A0A077YXZ6_TRITR Loading...

NADH dehydrogenase 1 alpha subcomplex subunit 5

Accessory subunit of the mitochondrial membrane respiratory chain NADH dehydrogenase (Complex I), that is believed not to be involved in catalysis. Complex I functions in the transfer of electrons from NADH to the respiratory chain. The immediate electron acceptor for the enzyme is believed to be ubiquinone.

AlphaFold DB , UniProt , Accession A0A077YXZ6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 103 aa.

						>A0A077YXZ6_TRITR|A0A077YXZ6
MQVVQDPGKHLRIIYGRVLKALQKMPEDSEYRRSTEATVIDRLQIIESEPNPEKLEEKFGLGQLEEVILQAELELNLTKTMLKYAPWEPLIAKPPDNQWSWPV
					

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	60.1	Low	85.1	Confident	160 Å²	160	89.5 Å²	89.5	79%	0.788	45%	0.454	S	S	*	.				0	141.3	0	-73.6	165.5	-165.3	0	0	107.9	E65 E66	M1-E65 HydrophobicContact CB-CB 4.43Å; M1-E65 HydrophobicContact SD-CB 4.13Å; M1-E66 HydrophobicContact CE-CG 3.87Å; M1-E66 HydrophobicContact SD-CG 4.03Å
2	Q	75.1	Confident	86	Confident	178 Å²	178	92.4 Å²	92.4	83%	0.832	46%	0.455	S	S	*	.	P	Polyproline II helix	trans	-84.5	136.6	171.2	-87.7	-177	-15.3	0	0	108.7	V4	Q2-V4 PolarHBondContact O-N 3.17Å
3	V	80.4	Confident	86.7	Confident	116 Å²	116	92.5 Å²	92.5	70%	0.703	46%	0.457	S	S	*	.	P	Polyproline II helix	trans	-64.9	121.9	174	178.9	0	0	0	0	108.5
4	V	83.9	Confident	87.4	Confident	41 Å²	41	86.3 Å²	86.3	25%	0.248	43%	0.426	C	S	.	.	P	Polyproline II helix	trans	-85.7	127.6	-177.4	178	0	0	0	0	109.5	Q2 D6 H10 E65 I68	Q2-V4 PolarHBondContact O-N 3.17Å; V4-D6 PolarHBondContact O-N 2.76Å; V4-H10 HydrophobicContact CG1-CB 4.19Å; V4-E65 HydrophobicContact CG2-CG 4.37Å; V4-E65 PolarHBondContact N-OE1 3.39Å; V4-I68 HydrophobicContact CB-CD1 3.97Å; V4-I68 HydrophobicContact CG1-CD1 3.94Å; V4-I68 HydrophobicContact CG2-CD1 3.92Å
5	Q	82.9	Confident	88.1	Confident	168 Å²	168	80.7 Å²	80.7	79%	0.785	40%	0.398	S	S	*	.	S	Bend	trans	-75.3	123.2	171.2	-61.6	-62.9	-39.5	0	0	109.1
6	D	89.7	Confident	88.7	Confident	94 Å²	94	77.4 Å²	77.4	50%	0.503	39%	0.391	S	S	.	.	S	Bend	trans	56.8	69.3	-177.2	-169.2	-1.8	0	0	0	113.5	V4 G8 K9 H10	V4-D6 PolarHBondContact O-N 2.76Å; D6-G8 VanDerWaalsContact C-N 3.27Å; D6-G8 PolarHBondContact O-N 3.3Å; D6-K9 HydrophobicContact CB-CB 4.32Å; D6-K9 PolarHBondContact O-N 3.25Å; D6-K9 WeakPolarHBondContact OD1-CB 3.22Å; D6-K9 PolarHBondContact OD1-N 2.89Å; D6-K9 WeakPolarHBondContact OD2-CB 3.41Å; D6-K9 WeakPolarHBondContact OD2-CD 3.41Å; D6-H10 PolarHBondContact O-N 3.4Å
7	P	91	Very high	89.2	Confident	18 Å²	18	80.8 Å²	80.8	12%	0.117	40%	0.398	C	S	.	.	H	α-helix	trans	-61.8	-34	-177.4	24.4	-34.2	0	0	0	112.7	K9 H10 L11 P52 L64 I68	P7-K9 PolarHBondContact O-N 2.91Å; P7-H10 PolarHBondContact O-N 3.48Å; P7-L11 WeakPolarHBondContact O-CB 3.41Å; P7-L11 WeakPolarHBondContact O-CG 3.46Å; P7-L11 PolarHBondContact O-N 3.26Å; P7-P52 HydrophobicContact CG-CB 4.28Å; P7-L64 HydrophobicContact CB-CB 3.93Å; P7-L64 HydrophobicContact CB-CD1 3.9Å; P7-L64 HydrophobicContact CB-CG 4.41Å; P7-L64 HydrophobicContact CG-CB 4.35Å; P7-L64 HydrophobicContact CG-CD1 3.52Å; P7-I68 HydrophobicContact CB-CD1 3.85Å
8	G	91.5	Very high	89.7	Confident	14 Å²	14	76.3 Å²	76.3	14%	0.144	38%	0.376	C	S	.	.	H	α-helix	trans	-62.2	-44.7	179.1	0	0	0	0	0	112.3	D6 H10 R12	D6-G8 VanDerWaalsContact C-N 3.27Å; D6-G8 PolarHBondContact O-N 3.3Å; G8-H10 VanDerWaalsContact C-N 3.35Å; G8-R12 WeakPolarHBondContact O-CB 3.39Å; G8-R12 PolarHBondContact O-N 3.13Å
9	K	92.7	Very high	90.1	Very high	130 Å²	130	74.4 Å²	74.4	57%	0.565	37%	0.367	S	S	*	.	H	α-helix	trans	-63.5	-41.8	173.9	-177.9	179.8	179.5	-179.1	0	111.9	D6 P7 R12 I13	D6-K9 HydrophobicContact CB-CB 4.32Å; D6-K9 PolarHBondContact O-N 3.25Å; D6-K9 WeakPolarHBondContact OD1-CB 3.22Å; D6-K9 PolarHBondContact OD1-N 2.89Å; D6-K9 WeakPolarHBondContact OD2-CB 3.41Å; D6-K9 WeakPolarHBondContact OD2-CD 3.41Å; P7-K9 PolarHBondContact O-N 2.91Å; K9-R12 PolarHBondContact O-N 2.94Å; K9-I13 HydrophobicContact CG-CD1 4.2Å; K9-I13 WeakPolarHBondContact O-CG1 3.34Å; K9-I13 PolarHBondContact O-N 3.19Å; K9-I13 VanDerWaalsContact O-N 3.11Å
10	H	93.7	Very high	90.4	Very high	66 Å²	66	78.1 Å²	78.1	31%	0.306	38%	0.381	S	S	.	.	H	α-helix	trans	-62.4	-48.5	179.8	-163.9	84	0	0	0	111.8	V4 D6 P7 G8 R12 I13 I14 I68 E72	V4-H10 HydrophobicContact CG1-CB 4.19Å; D6-H10 PolarHBondContact O-N 3.4Å; P7-H10 PolarHBondContact O-N 3.48Å; G8-H10 VanDerWaalsContact C-N 3.35Å; H10-R12 VanDerWaalsContact C-N 3.34Å; H10-R12 PolarHBondContact O-N 3.48Å; H10-I13 PolarHBondContact O-N 3.16Å; H10-I14 WeakPolarHBondContact CD2-CD1 3.42Å; H10-I14 WeakPolarHBondContact NE2-CD1 3.41Å; H10-I14 PolarHBondContact O-N 3.31Å; H10-I14 VanDerWaalsContact O-N 3.08Å; H10-I68 HydrophobicContact CB-CD1 4.35Å; H10-I68 VanDerWaalsContact CD2-CG2 3.47Å; H10-I68 WeakPolarHBondContact CD2-CG2 3.33Å; H10-E72 IonicContact NE2-OE1 3.1Å
11	L	94.9	Very high	90.7	Very high	0 Å²	0	75 Å²	75	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-58	-44.6	175.1	-74.2	170.2	0	0	0	111.8	P7 I13 I14 Y15 I46 L64 V67 I68 A71	P7-L11 WeakPolarHBondContact O-CB 3.41Å; P7-L11 WeakPolarHBondContact O-CG 3.46Å; P7-L11 PolarHBondContact O-N 3.26Å; L11-I13 VanDerWaalsContact C-N 3.28Å; L11-I13 PolarHBondContact O-N 3.09Å; L11-I14 PolarHBondContact O-N 2.89Å; L11-Y15 HydrophobicContact CB-CD2 4.18Å; L11-Y15 HydrophobicContact CB-CE2 4.05Å; L11-Y15 HydrophobicContact CD2-CE2 3.92Å; L11-Y15 WeakPolarHBondContact O-CB 3.5Å; L11-Y15 WeakPolarHBondContact O-CD2 3.47Å; L11-Y15 PolarHBondContact O-N 2.94Å; L11-I46 HydrophobicContact CB-CD1 3.55Å; L11-I46 HydrophobicContact CD1-CD1 3.95Å; L11-I46 HydrophobicContact CD1-CG1 4.37Å; L11-I46 HydrophobicContact CG-CD1 4.35Å; L11-L64 HydrophobicContact CD1-CD2 3.99Å; L11-V67 HydrophobicContact CD1-CG1 4.27Å; L11-V67 HydrophobicContact CD2-CG1 3.96Å; L11-I68 HydrophobicContact CD1-CG1 4.38Å; L11-I68 HydrophobicContact CD2-CB 4.28Å; L11-I68 HydrophobicContact CD2-CG1 3.54Å; L11-I68 HydrophobicContact CG-CG1 3.67Å; L11-A71 HydrophobicContact CD2-CB 4.13Å
12	R	95.6	Very high	92.4	Very high	124 Å²	124	67.4 Å²	67.4	47%	0.468	33%	0.331	S	S	.	.	H	α-helix	trans	-58.5	-40.8	178.1	-167.7	-177.9	-64.3	-151.7	2	112	G8 K9 H10 G16 L43 E47	G8-R12 WeakPolarHBondContact O-CB 3.39Å; G8-R12 PolarHBondContact O-N 3.13Å; K9-R12 PolarHBondContact O-N 2.94Å; H10-R12 VanDerWaalsContact C-N 3.34Å; H10-R12 PolarHBondContact O-N 3.48Å; R12-G16 PolarHBondContact O-N 3.17Å; R12-L43 HydrophobicContact CB-CD2 4.43Å; R12-L43 HydrophobicContact CG-CD2 4.06Å; R12-E47 IonicContact NH1-OE1 3.7Å
13	I	95.9	Very high	93.4	Very high	93 Å²	93	65.3 Å²	65.3	48%	0.477	32%	0.321	S	S	.	.	H	α-helix	trans	-65	-46.4	177	-67.3	165.1	0	0	0	110.7	K9 H10 L11 R17	K9-I13 HydrophobicContact CG-CD1 4.2Å; K9-I13 WeakPolarHBondContact O-CG1 3.34Å; K9-I13 PolarHBondContact O-N 3.19Å; K9-I13 VanDerWaalsContact O-N 3.11Å; H10-I13 PolarHBondContact O-N 3.16Å; L11-I13 VanDerWaalsContact C-N 3.28Å; L11-I13 PolarHBondContact O-N 3.09Å; I13-R17 WeakPolarHBondContact O-CG 3.31Å; I13-R17 PolarHBondContact O-N 2.99Å
14	I	96.7	Very high	94.1	Very high	6 Å²	6	67.4 Å²	67.4	3%	0.031	32%	0.321	C	S	.	.	H	α-helix	trans	-64.2	-51.2	-179.4	-64	167.5	0	0	0	110.5	H10 L11 G16 R17 V18 I68 A71 E72 L75	H10-I14 WeakPolarHBondContact CD2-CD1 3.42Å; H10-I14 WeakPolarHBondContact NE2-CD1 3.41Å; H10-I14 PolarHBondContact O-N 3.31Å; H10-I14 VanDerWaalsContact O-N 3.08Å; L11-I14 PolarHBondContact O-N 2.89Å; I14-G16 VanDerWaalsContact C-N 3.3Å; I14-G16 PolarHBondContact O-N 3.24Å; I14-R17 WeakPolarHBondContact O-CA 3.33Å; I14-R17 WeakPolarHBondContact O-CB 3.45Å; I14-R17 PolarHBondContact O-N 3.41Å; I14-V18 HydrophobicContact CG2-CG2 4.38Å; I14-V18 WeakPolarHBondContact O-CG2 3.35Å; I14-V18 PolarHBondContact O-N 3.03Å; I14-I68 HydrophobicContact CD1-CG2 4.1Å; I14-A71 HydrophobicContact CB-CB 4.3Å; I14-A71 HydrophobicContact CD1-CB 4.35Å; I14-A71 HydrophobicContact CG2-CB 3.68Å; I14-A71 WeakPolarHBondContact CG2-O 3.48Å; I14-E72 HydrophobicContact CD1-CG 3.6Å; I14-L75 HydrophobicContact CG2-CB 4.34Å; I14-L75 HydrophobicContact CG2-CD2 4.45Å
15	Y	97.5	Very high	94.6	Very high	2 Å²	2	65.7 Å²	65.7	1%	0.008	31%	0.31	C	S	.	.	H	α-helix	trans	-60.8	-38.6	179.9	-73.4	-44.6	0	0	0	112.5	L11 R17 V18 L19 V39 R42 L43 I46 A71	L11-Y15 HydrophobicContact CB-CD2 4.18Å; L11-Y15 HydrophobicContact CB-CE2 4.05Å; L11-Y15 HydrophobicContact CD2-CE2 3.92Å; L11-Y15 WeakPolarHBondContact O-CB 3.5Å; L11-Y15 WeakPolarHBondContact O-CD2 3.47Å; L11-Y15 PolarHBondContact O-N 2.94Å; Y15-R17 VanDerWaalsContact C-N 3.26Å; Y15-R17 PolarHBondContact O-N 3.36Å; Y15-V18 PolarHBondContact O-N 3.39Å; Y15-V18 VanDerWaalsContact O-N 3.16Å; Y15-L19 WeakPolarHBondContact O-CG 3.37Å; Y15-L19 PolarHBondContact O-N 3.41Å; Y15-V39 HydrophobicContact CD1-CB 4.25Å; Y15-V39 HydrophobicContact CD1-CG1 3.62Å; Y15-V39 HydrophobicContact CD1-CG2 3.85Å; Y15-V39 HydrophobicContact CE1-CG2 4.21Å; Y15-V39 HydrophobicContact CG-CG1 3.84Å; Y15-R42 HydrophobicContact CE2-CB 4.1Å; Y15-R42 WeakPolarHBondContact OH-CD 3.47Å; Y15-R42 PolarHBondContact OH-NH1 3.05Å; Y15-R42 VanDerWaalsContact OH-NH1 3.11Å; Y15-L43 HydrophobicContact CD2-CD2 4.19Å; Y15-L43 HydrophobicContact CD2-CG 4.31Å; Y15-L43 HydrophobicContact CG-CD2 4.44Å; Y15-L43 HydrophobicContact CG-CG 4.37Å; Y15-I46 HydrophobicContact CD2-CD1 3.9Å; Y15-I46 HydrophobicContact CE2-CD1 3.78Å; Y15-A71 HydrophobicContact CD1-CB 4.44Å; Y15-A71 HydrophobicContact CE1-CB 3.79Å
16	G	97.3	Very high	95.2	Very high	28 Å²	28	59.8 Å²	59.8	29%	0.289	29%	0.287	S	S	.	.	H	α-helix	trans	-60.9	-32.8	172.1	0	0	0	0	0	113.5	R12 I14 K20	R12-G16 PolarHBondContact O-N 3.17Å; I14-G16 VanDerWaalsContact C-N 3.3Å; I14-G16 PolarHBondContact O-N 3.24Å; G16-K20 WeakPolarHBondContact O-CG 3.48Å; G16-K20 PolarHBondContact O-N 3.34Å
17	R	97.7	Very high	95.4	Very high	135 Å²	135	62.5 Å²	62.5	51%	0.509	30%	0.296	S	S	.	.	H	α-helix	trans	-74.4	-37.5	174	-66.6	169.3	72.1	-176.4	5.6	112	I13 I14 Y15 K20 A21 L75	I13-R17 WeakPolarHBondContact O-CG 3.31Å; I13-R17 PolarHBondContact O-N 2.99Å; I14-R17 WeakPolarHBondContact O-CA 3.33Å; I14-R17 WeakPolarHBondContact O-CB 3.45Å; I14-R17 PolarHBondContact O-N 3.41Å; Y15-R17 VanDerWaalsContact C-N 3.26Å; Y15-R17 PolarHBondContact O-N 3.36Å; R17-K20 PolarHBondContact O-N 2.94Å; R17-A21 PolarHBondContact O-N 3.19Å; R17-L75 HydrophobicContact CB-CD1 3.95Å; R17-L75 HydrophobicContact CB-CD2 4.13Å
18	V	97.6	Very high	95.4	Very high	0 Å²	0	67.4 Å²	67.4	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-60.4	-52.5	174.8	174.4	0	0	0	0	109.7	I14 Y15 K20 A21 L22 T35 V39 L75	I14-V18 HydrophobicContact CG2-CG2 4.38Å; I14-V18 WeakPolarHBondContact O-CG2 3.35Å; I14-V18 PolarHBondContact O-N 3.03Å; Y15-V18 PolarHBondContact O-N 3.39Å; Y15-V18 VanDerWaalsContact O-N 3.16Å; V18-K20 VanDerWaalsContact C-N 3.34Å; V18-K20 PolarHBondContact O-N 3.08Å; V18-A21 WeakPolarHBondContact O-CA 3.21Å; V18-A21 WeakPolarHBondContact O-CB 3.39Å; V18-A21 PolarHBondContact O-N 3.11Å; V18-L22 HydrophobicContact CG1-CD1 3.8Å; V18-L22 HydrophobicContact CG1-CG 4.17Å; V18-L22 WeakPolarHBondContact O-CG 3.34Å; V18-L22 PolarHBondContact O-N 3.48Å; V18-T35 HydrophobicContact CG1-CG2 4.16Å; V18-V39 HydrophobicContact CG1-CG2 4Å; V18-L75 HydrophobicContact CG2-CB 3.79Å; V18-L75 HydrophobicContact CG2-CD1 3.9Å; V18-L75 HydrophobicContact CG2-CG 4.41Å
19	L	97.3	Very high	95.5	Very high	40 Å²	40	67 Å²	67	21%	0.209	32%	0.317	C	S	.	.	H	α-helix	trans	-56.6	-44.6	178.2	-68.5	175.5	0	0	0	112.4	Y15 A21 L22 Q23 E36 V39 I40 L43	Y15-L19 WeakPolarHBondContact O-CG 3.37Å; Y15-L19 PolarHBondContact O-N 3.41Å; L19-A21 VanDerWaalsContact C-N 3.26Å; L19-A21 PolarHBondContact O-N 2.88Å; L19-L22 PolarHBondContact O-N 2.92Å; L19-Q23 WeakPolarHBondContact O-CG 3.45Å; L19-Q23 PolarHBondContact O-N 3.22Å; L19-Q23 VanDerWaalsContact O-N 3.11Å; L19-E36 HydrophobicContact CD2-CG 4.19Å; L19-V39 HydrophobicContact CD1-CG1 4.14Å; L19-V39 HydrophobicContact CD2-CB 4.18Å; L19-V39 HydrophobicContact CD2-CG1 3.84Å; L19-V39 HydrophobicContact CG-CG1 3.75Å; L19-I40 HydrophobicContact CD2-CG1 4.45Å; L19-L43 HydrophobicContact CD1-CD1 3.71Å
20	K	97.2	Very high	95.6	Very high	148 Å²	148	66.6 Å²	66.6	64%	0.643	32%	0.317	S	S	*	.	H	α-helix	trans	-62	-31.6	175.1	-76.1	177.9	-179	-178.6	0	113.5	G16 R17 V18	G16-K20 WeakPolarHBondContact O-CG 3.48Å; G16-K20 PolarHBondContact O-N 3.34Å; R17-K20 PolarHBondContact O-N 2.94Å; V18-K20 VanDerWaalsContact C-N 3.34Å; V18-K20 PolarHBondContact O-N 3.08Å
21	A	96	Very high	95.7	Very high	14 Å²	14	65.4 Å²	65.4	12%	0.116	31%	0.31	C	S	.	.	H	α-helix	trans	-77.4	-39.3	176.6	0	0	0	0	0	111.5	R17 V18 L19 Q23 K24 T78 L82	R17-A21 PolarHBondContact O-N 3.19Å; V18-A21 WeakPolarHBondContact O-CA 3.21Å; V18-A21 WeakPolarHBondContact O-CB 3.39Å; V18-A21 PolarHBondContact O-N 3.11Å; L19-A21 VanDerWaalsContact C-N 3.26Å; L19-A21 PolarHBondContact O-N 2.88Å; A21-Q23 VanDerWaalsContact C-N 3.28Å; A21-Q23 PolarHBondContact O-N 3.49Å; A21-K24 WeakPolarHBondContact O-CB 3.45Å; A21-K24 PolarHBondContact O-N 3.33Å; A21-K24 VanDerWaalsContact O-N 3.09Å; A21-T78 HydrophobicContact CB-CG2 3.6Å; A21-L82 HydrophobicContact CB-CD1 4.38Å
22	L	96.2	Very high	95.8	Very high	0 Å²	0	66.9 Å²	66.9	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-61.4	-34.2	176.5	-70.1	174.8	0	0	0	112.7	V18 L19 K24 M25 Y31 R32 T35 E36 T78	V18-L22 HydrophobicContact CG1-CD1 3.8Å; V18-L22 HydrophobicContact CG1-CG 4.17Å; V18-L22 WeakPolarHBondContact O-CG 3.34Å; V18-L22 PolarHBondContact O-N 3.48Å; L19-L22 PolarHBondContact O-N 2.92Å; L22-K24 PolarHBondContact O-N 3.21Å; L22-M25 HydrophobicContact CD2-CE 4.13Å; L22-M25 HydrophobicContact CD2-SD 3.79Å; L22-M25 WeakPolarHBondContact O-CB 3.32Å; L22-M25 PolarHBondContact O-N 3.32Å; L22-Y31 HydrophobicContact CD2-CD1 4.32Å; L22-Y31 HydrophobicContact CD2-CE1 3.96Å; L22-R32 HydrophobicContact CB-CG 4.3Å; L22-R32 WeakPolarHBondContact O-CD 3.42Å; L22-R32 PolarHBondContact O-NE 3.37Å; L22-T35 HydrophobicContact CD1-CG2 3.75Å; L22-T35 HydrophobicContact CD2-CG2 4.43Å; L22-E36 HydrophobicContact CB-CG 4.2Å; L22-E36 HydrophobicContact CD1-CG 3.67Å; L22-T78 HydrophobicContact CD2-CG2 3.75Å; L22-T78 HydrophobicContact CG-CG2 4.06Å
23	Q	95.4	Very high	95.8	Very high	134 Å²	134	65.8 Å²	65.8	63%	0.626	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-17.6	173.5	-75	179.3	-12.5	0	0	114.6	L19 A21 M25	L19-Q23 WeakPolarHBondContact O-CG 3.45Å; L19-Q23 PolarHBondContact O-N 3.22Å; L19-Q23 VanDerWaalsContact O-N 3.11Å; A21-Q23 VanDerWaalsContact C-N 3.28Å; A21-Q23 PolarHBondContact O-N 3.49Å; Q23-M25 VanDerWaalsContact C-N 3.34Å
24	K	95.4	Very high	95.9	Very high	160 Å²	160	64.4 Å²	64.4	70%	0.696	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	-7.1	175.8	-57.4	-179.1	-173.8	-174.9	0	113.1	A21 L22 L82	A21-K24 WeakPolarHBondContact O-CB 3.45Å; A21-K24 PolarHBondContact O-N 3.33Å; A21-K24 VanDerWaalsContact O-N 3.09Å; L22-K24 PolarHBondContact O-N 3.21Å; K24-L82 HydrophobicContact CB-CD1 4.31Å; K24-L82 HydrophobicContact CB-CD2 3.67Å; K24-L82 HydrophobicContact CD-CD1 4.21Å
25	M	95.1	Very high	95.9	Very high	5 Å²	5	64.7 Å²	64.7	3%	0.025	31%	0.312	C	S	.	.	S	Bend	trans	-94.4	154.7	176.5	-54.9	-179.2	179.2	0	0	110.2	L22 Q23 Y31 R32 T78 M81 L82 W87	L22-M25 HydrophobicContact CD2-CE 4.13Å; L22-M25 HydrophobicContact CD2-SD 3.79Å; L22-M25 WeakPolarHBondContact O-CB 3.32Å; L22-M25 PolarHBondContact O-N 3.32Å; Q23-M25 VanDerWaalsContact C-N 3.34Å; M25-Y31 HydrophobicContact CE-CD1 4.21Å; M25-Y31 HydrophobicContact CE-CE1 3.98Å; M25-Y31 HydrophobicContact SD-CD1 3.82Å; M25-Y31 HydrophobicContact SD-CE1 4.14Å; M25-R32 HydrophobicContact CB-CB 4.36Å; M25-R32 PolarHBondContact O-NH1 3.09Å; M25-T78 HydrophobicContact CE-CG2 3.6Å; M25-T78 WeakPolarHBondContact CE-O 3.37Å; M25-M81 HydrophobicContact CE-CB 3.61Å; M25-L82 HydrophobicContact CE-CD2 4.02Å; M25-L82 HydrophobicContact CE-CG 3.68Å; M25-L82 HydrophobicContact CG-CD2 3.53Å; M25-L82 HydrophobicContact CG-CG 4.26Å; M25-W87 HydrophobicContact CB-CH2 4.1Å; M25-W87 HydrophobicContact CB-CZ3 4.17Å; M25-W87 HydrophobicContact CE-CH2 4.42Å; M25-W87 HydrophobicContact CE-CZ3 4.07Å; M25-W87 HydrophobicContact CG-CH2 3.64Å; M25-W87 HydrophobicContact CG-CZ3 3.71Å; M25-W87 HydrophobicContact SD-CE3 4.43Å; M25-W87 HydrophobicContact SD-CH2 4.16Å; M25-W87 HydrophobicContact SD-CZ3 3.63Å
26	P	95.5	Very high	95.9	Very high	45 Å²	45	66.8 Å²	66.8	29%	0.292	32%	0.322	S	S	.	.			trans	-57.9	144	173	-24.7	36.1	0	0	0	113	D28 S29 R32 W87	P26-D28 WeakPolarHBondContact CB-OD1 3.25Å; P26-D28 PolarHBondContact O-N 3.38Å; P26-S29 WeakPolarHBondContact O-CB 3.46Å; P26-S29 PolarHBondContact O-N 3.18Å; P26-R32 VanDerWaalsContact O-CD 3.3Å; P26-R32 WeakPolarHBondContact O-CD 3.47Å; P26-W87 HydrophobicContact CG-CG 4.45Å
27	E	93.5	Very high	95.8	Very high	150 Å²	150	68.3 Å²	68.3	70%	0.701	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-26.2	178.3	-72	-174.7	171.6	0	0	113	S29 R33	E27-S29 VanDerWaalsContact C-N 3.25Å; E27-S29 PolarHBondContact O-N 3.43Å; E27-R33 PolarHBondContact O-NH1 3.47Å
28	D	91.7	Very high	95.8	Very high	121 Å²	121	65.1 Å²	65.1	65%	0.647	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-11.2	177	64.8	-32.4	0	0	0	112.9	P26 E30 R33	P26-D28 WeakPolarHBondContact CB-OD1 3.25Å; P26-D28 PolarHBondContact O-N 3.38Å; D28-E30 PolarHBondContact O-N 3.06Å; D28-R33 VanDerWaalsContact O-CZ 3.31Å; D28-R33 PolarHBondContact O-NH1 3.38Å; D28-R33 PolarHBondContact O-NH2 3.11Å
29	S	93.5	Very high	95.7	Very high	6 Å²	6	65.3 Å²	65.3	4%	0.042	33%	0.329	C	S	.	.			trans	-63.8	121.9	175.2	-177.6	0	0	0	0	112	P26 E27 Y31 R32 R33	P26-S29 WeakPolarHBondContact O-CB 3.46Å; P26-S29 PolarHBondContact O-N 3.18Å; E27-S29 VanDerWaalsContact C-N 3.25Å; E27-S29 PolarHBondContact O-N 3.43Å; S29-Y31 VanDerWaalsContact C-N 3.3Å; S29-Y31 PolarHBondContact O-N 2.9Å; S29-R32 PolarHBondContact O-N 2.94Å; S29-R33 PolarHBondContact O-N 3.44Å; S29-R33 VanDerWaalsContact O-N 3.12Å
30	E	94.6	Very high	95.7	Very high	122 Å²	122	67.1 Å²	67.1	57%	0.57	34%	0.338	S	S	*	.	H	α-helix	trans	-62.2	-37.7	176.6	-68.8	-62.2	166.9	0	0	112.8	D28 R32 R33 S34	D28-E30 PolarHBondContact O-N 3.06Å; E30-R32 VanDerWaalsContact C-N 3.33Å; E30-R32 PolarHBondContact O-N 3.4Å; E30-R33 PolarHBondContact O-N 3.3Å; E30-R33 IonicContact OE1-CZ 3.85Å; E30-R33 IonicContact OE1-NH2 2.78Å; E30-R33 PolarHBondContact OE1-NH2 3.32Å; E30-R33 IonicContact OE2-CZ 3.85Å; E30-R33 IonicContact OE2-NE 3.51Å; E30-R33 PolarHBondContact OE2-NE 3.09Å; E30-R33 IonicContact OE2-NH2 3.51Å; E30-R33 PolarHBondContact OE2-NH2 2.95Å; E30-R33 VanDerWaalsContact OE2-NH2 3.1Å; E30-S34 WeakPolarHBondContact O-CB 3.43Å; E30-S34 PolarHBondContact O-N 3.05Å; E30-S34 PolarHBondContact O-OG 3.27Å
31	Y	95.9	Very high	95.6	Very high	41 Å²	41	64.2 Å²	64.2	16%	0.161	33%	0.329	C	S	.	.	H	α-helix	trans	-61.4	-45.4	176.4	176.6	-103	0	0	0	110.4	L22 M25 S29 R33 S34 T35 E74 L77 T78 M81	L22-Y31 HydrophobicContact CD2-CD1 4.32Å; L22-Y31 HydrophobicContact CD2-CE1 3.96Å; M25-Y31 HydrophobicContact CE-CD1 4.21Å; M25-Y31 HydrophobicContact CE-CE1 3.98Å; M25-Y31 HydrophobicContact SD-CD1 3.82Å; M25-Y31 HydrophobicContact SD-CE1 4.14Å; S29-Y31 VanDerWaalsContact C-N 3.3Å; S29-Y31 PolarHBondContact O-N 2.9Å; Y31-R33 PolarHBondContact O-N 3.46Å; Y31-S34 PolarHBondContact O-N 3.31Å; Y31-T35 WeakPolarHBondContact CE2-OG1 3.43Å; Y31-T35 WeakPolarHBondContact O-CB 3.46Å; Y31-T35 PolarHBondContact O-N 2.88Å; Y31-T35 PolarHBondContact O-OG1 2.95Å; Y31-T35 VanDerWaalsContact O-OG1 3.05Å; Y31-E74 PolarHBondContact OH-OE1 3.49Å; Y31-L77 HydrophobicContact CE2-CD2 4.14Å; Y31-T78 PolarHBondContact OH-OG1 3.42Å; Y31-M81 HydrophobicContact CD1-CB 4.28Å; Y31-M81 HydrophobicContact CD1-CE 3.69Å; Y31-M81 HydrophobicContact CD1-CG 4.06Å; Y31-M81 HydrophobicContact CD2-CE 3.67Å; Y31-M81 HydrophobicContact CE1-CB 4.01Å; Y31-M81 HydrophobicContact CE1-CE 4.18Å; Y31-M81 HydrophobicContact CE1-CG 3.66Å; Y31-M81 HydrophobicContact CE2-CE 4.18Å; Y31-M81 HydrophobicContact CE2-CG 4.38Å; Y31-M81 HydrophobicContact CG-CE 3.4Å
32	R	96.6	Very high	95.6	Very high	30 Å²	30	65.9 Å²	65.9	11%	0.113	33%	0.332	C	S	.	.	H	α-helix	trans	-57.7	-53	176.7	-179.7	178.2	173.8	-169.2	-17.5	111.3	L22 M25 P26 S29 E30 S34 T35 E36	L22-R32 HydrophobicContact CB-CG 4.3Å; L22-R32 WeakPolarHBondContact O-CD 3.42Å; L22-R32 PolarHBondContact O-NE 3.37Å; M25-R32 HydrophobicContact CB-CB 4.36Å; M25-R32 PolarHBondContact O-NH1 3.09Å; P26-R32 VanDerWaalsContact O-CD 3.3Å; P26-R32 WeakPolarHBondContact O-CD 3.47Å; S29-R32 PolarHBondContact O-N 2.94Å; E30-R32 VanDerWaalsContact C-N 3.33Å; E30-R32 PolarHBondContact O-N 3.4Å; R32-S34 PolarHBondContact O-N 3.48Å; R32-T35 PolarHBondContact O-N 2.99Å; R32-E36 HydrophobicContact CG-CG 4.18Å; R32-E36 IonicContact CZ-OE1 3.38Å; R32-E36 IonicContact NE-OE1 3.21Å; R32-E36 PolarHBondContact NE-OE1 3.24Å; R32-E36 IonicContact NE-OE2 2.64Å; R32-E36 IonicContact NH2-OE1 2.89Å; R32-E36 PolarHBondContact NH2-OE1 2.97Å; R32-E36 VanDerWaalsContact O-CB 3.28Å; R32-E36 WeakPolarHBondContact O-CB 3.47Å; R32-E36 VanDerWaalsContact O-CG 3.3Å; R32-E36 WeakPolarHBondContact O-CG 3.38Å; R32-E36 PolarHBondContact O-N 3.17Å
33	R	96.2	Very high	95.6	Very high	101 Å²	101	67.1 Å²	67.1	38%	0.381	34%	0.339	S	S	.	.	H	α-helix	trans	-56.9	-48.2	-179.4	-75.9	-166.6	-74.2	-86	8.2	112.5	E27 D28 S29 E30 Y31 A37	E27-R33 PolarHBondContact O-NH1 3.47Å; D28-R33 VanDerWaalsContact O-CZ 3.31Å; D28-R33 PolarHBondContact O-NH1 3.38Å; D28-R33 PolarHBondContact O-NH2 3.11Å; S29-R33 PolarHBondContact O-N 3.44Å; S29-R33 VanDerWaalsContact O-N 3.12Å; E30-R33 PolarHBondContact O-N 3.3Å; E30-R33 IonicContact OE1-CZ 3.85Å; E30-R33 IonicContact OE1-NH2 2.78Å; E30-R33 PolarHBondContact OE1-NH2 3.32Å; E30-R33 IonicContact OE2-CZ 3.85Å; E30-R33 IonicContact OE2-NE 3.51Å; E30-R33 PolarHBondContact OE2-NE 3.09Å; E30-R33 IonicContact OE2-NH2 3.51Å; E30-R33 PolarHBondContact OE2-NH2 2.95Å; E30-R33 VanDerWaalsContact OE2-NH2 3.1Å; Y31-R33 PolarHBondContact O-N 3.46Å; R33-A37 WeakPolarHBondContact O-CB 3.44Å; R33-A37 PolarHBondContact O-N 3.42Å
34	S	96.5	Very high	95.6	Very high	65 Å²	65	66.1 Å²	66.1	46%	0.455	33%	0.334	S	S	.	.	H	α-helix	trans	-67.4	-45.1	-175.6	-56.1	0	0	0	0	111.6	E30 Y31 R32 T38	E30-S34 WeakPolarHBondContact O-CB 3.43Å; E30-S34 PolarHBondContact O-N 3.05Å; E30-S34 PolarHBondContact O-OG 3.27Å; Y31-S34 PolarHBondContact O-N 3.31Å; R32-S34 PolarHBondContact O-N 3.48Å; S34-T38 WeakPolarHBondContact O-CB 3.4Å; S34-T38 PolarHBondContact O-N 3.18Å; S34-T38 VanDerWaalsContact O-N 3.09Å; S34-T38 PolarHBondContact O-OG1 3.2Å
35	T	97.1	Very high	95.5	Very high	12 Å²	12	60 Å²	60	7%	0.074	31%	0.309	C	S	.	.	H	α-helix	trans	-70.6	-39.9	179.2	-55.6	0	0	0	0	111.2	V18 L22 Y31 R32 T38 V39 E74	V18-T35 HydrophobicContact CG1-CG2 4.16Å; L22-T35 HydrophobicContact CD1-CG2 3.75Å; L22-T35 HydrophobicContact CD2-CG2 4.43Å; Y31-T35 WeakPolarHBondContact CE2-OG1 3.43Å; Y31-T35 WeakPolarHBondContact O-CB 3.46Å; Y31-T35 PolarHBondContact O-N 2.88Å; Y31-T35 PolarHBondContact O-OG1 2.95Å; Y31-T35 VanDerWaalsContact O-OG1 3.05Å; R32-T35 PolarHBondContact O-N 2.99Å; T35-T38 PolarHBondContact O-N 2.93Å; T35-V39 HydrophobicContact CG2-CG2 4.03Å; T35-V39 WeakPolarHBondContact O-CB 3.49Å; T35-V39 WeakPolarHBondContact O-CG2 3.39Å; T35-V39 PolarHBondContact O-N 3.16Å; T35-E74 HydrophobicContact CG2-CG 4.08Å; T35-E74 WeakPolarHBondContact CG2-OE1 3.21Å; T35-E74 PolarHBondContact OG1-OE1 2.88Å
36	E	96.7	Very high	95.5	Very high	45 Å²	45	60.2 Å²	60.2	21%	0.21	31%	0.31	C	S	.	.	H	α-helix	trans	-59.5	-49	175	-78.8	-177.4	175.4	0	0	111.4	L19 L22 R32 T38 V39 I40	L19-E36 HydrophobicContact CD2-CG 4.19Å; L22-E36 HydrophobicContact CB-CG 4.2Å; L22-E36 HydrophobicContact CD1-CG 3.67Å; R32-E36 HydrophobicContact CG-CG 4.18Å; R32-E36 IonicContact CZ-OE1 3.38Å; R32-E36 IonicContact NE-OE1 3.21Å; R32-E36 PolarHBondContact NE-OE1 3.24Å; R32-E36 IonicContact NE-OE2 2.64Å; R32-E36 IonicContact NH2-OE1 2.89Å; R32-E36 PolarHBondContact NH2-OE1 2.97Å; R32-E36 VanDerWaalsContact O-CB 3.28Å; R32-E36 WeakPolarHBondContact O-CB 3.47Å; R32-E36 VanDerWaalsContact O-CG 3.3Å; R32-E36 WeakPolarHBondContact O-CG 3.38Å; R32-E36 PolarHBondContact O-N 3.17Å; E36-T38 VanDerWaalsContact C-N 3.33Å; E36-T38 PolarHBondContact O-N 3.32Å; E36-V39 PolarHBondContact O-N 3.5Å; E36-I40 WeakPolarHBondContact O-CB 3.35Å; E36-I40 WeakPolarHBondContact O-CD1 3.44Å; E36-I40 WeakPolarHBondContact O-CG1 3.43Å; E36-I40 PolarHBondContact O-N 3.4Å
37	A	96.8	Very high	95.3	Very high	61 Å²	61	63.9 Å²	63.9	50%	0.504	32%	0.323	S	S	.	.	H	α-helix	trans	-58.3	-46.3	178.3	0	0	0	0	0	111.7	R33 I40 D41	R33-A37 WeakPolarHBondContact O-CB 3.44Å; R33-A37 PolarHBondContact O-N 3.42Å; A37-I40 PolarHBondContact O-N 2.95Å; A37-D41 WeakPolarHBondContact O-CB 3.5Å; A37-D41 PolarHBondContact O-N 3.26Å
38	T	96.2	Very high	95.3	Very high	67 Å²	67	60 Å²	60	41%	0.411	31%	0.313	S	S	.	.	H	α-helix	trans	-63.6	-43.8	179	-55.9	0	0	0	0	111.8	S34 T35 E36 R42	S34-T38 WeakPolarHBondContact O-CB 3.4Å; S34-T38 PolarHBondContact O-N 3.18Å; S34-T38 VanDerWaalsContact O-N 3.09Å; S34-T38 PolarHBondContact O-OG1 3.2Å; T35-T38 PolarHBondContact O-N 2.93Å; E36-T38 VanDerWaalsContact C-N 3.33Å; E36-T38 PolarHBondContact O-N 3.32Å; T38-R42 WeakPolarHBondContact O-CB 3.32Å; T38-R42 WeakPolarHBondContact O-CG 3.47Å; T38-R42 PolarHBondContact O-N 3.31Å; T38-R42 VanDerWaalsContact O-N 3.09Å
39	V	96.9	Very high	95.3	Very high	4 Å²	4	55.6 Å²	55.6	2%	0.024	29%	0.288	C	S	.	.	H	α-helix	trans	-69	-37.8	-178.8	170.8	0	0	0	0	111.4	Y15 V18 L19 T35 E36 L43	Y15-V39 HydrophobicContact CD1-CB 4.25Å; Y15-V39 HydrophobicContact CD1-CG1 3.62Å; Y15-V39 HydrophobicContact CD1-CG2 3.85Å; Y15-V39 HydrophobicContact CE1-CG2 4.21Å; Y15-V39 HydrophobicContact CG-CG1 3.84Å; V18-V39 HydrophobicContact CG1-CG2 4Å; L19-V39 HydrophobicContact CD1-CG1 4.14Å; L19-V39 HydrophobicContact CD2-CB 4.18Å; L19-V39 HydrophobicContact CD2-CG1 3.84Å; L19-V39 HydrophobicContact CG-CG1 3.75Å; T35-V39 HydrophobicContact CG2-CG2 4.03Å; T35-V39 WeakPolarHBondContact O-CB 3.49Å; T35-V39 WeakPolarHBondContact O-CG2 3.39Å; T35-V39 PolarHBondContact O-N 3.16Å; E36-V39 PolarHBondContact O-N 3.5Å; V39-L43 HydrophobicContact CG1-CD1 4.1Å; V39-L43 WeakPolarHBondContact O-CB 3.42Å; V39-L43 WeakPolarHBondContact O-CG 3.37Å; V39-L43 PolarHBondContact O-N 3.21Å
40	I	96.7	Very high	95.1	Very high	79 Å²	79	61.2 Å²	61.2	41%	0.405	32%	0.324	S	S	.	.	H	α-helix	trans	-65	-47.5	176.8	-71.2	166.5	0	0	0	110.7	L19 E36 A37 R42 L43 Q44	L19-I40 HydrophobicContact CD2-CG1 4.45Å; E36-I40 WeakPolarHBondContact O-CB 3.35Å; E36-I40 WeakPolarHBondContact O-CD1 3.44Å; E36-I40 WeakPolarHBondContact O-CG1 3.43Å; E36-I40 PolarHBondContact O-N 3.4Å; A37-I40 PolarHBondContact O-N 2.95Å; I40-R42 VanDerWaalsContact C-N 3.34Å; I40-R42 PolarHBondContact O-N 2.84Å; I40-L43 WeakPolarHBondContact O-CB 3.49Å; I40-L43 PolarHBondContact O-N 3.01Å; I40-Q44 WeakPolarHBondContact O-CG 3.3Å; I40-Q44 PolarHBondContact O-N 2.89Å
41	D	95.6	Very high	94.9	Very high	86 Å²	86	58.3 Å²	58.3	46%	0.46	31%	0.313	S	S	.	.	H	α-helix	trans	-58.3	-46.5	177.5	-177.8	57.4	0	0	0	111.4	A37 L43 Q44 I45	A37-D41 WeakPolarHBondContact O-CB 3.5Å; A37-D41 PolarHBondContact O-N 3.26Å; D41-L43 VanDerWaalsContact C-N 3.34Å; D41-L43 PolarHBondContact O-N 3.44Å; D41-Q44 WeakPolarHBondContact O-CB 3.39Å; D41-Q44 PolarHBondContact O-N 2.78Å; D41-Q44 VanDerWaalsContact O-N 3.13Å; D41-I45 WeakPolarHBondContact O-CG1 3.4Å; D41-I45 PolarHBondContact O-N 3.01Å
42	R	95.4	Very high	94.6	Very high	49 Å²	49	59.3 Å²	59.3	19%	0.185	32%	0.324	C	S	.	.	H	α-helix	trans	-62.8	-38.2	176.4	-69.4	177.5	173.6	-159.6	0.6	112.9	Y15 T38 I40 I45 I46 F59	Y15-R42 HydrophobicContact CE2-CB 4.1Å; Y15-R42 WeakPolarHBondContact OH-CD 3.47Å; Y15-R42 PolarHBondContact OH-NH1 3.05Å; Y15-R42 VanDerWaalsContact OH-NH1 3.11Å; T38-R42 WeakPolarHBondContact O-CB 3.32Å; T38-R42 WeakPolarHBondContact O-CG 3.47Å; T38-R42 PolarHBondContact O-N 3.31Å; T38-R42 VanDerWaalsContact O-N 3.09Å; I40-R42 VanDerWaalsContact C-N 3.34Å; I40-R42 PolarHBondContact O-N 2.84Å; R42-I45 PolarHBondContact O-N 3.29Å; R42-I46 WeakPolarHBondContact O-CD1 3.49Å; R42-I46 VanDerWaalsContact O-CG1 3.25Å; R42-I46 WeakPolarHBondContact O-CG1 3.3Å; R42-I46 PolarHBondContact O-N 3.41Å; R42-I46 VanDerWaalsContact O-N 3.09Å; R42-F59 HydrophobicContact CB-CE1 3.9Å; R42-F59 HydrophobicContact CB-CZ 3.92Å; R42-F59 HydrophobicContact CG-CE1 3.6Å; R42-F59 HydrophobicContact CG-CZ 4.15Å
43	L	95.8	Very high	94.2	Very high	26 Å²	26	65 Å²	65	14%	0.136	35%	0.352	C	S	.	.	H	α-helix	trans	-63.8	-41.2	173.9	-81.4	170.3	0	0	0	111.7	R12 Y15 L19 V39 I40 D41 I45 I46 E47	R12-L43 HydrophobicContact CB-CD2 4.43Å; R12-L43 HydrophobicContact CG-CD2 4.06Å; Y15-L43 HydrophobicContact CD2-CD2 4.19Å; Y15-L43 HydrophobicContact CD2-CG 4.31Å; Y15-L43 HydrophobicContact CG-CD2 4.44Å; Y15-L43 HydrophobicContact CG-CG 4.37Å; L19-L43 HydrophobicContact CD1-CD1 3.71Å; V39-L43 HydrophobicContact CG1-CD1 4.1Å; V39-L43 WeakPolarHBondContact O-CB 3.42Å; V39-L43 WeakPolarHBondContact O-CG 3.37Å; V39-L43 PolarHBondContact O-N 3.21Å; I40-L43 WeakPolarHBondContact O-CB 3.49Å; I40-L43 PolarHBondContact O-N 3.01Å; D41-L43 VanDerWaalsContact C-N 3.34Å; D41-L43 PolarHBondContact O-N 3.44Å; L43-I45 VanDerWaalsContact C-N 3.33Å; L43-I45 PolarHBondContact O-N 2.76Å; L43-I46 PolarHBondContact O-N 2.85Å; L43-E47 WeakPolarHBondContact O-CG 3.3Å; L43-E47 PolarHBondContact O-N 3.37Å
44	Q	95.7	Very high	94	Very high	113 Å²	113	65.5 Å²	65.5	53%	0.528	36%	0.357	S	S	.	.	H	α-helix	trans	-62.1	-41.4	176	-71.3	176.2	-18.5	0	0	111.6	I40 D41 I46 E47 S48	I40-Q44 WeakPolarHBondContact O-CG 3.3Å; I40-Q44 PolarHBondContact O-N 2.89Å; D41-Q44 WeakPolarHBondContact O-CB 3.39Å; D41-Q44 PolarHBondContact O-N 2.78Å; D41-Q44 VanDerWaalsContact O-N 3.13Å; Q44-I46 PolarHBondContact O-N 2.86Å; Q44-E47 PolarHBondContact O-N 3.47Å; Q44-S48 WeakPolarHBondContact O-CB 3.28Å; Q44-S48 PolarHBondContact O-N 3.42Å
45	I	94.3	Very high	93.8	Very high	33 Å²	33	62.6 Å²	62.6	17%	0.169	34%	0.337	C	S	.	.	H	α-helix	trans	-59.1	-48	174.9	-67.6	168.2	0	0	0	110.5	D41 R42 L43 E47 S48 E49 L55 K58 F59	D41-I45 WeakPolarHBondContact O-CG1 3.4Å; D41-I45 PolarHBondContact O-N 3.01Å; R42-I45 PolarHBondContact O-N 3.29Å; L43-I45 VanDerWaalsContact C-N 3.33Å; L43-I45 PolarHBondContact O-N 2.76Å; I45-E47 VanDerWaalsContact C-N 3.31Å; I45-E47 PolarHBondContact O-N 3.09Å; I45-S48 PolarHBondContact O-N 3.2Å; I45-S48 VanDerWaalsContact O-N 3.16Å; I45-S48 PolarHBondContact O-OG 3.28Å; I45-E49 PolarHBondContact O-N 3.35Å; I45-L55 HydrophobicContact CG2-CD1 3.77Å; I45-K58 HydrophobicContact CG2-CB 3.83Å; I45-K58 HydrophobicContact CG2-CD 4.33Å; I45-F59 HydrophobicContact CB-CE2 4.49Å; I45-F59 HydrophobicContact CG2-CD2 4.02Å; I45-F59 HydrophobicContact CG2-CE2 3.9Å
46	I	93.7	Very high	93.6	Very high	8 Å²	8	64.9 Å²	64.9	4%	0.041	35%	0.347	C	S	.	.	H	α-helix	trans	-62.8	-35.6	177.9	-64.5	160.3	0	0	0	112.1	L11 Y15 R42 L43 Q44 L55 F59	L11-I46 HydrophobicContact CB-CD1 3.55Å; L11-I46 HydrophobicContact CD1-CD1 3.95Å; L11-I46 HydrophobicContact CD1-CG1 4.37Å; L11-I46 HydrophobicContact CG-CD1 4.35Å; Y15-I46 HydrophobicContact CD2-CD1 3.9Å; Y15-I46 HydrophobicContact CE2-CD1 3.78Å; R42-I46 WeakPolarHBondContact O-CD1 3.49Å; R42-I46 VanDerWaalsContact O-CG1 3.25Å; R42-I46 WeakPolarHBondContact O-CG1 3.3Å; R42-I46 PolarHBondContact O-N 3.41Å; R42-I46 VanDerWaalsContact O-N 3.09Å; L43-I46 PolarHBondContact O-N 2.85Å; Q44-I46 PolarHBondContact O-N 2.86Å; I46-L55 HydrophobicContact CG1-CD1 4.21Å; I46-L55 HydrophobicContact CG1-CD2 4.34Å; I46-F59 HydrophobicContact CD1-CE2 4.36Å; I46-F59 HydrophobicContact CD1-CZ 4.07Å; I46-F59 HydrophobicContact CG1-CE2 3.81Å; I46-F59 HydrophobicContact CG1-CZ 3.98Å
47	E	92.9	Very high	93.4	Very high	122 Å²	122	70.5 Å²	70.5	57%	0.57	37%	0.373	S	S	*	.	H	α-helix	trans	-73	-31.9	176	-74.8	-179.2	171.7	0	0	112.7	R12 L43 Q44 I45	R12-E47 IonicContact NH1-OE1 3.7Å; L43-E47 WeakPolarHBondContact O-CG 3.3Å; L43-E47 PolarHBondContact O-N 3.37Å; Q44-E47 PolarHBondContact O-N 3.47Å; I45-E47 VanDerWaalsContact C-N 3.31Å; I45-E47 PolarHBondContact O-N 3.09Å
48	S	93.4	Very high	93.2	Very high	69 Å²	69	72.2 Å²	72.2	48%	0.483	37%	0.369	S	S	.	.	H	α-helix	trans	-74.6	-25.4	179.7	81	0	0	0	0	113.9	Q44 I45 K58	Q44-S48 WeakPolarHBondContact O-CB 3.28Å; Q44-S48 PolarHBondContact O-N 3.42Å; I45-S48 PolarHBondContact O-N 3.2Å; I45-S48 VanDerWaalsContact O-N 3.16Å; I45-S48 PolarHBondContact O-OG 3.28Å; S48-K58 PolarHBondContact OG-NZ 2.93Å
49	E	91.9	Very high	92.9	Very high	29 Å²	29	70 Å²	70	14%	0.136	35%	0.354	C	S	.	.			trans	-134.8	106.4	-170	-167.7	59.6	-117.9	0	0	112.2	I45 N51 K54 L55 K58	I45-E49 PolarHBondContact O-N 3.35Å; E49-N51 WeakPolarHBondContact OE1-CB 3.19Å; E49-K54 HydrophobicContact CG-CB 3.56Å; E49-K54 WeakPolarHBondContact OE1-CD 3.34Å; E49-L55 HydrophobicContact CB-CD1 4.11Å; E49-L55 HydrophobicContact CG-CB 4.39Å; E49-K58 HydrophobicContact CB-CD 3.96Å; E49-K58 HydrophobicContact CG-CD 4.26Å; E49-K58 IonicContact OE2-NZ 3.93Å; E49-K58 PolarHBondContact OE2-NZ 3.34Å
50	P	87.8	Confident	92.6	Very high	123 Å²	123	72.9 Å²	72.9	80%	0.799	38%	0.384	S	S	*	.			trans	-81.9	-17.3	176.6	31.7	-33.9	0	0	0	113.3
51	N	90.9	Very high	92	Very high	61 Å²	61	72.6 Å²	72.6	33%	0.326	38%	0.383	S	S	.	.			trans	-81.3	123.4	-179.9	-177.3	-41.3	0	0	0	110.3	E49 E53 K54 L55	E49-N51 WeakPolarHBondContact OE1-CB 3.19Å; N51-E53 PolarHBondContact O-N 3.36Å; N51-E53 PolarHBondContact OD1-N 2.78Å; N51-K54 HydrophobicContact CB-CB 4.27Å; N51-K54 HydrophobicContact CB-CD 4.37Å; N51-K54 HydrophobicContact CB-CG 4.37Å; N51-K54 PolarHBondContact O-N 3.11Å; N51-L55 VanDerWaalsContact O-CB 3.31Å; N51-L55 WeakPolarHBondContact O-CB 3.21Å; N51-L55 PolarHBondContact O-N 2.95Å
52	P	88.7	Confident	91.7	Very high	62 Å²	62	70.5 Å²	70.5	40%	0.403	38%	0.382	S	S	.	.	H	α-helix	trans	-61.9	-39.9	-177.2	24.6	-33.6	0	0	0	113.6	P7 K54 L55 E56 L64	P7-P52 HydrophobicContact CG-CB 4.28Å; P52-K54 PolarHBondContact O-N 3.25Å; P52-L55 WeakPolarHBondContact O-CB 3.44Å; P52-L55 PolarHBondContact O-N 3.24Å; P52-E56 WeakPolarHBondContact O-CG 3.47Å; P52-E56 PolarHBondContact O-N 3.44Å; P52-L64 HydrophobicContact CB-CD1 3.79Å; P52-L64 WeakPolarHBondContact O-CD1 3.33Å
53	E	89.7	Confident	91.5	Very high	150 Å²	150	73.2 Å²	73.2	70%	0.701	40%	0.397	S	S	*	.	H	α-helix	trans	-65.8	-41.9	-178.7	-63.2	175.7	175.2	0	0	111.4	N51 L55 E56 E57	N51-E53 PolarHBondContact O-N 3.36Å; N51-E53 PolarHBondContact OD1-N 2.78Å; E53-L55 VanDerWaalsContact C-N 3.3Å; E53-E56 WeakPolarHBondContact O-CB 3.38Å; E53-E56 PolarHBondContact O-N 3.12Å; E53-E57 PolarHBondContact O-N 3.4Å
54	K	92.3	Very high	91.4	Very high	111 Å²	111	72.1 Å²	72.1	48%	0.483	39%	0.391	S	S	.	.	H	α-helix	trans	-70.8	-30.3	175.1	-69	-174.3	175.9	-176.6	0	112.3	E49 N51 P52 E57 K58	E49-K54 HydrophobicContact CG-CB 3.56Å; E49-K54 WeakPolarHBondContact OE1-CD 3.34Å; N51-K54 HydrophobicContact CB-CB 4.27Å; N51-K54 HydrophobicContact CB-CD 4.37Å; N51-K54 HydrophobicContact CB-CG 4.37Å; N51-K54 PolarHBondContact O-N 3.11Å; P52-K54 PolarHBondContact O-N 3.25Å; K54-E57 PolarHBondContact O-N 3.37Å; K54-K58 WeakPolarHBondContact O-CB 3.21Å; K54-K58 WeakPolarHBondContact O-CG 3.5Å; K54-K58 PolarHBondContact O-N 2.99Å
55	L	92.1	Very high	91.2	Very high	4 Å²	4	68.2 Å²	68.2	2%	0.021	37%	0.372	C	S	.	.	H	α-helix	trans	-66.7	-41.6	176	-170.3	68	0	0	0	110.3	I45 I46 E49 N51 P52 E53 E57 K58 F59 L64	I45-L55 HydrophobicContact CG2-CD1 3.77Å; I46-L55 HydrophobicContact CG1-CD1 4.21Å; I46-L55 HydrophobicContact CG1-CD2 4.34Å; E49-L55 HydrophobicContact CB-CD1 4.11Å; E49-L55 HydrophobicContact CG-CB 4.39Å; N51-L55 VanDerWaalsContact O-CB 3.31Å; N51-L55 WeakPolarHBondContact O-CB 3.21Å; N51-L55 PolarHBondContact O-N 2.95Å; P52-L55 WeakPolarHBondContact O-CB 3.44Å; P52-L55 PolarHBondContact O-N 3.24Å; E53-L55 VanDerWaalsContact C-N 3.3Å; L55-E57 PolarHBondContact O-N 3.34Å; L55-K58 PolarHBondContact O-N 2.8Å; L55-F59 HydrophobicContact CD1-CD2 4.07Å; L55-F59 HydrophobicContact CD1-CE2 3.88Å; L55-F59 HydrophobicContact CG-CD2 3.97Å; L55-F59 HydrophobicContact CG-CE2 4.02Å; L55-F59 WeakPolarHBondContact O-CD2 3.41Å; L55-F59 PolarHBondContact O-N 2.95Å; L55-L64 HydrophobicContact CB-CD1 4.31Å; L55-L64 HydrophobicContact CB-CD2 4.43Å; L55-L64 HydrophobicContact CD2-CD1 3.99Å; L55-L64 HydrophobicContact CD2-CD2 3.68Å; L55-L64 HydrophobicContact CG-CD1 4.46Å; L55-L64 HydrophobicContact CG-CD2 3.89Å
56	E	92.2	Very high	91.1	Very high	61 Å²	61	70.3 Å²	70.3	29%	0.285	38%	0.382	S	S	.	.	H	α-helix	trans	-56.8	-48.6	172.3	-72.6	-179.4	163.8	0	0	112	P52 E53 K58 F59 G60 Q63 L64	P52-E56 WeakPolarHBondContact O-CG 3.47Å; P52-E56 PolarHBondContact O-N 3.44Å; E53-E56 WeakPolarHBondContact O-CB 3.38Å; E53-E56 PolarHBondContact O-N 3.12Å; E56-K58 VanDerWaalsContact C-N 3.34Å; E56-K58 PolarHBondContact O-N 3.32Å; E56-F59 PolarHBondContact O-N 3.49Å; E56-G60 PolarHBondContact O-N 2.92Å; E56-Q63 WeakPolarHBondContact OE1-CA 3.4Å; E56-L64 HydrophobicContact CG-CB 4.36Å; E56-L64 HydrophobicContact CG-CD1 3.98Å; E56-L64 HydrophobicContact CG-CD2 4.4Å; E56-L64 HydrophobicContact CG-CG 3.54Å; E56-L64 PolarHBondContact OE1-N 3.09Å
57	E	92.5	Very high	91.1	Very high	162 Å²	162	70 Å²	70	76%	0.757	38%	0.38	S	S	*	.	H	α-helix	trans	-60.3	-43.8	178.1	-170.5	-178	-174.9	0	0	111.7	E53 K54 L55 G60	E53-E57 PolarHBondContact O-N 3.4Å; K54-E57 PolarHBondContact O-N 3.37Å; L55-E57 PolarHBondContact O-N 3.34Å; E57-G60 PolarHBondContact O-N 3.44Å
58	K	92.2	Very high	91.2	Very high	98 Å²	98	64.6 Å²	64.6	43%	0.426	36%	0.355	S	S	.	.	H	α-helix	trans	-65.7	-37.4	177.7	-79.7	179.5	171.4	171.1	0	113.1	I45 S48 E49 K54 L55 E56	I45-K58 HydrophobicContact CG2-CB 3.83Å; I45-K58 HydrophobicContact CG2-CD 4.33Å; S48-K58 PolarHBondContact OG-NZ 2.93Å; E49-K58 HydrophobicContact CB-CD 3.96Å; E49-K58 HydrophobicContact CG-CD 4.26Å; E49-K58 IonicContact OE2-NZ 3.93Å; E49-K58 PolarHBondContact OE2-NZ 3.34Å; K54-K58 WeakPolarHBondContact O-CB 3.21Å; K54-K58 WeakPolarHBondContact O-CG 3.5Å; K54-K58 PolarHBondContact O-N 2.99Å; L55-K58 PolarHBondContact O-N 2.8Å; E56-K58 VanDerWaalsContact C-N 3.34Å; E56-K58 PolarHBondContact O-N 3.32Å
59	F	91	Very high	91.2	Very high	21 Å²	21	65.2 Å²	65.2	9%	0.092	35%	0.353	C	S	.	.	H	α-helix	trans	-69.4	-39.3	175.8	-95.2	-87	0	0	0	111.5	R42 I45 I46 L55 E56 L61 L64 V67	R42-F59 HydrophobicContact CB-CE1 3.9Å; R42-F59 HydrophobicContact CB-CZ 3.92Å; R42-F59 HydrophobicContact CG-CE1 3.6Å; R42-F59 HydrophobicContact CG-CZ 4.15Å; I45-F59 HydrophobicContact CB-CE2 4.49Å; I45-F59 HydrophobicContact CG2-CD2 4.02Å; I45-F59 HydrophobicContact CG2-CE2 3.9Å; I46-F59 HydrophobicContact CD1-CE2 4.36Å; I46-F59 HydrophobicContact CD1-CZ 4.07Å; I46-F59 HydrophobicContact CG1-CE2 3.81Å; I46-F59 HydrophobicContact CG1-CZ 3.98Å; L55-F59 HydrophobicContact CD1-CD2 4.07Å; L55-F59 HydrophobicContact CD1-CE2 3.88Å; L55-F59 HydrophobicContact CG-CD2 3.97Å; L55-F59 HydrophobicContact CG-CE2 4.02Å; L55-F59 WeakPolarHBondContact O-CD2 3.41Å; L55-F59 PolarHBondContact O-N 2.95Å; E56-F59 PolarHBondContact O-N 3.49Å; F59-L61 HydrophobicContact CD1-CD1 4.26Å; F59-L61 WeakPolarHBondContact O-CG 3.4Å; F59-L61 PolarHBondContact O-N 3.26Å; F59-L64 HydrophobicContact CD2-CD2 4.43Å; F59-V67 HydrophobicContact CB-CG2 4.49Å; F59-V67 HydrophobicContact CD1-CG1 3.87Å; F59-V67 HydrophobicContact CD1-CG2 4.3Å; F59-V67 HydrophobicContact CE1-CG1 3.68Å; F59-V67 HydrophobicContact CG-CG1 4.48Å; F59-V67 HydrophobicContact CG-CG2 4.41Å; F59-V67 HydrophobicContact CZ-CG1 4.16Å
60	G	89.1	Confident	91.4	Very high	64 Å²	64	67.2 Å²	67.2	66%	0.66	36%	0.362	S	S	*	.			trans	63.6	20.5	-179.2	0	0	0	0	0	113.9	E56 E57	E56-G60 PolarHBondContact O-N 2.92Å; E57-G60 PolarHBondContact O-N 3.44Å
61	L	84.6	Confident	91.8	Very high	72 Å²	72	61.4 Å²	61.4	38%	0.377	32%	0.324	S	S	.	.	S	Bend	trans	-116.7	22.4	-173	-70.1	175	0	0	0	113.2	F59 V67	F59-L61 HydrophobicContact CD1-CD1 4.26Å; F59-L61 WeakPolarHBondContact O-CG 3.4Å; F59-L61 PolarHBondContact O-N 3.26Å; L61-V67 HydrophobicContact CB-CG2 4.16Å
62	G	89.4	Confident	92.1	Very high	43 Å²	43	62.7 Å²	62.7	44%	0.443	33%	0.328	S	S	.	.	S	Bend	trans	92.1	-152.4	-174.8	0	0	0	0	0	112.5
63	Q	92.1	Very high	92.5	Very high	106 Å²	106	64.7 Å²	64.7	50%	0.495	34%	0.335	S	S	.	.			trans	-74.2	153.3	-178.6	-64.8	-179.1	3.4	0	0	111.7	E56 E65 E66 V67	E56-Q63 WeakPolarHBondContact OE1-CA 3.4Å; Q63-E65 PolarHBondContact O-N 2.87Å; Q63-E66 WeakPolarHBondContact O-CB 3.45Å; Q63-E66 PolarHBondContact O-N 3.39Å; Q63-V67 PolarHBondContact O-N 3.47Å
64	L	92.1	Very high	92.9	Very high	2 Å²	2	59.8 Å²	59.8	1%	0.01	31%	0.312	C	S	.	.	H	α-helix	trans	-60.5	-30.4	179	-77.1	167.5	0	0	0	113	P7 L11 P52 L55 E56 F59 E66 V67 I68	P7-L64 HydrophobicContact CB-CB 3.93Å; P7-L64 HydrophobicContact CB-CD1 3.9Å; P7-L64 HydrophobicContact CB-CG 4.41Å; P7-L64 HydrophobicContact CG-CB 4.35Å; P7-L64 HydrophobicContact CG-CD1 3.52Å; L11-L64 HydrophobicContact CD1-CD2 3.99Å; P52-L64 HydrophobicContact CB-CD1 3.79Å; P52-L64 WeakPolarHBondContact O-CD1 3.33Å; L55-L64 HydrophobicContact CB-CD1 4.31Å; L55-L64 HydrophobicContact CB-CD2 4.43Å; L55-L64 HydrophobicContact CD2-CD1 3.99Å; L55-L64 HydrophobicContact CD2-CD2 3.68Å; L55-L64 HydrophobicContact CG-CD1 4.46Å; L55-L64 HydrophobicContact CG-CD2 3.89Å; E56-L64 HydrophobicContact CG-CB 4.36Å; E56-L64 HydrophobicContact CG-CD1 3.98Å; E56-L64 HydrophobicContact CG-CD2 4.4Å; E56-L64 HydrophobicContact CG-CG 3.54Å; E56-L64 PolarHBondContact OE1-N 3.09Å; F59-L64 HydrophobicContact CD2-CD2 4.43Å; L64-E66 VanDerWaalsContact C-N 3.27Å; L64-E66 PolarHBondContact O-N 3.42Å; L64-V67 PolarHBondContact O-N 3.08Å; L64-I68 VanDerWaalsContact O-CG1 3.3Å; L64-I68 WeakPolarHBondContact O-CG1 3.49Å; L64-I68 PolarHBondContact O-N 2.95Å
65	E	91.7	Very high	93.1	Very high	31 Å²	31	55 Å²	55	15%	0.145	29%	0.292	C	S	.	.	H	α-helix	trans	-59.4	-38.3	173.8	-73.5	73.1	-166.4	0	0	112.1	M1 V4 Q63 I68 L69	M1-E65 HydrophobicContact CB-CB 4.43Å; M1-E65 HydrophobicContact SD-CB 4.13Å; V4-E65 HydrophobicContact CG2-CG 4.37Å; V4-E65 PolarHBondContact N-OE1 3.39Å; Q63-E65 PolarHBondContact O-N 2.87Å; E65-I68 PolarHBondContact O-N 3.46Å; E65-L69 PolarHBondContact O-N 3.24Å
66	E	92.5	Very high	93.4	Very high	78 Å²	78	58.8 Å²	58.8	36%	0.364	31%	0.312	S	S	.	.	H	α-helix	trans	-70.7	-39.3	176.4	-64.7	-176	-161.4	0	0	111	M1 Q63 L64 I68 L69 Q70	M1-E66 HydrophobicContact CE-CG 3.87Å; M1-E66 HydrophobicContact SD-CG 4.03Å; Q63-E66 WeakPolarHBondContact O-CB 3.45Å; Q63-E66 PolarHBondContact O-N 3.39Å; L64-E66 VanDerWaalsContact C-N 3.27Å; L64-E66 PolarHBondContact O-N 3.42Å; E66-I68 VanDerWaalsContact C-N 3.31Å; E66-I68 PolarHBondContact O-N 3.26Å; E66-L69 PolarHBondContact O-N 2.9Å; E66-Q70 WeakPolarHBondContact O-CG 3.49Å; E66-Q70 PolarHBondContact O-N 2.98Å
67	V	94.3	Very high	93.6	Very high	1 Å²	1	59.4 Å²	59.4	1%	0.006	32%	0.317	C	S	.	.	H	α-helix	trans	-63.6	-39.5	175.1	-177.5	0	0	0	0	110.9	L11 F59 L61 Q63 L64 Q70 A71	L11-V67 HydrophobicContact CD1-CG1 4.27Å; L11-V67 HydrophobicContact CD2-CG1 3.96Å; F59-V67 HydrophobicContact CB-CG2 4.49Å; F59-V67 HydrophobicContact CD1-CG1 3.87Å; F59-V67 HydrophobicContact CD1-CG2 4.3Å; F59-V67 HydrophobicContact CE1-CG1 3.68Å; F59-V67 HydrophobicContact CG-CG1 4.48Å; F59-V67 HydrophobicContact CG-CG2 4.41Å; F59-V67 HydrophobicContact CZ-CG1 4.16Å; L61-V67 HydrophobicContact CB-CG2 4.16Å; Q63-V67 PolarHBondContact O-N 3.47Å; L64-V67 PolarHBondContact O-N 3.08Å; V67-Q70 PolarHBondContact O-N 3.21Å; V67-A71 WeakPolarHBondContact O-CB 2.9Å; V67-A71 PolarHBondContact O-N 3.46Å
68	I	94.5	Very high	93.8	Very high	8 Å²	8	51.7 Å²	51.7	4%	0.041	28%	0.28	C	S	.	.	H	α-helix	trans	-61.8	-48.4	174.1	-73.4	167.2	0	0	0	110.3	V4 P7 H10 L11 I14 L64 E65 E66 Q70 A71 E72	V4-I68 HydrophobicContact CB-CD1 3.97Å; V4-I68 HydrophobicContact CG1-CD1 3.94Å; V4-I68 HydrophobicContact CG2-CD1 3.92Å; P7-I68 HydrophobicContact CB-CD1 3.85Å; H10-I68 HydrophobicContact CB-CD1 4.35Å; H10-I68 VanDerWaalsContact CD2-CG2 3.47Å; H10-I68 WeakPolarHBondContact CD2-CG2 3.33Å; L11-I68 HydrophobicContact CD1-CG1 4.38Å; L11-I68 HydrophobicContact CD2-CB 4.28Å; L11-I68 HydrophobicContact CD2-CG1 3.54Å; L11-I68 HydrophobicContact CG-CG1 3.67Å; I14-I68 HydrophobicContact CD1-CG2 4.1Å; L64-I68 VanDerWaalsContact O-CG1 3.3Å; L64-I68 WeakPolarHBondContact O-CG1 3.49Å; L64-I68 PolarHBondContact O-N 2.95Å; E65-I68 PolarHBondContact O-N 3.46Å; E66-I68 VanDerWaalsContact C-N 3.31Å; E66-I68 PolarHBondContact O-N 3.26Å; I68-Q70 VanDerWaalsContact C-N 3.31Å; I68-Q70 PolarHBondContact O-N 3.38Å; I68-A71 WeakPolarHBondContact O-CB 3.35Å; I68-A71 PolarHBondContact O-N 3.2Å; I68-A71 VanDerWaalsContact O-N 3.08Å; I68-E72 WeakPolarHBondContact O-CG 3.29Å; I68-E72 PolarHBondContact O-N 3.34Å
69	L	94.5	Very high	94	Very high	83 Å²	83	51.6 Å²	51.6	44%	0.435	28%	0.28	S	S	.	.	H	α-helix	trans	-58.3	-44.4	177.4	178.3	62.1	0	0	0	111.5	E65 E66 A71 E72 L73	E65-L69 PolarHBondContact O-N 3.24Å; E66-L69 PolarHBondContact O-N 2.9Å; L69-A71 VanDerWaalsContact C-N 3.31Å; L69-A71 PolarHBondContact O-N 2.96Å; L69-E72 PolarHBondContact O-N 3.39Å; L69-L73 HydrophobicContact CD1-CD1 4.48Å; L69-L73 HydrophobicContact CD1-CG 4.41Å; L69-L73 HydrophobicContact CG-CD1 4.22Å; L69-L73 VanDerWaalsContact O-CG 3.29Å; L69-L73 WeakPolarHBondContact O-CG 3.43Å; L69-L73 PolarHBondContact O-N 3.1Å
70	Q	95.6	Very high	94.3	Very high	71 Å²	71	53.7 Å²	53.7	33%	0.332	30%	0.295	S	S	.	.	H	α-helix	trans	-58.7	-43.3	174.6	-71.4	174.9	29.1	0	0	111.7	E66 V67 I68 E72 L73 E74	E66-Q70 WeakPolarHBondContact O-CG 3.49Å; E66-Q70 PolarHBondContact O-N 2.98Å; V67-Q70 PolarHBondContact O-N 3.21Å; I68-Q70 VanDerWaalsContact C-N 3.31Å; I68-Q70 PolarHBondContact O-N 3.38Å; Q70-E72 PolarHBondContact O-N 2.93Å; Q70-L73 PolarHBondContact O-N 2.64Å; Q70-E74 WeakPolarHBondContact O-CB 3.2Å; Q70-E74 PolarHBondContact O-N 3.01Å
71	A	96.2	Very high	94.6	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-65	-38	178.3	0	0	0	0	0	112.3	L11 I14 Y15 V67 I68 L69 E74 L75	L11-A71 HydrophobicContact CD2-CB 4.13Å; I14-A71 HydrophobicContact CB-CB 4.3Å; I14-A71 HydrophobicContact CD1-CB 4.35Å; I14-A71 HydrophobicContact CG2-CB 3.68Å; I14-A71 WeakPolarHBondContact CG2-O 3.48Å; Y15-A71 HydrophobicContact CD1-CB 4.44Å; Y15-A71 HydrophobicContact CE1-CB 3.79Å; V67-A71 WeakPolarHBondContact O-CB 2.9Å; V67-A71 PolarHBondContact O-N 3.46Å; I68-A71 WeakPolarHBondContact O-CB 3.35Å; I68-A71 PolarHBondContact O-N 3.2Å; I68-A71 VanDerWaalsContact O-N 3.08Å; L69-A71 VanDerWaalsContact C-N 3.31Å; L69-A71 PolarHBondContact O-N 2.96Å; A71-E74 PolarHBondContact O-N 2.89Å; A71-L75 PolarHBondContact O-N 3.4Å
72	E	96.4	Very high	95.1	Very high	88 Å²	88	51.5 Å²	51.5	41%	0.411	27%	0.268	S	S	.	.	H	α-helix	trans	-66.4	-41.7	174.8	-68.9	-169.4	150.8	0	0	112.3	H10 I14 I68 L69 Q70 L75 N76	H10-E72 IonicContact NE2-OE1 3.1Å; I14-E72 HydrophobicContact CD1-CG 3.6Å; I68-E72 WeakPolarHBondContact O-CG 3.29Å; I68-E72 PolarHBondContact O-N 3.34Å; L69-E72 PolarHBondContact O-N 3.39Å; Q70-E72 PolarHBondContact O-N 2.93Å; E72-L75 PolarHBondContact O-N 3.21Å; E72-N76 PolarHBondContact O-N 2.84Å; E72-N76 VanDerWaalsContact O-N 3.09Å; E72-N76 PolarHBondContact O-ND2 3.49Å
73	L	97.6	Very high	95.4	Very high	104 Å²	104	57 Å²	57	55%	0.545	28%	0.279	S	S	.	.	H	α-helix	trans	-62.1	-44.4	174.1	-69.9	172.9	0	0	0	110.8	L69 Q70 L75 N76 L77	L69-L73 HydrophobicContact CD1-CD1 4.48Å; L69-L73 HydrophobicContact CD1-CG 4.41Å; L69-L73 HydrophobicContact CG-CD1 4.22Å; L69-L73 VanDerWaalsContact O-CG 3.29Å; L69-L73 WeakPolarHBondContact O-CG 3.43Å; L69-L73 PolarHBondContact O-N 3.1Å; Q70-L73 PolarHBondContact O-N 2.64Å; L73-L75 VanDerWaalsContact C-N 3.31Å; L73-L75 PolarHBondContact O-N 3.4Å; L73-N76 PolarHBondContact O-N 2.97Å; L73-N76 VanDerWaalsContact O-N 3.12Å; L73-L77 WeakPolarHBondContact O-CB 3.39Å; L73-L77 PolarHBondContact O-N 3.05Å
74	E	97.2	Very high	95.5	Very high	48 Å²	48	59.4 Å²	59.4	22%	0.224	29%	0.285	C	S	.	.	H	α-helix	trans	-61.3	-39.8	176.7	-171.1	60.5	-154.7	0	0	111.6	Y31 T35 Q70 A71 N76 L77 T78	Y31-E74 PolarHBondContact OH-OE1 3.49Å; T35-E74 HydrophobicContact CG2-CG 4.08Å; T35-E74 WeakPolarHBondContact CG2-OE1 3.21Å; T35-E74 PolarHBondContact OG1-OE1 2.88Å; Q70-E74 WeakPolarHBondContact O-CB 3.2Å; Q70-E74 PolarHBondContact O-N 3.01Å; A71-E74 PolarHBondContact O-N 2.89Å; E74-N76 VanDerWaalsContact C-N 3.33Å; E74-N76 PolarHBondContact O-N 3.43Å; E74-L77 PolarHBondContact O-N 3.21Å; E74-T78 WeakPolarHBondContact O-CB 3.42Å; E74-T78 PolarHBondContact O-N 3.12Å; E74-T78 PolarHBondContact O-OG1 2.93Å
75	L	97.5	Very high	95.5	Very high	10 Å²	10	60.2 Å²	60.2	5%	0.052	29%	0.291	C	S	.	.	H	α-helix	trans	-62.9	-39.5	174.9	178.9	60.8	0	0	0	112.2	I14 R17 V18 A71 E72 L73 K79	I14-L75 HydrophobicContact CG2-CB 4.34Å; I14-L75 HydrophobicContact CG2-CD2 4.45Å; R17-L75 HydrophobicContact CB-CD1 3.95Å; R17-L75 HydrophobicContact CB-CD2 4.13Å; V18-L75 HydrophobicContact CG2-CB 3.79Å; V18-L75 HydrophobicContact CG2-CD1 3.9Å; V18-L75 HydrophobicContact CG2-CG 4.41Å; A71-L75 PolarHBondContact O-N 3.4Å; E72-L75 PolarHBondContact O-N 3.21Å; L73-L75 VanDerWaalsContact C-N 3.31Å; L73-L75 PolarHBondContact O-N 3.4Å; L75-K79 WeakPolarHBondContact O-CG 3.39Å; L75-K79 PolarHBondContact O-N 2.84Å
76	N	97.5	Very high	95.6	Very high	83 Å²	83	62.1 Å²	62.1	44%	0.444	31%	0.307	S	S	.	.	H	α-helix	trans	-72.5	-37.4	176.6	-70.2	-29.2	0	0	0	112	E72 L73 E74 K79 T80	E72-N76 PolarHBondContact O-N 2.84Å; E72-N76 VanDerWaalsContact O-N 3.09Å; E72-N76 PolarHBondContact O-ND2 3.49Å; L73-N76 PolarHBondContact O-N 2.97Å; L73-N76 VanDerWaalsContact O-N 3.12Å; E74-N76 VanDerWaalsContact C-N 3.33Å; E74-N76 PolarHBondContact O-N 3.43Å; N76-K79 PolarHBondContact O-N 2.87Å; N76-K79 PolarHBondContact OD1-NZ 3.37Å; N76-T80 PolarHBondContact O-N 2.59Å; N76-T80 PolarHBondContact O-OG1 3.41Å
77	L	97.6	Very high	95.6	Very high	74 Å²	74	62 Å²	62	39%	0.387	30%	0.303	S	S	.	.	H	α-helix	trans	-60	-47.8	171.6	-179.8	60.6	0	0	0	110.2	Y31 L73 E74 K79 T80 M81	Y31-L77 HydrophobicContact CE2-CD2 4.14Å; L73-L77 WeakPolarHBondContact O-CB 3.39Å; L73-L77 PolarHBondContact O-N 3.05Å; E74-L77 PolarHBondContact O-N 3.21Å; L77-K79 VanDerWaalsContact C-N 3.29Å; L77-K79 PolarHBondContact O-N 3.43Å; L77-T80 CarbonylContact O-C 3.49Å; L77-T80 WeakPolarHBondContact O-CA 3.35Å; L77-T80 VanDerWaalsContact O-CB 3.27Å; L77-T80 WeakPolarHBondContact O-CB 3.46Å; L77-T80 PolarHBondContact O-N 2.99Å; L77-M81 HydrophobicContact CD1-CG 4.16Å; L77-M81 HydrophobicContact CD1-SD 4.37Å; L77-M81 HydrophobicContact CG-CG 4.15Å; L77-M81 VanDerWaalsContact O-CG 3.29Å; L77-M81 WeakPolarHBondContact O-CG 3.31Å; L77-M81 PolarHBondContact O-N 3.45Å
78	T	96.9	Very high	95.4	Very high	0 Å²	0	68.1 Å²	68.1	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-55.9	-42.9	178.6	-57.3	0	0	0	0	111.8	A21 L22 M25 Y31 E74 T80 M81 L82	A21-T78 HydrophobicContact CB-CG2 3.6Å; L22-T78 HydrophobicContact CD2-CG2 3.75Å; L22-T78 HydrophobicContact CG-CG2 4.06Å; M25-T78 HydrophobicContact CE-CG2 3.6Å; M25-T78 WeakPolarHBondContact CE-O 3.37Å; Y31-T78 PolarHBondContact OH-OG1 3.42Å; E74-T78 WeakPolarHBondContact O-CB 3.42Å; E74-T78 PolarHBondContact O-N 3.12Å; E74-T78 PolarHBondContact O-OG1 2.93Å; T78-T80 VanDerWaalsContact C-N 3.3Å; T78-T80 PolarHBondContact O-N 3.23Å; T78-M81 PolarHBondContact O-N 3.04Å; T78-L82 PolarHBondContact O-N 3.46Å
79	K	96.3	Very high	95.3	Very high	96 Å²	96	73.3 Å²	73.3	42%	0.417	37%	0.366	S	S	.	.	H	α-helix	trans	-64.3	-36.5	174.3	-66.9	169.2	-167.3	159.5	0	112.4	L75 N76 L77 L82 K83	L75-K79 WeakPolarHBondContact O-CG 3.39Å; L75-K79 PolarHBondContact O-N 2.84Å; N76-K79 PolarHBondContact O-N 2.87Å; N76-K79 PolarHBondContact OD1-NZ 3.37Å; L77-K79 VanDerWaalsContact C-N 3.29Å; L77-K79 PolarHBondContact O-N 3.43Å; K79-L82 PolarHBondContact O-N 2.88Å; K79-K83 PolarHBondContact O-N 2.85Å
80	T	96.9	Very high	95.1	Very high	66 Å²	66	76.8 Å²	76.8	41%	0.405	38%	0.384	S	S	.	.	H	α-helix	trans	-69.6	-42.8	178.3	-56.4	0	0	0	0	110.5	N76 L77 T78 L82 K83 Y84	N76-T80 PolarHBondContact O-N 2.59Å; N76-T80 PolarHBondContact O-OG1 3.41Å; L77-T80 CarbonylContact O-C 3.49Å; L77-T80 WeakPolarHBondContact O-CA 3.35Å; L77-T80 VanDerWaalsContact O-CB 3.27Å; L77-T80 WeakPolarHBondContact O-CB 3.46Å; L77-T80 PolarHBondContact O-N 2.99Å; T78-T80 VanDerWaalsContact C-N 3.3Å; T78-T80 PolarHBondContact O-N 3.23Å; T80-L82 VanDerWaalsContact C-N 3.29Å; T80-L82 PolarHBondContact O-N 3.05Å; T80-K83 WeakPolarHBondContact O-CB 3.27Å; T80-K83 PolarHBondContact O-N 2.8Å; T80-Y84 HydrophobicContact CG2-CD2 3.59Å; T80-Y84 HydrophobicContact CG2-CE2 3.67Å; T80-Y84 VanDerWaalsContact O-CD2 3.31Å; T80-Y84 WeakPolarHBondContact O-CD2 3.29Å; T80-Y84 PolarHBondContact O-N 3.38Å
81	M	95.7	Very high	94.8	Very high	36 Å²	36	81.8 Å²	81.8	18%	0.177	41%	0.411	C	S	.	.	H	α-helix	trans	-58.6	-40.7	173.4	-64.8	-66.2	-83.2	0	0	111.2	M25 Y31 L77 T78 K83 Y84 A85 P86 W87	M25-M81 HydrophobicContact CE-CB 3.61Å; Y31-M81 HydrophobicContact CD1-CB 4.28Å; Y31-M81 HydrophobicContact CD1-CE 3.69Å; Y31-M81 HydrophobicContact CD1-CG 4.06Å; Y31-M81 HydrophobicContact CD2-CE 3.67Å; Y31-M81 HydrophobicContact CE1-CB 4.01Å; Y31-M81 HydrophobicContact CE1-CE 4.18Å; Y31-M81 HydrophobicContact CE1-CG 3.66Å; Y31-M81 HydrophobicContact CE2-CE 4.18Å; Y31-M81 HydrophobicContact CE2-CG 4.38Å; Y31-M81 HydrophobicContact CG-CE 3.4Å; L77-M81 HydrophobicContact CD1-CG 4.16Å; L77-M81 HydrophobicContact CD1-SD 4.37Å; L77-M81 HydrophobicContact CG-CG 4.15Å; L77-M81 VanDerWaalsContact O-CG 3.29Å; L77-M81 WeakPolarHBondContact O-CG 3.31Å; L77-M81 PolarHBondContact O-N 3.45Å; T78-M81 PolarHBondContact O-N 3.04Å; M81-K83 VanDerWaalsContact C-N 3.29Å; M81-K83 PolarHBondContact O-N 3.01Å; M81-Y84 PolarHBondContact O-N 3.42Å; M81-A85 WeakPolarHBondContact O-CA 3.21Å; M81-A85 PolarHBondContact O-N 2.77Å; M81-P86 HydrophobicContact CE-CG 3.34Å; M81-P86 WeakPolarHBondContact O-CD 3.41Å; M81-P86 HydrophobicContact SD-CG 3.55Å; M81-P86 VanDerWaalsContact SD-CG 3.55Å; M81-W87 HydrophobicContact CB-CZ3 4.33Å; M81-W87 WeakPolarHBondContact O-CH2 3.33Å; M81-W87 WeakPolarHBondContact O-CZ3 3.47Å
82	L	94.2	Very high	94.5	Very high	54 Å²	54	85.3 Å²	85.3	28%	0.283	44%	0.44	S	S	.	.	H	α-helix	trans	-60.5	-35.4	172.3	-75.8	170.6	0	0	0	113.7	A21 K24 M25 T78 K79 T80 W87	A21-L82 HydrophobicContact CB-CD1 4.38Å; K24-L82 HydrophobicContact CB-CD1 4.31Å; K24-L82 HydrophobicContact CB-CD2 3.67Å; K24-L82 HydrophobicContact CD-CD1 4.21Å; M25-L82 HydrophobicContact CE-CD2 4.02Å; M25-L82 HydrophobicContact CE-CG 3.68Å; M25-L82 HydrophobicContact CG-CD2 3.53Å; M25-L82 HydrophobicContact CG-CG 4.26Å; T78-L82 PolarHBondContact O-N 3.46Å; K79-L82 PolarHBondContact O-N 2.88Å; T80-L82 VanDerWaalsContact C-N 3.29Å; T80-L82 PolarHBondContact O-N 3.05Å; L82-W87 HydrophobicContact CD2-CH2 4.22Å
83	K	95	Very high	94.2	Very high	159 Å²	159	90.3 Å²	90.3	69%	0.691	46%	0.461	S	S	*	.	H	α-helix	trans	-74.7	-40.6	-179.8	-177.2	-175.6	175.5	-169.6	0	112.3	K79 T80 M81	K79-K83 PolarHBondContact O-N 2.85Å; T80-K83 WeakPolarHBondContact O-CB 3.27Å; T80-K83 PolarHBondContact O-N 2.8Å; M81-K83 VanDerWaalsContact C-N 3.29Å; M81-K83 PolarHBondContact O-N 3.01Å
84	Y	95	Very high	93.9	Very high	156 Å²	156	88.5 Å²	88.5	61%	0.612	46%	0.455	S	S	*	.	H	α-helix	trans	-96.3	-11.8	-173	-70.7	-73.8	0	0	0	114.2	T80 M81	T80-Y84 HydrophobicContact CG2-CD2 3.59Å; T80-Y84 HydrophobicContact CG2-CE2 3.67Å; T80-Y84 VanDerWaalsContact O-CD2 3.31Å; T80-Y84 WeakPolarHBondContact O-CD2 3.29Å; T80-Y84 PolarHBondContact O-N 3.38Å; M81-Y84 PolarHBondContact O-N 3.42Å
85	A	93.2	Very high	93.5	Very high	18 Å²	18	89.7 Å²	89.7	15%	0.149	47%	0.467	C	S	.	.			trans	44.1	52.9	177.4	0	0	0	0	0	114.4	M81 W87 E88	M81-A85 WeakPolarHBondContact O-CA 3.21Å; M81-A85 PolarHBondContact O-N 2.77Å; A85-W87 HydrophobicContact CB-CH2 4.39Å; A85-W87 HydrophobicContact CB-CZ2 3.73Å; A85-W87 PolarHBondContact O-N 3.02Å; A85-E88 HydrophobicContact CB-CG 4.26Å; A85-E88 WeakPolarHBondContact O-CB 3.42Å; A85-E88 WeakPolarHBondContact O-CG 3.45Å; A85-E88 PolarHBondContact O-N 2.99Å
86	P	92.9	Very high	92.9	Very high	72 Å²	72	97.1 Å²	97.1	47%	0.468	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-2.2	-172.5	31.4	-36.9	0	0	0	114.5	M81	M81-P86 HydrophobicContact CE-CG 3.34Å; M81-P86 WeakPolarHBondContact O-CD 3.41Å; M81-P86 HydrophobicContact SD-CG 3.55Å; M81-P86 VanDerWaalsContact SD-CG 3.55Å
87	W	91.9	Very high	92.4	Very high	76 Å²	76	99.1 Å²	99.1	29%	0.288	52%	0.517	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-9.7	169.4	51.5	77	0	0	0	112.7	M25 P26 M81 L82 A85	M25-W87 HydrophobicContact CB-CH2 4.1Å; M25-W87 HydrophobicContact CB-CZ3 4.17Å; M25-W87 HydrophobicContact CE-CH2 4.42Å; M25-W87 HydrophobicContact CE-CZ3 4.07Å; M25-W87 HydrophobicContact CG-CH2 3.64Å; M25-W87 HydrophobicContact CG-CZ3 3.71Å; M25-W87 HydrophobicContact SD-CE3 4.43Å; M25-W87 HydrophobicContact SD-CH2 4.16Å; M25-W87 HydrophobicContact SD-CZ3 3.63Å; P26-W87 HydrophobicContact CG-CG 4.45Å; M81-W87 HydrophobicContact CB-CZ3 4.33Å; M81-W87 WeakPolarHBondContact O-CH2 3.33Å; M81-W87 WeakPolarHBondContact O-CZ3 3.47Å; L82-W87 HydrophobicContact CD2-CH2 4.22Å; A85-W87 HydrophobicContact CB-CH2 4.39Å; A85-W87 HydrophobicContact CB-CZ2 3.73Å; A85-W87 PolarHBondContact O-N 3.02Å
88	E	91.2	Very high	92.1	Very high	128 Å²	128	100.7 Å²	100.7	60%	0.598	52%	0.523	S	S	*	.	S	Bend	trans	-68.9	155.8	172.4	-68.4	-177.4	167	0	0	111.7	A85	A85-E88 HydrophobicContact CB-CG 4.26Å; A85-E88 WeakPolarHBondContact O-CB 3.42Å; A85-E88 WeakPolarHBondContact O-CG 3.45Å; A85-E88 PolarHBondContact O-N 2.99Å
89	P	91	Very high	91.7	Very high	118 Å²	118	110.2 Å²	110.2	77%	0.766	56%	0.559	S	S	*	*	P	Polyproline II helix	trans	-55.9	154.4	175.4	-24.7	34.5	0	0	0	113	I91	P89-I91 PolarHBondContact O-N 3.18Å
90	L	91.2	Very high	91.1	Very high	156 Å²	156	109.2 Å²	109.2	82%	0.817	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-51.1	123	177.5	-68.8	171.8	0	0	0	111.6	A92	L90-A92 VanDerWaalsContact C-N 3.27Å; L90-A92 PolarHBondContact O-N 3.34Å
91	I	89.8	Confident	90.4	Very high	176 Å²	176	116.6 Å²	116.6	90%	0.903	59%	0.585	S	S	*	*	S	Bend	trans	-60.6	-38.2	-178.5	-60.1	170.7	0	0	0	111.4	P89	P89-I91 PolarHBondContact O-N 3.18Å
92	A	90.2	Very high	89.8	Confident	73 Å²	73	120 Å²	120	60%	0.603	61%	0.609	S	S	*	*	S	Bend	trans	-137	139.8	179.7	0	0	0	0	0	110.6	L90	L90-A92 VanDerWaalsContact C-N 3.27Å; L90-A92 PolarHBondContact O-N 3.34Å
93	K	89.4	Confident	88.7	Confident	194 Å²	194	126.3 Å²	126.3	84%	0.843	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-74.6	139.5	168.7	-68	-174.9	179.4	-178.6	0	109.1
94	P	90.5	Very high	88.4	Confident	65 Å²	65	124.7 Å²	124.7	42%	0.422	65%	0.648	S	S	.	*	P	Polyproline II helix	trans	-64.7	150.2	174.5	28.8	-34.3	0	0	0	110.6	Q98 W99	P94-Q98 HydrophobicContact CB-CB 4.28Å; P94-Q98 HydrophobicContact CB-CG 4.47Å; P94-W99 VanDerWaalsContact CB-NE1 3.26Å
95	P	89.3	Confident	88.1	Confident	74 Å²	74	123.1 Å²	123.1	48%	0.481	65%	0.649	S	S	.	*	P	Polyproline II helix	trans	-57	147.2	166.8	-21.9	30.8	0	0	0	111.7	N97 Q98	P95-N97 PolarHBondContact O-N 3.04Å; P95-Q98 HydrophobicContact CB-CB 4.25Å; P95-Q98 HydrophobicContact CG-CB 4.36Å; P95-Q98 VanDerWaalsContact O-CB 3.27Å; P95-Q98 WeakPolarHBondContact O-CB 3.27Å; P95-Q98 PolarHBondContact O-N 2.97Å
96	D	85.4	Confident	87.8	Confident	166 Å²	166	128.9 Å²	128.9	89%	0.888	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.9	-26.4	-173.3	-64.5	-30.1	0	0	0	113.9
97	N	87.6	Confident	87.5	Confident	124 Å²	124	132.2 Å²	132.2	66%	0.663	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.9	0.6	179.7	66.1	-20.1	0	0	0	114.3	P95 W99	P95-N97 PolarHBondContact O-N 3.04Å; N97-W99 VanDerWaalsContact C-N 3.29Å; N97-W99 PolarHBondContact O-N 3.33Å
98	Q	90	Very high	87.2	Confident	108 Å²	108	135.8 Å²	135.8	51%	0.505	72%	0.715	S	S	.	*	T	Hydrogen-bonded Turn	trans	-63.3	-34.8	-174.7	-177.7	67.3	23	0	0	112.8	P94 P95	P94-Q98 HydrophobicContact CB-CB 4.28Å; P94-Q98 HydrophobicContact CB-CG 4.47Å; P95-Q98 HydrophobicContact CB-CB 4.25Å; P95-Q98 HydrophobicContact CG-CB 4.36Å; P95-Q98 VanDerWaalsContact O-CB 3.27Å; P95-Q98 WeakPolarHBondContact O-CB 3.27Å; P95-Q98 PolarHBondContact O-N 2.97Å
99	W	88.9	Confident	87	Confident	199 Å²	199	136.3 Å²	136.3	75%	0.754	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.7	11.5	-174.4	-52.5	119.8	0	0	0	113.6	P94 N97	P94-W99 VanDerWaalsContact CB-NE1 3.26Å; N97-W99 VanDerWaalsContact C-N 3.29Å; N97-W99 PolarHBondContact O-N 3.33Å
100	S	83.5	Confident	86.7	Confident	75 Å²	75	137.6 Å²	137.6	52%	0.524	72%	0.719	S	S	.	*			trans	-85.7	114.8	177.4	-61.5	0	0	0	0	109.9
101	W	81.8	Confident	86.3	Confident	222 Å²	222	136.2 Å²	136.2	84%	0.841	71%	0.712	S	S	*	*			trans	-142.7	136.1	178.6	-170.5	-98.8	0	0	0	111.6	V103	W101-V103 HydrophobicContact CE3-CG2 4.19Å; W101-V103 HydrophobicContact CZ3-CG2 3.94Å
102	P	84.6	Confident	86	Confident	107 Å²	107	132.8 Å²	132.8	70%	0.695	70%	0.696	S	S	*	*			cis	-71.6	166.8	-6.5	32.2	-34.8	0	0	0	112.5
103	V	71.2	Confident	85.7	Confident	187 Å²	187	138.3 Å²	138.3	100%	1.133	70%	0.704	S	S	*	*			trans	-70.2	0	-177.9	-159.3	0	0	0	0	111.9	W101	W101-V103 HydrophobicContact CE3-CG2 4.19Å; W101-V103 HydrophobicContact CZ3-CG2 3.94Å

Retrieved 103 of 103 residues in 57.8 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).