A0A087YKZ7_POEFO Loading...

Protein kinase, AMP-activated, gamma 3b non-catalytic subunit

AlphaFold DB , UniProt , Accession A0A087YKZ7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 401 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	29.8	Very low	27.9	Very low	241 Å²	241	154.1 Å²	154.1	100%	1.187	82%	0.821	S	S	*	*				0	83.4	0	-82.9	174.5	167.9	0	0	105.4
2	D	27.2	Very low	27.8	Very low	164 Å²	164	155.8 Å²	155.8	88%	0.877	82%	0.824	S	S	*	*			trans	-87.8	126.7	-177.8	-73.8	-23.7	0	0	0	109.1	F4	D2-F4 PolarHBondContact O-N 3.23Å
3	S	24.5	Very low	28.2	Very low	113 Å²	113	154.5 Å²	154.5	79%	0.79	82%	0.818	S	S	*	*			trans	-59.2	126.7	-177.5	54	0	0	0	0	111.3	A5	S3-A5 PolarHBondContact O-N 3.27Å; S3-A5 VanDerWaalsContact O-N 3.13Å
4	F	24.7	Very low	28.4	Very low	209 Å²	209	156.3 Å²	156.3	92%	0.917	82%	0.819	S	S	*	*			trans	-55.4	113.7	166.4	-78.2	-96.7	0	0	0	109.2	D2 E6	D2-F4 PolarHBondContact O-N 3.23Å; F4-E6 PolarHBondContact O-N 3.28Å
5	A	27.5	Very low	29.2	Very low	94 Å²	94	158.4 Å²	158.4	78%	0.777	81%	0.814	S	S	*	*			trans	-72.5	112	166	0	0	0	0	0	107.6	S3 V7	S3-A5 PolarHBondContact O-N 3.27Å; S3-A5 VanDerWaalsContact O-N 3.13Å; A5-V7 PolarHBondContact O-N 2.87Å
6	E	26.7	Very low	30.2	Very low	188 Å²	188	155 Å²	155	88%	0.879	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-54.9	124	169.6	-84.6	176.9	147	0	0	109.5	F4	F4-E6 PolarHBondContact O-N 3.28Å
7	V	29.4	Very low	30.7	Very low	112 Å²	112	155.9 Å²	155.9	68%	0.679	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-71.4	124.6	172	-179.1	0	0	0	0	106.8	A5 L9	A5-V7 PolarHBondContact O-N 2.87Å; V7-L9 PolarHBondContact O-N 3.4Å
8	P	26.5	Very low	31.5	Very low	104 Å²	104	153.9 Å²	153.9	68%	0.675	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-60	127.2	-177.4	-20.3	30.4	0	0	0	110.9
9	L	27.6	Very low	32.3	Very low	160 Å²	160	147.7 Å²	147.7	84%	0.838	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-62.1	133.2	172.6	-156.9	72.6	0	0	0	108.7	V7 E11	V7-L9 PolarHBondContact O-N 3.4Å; L9-E11 PolarHBondContact O-N 3.43Å
10	F	37.4	Very low	32.9	Very low	133 Å²	133	142.5 Å²	142.5	58%	0.583	72%	0.724	S	S	*	*			trans	-68.2	99.3	177.2	-70.8	-84.7	0	0	0	109.4	F264	F10-F264 HydrophobicContact CZ-CZ 4.32Å
11	E	25.7	Very low	33.2	Very low	177 Å²	177	139.9 Å²	139.9	83%	0.827	71%	0.712	S	S	*	*			trans	-69.5	136.2	170.2	-77	-176.7	161.1	0	0	110.5	L9	L9-E11 PolarHBondContact O-N 3.43Å
12	M	26.9	Very low	33.8	Very low	175 Å²	175	129.8 Å²	129.8	86%	0.862	66%	0.664	S	S	*	*			trans	-77.9	123.7	174.9	-70.1	168	48.8	0	0	108.6	E14	M12-E14 PolarHBondContact O-N 2.82Å; M12-E14 VanDerWaalsContact O-N 3.08Å
13	D	32.9	Very low	34.8	Very low	138 Å²	138	124.7 Å²	124.7	74%	0.738	64%	0.639	S	S	*	*			trans	-71.1	101.2	180	-72.2	-37.8	0	0	0	111.2	Y15	D13-Y15 VanDerWaalsContact C-N 3.33Å; D13-Y15 PolarHBondContact O-N 2.79Å; D13-Y15 VanDerWaalsContact O-N 3.16Å
14	E	31.1	Very low	35.7	Very low	180 Å²	180	127.8 Å²	127.8	84%	0.841	63%	0.634	S	S	*	*			trans	-79.6	70.3	166.6	-70.8	-171.7	166.4	0	0	111.2	M12	M12-E14 PolarHBondContact O-N 2.82Å; M12-E14 VanDerWaalsContact O-N 3.08Å
15	Y	40.4	Very low	36.3	Very low	188 Å²	188	128.2 Å²	128.2	74%	0.737	63%	0.629	S	S	*	*			trans	-146.4	49	175.9	-69.4	-80.3	0	0	0	112.9	D13	D13-Y15 VanDerWaalsContact C-N 3.33Å; D13-Y15 PolarHBondContact O-N 2.79Å; D13-Y15 VanDerWaalsContact O-N 3.16Å
16	E	45	Very low	37	Very low	104 Å²	104	131.3 Å²	131.3	49%	0.486	62%	0.621	S	S	.	*			trans	-93.1	-26.7	-177.4	-60.5	-163.3	154	0	0	113.9	K194	E16-K194 WeakPolarHBondContact OE1-CE 3.09Å; E16-K194 IonicContact OE1-NZ 3.85Å; E16-K194 PolarHBondContact OE1-NZ 3.24Å
17	E	39.3	Very low	37.6	Very low	170 Å²	170	125.5 Å²	125.5	79%	0.794	61%	0.611	S	S	*	*	H	α-helix	trans	-76.7	-30.5	-174.4	-67.9	-167	164.6	0	0	114.1
18	E	44	Very low	37.9	Very low	120 Å²	120	126.3 Å²	126.3	56%	0.561	62%	0.616	S	S	*	*	H	α-helix	trans	-73.2	-31.9	-179.8	-80.9	-149.5	174.6	0	0	113.6	V20 L21 S22 R64	E18-V20 VanDerWaalsContact C-N 3.33Å; E18-V20 PolarHBondContact O-N 3.05Å; E18-L21 PolarHBondContact O-N 2.7Å; E18-S22 PolarHBondContact O-N 3.5Å; E18-S22 VanDerWaalsContact O-N 3.13Å; E18-S22 PolarHBondContact O-OG 3.06Å; E18-R64 PolarHBondContact O-NH2 3.03Å; E18-R64 IonicContact OE2-CZ 3.8Å; E18-R64 IonicContact OE2-NH1 2.81Å; E18-R64 PolarHBondContact OE2-NH1 3.14Å; E18-R64 IonicContact OE2-NH2 3.94Å
19	E	47.5	Very low	38	Very low	36 Å²	36	126.2 Å²	126.2	17%	0.168	62%	0.616	C	S	.	*	H	α-helix	trans	-61.3	-42.9	-178	-113.2	-172.6	169.4	0	0	110.9	L21 S22 V23 R191	E19-L21 VanDerWaalsContact C-N 3.34Å; E19-L21 PolarHBondContact O-N 2.85Å; E19-S22 PolarHBondContact O-N 2.68Å; E19-S22 PolarHBondContact O-OG 2.89Å; E19-V23 PolarHBondContact O-N 3Å; E19-R191 IonicContact OE1-CZ 3.66Å; E19-R191 IonicContact OE1-NH1 2.8Å; E19-R191 IonicContact OE1-NH2 2.74Å; E19-R191 PolarHBondContact OE1-NH2 2.88Å; E19-R191 IonicContact OE2-CZ 3.56Å; E19-R191 IonicContact OE2-NH1 3.7Å; E19-R191 PolarHBondContact OE2-NH1 3.13Å; E19-R191 IonicContact OE2-NH2 3.26Å
20	V	43.4	Very low	38	Very low	44 Å²	44	124.3 Å²	124.3	27%	0.267	61%	0.612	S	S	.	*	H	α-helix	trans	-62	-40.4	178.9	-175.8	0	0	0	0	111.6	E18 R24 I198	E18-V20 VanDerWaalsContact C-N 3.33Å; E18-V20 PolarHBondContact O-N 3.05Å; V20-R24 PolarHBondContact O-N 3.35Å; V20-I198 HydrophobicContact CG2-CG2 3.78Å
21	L	39.1	Very low	37.7	Very low	88 Å²	88	127.4 Å²	127.4	46%	0.461	62%	0.621	S	S	.	*	H	α-helix	trans	-73.2	-34	-179.2	-69.8	171.1	0	0	0	112.7	E18 E19 R24 R25	E18-L21 PolarHBondContact O-N 2.7Å; E19-L21 VanDerWaalsContact C-N 3.34Å; E19-L21 PolarHBondContact O-N 2.85Å; L21-R24 PolarHBondContact O-N 2.99Å; L21-R25 WeakPolarHBondContact O-CG 3.17Å; L21-R25 PolarHBondContact O-N 3.18Å
22	S	43.6	Very low	37.7	Very low	28 Å²	28	122.8 Å²	122.8	20%	0.196	61%	0.613	C	S	.	*	H	α-helix	trans	-67.7	-38.4	175.2	39.7	0	0	0	0	113.8	E18 E19 R25 R26 R64	E18-S22 PolarHBondContact O-N 3.5Å; E18-S22 VanDerWaalsContact O-N 3.13Å; E18-S22 PolarHBondContact O-OG 3.06Å; E19-S22 PolarHBondContact O-N 2.68Å; E19-S22 PolarHBondContact O-OG 2.89Å; S22-R25 PolarHBondContact O-N 3.33Å; S22-R26 PolarHBondContact O-N 3.17Å; S22-R64 PolarHBondContact OG-NE 3.1Å; S22-R64 PolarHBondContact OG-NH2 3.3Å
23	V	47.5	Very low	37.7	Very low	58 Å²	58	120.3 Å²	120.3	35%	0.352	61%	0.608	S	S	.	*	H	α-helix	trans	-70.3	-37.5	177.8	177.6	0	0	0	0	110.1	E19 R25 R26 F199	E19-V23 PolarHBondContact O-N 3Å; V23-R25 VanDerWaalsContact C-N 3.33Å; V23-R25 PolarHBondContact O-N 3.14Å; V23-R26 PolarHBondContact O-N 2.88Å; V23-F199 HydrophobicContact CB-CE1 3.98Å; V23-F199 HydrophobicContact CB-CZ 4.06Å; V23-F199 HydrophobicContact CG1-CE1 4.04Å; V23-F199 HydrophobicContact CG1-CZ 4.25Å; V23-F199 HydrophobicContact CG2-CE1 4.15Å; V23-F199 HydrophobicContact CG2-CZ 3.7Å
24	R	43.6	Very low	37.6	Very low	177 Å²	177	123.5 Å²	123.5	67%	0.668	61%	0.611	S	S	*	*	H	α-helix	trans	-58.3	-40.2	169.5	-81.8	-178.3	171.8	-178.6	-1	113.1	V20 L21 R26	V20-R24 PolarHBondContact O-N 3.35Å; L21-R24 PolarHBondContact O-N 2.99Å; R24-R26 VanDerWaalsContact C-N 3.33Å; R24-R26 PolarHBondContact O-N 2.89Å
25	R	38.1	Very low	37.7	Very low	219 Å²	219	120.4 Å²	120.4	83%	0.826	61%	0.607	S	S	*	*	H	α-helix	trans	-70.9	-22.6	179.4	-76.2	-179.1	-170	177.8	5.2	114	L21 S22 V23 G27	L21-R25 WeakPolarHBondContact O-CG 3.17Å; L21-R25 PolarHBondContact O-N 3.18Å; S22-R25 PolarHBondContact O-N 3.33Å; V23-R25 VanDerWaalsContact C-N 3.33Å; V23-R25 PolarHBondContact O-N 3.14Å; R25-G27 PolarHBondContact O-N 2.87Å
26	R	42.2	Very low	37.6	Very low	159 Å²	159	119.1 Å²	119.1	60%	0.6	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.4	3.8	178.2	-79.2	-170.5	-172.5	-172.9	1.7	114.8	S22 V23 R24 V28	S22-R26 PolarHBondContact O-N 3.17Å; V23-R26 PolarHBondContact O-N 2.88Å; R24-R26 VanDerWaalsContact C-N 3.33Å; R24-R26 PolarHBondContact O-N 2.89Å; R26-V28 PolarHBondContact O-N 2.94Å
27	G	37.5	Very low	37.4	Very low	65 Å²	65	118 Å²	118	67%	0.67	62%	0.618	S	S	*	*			trans	54.7	55.2	166.9	0	0	0	0	0	113.3	R25	R25-G27 PolarHBondContact O-N 2.87Å
28	V	36.1	Very low	37.6	Very low	129 Å²	129	113 Å²	113	78%	0.782	60%	0.6	S	S	*	*			trans	-122.8	76.9	166	-170.5	0	0	0	0	108.4	R26	R26-V28 PolarHBondContact O-N 2.94Å
29	C	29.8	Very low	37.7	Very low	102 Å²	102	110.3 Å²	110.3	69%	0.689	59%	0.593	S	S	*	*			trans	-146.2	55.3	155.3	-152.3	0	0	0	0	108.9
30	T	26.1	Very low	37.2	Very low	120 Å²	120	114 Å²	114	74%	0.736	63%	0.63	S	S	*	*			trans	-85.8	111.4	145.5	51.7	0	0	0	0	104.7	A32	T30-A32 PolarHBondContact O-N 3.31Å
31	Y	31.6	Very low	37.7	Very low	198 Å²	198	116 Å²	116	78%	0.776	66%	0.66	S	S	*	*			trans	-49.8	100	161.8	-67	-91.2	0	0	0	106.8	T33	Y31-T33 PolarHBondContact O-N 2.85Å
32	A	25.9	Very low	38.6	Very low	81 Å²	81	114.1 Å²	114.1	67%	0.669	65%	0.652	S	S	*	*			trans	-69.6	92.2	164.2	0	0	0	0	0	104.3	T30 Y34	T30-A32 PolarHBondContact O-N 3.31Å; A32-Y34 PolarHBondContact O-N 2.99Å
33	T	27.9	Very low	39.6	Very low	123 Å²	123	116.7 Å²	116.7	76%	0.755	66%	0.663	S	S	*	*			trans	-61.5	77.4	166.2	45.2	0	0	0	0	108.3	Y31	Y31-T33 PolarHBondContact O-N 2.85Å
34	Y	29.8	Very low	40.4	Very low	204 Å²	204	118 Å²	118	80%	0.8	67%	0.673	S	S	*	*			trans	-104.5	95.7	148.2	-80.2	-78.6	0	0	0	105.6	A32 M36	A32-Y34 PolarHBondContact O-N 2.99Å; Y34-M36 PolarHBondContact O-N 3.27Å
35	P	33.8	Very low	41.9	Very low	115 Å²	115	111.2 Å²	111.2	75%	0.747	65%	0.65	S	S	*	*			trans	-68	92.9	167.7	28.6	-28	0	0	0	106.1	A37	P35-A37 PolarHBondContact O-N 3.04Å
36	M	38.8	Very low	43.5	Very low	161 Å²	161	102.8 Å²	102.8	79%	0.793	62%	0.623	S	S	*	*			trans	-62.2	91.3	148.2	-73.3	-76.8	-75.5	0	0	104	Y34	Y34-M36 PolarHBondContact O-N 3.27Å
37	A	39	Very low	45.5	Very low	81 Å²	81	95.9 Å²	95.9	67%	0.669	60%	0.597	S	S	*	*	P	Polyproline II helix	trans	-50.8	126.2	178.9	0	0	0	0	0	107.3	P35	P35-A37 PolarHBondContact O-N 3.04Å
38	P	44.5	Very low	47.9	Very low	64 Å²	64	94.4 Å²	94.4	42%	0.416	57%	0.573	S	S	.	*	P	Polyproline II helix	trans	-55	137.5	175.3	21.3	-29.8	0	0	0	107.8	A40 Y47	P38-A40 PolarHBondContact O-N 3.28Å; P38-Y47 HydrophobicContact CB-CE2 4.49Å
39	P	46.4	Very low	50.4	Low	64 Å²	64	89.2 Å²	89.2	42%	0.416	54%	0.54	S	S	.	.	P	Polyproline II helix	trans	-52.6	130.8	176.2	17.8	-26.2	0	0	0	109	G41 T42 Y47	P39-G41 PolarHBondContact O-N 3.42Å; P39-G41 VanDerWaalsContact O-N 3.09Å; P39-T42 WeakPolarHBondContact CD-OG1 3.41Å; P39-T42 HydrophobicContact CG-CG2 4.42Å; P39-T42 WeakPolarHBondContact CG-OG1 3.34Å; P39-T42 PolarHBondContact O-N 2.94Å; P39-T42 VanDerWaalsContact O-N 3.11Å; P39-T42 PolarHBondContact O-OG1 3.23Å; P39-Y47 HydrophobicContact CG-CE2 4.38Å
40	A	37.5	Very low	53.3	Low	113 Å²	113	84.9 Å²	84.9	93%	0.934	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.9	118.5	-168.1	0	0	0	0	0	111.5	P38	P38-A40 PolarHBondContact O-N 3.28Å
41	G	53.4	Low	56.4	Low	87 Å²	87	82.9 Å²	82.9	90%	0.897	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	102	2.8	179.6	0	0	0	0	0	116.8	P39	P39-G41 PolarHBondContact O-N 3.42Å; P39-G41 VanDerWaalsContact O-N 3.09Å
42	T	57.6	Low	59.2	Low	48 Å²	48	74.6 Å²	74.6	29%	0.294	46%	0.462	S	S	.	.			trans	-97.3	136.8	174.7	41.9	0	0	0	0	112.7	P39 Y47	P39-T42 WeakPolarHBondContact CD-OG1 3.41Å; P39-T42 HydrophobicContact CG-CG2 4.42Å; P39-T42 WeakPolarHBondContact CG-OG1 3.34Å; P39-T42 PolarHBondContact O-N 2.94Å; P39-T42 VanDerWaalsContact O-N 3.11Å; P39-T42 PolarHBondContact O-OG1 3.23Å; T42-Y47 HydrophobicContact CG2-CE2 4.45Å
43	D	65.3	Low	62.4	Low	82 Å²	82	70.7 Å²	70.7	44%	0.439	43%	0.43	S	S	.	.			trans	-59.5	120.4	176.4	-178.3	0.3	0	0	0	109.5	D45 T46	D43-D45 PolarHBondContact O-N 3.49Å; D43-D45 WeakPolarHBondContact OD1-CB 3.46Å; D43-D45 PolarHBondContact OD1-N 3.4Å; D43-T46 WeakPolarHBondContact O-CB 3.37Å; D43-T46 PolarHBondContact O-N 3.26Å; D43-T46 PolarHBondContact O-OG1 3.07Å
44	P	64.2	Low	65.6	Low	87 Å²	87	69.5 Å²	69.5	57%	0.565	42%	0.415	S	S	*	.	G	3₁₀ helix	trans	-55.5	-26.1	-178.2	20.7	-33	0	0	0	113.2	T46 Y47	P44-T46 PolarHBondContact O-N 3.46Å; P44-Y47 PolarHBondContact O-N 3.28Å
45	D	73.7	Confident	68.6	Low	34 Å²	34	64 Å²	64	18%	0.182	41%	0.406	C	S	.	.	G	3₁₀ helix	trans	-59.6	-27.2	174.8	-81.7	12	0	0	0	113.2	D43 Y47 I48 P206 R207	D43-D45 PolarHBondContact O-N 3.49Å; D43-D45 WeakPolarHBondContact OD1-CB 3.46Å; D43-D45 PolarHBondContact OD1-N 3.4Å; D45-Y47 VanDerWaalsContact C-N 3.28Å; D45-Y47 PolarHBondContact O-N 3.14Å; D45-I48 HydrophobicContact CB-CD1 4.45Å; D45-I48 PolarHBondContact O-N 3.4Å; D45-P206 HydrophobicContact CB-CB 4.02Å; D45-R207 WeakPolarHBondContact OD2-CG 3.45Å; D45-R207 PolarHBondContact OD2-N 3.47Å
46	T	73.1	Confident	71.5	Confident	41 Å²	41	60.2 Å²	60.2	25%	0.252	38%	0.378	S	S	.	.	G	3₁₀ helix	trans	-63.3	-32.9	-174	-51.7	0	0	0	0	112.5	D43 P44 P346	D43-T46 WeakPolarHBondContact O-CB 3.37Å; D43-T46 PolarHBondContact O-N 3.26Å; D43-T46 PolarHBondContact O-OG1 3.07Å; P44-T46 PolarHBondContact O-N 3.46Å; T46-P346 HydrophobicContact CG2-CB 3.91Å; T46-P346 HydrophobicContact CG2-CG 3.98Å; T46-P346 WeakPolarHBondContact O-CB 3.44Å; T46-P346 WeakPolarHBondContact O-CG 3.3Å
47	Y	83.8	Confident	74.2	Confident	15 Å²	15	53.8 Å²	53.8	6%	0.059	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-103.3	-0.1	-171.6	-62	-68.6	0	0	0	113.9	P38 P39 T42 P44 D45 Y49 M50 N51 P346	P38-Y47 HydrophobicContact CB-CE2 4.49Å; P39-Y47 HydrophobicContact CG-CE2 4.38Å; T42-Y47 HydrophobicContact CG2-CE2 4.45Å; P44-Y47 PolarHBondContact O-N 3.28Å; D45-Y47 VanDerWaalsContact C-N 3.28Å; D45-Y47 PolarHBondContact O-N 3.14Å; Y47-Y49 PolarHBondContact O-N 3.17Å; Y47-M50 HydrophobicContact CD1-CE 3.32Å; Y47-M50 HydrophobicContact CD1-SD 3.99Å; Y47-M50 HydrophobicContact CE1-CE 4.12Å; Y47-M50 HydrophobicContact CG-CE 4.01Å; Y47-M50 PolarHBondContact O-N 2.81Å; Y47-N51 WeakPolarHBondContact O-CB 3.35Å; Y47-N51 VanDerWaalsContact O-CG 3.27Å; Y47-N51 PolarHBondContact O-N 3.21Å; Y47-N51 PolarHBondContact O-ND2 3.36Å; Y47-P346 HydrophobicContact CD1-CB 3.74Å; Y47-P346 HydrophobicContact CE1-CB 3.84Å; Y47-P346 WeakPolarHBondContact CE1-O 3.41Å
48	I	88.3	Confident	77	Confident	33 Å²	33	50 Å²	50	17%	0.169	32%	0.317	C	S	.	.	H	α-helix	trans	-57	-53.7	-173.6	-68.2	-178	0	0	0	111.3	D45 N51 F52 I203 P204 P206	D45-I48 HydrophobicContact CB-CD1 4.45Å; D45-I48 PolarHBondContact O-N 3.4Å; I48-N51 PolarHBondContact O-N 3.48Å; I48-F52 WeakPolarHBondContact O-CB 3.19Å; I48-F52 PolarHBondContact O-N 2.97Å; I48-I203 HydrophobicContact CG2-CG2 3.15Å; I48-P204 HydrophobicContact CD1-CB 4.31Å; I48-P206 HydrophobicContact CB-CG 4.22Å; I48-P206 HydrophobicContact CD1-CG 4.21Å; I48-P206 HydrophobicContact CG2-CG 4.44Å
49	Y	88.6	Confident	79.5	Confident	20 Å²	20	52.3 Å²	52.3	8%	0.078	32%	0.319	C	S	.	.	H	α-helix	trans	-68.4	-35.4	178.7	-68.9	-59.9	0	0	0	113.1	Y47 F52 M53 L196 I203 P206 F208 L209 L342	Y47-Y49 PolarHBondContact O-N 3.17Å; Y49-F52 PolarHBondContact O-N 3.03Å; Y49-M53 WeakPolarHBondContact O-CB 3.26Å; Y49-M53 WeakPolarHBondContact O-CG 3.43Å; Y49-M53 PolarHBondContact O-N 3.15Å; Y49-L196 HydrophobicContact CD1-CD1 3.39Å; Y49-L196 HydrophobicContact CD1-CD2 3.86Å; Y49-L196 HydrophobicContact CD1-CG 4.08Å; Y49-L196 HydrophobicContact CE1-CD1 3.72Å; Y49-L196 HydrophobicContact CE1-CD2 4.02Å; Y49-L196 HydrophobicContact CE1-CG 4.09Å; Y49-I203 HydrophobicContact CD1-CD1 4.28Å; Y49-I203 HydrophobicContact CD1-CG2 4.48Å; Y49-I203 HydrophobicContact CE1-CD1 4.2Å; Y49-I203 HydrophobicContact CE1-CG2 4.22Å; Y49-P206 HydrophobicContact CD2-CG 4.06Å; Y49-P206 HydrophobicContact CE2-CG 3.56Å; Y49-F208 AromaticContact CD2-CZ 3.81Å; Y49-F208 HydrophobicContact CD2-CZ 3.81Å; Y49-F208 HydrophobicContact CE2-CE2 4.38Å; Y49-F208 AromaticContact CE2-CZ 3.82Å; Y49-F208 HydrophobicContact CE2-CZ 3.82Å; Y49-L209 HydrophobicContact CE2-CD2 4.17Å; Y49-L209 WeakPolarHBondContact OH-CD1 3.26Å; Y49-L342 WeakPolarHBondContact CB-O 3.26Å; Y49-L342 HydrophobicContact CD2-CB 4.34Å; Y49-L342 HydrophobicContact CD2-CD2 3.95Å; Y49-L342 HydrophobicContact CE2-CD2 4.01Å
50	M	89.8	Confident	81.8	Confident	11 Å²	11	52.1 Å²	52.1	5%	0.054	31%	0.314	C	S	.	.	H	α-helix	trans	-61.4	-48.8	175.5	-177.7	-169.3	71.3	0	0	110.9	Y47 M53 K54 F159 A347	Y47-M50 HydrophobicContact CD1-CE 3.32Å; Y47-M50 HydrophobicContact CD1-SD 3.99Å; Y47-M50 HydrophobicContact CE1-CE 4.12Å; Y47-M50 HydrophobicContact CG-CE 4.01Å; Y47-M50 PolarHBondContact O-N 2.81Å; M50-M53 PolarHBondContact O-N 2.96Å; M50-K54 HydrophobicContact CG-CD 4.27Å; M50-K54 WeakPolarHBondContact O-CG 3.27Å; M50-K54 PolarHBondContact O-N 3.15Å; M50-F159 HydrophobicContact CG-CD2 3.86Å; M50-F159 HydrophobicContact CG-CE2 3.76Å; M50-F159 HydrophobicContact SD-CE2 4.29Å; M50-A347 HydrophobicContact SD-CB 3.82Å
51	N	90.6	Very high	84.4	Confident	78 Å²	78	46.7 Å²	46.7	42%	0.417	27%	0.27	S	S	.	.	H	α-helix	trans	-65.9	-41.3	-179.5	-70.4	-17.1	0	0	0	111.1	Y47 I48 M53 K54 S55	Y47-N51 WeakPolarHBondContact O-CB 3.35Å; Y47-N51 VanDerWaalsContact O-CG 3.27Å; Y47-N51 PolarHBondContact O-N 3.21Å; Y47-N51 PolarHBondContact O-ND2 3.36Å; I48-N51 PolarHBondContact O-N 3.48Å; N51-M53 VanDerWaalsContact C-N 3.35Å; N51-M53 PolarHBondContact O-N 3.25Å; N51-K54 PolarHBondContact O-N 3.49Å; N51-S55 PolarHBondContact O-N 2.71Å; N51-S55 PolarHBondContact O-OG 3.06Å
52	F	91.8	Very high	86.4	Confident	24 Å²	24	43.8 Å²	43.8	11%	0.105	23%	0.233	C	C	.	.	H	α-helix	trans	-58.4	-44.9	172.9	-177.9	-92.5	0	0	0	112	I48 Y49 K54 S55 H56 F195 L196 F199 I203	I48-F52 WeakPolarHBondContact O-CB 3.19Å; I48-F52 PolarHBondContact O-N 2.97Å; Y49-F52 PolarHBondContact O-N 3.03Å; F52-K54 VanDerWaalsContact C-N 3.32Å; F52-K54 PolarHBondContact O-N 3.4Å; F52-S55 PolarHBondContact O-N 3.35Å; F52-S55 PolarHBondContact O-OG 3.31Å; F52-H56 AromaticContact CD2-CE1 3.55Å; F52-H56 AromaticContact CD2-ND1 3.9Å; F52-H56 AromaticContact CE1-ND1 3.91Å; F52-H56 AromaticContact CE2-CE1 3.15Å; F52-H56 WeakPolarHBondContact CE2-CE1 3.3Å; F52-H56 AromaticContact CE2-ND1 3.76Å; F52-H56 AromaticContact CE2-NE2 3.89Å; F52-H56 AromaticContact CZ-CE1 3.42Å; F52-H56 VanDerWaalsContact CZ-CE1 3.42Å; F52-H56 WeakPolarHBondContact CZ-CE1 3.48Å; F52-H56 AromaticContact CZ-ND1 3.74Å; F52-H56 AromaticContact CZ-NE2 3.92Å; F52-H56 PolarHBondContact O-N 3.33Å; F52-H56 PolarHBondContact O-ND1 2.76Å; F52-F195 HydrophobicContact CE1-CD1 4.13Å; F52-F195 AromaticContact CE1-CE1 3.68Å; F52-F195 HydrophobicContact CE1-CE1 3.68Å; F52-F195 AromaticContact CZ-CE1 3.98Å; F52-F195 HydrophobicContact CZ-CE1 3.98Å; F52-L196 HydrophobicContact CD1-CD1 3.82Å; F52-L196 HydrophobicContact CE1-CD1 4.02Å; F52-F199 HydrophobicContact CE1-CB 4.48Å; F52-F199 HydrophobicContact CE2-CB 4.35Å; F52-F199 HydrophobicContact CZ-CB 3.64Å; F52-F199 HydrophobicContact CZ-CG 4.43Å; F52-I203 HydrophobicContact CB-CD1 4.18Å; F52-I203 HydrophobicContact CD1-CD1 3.68Å; F52-I203 HydrophobicContact CD2-CD1 3.45Å; F52-I203 VanDerWaalsContact CD2-CD1 3.45Å; F52-I203 HydrophobicContact CD2-CG1 3.65Å; F52-I203 HydrophobicContact CE1-CD1 3.87Å; F52-I203 HydrophobicContact CE2-CD1 3.64Å; F52-I203 HydrophobicContact CE2-CG1 3.82Å; F52-I203 HydrophobicContact CG-CD1 3.47Å; F52-I203 VanDerWaalsContact CG-CD1 3.47Å; F52-I203 HydrophobicContact CG-CG1 4.15Å; F52-I203 HydrophobicContact CZ-CD1 3.87Å; F52-I203 HydrophobicContact CZ-CG1 4.46Å
53	M	93.3	Very high	88	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-70.8	-26.4	177.9	-69.2	-64.7	-171.8	0	0	113.3	Y49 M50 N51 L158 F159 I162 I192 L196 V343	Y49-M53 WeakPolarHBondContact O-CB 3.26Å; Y49-M53 WeakPolarHBondContact O-CG 3.43Å; Y49-M53 PolarHBondContact O-N 3.15Å; M50-M53 PolarHBondContact O-N 2.96Å; N51-M53 VanDerWaalsContact C-N 3.35Å; N51-M53 PolarHBondContact O-N 3.25Å; M53-L158 HydrophobicContact CB-CB 4.36Å; M53-L158 PolarHBondContact O-N 3.23Å; M53-L158 HydrophobicContact SD-CB 3.78Å; M53-L158 HydrophobicContact SD-CD1 3.96Å; M53-F159 HydrophobicContact CB-CB 4.22Å; M53-F159 PolarHBondContact O-N 3.17Å; M53-F159 VanDerWaalsContact O-N 3.07Å; M53-I162 HydrophobicContact CB-CD1 4.5Å; M53-I162 HydrophobicContact CE-CD1 4.13Å; M53-I162 HydrophobicContact CG-CD1 4.02Å; M53-I162 HydrophobicContact SD-CD1 4Å; M53-I192 HydrophobicContact CE-CG2 3.87Å; M53-I192 HydrophobicContact SD-CG2 4.36Å; M53-L196 HydrophobicContact CE-CB 3.68Å; M53-L196 HydrophobicContact CE-CD1 3.75Å; M53-L196 HydrophobicContact CE-CD2 3.97Å; M53-L196 HydrophobicContact CE-CG 3.99Å; M53-V343 HydrophobicContact CB-CG1 4.18Å; M53-V343 HydrophobicContact CG-CG1 4.27Å; M53-V343 HydrophobicContact CG-CG2 3.96Å
54	K	93.5	Very high	89.2	Confident	98 Å²	98	46.7 Å²	46.7	43%	0.426	24%	0.238	S	C	.	.	H	α-helix	trans	-74.7	-31.6	173	-76.8	178.3	176.9	178.9	0	112.4	M50 N51 F52 F159	M50-K54 HydrophobicContact CG-CD 4.27Å; M50-K54 WeakPolarHBondContact O-CG 3.27Å; M50-K54 PolarHBondContact O-N 3.15Å; N51-K54 PolarHBondContact O-N 3.49Å; F52-K54 VanDerWaalsContact C-N 3.32Å; F52-K54 PolarHBondContact O-N 3.4Å; K54-F159 HydrophobicContact CG-CB 3.69Å; K54-F159 HydrophobicContact CG-CD1 4.42Å; K54-F159 HydrophobicContact CG-CD2 4.17Å; K54-F159 HydrophobicContact CG-CG 3.84Å
55	S	92.9	Very high	90.5	Very high	88 Å²	88	47.6 Å²	47.6	62%	0.615	25%	0.246	S	C	*	.	H	α-helix	trans	-82.2	-12.5	-178.3	70.9	0	0	0	0	114.2	N51 F52	N51-S55 PolarHBondContact O-N 2.71Å; N51-S55 PolarHBondContact O-OG 3.06Å; F52-S55 PolarHBondContact O-N 3.35Å; F52-S55 PolarHBondContact O-OG 3.31Å
56	H	95	Very high	91.4	Very high	36 Å²	36	48.6 Å²	48.6	17%	0.167	26%	0.256	C	S	.	.	S	Bend	trans	-110.7	141.4	179.4	-66.9	83.6	0	0	0	111.1	F52 S157 L158 F195	F52-H56 AromaticContact CD2-CE1 3.55Å; F52-H56 AromaticContact CD2-ND1 3.9Å; F52-H56 AromaticContact CE1-ND1 3.91Å; F52-H56 AromaticContact CE2-CE1 3.15Å; F52-H56 WeakPolarHBondContact CE2-CE1 3.3Å; F52-H56 AromaticContact CE2-ND1 3.76Å; F52-H56 AromaticContact CE2-NE2 3.89Å; F52-H56 AromaticContact CZ-CE1 3.42Å; F52-H56 VanDerWaalsContact CZ-CE1 3.42Å; F52-H56 WeakPolarHBondContact CZ-CE1 3.48Å; F52-H56 AromaticContact CZ-ND1 3.74Å; F52-H56 AromaticContact CZ-NE2 3.92Å; F52-H56 PolarHBondContact O-N 3.33Å; F52-H56 PolarHBondContact O-ND1 2.76Å; H56-S157 CarbonylContact O-C 3.53Å; H56-S157 WeakPolarHBondContact O-CA 3.38Å; H56-L158 HydrophobicContact CB-CD1 3.87Å; H56-L158 HydrophobicContact CB-CG 4.39Å; H56-L158 PolarHBondContact O-N 3.09Å; H56-F195 HydrophobicContact CB-CE1 4.06Å; H56-F195 HydrophobicContact CB-CZ 4.11Å; H56-F195 AromaticContact CD2-CZ 3.65Å; H56-F195 AromaticContact CG-CE1 3.97Å; H56-F195 AromaticContact CG-CZ 3.93Å
57	S	96.9	Very high	92.4	Very high	26 Å²	26	52.6 Å²	52.6	18%	0.182	27%	0.27	C	S	.	.	B	Isolated β-bridge	trans	-88.4	161.7	-179.6	71	0	0	0	0	112.2	Y59 D60 S156	S57-Y59 PolarHBondContact O-N 3.02Å; S57-Y59 PolarHBondContact OG-N 3.5Å; S57-D60 WeakPolarHBondContact CB-OD2 3.48Å; S57-D60 PolarHBondContact N-OD2 3.46Å; S57-D60 PolarHBondContact O-N 3.17Å; S57-D60 VanDerWaalsContact O-N 3.13Å; S57-D60 PolarHBondContact OG-N 2.8Å; S57-D60 PolarHBondContact OG-OD2 3.39Å; S57-S156 CarbonylContact C-O 3.44Å; S57-S156 VanDerWaalsContact CA-O 3.3Å; S57-S156 WeakPolarHBondContact CA-O 3.32Å
58	C	97	Very high	92.9	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-33.5	169.2	-70.7	0	0	0	0	112.1	D60 A61 M62 I152 P154 S156 L187	C58-D60 VanDerWaalsContact C-N 3.35Å; C58-A61 PolarHBondContact O-N 2.92Å; C58-M62 WeakPolarHBondContact O-CG 3.36Å; C58-I152 VanDerWaalsContact SG-CD1 3.6Å; C58-P154 WeakPolarHBondContact CB-O 3.36Å; C58-P154 PolarHBondContact N-O 2.83Å; C58-S156 PolarHBondContact N-O 3.08Å; C58-S156 PolarHBondContact SG-O 3.3Å; C58-S156 VanDerWaalsContact SG-O 3.4Å; C58-L187 HydrophobicContact CB-CD1 3.68Å
59	Y	95.9	Very high	93.3	Very high	113 Å²	113	53.8 Å²	53.8	44%	0.443	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-39.1	177.7	-175.6	-80.1	0	0	0	112.5	S57 A61 M62 P154	S57-Y59 PolarHBondContact O-N 3.02Å; S57-Y59 PolarHBondContact OG-N 3.5Å; Y59-A61 PolarHBondContact O-N 3.43Å; Y59-M62 VanDerWaalsContact CA-CE 3.48Å; Y59-M62 HydrophobicContact CD2-CE 3.09Å; Y59-M62 HydrophobicContact CE2-CE 3.7Å; Y59-M62 HydrophobicContact CG-CE 3.6Å; Y59-M62 WeakPolarHBondContact O-CB 3.35Å; Y59-M62 PolarHBondContact O-N 2.89Å; Y59-P154 HydrophobicContact CD2-CB 4.38Å; Y59-P154 PolarHBondContact N-O 3.39Å
60	D	94.8	Very high	93.7	Very high	60 Å²	60	56.4 Å²	56.4	32%	0.321	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-29.2	-177.7	-57.6	-45.3	0	0	0	112.6	S57 C58 M62 F195	S57-D60 WeakPolarHBondContact CB-OD2 3.48Å; S57-D60 PolarHBondContact N-OD2 3.46Å; S57-D60 PolarHBondContact O-N 3.17Å; S57-D60 VanDerWaalsContact O-N 3.13Å; S57-D60 PolarHBondContact OG-N 2.8Å; S57-D60 PolarHBondContact OG-OD2 3.39Å; C58-D60 VanDerWaalsContact C-N 3.35Å; D60-M62 VanDerWaalsContact C-N 3.32Å; D60-F195 HydrophobicContact CB-CE2 4.12Å; D60-F195 HydrophobicContact CB-CZ 4.15Å; D60-F195 WeakPolarHBondContact O-CE2 3.37Å
61	A	93.9	Very high	94.1	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-3.3	175.6	0	0	0	0	0	113.7	C58 Y59 L158 L187 R191 F195	C58-A61 PolarHBondContact O-N 2.92Å; Y59-A61 PolarHBondContact O-N 3.43Å; A61-L158 HydrophobicContact CB-CD1 4.15Å; A61-L158 HydrophobicContact CB-CD2 3.65Å; A61-L187 HydrophobicContact CB-CD2 4.16Å; A61-R191 WeakPolarHBondContact O-CG 3.41Å; A61-R191 PolarHBondContact O-NE 3.2Å; A61-R191 PolarHBondContact O-NH2 3.44Å; A61-R191 VanDerWaalsContact O-NH2 3.14Å; A61-F195 HydrophobicContact CB-CB 4.35Å; A61-F195 HydrophobicContact CB-CD2 3.92Å; A61-F195 HydrophobicContact CB-CE2 4.42Å; A61-F195 HydrophobicContact CB-CG 4.12Å
62	M	93.6	Very high	94.4	Very high	26 Å²	26	54.9 Å²	54.9	13%	0.128	28%	0.284	C	S	.	.	S	Bend	trans	-80.2	141.5	176.2	-57.6	-168.2	-67.3	0	0	110.3	C58 Y59 D60 V175 L184 H185	C58-M62 WeakPolarHBondContact O-CG 3.36Å; Y59-M62 VanDerWaalsContact CA-CE 3.48Å; Y59-M62 HydrophobicContact CD2-CE 3.09Å; Y59-M62 HydrophobicContact CE2-CE 3.7Å; Y59-M62 HydrophobicContact CG-CE 3.6Å; Y59-M62 WeakPolarHBondContact O-CB 3.35Å; Y59-M62 PolarHBondContact O-N 2.89Å; D60-M62 VanDerWaalsContact C-N 3.32Å; M62-V175 HydrophobicContact SD-CB 4.42Å; M62-V175 HydrophobicContact SD-CG1 4.26Å; M62-L184 HydrophobicContact CE-CB 4.41Å; M62-L184 HydrophobicContact CE-CD1 4.21Å; M62-L184 HydrophobicContact SD-CB 4.08Å; M62-H185 HydrophobicContact CG-CB 3.9Å; M62-H185 HydrophobicContact SD-CB 3.43Å; M62-H185 WeakPolarHBondContact SD-CB 3.38Å
63	P	91.8	Very high	94.6	Very high	40 Å²	40	54 Å²	54	26%	0.26	28%	0.28	S	S	.	.			trans	-65.9	157.5	171.5	32.1	-37.7	0	0	0	110.4	S65	P63-S65 WeakPolarHBondContact CG-O 3.26Å; P63-S65 PolarHBondContact O-N 3.21Å
64	R	89.9	Confident	94.7	Very high	150 Å²	150	56.8 Å²	56.8	57%	0.566	30%	0.298	S	S	*	.	S	Bend	trans	-59.8	-33.3	178.2	-66.3	-172	-172.5	159.2	6.2	113.1	E18 S22	E18-R64 PolarHBondContact O-NH2 3.03Å; E18-R64 IonicContact OE2-CZ 3.8Å; E18-R64 IonicContact OE2-NH1 2.81Å; E18-R64 PolarHBondContact OE2-NH1 3.14Å; E18-R64 IonicContact OE2-NH2 3.94Å; S22-R64 PolarHBondContact OG-NE 3.1Å; S22-R64 PolarHBondContact OG-NH2 3.3Å
65	S	93.1	Very high	94.9	Very high	107 Å²	107	54.7 Å²	54.7	75%	0.748	29%	0.291	S	S	*	.	S	Bend	trans	-134.5	138.6	175.5	-176.2	0	0	0	0	108.9	P63	P63-S65 WeakPolarHBondContact CG-O 3.26Å; P63-S65 PolarHBondContact O-N 3.21Å
66	S	91.3	Very high	95	Very high	54 Å²	54	53.5 Å²	53.5	38%	0.378	28%	0.275	S	S	.	.			trans	-148.4	151.7	171.7	65	0	0	0	0	111.7	H185	S66-H185 PolarHBondContact OG-ND1 2.81Å
67	K	93.7	Very high	94.9	Very high	126 Å²	126	51.8 Å²	51.8	55%	0.548	27%	0.268	S	S	.	.			trans	-92.7	132.7	170.9	-178.5	176.6	66.5	178.4	0	109.2	N87	K67-N87 WeakPolarHBondContact CE-O 3.39Å; K67-N87 PolarHBondContact NZ-O 3.19Å
68	L	95	Very high	94.6	Very high	53 Å²	53	53.1 Å²	53.1	28%	0.277	27%	0.27	S	S	.	.			trans	-119.9	133.4	173.2	-169.2	74.2	0	0	0	109.9	I70 P93 V183 I186	L68-I70 HydrophobicContact CD2-CD1 3.86Å; L68-I70 HydrophobicContact CD2-CG1 3.94Å; L68-I70 HydrophobicContact CG-CG1 4.23Å; L68-P93 HydrophobicContact CD1-CG 4.41Å; L68-V183 HydrophobicContact CD1-CG1 4.21Å; L68-V183 HydrophobicContact CD2-CB 3.57Å; L68-V183 HydrophobicContact CD2-CG1 3.51Å; L68-V183 VanDerWaalsContact CD2-O 3.3Å; L68-V183 WeakPolarHBondContact CD2-O 3.49Å; L68-I186 HydrophobicContact CD1-CD1 3.78Å; L68-I186 HydrophobicContact CD1-CG1 3.86Å
69	V	96.9	Very high	94.4	Very high	19 Å²	19	58.8 Å²	58.8	12%	0.115	30%	0.295	C	S	.	.			trans	-109.2	126.1	173.4	-178.9	0	0	0	0	107.8	F71 N87 V89 A92 P93	V69-F71 HydrophobicContact CG1-CD1 4.05Å; V69-F71 HydrophobicContact CG1-CE1 3.33Å; V69-F71 HydrophobicContact CG1-CE2 4.45Å; V69-F71 HydrophobicContact CG1-CZ 3.58Å; V69-N87 HydrophobicContact CG2-CB 3.84Å; V69-V89 HydrophobicContact CB-CG2 4.12Å; V69-V89 HydrophobicContact CG2-CG1 4.22Å; V69-V89 HydrophobicContact CG2-CG2 3.82Å; V69-A92 VanDerWaalsContact O-CB 3.24Å; V69-A92 WeakPolarHBondContact O-CB 3.37Å; V69-P93 WeakPolarHBondContact O-CD 3.5Å
70	I	97.3	Very high	94.4	Very high	75 Å²	75	53.4 Å²	53.4	39%	0.385	27%	0.274	S	S	.	.			trans	-120	137.6	177.2	-62.5	168.6	0	0	0	107.4	L68 P93 W95 F102	L68-I70 HydrophobicContact CD2-CD1 3.86Å; L68-I70 HydrophobicContact CD2-CG1 3.94Å; L68-I70 HydrophobicContact CG-CG1 4.23Å; I70-P93 HydrophobicContact CG1-CG 4.37Å; I70-W95 HydrophobicContact CG2-CB 3.82Å; I70-F102 HydrophobicContact CD1-CE1 4.02Å; I70-F102 HydrophobicContact CD1-CZ 4.04Å; I70-F102 HydrophobicContact CG1-CE1 4.36Å; I70-F102 HydrophobicContact CG2-CE1 3.88Å
71	F	97.8	Very high	94.3	Very high	12 Å²	12	50.6 Å²	50.6	5%	0.053	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	136.9	175.2	-58.7	-44.3	0	0	0	111	V69 L75 A80 A83 L84 A92 P93 L94 W95 L106 I134	V69-F71 HydrophobicContact CG1-CD1 4.05Å; V69-F71 HydrophobicContact CG1-CE1 3.33Å; V69-F71 HydrophobicContact CG1-CE2 4.45Å; V69-F71 HydrophobicContact CG1-CZ 3.58Å; F71-L75 HydrophobicContact CB-CD2 4.05Å; F71-L75 HydrophobicContact CD1-CD2 3.6Å; F71-L75 HydrophobicContact CE1-CD2 4.22Å; F71-L75 HydrophobicContact CG-CD2 3.89Å; F71-A80 HydrophobicContact CD2-CB 3.96Å; F71-A80 HydrophobicContact CE2-CB 3.98Å; F71-A80 HydrophobicContact CG-CB 4.43Å; F71-A80 HydrophobicContact CZ-CB 4.46Å; F71-A80 WeakPolarHBondContact CZ-O 3.22Å; F71-A83 HydrophobicContact CE1-CB 3.7Å; F71-A83 HydrophobicContact CZ-CB 3.74Å; F71-L84 HydrophobicContact CE2-CD1 4.48Å; F71-L84 HydrophobicContact CE2-CD2 3.65Å; F71-L84 HydrophobicContact CE2-CG 3.77Å; F71-L84 HydrophobicContact CZ-CD2 3.91Å; F71-L84 HydrophobicContact CZ-CG 4.01Å; F71-A92 HydrophobicContact CD2-CB 3.51Å; F71-A92 HydrophobicContact CE2-CB 3.46Å; F71-A92 VanDerWaalsContact CE2-CB 3.46Å; F71-A92 HydrophobicContact CG-CB 4.27Å; F71-A92 HydrophobicContact CZ-CB 4.19Å; F71-P93 PolarHBondContact N-O 3.24Å; F71-P93 VanDerWaalsContact N-O 3.09Å; F71-L94 HydrophobicContact CB-CD2 3.98Å; F71-L94 WeakPolarHBondContact O-CA 3.41Å; F71-W95 PolarHBondContact O-N 3.09Å; F71-L106 HydrophobicContact CD2-CD2 3.94Å; F71-L106 HydrophobicContact CE2-CD2 4.11Å; F71-I134 HydrophobicContact CB-CD1 3.85Å; F71-I134 HydrophobicContact CD2-CD1 4.43Å; F71-I134 HydrophobicContact CG-CD1 4.45Å
72	D	97.5	Very high	94.2	Very high	45 Å²	45	53.6 Å²	53.6	24%	0.241	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	140.2	164.4	-171.7	-79.8	0	0	0	109.6	T74 L75 W95 S97	D72-T74 PolarHBondContact O-N 2.89Å; D72-T74 VanDerWaalsContact O-N 3.15Å; D72-T74 VanDerWaalsContact OD1-CB 3.26Å; D72-T74 WeakPolarHBondContact OD1-CB 3.4Å; D72-T74 WeakPolarHBondContact OD1-CG2 3.42Å; D72-T74 PolarHBondContact OD1-N 2.8Å; D72-T74 PolarHBondContact OD1-OG1 3.3Å; D72-L75 VanDerWaalsContact O-CB 3.22Å; D72-L75 WeakPolarHBondContact O-CB 3.05Å; D72-L75 PolarHBondContact O-N 2.95Å; D72-W95 CarbonylContact C-O 3.59Å; D72-W95 WeakPolarHBondContact CA-O 3.48Å; D72-S97 WeakPolarHBondContact OD2-CB 3.41Å; D72-S97 PolarHBondContact OD2-OG 3.26Å
73	T	95.7	Very high	94.2	Very high	5 Å²	5	53.6 Å²	53.6	3%	0.031	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-19.4	-178.8	52.6	0	0	0	0	113.7	L75 L94 W95 D96 V103 I134 E135	T73-L75 VanDerWaalsContact C-N 3.31Å; T73-L94 HydrophobicContact CG2-CB 4.28Å; T73-W95 WeakPolarHBondContact CG2-O 3.01Å; T73-W95 PolarHBondContact N-O 3.3Å; T73-D96 HydrophobicContact CG2-CB 4.23Å; T73-V103 HydrophobicContact CG2-CG2 3.6Å; T73-I134 CarbonylContact O-C 3.56Å; T73-I134 WeakPolarHBondContact O-CB 3.21Å; T73-I134 PolarHBondContact O-N 3.22Å; T73-E135 PolarHBondContact O-N 3.44Å
74	T	95.9	Very high	94.3	Very high	60 Å²	60	51.8 Å²	51.8	37%	0.368	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-8.1	176.5	67.5	0	0	0	0	113.8	D72 K133	D72-T74 PolarHBondContact O-N 2.89Å; D72-T74 VanDerWaalsContact O-N 3.15Å; D72-T74 VanDerWaalsContact OD1-CB 3.26Å; D72-T74 WeakPolarHBondContact OD1-CB 3.4Å; D72-T74 WeakPolarHBondContact OD1-CG2 3.42Å; D72-T74 PolarHBondContact OD1-N 2.8Å; D72-T74 PolarHBondContact OD1-OG1 3.3Å; T74-K133 WeakPolarHBondContact O-CD 3.41Å; T74-K133 WeakPolarHBondContact O-CG 3.44Å
75	L	96.6	Very high	94.3	Very high	53 Å²	53	46.6 Å²	46.6	28%	0.277	25%	0.249	S	C	.	.	S	Bend	trans	-64.2	140.8	177.3	-176.6	62.9	0	0	0	110.8	F71 D72 T73 K79 A80 K133 I134	F71-L75 HydrophobicContact CB-CD2 4.05Å; F71-L75 HydrophobicContact CD1-CD2 3.6Å; F71-L75 HydrophobicContact CE1-CD2 4.22Å; F71-L75 HydrophobicContact CG-CD2 3.89Å; D72-L75 VanDerWaalsContact O-CB 3.22Å; D72-L75 WeakPolarHBondContact O-CB 3.05Å; D72-L75 PolarHBondContact O-N 2.95Å; T73-L75 VanDerWaalsContact C-N 3.31Å; L75-K79 HydrophobicContact CD1-CB 4.1Å; L75-K79 HydrophobicContact CD1-CD 4.44Å; L75-K79 HydrophobicContact CG-CB 4.47Å; L75-A80 HydrophobicContact CD2-CB 3.89Å; L75-A80 HydrophobicContact CG-CB 4.38Å; L75-K133 WeakPolarHBondContact O-CA 3.45Å; L75-I134 HydrophobicContact CB-CD1 4.08Å; L75-I134 WeakPolarHBondContact O-CG1 3.43Å; L75-I134 PolarHBondContact O-N 3.3Å
76	Q	95.3	Very high	94.2	Very high	63 Å²	63	45.3 Å²	45.3	29%	0.294	25%	0.245	S	C	.	.	B	Isolated β-bridge	trans	-63.6	137.5	173.7	-75.3	173.7	-26.9	0	0	111.2	K78 K79 A80 H132	Q76-K78 PolarHBondContact O-N 2.71Å; Q76-K79 HydrophobicContact CB-CB 4.33Å; Q76-K79 HydrophobicContact CB-CD 4.2Å; Q76-K79 HydrophobicContact CB-CG 4.22Å; Q76-K79 PolarHBondContact O-N 3.01Å; Q76-K79 VanDerWaalsContact O-N 3.15Å; Q76-A80 PolarHBondContact O-N 2.82Å; Q76-H132 WeakPolarHBondContact CA-O 3.16Å
77	V	93	Very high	94.2	Very high	1 Å²	1	45.7 Å²	45.7	1%	0.006	24%	0.242	C	C	.	.	H	α-helix	trans	-61.5	-45.7	-174.6	175.5	0	0	0	0	111.9	K79 A80 F81 I114 L129 H132 K133 I134 W137	V77-K79 VanDerWaalsContact C-N 3.32Å; V77-K79 PolarHBondContact O-N 3.23Å; V77-A80 WeakPolarHBondContact O-CB 3.28Å; V77-A80 PolarHBondContact O-N 2.8Å; V77-A80 VanDerWaalsContact O-N 3.15Å; V77-F81 HydrophobicContact CG1-CD2 3.69Å; V77-F81 HydrophobicContact CG1-CE2 3.29Å; V77-F81 HydrophobicContact CG1-CZ 4.34Å; V77-F81 VanDerWaalsContact O-CD2 3.27Å; V77-F81 WeakPolarHBondContact O-CD2 3.13Å; V77-F81 PolarHBondContact O-N 2.78Å; V77-I114 HydrophobicContact CG1-CD1 3.56Å; V77-L129 HydrophobicContact CG1-CD1 3.81Å; V77-H132 HydrophobicContact CG2-CB 4.2Å; V77-H132 WeakPolarHBondContact CG2-O 3.4Å; V77-H132 PolarHBondContact N-O 3.08Å; V77-K133 VanDerWaalsContact CG2-C 3.45Å; V77-K133 WeakPolarHBondContact CG2-O 3.36Å; V77-I134 HydrophobicContact CG2-CG1 4.25Å; V77-W137 HydrophobicContact CG2-CB 4.12Å
78	K	91.2	Very high	94	Very high	54 Å²	54	41.9 Å²	41.9	24%	0.235	24%	0.239	C	C	.	.	H	α-helix	trans	-53.2	-46.9	173.6	178.7	173.4	175.9	175.8	0	112.5	Q76 F81 F82 L129 E130 Y275	Q76-K78 PolarHBondContact O-N 2.71Å; K78-F81 PolarHBondContact O-N 2.78Å; K78-F82 HydrophobicContact CG-CE1 4.33Å; K78-F82 HydrophobicContact CG-CZ 4.43Å; K78-F82 WeakPolarHBondContact O-CD1 3.3Å; K78-F82 PolarHBondContact O-N 3.37Å; K78-F82 VanDerWaalsContact O-N 3.07Å; K78-L129 WeakPolarHBondContact CB-O 3.02Å; K78-L129 PolarHBondContact N-O 2.8Å; K78-E130 HydrophobicContact CD-CB 4.22Å; K78-E130 HydrophobicContact CD-CG 4.06Å; K78-E130 IonicContact NZ-OE1 2.72Å; K78-E130 PolarHBondContact NZ-OE1 3.3Å; K78-E130 IonicContact NZ-OE2 2.93Å; K78-E130 PolarHBondContact NZ-OE2 3.13Å; K78-Y275 WeakPolarHBondContact CE-OH 3.46Å
79	K	93.3	Very high	93.8	Very high	119 Å²	119	40.9 Å²	40.9	52%	0.517	24%	0.235	S	C	.	.	H	α-helix	trans	-65.3	-39.5	178.7	-69.4	-179.2	177	155.2	0	111.8	L75 Q76 V77 F82 A83	L75-K79 HydrophobicContact CD1-CB 4.1Å; L75-K79 HydrophobicContact CD1-CD 4.44Å; L75-K79 HydrophobicContact CG-CB 4.47Å; Q76-K79 HydrophobicContact CB-CB 4.33Å; Q76-K79 HydrophobicContact CB-CD 4.2Å; Q76-K79 HydrophobicContact CB-CG 4.22Å; Q76-K79 PolarHBondContact O-N 3.01Å; Q76-K79 VanDerWaalsContact O-N 3.15Å; V77-K79 VanDerWaalsContact C-N 3.32Å; V77-K79 PolarHBondContact O-N 3.23Å; K79-F82 PolarHBondContact O-N 2.92Å; K79-A83 WeakPolarHBondContact O-CB 3.26Å; K79-A83 PolarHBondContact O-N 2.96Å
80	A	94.9	Very high	93.5	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-61.9	-46.6	177.8	0	0	0	0	0	111.8	F71 L75 Q76 V77 F82 A83 L84 L106 I134	F71-A80 HydrophobicContact CD2-CB 3.96Å; F71-A80 HydrophobicContact CE2-CB 3.98Å; F71-A80 HydrophobicContact CG-CB 4.43Å; F71-A80 HydrophobicContact CZ-CB 4.46Å; F71-A80 WeakPolarHBondContact CZ-O 3.22Å; L75-A80 HydrophobicContact CD2-CB 3.89Å; L75-A80 HydrophobicContact CG-CB 4.38Å; Q76-A80 PolarHBondContact O-N 2.82Å; V77-A80 WeakPolarHBondContact O-CB 3.28Å; V77-A80 PolarHBondContact O-N 2.8Å; V77-A80 VanDerWaalsContact O-N 3.15Å; A80-F82 PolarHBondContact O-N 2.98Å; A80-A83 PolarHBondContact O-N 2.95Å; A80-L84 WeakPolarHBondContact O-CG 3.28Å; A80-L84 PolarHBondContact O-N 3.26Å; A80-L106 HydrophobicContact CB-CD2 3.61Å; A80-I134 HydrophobicContact CB-CD1 3.83Å; A80-I134 HydrophobicContact CB-CG1 4.33Å
81	F	93.1	Very high	93.4	Very high	1 Å²	1	40.7 Å²	40.7	0%	0.004	23%	0.229	C	C	.	.	H	α-helix	trans	-66	-37.6	176.7	-70.9	-58.3	0	0	0	112.9	V77 K78 A83 L84 V85 L106 D110 F111 I114 L129 I267	V77-F81 HydrophobicContact CG1-CD2 3.69Å; V77-F81 HydrophobicContact CG1-CE2 3.29Å; V77-F81 HydrophobicContact CG1-CZ 4.34Å; V77-F81 VanDerWaalsContact O-CD2 3.27Å; V77-F81 WeakPolarHBondContact O-CD2 3.13Å; V77-F81 PolarHBondContact O-N 2.78Å; K78-F81 PolarHBondContact O-N 2.78Å; F81-A83 VanDerWaalsContact C-N 3.33Å; F81-A83 PolarHBondContact O-N 3Å; F81-L84 HydrophobicContact CD1-CD1 3.9Å; F81-L84 HydrophobicContact CE1-CD1 4.28Å; F81-L84 WeakPolarHBondContact O-CB 3.13Å; F81-L84 PolarHBondContact O-N 2.93Å; F81-V85 WeakPolarHBondContact O-CG2 3.34Å; F81-V85 PolarHBondContact O-N 3.23Å; F81-V85 VanDerWaalsContact O-N 3.11Å; F81-L106 HydrophobicContact CE1-CD1 4.22Å; F81-L106 HydrophobicContact CE1-CD2 4.23Å; F81-L106 HydrophobicContact CE1-CG 4.09Å; F81-L106 HydrophobicContact CZ-CD1 3.89Å; F81-L106 HydrophobicContact CZ-CD2 4.42Å; F81-L106 HydrophobicContact CZ-CG 4.27Å; F81-D110 HydrophobicContact CZ-CB 4.22Å; F81-F111 HydrophobicContact CB-CD2 4.49Å; F81-F111 HydrophobicContact CD1-CB 3.92Å; F81-F111 HydrophobicContact CD1-CD2 4.16Å; F81-F111 HydrophobicContact CD1-CG 4.2Å; F81-F111 HydrophobicContact CD2-CB 4.43Å; F81-F111 AromaticContact CD2-CD2 3.47Å; F81-F111 HydrophobicContact CD2-CD2 3.47Å; F81-F111 VanDerWaalsContact CD2-CD2 3.47Å; F81-F111 HydrophobicContact CD2-CE2 4.12Å; F81-F111 HydrophobicContact CD2-CG 4.28Å; F81-F111 HydrophobicContact CE1-CB 3.51Å; F81-F111 HydrophobicContact CE1-CD2 4.34Å; F81-F111 HydrophobicContact CE1-CG 4.24Å; F81-F111 HydrophobicContact CE2-CB 3.99Å; F81-F111 AromaticContact CE2-CD2 3.58Å; F81-F111 HydrophobicContact CE2-CD2 3.58Å; F81-F111 HydrophobicContact CE2-CG 4.23Å; F81-F111 HydrophobicContact CG-CB 4.41Å; F81-F111 AromaticContact CG-CD2 3.78Å; F81-F111 HydrophobicContact CG-CD2 3.78Å; F81-F111 HydrophobicContact CG-CE2 4.4Å; F81-F111 HydrophobicContact CG-CG 4.27Å; F81-F111 VanDerWaalsContact CZ-CA 3.49Å; F81-F111 HydrophobicContact CZ-CB 3.53Å; F81-F111 HydrophobicContact CZ-CD2 4.06Å; F81-F111 HydrophobicContact CZ-CG 4.24Å; F81-I114 HydrophobicContact CE2-CD1 3.69Å; F81-I114 HydrophobicContact CZ-CD1 4.11Å; F81-L129 HydrophobicContact CD2-CD1 4.21Å; F81-L129 HydrophobicContact CE2-CD1 4.33Å; F81-I267 HydrophobicContact CB-CD1 4.33Å; F81-I267 HydrophobicContact CD1-CD1 3.85Å; F81-I267 HydrophobicContact CG-CD1 4.41Å
82	F	91.4	Very high	93.3	Very high	62 Å²	62	40.1 Å²	40.1	27%	0.272	23%	0.227	S	C	.	.	H	α-helix	trans	-65.3	-39.2	174.6	-80.3	28.6	0	0	0	111.3	K78 K79 A80 L84 V85 A86 A270 K273 Y275	K78-F82 HydrophobicContact CG-CE1 4.33Å; K78-F82 HydrophobicContact CG-CZ 4.43Å; K78-F82 WeakPolarHBondContact O-CD1 3.3Å; K78-F82 PolarHBondContact O-N 3.37Å; K78-F82 VanDerWaalsContact O-N 3.07Å; K79-F82 PolarHBondContact O-N 2.92Å; A80-F82 PolarHBondContact O-N 2.98Å; F82-L84 VanDerWaalsContact C-N 3.34Å; F82-L84 PolarHBondContact O-N 3.34Å; F82-V85 PolarHBondContact O-N 3.28Å; F82-A86 WeakPolarHBondContact O-CB 3.41Å; F82-A86 PolarHBondContact O-N 3.28Å; F82-A270 HydrophobicContact CD1-CB 4.41Å; F82-A270 HydrophobicContact CE1-CB 4.3Å; F82-A270 WeakPolarHBondContact CE1-O 3.43Å; F82-K273 HydrophobicContact CE2-CG 4.42Å; F82-K273 HydrophobicContact CZ-CG 3.99Å; F82-Y275 HydrophobicContact CE1-CE1 4.19Å; F82-Y275 HydrophobicContact CZ-CE1 4.3Å
83	A	93.4	Very high	93.3	Very high	27 Å²	27	38 Å²	38	22%	0.223	22%	0.215	C	C	.	.	H	α-helix	trans	-65.4	-35.6	174.8	0	0	0	0	0	112.2	F71 K79 A80 F81 N87	F71-A83 HydrophobicContact CE1-CB 3.7Å; F71-A83 HydrophobicContact CZ-CB 3.74Å; K79-A83 WeakPolarHBondContact O-CB 3.26Å; K79-A83 PolarHBondContact O-N 2.96Å; A80-A83 PolarHBondContact O-N 2.95Å; F81-A83 VanDerWaalsContact C-N 3.33Å; F81-A83 PolarHBondContact O-N 3Å; A83-N87 VanDerWaalsContact O-CB 3.29Å; A83-N87 WeakPolarHBondContact O-CB 3.11Å; A83-N87 PolarHBondContact O-N 3.13Å; A83-N87 PolarHBondContact O-ND2 3.16Å
84	L	92.9	Very high	93.3	Very high	1 Å²	1	37.8 Å²	37.8	1%	0.005	21%	0.214	C	C	.	.	H	α-helix	trans	-60.1	-49	172.6	-71.5	179.1	0	0	0	111.1	F71 A80 F81 F82 N87 G88 V89 A92	F71-L84 HydrophobicContact CE2-CD1 4.48Å; F71-L84 HydrophobicContact CE2-CD2 3.65Å; F71-L84 HydrophobicContact CE2-CG 3.77Å; F71-L84 HydrophobicContact CZ-CD2 3.91Å; F71-L84 HydrophobicContact CZ-CG 4.01Å; A80-L84 WeakPolarHBondContact O-CG 3.28Å; A80-L84 PolarHBondContact O-N 3.26Å; F81-L84 HydrophobicContact CD1-CD1 3.9Å; F81-L84 HydrophobicContact CE1-CD1 4.28Å; F81-L84 WeakPolarHBondContact O-CB 3.13Å; F81-L84 PolarHBondContact O-N 2.93Å; F82-L84 VanDerWaalsContact C-N 3.34Å; F82-L84 PolarHBondContact O-N 3.34Å; L84-N87 PolarHBondContact O-N 3.46Å; L84-G88 PolarHBondContact O-N 3.09Å; L84-G88 VanDerWaalsContact O-N 3.09Å; L84-V89 CarbonylContact C-O 3.45Å; L84-V89 HydrophobicContact CB-CG2 4.42Å; L84-V89 WeakPolarHBondContact CB-O 3.37Å; L84-V89 HydrophobicContact CD2-CG2 3.56Å; L84-V89 PolarHBondContact O-N 3.48Å; L84-A92 HydrophobicContact CD2-CB 3.84Å
85	V	90.3	Very high	93.3	Very high	42 Å²	42	38 Å²	38	26%	0.255	21%	0.208	S	C	.	.	H	α-helix	trans	-61	-52.5	177.2	173.1	0	0	0	0	111	F81 F82 N87 G88 I267 A270 A271	F81-V85 WeakPolarHBondContact O-CG2 3.34Å; F81-V85 PolarHBondContact O-N 3.23Å; F81-V85 VanDerWaalsContact O-N 3.11Å; F82-V85 PolarHBondContact O-N 3.28Å; V85-N87 PolarHBondContact O-N 3.12Å; V85-G88 PolarHBondContact O-N 3.24Å; V85-I267 HydrophobicContact CG2-CD1 4.49Å; V85-I267 HydrophobicContact CG2-CG1 3.74Å; V85-A270 HydrophobicContact CG2-CB 4.46Å; V85-A271 HydrophobicContact CG1-CB 3.52Å; V85-A271 HydrophobicContact CG2-CB 4.39Å
86	A	90.8	Very high	93.2	Very high	79 Å²	79	36.6 Å²	36.6	65%	0.653	20%	0.201	S	C	*	.	H	α-helix	trans	-61	-29.8	-177.3	0	0	0	0	0	112.8	F82	F82-A86 WeakPolarHBondContact O-CB 3.41Å; F82-A86 PolarHBondContact O-N 3.28Å
87	N	91.7	Very high	93.2	Very high	62 Å²	62	36.3 Å²	36.3	33%	0.332	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-1.1	176.7	-75.8	-80.8	0	0	0	113.9	K67 V69 A83 L84 V85 V89	K67-N87 WeakPolarHBondContact CE-O 3.39Å; K67-N87 PolarHBondContact NZ-O 3.19Å; V69-N87 HydrophobicContact CG2-CB 3.84Å; A83-N87 VanDerWaalsContact O-CB 3.29Å; A83-N87 WeakPolarHBondContact O-CB 3.11Å; A83-N87 PolarHBondContact O-N 3.13Å; A83-N87 PolarHBondContact O-ND2 3.16Å; L84-N87 PolarHBondContact O-N 3.46Å; V85-N87 PolarHBondContact O-N 3.12Å; N87-V89 HydrophobicContact CB-CG1 4.48Å; N87-V89 HydrophobicContact CB-CG2 3.98Å; N87-V89 PolarHBondContact O-N 3.02Å
88	G	89.1	Confident	93.3	Very high	46 Å²	46	43.5 Å²	43.5	47%	0.474	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.1	22.3	-177.4	0	0	0	0	0	113.9	L84 V85	L84-G88 PolarHBondContact O-N 3.09Å; L84-G88 VanDerWaalsContact O-N 3.09Å; V85-G88 PolarHBondContact O-N 3.24Å
89	V	91.6	Very high	93.3	Very high	32 Å²	32	46.4 Å²	46.4	19%	0.194	26%	0.255	C	S	.	.			trans	-106.4	147.1	-177.5	-64.4	0	0	0	0	111.4	V69 L84 N87	V69-V89 HydrophobicContact CB-CG2 4.12Å; V69-V89 HydrophobicContact CG2-CG1 4.22Å; V69-V89 HydrophobicContact CG2-CG2 3.82Å; L84-V89 CarbonylContact C-O 3.45Å; L84-V89 HydrophobicContact CB-CG2 4.42Å; L84-V89 WeakPolarHBondContact CB-O 3.37Å; L84-V89 HydrophobicContact CD2-CG2 3.56Å; L84-V89 PolarHBondContact O-N 3.48Å; N87-V89 HydrophobicContact CB-CG1 4.48Å; N87-V89 HydrophobicContact CB-CG2 3.98Å; N87-V89 PolarHBondContact O-N 3.02Å
90	R	91	Very high	93.3	Very high	82 Å²	82	46.8 Å²	46.8	31%	0.309	26%	0.258	S	S	.	.	S	Bend	trans	-102.6	-5.9	-173.4	-61.1	-179.9	-176.6	179.8	1	114.1	I108 F264 H318	R90-I108 HydrophobicContact CB-CD1 4.03Å; R90-I108 HydrophobicContact CG-CD1 4.25Å; R90-F264 HydrophobicContact CG-CD2 4.08Å; R90-F264 HydrophobicContact CG-CE2 4.16Å; R90-F264 VanDerWaalsContact NE-CD2 3.26Å; R90-F264 VanDerWaalsContact NE-CE2 3.28Å; R90-H318 PolarHBondContact NH1-NE2 3.36Å
91	A	94.4	Very high	93.2	Very high	9 Å²	9	49.2 Å²	49.2	7%	0.074	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.7	154.3	177.6	0	0	0	0	0	109.7	M105 L106 T107 R172	A91-M105 HydrophobicContact CB-CE 4.05Å; A91-L106 CarbonylContact C-O 3.49Å; A91-L106 WeakPolarHBondContact CA-O 3.29Å; A91-T107 HydrophobicContact CB-CG2 4.02Å; A91-R172 HydrophobicContact CB-CG 3.88Å
92	A	97	Very high	93.2	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	140.4	175.6	0	0	0	0	0	110.3	V69 F71 L84 M105 L106	V69-A92 VanDerWaalsContact O-CB 3.24Å; V69-A92 WeakPolarHBondContact O-CB 3.37Å; F71-A92 HydrophobicContact CD2-CB 3.51Å; F71-A92 HydrophobicContact CE2-CB 3.46Å; F71-A92 VanDerWaalsContact CE2-CB 3.46Å; F71-A92 HydrophobicContact CG-CB 4.27Å; F71-A92 HydrophobicContact CZ-CB 4.19Å; L84-A92 HydrophobicContact CD2-CB 3.84Å; A92-M105 WeakPolarHBondContact O-CA 3.43Å; A92-L106 PolarHBondContact N-O 2.98Å; A92-L106 PolarHBondContact O-N 3.29Å
93	P	96.7	Very high	93.2	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	150.4	166.5	-15.8	32.2	0	0	0	110.7	L68 V69 I70 F71 F102 M105 V183 I186	L68-P93 HydrophobicContact CD1-CG 4.41Å; V69-P93 WeakPolarHBondContact O-CD 3.5Å; I70-P93 HydrophobicContact CG1-CG 4.37Å; F71-P93 PolarHBondContact N-O 3.24Å; F71-P93 VanDerWaalsContact N-O 3.09Å; P93-F102 HydrophobicContact CB-CD1 3.85Å; P93-F102 HydrophobicContact CB-CE1 4.02Å; P93-M105 HydrophobicContact CB-SD 4.05Å; P93-M105 HydrophobicContact CG-CE 4.3Å; P93-M105 HydrophobicContact CG-SD 4.1Å; P93-V183 HydrophobicContact CB-CG2 4.32Å; P93-V183 HydrophobicContact CG-CG1 4.03Å; P93-V183 HydrophobicContact CG-CG2 4.29Å; P93-I186 HydrophobicContact CG-CD1 4.37Å
94	L	96.3	Very high	93.2	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	120.7	179.9	-62.9	-179.9	0	0	0	110.4	F71 T73 F102 V103 G104 L106 I134	F71-L94 HydrophobicContact CB-CD2 3.98Å; F71-L94 WeakPolarHBondContact O-CA 3.41Å; T73-L94 HydrophobicContact CG2-CB 4.28Å; L94-F102 CarbonylContact O-C 3.56Å; L94-F102 VanDerWaalsContact O-CA 3.27Å; L94-F102 WeakPolarHBondContact O-CA 3.19Å; L94-V103 HydrophobicContact CB-CG2 4Å; L94-V103 PolarHBondContact O-N 3.32Å; L94-G104 PolarHBondContact N-O 2.9Å; L94-L106 HydrophobicContact CD1-CB 4.25Å; L94-L106 HydrophobicContact CD2-CB 3.84Å; L94-L106 HydrophobicContact CG-CB 4.2Å; L94-I134 HydrophobicContact CD1-CG2 3.58Å; L94-I134 HydrophobicContact CD2-CD1 3.92Å; L94-I134 HydrophobicContact CD2-CG2 3.84Å; L94-I134 HydrophobicContact CG-CG2 4.31Å
95	W	96.1	Very high	93.2	Very high	66 Å²	66	49.5 Å²	49.5	25%	0.25	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	126.3	176.9	177.7	-100.1	0	0	0	110.2	I70 F71 D72 T73 S97 Q100 F102	I70-W95 HydrophobicContact CG2-CB 3.82Å; F71-W95 PolarHBondContact O-N 3.09Å; D72-W95 CarbonylContact C-O 3.59Å; D72-W95 WeakPolarHBondContact CA-O 3.48Å; T73-W95 WeakPolarHBondContact CG2-O 3.01Å; T73-W95 PolarHBondContact N-O 3.3Å; W95-S97 PolarHBondContact NE1-OG 3.02Å; W95-Q100 HydrophobicContact CH2-CB 4.4Å; W95-Q100 VanDerWaalsContact CH2-O 3.27Å; W95-Q100 WeakPolarHBondContact CH2-O 3.41Å; W95-Q100 HydrophobicContact CZ2-CB 4.21Å; W95-F102 HydrophobicContact CB-CD1 4.49Å; W95-F102 HydrophobicContact CB-CE1 4.31Å; W95-F102 HydrophobicContact CE3-CD1 4.1Å; W95-F102 AromaticContact CE3-CD2 4Å; W95-F102 HydrophobicContact CE3-CD2 4Å; W95-F102 AromaticContact CE3-CE1 3.94Å; W95-F102 HydrophobicContact CE3-CE1 3.94Å; W95-F102 AromaticContact CE3-CE2 3.81Å; W95-F102 HydrophobicContact CE3-CE2 3.81Å; W95-F102 HydrophobicContact CE3-CG 4.13Å; W95-F102 AromaticContact CE3-CZ 3.78Å; W95-F102 HydrophobicContact CE3-CZ 3.78Å; W95-F102 HydrophobicContact CZ3-CD2 4.06Å; W95-F102 AromaticContact CZ3-CE2 3.85Å; W95-F102 HydrophobicContact CZ3-CE2 3.85Å; W95-F102 HydrophobicContact CZ3-CZ 4.23Å
96	D	94.7	Very high	93.5	Very high	23 Å²	23	47.6 Å²	47.6	12%	0.123	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	110.1	171.4	-172.2	-40.4	0	0	0	109.2	T73 K98 L99 Q100 C101 V103	T73-D96 HydrophobicContact CG2-CB 4.23Å; D96-K98 VanDerWaalsContact C-N 3.27Å; D96-K98 PolarHBondContact O-N 3.14Å; D96-K98 WeakPolarHBondContact OD1-CA 3.49Å; D96-K98 WeakPolarHBondContact OD1-CB 3.45Å; D96-K98 PolarHBondContact OD1-N 2.92Å; D96-L99 HydrophobicContact CB-CB 4.15Å; D96-L99 PolarHBondContact O-N 2.65Å; D96-L99 PolarHBondContact OD1-N 2.91Å; D96-Q100 VanDerWaalsContact O-CA 3.32Å; D96-Q100 WeakPolarHBondContact O-CA 3.37Å; D96-Q100 PolarHBondContact O-N 3.01Å; D96-C101 PolarHBondContact N-O 3.09Å; D96-C101 PolarHBondContact O-N 2.91Å; D96-V103 HydrophobicContact CB-CG1 3.51Å; D96-V103 HydrophobicContact CB-CG2 4.24Å
97	S	95.2	Very high	93.6	Very high	56 Å²	56	45.2 Å²	45.2	39%	0.392	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-22.3	179.8	-73.4	0	0	0	0	113.9	D72 W95 Q100	D72-S97 WeakPolarHBondContact OD2-CB 3.41Å; D72-S97 PolarHBondContact OD2-OG 3.26Å; W95-S97 PolarHBondContact NE1-OG 3.02Å; S97-Q100 PolarHBondContact O-NE2 2.89Å
98	K	93.9	Very high	93.7	Very high	152 Å²	152	42.9 Å²	42.9	66%	0.661	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-42.6	176.7	-59	168.5	-173.4	155.5	0	110.3	D96 E135	D96-K98 VanDerWaalsContact C-N 3.27Å; D96-K98 PolarHBondContact O-N 3.14Å; D96-K98 WeakPolarHBondContact OD1-CA 3.49Å; D96-K98 WeakPolarHBondContact OD1-CB 3.45Å; D96-K98 PolarHBondContact OD1-N 2.92Å; K98-E135 IonicContact NZ-OE2 3.1Å; K98-E135 PolarHBondContact NZ-OE2 3.46Å; K98-E135 VanDerWaalsContact NZ-OE2 3.1Å
99	L	91.1	Very high	93.9	Very high	116 Å²	116	43 Å²	43	61%	0.607	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.9	-9.9	179.9	-59.8	178.3	0	0	0	113.6	D96 C101 V103	D96-L99 HydrophobicContact CB-CB 4.15Å; D96-L99 PolarHBondContact O-N 2.65Å; D96-L99 PolarHBondContact OD1-N 2.91Å; L99-C101 PolarHBondContact O-N 3.27Å; L99-V103 HydrophobicContact CD1-CG1 4.26Å
100	Q	93.1	Very high	93.9	Very high	126 Å²	126	42.5 Å²	42.5	59%	0.589	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.7	43.1	-176	-67.2	-70.9	-61.7	0	0	112.4	W95 D96 S97	W95-Q100 HydrophobicContact CH2-CB 4.4Å; W95-Q100 VanDerWaalsContact CH2-O 3.27Å; W95-Q100 WeakPolarHBondContact CH2-O 3.41Å; W95-Q100 HydrophobicContact CZ2-CB 4.21Å; D96-Q100 VanDerWaalsContact O-CA 3.32Å; D96-Q100 WeakPolarHBondContact O-CA 3.37Å; D96-Q100 PolarHBondContact O-N 3.01Å; S97-Q100 PolarHBondContact O-NE2 2.89Å
101	C	92.8	Very high	94	Very high	52 Å²	52	38.7 Å²	38.7	35%	0.351	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	163.4	179.9	69.2	0	0	0	0	113.2	D96 L99	D96-C101 PolarHBondContact N-O 3.09Å; D96-C101 PolarHBondContact O-N 2.91Å; L99-C101 PolarHBondContact O-N 3.27Å
102	F	93.9	Very high	93.9	Very high	36 Å²	36	38.3 Å²	38.3	16%	0.158	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	119	172.2	-67.7	-79.2	0	0	0	111	I70 P93 L94 W95 L149 I176 G181 V183	I70-F102 HydrophobicContact CD1-CE1 4.02Å; I70-F102 HydrophobicContact CD1-CZ 4.04Å; I70-F102 HydrophobicContact CG1-CE1 4.36Å; I70-F102 HydrophobicContact CG2-CE1 3.88Å; P93-F102 HydrophobicContact CB-CD1 3.85Å; P93-F102 HydrophobicContact CB-CE1 4.02Å; L94-F102 CarbonylContact O-C 3.56Å; L94-F102 VanDerWaalsContact O-CA 3.27Å; L94-F102 WeakPolarHBondContact O-CA 3.19Å; W95-F102 HydrophobicContact CB-CD1 4.49Å; W95-F102 HydrophobicContact CB-CE1 4.31Å; W95-F102 HydrophobicContact CE3-CD1 4.1Å; W95-F102 AromaticContact CE3-CD2 4Å; W95-F102 HydrophobicContact CE3-CD2 4Å; W95-F102 AromaticContact CE3-CE1 3.94Å; W95-F102 HydrophobicContact CE3-CE1 3.94Å; W95-F102 AromaticContact CE3-CE2 3.81Å; W95-F102 HydrophobicContact CE3-CE2 3.81Å; W95-F102 HydrophobicContact CE3-CG 4.13Å; W95-F102 AromaticContact CE3-CZ 3.78Å; W95-F102 HydrophobicContact CE3-CZ 3.78Å; W95-F102 HydrophobicContact CZ3-CD2 4.06Å; W95-F102 AromaticContact CZ3-CE2 3.85Å; W95-F102 HydrophobicContact CZ3-CE2 3.85Å; W95-F102 HydrophobicContact CZ3-CZ 4.23Å; F102-L149 HydrophobicContact CB-CD2 3.44Å; F102-L149 VanDerWaalsContact CB-CD2 3.44Å; F102-I176 HydrophobicContact CD2-CD1 4.41Å; F102-G181 WeakPolarHBondContact CE2-O 3.41Å; F102-V183 HydrophobicContact CD1-CG2 4.02Å; F102-V183 HydrophobicContact CD2-CG2 3.92Å; F102-V183 HydrophobicContact CE1-CG2 3.65Å; F102-V183 HydrophobicContact CE2-CG2 3.57Å; F102-V183 HydrophobicContact CG-CG2 4.14Å; F102-V183 HydrophobicContact CZ-CB 4.41Å; F102-V183 HydrophobicContact CZ-CG2 3.42Å; F102-V183 VanDerWaalsContact CZ-CG2 3.42Å
103	V	92.1	Very high	93.7	Very high	29 Å²	29	39 Å²	39	18%	0.176	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	-15.1	-172.7	-64.5	0	0	0	0	113.8	T73 L94 D96 L99 R138	T73-V103 HydrophobicContact CG2-CG2 3.6Å; L94-V103 HydrophobicContact CB-CG2 4Å; L94-V103 PolarHBondContact O-N 3.32Å; D96-V103 HydrophobicContact CB-CG1 3.51Å; D96-V103 HydrophobicContact CB-CG2 4.24Å; L99-V103 HydrophobicContact CD1-CG1 4.26Å; V103-R138 PolarHBondContact O-NH2 3.17Å
104	G	92.6	Very high	93.5	Very high	3 Å²	3	39.1 Å²	39.1	3%	0.031	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	177.1	-171.3	-174.1	0	0	0	0	0	114.5	L94	L94-G104 PolarHBondContact N-O 2.9Å
105	M	94.1	Very high	93.3	Very high	28 Å²	28	39.1 Å²	39.1	14%	0.138	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	142.2	170.5	-63.4	-64.7	-62.9	0	0	108.4	A91 A92 P93 T107 L149 R172 P174 I186	A91-M105 HydrophobicContact CB-CE 4.05Å; A92-M105 WeakPolarHBondContact O-CA 3.43Å; P93-M105 HydrophobicContact CB-SD 4.05Å; P93-M105 HydrophobicContact CG-CE 4.3Å; P93-M105 HydrophobicContact CG-SD 4.1Å; M105-T107 HydrophobicContact CB-CG2 4.19Å; M105-L149 HydrophobicContact CG-CD1 3.84Å; M105-L149 HydrophobicContact SD-CD1 4.28Å; M105-R172 HydrophobicContact CE-CB 4.41Å; M105-P174 HydrophobicContact SD-CB 4.29Å; M105-P174 HydrophobicContact SD-CG 4Å; M105-I186 HydrophobicContact CE-CD1 3.86Å; M105-I186 HydrophobicContact CE-CG1 4.31Å; M105-I186 HydrophobicContact CE-CG2 4.42Å
106	L	94.9	Very high	93	Very high	2 Å²	2	38.3 Å²	38.3	1%	0.01	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	128.3	162.9	-174.8	71.8	0	0	0	108.6	F71 A80 F81 A91 A92 L94 D110 I134	F71-L106 HydrophobicContact CD2-CD2 3.94Å; F71-L106 HydrophobicContact CE2-CD2 4.11Å; A80-L106 HydrophobicContact CB-CD2 3.61Å; F81-L106 HydrophobicContact CE1-CD1 4.22Å; F81-L106 HydrophobicContact CE1-CD2 4.23Å; F81-L106 HydrophobicContact CE1-CG 4.09Å; F81-L106 HydrophobicContact CZ-CD1 3.89Å; F81-L106 HydrophobicContact CZ-CD2 4.42Å; F81-L106 HydrophobicContact CZ-CG 4.27Å; A91-L106 CarbonylContact C-O 3.49Å; A91-L106 WeakPolarHBondContact CA-O 3.29Å; A92-L106 PolarHBondContact N-O 2.98Å; A92-L106 PolarHBondContact O-N 3.29Å; L94-L106 HydrophobicContact CD1-CB 4.25Å; L94-L106 HydrophobicContact CD2-CB 3.84Å; L94-L106 HydrophobicContact CG-CB 4.2Å; L106-D110 HydrophobicContact CD1-CB 3.86Å; L106-I134 HydrophobicContact CD2-CD1 4.16Å; L106-I134 HydrophobicContact CD2-CG1 4.47Å
107	T	94.1	Very high	92.8	Very high	29 Å²	29	43.1 Å²	43.1	18%	0.178	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	169.5	-174.6	71.3	0	0	0	0	111.2	A91 M105 T109 D110 F111	A91-T107 HydrophobicContact CB-CG2 4.02Å; M105-T107 HydrophobicContact CB-CG2 4.19Å; T107-T109 PolarHBondContact O-N 2.94Å; T107-T109 WeakPolarHBondContact OG1-CB 3.28Å; T107-T109 PolarHBondContact OG1-N 3.08Å; T107-D110 WeakPolarHBondContact CA-OD2 3.08Å; T107-D110 PolarHBondContact N-OD2 3.36Å; T107-D110 WeakPolarHBondContact O-CB 3.3Å; T107-D110 PolarHBondContact O-N 3.17Å; T107-D110 PolarHBondContact OG1-OD2 2.85Å; T107-F111 PolarHBondContact O-N 3.25Å
108	I	93.3	Very high	92.6	Very high	14 Å²	14	42 Å²	42	7%	0.072	21%	0.205	C	C	.	.	H	α-helix	trans	-62.8	-24.2	174.5	-50.8	166.3	0	0	0	112	R90 D110 F111 I112 R263 F264 I267	R90-I108 HydrophobicContact CB-CD1 4.03Å; R90-I108 HydrophobicContact CG-CD1 4.25Å; I108-D110 VanDerWaalsContact C-N 3.27Å; I108-D110 PolarHBondContact O-N 3.33Å; I108-F111 WeakPolarHBondContact O-CB 3.31Å; I108-F111 PolarHBondContact O-N 2.73Å; I108-I112 HydrophobicContact CG2-CD1 4.4Å; I108-I112 WeakPolarHBondContact O-CG1 3.37Å; I108-I112 PolarHBondContact O-N 2.75Å; I108-R263 HydrophobicContact CG2-CB 4.47Å; I108-R263 WeakPolarHBondContact CG2-O 3.41Å; I108-F264 HydrophobicContact CD1-CD2 4.26Å; I108-I267 HydrophobicContact CD1-CB 4.2Å; I108-I267 HydrophobicContact CD1-CG2 4.19Å; I108-I267 HydrophobicContact CG1-CB 4.16Å; I108-I267 HydrophobicContact CG1-CD1 4.43Å; I108-I267 HydrophobicContact CG1-CG1 4.32Å; I108-I267 HydrophobicContact CG2-CB 3.99Å; I108-I267 HydrophobicContact CG2-CD1 4.44Å
109	T	92.7	Very high	92.4	Very high	47 Å²	47	35.2 Å²	35.2	29%	0.288	18%	0.175	S	C	.	.	H	α-helix	trans	-62.5	-37.6	173.6	-51.1	0	0	0	0	111.2	T107 F111 I112 N113	T107-T109 PolarHBondContact O-N 2.94Å; T107-T109 WeakPolarHBondContact OG1-CB 3.28Å; T107-T109 PolarHBondContact OG1-N 3.08Å; T109-F111 VanDerWaalsContact C-N 3.31Å; T109-F111 PolarHBondContact O-N 2.7Å; T109-I112 PolarHBondContact O-N 2.71Å; T109-N113 PolarHBondContact O-N 3.03Å; T109-N113 PolarHBondContact O-ND2 2.93Å; T109-N113 VanDerWaalsContact O-ND2 3.17Å
110	D	92.7	Very high	92.1	Very high	22 Å²	22	37.5 Å²	37.5	12%	0.118	18%	0.18	C	C	.	.	H	α-helix	trans	-64.3	-40.2	176	-55.7	-74.2	0	0	0	110.7	F81 L106 T107 I108 I112 N113 I114	F81-D110 HydrophobicContact CZ-CB 4.22Å; L106-D110 HydrophobicContact CD1-CB 3.86Å; T107-D110 WeakPolarHBondContact CA-OD2 3.08Å; T107-D110 PolarHBondContact N-OD2 3.36Å; T107-D110 WeakPolarHBondContact O-CB 3.3Å; T107-D110 PolarHBondContact O-N 3.17Å; T107-D110 PolarHBondContact OG1-OD2 2.85Å; I108-D110 VanDerWaalsContact C-N 3.27Å; I108-D110 PolarHBondContact O-N 3.33Å; D110-I112 PolarHBondContact O-N 2.87Å; D110-N113 PolarHBondContact O-N 3.25Å; D110-I114 WeakPolarHBondContact O-CD1 3.37Å; D110-I114 VanDerWaalsContact O-CG1 3.25Å; D110-I114 WeakPolarHBondContact O-CG1 3.42Å; D110-I114 PolarHBondContact O-N 3.07Å
111	F	92.6	Very high	91.7	Very high	2 Å²	2	33.4 Å²	33.4	1%	0.009	17%	0.166	C	C	.	.	H	α-helix	trans	-59.5	-48.1	174.5	-169.9	-127	0	0	0	111.9	F81 T107 I108 T109 N113 I114 L115 L129 V266 I267 A270	F81-F111 HydrophobicContact CB-CD2 4.49Å; F81-F111 HydrophobicContact CD1-CB 3.92Å; F81-F111 HydrophobicContact CD1-CD2 4.16Å; F81-F111 HydrophobicContact CD1-CG 4.2Å; F81-F111 HydrophobicContact CD2-CB 4.43Å; F81-F111 AromaticContact CD2-CD2 3.47Å; F81-F111 HydrophobicContact CD2-CD2 3.47Å; F81-F111 VanDerWaalsContact CD2-CD2 3.47Å; F81-F111 HydrophobicContact CD2-CE2 4.12Å; F81-F111 HydrophobicContact CD2-CG 4.28Å; F81-F111 HydrophobicContact CE1-CB 3.51Å; F81-F111 HydrophobicContact CE1-CD2 4.34Å; F81-F111 HydrophobicContact CE1-CG 4.24Å; F81-F111 HydrophobicContact CE2-CB 3.99Å; F81-F111 AromaticContact CE2-CD2 3.58Å; F81-F111 HydrophobicContact CE2-CD2 3.58Å; F81-F111 HydrophobicContact CE2-CG 4.23Å; F81-F111 HydrophobicContact CG-CB 4.41Å; F81-F111 AromaticContact CG-CD2 3.78Å; F81-F111 HydrophobicContact CG-CD2 3.78Å; F81-F111 HydrophobicContact CG-CE2 4.4Å; F81-F111 HydrophobicContact CG-CG 4.27Å; F81-F111 VanDerWaalsContact CZ-CA 3.49Å; F81-F111 HydrophobicContact CZ-CB 3.53Å; F81-F111 HydrophobicContact CZ-CD2 4.06Å; F81-F111 HydrophobicContact CZ-CG 4.24Å; T107-F111 PolarHBondContact O-N 3.25Å; I108-F111 WeakPolarHBondContact O-CB 3.31Å; I108-F111 PolarHBondContact O-N 2.73Å; T109-F111 VanDerWaalsContact C-N 3.31Å; T109-F111 PolarHBondContact O-N 2.7Å; F111-N113 VanDerWaalsContact C-N 3.3Å; F111-N113 PolarHBondContact O-N 3.48Å; F111-I114 PolarHBondContact O-N 3.41Å; F111-L115 HydrophobicContact CD1-CD1 3.96Å; F111-L115 HydrophobicContact CD2-CG 4.4Å; F111-L115 HydrophobicContact CE1-CD1 3.52Å; F111-L115 HydrophobicContact CE1-CG 4.24Å; F111-L115 HydrophobicContact CE2-CD1 4.27Å; F111-L115 HydrophobicContact CE2-CD2 4.13Å; F111-L115 HydrophobicContact CE2-CG 4.12Å; F111-L115 HydrophobicContact CZ-CD1 3.69Å; F111-L115 HydrophobicContact CZ-CD2 4.08Å; F111-L115 HydrophobicContact CZ-CG 4.03Å; F111-L115 WeakPolarHBondContact O-CG 3.33Å; F111-L115 PolarHBondContact O-N 2.77Å; F111-L129 HydrophobicContact CD2-CD1 4.3Å; F111-L129 HydrophobicContact CE2-CD1 4.13Å; F111-L129 HydrophobicContact CE2-CD2 3.96Å; F111-V266 HydrophobicContact CD1-CG1 4.02Å; F111-V266 HydrophobicContact CE1-CG1 4.2Å; F111-V266 WeakPolarHBondContact CE1-O 3.35Å; F111-I267 HydrophobicContact CB-CD1 4.45Å; F111-I267 HydrophobicContact CD1-CD1 3.91Å; F111-I267 HydrophobicContact CE1-CD1 4.4Å; F111-I267 HydrophobicContact CG-CD1 4.19Å; F111-A270 HydrophobicContact CE1-CB 4.03Å; F111-A270 HydrophobicContact CE2-CB 4.42Å; F111-A270 HydrophobicContact CZ-CB 3.75Å
112	I	93.4	Very high	91.2	Very high	2 Å²	2	33 Å²	33	1%	0.01	16%	0.162	C	C	.	.	H	α-helix	trans	-57.8	-44.6	176.6	-70.2	162.5	0	0	0	110.8	I108 T109 D110 I114 L115 H116 L237 F240 V241 R263 V266	I108-I112 HydrophobicContact CG2-CD1 4.4Å; I108-I112 WeakPolarHBondContact O-CG1 3.37Å; I108-I112 PolarHBondContact O-N 2.75Å; T109-I112 PolarHBondContact O-N 2.71Å; D110-I112 PolarHBondContact O-N 2.87Å; I112-I114 VanDerWaalsContact C-N 3.35Å; I112-I114 PolarHBondContact O-N 3.28Å; I112-L115 PolarHBondContact O-N 2.72Å; I112-H116 VanDerWaalsContact O-CB 3.27Å; I112-H116 WeakPolarHBondContact O-CB 3.13Å; I112-H116 PolarHBondContact O-N 2.72Å; I112-L237 HydrophobicContact CG1-CD2 4.16Å; I112-L237 HydrophobicContact CG2-CB 4.4Å; I112-L237 HydrophobicContact CG2-CD2 4.13Å; I112-F240 HydrophobicContact CD1-CD2 4.2Å; I112-F240 HydrophobicContact CG2-CB 4.06Å; I112-V241 HydrophobicContact CG2-CG2 3.91Å; I112-R263 HydrophobicContact CD1-CB 3.67Å; I112-R263 HydrophobicContact CD1-CG 3.44Å; I112-R263 VanDerWaalsContact CD1-CG 3.44Å; I112-V266 HydrophobicContact CD1-CB 4.37Å; I112-V266 HydrophobicContact CD1-CG2 4.13Å; I112-V266 HydrophobicContact CG1-CB 4.04Å; I112-V266 HydrophobicContact CG1-CG1 3.78Å; I112-V266 HydrophobicContact CG1-CG2 4.07Å
113	N	92.3	Very high	90.7	Very high	13 Å²	13	39.1 Å²	39.1	7%	0.07	20%	0.196	C	C	.	.	H	α-helix	trans	-63.3	-40.2	179.2	-69.6	-31.2	0	0	0	112.2	T109 D110 F111 R117 W137 Y141	T109-N113 PolarHBondContact O-N 3.03Å; T109-N113 PolarHBondContact O-ND2 2.93Å; T109-N113 VanDerWaalsContact O-ND2 3.17Å; D110-N113 PolarHBondContact O-N 3.25Å; F111-N113 VanDerWaalsContact C-N 3.3Å; F111-N113 PolarHBondContact O-N 3.48Å; N113-R117 WeakPolarHBondContact O-CB 3.35Å; N113-R117 PolarHBondContact O-N 3.1Å; N113-W137 HydrophobicContact CB-CH2 4.09Å; N113-W137 HydrophobicContact CB-CZ2 3.83Å; N113-Y141 HydrophobicContact CB-CD2 4.48Å; N113-Y141 HydrophobicContact CB-CE2 3.93Å; N113-Y141 VanDerWaalsContact ND2-CZ 3.29Å; N113-Y141 PolarHBondContact ND2-OH 3.27Å
114	I	91.5	Very high	90.2	Very high	3 Å²	3	41.1 Å²	41.1	2%	0.015	21%	0.208	C	C	.	.	H	α-helix	trans	-65.5	-50.8	177.2	-66	157.3	0	0	0	110	V77 F81 D110 F111 I112 H116 R117 Y118 L129 W137	V77-I114 HydrophobicContact CG1-CD1 3.56Å; F81-I114 HydrophobicContact CE2-CD1 3.69Å; F81-I114 HydrophobicContact CZ-CD1 4.11Å; D110-I114 WeakPolarHBondContact O-CD1 3.37Å; D110-I114 VanDerWaalsContact O-CG1 3.25Å; D110-I114 WeakPolarHBondContact O-CG1 3.42Å; D110-I114 PolarHBondContact O-N 3.07Å; F111-I114 PolarHBondContact O-N 3.41Å; I112-I114 VanDerWaalsContact C-N 3.35Å; I112-I114 PolarHBondContact O-N 3.28Å; I114-H116 PolarHBondContact O-N 3.44Å; I114-R117 PolarHBondContact O-N 3.34Å; I114-Y118 HydrophobicContact CG2-CD2 3.96Å; I114-Y118 HydrophobicContact CG2-CE2 4.45Å; I114-Y118 WeakPolarHBondContact O-CD2 3.25Å; I114-Y118 PolarHBondContact O-N 3.08Å; I114-L129 HydrophobicContact CD1-CD1 4.36Å; I114-L129 HydrophobicContact CG2-CB 4.13Å; I114-L129 HydrophobicContact CG2-CD1 3.71Å; I114-L129 HydrophobicContact CG2-CG 4.47Å; I114-W137 HydrophobicContact CB-CH2 4.37Å; I114-W137 HydrophobicContact CD1-CD2 3.95Å; I114-W137 HydrophobicContact CD1-CG 4.18Å; I114-W137 HydrophobicContact CD1-CZ2 4.27Å; I114-W137 HydrophobicContact CG1-CD2 3.56Å; I114-W137 VanDerWaalsContact CG1-CE2 3.41Å; I114-W137 HydrophobicContact CG1-CE3 3.72Å; I114-W137 HydrophobicContact CG1-CG 4.31Å; I114-W137 HydrophobicContact CG1-CH2 3.56Å; I114-W137 HydrophobicContact CG1-CZ2 3.43Å; I114-W137 VanDerWaalsContact CG1-CZ2 3.43Å; I114-W137 HydrophobicContact CG1-CZ3 3.71Å
115	L	91.6	Very high	89.7	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-57.9	-51.4	179	-69.2	-176.1	0	0	0	111	F111 I112 R117 Y118 Y119 I126 L129 L237 V266 Y275 L278	F111-L115 HydrophobicContact CD1-CD1 3.96Å; F111-L115 HydrophobicContact CD2-CG 4.4Å; F111-L115 HydrophobicContact CE1-CD1 3.52Å; F111-L115 HydrophobicContact CE1-CG 4.24Å; F111-L115 HydrophobicContact CE2-CD1 4.27Å; F111-L115 HydrophobicContact CE2-CD2 4.13Å; F111-L115 HydrophobicContact CE2-CG 4.12Å; F111-L115 HydrophobicContact CZ-CD1 3.69Å; F111-L115 HydrophobicContact CZ-CD2 4.08Å; F111-L115 HydrophobicContact CZ-CG 4.03Å; F111-L115 WeakPolarHBondContact O-CG 3.33Å; F111-L115 PolarHBondContact O-N 2.77Å; I112-L115 PolarHBondContact O-N 2.72Å; L115-R117 VanDerWaalsContact C-N 3.29Å; L115-R117 PolarHBondContact O-N 3.16Å; L115-Y118 PolarHBondContact O-N 3.22Å; L115-Y119 WeakPolarHBondContact O-CB 3.13Å; L115-Y119 PolarHBondContact O-N 3.26Å; L115-I126 HydrophobicContact CD2-CD1 3.57Å; L115-L129 HydrophobicContact CD2-CD2 4.31Å; L115-L237 HydrophobicContact CB-CD1 3.78Å; L115-L237 HydrophobicContact CD1-CD1 4.19Å; L115-V266 HydrophobicContact CD1-CG1 4.02Å; L115-Y275 HydrophobicContact CD2-CD2 4.45Å; L115-L278 HydrophobicContact CB-CD1 4.09Å; L115-L278 HydrophobicContact CD1-CD2 4.46Å
116	H	91.6	Very high	89.3	Confident	50 Å²	50	44.1 Å²	44.1	23%	0.231	22%	0.221	C	C	.	.	H	α-helix	trans	-62.2	-34.8	-179.5	-179.3	-103.5	0	0	0	112.9	I112 I114 Y234 L237 A238 V241	I112-H116 VanDerWaalsContact O-CB 3.27Å; I112-H116 WeakPolarHBondContact O-CB 3.13Å; I112-H116 PolarHBondContact O-N 2.72Å; I114-H116 PolarHBondContact O-N 3.44Å; H116-Y234 AromaticContact CD2-CE2 3.96Å; H116-L237 HydrophobicContact CB-CB 4.35Å; H116-A238 WeakPolarHBondContact NE2-CA 3.17Å; H116-A238 WeakPolarHBondContact NE2-CB 3.27Å; H116-V241 HydrophobicContact CB-CG2 3.99Å
117	R	90.6	Very high	88.7	Confident	123 Å²	123	50.8 Å²	50.8	46%	0.464	25%	0.247	S	C	.	.	H	α-helix	trans	-74.2	-41.3	-178.2	-175.6	171.1	-172.9	144.7	-0.8	113.2	N113 I114 L115	N113-R117 WeakPolarHBondContact O-CB 3.35Å; N113-R117 PolarHBondContact O-N 3.1Å; I114-R117 PolarHBondContact O-N 3.34Å; L115-R117 VanDerWaalsContact C-N 3.29Å; L115-R117 PolarHBondContact O-N 3.16Å
118	Y	89.8	Confident	88.3	Confident	33 Å²	33	52.7 Å²	52.7	13%	0.129	25%	0.254	C	S	.	.	H	α-helix	trans	-105.8	-11.6	-170	-63.9	-70.1	0	0	0	114	I114 L115 K120 I126 E128 W137	I114-Y118 HydrophobicContact CG2-CD2 3.96Å; I114-Y118 HydrophobicContact CG2-CE2 4.45Å; I114-Y118 WeakPolarHBondContact O-CD2 3.25Å; I114-Y118 PolarHBondContact O-N 3.08Å; L115-Y118 PolarHBondContact O-N 3.22Å; Y118-K120 PolarHBondContact O-N 3.4Å; Y118-I126 HydrophobicContact CG-CG2 4.47Å; Y118-E128 HydrophobicContact CD1-CB 3.95Å; Y118-E128 HydrophobicContact CD1-CG 3.6Å; Y118-E128 VanDerWaalsContact CD1-OE1 3.24Å; Y118-E128 WeakPolarHBondContact CD1-OE1 3.45Å; Y118-E128 HydrophobicContact CD2-CB 3.95Å; Y118-E128 HydrophobicContact CE1-CB 3.96Å; Y118-E128 HydrophobicContact CE1-CG 3.52Å; Y118-E128 HydrophobicContact CE2-CB 3.95Å; Y118-E128 HydrophobicContact CE2-CG 4.43Å; Y118-E128 HydrophobicContact CG-CB 3.94Å; Y118-E128 HydrophobicContact CG-CG 4.11Å; Y118-W137 HydrophobicContact CE2-CE3 4.21Å; Y118-W137 AromaticContact CE2-CZ3 3.76Å; Y118-W137 HydrophobicContact CE2-CZ3 3.76Å
119	Y	89.4	Confident	87.8	Confident	10 Å²	10	52.1 Å²	52.1	4%	0.039	25%	0.251	C	S	.	.			trans	-62.2	130.3	174.3	-174	-106.8	0	0	0	111.4	L115 P122 I126 Y234 N276 L278 N279	L115-Y119 WeakPolarHBondContact O-CB 3.13Å; L115-Y119 PolarHBondContact O-N 3.26Å; Y119-P122 WeakPolarHBondContact OH-CD 3.37Å; Y119-P122 VanDerWaalsContact OH-CG 3.29Å; Y119-P122 WeakPolarHBondContact OH-CG 3.35Å; Y119-I126 HydrophobicContact CD2-CD1 4.29Å; Y119-Y234 AromaticContact CD1-CD2 3.34Å; Y119-Y234 HydrophobicContact CD1-CD2 3.34Å; Y119-Y234 AromaticContact CD1-CE2 3.67Å; Y119-Y234 HydrophobicContact CD1-CE2 3.67Å; Y119-Y234 AromaticContact CD1-CG 3.93Å; Y119-Y234 HydrophobicContact CD1-CG 3.93Å; Y119-Y234 HydrophobicContact CE1-CD2 4.08Å; Y119-Y234 HydrophobicContact CE1-CG 4.24Å; Y119-Y234 HydrophobicContact CG-CD2 4.02Å; Y119-Y234 HydrophobicContact CG-CE2 4.23Å; Y119-N276 WeakPolarHBondContact CE2-O 3.43Å; Y119-L278 HydrophobicContact CD1-CB 4.23Å; Y119-L278 HydrophobicContact CD1-CD1 4.19Å; Y119-L278 HydrophobicContact CD2-CB 4.09Å; Y119-L278 HydrophobicContact CD2-CD1 3.5Å; Y119-L278 VanDerWaalsContact CD2-CD1 3.5Å; Y119-L278 HydrophobicContact CD2-CG 3.74Å; Y119-L278 HydrophobicContact CE1-CB 3.89Å; Y119-L278 HydrophobicContact CE2-CB 3.78Å; Y119-L278 HydrophobicContact CE2-CD1 4.04Å; Y119-L278 HydrophobicContact CE2-CG 3.74Å; Y119-L278 HydrophobicContact CG-CB 4.3Å; Y119-L278 HydrophobicContact CG-CD1 3.57Å; Y119-L278 HydrophobicContact CG-CG 4.18Å; Y119-L278 PolarHBondContact OH-N 3.3Å; Y119-N279 WeakPolarHBondContact CE1-OD1 3.44Å; Y119-N279 PolarHBondContact OH-N 3.46Å; Y119-N279 PolarHBondContact OH-OD1 3.32Å
120	K	86.1	Confident	87.2	Confident	163 Å²	163	51.9 Å²	51.9	71%	0.709	25%	0.246	S	C	*	.			trans	-121.5	-52.1	176.6	-60.4	-59.9	177.9	-168	0	111.9	Y118	Y118-K120 PolarHBondContact O-N 3.4Å
121	S	84.8	Confident	86.9	Confident	41 Å²	41	57.2 Å²	57.2	29%	0.287	27%	0.271	S	S	.	.			trans	-159.5	153	-174.7	169.1	0	0	0	0	109.9	L123 V124	S121-L123 PolarHBondContact O-N 3.46Å; S121-L123 VanDerWaalsContact O-N 3.11Å; S121-L123 PolarHBondContact OG-N 3.45Å; S121-V124 PolarHBondContact O-N 3.25Å; S121-V124 VanDerWaalsContact O-N 3.13Å
122	P	82.4	Confident	86.8	Confident	43 Å²	43	59 Å²	59	28%	0.279	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-25.4	175.7	-23.2	31.3	0	0	0	115.3	Y119 N276 N279	Y119-P122 WeakPolarHBondContact OH-CD 3.37Å; Y119-P122 VanDerWaalsContact OH-CG 3.29Å; Y119-P122 WeakPolarHBondContact OH-CG 3.35Å; P122-N276 WeakPolarHBondContact CA-O 3.39Å; P122-N279 WeakPolarHBondContact CD-ND2 3.24Å; P122-N279 HydrophobicContact CG-CB 3.92Å; P122-N279 WeakPolarHBondContact CG-ND2 3.24Å
123	L	81.9	Confident	86.8	Confident	164 Å²	164	63.1 Å²	63.1	86%	0.859	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-12.9	-176.6	-60.8	175.7	0	0	0	113.3	S121	S121-L123 PolarHBondContact O-N 3.46Å; S121-L123 VanDerWaalsContact O-N 3.11Å; S121-L123 PolarHBondContact OG-N 3.45Å
124	V	82.9	Confident	86.9	Confident	71 Å²	71	62.5 Å²	62.5	43%	0.43	29%	0.294	S	S	.	.	S	Bend	trans	-109.4	120.1	-176	-177.1	0	0	0	0	108.6	S121	S121-V124 PolarHBondContact O-N 3.25Å; S121-V124 VanDerWaalsContact O-N 3.13Å
125	Q	81.4	Confident	87	Confident	92 Å²	92	64 Å²	64	43%	0.43	30%	0.301	S	S	.	.			trans	-66.8	146.3	174.4	-66.1	-179.9	3.1	0	0	110.3	Y127	Q125-Y127 VanDerWaalsContact C-N 3.31Å; Q125-Y127 HydrophobicContact CB-CE1 4.42Å; Q125-Y127 VanDerWaalsContact O-CD2 3.29Å; Q125-Y127 WeakPolarHBondContact O-CD2 3.49Å; Q125-Y127 PolarHBondContact O-N 2.94Å
126	I	84.9	Confident	87	Confident	2 Å²	2	66.2 Å²	66.2	1%	0.01	31%	0.314	C	S	.	.			trans	-82.6	80.6	176.4	-53	176.2	0	0	0	108.3	L115 Y118 Y119 E128 L129	L115-I126 HydrophobicContact CD2-CD1 3.57Å; Y118-I126 HydrophobicContact CG-CG2 4.47Å; Y119-I126 HydrophobicContact CD2-CD1 4.29Å; I126-E128 PolarHBondContact O-N 3.33Å; I126-L129 HydrophobicContact CB-CB 4.24Å; I126-L129 HydrophobicContact CG2-CB 3.81Å; I126-L129 WeakPolarHBondContact O-CB 3.2Å; I126-L129 PolarHBondContact O-N 3.11Å; I126-L129 VanDerWaalsContact O-N 3.1Å
127	Y	83.4	Confident	86.9	Confident	143 Å²	143	63.9 Å²	63.9	56%	0.561	30%	0.303	S	S	*	.	H	α-helix	trans	-57	-36.4	-176.5	-65.4	-75	0	0	0	112.5	Q125 L129 E130 E131	Q125-Y127 VanDerWaalsContact C-N 3.31Å; Q125-Y127 HydrophobicContact CB-CE1 4.42Å; Q125-Y127 VanDerWaalsContact O-CD2 3.29Å; Q125-Y127 WeakPolarHBondContact O-CD2 3.49Å; Q125-Y127 PolarHBondContact O-N 2.94Å; Y127-L129 VanDerWaalsContact C-N 3.25Å; Y127-L129 PolarHBondContact O-N 3.32Å; Y127-E130 PolarHBondContact O-N 2.95Å; Y127-E131 PolarHBondContact O-N 3.33Å
128	E	84.3	Confident	86.8	Confident	68 Å²	68	60.1 Å²	60.1	32%	0.318	29%	0.289	S	S	.	.	H	α-helix	trans	-63.3	-31.5	179.7	-62.3	92.4	154.9	0	0	112.4	Y118 I126 E130 H132	Y118-E128 HydrophobicContact CD1-CB 3.95Å; Y118-E128 HydrophobicContact CD1-CG 3.6Å; Y118-E128 VanDerWaalsContact CD1-OE1 3.24Å; Y118-E128 WeakPolarHBondContact CD1-OE1 3.45Å; Y118-E128 HydrophobicContact CD2-CB 3.95Å; Y118-E128 HydrophobicContact CE1-CB 3.96Å; Y118-E128 HydrophobicContact CE1-CG 3.52Å; Y118-E128 HydrophobicContact CE2-CB 3.95Å; Y118-E128 HydrophobicContact CE2-CG 4.43Å; Y118-E128 HydrophobicContact CG-CB 3.94Å; Y118-E128 HydrophobicContact CG-CG 4.11Å; I126-E128 PolarHBondContact O-N 3.33Å; E128-E130 VanDerWaalsContact C-N 3.29Å; E128-H132 WeakPolarHBondContact O-CB 3.39Å; E128-H132 PolarHBondContact O-N 3.36Å
129	L	83.1	Confident	86.6	Confident	2 Å²	2	64.5 Å²	64.5	1%	0.01	31%	0.311	C	S	.	.	H	α-helix	trans	-69	-32.6	175	-179.7	68.5	0	0	0	111.2	V77 K78 F81 F111 I114 L115 I126 Y127 Y275	V77-L129 HydrophobicContact CG1-CD1 3.81Å; K78-L129 WeakPolarHBondContact CB-O 3.02Å; K78-L129 PolarHBondContact N-O 2.8Å; F81-L129 HydrophobicContact CD2-CD1 4.21Å; F81-L129 HydrophobicContact CE2-CD1 4.33Å; F111-L129 HydrophobicContact CD2-CD1 4.3Å; F111-L129 HydrophobicContact CE2-CD1 4.13Å; F111-L129 HydrophobicContact CE2-CD2 3.96Å; I114-L129 HydrophobicContact CD1-CD1 4.36Å; I114-L129 HydrophobicContact CG2-CB 4.13Å; I114-L129 HydrophobicContact CG2-CD1 3.71Å; I114-L129 HydrophobicContact CG2-CG 4.47Å; L115-L129 HydrophobicContact CD2-CD2 4.31Å; I126-L129 HydrophobicContact CB-CB 4.24Å; I126-L129 HydrophobicContact CG2-CB 3.81Å; I126-L129 WeakPolarHBondContact O-CB 3.2Å; I126-L129 PolarHBondContact O-N 3.11Å; I126-L129 VanDerWaalsContact O-N 3.1Å; Y127-L129 VanDerWaalsContact C-N 3.25Å; Y127-L129 PolarHBondContact O-N 3.32Å; L129-Y275 HydrophobicContact CD2-CD2 3.87Å; L129-Y275 HydrophobicContact CD2-CE2 3.7Å; L129-Y275 HydrophobicContact CD2-CG 4.49Å
130	E	79.9	Confident	86.4	Confident	42 Å²	42	66 Å²	66	20%	0.196	32%	0.319	C	S	.	.	H	α-helix	trans	-79.8	-43	-177.3	-47.1	-138.6	150.2	0	0	111.9	K78 Y127 E128 Y275	K78-E130 HydrophobicContact CD-CB 4.22Å; K78-E130 HydrophobicContact CD-CG 4.06Å; K78-E130 IonicContact NZ-OE1 2.72Å; K78-E130 PolarHBondContact NZ-OE1 3.3Å; K78-E130 IonicContact NZ-OE2 2.93Å; K78-E130 PolarHBondContact NZ-OE2 3.13Å; Y127-E130 PolarHBondContact O-N 2.95Å; E128-E130 VanDerWaalsContact C-N 3.29Å; E130-Y275 PolarHBondContact OE1-OH 3.01Å
131	E	86.9	Confident	86	Confident	135 Å²	135	62.9 Å²	62.9	63%	0.631	30%	0.303	S	S	*	.	H	α-helix	trans	-89.8	-32.3	-172.4	-65.5	-56	132.1	0	0	113.7	Y127	Y127-E131 PolarHBondContact O-N 3.33Å
132	H	90.3	Very high	85.4	Confident	40 Å²	40	62.6 Å²	62.6	19%	0.185	30%	0.298	C	S	.	.			trans	-66	145.5	-176.6	-73.6	177.6	0	0	0	112.9	Q76 V77 E128	Q76-H132 WeakPolarHBondContact CA-O 3.16Å; V77-H132 HydrophobicContact CG2-CB 4.2Å; V77-H132 WeakPolarHBondContact CG2-O 3.4Å; V77-H132 PolarHBondContact N-O 3.08Å; E128-H132 WeakPolarHBondContact O-CB 3.39Å; E128-H132 PolarHBondContact O-N 3.36Å
133	K	94.4	Very high	84.4	Confident	88 Å²	88	66.5 Å²	66.5	38%	0.383	31%	0.313	S	S	.	.	B	Isolated β-bridge	trans	-89.7	162.3	164.3	-62	179.2	176.5	-177.1	0	110	T74 L75 V77 E135 T136 W137	T74-K133 WeakPolarHBondContact O-CD 3.41Å; T74-K133 WeakPolarHBondContact O-CG 3.44Å; L75-K133 WeakPolarHBondContact O-CA 3.45Å; V77-K133 VanDerWaalsContact CG2-C 3.45Å; V77-K133 WeakPolarHBondContact CG2-O 3.36Å; K133-E135 VanDerWaalsContact C-N 3.26Å; K133-E135 HydrophobicContact CB-CG 4.02Å; K133-E135 HydrophobicContact CD-CG 4.45Å; K133-E135 WeakPolarHBondContact CD-OE1 3.39Å; K133-E135 IonicContact NZ-OE1 3.88Å; K133-E135 PolarHBondContact O-N 3.36Å; K133-T136 HydrophobicContact CB-CG2 4.41Å; K133-T136 PolarHBondContact N-OG1 3.03Å; K133-T136 PolarHBondContact O-N 3.03Å; K133-T136 PolarHBondContact O-OG1 3.16Å; K133-W137 PolarHBondContact O-N 3.38Å
134	I	94.4	Very high	82.9	Confident	0 Å²	0	69.2 Å²	69.2	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-59.2	-41.1	176.3	-65.2	167.9	0	0	0	110.6	F71 T73 L75 V77 A80 L94 L106 R138	F71-I134 HydrophobicContact CB-CD1 3.85Å; F71-I134 HydrophobicContact CD2-CD1 4.43Å; F71-I134 HydrophobicContact CG-CD1 4.45Å; T73-I134 CarbonylContact O-C 3.56Å; T73-I134 WeakPolarHBondContact O-CB 3.21Å; T73-I134 PolarHBondContact O-N 3.22Å; L75-I134 HydrophobicContact CB-CD1 4.08Å; L75-I134 WeakPolarHBondContact O-CG1 3.43Å; L75-I134 PolarHBondContact O-N 3.3Å; V77-I134 HydrophobicContact CG2-CG1 4.25Å; A80-I134 HydrophobicContact CB-CD1 3.83Å; A80-I134 HydrophobicContact CB-CG1 4.33Å; L94-I134 HydrophobicContact CD1-CG2 3.58Å; L94-I134 HydrophobicContact CD2-CD1 3.92Å; L94-I134 HydrophobicContact CD2-CG2 3.84Å; L94-I134 HydrophobicContact CG-CG2 4.31Å; L106-I134 HydrophobicContact CD2-CD1 4.16Å; L106-I134 HydrophobicContact CD2-CG1 4.47Å; I134-R138 HydrophobicContact CG2-CG 4.35Å; I134-R138 WeakPolarHBondContact O-CB 3.23Å; I134-R138 WeakPolarHBondContact O-CG 3.37Å; I134-R138 PolarHBondContact O-N 3.38Å
135	E	92.7	Very high	81.7	Confident	34 Å²	34	68.5 Å²	68.5	16%	0.159	31%	0.311	C	S	.	.	H	α-helix	trans	-58.5	-50.2	176.8	65.9	-172.3	157.4	0	0	111.8	T73 K98 K133 W137 R138 E139	T73-E135 PolarHBondContact O-N 3.44Å; K98-E135 IonicContact NZ-OE2 3.1Å; K98-E135 PolarHBondContact NZ-OE2 3.46Å; K98-E135 VanDerWaalsContact NZ-OE2 3.1Å; K133-E135 VanDerWaalsContact C-N 3.26Å; K133-E135 HydrophobicContact CB-CG 4.02Å; K133-E135 HydrophobicContact CD-CG 4.45Å; K133-E135 WeakPolarHBondContact CD-OE1 3.39Å; K133-E135 IonicContact NZ-OE1 3.88Å; K133-E135 PolarHBondContact O-N 3.36Å; E135-W137 PolarHBondContact O-N 3.43Å; E135-R138 PolarHBondContact O-N 2.92Å; E135-E139 WeakPolarHBondContact O-CG 3.49Å; E135-E139 PolarHBondContact O-N 3.47Å
136	T	92	Very high	80.5	Confident	46 Å²	46	71.3 Å²	71.3	28%	0.282	34%	0.335	S	S	.	.	H	α-helix	trans	-68	-39.4	-176.2	61.2	0	0	0	0	112	K133 E139 I140	K133-T136 HydrophobicContact CB-CG2 4.41Å; K133-T136 PolarHBondContact N-OG1 3.03Å; K133-T136 PolarHBondContact O-N 3.03Å; K133-T136 PolarHBondContact O-OG1 3.16Å; T136-E139 PolarHBondContact O-N 3.21Å; T136-I140 WeakPolarHBondContact O-CG1 3.32Å; T136-I140 PolarHBondContact O-N 3.13Å
137	W	89.5	Confident	79.5	Confident	2 Å²	2	75.9 Å²	75.9	1%	0.008	36%	0.359	C	S	.	.	H	α-helix	trans	-61.3	-45.2	173.1	164.2	-111.8	0	0	0	111.6	V77 N113 I114 Y118 K133 E135 E139 I140 Y141	V77-W137 HydrophobicContact CG2-CB 4.12Å; N113-W137 HydrophobicContact CB-CH2 4.09Å; N113-W137 HydrophobicContact CB-CZ2 3.83Å; I114-W137 HydrophobicContact CB-CH2 4.37Å; I114-W137 HydrophobicContact CD1-CD2 3.95Å; I114-W137 HydrophobicContact CD1-CG 4.18Å; I114-W137 HydrophobicContact CD1-CZ2 4.27Å; I114-W137 HydrophobicContact CG1-CD2 3.56Å; I114-W137 VanDerWaalsContact CG1-CE2 3.41Å; I114-W137 HydrophobicContact CG1-CE3 3.72Å; I114-W137 HydrophobicContact CG1-CG 4.31Å; I114-W137 HydrophobicContact CG1-CH2 3.56Å; I114-W137 HydrophobicContact CG1-CZ2 3.43Å; I114-W137 VanDerWaalsContact CG1-CZ2 3.43Å; I114-W137 HydrophobicContact CG1-CZ3 3.71Å; Y118-W137 HydrophobicContact CE2-CE3 4.21Å; Y118-W137 AromaticContact CE2-CZ3 3.76Å; Y118-W137 HydrophobicContact CE2-CZ3 3.76Å; K133-W137 PolarHBondContact O-N 3.38Å; E135-W137 PolarHBondContact O-N 3.43Å; W137-E139 VanDerWaalsContact C-N 3.33Å; W137-E139 PolarHBondContact O-N 3Å; W137-I140 PolarHBondContact O-N 3.11Å; W137-Y141 AromaticContact CH2-CD2 3.72Å; W137-Y141 HydrophobicContact CH2-CD2 3.72Å; W137-Y141 HydrophobicContact CH2-CG 4.34Å; W137-Y141 AromaticContact CZ2-CD2 3.57Å; W137-Y141 HydrophobicContact CZ2-CD2 3.57Å; W137-Y141 HydrophobicContact CZ2-CE2 4.31Å; W137-Y141 AromaticContact CZ2-CG 3.89Å; W137-Y141 HydrophobicContact CZ2-CG 3.89Å; W137-Y141 WeakPolarHBondContact O-CB 3.46Å; W137-Y141 PolarHBondContact O-N 3.21Å
138	R	88.3	Confident	79.3	Confident	43 Å²	43	79.8 Å²	79.8	16%	0.162	37%	0.373	C	S	.	.	H	α-helix	trans	-63.2	-40.9	-179.7	-78.2	175	63.9	77.3	2.6	111.6	V103 I134 E135 Y141 L142	V103-R138 PolarHBondContact O-NH2 3.17Å; I134-R138 HydrophobicContact CG2-CG 4.35Å; I134-R138 WeakPolarHBondContact O-CB 3.23Å; I134-R138 WeakPolarHBondContact O-CG 3.37Å; I134-R138 PolarHBondContact O-N 3.38Å; E135-R138 PolarHBondContact O-N 2.92Å; R138-Y141 PolarHBondContact O-N 2.85Å; R138-L142 HydrophobicContact CB-CD1 4.18Å; R138-L142 WeakPolarHBondContact O-CA 3.26Å; R138-L142 WeakPolarHBondContact O-CB 3.35Å; R138-L142 VanDerWaalsContact O-CG 3.28Å; R138-L142 WeakPolarHBondContact O-CG 3.37Å; R138-L142 PolarHBondContact O-N 3.5Å
139	E	86.2	Confident	79.6	Confident	125 Å²	125	77.8 Å²	77.8	58%	0.584	36%	0.364	S	S	*	.	H	α-helix	trans	-59.3	-48.5	175.4	-73.2	172.6	-177.6	0	0	111.3	E135 T136 W137 Y141 L142 Q143	E135-E139 WeakPolarHBondContact O-CG 3.49Å; E135-E139 PolarHBondContact O-N 3.47Å; T136-E139 PolarHBondContact O-N 3.21Å; W137-E139 VanDerWaalsContact C-N 3.33Å; W137-E139 PolarHBondContact O-N 3Å; E139-Y141 VanDerWaalsContact C-N 3.33Å; E139-Y141 PolarHBondContact O-N 3.09Å; E139-L142 PolarHBondContact O-N 3.11Å; E139-Q143 WeakPolarHBondContact O-CB 3.41Å; E139-Q143 VanDerWaalsContact O-CG 3.22Å; E139-Q143 WeakPolarHBondContact O-CG 3.45Å; E139-Q143 PolarHBondContact O-N 2.61Å
140	I	84.6	Confident	80.1	Confident	42 Å²	42	80.4 Å²	80.4	22%	0.215	38%	0.377	C	S	.	.	H	α-helix	trans	-62	-40.1	178.8	-65.4	164.9	0	0	0	111.9	T136 W137	T136-I140 WeakPolarHBondContact O-CG1 3.32Å; T136-I140 PolarHBondContact O-N 3.13Å; W137-I140 PolarHBondContact O-N 3.11Å
141	Y	77.7	Confident	80.8	Confident	97 Å²	97	81.1 Å²	81.1	38%	0.38	39%	0.387	S	S	.	.	H	α-helix	trans	-80.3	-34.7	-176.8	-169.7	-97.4	0	0	0	112.9	N113 W137 R138 E139	N113-Y141 HydrophobicContact CB-CD2 4.48Å; N113-Y141 HydrophobicContact CB-CE2 3.93Å; N113-Y141 VanDerWaalsContact ND2-CZ 3.29Å; N113-Y141 PolarHBondContact ND2-OH 3.27Å; W137-Y141 AromaticContact CH2-CD2 3.72Å; W137-Y141 HydrophobicContact CH2-CD2 3.72Å; W137-Y141 HydrophobicContact CH2-CG 4.34Å; W137-Y141 AromaticContact CZ2-CD2 3.57Å; W137-Y141 HydrophobicContact CZ2-CD2 3.57Å; W137-Y141 HydrophobicContact CZ2-CE2 4.31Å; W137-Y141 AromaticContact CZ2-CG 3.89Å; W137-Y141 HydrophobicContact CZ2-CG 3.89Å; W137-Y141 WeakPolarHBondContact O-CB 3.46Å; W137-Y141 PolarHBondContact O-N 3.21Å; R138-Y141 PolarHBondContact O-N 2.85Å; E139-Y141 VanDerWaalsContact C-N 3.33Å; E139-Y141 PolarHBondContact O-N 3.09Å
142	L	73.3	Confident	81.3	Confident	35 Å²	35	75.5 Å²	75.5	18%	0.183	36%	0.361	C	S	.	.	H	α-helix	trans	-99	6.7	-174.9	-60	173.7	0	0	0	113.6	R138 E139 Y144 S145 N147	R138-L142 HydrophobicContact CB-CD1 4.18Å; R138-L142 WeakPolarHBondContact O-CA 3.26Å; R138-L142 WeakPolarHBondContact O-CB 3.35Å; R138-L142 VanDerWaalsContact O-CG 3.28Å; R138-L142 WeakPolarHBondContact O-CG 3.37Å; R138-L142 PolarHBondContact O-N 3.5Å; E139-L142 PolarHBondContact O-N 3.11Å; L142-Y144 PolarHBondContact O-N 2.86Å; L142-S145 PolarHBondContact O-N 3.25Å; L142-N147 HydrophobicContact CD2-CB 4.1Å; L142-N147 WeakPolarHBondContact CD2-ND2 3.45Å
143	Q	60.3	Low	81.7	Confident	126 Å²	126	79.3 Å²	79.3	59%	0.589	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.2	-20	179.7	-108	163.9	18.8	0	0	114.7	E139	E139-Q143 WeakPolarHBondContact O-CB 3.41Å; E139-Q143 VanDerWaalsContact O-CG 3.22Å; E139-Q143 WeakPolarHBondContact O-CG 3.45Å; E139-Q143 PolarHBondContact O-N 2.61Å
144	Y	51.3	Low	81.8	Confident	221 Å²	221	75.9 Å²	75.9	87%	0.867	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.5	8	179.3	-57.4	-77.4	0	0	0	114.8	L142	L142-Y144 PolarHBondContact O-N 2.86Å
145	S	57.1	Low	81.9	Confident	55 Å²	55	80.2 Å²	80.2	39%	0.385	40%	0.4	S	S	.	.			trans	-149.7	117	-175.3	-174.5	0	0	0	0	112.9	L142 N147	L142-S145 PolarHBondContact O-N 3.25Å; S145-N147 PolarHBondContact O-N 2.99Å; S145-N147 VanDerWaalsContact OG-CG 3.31Å; S145-N147 PolarHBondContact OG-ND2 3.25Å; S145-N147 PolarHBondContact OG-OD1 3.49Å; S145-N147 VanDerWaalsContact OG-OD1 3.1Å
146	V	56.1	Low	82.1	Confident	152 Å²	152	80.3 Å²	80.3	92%	0.921	40%	0.404	S	S	*	.			trans	-78	73.6	173.5	-153.1	0	0	0	0	109.4	R148	V146-R148 PolarHBondContact O-N 3.15Å
147	N	64.6	Low	82.4	Confident	97 Å²	97	79 Å²	79	52%	0.519	40%	0.397	S	S	.	.			trans	-79.1	88.8	177.3	-76.1	-33.6	0	0	0	110	L142 S145	L142-N147 HydrophobicContact CD2-CB 4.1Å; L142-N147 WeakPolarHBondContact CD2-ND2 3.45Å; S145-N147 PolarHBondContact O-N 2.99Å; S145-N147 VanDerWaalsContact OG-CG 3.31Å; S145-N147 PolarHBondContact OG-ND2 3.25Å; S145-N147 PolarHBondContact OG-OD1 3.49Å; S145-N147 VanDerWaalsContact OG-OD1 3.1Å
148	R	78.4	Confident	82.7	Confident	225 Å²	225	78.9 Å²	78.9	85%	0.849	40%	0.397	S	S	*	.	P	Polyproline II helix	trans	-63.9	141.1	168.3	-171.9	174.5	-179.4	173.6	1.8	109.4	V146 I150	V146-R148 PolarHBondContact O-N 3.15Å; R148-I150 PolarHBondContact O-N 2.85Å
149	L	89.8	Confident	83.1	Confident	27 Å²	27	78.1 Å²	78.1	14%	0.141	39%	0.394	C	S	.	.	P	Polyproline II helix	trans	-55.5	122.1	172.6	-179.9	60.7	0	0	0	110.4	F102 M105 P174 I176	F102-L149 HydrophobicContact CB-CD2 3.44Å; F102-L149 VanDerWaalsContact CB-CD2 3.44Å; M105-L149 HydrophobicContact CG-CD1 3.84Å; M105-L149 HydrophobicContact SD-CD1 4.28Å; L149-P174 HydrophobicContact CD1-CG 3.89Å; L149-P174 HydrophobicContact CD2-CG 4.43Å; L149-P174 HydrophobicContact CG-CG 4.32Å; L149-I176 HydrophobicContact CD2-CD1 4.12Å
150	I	93.8	Very high	83.6	Confident	56 Å²	56	75.6 Å²	75.6	29%	0.287	39%	0.385	S	S	.	.	P	Polyproline II helix	trans	-87.8	120.2	170.8	-62.5	153.4	0	0	0	107.2	R148 S164 N168 I170 L173 P174	R148-I150 PolarHBondContact O-N 2.85Å; I150-S164 WeakPolarHBondContact CG2-OG 3.41Å; I150-N168 HydrophobicContact CD1-CB 3.46Å; I150-N168 VanDerWaalsContact CD1-CB 3.46Å; I150-I170 HydrophobicContact CB-CD1 4.11Å; I150-I170 HydrophobicContact CD1-CD1 4.24Å; I150-I170 HydrophobicContact CG2-CD1 4.01Å; I150-L173 HydrophobicContact CG2-CD1 3.88Å; I150-P174 WeakPolarHBondContact O-CD 3.4Å; I150-P174 WeakPolarHBondContact O-CG 3.44Å
151	S	95.7	Very high	84.2	Confident	58 Å²	58	73.6 Å²	73.6	41%	0.406	38%	0.375	S	S	.	.			trans	-132.2	168.3	178.4	63.4	0	0	0	0	110.9	P174	S151-P174 WeakPolarHBondContact CA-O 3.13Å; S151-P174 WeakPolarHBondContact CB-O 3.38Å
152	I	97.4	Very high	85	Confident	16 Å²	16	69 Å²	69	8%	0.082	36%	0.357	C	S	.	.	B	Isolated β-bridge	trans	-133.9	150.9	176.8	-165.8	160.4	0	0	0	110.8	C58 D160 A161 L173 P174 V175 I176	C58-I152 VanDerWaalsContact SG-CD1 3.6Å; I152-D160 HydrophobicContact CD1-CB 4.1Å; I152-A161 HydrophobicContact CD1-CB 3.78Å; I152-L173 HydrophobicContact CB-CD1 4.44Å; I152-L173 HydrophobicContact CB-CD2 3.97Å; I152-L173 HydrophobicContact CB-CG 4.2Å; I152-L173 HydrophobicContact CD1-CD2 4.2Å; I152-L173 HydrophobicContact CG2-CD1 4.49Å; I152-L173 HydrophobicContact CG2-CD2 3.69Å; I152-L173 HydrophobicContact CG2-CG 3.78Å; I152-P174 PolarHBondContact N-O 3.43Å; I152-V175 HydrophobicContact CG2-CB 4.48Å; I152-V175 HydrophobicContact CG2-CG2 3.94Å; I152-V175 CarbonylContact O-C 3.59Å; I152-V175 VanDerWaalsContact O-CA 3.3Å; I152-V175 WeakPolarHBondContact O-CA 3.28Å; I152-I176 PolarHBondContact O-N 3.45Å
153	K	97.6	Very high	86.1	Confident	120 Å²	120	72.6 Å²	72.6	52%	0.522	37%	0.369	S	S	.	.			trans	-80	150.3	176.4	-62.2	178.3	179.9	179.8	0	110	A155 S156 P178	K153-A155 VanDerWaalsContact C-N 3.26Å; K153-A155 PolarHBondContact O-N 3.22Å; K153-S156 WeakPolarHBondContact O-CB 3.29Å; K153-S156 PolarHBondContact O-N 2.82Å; K153-S156 VanDerWaalsContact O-N 3.15Å; K153-P178 HydrophobicContact CD-CG 4.17Å; K153-P178 HydrophobicContact CG-CG 4.3Å
154	P	97.2	Very high	87.8	Confident	17 Å²	17	67.5 Å²	67.5	11%	0.11	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-33.5	177.1	21.9	-32.4	0	0	0	113.6	C58 Y59 S156 V175 I176 L184	C58-P154 WeakPolarHBondContact CB-O 3.36Å; C58-P154 PolarHBondContact N-O 2.83Å; Y59-P154 HydrophobicContact CD2-CB 4.38Å; Y59-P154 PolarHBondContact N-O 3.39Å; P154-S156 VanDerWaalsContact C-N 3.34Å; P154-V175 HydrophobicContact CB-CG1 3.95Å; P154-I176 WeakPolarHBondContact CD-O 3.19Å; P154-L184 HydrophobicContact CB-CD1 3.99Å; P154-L184 HydrophobicContact CG-CD1 4.01Å
155	A	96.4	Very high	89.9	Confident	91 Å²	91	57 Å²	57	75%	0.752	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-8.9	179.2	0	0	0	0	0	114.4	K153	K153-A155 VanDerWaalsContact C-N 3.26Å; K153-A155 PolarHBondContact O-N 3.22Å
156	S	97.6	Very high	91.5	Very high	35 Å²	35	55.6 Å²	55.6	25%	0.245	29%	0.294	C	S	.	.	S	Bend	trans	-68.5	156	175.8	-64.6	0	0	0	0	110.9	S57 C58 K153 P154	S57-S156 CarbonylContact C-O 3.44Å; S57-S156 VanDerWaalsContact CA-O 3.3Å; S57-S156 WeakPolarHBondContact CA-O 3.32Å; C58-S156 PolarHBondContact N-O 3.08Å; C58-S156 PolarHBondContact SG-O 3.3Å; C58-S156 VanDerWaalsContact SG-O 3.4Å; K153-S156 WeakPolarHBondContact O-CB 3.29Å; K153-S156 PolarHBondContact O-N 2.82Å; K153-S156 VanDerWaalsContact O-N 3.15Å; P154-S156 VanDerWaalsContact C-N 3.34Å
157	S	97.5	Very high	93.3	Very high	19 Å²	19	54.9 Å²	54.9	13%	0.133	28%	0.278	C	S	.	.	B	Isolated β-bridge	trans	-73	154.7	-178.5	71.8	0	0	0	0	112.5	H56 F159 D160 A161	H56-S157 CarbonylContact O-C 3.53Å; H56-S157 WeakPolarHBondContact O-CA 3.38Å; S157-F159 PolarHBondContact O-N 3.41Å; S157-D160 PolarHBondContact N-OD2 2.88Å; S157-D160 PolarHBondContact O-N 3.47Å; S157-D160 VanDerWaalsContact O-N 3.15Å; S157-D160 PolarHBondContact OG-N 3.41Å; S157-D160 VanDerWaalsContact OG-N 3.11Å; S157-D160 PolarHBondContact OG-OD2 3.11Å; S157-A161 PolarHBondContact O-N 3.37Å; S157-A161 VanDerWaalsContact O-N 3.15Å
158	L	96.6	Very high	94.5	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-63.4	-28.5	170.6	-67.8	177.2	0	0	0	111.9	M53 H56 A61 A161 I162 F195	M53-L158 HydrophobicContact CB-CB 4.36Å; M53-L158 PolarHBondContact O-N 3.23Å; M53-L158 HydrophobicContact SD-CB 3.78Å; M53-L158 HydrophobicContact SD-CD1 3.96Å; H56-L158 HydrophobicContact CB-CD1 3.87Å; H56-L158 HydrophobicContact CB-CG 4.39Å; H56-L158 PolarHBondContact O-N 3.09Å; A61-L158 HydrophobicContact CB-CD1 4.15Å; A61-L158 HydrophobicContact CB-CD2 3.65Å; L158-A161 WeakPolarHBondContact O-CB 3.15Å; L158-A161 PolarHBondContact O-N 2.9Å; L158-I162 VanDerWaalsContact O-CG1 3.26Å; L158-I162 WeakPolarHBondContact O-CG1 3.49Å; L158-I162 PolarHBondContact O-N 3.47Å; L158-F195 HydrophobicContact CD1-CD1 3.6Å; L158-F195 HydrophobicContact CD1-CE1 3.5Å; L158-F195 HydrophobicContact CD1-CG 4.32Å; L158-F195 HydrophobicContact CD1-CZ 4.16Å
159	F	95.8	Very high	95.1	Very high	26 Å²	26	51.6 Å²	51.6	11%	0.114	27%	0.269	C	S	.	.	H	α-helix	trans	-57.6	-48.1	170.8	177.8	-87.3	0	0	0	111.6	M50 M53 K54 S157 A161 I162 Y163 V343 L344 A347	M50-F159 HydrophobicContact CG-CD2 3.86Å; M50-F159 HydrophobicContact CG-CE2 3.76Å; M50-F159 HydrophobicContact SD-CE2 4.29Å; M53-F159 HydrophobicContact CB-CB 4.22Å; M53-F159 PolarHBondContact O-N 3.17Å; M53-F159 VanDerWaalsContact O-N 3.07Å; K54-F159 HydrophobicContact CG-CB 3.69Å; K54-F159 HydrophobicContact CG-CD1 4.42Å; K54-F159 HydrophobicContact CG-CD2 4.17Å; K54-F159 HydrophobicContact CG-CG 3.84Å; S157-F159 PolarHBondContact O-N 3.41Å; F159-A161 VanDerWaalsContact C-N 3.29Å; F159-A161 PolarHBondContact O-N 2.89Å; F159-I162 PolarHBondContact O-N 3.15Å; F159-Y163 WeakPolarHBondContact O-CB 3.34Å; F159-Y163 PolarHBondContact O-N 3.44Å; F159-V343 HydrophobicContact CD2-CG1 3.48Å; F159-V343 VanDerWaalsContact CD2-CG1 3.48Å; F159-V343 HydrophobicContact CE2-CG1 3.98Å; F159-V343 HydrophobicContact CG-CG1 4.46Å; F159-L344 HydrophobicContact CD2-CD2 4.43Å; F159-L344 HydrophobicContact CE2-CD2 3.76Å; F159-L344 HydrophobicContact CZ-CD2 3.86Å; F159-A347 HydrophobicContact CE2-CB 4.02Å; F159-A347 HydrophobicContact CZ-CB 3.88Å
160	D	96.4	Very high	95.3	Very high	73 Å²	73	52.3 Å²	52.3	39%	0.39	27%	0.273	S	S	.	.	H	α-helix	trans	-64.6	-36	177.8	-60.5	-44.6	0	0	0	111.6	I152 S157 Y163 S164	I152-D160 HydrophobicContact CD1-CB 4.1Å; S157-D160 PolarHBondContact N-OD2 2.88Å; S157-D160 PolarHBondContact O-N 3.47Å; S157-D160 VanDerWaalsContact O-N 3.15Å; S157-D160 PolarHBondContact OG-N 3.41Å; S157-D160 VanDerWaalsContact OG-N 3.11Å; S157-D160 PolarHBondContact OG-OD2 3.11Å; D160-Y163 PolarHBondContact O-N 2.75Å; D160-S164 VanDerWaalsContact O-CB 3.29Å; D160-S164 WeakPolarHBondContact O-CB 3.47Å; D160-S164 PolarHBondContact O-N 3.09Å
161	A	97	Very high	95.2	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-62.3	-48.3	175	0	0	0	0	0	111.8	I152 S157 L158 F159 S164 L165 L173 L187 I192	I152-A161 HydrophobicContact CD1-CB 3.78Å; S157-A161 PolarHBondContact O-N 3.37Å; S157-A161 VanDerWaalsContact O-N 3.15Å; L158-A161 WeakPolarHBondContact O-CB 3.15Å; L158-A161 PolarHBondContact O-N 2.9Å; F159-A161 VanDerWaalsContact C-N 3.29Å; F159-A161 PolarHBondContact O-N 2.89Å; A161-S164 PolarHBondContact O-N 3.15Å; A161-L165 WeakPolarHBondContact O-CG 3.42Å; A161-L165 PolarHBondContact O-N 3.4Å; A161-L173 HydrophobicContact CB-CD2 3.96Å; A161-L187 HydrophobicContact CB-CD1 4.29Å; A161-I192 HydrophobicContact CB-CD1 4.43Å
162	I	96.1	Very high	95.2	Very high	0 Å²	0	52 Å²	52	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-61.7	-46.9	177.3	-67.9	164.9	0	0	0	110.2	M53 L158 F159 S164 L165 L166 I192 L339 V343 L344	M53-I162 HydrophobicContact CB-CD1 4.5Å; M53-I162 HydrophobicContact CE-CD1 4.13Å; M53-I162 HydrophobicContact CG-CD1 4.02Å; M53-I162 HydrophobicContact SD-CD1 4Å; L158-I162 VanDerWaalsContact O-CG1 3.26Å; L158-I162 WeakPolarHBondContact O-CG1 3.49Å; L158-I162 PolarHBondContact O-N 3.47Å; F159-I162 PolarHBondContact O-N 3.15Å; I162-S164 VanDerWaalsContact C-N 3.32Å; I162-S164 PolarHBondContact O-N 3.4Å; I162-L165 PolarHBondContact O-N 2.71Å; I162-L166 HydrophobicContact CG2-CD1 3.61Å; I162-L166 HydrophobicContact CG2-CG 4.43Å; I162-L166 WeakPolarHBondContact O-CB 3.26Å; I162-L166 WeakPolarHBondContact O-CG 3.48Å; I162-L166 PolarHBondContact O-N 2.86Å; I162-I192 HydrophobicContact CD1-CG2 3.7Å; I162-I192 HydrophobicContact CG1-CD1 3.99Å; I162-I192 HydrophobicContact CG1-CG2 3.81Å; I162-L339 HydrophobicContact CD1-CD2 4.2Å; I162-L339 HydrophobicContact CG2-CB 4.21Å; I162-V343 HydrophobicContact CD1-CB 4.21Å; I162-V343 HydrophobicContact CD1-CG1 3.95Å; I162-V343 HydrophobicContact CD1-CG2 3.88Å; I162-V343 HydrophobicContact CG2-CB 4.44Å; I162-V343 HydrophobicContact CG2-CG1 4.48Å; I162-L344 HydrophobicContact CG2-CD1 4.44Å; I162-L344 HydrophobicContact CG2-CD2 4.46Å; I162-L344 HydrophobicContact CG2-CG 4.22Å
163	Y	95.6	Very high	95.2	Very high	110 Å²	110	51.3 Å²	51.3	43%	0.431	26%	0.258	S	S	.	.	H	α-helix	trans	-58.2	-44.7	176.4	178.3	-109	0	0	0	111.8	F159 D160 L166 K167 L344	F159-Y163 WeakPolarHBondContact O-CB 3.34Å; F159-Y163 PolarHBondContact O-N 3.44Å; D160-Y163 PolarHBondContact O-N 2.75Å; Y163-L166 PolarHBondContact O-N 3.4Å; Y163-K167 HydrophobicContact CE1-CD 3.77Å; Y163-K167 HydrophobicContact CE2-CD 4.39Å; Y163-K167 WeakPolarHBondContact O-CB 3.48Å; Y163-K167 PolarHBondContact O-N 3.06Å; Y163-L344 HydrophobicContact CD2-CD1 4.3Å; Y163-L344 HydrophobicContact CD2-CD2 4.31Å
164	S	95.6	Very high	95.2	Very high	19 Å²	19	45.6 Å²	45.6	13%	0.133	23%	0.233	C	C	.	.	H	α-helix	trans	-65.1	-42.9	178.3	-171.6	0	0	0	0	112.7	I150 D160 A161 I162 N168	I150-S164 WeakPolarHBondContact CG2-OG 3.41Å; D160-S164 VanDerWaalsContact O-CB 3.29Å; D160-S164 WeakPolarHBondContact O-CB 3.47Å; D160-S164 PolarHBondContact O-N 3.09Å; A161-S164 PolarHBondContact O-N 3.15Å; I162-S164 VanDerWaalsContact C-N 3.32Å; I162-S164 PolarHBondContact O-N 3.4Å; S164-N168 WeakPolarHBondContact O-CB 3.24Å; S164-N168 PolarHBondContact O-N 2.89Å; S164-N168 PolarHBondContact O-ND2 3.19Å; S164-N168 PolarHBondContact OG-ND2 3Å
165	L	95	Very high	95.2	Very high	1 Å²	1	44.8 Å²	44.8	1%	0.005	23%	0.228	C	C	.	.	H	α-helix	trans	-59	-48.3	176	-75.5	166.8	0	0	0	111.5	A161 I162 K169 I170 L173 I192	A161-L165 WeakPolarHBondContact O-CG 3.42Å; A161-L165 PolarHBondContact O-N 3.4Å; I162-L165 PolarHBondContact O-N 2.71Å; L165-K169 WeakPolarHBondContact O-CA 3.14Å; L165-K169 PolarHBondContact O-N 2.88Å; L165-K169 VanDerWaalsContact O-N 3.11Å; L165-I170 HydrophobicContact CD2-CG1 4.19Å; L165-I170 WeakPolarHBondContact CD2-O 3.38Å; L165-I170 PolarHBondContact O-N 3.49Å; L165-L173 HydrophobicContact CD2-CB 3.65Å; L165-L173 HydrophobicContact CG-CB 4.1Å; L165-L173 HydrophobicContact CG-CD2 4.3Å; L165-I192 HydrophobicContact CD1-CD1 3.57Å
166	L	92.3	Very high	95.2	Very high	26 Å²	26	41.8 Å²	41.8	14%	0.136	20%	0.199	C	C	.	.	H	α-helix	trans	-76.3	-46.1	-174.4	-65.1	171.7	0	0	0	112.2	I162 Y163 N168 K169 Q340 L344	I162-L166 HydrophobicContact CG2-CD1 3.61Å; I162-L166 HydrophobicContact CG2-CG 4.43Å; I162-L166 WeakPolarHBondContact O-CB 3.26Å; I162-L166 WeakPolarHBondContact O-CG 3.48Å; I162-L166 PolarHBondContact O-N 2.86Å; Y163-L166 PolarHBondContact O-N 3.4Å; L166-N168 VanDerWaalsContact C-N 3.33Å; L166-N168 PolarHBondContact O-N 3.45Å; L166-K169 PolarHBondContact O-N 3.41Å; L166-K169 VanDerWaalsContact O-N 3.12Å; L166-Q340 HydrophobicContact CD1-CB 4Å; L166-L344 HydrophobicContact CB-CD1 4.13Å; L166-L344 HydrophobicContact CD1-CD1 3.48Å; L166-L344 VanDerWaalsContact CD1-CD1 3.48Å; L166-L344 HydrophobicContact CD1-CG 4.21Å; L166-L344 HydrophobicContact CG-CD1 4.4Å
167	K	92.6	Very high	95.1	Very high	136 Å²	136	41.9 Å²	41.9	59%	0.591	20%	0.197	S	C	*	.	H	α-helix	trans	-57.8	-45.7	178.1	178.8	178.2	-179.3	174.8	0	111.9	Y163 K169	Y163-K167 HydrophobicContact CE1-CD 3.77Å; Y163-K167 HydrophobicContact CE2-CD 4.39Å; Y163-K167 WeakPolarHBondContact O-CB 3.48Å; Y163-K167 PolarHBondContact O-N 3.06Å; K167-K169 VanDerWaalsContact C-N 3.29Å
168	N	91	Very high	94.9	Very high	67 Å²	67	45 Å²	45	36%	0.358	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	0.4	-177.9	-59.1	-67.8	0	0	0	112.9	I150 S164 L166 I170	I150-N168 HydrophobicContact CD1-CB 3.46Å; I150-N168 VanDerWaalsContact CD1-CB 3.46Å; S164-N168 WeakPolarHBondContact O-CB 3.24Å; S164-N168 PolarHBondContact O-N 2.89Å; S164-N168 PolarHBondContact O-ND2 3.19Å; S164-N168 PolarHBondContact OG-ND2 3Å; L166-N168 VanDerWaalsContact C-N 3.33Å; L166-N168 PolarHBondContact O-N 3.45Å; N168-I170 HydrophobicContact CB-CD1 4.26Å; N168-I170 HydrophobicContact CB-CG1 4.12Å; N168-I170 HydrophobicContact CB-CG2 4.28Å; N168-I170 WeakPolarHBondContact O-CG2 3.36Å; N168-I170 PolarHBondContact O-N 3.28Å
169	K	90.6	Very high	94.8	Very high	186 Å²	186	49.5 Å²	49.5	81%	0.809	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.9	39.8	-178.3	-56.7	-178	179.6	-178.4	0	112.7	L165 L166 K167	L165-K169 WeakPolarHBondContact O-CA 3.14Å; L165-K169 PolarHBondContact O-N 2.88Å; L165-K169 VanDerWaalsContact O-N 3.11Å; L166-K169 PolarHBondContact O-N 3.41Å; L166-K169 VanDerWaalsContact O-N 3.12Å; K167-K169 VanDerWaalsContact C-N 3.29Å
170	I	92.7	Very high	94.7	Very high	43 Å²	43	51.3 Å²	51.3	22%	0.221	27%	0.269	C	S	.	.			trans	-109.9	150.4	179.8	60	175	0	0	0	110.9	I150 L165 N168 L173 H189	I150-I170 HydrophobicContact CB-CD1 4.11Å; I150-I170 HydrophobicContact CD1-CD1 4.24Å; I150-I170 HydrophobicContact CG2-CD1 4.01Å; L165-I170 HydrophobicContact CD2-CG1 4.19Å; L165-I170 WeakPolarHBondContact CD2-O 3.38Å; L165-I170 PolarHBondContact O-N 3.49Å; N168-I170 HydrophobicContact CB-CD1 4.26Å; N168-I170 HydrophobicContact CB-CG1 4.12Å; N168-I170 HydrophobicContact CB-CG2 4.28Å; N168-I170 WeakPolarHBondContact O-CG2 3.36Å; N168-I170 PolarHBondContact O-N 3.28Å; I170-L173 HydrophobicContact CD1-CD1 4.2Å; I170-H189 PolarHBondContact O-CE1 3.02Å; I170-H189 VanDerWaalsContact O-CE1 3.3Å
171	H	92.5	Very high	94.4	Very high	62 Å²	62	49.5 Å²	49.5	29%	0.287	27%	0.268	S	S	.	.	S	Bend	trans	-105	-8.1	-176.2	-66.9	-160	0	0	0	113.4
172	R	95.2	Very high	94.3	Very high	46 Å²	46	54.1 Å²	54.1	17%	0.174	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	119.7	-173	-57.4	-62	-177.3	-144.9	5.7	107.3	A91 M105 I186	A91-R172 HydrophobicContact CB-CG 3.88Å; M105-R172 HydrophobicContact CE-CB 4.41Å; R172-I186 HydrophobicContact CB-CG2 3.77Å; R172-I186 HydrophobicContact CG-CG2 4.4Å
173	L	97.3	Very high	94.3	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	105.2	-179.6	-179.8	64.4	0	0	0	108.7	I150 I152 A161 L165 I170 V175 L187	I150-L173 HydrophobicContact CG2-CD1 3.88Å; I152-L173 HydrophobicContact CB-CD1 4.44Å; I152-L173 HydrophobicContact CB-CD2 3.97Å; I152-L173 HydrophobicContact CB-CG 4.2Å; I152-L173 HydrophobicContact CD1-CD2 4.2Å; I152-L173 HydrophobicContact CG2-CD1 4.49Å; I152-L173 HydrophobicContact CG2-CD2 3.69Å; I152-L173 HydrophobicContact CG2-CG 3.78Å; A161-L173 HydrophobicContact CB-CD2 3.96Å; L165-L173 HydrophobicContact CD2-CB 3.65Å; L165-L173 HydrophobicContact CG-CB 4.1Å; L165-L173 HydrophobicContact CG-CD2 4.3Å; I170-L173 HydrophobicContact CD1-CD1 4.2Å; L173-V175 PolarHBondContact O-N 3.42Å; L173-L187 HydrophobicContact CB-CB 4.34Å; L173-L187 PolarHBondContact N-O 3.32Å; L173-L187 PolarHBondContact O-N 2.95Å
174	P	97.3	Very high	94.3	Very high	1 Å²	1	52.5 Å²	52.5	1%	0.006	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	132.3	177.4	26.3	-33	0	0	0	111.1	M105 L149 I150 S151 I152 I176 V183	M105-P174 HydrophobicContact SD-CB 4.29Å; M105-P174 HydrophobicContact SD-CG 4Å; L149-P174 HydrophobicContact CD1-CG 3.89Å; L149-P174 HydrophobicContact CD2-CG 4.43Å; L149-P174 HydrophobicContact CG-CG 4.32Å; I150-P174 WeakPolarHBondContact O-CD 3.4Å; I150-P174 WeakPolarHBondContact O-CG 3.44Å; S151-P174 WeakPolarHBondContact CA-O 3.13Å; S151-P174 WeakPolarHBondContact CB-O 3.38Å; I152-P174 PolarHBondContact N-O 3.43Å; P174-I176 HydrophobicContact CB-CG1 4.36Å; P174-V183 HydrophobicContact CB-CG1 4.29Å
175	V	97.6	Very high	94.3	Very high	0 Å²	0	53 Å²	53	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	113.5	171.8	-173.4	0	0	0	0	107.5	M62 I152 P154 L173 L184 H185 L187	M62-V175 HydrophobicContact SD-CB 4.42Å; M62-V175 HydrophobicContact SD-CG1 4.26Å; I152-V175 HydrophobicContact CG2-CB 4.48Å; I152-V175 HydrophobicContact CG2-CG2 3.94Å; I152-V175 CarbonylContact O-C 3.59Å; I152-V175 VanDerWaalsContact O-CA 3.3Å; I152-V175 WeakPolarHBondContact O-CA 3.28Å; P154-V175 HydrophobicContact CB-CG1 3.95Å; L173-V175 PolarHBondContact O-N 3.42Å; V175-L184 PolarHBondContact O-N 3.12Å; V175-H185 PolarHBondContact N-O 2.95Å; V175-L187 HydrophobicContact CG2-CB 4.28Å; V175-L187 HydrophobicContact CG2-CD1 3.58Å; V175-L187 HydrophobicContact CG2-CG 3.93Å
176	I	96.6	Very high	94.4	Very high	27 Å²	27	54.2 Å²	54.2	14%	0.138	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	127	-176.5	-56.5	-175.8	0	0	0	108.7	F102 L149 I152 P154 P174 P178 N182 V183	F102-I176 HydrophobicContact CD2-CD1 4.41Å; L149-I176 HydrophobicContact CD2-CD1 4.12Å; I152-I176 PolarHBondContact O-N 3.45Å; P154-I176 WeakPolarHBondContact CD-O 3.19Å; P174-I176 HydrophobicContact CB-CG1 4.36Å; I176-P178 WeakPolarHBondContact O-CD 3.45Å; I176-N182 WeakPolarHBondContact CA-O 3.44Å; I176-V183 HydrophobicContact CD1-CG2 4.21Å; I176-V183 HydrophobicContact CG1-CG2 4Å
177	D	95.8	Very high	94.6	Very high	38 Å²	38	53 Å²	53	20%	0.203	29%	0.292	C	S	.	.			trans	-74.2	119.1	172.3	173.9	36.2	0	0	0	110	A179 S180 G181 N182 L184	D177-A179 PolarHBondContact O-N 3Å; D177-A179 PolarHBondContact OD1-N 2.78Å; D177-S180 WeakPolarHBondContact CB-OG 3.37Å; D177-S180 VanDerWaalsContact OD2-CB 3.29Å; D177-S180 WeakPolarHBondContact OD2-CB 3.48Å; D177-S180 PolarHBondContact OD2-N 3.26Å; D177-S180 PolarHBondContact OD2-OG 3.49Å; D177-G181 WeakPolarHBondContact O-CA 3.45Å; D177-G181 PolarHBondContact O-N 3.13Å; D177-N182 PolarHBondContact N-O 3.35Å; D177-L184 HydrophobicContact CB-CD1 4.08Å; D177-L184 HydrophobicContact CB-CD2 4.23Å; D177-L184 HydrophobicContact CB-CG 4.15Å
178	P	93.4	Very high	94.8	Very high	85 Å²	85	47.5 Å²	47.5	55%	0.552	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-20.7	179.7	29	-36.8	0	0	0	113.7	K153 I176	K153-P178 HydrophobicContact CD-CG 4.17Å; K153-P178 HydrophobicContact CG-CG 4.3Å; I176-P178 WeakPolarHBondContact O-CD 3.45Å
179	A	93.6	Very high	94.9	Very high	94 Å²	94	44.8 Å²	44.8	78%	0.777	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-47.7	-179	0	0	0	0	0	111.7	D177	D177-A179 PolarHBondContact O-N 3Å; D177-A179 PolarHBondContact OD1-N 2.78Å
180	S	93.6	Very high	94.9	Very high	63 Å²	63	38.1 Å²	38.1	44%	0.441	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-21.4	179.5	60.6	0	0	0	0	114.6	D177 N182	D177-S180 WeakPolarHBondContact CB-OG 3.37Å; D177-S180 VanDerWaalsContact OD2-CB 3.29Å; D177-S180 WeakPolarHBondContact OD2-CB 3.48Å; D177-S180 PolarHBondContact OD2-N 3.26Å; D177-S180 PolarHBondContact OD2-OG 3.49Å; S180-N182 WeakPolarHBondContact CB-ND2 3.08Å; S180-N182 PolarHBondContact O-N 2.96Å; S180-N182 WeakPolarHBondContact OG-CB 3.44Å; S180-N182 PolarHBondContact OG-N 3.01Å; S180-N182 PolarHBondContact OG-ND2 3.44Å
181	G	91.9	Very high	95	Very high	36 Å²	36	37.8 Å²	37.8	37%	0.371	22%	0.222	S	C	.	.			trans	76.5	0.8	-169	0	0	0	0	0	113.9	F102 D177	F102-G181 WeakPolarHBondContact CE2-O 3.41Å; D177-G181 WeakPolarHBondContact O-CA 3.45Å; D177-G181 PolarHBondContact O-N 3.13Å
182	N	94.4	Very high	95	Very high	97 Å²	97	34.8 Å²	34.8	52%	0.519	21%	0.208	S	C	.	.			trans	-74.2	141.3	-177.5	-68.6	-32.6	0	0	0	111.9	I176 D177 S180 L184	I176-N182 WeakPolarHBondContact CA-O 3.44Å; D177-N182 PolarHBondContact N-O 3.35Å; S180-N182 WeakPolarHBondContact CB-ND2 3.08Å; S180-N182 PolarHBondContact O-N 2.96Å; S180-N182 WeakPolarHBondContact OG-CB 3.44Å; S180-N182 PolarHBondContact OG-N 3.01Å; S180-N182 PolarHBondContact OG-ND2 3.44Å; N182-L184 HydrophobicContact CB-CD2 4.42Å; N182-L184 PolarHBondContact O-N 3.23Å
183	V	95.8	Very high	94.8	Very high	15 Å²	15	32.8 Å²	32.8	9%	0.091	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	117.2	166.2	-178.4	0	0	0	0	107.7	L68 P93 F102 P174 I176	L68-V183 HydrophobicContact CD1-CG1 4.21Å; L68-V183 HydrophobicContact CD2-CB 3.57Å; L68-V183 HydrophobicContact CD2-CG1 3.51Å; L68-V183 VanDerWaalsContact CD2-O 3.3Å; L68-V183 WeakPolarHBondContact CD2-O 3.49Å; P93-V183 HydrophobicContact CB-CG2 4.32Å; P93-V183 HydrophobicContact CG-CG1 4.03Å; P93-V183 HydrophobicContact CG-CG2 4.29Å; F102-V183 HydrophobicContact CD1-CG2 4.02Å; F102-V183 HydrophobicContact CD2-CG2 3.92Å; F102-V183 HydrophobicContact CE1-CG2 3.65Å; F102-V183 HydrophobicContact CE2-CG2 3.57Å; F102-V183 HydrophobicContact CG-CG2 4.14Å; F102-V183 HydrophobicContact CZ-CB 4.41Å; F102-V183 HydrophobicContact CZ-CG2 3.42Å; F102-V183 VanDerWaalsContact CZ-CG2 3.42Å; P174-V183 HydrophobicContact CB-CG1 4.29Å; I176-V183 HydrophobicContact CD1-CG2 4.21Å; I176-V183 HydrophobicContact CG1-CG2 4Å
184	L	95.6	Very high	94.5	Very high	61 Å²	61	34.6 Å²	34.6	32%	0.319	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	-42.9	-178	-57.1	-177	0	0	0	111.7	M62 P154 V175 D177 N182	M62-L184 HydrophobicContact CE-CB 4.41Å; M62-L184 HydrophobicContact CE-CD1 4.21Å; M62-L184 HydrophobicContact SD-CB 4.08Å; P154-L184 HydrophobicContact CB-CD1 3.99Å; P154-L184 HydrophobicContact CG-CD1 4.01Å; V175-L184 PolarHBondContact O-N 3.12Å; D177-L184 HydrophobicContact CB-CD1 4.08Å; D177-L184 HydrophobicContact CB-CD2 4.23Å; D177-L184 HydrophobicContact CB-CG 4.15Å; N182-L184 HydrophobicContact CB-CD2 4.42Å; N182-L184 PolarHBondContact O-N 3.23Å
185	H	96.3	Very high	94.2	Very high	30 Å²	30	34.8 Å²	34.8	14%	0.139	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.4	168.9	-176.2	-165	61.5	0	0	0	111.5	M62 S66 V175	M62-H185 HydrophobicContact CG-CB 3.9Å; M62-H185 HydrophobicContact SD-CB 3.43Å; M62-H185 WeakPolarHBondContact SD-CB 3.38Å; S66-H185 PolarHBondContact OG-ND1 2.81Å; V175-H185 PolarHBondContact N-O 2.95Å
186	I	96.9	Very high	93.8	Very high	25 Å²	25	35.1 Å²	35.1	13%	0.128	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	106.2	172.3	-58.6	166.7	0	0	0	108.7	L68 P93 M105 R172	L68-I186 HydrophobicContact CD1-CD1 3.78Å; L68-I186 HydrophobicContact CD1-CG1 3.86Å; P93-I186 HydrophobicContact CG-CD1 4.37Å; M105-I186 HydrophobicContact CE-CD1 3.86Å; M105-I186 HydrophobicContact CE-CG1 4.31Å; M105-I186 HydrophobicContact CE-CG2 4.42Å; R172-I186 HydrophobicContact CB-CG2 3.77Å; R172-I186 HydrophobicContact CG-CG2 4.4Å
187	L	96.6	Very high	93.3	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	143.2	175.5	-96.2	164.4	0	0	0	111.5	C58 A61 A161 L173 V175 I192	C58-L187 HydrophobicContact CB-CD1 3.68Å; A61-L187 HydrophobicContact CB-CD2 4.16Å; A161-L187 HydrophobicContact CB-CD1 4.29Å; L173-L187 HydrophobicContact CB-CB 4.34Å; L173-L187 PolarHBondContact N-O 3.32Å; L173-L187 PolarHBondContact O-N 2.95Å; V175-L187 HydrophobicContact CG2-CB 4.28Å; V175-L187 HydrophobicContact CG2-CD1 3.58Å; V175-L187 HydrophobicContact CG2-CG 3.93Å; L187-I192 HydrophobicContact CD2-CD1 4.16Å; L187-I192 HydrophobicContact CD2-CG1 3.68Å
188	T	95.3	Very high	92.9	Very high	22 Å²	22	36.4 Å²	36.4	14%	0.135	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	154	-176.6	77.7	0	0	0	0	110.1	K190 R191 I192	T188-K190 PolarHBondContact O-N 3.33Å; T188-K190 PolarHBondContact OG1-N 2.96Å; T188-R191 PolarHBondContact O-N 3.36Å; T188-R191 VanDerWaalsContact O-N 3.15Å; T188-R191 PolarHBondContact OG1-N 2.79Å; T188-R191 VanDerWaalsContact OG1-N 3.13Å; T188-I192 WeakPolarHBondContact O-CG1 3.43Å; T188-I192 PolarHBondContact O-N 3.02Å
189	H	94.1	Very high	92.5	Very high	10 Å²	10	32.7 Å²	32.7	5%	0.046	19%	0.191	C	C	.	.	H	α-helix	trans	-52.6	-39.6	173.7	-61.4	97.5	0	0	0	112.2	I170 I192 L193 L335 S336 L339	I170-H189 PolarHBondContact O-CE1 3.02Å; I170-H189 VanDerWaalsContact O-CE1 3.3Å; H189-I192 PolarHBondContact O-N 2.85Å; H189-L193 PolarHBondContact O-N 3.11Å; H189-L335 HydrophobicContact CB-CB 3.9Å; H189-L335 HydrophobicContact CB-CD1 4.18Å; H189-S336 PolarHBondContact CD2-OG 2.87Å; H189-S336 PolarHBondContact CE1-OG 2.81Å; H189-S336 PolarHBondContact NE2-OG 2.91Å; H189-S336 VanDerWaalsContact NE2-OG 3.11Å; H189-L339 HydrophobicContact CB-CD1 3.83Å
190	K	91.4	Very high	91.8	Very high	46 Å²	46	29 Å²	29	20%	0.2	16%	0.162	C	C	.	.	H	α-helix	trans	-63.2	-47.3	179.4	-179.2	180	168.3	179.9	0	111.4	T188 L193 K194 E316 L335	T188-K190 PolarHBondContact O-N 3.33Å; T188-K190 PolarHBondContact OG1-N 2.96Å; K190-L193 PolarHBondContact O-N 3.09Å; K190-K194 WeakPolarHBondContact O-CB 3.23Å; K190-K194 PolarHBondContact O-N 3.49Å; K190-E316 WeakPolarHBondContact CE-O 3.34Å; K190-E316 WeakPolarHBondContact CE-OE2 3.38Å; K190-E316 VanDerWaalsContact NZ-CB 3.34Å; K190-E316 PolarHBondContact NZ-O 2.84Å; K190-E316 IonicContact NZ-OE2 3.91Å; K190-E316 PolarHBondContact NZ-OE2 3.45Å; K190-L335 HydrophobicContact CB-CD1 3.82Å
191	R	93.1	Very high	91	Very high	35 Å²	35	31.1 Å²	31.1	13%	0.132	18%	0.177	C	C	.	.	H	α-helix	trans	-66.1	-39.7	179.9	-177.7	56.3	179.2	163.1	1.1	111.7	E19 A61 T188 K194 F195	E19-R191 IonicContact OE1-CZ 3.66Å; E19-R191 IonicContact OE1-NH1 2.8Å; E19-R191 IonicContact OE1-NH2 2.74Å; E19-R191 PolarHBondContact OE1-NH2 2.88Å; E19-R191 IonicContact OE2-CZ 3.56Å; E19-R191 IonicContact OE2-NH1 3.7Å; E19-R191 PolarHBondContact OE2-NH1 3.13Å; E19-R191 IonicContact OE2-NH2 3.26Å; A61-R191 WeakPolarHBondContact O-CG 3.41Å; A61-R191 PolarHBondContact O-NE 3.2Å; A61-R191 PolarHBondContact O-NH2 3.44Å; A61-R191 VanDerWaalsContact O-NH2 3.14Å; T188-R191 PolarHBondContact O-N 3.36Å; T188-R191 VanDerWaalsContact O-N 3.15Å; T188-R191 PolarHBondContact OG1-N 2.79Å; T188-R191 VanDerWaalsContact OG1-N 3.13Å; R191-K194 PolarHBondContact O-N 3.13Å; R191-F195 WeakPolarHBondContact O-CB 3.46Å; R191-F195 PolarHBondContact O-N 2.91Å
192	I	94	Very high	90.4	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-64.5	-43.8	177	-64.8	168.9	0	0	0	111	M53 A161 I162 L165 L187 T188 H189 F195 L196 L339	M53-I192 HydrophobicContact CE-CG2 3.87Å; M53-I192 HydrophobicContact SD-CG2 4.36Å; A161-I192 HydrophobicContact CB-CD1 4.43Å; I162-I192 HydrophobicContact CD1-CG2 3.7Å; I162-I192 HydrophobicContact CG1-CD1 3.99Å; I162-I192 HydrophobicContact CG1-CG2 3.81Å; L165-I192 HydrophobicContact CD1-CD1 3.57Å; L187-I192 HydrophobicContact CD2-CD1 4.16Å; L187-I192 HydrophobicContact CD2-CG1 3.68Å; T188-I192 WeakPolarHBondContact O-CG1 3.43Å; T188-I192 PolarHBondContact O-N 3.02Å; H189-I192 PolarHBondContact O-N 2.85Å; I192-F195 WeakPolarHBondContact O-CB 3.4Å; I192-F195 PolarHBondContact O-N 3.07Å; I192-L196 PolarHBondContact O-N 2.76Å; I192-L339 HydrophobicContact CB-CD1 4.48Å; I192-L339 HydrophobicContact CG2-CD1 4.36Å; I192-L339 HydrophobicContact CG2-CD2 3.99Å
193	L	91.1	Very high	89.8	Confident	3 Å²	3	30.1 Å²	30.1	2%	0.016	16%	0.161	C	C	.	.	H	α-helix	trans	-67.4	-40.2	176.1	-169.9	72.1	0	0	0	111.6	H189 K190 F195 L196 H197 I309 I312 L335 I338 L339	H189-L193 PolarHBondContact O-N 3.11Å; K190-L193 PolarHBondContact O-N 3.09Å; L193-F195 VanDerWaalsContact C-N 3.32Å; L193-F195 PolarHBondContact O-N 3.48Å; L193-L196 HydrophobicContact CD1-CD2 4.29Å; L193-L196 WeakPolarHBondContact O-CB 3.4Å; L193-L196 PolarHBondContact O-N 3.32Å; L193-L196 VanDerWaalsContact O-N 3.15Å; L193-H197 WeakPolarHBondContact O-CB 3.48Å; L193-H197 PolarHBondContact O-N 3.47Å; L193-I309 HydrophobicContact CD1-CG2 4.32Å; L193-I312 HydrophobicContact CD2-CG2 4Å; L193-L335 HydrophobicContact CB-CD2 4.01Å; L193-L335 HydrophobicContact CD2-CD2 3.15Å; L193-L335 HydrophobicContact CG-CD2 4.16Å; L193-I338 HydrophobicContact CD1-CG2 4.08Å; L193-L339 HydrophobicContact CD1-CD2 4.33Å
194	K	89.5	Confident	89.3	Confident	39 Å²	39	33.8 Å²	33.8	17%	0.17	19%	0.185	C	C	.	.	H	α-helix	trans	-59.1	-44	175	-174.5	167.1	-175.6	165.6	0	111.1	E16 K190 R191 L196 H197 I198 E316	E16-K194 WeakPolarHBondContact OE1-CE 3.09Å; E16-K194 IonicContact OE1-NZ 3.85Å; E16-K194 PolarHBondContact OE1-NZ 3.24Å; K190-K194 WeakPolarHBondContact O-CB 3.23Å; K190-K194 PolarHBondContact O-N 3.49Å; R191-K194 PolarHBondContact O-N 3.13Å; K194-L196 PolarHBondContact O-N 3.41Å; K194-H197 PolarHBondContact O-N 3.28Å; K194-I198 HydrophobicContact CG-CD1 3.77Å; K194-I198 HydrophobicContact CG-CG1 4.34Å; K194-I198 WeakPolarHBondContact O-CB 3.32Å; K194-I198 VanDerWaalsContact O-CG1 3.24Å; K194-I198 WeakPolarHBondContact O-CG1 3.42Å; K194-I198 PolarHBondContact O-N 2.88Å; K194-E316 IonicContact NZ-OE1 3.14Å; K194-E316 PolarHBondContact NZ-OE1 3.22Å
195	F	91.6	Very high	88.6	Confident	4 Å²	4	37.1 Å²	37.1	2%	0.018	20%	0.197	C	C	.	.	H	α-helix	trans	-56.7	-48.8	172.6	-178.3	-91.4	0	0	0	111.6	F52 H56 D60 A61 L158 R191 I192 L193 H197 I198 F199	F52-F195 HydrophobicContact CE1-CD1 4.13Å; F52-F195 AromaticContact CE1-CE1 3.68Å; F52-F195 HydrophobicContact CE1-CE1 3.68Å; F52-F195 AromaticContact CZ-CE1 3.98Å; F52-F195 HydrophobicContact CZ-CE1 3.98Å; H56-F195 HydrophobicContact CB-CE1 4.06Å; H56-F195 HydrophobicContact CB-CZ 4.11Å; H56-F195 AromaticContact CD2-CZ 3.65Å; H56-F195 AromaticContact CG-CE1 3.97Å; H56-F195 AromaticContact CG-CZ 3.93Å; D60-F195 HydrophobicContact CB-CE2 4.12Å; D60-F195 HydrophobicContact CB-CZ 4.15Å; D60-F195 WeakPolarHBondContact O-CE2 3.37Å; A61-F195 HydrophobicContact CB-CB 4.35Å; A61-F195 HydrophobicContact CB-CD2 3.92Å; A61-F195 HydrophobicContact CB-CE2 4.42Å; A61-F195 HydrophobicContact CB-CG 4.12Å; L158-F195 HydrophobicContact CD1-CD1 3.6Å; L158-F195 HydrophobicContact CD1-CE1 3.5Å; L158-F195 HydrophobicContact CD1-CG 4.32Å; L158-F195 HydrophobicContact CD1-CZ 4.16Å; R191-F195 WeakPolarHBondContact O-CB 3.46Å; R191-F195 PolarHBondContact O-N 2.91Å; I192-F195 WeakPolarHBondContact O-CB 3.4Å; I192-F195 PolarHBondContact O-N 3.07Å; L193-F195 VanDerWaalsContact C-N 3.32Å; L193-F195 PolarHBondContact O-N 3.48Å; F195-H197 VanDerWaalsContact C-N 3.31Å; F195-H197 PolarHBondContact O-N 3.26Å; F195-I198 PolarHBondContact O-N 3.19Å; F195-F199 HydrophobicContact CD1-CD2 4.08Å; F195-F199 AromaticContact CD2-CD2 3.64Å; F195-F199 HydrophobicContact CD2-CD2 3.64Å; F195-F199 AromaticContact CD2-CE2 3.42Å; F195-F199 HydrophobicContact CD2-CE2 3.42Å; F195-F199 VanDerWaalsContact CD2-CE2 3.42Å; F195-F199 AromaticContact CE1-CD2 3.94Å; F195-F199 HydrophobicContact CE1-CD2 3.94Å; F195-F199 HydrophobicContact CE1-CE2 4.49Å; F195-F199 AromaticContact CE2-CD2 3.5Å; F195-F199 HydrophobicContact CE2-CD2 3.5Å; F195-F199 AromaticContact CE2-CE2 3.2Å; F195-F199 HydrophobicContact CE2-CE2 3.2Å; F195-F199 HydrophobicContact CE2-CZ 4.26Å; F195-F199 AromaticContact CG-CD2 3.93Å; F195-F199 HydrophobicContact CG-CD2 3.93Å; F195-F199 HydrophobicContact CG-CE2 4.17Å; F195-F199 AromaticContact CZ-CD2 3.65Å; F195-F199 HydrophobicContact CZ-CD2 3.65Å; F195-F199 AromaticContact CZ-CE2 3.79Å; F195-F199 HydrophobicContact CZ-CE2 3.79Å; F195-F199 WeakPolarHBondContact O-CD2 3.34Å; F195-F199 PolarHBondContact O-N 2.99Å; F195-F199 VanDerWaalsContact O-N 3.09Å
196	L	89	Confident	88.1	Confident	7 Å²	7	35.8 Å²	35.8	4%	0.037	19%	0.191	C	C	.	.	H	α-helix	trans	-61.7	-38.4	177.2	-173.7	65.1	0	0	0	112.9	Y49 F52 M53 I192 L193 K194 G200 I203 L342	Y49-L196 HydrophobicContact CD1-CD1 3.39Å; Y49-L196 HydrophobicContact CD1-CD2 3.86Å; Y49-L196 HydrophobicContact CD1-CG 4.08Å; Y49-L196 HydrophobicContact CE1-CD1 3.72Å; Y49-L196 HydrophobicContact CE1-CD2 4.02Å; Y49-L196 HydrophobicContact CE1-CG 4.09Å; F52-L196 HydrophobicContact CD1-CD1 3.82Å; F52-L196 HydrophobicContact CE1-CD1 4.02Å; M53-L196 HydrophobicContact CE-CB 3.68Å; M53-L196 HydrophobicContact CE-CD1 3.75Å; M53-L196 HydrophobicContact CE-CD2 3.97Å; M53-L196 HydrophobicContact CE-CG 3.99Å; I192-L196 PolarHBondContact O-N 2.76Å; L193-L196 HydrophobicContact CD1-CD2 4.29Å; L193-L196 WeakPolarHBondContact O-CB 3.4Å; L193-L196 PolarHBondContact O-N 3.32Å; L193-L196 VanDerWaalsContact O-N 3.15Å; K194-L196 PolarHBondContact O-N 3.41Å; L196-G200 WeakPolarHBondContact O-CA 3.49Å; L196-G200 PolarHBondContact O-N 3Å; L196-I203 HydrophobicContact CD1-CD1 3.75Å; L196-L342 HydrophobicContact CD2-CD1 3.89Å
197	H	86	Confident	87.5	Confident	62 Å²	62	44.2 Å²	44.2	29%	0.287	22%	0.221	S	C	.	.	H	α-helix	trans	-69.9	-46.5	-180	-176.1	69	0	0	0	111.6	L193 K194 F195 F199 G200 D310 A313	L193-H197 WeakPolarHBondContact O-CB 3.48Å; L193-H197 PolarHBondContact O-N 3.47Å; K194-H197 PolarHBondContact O-N 3.28Å; F195-H197 VanDerWaalsContact C-N 3.31Å; F195-H197 PolarHBondContact O-N 3.26Å; H197-F199 PolarHBondContact O-N 3.09Å; H197-G200 PolarHBondContact O-N 3.41Å; H197-G200 VanDerWaalsContact O-N 3.15Å; H197-D310 IonicContact CE1-OD1 2.75Å; H197-D310 PolarHBondContact CE1-OD1 3.4Å; H197-D310 IonicContact ND1-OD1 2.71Å; H197-D310 PolarHBondContact ND1-OD1 2.81Å; H197-A313 HydrophobicContact CB-CB 3.86Å
198	I	86.9	Confident	86.9	Confident	30 Å²	30	46.5 Å²	46.5	15%	0.154	23%	0.231	C	C	.	.	H	α-helix	trans	-58.2	-48.8	177.6	-69.8	166.6	0	0	0	110.7	V20 K194 F195 G200	V20-I198 HydrophobicContact CG2-CG2 3.78Å; K194-I198 HydrophobicContact CG-CD1 3.77Å; K194-I198 HydrophobicContact CG-CG1 4.34Å; K194-I198 WeakPolarHBondContact O-CB 3.32Å; K194-I198 VanDerWaalsContact O-CG1 3.24Å; K194-I198 WeakPolarHBondContact O-CG1 3.42Å; K194-I198 PolarHBondContact O-N 2.88Å; F195-I198 PolarHBondContact O-N 3.19Å; I198-G200 VanDerWaalsContact C-N 3.29Å; I198-G200 PolarHBondContact O-N 3.48Å
199	F	85.8	Confident	86.5	Confident	8 Å²	8	45.7 Å²	45.7	4%	0.035	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-86.6	-0.6	-179.2	-63.9	-61	0	0	0	113.3	V23 F52 F195 H197 S201 M202	V23-F199 HydrophobicContact CB-CE1 3.98Å; V23-F199 HydrophobicContact CB-CZ 4.06Å; V23-F199 HydrophobicContact CG1-CE1 4.04Å; V23-F199 HydrophobicContact CG1-CZ 4.25Å; V23-F199 HydrophobicContact CG2-CE1 4.15Å; V23-F199 HydrophobicContact CG2-CZ 3.7Å; F52-F199 HydrophobicContact CE1-CB 4.48Å; F52-F199 HydrophobicContact CE2-CB 4.35Å; F52-F199 HydrophobicContact CZ-CB 3.64Å; F52-F199 HydrophobicContact CZ-CG 4.43Å; F195-F199 HydrophobicContact CD1-CD2 4.08Å; F195-F199 AromaticContact CD2-CD2 3.64Å; F195-F199 HydrophobicContact CD2-CD2 3.64Å; F195-F199 AromaticContact CD2-CE2 3.42Å; F195-F199 HydrophobicContact CD2-CE2 3.42Å; F195-F199 VanDerWaalsContact CD2-CE2 3.42Å; F195-F199 AromaticContact CE1-CD2 3.94Å; F195-F199 HydrophobicContact CE1-CD2 3.94Å; F195-F199 HydrophobicContact CE1-CE2 4.49Å; F195-F199 AromaticContact CE2-CD2 3.5Å; F195-F199 HydrophobicContact CE2-CD2 3.5Å; F195-F199 AromaticContact CE2-CE2 3.2Å; F195-F199 HydrophobicContact CE2-CE2 3.2Å; F195-F199 HydrophobicContact CE2-CZ 4.26Å; F195-F199 AromaticContact CG-CD2 3.93Å; F195-F199 HydrophobicContact CG-CD2 3.93Å; F195-F199 HydrophobicContact CG-CE2 4.17Å; F195-F199 AromaticContact CZ-CD2 3.65Å; F195-F199 HydrophobicContact CZ-CD2 3.65Å; F195-F199 AromaticContact CZ-CE2 3.79Å; F195-F199 HydrophobicContact CZ-CE2 3.79Å; F195-F199 WeakPolarHBondContact O-CD2 3.34Å; F195-F199 PolarHBondContact O-N 2.99Å; F195-F199 VanDerWaalsContact O-N 3.09Å; H197-F199 PolarHBondContact O-N 3.09Å; F199-S201 PolarHBondContact O-N 2.96Å; F199-M202 HydrophobicContact CB-CE 3.73Å; F199-M202 HydrophobicContact CD1-CE 3.27Å; F199-M202 HydrophobicContact CD1-SD 4.41Å; F199-M202 HydrophobicContact CE1-CE 4.21Å; F199-M202 HydrophobicContact CG-CE 3.86Å; F199-M202 WeakPolarHBondContact O-CB 3.46Å; F199-M202 PolarHBondContact O-N 3.11Å
200	G	78.8	Confident	86.3	Confident	16 Å²	16	50.2 Å²	50.2	17%	0.165	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-64	-27.4	-176.2	0	0	0	0	0	113.4	L196 H197 I198 M202 I203	L196-G200 WeakPolarHBondContact O-CA 3.49Å; L196-G200 PolarHBondContact O-N 3Å; H197-G200 PolarHBondContact O-N 3.41Å; H197-G200 VanDerWaalsContact O-N 3.15Å; I198-G200 VanDerWaalsContact C-N 3.29Å; I198-G200 PolarHBondContact O-N 3.48Å; G200-M202 PolarHBondContact O-N 2.91Å; G200-I203 PolarHBondContact O-N 3.34Å; G200-I203 VanDerWaalsContact O-N 3.09Å; G200-I203 VanDerWaalsContact O-O 3.14Å
201	S	76.4	Confident	86.3	Confident	108 Å²	108	53.1 Å²	53.1	76%	0.755	26%	0.26	S	S	*	.	G	3₁₀ helix	trans	-63.6	-22.6	173.2	59.7	0	0	0	0	113.6	F199 I203	F199-S201 PolarHBondContact O-N 2.96Å; S201-I203 VanDerWaalsContact C-N 3.35Å
202	M	79.6	Confident	86.2	Confident	98 Å²	98	54.7 Å²	54.7	48%	0.483	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-89.4	-5.1	177.2	-53.9	-172.3	-53.2	0	0	112.6	F199 G200	F199-M202 HydrophobicContact CB-CE 3.73Å; F199-M202 HydrophobicContact CD1-CE 3.27Å; F199-M202 HydrophobicContact CD1-SD 4.41Å; F199-M202 HydrophobicContact CE1-CE 4.21Å; F199-M202 HydrophobicContact CG-CE 3.86Å; F199-M202 WeakPolarHBondContact O-CB 3.46Å; F199-M202 PolarHBondContact O-N 3.11Å; G200-M202 PolarHBondContact O-N 2.91Å
203	I	82.9	Confident	86.1	Confident	13 Å²	13	54.7 Å²	54.7	7%	0.067	27%	0.269	C	S	.	.	S	Bend	trans	-105.7	128.8	-176.4	-56.1	174.6	0	0	0	108	I48 Y49 F52 L196 G200 S201 K205	I48-I203 HydrophobicContact CG2-CG2 3.15Å; Y49-I203 HydrophobicContact CD1-CD1 4.28Å; Y49-I203 HydrophobicContact CD1-CG2 4.48Å; Y49-I203 HydrophobicContact CE1-CD1 4.2Å; Y49-I203 HydrophobicContact CE1-CG2 4.22Å; F52-I203 HydrophobicContact CB-CD1 4.18Å; F52-I203 HydrophobicContact CD1-CD1 3.68Å; F52-I203 HydrophobicContact CD2-CD1 3.45Å; F52-I203 VanDerWaalsContact CD2-CD1 3.45Å; F52-I203 HydrophobicContact CD2-CG1 3.65Å; F52-I203 HydrophobicContact CE1-CD1 3.87Å; F52-I203 HydrophobicContact CE2-CD1 3.64Å; F52-I203 HydrophobicContact CE2-CG1 3.82Å; F52-I203 HydrophobicContact CG-CD1 3.47Å; F52-I203 VanDerWaalsContact CG-CD1 3.47Å; F52-I203 HydrophobicContact CG-CG1 4.15Å; F52-I203 HydrophobicContact CZ-CD1 3.87Å; F52-I203 HydrophobicContact CZ-CG1 4.46Å; L196-I203 HydrophobicContact CD1-CD1 3.75Å; G200-I203 PolarHBondContact O-N 3.34Å; G200-I203 VanDerWaalsContact O-N 3.09Å; G200-I203 VanDerWaalsContact O-O 3.14Å; S201-I203 VanDerWaalsContact C-N 3.35Å; I203-K205 PolarHBondContact O-N 3.45Å
204	P	83.8	Confident	85.9	Confident	93 Å²	93	59.1 Å²	59.1	60%	0.604	29%	0.292	S	S	*	.			trans	-56.5	125.7	171.3	-22	32.4	0	0	0	110	I48 P206	I48-P204 HydrophobicContact CD1-CB 4.31Å; P204-P206 WeakPolarHBondContact O-CD 3.14Å
205	K	82.4	Confident	85.7	Confident	131 Å²	131	63.1 Å²	63.1	57%	0.57	31%	0.311	S	S	*	.			trans	-70.8	114.6	-175.9	-70.4	-173.1	175.6	-171.3	0	110.3	I203 L209 E306	I203-K205 PolarHBondContact O-N 3.45Å; K205-L209 HydrophobicContact CB-CD1 4.29Å; K205-E306 VanDerWaalsContact CD-OE1 3.31Å; K205-E306 WeakPolarHBondContact CD-OE1 3.17Å; K205-E306 VanDerWaalsContact CE-OE1 3.3Å; K205-E306 WeakPolarHBondContact CE-OE1 3.44Å; K205-E306 IonicContact NZ-OE1 3.67Å; K205-E306 PolarHBondContact NZ-OE1 3.05Å
206	P	84.8	Confident	85.4	Confident	2 Å²	2	63.8 Å²	63.8	1%	0.013	32%	0.316	C	S	.	.			trans	-64.8	144.3	178.9	-24.6	37.7	0	0	0	112	D45 I48 Y49 P204 F208 L209	D45-P206 HydrophobicContact CB-CB 4.02Å; I48-P206 HydrophobicContact CB-CG 4.22Å; I48-P206 HydrophobicContact CD1-CG 4.21Å; I48-P206 HydrophobicContact CG2-CG 4.44Å; Y49-P206 HydrophobicContact CD2-CG 4.06Å; Y49-P206 HydrophobicContact CE2-CG 3.56Å; P204-P206 WeakPolarHBondContact O-CD 3.14Å; P206-F208 HydrophobicContact CB-CD1 3.43Å; P206-F208 VanDerWaalsContact CB-CD1 3.43Å; P206-F208 HydrophobicContact CB-CE1 3.13Å; P206-F208 HydrophobicContact CB-CE2 4.46Å; P206-F208 HydrophobicContact CB-CG 4.24Å; P206-F208 HydrophobicContact CB-CZ 3.71Å; P206-F208 HydrophobicContact CG-CD1 4.45Å; P206-F208 HydrophobicContact CG-CE1 3.7Å; P206-F208 HydrophobicContact CG-CZ 3.93Å; P206-F208 PolarHBondContact O-N 3.26Å; P206-F208 VanDerWaalsContact O-N 3.17Å; P206-L209 WeakPolarHBondContact O-CB 3.38Å; P206-L209 WeakPolarHBondContact O-CG 3.49Å; P206-L209 PolarHBondContact O-N 3.41Å; P206-L209 VanDerWaalsContact O-N 3.14Å
207	R	84.6	Confident	85.3	Confident	201 Å²	201	69.6 Å²	69.6	76%	0.758	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-60.7	-29.2	-178.9	-66.1	179	74.1	156.6	4.8	113.6	D45 L209 Q210	D45-R207 WeakPolarHBondContact OD2-CG 3.45Å; D45-R207 PolarHBondContact OD2-N 3.47Å; R207-L209 PolarHBondContact O-N 3.18Å; R207-Q210 WeakPolarHBondContact O-CB 3.44Å; R207-Q210 PolarHBondContact O-N 3.49Å; R207-Q210 VanDerWaalsContact O-N 3.12Å
208	F	84.4	Confident	85.5	Confident	49 Å²	49	67.4 Å²	67.4	22%	0.215	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-65.5	-18	-179.4	69.5	-104.9	0	0	0	113.4	Y49 P206 Q210 K211 L305 L342	Y49-F208 AromaticContact CD2-CZ 3.81Å; Y49-F208 HydrophobicContact CD2-CZ 3.81Å; Y49-F208 HydrophobicContact CE2-CE2 4.38Å; Y49-F208 AromaticContact CE2-CZ 3.82Å; Y49-F208 HydrophobicContact CE2-CZ 3.82Å; P206-F208 HydrophobicContact CB-CD1 3.43Å; P206-F208 VanDerWaalsContact CB-CD1 3.43Å; P206-F208 HydrophobicContact CB-CE1 3.13Å; P206-F208 HydrophobicContact CB-CE2 4.46Å; P206-F208 HydrophobicContact CB-CG 4.24Å; P206-F208 HydrophobicContact CB-CZ 3.71Å; P206-F208 HydrophobicContact CG-CD1 4.45Å; P206-F208 HydrophobicContact CG-CE1 3.7Å; P206-F208 HydrophobicContact CG-CZ 3.93Å; P206-F208 PolarHBondContact O-N 3.26Å; P206-F208 VanDerWaalsContact O-N 3.17Å; F208-Q210 PolarHBondContact O-N 2.94Å; F208-K211 HydrophobicContact CB-CD 4.45Å; F208-K211 WeakPolarHBondContact O-CB 3.19Å; F208-K211 PolarHBondContact O-N 3.45Å; F208-K211 VanDerWaalsContact O-N 3.16Å; F208-L305 HydrophobicContact CD2-CD2 4.21Å; F208-L305 HydrophobicContact CE2-CD2 4.29Å; F208-L342 HydrophobicContact CE2-CD2 3.53Å; F208-L342 HydrophobicContact CZ-CD2 3.94Å
209	L	87.1	Confident	85.6	Confident	4 Å²	4	66.8 Å²	66.8	2%	0.021	35%	0.346	C	S	.	.	G	3₁₀ helix	trans	-64.2	-24.3	174.1	-67	-179	0	0	0	113	Y49 K205 P206 R207 K211 L305 E306 I309 L342	Y49-L209 HydrophobicContact CE2-CD2 4.17Å; Y49-L209 WeakPolarHBondContact OH-CD1 3.26Å; K205-L209 HydrophobicContact CB-CD1 4.29Å; P206-L209 WeakPolarHBondContact O-CB 3.38Å; P206-L209 WeakPolarHBondContact O-CG 3.49Å; P206-L209 PolarHBondContact O-N 3.41Å; P206-L209 VanDerWaalsContact O-N 3.14Å; R207-L209 PolarHBondContact O-N 3.18Å; L209-K211 VanDerWaalsContact C-N 3.29Å; L209-L305 HydrophobicContact CD2-CD2 4.13Å; L209-L305 HydrophobicContact CD2-CG 4.37Å; L209-L305 PolarHBondContact O-N 3.21Å; L209-E306 HydrophobicContact CB-CB 4.18Å; L209-E306 PolarHBondContact O-N 3.01Å; L209-I309 HydrophobicContact CD2-CD1 4.03Å; L209-L342 HydrophobicContact CD2-CD2 4.3Å
210	Q	90.1	Very high	86	Confident	105 Å²	105	69.9 Å²	69.9	49%	0.491	37%	0.365	S	S	.	.	G	3₁₀ helix	trans	-82.1	-7.6	178.2	-59.3	-55.7	-43.5	0	0	112.9	R207 F208 T304 E306	R207-Q210 WeakPolarHBondContact O-CB 3.44Å; R207-Q210 PolarHBondContact O-N 3.49Å; R207-Q210 VanDerWaalsContact O-N 3.12Å; F208-Q210 PolarHBondContact O-N 2.94Å; Q210-T304 WeakPolarHBondContact O-CG2 3.33Å; Q210-E306 PolarHBondContact NE2-OE2 3.07Å
211	K	90.1	Very high	86.6	Confident	108 Å²	108	72.7 Å²	72.7	47%	0.47	37%	0.373	S	S	.	.	S	Bend	trans	-67.9	147.1	174.6	-66.9	-174.6	175.9	-174	0	110.5	F208 L209 V216 T304 L305	F208-K211 HydrophobicContact CB-CD 4.45Å; F208-K211 WeakPolarHBondContact O-CB 3.19Å; F208-K211 PolarHBondContact O-N 3.45Å; F208-K211 VanDerWaalsContact O-N 3.16Å; L209-K211 VanDerWaalsContact C-N 3.29Å; K211-V216 HydrophobicContact CB-CG1 3.73Å; K211-V216 HydrophobicContact CD-CG1 3.86Å; K211-V216 HydrophobicContact CG-CG1 4.46Å; K211-T304 WeakPolarHBondContact O-CA 3.42Å; K211-L305 PolarHBondContact O-N 2.7Å; K211-L305 VanDerWaalsContact O-N 3.09Å
212	Q	92.5	Very high	87.2	Confident	68 Å²	68	77.9 Å²	77.9	32%	0.318	38%	0.376	S	S	.	.	B	Isolated β-bridge	trans	-74.7	151.1	176.5	-63.3	-176.8	11.5	0	0	110.6	N214 E215 V216 E303	Q212-N214 WeakPolarHBondContact CB-OD1 3.15Å; Q212-N214 PolarHBondContact O-N 3.04Å; Q212-N214 PolarHBondContact OE1-OD1 3.15Å; Q212-E215 HydrophobicContact CB-CG 4.21Å; Q212-E215 PolarHBondContact N-OE2 3.49Å; Q212-E215 VanDerWaalsContact N-OE2 3.09Å; Q212-E215 WeakPolarHBondContact O-CB 3.36Å; Q212-E215 PolarHBondContact O-N 3.2Å; Q212-V216 PolarHBondContact O-N 3.47Å; Q212-E303 WeakPolarHBondContact CA-O 3.42Å
213	I	89.9	Confident	87.7	Confident	0 Å²	0	81.7 Å²	81.7	0%	0	39%	0.393	C	S	.	.	G	3₁₀ helix	trans	-62.7	-28.6	-177.3	-167.3	61.3	0	0	0	113.2	E215 V216 I218 F221 Y300 P301 E303 I308 L322 V333	I213-E215 VanDerWaalsContact C-N 3.31Å; I213-V216 HydrophobicContact CD1-CG2 4.01Å; I213-V216 VanDerWaalsContact O-O 3.05Å; I213-I218 HydrophobicContact CD1-CB 4.25Å; I213-I218 WeakPolarHBondContact CD1-O 3.47Å; I213-F221 HydrophobicContact CG1-CZ 4.35Å; I213-Y300 WeakPolarHBondContact CG2-O 3.32Å; I213-P301 WeakPolarHBondContact CG2-O 3.48Å; I213-E303 PolarHBondContact N-O 3.48Å; I213-I308 HydrophobicContact CB-CD1 3.56Å; I213-I308 HydrophobicContact CD1-CD1 3.85Å; I213-I308 HydrophobicContact CG1-CD1 3.64Å; I213-I308 HydrophobicContact CG2-CD1 4.03Å; I213-L322 HydrophobicContact CG2-CD1 3.92Å; I213-V333 HydrophobicContact CD1-CG1 4.49Å; I213-V333 HydrophobicContact CD1-CG2 4.05Å; I213-V333 HydrophobicContact CG1-CG2 4.04Å
214	N	87.3	Confident	88.2	Confident	95 Å²	95	82.8 Å²	82.8	51%	0.508	40%	0.398	S	S	.	.	G	3₁₀ helix	trans	-72.8	-20.6	174.9	62	-6.7	0	0	0	113.8	Q212 P301	Q212-N214 WeakPolarHBondContact CB-OD1 3.15Å; Q212-N214 PolarHBondContact O-N 3.04Å; Q212-N214 PolarHBondContact OE1-OD1 3.15Å; N214-P301 HydrophobicContact CB-CB 4.18Å; N214-P301 PolarHBondContact N-O 3.24Å; N214-P301 PolarHBondContact ND2-O 3.3Å; N214-P301 PolarHBondContact OD1-O 2.82Å
215	E	86.1	Confident	88.8	Confident	123 Å²	123	79.4 Å²	79.4	58%	0.575	38%	0.378	S	S	*	.	G	3₁₀ helix	trans	-88.9	-12.7	179.9	-67.6	169.3	163.8	0	0	112.3	Q212 I213	Q212-E215 HydrophobicContact CB-CG 4.21Å; Q212-E215 PolarHBondContact N-OE2 3.49Å; Q212-E215 VanDerWaalsContact N-OE2 3.09Å; Q212-E215 WeakPolarHBondContact O-CB 3.36Å; Q212-E215 PolarHBondContact O-N 3.2Å; I213-E215 VanDerWaalsContact C-N 3.31Å
216	V	85.7	Confident	89.4	Confident	18 Å²	18	75.8 Å²	75.8	11%	0.109	37%	0.367	C	S	.	.	S	Bend	trans	-116.6	139.5	-177	-61.3	0	0	0	0	111	K211 Q212 I213 I218	K211-V216 HydrophobicContact CB-CG1 3.73Å; K211-V216 HydrophobicContact CD-CG1 3.86Å; K211-V216 HydrophobicContact CG-CG1 4.46Å; Q212-V216 PolarHBondContact O-N 3.47Å; I213-V216 HydrophobicContact CD1-CG2 4.01Å; I213-V216 VanDerWaalsContact O-O 3.05Å; V216-I218 HydrophobicContact CB-CD1 4.07Å; V216-I218 HydrophobicContact CB-CG1 4Å; V216-I218 HydrophobicContact CG2-CB 4.03Å; V216-I218 HydrophobicContact CG2-CD1 3.81Å; V216-I218 HydrophobicContact CG2-CG1 3.83Å; V216-I218 PolarHBondContact O-N 3.26Å
217	P	85.9	Confident	90	Very high	130 Å²	130	76 Å²	76	84%	0.844	37%	0.368	S	S	*	.			trans	-79.9	53.9	177.7	34.7	-36.5	0	0	0	111
218	I	89.7	Confident	90.6	Very high	15 Å²	15	69.9 Å²	69.9	8%	0.077	35%	0.348	C	S	.	.			trans	-114.3	105.7	-177.8	-54.9	178.4	0	0	0	109.3	I213 V216 F221 L305 D337 I338 A341	I213-I218 HydrophobicContact CD1-CB 4.25Å; I213-I218 WeakPolarHBondContact CD1-O 3.47Å; V216-I218 HydrophobicContact CB-CD1 4.07Å; V216-I218 HydrophobicContact CB-CG1 4Å; V216-I218 HydrophobicContact CG2-CB 4.03Å; V216-I218 HydrophobicContact CG2-CD1 3.81Å; V216-I218 HydrophobicContact CG2-CG1 3.83Å; V216-I218 PolarHBondContact O-N 3.26Å; I218-F221 WeakPolarHBondContact O-CZ 3.21Å; I218-L305 HydrophobicContact CD1-CD1 4.02Å; I218-L305 HydrophobicContact CD1-CD2 3.65Å; I218-L305 HydrophobicContact CD1-CG 4.48Å; I218-D337 HydrophobicContact CG2-CB 4.16Å; I218-I338 HydrophobicContact CG2-CG1 4.33Å; I218-A341 HydrophobicContact CD1-CB 3.52Å; I218-A341 HydrophobicContact CG1-CB 3.62Å; I218-A341 HydrophobicContact CG2-CB 4.26Å
219	G	90.9	Very high	91.1	Very high	18 Å²	18	70.1 Å²	70.1	19%	0.186	35%	0.35	C	S	.	.	S	Bend	trans	119.1	176.2	-176.3	0	0	0	0	0	111.9	I332	G219-I332 WeakPolarHBondContact CA-O 3.46Å
220	T	93.1	Very high	91.5	Very high	73 Å²	73	74 Å²	74	45%	0.448	38%	0.377	S	S	.	.	B	Isolated β-bridge	trans	-105.5	123.4	174.5	-52.9	0	0	0	0	108.6	I224 G331 I332	T220-I224 HydrophobicContact CG2-CD1 3.76Å; T220-I224 WeakPolarHBondContact O-CD1 3.44Å; T220-G331 CarbonylContact O-C 3.59Å; T220-G331 WeakPolarHBondContact O-CA 3.1Å; T220-I332 PolarHBondContact N-O 3.15Å; T220-I332 PolarHBondContact O-N 3.42Å
221	F	91.2	Very high	91.9	Very high	75 Å²	75	69.6 Å²	69.6	33%	0.329	36%	0.359	S	S	.	.			trans	-121.6	2.5	-175.8	-53.2	-60.2	0	0	0	113.9	I213 I218 L322	I213-F221 HydrophobicContact CG1-CZ 4.35Å; I218-F221 WeakPolarHBondContact O-CZ 3.21Å; F221-L322 HydrophobicContact CD1-CD2 3.68Å; F221-L322 HydrophobicContact CE1-CD2 3.5Å; F221-L322 VanDerWaalsContact CE1-CD2 3.5Å
222	R	89.4	Confident	92.1	Very high	217 Å²	217	65.4 Å²	65.4	82%	0.819	34%	0.343	S	S	*	.	S	Bend	trans	-131.6	148.3	-179.8	-62.1	-176.6	-177.3	179.6	0.8	109.2	I224	R222-I224 VanDerWaalsContact C-N 3.27Å; R222-I224 PolarHBondContact O-N 3.29Å
223	E	89.8	Confident	92.3	Very high	177 Å²	177	62.1 Å²	62.1	83%	0.827	33%	0.328	S	S	*	.	S	Bend	trans	50.9	46	177	-56.7	-174.5	137.4	0	0	113	A225	E223-A225 PolarHBondContact O-N 3.03Å
224	I	93.7	Very high	92.5	Very high	36 Å²	36	65.8 Å²	65.8	19%	0.185	34%	0.342	C	S	.	.			trans	-69	120.2	-179.2	-48.1	-56.3	0	0	0	109	T220 R222 T226 V329 I332	T220-I224 HydrophobicContact CG2-CD1 3.76Å; T220-I224 WeakPolarHBondContact O-CD1 3.44Å; R222-I224 VanDerWaalsContact C-N 3.27Å; R222-I224 PolarHBondContact O-N 3.29Å; I224-T226 HydrophobicContact CG2-CG2 4.21Å; I224-T226 PolarHBondContact O-N 3.29Å; I224-V329 HydrophobicContact CG2-CG1 4.02Å; I224-I332 HydrophobicContact CG2-CD1 3.84Å; I224-I332 HydrophobicContact CG2-CG1 4.01Å
225	A	95.3	Very high	92.9	Very high	22 Å²	22	65.9 Å²	65.9	18%	0.182	34%	0.34	C	S	.	.			trans	-69.6	110.9	172.6	0	0	0	0	0	109.6	E223 I239 R243 V245 L248 P249	E223-A225 PolarHBondContact O-N 3.03Å; A225-I239 HydrophobicContact CB-CG2 3.87Å; A225-R243 HydrophobicContact CB-CG 4.36Å; A225-V245 HydrophobicContact CB-CG2 4.44Å; A225-L248 HydrophobicContact CB-CD2 3.77Å; A225-L248 WeakPolarHBondContact O-CD2 3.32Å; A225-P249 WeakPolarHBondContact O-CD 3.48Å
226	T	96.1	Very high	93.4	Very high	55 Å²	55	60 Å²	60	34%	0.337	31%	0.313	S	S	.	.			trans	-117.7	162.4	174.9	58.2	0	0	0	0	110.3	I224 P249 V251 V329	I224-T226 HydrophobicContact CG2-CG2 4.21Å; I224-T226 PolarHBondContact O-N 3.29Å; T226-P249 WeakPolarHBondContact CA-O 3.46Å; T226-P249 HydrophobicContact CG2-CB 4.24Å; T226-P249 HydrophobicContact CG2-CG 4.4Å; T226-V251 HydrophobicContact CG2-CG1 4.31Å; T226-V329 HydrophobicContact CG2-CB 4.45Å; T226-V329 HydrophobicContact CG2-CG1 4.3Å
227	I	96.9	Very high	93.9	Very high	7 Å²	7	59.2 Å²	59.2	4%	0.036	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	142.1	175.6	-171.1	164.3	0	0	0	110.9	A231 E235 A236 I239 L248 P249 V250 V251 M282	I227-A231 HydrophobicContact CD1-CB 3.93Å; I227-A231 HydrophobicContact CG1-CB 3.61Å; I227-E235 HydrophobicContact CD1-CB 4.38Å; I227-A236 HydrophobicContact CD1-CB 3.42Å; I227-A236 VanDerWaalsContact CD1-CB 3.42Å; I227-I239 HydrophobicContact CB-CD1 4.49Å; I227-I239 HydrophobicContact CD1-CD1 4.47Å; I227-L248 HydrophobicContact CG2-CB 4.01Å; I227-L248 HydrophobicContact CG2-CD1 4.44Å; I227-P249 PolarHBondContact N-O 3.26Å; I227-V250 HydrophobicContact CG2-CB 4.35Å; I227-V250 HydrophobicContact CG2-CG1 4.49Å; I227-V250 HydrophobicContact CG2-CG2 3.86Å; I227-V250 CarbonylContact O-C 3.56Å; I227-V250 VanDerWaalsContact O-CA 3.28Å; I227-V250 WeakPolarHBondContact O-CA 3.47Å; I227-V251 PolarHBondContact O-N 3.5Å; I227-M282 HydrophobicContact CD1-CG 3.85Å; I227-M282 HydrophobicContact CD1-SD 3.93Å; I227-M282 HydrophobicContact CG1-CG 4.07Å; I227-M282 HydrophobicContact CG2-CG 4.24Å
228	Q	97.3	Very high	94.4	Very high	73 Å²	73	54.3 Å²	54.3	34%	0.341	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	147.2	177	-69.9	-66.3	-21.3	0	0	111.1	S230 A231 V251 N252	Q228-S230 PolarHBondContact O-N 2.85Å; Q228-A231 HydrophobicContact CB-CB 4.27Å; Q228-A231 WeakPolarHBondContact O-CB 3.43Å; Q228-A231 PolarHBondContact O-N 2.82Å; Q228-A231 VanDerWaalsContact O-N 3.08Å; Q228-V251 CarbonylContact C-O 3.59Å; Q228-V251 WeakPolarHBondContact CA-O 3.35Å; Q228-V251 PolarHBondContact OE1-O 3.26Å; Q228-N252 PolarHBondContact OE1-O 3.49Å
229	E	95.4	Very high	94.7	Very high	54 Å²	54	55.3 Å²	55.3	25%	0.252	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-23.6	177.9	64.6	172.6	-155.1	0	0	113.8	V250 V251 V258 M282 K283	E229-V250 HydrophobicContact CB-CG1 3.96Å; E229-V251 PolarHBondContact N-O 2.86Å; E229-V258 HydrophobicContact CB-CG2 4.39Å; E229-M282 PolarHBondContact O-N 3.31Å; E229-K283 PolarHBondContact O-N 3.24Å
230	S	95.8	Very high	94.9	Very high	84 Å²	84	54.7 Å²	54.7	59%	0.587	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-13.9	175.6	55.9	0	0	0	0	113.9	Q228	Q228-S230 PolarHBondContact O-N 2.85Å
231	A	97.1	Very high	94.9	Very high	14 Å²	14	53.4 Å²	53.4	12%	0.116	27%	0.267	C	S	.	.	S	Bend	trans	-69.9	159	178.4	0	0	0	0	0	111	I227 Q228 T281 M282	I227-A231 HydrophobicContact CD1-CB 3.93Å; I227-A231 HydrophobicContact CG1-CB 3.61Å; Q228-A231 HydrophobicContact CB-CB 4.27Å; Q228-A231 WeakPolarHBondContact O-CB 3.43Å; Q228-A231 PolarHBondContact O-N 2.82Å; Q228-A231 VanDerWaalsContact O-N 3.08Å; A231-T281 CarbonylContact O-C 3.53Å; A231-T281 VanDerWaalsContact O-CA 3.29Å; A231-T281 WeakPolarHBondContact O-CA 3.38Å; A231-M282 WeakPolarHBondContact O-CG 3.47Å; A231-M282 PolarHBondContact O-N 2.81Å
232	S	95.8	Very high	95	Very high	19 Å²	19	56.3 Å²	56.3	13%	0.133	28%	0.282	C	S	.	.	B	Isolated β-bridge	trans	-79.4	156.1	-179.9	64.3	0	0	0	0	112.8	Y234 E235 A236 M280	S232-Y234 PolarHBondContact O-N 3.34Å; S232-E235 WeakPolarHBondContact CB-OE2 3.48Å; S232-E235 PolarHBondContact N-OE2 3.24Å; S232-E235 PolarHBondContact O-N 2.74Å; S232-E235 VanDerWaalsContact OG-CG 3.32Å; S232-E235 WeakPolarHBondContact OG-CG 3.44Å; S232-E235 PolarHBondContact OG-N 3.14Å; S232-E235 PolarHBondContact OG-OE2 3.13Å; S232-A236 PolarHBondContact O-N 3.04Å; S232-M280 CarbonylContact C-O 3.6Å; S232-M280 WeakPolarHBondContact CA-O 3.26Å
233	V	95.2	Very high	95.1	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-58.1	-37.7	169.8	171	0	0	0	0	111.1	E235 A236 L237 L269 L278 M280 M282 A285	V233-E235 PolarHBondContact O-N 2.71Å; V233-A236 WeakPolarHBondContact O-CA 3.17Å; V233-A236 WeakPolarHBondContact O-CB 3.36Å; V233-A236 PolarHBondContact O-N 3.49Å; V233-L237 HydrophobicContact CG1-CG 4.42Å; V233-L237 WeakPolarHBondContact O-CG 3.4Å; V233-L237 PolarHBondContact O-N 3.32Å; V233-L269 HydrophobicContact CG1-CD1 3.94Å; V233-L278 HydrophobicContact CG1-CD2 4.3Å; V233-L278 PolarHBondContact N-O 3.38Å; V233-M280 HydrophobicContact CB-CG 4.37Å; V233-M280 HydrophobicContact CG2-CG 3.59Å; V233-M280 HydrophobicContact CG2-SD 4.27Å; V233-M280 PolarHBondContact N-O 2.68Å; V233-M282 HydrophobicContact CG2-SD 4.16Å; V233-A285 HydrophobicContact CG2-CB 3.53Å
234	Y	94.9	Very high	95.2	Very high	76 Å²	76	53.9 Å²	53.9	30%	0.298	27%	0.265	S	S	.	.	H	α-helix	trans	-59	-42.8	177.7	-178.8	-103.5	0	0	0	112.6	H116 Y119 S232 A236 L237 A238 L278	H116-Y234 AromaticContact CD2-CE2 3.96Å; Y119-Y234 AromaticContact CD1-CD2 3.34Å; Y119-Y234 HydrophobicContact CD1-CD2 3.34Å; Y119-Y234 AromaticContact CD1-CE2 3.67Å; Y119-Y234 HydrophobicContact CD1-CE2 3.67Å; Y119-Y234 AromaticContact CD1-CG 3.93Å; Y119-Y234 HydrophobicContact CD1-CG 3.93Å; Y119-Y234 HydrophobicContact CE1-CD2 4.08Å; Y119-Y234 HydrophobicContact CE1-CG 4.24Å; Y119-Y234 HydrophobicContact CG-CD2 4.02Å; Y119-Y234 HydrophobicContact CG-CE2 4.23Å; S232-Y234 PolarHBondContact O-N 3.34Å; Y234-A236 VanDerWaalsContact C-N 3.29Å; Y234-A236 PolarHBondContact O-N 3.21Å; Y234-L237 WeakPolarHBondContact O-CB 3.48Å; Y234-L237 PolarHBondContact O-N 3.02Å; Y234-L237 VanDerWaalsContact O-N 3.12Å; Y234-A238 PolarHBondContact O-N 3.21Å; Y234-L278 HydrophobicContact CD2-CD1 4.45Å; Y234-L278 PolarHBondContact N-O 3.12Å
235	E	96.2	Very high	95.1	Very high	98 Å²	98	54.3 Å²	54.3	46%	0.458	27%	0.269	S	S	.	.	H	α-helix	trans	-61	-38.9	173.2	-73	166	107.7	0	0	111.6	I227 S232 V233 L237 A238 I239	I227-E235 HydrophobicContact CD1-CB 4.38Å; S232-E235 WeakPolarHBondContact CB-OE2 3.48Å; S232-E235 PolarHBondContact N-OE2 3.24Å; S232-E235 PolarHBondContact O-N 2.74Å; S232-E235 VanDerWaalsContact OG-CG 3.32Å; S232-E235 WeakPolarHBondContact OG-CG 3.44Å; S232-E235 PolarHBondContact OG-N 3.14Å; S232-E235 PolarHBondContact OG-OE2 3.13Å; V233-E235 PolarHBondContact O-N 2.71Å; E235-L237 VanDerWaalsContact C-N 3.32Å; E235-L237 PolarHBondContact O-N 3.5Å; E235-A238 WeakPolarHBondContact O-CB 3.02Å; E235-A238 PolarHBondContact O-N 2.95Å; E235-I239 WeakPolarHBondContact O-CG1 3.45Å; E235-I239 PolarHBondContact O-N 3.47Å
236	A	96.5	Very high	94.9	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-60.9	-41.5	173.7	0	0	0	0	0	112	I227 S232 V233 Y234 I239 F240 L248 Y261 M282	I227-A236 HydrophobicContact CD1-CB 3.42Å; I227-A236 VanDerWaalsContact CD1-CB 3.42Å; S232-A236 PolarHBondContact O-N 3.04Å; V233-A236 WeakPolarHBondContact O-CA 3.17Å; V233-A236 WeakPolarHBondContact O-CB 3.36Å; V233-A236 PolarHBondContact O-N 3.49Å; Y234-A236 VanDerWaalsContact C-N 3.29Å; Y234-A236 PolarHBondContact O-N 3.21Å; A236-I239 PolarHBondContact O-N 3.21Å; A236-F240 VanDerWaalsContact O-CD2 3.28Å; A236-F240 WeakPolarHBondContact O-CD2 3.36Å; A236-F240 WeakPolarHBondContact O-CG 3.27Å; A236-F240 PolarHBondContact O-N 3.43Å; A236-L248 HydrophobicContact CB-CD1 4.04Å; A236-Y261 HydrophobicContact CB-CD1 4.19Å; A236-Y261 HydrophobicContact CB-CE1 4.19Å; A236-M282 HydrophobicContact CB-CE 4.45Å; A236-M282 HydrophobicContact CB-SD 3.82Å
237	L	95.5	Very high	94.8	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-63.2	-42	175.4	-58.7	-172.6	0	0	0	111.5	I112 L115 H116 V233 Y234 E235 I239 F240 V241 V266 L278	I112-L237 HydrophobicContact CG1-CD2 4.16Å; I112-L237 HydrophobicContact CG2-CB 4.4Å; I112-L237 HydrophobicContact CG2-CD2 4.13Å; L115-L237 HydrophobicContact CB-CD1 3.78Å; L115-L237 HydrophobicContact CD1-CD1 4.19Å; H116-L237 HydrophobicContact CB-CB 4.35Å; V233-L237 HydrophobicContact CG1-CG 4.42Å; V233-L237 WeakPolarHBondContact O-CG 3.4Å; V233-L237 PolarHBondContact O-N 3.32Å; Y234-L237 WeakPolarHBondContact O-CB 3.48Å; Y234-L237 PolarHBondContact O-N 3.02Å; Y234-L237 VanDerWaalsContact O-N 3.12Å; E235-L237 VanDerWaalsContact C-N 3.32Å; E235-L237 PolarHBondContact O-N 3.5Å; L237-I239 VanDerWaalsContact C-N 3.34Å; L237-I239 PolarHBondContact O-N 2.96Å; L237-F240 HydrophobicContact CD2-CD2 4.29Å; L237-F240 WeakPolarHBondContact O-CB 3.44Å; L237-F240 PolarHBondContact O-N 2.88Å; L237-F240 VanDerWaalsContact O-N 3.15Å; L237-V241 WeakPolarHBondContact O-CG2 3.36Å; L237-V241 PolarHBondContact O-N 3.49Å; L237-V266 HydrophobicContact CD2-CB 4.41Å; L237-V266 HydrophobicContact CD2-CG1 3.73Å; L237-V266 HydrophobicContact CD2-CG2 3.72Å; L237-L278 HydrophobicContact CD1-CD1 3.79Å
238	A	95.9	Very high	94.8	Very high	27 Å²	27	51.5 Å²	51.5	22%	0.223	25%	0.251	C	S	.	.	H	α-helix	trans	-58.2	-47	176.7	0	0	0	0	0	111.3	H116 Y234 E235 F240 V241 E242	H116-A238 WeakPolarHBondContact NE2-CA 3.17Å; H116-A238 WeakPolarHBondContact NE2-CB 3.27Å; Y234-A238 PolarHBondContact O-N 3.21Å; E235-A238 WeakPolarHBondContact O-CB 3.02Å; E235-A238 PolarHBondContact O-N 2.95Å; A238-F240 VanDerWaalsContact C-N 3.33Å; A238-F240 PolarHBondContact O-N 3.31Å; A238-V241 PolarHBondContact O-N 3.29Å; A238-E242 WeakPolarHBondContact O-CB 3.46Å; A238-E242 PolarHBondContact O-N 3.43Å
239	I	96.5	Very high	94.7	Very high	37 Å²	37	48 Å²	48	19%	0.19	24%	0.235	C	C	.	.	H	α-helix	trans	-63.1	-39.3	176.4	-59.5	167.1	0	0	0	111.1	A225 I227 E235 A236 L237 V241 E242 R243 V245 L248	A225-I239 HydrophobicContact CB-CG2 3.87Å; I227-I239 HydrophobicContact CB-CD1 4.49Å; I227-I239 HydrophobicContact CD1-CD1 4.47Å; E235-I239 WeakPolarHBondContact O-CG1 3.45Å; E235-I239 PolarHBondContact O-N 3.47Å; A236-I239 PolarHBondContact O-N 3.21Å; L237-I239 VanDerWaalsContact C-N 3.34Å; L237-I239 PolarHBondContact O-N 2.96Å; I239-V241 VanDerWaalsContact C-N 3.3Å; I239-V241 PolarHBondContact O-N 3.03Å; I239-E242 PolarHBondContact O-N 3.39Å; I239-R243 HydrophobicContact CG2-CB 4.31Å; I239-R243 HydrophobicContact CG2-CG 3.99Å; I239-R243 WeakPolarHBondContact O-CB 3.29Å; I239-R243 PolarHBondContact O-N 3.25Å; I239-V245 HydrophobicContact CG2-CG2 4.48Å; I239-L248 HydrophobicContact CB-CD1 4.01Å; I239-L248 HydrophobicContact CB-CD2 4.37Å; I239-L248 HydrophobicContact CD1-CD1 4.3Å; I239-L248 HydrophobicContact CG2-CD1 4.11Å; I239-L248 HydrophobicContact CG2-CD2 3.53Å; I239-L248 HydrophobicContact CG2-CG 4.46Å
240	F	95.6	Very high	94.7	Very high	4 Å²	4	45.4 Å²	45.4	2%	0.018	22%	0.223	C	C	.	.	H	α-helix	trans	-61.4	-37.3	176.1	-76.3	-41	0	0	0	113.4	I112 A236 L237 A238 R244 V245 L248 Y261 R263 V266	I112-F240 HydrophobicContact CD1-CD2 4.2Å; I112-F240 HydrophobicContact CG2-CB 4.06Å; A236-F240 VanDerWaalsContact O-CD2 3.28Å; A236-F240 WeakPolarHBondContact O-CD2 3.36Å; A236-F240 WeakPolarHBondContact O-CG 3.27Å; A236-F240 PolarHBondContact O-N 3.43Å; L237-F240 HydrophobicContact CD2-CD2 4.29Å; L237-F240 WeakPolarHBondContact O-CB 3.44Å; L237-F240 PolarHBondContact O-N 2.88Å; L237-F240 VanDerWaalsContact O-N 3.15Å; A238-F240 VanDerWaalsContact C-N 3.33Å; A238-F240 PolarHBondContact O-N 3.31Å; F240-R244 VanDerWaalsContact O-CA 3.26Å; F240-R244 WeakPolarHBondContact O-CA 3.33Å; F240-R244 PolarHBondContact O-N 3.48Å; F240-V245 HydrophobicContact CD1-CG2 4.05Å; F240-V245 WeakPolarHBondContact CD1-O 3.35Å; F240-V245 HydrophobicContact CE1-CG2 4.45Å; F240-L248 HydrophobicContact CD1-CD1 4.29Å; F240-L248 HydrophobicContact CD1-CG 4.23Å; F240-L248 HydrophobicContact CE1-CD1 4Å; F240-L248 HydrophobicContact CE1-CG 3.7Å; F240-L248 HydrophobicContact CE2-CD1 4.45Å; F240-L248 HydrophobicContact CZ-CD1 4.09Å; F240-L248 HydrophobicContact CZ-CG 4.06Å; F240-Y261 AromaticContact CE2-CD1 3.92Å; F240-Y261 HydrophobicContact CE2-CD1 3.92Å; F240-Y261 HydrophobicContact CE2-CE1 4.02Å; F240-Y261 HydrophobicContact CZ-CD1 4.07Å; F240-R263 HydrophobicContact CD1-CG 4.21Å; F240-R263 HydrophobicContact CE1-CG 4.22Å; F240-R263 HydrophobicContact CG-CG 4.4Å; F240-R263 HydrophobicContact CZ-CG 4.43Å; F240-V266 HydrophobicContact CD2-CG2 4.4Å; F240-V266 HydrophobicContact CE2-CG2 3.99Å
241	V	92.7	Very high	94.7	Very high	46 Å²	46	41.6 Å²	41.6	28%	0.279	20%	0.196	S	C	.	.	H	α-helix	trans	-74.3	-48.1	178.3	174.9	0	0	0	0	110.6	I112 H116 L237 A238 I239	I112-V241 HydrophobicContact CG2-CG2 3.91Å; H116-V241 HydrophobicContact CB-CG2 3.99Å; L237-V241 WeakPolarHBondContact O-CG2 3.36Å; L237-V241 PolarHBondContact O-N 3.49Å; A238-V241 PolarHBondContact O-N 3.29Å; I239-V241 VanDerWaalsContact C-N 3.3Å; I239-V241 PolarHBondContact O-N 3.03Å
242	E	92.8	Very high	94.5	Very high	136 Å²	136	42.2 Å²	42.2	64%	0.636	20%	0.197	S	C	*	.	H	α-helix	trans	-69.4	-55.5	-176	-172.6	-167.3	163	0	0	112	A238 I239 R244	A238-E242 WeakPolarHBondContact O-CB 3.46Å; A238-E242 PolarHBondContact O-N 3.43Å; I239-E242 PolarHBondContact O-N 3.39Å; E242-R244 VanDerWaalsContact C-N 3.32Å; E242-R244 PolarHBondContact O-N 2.9Å
243	R	92.4	Very high	94.4	Very high	142 Å²	142	49 Å²	49	54%	0.536	23%	0.227	S	C	.	.	S	Bend	trans	-84.6	-8.8	-174.6	-60.1	-68.5	179.4	164.2	-1.4	112.9	A225 I239 V245	A225-R243 HydrophobicContact CB-CG 4.36Å; I239-R243 HydrophobicContact CG2-CB 4.31Å; I239-R243 HydrophobicContact CG2-CG 3.99Å; I239-R243 WeakPolarHBondContact O-CB 3.29Å; I239-R243 PolarHBondContact O-N 3.25Å; R243-V245 HydrophobicContact CB-CG1 3.97Å; R243-V245 HydrophobicContact CB-CG2 4.24Å; R243-V245 PolarHBondContact O-N 3.26Å
244	R	90.8	Very high	94.2	Very high	201 Å²	201	54.8 Å²	54.8	76%	0.758	25%	0.254	S	S	*	.			trans	51	28.6	-176.6	-60.1	-172.6	178.7	-163.6	0.9	113.7	F240 E242 R263	F240-R244 VanDerWaalsContact O-CA 3.26Å; F240-R244 WeakPolarHBondContact O-CA 3.33Å; F240-R244 PolarHBondContact O-N 3.48Å; E242-R244 VanDerWaalsContact C-N 3.32Å; E242-R244 PolarHBondContact O-N 2.9Å; R244-R263 PolarHBondContact O-NH2 3.22Å
245	V	92.4	Very high	93.9	Very high	45 Å²	45	52.3 Å²	52.3	27%	0.273	25%	0.251	S	S	.	.			trans	-82.6	153.5	176.8	-63.9	0	0	0	0	111.5	A225 I239 F240 R243 L248 R263	A225-V245 HydrophobicContact CB-CG2 4.44Å; I239-V245 HydrophobicContact CG2-CG2 4.48Å; F240-V245 HydrophobicContact CD1-CG2 4.05Å; F240-V245 WeakPolarHBondContact CD1-O 3.35Å; F240-V245 HydrophobicContact CE1-CG2 4.45Å; R243-V245 HydrophobicContact CB-CG1 3.97Å; R243-V245 HydrophobicContact CB-CG2 4.24Å; R243-V245 PolarHBondContact O-N 3.26Å; V245-L248 HydrophobicContact CG2-CD2 3.59Å; V245-L248 HydrophobicContact CG2-CG 4.39Å; V245-R263 VanDerWaalsContact C-NH2 3.26Å; V245-R263 PolarHBondContact O-NE 3.48Å; V245-R263 VanDerWaalsContact O-NE 3.09Å; V245-R263 PolarHBondContact O-NH2 2.94Å
246	S	91.9	Very high	93.8	Very high	24 Å²	24	51.6 Å²	51.6	17%	0.168	25%	0.247	C	C	.	.	S	Bend	trans	-95.7	-12.9	-174.2	20.3	0	0	0	0	114.8	R263 R319	S246-R263 PolarHBondContact O-N 2.82Å; S246-R319 VanDerWaalsContact CB-NH2 3.29Å; S246-R319 PolarHBondContact OG-NH1 2.96Å; S246-R319 PolarHBondContact OG-NH2 3.09Å
247	A	94	Very high	93.7	Very high	1 Å²	1	52 Å²	52	1%	0.008	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.7	155.8	174.1	0	0	0	0	0	109.7	L260 Y261	A247-L260 HydrophobicContact CB-CD1 3.86Å; A247-L260 HydrophobicContact CB-CD2 4.44Å; A247-L260 HydrophobicContact CB-CG 4.09Å; A247-Y261 CarbonylContact C-O 3.49Å; A247-Y261 WeakPolarHBondContact CA-O 3.43Å; A247-Y261 WeakPolarHBondContact CB-O 3.29Å
248	L	95.4	Very high	93.5	Very high	0 Å²	0	55 Å²	55	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	122	-179.1	-62.7	172.3	0	0	0	108.3	A225 I227 A236 I239 F240 V245 V250 Y261	A225-L248 HydrophobicContact CB-CD2 3.77Å; A225-L248 WeakPolarHBondContact O-CD2 3.32Å; I227-L248 HydrophobicContact CG2-CB 4.01Å; I227-L248 HydrophobicContact CG2-CD1 4.44Å; A236-L248 HydrophobicContact CB-CD1 4.04Å; I239-L248 HydrophobicContact CB-CD1 4.01Å; I239-L248 HydrophobicContact CB-CD2 4.37Å; I239-L248 HydrophobicContact CD1-CD1 4.3Å; I239-L248 HydrophobicContact CG2-CD1 4.11Å; I239-L248 HydrophobicContact CG2-CD2 3.53Å; I239-L248 HydrophobicContact CG2-CG 4.46Å; F240-L248 HydrophobicContact CD1-CD1 4.29Å; F240-L248 HydrophobicContact CD1-CG 4.23Å; F240-L248 HydrophobicContact CE1-CD1 4Å; F240-L248 HydrophobicContact CE1-CG 3.7Å; F240-L248 HydrophobicContact CE2-CD1 4.45Å; F240-L248 HydrophobicContact CZ-CD1 4.09Å; F240-L248 HydrophobicContact CZ-CG 4.06Å; V245-L248 HydrophobicContact CG2-CD2 3.59Å; V245-L248 HydrophobicContact CG2-CG 4.39Å; L248-V250 PolarHBondContact O-N 2.95Å; L248-Y261 PolarHBondContact N-O 3.07Å; L248-Y261 PolarHBondContact O-N 2.87Å
249	P	95.6	Very high	93.3	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.2	124.4	164	-20	33.6	0	0	0	108.7	A225 T226 I227 V257 L260 V321 V329 I332	A225-P249 WeakPolarHBondContact O-CD 3.48Å; T226-P249 WeakPolarHBondContact CA-O 3.46Å; T226-P249 HydrophobicContact CG2-CB 4.24Å; T226-P249 HydrophobicContact CG2-CG 4.4Å; I227-P249 PolarHBondContact N-O 3.26Å; P249-V257 HydrophobicContact CB-CG2 4.07Å; P249-L260 HydrophobicContact CG-CD1 4.31Å; P249-V321 HydrophobicContact CB-CG1 4.44Å; P249-V321 HydrophobicContact CG-CG1 4.31Å; P249-V321 HydrophobicContact CG-CG2 4.29Å; P249-V329 HydrophobicContact CB-CG1 4.42Å; P249-V329 HydrophobicContact CB-CG2 3.88Å; P249-V329 HydrophobicContact CG-CG1 4.22Å; P249-I332 HydrophobicContact CG-CD1 3.8Å; P249-I332 HydrophobicContact CG-CG1 4.23Å
250	V	95.6	Very high	93.1	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	125.7	171.6	-172.6	0	0	0	0	106.8	I227 E229 L248 V258 A259 M282 L286	I227-V250 HydrophobicContact CG2-CB 4.35Å; I227-V250 HydrophobicContact CG2-CG1 4.49Å; I227-V250 HydrophobicContact CG2-CG2 3.86Å; I227-V250 CarbonylContact O-C 3.56Å; I227-V250 VanDerWaalsContact O-CA 3.28Å; I227-V250 WeakPolarHBondContact O-CA 3.47Å; E229-V250 HydrophobicContact CB-CG1 3.96Å; L248-V250 PolarHBondContact O-N 2.95Å; V250-V258 HydrophobicContact CB-CG2 4.06Å; V250-V258 HydrophobicContact CG1-CG2 3.8Å; V250-V258 VanDerWaalsContact O-CG2 3.3Å; V250-V258 WeakPolarHBondContact O-CG2 3.38Å; V250-V258 PolarHBondContact O-N 3.09Å; V250-A259 HydrophobicContact CB-CB 4.06Å; V250-A259 HydrophobicContact CG2-CB 4.26Å; V250-A259 PolarHBondContact N-O 3.11Å; V250-A259 PolarHBondContact O-N 2.71Å; V250-M282 HydrophobicContact CG1-CB 4.07Å; V250-M282 HydrophobicContact CG2-CE 4.25Å; V250-L286 HydrophobicContact CB-CD1 4.37Å; V250-L286 HydrophobicContact CG1-CD1 4.19Å; V250-L286 HydrophobicContact CG2-CD1 4.18Å
251	V	95.3	Very high	93	Very high	4 Å²	4	54.2 Å²	54.2	2%	0.024	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	152.6	-176	-61.3	0	0	0	0	111.1	T226 I227 Q228 E229 K256 V329	T226-V251 HydrophobicContact CG2-CG1 4.31Å; I227-V251 PolarHBondContact O-N 3.5Å; Q228-V251 CarbonylContact C-O 3.59Å; Q228-V251 WeakPolarHBondContact CA-O 3.35Å; Q228-V251 PolarHBondContact OE1-O 3.26Å; E229-V251 PolarHBondContact N-O 2.86Å; V251-K256 CarbonylContact C-O 3.58Å; V251-K256 WeakPolarHBondContact CA-O 3.47Å; V251-V329 HydrophobicContact CG1-CG2 3.8Å
252	N	94.1	Very high	93	Very high	26 Å²	26	53.3 Å²	53.3	14%	0.139	26%	0.257	C	S	.	.			trans	-83.2	-179.2	169.1	70.3	6.4	0	0	0	111.4	Q228 Q254 G255 K256 V258	Q228-N252 PolarHBondContact OE1-O 3.49Å; N252-Q254 VanDerWaalsContact CG-OE1 3.29Å; N252-Q254 PolarHBondContact ND2-OE1 3.02Å; N252-Q254 PolarHBondContact O-N 3.05Å; N252-Q254 VanDerWaalsContact O-N 3.14Å; N252-Q254 WeakPolarHBondContact OD1-CA 3.36Å; N252-Q254 PolarHBondContact OD1-N 3.45Å; N252-Q254 PolarHBondContact OD1-OE1 3.25Å; N252-G255 PolarHBondContact O-N 3.1Å; N252-G255 PolarHBondContact OD1-N 3.37Å; N252-G255 VanDerWaalsContact OD1-N 3.13Å; N252-K256 PolarHBondContact N-O 2.93Å; N252-K256 WeakPolarHBondContact OD1-CB 3.34Å; N252-K256 PolarHBondContact OD1-N 3.07Å; N252-V258 HydrophobicContact CB-CG1 3.95Å
253	E	92.9	Very high	92.9	Very high	162 Å²	162	48.3 Å²	48.3	76%	0.757	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-27.1	178.5	-63.9	179.3	172.3	0	0	113.5	G255	E253-G255 VanDerWaalsContact C-N 3.3Å
254	Q	91.6	Very high	92.6	Very high	121 Å²	121	44 Å²	44	57%	0.565	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.2	4	177	-59.6	77.3	36.5	0	0	113	N252 K256	N252-Q254 VanDerWaalsContact CG-OE1 3.29Å; N252-Q254 PolarHBondContact ND2-OE1 3.02Å; N252-Q254 PolarHBondContact O-N 3.05Å; N252-Q254 VanDerWaalsContact O-N 3.14Å; N252-Q254 WeakPolarHBondContact OD1-CA 3.36Å; N252-Q254 PolarHBondContact OD1-N 3.45Å; N252-Q254 PolarHBondContact OD1-OE1 3.25Å; Q254-K256 VanDerWaalsContact C-N 3.28Å; Q254-K256 HydrophobicContact CB-CG 4.35Å; Q254-K256 PolarHBondContact O-N 3Å
255	G	89.1	Confident	92.5	Very high	24 Å²	24	35.2 Å²	35.2	25%	0.247	19%	0.186	C	C	.	.	S	Bend	trans	77	9.2	-179.6	0	0	0	0	0	114.7	N252 E253	N252-G255 PolarHBondContact O-N 3.1Å; N252-G255 PolarHBondContact OD1-N 3.37Å; N252-G255 VanDerWaalsContact OD1-N 3.13Å; E253-G255 VanDerWaalsContact C-N 3.3Å
256	K	93.6	Very high	92.4	Very high	83 Å²	83	33 Å²	33	36%	0.361	17%	0.173	S	C	.	.	B	Isolated β-bridge	trans	-79.8	139.3	177.8	-56.9	-171.7	175.4	-167.6	0	110.5	V251 N252 Q254 V258 E326 D327 V328	V251-K256 CarbonylContact C-O 3.58Å; V251-K256 WeakPolarHBondContact CA-O 3.47Å; N252-K256 PolarHBondContact N-O 2.93Å; N252-K256 WeakPolarHBondContact OD1-CB 3.34Å; N252-K256 PolarHBondContact OD1-N 3.07Å; Q254-K256 VanDerWaalsContact C-N 3.28Å; Q254-K256 HydrophobicContact CB-CG 4.35Å; Q254-K256 PolarHBondContact O-N 3Å; K256-V258 PolarHBondContact O-N 2.72Å; K256-E326 WeakPolarHBondContact CD-O 3.49Å; K256-E326 WeakPolarHBondContact CE-O 3.41Å; K256-E326 WeakPolarHBondContact CG-O 3.29Å; K256-D327 CarbonylContact C-O 3.59Å; K256-D327 WeakPolarHBondContact CA-O 3.43Å; K256-D327 HydrophobicContact CB-CB 4.42Å; K256-V328 HydrophobicContact CG-CG2 4.28Å
257	V	93.8	Very high	92.1	Very high	9 Å²	9	32.4 Å²	32.4	6%	0.055	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	121.6	178.8	72.9	0	0	0	0	110.8	P249 V296 K298 V321 V323 D327 V329	P249-V257 HydrophobicContact CB-CG2 4.07Å; V257-V296 HydrophobicContact CG2-CG1 4.28Å; V257-V296 HydrophobicContact CG2-CG2 4.12Å; V257-K298 HydrophobicContact CG1-CD 4.18Å; V257-K298 HydrophobicContact CG1-CG 4.48Å; V257-V321 HydrophobicContact CG2-CG1 4.34Å; V257-V323 HydrophobicContact CG1-CG1 3.63Å; V257-D327 PolarHBondContact N-O 3.38Å; V257-V329 HydrophobicContact CB-CG2 3.76Å; V257-V329 HydrophobicContact CG2-CG2 4.16Å
258	V	91.8	Very high	91.5	Very high	62 Å²	62	34 Å²	34	38%	0.376	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	-36.5	176.5	-63	0	0	0	0	111.6	E229 V250 N252 K256	E229-V258 HydrophobicContact CB-CG2 4.39Å; V250-V258 HydrophobicContact CB-CG2 4.06Å; V250-V258 HydrophobicContact CG1-CG2 3.8Å; V250-V258 VanDerWaalsContact O-CG2 3.3Å; V250-V258 WeakPolarHBondContact O-CG2 3.38Å; V250-V258 PolarHBondContact O-N 3.09Å; N252-V258 HydrophobicContact CB-CG1 3.95Å; K256-V258 PolarHBondContact O-N 2.72Å
259	A	91.8	Very high	90.9	Very high	12 Å²	12	34.2 Å²	34.2	10%	0.099	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	172.3	-178.3	0	0	0	0	0	111.4	V250 L286	V250-A259 HydrophobicContact CB-CB 4.06Å; V250-A259 HydrophobicContact CG2-CB 4.26Å; V250-A259 PolarHBondContact N-O 3.11Å; V250-A259 PolarHBondContact O-N 2.71Å; A259-L286 HydrophobicContact CB-CD1 3.36Å; A259-L286 HydrophobicContact CB-CD2 3.75Å; A259-L286 HydrophobicContact CB-CG 4.18Å
260	L	91.9	Very high	90	Very high	37 Å²	37	34.3 Å²	34.3	19%	0.194	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	114.2	170.7	-179.5	70.8	0	0	0	108	A247 P249 R289 V296 R319 V321	A247-L260 HydrophobicContact CB-CD1 3.86Å; A247-L260 HydrophobicContact CB-CD2 4.44Å; A247-L260 HydrophobicContact CB-CG 4.09Å; P249-L260 HydrophobicContact CG-CD1 4.31Å; L260-R289 PolarHBondContact O-NH2 3.24Å; L260-V296 HydrophobicContact CB-CG1 4.17Å; L260-V296 HydrophobicContact CB-CG2 4.44Å; L260-R319 HydrophobicContact CD2-CG 3.92Å; L260-V321 HydrophobicContact CD1-CG2 3.9Å
261	Y	93.4	Very high	88.9	Confident	3 Å²	3	36.5 Å²	36.5	1%	0.012	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	120.2	177.4	-168.6	-109.1	0	0	0	110.3	A236 F240 A247 L248 D265 V266 M282 A285 L286	A236-Y261 HydrophobicContact CB-CD1 4.19Å; A236-Y261 HydrophobicContact CB-CE1 4.19Å; F240-Y261 AromaticContact CE2-CD1 3.92Å; F240-Y261 HydrophobicContact CE2-CD1 3.92Å; F240-Y261 HydrophobicContact CE2-CE1 4.02Å; F240-Y261 HydrophobicContact CZ-CD1 4.07Å; A247-Y261 CarbonylContact C-O 3.49Å; A247-Y261 WeakPolarHBondContact CA-O 3.43Å; A247-Y261 WeakPolarHBondContact CB-O 3.29Å; L248-Y261 PolarHBondContact N-O 3.07Å; L248-Y261 PolarHBondContact O-N 2.87Å; Y261-D265 HydrophobicContact CD2-CB 3.63Å; Y261-D265 HydrophobicContact CE2-CB 3.32Å; Y261-D265 HydrophobicContact CG-CB 4.4Å; Y261-V266 HydrophobicContact CE1-CG2 3.93Å; Y261-M282 HydrophobicContact CD1-CE 3.41Å; Y261-M282 VanDerWaalsContact CD1-CE 3.41Å; Y261-M282 HydrophobicContact CD2-CE 3.43Å; Y261-M282 VanDerWaalsContact CD2-CE 3.43Å; Y261-M282 HydrophobicContact CE1-CE 3.82Å; Y261-M282 HydrophobicContact CE2-CE 3.84Å; Y261-M282 HydrophobicContact CG-CE 3.18Å; Y261-A285 HydrophobicContact CE2-CB 4.44Å; Y261-L286 HydrophobicContact CD2-CD2 4.24Å
262	S	92.5	Very high	87.8	Confident	28 Å²	28	40.3 Å²	40.3	20%	0.196	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	164.7	-173	73.2	0	0	0	0	111.8	F264 D265	S262-F264 PolarHBondContact O-N 2.71Å; S262-F264 VanDerWaalsContact O-N 3.1Å; S262-F264 WeakPolarHBondContact OG-CB 3.22Å; S262-F264 PolarHBondContact OG-N 3.5Å; S262-D265 WeakPolarHBondContact CA-OD2 3.48Å; S262-D265 WeakPolarHBondContact CB-OD2 3.43Å; S262-D265 PolarHBondContact N-OD2 3.1Å; S262-D265 WeakPolarHBondContact O-CB 3.36Å; S262-D265 PolarHBondContact O-N 3.43Å; S262-D265 PolarHBondContact OG-N 3.46Å; S262-D265 PolarHBondContact OG-OD2 2.94Å
263	R	91.2	Very high	86.9	Confident	30 Å²	30	45.8 Å²	45.8	11%	0.113	24%	0.236	C	C	.	.	H	α-helix	trans	-55.2	-29.8	169.3	-63.8	-170.8	-174.3	133.6	-2.7	111.9	I108 I112 F240 R244 V245 S246 D265 V266	I108-R263 HydrophobicContact CG2-CB 4.47Å; I108-R263 WeakPolarHBondContact CG2-O 3.41Å; I112-R263 HydrophobicContact CD1-CB 3.67Å; I112-R263 HydrophobicContact CD1-CG 3.44Å; I112-R263 VanDerWaalsContact CD1-CG 3.44Å; F240-R263 HydrophobicContact CD1-CG 4.21Å; F240-R263 HydrophobicContact CE1-CG 4.22Å; F240-R263 HydrophobicContact CG-CG 4.4Å; F240-R263 HydrophobicContact CZ-CG 4.43Å; R244-R263 PolarHBondContact O-NH2 3.22Å; V245-R263 VanDerWaalsContact C-NH2 3.26Å; V245-R263 PolarHBondContact O-NE 3.48Å; V245-R263 VanDerWaalsContact O-NE 3.09Å; V245-R263 PolarHBondContact O-NH2 2.94Å; S246-R263 PolarHBondContact O-N 2.82Å; R263-D265 VanDerWaalsContact C-N 3.25Å; R263-D265 PolarHBondContact O-N 2.94Å; R263-V266 WeakPolarHBondContact O-CB 3.26Å; R263-V266 PolarHBondContact O-N 3.45Å
264	F	86.9	Confident	86.1	Confident	53 Å²	53	40.9 Å²	40.9	23%	0.232	21%	0.214	C	C	.	.	H	α-helix	trans	-64.4	-30	176.7	178.9	-107	0	0	0	112.4	F10 R90 I108 S262 V266 I267	F10-F264 HydrophobicContact CZ-CZ 4.32Å; R90-F264 HydrophobicContact CG-CD2 4.08Å; R90-F264 HydrophobicContact CG-CE2 4.16Å; R90-F264 VanDerWaalsContact NE-CD2 3.26Å; R90-F264 VanDerWaalsContact NE-CE2 3.28Å; I108-F264 HydrophobicContact CD1-CD2 4.26Å; S262-F264 PolarHBondContact O-N 2.71Å; S262-F264 VanDerWaalsContact O-N 3.1Å; S262-F264 WeakPolarHBondContact OG-CB 3.22Å; S262-F264 PolarHBondContact OG-N 3.5Å; F264-V266 VanDerWaalsContact C-N 3.3Å; F264-V266 PolarHBondContact O-N 3.44Å; F264-I267 HydrophobicContact CD2-CG2 4.27Å; F264-I267 HydrophobicContact CE2-CG2 4.4Å; F264-I267 VanDerWaalsContact O-CG2 3.23Å; F264-I267 WeakPolarHBondContact O-CG2 3.41Å; F264-I267 PolarHBondContact O-N 3.35Å
265	D	88.6	Confident	85.6	Confident	15 Å²	15	35.4 Å²	35.4	8%	0.08	19%	0.189	C	C	.	.	H	α-helix	trans	-70.5	-30.9	177	-60.8	-75	0	0	0	112.5	Y261 S262 R263 I267 N268 R289	Y261-D265 HydrophobicContact CD2-CB 3.63Å; Y261-D265 HydrophobicContact CE2-CB 3.32Å; Y261-D265 HydrophobicContact CG-CB 4.4Å; S262-D265 WeakPolarHBondContact CA-OD2 3.48Å; S262-D265 WeakPolarHBondContact CB-OD2 3.43Å; S262-D265 PolarHBondContact N-OD2 3.1Å; S262-D265 WeakPolarHBondContact O-CB 3.36Å; S262-D265 PolarHBondContact O-N 3.43Å; S262-D265 PolarHBondContact OG-N 3.46Å; S262-D265 PolarHBondContact OG-OD2 2.94Å; R263-D265 VanDerWaalsContact C-N 3.25Å; R263-D265 PolarHBondContact O-N 2.94Å; D265-I267 VanDerWaalsContact C-N 3.28Å; D265-I267 PolarHBondContact O-N 3.36Å; D265-N268 WeakPolarHBondContact O-CB 3.35Å; D265-N268 PolarHBondContact O-N 2.97Å; D265-N268 VanDerWaalsContact O-N 3.11Å; D265-R289 IonicContact OD1-CZ 3.66Å; D265-R289 IonicContact OD1-NE 2.76Å; D265-R289 PolarHBondContact OD1-NE 3.43Å; D265-R289 IonicContact OD1-NH2 3.37Å; D265-R289 PolarHBondContact OD1-NH2 3.36Å; D265-R289 IonicContact OD2-CZ 2.68Å; D265-R289 IonicContact OD2-NH2 3.17Å; D265-R289 PolarHBondContact OD2-NH2 2.91Å
266	V	90.2	Very high	85.2	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-63.2	-35.2	179	-172.7	0	0	0	0	111.4	F111 I112 L115 L237 F240 Y261 R263 F264 N268 L269	F111-V266 HydrophobicContact CD1-CG1 4.02Å; F111-V266 HydrophobicContact CE1-CG1 4.2Å; F111-V266 WeakPolarHBondContact CE1-O 3.35Å; I112-V266 HydrophobicContact CD1-CB 4.37Å; I112-V266 HydrophobicContact CD1-CG2 4.13Å; I112-V266 HydrophobicContact CG1-CB 4.04Å; I112-V266 HydrophobicContact CG1-CG1 3.78Å; I112-V266 HydrophobicContact CG1-CG2 4.07Å; L115-V266 HydrophobicContact CD1-CG1 4.02Å; L237-V266 HydrophobicContact CD2-CB 4.41Å; L237-V266 HydrophobicContact CD2-CG1 3.73Å; L237-V266 HydrophobicContact CD2-CG2 3.72Å; F240-V266 HydrophobicContact CD2-CG2 4.4Å; F240-V266 HydrophobicContact CE2-CG2 3.99Å; Y261-V266 HydrophobicContact CE1-CG2 3.93Å; R263-V266 WeakPolarHBondContact O-CB 3.26Å; R263-V266 PolarHBondContact O-N 3.45Å; F264-V266 VanDerWaalsContact C-N 3.3Å; F264-V266 PolarHBondContact O-N 3.44Å; V266-N268 PolarHBondContact O-N 3.28Å; V266-L269 HydrophobicContact CG1-CD1 4.16Å; V266-L269 VanDerWaalsContact O-CB 3.26Å; V266-L269 WeakPolarHBondContact O-CB 3.37Å; V266-L269 WeakPolarHBondContact O-CG 3.41Å; V266-L269 PolarHBondContact O-N 3.43Å; V266-L269 VanDerWaalsContact O-N 3.13Å
267	I	85.9	Confident	84.9	Confident	10 Å²	10	35.1 Å²	35.1	5%	0.051	19%	0.186	C	C	.	.	H	α-helix	trans	-68.3	-23.6	178.9	-155.8	63.1	0	0	0	112.3	F81 V85 I108 F111 F264 D265 L269 A270 A271	F81-I267 HydrophobicContact CB-CD1 4.33Å; F81-I267 HydrophobicContact CD1-CD1 3.85Å; F81-I267 HydrophobicContact CG-CD1 4.41Å; V85-I267 HydrophobicContact CG2-CD1 4.49Å; V85-I267 HydrophobicContact CG2-CG1 3.74Å; I108-I267 HydrophobicContact CD1-CB 4.2Å; I108-I267 HydrophobicContact CD1-CG2 4.19Å; I108-I267 HydrophobicContact CG1-CB 4.16Å; I108-I267 HydrophobicContact CG1-CD1 4.43Å; I108-I267 HydrophobicContact CG1-CG1 4.32Å; I108-I267 HydrophobicContact CG2-CB 3.99Å; I108-I267 HydrophobicContact CG2-CD1 4.44Å; F111-I267 HydrophobicContact CB-CD1 4.45Å; F111-I267 HydrophobicContact CD1-CD1 3.91Å; F111-I267 HydrophobicContact CE1-CD1 4.4Å; F111-I267 HydrophobicContact CG-CD1 4.19Å; F264-I267 HydrophobicContact CD2-CG2 4.27Å; F264-I267 HydrophobicContact CE2-CG2 4.4Å; F264-I267 VanDerWaalsContact O-CG2 3.23Å; F264-I267 WeakPolarHBondContact O-CG2 3.41Å; F264-I267 PolarHBondContact O-N 3.35Å; D265-I267 VanDerWaalsContact C-N 3.28Å; D265-I267 PolarHBondContact O-N 3.36Å; I267-L269 PolarHBondContact O-N 2.92Å; I267-A270 HydrophobicContact CD1-CB 4.36Å; I267-A270 VanDerWaalsContact O-CB 3.23Å; I267-A270 WeakPolarHBondContact O-CB 3.34Å; I267-A270 PolarHBondContact O-N 3.2Å; I267-A271 PolarHBondContact O-N 3.46Å
268	N	80.9	Confident	84.7	Confident	36 Å²	36	34.7 Å²	34.7	19%	0.193	18%	0.183	C	C	.	.	H	α-helix	trans	-68.1	-23.9	175.8	-65.5	-23.3	0	0	0	111.7	D265 V266 A270 A271 Q272	D265-N268 WeakPolarHBondContact O-CB 3.35Å; D265-N268 PolarHBondContact O-N 2.97Å; D265-N268 VanDerWaalsContact O-N 3.11Å; V266-N268 PolarHBondContact O-N 3.28Å; N268-A270 PolarHBondContact O-N 2.92Å; N268-A271 WeakPolarHBondContact O-CB 3.48Å; N268-A271 PolarHBondContact O-N 3.49Å; N268-A271 VanDerWaalsContact O-N 3.16Å; N268-Q272 PolarHBondContact O-N 2.98Å
269	L	81.6	Confident	84.7	Confident	4 Å²	4	35.9 Å²	35.9	2%	0.021	19%	0.187	C	C	.	.	H	α-helix	trans	-62.1	-33.2	170.3	-56.9	174.6	0	0	0	111.6	V233 V266 I267 K273 N274 Y275 L278 M280	V233-L269 HydrophobicContact CG1-CD1 3.94Å; V266-L269 HydrophobicContact CG1-CD1 4.16Å; V266-L269 VanDerWaalsContact O-CB 3.26Å; V266-L269 WeakPolarHBondContact O-CB 3.37Å; V266-L269 WeakPolarHBondContact O-CG 3.41Å; V266-L269 PolarHBondContact O-N 3.43Å; V266-L269 VanDerWaalsContact O-N 3.13Å; I267-L269 PolarHBondContact O-N 2.92Å; L269-K273 PolarHBondContact O-N 3.27Å; L269-N274 PolarHBondContact O-N 2.79Å; L269-Y275 PolarHBondContact O-N 2.96Å; L269-L278 HydrophobicContact CD1-CD2 4Å; L269-M280 HydrophobicContact CD2-CE 3.71Å; L269-M280 HydrophobicContact CD2-SD 4.47Å
270	A	76.4	Confident	84.7	Confident	1 Å²	1	35.8 Å²	35.8	1%	0.008	19%	0.185	C	C	.	.	H	α-helix	trans	-67.4	-44.3	173.2	0	0	0	0	0	111.2	F82 V85 F111 I267 N268 Q272 K273	F82-A270 HydrophobicContact CD1-CB 4.41Å; F82-A270 HydrophobicContact CE1-CB 4.3Å; F82-A270 WeakPolarHBondContact CE1-O 3.43Å; V85-A270 HydrophobicContact CG2-CB 4.46Å; F111-A270 HydrophobicContact CE1-CB 4.03Å; F111-A270 HydrophobicContact CE2-CB 4.42Å; F111-A270 HydrophobicContact CZ-CB 3.75Å; I267-A270 HydrophobicContact CD1-CB 4.36Å; I267-A270 VanDerWaalsContact O-CB 3.23Å; I267-A270 WeakPolarHBondContact O-CB 3.34Å; I267-A270 PolarHBondContact O-N 3.2Å; N268-A270 PolarHBondContact O-N 2.92Å; A270-Q272 VanDerWaalsContact C-N 3.3Å; A270-Q272 PolarHBondContact O-N 3.36Å; A270-K273 PolarHBondContact O-N 2.93Å; A270-K273 VanDerWaalsContact O-N 3.13Å
271	A	72.8	Confident	84.8	Confident	46 Å²	46	36 Å²	36	38%	0.38	19%	0.187	S	C	.	.	H	α-helix	trans	-57.6	-43.5	178.3	0	0	0	0	0	112.1	V85 I267 N268 K273	V85-A271 HydrophobicContact CG1-CB 3.52Å; V85-A271 HydrophobicContact CG2-CB 4.39Å; I267-A271 PolarHBondContact O-N 3.46Å; N268-A271 WeakPolarHBondContact O-CB 3.48Å; N268-A271 PolarHBondContact O-N 3.49Å; N268-A271 VanDerWaalsContact O-N 3.16Å; A271-K273 VanDerWaalsContact C-N 3.29Å; A271-K273 PolarHBondContact O-N 3.45Å
272	Q	73.4	Confident	84.8	Confident	84 Å²	84	35.8 Å²	35.8	39%	0.393	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-1.2	-178.3	-64.6	176.2	-3.3	0	0	113.4	N268 A270 N274 S288	N268-Q272 PolarHBondContact O-N 2.98Å; A270-Q272 VanDerWaalsContact C-N 3.3Å; A270-Q272 PolarHBondContact O-N 3.36Å; Q272-N274 HydrophobicContact CB-CB 4.07Å; Q272-N274 PolarHBondContact O-N 3.31Å; Q272-S288 PolarHBondContact NE2-O 3.15Å
273	K	75.1	Confident	84.8	Confident	142 Å²	142	40.7 Å²	40.7	62%	0.617	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.7	23.3	-170	-56.5	-179.3	178.9	174.5	0	113.4	F82 L269 A270 A271	F82-K273 HydrophobicContact CE2-CG 4.42Å; F82-K273 HydrophobicContact CZ-CG 3.99Å; L269-K273 PolarHBondContact O-N 3.27Å; A270-K273 PolarHBondContact O-N 2.93Å; A270-K273 VanDerWaalsContact O-N 3.13Å; A271-K273 VanDerWaalsContact C-N 3.29Å; A271-K273 PolarHBondContact O-N 3.45Å
274	N	76.7	Confident	84.7	Confident	58 Å²	58	44.5 Å²	44.5	31%	0.31	22%	0.224	S	C	.	.			trans	-98.4	15.9	-175.8	-162.3	17	0	0	0	112.2	L269 Q272 N276 N277 M280	L269-N274 PolarHBondContact O-N 2.79Å; Q272-N274 HydrophobicContact CB-CB 4.07Å; Q272-N274 PolarHBondContact O-N 3.31Å; N274-N276 PolarHBondContact O-N 3.41Å; N274-N277 PolarHBondContact O-N 3.32Å; N274-M280 WeakPolarHBondContact ND2-CE 3.4Å
275	Y	79.6	Confident	84.8	Confident	6 Å²	6	42.3 Å²	42.3	2%	0.024	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-7	176.9	57.4	-97.9	0	0	0	113.6	K78 F82 L115 L129 E130 L269 L278	K78-Y275 WeakPolarHBondContact CE-OH 3.46Å; F82-Y275 HydrophobicContact CE1-CE1 4.19Å; F82-Y275 HydrophobicContact CZ-CE1 4.3Å; L115-Y275 HydrophobicContact CD2-CD2 4.45Å; L129-Y275 HydrophobicContact CD2-CD2 3.87Å; L129-Y275 HydrophobicContact CD2-CE2 3.7Å; L129-Y275 HydrophobicContact CD2-CG 4.49Å; E130-Y275 PolarHBondContact OE1-OH 3.01Å; L269-Y275 PolarHBondContact O-N 2.96Å; Y275-L278 WeakPolarHBondContact O-CD2 3.13Å; Y275-L278 WeakPolarHBondContact O-CG 3.25Å
276	N	81.8	Confident	84.8	Confident	41 Å²	41	43 Å²	43	22%	0.219	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-25.4	173.5	-65.5	-31	0	0	0	112.2	Y119 P122 N274	Y119-N276 WeakPolarHBondContact CE2-O 3.43Å; P122-N276 WeakPolarHBondContact CA-O 3.39Å; N274-N276 PolarHBondContact O-N 3.41Å
277	N	86.3	Confident	84.5	Confident	61 Å²	61	46.9 Å²	46.9	33%	0.326	25%	0.251	S	S	.	.			trans	-106.4	73.4	-179.6	-173.8	19.1	0	0	0	112.1	N274 N279 M280	N274-N277 PolarHBondContact O-N 3.32Å; N277-N279 PolarHBondContact O-N 3.38Å; N277-M280 WeakPolarHBondContact O-CE 3.41Å
278	L	90.2	Very high	84	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-2.2	177.5	-50.8	-177.9	0	0	0	113.7	L115 Y119 V233 Y234 L237 L269 Y275 M280	L115-L278 HydrophobicContact CB-CD1 4.09Å; L115-L278 HydrophobicContact CD1-CD2 4.46Å; Y119-L278 HydrophobicContact CD1-CB 4.23Å; Y119-L278 HydrophobicContact CD1-CD1 4.19Å; Y119-L278 HydrophobicContact CD2-CB 4.09Å; Y119-L278 HydrophobicContact CD2-CD1 3.5Å; Y119-L278 VanDerWaalsContact CD2-CD1 3.5Å; Y119-L278 HydrophobicContact CD2-CG 3.74Å; Y119-L278 HydrophobicContact CE1-CB 3.89Å; Y119-L278 HydrophobicContact CE2-CB 3.78Å; Y119-L278 HydrophobicContact CE2-CD1 4.04Å; Y119-L278 HydrophobicContact CE2-CG 3.74Å; Y119-L278 HydrophobicContact CG-CB 4.3Å; Y119-L278 HydrophobicContact CG-CD1 3.57Å; Y119-L278 HydrophobicContact CG-CG 4.18Å; Y119-L278 PolarHBondContact OH-N 3.3Å; V233-L278 HydrophobicContact CG1-CD2 4.3Å; V233-L278 PolarHBondContact N-O 3.38Å; Y234-L278 HydrophobicContact CD2-CD1 4.45Å; Y234-L278 PolarHBondContact N-O 3.12Å; L237-L278 HydrophobicContact CD1-CD1 3.79Å; L269-L278 HydrophobicContact CD1-CD2 4Å; Y275-L278 WeakPolarHBondContact O-CD2 3.13Å; Y275-L278 WeakPolarHBondContact O-CG 3.25Å; L278-M280 VanDerWaalsContact C-N 3.3Å
279	N	91.9	Very high	83.7	Confident	87 Å²	87	49.8 Å²	49.8	47%	0.465	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-8.7	174.6	-73.2	7	0	0	0	113	Y119 P122 N277	Y119-N279 WeakPolarHBondContact CE1-OD1 3.44Å; Y119-N279 PolarHBondContact OH-N 3.46Å; Y119-N279 PolarHBondContact OH-OD1 3.32Å; P122-N279 WeakPolarHBondContact CD-ND2 3.24Å; P122-N279 HydrophobicContact CG-CB 3.92Å; P122-N279 WeakPolarHBondContact CG-ND2 3.24Å; N277-N279 PolarHBondContact O-N 3.38Å
280	M	92	Very high	82.4	Confident	10 Å²	10	54.4 Å²	54.4	5%	0.049	30%	0.298	C	S	.	.	S	Bend	trans	-56.8	144.8	173.4	76.6	178.2	96.7	0	0	110.2	S232 V233 L269 N274 N277 L278 E284 A285	S232-M280 CarbonylContact C-O 3.6Å; S232-M280 WeakPolarHBondContact CA-O 3.26Å; V233-M280 HydrophobicContact CB-CG 4.37Å; V233-M280 HydrophobicContact CG2-CG 3.59Å; V233-M280 HydrophobicContact CG2-SD 4.27Å; V233-M280 PolarHBondContact N-O 2.68Å; L269-M280 HydrophobicContact CD2-CE 3.71Å; L269-M280 HydrophobicContact CD2-SD 4.47Å; N274-M280 WeakPolarHBondContact ND2-CE 3.4Å; N277-M280 WeakPolarHBondContact O-CE 3.41Å; L278-M280 VanDerWaalsContact C-N 3.3Å; M280-E284 WeakPolarHBondContact CA-OE2 3.35Å; M280-E284 HydrophobicContact CB-CB 4.38Å; M280-E284 WeakPolarHBondContact CB-OE2 3.38Å; M280-A285 HydrophobicContact CG-CB 4.26Å; M280-A285 HydrophobicContact SD-CB 3.89Å
281	T	94.8	Very high	81.3	Confident	40 Å²	40	58.2 Å²	58.2	25%	0.245	32%	0.323	C	S	.	.	B	Isolated β-bridge	trans	-71.1	158	179.7	62.3	0	0	0	0	111	A231 K283 E284 A285	A231-T281 CarbonylContact O-C 3.53Å; A231-T281 VanDerWaalsContact O-CA 3.29Å; A231-T281 WeakPolarHBondContact O-CA 3.38Å; T281-K283 PolarHBondContact O-N 3.13Å; T281-E284 PolarHBondContact N-OE2 3.3Å; T281-E284 PolarHBondContact O-N 3.11Å; T281-E284 VanDerWaalsContact O-N 3.14Å; T281-E284 VanDerWaalsContact OG1-CD 3.32Å; T281-E284 VanDerWaalsContact OG1-CG 3.26Å; T281-E284 WeakPolarHBondContact OG1-CG 3.09Å; T281-E284 PolarHBondContact OG1-N 3.27Å; T281-E284 PolarHBondContact OG1-OE2 3.45Å; T281-A285 PolarHBondContact O-N 2.89Å
282	M	93.4	Very high	79.9	Confident	0 Å²	0	67 Å²	67	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-56.9	-37.9	173.4	-68.2	-46.2	-55.4	0	0	111.4	I227 E229 A231 V233 A236 V250 Y261 E284 A285 L286	I227-M282 HydrophobicContact CD1-CG 3.85Å; I227-M282 HydrophobicContact CD1-SD 3.93Å; I227-M282 HydrophobicContact CG1-CG 4.07Å; I227-M282 HydrophobicContact CG2-CG 4.24Å; E229-M282 PolarHBondContact O-N 3.31Å; A231-M282 WeakPolarHBondContact O-CG 3.47Å; A231-M282 PolarHBondContact O-N 2.81Å; V233-M282 HydrophobicContact CG2-SD 4.16Å; A236-M282 HydrophobicContact CB-CE 4.45Å; A236-M282 HydrophobicContact CB-SD 3.82Å; V250-M282 HydrophobicContact CG1-CB 4.07Å; V250-M282 HydrophobicContact CG2-CE 4.25Å; Y261-M282 HydrophobicContact CD1-CE 3.41Å; Y261-M282 VanDerWaalsContact CD1-CE 3.41Å; Y261-M282 HydrophobicContact CD2-CE 3.43Å; Y261-M282 VanDerWaalsContact CD2-CE 3.43Å; Y261-M282 HydrophobicContact CE1-CE 3.82Å; Y261-M282 HydrophobicContact CE2-CE 3.84Å; Y261-M282 HydrophobicContact CG-CE 3.18Å; M282-E284 PolarHBondContact O-N 3.03Å; M282-A285 PolarHBondContact O-N 2.8Å; M282-L286 WeakPolarHBondContact O-CB 3.43Å; M282-L286 WeakPolarHBondContact O-CD1 3.32Å; M282-L286 WeakPolarHBondContact O-CG 3.3Å; M282-L286 PolarHBondContact O-N 3.17Å
283	K	91.1	Very high	78.8	Confident	131 Å²	131	67.5 Å²	67.5	57%	0.57	36%	0.355	S	S	*	.	H	α-helix	trans	-59.1	-45.5	175.6	-170.3	172.3	-175	168.5	0	112.7	E229 T281 L286 A287	E229-K283 PolarHBondContact O-N 3.24Å; T281-K283 PolarHBondContact O-N 3.13Å; K283-L286 PolarHBondContact O-N 2.94Å; K283-A287 WeakPolarHBondContact O-CB 3.34Å; K283-A287 PolarHBondContact O-N 2.75Å
284	E	90.1	Very high	77.3	Confident	110 Å²	110	69.2 Å²	69.2	51%	0.514	37%	0.365	S	S	.	.	H	α-helix	trans	-66.2	-43.4	176.6	-70.2	163.7	159.8	0	0	111.8	M280 T281 M282 L286 A287 S288	M280-E284 WeakPolarHBondContact CA-OE2 3.35Å; M280-E284 HydrophobicContact CB-CB 4.38Å; M280-E284 WeakPolarHBondContact CB-OE2 3.38Å; T281-E284 PolarHBondContact N-OE2 3.3Å; T281-E284 PolarHBondContact O-N 3.11Å; T281-E284 VanDerWaalsContact O-N 3.14Å; T281-E284 VanDerWaalsContact OG1-CD 3.32Å; T281-E284 VanDerWaalsContact OG1-CG 3.26Å; T281-E284 WeakPolarHBondContact OG1-CG 3.09Å; T281-E284 PolarHBondContact OG1-N 3.27Å; T281-E284 PolarHBondContact OG1-OE2 3.45Å; M282-E284 PolarHBondContact O-N 3.03Å; E284-L286 VanDerWaalsContact C-N 3.28Å; E284-L286 PolarHBondContact O-N 3.26Å; E284-A287 PolarHBondContact O-N 2.97Å; E284-S288 PolarHBondContact O-N 2.85Å; E284-S288 VanDerWaalsContact O-N 3.15Å
285	A	89	Confident	76.5	Confident	6 Å²	6	68.9 Å²	68.9	5%	0.05	38%	0.376	C	S	.	.	H	α-helix	trans	-64.5	-31.9	178.4	0	0	0	0	0	112.9	V233 Y261 M280 T281 M282 S288	V233-A285 HydrophobicContact CG2-CB 3.53Å; Y261-A285 HydrophobicContact CE2-CB 4.44Å; M280-A285 HydrophobicContact CG-CB 4.26Å; M280-A285 HydrophobicContact SD-CB 3.89Å; T281-A285 PolarHBondContact O-N 2.89Å; M282-A285 PolarHBondContact O-N 2.8Å; A285-S288 PolarHBondContact O-OG 3.04Å
286	L	87.3	Confident	76.6	Confident	30 Å²	30	69.5 Å²	69.5	16%	0.157	38%	0.38	C	S	.	.	H	α-helix	trans	-76	-36.6	175.4	-69.9	165.3	0	0	0	111.8	V250 A259 Y261 M282 K283 E284 S288 R289	V250-L286 HydrophobicContact CB-CD1 4.37Å; V250-L286 HydrophobicContact CG1-CD1 4.19Å; V250-L286 HydrophobicContact CG2-CD1 4.18Å; A259-L286 HydrophobicContact CB-CD1 3.36Å; A259-L286 HydrophobicContact CB-CD2 3.75Å; A259-L286 HydrophobicContact CB-CG 4.18Å; Y261-L286 HydrophobicContact CD2-CD2 4.24Å; M282-L286 WeakPolarHBondContact O-CB 3.43Å; M282-L286 WeakPolarHBondContact O-CD1 3.32Å; M282-L286 WeakPolarHBondContact O-CG 3.3Å; M282-L286 PolarHBondContact O-N 3.17Å; K283-L286 PolarHBondContact O-N 2.94Å; E284-L286 VanDerWaalsContact C-N 3.28Å; E284-L286 PolarHBondContact O-N 3.26Å; L286-S288 PolarHBondContact O-N 3.28Å; L286-R289 WeakPolarHBondContact O-CB 3.29Å; L286-R289 WeakPolarHBondContact O-CG 3.08Å; L286-R289 PolarHBondContact O-N 2.83Å
287	A	84	Confident	76.9	Confident	81 Å²	81	70.4 Å²	70.4	67%	0.669	39%	0.385	S	S	*	.	H	α-helix	trans	-66.2	-27.1	176.9	0	0	0	0	0	112.7	K283 E284 R289	K283-A287 WeakPolarHBondContact O-CB 3.34Å; K283-A287 PolarHBondContact O-N 2.75Å; E284-A287 PolarHBondContact O-N 2.97Å; A287-R289 VanDerWaalsContact C-N 3.26Å; A287-R289 PolarHBondContact O-N 2.97Å
288	S	75.8	Confident	77.2	Confident	43 Å²	43	69.8 Å²	69.8	30%	0.301	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	2.7	177.5	70.9	0	0	0	0	114.4	Q272 E284 A285 L286 S290	Q272-S288 PolarHBondContact NE2-O 3.15Å; E284-S288 PolarHBondContact O-N 2.85Å; E284-S288 VanDerWaalsContact O-N 3.15Å; A285-S288 PolarHBondContact O-OG 3.04Å; L286-S288 PolarHBondContact O-N 3.28Å; S288-S290 PolarHBondContact O-N 3.15Å
289	R	75.2	Confident	77.4	Confident	64 Å²	64	69.8 Å²	69.8	24%	0.242	38%	0.379	C	S	.	.			trans	-65.9	119.6	175.2	-76	179.4	165.3	169.9	1.3	110.2	L260 D265 L286 A287 C291	L260-R289 PolarHBondContact O-NH2 3.24Å; D265-R289 IonicContact OD1-CZ 3.66Å; D265-R289 IonicContact OD1-NE 2.76Å; D265-R289 PolarHBondContact OD1-NE 3.43Å; D265-R289 IonicContact OD1-NH2 3.37Å; D265-R289 PolarHBondContact OD1-NH2 3.36Å; D265-R289 IonicContact OD2-CZ 2.68Å; D265-R289 IonicContact OD2-NH2 3.17Å; D265-R289 PolarHBondContact OD2-NH2 2.91Å; L286-R289 WeakPolarHBondContact O-CB 3.29Å; L286-R289 WeakPolarHBondContact O-CG 3.08Å; L286-R289 PolarHBondContact O-N 2.83Å; A287-R289 VanDerWaalsContact C-N 3.26Å; A287-R289 PolarHBondContact O-N 2.97Å; R289-C291 PolarHBondContact O-N 3.07Å
290	S	54.6	Low	77.5	Confident	102 Å²	102	69.3 Å²	69.3	71%	0.713	37%	0.371	S	S	*	.	S	Bend	trans	-64.3	-18.5	173.8	50.6	0	0	0	0	113.6	S288	S288-S290 PolarHBondContact O-N 3.15Å
291	C	52.2	Low	77.5	Confident	80 Å²	80	70.7 Å²	70.7	54%	0.541	38%	0.381	S	S	.	.	S	Bend	trans	-118	100.1	176.2	-153.5	0	0	0	0	107.9	R289 V293	R289-C291 PolarHBondContact O-N 3.07Å; C291-V293 VanDerWaalsContact C-N 3.31Å; C291-V293 PolarHBondContact O-N 3.29Å
292	W	42.7	Very low	77.4	Confident	230 Å²	230	74.4 Å²	74.4	87%	0.871	40%	0.396	S	S	*	.			trans	-67.4	92.9	170.4	-167.4	-64.3	0	0	0	107.6	E294	W292-E294 PolarHBondContact O-N 2.95Å
293	V	50.8	Low	77.5	Confident	95 Å²	95	75.7 Å²	75.7	58%	0.576	40%	0.402	S	S	*	.			trans	-76.1	110.3	166.3	-177.1	0	0	0	0	105.9	C291 G295	C291-V293 VanDerWaalsContact C-N 3.31Å; C291-V293 PolarHBondContact O-N 3.29Å; V293-G295 PolarHBondContact O-N 3.21Å
294	E	43.4	Very low	77.6	Confident	178 Å²	178	70.9 Å²	70.9	83%	0.832	38%	0.383	S	S	*	.			trans	-63.3	105	178.3	-165.2	172.6	-164.7	0	0	109.4	W292	W292-E294 PolarHBondContact O-N 2.95Å
295	G	61.4	Low	77.7	Confident	52 Å²	52	65.7 Å²	65.7	54%	0.536	36%	0.359	S	S	.	.	S	Bend	trans	79	162.7	176.4	0	0	0	0	0	115.7	V293	V293-G295 PolarHBondContact O-N 3.21Å
296	V	80.1	Confident	77.8	Confident	18 Å²	18	67 Å²	67	11%	0.109	36%	0.364	C	S	.	.			trans	-79.6	132.9	166.7	-179.5	0	0	0	0	108	V257 L260 K298 V321	V257-V296 HydrophobicContact CG2-CG1 4.28Å; V257-V296 HydrophobicContact CG2-CG2 4.12Å; L260-V296 HydrophobicContact CB-CG1 4.17Å; L260-V296 HydrophobicContact CB-CG2 4.44Å; V296-K298 HydrophobicContact CB-CG 4.43Å; V296-K298 HydrophobicContact CG1-CG 4.41Å; V296-K298 WeakPolarHBondContact O-CG 3.48Å; V296-K298 PolarHBondContact O-N 2.86Å; V296-K298 VanDerWaalsContact O-N 3.14Å; V296-V321 HydrophobicContact CG1-CB 4.13Å; V296-V321 HydrophobicContact CG1-CG2 3.7Å
297	L	88.7	Confident	78.1	Confident	60 Å²	60	68.3 Å²	68.3	31%	0.314	37%	0.374	S	S	.	.			trans	-71.7	111.5	169.3	-65	173.9	0	0	0	109.4	A315 V317 L320 V321	L297-A315 HydrophobicContact CD1-CB 3.41Å; L297-A315 VanDerWaalsContact CD1-CB 3.41Å; L297-V317 HydrophobicContact CD1-CB 4.17Å; L297-V317 HydrophobicContact CD1-CG1 3.46Å; L297-V317 VanDerWaalsContact CD1-CG1 3.46Å; L297-V317 HydrophobicContact CD1-CG2 3.7Å; L297-L320 HydrophobicContact CB-CD2 3.44Å; L297-L320 VanDerWaalsContact CB-CD2 3.44Å; L297-L320 HydrophobicContact CD1-CD2 4.49Å; L297-V321 PolarHBondContact O-N 3.01Å
298	K	92.7	Very high	78.5	Confident	49 Å²	49	64.5 Å²	64.5	21%	0.213	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	161.2	-176.5	-61.1	175.8	-137.7	-174.8	0	111	V257 V296 R311 V321 V323 D327	V257-K298 HydrophobicContact CG1-CD 4.18Å; V257-K298 HydrophobicContact CG1-CG 4.48Å; V296-K298 HydrophobicContact CB-CG 4.43Å; V296-K298 HydrophobicContact CG1-CG 4.41Å; V296-K298 WeakPolarHBondContact O-CG 3.48Å; V296-K298 PolarHBondContact O-N 2.86Å; V296-K298 VanDerWaalsContact O-N 3.14Å; K298-R311 PolarHBondContact O-NH1 2.92Å; K298-V321 CarbonylContact C-O 3.56Å; K298-V321 VanDerWaalsContact CA-O 3.27Å; K298-V321 WeakPolarHBondContact CA-O 3.48Å; K298-V323 HydrophobicContact CB-CG2 4Å; K298-V323 HydrophobicContact CD-CG1 4.15Å; K298-V323 HydrophobicContact CD-CG2 3.75Å; K298-V323 HydrophobicContact CG-CG1 4.23Å; K298-V323 HydrophobicContact CG-CG2 4.14Å; K298-D327 WeakPolarHBondContact CD-OD1 3.28Å; K298-D327 IonicContact NZ-OD1 2.78Å; K298-D327 PolarHBondContact NZ-OD1 2.82Å; K298-D327 IonicContact NZ-OD2 2.82Å; K298-D327 PolarHBondContact NZ-OD2 2.96Å
299	C	93.9	Very high	79.3	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	161.2	157.8	58.5	0	0	0	0	110	E303 I308 L320 V321 L322 V323	C299-E303 WeakPolarHBondContact CA-OE2 3.43Å; C299-E303 VanDerWaalsContact CB-OE2 3.22Å; C299-E303 WeakPolarHBondContact CB-OE2 3.3Å; C299-I308 HydrophobicContact CB-CD1 4.1Å; C299-I308 HydrophobicContact CB-CG1 3.99Å; C299-L320 HydrophobicContact CB-CB 4.2Å; C299-L320 HydrophobicContact CB-CD1 3.94Å; C299-V321 PolarHBondContact N-O 2.83Å; C299-L322 WeakPolarHBondContact O-CA 3.3Å; C299-V323 PolarHBondContact O-N 2.7Å
300	Y	94.8	Very high	80	Confident	76 Å²	76	62.3 Å²	62.3	30%	0.298	33%	0.331	S	S	.	.			trans	-118.9	151.9	-178.9	-60.8	-81.9	0	0	0	111.6	I213 H302 E303 V323	I213-Y300 WeakPolarHBondContact CG2-O 3.32Å; Y300-H302 WeakPolarHBondContact CB-CE1 3.47Å; Y300-H302 AromaticContact CG-CE1 3.9Å; Y300-H302 PolarHBondContact O-N 3.5Å; Y300-E303 PolarHBondContact N-OE2 3.27Å; Y300-E303 WeakPolarHBondContact O-CB 3.45Å; Y300-E303 PolarHBondContact O-N 3.37Å; Y300-V323 HydrophobicContact CD1-CG2 3.87Å; Y300-V323 HydrophobicContact CE1-CG2 3.5Å; Y300-V323 VanDerWaalsContact CE1-CG2 3.5Å
301	P	92.6	Very high	81.8	Confident	39 Å²	39	60.7 Å²	60.7	25%	0.253	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-25.6	-174.9	-29.4	34.6	0	0	0	115.7	I213 N214 L322 V323	I213-P301 WeakPolarHBondContact CG2-O 3.48Å; N214-P301 HydrophobicContact CB-CB 4.18Å; N214-P301 PolarHBondContact N-O 3.24Å; N214-P301 PolarHBondContact ND2-O 3.3Å; N214-P301 PolarHBondContact OD1-O 2.82Å; P301-L322 HydrophobicContact CG-CD1 4.16Å; P301-V323 VanDerWaalsContact CD-O 3.26Å; P301-V323 WeakPolarHBondContact CD-O 3.36Å
302	H	92.8	Very high	83.7	Confident	119 Å²	119	57 Å²	57	55%	0.551	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-5.6	-177.3	61.9	-86.5	0	0	0	113.2	Y300	Y300-H302 WeakPolarHBondContact CB-CE1 3.47Å; Y300-H302 AromaticContact CG-CE1 3.9Å; Y300-H302 PolarHBondContact O-N 3.5Å
303	E	94.8	Very high	85.8	Confident	27 Å²	27	46.7 Å²	46.7	13%	0.126	25%	0.248	C	C	.	.	S	Bend	trans	-75.9	146.8	179.4	-64.6	-177.1	137	0	0	111.1	Q212 I213 C299 Y300 I308 R311	Q212-E303 WeakPolarHBondContact CA-O 3.42Å; I213-E303 PolarHBondContact N-O 3.48Å; C299-E303 WeakPolarHBondContact CA-OE2 3.43Å; C299-E303 VanDerWaalsContact CB-OE2 3.22Å; C299-E303 WeakPolarHBondContact CB-OE2 3.3Å; Y300-E303 PolarHBondContact N-OE2 3.27Å; Y300-E303 WeakPolarHBondContact O-CB 3.45Å; Y300-E303 PolarHBondContact O-N 3.37Å; E303-I308 HydrophobicContact CB-CG1 4.4Å; E303-R311 VanDerWaalsContact CD-NH1 3.35Å; E303-R311 IonicContact OE1-CZ 3.09Å; E303-R311 IonicContact OE1-NH1 2.65Å; E303-R311 PolarHBondContact OE1-NH1 3.46Å; E303-R311 IonicContact OE1-NH2 2.7Å; E303-R311 PolarHBondContact OE1-NH2 3.39Å; E303-R311 IonicContact OE2-CZ 2.7Å; E303-R311 IonicContact OE2-NH1 3.32Å; E303-R311 PolarHBondContact OE2-NH1 2.87Å; E303-R311 IonicContact OE2-NH2 2.85Å
304	T	93.9	Very high	87.6	Confident	29 Å²	29	49.4 Å²	49.4	18%	0.178	25%	0.252	C	S	.	.	B	Isolated β-bridge	trans	-76.2	153.6	177.8	63.1	0	0	0	0	111.3	Q210 K211 E306 T307 I308	Q210-T304 WeakPolarHBondContact O-CG2 3.33Å; K211-T304 WeakPolarHBondContact O-CA 3.42Å; T304-E306 PolarHBondContact O-N 2.77Å; T304-T307 PolarHBondContact O-N 3.15Å; T304-T307 VanDerWaalsContact O-N 3.17Å; T304-T307 PolarHBondContact OG1-N 2.76Å; T304-T307 PolarHBondContact OG1-OG1 2.92Å; T304-T307 VanDerWaalsContact OG1-OG1 3.06Å; T304-I308 PolarHBondContact O-N 2.9Å; T304-I308 VanDerWaalsContact O-N 3.15Å
305	L	91.5	Very high	89.7	Confident	1 Å²	1	42.8 Å²	42.8	1%	0.005	23%	0.228	C	C	.	.	H	α-helix	trans	-58.2	-36.9	174.8	-178.7	62.2	0	0	0	111.8	F208 L209 K211 I218 I308 I309 L342	F208-L305 HydrophobicContact CD2-CD2 4.21Å; F208-L305 HydrophobicContact CE2-CD2 4.29Å; L209-L305 HydrophobicContact CD2-CD2 4.13Å; L209-L305 HydrophobicContact CD2-CG 4.37Å; L209-L305 PolarHBondContact O-N 3.21Å; K211-L305 PolarHBondContact O-N 2.7Å; K211-L305 VanDerWaalsContact O-N 3.09Å; I218-L305 HydrophobicContact CD1-CD1 4.02Å; I218-L305 HydrophobicContact CD1-CD2 3.65Å; I218-L305 HydrophobicContact CD1-CG 4.48Å; L305-I308 PolarHBondContact O-N 3.35Å; L305-I309 HydrophobicContact CD1-CD1 4.04Å; L305-I309 HydrophobicContact CD1-CG1 4.19Å; L305-I309 HydrophobicContact CD2-CD1 4.34Å; L305-I309 HydrophobicContact CG-CD1 3.74Å; L305-I309 HydrophobicContact CG-CG1 4.32Å; L305-I309 VanDerWaalsContact O-CG1 3.28Å; L305-I309 WeakPolarHBondContact O-CG1 3.22Å; L305-I309 PolarHBondContact O-N 3.3Å; L305-L342 HydrophobicContact CD2-CD2 4.34Å
306	E	91.2	Very high	90.9	Very high	33 Å²	33	44.1 Å²	44.1	15%	0.154	22%	0.22	C	C	.	.	H	α-helix	trans	-56.6	-50.1	174.3	-173.6	171.6	-144.7	0	0	112.2	K205 L209 Q210 T304 I308 I309 D310	K205-E306 VanDerWaalsContact CD-OE1 3.31Å; K205-E306 WeakPolarHBondContact CD-OE1 3.17Å; K205-E306 VanDerWaalsContact CE-OE1 3.3Å; K205-E306 WeakPolarHBondContact CE-OE1 3.44Å; K205-E306 IonicContact NZ-OE1 3.67Å; K205-E306 PolarHBondContact NZ-OE1 3.05Å; L209-E306 HydrophobicContact CB-CB 4.18Å; L209-E306 PolarHBondContact O-N 3.01Å; Q210-E306 PolarHBondContact NE2-OE2 3.07Å; T304-E306 PolarHBondContact O-N 2.77Å; E306-I308 VanDerWaalsContact C-N 3.28Å; E306-I308 PolarHBondContact O-N 2.87Å; E306-I309 PolarHBondContact O-N 3.49Å; E306-D310 WeakPolarHBondContact O-CB 3.22Å; E306-D310 PolarHBondContact O-N 3.11Å
307	T	93.5	Very high	91.4	Very high	59 Å²	59	45.2 Å²	45.2	36%	0.362	23%	0.227	S	C	.	.	H	α-helix	trans	-63.4	-37.7	-178.7	-63	0	0	0	0	111.3	T304 R311	T304-T307 PolarHBondContact O-N 3.15Å; T304-T307 VanDerWaalsContact O-N 3.17Å; T304-T307 PolarHBondContact OG1-N 2.76Å; T304-T307 PolarHBondContact OG1-OG1 2.92Å; T304-T307 VanDerWaalsContact OG1-OG1 3.06Å; T307-R311 VanDerWaalsContact O-CB 3.28Å; T307-R311 WeakPolarHBondContact O-CB 3.36Å; T307-R311 PolarHBondContact O-N 3.41Å
308	I	92.9	Very high	91.4	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-65.9	-47.2	176.3	-72.7	174.2	0	0	0	111.4	I213 C299 E303 T304 L305 E306 R311 I312 L320 V333 I338	I213-I308 HydrophobicContact CB-CD1 3.56Å; I213-I308 HydrophobicContact CD1-CD1 3.85Å; I213-I308 HydrophobicContact CG1-CD1 3.64Å; I213-I308 HydrophobicContact CG2-CD1 4.03Å; C299-I308 HydrophobicContact CB-CD1 4.1Å; C299-I308 HydrophobicContact CB-CG1 3.99Å; E303-I308 HydrophobicContact CB-CG1 4.4Å; T304-I308 PolarHBondContact O-N 2.9Å; T304-I308 VanDerWaalsContact O-N 3.15Å; L305-I308 PolarHBondContact O-N 3.35Å; E306-I308 VanDerWaalsContact C-N 3.28Å; E306-I308 PolarHBondContact O-N 2.87Å; I308-R311 PolarHBondContact O-N 3.36Å; I308-I312 HydrophobicContact CG2-CD1 3.98Å; I308-I312 WeakPolarHBondContact O-CG1 3.4Å; I308-I312 PolarHBondContact O-N 2.83Å; I308-L320 HydrophobicContact CG2-CD1 4.14Å; I308-V333 HydrophobicContact CG2-CG1 4.11Å; I308-I338 HydrophobicContact CG2-CD1 4.4Å
309	I	90.9	Very high	91.5	Very high	15 Å²	15	43.4 Å²	43.4	8%	0.077	22%	0.217	C	C	.	.	H	α-helix	trans	-61.8	-47.2	178.8	-70.5	167.6	0	0	0	110.1	L193 L209 L305 E306 R311 I312 A313 I338 L342	L193-I309 HydrophobicContact CD1-CG2 4.32Å; L209-I309 HydrophobicContact CD2-CD1 4.03Å; L305-I309 HydrophobicContact CD1-CD1 4.04Å; L305-I309 HydrophobicContact CD1-CG1 4.19Å; L305-I309 HydrophobicContact CD2-CD1 4.34Å; L305-I309 HydrophobicContact CG-CD1 3.74Å; L305-I309 HydrophobicContact CG-CG1 4.32Å; L305-I309 VanDerWaalsContact O-CG1 3.28Å; L305-I309 WeakPolarHBondContact O-CG1 3.22Å; L305-I309 PolarHBondContact O-N 3.3Å; E306-I309 PolarHBondContact O-N 3.49Å; I309-R311 PolarHBondContact O-N 3.15Å; I309-I312 PolarHBondContact O-N 3.18Å; I309-A313 WeakPolarHBondContact O-CB 3.34Å; I309-A313 PolarHBondContact O-N 2.84Å; I309-I338 HydrophobicContact CD1-CG2 4.11Å; I309-I338 HydrophobicContact CG1-CD1 4.26Å; I309-I338 HydrophobicContact CG1-CG2 3.92Å; I309-L342 HydrophobicContact CD1-CD1 3.94Å; I309-L342 HydrophobicContact CD1-CD2 4.39Å
310	D	90.9	Very high	91.5	Very high	47 Å²	47	43.4 Å²	43.4	25%	0.251	22%	0.217	S	C	.	.	H	α-helix	trans	-61.5	-43	178.8	-80.7	1.3	0	0	0	111.6	H197 E306 A313 K314	H197-D310 IonicContact CE1-OD1 2.75Å; H197-D310 PolarHBondContact CE1-OD1 3.4Å; H197-D310 IonicContact ND1-OD1 2.71Å; H197-D310 PolarHBondContact ND1-OD1 2.81Å; E306-D310 WeakPolarHBondContact O-CB 3.22Å; E306-D310 PolarHBondContact O-N 3.11Å; D310-A313 PolarHBondContact O-N 3.4Å; D310-K314 VanDerWaalsContact O-CB 3.3Å; D310-K314 WeakPolarHBondContact O-CB 3.36Å; D310-K314 VanDerWaalsContact O-CG 3.26Å; D310-K314 WeakPolarHBondContact O-CG 3.44Å; D310-K314 PolarHBondContact O-N 3.32Å
311	R	92.1	Very high	91.5	Very high	67 Å²	67	39.8 Å²	39.8	25%	0.253	20%	0.202	S	C	.	.	H	α-helix	trans	-62.7	-44.3	176.9	-173.7	179.7	-59.6	138.1	8	111.6	K298 E303 T307 I308 I309 A315 L320	K298-R311 PolarHBondContact O-NH1 2.92Å; E303-R311 VanDerWaalsContact CD-NH1 3.35Å; E303-R311 IonicContact OE1-CZ 3.09Å; E303-R311 IonicContact OE1-NH1 2.65Å; E303-R311 PolarHBondContact OE1-NH1 3.46Å; E303-R311 IonicContact OE1-NH2 2.7Å; E303-R311 PolarHBondContact OE1-NH2 3.39Å; E303-R311 IonicContact OE2-CZ 2.7Å; E303-R311 IonicContact OE2-NH1 3.32Å; E303-R311 PolarHBondContact OE2-NH1 2.87Å; E303-R311 IonicContact OE2-NH2 2.85Å; T307-R311 VanDerWaalsContact O-CB 3.28Å; T307-R311 WeakPolarHBondContact O-CB 3.36Å; T307-R311 PolarHBondContact O-N 3.41Å; I308-R311 PolarHBondContact O-N 3.36Å; I309-R311 PolarHBondContact O-N 3.15Å; R311-A315 WeakPolarHBondContact O-CB 3.4Å; R311-A315 PolarHBondContact O-N 3.02Å; R311-L320 HydrophobicContact CB-CD1 4.28Å; R311-L320 HydrophobicContact CG-CD1 4.24Å; R311-L320 HydrophobicContact CG-CD2 4.37Å
312	I	91.5	Very high	91.6	Very high	2 Å²	2	38.3 Å²	38.3	1%	0.01	19%	0.193	C	C	.	.	H	α-helix	trans	-65.3	-42.9	178.8	-72.2	170.4	0	0	0	111.4	L193 I308 I309 E316 V317 L320 L335 I338	L193-I312 HydrophobicContact CD2-CG2 4Å; I308-I312 HydrophobicContact CG2-CD1 3.98Å; I308-I312 WeakPolarHBondContact O-CG1 3.4Å; I308-I312 PolarHBondContact O-N 2.83Å; I309-I312 PolarHBondContact O-N 3.18Å; I312-E316 PolarHBondContact O-N 3.46Å; I312-V317 HydrophobicContact CG1-CG2 4.47Å; I312-V317 HydrophobicContact CG2-CG2 4.5Å; I312-V317 WeakPolarHBondContact CG2-O 3.38Å; I312-V317 PolarHBondContact O-N 2.87Å; I312-L320 HydrophobicContact CD1-CD1 4.09Å; I312-L320 HydrophobicContact CD1-CG 3.89Å; I312-L320 HydrophobicContact CG1-CD1 3.72Å; I312-L320 HydrophobicContact CG1-CD2 4.11Å; I312-L320 HydrophobicContact CG1-CG 3.51Å; I312-L335 HydrophobicContact CG2-CD2 3.39Å; I312-L335 HydrophobicContact CG2-CG 4.15Å; I312-I338 HydrophobicContact CD1-CD1 3.45Å; I312-I338 VanDerWaalsContact CD1-CD1 3.45Å
313	A	88.2	Confident	91.8	Very high	14 Å²	14	32.7 Å²	32.7	12%	0.116	17%	0.166	C	C	.	.	H	α-helix	trans	-65.7	-49.6	-179.9	0	0	0	0	0	111.4	H197 I309 D310 E316	H197-A313 HydrophobicContact CB-CB 3.86Å; I309-A313 WeakPolarHBondContact O-CB 3.34Å; I309-A313 PolarHBondContact O-N 2.84Å; D310-A313 PolarHBondContact O-N 3.4Å; A313-E316 PolarHBondContact O-N 3Å
314	K	88	Confident	91.7	Very high	152 Å²	152	32.6 Å²	32.6	66%	0.661	17%	0.167	S	C	*	.	H	α-helix	trans	-66.1	-43.9	-180	-71.3	174.1	-180	174.2	0	113	D310 E316	D310-K314 VanDerWaalsContact O-CB 3.3Å; D310-K314 WeakPolarHBondContact O-CB 3.36Å; D310-K314 VanDerWaalsContact O-CG 3.26Å; D310-K314 WeakPolarHBondContact O-CG 3.44Å; D310-K314 PolarHBondContact O-N 3.32Å; K314-E316 PolarHBondContact O-N 2.81Å
315	A	87.6	Confident	91.6	Very high	39 Å²	39	43.2 Å²	43.2	32%	0.322	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-2	178.7	0	0	0	0	0	112.9	L297 R311 V317	L297-A315 HydrophobicContact CD1-CB 3.41Å; L297-A315 VanDerWaalsContact CD1-CB 3.41Å; R311-A315 WeakPolarHBondContact O-CB 3.4Å; R311-A315 PolarHBondContact O-N 3.02Å; A315-V317 HydrophobicContact CB-CG1 4.48Å; A315-V317 HydrophobicContact CB-CG2 4.34Å; A315-V317 WeakPolarHBondContact O-CG1 3.39Å; A315-V317 PolarHBondContact O-N 3.39Å; A315-V317 VanDerWaalsContact O-N 3.08Å
316	E	87.1	Confident	91.6	Very high	80 Å²	80	49.4 Å²	49.4	37%	0.374	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	60	26.8	170.8	-80	-136.2	160.5	0	0	114.7	K190 K194 I312 A313 K314	K190-E316 WeakPolarHBondContact CE-O 3.34Å; K190-E316 WeakPolarHBondContact CE-OE2 3.38Å; K190-E316 VanDerWaalsContact NZ-CB 3.34Å; K190-E316 PolarHBondContact NZ-O 2.84Å; K190-E316 IonicContact NZ-OE2 3.91Å; K190-E316 PolarHBondContact NZ-OE2 3.45Å; K194-E316 IonicContact NZ-OE1 3.14Å; K194-E316 PolarHBondContact NZ-OE1 3.22Å; I312-E316 PolarHBondContact O-N 3.46Å; A313-E316 PolarHBondContact O-N 3Å; K314-E316 PolarHBondContact O-N 2.81Å
317	V	88.9	Confident	91.7	Very high	42 Å²	42	50.1 Å²	50.1	26%	0.255	24%	0.238	S	C	.	.			trans	-99.2	168.7	-176.8	-66.3	0	0	0	0	113.1	L297 I312 A315 L320	L297-V317 HydrophobicContact CD1-CB 4.17Å; L297-V317 HydrophobicContact CD1-CG1 3.46Å; L297-V317 VanDerWaalsContact CD1-CG1 3.46Å; L297-V317 HydrophobicContact CD1-CG2 3.7Å; I312-V317 HydrophobicContact CG1-CG2 4.47Å; I312-V317 HydrophobicContact CG2-CG2 4.5Å; I312-V317 WeakPolarHBondContact CG2-O 3.38Å; I312-V317 PolarHBondContact O-N 2.87Å; A315-V317 HydrophobicContact CB-CG1 4.48Å; A315-V317 HydrophobicContact CB-CG2 4.34Å; A315-V317 WeakPolarHBondContact O-CG1 3.39Å; A315-V317 PolarHBondContact O-N 3.39Å; A315-V317 VanDerWaalsContact O-N 3.08Å; V317-L320 HydrophobicContact CG2-CD2 4.23Å
318	H	90.3	Very high	91.8	Very high	46 Å²	46	48.9 Å²	48.9	21%	0.213	23%	0.23	C	C	.	.	S	Bend	trans	-95.9	-11.2	-176.9	-76.2	-136.8	0	0	0	114.2	R90 L335	R90-H318 PolarHBondContact NH1-NE2 3.36Å; H318-L335 HydrophobicContact CB-CD1 4.29Å; H318-L335 PolarHBondContact O-N 2.91Å; H318-L335 VanDerWaalsContact O-N 3.08Å
319	R	93.7	Very high	91.8	Very high	24 Å²	24	49.9 Å²	49.9	9%	0.091	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-169.2	164	-178.1	66.8	-152.1	61.9	-149.4	-20.1	111.3	S246 L260 I332 V333	S246-R319 VanDerWaalsContact CB-NH2 3.29Å; S246-R319 PolarHBondContact OG-NH1 2.96Å; S246-R319 PolarHBondContact OG-NH2 3.09Å; L260-R319 HydrophobicContact CD2-CG 3.92Å; R319-I332 HydrophobicContact CB-CG2 4Å; R319-I332 HydrophobicContact CG-CG2 4.27Å; R319-V333 CarbonylContact C-O 3.54Å; R319-V333 WeakPolarHBondContact CA-O 3.22Å; R319-V333 VanDerWaalsContact CB-O 3.25Å; R319-V333 WeakPolarHBondContact CB-O 3.49Å
320	L	94.5	Very high	92	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	150.5	163.4	-59.9	177.8	0	0	0	109.9	L297 C299 I308 R311 I312 V317 V333	L297-L320 HydrophobicContact CB-CD2 3.44Å; L297-L320 VanDerWaalsContact CB-CD2 3.44Å; L297-L320 HydrophobicContact CD1-CD2 4.49Å; C299-L320 HydrophobicContact CB-CB 4.2Å; C299-L320 HydrophobicContact CB-CD1 3.94Å; I308-L320 HydrophobicContact CG2-CD1 4.14Å; R311-L320 HydrophobicContact CB-CD1 4.28Å; R311-L320 HydrophobicContact CG-CD1 4.24Å; R311-L320 HydrophobicContact CG-CD2 4.37Å; I312-L320 HydrophobicContact CD1-CD1 4.09Å; I312-L320 HydrophobicContact CD1-CG 3.89Å; I312-L320 HydrophobicContact CG1-CD1 3.72Å; I312-L320 HydrophobicContact CG1-CD2 4.11Å; I312-L320 HydrophobicContact CG1-CG 3.51Å; V317-L320 HydrophobicContact CG2-CD2 4.23Å; L320-V333 PolarHBondContact N-O 2.91Å; L320-V333 PolarHBondContact O-N 3.3Å
321	V	95.2	Very high	92.2	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	120.5	171.5	-174.9	0	0	0	0	108.2	P249 V257 L260 V296 L297 K298 C299 V323 V329	P249-V321 HydrophobicContact CB-CG1 4.44Å; P249-V321 HydrophobicContact CG-CG1 4.31Å; P249-V321 HydrophobicContact CG-CG2 4.29Å; V257-V321 HydrophobicContact CG2-CG1 4.34Å; L260-V321 HydrophobicContact CD1-CG2 3.9Å; V296-V321 HydrophobicContact CG1-CB 4.13Å; V296-V321 HydrophobicContact CG1-CG2 3.7Å; L297-V321 PolarHBondContact O-N 3.01Å; K298-V321 CarbonylContact C-O 3.56Å; K298-V321 VanDerWaalsContact CA-O 3.27Å; K298-V321 WeakPolarHBondContact CA-O 3.48Å; C299-V321 PolarHBondContact N-O 2.83Å; V321-V323 HydrophobicContact CG1-CG1 3.99Å; V321-V323 PolarHBondContact O-N 3.46Å; V321-V329 HydrophobicContact CG1-CG1 3.97Å; V321-V329 HydrophobicContact CG1-CG2 4.04Å
322	L	94.9	Very high	92.3	Very high	9 Å²	9	51.3 Å²	51.3	5%	0.047	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	122.3	172.8	-177.4	74.9	0	0	0	108.4	I213 F221 C299 P301 R330 G331	I213-L322 HydrophobicContact CG2-CD1 3.92Å; F221-L322 HydrophobicContact CD1-CD2 3.68Å; F221-L322 HydrophobicContact CE1-CD2 3.5Å; F221-L322 VanDerWaalsContact CE1-CD2 3.5Å; C299-L322 WeakPolarHBondContact O-CA 3.3Å; P301-L322 HydrophobicContact CG-CD1 4.16Å; L322-R330 HydrophobicContact CD2-CB 4.16Å; L322-R330 HydrophobicContact CG-CB 4.31Å; L322-R330 PolarHBondContact O-N 3.29Å; L322-G331 PolarHBondContact N-O 3.2Å; L322-G331 PolarHBondContact O-N 3.22Å; L322-G331 VanDerWaalsContact O-N 3.17Å
323	V	95.1	Very high	92.5	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	159.3	179.3	-60.1	0	0	0	0	111.7	V257 K298 C299 Y300 P301 V321 V328	V257-V323 HydrophobicContact CG1-CG1 3.63Å; K298-V323 HydrophobicContact CB-CG2 4Å; K298-V323 HydrophobicContact CD-CG1 4.15Å; K298-V323 HydrophobicContact CD-CG2 3.75Å; K298-V323 HydrophobicContact CG-CG1 4.23Å; K298-V323 HydrophobicContact CG-CG2 4.14Å; C299-V323 PolarHBondContact O-N 2.7Å; Y300-V323 HydrophobicContact CD1-CG2 3.87Å; Y300-V323 HydrophobicContact CE1-CG2 3.5Å; Y300-V323 VanDerWaalsContact CE1-CG2 3.5Å; P301-V323 VanDerWaalsContact CD-O 3.26Å; P301-V323 WeakPolarHBondContact CD-O 3.36Å; V321-V323 HydrophobicContact CG1-CG1 3.99Å; V321-V323 PolarHBondContact O-N 3.46Å; V323-V328 VanDerWaalsContact CA-O 3.26Å; V323-V328 WeakPolarHBondContact CA-O 3.34Å
324	D	93.1	Very high	92.7	Very high	26 Å²	26	51.2 Å²	51.2	14%	0.139	24%	0.237	C	C	.	.			trans	-87.6	-169.5	167.7	65	21.9	0	0	0	112.5	E326 D327 V328 R330	D324-E326 PolarHBondContact O-N 3.05Å; D324-E326 WeakPolarHBondContact OD1-CA 3.4Å; D324-E326 PolarHBondContact OD1-N 3.19Å; D324-D327 PolarHBondContact O-N 3.15Å; D324-D327 PolarHBondContact OD1-N 3.05Å; D324-V328 PolarHBondContact N-O 3.47Å; D324-V328 VanDerWaalsContact N-O 3.1Å; D324-V328 PolarHBondContact OD1-N 3.33Å; D324-R330 HydrophobicContact CB-CG 4.07Å; D324-R330 IonicContact OD2-CZ 2.82Å; D324-R330 IonicContact OD2-NE 3.2Å; D324-R330 PolarHBondContact OD2-NE 3.01Å; D324-R330 IonicContact OD2-NH2 2.79Å; D324-R330 PolarHBondContact OD2-NH2 3.07Å
325	R	91.6	Very high	93	Very high	252 Å²	252	44.2 Å²	44.2	95%	0.951	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-17.9	179.9	-62.8	-176.3	-179.5	-168.3	-0.3	113.4
326	E	93	Very high	93.3	Very high	131 Å²	131	43.7 Å²	43.7	61%	0.612	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.7	9.3	179.7	-62.4	-175.9	-175.1	0	0	112.2	K256 D324 V328	K256-E326 WeakPolarHBondContact CD-O 3.49Å; K256-E326 WeakPolarHBondContact CE-O 3.41Å; K256-E326 WeakPolarHBondContact CG-O 3.29Å; D324-E326 PolarHBondContact O-N 3.05Å; D324-E326 WeakPolarHBondContact OD1-CA 3.4Å; D324-E326 PolarHBondContact OD1-N 3.19Å; E326-V328 HydrophobicContact CB-CG2 4.23Å; E326-V328 PolarHBondContact O-N 3.46Å
327	D	92.6	Very high	93.6	Very high	48 Å²	48	41.8 Å²	41.8	26%	0.257	19%	0.193	S	C	.	.			trans	63.8	19.5	-174.1	-78.1	-36.5	0	0	0	114.6	K256 V257 K298 D324	K256-D327 CarbonylContact C-O 3.59Å; K256-D327 WeakPolarHBondContact CA-O 3.43Å; K256-D327 HydrophobicContact CB-CB 4.42Å; V257-D327 PolarHBondContact N-O 3.38Å; K298-D327 WeakPolarHBondContact CD-OD1 3.28Å; K298-D327 IonicContact NZ-OD1 2.78Å; K298-D327 PolarHBondContact NZ-OD1 2.82Å; K298-D327 IonicContact NZ-OD2 2.82Å; K298-D327 PolarHBondContact NZ-OD2 2.96Å; D324-D327 PolarHBondContact O-N 3.15Å; D324-D327 PolarHBondContact OD1-N 3.05Å
328	V	94.9	Very high	93.7	Very high	32 Å²	32	39.8 Å²	39.8	19%	0.194	18%	0.181	C	C	.	.	B	Isolated β-bridge	trans	-78.5	136.2	175	179.2	0	0	0	0	109.8	K256 V323 D324 E326 R330	K256-V328 HydrophobicContact CG-CG2 4.28Å; V323-V328 VanDerWaalsContact CA-O 3.26Å; V323-V328 WeakPolarHBondContact CA-O 3.34Å; D324-V328 PolarHBondContact N-O 3.47Å; D324-V328 VanDerWaalsContact N-O 3.1Å; D324-V328 PolarHBondContact OD1-N 3.33Å; E326-V328 HydrophobicContact CB-CG2 4.23Å; E326-V328 PolarHBondContact O-N 3.46Å; V328-R330 PolarHBondContact O-N 3.32Å
329	V	94.6	Very high	93.8	Very high	21 Å²	21	37.6 Å²	37.6	13%	0.127	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	121.7	-178.2	-178.2	0	0	0	0	110.6	I224 T226 P249 V251 V257 V321	I224-V329 HydrophobicContact CG2-CG1 4.02Å; T226-V329 HydrophobicContact CG2-CB 4.45Å; T226-V329 HydrophobicContact CG2-CG1 4.3Å; P249-V329 HydrophobicContact CB-CG1 4.42Å; P249-V329 HydrophobicContact CB-CG2 3.88Å; P249-V329 HydrophobicContact CG-CG1 4.22Å; V251-V329 HydrophobicContact CG1-CG2 3.8Å; V257-V329 HydrophobicContact CB-CG2 3.76Å; V257-V329 HydrophobicContact CG2-CG2 4.16Å; V321-V329 HydrophobicContact CG1-CG1 3.97Å; V321-V329 HydrophobicContact CG1-CG2 4.04Å
330	R	94.3	Very high	93.7	Very high	137 Å²	137	40 Å²	40	52%	0.517	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	-20.3	175.1	-60.8	-57.3	-176.8	164.5	-2.8	113.1	L322 D324 V328	L322-R330 HydrophobicContact CD2-CB 4.16Å; L322-R330 HydrophobicContact CG-CB 4.31Å; L322-R330 PolarHBondContact O-N 3.29Å; D324-R330 HydrophobicContact CB-CG 4.07Å; D324-R330 IonicContact OD2-CZ 2.82Å; D324-R330 IonicContact OD2-NE 3.2Å; D324-R330 PolarHBondContact OD2-NE 3.01Å; D324-R330 IonicContact OD2-NH2 2.79Å; D324-R330 PolarHBondContact OD2-NH2 3.07Å; V328-R330 PolarHBondContact O-N 3.32Å
331	G	93.9	Very high	93.4	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	179.9	-178.4	179.9	0	0	0	0	0	114.4	T220 L322	T220-G331 CarbonylContact O-C 3.59Å; T220-G331 WeakPolarHBondContact O-CA 3.1Å; L322-G331 PolarHBondContact N-O 3.2Å; L322-G331 PolarHBondContact O-N 3.22Å; L322-G331 VanDerWaalsContact O-N 3.17Å
332	I	95	Very high	92.9	Very high	22 Å²	22	41.3 Å²	41.3	11%	0.113	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	130.7	174.1	-61.5	177.1	0	0	0	108.1	G219 T220 I224 P249 R319	G219-I332 WeakPolarHBondContact CA-O 3.46Å; T220-I332 PolarHBondContact N-O 3.15Å; T220-I332 PolarHBondContact O-N 3.42Å; I224-I332 HydrophobicContact CG2-CD1 3.84Å; I224-I332 HydrophobicContact CG2-CG1 4.01Å; P249-I332 HydrophobicContact CG-CD1 3.8Å; P249-I332 HydrophobicContact CG-CG1 4.23Å; R319-I332 HydrophobicContact CB-CG2 4Å; R319-I332 HydrophobicContact CG-CG2 4.27Å
333	V	95.2	Very high	92.3	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	110.6	172.4	-176.2	0	0	0	0	107.9	I213 I308 R319 L320 I338	I213-V333 HydrophobicContact CD1-CG1 4.49Å; I213-V333 HydrophobicContact CD1-CG2 4.05Å; I213-V333 HydrophobicContact CG1-CG2 4.04Å; I308-V333 HydrophobicContact CG2-CG1 4.11Å; R319-V333 CarbonylContact C-O 3.54Å; R319-V333 WeakPolarHBondContact CA-O 3.22Å; R319-V333 VanDerWaalsContact CB-O 3.25Å; R319-V333 WeakPolarHBondContact CB-O 3.49Å; L320-V333 PolarHBondContact N-O 2.91Å; L320-V333 PolarHBondContact O-N 3.3Å; V333-I338 HydrophobicContact CG1-CD1 4.12Å; V333-I338 HydrophobicContact CG1-CG1 4.08Å
334	S	94	Very high	91.5	Very high	15 Å²	15	41.3 Å²	41.3	11%	0.105	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	160.8	-178.7	78.8	0	0	0	0	112.9	S336 D337 I338	S334-S336 PolarHBondContact O-N 3.17Å; S334-S336 PolarHBondContact OG-N 3.1Å; S334-D337 WeakPolarHBondContact CA-OD2 3.39Å; S334-D337 VanDerWaalsContact CB-OD2 3.26Å; S334-D337 WeakPolarHBondContact CB-OD2 3.42Å; S334-D337 PolarHBondContact N-OD2 2.6Å; S334-D337 WeakPolarHBondContact O-CB 3.43Å; S334-D337 PolarHBondContact O-N 3.02Å; S334-D337 VanDerWaalsContact O-N 3.11Å; S334-D337 PolarHBondContact OG-N 3.26Å; S334-D337 PolarHBondContact OG-OD2 3.25Å; S334-I338 PolarHBondContact O-N 2.94Å; S334-I338 VanDerWaalsContact O-N 3.11Å
335	L	93.5	Very high	90.8	Very high	5 Å²	5	43.9 Å²	43.9	3%	0.026	21%	0.21	C	C	.	.	H	α-helix	trans	-54.3	-35.4	171.5	-72.3	175.9	0	0	0	113.2	H189 K190 L193 I312 H318 I338 L339	H189-L335 HydrophobicContact CB-CB 3.9Å; H189-L335 HydrophobicContact CB-CD1 4.18Å; K190-L335 HydrophobicContact CB-CD1 3.82Å; L193-L335 HydrophobicContact CB-CD2 4.01Å; L193-L335 HydrophobicContact CD2-CD2 3.15Å; L193-L335 HydrophobicContact CG-CD2 4.16Å; I312-L335 HydrophobicContact CG2-CD2 3.39Å; I312-L335 HydrophobicContact CG2-CG 4.15Å; H318-L335 HydrophobicContact CB-CD1 4.29Å; H318-L335 PolarHBondContact O-N 2.91Å; H318-L335 VanDerWaalsContact O-N 3.08Å; L335-I338 PolarHBondContact O-N 2.96Å; L335-L339 WeakPolarHBondContact O-CB 3.27Å; L335-L339 WeakPolarHBondContact O-CG 3.49Å; L335-L339 PolarHBondContact O-N 3.01Å
336	S	92.9	Very high	89.5	Confident	28 Å²	28	32.4 Å²	32.4	20%	0.196	17%	0.168	C	C	.	.	H	α-helix	trans	-68.4	-39.2	179.1	-63.3	0	0	0	0	111.2	H189 S334 Q340	H189-S336 PolarHBondContact CD2-OG 2.87Å; H189-S336 PolarHBondContact CE1-OG 2.81Å; H189-S336 PolarHBondContact NE2-OG 2.91Å; H189-S336 VanDerWaalsContact NE2-OG 3.11Å; S334-S336 PolarHBondContact O-N 3.17Å; S334-S336 PolarHBondContact OG-N 3.1Å; S336-Q340 WeakPolarHBondContact O-CB 3.37Å; S336-Q340 PolarHBondContact O-N 3.49Å
337	D	93.3	Very high	87.5	Confident	40 Å²	40	26.8 Å²	26.8	21%	0.214	14%	0.144	C	C	.	.	H	α-helix	trans	-64.3	-43.6	176	-53.7	-49.8	0	0	0	111	I218 S334 Q340 A341	I218-D337 HydrophobicContact CG2-CB 4.16Å; S334-D337 WeakPolarHBondContact CA-OD2 3.39Å; S334-D337 VanDerWaalsContact CB-OD2 3.26Å; S334-D337 WeakPolarHBondContact CB-OD2 3.42Å; S334-D337 PolarHBondContact N-OD2 2.6Å; S334-D337 WeakPolarHBondContact O-CB 3.43Å; S334-D337 PolarHBondContact O-N 3.02Å; S334-D337 VanDerWaalsContact O-N 3.11Å; S334-D337 PolarHBondContact OG-N 3.26Å; S334-D337 PolarHBondContact OG-OD2 3.25Å; D337-Q340 PolarHBondContact O-N 2.79Å; D337-A341 WeakPolarHBondContact O-CB 3.35Å; D337-A341 PolarHBondContact O-N 3.41Å
338	I	92.4	Very high	85.3	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-62.5	-51.7	177.8	-67.4	169.4	0	0	0	110.4	L193 I218 I308 I309 I312 V333 S334 L335 Q340 A341 L342	L193-I338 HydrophobicContact CD1-CG2 4.08Å; I218-I338 HydrophobicContact CG2-CG1 4.33Å; I308-I338 HydrophobicContact CG2-CD1 4.4Å; I309-I338 HydrophobicContact CD1-CG2 4.11Å; I309-I338 HydrophobicContact CG1-CD1 4.26Å; I309-I338 HydrophobicContact CG1-CG2 3.92Å; I312-I338 HydrophobicContact CD1-CD1 3.45Å; I312-I338 VanDerWaalsContact CD1-CD1 3.45Å; V333-I338 HydrophobicContact CG1-CD1 4.12Å; V333-I338 HydrophobicContact CG1-CG1 4.08Å; S334-I338 PolarHBondContact O-N 2.94Å; S334-I338 VanDerWaalsContact O-N 3.11Å; L335-I338 PolarHBondContact O-N 2.96Å; I338-Q340 VanDerWaalsContact C-N 3.33Å; I338-Q340 PolarHBondContact O-N 3.29Å; I338-A341 PolarHBondContact O-N 2.96Å; I338-L342 HydrophobicContact CG2-CD1 3.59Å; I338-L342 HydrophobicContact CG2-CG 4.1Å; I338-L342 WeakPolarHBondContact O-CB 3.22Å; I338-L342 VanDerWaalsContact O-CG 3.26Å; I338-L342 WeakPolarHBondContact O-CG 3.27Å; I338-L342 PolarHBondContact O-N 2.96Å
339	L	91.8	Very high	82.8	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-65.5	-36.1	-179	-71.7	170	0	0	0	112.3	I162 H189 I192 L193 L335 V343	I162-L339 HydrophobicContact CD1-CD2 4.2Å; I162-L339 HydrophobicContact CG2-CB 4.21Å; H189-L339 HydrophobicContact CB-CD1 3.83Å; I192-L339 HydrophobicContact CB-CD1 4.48Å; I192-L339 HydrophobicContact CG2-CD1 4.36Å; I192-L339 HydrophobicContact CG2-CD2 3.99Å; L193-L339 HydrophobicContact CD1-CD2 4.33Å; L335-L339 WeakPolarHBondContact O-CB 3.27Å; L335-L339 WeakPolarHBondContact O-CG 3.49Å; L335-L339 PolarHBondContact O-N 3.01Å; L339-V343 WeakPolarHBondContact O-CB 3.44Å; L339-V343 PolarHBondContact O-N 2.87Å; L339-V343 VanDerWaalsContact O-N 3.09Å
340	Q	91.1	Very high	80.1	Confident	75 Å²	75	33.4 Å²	33.4	35%	0.35	19%	0.192	S	C	.	.	I	π-helix	trans	-58.4	-49.1	172	179.6	75.1	36.5	0	0	110.6	L166 S336 D337 I338 L344 T345	L166-Q340 HydrophobicContact CD1-CB 4Å; S336-Q340 WeakPolarHBondContact O-CB 3.37Å; S336-Q340 PolarHBondContact O-N 3.49Å; D337-Q340 PolarHBondContact O-N 2.79Å; I338-Q340 VanDerWaalsContact C-N 3.33Å; I338-Q340 PolarHBondContact O-N 3.29Å; Q340-L344 PolarHBondContact O-N 3.27Å; Q340-T345 PolarHBondContact O-N 3.37Å; Q340-T345 PolarHBondContact O-OG1 2.82Å
341	A	88.1	Confident	77	Confident	23 Å²	23	33 Å²	33	19%	0.19	20%	0.199	C	C	.	.	I	π-helix	trans	-69	-44.4	-177.1	0	0	0	0	0	113.2	I218 D337 I338 P346	I218-A341 HydrophobicContact CD1-CB 3.52Å; I218-A341 HydrophobicContact CG1-CB 3.62Å; I218-A341 HydrophobicContact CG2-CB 4.26Å; D337-A341 WeakPolarHBondContact O-CB 3.35Å; D337-A341 PolarHBondContact O-N 3.41Å; I338-A341 PolarHBondContact O-N 2.96Å; A341-P346 WeakPolarHBondContact O-CD 3.26Å
342	L	85.6	Confident	73.8	Confident	3 Å²	3	38.4 Å²	38.4	2%	0.016	24%	0.235	C	C	.	.	I	π-helix	trans	-71.8	-32	-177.1	-65.4	-178.8	0	0	0	113	Y49 L196 F208 L209 L305 I309 I338	Y49-L342 WeakPolarHBondContact CB-O 3.26Å; Y49-L342 HydrophobicContact CD2-CB 4.34Å; Y49-L342 HydrophobicContact CD2-CD2 3.95Å; Y49-L342 HydrophobicContact CE2-CD2 4.01Å; L196-L342 HydrophobicContact CD2-CD1 3.89Å; F208-L342 HydrophobicContact CE2-CD2 3.53Å; F208-L342 HydrophobicContact CZ-CD2 3.94Å; L209-L342 HydrophobicContact CD2-CD2 4.3Å; L305-L342 HydrophobicContact CD2-CD2 4.34Å; I309-L342 HydrophobicContact CD1-CD1 3.94Å; I309-L342 HydrophobicContact CD1-CD2 4.39Å; I338-L342 HydrophobicContact CG2-CD1 3.59Å; I338-L342 HydrophobicContact CG2-CG 4.1Å; I338-L342 WeakPolarHBondContact O-CB 3.22Å; I338-L342 VanDerWaalsContact O-CG 3.26Å; I338-L342 WeakPolarHBondContact O-CG 3.27Å; I338-L342 PolarHBondContact O-N 2.96Å
343	V	83.1	Confident	70.5	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	26%	0.261	C	S	.	.	I	π-helix	trans	-118.2	-43.7	-165.8	-175	0	0	0	0	113	M53 F159 I162 L339	M53-V343 HydrophobicContact CB-CG1 4.18Å; M53-V343 HydrophobicContact CG-CG1 4.27Å; M53-V343 HydrophobicContact CG-CG2 3.96Å; F159-V343 HydrophobicContact CD2-CG1 3.48Å; F159-V343 VanDerWaalsContact CD2-CG1 3.48Å; F159-V343 HydrophobicContact CE2-CG1 3.98Å; F159-V343 HydrophobicContact CG-CG1 4.46Å; I162-V343 HydrophobicContact CD1-CB 4.21Å; I162-V343 HydrophobicContact CD1-CG1 3.95Å; I162-V343 HydrophobicContact CD1-CG2 3.88Å; I162-V343 HydrophobicContact CG2-CB 4.44Å; I162-V343 HydrophobicContact CG2-CG1 4.48Å; L339-V343 WeakPolarHBondContact O-CB 3.44Å; L339-V343 PolarHBondContact O-N 2.87Å; L339-V343 VanDerWaalsContact O-N 3.09Å
344	L	78.1	Confident	67.4	Low	10 Å²	10	47.4 Å²	47.4	5%	0.052	30%	0.297	C	S	.	.	I	π-helix	trans	-95	-38.8	-171.4	-62.8	-170.8	0	0	0	114.1	F159 I162 Y163 L166 Q340 A347 V348	F159-L344 HydrophobicContact CD2-CD2 4.43Å; F159-L344 HydrophobicContact CE2-CD2 3.76Å; F159-L344 HydrophobicContact CZ-CD2 3.86Å; I162-L344 HydrophobicContact CG2-CD1 4.44Å; I162-L344 HydrophobicContact CG2-CD2 4.46Å; I162-L344 HydrophobicContact CG2-CG 4.22Å; Y163-L344 HydrophobicContact CD2-CD1 4.3Å; Y163-L344 HydrophobicContact CD2-CD2 4.31Å; L166-L344 HydrophobicContact CB-CD1 4.13Å; L166-L344 HydrophobicContact CD1-CD1 3.48Å; L166-L344 VanDerWaalsContact CD1-CD1 3.48Å; L166-L344 HydrophobicContact CD1-CG 4.21Å; L166-L344 HydrophobicContact CG-CD1 4.4Å; Q340-L344 PolarHBondContact O-N 3.27Å; L344-A347 WeakPolarHBondContact O-CA 3.32Å; L344-A347 WeakPolarHBondContact O-CB 3.34Å; L344-A347 PolarHBondContact O-N 2.59Å; L344-V348 PolarHBondContact O-N 2.97Å; L344-V348 VanDerWaalsContact O-N 3.1Å
345	T	77.6	Confident	64.2	Low	79 Å²	79	56.2 Å²	56.2	49%	0.485	33%	0.333	S	S	.	.	H	α-helix	trans	-56.5	-42.7	179.3	-57	0	0	0	0	112.9	Q340 A347 V348 S349	Q340-T345 PolarHBondContact O-N 3.37Å; Q340-T345 PolarHBondContact O-OG1 2.82Å; T345-A347 VanDerWaalsContact C-N 3.3Å; T345-A347 PolarHBondContact O-N 2.93Å; T345-V348 PolarHBondContact O-N 2.96Å; T345-S349 PolarHBondContact O-N 3.34Å
346	P	64.9	Low	61.1	Low	11 Å²	11	61.9 Å²	61.9	7%	0.071	37%	0.368	C	S	.	.	H	α-helix	trans	-54.1	-42.6	169.1	-30.9	39.3	0	0	0	113.6	T46 Y47 A341 V348 S349	T46-P346 HydrophobicContact CG2-CB 3.91Å; T46-P346 HydrophobicContact CG2-CG 3.98Å; T46-P346 WeakPolarHBondContact O-CB 3.44Å; T46-P346 WeakPolarHBondContact O-CG 3.3Å; Y47-P346 HydrophobicContact CD1-CB 3.74Å; Y47-P346 HydrophobicContact CE1-CB 3.84Å; Y47-P346 WeakPolarHBondContact CE1-O 3.41Å; A341-P346 WeakPolarHBondContact O-CD 3.26Å; P346-V348 PolarHBondContact O-N 3.1Å; P346-S349 PolarHBondContact O-N 2.57Å; P346-S349 PolarHBondContact O-OG 3.28Å
347	A	51.4	Low	58	Low	14 Å²	14	65.4 Å²	65.4	12%	0.116	39%	0.39	C	S	.	.	H	α-helix	trans	-67.9	-37.2	-177.2	0	0	0	0	0	112.9	M50 F159 L344 T345 S349 S350	M50-A347 HydrophobicContact SD-CB 3.82Å; F159-A347 HydrophobicContact CE2-CB 4.02Å; F159-A347 HydrophobicContact CZ-CB 3.88Å; L344-A347 WeakPolarHBondContact O-CA 3.32Å; L344-A347 WeakPolarHBondContact O-CB 3.34Å; L344-A347 PolarHBondContact O-N 2.59Å; T345-A347 VanDerWaalsContact C-N 3.3Å; T345-A347 PolarHBondContact O-N 2.93Å; A347-S349 VanDerWaalsContact C-N 3.35Å; A347-S349 PolarHBondContact O-N 2.82Å; A347-S350 PolarHBondContact O-N 3.38Å; A347-S350 PolarHBondContact O-OG 2.8Å
348	V	45.8	Very low	55	Low	98 Å²	98	68.3 Å²	68.3	59%	0.594	42%	0.419	S	S	*	.	H	α-helix	trans	-69.5	-32.8	179.7	-177.2	0	0	0	0	111.7	L344 T345 P346 S350 L351	L344-V348 PolarHBondContact O-N 2.97Å; L344-V348 VanDerWaalsContact O-N 3.1Å; T345-V348 PolarHBondContact O-N 2.96Å; P346-V348 PolarHBondContact O-N 3.1Å; V348-S350 PolarHBondContact O-N 2.77Å; V348-L351 PolarHBondContact O-N 2.83Å
349	S	43	Very low	52.3	Low	81 Å²	81	72.8 Å²	72.8	57%	0.566	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-14.8	174.9	70.1	0	0	0	0	114.4	T345 P346 A347	T345-S349 PolarHBondContact O-N 3.34Å; P346-S349 PolarHBondContact O-N 2.57Å; P346-S349 PolarHBondContact O-OG 3.28Å; A347-S349 VanDerWaalsContact C-N 3.35Å; A347-S349 PolarHBondContact O-N 2.82Å
350	S	36.7	Very low	49.5	Very low	60 Å²	60	79.9 Å²	79.9	42%	0.42	49%	0.487	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.1	-4.2	-178.5	69.7	0	0	0	0	114.8	A347 V348	A347-S350 PolarHBondContact O-N 3.38Å; A347-S350 PolarHBondContact O-OG 2.8Å; V348-S350 PolarHBondContact O-N 2.77Å
351	L	29.5	Very low	46.5	Very low	128 Å²	128	82 Å²	82	67%	0.67	51%	0.511	S	S	*	.	S	Bend	trans	-90.2	124.2	176.2	-79.8	146.9	0	0	0	109.3	V348 S353	V348-L351 PolarHBondContact O-N 2.83Å; L351-S353 PolarHBondContact O-N 3.44Å
352	P	27	Very low	43.8	Very low	115 Å²	115	89.5 Å²	89.5	75%	0.747	54%	0.542	S	S	*	.			trans	-58.8	128.5	167.7	23.4	-29	0	0	0	107.8
353	S	26.5	Very low	41.3	Very low	94 Å²	94	95.6 Å²	95.6	66%	0.657	57%	0.573	S	S	*	*			trans	-42.9	136.5	172.2	53.1	0	0	0	0	109.6	L351 K355	L351-S353 PolarHBondContact O-N 3.44Å; S353-K355 PolarHBondContact O-N 3Å
354	P	28.7	Very low	38.6	Very low	117 Å²	117	105.2 Å²	105.2	76%	0.76	62%	0.615	S	S	*	*			trans	-53.6	116.3	168.6	-16.3	26.9	0	0	0	107.2	V356	P354-V356 PolarHBondContact O-N 3.38Å
355	K	27.5	Very low	36.3	Very low	199 Å²	199	111.3 Å²	111.3	87%	0.865	65%	0.653	S	S	*	*			trans	-62.5	96.7	166.7	-72.9	-177.9	178.6	-179.9	0	105.4	S353 P357	S353-K355 PolarHBondContact O-N 3Å; K355-P357 VanDerWaalsContact O-CD 3.25Å; K355-P357 WeakPolarHBondContact O-CD 3.25Å
356	V	28.9	Very low	33.9	Very low	124 Å²	124	113.3 Å²	113.3	75%	0.752	67%	0.67	S	S	*	*			trans	-59	118.2	164.7	-177.7	0	0	0	0	104.9	P354 A358	P354-V356 PolarHBondContact O-N 3.38Å; V356-A358 PolarHBondContact O-N 2.81Å
357	P	27.8	Very low	32.1	Very low	103 Å²	103	116.7 Å²	116.7	67%	0.669	71%	0.707	S	S	*	*			trans	-56.9	128.1	171.6	-18.5	30.8	0	0	0	107.5	K355 S359	K355-P357 VanDerWaalsContact O-CD 3.25Å; K355-P357 WeakPolarHBondContact O-CD 3.25Å; P357-S359 PolarHBondContact O-N 3.2Å
358	A	30.6	Very low	30.9	Very low	100 Å²	100	124.7 Å²	124.7	83%	0.826	74%	0.742	S	S	*	*	S	Bend	trans	-68.1	72.3	174.8	0	0	0	0	0	109.5	V356	V356-A358 PolarHBondContact O-N 2.81Å
359	S	35.3	Very low	30	Very low	95 Å²	95	125.8 Å²	125.8	66%	0.664	75%	0.751	S	S	*	*			trans	-171.3	73.5	173.8	-71.3	0	0	0	0	107.5	P357	P357-S359 PolarHBondContact O-N 3.2Å
360	I	32.5	Very low	29.1	Very low	148 Å²	148	132 Å²	132	76%	0.759	77%	0.768	S	S	*	*			trans	-172.6	23.1	155	-86.9	145.5	0	0	0	109.7	Q362	I360-Q362 PolarHBondContact O-N 2.73Å
361	S	27.5	Very low	28.6	Very low	121 Å²	121	138.2 Å²	138.2	85%	0.846	79%	0.788	S	S	*	*			trans	-78	27.7	175.3	51.1	0	0	0	0	114.1
362	Q	31.8	Very low	28.3	Very low	180 Å²	180	137.8 Å²	137.8	84%	0.841	80%	0.795	S	S	*	*	S	Bend	trans	-145.3	53.4	178	-71.4	-167.5	-27.2	0	0	113.1	I360	I360-Q362 PolarHBondContact O-N 2.73Å
363	I	32.6	Very low	28.3	Very low	131 Å²	131	141.6 Å²	141.6	67%	0.672	80%	0.803	S	S	*	*	S	Bend	trans	-135.4	-14.2	163.2	-61.3	-175	0	0	0	114.4
364	F	27.3	Very low	28.4	Very low	201 Å²	201	145.8 Å²	145.8	88%	0.882	81%	0.812	S	S	*	*			trans	-120.7	72.4	-179.8	-76.2	-81.6	0	0	0	113.5
365	T	28.8	Very low	28.3	Very low	139 Å²	139	147.3 Å²	147.3	85%	0.853	81%	0.814	S	S	*	*			trans	-141	72.1	157	32.7	0	0	0	0	109.7
366	S	28.2	Very low	28.3	Very low	121 Å²	121	147.6 Å²	147.6	85%	0.846	82%	0.815	S	S	*	*			trans	-171.3	124.7	148.3	53.4	0	0	0	0	109.1
367	G	26.2	Very low	28.1	Very low	81 Å²	81	151.3 Å²	151.3	84%	0.835	83%	0.827	S	S	*	*			trans	165.9	74.4	179.9	0	0	0	0	0	112.2
368	Q	27.4	Very low	28.3	Very low	183 Å²	183	151.4 Å²	151.4	86%	0.855	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-61.2	162.3	173.7	-92.1	-174.3	-28.7	0	0	113.3
369	P	26.5	Very low	28.2	Very low	120 Å²	120	150.7 Å²	150.7	78%	0.779	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-77.3	134.5	-170.5	31.1	-33	0	0	0	112.5	K371	P369-K371 PolarHBondContact O-N 2.98Å
370	F	24.6	Very low	27.9	Very low	213 Å²	213	154 Å²	154	93%	0.934	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-72.1	121	173.1	-103.4	-96.1	0	0	0	110.9
371	K	24.9	Very low	27.8	Very low	190 Å²	190	154.8 Å²	154.8	83%	0.826	85%	0.846	S	S	*	*	P	Polyproline II helix	trans	-83.4	146.7	162.3	-81.2	-179.7	173.8	179.7	0	109.7	P369	P369-K371 PolarHBondContact O-N 2.98Å
372	S	24.9	Very low	28	Very low	118 Å²	118	155.9 Å²	155.9	83%	0.825	85%	0.847	S	S	*	*	P	Polyproline II helix	trans	-60	128.5	168.4	48.3	0	0	0	0	112.6
373	E	26.7	Very low	27.9	Very low	196 Å²	196	157.1 Å²	157.1	92%	0.916	85%	0.85	S	S	*	*			trans	-129.4	112.2	158.2	-82.1	-172.4	155	0	0	109.5
374	E	27.9	Very low	27.7	Very low	181 Å²	181	162.3 Å²	162.3	85%	0.846	86%	0.861	S	S	*	*			trans	-75.5	150.1	157	-76.4	176.1	137.7	0	0	109.8
375	N	26.9	Very low	27.8	Very low	149 Å²	149	159.9 Å²	159.9	80%	0.797	86%	0.858	S	S	*	*			trans	67.4	104.5	159.9	-72.3	-21.3	0	0	0	119.1
376	K	26.5	Very low	27.8	Very low	206 Å²	206	161.5 Å²	161.5	90%	0.896	86%	0.861	S	S	*	*				174.6	95.6	126.1	-96.2	164.7	-175.6	-178.8	0	111.1
377	M	26.1	Very low	27.9	Very low	202 Å²	202	163 Å²	163	100%	0.995	86%	0.86	S	S	*	*			trans	-166.6	73.2	155.2	-113.9	171.6	135.2	0	0	109.6
378	A	30.6	Very low	28	Very low	104 Å²	104	169.5 Å²	169.5	86%	0.86	87%	0.865	S	S	*	*			trans	-155.2	61.2	163.1	0	0	0	0	0	107.6
379	A	29.7	Very low	28	Very low	86 Å²	86	165.4 Å²	165.4	71%	0.711	86%	0.862	S	S	*	*			trans	-163.6	83.5	170.5	0	0	0	0	0	106.7
380	D	27.9	Very low	28.1	Very low	165 Å²	165	168.7 Å²	168.7	88%	0.882	87%	0.867	S	S	*	*	S	Bend	trans	173.6	66.9	150.1	-87.1	-16.8	0	0	0	108.1
381	D	31.1	Very low	28.4	Very low	163 Å²	163	166.4 Å²	166.4	87%	0.872	86%	0.864	S	S	*	*	S	Bend	trans	-160.8	44.4	160.1	-120.5	-9.3	0	0	0	111.8
382	V	32.5	Very low	28.6	Very low	144 Å²	144	164.8 Å²	164.8	87%	0.873	86%	0.864	S	S	*	*			trans	-150.2	85.1	163.3	-174.4	0	0	0	0	108.1
383	K	29	Very low	28.7	Very low	207 Å²	207	164.6 Å²	164.6	90%	0.9	86%	0.863	S	S	*	*			trans	-170.9	77.6	158.1	-107.4	176.2	-168.2	-176.7	0	109.8
384	R	27.7	Very low	28.9	Very low	239 Å²	239	160.5 Å²	160.5	90%	0.902	86%	0.856	S	S	*	*	S	Bend	trans	-160.2	130.7	148.7	-104.9	168.8	-163.4	-178.3	4.8	107
385	D	30.4	Very low	29.2	Very low	151 Å²	151	160.4 Å²	160.4	81%	0.807	86%	0.856	S	S	*	*			trans	86.3	53.5	171.7	-57.7	-13.7	0	0	0	118.4
386	D	27.3	Very low	29.5	Very low	172 Å²	172	163.2 Å²	163.2	92%	0.92	86%	0.855	S	S	*	*			trans	-99.1	89.2	134	-92.7	-33.4	0	0	0	107.8
387	N	30.2	Very low	29.8	Very low	154 Å²	154	161.6 Å²	161.6	82%	0.824	85%	0.85	S	S	*	*			trans	-156.7	68.3	165.2	-125.2	1.5	0	0	0	109.6
388	K	28.6	Very low	29.9	Very low	216 Å²	216	155.5 Å²	155.5	94%	0.939	84%	0.839	S	S	*	*			trans	-167	72.2	162.5	-112.9	173.2	-172.5	-179.2	0	111.8
389	A	28.7	Very low	29.9	Very low	97 Å²	97	156.3 Å²	156.3	80%	0.802	84%	0.837	S	S	*	*			trans	-155.6	95.8	153.8	0	0	0	0	0	108.4
390	E	28.8	Very low	30.3	Very low	190 Å²	190	157.7 Å²	157.7	89%	0.888	84%	0.837	S	S	*	*			trans	159.1	92.1	144	-90.3	-178.7	176.1	0	0	109.9
391	L	30	Very low	30.9	Very low	165 Å²	165	162.9 Å²	162.9	86%	0.864	85%	0.852	S	S	*	*	S	Bend	trans	-170.7	83	149.7	-102.9	148.2	0	0	0	106.8
392	N	28.8	Very low	30.9	Very low	155 Å²	155	162.9 Å²	162.9	83%	0.829	85%	0.851	S	S	*	*			trans	169.5	84.7	132.8	-85.4	-13.7	0	0	0	110.2
393	S	28	Very low	30.8	Very low	114 Å²	114	163.9 Å²	163.9	80%	0.797	85%	0.85	S	S	*	*			trans	-84.7	107	143.6	55.4	0	0	0	0	107.5
394	S	30.5	Very low	30.9	Very low	110 Å²	110	161.5 Å²	161.5	77%	0.769	85%	0.847	S	S	*	*			trans	-176.9	132.2	147.4	-86.5	0	0	0	0	111
395	Q	34.5	Very low	31.1	Very low	180 Å²	180	156.9 Å²	156.9	84%	0.841	84%	0.843	S	S	*	*			trans	82.5	133.2	170	-54.3	-178	2	0	0	116.1
396	R	32.7	Very low	31.1	Very low	207 Å²	207	157.3 Å²	157.3	78%	0.781	85%	0.846	S	S	*	*			cis	-175.2	143.4	-20.9	-121.4	177.2	-169.3	-175.9	1	102.6
397	E	32.4	Very low	31.4	Very low	172 Å²	172	156.3 Å²	156.3	80%	0.804	84%	0.841	S	S	*	*			trans	38.3	119.3	141.8	-64.1	169.4	147.4	0	0	120
398	G	28.8	Very low	31.5	Very low	74 Å²	74	156.5 Å²	156.5	76%	0.763	84%	0.842	S	S	*	*				101.2	131.7	112.9	0	0	0	0	0	119.1
399	C	30.9	Very low	31.7	Very low	121 Å²	121	151.9 Å²	151.9	82%	0.818	84%	0.835	S	S	*	*			trans	82	111.8	140.5	-90.5	0	0	0	0	121.3
400	V	36.8	Very low	32	Very low	116 Å²	116	156.5 Å²	156.5	70%	0.703	84%	0.837	S	S	*	*				97	124	113.9	173.2	0	0	0	0	118.6
401	K	41.4	Very low	32.2	Very low	274 Å²	274	153.5 Å²	153.5	100%	1.191	83%	0.833	S	S	*	*			trans	88.9	0	156.3	-83.8	166	-172	-174.6	0	118.5

Retrieved 401 of 401 residues in 341.6 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).