G4LV33_SCHMA Loading...

CASPASE_P20 domain-containing protein

AlphaFold DB , UniProt , Accession G4LV33, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 95 aa.

						>G4LV33_SCHMA|G4LV33
MYLLHHCKGITKDAIVHCVLSPEEECGTKAISILHKQCRRPYDITEALLTLLHGPSLHQDDVAGLQRLIKPMINCKISLSQMERGSDLKCFINIK
					

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	45.7	Very low	48.6	Very low	193 Å²	193	110.5 Å²	110.5	95%	0.951	55%	0.547	S	S	*	.				0	20.4	0	-136	172	-170.6	0	0	113	L4	M1-L4 HydrophobicContact CG-CD1 4.21Å
2	Y	41.9	Very low	49.4	Very low	185 Å²	185	109 Å²	109	73%	0.725	54%	0.535	S	S	*	.	H	α-helix	trans	-75.1	-40.1	-174.3	-155.1	-97.9	0	0	0	112.6	L4 H5 H6	Y2-L4 PolarHBondContact O-N 3.11Å; Y2-H5 PolarHBondContact O-N 3.41Å; Y2-H6 AromaticContact CD1-CD2 3.87Å; Y2-H6 AromaticContact CE1-CD2 3.76Å; Y2-H6 AromaticContact CE1-NE2 3.59Å; Y2-H6 AromaticContact CZ-NE2 3.81Å; Y2-H6 PolarHBondContact O-CD2 3.08Å
3	L	38.9	Very low	50.1	Low	121 Å²	121	109.1 Å²	109.1	63%	0.634	54%	0.539	S	S	*	.	H	α-helix	trans	-64.4	-35.2	-177.5	-67.7	167.7	0	0	0	113.6	H5 H6 C7	L3-H5 VanDerWaalsContact C-N 3.29Å; L3-H5 PolarHBondContact O-N 3Å; L3-H6 PolarHBondContact O-N 3.42Å; L3-C7 WeakPolarHBondContact O-CB 3.43Å; L3-C7 PolarHBondContact O-N 3.45Å; L3-C7 PolarHBondContact O-SG 3.39Å
4	L	47.2	Very low	50.4	Low	35 Å²	35	102.1 Å²	102.1	18%	0.183	51%	0.507	C	S	.	.	H	α-helix	trans	-63.7	-29.8	-178.6	-92.2	160	0	0	0	114.1	M1 Y2 K12 I15 V16	M1-L4 HydrophobicContact CG-CD1 4.21Å; Y2-L4 PolarHBondContact O-N 3.11Å; L4-K12 HydrophobicContact CD2-CG 3.88Å; L4-I15 HydrophobicContact CD2-CG2 4.15Å; L4-I15 HydrophobicContact CG-CG2 3.93Å; L4-V16 HydrophobicContact CD2-CG2 3.57Å
5	H	47.8	Very low	50.5	Low	156 Å²	156	98.1 Å²	98.1	72%	0.722	49%	0.488	S	S	*	.	H	α-helix	trans	-78.4	-27.1	179.2	-83.8	-94.9	0	0	0	112.6	Y2 L3	Y2-H5 PolarHBondContact O-N 3.41Å; L3-H5 VanDerWaalsContact C-N 3.29Å; L3-H5 PolarHBondContact O-N 3Å
6	H	45.4	Very low	50.9	Low	131 Å²	131	96 Å²	96	61%	0.606	48%	0.482	S	S	*	.	H	α-helix	trans	-96.9	-24	-177.7	-67.3	-72.6	0	0	0	113.3	Y2 L3	Y2-H6 AromaticContact CD1-CD2 3.87Å; Y2-H6 AromaticContact CE1-CD2 3.76Å; Y2-H6 AromaticContact CE1-NE2 3.59Å; Y2-H6 AromaticContact CZ-NE2 3.81Å; Y2-H6 PolarHBondContact O-CD2 3.08Å; L3-H6 PolarHBondContact O-N 3.42Å
7	C	41.2	Very low	51.1	Low	27 Å²	27	95.4 Å²	95.4	18%	0.182	48%	0.477	C	S	.	.			trans	-80.2	133.5	175.6	-66.5	0	0	0	0	111.5	L3 T11 K12 I15	L3-C7 WeakPolarHBondContact O-CB 3.43Å; L3-C7 PolarHBondContact O-N 3.45Å; L3-C7 PolarHBondContact O-SG 3.39Å; C7-T11 HydrophobicContact CB-CG2 4.19Å; C7-K12 HydrophobicContact CB-CB 4.38Å; C7-I15 HydrophobicContact CB-CD1 4.09Å
8	K	52	Low	51.1	Low	178 Å²	178	91.1 Å²	91.1	77%	0.774	46%	0.457	S	S	*	.			trans	-123.9	152.3	174.5	-70.9	-177.7	179.2	177.9	0	110.5
9	G	62.5	Low	51.2	Low	48 Å²	48	92.2 Å²	92.2	50%	0.495	47%	0.469	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.5	-144.9	178.6	0	0	0	0	0	113.5	T11 K12 D13	G9-T11 PolarHBondContact O-N 2.99Å; G9-K12 WeakPolarHBondContact O-CA 3.44Å; G9-K12 WeakPolarHBondContact O-CB 3.43Å; G9-K12 PolarHBondContact O-N 3.24Å; G9-D13 PolarHBondContact O-N 3.36Å
10	I	58.5	Low	51.4	Low	118 Å²	118	95.1 Å²	95.1	61%	0.605	49%	0.485	S	S	*	.	H	α-helix	trans	-51.9	-34.2	-172.8	-60.4	173.3	0	0	0	112.7	D13 A14 I33	I10-D13 PolarHBondContact O-N 2.87Å; I10-A14 PolarHBondContact O-N 3.33Å; I10-A14 VanDerWaalsContact O-N 3.11Å; I10-I33 HydrophobicContact CG2-CD1 4.02Å; I10-I33 HydrophobicContact CG2-CG1 4.1Å; I10-I33 HydrophobicContact CG2-CG2 4.44Å
11	T	54	Low	51.4	Low	23 Å²	23	91.7 Å²	91.7	14%	0.141	47%	0.47	C	S	.	.	H	α-helix	trans	-63.1	-42.7	176.8	-32.6	0	0	0	0	112	C7 G9 I15 I33 Q37	C7-T11 HydrophobicContact CB-CG2 4.19Å; G9-T11 PolarHBondContact O-N 2.99Å; T11-I15 HydrophobicContact CG2-CD1 4.17Å; T11-I15 WeakPolarHBondContact O-CD1 3.44Å; T11-I15 VanDerWaalsContact O-CG1 3.23Å; T11-I15 WeakPolarHBondContact O-CG1 3.44Å; T11-I15 PolarHBondContact O-N 3.39Å; T11-I33 HydrophobicContact CG2-CG2 4.29Å; T11-Q37 PolarHBondContact OG1-NE2 3.49Å; T11-Q37 PolarHBondContact OG1-OE1 2.91Å
12	K	58.1	Low	52	Low	93 Å²	93	86.5 Å²	86.5	40%	0.404	45%	0.45	S	S	.	.	H	α-helix	trans	-65.8	-47.6	179.4	-169.1	-175.7	176	-179.9	0	110.2	L4 C7 G9 A14 I15 V16	L4-K12 HydrophobicContact CD2-CG 3.88Å; C7-K12 HydrophobicContact CB-CB 4.38Å; G9-K12 WeakPolarHBondContact O-CA 3.44Å; G9-K12 WeakPolarHBondContact O-CB 3.43Å; G9-K12 PolarHBondContact O-N 3.24Å; K12-A14 VanDerWaalsContact C-N 3.26Å; K12-A14 PolarHBondContact O-N 3.06Å; K12-I15 PolarHBondContact O-N 3.3Å; K12-I15 VanDerWaalsContact O-N 3.16Å; K12-V16 WeakPolarHBondContact O-CG2 3.48Å; K12-V16 PolarHBondContact O-N 2.72Å
13	D	58.2	Low	52.7	Low	110 Å²	110	83.3 Å²	83.3	59%	0.588	44%	0.442	S	S	*	.	H	α-helix	trans	-61.1	-38.5	-177.9	-67.3	-24.1	0	0	0	111.7	G9 I10 V16 H17	G9-D13 PolarHBondContact O-N 3.36Å; I10-D13 PolarHBondContact O-N 2.87Å; D13-V16 PolarHBondContact O-N 3.43Å; D13-H17 WeakPolarHBondContact O-CB 3.46Å; D13-H17 PolarHBondContact O-N 2.98Å
14	A	53.8	Low	53.5	Low	11 Å²	11	84.9 Å²	84.9	9%	0.091	45%	0.446	C	S	.	.	H	α-helix	trans	-73.2	-36	176.2	0	0	0	0	0	113.9	I10 K12 V16 H17 C18 I33	I10-A14 PolarHBondContact O-N 3.33Å; I10-A14 VanDerWaalsContact O-N 3.11Å; K12-A14 VanDerWaalsContact C-N 3.26Å; K12-A14 PolarHBondContact O-N 3.06Å; A14-V16 VanDerWaalsContact C-N 3.29Å; A14-H17 PolarHBondContact O-N 2.74Å; A14-C18 WeakPolarHBondContact O-CB 3.32Å; A14-C18 PolarHBondContact O-N 3.01Å; A14-C18 PolarHBondContact O-SG 3.04Å; A14-I33 HydrophobicContact CB-CD1 2.92Å; A14-I33 HydrophobicContact CB-CG1 4.41Å
15	I	52.3	Low	54.2	Low	42 Å²	42	88.5 Å²	88.5	22%	0.215	46%	0.462	C	S	.	.	H	α-helix	trans	-64.1	-37.9	171.8	-68.1	167	0	0	0	110.3	L4 C7 T11 K12 C18 V19	L4-I15 HydrophobicContact CD2-CG2 4.15Å; L4-I15 HydrophobicContact CG-CG2 3.93Å; C7-I15 HydrophobicContact CB-CD1 4.09Å; T11-I15 HydrophobicContact CG2-CD1 4.17Å; T11-I15 WeakPolarHBondContact O-CD1 3.44Å; T11-I15 VanDerWaalsContact O-CG1 3.23Å; T11-I15 WeakPolarHBondContact O-CG1 3.44Å; T11-I15 PolarHBondContact O-N 3.39Å; K12-I15 PolarHBondContact O-N 3.3Å; K12-I15 VanDerWaalsContact O-N 3.16Å; I15-C18 WeakPolarHBondContact O-CB 3.43Å; I15-C18 PolarHBondContact O-N 3.46Å; I15-V19 WeakPolarHBondContact O-CG2 3.42Å; I15-V19 PolarHBondContact O-N 3.39Å
16	V	56.7	Low	54.5	Low	65 Å²	65	82.4 Å²	82.4	39%	0.394	44%	0.437	S	S	.	.	H	α-helix	trans	-64	-47.6	172.9	172.7	0	0	0	0	110.7	L4 K12 D13 A14 C18 V19	L4-V16 HydrophobicContact CD2-CG2 3.57Å; K12-V16 WeakPolarHBondContact O-CG2 3.48Å; K12-V16 PolarHBondContact O-N 2.72Å; D13-V16 PolarHBondContact O-N 3.43Å; A14-V16 VanDerWaalsContact C-N 3.29Å; V16-C18 PolarHBondContact O-N 3.4Å; V16-V19 PolarHBondContact O-N 2.87Å; V16-V19 VanDerWaalsContact O-N 3.16Å
17	H	55.1	Low	55.2	Low	85 Å²	85	76.5 Å²	76.5	39%	0.394	41%	0.412	S	S	.	.	H	α-helix	trans	-59.7	-38.7	177.8	-167.2	-63.9	0	0	0	111.4	D13 A14 V19 L20 S21 K29	D13-H17 WeakPolarHBondContact O-CB 3.46Å; D13-H17 PolarHBondContact O-N 2.98Å; A14-H17 PolarHBondContact O-N 2.74Å; H17-V19 VanDerWaalsContact C-N 3.34Å; H17-V19 PolarHBondContact O-N 3.35Å; H17-L20 PolarHBondContact O-N 3.26Å; H17-L20 VanDerWaalsContact O-N 3.1Å; H17-S21 PolarHBondContact CE1-OG 2.85Å; H17-S21 PolarHBondContact ND1-OG 3.25Å; H17-S21 WeakPolarHBondContact O-CB 3.47Å; H17-S21 PolarHBondContact O-N 2.98Å; H17-S21 VanDerWaalsContact O-N 3.12Å; H17-S21 PolarHBondContact O-OG 2.83Å; H17-K29 PolarHBondContact CE1-NZ 3.13Å; H17-K29 PolarHBondContact ND1-NZ 3.23Å; H17-K29 PolarHBondContact NE2-NZ 3.43Å
18	C	50.2	Low	56.2	Low	18 Å²	18	79.3 Å²	79.3	12%	0.122	43%	0.428	C	S	.	.	H	α-helix	trans	-56.8	-40.3	175.1	-101.7	0	0	0	0	114	A14 I15 V16 L20 S21 C26	A14-C18 WeakPolarHBondContact O-CB 3.32Å; A14-C18 PolarHBondContact O-N 3.01Å; A14-C18 PolarHBondContact O-SG 3.04Å; I15-C18 WeakPolarHBondContact O-CB 3.43Å; I15-C18 PolarHBondContact O-N 3.46Å; V16-C18 PolarHBondContact O-N 3.4Å; C18-L20 PolarHBondContact O-N 3.21Å; C18-S21 PolarHBondContact O-N 3.5Å; C18-C26 VanDerWaalsContact CA-SG 3.55Å; C18-C26 HydrophobicContact CB-CB 3.72Å; C18-C26 WeakPolarHBondContact CB-SG 3.21Å; C18-C26 WeakPolarHBondContact SG-CA 3.24Å; C18-C26 WeakPolarHBondContact SG-CB 3.24Å; C18-C26 PolarHBondContact SG-O 3.21Å; C18-C26 CovalentContact SG-SG 2.02Å; C18-C26 PolarHBondContact SG-SG 3.21Å
19	V	52.8	Low	56.8	Low	113 Å²	113	74.7 Å²	74.7	69%	0.685	41%	0.408	S	S	*	.	H	α-helix	trans	-63.5	-26.3	178	173.5	0	0	0	0	111.5	I15 V16 H17	I15-V19 WeakPolarHBondContact O-CG2 3.42Å; I15-V19 PolarHBondContact O-N 3.39Å; V16-V19 PolarHBondContact O-N 2.87Å; V16-V19 VanDerWaalsContact O-N 3.16Å; H17-V19 VanDerWaalsContact C-N 3.34Å; H17-V19 PolarHBondContact O-N 3.35Å
20	L	55.3	Low	56.9	Low	149 Å²	149	73.9 Å²	73.9	78%	0.78	40%	0.396	S	S	*	.	H	α-helix	trans	-97.5	-8.3	-179	-62.3	172.7	0	0	0	113.6	H17 C18	H17-L20 PolarHBondContact O-N 3.26Å; H17-L20 VanDerWaalsContact O-N 3.1Å; C18-L20 PolarHBondContact O-N 3.21Å
21	S	52.8	Low	57.2	Low	24 Å²	24	69.2 Å²	69.2	17%	0.168	37%	0.372	C	S	.	.	S	Bend	trans	-109.3	156.7	-171.5	-54.8	0	0	0	0	112	H17 C18	H17-S21 PolarHBondContact CE1-OG 2.85Å; H17-S21 PolarHBondContact ND1-OG 3.25Å; H17-S21 WeakPolarHBondContact O-CB 3.47Å; H17-S21 PolarHBondContact O-N 2.98Å; H17-S21 VanDerWaalsContact O-N 3.12Å; H17-S21 PolarHBondContact O-OG 2.83Å; C18-S21 PolarHBondContact O-N 3.5Å
22	P	57.4	Low	57.7	Low	84 Å²	84	70.4 Å²	70.4	55%	0.545	38%	0.382	S	S	.	.			trans	-52.5	143.3	169.1	-21.4	31.6	0	0	0	111.2	E24 E25 C26	P22-E24 PolarHBondContact O-N 3.16Å; P22-E24 VanDerWaalsContact O-N 3.1Å; P22-E25 PolarHBondContact O-N 3.04Å; P22-C26 PolarHBondContact O-N 3.42Å; P22-C26 VanDerWaalsContact O-N 3.07Å
23	E	56.3	Low	58.2	Low	118 Å²	118	66.7 Å²	66.7	55%	0.551	37%	0.366	S	S	*	.	H	α-helix	trans	-55	-34.9	-171.4	-147.9	170.5	-158.4	0	0	112.7	G27 I77	E23-G27 PolarHBondContact O-N 2.87Å; E23-G27 VanDerWaalsContact O-N 3.1Å; E23-I77 HydrophobicContact CG-CD1 4.01Å
24	E	56.2	Low	58.4	Low	155 Å²	155	64.4 Å²	64.4	72%	0.724	35%	0.354	S	S	*	.	H	α-helix	trans	-67.3	-46.3	176.3	-80.3	179.7	154	0	0	113.9	P22 C26 G27 T28 Q81	P22-E24 PolarHBondContact O-N 3.16Å; P22-E24 VanDerWaalsContact O-N 3.1Å; E24-C26 VanDerWaalsContact C-N 3.28Å; E24-C26 PolarHBondContact O-N 3.46Å; E24-G27 PolarHBondContact O-N 2.97Å; E24-T28 PolarHBondContact O-N 3.27Å; E24-T28 PolarHBondContact O-OG1 3.28Å; E24-Q81 PolarHBondContact O-NE2 3.28Å
25	E	61	Low	58.9	Low	110 Å²	110	68.6 Å²	68.6	51%	0.514	37%	0.371	S	S	.	.	H	α-helix	trans	-65.7	-37.5	177.7	-78.1	-170	173.3	0	0	111.2	P22 K29	P22-E25 PolarHBondContact O-N 3.04Å; E25-K29 PolarHBondContact O-N 3.33Å; E25-K29 VanDerWaalsContact O-N 3.13Å
26	C	55.3	Low	59.6	Low	28 Å²	28	75 Å²	75	19%	0.189	40%	0.398	C	S	.	.	H	α-helix	trans	-60.8	-53.3	177.6	166.8	0	0	0	0	111.5	C18 P22 E24 T28 K29 A30	C18-C26 VanDerWaalsContact CA-SG 3.55Å; C18-C26 HydrophobicContact CB-CB 3.72Å; C18-C26 WeakPolarHBondContact CB-SG 3.21Å; C18-C26 WeakPolarHBondContact SG-CA 3.24Å; C18-C26 WeakPolarHBondContact SG-CB 3.24Å; C18-C26 PolarHBondContact SG-O 3.21Å; C18-C26 CovalentContact SG-SG 2.02Å; C18-C26 PolarHBondContact SG-SG 3.21Å; P22-C26 PolarHBondContact O-N 3.42Å; P22-C26 VanDerWaalsContact O-N 3.07Å; E24-C26 VanDerWaalsContact C-N 3.28Å; E24-C26 PolarHBondContact O-N 3.46Å; C26-T28 VanDerWaalsContact C-N 3.29Å; C26-T28 PolarHBondContact O-N 2.99Å; C26-K29 PolarHBondContact O-N 3.49Å; C26-A30 WeakPolarHBondContact O-CB 3.08Å; C26-A30 PolarHBondContact O-N 3.3Å
27	G	59.2	Low	59.8	Low	8 Å²	8	76.9 Å²	76.9	8%	0.082	40%	0.402	C	S	.	.	H	α-helix	trans	-59.3	-42.7	-177	0	0	0	0	0	111.8	E23 E24 K29 A30 I31 Q81	E23-G27 PolarHBondContact O-N 2.87Å; E23-G27 VanDerWaalsContact O-N 3.1Å; E24-G27 PolarHBondContact O-N 2.97Å; G27-K29 PolarHBondContact O-N 3.45Å; G27-A30 PolarHBondContact O-N 3.17Å; G27-I31 VanDerWaalsContact O-CG1 3.31Å; G27-I31 WeakPolarHBondContact O-CG1 3.46Å; G27-I31 PolarHBondContact O-N 3.01Å; G27-Q81 PolarHBondContact O-OE1 2.91Å
28	T	63.5	Low	59.9	Low	85 Å²	85	74.8 Å²	74.8	52%	0.521	40%	0.397	S	S	.	.	H	α-helix	trans	-62.4	-44.5	179.3	-52.6	0	0	0	0	111.6	E24 C26 S32	E24-T28 PolarHBondContact O-N 3.27Å; E24-T28 PolarHBondContact O-OG1 3.28Å; C26-T28 VanDerWaalsContact C-N 3.29Å; C26-T28 PolarHBondContact O-N 2.99Å; T28-S32 WeakPolarHBondContact O-CB 3.44Å; T28-S32 PolarHBondContact O-N 3.03Å
29	K	63.7	Low	60.4	Low	81 Å²	81	85.7 Å²	85.7	35%	0.352	44%	0.435	S	S	.	.	H	α-helix	trans	-64.3	-44.5	175.5	-83.6	-178.6	-178.4	170.1	0	112	H17 E25 C26 G27 I31 S32 I33	H17-K29 PolarHBondContact CE1-NZ 3.13Å; H17-K29 PolarHBondContact ND1-NZ 3.23Å; H17-K29 PolarHBondContact NE2-NZ 3.43Å; E25-K29 PolarHBondContact O-N 3.33Å; E25-K29 VanDerWaalsContact O-N 3.13Å; C26-K29 PolarHBondContact O-N 3.49Å; G27-K29 PolarHBondContact O-N 3.45Å; K29-I31 PolarHBondContact O-N 2.95Å; K29-S32 PolarHBondContact O-N 3.26Å; K29-S32 PolarHBondContact O-OG 3.41Å; K29-I33 PolarHBondContact O-N 3.25Å; K29-I33 VanDerWaalsContact O-N 3.07Å
30	A	64.7	Low	60.9	Low	31 Å²	31	88.3 Å²	88.3	26%	0.256	43%	0.433	S	S	.	.	H	α-helix	trans	-60.3	-45.5	178.8	0	0	0	0	0	111.4	C26 G27 I33 L34	C26-A30 WeakPolarHBondContact O-CB 3.08Å; C26-A30 PolarHBondContact O-N 3.3Å; G27-A30 PolarHBondContact O-N 3.17Å; A30-I33 PolarHBondContact O-N 2.89Å; A30-L34 WeakPolarHBondContact O-CG 3.45Å; A30-L34 PolarHBondContact O-N 2.94Å
31	I	64.1	Low	61.3	Low	20 Å²	20	84 Å²	84	10%	0.103	41%	0.414	C	S	.	.	H	α-helix	trans	-60.9	-46.2	174.3	-68.9	162.4	0	0	0	110.5	G27 K29 I33 L34 H35 S78 Q81 M82	G27-I31 VanDerWaalsContact O-CG1 3.31Å; G27-I31 WeakPolarHBondContact O-CG1 3.46Å; G27-I31 PolarHBondContact O-N 3.01Å; K29-I31 PolarHBondContact O-N 2.95Å; I31-I33 PolarHBondContact O-N 3.19Å; I31-L34 CarbonylContact O-C 3.58Å; I31-L34 PolarHBondContact O-N 3.44Å; I31-H35 WeakPolarHBondContact O-CB 3.43Å; I31-H35 PolarHBondContact O-N 2.96Å; I31-S78 WeakPolarHBondContact CD1-O 3.36Å; I31-Q81 HydrophobicContact CD1-CB 3.42Å; I31-Q81 VanDerWaalsContact CD1-CB 3.42Å; I31-Q81 HydrophobicContact CD1-CG 4.48Å; I31-M82 HydrophobicContact CD1-CG 3.78Å; I31-M82 HydrophobicContact CG1-CG 4.15Å; I31-M82 HydrophobicContact CG2-CG 3.97Å
32	S	65.7	Low	61.9	Low	48 Å²	48	90.2 Å²	90.2	34%	0.336	44%	0.435	S	S	.	.	H	α-helix	trans	-58	-35.1	180	81.4	0	0	0	0	112.5	T28 K29 K36	T28-S32 WeakPolarHBondContact O-CB 3.44Å; T28-S32 PolarHBondContact O-N 3.03Å; K29-S32 PolarHBondContact O-N 3.26Å; K29-S32 PolarHBondContact O-OG 3.41Å; S32-K36 WeakPolarHBondContact O-CG 3.47Å; S32-K36 PolarHBondContact O-N 3.45Å
33	I	67.1	Low	62.3	Low	15 Å²	15	89.9 Å²	89.9	8%	0.077	43%	0.428	C	S	.	.	H	α-helix	trans	-79.3	-41.2	179.3	-71.6	162.2	0	0	0	111.1	I10 T11 A14 K29 A30 I31 H35 K36 Q37	I10-I33 HydrophobicContact CG2-CD1 4.02Å; I10-I33 HydrophobicContact CG2-CG1 4.1Å; I10-I33 HydrophobicContact CG2-CG2 4.44Å; T11-I33 HydrophobicContact CG2-CG2 4.29Å; A14-I33 HydrophobicContact CB-CD1 2.92Å; A14-I33 HydrophobicContact CB-CG1 4.41Å; K29-I33 PolarHBondContact O-N 3.25Å; K29-I33 VanDerWaalsContact O-N 3.07Å; A30-I33 PolarHBondContact O-N 2.89Å; I31-I33 PolarHBondContact O-N 3.19Å; I33-H35 PolarHBondContact O-N 3.21Å; I33-K36 PolarHBondContact O-N 2.76Å; I33-K36 VanDerWaalsContact O-N 3.13Å; I33-Q37 HydrophobicContact CG2-CG 4.32Å; I33-Q37 WeakPolarHBondContact O-CB 3.46Å; I33-Q37 WeakPolarHBondContact O-CG 3.4Å; I33-Q37 PolarHBondContact O-N 3.19Å
34	L	63.6	Low	62.8	Low	63 Å²	63	84.7 Å²	84.7	33%	0.33	40%	0.404	S	S	.	.	H	α-helix	trans	-56.6	-43.4	170.1	-75.1	166.9	0	0	0	110	A30 I31 K36 Q37 C38 I44	A30-L34 WeakPolarHBondContact O-CG 3.45Å; A30-L34 PolarHBondContact O-N 2.94Å; I31-L34 CarbonylContact O-C 3.58Å; I31-L34 PolarHBondContact O-N 3.44Å; L34-K36 VanDerWaalsContact C-N 3.33Å; L34-K36 PolarHBondContact O-N 3.27Å; L34-Q37 PolarHBondContact O-N 3.07Å; L34-C38 WeakPolarHBondContact O-CA 3.45Å; L34-C38 WeakPolarHBondContact O-CB 3.38Å; L34-C38 PolarHBondContact O-N 2.7Å; L34-I44 HydrophobicContact CB-CD1 3.63Å; L34-I44 HydrophobicContact CB-CG1 4.09Å; L34-I44 HydrophobicContact CB-CG2 4.44Å; L34-I44 HydrophobicContact CD1-CG2 4.08Å
35	H	64.1	Low	63.2	Low	98 Å²	98	77.4 Å²	77.4	45%	0.454	37%	0.37	S	S	.	.	H	α-helix	trans	-64.5	-35.4	176.6	-126.9	-77.6	0	0	0	113.1	I31 I33	I31-H35 WeakPolarHBondContact O-CB 3.43Å; I31-H35 PolarHBondContact O-N 2.96Å; I33-H35 PolarHBondContact O-N 3.21Å
36	K	65.9	Low	63.5	Low	178 Å²	178	77 Å²	77	77%	0.774	37%	0.368	S	S	*	.	H	α-helix	trans	-72.6	-34.3	175.6	-77.7	177.3	-178.1	-179.9	0	112.6	S32 I33 L34	S32-K36 WeakPolarHBondContact O-CG 3.47Å; S32-K36 PolarHBondContact O-N 3.45Å; I33-K36 PolarHBondContact O-N 2.76Å; I33-K36 VanDerWaalsContact O-N 3.13Å; L34-K36 VanDerWaalsContact C-N 3.33Å; L34-K36 PolarHBondContact O-N 3.27Å
37	Q	62	Low	64	Low	103 Å²	103	78.3 Å²	78.3	48%	0.481	38%	0.381	S	S	.	.	H	α-helix	trans	-92.1	-42.6	-175.3	-71.2	-170.9	-26.3	0	0	113.2	T11 I33 L34	T11-Q37 PolarHBondContact OG1-NE2 3.49Å; T11-Q37 PolarHBondContact OG1-OE1 2.91Å; I33-Q37 HydrophobicContact CG2-CG 4.32Å; I33-Q37 WeakPolarHBondContact O-CB 3.46Å; I33-Q37 WeakPolarHBondContact O-CG 3.4Å; I33-Q37 PolarHBondContact O-N 3.19Å; L34-Q37 PolarHBondContact O-N 3.07Å
38	C	56.7	Low	64.2	Low	42 Å²	42	79.2 Å²	79.2	28%	0.284	38%	0.384	S	S	.	.			trans	-86.1	111.7	175	-61	0	0	0	0	108.2	L34 R40 I44	L34-C38 WeakPolarHBondContact O-CA 3.45Å; L34-C38 WeakPolarHBondContact O-CB 3.38Å; L34-C38 PolarHBondContact O-N 2.7Å; C38-R40 PolarHBondContact O-N 3.03Å; C38-I44 HydrophobicContact CB-CD1 3.88Å; C38-I44 HydrophobicContact CB-CG1 3.78Å
39	R	60.7	Low	64.4	Low	246 Å²	246	77 Å²	77	93%	0.928	37%	0.368	S	S	*	.	S	Bend	trans	-61.1	-12.8	177.1	-73	-172	175.5	-177.6	-0.7	113.6
40	R	63.8	Low	64.5	Low	169 Å²	169	77 Å²	77	64%	0.638	38%	0.376	S	S	*	.			trans	-127.9	110.3	-174.2	-67.1	-176.5	169.2	-161.9	-3.7	110.1	C38 Y42 D43	C38-R40 PolarHBondContact O-N 3.03Å; R40-Y42 PolarHBondContact O-N 2.88Å; R40-D43 HydrophobicContact CB-CB 4.45Å; R40-D43 WeakPolarHBondContact CB-OD2 3.31Å; R40-D43 PolarHBondContact O-N 3.14Å
41	P	62.9	Low	64.4	Low	58 Å²	58	79.9 Å²	79.9	38%	0.377	39%	0.386	S	S	.	.	H	α-helix	trans	-59.9	-23.6	174.3	19	-29.1	0	0	0	113.5	T45	P41-T45 PolarHBondContact O-N 3.26Å; P41-T45 PolarHBondContact O-OG1 3.43Å
42	Y	65.5	Low	64.2	Low	155 Å²	155	80.1 Å²	80.1	61%	0.608	39%	0.388	S	S	*	.	H	α-helix	trans	-60.6	-47.4	175.3	-170.3	-91.8	0	0	0	112	R40 I44 T45 E46	R40-Y42 PolarHBondContact O-N 2.88Å; Y42-I44 VanDerWaalsContact C-N 3.29Å; Y42-I44 PolarHBondContact O-N 2.86Å; Y42-T45 WeakPolarHBondContact O-CB 3.4Å; Y42-T45 PolarHBondContact O-N 3.4Å; Y42-E46 PolarHBondContact O-N 3Å
43	D	66.2	Low	64.1	Low	76 Å²	76	84.3 Å²	84.3	41%	0.406	40%	0.402	S	S	.	.	H	α-helix	trans	-62.3	-36.8	-177.2	-55.2	-6	0	0	0	111.7	R40 E46 A47	R40-D43 HydrophobicContact CB-CB 4.45Å; R40-D43 WeakPolarHBondContact CB-OD2 3.31Å; R40-D43 PolarHBondContact O-N 3.14Å; D43-E46 PolarHBondContact O-N 3.19Å; D43-A47 WeakPolarHBondContact O-CB 3.32Å; D43-A47 PolarHBondContact O-N 3.4Å
44	I	66.6	Low	63.7	Low	9 Å²	9	84.9 Å²	84.9	5%	0.046	41%	0.411	C	S	.	.	H	α-helix	trans	-64.4	-45.4	174.9	-60.3	162.3	0	0	0	110.2	L34 C38 Y42 E46 A47 L48 M82	L34-I44 HydrophobicContact CB-CD1 3.63Å; L34-I44 HydrophobicContact CB-CG1 4.09Å; L34-I44 HydrophobicContact CB-CG2 4.44Å; L34-I44 HydrophobicContact CD1-CG2 4.08Å; C38-I44 HydrophobicContact CB-CD1 3.88Å; C38-I44 HydrophobicContact CB-CG1 3.78Å; Y42-I44 VanDerWaalsContact C-N 3.29Å; Y42-I44 PolarHBondContact O-N 2.86Å; I44-E46 VanDerWaalsContact C-N 3.33Å; I44-A47 PolarHBondContact O-N 2.72Å; I44-L48 HydrophobicContact CG2-CD1 4.12Å; I44-L48 WeakPolarHBondContact O-CG 3.4Å; I44-L48 PolarHBondContact O-N 3.47Å; I44-M82 HydrophobicContact CB-CE 4.5Å; I44-M82 HydrophobicContact CG2-CE 4.21Å; I44-M82 HydrophobicContact CG2-SD 4.23Å
45	T	65.6	Low	63.7	Low	2 Å²	2	85.9 Å²	85.9	1%	0.012	42%	0.422	C	S	.	.	H	α-helix	trans	-63.5	-44.4	179.7	-45.9	0	0	0	0	110	P41 Y42 A47 L48 L49 L79 R84	P41-T45 PolarHBondContact O-N 3.26Å; P41-T45 PolarHBondContact O-OG1 3.43Å; Y42-T45 WeakPolarHBondContact O-CB 3.4Å; Y42-T45 PolarHBondContact O-N 3.4Å; T45-A47 VanDerWaalsContact C-N 3.34Å; T45-A47 PolarHBondContact O-N 2.85Å; T45-L48 WeakPolarHBondContact O-CB 3.39Å; T45-L48 PolarHBondContact O-N 3.13Å; T45-L48 VanDerWaalsContact O-N 3.16Å; T45-L49 HydrophobicContact CG2-CD1 3.95Å; T45-L49 HydrophobicContact CG2-CG 4.2Å; T45-L49 WeakPolarHBondContact O-CG 3.19Å; T45-L49 PolarHBondContact O-N 3.28Å; T45-L79 HydrophobicContact CG2-CD2 4.09Å; T45-R84 PolarHBondContact OG1-NH1 3.17Å
46	E	67.3	Low	63.6	Low	102 Å²	102	87.5 Å²	87.5	48%	0.477	44%	0.444	S	S	.	.	H	α-helix	trans	-62.4	-40.6	179.4	-150.6	-157.1	146.9	0	0	112.2	Y42 D43 I44 L48 L49 T50	Y42-E46 PolarHBondContact O-N 3Å; D43-E46 PolarHBondContact O-N 3.19Å; I44-E46 VanDerWaalsContact C-N 3.33Å; E46-L48 VanDerWaalsContact C-N 3.34Å; E46-L48 PolarHBondContact O-N 3.02Å; E46-L49 PolarHBondContact O-N 3.43Å; E46-T50 WeakPolarHBondContact O-CB 3.41Å; E46-T50 PolarHBondContact O-N 2.99Å; E46-T50 PolarHBondContact O-OG1 2.99Å
47	A	65	Low	63.6	Low	56 Å²	56	81.7 Å²	81.7	46%	0.463	42%	0.421	S	S	.	.	H	α-helix	trans	-62.3	-41.1	174.3	0	0	0	0	0	112.1	D43 I44 T45 T50 L51	D43-A47 WeakPolarHBondContact O-CB 3.32Å; D43-A47 PolarHBondContact O-N 3.4Å; I44-A47 PolarHBondContact O-N 2.72Å; T45-A47 VanDerWaalsContact C-N 3.34Å; T45-A47 PolarHBondContact O-N 2.85Å; A47-T50 PolarHBondContact O-N 3.29Å; A47-L51 PolarHBondContact O-N 3.25Å; A47-L51 VanDerWaalsContact O-N 3.12Å
48	L	64	Low	63.7	Low	26 Å²	26	84.4 Å²	84.4	14%	0.136	43%	0.433	C	S	.	.	H	α-helix	trans	-64.9	-41.8	174.6	-76.3	171.7	0	0	0	112.1	I44 T45 E46 L51 L52 C75 L79 M82	I44-L48 HydrophobicContact CG2-CD1 4.12Å; I44-L48 WeakPolarHBondContact O-CG 3.4Å; I44-L48 PolarHBondContact O-N 3.47Å; T45-L48 WeakPolarHBondContact O-CB 3.39Å; T45-L48 PolarHBondContact O-N 3.13Å; T45-L48 VanDerWaalsContact O-N 3.16Å; E46-L48 VanDerWaalsContact C-N 3.34Å; E46-L48 PolarHBondContact O-N 3.02Å; L48-L51 VanDerWaalsContact O-CB 3.25Å; L48-L51 WeakPolarHBondContact O-CB 3.36Å; L48-L51 PolarHBondContact O-N 3.12Å; L48-L52 PolarHBondContact O-N 3.37Å; L48-C75 HydrophobicContact CD2-CB 4.48Å; L48-C75 PolarHBondContact O-SG 2.82Å; L48-L79 HydrophobicContact CD1-CD2 4.31Å; L48-M82 HydrophobicContact CD1-SD 3.88Å
49	L	66.6	Low	64.2	Low	38 Å²	38	91.5 Å²	91.5	20%	0.199	46%	0.462	C	S	.	.	H	α-helix	trans	-65.4	-38.5	176.1	-65.7	168.5	0	0	0	111.6	T45 E46 L51 L52 H53 D87 F91	T45-L49 HydrophobicContact CG2-CD1 3.95Å; T45-L49 HydrophobicContact CG2-CG 4.2Å; T45-L49 WeakPolarHBondContact O-CG 3.19Å; T45-L49 PolarHBondContact O-N 3.28Å; E46-L49 PolarHBondContact O-N 3.43Å; L49-L51 VanDerWaalsContact C-N 3.26Å; L49-L51 PolarHBondContact O-N 3.39Å; L49-L52 HydrophobicContact CD2-CD1 4.34Å; L49-L52 WeakPolarHBondContact O-CA 3.41Å; L49-L52 WeakPolarHBondContact O-CB 3.44Å; L49-L52 PolarHBondContact O-N 3.39Å; L49-H53 PolarHBondContact O-N 3.07Å; L49-D87 HydrophobicContact CD2-CB 4.23Å; L49-F91 HydrophobicContact CB-CZ 4.4Å; L49-F91 HydrophobicContact CD2-CE2 3.35Å; L49-F91 HydrophobicContact CD2-CZ 3.43Å; L49-F91 VanDerWaalsContact CD2-CZ 3.43Å; L49-F91 HydrophobicContact CG-CZ 4.46Å
50	T	65.8	Low	64.8	Low	83 Å²	83	86.4 Å²	86.4	51%	0.509	45%	0.453	S	S	.	.	H	α-helix	trans	-62.9	-36.7	175.1	-54.7	0	0	0	0	111.4	E46 A47 L52 H53 G54	E46-T50 WeakPolarHBondContact O-CB 3.41Å; E46-T50 PolarHBondContact O-N 2.99Å; E46-T50 PolarHBondContact O-OG1 2.99Å; A47-T50 PolarHBondContact O-N 3.29Å; T50-L52 VanDerWaalsContact C-N 3.27Å; T50-L52 PolarHBondContact O-N 2.78Å; T50-H53 PolarHBondContact O-N 3.07Å; T50-G54 PolarHBondContact O-N 3.1Å
51	L	62.4	Low	65.2	Low	90 Å²	90	81.2 Å²	81.2	47%	0.471	44%	0.438	S	S	.	.	H	α-helix	trans	-63.1	-31.8	171.8	-110.9	139.4	0	0	0	112.9	A47 L48 L49 P71	A47-L51 PolarHBondContact O-N 3.25Å; A47-L51 VanDerWaalsContact O-N 3.12Å; L48-L51 VanDerWaalsContact O-CB 3.25Å; L48-L51 WeakPolarHBondContact O-CB 3.36Å; L48-L51 PolarHBondContact O-N 3.12Å; L49-L51 VanDerWaalsContact C-N 3.26Å; L49-L51 PolarHBondContact O-N 3.39Å; L51-P71 HydrophobicContact CD2-CB 3.68Å
52	L	61.6	Low	65.8	Low	26 Å²	26	83 Å²	83	14%	0.136	45%	0.448	C	S	.	.	H	α-helix	trans	-76.1	-36.3	175.5	-74.8	164.9	0	0	0	113	L48 L49 T50 G54 M72 C75 L79 L88 F91	L48-L52 PolarHBondContact O-N 3.37Å; L49-L52 HydrophobicContact CD2-CD1 4.34Å; L49-L52 WeakPolarHBondContact O-CA 3.41Å; L49-L52 WeakPolarHBondContact O-CB 3.44Å; L49-L52 PolarHBondContact O-N 3.39Å; T50-L52 VanDerWaalsContact C-N 3.27Å; T50-L52 PolarHBondContact O-N 2.78Å; L52-G54 PolarHBondContact O-N 2.85Å; L52-M72 HydrophobicContact CD2-CE 4.38Å; L52-M72 HydrophobicContact CD2-CG 4.38Å; L52-C75 HydrophobicContact CD2-CB 4.17Å; L52-C75 HydrophobicContact CG-CB 4.18Å; L52-C75 VanDerWaalsContact CG-SG 3.6Å; L52-L79 HydrophobicContact CD1-CD1 3.78Å; L52-L88 HydrophobicContact CD1-CD2 4.42Å; L52-F91 HydrophobicContact CB-CZ 4.49Å; L52-F91 HydrophobicContact CD1-CD2 4.15Å; L52-F91 HydrophobicContact CD1-CE2 3.87Å; L52-F91 HydrophobicContact CD1-CZ 4.37Å
53	H	62.1	Low	66.3	Low	136 Å²	136	77.8 Å²	77.8	63%	0.63	44%	0.437	S	S	*	.	H	α-helix	trans	-60.1	-30.3	172.1	-68.1	149.2	0	0	0	111.6	L49 T50 F91	L49-H53 PolarHBondContact O-N 3.07Å; T50-H53 PolarHBondContact O-N 3.07Å; H53-F91 AromaticContact CD2-CE1 3.65Å; H53-F91 AromaticContact NE2-CE1 3.46Å; H53-F91 WeakPolarHBondContact NE2-CE1 3.47Å
54	G	60.2	Low	66.6	Low	27 Å²	27	74.4 Å²	74.4	28%	0.278	42%	0.42	S	S	.	.			trans	66.4	166.7	174	0	0	0	0	0	113.2	T50 L52	T50-G54 PolarHBondContact O-N 3.1Å; L52-G54 PolarHBondContact O-N 2.85Å
55	P	63.2	Low	66.7	Low	84 Å²	84	79.1 Å²	79.1	55%	0.545	45%	0.445	S	S	.	.	S	Bend	trans	-67.5	147.7	166.8	29.4	-31	0	0	0	109.9	L57 L68	P55-L57 PolarHBondContact O-N 3.24Å; P55-L57 VanDerWaalsContact O-N 3.09Å; P55-L68 HydrophobicContact CG-CD2 4.2Å
56	S	62.5	Low	67	Low	132 Å²	132	85.2 Å²	85.2	92%	0.923	47%	0.473	S	S	*	.	P	Polyproline II helix	trans	-57.1	116.2	171.3	-173	0	0	0	0	109.3
57	L	65.3	Low	67.4	Low	55 Å²	55	89.3 Å²	89.3	29%	0.288	48%	0.484	S	S	.	.	P	Polyproline II helix	trans	-103.3	141.5	177	-68.8	-178.6	0	0	0	109.7	P55 L65 L68	P55-L57 PolarHBondContact O-N 3.24Å; P55-L57 VanDerWaalsContact O-N 3.09Å; L57-L65 HydrophobicContact CD1-CB 4.41Å; L57-L65 HydrophobicContact CD1-CD1 4.43Å; L57-L68 HydrophobicContact CD1-CD1 3.44Å; L57-L68 VanDerWaalsContact CD1-CD1 3.44Å; L57-L68 HydrophobicContact CD1-CG 4.25Å; L57-L68 HydrophobicContact CG-CD1 4.18Å
58	H	63.7	Low	67.6	Low	160 Å²	160	88.2 Å²	88.2	74%	0.741	47%	0.47	S	S	*	.	P	Polyproline II helix	trans	-68.7	147.6	168.6	-122.5	-92.4	0	0	0	109.6	D60 D61	H58-D60 PolarHBondContact O-N 3.43Å; H58-D61 HydrophobicContact CB-CB 4.31Å; H58-D61 WeakPolarHBondContact O-CB 3.35Å; H58-D61 PolarHBondContact O-N 3.03Å
59	Q	67.6	Low	67.9	Low	191 Å²	191	91.3 Å²	91.3	89%	0.893	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-27.8	-174.3	-166.5	172.1	-7	0	0	113.6
60	D	72.3	Confident	68.3	Low	139 Å²	139	96.8 Å²	96.8	74%	0.743	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100	5.6	179.9	-54.4	-48.1	0	0	0	113.7	H58 V62	H58-D60 PolarHBondContact O-N 3.43Å; D60-V62 PolarHBondContact O-N 3.1Å
61	D	72.3	Confident	68.6	Low	61 Å²	61	94.7 Å²	94.7	33%	0.326	50%	0.496	S	S	.	.			trans	-81.5	67.9	-179.3	-168.5	6.4	0	0	0	111.8	H58 A63 G64 L65	H58-D61 HydrophobicContact CB-CB 4.31Å; H58-D61 WeakPolarHBondContact O-CB 3.35Å; H58-D61 PolarHBondContact O-N 3.03Å; D61-A63 PolarHBondContact O-N 2.02Å; D61-G64 PolarHBondContact O-N 3.21Å; D61-G64 VanDerWaalsContact O-N 3.14Å; D61-G64 PolarHBondContact OD1-N 2.9Å; D61-L65 PolarHBondContact O-N 3.03Å
62	V	75.5	Confident	69	Low	94 Å²	94	94.9 Å²	94.9	57%	0.57	50%	0.496	S	S	*	.	H	α-helix	trans	-57	-36.4	175.7	179.9	0	0	0	0	111	D60 L65 Q66	D60-V62 PolarHBondContact O-N 3.1Å; V62-L65 PolarHBondContact O-N 3.38Å; V62-Q66 WeakPolarHBondContact O-CB 3.25Å; V62-Q66 WeakPolarHBondContact O-CG 3.42Å; V62-Q66 PolarHBondContact O-N 3.18Å
63	A	76.3	Confident	69.6	Low	46 Å²	46	97.5 Å²	97.5	38%	0.38	51%	0.509	S	S	.	.	H	α-helix	trans	-67.3	-42.1	178.1	0	0	0	0	0	111.3	D61 Q66 R67	D61-A63 PolarHBondContact O-N 2.02Å; A63-Q66 PolarHBondContact O-N 3.41Å; A63-R67 VanDerWaalsContact O-CG 3.25Å; A63-R67 WeakPolarHBondContact O-CG 3.46Å; A63-R67 PolarHBondContact O-N 3.33Å
64	G	72.7	Confident	70.1	Confident	5 Å²	5	94.3 Å²	94.3	5%	0.052	50%	0.497	C	S	.	.	H	α-helix	trans	-59.3	-45.9	171.9	0	0	0	0	0	112	D61 Q66 R67 L68	D61-G64 PolarHBondContact O-N 3.21Å; D61-G64 VanDerWaalsContact O-N 3.14Å; D61-G64 PolarHBondContact OD1-N 2.9Å; G64-Q66 PolarHBondContact O-N 2.77Å; G64-R67 WeakPolarHBondContact O-CB 3.46Å; G64-R67 PolarHBondContact O-N 3.48Å; G64-L68 PolarHBondContact O-N 3.27Å
65	L	68.7	Low	70.6	Confident	108 Å²	108	93.2 Å²	93.2	57%	0.565	49%	0.485	S	S	*	.	H	α-helix	trans	-62.1	-46	177.7	-166.4	75	0	0	0	111.6	L57 D61 V62 R67 L68 I69	L57-L65 HydrophobicContact CD1-CB 4.41Å; L57-L65 HydrophobicContact CD1-CD1 4.43Å; D61-L65 PolarHBondContact O-N 3.03Å; V62-L65 PolarHBondContact O-N 3.38Å; L65-R67 VanDerWaalsContact C-N 3.26Å; L65-R67 PolarHBondContact O-N 3.32Å; L65-L68 PolarHBondContact O-N 2.9Å; L65-I69 PolarHBondContact O-N 3.41Å
66	Q	72.3	Confident	70.9	Confident	130 Å²	130	95.2 Å²	95.2	61%	0.607	49%	0.485	S	S	*	.	H	α-helix	trans	-60.1	-36.2	176.2	-76.6	-177.3	-9.2	0	0	112.5	V62 A63 G64 L68 I69	V62-Q66 WeakPolarHBondContact O-CB 3.25Å; V62-Q66 WeakPolarHBondContact O-CG 3.42Å; V62-Q66 PolarHBondContact O-N 3.18Å; A63-Q66 PolarHBondContact O-N 3.41Å; G64-Q66 PolarHBondContact O-N 2.77Å; Q66-L68 VanDerWaalsContact C-N 3.27Å; Q66-L68 PolarHBondContact O-N 2.93Å; Q66-I69 PolarHBondContact O-N 2.91Å
67	R	74.4	Confident	71.5	Confident	189 Å²	189	90.8 Å²	90.8	71%	0.713	45%	0.45	S	S	*	.	H	α-helix	trans	-66.9	-27.6	175.1	-70.9	170	-164.1	172.9	6.3	112.7	A63 G64 L65 P71	A63-R67 VanDerWaalsContact O-CG 3.25Å; A63-R67 WeakPolarHBondContact O-CG 3.46Å; A63-R67 PolarHBondContact O-N 3.33Å; G64-R67 WeakPolarHBondContact O-CB 3.46Å; G64-R67 PolarHBondContact O-N 3.48Å; L65-R67 VanDerWaalsContact C-N 3.26Å; L65-R67 PolarHBondContact O-N 3.32Å; R67-P71 WeakPolarHBondContact O-CD 3Å
68	L	69.2	Low	72	Confident	33 Å²	33	89.4 Å²	89.4	17%	0.173	45%	0.445	C	S	.	.	H	α-helix	trans	-81.4	-23	179.1	-69.8	-177.1	0	0	0	114.5	P55 L57 G64 L65 Q66 K70 P71 M72	P55-L68 HydrophobicContact CG-CD2 4.2Å; L57-L68 HydrophobicContact CD1-CD1 3.44Å; L57-L68 VanDerWaalsContact CD1-CD1 3.44Å; L57-L68 HydrophobicContact CD1-CG 4.25Å; L57-L68 HydrophobicContact CG-CD1 4.18Å; G64-L68 PolarHBondContact O-N 3.27Å; L65-L68 PolarHBondContact O-N 2.9Å; Q66-L68 VanDerWaalsContact C-N 3.27Å; Q66-L68 PolarHBondContact O-N 2.93Å; L68-K70 VanDerWaalsContact C-N 3.29Å; L68-K70 PolarHBondContact O-N 3.38Å; L68-P71 VanDerWaalsContact O-CD 3.23Å; L68-P71 WeakPolarHBondContact O-CD 2.81Å; L68-M72 WeakPolarHBondContact O-CB 3.23Å; L68-M72 WeakPolarHBondContact O-CG 3.44Å; L68-M72 PolarHBondContact O-N 3.29Å
69	I	71	Confident	72.3	Confident	91 Å²	91	81.8 Å²	81.8	47%	0.467	41%	0.41	S	S	.	.	H	α-helix	trans	-52.7	-48.6	-179.6	-67.3	173.2	0	0	0	111.2	L65 Q66 M72 I73	L65-I69 PolarHBondContact O-N 3.41Å; Q66-I69 PolarHBondContact O-N 2.91Å; I69-M72 PolarHBondContact O-N 2.69Å; I69-I73 HydrophobicContact CG2-CD1 3.63Å; I69-I73 HydrophobicContact CG2-CG1 4.37Å; I69-I73 VanDerWaalsContact O-CG1 3.27Å; I69-I73 WeakPolarHBondContact O-CG1 3.27Å; I69-I73 PolarHBondContact O-N 2.78Å
70	K	75.6	Confident	72.6	Confident	152 Å²	152	75.7 Å²	75.7	66%	0.661	39%	0.388	S	S	*	.	H	α-helix	trans	-65.2	-50.4	-177.7	-178.8	173	-171.3	166.9	0	112.7	L68 M72 I73 N74	L68-K70 VanDerWaalsContact C-N 3.29Å; L68-K70 PolarHBondContact O-N 3.38Å; K70-M72 VanDerWaalsContact C-N 3.33Å; K70-M72 PolarHBondContact O-N 2.71Å; K70-I73 PolarHBondContact O-N 3.08Å; K70-N74 VanDerWaalsContact O-CG 3.26Å; K70-N74 PolarHBondContact O-N 3.12Å; K70-N74 PolarHBondContact O-OD1 3.16Å
71	P	72	Confident	72.5	Confident	40 Å²	40	71.5 Å²	71.5	26%	0.26	36%	0.364	S	S	.	.	H	α-helix	trans	-53.6	-43.3	170.1	-26.5	30.6	0	0	0	114.3	L51 R67 L68 N74 C75	L51-P71 HydrophobicContact CD2-CB 3.68Å; R67-P71 WeakPolarHBondContact O-CD 3Å; L68-P71 VanDerWaalsContact O-CD 3.23Å; L68-P71 WeakPolarHBondContact O-CD 2.81Å; P71-N74 PolarHBondContact O-N 3.42Å; P71-C75 WeakPolarHBondContact O-CB 3.46Å; P71-C75 PolarHBondContact O-N 3.26Å
72	M	69.9	Low	72.6	Confident	93 Å²	93	70.2 Å²	70.2	46%	0.458	36%	0.357	S	S	.	.	H	α-helix	trans	-65.2	-43.3	179.6	-73.7	-176.2	79.3	0	0	112.2	L52 L68 I69 K70 C75 K76	L52-M72 HydrophobicContact CD2-CE 4.38Å; L52-M72 HydrophobicContact CD2-CG 4.38Å; L68-M72 WeakPolarHBondContact O-CB 3.23Å; L68-M72 WeakPolarHBondContact O-CG 3.44Å; L68-M72 PolarHBondContact O-N 3.29Å; I69-M72 PolarHBondContact O-N 2.69Å; K70-M72 VanDerWaalsContact C-N 3.33Å; K70-M72 PolarHBondContact O-N 2.71Å; M72-C75 PolarHBondContact O-N 3.1Å; M72-K76 WeakPolarHBondContact O-CB 3.45Å; M72-K76 PolarHBondContact O-N 3.32Å
73	I	73.9	Confident	72.4	Confident	81 Å²	81	74.4 Å²	74.4	42%	0.415	37%	0.37	S	S	.	.	H	α-helix	trans	-60	-48.5	175	-69.9	168.5	0	0	0	110.1	I69 K70 C75 K76 I77	I69-I73 HydrophobicContact CG2-CD1 3.63Å; I69-I73 HydrophobicContact CG2-CG1 4.37Å; I69-I73 VanDerWaalsContact O-CG1 3.27Å; I69-I73 WeakPolarHBondContact O-CG1 3.27Å; I69-I73 PolarHBondContact O-N 2.78Å; K70-I73 PolarHBondContact O-N 3.08Å; I73-C75 VanDerWaalsContact C-N 3.27Å; I73-C75 PolarHBondContact O-N 2.79Å; I73-K76 WeakPolarHBondContact O-CB 3.2Å; I73-K76 PolarHBondContact O-N 3.25Å; I73-I77 HydrophobicContact CG2-CD1 3.83Å; I73-I77 HydrophobicContact CG2-CG1 4.49Å; I73-I77 WeakPolarHBondContact O-CG1 3.19Å; I73-I77 PolarHBondContact O-N 3.43Å
74	N	74.3	Confident	72	Confident	70 Å²	70	75.9 Å²	75.9	37%	0.374	37%	0.366	S	S	.	.	H	α-helix	trans	-59.9	-39	178.1	-69.7	-2.2	0	0	0	112	K70 P71 S78	K70-N74 VanDerWaalsContact O-CG 3.26Å; K70-N74 PolarHBondContact O-N 3.12Å; K70-N74 PolarHBondContact O-OD1 3.16Å; P71-N74 PolarHBondContact O-N 3.42Å; N74-S78 WeakPolarHBondContact O-CB 3.37Å; N74-S78 PolarHBondContact O-N 3.39Å; N74-S78 PolarHBondContact O-OG 3.28Å
75	C	69.7	Low	71.5	Confident	3 Å²	3	77.1 Å²	77.1	2%	0.02	38%	0.379	C	S	.	.	H	α-helix	trans	-67.4	-43.8	177.4	-167.2	0	0	0	0	111.3	L48 L52 P71 M72 I73 I77 S78 L79	L48-C75 HydrophobicContact CD2-CB 4.48Å; L48-C75 PolarHBondContact O-SG 2.82Å; L52-C75 HydrophobicContact CD2-CB 4.17Å; L52-C75 HydrophobicContact CG-CB 4.18Å; L52-C75 VanDerWaalsContact CG-SG 3.6Å; P71-C75 WeakPolarHBondContact O-CB 3.46Å; P71-C75 PolarHBondContact O-N 3.26Å; M72-C75 PolarHBondContact O-N 3.1Å; I73-C75 VanDerWaalsContact C-N 3.27Å; I73-C75 PolarHBondContact O-N 2.79Å; C75-I77 PolarHBondContact O-N 3.32Å; C75-S78 PolarHBondContact O-N 2.85Å; C75-L79 WeakPolarHBondContact O-CB 3.23Å; C75-L79 WeakPolarHBondContact O-CG 3.49Å; C75-L79 PolarHBondContact O-N 3.05Å
76	K	69.1	Low	71.4	Confident	126 Å²	126	75.5 Å²	75.5	55%	0.548	38%	0.376	S	S	.	.	H	α-helix	trans	-57.9	-46.4	174.9	-177.4	-174.1	177	-174.9	0	112	M72 I73 S80 L88	M72-K76 WeakPolarHBondContact O-CB 3.45Å; M72-K76 PolarHBondContact O-N 3.32Å; I73-K76 WeakPolarHBondContact O-CB 3.2Å; I73-K76 PolarHBondContact O-N 3.25Å; K76-S80 WeakPolarHBondContact O-CB 3.5Å; K76-S80 PolarHBondContact O-N 3.29Å; K76-S80 PolarHBondContact O-OG 3.28Å; K76-L88 HydrophobicContact CB-CD1 4.41Å; K76-L88 HydrophobicContact CB-CD2 4.23Å; K76-L88 HydrophobicContact CG-CD1 3.82Å; K76-L88 HydrophobicContact CG-CD2 4.26Å
77	I	75.9	Confident	70.9	Confident	40 Å²	40	70.8 Å²	70.8	21%	0.205	36%	0.355	C	S	.	.	H	α-helix	trans	-61.9	-48.9	177.5	-66.4	168.2	0	0	0	109.7	E23 I73 C75 L79 S80 Q81	E23-I77 HydrophobicContact CG-CD1 4.01Å; I73-I77 HydrophobicContact CG2-CD1 3.83Å; I73-I77 HydrophobicContact CG2-CG1 4.49Å; I73-I77 WeakPolarHBondContact O-CG1 3.19Å; I73-I77 PolarHBondContact O-N 3.43Å; C75-I77 PolarHBondContact O-N 3.32Å; I77-L79 PolarHBondContact O-N 2.85Å; I77-S80 PolarHBondContact O-N 2.85Å; I77-Q81 WeakPolarHBondContact O-CG 3.35Å; I77-Q81 PolarHBondContact O-N 3.25Å
78	S	74.9	Confident	70	Confident	25 Å²	25	63.4 Å²	63.4	18%	0.175	33%	0.33	C	S	.	.	H	α-helix	trans	-59.1	-47.8	179.8	-58.4	0	0	0	0	112.4	I31 N74 C75 S80 Q81 M82	I31-S78 WeakPolarHBondContact CD1-O 3.36Å; N74-S78 WeakPolarHBondContact O-CB 3.37Å; N74-S78 PolarHBondContact O-N 3.39Å; N74-S78 PolarHBondContact O-OG 3.28Å; C75-S78 PolarHBondContact O-N 2.85Å; S78-S80 VanDerWaalsContact C-N 3.31Å; S78-S80 PolarHBondContact O-N 3.04Å; S78-Q81 PolarHBondContact O-N 3.42Å; S78-M82 WeakPolarHBondContact O-CG 3.48Å; S78-M82 PolarHBondContact O-N 3.16Å
79	L	70.7	Confident	69.3	Low	0 Å²	0	69.5 Å²	69.5	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-64.4	-35.4	178.5	-73.5	173.1	0	0	0	112.4	T45 L48 L52 C75 I77 M82 E83 R84 G85 L88	T45-L79 HydrophobicContact CG2-CD2 4.09Å; L48-L79 HydrophobicContact CD1-CD2 4.31Å; L52-L79 HydrophobicContact CD1-CD1 3.78Å; C75-L79 WeakPolarHBondContact O-CB 3.23Å; C75-L79 WeakPolarHBondContact O-CG 3.49Å; C75-L79 PolarHBondContact O-N 3.05Å; I77-L79 PolarHBondContact O-N 2.85Å; L79-M82 PolarHBondContact O-N 3.33Å; L79-E83 PolarHBondContact O-N 3.49Å; L79-R84 HydrophobicContact CD2-CB 4.14Å; L79-R84 CarbonylContact O-C 3.43Å; L79-R84 WeakPolarHBondContact O-CA 3.36Å; L79-R84 PolarHBondContact O-N 3.11Å; L79-G85 PolarHBondContact O-N 3.48Å; L79-L88 HydrophobicContact CB-CD1 4.32Å; L79-L88 HydrophobicContact CD1-CD2 4.22Å; L79-L88 HydrophobicContact CD1-CG 4Å
80	S	73.1	Confident	68.1	Low	63 Å²	63	69.7 Å²	69.7	44%	0.441	36%	0.363	S	S	.	.	H	α-helix	trans	-65.9	-41.8	176.2	-56.4	0	0	0	0	111.3	K76 I77 S78 M82 E83	K76-S80 WeakPolarHBondContact O-CB 3.5Å; K76-S80 PolarHBondContact O-N 3.29Å; K76-S80 PolarHBondContact O-OG 3.28Å; I77-S80 PolarHBondContact O-N 2.85Å; S78-S80 VanDerWaalsContact C-N 3.31Å; S78-S80 PolarHBondContact O-N 3.04Å; S80-M82 VanDerWaalsContact C-N 3.3Å; S80-M82 PolarHBondContact O-N 3.47Å; S80-E83 PolarHBondContact O-N 3.37Å; S80-E83 VanDerWaalsContact O-N 3.08Å
81	Q	71.8	Confident	66.5	Low	52 Å²	52	65.4 Å²	65.4	24%	0.243	35%	0.345	C	S	.	.	H	α-helix	trans	-70.9	-24.4	176.8	-70.8	173.6	-11.4	0	0	113.4	E24 G27 I31 I77 S78 E83	E24-Q81 PolarHBondContact O-NE2 3.28Å; G27-Q81 PolarHBondContact O-OE1 2.91Å; I31-Q81 HydrophobicContact CD1-CB 3.42Å; I31-Q81 VanDerWaalsContact CD1-CB 3.42Å; I31-Q81 HydrophobicContact CD1-CG 4.48Å; I77-Q81 WeakPolarHBondContact O-CG 3.35Å; I77-Q81 PolarHBondContact O-N 3.25Å; S78-Q81 PolarHBondContact O-N 3.42Å; Q81-E83 PolarHBondContact O-N 2.94Å
82	M	73	Confident	65	Low	33 Å²	33	70 Å²	70	16%	0.163	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81	4.2	170.5	-66.8	-179.3	74.6	0	0	113	I31 I44 L48 S78 L79 S80 R84	I31-M82 HydrophobicContact CD1-CG 3.78Å; I31-M82 HydrophobicContact CG1-CG 4.15Å; I31-M82 HydrophobicContact CG2-CG 3.97Å; I44-M82 HydrophobicContact CB-CE 4.5Å; I44-M82 HydrophobicContact CG2-CE 4.21Å; I44-M82 HydrophobicContact CG2-SD 4.23Å; L48-M82 HydrophobicContact CD1-SD 3.88Å; S78-M82 WeakPolarHBondContact O-CG 3.48Å; S78-M82 PolarHBondContact O-N 3.16Å; L79-M82 PolarHBondContact O-N 3.33Å; S80-M82 VanDerWaalsContact C-N 3.3Å; S80-M82 PolarHBondContact O-N 3.47Å; M82-R84 HydrophobicContact CB-CB 4.28Å; M82-R84 HydrophobicContact CB-CG 4.09Å; M82-R84 WeakPolarHBondContact O-CG 3.35Å; M82-R84 PolarHBondContact O-N 3.45Å; M82-R84 VanDerWaalsContact O-N 3.11Å
83	E	72.6	Confident	63.3	Low	183 Å²	183	72.5 Å²	72.5	86%	0.855	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.6	20.3	-172	-57.3	178.7	-170.9	0	0	113.2	L79 S80 Q81	L79-E83 PolarHBondContact O-N 3.49Å; S80-E83 PolarHBondContact O-N 3.37Å; S80-E83 VanDerWaalsContact O-N 3.08Å; Q81-E83 PolarHBondContact O-N 2.94Å
84	R	67.3	Low	61.3	Low	76 Å²	76	75.6 Å²	75.6	29%	0.287	40%	0.397	S	S	.	.			trans	-102.6	24.8	-179.7	-67.1	-74.6	-67.7	-76.5	-1.8	111.9	T45 L79 M82 S86 D87	T45-R84 PolarHBondContact OG1-NH1 3.17Å; L79-R84 HydrophobicContact CD2-CB 4.14Å; L79-R84 CarbonylContact O-C 3.43Å; L79-R84 WeakPolarHBondContact O-CA 3.36Å; L79-R84 PolarHBondContact O-N 3.11Å; M82-R84 HydrophobicContact CB-CB 4.28Å; M82-R84 HydrophobicContact CB-CG 4.09Å; M82-R84 WeakPolarHBondContact O-CG 3.35Å; M82-R84 PolarHBondContact O-N 3.45Å; M82-R84 VanDerWaalsContact O-N 3.11Å; R84-S86 PolarHBondContact O-N 3.19Å; R84-D87 IonicContact CZ-OD2 3.15Å; R84-D87 IonicContact NE-OD1 3.88Å; R84-D87 IonicContact NE-OD2 2.87Å; R84-D87 PolarHBondContact NE-OD2 3.01Å; R84-D87 IonicContact NH2-OD2 2.72Å; R84-D87 PolarHBondContact NH2-OD2 3.29Å; R84-D87 WeakPolarHBondContact O-CB 3.23Å; R84-D87 PolarHBondContact O-N 2.92Å
85	G	63	Low	59.3	Low	31 Å²	31	85.1 Å²	85.1	32%	0.32	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-19.7	179.6	0	0	0	0	0	113.9	L79 D87 L88	L79-G85 PolarHBondContact O-N 3.48Å; G85-D87 VanDerWaalsContact C-N 3.25Å; G85-D87 PolarHBondContact O-N 3.09Å; G85-L88 WeakPolarHBondContact O-CB 3.09Å; G85-L88 PolarHBondContact O-N 3.32Å
86	S	65.8	Low	58.8	Low	74 Å²	74	89.2 Å²	89.2	52%	0.517	46%	0.456	S	S	.	.	H	α-helix	trans	-59.6	-34	171.6	51.7	0	0	0	0	113.1	R84 L88 K89	R84-S86 PolarHBondContact O-N 3.19Å; S86-L88 PolarHBondContact O-N 3.04Å; S86-K89 WeakPolarHBondContact O-CB 3.41Å; S86-K89 PolarHBondContact O-N 3.4Å
87	D	60.9	Low	58.2	Low	31 Å²	31	87.3 Å²	87.3	17%	0.166	45%	0.451	C	S	.	.	H	α-helix	trans	-67	-26.2	-175.6	-62.8	-6.8	0	0	0	110.8	L49 R84 G85 K89 C90 F91	L49-D87 HydrophobicContact CD2-CB 4.23Å; R84-D87 IonicContact CZ-OD2 3.15Å; R84-D87 IonicContact NE-OD1 3.88Å; R84-D87 IonicContact NE-OD2 2.87Å; R84-D87 PolarHBondContact NE-OD2 3.01Å; R84-D87 IonicContact NH2-OD2 2.72Å; R84-D87 PolarHBondContact NH2-OD2 3.29Å; R84-D87 WeakPolarHBondContact O-CB 3.23Å; R84-D87 PolarHBondContact O-N 2.92Å; G85-D87 VanDerWaalsContact C-N 3.25Å; G85-D87 PolarHBondContact O-N 3.09Å; D87-K89 VanDerWaalsContact C-N 3.31Å; D87-K89 PolarHBondContact O-N 3.36Å; D87-C90 WeakPolarHBondContact O-CB 3.46Å; D87-C90 PolarHBondContact O-N 3.28Å; D87-F91 WeakPolarHBondContact O-CD2 3.35Å; D87-F91 VanDerWaalsContact O-CE2 3.24Å; D87-F91 WeakPolarHBondContact O-CE2 3.25Å
88	L	57.1	Low	57.3	Low	35 Å²	35	89.9 Å²	89.9	18%	0.183	46%	0.464	C	S	.	.	H	α-helix	trans	-64.1	-32	172.7	-72.4	153.1	0	0	0	112.8	L52 K76 L79 G85 S86 C90 F91	L52-L88 HydrophobicContact CD1-CD2 4.42Å; K76-L88 HydrophobicContact CB-CD1 4.41Å; K76-L88 HydrophobicContact CB-CD2 4.23Å; K76-L88 HydrophobicContact CG-CD1 3.82Å; K76-L88 HydrophobicContact CG-CD2 4.26Å; L79-L88 HydrophobicContact CB-CD1 4.32Å; L79-L88 HydrophobicContact CD1-CD2 4.22Å; L79-L88 HydrophobicContact CD1-CG 4Å; G85-L88 WeakPolarHBondContact O-CB 3.09Å; G85-L88 PolarHBondContact O-N 3.32Å; S86-L88 PolarHBondContact O-N 3.04Å; L88-C90 VanDerWaalsContact C-N 3.28Å; L88-C90 PolarHBondContact O-N 3.03Å; L88-F91 PolarHBondContact O-N 2.78Å
89	K	54.2	Low	56.2	Low	161 Å²	161	93.7 Å²	93.7	70%	0.7	48%	0.481	S	S	*	.	H	α-helix	trans	-68.3	-29.4	179.5	-72.2	-176.5	177.8	178.3	0	112.2	S86 D87 F91 I92	S86-K89 WeakPolarHBondContact O-CB 3.41Å; S86-K89 PolarHBondContact O-N 3.4Å; D87-K89 VanDerWaalsContact C-N 3.31Å; D87-K89 PolarHBondContact O-N 3.36Å; K89-F91 PolarHBondContact O-N 2.97Å; K89-I92 PolarHBondContact O-N 3.22Å
90	C	45.9	Very low	55.3	Low	95 Å²	95	99.6 Å²	99.6	64%	0.642	51%	0.511	S	S	*	.	H	α-helix	trans	-61	-31.5	175.8	-70.4	0	0	0	0	112	D87 L88	D87-C90 WeakPolarHBondContact O-CB 3.46Å; D87-C90 PolarHBondContact O-N 3.28Å; L88-C90 VanDerWaalsContact C-N 3.28Å; L88-C90 PolarHBondContact O-N 3.03Å
91	F	42.2	Very low	54.1	Low	62 Å²	62	102 Å²	102	27%	0.272	52%	0.516	S	S	.	.	H	α-helix	trans	-83.2	-20.8	-177.1	-63.8	-74.8	0	0	0	114.8	L49 L52 H53 D87 L88 K89 N93 I94	L49-F91 HydrophobicContact CB-CZ 4.4Å; L49-F91 HydrophobicContact CD2-CE2 3.35Å; L49-F91 HydrophobicContact CD2-CZ 3.43Å; L49-F91 VanDerWaalsContact CD2-CZ 3.43Å; L49-F91 HydrophobicContact CG-CZ 4.46Å; L52-F91 HydrophobicContact CB-CZ 4.49Å; L52-F91 HydrophobicContact CD1-CD2 4.15Å; L52-F91 HydrophobicContact CD1-CE2 3.87Å; L52-F91 HydrophobicContact CD1-CZ 4.37Å; H53-F91 AromaticContact CD2-CE1 3.65Å; H53-F91 AromaticContact NE2-CE1 3.46Å; H53-F91 WeakPolarHBondContact NE2-CE1 3.47Å; D87-F91 WeakPolarHBondContact O-CD2 3.35Å; D87-F91 VanDerWaalsContact O-CE2 3.24Å; D87-F91 WeakPolarHBondContact O-CE2 3.25Å; L88-F91 PolarHBondContact O-N 2.78Å; K89-F91 PolarHBondContact O-N 2.97Å; F91-N93 VanDerWaalsContact C-N 3.26Å; F91-N93 PolarHBondContact O-N 3.34Å; F91-I94 VanDerWaalsContact O-CG1 3.24Å; F91-I94 WeakPolarHBondContact O-CG1 3.4Å
92	I	39.5	Very low	52.9	Low	136 Å²	136	105.6 Å²	105.6	70%	0.697	54%	0.536	S	S	*	.	H	α-helix	trans	-79.6	-14.7	-179.4	-52.4	171.2	0	0	0	110.9	K89 I94	K89-I92 PolarHBondContact O-N 3.22Å; I92-I94 PolarHBondContact O-N 3.14Å
93	N	34.5	Very low	51.3	Low	145 Å²	145	111.2 Å²	111.2	78%	0.775	56%	0.564	S	S	*	*			trans	-75.7	58.3	167.6	-78.2	-36.3	0	0	0	111	F91 K95	F91-N93 VanDerWaalsContact C-N 3.26Å; F91-N93 PolarHBondContact O-N 3.34Å; N93-K95 PolarHBondContact O-N 2.9Å
94	I	32.1	Very low	49.5	Very low	146 Å²	146	105.2 Å²	105.2	75%	0.749	54%	0.54	S	S	*	.			trans	-75.9	104.4	164.2	-52.3	-179.7	0	0	0	105.6	F91 I92	F91-I94 VanDerWaalsContact O-CG1 3.24Å; F91-I94 WeakPolarHBondContact O-CG1 3.4Å; I92-I94 PolarHBondContact O-N 3.14Å
95	K	31.8	Very low	47.9	Very low	270 Å²	270	107.8 Å²	107.8	100%	1.174	56%	0.563	S	S	*	*			trans	-72.7	0	159.1	-94.1	-175.9	174	178.8	0	109.3	N93	N93-K95 PolarHBondContact O-N 2.9Å

Retrieved 95 of 95 residues in 24.1 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).