A0A077ZIR7_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZIR7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 121 aa.

						>A0A077ZIR7_TRITR|A0A077ZIR7
MLDSGASRSFPSRFVGQYFNVVNAPSEGDPKSILEYSRVIGFLTGYESRVMEEAHTDAVMILGEAFGSNQLFDFSTQDTTRRIRSCSTVTGNAMLSPLAAQTAPVACKNSDSLQRLSSAFN
					

Structure Viewer

Loading PAE data...

(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	66.6	Low	80.3	Confident	221 Å²	221	118.1 Å²	118.1	100%	1.089	69%	0.691	S	S	*	*				0	127.1	0	-71.5	167.1	70.4	0	0	106.7
2	L	81.5	Confident	81.2	Confident	156 Å²	156	117.3 Å²	117.3	82%	0.817	70%	0.696	S	S	*	*			trans	-96.9	97.1	175.3	-174.1	84.3	0	0	0	106.8	S4	L2-S4 VanDerWaalsContact C-N 3.29Å; L2-S4 WeakPolarHBondContact CD2-OG 3.37Å; L2-S4 PolarHBondContact O-N 3.36Å
3	D	76.3	Confident	82.1	Confident	127 Å²	127	121.5 Å²	121.5	68%	0.679	69%	0.693	S	S	*	*			trans	-79.3	76.5	179.3	-66	-37.6	0	0	0	110.4	G5	D3-G5 PolarHBondContact O-N 3.4Å
4	S	73.5	Confident	82.8	Confident	65 Å²	65	115 Å²	115	46%	0.455	65%	0.653	S	S	.	*	G	3₁₀ helix	trans	-71.6	-0.6	175.8	-55	0	0	0	0	113.8	L2 A6 S7	L2-S4 VanDerWaalsContact C-N 3.29Å; L2-S4 WeakPolarHBondContact CD2-OG 3.37Å; L2-S4 PolarHBondContact O-N 3.36Å; S4-A6 VanDerWaalsContact C-N 3.27Å; S4-A6 PolarHBondContact O-N 2.91Å; S4-S7 WeakPolarHBondContact O-CB 3.46Å; S4-S7 PolarHBondContact O-N 3.03Å; S4-S7 VanDerWaalsContact O-N 3.16Å
5	G	77.6	Confident	83.5	Confident	65 Å²	65	112.4 Å²	112.4	67%	0.67	64%	0.64	S	S	*	*	G	3₁₀ helix	trans	-61.3	-33.7	179.7	0	0	0	0	0	113.2	D3	D3-G5 PolarHBondContact O-N 3.4Å
6	A	78.2	Confident	84.2	Confident	96 Å²	96	107.6 Å²	107.6	79%	0.793	62%	0.623	S	S	*	*	G	3₁₀ helix	trans	-86.2	-6.6	178.1	0	0	0	0	0	113.8	S4 R8	S4-A6 VanDerWaalsContact C-N 3.27Å; S4-A6 PolarHBondContact O-N 2.91Å; A6-R8 VanDerWaalsContact C-N 3.27Å; A6-R8 PolarHBondContact O-N 3.35Å
7	S	81.1	Confident	84.8	Confident	96 Å²	96	102.7 Å²	102.7	67%	0.671	59%	0.593	S	S	*	*			trans	-82.5	2.1	-172.8	-51.5	0	0	0	0	114.2	S4 S9	S4-S7 WeakPolarHBondContact O-CB 3.46Å; S4-S7 PolarHBondContact O-N 3.03Å; S4-S7 VanDerWaalsContact O-N 3.16Å; S7-S9 PolarHBondContact O-N 3.49Å
8	R	81.4	Confident	85.3	Confident	185 Å²	185	103.4 Å²	103.4	70%	0.698	59%	0.585	S	S	*	*			trans	-73.7	118.4	178.7	-65.7	-177.7	-176.5	-96.7	0.1	109.6	A6 F10	A6-R8 VanDerWaalsContact C-N 3.27Å; A6-R8 PolarHBondContact O-N 3.35Å; R8-F10 HydrophobicContact CB-CE2 3.98Å; R8-F10 HydrophobicContact CB-CZ 4.35Å; R8-F10 WeakPolarHBondContact O-CD2 3.49Å
9	S	86.8	Confident	85.8	Confident	113 Å²	113	104.4 Å²	104.4	79%	0.79	58%	0.583	S	S	*	*			trans	-75.8	132.4	171.9	-174	0	0	0	0	110.1	S7	S7-S9 PolarHBondContact O-N 3.49Å
10	F	87.9	Confident	86.2	Confident	94 Å²	94	102.5 Å²	102.5	41%	0.412	57%	0.571	S	S	.	*			trans	-114.1	148.1	171.2	-67.8	-85.8	0	0	0	109.7	R8 S12 F14 V15	R8-F10 HydrophobicContact CB-CE2 3.98Å; R8-F10 HydrophobicContact CB-CZ 4.35Å; R8-F10 WeakPolarHBondContact O-CD2 3.49Å; F10-S12 PolarHBondContact O-N 3.49Å; F10-F14 HydrophobicContact CB-CD1 3.76Å; F10-F14 HydrophobicContact CB-CE1 4.38Å; F10-F14 AromaticContact CD1-CD1 3.87Å; F10-F14 HydrophobicContact CD1-CD1 3.87Å; F10-F14 AromaticContact CD1-CE1 3.85Å; F10-F14 HydrophobicContact CD1-CE1 3.85Å; F10-F14 HydrophobicContact CE1-CE1 4.33Å; F10-F14 AromaticContact CG-CD1 3.97Å; F10-F14 HydrophobicContact CG-CD1 3.97Å; F10-F14 HydrophobicContact CG-CE1 4.1Å; F10-V15 HydrophobicContact CB-CG2 3.9Å
11	P	92	Very high	86.6	Confident	81 Å²	81	97.8 Å²	97.8	53%	0.526	55%	0.545	S	S	.	.			trans	-55	139.5	174.3	-23.9	33.6	0	0	0	111.4	R13 F14 V15	P11-R13 PolarHBondContact O-N 3.36Å; P11-R13 VanDerWaalsContact O-N 3.13Å; P11-F14 WeakPolarHBondContact O-CB 3.29Å; P11-F14 PolarHBondContact O-N 3.36Å; P11-V15 PolarHBondContact O-N 3.11Å; P11-V15 VanDerWaalsContact O-N 3.09Å
12	S	92.1	Very high	87.8	Confident	108 Å²	108	89.6 Å²	89.6	76%	0.755	51%	0.507	S	S	*	.	H	α-helix	trans	-54.1	-36.8	179.9	55.9	0	0	0	0	112.9	F10 F14 V15 G16	F10-S12 PolarHBondContact O-N 3.49Å; S12-F14 PolarHBondContact O-N 3.3Å; S12-V15 PolarHBondContact O-N 2.94Å; S12-G16 PolarHBondContact O-N 3.3Å
13	R	92.3	Very high	88.3	Confident	172 Å²	172	84.4 Å²	84.4	65%	0.649	48%	0.48	S	S	*	.	H	α-helix	trans	-58.1	-46.4	174	-175.7	179.5	-176.9	-90.8	7.3	112.3	P11 G16 Q17	P11-R13 PolarHBondContact O-N 3.36Å; P11-R13 VanDerWaalsContact O-N 3.13Å; R13-G16 PolarHBondContact O-N 3.13Å; R13-Q17 VanDerWaalsContact NH1-OE1 3.13Å; R13-Q17 VanDerWaalsContact O-CG 3.29Å; R13-Q17 WeakPolarHBondContact O-CG 3.38Å; R13-Q17 PolarHBondContact O-N 3.06Å
14	F	92.2	Very high	89.1	Confident	31 Å²	31	78.4 Å²	78.4	14%	0.136	45%	0.448	C	S	.	.	H	α-helix	trans	-64	-45.4	178	171.9	-92.9	0	0	0	110.5	F10 P11 S12 G16 Q17 Y18 I40	F10-F14 HydrophobicContact CB-CD1 3.76Å; F10-F14 HydrophobicContact CB-CE1 4.38Å; F10-F14 AromaticContact CD1-CD1 3.87Å; F10-F14 HydrophobicContact CD1-CD1 3.87Å; F10-F14 AromaticContact CD1-CE1 3.85Å; F10-F14 HydrophobicContact CD1-CE1 3.85Å; F10-F14 HydrophobicContact CE1-CE1 4.33Å; F10-F14 AromaticContact CG-CD1 3.97Å; F10-F14 HydrophobicContact CG-CD1 3.97Å; F10-F14 HydrophobicContact CG-CE1 4.1Å; P11-F14 WeakPolarHBondContact O-CB 3.29Å; P11-F14 PolarHBondContact O-N 3.36Å; S12-F14 PolarHBondContact O-N 3.3Å; F14-G16 VanDerWaalsContact C-N 3.34Å; F14-G16 PolarHBondContact O-N 2.77Å; F14-Q17 PolarHBondContact O-N 3.31Å; F14-Y18 HydrophobicContact CZ-CD2 4.5Å; F14-Y18 VanDerWaalsContact O-CB 3.28Å; F14-Y18 WeakPolarHBondContact O-CB 3.44Å; F14-Y18 PolarHBondContact O-N 3.09Å; F14-I40 HydrophobicContact CD2-CD1 4.11Å; F14-I40 HydrophobicContact CD2-CG1 4.11Å; F14-I40 HydrophobicContact CE2-CD1 3.79Å; F14-I40 HydrophobicContact CE2-CG1 4Å; F14-I40 HydrophobicContact CZ-CD1 4.35Å
15	V	93.5	Very high	90	Very high	76 Å²	76	75.9 Å²	75.9	46%	0.461	43%	0.431	S	S	.	.	H	α-helix	trans	-60.4	-43.7	179.2	178.7	0	0	0	0	111.2	F10 P11 S12 Y18 F19	F10-V15 HydrophobicContact CB-CG2 3.9Å; P11-V15 PolarHBondContact O-N 3.11Å; P11-V15 VanDerWaalsContact O-N 3.09Å; S12-V15 PolarHBondContact O-N 2.94Å; V15-Y18 PolarHBondContact O-N 3.18Å; V15-F19 WeakPolarHBondContact O-CB 3.49Å; V15-F19 PolarHBondContact O-N 2.95Å
16	G	94.7	Very high	90.6	Very high	35 Å²	35	74.9 Å²	74.9	36%	0.361	41%	0.413	S	S	.	.	H	α-helix	trans	-63.3	-44.6	176	0	0	0	0	0	112.7	S12 R13 F14 Y18 F19 N20	S12-G16 PolarHBondContact O-N 3.3Å; R13-G16 PolarHBondContact O-N 3.13Å; F14-G16 VanDerWaalsContact C-N 3.34Å; F14-G16 PolarHBondContact O-N 2.77Å; G16-Y18 PolarHBondContact O-N 2.92Å; G16-F19 PolarHBondContact O-N 3.45Å; G16-N20 VanDerWaalsContact O-CG 3.29Å; G16-N20 PolarHBondContact O-N 2.99Å; G16-N20 PolarHBondContact O-OD1 3.42Å
17	Q	94.2	Very high	91	Very high	25 Å²	25	76 Å²	76	12%	0.117	40%	0.402	C	S	.	.	H	α-helix	trans	-64.3	-40.4	176.2	-71.1	177.4	-46.1	0	0	112.2	R13 F14 F19 N20 V21 I40	R13-Q17 VanDerWaalsContact NH1-OE1 3.13Å; R13-Q17 VanDerWaalsContact O-CG 3.29Å; R13-Q17 WeakPolarHBondContact O-CG 3.38Å; R13-Q17 PolarHBondContact O-N 3.06Å; F14-Q17 PolarHBondContact O-N 3.31Å; Q17-F19 VanDerWaalsContact C-N 3.33Å; Q17-N20 PolarHBondContact O-N 3.13Å; Q17-V21 PolarHBondContact O-N 3.42Å; Q17-I40 HydrophobicContact CB-CB 4.25Å; Q17-I40 HydrophobicContact CB-CD1 4.1Å; Q17-I40 HydrophobicContact CB-CG1 4.07Å
18	Y	93.5	Very high	91.1	Very high	116 Å²	116	74 Å²	74	46%	0.455	40%	0.396	S	S	.	.	H	α-helix	trans	-62.2	-44.3	176.2	179	-94.2	0	0	0	110.9	F14 V15 G16 N20 V21 V22 I40 F42	F14-Y18 HydrophobicContact CZ-CD2 4.5Å; F14-Y18 VanDerWaalsContact O-CB 3.28Å; F14-Y18 WeakPolarHBondContact O-CB 3.44Å; F14-Y18 PolarHBondContact O-N 3.09Å; V15-Y18 PolarHBondContact O-N 3.18Å; G16-Y18 PolarHBondContact O-N 2.92Å; Y18-N20 VanDerWaalsContact C-N 3.31Å; Y18-N20 PolarHBondContact O-N 3.5Å; Y18-V21 PolarHBondContact O-N 3.49Å; Y18-V22 HydrophobicContact CD1-CG2 4.26Å; Y18-V22 HydrophobicContact CE1-CG2 3.78Å; Y18-V22 PolarHBondContact O-N 3.48Å; Y18-I40 VanDerWaalsContact CA-CD1 3.47Å; Y18-I40 HydrophobicContact CD2-CD1 4.31Å; Y18-F42 HydrophobicContact CD2-CE2 4.24Å; Y18-F42 AromaticContact CD2-CZ 3.88Å; Y18-F42 HydrophobicContact CD2-CZ 3.88Å; Y18-F42 HydrophobicContact CE2-CE2 4.43Å; Y18-F42 HydrophobicContact CE2-CZ 4.11Å
19	F	93.9	Very high	91.4	Very high	122 Å²	122	68.3 Å²	68.3	54%	0.535	38%	0.38	S	S	.	.	H	α-helix	trans	-59.9	-41.4	176	-175.6	-96	0	0	0	111.9	V15 G16 Q17 V21 V22 N23	V15-F19 WeakPolarHBondContact O-CB 3.49Å; V15-F19 PolarHBondContact O-N 2.95Å; G16-F19 PolarHBondContact O-N 3.45Å; Q17-F19 VanDerWaalsContact C-N 3.33Å; F19-V21 VanDerWaalsContact C-N 3.3Å; F19-V21 PolarHBondContact O-N 2.8Å; F19-V22 PolarHBondContact O-N 3.29Å; F19-V22 VanDerWaalsContact O-N 3.14Å; F19-N23 HydrophobicContact CD1-CB 4.23Å; F19-N23 HydrophobicContact CE1-CB 3.87Å; F19-N23 HydrophobicContact CZ-CB 4.19Å; F19-N23 VanDerWaalsContact O-CB 3.29Å; F19-N23 WeakPolarHBondContact O-CB 3.43Å; F19-N23 PolarHBondContact O-N 2.9Å
20	N	94	Very high	91.5	Very high	65 Å²	65	66 Å²	66	35%	0.348	36%	0.362	S	S	.	.	H	α-helix	trans	-59.8	-39.4	177.1	-65.9	-7.9	0	0	0	112.4	G16 Q17 Y18 A24 Y36	G16-N20 VanDerWaalsContact O-CG 3.29Å; G16-N20 PolarHBondContact O-N 2.99Å; G16-N20 PolarHBondContact O-OD1 3.42Å; Q17-N20 PolarHBondContact O-N 3.13Å; Y18-N20 VanDerWaalsContact C-N 3.31Å; Y18-N20 PolarHBondContact O-N 3.5Å; N20-A24 WeakPolarHBondContact O-CB 3.32Å; N20-A24 PolarHBondContact O-N 3.25Å; N20-Y36 HydrophobicContact CB-CD1 4.18Å; N20-Y36 HydrophobicContact CB-CD2 3.84Å; N20-Y36 HydrophobicContact CB-CE1 4.39Å; N20-Y36 HydrophobicContact CB-CE2 4.05Å; N20-Y36 HydrophobicContact CB-CG 3.92Å
21	V	94.3	Very high	91.7	Very high	5 Å²	5	69.1 Å²	69.1	3%	0.03	38%	0.375	C	S	.	.	H	α-helix	trans	-64	-43.1	175.7	178.7	0	0	0	0	111.2	Q17 Y18 F19 P25 I40 F42 V59	Q17-V21 PolarHBondContact O-N 3.42Å; Y18-V21 PolarHBondContact O-N 3.49Å; F19-V21 VanDerWaalsContact C-N 3.3Å; F19-V21 PolarHBondContact O-N 2.8Å; V21-P25 WeakPolarHBondContact O-CD 3.43Å; V21-I40 HydrophobicContact CG2-CG2 4.11Å; V21-F42 HydrophobicContact CG1-CD2 4.49Å; V21-F42 HydrophobicContact CG1-CE2 4.49Å; V21-V59 HydrophobicContact CG1-CG1 4.34Å; V21-V59 WeakPolarHBondContact O-CG1 3.12Å
22	V	92.4	Very high	91.8	Very high	48 Å²	48	65.6 Å²	65.6	29%	0.291	35%	0.353	S	S	.	.	H	α-helix	trans	-73.6	-32.3	-178.4	176.6	0	0	0	0	112.1	Y18 F19 P25 F66	Y18-V22 HydrophobicContact CD1-CG2 4.26Å; Y18-V22 HydrophobicContact CE1-CG2 3.78Å; Y18-V22 PolarHBondContact O-N 3.48Å; F19-V22 PolarHBondContact O-N 3.29Å; F19-V22 VanDerWaalsContact O-N 3.14Å; V22-P25 WeakPolarHBondContact O-CD 3.08Å; V22-F66 HydrophobicContact CG1-CE2 4.2Å
23	N	92.4	Very high	91.9	Very high	48 Å²	48	60.5 Å²	60.5	26%	0.257	32%	0.317	S	S	.	.	H	α-helix	trans	-83.9	-27.1	179.6	-170.5	64.6	0	0	0	113	F19 P25 S26 E27	F19-N23 HydrophobicContact CD1-CB 4.23Å; F19-N23 HydrophobicContact CE1-CB 3.87Å; F19-N23 HydrophobicContact CZ-CB 4.19Å; F19-N23 VanDerWaalsContact O-CB 3.29Å; F19-N23 WeakPolarHBondContact O-CB 3.43Å; F19-N23 PolarHBondContact O-N 2.9Å; N23-P25 VanDerWaalsContact C-N 3.3Å; N23-P25 VanDerWaalsContact O-N 3.13Å; N23-S26 WeakPolarHBondContact O-CB 3.43Å; N23-S26 PolarHBondContact O-N 3.33Å; N23-S26 PolarHBondContact O-OG 3.32Å; N23-S26 PolarHBondContact OD1-OG 3.07Å; N23-E27 PolarHBondContact ND2-OE1 3.49Å
24	A	93.3	Very high	92	Very high	1 Å²	1	53.7 Å²	53.7	1%	0.008	29%	0.293	C	S	.	.	H	α-helix	trans	-49.6	-38.7	-178.1	0	0	0	0	0	115.4	N20 S26 E27 S32 I33 Y36	N20-A24 WeakPolarHBondContact O-CB 3.32Å; N20-A24 PolarHBondContact O-N 3.25Å; A24-S26 PolarHBondContact O-N 3.46Å; A24-E27 PolarHBondContact O-N 3.28Å; A24-E27 VanDerWaalsContact O-N 3.13Å; A24-S32 WeakPolarHBondContact CB-OG 3.41Å; A24-I33 HydrophobicContact CB-CG1 3.56Å; A24-Y36 HydrophobicContact CB-CD2 4.04Å; A24-Y36 HydrophobicContact CB-CE2 4.28Å
25	P	91.9	Very high	92.2	Very high	12 Å²	12	57.9 Å²	57.9	8%	0.078	31%	0.313	C	S	.	.	H	α-helix	trans	-57.4	-31.3	172.4	-28.8	36.2	0	0	0	115.3	V21 V22 N23 E27 G28 I33 V59 M60	V21-P25 WeakPolarHBondContact O-CD 3.43Å; V22-P25 WeakPolarHBondContact O-CD 3.08Å; N23-P25 VanDerWaalsContact C-N 3.3Å; N23-P25 VanDerWaalsContact O-N 3.13Å; P25-E27 PolarHBondContact O-N 3.02Å; P25-G28 PolarHBondContact O-N 2.78Å; P25-G28 VanDerWaalsContact O-N 3.16Å; P25-I33 HydrophobicContact CG-CD1 3.87Å; P25-I33 HydrophobicContact CG-CG1 4.48Å; P25-V59 HydrophobicContact CG-CG1 3.67Å; P25-V59 WeakPolarHBondContact CG-O 3.46Å; P25-M60 HydrophobicContact CB-SD 3.89Å; P25-M60 HydrophobicContact CG-SD 4.28Å
26	S	89.6	Confident	92.3	Very high	44 Å²	44	57.5 Å²	57.5	31%	0.308	30%	0.304	S	S	.	.	H	α-helix	trans	-69.8	-22.9	179.8	78.4	0	0	0	0	112.2	N23 A24 G28	N23-S26 WeakPolarHBondContact O-CB 3.43Å; N23-S26 PolarHBondContact O-N 3.33Å; N23-S26 PolarHBondContact O-OG 3.32Å; N23-S26 PolarHBondContact OD1-OG 3.07Å; A24-S26 PolarHBondContact O-N 3.46Å; S26-G28 VanDerWaalsContact C-N 3.35Å
27	E	87.5	Confident	92.3	Very high	120 Å²	120	55.9 Å²	55.9	56%	0.561	29%	0.287	S	S	*	.	H	α-helix	trans	-84.9	-11.3	175.1	-61.8	176.1	-170.2	0	0	112.5	N23 A24 P25 D29	N23-E27 PolarHBondContact ND2-OE1 3.49Å; A24-E27 PolarHBondContact O-N 3.28Å; A24-E27 VanDerWaalsContact O-N 3.13Å; P25-E27 PolarHBondContact O-N 3.02Å; E27-D29 VanDerWaalsContact C-N 3.29Å; E27-D29 PolarHBondContact O-N 2.95Å
28	G	83.3	Confident	92.3	Very high	53 Å²	53	59.8 Å²	59.8	55%	0.546	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.8	15	177.4	0	0	0	0	0	115	P25 S26 P30	P25-G28 PolarHBondContact O-N 2.78Å; P25-G28 VanDerWaalsContact O-N 3.16Å; S26-G28 VanDerWaalsContact C-N 3.35Å; G28-P30 WeakPolarHBondContact O-CD 3.32Å
29	D	87.4	Confident	92.2	Very high	66 Å²	66	58.1 Å²	58.1	35%	0.353	30%	0.302	S	S	.	.			trans	-105.9	102.4	176.4	-174.2	11.2	0	0	0	112	E27 K31 S32	E27-D29 VanDerWaalsContact C-N 3.29Å; E27-D29 PolarHBondContact O-N 2.95Å; D29-K31 PolarHBondContact O-N 3.17Å; D29-K31 VanDerWaalsContact OD1-CB 3.31Å; D29-K31 WeakPolarHBondContact OD1-CB 3.31Å; D29-K31 PolarHBondContact OD1-N 2.87Å; D29-S32 PolarHBondContact O-N 3.49Å; D29-S32 PolarHBondContact O-OG 3.44Å
30	P	88.4	Confident	92.2	Very high	63 Å²	63	52.4 Å²	52.4	41%	0.409	28%	0.277	S	S	.	.	H	α-helix	trans	-64.8	-20.6	176.1	24.6	-32.5	0	0	0	113.4	G28 I33 T56	G28-P30 WeakPolarHBondContact O-CD 3.32Å; P30-I33 WeakPolarHBondContact O-CB 3.47Å; P30-I33 PolarHBondContact O-N 3.02Å; P30-T56 HydrophobicContact CB-CG2 3.55Å
31	K	92.8	Very high	92.1	Very high	161 Å²	161	50.7 Å²	50.7	70%	0.7	28%	0.275	S	S	*	.	H	α-helix	trans	-72	-37.1	179.5	-62.2	178.1	-178.9	174.2	0	111.7	D29 I33 L34 E35	D29-K31 PolarHBondContact O-N 3.17Å; D29-K31 VanDerWaalsContact OD1-CB 3.31Å; D29-K31 WeakPolarHBondContact OD1-CB 3.31Å; D29-K31 PolarHBondContact OD1-N 2.87Å; K31-I33 VanDerWaalsContact C-N 3.26Å; K31-I33 PolarHBondContact O-N 3.14Å; K31-L34 PolarHBondContact O-N 3.35Å; K31-E35 PolarHBondContact O-N 3.46Å; K31-E35 VanDerWaalsContact O-N 3.07Å
32	S	94.2	Very high	91.9	Very high	7 Å²	7	53.1 Å²	53.1	5%	0.049	29%	0.285	C	S	.	.	H	α-helix	trans	-64.1	-34.2	177.2	71.9	0	0	0	0	111.3	A24 D29 L34 E35 Y36	A24-S32 WeakPolarHBondContact CB-OG 3.41Å; D29-S32 PolarHBondContact O-N 3.49Å; D29-S32 PolarHBondContact O-OG 3.44Å; S32-L34 PolarHBondContact O-N 2.74Å; S32-E35 PolarHBondContact O-N 3.35Å; S32-Y36 WeakPolarHBondContact O-CB 3.26Å; S32-Y36 WeakPolarHBondContact O-CD2 3.44Å; S32-Y36 VanDerWaalsContact O-CG 3.29Å; S32-Y36 PolarHBondContact O-N 2.84Å
33	I	95	Very high	91.9	Very high	0 Å²	0	51 Å²	51	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-57.5	-49.2	173.4	-61.7	173.5	0	0	0	110.9	A24 P25 P30 K31 S37 T56 V59 M60	A24-I33 HydrophobicContact CB-CG1 3.56Å; P25-I33 HydrophobicContact CG-CD1 3.87Å; P25-I33 HydrophobicContact CG-CG1 4.48Å; P30-I33 WeakPolarHBondContact O-CB 3.47Å; P30-I33 PolarHBondContact O-N 3.02Å; K31-I33 VanDerWaalsContact C-N 3.26Å; K31-I33 PolarHBondContact O-N 3.14Å; I33-S37 WeakPolarHBondContact O-CB 3.09Å; I33-S37 PolarHBondContact O-N 3Å; I33-S37 PolarHBondContact O-OG 2.97Å; I33-T56 HydrophobicContact CB-CG2 4.43Å; I33-T56 HydrophobicContact CD1-CG2 4.15Å; I33-V59 HydrophobicContact CD1-CB 4.37Å; I33-V59 HydrophobicContact CD1-CG1 4.05Å; I33-V59 HydrophobicContact CG1-CG1 4.31Å; I33-V59 HydrophobicContact CG2-CB 3.87Å; I33-V59 HydrophobicContact CG2-CG1 3.84Å; I33-V59 HydrophobicContact CG2-CG2 4.13Å; I33-M60 HydrophobicContact CD1-CG 3.8Å; I33-M60 HydrophobicContact CD1-SD 3.47Å; I33-M60 WeakPolarHBondContact CD1-SD 3.36Å
34	L	94.2	Very high	91.8	Very high	30 Å²	30	52.9 Å²	52.9	16%	0.157	29%	0.286	C	S	.	.	H	α-helix	trans	-64.2	-43.3	179.1	-72	175	0	0	0	111.8	K31 S32 S37 R38 L43 E52 T56	K31-L34 PolarHBondContact O-N 3.35Å; S32-L34 PolarHBondContact O-N 2.74Å; L34-S37 PolarHBondContact O-N 3.17Å; L34-R38 WeakPolarHBondContact O-CG 3.34Å; L34-R38 PolarHBondContact O-N 3.3Å; L34-L43 HydrophobicContact CD2-CD1 3.64Å; L34-E52 HydrophobicContact CD1-CB 4.48Å; L34-E52 HydrophobicContact CD2-CB 3.82Å; L34-E52 HydrophobicContact CD2-CG 4.25Å; L34-T56 VanDerWaalsContact CD2-OG1 3.31Å; L34-T56 WeakPolarHBondContact CD2-OG1 3.29Å; L34-T56 WeakPolarHBondContact CG-OG1 3.35Å
35	E	95.2	Very high	91.5	Very high	119 Å²	119	54.8 Å²	54.8	56%	0.556	31%	0.305	S	S	*	.	H	α-helix	trans	-60.9	-53.5	177.7	-174.5	177.8	171.6	0	0	111.5	K31 S32 S37 R38 V39	K31-E35 PolarHBondContact O-N 3.46Å; K31-E35 VanDerWaalsContact O-N 3.07Å; S32-E35 PolarHBondContact O-N 3.35Å; E35-S37 VanDerWaalsContact C-N 3.29Å; E35-S37 PolarHBondContact O-N 3.16Å; E35-R38 PolarHBondContact O-N 3.26Å; E35-R38 VanDerWaalsContact O-N 3.16Å; E35-V39 WeakPolarHBondContact O-CG2 3.49Å; E35-V39 PolarHBondContact O-N 3.36Å
36	Y	95.4	Very high	91.4	Very high	68 Å²	68	64.4 Å²	64.4	27%	0.267	34%	0.342	S	S	.	.	H	α-helix	trans	-63.5	-36.6	179	-63.2	-38.7	0	0	0	112.3	N20 A24 S32 R38 V39 I40	N20-Y36 HydrophobicContact CB-CD1 4.18Å; N20-Y36 HydrophobicContact CB-CD2 3.84Å; N20-Y36 HydrophobicContact CB-CE1 4.39Å; N20-Y36 HydrophobicContact CB-CE2 4.05Å; N20-Y36 HydrophobicContact CB-CG 3.92Å; A24-Y36 HydrophobicContact CB-CD2 4.04Å; A24-Y36 HydrophobicContact CB-CE2 4.28Å; S32-Y36 WeakPolarHBondContact O-CB 3.26Å; S32-Y36 WeakPolarHBondContact O-CD2 3.44Å; S32-Y36 VanDerWaalsContact O-CG 3.29Å; S32-Y36 PolarHBondContact O-N 2.84Å; Y36-R38 VanDerWaalsContact C-N 3.32Å; Y36-R38 PolarHBondContact O-N 3.28Å; Y36-V39 PolarHBondContact O-N 3.29Å; Y36-I40 WeakPolarHBondContact O-CG2 3.41Å; Y36-I40 PolarHBondContact O-N 2.96Å
37	S	94.7	Very high	91.2	Very high	0 Å²	0	63.8 Å²	63.8	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-65.4	-33.7	176.6	-62.9	0	0	0	0	112.2	I33 L34 E35 G41 F42 L43 H55	I33-S37 WeakPolarHBondContact O-CB 3.09Å; I33-S37 PolarHBondContact O-N 3Å; I33-S37 PolarHBondContact O-OG 2.97Å; L34-S37 PolarHBondContact O-N 3.17Å; E35-S37 VanDerWaalsContact C-N 3.29Å; E35-S37 PolarHBondContact O-N 3.16Å; S37-G41 CarbonylContact O-C 3.58Å; S37-G41 PolarHBondContact O-N 3.35Å; S37-F42 WeakPolarHBondContact O-CA 3.4Å; S37-F42 PolarHBondContact O-N 3.37Å; S37-L43 PolarHBondContact O-N 3.29Å; S37-L43 VanDerWaalsContact O-N 3.08Å; S37-H55 WeakPolarHBondContact CB-NE2 3.33Å; S37-H55 PolarHBondContact OG-NE2 3.17Å
38	R	93.9	Very high	91.4	Very high	107 Å²	107	61.4 Å²	61.4	40%	0.404	33%	0.33	S	S	.	.	H	α-helix	trans	-72.7	-41.7	171.4	-70	172.8	-173.2	138.4	-2.3	111.8	L34 E35 Y36 I40 G41 L43 E52	L34-R38 WeakPolarHBondContact O-CG 3.34Å; L34-R38 PolarHBondContact O-N 3.3Å; E35-R38 PolarHBondContact O-N 3.26Å; E35-R38 VanDerWaalsContact O-N 3.16Å; Y36-R38 VanDerWaalsContact C-N 3.32Å; Y36-R38 PolarHBondContact O-N 3.28Å; R38-I40 PolarHBondContact O-N 3.34Å; R38-G41 WeakPolarHBondContact O-CA 3.49Å; R38-G41 PolarHBondContact O-N 3.03Å; R38-L43 HydrophobicContact CG-CB 3.82Å; R38-L43 HydrophobicContact CG-CD1 4.48Å; R38-E52 IonicContact CZ-OE1 3.38Å; R38-E52 IonicContact NE-OE1 3.17Å; R38-E52 VanDerWaalsContact NH2-CD 3.29Å; R38-E52 IonicContact NH2-OE1 2.74Å; R38-E52 PolarHBondContact NH2-OE1 3.4Å; R38-E52 IonicContact NH2-OE2 2.8Å; R38-E52 PolarHBondContact NH2-OE2 2.88Å
39	V	93	Very high	91.8	Very high	81 Å²	81	67.6 Å²	67.6	49%	0.491	34%	0.337	S	S	.	.	H	α-helix	trans	-64	-39.8	-179.2	166.6	0	0	0	0	112.7	E35 Y36	E35-V39 WeakPolarHBondContact O-CG2 3.49Å; E35-V39 PolarHBondContact O-N 3.36Å; Y36-V39 PolarHBondContact O-N 3.29Å
40	I	93.8	Very high	91.9	Very high	3 Å²	3	68.6 Å²	68.6	2%	0.015	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-12.9	172.6	-159.4	173.9	0	0	0	112.1	F14 Q17 Y18 V21 Y36 R38 F42 Q101	F14-I40 HydrophobicContact CD2-CD1 4.11Å; F14-I40 HydrophobicContact CD2-CG1 4.11Å; F14-I40 HydrophobicContact CE2-CD1 3.79Å; F14-I40 HydrophobicContact CE2-CG1 4Å; F14-I40 HydrophobicContact CZ-CD1 4.35Å; Q17-I40 HydrophobicContact CB-CB 4.25Å; Q17-I40 HydrophobicContact CB-CD1 4.1Å; Q17-I40 HydrophobicContact CB-CG1 4.07Å; Y18-I40 VanDerWaalsContact CA-CD1 3.47Å; Y18-I40 HydrophobicContact CD2-CD1 4.31Å; V21-I40 HydrophobicContact CG2-CG2 4.11Å; Y36-I40 WeakPolarHBondContact O-CG2 3.41Å; Y36-I40 PolarHBondContact O-N 2.96Å; R38-I40 PolarHBondContact O-N 3.34Å; I40-F42 HydrophobicContact CD1-CE1 4.41Å; I40-F42 HydrophobicContact CD1-CE2 4.27Å; I40-F42 HydrophobicContact CD1-CZ 4.02Å; I40-F42 HydrophobicContact CG2-CB 4.12Å; I40-F42 HydrophobicContact CG2-CD1 3.98Å; I40-F42 HydrophobicContact CG2-CD2 3.57Å; I40-F42 HydrophobicContact CG2-CE1 4.31Å; I40-F42 HydrophobicContact CG2-CE2 3.95Å; I40-F42 HydrophobicContact CG2-CG 3.6Å; I40-F42 HydrophobicContact CG2-CZ 4.31Å; I40-Q101 PolarHBondContact O-NE2 2.8Å
41	G	91.4	Very high	91.9	Very high	29 Å²	29	66.4 Å²	66.4	30%	0.299	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.8	25.4	179.4	0	0	0	0	0	114.3	S37 R38 L43 P97	S37-G41 CarbonylContact O-C 3.58Å; S37-G41 PolarHBondContact O-N 3.35Å; R38-G41 WeakPolarHBondContact O-CA 3.49Å; R38-G41 PolarHBondContact O-N 3.03Å; G41-L43 VanDerWaalsContact C-N 3.31Å; G41-P97 WeakPolarHBondContact O-CB 3.43Å
42	F	90.8	Very high	91.9	Very high	55 Å²	55	60.4 Å²	60.4	24%	0.241	31%	0.305	C	S	.	.	S	Bend	trans	-71.3	-30.8	164.8	-69.2	-19.6	0	0	0	112.3	Y18 V21 S37 I40 P97	Y18-F42 HydrophobicContact CD2-CE2 4.24Å; Y18-F42 AromaticContact CD2-CZ 3.88Å; Y18-F42 HydrophobicContact CD2-CZ 3.88Å; Y18-F42 HydrophobicContact CE2-CE2 4.43Å; Y18-F42 HydrophobicContact CE2-CZ 4.11Å; V21-F42 HydrophobicContact CG1-CD2 4.49Å; V21-F42 HydrophobicContact CG1-CE2 4.49Å; S37-F42 WeakPolarHBondContact O-CA 3.4Å; S37-F42 PolarHBondContact O-N 3.37Å; I40-F42 HydrophobicContact CD1-CE1 4.41Å; I40-F42 HydrophobicContact CD1-CE2 4.27Å; I40-F42 HydrophobicContact CD1-CZ 4.02Å; I40-F42 HydrophobicContact CG2-CB 4.12Å; I40-F42 HydrophobicContact CG2-CD1 3.98Å; I40-F42 HydrophobicContact CG2-CD2 3.57Å; I40-F42 HydrophobicContact CG2-CE1 4.31Å; I40-F42 HydrophobicContact CG2-CE2 3.95Å; I40-F42 HydrophobicContact CG2-CG 3.6Å; I40-F42 HydrophobicContact CG2-CZ 4.31Å; F42-P97 WeakPolarHBondContact O-CG 3.33Å
43	L	91.8	Very high	91.8	Very high	5 Å²	5	64 Å²	64	3%	0.026	32%	0.32	C	S	.	.	S	Bend	trans	-113.1	135.6	171.9	-59.2	175.6	0	0	0	108.8	L34 S37 R38 G41 E47 H55	L34-L43 HydrophobicContact CD2-CD1 3.64Å; S37-L43 PolarHBondContact O-N 3.29Å; S37-L43 VanDerWaalsContact O-N 3.08Å; R38-L43 HydrophobicContact CG-CB 3.82Å; R38-L43 HydrophobicContact CG-CD1 4.48Å; G41-L43 VanDerWaalsContact C-N 3.31Å; L43-E47 HydrophobicContact CD2-CG 4.02Å; L43-H55 HydrophobicContact CD2-CB 4.45Å
44	T	89.4	Confident	91.6	Very high	86 Å²	86	64.4 Å²	64.4	53%	0.528	32%	0.324	S	S	.	.			trans	-79.9	-19.8	177.9	65.8	0	0	0	0	112.8	Y46 E47	T44-Y46 PolarHBondContact OG1-N 2.74Å; T44-E47 WeakPolarHBondContact CA-OE1 3.33Å; T44-E47 WeakPolarHBondContact CB-OE1 3.32Å; T44-E47 PolarHBondContact N-OE1 3.49Å; T44-E47 PolarHBondContact N-OE2 2.63Å; T44-E47 PolarHBondContact OG1-OE1 2.71Å; T44-E47 PolarHBondContact OG1-OE2 2.77Å
45	G	88.9	Confident	91.6	Very high	41 Å²	41	64.6 Å²	64.6	42%	0.423	32%	0.324	S	S	.	.	S	Bend	trans	91.9	-1.6	-173.5	0	0	0	0	0	114.3	E47	G45-E47 VanDerWaalsContact CA-OE2 3.32Å; G45-E47 WeakPolarHBondContact CA-OE2 3.35Å; G45-E47 PolarHBondContact N-OE2 2.75Å
46	Y	89.1	Confident	91.5	Very high	215 Å²	215	59.5 Å²	59.5	84%	0.843	30%	0.301	S	S	*	.			trans	-106.2	9	177.3	-61	-75.2	0	0	0	113	T44	T44-Y46 PolarHBondContact OG1-N 2.74Å
47	E	85.7	Confident	91.3	Very high	30 Å²	30	60.4 Å²	60.4	14%	0.14	31%	0.31	C	S	.	.			trans	-67	147.6	-177.8	-68.8	75	-159.9	0	0	112	L43 T44 G45 M51 E52	L43-E47 HydrophobicContact CD2-CG 4.02Å; T44-E47 WeakPolarHBondContact CA-OE1 3.33Å; T44-E47 WeakPolarHBondContact CB-OE1 3.32Å; T44-E47 PolarHBondContact N-OE1 3.49Å; T44-E47 PolarHBondContact N-OE2 2.63Å; T44-E47 PolarHBondContact OG1-OE1 2.71Å; T44-E47 PolarHBondContact OG1-OE2 2.77Å; G45-E47 VanDerWaalsContact CA-OE2 3.32Å; G45-E47 WeakPolarHBondContact CA-OE2 3.35Å; G45-E47 PolarHBondContact N-OE2 2.75Å; E47-M51 HydrophobicContact CB-CB 4.25Å; E47-M51 HydrophobicContact CB-CG 4.18Å; E47-M51 HydrophobicContact CB-SD 3.77Å; E47-M51 HydrophobicContact CG-CE 3.74Å; E47-M51 HydrophobicContact CG-CG 4.16Å; E47-M51 HydrophobicContact CG-SD 3.33Å; E47-M51 WeakPolarHBondContact CG-SD 3.48Å; E47-E52 HydrophobicContact CB-CG 4.04Å
48	S	91.1	Very high	91.2	Very high	70 Å²	70	61.3 Å²	61.3	49%	0.49	32%	0.318	S	S	.	.			trans	-64.9	149.9	170.1	73.4	0	0	0	0	110.2	V50 M51 E52	S48-V50 PolarHBondContact O-N 3.11Å; S48-V50 VanDerWaalsContact O-N 3.11Å; S48-M51 WeakPolarHBondContact O-CA 3.42Å; S48-M51 WeakPolarHBondContact O-CB 2.87Å; S48-M51 PolarHBondContact O-N 3.39Å; S48-M51 PolarHBondContact OG-N 3.31Å; S48-E52 PolarHBondContact O-N 3.27Å
49	R	91	Very high	91.2	Very high	184 Å²	184	57.1 Å²	57.1	69%	0.694	30%	0.304	S	S	*	.	H	α-helix	trans	-50.6	-38.9	174.7	-179.6	177.1	170.2	-176.2	-4	112.7	M51 E52 E53	R49-M51 VanDerWaalsContact C-N 3.29Å; R49-M51 PolarHBondContact O-N 2.99Å; R49-E52 PolarHBondContact O-N 3Å; R49-E53 HydrophobicContact CG-CG 4.36Å; R49-E53 IonicContact CZ-OE1 2.8Å; R49-E53 VanDerWaalsContact CZ-OE1 3.29Å; R49-E53 IonicContact NE-OE1 3.2Å; R49-E53 PolarHBondContact NE-OE1 2.66Å; R49-E53 IonicContact NH2-OE1 3.97Å; R49-E53 PolarHBondContact NH2-OE1 2.62Å; R49-E53 WeakPolarHBondContact O-CB 3.49Å; R49-E53 WeakPolarHBondContact O-CG 3.26Å; R49-E53 PolarHBondContact O-N 3.31Å
50	V	89.9	Confident	91.2	Very high	86 Å²	86	56.2 Å²	56.2	52%	0.521	30%	0.295	S	S	.	.	H	α-helix	trans	-64.4	-34.2	179.1	-179.3	0	0	0	0	111.7	S48 A54 V89	S48-V50 PolarHBondContact O-N 3.11Å; S48-V50 VanDerWaalsContact O-N 3.11Å; V50-A54 VanDerWaalsContact O-CB 3.26Å; V50-A54 WeakPolarHBondContact O-CB 3.4Å; V50-A54 PolarHBondContact O-N 3.34Å; V50-V89 HydrophobicContact CG1-CG1 3.61Å
51	M	89.5	Confident	91	Very high	17 Å²	17	56.6 Å²	56.6	8%	0.084	30%	0.297	C	S	.	.	H	α-helix	trans	-75.7	-39.5	174.5	179.4	-179.9	179.6	0	0	112.1	E47 S48 R49 E53 A54 H55 T90 A93	E47-M51 HydrophobicContact CB-CB 4.25Å; E47-M51 HydrophobicContact CB-CG 4.18Å; E47-M51 HydrophobicContact CB-SD 3.77Å; E47-M51 HydrophobicContact CG-CE 3.74Å; E47-M51 HydrophobicContact CG-CG 4.16Å; E47-M51 HydrophobicContact CG-SD 3.33Å; E47-M51 WeakPolarHBondContact CG-SD 3.48Å; S48-M51 WeakPolarHBondContact O-CA 3.42Å; S48-M51 WeakPolarHBondContact O-CB 2.87Å; S48-M51 PolarHBondContact O-N 3.39Å; S48-M51 PolarHBondContact OG-N 3.31Å; R49-M51 VanDerWaalsContact C-N 3.29Å; R49-M51 PolarHBondContact O-N 2.99Å; M51-E53 VanDerWaalsContact C-N 3.34Å; M51-A54 PolarHBondContact O-N 3.39Å; M51-H55 VanDerWaalsContact O-CB 3.29Å; M51-H55 WeakPolarHBondContact O-CB 3.26Å; M51-H55 PolarHBondContact O-N 3.34Å; M51-T90 HydrophobicContact CE-CG2 3.89Å; M51-T90 HydrophobicContact CG-CG2 4.38Å; M51-A93 HydrophobicContact CE-CB 3.56Å; M51-A93 HydrophobicContact SD-CB 3.26Å; M51-A93 WeakPolarHBondContact SD-CB 3.43Å
52	E	91.5	Very high	91	Very high	36 Å²	36	59.9 Å²	59.9	17%	0.168	31%	0.307	C	S	.	.	H	α-helix	trans	-60.7	-44.9	174.4	-67.2	-166.7	161.5	0	0	111.3	L34 R38 E47 S48 R49 H55 T56	L34-E52 HydrophobicContact CD1-CB 4.48Å; L34-E52 HydrophobicContact CD2-CB 3.82Å; L34-E52 HydrophobicContact CD2-CG 4.25Å; R38-E52 IonicContact CZ-OE1 3.38Å; R38-E52 IonicContact NE-OE1 3.17Å; R38-E52 VanDerWaalsContact NH2-CD 3.29Å; R38-E52 IonicContact NH2-OE1 2.74Å; R38-E52 PolarHBondContact NH2-OE1 3.4Å; R38-E52 IonicContact NH2-OE2 2.8Å; R38-E52 PolarHBondContact NH2-OE2 2.88Å; E47-E52 HydrophobicContact CB-CG 4.04Å; S48-E52 PolarHBondContact O-N 3.27Å; R49-E52 PolarHBondContact O-N 3Å; E52-H55 PolarHBondContact O-N 3.43Å; E52-T56 WeakPolarHBondContact O-CB 3.42Å; E52-T56 PolarHBondContact O-N 3.06Å; E52-T56 PolarHBondContact O-OG1 3.32Å
53	E	92	Very high	91	Very high	81 Å²	81	57.4 Å²	57.4	38%	0.379	30%	0.297	S	S	.	.	H	α-helix	trans	-62.2	-50.1	174.7	-73	172.6	173.4	0	0	110.5	R49 M51 H55 T56 D57	R49-E53 HydrophobicContact CG-CG 4.36Å; R49-E53 IonicContact CZ-OE1 2.8Å; R49-E53 VanDerWaalsContact CZ-OE1 3.29Å; R49-E53 IonicContact NE-OE1 3.2Å; R49-E53 PolarHBondContact NE-OE1 2.66Å; R49-E53 IonicContact NH2-OE1 3.97Å; R49-E53 PolarHBondContact NH2-OE1 2.62Å; R49-E53 WeakPolarHBondContact O-CB 3.49Å; R49-E53 WeakPolarHBondContact O-CG 3.26Å; R49-E53 PolarHBondContact O-N 3.31Å; M51-E53 VanDerWaalsContact C-N 3.34Å; E53-H55 VanDerWaalsContact C-N 3.32Å; E53-H55 PolarHBondContact O-N 3.05Å; E53-T56 PolarHBondContact O-N 2.89Å; E53-D57 WeakPolarHBondContact O-CB 3.34Å; E53-D57 VanDerWaalsContact O-CG 3.27Å; E53-D57 PolarHBondContact O-N 3.36Å
54	A	91.9	Very high	90.9	Very high	9 Å²	9	60.2 Å²	60.2	7%	0.074	31%	0.31	C	S	.	.	H	α-helix	trans	-61.6	-37.2	178.8	0	0	0	0	0	113.6	V50 M51 A58 V89	V50-A54 VanDerWaalsContact O-CB 3.26Å; V50-A54 WeakPolarHBondContact O-CB 3.4Å; V50-A54 PolarHBondContact O-N 3.34Å; M51-A54 PolarHBondContact O-N 3.39Å; A54-A58 WeakPolarHBondContact O-CB 3.41Å; A54-A58 PolarHBondContact O-N 3.32Å; A54-V89 HydrophobicContact CB-CB 4.08Å; A54-V89 HydrophobicContact CB-CG1 3.97Å
55	H	92.9	Very high	90.8	Very high	35 Å²	35	57.1 Å²	57.1	16%	0.162	29%	0.293	C	S	.	.	H	α-helix	trans	-66.4	-47.5	174.9	178.7	83.2	0	0	0	111	S37 L43 M51 E52 E53 D57 A58 V59	S37-H55 WeakPolarHBondContact CB-NE2 3.33Å; S37-H55 PolarHBondContact OG-NE2 3.17Å; L43-H55 HydrophobicContact CD2-CB 4.45Å; M51-H55 VanDerWaalsContact O-CB 3.29Å; M51-H55 WeakPolarHBondContact O-CB 3.26Å; M51-H55 PolarHBondContact O-N 3.34Å; E52-H55 PolarHBondContact O-N 3.43Å; E53-H55 VanDerWaalsContact C-N 3.32Å; E53-H55 PolarHBondContact O-N 3.05Å; H55-D57 PolarHBondContact O-N 2.81Å; H55-A58 PolarHBondContact O-N 2.94Å; H55-V59 WeakPolarHBondContact O-CG2 3.45Å; H55-V59 PolarHBondContact O-N 2.97Å
56	T	93.5	Very high	90.7	Very high	11 Å²	11	61.2 Å²	61.2	7%	0.067	30%	0.3	C	S	.	.	H	α-helix	trans	-60.8	-46.8	178.5	-55	0	0	0	0	110.9	P30 I33 L34 E52 E53 A58 V59 M60	P30-T56 HydrophobicContact CB-CG2 3.55Å; I33-T56 HydrophobicContact CB-CG2 4.43Å; I33-T56 HydrophobicContact CD1-CG2 4.15Å; L34-T56 VanDerWaalsContact CD2-OG1 3.31Å; L34-T56 WeakPolarHBondContact CD2-OG1 3.29Å; L34-T56 WeakPolarHBondContact CG-OG1 3.35Å; E52-T56 WeakPolarHBondContact O-CB 3.42Å; E52-T56 PolarHBondContact O-N 3.06Å; E52-T56 PolarHBondContact O-OG1 3.32Å; E53-T56 PolarHBondContact O-N 2.89Å; T56-A58 VanDerWaalsContact C-N 3.33Å; T56-A58 PolarHBondContact O-N 3.24Å; T56-V59 PolarHBondContact O-N 2.85Å; T56-M60 HydrophobicContact CG2-CG 4.39Å; T56-M60 WeakPolarHBondContact O-CB 3.31Å; T56-M60 VanDerWaalsContact O-CG 3.27Å; T56-M60 WeakPolarHBondContact O-CG 3.45Å; T56-M60 PolarHBondContact O-N 3.48Å
57	D	92.3	Very high	90.4	Very high	88 Å²	88	53.2 Å²	53.2	47%	0.471	28%	0.283	S	S	.	.	H	α-helix	trans	-59.7	-43.2	177.4	-72.6	-14.9	0	0	0	111.7	E53 H55 V59 M60 I61	E53-D57 WeakPolarHBondContact O-CB 3.34Å; E53-D57 VanDerWaalsContact O-CG 3.27Å; E53-D57 PolarHBondContact O-N 3.36Å; H55-D57 PolarHBondContact O-N 2.81Å; D57-V59 PolarHBondContact O-N 2.87Å; D57-M60 PolarHBondContact O-N 3.08Å; D57-I61 VanDerWaalsContact O-CD1 3.31Å; D57-I61 WeakPolarHBondContact O-CD1 3.4Å; D57-I61 WeakPolarHBondContact O-CG1 3.28Å; D57-I61 PolarHBondContact O-N 3.22Å
58	A	92.3	Very high	90.3	Very high	18 Å²	18	54.5 Å²	54.5	15%	0.149	30%	0.295	C	S	.	.	H	α-helix	trans	-61.7	-43.2	177.7	0	0	0	0	0	112	A54 H55 T56 I61 L62 C86	A54-A58 WeakPolarHBondContact O-CB 3.41Å; A54-A58 PolarHBondContact O-N 3.32Å; H55-A58 PolarHBondContact O-N 2.94Å; T56-A58 VanDerWaalsContact C-N 3.33Å; T56-A58 PolarHBondContact O-N 3.24Å; A58-I61 PolarHBondContact O-N 2.98Å; A58-L62 WeakPolarHBondContact O-CG 3.36Å; A58-L62 PolarHBondContact O-N 2.81Å; A58-L62 VanDerWaalsContact O-N 3.1Å; A58-C86 HydrophobicContact CB-CB 4.06Å
59	V	93.1	Very high	89.9	Confident	19 Å²	19	59.8 Å²	59.8	12%	0.115	32%	0.318	C	S	.	.	H	α-helix	trans	-68.8	-38.7	177.7	178.4	0	0	0	0	110.9	V21 P25 I33 H55 T56 D57 L62 G63	V21-V59 HydrophobicContact CG1-CG1 4.34Å; V21-V59 WeakPolarHBondContact O-CG1 3.12Å; P25-V59 HydrophobicContact CG-CG1 3.67Å; P25-V59 WeakPolarHBondContact CG-O 3.46Å; I33-V59 HydrophobicContact CD1-CB 4.37Å; I33-V59 HydrophobicContact CD1-CG1 4.05Å; I33-V59 HydrophobicContact CG1-CG1 4.31Å; I33-V59 HydrophobicContact CG2-CB 3.87Å; I33-V59 HydrophobicContact CG2-CG1 3.84Å; I33-V59 HydrophobicContact CG2-CG2 4.13Å; H55-V59 WeakPolarHBondContact O-CG2 3.45Å; H55-V59 PolarHBondContact O-N 2.97Å; T56-V59 PolarHBondContact O-N 2.85Å; D57-V59 PolarHBondContact O-N 2.87Å; V59-L62 PolarHBondContact O-N 3.42Å; V59-G63 PolarHBondContact O-N 3.47Å
60	M	92.9	Very high	89.7	Confident	63 Å²	63	58.8 Å²	58.8	31%	0.31	32%	0.321	S	S	.	.	H	α-helix	trans	-60.4	-46.8	174.2	-73	-63.4	-67.6	0	0	111.8	P25 I33 T56 D57 L62 G63 E64	P25-M60 HydrophobicContact CB-SD 3.89Å; P25-M60 HydrophobicContact CG-SD 4.28Å; I33-M60 HydrophobicContact CD1-CG 3.8Å; I33-M60 HydrophobicContact CD1-SD 3.47Å; I33-M60 WeakPolarHBondContact CD1-SD 3.36Å; T56-M60 HydrophobicContact CG2-CG 4.39Å; T56-M60 WeakPolarHBondContact O-CB 3.31Å; T56-M60 VanDerWaalsContact O-CG 3.27Å; T56-M60 WeakPolarHBondContact O-CG 3.45Å; T56-M60 PolarHBondContact O-N 3.48Å; D57-M60 PolarHBondContact O-N 3.08Å; M60-L62 VanDerWaalsContact C-N 3.34Å; M60-L62 PolarHBondContact O-N 3.26Å; M60-G63 PolarHBondContact O-N 3.16Å; M60-G63 VanDerWaalsContact O-N 3.12Å; M60-E64 PolarHBondContact O-N 3.44Å; M60-E64 VanDerWaalsContact O-N 3.16Å
61	I	91.1	Very high	89.6	Confident	10 Å²	10	63.2 Å²	63.2	5%	0.051	34%	0.341	C	S	.	.	H	α-helix	trans	-59.1	-44.1	176.7	-67.9	157	0	0	0	111.3	D57 A58 G63 E64 T79 R82 I83	D57-I61 VanDerWaalsContact O-CD1 3.31Å; D57-I61 WeakPolarHBondContact O-CD1 3.4Å; D57-I61 WeakPolarHBondContact O-CG1 3.28Å; D57-I61 PolarHBondContact O-N 3.22Å; A58-I61 PolarHBondContact O-N 2.98Å; I61-G63 VanDerWaalsContact C-N 3.29Å; I61-G63 PolarHBondContact O-N 3.01Å; I61-E64 PolarHBondContact O-N 2.91Å; I61-T79 HydrophobicContact CG2-CG2 3.68Å; I61-R82 HydrophobicContact CD1-CB 3.88Å; I61-R82 HydrophobicContact CG1-CB 4.36Å; I61-R82 VanDerWaalsContact CG1-NH2 3.31Å; I61-R82 HydrophobicContact CG2-CB 4.03Å; I61-I83 HydrophobicContact CB-CG1 4.14Å; I61-I83 HydrophobicContact CD1-CG1 4.48Å; I61-I83 HydrophobicContact CG2-CD1 4.12Å; I61-I83 HydrophobicContact CG2-CG1 3.68Å
62	L	90.3	Very high	89.5	Confident	99 Å²	99	64.4 Å²	64.4	52%	0.518	35%	0.346	S	S	.	.	H	α-helix	trans	-65.4	-35.6	176.6	-75.4	170.3	0	0	0	112.1	A58 V59 M60 E64 I83	A58-L62 WeakPolarHBondContact O-CG 3.36Å; A58-L62 PolarHBondContact O-N 2.81Å; A58-L62 VanDerWaalsContact O-N 3.1Å; V59-L62 PolarHBondContact O-N 3.42Å; M60-L62 VanDerWaalsContact C-N 3.34Å; M60-L62 PolarHBondContact O-N 3.26Å; L62-E64 VanDerWaalsContact C-N 3.31Å; L62-E64 PolarHBondContact O-N 3.31Å; L62-I83 HydrophobicContact CD1-CD1 4.29Å; L62-I83 HydrophobicContact CD2-CD1 3.33Å; L62-I83 HydrophobicContact CG-CD1 3.52Å; L62-I83 HydrophobicContact CG-CG1 4.47Å
63	G	91.3	Very high	89.3	Confident	3 Å²	3	66.5 Å²	66.5	3%	0.031	36%	0.358	C	S	.	.	H	α-helix	trans	-73.5	-14.6	-179.1	0	0	0	0	0	115.2	V59 M60 I61 A65 F66 G67	V59-G63 PolarHBondContact O-N 3.47Å; M60-G63 PolarHBondContact O-N 3.16Å; M60-G63 VanDerWaalsContact O-N 3.12Å; I61-G63 VanDerWaalsContact C-N 3.29Å; I61-G63 PolarHBondContact O-N 3.01Å; G63-A65 PolarHBondContact O-N 2.91Å; G63-A65 VanDerWaalsContact O-N 3.11Å; G63-F66 PolarHBondContact O-N 3.01Å; G63-G67 PolarHBondContact O-N 3.47Å; G63-G67 VanDerWaalsContact O-N 3.1Å
64	E	88.7	Confident	89.1	Confident	64 Å²	64	70 Å²	70	30%	0.299	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-32.1	177.6	-70.7	176.4	178.6	0	0	111.9	M60 I61 L62 F66 F72 R82	M60-E64 PolarHBondContact O-N 3.44Å; M60-E64 VanDerWaalsContact O-N 3.16Å; I61-E64 PolarHBondContact O-N 2.91Å; L62-E64 VanDerWaalsContact C-N 3.31Å; L62-E64 PolarHBondContact O-N 3.31Å; E64-F66 PolarHBondContact O-N 3.09Å; E64-F72 HydrophobicContact CB-CE2 4.08Å; E64-F72 HydrophobicContact CB-CZ 4.42Å; E64-R82 IonicContact OE1-CZ 3.29Å; E64-R82 IonicContact OE1-NH1 3.71Å; E64-R82 PolarHBondContact OE1-NH1 3.19Å; E64-R82 IonicContact OE1-NH2 2.96Å; E64-R82 PolarHBondContact OE1-NH2 2.94Å; E64-R82 IonicContact OE2-CZ 3.99Å; E64-R82 IonicContact OE2-NH1 2.66Å; E64-R82 PolarHBondContact OE2-NH1 2.72Å
65	A	88.3	Confident	88.9	Confident	20 Å²	20	74.4 Å²	74.4	17%	0.165	40%	0.403	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-21.2	176	0	0	0	0	0	114.5	G63 F72 F74	G63-A65 PolarHBondContact O-N 2.91Å; G63-A65 VanDerWaalsContact O-N 3.11Å; A65-F72 HydrophobicContact CB-CB 4.37Å; A65-F72 HydrophobicContact CB-CD1 3.68Å; A65-F72 HydrophobicContact CB-CD2 4.27Å; A65-F72 HydrophobicContact CB-CE1 3.88Å; A65-F72 HydrophobicContact CB-CE2 4.46Å; A65-F72 HydrophobicContact CB-CG 3.86Å; A65-F72 HydrophobicContact CB-CZ 4.27Å; A65-F74 HydrophobicContact CB-CE1 3.99Å; A65-F74 HydrophobicContact CB-CZ 3.88Å
66	F	86.9	Confident	88.4	Confident	127 Å²	127	77.7 Å²	77.7	56%	0.557	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.7	-9.8	-176	-55.2	-71.7	0	0	0	113.4	V22 G63 E64	V22-F66 HydrophobicContact CG1-CE2 4.2Å; G63-F66 PolarHBondContact O-N 3.01Å; E64-F66 PolarHBondContact O-N 3.09Å
67	G	83	Confident	87.7	Confident	48 Å²	48	80.6 Å²	80.6	50%	0.495	44%	0.438	S	S	.	.	S	Bend	trans	-79.6	-12.9	-176.2	0	0	0	0	0	115.1	G63	G63-G67 PolarHBondContact O-N 3.47Å; G63-G67 VanDerWaalsContact O-N 3.1Å
68	S	82.6	Confident	87.3	Confident	56 Å²	56	79.6 Å²	79.6	39%	0.392	43%	0.432	S	S	.	.			trans	-116	144.1	-178.9	101.2	0	0	0	0	111.6	Q70	S68-Q70 PolarHBondContact O-N 3.47Å; S68-Q70 PolarHBondContact OG-N 3.48Å; S68-Q70 VanDerWaalsContact OG-N 3.16Å; S68-Q70 PolarHBondContact OG-O 3.13Å
69	N	83	Confident	87	Confident	181 Å²	181	80 Å²	80	97%	0.968	43%	0.433	S	S	*	.	S	Bend	trans	-75.4	0.7	171.1	-71.7	-3.2	0	0	0	113.1
70	Q	86.7	Confident	86.6	Confident	163 Å²	163	83.2 Å²	83.2	76%	0.762	45%	0.453	S	S	*	.	S	Bend	trans	-94.6	157.3	176.9	-62.5	-175.3	38.5	0	0	110.3	S68 F72	S68-Q70 PolarHBondContact O-N 3.47Å; S68-Q70 PolarHBondContact OG-N 3.48Å; S68-Q70 VanDerWaalsContact OG-N 3.16Å; S68-Q70 PolarHBondContact OG-O 3.13Å; Q70-F72 PolarHBondContact O-N 2.96Å
71	L	87.3	Confident	86.3	Confident	180 Å²	180	88.8 Å²	88.8	94%	0.942	47%	0.471	S	S	*	.	P	Polyproline II helix	trans	-60.3	123	174.1	-68.1	175.6	0	0	0	109.5	D73	L71-D73 PolarHBondContact O-N 2.74Å
72	F	87	Confident	86.1	Confident	42 Å²	42	92.5 Å²	92.5	18%	0.184	48%	0.484	C	S	.	.	P	Polyproline II helix	trans	-78.6	117.2	173.6	-169.6	-100.1	0	0	0	109.7	E64 A65 Q70 F74 Q77	E64-F72 HydrophobicContact CB-CE2 4.08Å; E64-F72 HydrophobicContact CB-CZ 4.42Å; A65-F72 HydrophobicContact CB-CB 4.37Å; A65-F72 HydrophobicContact CB-CD1 3.68Å; A65-F72 HydrophobicContact CB-CD2 4.27Å; A65-F72 HydrophobicContact CB-CE1 3.88Å; A65-F72 HydrophobicContact CB-CE2 4.46Å; A65-F72 HydrophobicContact CB-CG 3.86Å; A65-F72 HydrophobicContact CB-CZ 4.27Å; Q70-F72 PolarHBondContact O-N 2.96Å; F72-F74 HydrophobicContact CB-CE2 4.42Å; F72-F74 AromaticContact CD1-CD1 3.67Å; F72-F74 HydrophobicContact CD1-CD1 3.67Å; F72-F74 HydrophobicContact CD1-CD2 4.04Å; F72-F74 AromaticContact CD1-CE1 3.51Å; F72-F74 HydrophobicContact CD1-CE1 3.51Å; F72-F74 AromaticContact CD1-CE2 3.9Å; F72-F74 HydrophobicContact CD1-CE2 3.9Å; F72-F74 AromaticContact CD1-CG 3.94Å; F72-F74 HydrophobicContact CD1-CG 3.94Å; F72-F74 AromaticContact CD1-CZ 3.64Å; F72-F74 HydrophobicContact CD1-CZ 3.64Å; F72-F74 AromaticContact CE1-CD1 3.72Å; F72-F74 HydrophobicContact CE1-CD1 3.72Å; F72-F74 AromaticContact CE1-CE1 3.71Å; F72-F74 HydrophobicContact CE1-CE1 3.71Å; F72-F74 HydrophobicContact CE1-CG 4.32Å; F72-F74 HydrophobicContact CE1-CZ 4.3Å; F72-F74 WeakPolarHBondContact O-CD2 3.29Å; F72-F74 PolarHBondContact O-N 3.26Å; F72-Q77 HydrophobicContact CE1-CG 3.63Å; F72-Q77 VanDerWaalsContact CZ-CD 3.48Å; F72-Q77 HydrophobicContact CZ-CG 3.68Å
73	D	87.4	Confident	85.9	Confident	80 Å²	80	89.9 Å²	89.9	43%	0.428	47%	0.47	S	S	.	.			trans	-80.7	102	177.1	-177.5	1	0	0	0	109.9	L71 S75 Q77	L71-D73 PolarHBondContact O-N 2.74Å; D73-S75 VanDerWaalsContact CG-OG 3.3Å; D73-S75 PolarHBondContact O-N 3.38Å; D73-S75 WeakPolarHBondContact OD1-CA 3.31Å; D73-S75 WeakPolarHBondContact OD1-CB 3.18Å; D73-S75 PolarHBondContact OD1-N 2.94Å; D73-S75 PolarHBondContact OD1-OG 3.47Å; D73-S75 PolarHBondContact OD2-OG 3.41Å; D73-Q77 WeakPolarHBondContact O-CG 3.41Å; D73-Q77 PolarHBondContact O-NE2 3.29Å
74	F	88	Confident	85.4	Confident	155 Å²	155	97.6 Å²	97.6	68%	0.68	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-9.7	176.4	-67.3	-82.8	0	0	0	114	A65 F72	A65-F74 HydrophobicContact CB-CE1 3.99Å; A65-F74 HydrophobicContact CB-CZ 3.88Å; F72-F74 HydrophobicContact CB-CE2 4.42Å; F72-F74 AromaticContact CD1-CD1 3.67Å; F72-F74 HydrophobicContact CD1-CD1 3.67Å; F72-F74 HydrophobicContact CD1-CD2 4.04Å; F72-F74 AromaticContact CD1-CE1 3.51Å; F72-F74 HydrophobicContact CD1-CE1 3.51Å; F72-F74 AromaticContact CD1-CE2 3.9Å; F72-F74 HydrophobicContact CD1-CE2 3.9Å; F72-F74 AromaticContact CD1-CG 3.94Å; F72-F74 HydrophobicContact CD1-CG 3.94Å; F72-F74 AromaticContact CD1-CZ 3.64Å; F72-F74 HydrophobicContact CD1-CZ 3.64Å; F72-F74 AromaticContact CE1-CD1 3.72Å; F72-F74 HydrophobicContact CE1-CD1 3.72Å; F72-F74 AromaticContact CE1-CE1 3.71Å; F72-F74 HydrophobicContact CE1-CE1 3.71Å; F72-F74 HydrophobicContact CE1-CG 4.32Å; F72-F74 HydrophobicContact CE1-CZ 4.3Å; F72-F74 WeakPolarHBondContact O-CD2 3.29Å; F72-F74 PolarHBondContact O-N 3.26Å
75	S	87.9	Confident	84.9	Confident	101 Å²	101	98.3 Å²	98.3	71%	0.706	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-29.5	-174.8	76.3	0	0	0	0	113.6	D73	D73-S75 VanDerWaalsContact CG-OG 3.3Å; D73-S75 PolarHBondContact O-N 3.38Å; D73-S75 WeakPolarHBondContact OD1-CA 3.31Å; D73-S75 WeakPolarHBondContact OD1-CB 3.18Å; D73-S75 PolarHBondContact OD1-N 2.94Å; D73-S75 PolarHBondContact OD1-OG 3.47Å; D73-S75 PolarHBondContact OD2-OG 3.41Å
76	T	82.4	Confident	84.5	Confident	104 Å²	104	98.1 Å²	98.1	64%	0.638	51%	0.508	S	S	*	.	S	Bend	trans	-104.6	5.5	-175.6	61.5	0	0	0	0	114.1
77	Q	78.5	Confident	83.3	Confident	71 Å²	71	95 Å²	95	33%	0.332	50%	0.501	S	S	.	.			trans	-86.2	147.3	-169.6	-57.9	-64.6	-28.9	0	0	113.3	F72 D73 T79	F72-Q77 HydrophobicContact CE1-CG 3.63Å; F72-Q77 VanDerWaalsContact CZ-CD 3.48Å; F72-Q77 HydrophobicContact CZ-CG 3.68Å; D73-Q77 WeakPolarHBondContact O-CG 3.41Å; D73-Q77 PolarHBondContact O-NE2 3.29Å; Q77-T79 WeakPolarHBondContact CB-OG1 3.48Å
78	D	84.2	Confident	82	Confident	67 Å²	67	98.2 Å²	98.2	36%	0.358	51%	0.512	S	S	.	.			trans	-105	18.5	171.2	73.2	-22.4	0	0	0	112.5	T80 R81 R82	D78-T80 VanDerWaalsContact C-N 3.28Å; D78-T80 PolarHBondContact O-N 3.31Å; D78-T80 VanDerWaalsContact O-N 3.14Å; D78-R81 HydrophobicContact CB-CB 4.32Å; D78-R81 WeakPolarHBondContact O-CA 3.31Å; D78-R81 VanDerWaalsContact O-CB 3.29Å; D78-R81 WeakPolarHBondContact O-CB 3.44Å; D78-R81 PolarHBondContact O-N 3.46Å; D78-R82 PolarHBondContact O-N 2.86Å; D78-R82 VanDerWaalsContact OD1-CD 3.29Å; D78-R82 WeakPolarHBondContact OD1-CD 3.36Å
79	T	86.3	Confident	80.8	Confident	26 Å²	26	98.6 Å²	98.6	16%	0.16	51%	0.512	C	S	.	.	H	α-helix	trans	-44.6	-49.7	-178.8	-48.9	0	0	0	0	112.2	I61 Q77 R81 R82 I83	I61-T79 HydrophobicContact CG2-CG2 3.68Å; Q77-T79 WeakPolarHBondContact CB-OG1 3.48Å; T79-R81 VanDerWaalsContact C-N 3.32Å; T79-R81 PolarHBondContact O-N 2.83Å; T79-R82 PolarHBondContact O-N 3.23Å; T79-I83 HydrophobicContact CG2-CD1 3.81Å; T79-I83 VanDerWaalsContact O-CG1 3.31Å; T79-I83 WeakPolarHBondContact O-CG1 3.27Å; T79-I83 PolarHBondContact O-N 2.91Å
80	T	85.5	Confident	79.4	Confident	87 Å²	87	90.7 Å²	90.7	53%	0.534	47%	0.47	S	S	.	.	H	α-helix	trans	-63.2	-36.2	178.9	-47.2	0	0	0	0	112.7	D78 R84	D78-T80 VanDerWaalsContact C-N 3.28Å; D78-T80 PolarHBondContact O-N 3.31Å; D78-T80 VanDerWaalsContact O-N 3.14Å; T80-R84 VanDerWaalsContact O-CG 3.26Å; T80-R84 WeakPolarHBondContact O-CG 3.37Å; T80-R84 PolarHBondContact O-N 3.05Å
81	R	86.3	Confident	77.7	Confident	181 Å²	181	85.8 Å²	85.8	68%	0.683	46%	0.463	S	S	*	.	H	α-helix	trans	-68.5	-44.3	176.6	-172.1	-171.6	-66	151.7	-1	110.4	D78 T79 R84 S85	D78-R81 HydrophobicContact CB-CB 4.32Å; D78-R81 WeakPolarHBondContact O-CA 3.31Å; D78-R81 VanDerWaalsContact O-CB 3.29Å; D78-R81 WeakPolarHBondContact O-CB 3.44Å; D78-R81 PolarHBondContact O-N 3.46Å; T79-R81 VanDerWaalsContact C-N 3.32Å; T79-R81 PolarHBondContact O-N 2.83Å; R81-R84 PolarHBondContact O-N 3.5Å; R81-S85 PolarHBondContact O-N 3.23Å
82	R	86.6	Confident	76	Confident	87 Å²	87	84.9 Å²	84.9	33%	0.328	46%	0.459	S	S	.	.	H	α-helix	trans	-63.5	-39.7	177.5	-71.3	-178.3	56.5	-173.9	-7.2	112.9	I61 E64 D78 T79 S85 C86	I61-R82 HydrophobicContact CD1-CB 3.88Å; I61-R82 HydrophobicContact CG1-CB 4.36Å; I61-R82 VanDerWaalsContact CG1-NH2 3.31Å; I61-R82 HydrophobicContact CG2-CB 4.03Å; E64-R82 IonicContact OE1-CZ 3.29Å; E64-R82 IonicContact OE1-NH1 3.71Å; E64-R82 PolarHBondContact OE1-NH1 3.19Å; E64-R82 IonicContact OE1-NH2 2.96Å; E64-R82 PolarHBondContact OE1-NH2 2.94Å; E64-R82 IonicContact OE2-CZ 3.99Å; E64-R82 IonicContact OE2-NH1 2.66Å; E64-R82 PolarHBondContact OE2-NH1 2.72Å; D78-R82 PolarHBondContact O-N 2.86Å; D78-R82 VanDerWaalsContact OD1-CD 3.29Å; D78-R82 WeakPolarHBondContact OD1-CD 3.36Å; T79-R82 PolarHBondContact O-N 3.23Å; R82-S85 PolarHBondContact O-N 3.45Å; R82-S85 PolarHBondContact O-OG 2.91Å; R82-C86 PolarHBondContact O-SG 3.32Å
83	I	85.9	Confident	74.2	Confident	44 Å²	44	85.3 Å²	85.3	23%	0.226	47%	0.47	C	S	.	.	H	α-helix	trans	-69.7	-36.6	177.2	-66.2	164.7	0	0	0	111.5	I61 L62 T79 S85 C86 S87	I61-I83 HydrophobicContact CB-CG1 4.14Å; I61-I83 HydrophobicContact CD1-CG1 4.48Å; I61-I83 HydrophobicContact CG2-CD1 4.12Å; I61-I83 HydrophobicContact CG2-CG1 3.68Å; L62-I83 HydrophobicContact CD1-CD1 4.29Å; L62-I83 HydrophobicContact CD2-CD1 3.33Å; L62-I83 HydrophobicContact CG-CD1 3.52Å; L62-I83 HydrophobicContact CG-CG1 4.47Å; T79-I83 HydrophobicContact CG2-CD1 3.81Å; T79-I83 VanDerWaalsContact O-CG1 3.31Å; T79-I83 WeakPolarHBondContact O-CG1 3.27Å; T79-I83 PolarHBondContact O-N 2.91Å; I83-S85 PolarHBondContact O-N 3.14Å; I83-C86 WeakPolarHBondContact O-CA 3.29Å; I83-C86 VanDerWaalsContact O-CB 3.31Å; I83-C86 WeakPolarHBondContact O-CB 3.31Å; I83-C86 PolarHBondContact O-N 3.43Å; I83-S87 PolarHBondContact O-N 3.1Å
84	R	80.9	Confident	72.5	Confident	165 Å²	165	87.9 Å²	87.9	62%	0.623	48%	0.482	S	S	*	.	H	α-helix	trans	-62	-31.2	176.5	-77.3	173.5	-174.1	144.4	1.3	112.9	T80 R81 C86 S87 T88	T80-R84 VanDerWaalsContact O-CG 3.26Å; T80-R84 WeakPolarHBondContact O-CG 3.37Å; T80-R84 PolarHBondContact O-N 3.05Å; R81-R84 PolarHBondContact O-N 3.5Å; R84-C86 VanDerWaalsContact C-N 3.3Å; R84-S87 PolarHBondContact O-N 2.88Å; R84-S87 PolarHBondContact O-OG 3.48Å; R84-T88 PolarHBondContact O-OG1 3.44Å
85	S	79	Confident	70.5	Confident	80 Å²	80	88.1 Å²	88.1	56%	0.559	49%	0.489	S	S	*	.	H	α-helix	trans	-64.9	-35.1	170.8	31.4	0	0	0	0	112.3	R81 R82 I83	R81-S85 PolarHBondContact O-N 3.23Å; R82-S85 PolarHBondContact O-N 3.45Å; R82-S85 PolarHBondContact O-OG 2.91Å; I83-S85 PolarHBondContact O-N 3.14Å
86	C	78.3	Confident	68.7	Low	16 Å²	16	87.7 Å²	87.7	11%	0.108	49%	0.486	C	S	.	.	H	α-helix	trans	-69.5	-38.7	175.3	-54.3	0	0	0	0	112.1	A58 R82 I83 R84 T88 V89 T90	A58-C86 HydrophobicContact CB-CB 4.06Å; R82-C86 PolarHBondContact O-SG 3.32Å; I83-C86 WeakPolarHBondContact O-CA 3.29Å; I83-C86 VanDerWaalsContact O-CB 3.31Å; I83-C86 WeakPolarHBondContact O-CB 3.31Å; I83-C86 PolarHBondContact O-N 3.43Å; R84-C86 VanDerWaalsContact C-N 3.3Å; C86-T88 VanDerWaalsContact C-N 3.3Å; C86-T88 PolarHBondContact O-N 2.66Å; C86-V89 WeakPolarHBondContact O-CB 3.36Å; C86-V89 PolarHBondContact O-N 2.88Å; C86-T90 PolarHBondContact O-OG1 3.18Å
87	S	61.5	Low	67.2	Low	60 Å²	60	84.1 Å²	84.1	42%	0.42	47%	0.465	S	S	.	.	H	α-helix	trans	-67.6	-25.4	-175.5	66	0	0	0	0	114.7	I83 R84 V89 T90 G91	I83-S87 PolarHBondContact O-N 3.1Å; R84-S87 PolarHBondContact O-N 2.88Å; R84-S87 PolarHBondContact O-OG 3.48Å; S87-V89 PolarHBondContact O-N 3.37Å; S87-T90 PolarHBondContact O-N 2.85Å; S87-G91 PolarHBondContact O-N 3.29Å
88	T	57.1	Low	65.9	Low	116 Å²	116	86 Å²	86	71%	0.712	48%	0.477	S	S	*	.	H	α-helix	trans	-63.2	-27.9	179.4	-56.5	0	0	0	0	111.4	R84 C86	R84-T88 PolarHBondContact O-OG1 3.44Å; C86-T88 VanDerWaalsContact C-N 3.3Å; C86-T88 PolarHBondContact O-N 2.66Å
89	V	56.9	Low	64.4	Low	65 Å²	65	86.2 Å²	86.2	39%	0.394	49%	0.488	S	S	.	.	H	α-helix	trans	-73.8	-39.2	172.6	174.7	0	0	0	0	111.3	V50 A54 C86 S87	V50-V89 HydrophobicContact CG1-CG1 3.61Å; A54-V89 HydrophobicContact CB-CB 4.08Å; A54-V89 HydrophobicContact CB-CG1 3.97Å; C86-V89 WeakPolarHBondContact O-CB 3.36Å; C86-V89 PolarHBondContact O-N 2.88Å; S87-V89 PolarHBondContact O-N 3.37Å
90	T	53.4	Low	62.9	Low	14 Å²	14	88.4 Å²	88.4	9%	0.086	51%	0.508	C	S	.	.	H	α-helix	trans	-85.4	-12.1	-171.7	-32.8	0	0	0	0	114.4	M51 C86 S87 N92 A93 M94	M51-T90 HydrophobicContact CE-CG2 3.89Å; M51-T90 HydrophobicContact CG-CG2 4.38Å; C86-T90 PolarHBondContact O-OG1 3.18Å; S87-T90 PolarHBondContact O-N 2.85Å; T90-N92 PolarHBondContact O-N 3.35Å; T90-A93 PolarHBondContact O-N 3.31Å; T90-M94 HydrophobicContact CG2-CB 3.87Å; T90-M94 HydrophobicContact CG2-CE 4.43Å; T90-M94 HydrophobicContact CG2-CG 4.2Å; T90-M94 PolarHBondContact O-N 3.14Å
91	G	51.3	Low	61.5	Low	61 Å²	61	87.4 Å²	87.4	63%	0.629	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	-23.9	-177.2	0	0	0	0	0	114.9	S87	S87-G91 PolarHBondContact O-N 3.29Å
92	N	51.6	Low	59.7	Low	160 Å²	160	81.3 Å²	81.3	86%	0.856	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-12.3	177.1	-67	-35.2	0	0	0	114.8	T90	T90-N92 PolarHBondContact O-N 3.35Å
93	A	49.4	Very low	58.3	Low	51 Å²	51	79.7 Å²	79.7	42%	0.421	49%	0.486	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.4	-14.3	-167.1	0	0	0	0	0	115.7	M51 T90 L95	M51-A93 HydrophobicContact CE-CB 3.56Å; M51-A93 HydrophobicContact SD-CB 3.26Å; M51-A93 WeakPolarHBondContact SD-CB 3.43Å; T90-A93 PolarHBondContact O-N 3.31Å; A93-L95 VanDerWaalsContact C-N 3.28Å; A93-L95 PolarHBondContact O-N 3.22Å; A93-L95 VanDerWaalsContact O-N 3.14Å
94	M	51.7	Low	56.7	Low	134 Å²	134	81 Å²	81	66%	0.66	50%	0.497	S	S	*	.			trans	-79.9	16.9	-173.3	-150.5	-159.6	-116.6	0	0	116	T90 S96	T90-M94 HydrophobicContact CG2-CB 3.87Å; T90-M94 HydrophobicContact CG2-CE 4.43Å; T90-M94 HydrophobicContact CG2-CG 4.2Å; T90-M94 PolarHBondContact O-N 3.14Å; M94-S96 PolarHBondContact O-N 3.29Å
95	L	45.9	Very low	55.3	Low	160 Å²	160	76.2 Å²	76.2	84%	0.838	49%	0.486	S	S	*	.	S	Bend	trans	-86.1	1	-169.2	-69.5	-176.6	0	0	0	116.7	A93	A93-L95 VanDerWaalsContact C-N 3.28Å; A93-L95 PolarHBondContact O-N 3.22Å; A93-L95 VanDerWaalsContact O-N 3.14Å
96	S	50.8	Low	54.1	Low	92 Å²	92	75.3 Å²	75.3	64%	0.643	48%	0.483	S	S	*	.	S	Bend	trans	-138.5	19	-160.3	-43	0	0	0	0	122.6	M94	M94-S96 PolarHBondContact O-N 3.29Å
97	P	50.7	Low	52.7	Low	29 Å²	29	78.2 Å²	78.2	19%	0.188	50%	0.503	C	S	.	.	S	Bend	trans	-113.5	-26.5	171.7	11.8	7.6	0	0	0	118	G41 F42 A99 A100	G41-P97 WeakPolarHBondContact O-CB 3.43Å; F42-P97 WeakPolarHBondContact O-CG 3.33Å; P97-A99 VanDerWaalsContact C-N 3.31Å; P97-A99 PolarHBondContact O-N 3.32Å; P97-A100 PolarHBondContact O-N 2.9Å
98	L	50.5	Low	52.3	Low	112 Å²	112	82.2 Å²	82.2	59%	0.586	51%	0.513	S	S	*	.	H	α-helix	trans	-70.7	-28.2	-175.4	-169.3	61.3	0	0	0	113	A100 T102	L98-A100 PolarHBondContact O-N 3.17Å; L98-T102 HydrophobicContact CD1-CG2 4.21Å; L98-T102 HydrophobicContact CG-CG2 4.35Å; L98-T102 WeakPolarHBondContact O-CG2 3.44Å; L98-T102 PolarHBondContact O-N 3.42Å; L98-T102 PolarHBondContact O-OG1 3.03Å
99	A	53.6	Low	52.2	Low	71 Å²	71	80.7 Å²	80.7	59%	0.587	50%	0.5	S	S	*	.	H	α-helix	trans	-65.5	-37.9	179.4	0	0	0	0	0	112.4	P97 Q101 T102 A103	P97-A99 VanDerWaalsContact C-N 3.31Å; P97-A99 PolarHBondContact O-N 3.32Å; A99-Q101 PolarHBondContact O-N 2.9Å; A99-T102 PolarHBondContact O-N 3.49Å; A99-T102 PolarHBondContact O-OG1 3.39Å; A99-A103 WeakPolarHBondContact O-CA 3.45Å; A99-A103 WeakPolarHBondContact O-CB 3.37Å; A99-A103 PolarHBondContact O-N 3.23Å
100	A	54.3	Low	52.2	Low	71 Å²	71	80.8 Å²	80.8	59%	0.587	50%	0.504	S	S	*	.	H	α-helix	trans	-69.2	-36.9	-173.4	0	0	0	0	0	113.5	P97 L98 P104	P97-A100 PolarHBondContact O-N 2.9Å; L98-A100 PolarHBondContact O-N 3.17Å; A100-P104 WeakPolarHBondContact O-CD 3.47Å
101	Q	54.8	Low	52.5	Low	66 Å²	66	84.8 Å²	84.8	31%	0.308	52%	0.524	S	S	.	.	H	α-helix	trans	-83.1	-27.4	179.1	-66.3	-173.4	85.8	0	0	113	I40 A99 P104	I40-Q101 PolarHBondContact O-NE2 2.8Å; A99-Q101 PolarHBondContact O-N 2.9Å; Q101-P104 WeakPolarHBondContact O-CD 3.4Å; Q101-P104 WeakPolarHBondContact O-CG 3.49Å
102	T	50.4	Low	52.9	Low	54 Å²	54	84.6 Å²	84.6	33%	0.331	51%	0.514	S	S	.	.	H	α-helix	trans	-87.1	-25.1	176.7	58.2	0	0	0	0	113	L98 A99 V105 A106	L98-T102 HydrophobicContact CD1-CG2 4.21Å; L98-T102 HydrophobicContact CG-CG2 4.35Å; L98-T102 WeakPolarHBondContact O-CG2 3.44Å; L98-T102 PolarHBondContact O-N 3.42Å; L98-T102 PolarHBondContact O-OG1 3.03Å; A99-T102 PolarHBondContact O-N 3.49Å; A99-T102 PolarHBondContact O-OG1 3.39Å; T102-V105 PolarHBondContact O-N 2.8Å; T102-A106 PolarHBondContact O-N 3.35Å
103	A	55.5	Low	53.4	Low	53 Å²	53	82.4 Å²	82.4	44%	0.438	50%	0.501	S	S	.	.	H	α-helix	trans	-50.5	-48	174	0	0	0	0	0	113.8	A99 V105 A106 C107	A99-A103 WeakPolarHBondContact O-CA 3.45Å; A99-A103 WeakPolarHBondContact O-CB 3.37Å; A99-A103 PolarHBondContact O-N 3.23Å; A103-V105 PolarHBondContact O-N 3.41Å; A103-A106 PolarHBondContact O-N 3.07Å; A103-C107 WeakPolarHBondContact O-CB 3.29Å; A103-C107 PolarHBondContact O-N 2.94Å
104	P	52.5	Low	54.3	Low	71 Å²	71	86.8 Å²	86.8	46%	0.461	51%	0.513	S	S	.	.	H	α-helix	trans	-64.9	-27.1	177.3	22.7	-32.7	0	0	0	113.2	A100 Q101 K108	A100-P104 WeakPolarHBondContact O-CD 3.47Å; Q101-P104 WeakPolarHBondContact O-CD 3.4Å; Q101-P104 WeakPolarHBondContact O-CG 3.49Å; P104-K108 VanDerWaalsContact O-CG 3.31Å; P104-K108 WeakPolarHBondContact O-CG 3.31Å; P104-K108 PolarHBondContact O-N 3.39Å
105	V	52.6	Low	54.9	Low	65 Å²	65	89.6 Å²	89.6	39%	0.394	52%	0.516	S	S	.	.	H	α-helix	trans	-79.7	-41.2	175.9	178.3	0	0	0	0	111.3	T102 A103 C107 K108 N109	T102-V105 PolarHBondContact O-N 2.8Å; A103-V105 PolarHBondContact O-N 3.41Å; V105-C107 VanDerWaalsContact C-N 3.31Å; V105-C107 PolarHBondContact O-N 3.16Å; V105-K108 PolarHBondContact O-N 3.11Å; V105-N109 PolarHBondContact O-N 3.21Å; V105-N109 PolarHBondContact O-ND2 3.48Å
106	A	52.7	Low	55.9	Low	61 Å²	61	86.6 Å²	86.6	50%	0.504	50%	0.501	S	S	.	.	H	α-helix	trans	-61.4	-40.8	174	0	0	0	0	0	111.4	T102 A103 N109 S110	T102-A106 PolarHBondContact O-N 3.35Å; A103-A106 PolarHBondContact O-N 3.07Å; A106-N109 PolarHBondContact O-N 3.48Å; A106-S110 PolarHBondContact O-N 3.49Å
107	C	48.6	Very low	56.9	Low	77 Å²	77	86.4 Å²	86.4	52%	0.52	50%	0.499	S	S	.	.	H	α-helix	trans	-62.8	-44.8	175.9	-163.2	0	0	0	0	111.8	A103 V105 N109 S110 D111	A103-C107 WeakPolarHBondContact O-CB 3.29Å; A103-C107 PolarHBondContact O-N 2.94Å; V105-C107 VanDerWaalsContact C-N 3.31Å; V105-C107 PolarHBondContact O-N 3.16Å; C107-N109 VanDerWaalsContact C-N 3.29Å; C107-N109 PolarHBondContact O-N 3.12Å; C107-S110 WeakPolarHBondContact O-CB 3.22Å; C107-S110 PolarHBondContact O-N 2.84Å; C107-S110 VanDerWaalsContact O-N 3.11Å; C107-D111 PolarHBondContact O-N 3Å; C107-D111 VanDerWaalsContact O-N 3.09Å
108	K	54.3	Low	58.1	Low	144 Å²	144	88.8 Å²	88.8	63%	0.626	52%	0.517	S	S	*	.	H	α-helix	trans	-61.5	-34.2	175.2	-76	177.3	178.7	-174.6	0	113.5	P104 V105 S112	P104-K108 VanDerWaalsContact O-CG 3.31Å; P104-K108 WeakPolarHBondContact O-CG 3.31Å; P104-K108 PolarHBondContact O-N 3.39Å; V105-K108 PolarHBondContact O-N 3.11Å; K108-S112 PolarHBondContact O-N 2.85Å; K108-S112 VanDerWaalsContact O-N 3.13Å; K108-S112 PolarHBondContact O-OG 3.46Å
109	N	55	Low	59.2	Low	84 Å²	84	87 Å²	87	45%	0.449	52%	0.518	S	S	.	.	H	α-helix	trans	-73.2	-33.6	175.8	-71.4	-23.1	0	0	0	112	V105 A106 C107 S112 L113	V105-N109 PolarHBondContact O-N 3.21Å; V105-N109 PolarHBondContact O-ND2 3.48Å; A106-N109 PolarHBondContact O-N 3.48Å; C107-N109 VanDerWaalsContact C-N 3.29Å; C107-N109 PolarHBondContact O-N 3.12Å; N109-S112 WeakPolarHBondContact O-CB 3.12Å; N109-S112 PolarHBondContact O-N 3.1Å; N109-L113 WeakPolarHBondContact O-CD2 3.42Å; N109-L113 VanDerWaalsContact O-CG 3.29Å; N109-L113 WeakPolarHBondContact O-CG 3.36Å; N109-L113 PolarHBondContact O-N 2.86Å
110	S	57.5	Low	60.1	Low	66 Å²	66	92.4 Å²	92.4	46%	0.462	53%	0.529	S	S	.	.	H	α-helix	trans	-62.4	-43.8	172.2	-175.4	0	0	0	0	111.8	A106 C107 S112 L113 Q114	A106-S110 PolarHBondContact O-N 3.49Å; C107-S110 WeakPolarHBondContact O-CB 3.22Å; C107-S110 PolarHBondContact O-N 2.84Å; C107-S110 VanDerWaalsContact O-N 3.11Å; S110-S112 VanDerWaalsContact C-N 3.29Å; S110-S112 PolarHBondContact O-N 2.78Å; S110-L113 PolarHBondContact O-N 2.91Å; S110-Q114 WeakPolarHBondContact O-CG 3.21Å; S110-Q114 PolarHBondContact O-N 2.78Å
111	D	58.8	Low	60.7	Low	98 Å²	98	98.8 Å²	98.8	52%	0.524	55%	0.553	S	S	.	*	H	α-helix	trans	-63.3	-37.7	175.3	-70.6	-21.6	0	0	0	111.8	C107 L113 Q114 R115	C107-D111 PolarHBondContact O-N 3Å; C107-D111 VanDerWaalsContact O-N 3.09Å; D111-L113 VanDerWaalsContact C-N 3.33Å; D111-L113 PolarHBondContact O-N 3.24Å; D111-Q114 PolarHBondContact O-N 3.27Å; D111-R115 WeakPolarHBondContact O-CB 3.43Å; D111-R115 WeakPolarHBondContact O-CG 3.05Å; D111-R115 PolarHBondContact O-N 3.39Å
112	S	59.2	Low	61	Low	58 Å²	58	100.4 Å²	100.4	41%	0.406	57%	0.565	S	S	.	*	H	α-helix	trans	-65.8	-35.9	175.7	-55.1	0	0	0	0	111.9	K108 N109 S110 R115 L116	K108-S112 PolarHBondContact O-N 2.85Å; K108-S112 VanDerWaalsContact O-N 3.13Å; K108-S112 PolarHBondContact O-OG 3.46Å; N109-S112 WeakPolarHBondContact O-CB 3.12Å; N109-S112 PolarHBondContact O-N 3.1Å; S110-S112 VanDerWaalsContact C-N 3.29Å; S110-S112 PolarHBondContact O-N 2.78Å; S112-R115 PolarHBondContact O-N 3.13Å; S112-L116 WeakPolarHBondContact O-CG 3.42Å; S112-L116 PolarHBondContact O-N 3.28Å
113	L	61.8	Low	61.5	Low	113 Å²	113	102.8 Å²	102.8	59%	0.592	58%	0.578	S	S	*	*	H	α-helix	trans	-75.4	-37.2	178.4	-70.5	-125	0	0	0	111.8	N109 S110 D111 R115 L116 S117	N109-L113 WeakPolarHBondContact O-CD2 3.42Å; N109-L113 VanDerWaalsContact O-CG 3.29Å; N109-L113 WeakPolarHBondContact O-CG 3.36Å; N109-L113 PolarHBondContact O-N 2.86Å; S110-L113 PolarHBondContact O-N 2.91Å; D111-L113 VanDerWaalsContact C-N 3.33Å; D111-L113 PolarHBondContact O-N 3.24Å; L113-R115 VanDerWaalsContact C-N 3.3Å; L113-R115 PolarHBondContact O-N 2.63Å; L113-L116 HydrophobicContact CD2-CD1 4.3Å; L113-L116 PolarHBondContact O-N 2.83Å; L113-S117 PolarHBondContact O-N 3Å
114	Q	68.2	Low	61.8	Low	144 Å²	144	105.6 Å²	105.6	67%	0.673	59%	0.585	S	S	*	*	H	α-helix	trans	-61.8	-40.8	170.5	-72.6	-119.4	-23.3	0	0	111.1	S110 D111 S117 S118	S110-Q114 WeakPolarHBondContact O-CG 3.21Å; S110-Q114 PolarHBondContact O-N 2.78Å; D111-Q114 PolarHBondContact O-N 3.27Å; Q114-S117 PolarHBondContact O-N 3.4Å; Q114-S118 PolarHBondContact O-N 3.4Å; Q114-S118 PolarHBondContact O-OG 3.16Å
115	R	65.8	Low	62.4	Low	192 Å²	192	107.6 Å²	107.6	73%	0.725	59%	0.593	S	S	*	*	H	α-helix	trans	-65	-41.3	175.1	-78	-178.2	143.3	-162.7	-7.4	113.1	D111 S112 L113 S118 A119	D111-R115 WeakPolarHBondContact O-CB 3.43Å; D111-R115 WeakPolarHBondContact O-CG 3.05Å; D111-R115 PolarHBondContact O-N 3.39Å; S112-R115 PolarHBondContact O-N 3.13Å; L113-R115 VanDerWaalsContact C-N 3.3Å; L113-R115 PolarHBondContact O-N 2.63Å; R115-S118 WeakPolarHBondContact CA-OG 3.49Å; R115-S118 PolarHBondContact O-N 3.44Å; R115-S118 PolarHBondContact O-OG 3.26Å; R115-A119 WeakPolarHBondContact O-CB 3.29Å; R115-A119 PolarHBondContact O-N 3.15Å
116	L	66.8	Low	63	Low	98 Å²	98	110.3 Å²	110.3	51%	0.513	61%	0.605	S	S	.	*	H	α-helix	trans	-65	-41.2	174.6	-78.5	166.5	0	0	0	111.6	S112 L113 S118 A119 F120	S112-L116 WeakPolarHBondContact O-CG 3.42Å; S112-L116 PolarHBondContact O-N 3.28Å; L113-L116 HydrophobicContact CD2-CD1 4.3Å; L113-L116 PolarHBondContact O-N 2.83Å; L116-S118 VanDerWaalsContact C-N 3.28Å; L116-S118 PolarHBondContact O-N 3.2Å; L116-A119 PolarHBondContact O-N 3.16Å; L116-A119 VanDerWaalsContact O-N 3.13Å; L116-F120 HydrophobicContact CD2-CE2 4.43Å; L116-F120 WeakPolarHBondContact O-CD2 3.38Å; L116-F120 PolarHBondContact O-N 3.26Å
117	S	70.3	Confident	63.7	Low	87 Å²	87	113.6 Å²	113.6	61%	0.608	61%	0.612	S	S	*	*	H	α-helix	trans	-62	-34.7	174.5	-174.8	0	0	0	0	112.7	L113 Q114	L113-S117 PolarHBondContact O-N 3Å; Q114-S117 PolarHBondContact O-N 3.4Å
118	S	76.2	Confident	64.8	Low	80 Å²	80	116.2 Å²	116.2	56%	0.559	62%	0.618	S	S	*	*	H	α-helix	trans	-77.8	-17.6	175.6	64.2	0	0	0	0	114.3	Q114 R115 L116	Q114-S118 PolarHBondContact O-N 3.4Å; Q114-S118 PolarHBondContact O-OG 3.16Å; R115-S118 WeakPolarHBondContact CA-OG 3.49Å; R115-S118 PolarHBondContact O-N 3.44Å; R115-S118 PolarHBondContact O-OG 3.26Å; L116-S118 VanDerWaalsContact C-N 3.28Å; L116-S118 PolarHBondContact O-N 3.2Å
119	A	74.1	Confident	65.6	Low	75 Å²	75	114.1 Å²	114.1	62%	0.62	62%	0.618	S	S	*	*	H	α-helix	trans	-87	-16.1	179.5	0	0	0	0	0	113.1	R115 L116	R115-A119 WeakPolarHBondContact O-CB 3.29Å; R115-A119 PolarHBondContact O-N 3.15Å; L116-A119 PolarHBondContact O-N 3.16Å; L116-A119 VanDerWaalsContact O-N 3.13Å
120	F	73.1	Confident	66.4	Low	183 Å²	183	116.6 Å²	116.6	80%	0.803	63%	0.632	S	S	*	*			trans	-104.7	6.8	179.4	-80.4	-76.6	0	0	0	113.8	L116	L116-F120 HydrophobicContact CD2-CE2 4.43Å; L116-F120 WeakPolarHBondContact O-CD2 3.38Å; L116-F120 PolarHBondContact O-N 3.26Å
121	N	65.5	Low	67.3	Low	205 Å²	205	121.2 Å²	121.2	100%	1.096	65%	0.647	S	S	*	*			trans	-115.8	0	170.3	-124.4	-5	0	0	0	108.9

Retrieved 121 of 121 residues in 95.2 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).