G4VS58_SCHMA Loading...

Prohibitin

AlphaFold DB , UniProt , Accession G4VS58, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 288 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	42.2	Very low	48.7	Very low	234 Å²	234	134.7 Å²	134.7	100%	1.153	72%	0.721	S	S	*	*				0	52.9	0	-156.8	129.1	69.3	0	0	111.1
2	N	48.7	Very low	49.4	Very low	149 Å²	149	131.8 Å²	131.8	80%	0.797	71%	0.711	S	S	*	*			trans	-117.3	0.8	-173.7	-87.7	-0.5	0	0	0	115
3	N	51.1	Low	49.8	Very low	139 Å²	139	128.5 Å²	128.5	74%	0.743	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.5	-6.1	-173.7	-78.7	-12.4	0	0	0	115.3
4	L	52	Low	50	Low	164 Å²	164	121.9 Å²	121.9	86%	0.859	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.8	-10.6	178.9	-104.8	129.5	0	0	0	114.2
5	K	48.5	Very low	50.7	Low	172 Å²	172	116.7 Å²	116.7	75%	0.748	65%	0.654	S	S	*	*	S	Bend	trans	-83.1	-22.8	178.4	-98.5	-177.8	174	-178.8	0	114.7
6	N	50.6	Low	51.7	Low	102 Å²	102	112 Å²	112	55%	0.545	64%	0.64	S	S	.	*	H	α-helix	trans	-84.6	-25.6	-170	-73.5	-7.9	0	0	0	114.4	N9	N6-N9 PolarHBondContact O-N 3.32Å
7	I	51.7	Low	53.1	Low	145 Å²	145	114.5 Å²	114.5	74%	0.744	64%	0.642	S	S	*	*	H	α-helix	trans	-75.5	-28.3	179.8	-59.2	175.3	0	0	0	111.2	N9	I7-N9 VanDerWaalsContact C-N 3.26Å; I7-N9 PolarHBondContact O-N 3.37Å
8	A	51.2	Low	54.5	Low	66 Å²	66	115.2 Å²	115.2	55%	0.545	64%	0.642	S	S	.	*	H	α-helix	trans	-64.2	-30.3	171.8	0	0	0	0	0	112.5	V12	A8-V12 VanDerWaalsContact O-CG2 3.3Å; A8-V12 WeakPolarHBondContact O-CG2 3.3Å
9	N	45.8	Very low	55.6	Low	88 Å²	88	111.3 Å²	111.3	47%	0.471	63%	0.631	S	S	.	*	H	α-helix	trans	-78.1	-29.6	-175.9	-81.8	-1.1	0	0	0	114.5	N6 I7 V12 I13	N6-N9 PolarHBondContact O-N 3.32Å; I7-N9 VanDerWaalsContact C-N 3.26Å; I7-N9 PolarHBondContact O-N 3.37Å; N9-V12 PolarHBondContact O-N 2.88Å; N9-I13 VanDerWaalsContact O-CG1 3.29Å; N9-I13 WeakPolarHBondContact O-CG1 3.29Å; N9-I13 PolarHBondContact O-N 3.02Å
10	F	46.9	Very low	56.7	Low	165 Å²	165	108.4 Å²	108.4	72%	0.724	62%	0.621	S	S	*	*	H	α-helix	trans	-71.5	-31.9	178.3	-96.1	-82.2	0	0	0	112.7	V12 G14	F10-V12 VanDerWaalsContact C-N 3.3Å; F10-G14 PolarHBondContact O-N 2.86Å
11	G	47.2	Very low	57.8	Low	58 Å²	58	105.7 Å²	105.7	60%	0.598	61%	0.612	S	S	*	*	H	α-helix	trans	-64.2	-35.2	168.3	0	0	0	0	0	112.5	G15	G11-G15 PolarHBondContact O-N 2.99Å
12	V	56.6	Low	59.6	Low	100 Å²	100	96.6 Å²	96.6	61%	0.606	57%	0.574	S	S	*	*	H	α-helix	trans	-74.4	-40.6	177.8	176.4	0	0	0	0	112.1	A8 N9 F10 G16	A8-V12 VanDerWaalsContact O-CG2 3.3Å; A8-V12 WeakPolarHBondContact O-CG2 3.3Å; N9-V12 PolarHBondContact O-N 2.88Å; F10-V12 VanDerWaalsContact C-N 3.3Å; V12-G16 PolarHBondContact O-N 3.18Å
13	I	54.4	Low	60.8	Low	89 Å²	89	92.3 Å²	92.3	46%	0.456	56%	0.559	S	S	.	*	H	α-helix	trans	-72.6	-45.2	179.3	-63.6	165	0	0	0	110.5	N9 G16 F17	N9-I13 VanDerWaalsContact O-CG1 3.29Å; N9-I13 WeakPolarHBondContact O-CG1 3.29Å; N9-I13 PolarHBondContact O-N 3.02Å; I13-G16 PolarHBondContact O-N 3.04Å; I13-F17 HydrophobicContact CG2-CD2 3.88Å; I13-F17 HydrophobicContact CG2-CE2 3.79Å; I13-F17 VanDerWaalsContact O-CD2 3.3Å; I13-F17 WeakPolarHBondContact O-CD2 3.32Å; I13-F17 PolarHBondContact O-N 3.25Å
14	G	53.2	Low	62	Low	35 Å²	35	91.5 Å²	91.5	36%	0.361	55%	0.554	S	S	.	*	H	α-helix	trans	-63.9	-42.5	176	0	0	0	0	0	112.7	F10 G16 I18	F10-G14 PolarHBondContact O-N 2.86Å; G14-G16 VanDerWaalsContact C-N 3.33Å; G14-I18 WeakPolarHBondContact O-CG1 3.3Å; G14-I18 PolarHBondContact O-N 2.87Å
15	G	60.5	Low	63.1	Low	44 Å²	44	88 Å²	88	45%	0.454	54%	0.54	S	S	.	.	H	α-helix	trans	-65.3	-34.8	172.9	0	0	0	0	0	113.1	G11 G19	G11-G15 PolarHBondContact O-N 2.99Å; G15-G19 PolarHBondContact O-N 3.17Å
16	G	66	Low	64.3	Low	42 Å²	42	85.5 Å²	85.5	43%	0.433	54%	0.535	S	S	.	.	H	α-helix	trans	-66.3	-43.9	177.2	0	0	0	0	0	113.4	V12 I13 G14 A20	V12-G16 PolarHBondContact O-N 3.18Å; I13-G16 PolarHBondContact O-N 3.04Å; G14-G16 VanDerWaalsContact C-N 3.33Å; G16-A20 VanDerWaalsContact O-CB 3.31Å; G16-A20 WeakPolarHBondContact O-CB 3.29Å; G16-A20 PolarHBondContact O-N 3.41Å
17	F	75.9	Confident	65.3	Low	154 Å²	154	81.1 Å²	81.1	68%	0.675	51%	0.513	S	S	*	.	H	α-helix	trans	-68.7	-40.9	175.9	-83.3	-76.5	0	0	0	112.6	I13 A20 A21	I13-F17 HydrophobicContact CG2-CD2 3.88Å; I13-F17 HydrophobicContact CG2-CE2 3.79Å; I13-F17 VanDerWaalsContact O-CD2 3.3Å; I13-F17 WeakPolarHBondContact O-CD2 3.32Å; I13-F17 PolarHBondContact O-N 3.25Å; F17-A20 PolarHBondContact O-N 2.9Å; F17-A21 VanDerWaalsContact O-CB 3.32Å; F17-A21 WeakPolarHBondContact O-CB 3.31Å; F17-A21 PolarHBondContact O-N 2.95Å
18	I	77.7	Confident	66.3	Low	127 Å²	127	79.1 Å²	79.1	65%	0.651	50%	0.504	S	S	*	.	H	α-helix	trans	-65	-42.4	175.5	-66.2	169.6	0	0	0	110.5	G14 A21 A22	G14-I18 WeakPolarHBondContact O-CG1 3.3Å; G14-I18 PolarHBondContact O-N 2.87Å; I18-A21 PolarHBondContact O-N 2.9Å; I18-A22 VanDerWaalsContact O-CB 3.29Å; I18-A22 WeakPolarHBondContact O-CB 3.38Å; I18-A22 PolarHBondContact O-N 3.44Å
19	G	76.9	Confident	67.4	Low	42 Å²	42	80.2 Å²	80.2	43%	0.433	51%	0.507	S	S	.	.	H	α-helix	trans	-62.9	-42.2	175.5	0	0	0	0	0	112.9	G15 A23	G15-G19 PolarHBondContact O-N 3.17Å; G19-A23 WeakPolarHBondContact O-CB 3.32Å; G19-A23 PolarHBondContact O-N 2.88Å
20	A	77.6	Confident	68.8	Low	52 Å²	52	81.1 Å²	81.1	43%	0.43	51%	0.509	S	S	.	.	H	α-helix	trans	-67.1	-43.4	176	0	0	0	0	0	112.2	G16 F17 A23 L24	G16-A20 VanDerWaalsContact O-CB 3.31Å; G16-A20 WeakPolarHBondContact O-CB 3.29Å; G16-A20 PolarHBondContact O-N 3.41Å; F17-A20 PolarHBondContact O-N 2.9Å; A20-A23 PolarHBondContact O-N 2.98Å; A20-L24 WeakPolarHBondContact O-CG 3.22Å; A20-L24 PolarHBondContact O-N 3.27Å
21	A	79.7	Confident	70.3	Confident	52 Å²	52	73.6 Å²	73.6	43%	0.43	48%	0.476	S	S	.	.	H	α-helix	trans	-63.1	-43	176.2	0	0	0	0	0	111.6	F17 I18 A23 L24 T25	F17-A21 VanDerWaalsContact O-CB 3.32Å; F17-A21 WeakPolarHBondContact O-CB 3.31Å; F17-A21 PolarHBondContact O-N 2.95Å; I18-A21 PolarHBondContact O-N 2.9Å; A21-A23 VanDerWaalsContact C-N 3.35Å; A21-A23 PolarHBondContact O-N 3.5Å; A21-L24 PolarHBondContact O-N 3.07Å; A21-T25 WeakPolarHBondContact O-CG2 3.33Å; A21-T25 PolarHBondContact O-N 3.21Å; A21-T25 PolarHBondContact O-OG1 3.46Å
22	A	78.5	Confident	72.1	Confident	43 Å²	43	76.1 Å²	76.1	36%	0.355	47%	0.471	S	S	.	.	H	α-helix	trans	-62.7	-39.9	174.6	0	0	0	0	0	112.2	I18 L24 T25 L26	I18-A22 VanDerWaalsContact O-CB 3.29Å; I18-A22 WeakPolarHBondContact O-CB 3.38Å; I18-A22 PolarHBondContact O-N 3.44Å; A22-L24 VanDerWaalsContact C-N 3.34Å; A22-T25 WeakPolarHBondContact CA-OG1 3.39Å; A22-T25 PolarHBondContact O-N 3.49Å; A22-T25 PolarHBondContact O-OG1 2.85Å; A22-T25 VanDerWaalsContact O-OG1 3.07Å; A22-L26 VanDerWaalsContact O-CB 3.31Å; A22-L26 WeakPolarHBondContact O-CB 3.41Å; A22-L26 VanDerWaalsContact O-CG 3.22Å; A22-L26 WeakPolarHBondContact O-CG 3.48Å; A22-L26 PolarHBondContact O-N 3.28Å
23	A	75.3	Confident	73.5	Confident	59 Å²	59	72.3 Å²	72.3	49%	0.488	45%	0.446	S	S	.	.	H	α-helix	trans	-64.7	-38.3	175.6	0	0	0	0	0	112.2	G19 A20 A21 G27	G19-A23 WeakPolarHBondContact O-CB 3.32Å; G19-A23 PolarHBondContact O-N 2.88Å; A20-A23 PolarHBondContact O-N 2.98Å; A21-A23 VanDerWaalsContact C-N 3.35Å; A21-A23 PolarHBondContact O-N 3.5Å; A23-G27 PolarHBondContact O-N 2.92Å
24	L	75.7	Confident	75.1	Confident	122 Å²	122	72.7 Å²	72.7	64%	0.639	45%	0.453	S	S	*	.	H	α-helix	trans	-70.5	-42.2	176.8	-70	172.6	0	0	0	112.2	A20 A21 A22 G27 L28	A20-L24 WeakPolarHBondContact O-CG 3.22Å; A20-L24 PolarHBondContact O-N 3.27Å; A21-L24 PolarHBondContact O-N 3.07Å; A22-L24 VanDerWaalsContact C-N 3.34Å; L24-G27 PolarHBondContact O-N 2.96Å; L24-L28 WeakPolarHBondContact O-CB 3.31Å; L24-L28 VanDerWaalsContact O-CG 3.31Å; L24-L28 WeakPolarHBondContact O-CG 3.4Å; L24-L28 PolarHBondContact O-N 3.32Å
25	T	75.8	Confident	76.9	Confident	92 Å²	92	71.2 Å²	71.2	56%	0.564	44%	0.436	S	S	*	.	H	α-helix	trans	-67.8	-42.2	178.2	54.8	0	0	0	0	111.9	A21 A22 G27 L28 S29	A21-T25 WeakPolarHBondContact O-CG2 3.33Å; A21-T25 PolarHBondContact O-N 3.21Å; A21-T25 PolarHBondContact O-OG1 3.46Å; A22-T25 WeakPolarHBondContact CA-OG1 3.39Å; A22-T25 PolarHBondContact O-N 3.49Å; A22-T25 PolarHBondContact O-OG1 2.85Å; A22-T25 VanDerWaalsContact O-OG1 3.07Å; T25-G27 VanDerWaalsContact C-N 3.33Å; T25-L28 PolarHBondContact O-N 3.14Å; T25-S29 WeakPolarHBondContact O-CB 3.29Å; T25-S29 PolarHBondContact O-N 2.87Å
26	L	72.4	Confident	78.4	Confident	119 Å²	119	74.2 Å²	74.2	62%	0.623	44%	0.442	S	S	*	.	H	α-helix	trans	-65	-38.4	172.8	-68.9	174.2	0	0	0	111.5	A22 Q30	A22-L26 VanDerWaalsContact O-CB 3.31Å; A22-L26 WeakPolarHBondContact O-CB 3.41Å; A22-L26 VanDerWaalsContact O-CG 3.22Å; A22-L26 WeakPolarHBondContact O-CG 3.48Å; A22-L26 PolarHBondContact O-N 3.28Å; L26-Q30 WeakPolarHBondContact O-CB 3.31Å; L26-Q30 WeakPolarHBondContact O-CG 3.47Å; L26-Q30 PolarHBondContact O-N 2.94Å; L26-Q30 VanDerWaalsContact O-N 3.14Å
27	G	72.9	Confident	79.6	Confident	10 Å²	10	73.5 Å²	73.5	10%	0.103	44%	0.435	C	S	.	.	H	α-helix	trans	-58.3	-55.4	172.9	0	0	0	0	0	111.6	A23 L24 T25 S29 Q30 S31 P64	A23-G27 PolarHBondContact O-N 2.92Å; L24-G27 PolarHBondContact O-N 2.96Å; T25-G27 VanDerWaalsContact C-N 3.33Å; G27-S29 PolarHBondContact O-N 3.34Å; G27-Q30 CarbonylContact O-C 3.58Å; G27-Q30 PolarHBondContact O-N 2.89Å; G27-S31 PolarHBondContact O-N 2.76Å; G27-S31 PolarHBondContact O-OG 2.97Å; G27-P64 VanDerWaalsContact O-CG 3.23Å; G27-P64 WeakPolarHBondContact O-CG 3.19Å
28	L	73	Confident	80.3	Confident	103 Å²	103	67 Å²	67	54%	0.539	41%	0.411	S	S	.	.	H	α-helix	trans	-63.7	-41.6	-178.6	-70	174	0	0	0	113.2	L24 T25 Q30 S31 F32	L24-L28 WeakPolarHBondContact O-CB 3.31Å; L24-L28 VanDerWaalsContact O-CG 3.31Å; L24-L28 WeakPolarHBondContact O-CG 3.4Å; L24-L28 PolarHBondContact O-N 3.32Å; T25-L28 PolarHBondContact O-N 3.14Å; L28-Q30 PolarHBondContact O-N 3.49Å; L28-S31 WeakPolarHBondContact O-CB 3.36Å; L28-S31 PolarHBondContact O-N 3.04Å; L28-F32 WeakPolarHBondContact O-CD2 3.34Å
29	S	72.4	Confident	81.1	Confident	88 Å²	88	63 Å²	63	62%	0.615	39%	0.389	S	S	*	.	H	α-helix	trans	-64.2	-30.9	177.1	-177.4	0	0	0	0	112	T25 G27	T25-S29 WeakPolarHBondContact O-CB 3.29Å; T25-S29 PolarHBondContact O-N 2.87Å; G27-S29 PolarHBondContact O-N 3.34Å
30	Q	75.5	Confident	81.9	Confident	108 Å²	108	63.2 Å²	63.2	51%	0.505	38%	0.377	S	S	.	.	H	α-helix	trans	-82.8	-15.7	174.4	-68.4	-66.8	-33.9	0	0	112.3	L26 G27 L28 F32 R62 P64	L26-Q30 WeakPolarHBondContact O-CB 3.31Å; L26-Q30 WeakPolarHBondContact O-CG 3.47Å; L26-Q30 PolarHBondContact O-N 2.94Å; L26-Q30 VanDerWaalsContact O-N 3.14Å; G27-Q30 CarbonylContact O-C 3.58Å; G27-Q30 PolarHBondContact O-N 2.89Å; L28-Q30 PolarHBondContact O-N 3.49Å; Q30-F32 VanDerWaalsContact C-N 3.34Å; Q30-F32 PolarHBondContact O-N 3.19Å; Q30-R62 PolarHBondContact O-NE 2.98Å; Q30-R62 VanDerWaalsContact O-NE 3.08Å; Q30-R62 PolarHBondContact O-NH2 3.08Å; Q30-P64 HydrophobicContact CB-CB 4.31Å; Q30-P64 HydrophobicContact CB-CG 4.18Å
31	S	78.3	Confident	82.6	Confident	6 Å²	6	60.8 Å²	60.8	4%	0.042	36%	0.357	C	S	.	.	H	α-helix	trans	-74.5	-21.5	-179.3	-59.9	0	0	0	0	114	G27 L28 F61 R62 P64	G27-S31 PolarHBondContact O-N 2.76Å; G27-S31 PolarHBondContact O-OG 2.97Å; L28-S31 WeakPolarHBondContact O-CB 3.36Å; L28-S31 PolarHBondContact O-N 3.04Å; S31-F61 CarbonylContact O-C 3.57Å; S31-F61 WeakPolarHBondContact O-CA 3.47Å; S31-R62 VanDerWaalsContact CA-O 3.27Å; S31-R62 WeakPolarHBondContact CA-O 3.27Å; S31-R62 VanDerWaalsContact CB-O 3.29Å; S31-R62 WeakPolarHBondContact CB-O 3.29Å; S31-R62 WeakPolarHBondContact O-CG 3.47Å; S31-R62 PolarHBondContact O-N 3.18Å; S31-P64 VanDerWaalsContact OG-CD 3.29Å; S31-P64 WeakPolarHBondContact OG-CD 3.23Å; S31-P64 VanDerWaalsContact OG-CG 3.27Å; S31-P64 WeakPolarHBondContact OG-CG 3.27Å
32	F	85.8	Confident	83.2	Confident	111 Å²	111	58.3 Å²	58.3	49%	0.487	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	134.2	179.5	-67.4	-70.9	0	0	0	111.2	L28 Q30 L59 F61	L28-F32 WeakPolarHBondContact O-CD2 3.34Å; Q30-F32 VanDerWaalsContact C-N 3.34Å; Q30-F32 PolarHBondContact O-N 3.19Å; F32-L59 HydrophobicContact CB-CD1 4.07Å; F32-L59 HydrophobicContact CD1-CD1 4.25Å; F32-L59 HydrophobicContact CD1-CD2 4.11Å; F32-L59 HydrophobicContact CD1-CG 4.17Å; F32-F61 HydrophobicContact CE1-CD2 4.27Å
33	Y	85.8	Confident	83.8	Confident	21 Å²	21	56.2 Å²	56.2	8%	0.082	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	149.9	167.2	74.6	-80	0	0	0	109.9	V35 A41 M43 H60 R62 P69	Y33-V35 HydrophobicContact CD2-CG2 4.05Å; Y33-V35 HydrophobicContact CE2-CG2 3.59Å; Y33-A41 HydrophobicContact CE2-CB 4.16Å; Y33-M43 HydrophobicContact CE1-CE 3.86Å; Y33-H60 HydrophobicContact CD1-CB 4.1Å; Y33-H60 WeakPolarHBondContact CD1-O 3.39Å; Y33-H60 HydrophobicContact CE1-CB 3.44Å; Y33-H60 VanDerWaalsContact CE1-CB 3.44Å; Y33-H60 HydrophobicContact CE2-CB 4Å; Y33-H60 PolarHBondContact N-O 3.49Å; Y33-H60 PolarHBondContact O-N 2.79Å; Y33-H60 WeakPolarHBondContact OH-CB 3.29Å; Y33-R62 HydrophobicContact CD1-CB 3.87Å; Y33-R62 HydrophobicContact CD1-CG 3.87Å; Y33-R62 HydrophobicContact CE1-CB 3.89Å; Y33-R62 HydrophobicContact CE1-CG 4.41Å; Y33-P69 HydrophobicContact CD2-CB 4.02Å; Y33-P69 HydrophobicContact CD2-CG 4.09Å; Y33-P69 HydrophobicContact CE2-CB 3.78Å; Y33-P69 HydrophobicContact CE2-CG 4.34Å; Y33-P69 HydrophobicContact CG-CG 4.18Å
34	T	89.2	Confident	84.5	Confident	97 Å²	97	56.9 Å²	56.9	60%	0.595	31%	0.311	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.6	138.1	177.8	-171.7	0	0	0	0	110.1	G58	T34-G58 CarbonylContact C-O 3.58Å; T34-G58 WeakPolarHBondContact CA-O 3.35Å
35	V	90.9	Very high	85.1	Confident	3 Å²	3	51.7 Å²	51.7	2%	0.018	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	118.2	171.5	179.9	0	0	0	0	107.3	Y33 H39 A41 E57 G58	Y33-V35 HydrophobicContact CD2-CG2 4.05Å; Y33-V35 HydrophobicContact CE2-CG2 3.59Å; V35-H39 HydrophobicContact CG1-CB 4.01Å; V35-A41 HydrophobicContact CG2-CB 3.7Å; V35-E57 WeakPolarHBondContact O-CA 3.43Å; V35-G58 PolarHBondContact N-O 2.89Å; V35-G58 PolarHBondContact O-N 2.88Å
36	D	91	Very high	85.6	Confident	107 Å²	107	54.4 Å²	54.4	57%	0.572	29%	0.285	S	S	*	.	P	Polyproline II helix	trans	-70.2	160.2	179.6	-172.3	28.7	0	0	0	112.1	G38 H39	D36-G38 PolarHBondContact O-N 2.76Å; D36-H39 WeakPolarHBondContact O-CB 3.31Å; D36-H39 PolarHBondContact O-N 3.11Å; D36-H39 VanDerWaalsContact O-N 3.12Å
37	G	90.4	Very high	86.3	Confident	27 Å²	27	55.9 Å²	55.9	28%	0.278	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	136.8	177	0	0	0	0	0	112.1	H39 R75	G37-H39 PolarHBondContact O-N 3.49Å; G37-H39 PolarHBondContact O-ND1 2.76Å; G37-R75 PolarHBondContact O-NH2 3.19Å
38	G	91.6	Very high	86.7	Confident	18 Å²	18	58.4 Å²	58.4	19%	0.186	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.5	13	-176.8	0	0	0	0	0	114.8	D36 I74	D36-G38 PolarHBondContact O-N 2.76Å; G38-I74 VanDerWaalsContact C-CG1 3.49Å; G38-I74 WeakPolarHBondContact O-CG1 3.46Å; G38-I74 PolarHBondContact O-N 3.24Å
39	H	94.1	Very high	87.5	Confident	42 Å²	42	54.8 Å²	54.8	19%	0.194	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	160.6	166.3	-63.6	79.8	0	0	0	110.8	V35 D36 G37 I71 Y72	V35-H39 HydrophobicContact CG1-CB 4.01Å; D36-H39 WeakPolarHBondContact O-CB 3.31Å; D36-H39 PolarHBondContact O-N 3.11Å; D36-H39 VanDerWaalsContact O-N 3.12Å; G37-H39 PolarHBondContact O-N 3.49Å; G37-H39 PolarHBondContact O-ND1 2.76Å; H39-I71 HydrophobicContact CB-CG2 3.64Å; H39-Y72 CarbonylContact C-O 3.6Å; H39-Y72 WeakPolarHBondContact CA-O 3.3Å; H39-Y72 WeakPolarHBondContact CB-O 3.46Å
40	R	93.2	Very high	88.3	Confident	48 Å²	48	51.4 Å²	51.4	18%	0.181	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	139.2	171.5	-68.3	-66.3	-178.2	-92.8	3.5	108.8	I54 Y55 E57 Y72 I74 V105 L108	R40-I54 HydrophobicContact CB-CG2 4.07Å; R40-I54 HydrophobicContact CG-CG2 4.38Å; R40-Y55 WeakPolarHBondContact CD-O 3.35Å; R40-E57 IonicContact NH1-OE2 2.73Å; R40-Y72 PolarHBondContact N-O 3.2Å; R40-Y72 PolarHBondContact O-N 2.78Å; R40-I74 HydrophobicContact CB-CG2 3.98Å; R40-I74 HydrophobicContact CG-CD1 3.89Å; R40-I74 HydrophobicContact CG-CG1 4.26Å; R40-I74 HydrophobicContact CG-CG2 3.69Å; R40-V105 HydrophobicContact CG-CG1 3.94Å; R40-L108 HydrophobicContact CB-CD1 3.56Å; R40-L108 HydrophobicContact CG-CD1 4.32Å
41	A	92.5	Very high	88.8	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	139.2	179	0	0	0	0	0	110.8	Y33 V35 Y55 I70 I71	Y33-A41 HydrophobicContact CE2-CB 4.16Å; V35-A41 HydrophobicContact CG2-CB 3.7Å; A41-Y55 PolarHBondContact N-O 3.49Å; A41-Y55 VanDerWaalsContact N-O 3.12Å; A41-Y55 PolarHBondContact O-N 3.13Å; A41-I70 WeakPolarHBondContact CA-O 3.34Å; A41-I71 HydrophobicContact CB-CG1 4.32Å
42	I	92.4	Very high	89.3	Confident	0 Å²	0	54 Å²	54	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	149.1	164.2	63.4	173.1	0	0	0	108.5	V50 I70 Y72 L108 P109 Y112	I42-V50 HydrophobicContact CD1-CG1 4.11Å; I42-I70 HydrophobicContact CD1-CB 4.35Å; I42-I70 HydrophobicContact CD1-CD1 4.25Å; I42-I70 HydrophobicContact CD1-CG2 4.5Å; I42-I70 HydrophobicContact CG1-CB 3.78Å; I42-I70 HydrophobicContact CG1-CD1 4.2Å; I42-I70 HydrophobicContact CG1-CG2 4.3Å; I42-I70 PolarHBondContact N-O 2.73Å; I42-I70 PolarHBondContact O-N 2.95Å; I42-Y72 HydrophobicContact CD1-CD2 4.37Å; I42-Y72 HydrophobicContact CD1-CE2 3.67Å; I42-Y72 HydrophobicContact CG1-CD2 4.36Å; I42-Y72 HydrophobicContact CG1-CE2 4.09Å; I42-L108 HydrophobicContact CG2-CB 3.75Å; I42-P109 HydrophobicContact CG2-CG 4.15Å; I42-Y112 HydrophobicContact CD1-CD1 4.02Å; I42-Y112 HydrophobicContact CD1-CD2 4Å; I42-Y112 HydrophobicContact CD1-CG 3.51Å
43	M	90.8	Very high	89.4	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	123	-178.8	-169.2	59.2	71.6	0	0	111.6	Y33 Q51 Y55 R62 Q67 P69	Y33-M43 HydrophobicContact CE1-CE 3.86Å; M43-Q51 HydrophobicContact CB-CB 4.45Å; M43-Q51 HydrophobicContact CB-CG 4.46Å; M43-Q51 PolarHBondContact O-N 2.83Å; M43-Y55 HydrophobicContact CB-CE2 3.72Å; M43-R62 HydrophobicContact CE-CB 4.02Å; M43-Q67 HydrophobicContact CE-CB 4.47Å; M43-Q67 HydrophobicContact CG-CB 4.12Å; M43-Q67 HydrophobicContact CG-CG 3.98Å; M43-Q67 HydrophobicContact SD-CB 3.55Å; M43-Q67 VanDerWaalsContact SD-CB 3.55Å; M43-Q67 HydrophobicContact SD-CG 4.11Å; M43-P69 HydrophobicContact CE-CB 4.13Å; M43-P69 HydrophobicContact SD-CB 4.44Å
44	F	90.5	Very high	89.7	Confident	72 Å²	72	55.9 Å²	55.9	32%	0.316	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	116.8	168.6	-179.6	-98.2	0	0	0	110.2	V50 Q67 Y68 I70	F44-V50 HydrophobicContact CD2-CG2 3.83Å; F44-V50 HydrophobicContact CE2-CG2 4.42Å; F44-Q67 WeakPolarHBondContact O-CA 3.32Å; F44-Y68 HydrophobicContact CD1-CD2 4.49Å; F44-Y68 PolarHBondContact N-O 2.86Å; F44-Y68 PolarHBondContact O-N 3.12Å; F44-I70 HydrophobicContact CB-CD1 3.79Å
45	S	89.3	Confident	89.8	Confident	13 Å²	13	53.3 Å²	53.3	9%	0.091	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	131.5	174.9	-63.2	0	0	0	0	110.5	I47 G48 G49 Q51 F66	S45-I47 PolarHBondContact O-N 2.84Å; S45-I47 VanDerWaalsContact O-N 3.16Å; S45-G48 PolarHBondContact O-N 2.91Å; S45-G49 PolarHBondContact N-O 3.45Å; S45-G49 VanDerWaalsContact O-CA 3.29Å; S45-G49 WeakPolarHBondContact O-CA 3.45Å; S45-G49 PolarHBondContact O-N 3.16Å; S45-Q51 PolarHBondContact OG-NE2 2.87Å; S45-F66 CarbonylContact C-O 3.57Å; S45-F66 WeakPolarHBondContact CA-O 3.34Å
46	R	85.5	Confident	89.9	Confident	150 Å²	150	56.9 Å²	56.9	57%	0.566	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-29.4	177.7	-71	-173.3	179.7	173.7	4.8	114.1	W65 F66 Y68	R46-W65 WeakPolarHBondContact CD-O 3.45Å; R46-W65 PolarHBondContact NE-O 3.5Å; R46-W65 VanDerWaalsContact NE-O 3.11Å; R46-F66 PolarHBondContact N-O 3.49Å; R46-Y68 HydrophobicContact CG-CE2 4.29Å; R46-Y68 PolarHBondContact NH2-OH 2.79Å
47	I	86.8	Confident	89.9	Confident	149 Å²	149	56.8 Å²	56.8	76%	0.764	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.8	-40	-176.9	-57	169.8	0	0	0	111.6	S45 F66	S45-I47 PolarHBondContact O-N 2.84Å; S45-I47 VanDerWaalsContact O-N 3.16Å; I47-F66 HydrophobicContact CD1-CD1 3.9Å; I47-F66 HydrophobicContact CD1-CE1 4Å; I47-F66 HydrophobicContact CG1-CD1 4.33Å
48	G	83	Confident	90	Very high	64 Å²	64	57 Å²	57	66%	0.66	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.5	2.1	-172	0	0	0	0	0	115.2	S45	S45-G48 PolarHBondContact O-N 2.91Å
49	G	88.7	Confident	89.9	Confident	26 Å²	26	61.9 Å²	61.9	27%	0.268	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	67.2	-149.5	-174.3	0	0	0	0	0	112.9	S45 Q51	S45-G49 PolarHBondContact N-O 3.45Å; S45-G49 VanDerWaalsContact O-CA 3.29Å; S45-G49 WeakPolarHBondContact O-CA 3.45Å; S45-G49 PolarHBondContact O-N 3.16Å; G49-Q51 PolarHBondContact O-N 3.02Å
50	V	88.3	Confident	89.7	Confident	17 Å²	17	61.7 Å²	61.7	10%	0.103	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	121.7	-178.9	-175.8	0	0	0	0	109.1	I42 F44 P109 Y112 R113	I42-V50 HydrophobicContact CD1-CG1 4.11Å; F44-V50 HydrophobicContact CD2-CG2 3.83Å; F44-V50 HydrophobicContact CE2-CG2 4.42Å; V50-P109 HydrophobicContact CG1-CB 4.17Å; V50-Y112 HydrophobicContact CB-CD1 4.45Å; V50-Y112 HydrophobicContact CG1-CD1 4.18Å; V50-Y112 HydrophobicContact CG2-CD1 3.42Å; V50-Y112 VanDerWaalsContact CG2-CD1 3.42Å; V50-Y112 HydrophobicContact CG2-CE1 3.51Å; V50-R113 HydrophobicContact CB-CG 4.27Å; V50-R113 HydrophobicContact CG2-CG 4.14Å; V50-R113 PolarHBondContact O-NH2 3.04Å
51	Q	87.5	Confident	89.4	Confident	52 Å²	52	65.1 Å²	65.1	24%	0.243	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	151	175.3	-61.4	-178.1	2.9	0	0	110.9	M43 S45 G49 E53 Y55	M43-Q51 HydrophobicContact CB-CB 4.45Å; M43-Q51 HydrophobicContact CB-CG 4.46Å; M43-Q51 PolarHBondContact O-N 2.83Å; S45-Q51 PolarHBondContact OG-NE2 2.87Å; G49-Q51 PolarHBondContact O-N 3.02Å; Q51-E53 VanDerWaalsContact C-N 3.28Å; Q51-Y55 PolarHBondContact OE1-OH 2.85Å
52	N	87.5	Confident	89.1	Confident	116 Å²	116	67 Å²	67	62%	0.62	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.5	-10	177.5	-68	-18.1	0	0	0	112.9	R113	N52-R113 PolarHBondContact OD1-NH1 2.85Å; N52-R113 PolarHBondContact OD1-NH2 3.11Å
53	E	89	Confident	88.8	Confident	120 Å²	120	70.9 Å²	70.9	56%	0.561	37%	0.372	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.4	134.7	178.5	-67.1	-178	-177.3	0	0	111.1	Q51 Y55	Q51-E53 VanDerWaalsContact C-N 3.28Å; E53-Y55 HydrophobicContact CB-CE2 4.39Å; E53-Y55 PolarHBondContact OE2-OH 2.89Å; E53-Y55 VanDerWaalsContact OE2-OH 3.13Å
54	I	91.6	Very high	88.3	Confident	52 Å²	52	71.4 Å²	71.4	27%	0.267	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	121.2	178	-61.7	146.2	0	0	0	107.8	R40 V105 L108 P109	R40-I54 HydrophobicContact CB-CG2 4.07Å; R40-I54 HydrophobicContact CG-CG2 4.38Å; I54-V105 WeakPolarHBondContact CD1-O 3.48Å; I54-V105 HydrophobicContact CG2-CG1 4.32Å; I54-L108 HydrophobicContact CG2-CD1 4.28Å; I54-P109 HydrophobicContact CG1-CG 4.14Å
55	Y	92	Very high	87.9	Confident	44 Å²	44	75.9 Å²	75.9	17%	0.173	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	129.3	179.5	-60.6	-84.4	0	0	0	110.2	R40 A41 M43 Q51 E53 H60	R40-Y55 WeakPolarHBondContact CD-O 3.35Å; A41-Y55 PolarHBondContact N-O 3.49Å; A41-Y55 VanDerWaalsContact N-O 3.12Å; A41-Y55 PolarHBondContact O-N 3.13Å; M43-Y55 HydrophobicContact CB-CE2 3.72Å; Q51-Y55 PolarHBondContact OE1-OH 2.85Å; E53-Y55 HydrophobicContact CB-CE2 4.39Å; E53-Y55 PolarHBondContact OE2-OH 2.89Å; E53-Y55 VanDerWaalsContact OE2-OH 3.13Å; Y55-H60 AromaticContact CD1-ND1 3.8Å
56	T	92.3	Very high	87.7	Confident	78 Å²	78	80.2 Å²	80.2	48%	0.479	41%	0.408	S	S	.	.			trans	-74.8	177	176.9	57.1	0	0	0	0	111.7	H60	T56-H60 PolarHBondContact O-CD2 2.86Å; T56-H60 PolarHBondContact O-NE2 2.96Å
57	E	90.7	Very high	87.9	Confident	105 Å²	105	74.5 Å²	74.5	49%	0.491	39%	0.388	S	S	.	.	S	Bend	trans	-57.4	145.7	168.5	60.7	-160.4	-147.3	0	0	111.8	V35 R40	V35-E57 WeakPolarHBondContact O-CA 3.43Å; R40-E57 IonicContact NH1-OE2 2.73Å
58	G	92.5	Very high	88	Confident	31 Å²	31	72.1 Å²	72.1	32%	0.32	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	129.8	-175.3	-177.9	0	0	0	0	0	114.9	T34 V35	T34-G58 CarbonylContact C-O 3.58Å; T34-G58 WeakPolarHBondContact CA-O 3.35Å; V35-G58 PolarHBondContact N-O 2.89Å; V35-G58 PolarHBondContact O-N 2.88Å
59	L	90.6	Very high	88.4	Confident	120 Å²	120	70.9 Å²	70.9	63%	0.628	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.1	122.4	176.5	-175.9	70.6	0	0	0	109.8	F32	F32-L59 HydrophobicContact CB-CD1 4.07Å; F32-L59 HydrophobicContact CD1-CD1 4.25Å; F32-L59 HydrophobicContact CD1-CD2 4.11Å; F32-L59 HydrophobicContact CD1-CG 4.17Å
60	H	89.1	Confident	88.5	Confident	39 Å²	39	70.9 Å²	70.9	18%	0.181	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	154.3	179.6	-67.1	-71.9	0	0	0	111.2	Y33 Y55 T56	Y33-H60 HydrophobicContact CD1-CB 4.1Å; Y33-H60 WeakPolarHBondContact CD1-O 3.39Å; Y33-H60 HydrophobicContact CE1-CB 3.44Å; Y33-H60 VanDerWaalsContact CE1-CB 3.44Å; Y33-H60 HydrophobicContact CE2-CB 4Å; Y33-H60 PolarHBondContact N-O 3.49Å; Y33-H60 PolarHBondContact O-N 2.79Å; Y33-H60 WeakPolarHBondContact OH-CB 3.29Å; Y55-H60 AromaticContact CD1-ND1 3.8Å; T56-H60 PolarHBondContact O-CD2 2.86Å; T56-H60 PolarHBondContact O-NE2 2.96Å
61	F	87.6	Confident	88.7	Confident	120 Å²	120	74.2 Å²	74.2	53%	0.526	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	130.9	177.7	-177.9	-93.8	0	0	0	109.9	S31 F32 I63	S31-F61 CarbonylContact O-C 3.57Å; S31-F61 WeakPolarHBondContact O-CA 3.47Å; F32-F61 HydrophobicContact CE1-CD2 4.27Å; F61-I63 HydrophobicContact CE1-CG1 4.48Å
62	R	85.3	Confident	89	Confident	39 Å²	39	72.2 Å²	72.2	15%	0.147	35%	0.35	C	S	.	.			trans	-121.5	151.8	171.3	66	175.9	-178.2	93.8	-1.4	110	Q30 S31 Y33 M43 P64 Q67	Q30-R62 PolarHBondContact O-NE 2.98Å; Q30-R62 VanDerWaalsContact O-NE 3.08Å; Q30-R62 PolarHBondContact O-NH2 3.08Å; S31-R62 VanDerWaalsContact CA-O 3.27Å; S31-R62 WeakPolarHBondContact CA-O 3.27Å; S31-R62 VanDerWaalsContact CB-O 3.29Å; S31-R62 WeakPolarHBondContact CB-O 3.29Å; S31-R62 WeakPolarHBondContact O-CG 3.47Å; S31-R62 PolarHBondContact O-N 3.18Å; Y33-R62 HydrophobicContact CD1-CB 3.87Å; Y33-R62 HydrophobicContact CD1-CG 3.87Å; Y33-R62 HydrophobicContact CE1-CB 3.89Å; Y33-R62 HydrophobicContact CE1-CG 4.41Å; M43-R62 HydrophobicContact CE-CB 4.02Å; R62-P64 VanDerWaalsContact O-CD 3.31Å; R62-P64 WeakPolarHBondContact O-CD 3.4Å; R62-Q67 HydrophobicContact CB-CB 4.35Å
63	I	86.6	Confident	89.3	Confident	81 Å²	81	67.9 Å²	67.9	42%	0.415	33%	0.327	S	S	.	.			trans	-80.2	116	168.5	-57.5	173.6	0	0	0	108.3	F61 F66 Q67	F61-I63 HydrophobicContact CE1-CG1 4.48Å; I63-F66 HydrophobicContact CG2-CB 4.29Å; I63-F66 HydrophobicContact CG2-CD2 3.95Å; I63-Q67 HydrophobicContact CB-CB 4.5Å; I63-Q67 HydrophobicContact CB-CG 4.38Å; I63-Q67 WeakPolarHBondContact O-CB 3.39Å; I63-Q67 PolarHBondContact O-N 2.76Å
64	P	80.4	Confident	89.4	Confident	11 Å²	11	63.3 Å²	63.3	7%	0.071	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	146.2	175.1	-21.6	32.5	0	0	0	110.9	G27 Q30 S31 R62 F66	G27-P64 VanDerWaalsContact O-CG 3.23Å; G27-P64 WeakPolarHBondContact O-CG 3.19Å; Q30-P64 HydrophobicContact CB-CB 4.31Å; Q30-P64 HydrophobicContact CB-CG 4.18Å; S31-P64 VanDerWaalsContact OG-CD 3.29Å; S31-P64 WeakPolarHBondContact OG-CD 3.23Å; S31-P64 VanDerWaalsContact OG-CG 3.27Å; S31-P64 WeakPolarHBondContact OG-CG 3.27Å; R62-P64 VanDerWaalsContact O-CD 3.31Å; R62-P64 WeakPolarHBondContact O-CD 3.4Å; P64-F66 PolarHBondContact O-N 3.12Å
65	W	81	Confident	89.6	Confident	166 Å²	166	67.1 Å²	67.1	63%	0.629	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	71	-36.7	-179.2	-44.5	-71.1	0	0	0	117.9	R46 Y68	R46-W65 WeakPolarHBondContact CD-O 3.45Å; R46-W65 PolarHBondContact NE-O 3.5Å; R46-W65 VanDerWaalsContact NE-O 3.11Å; W65-Y68 WeakPolarHBondContact O-CE2 3.49Å
66	F	86.3	Confident	89.7	Confident	105 Å²	105	67.8 Å²	67.8	46%	0.461	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-30.9	-178.2	-69.1	-78.4	0	0	0	113.4	S45 R46 I47 I63 P64	S45-F66 CarbonylContact C-O 3.57Å; S45-F66 WeakPolarHBondContact CA-O 3.34Å; R46-F66 PolarHBondContact N-O 3.49Å; I47-F66 HydrophobicContact CD1-CD1 3.9Å; I47-F66 HydrophobicContact CD1-CE1 4Å; I47-F66 HydrophobicContact CG1-CD1 4.33Å; I63-F66 HydrophobicContact CG2-CB 4.29Å; I63-F66 HydrophobicContact CG2-CD2 3.95Å; P64-F66 PolarHBondContact O-N 3.12Å
67	Q	88.8	Confident	89.9	Confident	30 Å²	30	70 Å²	70	14%	0.14	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	128.1	-172.3	-79.6	-178.9	-13	0	0	111.6	M43 F44 R62 I63	M43-Q67 HydrophobicContact CE-CB 4.47Å; M43-Q67 HydrophobicContact CG-CB 4.12Å; M43-Q67 HydrophobicContact CG-CG 3.98Å; M43-Q67 HydrophobicContact SD-CB 3.55Å; M43-Q67 VanDerWaalsContact SD-CB 3.55Å; M43-Q67 HydrophobicContact SD-CG 4.11Å; F44-Q67 WeakPolarHBondContact O-CA 3.32Å; R62-Q67 HydrophobicContact CB-CB 4.35Å; I63-Q67 HydrophobicContact CB-CB 4.5Å; I63-Q67 HydrophobicContact CB-CG 4.38Å; I63-Q67 WeakPolarHBondContact O-CB 3.39Å; I63-Q67 PolarHBondContact O-N 2.76Å
68	Y	90.2	Very high	90.1	Very high	99 Å²	99	69.2 Å²	69.2	39%	0.388	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	113.8	178.3	-69.6	-87.2	0	0	0	110	F44 R46 W65	F44-Y68 HydrophobicContact CD1-CD2 4.49Å; F44-Y68 PolarHBondContact N-O 2.86Å; F44-Y68 PolarHBondContact O-N 3.12Å; R46-Y68 HydrophobicContact CG-CE2 4.29Å; R46-Y68 PolarHBondContact NH2-OH 2.79Å; W65-Y68 WeakPolarHBondContact O-CE2 3.49Å
69	P	90.8	Very high	90.1	Very high	38 Å²	38	69.9 Å²	69.9	25%	0.247	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	130.8	174.7	29.9	-32.5	0	0	0	110.1	Y33 M43	Y33-P69 HydrophobicContact CD2-CB 4.02Å; Y33-P69 HydrophobicContact CD2-CG 4.09Å; Y33-P69 HydrophobicContact CE2-CB 3.78Å; Y33-P69 HydrophobicContact CE2-CG 4.34Å; Y33-P69 HydrophobicContact CG-CG 4.18Å; M43-P69 HydrophobicContact CE-CB 4.13Å; M43-P69 HydrophobicContact SD-CB 4.44Å
70	I	91.2	Very high	90.3	Very high	26 Å²	26	71 Å²	71	13%	0.133	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	114.8	170.5	-62.1	143.6	0	0	0	106.9	A41 I42 F44 Y72 Y112 T117	A41-I70 WeakPolarHBondContact CA-O 3.34Å; I42-I70 HydrophobicContact CD1-CB 4.35Å; I42-I70 HydrophobicContact CD1-CD1 4.25Å; I42-I70 HydrophobicContact CD1-CG2 4.5Å; I42-I70 HydrophobicContact CG1-CB 3.78Å; I42-I70 HydrophobicContact CG1-CD1 4.2Å; I42-I70 HydrophobicContact CG1-CG2 4.3Å; I42-I70 PolarHBondContact N-O 2.73Å; I42-I70 PolarHBondContact O-N 2.95Å; F44-I70 HydrophobicContact CB-CD1 3.79Å; I70-Y72 HydrophobicContact CG2-CD2 4.12Å; I70-Y72 HydrophobicContact CG2-CE2 3.7Å; I70-Y112 HydrophobicContact CD1-CD1 4.34Å; I70-Y112 HydrophobicContact CD1-CD2 4.02Å; I70-Y112 HydrophobicContact CD1-CE1 3.79Å; I70-Y112 HydrophobicContact CD1-CE2 3.43Å; I70-Y112 VanDerWaalsContact CD1-CE2 3.43Å; I70-Y112 HydrophobicContact CD1-CG 4.44Å; I70-Y112 WeakPolarHBondContact CD1-OH 3.26Å; I70-Y112 HydrophobicContact CG1-CE2 4.16Å; I70-Y112 HydrophobicContact CG2-CD2 4.16Å; I70-Y112 HydrophobicContact CG2-CE2 4.11Å; I70-T117 HydrophobicContact CG2-CG2 3.87Å
71	I	92.3	Very high	90.6	Very high	87 Å²	87	70 Å²	70	45%	0.446	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	121.2	-175.4	-55.9	174.3	0	0	0	108.6	H39 A41	H39-I71 HydrophobicContact CB-CG2 3.64Å; A41-I71 HydrophobicContact CB-CG1 4.32Å
72	Y	93	Very high	90.9	Very high	9 Å²	9	68.5 Å²	68.5	4%	0.035	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	139.5	171.9	-81.6	-90.8	0	0	0	110.5	H39 R40 I42 I70 L108 Y112 G116 Y119	H39-Y72 CarbonylContact C-O 3.6Å; H39-Y72 WeakPolarHBondContact CA-O 3.3Å; H39-Y72 WeakPolarHBondContact CB-O 3.46Å; R40-Y72 PolarHBondContact N-O 3.2Å; R40-Y72 PolarHBondContact O-N 2.78Å; I42-Y72 HydrophobicContact CD1-CD2 4.37Å; I42-Y72 HydrophobicContact CD1-CE2 3.67Å; I42-Y72 HydrophobicContact CG1-CD2 4.36Å; I42-Y72 HydrophobicContact CG1-CE2 4.09Å; I70-Y72 HydrophobicContact CG2-CD2 4.12Å; I70-Y72 HydrophobicContact CG2-CE2 3.7Å; Y72-L108 HydrophobicContact CD1-CD2 4.13Å; Y72-L108 HydrophobicContact CD2-CD2 4.36Å; Y72-L108 HydrophobicContact CG-CD2 3.94Å; Y72-Y112 HydrophobicContact CE2-CD2 4.26Å; Y72-Y112 WeakPolarHBondContact OH-CA 3.43Å; Y72-Y112 VanDerWaalsContact OH-CB 3.3Å; Y72-Y112 WeakPolarHBondContact OH-CB 3.33Å; Y72-Y112 VanDerWaalsContact OH-CD2 3.26Å; Y72-Y112 WeakPolarHBondContact OH-CD2 3.32Å; Y72-G116 PolarHBondContact OH-O 2.85Å; Y72-Y119 HydrophobicContact CD1-CD1 4.46Å; Y72-Y119 HydrophobicContact CD1-CE1 4.24Å; Y72-Y119 AromaticContact CE1-CD1 3.94Å; Y72-Y119 HydrophobicContact CE1-CD1 3.94Å; Y72-Y119 HydrophobicContact CE1-CE1 4.18Å
73	D	93	Very high	91.2	Very high	26 Å²	26	67 Å²	67	14%	0.139	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	125.3	164.8	-174.8	-1.3	0	0	0	108.9	R75 R77	D73-R75 WeakPolarHBondContact OD1-CB 3.17Å; D73-R75 WeakPolarHBondContact OD1-CG 3.19Å; D73-R75 PolarHBondContact OD1-N 3.45Å; D73-R77 IonicContact OD2-CZ 3.66Å; D73-R77 IonicContact OD2-NE 2.71Å; D73-R77 PolarHBondContact OD2-NE 2.76Å; D73-R77 IonicContact OD2-NH2 3.31Å; D73-R77 PolarHBondContact OD2-NH2 2.76Å
74	I	93.1	Very high	91.4	Very high	24 Å²	24	66.9 Å²	66.9	12%	0.123	32%	0.322	C	S	.	.			trans	-101.8	7.2	-180	59	155.8	0	0	0	112.6	G38 R40 P103 V105 L108	G38-I74 VanDerWaalsContact C-CG1 3.49Å; G38-I74 WeakPolarHBondContact O-CG1 3.46Å; G38-I74 PolarHBondContact O-N 3.24Å; R40-I74 HydrophobicContact CB-CG2 3.98Å; R40-I74 HydrophobicContact CG-CD1 3.89Å; R40-I74 HydrophobicContact CG-CG1 4.26Å; R40-I74 HydrophobicContact CG-CG2 3.69Å; I74-P103 HydrophobicContact CG2-CG 4.47Å; I74-V105 HydrophobicContact CB-CG2 4.26Å; I74-V105 HydrophobicContact CD1-CG2 4.18Å; I74-V105 HydrophobicContact CG2-CG2 3.97Å; I74-L108 HydrophobicContact CG2-CD1 4.36Å
75	R	94.8	Very high	92	Very high	132 Å²	132	66.5 Å²	66.5	50%	0.498	32%	0.319	S	S	.	.	S	Bend	trans	-77.5	148.8	175.7	-59.5	170.6	-172.1	-176.4	4.7	110.8	G37 D73 R77	G37-R75 PolarHBondContact O-NH2 3.19Å; D73-R75 WeakPolarHBondContact OD1-CB 3.17Å; D73-R75 WeakPolarHBondContact OD1-CG 3.19Å; D73-R75 PolarHBondContact OD1-N 3.45Å; R75-R77 PolarHBondContact O-N 2.71Å
76	S	95.1	Very high	92.6	Very high	58 Å²	58	60.5 Å²	60.5	41%	0.406	31%	0.309	S	S	.	.			trans	-66	118.7	175.3	-48.3	0	0	0	0	110.7	D171	S76-D171 VanDerWaalsContact CB-OD2 3.22Å; S76-D171 WeakPolarHBondContact CB-OD2 3.24Å; S76-D171 PolarHBondContact OG-OD2 3.19Å
77	R	94.5	Very high	92.9	Very high	123 Å²	123	55.8 Å²	55.8	46%	0.464	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	131.1	179.3	-69.4	178.1	174.9	-169.9	-4.7	110.6	D73 R75 S101	D73-R77 IonicContact OD2-CZ 3.66Å; D73-R77 IonicContact OD2-NE 2.71Å; D73-R77 PolarHBondContact OD2-NE 2.76Å; D73-R77 IonicContact OD2-NH2 3.31Å; D73-R77 PolarHBondContact OD2-NH2 2.76Å; R75-R77 PolarHBondContact O-N 2.71Å; R77-S101 PolarHBondContact N-O 3.39Å; R77-S101 PolarHBondContact O-N 3.45Å
78	P	95.4	Very high	93.1	Very high	90 Å²	90	60.5 Å²	60.5	58%	0.584	31%	0.309	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.3	134.1	174.2	29.8	-32.4	0	0	0	111.3	R98 L100	P78-R98 HydrophobicContact CB-CG 4.43Å; P78-L100 VanDerWaalsContact CA-CD2 3.49Å; P78-L100 HydrophobicContact CB-CD2 3.49Å; P78-L100 VanDerWaalsContact CB-CD2 3.49Å; P78-L100 HydrophobicContact CG-CD2 4.48Å
79	R	93.4	Very high	93.3	Very high	44 Å²	44	58.4 Å²	58.4	17%	0.166	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	131	171.5	-164.1	120.7	63	134.5	47.9	111.7	I81 R98 V99 D120 E121	R79-I81 HydrophobicContact CG-CG1 4.22Å; R79-R98 CarbonylContact O-C 3.58Å; R79-R98 VanDerWaalsContact O-CA 3.29Å; R79-R98 WeakPolarHBondContact O-CA 3.38Å; R79-V99 PolarHBondContact N-O 3.35Å; R79-V99 PolarHBondContact O-N 3.36Å; R79-D120 VanDerWaalsContact CZ-C 3.47Å; R79-D120 VanDerWaalsContact CZ-CB 3.46Å; R79-D120 IonicContact CZ-OD2 3.57Å; R79-D120 IonicContact NE-OD2 2.83Å; R79-D120 IonicContact NH1-OD1 3.05Å; R79-D120 IonicContact NH1-OD2 3.42Å; R79-D120 PolarHBondContact NH1-OD2 2.86Å; R79-D120 PolarHBondContact NH2-O 3.35Å; R79-E121 VanDerWaalsContact NH1-N 3.12Å
80	K	95	Very high	93.3	Very high	144 Å²	144	64.1 Å²	64.1	63%	0.626	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.3	124.2	173.7	-63.6	-177.7	-178.5	-177.1	0	109.1	T96 L97	K80-T96 HydrophobicContact CB-CG2 4.39Å; K80-L97 CarbonylContact C-O 3.58Å; K80-L97 WeakPolarHBondContact CA-O 3.25Å
81	I	94.2	Very high	93.2	Very high	17 Å²	17	65.9 Å²	65.9	9%	0.087	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	120.9	175.9	-63.4	165.5	0	0	0	107	R79 L97 V128	R79-I81 HydrophobicContact CG-CG1 4.22Å; I81-L97 PolarHBondContact N-O 3Å; I81-L97 PolarHBondContact O-N 2.89Å; I81-V128 HydrophobicContact CB-CG1 4.16Å; I81-V128 HydrophobicContact CD1-CB 3.82Å; I81-V128 HydrophobicContact CD1-CG1 3.96Å; I81-V128 HydrophobicContact CD1-CG2 3.77Å; I81-V128 HydrophobicContact CG2-CG1 4.04Å
82	T	93.9	Very high	93.2	Very high	90 Å²	90	65.8 Å²	65.8	55%	0.552	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.5	131.1	176.5	-57.6	0	0	0	0	109.2	L95 T96	T82-L95 WeakPolarHBondContact CA-O 3.16Å; T82-T96 WeakPolarHBondContact CG2-OG1 3.43Å; T82-T96 WeakPolarHBondContact OG1-CG2 3.32Å; T82-T96 PolarHBondContact OG1-OG1 2.74Å
83	S	91.5	Very high	93.2	Very high	7 Å²	7	65.4 Å²	65.4	5%	0.049	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	129.3	-178.4	-161.9	0	0	0	0	111.4	T85 L95 N129	S83-T85 PolarHBondContact O-N 3.05Å; S83-L95 PolarHBondContact N-O 3.08Å; S83-L95 PolarHBondContact O-N 2.78Å; S83-L95 VanDerWaalsContact O-N 3.13Å; S83-N129 WeakPolarHBondContact CB-OD1 3.02Å; S83-N129 PolarHBondContact OG-OD1 3.45Å
84	P	92.5	Very high	93.2	Very high	78 Å²	78	67.5 Å²	67.5	51%	0.506	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	125.5	167.2	29.5	-31.9	0	0	0	109.1	T92 N94	P84-T92 HydrophobicContact CB-CG2 4.29Å; P84-N94 WeakPolarHBondContact CB-OD1 3.37Å
85	T	92.5	Very high	93.3	Very high	4 Å²	4	66.4 Å²	66.4	3%	0.025	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	139.8	-177.4	-69.3	0	0	0	0	111.6	S83 V93 L132 K133 V136	S83-T85 PolarHBondContact O-N 3.05Å; T85-V93 PolarHBondContact N-O 3.43Å; T85-V93 PolarHBondContact O-N 3.4Å; T85-L132 HydrophobicContact CG2-CD2 3.95Å; T85-L132 WeakPolarHBondContact OG1-CD2 3.39Å; T85-K133 HydrophobicContact CG2-CB 4.37Å; T85-K133 HydrophobicContact CG2-CG 4Å; T85-V136 HydrophobicContact CG2-CB 3.62Å; T85-V136 HydrophobicContact CG2-CG1 3.68Å; T85-V136 HydrophobicContact CG2-CG2 4.3Å
86	G	92.8	Very high	93.3	Very high	40 Å²	40	60.9 Å²	60.9	41%	0.412	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	131.2	174.6	0	0	0	0	0	111.8	Q91	G86-Q91 WeakPolarHBondContact CA-O 3.49Å
87	S	92.9	Very high	93.3	Very high	5 Å²	5	58.1 Å²	58.1	4%	0.035	31%	0.309	C	S	.	.			trans	-82	172.3	168.1	60.1	0	0	0	0	111.6	D89 L90 Q91	S87-D89 VanDerWaalsContact CB-OD1 3.23Å; S87-D89 WeakPolarHBondContact CB-OD1 3.4Å; S87-D89 PolarHBondContact O-N 2.87Å; S87-D89 PolarHBondContact OG-OD1 2.68Å; S87-L90 PolarHBondContact O-N 2.89Å; S87-Q91 PolarHBondContact N-O 3.35Å; S87-Q91 WeakPolarHBondContact OG-CB 3.4Å; S87-Q91 PolarHBondContact OG-N 2.95Å; S87-Q91 PolarHBondContact OG-O 3.39Å; S87-Q91 VanDerWaalsContact OG-O 3.12Å
88	K	93.9	Very high	93.3	Very high	130 Å²	130	56.8 Å²	56.8	57%	0.565	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-32	178	-179.2	175.4	176.2	179.6	0	113.7	L90 A137 K138 F139 N140	K88-L90 PolarHBondContact O-N 3.38Å; K88-A137 WeakPolarHBondContact CA-O 2.94Å; K88-A137 WeakPolarHBondContact CB-O 3.43Å; K88-K138 WeakPolarHBondContact CD-O 3.49Å; K88-F139 VanDerWaalsContact CB-O 3.28Å; K88-F139 WeakPolarHBondContact CB-O 3.49Å; K88-F139 PolarHBondContact N-O 3.32Å; K88-N140 WeakPolarHBondContact CB-OD1 3.04Å
89	D	92.8	Very high	93.4	Very high	55 Å²	55	52.6 Å²	52.6	29%	0.294	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	17.1	177.3	59.1	-37.8	0	0	0	113.6	S87 Q91 A141	S87-D89 VanDerWaalsContact CB-OD1 3.23Å; S87-D89 WeakPolarHBondContact CB-OD1 3.4Å; S87-D89 PolarHBondContact O-N 2.87Å; S87-D89 PolarHBondContact OG-OD1 2.68Å; D89-Q91 PolarHBondContact O-N 2.95Å; D89-Q91 WeakPolarHBondContact OD2-CG 3.24Å; D89-A141 PolarHBondContact OD1-N 3.38Å; D89-A141 VanDerWaalsContact OD1-N 3.08Å
90	L	90.8	Very high	93.5	Very high	158 Å²	158	52.5 Å²	52.5	83%	0.827	28%	0.279	S	S	*	.	S	Bend	trans	60.7	26	178.9	-53.7	174.3	0	0	0	113.5	S87 K88	S87-L90 PolarHBondContact O-N 2.89Å; K88-L90 PolarHBondContact O-N 3.38Å
91	Q	90.6	Very high	93.5	Very high	62 Å²	62	45.8 Å²	45.8	29%	0.29	25%	0.25	S	S	.	.			trans	-89.9	137.4	171.8	-63.1	-61	-38.2	0	0	110.1	G86 S87 D89 V93 Y184	G86-Q91 WeakPolarHBondContact CA-O 3.49Å; S87-Q91 PolarHBondContact N-O 3.35Å; S87-Q91 WeakPolarHBondContact OG-CB 3.4Å; S87-Q91 PolarHBondContact OG-N 2.95Å; S87-Q91 PolarHBondContact OG-O 3.39Å; S87-Q91 VanDerWaalsContact OG-O 3.12Å; D89-Q91 PolarHBondContact O-N 2.95Å; D89-Q91 WeakPolarHBondContact OD2-CG 3.24Å; Q91-V93 PolarHBondContact O-N 2.73Å; Q91-Y184 HydrophobicContact CG-CD2 4.06Å; Q91-Y184 HydrophobicContact CG-CE2 4.15Å
92	T	91.7	Very high	93.5	Very high	85 Å²	85	48.6 Å²	48.6	52%	0.521	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	120.7	172.2	-58.4	0	0	0	0	109.1	P84	P84-T92 HydrophobicContact CB-CG2 4.29Å
93	V	92.5	Very high	93.6	Very high	1 Å²	1	44.3 Å²	44.3	1%	0.006	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	124.2	178	-173.2	0	0	0	0	108.6	T85 Q91 L95 L144 L178 F180	T85-V93 PolarHBondContact N-O 3.43Å; T85-V93 PolarHBondContact O-N 3.4Å; Q91-V93 PolarHBondContact O-N 2.73Å; V93-L95 PolarHBondContact O-N 3.39Å; V93-L144 HydrophobicContact CG1-CD1 4.37Å; V93-L144 HydrophobicContact CG2-CD1 4.09Å; V93-L178 HydrophobicContact CG1-CD1 4.27Å; V93-L178 HydrophobicContact CG1-CD2 3.77Å; V93-L178 HydrophobicContact CG1-CG 3.75Å; V93-F180 HydrophobicContact CG1-CD1 4.3Å; V93-F180 HydrophobicContact CG1-CE1 4.16Å; V93-F180 HydrophobicContact CG2-CD1 3.82Å; V93-F180 HydrophobicContact CG2-CE1 3.77Å
94	N	93.6	Very high	93.7	Very high	70 Å²	70	47.1 Å²	47.1	37%	0.374	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	103.4	171.5	-72.9	-34.8	0	0	0	108.1	P84 T179	P84-N94 WeakPolarHBondContact CB-OD1 3.37Å; N94-T179 WeakPolarHBondContact CB-OG1 3.41Å; N94-T179 PolarHBondContact N-O 3.45Å; N94-T179 PolarHBondContact O-N 3.02Å; N94-T179 PolarHBondContact O-OG1 2.97Å
95	L	94	Very high	93.7	Very high	1 Å²	1	45.4 Å²	45.4	1%	0.005	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	127.9	-176	-163.4	71	0	0	0	110	T82 S83 V93 L132 V136 I175 L178	T82-L95 WeakPolarHBondContact CA-O 3.16Å; S83-L95 PolarHBondContact N-O 3.08Å; S83-L95 PolarHBondContact O-N 2.78Å; S83-L95 VanDerWaalsContact O-N 3.13Å; V93-L95 PolarHBondContact O-N 3.39Å; L95-L132 HydrophobicContact CB-CD1 4.36Å; L95-L132 HydrophobicContact CB-CD2 4.3Å; L95-L132 HydrophobicContact CD2-CD1 3.56Å; L95-L132 HydrophobicContact CD2-CD2 4.02Å; L95-L132 HydrophobicContact CD2-CG 3.75Å; L95-L132 HydrophobicContact CG-CD1 4.22Å; L95-V136 HydrophobicContact CD2-CG2 3.96Å; L95-I175 HydrophobicContact CD1-CB 4.48Å; L95-I175 HydrophobicContact CD1-CD1 4.3Å; L95-I175 HydrophobicContact CD1-CG1 4.33Å; L95-I175 HydrophobicContact CD1-CG2 3.34Å; L95-I175 HydrophobicContact CD2-CD1 4.34Å; L95-I175 HydrophobicContact CD2-CG1 4.27Å; L95-I175 HydrophobicContact CG-CG2 4.03Å; L95-L178 HydrophobicContact CD1-CB 3.99Å; L95-L178 HydrophobicContact CD1-CD1 3.63Å; L95-L178 HydrophobicContact CD1-CG 3.75Å
96	T	95	Very high	93.8	Very high	16 Å²	16	48.4 Å²	48.4	10%	0.098	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	115.5	170.4	-58.2	0	0	0	0	109.2	K80 T82 T176 D177	K80-T96 HydrophobicContact CB-CG2 4.39Å; T82-T96 WeakPolarHBondContact CG2-OG1 3.43Å; T82-T96 WeakPolarHBondContact OG1-CG2 3.32Å; T82-T96 PolarHBondContact OG1-OG1 2.74Å; T96-T176 PolarHBondContact O-N 2.98Å; T96-D177 PolarHBondContact N-O 3.03Å; T96-D177 PolarHBondContact O-N 3.03Å
97	L	95.4	Very high	93.8	Very high	0 Å²	0	50 Å²	50	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	132.7	178.1	-166.3	70.7	0	0	0	110	K80 I81 V99 V128 L132 I155 V173 I175	K80-L97 CarbonylContact C-O 3.58Å; K80-L97 WeakPolarHBondContact CA-O 3.25Å; I81-L97 PolarHBondContact N-O 3Å; I81-L97 PolarHBondContact O-N 2.89Å; L97-V99 HydrophobicContact CD2-CG2 3.65Å; L97-V99 HydrophobicContact CG-CG2 4Å; L97-V128 HydrophobicContact CD2-CG1 3.64Å; L97-L132 HydrophobicContact CB-CD1 4Å; L97-L132 HydrophobicContact CD2-CD1 4.25Å; L97-I155 HydrophobicContact CD1-CD1 4.49Å; L97-I155 HydrophobicContact CD2-CG2 4.01Å; L97-V173 HydrophobicContact CD1-CG1 3.4Å; L97-V173 VanDerWaalsContact CD1-CG1 3.4Å; L97-V173 HydrophobicContact CD2-CG1 3.62Å; L97-V173 HydrophobicContact CG-CG1 3.71Å; L97-I175 HydrophobicContact CD1-CG1 3.9Å
98	R	95.8	Very high	93.8	Very high	96 Å²	96	49.8 Å²	49.8	36%	0.362	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	121.8	166.5	179.5	-176	71.7	160.6	5.8	108.7	P78 R79 V173 S174 T176	P78-R98 HydrophobicContact CB-CG 4.43Å; R79-R98 CarbonylContact O-C 3.58Å; R79-R98 VanDerWaalsContact O-CA 3.29Å; R79-R98 WeakPolarHBondContact O-CA 3.38Å; R98-V173 WeakPolarHBondContact O-CA 3.4Å; R98-S174 PolarHBondContact N-O 3.36Å; R98-S174 PolarHBondContact NE-OG 3.15Å; R98-S174 VanDerWaalsContact NE-OG 3.13Å; R98-S174 PolarHBondContact NH2-OG 3.28Å; R98-S174 PolarHBondContact O-N 3.15Å; R98-T176 WeakPolarHBondContact CB-OG1 3.2Å
99	V	96.1	Very high	93.7	Very high	1 Å²	1	43.8 Å²	43.8	1%	0.006	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	125.5	177.3	-177.7	0	0	0	0	108.2	R79 L97 V128 L159 V170 V173	R79-V99 PolarHBondContact N-O 3.35Å; R79-V99 PolarHBondContact O-N 3.36Å; L97-V99 HydrophobicContact CD2-CG2 3.65Å; L97-V99 HydrophobicContact CG-CG2 4Å; V99-V128 HydrophobicContact CG2-CG2 4.01Å; V99-L159 HydrophobicContact CG1-CD2 3.89Å; V99-L159 HydrophobicContact CG2-CD2 3.95Å; V99-V170 HydrophobicContact CG1-CG1 4.03Å; V99-V173 HydrophobicContact CG1-CG2 4.36Å; V99-V173 HydrophobicContact CG2-CG2 4.46Å
100	L	96.1	Very high	93.8	Very high	42 Å²	42	44.7 Å²	44.7	22%	0.22	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	118	167	-59.3	-171.7	0	0	0	107.7	P78 D171 D172	P78-L100 VanDerWaalsContact CA-CD2 3.49Å; P78-L100 HydrophobicContact CB-CD2 3.49Å; P78-L100 VanDerWaalsContact CB-CD2 3.49Å; P78-L100 HydrophobicContact CG-CD2 4.48Å; L100-D171 HydrophobicContact CB-CB 4.31Å; L100-D171 PolarHBondContact O-N 3.2Å; L100-D172 HydrophobicContact CB-CB 4.32Å; L100-D172 HydrophobicContact CD1-CB 3.97Å; L100-D172 HydrophobicContact CG-CB 4.2Å; L100-D172 PolarHBondContact N-O 3.24Å
101	S	95.1	Very high	93.9	Very high	3 Å²	3	37.1 Å²	37.1	2%	0.021	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	151.1	-179	57.6	0	0	0	0	111.9	R77 L124 I169	R77-S101 PolarHBondContact N-O 3.39Å; R77-S101 PolarHBondContact O-N 3.45Å; S101-L124 WeakPolarHBondContact OG-CD1 3.47Å; S101-I169 CarbonylContact C-O 3.53Å; S101-I169 VanDerWaalsContact CA-O 3.26Å; S101-I169 WeakPolarHBondContact CA-O 3.36Å
102	R	94.9	Very high	94	Very high	77 Å²	77	37.3 Å²	37.3	29%	0.291	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	154.2	173.1	63.2	-172.7	177.3	114.4	2.3	109.9	I169 D171	R102-I169 HydrophobicContact CG-CB 3.95Å; R102-I169 HydrophobicContact CG-CG2 4.34Å; R102-I169 PolarHBondContact N-O 3.32Å; R102-I169 PolarHBondContact O-N 3.1Å; R102-D171 WeakPolarHBondContact CD-OD2 3.44Å; R102-D171 IonicContact CZ-OD1 3.74Å; R102-D171 IonicContact NE-OD1 3.82Å; R102-D171 PolarHBondContact NE-OD1 3.37Å; R102-D171 VanDerWaalsContact NE-OD1 3.11Å; R102-D171 IonicContact NE-OD2 3.65Å; R102-D171 IonicContact NH2-OD1 3.45Å
103	P	95.3	Very high	94	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	149.1	178.1	31.4	-27.1	0	0	0	110.2	I74 V105 L108 I111 Y119	I74-P103 HydrophobicContact CG2-CG 4.47Å; P103-V105 PolarHBondContact O-N 3.03Å; P103-L108 HydrophobicContact CB-CD2 3.78Å; P103-L108 HydrophobicContact CG-CD2 3.92Å; P103-I111 HydrophobicContact CB-CD1 3.93Å; P103-Y119 HydrophobicContact CB-CE1 4.31Å; P103-Y119 HydrophobicContact CB-CE2 4.09Å; P103-Y119 VanDerWaalsContact CD-OH 3.25Å; P103-Y119 WeakPolarHBondContact CD-OH 3.38Å; P103-Y119 HydrophobicContact CG-CE1 4.34Å
104	E	94.4	Very high	94	Very high	66 Å²	66	43.3 Å²	43.3	31%	0.308	21%	0.208	S	C	.	.			trans	-71.3	122.8	171.7	-170.3	-177.9	-168.1	0	0	110.3	S106 Q107 L108 H167 I169	E104-S106 VanDerWaalsContact C-N 3.35Å; E104-S106 VanDerWaalsContact CD-OG 3.26Å; E104-S106 WeakPolarHBondContact CG-OG 3.37Å; E104-S106 PolarHBondContact O-N 2.95Å; E104-S106 PolarHBondContact OE1-OG 3.26Å; E104-S106 VanDerWaalsContact OE1-OG 3.1Å; E104-Q107 PolarHBondContact O-N 3.28Å; E104-L108 PolarHBondContact O-N 2.84Å; E104-H167 HydrophobicContact CB-CB 4.21Å; E104-H167 WeakPolarHBondContact CB-O 3.42Å; E104-H167 PolarHBondContact N-O 3.15Å; E104-H167 IonicContact OE2-CD2 2.7Å; E104-I169 HydrophobicContact CB-CD1 4.19Å; E104-I169 HydrophobicContact CB-CG1 4.18Å; E104-I169 HydrophobicContact CG-CD1 4.2Å
105	V	92.5	Very high	93.9	Very high	42 Å²	42	40.6 Å²	40.6	26%	0.255	19%	0.193	S	C	.	.	G	3₁₀ helix	trans	-62.8	-40.4	-172.3	-179.8	0	0	0	0	112.3	R40 I54 I74 P103 Q107 L108	R40-V105 HydrophobicContact CG-CG1 3.94Å; I54-V105 WeakPolarHBondContact CD1-O 3.48Å; I54-V105 HydrophobicContact CG2-CG1 4.32Å; I74-V105 HydrophobicContact CB-CG2 4.26Å; I74-V105 HydrophobicContact CD1-CG2 4.18Å; I74-V105 HydrophobicContact CG2-CG2 3.97Å; P103-V105 PolarHBondContact O-N 3.03Å; V105-Q107 PolarHBondContact O-N 3.28Å; V105-L108 HydrophobicContact CG1-CD1 4.49Å; V105-L108 WeakPolarHBondContact O-CG 3.37Å
106	S	92.9	Very high	93.7	Very high	67 Å²	67	41.2 Å²	41.2	47%	0.469	20%	0.2	S	C	.	.	G	3₁₀ helix	trans	-64.9	-23.6	-178	50.9	0	0	0	0	113.5	E104	E104-S106 VanDerWaalsContact C-N 3.35Å; E104-S106 VanDerWaalsContact CD-OG 3.26Å; E104-S106 WeakPolarHBondContact CG-OG 3.37Å; E104-S106 PolarHBondContact O-N 2.95Å; E104-S106 PolarHBondContact OE1-OG 3.26Å; E104-S106 VanDerWaalsContact OE1-OG 3.1Å
107	Q	93.3	Very high	93.4	Very high	73 Å²	73	44.6 Å²	44.6	34%	0.341	22%	0.22	S	C	.	.	G	3₁₀ helix	trans	-116.6	14.6	-171.7	-64.2	-66.3	-11.9	0	0	113.2	E104 V105 P109 H110 I111 H167	E104-Q107 PolarHBondContact O-N 3.28Å; V105-Q107 PolarHBondContact O-N 3.28Å; Q107-P109 VanDerWaalsContact C-CD 3.42Å; Q107-P109 VanDerWaalsContact C-N 3.32Å; Q107-H110 HydrophobicContact CB-CB 4.5Å; Q107-H110 WeakPolarHBondContact O-CA 3.49Å; Q107-H110 WeakPolarHBondContact O-CB 3.36Å; Q107-H110 PolarHBondContact O-N 3.46Å; Q107-I111 WeakPolarHBondContact O-CG1 3.47Å; Q107-I111 PolarHBondContact O-N 2.93Å; Q107-H167 HydrophobicContact CB-CB 3.82Å; Q107-H167 HydrophobicContact CG-CB 4.42Å
108	L	93.1	Very high	93.2	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-50.8	-41.8	175.4	-69.7	173.8	0	0	0	114	R40 I42 I54 Y72 I74 P103 E104 V105 H110 I111 Y112	R40-L108 HydrophobicContact CB-CD1 3.56Å; R40-L108 HydrophobicContact CG-CD1 4.32Å; I42-L108 HydrophobicContact CG2-CB 3.75Å; I54-L108 HydrophobicContact CG2-CD1 4.28Å; Y72-L108 HydrophobicContact CD1-CD2 4.13Å; Y72-L108 HydrophobicContact CD2-CD2 4.36Å; Y72-L108 HydrophobicContact CG-CD2 3.94Å; I74-L108 HydrophobicContact CG2-CD1 4.36Å; P103-L108 HydrophobicContact CB-CD2 3.78Å; P103-L108 HydrophobicContact CG-CD2 3.92Å; E104-L108 PolarHBondContact O-N 2.84Å; V105-L108 HydrophobicContact CG1-CD1 4.49Å; V105-L108 WeakPolarHBondContact O-CG 3.37Å; L108-H110 VanDerWaalsContact C-N 3.29Å; L108-H110 PolarHBondContact O-N 2.64Å; L108-I111 HydrophobicContact CD2-CD1 4.44Å; L108-I111 PolarHBondContact O-N 3.24Å; L108-Y112 PolarHBondContact O-N 3.37Å
109	P	92.7	Very high	92.9	Very high	5 Å²	5	43.2 Å²	43.2	3%	0.032	22%	0.219	C	C	.	.	H	α-helix	trans	-61.1	-37.3	175.4	-24.4	35.4	0	0	0	113	I42 V50 I54 Q107 R113	I42-P109 HydrophobicContact CG2-CG 4.15Å; V50-P109 HydrophobicContact CG1-CB 4.17Å; I54-P109 HydrophobicContact CG1-CG 4.14Å; Q107-P109 VanDerWaalsContact C-CD 3.42Å; Q107-P109 VanDerWaalsContact C-N 3.32Å; P109-R113 WeakPolarHBondContact O-CG 3.39Å; P109-R113 PolarHBondContact O-N 2.91Å
110	H	93.3	Very high	92.5	Very high	73 Å²	73	44.8 Å²	44.8	34%	0.338	23%	0.228	S	C	.	.	H	α-helix	trans	-71.1	-44.1	177.7	-175.9	-88.9	0	0	0	111.4	Q107 L108 Y112 R113 T114 H167	Q107-H110 HydrophobicContact CB-CB 4.5Å; Q107-H110 WeakPolarHBondContact O-CA 3.49Å; Q107-H110 WeakPolarHBondContact O-CB 3.36Å; Q107-H110 PolarHBondContact O-N 3.46Å; L108-H110 VanDerWaalsContact C-N 3.29Å; L108-H110 PolarHBondContact O-N 2.64Å; H110-Y112 VanDerWaalsContact C-N 3.33Å; H110-Y112 PolarHBondContact O-N 2.53Å; H110-R113 PolarHBondContact O-N 2.85Å; H110-T114 PolarHBondContact O-N 3.2Å; H110-T114 PolarHBondContact O-OG1 3.41Å; H110-H167 AromaticContact CE1-CE1 3.71Å; H110-H167 AromaticContact CE1-ND1 3.96Å; H110-H167 AromaticContact ND1-CE1 3.51Å; H110-H167 AromaticContact ND1-ND1 3.46Å; H110-H167 PolarHBondContact ND1-ND1 3.18Å
111	I	93.9	Very high	92.3	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-57.2	-45.9	175.1	-65.2	168.3	0	0	0	110.4	P103 Q107 L108 R113 T114 L115 G116 Y119 H167	P103-I111 HydrophobicContact CB-CD1 3.93Å; Q107-I111 WeakPolarHBondContact O-CG1 3.47Å; Q107-I111 PolarHBondContact O-N 2.93Å; L108-I111 HydrophobicContact CD2-CD1 4.44Å; L108-I111 PolarHBondContact O-N 3.24Å; I111-R113 PolarHBondContact O-N 2.86Å; I111-T114 PolarHBondContact O-N 3.16Å; I111-L115 HydrophobicContact CG2-CB 4.43Å; I111-L115 HydrophobicContact CG2-CD1 4.43Å; I111-L115 WeakPolarHBondContact O-CA 3.22Å; I111-L115 WeakPolarHBondContact O-CB 3.26Å; I111-L115 PolarHBondContact O-N 3.32Å; I111-G116 PolarHBondContact O-N 3.02Å; I111-G116 VanDerWaalsContact O-N 3.08Å; I111-Y119 HydrophobicContact CG2-CD1 4.29Å; I111-Y119 HydrophobicContact CG2-CD2 4.46Å; I111-Y119 HydrophobicContact CG2-CG 3.87Å; I111-H167 HydrophobicContact CD1-CB 4.03Å; I111-H167 WeakPolarHBondContact CD1-O 3.43Å; I111-H167 HydrophobicContact CG1-CB 4.04Å
112	Y	93	Very high	92	Very high	65 Å²	65	55.6 Å²	55.6	26%	0.255	27%	0.271	S	S	.	.	H	α-helix	trans	-64.1	-40.2	178.5	-179	-96.1	0	0	0	112.8	I42 V50 I70 Y72 L108 H110 G116 T117	I42-Y112 HydrophobicContact CD1-CD1 4.02Å; I42-Y112 HydrophobicContact CD1-CD2 4Å; I42-Y112 HydrophobicContact CD1-CG 3.51Å; V50-Y112 HydrophobicContact CB-CD1 4.45Å; V50-Y112 HydrophobicContact CG1-CD1 4.18Å; V50-Y112 HydrophobicContact CG2-CD1 3.42Å; V50-Y112 VanDerWaalsContact CG2-CD1 3.42Å; V50-Y112 HydrophobicContact CG2-CE1 3.51Å; I70-Y112 HydrophobicContact CD1-CD1 4.34Å; I70-Y112 HydrophobicContact CD1-CD2 4.02Å; I70-Y112 HydrophobicContact CD1-CE1 3.79Å; I70-Y112 HydrophobicContact CD1-CE2 3.43Å; I70-Y112 VanDerWaalsContact CD1-CE2 3.43Å; I70-Y112 HydrophobicContact CD1-CG 4.44Å; I70-Y112 WeakPolarHBondContact CD1-OH 3.26Å; I70-Y112 HydrophobicContact CG1-CE2 4.16Å; I70-Y112 HydrophobicContact CG2-CD2 4.16Å; I70-Y112 HydrophobicContact CG2-CE2 4.11Å; Y72-Y112 HydrophobicContact CE2-CD2 4.26Å; Y72-Y112 WeakPolarHBondContact OH-CA 3.43Å; Y72-Y112 VanDerWaalsContact OH-CB 3.3Å; Y72-Y112 WeakPolarHBondContact OH-CB 3.33Å; Y72-Y112 VanDerWaalsContact OH-CD2 3.26Å; Y72-Y112 WeakPolarHBondContact OH-CD2 3.32Å; L108-Y112 PolarHBondContact O-N 3.37Å; H110-Y112 VanDerWaalsContact C-N 3.33Å; H110-Y112 PolarHBondContact O-N 2.53Å; Y112-G116 WeakPolarHBondContact O-CA 3.05Å; Y112-G116 PolarHBondContact O-N 3.11Å; Y112-T117 HydrophobicContact CD2-CG2 4.06Å; Y112-T117 HydrophobicContact CE2-CG2 3.89Å
113	R	91.4	Very high	91.9	Very high	134 Å²	134	52.5 Å²	52.5	51%	0.506	26%	0.261	S	S	.	.	H	α-helix	trans	-67.1	-36.6	178.4	-73.3	178.2	-168.1	146	6.9	113.1	V50 N52 P109 H110 I111	V50-R113 HydrophobicContact CB-CG 4.27Å; V50-R113 HydrophobicContact CG2-CG 4.14Å; V50-R113 PolarHBondContact O-NH2 3.04Å; N52-R113 PolarHBondContact OD1-NH1 2.85Å; N52-R113 PolarHBondContact OD1-NH2 3.11Å; P109-R113 WeakPolarHBondContact O-CG 3.39Å; P109-R113 PolarHBondContact O-N 2.91Å; H110-R113 PolarHBondContact O-N 2.85Å; I111-R113 PolarHBondContact O-N 2.86Å
114	T	91.8	Very high	91.7	Very high	78 Å²	78	52.6 Å²	52.6	48%	0.479	26%	0.261	S	S	.	.	H	α-helix	trans	-94.9	-42.4	-172.7	50.6	0	0	0	0	113.2	H110 I111	H110-T114 PolarHBondContact O-N 3.2Å; H110-T114 PolarHBondContact O-OG1 3.41Å; I111-T114 PolarHBondContact O-N 3.16Å
115	L	91.4	Very high	91.7	Very high	13 Å²	13	51.6 Å²	51.6	7%	0.068	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.5	-29.5	-172.6	-56.9	-176.7	0	0	0	113	I111 R122 V123 F166	I111-L115 HydrophobicContact CG2-CB 4.43Å; I111-L115 HydrophobicContact CG2-CD1 4.43Å; I111-L115 WeakPolarHBondContact O-CA 3.22Å; I111-L115 WeakPolarHBondContact O-CB 3.26Å; I111-L115 PolarHBondContact O-N 3.32Å; L115-R122 PolarHBondContact O-NH1 3.49Å; L115-V123 HydrophobicContact CD1-CG1 3.97Å; L115-V123 HydrophobicContact CD1-CG2 4.09Å; L115-V123 HydrophobicContact CD2-CG1 3.41Å; L115-V123 VanDerWaalsContact CD2-CG1 3.41Å; L115-V123 HydrophobicContact CG-CG1 4.32Å; L115-F166 HydrophobicContact CD1-CB 4.3Å; L115-F166 HydrophobicContact CD1-CD1 4.42Å; L115-F166 HydrophobicContact CD2-CD1 4.35Å
116	G	90.9	Very high	91.7	Very high	14 Å²	14	53.2 Å²	53.2	14%	0.144	27%	0.273	C	S	.	.			trans	90.4	-164.2	-175.6	0	0	0	0	0	113.3	Y72 I111 Y112	Y72-G116 PolarHBondContact OH-O 2.85Å; I111-G116 PolarHBondContact O-N 3.02Å; I111-G116 VanDerWaalsContact O-N 3.08Å; Y112-G116 WeakPolarHBondContact O-CA 3.05Å; Y112-G116 PolarHBondContact O-N 3.11Å
117	T	88.1	Confident	91.8	Very high	87 Å²	87	50.4 Å²	50.4	53%	0.534	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74	-31.1	175.3	51.1	0	0	0	0	112.1	I70 Y112 Y119	I70-T117 HydrophobicContact CG2-CG2 3.87Å; Y112-T117 HydrophobicContact CD2-CG2 4.06Å; Y112-T117 HydrophobicContact CE2-CG2 3.89Å; T117-Y119 PolarHBondContact O-N 3.28Å
118	D	90.6	Very high	92	Very high	53 Å²	53	47 Å²	47	28%	0.283	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.6	36.6	177	62.8	-43	0	0	0	112.1	D120 E121 R122	D118-D120 PolarHBondContact O-N 3.2Å; D118-E121 PolarHBondContact O-N 2.82Å; D118-R122 WeakPolarHBondContact O-CB 3.37Å; D118-R122 PolarHBondContact O-N 2.84Å; D118-R122 VanDerWaalsContact O-N 3.15Å; D118-R122 IonicContact OD1-CZ 3.37Å; D118-R122 IonicContact OD1-NH1 3.64Å; D118-R122 IonicContact OD1-NH2 3.33Å; D118-R122 PolarHBondContact OD1-NH2 3.39Å; D118-R122 IonicContact OD2-CZ 3.56Å; D118-R122 VanDerWaalsContact OD2-CZ 3.31Å; D118-R122 IonicContact OD2-NE 3.11Å; D118-R122 IonicContact OD2-NH2 3.61Å; D118-R122 PolarHBondContact OD2-NH2 3.03Å
119	Y	90.2	Very high	92	Very high	14 Å²	14	49.1 Å²	49.1	6%	0.055	25%	0.249	C	C	.	.	H	α-helix	trans	-58.4	-38.3	-176	71.9	-85.9	0	0	0	111.4	Y72 P103 I111 T117 V123 I168	Y72-Y119 HydrophobicContact CD1-CD1 4.46Å; Y72-Y119 HydrophobicContact CD1-CE1 4.24Å; Y72-Y119 AromaticContact CE1-CD1 3.94Å; Y72-Y119 HydrophobicContact CE1-CD1 3.94Å; Y72-Y119 HydrophobicContact CE1-CE1 4.18Å; P103-Y119 HydrophobicContact CB-CE1 4.31Å; P103-Y119 HydrophobicContact CB-CE2 4.09Å; P103-Y119 VanDerWaalsContact CD-OH 3.25Å; P103-Y119 WeakPolarHBondContact CD-OH 3.38Å; P103-Y119 HydrophobicContact CG-CE1 4.34Å; I111-Y119 HydrophobicContact CG2-CD1 4.29Å; I111-Y119 HydrophobicContact CG2-CD2 4.46Å; I111-Y119 HydrophobicContact CG2-CG 3.87Å; T117-Y119 PolarHBondContact O-N 3.28Å; Y119-V123 WeakPolarHBondContact O-CG2 3.29Å; Y119-V123 PolarHBondContact O-N 3.34Å; Y119-I168 HydrophobicContact CD2-CD1 3.85Å; Y119-I168 HydrophobicContact CD2-CG1 4.06Å; Y119-I168 HydrophobicContact CE2-CD1 4.36Å; Y119-I168 HydrophobicContact CE2-CG1 4.33Å
120	D	88.3	Confident	92.1	Very high	35 Å²	35	53.4 Å²	53.4	19%	0.187	27%	0.268	C	S	.	.	H	α-helix	trans	-65.3	-56.1	-178.1	66.7	-26.9	0	0	0	109.5	R79 D118 R122 L124	R79-D120 VanDerWaalsContact CZ-C 3.47Å; R79-D120 VanDerWaalsContact CZ-CB 3.46Å; R79-D120 IonicContact CZ-OD2 3.57Å; R79-D120 IonicContact NE-OD2 2.83Å; R79-D120 IonicContact NH1-OD1 3.05Å; R79-D120 IonicContact NH1-OD2 3.42Å; R79-D120 PolarHBondContact NH1-OD2 2.86Å; R79-D120 PolarHBondContact NH2-O 3.35Å; D118-D120 PolarHBondContact O-N 3.2Å; D120-R122 VanDerWaalsContact C-N 3.27Å; D120-R122 PolarHBondContact O-N 3.05Å; D120-L124 HydrophobicContact CB-CD1 3.97Å; D120-L124 WeakPolarHBondContact O-CB 3.37Å; D120-L124 PolarHBondContact O-N 3.49Å
121	E	90.5	Very high	92.2	Very high	137 Å²	137	50.2 Å²	50.2	64%	0.64	25%	0.254	S	S	*	.	H	α-helix	trans	-59.4	-33.6	-179.2	-68.1	-166.7	167.3	0	0	113.9	R79 D118 P125	R79-E121 VanDerWaalsContact NH1-N 3.12Å; D118-E121 PolarHBondContact O-N 2.82Å; E121-P125 VanDerWaalsContact O-CD 3.24Å; E121-P125 WeakPolarHBondContact O-CD 3.13Å; E121-P125 WeakPolarHBondContact O-CG 3.36Å
122	R	89.9	Confident	92.3	Very high	135 Å²	135	50.2 Å²	50.2	51%	0.509	25%	0.254	S	S	.	.	H	α-helix	trans	-74.3	-41.7	-174.8	-171.2	163.4	-69.3	158.3	4	114.1	L115 D118 D120	L115-R122 PolarHBondContact O-NH1 3.49Å; D118-R122 WeakPolarHBondContact O-CB 3.37Å; D118-R122 PolarHBondContact O-N 2.84Å; D118-R122 VanDerWaalsContact O-N 3.15Å; D118-R122 IonicContact OD1-CZ 3.37Å; D118-R122 IonicContact OD1-NH1 3.64Å; D118-R122 IonicContact OD1-NH2 3.33Å; D118-R122 PolarHBondContact OD1-NH2 3.39Å; D118-R122 IonicContact OD2-CZ 3.56Å; D118-R122 VanDerWaalsContact OD2-CZ 3.31Å; D118-R122 IonicContact OD2-NE 3.11Å; D118-R122 IonicContact OD2-NH2 3.61Å; D118-R122 PolarHBondContact OD2-NH2 3.03Å; D120-R122 VanDerWaalsContact C-N 3.27Å; D120-R122 PolarHBondContact O-N 3.05Å
123	V	92.2	Very high	92.3	Very high	12 Å²	12	52.5 Å²	52.5	7%	0.073	27%	0.265	C	S	.	.	H	α-helix	trans	-108.8	-37.2	-171.5	-57.3	0	0	0	0	114.7	L115 Y119 S126 I127 F166 I168	L115-V123 HydrophobicContact CD1-CG1 3.97Å; L115-V123 HydrophobicContact CD1-CG2 4.09Å; L115-V123 HydrophobicContact CD2-CG1 3.41Å; L115-V123 VanDerWaalsContact CD2-CG1 3.41Å; L115-V123 HydrophobicContact CG-CG1 4.32Å; Y119-V123 WeakPolarHBondContact O-CG2 3.29Å; Y119-V123 PolarHBondContact O-N 3.34Å; V123-S126 WeakPolarHBondContact O-CB 3.15Å; V123-S126 PolarHBondContact O-N 3.48Å; V123-S126 VanDerWaalsContact O-N 3.16Å; V123-I127 HydrophobicContact CB-CD1 3.99Å; V123-I127 HydrophobicContact CG2-CD1 4.13Å; V123-I127 WeakPolarHBondContact O-CG1 3.48Å; V123-I127 PolarHBondContact O-N 2.88Å; V123-F166 HydrophobicContact CG1-CD1 4.02Å; V123-F166 HydrophobicContact CG1-CE1 4.16Å; V123-F166 HydrophobicContact CG2-CB 4.46Å; V123-F166 HydrophobicContact CG2-CG 4.44Å; V123-I168 HydrophobicContact CG2-CD1 3.36Å
124	L	92.2	Very high	92.5	Very high	2 Å²	2	48.4 Å²	48.4	1%	0.01	26%	0.26	C	S	.	.	H	α-helix	trans	-65.2	-40	-171.5	-73.1	172.7	0	0	0	113.2	S101 D120 S126 I127 V128 I168	S101-L124 WeakPolarHBondContact OG-CD1 3.47Å; D120-L124 HydrophobicContact CB-CD1 3.97Å; D120-L124 WeakPolarHBondContact O-CB 3.37Å; D120-L124 PolarHBondContact O-N 3.49Å; L124-S126 PolarHBondContact O-N 2.99Å; L124-I127 PolarHBondContact O-N 2.9Å; L124-V128 WeakPolarHBondContact O-CB 3.19Å; L124-V128 WeakPolarHBondContact O-CG2 3.03Å; L124-V128 PolarHBondContact O-N 3.13Å; L124-I168 HydrophobicContact CD2-CD1 4.42Å; L124-I168 HydrophobicContact CD2-CG2 4.36Å; L124-I168 HydrophobicContact CG-CD1 4.39Å
125	P	93.3	Very high	92.6	Very high	44 Å²	44	44.9 Å²	44.9	29%	0.286	24%	0.238	S	C	.	.	H	α-helix	trans	-57.6	-39.7	174.9	-25.6	36.3	0	0	0	112.3	E121 N129	E121-P125 VanDerWaalsContact O-CD 3.24Å; E121-P125 WeakPolarHBondContact O-CD 3.13Å; E121-P125 WeakPolarHBondContact O-CG 3.36Å; P125-N129 WeakPolarHBondContact O-CB 3.38Å; P125-N129 PolarHBondContact O-N 2.97Å; P125-N129 PolarHBondContact O-ND2 2.88Å
126	S	93.7	Very high	92.7	Very high	76 Å²	76	44.3 Å²	44.3	53%	0.531	24%	0.235	S	C	.	.	H	α-helix	trans	-67.9	-52.7	-180	-57.3	0	0	0	0	111.7	V123 L124 V128 N129 E130	V123-S126 WeakPolarHBondContact O-CB 3.15Å; V123-S126 PolarHBondContact O-N 3.48Å; V123-S126 VanDerWaalsContact O-N 3.16Å; L124-S126 PolarHBondContact O-N 2.99Å; S126-V128 PolarHBondContact O-N 2.92Å; S126-N129 PolarHBondContact O-N 3.39Å; S126-E130 PolarHBondContact O-N 2.69Å
127	I	95	Very high	92.9	Very high	8 Å²	8	46.1 Å²	46.1	4%	0.041	25%	0.249	C	C	.	.	H	α-helix	trans	-66	-42.4	-177.9	-56.7	164.3	0	0	0	110.7	V123 L124 N129 E130 V131 L159 R162 F166	V123-I127 HydrophobicContact CB-CD1 3.99Å; V123-I127 HydrophobicContact CG2-CD1 4.13Å; V123-I127 WeakPolarHBondContact O-CG1 3.48Å; V123-I127 PolarHBondContact O-N 2.88Å; L124-I127 PolarHBondContact O-N 2.9Å; I127-N129 PolarHBondContact O-N 3.3Å; I127-E130 PolarHBondContact O-N 3.44Å; I127-V131 HydrophobicContact CG2-CG2 4.24Å; I127-V131 WeakPolarHBondContact O-CB 3.2Å; I127-V131 WeakPolarHBondContact O-CG2 3.45Å; I127-V131 PolarHBondContact O-N 2.68Å; I127-L159 HydrophobicContact CB-CD1 4.46Å; I127-L159 HydrophobicContact CG2-CD1 3.69Å; I127-R162 HydrophobicContact CG2-CB 3.48Å; I127-R162 VanDerWaalsContact CG2-CB 3.48Å; I127-R162 HydrophobicContact CG2-CG 4.44Å; I127-F166 HydrophobicContact CD1-CD2 3.31Å; I127-F166 HydrophobicContact CD1-CE2 3.43Å; I127-F166 VanDerWaalsContact CD1-CE2 3.43Å; I127-F166 HydrophobicContact CD1-CG 4.18Å; I127-F166 HydrophobicContact CD1-CZ 4.37Å; I127-F166 HydrophobicContact CG1-CD2 4.35Å; I127-F166 HydrophobicContact CG1-CE2 4Å
128	V	95.6	Very high	93.2	Very high	1 Å²	1	48 Å²	48	1%	0.006	25%	0.25	C	C	.	.	H	α-helix	trans	-63.2	-44.1	178.3	170.5	0	0	0	0	110.5	I81 L97 V99 L124 S126 E130 L132 L159	I81-V128 HydrophobicContact CB-CG1 4.16Å; I81-V128 HydrophobicContact CD1-CB 3.82Å; I81-V128 HydrophobicContact CD1-CG1 3.96Å; I81-V128 HydrophobicContact CD1-CG2 3.77Å; I81-V128 HydrophobicContact CG2-CG1 4.04Å; L97-V128 HydrophobicContact CD2-CG1 3.64Å; V99-V128 HydrophobicContact CG2-CG2 4.01Å; L124-V128 WeakPolarHBondContact O-CB 3.19Å; L124-V128 WeakPolarHBondContact O-CG2 3.03Å; L124-V128 PolarHBondContact O-N 3.13Å; S126-V128 PolarHBondContact O-N 2.92Å; V128-E130 PolarHBondContact O-N 2.89Å; V128-L132 WeakPolarHBondContact O-CB 3.41Å; V128-L132 PolarHBondContact O-N 3.35Å; V128-L159 HydrophobicContact CG2-CD1 3.81Å; V128-L159 HydrophobicContact CG2-CD2 3.95Å
129	N	94.6	Very high	93.4	Very high	46 Å²	46	46.7 Å²	46.7	25%	0.246	24%	0.241	C	C	.	.	H	α-helix	trans	-62.6	-41.6	176.7	-78.7	-34.8	0	0	0	112.5	S83 P125 S126 I127 K133	S83-N129 WeakPolarHBondContact CB-OD1 3.02Å; S83-N129 PolarHBondContact OG-OD1 3.45Å; P125-N129 WeakPolarHBondContact O-CB 3.38Å; P125-N129 PolarHBondContact O-N 2.97Å; P125-N129 PolarHBondContact O-ND2 2.88Å; S126-N129 PolarHBondContact O-N 3.39Å; I127-N129 PolarHBondContact O-N 3.3Å; N129-K133 WeakPolarHBondContact O-CB 3.18Å; N129-K133 VanDerWaalsContact O-CG 3.23Å; N129-K133 WeakPolarHBondContact O-CG 3Å; N129-K133 PolarHBondContact O-N 2.81Å
130	E	94.8	Very high	93.6	Very high	95 Å²	95	48.4 Å²	48.4	44%	0.444	25%	0.252	S	S	.	.	H	α-helix	trans	-61.8	-53.9	176.4	-174.7	-170.8	157.5	0	0	111.4	S126 I127 V128 L132 K133 A134 R162	S126-E130 PolarHBondContact O-N 2.69Å; I127-E130 PolarHBondContact O-N 3.44Å; V128-E130 PolarHBondContact O-N 2.89Å; E130-L132 PolarHBondContact O-N 2.81Å; E130-K133 PolarHBondContact O-N 3.49Å; E130-A134 WeakPolarHBondContact O-CB 3.49Å; E130-A134 PolarHBondContact O-N 3.42Å; E130-R162 IonicContact OE1-CZ 3.17Å; E130-R162 IonicContact OE1-NH1 3.47Å; E130-R162 PolarHBondContact OE1-NH1 3.12Å; E130-R162 IonicContact OE1-NH2 2.68Å; E130-R162 PolarHBondContact OE1-NH2 3.26Å; E130-R162 IonicContact OE2-NH1 2.89Å
131	V	95.3	Very high	93.7	Very high	5 Å²	5	46.8 Å²	46.8	3%	0.03	24%	0.243	C	C	.	.	H	α-helix	trans	-63.7	-42.5	-178.1	173.8	0	0	0	0	111	I127 K133 A134 V135 I155 Q158 L159 R162	I127-V131 HydrophobicContact CG2-CG2 4.24Å; I127-V131 WeakPolarHBondContact O-CB 3.2Å; I127-V131 WeakPolarHBondContact O-CG2 3.45Å; I127-V131 PolarHBondContact O-N 2.68Å; V131-K133 PolarHBondContact O-N 3.4Å; V131-A134 PolarHBondContact O-N 2.79Å; V131-V135 HydrophobicContact CG1-CG2 4.22Å; V131-V135 WeakPolarHBondContact O-CG2 3.48Å; V131-V135 PolarHBondContact O-N 3.11Å; V131-I155 HydrophobicContact CG1-CG2 4.11Å; V131-Q158 HydrophobicContact CG1-CB 3.66Å; V131-L159 HydrophobicContact CB-CD1 4.45Å; V131-L159 HydrophobicContact CG1-CB 4.38Å; V131-L159 HydrophobicContact CG2-CD1 4.18Å; V131-R162 HydrophobicContact CG2-CB 4.45Å; V131-R162 HydrophobicContact CG2-CG 4.12Å
132	L	94.7	Very high	93.7	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-62.4	-44.3	179.5	-171.3	146.4	0	0	0	110.7	T85 L95 L97 V128 E130 V136	T85-L132 HydrophobicContact CG2-CD2 3.95Å; T85-L132 WeakPolarHBondContact OG1-CD2 3.39Å; L95-L132 HydrophobicContact CB-CD1 4.36Å; L95-L132 HydrophobicContact CB-CD2 4.3Å; L95-L132 HydrophobicContact CD2-CD1 3.56Å; L95-L132 HydrophobicContact CD2-CD2 4.02Å; L95-L132 HydrophobicContact CD2-CG 3.75Å; L95-L132 HydrophobicContact CG-CD1 4.22Å; L97-L132 HydrophobicContact CB-CD1 4Å; L97-L132 HydrophobicContact CD2-CD1 4.25Å; V128-L132 WeakPolarHBondContact O-CB 3.41Å; V128-L132 PolarHBondContact O-N 3.35Å; E130-L132 PolarHBondContact O-N 2.81Å; L132-V136 HydrophobicContact CD2-CG2 4.33Å; L132-V136 HydrophobicContact CG-CG2 4.29Å; L132-V136 WeakPolarHBondContact O-CB 3.22Å; L132-V136 WeakPolarHBondContact O-CG2 3.23Å; L132-V136 PolarHBondContact O-N 2.88Å
133	K	94.4	Very high	93.8	Very high	113 Å²	113	39.6 Å²	39.6	49%	0.491	22%	0.222	S	C	.	.	H	α-helix	trans	-61.7	-43	173.1	-72.5	173.9	-177.2	179.6	0	112.5	T85 N129 E130 V131 A137	T85-K133 HydrophobicContact CG2-CB 4.37Å; T85-K133 HydrophobicContact CG2-CG 4Å; N129-K133 WeakPolarHBondContact O-CB 3.18Å; N129-K133 VanDerWaalsContact O-CG 3.23Å; N129-K133 WeakPolarHBondContact O-CG 3Å; N129-K133 PolarHBondContact O-N 2.81Å; E130-K133 PolarHBondContact O-N 3.49Å; V131-K133 PolarHBondContact O-N 3.4Å; K133-A137 VanDerWaalsContact O-CB 3.23Å; K133-A137 WeakPolarHBondContact O-CB 3.39Å; K133-A137 PolarHBondContact O-N 2.93Å
134	A	94.4	Very high	93.8	Very high	49 Å²	49	39.1 Å²	39.1	41%	0.405	22%	0.219	S	C	.	.	H	α-helix	trans	-67.9	-36.8	-178.5	0	0	0	0	0	113.8	E130 V131 K138	E130-A134 WeakPolarHBondContact O-CB 3.49Å; E130-A134 PolarHBondContact O-N 3.42Å; V131-A134 PolarHBondContact O-N 2.79Å; A134-K138 WeakPolarHBondContact O-CE 3.33Å
135	V	94.4	Very high	93.7	Very high	3 Å²	3	43.8 Å²	43.8	2%	0.018	24%	0.243	C	C	.	.	H	α-helix	trans	-79.7	-48.9	178.1	-179.4	0	0	0	0	111.2	V131 A137 K138 F139 V151 L154 I155 Q158	V131-V135 HydrophobicContact CG1-CG2 4.22Å; V131-V135 WeakPolarHBondContact O-CG2 3.48Å; V131-V135 PolarHBondContact O-N 3.11Å; V135-A137 VanDerWaalsContact C-N 3.26Å; V135-A137 PolarHBondContact O-N 2.86Å; V135-K138 WeakPolarHBondContact O-CB 3.44Å; V135-K138 PolarHBondContact O-N 3.45Å; V135-F139 HydrophobicContact CG1-CD2 4.29Å; V135-F139 HydrophobicContact CG1-CE2 4.04Å; V135-F139 WeakPolarHBondContact O-CD2 3.45Å; V135-V151 HydrophobicContact CG1-CG1 4.19Å; V135-L154 HydrophobicContact CG1-CB 4.22Å; V135-I155 HydrophobicContact CB-CG1 3.87Å; V135-I155 HydrophobicContact CG1-CG1 3.85Å; V135-I155 HydrophobicContact CG2-CG1 3.95Å; V135-Q158 HydrophobicContact CG2-CG 4.5Å
136	V	94.2	Very high	93.6	Very high	1 Å²	1	47 Å²	47	1%	0.006	26%	0.262	C	S	.	.	H	α-helix	trans	-64.9	-32.6	-173.3	173.5	0	0	0	0	111.3	T85 L95 L132 K138 F139 L144	T85-V136 HydrophobicContact CG2-CB 3.62Å; T85-V136 HydrophobicContact CG2-CG1 3.68Å; T85-V136 HydrophobicContact CG2-CG2 4.3Å; L95-V136 HydrophobicContact CD2-CG2 3.96Å; L132-V136 HydrophobicContact CD2-CG2 4.33Å; L132-V136 HydrophobicContact CG-CG2 4.29Å; L132-V136 WeakPolarHBondContact O-CB 3.22Å; L132-V136 WeakPolarHBondContact O-CG2 3.23Å; L132-V136 PolarHBondContact O-N 2.88Å; V136-K138 PolarHBondContact O-N 3.49Å; V136-F139 PolarHBondContact O-N 2.93Å; V136-F139 VanDerWaalsContact O-O 3.11Å; V136-L144 HydrophobicContact CG1-CD1 3.86Å; V136-L144 HydrophobicContact CG1-CD2 4.37Å; V136-L144 HydrophobicContact CG2-CD2 4.5Å
137	A	94.3	Very high	93.6	Very high	52 Å²	52	46.9 Å²	46.9	43%	0.43	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-16.3	174.2	0	0	0	0	0	114.2	K88 K133 V135	K88-A137 WeakPolarHBondContact CA-O 2.94Å; K88-A137 WeakPolarHBondContact CB-O 3.43Å; K133-A137 VanDerWaalsContact O-CB 3.23Å; K133-A137 WeakPolarHBondContact O-CB 3.39Å; K133-A137 PolarHBondContact O-N 2.93Å; V135-A137 VanDerWaalsContact C-N 3.26Å; V135-A137 PolarHBondContact O-N 2.86Å
138	K	95.1	Very high	93.5	Very high	127 Å²	127	50.7 Å²	50.7	55%	0.552	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-16.2	177.6	-58.6	176.5	-176.8	176.6	0	113.4	K88 A134 V135 V136	K88-K138 WeakPolarHBondContact CD-O 3.49Å; A134-K138 WeakPolarHBondContact O-CE 3.33Å; V135-K138 WeakPolarHBondContact O-CB 3.44Å; V135-K138 PolarHBondContact O-N 3.45Å; V136-K138 PolarHBondContact O-N 3.49Å
139	F	95.3	Very high	93.4	Very high	25 Å²	25	59 Å²	59	11%	0.11	31%	0.305	C	S	.	.	S	Bend	trans	-113.4	145.9	-174.3	-70	-83.9	0	0	0	111.8	K88 V135 V136 Q143 L144 V151 L154	K88-F139 VanDerWaalsContact CB-O 3.28Å; K88-F139 WeakPolarHBondContact CB-O 3.49Å; K88-F139 PolarHBondContact N-O 3.32Å; V135-F139 HydrophobicContact CG1-CD2 4.29Å; V135-F139 HydrophobicContact CG1-CE2 4.04Å; V135-F139 WeakPolarHBondContact O-CD2 3.45Å; V136-F139 PolarHBondContact O-N 2.93Å; V136-F139 VanDerWaalsContact O-O 3.11Å; F139-Q143 HydrophobicContact CB-CB 4.48Å; F139-Q143 HydrophobicContact CD1-CB 4.22Å; F139-L144 HydrophobicContact CB-CD2 3.94Å; F139-L144 HydrophobicContact CB-CG 4.36Å; F139-V151 HydrophobicContact CD1-CG2 4.08Å; F139-V151 HydrophobicContact CD2-CG2 3.98Å; F139-V151 HydrophobicContact CE1-CG2 4.12Å; F139-V151 HydrophobicContact CE2-CG2 4.04Å; F139-V151 HydrophobicContact CG-CG2 4.01Å; F139-V151 HydrophobicContact CZ-CG2 4.11Å; F139-L154 HydrophobicContact CE2-CD1 3.78Å; F139-L154 HydrophobicContact CZ-CD1 3.53Å
140	N	93.5	Very high	93.4	Very high	51 Å²	51	61.8 Å²	61.8	27%	0.273	32%	0.317	S	S	.	.			trans	-76.9	155.6	171.8	-66.8	-22.8	0	0	0	110.8	K88 S142 Q143 L144	K88-N140 WeakPolarHBondContact CB-OD1 3.04Å; N140-S142 VanDerWaalsContact C-N 3.28Å; N140-S142 PolarHBondContact O-N 3.33Å; N140-Q143 HydrophobicContact CB-CG 4.31Å; N140-Q143 WeakPolarHBondContact O-CB 3.32Å; N140-Q143 PolarHBondContact O-N 2.73Å; N140-L144 PolarHBondContact O-N 3.39Å; N140-L144 VanDerWaalsContact O-N 3.15Å
141	A	90.8	Very high	93.4	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-49.6	-45.2	174.8	0	0	0	0	0	113.5	D89 Q143 L144 F180 Y184	D89-A141 PolarHBondContact OD1-N 3.38Å; D89-A141 VanDerWaalsContact OD1-N 3.08Å; A141-Q143 VanDerWaalsContact C-N 3.31Å; A141-Q143 PolarHBondContact O-N 2.87Å; A141-L144 PolarHBondContact O-N 3.13Å; A141-F180 HydrophobicContact CB-CD1 4.1Å; A141-F180 HydrophobicContact CB-CE1 3.5Å; A141-F180 VanDerWaalsContact CB-CE1 3.5Å; A141-F180 HydrophobicContact CB-CZ 4.28Å; A141-F180 WeakPolarHBondContact O-CZ 3.23Å; A141-Y184 HydrophobicContact CB-CE1 4.09Å; A141-Y184 HydrophobicContact CB-CE2 4.41Å; A141-Y184 WeakPolarHBondContact CB-OH 3.46Å
142	S	88.9	Confident	93.3	Very high	61 Å²	61	57.7 Å²	57.7	43%	0.427	30%	0.299	S	S	.	.	H	α-helix	trans	-64.6	-30.8	178.2	58.8	0	0	0	0	114.1	N140 T146	N140-S142 VanDerWaalsContact C-N 3.28Å; N140-S142 PolarHBondContact O-N 3.33Å; S142-T146 PolarHBondContact O-N 3.46Å; S142-T146 PolarHBondContact O-OG1 3.07Å
143	Q	92.8	Very high	93.3	Very high	61 Å²	61	60.8 Å²	60.8	29%	0.285	32%	0.316	S	S	.	.	H	α-helix	trans	-74.9	-32.3	176.9	-68.2	173.4	-30.3	0	0	111.3	F139 N140 A141 I145 T146 Q147	F139-Q143 HydrophobicContact CB-CB 4.48Å; F139-Q143 HydrophobicContact CD1-CB 4.22Å; N140-Q143 HydrophobicContact CB-CG 4.31Å; N140-Q143 WeakPolarHBondContact O-CB 3.32Å; N140-Q143 PolarHBondContact O-N 2.73Å; A141-Q143 VanDerWaalsContact C-N 3.31Å; A141-Q143 PolarHBondContact O-N 2.87Å; Q143-I145 PolarHBondContact O-N 2.84Å; Q143-T146 PolarHBondContact O-N 2.98Å; Q143-Q147 WeakPolarHBondContact O-CA 3.15Å; Q143-Q147 WeakPolarHBondContact O-CB 3.4Å; Q143-Q147 PolarHBondContact O-N 3.33Å
144	L	92.3	Very high	93.4	Very high	1 Å²	1	58.3 Å²	58.3	1%	0.005	31%	0.307	C	S	.	.	H	α-helix	trans	-64.8	-28.2	176.1	-61.6	171.3	0	0	0	112.4	V93 V136 F139 N140 A141 R148 V151 L178	V93-L144 HydrophobicContact CG1-CD1 4.37Å; V93-L144 HydrophobicContact CG2-CD1 4.09Å; V136-L144 HydrophobicContact CG1-CD1 3.86Å; V136-L144 HydrophobicContact CG1-CD2 4.37Å; V136-L144 HydrophobicContact CG2-CD2 4.5Å; F139-L144 HydrophobicContact CB-CD2 3.94Å; F139-L144 HydrophobicContact CB-CG 4.36Å; N140-L144 PolarHBondContact O-N 3.39Å; N140-L144 VanDerWaalsContact O-N 3.15Å; A141-L144 PolarHBondContact O-N 3.13Å; L144-R148 WeakPolarHBondContact O-CB 3.2Å; L144-V151 HydrophobicContact CD2-CG1 3.99Å; L144-V151 HydrophobicContact CD2-CG2 4.12Å; L144-L178 HydrophobicContact CB-CD1 3.63Å; L144-L178 HydrophobicContact CD1-CD1 4.47Å
145	I	90	Very high	93.5	Very high	100 Å²	100	56 Å²	56	51%	0.513	29%	0.288	S	S	.	.	H	α-helix	trans	-73.9	-52.3	174.2	-54.2	176.2	0	0	0	110.4	Q143 F180	Q143-I145 PolarHBondContact O-N 2.84Å; I145-F180 HydrophobicContact CD1-CE2 3.46Å; I145-F180 VanDerWaalsContact CD1-CE2 3.46Å; I145-F180 HydrophobicContact CD1-CZ 3.74Å; I145-F180 HydrophobicContact CG1-CE2 3.53Å; I145-F180 HydrophobicContact CG1-CZ 3.52Å
146	T	91.7	Very high	93.5	Very high	112 Å²	112	59.9 Å²	59.9	69%	0.687	30%	0.302	S	S	*	.	H	α-helix	trans	-80.1	-36.1	-170.5	51.1	0	0	0	0	113.3	S142 Q143	S142-T146 PolarHBondContact O-N 3.46Å; S142-T146 PolarHBondContact O-OG1 3.07Å; Q143-T146 PolarHBondContact O-N 2.98Å
147	Q	93.5	Very high	93.6	Very high	74 Å²	74	66 Å²	66	35%	0.346	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.5	29.2	-173.7	-59.7	179.6	-4.8	0	0	112.7	Q143 Q149 Q150 V151	Q143-Q147 WeakPolarHBondContact O-CA 3.15Å; Q143-Q147 WeakPolarHBondContact O-CB 3.4Å; Q143-Q147 PolarHBondContact O-N 3.33Å; Q147-Q149 VanDerWaalsContact C-N 3.26Å; Q147-Q149 PolarHBondContact O-N 2.95Å; Q147-Q149 VanDerWaalsContact O-N 3.15Å; Q147-Q150 HydrophobicContact CB-CB 4.43Å; Q147-Q150 PolarHBondContact O-N 3.08Å; Q147-V151 WeakPolarHBondContact O-CG2 3.23Å; Q147-V151 PolarHBondContact O-N 3.31Å
148	R	92.5	Very high	93.7	Very high	88 Å²	88	66.4 Å²	66.4	33%	0.332	32%	0.322	S	S	.	.	H	α-helix	trans	-51.6	-40.5	-176.3	-169.7	-173.5	-173.6	177.6	11.7	114.2	L144 S152 I175 T176	L144-R148 WeakPolarHBondContact O-CB 3.2Å; R148-S152 WeakPolarHBondContact O-CB 3.47Å; R148-S152 PolarHBondContact O-N 3.45Å; R148-S152 PolarHBondContact O-OG 2.77Å; R148-I175 HydrophobicContact CG-CB 4.14Å; R148-I175 HydrophobicContact CG-CD1 3.92Å; R148-I175 HydrophobicContact CG-CG2 4.49Å; R148-I175 PolarHBondContact NE-O 3.35Å; R148-I175 PolarHBondContact NH2-O 3.08Å; R148-T176 PolarHBondContact NH2-O 2.89Å
149	Q	93.8	Very high	93.7	Very high	174 Å²	174	60.3 Å²	60.3	81%	0.813	30%	0.295	S	S	*	.	H	α-helix	trans	-67.1	-42.6	180	-69.6	179.1	-16.7	0	0	111.9	Q147 S152 L153	Q147-Q149 VanDerWaalsContact C-N 3.26Å; Q147-Q149 PolarHBondContact O-N 2.95Å; Q147-Q149 VanDerWaalsContact O-N 3.15Å; Q149-S152 PolarHBondContact O-N 3.39Å; Q149-L153 PolarHBondContact O-N 3.3Å
150	Q	94.3	Very high	93.8	Very high	106 Å²	106	62.3 Å²	62.3	50%	0.495	31%	0.31	S	S	.	.	H	α-helix	trans	-64.9	-42.2	177.7	-175.2	177.6	0.6	0	0	111.2	Q147 L153 L154	Q147-Q150 HydrophobicContact CB-CB 4.43Å; Q147-Q150 PolarHBondContact O-N 3.08Å; Q150-L153 PolarHBondContact O-N 3.25Å; Q150-L154 WeakPolarHBondContact O-CG 3.39Å; Q150-L154 PolarHBondContact O-N 3.46Å
151	V	94.6	Very high	93.9	Very high	0 Å²	0	66.2 Å²	66.2	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-63.1	-43.7	175.7	178.3	0	0	0	0	110.7	V135 F139 L144 Q147 L153 L154 I155 I175	V135-V151 HydrophobicContact CG1-CG1 4.19Å; F139-V151 HydrophobicContact CD1-CG2 4.08Å; F139-V151 HydrophobicContact CD2-CG2 3.98Å; F139-V151 HydrophobicContact CE1-CG2 4.12Å; F139-V151 HydrophobicContact CE2-CG2 4.04Å; F139-V151 HydrophobicContact CG-CG2 4.01Å; F139-V151 HydrophobicContact CZ-CG2 4.11Å; L144-V151 HydrophobicContact CD2-CG1 3.99Å; L144-V151 HydrophobicContact CD2-CG2 4.12Å; Q147-V151 WeakPolarHBondContact O-CG2 3.23Å; Q147-V151 PolarHBondContact O-N 3.31Å; V151-L153 VanDerWaalsContact C-N 3.31Å; V151-L153 PolarHBondContact O-N 2.8Å; V151-L154 PolarHBondContact O-N 3.4Å; V151-I155 HydrophobicContact CG1-CD1 3.95Å; V151-I155 HydrophobicContact CG1-CG1 4.4Å; V151-I155 WeakPolarHBondContact O-CG1 3.5Å; V151-I155 PolarHBondContact O-N 2.92Å; V151-I175 HydrophobicContact CB-CD1 4.46Å; V151-I175 HydrophobicContact CG1-CD1 4.19Å
152	S	94.5	Very high	94.1	Very high	14 Å²	14	71.2 Å²	71.2	10%	0.098	35%	0.345	C	S	.	.	H	α-helix	trans	-59.7	-40.6	176.6	-57.3	0	0	0	0	112.1	R148 Q149 I155 R156 I175	R148-S152 WeakPolarHBondContact O-CB 3.47Å; R148-S152 PolarHBondContact O-N 3.45Å; R148-S152 PolarHBondContact O-OG 2.77Å; Q149-S152 PolarHBondContact O-N 3.39Å; S152-I155 PolarHBondContact O-N 2.81Å; S152-R156 WeakPolarHBondContact O-CB 3.48Å; S152-R156 PolarHBondContact O-N 3.33Å; S152-I175 WeakPolarHBondContact OG-CG1 3.43Å
153	L	94.9	Very high	94.4	Very high	65 Å²	65	68.3 Å²	68.3	34%	0.34	33%	0.325	S	S	.	.	H	α-helix	trans	-65.3	-39.5	176.4	-175.9	153.5	0	0	0	112.4	Q149 Q150 V151 R156 K157	Q149-L153 PolarHBondContact O-N 3.3Å; Q150-L153 PolarHBondContact O-N 3.25Å; V151-L153 VanDerWaalsContact C-N 3.31Å; V151-L153 PolarHBondContact O-N 2.8Å; L153-R156 WeakPolarHBondContact O-CB 3.47Å; L153-R156 PolarHBondContact O-N 2.89Å; L153-K157 HydrophobicContact CD2-CD 3.98Å; L153-K157 HydrophobicContact CD2-CG 4.45Å; L153-K157 WeakPolarHBondContact O-CG 3.37Å; L153-K157 PolarHBondContact O-N 3.47Å; L153-K157 VanDerWaalsContact O-N 3.08Å
154	L	95.4	Very high	94.4	Very high	60 Å²	60	69 Å²	69	31%	0.314	34%	0.336	S	S	.	.	H	α-helix	trans	-67.2	-42.7	175.7	-70.9	173.4	0	0	0	111.9	V135 F139 Q150 V151 R156 K157 Q158	V135-L154 HydrophobicContact CG1-CB 4.22Å; F139-L154 HydrophobicContact CE2-CD1 3.78Å; F139-L154 HydrophobicContact CZ-CD1 3.53Å; Q150-L154 WeakPolarHBondContact O-CG 3.39Å; Q150-L154 PolarHBondContact O-N 3.46Å; V151-L154 PolarHBondContact O-N 3.4Å; L154-R156 VanDerWaalsContact C-N 3.3Å; L154-R156 PolarHBondContact O-N 3.19Å; L154-K157 PolarHBondContact O-N 3.22Å; L154-Q158 PolarHBondContact O-N 2.96Å
155	I	96.1	Very high	94.5	Very high	1 Å²	1	74.3 Å²	74.3	1%	0.005	36%	0.364	C	S	.	.	H	α-helix	trans	-58.6	-45.7	172.9	-65.3	169.4	0	0	0	109.6	L97 V131 V135 V151 S152 K157 Q158 L159 V173 I175	L97-I155 HydrophobicContact CD1-CD1 4.49Å; L97-I155 HydrophobicContact CD2-CG2 4.01Å; V131-I155 HydrophobicContact CG1-CG2 4.11Å; V135-I155 HydrophobicContact CB-CG1 3.87Å; V135-I155 HydrophobicContact CG1-CG1 3.85Å; V135-I155 HydrophobicContact CG2-CG1 3.95Å; V151-I155 HydrophobicContact CG1-CD1 3.95Å; V151-I155 HydrophobicContact CG1-CG1 4.4Å; V151-I155 WeakPolarHBondContact O-CG1 3.5Å; V151-I155 PolarHBondContact O-N 2.92Å; S152-I155 PolarHBondContact O-N 2.81Å; I155-K157 PolarHBondContact O-N 3.31Å; I155-Q158 PolarHBondContact O-N 2.96Å; I155-L159 WeakPolarHBondContact O-CB 3.45Å; I155-L159 PolarHBondContact O-N 3.38Å; I155-V173 HydrophobicContact CB-CG1 4.42Å; I155-V173 HydrophobicContact CG2-CG1 3.83Å; I155-I175 HydrophobicContact CD1-CD1 4.49Å
156	R	96	Very high	94.7	Very high	85 Å²	85	73.3 Å²	73.3	32%	0.321	36%	0.357	S	S	.	.	H	α-helix	trans	-55.9	-48.4	177.5	-171.9	179.8	66.6	-144.7	3	112	S152 L153 L154 Q158 L159 V160 V173	S152-R156 WeakPolarHBondContact O-CB 3.48Å; S152-R156 PolarHBondContact O-N 3.33Å; L153-R156 WeakPolarHBondContact O-CB 3.47Å; L153-R156 PolarHBondContact O-N 2.89Å; L154-R156 VanDerWaalsContact C-N 3.3Å; L154-R156 PolarHBondContact O-N 3.19Å; R156-Q158 PolarHBondContact O-N 2.91Å; R156-L159 PolarHBondContact O-N 3.22Å; R156-V160 HydrophobicContact CG-CG2 4.27Å; R156-V160 WeakPolarHBondContact O-CB 3.45Å; R156-V160 WeakPolarHBondContact O-CG2 3.43Å; R156-V160 PolarHBondContact O-N 3.23Å; R156-V173 HydrophobicContact CB-CB 4.04Å; R156-V173 HydrophobicContact CB-CG2 4.13Å; R156-V173 HydrophobicContact CG-CB 4.4Å; R156-V173 HydrophobicContact CG-CG2 4.14Å
157	K	96	Very high	94.8	Very high	130 Å²	130	70.2 Å²	70.2	57%	0.565	33%	0.334	S	S	*	.	H	α-helix	trans	-57.8	-48.8	-179.9	-74.3	178.2	174.5	179.9	0	112.1	L153 L154 I155 E161	L153-K157 HydrophobicContact CD2-CD 3.98Å; L153-K157 HydrophobicContact CD2-CG 4.45Å; L153-K157 WeakPolarHBondContact O-CG 3.37Å; L153-K157 PolarHBondContact O-N 3.47Å; L153-K157 VanDerWaalsContact O-N 3.08Å; L154-K157 PolarHBondContact O-N 3.22Å; I155-K157 PolarHBondContact O-N 3.31Å; K157-E161 PolarHBondContact O-N 3.49Å
158	Q	95.8	Very high	94.9	Very high	59 Å²	59	66.9 Å²	66.9	28%	0.276	32%	0.319	S	S	.	.	H	α-helix	trans	-70.6	-34.9	179.7	-67.9	-163.6	-30.2	0	0	112.7	V131 V135 L154 I155 R156 E161 R162	V131-Q158 HydrophobicContact CG1-CB 3.66Å; V135-Q158 HydrophobicContact CG2-CG 4.5Å; L154-Q158 PolarHBondContact O-N 2.96Å; I155-Q158 PolarHBondContact O-N 2.96Å; R156-Q158 PolarHBondContact O-N 2.91Å; Q158-E161 PolarHBondContact O-N 2.81Å; Q158-R162 PolarHBondContact O-N 2.9Å; Q158-R162 VanDerWaalsContact O-N 3.11Å
159	L	96.1	Very high	95	Very high	0 Å²	0	65.3 Å²	65.3	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-69.9	-36.5	178.4	-169.5	63.7	0	0	0	111.6	V99 I127 V128 V131 I155 R156 R162 A163 V170 V173	V99-L159 HydrophobicContact CG1-CD2 3.89Å; V99-L159 HydrophobicContact CG2-CD2 3.95Å; I127-L159 HydrophobicContact CB-CD1 4.46Å; I127-L159 HydrophobicContact CG2-CD1 3.69Å; V128-L159 HydrophobicContact CG2-CD1 3.81Å; V128-L159 HydrophobicContact CG2-CD2 3.95Å; V131-L159 HydrophobicContact CB-CD1 4.45Å; V131-L159 HydrophobicContact CG1-CB 4.38Å; V131-L159 HydrophobicContact CG2-CD1 4.18Å; I155-L159 WeakPolarHBondContact O-CB 3.45Å; I155-L159 PolarHBondContact O-N 3.38Å; R156-L159 PolarHBondContact O-N 3.22Å; L159-R162 PolarHBondContact O-N 3.03Å; L159-A163 WeakPolarHBondContact O-CB 3.28Å; L159-A163 PolarHBondContact O-N 3.03Å; L159-V170 HydrophobicContact CD2-CG1 4.19Å; L159-V170 HydrophobicContact CD2-CG2 4.4Å; L159-V170 HydrophobicContact CG-CG2 4.24Å; L159-V173 HydrophobicContact CD2-CG2 3.7Å
160	V	96.2	Very high	95.1	Very high	67 Å²	67	57.7 Å²	57.7	41%	0.406	28%	0.282	S	S	.	.	H	α-helix	trans	-62.1	-45.6	174	168.4	0	0	0	0	110.7	R156 A163 S164 V170	R156-V160 HydrophobicContact CG-CG2 4.27Å; R156-V160 WeakPolarHBondContact O-CB 3.45Å; R156-V160 WeakPolarHBondContact O-CG2 3.43Å; R156-V160 PolarHBondContact O-N 3.23Å; V160-A163 PolarHBondContact O-N 3.35Å; V160-S164 WeakPolarHBondContact O-CB 3.4Å; V160-S164 PolarHBondContact O-N 3.37Å; V160-V170 HydrophobicContact CG2-CB 4.03Å; V160-V170 HydrophobicContact CG2-CG1 4.48Å
161	E	95.5	Very high	95.1	Very high	133 Å²	133	55.6 Å²	55.6	62%	0.621	27%	0.274	S	S	*	.	H	α-helix	trans	-58.9	-50	177.5	-173.5	177.7	-172.1	0	0	111.3	K157 Q158 S164	K157-E161 PolarHBondContact O-N 3.49Å; Q158-E161 PolarHBondContact O-N 2.81Å; E161-S164 WeakPolarHBondContact O-CB 3.36Å; E161-S164 PolarHBondContact O-N 3.31Å
162	R	95.1	Very high	95.1	Very high	105 Å²	105	58.1 Å²	58.1	40%	0.396	29%	0.287	S	S	.	.	H	α-helix	trans	-72.6	-30.1	179.7	-64	-52.9	-169.6	92.4	7.2	114.4	I127 E130 V131 Q158 L159 S164 F166	I127-R162 HydrophobicContact CG2-CB 3.48Å; I127-R162 VanDerWaalsContact CG2-CB 3.48Å; I127-R162 HydrophobicContact CG2-CG 4.44Å; E130-R162 IonicContact OE1-CZ 3.17Å; E130-R162 IonicContact OE1-NH1 3.47Å; E130-R162 PolarHBondContact OE1-NH1 3.12Å; E130-R162 IonicContact OE1-NH2 2.68Å; E130-R162 PolarHBondContact OE1-NH2 3.26Å; E130-R162 IonicContact OE2-NH1 2.89Å; V131-R162 HydrophobicContact CG2-CB 4.45Å; V131-R162 HydrophobicContact CG2-CG 4.12Å; Q158-R162 PolarHBondContact O-N 2.9Å; Q158-R162 VanDerWaalsContact O-N 3.11Å; L159-R162 PolarHBondContact O-N 3.03Å; R162-S164 VanDerWaalsContact C-N 3.33Å; R162-F166 WeakPolarHBondContact O-CD2 3.36Å
163	A	94.9	Very high	95.2	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-74.8	-26.2	176.4	0	0	0	0	0	112.1	L159 V160 D165 F166 H167 I168 V170	L159-A163 WeakPolarHBondContact O-CB 3.28Å; L159-A163 PolarHBondContact O-N 3.03Å; V160-A163 PolarHBondContact O-N 3.35Å; A163-D165 VanDerWaalsContact C-N 3.28Å; A163-D165 PolarHBondContact O-N 3.32Å; A163-F166 CarbonylContact O-C 3.55Å; A163-F166 PolarHBondContact O-N 3.01Å; A163-F166 VanDerWaalsContact O-N 3.11Å; A163-H167 PolarHBondContact O-N 3.39Å; A163-I168 CarbonylContact C-O 3.49Å; A163-I168 HydrophobicContact CB-CB 4.3Å; A163-I168 WeakPolarHBondContact CB-O 3.31Å; A163-I168 PolarHBondContact O-N 3.06Å; A163-V170 HydrophobicContact CB-CG2 3.63Å
164	S	93.5	Very high	95.1	Very high	75 Å²	75	55.8 Å²	55.8	52%	0.524	28%	0.276	S	S	.	.	H	α-helix	trans	-60.5	-36.5	176.2	-167.4	0	0	0	0	112.2	V160 E161 R162 F166 H167	V160-S164 WeakPolarHBondContact O-CB 3.4Å; V160-S164 PolarHBondContact O-N 3.37Å; E161-S164 WeakPolarHBondContact O-CB 3.36Å; E161-S164 PolarHBondContact O-N 3.31Å; R162-S164 VanDerWaalsContact C-N 3.33Å; S164-F166 PolarHBondContact O-N 2.96Å; S164-H167 PolarHBondContact O-N 3.06Å
165	D	93.5	Very high	95.1	Very high	112 Å²	112	53.3 Å²	53.3	60%	0.599	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-27.5	177.2	-64.6	-22.9	0	0	0	112.5	A163	A163-D165 VanDerWaalsContact C-N 3.28Å; A163-D165 PolarHBondContact O-N 3.32Å
166	F	94.3	Very high	94.9	Very high	80 Å²	80	55.4 Å²	55.4	35%	0.351	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.9	7.9	178.9	-61.5	-81.2	0	0	0	113	L115 V123 I127 R162 A163 S164 I168	L115-F166 HydrophobicContact CD1-CB 4.3Å; L115-F166 HydrophobicContact CD1-CD1 4.42Å; L115-F166 HydrophobicContact CD2-CD1 4.35Å; V123-F166 HydrophobicContact CG1-CD1 4.02Å; V123-F166 HydrophobicContact CG1-CE1 4.16Å; V123-F166 HydrophobicContact CG2-CB 4.46Å; V123-F166 HydrophobicContact CG2-CG 4.44Å; I127-F166 HydrophobicContact CD1-CD2 3.31Å; I127-F166 HydrophobicContact CD1-CE2 3.43Å; I127-F166 VanDerWaalsContact CD1-CE2 3.43Å; I127-F166 HydrophobicContact CD1-CG 4.18Å; I127-F166 HydrophobicContact CD1-CZ 4.37Å; I127-F166 HydrophobicContact CG1-CD2 4.35Å; I127-F166 HydrophobicContact CG1-CE2 4Å; R162-F166 WeakPolarHBondContact O-CD2 3.36Å; A163-F166 CarbonylContact O-C 3.55Å; A163-F166 PolarHBondContact O-N 3.01Å; A163-F166 VanDerWaalsContact O-N 3.11Å; S164-F166 PolarHBondContact O-N 2.96Å; F166-I168 VanDerWaalsContact C-N 3.25Å; F166-I168 HydrophobicContact CB-CD1 4.17Å; F166-I168 HydrophobicContact CB-CG1 4.29Å; F166-I168 PolarHBondContact O-N 3.06Å
167	H	94.5	Very high	94.8	Very high	46 Å²	46	55.2 Å²	55.2	21%	0.213	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.8	36.7	-177.4	-48.2	91.9	0	0	0	112.9	E104 Q107 H110 I111 A163 S164	E104-H167 HydrophobicContact CB-CB 4.21Å; E104-H167 WeakPolarHBondContact CB-O 3.42Å; E104-H167 PolarHBondContact N-O 3.15Å; E104-H167 IonicContact OE2-CD2 2.7Å; Q107-H167 HydrophobicContact CB-CB 3.82Å; Q107-H167 HydrophobicContact CG-CB 4.42Å; H110-H167 AromaticContact CE1-CE1 3.71Å; H110-H167 AromaticContact CE1-ND1 3.96Å; H110-H167 AromaticContact ND1-CE1 3.51Å; H110-H167 AromaticContact ND1-ND1 3.46Å; H110-H167 PolarHBondContact ND1-ND1 3.18Å; I111-H167 HydrophobicContact CD1-CB 4.03Å; I111-H167 WeakPolarHBondContact CD1-O 3.43Å; I111-H167 HydrophobicContact CG1-CB 4.04Å; A163-H167 PolarHBondContact O-N 3.39Å; S164-H167 PolarHBondContact O-N 3.06Å
168	I	95.1	Very high	94.6	Very high	5 Å²	5	50.8 Å²	50.8	3%	0.026	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	125.9	175.9	-59.8	172.3	0	0	0	108.7	Y119 V123 L124 A163 F166	Y119-I168 HydrophobicContact CD2-CD1 3.85Å; Y119-I168 HydrophobicContact CD2-CG1 4.06Å; Y119-I168 HydrophobicContact CE2-CD1 4.36Å; Y119-I168 HydrophobicContact CE2-CG1 4.33Å; V123-I168 HydrophobicContact CG2-CD1 3.36Å; L124-I168 HydrophobicContact CD2-CD1 4.42Å; L124-I168 HydrophobicContact CD2-CG2 4.36Å; L124-I168 HydrophobicContact CG-CD1 4.39Å; A163-I168 CarbonylContact C-O 3.49Å; A163-I168 HydrophobicContact CB-CB 4.3Å; A163-I168 WeakPolarHBondContact CB-O 3.31Å; A163-I168 PolarHBondContact O-N 3.06Å; F166-I168 VanDerWaalsContact C-N 3.25Å; F166-I168 HydrophobicContact CB-CD1 4.17Å; F166-I168 HydrophobicContact CB-CG1 4.29Å; F166-I168 PolarHBondContact O-N 3.06Å
169	I	95.4	Very high	94.4	Very high	55 Å²	55	51.6 Å²	51.6	28%	0.282	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	125.8	176	-57.7	173.2	0	0	0	108.4	S101 R102 E104	S101-I169 CarbonylContact C-O 3.53Å; S101-I169 VanDerWaalsContact CA-O 3.26Å; S101-I169 WeakPolarHBondContact CA-O 3.36Å; R102-I169 HydrophobicContact CG-CB 3.95Å; R102-I169 HydrophobicContact CG-CG2 4.34Å; R102-I169 PolarHBondContact N-O 3.32Å; R102-I169 PolarHBondContact O-N 3.1Å; E104-I169 HydrophobicContact CB-CD1 4.19Å; E104-I169 HydrophobicContact CB-CG1 4.18Å; E104-I169 HydrophobicContact CG-CD1 4.2Å
170	V	95.9	Very high	94.1	Very high	13 Å²	13	53 Å²	53	8%	0.079	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	111.1	173.8	178.3	0	0	0	0	108.4	V99 L159 V160 A163 V173	V99-V170 HydrophobicContact CG1-CG1 4.03Å; L159-V170 HydrophobicContact CD2-CG1 4.19Å; L159-V170 HydrophobicContact CD2-CG2 4.4Å; L159-V170 HydrophobicContact CG-CG2 4.24Å; V160-V170 HydrophobicContact CG2-CB 4.03Å; V160-V170 HydrophobicContact CG2-CG1 4.48Å; A163-V170 HydrophobicContact CB-CG2 3.63Å; V170-V173 HydrophobicContact CG1-CG2 3.55Å
171	D	94.3	Very high	93.6	Very high	62 Å²	62	52 Å²	52	33%	0.332	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	-42.6	-177	-59.5	-53	0	0	0	111.4	S76 L100 R102	S76-D171 VanDerWaalsContact CB-OD2 3.22Å; S76-D171 WeakPolarHBondContact CB-OD2 3.24Å; S76-D171 PolarHBondContact OG-OD2 3.19Å; L100-D171 HydrophobicContact CB-CB 4.31Å; L100-D171 PolarHBondContact O-N 3.2Å; R102-D171 WeakPolarHBondContact CD-OD2 3.44Å; R102-D171 IonicContact CZ-OD1 3.74Å; R102-D171 IonicContact NE-OD1 3.82Å; R102-D171 PolarHBondContact NE-OD1 3.37Å; R102-D171 VanDerWaalsContact NE-OD1 3.11Å; R102-D171 IonicContact NE-OD2 3.65Å; R102-D171 IonicContact NH2-OD1 3.45Å
172	D	94.5	Very high	93.3	Very high	54 Å²	54	53.3 Å²	53.3	29%	0.289	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	153.8	178.2	-169.9	34	0	0	0	112.8	L100	L100-D172 HydrophobicContact CB-CB 4.32Å; L100-D172 HydrophobicContact CD1-CB 3.97Å; L100-D172 HydrophobicContact CG-CB 4.2Å; L100-D172 PolarHBondContact N-O 3.24Å
173	V	95.6	Very high	93	Very high	4 Å²	4	54.1 Å²	54.1	2%	0.024	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	123.4	176.5	-179.8	0	0	0	0	109.3	L97 R98 V99 I155 R156 L159 V170	L97-V173 HydrophobicContact CD1-CG1 3.4Å; L97-V173 VanDerWaalsContact CD1-CG1 3.4Å; L97-V173 HydrophobicContact CD2-CG1 3.62Å; L97-V173 HydrophobicContact CG-CG1 3.71Å; R98-V173 WeakPolarHBondContact O-CA 3.4Å; V99-V173 HydrophobicContact CG1-CG2 4.36Å; V99-V173 HydrophobicContact CG2-CG2 4.46Å; I155-V173 HydrophobicContact CB-CG1 4.42Å; I155-V173 HydrophobicContact CG2-CG1 3.83Å; R156-V173 HydrophobicContact CB-CB 4.04Å; R156-V173 HydrophobicContact CB-CG2 4.13Å; R156-V173 HydrophobicContact CG-CB 4.4Å; R156-V173 HydrophobicContact CG-CG2 4.14Å; L159-V173 HydrophobicContact CD2-CG2 3.7Å; V170-V173 HydrophobicContact CG1-CG2 3.55Å
174	S	93.9	Very high	92.7	Very high	25 Å²	25	56.3 Å²	56.3	18%	0.175	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	129.8	-179.8	62.8	0	0	0	0	110.9	R98 T176	R98-S174 PolarHBondContact N-O 3.36Å; R98-S174 PolarHBondContact NE-OG 3.15Å; R98-S174 VanDerWaalsContact NE-OG 3.13Å; R98-S174 PolarHBondContact NH2-OG 3.28Å; R98-S174 PolarHBondContact O-N 3.15Å; S174-T176 PolarHBondContact O-N 3.23Å
175	I	94.8	Very high	92.4	Very high	9 Å²	9	54.8 Å²	54.8	5%	0.046	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	125.3	167.7	-58.7	166.3	0	0	0	107.3	L95 L97 R148 V151 S152 I155	L95-I175 HydrophobicContact CD1-CB 4.48Å; L95-I175 HydrophobicContact CD1-CD1 4.3Å; L95-I175 HydrophobicContact CD1-CG1 4.33Å; L95-I175 HydrophobicContact CD1-CG2 3.34Å; L95-I175 HydrophobicContact CD2-CD1 4.34Å; L95-I175 HydrophobicContact CD2-CG1 4.27Å; L95-I175 HydrophobicContact CG-CG2 4.03Å; L97-I175 HydrophobicContact CD1-CG1 3.9Å; R148-I175 HydrophobicContact CG-CB 4.14Å; R148-I175 HydrophobicContact CG-CD1 3.92Å; R148-I175 HydrophobicContact CG-CG2 4.49Å; R148-I175 PolarHBondContact NE-O 3.35Å; R148-I175 PolarHBondContact NH2-O 3.08Å; V151-I175 HydrophobicContact CB-CD1 4.46Å; V151-I175 HydrophobicContact CG1-CD1 4.19Å; S152-I175 WeakPolarHBondContact OG-CG1 3.43Å; I155-I175 HydrophobicContact CD1-CD1 4.49Å
176	T	93	Very high	92.3	Very high	45 Å²	45	52 Å²	52	28%	0.276	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	-47.6	-179.6	-56.4	0	0	0	0	112.1	T96 R98 R148 S174	T96-T176 PolarHBondContact O-N 2.98Å; R98-T176 WeakPolarHBondContact CB-OG1 3.2Å; R148-T176 PolarHBondContact NH2-O 2.89Å; S174-T176 PolarHBondContact O-N 3.23Å
177	D	92.9	Very high	92.1	Very high	81 Å²	81	51 Å²	51	43%	0.433	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	144.4	177.9	-55	-60.5	0	0	0	109.9	T96	T96-D177 PolarHBondContact N-O 3.03Å; T96-D177 PolarHBondContact O-N 3.03Å
178	L	91.3	Very high	91.8	Very high	36 Å²	36	52 Å²	52	19%	0.188	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	116.5	175.6	-170.3	157.3	0	0	0	107.6	V93 L95 L144 F180	V93-L178 HydrophobicContact CG1-CD1 4.27Å; V93-L178 HydrophobicContact CG1-CD2 3.77Å; V93-L178 HydrophobicContact CG1-CG 3.75Å; L95-L178 HydrophobicContact CD1-CB 3.99Å; L95-L178 HydrophobicContact CD1-CD1 3.63Å; L95-L178 HydrophobicContact CD1-CG 3.75Å; L144-L178 HydrophobicContact CB-CD1 3.63Å; L144-L178 HydrophobicContact CD1-CD1 4.47Å; L178-F180 HydrophobicContact CD2-CD1 4.27Å; L178-F180 HydrophobicContact CD2-CD2 3.73Å; L178-F180 HydrophobicContact CD2-CE1 3.72Å; L178-F180 HydrophobicContact CD2-CE2 3.12Å; L178-F180 HydrophobicContact CD2-CG 4.27Å; L178-F180 HydrophobicContact CD2-CZ 3.13Å; L178-F180 HydrophobicContact CG-CZ 4.46Å
179	T	92	Very high	91.6	Very high	77 Å²	77	57.9 Å²	57.9	47%	0.472	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	133.4	178.6	55.1	0	0	0	0	110.1	N94	N94-T179 WeakPolarHBondContact CB-OG1 3.41Å; N94-T179 PolarHBondContact N-O 3.45Å; N94-T179 PolarHBondContact O-N 3.02Å; N94-T179 PolarHBondContact O-OG1 2.97Å
180	F	89.6	Confident	91.6	Very high	29 Å²	29	58 Å²	58	13%	0.127	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	169.6	175	-60.5	-79.6	0	0	0	110.3	V93 A141 I145 L178 Y184	V93-F180 HydrophobicContact CG1-CD1 4.3Å; V93-F180 HydrophobicContact CG1-CE1 4.16Å; V93-F180 HydrophobicContact CG2-CD1 3.82Å; V93-F180 HydrophobicContact CG2-CE1 3.77Å; A141-F180 HydrophobicContact CB-CD1 4.1Å; A141-F180 HydrophobicContact CB-CE1 3.5Å; A141-F180 VanDerWaalsContact CB-CE1 3.5Å; A141-F180 HydrophobicContact CB-CZ 4.28Å; A141-F180 WeakPolarHBondContact O-CZ 3.23Å; I145-F180 HydrophobicContact CD1-CE2 3.46Å; I145-F180 VanDerWaalsContact CD1-CE2 3.46Å; I145-F180 HydrophobicContact CD1-CZ 3.74Å; I145-F180 HydrophobicContact CG1-CE2 3.53Å; I145-F180 HydrophobicContact CG1-CZ 3.52Å; L178-F180 HydrophobicContact CD2-CD1 4.27Å; L178-F180 HydrophobicContact CD2-CD2 3.73Å; L178-F180 HydrophobicContact CD2-CE1 3.72Å; L178-F180 HydrophobicContact CD2-CE2 3.12Å; L178-F180 HydrophobicContact CD2-CG 4.27Å; L178-F180 HydrophobicContact CD2-CZ 3.13Å; L178-F180 HydrophobicContact CG-CZ 4.46Å; F180-Y184 HydrophobicContact CB-CD1 3.79Å; F180-Y184 HydrophobicContact CD1-CD1 4.02Å; F180-Y184 HydrophobicContact CD1-CE1 4.07Å; F180-Y184 HydrophobicContact CD2-CD1 4.45Å; F180-Y184 HydrophobicContact CE1-CE1 4.39Å; F180-Y184 AromaticContact CG-CD1 3.84Å; F180-Y184 HydrophobicContact CG-CD1 3.84Å; F180-Y184 HydrophobicContact CG-CE1 4.15Å
181	S	86.8	Confident	91.4	Very high	46 Å²	46	64.3 Å²	64.3	32%	0.322	37%	0.367	S	S	.	.			trans	-56.5	147.3	167.6	73	0	0	0	0	110.6	V183 Y184 S185	S181-V183 VanDerWaalsContact C-N 3.25Å; S181-V183 PolarHBondContact O-N 3.35Å; S181-Y184 PolarHBondContact O-N 2.93Å; S181-Y184 VanDerWaalsContact OG-CB 3.24Å; S181-Y184 WeakPolarHBondContact OG-CB 3.34Å; S181-Y184 PolarHBondContact OG-N 3.22Å; S181-S185 PolarHBondContact O-N 2.9Å; S181-S185 PolarHBondContact O-OG 3.47Å
182	Q	88.2	Confident	91.4	Very high	161 Å²	161	66.9 Å²	66.9	75%	0.752	38%	0.377	S	S	*	.	H	α-helix	trans	-61	-37.7	-179.8	-67.8	-64.9	-14.9	0	0	111.6	S185 A186	Q182-S185 PolarHBondContact O-N 3.47Å; Q182-A186 WeakPolarHBondContact O-CB 3.42Å; Q182-A186 PolarHBondContact O-N 3Å
183	V	89.1	Confident	91.4	Very high	121 Å²	121	68 Å²	68	73%	0.733	38%	0.382	S	S	*	.	H	α-helix	trans	-63.5	-43.1	177.6	-177.1	0	0	0	0	111.4	S181 A187	S181-V183 VanDerWaalsContact C-N 3.25Å; S181-V183 PolarHBondContact O-N 3.35Å; V183-A187 WeakPolarHBondContact O-CB 3.36Å; V183-A187 PolarHBondContact O-N 3.01Å
184	Y	88.2	Confident	91.5	Very high	46 Å²	46	70.4 Å²	70.4	18%	0.18	40%	0.402	C	S	.	.	H	α-helix	trans	-65.6	-45	177.2	-178	-94.5	0	0	0	111.5	Q91 A141 F180 S181 A186 A187 V188	Q91-Y184 HydrophobicContact CG-CD2 4.06Å; Q91-Y184 HydrophobicContact CG-CE2 4.15Å; A141-Y184 HydrophobicContact CB-CE1 4.09Å; A141-Y184 HydrophobicContact CB-CE2 4.41Å; A141-Y184 WeakPolarHBondContact CB-OH 3.46Å; F180-Y184 HydrophobicContact CB-CD1 3.79Å; F180-Y184 HydrophobicContact CD1-CD1 4.02Å; F180-Y184 HydrophobicContact CD1-CE1 4.07Å; F180-Y184 HydrophobicContact CD2-CD1 4.45Å; F180-Y184 HydrophobicContact CE1-CE1 4.39Å; F180-Y184 AromaticContact CG-CD1 3.84Å; F180-Y184 HydrophobicContact CG-CD1 3.84Å; F180-Y184 HydrophobicContact CG-CE1 4.15Å; S181-Y184 PolarHBondContact O-N 2.93Å; S181-Y184 VanDerWaalsContact OG-CB 3.24Å; S181-Y184 WeakPolarHBondContact OG-CB 3.34Å; S181-Y184 PolarHBondContact OG-N 3.22Å; Y184-A186 PolarHBondContact O-N 3.24Å; Y184-A187 PolarHBondContact O-N 3.41Å; Y184-V188 HydrophobicContact CD1-CG2 4Å; Y184-V188 HydrophobicContact CE1-CG2 3.6Å; Y184-V188 HydrophobicContact CE2-CG2 4.27Å; Y184-V188 HydrophobicContact CG-CG2 4.5Å; Y184-V188 WeakPolarHBondContact O-CG2 3.43Å; Y184-V188 PolarHBondContact O-N 3.23Å
185	S	88.3	Confident	91.5	Very high	43 Å²	43	73.2 Å²	73.2	30%	0.301	42%	0.415	S	S	.	.	H	α-helix	trans	-60.7	-46.1	179.7	-54.8	0	0	0	0	111.3	S181 Q182 A187 V188 E189	S181-S185 PolarHBondContact O-N 2.9Å; S181-S185 PolarHBondContact O-OG 3.47Å; Q182-S185 PolarHBondContact O-N 3.47Å; S185-A187 PolarHBondContact O-N 2.51Å; S185-V188 PolarHBondContact O-N 2.78Å; S185-E189 WeakPolarHBondContact O-CB 3.42Å; S185-E189 PolarHBondContact O-N 3.02Å
186	A	91.7	Very high	91.6	Very high	54 Å²	54	76.9 Å²	76.9	45%	0.446	43%	0.432	S	S	.	.	H	α-helix	trans	-62.6	-40.5	175.8	0	0	0	0	0	112.5	Q182 Y184 E189 A190	Q182-A186 WeakPolarHBondContact O-CB 3.42Å; Q182-A186 PolarHBondContact O-N 3Å; Y184-A186 PolarHBondContact O-N 3.24Å; A186-E189 PolarHBondContact O-N 3.31Å; A186-A190 VanDerWaalsContact O-CB 3.31Å; A186-A190 WeakPolarHBondContact O-CB 3.39Å; A186-A190 PolarHBondContact O-N 3.24Å
187	A	90	Very high	91.8	Very high	59 Å²	59	80.4 Å²	80.4	49%	0.488	45%	0.445	S	S	.	.	H	α-helix	trans	-66.7	-39.1	178	0	0	0	0	0	112.6	V183 Y184 S185 K191	V183-A187 WeakPolarHBondContact O-CB 3.36Å; V183-A187 PolarHBondContact O-N 3.01Å; Y184-A187 PolarHBondContact O-N 3.41Å; S185-A187 PolarHBondContact O-N 2.51Å; A187-K191 WeakPolarHBondContact O-CB 3.49Å; A187-K191 PolarHBondContact O-N 3.11Å
188	V	88.1	Confident	92	Very high	68 Å²	68	78.8 Å²	78.8	41%	0.412	44%	0.443	S	S	.	.	H	α-helix	trans	-66.8	-43.7	175.7	171.2	0	0	0	0	110.7	Y184 S185 K191 Q192	Y184-V188 HydrophobicContact CD1-CG2 4Å; Y184-V188 HydrophobicContact CE1-CG2 3.6Å; Y184-V188 HydrophobicContact CE2-CG2 4.27Å; Y184-V188 HydrophobicContact CG-CG2 4.5Å; Y184-V188 WeakPolarHBondContact O-CG2 3.43Å; Y184-V188 PolarHBondContact O-N 3.23Å; S185-V188 PolarHBondContact O-N 2.78Å; V188-K191 PolarHBondContact O-N 3.38Å; V188-Q192 WeakPolarHBondContact O-CB 3.31Å; V188-Q192 PolarHBondContact O-N 2.92Å
189	E	90.4	Very high	92.3	Very high	128 Å²	128	83.1 Å²	83.1	60%	0.598	46%	0.462	S	S	*	.	H	α-helix	trans	-61.9	-47.6	176.5	-173.9	173.6	-165.5	0	0	111.4	S185 A186 K191 Q192 I193	S185-E189 WeakPolarHBondContact O-CB 3.42Å; S185-E189 PolarHBondContact O-N 3.02Å; A186-E189 PolarHBondContact O-N 3.31Å; E189-K191 VanDerWaalsContact C-N 3.34Å; E189-K191 PolarHBondContact O-N 3.42Å; E189-Q192 WeakPolarHBondContact O-CB 3.45Å; E189-Q192 PolarHBondContact O-N 2.9Å; E189-Q192 VanDerWaalsContact O-N 3.11Å; E189-I193 HydrophobicContact CG-CD1 4.04Å; E189-I193 VanDerWaalsContact O-CG1 3.31Å; E189-I193 WeakPolarHBondContact O-CG1 3.37Å; E189-I193 PolarHBondContact O-N 3Å
190	A	95.2	Very high	92.5	Very high	57 Å²	57	86.8 Å²	86.8	47%	0.471	47%	0.467	S	S	.	.	H	α-helix	trans	-59.5	-42.4	176.3	0	0	0	0	0	112.4	A186 Q192 I193 A194	A186-A190 VanDerWaalsContact O-CB 3.31Å; A186-A190 WeakPolarHBondContact O-CB 3.39Å; A186-A190 PolarHBondContact O-N 3.24Å; A190-Q192 VanDerWaalsContact C-N 3.34Å; A190-Q192 PolarHBondContact O-N 2.97Å; A190-I193 PolarHBondContact O-N 2.88Å; A190-A194 WeakPolarHBondContact O-CB 3.49Å; A190-A194 PolarHBondContact O-N 3.49Å
191	K	92.6	Very high	92.9	Very high	146 Å²	146	88 Å²	88	64%	0.635	48%	0.483	S	S	*	.	H	α-helix	trans	-63.3	-40.3	175.1	-175.5	178.9	179.8	179.1	0	111.7	A187 V188 E189 A194 L195	A187-K191 WeakPolarHBondContact O-CB 3.49Å; A187-K191 PolarHBondContact O-N 3.11Å; V188-K191 PolarHBondContact O-N 3.38Å; E189-K191 VanDerWaalsContact C-N 3.34Å; E189-K191 PolarHBondContact O-N 3.42Å; K191-A194 PolarHBondContact O-N 3.38Å; K191-L195 HydrophobicContact CG-CD1 4.22Å; K191-L195 WeakPolarHBondContact O-CB 3.47Å; K191-L195 VanDerWaalsContact O-CG 3.3Å; K191-L195 WeakPolarHBondContact O-CG 3.41Å; K191-L195 PolarHBondContact O-N 3.1Å
192	Q	92.8	Very high	93.4	Very high	115 Å²	115	92 Å²	92	54%	0.537	50%	0.496	S	S	.	.	H	α-helix	trans	-66.8	-40.9	178.9	-173.2	62.1	24.8	0	0	111.6	V188 E189 A190 L195 Q196	V188-Q192 WeakPolarHBondContact O-CB 3.31Å; V188-Q192 PolarHBondContact O-N 2.92Å; E189-Q192 WeakPolarHBondContact O-CB 3.45Å; E189-Q192 PolarHBondContact O-N 2.9Å; E189-Q192 VanDerWaalsContact O-N 3.11Å; A190-Q192 VanDerWaalsContact C-N 3.34Å; A190-Q192 PolarHBondContact O-N 2.97Å; Q192-L195 PolarHBondContact O-N 3.36Å; Q192-Q196 WeakPolarHBondContact O-CB 3.41Å; Q192-Q196 PolarHBondContact O-N 2.84Å
193	I	95.8	Very high	93.8	Very high	78 Å²	78	91.1 Å²	91.1	40%	0.4	49%	0.49	S	S	.	.	H	α-helix	trans	-60.9	-50.1	174.1	-66.9	164.9	0	0	0	109.8	E189 A190 L195 Q196 E197	E189-I193 HydrophobicContact CG-CD1 4.04Å; E189-I193 VanDerWaalsContact O-CG1 3.31Å; E189-I193 WeakPolarHBondContact O-CG1 3.37Å; E189-I193 PolarHBondContact O-N 3Å; A190-I193 PolarHBondContact O-N 2.88Å; I193-L195 VanDerWaalsContact C-N 3.33Å; I193-L195 PolarHBondContact O-N 3.41Å; I193-Q196 PolarHBondContact O-N 3.35Å; I193-Q196 VanDerWaalsContact O-N 3.1Å; I193-E197 HydrophobicContact CG2-CG 4.38Å; I193-E197 WeakPolarHBondContact O-CG 3.45Å; I193-E197 PolarHBondContact O-N 3.44Å
194	A	96	Very high	94.2	Very high	54 Å²	54	91 Å²	91	45%	0.446	48%	0.484	S	S	.	.	H	α-helix	trans	-60.2	-40.1	178.9	0	0	0	0	0	112.7	A190 K191 E197 A198	A190-A194 WeakPolarHBondContact O-CB 3.49Å; A190-A194 PolarHBondContact O-N 3.49Å; K191-A194 PolarHBondContact O-N 3.38Å; A194-E197 PolarHBondContact O-N 3.34Å; A194-A198 WeakPolarHBondContact O-CB 3.28Å; A194-A198 PolarHBondContact O-N 2.94Å
195	L	95.7	Very high	94.6	Very high	85 Å²	85	92.3 Å²	92.3	45%	0.445	50%	0.498	S	S	.	.	H	α-helix	trans	-64.9	-40.9	174.5	-75.8	171.2	0	0	0	112	K191 Q192 I193 A198 Q199	K191-L195 HydrophobicContact CG-CD1 4.22Å; K191-L195 WeakPolarHBondContact O-CB 3.47Å; K191-L195 VanDerWaalsContact O-CG 3.3Å; K191-L195 WeakPolarHBondContact O-CG 3.41Å; K191-L195 PolarHBondContact O-N 3.1Å; Q192-L195 PolarHBondContact O-N 3.36Å; I193-L195 VanDerWaalsContact C-N 3.33Å; I193-L195 PolarHBondContact O-N 3.41Å; L195-A198 PolarHBondContact O-N 3.45Å; L195-Q199 WeakPolarHBondContact O-CB 3.39Å; L195-Q199 WeakPolarHBondContact O-CG 3.49Å; L195-Q199 PolarHBondContact O-N 3.23Å
196	Q	95.8	Very high	95	Very high	86 Å²	86	94.7 Å²	94.7	40%	0.402	50%	0.504	S	S	.	.	H	α-helix	trans	-67.5	-39.4	177.3	-169.9	176.9	20.4	0	0	111.6	Q192 I193 Q199 R200	Q192-Q196 WeakPolarHBondContact O-CB 3.41Å; Q192-Q196 PolarHBondContact O-N 2.84Å; I193-Q196 PolarHBondContact O-N 3.35Å; I193-Q196 VanDerWaalsContact O-N 3.1Å; Q196-Q199 PolarHBondContact O-N 2.94Å; Q196-R200 VanDerWaalsContact NE2-NH2 3.14Å; Q196-R200 WeakPolarHBondContact O-CB 3.4Å; Q196-R200 VanDerWaalsContact O-CG 3.28Å; Q196-R200 WeakPolarHBondContact O-CG 3.3Å; Q196-R200 PolarHBondContact O-N 2.94Å
197	E	96.8	Very high	95.3	Very high	119 Å²	119	98.9 Å²	98.9	56%	0.556	51%	0.508	S	S	*	.	H	α-helix	trans	-63.4	-44.7	174.2	-74.1	178.5	174.8	0	0	111.6	I193 A194 Q199 R200 A201	I193-E197 HydrophobicContact CG2-CG 4.38Å; I193-E197 WeakPolarHBondContact O-CG 3.45Å; I193-E197 PolarHBondContact O-N 3.44Å; A194-E197 PolarHBondContact O-N 3.34Å; E197-Q199 PolarHBondContact O-N 2.87Å; E197-R200 PolarHBondContact O-N 3.46Å; E197-A201 WeakPolarHBondContact O-CB 3.3Å; E197-A201 PolarHBondContact O-N 2.86Å
198	A	96.9	Very high	95.6	Very high	46 Å²	46	98.4 Å²	98.4	38%	0.38	50%	0.504	S	S	.	.	H	α-helix	trans	-60.8	-43.3	174.6	0	0	0	0	0	111.8	A194 L195 A201 Q202	A194-A198 WeakPolarHBondContact O-CB 3.28Å; A194-A198 PolarHBondContact O-N 2.94Å; L195-A198 PolarHBondContact O-N 3.45Å; A198-A201 PolarHBondContact O-N 2.92Å; A198-Q202 VanDerWaalsContact O-CG 3.3Å; A198-Q202 WeakPolarHBondContact O-CG 3.42Å; A198-Q202 PolarHBondContact O-N 2.89Å
199	Q	97.6	Very high	96.1	Very high	127 Å²	127	100.4 Å²	100.4	59%	0.593	51%	0.507	S	S	*	.	H	α-helix	trans	-62.6	-41.9	174.6	-77.2	178.4	-6.2	0	0	112.3	L195 Q196 E197 Q202 F203	L195-Q199 WeakPolarHBondContact O-CB 3.39Å; L195-Q199 WeakPolarHBondContact O-CG 3.49Å; L195-Q199 PolarHBondContact O-N 3.23Å; Q196-Q199 PolarHBondContact O-N 2.94Å; E197-Q199 PolarHBondContact O-N 2.87Å; Q199-Q202 PolarHBondContact O-N 3.37Å; Q199-F203 WeakPolarHBondContact O-CB 3.35Å; Q199-F203 PolarHBondContact O-N 2.95Å
200	R	97.3	Very high	96.4	Very high	154 Å²	154	100.6 Å²	100.6	58%	0.581	51%	0.508	S	S	*	.	H	α-helix	trans	-63.5	-42.3	175.6	-74.9	174.9	-175.9	175	5.7	111.7	Q196 E197 F203 L204	Q196-R200 VanDerWaalsContact NE2-NH2 3.14Å; Q196-R200 WeakPolarHBondContact O-CB 3.4Å; Q196-R200 VanDerWaalsContact O-CG 3.28Å; Q196-R200 WeakPolarHBondContact O-CG 3.3Å; Q196-R200 PolarHBondContact O-N 2.94Å; E197-R200 PolarHBondContact O-N 3.46Å; R200-F203 PolarHBondContact O-N 3.45Å; R200-L204 WeakPolarHBondContact O-CB 3.43Å; R200-L204 PolarHBondContact O-N 3.35Å
201	A	96.9	Very high	96.4	Very high	55 Å²	55	101.4 Å²	101.4	46%	0.455	50%	0.502	S	S	.	.	H	α-helix	trans	-63.6	-43	176.3	0	0	0	0	0	111.4	E197 A198 L204 V205	E197-A201 WeakPolarHBondContact O-CB 3.3Å; E197-A201 PolarHBondContact O-N 2.86Å; A198-A201 PolarHBondContact O-N 2.92Å; A201-L204 PolarHBondContact O-N 3.23Å; A201-V205 WeakPolarHBondContact O-CG2 3.25Å; A201-V205 PolarHBondContact O-N 3.4Å
202	Q	97	Very high	96.7	Very high	130 Å²	130	102.7 Å²	102.7	61%	0.607	50%	0.503	S	S	*	.	H	α-helix	trans	-61.2	-46	173.7	-73.2	174.4	6.6	0	0	111.7	A198 Q199 L204 V205 E206	A198-Q202 VanDerWaalsContact O-CG 3.3Å; A198-Q202 WeakPolarHBondContact O-CG 3.42Å; A198-Q202 PolarHBondContact O-N 2.89Å; Q199-Q202 PolarHBondContact O-N 3.37Å; Q202-L204 VanDerWaalsContact C-N 3.3Å; Q202-L204 PolarHBondContact O-N 2.89Å; Q202-V205 PolarHBondContact O-N 2.86Å; Q202-E206 PolarHBondContact O-N 3.42Å
203	F	97.3	Very high	96.8	Very high	143 Å²	143	102.4 Å²	102.4	63%	0.627	50%	0.502	S	S	*	.	H	α-helix	trans	-61.4	-38.6	176.8	-177.7	-99.9	0	0	0	112.1	Q199 R200 E206 R207	Q199-F203 WeakPolarHBondContact O-CB 3.35Å; Q199-F203 PolarHBondContact O-N 2.95Å; R200-F203 PolarHBondContact O-N 3.45Å; F203-E206 PolarHBondContact O-N 2.83Å; F203-R207 VanDerWaalsContact O-CB 3.25Å; F203-R207 WeakPolarHBondContact O-CB 3.42Å; F203-R207 PolarHBondContact O-N 3.02Å
204	L	97.4	Very high	96.9	Very high	117 Å²	117	105 Å²	105	61%	0.613	51%	0.512	S	S	*	.	H	α-helix	trans	-64.7	-42.8	175.9	-172.4	153.1	0	0	0	111.7	R200 A201 Q202 R207 A208	R200-L204 WeakPolarHBondContact O-CB 3.43Å; R200-L204 PolarHBondContact O-N 3.35Å; A201-L204 PolarHBondContact O-N 3.23Å; Q202-L204 VanDerWaalsContact C-N 3.3Å; Q202-L204 PolarHBondContact O-N 2.89Å; L204-R207 PolarHBondContact O-N 3.47Å; L204-A208 WeakPolarHBondContact O-CB 3.35Å; L204-A208 PolarHBondContact O-N 3.31Å
205	V	96.7	Very high	96.9	Very high	75 Å²	75	109.6 Å²	109.6	46%	0.455	52%	0.522	S	S	.	.	H	α-helix	trans	-65.6	-44.4	176.6	171.9	0	0	0	0	111.3	A201 Q202 A208 K209	A201-V205 WeakPolarHBondContact O-CG2 3.25Å; A201-V205 PolarHBondContact O-N 3.4Å; Q202-V205 PolarHBondContact O-N 2.86Å; V205-A208 PolarHBondContact O-N 3.47Å; V205-K209 WeakPolarHBondContact O-CG 3.39Å; V205-K209 PolarHBondContact O-N 2.91Å
206	E	97.2	Very high	97	Very high	93 Å²	93	108.8 Å²	108.8	44%	0.435	52%	0.518	S	S	.	.	H	α-helix	trans	-60.4	-46.8	174.9	-78.6	-63.5	129.5	0	0	111.4	Q202 F203 A208 K209 Q210	Q202-E206 PolarHBondContact O-N 3.42Å; F203-E206 PolarHBondContact O-N 2.83Å; E206-A208 VanDerWaalsContact C-N 3.33Å; E206-A208 PolarHBondContact O-N 2.95Å; E206-K209 WeakPolarHBondContact O-CB 3.39Å; E206-K209 PolarHBondContact O-N 3.18Å; E206-K209 IonicContact OE1-NZ 3.75Å; E206-K209 PolarHBondContact OE1-NZ 2.9Å; E206-Q210 WeakPolarHBondContact O-CG 3.35Å; E206-Q210 PolarHBondContact O-N 3.48Å
207	R	97.7	Very high	97	Very high	142 Å²	142	108.5 Å²	108.5	54%	0.536	52%	0.522	S	S	.	.	H	α-helix	trans	-58.1	-44.9	174.3	-179.9	178.3	173.6	164.5	2.9	111.6	F203 L204 K209 Q210 E211	F203-R207 VanDerWaalsContact O-CB 3.25Å; F203-R207 WeakPolarHBondContact O-CB 3.42Å; F203-R207 PolarHBondContact O-N 3.02Å; L204-R207 PolarHBondContact O-N 3.47Å; R207-K209 VanDerWaalsContact C-N 3.32Å; R207-K209 PolarHBondContact O-N 3.41Å; R207-Q210 PolarHBondContact O-N 3.12Å; R207-E211 HydrophobicContact CG-CG 4.35Å; R207-E211 IonicContact CZ-OE1 2.73Å; R207-E211 IonicContact NE-OE1 3.59Å; R207-E211 PolarHBondContact NE-OE1 2.75Å; R207-E211 IonicContact NH2-OE1 3.97Å; R207-E211 PolarHBondContact NH2-OE1 3.24Å; R207-E211 WeakPolarHBondContact O-CB 3.37Å; R207-E211 WeakPolarHBondContact O-CG 3.44Å; R207-E211 PolarHBondContact O-N 3.41Å
208	A	97	Very high	97	Very high	49 Å²	49	106.2 Å²	106.2	41%	0.405	52%	0.516	S	S	.	.	H	α-helix	trans	-63.9	-35.3	178.1	0	0	0	0	0	112.6	L204 V205 E206 R212	L204-A208 WeakPolarHBondContact O-CB 3.35Å; L204-A208 PolarHBondContact O-N 3.31Å; V205-A208 PolarHBondContact O-N 3.47Å; E206-A208 VanDerWaalsContact C-N 3.33Å; E206-A208 PolarHBondContact O-N 2.95Å; A208-R212 WeakPolarHBondContact O-CB 3.45Å; A208-R212 PolarHBondContact O-N 3.28Å
209	K	97.4	Very high	96.9	Very high	109 Å²	109	106.6 Å²	106.6	47%	0.474	52%	0.519	S	S	.	.	H	α-helix	trans	-66.5	-46.2	172.3	-70.7	173.6	-173.1	168.9	0	111.5	V205 E206 R207 R212 Q213	V205-K209 WeakPolarHBondContact O-CG 3.39Å; V205-K209 PolarHBondContact O-N 2.91Å; E206-K209 WeakPolarHBondContact O-CB 3.39Å; E206-K209 PolarHBondContact O-N 3.18Å; E206-K209 IonicContact OE1-NZ 3.75Å; E206-K209 PolarHBondContact OE1-NZ 2.9Å; R207-K209 VanDerWaalsContact C-N 3.32Å; R207-K209 PolarHBondContact O-N 3.41Å; K209-R212 PolarHBondContact O-N 3.24Å; K209-Q213 PolarHBondContact O-N 2.91Å
210	Q	96.7	Very high	96.9	Very high	133 Å²	133	106.3 Å²	106.3	62%	0.621	52%	0.517	S	S	*	.	H	α-helix	trans	-61.9	-44.9	177.6	-71.9	-177.3	-11.4	0	0	111.6	E206 R207 R212 Q213 Q214	E206-Q210 WeakPolarHBondContact O-CG 3.35Å; E206-Q210 PolarHBondContact O-N 3.48Å; R207-Q210 PolarHBondContact O-N 3.12Å; Q210-R212 VanDerWaalsContact C-N 3.34Å; Q210-R212 PolarHBondContact O-N 3.17Å; Q210-Q213 PolarHBondContact O-N 2.96Å; Q210-Q214 WeakPolarHBondContact O-CB 3.39Å; Q210-Q214 PolarHBondContact O-N 3.05Å
211	E	96.7	Very high	96.8	Very high	74 Å²	74	100.7 Å²	100.7	35%	0.346	51%	0.508	S	S	.	.	H	α-helix	trans	-63.2	-38.4	176.3	-74.3	179.6	-173.2	0	0	112	R207 K215	R207-E211 HydrophobicContact CG-CG 4.35Å; R207-E211 IonicContact CZ-OE1 2.73Å; R207-E211 IonicContact NE-OE1 3.59Å; R207-E211 PolarHBondContact NE-OE1 2.75Å; R207-E211 IonicContact NH2-OE1 3.97Å; R207-E211 PolarHBondContact NH2-OE1 3.24Å; R207-E211 WeakPolarHBondContact O-CB 3.37Å; R207-E211 WeakPolarHBondContact O-CG 3.44Å; R207-E211 PolarHBondContact O-N 3.41Å; E211-K215 WeakPolarHBondContact O-CG 3.37Å; E211-K215 PolarHBondContact O-N 2.9Å
212	R	97	Very high	96.7	Very high	173 Å²	173	104.3 Å²	104.3	65%	0.653	52%	0.515	S	S	*	.	H	α-helix	trans	-63.1	-48.1	172.8	179.7	-176.2	-67.9	159	-1.2	111.1	A208 K209 Q210 Q214 K215 I216	A208-R212 WeakPolarHBondContact O-CB 3.45Å; A208-R212 PolarHBondContact O-N 3.28Å; K209-R212 PolarHBondContact O-N 3.24Å; Q210-R212 VanDerWaalsContact C-N 3.34Å; Q210-R212 PolarHBondContact O-N 3.17Å; R212-Q214 VanDerWaalsContact C-N 3.31Å; R212-Q214 PolarHBondContact O-N 3.31Å; R212-K215 PolarHBondContact O-N 3.43Å; R212-I216 HydrophobicContact CG-CD1 4.01Å; R212-I216 WeakPolarHBondContact O-CG1 3.33Å; R212-I216 PolarHBondContact O-N 2.87Å
213	Q	96.5	Very high	96.6	Very high	109 Å²	109	100.5 Å²	100.5	51%	0.509	51%	0.506	S	S	.	.	H	α-helix	trans	-62	-42.2	179.6	-172.3	60.5	36.9	0	0	111	K209 Q210 K215 I216 V217	K209-Q213 PolarHBondContact O-N 2.91Å; Q210-Q213 PolarHBondContact O-N 2.96Å; Q213-K215 VanDerWaalsContact C-N 3.34Å; Q213-K215 PolarHBondContact O-N 3.49Å; Q213-I216 PolarHBondContact O-N 3.23Å; Q213-V217 HydrophobicContact CG-CG2 4.39Å; Q213-V217 WeakPolarHBondContact O-CG2 3.38Å; Q213-V217 PolarHBondContact O-N 3.38Å
214	Q	96.7	Very high	96.4	Very high	131 Å²	131	99.8 Å²	99.8	61%	0.612	51%	0.505	S	S	*	.	H	α-helix	trans	-57.8	-46.5	175.1	-173.3	179.1	10.9	0	0	111.1	Q210 R212 I216 V217 T218	Q210-Q214 WeakPolarHBondContact O-CB 3.39Å; Q210-Q214 PolarHBondContact O-N 3.05Å; R212-Q214 VanDerWaalsContact C-N 3.31Å; R212-Q214 PolarHBondContact O-N 3.31Å; Q214-I216 PolarHBondContact O-N 2.92Å; Q214-V217 PolarHBondContact O-N 2.96Å; Q214-T218 WeakPolarHBondContact O-CB 3.46Å; Q214-T218 PolarHBondContact O-N 3.26Å; Q214-T218 PolarHBondContact O-OG1 3.04Å
215	K	97	Very high	96.2	Very high	151 Å²	151	96.3 Å²	96.3	66%	0.657	49%	0.493	S	S	*	.	H	α-helix	trans	-62.2	-40.2	177.1	-73.5	173.9	-177.5	177.2	0	113	E211 R212 Q213 A219	E211-K215 WeakPolarHBondContact O-CG 3.37Å; E211-K215 PolarHBondContact O-N 2.9Å; R212-K215 PolarHBondContact O-N 3.43Å; Q213-K215 VanDerWaalsContact C-N 3.34Å; Q213-K215 PolarHBondContact O-N 3.49Å; K215-A219 VanDerWaalsContact O-CB 3.29Å; K215-A219 WeakPolarHBondContact O-CB 3.27Å; K215-A219 PolarHBondContact O-N 3.44Å
216	I	97.4	Very high	96	Very high	69 Å²	69	95.7 Å²	95.7	35%	0.354	50%	0.495	S	S	.	.	H	α-helix	trans	-64.3	-49.9	176.6	-66.9	167	0	0	0	110.1	R212 Q213 Q214 T218 A219 E220	R212-I216 HydrophobicContact CG-CD1 4.01Å; R212-I216 WeakPolarHBondContact O-CG1 3.33Å; R212-I216 PolarHBondContact O-N 2.87Å; Q213-I216 PolarHBondContact O-N 3.23Å; Q214-I216 PolarHBondContact O-N 2.92Å; I216-T218 VanDerWaalsContact C-N 3.34Å; I216-T218 PolarHBondContact O-N 3.07Å; I216-A219 PolarHBondContact O-N 3.22Å; I216-E220 HydrophobicContact CG2-CG 4.27Å; I216-E220 WeakPolarHBondContact O-CB 3.46Å; I216-E220 WeakPolarHBondContact O-CG 3.28Å; I216-E220 PolarHBondContact O-N 2.83Å
217	V	96.6	Very high	95.7	Very high	80 Å²	80	98.5 Å²	98.5	49%	0.485	51%	0.506	S	S	.	.	H	α-helix	trans	-62.5	-40.2	179.7	173.7	0	0	0	0	111.5	Q213 Q214 G221	Q213-V217 HydrophobicContact CG-CG2 4.39Å; Q213-V217 WeakPolarHBondContact O-CG2 3.38Å; Q213-V217 PolarHBondContact O-N 3.38Å; Q214-V217 PolarHBondContact O-N 2.96Å; V217-G221 PolarHBondContact O-N 3.46Å
218	T	95.3	Very high	95.3	Very high	71 Å²	71	97 Å²	97	44%	0.436	51%	0.508	S	S	.	.	H	α-helix	trans	-64.2	-45.2	174.5	-58	0	0	0	0	111.4	Q214 I216 G221 E222	Q214-T218 WeakPolarHBondContact O-CB 3.46Å; Q214-T218 PolarHBondContact O-N 3.26Å; Q214-T218 PolarHBondContact O-OG1 3.04Å; I216-T218 VanDerWaalsContact C-N 3.34Å; I216-T218 PolarHBondContact O-N 3.07Å; T218-G221 PolarHBondContact O-N 2.84Å; T218-E222 WeakPolarHBondContact O-CB 3.3Å; T218-E222 WeakPolarHBondContact O-CG 3.3Å; T218-E222 PolarHBondContact O-N 3.45Å
219	A	95.9	Very high	94.8	Very high	54 Å²	54	98.1 Å²	98.1	45%	0.446	51%	0.507	S	S	.	.	H	α-helix	trans	-66.4	-40.6	178.8	0	0	0	0	0	112.8	K215 I216 E222 A223	K215-A219 VanDerWaalsContact O-CB 3.29Å; K215-A219 WeakPolarHBondContact O-CB 3.27Å; K215-A219 PolarHBondContact O-N 3.44Å; I216-A219 PolarHBondContact O-N 3.22Å; A219-E222 PolarHBondContact O-N 2.9Å; A219-A223 VanDerWaalsContact O-CB 3.3Å; A219-A223 WeakPolarHBondContact O-CB 3.39Å; A219-A223 PolarHBondContact O-N 3.3Å
220	E	96.1	Very high	94.3	Very high	120 Å²	120	94.6 Å²	94.6	56%	0.561	50%	0.501	S	S	*	.	H	α-helix	trans	-64.5	-43.5	173.4	-74.2	177.3	172.7	0	0	111.2	I216 E222 A223 Q224	I216-E220 HydrophobicContact CG2-CG 4.27Å; I216-E220 WeakPolarHBondContact O-CB 3.46Å; I216-E220 WeakPolarHBondContact O-CG 3.28Å; I216-E220 PolarHBondContact O-N 2.83Å; E220-E222 PolarHBondContact O-N 3.03Å; E220-A223 PolarHBondContact O-N 3.47Å; E220-Q224 WeakPolarHBondContact O-CB 3.25Å; E220-Q224 PolarHBondContact O-N 2.85Å
221	G	96.4	Very high	93.8	Very high	37 Å²	37	93.2 Å²	93.2	38%	0.381	50%	0.498	S	S	.	.	H	α-helix	trans	-60.1	-43.3	174.4	0	0	0	0	0	112.3	V217 T218 A225	V217-G221 PolarHBondContact O-N 3.46Å; T218-G221 PolarHBondContact O-N 2.84Å; G221-A225 WeakPolarHBondContact O-CB 3.34Å; G221-A225 PolarHBondContact O-N 3.24Å
222	E	94.2	Very high	93.3	Very high	130 Å²	130	92.5 Å²	92.5	61%	0.607	51%	0.505	S	S	*	.	H	α-helix	trans	-66	-42.8	174.4	-76.6	178.6	-176.8	0	0	112.2	T218 A219 E220 A225 A226	T218-E222 WeakPolarHBondContact O-CB 3.3Å; T218-E222 WeakPolarHBondContact O-CG 3.3Å; T218-E222 PolarHBondContact O-N 3.45Å; A219-E222 PolarHBondContact O-N 2.9Å; E220-E222 PolarHBondContact O-N 3.03Å; E222-A225 PolarHBondContact O-N 2.87Å; E222-A226 WeakPolarHBondContact O-CB 3.49Å; E222-A226 PolarHBondContact O-N 3.22Å
223	A	94.5	Very high	92.6	Very high	51 Å²	51	85.7 Å²	85.7	42%	0.421	48%	0.481	S	S	.	.	H	α-helix	trans	-65.2	-42	177.8	0	0	0	0	0	111.8	A219 E220 A226 K227	A219-A223 VanDerWaalsContact O-CB 3.3Å; A219-A223 WeakPolarHBondContact O-CB 3.39Å; A219-A223 PolarHBondContact O-N 3.3Å; E220-A223 PolarHBondContact O-N 3.47Å; A223-A226 PolarHBondContact O-N 2.88Å; A223-K227 WeakPolarHBondContact O-CG 3.44Å; A223-K227 PolarHBondContact O-N 2.86Å
224	Q	94.5	Very high	91.8	Very high	128 Å²	128	84.5 Å²	84.5	60%	0.598	49%	0.485	S	S	*	.	H	α-helix	trans	-68.9	-42.5	176.1	-170.8	174.3	9.9	0	0	111.3	E220 A226 K227 L228	E220-Q224 WeakPolarHBondContact O-CB 3.25Å; E220-Q224 PolarHBondContact O-N 2.85Å; Q224-A226 VanDerWaalsContact C-N 3.32Å; Q224-A226 PolarHBondContact O-N 3.48Å; Q224-K227 PolarHBondContact O-N 2.95Å; Q224-L228 HydrophobicContact CG-CD1 4.34Å; Q224-L228 WeakPolarHBondContact O-CB 3.43Å; Q224-L228 WeakPolarHBondContact O-CG 3.29Å; Q224-L228 PolarHBondContact O-N 3.39Å
225	A	93.3	Very high	91.1	Very high	43 Å²	43	85.7 Å²	85.7	36%	0.355	49%	0.49	S	S	.	.	H	α-helix	trans	-61.1	-41.5	173	0	0	0	0	0	111.4	G221 E222 L228 I229	G221-A225 WeakPolarHBondContact O-CB 3.34Å; G221-A225 PolarHBondContact O-N 3.24Å; E222-A225 PolarHBondContact O-N 2.87Å; A225-L228 PolarHBondContact O-N 3.46Å; A225-I229 VanDerWaalsContact O-CB 3.29Å; A225-I229 WeakPolarHBondContact O-CB 3.33Å; A225-I229 WeakPolarHBondContact O-CD1 3.45Å; A225-I229 WeakPolarHBondContact O-CG1 3.4Å; A225-I229 PolarHBondContact O-N 3.23Å
226	A	90.8	Very high	90.4	Very high	62 Å²	62	83.6 Å²	83.6	51%	0.512	49%	0.487	S	S	.	.	H	α-helix	trans	-64.6	-40.4	176.8	0	0	0	0	0	112.2	E222 A223 Q224 G230	E222-A226 WeakPolarHBondContact O-CB 3.49Å; E222-A226 PolarHBondContact O-N 3.22Å; A223-A226 PolarHBondContact O-N 2.88Å; Q224-A226 VanDerWaalsContact C-N 3.32Å; Q224-A226 PolarHBondContact O-N 3.48Å; A226-G230 PolarHBondContact O-N 3.14Å
227	K	91.7	Very high	89.4	Confident	152 Å²	152	81.9 Å²	81.9	66%	0.661	48%	0.48	S	S	*	.	H	α-helix	trans	-62.7	-51.1	173	-74.6	176.8	-178.6	-179.8	0	111.6	A223 Q224 I229 G230 D231	A223-K227 WeakPolarHBondContact O-CG 3.44Å; A223-K227 PolarHBondContact O-N 2.86Å; Q224-K227 PolarHBondContact O-N 2.95Å; K227-I229 PolarHBondContact O-N 2.96Å; K227-G230 CarbonylContact O-C 3.58Å; K227-G230 WeakPolarHBondContact O-CA 3.31Å; K227-G230 PolarHBondContact O-N 3.19Å; K227-G230 VanDerWaalsContact O-N 3.08Å; K227-D231 PolarHBondContact O-N 3.41Å
228	L	89.8	Confident	88.7	Confident	110 Å²	110	80.6 Å²	80.6	58%	0.576	48%	0.483	S	S	*	.	H	α-helix	trans	-61.3	-41.8	178.8	-72.1	173.5	0	0	0	112.5	Q224 A225 A232	Q224-L228 HydrophobicContact CG-CD1 4.34Å; Q224-L228 WeakPolarHBondContact O-CB 3.43Å; Q224-L228 WeakPolarHBondContact O-CG 3.29Å; Q224-L228 PolarHBondContact O-N 3.39Å; A225-L228 PolarHBondContact O-N 3.46Å; L228-A232 VanDerWaalsContact O-CB 3.24Å; L228-A232 WeakPolarHBondContact O-CB 3.49Å; L228-A232 PolarHBondContact O-N 2.88Å
229	I	86.6	Confident	88	Confident	74 Å²	74	82.9 Å²	82.9	38%	0.379	48%	0.484	S	S	.	.	H	α-helix	trans	-63.5	-45.2	173.2	-69.3	165.6	0	0	0	109.6	A225 K227 D231 A232 L233	A225-I229 VanDerWaalsContact O-CB 3.29Å; A225-I229 WeakPolarHBondContact O-CB 3.33Å; A225-I229 WeakPolarHBondContact O-CD1 3.45Å; A225-I229 WeakPolarHBondContact O-CG1 3.4Å; A225-I229 PolarHBondContact O-N 3.23Å; K227-I229 PolarHBondContact O-N 2.96Å; I229-D231 PolarHBondContact O-N 2.95Å; I229-A232 PolarHBondContact O-N 3.38Å; I229-L233 WeakPolarHBondContact O-CB 3.49Å; I229-L233 PolarHBondContact O-N 2.92Å
230	G	86.8	Confident	87.3	Confident	34 Å²	34	81.8 Å²	81.8	35%	0.351	47%	0.471	S	S	.	.	H	α-helix	trans	-57.9	-45.2	177.4	0	0	0	0	0	112.9	A226 K227 L233 S234	A226-G230 PolarHBondContact O-N 3.14Å; K227-G230 CarbonylContact O-C 3.58Å; K227-G230 WeakPolarHBondContact O-CA 3.31Å; K227-G230 PolarHBondContact O-N 3.19Å; K227-G230 VanDerWaalsContact O-N 3.08Å; G230-L233 WeakPolarHBondContact O-CB 3.37Å; G230-L233 PolarHBondContact O-N 3.46Å; G230-S234 PolarHBondContact O-N 3Å
231	D	86.8	Confident	86.6	Confident	105 Å²	105	80.4 Å²	80.4	56%	0.561	46%	0.463	S	S	*	.	H	α-helix	trans	-66.8	-47.6	177.2	-66.6	-24.1	0	0	0	111.3	K227 I229 L233 S234 Q235	K227-D231 PolarHBondContact O-N 3.41Å; I229-D231 PolarHBondContact O-N 2.95Å; D231-L233 PolarHBondContact O-N 3.25Å; D231-S234 WeakPolarHBondContact O-CB 3.48Å; D231-S234 PolarHBondContact O-N 3.04Å; D231-Q235 WeakPolarHBondContact O-CG 3.42Å; D231-Q235 PolarHBondContact O-N 3.18Å; D231-Q235 VanDerWaalsContact O-N 3.11Å
232	A	84.8	Confident	86.1	Confident	58 Å²	58	82.9 Å²	82.9	48%	0.479	47%	0.467	S	S	.	.	H	α-helix	trans	-59.9	-32.4	175.9	0	0	0	0	0	112.4	L228 I229 N236	L228-A232 VanDerWaalsContact O-CB 3.24Å; L228-A232 WeakPolarHBondContact O-CB 3.49Å; L228-A232 PolarHBondContact O-N 2.88Å; I229-A232 PolarHBondContact O-N 3.38Å; A232-N236 PolarHBondContact O-N 2.88Å; A232-N236 VanDerWaalsContact O-N 3.1Å
233	L	82.5	Confident	85.6	Confident	30 Å²	30	82.8 Å²	82.8	16%	0.157	46%	0.461	C	S	.	.	H	α-helix	trans	-76.4	-38	178.6	-166.7	63.4	0	0	0	113.5	I229 G230 D231 Q235 N236 Y239 L240	I229-L233 WeakPolarHBondContact O-CB 3.49Å; I229-L233 PolarHBondContact O-N 2.92Å; G230-L233 WeakPolarHBondContact O-CB 3.37Å; G230-L233 PolarHBondContact O-N 3.46Å; D231-L233 PolarHBondContact O-N 3.25Å; L233-Q235 VanDerWaalsContact C-N 3.28Å; L233-N236 CarbonylContact O-C 3.12Å; L233-N236 PolarHBondContact O-N 3.01Å; L233-Y239 HydrophobicContact CD1-CD1 3.61Å; L233-Y239 HydrophobicContact CD1-CG 4.27Å; L233-L240 HydrophobicContact CD1-CB 4.05Å; L233-L240 HydrophobicContact CD1-CD1 4.34Å; L233-L240 HydrophobicContact CD1-CD2 3.75Å; L233-L240 HydrophobicContact CD1-CG 3.34Å; L233-L240 HydrophobicContact CD2-CD1 3.8Å; L233-L240 HydrophobicContact CD2-CD2 3.38Å; L233-L240 HydrophobicContact CD2-CG 3.46Å; L233-L240 VanDerWaalsContact CD2-CG 3.46Å; L233-L240 HydrophobicContact CG-CD1 4.1Å; L233-L240 HydrophobicContact CG-CD2 4Å; L233-L240 HydrophobicContact CG-CG 3.59Å
234	S	79.6	Confident	85.1	Confident	85 Å²	85	83.7 Å²	83.7	59%	0.594	46%	0.455	S	S	*	.	H	α-helix	trans	-58	-44.7	171.4	-170.3	0	0	0	0	110.3	G230 D231 N236	G230-S234 PolarHBondContact O-N 3Å; D231-S234 WeakPolarHBondContact O-CB 3.48Å; D231-S234 PolarHBondContact O-N 3.04Å; S234-N236 PolarHBondContact O-N 3.03Å
235	Q	82.1	Confident	84.8	Confident	155 Å²	155	80.8 Å²	80.8	72%	0.724	44%	0.443	S	S	*	.	H	α-helix	trans	-65.8	-37.6	176.4	-63.8	-64.1	-16.8	0	0	112.9	D231 L233	D231-Q235 WeakPolarHBondContact O-CG 3.42Å; D231-Q235 PolarHBondContact O-N 3.18Å; D231-Q235 VanDerWaalsContact O-N 3.11Å; L233-Q235 VanDerWaalsContact C-N 3.28Å
236	N	82	Confident	84.6	Confident	108 Å²	108	85.3 Å²	85.3	58%	0.578	46%	0.455	S	S	*	.			trans	-127.4	81.2	-176.9	-74.8	-64.7	0	0	0	112.3	A232 L233 S234 G238 Y239	A232-N236 PolarHBondContact O-N 2.88Å; A232-N236 VanDerWaalsContact O-N 3.1Å; L233-N236 CarbonylContact O-C 3.12Å; L233-N236 PolarHBondContact O-N 3.01Å; S234-N236 PolarHBondContact O-N 3.03Å; N236-G238 PolarHBondContact O-N 3.38Å; N236-Y239 WeakPolarHBondContact O-CB 3.34Å; N236-Y239 PolarHBondContact O-N 3.39Å
237	P	77.6	Confident	84.5	Confident	32 Å²	32	84.6 Å²	84.6	21%	0.208	45%	0.449	C	S	.	.	H	α-helix	trans	-61.1	-21.3	178.3	22.8	-33.4	0	0	0	113.2	Y239 L240 K286	P237-Y239 PolarHBondContact O-N 3.3Å; P237-L240 PolarHBondContact O-N 2.85Å; P237-K286 HydrophobicContact CB-CG 4.28Å; P237-K286 HydrophobicContact CG-CD 4.49Å; P237-K286 HydrophobicContact CG-CG 3.82Å
238	G	80.6	Confident	84.2	Confident	53 Å²	53	78.1 Å²	78.1	55%	0.546	42%	0.424	S	S	.	.	H	α-helix	trans	-60.5	-27.6	172.5	0	0	0	0	0	113.9	N236 L240 K241 L242	N236-G238 PolarHBondContact O-N 3.38Å; G238-L240 PolarHBondContact O-N 3.2Å; G238-K241 PolarHBondContact O-N 2.89Å; G238-L242 PolarHBondContact O-N 3.13Å; G238-L242 VanDerWaalsContact O-N 3.11Å
239	Y	81.6	Confident	84.1	Confident	120 Å²	120	75.7 Å²	75.7	47%	0.471	41%	0.414	S	S	.	.	H	α-helix	trans	-65.5	-37.7	177.5	-177.3	-93	0	0	0	112.2	L233 N236 P237 K241 L242 R243	L233-Y239 HydrophobicContact CD1-CD1 3.61Å; L233-Y239 HydrophobicContact CD1-CG 4.27Å; N236-Y239 WeakPolarHBondContact O-CB 3.34Å; N236-Y239 PolarHBondContact O-N 3.39Å; P237-Y239 PolarHBondContact O-N 3.3Å; Y239-K241 VanDerWaalsContact C-N 3.35Å; Y239-K241 PolarHBondContact O-N 2.88Å; Y239-L242 PolarHBondContact O-N 3.08Å; Y239-R243 WeakPolarHBondContact O-CB 3.43Å; Y239-R243 PolarHBondContact O-N 3.5Å
240	L	81.9	Confident	84.3	Confident	31 Å²	31	77.4 Å²	77.4	16%	0.162	42%	0.42	C	S	.	.	H	α-helix	trans	-60.4	-44.9	174.5	-87.3	-176.4	0	0	0	111.6	L233 P237 G238 L242 R243 K244 L282 L285	L233-L240 HydrophobicContact CD1-CB 4.05Å; L233-L240 HydrophobicContact CD1-CD1 4.34Å; L233-L240 HydrophobicContact CD1-CD2 3.75Å; L233-L240 HydrophobicContact CD1-CG 3.34Å; L233-L240 HydrophobicContact CD2-CD1 3.8Å; L233-L240 HydrophobicContact CD2-CD2 3.38Å; L233-L240 HydrophobicContact CD2-CG 3.46Å; L233-L240 VanDerWaalsContact CD2-CG 3.46Å; L233-L240 HydrophobicContact CG-CD1 4.1Å; L233-L240 HydrophobicContact CG-CD2 4Å; L233-L240 HydrophobicContact CG-CG 3.59Å; P237-L240 PolarHBondContact O-N 2.85Å; G238-L240 PolarHBondContact O-N 3.2Å; L240-L242 VanDerWaalsContact C-N 3.35Å; L240-R243 PolarHBondContact O-N 3.43Å; L240-K244 WeakPolarHBondContact O-CB 3.3Å; L240-K244 WeakPolarHBondContact O-CG 3.38Å; L240-K244 PolarHBondContact O-N 2.84Å; L240-L282 HydrophobicContact CB-CD2 3.39Å; L240-L282 HydrophobicContact CD1-CD2 3.26Å; L240-L282 HydrophobicContact CG-CD2 3.92Å; L240-L285 HydrophobicContact CD1-CD1 3.97Å
241	K	80.6	Confident	84.3	Confident	90 Å²	90	80.3 Å²	80.3	39%	0.391	43%	0.427	S	S	.	.	H	α-helix	trans	-62.2	-44.7	-179.7	-170.4	160.7	-178.6	157.2	0	110.5	G238 Y239 R243 K244 I245 D279 L282	G238-K241 PolarHBondContact O-N 2.89Å; Y239-K241 VanDerWaalsContact C-N 3.35Å; Y239-K241 PolarHBondContact O-N 2.88Å; K241-R243 PolarHBondContact O-N 2.84Å; K241-K244 PolarHBondContact O-N 3.41Å; K241-I245 HydrophobicContact CG-CD1 4.17Å; K241-I245 WeakPolarHBondContact O-CD1 3.5Å; K241-I245 VanDerWaalsContact O-CG1 3.25Å; K241-I245 WeakPolarHBondContact O-CG1 3.43Å; K241-I245 PolarHBondContact O-N 3.35Å; K241-D279 IonicContact NZ-OD1 3.9Å; K241-D279 IonicContact NZ-OD2 3.96Å; K241-D279 PolarHBondContact NZ-OD2 2.88Å; K241-L282 HydrophobicContact CB-CD1 4.38Å
242	L	85.4	Confident	84.1	Confident	89 Å²	89	77.5 Å²	77.5	47%	0.466	42%	0.418	S	S	.	.	H	α-helix	trans	-61.9	-43.3	174.1	-177.6	63.1	0	0	0	112.4	G238 Y239 L240 I245 K246	G238-L242 PolarHBondContact O-N 3.13Å; G238-L242 VanDerWaalsContact O-N 3.11Å; Y239-L242 PolarHBondContact O-N 3.08Å; L240-L242 VanDerWaalsContact C-N 3.35Å; L242-I245 PolarHBondContact O-N 3.3Å; L242-K246 WeakPolarHBondContact O-CG 3.25Å; L242-K246 PolarHBondContact O-N 2.82Å
243	R	85	Confident	84.3	Confident	129 Å²	129	81.9 Å²	81.9	49%	0.487	42%	0.422	S	S	.	.	H	α-helix	trans	-66.3	-40.1	179.4	-165.9	166.7	105.2	167.5	3.3	112	Y239 L240 K241 K246 A247	Y239-R243 WeakPolarHBondContact O-CB 3.43Å; Y239-R243 PolarHBondContact O-N 3.5Å; L240-R243 PolarHBondContact O-N 3.43Å; K241-R243 PolarHBondContact O-N 2.84Å; R243-K246 PolarHBondContact O-N 3.19Å; R243-A247 WeakPolarHBondContact O-CB 3.14Å; R243-A247 PolarHBondContact O-N 3.36Å
244	K	83.9	Confident	84.5	Confident	69 Å²	69	84.2 Å²	84.2	30%	0.3	44%	0.438	S	S	.	.	H	α-helix	trans	-61.1	-46	172.8	-77.9	-176.5	178.2	-175.1	0	111.5	L240 K241 A247 A248 F278 L282	L240-K244 WeakPolarHBondContact O-CB 3.3Å; L240-K244 WeakPolarHBondContact O-CG 3.38Å; L240-K244 PolarHBondContact O-N 2.84Å; K241-K244 PolarHBondContact O-N 3.41Å; K244-A247 PolarHBondContact O-N 2.87Å; K244-A248 WeakPolarHBondContact O-CB 3.03Å; K244-A248 PolarHBondContact O-N 3.5Å; K244-F278 HydrophobicContact CB-CE1 4.2Å; K244-F278 HydrophobicContact CB-CZ 3.95Å; K244-F278 HydrophobicContact CD-CE1 3.77Å; K244-F278 HydrophobicContact CD-CZ 3.75Å; K244-F278 HydrophobicContact CG-CZ 4.3Å; K244-F278 PolarHBondContact NZ-O 3.11Å; K244-F278 VanDerWaalsContact NZ-O 3.08Å; K244-L282 HydrophobicContact CD-CD1 4.45Å
245	I	86.7	Confident	84.7	Confident	67 Å²	67	83.1 Å²	83.1	34%	0.344	43%	0.427	S	S	.	.	H	α-helix	trans	-62	-46.7	176.1	-66.9	164.3	0	0	0	110.5	K241 L242 A247 A248 T249 V273	K241-I245 HydrophobicContact CG-CD1 4.17Å; K241-I245 WeakPolarHBondContact O-CD1 3.5Å; K241-I245 VanDerWaalsContact O-CG1 3.25Å; K241-I245 WeakPolarHBondContact O-CG1 3.43Å; K241-I245 PolarHBondContact O-N 3.35Å; L242-I245 PolarHBondContact O-N 3.3Å; I245-A247 VanDerWaalsContact C-N 3.32Å; I245-A247 PolarHBondContact O-N 2.86Å; I245-A248 WeakPolarHBondContact O-CB 3.36Å; I245-A248 PolarHBondContact O-N 3.25Å; I245-T249 PolarHBondContact O-N 3.43Å; I245-T249 PolarHBondContact O-OG1 2.83Å; I245-V273 HydrophobicContact CG1-CG1 4.22Å
246	K	90	Very high	84.8	Confident	138 Å²	138	79.9 Å²	79.9	60%	0.6	43%	0.427	S	S	*	.	H	α-helix	trans	-60	-40.8	176.1	-77	-172.1	176.6	-175.5	0	112.4	L242 R243 T249 Q250	L242-K246 WeakPolarHBondContact O-CG 3.25Å; L242-K246 PolarHBondContact O-N 2.82Å; R243-K246 PolarHBondContact O-N 3.19Å; K246-T249 PolarHBondContact O-N 3.19Å; K246-Q250 WeakPolarHBondContact O-CB 3.4Å; K246-Q250 PolarHBondContact O-N 2.83Å
247	A	88.4	Confident	85	Confident	47 Å²	47	82.5 Å²	82.5	39%	0.388	44%	0.436	S	S	.	.	H	α-helix	trans	-63.5	-44.6	175.2	0	0	0	0	0	111.4	R243 K244 I245 T249 Q250 I251	R243-A247 WeakPolarHBondContact O-CB 3.14Å; R243-A247 PolarHBondContact O-N 3.36Å; K244-A247 PolarHBondContact O-N 2.87Å; I245-A247 VanDerWaalsContact C-N 3.32Å; I245-A247 PolarHBondContact O-N 2.86Å; A247-T249 PolarHBondContact O-N 2.99Å; A247-Q250 PolarHBondContact O-N 3.31Å; A247-I251 WeakPolarHBondContact O-CB 3.46Å; A247-I251 VanDerWaalsContact O-CG1 3.25Å; A247-I251 WeakPolarHBondContact O-CG1 3.4Å; A247-I251 PolarHBondContact O-N 2.97Å
248	A	85.4	Confident	85.4	Confident	16 Å²	16	83.3 Å²	83.3	13%	0.132	44%	0.442	C	S	.	.	H	α-helix	trans	-59.8	-44.4	174	0	0	0	0	0	111.7	K244 I245 Q250 I251 A252 L271 V273	K244-A248 WeakPolarHBondContact O-CB 3.03Å; K244-A248 PolarHBondContact O-N 3.5Å; I245-A248 WeakPolarHBondContact O-CB 3.36Å; I245-A248 PolarHBondContact O-N 3.25Å; A248-Q250 PolarHBondContact O-N 2.86Å; A248-I251 PolarHBondContact O-N 3.47Å; A248-A252 VanDerWaalsContact O-CB 3.3Å; A248-A252 WeakPolarHBondContact O-CB 3.14Å; A248-A252 PolarHBondContact O-N 2.77Å; A248-L271 HydrophobicContact CB-CB 4.43Å; A248-L271 HydrophobicContact CB-CD1 3.99Å; A248-L271 VanDerWaalsContact O-CD1 3.3Å; A248-L271 WeakPolarHBondContact O-CD1 3.49Å; A248-V273 HydrophobicContact CB-CG2 4.13Å
249	T	88.1	Confident	85.6	Confident	60 Å²	60	90.1 Å²	90.1	37%	0.368	46%	0.46	S	S	.	.	H	α-helix	trans	-61	-41.9	174.4	-56	0	0	0	0	112.1	I245 K246 A247 A252 R253	I245-T249 PolarHBondContact O-N 3.43Å; I245-T249 PolarHBondContact O-OG1 2.83Å; K246-T249 PolarHBondContact O-N 3.19Å; A247-T249 PolarHBondContact O-N 2.99Å; T249-A252 PolarHBondContact O-N 3.44Å; T249-R253 WeakPolarHBondContact O-CG 3.29Å; T249-R253 PolarHBondContact O-N 3.43Å
250	Q	89.7	Confident	85.7	Confident	109 Å²	109	90.6 Å²	90.6	51%	0.509	47%	0.47	S	S	.	.	H	α-helix	trans	-66.8	-45.1	178.4	-174	64.4	14.2	0	0	111.4	K246 A247 A248 A252 R253 T254	K246-Q250 WeakPolarHBondContact O-CB 3.4Å; K246-Q250 PolarHBondContact O-N 2.83Å; A247-Q250 PolarHBondContact O-N 3.31Å; A248-Q250 PolarHBondContact O-N 2.86Å; Q250-A252 VanDerWaalsContact C-N 3.35Å; Q250-R253 PolarHBondContact O-N 3.44Å; Q250-T254 PolarHBondContact O-N 2.83Å; Q250-T254 PolarHBondContact O-OG1 3.11Å; Q250-T254 VanDerWaalsContact O-OG1 3.07Å
251	I	87.2	Confident	85.6	Confident	96 Å²	96	100 Å²	100	49%	0.492	50%	0.504	S	S	.	.	H	α-helix	trans	-60.5	-46.1	175.2	-66.7	163.6	0	0	0	110	A247 A248 R253 T254 V255	A247-I251 WeakPolarHBondContact O-CB 3.46Å; A247-I251 VanDerWaalsContact O-CG1 3.25Å; A247-I251 WeakPolarHBondContact O-CG1 3.4Å; A247-I251 PolarHBondContact O-N 2.97Å; A248-I251 PolarHBondContact O-N 3.47Å; I251-R253 VanDerWaalsContact C-N 3.32Å; I251-R253 PolarHBondContact O-N 2.92Å; I251-T254 PolarHBondContact O-N 2.7Å; I251-V255 HydrophobicContact CG2-CG2 4.23Å; I251-V255 WeakPolarHBondContact O-CB 3.19Å; I251-V255 VanDerWaalsContact O-CG2 3.28Å; I251-V255 WeakPolarHBondContact O-CG2 3.43Å; I251-V255 PolarHBondContact O-N 3.37Å
252	A	84.1	Confident	85.3	Confident	46 Å²	46	98.8 Å²	98.8	38%	0.38	51%	0.51	S	S	.	.	H	α-helix	trans	-57.6	-43.1	176.4	0	0	0	0	0	112.1	A248 T249 Q250 V255 A256 L271	A248-A252 VanDerWaalsContact O-CB 3.3Å; A248-A252 WeakPolarHBondContact O-CB 3.14Å; A248-A252 PolarHBondContact O-N 2.77Å; T249-A252 PolarHBondContact O-N 3.44Å; Q250-A252 VanDerWaalsContact C-N 3.35Å; A252-V255 PolarHBondContact O-N 3.3Å; A252-A256 VanDerWaalsContact O-CB 3.27Å; A252-A256 WeakPolarHBondContact O-CB 3.32Å; A252-A256 PolarHBondContact O-N 3.4Å; A252-L271 HydrophobicContact CB-CD1 3.98Å
253	R	87.5	Confident	84.8	Confident	149 Å²	149	103.9 Å²	103.9	56%	0.562	53%	0.529	S	S	*	.	H	α-helix	trans	-63.4	-47.9	174.8	-76	176.9	-176.7	167	-1.5	112.3	T249 Q250 I251 V255 A256 Q257	T249-R253 WeakPolarHBondContact O-CG 3.29Å; T249-R253 PolarHBondContact O-N 3.43Å; Q250-R253 PolarHBondContact O-N 3.44Å; I251-R253 VanDerWaalsContact C-N 3.32Å; I251-R253 PolarHBondContact O-N 2.92Å; R253-V255 VanDerWaalsContact C-N 3.31Å; R253-V255 PolarHBondContact O-N 3.49Å; R253-A256 PolarHBondContact O-N 2.83Å; R253-Q257 WeakPolarHBondContact O-CB 3.37Å; R253-Q257 WeakPolarHBondContact O-CG 3.39Å; R253-Q257 PolarHBondContact O-N 3.12Å
254	T	87.3	Confident	84.2	Confident	79 Å²	79	102.3 Å²	102.3	49%	0.485	53%	0.53	S	S	.	.	H	α-helix	trans	-60.2	-42.1	178.2	-57.1	0	0	0	0	111.1	Q250 I251 S258	Q250-T254 PolarHBondContact O-N 2.83Å; Q250-T254 PolarHBondContact O-OG1 3.11Å; Q250-T254 VanDerWaalsContact O-OG1 3.07Å; I251-T254 PolarHBondContact O-N 2.7Å; T254-S258 WeakPolarHBondContact O-CB 3.35Å; T254-S258 PolarHBondContact O-N 3.27Å
255	V	84.1	Confident	83.8	Confident	63 Å²	63	105.6 Å²	105.6	38%	0.382	55%	0.546	S	S	.	.	H	α-helix	trans	-67	-43.9	177.2	173.3	0	0	0	0	111.2	I251 A252 R253 Q257 S258 A262	I251-V255 HydrophobicContact CG2-CG2 4.23Å; I251-V255 WeakPolarHBondContact O-CB 3.19Å; I251-V255 VanDerWaalsContact O-CG2 3.28Å; I251-V255 WeakPolarHBondContact O-CG2 3.43Å; I251-V255 PolarHBondContact O-N 3.37Å; A252-V255 PolarHBondContact O-N 3.3Å; R253-V255 VanDerWaalsContact C-N 3.31Å; R253-V255 PolarHBondContact O-N 3.49Å; V255-Q257 PolarHBondContact O-N 3.47Å; V255-S258 PolarHBondContact O-N 2.95Å; V255-S258 PolarHBondContact O-OG 3.29Å; V255-A262 HydrophobicContact CG1-CB 4.38Å
256	A	83.6	Confident	83	Confident	87 Å²	87	106.9 Å²	106.9	72%	0.719	56%	0.561	S	S	*	*	H	α-helix	trans	-65.8	-33.6	177.6	0	0	0	0	0	113.6	A252 R253	A252-A256 VanDerWaalsContact O-CB 3.27Å; A252-A256 WeakPolarHBondContact O-CB 3.32Å; A252-A256 PolarHBondContact O-N 3.4Å; R253-A256 PolarHBondContact O-N 2.83Å
257	Q	87.2	Confident	82	Confident	162 Å²	162	102.9 Å²	102.9	76%	0.757	56%	0.559	S	S	*	*	H	α-helix	trans	-78.6	-24.5	174.1	-73.9	-179.4	-22	0	0	113	R253 V255	R253-Q257 WeakPolarHBondContact O-CB 3.37Å; R253-Q257 WeakPolarHBondContact O-CG 3.39Å; R253-Q257 PolarHBondContact O-N 3.12Å; V255-Q257 PolarHBondContact O-N 3.47Å
258	S	84.8	Confident	81	Confident	49 Å²	49	101.9 Å²	101.9	34%	0.343	55%	0.549	S	S	.	.	S	Bend	trans	-65.9	136.6	179.6	78.2	0	0	0	0	110.1	T254 V255 N260	T254-S258 WeakPolarHBondContact O-CB 3.35Å; T254-S258 PolarHBondContact O-N 3.27Å; V255-S258 PolarHBondContact O-N 2.95Å; V255-S258 PolarHBondContact O-OG 3.29Å; S258-N260 PolarHBondContact O-N 2.86Å; S258-N260 VanDerWaalsContact O-N 3.12Å
259	Q	85	Confident	80.1	Confident	196 Å²	196	106.9 Å²	106.9	92%	0.916	57%	0.573	S	S	*	*	S	Bend	trans	-68.7	-5.5	174.1	-62.2	-178.3	8.2	0	0	112.5
260	N	84	Confident	79.1	Confident	130 Å²	130	109.9 Å²	109.9	70%	0.695	59%	0.586	S	S	*	*	S	Bend	trans	-83.5	123.5	-176.8	-71.9	-10.4	0	0	0	110.7	S258 A262	S258-N260 PolarHBondContact O-N 2.86Å; S258-N260 VanDerWaalsContact O-N 3.12Å; N260-A262 PolarHBondContact O-N 3.24Å
261	R	80.1	Confident	78.1	Confident	229 Å²	229	107.8 Å²	107.8	86%	0.864	58%	0.577	S	S	*	*			trans	-73.2	105.6	172	-64.3	-173.1	-67	-152.2	-1.1	109.6
262	A	73.1	Confident	77.2	Confident	64 Å²	64	107.1 Å²	107.1	53%	0.529	58%	0.575	S	S	.	*	P	Polyproline II helix	trans	-96.9	122.3	171.7	0	0	0	0	0	110.1	V255 N260	V255-A262 HydrophobicContact CG1-CB 4.38Å; N260-A262 PolarHBondContact O-N 3.24Å
263	F	75.9	Confident	76.6	Confident	196 Å²	196	107 Å²	107	86%	0.86	57%	0.569	S	S	*	*	P	Polyproline II helix	trans	-82.6	118	172.3	-65.5	-87	0	0	0	109
264	L	72	Confident	75.6	Confident	96 Å²	96	103.7 Å²	103.7	50%	0.503	57%	0.574	S	S	.	*	P	Polyproline II helix	trans	-103	143.2	177	-63.9	172.5	0	0	0	109.7
265	H	76	Confident	74.8	Confident	139 Å²	139	102.9 Å²	102.9	64%	0.644	57%	0.566	S	S	*	*	P	Polyproline II helix	trans	-66.4	143.9	172.2	-172.6	-92.2	0	0	0	109.4	G267 S268	H265-G267 PolarHBondContact ND1-N 3.42Å; H265-G267 VanDerWaalsContact ND1-N 3.13Å; H265-G267 PolarHBondContact O-N 3.4Å; H265-G267 VanDerWaalsContact O-N 3.14Å; H265-S268 PolarHBondContact N-OG 3.35Å; H265-S268 PolarHBondContact O-N 2.92Å; H265-S268 PolarHBondContact O-OG 3.48Å
266	S	68.8	Low	74.1	Confident	94 Å²	94	105.1 Å²	105.1	66%	0.657	58%	0.582	S	S	*	*	G	3₁₀ helix	trans	-56.7	-33.3	-178.7	51	0	0	0	0	112.6	L269	S266-L269 WeakPolarHBondContact O-CD1 3.08Å
267	G	69	Low	73.5	Confident	53 Å²	53	109.1 Å²	109.1	55%	0.546	58%	0.583	S	S	.	*	G	3₁₀ helix	trans	-71	-22.6	173	0	0	0	0	0	115.6	H265	H265-G267 PolarHBondContact ND1-N 3.42Å; H265-G267 VanDerWaalsContact ND1-N 3.13Å; H265-G267 PolarHBondContact O-N 3.4Å; H265-G267 VanDerWaalsContact O-N 3.14Å
268	S	68.8	Low	72.6	Confident	27 Å²	27	104 Å²	104	19%	0.189	56%	0.559	C	S	.	*	G	3₁₀ helix	trans	-97.6	6.2	-176	67.6	0	0	0	0	113.8	H265 I270 L271	H265-S268 PolarHBondContact N-OG 3.35Å; H265-S268 PolarHBondContact O-N 2.92Å; H265-S268 PolarHBondContact O-OG 3.48Å; S268-I270 PolarHBondContact O-N 2.83Å; S268-L271 WeakPolarHBondContact O-CA 3.46Å; S268-L271 PolarHBondContact O-N 3.17Å
269	L	66.1	Low	71.8	Confident	121 Å²	121	103.4 Å²	103.4	63%	0.634	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.1	-28.7	-179.1	-79.1	163.2	0	0	0	112.9	S266 L271	S266-L269 WeakPolarHBondContact O-CD1 3.08Å; L269-L271 VanDerWaalsContact C-N 3.3Å
270	I	67.9	Low	71.2	Confident	123 Å²	123	96.6 Å²	96.6	63%	0.631	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	22	176.2	-33.3	177.1	0	0	0	111.3	S268 N272 V273	S268-I270 PolarHBondContact O-N 2.83Å; I270-N272 PolarHBondContact O-N 2.88Å; I270-V273 WeakPolarHBondContact O-CB 3.43Å; I270-V273 VanDerWaalsContact O-CG2 3.31Å; I270-V273 WeakPolarHBondContact O-CG2 3.24Å; I270-V273 PolarHBondContact O-N 3.34Å
271	L	67.4	Low	70.4	Confident	64 Å²	64	92.5 Å²	92.5	34%	0.335	52%	0.518	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.2	36.5	-177.8	-67.8	169.1	0	0	0	113.5	A248 A252 S268 L269 V273	A248-L271 HydrophobicContact CB-CB 4.43Å; A248-L271 HydrophobicContact CB-CD1 3.99Å; A248-L271 VanDerWaalsContact O-CD1 3.3Å; A248-L271 WeakPolarHBondContact O-CD1 3.49Å; A252-L271 HydrophobicContact CB-CD1 3.98Å; S268-L271 WeakPolarHBondContact O-CA 3.46Å; S268-L271 PolarHBondContact O-N 3.17Å; L269-L271 VanDerWaalsContact C-N 3.3Å; L271-V273 HydrophobicContact CB-CG2 4.45Å; L271-V273 PolarHBondContact O-N 3.06Å; L271-V273 VanDerWaalsContact O-N 3.08Å
272	N	69.4	Low	69.7	Low	82 Å²	82	82.3 Å²	82.3	44%	0.439	48%	0.48	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.3	18.8	-177.2	-66.5	-15.6	0	0	0	115.8	I270 A274 D275 F278	I270-N272 PolarHBondContact O-N 2.88Å; N272-A274 PolarHBondContact O-N 3.08Å; N272-D275 HydrophobicContact CB-CB 4.43Å; N272-D275 PolarHBondContact O-N 2.83Å; N272-F278 WeakPolarHBondContact O-CB 3.45Å; N272-F278 WeakPolarHBondContact O-CG 3.41Å
273	V	69.7	Low	69.4	Low	44 Å²	44	83.3 Å²	83.3	27%	0.267	48%	0.477	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-23.2	180	179.9	0	0	0	0	112.2	I245 A248 I270 L271	I245-V273 HydrophobicContact CG1-CG1 4.22Å; A248-V273 HydrophobicContact CB-CG2 4.13Å; I270-V273 WeakPolarHBondContact O-CB 3.43Å; I270-V273 VanDerWaalsContact O-CG2 3.31Å; I270-V273 WeakPolarHBondContact O-CG2 3.24Å; I270-V273 PolarHBondContact O-N 3.34Å; L271-V273 HydrophobicContact CB-CG2 4.45Å; L271-V273 PolarHBondContact O-N 3.06Å; L271-V273 VanDerWaalsContact O-N 3.08Å
274	A	67.6	Low	69.1	Low	80 Å²	80	79.6 Å²	79.6	66%	0.661	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.8	-5.1	179.5	0	0	0	0	0	114.5	N272	N272-A274 PolarHBondContact O-N 3.08Å
275	D	70.6	Confident	68.5	Low	61 Å²	61	79.5 Å²	79.5	33%	0.326	46%	0.464	S	S	.	.			trans	-71.1	126.8	179.8	-173.5	-19.1	0	0	0	109.5	N272 K277 F278	N272-D275 HydrophobicContact CB-CB 4.43Å; N272-D275 PolarHBondContact O-N 2.83Å; D275-K277 PolarHBondContact O-N 3.08Å; D275-K277 VanDerWaalsContact O-N 3.12Å; D275-K277 WeakPolarHBondContact OD1-CB 3.38Å; D275-K277 PolarHBondContact OD1-N 3.49Å; D275-F278 HydrophobicContact CB-CB 4.35Å; D275-F278 WeakPolarHBondContact O-CA 3.37Å; D275-F278 WeakPolarHBondContact O-CB 3.3Å; D275-F278 PolarHBondContact O-N 3.05Å
276	P	69.4	Low	67.7	Low	110 Å²	110	79.8 Å²	79.8	71%	0.714	46%	0.464	S	S	*	.	H	α-helix	trans	-57	-26.4	174.9	20.1	-31.3	0	0	0	113.4	F278 D279 A280	P276-F278 PolarHBondContact O-N 3.1Å; P276-D279 PolarHBondContact O-N 3.24Å; P276-A280 PolarHBondContact O-N 3.28Å
277	K	71.5	Confident	67.2	Low	171 Å²	171	84.3 Å²	84.3	74%	0.743	47%	0.471	S	S	*	.	H	α-helix	trans	-65.4	-24.7	172.1	-65.8	179.8	179.5	177	0	112.9	D275	D275-K277 PolarHBondContact O-N 3.08Å; D275-K277 VanDerWaalsContact O-N 3.12Å; D275-K277 WeakPolarHBondContact OD1-CB 3.38Å; D275-K277 PolarHBondContact OD1-N 3.49Å
278	F	66.7	Low	66.1	Low	54 Å²	54	93.7 Å²	93.7	24%	0.237	50%	0.497	C	S	.	.	H	α-helix	trans	-68.2	-36.1	179.1	-172.6	-99.8	0	0	0	112.6	K244 N272 D275 P276	K244-F278 HydrophobicContact CB-CE1 4.2Å; K244-F278 HydrophobicContact CB-CZ 3.95Å; K244-F278 HydrophobicContact CD-CE1 3.77Å; K244-F278 HydrophobicContact CD-CZ 3.75Å; K244-F278 HydrophobicContact CG-CZ 4.3Å; K244-F278 PolarHBondContact NZ-O 3.11Å; K244-F278 VanDerWaalsContact NZ-O 3.08Å; N272-F278 WeakPolarHBondContact O-CB 3.45Å; N272-F278 WeakPolarHBondContact O-CG 3.41Å; D275-F278 HydrophobicContact CB-CB 4.35Å; D275-F278 WeakPolarHBondContact O-CA 3.37Å; D275-F278 WeakPolarHBondContact O-CB 3.3Å; D275-F278 PolarHBondContact O-N 3.05Å; P276-F278 PolarHBondContact O-N 3.1Å
279	D	69.3	Low	66	Low	38 Å²	38	97.1 Å²	97.1	20%	0.203	51%	0.513	C	S	.	.	H	α-helix	trans	-90.9	-20.1	179.8	-80.3	-12.4	0	0	0	113	K241 P276 G281 L282 D283	K241-D279 IonicContact NZ-OD1 3.9Å; K241-D279 IonicContact NZ-OD2 3.96Å; K241-D279 PolarHBondContact NZ-OD2 2.88Å; P276-D279 PolarHBondContact O-N 3.24Å; D279-G281 PolarHBondContact O-N 2.92Å; D279-L282 WeakPolarHBondContact O-CA 3.44Å; D279-L282 VanDerWaalsContact O-CB 3.3Å; D279-L282 WeakPolarHBondContact O-CB 3.47Å; D279-L282 PolarHBondContact O-N 3.32Å; D279-D283 PolarHBondContact O-N 3.48Å
280	A	71.2	Confident	66	Low	52 Å²	52	95.8 Å²	95.8	43%	0.43	51%	0.506	S	S	.	.	H	α-helix	trans	-52.1	-36.2	-177.2	0	0	0	0	0	114.3	P276 L282	P276-A280 PolarHBondContact O-N 3.28Å; A280-L282 VanDerWaalsContact C-N 3.32Å; A280-L282 PolarHBondContact O-N 3.37Å
281	G	67.5	Low	65.9	Low	45 Å²	45	94.3 Å²	94.3	46%	0.464	50%	0.499	S	S	.	.	H	α-helix	trans	-72.2	-21	176.6	0	0	0	0	0	114.8	D279	D279-G281 PolarHBondContact O-N 2.92Å
282	L	65.1	Low	65.8	Low	14 Å²	14	96.1 Å²	96.1	7%	0.073	51%	0.509	C	S	.	.	H	α-helix	trans	-80.9	-36.3	178.2	-65.1	164.8	0	0	0	111.8	L240 K241 K244 D279 A280 I284 L285	L240-L282 HydrophobicContact CB-CD2 3.39Å; L240-L282 HydrophobicContact CD1-CD2 3.26Å; L240-L282 HydrophobicContact CG-CD2 3.92Å; K241-L282 HydrophobicContact CB-CD1 4.38Å; K244-L282 HydrophobicContact CD-CD1 4.45Å; D279-L282 WeakPolarHBondContact O-CA 3.44Å; D279-L282 VanDerWaalsContact O-CB 3.3Å; D279-L282 WeakPolarHBondContact O-CB 3.47Å; D279-L282 PolarHBondContact O-N 3.32Å; A280-L282 VanDerWaalsContact C-N 3.32Å; A280-L282 PolarHBondContact O-N 3.37Å; L282-I284 PolarHBondContact O-N 2.82Å; L282-L285 PolarHBondContact O-N 3.17Å; L282-L285 VanDerWaalsContact O-N 3.17Å
283	D	68.2	Low	65.6	Low	86 Å²	86	96.9 Å²	96.9	46%	0.46	51%	0.513	S	S	.	.	H	α-helix	trans	-68.3	-24.2	-177.9	-71.9	-28.5	0	0	0	113	D279 L285 K286	D279-D283 PolarHBondContact O-N 3.48Å; D283-L285 VanDerWaalsContact C-N 3.29Å; D283-L285 PolarHBondContact O-N 3.47Å; D283-K286 PolarHBondContact O-N 3.41Å
284	I	68.5	Low	65.3	Low	118 Å²	118	100.5 Å²	100.5	61%	0.605	53%	0.53	S	S	*	.	H	α-helix	trans	-65.1	-35.6	174.9	-56.8	167.5	0	0	0	110.7	L282 K287	L282-I284 PolarHBondContact O-N 2.82Å; I284-K287 PolarHBondContact O-N 3.44Å
285	L	60.2	Low	65.1	Low	93 Å²	93	101.9 Å²	101.9	49%	0.487	52%	0.52	S	S	.	.	H	α-helix	trans	-74	-28.9	-179.6	-68.7	170.7	0	0	0	112.7	L240 L282 D283 K287	L240-L285 HydrophobicContact CD1-CD1 3.97Å; L282-L285 PolarHBondContact O-N 3.17Å; L282-L285 VanDerWaalsContact O-N 3.17Å; D283-L285 VanDerWaalsContact C-N 3.29Å; D283-L285 PolarHBondContact O-N 3.47Å; L285-K287 VanDerWaalsContact C-N 3.27Å; L285-K287 PolarHBondContact O-N 3.41Å
286	K	59.4	Low	64.7	Low	146 Å²	146	105.1 Å²	105.1	64%	0.635	54%	0.535	S	S	*	.	H	α-helix	trans	-71.2	-19.3	174.4	-84.7	-175.8	175.8	179	0	114.1	P237 D283	P237-K286 HydrophobicContact CB-CG 4.28Å; P237-K286 HydrophobicContact CG-CD 4.49Å; P237-K286 HydrophobicContact CG-CG 3.82Å; D283-K286 PolarHBondContact O-N 3.41Å
287	K	56.7	Low	64.3	Low	189 Å²	189	104.7 Å²	104.7	82%	0.822	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.7	-5.8	-174	-77	-175.7	177.6	-178.9	0	113.9	I284 L285	I284-K287 PolarHBondContact O-N 3.44Å; L285-K287 VanDerWaalsContact C-N 3.27Å; L285-K287 PolarHBondContact O-N 3.41Å
288	K	47.3	Very low	63.7	Low	250 Å²	250	98.6 Å²	98.6	100%	1.087	50%	0.5	S	S	*	.			trans	-100.7	0	168.5	-87.8	-171.6	172.1	-173.8	0	109.4

Retrieved 288 of 288 residues in 55.6 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).