A0A077ZLM4_TRITR Loading...

Putative bap28

AlphaFold DB , UniProt , Accession A0A077ZLM4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 76 aa.

						>A0A077ZLM4_TRITR|A0A077ZLM4
MLRSVFGAVADCRSEELRLPGVAFSPAGRERARGLSAPRRLLWMKCLVTLANHVGTTWLPELAICLLVVSLEKACI
					

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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	50.7	Low	58.7	Low	150 Å²	150	81 Å²	81	74%	0.739	42%	0.42	S	S	*	.				0	-61.8	0	-117.2	167.3	178.5	0	0	112.9	R3 S4 V5 E61	M1-R3 VanDerWaalsContact C-N 3.32Å; M1-R3 PolarHBondContact O-N 3.06Å; M1-S4 WeakPolarHBondContact O-CB 3.48Å; M1-S4 PolarHBondContact O-N 3.44Å; M1-V5 PolarHBondContact O-N 2.89Å; M1-E61 VanDerWaalsContact CE-OE1 3.29Å; M1-E61 WeakPolarHBondContact CE-OE1 3.5Å
2	L	50.4	Low	59.1	Low	116 Å²	116	74.8 Å²	74.8	61%	0.607	39%	0.389	S	S	*	.	H	α-helix	trans	-52	-42.3	179.1	-87.6	139.7	0	0	0	114.4	S4 V5 F6	L2-S4 PolarHBondContact O-N 3.23Å; L2-V5 PolarHBondContact O-N 3.31Å; L2-V5 VanDerWaalsContact O-N 3.13Å; L2-F6 HydrophobicContact CB-CD2 4.34Å; L2-F6 HydrophobicContact CB-CE2 4.29Å; L2-F6 HydrophobicContact CD2-CD2 4.45Å; L2-F6 HydrophobicContact CD2-CE2 3.72Å; L2-F6 HydrophobicContact CD2-CZ 4.49Å; L2-F6 WeakPolarHBondContact O-CD2 3.31Å; L2-F6 PolarHBondContact O-N 3.18Å
3	R	57.7	Low	59.2	Low	230 Å²	230	78.5 Å²	78.5	87%	0.868	39%	0.394	S	S	*	.	H	α-helix	trans	-57.3	-34.8	175.9	-73.5	177.7	102.6	158.9	4.1	113.2	M1 G7	M1-R3 VanDerWaalsContact C-N 3.32Å; M1-R3 PolarHBondContact O-N 3.06Å; R3-G7 PolarHBondContact O-N 2.85Å
4	S	60.4	Low	59.5	Low	43 Å²	43	77.3 Å²	77.3	30%	0.301	40%	0.397	S	S	.	.	H	α-helix	trans	-68.7	-41.4	177.8	-50.5	0	0	0	0	111.1	M1 L2 G7 A8 H53	M1-S4 WeakPolarHBondContact O-CB 3.48Å; M1-S4 PolarHBondContact O-N 3.44Å; L2-S4 PolarHBondContact O-N 3.23Å; S4-G7 PolarHBondContact O-N 3.04Å; S4-A8 PolarHBondContact O-N 2.97Å; S4-H53 WeakPolarHBondContact CB-O 3.43Å
5	V	54.5	Low	59.4	Low	11 Å²	11	75.3 Å²	75.3	7%	0.067	39%	0.385	C	S	.	.	H	α-helix	trans	-65.9	-46	175.6	-179.3	0	0	0	0	110.8	M1 L2 G7 A8 V9 L50 V54 E61 I64	M1-V5 PolarHBondContact O-N 2.89Å; L2-V5 PolarHBondContact O-N 3.31Å; L2-V5 VanDerWaalsContact O-N 3.13Å; V5-G7 VanDerWaalsContact C-N 3.3Å; V5-G7 PolarHBondContact O-N 3.39Å; V5-A8 PolarHBondContact O-N 3.48Å; V5-V9 WeakPolarHBondContact O-CG2 3.22Å; V5-V9 PolarHBondContact O-N 3.08Å; V5-L50 HydrophobicContact CB-CD1 4.47Å; V5-L50 HydrophobicContact CG1-CD1 4.17Å; V5-L50 HydrophobicContact CG2-CD1 4.38Å; V5-V54 HydrophobicContact CG2-CG2 4.22Å; V5-E61 HydrophobicContact CG2-CG 4.18Å; V5-I64 HydrophobicContact CG1-CG2 4.16Å
6	F	57.6	Low	59.1	Low	141 Å²	141	72.3 Å²	72.3	62%	0.618	37%	0.369	S	S	*	.	H	α-helix	trans	-61.9	-37.9	174.8	-77.8	-68.2	0	0	0	112.4	L2 V9 A10	L2-F6 HydrophobicContact CB-CD2 4.34Å; L2-F6 HydrophobicContact CB-CE2 4.29Å; L2-F6 HydrophobicContact CD2-CD2 4.45Å; L2-F6 HydrophobicContact CD2-CE2 3.72Å; L2-F6 HydrophobicContact CD2-CZ 4.49Å; L2-F6 WeakPolarHBondContact O-CD2 3.31Å; L2-F6 PolarHBondContact O-N 3.18Å; F6-V9 PolarHBondContact O-N 2.85Å; F6-A10 WeakPolarHBondContact O-CB 3.31Å; F6-A10 PolarHBondContact O-N 2.95Å
7	G	60.7	Low	58.9	Low	31 Å²	31	76.9 Å²	76.9	32%	0.32	39%	0.394	S	S	.	.	H	α-helix	trans	-60.9	-46.8	173.2	0	0	0	0	0	112.1	R3 S4 V5 A10 D11	R3-G7 PolarHBondContact O-N 2.85Å; S4-G7 PolarHBondContact O-N 3.04Å; V5-G7 VanDerWaalsContact C-N 3.3Å; V5-G7 PolarHBondContact O-N 3.39Å; G7-A10 PolarHBondContact O-N 2.81Å; G7-D11 WeakPolarHBondContact O-CB 3.26Å; G7-D11 PolarHBondContact O-N 3.41Å
8	A	61.4	Low	59.1	Low	1 Å²	1	83.3 Å²	83.3	1%	0.008	41%	0.412	C	S	.	.	H	α-helix	trans	-61.5	-45.3	175.8	0	0	0	0	0	111.9	S4 V5 A10 D11 C12 T49 L50 H53	S4-A8 PolarHBondContact O-N 2.97Å; V5-A8 PolarHBondContact O-N 3.48Å; A8-A10 VanDerWaalsContact C-N 3.31Å; A8-A10 PolarHBondContact O-N 2.85Å; A8-D11 WeakPolarHBondContact O-CB 3.26Å; A8-D11 PolarHBondContact O-N 3.22Å; A8-C12 PolarHBondContact O-N 2.94Å; A8-C12 PolarHBondContact O-SG 3.21Å; A8-T49 HydrophobicContact CB-CG2 4.42Å; A8-L50 HydrophobicContact CB-CB 4.17Å; A8-L50 HydrophobicContact CB-CD1 3.64Å; A8-H53 HydrophobicContact CB-CB 4.37Å
9	V	63.1	Low	58.8	Low	42 Å²	42	82.3 Å²	82.3	26%	0.255	41%	0.408	S	S	.	.	H	α-helix	trans	-62.2	-40.2	177	173.7	0	0	0	0	111.3	V5 F6 C12 R13	V5-V9 WeakPolarHBondContact O-CG2 3.22Å; V5-V9 PolarHBondContact O-N 3.08Å; F6-V9 PolarHBondContact O-N 2.85Å; V9-C12 PolarHBondContact O-N 2.86Å; V9-R13 PolarHBondContact O-N 3.17Å
10	A	63.5	Low	58.5	Low	55 Å²	55	83.5 Å²	83.5	46%	0.455	42%	0.422	S	S	.	.	H	α-helix	trans	-64.9	-41.1	175.6	0	0	0	0	0	111.9	F6 G7 A8 R13 S14	F6-A10 WeakPolarHBondContact O-CB 3.31Å; F6-A10 PolarHBondContact O-N 2.95Å; G7-A10 PolarHBondContact O-N 2.81Å; A8-A10 VanDerWaalsContact C-N 3.31Å; A8-A10 PolarHBondContact O-N 2.85Å; A10-R13 PolarHBondContact O-N 3.23Å; A10-S14 WeakPolarHBondContact O-CB 3.32Å; A10-S14 PolarHBondContact O-N 3.47Å
11	D	66	Low	58	Low	71 Å²	71	79.8 Å²	79.8	38%	0.38	41%	0.405	S	S	.	.	H	α-helix	trans	-62.4	-46	175.3	-166.2	-103.9	0	0	0	111.1	G7 A8 R13 S14 E15 T49	G7-D11 WeakPolarHBondContact O-CB 3.26Å; G7-D11 PolarHBondContact O-N 3.41Å; A8-D11 WeakPolarHBondContact O-CB 3.26Å; A8-D11 PolarHBondContact O-N 3.22Å; D11-R13 VanDerWaalsContact C-N 3.34Å; D11-R13 PolarHBondContact O-N 2.93Å; D11-S14 WeakPolarHBondContact O-CB 3.21Å; D11-S14 PolarHBondContact O-N 3.36Å; D11-S14 VanDerWaalsContact O-N 3.09Å; D11-E15 PolarHBondContact O-N 3.26Å; D11-T49 HydrophobicContact CB-CG2 4.16Å
12	C	62.9	Low	57.7	Low	7 Å²	7	73 Å²	73	5%	0.047	37%	0.372	C	S	.	.	H	α-helix	trans	-59.3	-42.8	174.4	-56	0	0	0	0	112	A8 V9 S14 E15 E16 F24 C46	A8-C12 PolarHBondContact O-N 2.94Å; A8-C12 PolarHBondContact O-SG 3.21Å; V9-C12 PolarHBondContact O-N 2.86Å; C12-S14 VanDerWaalsContact C-N 3.35Å; C12-E15 PolarHBondContact O-N 2.87Å; C12-E16 PolarHBondContact O-N 2.81Å; C12-F24 HydrophobicContact CB-CD2 4.29Å; C12-F24 HydrophobicContact CB-CE2 3.92Å; C12-F24 HydrophobicContact CB-CZ 4.05Å; C12-F24 WeakPolarHBondContact O-CE2 3.14Å; C12-C46 HydrophobicContact CB-CB 3.89Å; C12-C46 WeakPolarHBondContact CB-SG 3.03Å; C12-C46 WeakPolarHBondContact SG-CA 3.16Å; C12-C46 WeakPolarHBondContact SG-CB 3.27Å; C12-C46 CovalentContact SG-SG 2.03Å; C12-C46 PolarHBondContact SG-SG 3.2Å
13	R	61.1	Low	57.7	Low	122 Å²	122	67.9 Å²	67.9	46%	0.46	35%	0.347	S	S	.	.	H	α-helix	trans	-64.1	-38.3	174.5	-81.5	-170.7	173.3	-172	-1.4	112.6	V9 A10 D11 E15 E16 L17 E72	V9-R13 PolarHBondContact O-N 3.17Å; A10-R13 PolarHBondContact O-N 3.23Å; D11-R13 VanDerWaalsContact C-N 3.34Å; D11-R13 PolarHBondContact O-N 2.93Å; R13-E15 VanDerWaalsContact C-N 3.26Å; R13-E15 PolarHBondContact O-N 3.3Å; R13-E16 WeakPolarHBondContact O-CB 3.29Å; R13-E16 PolarHBondContact O-N 3.39Å; R13-L17 PolarHBondContact O-N 2.9Å; R13-E72 IonicContact NH2-OE1 3.62Å
14	S	62.4	Low	57.6	Low	62 Å²	62	58.2 Å²	58.2	43%	0.434	31%	0.311	S	S	.	.	H	α-helix	trans	-63.4	-36.9	175.8	-154.3	0	0	0	0	111	A10 D11 C12 L17 R18	A10-S14 WeakPolarHBondContact O-CB 3.32Å; A10-S14 PolarHBondContact O-N 3.47Å; D11-S14 WeakPolarHBondContact O-CB 3.21Å; D11-S14 PolarHBondContact O-N 3.36Å; D11-S14 VanDerWaalsContact O-N 3.09Å; C12-S14 VanDerWaalsContact C-N 3.35Å; S14-L17 WeakPolarHBondContact O-CB 3.33Å; S14-L17 PolarHBondContact O-N 3.46Å; S14-R18 PolarHBondContact O-N 2.99Å
15	E	58.1	Low	57.2	Low	47 Å²	47	57.2 Å²	57.2	22%	0.22	30%	0.304	C	S	.	.	H	α-helix	trans	-74.9	-31.1	175.6	-154	145.6	114.8	0	0	112.7	D11 C12 R13 L17 R18 L19 L42 K45	D11-E15 PolarHBondContact O-N 3.26Å; C12-E15 PolarHBondContact O-N 2.87Å; R13-E15 VanDerWaalsContact C-N 3.26Å; R13-E15 PolarHBondContact O-N 3.3Å; E15-L17 VanDerWaalsContact C-N 3.34Å; E15-R18 PolarHBondContact O-N 3.38Å; E15-L19 HydrophobicContact CG-CD1 3.83Å; E15-L19 PolarHBondContact O-N 3.38Å; E15-L19 VanDerWaalsContact O-N 3.1Å; E15-L42 HydrophobicContact CB-CD2 4.31Å; E15-L42 HydrophobicContact CG-CD2 3.67Å; E15-K45 WeakPolarHBondContact OE1-CD 3.26Å; E15-K45 IonicContact OE1-NZ 2.85Å; E15-K45 PolarHBondContact OE1-NZ 2.84Å
16	E	54.6	Low	57.2	Low	27 Å²	27	59.8 Å²	59.8	13%	0.126	32%	0.321	C	S	.	.	H	α-helix	trans	-58.1	-43.1	165.5	148.6	178.4	168.3	0	0	111.9	C12 R13 R18 L19 V22 A23 F24 S25	C12-E16 PolarHBondContact O-N 2.81Å; R13-E16 WeakPolarHBondContact O-CB 3.29Å; R13-E16 PolarHBondContact O-N 3.39Å; E16-R18 PolarHBondContact O-N 3.13Å; E16-L19 PolarHBondContact O-N 2.85Å; E16-V22 WeakPolarHBondContact CG-O 3.26Å; E16-A23 VanDerWaalsContact CD-CA 3.44Å; E16-A23 HydrophobicContact CG-CB 4.33Å; E16-A23 VanDerWaalsContact OE2-CA 3.3Å; E16-A23 WeakPolarHBondContact OE2-CA 3.07Å; E16-F24 HydrophobicContact CB-CD2 3.7Å; E16-F24 HydrophobicContact CB-CE2 3.97Å; E16-F24 WeakPolarHBondContact OE2-CA 3.33Å; E16-F24 VanDerWaalsContact OE2-CB 3.22Å; E16-F24 WeakPolarHBondContact OE2-CB 3.27Å; E16-F24 WeakPolarHBondContact OE2-CD2 3.33Å; E16-F24 PolarHBondContact OE2-N 3.32Å; E16-S25 WeakPolarHBondContact OE1-CB 3.39Å; E16-S25 PolarHBondContact OE1-OG 2.73Å; E16-S25 PolarHBondContact OE2-N 3.29Å
17	L	56.8	Low	56.9	Low	151 Å²	151	56.6 Å²	56.6	79%	0.791	32%	0.32	S	S	*	.	H	α-helix	trans	-63.6	-31	176.3	-82.4	151.6	0	0	0	112.6	R13 S14 E15	R13-L17 PolarHBondContact O-N 2.9Å; S14-L17 WeakPolarHBondContact O-CB 3.33Å; S14-L17 PolarHBondContact O-N 3.46Å; E15-L17 VanDerWaalsContact C-N 3.34Å
18	R	61.4	Low	56.4	Low	193 Å²	193	55.6 Å²	55.6	73%	0.728	31%	0.311	S	S	*	.	H	α-helix	trans	-80	-25.5	179.2	-76.7	-179.7	164.4	173.9	-3.3	113.6	S14 E15 E16 P20	S14-R18 PolarHBondContact O-N 2.99Å; E15-R18 PolarHBondContact O-N 3.38Å; E16-R18 PolarHBondContact O-N 3.13Å; R18-P20 WeakPolarHBondContact O-CD 3.32Å
19	L	54.2	Low	55.9	Low	63 Å²	63	58.5 Å²	58.5	33%	0.33	32%	0.321	S	S	.	.	S	Bend	trans	-113.3	101.9	-171.5	-73.5	155.7	0	0	0	110.6	E15 E16 G21 V22 L42	E15-L19 HydrophobicContact CG-CD1 3.83Å; E15-L19 PolarHBondContact O-N 3.38Å; E15-L19 VanDerWaalsContact O-N 3.1Å; E16-L19 PolarHBondContact O-N 2.85Å; L19-G21 PolarHBondContact O-N 3.33Å; L19-G21 VanDerWaalsContact O-N 3.14Å; L19-V22 PolarHBondContact O-N 3.45Å; L19-L42 HydrophobicContact CB-CD1 4.05Å; L19-L42 HydrophobicContact CD1-CD1 3.48Å; L19-L42 VanDerWaalsContact CD1-CD1 3.48Å; L19-L42 HydrophobicContact CD1-CD2 3.44Å; L19-L42 VanDerWaalsContact CD1-CD2 3.44Å; L19-L42 HydrophobicContact CD1-CG 3.95Å; L19-L42 HydrophobicContact CG-CD1 4.29Å
20	P	51.7	Low	55.5	Low	106 Å²	106	62.7 Å²	62.7	69%	0.688	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	124.3	172.2	25.5	-31.8	0	0	0	108	R18 L35	R18-P20 WeakPolarHBondContact O-CD 3.32Å; P20-L35 WeakPolarHBondContact O-CD2 3.36Å
21	G	48.8	Very low	54.9	Low	6 Å²	6	70.4 Å²	70.4	6%	0.062	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	108.2	1.3	178.9	0	0	0	0	0	116.9	L19 A32	L19-G21 PolarHBondContact O-N 3.33Å; L19-G21 VanDerWaalsContact O-N 3.14Å; G21-A32 VanDerWaalsContact C-CB 3.42Å; G21-A32 VanDerWaalsContact O-CB 3.23Å; G21-A32 WeakPolarHBondContact O-CB 3.32Å
22	V	44.5	Very low	54.1	Low	7 Å²	7	67.1 Å²	67.1	4%	0.042	34%	0.338	C	S	.	.			trans	-125.5	140.8	169.7	175.4	0	0	0	0	110.4	E16 L19 F24 P38 R39 L42	E16-V22 WeakPolarHBondContact CG-O 3.26Å; L19-V22 PolarHBondContact O-N 3.45Å; V22-F24 HydrophobicContact CG1-CE2 4.31Å; V22-F24 HydrophobicContact CG1-CZ 4.44Å; V22-P38 HydrophobicContact CG2-CB 3.85Å; V22-P38 HydrophobicContact CG2-CG 3.88Å; V22-R39 HydrophobicContact CG2-CG 4.4Å; V22-L42 HydrophobicContact CB-CD1 3.64Å; V22-L42 HydrophobicContact CG1-CB 3.95Å; V22-L42 HydrophobicContact CG1-CD1 3.85Å; V22-L42 HydrophobicContact CG2-CB 4.43Å; V22-L42 HydrophobicContact CG2-CD1 3.25Å; V22-L42 HydrophobicContact CG2-CG 4.45Å
23	A	51.2	Low	53.8	Low	10 Å²	10	76.2 Å²	76.2	8%	0.083	37%	0.371	C	S	.	.			trans	-154.3	129.1	171.1	0	0	0	0	0	112.8	E16 G28 R29 A32	E16-A23 VanDerWaalsContact CD-CA 3.44Å; E16-A23 HydrophobicContact CG-CB 4.33Å; E16-A23 VanDerWaalsContact OE2-CA 3.3Å; E16-A23 WeakPolarHBondContact OE2-CA 3.07Å; A23-G28 WeakPolarHBondContact CB-O 3.33Å; A23-R29 HydrophobicContact CB-CG 4.14Å; A23-R29 VanDerWaalsContact O-CG 3.29Å; A23-R29 WeakPolarHBondContact O-CG 3.36Å; A23-A32 HydrophobicContact CB-CB 4.43Å
24	F	55	Low	53.5	Low	26 Å²	26	73.7 Å²	73.7	11%	0.114	38%	0.383	C	S	.	.	S	Bend	trans	-73.9	-44.6	161.1	-53.3	-75.9	0	0	0	109.3	C12 E16 V22 R29 C46	C12-F24 HydrophobicContact CB-CD2 4.29Å; C12-F24 HydrophobicContact CB-CE2 3.92Å; C12-F24 HydrophobicContact CB-CZ 4.05Å; C12-F24 WeakPolarHBondContact O-CE2 3.14Å; E16-F24 HydrophobicContact CB-CD2 3.7Å; E16-F24 HydrophobicContact CB-CE2 3.97Å; E16-F24 WeakPolarHBondContact OE2-CA 3.33Å; E16-F24 VanDerWaalsContact OE2-CB 3.22Å; E16-F24 WeakPolarHBondContact OE2-CB 3.27Å; E16-F24 WeakPolarHBondContact OE2-CD2 3.33Å; E16-F24 PolarHBondContact OE2-N 3.32Å; V22-F24 HydrophobicContact CG1-CE2 4.31Å; V22-F24 HydrophobicContact CG1-CZ 4.44Å; F24-R29 PolarHBondContact O-NE 3.21Å; F24-R29 PolarHBondContact O-NH2 3.31Å; F24-C46 HydrophobicContact CE1-CB 4.24Å; F24-C46 HydrophobicContact CZ-CB 4.17Å
25	S	52.3	Low	53	Low	23 Å²	23	74.3 Å²	74.3	16%	0.161	38%	0.381	C	S	.	.	S	Bend	trans	-70.2	146.8	179.7	71.9	0	0	0	0	113.3	E16 A27 G28 R29	E16-S25 WeakPolarHBondContact OE1-CB 3.39Å; E16-S25 PolarHBondContact OE1-OG 2.73Å; E16-S25 PolarHBondContact OE2-N 3.29Å; S25-A27 VanDerWaalsContact C-N 3.28Å; S25-A27 PolarHBondContact O-N 2.79Å; S25-G28 PolarHBondContact O-N 2.95Å; S25-G28 PolarHBondContact OG-N 3.44Å; S25-G28 VanDerWaalsContact OG-N 3.08Å; S25-R29 WeakPolarHBondContact O-CG 3.33Å; S25-R29 PolarHBondContact O-N 3.37Å
26	P	53.2	Low	52.7	Low	65 Å²	65	78.4 Å²	78.4	42%	0.422	42%	0.415	S	S	.	.	H	α-helix	trans	-57.1	-41	175.7	19.4	-29.9	0	0	0	112.4	G28 R29 E30	P26-G28 PolarHBondContact O-N 2.89Å; P26-R29 WeakPolarHBondContact O-CB 3.47Å; P26-R29 PolarHBondContact O-N 2.92Å; P26-R29 VanDerWaalsContact O-N 3.11Å; P26-E30 PolarHBondContact O-N 3.22Å
27	A	51.7	Low	52.5	Low	73 Å²	73	81.3 Å²	81.3	60%	0.603	44%	0.443	S	S	*	.	H	α-helix	trans	-63.9	-39.4	178.2	0	0	0	0	0	112.9	S25 R29	S25-A27 VanDerWaalsContact C-N 3.28Å; S25-A27 PolarHBondContact O-N 2.79Å; A27-R29 VanDerWaalsContact C-N 3.33Å
28	G	49.5	Very low	52.1	Low	11 Å²	11	75.6 Å²	75.6	11%	0.113	42%	0.415	C	S	.	.	H	α-helix	trans	-71.9	-27.9	174.2	0	0	0	0	0	112.3	A23 S25 P26 E30 R31 A32	A23-G28 WeakPolarHBondContact CB-O 3.33Å; S25-G28 PolarHBondContact O-N 2.95Å; S25-G28 PolarHBondContact OG-N 3.44Å; S25-G28 VanDerWaalsContact OG-N 3.08Å; P26-G28 PolarHBondContact O-N 2.89Å; G28-E30 VanDerWaalsContact C-N 3.26Å; G28-E30 PolarHBondContact O-N 3.46Å; G28-R31 CarbonylContact O-C 3.6Å; G28-R31 WeakPolarHBondContact O-CA 3.5Å; G28-R31 WeakPolarHBondContact O-CB 3.05Å; G28-R31 PolarHBondContact O-N 3.09Å; G28-R31 VanDerWaalsContact O-N 3.07Å; G28-A32 WeakPolarHBondContact O-CB 2.96Å; G28-A32 PolarHBondContact O-N 2.88Å
29	R	52.9	Low	51.5	Low	62 Å²	62	71.1 Å²	71.1	23%	0.234	40%	0.399	C	S	.	.	H	α-helix	trans	-65.3	-33.5	-178.9	-76.3	178	-137.3	-174.7	9	111.5	A23 F24 S25 P26 A27 A32 R33 R39 E72	A23-R29 HydrophobicContact CB-CG 4.14Å; A23-R29 VanDerWaalsContact O-CG 3.29Å; A23-R29 WeakPolarHBondContact O-CG 3.36Å; F24-R29 PolarHBondContact O-NE 3.21Å; F24-R29 PolarHBondContact O-NH2 3.31Å; S25-R29 WeakPolarHBondContact O-CG 3.33Å; S25-R29 PolarHBondContact O-N 3.37Å; P26-R29 WeakPolarHBondContact O-CB 3.47Å; P26-R29 PolarHBondContact O-N 2.92Å; P26-R29 VanDerWaalsContact O-N 3.11Å; A27-R29 VanDerWaalsContact C-N 3.33Å; R29-A32 CarbonylContact O-C 3.54Å; R29-A32 PolarHBondContact O-N 3.27Å; R29-R33 PolarHBondContact O-N 3.42Å; R29-R33 VanDerWaalsContact O-N 3.08Å; R29-R39 PolarHBondContact O-NH2 2.03Å; R29-E72 IonicContact NH2-OE2 3.41Å; R29-E72 PolarHBondContact NH2-OE2 3.47Å
30	E	54	Low	51.4	Low	129 Å²	129	78.8 Å²	78.8	60%	0.603	42%	0.423	S	S	*	.	H	α-helix	trans	-61.1	-48	170	-148.3	84.4	-123.1	0	0	110.4	P26 G28 A32 R33	P26-E30 PolarHBondContact O-N 3.22Å; G28-E30 VanDerWaalsContact C-N 3.26Å; G28-E30 PolarHBondContact O-N 3.46Å; E30-A32 VanDerWaalsContact C-N 3.26Å; E30-A32 PolarHBondContact O-N 2.9Å; E30-R33 WeakPolarHBondContact O-CB 3.43Å; E30-R33 PolarHBondContact O-N 3.24Å; E30-R33 IonicContact OE1-NH1 3.01Å; E30-R33 PolarHBondContact OE1-NH1 3.43Å
31	R	50.8	Low	51.4	Low	218 Å²	218	80 Å²	80	82%	0.823	42%	0.423	S	S	*	.	H	α-helix	trans	-64.1	-31.9	175.8	-67	-177	177	-178.2	-1.1	112.6	G28	G28-R31 CarbonylContact O-C 3.6Å; G28-R31 WeakPolarHBondContact O-CA 3.5Å; G28-R31 WeakPolarHBondContact O-CB 3.05Å; G28-R31 PolarHBondContact O-N 3.09Å; G28-R31 VanDerWaalsContact O-N 3.07Å
32	A	49.7	Very low	51.6	Low	2 Å²	2	80.1 Å²	80.1	2%	0.017	42%	0.422	C	S	.	.	G	3₁₀ helix	trans	-83.9	-4.7	179.4	0	0	0	0	0	114	G21 A23 G28 R29 E30 G34 L35 R39	G21-A32 VanDerWaalsContact C-CB 3.42Å; G21-A32 VanDerWaalsContact O-CB 3.23Å; G21-A32 WeakPolarHBondContact O-CB 3.32Å; A23-A32 HydrophobicContact CB-CB 4.43Å; G28-A32 WeakPolarHBondContact O-CB 2.96Å; G28-A32 PolarHBondContact O-N 2.88Å; R29-A32 CarbonylContact O-C 3.54Å; R29-A32 PolarHBondContact O-N 3.27Å; E30-A32 VanDerWaalsContact C-N 3.26Å; E30-A32 PolarHBondContact O-N 2.9Å; A32-G34 PolarHBondContact O-N 3.42Å; A32-G34 VanDerWaalsContact O-N 3.1Å; A32-L35 PolarHBondContact O-N 3.4Å; A32-R39 PolarHBondContact O-NH2 3.05Å
33	R	55.2	Low	52.3	Low	198 Å²	198	84.9 Å²	84.9	75%	0.747	44%	0.439	S	S	*	.	G	3₁₀ helix	trans	-67.1	-5	-176.6	-101.4	178.8	167	-174.3	-7.1	114.2	R29 E30	R29-R33 PolarHBondContact O-N 3.42Å; R29-R33 VanDerWaalsContact O-N 3.08Å; E30-R33 WeakPolarHBondContact O-CB 3.43Å; E30-R33 PolarHBondContact O-N 3.24Å; E30-R33 IonicContact OE1-NH1 3.01Å; E30-R33 PolarHBondContact OE1-NH1 3.43Å
34	G	55.9	Low	52.6	Low	68 Å²	68	90.6 Å²	90.6	70%	0.701	47%	0.466	S	S	*	.	G	3₁₀ helix	trans	-107.6	-5.1	175.4	0	0	0	0	0	116.2	A32	A32-G34 PolarHBondContact O-N 3.42Å; A32-G34 VanDerWaalsContact O-N 3.1Å
35	L	51.5	Low	52.8	Low	75 Å²	75	94.2 Å²	94.2	39%	0.393	48%	0.482	S	S	.	.			trans	-108.7	98.5	-176.8	-81.1	99.1	0	0	0	111.5	P20 A32 A37 P38	P20-L35 WeakPolarHBondContact O-CD2 3.36Å; A32-L35 PolarHBondContact O-N 3.4Å; L35-A37 VanDerWaalsContact C-N 3.28Å; L35-A37 PolarHBondContact O-N 3.49Å; L35-P38 HydrophobicContact CB-CG 4.34Å; L35-P38 HydrophobicContact CD2-CG 4.4Å
36	S	50.8	Low	53.4	Low	133 Å²	133	94.6 Å²	94.6	93%	0.93	48%	0.484	S	S	*	.	S	Bend	trans	-69.2	-14.7	-177.6	-75.6	0	0	0	0	115.4
37	A	50.8	Low	53.9	Low	88 Å²	88	94.8 Å²	94.8	73%	0.727	48%	0.481	S	S	*	.	S	Bend	trans	-100.9	-42	-166.3	0	0	0	0	0	116.8	L35	L35-A37 VanDerWaalsContact C-N 3.28Å; L35-A37 PolarHBondContact O-N 3.49Å
38	P	48.9	Very low	54.5	Low	31 Å²	31	95.4 Å²	95.4	20%	0.201	48%	0.477	C	S	.	.	S	Bend	trans	-92.1	-5.5	-165.2	31.6	-32.1	0	0	0	116.2	V22 L35 R40 L42	V22-P38 HydrophobicContact CG2-CB 3.85Å; V22-P38 HydrophobicContact CG2-CG 3.88Å; L35-P38 HydrophobicContact CB-CG 4.34Å; L35-P38 HydrophobicContact CD2-CG 4.4Å; P38-R40 PolarHBondContact O-N 2.92Å; P38-L42 HydrophobicContact CB-CD1 4.46Å
39	R	49.3	Very low	55.1	Low	100 Å²	100	96.4 Å²	96.4	38%	0.377	48%	0.481	S	S	.	.	H	α-helix	trans	-58.9	-44.1	-173.4	-72.4	-172.3	-177.1	-155.6	-0.6	113.8	V22 R29 A32	V22-R39 HydrophobicContact CG2-CG 4.4Å; R29-R39 PolarHBondContact O-NH2 2.03Å; A32-R39 PolarHBondContact O-NH2 3.05Å
40	R	51.7	Low	55.5	Low	223 Å²	223	94 Å²	94	84%	0.842	47%	0.473	S	S	*	.	H	α-helix	trans	-71.8	-36.9	-174.3	-69.2	-174	-162.6	-173.1	5.2	114	P38 L42 M44	P38-R40 PolarHBondContact O-N 2.92Å; R40-L42 VanDerWaalsContact C-N 3.31Å; R40-L42 PolarHBondContact O-N 3.35Å; R40-M44 PolarHBondContact O-N 2.91Å
41	L	51.9	Low	55.7	Low	131 Å²	131	89 Å²	89	69%	0.686	45%	0.453	S	S	*	.	H	α-helix	trans	-64.9	-34.6	-175.9	-104.8	143.7	0	0	0	112.5	K45	L41-K45 PolarHBondContact O-N 3.33Å
42	L	52.5	Low	56.3	Low	9 Å²	9	84.9 Å²	84.9	5%	0.047	45%	0.448	C	S	.	.	H	α-helix	trans	-82.2	-30.4	-177.6	-80.9	148.2	0	0	0	113.9	E15 L19 V22 P38 R40 M44 K45 C46	E15-L42 HydrophobicContact CB-CD2 4.31Å; E15-L42 HydrophobicContact CG-CD2 3.67Å; L19-L42 HydrophobicContact CB-CD1 4.05Å; L19-L42 HydrophobicContact CD1-CD1 3.48Å; L19-L42 VanDerWaalsContact CD1-CD1 3.48Å; L19-L42 HydrophobicContact CD1-CD2 3.44Å; L19-L42 VanDerWaalsContact CD1-CD2 3.44Å; L19-L42 HydrophobicContact CD1-CG 3.95Å; L19-L42 HydrophobicContact CG-CD1 4.29Å; V22-L42 HydrophobicContact CB-CD1 3.64Å; V22-L42 HydrophobicContact CG1-CB 3.95Å; V22-L42 HydrophobicContact CG1-CD1 3.85Å; V22-L42 HydrophobicContact CG2-CB 4.43Å; V22-L42 HydrophobicContact CG2-CD1 3.25Å; V22-L42 HydrophobicContact CG2-CG 4.45Å; P38-L42 HydrophobicContact CB-CD1 4.46Å; R40-L42 VanDerWaalsContact C-N 3.31Å; R40-L42 PolarHBondContact O-N 3.35Å; L42-M44 VanDerWaalsContact C-N 3.29Å; L42-M44 PolarHBondContact O-N 2.73Å; L42-K45 HydrophobicContact CD2-CD 4.29Å; L42-K45 PolarHBondContact O-N 3.21Å; L42-C46 WeakPolarHBondContact O-CB 3.14Å; L42-C46 PolarHBondContact O-N 3.33Å
43	W	59.1	Low	56.7	Low	107 Å²	107	89 Å²	89	41%	0.405	47%	0.467	S	S	.	.	H	α-helix	trans	-60.4	-43.2	168.9	-83.1	71.8	0	0	0	111.1	C46 L47 V69	W43-C46 PolarHBondContact O-N 3.1Å; W43-L47 WeakPolarHBondContact O-CG 3.47Å; W43-L47 PolarHBondContact O-N 3.22Å; W43-V69 HydrophobicContact CH2-CB 4.5Å; W43-V69 HydrophobicContact CH2-CG1 3.84Å; W43-V69 HydrophobicContact CH2-CG2 3.75Å; W43-V69 HydrophobicContact CZ3-CG1 4.43Å; W43-V69 HydrophobicContact CZ3-CG2 3.96Å
44	M	58.3	Low	56.7	Low	130 Å²	130	80.5 Å²	80.5	64%	0.64	44%	0.437	S	S	*	.	H	α-helix	trans	-61.8	-44.9	175.3	-71.6	-61.4	-152.7	0	0	112	R40 L42 C46 L47 V48	R40-M44 PolarHBondContact O-N 2.91Å; L42-M44 VanDerWaalsContact C-N 3.29Å; L42-M44 PolarHBondContact O-N 2.73Å; M44-C46 PolarHBondContact O-N 3.35Å; M44-L47 PolarHBondContact O-N 3.41Å; M44-L47 HydrophobicContact SD-CD1 4.44Å; M44-V48 VanDerWaalsContact O-CG2 3.31Å; M44-V48 WeakPolarHBondContact O-CG2 3.42Å; M44-V48 PolarHBondContact O-N 3.33Å
45	K	59.7	Low	56.7	Low	103 Å²	103	79.2 Å²	79.2	45%	0.448	42%	0.424	S	S	.	.	H	α-helix	trans	-60.6	-43.9	174.7	-81.9	-172.9	169.3	-176.5	0	112.7	E15 L41 L42 L47 V48 T49	E15-K45 WeakPolarHBondContact OE1-CD 3.26Å; E15-K45 IonicContact OE1-NZ 2.85Å; E15-K45 PolarHBondContact OE1-NZ 2.84Å; L41-K45 PolarHBondContact O-N 3.33Å; L42-K45 HydrophobicContact CD2-CD 4.29Å; L42-K45 PolarHBondContact O-N 3.21Å; K45-L47 VanDerWaalsContact C-N 3.29Å; K45-L47 PolarHBondContact O-N 2.71Å; K45-V48 CarbonylContact O-C 3.59Å; K45-V48 PolarHBondContact O-N 3.01Å; K45-V48 VanDerWaalsContact O-N 3.08Å; K45-T49 PolarHBondContact O-N 2.62Å; K45-T49 PolarHBondContact O-OG1 3.3Å
46	C	64.3	Low	56.8	Low	30 Å²	30	81.6 Å²	81.6	20%	0.203	44%	0.441	C	S	.	.	H	α-helix	trans	-60.2	-42	178.1	-171.7	0	0	0	0	111.5	C12 F24 L42 W43 M44 V48 T49 L50	C12-C46 HydrophobicContact CB-CB 3.89Å; C12-C46 WeakPolarHBondContact CB-SG 3.03Å; C12-C46 WeakPolarHBondContact SG-CA 3.16Å; C12-C46 WeakPolarHBondContact SG-CB 3.27Å; C12-C46 CovalentContact SG-SG 2.03Å; C12-C46 PolarHBondContact SG-SG 3.2Å; F24-C46 HydrophobicContact CE1-CB 4.24Å; F24-C46 HydrophobicContact CZ-CB 4.17Å; L42-C46 WeakPolarHBondContact O-CB 3.14Å; L42-C46 PolarHBondContact O-N 3.33Å; W43-C46 PolarHBondContact O-N 3.1Å; M44-C46 PolarHBondContact O-N 3.35Å; C46-V48 VanDerWaalsContact C-N 3.34Å; C46-V48 PolarHBondContact O-N 2.94Å; C46-T49 PolarHBondContact O-N 3.26Å; C46-L50 VanDerWaalsContact O-CB 3.27Å; C46-L50 WeakPolarHBondContact O-CB 3.4Å; C46-L50 PolarHBondContact O-N 3.33Å
47	L	64	Low	56.8	Low	70 Å²	70	78.2 Å²	78.2	37%	0.366	42%	0.415	S	S	.	.	H	α-helix	trans	-62.7	-38.7	173.7	-69.9	170.8	0	0	0	112.2	W43 M44 K45 A51 L62	W43-L47 WeakPolarHBondContact O-CG 3.47Å; W43-L47 PolarHBondContact O-N 3.22Å; M44-L47 PolarHBondContact O-N 3.41Å; M44-L47 HydrophobicContact SD-CD1 4.44Å; K45-L47 VanDerWaalsContact C-N 3.29Å; K45-L47 PolarHBondContact O-N 2.71Å; L47-A51 VanDerWaalsContact O-CB 3.31Å; L47-A51 WeakPolarHBondContact O-CB 3.48Å; L47-A51 PolarHBondContact O-N 3.14Å; L47-L62 HydrophobicContact CD2-CD2 4Å
48	V	63	Low	56.7	Low	86 Å²	86	81 Å²	81	52%	0.521	41%	0.407	S	S	.	.	H	α-helix	trans	-68.2	-47.2	176.3	171.4	0	0	0	0	111.5	M44 K45 C46 L50 A51 N52	M44-V48 VanDerWaalsContact O-CG2 3.31Å; M44-V48 WeakPolarHBondContact O-CG2 3.42Å; M44-V48 PolarHBondContact O-N 3.33Å; K45-V48 CarbonylContact O-C 3.59Å; K45-V48 PolarHBondContact O-N 3.01Å; K45-V48 VanDerWaalsContact O-N 3.08Å; C46-V48 VanDerWaalsContact C-N 3.34Å; C46-V48 PolarHBondContact O-N 2.94Å; V48-L50 VanDerWaalsContact C-N 3.27Å; V48-L50 PolarHBondContact O-N 3.26Å; V48-A51 PolarHBondContact O-N 3.24Å; V48-N52 WeakPolarHBondContact O-CB 3.44Å; V48-N52 PolarHBondContact O-N 2.61Å
49	T	63.2	Low	56.7	Low	32 Å²	32	86.9 Å²	86.9	20%	0.196	44%	0.436	C	S	.	.	H	α-helix	trans	-58.8	-42.1	175.7	-62.9	0	0	0	0	110.7	A8 D11 K45 C46 N52 H53	A8-T49 HydrophobicContact CB-CG2 4.42Å; D11-T49 HydrophobicContact CB-CG2 4.16Å; K45-T49 PolarHBondContact O-N 2.62Å; K45-T49 PolarHBondContact O-OG1 3.3Å; C46-T49 PolarHBondContact O-N 3.26Å; T49-N52 PolarHBondContact O-N 3.46Å; T49-H53 PolarHBondContact O-CD2 2.86Å; T49-H53 PolarHBondContact O-N 3.31Å
50	L	61.4	Low	56.7	Low	10 Å²	10	85.8 Å²	85.8	5%	0.052	44%	0.441	C	S	.	.	H	α-helix	trans	-63.5	-48	174.1	-175.7	74.5	0	0	0	111.8	V5 A8 C46 V48 N52 H53 V54 C65	V5-L50 HydrophobicContact CB-CD1 4.47Å; V5-L50 HydrophobicContact CG1-CD1 4.17Å; V5-L50 HydrophobicContact CG2-CD1 4.38Å; A8-L50 HydrophobicContact CB-CB 4.17Å; A8-L50 HydrophobicContact CB-CD1 3.64Å; C46-L50 VanDerWaalsContact O-CB 3.27Å; C46-L50 WeakPolarHBondContact O-CB 3.4Å; C46-L50 PolarHBondContact O-N 3.33Å; V48-L50 VanDerWaalsContact C-N 3.27Å; V48-L50 PolarHBondContact O-N 3.26Å; L50-N52 PolarHBondContact O-N 2.96Å; L50-H53 CarbonylContact O-C 3.52Å; L50-H53 PolarHBondContact O-N 2.86Å; L50-V54 HydrophobicContact CD1-CG2 3.82Å; L50-V54 HydrophobicContact CG-CG2 3.94Å; L50-V54 VanDerWaalsContact O-CB 3.26Å; L50-V54 WeakPolarHBondContact O-CB 3.38Å; L50-V54 VanDerWaalsContact O-CG2 3.22Å; L50-V54 WeakPolarHBondContact O-CG2 3.22Å; L50-V54 PolarHBondContact O-N 3.06Å; L50-C65 HydrophobicContact CD2-CB 4.31Å; L50-C65 WeakPolarHBondContact CD2-SG 3.49Å
51	A	58.8	Low	56.4	Low	24 Å²	24	75.6 Å²	75.6	20%	0.198	40%	0.403	C	S	.	.	H	α-helix	trans	-57.7	-39.7	177.7	0	0	0	0	0	111.7	L47 V48 G55 W58	L47-A51 VanDerWaalsContact O-CB 3.31Å; L47-A51 WeakPolarHBondContact O-CB 3.48Å; L47-A51 PolarHBondContact O-N 3.14Å; V48-A51 PolarHBondContact O-N 3.24Å; A51-G55 PolarHBondContact O-N 2.95Å; A51-W58 HydrophobicContact CB-CH2 3.48Å; A51-W58 VanDerWaalsContact CB-CH2 3.48Å; A51-W58 HydrophobicContact CB-CZ2 3.91Å; A51-W58 HydrophobicContact CB-CZ3 4.07Å
52	N	61.9	Low	56.4	Low	133 Å²	133	72.6 Å²	72.6	71%	0.711	39%	0.388	S	S	*	.	H	α-helix	trans	-64.5	-40.6	173.6	-78.2	-18.4	0	0	0	112.4	V48 T49 L50	V48-N52 WeakPolarHBondContact O-CB 3.44Å; V48-N52 PolarHBondContact O-N 2.61Å; T49-N52 PolarHBondContact O-N 3.46Å; L50-N52 PolarHBondContact O-N 2.96Å
53	H	58.7	Low	56.3	Low	89 Å²	89	74.8 Å²	74.8	41%	0.412	41%	0.407	S	S	.	.	H	α-helix	trans	-74.2	-29.6	178.5	-86.8	-58.6	0	0	0	114.1	S4 A8 T49 L50	S4-H53 WeakPolarHBondContact CB-O 3.43Å; A8-H53 HydrophobicContact CB-CB 4.37Å; T49-H53 PolarHBondContact O-CD2 2.86Å; T49-H53 PolarHBondContact O-N 3.31Å; L50-H53 CarbonylContact O-C 3.52Å; L50-H53 PolarHBondContact O-N 2.86Å
54	V	55.1	Low	55.9	Low	19 Å²	19	72.6 Å²	72.6	12%	0.115	40%	0.403	C	S	.	.	H	α-helix	trans	-89.7	-26.7	-173.2	169.5	0	0	0	0	111.9	V5 L50 T57 E61	V5-V54 HydrophobicContact CG2-CG2 4.22Å; L50-V54 HydrophobicContact CD1-CG2 3.82Å; L50-V54 HydrophobicContact CG-CG2 3.94Å; L50-V54 VanDerWaalsContact O-CB 3.26Å; L50-V54 WeakPolarHBondContact O-CB 3.38Å; L50-V54 VanDerWaalsContact O-CG2 3.22Å; L50-V54 WeakPolarHBondContact O-CG2 3.22Å; L50-V54 PolarHBondContact O-N 3.06Å; V54-T57 WeakPolarHBondContact CG1-O 3.12Å; V54-E61 HydrophobicContact CB-CG 4.37Å; V54-E61 HydrophobicContact CG1-CB 3.99Å; V54-E61 HydrophobicContact CG1-CG 3.58Å; V54-E61 VanDerWaalsContact CG1-OE1 3.26Å; V54-E61 WeakPolarHBondContact CG1-OE1 3.18Å; V54-E61 HydrophobicContact CG2-CB 4.02Å; V54-E61 HydrophobicContact CG2-CG 3.79Å
55	G	55.2	Low	55.6	Low	41 Å²	41	67.6 Å²	67.6	42%	0.423	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.1	76	177.5	0	0	0	0	0	111.4	A51 T57	A51-G55 PolarHBondContact O-N 2.95Å; G55-T57 PolarHBondContact O-N 2.68Å
56	T	53.9	Low	55.3	Low	124 Å²	124	68.1 Å²	68.1	76%	0.761	39%	0.387	S	S	*	.	S	Bend	trans	58.8	2	164	56.7	0	0	0	0	119.3	W58	T56-W58 VanDerWaalsContact O-CD1 3.24Å; T56-W58 PolarHBondContact O-N 3.05Å
57	T	51.3	Low	54.6	Low	62 Å²	62	71.7 Å²	71.7	38%	0.38	40%	0.404	S	S	.	.			trans	-86.6	102.8	162.7	38.3	0	0	0	0	108.7	V54 G55 E61	V54-T57 WeakPolarHBondContact CG1-O 3.12Å; G55-T57 PolarHBondContact O-N 2.68Å; T57-E61 PolarHBondContact OG1-OE1 3.3Å
58	W	48.2	Very low	54.1	Low	148 Å²	148	71.2 Å²	71.2	56%	0.561	40%	0.404	S	S	*	.			trans	-92	-7.5	-172.2	-71.1	89.9	0	0	0	114.1	A51 T56 L62	A51-W58 HydrophobicContact CB-CH2 3.48Å; A51-W58 VanDerWaalsContact CB-CH2 3.48Å; A51-W58 HydrophobicContact CB-CZ2 3.91Å; A51-W58 HydrophobicContact CB-CZ3 4.07Å; T56-W58 VanDerWaalsContact O-CD1 3.24Å; T56-W58 PolarHBondContact O-N 3.05Å; W58-L62 HydrophobicContact CE3-CD1 4.33Å; W58-L62 VanDerWaalsContact O-CD1 3.32Å; W58-L62 WeakPolarHBondContact O-CD1 3.3Å; W58-L62 WeakPolarHBondContact O-CG 3.34Å
59	L	49.5	Very low	53.7	Low	154 Å²	154	69.1 Å²	69.1	81%	0.806	39%	0.391	S	S	*	.	S	Bend	trans	-96.4	-53	-163.4	-73.8	161	0	0	0	114.3
60	P	48.4	Very low	53.1	Low	76 Å²	76	70.4 Å²	70.4	49%	0.494	40%	0.401	S	S	.	.	H	α-helix	trans	-76.8	-31.7	179	25.7	-26.6	0	0	0	112.5	A63 I64	P60-A63 WeakPolarHBondContact O-CB 3.23Å; P60-A63 PolarHBondContact O-N 3.3Å; P60-I64 WeakPolarHBondContact O-CG1 3.43Å; P60-I64 PolarHBondContact O-N 3.3Å
61	E	46.3	Very low	52.2	Low	9 Å²	9	74.8 Å²	74.8	4%	0.042	42%	0.424	C	S	.	.	H	α-helix	trans	-78.8	-32.6	-174.5	-64.7	93	163.9	0	0	114.3	M1 V5 V54 T57 A63 I64 C65	M1-E61 VanDerWaalsContact CE-OE1 3.29Å; M1-E61 WeakPolarHBondContact CE-OE1 3.5Å; V5-E61 HydrophobicContact CG2-CG 4.18Å; V54-E61 HydrophobicContact CB-CG 4.37Å; V54-E61 HydrophobicContact CG1-CB 3.99Å; V54-E61 HydrophobicContact CG1-CG 3.58Å; V54-E61 VanDerWaalsContact CG1-OE1 3.26Å; V54-E61 WeakPolarHBondContact CG1-OE1 3.18Å; V54-E61 HydrophobicContact CG2-CB 4.02Å; V54-E61 HydrophobicContact CG2-CG 3.79Å; T57-E61 PolarHBondContact OG1-OE1 3.3Å; E61-A63 PolarHBondContact O-N 2.79Å; E61-I64 PolarHBondContact O-N 2.7Å; E61-C65 PolarHBondContact O-N 3.08Å
62	L	51	Low	51.5	Low	68 Å²	68	76.1 Å²	76.1	36%	0.356	43%	0.426	S	S	.	.	H	α-helix	trans	-62.8	-36.9	168.2	-75.6	-179.6	0	0	0	110.7	L47 W58 C65 L66	L47-L62 HydrophobicContact CD2-CD2 4Å; W58-L62 HydrophobicContact CE3-CD1 4.33Å; W58-L62 VanDerWaalsContact O-CD1 3.32Å; W58-L62 WeakPolarHBondContact O-CD1 3.3Å; W58-L62 WeakPolarHBondContact O-CG 3.34Å; L62-C65 PolarHBondContact O-N 3.21Å; L62-L66 WeakPolarHBondContact O-CB 3.21Å; L62-L66 PolarHBondContact O-N 3.08Å
63	A	50.2	Low	50.5	Low	55 Å²	55	76.5 Å²	76.5	46%	0.455	42%	0.422	S	S	.	.	H	α-helix	trans	-65.2	-41.1	173.7	0	0	0	0	0	111.1	P60 E61 L66 L67	P60-A63 WeakPolarHBondContact O-CB 3.23Å; P60-A63 PolarHBondContact O-N 3.3Å; E61-A63 PolarHBondContact O-N 2.79Å; A63-L66 PolarHBondContact O-N 3.1Å; A63-L67 WeakPolarHBondContact O-CB 3.29Å; A63-L67 PolarHBondContact O-N 2.93Å
64	I	51.8	Low	49.5	Very low	62 Å²	62	75.9 Å²	75.9	32%	0.318	43%	0.432	S	S	.	.	H	α-helix	trans	-63	-41.4	173.3	-64.7	167.2	0	0	0	110.9	V5 P60 E61 L67 V68	V5-I64 HydrophobicContact CG1-CG2 4.16Å; P60-I64 WeakPolarHBondContact O-CG1 3.43Å; P60-I64 PolarHBondContact O-N 3.3Å; E61-I64 PolarHBondContact O-N 2.7Å; I64-L67 CarbonylContact O-C 3.5Å; I64-L67 WeakPolarHBondContact O-CB 3.31Å; I64-L67 PolarHBondContact O-N 3.11Å; I64-V68 HydrophobicContact CG2-CG2 4.26Å; I64-V68 WeakPolarHBondContact O-CB 3.46Å; I64-V68 VanDerWaalsContact O-CG2 3.26Å; I64-V68 WeakPolarHBondContact O-CG2 3.21Å; I64-V68 PolarHBondContact O-N 3.39Å
65	C	50.8	Low	48.4	Very low	25 Å²	25	80.6 Å²	80.6	17%	0.169	47%	0.465	C	S	.	.	H	α-helix	trans	-68.8	-42.5	177	-82.3	0	0	0	0	112.6	L50 E61 L62 L67 V68 V69	L50-C65 HydrophobicContact CD2-CB 4.31Å; L50-C65 WeakPolarHBondContact CD2-SG 3.49Å; E61-C65 PolarHBondContact O-N 3.08Å; L62-C65 PolarHBondContact O-N 3.21Å; C65-L67 PolarHBondContact O-N 2.99Å; C65-V68 PolarHBondContact O-N 3.07Å; C65-V69 VanDerWaalsContact O-CB 3.27Å; C65-V69 WeakPolarHBondContact O-CB 3.44Å; C65-V69 WeakPolarHBondContact O-CG2 3.49Å; C65-V69 PolarHBondContact O-N 3.34Å
66	L	54	Low	47.5	Very low	114 Å²	114	87.2 Å²	87.2	60%	0.597	49%	0.488	S	S	*	.	H	α-helix	trans	-59.4	-38.2	169.2	-89.6	157.3	0	0	0	110.7	L62 A63 S70	L62-L66 WeakPolarHBondContact O-CB 3.21Å; L62-L66 PolarHBondContact O-N 3.08Å; A63-L66 PolarHBondContact O-N 3.1Å; L66-S70 WeakPolarHBondContact O-CA 3.15Å; L66-S70 WeakPolarHBondContact O-CB 3.44Å; L66-S70 PolarHBondContact O-N 3.33Å; L66-S70 PolarHBondContact O-OG 2.81Å
67	L	49	Very low	47.2	Very low	105 Å²	105	85.4 Å²	85.4	55%	0.55	48%	0.475	S	S	.	.	H	α-helix	trans	-69.4	-43	177.7	-163.4	103.7	0	0	0	111.1	A63 I64 C65 S70 L71	A63-L67 WeakPolarHBondContact O-CB 3.29Å; A63-L67 PolarHBondContact O-N 2.93Å; I64-L67 CarbonylContact O-C 3.5Å; I64-L67 WeakPolarHBondContact O-CB 3.31Å; I64-L67 PolarHBondContact O-N 3.11Å; C65-L67 PolarHBondContact O-N 2.99Å; L67-S70 CarbonylContact O-C 3.56Å; L67-S70 PolarHBondContact O-N 3.33Å; L67-L71 HydrophobicContact CD2-CD1 3.62Å; L67-L71 HydrophobicContact CG-CD1 3.9Å; L67-L71 HydrophobicContact CG-CG 4.32Å; L67-L71 WeakPolarHBondContact O-CA 3.45Å; L67-L71 WeakPolarHBondContact O-CB 3.18Å; L67-L71 WeakPolarHBondContact O-CG 3.47Å; L67-L71 PolarHBondContact O-N 3.44Å
68	V	53.7	Low	47	Very low	60 Å²	60	86.6 Å²	86.6	36%	0.364	48%	0.48	S	S	.	.	H	α-helix	trans	-64.5	-44.5	175.5	170.2	0	0	0	0	110	I64 C65 S70 E72	I64-V68 HydrophobicContact CG2-CG2 4.26Å; I64-V68 WeakPolarHBondContact O-CB 3.46Å; I64-V68 VanDerWaalsContact O-CG2 3.26Å; I64-V68 WeakPolarHBondContact O-CG2 3.21Å; I64-V68 PolarHBondContact O-N 3.39Å; C65-V68 PolarHBondContact O-N 3.07Å; V68-S70 VanDerWaalsContact C-N 3.34Å; V68-E72 WeakPolarHBondContact O-CB 3.42Å; V68-E72 PolarHBondContact O-N 3.23Å
69	V	54.7	Low	46.9	Very low	41 Å²	41	83.2 Å²	83.2	25%	0.248	48%	0.475	C	S	.	.	H	α-helix	trans	-65.8	-36.8	175.3	170.8	0	0	0	0	111.5	W43 C65 K73	W43-V69 HydrophobicContact CH2-CB 4.5Å; W43-V69 HydrophobicContact CH2-CG1 3.84Å; W43-V69 HydrophobicContact CH2-CG2 3.75Å; W43-V69 HydrophobicContact CZ3-CG1 4.43Å; W43-V69 HydrophobicContact CZ3-CG2 3.96Å; C65-V69 VanDerWaalsContact O-CB 3.27Å; C65-V69 WeakPolarHBondContact O-CB 3.44Å; C65-V69 WeakPolarHBondContact O-CG2 3.49Å; C65-V69 PolarHBondContact O-N 3.34Å; V69-K73 PolarHBondContact O-N 3.01Å
70	S	50.9	Low	46.8	Very low	60 Å²	60	79 Å²	79	42%	0.42	46%	0.456	S	S	.	.	H	α-helix	trans	-77.2	-38.6	179.5	-62.5	0	0	0	0	112.1	L66 L67 V68 E72 K73 A74	L66-S70 WeakPolarHBondContact O-CA 3.15Å; L66-S70 WeakPolarHBondContact O-CB 3.44Å; L66-S70 PolarHBondContact O-N 3.33Å; L66-S70 PolarHBondContact O-OG 2.81Å; L67-S70 CarbonylContact O-C 3.56Å; L67-S70 PolarHBondContact O-N 3.33Å; V68-S70 VanDerWaalsContact C-N 3.34Å; S70-E72 VanDerWaalsContact C-N 3.31Å; S70-K73 CarbonylContact O-C 3.59Å; S70-K73 WeakPolarHBondContact O-CA 3.34Å; S70-K73 WeakPolarHBondContact O-CB 3.46Å; S70-K73 PolarHBondContact O-N 3.41Å; S70-K73 VanDerWaalsContact O-N 3.07Å; S70-A74 VanDerWaalsContact O-CB 3.31Å; S70-A74 WeakPolarHBondContact O-CB 3.35Å; S70-A74 PolarHBondContact O-N 3.22Å
71	L	43.4	Very low	46.7	Very low	102 Å²	102	79.2 Å²	79.2	53%	0.534	45%	0.453	S	S	.	.	H	α-helix	trans	-62.9	-40.1	171.5	-79.6	165.1	0	0	0	110.1	L67 K73 A74 C75	L67-L71 HydrophobicContact CD2-CD1 3.62Å; L67-L71 HydrophobicContact CG-CD1 3.9Å; L67-L71 HydrophobicContact CG-CG 4.32Å; L67-L71 WeakPolarHBondContact O-CA 3.45Å; L67-L71 WeakPolarHBondContact O-CB 3.18Å; L67-L71 WeakPolarHBondContact O-CG 3.47Å; L67-L71 PolarHBondContact O-N 3.44Å; L71-K73 VanDerWaalsContact C-N 3.29Å; L71-K73 PolarHBondContact O-N 3.46Å; L71-A74 PolarHBondContact O-N 3.07Å; L71-C75 PolarHBondContact O-N 3.01Å
72	E	43.6	Very low	46.7	Very low	51 Å²	51	83.9 Å²	83.9	24%	0.238	48%	0.481	C	S	.	.	H	α-helix	trans	-67.6	-26.6	171.4	-85.6	-141.9	150.2	0	0	113.4	R13 R29 V68 S70	R13-E72 IonicContact NH2-OE1 3.62Å; R29-E72 IonicContact NH2-OE2 3.41Å; R29-E72 PolarHBondContact NH2-OE2 3.47Å; V68-E72 WeakPolarHBondContact O-CB 3.42Å; V68-E72 PolarHBondContact O-N 3.23Å; S70-E72 VanDerWaalsContact C-N 3.31Å
73	K	41.5	Very low	46.4	Very low	141 Å²	141	85 Å²	85	61%	0.613	49%	0.49	S	S	*	.	H	α-helix	trans	-77.3	-31	169.9	-80.6	-168.3	174.6	176.3	0	113.1	V69 S70 L71	V69-K73 PolarHBondContact O-N 3.01Å; S70-K73 CarbonylContact O-C 3.59Å; S70-K73 WeakPolarHBondContact O-CA 3.34Å; S70-K73 WeakPolarHBondContact O-CB 3.46Å; S70-K73 PolarHBondContact O-N 3.41Å; S70-K73 VanDerWaalsContact O-N 3.07Å; L71-K73 VanDerWaalsContact C-N 3.29Å; L71-K73 PolarHBondContact O-N 3.46Å
74	A	36.5	Very low	46.1	Very low	76 Å²	76	87.3 Å²	87.3	63%	0.628	49%	0.492	S	S	*	.	H	α-helix	trans	-85.3	-15.3	-176.2	0	0	0	0	0	113.5	S70 L71 I76	S70-A74 VanDerWaalsContact O-CB 3.31Å; S70-A74 WeakPolarHBondContact O-CB 3.35Å; S70-A74 PolarHBondContact O-N 3.22Å; L71-A74 PolarHBondContact O-N 3.07Å; A74-I76 PolarHBondContact O-N 3.41Å
75	C	32.9	Very low	45.6	Very low	119 Å²	119	89.4 Å²	89.4	80%	0.804	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	12.6	173.3	-156	0	0	0	0	113.2	L71	L71-C75 PolarHBondContact O-N 3.01Å
76	I	36.7	Very low	45.2	Very low	179 Å²	179	95.3 Å²	95.3	92%	0.918	54%	0.538	S	S	*	.			trans	-106.7	0	163.4	-54.3	173.8	0	0	0	106.4	A74	A74-I76 PolarHBondContact O-N 3.41Å

Retrieved 76 of 76 residues in 14.8 ms (Link to these results)

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