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Histone deacetylase complex subunit SAP30 homolog

Component of the class 1 Sin3A-histone deacetylase (HDAC1/Rpd3) complex (HDAC). Appears to be a non-essential subunit of this complex which is not required for cell cycle regulation of progression through the G2 phase of the cell cycle.

AlphaFold DB (Q9VXB3), UniProt , Accession X2JKS9, Species DROME (Drosophila melanogaster, Fruit fly), Gene Sap30, Length 173 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	57.2	Low	50	Low	239 Å²	239	146.2 Å²	146.2	100%	1.177	82%	0.822	S	S	*	*				0	118.9	0	-72.2	76.8	171.1	0	0	107.9
2	N	47.3	Very low	50.2	Low	152 Å²	152	144 Å²	144	81%	0.813	82%	0.823	S	S	*	*			trans	-79.2	166.9	-177.8	-77.2	2.3	0	0	0	112.5
3	N	56.6	Low	50.5	Low	160 Å²	160	147.9 Å²	147.9	86%	0.856	82%	0.817	S	S	*	*			trans	122.7	100.1	149.7	-67.8	36.1	0	0	0	110.8
4	G	49	Very low	50.7	Low	73 Å²	73	139.8 Å²	139.8	75%	0.753	78%	0.783	S	S	*	*			cis	100.5	75.2	36.1	0	0	0	0	0	108.5	S6	G4-S6 PolarHBondContact O-N 3.26Å
5	F	45.5	Very low	51.3	Low	201 Å²	201	137.1 Å²	137.1	88%	0.882	76%	0.762	S	S	*	*			trans	-85.7	81.7	178.3	-151.3	-90.2	0	0	0	108.5	T7	F5-T7 HydrophobicContact CD1-CG2 4.27Å; F5-T7 HydrophobicContact CE1-CG2 4.32Å
6	S	51.4	Low	52.2	Low	118 Å²	118	133.6 Å²	133.6	83%	0.825	75%	0.745	S	S	*	*			trans	-85.2	109.7	167.8	-69.8	0	0	0	0	108.3	G4 G8	G4-S6 PolarHBondContact O-N 3.26Å; S6-G8 PolarHBondContact O-N 3.05Å
7	T	53.9	Low	53.6	Low	122 Å²	122	133.6 Å²	133.6	75%	0.748	74%	0.744	S	S	*	*			trans	-63.5	100.1	168.4	46.3	0	0	0	0	108.8	F5 E9	F5-T7 HydrophobicContact CD1-CG2 4.27Å; F5-T7 HydrophobicContact CE1-CG2 4.32Å; T7-E9 PolarHBondContact O-N 3.21Å
8	G	47.5	Very low	55.5	Low	64 Å²	64	129.2 Å²	129.2	66%	0.66	72%	0.716	S	S	*	*			trans	-64.9	113.3	173.8	0	0	0	0	0	111.3	S6	S6-G8 PolarHBondContact O-N 3.05Å
9	E	51	Low	57.4	Low	170 Å²	170	125.2 Å²	125.2	79%	0.794	70%	0.696	S	S	*	*				50.9	91.5	120.9	-59.6	175.5	145.8	0	0	116.6	T7	T7-E9 PolarHBondContact O-N 3.21Å
10	E	42.5	Very low	59.3	Low	178 Å²	178	119 Å²	119	83%	0.832	66%	0.661	S	S	*	*				46.3	83.8	116.1	-57.1	179.1	132	0	0	118.2
11	D	48.6	Very low	61	Low	131 Å²	131	113.5 Å²	113.5	70%	0.701	63%	0.631	S	S	*	*			trans	-125.3	44	160.7	-124	-10.3	0	0	0	112.1	R13	D11-R13 PolarHBondContact O-N 3.26Å
12	S	52.3	Low	62.9	Low	120 Å²	120	102.1 Å²	102.1	84%	0.839	58%	0.575	S	S	*	*			trans	-82.6	29.7	169.8	-63.4	0	0	0	0	112.6	G14	S12-G14 VanDerWaalsContact C-N 3.3Å; S12-G14 PolarHBondContact O-N 3.35Å
13	R	53.6	Low	65.1	Low	195 Å²	195	96.5 Å²	96.5	74%	0.736	54%	0.544	S	S	*	.			trans	-67.5	95.2	174.2	-68.8	-176.5	-176.2	164.5	5.1	108.2	D11	D11-R13 PolarHBondContact O-N 3.26Å
14	G	53.4	Low	66.8	Low	34 Å²	34	90.4 Å²	90.4	35%	0.351	51%	0.512	S	S	.	.			trans	-48.2	155.4	-178.4	0	0	0	0	0	111.9	S12 T16 D17	S12-G14 VanDerWaalsContact C-N 3.3Å; S12-G14 PolarHBondContact O-N 3.35Å; G14-T16 PolarHBondContact O-N 3.49Å; G14-D17 PolarHBondContact O-N 2.69Å
15	H	59.2	Low	68.6	Low	100 Å²	100	90.7 Å²	90.7	46%	0.463	50%	0.496	S	S	.	.	G	3₁₀ helix	trans	-50.1	-14.6	-178.9	-33.1	-71.6	0	0	0	114.2	D17	H15-D17 PolarHBondContact O-N 2.76Å
16	T	65.8	Low	70.5	Confident	80 Å²	80	89.9 Å²	89.9	49%	0.491	50%	0.497	S	S	.	.	G	3₁₀ helix	trans	-69.5	-26.4	-174.4	55.2	0	0	0	0	113.8	G14 Q32	G14-T16 PolarHBondContact O-N 3.49Å; T16-Q32 WeakPolarHBondContact O-CG 3.15Å; T16-Q32 PolarHBondContact O-NE2 3.42Å
17	D	77.2	Confident	72.5	Confident	135 Å²	135	91.4 Å²	91.4	72%	0.722	49%	0.491	S	S	*	.	G	3₁₀ helix	trans	-106.6	8.1	-174.1	-64.9	-4.9	0	0	0	113.6	G14 H15	G14-D17 PolarHBondContact O-N 2.69Å; H15-D17 PolarHBondContact O-N 2.76Å
18	Q	86.5	Confident	74.3	Confident	54 Å²	54	91.3 Å²	91.3	25%	0.252	48%	0.477	S	S	.	.			trans	-86.3	137.9	-178.9	-65.5	-174.9	6.7	0	0	111	A33 H61	Q18-A33 HydrophobicContact CB-CB 4.18Å; Q18-A33 VanDerWaalsContact O-CB 3.29Å; Q18-A33 WeakPolarHBondContact O-CB 3.48Å; Q18-A33 PolarHBondContact O-N 3.49Å; Q18-H61 PolarHBondContact OE1-CD2 2.88Å; Q18-H61 PolarHBondContact OE1-ND1 3.23Å
19	T	92.5	Very high	76.5	Confident	53 Å²	53	89 Å²	89	33%	0.325	45%	0.45	S	S	.	.	B	Isolated β-bridge	trans	-95.3	137.9	177.4	-56.3	0	0	0	0	110.1	C21 C29 H61	T19-C21 PolarHBondContact O-N 2.93Å; T19-C29 WeakPolarHBondContact CG2-O 3.29Å; T19-H61 PolarHBondContact O-CE1 2.87Å; T19-H61 PolarHBondContact O-NE2 3.38Å
20	C	94.8	Very high	78.5	Confident	0 Å²	0	91.9 Å²	91.9	0%	0	45%	0.454	C	S	.	.			trans	-40.3	128.6	-179.3	178.3	0	0	0	0	114.1	L22 C29 N31 C65 H68	C20-L22 PolarHBondContact O-N 2.83Å; C20-C29 HydrophobicContact CB-CB 3.84Å; C20-N31 WeakPolarHBondContact CB-O 3.43Å; C20-N31 PolarHBondContact N-O 3.25Å; C20-C65 HydrophobicContact CB-CB 3.92Å; C20-C65 PolarHBondContact SG-N 3.16Å; C20-C65 VanDerWaalsContact SG-N 3.42Å; C20-H68 PolarHBondContact SG-ND1 2.95Å
21	C	95.5	Very high	80.9	Confident	4 Å²	4	87.1 Å²	87.1	3%	0.027	44%	0.435	C	S	.	.	S	Bend	trans	-75.7	13.7	-174.7	76.8	0	0	0	0	115	T19 D56 A59 H61 Y63	T19-C21 PolarHBondContact O-N 2.93Å; C21-D56 PolarHBondContact O-N 3.44Å; C21-A59 HydrophobicContact CB-CB 3.77Å; C21-H61 WeakPolarHBondContact CB-O 3.37Å; C21-Y63 WeakPolarHBondContact CB-O 3.11Å; C21-Y63 PolarHBondContact N-O 3.19Å; C21-Y63 PolarHBondContact SG-O 3.14Å; C21-Y63 VanDerWaalsContact SG-O 3.33Å
22	L	96.1	Very high	83.1	Confident	0 Å²	0	87 Å²	87	0%	0	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	143.6	-171.7	-67	178.3	0	0	0	111.9	C20 C29 Y38 L53 S54 I64 H68 I72	C20-L22 PolarHBondContact O-N 2.83Å; L22-C29 WeakPolarHBondContact O-CB 3.47Å; L22-C29 PolarHBondContact O-N 3.43Å; L22-Y38 HydrophobicContact CD1-CD2 4.33Å; L22-Y38 HydrophobicContact CD2-CD1 4.01Å; L22-Y38 HydrophobicContact CD2-CD2 3.63Å; L22-Y38 HydrophobicContact CD2-CE1 4.12Å; L22-Y38 HydrophobicContact CD2-CE2 3.75Å; L22-Y38 HydrophobicContact CD2-CG 3.76Å; L22-Y38 HydrophobicContact CG-CD2 4.49Å; L22-L53 HydrophobicContact CD1-CD1 4.49Å; L22-L53 HydrophobicContact CD1-CD2 4.5Å; L22-S54 CarbonylContact C-O 3.58Å; L22-S54 WeakPolarHBondContact CA-O 3.4Å; L22-S54 WeakPolarHBondContact CD2-O 3.41Å; L22-I64 HydrophobicContact CD1-CB 4.16Å; L22-I64 HydrophobicContact CD1-CG2 3.61Å; L22-I64 HydrophobicContact CD2-CG2 4.46Å; L22-I64 HydrophobicContact CG-CG2 3.79Å; L22-H68 HydrophobicContact CD1-CB 3.75Å; L22-I72 HydrophobicContact CD1-CD1 4.4Å
23	I	95	Very high	85	Confident	34 Å²	34	81.7 Å²	81.7	17%	0.174	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	123.9	166	-58.3	174.4	0	0	0	106.8	M26 E27 L53 S54 D56	I23-M26 VanDerWaalsContact CG2-C 3.47Å; I23-E27 CarbonylContact C-O 3.52Å; I23-E27 VanDerWaalsContact CA-O 3.3Å; I23-E27 WeakPolarHBondContact CA-O 3.34Å; I23-L53 WeakPolarHBondContact O-CA 3.13Å; I23-S54 PolarHBondContact N-O 2.95Å; I23-S54 PolarHBondContact O-N 3.34Å; I23-D56 HydrophobicContact CD1-CB 4.1Å; I23-D56 HydrophobicContact CG1-CB 3.91Å
24	D	91.6	Very high	86.8	Confident	33 Å²	33	73.1 Å²	73.1	18%	0.176	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	123.3	177	-167.5	7.2	0	0	0	109.1	M26 E27 L53 H68 R71	D24-M26 PolarHBondContact O-N 2.84Å; D24-M26 VanDerWaalsContact O-N 3.13Å; D24-E27 PolarHBondContact N-O 2.9Å; D24-E27 PolarHBondContact O-N 2.82Å; D24-L53 HydrophobicContact CB-CD2 3.78Å; D24-H68 IonicContact OD2-NE2 3.41Å; D24-H68 PolarHBondContact OD2-NE2 3.09Å; D24-R71 IonicContact OD1-CZ 2.9Å; D24-R71 IonicContact OD1-NH1 2.66Å; D24-R71 PolarHBondContact OD1-NH1 3.25Å; D24-R71 IonicContact OD1-NH2 3.43Å; D24-R71 PolarHBondContact OD1-NH2 3.28Å; D24-R71 IonicContact OD2-CZ 2.73Å; D24-R71 IonicContact OD2-NH1 2.65Å; D24-R71 PolarHBondContact OD2-NH1 2.99Å; D24-R71 IonicContact OD2-NH2 2.92Å
25	D	87.2	Confident	88.6	Confident	78 Å²	78	80.5 Å²	80.5	42%	0.417	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.7	37	179.7	-91.7	-57.9	0	0	0	114	E27 K52	D25-E27 VanDerWaalsContact C-N 3.26Å; D25-E27 PolarHBondContact O-N 2.76Å; D25-K52 PolarHBondContact N-O 2.88Å; D25-K52 VanDerWaalsContact N-O 3.15Å; D25-K52 WeakPolarHBondContact OD1-CD 3.3Å; D25-K52 WeakPolarHBondContact OD1-CE 3.08Å; D25-K52 IonicContact OD1-NZ 3.59Å; D25-K52 PolarHBondContact OD1-NZ 3.44Å
26	M	85.9	Confident	90.2	Very high	184 Å²	184	77.1 Å²	77.1	91%	0.906	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.2	4	-175.7	-49.1	-178.1	-66.9	0	0	115.6	I23 D24	I23-M26 VanDerWaalsContact CG2-C 3.47Å; D24-M26 PolarHBondContact O-N 2.84Å; D24-M26 VanDerWaalsContact O-N 3.13Å
27	E	91.9	Very high	91.6	Very high	151 Å²	151	75.7 Å²	75.7	71%	0.706	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.3	132.6	173.4	-63.2	-162.3	156.6	0	0	111.9	I23 D24 D25 C29	I23-E27 CarbonylContact C-O 3.52Å; I23-E27 VanDerWaalsContact CA-O 3.3Å; I23-E27 WeakPolarHBondContact CA-O 3.34Å; D24-E27 PolarHBondContact N-O 2.9Å; D24-E27 PolarHBondContact O-N 2.82Å; D25-E27 VanDerWaalsContact C-N 3.26Å; D25-E27 PolarHBondContact O-N 2.76Å; E27-C29 PolarHBondContact O-N 3.21Å
28	R	92.8	Very high	92.4	Very high	120 Å²	120	70.3 Å²	70.3	45%	0.453	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	125.6	174.5	-176	178.3	176.8	163.7	4	109.7	R30 D56	R28-R30 PolarHBondContact O-N 3.48Å; R28-D56 WeakPolarHBondContact CD-OD2 3.18Å; R28-D56 IonicContact CZ-OD2 2.97Å; R28-D56 IonicContact NE-OD2 2.93Å; R28-D56 PolarHBondContact NE-OD2 2.94Å; R28-D56 IonicContact NH1-OD2 3.19Å; R28-D56 PolarHBondContact NH1-OD2 2.94Å; R28-D56 IonicContact NH2-OD2 3.6Å
29	C	93.7	Very high	92.7	Very high	14 Å²	14	70 Å²	70	10%	0.095	34%	0.34	C	S	.	.			trans	-60.2	135.4	175.8	-168	0	0	0	0	110.6	T19 C20 L22 E27 H68	T19-C29 WeakPolarHBondContact CG2-O 3.29Å; C20-C29 HydrophobicContact CB-CB 3.84Å; L22-C29 WeakPolarHBondContact O-CB 3.47Å; L22-C29 PolarHBondContact O-N 3.43Å; E27-C29 PolarHBondContact O-N 3.21Å; C29-H68 PolarHBondContact SG-CE1 3.41Å
30	R	93.4	Very high	92.7	Very high	232 Å²	232	75.6 Å²	75.6	88%	0.875	36%	0.36	S	S	*	.			trans	-105.2	0.7	178.2	-60.6	-175	-176.3	178.9	1.5	113.7	R28	R28-R30 PolarHBondContact O-N 3.48Å
31	N	92.9	Very high	92.6	Very high	78 Å²	78	84.1 Å²	84.1	42%	0.417	39%	0.392	S	S	.	.	S	Bend	trans	-74.9	147.4	179.7	-65.9	-17.7	0	0	0	111	C20 A33 C65	C20-N31 WeakPolarHBondContact CB-O 3.43Å; C20-N31 PolarHBondContact N-O 3.25Å; N31-A33 PolarHBondContact O-N 3.49Å; N31-C65 HydrophobicContact CB-CB 3.61Å
32	Q	93.3	Very high	92.4	Very high	128 Å²	128	85 Å²	85	60%	0.598	40%	0.396	S	S	*	.	B	Isolated β-bridge	trans	-58.4	134.9	174	-168.2	177.9	-2.9	0	0	110.9	T16 C65	T16-Q32 WeakPolarHBondContact O-CG 3.15Å; T16-Q32 PolarHBondContact O-NE2 3.42Å; Q32-C65 WeakPolarHBondContact O-CA 3.3Å; Q32-C65 WeakPolarHBondContact O-CB 3.29Å
33	A	93.4	Very high	92.2	Very high	8 Å²	8	89.8 Å²	89.8	7%	0.066	42%	0.419	C	S	.	.	P	Polyproline II helix	trans	-73.2	135.4	176.6	0	0	0	0	0	110	Q18 N31	Q18-A33 HydrophobicContact CB-CB 4.18Å; Q18-A33 VanDerWaalsContact O-CB 3.29Å; Q18-A33 WeakPolarHBondContact O-CB 3.48Å; Q18-A33 PolarHBondContact O-N 3.49Å; N31-A33 PolarHBondContact O-N 3.49Å
34	G	91.2	Very high	92	Very high	16 Å²	16	95.7 Å²	95.7	17%	0.165	44%	0.443	C	S	.	.			trans	-93.8	-161.3	169.2	0	0	0	0	0	111.4	A36 Y63 I64	G34-A36 VanDerWaalsContact C-N 3.34Å; G34-Y63 WeakPolarHBondContact O-CB 3.42Å; G34-I64 PolarHBondContact N-O 3.33Å
35	Y	91	Very high	91.9	Very high	189 Å²	189	94.8 Å²	94.8	74%	0.741	44%	0.439	S	S	*	.	S	Bend	trans	-81.4	-11.1	179.3	-62.1	-82	0	0	0	114.3
36	A	93.3	Very high	92.1	Very high	29 Å²	29	91.4 Å²	91.4	24%	0.24	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	137.3	-179.9	0	0	0	0	0	110.4	G34 Y63 I64 K69	G34-A36 VanDerWaalsContact C-N 3.34Å; A36-Y63 CarbonylContact O-C 3.58Å; A36-Y63 WeakPolarHBondContact O-CA 3.46Å; A36-I64 HydrophobicContact CB-CD1 4.05Å; A36-I64 HydrophobicContact CB-CG1 3.65Å; A36-I64 WeakPolarHBondContact O-CG1 3.38Å; A36-I64 PolarHBondContact O-N 2.8Å; A36-K69 HydrophobicContact CB-CB 4.24Å; A36-K69 HydrophobicContact CB-CD 4.09Å; A36-K69 HydrophobicContact CB-CG 4.13Å
37	S	94.2	Very high	92.3	Very high	50 Å²	50	86 Å²	86	35%	0.35	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	141.7	-178.9	62.5	0	0	0	0	113	S39 I62	S37-S39 PolarHBondContact O-N 2.91Å; S37-I62 CarbonylContact C-O 3.57Å; S37-I62 WeakPolarHBondContact CA-O 3.18Å
38	Y	94.7	Very high	92.1	Very high	22 Å²	22	84.9 Å²	84.9	9%	0.086	40%	0.4	C	S	.	.			trans	-77.3	64.2	171.4	-163.5	-112.7	0	0	0	111.2	L22 I42 Q43 V46 I62 I64	L22-Y38 HydrophobicContact CD1-CD2 4.33Å; L22-Y38 HydrophobicContact CD2-CD1 4.01Å; L22-Y38 HydrophobicContact CD2-CD2 3.63Å; L22-Y38 HydrophobicContact CD2-CE1 4.12Å; L22-Y38 HydrophobicContact CD2-CE2 3.75Å; L22-Y38 HydrophobicContact CD2-CG 3.76Å; L22-Y38 HydrophobicContact CG-CD2 4.49Å; Y38-I42 HydrophobicContact CD2-CB 4.18Å; Y38-I42 HydrophobicContact CD2-CG2 3.47Å; Y38-I42 VanDerWaalsContact CD2-CG2 3.47Å; Y38-I42 HydrophobicContact CE2-CB 4.44Å; Y38-I42 HydrophobicContact CE2-CG2 3.59Å; Y38-Q43 HydrophobicContact CE1-CB 4.1Å; Y38-Q43 HydrophobicContact CE1-CG 4.19Å; Y38-V46 HydrophobicContact CE2-CG2 3.81Å; Y38-I62 PolarHBondContact N-O 2.98Å; Y38-I64 HydrophobicContact CD2-CG2 4.46Å
39	S	93.4	Very high	91.9	Very high	46 Å²	46	81.1 Å²	81.1	32%	0.322	39%	0.387	S	S	.	.			trans	-68.6	164.3	179.1	66.3	0	0	0	0	112.9	S37 R41 I42 Q43	S37-S39 PolarHBondContact O-N 2.91Å; S39-R41 PolarHBondContact O-N 3.1Å; S39-I42 WeakPolarHBondContact O-CA 3.39Å; S39-I42 WeakPolarHBondContact O-CB 3.36Å; S39-I42 PolarHBondContact O-N 3.44Å; S39-Q43 PolarHBondContact O-N 3.31Å
40	K	92.7	Very high	91.6	Very high	172 Å²	172	91.3 Å²	91.3	75%	0.748	42%	0.424	S	S	*	.	H	α-helix	trans	-50.2	-32.1	172.6	-67.4	-178.2	179.9	176.9	0	113.2	K44	K40-K44 WeakPolarHBondContact O-CG 3.34Å; K40-K44 PolarHBondContact O-N 3Å
41	R	90.9	Very high	91.3	Very high	178 Å²	178	81.8 Å²	81.8	67%	0.672	39%	0.39	S	S	*	.	H	α-helix	trans	-68.3	-40	176	-176	-179	-179.3	-168.1	1.6	112	S39 T45	S39-R41 PolarHBondContact O-N 3.1Å; R41-T45 PolarHBondContact O-N 3.24Å; R41-T45 PolarHBondContact O-OG1 2.91Å
42	I	91.7	Very high	91.3	Very high	23 Å²	23	84.7 Å²	84.7	12%	0.118	40%	0.399	C	S	.	.	H	α-helix	trans	-70	-43.8	175.6	-61.1	-56.1	0	0	0	110	Y38 S39 K44 T45 V46 I72	Y38-I42 HydrophobicContact CD2-CB 4.18Å; Y38-I42 HydrophobicContact CD2-CG2 3.47Å; Y38-I42 VanDerWaalsContact CD2-CG2 3.47Å; Y38-I42 HydrophobicContact CE2-CB 4.44Å; Y38-I42 HydrophobicContact CE2-CG2 3.59Å; S39-I42 WeakPolarHBondContact O-CA 3.39Å; S39-I42 WeakPolarHBondContact O-CB 3.36Å; S39-I42 PolarHBondContact O-N 3.44Å; I42-K44 VanDerWaalsContact C-N 3.32Å; I42-K44 PolarHBondContact O-N 3.4Å; I42-T45 CarbonylContact O-C 3.58Å; I42-T45 WeakPolarHBondContact O-CA 3.4Å; I42-T45 VanDerWaalsContact O-CB 3.29Å; I42-T45 WeakPolarHBondContact O-CB 2.82Å; I42-T45 PolarHBondContact O-N 3.18Å; I42-V46 HydrophobicContact CG2-CG2 4.34Å; I42-V46 PolarHBondContact O-N 2.9Å; I42-I72 HydrophobicContact CD1-CG2 4.15Å; I42-I72 HydrophobicContact CG2-CD1 3.72Å; I42-I72 HydrophobicContact CG2-CG1 4.43Å; I42-I72 HydrophobicContact CG2-CG2 3.94Å
43	Q	93	Very high	91.2	Very high	100 Å²	100	79.1 Å²	79.1	47%	0.467	37%	0.373	S	S	.	.	H	α-helix	trans	-55	-45	174.8	-169	-177.3	14	0	0	112.3	Y38 S39 T45 V46 A47	Y38-Q43 HydrophobicContact CE1-CB 4.1Å; Y38-Q43 HydrophobicContact CE1-CG 4.19Å; S39-Q43 PolarHBondContact O-N 3.31Å; Q43-T45 VanDerWaalsContact C-N 3.3Å; Q43-T45 PolarHBondContact O-N 3.46Å; Q43-V46 PolarHBondContact O-N 2.65Å; Q43-A47 WeakPolarHBondContact O-CB 3.34Å; Q43-A47 PolarHBondContact O-N 3.41Å
44	K	91	Very high	91.2	Very high	159 Å²	159	81.4 Å²	81.4	69%	0.691	39%	0.389	S	S	*	.	H	α-helix	trans	-59.3	-39.6	172.5	-75.4	-180	-179.1	-173.9	0	112.7	K40 I42 Q48	K40-K44 WeakPolarHBondContact O-CG 3.34Å; K40-K44 PolarHBondContact O-N 3Å; I42-K44 VanDerWaalsContact C-N 3.32Å; I42-K44 PolarHBondContact O-N 3.4Å; K44-Q48 WeakPolarHBondContact O-CB 3.5Å; K44-Q48 PolarHBondContact O-N 3.44Å
45	T	88	Confident	91.3	Very high	14 Å²	14	83.6 Å²	83.6	9%	0.086	40%	0.401	C	S	.	.	H	α-helix	trans	-66.9	-46.4	179.2	-56.2	0	0	0	0	110.8	R41 I42 Q43 Q48 K49 R76	R41-T45 PolarHBondContact O-N 3.24Å; R41-T45 PolarHBondContact O-OG1 2.91Å; I42-T45 CarbonylContact O-C 3.58Å; I42-T45 WeakPolarHBondContact O-CA 3.4Å; I42-T45 VanDerWaalsContact O-CB 3.29Å; I42-T45 WeakPolarHBondContact O-CB 2.82Å; I42-T45 PolarHBondContact O-N 3.18Å; Q43-T45 VanDerWaalsContact C-N 3.3Å; Q43-T45 PolarHBondContact O-N 3.46Å; T45-Q48 PolarHBondContact O-N 3.22Å; T45-K49 HydrophobicContact CG2-CG 4.35Å; T45-K49 VanDerWaalsContact O-CB 3.23Å; T45-K49 WeakPolarHBondContact O-CB 3.26Å; T45-K49 WeakPolarHBondContact O-CG 3.45Å; T45-K49 PolarHBondContact O-N 2.82Å; T45-R76 HydrophobicContact CG2-CG 3.59Å
46	V	91	Very high	91.4	Very high	6 Å²	6	75.5 Å²	75.5	4%	0.036	37%	0.371	C	S	.	.	H	α-helix	trans	-57.4	-49.5	176.2	165.3	0	0	0	0	110.8	Y38 I42 Q43 K49 R50 L51 L53 I72	Y38-V46 HydrophobicContact CE2-CG2 3.81Å; I42-V46 HydrophobicContact CG2-CG2 4.34Å; I42-V46 PolarHBondContact O-N 2.9Å; Q43-V46 PolarHBondContact O-N 2.65Å; V46-K49 CarbonylContact O-C 3.58Å; V46-K49 PolarHBondContact O-N 2.66Å; V46-R50 PolarHBondContact O-N 3Å; V46-L51 HydrophobicContact CG1-CB 4.07Å; V46-L51 HydrophobicContact CG2-CD1 4.31Å; V46-L51 PolarHBondContact O-N 2.73Å; V46-L51 VanDerWaalsContact O-N 3.13Å; V46-L53 HydrophobicContact CG1-CB 3.92Å; V46-L53 VanDerWaalsContact CG1-O 3.3Å; V46-L53 WeakPolarHBondContact CG1-O 3.38Å; V46-L53 HydrophobicContact CG2-CB 4.46Å; V46-L53 HydrophobicContact CG2-CD1 4.4Å; V46-I72 HydrophobicContact CG2-CG1 4.3Å
47	A	90.2	Very high	91.2	Very high	71 Å²	71	80 Å²	80	59%	0.587	40%	0.398	S	S	*	.	H	α-helix	trans	-61.7	-47.8	177.4	0	0	0	0	0	112.4	Q43 K49 R50	Q43-A47 WeakPolarHBondContact O-CB 3.34Å; Q43-A47 PolarHBondContact O-N 3.41Å; A47-K49 PolarHBondContact O-N 3.13Å; A47-R50 PolarHBondContact O-N 3.33Å
48	Q	89.1	Confident	91	Very high	127 Å²	127	80.9 Å²	80.9	59%	0.593	41%	0.408	S	S	*	.	H	α-helix	trans	-62.5	-28.5	179.8	-170.6	-174.6	18.8	0	0	112.7	K44 T45	K44-Q48 WeakPolarHBondContact O-CB 3.5Å; K44-Q48 PolarHBondContact O-N 3.44Å; T45-Q48 PolarHBondContact O-N 3.22Å
49	K	87.1	Confident	90.7	Very high	41 Å²	41	80.7 Å²	80.7	18%	0.178	41%	0.411	C	S	.	.	H	α-helix	trans	-100.3	-0	-176.4	-65	-70.3	-168.9	140.8	0	113.8	T45 V46 A47 L51 V75	T45-K49 HydrophobicContact CG2-CG 4.35Å; T45-K49 VanDerWaalsContact O-CB 3.23Å; T45-K49 WeakPolarHBondContact O-CB 3.26Å; T45-K49 WeakPolarHBondContact O-CG 3.45Å; T45-K49 PolarHBondContact O-N 2.82Å; V46-K49 CarbonylContact O-C 3.58Å; V46-K49 PolarHBondContact O-N 2.66Å; A47-K49 PolarHBondContact O-N 3.13Å; K49-L51 HydrophobicContact CB-CG 4.16Å; K49-L51 PolarHBondContact O-N 3.15Å; K49-V75 HydrophobicContact CB-CG1 3.51Å; K49-V75 HydrophobicContact CD-CG1 3.64Å; K49-V75 WeakPolarHBondContact CE-O 3.44Å; K49-V75 HydrophobicContact CG-CG1 3.54Å; K49-V75 PolarHBondContact NZ-O 2.99Å
50	R	87.8	Confident	90.4	Very high	229 Å²	229	87.8 Å²	87.8	86%	0.864	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	54	37.8	-178.9	-56.5	-176.8	172	-164.9	-2.9	112.5	V46 A47	V46-R50 PolarHBondContact O-N 3Å; A47-R50 PolarHBondContact O-N 3.33Å
51	L	88.7	Confident	90.4	Very high	32 Å²	32	81.1 Å²	81.1	17%	0.168	41%	0.411	C	S	.	.			trans	-73.4	137.2	170.5	-61.5	177.4	0	0	0	108.6	V46 K49 L53 V75	V46-L51 HydrophobicContact CG1-CB 4.07Å; V46-L51 HydrophobicContact CG2-CD1 4.31Å; V46-L51 PolarHBondContact O-N 2.73Å; V46-L51 VanDerWaalsContact O-N 3.13Å; K49-L51 HydrophobicContact CB-CG 4.16Å; K49-L51 PolarHBondContact O-N 3.15Å; L51-L53 HydrophobicContact CB-CD1 4.3Å; L51-L53 HydrophobicContact CB-CG 4.34Å; L51-L53 HydrophobicContact CD1-CD1 4.35Å; L51-L53 PolarHBondContact O-N 2.92Å; L51-V75 HydrophobicContact CD1-CB 4.2Å; L51-V75 HydrophobicContact CD1-CG1 4.23Å; L51-V75 HydrophobicContact CD1-CG2 4.04Å; L51-V75 HydrophobicContact CD2-CB 4.47Å; L51-V75 HydrophobicContact CD2-CG1 4.2Å; L51-V75 HydrophobicContact CD2-CG2 3.72Å; L51-V75 HydrophobicContact CG-CG1 4.37Å; L51-V75 HydrophobicContact CG-CG2 4.42Å
52	K	91.3	Very high	90.6	Very high	138 Å²	138	77.1 Å²	77.1	60%	0.6	40%	0.402	S	S	*	.	S	Bend	trans	-80.4	50.1	179.2	-61.2	-177.9	178.1	175.7	0	111.8	D25	D25-K52 PolarHBondContact N-O 2.88Å; D25-K52 VanDerWaalsContact N-O 3.15Å; D25-K52 WeakPolarHBondContact OD1-CD 3.3Å; D25-K52 WeakPolarHBondContact OD1-CE 3.08Å; D25-K52 IonicContact OD1-NZ 3.59Å; D25-K52 PolarHBondContact OD1-NZ 3.44Å
53	L	92.6	Very high	90.8	Very high	11 Å²	11	79.9 Å²	79.9	6%	0.058	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	127.8	179.7	-65.2	173.7	0	0	0	109.1	L22 I23 D24 V46 L51 R71 I72	L22-L53 HydrophobicContact CD1-CD1 4.49Å; L22-L53 HydrophobicContact CD1-CD2 4.5Å; I23-L53 WeakPolarHBondContact O-CA 3.13Å; D24-L53 HydrophobicContact CB-CD2 3.78Å; V46-L53 HydrophobicContact CG1-CB 3.92Å; V46-L53 VanDerWaalsContact CG1-O 3.3Å; V46-L53 WeakPolarHBondContact CG1-O 3.38Å; V46-L53 HydrophobicContact CG2-CB 4.46Å; V46-L53 HydrophobicContact CG2-CD1 4.4Å; L51-L53 HydrophobicContact CB-CD1 4.3Å; L51-L53 HydrophobicContact CB-CG 4.34Å; L51-L53 HydrophobicContact CD1-CD1 4.35Å; L51-L53 PolarHBondContact O-N 2.92Å; L53-R71 VanDerWaalsContact CD2-NH1 3.34Å; L53-I72 HydrophobicContact CD1-CD1 4.29Å; L53-I72 HydrophobicContact CD1-CG1 4.01Å
54	S	92.7	Very high	90.8	Very high	57 Å²	57	75.4 Å²	75.4	40%	0.399	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	157.8	170.8	60.5	0	0	0	0	110.6	L22 I23	L22-S54 CarbonylContact C-O 3.58Å; L22-S54 WeakPolarHBondContact CA-O 3.4Å; L22-S54 WeakPolarHBondContact CD2-O 3.41Å; I23-S54 PolarHBondContact N-O 2.95Å; I23-S54 PolarHBondContact O-N 3.34Å
55	S	93	Very high	91.1	Very high	61 Å²	61	68 Å²	68	43%	0.427	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	132.5	173.2	51.3	0	0	0	0	110	P57	S55-P57 WeakPolarHBondContact O-CD 3.41Å
56	D	92.7	Very high	91.3	Very high	19 Å²	19	71.2 Å²	71.2	10%	0.102	38%	0.375	C	S	.	.			trans	-71.7	117.1	172.7	-178.2	3.9	0	0	0	110.4	C21 I23 R28 A58 A59	C21-D56 PolarHBondContact O-N 3.44Å; I23-D56 HydrophobicContact CD1-CB 4.1Å; I23-D56 HydrophobicContact CG1-CB 3.91Å; R28-D56 WeakPolarHBondContact CD-OD2 3.18Å; R28-D56 IonicContact CZ-OD2 2.97Å; R28-D56 IonicContact NE-OD2 2.93Å; R28-D56 PolarHBondContact NE-OD2 2.94Å; R28-D56 IonicContact NH1-OD2 3.19Å; R28-D56 PolarHBondContact NH1-OD2 2.94Å; R28-D56 IonicContact NH2-OD2 3.6Å; D56-A58 PolarHBondContact O-N 2.86Å; D56-A58 WeakPolarHBondContact OD1-CB 3.33Å; D56-A58 PolarHBondContact OD1-N 3.33Å; D56-A59 HydrophobicContact CB-CB 4.09Å; D56-A59 WeakPolarHBondContact O-CB 3.31Å; D56-A59 PolarHBondContact O-N 2.74Å; D56-A59 VanDerWaalsContact O-N 3.1Å
57	P	90.2	Very high	91.5	Very high	125 Å²	125	75.8 Å²	75.8	81%	0.812	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-18	177.2	28	-35.4	0	0	0	113.6	S55	S55-P57 WeakPolarHBondContact O-CD 3.41Å
58	A	88.9	Confident	91.7	Very high	67 Å²	67	72.5 Å²	72.5	55%	0.554	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-9.9	175.1	0	0	0	0	0	113.1	D56 Q60	D56-A58 PolarHBondContact O-N 2.86Å; D56-A58 WeakPolarHBondContact OD1-CB 3.33Å; D56-A58 PolarHBondContact OD1-N 3.33Å; A58-Q60 PolarHBondContact O-N 3.49Å
59	A	89.1	Confident	92	Very high	19 Å²	19	69.9 Å²	69.9	16%	0.157	36%	0.355	C	S	.	.			trans	-75.5	125.1	176.7	0	0	0	0	0	110.4	C21 D56 H61	C21-A59 HydrophobicContact CB-CB 3.77Å; D56-A59 HydrophobicContact CB-CB 4.09Å; D56-A59 WeakPolarHBondContact O-CB 3.31Å; D56-A59 PolarHBondContact O-N 2.74Å; D56-A59 VanDerWaalsContact O-N 3.1Å; A59-H61 PolarHBondContact O-N 3.43Å
60	Q	87.9	Confident	92.2	Very high	194 Å²	194	73.5 Å²	73.5	91%	0.907	37%	0.373	S	S	*	.	S	Bend	trans	-79.7	6.7	177.8	-66.1	178.8	-20	0	0	113.2	A58	A58-Q60 PolarHBondContact O-N 3.49Å
61	H	92.3	Very high	92.3	Very high	32 Å²	32	65.9 Å²	65.9	15%	0.148	34%	0.344	C	S	.	.	S	Bend	trans	-147.3	168.8	-178.5	65.6	94.7	0	0	0	111.1	Q18 T19 C21 A59 Y63	Q18-H61 PolarHBondContact OE1-CD2 2.88Å; Q18-H61 PolarHBondContact OE1-ND1 3.23Å; T19-H61 PolarHBondContact O-CE1 2.87Å; T19-H61 PolarHBondContact O-NE2 3.38Å; C21-H61 WeakPolarHBondContact CB-O 3.37Å; A59-H61 PolarHBondContact O-N 3.43Å; H61-Y63 HydrophobicContact CB-CD2 3.98Å; H61-Y63 AromaticContact ND1-CD2 3.83Å; H61-Y63 PolarHBondContact ND1-N 2.99Å
62	I	94.3	Very high	92.4	Very high	95 Å²	95	64.6 Å²	64.6	49%	0.487	34%	0.337	S	S	.	.			trans	-109.8	13.9	-177.6	64.3	168.2	0	0	0	113.5	S37 Y38	S37-I62 CarbonylContact C-O 3.57Å; S37-I62 WeakPolarHBondContact CA-O 3.18Å; Y38-I62 PolarHBondContact N-O 2.98Å
63	Y	95.2	Very high	92.3	Very high	81 Å²	81	62.7 Å²	62.7	32%	0.318	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	144.5	-174.7	-61.5	-68.2	0	0	0	113.5	C21 G34 A36 H61	C21-Y63 WeakPolarHBondContact CB-O 3.11Å; C21-Y63 PolarHBondContact N-O 3.19Å; C21-Y63 PolarHBondContact SG-O 3.14Å; C21-Y63 VanDerWaalsContact SG-O 3.33Å; G34-Y63 WeakPolarHBondContact O-CB 3.42Å; A36-Y63 CarbonylContact O-C 3.58Å; A36-Y63 WeakPolarHBondContact O-CA 3.46Å; H61-Y63 HydrophobicContact CB-CD2 3.98Å; H61-Y63 AromaticContact ND1-CD2 3.83Å; H61-Y63 PolarHBondContact ND1-N 2.99Å
64	I	94.8	Very high	91.9	Very high	5 Å²	5	64.4 Å²	64.4	3%	0.026	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	151.3	-176.3	69.2	176.1	0	0	0	111.4	L22 G34 A36 Y38 H68 K69 I72	L22-I64 HydrophobicContact CD1-CB 4.16Å; L22-I64 HydrophobicContact CD1-CG2 3.61Å; L22-I64 HydrophobicContact CD2-CG2 4.46Å; L22-I64 HydrophobicContact CG-CG2 3.79Å; G34-I64 PolarHBondContact N-O 3.33Å; A36-I64 HydrophobicContact CB-CD1 4.05Å; A36-I64 HydrophobicContact CB-CG1 3.65Å; A36-I64 WeakPolarHBondContact O-CG1 3.38Å; A36-I64 PolarHBondContact O-N 2.8Å; Y38-I64 HydrophobicContact CD2-CG2 4.46Å; I64-H68 HydrophobicContact CB-CB 4.39Å; I64-K69 HydrophobicContact CD1-CB 4.01Å; I64-K69 HydrophobicContact CG1-CB 4.37Å; I64-I72 HydrophobicContact CD1-CD1 3.82Å
65	C	95.4	Very high	91.3	Very high	3 Å²	3	63 Å²	63	2%	0.02	33%	0.332	C	S	.	.			trans	-70.9	160.7	174	64.1	0	0	0	0	112	C20 N31 Q32 H67 H68 K69	C20-C65 HydrophobicContact CB-CB 3.92Å; C20-C65 PolarHBondContact SG-N 3.16Å; C20-C65 VanDerWaalsContact SG-N 3.42Å; N31-C65 HydrophobicContact CB-CB 3.61Å; Q32-C65 WeakPolarHBondContact O-CA 3.3Å; Q32-C65 WeakPolarHBondContact O-CB 3.29Å; C65-H67 PolarHBondContact O-N 2.9Å; C65-H68 PolarHBondContact O-N 3Å; C65-H68 PolarHBondContact SG-N 2.88Å; C65-H68 VanDerWaalsContact SG-N 3.44Å; C65-H68 PolarHBondContact SG-ND1 3.37Å; C65-H68 VanDerWaalsContact SG-ND1 3.44Å; C65-K69 PolarHBondContact O-N 2.96Å
66	D	94.2	Very high	90.5	Very high	82 Å²	82	64.4 Å²	64.4	44%	0.439	33%	0.328	S	S	.	.	H	α-helix	trans	-60.5	-34.5	177.5	-78.6	-49.5	0	0	0	112.5	H68 K69 E70	D66-H68 PolarHBondContact O-N 3.4Å; D66-K69 WeakPolarHBondContact O-CB 3.46Å; D66-K69 PolarHBondContact O-N 3.23Å; D66-K69 VanDerWaalsContact OD1-CD 3.26Å; D66-K69 WeakPolarHBondContact OD1-CD 3.23Å; D66-K69 IonicContact OD1-NZ 3.85Å; D66-K69 PolarHBondContact OD1-NZ 2.86Å; D66-E70 WeakPolarHBondContact O-CG 3.12Å; D66-E70 PolarHBondContact O-N 3.37Å
67	H	94.2	Very high	89.5	Confident	103 Å²	103	68.2 Å²	68.2	48%	0.477	35%	0.352	S	S	.	.	H	α-helix	trans	-56.7	-48.1	174	-179.5	72.3	0	0	0	112.5	C65 E70 R71	C65-H67 PolarHBondContact O-N 2.9Å; H67-E70 PolarHBondContact O-N 2.91Å; H67-R71 WeakPolarHBondContact O-CB 3.37Å; H67-R71 PolarHBondContact O-N 2.92Å
68	H	94.5	Very high	88.1	Confident	2 Å²	2	70.1 Å²	70.1	1%	0.009	35%	0.348	C	S	.	.	H	α-helix	trans	-72.2	-34.6	178.1	-77.8	144	0	0	0	112.9	C20 L22 D24 C29 I64 C65 D66 E70 R71 I72	C20-H68 PolarHBondContact SG-ND1 2.95Å; L22-H68 HydrophobicContact CD1-CB 3.75Å; D24-H68 IonicContact OD2-NE2 3.41Å; D24-H68 PolarHBondContact OD2-NE2 3.09Å; C29-H68 PolarHBondContact SG-CE1 3.41Å; I64-H68 HydrophobicContact CB-CB 4.39Å; C65-H68 PolarHBondContact O-N 3Å; C65-H68 PolarHBondContact SG-N 2.88Å; C65-H68 VanDerWaalsContact SG-N 3.44Å; C65-H68 PolarHBondContact SG-ND1 3.37Å; C65-H68 VanDerWaalsContact SG-ND1 3.44Å; D66-H68 PolarHBondContact O-N 3.4Å; H68-E70 VanDerWaalsContact C-N 3.33Å; H68-E70 PolarHBondContact O-N 3.32Å; H68-R71 PolarHBondContact O-N 2.92Å; H68-I72 WeakPolarHBondContact O-CB 3.44Å; H68-I72 VanDerWaalsContact O-CD1 3.31Å; H68-I72 WeakPolarHBondContact O-CD1 3.32Å; H68-I72 WeakPolarHBondContact O-CG1 3.46Å; H68-I72 PolarHBondContact O-N 2.84Å
69	K	94.4	Very high	86.4	Confident	72 Å²	72	74.5 Å²	74.5	31%	0.313	35%	0.35	S	S	.	.	H	α-helix	trans	-57.7	-47.1	172.1	169.7	-162.4	172.4	-154.9	0	110.6	A36 I64 C65 D66 I72 Q73	A36-K69 HydrophobicContact CB-CB 4.24Å; A36-K69 HydrophobicContact CB-CD 4.09Å; A36-K69 HydrophobicContact CB-CG 4.13Å; I64-K69 HydrophobicContact CD1-CB 4.01Å; I64-K69 HydrophobicContact CG1-CB 4.37Å; C65-K69 PolarHBondContact O-N 2.96Å; D66-K69 WeakPolarHBondContact O-CB 3.46Å; D66-K69 PolarHBondContact O-N 3.23Å; D66-K69 VanDerWaalsContact OD1-CD 3.26Å; D66-K69 WeakPolarHBondContact OD1-CD 3.23Å; D66-K69 IonicContact OD1-NZ 3.85Å; D66-K69 PolarHBondContact OD1-NZ 2.86Å; K69-I72 PolarHBondContact O-N 3.46Å; K69-Q73 WeakPolarHBondContact O-CB 3.32Å; K69-Q73 VanDerWaalsContact O-CG 3.23Å; K69-Q73 WeakPolarHBondContact O-CG 3.38Å; K69-Q73 PolarHBondContact O-N 3.39Å
70	E	92	Very high	84.6	Confident	117 Å²	117	84.6 Å²	84.6	55%	0.547	38%	0.384	S	S	.	.	H	α-helix	trans	-65.8	-43.5	177	-73.4	172.8	-170.1	0	0	112.4	D66 H67 H68 I72 Q73 S74	D66-E70 WeakPolarHBondContact O-CG 3.12Å; D66-E70 PolarHBondContact O-N 3.37Å; H67-E70 PolarHBondContact O-N 2.91Å; H68-E70 VanDerWaalsContact C-N 3.33Å; H68-E70 PolarHBondContact O-N 3.32Å; E70-I72 VanDerWaalsContact C-N 3.3Å; E70-I72 PolarHBondContact O-N 2.97Å; E70-Q73 PolarHBondContact O-N 2.95Å; E70-Q73 VanDerWaalsContact O-N 3.16Å; E70-S74 WeakPolarHBondContact O-CB 3.36Å; E70-S74 PolarHBondContact O-N 3.3Å; E70-S74 PolarHBondContact O-OG 3.13Å; E70-S74 VanDerWaalsContact O-OG 3.14Å
71	R	90.9	Very high	82.9	Confident	69 Å²	69	85 Å²	85	26%	0.26	38%	0.377	S	S	.	.	H	α-helix	trans	-59.1	-42.1	175.1	-166.6	170.9	179.2	-138.1	8.6	111.7	D24 L53 H67 H68 S74 V75	D24-R71 IonicContact OD1-CZ 2.9Å; D24-R71 IonicContact OD1-NH1 2.66Å; D24-R71 PolarHBondContact OD1-NH1 3.25Å; D24-R71 IonicContact OD1-NH2 3.43Å; D24-R71 PolarHBondContact OD1-NH2 3.28Å; D24-R71 IonicContact OD2-CZ 2.73Å; D24-R71 IonicContact OD2-NH1 2.65Å; D24-R71 PolarHBondContact OD2-NH1 2.99Å; D24-R71 IonicContact OD2-NH2 2.92Å; L53-R71 VanDerWaalsContact CD2-NH1 3.34Å; H67-R71 WeakPolarHBondContact O-CB 3.37Å; H67-R71 PolarHBondContact O-N 2.92Å; H68-R71 PolarHBondContact O-N 2.92Å; R71-S74 PolarHBondContact O-OG 3.37Å; R71-V75 WeakPolarHBondContact O-CG2 3.29Å; R71-V75 PolarHBondContact O-N 3.45Å
72	I	90.6	Very high	80.9	Confident	4 Å²	4	93 Å²	93	2%	0.021	41%	0.412	C	S	.	.	H	α-helix	trans	-68.5	-40.2	175.8	-70.2	161	0	0	0	111.3	L22 I42 V46 L53 I64 H68 K69 E70 R76	L22-I72 HydrophobicContact CD1-CD1 4.4Å; I42-I72 HydrophobicContact CD1-CG2 4.15Å; I42-I72 HydrophobicContact CG2-CD1 3.72Å; I42-I72 HydrophobicContact CG2-CG1 4.43Å; I42-I72 HydrophobicContact CG2-CG2 3.94Å; V46-I72 HydrophobicContact CG2-CG1 4.3Å; L53-I72 HydrophobicContact CD1-CD1 4.29Å; L53-I72 HydrophobicContact CD1-CG1 4.01Å; I64-I72 HydrophobicContact CD1-CD1 3.82Å; H68-I72 WeakPolarHBondContact O-CB 3.44Å; H68-I72 VanDerWaalsContact O-CD1 3.31Å; H68-I72 WeakPolarHBondContact O-CD1 3.32Å; H68-I72 WeakPolarHBondContact O-CG1 3.46Å; H68-I72 PolarHBondContact O-N 2.84Å; K69-I72 PolarHBondContact O-N 3.46Å; E70-I72 VanDerWaalsContact C-N 3.3Å; E70-I72 PolarHBondContact O-N 2.97Å; I72-R76 WeakPolarHBondContact O-CG 3.38Å; I72-R76 PolarHBondContact O-N 2.84Å
73	Q	88.9	Confident	78.5	Confident	98 Å²	98	95.9 Å²	95.9	46%	0.458	43%	0.428	S	S	.	.	H	α-helix	trans	-68.8	-46.3	179.9	-76.9	-179	9.4	0	0	112.7	K69 E70 V75 R76 T77	K69-Q73 WeakPolarHBondContact O-CB 3.32Å; K69-Q73 VanDerWaalsContact O-CG 3.23Å; K69-Q73 WeakPolarHBondContact O-CG 3.38Å; K69-Q73 PolarHBondContact O-N 3.39Å; E70-Q73 PolarHBondContact O-N 2.95Å; E70-Q73 VanDerWaalsContact O-N 3.16Å; Q73-V75 PolarHBondContact O-N 2.93Å; Q73-R76 WeakPolarHBondContact O-CA 3.42Å; Q73-R76 WeakPolarHBondContact O-CB 3.42Å; Q73-R76 PolarHBondContact O-N 3.21Å; Q73-T77 PolarHBondContact O-N 3.01Å; Q73-T77 VanDerWaalsContact O-N 3.09Å; Q73-T77 PolarHBondContact O-OG1 3.05Å
74	S	83.7	Confident	76.1	Confident	48 Å²	48	96.8 Å²	96.8	34%	0.336	45%	0.446	S	S	.	.	H	α-helix	trans	-57.4	-36.8	179.2	62.5	0	0	0	0	112	E70 R71 R76 T77 K78	E70-S74 WeakPolarHBondContact O-CB 3.36Å; E70-S74 PolarHBondContact O-N 3.3Å; E70-S74 PolarHBondContact O-OG 3.13Å; E70-S74 VanDerWaalsContact O-OG 3.14Å; R71-S74 PolarHBondContact O-OG 3.37Å; S74-R76 VanDerWaalsContact C-N 3.31Å; S74-R76 PolarHBondContact O-N 3.38Å; S74-T77 WeakPolarHBondContact CA-OG1 3.18Å; S74-T77 PolarHBondContact O-N 3.39Å; S74-T77 PolarHBondContact O-OG1 2.98Å; S74-K78 WeakPolarHBondContact O-CB 3.23Å; S74-K78 WeakPolarHBondContact O-CG 3.22Å; S74-K78 PolarHBondContact O-N 2.93Å
75	V	80.4	Confident	73.7	Confident	27 Å²	27	105.7 Å²	105.7	16%	0.164	49%	0.488	C	S	.	.	H	α-helix	trans	-74.2	-25.9	179.2	179.7	0	0	0	0	111.4	K49 L51 R71 Q73	K49-V75 HydrophobicContact CB-CG1 3.51Å; K49-V75 HydrophobicContact CD-CG1 3.64Å; K49-V75 WeakPolarHBondContact CE-O 3.44Å; K49-V75 HydrophobicContact CG-CG1 3.54Å; K49-V75 PolarHBondContact NZ-O 2.99Å; L51-V75 HydrophobicContact CD1-CB 4.2Å; L51-V75 HydrophobicContact CD1-CG1 4.23Å; L51-V75 HydrophobicContact CD1-CG2 4.04Å; L51-V75 HydrophobicContact CD2-CB 4.47Å; L51-V75 HydrophobicContact CD2-CG1 4.2Å; L51-V75 HydrophobicContact CD2-CG2 3.72Å; L51-V75 HydrophobicContact CG-CG1 4.37Å; L51-V75 HydrophobicContact CG-CG2 4.42Å; R71-V75 WeakPolarHBondContact O-CG2 3.29Å; R71-V75 PolarHBondContact O-N 3.45Å; Q73-V75 PolarHBondContact O-N 2.93Å
76	R	76.4	Confident	71.5	Confident	91 Å²	91	112.7 Å²	112.7	34%	0.343	53%	0.525	S	S	.	.	H	α-helix	trans	-71.4	-42.2	172.1	-68.4	172.2	115.8	-169.1	3.2	111.2	T45 I72 Q73 S74	T45-R76 HydrophobicContact CG2-CG 3.59Å; I72-R76 WeakPolarHBondContact O-CG 3.38Å; I72-R76 PolarHBondContact O-N 2.84Å; Q73-R76 WeakPolarHBondContact O-CA 3.42Å; Q73-R76 WeakPolarHBondContact O-CB 3.42Å; Q73-R76 PolarHBondContact O-N 3.21Å; S74-R76 VanDerWaalsContact C-N 3.31Å; S74-R76 PolarHBondContact O-N 3.38Å
77	T	71	Confident	69.4	Low	98 Å²	98	115.7 Å²	115.7	60%	0.601	54%	0.541	S	S	*	.	H	α-helix	trans	-73.3	-35.8	-179.5	52.3	0	0	0	0	112.4	Q73 S74 R79 R80	Q73-T77 PolarHBondContact O-N 3.01Å; Q73-T77 VanDerWaalsContact O-N 3.09Å; Q73-T77 PolarHBondContact O-OG1 3.05Å; S74-T77 WeakPolarHBondContact CA-OG1 3.18Å; S74-T77 PolarHBondContact O-N 3.39Å; S74-T77 PolarHBondContact O-OG1 2.98Å; T77-R79 PolarHBondContact O-N 3.04Å; T77-R80 PolarHBondContact O-N 2.92Å
78	K	59.8	Low	67.3	Low	166 Å²	166	114.7 Å²	114.7	72%	0.722	55%	0.545	S	S	*	.	G	3₁₀ helix	trans	-58.5	-14.4	178.8	-81.3	-175.1	177.7	-170.4	0	115.8	S74 R80	S74-K78 WeakPolarHBondContact O-CB 3.23Å; S74-K78 WeakPolarHBondContact O-CG 3.22Å; S74-K78 PolarHBondContact O-N 2.93Å; K78-R80 VanDerWaalsContact C-N 3.33Å
79	R	55	Low	65	Low	159 Å²	159	122.4 Å²	122.4	60%	0.6	59%	0.587	S	S	*	*	G	3₁₀ helix	trans	-87	6.3	174.1	-104.8	-172	-169.1	164.7	-1.9	114.9	T77	T77-R79 PolarHBondContact O-N 3.04Å
80	R	50.1	Low	62.8	Low	231 Å²	231	125.7 Å²	125.7	87%	0.872	60%	0.603	S	S	*	*	G	3₁₀ helix	trans	-105.3	7.7	179.3	-88.1	-108.2	149.2	-163.7	-7	115.1	T77 K78	T77-R80 PolarHBondContact O-N 2.92Å; K78-R80 VanDerWaalsContact C-N 3.33Å
81	R	52.5	Low	60.4	Low	202 Å²	202	125.4 Å²	125.4	76%	0.762	61%	0.61	S	S	*	*			trans	-145.7	101.6	172.8	-65	-178	178.2	166.5	-3.5	107
82	K	49.6	Very low	58.1	Low	201 Å²	201	130.4 Å²	130.4	87%	0.874	64%	0.641	S	S	*	*				32.1	105.7	89.2	-160.7	166.7	-178.5	-175.5	0	112.6
83	D	45.1	Very low	55.7	Low	155 Å²	155	135.5 Å²	135.5	83%	0.829	67%	0.673	S	S	*	*	S	Bend	trans	-44.5	145.5	165.1	-103.3	-80.6	0	0	0	113.4
84	S	45	Very low	53.6	Low	100 Å²	100	137 Å²	137	70%	0.699	68%	0.684	S	S	*	*	S	Bend	trans	82.1	123.8	-178.7	90	0	0	0	0	117.7
85	E	43.6	Very low	51.6	Low	191 Å²	191	143.6 Å²	143.6	89%	0.893	72%	0.715	S	S	*	*			trans	93.1	87.7	178.6	-43.7	-82.7	116.6	0	0	115.6
86	D	49.4	Very low	50.4	Low	150 Å²	150	149.2 Å²	149.2	80%	0.802	74%	0.739	S	S	*	*			trans	-154.3	99.8	166.8	-147	12.6	0	0	0	110.6
87	D	50.8	Low	49.7	Very low	146 Å²	146	153.6 Å²	153.6	78%	0.781	76%	0.763	S	S	*	*			trans	-140.8	126.8	160.3	-163.8	1.4	0	0	0	108.5
88	S	49.1	Very low	49.5	Very low	81 Å²	81	154.6 Å²	154.6	57%	0.566	76%	0.76	S	S	*	*			trans	66.7	96.8	162.3	-56.4	0	0	0	0	119	E90	S88-E90 VanDerWaalsContact CB-OE1 3.29Å; S88-E90 WeakPolarHBondContact CB-OE1 3.43Å
89	N	46.6	Very low	50.3	Low	165 Å²	165	149.7 Å²	149.7	88%	0.882	75%	0.745	S	S	*	*			trans	-120.7	67.9	162	-168.2	81.1	0	0	0	110.4
90	E	47.8	Very low	51.7	Low	140 Å²	140	146 Å²	146	65%	0.654	74%	0.737	S	S	*	*			trans	-75.5	124.5	157.8	31.4	-112.6	96.7	0	0	111	S88	S88-E90 VanDerWaalsContact CB-OE1 3.29Å; S88-E90 WeakPolarHBondContact CB-OE1 3.43Å
91	T	42.2	Very low	53.5	Low	111 Å²	111	135.8 Å²	135.8	68%	0.681	70%	0.699	S	S	*	*	S	Bend	trans	50.2	112.7	148.8	44.4	0	0	0	0	120.3	T93	T91-T93 PolarHBondContact O-N 2.71Å; T91-T93 PolarHBondContact O-OG1 3.22Å
92	D	41.7	Very low	55.2	Low	174 Å²	174	130.9 Å²	130.9	93%	0.93	68%	0.682	S	S	*	*				46.4	50	126.3	-157.3	39.6	0	0	0	117.6
93	T	40.8	Very low	57.2	Low	112 Å²	112	128.5 Å²	128.5	69%	0.687	67%	0.674	S	S	*	*			trans	-123.5	114.5	175.4	-36.7	0	0	0	0	109.3	T91	T91-T93 PolarHBondContact O-N 2.71Å; T91-T93 PolarHBondContact O-OG1 3.22Å
94	D	44.2	Very low	59.3	Low	130 Å²	130	124.3 Å²	124.3	70%	0.695	65%	0.651	S	S	*	*			trans	71.8	83.2	168.1	-60.1	-36.8	0	0	0	117.9	H96	D94-H96 HydrophobicContact CB-CB 4.22Å; D94-H96 PolarHBondContact O-N 3.03Å
95	L	42.9	Very low	61.6	Low	185 Å²	185	121.2 Å²	121.2	97%	0.969	63%	0.634	S	S	*	*			trans	-51.7	65.5	130.1	-77.6	167.8	0	0	0	109.8	E97	L95-E97 PolarHBondContact O-N 2.74Å
96	H	53.9	Low	63.8	Low	145 Å²	145	114.8 Å²	114.8	67%	0.671	61%	0.608	S	S	*	*			trans	-70.6	109.7	171.8	-143.6	-17	0	0	0	105.9	D94 F98	D94-H96 HydrophobicContact CB-CB 4.22Å; D94-H96 PolarHBondContact O-N 3.03Å; H96-F98 VanDerWaalsContact C-N 3.34Å; H96-F98 PolarHBondContact O-N 2.77Å
97	E	62.6	Low	65.8	Low	183 Å²	183	111.6 Å²	111.6	86%	0.855	60%	0.597	S	S	*	*			trans	-43.4	97.6	173	-100	-176.7	139.9	0	0	109.4	L95	L95-E97 PolarHBondContact O-N 2.74Å
98	F	66.8	Low	67.8	Low	120 Å²	120	107.4 Å²	107.4	53%	0.526	58%	0.577	S	S	.	*			trans	-63	134.2	168.5	-78.3	-78.2	0	0	0	106.6	H96 D100 M134 K138	H96-F98 VanDerWaalsContact C-N 3.34Å; H96-F98 PolarHBondContact O-N 2.77Å; F98-D100 PolarHBondContact O-N 3.24Å; F98-M134 HydrophobicContact CB-CE 4.21Å; F98-M134 HydrophobicContact CB-SD 4.27Å; F98-M134 HydrophobicContact CD1-SD 4.33Å; F98-K138 HydrophobicContact CD1-CD 4.36Å; F98-K138 VanDerWaalsContact CD1-CE 3.48Å; F98-K138 HydrophobicContact CD1-CG 4.29Å; F98-K138 HydrophobicContact CE1-CD 3.83Å; F98-K138 HydrophobicContact CE1-CG 3.8Å; F98-K138 VanDerWaalsContact CE2-NZ 3.29Å; F98-K138 HydrophobicContact CZ-CD 4.11Å; F98-K138 VanDerWaalsContact CZ-NZ 3.32Å
99	P	75.9	Confident	70	Confident	63 Å²	63	103.6 Å²	103.6	41%	0.409	55%	0.551	S	S	.	*			trans	-57.5	130.8	-176.4	21.7	-32.4	0	0	0	109.8	L101 M134 F137	P99-L101 VanDerWaalsContact C-N 3.33Å; P99-L101 PolarHBondContact O-N 2.59Å; P99-M134 WeakPolarHBondContact O-CE 3.09Å; P99-F137 HydrophobicContact CG-CE1 4.14Å
100	D	85.1	Confident	72.1	Confident	81 Å²	81	102.3 Å²	102.3	43%	0.433	53%	0.533	S	S	.	.			trans	-70.5	90.4	177.6	-177.3	11.2	0	0	0	110.7	F98 Y102 Q103	F98-D100 PolarHBondContact O-N 3.24Å; D100-Y102 PolarHBondContact O-N 3.24Å; D100-Y102 VanDerWaalsContact O-N 3.15Å; D100-Y102 WeakPolarHBondContact OD1-CB 3.43Å; D100-Y102 VanDerWaalsContact OD1-CD2 3.27Å; D100-Y102 WeakPolarHBondContact OD1-CD2 3.3Å; D100-Y102 PolarHBondContact OD1-N 2.93Å; D100-Q103 HydrophobicContact CB-CG 4.31Å; D100-Q103 PolarHBondContact O-N 3.08Å; D100-Q103 WeakPolarHBondContact OD2-CG 3.35Å; D100-Q103 PolarHBondContact OD2-NE2 3.34Å; D100-Q103 VanDerWaalsContact OD2-NE2 3.08Å
101	L	88.9	Confident	74.3	Confident	16 Å²	16	99.5 Å²	99.5	8%	0.084	52%	0.517	C	S	.	.	G	3₁₀ helix	trans	-66.3	-12.4	176.9	-63.4	-179.2	0	0	0	112.8	P99 Q103 L104 A130 I133 M134	P99-L101 VanDerWaalsContact C-N 3.33Å; P99-L101 PolarHBondContact O-N 2.59Å; L101-Q103 PolarHBondContact O-N 3.31Å; L101-L104 HydrophobicContact CD2-CD1 3.56Å; L101-L104 PolarHBondContact O-N 2.75Å; L101-A130 HydrophobicContact CB-CB 4.45Å; L101-I133 HydrophobicContact CD1-CB 4.34Å; L101-I133 HydrophobicContact CD1-CG2 3.66Å; L101-M134 HydrophobicContact CB-CE 4.29Å; L101-M134 HydrophobicContact CD1-CB 3.94Å; L101-M134 HydrophobicContact CD1-CE 3.7Å; L101-M134 HydrophobicContact CD1-SD 4.32Å; L101-M134 HydrophobicContact CG-CE 3.62Å
102	Y	87.6	Confident	76.8	Confident	100 Å²	100	96.1 Å²	96.1	39%	0.392	49%	0.492	S	S	.	.	G	3₁₀ helix	trans	-66.3	-27.6	174.8	-69.7	-100.3	0	0	0	111.4	D100 L104 R126 A127 A130 D131	D100-Y102 PolarHBondContact O-N 3.24Å; D100-Y102 VanDerWaalsContact O-N 3.15Å; D100-Y102 WeakPolarHBondContact OD1-CB 3.43Å; D100-Y102 VanDerWaalsContact OD1-CD2 3.27Å; D100-Y102 WeakPolarHBondContact OD1-CD2 3.3Å; D100-Y102 PolarHBondContact OD1-N 2.93Å; Y102-L104 PolarHBondContact O-N 3.36Å; Y102-R126 VanDerWaalsContact O-CZ 3.22Å; Y102-R126 PolarHBondContact O-NE 3.31Å; Y102-R126 PolarHBondContact O-NH2 3.39Å; Y102-A127 HydrophobicContact CD1-CB 4.48Å; Y102-A127 HydrophobicContact CE1-CB 3.74Å; Y102-A130 HydrophobicContact CD1-CB 4.36Å; Y102-A130 HydrophobicContact CD2-CB 4.46Å; Y102-A130 HydrophobicContact CE1-CB 4.43Å; Y102-A130 HydrophobicContact CE2-CB 4.48Å; Y102-A130 HydrophobicContact CG-CB 4.39Å; Y102-D131 PolarHBondContact OH-OD1 2.93Å; Y102-D131 PolarHBondContact OH-OD2 3.25Å
103	Q	90.3	Very high	79.2	Confident	151 Å²	151	90.9 Å²	90.9	71%	0.706	46%	0.461	S	S	*	.	G	3₁₀ helix	trans	-70.6	-20.9	178.6	-64.4	177.2	22.2	0	0	113	D100 L101	D100-Q103 HydrophobicContact CB-CG 4.31Å; D100-Q103 PolarHBondContact O-N 3.08Å; D100-Q103 WeakPolarHBondContact OD2-CG 3.35Å; D100-Q103 PolarHBondContact OD2-NE2 3.34Å; D100-Q103 VanDerWaalsContact OD2-NE2 3.08Å; L101-Q103 PolarHBondContact O-N 3.31Å
104	L	91.1	Very high	81.8	Confident	67 Å²	67	93.9 Å²	93.9	35%	0.351	46%	0.46	S	S	.	.	S	Bend	trans	-69.9	142.9	179.7	-60.2	179.7	0	0	0	112.2	L101 Y102 T108 L109 R126	L101-L104 HydrophobicContact CD2-CD1 3.56Å; L101-L104 PolarHBondContact O-N 2.75Å; Y102-L104 PolarHBondContact O-N 3.36Å; L104-T108 HydrophobicContact CB-CG2 4.46Å; L104-T108 HydrophobicContact CD1-CG2 4.2Å; L104-T108 HydrophobicContact CD2-CG2 4.41Å; L104-L109 HydrophobicContact CB-CD2 4.05Å; L104-L109 HydrophobicContact CB-CG 4.24Å; L104-L109 HydrophobicContact CD1-CD2 4.18Å; L104-R126 PolarHBondContact O-NH2 2.78Å
105	G	91.9	Very high	84.1	Confident	34 Å²	34	93.5 Å²	93.5	35%	0.351	45%	0.453	S	S	.	.			trans	-62.4	150.4	171.9	0	0	0	0	0	112.2	S107 T108 L109	G105-S107 PolarHBondContact O-N 3.47Å; G105-T108 WeakPolarHBondContact O-CB 3.14Å; G105-T108 PolarHBondContact O-N 3.48Å; G105-L109 PolarHBondContact O-N 3.28Å; G105-L109 VanDerWaalsContact O-N 3.08Å
106	V	91.1	Very high	86.6	Confident	57 Å²	57	88.4 Å²	88.4	35%	0.345	42%	0.423	S	S	.	.	H	α-helix	trans	-58.8	-33	179.6	175.6	0	0	0	0	111.7	L109 R110 R126	V106-L109 PolarHBondContact O-N 3.49Å; V106-R110 HydrophobicContact CG1-CG 4.33Å; V106-R110 WeakPolarHBondContact O-CB 3.3Å; V106-R110 VanDerWaalsContact O-CG 3.25Å; V106-R110 WeakPolarHBondContact O-CG 3.27Å; V106-R110 PolarHBondContact O-N 3.48Å; V106-R126 HydrophobicContact CG2-CB 4.18Å; V106-R126 HydrophobicContact CG2-CG 4.01Å
107	S	91.4	Very high	88.5	Confident	82 Å²	82	90.2 Å²	90.2	57%	0.573	43%	0.429	S	S	*	.	H	α-helix	trans	-59.9	-45.6	174	50.8	0	0	0	0	112	G105 R110 R111	G105-S107 PolarHBondContact O-N 3.47Å; S107-R110 PolarHBondContact O-N 3.2Å; S107-R111 WeakPolarHBondContact O-CB 2.95Å; S107-R111 PolarHBondContact O-N 3.49Å
108	T	92.9	Very high	90	Very high	59 Å²	59	82.2 Å²	82.2	36%	0.362	39%	0.393	S	S	.	.	H	α-helix	trans	-65	-46	177.5	-52.4	0	0	0	0	111.5	L104 G105 R110 R111 Y112	L104-T108 HydrophobicContact CB-CG2 4.46Å; L104-T108 HydrophobicContact CD1-CG2 4.2Å; L104-T108 HydrophobicContact CD2-CG2 4.41Å; G105-T108 WeakPolarHBondContact O-CB 3.14Å; G105-T108 PolarHBondContact O-N 3.48Å; T108-R110 VanDerWaalsContact C-N 3.29Å; T108-R110 PolarHBondContact O-N 2.91Å; T108-R111 WeakPolarHBondContact O-CB 3.35Å; T108-R111 PolarHBondContact O-N 2.89Å; T108-R111 VanDerWaalsContact O-N 3.13Å; T108-Y112 PolarHBondContact O-N 3.43Å
109	L	94	Very high	91.1	Very high	1 Å²	1	85.1 Å²	85.1	1%	0.005	41%	0.408	C	S	.	.	H	α-helix	trans	-59.3	-41.7	175.4	-63.7	176.5	0	0	0	111.4	L104 G105 V106 Y112 K113 R126 L129 A130 I133	L104-L109 HydrophobicContact CB-CD2 4.05Å; L104-L109 HydrophobicContact CB-CG 4.24Å; L104-L109 HydrophobicContact CD1-CD2 4.18Å; G105-L109 PolarHBondContact O-N 3.28Å; G105-L109 VanDerWaalsContact O-N 3.08Å; V106-L109 PolarHBondContact O-N 3.49Å; L109-Y112 PolarHBondContact O-N 2.64Å; L109-K113 WeakPolarHBondContact O-CB 3.32Å; L109-K113 PolarHBondContact O-N 3.26Å; L109-R126 HydrophobicContact CD1-CG 4.18Å; L109-L129 HydrophobicContact CB-CD2 3.63Å; L109-L129 HydrophobicContact CB-CG 4.05Å; L109-L129 HydrophobicContact CD1-CD2 4.42Å; L109-A130 HydrophobicContact CD1-CB 4.27Å; L109-I133 HydrophobicContact CB-CD1 3.76Å; L109-I133 HydrophobicContact CD2-CD1 3.87Å; L109-I133 HydrophobicContact CG-CD1 4.4Å; L109-I133 WeakPolarHBondContact O-CD1 3.44Å
110	R	91.9	Very high	91.7	Very high	138 Å²	138	83.9 Å²	83.9	52%	0.521	40%	0.399	S	S	.	.	H	α-helix	trans	-68.5	-36.5	175.4	-72.3	177.3	-171.6	-79.9	-0.9	112.6	V106 S107 T108 K113 R114 L129	V106-R110 HydrophobicContact CG1-CG 4.33Å; V106-R110 WeakPolarHBondContact O-CB 3.3Å; V106-R110 VanDerWaalsContact O-CG 3.25Å; V106-R110 WeakPolarHBondContact O-CG 3.27Å; V106-R110 PolarHBondContact O-N 3.48Å; S107-R110 PolarHBondContact O-N 3.2Å; T108-R110 VanDerWaalsContact C-N 3.29Å; T108-R110 PolarHBondContact O-N 2.91Å; R110-K113 PolarHBondContact O-N 3.17Å; R110-R114 WeakPolarHBondContact O-CB 3.36Å; R110-R114 PolarHBondContact O-N 3.47Å; R110-L129 HydrophobicContact CG-CD2 4.17Å
111	R	92.7	Very high	91.8	Very high	80 Å²	80	90 Å²	90	30%	0.302	42%	0.416	S	S	.	.	H	α-helix	trans	-60.4	-49.4	174.3	-170.5	-171.7	-66.8	-172.5	1	109.8	S107 T108 R114 H115 D163	S107-R111 WeakPolarHBondContact O-CB 2.95Å; S107-R111 PolarHBondContact O-N 3.49Å; T108-R111 WeakPolarHBondContact O-CB 3.35Å; T108-R111 PolarHBondContact O-N 2.89Å; T108-R111 VanDerWaalsContact O-N 3.13Å; R111-R114 PolarHBondContact O-N 2.9Å; R111-H115 WeakPolarHBondContact O-CB 3.27Å; R111-H115 PolarHBondContact O-N 3.14Å; R111-D163 IonicContact CZ-OD1 3.73Å; R111-D163 IonicContact NH1-OD1 2.85Å; R111-D163 PolarHBondContact NH1-OD1 2.98Å; R111-D163 IonicContact NH2-OD1 3.44Å
112	Y	94.2	Very high	91.6	Very high	41 Å²	41	98.5 Å²	98.5	16%	0.161	46%	0.456	C	S	.	.	H	α-helix	trans	-56.7	-52.3	175.1	-177	-78.1	0	0	0	111.6	T108 L109 R114 H115 F116 V118 I133 H136 F137 I140	T108-Y112 PolarHBondContact O-N 3.43Å; L109-Y112 PolarHBondContact O-N 2.64Å; Y112-R114 VanDerWaalsContact C-N 3.28Å; Y112-R114 PolarHBondContact O-N 2.88Å; Y112-H115 PolarHBondContact O-N 2.87Å; Y112-H115 VanDerWaalsContact O-N 3.15Å; Y112-F116 HydrophobicContact CD1-CD2 4.03Å; Y112-F116 AromaticContact CD2-CD2 3.85Å; Y112-F116 HydrophobicContact CD2-CD2 3.85Å; Y112-F116 AromaticContact CD2-CE2 3.87Å; Y112-F116 HydrophobicContact CD2-CE2 3.87Å; Y112-F116 HydrophobicContact CE1-CB 4.31Å; Y112-F116 AromaticContact CE1-CD2 3.79Å; Y112-F116 HydrophobicContact CE1-CD2 3.79Å; Y112-F116 HydrophobicContact CE1-CG 4.28Å; Y112-F116 AromaticContact CE2-CD2 3.63Å; Y112-F116 HydrophobicContact CE2-CD2 3.63Å; Y112-F116 AromaticContact CE2-CE2 3.54Å; Y112-F116 HydrophobicContact CE2-CE2 3.54Å; Y112-F116 HydrophobicContact CE2-CZ 4.49Å; Y112-F116 HydrophobicContact CG-CD2 4.06Å; Y112-F116 AromaticContact CZ-CD2 3.61Å; Y112-F116 AromaticContact CZ-CE2 3.92Å; Y112-F116 PolarHBondContact O-N 3.22Å; Y112-V118 HydrophobicContact CD1-CG2 4.29Å; Y112-V118 HydrophobicContact CE1-CG2 3.94Å; Y112-I133 HydrophobicContact CD1-CB 4.28Å; Y112-I133 HydrophobicContact CD1-CD1 4.14Å; Y112-I133 HydrophobicContact CD1-CG1 3.89Å; Y112-I133 HydrophobicContact CD1-CG2 3.5Å; Y112-I133 HydrophobicContact CD2-CG2 4.41Å; Y112-I133 HydrophobicContact CE1-CB 4.36Å; Y112-I133 HydrophobicContact CE1-CG1 4.31Å; Y112-I133 HydrophobicContact CE1-CG2 3.54Å; Y112-I133 HydrophobicContact CE2-CG2 4.42Å; Y112-I133 HydrophobicContact CG-CG2 3.97Å; Y112-H136 AromaticContact CE1-ND1 3.55Å; Y112-H136 AromaticContact CZ-ND1 3.64Å; Y112-H136 PolarHBondContact OH-ND1 2.68Å; Y112-F137 AromaticContact CE2-CD2 3.92Å; Y112-F137 HydrophobicContact CE2-CD2 3.92Å; Y112-F137 VanDerWaalsContact OH-CA 3.3Å; Y112-F137 WeakPolarHBondContact OH-CA 3.5Å; Y112-I140 HydrophobicContact CE2-CD1 4.31Å; Y112-I140 WeakPolarHBondContact OH-CD1 3.48Å
113	K	93.9	Very high	91.4	Very high	64 Å²	64	97.6 Å²	97.6	28%	0.278	48%	0.477	S	S	.	.	H	α-helix	trans	-53.8	-45.6	179	-179	-166.1	163.3	179.7	0	111.6	L109 R110 K117 V118 T120 L129	L109-K113 WeakPolarHBondContact O-CB 3.32Å; L109-K113 PolarHBondContact O-N 3.26Å; R110-K113 PolarHBondContact O-N 3.17Å; K113-K117 WeakPolarHBondContact O-CA 3.04Å; K113-K117 PolarHBondContact O-N 2.99Å; K113-V118 WeakPolarHBondContact CE-O 3.33Å; K113-V118 HydrophobicContact CG-CB 4.16Å; K113-V118 WeakPolarHBondContact CG-O 3.48Å; K113-V118 PolarHBondContact O-N 2.9Å; K113-T120 HydrophobicContact CD-CG2 3.82Å; K113-T120 WeakPolarHBondContact CE-OG1 3.49Å; K113-T120 HydrophobicContact CG-CG2 4.22Å; K113-T120 PolarHBondContact NZ-OG1 3.19Å; K113-L129 HydrophobicContact CD-CD1 4.22Å
114	R	93.7	Very high	91.1	Very high	175 Å²	175	93 Å²	93	66%	0.66	46%	0.456	S	S	*	.	H	α-helix	trans	-65.8	-43.9	-179.9	-170.1	-172.1	-61.2	138.2	-2	111.6	R110 R111 Y112 K117	R110-R114 WeakPolarHBondContact O-CB 3.36Å; R110-R114 PolarHBondContact O-N 3.47Å; R111-R114 PolarHBondContact O-N 2.9Å; Y112-R114 VanDerWaalsContact C-N 3.28Å; Y112-R114 PolarHBondContact O-N 2.88Å; R114-K117 PolarHBondContact O-N 3.35Å
115	H	93.1	Very high	91.1	Very high	121 Å²	121	97.4 Å²	97.4	56%	0.56	47%	0.472	S	S	*	.	H	α-helix	trans	-62.2	-49.2	-179	-176.8	-92	0	0	0	111.9	R111 Y112 K117	R111-H115 WeakPolarHBondContact O-CB 3.27Å; R111-H115 PolarHBondContact O-N 3.14Å; Y112-H115 PolarHBondContact O-N 2.87Å; Y112-H115 VanDerWaalsContact O-N 3.15Å; H115-K117 VanDerWaalsContact C-N 3.35Å
116	F	94.9	Very high	91	Very high	79 Å²	79	101.7 Å²	101.7	35%	0.346	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	4.2	-178	-71.2	-79.1	0	0	0	114.2	Y112 V118 H136 I140	Y112-F116 HydrophobicContact CD1-CD2 4.03Å; Y112-F116 AromaticContact CD2-CD2 3.85Å; Y112-F116 HydrophobicContact CD2-CD2 3.85Å; Y112-F116 AromaticContact CD2-CE2 3.87Å; Y112-F116 HydrophobicContact CD2-CE2 3.87Å; Y112-F116 HydrophobicContact CE1-CB 4.31Å; Y112-F116 AromaticContact CE1-CD2 3.79Å; Y112-F116 HydrophobicContact CE1-CD2 3.79Å; Y112-F116 HydrophobicContact CE1-CG 4.28Å; Y112-F116 AromaticContact CE2-CD2 3.63Å; Y112-F116 HydrophobicContact CE2-CD2 3.63Å; Y112-F116 AromaticContact CE2-CE2 3.54Å; Y112-F116 HydrophobicContact CE2-CE2 3.54Å; Y112-F116 HydrophobicContact CE2-CZ 4.49Å; Y112-F116 HydrophobicContact CG-CD2 4.06Å; Y112-F116 AromaticContact CZ-CD2 3.61Å; Y112-F116 AromaticContact CZ-CE2 3.92Å; Y112-F116 PolarHBondContact O-N 3.22Å; F116-V118 HydrophobicContact CB-CG2 3.8Å; F116-V118 PolarHBondContact O-N 3.36Å; F116-V118 VanDerWaalsContact O-N 3.15Å; F116-H136 VanDerWaalsContact CB-CE1 3.46Å; F116-H136 WeakPolarHBondContact CB-CE1 3.25Å; F116-H136 AromaticContact CD1-CE1 3.71Å; F116-H136 AromaticContact CG-CE1 3.65Å; F116-I140 HydrophobicContact CD1-CD1 4.17Å; F116-I140 HydrophobicContact CE1-CD1 3.67Å; F116-I140 HydrophobicContact CE1-CG1 4.29Å; F116-I140 HydrophobicContact CE2-CD1 4.16Å; F116-I140 HydrophobicContact CZ-CD1 3.66Å
117	K	94.9	Very high	91	Very high	183 Å²	183	101 Å²	101	80%	0.796	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.5	38.1	-177.7	-56.4	179.4	-177.8	177.3	0	112.8	K113 R114 H115 Q119	K113-K117 WeakPolarHBondContact O-CA 3.04Å; K113-K117 PolarHBondContact O-N 2.99Å; R114-K117 PolarHBondContact O-N 3.35Å; H115-K117 VanDerWaalsContact C-N 3.35Å; K117-Q119 PolarHBondContact O-N 3.07Å
118	V	93.8	Very high	91.1	Very high	14 Å²	14	101.7 Å²	101.7	9%	0.085	47%	0.472	C	S	.	.			trans	-64.6	122	-178.5	-175.3	0	0	0	0	109.3	Y112 K113 F116 T120 T132 H136	Y112-V118 HydrophobicContact CD1-CG2 4.29Å; Y112-V118 HydrophobicContact CE1-CG2 3.94Å; K113-V118 WeakPolarHBondContact CE-O 3.33Å; K113-V118 HydrophobicContact CG-CB 4.16Å; K113-V118 WeakPolarHBondContact CG-O 3.48Å; K113-V118 PolarHBondContact O-N 2.9Å; F116-V118 HydrophobicContact CB-CG2 3.8Å; F116-V118 PolarHBondContact O-N 3.36Å; F116-V118 VanDerWaalsContact O-N 3.15Å; V118-T120 HydrophobicContact CG1-CG2 4.42Å; V118-T120 PolarHBondContact O-N 3.29Å; V118-T132 HydrophobicContact CG1-CG2 4Å; V118-H136 HydrophobicContact CG1-CB 4.21Å; V118-H136 HydrophobicContact CG2-CB 4.16Å
119	Q	90.2	Very high	91.1	Very high	182 Å²	182	99.2 Å²	99.2	85%	0.85	46%	0.457	S	S	*	.			trans	-69.4	125.7	-179.9	-63	-176.5	18.8	0	0	110.3	K117	K117-Q119 PolarHBondContact O-N 3.07Å
120	T	88.9	Confident	91.1	Very high	36 Å²	36	99.1 Å²	99.1	22%	0.221	46%	0.457	C	S	.	.			trans	-142.9	154.9	173.9	87.6	0	0	0	0	110.3	K113 V118 M124 L129 T132	K113-T120 HydrophobicContact CD-CG2 3.82Å; K113-T120 WeakPolarHBondContact CE-OG1 3.49Å; K113-T120 HydrophobicContact CG-CG2 4.22Å; K113-T120 PolarHBondContact NZ-OG1 3.19Å; V118-T120 HydrophobicContact CG1-CG2 4.42Å; V118-T120 PolarHBondContact O-N 3.29Å; T120-M124 HydrophobicContact CG2-SD 4.36Å; T120-L129 HydrophobicContact CG2-CD1 4.19Å; T120-T132 HydrophobicContact CG2-CG2 4.06Å
121	R	86.2	Confident	91.1	Very high	209 Å²	209	95.8 Å²	95.8	79%	0.789	45%	0.449	S	S	*	.			trans	-73.4	154.4	169.8	-60.1	-175.6	174.2	-153.6	-2.6	110.9	M124	R121-M124 HydrophobicContact CB-CE 3.99Å; R121-M124 HydrophobicContact CG-CE 4.29Å
122	Q	84.8	Confident	91.1	Very high	196 Å²	196	93.9 Å²	93.9	92%	0.916	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	151.3	171.1	-64	-177.3	-1.2	0	0	110.1	M124	Q122-M124 PolarHBondContact O-N 3.15Å
123	G	82.6	Confident	91.1	Very high	81 Å²	81	92 Å²	92	84%	0.835	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.2	7.7	177.2	0	0	0	0	0	116.7	K125	G123-K125 PolarHBondContact O-N 3.39Å
124	M	85.7	Confident	91.1	Very high	53 Å²	53	90.6 Å²	90.6	26%	0.261	43%	0.434	S	S	.	.			trans	-63.1	135.3	176.9	-77.1	-174.4	178.3	0	0	112.5	T120 R121 Q122 Q128	T120-M124 HydrophobicContact CG2-SD 4.36Å; R121-M124 HydrophobicContact CB-CE 3.99Å; R121-M124 HydrophobicContact CG-CE 4.29Å; Q122-M124 PolarHBondContact O-N 3.15Å; M124-Q128 HydrophobicContact CB-CB 4.25Å; M124-Q128 HydrophobicContact CG-CB 4.36Å; M124-Q128 HydrophobicContact SD-CB 4.49Å
125	K	90.3	Very high	90.9	Very high	161 Å²	161	89.6 Å²	89.6	70%	0.7	43%	0.434	S	S	*	.			trans	-71.7	162.3	172.8	-64.2	-175	178.5	-177.7	0	111	G123 A127 Q128 L129	G123-K125 PolarHBondContact O-N 3.39Å; K125-A127 VanDerWaalsContact C-N 3.33Å; K125-A127 PolarHBondContact O-N 3.06Å; K125-Q128 PolarHBondContact O-N 3.06Å; K125-Q128 VanDerWaalsContact O-N 3.16Å; K125-L129 PolarHBondContact O-N 2.83Å
126	R	90.1	Very high	91	Very high	123 Å²	123	86.1 Å²	86.1	46%	0.464	42%	0.418	S	S	.	.	H	α-helix	trans	-49.1	-50.1	179.2	178.2	-175.4	176.6	-177.6	5.2	112.7	Y102 L104 V106 L109 Q128 L129 A130	Y102-R126 VanDerWaalsContact O-CZ 3.22Å; Y102-R126 PolarHBondContact O-NE 3.31Å; Y102-R126 PolarHBondContact O-NH2 3.39Å; L104-R126 PolarHBondContact O-NH2 2.78Å; V106-R126 HydrophobicContact CG2-CB 4.18Å; V106-R126 HydrophobicContact CG2-CG 4.01Å; L109-R126 HydrophobicContact CD1-CG 4.18Å; R126-Q128 PolarHBondContact O-N 3.15Å; R126-L129 WeakPolarHBondContact O-CB 3.37Å; R126-L129 PolarHBondContact O-N 2.91Å; R126-A130 PolarHBondContact O-N 3.33Å
127	A	92	Very high	90.9	Very high	44 Å²	44	86.5 Å²	86.5	36%	0.364	42%	0.42	S	S	.	.	H	α-helix	trans	-57.6	-49.1	179.8	0	0	0	0	0	112.3	Y102 K125 L129 A130 D131	Y102-A127 HydrophobicContact CD1-CB 4.48Å; Y102-A127 HydrophobicContact CE1-CB 3.74Å; K125-A127 VanDerWaalsContact C-N 3.33Å; K125-A127 PolarHBondContact O-N 3.06Å; A127-L129 VanDerWaalsContact C-N 3.29Å; A127-L129 PolarHBondContact O-N 3.28Å; A127-A130 WeakPolarHBondContact O-CB 3.28Å; A127-A130 PolarHBondContact O-N 3.43Å; A127-A130 VanDerWaalsContact O-N 3.15Å; A127-D131 PolarHBondContact O-N 2.8Å
128	Q	92.1	Very high	90.7	Very high	95 Å²	95	83.1 Å²	83.1	44%	0.444	41%	0.405	S	S	.	.	H	α-helix	trans	-62.5	-36.8	178.9	-64.4	174.1	-9.8	0	0	112.4	M124 K125 R126 T132	M124-Q128 HydrophobicContact CB-CB 4.25Å; M124-Q128 HydrophobicContact CG-CB 4.36Å; M124-Q128 HydrophobicContact SD-CB 4.49Å; K125-Q128 PolarHBondContact O-N 3.06Å; K125-Q128 VanDerWaalsContact O-N 3.16Å; R126-Q128 PolarHBondContact O-N 3.15Å; Q128-T132 WeakPolarHBondContact O-CB 3.38Å; Q128-T132 PolarHBondContact O-N 3.37Å; Q128-T132 PolarHBondContact O-OG1 2.97Å
129	L	93.2	Very high	90.6	Very high	7 Å²	7	87.2 Å²	87.2	4%	0.037	43%	0.43	C	S	.	.	H	α-helix	trans	-66.5	-44.8	175.2	-178.6	61	0	0	0	111	L109 R110 K113 T120 K125 R126 A127 T132 I133	L109-L129 HydrophobicContact CB-CD2 3.63Å; L109-L129 HydrophobicContact CB-CG 4.05Å; L109-L129 HydrophobicContact CD1-CD2 4.42Å; R110-L129 HydrophobicContact CG-CD2 4.17Å; K113-L129 HydrophobicContact CD-CD1 4.22Å; T120-L129 HydrophobicContact CG2-CD1 4.19Å; K125-L129 PolarHBondContact O-N 2.83Å; R126-L129 WeakPolarHBondContact O-CB 3.37Å; R126-L129 PolarHBondContact O-N 2.91Å; A127-L129 VanDerWaalsContact C-N 3.29Å; A127-L129 PolarHBondContact O-N 3.28Å; L129-T132 PolarHBondContact O-N 3.5Å; L129-I133 HydrophobicContact CD1-CD1 3.88Å; L129-I133 HydrophobicContact CD1-CG1 4.28Å; L129-I133 HydrophobicContact CG-CD1 3.84Å; L129-I133 WeakPolarHBondContact O-CB 3.49Å; L129-I133 VanDerWaalsContact O-CG1 3.26Å; L129-I133 WeakPolarHBondContact O-CG1 3.26Å; L129-I133 PolarHBondContact O-N 3.36Å
130	A	93.8	Very high	90.6	Very high	0 Å²	0	80.9 Å²	80.9	0%	0	40%	0.402	C	S	.	.	H	α-helix	trans	-60.1	-45.7	176	0	0	0	0	0	111.6	L101 Y102 L109 R126 A127 T132 I133 M134	L101-A130 HydrophobicContact CB-CB 4.45Å; Y102-A130 HydrophobicContact CD1-CB 4.36Å; Y102-A130 HydrophobicContact CD2-CB 4.46Å; Y102-A130 HydrophobicContact CE1-CB 4.43Å; Y102-A130 HydrophobicContact CE2-CB 4.48Å; Y102-A130 HydrophobicContact CG-CB 4.39Å; L109-A130 HydrophobicContact CD1-CB 4.27Å; R126-A130 PolarHBondContact O-N 3.33Å; A127-A130 WeakPolarHBondContact O-CB 3.28Å; A127-A130 PolarHBondContact O-N 3.43Å; A127-A130 VanDerWaalsContact O-N 3.15Å; A130-T132 PolarHBondContact O-N 2.91Å; A130-I133 PolarHBondContact O-N 3.12Å; A130-M134 WeakPolarHBondContact O-CB 3.35Å; A130-M134 PolarHBondContact O-N 3.46Å
131	D	91.9	Very high	90.8	Very high	68 Å²	68	84.8 Å²	84.8	36%	0.364	43%	0.428	S	S	.	.	H	α-helix	trans	-60.6	-43.5	176.6	-74.5	-29.7	0	0	0	112.9	Y102 A127 I133 M134 K135	Y102-D131 PolarHBondContact OH-OD1 2.93Å; Y102-D131 PolarHBondContact OH-OD2 3.25Å; A127-D131 PolarHBondContact O-N 2.8Å; D131-I133 VanDerWaalsContact C-N 3.33Å; D131-M134 PolarHBondContact O-N 3.19Å; D131-K135 WeakPolarHBondContact O-CG 3.48Å; D131-K135 PolarHBondContact O-N 3.16Å
132	T	92.6	Very high	91	Very high	39 Å²	39	80.8 Å²	80.8	24%	0.239	42%	0.421	C	S	.	.	H	α-helix	trans	-65.6	-41.9	179.5	-56.5	0	0	0	0	110.6	V118 T120 Q128 L129 A130 K135 H136	V118-T132 HydrophobicContact CG1-CG2 4Å; T120-T132 HydrophobicContact CG2-CG2 4.06Å; Q128-T132 WeakPolarHBondContact O-CB 3.38Å; Q128-T132 PolarHBondContact O-N 3.37Å; Q128-T132 PolarHBondContact O-OG1 2.97Å; L129-T132 PolarHBondContact O-N 3.5Å; A130-T132 PolarHBondContact O-N 2.91Å; T132-K135 PolarHBondContact O-N 3.36Å; T132-H136 PolarHBondContact O-N 3.44Å; T132-H136 VanDerWaalsContact O-N 3.16Å
133	I	94.3	Very high	91.5	Very high	1 Å²	1	77.4 Å²	77.4	1%	0.005	40%	0.403	C	S	.	.	H	α-helix	trans	-65.7	-43.3	175.8	-71.8	171	0	0	0	110.7	L101 L109 Y112 L129 A130 D131 K135 H136 F137	L101-I133 HydrophobicContact CD1-CB 4.34Å; L101-I133 HydrophobicContact CD1-CG2 3.66Å; L109-I133 HydrophobicContact CB-CD1 3.76Å; L109-I133 HydrophobicContact CD2-CD1 3.87Å; L109-I133 HydrophobicContact CG-CD1 4.4Å; L109-I133 WeakPolarHBondContact O-CD1 3.44Å; Y112-I133 HydrophobicContact CD1-CB 4.28Å; Y112-I133 HydrophobicContact CD1-CD1 4.14Å; Y112-I133 HydrophobicContact CD1-CG1 3.89Å; Y112-I133 HydrophobicContact CD1-CG2 3.5Å; Y112-I133 HydrophobicContact CD2-CG2 4.41Å; Y112-I133 HydrophobicContact CE1-CB 4.36Å; Y112-I133 HydrophobicContact CE1-CG1 4.31Å; Y112-I133 HydrophobicContact CE1-CG2 3.54Å; Y112-I133 HydrophobicContact CE2-CG2 4.42Å; Y112-I133 HydrophobicContact CG-CG2 3.97Å; L129-I133 HydrophobicContact CD1-CD1 3.88Å; L129-I133 HydrophobicContact CD1-CG1 4.28Å; L129-I133 HydrophobicContact CG-CD1 3.84Å; L129-I133 WeakPolarHBondContact O-CB 3.49Å; L129-I133 VanDerWaalsContact O-CG1 3.26Å; L129-I133 WeakPolarHBondContact O-CG1 3.26Å; L129-I133 PolarHBondContact O-N 3.36Å; A130-I133 PolarHBondContact O-N 3.12Å; D131-I133 VanDerWaalsContact C-N 3.33Å; I133-K135 VanDerWaalsContact C-N 3.3Å; I133-K135 PolarHBondContact O-N 2.99Å; I133-H136 CarbonylContact O-C 3.53Å; I133-H136 PolarHBondContact O-N 3.27Å; I133-H136 VanDerWaalsContact O-N 3.12Å; I133-F137 WeakPolarHBondContact O-CB 3.26Å; I133-F137 PolarHBondContact O-N 2.63Å
134	M	93	Very high	92	Very high	36 Å²	36	80.4 Å²	80.4	18%	0.177	40%	0.395	C	S	.	.	H	α-helix	trans	-56.6	-45.2	177.5	179.4	52.7	75.5	0	0	111.2	F98 P99 L101 A130 D131 H136 F137 K138	F98-M134 HydrophobicContact CB-CE 4.21Å; F98-M134 HydrophobicContact CB-SD 4.27Å; F98-M134 HydrophobicContact CD1-SD 4.33Å; P99-M134 WeakPolarHBondContact O-CE 3.09Å; L101-M134 HydrophobicContact CB-CE 4.29Å; L101-M134 HydrophobicContact CD1-CB 3.94Å; L101-M134 HydrophobicContact CD1-CE 3.7Å; L101-M134 HydrophobicContact CD1-SD 4.32Å; L101-M134 HydrophobicContact CG-CE 3.62Å; A130-M134 WeakPolarHBondContact O-CB 3.35Å; A130-M134 PolarHBondContact O-N 3.46Å; D131-M134 PolarHBondContact O-N 3.19Å; M134-H136 PolarHBondContact O-N 2.88Å; M134-F137 PolarHBondContact O-N 3.32Å; M134-K138 WeakPolarHBondContact O-CG 3.42Å; M134-K138 PolarHBondContact O-N 3.08Å
135	K	90.9	Very high	92.4	Very high	154 Å²	154	86.4 Å²	86.4	67%	0.67	42%	0.42	S	S	*	.	H	α-helix	trans	-61.2	-43.9	176.1	-71.4	173.3	-174.9	176	0	112.1	D131 T132 I133	D131-K135 WeakPolarHBondContact O-CG 3.48Å; D131-K135 PolarHBondContact O-N 3.16Å; T132-K135 PolarHBondContact O-N 3.36Å; I133-K135 VanDerWaalsContact C-N 3.3Å; I133-K135 PolarHBondContact O-N 2.99Å
136	H	94.7	Very high	92.6	Very high	48 Å²	48	83.1 Å²	83.1	22%	0.222	41%	0.407	C	S	.	.	H	α-helix	trans	-67.7	-40.7	176.8	174.9	-85.9	0	0	0	112.2	Y112 F116 V118 T132 I133 M134 K138 T139	Y112-H136 AromaticContact CE1-ND1 3.55Å; Y112-H136 AromaticContact CZ-ND1 3.64Å; Y112-H136 PolarHBondContact OH-ND1 2.68Å; F116-H136 VanDerWaalsContact CB-CE1 3.46Å; F116-H136 WeakPolarHBondContact CB-CE1 3.25Å; F116-H136 AromaticContact CD1-CE1 3.71Å; F116-H136 AromaticContact CG-CE1 3.65Å; V118-H136 HydrophobicContact CG1-CB 4.21Å; V118-H136 HydrophobicContact CG2-CB 4.16Å; T132-H136 PolarHBondContact O-N 3.44Å; T132-H136 VanDerWaalsContact O-N 3.16Å; I133-H136 CarbonylContact O-C 3.53Å; I133-H136 PolarHBondContact O-N 3.27Å; I133-H136 VanDerWaalsContact O-N 3.12Å; M134-H136 PolarHBondContact O-N 2.88Å; H136-K138 PolarHBondContact O-N 3.02Å; H136-T139 WeakPolarHBondContact O-CA 3.46Å; H136-T139 WeakPolarHBondContact O-CB 3.29Å; H136-T139 PolarHBondContact O-N 3.28Å; H136-T139 PolarHBondContact O-OG1 2.93Å
137	F	93.7	Very high	92.8	Very high	86 Å²	86	81.5 Å²	81.5	38%	0.377	41%	0.407	S	S	.	.	H	α-helix	trans	-55.8	-40.7	-178.7	-173.7	-95.8	0	0	0	111.9	P99 Y112 I133 M134 T139 I140	P99-F137 HydrophobicContact CG-CE1 4.14Å; Y112-F137 AromaticContact CE2-CD2 3.92Å; Y112-F137 HydrophobicContact CE2-CD2 3.92Å; Y112-F137 VanDerWaalsContact OH-CA 3.3Å; Y112-F137 WeakPolarHBondContact OH-CA 3.5Å; I133-F137 WeakPolarHBondContact O-CB 3.26Å; I133-F137 PolarHBondContact O-N 2.63Å; M134-F137 PolarHBondContact O-N 3.32Å; F137-T139 PolarHBondContact O-N 3.19Å; F137-T139 VanDerWaalsContact O-N 3.14Å; F137-I140 HydrophobicContact CD2-CD1 4.3Å; F137-I140 PolarHBondContact O-N 3.22Å
138	K	90.3	Very high	92.9	Very high	113 Å²	113	84.4 Å²	84.4	49%	0.491	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-13.9	175.3	-64.8	-177.5	-172.6	-150.5	0	114.7	F98 M134 H136	F98-K138 HydrophobicContact CD1-CD 4.36Å; F98-K138 VanDerWaalsContact CD1-CE 3.48Å; F98-K138 HydrophobicContact CD1-CG 4.29Å; F98-K138 HydrophobicContact CE1-CD 3.83Å; F98-K138 HydrophobicContact CE1-CG 3.8Å; F98-K138 VanDerWaalsContact CE2-NZ 3.29Å; F98-K138 HydrophobicContact CZ-CD 4.11Å; F98-K138 VanDerWaalsContact CZ-NZ 3.32Å; M134-K138 WeakPolarHBondContact O-CG 3.42Å; M134-K138 PolarHBondContact O-N 3.08Å; H136-K138 PolarHBondContact O-N 3.02Å
139	T	91.2	Very high	93	Very high	100 Å²	100	84 Å²	84	61%	0.613	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.6	-3	-179.9	66.9	0	0	0	0	113.4	H136 F137 P141	H136-T139 WeakPolarHBondContact O-CA 3.46Å; H136-T139 WeakPolarHBondContact O-CB 3.29Å; H136-T139 PolarHBondContact O-N 3.28Å; H136-T139 PolarHBondContact O-OG1 2.93Å; F137-T139 PolarHBondContact O-N 3.19Å; F137-T139 VanDerWaalsContact O-N 3.14Å; T139-P141 WeakPolarHBondContact O-CD 3.43Å
140	I	91	Very high	92.9	Very high	49 Å²	49	89.8 Å²	89.8	25%	0.251	44%	0.444	S	S	.	.	S	Bend	trans	-71.5	125.3	-179.7	-67.6	178.5	0	0	0	109.4	Y112 F116 F137 I142	Y112-I140 HydrophobicContact CE2-CD1 4.31Å; Y112-I140 WeakPolarHBondContact OH-CD1 3.48Å; F116-I140 HydrophobicContact CD1-CD1 4.17Å; F116-I140 HydrophobicContact CE1-CD1 3.67Å; F116-I140 HydrophobicContact CE1-CG1 4.29Å; F116-I140 HydrophobicContact CE2-CD1 4.16Å; F116-I140 HydrophobicContact CZ-CD1 3.66Å; F137-I140 HydrophobicContact CD2-CD1 4.3Å; F137-I140 PolarHBondContact O-N 3.22Å; I140-I142 PolarHBondContact O-N 3.47Å
141	P	92	Very high	92.9	Very high	117 Å²	117	96 Å²	96	76%	0.76	47%	0.471	S	S	*	.	P	Polyproline II helix	trans	-67.3	132.5	172.9	27.6	-33.5	0	0	0	110.6	T139	T139-P141 WeakPolarHBondContact O-CD 3.43Å
142	I	91.4	Very high	92.9	Very high	125 Å²	125	96.7 Å²	96.7	64%	0.641	48%	0.478	S	S	*	.	P	Polyproline II helix	trans	-101.7	116.7	-177.3	-60.2	178	0	0	0	108.5	I140 E144 I147	I140-I142 PolarHBondContact O-N 3.47Å; I142-E144 HydrophobicContact CG2-CG 3.94Å; I142-I147 HydrophobicContact CB-CD1 4.25Å; I142-I147 HydrophobicContact CG2-CD1 3.51Å
143	K	93.7	Very high	92.9	Very high	125 Å²	125	100.5 Å²	100.5	54%	0.543	49%	0.489	S	S	.	.			trans	-104.5	87.9	169.2	-69.7	-176.9	174.8	-177.8	0	109.4	K145 E146 I147	K143-K145 VanDerWaalsContact C-N 3.34Å; K143-K145 PolarHBondContact O-N 3.16Å; K143-E146 HydrophobicContact CB-CB 4.19Å; K143-E146 HydrophobicContact CB-CG 4.33Å; K143-E146 HydrophobicContact CD-CG 4.36Å; K143-E146 VanDerWaalsContact CD-OE1 3.26Å; K143-E146 WeakPolarHBondContact CD-OE1 3.19Å; K143-E146 VanDerWaalsContact CD-OE2 3.28Å; K143-E146 WeakPolarHBondContact CD-OE2 3.5Å; K143-E146 IonicContact NZ-OE1 3.63Å; K143-E146 PolarHBondContact NZ-OE1 3.13Å; K143-E146 IonicContact NZ-OE2 3.33Å; K143-E146 PolarHBondContact O-N 3.02Å; K143-I147 WeakPolarHBondContact O-CG1 3.26Å; K143-I147 PolarHBondContact O-N 2.9Å
144	E	93.6	Very high	92.7	Very high	144 Å²	144	103.7 Å²	103.7	67%	0.673	50%	0.504	S	S	*	.	H	α-helix	trans	-52.2	-48.2	-168.3	-60.8	-178.8	143.9	0	0	113.3	I142 E146 I147 I148	I142-E144 HydrophobicContact CG2-CG 3.94Å; E144-E146 VanDerWaalsContact C-N 3.34Å; E144-E146 PolarHBondContact O-N 3.48Å; E144-I147 PolarHBondContact O-N 2.96Å; E144-I148 WeakPolarHBondContact O-CB 3.41Å; E144-I148 VanDerWaalsContact O-CG1 3.3Å; E144-I148 WeakPolarHBondContact O-CG1 3.46Å; E144-I148 PolarHBondContact O-N 3.18Å
145	K	94.6	Very high	92.7	Very high	180 Å²	180	106.4 Å²	106.4	78%	0.783	52%	0.523	S	S	*	.	H	α-helix	trans	-56.3	-45.7	178.9	-177.9	176.9	177.2	178.9	0	112.6	K143 T149	K143-K145 VanDerWaalsContact C-N 3.34Å; K143-K145 PolarHBondContact O-N 3.16Å; K145-T149 WeakPolarHBondContact O-CB 3.22Å; K145-T149 PolarHBondContact O-N 3.4Å; K145-T149 VanDerWaalsContact O-N 3.17Å; K145-T149 PolarHBondContact O-OG1 2.97Å
146	E	94.1	Very high	92.7	Very high	92 Å²	92	107.8 Å²	107.8	43%	0.43	53%	0.529	S	S	.	.	H	α-helix	trans	-67	-46.9	178.8	-68.6	179.7	-164.3	0	0	110.2	K143 E144 I148 T149 F150	K143-E146 HydrophobicContact CB-CB 4.19Å; K143-E146 HydrophobicContact CB-CG 4.33Å; K143-E146 HydrophobicContact CD-CG 4.36Å; K143-E146 VanDerWaalsContact CD-OE1 3.26Å; K143-E146 WeakPolarHBondContact CD-OE1 3.19Å; K143-E146 VanDerWaalsContact CD-OE2 3.28Å; K143-E146 WeakPolarHBondContact CD-OE2 3.5Å; K143-E146 IonicContact NZ-OE1 3.63Å; K143-E146 PolarHBondContact NZ-OE1 3.13Å; K143-E146 IonicContact NZ-OE2 3.33Å; K143-E146 PolarHBondContact O-N 3.02Å; E144-E146 VanDerWaalsContact C-N 3.34Å; E144-E146 PolarHBondContact O-N 3.48Å; E146-I148 PolarHBondContact O-N 3.36Å; E146-T149 PolarHBondContact O-N 2.93Å; E146-F150 HydrophobicContact CB-CD2 4.27Å; E146-F150 HydrophobicContact CB-CE2 4.14Å; E146-F150 WeakPolarHBondContact O-CD2 3.4Å; E146-F150 PolarHBondContact O-N 3.36Å
147	I	93.9	Very high	92.5	Very high	89 Å²	89	110.2 Å²	110.2	46%	0.456	54%	0.541	S	S	.	.	H	α-helix	trans	-59.5	-49.2	-177.7	-68.3	165.9	0	0	0	111.3	I142 K143 E144 T149 F150 F151	I142-I147 HydrophobicContact CB-CD1 4.25Å; I142-I147 HydrophobicContact CG2-CD1 3.51Å; K143-I147 WeakPolarHBondContact O-CG1 3.26Å; K143-I147 PolarHBondContact O-N 2.9Å; E144-I147 PolarHBondContact O-N 2.96Å; I147-T149 PolarHBondContact O-N 3.33Å; I147-F150 PolarHBondContact O-N 3.03Å; I147-F151 VanDerWaalsContact O-CB 3.27Å; I147-F151 WeakPolarHBondContact O-CB 3.32Å; I147-F151 PolarHBondContact O-N 3.17Å
148	I	95.1	Very high	92.1	Very high	105 Å²	105	109.7 Å²	109.7	54%	0.538	56%	0.56	S	S	.	*	H	α-helix	trans	-62.9	-44.6	179.1	-65.6	166.5	0	0	0	110.2	E144 E146 F150 F151 V152	E144-I148 WeakPolarHBondContact O-CB 3.41Å; E144-I148 VanDerWaalsContact O-CG1 3.3Å; E144-I148 WeakPolarHBondContact O-CG1 3.46Å; E144-I148 PolarHBondContact O-N 3.18Å; E146-I148 PolarHBondContact O-N 3.36Å; I148-F150 PolarHBondContact O-N 2.97Å; I148-F151 PolarHBondContact O-N 3.43Å; I148-V152 HydrophobicContact CG2-CG2 4.32Å; I148-V152 WeakPolarHBondContact O-CG2 3.4Å; I148-V152 PolarHBondContact O-N 3.48Å
149	T	94	Very high	91.4	Very high	86 Å²	86	106.3 Å²	106.3	53%	0.528	55%	0.551	S	S	.	*	H	α-helix	trans	-60.6	-48	179.3	-57.9	0	0	0	0	111.4	K145 E146 I147 Y153	K145-T149 WeakPolarHBondContact O-CB 3.22Å; K145-T149 PolarHBondContact O-N 3.4Å; K145-T149 VanDerWaalsContact O-N 3.17Å; K145-T149 PolarHBondContact O-OG1 2.97Å; E146-T149 PolarHBondContact O-N 2.93Å; I147-T149 PolarHBondContact O-N 3.33Å; T149-Y153 VanDerWaalsContact O-CB 3.29Å; T149-Y153 WeakPolarHBondContact O-CB 3.42Å; T149-Y153 PolarHBondContact O-N 3Å
150	F	91	Very high	90.6	Very high	129 Å²	129	104.5 Å²	104.5	57%	0.566	54%	0.538	S	S	*	.	H	α-helix	trans	-63.8	-41.4	177.1	-75.8	-59	0	0	0	111.9	E146 I147 I148 Y153 M154	E146-F150 HydrophobicContact CB-CD2 4.27Å; E146-F150 HydrophobicContact CB-CE2 4.14Å; E146-F150 WeakPolarHBondContact O-CD2 3.4Å; E146-F150 PolarHBondContact O-N 3.36Å; I147-F150 PolarHBondContact O-N 3.03Å; I148-F150 PolarHBondContact O-N 2.97Å; F150-Y153 PolarHBondContact O-N 3.15Å; F150-M154 HydrophobicContact CB-CE 4.45Å; F150-M154 WeakPolarHBondContact O-CB 3.31Å; F150-M154 WeakPolarHBondContact O-CE 3.25Å; F150-M154 VanDerWaalsContact O-CG 3.26Å; F150-M154 WeakPolarHBondContact O-CG 3.25Å; F150-M154 PolarHBondContact O-N 3.05Å
151	F	93.2	Very high	89.4	Confident	130 Å²	130	109.7 Å²	109.7	57%	0.57	56%	0.558	S	S	*	*	H	α-helix	trans	-60.8	-53.5	177.9	176.1	-104.3	0	0	0	111.8	I147 I148 Y153 M154 V155	I147-F151 VanDerWaalsContact O-CB 3.27Å; I147-F151 WeakPolarHBondContact O-CB 3.32Å; I147-F151 PolarHBondContact O-N 3.17Å; I148-F151 PolarHBondContact O-N 3.43Å; F151-Y153 VanDerWaalsContact C-N 3.29Å; F151-Y153 PolarHBondContact O-N 3.15Å; F151-M154 PolarHBondContact O-N 3.24Å; F151-V155 HydrophobicContact CD2-CG2 4.25Å; F151-V155 HydrophobicContact CE1-CG2 4.17Å; F151-V155 HydrophobicContact CE2-CG2 3.86Å; F151-V155 HydrophobicContact CZ-CG2 3.81Å; F151-V155 WeakPolarHBondContact O-CG2 3.45Å; F151-V155 PolarHBondContact O-N 2.98Å
152	V	93.6	Very high	88	Confident	83 Å²	83	109.6 Å²	109.6	50%	0.503	55%	0.551	S	S	.	*	H	α-helix	trans	-58.9	-42.8	178.1	172.8	0	0	0	0	110.9	I148 V155 K156	I148-V152 HydrophobicContact CG2-CG2 4.32Å; I148-V152 WeakPolarHBondContact O-CG2 3.4Å; I148-V152 PolarHBondContact O-N 3.48Å; V152-V155 PolarHBondContact O-N 3.46Å; V152-K156 VanDerWaalsContact O-CB 3.25Å; V152-K156 WeakPolarHBondContact O-CB 3.46Å; V152-K156 PolarHBondContact O-N 2.94Å
153	Y	91.4	Very high	86.6	Confident	118 Å²	118	108 Å²	108	46%	0.463	54%	0.544	S	S	.	.	H	α-helix	trans	-60.4	-48.9	175.8	177.3	-90.8	0	0	0	112.1	T149 F150 F151 V155 K156 M157	T149-Y153 VanDerWaalsContact O-CB 3.29Å; T149-Y153 WeakPolarHBondContact O-CB 3.42Å; T149-Y153 PolarHBondContact O-N 3Å; F150-Y153 PolarHBondContact O-N 3.15Å; F151-Y153 VanDerWaalsContact C-N 3.29Å; F151-Y153 PolarHBondContact O-N 3.15Å; Y153-V155 PolarHBondContact O-N 3.48Å; Y153-K156 PolarHBondContact O-N 2.83Å; Y153-M157 HydrophobicContact CD1-CG 4.21Å; Y153-M157 HydrophobicContact CD2-CG 4.15Å; Y153-M157 HydrophobicContact CE1-CG 3.84Å; Y153-M157 HydrophobicContact CE2-CG 3.79Å; Y153-M157 HydrophobicContact CE2-SD 4.35Å; Y153-M157 HydrophobicContact CG-CG 4.35Å; Y153-M157 VanDerWaalsContact O-CB 3.31Å; Y153-M157 WeakPolarHBondContact O-CB 3.33Å; Y153-M157 WeakPolarHBondContact O-CG 3.33Å; Y153-M157 PolarHBondContact O-N 3.44Å
154	M	91.2	Very high	84.7	Confident	68 Å²	68	109.3 Å²	109.3	34%	0.335	55%	0.552	S	S	.	*	H	α-helix	trans	-62.1	-42.3	-179.8	-75.3	-174.6	-64.9	0	0	112.2	F150 F151 G158 S159	F150-M154 HydrophobicContact CB-CE 4.45Å; F150-M154 WeakPolarHBondContact O-CB 3.31Å; F150-M154 WeakPolarHBondContact O-CE 3.25Å; F150-M154 VanDerWaalsContact O-CG 3.26Å; F150-M154 WeakPolarHBondContact O-CG 3.25Å; F150-M154 PolarHBondContact O-N 3.05Å; F151-M154 PolarHBondContact O-N 3.24Å; M154-G158 PolarHBondContact O-N 2.96Å; M154-S159 PolarHBondContact O-N 2.98Å
155	V	91.8	Very high	82.7	Confident	93 Å²	93	111.6 Å²	111.6	56%	0.564	56%	0.559	S	S	*	*	H	α-helix	trans	-65.1	-48	177.3	173.8	0	0	0	0	110.6	F151 V152 Y153 M157 G158	F151-V155 HydrophobicContact CD2-CG2 4.25Å; F151-V155 HydrophobicContact CE1-CG2 4.17Å; F151-V155 HydrophobicContact CE2-CG2 3.86Å; F151-V155 HydrophobicContact CZ-CG2 3.81Å; F151-V155 WeakPolarHBondContact O-CG2 3.45Å; F151-V155 PolarHBondContact O-N 2.98Å; V152-V155 PolarHBondContact O-N 3.46Å; Y153-V155 PolarHBondContact O-N 3.48Å; V155-M157 VanDerWaalsContact C-N 3.3Å; V155-M157 PolarHBondContact O-N 3.34Å; V155-G158 PolarHBondContact O-N 3.29Å; V155-G158 VanDerWaalsContact O-N 3.17Å
156	K	91.9	Very high	80.5	Confident	184 Å²	184	108 Å²	108	80%	0.8	55%	0.549	S	S	*	.	H	α-helix	trans	-62	-36.7	179.1	-176.8	175.5	178.3	176.5	0	112.6	V152 Y153 G158	V152-K156 VanDerWaalsContact O-CB 3.25Å; V152-K156 WeakPolarHBondContact O-CB 3.46Å; V152-K156 PolarHBondContact O-N 2.94Å; Y153-K156 PolarHBondContact O-N 2.83Å; K156-G158 VanDerWaalsContact C-N 3.31Å
157	M	89.6	Confident	77.9	Confident	98 Å²	98	107.2 Å²	107.2	48%	0.483	57%	0.566	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83	-4.3	-179.9	-67.9	-57.5	-52.6	0	0	113.7	Y153 V155 S159	Y153-M157 HydrophobicContact CD1-CG 4.21Å; Y153-M157 HydrophobicContact CD2-CG 4.15Å; Y153-M157 HydrophobicContact CE1-CG 3.84Å; Y153-M157 HydrophobicContact CE2-CG 3.79Å; Y153-M157 HydrophobicContact CE2-SD 4.35Å; Y153-M157 HydrophobicContact CG-CG 4.35Å; Y153-M157 VanDerWaalsContact O-CB 3.31Å; Y153-M157 WeakPolarHBondContact O-CB 3.33Å; Y153-M157 WeakPolarHBondContact O-CG 3.33Å; Y153-M157 PolarHBondContact O-N 3.44Å; V155-M157 VanDerWaalsContact C-N 3.3Å; V155-M157 PolarHBondContact O-N 3.34Å; M157-S159 PolarHBondContact O-N 3.27Å; M157-S159 PolarHBondContact O-OG 2.85Å; M157-S159 VanDerWaalsContact O-OG 3.11Å
158	G	85.3	Confident	75.3	Confident	75 Å²	75	111.8 Å²	111.8	77%	0.773	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	56.9	21.2	-177.2	0	0	0	0	0	114	M154 V155 K156	M154-G158 PolarHBondContact O-N 2.96Å; V155-G158 PolarHBondContact O-N 3.29Å; V155-G158 VanDerWaalsContact O-N 3.17Å; K156-G158 VanDerWaalsContact C-N 3.31Å
159	S	74.8	Confident	72.5	Confident	42 Å²	42	109.7 Å²	109.7	29%	0.294	59%	0.594	S	S	.	*			trans	-141.8	120.2	-171.8	51.4	0	0	0	0	111.7	M154 M157	M154-S159 PolarHBondContact O-N 2.98Å; M157-S159 PolarHBondContact O-N 3.27Å; M157-S159 PolarHBondContact O-OG 2.85Å; M157-S159 VanDerWaalsContact O-OG 3.11Å
160	N	75.8	Confident	69.9	Low	63 Å²	63	113.5 Å²	113.5	34%	0.337	61%	0.611	S	S	.	*			trans	-90	109	165.8	-174.9	-3.6	0	0	0	108.3	L162 D163	N160-L162 PolarHBondContact O-N 2.97Å; N160-L162 VanDerWaalsContact OD1-CB 3.25Å; N160-L162 WeakPolarHBondContact OD1-CB 3.41Å; N160-L162 PolarHBondContact OD1-N 2.72Å; N160-D163 HydrophobicContact CB-CB 4.33Å; N160-D163 PolarHBondContact O-N 3.11Å
161	K	64.9	Low	67.7	Low	157 Å²	157	115.1 Å²	115.1	68%	0.683	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.9	-20.4	176.2	-68.2	-172.1	178.4	-173.4	0	112.5
162	L	63.5	Low	65	Low	115 Å²	115	115.1 Å²	115.1	60%	0.602	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.7	-11.3	178.7	-54.6	176.2	0	0	0	114.2	N160	N160-L162 PolarHBondContact O-N 2.97Å; N160-L162 VanDerWaalsContact OD1-CB 3.25Å; N160-L162 WeakPolarHBondContact OD1-CB 3.41Å; N160-L162 PolarHBondContact OD1-N 2.72Å
163	D	61.6	Low	62.6	Low	93 Å²	93	121 Å²	121	50%	0.497	67%	0.673	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85.3	-19.9	179.2	-107	-15.6	0	0	0	113.9	R111 N160 K165	R111-D163 IonicContact CZ-OD1 3.73Å; R111-D163 IonicContact NH1-OD1 2.85Å; R111-D163 PolarHBondContact NH1-OD1 2.98Å; R111-D163 IonicContact NH2-OD1 3.44Å; N160-D163 HydrophobicContact CB-CB 4.33Å; N160-D163 PolarHBondContact O-N 3.11Å; D163-K165 PolarHBondContact O-N 2.83Å
164	Q	54.6	Low	61.1	Low	151 Å²	151	121.1 Å²	121.1	71%	0.706	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.3	15.4	-168.6	-67.1	-173.1	2.7	0	0	116
165	K	51.2	Low	59.5	Low	192 Å²	192	123.9 Å²	123.9	84%	0.835	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.4	12.8	-178.7	-146.1	170.5	176	172.5	0	116.6	D163	D163-K165 PolarHBondContact O-N 2.83Å
166	N	48	Very low	57.7	Low	105 Å²	105	125.6 Å²	125.6	56%	0.561	71%	0.709	S	S	*	*	S	Bend	trans	-141.3	69.4	-179.9	-88.8	79.1	0	0	0	111.8
167	G	39	Very low	55.7	Low	76 Å²	76	122.2 Å²	122.2	78%	0.784	70%	0.704	S	S	*	*			trans	147.7	6.7	160	0	0	0	0	0	120.9	G169	G167-G169 PolarHBondContact O-N 3.2Å
168	L	40.3	Very low	53.6	Low	184 Å²	184	123.7 Å²	123.7	96%	0.963	72%	0.718	S	S	*	*			trans	-81.6	98.6	171.4	-78.1	158.1	0	0	0	109.6
169	G	36.4	Very low	51.5	Low	61 Å²	61	126.9 Å²	126.9	63%	0.629	71%	0.714	S	S	*	*			trans	177.1	55	175.5	0	0	0	0	0	110.4	G167	G167-G169 PolarHBondContact O-N 3.2Å
170	N	38.3	Very low	49.8	Very low	166 Å²	166	133 Å²	133	89%	0.888	74%	0.744	S	S	*	*			trans	-161.5	82.2	153.9	-94	-3	0	0	0	105.9
171	D	45	Very low	47.8	Very low	163 Å²	163	138.4 Å²	138.4	87%	0.872	78%	0.775	S	S	*	*			trans	-62.3	136.5	165.6	-89.3	-59.9	0	0	0	109.8	T173	D171-T173 PolarHBondContact O-N 3.45Å
172	T	36.5	Very low	46.4	Very low	130 Å²	130	136.8 Å²	136.8	80%	0.798	78%	0.783	S	S	*	*			trans	-47.5	120	162.2	-48.1	0	0	0	0	111.4
173	T	42.6	Very low	44.9	Very low	206 Å²	206	138.8 Å²	138.8	100%	1.264	80%	0.8	S	S	*	*			trans	147.6	0	137.4	-49.7	0	0	0	0	109.8	D171	D171-T173 PolarHBondContact O-N 3.45Å

Retrieved 173 of 173 residues in 128.4 ms (Link to these results)

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