A0A087WQP7_MOUSE Loading...

Insulin-induced gene protein

Mediates feedback control of cholesterol synthesis.

AlphaFold DB , UniProt , Accession A0A087WQP7, Species MOUSE (Mus musculus, Mouse), Gene Insig2, Length 117 aa.

						>A0A087WQP7_MOUSE|A0A087WQP7|Insig2
MRCVAVFVGINHASAKVDFDNNFQFSLTLAALSVGLWWTFDRSRSGFGLGVGIAFLATVVTQLLVYNGVYQYTSPDFLYVRSWLPCIFFAGGITMGNIGRQLAMYECKVIAEKSHQE
					

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	42.8	Very low	51.8	Low	223 Å²	223	96.5 Å²	96.5	100%	1.099	53%	0.525	S	S	*	.				0	-26.2	0	-65.1	-153.4	-90.6	0	0	114.9
2	R	44.3	Very low	52.3	Low	223 Å²	223	98.6 Å²	98.6	84%	0.842	53%	0.528	S	S	*	.	H	α-helix	trans	-71.6	-29.4	-179.8	-68.4	-174.9	168	108.4	1.1	115.5	A5 V6	R2-A5 PolarHBondContact O-N 3.02Å; R2-V6 PolarHBondContact O-N 2.82Å
3	C	45.2	Very low	52.3	Low	42 Å²	42	95 Å²	95	28%	0.284	52%	0.52	S	S	.	.	H	α-helix	trans	-70.4	-34.6	-178.2	-57.4	0	0	0	0	113.2	A5 V6 F7 F40	C3-A5 VanDerWaalsContact C-N 3.33Å; C3-V6 PolarHBondContact O-N 3.26Å; C3-F7 WeakPolarHBondContact O-CB 3.37Å; C3-F7 PolarHBondContact O-N 3.45Å; C3-F40 HydrophobicContact CB-CE2 3.67Å; C3-F40 HydrophobicContact CB-CZ 3.66Å; C3-F40 WeakPolarHBondContact SG-CE2 3.48Å; C3-F40 WeakPolarHBondContact SG-CZ 3.21Å
4	V	50.5	Low	52.2	Low	98 Å²	98	90.3 Å²	90.3	59%	0.594	50%	0.498	S	S	*	.	H	α-helix	trans	-67.1	-38	177.1	-175.7	0	0	0	0	110.2	V6 F7 V8	V4-V6 PolarHBondContact O-N 3Å; V4-F7 PolarHBondContact O-N 3.18Å; V4-V8 HydrophobicContact CG1-CG2 4.06Å; V4-V8 VanDerWaalsContact O-CB 3.25Å; V4-V8 WeakPolarHBondContact O-CB 3.4Å; V4-V8 WeakPolarHBondContact O-CG2 3.31Å; V4-V8 PolarHBondContact O-N 2.68Å
5	A	50.2	Low	52	Low	67 Å²	67	90.3 Å²	90.3	55%	0.554	52%	0.515	S	S	*	.	H	α-helix	trans	-65	-37.4	177.3	0	0	0	0	0	112.9	R2 C3 G9	R2-A5 PolarHBondContact O-N 3.02Å; C3-A5 VanDerWaalsContact C-N 3.33Å; A5-G9 WeakPolarHBondContact O-CA 3.48Å; A5-G9 PolarHBondContact O-N 3.36Å
6	V	55.8	Low	51.7	Low	78 Å²	78	94.9 Å²	94.9	47%	0.473	53%	0.527	S	S	.	.	H	α-helix	trans	-72.8	-40.9	175.8	177.8	0	0	0	0	111	R2 C3 V4 G9 I10	R2-V6 PolarHBondContact O-N 2.82Å; C3-V6 PolarHBondContact O-N 3.26Å; V4-V6 PolarHBondContact O-N 3Å; V6-G9 PolarHBondContact O-N 3.48Å; V6-I10 HydrophobicContact CG1-CD1 3.73Å; V6-I10 HydrophobicContact CG1-CG1 4.48Å; V6-I10 WeakPolarHBondContact O-CB 3.13Å; V6-I10 VanDerWaalsContact O-CG1 3.29Å; V6-I10 WeakPolarHBondContact O-CG1 3.02Å; V6-I10 PolarHBondContact O-N 2.98Å
7	F	54.4	Low	51.4	Low	73 Å²	73	93.5 Å²	93.5	32%	0.32	52%	0.521	S	S	.	.	H	α-helix	trans	-64.1	-44.2	176.9	-167.6	-95.4	0	0	0	112.4	C3 V4 N11 L32 A90	C3-F7 WeakPolarHBondContact O-CB 3.37Å; C3-F7 PolarHBondContact O-N 3.45Å; V4-F7 PolarHBondContact O-N 3.18Å; F7-N11 WeakPolarHBondContact CE1-ND2 3.37Å; F7-N11 WeakPolarHBondContact O-CB 3.26Å; F7-N11 PolarHBondContact O-N 3.35Å; F7-N11 PolarHBondContact O-ND2 3.39Å; F7-L32 HydrophobicContact CD2-CD2 4.09Å; F7-L32 HydrophobicContact CE2-CD2 4.49Å; F7-A90 HydrophobicContact CE2-CB 3.66Å; F7-A90 HydrophobicContact CZ-CB 3.91Å
8	V	55.3	Low	51.1	Low	84 Å²	84	97.4 Å²	97.4	51%	0.509	54%	0.541	S	S	.	.	H	α-helix	trans	-69.9	-39.6	176	171.2	0	0	0	0	110.8	V4 I10 N11 H12	V4-V8 HydrophobicContact CG1-CG2 4.06Å; V4-V8 VanDerWaalsContact O-CB 3.25Å; V4-V8 WeakPolarHBondContact O-CB 3.4Å; V4-V8 WeakPolarHBondContact O-CG2 3.31Å; V4-V8 PolarHBondContact O-N 2.68Å; V8-I10 PolarHBondContact O-N 3.36Å; V8-N11 PolarHBondContact O-N 2.89Å; V8-H12 WeakPolarHBondContact O-CB 3.41Å; V8-H12 PolarHBondContact O-N 3.36Å
9	G	57.9	Low	50.9	Low	37 Å²	37	95.9 Å²	95.9	38%	0.381	53%	0.529	S	S	.	.	H	α-helix	trans	-62.8	-41.8	177.6	0	0	0	0	0	112.9	A5 V6 A13	A5-G9 WeakPolarHBondContact O-CA 3.48Å; A5-G9 PolarHBondContact O-N 3.36Å; V6-G9 PolarHBondContact O-N 3.48Å; G9-A13 WeakPolarHBondContact O-CB 3.25Å; G9-A13 PolarHBondContact O-N 3.44Å
10	I	55.6	Low	50.6	Low	56 Å²	56	99.6 Å²	99.6	29%	0.287	55%	0.547	S	S	.	.	H	α-helix	trans	-73.6	-39.5	177.1	-64.5	166.5	0	0	0	111.1	V6 V8 H12 A13 S14 T28 L32	V6-I10 HydrophobicContact CG1-CD1 3.73Å; V6-I10 HydrophobicContact CG1-CG1 4.48Å; V6-I10 WeakPolarHBondContact O-CB 3.13Å; V6-I10 VanDerWaalsContact O-CG1 3.29Å; V6-I10 WeakPolarHBondContact O-CG1 3.02Å; V6-I10 PolarHBondContact O-N 2.98Å; V8-I10 PolarHBondContact O-N 3.36Å; I10-H12 VanDerWaalsContact C-N 3.35Å; I10-A13 PolarHBondContact O-N 3.39Å; I10-S14 VanDerWaalsContact O-CB 3.25Å; I10-S14 WeakPolarHBondContact O-CB 3.28Å; I10-S14 PolarHBondContact O-N 2.99Å; I10-T28 HydrophobicContact CG2-CG2 3.73Å; I10-L32 HydrophobicContact CB-CD2 4.38Å; I10-L32 HydrophobicContact CD1-CD2 3.81Å; I10-L32 HydrophobicContact CD1-CG 4.3Å; I10-L32 HydrophobicContact CG2-CD1 3.98Å; I10-L32 HydrophobicContact CG2-CD2 4.26Å; I10-L32 HydrophobicContact CG2-CG 4.03Å
11	N	57.9	Low	50.4	Low	81 Å²	81	99.8 Å²	99.8	43%	0.433	55%	0.548	S	S	.	.	H	α-helix	trans	-62.1	-42.5	172.8	-93.7	-84.9	0	0	0	111.9	F7 V8 S14 A15	F7-N11 WeakPolarHBondContact CE1-ND2 3.37Å; F7-N11 WeakPolarHBondContact O-CB 3.26Å; F7-N11 PolarHBondContact O-N 3.35Å; F7-N11 PolarHBondContact O-ND2 3.39Å; V8-N11 PolarHBondContact O-N 2.89Å; N11-S14 PolarHBondContact O-N 3.12Å; N11-A15 VanDerWaalsContact O-CB 3.32Å; N11-A15 WeakPolarHBondContact O-CB 3.46Å; N11-A15 PolarHBondContact O-N 3.47Å
12	H	57.4	Low	50.5	Low	121 Å²	121	93.7 Å²	93.7	56%	0.56	52%	0.519	S	S	*	.	H	α-helix	trans	-67.3	-37.3	177.6	-177.6	-85.2	0	0	0	111.6	V8 I10 K16	V8-H12 WeakPolarHBondContact O-CB 3.41Å; V8-H12 PolarHBondContact O-N 3.36Å; I10-H12 VanDerWaalsContact C-N 3.35Å; H12-K16 WeakPolarHBondContact O-CB 3.42Å; H12-K16 PolarHBondContact O-N 3.36Å
13	A	52.7	Low	50.6	Low	52 Å²	52	90.4 Å²	90.4	43%	0.43	51%	0.512	S	S	.	.	H	α-helix	trans	-67.5	-40.5	171.7	0	0	0	0	0	111.7	G9 I10 K16 V17	G9-A13 WeakPolarHBondContact O-CB 3.25Å; G9-A13 PolarHBondContact O-N 3.44Å; I10-A13 PolarHBondContact O-N 3.39Å; A13-K16 PolarHBondContact O-N 3.19Å; A13-V17 WeakPolarHBondContact O-CG2 3.27Å; A13-V17 PolarHBondContact O-N 2.89Å
14	S	51	Low	50.6	Low	29 Å²	29	92.6 Å²	92.6	20%	0.203	52%	0.518	C	S	.	.	H	α-helix	trans	-70.5	-29.6	179.2	-174.4	0	0	0	0	113.6	I10 N11 K16	I10-S14 VanDerWaalsContact O-CB 3.25Å; I10-S14 WeakPolarHBondContact O-CB 3.28Å; I10-S14 PolarHBondContact O-N 2.99Å; N11-S14 PolarHBondContact O-N 3.12Å; S14-K16 VanDerWaalsContact C-N 3.3Å
15	A	48.5	Very low	50.5	Low	91 Å²	91	91.1 Å²	91.1	75%	0.752	50%	0.503	S	S	*	.	H	α-helix	trans	-78	-17.1	174.8	0	0	0	0	0	112.7	N11	N11-A15 VanDerWaalsContact O-CB 3.32Å; N11-A15 WeakPolarHBondContact O-CB 3.46Å; N11-A15 PolarHBondContact O-N 3.47Å
16	K	47.1	Very low	50.5	Low	163 Å²	163	91.6 Å²	91.6	71%	0.709	50%	0.503	S	S	*	.	H	α-helix	trans	-104.2	-4.4	-177.7	-139.8	176.5	-171.3	178.3	0	113.5	H12 A13 S14	H12-K16 WeakPolarHBondContact O-CB 3.42Å; H12-K16 PolarHBondContact O-N 3.36Å; A13-K16 PolarHBondContact O-N 3.19Å; S14-K16 VanDerWaalsContact C-N 3.3Å
17	V	47.9	Very low	50.3	Low	72 Å²	72	93 Å²	93	44%	0.436	51%	0.507	S	S	.	.	S	Bend	trans	-106.7	111.4	172.1	179.4	0	0	0	0	107.5	A13 F19	A13-V17 WeakPolarHBondContact O-CG2 3.27Å; A13-V17 PolarHBondContact O-N 2.89Å; V17-F19 HydrophobicContact CB-CD1 4.34Å; V17-F19 HydrophobicContact CB-CD2 4.15Å; V17-F19 HydrophobicContact CB-CE1 3.95Å; V17-F19 HydrophobicContact CB-CE2 3.69Å; V17-F19 HydrophobicContact CB-CG 4.49Å; V17-F19 HydrophobicContact CB-CZ 3.59Å; V17-F19 HydrophobicContact CG1-CD1 3.45Å; V17-F19 VanDerWaalsContact CG1-CD1 3.45Å; V17-F19 HydrophobicContact CG1-CD2 4.11Å; V17-F19 HydrophobicContact CG1-CE1 3.17Å; V17-F19 HydrophobicContact CG1-CE2 3.84Å; V17-F19 HydrophobicContact CG1-CG 3.97Å; V17-F19 HydrophobicContact CG1-CZ 3.38Å; V17-F19 HydrophobicContact CG2-CZ 4.27Å; V17-F19 VanDerWaalsContact O-CD2 3.27Å; V17-F19 WeakPolarHBondContact O-CD2 3.36Å; V17-F19 PolarHBondContact O-N 3.03Å
18	D	44.8	Very low	50.2	Low	164 Å²	164	91.2 Å²	91.2	88%	0.877	50%	0.502	S	S	*	.			trans	-67.9	93.8	172.6	-73.4	-61.8	0	0	0	109	D20	D18-D20 PolarHBondContact O-N 3.36Å
19	F	48	Very low	50.2	Low	69 Å²	69	89.6 Å²	89.6	30%	0.303	49%	0.49	S	S	.	.			trans	-85.6	104.2	-178.5	-69.5	-60.7	0	0	0	110.6	V17 N21 Q24	V17-F19 HydrophobicContact CB-CD1 4.34Å; V17-F19 HydrophobicContact CB-CD2 4.15Å; V17-F19 HydrophobicContact CB-CE1 3.95Å; V17-F19 HydrophobicContact CB-CE2 3.69Å; V17-F19 HydrophobicContact CB-CG 4.49Å; V17-F19 HydrophobicContact CB-CZ 3.59Å; V17-F19 HydrophobicContact CG1-CD1 3.45Å; V17-F19 VanDerWaalsContact CG1-CD1 3.45Å; V17-F19 HydrophobicContact CG1-CD2 4.11Å; V17-F19 HydrophobicContact CG1-CE1 3.17Å; V17-F19 HydrophobicContact CG1-CE2 3.84Å; V17-F19 HydrophobicContact CG1-CG 3.97Å; V17-F19 HydrophobicContact CG1-CZ 3.38Å; V17-F19 HydrophobicContact CG2-CZ 4.27Å; V17-F19 VanDerWaalsContact O-CD2 3.27Å; V17-F19 WeakPolarHBondContact O-CD2 3.36Å; V17-F19 PolarHBondContact O-N 3.03Å; F19-N21 PolarHBondContact O-N 3.12Å; F19-Q24 HydrophobicContact CD1-CB 3.59Å; F19-Q24 HydrophobicContact CD1-CG 4.08Å; F19-Q24 HydrophobicContact CE1-CB 3.79Å; F19-Q24 HydrophobicContact CE1-CG 4.16Å; F19-Q24 HydrophobicContact CG-CB 4.17Å
20	D	45.6	Very low	50	Low	169 Å²	169	90.2 Å²	90.2	90%	0.904	49%	0.492	S	S	*	.			trans	-75.8	-4	177.7	-154.9	26.2	0	0	0	113	D18	D18-D20 PolarHBondContact O-N 3.36Å
21	N	44.9	Very low	49.9	Very low	103 Å²	103	90.4 Å²	90.4	55%	0.551	50%	0.502	S	S	*	.	S	Bend	trans	-142.5	126.9	-168.3	-151.8	-16.6	0	0	0	114.3	F19 F23 Q24	F19-N21 PolarHBondContact O-N 3.12Å; N21-F23 PolarHBondContact O-N 2.98Å; N21-Q24 PolarHBondContact O-N 3.49Å
22	N	46.1	Very low	49.8	Very low	95 Å²	95	88 Å²	88	51%	0.508	49%	0.489	S	S	.	.	H	α-helix	trans	-52.7	-24.1	-176.3	-74	-78.2	0	0	0	115	S26	N22-S26 PolarHBondContact O-N 3.02Å
23	F	45.7	Very low	49.6	Very low	155 Å²	155	84.6 Å²	84.6	68%	0.68	48%	0.479	S	S	*	.	H	α-helix	trans	-71.2	-35	-178	-154.7	-97.8	0	0	0	113.3	N21 S26 L27	N21-F23 PolarHBondContact O-N 2.98Å; F23-S26 PolarHBondContact O-N 2.84Å; F23-L27 WeakPolarHBondContact O-CB 3.37Å; F23-L27 PolarHBondContact O-N 3.28Å
24	Q	44.5	Very low	49.6	Very low	87 Å²	87	86.2 Å²	86.2	41%	0.407	48%	0.483	S	S	.	.	H	α-helix	trans	-72.7	-32.1	-179	-76.5	164.6	-32.4	0	0	112.2	F19 N21 L27 T28	F19-Q24 HydrophobicContact CD1-CB 3.59Å; F19-Q24 HydrophobicContact CD1-CG 4.08Å; F19-Q24 HydrophobicContact CE1-CB 3.79Å; F19-Q24 HydrophobicContact CE1-CG 4.16Å; F19-Q24 HydrophobicContact CG-CB 4.17Å; N21-Q24 PolarHBondContact O-N 3.49Å; Q24-L27 PolarHBondContact O-N 3.37Å; Q24-T28 WeakPolarHBondContact O-CB 3.34Å; Q24-T28 PolarHBondContact O-N 2.87Å; Q24-T28 PolarHBondContact O-OG1 3.42Å
25	F	48.7	Very low	49.9	Very low	67 Å²	67	86.1 Å²	86.1	29%	0.294	49%	0.487	S	S	.	.	H	α-helix	trans	-67.1	-44.9	175.2	-152.5	-89.1	0	0	0	111.1	T28 L29 W83	F25-T28 PolarHBondContact O-N 3.49Å; F25-L29 HydrophobicContact CD1-CD1 4.08Å; F25-L29 HydrophobicContact CE1-CD1 3.93Å; F25-L29 PolarHBondContact O-N 3.35Å; F25-L29 VanDerWaalsContact O-N 3.12Å; F25-W83 HydrophobicContact CZ-CB 4.23Å
26	S	50	Low	50.1	Low	77 Å²	77	83 Å²	83	54%	0.538	46%	0.457	S	S	.	.	H	α-helix	trans	-64.4	-39.7	175.1	-170.4	0	0	0	0	112.5	N22 F23 T28 L29 A30	N22-S26 PolarHBondContact O-N 3.02Å; F23-S26 PolarHBondContact O-N 2.84Å; S26-T28 PolarHBondContact O-N 3.02Å; S26-L29 VanDerWaalsContact O-CB 3.28Å; S26-L29 WeakPolarHBondContact O-CB 3.47Å; S26-L29 PolarHBondContact O-N 2.87Å; S26-A30 WeakPolarHBondContact O-CB 3.45Å; S26-A30 PolarHBondContact O-N 3.12Å
27	L	51.5	Low	50.3	Low	109 Å²	109	80.5 Å²	80.5	57%	0.571	44%	0.443	S	S	*	.	H	α-helix	trans	-66.2	-38.2	178.4	-157.5	77.4	0	0	0	112.2	F23 Q24 A30 A31	F23-L27 WeakPolarHBondContact O-CB 3.37Å; F23-L27 PolarHBondContact O-N 3.28Å; Q24-L27 PolarHBondContact O-N 3.37Å; L27-A30 PolarHBondContact O-N 3.48Å; L27-A31 VanDerWaalsContact O-CB 3.25Å; L27-A31 WeakPolarHBondContact O-CB 3.39Å; L27-A31 PolarHBondContact O-N 3.34Å
28	T	52.7	Low	50.5	Low	34 Å²	34	86.2 Å²	86.2	21%	0.209	46%	0.457	C	S	.	.	H	α-helix	trans	-68.3	-38	177.1	-55.2	0	0	0	0	111.4	I10 Q24 F25 S26 L32	I10-T28 HydrophobicContact CG2-CG2 3.73Å; Q24-T28 WeakPolarHBondContact O-CB 3.34Å; Q24-T28 PolarHBondContact O-N 2.87Å; Q24-T28 PolarHBondContact O-OG1 3.42Å; F25-T28 PolarHBondContact O-N 3.49Å; S26-T28 PolarHBondContact O-N 3.02Å; T28-L32 HydrophobicContact CG2-CD1 4.44Å; T28-L32 WeakPolarHBondContact O-CB 3.38Å; T28-L32 WeakPolarHBondContact O-CG 3.49Å; T28-L32 PolarHBondContact O-N 2.82Å
29	L	55.2	Low	50.7	Low	50 Å²	50	82.4 Å²	82.4	26%	0.262	44%	0.44	S	S	.	.	H	α-helix	trans	-61.8	-47.7	170.4	-108.5	61.1	0	0	0	112.9	F25 S26 A31 L32 S33 C86	F25-L29 HydrophobicContact CD1-CD1 4.08Å; F25-L29 HydrophobicContact CE1-CD1 3.93Å; F25-L29 PolarHBondContact O-N 3.35Å; F25-L29 VanDerWaalsContact O-N 3.12Å; S26-L29 VanDerWaalsContact O-CB 3.28Å; S26-L29 WeakPolarHBondContact O-CB 3.47Å; S26-L29 PolarHBondContact O-N 2.87Å; L29-A31 VanDerWaalsContact C-N 3.32Å; L29-L32 WeakPolarHBondContact O-CB 3.35Å; L29-L32 PolarHBondContact O-N 3.1Å; L29-S33 WeakPolarHBondContact O-CB 3.32Å; L29-S33 PolarHBondContact O-N 2.96Å; L29-C86 HydrophobicContact CD1-CB 4.15Å; L29-C86 WeakPolarHBondContact CD1-SG 3.4Å; L29-C86 WeakPolarHBondContact CD2-SG 3.24Å; L29-C86 HydrophobicContact CG-CB 4.21Å; L29-C86 WeakPolarHBondContact CG-SG 3.13Å
30	A	54.1	Low	50.6	Low	50 Å²	50	82.8 Å²	82.8	41%	0.413	44%	0.442	S	S	.	.	H	α-helix	trans	-63.1	-43.1	178	0	0	0	0	0	110.3	S26 L27 L32 S33 V34	S26-A30 WeakPolarHBondContact O-CB 3.45Å; S26-A30 PolarHBondContact O-N 3.12Å; L27-A30 PolarHBondContact O-N 3.48Å; A30-L32 PolarHBondContact O-N 2.78Å; A30-S33 PolarHBondContact O-N 2.96Å; A30-V34 WeakPolarHBondContact O-CB 3.21Å; A30-V34 VanDerWaalsContact O-CG2 3.26Å; A30-V34 WeakPolarHBondContact O-CG2 3.43Å; A30-V34 PolarHBondContact O-N 3.18Å
31	A	54.1	Low	50.5	Low	61 Å²	61	76.5 Å²	76.5	50%	0.504	41%	0.408	S	S	.	.	H	α-helix	trans	-64.4	-36.9	174.2	0	0	0	0	0	112.4	L27 L29 G35	L27-A31 VanDerWaalsContact O-CB 3.25Å; L27-A31 WeakPolarHBondContact O-CB 3.39Å; L27-A31 PolarHBondContact O-N 3.34Å; L29-A31 VanDerWaalsContact C-N 3.32Å; A31-G35 WeakPolarHBondContact O-CA 3.4Å; A31-G35 PolarHBondContact O-N 3.42Å
32	L	54.2	Low	50.8	Low	31 Å²	31	83.6 Å²	83.6	16%	0.162	43%	0.427	C	S	.	.	H	α-helix	trans	-66.5	-41.8	172.9	-91	164.2	0	0	0	111.8	F7 I10 T28 L29 A30 G35 L36	F7-L32 HydrophobicContact CD2-CD2 4.09Å; F7-L32 HydrophobicContact CE2-CD2 4.49Å; I10-L32 HydrophobicContact CB-CD2 4.38Å; I10-L32 HydrophobicContact CD1-CD2 3.81Å; I10-L32 HydrophobicContact CD1-CG 4.3Å; I10-L32 HydrophobicContact CG2-CD1 3.98Å; I10-L32 HydrophobicContact CG2-CD2 4.26Å; I10-L32 HydrophobicContact CG2-CG 4.03Å; T28-L32 HydrophobicContact CG2-CD1 4.44Å; T28-L32 WeakPolarHBondContact O-CB 3.38Å; T28-L32 WeakPolarHBondContact O-CG 3.49Å; T28-L32 PolarHBondContact O-N 2.82Å; L29-L32 WeakPolarHBondContact O-CB 3.35Å; L29-L32 PolarHBondContact O-N 3.1Å; A30-L32 PolarHBondContact O-N 2.78Å; L32-G35 PolarHBondContact O-N 3.29Å; L32-L36 VanDerWaalsContact O-CB 3.31Å; L32-L36 WeakPolarHBondContact O-CB 3.44Å; L32-L36 WeakPolarHBondContact O-CD1 3.3Å; L32-L36 PolarHBondContact O-N 3.49Å
33	S	53.3	Low	51	Low	49 Å²	49	81.1 Å²	81.1	34%	0.343	42%	0.417	S	S	.	.	H	α-helix	trans	-66.6	-45.6	178	-167.4	0	0	0	0	111.6	L29 A30 L36 W37 F89	L29-S33 WeakPolarHBondContact O-CB 3.32Å; L29-S33 PolarHBondContact O-N 2.96Å; A30-S33 PolarHBondContact O-N 2.96Å; S33-L36 PolarHBondContact O-N 3.45Å; S33-W37 WeakPolarHBondContact O-CB 3.14Å; S33-W37 PolarHBondContact O-N 2.97Å; S33-F89 WeakPolarHBondContact OG-CE1 2.91Å
34	V	54.3	Low	51.3	Low	85 Å²	85	85.4 Å²	85.4	52%	0.515	43%	0.429	S	S	.	.	H	α-helix	trans	-66.2	-38.7	174.5	174.1	0	0	0	0	111	A30 W37 W38	A30-V34 WeakPolarHBondContact O-CB 3.21Å; A30-V34 VanDerWaalsContact O-CG2 3.26Å; A30-V34 WeakPolarHBondContact O-CG2 3.43Å; A30-V34 PolarHBondContact O-N 3.18Å; V34-W37 PolarHBondContact O-N 2.95Å; V34-W38 WeakPolarHBondContact O-CB 3.38Å; V34-W38 PolarHBondContact O-N 2.95Å
35	G	56.3	Low	51.5	Low	28 Å²	28	84.3 Å²	84.3	29%	0.289	43%	0.431	S	S	.	.	H	α-helix	trans	-65.3	-45.4	175.3	0	0	0	0	0	112.3	A31 L32 W37 W38 T39	A31-G35 WeakPolarHBondContact O-CA 3.4Å; A31-G35 PolarHBondContact O-N 3.42Å; L32-G35 PolarHBondContact O-N 3.29Å; G35-W37 PolarHBondContact O-N 3.31Å; G35-W38 PolarHBondContact O-N 3.32Å; G35-T39 WeakPolarHBondContact O-CB 3.4Å; G35-T39 PolarHBondContact O-N 3.48Å; G35-T39 PolarHBondContact O-OG1 3.47Å
36	L	52.7	Low	51.7	Low	24 Å²	24	82.2 Å²	82.2	13%	0.126	43%	0.428	C	S	.	.	H	α-helix	trans	-61.3	-43.9	174.1	-97.3	131.9	0	0	0	111	L32 S33 T39 F40 I93	L32-L36 VanDerWaalsContact O-CB 3.31Å; L32-L36 WeakPolarHBondContact O-CB 3.44Å; L32-L36 WeakPolarHBondContact O-CD1 3.3Å; L32-L36 PolarHBondContact O-N 3.49Å; S33-L36 PolarHBondContact O-N 3.45Å; L36-T39 PolarHBondContact O-N 3.45Å; L36-F40 HydrophobicContact CD2-CD2 3.65Å; L36-F40 HydrophobicContact CD2-CE2 3.64Å; L36-F40 HydrophobicContact CG-CD2 4.4Å; L36-F40 VanDerWaalsContact O-CB 3.29Å; L36-F40 WeakPolarHBondContact O-CB 3.47Å; L36-F40 PolarHBondContact O-N 3.34Å; L36-I93 HydrophobicContact CD2-CB 4.34Å; L36-I93 HydrophobicContact CD2-CD1 4.41Å; L36-I93 HydrophobicContact CD2-CG2 3.77Å
37	W	52	Low	51.9	Low	111 Å²	111	83.7 Å²	83.7	42%	0.42	43%	0.425	S	S	.	.	H	α-helix	trans	-62.2	-47.4	175.6	180	52.4	0	0	0	112.4	S33 V34 G35 T39 D41 F47	S33-W37 WeakPolarHBondContact O-CB 3.14Å; S33-W37 PolarHBondContact O-N 2.97Å; V34-W37 PolarHBondContact O-N 2.95Å; G35-W37 PolarHBondContact O-N 3.31Å; W37-T39 VanDerWaalsContact C-N 3.33Å; W37-T39 PolarHBondContact O-N 2.87Å; W37-D41 CarbonylContact O-C 3.56Å; W37-D41 PolarHBondContact O-N 2.91Å; W37-F47 AromaticContact CD1-CD2 3.8Å; W37-F47 AromaticContact CD2-CD2 3.92Å; W37-F47 HydrophobicContact CD2-CD2 3.92Å; W37-F47 HydrophobicContact CD2-CE2 4.32Å; W37-F47 AromaticContact CE2-CD2 3.63Å; W37-F47 HydrophobicContact CG-CD2 4.01Å; W37-F47 HydrophobicContact CZ2-CD2 4.15Å; W37-F47 AromaticContact NE1-CD2 3.57Å
38	W	51.3	Low	52.2	Low	192 Å²	192	80.8 Å²	80.8	73%	0.727	42%	0.421	S	S	*	.	H	α-helix	trans	-66.5	-33.2	179.7	-167.8	-90.2	0	0	0	113	V34 G35	V34-W38 WeakPolarHBondContact O-CB 3.38Å; V34-W38 PolarHBondContact O-N 2.95Å; G35-W38 PolarHBondContact O-N 3.32Å
39	T	49.3	Very low	52.3	Low	85 Å²	85	84.2 Å²	84.2	52%	0.521	44%	0.438	S	S	.	.	H	α-helix	trans	-92.1	-30.9	-174.2	-40.5	0	0	0	0	113.1	G35 L36 W37	G35-T39 WeakPolarHBondContact O-CB 3.4Å; G35-T39 PolarHBondContact O-N 3.48Å; G35-T39 PolarHBondContact O-OG1 3.47Å; L36-T39 PolarHBondContact O-N 3.45Å; W37-T39 VanDerWaalsContact C-N 3.33Å; W37-T39 PolarHBondContact O-N 2.87Å
40	F	47.1	Very low	52.2	Low	77 Å²	77	82.2 Å²	82.2	34%	0.338	43%	0.429	S	S	.	.	H	α-helix	trans	-93.6	-41.3	-177.5	-91.3	-78.1	0	0	0	114.8	C3 L36 N97	C3-F40 HydrophobicContact CB-CE2 3.67Å; C3-F40 HydrophobicContact CB-CZ 3.66Å; C3-F40 WeakPolarHBondContact SG-CE2 3.48Å; C3-F40 WeakPolarHBondContact SG-CZ 3.21Å; L36-F40 HydrophobicContact CD2-CD2 3.65Å; L36-F40 HydrophobicContact CD2-CE2 3.64Å; L36-F40 HydrophobicContact CG-CD2 4.4Å; L36-F40 VanDerWaalsContact O-CB 3.29Å; L36-F40 WeakPolarHBondContact O-CB 3.47Å; L36-F40 PolarHBondContact O-N 3.34Å; F40-N97 WeakPolarHBondContact CD1-ND2 3.25Å; F40-N97 HydrophobicContact CE1-CB 4.49Å; F40-N97 WeakPolarHBondContact CE1-ND2 3.29Å; F40-N97 WeakPolarHBondContact CG-ND2 3.2Å
41	D	42.9	Very low	52.3	Low	37 Å²	37	83.6 Å²	83.6	20%	0.198	43%	0.432	C	S	.	.			trans	-151.2	93.2	-164	-148	22.8	0	0	0	109.9	W37 S43 R100	W37-D41 CarbonylContact O-C 3.56Å; W37-D41 PolarHBondContact O-N 2.91Å; D41-S43 PolarHBondContact O-N 2.96Å; D41-S43 WeakPolarHBondContact OD1-CB 3.37Å; D41-S43 WeakPolarHBondContact OD2-CB 3.46Å; D41-R100 IonicContact OD2-NH1 3.39Å; D41-R100 PolarHBondContact OD2-NH1 2.95Å
42	R	50.9	Low	52.5	Low	251 Å²	251	82.7 Å²	82.7	95%	0.947	43%	0.428	S	S	*	.			trans	-68.7	36.5	160	-156.9	177.7	-174.3	137.9	-1.1	110.6
43	S	49.4	Very low	52.5	Low	43 Å²	43	84.1 Å²	84.1	30%	0.301	44%	0.435	S	S	.	.	S	Bend	trans	-124.4	132.7	-178.8	-172.5	0	0	0	0	109.8	D41 S45 G46	D41-S43 PolarHBondContact O-N 2.96Å; D41-S43 WeakPolarHBondContact OD1-CB 3.37Å; D41-S43 WeakPolarHBondContact OD2-CB 3.46Å; S43-S45 PolarHBondContact O-N 2.97Å; S43-S45 PolarHBondContact OG-OG 3.44Å; S43-G46 PolarHBondContact O-N 2.63Å
44	R	52.5	Low	52.5	Low	246 Å²	246	83.3 Å²	83.3	93%	0.928	43%	0.432	S	S	*	.	H	α-helix	trans	-65.4	-21.4	-172.3	-60.1	175.8	-161.6	157.5	5.2	112.9
45	S	49.8	Very low	52.7	Low	64 Å²	64	86.6 Å²	86.6	45%	0.448	44%	0.439	S	S	.	.	H	α-helix	trans	-82.7	-27.3	-177	40.8	0	0	0	0	114	S43 F47 L49	S43-S45 PolarHBondContact O-N 2.97Å; S43-S45 PolarHBondContact OG-OG 3.44Å; S45-F47 VanDerWaalsContact C-N 3.33Å; S45-L49 PolarHBondContact O-N 2.96Å
46	G	53	Low	52.8	Low	22 Å²	22	90.8 Å²	90.8	23%	0.227	46%	0.455	C	S	.	.	H	α-helix	trans	-68.1	-32	172.9	0	0	0	0	0	113	S43 G50	S43-G46 PolarHBondContact O-N 2.63Å; G46-G50 PolarHBondContact O-N 3.37Å
47	F	54.3	Low	52.8	Low	109 Å²	109	90.5 Å²	90.5	48%	0.478	46%	0.456	S	S	.	.	H	α-helix	trans	-65.8	-43.7	178	-169.4	-100.8	0	0	0	112.4	W37 S45 G50 V51	W37-F47 AromaticContact CD1-CD2 3.8Å; W37-F47 AromaticContact CD2-CD2 3.92Å; W37-F47 HydrophobicContact CD2-CD2 3.92Å; W37-F47 HydrophobicContact CD2-CE2 4.32Å; W37-F47 AromaticContact CE2-CD2 3.63Å; W37-F47 HydrophobicContact CG-CD2 4.01Å; W37-F47 HydrophobicContact CZ2-CD2 4.15Å; W37-F47 AromaticContact NE1-CD2 3.57Å; S45-F47 VanDerWaalsContact C-N 3.33Å; F47-G50 PolarHBondContact O-N 2.92Å; F47-V51 HydrophobicContact CD1-CG2 4.18Å; F47-V51 HydrophobicContact CE1-CG2 3.88Å; F47-V51 HydrophobicContact CZ-CG2 4.11Å; F47-V51 WeakPolarHBondContact O-CG2 3.38Å; F47-V51 PolarHBondContact O-N 2.85Å
48	G	56.3	Low	53	Low	47 Å²	47	88.7 Å²	88.7	49%	0.485	46%	0.457	S	S	.	.	H	α-helix	trans	-66.2	-42.6	179.7	0	0	0	0	0	113.2	V51 G52	G48-V51 PolarHBondContact O-N 3.35Å; G48-G52 PolarHBondContact O-N 2.88Å
49	L	54.4	Low	53.4	Low	107 Å²	107	82.4 Å²	82.4	56%	0.56	44%	0.44	S	S	*	.	H	α-helix	trans	-67.2	-38.7	174.8	-82.3	164.9	0	0	0	111.9	S45 G52 I53	S45-L49 PolarHBondContact O-N 2.96Å; L49-G52 PolarHBondContact O-N 2.97Å; L49-I53 WeakPolarHBondContact O-CB 3.32Å; L49-I53 WeakPolarHBondContact O-CD1 3.35Å; L49-I53 VanDerWaalsContact O-CG1 3.26Å; L49-I53 WeakPolarHBondContact O-CG1 3.25Å; L49-I53 PolarHBondContact O-N 3.17Å
50	G	54.8	Low	53.9	Low	7 Å²	7	81.9 Å²	81.9	7%	0.072	44%	0.436	C	S	.	.	H	α-helix	trans	-58	-55.7	172	0	0	0	0	0	111.4	G46 F47 G52 I53 A54 F89	G46-G50 PolarHBondContact O-N 3.37Å; F47-G50 PolarHBondContact O-N 2.92Å; G50-G52 VanDerWaalsContact C-N 3.28Å; G50-G52 PolarHBondContact O-N 3.44Å; G50-I53 PolarHBondContact O-N 3.17Å; G50-I53 VanDerWaalsContact O-N 3.15Å; G50-A54 WeakPolarHBondContact O-CB 3.32Å; G50-A54 PolarHBondContact O-N 2.91Å; G50-F89 VanDerWaalsContact O-CE2 3.3Å; G50-F89 WeakPolarHBondContact O-CE2 3.47Å
51	V	56.3	Low	54.2	Low	80 Å²	80	79.1 Å²	79.1	49%	0.485	43%	0.426	S	S	.	.	H	α-helix	trans	-57	-41.6	178.5	170.1	0	0	0	0	111.8	F47 G48 A54 F55	F47-V51 HydrophobicContact CD1-CG2 4.18Å; F47-V51 HydrophobicContact CE1-CG2 3.88Å; F47-V51 HydrophobicContact CZ-CG2 4.11Å; F47-V51 WeakPolarHBondContact O-CG2 3.38Å; F47-V51 PolarHBondContact O-N 2.85Å; G48-V51 PolarHBondContact O-N 3.35Å; V51-A54 PolarHBondContact O-N 2.95Å; V51-F55 WeakPolarHBondContact O-CB 3.41Å; V51-F55 PolarHBondContact O-N 2.82Å
52	G	56.4	Low	54.6	Low	41 Å²	41	82.6 Å²	82.6	42%	0.423	44%	0.441	S	S	.	.	H	α-helix	trans	-62.9	-43.8	176.7	0	0	0	0	0	113.3	G48 L49 G50 F55 L56	G48-G52 PolarHBondContact O-N 2.88Å; L49-G52 PolarHBondContact O-N 2.97Å; G50-G52 VanDerWaalsContact C-N 3.28Å; G50-G52 PolarHBondContact O-N 3.44Å; G52-F55 PolarHBondContact O-N 2.76Å; G52-L56 WeakPolarHBondContact O-CB 3.49Å; G52-L56 PolarHBondContact O-N 3.16Å
53	I	54.8	Low	54.8	Low	61 Å²	61	75.1 Å²	75.1	31%	0.313	42%	0.419	S	S	.	.	H	α-helix	trans	-70	-38.8	178.6	-70.1	161	0	0	0	111.1	L49 G50 L56 A57	L49-I53 WeakPolarHBondContact O-CB 3.32Å; L49-I53 WeakPolarHBondContact O-CD1 3.35Å; L49-I53 VanDerWaalsContact O-CG1 3.26Å; L49-I53 WeakPolarHBondContact O-CG1 3.25Å; L49-I53 PolarHBondContact O-N 3.17Å; G50-I53 PolarHBondContact O-N 3.17Å; G50-I53 VanDerWaalsContact O-N 3.15Å; I53-L56 PolarHBondContact O-N 2.84Å; I53-A57 WeakPolarHBondContact O-CB 3.29Å; I53-A57 PolarHBondContact O-N 2.82Å
54	A	53.5	Low	54.9	Low	33 Å²	33	77 Å²	77	27%	0.273	43%	0.426	S	S	.	.	H	α-helix	trans	-59	-49.8	173.5	0	0	0	0	0	110.9	G50 V51 L56 A57 T58 F89	G50-A54 WeakPolarHBondContact O-CB 3.32Å; G50-A54 PolarHBondContact O-N 2.91Å; V51-A54 PolarHBondContact O-N 2.95Å; A54-L56 PolarHBondContact O-N 2.84Å; A54-A57 PolarHBondContact O-N 2.79Å; A54-T58 PolarHBondContact O-N 3.29Å; A54-T58 PolarHBondContact O-OG1 3.02Å; A54-F89 HydrophobicContact CB-CD2 3.75Å; A54-F89 HydrophobicContact CB-CE2 3.61Å
55	F	58.2	Low	54.9	Low	153 Å²	153	67 Å²	67	67%	0.671	39%	0.392	S	S	*	.	H	α-helix	trans	-63.4	-43.9	-179.1	-160.3	-96.3	0	0	0	111.6	V51 G52 T58 V59	V51-F55 WeakPolarHBondContact O-CB 3.41Å; V51-F55 PolarHBondContact O-N 2.82Å; G52-F55 PolarHBondContact O-N 2.76Å; F55-T58 PolarHBondContact O-N 3.24Å; F55-V59 HydrophobicContact CD1-CG2 4.15Å; F55-V59 HydrophobicContact CE1-CG2 4.04Å; F55-V59 VanDerWaalsContact O-CG2 3.31Å; F55-V59 WeakPolarHBondContact O-CG2 3.42Å; F55-V59 PolarHBondContact O-N 3.43Å
56	L	57.9	Low	54.9	Low	116 Å²	116	74.1 Å²	74.1	61%	0.607	41%	0.41	S	S	*	.	H	α-helix	trans	-64.4	-41.3	177.4	-163.4	70.7	0	0	0	111.8	G52 I53 A54 V59 V60	G52-L56 WeakPolarHBondContact O-CB 3.49Å; G52-L56 PolarHBondContact O-N 3.16Å; I53-L56 PolarHBondContact O-N 2.84Å; A54-L56 PolarHBondContact O-N 2.84Å; L56-V59 PolarHBondContact O-N 2.77Å; L56-V60 WeakPolarHBondContact O-CB 3.37Å; L56-V60 VanDerWaalsContact O-CG2 3.24Å; L56-V60 WeakPolarHBondContact O-CG2 3.26Å; L56-V60 PolarHBondContact O-N 3.24Å
57	A	54.4	Low	54.9	Low	18 Å²	18	78.4 Å²	78.4	15%	0.149	43%	0.428	C	S	.	.	H	α-helix	trans	-63.4	-41.9	176.4	0	0	0	0	0	111.8	I53 A54 V60 T61	I53-A57 WeakPolarHBondContact O-CB 3.29Å; I53-A57 PolarHBondContact O-N 2.82Å; A54-A57 PolarHBondContact O-N 2.79Å; A57-V60 PolarHBondContact O-N 3.49Å; A57-T61 PolarHBondContact O-N 3.2Å; A57-T61 PolarHBondContact O-OG1 3.35Å
58	T	56.3	Low	54.6	Low	73 Å²	73	75.6 Å²	75.6	45%	0.448	43%	0.43	S	S	.	.	H	α-helix	trans	-61.1	-47.2	174	-54.7	0	0	0	0	110.9	A54 F55 V60 T61 Q62	A54-T58 PolarHBondContact O-N 3.29Å; A54-T58 PolarHBondContact O-OG1 3.02Å; F55-T58 PolarHBondContact O-N 3.24Å; T58-V60 PolarHBondContact O-N 2.92Å; T58-T61 PolarHBondContact O-N 3.36Å; T58-T61 PolarHBondContact O-OG1 2.85Å; T58-Q62 WeakPolarHBondContact O-CB 3.44Å; T58-Q62 PolarHBondContact O-N 3.15Å
59	V	59.2	Low	54.2	Low	60 Å²	60	78.8 Å²	78.8	36%	0.364	44%	0.44	S	S	.	.	H	α-helix	trans	-62.1	-43.2	178.9	171	0	0	0	0	111.6	F55 L56 Q62 L63	F55-V59 HydrophobicContact CD1-CG2 4.15Å; F55-V59 HydrophobicContact CE1-CG2 4.04Å; F55-V59 VanDerWaalsContact O-CG2 3.31Å; F55-V59 WeakPolarHBondContact O-CG2 3.42Å; F55-V59 PolarHBondContact O-N 3.43Å; L56-V59 PolarHBondContact O-N 2.77Å; V59-Q62 PolarHBondContact O-N 3.4Å; V59-L63 HydrophobicContact CG1-CD1 4.06Å; V59-L63 WeakPolarHBondContact O-CB 3.29Å; V59-L63 PolarHBondContact O-N 3.47Å
60	V	58.4	Low	53.7	Low	74 Å²	74	80.3 Å²	80.3	45%	0.448	44%	0.439	S	S	.	.	H	α-helix	trans	-66.2	-41.3	179	170.6	0	0	0	0	111.7	L56 A57 T58 L63 L64	L56-V60 WeakPolarHBondContact O-CB 3.37Å; L56-V60 VanDerWaalsContact O-CG2 3.24Å; L56-V60 WeakPolarHBondContact O-CG2 3.26Å; L56-V60 PolarHBondContact O-N 3.24Å; A57-V60 PolarHBondContact O-N 3.49Å; T58-V60 PolarHBondContact O-N 2.92Å; V60-L63 PolarHBondContact O-N 2.87Å; V60-L64 HydrophobicContact CG1-CD1 4.01Å; V60-L64 WeakPolarHBondContact O-CD1 3.29Å; V60-L64 PolarHBondContact O-N 3.5Å
61	T	53.7	Low	53.1	Low	20 Å²	20	87.5 Å²	87.5	12%	0.123	47%	0.471	C	S	.	.	H	α-helix	trans	-68.3	-39.2	175.8	28.6	0	0	0	0	112	A57 T58 L63 L64 V65 V80	A57-T61 PolarHBondContact O-N 3.2Å; A57-T61 PolarHBondContact O-OG1 3.35Å; T58-T61 PolarHBondContact O-N 3.36Å; T58-T61 PolarHBondContact O-OG1 2.85Å; T61-L63 VanDerWaalsContact C-N 3.32Å; T61-L63 PolarHBondContact O-N 2.8Å; T61-L64 PolarHBondContact O-N 2.95Å; T61-V65 WeakPolarHBondContact O-CG2 3.49Å; T61-V65 PolarHBondContact O-N 3.44Å; T61-V65 VanDerWaalsContact O-N 3.12Å; T61-V80 HydrophobicContact CG2-CG1 3.97Å
62	Q	52.3	Low	52.5	Low	110 Å²	110	87.3 Å²	87.3	51%	0.514	46%	0.462	S	S	.	.	H	α-helix	trans	-60.3	-43	172.9	-140.4	84.4	3.2	0	0	111.3	T58 V59 Y66	T58-Q62 WeakPolarHBondContact O-CB 3.44Å; T58-Q62 PolarHBondContact O-N 3.15Å; V59-Q62 PolarHBondContact O-N 3.4Å; Q62-Y66 WeakPolarHBondContact O-CB 3.2Å; Q62-Y66 PolarHBondContact O-N 2.96Å
63	L	54.7	Low	51.9	Low	93 Å²	93	92.1 Å²	92.1	49%	0.487	48%	0.484	S	S	.	.	H	α-helix	trans	-65.7	-41.1	177.3	-105.6	152.4	0	0	0	112.6	V59 V60 T61 Y66 N67	V59-L63 HydrophobicContact CG1-CD1 4.06Å; V59-L63 WeakPolarHBondContact O-CB 3.29Å; V59-L63 PolarHBondContact O-N 3.47Å; V60-L63 PolarHBondContact O-N 2.87Å; T61-L63 VanDerWaalsContact C-N 3.32Å; T61-L63 PolarHBondContact O-N 2.8Å; L63-Y66 PolarHBondContact O-N 3.28Å; L63-N67 WeakPolarHBondContact O-CB 3.31Å; L63-N67 PolarHBondContact O-N 3.45Å; L63-N67 PolarHBondContact O-ND2 3.43Å
64	L	52.4	Low	51.2	Low	83 Å²	83	92.7 Å²	92.7	44%	0.435	49%	0.493	S	S	.	.	H	α-helix	trans	-65.1	-39.1	178.6	-106.8	77.2	0	0	0	112.4	V60 T61	V60-L64 HydrophobicContact CG1-CD1 4.01Å; V60-L64 WeakPolarHBondContact O-CD1 3.29Å; V60-L64 PolarHBondContact O-N 3.5Å; T61-L64 PolarHBondContact O-N 2.95Å
65	V	52.4	Low	50.7	Low	37 Å²	37	95.8 Å²	95.8	22%	0.224	51%	0.51	C	S	.	.	H	α-helix	trans	-65.2	-45.6	173.5	161.7	0	0	0	0	111.2	T61 N67 G68 Y79 V80	T61-V65 WeakPolarHBondContact O-CG2 3.49Å; T61-V65 PolarHBondContact O-N 3.44Å; T61-V65 VanDerWaalsContact O-N 3.12Å; V65-N67 VanDerWaalsContact C-N 3.29Å; V65-N67 PolarHBondContact O-N 3.47Å; V65-G68 PolarHBondContact O-N 2.81Å; V65-G68 VanDerWaalsContact O-N 3.12Å; V65-Y79 HydrophobicContact CG1-CD1 3.66Å; V65-Y79 HydrophobicContact CG1-CG 4Å; V65-Y79 HydrophobicContact CG2-CD1 4.47Å; V65-Y79 WeakPolarHBondContact CG2-O 3.49Å; V65-V80 HydrophobicContact CG2-CG2 3.4Å; V65-V80 VanDerWaalsContact CG2-CG2 3.4Å
66	Y	49.5	Very low	50	Low	213 Å²	213	93.4 Å²	93.4	84%	0.835	50%	0.504	S	S	*	.	H	α-helix	trans	-67.9	-29.8	-176.9	-155.3	-93.9	0	0	0	112.7	Q62 L63 G68	Q62-Y66 WeakPolarHBondContact O-CB 3.2Å; Q62-Y66 PolarHBondContact O-N 2.96Å; L63-Y66 PolarHBondContact O-N 3.28Å; Y66-G68 PolarHBondContact O-N 2.89Å
67	N	51.7	Low	49.3	Very low	111 Å²	111	97.3 Å²	97.3	59%	0.594	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	2.4	175	-80.6	-83.8	0	0	0	113.9	L63 V65 V69	L63-N67 WeakPolarHBondContact O-CB 3.31Å; L63-N67 PolarHBondContact O-N 3.45Å; L63-N67 PolarHBondContact O-ND2 3.43Å; V65-N67 VanDerWaalsContact C-N 3.29Å; V65-N67 PolarHBondContact O-N 3.47Å; N67-V69 HydrophobicContact CB-CG2 4.41Å; N67-V69 PolarHBondContact O-N 2.9Å; N67-V69 VanDerWaalsContact O-N 3.1Å
68	G	49	Very low	48.8	Very low	51 Å²	51	103.1 Å²	103.1	53%	0.526	54%	0.544	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.2	9.2	170	0	0	0	0	0	115.6	V65 Y66 Y70	V65-G68 PolarHBondContact O-N 2.81Å; V65-G68 VanDerWaalsContact O-N 3.12Å; Y66-G68 PolarHBondContact O-N 2.89Å; G68-Y70 PolarHBondContact O-N 3.27Å
69	V	47.7	Very low	48.4	Very low	114 Å²	114	104.7 Å²	104.7	69%	0.691	54%	0.543	S	S	*	.			trans	-72.1	-16.9	-179.7	179.9	0	0	0	0	111.9	N67	N67-V69 HydrophobicContact CB-CG2 4.41Å; N67-V69 PolarHBondContact O-N 2.9Å; N67-V69 VanDerWaalsContact O-N 3.1Å
70	Y	45	Very low	47.7	Very low	139 Å²	139	103.4 Å²	103.4	55%	0.545	54%	0.535	S	S	.	.			trans	-123.4	119.1	176	-92.2	-86.3	0	0	0	112.1	G68	G68-Y70 PolarHBondContact O-N 3.27Å
71	Q	40.5	Very low	47.4	Very low	157 Å²	157	105.3 Å²	105.3	73%	0.734	53%	0.534	S	S	*	.			trans	-105.2	118	166.2	-76.4	-93.4	-56.3	0	0	108.3
72	Y	45.4	Very low	47.2	Very low	76 Å²	76	107.1 Å²	107.1	30%	0.298	55%	0.548	S	S	.	.			trans	-99.3	120.3	174.3	-114.4	-86.4	0	0	0	109.4	S74 R81	Y72-S74 PolarHBondContact O-N 3.4Å; Y72-R81 VanDerWaalsContact CE1-NE 3.31Å; Y72-R81 HydrophobicContact CE2-CB 4.44Å; Y72-R81 WeakPolarHBondContact OH-CD 3.36Å
73	T	41.9	Very low	47.1	Very low	143 Å²	143	107.4 Å²	107.4	88%	0.877	54%	0.544	S	S	*	.	S	Bend	trans	-59.2	-7.2	-179.2	-74.5	0	0	0	0	115.1
74	S	41.1	Very low	47.1	Very low	72 Å²	72	105.5 Å²	105.5	50%	0.503	53%	0.534	S	S	.	.	S	Bend	trans	-146.3	102.9	175.5	-49.6	0	0	0	0	108.8	Y72 D76	Y72-S74 PolarHBondContact O-N 3.4Å; S74-D76 PolarHBondContact O-N 2.84Å
75	P	42.1	Very low	47	Very low	99 Å²	99	103 Å²	103	64%	0.643	52%	0.523	S	S	*	.			trans	-76.1	108	-178.3	28.4	-31.2	0	0	0	110
76	D	44.9	Very low	47.1	Very low	102 Å²	102	102.8 Å²	102.8	55%	0.545	52%	0.523	S	S	.	.			trans	-84.1	148	154.1	-93	-57	0	0	0	109.1	S74 L78 Y79	S74-D76 PolarHBondContact O-N 2.84Å; D76-L78 PolarHBondContact O-N 3.38Å; D76-Y79 PolarHBondContact O-N 3.37Å
77	F	43.1	Very low	47.5	Very low	199 Å²	199	97.1 Å²	97.1	87%	0.873	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.6	-0.1	-150.9	-151.5	-105	0	0	0	119
78	L	42.8	Very low	47.7	Very low	139 Å²	139	98.3 Å²	98.3	73%	0.728	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-141.6	23	177.1	-75.9	173.4	0	0	0	115.1	D76 V80	D76-L78 PolarHBondContact O-N 3.38Å; L78-V80 PolarHBondContact O-N 2.56Å
79	Y	48.1	Very low	48.1	Very low	107 Å²	107	97.2 Å²	97.2	42%	0.42	49%	0.487	S	S	.	.	S	Bend	trans	58.5	9	163.5	-123.2	-88.6	0	0	0	117.6	V65 D76	V65-Y79 HydrophobicContact CG1-CD1 3.66Å; V65-Y79 HydrophobicContact CG1-CG 4Å; V65-Y79 HydrophobicContact CG2-CD1 4.47Å; V65-Y79 WeakPolarHBondContact CG2-O 3.49Å; D76-Y79 PolarHBondContact O-N 3.37Å
80	V	44	Very low	48.5	Very low	33 Å²	33	92.3 Å²	92.3	20%	0.2	46%	0.458	C	S	.	.	S	Bend	trans	-128.7	127.3	169	176.2	0	0	0	0	107.3	T61 V65 L78 S82 L84 P85	T61-V80 HydrophobicContact CG2-CG1 3.97Å; V65-V80 HydrophobicContact CG2-CG2 3.4Å; V65-V80 VanDerWaalsContact CG2-CG2 3.4Å; L78-V80 PolarHBondContact O-N 2.56Å; V80-S82 PolarHBondContact O-N 3Å; V80-L84 HydrophobicContact CG1-CB 4.44Å; V80-P85 HydrophobicContact CG1-CG 4.46Å
81	R	53.4	Low	49.2	Very low	114 Å²	114	87.3 Å²	87.3	43%	0.43	45%	0.449	S	S	.	.			trans	-64.6	114	176	-149.1	165.3	-111.6	-168.5	-10.6	108.8	Y72 W83 L84	Y72-R81 VanDerWaalsContact CE1-NE 3.31Å; Y72-R81 HydrophobicContact CE2-CB 4.44Å; Y72-R81 WeakPolarHBondContact OH-CD 3.36Å; R81-W83 PolarHBondContact O-N 2.97Å; R81-L84 WeakPolarHBondContact O-CB 3.38Å; R81-L84 PolarHBondContact O-N 2.98Å
82	S	49.9	Very low	50	Low	57 Å²	57	81 Å²	81	40%	0.399	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-11.3	-162.2	-45.1	0	0	0	0	115.4	V80 C86	V80-S82 PolarHBondContact O-N 3Å; S82-C86 PolarHBondContact O-SG 3.5Å
83	W	49.8	Very low	50.5	Low	117 Å²	117	78.9 Å²	78.9	44%	0.443	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-26.1	173.6	63.9	-88.1	0	0	0	114.1	F25 R81 C86 I87	F25-W83 HydrophobicContact CZ-CB 4.23Å; R81-W83 PolarHBondContact O-N 2.97Å; W83-C86 WeakPolarHBondContact O-CB 3.48Å; W83-C86 PolarHBondContact O-N 3.4Å; W83-C86 VanDerWaalsContact O-N 3.17Å; W83-I87 HydrophobicContact CE3-CD1 3.38Å; W83-I87 HydrophobicContact CE3-CG1 4.12Å; W83-I87 HydrophobicContact CZ3-CD1 3.55Å; W83-I87 PolarHBondContact O-N 3.4Å
84	L	54.3	Low	51.2	Low	53 Å²	53	75.4 Å²	75.4	28%	0.277	40%	0.398	S	S	.	.	H	α-helix	trans	-63.7	-50	-175.5	-130.2	145	0	0	0	113.3	V80 R81 C86 I87 F88	V80-L84 HydrophobicContact CG1-CB 4.44Å; R81-L84 WeakPolarHBondContact O-CB 3.38Å; R81-L84 PolarHBondContact O-N 2.98Å; L84-C86 PolarHBondContact O-N 2.8Å; L84-C86 VanDerWaalsContact O-N 3.17Å; L84-I87 PolarHBondContact O-N 2.85Å; L84-F88 HydrophobicContact CD2-CD2 4.1Å; L84-F88 HydrophobicContact CD2-CE2 3.87Å; L84-F88 WeakPolarHBondContact O-CD2 3.16Å; L84-F88 PolarHBondContact O-N 3.39Å
85	P	51.2	Low	51.9	Low	30 Å²	30	78.7 Å²	78.7	20%	0.195	41%	0.407	C	S	.	.	H	α-helix	trans	-62.2	-24.4	174.5	21.3	-30.9	0	0	0	112.7	V80 F89	V80-P85 HydrophobicContact CG1-CG 4.46Å; P85-F89 WeakPolarHBondContact O-CB 3.16Å; P85-F89 PolarHBondContact O-N 3.01Å
86	C	54.3	Low	52.6	Low	33 Å²	33	76 Å²	76	22%	0.223	40%	0.398	C	S	.	.	H	α-helix	trans	-81.9	-35.6	-175.6	-55.6	0	0	0	0	112.7	L29 S82 W83 L84 F88 F89 A90	L29-C86 HydrophobicContact CD1-CB 4.15Å; L29-C86 WeakPolarHBondContact CD1-SG 3.4Å; L29-C86 WeakPolarHBondContact CD2-SG 3.24Å; L29-C86 HydrophobicContact CG-CB 4.21Å; L29-C86 WeakPolarHBondContact CG-SG 3.13Å; S82-C86 PolarHBondContact O-SG 3.5Å; W83-C86 WeakPolarHBondContact O-CB 3.48Å; W83-C86 PolarHBondContact O-N 3.4Å; W83-C86 VanDerWaalsContact O-N 3.17Å; L84-C86 PolarHBondContact O-N 2.8Å; L84-C86 VanDerWaalsContact O-N 3.17Å; C86-F88 VanDerWaalsContact C-N 3.35Å; C86-F89 PolarHBondContact O-N 2.93Å; C86-A90 VanDerWaalsContact O-CB 3.29Å; C86-A90 WeakPolarHBondContact O-CB 3.41Å; C86-A90 PolarHBondContact O-N 3.49Å
87	I	57.7	Low	53	Low	93 Å²	93	73 Å²	73	48%	0.477	38%	0.382	S	S	.	.	H	α-helix	trans	-65.4	-41.8	170.3	-69.9	-168.3	0	0	0	110.3	W83 L84 A90 G91	W83-I87 HydrophobicContact CE3-CD1 3.38Å; W83-I87 HydrophobicContact CE3-CG1 4.12Å; W83-I87 HydrophobicContact CZ3-CD1 3.55Å; W83-I87 PolarHBondContact O-N 3.4Å; L84-I87 PolarHBondContact O-N 2.85Å; I87-A90 PolarHBondContact O-N 3.38Å; I87-G91 PolarHBondContact O-N 3.25Å
88	F	56.2	Low	53.9	Low	136 Å²	136	67.5 Å²	67.5	60%	0.596	36%	0.36	S	S	*	.	H	α-helix	trans	-65.3	-40.2	176.1	-88.5	-76.9	0	0	0	112.4	L84 C86 G92	L84-F88 HydrophobicContact CD2-CD2 4.1Å; L84-F88 HydrophobicContact CD2-CE2 3.87Å; L84-F88 WeakPolarHBondContact O-CD2 3.16Å; L84-F88 PolarHBondContact O-N 3.39Å; C86-F88 VanDerWaalsContact C-N 3.35Å; F88-G92 PolarHBondContact O-N 3.07Å
89	F	57.5	Low	54.6	Low	29 Å²	29	62.7 Å²	62.7	13%	0.127	34%	0.344	C	S	.	.	H	α-helix	trans	-64.3	-47.5	175.4	-173.7	-104.6	0	0	0	112.4	S33 G50 A54 P85 C86 G92 I93	S33-F89 WeakPolarHBondContact OG-CE1 2.91Å; G50-F89 VanDerWaalsContact O-CE2 3.3Å; G50-F89 WeakPolarHBondContact O-CE2 3.47Å; A54-F89 HydrophobicContact CB-CD2 3.75Å; A54-F89 HydrophobicContact CB-CE2 3.61Å; P85-F89 WeakPolarHBondContact O-CB 3.16Å; P85-F89 PolarHBondContact O-N 3.01Å; C86-F89 PolarHBondContact O-N 2.93Å; F89-G92 PolarHBondContact O-N 2.72Å; F89-I93 HydrophobicContact CD1-CD1 4.21Å; F89-I93 HydrophobicContact CE1-CD1 3.59Å; F89-I93 HydrophobicContact CE2-CD1 4.27Å; F89-I93 HydrophobicContact CZ-CD1 3.64Å; F89-I93 WeakPolarHBondContact O-CG1 3.41Å; F89-I93 PolarHBondContact O-N 3.39Å; F89-I93 VanDerWaalsContact O-N 3.07Å
90	A	55.7	Low	55	Low	10 Å²	10	62.6 Å²	62.6	8%	0.083	34%	0.343	C	S	.	.	H	α-helix	trans	-65.9	-40	177.7	0	0	0	0	0	112.4	F7 C86 I87 T94	F7-A90 HydrophobicContact CE2-CB 3.66Å; F7-A90 HydrophobicContact CZ-CB 3.91Å; C86-A90 VanDerWaalsContact O-CB 3.29Å; C86-A90 WeakPolarHBondContact O-CB 3.41Å; C86-A90 PolarHBondContact O-N 3.49Å; I87-A90 PolarHBondContact O-N 3.38Å; A90-T94 WeakPolarHBondContact O-CB 3.48Å; A90-T94 PolarHBondContact O-N 3.47Å; A90-T94 PolarHBondContact O-OG1 3.41Å
91	G	58.6	Low	55.4	Low	34 Å²	34	67.9 Å²	67.9	35%	0.351	37%	0.366	S	S	.	.	H	α-helix	trans	-63.6	-42.6	174.8	0	0	0	0	0	112.2	I87 T94 M95	I87-G91 PolarHBondContact O-N 3.25Å; G91-T94 PolarHBondContact O-N 2.93Å; G91-M95 PolarHBondContact O-N 3.29Å
92	G	58.5	Low	55.8	Low	25 Å²	25	67.6 Å²	67.6	26%	0.258	37%	0.372	S	S	.	.	H	α-helix	trans	-61.4	-45.5	176.5	0	0	0	0	0	112.9	F88 F89 T94 G96	F88-G92 PolarHBondContact O-N 3.07Å; F89-G92 PolarHBondContact O-N 2.72Å; G92-T94 VanDerWaalsContact C-N 3.34Å; G92-T94 PolarHBondContact O-N 3.03Å; G92-G96 PolarHBondContact O-N 3.34Å
93	I	55	Low	56.3	Low	32 Å²	32	67.8 Å²	67.8	16%	0.164	38%	0.377	C	S	.	.	H	α-helix	trans	-65.9	-38.6	176.4	-67	-174.6	0	0	0	111.4	L36 F89 G96 N97	L36-I93 HydrophobicContact CD2-CB 4.34Å; L36-I93 HydrophobicContact CD2-CD1 4.41Å; L36-I93 HydrophobicContact CD2-CG2 3.77Å; F89-I93 HydrophobicContact CD1-CD1 4.21Å; F89-I93 HydrophobicContact CE1-CD1 3.59Å; F89-I93 HydrophobicContact CE2-CD1 4.27Å; F89-I93 HydrophobicContact CZ-CD1 3.64Å; F89-I93 WeakPolarHBondContact O-CG1 3.41Å; F89-I93 PolarHBondContact O-N 3.39Å; F89-I93 VanDerWaalsContact O-N 3.07Å; I93-G96 PolarHBondContact O-N 2.83Å; I93-N97 PolarHBondContact O-N 3.06Å
94	T	57.1	Low	56.9	Low	70 Å²	70	68.7 Å²	68.7	43%	0.429	39%	0.388	S	S	.	.	H	α-helix	trans	-66.4	-47.7	-179.8	-54.4	0	0	0	0	111.4	A90 G91 G92 N97 I98	A90-T94 WeakPolarHBondContact O-CB 3.48Å; A90-T94 PolarHBondContact O-N 3.47Å; A90-T94 PolarHBondContact O-OG1 3.41Å; G91-T94 PolarHBondContact O-N 2.93Å; G92-T94 VanDerWaalsContact C-N 3.34Å; G92-T94 PolarHBondContact O-N 3.03Å; T94-N97 PolarHBondContact O-N 3.39Å; T94-I98 HydrophobicContact CG2-CD1 4.2Å; T94-I98 WeakPolarHBondContact O-CG1 3.48Å; T94-I98 PolarHBondContact O-N 3.05Å; T94-I98 VanDerWaalsContact O-N 3.17Å
95	M	56	Low	57.2	Low	141 Å²	141	74.1 Å²	74.1	70%	0.695	41%	0.406	S	S	*	.	H	α-helix	trans	-66.5	-36.6	176.4	-75.2	-63.2	-170.6	0	0	112.2	G91 N97 I98 G99	G91-M95 PolarHBondContact O-N 3.29Å; M95-N97 PolarHBondContact O-N 3.17Å; M95-I98 PolarHBondContact O-N 3.4Å; M95-I98 HydrophobicContact SD-CD1 4.43Å; M95-G99 PolarHBondContact O-N 3.05Å
96	G	56.1	Low	57.9	Low	43 Å²	43	78.6 Å²	78.6	44%	0.443	42%	0.424	S	S	.	.	H	α-helix	trans	-61.6	-40.6	175.6	0	0	0	0	0	113.3	G92 I93 G99 R100	G92-G96 PolarHBondContact O-N 3.34Å; I93-G96 PolarHBondContact O-N 2.83Å; G96-G99 PolarHBondContact O-N 3.47Å; G96-R100 PolarHBondContact O-N 3.47Å
97	N	53.7	Low	58.2	Low	38 Å²	38	81 Å²	81	20%	0.203	44%	0.44	C	S	.	.	H	α-helix	trans	-70.7	-35.5	176.5	-78.4	-23.6	0	0	0	113	F40 I93 T94 M95 R100 Q101	F40-N97 WeakPolarHBondContact CD1-ND2 3.25Å; F40-N97 HydrophobicContact CE1-CB 4.49Å; F40-N97 WeakPolarHBondContact CE1-ND2 3.29Å; F40-N97 WeakPolarHBondContact CG-ND2 3.2Å; I93-N97 PolarHBondContact O-N 3.06Å; T94-N97 PolarHBondContact O-N 3.39Å; M95-N97 PolarHBondContact O-N 3.17Å; N97-R100 PolarHBondContact O-N 2.9Å; N97-Q101 VanDerWaalsContact O-CG 3.29Å; N97-Q101 WeakPolarHBondContact O-CG 3.4Å; N97-Q101 PolarHBondContact O-N 3.31Å
98	I	62.1	Low	58.4	Low	83 Å²	83	83 Å²	83	43%	0.426	45%	0.446	S	S	.	.	H	α-helix	trans	-66.3	-44.1	174.1	-66.8	164.5	0	0	0	110.3	T94 M95 R100 Q101 L102	T94-I98 HydrophobicContact CG2-CD1 4.2Å; T94-I98 WeakPolarHBondContact O-CG1 3.48Å; T94-I98 PolarHBondContact O-N 3.05Å; T94-I98 VanDerWaalsContact O-N 3.17Å; M95-I98 PolarHBondContact O-N 3.4Å; M95-I98 HydrophobicContact SD-CD1 4.43Å; I98-R100 VanDerWaalsContact C-N 3.32Å; I98-R100 PolarHBondContact O-N 3.45Å; I98-Q101 PolarHBondContact O-N 3.41Å; I98-L102 HydrophobicContact CG2-CD1 3.8Å; I98-L102 WeakPolarHBondContact O-CB 3.49Å; I98-L102 WeakPolarHBondContact O-CG 3.36Å; I98-L102 PolarHBondContact O-N 3.49Å
99	G	56.8	Low	59	Low	38 Å²	38	79 Å²	79	39%	0.392	43%	0.432	S	S	.	.	H	α-helix	trans	-60	-39.5	176	0	0	0	0	0	113	M95 G96 L102 A103	M95-G99 PolarHBondContact O-N 3.05Å; G96-G99 PolarHBondContact O-N 3.47Å; G99-L102 PolarHBondContact O-N 3.46Å; G99-A103 WeakPolarHBondContact O-CB 3.38Å; G99-A103 PolarHBondContact O-N 3.41Å
100	R	56.8	Low	59.4	Low	106 Å²	106	82.6 Å²	82.6	40%	0.4	45%	0.452	S	S	.	.	H	α-helix	trans	-70.6	-36.4	177.3	-162	-178.8	-81.2	177	-3.2	112.5	D41 G96 N97 I98 M104	D41-R100 IonicContact OD2-NH1 3.39Å; D41-R100 PolarHBondContact OD2-NH1 2.95Å; G96-R100 PolarHBondContact O-N 3.47Å; N97-R100 PolarHBondContact O-N 2.9Å; I98-R100 VanDerWaalsContact C-N 3.32Å; I98-R100 PolarHBondContact O-N 3.45Å; R100-M104 WeakPolarHBondContact O-CG 3.48Å; R100-M104 PolarHBondContact O-N 2.9Å; R100-M104 VanDerWaalsContact O-N 3.12Å
101	Q	53.8	Low	59.8	Low	143 Å²	143	84.5 Å²	84.5	67%	0.668	47%	0.468	S	S	*	.	H	α-helix	trans	-64.9	-42.5	172.1	-74.3	-79.8	6.2	0	0	111.5	N97 I98 M104 Y105	N97-Q101 VanDerWaalsContact O-CG 3.29Å; N97-Q101 WeakPolarHBondContact O-CG 3.4Å; N97-Q101 PolarHBondContact O-N 3.31Å; I98-Q101 PolarHBondContact O-N 3.41Å; Q101-M104 PolarHBondContact O-N 2.95Å; Q101-Y105 WeakPolarHBondContact O-CB 3.35Å; Q101-Y105 PolarHBondContact O-N 3.12Å
102	L	61.3	Low	60	Low	108 Å²	108	88.6 Å²	88.6	57%	0.565	48%	0.478	S	S	*	.	H	α-helix	trans	-62.9	-42.9	175.7	-80.5	159.6	0	0	0	112.1	I98 G99 M104 Y105 E106	I98-L102 HydrophobicContact CG2-CD1 3.8Å; I98-L102 WeakPolarHBondContact O-CB 3.49Å; I98-L102 WeakPolarHBondContact O-CG 3.36Å; I98-L102 PolarHBondContact O-N 3.49Å; G99-L102 PolarHBondContact O-N 3.46Å; L102-M104 PolarHBondContact O-N 3.25Å; L102-Y105 WeakPolarHBondContact O-CB 3.41Å; L102-Y105 PolarHBondContact O-N 2.98Å; L102-E106 WeakPolarHBondContact O-CB 3.5Å; L102-E106 PolarHBondContact O-N 3.45Å
103	A	60.8	Low	59.9	Low	61 Å²	61	94.2 Å²	94.2	50%	0.504	50%	0.495	S	S	.	.	H	α-helix	trans	-64.4	-39.3	177.4	0	0	0	0	0	112.9	G99 Y105 C107	G99-A103 WeakPolarHBondContact O-CB 3.38Å; G99-A103 PolarHBondContact O-N 3.41Å; A103-Y105 VanDerWaalsContact C-N 3.34Å; A103-C107 WeakPolarHBondContact O-CB 3.36Å; A103-C107 PolarHBondContact O-N 3.01Å
104	M	62.2	Low	60.1	Low	136 Å²	136	96.7 Å²	96.7	67%	0.67	52%	0.515	S	S	*	.	H	α-helix	trans	-68.4	-35.4	174.4	-71.4	-74.8	-87.2	0	0	111.8	R100 Q101 L102 K108	R100-M104 WeakPolarHBondContact O-CG 3.48Å; R100-M104 PolarHBondContact O-N 2.9Å; R100-M104 VanDerWaalsContact O-N 3.12Å; Q101-M104 PolarHBondContact O-N 2.95Å; L102-M104 PolarHBondContact O-N 3.25Å; M104-K108 WeakPolarHBondContact O-CB 3.47Å; M104-K108 PolarHBondContact O-N 3.25Å
105	Y	59.4	Low	60.1	Low	168 Å²	168	101.6 Å²	101.6	66%	0.659	53%	0.533	S	S	*	.	H	α-helix	trans	-66.4	-47.4	176.1	-160.6	-91.6	0	0	0	111.4	Q101 L102 A103 C107 K108 V109	Q101-Y105 WeakPolarHBondContact O-CB 3.35Å; Q101-Y105 PolarHBondContact O-N 3.12Å; L102-Y105 WeakPolarHBondContact O-CB 3.41Å; L102-Y105 PolarHBondContact O-N 2.98Å; A103-Y105 VanDerWaalsContact C-N 3.34Å; Y105-C107 PolarHBondContact O-N 3.02Å; Y105-K108 PolarHBondContact O-N 2.9Å; Y105-V109 HydrophobicContact CD1-CG2 4Å; Y105-V109 HydrophobicContact CE1-CG2 3.89Å; Y105-V109 VanDerWaalsContact O-CG2 3.27Å; Y105-V109 WeakPolarHBondContact O-CG2 3.4Å; Y105-V109 PolarHBondContact O-N 2.95Å
106	E	66.5	Low	60	Low	123 Å²	123	103.3 Å²	103.3	58%	0.575	54%	0.539	S	S	*	.	H	α-helix	trans	-55.8	-48.2	172.7	-88.9	-86.4	124.7	0	0	111.8	L102 K108 V109 I110	L102-E106 WeakPolarHBondContact O-CB 3.5Å; L102-E106 PolarHBondContact O-N 3.45Å; E106-K108 VanDerWaalsContact C-N 3.33Å; E106-K108 PolarHBondContact O-N 3.23Å; E106-V109 PolarHBondContact O-N 3.39Å; E106-I110 WeakPolarHBondContact O-CD1 3.26Å; E106-I110 VanDerWaalsContact O-CG1 3.26Å; E106-I110 WeakPolarHBondContact O-CG1 3.47Å; E106-I110 PolarHBondContact O-N 3.28Å
107	C	61.5	Low	59.5	Low	83 Å²	83	112.4 Å²	112.4	56%	0.561	57%	0.57	S	S	*	*	H	α-helix	trans	-63.3	-38.8	179.9	-168	0	0	0	0	112.3	A103 Y105 I110 A111	A103-C107 WeakPolarHBondContact O-CB 3.36Å; A103-C107 PolarHBondContact O-N 3.01Å; Y105-C107 PolarHBondContact O-N 3.02Å; C107-I110 PolarHBondContact O-N 3.47Å; C107-A111 WeakPolarHBondContact O-CB 3.27Å; C107-A111 PolarHBondContact O-N 2.92Å
108	K	61.5	Low	59.8	Low	137 Å²	137	116.2 Å²	116.2	60%	0.596	59%	0.588	S	S	*	*	H	α-helix	trans	-66.8	-41.9	175.9	-164.8	179.6	-179.5	-168.9	0	112	M104 Y105 E106 A111 E112	M104-K108 WeakPolarHBondContact O-CB 3.47Å; M104-K108 PolarHBondContact O-N 3.25Å; Y105-K108 PolarHBondContact O-N 2.9Å; E106-K108 VanDerWaalsContact C-N 3.33Å; E106-K108 PolarHBondContact O-N 3.23Å; K108-A111 PolarHBondContact O-N 3.32Å; K108-E112 PolarHBondContact O-N 2.94Å
109	V	67.1	Low	59.6	Low	51 Å²	51	117.9 Å²	117.9	31%	0.309	60%	0.597	S	S	.	*	H	α-helix	trans	-63.3	-40.5	175.8	169	0	0	0	0	111.5	Y105 E106 K113	Y105-V109 HydrophobicContact CD1-CG2 4Å; Y105-V109 HydrophobicContact CE1-CG2 3.89Å; Y105-V109 VanDerWaalsContact O-CG2 3.27Å; Y105-V109 WeakPolarHBondContact O-CG2 3.4Å; Y105-V109 PolarHBondContact O-N 2.95Å; E106-V109 PolarHBondContact O-N 3.39Å; V109-K113 PolarHBondContact O-N 3.27Å; V109-K113 VanDerWaalsContact O-N 3.13Å
110	I	66.7	Low	59.8	Low	105 Å²	105	122.3 Å²	122.3	54%	0.538	61%	0.608	S	S	.	*	H	α-helix	trans	-66.7	-42.8	176.7	-67.4	162.1	0	0	0	110.8	E106 C107 K113 S114	E106-I110 WeakPolarHBondContact O-CD1 3.26Å; E106-I110 VanDerWaalsContact O-CG1 3.26Å; E106-I110 WeakPolarHBondContact O-CG1 3.47Å; E106-I110 PolarHBondContact O-N 3.28Å; C107-I110 PolarHBondContact O-N 3.47Å; I110-K113 PolarHBondContact O-N 3.34Å; I110-S114 PolarHBondContact O-N 3.4Å; I110-S114 VanDerWaalsContact O-N 3.09Å
111	A	63.8	Low	60	Low	50 Å²	50	123.3 Å²	123.3	41%	0.413	62%	0.621	S	S	.	*	H	α-helix	trans	-64.3	-39.4	177.3	0	0	0	0	0	112.7	C107 K108 S114 H115	C107-A111 WeakPolarHBondContact O-CB 3.27Å; C107-A111 PolarHBondContact O-N 2.92Å; K108-A111 PolarHBondContact O-N 3.32Å; A111-S114 PolarHBondContact O-N 3.09Å; A111-H115 PolarHBondContact O-N 3.13Å
112	E	62.8	Low	60.3	Low	120 Å²	120	122.1 Å²	122.1	56%	0.561	62%	0.618	S	S	*	*	H	α-helix	trans	-65.4	-38.1	175.2	-79.6	-174.5	83.9	0	0	112.3	K108 H115	K108-E112 PolarHBondContact O-N 2.94Å; E112-H115 PolarHBondContact O-N 3.27Å
113	K	57.6	Low	60.3	Low	142 Å²	142	123 Å²	123	62%	0.617	62%	0.621	S	S	*	*	H	α-helix	trans	-65.1	-40.3	174.7	-75.9	-171.2	-176.9	-175.1	0	112.8	V109 I110 H115 Q116	V109-K113 PolarHBondContact O-N 3.27Å; V109-K113 VanDerWaalsContact O-N 3.13Å; I110-K113 PolarHBondContact O-N 3.34Å; K113-H115 VanDerWaalsContact C-N 3.26Å; K113-H115 PolarHBondContact O-N 3.34Å; K113-Q116 PolarHBondContact O-N 3.38Å
114	S	59.1	Low	60.2	Low	84 Å²	84	127.4 Å²	127.4	59%	0.587	63%	0.629	S	S	*	*	H	α-helix	trans	-68	-21.7	178.4	-179.7	0	0	0	0	114	I110 A111	I110-S114 PolarHBondContact O-N 3.4Å; I110-S114 VanDerWaalsContact O-N 3.09Å; A111-S114 PolarHBondContact O-N 3.09Å
115	H	55.9	Low	60.1	Low	173 Å²	173	126.8 Å²	126.8	80%	0.801	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.1	-9.2	177.7	-96.1	-81.1	0	0	0	113.5	A111 E112 K113	A111-H115 PolarHBondContact O-N 3.13Å; E112-H115 PolarHBondContact O-N 3.27Å; K113-H115 VanDerWaalsContact C-N 3.26Å; K113-H115 PolarHBondContact O-N 3.34Å
116	Q	53.6	Low	60.2	Low	177 Å²	177	123.3 Å²	123.3	83%	0.827	62%	0.624	S	S	*	*			trans	-97.7	-4.3	176	-77.2	-166.8	-66.8	0	0	113.9	K113	K113-Q116 PolarHBondContact O-N 3.38Å
117	E	45.8	Very low	59.6	Low	235 Å²	235	123.4 Å²	123.4	100%	1.098	63%	0.628	S	S	*	*			trans	-92.9	0	172	-76.3	-176.2	86.2	0	0	112.7

Retrieved 117 of 117 residues in 470.8 ms (Link to these results)

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