N 3.22Å; V43-R46 VanDerWaalsContact O-N 3.15Å; V43-V47 HydrophobicContact CG1-CG2 4.46Å; V43-V47 WeakPolarHBondContact O-CG2 3.46Å; V43-V47 PolarHBondContact O-N 3.36Å; V43-L154 HydrophobicContact CG1-CB 3.98Å; V43-L154 HydrophobicContact CG1-CD2 4.19Å
44	Q	66	Low	70	Confident	32 Å²	32	50.3 Å²	50.3	15%	0.15	28%	0.284	C	S	.	.	H	α-helix	trans	-63.9	-34.6	179	-174.7	62.8	77.5	0	0	111.8	Y39 S42 V47 D48 L155	Y39-Q44 HydrophobicContact CE2-CB 4.17Å; Y39-Q44 HydrophobicContact CE2-CG 4.03Å; S42-Q44 PolarHBondContact O-N 3.46Å; Q44-V47 PolarHBondContact O-N 2.58Å; Q44-D48 VanDerWaalsContact NE2-CG 3.3Å; Q44-D48 PolarHBondContact NE2-OD1 3.3Å; Q44-D48 PolarHBondContact NE2-OD2 3.22Å; Q44-D48 WeakPolarHBondContact O-CB 3.46Å; Q44-D48 PolarHBondContact O-N 3.34Å; Q44-L155 HydrophobicContact CB-CD2 4.32Å
45	F	68.8	Low	69.4	Low	0 Å²	0	47 Å²	47	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-61.7	-43.3	173	169.9	-107.8	0	0	0	111.8	I32 Y39 Q40 S42 V43 D48 V49 Y83 L86 A87	I32-F45 HydrophobicContact CD1-CD2 4.34Å; I32-F45 HydrophobicContact CD1-CE2 3.94Å; I32-F45 HydrophobicContact CG1-CE2 4.49Å; I32-F45 HydrophobicContact CG2-CE2 4.11Å; Y39-F45 HydrophobicContact CD1-CB 4.11Å; Y39-F45 AromaticContact CD1-CD2 3.94Å; Y39-F45 HydrophobicContact CD1-CD2 3.94Å; Y39-F45 HydrophobicContact CD1-CG 4.43Å; Y39-F45 HydrophobicContact CD2-CB 4.41Å; Y39-F45 HydrophobicContact CE1-CB 3.88Å; Y39-F45 AromaticContact CE1-CD2 3.56Å; Y39-F45 HydrophobicContact CE1-CD2 3.56Å; Y39-F45 HydrophobicContact CE1-CG 4.2Å; Y39-F45 HydrophobicContact CE2-CB 4.17Å; Y39-F45 HydrophobicContact CG-CB 4.38Å; Y39-F45 WeakPolarHBondContact O-CB 3.49Å; Q40-F45 HydrophobicContact CB-CD1 4.41Å; Q40-F45 HydrophobicContact CB-CE1 4.34Å; Q40-F45 HydrophobicContact CG-CE2 4.27Å; Q40-F45 HydrophobicContact CG-CZ 4.28Å; Q40-F45 WeakPolarHBondContact O-CD1 3.24Å; S42-F45 WeakPolarHBondContact O-CB 3.46Å; S42-F45 PolarHBondContact O-N 3.3Å; S42-F45 VanDerWaalsContact O-N 3.16Å; S42-F45 PolarHBondContact OG-N 2.97Å; S42-F45 VanDerWaalsContact OG-N 3.11Å; V43-F45 VanDerWaalsContact C-N 3.29Å; V43-F45 PolarHBondContact O-N 3.43Å; F45-D48 PolarHBondContact O-N 2.91Å; F45-V49 HydrophobicContact CD1-CG2 4.37Å; F45-V49 HydrophobicContact CD2-CG2 3.94Å; F45-V49 HydrophobicContact CE1-CG2 4.08Å; F45-V49 HydrophobicContact CE2-CG2 3.62Å; F45-V49 HydrophobicContact CG-CG2 4.32Å; F45-V49 HydrophobicContact CZ-CG2 3.69Å; F45-V49 WeakPolarHBondContact O-CB 3.46Å; F45-V49 VanDerWaalsContact O-CG2 3.26Å; F45-V49 WeakPolarHBondContact O-CG2 3.48Å; F45-V49 PolarHBondContact O-N 3.46Å; F45-Y83 AromaticContact CE2-CD1 3.83Å; F45-Y83 HydrophobicContact CE2-CD1 3.83Å; F45-Y83 HydrophobicContact CE2-CE1 4.46Å; F45-Y83 AromaticContact CZ-CD1 3.92Å; F45-Y83 HydrophobicContact CZ-CD1 3.92Å; F45-L86 HydrophobicContact CE1-CB 4.09Å; F45-L86 HydrophobicContact CZ-CB 3.93Å; F45-A87 HydrophobicContact CD1-CB 4.3Å; F45-A87 HydrophobicContact CE1-CB 3.85Å
46	R	62.9	Low	68.9	Low	51 Å²	51	46.3 Å²	46.3	19%	0.192	26%	0.263	C	S	.	.	H	α-helix	trans	-66.4	-41	179.2	-56.5	177.2	-165	-129.2	16.1	112.6	V43 D48 V49 A50 A87 D90	V43-R46 PolarHBondContact O-N 3.22Å; V43-R46 VanDerWaalsContact O-N 3.15Å; R46-D48 VanDerWaalsContact C-N 3.32Å; R46-V49 PolarHBondContact O-N 3.41Å; R46-A50 WeakPolarHBondContact O-CB 3.46Å; R46-A50 PolarHBondContact O-N 2.81Å; R46-A87 HydrophobicContact CG-CB 4.24Å; R46-A87 PolarHBondContact NH1-O 2.93Å; R46-A87 VanDerWaalsContact NH1-O 3.11Å; R46-D90 PolarHBondContact NH1-O 2.79Å; R46-D90 VanDerWaalsContact NH2-C 3.33Å; R46-D90 PolarHBondContact NH2-O 3Å
47	V	65.8	Low	68.5	Low	29 Å²	29	46.4 Å²	46.4	18%	0.176	26%	0.257	C	S	.	.	H	α-helix	trans	-59	-49.2	172.8	171.2	0	0	0	0	110	V43 Q44 V49 A50 E51 L154	V43-V47 HydrophobicContact CG1-CG2 4.46Å; V43-V47 WeakPolarHBondContact O-CG2 3.46Å; V43-V47 PolarHBondContact O-N 3.36Å; Q44-V47 PolarHBondContact O-N 2.58Å; V47-V49 PolarHBondContact O-N 2.95Å; V47-A50 PolarHBondContact O-N 2.99Å; V47-E51 PolarHBondContact O-N 3.3Å; V47-L154 HydrophobicContact CG2-CD1 3.69Å
48	D	69.7	Low	68.3	Low	3 Å²	3	42.4 Å²	42.4	2%	0.016	24%	0.235	C	C	.	.	H	α-helix	trans	-60.2	-48.4	-180	-76.7	-11.5	0	0	0	108.9	F28 K31 Y39 Q44 F45 R46 A50 E51 L52	F28-D48 VanDerWaalsContact CE2-CA 3.49Å; F28-D48 HydrophobicContact CE2-CB 3.37Å; F28-D48 WeakPolarHBondContact CE2-O 3.31Å; F28-D48 HydrophobicContact CZ-CB 3.37Å; F28-D48 WeakPolarHBondContact CZ-O 3.37Å; K31-D48 IonicContact NZ-OD1 2.58Å; K31-D48 PolarHBondContact NZ-OD1 3.25Å; K31-D48 IonicContact NZ-OD2 3.48Å; K31-D48 PolarHBondContact NZ-OD2 3.48Å; Y39-D48 VanDerWaalsContact OH-CB 3.31Å; Y39-D48 WeakPolarHBondContact OH-CB 3.24Å; Y39-D48 VanDerWaalsContact OH-CG 3.25Å; Y39-D48 PolarHBondContact OH-OD2 2.94Å; Q44-D48 VanDerWaalsContact NE2-CG 3.3Å; Q44-D48 PolarHBondContact NE2-OD1 3.3Å; Q44-D48 PolarHBondContact NE2-OD2 3.22Å; Q44-D48 WeakPolarHBondContact O-CB 3.46Å; Q44-D48 PolarHBondContact O-N 3.34Å; F45-D48 PolarHBondContact O-N 2.91Å; R46-D48 VanDerWaalsContact C-N 3.32Å; D48-A50 VanDerWaalsContact C-N 3.31Å; D48-A50 PolarHBondContact O-N 3.24Å; D48-E51 WeakPolarHBondContact O-CB 3.43Å; D48-E51 PolarHBondContact O-N 3.33Å; D48-E51 VanDerWaalsContact O-N 3.1Å; D48-L52 PolarHBondContact O-N 3.49Å
49	V	68.1	Low	68	Low	6 Å²	6	38.9 Å²	38.9	4%	0.036	21%	0.21	C	C	.	.	H	α-helix	trans	-61.5	-37.4	179.4	169.5	0	0	0	0	112.2	I32 F45 R46 V47 L52 A53 C84 A87	I32-V49 HydrophobicContact CD1-CG2 4.33Å; F45-V49 HydrophobicContact CD1-CG2 4.37Å; F45-V49 HydrophobicContact CD2-CG2 3.94Å; F45-V49 HydrophobicContact CE1-CG2 4.08Å; F45-V49 HydrophobicContact CE2-CG2 3.62Å; F45-V49 HydrophobicContact CG-CG2 4.32Å; F45-V49 HydrophobicContact CZ-CG2 3.69Å; F45-V49 WeakPolarHBondContact O-CB 3.46Å; F45-V49 VanDerWaalsContact O-CG2 3.26Å; F45-V49 WeakPolarHBondContact O-CG2 3.48Å; F45-V49 PolarHBondContact O-N 3.46Å; R46-V49 PolarHBondContact O-N 3.41Å; V47-V49 PolarHBondContact O-N 2.95Å; V49-L52 WeakPolarHBondContact O-CB 3.26Å; V49-L52 PolarHBondContact O-N 3.39Å; V49-A53 PolarHBondContact O-N 3.32Å; V49-C84 HydrophobicContact CG1-CB 4.42Å; V49-A87 HydrophobicContact CB-CB 4.19Å; V49-A87 HydrophobicContact CG1-CB 3.96Å; V49-A87 HydrophobicContact CG2-CB 4.33Å
50	A	65.1	Low	67.8	Low	35 Å²	35	41.6 Å²	41.6	29%	0.289	22%	0.223	S	C	.	.	H	α-helix	trans	-64.2	-42.6	173.7	0	0	0	0	0	111.7	R46 V47 D48 L52 A53 V54	R46-A50 WeakPolarHBondContact O-CB 3.46Å; R46-A50 PolarHBondContact O-N 2.81Å; V47-A50 PolarHBondContact O-N 2.99Å; D48-A50 VanDerWaalsContact C-N 3.31Å; D48-A50 PolarHBondContact O-N 3.24Å; A50-L52 VanDerWaalsContact C-N 3.33Å; A50-L52 PolarHBondContact O-N 2.85Å; A50-A53 PolarHBondContact O-N 3.17Å; A50-V54 WeakPolarHBondContact O-CG2 3.34Å; A50-V54 PolarHBondContact O-N 2.93Å; A50-V54 VanDerWaalsContact O-N 3.12Å
51	E	71.4	Confident	67.7	Low	85 Å²	85	44.5 Å²	44.5	40%	0.397	24%	0.235	S	C	.	.	H	α-helix	trans	-60.5	-43.3	173.2	-70.3	-176.6	-176.9	0	0	111.2	V47 D48 A53 V54 V55	V47-E51 PolarHBondContact O-N 3.3Å; D48-E51 WeakPolarHBondContact O-CB 3.43Å; D48-E51 PolarHBondContact O-N 3.33Å; D48-E51 VanDerWaalsContact O-N 3.1Å; E51-A53 PolarHBondContact O-N 2.97Å; E51-V54 PolarHBondContact O-N 2.89Å; E51-V55 WeakPolarHBondContact O-CG2 3.15Å; E51-V55 PolarHBondContact O-N 3.4Å
52	L	72.7	Confident	67.8	Low	2 Å²	2	44.1 Å²	44.1	1%	0.01	23%	0.23	C	C	.	.	H	α-helix	trans	-58.1	-46.1	175.6	175	63.9	0	0	0	112.3	I25 F28 L29 D48 V49 A50 V54 V55 Y56 V80 Y83	I25-L52 HydrophobicContact CB-CD1 4.29Å; I25-L52 HydrophobicContact CG1-CD1 4.05Å; I25-L52 HydrophobicContact CG2-CD1 3.97Å; F28-L52 HydrophobicContact CB-CD1 4.17Å; F28-L52 HydrophobicContact CD1-CB 3.55Å; F28-L52 HydrophobicContact CD1-CD1 3.59Å; F28-L52 HydrophobicContact CD1-CD2 3.55Å; F28-L52 HydrophobicContact CD1-CG 3.71Å; F28-L52 HydrophobicContact CD2-CB 4.34Å; F28-L52 HydrophobicContact CE1-CB 3.38Å; F28-L52 HydrophobicContact CE1-CD1 4.26Å; F28-L52 HydrophobicContact CE1-CD2 3.5Å; F28-L52 HydrophobicContact CE1-CG 3.85Å; F28-L52 HydrophobicContact CE2-CB 4.27Å; F28-L52 HydrophobicContact CG-CB 4.03Å; F28-L52 HydrophobicContact CG-CD1 4Å; F28-L52 HydrophobicContact CG-CG 4.42Å; F28-L52 HydrophobicContact CZ-CB 3.84Å; L29-L52 HydrophobicContact CD2-CD2 4.07Å; D48-L52 PolarHBondContact O-N 3.49Å; V49-L52 WeakPolarHBondContact O-CB 3.26Å; V49-L52 PolarHBondContact O-N 3.39Å; A50-L52 VanDerWaalsContact C-N 3.33Å; A50-L52 PolarHBondContact O-N 2.85Å; L52-V54 VanDerWaalsContact C-N 3.32Å; L52-V54 PolarHBondContact O-N 3.26Å; L52-V55 PolarHBondContact O-N 2.87Å; L52-Y56 WeakPolarHBondContact O-CB 3.1Å; L52-Y56 PolarHBondContact O-N 3.28Å; L52-V80 HydrophobicContact CD1-CG2 3.98Å; L52-V80 HydrophobicContact CD2-CB 4.27Å; L52-V80 HydrophobicContact CD2-CG1 4.3Å; L52-V80 HydrophobicContact CD2-CG2 3.86Å; L52-V80 HydrophobicContact CG-CG1 4.25Å; L52-V80 HydrophobicContact CG-CG2 3.87Å; L52-Y83 HydrophobicContact CD2-CD2 4.34Å
53	A	69.5	Low	67.9	Low	36 Å²	36	46.5 Å²	46.5	30%	0.298	23%	0.234	S	C	.	.	H	α-helix	trans	-60.8	-42.5	179.3	0	0	0	0	0	111.6	V49 A50 E51 Y56 E57	V49-A53 PolarHBondContact O-N 3.32Å; A50-A53 PolarHBondContact O-N 3.17Å; E51-A53 PolarHBondContact O-N 2.97Å; A53-Y56 PolarHBondContact O-N 3.16Å; A53-E57 PolarHBondContact O-N 3.1Å
54	V	71	Confident	67.7	Low	75 Å²	75	52.6 Å²	52.6	46%	0.455	26%	0.256	S	S	.	.	H	α-helix	trans	-63.2	-44.7	176.1	172.3	0	0	0	0	111.2	A50 E51 L52 Y56 E57 I58	A50-V54 WeakPolarHBondContact O-CG2 3.34Å; A50-V54 PolarHBondContact O-N 2.93Å; A50-V54 VanDerWaalsContact O-N 3.12Å; E51-V54 PolarHBondContact O-N 2.89Å; L52-V54 VanDerWaalsContact C-N 3.32Å; L52-V54 PolarHBondContact O-N 3.26Å; V54-Y56 VanDerWaalsContact C-N 3.32Å; V54-Y56 PolarHBondContact O-N 3Å; V54-E57 PolarHBondContact O-N 2.86Å; V54-I58 HydrophobicContact CG1-CD1 4.08Å; V54-I58 WeakPolarHBondContact O-CG1 3.34Å; V54-I58 PolarHBondContact O-N 3.32Å
55	V	68.9	Low	67	Low	16 Å²	16	54.3 Å²	54.3	10%	0.097	28%	0.282	C	S	.	.	H	α-helix	trans	-64.7	-38.4	177.9	179.1	0	0	0	0	111.1	A21 R24 I25 E51 L52 I58 M59	A21-V55 HydrophobicContact CB-CG1 4.27Å; R24-V55 HydrophobicContact CB-CG1 3.65Å; I25-V55 HydrophobicContact CD1-CG1 4.15Å; I25-V55 HydrophobicContact CG1-CB 4.28Å; I25-V55 HydrophobicContact CG1-CG1 3.65Å; E51-V55 WeakPolarHBondContact O-CG2 3.15Å; E51-V55 PolarHBondContact O-N 3.4Å; L52-V55 PolarHBondContact O-N 2.87Å; V55-I58 PolarHBondContact O-N 3.35Å; V55-M59 PolarHBondContact O-N 3.27Å
56	Y	70.4	Confident	66.2	Low	38 Å²	38	61.9 Å²	61.9	15%	0.149	32%	0.315	C	S	.	.	H	α-helix	trans	-62.1	-43.5	174.7	-177.1	-95.3	0	0	0	112	I25 L52 A53 V54 I58 M59 E60 L73 S77 V80	I25-Y56 HydrophobicContact CD1-CD2 4.2Å; L52-Y56 WeakPolarHBondContact O-CB 3.1Å; L52-Y56 PolarHBondContact O-N 3.28Å; A53-Y56 PolarHBondContact O-N 3.16Å; V54-Y56 VanDerWaalsContact C-N 3.32Å; V54-Y56 PolarHBondContact O-N 3Å; Y56-I58 VanDerWaalsContact C-N 3.33Å; Y56-I58 PolarHBondContact O-N 3.05Å; Y56-M59 HydrophobicContact CD2-CE 3.45Å; Y56-M59 VanDerWaalsContact CD2-CE 3.45Å; Y56-M59 HydrophobicContact CE2-CE 3.57Å; Y56-M59 HydrophobicContact CG-CE 4.47Å; Y56-M59 WeakPolarHBondContact O-CB 3.1Å; Y56-M59 PolarHBondContact O-N 2.82Å; Y56-E60 PolarHBondContact O-N 3.2Å; Y56-L73 HydrophobicContact CE2-CG 4.48Å; Y56-S77 WeakPolarHBondContact OH-CB 3.35Å; Y56-V80 HydrophobicContact CD2-CG2 3.91Å; Y56-V80 HydrophobicContact CG-CG1 4.35Å; Y56-V80 HydrophobicContact CG-CG2 4.12Å
57	E	69.5	Low	65.8	Low	82 Å²	82	64.6 Å²	64.6	38%	0.383	35%	0.348	S	S	.	.	H	α-helix	trans	-61.8	-41.2	175.7	-167.9	-169.6	159.6	0	0	111.7	A53 V54 E60 K61	A53-E57 PolarHBondContact O-N 3.1Å; V54-E57 PolarHBondContact O-N 2.86Å; E57-E60 PolarHBondContact O-N 3.39Å; E57-K61 WeakPolarHBondContact O-CG 3.39Å; E57-K61 PolarHBondContact O-N 3.07Å; E57-K61 WeakPolarHBondContact OE1-CE 3.49Å; E57-K61 IonicContact OE1-NZ 2.64Å; E57-K61 PolarHBondContact OE1-NZ 3.32Å
58	I	70	Confident	65.5	Low	60 Å²	60	65.7 Å²	65.7	31%	0.308	35%	0.353	S	S	.	.	H	α-helix	trans	-61.2	-46.2	174	-67.1	166.3	0	0	0	110.2	V54 V55 Y56 E60 K61 E62	V54-I58 HydrophobicContact CG1-CD1 4.08Å; V54-I58 WeakPolarHBondContact O-CG1 3.34Å; V54-I58 PolarHBondContact O-N 3.32Å; V55-I58 PolarHBondContact O-N 3.35Å; Y56-I58 VanDerWaalsContact C-N 3.33Å; Y56-I58 PolarHBondContact O-N 3.05Å; I58-E60 VanDerWaalsContact C-N 3.33Å; I58-E60 PolarHBondContact O-N 3.01Å; I58-K61 PolarHBondContact O-N 2.95Å; I58-E62 HydrophobicContact CG2-CG 4.36Å; I58-E62 WeakPolarHBondContact O-CG 3.5Å; I58-E62 PolarHBondContact O-N 3.29Å
59	M	68.4	Low	65.4	Low	4 Å²	4	70.4 Å²	70.4	2%	0.02	38%	0.378	C	S	.	.	H	α-helix	trans	-60	-42.2	177.4	-173	180	55.7	0	0	111.9	A21 I25 V55 Y56 K61 E62 R63 L68 L73 Y76	A21-M59 HydrophobicContact CB-CB 3.65Å; A21-M59 HydrophobicContact CB-CG 4.09Å; I25-M59 HydrophobicContact CD1-CB 4.12Å; I25-M59 HydrophobicContact CD1-CE 3.33Å; I25-M59 HydrophobicContact CD1-CG 4.49Å; I25-M59 HydrophobicContact CD1-SD 3.62Å; V55-M59 PolarHBondContact O-N 3.27Å; Y56-M59 HydrophobicContact CD2-CE 3.45Å; Y56-M59 VanDerWaalsContact CD2-CE 3.45Å; Y56-M59 HydrophobicContact CE2-CE 3.57Å; Y56-M59 HydrophobicContact CG-CE 4.47Å; Y56-M59 WeakPolarHBondContact O-CB 3.1Å; Y56-M59 PolarHBondContact O-N 2.82Å; M59-K61 VanDerWaalsContact C-N 3.35Å; M59-E62 PolarHBondContact O-N 2.73Å; M59-R63 WeakPolarHBondContact O-CB 3.4Å; M59-R63 PolarHBondContact O-N 3.28Å; M59-L68 HydrophobicContact CG-CD1 3.99Å; M59-L73 HydrophobicContact CE-CD1 3.53Å; M59-L73 HydrophobicContact CE-CG 4.45Å; M59-L73 HydrophobicContact CG-CD1 4.25Å; M59-L73 HydrophobicContact SD-CD1 4.17Å; M59-Y76 HydrophobicContact CE-CD2 3.9Å; M59-Y76 HydrophobicContact CE-CG 4.31Å; M59-Y76 HydrophobicContact SD-CD2 4.14Å; M59-Y76 HydrophobicContact SD-CE2 4.46Å
60	E	67.5	Low	65.5	Low	74 Å²	74	74.3 Å²	74.3	35%	0.346	40%	0.399	S	S	.	.	H	α-helix	trans	-64.7	-40.1	178.2	-161.5	-166.9	162.4	0	0	111.6	Y56 E57 I58 R63 K64	Y56-E60 PolarHBondContact O-N 3.2Å; E57-E60 PolarHBondContact O-N 3.39Å; I58-E60 VanDerWaalsContact C-N 3.33Å; I58-E60 PolarHBondContact O-N 3.01Å; E60-R63 WeakPolarHBondContact O-CB 3.36Å; E60-R63 PolarHBondContact O-N 2.98Å; E60-K64 PolarHBondContact O-N 3.37Å
61	K	67.4	Low	65.8	Low	128 Å²	128	80.1 Å²	80.1	56%	0.557	42%	0.42	S	S	*	.	H	α-helix	trans	-64.9	-43	173.4	-72.9	174.9	-175.2	168.5	0	111.9	E57 I58 M59 R63 K64	E57-K61 WeakPolarHBondContact O-CG 3.39Å; E57-K61 PolarHBondContact O-N 3.07Å; E57-K61 WeakPolarHBondContact OE1-CE 3.49Å; E57-K61 IonicContact OE1-NZ 2.64Å; E57-K61 PolarHBondContact OE1-NZ 3.32Å; I58-K61 PolarHBondContact O-N 2.95Å; M59-K61 VanDerWaalsContact C-N 3.35Å; K61-R63 VanDerWaalsContact C-N 3.33Å; K61-R63 PolarHBondContact O-N 3.13Å; K61-K64 PolarHBondContact O-N 3.45Å
62	E	67.4	Low	65.6	Low	83 Å²	83	80.6 Å²	80.6	39%	0.388	42%	0.422	S	S	.	.	H	α-helix	trans	-65.3	-35	176.1	-73	-179.6	-179.9	0	0	112.2	I58 M59 K64 G65 K66	I58-E62 HydrophobicContact CG2-CG 4.36Å; I58-E62 WeakPolarHBondContact O-CG 3.5Å; I58-E62 PolarHBondContact O-N 3.29Å; M59-E62 PolarHBondContact O-N 2.73Å; E62-K64 VanDerWaalsContact C-N 3.31Å; E62-K64 PolarHBondContact O-N 3.01Å; E62-G65 WeakPolarHBondContact O-CA 3.43Å; E62-G65 PolarHBondContact O-N 3.44Å; E62-K66 PolarHBondContact O-N 3.32Å
63	R	64	Low	65.3	Low	83 Å²	83	81.1 Å²	81.1	31%	0.313	43%	0.425	S	S	.	.	H	α-helix	trans	-59.8	-37	174.1	179.1	173.9	168.4	-121.6	1.1	112.5	M59 E60 K61 G65 K66 L68 D70	M59-R63 WeakPolarHBondContact O-CB 3.4Å; M59-R63 PolarHBondContact O-N 3.28Å; E60-R63 WeakPolarHBondContact O-CB 3.36Å; E60-R63 PolarHBondContact O-N 2.98Å; K61-R63 VanDerWaalsContact C-N 3.33Å; K61-R63 PolarHBondContact O-N 3.13Å; R63-G65 PolarHBondContact O-N 2.83Å; R63-K66 PolarHBondContact O-N 3.28Å; R63-K66 VanDerWaalsContact O-N 3.1Å; R63-L68 HydrophobicContact CB-CD1 3.87Å; R63-L68 HydrophobicContact CG-CB 4.25Å; R63-L68 HydrophobicContact CG-CD1 4.44Å; R63-D70 IonicContact CZ-OD1 3.47Å; R63-D70 IonicContact NE-OD1 3.55Å; R63-D70 VanDerWaalsContact NH2-CG 3.25Å; R63-D70 IonicContact NH2-OD1 2.64Å; R63-D70 PolarHBondContact NH2-OD1 2.64Å; R63-D70 IonicContact NH2-OD2 3.5Å; R63-D70 PolarHBondContact NH2-OD2 2.87Å
64	K	56.8	Low	65.4	Low	183 Å²	183	85.6 Å²	85.6	80%	0.796	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-17.3	174.3	-69.2	-177.3	179.8	176.1	0	112.4	E60 K61 E62	E60-K64 PolarHBondContact O-N 3.37Å; K61-K64 PolarHBondContact O-N 3.45Å; E62-K64 VanDerWaalsContact C-N 3.31Å; E62-K64 PolarHBondContact O-N 3.01Å
65	G	52	Low	65.5	Low	68 Å²	68	86.4 Å²	86.4	70%	0.701	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.7	-10	174.6	0	0	0	0	0	117.2	E62 R63	E62-G65 WeakPolarHBondContact O-CA 3.43Å; E62-G65 PolarHBondContact O-N 3.44Å; R63-G65 PolarHBondContact O-N 2.83Å
66	K	51.5	Low	65.7	Low	159 Å²	159	87.6 Å²	87.6	69%	0.691	44%	0.443	S	S	*	.	S	Bend	trans	-140.5	148.7	-175.1	-73.1	-178	-178.3	171.6	0	113	E62 R63 L68	E62-K66 PolarHBondContact O-N 3.32Å; R63-K66 PolarHBondContact O-N 3.28Å; R63-K66 VanDerWaalsContact O-N 3.1Å; K66-L68 VanDerWaalsContact C-N 3.28Å; K66-L68 PolarHBondContact O-N 3.35Å
67	A	54.4	Low	65.7	Low	108 Å²	108	87.4 Å²	87.4	89%	0.893	45%	0.446	S	S	*	.			trans	-73.9	71	178	0	0	0	0	0	112.5
68	L	60.1	Low	65.9	Low	51 Å²	51	92 Å²	92	27%	0.267	46%	0.46	S	S	.	.			trans	-73.6	143.6	162	-77	161.6	0	0	0	109.3	M59 R63 K66 D70	M59-L68 HydrophobicContact CG-CD1 3.99Å; R63-L68 HydrophobicContact CB-CD1 3.87Å; R63-L68 HydrophobicContact CG-CB 4.25Å; R63-L68 HydrophobicContact CG-CD1 4.44Å; K66-L68 VanDerWaalsContact C-N 3.28Å; K66-L68 PolarHBondContact O-N 3.35Å; L68-D70 PolarHBondContact O-N 2.94Å
69	N	67.7	Low	66.1	Low	103 Å²	103	92.1 Å²	92.1	55%	0.551	46%	0.46	S	S	*	.			trans	-67.3	128.1	178.1	-77.9	-23.8	0	0	0	110.6	E71 E72 L73	N69-E71 PolarHBondContact O-N 3.42Å; N69-E72 HydrophobicContact CB-CB 4.45Å; N69-E72 HydrophobicContact CB-CG 4.24Å; N69-E72 PolarHBondContact ND2-OE1 3.35Å; N69-E72 PolarHBondContact O-N 3.36Å; N69-L73 PolarHBondContact O-N 2.72Å
70	D	69.3	Low	66.2	Low	87 Å²	87	92.3 Å²	92.3	47%	0.465	46%	0.461	S	S	.	.	H	α-helix	trans	-61	-28.6	-177.7	-82.3	12.7	0	0	0	113.8	R63 L68 K74	R63-D70 IonicContact CZ-OD1 3.47Å; R63-D70 IonicContact NE-OD1 3.55Å; R63-D70 VanDerWaalsContact NH2-CG 3.25Å; R63-D70 IonicContact NH2-OD1 2.64Å; R63-D70 PolarHBondContact NH2-OD1 2.64Å; R63-D70 IonicContact NH2-OD2 3.5Å; R63-D70 PolarHBondContact NH2-OD2 2.87Å; L68-D70 PolarHBondContact O-N 2.94Å; D70-K74 VanDerWaalsContact O-CG 3.27Å; D70-K74 WeakPolarHBondContact O-CG 3.31Å; D70-K74 PolarHBondContact O-N 3.18Å
71	E	70.9	Confident	66.2	Low	158 Å²	158	94 Å²	94	74%	0.738	47%	0.472	S	S	*	.	H	α-helix	trans	-70.8	-48.3	177.9	-70.9	-177.4	171.9	0	0	111.6	N69 L73 K74 D75	N69-E71 PolarHBondContact O-N 3.42Å; E71-L73 VanDerWaalsContact C-N 3.31Å; E71-L73 PolarHBondContact O-N 3.32Å; E71-K74 WeakPolarHBondContact O-CB 3.17Å; E71-K74 PolarHBondContact O-N 2.88Å; E71-K74 VanDerWaalsContact O-N 3.12Å; E71-D75 PolarHBondContact O-N 2.97Å
72	E	67.8	Low	66.5	Low	94 Å²	94	92.1 Å²	92.1	44%	0.439	47%	0.468	S	S	.	.	H	α-helix	trans	-59.1	-42.3	178.2	-70.6	170.3	-165.1	0	0	111.6	N69 K74 D75 Y76	N69-E72 HydrophobicContact CB-CB 4.45Å; N69-E72 HydrophobicContact CB-CG 4.24Å; N69-E72 PolarHBondContact ND2-OE1 3.35Å; N69-E72 PolarHBondContact O-N 3.36Å; E72-K74 VanDerWaalsContact C-N 3.35Å; E72-K74 PolarHBondContact O-N 2.91Å; E72-D75 PolarHBondContact O-N 3.31Å; E72-Y76 HydrophobicContact CB-CE2 4.47Å; E72-Y76 WeakPolarHBondContact O-CD2 3.47Å; E72-Y76 PolarHBondContact O-N 2.95Å
73	L	67.9	Low	66.6	Low	13 Å²	13	89.2 Å²	89.2	7%	0.068	45%	0.453	C	S	.	.	H	α-helix	trans	-65.8	-37.9	177.9	-164	96.8	0	0	0	112.3	Y56 M59 N69 E71 D75 S77	Y56-L73 HydrophobicContact CE2-CG 4.48Å; M59-L73 HydrophobicContact CE-CD1 3.53Å; M59-L73 HydrophobicContact CE-CG 4.45Å; M59-L73 HydrophobicContact CG-CD1 4.25Å; M59-L73 HydrophobicContact SD-CD1 4.17Å; N69-L73 PolarHBondContact O-N 2.72Å; E71-L73 VanDerWaalsContact C-N 3.31Å; E71-L73 PolarHBondContact O-N 3.32Å; L73-D75 VanDerWaalsContact C-N 3.35Å; L73-S77 WeakPolarHBondContact O-CB 3.46Å; L73-S77 PolarHBondContact O-N 2.92Å
74	K	69.8	Low	66.7	Low	130 Å²	130	86.7 Å²	86.7	57%	0.565	45%	0.448	S	S	*	.	H	α-helix	trans	-66	-40	176.3	-79.6	174.6	-178	175.6	0	111	D70 E71 E72 S77 R78	D70-K74 VanDerWaalsContact O-CG 3.27Å; D70-K74 WeakPolarHBondContact O-CG 3.31Å; D70-K74 PolarHBondContact O-N 3.18Å; E71-K74 WeakPolarHBondContact O-CB 3.17Å; E71-K74 PolarHBondContact O-N 2.88Å; E71-K74 VanDerWaalsContact O-N 3.12Å; E72-K74 VanDerWaalsContact C-N 3.35Å; E72-K74 PolarHBondContact O-N 2.91Å; K74-S77 WeakPolarHBondContact CA-OG 3.32Å; K74-S77 PolarHBondContact O-N 3.5Å; K74-S77 PolarHBondContact O-OG 2.97Å; K74-R78 PolarHBondContact O-N 3.35Å
75	D	74.2	Confident	67.1	Low	92 Å²	92	81.2 Å²	81.2	49%	0.492	43%	0.432	S	S	.	.	H	α-helix	trans	-65.2	-46.6	176.6	-71.8	-17.2	0	0	0	110.9	E71 E72 L73 S77 R78 E79	E71-D75 PolarHBondContact O-N 2.97Å; E72-D75 PolarHBondContact O-N 3.31Å; L73-D75 VanDerWaalsContact C-N 3.35Å; D75-S77 VanDerWaalsContact C-N 3.33Å; D75-S77 PolarHBondContact O-N 3.21Å; D75-R78 PolarHBondContact O-N 3.02Å; D75-E79 PolarHBondContact O-N 3.08Å
76	Y	72.2	Confident	67.8	Low	42 Å²	42	79.9 Å²	79.9	17%	0.165	41%	0.409	C	S	.	.	H	α-helix	trans	-59.4	-42.6	172.3	-70.1	-48.3	0	0	0	112.2	I25 S26 L29 M59 E72 R78 E79 V80	I25-Y76 HydrophobicContact CB-CD1 4.43Å; I25-Y76 HydrophobicContact CB-CE1 4.38Å; I25-Y76 HydrophobicContact CG2-CD1 3.29Å; I25-Y76 HydrophobicContact CG2-CE1 3.57Å; I25-Y76 HydrophobicContact CG2-CG 3.87Å; S26-Y76 PolarHBondContact OG-OH 3.37Å; L29-Y76 HydrophobicContact CD1-CD1 3.64Å; L29-Y76 HydrophobicContact CD1-CE1 3.86Å; M59-Y76 HydrophobicContact CE-CD2 3.9Å; M59-Y76 HydrophobicContact CE-CG 4.31Å; M59-Y76 HydrophobicContact SD-CD2 4.14Å; M59-Y76 HydrophobicContact SD-CE2 4.46Å; E72-Y76 HydrophobicContact CB-CE2 4.47Å; E72-Y76 WeakPolarHBondContact O-CD2 3.47Å; E72-Y76 PolarHBondContact O-N 2.95Å; Y76-R78 PolarHBondContact O-N 3.14Å; Y76-E79 PolarHBondContact O-N 3.34Å; Y76-V80 WeakPolarHBondContact O-CB 3.39Å; Y76-V80 WeakPolarHBondContact O-CG2 3.42Å; Y76-V80 PolarHBondContact O-N 3.29Å
77	S	72.1	Confident	68.3	Low	33 Å²	33	72.9 Å²	72.9	23%	0.231	38%	0.38	C	S	.	.	H	α-helix	trans	-57.1	-41.1	178.4	80.1	0	0	0	0	111.8	Y56 L73 K74 D75 L81	Y56-S77 WeakPolarHBondContact OH-CB 3.35Å; L73-S77 WeakPolarHBondContact O-CB 3.46Å; L73-S77 PolarHBondContact O-N 2.92Å; K74-S77 WeakPolarHBondContact CA-OG 3.32Å; K74-S77 PolarHBondContact O-N 3.5Å; K74-S77 PolarHBondContact O-OG 2.97Å; D75-S77 VanDerWaalsContact C-N 3.33Å; D75-S77 PolarHBondContact O-N 3.21Å; S77-L81 VanDerWaalsContact O-CB 3.26Å; S77-L81 WeakPolarHBondContact O-CB 3.14Å; S77-L81 WeakPolarHBondContact O-CD1 3.37Å; S77-L81 WeakPolarHBondContact O-CG 3.45Å; S77-L81 PolarHBondContact O-N 3.35Å
78	R	71.8	Confident	68.2	Low	178 Å²	178	70.9 Å²	70.9	67%	0.672	35%	0.353	S	S	*	.	H	α-helix	trans	-70.7	-44.5	-179.3	-170.5	-175.7	-60.8	161.6	7.1	111.2	K74 D75 Y76 N82	K74-R78 PolarHBondContact O-N 3.35Å; D75-R78 PolarHBondContact O-N 3.02Å; Y76-R78 PolarHBondContact O-N 3.14Å; R78-N82 WeakPolarHBondContact O-CB 3.12Å; R78-N82 PolarHBondContact O-N 3.4Å
79	E	75.2	Confident	67.8	Low	64 Å²	64	75.2 Å²	75.2	30%	0.299	37%	0.371	S	S	.	.	H	α-helix	trans	-66.2	-44.2	178.7	-67.8	-159.8	-174.9	0	0	111.7	L29 K33 D75 Y76 N82 Y83	L29-E79 HydrophobicContact CD1-CB 4.31Å; L29-E79 WeakPolarHBondContact CD1-OE2 3.47Å; L29-E79 HydrophobicContact CD2-CB 3.86Å; L29-E79 WeakPolarHBondContact CD2-OE2 3.27Å; K33-E79 IonicContact NZ-OE1 2.65Å; K33-E79 PolarHBondContact NZ-OE1 3.27Å; K33-E79 IonicContact NZ-OE2 3.82Å; K33-E79 PolarHBondContact NZ-OE2 2.91Å; D75-E79 PolarHBondContact O-N 3.08Å; Y76-E79 PolarHBondContact O-N 3.34Å; E79-N82 WeakPolarHBondContact O-CB 3.28Å; E79-N82 PolarHBondContact O-N 3.47Å; E79-Y83 WeakPolarHBondContact O-CD2 3.41Å; E79-Y83 PolarHBondContact O-N 2.88Å; E79-Y83 VanDerWaalsContact O-N 3.08Å
80	V	69.6	Low	66.7	Low	7 Å²	7	72.4 Å²	72.4	4%	0.042	36%	0.356	C	S	.	.	H	α-helix	trans	-61	-49.4	177.5	174.8	0	0	0	0	110.5	L52 Y56 Y76 N82 Y83 C84	L52-V80 HydrophobicContact CD1-CG2 3.98Å; L52-V80 HydrophobicContact CD2-CB 4.27Å; L52-V80 HydrophobicContact CD2-CG1 4.3Å; L52-V80 HydrophobicContact CD2-CG2 3.86Å; L52-V80 HydrophobicContact CG-CG1 4.25Å; L52-V80 HydrophobicContact CG-CG2 3.87Å; Y56-V80 HydrophobicContact CD2-CG2 3.91Å; Y56-V80 HydrophobicContact CG-CG1 4.35Å; Y56-V80 HydrophobicContact CG-CG2 4.12Å; Y76-V80 WeakPolarHBondContact O-CB 3.39Å; Y76-V80 WeakPolarHBondContact O-CG2 3.42Å; Y76-V80 PolarHBondContact O-N 3.29Å; V80-N82 VanDerWaalsContact C-N 3.28Å; V80-N82 PolarHBondContact O-N 2.69Å; V80-Y83 PolarHBondContact O-N 3.06Å; V80-C84 PolarHBondContact O-N 3.48Å; V80-C84 PolarHBondContact O-SG 3.17Å
81	L	67.3	Low	65.3	Low	111 Å²	111	72.7 Å²	72.7	58%	0.581	36%	0.357	S	S	*	.	H	α-helix	trans	-59.7	-39.5	177.4	-74.6	170.9	0	0	0	112	S77 Y83 C84 C85	S77-L81 VanDerWaalsContact O-CB 3.26Å; S77-L81 WeakPolarHBondContact O-CB 3.14Å; S77-L81 WeakPolarHBondContact O-CD1 3.37Å; S77-L81 WeakPolarHBondContact O-CG 3.45Å; S77-L81 PolarHBondContact O-N 3.35Å; L81-Y83 PolarHBondContact O-N 2.76Å; L81-C84 PolarHBondContact O-N 2.96Å; L81-C85 PolarHBondContact O-N 2.94Å; L81-C85 PolarHBondContact O-SG 2.9Å
82	N	74.5	Confident	63.8	Low	87 Å²	87	72.4 Å²	72.4	47%	0.465	36%	0.361	S	S	.	.	H	α-helix	trans	-60.8	-45.4	176.8	-176.1	74.5	0	0	0	111.9	R78 E79 V80 C85 L86	R78-N82 WeakPolarHBondContact O-CB 3.12Å; R78-N82 PolarHBondContact O-N 3.4Å; E79-N82 WeakPolarHBondContact O-CB 3.28Å; E79-N82 PolarHBondContact O-N 3.47Å; V80-N82 VanDerWaalsContact C-N 3.28Å; V80-N82 PolarHBondContact O-N 2.69Å; N82-C85 PolarHBondContact O-N 3.35Å; N82-L86 WeakPolarHBondContact O-CG 3.45Å; N82-L86 PolarHBondContact O-N 3.05Å
83	Y	70.3	Confident	62.3	Low	22 Å²	22	71.5 Å²	71.5	9%	0.086	37%	0.365	C	S	.	.	H	α-helix	trans	-71	-34	178.2	-70.9	-59.4	0	0	0	113.3	L29 I32 F45 L52 E79 V80 L81 C85 L86 A87	L29-Y83 HydrophobicContact CD2-CD2 3.76Å; L29-Y83 HydrophobicContact CD2-CE2 3.48Å; L29-Y83 VanDerWaalsContact CD2-CE2 3.48Å; I32-Y83 HydrophobicContact CB-CE1 4.18Å; I32-Y83 HydrophobicContact CD1-CD1 3.89Å; I32-Y83 HydrophobicContact CD1-CD2 3.98Å; I32-Y83 HydrophobicContact CD1-CE1 4.05Å; I32-Y83 HydrophobicContact CD1-CE2 4.12Å; I32-Y83 HydrophobicContact CD1-CG 3.85Å; I32-Y83 HydrophobicContact CG2-CD1 4.06Å; I32-Y83 HydrophobicContact CG2-CE1 3.34Å; F45-Y83 AromaticContact CE2-CD1 3.83Å; F45-Y83 HydrophobicContact CE2-CD1 3.83Å; F45-Y83 HydrophobicContact CE2-CE1 4.46Å; F45-Y83 AromaticContact CZ-CD1 3.92Å; F45-Y83 HydrophobicContact CZ-CD1 3.92Å; L52-Y83 HydrophobicContact CD2-CD2 4.34Å; E79-Y83 WeakPolarHBondContact O-CD2 3.41Å; E79-Y83 PolarHBondContact O-N 2.88Å; E79-Y83 VanDerWaalsContact O-N 3.08Å; V80-Y83 PolarHBondContact O-N 3.06Å; L81-Y83 PolarHBondContact O-N 2.76Å; Y83-C85 VanDerWaalsContact C-N 3.33Å; Y83-L86 HydrophobicContact CD1-CD1 3.97Å; Y83-L86 HydrophobicContact CE1-CD1 4.33Å; Y83-L86 PolarHBondContact O-N 2.78Å; Y83-A87 WeakPolarHBondContact O-CB 3.32Å; Y83-A87 PolarHBondContact O-N 3.4Å
84	C	65.5	Low	60.5	Low	31 Å²	31	77.3 Å²	77.3	21%	0.209	39%	0.387	C	S	.	.	H	α-helix	trans	-59.2	-44.7	169.8	-68	0	0	0	0	111.3	V49 V80 L81 A87 E88	V49-C84 HydrophobicContact CG1-CB 4.42Å; V80-C84 PolarHBondContact O-N 3.48Å; V80-C84 PolarHBondContact O-SG 3.17Å; L81-C84 PolarHBondContact O-N 2.96Å; C84-A87 PolarHBondContact O-N 2.96Å; C84-E88 WeakPolarHBondContact O-CG 3.4Å; C84-E88 PolarHBondContact O-N 3.1Å; C84-E88 VanDerWaalsContact O-N 3.14Å
85	C	65.3	Low	58.6	Low	67 Å²	67	75.7 Å²	75.7	45%	0.453	39%	0.392	S	S	.	.	H	α-helix	trans	-62	-44.9	175.6	-67.1	0	0	0	0	112.3	L81 N82 Y83 A87 E88 E89	L81-C85 PolarHBondContact O-N 2.94Å; L81-C85 PolarHBondContact O-SG 2.9Å; N82-C85 PolarHBondContact O-N 3.35Å; Y83-C85 VanDerWaalsContact C-N 3.33Å; C85-A87 VanDerWaalsContact C-N 3.31Å; C85-A87 PolarHBondContact O-N 3.24Å; C85-E88 WeakPolarHBondContact O-CB 3.38Å; C85-E88 PolarHBondContact O-N 3.01Å; C85-E89 PolarHBondContact O-N 3.39Å
86	L	66.5	Low	56.5	Low	41 Å²	41	80.2 Å²	80.2	22%	0.215	41%	0.407	C	S	.	.	H	α-helix	trans	-61.3	-39.1	177.5	-70.8	171.6	0	0	0	112.1	F45 N82 Y83 E88	F45-L86 HydrophobicContact CE1-CB 4.09Å; F45-L86 HydrophobicContact CZ-CB 3.93Å; N82-L86 WeakPolarHBondContact O-CG 3.45Å; N82-L86 PolarHBondContact O-N 3.05Å; Y83-L86 HydrophobicContact CD1-CD1 3.97Å; Y83-L86 HydrophobicContact CE1-CD1 4.33Å; Y83-L86 PolarHBondContact O-N 2.78Å; L86-E88 PolarHBondContact O-N 3.4Å
87	A	61.1	Low	54.3	Low	11 Å²	11	84.5 Å²	84.5	9%	0.091	43%	0.432	C	S	.	.	H	α-helix	trans	-68.7	-21.8	176.2	0	0	0	0	0	113.2	F45 R46 V49 Y83 C84 C85	F45-A87 HydrophobicContact CD1-CB 4.3Å; F45-A87 HydrophobicContact CE1-CB 3.85Å; R46-A87 HydrophobicContact CG-CB 4.24Å; R46-A87 PolarHBondContact NH1-O 2.93Å; R46-A87 VanDerWaalsContact NH1-O 3.11Å; V49-A87 HydrophobicContact CB-CB 4.19Å; V49-A87 HydrophobicContact CG1-CB 3.96Å; V49-A87 HydrophobicContact CG2-CB 4.33Å; Y83-A87 WeakPolarHBondContact O-CB 3.32Å; Y83-A87 PolarHBondContact O-N 3.4Å; C84-A87 PolarHBondContact O-N 2.96Å; C85-A87 VanDerWaalsContact C-N 3.31Å; C85-A87 PolarHBondContact O-N 3.24Å
88	E	53.4	Low	52.1	Low	66 Å²	66	87.2 Å²	87.2	31%	0.308	45%	0.451	S	S	.	.	H	α-helix	trans	-86.8	-39.3	178.3	-75	-175.2	179.1	0	0	113.5	C84 C85 L86 D90 I91 R195	C84-E88 WeakPolarHBondContact O-CG 3.4Å; C84-E88 PolarHBondContact O-N 3.1Å; C84-E88 VanDerWaalsContact O-N 3.14Å; C85-E88 WeakPolarHBondContact O-CB 3.38Å; C85-E88 PolarHBondContact O-N 3.01Å; L86-E88 PolarHBondContact O-N 3.4Å; E88-D90 PolarHBondContact O-N 3.49Å; E88-D90 VanDerWaalsContact O-N 3.15Å; E88-I91 HydrophobicContact CG-CD1 4.44Å; E88-I91 WeakPolarHBondContact O-CB 3.44Å; E88-I91 PolarHBondContact O-N 3.16Å; E88-R195 IonicContact OE1-CZ 3.65Å; E88-R195 IonicContact OE1-NE 2.94Å; E88-R195 PolarHBondContact OE1-NE 3.15Å; E88-R195 IonicContact OE1-NH2 3.79Å; E88-R195 IonicContact OE2-CZ 3.36Å; E88-R195 IonicContact OE2-NE 3.35Å; E88-R195 PolarHBondContact OE2-NE 2.95Å; E88-R195 IonicContact OE2-NH2 2.72Å; E88-R195 PolarHBondContact OE2-NH2 3.01Å
89	E	51.8	Low	49.8	Very low	142 Å²	142	85.5 Å²	85.5	66%	0.664	46%	0.455	S	S	*	.	H	α-helix	trans	-57.2	-31	-179.2	-76.2	-177.1	-178.8	0	0	112.2	C85	C85-E89 PolarHBondContact O-N 3.39Å
90	D	45	Very low	47.5	Very low	44 Å²	44	86.2 Å²	86.2	24%	0.235	47%	0.472	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	0.3	175.8	-71	-30.6	0	0	0	114.3	R46 E88 S93 Y94	R46-D90 PolarHBondContact NH1-O 2.79Å; R46-D90 VanDerWaalsContact NH2-C 3.33Å; R46-D90 PolarHBondContact NH2-O 3Å; E88-D90 PolarHBondContact O-N 3.49Å; E88-D90 VanDerWaalsContact O-N 3.15Å; D90-S93 WeakPolarHBondContact CA-OG 3.45Å; D90-S93 PolarHBondContact O-OG 2.94Å; D90-Y94 VanDerWaalsContact O-CD2 3.29Å; D90-Y94 WeakPolarHBondContact O-CD2 3.47Å
91	I	40.2	Very low	45.5	Very low	93 Å²	93	91.2 Å²	91.2	48%	0.477	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-37.4	173	-64.5	174	0	0	0	109.7	E88 S93 Y94	E88-I91 HydrophobicContact CG-CD1 4.44Å; E88-I91 WeakPolarHBondContact O-CB 3.44Å; E88-I91 PolarHBondContact O-N 3.16Å; I91-S93 PolarHBondContact O-N 2.99Å; I91-Y94 PolarHBondContact O-N 3.34Å; I91-Y94 VanDerWaalsContact O-N 3.15Å
92	D	38.5	Very low	43.5	Very low	153 Å²	153	90.8 Å²	90.8	82%	0.818	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-19.5	-178.8	-69	-20.1	0	0	0	112.7
93	S	35.5	Very low	41.1	Very low	75 Å²	75	93.8 Å²	93.8	52%	0.524	53%	0.529	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-15.3	176.7	53.9	0	0	0	0	114.1	D90 I91 S95	D90-S93 WeakPolarHBondContact CA-OG 3.45Å; D90-S93 PolarHBondContact O-OG 2.94Å; I91-S93 PolarHBondContact O-N 2.99Å; S93-S95 PolarHBondContact O-N 3.24Å
94	Y	30.4	Very low	39	Very low	134 Å²	134	100.9 Å²	100.9	53%	0.525	57%	0.565	S	S	.	*			trans	-93.8	78.4	172.4	-76.3	-100.1	0	0	0	109.6	D90 I91 F96	D90-Y94 VanDerWaalsContact O-CD2 3.29Å; D90-Y94 WeakPolarHBondContact O-CD2 3.47Å; I91-Y94 PolarHBondContact O-N 3.34Å; I91-Y94 VanDerWaalsContact O-N 3.15Å; Y94-F96 VanDerWaalsContact C-N 3.33Å; Y94-F96 PolarHBondContact O-N 2.89Å
95	S	30.9	Very low	37.2	Very low	96 Å²	96	104.6 Å²	104.6	67%	0.671	59%	0.592	S	S	*	*			trans	-56.2	107	150	55.5	0	0	0	0	106.3	S93 I97	S93-S95 PolarHBondContact O-N 3.24Å; S95-I97 VanDerWaalsContact C-N 3.32Å; S95-I97 PolarHBondContact O-N 3.3Å
96	F	29.6	Very low	35.3	Very low	187 Å²	187	110.6 Å²	110.6	82%	0.82	61%	0.613	S	S	*	*			trans	-51.7	105.4	165.5	-107.9	-99	0	0	0	106.1	Y94 S98	Y94-F96 VanDerWaalsContact C-N 3.33Å; Y94-F96 PolarHBondContact O-N 2.89Å; F96-S98 PolarHBondContact O-N 3.27Å
97	I	26.1	Very low	33.4	Very low	133 Å²	133	118 Å²	118	68%	0.682	65%	0.647	S	S	*	*			trans	-69.9	82.4	161.8	-58.5	174.2	0	0	0	103.3	S95 D99	S95-I97 VanDerWaalsContact C-N 3.32Å; S95-I97 PolarHBondContact O-N 3.3Å; I97-D99 PolarHBondContact O-N 3.46Å
98	S	25	Very low	31.8	Very low	90 Å²	90	126 Å²	126	63%	0.629	68%	0.679	S	S	*	*			trans	-67.7	90.2	163.2	58.1	0	0	0	0	105.5	F96 A100	F96-S98 PolarHBondContact O-N 3.27Å; S98-A100 PolarHBondContact O-N 2.93Å
99	D	24.5	Very low	30.6	Very low	141 Å²	141	130.8 Å²	130.8	75%	0.754	71%	0.707	S	S	*	*			trans	-69.1	32.6	166	-93.5	-20.1	0	0	0	111.5	I97 S101	I97-D99 PolarHBondContact O-N 3.46Å; D99-S101 PolarHBondContact O-N 3.35Å
100	A	26.3	Very low	29.4	Very low	80 Å²	80	132 Å²	132	66%	0.661	71%	0.712	S	S	*	*			trans	-77.5	64.9	158.4	0	0	0	0	0	108.4	S98 S102	S98-A100 PolarHBondContact O-N 2.93Å; A100-S102 PolarHBondContact O-N 3.45Å
101	S	27.8	Very low	28.6	Very low	112 Å²	112	134.8 Å²	134.8	78%	0.783	74%	0.735	S	S	*	*			trans	-78.7	63.5	160.1	65.5	0	0	0	0	109.7	D99	D99-S101 PolarHBondContact O-N 3.35Å
102	S	24.6	Very low	28.1	Very low	101 Å²	101	138.1 Å²	138.1	71%	0.706	75%	0.754	S	S	*	*			trans	-108.2	119.4	141.2	-79.5	0	0	0	0	103.6	A100	A100-S102 PolarHBondContact O-N 3.45Å
103	D	25.5	Very low	27.5	Very low	150 Å²	150	139.1 Å²	139.1	80%	0.802	75%	0.754	S	S	*	*			cis	-168.7	169.5	43	-134.2	-28	0	0	0	110.1
104	M	26.2	Very low	27.4	Very low	171 Å²	171	143.6 Å²	143.6	84%	0.842	77%	0.772	S	S	*	*			trans	-49.7	158.8	171.5	-73.6	-101.2	-176.6	0	0	114.9
105	S	26.4	Very low	27.2	Very low	110 Å²	110	143.9 Å²	143.9	77%	0.769	78%	0.782	S	S	*	*			trans	87	97.2	171.1	68.9	0	0	0	0	116
106	E	26.9	Very low	27	Very low	193 Å²	193	143.9 Å²	143.9	90%	0.902	79%	0.788	S	S	*	*				55.5	87.8	87.9	-74.3	-167	166	0	0	113.7
107	E	26.7	Very low	26.8	Very low	197 Å²	197	141.5 Å²	141.5	92%	0.921	78%	0.782	S	S	*	*				-163.3	126.2	122.8	-113.8	177.7	177.5	0	0	110.9
108	K	27	Very low	26.8	Very low	177 Å²	177	138.6 Å²	138.6	77%	0.77	77%	0.774	S	S	*	*			trans	-65.9	135.5	169.3	-83.6	-179.7	166.7	-165.9	0	109.9
109	L	28.7	Very low	27	Very low	168 Å²	168	138.2 Å²	138.2	88%	0.88	78%	0.776	S	S	*	*			trans	-139.7	97.5	142.8	-98.4	156.4	0	0	0	108.1	S111	L109-S111 PolarHBondContact O-N 3.29Å
110	E	26.4	Very low	27	Very low	166 Å²	166	134.8 Å²	134.8	78%	0.776	76%	0.764	S	S	*	*			trans	-66.2	110	155.2	-75.4	166	176.1	0	0	106.6
111	S	28.7	Very low	27.1	Very low	104 Å²	104	138.7 Å²	138.7	73%	0.727	76%	0.762	S	S	*	*			trans	-120.3	94.8	156.2	62.3	0	0	0	0	107.6	L109 E113	L109-S111 PolarHBondContact O-N 3.29Å; S111-E113 PolarHBondContact O-N 3.12Å; S111-E113 VanDerWaalsContact O-N 3.16Å
112	D	28.8	Very low	27	Very low	162 Å²	162	140.2 Å²	140.2	87%	0.866	76%	0.755	S	S	*	*			trans	-55.9	104.1	150.9	-71.8	-35.7	0	0	0	107.1
113	E	26.1	Very low	27	Very low	175 Å²	175	138.2 Å²	138.2	82%	0.818	75%	0.745	S	S	*	*			trans	-160	123.3	138.4	-73.2	-149.2	152	0	0	107.4	S111 D115	S111-E113 PolarHBondContact O-N 3.12Å; S111-E113 VanDerWaalsContact O-N 3.16Å; E113-D115 PolarHBondContact O-N 3.45Å; E113-D115 VanDerWaalsContact O-N 3.1Å
114	D	32.1	Very low	27	Very low	168 Å²	168	139.4 Å²	139.4	90%	0.898	75%	0.745	S	S	*	*			trans	-49.9	110.4	162.6	-71.3	-57.5	0	0	0	109.3
115	D	26.7	Very low	27	Very low	141 Å²	141	138.5 Å²	138.5	75%	0.754	74%	0.739	S	S	*	*			trans	-136.5	99.7	158.7	-102	-28.8	0	0	0	108.7	E113 I117	E113-D115 PolarHBondContact O-N 3.45Å; E113-D115 VanDerWaalsContact O-N 3.1Å; D115-I117 PolarHBondContact O-N 2.95Å
116	A	28	Very low	27.1	Very low	95 Å²	95	135.8 Å²	135.8	79%	0.785	72%	0.718	S	S	*	*			trans	-38.9	109.1	163.6	0	0	0	0	0	108.6	S118	A116-S118 PolarHBondContact O-N 3.32Å
117	I	25.3	Very low	27	Very low	137 Å²	137	134.7 Å²	134.7	70%	0.703	71%	0.711	S	S	*	*			trans	-55.3	97	174.7	-62.9	171.6	0	0	0	106.2	D115 A119	D115-I117 PolarHBondContact O-N 2.95Å; I117-A119 PolarHBondContact O-N 3.27Å
118	S	25.2	Very low	27	Very low	72 Å²	72	132.9 Å²	132.9	50%	0.503	71%	0.707	S	S	.	*			trans	-61.8	131.8	-173.9	174.2	0	0	0	0	107.6	A116 S120 Y121	A116-S118 PolarHBondContact O-N 3.32Å; S118-S120 PolarHBondContact O-N 3.31Å; S118-S120 PolarHBondContact OG-OG 3.34Å; S118-Y121 PolarHBondContact O-N 3.32Å
119	A	29.9	Very low	27.4	Very low	82 Å²	82	128.9 Å²	128.9	68%	0.678	70%	0.698	S	S	*	*	H	α-helix	trans	-49.1	-17.5	178.4	0	0	0	0	0	114.2	I117 F122 A123	I117-A119 PolarHBondContact O-N 3.27Å; A119-F122 PolarHBondContact O-N 3.48Å; A119-A123 PolarHBondContact O-N 2.9Å
120	S	24.7	Very low	27.7	Very low	70 Å²	70	129.6 Å²	129.6	49%	0.49	70%	0.697	S	S	.	*	H	α-helix	trans	-62.8	-31.9	170.3	58.6	0	0	0	0	114.7	S118 F122 A123 E124	S118-S120 PolarHBondContact O-N 3.31Å; S118-S120 PolarHBondContact OG-OG 3.34Å; S120-F122 VanDerWaalsContact C-N 3.27Å; S120-F122 PolarHBondContact O-N 2.98Å; S120-A123 WeakPolarHBondContact O-CB 3.34Å; S120-A123 PolarHBondContact O-N 3.1Å; S120-E124 PolarHBondContact O-N 3Å; S120-E124 VanDerWaalsContact O-N 3.15Å
121	Y	26.8	Very low	28.4	Very low	161 Å²	161	123.8 Å²	123.8	63%	0.631	68%	0.677	S	S	*	*	H	α-helix	trans	-65.4	-33.5	176.2	-162.4	-97.2	0	0	0	111.5	S118	S118-Y121 PolarHBondContact O-N 3.32Å
122	F	26.3	Very low	29	Very low	144 Å²	144	121.2 Å²	121.2	63%	0.632	66%	0.659	S	S	*	*	H	α-helix	trans	-70.5	-33.2	169.8	-89.3	-77.9	0	0	0	112.2	A119 S120 T126	A119-F122 PolarHBondContact O-N 3.48Å; S120-F122 VanDerWaalsContact C-N 3.27Å; S120-F122 PolarHBondContact O-N 2.98Å; F122-T126 PolarHBondContact O-OG1 3.19Å
123	A	25.1	Very low	29.4	Very low	60 Å²	60	120.8 Å²	120.8	50%	0.496	65%	0.652	S	S	.	*	H	α-helix	trans	-67.6	-37.9	-180	0	0	0	0	0	113	A119 S120 T126	A119-A123 PolarHBondContact O-N 2.9Å; S120-A123 WeakPolarHBondContact O-CB 3.34Å; S120-A123 PolarHBondContact O-N 3.1Å; A123-T126 WeakPolarHBondContact O-CB 3.41Å; A123-T126 PolarHBondContact O-N 3.33Å
124	E	24.6	Very low	30	Very low	174 Å²	174	116.1 Å²	116.1	81%	0.813	64%	0.639	S	S	*	*	H	α-helix	trans	-75.3	-31.2	-176.6	-77.8	-170.4	157.6	0	0	114.4	S120 T126	S120-E124 PolarHBondContact O-N 3Å; S120-E124 VanDerWaalsContact O-N 3.15Å; E124-T126 PolarHBondContact O-N 3.34Å
125	Q	26.1	Very low	30.3	Very low	153 Å²	153	113.4 Å²	113.4	72%	0.715	62%	0.621	S	S	*	*	G	3₁₀ helix	trans	-73.9	-9.8	170.2	-92.5	-161.3	21.7	0	0	113.5	F127	Q125-F127 VanDerWaalsContact C-N 3.29Å; Q125-F127 PolarHBondContact O-N 3.46Å
126	T	28.4	Very low	30.9	Very low	53 Å²	53	110.5 Å²	110.5	33%	0.325	61%	0.605	S	S	.	*	G	3₁₀ helix	trans	-76.7	-4.1	-168.7	-66.1	0	0	0	0	115	F122 A123 E124 K196	F122-T126 PolarHBondContact O-OG1 3.19Å; A123-T126 WeakPolarHBondContact O-CB 3.41Å; A123-T126 PolarHBondContact O-N 3.33Å; E124-T126 PolarHBondContact O-N 3.34Å; T126-K196 HydrophobicContact CG2-CD 3.72Å; T126-K196 HydrophobicContact CG2-CG 4.36Å; T126-K196 VanDerWaalsContact OG1-CE 3.24Å; T126-K196 WeakPolarHBondContact OG1-CE 3.34Å; T126-K196 PolarHBondContact OG1-NZ 3.15Å
127	F	24.7	Very low	31.4	Very low	170 Å²	170	111.2 Å²	111.2	75%	0.746	59%	0.592	S	S	*	*	G	3₁₀ helix	trans	-108.2	-6.2	-169.1	-108.5	-84.3	0	0	0	119.2	Q125	Q125-F127 VanDerWaalsContact C-N 3.29Å; Q125-F127 PolarHBondContact O-N 3.46Å
128	N	27.7	Very low	32	Very low	159 Å²	159	108.5 Å²	108.5	85%	0.85	59%	0.585	S	S	*	*	S	Bend	trans	-115	5.4	-167.6	-82.2	-16.6	0	0	0	118.4
129	T	35.6	Very low	32.8	Very low	93 Å²	93	106.7 Å²	106.7	57%	0.571	57%	0.569	S	S	*	*			trans	-114.1	68	170.9	36.6	0	0	0	0	111	A131 H193	T129-A131 VanDerWaalsContact C-N 3.31Å; T129-A131 PolarHBondContact O-N 2.89Å; T129-H193 PolarHBondContact O-CE1 2.82Å; T129-H193 VanDerWaalsContact O-CE1 3.28Å
130	Q	33.8	Very low	33.4	Very low	182 Å²	182	107.3 Å²	107.3	85%	0.85	57%	0.565	S	S	*	*			trans	-66.5	94.3	159.6	-74.7	-175.7	-10.8	0	0	108	S132	Q130-S132 PolarHBondContact O-N 3.34Å
131	A	41.8	Very low	34	Very low	45 Å²	45	110.7 Å²	110.7	37%	0.372	57%	0.571	S	S	.	*			trans	-60.2	125.2	159.7	0	0	0	0	0	107.3	T129 E135 L136	T129-A131 VanDerWaalsContact C-N 3.31Å; T129-A131 PolarHBondContact O-N 2.89Å; A131-E135 WeakPolarHBondContact CA-OE2 3.45Å; A131-E135 HydrophobicContact CB-CB 4.29Å; A131-L136 HydrophobicContact CB-CD2 4.3Å; A131-L136 HydrophobicContact CB-CG 4.31Å
132	S	41.5	Very low	34.4	Very low	50 Å²	50	107.1 Å²	107.1	35%	0.35	56%	0.557	S	S	.	*			trans	-58.9	151.6	172.2	60.2	0	0	0	0	110.4	Q130 S134 E135 L136	Q130-S132 PolarHBondContact O-N 3.34Å; S132-S134 PolarHBondContact O-N 3.11Å; S132-S134 VanDerWaalsContact O-N 3.1Å; S132-S134 PolarHBondContact OG-OG 3.39Å; S132-E135 WeakPolarHBondContact CB-OE2 3.34Å; S132-E135 PolarHBondContact N-OE2 2.93Å; S132-E135 WeakPolarHBondContact O-CB 3.47Å; S132-E135 PolarHBondContact O-N 3.08Å; S132-E135 VanDerWaalsContact OG-CD 3.25Å; S132-E135 VanDerWaalsContact OG-CG 3.28Å; S132-E135 WeakPolarHBondContact OG-CG 3.43Å; S132-E135 PolarHBondContact OG-N 3.45Å; S132-E135 PolarHBondContact OG-OE2 3.18Å; S132-L136 PolarHBondContact O-N 3.15Å
133	E	36.1	Very low	35	Very low	153 Å²	153	101.9 Å²	101.9	72%	0.715	54%	0.537	S	S	*	.	H	α-helix	trans	-51.8	-35.7	177	-172.1	174	-168.6	0	0	111.9	E135 L136 E137	E133-E135 PolarHBondContact O-N 3.05Å; E133-L136 PolarHBondContact O-N 3.35Å; E133-E137 PolarHBondContact O-N 3.05Å
134	S	39	Very low	35.7	Very low	77 Å²	77	101.5 Å²	101.5	54%	0.538	54%	0.539	S	S	.	.	H	α-helix	trans	-64.9	-35	174.4	48.4	0	0	0	0	114.5	S132 S138	S132-S134 PolarHBondContact O-N 3.11Å; S132-S134 VanDerWaalsContact O-N 3.1Å; S132-S134 PolarHBondContact OG-OG 3.39Å; S134-S138 VanDerWaalsContact O-CB 3.32Å; S134-S138 WeakPolarHBondContact O-CB 3.29Å; S134-S138 PolarHBondContact O-N 3.03Å
135	E	38.9	Very low	36.3	Very low	111 Å²	111	99.8 Å²	99.8	52%	0.519	54%	0.535	S	S	.	.	H	α-helix	trans	-72	-37.2	177.2	-74.8	163.6	140	0	0	110.7	A131 S132 E133 L139	A131-E135 WeakPolarHBondContact CA-OE2 3.45Å; A131-E135 HydrophobicContact CB-CB 4.29Å; S132-E135 WeakPolarHBondContact CB-OE2 3.34Å; S132-E135 PolarHBondContact N-OE2 2.93Å; S132-E135 WeakPolarHBondContact O-CB 3.47Å; S132-E135 PolarHBondContact O-N 3.08Å; S132-E135 VanDerWaalsContact OG-CD 3.25Å; S132-E135 VanDerWaalsContact OG-CG 3.28Å; S132-E135 WeakPolarHBondContact OG-CG 3.43Å; S132-E135 PolarHBondContact OG-N 3.45Å; S132-E135 PolarHBondContact OG-OE2 3.18Å; E133-E135 PolarHBondContact O-N 3.05Å; E135-L139 WeakPolarHBondContact O-CB 3.29Å; E135-L139 PolarHBondContact O-N 2.93Å
136	L	39.5	Very low	36.7	Very low	80 Å²	80	93.7 Å²	93.7	42%	0.419	51%	0.507	S	S	.	.	H	α-helix	trans	-64.6	-47.9	172.9	-66.8	173.8	0	0	0	111.4	A131 S132 E133 L139 V140 M190	A131-L136 HydrophobicContact CB-CD2 4.3Å; A131-L136 HydrophobicContact CB-CG 4.31Å; S132-L136 PolarHBondContact O-N 3.15Å; E133-L136 PolarHBondContact O-N 3.35Å; L136-L139 PolarHBondContact O-N 2.77Å; L136-V140 WeakPolarHBondContact O-CG2 3.26Å; L136-V140 PolarHBondContact O-N 2.99Å; L136-M190 HydrophobicContact CD2-CE 3.57Å
137	E	37.5	Very low	37.3	Very low	109 Å²	109	93.5 Å²	93.5	51%	0.509	51%	0.511	S	S	.	.	H	α-helix	trans	-60.6	-48.7	176.8	-77.9	-173.9	160.9	0	0	111.9	E133 L139 V140 F141	E133-E137 PolarHBondContact O-N 3.05Å; E137-L139 PolarHBondContact O-N 2.93Å; E137-V140 PolarHBondContact O-N 3.41Å; E137-V140 VanDerWaalsContact O-N 3.13Å; E137-F141 WeakPolarHBondContact O-CD2 3.27Å; E137-F141 PolarHBondContact O-N 2.91Å
138	S	38.1	Very low	37.9	Very low	81 Å²	81	89.8 Å²	89.8	57%	0.566	51%	0.506	S	S	*	.	H	α-helix	trans	-58.5	-35.6	177.7	-172.3	0	0	0	0	111.7	S134 Y142	S134-S138 VanDerWaalsContact O-CB 3.32Å; S134-S138 WeakPolarHBondContact O-CB 3.29Å; S134-S138 PolarHBondContact O-N 3.03Å; S138-Y142 VanDerWaalsContact O-CB 3.23Å; S138-Y142 WeakPolarHBondContact O-CB 3.44Å; S138-Y142 PolarHBondContact O-N 2.94Å
139	L	42.5	Very low	38.3	Very low	33 Å²	33	87.5 Å²	87.5	17%	0.173	49%	0.486	C	S	.	.	H	α-helix	trans	-75.4	-35.9	176.7	-157.3	79.9	0	0	0	112.7	E135 L136 E137 Y142 T143 M190	E135-L139 WeakPolarHBondContact O-CB 3.29Å; E135-L139 PolarHBondContact O-N 2.93Å; L136-L139 PolarHBondContact O-N 2.77Å; E137-L139 PolarHBondContact O-N 2.93Å; L139-Y142 PolarHBondContact O-N 3.19Å; L139-T143 HydrophobicContact CG-CG2 4.21Å; L139-T143 WeakPolarHBondContact O-CB 3.47Å; L139-T143 VanDerWaalsContact O-CG2 3.3Å; L139-T143 WeakPolarHBondContact O-CG2 3.2Å; L139-T143 PolarHBondContact O-N 3.42Å; L139-T143 PolarHBondContact O-OG1 3Å; L139-M190 HydrophobicContact CB-CE 4.15Å; L139-M190 HydrophobicContact CD2-CE 3.12Å; L139-M190 HydrophobicContact CD2-SD 3.67Å; L139-M190 HydrophobicContact CG-CE 4.19Å
140	V	41.6	Very low	38.5	Very low	95 Å²	95	85.1 Å²	85.1	58%	0.576	47%	0.469	S	S	*	.	H	α-helix	trans	-62.8	-44.6	172.5	171.1	0	0	0	0	110.5	L136 E137 Y142 T143 G144	L136-V140 WeakPolarHBondContact O-CG2 3.26Å; L136-V140 PolarHBondContact O-N 2.99Å; E137-V140 PolarHBondContact O-N 3.41Å; E137-V140 VanDerWaalsContact O-N 3.13Å; V140-Y142 PolarHBondContact O-N 3.4Å; V140-T143 WeakPolarHBondContact CA-OG1 3.4Å; V140-T143 PolarHBondContact O-OG1 3.48Å; V140-T143 VanDerWaalsContact O-OG1 3.11Å; V140-G144 PolarHBondContact O-N 3.34Å
141	F	38.9	Very low	38.7	Very low	142 Å²	142	81.8 Å²	81.8	62%	0.623	45%	0.449	S	S	*	.	H	α-helix	trans	-62.3	-42.8	174	-80.6	-69	0	0	0	111.9	E137 N145	E137-F141 WeakPolarHBondContact O-CD2 3.27Å; E137-F141 PolarHBondContact O-N 2.91Å; F141-N145 VanDerWaalsContact O-CB 3.3Å; F141-N145 WeakPolarHBondContact O-CB 3.42Å; F141-N145 PolarHBondContact O-N 3.45Å; F141-N145 PolarHBondContact O-ND2 2.92Å
142	Y	34.3	Very low	38.3	Very low	86 Å²	86	86.1 Å²	86.1	34%	0.337	46%	0.455	S	S	.	.	H	α-helix	trans	-66.9	-46.9	178.8	-178	-90.2	0	0	0	112.3	S138 L139 V140 N145 N146 L183	S138-Y142 VanDerWaalsContact O-CB 3.23Å; S138-Y142 WeakPolarHBondContact O-CB 3.44Å; S138-Y142 PolarHBondContact O-N 2.94Å; L139-Y142 PolarHBondContact O-N 3.19Å; V140-Y142 PolarHBondContact O-N 3.4Å; Y142-N145 PolarHBondContact O-N 3.02Å; Y142-N146 VanDerWaalsContact CD2-ND2 3.26Å; Y142-N146 WeakPolarHBondContact CD2-ND2 3.24Å; Y142-N146 HydrophobicContact CE1-CB 4.26Å; Y142-N146 WeakPolarHBondContact CE2-ND2 3.44Å; Y142-N146 VanDerWaalsContact CZ-ND2 3.28Å; Y142-N146 VanDerWaalsContact O-CB 3.26Å; Y142-N146 WeakPolarHBondContact O-CB 3.42Å; Y142-N146 PolarHBondContact O-N 3.25Å; Y142-N146 PolarHBondContact O-ND2 2.93Å; Y142-L183 HydrophobicContact CE1-CD1 3.9Å; Y142-L183 HydrophobicContact CE1-CD2 3.94Å; Y142-L183 WeakPolarHBondContact OH-CD1 3.42Å
143	T	39.7	Very low	37.9	Very low	34 Å²	34	85.9 Å²	85.9	21%	0.209	46%	0.457	C	S	.	.	H	α-helix	trans	-65.8	-38.1	178	50.7	0	0	0	0	111.1	L139 V140 N146 A147 I150 F187	L139-T143 HydrophobicContact CG-CG2 4.21Å; L139-T143 WeakPolarHBondContact O-CB 3.47Å; L139-T143 VanDerWaalsContact O-CG2 3.3Å; L139-T143 WeakPolarHBondContact O-CG2 3.2Å; L139-T143 PolarHBondContact O-N 3.42Å; L139-T143 PolarHBondContact O-OG1 3Å; V140-T143 WeakPolarHBondContact CA-OG1 3.4Å; V140-T143 PolarHBondContact O-OG1 3.48Å; V140-T143 VanDerWaalsContact O-OG1 3.11Å; T143-N146 CarbonylContact O-C 3.53Å; T143-N146 PolarHBondContact O-N 2.91Å; T143-A147 WeakPolarHBondContact O-CA 3.22Å; T143-A147 VanDerWaalsContact O-CB 3.24Å; T143-A147 WeakPolarHBondContact O-CB 3.45Å; T143-A147 PolarHBondContact O-N 3.13Å; T143-I150 HydrophobicContact CG2-CD1 4Å; T143-F187 HydrophobicContact CG2-CD2 4.41Å
144	G	38.4	Very low	37.9	Very low	52 Å²	52	81.3 Å²	81.3	54%	0.536	44%	0.437	S	S	.	.	H	α-helix	trans	-60.6	-51.2	170.7	0	0	0	0	0	112.6	V140 N146 A147	V140-G144 PolarHBondContact O-N 3.34Å; G144-N146 VanDerWaalsContact C-N 3.27Å; G144-N146 PolarHBondContact O-N 3.25Å; G144-A147 PolarHBondContact O-N 3.4Å
145	N	38.6	Very low	37.7	Very low	138 Å²	138	81.2 Å²	81.2	74%	0.738	43%	0.43	S	S	*	.	H	α-helix	trans	-65	-30.8	179.3	-73.6	-20.8	0	0	0	112.9	F141 Y142	F141-N145 VanDerWaalsContact O-CB 3.3Å; F141-N145 WeakPolarHBondContact O-CB 3.42Å; F141-N145 PolarHBondContact O-N 3.45Å; F141-N145 PolarHBondContact O-ND2 2.92Å; Y142-N145 PolarHBondContact O-N 3.02Å
146	N	33.9	Very low	37.2	Very low	24 Å²	24	78.7 Å²	78.7	13%	0.128	43%	0.434	C	S	.	.	H	α-helix	trans	-105	7.6	-178.4	-64.7	-74.5	0	0	0	113.3	Y142 T143 G144 S148 R149 I150	Y142-N146 VanDerWaalsContact CD2-ND2 3.26Å; Y142-N146 WeakPolarHBondContact CD2-ND2 3.24Å; Y142-N146 HydrophobicContact CE1-CB 4.26Å; Y142-N146 WeakPolarHBondContact CE2-ND2 3.44Å; Y142-N146 VanDerWaalsContact CZ-ND2 3.28Å; Y142-N146 VanDerWaalsContact O-CB 3.26Å; Y142-N146 WeakPolarHBondContact O-CB 3.42Å; Y142-N146 PolarHBondContact O-N 3.25Å; Y142-N146 PolarHBondContact O-ND2 2.93Å; T143-N146 CarbonylContact O-C 3.53Å; T143-N146 PolarHBondContact O-N 2.91Å; G144-N146 VanDerWaalsContact C-N 3.27Å; G144-N146 PolarHBondContact O-N 3.25Å; N146-S148 PolarHBondContact O-N 2.87Å; N146-R149 HydrophobicContact CB-CB 4.5Å; N146-R149 CarbonylContact O-C 3.57Å; N146-R149 WeakPolarHBondContact O-CA 3.23Å; N146-R149 WeakPolarHBondContact O-CB 3.18Å; N146-R149 PolarHBondContact O-N 2.73Å; N146-I150 HydrophobicContact CB-CD1 4.17Å; N146-I150 HydrophobicContact CB-CG1 4.28Å; N146-I150 PolarHBondContact O-N 2.88Å
147	A	40.6	Very low	36.9	Very low	50 Å²	50	78.5 Å²	78.5	41%	0.413	44%	0.435	S	S	.	.	H	α-helix	trans	-54.1	-39.1	-173.2	0	0	0	0	0	111.6	T143 G144 R151	T143-A147 WeakPolarHBondContact O-CA 3.22Å; T143-A147 VanDerWaalsContact O-CB 3.24Å; T143-A147 WeakPolarHBondContact O-CB 3.45Å; T143-A147 PolarHBondContact O-N 3.13Å; G144-A147 PolarHBondContact O-N 3.4Å; A147-R151 WeakPolarHBondContact O-CA 3.47Å; A147-R151 WeakPolarHBondContact O-CB 3.2Å; A147-R151 PolarHBondContact O-N 2.94Å
148	S	37.4	Very low	36.6	Very low	91 Å²	91	79 Å²	79	64%	0.636	45%	0.445	S	S	*	.	H	α-helix	trans	-68.5	-31.8	176.1	-66.4	0	0	0	0	113.9	N146 R152	N146-S148 PolarHBondContact O-N 2.87Å; S148-R152 VanDerWaalsContact O-CB 3.31Å; S148-R152 WeakPolarHBondContact O-CB 3.4Å; S148-R152 PolarHBondContact O-N 3.27Å
149	R	35.7	Very low	36.4	Very low	112 Å²	112	83.7 Å²	83.7	42%	0.423	46%	0.456	S	S	.	.	H	α-helix	trans	-77	-46.7	175.7	-65.9	-179.6	67	171.2	1.7	110.9	N146 R151 R152 A153 E180	N146-R149 HydrophobicContact CB-CB 4.5Å; N146-R149 CarbonylContact O-C 3.57Å; N146-R149 WeakPolarHBondContact O-CA 3.23Å; N146-R149 WeakPolarHBondContact O-CB 3.18Å; N146-R149 PolarHBondContact O-N 2.73Å; R149-R151 VanDerWaalsContact C-N 3.31Å; R149-R151 PolarHBondContact O-N 3.22Å; R149-R152 CarbonylContact O-C 3.46Å; R149-R152 WeakPolarHBondContact O-CA 3.41Å; R149-R152 WeakPolarHBondContact O-CB 3.3Å; R149-R152 PolarHBondContact O-N 3.11Å; R149-A153 PolarHBondContact O-N 2.75Å; R149-E180 IonicContact NH2-OE1 3.59Å
150	I	41	Very low	35.8	Very low	42 Å²	42	87.9 Å²	87.9	22%	0.215	48%	0.483	C	S	.	.	H	α-helix	trans	-57.8	-46.8	173.5	-63.9	169.4	0	0	0	109.6	T143 N146 R152 A153 L154	T143-I150 HydrophobicContact CG2-CD1 4Å; N146-I150 HydrophobicContact CB-CD1 4.17Å; N146-I150 HydrophobicContact CB-CG1 4.28Å; N146-I150 PolarHBondContact O-N 2.88Å; I150-R152 VanDerWaalsContact C-N 3.31Å; I150-R152 PolarHBondContact O-N 2.85Å; I150-A153 PolarHBondContact O-N 2.94Å; I150-L154 HydrophobicContact CG2-CD1 3.84Å; I150-L154 HydrophobicContact CG2-CG 4.33Å; I150-L154 WeakPolarHBondContact O-CB 3.33Å; I150-L154 WeakPolarHBondContact O-CG 3.39Å; I150-L154 PolarHBondContact O-N 3.46Å
151	R	36.8	Very low	35.1	Very low	113 Å²	113	91.8 Å²	91.8	43%	0.426	50%	0.495	S	S	.	.	H	α-helix	trans	-59.9	-39.6	173.8	-174.8	176.8	-177.5	-164	1.9	112	A147 R149 L155	A147-R151 WeakPolarHBondContact O-CA 3.47Å; A147-R151 WeakPolarHBondContact O-CB 3.2Å; A147-R151 PolarHBondContact O-N 2.94Å; R149-R151 VanDerWaalsContact C-N 3.31Å; R149-R151 PolarHBondContact O-N 3.22Å; R151-L155 HydrophobicContact CG-CD1 3.7Å; R151-L155 HydrophobicContact CG-CG 4.24Å; R151-L155 WeakPolarHBondContact O-CB 3.42Å; R151-L155 WeakPolarHBondContact O-CD1 3.46Å; R151-L155 WeakPolarHBondContact O-CG 2.99Å; R151-L155 PolarHBondContact O-N 3.3Å
152	R	33.5	Very low	34.5	Very low	135 Å²	135	90.7 Å²	90.7	51%	0.509	51%	0.505	S	S	.	.	H	α-helix	trans	-66.3	-41.2	176.8	-173.1	178	-65.5	147.7	3.9	112.3	S148 R149 I150 G156 V157	S148-R152 VanDerWaalsContact O-CB 3.31Å; S148-R152 WeakPolarHBondContact O-CB 3.4Å; S148-R152 PolarHBondContact O-N 3.27Å; R149-R152 CarbonylContact O-C 3.46Å; R149-R152 WeakPolarHBondContact O-CA 3.41Å; R149-R152 WeakPolarHBondContact O-CB 3.3Å; R149-R152 PolarHBondContact O-N 3.11Å; I150-R152 VanDerWaalsContact C-N 3.31Å; I150-R152 PolarHBondContact O-N 2.85Å; R152-G156 PolarHBondContact O-N 3.38Å; R152-V157 HydrophobicContact CG-CB 4.1Å; R152-V157 WeakPolarHBondContact CG-O 3.14Å; R152-V157 PolarHBondContact O-N 3.31Å; R152-V157 VanDerWaalsContact O-N 3.1Å
153	A	34.1	Very low	34.1	Very low	46 Å²	46	90.3 Å²	90.3	38%	0.38	53%	0.527	S	S	.	.	H	α-helix	trans	-65.5	-48.1	175.6	0	0	0	0	0	111.4	R149 I150 L155 G156	R149-A153 PolarHBondContact O-N 2.75Å; I150-A153 PolarHBondContact O-N 2.94Å; A153-L155 VanDerWaalsContact C-N 3.31Å; A153-L155 PolarHBondContact O-N 3.16Å; A153-G156 PolarHBondContact O-N 2.78Å
154	L	35.8	Very low	33.9	Very low	56 Å²	56	94.6 Å²	94.6	29%	0.293	56%	0.555	S	S	.	*	H	α-helix	trans	-63	-34.3	176.1	-72.5	174	0	0	0	113.1	V43 V47 I150 G156 L184	V43-L154 HydrophobicContact CG1-CB 3.98Å; V43-L154 HydrophobicContact CG1-CD2 4.19Å; V47-L154 HydrophobicContact CG2-CD1 3.69Å; I150-L154 HydrophobicContact CG2-CD1 3.84Å; I150-L154 HydrophobicContact CG2-CG 4.33Å; I150-L154 WeakPolarHBondContact O-CB 3.33Å; I150-L154 WeakPolarHBondContact O-CG 3.39Å; I150-L154 PolarHBondContact O-N 3.46Å; L154-G156 PolarHBondContact O-N 3.26Å; L154-L184 HydrophobicContact CD2-CD2 4.17Å
155	L	34.5	Very low	33.6	Very low	76 Å²	76	96.8 Å²	96.8	40%	0.398	56%	0.563	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.1	-1.4	175.8	-71.2	174.9	0	0	0	113.5	Q44 R151 A153 V157	Q44-L155 HydrophobicContact CB-CD2 4.32Å; R151-L155 HydrophobicContact CG-CD1 3.7Å; R151-L155 HydrophobicContact CG-CG 4.24Å; R151-L155 WeakPolarHBondContact O-CB 3.42Å; R151-L155 WeakPolarHBondContact O-CD1 3.46Å; R151-L155 WeakPolarHBondContact O-CG 2.99Å; R151-L155 PolarHBondContact O-N 3.3Å; A153-L155 VanDerWaalsContact C-N 3.31Å; A153-L155 PolarHBondContact O-N 3.16Å; L155-V157 HydrophobicContact CB-CG2 3.89Å; L155-V157 PolarHBondContact O-N 2.91Å; L155-V157 VanDerWaalsContact O-N 3.12Å
156	G	29.9	Very low	33.6	Very low	58 Å²	58	97.8 Å²	97.8	60%	0.598	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	61.4	18.5	-177.9	0	0	0	0	0	113.9	R152 A153 L154 V158	R152-G156 PolarHBondContact O-N 3.38Å; A153-G156 PolarHBondContact O-N 2.78Å; L154-G156 PolarHBondContact O-N 3.26Å; G156-V158 PolarHBondContact O-N 3.05Å
157	V	31.6	Very low	34.3	Very low	75 Å²	75	104 Å²	104	46%	0.455	60%	0.6	S	S	.	*			trans	-83.2	70.5	-179.3	-171.9	0	0	0	0	108.9	R152 L155 K159	R152-V157 HydrophobicContact CG-CB 4.1Å; R152-V157 WeakPolarHBondContact CG-O 3.14Å; R152-V157 PolarHBondContact O-N 3.31Å; R152-V157 VanDerWaalsContact O-N 3.1Å; L155-V157 HydrophobicContact CB-CG2 3.89Å; L155-V157 PolarHBondContact O-N 2.91Å; L155-V157 VanDerWaalsContact O-N 3.12Å; V157-K159 PolarHBondContact O-N 3.48Å
158	V	32.4	Very low	34.5	Very low	119 Å²	119	108.8 Å²	108.8	72%	0.721	62%	0.618	S	S	*	*			trans	-68.2	112.4	153.4	-177.7	0	0	0	0	105.1	G156 T160	G156-V158 PolarHBondContact O-N 3.05Å; V158-T160 HydrophobicContact CG1-CG2 4.33Å; V158-T160 PolarHBondContact O-N 3.38Å
159	K	32.3	Very low	34.8	Very low	181 Å²	181	107.8 Å²	107.8	79%	0.787	61%	0.611	S	S	*	*			trans	-65.1	91	168.4	-80.6	-171.6	173.5	-173.9	0	107.9	V157 E161	V157-K159 PolarHBondContact O-N 3.48Å; K159-E161 VanDerWaalsContact C-N 3.31Å; K159-E161 PolarHBondContact O-N 3.15Å; K159-E161 VanDerWaalsContact O-N 3.16Å
160	T	30	Very low	35.2	Very low	120 Å²	120	110.7 Å²	110.7	74%	0.736	63%	0.627	S	S	*	*			trans	-77.1	89.5	158.6	54.2	0	0	0	0	106.8	V158	V158-T160 HydrophobicContact CG1-CG2 4.33Å; V158-T160 PolarHBondContact O-N 3.38Å
161	E	27.9	Very low	35.6	Very low	177 Å²	177	115 Å²	115	83%	0.827	65%	0.651	S	S	*	*			trans	-161	87.7	153.1	-110.1	169.6	-146.4	0	0	110.5	K159	K159-E161 VanDerWaalsContact C-N 3.31Å; K159-E161 PolarHBondContact O-N 3.15Å; K159-E161 VanDerWaalsContact O-N 3.16Å
162	S	25.9	Very low	35.9	Very low	120 Å²	120	117.1 Å²	117.1	84%	0.839	66%	0.663	S	S	*	*				63.7	75.9	121.4	-43.6	0	0	0	0	118.1
163	G	26.8	Very low	36.6	Very low	77 Å²	77	115.9 Å²	115.9	79%	0.794	66%	0.663	S	S	*	*				109.1	167.5	124.5	0	0	0	0	0	118.9
164	P	34.7	Very low	37.4	Very low	124 Å²	124	117.9 Å²	117.9	81%	0.805	67%	0.665	S	S	*	*			cis	-111	159.2	-8.7	37.9	-25.3	0	0	0	114.1
165	S	33.2	Very low	38.1	Very low	99 Å²	99	120 Å²	120	69%	0.692	67%	0.673	S	S	*	*			trans	-28.6	145.7	165.7	54.9	0	0	0	0	117.9
166	I	37.7	Very low	38.7	Very low	159 Å²	159	120.7 Å²	120.7	82%	0.815	67%	0.674	S	S	*	*				-179.8	101.6	109	-78.2	146.6	0	0	0	109.2	D168	I166-D168 PolarHBondContact O-N 3.11Å
167	D	48.4	Very low	39.6	Very low	155 Å²	155	121.6 Å²	121.6	83%	0.829	67%	0.665	S	S	*	*	S	Bend	trans	61.3	24.2	138.5	-98.8	1.7	0	0	0	125.6
168	D	44	Very low	40.7	Very low	150 Å²	150	123.2 Å²	123.2	80%	0.802	67%	0.667	S	S	*	*	S	Bend	trans	-144.4	14.6	164.7	-87.8	-37.9	0	0	0	115	I166	I166-D168 PolarHBondContact O-N 3.11Å
169	S	44.7	Very low	41.5	Very low	70 Å²	70	122.2 Å²	122.2	49%	0.49	66%	0.655	S	S	.	*			trans	-91.2	-14.1	-169.7	62.6	0	0	0	0	116.5	D171 F172 E173	S169-D171 VanDerWaalsContact C-N 3.33Å; S169-D171 PolarHBondContact O-N 2.84Å; S169-F172 PolarHBondContact O-N 3.17Å; S169-E173 PolarHBondContact O-N 2.93Å
170	F	43.2	Very low	42.1	Very low	172 Å²	172	116.7 Å²	116.7	75%	0.754	63%	0.632	S	S	*	*	H	α-helix	trans	-67.9	-32.2	-169.9	-153.1	-93.8	0	0	0	112.9	Q174	F170-Q174 PolarHBondContact O-N 3.29Å
171	D	49.8	Very low	43	Very low	133 Å²	133	117 Å²	117	71%	0.711	63%	0.625	S	S	*	*	H	α-helix	trans	-75.8	-35.6	-179.4	-143.8	12.2	0	0	0	111.8	S169 Q175	S169-D171 VanDerWaalsContact C-N 3.33Å; S169-D171 PolarHBondContact O-N 2.84Å; D171-Q175 WeakPolarHBondContact O-CB 2.97Å; D171-Q175 PolarHBondContact O-N 3.46Å; D171-Q175 VanDerWaalsContact O-N 3.13Å
172	F	44	Very low	44.1	Very low	157 Å²	157	114 Å²	114	69%	0.689	61%	0.611	S	S	*	*	H	α-helix	trans	-71.1	-35.5	176.6	-84.1	-77.8	0	0	0	113	S169 Q176	S169-F172 PolarHBondContact O-N 3.17Å; F172-Q176 WeakPolarHBondContact O-CB 2.88Å; F172-Q176 PolarHBondContact O-N 3.16Å
173	E	48.6	Very low	45.1	Very low	110 Å²	110	110.4 Å²	110.4	51%	0.514	58%	0.582	S	S	.	*	H	α-helix	trans	-69.1	-44.6	178.9	-76.2	179.9	175.5	0	0	111.4	S169 Q176 I177	S169-E173 PolarHBondContact O-N 2.93Å; E173-Q176 PolarHBondContact O-N 2.83Å; E173-I177 VanDerWaalsContact O-CG1 3.29Å; E173-I177 WeakPolarHBondContact O-CG1 3.08Å; E173-I177 PolarHBondContact O-N 3.08Å
174	Q	50.4	Low	46.1	Very low	88 Å²	88	110.1 Å²	110.1	41%	0.411	56%	0.562	S	S	.	*	H	α-helix	trans	-66.2	-44.7	178	-173.3	63.4	32.2	0	0	111.9	F170 Q176 I177 E178	F170-Q174 PolarHBondContact O-N 3.29Å; Q174-Q176 VanDerWaalsContact C-N 3.26Å; Q174-Q176 PolarHBondContact O-N 3.18Å; Q174-I177 PolarHBondContact O-N 2.65Å; Q174-E178 PolarHBondContact NE2-OE1 2.84Å; Q174-E178 VanDerWaalsContact NE2-OE1 3.11Å; Q174-E178 PolarHBondContact O-N 3.03Å
175	Q	50.6	Low	46.8	Very low	100 Å²	100	106 Å²	106	47%	0.467	54%	0.541	S	S	.	.	H	α-helix	trans	-61.6	-37.3	176.5	-172	179.4	-2.5	0	0	111.7	D171 E179	D171-Q175 WeakPolarHBondContact O-CB 2.97Å; D171-Q175 PolarHBondContact O-N 3.46Å; D171-Q175 VanDerWaalsContact O-N 3.13Å; Q175-E179 PolarHBondContact NE2-OE1 2.97Å; Q175-E179 WeakPolarHBondContact O-CB 3.09Å; Q175-E179 WeakPolarHBondContact O-CG 3.19Å; Q175-E179 PolarHBondContact O-N 3.06Å
176	Q	46.4	Very low	47.4	Very low	90 Å²	90	105.8 Å²	105.8	42%	0.421	53%	0.528	S	S	.	.	H	α-helix	trans	-66.9	-39.4	176.5	179	159.7	92.2	0	0	112.2	F172 E173 Q174 E180	F172-Q176 WeakPolarHBondContact O-CB 2.88Å; F172-Q176 PolarHBondContact O-N 3.16Å; E173-Q176 PolarHBondContact O-N 2.83Å; Q174-Q176 VanDerWaalsContact C-N 3.26Å; Q174-Q176 PolarHBondContact O-N 3.18Å; Q176-E180 HydrophobicContact CG-CG 4.45Å; Q176-E180 WeakPolarHBondContact CG-OE1 3.08Å; Q176-E180 VanDerWaalsContact O-CB 3.27Å; Q176-E180 WeakPolarHBondContact O-CB 3.05Å; Q176-E180 WeakPolarHBondContact O-CG 3.4Å; Q176-E180 PolarHBondContact O-N 3.23Å
177	I	49.8	Very low	47.9	Very low	77 Å²	77	101.3 Å²	101.3	40%	0.395	50%	0.503	S	S	.	.	H	α-helix	trans	-64.9	-45.2	176.5	-68.2	163.9	0	0	0	110.6	E173 Q174 E180 E181	E173-I177 VanDerWaalsContact O-CG1 3.29Å; E173-I177 WeakPolarHBondContact O-CG1 3.08Å; E173-I177 PolarHBondContact O-N 3.08Å; Q174-I177 PolarHBondContact O-N 2.65Å; I177-E180 CarbonylContact O-C 3.6Å; I177-E180 PolarHBondContact O-N 3.13Å; I177-E180 VanDerWaalsContact O-N 3.15Å; I177-E181 HydrophobicContact CG2-CG 4.46Å; I177-E181 WeakPolarHBondContact O-CG 3.31Å; I177-E181 PolarHBondContact O-N 3.01Å
178	E	53.8	Low	47.9	Very low	110 Å²	110	96.7 Å²	96.7	51%	0.514	48%	0.483	S	S	.	.	H	α-helix	trans	-64.1	-43.3	178.9	-73.2	173	-163.7	0	0	112.3	Q174 E180 E181 E182	Q174-E178 PolarHBondContact NE2-OE1 2.84Å; Q174-E178 VanDerWaalsContact NE2-OE1 3.11Å; Q174-E178 PolarHBondContact O-N 3.03Å; E178-E180 VanDerWaalsContact C-N 3.29Å; E178-E180 PolarHBondContact O-N 3.19Å; E178-E181 PolarHBondContact O-N 3.48Å; E178-E182 WeakPolarHBondContact O-CB 3.29Å; E178-E182 PolarHBondContact O-N 3.25Å
179	E	49	Very low	48.1	Very low	98 Å²	98	92.6 Å²	92.6	46%	0.458	46%	0.463	S	S	.	.	H	α-helix	trans	-60.3	-41	172.4	-75.7	178.8	-169.3	0	0	111	Q175 L183	Q175-E179 PolarHBondContact NE2-OE1 2.97Å; Q175-E179 WeakPolarHBondContact O-CB 3.09Å; Q175-E179 WeakPolarHBondContact O-CG 3.19Å; Q175-E179 PolarHBondContact O-N 3.06Å; E179-L183 WeakPolarHBondContact O-CB 3.21Å; E179-L183 VanDerWaalsContact O-CD1 3.24Å; E179-L183 WeakPolarHBondContact O-CD1 3.14Å; E179-L183 WeakPolarHBondContact O-CG 3.47Å; E179-L183 PolarHBondContact O-N 2.65Å
180	E	45.4	Very low	48.1	Very low	64 Å²	64	91 Å²	91	30%	0.299	45%	0.448	S	S	.	.	H	α-helix	trans	-67.3	-39.7	178.7	-76.3	176.9	-175.3	0	0	112.7	R149 Q176 I177 E178 L183 L184	R149-E180 IonicContact NH2-OE1 3.59Å; Q176-E180 HydrophobicContact CG-CG 4.45Å; Q176-E180 WeakPolarHBondContact CG-OE1 3.08Å; Q176-E180 VanDerWaalsContact O-CB 3.27Å; Q176-E180 WeakPolarHBondContact O-CB 3.05Å; Q176-E180 WeakPolarHBondContact O-CG 3.4Å; Q176-E180 PolarHBondContact O-N 3.23Å; I177-E180 CarbonylContact O-C 3.6Å; I177-E180 PolarHBondContact O-N 3.13Å; I177-E180 VanDerWaalsContact O-N 3.15Å; E178-E180 VanDerWaalsContact C-N 3.29Å; E178-E180 PolarHBondContact O-N 3.19Å; E180-L183 PolarHBondContact O-N 3.27Å; E180-L184 WeakPolarHBondContact O-CG 3.37Å; E180-L184 PolarHBondContact O-N 3.31Å
181	E	48.6	Very low	48.3	Very low	128 Å²	128	86.3 Å²	86.3	60%	0.598	43%	0.431	S	S	*	.	H	α-helix	trans	-66.6	-44.1	174.5	-74.4	-175.5	171.2	0	0	112.2	I177 E178 L183 L184 G185	I177-E181 HydrophobicContact CG2-CG 4.46Å; I177-E181 WeakPolarHBondContact O-CG 3.31Å; I177-E181 PolarHBondContact O-N 3.01Å; E178-E181 PolarHBondContact O-N 3.48Å; E181-L183 PolarHBondContact O-N 3.49Å; E181-L184 PolarHBondContact O-N 2.94Å; E181-G185 PolarHBondContact O-N 2.91Å
182	E	51.1	Low	48.2	Very low	114 Å²	114	84.7 Å²	84.7	53%	0.533	42%	0.419	S	S	.	.	H	α-helix	trans	-59.5	-39.2	175.3	-165.5	-165.7	155.5	0	0	110.7	E178 G185 K186	E178-E182 WeakPolarHBondContact O-CB 3.29Å; E178-E182 PolarHBondContact O-N 3.25Å; E182-G185 PolarHBondContact O-N 3.33Å; E182-K186 WeakPolarHBondContact O-CG 3.26Å; E182-K186 PolarHBondContact O-N 3.38Å; E182-K186 WeakPolarHBondContact OE1-CE 3.3Å; E182-K186 IonicContact OE1-NZ 2.91Å; E182-K186 PolarHBondContact OE1-NZ 2.83Å
183	L	47	Very low	48.2	Very low	43 Å²	43	79.5 Å²	79.5	23%	0.225	40%	0.397	C	S	.	.	H	α-helix	trans	-71.4	-38.7	178.5	-72.3	166.1	0	0	0	112.9	Y142 E179 E180 E181 G185 K186 F187	Y142-L183 HydrophobicContact CE1-CD1 3.9Å; Y142-L183 HydrophobicContact CE1-CD2 3.94Å; Y142-L183 WeakPolarHBondContact OH-CD1 3.42Å; E179-L183 WeakPolarHBondContact O-CB 3.21Å; E179-L183 VanDerWaalsContact O-CD1 3.24Å; E179-L183 WeakPolarHBondContact O-CD1 3.14Å; E179-L183 WeakPolarHBondContact O-CG 3.47Å; E179-L183 PolarHBondContact O-N 2.65Å; E180-L183 PolarHBondContact O-N 3.27Å; E181-L183 PolarHBondContact O-N 3.49Å; L183-G185 VanDerWaalsContact C-N 3.3Å; L183-K186 HydrophobicContact CD2-CD 4.43Å; L183-K186 PolarHBondContact O-N 3.04Å; L183-F187 WeakPolarHBondContact O-CB 3.44Å; L183-F187 PolarHBondContact O-N 2.84Å
184	L	48.1	Very low	47.9	Very low	71 Å²	71	78.3 Å²	78.3	37%	0.372	39%	0.394	S	S	.	.	H	α-helix	trans	-62.6	-40	171.6	-75.5	171	0	0	0	111	L154 E180 E181 K186 F187 S188	L154-L184 HydrophobicContact CD2-CD2 4.17Å; E180-L184 WeakPolarHBondContact O-CG 3.37Å; E180-L184 PolarHBondContact O-N 3.31Å; E181-L184 PolarHBondContact O-N 2.94Å; L184-K186 PolarHBondContact O-N 2.97Å; L184-F187 PolarHBondContact O-N 3.34Å; L184-S188 WeakPolarHBondContact O-CB 3.36Å; L184-S188 PolarHBondContact O-N 3.27Å
185	G	48.8	Very low	47.6	Very low	37 Å²	37	80.6 Å²	80.6	38%	0.381	40%	0.399	S	S	.	.	H	α-helix	trans	-58.2	-44.9	171.8	0	0	0	0	0	112.5	E181 E182 L183 T189	E181-G185 PolarHBondContact O-N 2.91Å; E182-G185 PolarHBondContact O-N 3.33Å; L183-G185 VanDerWaalsContact C-N 3.3Å; G185-T189 WeakPolarHBondContact O-CB 3.24Å; G185-T189 PolarHBondContact O-N 3.45Å; G185-T189 PolarHBondContact O-OG1 3.28Å
186	K	46.6	Very low	47.3	Very low	96 Å²	96	78.7 Å²	78.7	42%	0.417	39%	0.389	S	S	.	.	H	α-helix	trans	-63.9	-41.8	175	-72.2	169.7	-174.6	165	0	112.3	E182 L183 L184 T189 M190	E182-K186 WeakPolarHBondContact O-CG 3.26Å; E182-K186 PolarHBondContact O-N 3.38Å; E182-K186 WeakPolarHBondContact OE1-CE 3.3Å; E182-K186 IonicContact OE1-NZ 2.91Å; E182-K186 PolarHBondContact OE1-NZ 2.83Å; L183-K186 HydrophobicContact CD2-CD 4.43Å; L183-K186 PolarHBondContact O-N 3.04Å; L184-K186 PolarHBondContact O-N 2.97Å; K186-T189 PolarHBondContact O-N 2.73Å; K186-M190 PolarHBondContact O-N 3.26Å
187	F	46.8	Very low	47	Very low	64 Å²	64	79.6 Å²	79.6	28%	0.281	40%	0.397	S	S	.	.	H	α-helix	trans	-66.9	-42.4	178.3	-174.1	-103.7	0	0	0	112.3	T143 L183 L184 T189 M190 L191	T143-F187 HydrophobicContact CG2-CD2 4.41Å; L183-F187 WeakPolarHBondContact O-CB 3.44Å; L183-F187 PolarHBondContact O-N 2.84Å; L184-F187 PolarHBondContact O-N 3.34Å; F187-T189 VanDerWaalsContact C-N 3.34Å; F187-T189 PolarHBondContact O-N 2.82Å; F187-M190 WeakPolarHBondContact O-CB 3.5Å; F187-M190 PolarHBondContact O-N 3.43Å; F187-M190 VanDerWaalsContact O-N 3.16Å; F187-L191 HydrophobicContact CD1-CD1 3.98Å; F187-L191 HydrophobicContact CD1-CG 4.37Å; F187-L191 HydrophobicContact CE1-CD1 3.49Å; F187-L191 VanDerWaalsContact CE1-CD1 3.49Å; F187-L191 HydrophobicContact CE1-CG 3.97Å; F187-L191 HydrophobicContact CZ-CD1 4.11Å; F187-L191 HydrophobicContact CZ-CD2 4.39Å; F187-L191 HydrophobicContact CZ-CG 4.2Å; F187-L191 PolarHBondContact O-N 3.29Å
188	S	48.5	Very low	46.5	Very low	59 Å²	59	79 Å²	79	41%	0.413	40%	0.403	S	S	.	.	H	α-helix	trans	-59	-46.2	173.1	-178.2	0	0	0	0	111.3	L184 M190 L191 Q192	L184-S188 WeakPolarHBondContact O-CB 3.36Å; L184-S188 PolarHBondContact O-N 3.27Å; S188-M190 VanDerWaalsContact C-N 3.28Å; S188-M190 PolarHBondContact O-N 2.79Å; S188-L191 PolarHBondContact O-N 3.35Å; S188-Q192 WeakPolarHBondContact O-CG 3.35Å; S188-Q192 PolarHBondContact O-N 3.37Å
189	T	48.4	Very low	45.9	Very low	63 Å²	63	77.6 Å²	77.6	39%	0.387	40%	0.402	S	S	.	.	H	α-helix	trans	-59.2	-40	175	-54	0	0	0	0	111.5	G185 K186 F187 Q192 H193	G185-T189 WeakPolarHBondContact O-CB 3.24Å; G185-T189 PolarHBondContact O-N 3.45Å; G185-T189 PolarHBondContact O-OG1 3.28Å; K186-T189 PolarHBondContact O-N 2.73Å; F187-T189 VanDerWaalsContact C-N 3.34Å; F187-T189 PolarHBondContact O-N 2.82Å; T189-Q192 WeakPolarHBondContact O-CB 3.07Å; T189-Q192 PolarHBondContact O-N 2.94Å; T189-H193 PolarHBondContact O-CD2 3Å; T189-H193 PolarHBondContact O-N 2.82Å
190	M	45.6	Very low	45.4	Very low	36 Å²	36	76.3 Å²	76.3	18%	0.177	40%	0.4	C	S	.	.	H	α-helix	trans	-66.5	-44.4	175.9	173.8	176.2	-77.7	0	0	113	L136 L139 K186 F187 S188 Q192 H193 L194	L136-M190 HydrophobicContact CD2-CE 3.57Å; L139-M190 HydrophobicContact CB-CE 4.15Å; L139-M190 HydrophobicContact CD2-CE 3.12Å; L139-M190 HydrophobicContact CD2-SD 3.67Å; L139-M190 HydrophobicContact CG-CE 4.19Å; K186-M190 PolarHBondContact O-N 3.26Å; F187-M190 WeakPolarHBondContact O-CB 3.5Å; F187-M190 PolarHBondContact O-N 3.43Å; F187-M190 VanDerWaalsContact O-N 3.16Å; S188-M190 VanDerWaalsContact C-N 3.28Å; S188-M190 PolarHBondContact O-N 2.79Å; M190-Q192 PolarHBondContact O-N 2.71Å; M190-H193 CarbonylContact O-C 3.59Å; M190-H193 WeakPolarHBondContact O-CA 3.26Å; M190-H193 WeakPolarHBondContact O-CB 3.24Å; M190-H193 PolarHBondContact O-N 2.49Å; M190-L194 HydrophobicContact CG-CD1 4.18Å; M190-L194 HydrophobicContact CG-CG 4.45Å; M190-L194 PolarHBondContact O-N 3.41Å
191	L	46.2	Very low	44.9	Very low	75 Å²	75	75.4 Å²	75.4	39%	0.393	40%	0.404	S	S	.	.	H	α-helix	trans	-60.2	-39.7	175.8	-77.6	176.8	0	0	0	110.7	F187 S188 H193 L194 R195	F187-L191 HydrophobicContact CD1-CD1 3.98Å; F187-L191 HydrophobicContact CD1-CG 4.37Å; F187-L191 HydrophobicContact CE1-CD1 3.49Å; F187-L191 VanDerWaalsContact CE1-CD1 3.49Å; F187-L191 HydrophobicContact CE1-CG 3.97Å; F187-L191 HydrophobicContact CZ-CD1 4.11Å; F187-L191 HydrophobicContact CZ-CD2 4.39Å; F187-L191 HydrophobicContact CZ-CG 4.2Å; F187-L191 PolarHBondContact O-N 3.29Å; S188-L191 PolarHBondContact O-N 3.35Å; L191-H193 VanDerWaalsContact C-N 3.32Å; L191-H193 PolarHBondContact O-N 3.29Å; L191-L194 PolarHBondContact O-N 3.39Å; L191-R195 VanDerWaalsContact O-CB 3.31Å; L191-R195 WeakPolarHBondContact O-CB 3.48Å; L191-R195 PolarHBondContact O-N 2.84Å
192	Q	48.2	Very low	44.2	Very low	99 Å²	99	70.5 Å²	70.5	46%	0.463	39%	0.388	S	S	.	.	H	α-helix	trans	-61.9	-38.5	171.6	-68.2	175.5	0.4	0	0	112	S188 T189 M190 K196	S188-Q192 WeakPolarHBondContact O-CG 3.35Å; S188-Q192 PolarHBondContact O-N 3.37Å; T189-Q192 WeakPolarHBondContact O-CB 3.07Å; T189-Q192 PolarHBondContact O-N 2.94Å; M190-Q192 PolarHBondContact O-N 2.71Å; Q192-K196 WeakPolarHBondContact O-CB 3.45Å; Q192-K196 VanDerWaalsContact O-CG 3.28Å; Q192-K196 WeakPolarHBondContact O-CG 3.37Å; Q192-K196 PolarHBondContact O-N 3.05Å
193	H	43.8	Very low	43.6	Very low	48 Å²	48	70.3 Å²	70.3	22%	0.222	39%	0.387	C	S	.	.	H	α-helix	trans	-68.5	-41.2	175.4	-76.7	-156	0	0	0	112.8	T129 T189 M190 L191 K196 N197	T129-H193 PolarHBondContact O-CE1 2.82Å; T129-H193 VanDerWaalsContact O-CE1 3.28Å; T189-H193 PolarHBondContact O-CD2 3Å; T189-H193 PolarHBondContact O-N 2.82Å; M190-H193 CarbonylContact O-C 3.59Å; M190-H193 WeakPolarHBondContact O-CA 3.26Å; M190-H193 WeakPolarHBondContact O-CB 3.24Å; M190-H193 PolarHBondContact O-N 2.49Å; L191-H193 VanDerWaalsContact C-N 3.32Å; L191-H193 PolarHBondContact O-N 3.29Å; H193-K196 WeakPolarHBondContact O-CB 3.12Å; H193-K196 PolarHBondContact O-N 2.58Å; H193-N197 WeakPolarHBondContact O-CB 3.44Å; H193-N197 PolarHBondContact O-N 3.45Å
194	L	43.7	Very low	42.9	Very low	85 Å²	85	72.5 Å²	72.5	45%	0.445	40%	0.398	S	S	.	.	H	α-helix	trans	-63.3	-42.7	173.9	-76.6	169.2	0	0	0	110.8	M190 L191 K196 N197 A198	M190-L194 HydrophobicContact CG-CD1 4.18Å; M190-L194 HydrophobicContact CG-CG 4.45Å; M190-L194 PolarHBondContact O-N 3.41Å; L191-L194 PolarHBondContact O-N 3.39Å; L194-K196 VanDerWaalsContact C-N 3.33Å; L194-K196 PolarHBondContact O-N 2.98Å; L194-N197 PolarHBondContact O-N 3.43Å; L194-A198 VanDerWaalsContact O-CB 3.31Å; L194-A198 WeakPolarHBondContact O-CB 3.1Å; L194-A198 PolarHBondContact O-N 2.79Å
195	R	44.1	Very low	42	Very low	135 Å²	135	74.2 Å²	74.2	51%	0.509	41%	0.407	S	S	.	.	H	α-helix	trans	-57.2	-46.5	172.7	-168.8	-179	-170	-157.8	-0.7	111.1	E88 L191 A198 V199	E88-R195 IonicContact OE1-CZ 3.65Å; E88-R195 IonicContact OE1-NE 2.94Å; E88-R195 PolarHBondContact OE1-NE 3.15Å; E88-R195 IonicContact OE1-NH2 3.79Å; E88-R195 IonicContact OE2-CZ 3.36Å; E88-R195 IonicContact OE2-NE 3.35Å; E88-R195 PolarHBondContact OE2-NE 2.95Å; E88-R195 IonicContact OE2-NH2 2.72Å; E88-R195 PolarHBondContact OE2-NH2 3.01Å; L191-R195 VanDerWaalsContact O-CB 3.31Å; L191-R195 WeakPolarHBondContact O-CB 3.48Å; L191-R195 PolarHBondContact O-N 2.84Å; R195-A198 PolarHBondContact O-N 3.44Å; R195-V199 WeakPolarHBondContact O-CB 3.27Å; R195-V199 VanDerWaalsContact O-CG2 3.24Å; R195-V199 WeakPolarHBondContact O-CG2 2.98Å; R195-V199 PolarHBondContact O-N 3.39Å
196	K	43.1	Very low	41.5	Very low	61 Å²	61	81 Å²	81	27%	0.265	42%	0.421	S	S	.	.	H	α-helix	trans	-62	-45.9	175.6	-76.7	165.7	166.2	-176.1	0	112.1	T126 Q192 H193 L194 A198 V199 V200	T126-K196 HydrophobicContact CG2-CD 3.72Å; T126-K196 HydrophobicContact CG2-CG 4.36Å; T126-K196 VanDerWaalsContact OG1-CE 3.24Å; T126-K196 WeakPolarHBondContact OG1-CE 3.34Å; T126-K196 PolarHBondContact OG1-NZ 3.15Å; Q192-K196 WeakPolarHBondContact O-CB 3.45Å; Q192-K196 VanDerWaalsContact O-CG 3.28Å; Q192-K196 WeakPolarHBondContact O-CG 3.37Å; Q192-K196 PolarHBondContact O-N 3.05Å; H193-K196 WeakPolarHBondContact O-CB 3.12Å; H193-K196 PolarHBondContact O-N 2.58Å; L194-K196 VanDerWaalsContact C-N 3.33Å; L194-K196 PolarHBondContact O-N 2.98Å; K196-A198 PolarHBondContact O-N 2.87Å; K196-V199 PolarHBondContact O-N 2.84Å; K196-V200 WeakPolarHBondContact O-CB 3.15Å; K196-V200 VanDerWaalsContact O-CG2 3.26Å; K196-V200 WeakPolarHBondContact O-CG2 3.33Å; K196-V200 PolarHBondContact O-N 2.86Å
197	N	41.2	Very low	41.2	Very low	109 Å²	109	82.6 Å²	82.6	58%	0.583	43%	0.43	S	S	*	.	H	α-helix	trans	-65.5	-38.1	178.3	-73.2	-14.9	0	0	0	112.3	H193 L194 V200 A201	H193-N197 WeakPolarHBondContact O-CB 3.44Å; H193-N197 PolarHBondContact O-N 3.45Å; L194-N197 PolarHBondContact O-N 3.43Å; N197-V200 PolarHBondContact O-N 2.78Å; N197-A201 WeakPolarHBondContact O-CB 3.39Å; N197-A201 PolarHBondContact O-N 3.04Å
198	A	39	Very low	40.5	Very low	65 Å²	65	84.1 Å²	84.1	54%	0.537	44%	0.441	S	S	.	.	H	α-helix	trans	-68.5	-39.6	175.9	0	0	0	0	0	111.8	L194 R195 K196 G202	L194-A198 VanDerWaalsContact O-CB 3.31Å; L194-A198 WeakPolarHBondContact O-CB 3.1Å; L194-A198 PolarHBondContact O-N 2.79Å; R195-A198 PolarHBondContact O-N 3.44Å; K196-A198 PolarHBondContact O-N 2.87Å; A198-G202 PolarHBondContact O-N 3.06Å
199	V	40.9	Very low	39.9	Very low	79 Å²	79	84.6 Å²	84.6	48%	0.479	44%	0.442	S	S	.	.	H	α-helix	trans	-63.4	-48.5	172.7	170.4	0	0	0	0	110.3	R195 K196 A201 G202 E203	R195-V199 WeakPolarHBondContact O-CB 3.27Å; R195-V199 VanDerWaalsContact O-CG2 3.24Å; R195-V199 WeakPolarHBondContact O-CG2 2.98Å; R195-V199 PolarHBondContact O-N 3.39Å; K196-V199 PolarHBondContact O-N 2.84Å; V199-A201 PolarHBondContact O-N 3.26Å; V199-G202 CarbonylContact O-C 3.49Å; V199-G202 WeakPolarHBondContact O-CA 3.48Å; V199-G202 PolarHBondContact O-N 2.83Å; V199-G202 VanDerWaalsContact O-N 3.12Å; V199-E203 HydrophobicContact CG1-CG 4.47Å; V199-E203 WeakPolarHBondContact O-CG 3.43Å; V199-E203 PolarHBondContact O-N 3.02Å
200	V	38	Very low	39.3	Very low	71 Å²	71	89 Å²	89	43%	0.43	46%	0.456	S	S	.	.	H	α-helix	trans	-61.2	-44.3	177	170.4	0	0	0	0	111.2	K196 N197 G202 E203 I204	K196-V200 WeakPolarHBondContact O-CB 3.15Å; K196-V200 VanDerWaalsContact O-CG2 3.26Å; K196-V200 WeakPolarHBondContact O-CG2 3.33Å; K196-V200 PolarHBondContact O-N 2.86Å; N197-V200 PolarHBondContact O-N 2.78Å; V200-G202 VanDerWaalsContact C-N 3.3Å; V200-G202 PolarHBondContact O-N 3.42Å; V200-E203 PolarHBondContact O-N 3.04Å; V200-I204 HydrophobicContact CG1-CD1 3.79Å; V200-I204 HydrophobicContact CG1-CG1 4.39Å; V200-I204 WeakPolarHBondContact O-CB 3.38Å; V200-I204 VanDerWaalsContact O-CG1 3.25Å; V200-I204 WeakPolarHBondContact O-CG1 3.31Å; V200-I204 PolarHBondContact O-N 3.37Å
201	A	35.8	Very low	38.9	Very low	46 Å²	46	92 Å²	92	38%	0.38	48%	0.475	S	S	.	.	H	α-helix	trans	-61.2	-41.4	174.2	0	0	0	0	0	111.2	N197 V199 I204 L205	N197-A201 WeakPolarHBondContact O-CB 3.39Å; N197-A201 PolarHBondContact O-N 3.04Å; V199-A201 PolarHBondContact O-N 3.26Å; A201-I204 PolarHBondContact O-N 2.91Å; A201-L205 WeakPolarHBondContact O-CB 3.4Å; A201-L205 WeakPolarHBondContact O-CG 3.01Å; A201-L205 PolarHBondContact O-N 2.82Å
202	G	32.4	Very low	38.4	Very low	24 Å²	24	95.8 Å²	95.8	25%	0.247	49%	0.491	C	S	.	.	H	α-helix	trans	-64.1	-36.5	174.2	0	0	0	0	0	113.5	A198 V199 V200 R206	A198-G202 PolarHBondContact O-N 3.06Å; V199-G202 CarbonylContact O-C 3.49Å; V199-G202 WeakPolarHBondContact O-CA 3.48Å; V199-G202 PolarHBondContact O-N 2.83Å; V199-G202 VanDerWaalsContact O-N 3.12Å; V200-G202 VanDerWaalsContact C-N 3.3Å; V200-G202 PolarHBondContact O-N 3.42Å; G202-R206 WeakPolarHBondContact O-CB 3.49Å; G202-R206 VanDerWaalsContact O-CG 3.27Å; G202-R206 WeakPolarHBondContact O-CG 3.48Å; G202-R206 PolarHBondContact O-N 2.98Å
203	E	39.3	Very low	37.8	Very low	110 Å²	110	99.5 Å²	99.5	51%	0.514	51%	0.506	S	S	.	.	H	α-helix	trans	-69.7	-46	174.5	-75.1	-176.1	160.4	0	0	111.5	V199 V200 L205 R206 E207	V199-E203 HydrophobicContact CG1-CG 4.47Å; V199-E203 WeakPolarHBondContact O-CG 3.43Å; V199-E203 PolarHBondContact O-N 3.02Å; V200-E203 PolarHBondContact O-N 3.04Å; E203-L205 VanDerWaalsContact C-N 3.32Å; E203-L205 PolarHBondContact O-N 2.55Å; E203-R206 CarbonylContact O-C 3.57Å; E203-R206 WeakPolarHBondContact O-CB 3.46Å; E203-R206 PolarHBondContact O-N 3.29Å; E203-R206 VanDerWaalsContact O-N 3.09Å; E203-E207 WeakPolarHBondContact O-CG 3.17Å; E203-E207 PolarHBondContact O-N 3.29Å
204	I	32.4	Very low	37.5	Very low	89 Å²	89	101.2 Å²	101.2	46%	0.456	53%	0.528	S	S	.	.	H	α-helix	trans	-57.5	-46.3	173.8	-67.6	165.7	0	0	0	110.1	V200 A201 R206 E207 D208	V200-I204 HydrophobicContact CG1-CD1 3.79Å; V200-I204 HydrophobicContact CG1-CG1 4.39Å; V200-I204 WeakPolarHBondContact O-CB 3.38Å; V200-I204 VanDerWaalsContact O-CG1 3.25Å; V200-I204 WeakPolarHBondContact O-CG1 3.31Å; V200-I204 PolarHBondContact O-N 3.37Å; A201-I204 PolarHBondContact O-N 2.91Å; I204-R206 VanDerWaalsContact C-N 3.31Å; I204-R206 PolarHBondContact O-N 3.1Å; I204-E207 PolarHBondContact O-N 3.11Å; I204-D208 WeakPolarHBondContact O-CB 3.35Å; I204-D208 PolarHBondContact O-N 3.35Å
205	L	30.1	Very low	37.3	Very low	108 Å²	108	105.4 Å²	105.4	57%	0.565	56%	0.563	S	S	*	*	H	α-helix	trans	-63.6	-35	177	-72	170.3	0	0	0	112.4	A201 E203 T209	A201-L205 WeakPolarHBondContact O-CB 3.4Å; A201-L205 WeakPolarHBondContact O-CG 3.01Å; A201-L205 PolarHBondContact O-N 2.82Å; E203-L205 VanDerWaalsContact C-N 3.32Å; E203-L205 PolarHBondContact O-N 2.55Å; L205-T209 PolarHBondContact O-N 3.18Å; L205-T209 PolarHBondContact O-OG1 3.03Å
206	R	38.7	Very low	37	Very low	180 Å²	180	104 Å²	104	68%	0.679	57%	0.565	S	S	*	*	H	α-helix	trans	-70.6	-36.6	173.7	-78.2	-179.8	-146	-168.5	6.8	112.5	G202 E203 I204 T209 K210	G202-R206 WeakPolarHBondContact O-CB 3.49Å; G202-R206 VanDerWaalsContact O-CG 3.27Å; G202-R206 WeakPolarHBondContact O-CG 3.48Å; G202-R206 PolarHBondContact O-N 2.98Å; E203-R206 CarbonylContact O-C 3.57Å; E203-R206 WeakPolarHBondContact O-CB 3.46Å; E203-R206 PolarHBondContact O-N 3.29Å; E203-R206 VanDerWaalsContact O-N 3.09Å; I204-R206 VanDerWaalsContact C-N 3.31Å; I204-R206 PolarHBondContact O-N 3.1Å; R206-T209 VanDerWaalsContact CA-OG1 3.3Å; R206-T209 WeakPolarHBondContact CA-OG1 3.42Å; R206-T209 PolarHBondContact O-OG1 3.43Å; R206-K210 WeakPolarHBondContact O-CG 3.22Å; R206-K210 PolarHBondContact O-N 2.9Å
207	E	39.3	Very low	36.6	Very low	128 Å²	128	106.2 Å²	106.2	60%	0.598	58%	0.581	S	S	*	*	H	α-helix	trans	-69.1	-44.7	175.2	-73.3	-170.1	163.1	0	0	111.1	E203 I204 T209 K210 V211	E203-E207 WeakPolarHBondContact O-CG 3.17Å; E203-E207 PolarHBondContact O-N 3.29Å; I204-E207 PolarHBondContact O-N 3.11Å; E207-T209 VanDerWaalsContact C-N 3.29Å; E207-T209 PolarHBondContact O-N 3.05Å; E207-K210 WeakPolarHBondContact O-CB 3.09Å; E207-K210 PolarHBondContact O-N 3.34Å; E207-V211 WeakPolarHBondContact O-CG2 3.2Å; E207-V211 PolarHBondContact O-N 3.12Å
208	D	32.7	Very low	36.4	Very low	96 Å²	96	106.1 Å²	106.1	51%	0.513	58%	0.581	S	S	.	*	H	α-helix	trans	-61	-37.6	174.7	-82.9	-12.8	0	0	0	112	I204 V211 H212	I204-D208 WeakPolarHBondContact O-CB 3.35Å; I204-D208 PolarHBondContact O-N 3.35Å; D208-V211 PolarHBondContact O-N 3.35Å; D208-H212 PolarHBondContact O-N 3.13Å; D208-H212 VanDerWaalsContact O-N 3.08Å
209	T	35.3	Very low	36.2	Very low	70 Å²	70	108.5 Å²	108.5	43%	0.429	58%	0.584	S	S	.	*	H	α-helix	trans	-68.2	-37	172.9	24.1	0	0	0	0	112.5	L205 R206 E207 V211 H212 F213	L205-T209 PolarHBondContact O-N 3.18Å; L205-T209 PolarHBondContact O-OG1 3.03Å; R206-T209 VanDerWaalsContact CA-OG1 3.3Å; R206-T209 WeakPolarHBondContact CA-OG1 3.42Å; R206-T209 PolarHBondContact O-OG1 3.43Å; E207-T209 VanDerWaalsContact C-N 3.29Å; E207-T209 PolarHBondContact O-N 3.05Å; T209-V211 VanDerWaalsContact C-N 3.31Å; T209-V211 PolarHBondContact O-N 3.38Å; T209-H212 PolarHBondContact O-N 2.8Å; T209-F213 WeakPolarHBondContact O-CD2 3.29Å; T209-F213 PolarHBondContact O-N 3.16Å
210	K	36.2	Very low	35.9	Very low	156 Å²	156	110.3 Å²	110.3	68%	0.678	59%	0.59	S	S	*	*	H	α-helix	trans	-62.9	-37.4	173.4	-77.6	176.4	-177.9	174.2	0	112.2	R206 E207 H212 F213 A214	R206-K210 WeakPolarHBondContact O-CG 3.22Å; R206-K210 PolarHBondContact O-N 2.9Å; E207-K210 WeakPolarHBondContact O-CB 3.09Å; E207-K210 PolarHBondContact O-N 3.34Å; K210-H212 VanDerWaalsContact C-N 3.31Å; K210-F213 PolarHBondContact O-N 3.29Å; K210-A214 PolarHBondContact O-N 3.39Å
211	V	36.9	Very low	35.8	Very low	98 Å²	98	112.9 Å²	112.9	59%	0.594	60%	0.601	S	S	*	*	H	α-helix	trans	-67	-35.5	176.1	179.7	0	0	0	0	110.9	E207 D208 T209 F213 A214	E207-V211 WeakPolarHBondContact O-CG2 3.2Å; E207-V211 PolarHBondContact O-N 3.12Å; D208-V211 PolarHBondContact O-N 3.35Å; T209-V211 VanDerWaalsContact C-N 3.31Å; T209-V211 PolarHBondContact O-N 3.38Å; V211-F213 PolarHBondContact O-N 3.36Å; V211-A214 PolarHBondContact O-N 3.18Å
212	H	35.2	Very low	35.8	Very low	155 Å²	155	117.7 Å²	117.7	72%	0.718	62%	0.617	S	S	*	*	H	α-helix	trans	-71.9	-23.3	178.1	-104.2	-52.9	0	0	0	115.2	D208 T209 K210	D208-H212 PolarHBondContact O-N 3.13Å; D208-H212 VanDerWaalsContact O-N 3.08Å; T209-H212 PolarHBondContact O-N 2.8Å; K210-H212 VanDerWaalsContact C-N 3.31Å
213	F	36.5	Very low	36.1	Very low	177 Å²	177	124.9 Å²	124.9	78%	0.776	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.7	-0.7	175.2	-72	-71.6	0	0	0	114	T209 K210 V211	T209-F213 WeakPolarHBondContact O-CD2 3.29Å; T209-F213 PolarHBondContact O-N 3.16Å; K210-F213 PolarHBondContact O-N 3.29Å; V211-F213 PolarHBondContact O-N 3.36Å
214	A	37.2	Very low	35.8	Very low	84 Å²	84	126.2 Å²	126.2	69%	0.694	66%	0.656	S	S	*	*			trans	-100.4	1.9	178.5	0	0	0	0	0	114.3	K210 V211	K210-A214 PolarHBondContact O-N 3.39Å; V211-A214 PolarHBondContact O-N 3.18Å
215	C	39.1	Very low	36.1	Very low	173 Å²	173	129.5 Å²	129.5	100%	1.169	67%	0.674	S	S	*	*			trans	-110.9	0	171.9	-67.8	0	0	0	0	110.8

Retrieved 215 of 215 residues in 40.8 ms (Link to these results)

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