A0A3Q0KEG6_SCHMA Loading...

A-kinase anchor protein 14

AlphaFold DB , UniProt , Accession A0A3Q0KEG6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 255 aa.

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(Predicted Aligned Error values between residue pairs)

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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	50.3	Low	57.6	Low	192 Å²	192	83.5 Å²	83.5	95%	0.946	42%	0.424	S	S	*	.				0	-52.6	0	-164.7	-179.4	-124.9	0	0	111.3	S4 I5	M1-S4 WeakPolarHBondContact O-CB 3.36Å; M1-S4 PolarHBondContact O-N 3.11Å; M1-I5 PolarHBondContact O-N 3.29Å; M1-I5 VanDerWaalsContact O-N 3.1Å
2	V	44.1	Very low	58.2	Low	31 Å²	31	89.8 Å²	89.8	19%	0.188	44%	0.441	C	S	.	.	H	α-helix	trans	-59.6	-44.8	175.6	179	0	0	0	0	112.1	S4 I5 I6 Y68 L72	V2-S4 PolarHBondContact O-N 2.88Å; V2-I5 PolarHBondContact O-N 3.41Å; V2-I6 HydrophobicContact CG1-CD1 3.66Å; V2-I6 HydrophobicContact CG1-CG1 4.16Å; V2-I6 WeakPolarHBondContact O-CG1 3.18Å; V2-I6 PolarHBondContact O-N 2.87Å; V2-Y68 HydrophobicContact CG1-CD2 4.48Å; V2-Y68 HydrophobicContact CG1-CG 4.26Å; V2-Y68 HydrophobicContact CG2-CG 4.39Å; V2-L72 HydrophobicContact CG2-CD1 3.88Å
3	D	55.3	Low	58	Low	127 Å²	127	84.5 Å²	84.5	68%	0.679	42%	0.416	S	S	*	.	H	α-helix	trans	-60.9	-34.9	177	-54.1	-38.2	0	0	0	112.1	Q7	D3-Q7 WeakPolarHBondContact O-CA 3.21Å; D3-Q7 WeakPolarHBondContact O-CB 3.49Å; D3-Q7 PolarHBondContact O-N 2.85Å
4	S	66.9	Low	58.1	Low	81 Å²	81	85.6 Å²	85.6	57%	0.566	42%	0.42	S	S	*	.	H	α-helix	trans	-68.9	-37.4	175.5	174.8	0	0	0	0	112.3	M1 V2 R8	M1-S4 WeakPolarHBondContact O-CB 3.36Å; M1-S4 PolarHBondContact O-N 3.11Å; V2-S4 PolarHBondContact O-N 2.88Å; S4-R8 WeakPolarHBondContact O-CB 3.25Å; S4-R8 PolarHBondContact O-N 3.32Å
5	I	55.5	Low	58.6	Low	55 Å²	55	91.6 Å²	91.6	28%	0.282	44%	0.443	S	S	.	.	H	α-helix	trans	-69.8	-48.1	176.3	-64.9	169.6	0	0	0	109.9	M1 V2 Q7 R8 S9 Y68	M1-I5 PolarHBondContact O-N 3.29Å; M1-I5 VanDerWaalsContact O-N 3.1Å; V2-I5 PolarHBondContact O-N 3.41Å; I5-Q7 PolarHBondContact O-N 3.45Å; I5-R8 PolarHBondContact O-N 3.12Å; I5-S9 PolarHBondContact O-N 2.81Å; I5-S9 PolarHBondContact O-OG 3.3Å; I5-S9 VanDerWaalsContact O-OG 3.05Å; I5-Y68 HydrophobicContact CD1-CE1 4.27Å; I5-Y68 HydrophobicContact CG2-CE2 4.02Å
6	I	57.2	Low	58.1	Low	26 Å²	26	90.9 Å²	90.9	13%	0.133	44%	0.441	C	S	.	.	H	α-helix	trans	-60.2	-47.7	177.5	-66.4	175.9	0	0	0	109.8	V2 R8 S9 V10 Q61	V2-I6 HydrophobicContact CG1-CD1 3.66Å; V2-I6 HydrophobicContact CG1-CG1 4.16Å; V2-I6 WeakPolarHBondContact O-CG1 3.18Å; V2-I6 PolarHBondContact O-N 2.87Å; I6-R8 VanDerWaalsContact C-N 3.33Å; I6-R8 PolarHBondContact O-N 3.37Å; I6-S9 WeakPolarHBondContact O-CB 3.49Å; I6-S9 PolarHBondContact O-N 3.08Å; I6-V10 HydrophobicContact CG2-CG2 4.31Å; I6-V10 VanDerWaalsContact O-CG2 3.28Å; I6-V10 WeakPolarHBondContact O-CG2 3.47Å; I6-V10 PolarHBondContact O-N 3.05Å; I6-Q61 HydrophobicContact CG2-CG 4.21Å
7	Q	61.8	Low	57.5	Low	100 Å²	100	92.4 Å²	92.4	47%	0.467	45%	0.452	S	S	.	.	H	α-helix	trans	-61.2	-43.1	177.5	-168.4	62.7	39.2	0	0	111	D3 I5 S9 V10 D11	D3-Q7 WeakPolarHBondContact O-CA 3.21Å; D3-Q7 WeakPolarHBondContact O-CB 3.49Å; D3-Q7 PolarHBondContact O-N 2.85Å; I5-Q7 PolarHBondContact O-N 3.45Å; Q7-S9 VanDerWaalsContact C-N 3.32Å; Q7-S9 PolarHBondContact O-N 3.22Å; Q7-V10 PolarHBondContact O-N 2.68Å; Q7-D11 PolarHBondContact NE2-OD1 3.35Å; Q7-D11 VanDerWaalsContact O-CB 3.32Å; Q7-D11 WeakPolarHBondContact O-CB 3.41Å; Q7-D11 PolarHBondContact O-N 3.18Å
8	R	60.7	Low	57.1	Low	198 Å²	198	92.4 Å²	92.4	75%	0.747	46%	0.458	S	S	*	.	H	α-helix	trans	-62.8	-38.1	176.3	-172.3	177.7	-175.7	172.2	1.7	112.4	S4 I5 I6 Y12	S4-R8 WeakPolarHBondContact O-CB 3.25Å; S4-R8 PolarHBondContact O-N 3.32Å; I5-R8 PolarHBondContact O-N 3.12Å; I6-R8 VanDerWaalsContact C-N 3.33Å; I6-R8 PolarHBondContact O-N 3.37Å; R8-Y12 VanDerWaalsContact O-CB 3.24Å; R8-Y12 WeakPolarHBondContact O-CB 3.38Å; R8-Y12 PolarHBondContact O-N 2.76Å
9	S	53.6	Low	56.3	Low	36 Å²	36	91.6 Å²	91.6	25%	0.252	48%	0.476	S	S	.	.	H	α-helix	trans	-66.8	-43.7	174.4	-61.2	0	0	0	0	111.5	I5 I6 Q7 Y12 V13	I5-S9 PolarHBondContact O-N 2.81Å; I5-S9 PolarHBondContact O-OG 3.3Å; I5-S9 VanDerWaalsContact O-OG 3.05Å; I6-S9 WeakPolarHBondContact O-CB 3.49Å; I6-S9 PolarHBondContact O-N 3.08Å; Q7-S9 VanDerWaalsContact C-N 3.32Å; Q7-S9 PolarHBondContact O-N 3.22Å; S9-Y12 PolarHBondContact O-N 3.37Å; S9-V13 VanDerWaalsContact O-CG2 3.31Å; S9-V13 WeakPolarHBondContact O-CG2 3.18Å; S9-V13 PolarHBondContact O-N 3.43Å
10	V	60.4	Low	55.4	Low	17 Å²	17	91.3 Å²	91.3	10%	0.103	48%	0.482	C	S	.	.	H	α-helix	trans	-61.8	-49.1	174.8	172.4	0	0	0	0	110.2	I6 Q7 Y12 V13 Q14 T57 Q61	I6-V10 HydrophobicContact CG2-CG2 4.31Å; I6-V10 VanDerWaalsContact O-CG2 3.28Å; I6-V10 WeakPolarHBondContact O-CG2 3.47Å; I6-V10 PolarHBondContact O-N 3.05Å; Q7-V10 PolarHBondContact O-N 2.68Å; V10-Y12 VanDerWaalsContact C-N 3.31Å; V10-Y12 PolarHBondContact O-N 2.94Å; V10-V13 CarbonylContact O-C 3.49Å; V10-V13 PolarHBondContact O-N 2.83Å; V10-Q14 HydrophobicContact CG1-CG 4.27Å; V10-Q14 WeakPolarHBondContact O-CB 3.37Å; V10-Q14 VanDerWaalsContact O-CG 3.26Å; V10-Q14 WeakPolarHBondContact O-CG 3.39Å; V10-Q14 PolarHBondContact O-N 2.69Å; V10-T57 HydrophobicContact CG2-CG2 4.05Å; V10-Q61 HydrophobicContact CG2-CG 4.21Å
11	D	67.7	Low	54.6	Low	56 Å²	56	90.6 Å²	90.6	30%	0.299	48%	0.484	S	S	.	.	H	α-helix	trans	-61.2	-38.8	178.2	-67.2	-10.7	0	0	0	111.7	Q7 Q14 K15	Q7-D11 PolarHBondContact NE2-OD1 3.35Å; Q7-D11 VanDerWaalsContact O-CB 3.32Å; Q7-D11 WeakPolarHBondContact O-CB 3.41Å; Q7-D11 PolarHBondContact O-N 3.18Å; D11-Q14 PolarHBondContact O-N 2.79Å; D11-K15 VanDerWaalsContact O-CG 3.3Å; D11-K15 WeakPolarHBondContact O-CG 3.43Å; D11-K15 PolarHBondContact O-N 3.18Å
12	Y	64.5	Low	53.8	Low	159 Å²	159	90.8 Å²	90.8	62%	0.624	48%	0.48	S	S	*	.	H	α-helix	trans	-63.5	-50.5	175.7	-179.5	-96.1	0	0	0	111	R8 S9 V10 Q14 K15 L16	R8-Y12 VanDerWaalsContact O-CB 3.24Å; R8-Y12 WeakPolarHBondContact O-CB 3.38Å; R8-Y12 PolarHBondContact O-N 2.76Å; S9-Y12 PolarHBondContact O-N 3.37Å; V10-Y12 VanDerWaalsContact C-N 3.31Å; V10-Y12 PolarHBondContact O-N 2.94Å; Y12-Q14 PolarHBondContact O-N 3.33Å; Y12-K15 PolarHBondContact O-N 3.45Å; Y12-L16 HydrophobicContact CE1-CD1 4.4Å; Y12-L16 HydrophobicContact CE1-CD2 4.39Å; Y12-L16 PolarHBondContact O-N 3.24Å
13	V	56.2	Low	53.3	Low	21 Å²	21	96.3 Å²	96.3	13%	0.127	51%	0.508	C	S	.	.	H	α-helix	trans	-60.6	-31.3	174	174.1	0	0	0	0	110.6	S9 V10 R53 I60	S9-V13 VanDerWaalsContact O-CG2 3.31Å; S9-V13 WeakPolarHBondContact O-CG2 3.18Å; S9-V13 PolarHBondContact O-N 3.43Å; V10-V13 CarbonylContact O-C 3.49Å; V10-V13 PolarHBondContact O-N 2.83Å; V13-R53 HydrophobicContact CG1-CG 4.12Å; V13-R53 PolarHBondContact O-NE 2.87Å; V13-I60 HydrophobicContact CG2-CD1 4.18Å
14	Q	59.1	Low	52	Low	100 Å²	100	96.7 Å²	96.7	47%	0.467	51%	0.51	S	S	.	.	H	α-helix	trans	-71.5	-36.4	178.8	-77.7	-178.1	0.3	0	0	113.2	V10 D11 Y12 L16 R53	V10-Q14 HydrophobicContact CG1-CG 4.27Å; V10-Q14 WeakPolarHBondContact O-CB 3.37Å; V10-Q14 VanDerWaalsContact O-CG 3.26Å; V10-Q14 WeakPolarHBondContact O-CG 3.39Å; V10-Q14 PolarHBondContact O-N 2.69Å; D11-Q14 PolarHBondContact O-N 2.79Å; Y12-Q14 PolarHBondContact O-N 3.33Å; Q14-L16 VanDerWaalsContact C-N 3.3Å; Q14-L16 PolarHBondContact O-N 3.48Å; Q14-R53 VanDerWaalsContact C-NH2 3.31Å; Q14-R53 PolarHBondContact O-NH2 2.83Å
15	K	66.1	Low	50.6	Low	175 Å²	175	98.9 Å²	98.9	76%	0.761	52%	0.519	S	S	*	.	H	α-helix	trans	-78.2	-10.1	178.9	-71.8	173.5	-173.9	-179.5	0	114	D11 Y12 N17	D11-K15 VanDerWaalsContact O-CG 3.3Å; D11-K15 WeakPolarHBondContact O-CG 3.43Å; D11-K15 PolarHBondContact O-N 3.18Å; Y12-K15 PolarHBondContact O-N 3.45Å; K15-N17 PolarHBondContact O-N 3.1Å
16	L	49.8	Very low	49.4	Very low	80 Å²	80	102.6 Å²	102.6	42%	0.419	54%	0.54	S	S	.	.			trans	-65	109.4	173.9	-69.5	173.6	0	0	0	109.6	Y12 Q14 V18	Y12-L16 HydrophobicContact CE1-CD1 4.4Å; Y12-L16 HydrophobicContact CE1-CD2 4.39Å; Y12-L16 PolarHBondContact O-N 3.24Å; Q14-L16 VanDerWaalsContact C-N 3.3Å; Q14-L16 PolarHBondContact O-N 3.48Å; L16-V18 PolarHBondContact O-N 3.29Å
17	N	47.6	Very low	48	Very low	116 Å²	116	110.1 Å²	110.1	62%	0.62	57%	0.574	S	S	*	*			trans	-74.5	121.9	175.5	-166.9	-2.9	0	0	0	109.5	K15 G19 S20	K15-N17 PolarHBondContact O-N 3.1Å; N17-G19 PolarHBondContact O-N 3.37Å; N17-S20 PolarHBondContact O-N 3.12Å; N17-S20 PolarHBondContact O-OG 3.25Å
18	V	51.3	Low	46.4	Very low	94 Å²	94	113.1 Å²	113.1	57%	0.57	59%	0.588	S	S	*	*	G	3₁₀ helix	trans	-56.1	-27.8	-173.8	-179.7	0	0	0	0	112.4	L16 P49	L16-V18 PolarHBondContact O-N 3.29Å; V18-P49 HydrophobicContact CG1-CB 3.95Å; V18-P49 HydrophobicContact CG1-CG 3.98Å; V18-P49 HydrophobicContact CG2-CB 4.05Å
19	G	41.1	Very low	44.9	Very low	77 Å²	77	110.3 Å²	110.3	79%	0.794	59%	0.588	S	S	*	*	G	3₁₀ helix	trans	-78.1	-18.2	-179.9	0	0	0	0	0	115.7	N17	N17-G19 PolarHBondContact O-N 3.37Å
20	S	38	Very low	43.7	Very low	84 Å²	84	118.7 Å²	118.7	59%	0.587	62%	0.62	S	S	*	*	G	3₁₀ helix	trans	-109.5	10.1	-175.5	65.1	0	0	0	0	113.9	N17 K22	N17-S20 PolarHBondContact O-N 3.12Å; N17-S20 PolarHBondContact O-OG 3.25Å; S20-K22 PolarHBondContact O-N 3.42Å
21	S	38.4	Very low	42.1	Very low	77 Å²	77	126.6 Å²	126.6	54%	0.538	65%	0.653	S	S	.	*			trans	-76.4	45.6	174.2	-51	0	0	0	0	112.6
22	K	35.5	Very low	40.1	Very low	196 Å²	196	131 Å²	131	85%	0.852	68%	0.677	S	S	*	*			trans	-85.9	90.1	145.1	-81	-176.7	176.5	-179.4	0	105.1	S20 D24	S20-K22 PolarHBondContact O-N 3.42Å; K22-D24 PolarHBondContact O-N 3.43Å
23	L	33.5	Very low	38.5	Very low	147 Å²	147	130.3 Å²	130.3	77%	0.77	69%	0.689	S	S	*	*			trans	-68.2	92.5	167.9	-73.2	167.2	0	0	0	106.8	V25	L23-V25 VanDerWaalsContact C-N 3.25Å; L23-V25 PolarHBondContact O-N 3.29Å
24	D	27.3	Very low	37.1	Very low	135 Å²	135	137.1 Å²	137.1	72%	0.722	72%	0.72	S	S	*	*			trans	-78.6	79.1	176.6	-155.3	0.6	0	0	0	108.1	K22 N26	K22-D24 PolarHBondContact O-N 3.43Å; D24-N26 PolarHBondContact O-N 3.13Å
25	V	37	Very low	35.6	Very low	127 Å²	127	139 Å²	139	77%	0.77	73%	0.728	S	S	*	*			trans	-88.1	55	168.8	-165.7	0	0	0	0	108	L23	L23-V25 VanDerWaalsContact C-N 3.25Å; L23-V25 PolarHBondContact O-N 3.29Å
26	N	30	Very low	33.7	Very low	134 Å²	134	139 Å²	139	72%	0.717	73%	0.731	S	S	*	*			trans	-129.3	79.3	163	-76.6	-52.5	0	0	0	107.1	D24 E28	D24-N26 PolarHBondContact O-N 3.13Å; N26-E28 PolarHBondContact O-N 3.15Å
27	H	29.1	Very low	32.5	Very low	183 Å²	183	139.1 Å²	139.1	85%	0.847	75%	0.751	S	S	*	*			trans	-58.9	111.8	156.3	-118.5	-26.1	0	0	0	107.3	N29	H27-N29 PolarHBondContact O-N 2.92Å
28	E	28.2	Very low	31.5	Very low	163 Å²	163	140 Å²	140	76%	0.762	76%	0.761	S	S	*	*	S	Bend	trans	13.3	98	157.1	-62.3	-175.8	155.7	0	0	116.1	N26	N26-E28 PolarHBondContact O-N 3.15Å
29	N	28.7	Very low	30.3	Very low	140 Å²	140	145.7 Å²	145.7	75%	0.749	77%	0.772	S	S	*	*				163.5	84	128.4	-84.9	-35.7	0	0	0	110.9	H27	H27-N29 PolarHBondContact O-N 2.92Å
30	F	27.6	Very low	29.6	Very low	212 Å²	212	150 Å²	150	93%	0.93	78%	0.775	S	S	*	*			trans	-148.9	85.1	141.5	-98.4	-75.9	0	0	0	108.4
31	K	27.1	Very low	29.1	Very low	183 Å²	183	149.4 Å²	149.4	80%	0.796	78%	0.782	S	S	*	*			trans	-62	136.2	156.2	-72.8	179.1	176.7	175.8	0	107.6
32	N	27	Very low	28.6	Very low	147 Å²	147	153 Å²	153	79%	0.786	79%	0.791	S	S	*	*			trans	73.6	85.9	163.9	-55	-17	0	0	0	117
33	T	29.5	Very low	28.3	Very low	146 Å²	146	153 Å²	153	90%	0.896	79%	0.793	S	S	*	*				-146.4	111	122.5	-21.6	0	0	0	0	110.3
34	Q	26.5	Very low	28.4	Very low	164 Å²	164	154.8 Å²	154.8	77%	0.766	80%	0.795	S	S	*	*			trans	-71.6	137.3	169.2	-95.6	-167.3	16.5	0	0	109.7
35	Q	28.4	Very low	29	Very low	138 Å²	138	152.7 Å²	152.7	65%	0.645	79%	0.791	S	S	*	*			trans	98.5	127.4	141.7	-50.4	-114.1	18.9	0	0	120.1
36	H	25.3	Very low	29.1	Very low	177 Å²	177	154.9 Å²	154.9	82%	0.819	80%	0.798	S	S	*	*			trans	81.9	98	151.8	-62.7	-52.6	0	0	0	120.3
37	G	25.8	Very low	30	Very low	81 Å²	81	152.2 Å²	152.2	84%	0.835	78%	0.781	S	S	*	*			trans	-163.3	107	158.3	0	0	0	0	0	110.8
38	T	25.4	Very low	31	Very low	134 Å²	134	146.3 Å²	146.3	82%	0.822	76%	0.761	S	S	*	*			trans	-63.1	142.5	-165.6	-57.1	0	0	0	0	115.7
39	R	27	Very low	32.5	Very low	215 Å²	215	141.5 Å²	141.5	81%	0.811	74%	0.744	S	S	*	*			trans	-74.2	111.4	178.2	-166.2	-174.5	-161.9	-165.9	4.1	111.3
40	I	26.6	Very low	33.6	Very low	168 Å²	168	140 Å²	140	86%	0.862	73%	0.732	S	S	*	*			trans	-141	126	161.7	-56.8	-178.3	0	0	0	107.9
41	G	26.4	Very low	35.1	Very low	71 Å²	71	133 Å²	133	73%	0.732	71%	0.707	S	S	*	*			trans	118.8	67.6	170.4	0	0	0	0	0	114.9
42	Q	27.8	Very low	36.5	Very low	153 Å²	153	126.2 Å²	126.2	72%	0.715	68%	0.679	S	S	*	*			trans	-102.1	81.1	151.8	-72.9	-160.8	-40.3	0	0	107.8
43	E	30.2	Very low	37.8	Very low	194 Å²	194	122.6 Å²	122.6	91%	0.907	65%	0.654	S	S	*	*			trans	-102.2	101.5	154.7	-80.7	-174.8	172	0	0	106.4	S45	E43-S45 PolarHBondContact O-N 3.31Å
44	K	34.8	Very low	39.4	Very low	186 Å²	186	119.2 Å²	119.2	81%	0.809	63%	0.63	S	S	*	*			trans	-72.1	106.9	174.3	-68.3	179.2	177.9	178.7	0	107.1	D46	K44-D46 PolarHBondContact O-N 3.13Å
45	S	40.3	Very low	41.4	Very low	91 Å²	91	115.3 Å²	115.3	64%	0.636	61%	0.614	S	S	*	*			trans	-68.6	113.3	164.9	57.3	0	0	0	0	108.4	E43 E47	E43-S45 PolarHBondContact O-N 3.31Å; S45-E47 PolarHBondContact O-N 3.4Å
46	D	39.2	Very low	42.9	Very low	172 Å²	172	111.7 Å²	111.7	92%	0.92	60%	0.599	S	S	*	*			trans	-78.2	47	-179.9	-148.7	15.4	0	0	0	111.4	K44	K44-D46 PolarHBondContact O-N 3.13Å
47	E	50	Low	44.5	Very low	78 Å²	78	104.1 Å²	104.1	36%	0.364	57%	0.565	S	S	.	*			trans	-84.9	127.8	172.4	-75.8	-169.2	156.1	0	0	109.3	S45 R248	S45-E47 PolarHBondContact O-N 3.4Å; E47-R248 IonicContact OE1-CZ 2.85Å; E47-R248 IonicContact OE1-NH2 3.05Å; E47-R248 PolarHBondContact OE1-NH2 3.09Å; E47-R248 IonicContact OE2-NH2 3.27Å; E47-R248 PolarHBondContact OE2-NH2 3.47Å
48	S	49.3	Very low	46.2	Very low	59 Å²	59	103.2 Å²	103.2	41%	0.413	55%	0.546	S	S	.	.			trans	-57.8	130	-179.4	75.9	0	0	0	0	110.1	Q50 V51	S48-Q50 PolarHBondContact O-N 3.36Å; S48-V51 PolarHBondContact O-N 2.83Å; S48-V51 WeakPolarHBondContact OG-CG2 3.24Å
49	P	59.7	Low	48.3	Very low	63 Å²	63	99.7 Å²	99.7	41%	0.409	52%	0.521	S	S	.	.	H	α-helix	trans	-49.8	-26.6	177.5	-30	35.1	0	0	0	113.7	V18 R53	V18-P49 HydrophobicContact CG1-CB 3.95Å; V18-P49 HydrophobicContact CG1-CG 3.98Å; V18-P49 HydrophobicContact CG2-CB 4.05Å; P49-R53 VanDerWaalsContact O-CB 3.27Å; P49-R53 WeakPolarHBondContact O-CB 3.3Å; P49-R53 PolarHBondContact O-N 3.44Å
50	Q	52.6	Low	50.3	Low	109 Å²	109	92.1 Å²	92.1	51%	0.509	50%	0.497	S	S	.	.	H	α-helix	trans	-60.9	-43.4	174	-95.4	70.6	13.9	0	0	114.2	S48 R53 N54	S48-Q50 PolarHBondContact O-N 3.36Å; Q50-R53 PolarHBondContact O-N 2.9Å; Q50-N54 WeakPolarHBondContact O-CB 3.35Å; Q50-N54 PolarHBondContact O-N 3.2Å; Q50-N54 PolarHBondContact O-OD1 2.98Å
51	V	59.1	Low	51.9	Low	64 Å²	64	87.9 Å²	87.9	39%	0.388	47%	0.473	S	S	.	.	H	α-helix	trans	-66.4	-45.2	-176.3	173.4	0	0	0	0	110.2	S48 R53 N54 L55	S48-V51 PolarHBondContact O-N 2.83Å; S48-V51 WeakPolarHBondContact OG-CG2 3.24Å; V51-R53 VanDerWaalsContact C-N 3.35Å; V51-R53 PolarHBondContact O-N 3.48Å; V51-N54 PolarHBondContact O-N 3.04Å; V51-L55 PolarHBondContact O-N 3.16Å
52	I	56.1	Low	53.5	Low	40 Å²	40	85.8 Å²	85.8	21%	0.205	45%	0.447	C	S	.	.	H	α-helix	trans	-61.9	-44.9	175.7	-62.3	172.6	0	0	0	110	N54 L55 I56 Y252	I52-N54 VanDerWaalsContact C-N 3.34Å; I52-N54 PolarHBondContact O-N 2.77Å; I52-L55 PolarHBondContact O-N 2.79Å; I52-I56 HydrophobicContact CG2-CD1 3.69Å; I52-I56 HydrophobicContact CG2-CG1 4.32Å; I52-I56 WeakPolarHBondContact O-CB 3.46Å; I52-I56 VanDerWaalsContact O-CG1 3.29Å; I52-I56 WeakPolarHBondContact O-CG1 3.41Å; I52-I56 PolarHBondContact O-N 3.43Å; I52-Y252 HydrophobicContact CD1-CE1 3.92Å; I52-Y252 HydrophobicContact CG2-CE1 4.39Å
53	R	54.5	Low	54.9	Low	72 Å²	72	81.1 Å²	81.1	27%	0.272	43%	0.431	S	S	.	.	H	α-helix	trans	-60.5	-41.7	177	-174.5	170.5	175.2	-117.8	34.9	112.1	V13 Q14 P49 Q50 V51 T57	V13-R53 HydrophobicContact CG1-CG 4.12Å; V13-R53 PolarHBondContact O-NE 2.87Å; Q14-R53 VanDerWaalsContact C-NH2 3.31Å; Q14-R53 PolarHBondContact O-NH2 2.83Å; P49-R53 VanDerWaalsContact O-CB 3.27Å; P49-R53 WeakPolarHBondContact O-CB 3.3Å; P49-R53 PolarHBondContact O-N 3.44Å; Q50-R53 PolarHBondContact O-N 2.9Å; V51-R53 VanDerWaalsContact C-N 3.35Å; V51-R53 PolarHBondContact O-N 3.48Å; R53-T57 VanDerWaalsContact O-CB 3.28Å; R53-T57 WeakPolarHBondContact O-CB 3.42Å; R53-T57 PolarHBondContact O-N 3.21Å; R53-T57 PolarHBondContact O-OG1 2.83Å
54	N	63.2	Low	56.1	Low	75 Å²	75	73.6 Å²	73.6	40%	0.401	40%	0.397	S	S	.	.	H	α-helix	trans	-67.1	-42.1	179.1	-69	-6.2	0	0	0	111.4	Q50 V51 I52 T57 S58	Q50-N54 WeakPolarHBondContact O-CB 3.35Å; Q50-N54 PolarHBondContact O-N 3.2Å; Q50-N54 PolarHBondContact O-OD1 2.98Å; V51-N54 PolarHBondContact O-N 3.04Å; I52-N54 VanDerWaalsContact C-N 3.34Å; I52-N54 PolarHBondContact O-N 2.77Å; N54-T57 PolarHBondContact O-N 2.85Å; N54-S58 WeakPolarHBondContact O-CB 3.2Å; N54-S58 PolarHBondContact O-N 3.42Å
55	L	68	Low	57.2	Low	82 Å²	82	70.9 Å²	70.9	43%	0.429	38%	0.383	S	S	.	.	H	α-helix	trans	-64.1	-48.1	175.8	-178.1	64.9	0	0	0	111.5	V51 I52 T57 S58 I59 L249	V51-L55 PolarHBondContact O-N 3.16Å; I52-L55 PolarHBondContact O-N 2.79Å; L55-T57 VanDerWaalsContact C-N 3.3Å; L55-T57 PolarHBondContact O-N 2.8Å; L55-S58 PolarHBondContact O-N 2.8Å; L55-I59 HydrophobicContact CD1-CD1 4.23Å; L55-I59 HydrophobicContact CD1-CG1 4.49Å; L55-I59 HydrophobicContact CG-CD1 3.87Å; L55-I59 VanDerWaalsContact O-CG1 3.3Å; L55-I59 WeakPolarHBondContact O-CG1 3.35Å; L55-I59 PolarHBondContact O-N 3.49Å; L55-L249 HydrophobicContact CD2-CD2 4.26Å
56	I	60.1	Low	58	Low	62 Å²	62	70.5 Å²	70.5	32%	0.318	37%	0.367	S	S	.	.	H	α-helix	trans	-58.5	-44.8	176.3	-70.2	172.1	0	0	0	110.2	I52 S58 I59 I60	I52-I56 HydrophobicContact CG2-CD1 3.69Å; I52-I56 HydrophobicContact CG2-CG1 4.32Å; I52-I56 WeakPolarHBondContact O-CB 3.46Å; I52-I56 VanDerWaalsContact O-CG1 3.29Å; I52-I56 WeakPolarHBondContact O-CG1 3.41Å; I52-I56 PolarHBondContact O-N 3.43Å; I56-S58 VanDerWaalsContact C-N 3.34Å; I56-S58 PolarHBondContact O-N 3.49Å; I56-I59 PolarHBondContact O-N 2.97Å; I56-I60 HydrophobicContact CG2-CD1 3.59Å; I56-I60 HydrophobicContact CG2-CG1 4.27Å; I56-I60 WeakPolarHBondContact O-CB 3.29Å; I56-I60 VanDerWaalsContact O-CG1 3.27Å; I56-I60 WeakPolarHBondContact O-CG1 3.42Å; I56-I60 PolarHBondContact O-N 2.76Å
57	T	58	Low	58.8	Low	18 Å²	18	66.1 Å²	66.1	11%	0.11	35%	0.347	C	S	.	.	H	α-helix	trans	-60.5	-44	177.5	-56.5	0	0	0	0	110.9	V10 R53 N54 L55 I60 Q61	V10-T57 HydrophobicContact CG2-CG2 4.05Å; R53-T57 VanDerWaalsContact O-CB 3.28Å; R53-T57 WeakPolarHBondContact O-CB 3.42Å; R53-T57 PolarHBondContact O-N 3.21Å; R53-T57 PolarHBondContact O-OG1 2.83Å; N54-T57 PolarHBondContact O-N 2.85Å; L55-T57 VanDerWaalsContact C-N 3.3Å; L55-T57 PolarHBondContact O-N 2.8Å; T57-I60 PolarHBondContact O-N 3.27Å; T57-Q61 HydrophobicContact CG2-CG 4.26Å; T57-Q61 VanDerWaalsContact O-CB 3.23Å; T57-Q61 WeakPolarHBondContact O-CB 3.38Å; T57-Q61 WeakPolarHBondContact O-CG 3.25Å; T57-Q61 PolarHBondContact O-N 2.87Å
58	S	62.5	Low	58.8	Low	62 Å²	62	65.3 Å²	65.3	43%	0.434	34%	0.341	S	S	.	.	H	α-helix	trans	-64.4	-41.5	176.6	-176.3	0	0	0	0	112.7	N54 L55 I56 Q61 S62	N54-S58 WeakPolarHBondContact O-CB 3.2Å; N54-S58 PolarHBondContact O-N 3.42Å; L55-S58 PolarHBondContact O-N 2.8Å; I56-S58 VanDerWaalsContact C-N 3.34Å; I56-S58 PolarHBondContact O-N 3.49Å; S58-Q61 PolarHBondContact O-N 2.79Å; S58-S62 WeakPolarHBondContact O-CB 3.32Å; S58-S62 PolarHBondContact O-N 3.06Å
59	I	68.6	Low	59	Low	59 Å²	59	66.7 Å²	66.7	30%	0.303	34%	0.341	S	S	.	.	H	α-helix	trans	-63	-48.3	176.5	-68.4	161.3	0	0	0	110.2	L55 I56 S62 S63 L249	L55-I59 HydrophobicContact CD1-CD1 4.23Å; L55-I59 HydrophobicContact CD1-CG1 4.49Å; L55-I59 HydrophobicContact CG-CD1 3.87Å; L55-I59 VanDerWaalsContact O-CG1 3.3Å; L55-I59 WeakPolarHBondContact O-CG1 3.35Å; L55-I59 PolarHBondContact O-N 3.49Å; I56-I59 PolarHBondContact O-N 2.97Å; I59-S62 PolarHBondContact O-N 3.39Å; I59-S62 PolarHBondContact O-OG 3.11Å; I59-S63 WeakPolarHBondContact O-CB 3.17Å; I59-S63 PolarHBondContact O-N 2.91Å; I59-S63 PolarHBondContact O-OG 3.46Å; I59-L249 HydrophobicContact CD1-CD1 3.47Å; I59-L249 VanDerWaalsContact CD1-CD1 3.47Å; I59-L249 HydrophobicContact CD1-CD2 3.6Å; I59-L249 HydrophobicContact CD1-CG 4.18Å
60	I	68.9	Low	58.5	Low	57 Å²	57	70.3 Å²	70.3	29%	0.292	35%	0.35	S	S	.	.	H	α-helix	trans	-62.1	-47.8	177.4	-69	172	0	0	0	109.8	V13 I56 T57 S62 S63 L64	V13-I60 HydrophobicContact CG2-CD1 4.18Å; I56-I60 HydrophobicContact CG2-CD1 3.59Å; I56-I60 HydrophobicContact CG2-CG1 4.27Å; I56-I60 WeakPolarHBondContact O-CB 3.29Å; I56-I60 VanDerWaalsContact O-CG1 3.27Å; I56-I60 WeakPolarHBondContact O-CG1 3.42Å; I56-I60 PolarHBondContact O-N 2.76Å; T57-I60 PolarHBondContact O-N 3.27Å; I60-S62 PolarHBondContact O-N 2.86Å; I60-S63 WeakPolarHBondContact CA-OG 3.32Å; I60-S63 PolarHBondContact O-N 3.32Å; I60-S63 PolarHBondContact O-OG 2.88Å; I60-L64 HydrophobicContact CG2-CD1 3.55Å; I60-L64 HydrophobicContact CG2-CG 4.06Å; I60-L64 VanDerWaalsContact O-CB 3.3Å; I60-L64 WeakPolarHBondContact O-CB 3.23Å; I60-L64 WeakPolarHBondContact O-CG 3.17Å; I60-L64 PolarHBondContact O-N 3.31Å
61	Q	59.9	Low	58	Low	79 Å²	79	68.6 Å²	68.6	37%	0.369	34%	0.344	S	S	.	.	H	α-helix	trans	-59.8	-48.1	178.5	-79.5	175.1	-38.9	0	0	111.7	I6 V10 T57 S58 S63 L64 Y65	I6-Q61 HydrophobicContact CG2-CG 4.21Å; V10-Q61 HydrophobicContact CG2-CG 4.21Å; T57-Q61 HydrophobicContact CG2-CG 4.26Å; T57-Q61 VanDerWaalsContact O-CB 3.23Å; T57-Q61 WeakPolarHBondContact O-CB 3.38Å; T57-Q61 WeakPolarHBondContact O-CG 3.25Å; T57-Q61 PolarHBondContact O-N 2.87Å; S58-Q61 PolarHBondContact O-N 2.79Å; Q61-S63 VanDerWaalsContact C-N 3.33Å; Q61-S63 PolarHBondContact O-N 3.39Å; Q61-L64 PolarHBondContact O-N 2.97Å; Q61-Y65 WeakPolarHBondContact O-CB 3.38Å; Q61-Y65 PolarHBondContact O-N 3.36Å
62	S	60.1	Low	56.9	Low	26 Å²	26	69.2 Å²	69.2	18%	0.182	35%	0.345	C	S	.	.	H	α-helix	trans	-67.6	-35.4	-179.2	89.3	0	0	0	0	112	S58 I59 I60 R66	S58-S62 WeakPolarHBondContact O-CB 3.32Å; S58-S62 PolarHBondContact O-N 3.06Å; I59-S62 PolarHBondContact O-N 3.39Å; I59-S62 PolarHBondContact O-OG 3.11Å; I60-S62 PolarHBondContact O-N 2.86Å; S62-R66 WeakPolarHBondContact O-CB 3.49Å; S62-R66 VanDerWaalsContact O-CG 3.25Å; S62-R66 WeakPolarHBondContact O-CG 3.18Å; S62-R66 PolarHBondContact O-N 3.07Å
63	S	58.7	Low	56.1	Low	56 Å²	56	72.4 Å²	72.4	39%	0.392	36%	0.362	S	S	.	.	H	α-helix	trans	-74.7	-41	178.6	50.4	0	0	0	0	111.7	I59 I60 Q61 R66 V67	I59-S63 WeakPolarHBondContact O-CB 3.17Å; I59-S63 PolarHBondContact O-N 2.91Å; I59-S63 PolarHBondContact O-OG 3.46Å; I60-S63 WeakPolarHBondContact CA-OG 3.32Å; I60-S63 PolarHBondContact O-N 3.32Å; I60-S63 PolarHBondContact O-OG 2.88Å; Q61-S63 VanDerWaalsContact C-N 3.33Å; Q61-S63 PolarHBondContact O-N 3.39Å; S63-R66 PolarHBondContact O-N 3.15Å; S63-V67 WeakPolarHBondContact O-CG2 3.21Å; S63-V67 PolarHBondContact O-N 2.96Å
64	L	53.9	Low	55.3	Low	35 Å²	35	74.4 Å²	74.4	18%	0.183	38%	0.377	C	S	.	.	H	α-helix	trans	-61.7	-44.1	169.9	-68.7	173.9	0	0	0	111.2	I60 Q61 R66 V67 Y68	I60-L64 HydrophobicContact CG2-CD1 3.55Å; I60-L64 HydrophobicContact CG2-CG 4.06Å; I60-L64 VanDerWaalsContact O-CB 3.3Å; I60-L64 WeakPolarHBondContact O-CB 3.23Å; I60-L64 WeakPolarHBondContact O-CG 3.17Å; I60-L64 PolarHBondContact O-N 3.31Å; Q61-L64 PolarHBondContact O-N 2.97Å; L64-R66 VanDerWaalsContact C-N 3.32Å; L64-R66 PolarHBondContact O-N 3.05Å; L64-V67 PolarHBondContact O-N 2.59Å; L64-V67 VanDerWaalsContact O-N 3.13Å; L64-Y68 HydrophobicContact CB-CD2 4.14Å; L64-Y68 HydrophobicContact CB-CE2 4.31Å; L64-Y68 HydrophobicContact CD2-CD2 4.47Å; L64-Y68 HydrophobicContact CD2-CE2 3.84Å; L64-Y68 WeakPolarHBondContact O-CB 3.44Å; L64-Y68 WeakPolarHBondContact O-CD2 3.24Å; L64-Y68 PolarHBondContact O-N 2.85Å
65	Y	59.5	Low	53.9	Low	130 Å²	130	75.4 Å²	75.4	51%	0.51	38%	0.383	S	S	.	.	H	α-helix	trans	-58.6	-44.4	176.6	-167.7	-91.3	0	0	0	111.1	Q61 V67 Y68 E69	Q61-Y65 WeakPolarHBondContact O-CB 3.38Å; Q61-Y65 PolarHBondContact O-N 3.36Å; Y65-V67 VanDerWaalsContact C-N 3.32Å; Y65-V67 PolarHBondContact O-N 3.47Å; Y65-Y68 PolarHBondContact O-N 2.86Å; Y65-E69 HydrophobicContact CD1-CG 4.15Å; Y65-E69 HydrophobicContact CE1-CB 4.49Å; Y65-E69 VanDerWaalsContact CE1-CD 3.5Å; Y65-E69 HydrophobicContact CE1-CG 3.61Å; Y65-E69 WeakPolarHBondContact O-CB 3.14Å; Y65-E69 PolarHBondContact O-N 3.36Å
66	R	56.1	Low	52.3	Low	82 Å²	82	78.8 Å²	78.8	31%	0.309	39%	0.394	S	S	.	.	H	α-helix	trans	-63.8	-32.6	175.8	-74.7	173.7	-173	-100.7	2.2	113.8	S62 S63 L64 K70 F223	S62-R66 WeakPolarHBondContact O-CB 3.49Å; S62-R66 VanDerWaalsContact O-CG 3.25Å; S62-R66 WeakPolarHBondContact O-CG 3.18Å; S62-R66 PolarHBondContact O-N 3.07Å; S63-R66 PolarHBondContact O-N 3.15Å; L64-R66 VanDerWaalsContact C-N 3.32Å; L64-R66 PolarHBondContact O-N 3.05Å; R66-K70 WeakPolarHBondContact O-CG 3.49Å; R66-F223 PolarHBondContact NH2-O 3.01Å
67	V	55.3	Low	51.3	Low	80 Å²	80	82.2 Å²	82.2	49%	0.485	41%	0.412	S	S	.	.	H	α-helix	trans	-75	-48.9	176.3	172.7	0	0	0	0	109.9	S63 L64 Y65 K70 D71	S63-V67 WeakPolarHBondContact O-CG2 3.21Å; S63-V67 PolarHBondContact O-N 2.96Å; L64-V67 PolarHBondContact O-N 2.59Å; L64-V67 VanDerWaalsContact O-N 3.13Å; Y65-V67 VanDerWaalsContact C-N 3.32Å; Y65-V67 PolarHBondContact O-N 3.47Å; V67-K70 WeakPolarHBondContact O-CB 3.33Å; V67-K70 PolarHBondContact O-N 3.43Å; V67-D71 PolarHBondContact O-N 2.86Å
68	Y	50.5	Low	50.2	Low	62 Å²	62	88.3 Å²	88.3	24%	0.243	44%	0.444	C	S	.	.	H	α-helix	trans	-80.7	-23.8	-174.7	-70.6	-64.6	0	0	0	114.4	V2 I5 L64 Y65 K70 D71 L72	V2-Y68 HydrophobicContact CG1-CD2 4.48Å; V2-Y68 HydrophobicContact CG1-CG 4.26Å; V2-Y68 HydrophobicContact CG2-CG 4.39Å; I5-Y68 HydrophobicContact CD1-CE1 4.27Å; I5-Y68 HydrophobicContact CG2-CE2 4.02Å; L64-Y68 HydrophobicContact CB-CD2 4.14Å; L64-Y68 HydrophobicContact CB-CE2 4.31Å; L64-Y68 HydrophobicContact CD2-CD2 4.47Å; L64-Y68 HydrophobicContact CD2-CE2 3.84Å; L64-Y68 WeakPolarHBondContact O-CB 3.44Å; L64-Y68 WeakPolarHBondContact O-CD2 3.24Å; L64-Y68 PolarHBondContact O-N 2.85Å; Y65-Y68 PolarHBondContact O-N 2.86Å; Y68-K70 VanDerWaalsContact C-N 3.27Å; Y68-D71 CarbonylContact O-C 3.53Å; Y68-D71 PolarHBondContact O-N 2.83Å; Y68-L72 VanDerWaalsContact O-CB 3.27Å; Y68-L72 WeakPolarHBondContact O-CB 3.25Å; Y68-L72 PolarHBondContact O-N 2.97Å
69	E	53.2	Low	48.6	Very low	88 Å²	88	91.7 Å²	91.7	41%	0.411	46%	0.456	S	S	.	.	H	α-helix	trans	-66.4	-32.2	167.5	-104.5	-149.1	144.5	0	0	111.4	Y65 D71 L72 L73	Y65-E69 HydrophobicContact CD1-CG 4.15Å; Y65-E69 HydrophobicContact CE1-CB 4.49Å; Y65-E69 VanDerWaalsContact CE1-CD 3.5Å; Y65-E69 HydrophobicContact CE1-CG 3.61Å; Y65-E69 WeakPolarHBondContact O-CB 3.14Å; Y65-E69 PolarHBondContact O-N 3.36Å; E69-D71 VanDerWaalsContact C-N 3.33Å; E69-L72 PolarHBondContact O-N 2.9Å; E69-L73 VanDerWaalsContact O-CB 3.23Å; E69-L73 WeakPolarHBondContact O-CB 3.48Å; E69-L73 WeakPolarHBondContact O-CG 3.48Å; E69-L73 PolarHBondContact O-N 3Å
70	K	50	Low	46.6	Very low	139 Å²	139	98 Å²	98	60%	0.604	48%	0.481	S	S	*	.	H	α-helix	trans	-61.6	-47.3	171	-72.3	178	179.1	176.9	0	109.8	R66 V67 Y68 L72 L74	R66-K70 WeakPolarHBondContact O-CG 3.49Å; V67-K70 WeakPolarHBondContact O-CB 3.33Å; V67-K70 PolarHBondContact O-N 3.43Å; Y68-K70 VanDerWaalsContact C-N 3.27Å; K70-L72 VanDerWaalsContact C-N 3.35Å; K70-L72 PolarHBondContact O-N 2.91Å; K70-L74 WeakPolarHBondContact O-CB 3.41Å; K70-L74 VanDerWaalsContact O-CD1 3.28Å; K70-L74 WeakPolarHBondContact O-CD1 3.12Å; K70-L74 PolarHBondContact O-N 2.87Å
71	D	42	Very low	44.8	Very low	73 Å²	73	101.7 Å²	101.7	39%	0.39	51%	0.509	S	S	.	.	H	α-helix	trans	-68.3	-32.1	179.3	-66.5	-16.4	0	0	0	112.8	V67 Y68 E69 L74 N75	V67-D71 PolarHBondContact O-N 2.86Å; Y68-D71 CarbonylContact O-C 3.53Å; Y68-D71 PolarHBondContact O-N 2.83Å; E69-D71 VanDerWaalsContact C-N 3.33Å; D71-L74 PolarHBondContact O-N 2.94Å; D71-N75 VanDerWaalsContact O-CB 3.24Å; D71-N75 WeakPolarHBondContact O-CB 3.46Å; D71-N75 PolarHBondContact O-N 3.32Å; D71-N75 PolarHBondContact O-ND2 2.74Å
72	L	35.5	Very low	43.2	Very low	76 Å²	76	101.2 Å²	101.2	40%	0.398	53%	0.525	S	S	.	.	H	α-helix	trans	-81.5	-31.6	179.5	-153.3	117.6	0	0	0	112.4	V2 Y68 E69 K70 L74 N75 K76	V2-L72 HydrophobicContact CG2-CD1 3.88Å; Y68-L72 VanDerWaalsContact O-CB 3.27Å; Y68-L72 WeakPolarHBondContact O-CB 3.25Å; Y68-L72 PolarHBondContact O-N 2.97Å; E69-L72 PolarHBondContact O-N 2.9Å; K70-L72 VanDerWaalsContact C-N 3.35Å; K70-L72 PolarHBondContact O-N 2.91Å; L72-L74 VanDerWaalsContact C-N 3.32Å; L72-N75 PolarHBondContact O-N 3Å; L72-K76 HydrophobicContact CD2-CD 4.08Å; L72-K76 HydrophobicContact CD2-CG 4.29Å; L72-K76 WeakPolarHBondContact O-CB 3.47Å; L72-K76 WeakPolarHBondContact O-CG 3.49Å; L72-K76 PolarHBondContact O-N 3.39Å
73	L	40	Very low	41.6	Very low	108 Å²	108	108 Å²	108	57%	0.565	56%	0.559	S	S	*	*	H	α-helix	trans	-69.1	-33	167.8	-71.9	173.3	0	0	0	111.2	E69 L77	E69-L73 VanDerWaalsContact O-CB 3.23Å; E69-L73 WeakPolarHBondContact O-CB 3.48Å; E69-L73 WeakPolarHBondContact O-CG 3.48Å; E69-L73 PolarHBondContact O-N 3Å; L73-L77 WeakPolarHBondContact O-CG 3.28Å
74	L	36.9	Very low	40.3	Very low	114 Å²	114	111 Å²	111	60%	0.597	58%	0.58	S	S	*	*	H	α-helix	trans	-69.5	-44	170.4	-91.4	139.8	0	0	0	111.7	K70 D71 L72 L77	K70-L74 WeakPolarHBondContact O-CB 3.41Å; K70-L74 VanDerWaalsContact O-CD1 3.28Å; K70-L74 WeakPolarHBondContact O-CD1 3.12Å; K70-L74 PolarHBondContact O-N 2.87Å; D71-L74 PolarHBondContact O-N 2.94Å; L72-L74 VanDerWaalsContact C-N 3.32Å; L74-L77 PolarHBondContact O-N 3.39Å
75	N	33.9	Very low	39	Very low	95 Å²	95	118.5 Å²	118.5	51%	0.508	62%	0.615	S	S	.	*	H	α-helix	trans	-76.9	-30.2	-179.1	-76	-25.4	0	0	0	114	D71 L72 L77 D78 I79	D71-N75 VanDerWaalsContact O-CB 3.24Å; D71-N75 WeakPolarHBondContact O-CB 3.46Å; D71-N75 PolarHBondContact O-N 3.32Å; D71-N75 PolarHBondContact O-ND2 2.74Å; L72-N75 PolarHBondContact O-N 3Å; N75-L77 PolarHBondContact O-N 2.78Å; N75-D78 PolarHBondContact O-N 3.42Å; N75-D78 VanDerWaalsContact O-N 3.1Å; N75-I79 PolarHBondContact O-N 3.3Å
76	K	35.6	Very low	37.5	Very low	153 Å²	153	116.7 Å²	116.7	67%	0.665	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.5	-17.5	174.1	-90.4	-174.8	173.3	-177.8	0	112.8	L72 D78	L72-K76 HydrophobicContact CD2-CD 4.08Å; L72-K76 HydrophobicContact CD2-CG 4.29Å; L72-K76 WeakPolarHBondContact O-CB 3.47Å; L72-K76 WeakPolarHBondContact O-CG 3.49Å; L72-K76 PolarHBondContact O-N 3.39Å; K76-D78 VanDerWaalsContact C-N 3.32Å
77	L	39.2	Very low	36	Very low	134 Å²	134	118.2 Å²	118.2	70%	0.702	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.7	-20.4	173.8	-68.6	173	0	0	0	112.8	L73 L74 N75	L73-L77 WeakPolarHBondContact O-CG 3.28Å; L74-L77 PolarHBondContact O-N 3.39Å; N75-L77 PolarHBondContact O-N 2.78Å
78	D	34.3	Very low	34.9	Very low	146 Å²	146	124 Å²	124	78%	0.781	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110	-0.1	-175	-80.7	-19.3	0	0	0	115.4	N75 K76	N75-D78 PolarHBondContact O-N 3.42Å; N75-D78 VanDerWaalsContact O-N 3.1Å; K76-D78 VanDerWaalsContact C-N 3.32Å
79	I	28	Very low	33.8	Very low	134 Å²	134	129.9 Å²	129.9	69%	0.687	69%	0.688	S	S	*	*			trans	-104	106.6	-179.1	-58.3	171.4	0	0	0	111.1	N75	N75-I79 PolarHBondContact O-N 3.3Å
80	K	28.1	Very low	32.6	Very low	191 Å²	191	132.8 Å²	132.8	83%	0.83	71%	0.705	S	S	*	*			trans	-58.8	150.3	166.7	-87.9	-164.5	176	-176.3	0	111.6	G82	K80-G82 PolarHBondContact O-N 3.26Å
81	P	31	Very low	31.5	Very low	134 Å²	134	131.9 Å²	131.9	87%	0.87	71%	0.707	S	S	*	*			trans	-75.2	121.4	-164.4	31.1	-33	0	0	0	111.1
82	G	26.4	Very low	31.3	Very low	70 Å²	70	133.2 Å²	133.2	72%	0.722	72%	0.72	S	S	*	*			trans	-142.8	117.4	169.7	0	0	0	0	0	108.7	K80	K80-G82 PolarHBondContact O-N 3.26Å
83	N	25.4	Very low	31.3	Very low	167 Å²	167	135.9 Å²	135.9	89%	0.893	74%	0.739	S	S	*	*			trans	-44.5	134.3	-175.7	-61.4	-22.1	0	0	0	115.4
84	S	32.3	Very low	30.9	Very low	119 Å²	119	138.1 Å²	138.1	83%	0.832	75%	0.752	S	S	*	*			trans	-157.7	118.2	135.3	51	0	0	0	0	110.7
85	E	26.8	Very low	30.7	Very low	194 Å²	194	142 Å²	142	91%	0.907	76%	0.76	S	S	*	*			trans	-74	137.7	167.9	-64.9	163.5	155.6	0	0	109.2
86	S	28.2	Very low	30.6	Very low	91 Å²	91	143.9 Å²	143.9	64%	0.636	77%	0.77	S	S	*	*			trans	-149.9	105.7	145.5	79.7	0	0	0	0	109.4
87	S	23.5	Very low	30.5	Very low	114 Å²	114	145.6 Å²	145.6	80%	0.797	77%	0.774	S	S	*	*			trans	-70.1	120.7	170.1	-41.3	0	0	0	0	108.9
88	Y	31.6	Very low	30.5	Very low	202 Å²	202	147.1 Å²	147.1	79%	0.792	77%	0.771	S	S	*	*			trans	-117.5	112.5	161	-74.7	-78.5	0	0	0	108.1
89	E	28.3	Very low	30.7	Very low	186 Å²	186	144.7 Å²	144.7	87%	0.869	76%	0.758	S	S	*	*			trans	-69.9	124.6	169.2	-74.2	177.8	155.4	0	0	109.1
90	I	27.7	Very low	31.2	Very low	148 Å²	148	142.8 Å²	142.8	76%	0.759	75%	0.749	S	S	*	*			trans	-89.6	114.6	177.8	-60.8	170.2	0	0	0	107.4
91	N	27.9	Very low	31.7	Very low	121 Å²	121	141.4 Å²	141.4	65%	0.647	75%	0.745	S	S	*	*			trans	-74.1	125.4	174.2	-85.6	-43.9	0	0	0	110.5	T93	N91-T93 PolarHBondContact O-N 2.8Å; N91-T93 VanDerWaalsContact O-N 3.12Å
92	P	37.9	Very low	32.5	Very low	101 Å²	101	143.4 Å²	143.4	66%	0.656	74%	0.74	S	S	*	*	G	3₁₀ helix	trans	-69.1	-8.8	-173	-16.7	27.9	0	0	0	115.9	D94	P92-D94 VanDerWaalsContact C-N 3.27Å; P92-D94 PolarHBondContact O-N 3.34Å
93	T	35.1	Very low	33.1	Very low	131 Å²	131	144.8 Å²	144.8	80%	0.804	73%	0.731	S	S	*	*	G	3₁₀ helix	trans	-78.7	-3.8	-176.4	39.6	0	0	0	0	114.6	N91 Y95	N91-T93 PolarHBondContact O-N 2.8Å; N91-T93 VanDerWaalsContact O-N 3.12Å; T93-Y95 PolarHBondContact O-N 2.8Å
94	D	32.1	Very low	33.7	Very low	155 Å²	155	145 Å²	145	83%	0.829	72%	0.72	S	S	*	*	G	3₁₀ helix	trans	-77.5	-4.6	174.8	-102.3	-7.1	0	0	0	113.9	P92 N96	P92-D94 VanDerWaalsContact C-N 3.27Å; P92-D94 PolarHBondContact O-N 3.34Å; D94-N96 VanDerWaalsContact C-N 3.32Å; D94-N96 PolarHBondContact O-N 2.8Å
95	Y	32.4	Very low	34	Very low	195 Å²	195	143.4 Å²	143.4	77%	0.765	71%	0.707	S	S	*	*			trans	-81.3	80.2	167.6	-67.4	-77.3	0	0	0	110	T93 Y97	T93-Y95 PolarHBondContact O-N 2.8Å; Y95-Y97 PolarHBondContact O-N 3.05Å
96	N	31	Very low	34.6	Very low	135 Å²	135	141.2 Å²	141.2	72%	0.722	70%	0.702	S	S	*	*			trans	-67.5	91.6	154.3	-165.2	-11.4	0	0	0	106.9	D94 Y98	D94-N96 VanDerWaalsContact C-N 3.32Å; D94-N96 PolarHBondContact O-N 2.8Å; N96-Y98 VanDerWaalsContact C-N 3.35Å; N96-Y98 PolarHBondContact O-N 2.85Å
97	Y	32.7	Very low	35.1	Very low	190 Å²	190	142.6 Å²	142.6	75%	0.745	70%	0.698	S	S	*	*			trans	-54.3	97.7	176.2	-178.5	-98.8	0	0	0	108	Y95 D99	Y95-Y97 PolarHBondContact O-N 3.05Å; Y97-D99 PolarHBondContact O-N 3.26Å
98	Y	40.1	Very low	35.9	Very low	166 Å²	166	142.3 Å²	142.3	65%	0.651	70%	0.696	S	S	*	*			trans	-48.3	128	-176.8	-66.3	-82.7	0	0	0	110.4	N96 L100	N96-Y98 VanDerWaalsContact C-N 3.35Å; N96-Y98 PolarHBondContact O-N 2.85Å; Y98-L100 VanDerWaalsContact C-N 3.29Å; Y98-L100 PolarHBondContact O-N 3.1Å
99	D	38.5	Very low	36.1	Very low	95 Å²	95	137.5 Å²	137.5	51%	0.508	69%	0.692	S	S	.	*			trans	-58.4	90	173.1	-167.8	6.8	0	0	0	109.4	Y97 E101 K102	Y97-D99 PolarHBondContact O-N 3.26Å; D99-E101 PolarHBondContact O-N 3.27Å; D99-E101 VanDerWaalsContact O-N 3.08Å; D99-K102 PolarHBondContact O-N 3.49Å
100	L	37.8	Very low	36.8	Very low	93 Å²	93	136.4 Å²	136.4	49%	0.487	68%	0.681	S	S	.	*	H	α-helix	trans	-57.9	-23.2	-174.3	-69.3	172.1	0	0	0	111.8	Y98 K102 L103 Y104	Y98-L100 VanDerWaalsContact C-N 3.29Å; Y98-L100 PolarHBondContact O-N 3.1Å; L100-K102 VanDerWaalsContact C-N 3.25Å; L100-K102 PolarHBondContact O-N 3.19Å; L100-L103 PolarHBondContact O-N 2.79Å; L100-Y104 PolarHBondContact O-N 2.9Å
101	E	39.3	Very low	37.2	Very low	162 Å²	162	137.2 Å²	137.2	76%	0.757	68%	0.682	S	S	*	*	H	α-helix	trans	-64.6	-26.9	176.7	-61.4	-170.5	172.1	0	0	112.6	D99	D99-E101 PolarHBondContact O-N 3.27Å; D99-E101 VanDerWaalsContact O-N 3.08Å
102	K	48.4	Very low	37.7	Very low	176 Å²	176	138 Å²	138	77%	0.765	68%	0.684	S	S	*	*	H	α-helix	trans	-79	-24.4	175.1	-91.9	-177.6	178.4	174.3	0	114.2	D99 L100	D99-K102 PolarHBondContact O-N 3.49Å; L100-K102 VanDerWaalsContact C-N 3.25Å; L100-K102 PolarHBondContact O-N 3.19Å
103	L	39.3	Very low	37.7	Very low	100 Å²	100	140.1 Å²	140.1	52%	0.524	69%	0.689	S	S	.	*	H	α-helix	trans	-84.1	-23.7	-179.8	-71	174.7	0	0	0	112.3	L100 P105	L100-L103 PolarHBondContact O-N 2.79Å; L103-P105 WeakPolarHBondContact O-CD 3.35Å
104	Y	37.9	Very low	38.1	Very low	171 Å²	171	140.3 Å²	140.3	67%	0.671	69%	0.685	S	S	*	*	S	Bend	trans	-119.6	84.3	175.5	-69.7	-84.4	0	0	0	109.1	L100 N106	L100-Y104 PolarHBondContact O-N 2.9Å; Y104-N106 VanDerWaalsContact C-N 3.29Å; Y104-N106 PolarHBondContact O-N 2.87Å
105	P	37.3	Very low	38.6	Very low	85 Å²	85	141.1 Å²	141.1	55%	0.552	68%	0.684	S	S	*	*			trans	-62.5	98.9	168.7	26.5	-30.4	0	0	0	107.7	L103 E107	L103-P105 WeakPolarHBondContact O-CD 3.35Å; P105-E107 PolarHBondContact O-N 3.12Å
106	N	39.9	Very low	39.4	Very low	149 Å²	149	138.7 Å²	138.7	80%	0.797	68%	0.683	S	S	*	*			trans	18	73.4	154.1	45.8	-13	0	0	0	114.9	Y104 S108	Y104-N106 VanDerWaalsContact C-N 3.29Å; Y104-N106 PolarHBondContact O-N 2.87Å; N106-S108 PolarHBondContact O-N 2.96Å
107	E	39.1	Very low	40.5	Very low	119 Å²	119	138.8 Å²	138.8	56%	0.556	68%	0.682	S	S	*	*			trans	-76.3	75.2	172	-74.6	-173.5	134	0	0	110.1	P105 S109 Y110	P105-E107 PolarHBondContact O-N 3.12Å; E107-S109 PolarHBondContact O-N 3.4Å; E107-Y110 HydrophobicContact CB-CD2 4.39Å; E107-Y110 HydrophobicContact CB-CE2 4.3Å; E107-Y110 HydrophobicContact CG-CE2 4.26Å; E107-Y110 WeakPolarHBondContact OE1-CE2 3.25Å; E107-Y110 VanDerWaalsContact OE1-CZ 3.31Å; E107-Y110 PolarHBondContact OE1-OH 3.09Å; E107-Y110 WeakPolarHBondContact OE2-CE2 3.33Å
108	S	39.1	Very low	41.6	Very low	109 Å²	109	136.9 Å²	136.9	76%	0.762	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.4	104.5	144.6	160.9	0	0	0	0	107	N106	N106-S108 PolarHBondContact O-N 2.96Å
109	S	36	Very low	42.3	Very low	101 Å²	101	132.3 Å²	132.3	71%	0.706	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	135.7	27	155.4	-49.3	0	0	0	0	116	E107	E107-S109 PolarHBondContact O-N 3.4Å
110	Y	43	Very low	43.5	Very low	162 Å²	162	135.4 Å²	135.4	64%	0.635	69%	0.693	S	S	*	*			trans	-100.1	98.2	144.5	-50.7	-57.6	0	0	0	106.8	E107 I112	E107-Y110 HydrophobicContact CB-CD2 4.39Å; E107-Y110 HydrophobicContact CB-CE2 4.3Å; E107-Y110 HydrophobicContact CG-CE2 4.26Å; E107-Y110 WeakPolarHBondContact OE1-CE2 3.25Å; E107-Y110 VanDerWaalsContact OE1-CZ 3.31Å; E107-Y110 PolarHBondContact OE1-OH 3.09Å; E107-Y110 WeakPolarHBondContact OE2-CE2 3.33Å; Y110-I112 PolarHBondContact O-N 3.41Å
111	E	36.7	Very low	44.5	Very low	166 Å²	166	137 Å²	137	78%	0.776	70%	0.702	S	S	*	*			trans	-61.7	89.6	163.1	-68.7	-179.5	177.9	0	0	107.2	L113	E111-L113 HydrophobicContact CB-CD1 4.36Å; E111-L113 HydrophobicContact CB-CG 4.26Å; E111-L113 PolarHBondContact O-N 3Å
112	I	39.1	Very low	45.6	Very low	138 Å²	138	134.5 Å²	134.5	71%	0.708	70%	0.7	S	S	*	*			trans	-70.7	87.7	162.5	-59.1	173.2	0	0	0	104.7	Y110 D114	Y110-I112 PolarHBondContact O-N 3.41Å; I112-D114 HydrophobicContact CG2-CB 4.47Å; I112-D114 PolarHBondContact O-N 3.38Å
113	L	37	Very low	46.3	Very low	144 Å²	144	132.2 Å²	132.2	75%	0.754	70%	0.695	S	S	*	*			trans	-84.7	17.4	172.2	-82.9	167.2	0	0	0	112.5	E111 E115	E111-L113 HydrophobicContact CB-CD1 4.36Å; E111-L113 HydrophobicContact CB-CG 4.26Å; E111-L113 PolarHBondContact O-N 3Å; L113-E115 PolarHBondContact O-N 3.12Å
114	D	43.1	Very low	47.6	Very low	135 Å²	135	132.8 Å²	132.8	72%	0.722	71%	0.705	S	S	*	*	S	Bend	trans	-92.2	98.2	166	-68.9	-17.2	0	0	0	107.3	I112 I116	I112-D114 HydrophobicContact CG2-CB 4.47Å; I112-D114 PolarHBondContact O-N 3.38Å; D114-I116 PolarHBondContact O-N 3.46Å
115	E	43.2	Very low	49.6	Very low	172 Å²	172	129.4 Å²	129.4	80%	0.804	69%	0.694	S	S	*	*			trans	-42.1	111.7	161.3	-149.7	169.1	-150.4	0	0	107.2	L113 I117	L113-E115 PolarHBondContact O-N 3.12Å; E115-I117 PolarHBondContact O-N 2.92Å
116	I	49.5	Very low	51.7	Low	145 Å²	145	126.4 Å²	126.4	74%	0.744	67%	0.674	S	S	*	*			trans	-68.6	88.4	179.4	-60.2	172.2	0	0	0	106.1	D114 L118	D114-I116 PolarHBondContact O-N 3.46Å; I116-L118 VanDerWaalsContact C-N 3.35Å; I116-L118 HydrophobicContact CG2-CD2 4.11Å; I116-L118 HydrophobicContact CG2-CG 4.4Å; I116-L118 PolarHBondContact O-N 3.13Å
117	I	53.5	Low	54.1	Low	136 Å²	136	123.5 Å²	123.5	70%	0.697	66%	0.659	S	S	*	*			trans	-72.1	99.1	171.7	-58.5	174.9	0	0	0	105.8	E115 S119	E115-I117 PolarHBondContact O-N 2.92Å; I117-S119 PolarHBondContact O-N 3.07Å
118	L	55.7	Low	56.6	Low	151 Å²	151	119 Å²	119	79%	0.791	64%	0.638	S	S	*	*			trans	-65.6	82.4	162.5	-64.2	176	0	0	0	107.2	I116 D120	I116-L118 VanDerWaalsContact C-N 3.35Å; I116-L118 HydrophobicContact CG2-CD2 4.11Å; I116-L118 HydrophobicContact CG2-CG 4.4Å; I116-L118 PolarHBondContact O-N 3.13Å; L118-D120 PolarHBondContact O-N 2.69Å
119	S	54.8	Low	59.1	Low	70 Å²	70	122 Å²	122	49%	0.49	64%	0.64	S	S	.	*			trans	-66.6	119.4	169.7	165.2	0	0	0	0	108.2	I117 N121	I117-S119 PolarHBondContact O-N 3.07Å; S119-N121 PolarHBondContact O-N 2.64Å; S119-N121 PolarHBondContact OG-N 3.1Å; S119-N121 PolarHBondContact OG-O 3.21Å
120	D	64.5	Low	62	Low	159 Å²	159	118.7 Å²	118.7	85%	0.85	61%	0.612	S	S	*	*	S	Bend	trans	-57.9	-18	174	-75.1	-29.1	0	0	0	113	L118 P122	L118-D120 PolarHBondContact O-N 2.69Å; D120-P122 VanDerWaalsContact O-CD 3.24Å; D120-P122 WeakPolarHBondContact O-CD 3.39Å
121	N	58.8	Low	64.5	Low	126 Å²	126	111.1 Å²	111.1	67%	0.674	58%	0.583	S	S	*	*	S	Bend	trans	-94.9	105	172.5	-62.5	-42	0	0	0	109.1	S119 L123	S119-N121 PolarHBondContact O-N 2.64Å; S119-N121 PolarHBondContact OG-N 3.1Å; S119-N121 PolarHBondContact OG-O 3.21Å; N121-L123 PolarHBondContact O-N 3.35Å; N121-L123 VanDerWaalsContact O-N 3.15Å
122	P	61.1	Low	67.3	Low	110 Å²	110	104.7 Å²	104.7	71%	0.714	56%	0.555	S	S	*	*	P	Polyproline II helix	trans	-60	121.6	168.7	24.4	-31.4	0	0	0	107.9	D120	D120-P122 VanDerWaalsContact O-CD 3.24Å; D120-P122 WeakPolarHBondContact O-CD 3.39Å
123	L	63.2	Low	69.9	Low	128 Å²	128	99.3 Å²	99.3	67%	0.67	53%	0.528	S	S	*	.	P	Polyproline II helix	trans	-53	136.1	173.8	-71.3	168.9	0	0	0	108.9	N121 F125	N121-L123 PolarHBondContact O-N 3.35Å; N121-L123 VanDerWaalsContact O-N 3.15Å; L123-F125 PolarHBondContact O-N 3.12Å
124	P	67.9	Low	72.7	Confident	112 Å²	112	98.9 Å²	98.9	73%	0.727	52%	0.522	S	S	*	.	P	Polyproline II helix	trans	-59.3	132.1	-178.9	23.5	-32.3	0	0	0	109.9
125	F	78.8	Confident	75.1	Confident	101 Å²	101	98.2 Å²	98.2	44%	0.443	51%	0.514	S	S	.	.	P	Polyproline II helix	trans	-61.5	125.7	175.5	-60.1	-68.1	0	0	0	109.1	L123 N127 G230 R233	L123-F125 PolarHBondContact O-N 3.12Å; F125-N127 PolarHBondContact O-N 2.98Å; F125-N127 VanDerWaalsContact O-N 3.13Å; F125-G230 WeakPolarHBondContact CD2-O 3.31Å; F125-R233 HydrophobicContact CD1-CB 4.17Å
126	P	82.3	Confident	77.6	Confident	22 Å²	22	91 Å²	91	14%	0.143	48%	0.48	C	S	.	.	P	Polyproline II helix	trans	-58.8	125	177.4	23.4	-31.8	0	0	0	108.7
127	N	88.9	Confident	79.8	Confident	88 Å²	88	87.5 Å²	87.5	47%	0.471	47%	0.466	S	S	.	.			trans	-143.1	158.1	178.2	-162.3	15.4	0	0	0	110.3	F125 W130	F125-N127 PolarHBondContact O-N 2.98Å; F125-N127 VanDerWaalsContact O-N 3.13Å; N127-W130 PolarHBondContact OD1-NE1 3.36Å
128	I	92.1	Very high	81.8	Confident	23 Å²	23	83.6 Å²	83.6	12%	0.118	45%	0.449	C	S	.	.			trans	-125.4	160.6	177.7	63	164.2	0	0	0	110.1	W130 K144 K147 Y148	I128-W130 HydrophobicContact CD1-CD2 4.22Å; I128-W130 HydrophobicContact CD1-CE3 4.26Å; I128-W130 HydrophobicContact CD1-CH2 3.96Å; I128-W130 HydrophobicContact CD1-CZ2 3.89Å; I128-W130 HydrophobicContact CD1-CZ3 4.14Å; I128-W130 HydrophobicContact CG1-CD2 4.13Å; I128-W130 HydrophobicContact CG1-CH2 4.45Å; I128-W130 HydrophobicContact CG1-CZ2 3.88Å; I128-W130 PolarHBondContact O-N 2.85Å; I128-W130 VanDerWaalsContact O-N 3.13Å; I128-K144 HydrophobicContact CD1-CB 4.22Å; I128-K144 HydrophobicContact CD1-CD 4.31Å; I128-K144 WeakPolarHBondContact CD1-O 3.39Å; I128-K147 HydrophobicContact CD1-CB 4.43Å; I128-K147 HydrophobicContact CG2-CD 4.49Å; I128-K147 HydrophobicContact CG2-CG 4.27Å; I128-Y148 HydrophobicContact CG1-CD2 4.26Å
129	Q	93	Very high	83.7	Confident	174 Å²	174	83.4 Å²	83.4	81%	0.813	44%	0.442	S	S	*	.			trans	-73.8	103.9	168.6	-68.9	-179.2	-2.8	0	0	109.7	K144	Q129-K144 PolarHBondContact O-NZ 2.88Å
130	W	95.3	Very high	85.7	Confident	30 Å²	30	82 Å²	82	11%	0.114	43%	0.429	C	S	.	.	P	Polyproline II helix	trans	-71.4	149.3	171.2	-65.9	101	0	0	0	110.7	N127 I128 K144 I145 Y148 T213 I214 V216 P229	N127-W130 PolarHBondContact OD1-NE1 3.36Å; I128-W130 HydrophobicContact CD1-CD2 4.22Å; I128-W130 HydrophobicContact CD1-CE3 4.26Å; I128-W130 HydrophobicContact CD1-CH2 3.96Å; I128-W130 HydrophobicContact CD1-CZ2 3.89Å; I128-W130 HydrophobicContact CD1-CZ3 4.14Å; I128-W130 HydrophobicContact CG1-CD2 4.13Å; I128-W130 HydrophobicContact CG1-CH2 4.45Å; I128-W130 HydrophobicContact CG1-CZ2 3.88Å; I128-W130 PolarHBondContact O-N 2.85Å; I128-W130 VanDerWaalsContact O-N 3.13Å; W130-K144 HydrophobicContact CE3-CB 3.99Å; W130-K144 HydrophobicContact CZ3-CB 3.74Å; W130-I145 HydrophobicContact CH2-CG1 4.42Å; W130-I145 HydrophobicContact CZ3-CG1 4.38Å; W130-Y148 HydrophobicContact CH2-CG 4.24Å; W130-Y148 HydrophobicContact CZ2-CD1 4.33Å; W130-Y148 HydrophobicContact CZ2-CD2 4.1Å; W130-Y148 AromaticContact CZ2-CG 3.9Å; W130-Y148 HydrophobicContact CZ2-CG 3.9Å; W130-T213 HydrophobicContact CB-CG2 3.7Å; W130-T213 WeakPolarHBondContact O-CG2 3.04Å; W130-I214 HydrophobicContact CB-CG1 4.32Å; W130-V216 HydrophobicContact CD2-CB 4.25Å; W130-V216 HydrophobicContact CD2-CG1 4.48Å; W130-V216 HydrophobicContact CD2-CG2 3.63Å; W130-V216 HydrophobicContact CE3-CB 4.47Å; W130-V216 HydrophobicContact CE3-CG1 4.41Å; W130-V216 HydrophobicContact CE3-CG2 3.66Å; W130-V216 HydrophobicContact CG-CG2 4.01Å; W130-V216 HydrophobicContact CH2-CG1 3.85Å; W130-V216 HydrophobicContact CZ2-CB 4.41Å; W130-V216 HydrophobicContact CZ2-CG1 3.94Å; W130-V216 HydrophobicContact CZ3-CG1 4.09Å; W130-V216 HydrophobicContact CZ3-CG2 4.15Å; W130-P229 HydrophobicContact CZ2-CB 3.92Å; W130-P229 HydrophobicContact CZ2-CG 3.68Å
131	P	95.2	Very high	87.2	Confident	3 Å²	3	74.4 Å²	74.4	2%	0.019	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-69.7	158.6	-177.1	29.9	-34.7	0	0	0	111.9	E135 F136 L140 T213 I214	P131-E135 HydrophobicContact CB-CB 4.43Å; P131-F136 HydrophobicContact CG-CD2 3.98Å; P131-L140 HydrophobicContact CB-CD2 3.78Å; P131-L140 HydrophobicContact CG-CD2 4.3Å; P131-T213 WeakPolarHBondContact O-CG2 3.17Å; P131-I214 HydrophobicContact CG-CD1 3.77Å; P131-I214 HydrophobicContact CG-CG1 4.14Å; P131-I214 WeakPolarHBondContact O-CG1 3.27Å; P131-I214 PolarHBondContact O-N 2.98Å; P131-I214 VanDerWaalsContact O-N 3.08Å
132	T	96.2	Very high	89.1	Confident	32 Å²	32	70.1 Å²	70.1	20%	0.196	37%	0.365	C	S	.	.	B	Isolated β-bridge	trans	-71.4	164.9	167.9	60.5	0	0	0	0	111.3	E134 E135 F136 S212	T132-E134 PolarHBondContact O-N 2.88Å; T132-E135 PolarHBondContact N-OE2 3.18Å; T132-E135 PolarHBondContact O-N 3.45Å; T132-E135 WeakPolarHBondContact OG1-CB 3.21Å; T132-E135 WeakPolarHBondContact OG1-CG 3.47Å; T132-E135 PolarHBondContact OG1-N 2.86Å; T132-E135 PolarHBondContact OG1-OE2 2.9Å; T132-F136 PolarHBondContact O-N 2.83Å; T132-S212 CarbonylContact C-O 3.55Å; T132-S212 WeakPolarHBondContact CA-O 3.37Å
133	I	94.6	Very high	90.8	Very high	25 Å²	25	69.3 Å²	69.3	13%	0.128	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-35.7	175.7	-72.7	167.8	0	0	0	111	I204 K208 K210 S212 I214	I133-I204 HydrophobicContact CB-CG2 4.49Å; I133-I204 HydrophobicContact CG1-CG2 4.32Å; I133-I204 HydrophobicContact CG2-CG2 3.82Å; I133-K208 HydrophobicContact CD1-CB 3.75Å; I133-K210 PolarHBondContact N-O 3.42Å; I133-S212 WeakPolarHBondContact CG1-O 2.83Å; I133-S212 PolarHBondContact N-O 3.04Å; I133-I214 HydrophobicContact CG1-CG2 4.12Å
134	E	94.2	Very high	92.4	Very high	135 Å²	135	65.4 Å²	65.4	63%	0.631	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-43	179.3	-168.3	159.4	-159.9	0	0	113.7	T132 F136 K210	T132-E134 PolarHBondContact O-N 2.88Å; E134-F136 VanDerWaalsContact C-N 3.26Å; E134-F136 PolarHBondContact O-N 3.42Å; E134-K210 HydrophobicContact CB-CB 4.16Å; E134-K210 PolarHBondContact N-O 2.87Å
135	E	94.9	Very high	93.8	Very high	121 Å²	121	60.1 Å²	60.1	57%	0.565	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-14.7	-177.1	-66.7	164.4	157.3	0	0	112.8	P131 T132 T137 L140	P131-E135 HydrophobicContact CB-CB 4.43Å; T132-E135 PolarHBondContact N-OE2 3.18Å; T132-E135 PolarHBondContact O-N 3.45Å; T132-E135 WeakPolarHBondContact OG1-CB 3.21Å; T132-E135 WeakPolarHBondContact OG1-CG 3.47Å; T132-E135 PolarHBondContact OG1-N 2.86Å; T132-E135 PolarHBondContact OG1-OE2 2.9Å; E135-T137 PolarHBondContact O-N 3.08Å; E135-L140 HydrophobicContact CB-CD2 4.47Å; E135-L140 WeakPolarHBondContact O-CD2 3.4Å
136	F	95.8	Very high	94.6	Very high	21 Å²	21	58.5 Å²	58.5	9%	0.092	29%	0.289	C	S	.	.			trans	-65.1	127.4	-172.3	-179.7	-89.7	0	0	0	112.1	P131 T132 E134 H176 L202 I204 I214	P131-F136 HydrophobicContact CG-CD2 3.98Å; T132-F136 PolarHBondContact O-N 2.83Å; E134-F136 VanDerWaalsContact C-N 3.26Å; E134-F136 PolarHBondContact O-N 3.42Å; F136-H176 HydrophobicContact CE1-CB 4.35Å; F136-H176 AromaticContact CE1-CD2 3.53Å; F136-H176 AromaticContact CE1-CE1 3.82Å; F136-H176 AromaticContact CE1-CG 3.63Å; F136-H176 AromaticContact CE1-ND1 3.82Å; F136-H176 AromaticContact CE1-NE2 3.66Å; F136-H176 HydrophobicContact CZ-CB 3.96Å; F136-H176 AromaticContact CZ-CD2 3.99Å; F136-H176 AromaticContact CZ-CG 3.74Å; F136-L202 HydrophobicContact CD2-CD2 4.45Å; F136-L202 HydrophobicContact CE2-CB 4.36Å; F136-L202 HydrophobicContact CE2-CD2 3.53Å; F136-L202 HydrophobicContact CZ-CD2 4.21Å; F136-I204 HydrophobicContact CB-CD1 4.39Å; F136-I204 HydrophobicContact CD1-CD1 3.1Å; F136-I204 HydrophobicContact CD1-CG1 4.1Å; F136-I204 HydrophobicContact CE1-CD1 3.41Å; F136-I204 VanDerWaalsContact CE1-CD1 3.41Å; F136-I204 HydrophobicContact CE1-CG1 4.39Å; F136-I204 HydrophobicContact CG-CD1 3.8Å; F136-I204 HydrophobicContact CG-CG1 4.4Å; F136-I204 HydrophobicContact CZ-CD1 4.32Å; F136-I214 HydrophobicContact CB-CG2 4.19Å; F136-I214 HydrophobicContact CD2-CD1 3.81Å; F136-I214 HydrophobicContact CD2-CG2 4.44Å; F136-I214 HydrophobicContact CE2-CD1 4.1Å; F136-I214 HydrophobicContact CG-CG2 4.45Å
137	T	95.3	Very high	95.2	Very high	70 Å²	70	63.6 Å²	63.6	43%	0.429	31%	0.309	S	S	.	.			trans	-128.4	153.7	163.1	62.5	0	0	0	0	109.2	E135 K139 L140 G141	E135-T137 PolarHBondContact O-N 3.08Å; T137-K139 PolarHBondContact O-N 3.42Å; T137-K139 VanDerWaalsContact O-N 3.15Å; T137-L140 PolarHBondContact O-N 2.82Å; T137-L140 VanDerWaalsContact O-N 3.07Å; T137-L140 WeakPolarHBondContact OG1-CB 3.06Å; T137-L140 PolarHBondContact OG1-N 3.21Å; T137-L140 VanDerWaalsContact OG1-N 3.11Å; T137-G141 PolarHBondContact O-N 3.05Å
138	P	95	Very high	95.5	Very high	54 Å²	54	59.4 Å²	59.4	35%	0.351	29%	0.286	S	S	.	.	H	α-helix	trans	-55.9	-33.6	177.4	-26.9	34.5	0	0	0	113.6	L142 Y178	P138-L142 PolarHBondContact O-N 3.45Å; P138-Y178 WeakPolarHBondContact CA-OH 3.43Å; P138-Y178 PolarHBondContact O-OH 2.83Å
139	K	96.4	Very high	95.6	Very high	147 Å²	147	58.5 Å²	58.5	64%	0.639	28%	0.281	S	S	*	.	H	α-helix	trans	-70.3	-45.7	175.2	-172.1	-177.3	175.5	-173.7	0	111.8	T137 G141 L142 E143	T137-K139 PolarHBondContact O-N 3.42Å; T137-K139 VanDerWaalsContact O-N 3.15Å; K139-G141 VanDerWaalsContact C-N 3.25Å; K139-G141 PolarHBondContact O-N 3.13Å; K139-L142 WeakPolarHBondContact O-CB 3.14Å; K139-L142 PolarHBondContact O-N 3.33Å; K139-L142 VanDerWaalsContact O-N 3.1Å; K139-E143 PolarHBondContact O-N 3.41Å
140	L	96.5	Very high	95.6	Very high	41 Å²	41	57.6 Å²	57.6	22%	0.215	28%	0.275	C	S	.	.	H	α-helix	trans	-60.7	-37.4	174.5	-176.7	66.1	0	0	0	111.5	P131 E135 T137 L142 E143 K144	P131-L140 HydrophobicContact CB-CD2 3.78Å; P131-L140 HydrophobicContact CG-CD2 4.3Å; E135-L140 HydrophobicContact CB-CD2 4.47Å; E135-L140 WeakPolarHBondContact O-CD2 3.4Å; T137-L140 PolarHBondContact O-N 2.82Å; T137-L140 VanDerWaalsContact O-N 3.07Å; T137-L140 WeakPolarHBondContact OG1-CB 3.06Å; T137-L140 PolarHBondContact OG1-N 3.21Å; T137-L140 VanDerWaalsContact OG1-N 3.11Å; L140-L142 VanDerWaalsContact C-N 3.33Å; L140-L142 PolarHBondContact O-N 2.83Å; L140-E143 PolarHBondContact O-N 3.22Å; L140-K144 HydrophobicContact CD1-CG 4.46Å; L140-K144 HydrophobicContact CG-CG 4.39Å; L140-K144 WeakPolarHBondContact O-CB 3.36Å; L140-K144 WeakPolarHBondContact O-CG 3.48Å; L140-K144 PolarHBondContact O-N 3.47Å
141	G	96.6	Very high	95.5	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-57	-45.1	172.7	0	0	0	0	0	112.6	T137 K139 K144 I145	T137-G141 PolarHBondContact O-N 3.05Å; K139-G141 VanDerWaalsContact C-N 3.25Å; K139-G141 PolarHBondContact O-N 3.13Å; G141-K144 PolarHBondContact O-N 2.83Å; G141-I145 VanDerWaalsContact O-CG1 3.25Å; G141-I145 WeakPolarHBondContact O-CG1 3.5Å; G141-I145 PolarHBondContact O-N 2.95Å
142	L	97.2	Very high	95.3	Very high	36 Å²	36	57.7 Å²	57.7	19%	0.188	28%	0.279	C	S	.	.	H	α-helix	trans	-61.2	-49.9	176.1	-176.5	152.8	0	0	0	111.4	P138 K139 L140 K144 I145 E146 I162 I164 Y178	P138-L142 PolarHBondContact O-N 3.45Å; K139-L142 WeakPolarHBondContact O-CB 3.14Å; K139-L142 PolarHBondContact O-N 3.33Å; K139-L142 VanDerWaalsContact O-N 3.1Å; L140-L142 VanDerWaalsContact C-N 3.33Å; L140-L142 PolarHBondContact O-N 2.83Å; L142-K144 VanDerWaalsContact C-N 3.27Å; L142-K144 PolarHBondContact O-N 3.48Å; L142-I145 PolarHBondContact O-N 3.43Å; L142-I145 VanDerWaalsContact O-N 3.13Å; L142-E146 HydrophobicContact CD2-CG 4.19Å; L142-E146 WeakPolarHBondContact CD2-OE1 3.44Å; L142-E146 PolarHBondContact O-N 3.5Å; L142-I162 HydrophobicContact CG-CG2 4.49Å; L142-I164 HydrophobicContact CD1-CD1 4.04Å; L142-I164 HydrophobicContact CD1-CG1 4.02Å; L142-Y178 HydrophobicContact CB-CE1 4.08Å
143	E	97.1	Very high	94.8	Very high	92 Å²	92	62.8 Å²	62.8	43%	0.43	30%	0.301	S	S	.	.	H	α-helix	trans	-59.4	-38.3	179	-68.5	173.3	-170.5	0	0	112.1	K139 L140 E146 K147	K139-E143 PolarHBondContact O-N 3.41Å; L140-E143 PolarHBondContact O-N 3.22Å; E143-E146 PolarHBondContact O-N 2.81Å; E143-K147 PolarHBondContact O-N 3.35Å
144	K	97.1	Very high	94.7	Very high	47 Å²	47	63.1 Å²	63.1	20%	0.204	30%	0.302	C	S	.	.	H	α-helix	trans	-69.7	-39.6	176.5	-68.5	-76.7	-176.5	169.8	0	111.9	I128 Q129 W130 L140 G141 L142 K147 Y148	I128-K144 HydrophobicContact CD1-CB 4.22Å; I128-K144 HydrophobicContact CD1-CD 4.31Å; I128-K144 WeakPolarHBondContact CD1-O 3.39Å; Q129-K144 PolarHBondContact O-NZ 2.88Å; W130-K144 HydrophobicContact CE3-CB 3.99Å; W130-K144 HydrophobicContact CZ3-CB 3.74Å; L140-K144 HydrophobicContact CD1-CG 4.46Å; L140-K144 HydrophobicContact CG-CG 4.39Å; L140-K144 WeakPolarHBondContact O-CB 3.36Å; L140-K144 WeakPolarHBondContact O-CG 3.48Å; L140-K144 PolarHBondContact O-N 3.47Å; G141-K144 PolarHBondContact O-N 2.83Å; L142-K144 VanDerWaalsContact C-N 3.27Å; L142-K144 PolarHBondContact O-N 3.48Å; K144-K147 PolarHBondContact O-N 2.62Å; K144-Y148 WeakPolarHBondContact O-CB 3.29Å; K144-Y148 PolarHBondContact O-N 3.28Å
145	I	96.8	Very high	94.6	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-62.8	-43.7	173.8	-68	164.1	0	0	0	110.2	W130 G141 L142 K147 Y148 I149 I162 Y178 V180 F200 L202	W130-I145 HydrophobicContact CH2-CG1 4.42Å; W130-I145 HydrophobicContact CZ3-CG1 4.38Å; G141-I145 VanDerWaalsContact O-CG1 3.25Å; G141-I145 WeakPolarHBondContact O-CG1 3.5Å; G141-I145 PolarHBondContact O-N 2.95Å; L142-I145 PolarHBondContact O-N 3.43Å; L142-I145 VanDerWaalsContact O-N 3.13Å; I145-K147 VanDerWaalsContact C-N 3.32Å; I145-K147 PolarHBondContact O-N 3.21Å; I145-Y148 WeakPolarHBondContact O-CB 3.38Å; I145-Y148 PolarHBondContact O-N 3.08Å; I145-Y148 VanDerWaalsContact O-N 3.09Å; I145-I149 HydrophobicContact CG2-CD1 3.78Å; I145-I149 HydrophobicContact CG2-CG1 4.28Å; I145-I149 WeakPolarHBondContact O-CG1 3.39Å; I145-I149 PolarHBondContact O-N 2.91Å; I145-I162 HydrophobicContact CG2-CD1 3.96Å; I145-Y178 HydrophobicContact CD1-CD1 3.97Å; I145-Y178 HydrophobicContact CD1-CD2 3.45Å; I145-Y178 VanDerWaalsContact CD1-CD2 3.45Å; I145-Y178 HydrophobicContact CD1-CE1 4.39Å; I145-Y178 HydrophobicContact CD1-CE2 3.95Å; I145-Y178 HydrophobicContact CD1-CG 3.47Å; I145-Y178 VanDerWaalsContact CD1-CG 3.47Å; I145-V180 HydrophobicContact CG2-CG2 4.07Å; I145-F200 HydrophobicContact CD1-CB 3.95Å; I145-F200 HydrophobicContact CD1-CD1 4.48Å; I145-F200 HydrophobicContact CD1-CG 4.22Å; I145-F200 HydrophobicContact CG1-CD1 4.14Å; I145-F200 HydrophobicContact CG1-CG 4.32Å; I145-F200 HydrophobicContact CG2-CD1 4.36Å; I145-F200 HydrophobicContact CG2-CD2 4.11Å; I145-F200 HydrophobicContact CG2-CE1 4.28Å; I145-F200 HydrophobicContact CG2-CE2 4.02Å; I145-F200 HydrophobicContact CG2-CG 4.25Å; I145-F200 HydrophobicContact CG2-CZ 4.06Å; I145-L202 HydrophobicContact CD1-CD1 3.84Å; I145-L202 HydrophobicContact CG1-CD1 4.26Å
146	E	96	Very high	94.3	Very high	68 Å²	68	60.7 Å²	60.7	32%	0.318	30%	0.301	S	S	.	.	H	α-helix	trans	-58.5	-44.7	174.9	-72.3	-175.8	170.7	0	0	111.8	L142 E143 Y148 I149 K150 I162	L142-E146 HydrophobicContact CD2-CG 4.19Å; L142-E146 WeakPolarHBondContact CD2-OE1 3.44Å; L142-E146 PolarHBondContact O-N 3.5Å; E143-E146 PolarHBondContact O-N 2.81Å; E146-Y148 VanDerWaalsContact C-N 3.27Å; E146-Y148 PolarHBondContact O-N 3.36Å; E146-I149 PolarHBondContact O-N 3.17Å; E146-K150 WeakPolarHBondContact O-CG 3.36Å; E146-K150 PolarHBondContact O-N 2.81Å; E146-K150 VanDerWaalsContact O-N 3.12Å; E146-I162 HydrophobicContact CG-CD1 3.48Å; E146-I162 VanDerWaalsContact CG-CD1 3.48Å
147	K	95.6	Very high	94.1	Very high	129 Å²	129	66.8 Å²	66.8	56%	0.561	33%	0.327	S	S	*	.	H	α-helix	trans	-61.3	-37.6	175.5	-170.3	176.8	-179.2	172.6	0	111.8	I128 E143 K144 I145	I128-K147 HydrophobicContact CD1-CB 4.43Å; I128-K147 HydrophobicContact CG2-CD 4.49Å; I128-K147 HydrophobicContact CG2-CG 4.27Å; E143-K147 PolarHBondContact O-N 3.35Å; K144-K147 PolarHBondContact O-N 2.62Å; I145-K147 VanDerWaalsContact C-N 3.32Å; I145-K147 PolarHBondContact O-N 3.21Å
148	Y	95.5	Very high	94	Very high	0 Å²	0	64 Å²	64	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-70.7	-42.6	177.8	-174.7	-113.8	0	0	0	112.4	I128 W130 K144 I145 E146 K150 S151 W152 F200 Y218 P229	I128-Y148 HydrophobicContact CG1-CD2 4.26Å; W130-Y148 HydrophobicContact CH2-CG 4.24Å; W130-Y148 HydrophobicContact CZ2-CD1 4.33Å; W130-Y148 HydrophobicContact CZ2-CD2 4.1Å; W130-Y148 AromaticContact CZ2-CG 3.9Å; W130-Y148 HydrophobicContact CZ2-CG 3.9Å; K144-Y148 WeakPolarHBondContact O-CB 3.29Å; K144-Y148 PolarHBondContact O-N 3.28Å; I145-Y148 WeakPolarHBondContact O-CB 3.38Å; I145-Y148 PolarHBondContact O-N 3.08Å; I145-Y148 VanDerWaalsContact O-N 3.09Å; E146-Y148 VanDerWaalsContact C-N 3.27Å; E146-Y148 PolarHBondContact O-N 3.36Å; Y148-K150 VanDerWaalsContact C-N 3.27Å; Y148-K150 PolarHBondContact O-N 3.18Å; Y148-S151 WeakPolarHBondContact O-CA 3.47Å; Y148-S151 WeakPolarHBondContact O-CB 3.33Å; Y148-S151 PolarHBondContact O-N 3.44Å; Y148-S151 PolarHBondContact O-OG 2.77Å; Y148-W152 AromaticContact CD1-CE2 3.96Å; Y148-W152 HydrophobicContact CD1-CZ2 4.09Å; Y148-W152 AromaticContact CD1-NE1 3.39Å; Y148-W152 AromaticContact CE1-CE2 3.76Å; Y148-W152 AromaticContact CE1-CZ2 3.9Å; Y148-W152 HydrophobicContact CE1-CZ2 3.9Å; Y148-W152 AromaticContact CE1-NE1 3.04Å; Y148-W152 AromaticContact CZ-NE1 3.52Å; Y148-F200 AromaticContact CD1-CE1 3.75Å; Y148-F200 HydrophobicContact CD1-CE1 3.75Å; Y148-F200 AromaticContact CD1-CZ 3.99Å; Y148-F200 HydrophobicContact CD1-CZ 3.99Å; Y148-F200 HydrophobicContact CE1-CE1 4.09Å; Y148-F200 HydrophobicContact CE1-CZ 4.35Å; Y148-Y218 HydrophobicContact CE1-CD1 4.25Å; Y148-Y218 AromaticContact CE1-CE1 3.79Å; Y148-Y218 HydrophobicContact CE1-CE1 3.79Å; Y148-P229 HydrophobicContact CD2-CB 4.39Å; Y148-P229 HydrophobicContact CE1-CB 4.33Å; Y148-P229 HydrophobicContact CE1-CG 4.07Å; Y148-P229 HydrophobicContact CE2-CB 3.72Å; Y148-P229 HydrophobicContact CE2-CG 4.33Å; Y148-P229 WeakPolarHBondContact OH-CA 3.41Å
149	I	94.2	Very high	94	Very high	3 Å²	3	66.3 Å²	66.3	2%	0.015	32%	0.318	C	S	.	.	H	α-helix	trans	-60.5	-39.4	176.7	-67.1	162.6	0	0	0	110.8	I145 E146 S151 W152 Y160 I162 V180 F200	I145-I149 HydrophobicContact CG2-CD1 3.78Å; I145-I149 HydrophobicContact CG2-CG1 4.28Å; I145-I149 WeakPolarHBondContact O-CG1 3.39Å; I145-I149 PolarHBondContact O-N 2.91Å; E146-I149 PolarHBondContact O-N 3.17Å; I149-S151 PolarHBondContact O-N 3.4Å; I149-S151 VanDerWaalsContact O-N 3.12Å; I149-W152 HydrophobicContact CB-CD2 4.48Å; I149-W152 HydrophobicContact CB-CE3 4.34Å; I149-W152 HydrophobicContact CG1-CD2 4.47Å; I149-W152 HydrophobicContact CG1-CE3 4.22Å; I149-W152 HydrophobicContact CG1-CH2 4.05Å; I149-W152 HydrophobicContact CG1-CZ2 4.32Å; I149-W152 HydrophobicContact CG1-CZ3 3.99Å; I149-W152 HydrophobicContact CG2-CD2 4.49Å; I149-W152 HydrophobicContact CG2-CE3 3.97Å; I149-W152 HydrophobicContact CG2-CZ3 4.29Å; I149-W152 VanDerWaalsContact O-CB 3.29Å; I149-W152 WeakPolarHBondContact O-CB 3.26Å; I149-W152 PolarHBondContact O-N 3.05Å; I149-Y160 HydrophobicContact CD1-CD2 4.17Å; I149-Y160 HydrophobicContact CD1-CE2 4.1Å; I149-Y160 HydrophobicContact CG2-CD1 4.17Å; I149-Y160 HydrophobicContact CG2-CE1 4.01Å; I149-Y160 HydrophobicContact CG2-CE2 4.46Å; I149-Y160 HydrophobicContact CG2-CG 4.47Å; I149-I162 HydrophobicContact CD1-CD1 3.85Å; I149-I162 HydrophobicContact CD1-CG1 4.42Å; I149-V180 HydrophobicContact CD1-CB 4.38Å; I149-V180 HydrophobicContact CD1-CG1 3.67Å; I149-V180 HydrophobicContact CD1-CG2 3.81Å; I149-F200 HydrophobicContact CG1-CZ 4.48Å
150	K	92.3	Very high	93.9	Very high	155 Å²	155	63.1 Å²	63.1	67%	0.674	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-60.2	-20.9	174.8	-71.3	175.2	-176	179.2	0	113.4	E146 Y148	E146-K150 WeakPolarHBondContact O-CG 3.36Å; E146-K150 PolarHBondContact O-N 2.81Å; E146-K150 VanDerWaalsContact O-N 3.12Å; Y148-K150 VanDerWaalsContact C-N 3.27Å; Y148-K150 PolarHBondContact O-N 3.18Å
151	S	92	Very high	93.9	Very high	28 Å²	28	64.2 Å²	64.2	20%	0.196	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-86.4	-3.1	175.8	76.5	0	0	0	0	114.3	Y148 I149 E153	Y148-S151 WeakPolarHBondContact O-CA 3.47Å; Y148-S151 WeakPolarHBondContact O-CB 3.33Å; Y148-S151 PolarHBondContact O-N 3.44Å; Y148-S151 PolarHBondContact O-OG 2.77Å; I149-S151 PolarHBondContact O-N 3.4Å; I149-S151 VanDerWaalsContact O-N 3.12Å; S151-E153 PolarHBondContact O-N 3.25Å
152	W	91.2	Very high	93.9	Very high	8 Å²	8	65.5 Å²	65.5	3%	0.03	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-76	-7.4	-177.8	-68.5	-8.5	0	0	0	114.6	Y148 I149 I154 L182 V198 F200 Y218 F234	Y148-W152 AromaticContact CD1-CE2 3.96Å; Y148-W152 HydrophobicContact CD1-CZ2 4.09Å; Y148-W152 AromaticContact CD1-NE1 3.39Å; Y148-W152 AromaticContact CE1-CE2 3.76Å; Y148-W152 AromaticContact CE1-CZ2 3.9Å; Y148-W152 HydrophobicContact CE1-CZ2 3.9Å; Y148-W152 AromaticContact CE1-NE1 3.04Å; Y148-W152 AromaticContact CZ-NE1 3.52Å; I149-W152 HydrophobicContact CB-CD2 4.48Å; I149-W152 HydrophobicContact CB-CE3 4.34Å; I149-W152 HydrophobicContact CG1-CD2 4.47Å; I149-W152 HydrophobicContact CG1-CE3 4.22Å; I149-W152 HydrophobicContact CG1-CH2 4.05Å; I149-W152 HydrophobicContact CG1-CZ2 4.32Å; I149-W152 HydrophobicContact CG1-CZ3 3.99Å; I149-W152 HydrophobicContact CG2-CD2 4.49Å; I149-W152 HydrophobicContact CG2-CE3 3.97Å; I149-W152 HydrophobicContact CG2-CZ3 4.29Å; I149-W152 VanDerWaalsContact O-CB 3.29Å; I149-W152 WeakPolarHBondContact O-CB 3.26Å; I149-W152 PolarHBondContact O-N 3.05Å; W152-I154 HydrophobicContact CB-CG2 3.87Å; W152-I154 PolarHBondContact O-N 3.01Å; W152-I154 VanDerWaalsContact O-N 3.12Å; W152-L182 HydrophobicContact CZ3-CD2 4.46Å; W152-V198 HydrophobicContact CH2-CB 4.47Å; W152-V198 HydrophobicContact CH2-CG1 4.12Å; W152-V198 HydrophobicContact CH2-CG2 4.45Å; W152-F200 AromaticContact CH2-CE2 3.82Å; W152-F200 HydrophobicContact CH2-CE2 3.82Å; W152-F200 AromaticContact CH2-CZ 3.67Å; W152-F200 HydrophobicContact CH2-CZ 3.67Å; W152-F200 HydrophobicContact CZ2-CE1 4.4Å; W152-F200 HydrophobicContact CZ2-CE2 4.07Å; W152-F200 AromaticContact CZ2-CZ 3.42Å; W152-F200 HydrophobicContact CZ2-CZ 3.42Å; W152-F200 VanDerWaalsContact CZ2-CZ 3.42Å; W152-Y218 HydrophobicContact CZ2-CE2 4.36Å; W152-F234 HydrophobicContact CB-CB 4.1Å; W152-F234 HydrophobicContact CB-CD1 3.9Å; W152-F234 HydrophobicContact CB-CG 4.16Å; W152-F234 AromaticContact CD1-CG 3.99Å; W152-F234 HydrophobicContact CD2-CB 3.95Å; W152-F234 AromaticContact CD2-CD1 3.73Å; W152-F234 HydrophobicContact CD2-CD1 3.73Å; W152-F234 AromaticContact CD2-CD2 3.71Å; W152-F234 HydrophobicContact CD2-CD2 3.71Å; W152-F234 HydrophobicContact CD2-CE1 4.16Å; W152-F234 HydrophobicContact CD2-CE2 4.14Å; W152-F234 AromaticContact CD2-CG 3.49Å; W152-F234 HydrophobicContact CD2-CG 3.49Å; W152-F234 VanDerWaalsContact CD2-CG 3.49Å; W152-F234 HydrophobicContact CD2-CZ 4.35Å; W152-F234 AromaticContact CE2-CD2 3.53Å; W152-F234 AromaticContact CE2-CG 3.7Å; W152-F234 AromaticContact CE3-CD1 3.79Å; W152-F234 HydrophobicContact CE3-CD1 3.79Å; W152-F234 AromaticContact CE3-CD2 3.93Å; W152-F234 HydrophobicContact CE3-CD2 3.93Å; W152-F234 AromaticContact CE3-CE1 3.72Å; W152-F234 HydrophobicContact CE3-CE1 3.72Å; W152-F234 AromaticContact CE3-CE2 3.87Å; W152-F234 HydrophobicContact CE3-CE2 3.87Å; W152-F234 AromaticContact CE3-CG 3.9Å; W152-F234 HydrophobicContact CE3-CG 3.9Å; W152-F234 AromaticContact CE3-CZ 3.77Å; W152-F234 HydrophobicContact CE3-CZ 3.77Å; W152-F234 HydrophobicContact CG-CB 3.63Å; W152-F234 AromaticContact CG-CD1 3.84Å; W152-F234 HydrophobicContact CG-CD1 3.84Å; W152-F234 HydrophobicContact CG-CD2 4.32Å; W152-F234 AromaticContact CG-CG 3.66Å; W152-F234 HydrophobicContact CG-CG 3.66Å; W152-F234 AromaticContact CH2-CD2 3.82Å; W152-F234 HydrophobicContact CH2-CD2 3.82Å; W152-F234 AromaticContact CH2-CE2 3.56Å; W152-F234 HydrophobicContact CH2-CE2 3.56Å; W152-F234 HydrophobicContact CH2-CZ 4.12Å; W152-F234 AromaticContact CZ2-CD2 3.55Å; W152-F234 HydrophobicContact CZ2-CD2 3.55Å; W152-F234 AromaticContact CZ2-CE2 3.81Å; W152-F234 HydrophobicContact CZ2-CE2 3.81Å; W152-F234 HydrophobicContact CZ2-CG 4.2Å; W152-F234 HydrophobicContact CZ3-CD1 4.48Å; W152-F234 HydrophobicContact CZ3-CD2 4.01Å; W152-F234 HydrophobicContact CZ3-CE1 4.11Å; W152-F234 AromaticContact CZ3-CE2 3.6Å; W152-F234 HydrophobicContact CZ3-CE2 3.6Å; W152-F234 HydrophobicContact CZ3-CG 4.44Å; W152-F234 AromaticContact CZ3-CZ 3.66Å; W152-F234 HydrophobicContact CZ3-CZ 3.66Å
153	E	87.1	Confident	93.9	Very high	139 Å²	139	66 Å²	66	65%	0.65	32%	0.322	S	S	*	.			trans	51.2	35.9	179.2	-62.4	174.1	179.1	0	0	112.5	S151 R233	S151-E153 PolarHBondContact O-N 3.25Å; E153-R233 IonicContact OE2-CZ 3.21Å; E153-R233 VanDerWaalsContact OE2-CZ 3.27Å; E153-R233 IonicContact OE2-NH1 2.69Å; E153-R233 PolarHBondContact OE2-NH1 3.42Å; E153-R233 IonicContact OE2-NH2 3.96Å; E153-R233 PolarHBondContact OE2-NH2 3.17Å
154	I	91.2	Very high	93.8	Very high	31 Å²	31	66.4 Å²	66.4	16%	0.159	33%	0.326	C	S	.	.			trans	-79.8	155.2	177.1	60.6	175.5	0	0	0	111.1	W152 W158 L182 F234 E236	W152-I154 HydrophobicContact CB-CG2 3.87Å; W152-I154 PolarHBondContact O-N 3.01Å; W152-I154 VanDerWaalsContact O-N 3.12Å; I154-W158 HydrophobicContact CD1-CB 3.93Å; I154-W158 HydrophobicContact CD1-CG 4.3Å; I154-L182 HydrophobicContact CD1-CD2 4.11Å; I154-F234 HydrophobicContact CG2-CD1 4.06Å; I154-F234 HydrophobicContact CG2-CE1 4.01Å; I154-E236 HydrophobicContact CG2-CB 4.28Å
155	S	91.9	Very high	93.7	Very high	41 Å²	41	66.2 Å²	66.2	29%	0.287	33%	0.327	S	S	.	.			trans	-56.1	139.8	176.7	-174.1	0	0	0	0	113.3	K157 W158 E236	S155-K157 PolarHBondContact O-N 3.38Å; S155-W158 VanDerWaalsContact O-CD1 3.31Å; S155-W158 PolarHBondContact O-N 2.67Å; S155-E236 WeakPolarHBondContact CB-OE1 3.37Å; S155-E236 PolarHBondContact N-OE2 2.71Å
156	D	89.9	Confident	93.6	Very high	164 Å²	164	71.3 Å²	71.3	88%	0.877	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-10	175.2	-62.7	-28.5	0	0	0	114.5	W158	D156-W158 PolarHBondContact O-N 3.26Å
157	K	91	Very high	93.4	Very high	150 Å²	150	72.1 Å²	72.1	65%	0.652	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-21.8	174.2	-62.4	175.5	-173.5	169.6	0	112.5	S155 L159 I184	S155-K157 PolarHBondContact O-N 3.38Å; K157-L159 PolarHBondContact O-N 2.76Å; K157-I184 HydrophobicContact CB-CG2 4.25Å
158	W	93.8	Very high	93.3	Very high	12 Å²	12	68.4 Å²	68.4	5%	0.045	35%	0.354	C	S	.	.			trans	-78.6	120.8	179.4	-70.8	97.4	0	0	0	110.7	I154 S155 D156 L182 I184 E236 L239 I243	I154-W158 HydrophobicContact CD1-CB 3.93Å; I154-W158 HydrophobicContact CD1-CG 4.3Å; S155-W158 VanDerWaalsContact O-CD1 3.31Å; S155-W158 PolarHBondContact O-N 2.67Å; D156-W158 PolarHBondContact O-N 3.26Å; W158-L182 HydrophobicContact CE3-CB 3.82Å; W158-L182 HydrophobicContact CZ3-CB 4.04Å; W158-I184 HydrophobicContact CD2-CD1 4.11Å; W158-I184 HydrophobicContact CD2-CG1 3.68Å; W158-I184 HydrophobicContact CE3-CD1 4.32Å; W158-I184 HydrophobicContact CE3-CG1 3.67Å; W158-I184 HydrophobicContact CG-CG1 4.35Å; W158-I184 HydrophobicContact CH2-CD1 3.79Å; W158-I184 HydrophobicContact CH2-CG1 3.99Å; W158-I184 HydrophobicContact CZ2-CD1 3.54Å; W158-I184 HydrophobicContact CZ2-CG1 4Å; W158-I184 HydrophobicContact CZ3-CD1 4.19Å; W158-I184 HydrophobicContact CZ3-CG1 3.84Å; W158-E236 HydrophobicContact CZ2-CG 4.34Å; W158-E236 PolarHBondContact NE1-OE1 3.21Å; W158-L239 HydrophobicContact CD2-CD1 4.15Å; W158-L239 HydrophobicContact CE3-CD1 4.22Å; W158-L239 HydrophobicContact CH2-CB 3.34Å; W158-L239 HydrophobicContact CH2-CD1 4.12Å; W158-L239 HydrophobicContact CH2-CG 4.35Å; W158-L239 HydrophobicContact CZ2-CB 3.57Å; W158-L239 HydrophobicContact CZ2-CD1 4.04Å; W158-L239 HydrophobicContact CZ2-CG 4.48Å; W158-L239 HydrophobicContact CZ3-CB 4.02Å; W158-L239 HydrophobicContact CZ3-CD1 4.2Å; W158-I243 HydrophobicContact CH2-CD1 3.48Å; W158-I243 VanDerWaalsContact CH2-CD1 3.48Å; W158-I243 HydrophobicContact CH2-CG1 4.32Å; W158-I243 HydrophobicContact CZ3-CD1 3.65Å
159	L	94.3	Very high	93.3	Very high	102 Å²	102	75 Å²	75	53%	0.534	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	143.9	162.5	-60.5	-167.2	0	0	0	109.4	K157 L182 S183 P185	K157-L159 PolarHBondContact O-N 2.76Å; L159-L182 CarbonylContact O-C 3.52Å; L159-L182 WeakPolarHBondContact O-CA 3.21Å; L159-S183 PolarHBondContact N-O 2.95Å; L159-S183 PolarHBondContact O-N 3.21Å; L159-P185 HydrophobicContact CD1-CG 3.57Å; L159-P185 HydrophobicContact CG-CG 3.79Å
160	Y	95.5	Very high	93.2	Very high	80 Å²	80	78 Å²	78	31%	0.314	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	153.7	175.5	73.1	-88.9	0	0	0	112.7	I149 I162 V180 K181	I149-Y160 HydrophobicContact CD1-CD2 4.17Å; I149-Y160 HydrophobicContact CD1-CE2 4.1Å; I149-Y160 HydrophobicContact CG2-CD1 4.17Å; I149-Y160 HydrophobicContact CG2-CE1 4.01Å; I149-Y160 HydrophobicContact CG2-CE2 4.46Å; I149-Y160 HydrophobicContact CG2-CG 4.47Å; Y160-I162 HydrophobicContact CD2-CD1 4.49Å; Y160-I162 HydrophobicContact CD2-CG1 4.06Å; Y160-I162 HydrophobicContact CE2-CD1 4.15Å; Y160-I162 HydrophobicContact CE2-CG1 4.15Å; Y160-V180 HydrophobicContact CD2-CG1 4.28Å; Y160-K181 CarbonylContact C-O 3.59Å; Y160-K181 WeakPolarHBondContact CA-O 3.44Å; Y160-K181 WeakPolarHBondContact CB-O 3.19Å
161	C	95.4	Very high	93.1	Very high	63 Å²	63	79.7 Å²	79.7	43%	0.426	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	155.6	164.8	67.4	0	0	0	0	110.1	V180 K181	C161-V180 CarbonylContact O-C 3.52Å; C161-V180 WeakPolarHBondContact O-CA 3.19Å; C161-K181 PolarHBondContact N-O 3.23Å; C161-K181 PolarHBondContact O-N 2.93Å
162	I	97.6	Very high	93.2	Very high	27 Å²	27	81.9 Å²	81.9	14%	0.138	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	118.2	-177.8	-49.6	-176.1	0	0	0	108.9	L142 I145 E146 I149 Y160 Y178 V180	L142-I162 HydrophobicContact CG-CG2 4.49Å; I145-I162 HydrophobicContact CG2-CD1 3.96Å; E146-I162 HydrophobicContact CG-CD1 3.48Å; E146-I162 VanDerWaalsContact CG-CD1 3.48Å; I149-I162 HydrophobicContact CD1-CD1 3.85Å; I149-I162 HydrophobicContact CD1-CG1 4.42Å; Y160-I162 HydrophobicContact CD2-CD1 4.49Å; Y160-I162 HydrophobicContact CD2-CG1 4.06Å; Y160-I162 HydrophobicContact CE2-CD1 4.15Å; Y160-I162 HydrophobicContact CE2-CG1 4.15Å; I162-Y178 HydrophobicContact CG2-CD1 4.36Å; I162-V180 HydrophobicContact CD1-CG2 4.43Å; I162-V180 HydrophobicContact CG1-CG1 4.42Å; I162-V180 HydrophobicContact CG1-CG2 4.13Å; I162-V180 HydrophobicContact CG2-CG2 4.29Å
163	D	95.8	Very high	93.3	Very high	47 Å²	47	82.8 Å²	82.8	25%	0.251	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	133.5	171.5	-58.7	-37	0	0	0	109.6	Y178 R179 K181	D163-Y178 CarbonylContact O-C 3.53Å; D163-Y178 WeakPolarHBondContact O-CA 3.34Å; D163-R179 HydrophobicContact CB-CB 4.37Å; D163-R179 PolarHBondContact N-O 2.72Å; D163-R179 PolarHBondContact O-N 2.76Å; D163-R179 IonicContact OD2-CZ 2.78Å; D163-R179 VanDerWaalsContact OD2-CZ 3.3Å; D163-R179 IonicContact OD2-NE 3.86Å; D163-R179 PolarHBondContact OD2-NE 2.84Å; D163-R179 IonicContact OD2-NH2 2.64Å; D163-R179 PolarHBondContact OD2-NH2 2.75Å; D163-K181 WeakPolarHBondContact OD2-CE 3.43Å; D163-K181 IonicContact OD2-NZ 3.06Å; D163-K181 PolarHBondContact OD2-NZ 3.39Å
164	I	95.8	Very high	93.6	Very high	100 Å²	100	77 Å²	77	51%	0.513	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	125	167.4	-56.2	177.2	0	0	0	107.8	L142 Y178	L142-I164 HydrophobicContact CD1-CD1 4.04Å; L142-I164 HydrophobicContact CD1-CG1 4.02Å; I164-Y178 HydrophobicContact CG1-CD1 4.05Å; I164-Y178 HydrophobicContact CG1-CE1 3.99Å; I164-Y178 HydrophobicContact CG2-CE1 4.43Å
165	L	94.5	Very high	93.8	Very high	43 Å²	43	76.4 Å²	76.4	23%	0.225	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-95.7	162.2	177.2	-60.8	-179.7	0	0	0	110.7	I167 K177 R179 Y199	L165-I167 PolarHBondContact O-N 3.18Å; L165-K177 HydrophobicContact CB-CB 3.8Å; L165-K177 WeakPolarHBondContact CB-O 3.41Å; L165-K177 HydrophobicContact CD1-CB 4.11Å; L165-K177 PolarHBondContact N-O 2.81Å; L165-R179 HydrophobicContact CD1-CB 3.95Å; L165-R179 HydrophobicContact CD2-CB 4.07Å; L165-R179 HydrophobicContact CG-CB 4.05Å; L165-Y199 HydrophobicContact CD1-CD1 4.2Å; L165-Y199 HydrophobicContact CD1-CE1 4.5Å
166	P	94.1	Very high	94	Very high	108 Å²	108	75.3 Å²	75.3	70%	0.701	38%	0.383	S	S	*	.	P	Polyproline II helix	trans	-54	137.4	175.1	-27.2	35.7	0	0	0	112.6
167	I	93.6	Very high	94.3	Very high	84 Å²	84	70.6 Å²	70.6	43%	0.431	36%	0.355	S	S	.	.	P	Polyproline II helix	trans	-70.6	138.9	177.1	-60.6	167	0	0	0	108.6	L165 E169 T174	L165-I167 PolarHBondContact O-N 3.18Å; I167-E169 HydrophobicContact CG2-CG 4.45Å; I167-T174 HydrophobicContact CG2-CG2 3.39Å
168	V	93.4	Very high	94.7	Very high	51 Å²	51	63.5 Å²	63.5	31%	0.309	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	114	172.1	-179	0	0	0	0	108.8	L170 L175 K177	V168-L170 HydrophobicContact CG1-CD2 4.05Å; V168-L170 HydrophobicContact CG1-CG 4.41Å; V168-L175 HydrophobicContact CB-CB 4.19Å; V168-L175 HydrophobicContact CB-CD1 4.5Å; V168-L175 PolarHBondContact N-O 2.78Å; V168-L175 PolarHBondContact O-N 2.83Å; V168-K177 HydrophobicContact CG2-CD 4.21Å
169	E	94.2	Very high	94.8	Very high	138 Å²	138	66.3 Å²	66.3	65%	0.645	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88	126.4	173.4	-65.1	-160.3	-159	0	0	110.8	I167 T174 R206	I167-E169 HydrophobicContact CG2-CG 4.45Å; E169-T174 HydrophobicContact CG-CG2 4.36Å; E169-R206 IonicContact OE2-CZ 3Å; E169-R206 IonicContact OE2-NH2 2.83Å; E169-R206 PolarHBondContact OE2-NH2 3.33Å
170	L	92.2	Very high	94.9	Very high	67 Å²	67	61.5 Å²	61.5	35%	0.351	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	165.5	172.8	-56.5	176.6	0	0	0	108.8	V168 N172 E173 L175 R206	V168-L170 HydrophobicContact CG1-CD2 4.05Å; V168-L170 HydrophobicContact CG1-CG 4.41Å; L170-N172 VanDerWaalsContact C-N 3.3Å; L170-N172 PolarHBondContact O-N 3.43Å; L170-E173 CarbonylContact C-O 3.43Å; L170-E173 WeakPolarHBondContact CA-O 3.48Å; L170-E173 HydrophobicContact CB-CB 4.39Å; L170-E173 WeakPolarHBondContact CB-O 3.35Å; L170-E173 PolarHBondContact N-O 2.91Å; L170-E173 PolarHBondContact O-N 2.87Å; L170-L175 HydrophobicContact CD1-CD1 3.9Å; L170-L175 HydrophobicContact CD1-CG 4.09Å; L170-R206 PolarHBondContact O-NH1 3.41Å
171	K	90.8	Very high	94.9	Very high	190 Å²	190	60.6 Å²	60.6	83%	0.826	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.4	-48.9	-176.4	-172.4	178.7	179.5	176	0	113.2
172	N	93.1	Very high	94.9	Very high	75 Å²	75	57.6 Å²	57.6	40%	0.401	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.8	2.4	-174.6	-66.4	-14.7	0	0	0	113	L170 R206 I207	L170-N172 VanDerWaalsContact C-N 3.3Å; L170-N172 PolarHBondContact O-N 3.43Å; N172-R206 VanDerWaalsContact O-CB 3.3Å; N172-R206 WeakPolarHBondContact O-CB 3.19Å; N172-R206 PolarHBondContact O-N 2.98Å; N172-I207 HydrophobicContact CB-CG2 4.13Å
173	E	93.5	Very high	94.8	Very high	27 Å²	27	57.3 Å²	57.3	13%	0.126	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	157.2	-166.3	-55.6	-172.7	147.6	0	0	112.1	L170 R203 I204	L170-E173 CarbonylContact C-O 3.43Å; L170-E173 WeakPolarHBondContact CA-O 3.48Å; L170-E173 HydrophobicContact CB-CB 4.39Å; L170-E173 WeakPolarHBondContact CB-O 3.35Å; L170-E173 PolarHBondContact N-O 2.91Å; L170-E173 PolarHBondContact O-N 2.87Å; E173-R203 IonicContact OE1-CZ 3.3Å; E173-R203 IonicContact OE1-NE 2.94Å; E173-R203 PolarHBondContact OE1-NE 2.88Å; E173-R203 IonicContact OE1-NH2 2.72Å; E173-R203 PolarHBondContact OE1-NH2 3.24Å; E173-R203 IonicContact OE2-CZ 2.64Å; E173-R203 IonicContact OE2-NE 2.68Å; E173-R203 PolarHBondContact OE2-NE 3.42Å; E173-R203 IonicContact OE2-NH2 2.76Å; E173-R203 PolarHBondContact OE2-NH2 2.89Å; E173-I204 CarbonylContact C-O 3.47Å; E173-I204 WeakPolarHBondContact CA-O 3.49Å; E173-I204 WeakPolarHBondContact CB-O 3.33Å
174	T	95	Very high	94.6	Very high	17 Å²	17	58.4 Å²	58.4	10%	0.104	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	126.8	176.5	-56.6	0	0	0	0	108.4	I167 E169 I204 R206	I167-T174 HydrophobicContact CG2-CG2 3.39Å; E169-T174 HydrophobicContact CG-CG2 4.36Å; T174-I204 PolarHBondContact N-O 3.49Å; T174-I204 PolarHBondContact O-N 3.29Å; T174-R206 PolarHBondContact OG1-NE 2.9Å; T174-R206 PolarHBondContact OG1-NH2 2.74Å
175	L	94.8	Very high	94.3	Very high	18 Å²	18	55.7 Å²	55.7	9%	0.094	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	110.4	-177.7	-51.6	-177.1	0	0	0	109.4	V168 L170 T201 R203	V168-L175 HydrophobicContact CB-CB 4.19Å; V168-L175 HydrophobicContact CB-CD1 4.5Å; V168-L175 PolarHBondContact N-O 2.78Å; V168-L175 PolarHBondContact O-N 2.83Å; L170-L175 HydrophobicContact CD1-CD1 3.9Å; L170-L175 HydrophobicContact CD1-CG 4.09Å; L175-T201 HydrophobicContact CB-CG2 4.02Å; L175-T201 HydrophobicContact CD2-CG2 4.26Å; L175-R203 HydrophobicContact CD2-CB 3.77Å; L175-R203 HydrophobicContact CD2-CG 3.65Å
176	H	96.9	Very high	94	Very high	19 Å²	19	56.5 Å²	56.5	9%	0.088	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	117	170.9	-67.5	-94.7	0	0	0	108.8	F136 Y178 T201 L202 I204	F136-H176 HydrophobicContact CE1-CB 4.35Å; F136-H176 AromaticContact CE1-CD2 3.53Å; F136-H176 AromaticContact CE1-CE1 3.82Å; F136-H176 AromaticContact CE1-CG 3.63Å; F136-H176 AromaticContact CE1-ND1 3.82Å; F136-H176 AromaticContact CE1-NE2 3.66Å; F136-H176 HydrophobicContact CZ-CB 3.96Å; F136-H176 AromaticContact CZ-CD2 3.99Å; F136-H176 AromaticContact CZ-CG 3.74Å; H176-Y178 HydrophobicContact CB-CE2 3.82Å; H176-T201 WeakPolarHBondContact O-CA 3.4Å; H176-L202 HydrophobicContact CB-CB 4.24Å; H176-L202 PolarHBondContact N-O 2.9Å; H176-L202 PolarHBondContact O-N 2.85Å; H176-I204 WeakPolarHBondContact CD2-CD1 3.33Å; H176-I204 WeakPolarHBondContact NE2-CD1 3.36Å
177	K	96.1	Very high	93.7	Very high	64 Å²	64	63.7 Å²	63.7	28%	0.278	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	139.4	-174.9	-66.3	-177.5	-179.4	-178.3	0	110	L165 V168 F200 T201	L165-K177 HydrophobicContact CB-CB 3.8Å; L165-K177 WeakPolarHBondContact CB-O 3.41Å; L165-K177 HydrophobicContact CD1-CB 4.11Å; L165-K177 PolarHBondContact N-O 2.81Å; V168-K177 HydrophobicContact CG2-CD 4.21Å; K177-F200 WeakPolarHBondContact CA-O 3.24Å; K177-T201 HydrophobicContact CG-CG2 4.33Å
178	Y	97.5	Very high	93.5	Very high	1 Å²	1	71.1 Å²	71.1	0%	0.004	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	144.3	177.2	-55.3	-102	0	0	0	108.8	P138 L142 I145 I162 D163 I164 H176 Y199 F200 L202	P138-Y178 WeakPolarHBondContact CA-OH 3.43Å; P138-Y178 PolarHBondContact O-OH 2.83Å; L142-Y178 HydrophobicContact CB-CE1 4.08Å; I145-Y178 HydrophobicContact CD1-CD1 3.97Å; I145-Y178 HydrophobicContact CD1-CD2 3.45Å; I145-Y178 VanDerWaalsContact CD1-CD2 3.45Å; I145-Y178 HydrophobicContact CD1-CE1 4.39Å; I145-Y178 HydrophobicContact CD1-CE2 3.95Å; I145-Y178 HydrophobicContact CD1-CG 3.47Å; I145-Y178 VanDerWaalsContact CD1-CG 3.47Å; I162-Y178 HydrophobicContact CG2-CD1 4.36Å; D163-Y178 CarbonylContact O-C 3.53Å; D163-Y178 WeakPolarHBondContact O-CA 3.34Å; I164-Y178 HydrophobicContact CG1-CD1 4.05Å; I164-Y178 HydrophobicContact CG1-CE1 3.99Å; I164-Y178 HydrophobicContact CG2-CE1 4.43Å; H176-Y178 HydrophobicContact CB-CE2 3.82Å; Y178-Y199 WeakPolarHBondContact O-CA 3.21Å; Y178-F200 PolarHBondContact N-O 2.95Å; Y178-F200 PolarHBondContact O-N 2.71Å; Y178-L202 HydrophobicContact CD2-CD1 4.07Å; Y178-L202 HydrophobicContact CE2-CD1 4.08Å; Y178-L202 HydrophobicContact CE2-CD2 4.17Å; Y178-L202 HydrophobicContact CE2-CG 4.48Å
179	R	97.2	Very high	93.1	Very high	72 Å²	72	70.7 Å²	70.7	27%	0.272	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	114.1	174.1	176.3	178.7	63.1	-173.7	-3	108.8	D163 L165 K181 Y199	D163-R179 HydrophobicContact CB-CB 4.37Å; D163-R179 PolarHBondContact N-O 2.72Å; D163-R179 PolarHBondContact O-N 2.76Å; D163-R179 IonicContact OD2-CZ 2.78Å; D163-R179 VanDerWaalsContact OD2-CZ 3.3Å; D163-R179 IonicContact OD2-NE 3.86Å; D163-R179 PolarHBondContact OD2-NE 2.84Å; D163-R179 IonicContact OD2-NH2 2.64Å; D163-R179 PolarHBondContact OD2-NH2 2.75Å; L165-R179 HydrophobicContact CD1-CB 3.95Å; L165-R179 HydrophobicContact CD2-CB 4.07Å; L165-R179 HydrophobicContact CG-CB 4.05Å; R179-K181 HydrophobicContact CG-CG 4.24Å; R179-K181 VanDerWaalsContact NE-CE 3.32Å; R179-K181 VanDerWaalsContact NH2-NZ 3.11Å; R179-Y199 HydrophobicContact CB-CD1 4.25Å; R179-Y199 HydrophobicContact CB-CE1 4.24Å; R179-Y199 HydrophobicContact CG-CD1 4.31Å; R179-Y199 HydrophobicContact CG-CE1 3.96Å
180	V	96.7	Very high	92.8	Very high	0 Å²	0	68.8 Å²	68.8	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	116.1	171.8	-175.7	0	0	0	0	107.3	I145 I149 Y160 C161 I162 L182 S197 V198 F200	I145-V180 HydrophobicContact CG2-CG2 4.07Å; I149-V180 HydrophobicContact CD1-CB 4.38Å; I149-V180 HydrophobicContact CD1-CG1 3.67Å; I149-V180 HydrophobicContact CD1-CG2 3.81Å; Y160-V180 HydrophobicContact CD2-CG1 4.28Å; C161-V180 CarbonylContact O-C 3.52Å; C161-V180 WeakPolarHBondContact O-CA 3.19Å; I162-V180 HydrophobicContact CD1-CG2 4.43Å; I162-V180 HydrophobicContact CG1-CG1 4.42Å; I162-V180 HydrophobicContact CG1-CG2 4.13Å; I162-V180 HydrophobicContact CG2-CG2 4.29Å; V180-L182 HydrophobicContact CB-CD1 4.36Å; V180-L182 HydrophobicContact CG1-CD1 3.74Å; V180-L182 HydrophobicContact CG1-CG 4.11Å; V180-S197 CarbonylContact O-C 3.58Å; V180-S197 WeakPolarHBondContact O-CA 3.3Å; V180-V198 HydrophobicContact CB-CB 4.34Å; V180-V198 PolarHBondContact N-O 2.64Å; V180-V198 PolarHBondContact O-N 3.06Å; V180-F200 HydrophobicContact CB-CE2 4.41Å; V180-F200 HydrophobicContact CG2-CD2 3.61Å; V180-F200 HydrophobicContact CG2-CE2 3.56Å
181	K	95.6	Very high	92.7	Very high	61 Å²	61	72.4 Å²	72.4	27%	0.265	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	126.6	172.2	-66.3	176.7	-177.3	144.3	0	108.7	Y160 C161 D163 R179 V196	Y160-K181 CarbonylContact C-O 3.59Å; Y160-K181 WeakPolarHBondContact CA-O 3.44Å; Y160-K181 WeakPolarHBondContact CB-O 3.19Å; C161-K181 PolarHBondContact N-O 3.23Å; C161-K181 PolarHBondContact O-N 2.93Å; D163-K181 WeakPolarHBondContact OD2-CE 3.43Å; D163-K181 IonicContact OD2-NZ 3.06Å; D163-K181 PolarHBondContact OD2-NZ 3.39Å; R179-K181 HydrophobicContact CG-CG 4.24Å; R179-K181 VanDerWaalsContact NE-CE 3.32Å; R179-K181 VanDerWaalsContact NH2-NZ 3.11Å; K181-V196 CarbonylContact C-O 3.56Å; K181-V196 WeakPolarHBondContact CA-O 3.44Å
182	L	95.6	Very high	92.5	Very high	0 Å²	0	65 Å²	65	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	144.6	176.3	-58.5	100.8	0	0	0	110.2	W152 I154 W158 L159 V180 T195 V196 V198 L239	W152-L182 HydrophobicContact CZ3-CD2 4.46Å; I154-L182 HydrophobicContact CD1-CD2 4.11Å; W158-L182 HydrophobicContact CE3-CB 3.82Å; W158-L182 HydrophobicContact CZ3-CB 4.04Å; L159-L182 CarbonylContact O-C 3.52Å; L159-L182 WeakPolarHBondContact O-CA 3.21Å; V180-L182 HydrophobicContact CB-CD1 4.36Å; V180-L182 HydrophobicContact CG1-CD1 3.74Å; V180-L182 HydrophobicContact CG1-CG 4.11Å; L182-T195 CarbonylContact O-C 2.96Å; L182-T195 WeakPolarHBondContact O-CA 3.26Å; L182-V196 PolarHBondContact N-O 3.49Å; L182-V196 PolarHBondContact O-N 3.42Å; L182-V198 HydrophobicContact CD1-CB 4.41Å; L182-V198 HydrophobicContact CD1-CG2 3.73Å; L182-L239 HydrophobicContact CD1-CD2 4.09Å; L182-L239 HydrophobicContact CD2-CD1 3.89Å
183	S	93.9	Very high	92	Very high	22 Å²	22	69.6 Å²	69.6	15%	0.154	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.3	157.6	178.7	64.3	0	0	0	0	111.8	L159 P185	L159-S183 PolarHBondContact N-O 2.95Å; L159-S183 PolarHBondContact O-N 3.21Å; S183-P185 WeakPolarHBondContact O-CD 3.23Å
184	I	91.7	Very high	91.7	Very high	69 Å²	69	69.2 Å²	69.2	35%	0.354	33%	0.331	S	S	.	.			trans	-112.6	96.8	175.5	-57.9	168.9	0	0	0	108.3	K157 W158	K157-I184 HydrophobicContact CB-CG2 4.25Å; W158-I184 HydrophobicContact CD2-CD1 4.11Å; W158-I184 HydrophobicContact CD2-CG1 3.68Å; W158-I184 HydrophobicContact CE3-CD1 4.32Å; W158-I184 HydrophobicContact CE3-CG1 3.67Å; W158-I184 HydrophobicContact CG-CG1 4.35Å; W158-I184 HydrophobicContact CH2-CD1 3.79Å; W158-I184 HydrophobicContact CH2-CG1 3.99Å; W158-I184 HydrophobicContact CZ2-CD1 3.54Å; W158-I184 HydrophobicContact CZ2-CG1 4Å; W158-I184 HydrophobicContact CZ3-CD1 4.19Å; W158-I184 HydrophobicContact CZ3-CG1 3.84Å
185	P	90.6	Very high	91.6	Very high	44 Å²	44	71 Å²	71	29%	0.286	34%	0.342	S	S	.	.			trans	-72.6	151.6	169.4	32	-35.1	0	0	0	110.6	L159 S183 P192	L159-P185 HydrophobicContact CD1-CG 3.57Å; L159-P185 HydrophobicContact CG-CG 3.79Å; S183-P185 WeakPolarHBondContact O-CD 3.23Å; P185-P192 HydrophobicContact CB-CG 4.31Å
186	S	86.9	Confident	91.5	Very high	59 Å²	59	70.1 Å²	70.1	41%	0.413	34%	0.338	S	S	.	.	B	Isolated β-bridge	trans	-136.4	160.2	173.6	73.5	0	0	0	0	111.2	R188 S189 P190	S186-R188 PolarHBondContact O-N 3.26Å; S186-R188 VanDerWaalsContact O-N 3.17Å; S186-S189 PolarHBondContact N-O 3.18Å; S186-S189 CarbonylContact O-C 3.6Å; S186-S189 PolarHBondContact O-N 2.86Å; S186-S189 VanDerWaalsContact O-O 3.07Å; S186-S189 PolarHBondContact OG-N 2.8Å; S186-S189 VanDerWaalsContact OG-N 3.09Å; S186-P190 WeakPolarHBondContact O-CA 3.28Å; S186-P190 VanDerWaalsContact O-N 3.08Å
187	R	89.1	Confident	91.4	Very high	259 Å²	259	69.7 Å²	69.7	98%	0.977	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-31	176.7	-68	-171.5	179.9	119.2	-0.1	113.2
188	R	89.3	Confident	91.4	Very high	241 Å²	241	66.6 Å²	66.6	91%	0.909	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	-14.3	178.1	-63.9	-174.6	-179.3	171.5	0.7	113.2	S186	S186-R188 PolarHBondContact O-N 3.26Å; S186-R188 VanDerWaalsContact O-N 3.17Å
189	S	85	Confident	91.3	Very high	41 Å²	41	70.1 Å²	70.1	29%	0.287	34%	0.337	S	S	.	.	B	Isolated β-bridge	trans	-147.7	78.1	179	-58.7	0	0	0	0	107.9	S186 I191	S186-S189 PolarHBondContact N-O 3.18Å; S186-S189 CarbonylContact O-C 3.6Å; S186-S189 PolarHBondContact O-N 2.86Å; S186-S189 VanDerWaalsContact O-O 3.07Å; S186-S189 PolarHBondContact OG-N 2.8Å; S186-S189 VanDerWaalsContact OG-N 3.09Å; S189-I191 PolarHBondContact O-N 2.84Å
190	P	88.4	Confident	91.3	Very high	99 Å²	99	66.8 Å²	66.8	64%	0.643	33%	0.325	S	S	*	.	S	Bend	trans	-65.3	-31	-176.2	24.6	-33.7	0	0	0	111.6	S186 P192	S186-P190 WeakPolarHBondContact O-CA 3.28Å; S186-P190 VanDerWaalsContact O-N 3.08Å; P190-P192 WeakPolarHBondContact O-CD 3.39Å
191	I	88.7	Confident	91.2	Very high	142 Å²	142	67.5 Å²	67.5	73%	0.728	33%	0.329	S	S	*	.	S	Bend	trans	-88.9	116.5	166.9	-59.6	168.5	0	0	0	107.2	S189 K193	S189-I191 PolarHBondContact O-N 2.84Å; I191-K193 PolarHBondContact O-N 3.24Å
192	P	86.7	Confident	91.3	Very high	36 Å²	36	64.6 Å²	64.6	23%	0.234	32%	0.316	C	S	.	.			trans	-60.9	135.4	177.5	-22	32.9	0	0	0	111.3	P185 P190 S194	P185-P192 HydrophobicContact CB-CG 4.31Å; P190-P192 WeakPolarHBondContact O-CD 3.39Å; P192-S194 PolarHBondContact O-N 3.39Å
193	K	83.2	Confident	91.2	Very high	171 Å²	171	69 Å²	69	74%	0.743	33%	0.333	S	S	*	.	S	Bend	trans	-63.6	-25.2	176.2	-67.1	-176	177.9	-177.7	0	113	I191	I191-K193 PolarHBondContact O-N 3.24Å
194	S	87.8	Confident	91.3	Very high	18 Å²	18	69 Å²	69	13%	0.126	33%	0.331	C	S	.	.			trans	-151.8	156.1	-177.5	-174.7	0	0	0	0	109.9	P192 K246	P192-S194 PolarHBondContact O-N 3.39Å; S194-K246 WeakPolarHBondContact OG-CB 3.28Å; S194-K246 WeakPolarHBondContact OG-CD 3.18Å
195	T	92.1	Very high	91.4	Very high	55 Å²	55	66 Å²	66	34%	0.337	32%	0.316	S	S	.	.			trans	-131.2	155	177.1	62.8	0	0	0	0	109.1	L182 K246	L182-T195 CarbonylContact O-C 2.96Å; L182-T195 WeakPolarHBondContact O-CA 3.26Å; T195-K246 PolarHBondContact O-NZ 3.42Å
196	V	93.2	Very high	91.4	Very high	0 Å²	0	70.1 Å²	70.1	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	134.2	174.4	-176.1	0	0	0	0	108.8	K181 L182 V220 E221 L239 V242 I243	K181-V196 CarbonylContact C-O 3.56Å; K181-V196 WeakPolarHBondContact CA-O 3.44Å; L182-V196 PolarHBondContact N-O 3.49Å; L182-V196 PolarHBondContact O-N 3.42Å; V196-V220 HydrophobicContact CG1-CG1 4.15Å; V196-E221 HydrophobicContact CG1-CB 4.36Å; V196-L239 HydrophobicContact CB-CD2 4.06Å; V196-L239 HydrophobicContact CG1-CD2 3.59Å; V196-L239 HydrophobicContact CG2-CB 4.42Å; V196-L239 WeakPolarHBondContact CG2-O 3.37Å; V196-V242 HydrophobicContact CB-CG1 4.37Å; V196-V242 HydrophobicContact CG1-CB 4.04Å; V196-V242 HydrophobicContact CG1-CG1 3.96Å; V196-V242 HydrophobicContact CG1-CG2 4.3Å; V196-V242 HydrophobicContact CG2-CB 3.95Å; V196-V242 HydrophobicContact CG2-CG1 3.92Å; V196-I243 HydrophobicContact CG2-CD1 3.95Å; V196-I243 HydrophobicContact CG2-CG1 3.31Å
197	S	94.6	Very high	91.8	Very high	9 Å²	9	73.1 Å²	73.1	6%	0.063	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	126.4	173.5	-63.2	0	0	0	0	111.6	V180 E221	V180-S197 CarbonylContact O-C 3.58Å; V180-S197 WeakPolarHBondContact O-CA 3.3Å; S197-E221 PolarHBondContact N-OE2 3.02Å; S197-E221 WeakPolarHBondContact O-CA 3.47Å; S197-E221 VanDerWaalsContact O-CB 3.26Å; S197-E221 WeakPolarHBondContact O-CB 3.32Å; S197-E221 PolarHBondContact O-N 2.78Å
198	V	95.3	Very high	91.9	Very high	0 Å²	0	65.2 Å²	65.2	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	124	167	-175.4	0	0	0	0	108.6	W152 V180 L182 F200 Y218 V220 L239	W152-V198 HydrophobicContact CH2-CB 4.47Å; W152-V198 HydrophobicContact CH2-CG1 4.12Å; W152-V198 HydrophobicContact CH2-CG2 4.45Å; V180-V198 HydrophobicContact CB-CB 4.34Å; V180-V198 PolarHBondContact N-O 2.64Å; V180-V198 PolarHBondContact O-N 3.06Å; L182-V198 HydrophobicContact CD1-CB 4.41Å; L182-V198 HydrophobicContact CD1-CG2 3.73Å; V198-F200 HydrophobicContact CB-CE2 4.37Å; V198-F200 HydrophobicContact CG1-CD2 4.15Å; V198-F200 HydrophobicContact CG1-CE2 3.78Å; V198-Y218 HydrophobicContact CG1-CD2 3.73Å; V198-Y218 HydrophobicContact CG1-CG 4.32Å; V198-V220 HydrophobicContact CG2-CG2 4.26Å; V198-L239 HydrophobicContact CG2-CD2 4.11Å
199	Y	96.1	Very high	92.2	Very high	75 Å²	75	57.6 Å²	57.6	29%	0.294	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	111.6	-176.4	-62.1	-83.8	0	0	0	109.9	L165 Y178 R179 Y218 Q219	L165-Y199 HydrophobicContact CD1-CD1 4.2Å; L165-Y199 HydrophobicContact CD1-CE1 4.5Å; Y178-Y199 WeakPolarHBondContact O-CA 3.21Å; R179-Y199 HydrophobicContact CB-CD1 4.25Å; R179-Y199 HydrophobicContact CB-CE1 4.24Å; R179-Y199 HydrophobicContact CG-CD1 4.31Å; R179-Y199 HydrophobicContact CG-CE1 3.96Å; Y199-Y218 CarbonylContact O-C 3.5Å; Y199-Y218 WeakPolarHBondContact O-CA 3.48Å; Y199-Y218 WeakPolarHBondContact O-CB 3.43Å; Y199-Q219 PolarHBondContact N-O 2.93Å; Y199-Q219 PolarHBondContact O-N 3.18Å
200	F	96.9	Very high	92.6	Very high	1 Å²	1	62.2 Å²	62.2	0%	0.004	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	138.3	172.2	-75.7	-101.1	0	0	0	110.1	I145 Y148 I149 W152 K177 Y178 V180 V198 L202 Y218	I145-F200 HydrophobicContact CD1-CB 3.95Å; I145-F200 HydrophobicContact CD1-CD1 4.48Å; I145-F200 HydrophobicContact CD1-CG 4.22Å; I145-F200 HydrophobicContact CG1-CD1 4.14Å; I145-F200 HydrophobicContact CG1-CG 4.32Å; I145-F200 HydrophobicContact CG2-CD1 4.36Å; I145-F200 HydrophobicContact CG2-CD2 4.11Å; I145-F200 HydrophobicContact CG2-CE1 4.28Å; I145-F200 HydrophobicContact CG2-CE2 4.02Å; I145-F200 HydrophobicContact CG2-CG 4.25Å; I145-F200 HydrophobicContact CG2-CZ 4.06Å; Y148-F200 AromaticContact CD1-CE1 3.75Å; Y148-F200 HydrophobicContact CD1-CE1 3.75Å; Y148-F200 AromaticContact CD1-CZ 3.99Å; Y148-F200 HydrophobicContact CD1-CZ 3.99Å; Y148-F200 HydrophobicContact CE1-CE1 4.09Å; Y148-F200 HydrophobicContact CE1-CZ 4.35Å; I149-F200 HydrophobicContact CG1-CZ 4.48Å; W152-F200 AromaticContact CH2-CE2 3.82Å; W152-F200 HydrophobicContact CH2-CE2 3.82Å; W152-F200 AromaticContact CH2-CZ 3.67Å; W152-F200 HydrophobicContact CH2-CZ 3.67Å; W152-F200 HydrophobicContact CZ2-CE1 4.4Å; W152-F200 HydrophobicContact CZ2-CE2 4.07Å; W152-F200 AromaticContact CZ2-CZ 3.42Å; W152-F200 HydrophobicContact CZ2-CZ 3.42Å; W152-F200 VanDerWaalsContact CZ2-CZ 3.42Å; K177-F200 WeakPolarHBondContact CA-O 3.24Å; Y178-F200 PolarHBondContact N-O 2.95Å; Y178-F200 PolarHBondContact O-N 2.71Å; V180-F200 HydrophobicContact CB-CE2 4.41Å; V180-F200 HydrophobicContact CG2-CD2 3.61Å; V180-F200 HydrophobicContact CG2-CE2 3.56Å; V198-F200 HydrophobicContact CB-CE2 4.37Å; V198-F200 HydrophobicContact CG1-CD2 4.15Å; V198-F200 HydrophobicContact CG1-CE2 3.78Å; F200-L202 HydrophobicContact CB-CD1 4.21Å; F200-Y218 HydrophobicContact CD1-CD1 4.47Å; F200-Y218 HydrophobicContact CD1-CG 4.38Å; F200-Y218 AromaticContact CE1-CD1 3.99Å; F200-Y218 HydrophobicContact CE1-CD1 3.99Å; F200-Y218 HydrophobicContact CE1-CG 4.06Å; F200-Y218 HydrophobicContact CZ-CD1 4.49Å; F200-Y218 HydrophobicContact CZ-CG 4.27Å
201	T	95.1	Very high	92.9	Very high	15 Å²	15	61.9 Å²	61.9	9%	0.092	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	119	170.9	-55.4	0	0	0	0	109.5	L175 H176 K177 Y217	L175-T201 HydrophobicContact CB-CG2 4.02Å; L175-T201 HydrophobicContact CD2-CG2 4.26Å; H176-T201 WeakPolarHBondContact O-CA 3.4Å; K177-T201 HydrophobicContact CG-CG2 4.33Å; T201-Y217 HydrophobicContact CG2-CE1 4.07Å; T201-Y217 HydrophobicContact CG2-CE2 4.1Å; T201-Y217 VanDerWaalsContact CG2-OH 3.32Å; T201-Y217 WeakPolarHBondContact CG2-OH 3.47Å; T201-Y217 PolarHBondContact N-O 3.5Å; T201-Y217 PolarHBondContact O-N 2.76Å; T201-Y217 VanDerWaalsContact O-N 3.16Å
202	L	96.4	Very high	93.2	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	110.8	175.2	-79.2	65.2	0	0	0	107	F136 I145 H176 Y178 F200 I214 V216	F136-L202 HydrophobicContact CD2-CD2 4.45Å; F136-L202 HydrophobicContact CE2-CB 4.36Å; F136-L202 HydrophobicContact CE2-CD2 3.53Å; F136-L202 HydrophobicContact CZ-CD2 4.21Å; I145-L202 HydrophobicContact CD1-CD1 3.84Å; I145-L202 HydrophobicContact CG1-CD1 4.26Å; H176-L202 HydrophobicContact CB-CB 4.24Å; H176-L202 PolarHBondContact N-O 2.9Å; H176-L202 PolarHBondContact O-N 2.85Å; Y178-L202 HydrophobicContact CD2-CD1 4.07Å; Y178-L202 HydrophobicContact CE2-CD1 4.08Å; Y178-L202 HydrophobicContact CE2-CD2 4.17Å; Y178-L202 HydrophobicContact CE2-CG 4.48Å; F200-L202 HydrophobicContact CB-CD1 4.21Å; L202-I214 HydrophobicContact CB-CD1 4.11Å; L202-I214 HydrophobicContact CD2-CD1 3.65Å; L202-I214 HydrophobicContact CG-CD1 3.87Å; L202-V216 HydrophobicContact CD1-CG1 3.87Å; L202-V216 HydrophobicContact CG-CG1 4.18Å; L202-V216 HydrophobicContact CG-CG2 3.98Å
203	R	94.9	Very high	93.5	Very high	92 Å²	92	59.1 Å²	59.1	35%	0.347	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	114.4	-174.7	176.4	175.5	174.3	173.5	4.1	109.5	E173 L175 L215 Y217	E173-R203 IonicContact OE1-CZ 3.3Å; E173-R203 IonicContact OE1-NE 2.94Å; E173-R203 PolarHBondContact OE1-NE 2.88Å; E173-R203 IonicContact OE1-NH2 2.72Å; E173-R203 PolarHBondContact OE1-NH2 3.24Å; E173-R203 IonicContact OE2-CZ 2.64Å; E173-R203 IonicContact OE2-NE 2.68Å; E173-R203 PolarHBondContact OE2-NE 3.42Å; E173-R203 IonicContact OE2-NH2 2.76Å; E173-R203 PolarHBondContact OE2-NH2 2.89Å; L175-R203 HydrophobicContact CD2-CB 3.77Å; L175-R203 HydrophobicContact CD2-CG 3.65Å; R203-L215 HydrophobicContact CB-CB 3.98Å; R203-L215 HydrophobicContact CG-CB 4.45Å; R203-L215 PolarHBondContact N-O 3.33Å; R203-L215 PolarHBondContact O-N 3.39Å; R203-L215 VanDerWaalsContact O-N 3.12Å; R203-Y217 HydrophobicContact CB-CE1 4.34Å
204	I	94.7	Very high	94.1	Very high	23 Å²	23	51.4 Å²	51.4	12%	0.118	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	125.7	175.7	-51.2	175.3	0	0	0	107.7	I133 F136 E173 T174 H176 I214	I133-I204 HydrophobicContact CB-CG2 4.49Å; I133-I204 HydrophobicContact CG1-CG2 4.32Å; I133-I204 HydrophobicContact CG2-CG2 3.82Å; F136-I204 HydrophobicContact CB-CD1 4.39Å; F136-I204 HydrophobicContact CD1-CD1 3.1Å; F136-I204 HydrophobicContact CD1-CG1 4.1Å; F136-I204 HydrophobicContact CE1-CD1 3.41Å; F136-I204 VanDerWaalsContact CE1-CD1 3.41Å; F136-I204 HydrophobicContact CE1-CG1 4.39Å; F136-I204 HydrophobicContact CG-CD1 3.8Å; F136-I204 HydrophobicContact CG-CG1 4.4Å; F136-I204 HydrophobicContact CZ-CD1 4.32Å; E173-I204 CarbonylContact C-O 3.47Å; E173-I204 WeakPolarHBondContact CA-O 3.49Å; E173-I204 WeakPolarHBondContact CB-O 3.33Å; T174-I204 PolarHBondContact N-O 3.49Å; T174-I204 PolarHBondContact O-N 3.29Å; H176-I204 WeakPolarHBondContact CD2-CD1 3.33Å; H176-I204 WeakPolarHBondContact NE2-CD1 3.36Å; I204-I214 HydrophobicContact CG1-CG2 4.31Å
205	S	93.7	Very high	94.4	Very high	6 Å²	6	54 Å²	54	4%	0.042	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	133.7	177.7	-172.6	0	0	0	0	110.4	I207	S205-I207 VanDerWaalsContact C-N 3.35Å; S205-I207 WeakPolarHBondContact OG-CG1 3.37Å
206	R	92	Very high	94.6	Very high	130 Å²	130	51.7 Å²	51.7	49%	0.491	26%	0.261	S	S	.	.	S	Bend	trans	-81.3	-17.3	176.2	-59	176.6	178.9	177.6	-6.9	112.3	E169 L170 N172 T174	E169-R206 IonicContact OE2-CZ 3Å; E169-R206 IonicContact OE2-NH2 2.83Å; E169-R206 PolarHBondContact OE2-NH2 3.33Å; L170-R206 PolarHBondContact O-NH1 3.41Å; N172-R206 VanDerWaalsContact O-CB 3.3Å; N172-R206 WeakPolarHBondContact O-CB 3.19Å; N172-R206 PolarHBondContact O-N 2.98Å; T174-R206 PolarHBondContact OG1-NE 2.9Å; T174-R206 PolarHBondContact OG1-NH2 2.74Å
207	I	93.9	Very high	94.6	Very high	123 Å²	123	54.5 Å²	54.5	63%	0.631	27%	0.272	S	S	*	.	S	Bend	trans	-97.9	-20.6	-178.8	58.7	167.2	0	0	0	113.3	N172 S205	N172-I207 HydrophobicContact CB-CG2 4.13Å; S205-I207 VanDerWaalsContact C-N 3.35Å; S205-I207 WeakPolarHBondContact OG-CG1 3.37Å
208	K	92.7	Very high	94.6	Very high	93 Å²	93	54 Å²	54	40%	0.404	27%	0.269	S	S	.	.	S	Bend	trans	-76.8	150.5	177	-71.5	-175.1	179.3	-174.8	0	110.1	I133	I133-K208 HydrophobicContact CD1-CB 3.75Å
209	P	95.4	Very high	94.5	Very high	81 Å²	81	56 Å²	56	53%	0.526	28%	0.278	S	S	.	.			trans	-62.8	144.6	177.5	24.8	-30.2	0	0	0	110.2	S211 S212	P209-S211 PolarHBondContact O-N 2.92Å; P209-S211 VanDerWaalsContact O-N 3.11Å; P209-S212 WeakPolarHBondContact CG-OG 3.39Å; P209-S212 VanDerWaalsContact O-CB 3.25Å; P209-S212 WeakPolarHBondContact O-CB 3.42Å; P209-S212 PolarHBondContact O-N 2.84Å; P209-S212 PolarHBondContact O-OG 2.91Å
210	K	93.7	Very high	94.3	Very high	137 Å²	137	52.4 Å²	52.4	60%	0.596	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-26.6	-176	-71.7	-169.3	-179.6	-176	0	114.1	I133 E134 S212	I133-K210 PolarHBondContact N-O 3.42Å; E134-K210 HydrophobicContact CB-CB 4.16Å; E134-K210 PolarHBondContact N-O 2.87Å; K210-S212 VanDerWaalsContact C-N 3.26Å; K210-S212 PolarHBondContact O-N 3.32Å
211	S	93.9	Very high	93.8	Very high	93 Å²	93	54 Å²	54	65%	0.65	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-10.7	174.5	56.2	0	0	0	0	114.5	P209	P209-S211 PolarHBondContact O-N 2.92Å; P209-S211 VanDerWaalsContact O-N 3.11Å
212	S	94.4	Very high	93.2	Very high	36 Å²	36	56.9 Å²	56.9	25%	0.252	29%	0.289	S	S	.	.	S	Bend	trans	-72.5	144.1	177.5	-66.8	0	0	0	0	111.5	T132 I133 P209 K210	T132-S212 CarbonylContact C-O 3.55Å; T132-S212 WeakPolarHBondContact CA-O 3.37Å; I133-S212 WeakPolarHBondContact CG1-O 2.83Å; I133-S212 PolarHBondContact N-O 3.04Å; P209-S212 WeakPolarHBondContact CG-OG 3.39Å; P209-S212 VanDerWaalsContact O-CB 3.25Å; P209-S212 WeakPolarHBondContact O-CB 3.42Å; P209-S212 PolarHBondContact O-N 2.84Å; P209-S212 PolarHBondContact O-OG 2.91Å; K210-S212 VanDerWaalsContact C-N 3.26Å; K210-S212 PolarHBondContact O-N 3.32Å
213	T	94.6	Very high	92.6	Very high	83 Å²	83	59 Å²	59	51%	0.509	30%	0.299	S	S	.	.	B	Isolated β-bridge	trans	-67.8	144.4	170.9	-37	0	0	0	0	111	W130 P131	W130-T213 HydrophobicContact CB-CG2 3.7Å; W130-T213 WeakPolarHBondContact O-CG2 3.04Å; P131-T213 WeakPolarHBondContact O-CG2 3.17Å
214	I	95.2	Very high	92	Very high	10 Å²	10	61.5 Å²	61.5	5%	0.051	31%	0.314	C	S	.	.	P	Polyproline II helix	trans	-63.9	152.3	174.2	63.7	165.6	0	0	0	111.6	W130 P131 I133 F136 L202 I204 V216	W130-I214 HydrophobicContact CB-CG1 4.32Å; P131-I214 HydrophobicContact CG-CD1 3.77Å; P131-I214 HydrophobicContact CG-CG1 4.14Å; P131-I214 WeakPolarHBondContact O-CG1 3.27Å; P131-I214 PolarHBondContact O-N 2.98Å; P131-I214 VanDerWaalsContact O-N 3.08Å; I133-I214 HydrophobicContact CG1-CG2 4.12Å; F136-I214 HydrophobicContact CB-CG2 4.19Å; F136-I214 HydrophobicContact CD2-CD1 3.81Å; F136-I214 HydrophobicContact CD2-CG2 4.44Å; F136-I214 HydrophobicContact CE2-CD1 4.1Å; F136-I214 HydrophobicContact CG-CG2 4.45Å; L202-I214 HydrophobicContact CB-CD1 4.11Å; L202-I214 HydrophobicContact CD2-CD1 3.65Å; L202-I214 HydrophobicContact CG-CD1 3.87Å; I204-I214 HydrophobicContact CG1-CG2 4.31Å; I214-V216 HydrophobicContact CD1-CG2 3.76Å; I214-V216 HydrophobicContact CG1-CG2 3.83Å
215	L	94.2	Very high	91.4	Very high	71 Å²	71	63.9 Å²	63.9	37%	0.372	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	127.4	172.4	-106.5	164.5	0	0	0	109.6	R203	R203-L215 HydrophobicContact CB-CB 3.98Å; R203-L215 HydrophobicContact CG-CB 4.45Å; R203-L215 PolarHBondContact N-O 3.33Å; R203-L215 PolarHBondContact O-N 3.39Å; R203-L215 VanDerWaalsContact O-N 3.12Å
216	V	95	Very high	91.3	Very high	7 Å²	7	68.4 Å²	68.4	4%	0.042	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	133.9	-179.6	-171.9	0	0	0	0	109.9	W130 L202 I214 P229	W130-V216 HydrophobicContact CD2-CB 4.25Å; W130-V216 HydrophobicContact CD2-CG1 4.48Å; W130-V216 HydrophobicContact CD2-CG2 3.63Å; W130-V216 HydrophobicContact CE3-CB 4.47Å; W130-V216 HydrophobicContact CE3-CG1 4.41Å; W130-V216 HydrophobicContact CE3-CG2 3.66Å; W130-V216 HydrophobicContact CG-CG2 4.01Å; W130-V216 HydrophobicContact CH2-CG1 3.85Å; W130-V216 HydrophobicContact CZ2-CB 4.41Å; W130-V216 HydrophobicContact CZ2-CG1 3.94Å; W130-V216 HydrophobicContact CZ3-CG1 4.09Å; W130-V216 HydrophobicContact CZ3-CG2 4.15Å; L202-V216 HydrophobicContact CD1-CG1 3.87Å; L202-V216 HydrophobicContact CG-CG1 4.18Å; L202-V216 HydrophobicContact CG-CG2 3.98Å; I214-V216 HydrophobicContact CD1-CG2 3.76Å; I214-V216 HydrophobicContact CG1-CG2 3.83Å; V216-P229 HydrophobicContact CB-CG 4.25Å; V216-P229 HydrophobicContact CG1-CG 3.98Å; V216-P229 VanDerWaalsContact O-CD 3.29Å; V216-P229 WeakPolarHBondContact O-CD 3.27Å
217	Y	95	Very high	91.2	Very high	59 Å²	59	63.3 Å²	63.3	23%	0.231	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	158.5	171.3	57.2	-87.6	0	0	0	110.2	T201 R203 I226 Q227	T201-Y217 HydrophobicContact CG2-CE1 4.07Å; T201-Y217 HydrophobicContact CG2-CE2 4.1Å; T201-Y217 VanDerWaalsContact CG2-OH 3.32Å; T201-Y217 WeakPolarHBondContact CG2-OH 3.47Å; T201-Y217 PolarHBondContact N-O 3.5Å; T201-Y217 PolarHBondContact O-N 2.76Å; T201-Y217 VanDerWaalsContact O-N 3.16Å; R203-Y217 HydrophobicContact CB-CE1 4.34Å; Y217-I226 HydrophobicContact CD2-CG2 3.65Å; Y217-I226 HydrophobicContact CG-CG2 3.97Å; Y217-Q227 CarbonylContact C-O 3.57Å; Y217-Q227 VanDerWaalsContact CA-O 3.25Å; Y217-Q227 WeakPolarHBondContact CA-O 3.24Å; Y217-Q227 WeakPolarHBondContact CB-O 3.3Å
218	Y	94.4	Very high	91.1	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	156.5	178.6	65.8	-85.5	0	0	0	112.2	Y148 W152 V198 Y199 F200 Q227 P229 F234	Y148-Y218 HydrophobicContact CE1-CD1 4.25Å; Y148-Y218 AromaticContact CE1-CE1 3.79Å; Y148-Y218 HydrophobicContact CE1-CE1 3.79Å; W152-Y218 HydrophobicContact CZ2-CE2 4.36Å; V198-Y218 HydrophobicContact CG1-CD2 3.73Å; V198-Y218 HydrophobicContact CG1-CG 4.32Å; Y199-Y218 CarbonylContact O-C 3.5Å; Y199-Y218 WeakPolarHBondContact O-CA 3.48Å; Y199-Y218 WeakPolarHBondContact O-CB 3.43Å; F200-Y218 HydrophobicContact CD1-CD1 4.47Å; F200-Y218 HydrophobicContact CD1-CG 4.38Å; F200-Y218 AromaticContact CE1-CD1 3.99Å; F200-Y218 HydrophobicContact CE1-CD1 3.99Å; F200-Y218 HydrophobicContact CE1-CG 4.06Å; F200-Y218 HydrophobicContact CZ-CD1 4.49Å; F200-Y218 HydrophobicContact CZ-CG 4.27Å; Y218-Q227 HydrophobicContact CD1-CB 4.04Å; Y218-Q227 HydrophobicContact CD2-CB 3.87Å; Y218-Q227 HydrophobicContact CD2-CG 4.37Å; Y218-Q227 HydrophobicContact CE1-CB 3.6Å; Y218-Q227 HydrophobicContact CE2-CB 3.43Å; Y218-Q227 VanDerWaalsContact CE2-CB 3.43Å; Y218-Q227 HydrophobicContact CE2-CG 3.82Å; Y218-Q227 HydrophobicContact CG-CB 4.16Å; Y218-Q227 PolarHBondContact N-O 3.31Å; Y218-Q227 PolarHBondContact O-N 2.9Å; Y218-P229 HydrophobicContact CD1-CG 4.33Å; Y218-P229 HydrophobicContact CE1-CG 4.34Å; Y218-F234 AromaticContact CE2-CD2 3.79Å; Y218-F234 HydrophobicContact CE2-CD2 3.79Å; Y218-F234 HydrophobicContact CE2-CE2 4.17Å
219	Q	92.7	Very high	91	Very high	40 Å²	40	56.3 Å²	56.3	19%	0.187	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	128.3	177.2	-172.7	-178.4	56.6	0	0	108.7	Y199 F223 H224	Y199-Q219 PolarHBondContact N-O 2.93Å; Y199-Q219 PolarHBondContact O-N 3.18Å; Q219-F223 VanDerWaalsContact CD-O 3.24Å; Q219-F223 WeakPolarHBondContact CG-O 3.27Å; Q219-F223 PolarHBondContact NE2-O 2.94Å; Q219-H224 PolarHBondContact NE2-O 2.9Å
220	V	91.7	Very high	90.7	Very high	1 Å²	1	53.5 Å²	53.5	1%	0.006	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	146.2	170.8	-177.6	0	0	0	0	108.4	V196 V198 F223 F234 W238 V242	V196-V220 HydrophobicContact CG1-CG1 4.15Å; V198-V220 HydrophobicContact CG2-CG2 4.26Å; V220-F223 HydrophobicContact CB-CB 4.32Å; V220-F223 HydrophobicContact CB-CD1 4.43Å; V220-F223 HydrophobicContact CB-CD2 4.02Å; V220-F223 HydrophobicContact CB-CE2 4.47Å; V220-F223 HydrophobicContact CB-CG 4.01Å; V220-F223 HydrophobicContact CG1-CD1 4.34Å; V220-F223 HydrophobicContact CG1-CE1 4.42Å; V220-F223 HydrophobicContact CG1-CG 4.4Å; V220-F223 PolarHBondContact O-N 2.91Å; V220-F234 HydrophobicContact CG2-CE2 4.26Å; V220-W238 HydrophobicContact CG2-CE3 4.06Å; V220-V242 HydrophobicContact CG1-CG2 3.96Å
221	E	87.1	Confident	90.4	Very high	35 Å²	35	53.8 Å²	53.8	16%	0.164	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-45.9	144.1	173.1	-151.3	178.4	149.8	0	0	111.8	V196 S197 F223 V242 K246	V196-E221 HydrophobicContact CG1-CB 4.36Å; S197-E221 PolarHBondContact N-OE2 3.02Å; S197-E221 WeakPolarHBondContact O-CA 3.47Å; S197-E221 VanDerWaalsContact O-CB 3.26Å; S197-E221 WeakPolarHBondContact O-CB 3.32Å; S197-E221 PolarHBondContact O-N 2.78Å; E221-F223 WeakPolarHBondContact O-CD1 3.41Å; E221-F223 PolarHBondContact O-N 3.46Å; E221-V242 HydrophobicContact CB-CG1 4.07Å; E221-V242 HydrophobicContact CB-CG2 4.5Å; E221-V242 WeakPolarHBondContact O-CG2 3.45Å; E221-K246 VanDerWaalsContact CD-CE 3.41Å; E221-K246 WeakPolarHBondContact OE1-CE 3.29Å; E221-K246 IonicContact OE1-NZ 2.71Å; E221-K246 PolarHBondContact OE1-NZ 3.26Å; E221-K246 IonicContact OE2-NZ 2.86Å; E221-K246 PolarHBondContact OE2-NZ 3.22Å
222	T	81.2	Confident	90	Very high	74 Å²	74	50.8 Å²	50.8	45%	0.454	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.4	-17.2	-178.9	75	0	0	0	0	116.4
223	F	83.8	Confident	89.6	Confident	46 Å²	46	54.2 Å²	54.2	20%	0.202	28%	0.279	C	S	.	.			trans	-77.5	143.6	-178	-72.1	27.3	0	0	0	110.2	R66 Q219 V220 E221 W238 V242	R66-F223 PolarHBondContact NH2-O 3.01Å; Q219-F223 VanDerWaalsContact CD-O 3.24Å; Q219-F223 WeakPolarHBondContact CG-O 3.27Å; Q219-F223 PolarHBondContact NE2-O 2.94Å; V220-F223 HydrophobicContact CB-CB 4.32Å; V220-F223 HydrophobicContact CB-CD1 4.43Å; V220-F223 HydrophobicContact CB-CD2 4.02Å; V220-F223 HydrophobicContact CB-CE2 4.47Å; V220-F223 HydrophobicContact CB-CG 4.01Å; V220-F223 HydrophobicContact CG1-CD1 4.34Å; V220-F223 HydrophobicContact CG1-CE1 4.42Å; V220-F223 HydrophobicContact CG1-CG 4.4Å; V220-F223 PolarHBondContact O-N 2.91Å; E221-F223 WeakPolarHBondContact O-CD1 3.41Å; E221-F223 PolarHBondContact O-N 3.46Å; F223-W238 HydrophobicContact CE2-CB 3.64Å; F223-W238 AromaticContact CE2-CD1 3.78Å; F223-W238 HydrophobicContact CE2-CD2 4.13Å; F223-W238 AromaticContact CE2-CG 3.58Å; F223-W238 HydrophobicContact CE2-CG 3.58Å; F223-W238 HydrophobicContact CZ-CB 3.76Å; F223-W238 HydrophobicContact CZ-CG 4.1Å; F223-V242 HydrophobicContact CD1-CG2 4.24Å; F223-V242 HydrophobicContact CE1-CG2 3.72Å
224	H	83.2	Confident	89.4	Confident	144 Å²	144	50.5 Å²	50.5	67%	0.667	26%	0.256	S	S	*	.			trans	-83.5	-32.3	172.2	-67.8	85.5	0	0	0	111.3	Q219 I226	Q219-H224 PolarHBondContact NE2-O 2.9Å; H224-I226 PolarHBondContact O-N 3.5Å
225	S	82.3	Confident	89.1	Confident	72 Å²	72	52.1 Å²	52.1	50%	0.503	27%	0.268	S	S	.	.			trans	-67.9	127.5	-176.2	-51.7	0	0	0	0	112.4
226	I	90.4	Very high	89	Confident	101 Å²	101	51.9 Å²	51.9	52%	0.518	27%	0.265	S	S	.	.			trans	-89.6	131.8	170.6	-62.4	173.6	0	0	0	108.4	Y217 H224	Y217-I226 HydrophobicContact CD2-CG2 3.65Å; Y217-I226 HydrophobicContact CG-CG2 3.97Å; H224-I226 PolarHBondContact O-N 3.5Å
227	Q	90.2	Very high	88.9	Confident	23 Å²	23	60 Å²	60	11%	0.107	30%	0.295	C	S	.	.	B	Isolated β-bridge	trans	-106.1	144.6	180	-56	-57.1	-31.6	0	0	110.5	Y217 Y218 S232 W238	Y217-Q227 CarbonylContact C-O 3.57Å; Y217-Q227 VanDerWaalsContact CA-O 3.25Å; Y217-Q227 WeakPolarHBondContact CA-O 3.24Å; Y217-Q227 WeakPolarHBondContact CB-O 3.3Å; Y218-Q227 HydrophobicContact CD1-CB 4.04Å; Y218-Q227 HydrophobicContact CD2-CB 3.87Å; Y218-Q227 HydrophobicContact CD2-CG 4.37Å; Y218-Q227 HydrophobicContact CE1-CB 3.6Å; Y218-Q227 HydrophobicContact CE2-CB 3.43Å; Y218-Q227 VanDerWaalsContact CE2-CB 3.43Å; Y218-Q227 HydrophobicContact CE2-CG 3.82Å; Y218-Q227 HydrophobicContact CG-CB 4.16Å; Y218-Q227 PolarHBondContact N-O 3.31Å; Y218-Q227 PolarHBondContact O-N 2.9Å; Q227-S232 PolarHBondContact OE1-OG 2.87Å; Q227-W238 HydrophobicContact CG-CH2 4.14Å; Q227-W238 HydrophobicContact CG-CZ3 3.94Å
228	I	91.6	Very high	88.8	Confident	59 Å²	59	59.8 Å²	59.8	30%	0.303	29%	0.294	S	S	.	.			trans	-120.6	126.2	-179.3	-60.2	172.6	0	0	0	108.2	G230 K231 S232	I228-G230 PolarHBondContact O-N 2.83Å; I228-K231 HydrophobicContact CB-CB 4.2Å; I228-K231 HydrophobicContact CB-CD 4.03Å; I228-K231 HydrophobicContact CB-CG 4.19Å; I228-K231 HydrophobicContact CD1-CD 4.1Å; I228-K231 HydrophobicContact CG2-CD 3.97Å; I228-K231 HydrophobicContact CG2-CG 4.05Å; I228-K231 PolarHBondContact O-N 3.47Å; I228-S232 PolarHBondContact O-N 2.87Å
229	P	90.9	Very high	88.7	Confident	11 Å²	11	59.8 Å²	59.8	7%	0.071	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.5	133.4	174.6	-28.3	36.9	0	0	0	112.7	W130 Y148 V216 Y218 K231	W130-P229 HydrophobicContact CZ2-CB 3.92Å; W130-P229 HydrophobicContact CZ2-CG 3.68Å; Y148-P229 HydrophobicContact CD2-CB 4.39Å; Y148-P229 HydrophobicContact CE1-CB 4.33Å; Y148-P229 HydrophobicContact CE1-CG 4.07Å; Y148-P229 HydrophobicContact CE2-CB 3.72Å; Y148-P229 HydrophobicContact CE2-CG 4.33Å; Y148-P229 WeakPolarHBondContact OH-CA 3.41Å; V216-P229 HydrophobicContact CB-CG 4.25Å; V216-P229 HydrophobicContact CG1-CG 3.98Å; V216-P229 VanDerWaalsContact O-CD 3.29Å; V216-P229 WeakPolarHBondContact O-CD 3.27Å; Y218-P229 HydrophobicContact CD1-CG 4.33Å; Y218-P229 HydrophobicContact CE1-CG 4.34Å; P229-K231 VanDerWaalsContact C-N 3.25Å; P229-K231 PolarHBondContact O-N 2.78Å
230	G	89	Confident	88.6	Confident	22 Å²	22	60.2 Å²	60.2	23%	0.227	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	76.6	-1	-177.4	0	0	0	0	0	116	F125 I228	F125-G230 WeakPolarHBondContact CD2-O 3.31Å; I228-G230 PolarHBondContact O-N 2.83Å
231	K	87.3	Confident	88.5	Confident	142 Å²	142	63 Å²	63	62%	0.617	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.2	-21.8	172.3	-62	-166.4	178.8	-175	0	113.8	I228 P229	I228-K231 HydrophobicContact CB-CB 4.2Å; I228-K231 HydrophobicContact CB-CD 4.03Å; I228-K231 HydrophobicContact CB-CG 4.19Å; I228-K231 HydrophobicContact CD1-CD 4.1Å; I228-K231 HydrophobicContact CG2-CD 3.97Å; I228-K231 HydrophobicContact CG2-CG 4.05Å; I228-K231 PolarHBondContact O-N 3.47Å; P229-K231 VanDerWaalsContact C-N 3.25Å; P229-K231 PolarHBondContact O-N 2.78Å
232	S	85.7	Confident	88.7	Confident	31 Å²	31	61.4 Å²	61.4	22%	0.217	31%	0.306	C	S	.	.	S	Bend	trans	-136.2	142.3	179.7	-54.2	0	0	0	0	109.1	Q227 I228	Q227-S232 PolarHBondContact OE1-OG 2.87Å; I228-S232 PolarHBondContact O-N 2.87Å
233	R	86.7	Confident	89	Confident	107 Å²	107	58.8 Å²	58.8	40%	0.404	29%	0.289	S	S	.	.			trans	-82.2	133.3	167.9	-174.6	169.2	165.9	104.7	0.4	108.7	F125 E153 W238	F125-R233 HydrophobicContact CD1-CB 4.17Å; E153-R233 IonicContact OE2-CZ 3.21Å; E153-R233 VanDerWaalsContact OE2-CZ 3.27Å; E153-R233 IonicContact OE2-NH1 2.69Å; E153-R233 PolarHBondContact OE2-NH1 3.42Å; E153-R233 IonicContact OE2-NH2 3.96Å; E153-R233 PolarHBondContact OE2-NH2 3.17Å; R233-W238 WeakPolarHBondContact O-CH2 3.3Å
234	F	90.1	Very high	89.3	Confident	6 Å²	6	61 Å²	61	3%	0.026	30%	0.303	C	S	.	.			trans	-68.1	134.6	172.7	-171.6	-87.8	0	0	0	109.5	W152 I154 Y218 V220 W238 L239	W152-F234 HydrophobicContact CB-CB 4.1Å; W152-F234 HydrophobicContact CB-CD1 3.9Å; W152-F234 HydrophobicContact CB-CG 4.16Å; W152-F234 AromaticContact CD1-CG 3.99Å; W152-F234 HydrophobicContact CD2-CB 3.95Å; W152-F234 AromaticContact CD2-CD1 3.73Å; W152-F234 HydrophobicContact CD2-CD1 3.73Å; W152-F234 AromaticContact CD2-CD2 3.71Å; W152-F234 HydrophobicContact CD2-CD2 3.71Å; W152-F234 HydrophobicContact CD2-CE1 4.16Å; W152-F234 HydrophobicContact CD2-CE2 4.14Å; W152-F234 AromaticContact CD2-CG 3.49Å; W152-F234 HydrophobicContact CD2-CG 3.49Å; W152-F234 VanDerWaalsContact CD2-CG 3.49Å; W152-F234 HydrophobicContact CD2-CZ 4.35Å; W152-F234 AromaticContact CE2-CD2 3.53Å; W152-F234 AromaticContact CE2-CG 3.7Å; W152-F234 AromaticContact CE3-CD1 3.79Å; W152-F234 HydrophobicContact CE3-CD1 3.79Å; W152-F234 AromaticContact CE3-CD2 3.93Å; W152-F234 HydrophobicContact CE3-CD2 3.93Å; W152-F234 AromaticContact CE3-CE1 3.72Å; W152-F234 HydrophobicContact CE3-CE1 3.72Å; W152-F234 AromaticContact CE3-CE2 3.87Å; W152-F234 HydrophobicContact CE3-CE2 3.87Å; W152-F234 AromaticContact CE3-CG 3.9Å; W152-F234 HydrophobicContact CE3-CG 3.9Å; W152-F234 AromaticContact CE3-CZ 3.77Å; W152-F234 HydrophobicContact CE3-CZ 3.77Å; W152-F234 HydrophobicContact CG-CB 3.63Å; W152-F234 AromaticContact CG-CD1 3.84Å; W152-F234 HydrophobicContact CG-CD1 3.84Å; W152-F234 HydrophobicContact CG-CD2 4.32Å; W152-F234 AromaticContact CG-CG 3.66Å; W152-F234 HydrophobicContact CG-CG 3.66Å; W152-F234 AromaticContact CH2-CD2 3.82Å; W152-F234 HydrophobicContact CH2-CD2 3.82Å; W152-F234 AromaticContact CH2-CE2 3.56Å; W152-F234 HydrophobicContact CH2-CE2 3.56Å; W152-F234 HydrophobicContact CH2-CZ 4.12Å; W152-F234 AromaticContact CZ2-CD2 3.55Å; W152-F234 HydrophobicContact CZ2-CD2 3.55Å; W152-F234 AromaticContact CZ2-CE2 3.81Å; W152-F234 HydrophobicContact CZ2-CE2 3.81Å; W152-F234 HydrophobicContact CZ2-CG 4.2Å; W152-F234 HydrophobicContact CZ3-CD1 4.48Å; W152-F234 HydrophobicContact CZ3-CD2 4.01Å; W152-F234 HydrophobicContact CZ3-CE1 4.11Å; W152-F234 AromaticContact CZ3-CE2 3.6Å; W152-F234 HydrophobicContact CZ3-CE2 3.6Å; W152-F234 HydrophobicContact CZ3-CG 4.44Å; W152-F234 AromaticContact CZ3-CZ 3.66Å; W152-F234 HydrophobicContact CZ3-CZ 3.66Å; I154-F234 HydrophobicContact CG2-CD1 4.06Å; I154-F234 HydrophobicContact CG2-CE1 4.01Å; Y218-F234 AromaticContact CE2-CD2 3.79Å; Y218-F234 HydrophobicContact CE2-CD2 3.79Å; Y218-F234 HydrophobicContact CE2-CE2 4.17Å; V220-F234 HydrophobicContact CG2-CE2 4.26Å; F234-W238 HydrophobicContact CD2-CE3 4.22Å; F234-W238 HydrophobicContact CD2-CZ3 4.25Å; F234-W238 HydrophobicContact CE2-CE3 4.27Å; F234-L239 HydrophobicContact CE1-CD1 3.81Å; F234-L239 HydrophobicContact CE1-CD2 4.49Å; F234-L239 HydrophobicContact CE1-CG 3.96Å; F234-L239 HydrophobicContact CZ-CD1 3.91Å; F234-L239 HydrophobicContact CZ-CD2 3.77Å; F234-L239 HydrophobicContact CZ-CG 3.72Å
235	S	89.8	Confident	89.5	Confident	44 Å²	44	57 Å²	57	31%	0.308	29%	0.292	S	S	.	.			trans	-113	125.1	177	-178.2	0	0	0	0	110.4	R237 W238	S235-R237 PolarHBondContact O-N 3.23Å; S235-R237 WeakPolarHBondContact OG-CB 3.37Å; S235-R237 PolarHBondContact OG-N 3.43Å; S235-W238 WeakPolarHBondContact O-CB 3.12Å; S235-W238 PolarHBondContact O-N 2.89Å; S235-W238 VanDerWaalsContact O-N 3.08Å
236	E	92.2	Very high	89.7	Confident	65 Å²	65	55.9 Å²	55.9	30%	0.304	28%	0.278	S	S	.	.	H	α-helix	trans	-57.1	-31	174	-174.1	174.2	159.1	0	0	111.8	I154 S155 W158 W238 L239 T240	I154-E236 HydrophobicContact CG2-CB 4.28Å; S155-E236 WeakPolarHBondContact CB-OE1 3.37Å; S155-E236 PolarHBondContact N-OE2 2.71Å; W158-E236 HydrophobicContact CZ2-CG 4.34Å; W158-E236 PolarHBondContact NE1-OE1 3.21Å; E236-W238 PolarHBondContact O-N 3.33Å; E236-L239 WeakPolarHBondContact O-CB 3.43Å; E236-L239 PolarHBondContact O-N 2.95Å; E236-T240 PolarHBondContact O-N 2.72Å; E236-T240 PolarHBondContact O-OG1 3.25Å
237	R	91.7	Very high	89.5	Confident	178 Å²	178	54.8 Å²	54.8	67%	0.672	27%	0.272	S	S	*	.	H	α-helix	trans	-54.2	-37.4	176.2	-172.1	173.9	-178.8	158.8	2.3	112	S235 L239 T240 D241	S235-R237 PolarHBondContact O-N 3.23Å; S235-R237 WeakPolarHBondContact OG-CB 3.37Å; S235-R237 PolarHBondContact OG-N 3.43Å; R237-L239 PolarHBondContact O-N 2.92Å; R237-T240 PolarHBondContact O-N 2.88Å; R237-D241 WeakPolarHBondContact O-CB 3.33Å; R237-D241 PolarHBondContact O-N 3.4Å
238	W	92.2	Very high	89.3	Confident	55 Å²	55	59.7 Å²	59.7	21%	0.208	29%	0.29	C	S	.	.	H	α-helix	trans	-59.9	-35.4	177.9	-59.4	-15.6	0	0	0	112.6	V220 F223 Q227 R233 F234 S235 E236 V242	V220-W238 HydrophobicContact CG2-CE3 4.06Å; F223-W238 HydrophobicContact CE2-CB 3.64Å; F223-W238 AromaticContact CE2-CD1 3.78Å; F223-W238 HydrophobicContact CE2-CD2 4.13Å; F223-W238 AromaticContact CE2-CG 3.58Å; F223-W238 HydrophobicContact CE2-CG 3.58Å; F223-W238 HydrophobicContact CZ-CB 3.76Å; F223-W238 HydrophobicContact CZ-CG 4.1Å; Q227-W238 HydrophobicContact CG-CH2 4.14Å; Q227-W238 HydrophobicContact CG-CZ3 3.94Å; R233-W238 WeakPolarHBondContact O-CH2 3.3Å; F234-W238 HydrophobicContact CD2-CE3 4.22Å; F234-W238 HydrophobicContact CD2-CZ3 4.25Å; F234-W238 HydrophobicContact CE2-CE3 4.27Å; S235-W238 WeakPolarHBondContact O-CB 3.12Å; S235-W238 PolarHBondContact O-N 2.89Å; S235-W238 VanDerWaalsContact O-N 3.08Å; E236-W238 PolarHBondContact O-N 3.33Å; W238-V242 WeakPolarHBondContact O-CG2 3.4Å; W238-V242 PolarHBondContact O-N 2.94Å
239	L	92.3	Very high	88.9	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-72.2	-46.7	176.8	-59	175.7	0	0	0	110.8	W158 L182 V196 V198 F234 E236 R237 D241 V242 I243	W158-L239 HydrophobicContact CD2-CD1 4.15Å; W158-L239 HydrophobicContact CE3-CD1 4.22Å; W158-L239 HydrophobicContact CH2-CB 3.34Å; W158-L239 HydrophobicContact CH2-CD1 4.12Å; W158-L239 HydrophobicContact CH2-CG 4.35Å; W158-L239 HydrophobicContact CZ2-CB 3.57Å; W158-L239 HydrophobicContact CZ2-CD1 4.04Å; W158-L239 HydrophobicContact CZ2-CG 4.48Å; W158-L239 HydrophobicContact CZ3-CB 4.02Å; W158-L239 HydrophobicContact CZ3-CD1 4.2Å; L182-L239 HydrophobicContact CD1-CD2 4.09Å; L182-L239 HydrophobicContact CD2-CD1 3.89Å; V196-L239 HydrophobicContact CB-CD2 4.06Å; V196-L239 HydrophobicContact CG1-CD2 3.59Å; V196-L239 HydrophobicContact CG2-CB 4.42Å; V196-L239 WeakPolarHBondContact CG2-O 3.37Å; V198-L239 HydrophobicContact CG2-CD2 4.11Å; F234-L239 HydrophobicContact CE1-CD1 3.81Å; F234-L239 HydrophobicContact CE1-CD2 4.49Å; F234-L239 HydrophobicContact CE1-CG 3.96Å; F234-L239 HydrophobicContact CZ-CD1 3.91Å; F234-L239 HydrophobicContact CZ-CD2 3.77Å; F234-L239 HydrophobicContact CZ-CG 3.72Å; E236-L239 WeakPolarHBondContact O-CB 3.43Å; E236-L239 PolarHBondContact O-N 2.95Å; R237-L239 PolarHBondContact O-N 2.92Å; L239-D241 VanDerWaalsContact C-N 3.31Å; L239-D241 PolarHBondContact O-N 2.86Å; L239-V242 PolarHBondContact O-N 3.48Å; L239-I243 PolarHBondContact O-N 3.46Å
240	T	91.1	Very high	88.5	Confident	48 Å²	48	63.8 Å²	63.8	29%	0.294	31%	0.309	S	S	.	.	H	α-helix	trans	-59.7	-42.2	178.8	-56.6	0	0	0	0	111.6	E236 R237 V242 I243 N244	E236-T240 PolarHBondContact O-N 2.72Å; E236-T240 PolarHBondContact O-OG1 3.25Å; R237-T240 PolarHBondContact O-N 2.88Å; T240-V242 VanDerWaalsContact C-N 3.34Å; T240-V242 PolarHBondContact O-N 3.26Å; T240-I243 PolarHBondContact O-N 3.06Å; T240-N244 WeakPolarHBondContact O-CB 3.37Å; T240-N244 VanDerWaalsContact O-CG 3.26Å; T240-N244 PolarHBondContact O-N 2.84Å; T240-N244 PolarHBondContact O-ND2 2.96Å
241	D	90.5	Very high	88.1	Confident	61 Å²	61	67.2 Å²	67.2	33%	0.326	33%	0.33	S	S	.	.	H	α-helix	trans	-60.2	-42.9	177.8	-67.6	-18.4	0	0	0	111.5	R237 L239 S245	R237-D241 WeakPolarHBondContact O-CB 3.33Å; R237-D241 PolarHBondContact O-N 3.4Å; L239-D241 VanDerWaalsContact C-N 3.31Å; L239-D241 PolarHBondContact O-N 2.86Å; D241-S245 VanDerWaalsContact O-CB 3.24Å; D241-S245 WeakPolarHBondContact O-CB 3.44Å; D241-S245 PolarHBondContact O-N 2.71Å; D241-S245 PolarHBondContact O-OG 3.35Å
242	V	89.8	Confident	87.9	Confident	1 Å²	1	65.1 Å²	65.1	1%	0.006	32%	0.319	C	S	.	.	H	α-helix	trans	-65.2	-45.7	175.9	174.3	0	0	0	0	111.2	V196 V220 E221 F223 W238 L239 T240 S245 K246	V196-V242 HydrophobicContact CB-CG1 4.37Å; V196-V242 HydrophobicContact CG1-CB 4.04Å; V196-V242 HydrophobicContact CG1-CG1 3.96Å; V196-V242 HydrophobicContact CG1-CG2 4.3Å; V196-V242 HydrophobicContact CG2-CB 3.95Å; V196-V242 HydrophobicContact CG2-CG1 3.92Å; V220-V242 HydrophobicContact CG1-CG2 3.96Å; E221-V242 HydrophobicContact CB-CG1 4.07Å; E221-V242 HydrophobicContact CB-CG2 4.5Å; E221-V242 WeakPolarHBondContact O-CG2 3.45Å; F223-V242 HydrophobicContact CD1-CG2 4.24Å; F223-V242 HydrophobicContact CE1-CG2 3.72Å; W238-V242 WeakPolarHBondContact O-CG2 3.4Å; W238-V242 PolarHBondContact O-N 2.94Å; L239-V242 PolarHBondContact O-N 3.48Å; T240-V242 VanDerWaalsContact C-N 3.34Å; T240-V242 PolarHBondContact O-N 3.26Å; V242-S245 PolarHBondContact O-N 3.04Å; V242-K246 HydrophobicContact CG1-CD 4.28Å; V242-K246 WeakPolarHBondContact O-CG 3.14Å; V242-K246 PolarHBondContact O-N 3.05Å
243	I	88.9	Confident	87.6	Confident	19 Å²	19	67.3 Å²	67.3	10%	0.097	33%	0.331	C	S	.	.	H	α-helix	trans	-60.4	-50.3	178.9	-70.2	-169.3	0	0	0	110.6	W158 V196 L239 T240 S245 K246 I247	W158-I243 HydrophobicContact CH2-CD1 3.48Å; W158-I243 VanDerWaalsContact CH2-CD1 3.48Å; W158-I243 HydrophobicContact CH2-CG1 4.32Å; W158-I243 HydrophobicContact CZ3-CD1 3.65Å; V196-I243 HydrophobicContact CG2-CD1 3.95Å; V196-I243 HydrophobicContact CG2-CG1 3.31Å; L239-I243 PolarHBondContact O-N 3.46Å; T240-I243 PolarHBondContact O-N 3.06Å; I243-S245 VanDerWaalsContact C-N 3.31Å; I243-S245 PolarHBondContact O-N 3.27Å; I243-K246 PolarHBondContact O-N 3.38Å; I243-I247 HydrophobicContact CG2-CD1 3.54Å; I243-I247 HydrophobicContact CG2-CG1 4.22Å; I243-I247 WeakPolarHBondContact O-CG1 3.38Å; I243-I247 PolarHBondContact O-N 3.48Å
244	N	88.7	Confident	87.1	Confident	91 Å²	91	68.7 Å²	68.7	49%	0.487	35%	0.351	S	S	.	.	H	α-helix	trans	-61.3	-42.9	-178.4	-72.1	-15	0	0	0	111	T240 K246 I247 R248	T240-N244 WeakPolarHBondContact O-CB 3.37Å; T240-N244 VanDerWaalsContact O-CG 3.26Å; T240-N244 PolarHBondContact O-N 2.84Å; T240-N244 PolarHBondContact O-ND2 2.96Å; N244-K246 PolarHBondContact O-N 3.29Å; N244-I247 PolarHBondContact O-N 2.86Å; N244-R248 WeakPolarHBondContact O-CB 3.22Å; N244-R248 PolarHBondContact O-N 3.06Å
245	S	88.4	Confident	86.2	Confident	62 Å²	62	79.6 Å²	79.6	43%	0.434	40%	0.399	S	S	.	.	H	α-helix	trans	-59.8	-45.5	175.2	-61.4	0	0	0	0	111.6	D241 V242 I243 R248 L249	D241-S245 VanDerWaalsContact O-CB 3.24Å; D241-S245 WeakPolarHBondContact O-CB 3.44Å; D241-S245 PolarHBondContact O-N 2.71Å; D241-S245 PolarHBondContact O-OG 3.35Å; V242-S245 PolarHBondContact O-N 3.04Å; I243-S245 VanDerWaalsContact C-N 3.31Å; I243-S245 PolarHBondContact O-N 3.27Å; S245-R248 PolarHBondContact O-N 3.39Å; S245-L249 WeakPolarHBondContact O-CB 3.36Å; S245-L249 VanDerWaalsContact O-CG 3.22Å; S245-L249 WeakPolarHBondContact O-CG 3.3Å; S245-L249 PolarHBondContact O-N 3.19Å
246	K	86.8	Confident	86	Confident	48 Å²	48	81.4 Å²	81.4	21%	0.209	40%	0.403	C	S	.	.	H	α-helix	trans	-64.2	-43.4	176.9	-76.5	-178.2	176.2	-172	0	113	S194 T195 E221 V242 I243 N244 R248 L249 M250	S194-K246 WeakPolarHBondContact OG-CB 3.28Å; S194-K246 WeakPolarHBondContact OG-CD 3.18Å; T195-K246 PolarHBondContact O-NZ 3.42Å; E221-K246 VanDerWaalsContact CD-CE 3.41Å; E221-K246 WeakPolarHBondContact OE1-CE 3.29Å; E221-K246 IonicContact OE1-NZ 2.71Å; E221-K246 PolarHBondContact OE1-NZ 3.26Å; E221-K246 IonicContact OE2-NZ 2.86Å; E221-K246 PolarHBondContact OE2-NZ 3.22Å; V242-K246 HydrophobicContact CG1-CD 4.28Å; V242-K246 WeakPolarHBondContact O-CG 3.14Å; V242-K246 PolarHBondContact O-N 3.05Å; I243-K246 PolarHBondContact O-N 3.38Å; N244-K246 PolarHBondContact O-N 3.29Å; K246-R248 VanDerWaalsContact C-N 3.32Å; K246-L249 PolarHBondContact O-N 3.27Å; K246-M250 WeakPolarHBondContact O-CB 3.46Å; K246-M250 VanDerWaalsContact O-CG 3.3Å; K246-M250 WeakPolarHBondContact O-CG 3.23Å; K246-M250 PolarHBondContact O-N 3.24Å
247	I	85.1	Confident	85.7	Confident	78 Å²	78	82.3 Å²	82.3	40%	0.4	41%	0.409	S	S	.	.	H	α-helix	trans	-62.4	-43.6	178.1	-69.4	171.4	0	0	0	110	I243 N244 L249 M250	I243-I247 HydrophobicContact CG2-CD1 3.54Å; I243-I247 HydrophobicContact CG2-CG1 4.22Å; I243-I247 WeakPolarHBondContact O-CG1 3.38Å; I243-I247 PolarHBondContact O-N 3.48Å; N244-I247 PolarHBondContact O-N 2.86Å; I247-L249 VanDerWaalsContact C-N 3.33Å; I247-L249 PolarHBondContact O-N 3.01Å; I247-M250 PolarHBondContact O-N 3.17Å
248	R	86.2	Confident	85.3	Confident	126 Å²	126	76.9 Å²	76.9	48%	0.475	39%	0.394	S	S	.	.	H	α-helix	trans	-62	-40.5	175.3	-176	177.5	177.2	172.7	2.6	111.6	E47 N244 S245 K246 S251 Y252	E47-R248 IonicContact OE1-CZ 2.85Å; E47-R248 IonicContact OE1-NH2 3.05Å; E47-R248 PolarHBondContact OE1-NH2 3.09Å; E47-R248 IonicContact OE2-NH2 3.27Å; E47-R248 PolarHBondContact OE2-NH2 3.47Å; N244-R248 WeakPolarHBondContact O-CB 3.22Å; N244-R248 PolarHBondContact O-N 3.06Å; S245-R248 PolarHBondContact O-N 3.39Å; K246-R248 VanDerWaalsContact C-N 3.32Å; R248-S251 PolarHBondContact O-OG 3.21Å; R248-Y252 HydrophobicContact CG-CE2 4.38Å; R248-Y252 WeakPolarHBondContact O-CD2 3.38Å; R248-Y252 VanDerWaalsContact O-CE2 3.23Å; R248-Y252 WeakPolarHBondContact O-CE2 3.44Å
249	L	84.1	Confident	84.9	Confident	48 Å²	48	78.2 Å²	78.2	25%	0.251	41%	0.405	S	S	.	.	H	α-helix	trans	-73	-32.2	179.7	-71.1	167	0	0	0	113	L55 I59 S245 K246 I247 S251 Y252	L55-L249 HydrophobicContact CD2-CD2 4.26Å; I59-L249 HydrophobicContact CD1-CD1 3.47Å; I59-L249 VanDerWaalsContact CD1-CD1 3.47Å; I59-L249 HydrophobicContact CD1-CD2 3.6Å; I59-L249 HydrophobicContact CD1-CG 4.18Å; S245-L249 WeakPolarHBondContact O-CB 3.36Å; S245-L249 VanDerWaalsContact O-CG 3.22Å; S245-L249 WeakPolarHBondContact O-CG 3.3Å; S245-L249 PolarHBondContact O-N 3.19Å; K246-L249 PolarHBondContact O-N 3.27Å; I247-L249 VanDerWaalsContact C-N 3.33Å; I247-L249 PolarHBondContact O-N 3.01Å; L249-S251 PolarHBondContact O-N 2.91Å; L249-Y252 PolarHBondContact O-N 3.06Å
250	M	81.6	Confident	84.5	Confident	107 Å²	107	83.1 Å²	83.1	53%	0.527	43%	0.43	S	S	.	.	H	α-helix	trans	-58.2	-28.9	177.8	-84.4	-78.5	179.7	0	0	112.7	K246 I247 Y252 V253 F255	K246-M250 WeakPolarHBondContact O-CB 3.46Å; K246-M250 VanDerWaalsContact O-CG 3.3Å; K246-M250 WeakPolarHBondContact O-CG 3.23Å; K246-M250 PolarHBondContact O-N 3.24Å; I247-M250 PolarHBondContact O-N 3.17Å; M250-Y252 PolarHBondContact O-N 3.36Å; M250-V253 PolarHBondContact O-N 3.02Å; M250-F255 HydrophobicContact SD-CE2 4.1Å; M250-F255 HydrophobicContact SD-CZ 4.45Å
251	S	80.2	Confident	84	Confident	94 Å²	94	85.5 Å²	85.5	66%	0.657	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-15.1	175.7	61.6	0	0	0	0	114.1	R248 L249	R248-S251 PolarHBondContact O-OG 3.21Å; L249-S251 PolarHBondContact O-N 2.91Å
252	Y	84.8	Confident	83.6	Confident	99 Å²	99	87.2 Å²	87.2	39%	0.388	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.5	-3.7	178.4	-58	-84.4	0	0	0	113.2	I52 R248 L249 M250	I52-Y252 HydrophobicContact CD1-CE1 3.92Å; I52-Y252 HydrophobicContact CG2-CE1 4.39Å; R248-Y252 HydrophobicContact CG-CE2 4.38Å; R248-Y252 WeakPolarHBondContact O-CD2 3.38Å; R248-Y252 VanDerWaalsContact O-CE2 3.23Å; R248-Y252 WeakPolarHBondContact O-CE2 3.44Å; L249-Y252 PolarHBondContact O-N 3.06Å; M250-Y252 PolarHBondContact O-N 3.36Å
253	V	78.7	Confident	83.1	Confident	77 Å²	77	93.8 Å²	93.8	47%	0.467	48%	0.481	S	S	.	.			trans	-108.3	113.4	-179.6	-178.5	0	0	0	0	108.9	M250 F255	M250-V253 PolarHBondContact O-N 3.02Å; V253-F255 HydrophobicContact CG1-CE1 4.46Å; V253-F255 HydrophobicContact CG1-CE2 4.14Å; V253-F255 HydrophobicContact CG1-CZ 4.1Å
254	T	75.5	Confident	82.6	Confident	135 Å²	135	100.1 Å²	100.1	83%	0.828	51%	0.513	S	S	*	.			trans	-91.7	130.1	169.3	-15.7	0	0	0	0	108.6
255	F	71.1	Confident	82.1	Confident	236 Å²	236	100.9 Å²	100.9	100%	1.035	52%	0.516	S	S	*	.			trans	-94.6	0	173	-68.5	-83.2	0	0	0	110.9	M250 V253	M250-F255 HydrophobicContact SD-CE2 4.1Å; M250-F255 HydrophobicContact SD-CZ 4.45Å; V253-F255 HydrophobicContact CG1-CE1 4.46Å; V253-F255 HydrophobicContact CG1-CE2 4.14Å; V253-F255 HydrophobicContact CG1-CZ 4.1Å

Retrieved 255 of 255 residues in 255.6 ms (Link to these results)

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