G4VMN2_SCHMA Loading...

Secreted protein

AlphaFold DB , UniProt , Accession G4VMN2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 172 aa.

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	51.3	Low	62.5	Low	200 Å²	200	114.7 Å²	114.7	99%	0.985	56%	0.556	S	S	*	*				0	-43	0	-74	-67.7	-176.9	0	0	112.8	N3 R4	M1-N3 PolarHBondContact O-N 3.34Å; M1-R4 PolarHBondContact O-N 3.33Å
2	L	48.7	Very low	63.6	Low	127 Å²	127	111.3 Å²	111.3	67%	0.665	55%	0.547	S	S	*	.	H	α-helix	trans	-60.3	-36.6	-172.6	-166	64.4	0	0	0	115.5	R4 F5 I6	L2-R4 VanDerWaalsContact C-N 3.31Å; L2-R4 PolarHBondContact O-N 3.25Å; L2-F5 WeakPolarHBondContact O-CB 3.43Å; L2-F5 PolarHBondContact O-N 3.5Å; L2-F5 VanDerWaalsContact O-N 3.15Å; L2-I6 HydrophobicContact CG-CD1 4.38Å; L2-I6 PolarHBondContact O-N 2.95Å
3	N	54.1	Low	64.2	Low	60 Å²	60	110.4 Å²	110.4	32%	0.321	54%	0.538	S	S	.	.	H	α-helix	trans	-64.3	-32.1	-177.8	-74.6	-0.9	0	0	0	113.9	M1 I6 V7	M1-N3 PolarHBondContact O-N 3.34Å; N3-I6 PolarHBondContact O-N 3.17Å; N3-V7 WeakPolarHBondContact O-CG2 3.47Å; N3-V7 PolarHBondContact O-N 2.96Å
4	R	53.6	Low	64.9	Low	199 Å²	199	107 Å²	107	75%	0.751	53%	0.527	S	S	*	.	H	α-helix	trans	-69.4	-36.1	176.5	-70.3	-174.3	173.8	-174.5	-2.4	111.6	M1 L2 V7 I8	M1-R4 PolarHBondContact O-N 3.33Å; L2-R4 VanDerWaalsContact C-N 3.31Å; L2-R4 PolarHBondContact O-N 3.25Å; R4-V7 PolarHBondContact O-N 3.01Å; R4-I8 WeakPolarHBondContact O-CB 3.39Å; R4-I8 WeakPolarHBondContact O-CD1 3.44Å; R4-I8 WeakPolarHBondContact O-CG1 3.33Å; R4-I8 PolarHBondContact O-N 2.79Å
5	F	58.4	Low	65.2	Low	131 Å²	131	102.3 Å²	102.3	58%	0.575	52%	0.517	S	S	*	.	H	α-helix	trans	-65.4	-38.8	176.9	-84.9	-85	0	0	0	112.3	L2 I8 L9	L2-F5 WeakPolarHBondContact O-CB 3.43Å; L2-F5 PolarHBondContact O-N 3.5Å; L2-F5 VanDerWaalsContact O-N 3.15Å; F5-I8 PolarHBondContact O-N 3.27Å; F5-L9 WeakPolarHBondContact O-CB 3.37Å; F5-L9 VanDerWaalsContact O-CG 3.31Å; F5-L9 WeakPolarHBondContact O-CG 3.05Å; F5-L9 PolarHBondContact O-N 3.07Å
6	I	66.3	Low	65.3	Low	45 Å²	45	101.9 Å²	101.9	23%	0.231	52%	0.516	C	S	.	.	H	α-helix	trans	-67.7	-43.7	179.3	-62.8	168.9	0	0	0	110.5	L2 N3 I8 L9 V10 F151	L2-I6 HydrophobicContact CG-CD1 4.38Å; L2-I6 PolarHBondContact O-N 2.95Å; N3-I6 PolarHBondContact O-N 3.17Å; I6-I8 VanDerWaalsContact C-N 3.34Å; I6-I8 PolarHBondContact O-N 2.74Å; I6-L9 PolarHBondContact O-N 2.8Å; I6-V10 WeakPolarHBondContact O-CG2 3.26Å; I6-V10 PolarHBondContact O-N 3.27Å; I6-F151 HydrophobicContact CG2-CZ 3.97Å
7	V	65.7	Low	65.2	Low	68 Å²	68	98.6 Å²	98.6	41%	0.412	50%	0.501	S	S	.	.	H	α-helix	trans	-59.9	-46.6	174.9	175.4	0	0	0	0	110.4	N3 R4 L9 V10 F11	N3-V7 WeakPolarHBondContact O-CG2 3.47Å; N3-V7 PolarHBondContact O-N 2.96Å; R4-V7 PolarHBondContact O-N 3.01Å; V7-L9 VanDerWaalsContact C-N 3.34Å; V7-L9 PolarHBondContact O-N 2.76Å; V7-V10 PolarHBondContact O-N 2.94Å; V7-F11 HydrophobicContact CG1-CD2 3.67Å; V7-F11 HydrophobicContact CG1-CE2 3.74Å; V7-F11 VanDerWaalsContact O-CD2 3.31Å; V7-F11 WeakPolarHBondContact O-CD2 3.42Å; V7-F11 PolarHBondContact O-N 3.34Å
8	I	69	Low	64.9	Low	95 Å²	95	96.9 Å²	96.9	49%	0.487	50%	0.497	S	S	.	.	H	α-helix	trans	-60	-44	176.4	-67.4	163	0	0	0	111.1	R4 F5 I6 V10 F11 V12	R4-I8 WeakPolarHBondContact O-CB 3.39Å; R4-I8 WeakPolarHBondContact O-CD1 3.44Å; R4-I8 WeakPolarHBondContact O-CG1 3.33Å; R4-I8 PolarHBondContact O-N 2.79Å; F5-I8 PolarHBondContact O-N 3.27Å; I6-I8 VanDerWaalsContact C-N 3.34Å; I6-I8 PolarHBondContact O-N 2.74Å; I8-V10 VanDerWaalsContact C-N 3.34Å; I8-V10 PolarHBondContact O-N 3.31Å; I8-F11 PolarHBondContact O-N 3.13Å; I8-V12 HydrophobicContact CG2-CG2 4.07Å; I8-V12 WeakPolarHBondContact O-CB 3.26Å; I8-V12 WeakPolarHBondContact O-CG2 3.24Å; I8-V12 PolarHBondContact O-N 3.07Å
9	L	74.2	Confident	64.4	Low	116 Å²	116	98.8 Å²	98.8	61%	0.607	50%	0.501	S	S	*	.	H	α-helix	trans	-63.1	-39.4	178	-78.5	168.5	0	0	0	112.2	F5 I6 V7 F13	F5-L9 WeakPolarHBondContact O-CB 3.37Å; F5-L9 VanDerWaalsContact O-CG 3.31Å; F5-L9 WeakPolarHBondContact O-CG 3.05Å; F5-L9 PolarHBondContact O-N 3.07Å; I6-L9 PolarHBondContact O-N 2.8Å; V7-L9 VanDerWaalsContact C-N 3.34Å; V7-L9 PolarHBondContact O-N 2.76Å; L9-F13 WeakPolarHBondContact O-CB 3.26Å; L9-F13 PolarHBondContact O-N 2.83Å
10	V	74.6	Confident	63.8	Low	68 Å²	68	99.5 Å²	99.5	41%	0.412	51%	0.506	S	S	.	.	H	α-helix	trans	-65.1	-45.3	174.5	173.2	0	0	0	0	110.6	I6 V7 I8 F13 V14	I6-V10 WeakPolarHBondContact O-CG2 3.26Å; I6-V10 PolarHBondContact O-N 3.27Å; V7-V10 PolarHBondContact O-N 2.94Å; I8-V10 VanDerWaalsContact C-N 3.34Å; I8-V10 PolarHBondContact O-N 3.31Å; V10-F13 PolarHBondContact O-N 2.84Å; V10-V14 HydrophobicContact CG1-CG2 4.36Å; V10-V14 WeakPolarHBondContact O-CB 3.31Å; V10-V14 VanDerWaalsContact O-CG2 3.24Å; V10-V14 WeakPolarHBondContact O-CG2 3.31Å; V10-V14 PolarHBondContact O-N 3.18Å
11	F	72	Confident	63.2	Low	153 Å²	153	99.5 Å²	99.5	67%	0.671	51%	0.507	S	S	*	.	H	α-helix	trans	-63.7	-42.1	176.9	-90.7	-82.9	0	0	0	112.6	V7 I8 G15	V7-F11 HydrophobicContact CG1-CD2 3.67Å; V7-F11 HydrophobicContact CG1-CE2 3.74Å; V7-F11 VanDerWaalsContact O-CD2 3.31Å; V7-F11 WeakPolarHBondContact O-CD2 3.42Å; V7-F11 PolarHBondContact O-N 3.34Å; I8-F11 PolarHBondContact O-N 3.13Å; F11-G15 PolarHBondContact O-N 3.47Å
12	V	75.5	Confident	63.3	Low	73 Å²	73	94.4 Å²	94.4	44%	0.442	49%	0.487	S	S	.	.	H	α-helix	trans	-64.6	-43.1	176	170.4	0	0	0	0	110.3	I8 G15 I16	I8-V12 HydrophobicContact CG2-CG2 4.07Å; I8-V12 WeakPolarHBondContact O-CB 3.26Å; I8-V12 WeakPolarHBondContact O-CG2 3.24Å; I8-V12 PolarHBondContact O-N 3.07Å; V12-G15 PolarHBondContact O-N 3.36Å; V12-I16 HydrophobicContact CG1-CD1 3.66Å; V12-I16 HydrophobicContact CG1-CG1 4.36Å; V12-I16 VanDerWaalsContact O-CG1 3.24Å; V12-I16 WeakPolarHBondContact O-CG1 3.43Å; V12-I16 PolarHBondContact O-N 3.37Å
13	F	71.2	Confident	63.3	Low	100 Å²	100	93.1 Å²	93.1	44%	0.439	48%	0.478	S	S	.	.	H	α-helix	trans	-66.1	-44	178.5	-166.1	-95.1	0	0	0	111.9	L9 V10 G15 I16 V17 I126	L9-F13 WeakPolarHBondContact O-CB 3.26Å; L9-F13 PolarHBondContact O-N 2.83Å; V10-F13 PolarHBondContact O-N 2.84Å; F13-G15 VanDerWaalsContact C-N 3.31Å; F13-G15 PolarHBondContact O-N 3.36Å; F13-I16 PolarHBondContact O-N 3.09Å; F13-V17 HydrophobicContact CD1-CG2 3.96Å; F13-V17 HydrophobicContact CE1-CG2 3.68Å; F13-V17 HydrophobicContact CZ-CG2 4.07Å; F13-V17 WeakPolarHBondContact O-CB 3.38Å; F13-V17 VanDerWaalsContact O-CG2 3.26Å; F13-V17 WeakPolarHBondContact O-CG2 3.39Å; F13-V17 PolarHBondContact O-N 3.34Å; F13-I126 HydrophobicContact CE1-CG2 4.48Å; F13-I126 HydrophobicContact CZ-CG1 4.48Å; F13-I126 HydrophobicContact CZ-CG2 3.78Å
14	V	73.5	Confident	63.1	Low	63 Å²	63	93.5 Å²	93.5	38%	0.382	50%	0.496	S	S	.	.	H	α-helix	trans	-61.1	-42.1	174	171.5	0	0	0	0	110.7	V10 T18	V10-V14 HydrophobicContact CG1-CG2 4.36Å; V10-V14 WeakPolarHBondContact O-CB 3.31Å; V10-V14 VanDerWaalsContact O-CG2 3.24Å; V10-V14 WeakPolarHBondContact O-CG2 3.31Å; V10-V14 PolarHBondContact O-N 3.18Å; V14-T18 WeakPolarHBondContact O-CB 3.36Å; V14-T18 PolarHBondContact O-N 3.03Å; V14-T18 PolarHBondContact O-OG1 2.65Å
15	G	70	Confident	62.7	Low	36 Å²	36	92.1 Å²	92.1	37%	0.371	50%	0.498	S	S	.	.	H	α-helix	trans	-62.4	-44.4	176.2	0	0	0	0	0	113.2	F11 V12 F13 T18 F19	F11-G15 PolarHBondContact O-N 3.47Å; V12-G15 PolarHBondContact O-N 3.36Å; F13-G15 VanDerWaalsContact C-N 3.31Å; F13-G15 PolarHBondContact O-N 3.36Å; G15-T18 WeakPolarHBondContact CA-OG1 3.24Å; G15-T18 PolarHBondContact O-OG1 3.42Å; G15-T18 VanDerWaalsContact O-OG1 3.13Å; G15-F19 VanDerWaalsContact O-CB 3.26Å; G15-F19 WeakPolarHBondContact O-CB 3.39Å; G15-F19 PolarHBondContact O-N 3.29Å
16	I	66.7	Low	61.9	Low	97 Å²	97	94.8 Å²	94.8	50%	0.497	50%	0.504	S	S	.	.	H	α-helix	trans	-66.7	-45.9	177.8	-67.3	166.1	0	0	0	110.7	V12 F13 T18 F19 D20	V12-I16 HydrophobicContact CG1-CD1 3.66Å; V12-I16 HydrophobicContact CG1-CG1 4.36Å; V12-I16 VanDerWaalsContact O-CG1 3.24Å; V12-I16 WeakPolarHBondContact O-CG1 3.43Å; V12-I16 PolarHBondContact O-N 3.37Å; F13-I16 PolarHBondContact O-N 3.09Å; I16-T18 VanDerWaalsContact C-N 3.34Å; I16-T18 PolarHBondContact O-N 3.11Å; I16-F19 PolarHBondContact O-N 2.81Å; I16-D20 PolarHBondContact O-N 2.98Å
17	V	64.1	Low	61.1	Low	45 Å²	45	99.8 Å²	99.8	27%	0.273	53%	0.532	S	S	.	.	H	α-helix	trans	-64.7	-38	179.7	172	0	0	0	0	111.7	F13 N21	F13-V17 HydrophobicContact CD1-CG2 3.96Å; F13-V17 HydrophobicContact CE1-CG2 3.68Å; F13-V17 HydrophobicContact CZ-CG2 4.07Å; F13-V17 WeakPolarHBondContact O-CB 3.38Å; F13-V17 VanDerWaalsContact O-CG2 3.26Å; F13-V17 WeakPolarHBondContact O-CG2 3.39Å; F13-V17 PolarHBondContact O-N 3.34Å; V17-N21 PolarHBondContact O-N 2.9Å
18	T	59.7	Low	60.5	Low	69 Å²	69	101.4 Å²	101.4	42%	0.423	54%	0.543	S	S	.	.	H	α-helix	trans	-70.9	-35.3	173.6	38.6	0	0	0	0	112.2	V14 G15 I16 N21 V22	V14-T18 WeakPolarHBondContact O-CB 3.36Å; V14-T18 PolarHBondContact O-N 3.03Å; V14-T18 PolarHBondContact O-OG1 2.65Å; G15-T18 WeakPolarHBondContact CA-OG1 3.24Å; G15-T18 PolarHBondContact O-OG1 3.42Å; G15-T18 VanDerWaalsContact O-OG1 3.13Å; I16-T18 VanDerWaalsContact C-N 3.34Å; I16-T18 PolarHBondContact O-N 3.11Å; T18-N21 PolarHBondContact O-N 2.99Å; T18-V22 VanDerWaalsContact O-CG2 3.26Å; T18-V22 WeakPolarHBondContact O-CG2 3.19Å; T18-V22 PolarHBondContact O-N 3.45Å
19	F	54.2	Low	59.4	Low	133 Å²	133	102.2 Å²	102.2	58%	0.583	56%	0.555	S	S	*	*	H	α-helix	trans	-66.3	-41.3	177.5	-163.3	-98.9	0	0	0	112.4	G15 I16 V22 Q23	G15-F19 VanDerWaalsContact O-CB 3.26Å; G15-F19 WeakPolarHBondContact O-CB 3.39Å; G15-F19 PolarHBondContact O-N 3.29Å; I16-F19 PolarHBondContact O-N 2.81Å; F19-V22 PolarHBondContact O-N 2.85Å; F19-Q23 HydrophobicContact CE1-CG 4.35Å; F19-Q23 PolarHBondContact O-N 3.35Å; F19-Q23 VanDerWaalsContact O-N 3.09Å
20	D	53.1	Low	57.8	Low	112 Å²	112	106.8 Å²	106.8	60%	0.599	56%	0.564	S	S	*	*	H	α-helix	trans	-65.4	-38.3	173.6	-92.8	-24.9	0	0	0	112	I16 V22 Q23 G24	I16-D20 PolarHBondContact O-N 2.98Å; D20-V22 VanDerWaalsContact C-N 3.35Å; D20-V22 PolarHBondContact O-N 3.36Å; D20-Q23 PolarHBondContact O-N 2.93Å; D20-G24 PolarHBondContact O-N 3.44Å; D20-G24 VanDerWaalsContact O-N 3.07Å
21	N	51.8	Low	56.1	Low	99 Å²	99	109 Å²	109	53%	0.529	58%	0.578	S	S	.	*	H	α-helix	trans	-67.6	-32.8	176.4	-114.5	-31.8	0	0	0	113	V17 T18	V17-N21 PolarHBondContact O-N 2.9Å; T18-N21 PolarHBondContact O-N 2.99Å
22	V	52.2	Low	54.4	Low	93 Å²	93	106.8 Å²	106.8	56%	0.564	57%	0.573	S	S	*	*	H	α-helix	trans	-78.1	-26.2	177.4	173.8	0	0	0	0	111.9	T18 F19 D20	T18-V22 VanDerWaalsContact O-CG2 3.26Å; T18-V22 WeakPolarHBondContact O-CG2 3.19Å; T18-V22 PolarHBondContact O-N 3.45Å; F19-V22 PolarHBondContact O-N 2.85Å; D20-V22 VanDerWaalsContact C-N 3.35Å; D20-V22 PolarHBondContact O-N 3.36Å
23	Q	49.9	Very low	52.6	Low	101 Å²	101	111 Å²	111	47%	0.472	59%	0.593	S	S	.	*	H	α-helix	trans	-81.2	-26.2	173.7	-69.4	-151.4	13.2	0	0	113.6	F19 D20 Q25 R26	F19-Q23 HydrophobicContact CE1-CG 4.35Å; F19-Q23 PolarHBondContact O-N 3.35Å; F19-Q23 VanDerWaalsContact O-N 3.09Å; D20-Q23 PolarHBondContact O-N 2.93Å; Q23-Q25 PolarHBondContact O-N 2.93Å; Q23-Q25 VanDerWaalsContact O-N 3.13Å; Q23-R26 PolarHBondContact O-N 2.97Å
24	G	48.6	Very low	51.1	Low	68 Å²	68	111.5 Å²	111.5	70%	0.701	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.6	-5.8	173.4	0	0	0	0	0	115.4	D20	D20-G24 PolarHBondContact O-N 3.44Å; D20-G24 VanDerWaalsContact O-N 3.07Å
25	Q	45	Very low	49.7	Very low	169 Å²	169	115.1 Å²	115.1	79%	0.79	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112	14.5	-178.9	-152.2	171	3.3	0	0	113.4	Q23	Q23-Q25 PolarHBondContact O-N 2.93Å; Q23-Q25 VanDerWaalsContact O-N 3.13Å
26	R	43.6	Very low	47.9	Very low	187 Å²	187	119.1 Å²	119.1	71%	0.706	64%	0.638	S	S	*	*			trans	-100.6	53.9	170.8	-65.4	-167.1	-160.5	170	6	112.1	Q23 P28	Q23-R26 PolarHBondContact O-N 2.97Å; R26-P28 WeakPolarHBondContact O-CD 3.19Å
27	D	48.5	Very low	46.5	Very low	150 Å²	150	122.5 Å²	122.5	80%	0.802	65%	0.651	S	S	*	*			trans	-84.5	111.9	151.1	-84.2	-32	0	0	0	107.2
28	P	53.6	Low	45.5	Very low	102 Å²	102	125.3 Å²	125.3	66%	0.662	67%	0.669	S	S	*	*			trans	-59.1	145.6	170.1	26.4	-31.9	0	0	0	108.1	R26 R30	R26-P28 WeakPolarHBondContact O-CD 3.19Å; P28-R30 PolarHBondContact O-N 3.18Å
29	P	44.4	Very low	44.4	Very low	113 Å²	113	127.3 Å²	127.3	73%	0.734	68%	0.681	S	S	*	*			trans	-55.7	112.3	175	24.2	-31.6	0	0	0	107.1	T31	P29-T31 PolarHBondContact O-N 2.98Å
30	R	40.8	Very low	43.8	Very low	212 Å²	212	128.3 Å²	128.3	80%	0.8	69%	0.692	S	S	*	*			trans	-68.8	86.9	173.4	-164.1	176	-176.6	148.7	0.7	106.1	P28 N32	P28-R30 PolarHBondContact O-N 3.18Å; R30-N32 PolarHBondContact O-N 2.92Å
31	T	38.8	Very low	42.8	Very low	115 Å²	115	130.9 Å²	130.9	71%	0.706	70%	0.7	S	S	*	*			trans	-67.5	68.6	167.7	45	0	0	0	0	108.3	P29 N33	P29-T31 PolarHBondContact O-N 2.98Å; T31-N33 VanDerWaalsContact C-N 3.28Å; T31-N33 PolarHBondContact O-N 2.87Å
32	N	37.7	Very low	41.9	Very low	106 Å²	106	136.8 Å²	136.8	57%	0.567	72%	0.717	S	S	*	*			trans	-75.6	95.4	159.6	-84.5	-0	0	0	0	106.3	R30 T34	R30-N32 PolarHBondContact O-N 2.92Å; N32-T34 PolarHBondContact O-N 2.72Å; N32-T34 PolarHBondContact O-OG1 3.09Å
33	N	36.7	Very low	41.2	Very low	160 Å²	160	138.9 Å²	138.9	86%	0.856	73%	0.73	S	S	*	*			trans	-34	92.1	154.4	-68.2	-17.4	0	0	0	109.8	T31	T31-N33 VanDerWaalsContact C-N 3.28Å; T31-N33 PolarHBondContact O-N 2.87Å
34	T	39.3	Very low	40.5	Very low	112 Å²	112	137.2 Å²	137.2	69%	0.687	74%	0.74	S	S	*	*			trans	-123	85.2	169.1	-53.3	0	0	0	0	104.5	N32 T36	N32-T34 PolarHBondContact O-N 2.72Å; N32-T34 PolarHBondContact O-OG1 3.09Å; T34-T36 PolarHBondContact O-N 3.42Å
35	I	44.3	Very low	40	Very low	139 Å²	139	143.6 Å²	143.6	71%	0.713	75%	0.748	S	S	*	*			trans	2.8	88.1	161.6	-52.9	173.1	0	0	0	111.9	H37	I35-H37 VanDerWaalsContact C-N 3.33Å; I35-H37 PolarHBondContact O-N 3.12Å
36	T	33.7	Very low	40.1	Very low	119 Å²	119	143.4 Å²	143.4	73%	0.73	75%	0.751	S	S	*	*			trans	-67.9	100.5	161.8	-43.9	0	0	0	0	105.4	T34 T38	T34-T36 PolarHBondContact O-N 3.42Å; T36-T38 HydrophobicContact CG2-CG2 3.92Å; T36-T38 PolarHBondContact O-N 2.81Å
37	H	36.8	Very low	39.9	Very low	168 Å²	168	138.9 Å²	138.9	78%	0.778	75%	0.749	S	S	*	*			trans	-63.8	84.4	164.2	-87.9	-85.4	0	0	0	107.6	I35 T39	I35-H37 VanDerWaalsContact C-N 3.33Å; I35-H37 PolarHBondContact O-N 3.12Å; H37-T39 PolarHBondContact O-N 3.47Å
38	T	42.4	Very low	39.3	Very low	105 Å²	105	139.6 Å²	139.6	64%	0.644	75%	0.747	S	S	*	*			trans	-76.3	110.2	164.3	43.4	0	0	0	0	107.4	T36 N40	T36-T38 HydrophobicContact CG2-CG2 3.92Å; T36-T38 PolarHBondContact O-N 2.81Å; T38-N40 PolarHBondContact O-N 3.41Å
39	T	37	Very low	38.3	Very low	110 Å²	110	142.3 Å²	142.3	68%	0.675	75%	0.75	S	S	*	*			trans	-47.3	98	168.9	-59.8	0	0	0	0	110.9	H37 H41	H37-T39 PolarHBondContact O-N 3.47Å; T39-H41 VanDerWaalsContact CG2-CD2 3.43Å; T39-H41 WeakPolarHBondContact CG2-CD2 3.43Å
40	N	41.9	Very low	37.9	Very low	154 Å²	154	144.3 Å²	144.3	82%	0.824	76%	0.755	S	S	*	*			trans	-103.9	99.2	153.8	-78.7	-36.5	0	0	0	107.1	T38 Y42	T38-N40 PolarHBondContact O-N 3.41Å; N40-Y42 PolarHBondContact O-N 2.85Å; N40-Y42 VanDerWaalsContact O-N 3.17Å
41	H	31.9	Very low	37.7	Very low	166 Å²	166	140.1 Å²	140.1	77%	0.769	75%	0.753	S	S	*	*			trans	-55.6	109.5	165.7	-85.7	-84.3	0	0	0	109.6	T39	T39-H41 VanDerWaalsContact CG2-CD2 3.43Å; T39-H41 WeakPolarHBondContact CG2-CD2 3.43Å
42	Y	33.8	Very low	37.6	Very low	224 Å²	224	140.6 Å²	140.6	88%	0.878	76%	0.756	S	S	*	*			trans	-147.7	93.4	149.4	-127.9	-91.6	0	0	0	110.4	N40	N40-Y42 PolarHBondContact O-N 2.85Å; N40-Y42 VanDerWaalsContact O-N 3.17Å
43	V	37.1	Very low	38.1	Very low	137 Å²	137	141.1 Å²	141.1	83%	0.83	77%	0.765	S	S	*	*			trans	7	123	146	-160.8	0	0	0	0	116.9
44	G	34.5	Very low	38.1	Very low	66 Å²	66	137.5 Å²	137.5	68%	0.68	76%	0.757	S	S	*	*			trans	160.6	76.8	155.8	0	0	0	0	0	116.8
45	K	39.4	Very low	37.9	Very low	201 Å²	201	141.7 Å²	141.7	87%	0.874	77%	0.766	S	S	*	*			trans	36.2	117.9	142.7	-63.9	174.6	177.1	176.9	0	117.6
46	L	45.2	Very low	37.8	Very low	165 Å²	165	141.4 Å²	141.4	86%	0.864	77%	0.77	S	S	*	*				179.2	123.6	99.6	-146.2	58.7	0	0	0	112.1
47	S	39.3	Very low	38.1	Very low	93 Å²	93	141.3 Å²	141.3	65%	0.65	77%	0.77	S	S	*	*			trans	59.8	97.4	147.4	-137.3	0	0	0	0	120.8
48	H	36.5	Very low	38.1	Very low	165 Å²	165	145.2 Å²	145.2	76%	0.764	78%	0.778	S	S	*	*				79.5	114.2	92.7	-71.9	103.1	0	0	0	116
49	H	33.1	Very low	37.8	Very low	159 Å²	159	149.2 Å²	149.2	74%	0.736	79%	0.786	S	S	*	*			trans	56.4	102.4	138.9	-99.6	-80.7	0	0	0	119.2
50	N	36.4	Very low	37.6	Very low	155 Å²	155	149.3 Å²	149.3	83%	0.829	79%	0.791	S	S	*	*				-165.2	105.6	113.9	-104.8	-2.9	0	0	0	112.2
51	T	35.3	Very low	37.4	Very low	123 Å²	123	150.5 Å²	150.5	76%	0.755	79%	0.792	S	S	*	*			trans	-80.5	108.8	168.3	-54.2	0	0	0	0	109.2
52	V	38.2	Very low	37.5	Very low	126 Å²	126	150.4 Å²	150.4	76%	0.764	79%	0.792	S	S	*	*			trans	-149.7	106.3	157	-173.8	0	0	0	0	109
53	P	46.8	Very low	37.8	Very low	117 Å²	117	145.9 Å²	145.9	76%	0.76	79%	0.787	S	S	*	*			trans	-82.8	119.1	157.6	2.8	15.1	0	0	0	108.3	K55	P53-K55 PolarHBondContact O-N 3.41Å
54	A	38	Very low	37.7	Very low	83 Å²	83	146.2 Å²	146.2	69%	0.686	79%	0.79	S	S	*	*			trans	-56.7	134.4	176	0	0	0	0	0	111.7	T56	A54-T56 PolarHBondContact O-N 3.31Å
55	K	34.7	Very low	37.7	Very low	201 Å²	201	147.1 Å²	147.1	87%	0.874	79%	0.791	S	S	*	*			trans	-58.7	114.6	163.9	-73	172.4	175.3	173.6	0	109.3	P53	P53-K55 PolarHBondContact O-N 3.41Å
56	T	42.3	Very low	37.7	Very low	133 Å²	133	144.5 Å²	144.5	82%	0.816	79%	0.792	S	S	*	*			trans	-120.5	92.8	157.2	35.3	0	0	0	0	109.5	A54 R58	A54-T56 PolarHBondContact O-N 3.31Å; T56-R58 PolarHBondContact O-N 2.86Å
57	T	39.1	Very low	37.5	Very low	117 Å²	117	140.5 Å²	140.5	72%	0.718	78%	0.783	S	S	*	*			trans	-58.2	116.5	164.8	-50.3	0	0	0	0	109.5	K59	T57-K59 HydrophobicContact CG2-CG 4.07Å
58	R	36.7	Very low	37.6	Very low	250 Å²	250	147.1 Å²	147.1	94%	0.943	79%	0.794	S	S	*	*			trans	-117.7	93.5	160.3	-128.6	-179.4	-177.6	-169.1	0.6	108.2	T56	T56-R58 PolarHBondContact O-N 2.86Å
59	K	35.9	Very low	37.8	Very low	188 Å²	188	146.4 Å²	146.4	82%	0.817	79%	0.79	S	S	*	*			trans	-85.9	128.6	165.1	-75.1	-174.5	176.6	-176.8	0	108.2	T57	T57-K59 HydrophobicContact CG2-CG 4.07Å
60	S	34.6	Very low	37.9	Very low	112 Å²	112	146 Å²	146	78%	0.783	79%	0.789	S	S	*	*			trans	-144	89.9	155.5	-163	0	0	0	0	105.4
61	Q	36.5	Very low	38.1	Very low	179 Å²	179	146.5 Å²	146.5	84%	0.836	79%	0.791	S	S	*	*				47.3	99.8	99	-92.1	178	-28.9	0	0	112
62	H	34.1	Very low	38.1	Very low	165 Å²	165	146 Å²	146	76%	0.764	79%	0.788	S	S	*	*				81.2	112.2	76.2	-165.6	-72.4	0	0	0	111.7
63	T	40.5	Very low	38.1	Very low	129 Å²	129	146 Å²	146	79%	0.791	78%	0.783	S	S	*	*				173.2	114.6	124.8	36.2	0	0	0	0	111.1
64	T	34.1	Very low	37.8	Very low	143 Å²	143	148.7 Å²	148.7	88%	0.877	78%	0.783	S	S	*	*			trans	-86.8	127.9	157.4	-18.6	0	0	0	0	107.8
65	A	34.1	Very low	37.9	Very low	86 Å²	86	150.6 Å²	150.6	71%	0.711	79%	0.786	S	S	*	*			trans	157.5	158.7	147.6	0	0	0	0	0	111.9
66	T	40.7	Very low	37.9	Very low	145 Å²	145	146.7 Å²	146.7	89%	0.89	78%	0.779	S	S	*	*			trans	75.4	130.3	169.4	17.7	0	0	0	0	115.5
67	A	40.9	Very low	37.9	Very low	82 Å²	82	147.7 Å²	147.7	68%	0.678	78%	0.779	S	S	*	*			cis	-162.9	155.5	11.2	0	0	0	0	0	108.1
68	R	40.2	Very low	37.8	Very low	232 Å²	232	146.1 Å²	146.1	88%	0.875	77%	0.772	S	S	*	*			trans	177.9	100	131.6	-91.9	170.8	-169.8	-177	5.4	111.6
69	H	41	Very low	37.9	Very low	149 Å²	149	142.3 Å²	142.3	69%	0.69	77%	0.765	S	S	*	*			trans	70.2	112.8	138.2	-56.1	-64.4	0	0	0	122.9
70	H	36.7	Very low	37.9	Very low	152 Å²	152	140.9 Å²	140.9	70%	0.704	76%	0.761	S	S	*	*			trans	47.9	107.5	130.4	-59	-80.2	0	0	0	119.3
71	N	40.2	Very low	38	Very low	165 Å²	165	142 Å²	142	88%	0.882	76%	0.758	S	S	*	*				-165.7	141.5	104.3	-102	-5	0	0	0	111.8
72	T	34.9	Very low	38.1	Very low	112 Å²	112	139.6 Å²	139.6	69%	0.687	76%	0.756	S	S	*	*			trans	-110.1	162.3	-162	-19.1	0	0	0	0	110
73	L	37.9	Very low	38.2	Very low	125 Å²	125	138.2 Å²	138.2	65%	0.654	76%	0.759	S	S	*	*			trans	85.2	116.5	150.9	-97.2	64.4	0	0	0	119.6
74	K	39.9	Very low	38.1	Very low	175 Å²	175	137.4 Å²	137.4	76%	0.761	76%	0.756	S	S	*	*				72.2	143.2	127.2	-71	175.3	-174.8	-179.9	0	116.8
75	T	40.1	Very low	38	Very low	122 Å²	122	135.1 Å²	135.1	75%	0.748	75%	0.751	S	S	*	*			cis	-167.5	151.4	2.1	7.4	0	0	0	0	105.9
76	T	35.3	Very low	38.2	Very low	119 Å²	119	140.4 Å²	140.4	73%	0.73	76%	0.758	S	S	*	*			trans	-28.1	139.8	158.8	41.6	0	0	0	0	117.4
77	L	41.9	Very low	38.5	Very low	155 Å²	155	139.6 Å²	139.6	81%	0.812	75%	0.753	S	S	*	*			trans	164.6	112	131.8	-110.4	82.1	0	0	0	107.1
78	S	37.6	Very low	38.5	Very low	84 Å²	84	141.6 Å²	141.6	59%	0.587	76%	0.757	S	S	*	*				106.2	127.7	80.7	-110.1	0	0	0	0	112.1
79	H	38	Very low	38.3	Very low	169 Å²	169	142.5 Å²	142.5	78%	0.782	76%	0.761	S	S	*	*			trans	72.6	141.2	146.7	-67	66.8	0	0	0	116.7
80	H	37.2	Very low	38.1	Very low	159 Å²	159	144.1 Å²	144.1	74%	0.736	77%	0.766	S	S	*	*			cis	-176.1	164.8	-5.9	-156.4	-90.2	0	0	0	104.1
81	N	36.9	Very low	38	Very low	136 Å²	136	142.3 Å²	142.3	73%	0.727	77%	0.77	S	S	*	*			trans	94.1	86.1	166.7	-59.7	-6.6	0	0	0	119.7
82	T	37	Very low	37.8	Very low	127 Å²	127	143.4 Å²	143.4	78%	0.779	77%	0.77	S	S	*	*				-19	135.1	122.1	-30.9	0	0	0	0	113.4
83	V	37.1	Very low	38.1	Very low	137 Å²	137	145.6 Å²	145.6	83%	0.83	77%	0.772	S	S	*	*				-161.2	132.8	77.7	170.9	0	0	0	0	110.1
84	P	37.6	Very low	38.3	Very low	112 Å²	112	144.4 Å²	144.4	73%	0.727	77%	0.772	S	S	*	*			trans	-102.8	139.6	169.5	36	-26.3	0	0	0	112
85	A	32.4	Very low	38.3	Very low	95 Å²	95	142.4 Å²	142.4	79%	0.785	77%	0.769	S	S	*	*			trans	156	113.7	138.6	0	0	0	0	0	110.6
86	K	39.3	Very low	38.5	Very low	197 Å²	197	142.1 Å²	142.1	86%	0.857	77%	0.767	S	S	*	*			trans	-172.9	138.4	131.7	-107.2	167	-177.5	177	0	111.6
87	T	47.5	Very low	39.1	Very low	128 Å²	128	142.1 Å²	142.1	79%	0.785	77%	0.768	S	S	*	*			trans	74.2	90.9	151.2	51	0	0	0	0	118.8	R89	T87-R89 PolarHBondContact O-N 3.39Å
88	T	40.4	Very low	39.3	Very low	124 Å²	124	140.5 Å²	140.5	76%	0.761	77%	0.766	S	S	*	*			trans	-23.8	110.9	138.5	-39.2	0	0	0	0	113.5	K90	T88-K90 HydrophobicContact CG2-CG 4.09Å
89	R	35.9	Very low	39.3	Very low	251 Å²	251	141.2 Å²	141.2	95%	0.947	77%	0.771	S	S	*	*			trans	-118.9	97.8	150	-106.5	-174.8	174.2	-174.1	-1.4	107.8	T87	T87-R89 PolarHBondContact O-N 3.39Å
90	K	37.5	Very low	39.3	Very low	183 Å²	183	140 Å²	140	80%	0.796	77%	0.765	S	S	*	*			trans	-63.1	138.7	164.7	-73.8	-176.5	176	-178.2	0	108.4	T88	T88-K90 HydrophobicContact CG2-CG 4.09Å
91	S	33.4	Very low	39.8	Very low	113 Å²	113	138 Å²	138	79%	0.79	77%	0.765	S	S	*	*			trans	65.4	92.9	143.5	-143.4	0	0	0	0	117.3
92	Q	37	Very low	40.1	Very low	188 Å²	188	134.3 Å²	134.3	88%	0.879	75%	0.745	S	S	*	*				-155.8	80.9	129.7	-133.2	163.3	-15.2	0	0	108.5	P94	Q92-P94 WeakPolarHBondContact O-CD 3.45Å
93	H	40.1	Very low	40.8	Very low	159 Å²	159	137.1 Å²	137.1	74%	0.736	75%	0.746	S	S	*	*			trans	-71.5	118.7	157.5	-135.4	-64.5	0	0	0	105.2	N95	H93-N95 PolarHBondContact O-N 2.85Å
94	P	41.8	Very low	41.4	Very low	100 Å²	100	135.2 Å²	135.2	65%	0.649	74%	0.735	S	S	*	*			trans	-72	80.2	164	29.8	-28.8	0	0	0	106.6	Q92 T96	Q92-P94 WeakPolarHBondContact O-CD 3.45Å; P94-T96 PolarHBondContact O-N 3.21Å
95	N	40.3	Very low	42	Very low	133 Å²	133	133.9 Å²	133.9	71%	0.711	73%	0.725	S	S	*	*			trans	-73	71.9	154.4	-89.3	3.4	0	0	0	106.8	H93	H93-N95 PolarHBondContact O-N 2.85Å
96	T	44.1	Very low	42.6	Very low	115 Å²	115	135.8 Å²	135.8	71%	0.706	72%	0.718	S	S	*	*			trans	-107.6	69.9	161.5	49.3	0	0	0	0	107.2	P94 P98	P94-T96 PolarHBondContact O-N 3.21Å; T96-P98 WeakPolarHBondContact O-CD 3.46Å
97	T	49.2	Very low	43	Very low	120 Å²	120	134.6 Å²	134.6	74%	0.736	71%	0.712	S	S	*	*			trans	-59.8	120.1	145.5	-29.3	0	0	0	0	104.8	S99	T97-S99 PolarHBondContact O-N 2.87Å
98	P	44.4	Very low	43.1	Very low	121 Å²	121	136.4 Å²	136.4	79%	0.786	71%	0.709	S	S	*	*			trans	-68.7	87.2	171.9	27.9	-29.8	0	0	0	107	T96 H100	T96-P98 WeakPolarHBondContact O-CD 3.46Å; P98-H100 PolarHBondContact O-N 3.34Å
99	S	38.1	Very low	43.6	Very low	98 Å²	98	134.7 Å²	134.7	69%	0.685	70%	0.701	S	S	*	*			trans	-73	64.5	163.4	177.2	0	0	0	0	107.9	T97 T101	T97-S99 PolarHBondContact O-N 2.87Å; S99-T101 VanDerWaalsContact C-N 3.31Å; S99-T101 PolarHBondContact O-N 2.86Å
100	H	38.8	Very low	44.4	Very low	144 Å²	144	127 Å²	127	67%	0.667	68%	0.678	S	S	*	*			trans	-93.7	75.5	156.3	-109.1	-85.6	0	0	0	107.2	P98 D102	P98-H100 PolarHBondContact O-N 3.34Å; H100-D102 IonicContact CE1-OD2 3.13Å; H100-D102 PolarHBondContact CE1-OD2 3.31Å; H100-D102 IonicContact ND1-OD2 2.81Å; H100-D102 PolarHBondContact ND1-OD2 3.13Å; H100-D102 PolarHBondContact O-N 2.63Å
101	T	46.3	Very low	45.3	Very low	117 Å²	117	124.8 Å²	124.8	72%	0.718	68%	0.676	S	S	*	*			trans	-69	60.1	150.2	43.6	0	0	0	0	108.9	S99 K103	S99-T101 VanDerWaalsContact C-N 3.31Å; S99-T101 PolarHBondContact O-N 2.86Å; T101-K103 PolarHBondContact O-N 2.9Å
102	D	44.2	Very low	46.5	Very low	59 Å²	59	128.1 Å²	128.1	32%	0.316	68%	0.676	S	S	.	*			trans	-82.7	97.1	163	-114	-33.6	0	0	0	106.4	H100 T104 V105 Q106	H100-D102 IonicContact CE1-OD2 3.13Å; H100-D102 PolarHBondContact CE1-OD2 3.31Å; H100-D102 IonicContact ND1-OD2 2.81Å; H100-D102 PolarHBondContact ND1-OD2 3.13Å; H100-D102 PolarHBondContact O-N 2.63Å; D102-T104 WeakPolarHBondContact CB-OG1 3.31Å; D102-T104 VanDerWaalsContact CG-OG1 3.28Å; D102-T104 PolarHBondContact O-N 2.88Å; D102-T104 PolarHBondContact OD1-OG1 3.5Å; D102-V105 HydrophobicContact CB-CB 3.98Å; D102-V105 HydrophobicContact CB-CG2 3.65Å; D102-V105 PolarHBondContact O-N 2.85Å; D102-Q106 PolarHBondContact O-N 2.8Å
103	K	51.2	Low	47.6	Very low	185 Å²	185	122.1 Å²	122.1	80%	0.804	65%	0.649	S	S	*	*	H	α-helix	trans	-53.7	-16.2	171.3	-66.4	-179.4	178.4	177	0	111.9	T101	T101-K103 PolarHBondContact O-N 2.9Å
104	T	50.8	Low	49	Very low	98 Å²	98	117.8 Å²	117.8	60%	0.601	63%	0.633	S	S	*	*	H	α-helix	trans	-83.2	-32.4	177.2	51.5	0	0	0	0	113.6	D102	D102-T104 WeakPolarHBondContact CB-OG1 3.31Å; D102-T104 VanDerWaalsContact CG-OG1 3.28Å; D102-T104 PolarHBondContact O-N 2.88Å; D102-T104 PolarHBondContact OD1-OG1 3.5Å
105	V	49.6	Very low	50	Low	83 Å²	83	116.3 Å²	116.3	50%	0.503	62%	0.624	S	S	.	*	H	α-helix	trans	-80.6	-39.5	179.6	176.4	0	0	0	0	111.1	D102 K107 K108 C109	D102-V105 HydrophobicContact CB-CB 3.98Å; D102-V105 HydrophobicContact CB-CG2 3.65Å; D102-V105 PolarHBondContact O-N 2.85Å; V105-K107 VanDerWaalsContact C-N 3.26Å; V105-K107 PolarHBondContact O-N 3.39Å; V105-K108 PolarHBondContact O-N 2.85Å; V105-C109 PolarHBondContact O-N 3.04Å
106	Q	44.8	Very low	51.1	Low	136 Å²	136	117.2 Å²	117.2	64%	0.636	62%	0.623	S	S	*	*	H	α-helix	trans	-61.3	-34.8	175.9	-74.2	-173.3	2.8	0	0	112.6	D102 K108 C109 L110	D102-Q106 PolarHBondContact O-N 2.8Å; Q106-K108 PolarHBondContact O-N 2.97Å; Q106-C109 PolarHBondContact O-N 2.87Å; Q106-L110 PolarHBondContact O-N 2.87Å; Q106-L110 VanDerWaalsContact O-N 3.1Å
107	K	48.2	Very low	52.3	Low	172 Å²	172	115.3 Å²	115.3	75%	0.748	61%	0.609	S	S	*	*	H	α-helix	trans	-65	-27.8	177.5	-152.9	174.6	-174.7	-178.9	0	112.5	V105	V105-K107 VanDerWaalsContact C-N 3.26Å; V105-K107 PolarHBondContact O-N 3.39Å
108	K	50.2	Low	53.1	Low	165 Å²	165	111.9 Å²	111.9	72%	0.717	59%	0.586	S	S	*	*	H	α-helix	trans	-82.2	-29.4	178	-155.8	171.6	-174.4	178.7	0	112.5	V105 Q106	V105-K108 PolarHBondContact O-N 2.85Å; Q106-K108 PolarHBondContact O-N 2.97Å
109	C	49.7	Very low	54	Low	88 Å²	88	109.5 Å²	109.5	60%	0.595	57%	0.566	S	S	*	*	H	α-helix	trans	-73.4	-35.4	173.9	-65.8	0	0	0	0	112.2	V105 Q106 N111 K112	V105-C109 PolarHBondContact O-N 3.04Å; Q106-C109 PolarHBondContact O-N 2.87Å; C109-N111 VanDerWaalsContact C-N 3.31Å; C109-N111 PolarHBondContact O-N 3.28Å; C109-K112 PolarHBondContact O-N 2.94Å
110	L	53.5	Low	55.5	Low	89 Å²	89	108.4 Å²	108.4	47%	0.466	56%	0.558	S	S	.	*	H	α-helix	trans	-69.4	-29	-179.7	-146.6	74.3	0	0	0	113.1	Q106 K112 M113	Q106-L110 PolarHBondContact O-N 2.87Å; Q106-L110 VanDerWaalsContact O-N 3.1Å; L110-K112 VanDerWaalsContact C-N 3.26Å; L110-K112 PolarHBondContact O-N 2.72Å; L110-M113 HydrophobicContact CD1-SD 4.23Å; L110-M113 WeakPolarHBondContact O-CB 3.39Å; L110-M113 PolarHBondContact O-N 3.24Å
111	N	56.5	Low	57	Low	138 Å²	138	105 Å²	105	74%	0.738	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-7.4	-176.9	-149.5	32.8	0	0	0	114.2	C109	C109-N111 VanDerWaalsContact C-N 3.31Å; C109-N111 PolarHBondContact O-N 3.28Å
112	K	57.5	Low	58	Low	182 Å²	182	103.3 Å²	103.3	79%	0.791	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.1	1.7	174.9	-72.1	-169.9	174.3	-169.7	0	112.9	C109 L110 T114	C109-K112 PolarHBondContact O-N 2.94Å; L110-K112 VanDerWaalsContact C-N 3.26Å; L110-K112 PolarHBondContact O-N 2.72Å; K112-T114 PolarHBondContact O-N 3.23Å
113	M	61	Low	59.1	Low	63 Å²	63	107 Å²	107	31%	0.31	54%	0.544	S	S	.	.			trans	-74.6	124.9	-176.1	-159.9	153.3	-178.4	0	0	109.1	L110 D117 L121	L110-M113 HydrophobicContact CD1-SD 4.23Å; L110-M113 WeakPolarHBondContact O-CB 3.39Å; L110-M113 PolarHBondContact O-N 3.24Å; M113-D117 HydrophobicContact CE-CB 3.65Å; M113-D117 WeakPolarHBondContact CE-O 3.21Å; M113-D117 HydrophobicContact CG-CB 3.4Å; M113-D117 VanDerWaalsContact CG-CB 3.4Å; M113-D117 HydrophobicContact SD-CB 4.39Å; M113-L121 HydrophobicContact CE-CB 3.92Å; M113-L121 HydrophobicContact CE-CD1 4.45Å; M113-L121 HydrophobicContact CE-CD2 4Å; M113-L121 HydrophobicContact CE-CG 4.33Å
114	T	68.5	Low	59.9	Low	67 Å²	67	101.3 Å²	101.3	41%	0.411	53%	0.528	S	S	.	.			trans	-67.8	154.2	177.5	65.9	0	0	0	0	109.5	K112 Q116 D117 L118	K112-T114 PolarHBondContact O-N 3.23Å; T114-Q116 PolarHBondContact O-N 2.97Å; T114-Q116 VanDerWaalsContact O-N 3.11Å; T114-D117 PolarHBondContact N-OD2 3.11Å; T114-D117 WeakPolarHBondContact O-CB 3.27Å; T114-D117 PolarHBondContact O-N 3.01Å; T114-D117 PolarHBondContact OG1-N 3.44Å; T114-D117 PolarHBondContact OG1-OD2 3.26Å; T114-L118 PolarHBondContact O-N 3.47Å
115	P	62.4	Low	60.4	Low	70 Å²	70	100.3 Å²	100.3	46%	0.455	52%	0.518	S	S	.	.	H	α-helix	trans	-54	-31.4	174.4	-27	35	0	0	0	112.8	L118 I119	P115-L118 PolarHBondContact O-N 3.3Å; P115-I119 WeakPolarHBondContact O-CB 3.36Å; P115-I119 WeakPolarHBondContact O-CD1 3.39Å; P115-I119 WeakPolarHBondContact O-CG1 3.12Å; P115-I119 PolarHBondContact O-N 3.15Å
116	Q	65.1	Low	61	Low	151 Å²	151	98.9 Å²	98.9	71%	0.706	51%	0.507	S	S	*	.	H	α-helix	trans	-68.9	-39.3	176	-68.9	-166.4	-7.3	0	0	113	T114 L118 I119 S120	T114-Q116 PolarHBondContact O-N 2.97Å; T114-Q116 VanDerWaalsContact O-N 3.11Å; Q116-L118 VanDerWaalsContact C-N 3.33Å; Q116-I119 PolarHBondContact O-N 3.05Å; Q116-S120 WeakPolarHBondContact O-CB 3.47Å; Q116-S120 PolarHBondContact O-N 2.91Å; Q116-S120 PolarHBondContact O-OG 3.23Å
117	D	67.7	Low	61.5	Low	75 Å²	75	96.6 Å²	96.6	40%	0.401	50%	0.504	S	S	.	.	H	α-helix	trans	-65.4	-40.5	174.4	-64.7	-41.6	0	0	0	110.7	M113 T114 I119 S120 L121	M113-D117 HydrophobicContact CE-CB 3.65Å; M113-D117 WeakPolarHBondContact CE-O 3.21Å; M113-D117 HydrophobicContact CG-CB 3.4Å; M113-D117 VanDerWaalsContact CG-CB 3.4Å; M113-D117 HydrophobicContact SD-CB 4.39Å; T114-D117 PolarHBondContact N-OD2 3.11Å; T114-D117 WeakPolarHBondContact O-CB 3.27Å; T114-D117 PolarHBondContact O-N 3.01Å; T114-D117 PolarHBondContact OG1-N 3.44Å; T114-D117 PolarHBondContact OG1-OD2 3.26Å; D117-I119 VanDerWaalsContact C-N 3.35Å; D117-S120 PolarHBondContact O-N 3.45Å; D117-L121 VanDerWaalsContact O-CB 3.31Å; D117-L121 WeakPolarHBondContact O-CB 3.38Å; D117-L121 PolarHBondContact O-N 2.84Å
118	L	65.9	Low	61.7	Low	48 Å²	48	95.2 Å²	95.2	25%	0.251	50%	0.5	S	S	.	.	H	α-helix	trans	-63.2	-42.2	176.5	-175.4	67.3	0	0	0	111.5	T114 P115 Q116 L121 L122 L147	T114-L118 PolarHBondContact O-N 3.47Å; P115-L118 PolarHBondContact O-N 3.3Å; Q116-L118 VanDerWaalsContact C-N 3.33Å; L118-L121 PolarHBondContact O-N 3.42Å; L118-L122 WeakPolarHBondContact O-CB 3.18Å; L118-L122 PolarHBondContact O-N 3.48Å; L118-L147 HydrophobicContact CD2-CD2 4.48Å
119	I	64.8	Low	62.1	Low	71 Å²	71	90.2 Å²	90.2	36%	0.364	48%	0.481	S	S	.	.	H	α-helix	trans	-64.7	-43.7	175.5	-72.1	164.8	0	0	0	110.5	P115 Q116 D117 L121 L122 F123	P115-I119 WeakPolarHBondContact O-CB 3.36Å; P115-I119 WeakPolarHBondContact O-CD1 3.39Å; P115-I119 WeakPolarHBondContact O-CG1 3.12Å; P115-I119 PolarHBondContact O-N 3.15Å; Q116-I119 PolarHBondContact O-N 3.05Å; D117-I119 VanDerWaalsContact C-N 3.35Å; I119-L121 VanDerWaalsContact C-N 3.32Å; I119-L121 PolarHBondContact O-N 3.47Å; I119-L122 WeakPolarHBondContact O-CB 3.44Å; I119-L122 PolarHBondContact O-N 3.25Å; I119-F123 HydrophobicContact CG2-CD2 3.5Å; I119-F123 HydrophobicContact CG2-CE2 3.42Å; I119-F123 VanDerWaalsContact CG2-CE2 3.42Å; I119-F123 WeakPolarHBondContact O-CD2 3.46Å; I119-F123 PolarHBondContact O-N 3.26Å
120	S	69.7	Low	62.1	Low	75 Å²	75	95 Å²	95	52%	0.524	49%	0.492	S	S	.	.	H	α-helix	trans	-63.5	-40.1	176.9	-60.3	0	0	0	0	111.6	Q116 D117 F123 S124	Q116-S120 WeakPolarHBondContact O-CB 3.47Å; Q116-S120 PolarHBondContact O-N 2.91Å; Q116-S120 PolarHBondContact O-OG 3.23Å; D117-S120 PolarHBondContact O-N 3.45Å; S120-F123 PolarHBondContact O-N 3.23Å; S120-S124 WeakPolarHBondContact O-CB 3.49Å; S120-S124 PolarHBondContact O-N 2.91Å
121	L	69.3	Low	61.9	Low	73 Å²	73	97.1 Å²	97.1	38%	0.382	51%	0.508	S	S	.	.	H	α-helix	trans	-61.8	-47.7	173.2	-167	74.7	0	0	0	110.1	M113 D117 L118 I119 F123 S124 L125	M113-L121 HydrophobicContact CE-CB 3.92Å; M113-L121 HydrophobicContact CE-CD1 4.45Å; M113-L121 HydrophobicContact CE-CD2 4Å; M113-L121 HydrophobicContact CE-CG 4.33Å; D117-L121 VanDerWaalsContact O-CB 3.31Å; D117-L121 WeakPolarHBondContact O-CB 3.38Å; D117-L121 PolarHBondContact O-N 2.84Å; L118-L121 PolarHBondContact O-N 3.42Å; I119-L121 VanDerWaalsContact C-N 3.32Å; I119-L121 PolarHBondContact O-N 3.47Å; L121-F123 PolarHBondContact O-N 3.39Å; L121-S124 PolarHBondContact O-N 3Å; L121-S124 VanDerWaalsContact O-N 3.09Å; L121-S124 PolarHBondContact O-OG 2.81Å; L121-L125 HydrophobicContact CD2-CD1 4.5Å; L121-L125 HydrophobicContact CG-CD1 3.92Å; L121-L125 WeakPolarHBondContact O-CD1 3.18Å; L121-L125 PolarHBondContact O-N 2.96Å
122	L	67	Low	61.5	Low	81 Å²	81	94.7 Å²	94.7	42%	0.424	49%	0.494	S	S	.	.	H	α-helix	trans	-57.8	-47.8	177	-168.5	70	0	0	0	111.2	L118 I119 S124 L125 I126	L118-L122 WeakPolarHBondContact O-CB 3.18Å; L118-L122 PolarHBondContact O-N 3.48Å; I119-L122 WeakPolarHBondContact O-CB 3.44Å; I119-L122 PolarHBondContact O-N 3.25Å; L122-S124 VanDerWaalsContact C-N 3.29Å; L122-S124 PolarHBondContact O-N 3.13Å; L122-L125 PolarHBondContact O-N 3.39Å; L122-L125 VanDerWaalsContact O-N 3.11Å; L122-I126 VanDerWaalsContact O-CG1 3.31Å; L122-I126 WeakPolarHBondContact O-CG1 3.49Å; L122-I126 PolarHBondContact O-N 2.92Å
123	F	67.9	Low	61	Low	138 Å²	138	92.2 Å²	92.2	61%	0.605	49%	0.486	S	S	*	.	H	α-helix	trans	-63.3	-31.5	175.9	-81.7	-67	0	0	0	113.5	I119 S120 L121 L125 I126 P127	I119-F123 HydrophobicContact CG2-CD2 3.5Å; I119-F123 HydrophobicContact CG2-CE2 3.42Å; I119-F123 VanDerWaalsContact CG2-CE2 3.42Å; I119-F123 WeakPolarHBondContact O-CD2 3.46Å; I119-F123 PolarHBondContact O-N 3.26Å; S120-F123 PolarHBondContact O-N 3.23Å; L121-F123 PolarHBondContact O-N 3.39Å; F123-L125 VanDerWaalsContact C-N 3.33Å; F123-I126 HydrophobicContact CD1-CD1 3.89Å; F123-I126 HydrophobicContact CE1-CD1 4.27Å; F123-P127 WeakPolarHBondContact O-CD 3.35Å
124	S	67.2	Low	60.6	Low	65 Å²	65	92.6 Å²	92.6	46%	0.455	49%	0.486	S	S	.	.	H	α-helix	trans	-72.1	-27.4	174.3	77	0	0	0	0	113.2	S120 L121 L122	S120-S124 WeakPolarHBondContact O-CB 3.49Å; S120-S124 PolarHBondContact O-N 2.91Å; L121-S124 PolarHBondContact O-N 3Å; L121-S124 VanDerWaalsContact O-N 3.09Å; L121-S124 PolarHBondContact O-OG 2.81Å; L122-S124 VanDerWaalsContact C-N 3.29Å; L122-S124 PolarHBondContact O-N 3.13Å
125	L	62.7	Low	59.6	Low	76 Å²	76	94.5 Å²	94.5	40%	0.398	50%	0.502	S	S	.	.	H	α-helix	trans	-83.9	-32.6	177.9	-87.7	134.1	0	0	0	112.5	L121 L122 F123 Q128 I129	L121-L125 HydrophobicContact CD2-CD1 4.5Å; L121-L125 HydrophobicContact CG-CD1 3.92Å; L121-L125 WeakPolarHBondContact O-CD1 3.18Å; L121-L125 PolarHBondContact O-N 2.96Å; L122-L125 PolarHBondContact O-N 3.39Å; L122-L125 VanDerWaalsContact O-N 3.11Å; F123-L125 VanDerWaalsContact C-N 3.33Å; L125-Q128 WeakPolarHBondContact O-CB 3.31Å; L125-Q128 PolarHBondContact O-N 3.3Å; L125-I129 WeakPolarHBondContact O-CG1 3.35Å; L125-I129 PolarHBondContact O-N 2.92Å
126	I	61.5	Low	59	Low	53 Å²	53	98.8 Å²	98.8	27%	0.272	52%	0.516	S	S	.	.	G	3₁₀ helix	trans	-50	-46.1	-179.2	-73.2	166.5	0	0	0	113.3	F13 L122 F123 Q128 I129	F13-I126 HydrophobicContact CE1-CG2 4.48Å; F13-I126 HydrophobicContact CZ-CG1 4.48Å; F13-I126 HydrophobicContact CZ-CG2 3.78Å; L122-I126 VanDerWaalsContact O-CG1 3.31Å; L122-I126 WeakPolarHBondContact O-CG1 3.49Å; L122-I126 PolarHBondContact O-N 2.92Å; F123-I126 HydrophobicContact CD1-CD1 3.89Å; F123-I126 HydrophobicContact CE1-CD1 4.27Å; I126-Q128 VanDerWaalsContact C-N 3.26Å; I126-Q128 PolarHBondContact O-N 3.29Å; I126-I129 PolarHBondContact O-N 3.06Å
127	P	54.5	Low	58.6	Low	88 Å²	88	94.1 Å²	94.1	57%	0.571	50%	0.496	S	S	*	.	G	3₁₀ helix	trans	-64.7	-27	177.9	-22.5	32.5	0	0	0	114.1	F123 I129	F123-P127 WeakPolarHBondContact O-CD 3.35Å; P127-I129 VanDerWaalsContact C-N 3.32Å
128	Q	54	Low	58.4	Low	143 Å²	143	96.8 Å²	96.8	67%	0.668	51%	0.506	S	S	*	.	G	3₁₀ helix	trans	-80.4	-14.5	-178.4	-59.3	-167.6	11.2	0	0	112.8	L125 I126 K130	L125-Q128 WeakPolarHBondContact O-CB 3.31Å; L125-Q128 PolarHBondContact O-N 3.3Å; I126-Q128 VanDerWaalsContact C-N 3.26Å; I126-Q128 PolarHBondContact O-N 3.29Å; Q128-K130 PolarHBondContact O-N 3.24Å
129	I	56.8	Low	58.3	Low	60 Å²	60	99.5 Å²	99.5	31%	0.308	52%	0.52	S	S	.	.	G	3₁₀ helix	trans	-85.1	5.6	-176.3	-54.5	161.7	0	0	0	112.1	L125 I126 P127 T131 F134	L125-I129 WeakPolarHBondContact O-CG1 3.35Å; L125-I129 PolarHBondContact O-N 2.92Å; I126-I129 PolarHBondContact O-N 3.06Å; P127-I129 VanDerWaalsContact C-N 3.32Å; I129-T131 PolarHBondContact O-N 3.1Å; I129-F134 HydrophobicContact CG2-CD2 3.87Å; I129-F134 HydrophobicContact CG2-CE2 3.36Å; I129-F134 HydrophobicContact CG2-CZ 4.39Å
130	K	51.6	Low	58	Low	189 Å²	189	98.1 Å²	98.1	82%	0.822	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	2.4	-177.2	-103.4	-173.2	176.1	-174.7	0	116.4	Q128	Q128-K130 PolarHBondContact O-N 3.24Å
131	T	47.6	Very low	57.6	Low	133 Å²	133	100.5 Å²	100.5	82%	0.816	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-150.9	7.7	-171.2	10.2	0	0	0	0	115.8	I129	I129-T131 PolarHBondContact O-N 3.1Å
132	I	47.9	Very low	57.7	Low	87 Å²	87	102 Å²	102	45%	0.446	52%	0.523	S	S	.	.	S	Bend	trans	-103.9	117.8	-178.4	-52.6	175.1	0	0	0	108	F134	I132-F134 PolarHBondContact O-N 3.41Å
133	E	47.8	Very low	57.6	Low	130 Å²	130	102.3 Å²	102.3	61%	0.607	53%	0.525	S	S	*	.			trans	-50.5	103.8	170.1	-75.7	-174.1	160.9	0	0	109.6	S135	E133-S135 PolarHBondContact O-N 3.47Å; E133-S135 VanDerWaalsContact O-N 3.12Å
134	F	52.2	Low	57.5	Low	72 Å²	72	98.3 Å²	98.3	32%	0.316	52%	0.517	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-17.4	-175	-126.6	-89.2	0	0	0	112.4	I129 I132 L140	I129-F134 HydrophobicContact CG2-CD2 3.87Å; I129-F134 HydrophobicContact CG2-CE2 3.36Å; I129-F134 HydrophobicContact CG2-CZ 4.39Å; I132-F134 PolarHBondContact O-N 3.41Å; F134-L140 HydrophobicContact CB-CD1 4.37Å; F134-L140 HydrophobicContact CD1-CD1 3.45Å; F134-L140 VanDerWaalsContact CD1-CD1 3.45Å; F134-L140 HydrophobicContact CD1-CG 4.49Å; F134-L140 HydrophobicContact CD2-CD1 4.17Å; F134-L140 HydrophobicContact CE1-CD1 3.64Å; F134-L140 HydrophobicContact CE1-CD2 3.88Å; F134-L140 HydrophobicContact CE1-CG 4.28Å; F134-L140 HydrophobicContact CE2-CD1 4.38Å; F134-L140 HydrophobicContact CG-CD1 3.71Å; F134-L140 HydrophobicContact CZ-CD1 4.11Å; F134-L140 HydrophobicContact CZ-CD2 3.93Å
135	S	48	Very low	57.6	Low	107 Å²	107	97.9 Å²	97.9	75%	0.748	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-16.9	-171.3	57.9	0	0	0	0	114.8	E133	E133-S135 PolarHBondContact O-N 3.47Å; E133-S135 VanDerWaalsContact O-N 3.12Å
136	Q	50.6	Low	58.1	Low	159 Å²	159	98.4 Å²	98.4	74%	0.743	51%	0.514	S	S	*	.	S	Bend	trans	-116.1	-0.9	-174	-67.1	-166.5	3.1	0	0	115	E138	Q136-E138 PolarHBondContact O-N 3.25Å
137	N	56.9	Low	58.5	Low	54 Å²	54	98.1 Å²	98.1	29%	0.289	51%	0.513	S	S	.	.			trans	-94.8	101.6	-171.7	-154.4	-31.6	0	0	0	111.7	N139 L140	N137-N139 PolarHBondContact O-N 2.98Å; N137-N139 WeakPolarHBondContact OD1-CB 3.48Å; N137-N139 VanDerWaalsContact OD1-CG 3.29Å; N137-N139 PolarHBondContact OD1-N 3.46Å; N137-N139 PolarHBondContact OD1-ND2 3.45Å; N137-L140 HydrophobicContact CB-CD1 4Å; N137-L140 HydrophobicContact CB-CG 4.26Å; N137-L140 PolarHBondContact O-N 3.33Å
138	E	63.4	Low	59.3	Low	131 Å²	131	100.1 Å²	100.1	61%	0.612	52%	0.515	S	S	*	.	H	α-helix	trans	-49.8	-26.4	169.9	-71.8	-169.1	177.9	0	0	113	Q136 L140 L141 K142	Q136-E138 PolarHBondContact O-N 3.25Å; E138-L140 VanDerWaalsContact C-N 3.3Å; E138-L140 PolarHBondContact O-N 3.3Å; E138-L141 PolarHBondContact O-N 2.87Å; E138-K142 WeakPolarHBondContact O-CG 3.39Å; E138-K142 PolarHBondContact O-N 3.38Å; E138-K142 IonicContact OE2-NZ 2.87Å; E138-K142 PolarHBondContact OE2-NZ 3.24Å
139	N	62.3	Low	60.3	Low	104 Å²	104	100 Å²	100	56%	0.556	51%	0.512	S	S	*	.	H	α-helix	trans	-70.2	-27.2	-179.8	-57.1	-50.4	0	0	0	112.5	N137 L143	N137-N139 PolarHBondContact O-N 2.98Å; N137-N139 WeakPolarHBondContact OD1-CB 3.48Å; N137-N139 VanDerWaalsContact OD1-CG 3.29Å; N137-N139 PolarHBondContact OD1-N 3.46Å; N137-N139 PolarHBondContact OD1-ND2 3.45Å; N139-L143 VanDerWaalsContact O-CB 3.27Å; N139-L143 WeakPolarHBondContact O-CB 3.44Å; N139-L143 PolarHBondContact O-N 3.35Å
140	L	59.2	Low	60.7	Low	42 Å²	42	99.7 Å²	99.7	22%	0.22	51%	0.511	C	S	.	.	H	α-helix	trans	-73	-38.7	174.6	-74.7	166.5	0	0	0	111.4	F134 N137 E138 L143 A144	F134-L140 HydrophobicContact CB-CD1 4.37Å; F134-L140 HydrophobicContact CD1-CD1 3.45Å; F134-L140 VanDerWaalsContact CD1-CD1 3.45Å; F134-L140 HydrophobicContact CD1-CG 4.49Å; F134-L140 HydrophobicContact CD2-CD1 4.17Å; F134-L140 HydrophobicContact CE1-CD1 3.64Å; F134-L140 HydrophobicContact CE1-CD2 3.88Å; F134-L140 HydrophobicContact CE1-CG 4.28Å; F134-L140 HydrophobicContact CE2-CD1 4.38Å; F134-L140 HydrophobicContact CG-CD1 3.71Å; F134-L140 HydrophobicContact CZ-CD1 4.11Å; F134-L140 HydrophobicContact CZ-CD2 3.93Å; N137-L140 HydrophobicContact CB-CD1 4Å; N137-L140 HydrophobicContact CB-CG 4.26Å; N137-L140 PolarHBondContact O-N 3.33Å; E138-L140 VanDerWaalsContact C-N 3.3Å; E138-L140 PolarHBondContact O-N 3.3Å; L140-L143 PolarHBondContact O-N 3.21Å; L140-A144 WeakPolarHBondContact O-CB 3.33Å; L140-A144 PolarHBondContact O-N 3.4Å
141	L	61.5	Low	61.3	Low	126 Å²	126	93.4 Å²	93.4	66%	0.66	48%	0.483	S	S	*	.	H	α-helix	trans	-63.8	-45.1	172.7	-173.5	65	0	0	0	110.6	E138 L143 A144 T145	E138-L141 PolarHBondContact O-N 2.87Å; L141-L143 VanDerWaalsContact C-N 3.29Å; L141-L143 PolarHBondContact O-N 3.39Å; L141-A144 PolarHBondContact O-N 2.96Å; L141-T145 PolarHBondContact O-N 2.99Å; L141-T145 PolarHBondContact O-OG1 2.91Å
142	K	70.5	Confident	62.3	Low	104 Å²	104	92.8 Å²	92.8	45%	0.452	47%	0.471	S	S	.	.	H	α-helix	trans	-59.4	-40.7	174.1	-72.1	167.4	-170.4	157.6	0	111.6	E138 T145 I146	E138-K142 WeakPolarHBondContact O-CG 3.39Å; E138-K142 PolarHBondContact O-N 3.38Å; E138-K142 IonicContact OE2-NZ 2.87Å; E138-K142 PolarHBondContact OE2-NZ 3.24Å; K142-T145 PolarHBondContact O-N 3.49Å; K142-I146 WeakPolarHBondContact O-CD1 3.48Å; K142-I146 WeakPolarHBondContact O-CG1 3.2Å; K142-I146 PolarHBondContact O-N 2.92Å
143	L	65	Low	62.9	Low	87 Å²	87	95 Å²	95	46%	0.455	48%	0.48	S	S	.	.	H	α-helix	trans	-65.3	-43.9	177.1	-172.4	67.1	0	0	0	111.6	N139 L140 L141 T145 I146 L147	N139-L143 VanDerWaalsContact O-CB 3.27Å; N139-L143 WeakPolarHBondContact O-CB 3.44Å; N139-L143 PolarHBondContact O-N 3.35Å; L140-L143 PolarHBondContact O-N 3.21Å; L141-L143 VanDerWaalsContact C-N 3.29Å; L141-L143 PolarHBondContact O-N 3.39Å; L143-T145 PolarHBondContact O-N 3.45Å; L143-I146 PolarHBondContact O-N 3.39Å; L143-L147 HydrophobicContact CG-CD1 4.38Å; L143-L147 WeakPolarHBondContact O-CG 3.21Å; L143-L147 PolarHBondContact O-N 2.99Å
144	A	65.4	Low	63.2	Low	54 Å²	54	92.9 Å²	92.9	45%	0.446	47%	0.47	S	S	.	.	H	α-helix	trans	-59.7	-45.8	175.7	0	0	0	0	0	111.5	L140 L141 I146 L147 E148	L140-A144 WeakPolarHBondContact O-CB 3.33Å; L140-A144 PolarHBondContact O-N 3.4Å; L141-A144 PolarHBondContact O-N 2.96Å; A144-I146 VanDerWaalsContact C-N 3.31Å; A144-I146 PolarHBondContact O-N 2.93Å; A144-L147 PolarHBondContact O-N 3.13Å; A144-E148 WeakPolarHBondContact O-CB 3.4Å; A144-E148 PolarHBondContact O-N 2.95Å
145	T	70.2	Confident	63.3	Low	57 Å²	57	92.1 Å²	92.1	35%	0.35	47%	0.473	S	S	.	.	H	α-helix	trans	-63.4	-36.3	176.3	-49.7	0	0	0	0	112.4	L141 K142 L143 K149	L141-T145 PolarHBondContact O-N 2.99Å; L141-T145 PolarHBondContact O-OG1 2.91Å; K142-T145 PolarHBondContact O-N 3.49Å; L143-T145 PolarHBondContact O-N 3.45Å; T145-K149 WeakPolarHBondContact O-CG 3.37Å; T145-K149 PolarHBondContact O-N 3.33Å; T145-K149 VanDerWaalsContact O-N 3.1Å
146	I	74.2	Confident	63.5	Low	86 Å²	86	96.7 Å²	96.7	44%	0.441	47%	0.474	S	S	.	.	H	α-helix	trans	-66.9	-44.5	176	-71.2	164	0	0	0	110.4	K142 L143 A144 K149 I150	K142-I146 WeakPolarHBondContact O-CD1 3.48Å; K142-I146 WeakPolarHBondContact O-CG1 3.2Å; K142-I146 PolarHBondContact O-N 2.92Å; L143-I146 PolarHBondContact O-N 3.39Å; A144-I146 VanDerWaalsContact C-N 3.31Å; A144-I146 PolarHBondContact O-N 2.93Å; I146-K149 PolarHBondContact O-N 3.12Å; I146-I150 HydrophobicContact CG2-CD1 3.76Å; I146-I150 HydrophobicContact CG2-CG1 4.46Å; I146-I150 VanDerWaalsContact O-CG1 3.3Å; I146-I150 WeakPolarHBondContact O-CG1 3.39Å; I146-I150 PolarHBondContact O-N 3.39Å
147	L	68.8	Low	63.5	Low	47 Å²	47	94.4 Å²	94.4	25%	0.246	47%	0.471	C	S	.	.	H	α-helix	trans	-61.1	-46.4	177.4	-73.1	170.6	0	0	0	111	L118 L143 A144 K149 I150 F151	L118-L147 HydrophobicContact CD2-CD2 4.48Å; L143-L147 HydrophobicContact CG-CD1 4.38Å; L143-L147 WeakPolarHBondContact O-CG 3.21Å; L143-L147 PolarHBondContact O-N 2.99Å; A144-L147 PolarHBondContact O-N 3.13Å; L147-K149 VanDerWaalsContact C-N 3.33Å; L147-K149 PolarHBondContact O-N 3.24Å; L147-I150 PolarHBondContact O-N 3.38Å; L147-I150 VanDerWaalsContact O-N 3.13Å; L147-F151 WeakPolarHBondContact O-CD2 3.42Å; L147-F151 PolarHBondContact O-N 3.33Å
148	E	71.7	Confident	63.1	Low	131 Å²	131	99.5 Å²	99.5	61%	0.612	49%	0.493	S	S	*	.	H	α-helix	trans	-56.2	-47	176.8	-169.5	174.5	-158.5	0	0	111.6	A144 I150 F151 E152	A144-E148 WeakPolarHBondContact O-CB 3.4Å; A144-E148 PolarHBondContact O-N 2.95Å; E148-I150 VanDerWaalsContact C-N 3.34Å; E148-I150 PolarHBondContact O-N 3Å; E148-F151 PolarHBondContact O-N 2.93Å; E148-E152 WeakPolarHBondContact O-CB 3.3Å; E148-E152 PolarHBondContact O-N 3.3Å
149	K	74.4	Confident	62.3	Low	141 Å²	141	101.6 Å²	101.6	61%	0.613	50%	0.502	S	S	*	.	H	α-helix	trans	-62	-38.3	176.2	-75.2	-178.8	179.6	-176.6	0	113.3	T145 I146 L147 Q153	T145-K149 WeakPolarHBondContact O-CG 3.37Å; T145-K149 PolarHBondContact O-N 3.33Å; T145-K149 VanDerWaalsContact O-N 3.1Å; I146-K149 PolarHBondContact O-N 3.12Å; L147-K149 VanDerWaalsContact C-N 3.33Å; L147-K149 PolarHBondContact O-N 3.24Å; K149-Q153 WeakPolarHBondContact O-CG 3.41Å; K149-Q153 PolarHBondContact O-N 3.48Å; K149-Q153 VanDerWaalsContact O-N 3.08Å
150	I	66.2	Low	61.5	Low	53 Å²	53	100.9 Å²	100.9	27%	0.272	51%	0.506	S	S	.	.	H	α-helix	trans	-67.9	-44.5	178.4	-69.8	167.7	0	0	0	110.3	I146 L147 E148 E152 Q153 Q154	I146-I150 HydrophobicContact CG2-CD1 3.76Å; I146-I150 HydrophobicContact CG2-CG1 4.46Å; I146-I150 VanDerWaalsContact O-CG1 3.3Å; I146-I150 WeakPolarHBondContact O-CG1 3.39Å; I146-I150 PolarHBondContact O-N 3.39Å; L147-I150 PolarHBondContact O-N 3.38Å; L147-I150 VanDerWaalsContact O-N 3.13Å; E148-I150 VanDerWaalsContact C-N 3.34Å; E148-I150 PolarHBondContact O-N 3Å; I150-E152 VanDerWaalsContact C-N 3.34Å; I150-E152 PolarHBondContact O-N 3.08Å; I150-Q153 PolarHBondContact O-N 3.34Å; I150-Q154 PolarHBondContact O-N 3.1Å; I150-Q154 VanDerWaalsContact O-N 3.12Å
151	F	64.3	Low	60.8	Low	57 Å²	57	103.9 Å²	103.9	25%	0.25	53%	0.53	C	S	.	.	H	α-helix	trans	-65.5	-37.3	178.3	-83.3	-71.1	0	0	0	112.4	I6 L147 E148 Q154 S155	I6-F151 HydrophobicContact CG2-CZ 3.97Å; L147-F151 WeakPolarHBondContact O-CD2 3.42Å; L147-F151 PolarHBondContact O-N 3.33Å; E148-F151 PolarHBondContact O-N 2.93Å; F151-Q154 PolarHBondContact O-N 3.44Å; F151-S155 PolarHBondContact O-N 3.37Å; F151-S155 VanDerWaalsContact O-N 3.11Å
152	E	67.7	Low	60	Low	120 Å²	120	103.1 Å²	103.1	56%	0.561	53%	0.532	S	S	*	.	H	α-helix	trans	-71.2	-31.5	177.3	-165.7	160.8	-165.6	0	0	112.8	E148 I150 S155 R156	E148-E152 WeakPolarHBondContact O-CB 3.3Å; E148-E152 PolarHBondContact O-N 3.3Å; I150-E152 VanDerWaalsContact C-N 3.34Å; I150-E152 PolarHBondContact O-N 3.08Å; E152-S155 PolarHBondContact O-OG 3.45Å; E152-R156 PolarHBondContact O-N 3.41Å
153	Q	60.8	Low	58.9	Low	133 Å²	133	104.7 Å²	104.7	62%	0.621	55%	0.551	S	S	*	*	H	α-helix	trans	-68.4	-36.4	170.7	-74.8	-158.3	2.8	0	0	112.6	K149 I150 R156 V157	K149-Q153 WeakPolarHBondContact O-CG 3.41Å; K149-Q153 PolarHBondContact O-N 3.48Å; K149-Q153 VanDerWaalsContact O-N 3.08Å; I150-Q153 PolarHBondContact O-N 3.34Å; Q153-R156 PolarHBondContact O-N 3.37Å; Q153-V157 WeakPolarHBondContact O-CG2 3.45Å
154	Q	53.4	Low	58.4	Low	86 Å²	86	109.6 Å²	109.6	40%	0.402	57%	0.569	S	S	.	*	H	α-helix	trans	-69.3	-33.4	176.5	-71.1	-157.8	1.9	0	0	112.9	I150 F151 R156 V157	I150-Q154 PolarHBondContact O-N 3.1Å; I150-Q154 VanDerWaalsContact O-N 3.12Å; F151-Q154 PolarHBondContact O-N 3.44Å; Q154-R156 VanDerWaalsContact C-N 3.32Å; Q154-R156 PolarHBondContact O-N 3.11Å; Q154-V157 PolarHBondContact O-N 3.31Å
155	S	55.1	Low	57.6	Low	56 Å²	56	112.7 Å²	112.7	39%	0.392	58%	0.582	S	S	.	*	H	α-helix	trans	-68.2	-29.4	177.1	76.1	0	0	0	0	113.2	F151 E152	F151-S155 PolarHBondContact O-N 3.37Å; F151-S155 VanDerWaalsContact O-N 3.11Å; E152-S155 PolarHBondContact O-OG 3.45Å
156	R	51.9	Low	56.7	Low	203 Å²	203	115.8 Å²	115.8	77%	0.766	60%	0.603	S	S	*	*	H	α-helix	trans	-74.2	-27.5	175.9	-86.4	-170.5	175.7	-149.2	0.1	114	E152 Q153 Q154	E152-R156 PolarHBondContact O-N 3.41Å; Q153-R156 PolarHBondContact O-N 3.37Å; Q154-R156 VanDerWaalsContact C-N 3.32Å; Q154-R156 PolarHBondContact O-N 3.11Å
157	V	51.3	Low	55.6	Low	110 Å²	110	116.1 Å²	116.1	67%	0.667	62%	0.619	S	S	*	*	H	α-helix	trans	-76.8	-25.6	-177.1	176.3	0	0	0	0	112.2	Q153 Q154 H159	Q153-V157 WeakPolarHBondContact O-CG2 3.45Å; Q154-V157 PolarHBondContact O-N 3.31Å; V157-H159 VanDerWaalsContact C-N 3.28Å; V157-H159 PolarHBondContact O-N 3Å
158	E	48.9	Very low	55.1	Low	162 Å²	162	119.9 Å²	119.9	76%	0.757	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.8	-7.6	176.9	-81.1	-165.7	139	0	0	114.6
159	H	46.6	Very low	54	Low	174 Å²	174	123 Å²	123	81%	0.806	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.2	2	-177.8	-77.4	-50.7	0	0	0	116	V157	V157-H159 VanDerWaalsContact C-N 3.28Å; V157-H159 PolarHBondContact O-N 3Å
160	S	44.3	Very low	53.4	Low	90 Å²	90	122.6 Å²	122.6	63%	0.629	65%	0.654	S	S	*	*			trans	-101.8	72.5	169.8	62.6	0	0	0	0	110.9
161	S	44.1	Very low	52.7	Low	105 Å²	105	128.9 Å²	128.9	73%	0.734	68%	0.679	S	S	*	*			trans	-70.3	124.8	170.1	-159.5	0	0	0	0	109.8	T163	S161-T163 PolarHBondContact O-N 3.28Å
162	P	46.4	Very low	52.4	Low	109 Å²	109	138.7 Å²	138.7	71%	0.708	73%	0.726	S	S	*	*			trans	-79.8	101.7	170.2	30.8	-27.6	0	0	0	108	K164	P162-K164 VanDerWaalsContact C-N 3.33Å; P162-K164 PolarHBondContact O-N 2.86Å
163	T	46.2	Very low	51.6	Low	137 Å²	137	139.6 Å²	139.6	84%	0.84	73%	0.734	S	S	*	*			trans	-63.3	98.2	169.3	-48	0	0	0	0	108.4	S161 T165	S161-T163 PolarHBondContact O-N 3.28Å; T163-T165 PolarHBondContact O-N 3.33Å
164	K	53.8	Low	51.1	Low	190 Å²	190	139.9 Å²	139.9	83%	0.826	74%	0.74	S	S	*	*			trans	-59.2	121.8	174.9	-79	179	174.6	178.4	0	110.2	P162	P162-K164 VanDerWaalsContact C-N 3.33Å; P162-K164 PolarHBondContact O-N 2.86Å
165	T	49.3	Very low	51	Low	119 Å²	119	142.9 Å²	142.9	73%	0.73	76%	0.758	S	S	*	*			trans	-51.9	130.3	161.1	-46.6	0	0	0	0	111.3	T163 A167	T163-T165 PolarHBondContact O-N 3.33Å; T165-A167 HydrophobicContact CG2-CB 4.4Å; T165-A167 PolarHBondContact O-N 3.24Å
166	P	51.3	Low	50.8	Low	123 Å²	123	148.1 Å²	148.1	80%	0.799	78%	0.78	S	S	*	*			trans	-85	88.6	159.6	31.8	-26.5	0	0	0	108.4	N168	P166-N168 PolarHBondContact O-N 3.34Å
167	A	51.5	Low	50.7	Low	93 Å²	93	144.6 Å²	144.6	77%	0.769	78%	0.781	S	S	*	*			trans	-84.7	86.2	162.4	0	0	0	0	0	107.7	T165	T165-A167 HydrophobicContact CG2-CB 4.4Å; T165-A167 PolarHBondContact O-N 3.24Å
168	N	58	Low	50.7	Low	125 Å²	125	146.9 Å²	146.9	67%	0.668	79%	0.789	S	S	*	*			trans	-113.8	85.7	166.2	-159.1	13.9	0	0	0	109	P166 I170	P166-N168 PolarHBondContact O-N 3.34Å; N168-I170 VanDerWaalsContact ND2-CD1 3.34Å; N168-I170 WeakPolarHBondContact ND2-CD1 3.34Å; N168-I170 PolarHBondContact O-N 3.3Å; N168-I170 VanDerWaalsContact OD1-CG1 3.27Å; N168-I170 WeakPolarHBondContact OD1-CG1 3.27Å
169	K	48.3	Very low	50.8	Low	198 Å²	198	145.9 Å²	145.9	86%	0.861	79%	0.791	S	S	*	*			trans	-74.5	98.1	156.2	-90.1	-178.7	173.2	-178.1	0	106.5
170	I	63.1	Low	51.1	Low	131 Å²	131	143.7 Å²	143.7	67%	0.672	79%	0.79	S	S	*	*			trans	-91.7	118.6	160.1	-65.7	-179	0	0	0	106.6	N168	N168-I170 VanDerWaalsContact ND2-CD1 3.34Å; N168-I170 WeakPolarHBondContact ND2-CD1 3.34Å; N168-I170 PolarHBondContact O-N 3.3Å; N168-I170 VanDerWaalsContact OD1-CG1 3.27Å; N168-I170 WeakPolarHBondContact OD1-CG1 3.27Å
171	F	50.3	Low	51.7	Low	185 Å²	185	148.2 Å²	148.2	81%	0.811	80%	0.803	S	S	*	*			trans	-58.6	125.9	163.3	-85.5	-108.1	0	0	0	109.7
172	H	57.7	Low	52.4	Low	263 Å²	263	152.1 Å²	152.1	100%	1.218	81%	0.809	S	S	*	*			trans	-167.5	0	136.7	-107.9	-71.1	0	0	0	109.9

Retrieved 172 of 172 residues in 182.1 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).