X6RK00_HUMAN Loading...

L-fucose mutarotase

AlphaFold DB , UniProt , Accession X6RK00, Species HUMAN (Homo sapiens, Human), Gene FUOM, Length 127 aa.

						>X6RK00_HUMAN|X6RK00|FUOM
KGVPALLSPELLYALARMGHGDEIGLGIPQLLEAVLKLLPLDTYVESPAAVMELVPSDKERGLQTPVWTEYESILRRAGCVRALAKIERFEFYERAKKAFAVVATGETALYGNLILRKGVLALNPLL
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	K	57.8	Low	73	Confident	268 Å²	268	82.5 Å²	82.5	100%	1.165	49%	0.486	S	S	*	.				0	126.7	0	-71.6	180	176.5	178.9	0	107.2
2	G	71.6	Confident	73	Confident	69 Å²	69	83.8 Å²	83.8	71%	0.711	49%	0.488	S	S	*	.			trans	116.6	-11.6	178.1	0	0	0	0	0	116.7
3	V	71.3	Confident	73	Confident	96 Å²	96	88.5 Å²	88.5	58%	0.582	49%	0.494	S	S	*	.	S	Bend	trans	-81	131	169.2	-178.1	0	0	0	0	108.2	A5 L7 L38	V3-A5 PolarHBondContact O-N 2.88Å; V3-L7 HydrophobicContact CG1-CB 4.22Å; V3-L38 HydrophobicContact CG1-CD1 4.14Å
4	P	77.3	Confident	72.8	Confident	15 Å²	15	85.3 Å²	85.3	10%	0.097	48%	0.484	C	S	.	.			trans	-55.1	134.5	174.8	-25.1	35.2	0	0	0	110.7	L6 L7 A34 K37	P4-L6 PolarHBondContact O-N 3.36Å; P4-L7 HydrophobicContact CG-CD1 4.48Å; P4-L7 PolarHBondContact O-N 3.46Å; P4-A34 HydrophobicContact CB-CB 3.74Å; P4-A34 HydrophobicContact CG-CB 4.01Å; P4-A34 WeakPolarHBondContact CG-O 3.01Å; P4-K37 HydrophobicContact CG-CB 4.06Å; P4-K37 HydrophobicContact CG-CD 3.82Å
5	A	76.3	Confident	72.4	Confident	94 Å²	94	83.6 Å²	83.6	78%	0.777	47%	0.473	S	S	*	.	G	3₁₀ helix	trans	-58.6	-23.5	179.1	0	0	0	0	0	112.8	V3 L7 S8	V3-A5 PolarHBondContact O-N 2.88Å; A5-L7 VanDerWaalsContact C-N 3.33Å; A5-S8 WeakPolarHBondContact O-CB 3.31Å; A5-S8 PolarHBondContact O-N 2.95Å
6	L	77.9	Confident	72.3	Confident	58 Å²	58	83.7 Å²	83.7	30%	0.304	49%	0.487	S	S	.	.	G	3₁₀ helix	trans	-63.6	-38.6	172.6	-174.5	62	0	0	0	111.8	P4 S8 L11 L26 Q30 A34	P4-L6 PolarHBondContact O-N 3.36Å; L6-S8 PolarHBondContact O-N 3Å; L6-S8 VanDerWaalsContact O-N 3.13Å; L6-L11 HydrophobicContact CD1-CD2 4.49Å; L6-L11 WeakPolarHBondContact O-CB 3.44Å; L6-L11 WeakPolarHBondContact O-CD2 3.33Å; L6-L26 HydrophobicContact CD1-CD1 3.62Å; L6-L26 HydrophobicContact CD1-CD2 3.95Å; L6-L26 HydrophobicContact CD1-CG 4.46Å; L6-L26 HydrophobicContact CD2-CD1 3.99Å; L6-L26 HydrophobicContact CD2-CD2 4.16Å; L6-L26 HydrophobicContact CG-CD1 4.36Å; L6-L26 HydrophobicContact CG-CD2 4.2Å; L6-Q30 HydrophobicContact CD2-CB 4.1Å; L6-Q30 WeakPolarHBondContact CD2-O 3.4Å; L6-A34 HydrophobicContact CB-CB 4.17Å; L6-A34 HydrophobicContact CD2-CB 3.94Å
7	L	75.9	Confident	72.3	Confident	30 Å²	30	88.9 Å²	88.9	16%	0.157	50%	0.497	C	S	.	.	G	3₁₀ helix	trans	-89.2	44.8	178.1	-61.3	174.9	0	0	0	111.2	V3 P4 A5 L31 A34 L38	V3-L7 HydrophobicContact CG1-CB 4.22Å; P4-L7 HydrophobicContact CG-CD1 4.48Å; P4-L7 PolarHBondContact O-N 3.46Å; A5-L7 VanDerWaalsContact C-N 3.33Å; L7-L31 HydrophobicContact CD2-CD1 3.85Å; L7-A34 HydrophobicContact CD1-CB 4.13Å; L7-A34 HydrophobicContact CG-CB 4.04Å; L7-L38 HydrophobicContact CD1-CD1 3.96Å
8	S	75.1	Confident	72.2	Confident	28 Å²	28	87.4 Å²	87.4	20%	0.196	49%	0.486	C	S	.	.			trans	-69.7	156.8	-177.9	87	0	0	0	0	111.5	A5 L6 E10 L11 L12	A5-S8 WeakPolarHBondContact O-CB 3.31Å; A5-S8 PolarHBondContact O-N 2.95Å; L6-S8 PolarHBondContact O-N 3Å; L6-S8 VanDerWaalsContact O-N 3.13Å; S8-E10 WeakPolarHBondContact CB-OE2 3.18Å; S8-E10 PolarHBondContact O-N 3.35Å; S8-E10 PolarHBondContact OG-N 3.38Å; S8-E10 PolarHBondContact OG-OE2 3.16Å; S8-L11 PolarHBondContact O-N 2.91Å; S8-L11 VanDerWaalsContact O-N 3.09Å; S8-L11 PolarHBondContact OG-N 2.72Å; S8-L11 VanDerWaalsContact OG-N 3.11Å; S8-L12 WeakPolarHBondContact O-CG 3.47Å; S8-L12 PolarHBondContact O-N 3.47Å
9	P	77	Confident	71.2	Confident	94 Å²	94	85.3 Å²	85.3	61%	0.61	49%	0.486	S	S	*	.	H	α-helix	trans	-52	-34.8	170.5	-26.2	35.6	0	0	0	112.5	L12 Y13	P9-L12 PolarHBondContact O-N 2.96Å; P9-Y13 WeakPolarHBondContact O-CB 3.46Å; P9-Y13 PolarHBondContact O-N 3.3Å
10	E	71.3	Confident	69.7	Low	130 Å²	130	91.5 Å²	91.5	61%	0.607	51%	0.51	S	S	*	.	H	α-helix	trans	-69.3	-39.8	178.2	-56.1	72	-154.7	0	0	112	S8 Y13 A14	S8-E10 WeakPolarHBondContact CB-OE2 3.18Å; S8-E10 PolarHBondContact O-N 3.35Å; S8-E10 PolarHBondContact OG-N 3.38Å; S8-E10 PolarHBondContact OG-OE2 3.16Å; E10-Y13 PolarHBondContact O-N 3.2Å; E10-A14 VanDerWaalsContact O-CB 3.26Å; E10-A14 WeakPolarHBondContact O-CB 3.44Å; E10-A14 PolarHBondContact O-N 3.29Å
11	L	71.6	Confident	68.5	Low	26 Å²	26	90.2 Å²	90.2	14%	0.136	52%	0.517	C	S	.	.	H	α-helix	trans	-64.2	-47	172.4	178.2	63.9	0	0	0	110.5	L6 S8 Y13 A14 L15 I24 L26	L6-L11 HydrophobicContact CD1-CD2 4.49Å; L6-L11 WeakPolarHBondContact O-CB 3.44Å; L6-L11 WeakPolarHBondContact O-CD2 3.33Å; S8-L11 PolarHBondContact O-N 2.91Å; S8-L11 VanDerWaalsContact O-N 3.09Å; S8-L11 PolarHBondContact OG-N 2.72Å; S8-L11 VanDerWaalsContact OG-N 3.11Å; L11-Y13 VanDerWaalsContact C-N 3.28Å; L11-Y13 PolarHBondContact O-N 3.41Å; L11-A14 PolarHBondContact O-N 3.45Å; L11-L15 HydrophobicContact CD1-CD1 4.37Å; L11-L15 HydrophobicContact CD1-CG 4.25Å; L11-L15 HydrophobicContact CG-CD1 4.04Å; L11-L15 HydrophobicContact CG-CG 4.38Å; L11-L15 WeakPolarHBondContact O-CB 3.47Å; L11-L15 VanDerWaalsContact O-CG 3.28Å; L11-L15 WeakPolarHBondContact O-CG 3.4Å; L11-L15 PolarHBondContact O-N 3.27Å; L11-I24 HydrophobicContact CD1-CD1 3.37Å; L11-L26 HydrophobicContact CD2-CD2 4.2Å
12	L	73.4	Confident	68.3	Low	98 Å²	98	82.1 Å²	82.1	51%	0.513	49%	0.487	S	S	.	.	H	α-helix	trans	-62.4	-38.5	179.3	-66.4	174.5	0	0	0	111.5	S8 P9 A16	S8-L12 WeakPolarHBondContact O-CG 3.47Å; S8-L12 PolarHBondContact O-N 3.47Å; P9-L12 PolarHBondContact O-N 2.96Å; L12-A16 WeakPolarHBondContact O-CB 3.19Å; L12-A16 PolarHBondContact O-N 3.08Å
13	Y	72.9	Confident	67.4	Low	145 Å²	145	87.9 Å²	87.9	57%	0.569	50%	0.496	S	S	*	.	H	α-helix	trans	-68.1	-41.9	174.5	179	-103.7	0	0	0	112.4	P9 E10 L11 A16 R17	P9-Y13 WeakPolarHBondContact O-CB 3.46Å; P9-Y13 PolarHBondContact O-N 3.3Å; E10-Y13 PolarHBondContact O-N 3.2Å; L11-Y13 VanDerWaalsContact C-N 3.28Å; L11-Y13 PolarHBondContact O-N 3.41Å; Y13-A16 PolarHBondContact O-N 3.14Å; Y13-R17 HydrophobicContact CE1-CG 4.36Å; Y13-R17 HydrophobicContact CE2-CG 4.32Å; Y13-R17 WeakPolarHBondContact O-CB 3.48Å; Y13-R17 PolarHBondContact O-N 3.5Å; Y13-R17 VanDerWaalsContact O-N 3.11Å; Y13-R17 VanDerWaalsContact OH-CD 3.25Å; Y13-R17 WeakPolarHBondContact OH-CD 3.41Å
14	A	70	Confident	67.2	Low	43 Å²	43	85.2 Å²	85.2	36%	0.355	48%	0.477	S	S	.	.	H	α-helix	trans	-60.1	-48.7	174.5	0	0	0	0	0	110.6	E10 L11 A16 R17 M18	E10-A14 VanDerWaalsContact O-CB 3.26Å; E10-A14 WeakPolarHBondContact O-CB 3.44Å; E10-A14 PolarHBondContact O-N 3.29Å; L11-A14 PolarHBondContact O-N 3.45Å; A14-A16 VanDerWaalsContact C-N 3.32Å; A14-A16 PolarHBondContact O-N 3.21Å; A14-R17 PolarHBondContact O-N 3.19Å; A14-M18 WeakPolarHBondContact O-CG 3.35Å; A14-M18 PolarHBondContact O-N 3.38Å
15	L	66.9	Low	66.6	Low	60 Å²	60	88.5 Å²	88.5	31%	0.314	51%	0.514	S	S	.	.	H	α-helix	trans	-57.1	-42.4	174.5	-70.3	170.4	0	0	0	112.2	L11 R17 M18 I24	L11-L15 HydrophobicContact CD1-CD1 4.37Å; L11-L15 HydrophobicContact CD1-CG 4.25Å; L11-L15 HydrophobicContact CG-CD1 4.04Å; L11-L15 HydrophobicContact CG-CG 4.38Å; L11-L15 WeakPolarHBondContact O-CB 3.47Å; L11-L15 VanDerWaalsContact O-CG 3.28Å; L11-L15 WeakPolarHBondContact O-CG 3.4Å; L11-L15 PolarHBondContact O-N 3.27Å; L15-R17 PolarHBondContact O-N 2.98Å; L15-M18 HydrophobicContact CD2-SD 3.97Å; L15-M18 PolarHBondContact O-N 3.09Å; L15-I24 HydrophobicContact CD2-CD1 4.08Å; L15-I24 HydrophobicContact CD2-CG2 4.45Å
16	A	70.4	Confident	66.6	Low	85 Å²	85	85.4 Å²	85.4	70%	0.702	48%	0.484	S	S	*	.	H	α-helix	trans	-66.7	-19.5	177.4	0	0	0	0	0	113.8	L12 Y13 A14	L12-A16 WeakPolarHBondContact O-CB 3.19Å; L12-A16 PolarHBondContact O-N 3.08Å; Y13-A16 PolarHBondContact O-N 3.14Å; A14-A16 VanDerWaalsContact C-N 3.32Å; A14-A16 PolarHBondContact O-N 3.21Å
17	R	72.7	Confident	67	Low	173 Å²	173	83.3 Å²	83.3	65%	0.653	48%	0.477	S	S	*	.	H	α-helix	trans	-102.2	-10.9	-178.2	-86.2	-161.6	52.4	-170.3	-13.1	114.9	Y13 A14 L15 G19	Y13-R17 HydrophobicContact CE1-CG 4.36Å; Y13-R17 HydrophobicContact CE2-CG 4.32Å; Y13-R17 WeakPolarHBondContact O-CB 3.48Å; Y13-R17 PolarHBondContact O-N 3.5Å; Y13-R17 VanDerWaalsContact O-N 3.11Å; Y13-R17 VanDerWaalsContact OH-CD 3.25Å; Y13-R17 WeakPolarHBondContact OH-CD 3.41Å; A14-R17 PolarHBondContact O-N 3.19Å; L15-R17 PolarHBondContact O-N 2.98Å; R17-G19 PolarHBondContact O-N 3.17Å
18	M	70	Confident	67.9	Low	62 Å²	62	82.9 Å²	82.9	31%	0.305	48%	0.475	S	S	.	.			trans	-63.2	131.9	177.7	-75.9	171.6	74.9	0	0	110.3	A14 L15 D22 I24	A14-M18 WeakPolarHBondContact O-CG 3.35Å; A14-M18 PolarHBondContact O-N 3.38Å; L15-M18 HydrophobicContact CD2-SD 3.97Å; L15-M18 PolarHBondContact O-N 3.09Å; M18-D22 WeakPolarHBondContact CA-OD2 3.48Å; M18-D22 HydrophobicContact CB-CB 4.04Å; M18-D22 HydrophobicContact CE-CB 3.8Å; M18-D22 WeakPolarHBondContact CE-O 3.39Å; M18-D22 HydrophobicContact CG-CB 3.99Å; M18-I24 HydrophobicContact CE-CB 3.96Å; M18-I24 HydrophobicContact CE-CG2 4.01Å; M18-I24 HydrophobicContact SD-CB 4.18Å; M18-I24 HydrophobicContact SD-CG2 4.32Å
19	G	52.8	Low	68.9	Low	46 Å²	46	82 Å²	82	47%	0.474	47%	0.468	S	S	.	.			trans	-93.9	-179.9	173.4	0	0	0	0	0	112.5	R17 G21 D22	R17-G19 PolarHBondContact O-N 3.17Å; G19-G21 PolarHBondContact O-N 2.92Å; G19-G21 VanDerWaalsContact O-N 3.14Å; G19-D22 PolarHBondContact N-OD2 2.91Å; G19-D22 PolarHBondContact O-N 3.09Å
20	H	42.1	Very low	69.5	Low	209 Å²	209	82.2 Å²	82.2	97%	0.968	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	114.1	173.2	-177.7	73.2	0	0	0	110.2
21	G	44.9	Very low	70.5	Confident	65 Å²	65	77.1 Å²	77.1	67%	0.67	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	109.7	-5.6	179.1	0	0	0	0	0	115.5	G19	G19-G21 PolarHBondContact O-N 2.92Å; G19-G21 VanDerWaalsContact O-N 3.14Å
22	D	53.7	Low	71.6	Confident	98 Å²	98	76.1 Å²	76.1	52%	0.524	43%	0.433	S	S	.	.			trans	-77.8	139.1	175.3	-69.9	-27.7	0	0	0	111.4	M18 G19	M18-D22 WeakPolarHBondContact CA-OD2 3.48Å; M18-D22 HydrophobicContact CB-CB 4.04Å; M18-D22 HydrophobicContact CE-CB 3.8Å; M18-D22 WeakPolarHBondContact CE-O 3.39Å; M18-D22 HydrophobicContact CG-CB 3.99Å; G19-D22 PolarHBondContact N-OD2 2.91Å; G19-D22 PolarHBondContact O-N 3.09Å
23	E	52.6	Low	72.6	Confident	191 Å²	191	75.2 Å²	75.2	89%	0.893	43%	0.426	S	S	*	.			trans	-112.3	141.4	179.8	-64.7	-177.7	175.1	0	0	111.2
24	I	66.1	Low	73.3	Confident	39 Å²	39	68.5 Å²	68.5	20%	0.2	40%	0.4	C	S	.	.			trans	-123.6	116.7	173.6	-171.9	167.7	0	0	0	109.7	L11 L15 M18 L26 G106	L11-I24 HydrophobicContact CD1-CD1 3.37Å; L15-I24 HydrophobicContact CD2-CD1 4.08Å; L15-I24 HydrophobicContact CD2-CG2 4.45Å; M18-I24 HydrophobicContact CE-CB 3.96Å; M18-I24 HydrophobicContact CE-CG2 4.01Å; M18-I24 HydrophobicContact SD-CB 4.18Å; M18-I24 HydrophobicContact SD-CG2 4.32Å; I24-L26 HydrophobicContact CG1-CB 4.43Å; I24-L26 PolarHBondContact O-N 3.04Å; I24-G106 WeakPolarHBondContact O-CA 3.43Å; I24-G106 PolarHBondContact O-N 2.91Å
25	G	65.6	Low	74.3	Confident	85 Å²	85	68.1 Å²	68.1	88%	0.876	39%	0.394	S	S	*	.			trans	-75.2	47.2	-176.8	0	0	0	0	0	114.7
26	L	75.1	Confident	75.5	Confident	28 Å²	28	66.5 Å²	66.5	15%	0.147	39%	0.385	C	S	.	.			trans	-103.4	120.5	175.5	-173.4	59.9	0	0	0	110.1	L6 L11 I24 Q30 L31 T105 G106	L6-L26 HydrophobicContact CD1-CD1 3.62Å; L6-L26 HydrophobicContact CD1-CD2 3.95Å; L6-L26 HydrophobicContact CD1-CG 4.46Å; L6-L26 HydrophobicContact CD2-CD1 3.99Å; L6-L26 HydrophobicContact CD2-CD2 4.16Å; L6-L26 HydrophobicContact CG-CD1 4.36Å; L6-L26 HydrophobicContact CG-CD2 4.2Å; L11-L26 HydrophobicContact CD2-CD2 4.2Å; I24-L26 HydrophobicContact CG1-CB 4.43Å; I24-L26 PolarHBondContact O-N 3.04Å; L26-Q30 HydrophobicContact CD1-CB 4.17Å; L26-L31 HydrophobicContact CD2-CB 4.16Å; L26-L31 HydrophobicContact CD2-CD1 4.11Å; L26-L31 HydrophobicContact CG-CB 4.44Å; L26-T105 WeakPolarHBondContact O-CB 3.38Å; L26-G106 PolarHBondContact O-N 3.16Å; L26-G106 VanDerWaalsContact O-N 3.09Å
27	G	88	Confident	76.4	Confident	15 Å²	15	69.7 Å²	69.7	16%	0.155	38%	0.383	C	S	.	.			trans	-73.4	154.1	173.4	0	0	0	0	0	112.2	Q30 L31 E107	G27-Q30 VanDerWaalsContact C-OE1 3.32Å; G27-Q30 VanDerWaalsContact CA-OE1 3.28Å; G27-Q30 PolarHBondContact O-OE1 3.4Å; G27-L31 PolarHBondContact O-N 2.6Å; G27-E107 WeakPolarHBondContact CA-OE2 3.36Å
28	I	93.8	Very high	77.1	Confident	21 Å²	21	65.7 Å²	65.7	11%	0.108	37%	0.374	C	S	.	.	H	α-helix	trans	-67.3	-36.9	179.1	-69.7	169.9	0	0	0	111.9	Q30 L31 L32 Y71 T105 E107 G112 L114	I28-Q30 PolarHBondContact O-N 3.47Å; I28-L31 PolarHBondContact O-N 3.44Å; I28-L32 VanDerWaalsContact O-CB 3.23Å; I28-L32 WeakPolarHBondContact O-CB 3.41Å; I28-L32 PolarHBondContact O-N 3.3Å; I28-Y71 HydrophobicContact CB-CE1 4.12Å; I28-Y71 WeakPolarHBondContact CB-OH 3.49Å; I28-Y71 HydrophobicContact CG2-CE1 3.6Å; I28-Y71 HydrophobicContact CG2-CE2 4.39Å; I28-Y71 VanDerWaalsContact CG2-CZ 3.48Å; I28-Y71 WeakPolarHBondContact CG2-OH 3.35Å; I28-T105 HydrophobicContact CG1-CG2 4Å; I28-E107 HydrophobicContact CB-CB 4.4Å; I28-E107 HydrophobicContact CB-CG 4.27Å; I28-E107 HydrophobicContact CD1-CB 3.83Å; I28-E107 HydrophobicContact CD1-CG 3.89Å; I28-E107 HydrophobicContact CG1-CB 3.74Å; I28-E107 HydrophobicContact CG1-CG 4.02Å; I28-E107 PolarHBondContact N-OE2 3.27Å; I28-G112 WeakPolarHBondContact CD1-O 3.38Å; I28-L114 HydrophobicContact CG2-CB 4.35Å; I28-L114 HydrophobicContact CG2-CD2 4.34Å
29	P	95.5	Very high	77.9	Confident	8 Å²	8	65 Å²	65	5%	0.052	37%	0.371	C	S	.	.	H	α-helix	trans	-55.7	-46.8	177.8	-27.2	34.2	0	0	0	113.7	L32 E33 V67 E70 Y71 I74 E107	P29-L32 PolarHBondContact O-N 3.2Å; P29-E33 PolarHBondContact O-N 2.83Å; P29-V67 HydrophobicContact CG-CG2 4.29Å; P29-E70 HydrophobicContact CB-CG 4.18Å; P29-E70 WeakPolarHBondContact CB-OE1 3.38Å; P29-E70 HydrophobicContact CG-CG 4.33Å; P29-Y71 HydrophobicContact CG-CE1 3.88Å; P29-I74 HydrophobicContact CB-CD1 3.83Å; P29-E107 WeakPolarHBondContact CD-OE2 3.26Å
30	Q	91.3	Very high	79.8	Confident	100 Å²	100	64.3 Å²	64.3	47%	0.467	36%	0.359	S	S	.	.	H	α-helix	trans	-67	-41.2	-179.8	-59.7	82.1	4.5	0	0	111.2	L6 L26 G27 I28 A34	L6-Q30 HydrophobicContact CD2-CB 4.1Å; L6-Q30 WeakPolarHBondContact CD2-O 3.4Å; L26-Q30 HydrophobicContact CD1-CB 4.17Å; G27-Q30 VanDerWaalsContact C-OE1 3.32Å; G27-Q30 VanDerWaalsContact CA-OE1 3.28Å; G27-Q30 PolarHBondContact O-OE1 3.4Å; I28-Q30 PolarHBondContact O-N 3.47Å; Q30-A34 PolarHBondContact O-N 3.39Å
31	L	91.4	Very high	82.3	Confident	22 Å²	22	55.7 Å²	55.7	12%	0.115	32%	0.32	C	S	.	.	H	α-helix	trans	-64.7	-42.3	176.6	-176.8	60	0	0	0	111.4	L7 L26 G27 I28 E33 A34 V35 V103 T105	L7-L31 HydrophobicContact CD2-CD1 3.85Å; L26-L31 HydrophobicContact CD2-CB 4.16Å; L26-L31 HydrophobicContact CD2-CD1 4.11Å; L26-L31 HydrophobicContact CG-CB 4.44Å; G27-L31 PolarHBondContact O-N 2.6Å; I28-L31 PolarHBondContact O-N 3.44Å; L31-E33 PolarHBondContact O-N 2.85Å; L31-A34 PolarHBondContact O-N 3.34Å; L31-V35 HydrophobicContact CD1-CG2 4.09Å; L31-V35 HydrophobicContact CG-CG2 4.19Å; L31-V35 WeakPolarHBondContact O-CB 3.47Å; L31-V35 VanDerWaalsContact O-CG2 3.27Å; L31-V35 WeakPolarHBondContact O-CG2 3.45Å; L31-V35 PolarHBondContact O-N 3.03Å; L31-V103 HydrophobicContact CD2-CG1 3.99Å; L31-T105 HydrophobicContact CD2-CG2 3.91Å
32	L	94.6	Very high	84.6	Confident	5 Å²	5	53.4 Å²	53.4	3%	0.026	29%	0.292	C	S	.	.	H	α-helix	trans	-59.2	-47.9	177.8	179	61.8	0	0	0	111.2	I28 P29 A34 V35 L36 Y71 I74 L114 L116	I28-L32 VanDerWaalsContact O-CB 3.23Å; I28-L32 WeakPolarHBondContact O-CB 3.41Å; I28-L32 PolarHBondContact O-N 3.3Å; P29-L32 PolarHBondContact O-N 3.2Å; L32-A34 VanDerWaalsContact C-N 3.27Å; L32-A34 PolarHBondContact O-N 3.04Å; L32-V35 PolarHBondContact O-N 2.96Å; L32-L36 HydrophobicContact CD1-CD1 3.77Å; L32-L36 HydrophobicContact CD1-CD2 4.28Å; L32-L36 HydrophobicContact CD1-CG 3.84Å; L32-L36 HydrophobicContact CG-CD1 3.9Å; L32-L36 HydrophobicContact CG-CG 4.33Å; L32-L36 WeakPolarHBondContact O-CB 3.41Å; L32-L36 VanDerWaalsContact O-CG 3.29Å; L32-L36 WeakPolarHBondContact O-CG 3.4Å; L32-L36 PolarHBondContact O-N 2.9Å; L32-Y71 HydrophobicContact CD2-CD1 3.89Å; L32-Y71 HydrophobicContact CD2-CG 4.22Å; L32-I74 HydrophobicContact CB-CG2 4.42Å; L32-I74 HydrophobicContact CD2-CB 4Å; L32-I74 HydrophobicContact CD2-CD1 4.24Å; L32-I74 HydrophobicContact CD2-CG2 3.71Å; L32-I74 HydrophobicContact CG-CG2 3.69Å; L32-L114 HydrophobicContact CD1-CD2 3.66Å; L32-L114 HydrophobicContact CD2-CD2 3.71Å; L32-L114 HydrophobicContact CG-CD2 4.19Å; L32-L116 HydrophobicContact CD1-CD1 3.7Å; L32-L116 HydrophobicContact CD1-CD2 4.01Å; L32-L116 HydrophobicContact CD1-CG 4.38Å
33	E	93.6	Very high	86.5	Confident	79 Å²	79	53.3 Å²	53.3	37%	0.369	30%	0.295	S	S	.	.	H	α-helix	trans	-58.6	-39.1	176.7	-73.8	-166.2	165.5	0	0	112.8	P29 L31 K37 I74 R77	P29-E33 PolarHBondContact O-N 2.83Å; L31-E33 PolarHBondContact O-N 2.85Å; E33-K37 WeakPolarHBondContact O-CG 3.26Å; E33-I74 HydrophobicContact CG-CB 4.42Å; E33-I74 HydrophobicContact CG-CD1 3.98Å; E33-I74 HydrophobicContact CG-CG1 3.87Å; E33-I74 HydrophobicContact CG-CG2 3.68Å; E33-R77 IonicContact OE1-CZ 3.77Å; E33-R77 IonicContact OE1-NH2 2.72Å; E33-R77 PolarHBondContact OE1-NH2 3.5Å
34	A	89.3	Confident	88.4	Confident	4 Å²	4	53.4 Å²	53.4	3%	0.033	29%	0.289	C	S	.	.	H	α-helix	trans	-70.6	-45.1	176.9	0	0	0	0	0	111.8	P4 L6 L7 Q30 L31 L32 L36 K37	P4-A34 HydrophobicContact CB-CB 3.74Å; P4-A34 HydrophobicContact CG-CB 4.01Å; P4-A34 WeakPolarHBondContact CG-O 3.01Å; L6-A34 HydrophobicContact CB-CB 4.17Å; L6-A34 HydrophobicContact CD2-CB 3.94Å; L7-A34 HydrophobicContact CD1-CB 4.13Å; L7-A34 HydrophobicContact CG-CB 4.04Å; Q30-A34 PolarHBondContact O-N 3.39Å; L31-A34 PolarHBondContact O-N 3.34Å; L32-A34 VanDerWaalsContact C-N 3.27Å; L32-A34 PolarHBondContact O-N 3.04Å; A34-L36 PolarHBondContact O-N 3.22Å; A34-K37 PolarHBondContact O-N 3.18Å
35	V	89.2	Confident	89.7	Confident	36 Å²	36	53 Å²	53	22%	0.218	29%	0.288	C	S	.	.	H	α-helix	trans	-60.9	-45.6	179.8	167.9	0	0	0	0	110.9	L31 L32 K37 L38 L39 L116	L31-V35 HydrophobicContact CD1-CG2 4.09Å; L31-V35 HydrophobicContact CG-CG2 4.19Å; L31-V35 WeakPolarHBondContact O-CB 3.47Å; L31-V35 VanDerWaalsContact O-CG2 3.27Å; L31-V35 WeakPolarHBondContact O-CG2 3.45Å; L31-V35 PolarHBondContact O-N 3.03Å; L32-V35 PolarHBondContact O-N 2.96Å; V35-K37 PolarHBondContact O-N 3.48Å; V35-K37 VanDerWaalsContact O-N 3.17Å; V35-L38 PolarHBondContact O-N 2.83Å; V35-L39 HydrophobicContact CG1-CB 3.79Å; V35-L39 HydrophobicContact CG1-CD2 4.07Å; V35-L39 HydrophobicContact CG1-CG 4.39Å; V35-L39 VanDerWaalsContact O-CB 3.27Å; V35-L39 WeakPolarHBondContact O-CB 3.22Å; V35-L39 PolarHBondContact O-N 3.19Å; V35-L116 HydrophobicContact CG1-CD1 3.91Å
36	L	92.5	Very high	91.1	Very high	25 Å²	25	57.6 Å²	57.6	13%	0.131	29%	0.287	C	S	.	.	H	α-helix	trans	-66.6	-17.4	-177.3	-67.2	177.4	0	0	0	114.2	L32 A34 L38 L41 I74 L75 A78 L116	L32-L36 HydrophobicContact CD1-CD1 3.77Å; L32-L36 HydrophobicContact CD1-CD2 4.28Å; L32-L36 HydrophobicContact CD1-CG 3.84Å; L32-L36 HydrophobicContact CG-CD1 3.9Å; L32-L36 HydrophobicContact CG-CG 4.33Å; L32-L36 WeakPolarHBondContact O-CB 3.41Å; L32-L36 VanDerWaalsContact O-CG 3.29Å; L32-L36 WeakPolarHBondContact O-CG 3.4Å; L32-L36 PolarHBondContact O-N 2.9Å; A34-L36 PolarHBondContact O-N 3.22Å; L36-L38 PolarHBondContact O-N 3.39Å; L36-L41 HydrophobicContact CD2-CD1 3.73Å; L36-L41 HydrophobicContact CD2-CD2 3.78Å; L36-L41 HydrophobicContact CD2-CG 3.77Å; L36-I74 HydrophobicContact CD1-CG2 3.81Å; L36-L75 HydrophobicContact CD1-CD2 3.99Å; L36-L75 HydrophobicContact CD2-CD2 4.43Å; L36-A78 HydrophobicContact CB-CB 3.93Å; L36-A78 HydrophobicContact CD1-CB 3.66Å; L36-A78 HydrophobicContact CG-CB 4.33Å; L36-L116 HydrophobicContact CD2-CD1 4.49Å
37	K	89.8	Confident	92.2	Very high	153 Å²	153	57 Å²	57	67%	0.665	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-22	171.6	-72.1	169.7	-179.9	172.8	0	112.9	P4 E33 A34 V35	P4-K37 HydrophobicContact CG-CB 4.06Å; P4-K37 HydrophobicContact CG-CD 3.82Å; E33-K37 WeakPolarHBondContact O-CG 3.26Å; A34-K37 PolarHBondContact O-N 3.18Å; V35-K37 PolarHBondContact O-N 3.48Å; V35-K37 VanDerWaalsContact O-N 3.17Å
38	L	87.9	Confident	92.6	Very high	89 Å²	89	56.5 Å²	56.5	47%	0.466	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.8	-22.9	-174.7	-59.2	-179.5	0	0	0	113.2	V3 L7 V35 L36 P40	V3-L38 HydrophobicContact CG1-CD1 4.14Å; L7-L38 HydrophobicContact CD1-CD1 3.96Å; V35-L38 PolarHBondContact O-N 2.83Å; L36-L38 PolarHBondContact O-N 3.39Å; L38-P40 WeakPolarHBondContact O-CD 3.34Å
39	L	87.4	Confident	92.8	Very high	46 Å²	46	55.5 Å²	55.5	24%	0.241	27%	0.274	C	S	.	.			trans	-107.8	102.6	-174.6	-169.5	109.1	0	0	0	110.1	V35 L41 L116 K118	V35-L39 HydrophobicContact CG1-CB 3.79Å; V35-L39 HydrophobicContact CG1-CD2 4.07Å; V35-L39 HydrophobicContact CG1-CG 4.39Å; V35-L39 VanDerWaalsContact O-CB 3.27Å; V35-L39 WeakPolarHBondContact O-CB 3.22Å; V35-L39 PolarHBondContact O-N 3.19Å; L39-L41 HydrophobicContact CD2-CD2 4.15Å; L39-L116 HydrophobicContact CD2-CB 4.3Å; L39-L116 HydrophobicContact CD2-CD1 4.34Å; L39-K118 HydrophobicContact CD1-CB 4.1Å; L39-K118 HydrophobicContact CD1-CD 4.06Å; L39-K118 HydrophobicContact CD1-CG 4.02Å; L39-K118 HydrophobicContact CD2-CB 4.45Å; L39-K118 HydrophobicContact CG-CB 4.3Å; L39-K118 HydrophobicContact CG-CG 4.21Å
40	P	91.1	Very high	92.9	Very high	33 Å²	33	55.1 Å²	55.1	21%	0.214	27%	0.272	C	S	.	.			trans	-63.7	141.9	170.5	30.4	-37.1	0	0	0	109.6	L38 K118 G119 L121	L38-P40 WeakPolarHBondContact O-CD 3.34Å; P40-K118 WeakPolarHBondContact O-CA 3.22Å; P40-G119 PolarHBondContact O-N 2.91Å; P40-L121 HydrophobicContact CB-CD2 4.14Å; P40-L121 HydrophobicContact CG-CD2 3.65Å; P40-L121 HydrophobicContact CG-CG 3.98Å
41	L	94.3	Very high	93.3	Very high	27 Å²	27	50.4 Å²	50.4	14%	0.141	25%	0.249	C	C	.	.	B	Isolated β-bridge	trans	-88.8	149	176.8	-65.9	179	0	0	0	111.3	L36 L39 T43 P48 L75 C80 L116	L36-L41 HydrophobicContact CD2-CD1 3.73Å; L36-L41 HydrophobicContact CD2-CD2 3.78Å; L36-L41 HydrophobicContact CD2-CG 3.77Å; L39-L41 HydrophobicContact CD2-CD2 4.15Å; L41-T43 PolarHBondContact O-N 3.4Å; L41-P48 HydrophobicContact CB-CB 3.9Å; L41-P48 HydrophobicContact CB-CG 3.95Å; L41-P48 HydrophobicContact CD1-CG 4.18Å; L41-P48 HydrophobicContact CD2-CB 4.46Å; L41-L75 HydrophobicContact CD1-CD2 3.67Å; L41-C80 HydrophobicContact CD1-CB 3.88Å; L41-L116 HydrophobicContact CD2-CB 4.33Å; L41-L116 HydrophobicContact CD2-CD2 4.23Å
42	D	94.9	Very high	93.6	Very high	18 Å²	18	50 Å²	50	10%	0.096	25%	0.247	C	C	.	.			trans	-70	115.7	-179.4	-169.7	-9.4	0	0	0	111.8	Y44 V45 P48 R117 G119	D42-Y44 WeakPolarHBondContact OD1-CB 3.34Å; D42-Y44 PolarHBondContact OD1-N 2.98Å; D42-V45 HydrophobicContact CB-CG2 4.07Å; D42-V45 WeakPolarHBondContact O-CG2 3.38Å; D42-P48 HydrophobicContact CB-CB 4.45Å; D42-P48 WeakPolarHBondContact O-CB 3.44Å; D42-R117 HydrophobicContact CB-CB 4.24Å; D42-R117 HydrophobicContact CB-CG 3.83Å; D42-R117 PolarHBondContact N-O 3.29Å; D42-R117 IonicContact OD2-CZ 3.56Å; D42-R117 IonicContact OD2-NE 2.79Å; D42-R117 PolarHBondContact OD2-NE 2.79Å; D42-R117 IonicContact OD2-NH2 3.61Å; D42-G119 VanDerWaalsContact CA-CA 3.42Å
43	T	93.5	Very high	93.8	Very high	96 Å²	96	52.7 Å²	52.7	59%	0.589	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-9	-179	55.3	0	0	0	0	113.6	L41 V45	L41-T43 PolarHBondContact O-N 3.4Å; T43-V45 VanDerWaalsContact C-N 3.34Å
44	Y	92.3	Very high	94	Very high	193 Å²	193	50 Å²	50	76%	0.757	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.9	0.8	-177.5	-65	-85.8	0	0	0	113.5	D42 V120	D42-Y44 WeakPolarHBondContact OD1-CB 3.34Å; D42-Y44 PolarHBondContact OD1-N 2.98Å; Y44-V120 HydrophobicContact CE2-CG2 4.27Å
45	V	93.8	Very high	94.4	Very high	30 Å²	30	51.1 Å²	51.1	18%	0.182	25%	0.254	C	S	.	.	S	Bend	trans	-110.9	160.2	176	-64.1	0	0	0	0	111.5	D42 T43 P48 R117	D42-V45 HydrophobicContact CB-CG2 4.07Å; D42-V45 WeakPolarHBondContact O-CG2 3.38Å; T43-V45 VanDerWaalsContact C-N 3.34Å; V45-P48 HydrophobicContact CG2-CB 4.17Å; V45-R117 VanDerWaalsContact CG1-CZ 3.47Å
46	E	94.8	Very high	94.9	Very high	181 Å²	181	53.7 Å²	53.7	85%	0.846	27%	0.272	S	S	*	.	S	Bend	trans	-59.2	-47	175.4	-175.3	-178.8	179.1	0	0	111.5	R82	E46-R82 WeakPolarHBondContact O-CD 3.35Å; E46-R82 WeakPolarHBondContact O-CG 3.32Å
47	S	96.6	Very high	95.1	Very high	17 Å²	17	55.6 Å²	55.6	12%	0.119	29%	0.287	C	S	.	.			trans	-141.2	124	172.7	-173.1	0	0	0	0	112.1	A49 A83 A85	S47-A49 VanDerWaalsContact C-N 3.28Å; S47-A49 PolarHBondContact OG-N 3.33Å; S47-A49 PolarHBondContact OG-O 3.22Å; S47-A83 WeakPolarHBondContact CB-O 3.34Å; S47-A83 PolarHBondContact OG-O 2.91Å; S47-A85 PolarHBondContact OG-N 2.85Å
48	P	97.1	Very high	95.5	Very high	3 Å²	3	49.5 Å²	49.5	2%	0.019	26%	0.261	C	S	.	.	S	Bend	trans	-82.3	-6.4	176.6	32.9	-34	0	0	0	113.1	L41 D42 V45 L116 R117	L41-P48 HydrophobicContact CB-CB 3.9Å; L41-P48 HydrophobicContact CB-CG 3.95Å; L41-P48 HydrophobicContact CD1-CG 4.18Å; L41-P48 HydrophobicContact CD2-CB 4.46Å; D42-P48 HydrophobicContact CB-CB 4.45Å; D42-P48 WeakPolarHBondContact O-CB 3.44Å; V45-P48 HydrophobicContact CG2-CB 4.17Å; P48-L116 CarbonylContact O-C 3.51Å; P48-L116 WeakPolarHBondContact O-CA 3.34Å; P48-R117 HydrophobicContact CB-CB 4.44Å; P48-R117 PolarHBondContact O-N 3.5Å
49	A	98.1	Very high	95.9	Very high	1 Å²	1	50 Å²	50	1%	0.008	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	132.7	-178.6	0	0	0	0	0	110	S47 L75 L84 A85 L114 I115 L116	S47-A49 VanDerWaalsContact C-N 3.28Å; S47-A49 PolarHBondContact OG-N 3.33Å; S47-A49 PolarHBondContact OG-O 3.22Å; A49-L75 HydrophobicContact CB-CD1 3.66Å; A49-L75 HydrophobicContact CB-CD2 3.98Å; A49-L84 HydrophobicContact CB-CD1 3.75Å; A49-A85 PolarHBondContact O-N 2.96Å; A49-L114 HydrophobicContact CB-CD1 4.36Å; A49-I115 CarbonylContact C-O 3.57Å; A49-I115 VanDerWaalsContact CA-O 3.3Å; A49-I115 WeakPolarHBondContact CA-O 3.44Å; A49-L116 HydrophobicContact CB-CD2 3.91Å
50	A	98.6	Very high	96.4	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	139	-178.9	0	0	0	0	0	112.4	A85 I87 L114 I115	A50-A85 CarbonylContact C-O 3.59Å; A50-A85 VanDerWaalsContact CA-O 3.32Å; A50-A85 WeakPolarHBondContact CA-O 3.49Å; A50-A85 HydrophobicContact CB-CB 3.97Å; A50-I87 HydrophobicContact CB-CD1 3.4Å; A50-I87 HydrophobicContact CB-CG1 3.98Å; A50-L114 WeakPolarHBondContact O-CA 3.27Å; A50-I115 PolarHBondContact N-O 3.24Å; A50-I115 PolarHBondContact O-N 3.5Å
51	V	98.6	Very high	96.7	Very high	0 Å²	0	63.3 Å²	63.3	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	162.5	168.6	-67.2	0	0	0	0	110.4	W68 Y71 L84 A85 K86 I87 N113 L114	V51-W68 HydrophobicContact CG2-CD2 3.96Å; V51-W68 HydrophobicContact CG2-CG 4.28Å; V51-W68 HydrophobicContact CG2-CZ2 4.04Å; V51-Y71 HydrophobicContact CG1-CD2 3.98Å; V51-Y71 HydrophobicContact CG1-CE2 4.2Å; V51-L84 HydrophobicContact CG1-CD1 4.16Å; V51-L84 HydrophobicContact CG1-CD2 3.77Å; V51-L84 HydrophobicContact CG1-CG 4.19Å; V51-L84 HydrophobicContact CG2-CD2 3.99Å; V51-L84 HydrophobicContact CG2-CG 4.12Å; V51-A85 WeakPolarHBondContact CG2-O 3.17Å; V51-A85 PolarHBondContact N-O 3.22Å; V51-K86 HydrophobicContact CG2-CG 4.11Å; V51-I87 PolarHBondContact O-N 3.07Å; V51-N113 WeakPolarHBondContact CA-O 3.33Å; V51-N113 WeakPolarHBondContact CG1-O 3.23Å; V51-L114 HydrophobicContact CG1-CD1 3.9Å
52	M	98.4	Very high	96.9	Very high	14 Å²	14	64 Å²	64	7%	0.069	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	130.1	172.2	-171.9	170.5	73.3	0	0	109.9	W68 I87 R89 F92 Y93 Y111	M52-W68 WeakPolarHBondContact O-CZ2 3.47Å; M52-I87 CarbonylContact C-O 3.54Å; M52-R89 HydrophobicContact CG-CB 4.27Å; M52-R89 HydrophobicContact SD-CB 4.08Å; M52-R89 HydrophobicContact SD-CG 3.76Å; M52-F92 HydrophobicContact CB-CB 4.3Å; M52-F92 HydrophobicContact CB-CD1 4.23Å; M52-F92 HydrophobicContact CB-CD2 3.87Å; M52-F92 HydrophobicContact CB-CE2 4.23Å; M52-F92 HydrophobicContact CB-CG 3.87Å; M52-F92 HydrophobicContact CG-CB 4.14Å; M52-F92 HydrophobicContact CG-CG 4.2Å; M52-F92 HydrophobicContact SD-CD1 4.48Å; M52-Y93 HydrophobicContact SD-CE1 4.21Å; M52-Y111 HydrophobicContact CB-CD1 4.37Å; M52-Y111 HydrophobicContact CE-CD1 3.53Å; M52-Y111 HydrophobicContact CE-CE1 3.59Å; M52-Y111 HydrophobicContact CE-CG 4.45Å; M52-Y111 HydrophobicContact CG-CD1 4.35Å
53	E	98.4	Very high	97	Very high	62 Å²	62	65.5 Å²	65.5	29%	0.29	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-70.3	148.8	176.4	-165.4	177.1	-159.3	0	0	111.3	V55 K59 K86 I87 Y111	E53-V55 PolarHBondContact O-N 2.78Å; E53-K59 WeakPolarHBondContact OE1-CE 3.15Å; E53-K59 IonicContact OE1-NZ 2.71Å; E53-K59 PolarHBondContact OE1-NZ 2.71Å; E53-K59 IonicContact OE2-NZ 3.46Å; E53-K59 PolarHBondContact OE2-NZ 3.46Å; E53-K86 HydrophobicContact CB-CB 4.15Å; E53-K86 HydrophobicContact CG-CB 4.19Å; E53-I87 WeakPolarHBondContact CB-O 3.21Å; E53-I87 PolarHBondContact N-O 3.35Å; E53-Y111 VanDerWaalsContact O-CE1 3.32Å; E53-Y111 WeakPolarHBondContact O-CE1 3.36Å
54	L	98	Very high	97.2	Very high	21 Å²	21	68 Å²	68	11%	0.11	34%	0.336	C	S	.	.	P	Polyproline II helix	trans	-57.6	135.7	170.4	-66.9	-179.9	0	0	0	110.9	D58 K59 L63 T65 W68 Y111	L54-D58 HydrophobicContact CD2-CB 4.26Å; L54-K59 HydrophobicContact CB-CD 4.38Å; L54-K59 HydrophobicContact CB-CG 3.54Å; L54-K59 HydrophobicContact CD1-CG 4.2Å; L54-K59 WeakPolarHBondContact O-CE 3.47Å; L54-L63 HydrophobicContact CD2-CD2 3.98Å; L54-T65 HydrophobicContact CD2-CG2 3.78Å; L54-T65 HydrophobicContact CG-CG2 4.38Å; L54-W68 HydrophobicContact CG-CH2 4.03Å; L54-Y111 HydrophobicContact CD2-CD1 4.04Å; L54-Y111 HydrophobicContact CD2-CD2 3.48Å; L54-Y111 VanDerWaalsContact CD2-CD2 3.48Å; L54-Y111 HydrophobicContact CD2-CE1 3.99Å; L54-Y111 HydrophobicContact CD2-CE2 3.43Å; L54-Y111 VanDerWaalsContact CD2-CE2 3.43Å; L54-Y111 HydrophobicContact CD2-CG 3.81Å
55	V	97.8	Very high	97.4	Very high	28 Å²	28	59.7 Å²	59.7	17%	0.17	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-68.5	157.7	169.2	-56.4	0	0	0	0	110.5	E53 S57 D58 K59 R89 Y111	E53-V55 PolarHBondContact O-N 2.78Å; V55-S57 VanDerWaalsContact C-N 3.31Å; V55-S57 WeakPolarHBondContact CG2-OG 3.27Å; V55-S57 PolarHBondContact O-N 2.84Å; V55-D58 HydrophobicContact CG2-CB 4.12Å; V55-D58 PolarHBondContact O-N 3.36Å; V55-K59 PolarHBondContact O-N 2.67Å; V55-K59 VanDerWaalsContact O-N 3.08Å; V55-R89 HydrophobicContact CG1-CB 4.47Å; V55-Y111 WeakPolarHBondContact CG2-OH 3.47Å; V55-Y111 PolarHBondContact N-OH 2.93Å
56	P	98	Very high	97.6	Very high	91 Å²	91	63 Å²	63	59%	0.591	33%	0.328	S	S	*	.	H	α-helix	trans	-51.5	-44.7	-175.9	-30	36.5	0	0	0	114.3	D58 K59 E60	P56-D58 VanDerWaalsContact C-N 3.3Å; P56-D58 PolarHBondContact O-N 3.26Å; P56-K59 WeakPolarHBondContact O-CB 3.48Å; P56-K59 PolarHBondContact O-N 2.87Å; P56-E60 WeakPolarHBondContact O-CG 3.44Å; P56-E60 PolarHBondContact O-N 3.46Å
57	S	97.8	Very high	97.7	Very high	64 Å²	64	54.8 Å²	54.8	45%	0.448	29%	0.29	S	S	.	.	H	α-helix	trans	-62.9	-33.3	-179.9	58.7	0	0	0	0	113.7	V55 R61	V55-S57 VanDerWaalsContact C-N 3.31Å; V55-S57 WeakPolarHBondContact CG2-OG 3.27Å; V55-S57 PolarHBondContact O-N 2.84Å; S57-R61 WeakPolarHBondContact O-CB 3.17Å; S57-R61 VanDerWaalsContact O-CD 3.31Å; S57-R61 WeakPolarHBondContact O-CD 3.05Å; S57-R61 WeakPolarHBondContact O-CG 3.39Å; S57-R61 PolarHBondContact O-N 3.13Å
58	D	97.9	Very high	97.7	Very high	25 Å²	25	55 Å²	55	13%	0.134	29%	0.288	C	S	.	.	H	α-helix	trans	-80.1	-30.6	177.8	-73.8	-23.8	0	0	0	111.6	L54 V55 P56 R61 G62 L63 Y111	L54-D58 HydrophobicContact CD2-CB 4.26Å; V55-D58 HydrophobicContact CG2-CB 4.12Å; V55-D58 PolarHBondContact O-N 3.36Å; P56-D58 VanDerWaalsContact C-N 3.3Å; P56-D58 PolarHBondContact O-N 3.26Å; D58-R61 IonicContact OD1-NH1 3.16Å; D58-R61 PolarHBondContact OD1-NH1 3.06Å; D58-R61 VanDerWaalsContact OD1-NH1 3.16Å; D58-G62 PolarHBondContact O-N 3.4Å; D58-L63 HydrophobicContact CB-CB 4.03Å; D58-L63 HydrophobicContact CB-CD2 3.87Å; D58-L63 WeakPolarHBondContact O-CB 2.86Å; D58-L63 PolarHBondContact O-N 2.75Å; D58-Y111 WeakPolarHBondContact OD2-CE2 3.43Å; D58-Y111 PolarHBondContact OD2-OH 3.19Å
59	K	97.4	Very high	97.8	Very high	100 Å²	100	59.4 Å²	59.4	44%	0.435	32%	0.315	S	S	.	.	H	α-helix	trans	-63.1	-48.1	169.4	-68.5	177.1	169.5	171.9	0	111	E53 L54 V55 P56 R61 G62	E53-K59 WeakPolarHBondContact OE1-CE 3.15Å; E53-K59 IonicContact OE1-NZ 2.71Å; E53-K59 PolarHBondContact OE1-NZ 2.71Å; E53-K59 IonicContact OE2-NZ 3.46Å; E53-K59 PolarHBondContact OE2-NZ 3.46Å; L54-K59 HydrophobicContact CB-CD 4.38Å; L54-K59 HydrophobicContact CB-CG 3.54Å; L54-K59 HydrophobicContact CD1-CG 4.2Å; L54-K59 WeakPolarHBondContact O-CE 3.47Å; V55-K59 PolarHBondContact O-N 2.67Å; V55-K59 VanDerWaalsContact O-N 3.08Å; P56-K59 WeakPolarHBondContact O-CB 3.48Å; P56-K59 PolarHBondContact O-N 2.87Å; K59-R61 VanDerWaalsContact C-N 3.29Å; K59-R61 PolarHBondContact O-N 2.87Å; K59-G62 PolarHBondContact O-N 3.4Å
60	E	97.9	Very high	97.8	Very high	166 Å²	166	63.8 Å²	63.8	78%	0.776	34%	0.336	S	S	*	.	H	α-helix	trans	-61.3	-36.9	179.3	-74.1	169.6	-167.3	0	0	112.5	P56 G62	P56-E60 WeakPolarHBondContact O-CG 3.44Å; P56-E60 PolarHBondContact O-N 3.46Å; E60-G62 PolarHBondContact O-N 3.49Å
61	R	97	Very high	97.8	Very high	193 Å²	193	63.8 Å²	63.8	73%	0.728	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-3.4	175.7	-69.2	168.7	63.7	-147.7	2.8	113.7	S57 D58 K59 L63	S57-R61 WeakPolarHBondContact O-CB 3.17Å; S57-R61 VanDerWaalsContact O-CD 3.31Å; S57-R61 WeakPolarHBondContact O-CD 3.05Å; S57-R61 WeakPolarHBondContact O-CG 3.39Å; S57-R61 PolarHBondContact O-N 3.13Å; D58-R61 IonicContact OD1-NH1 3.16Å; D58-R61 PolarHBondContact OD1-NH1 3.06Å; D58-R61 VanDerWaalsContact OD1-NH1 3.16Å; K59-R61 VanDerWaalsContact C-N 3.29Å; K59-R61 PolarHBondContact O-N 2.87Å; R61-L63 VanDerWaalsContact C-N 3.32Å; R61-L63 PolarHBondContact O-N 2.66Å
62	G	97.4	Very high	97.7	Very high	42 Å²	42	66.5 Å²	66.5	43%	0.433	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.2	31.8	-178.8	0	0	0	0	0	113.5	D58 K59 E60 Q64	D58-G62 PolarHBondContact O-N 3.4Å; K59-G62 PolarHBondContact O-N 3.4Å; E60-G62 PolarHBondContact O-N 3.49Å; G62-Q64 PolarHBondContact O-N 3.11Å; G62-Q64 PolarHBondContact O-NE2 3.09Å
63	L	97.5	Very high	97.7	Very high	48 Å²	48	68.2 Å²	68.2	25%	0.251	36%	0.361	S	S	.	.			trans	-57.7	131.9	178.2	-176	66.8	0	0	0	110.2	L54 D58 R61 L110 Y111	L54-L63 HydrophobicContact CD2-CD2 3.98Å; D58-L63 HydrophobicContact CB-CB 4.03Å; D58-L63 HydrophobicContact CB-CD2 3.87Å; D58-L63 WeakPolarHBondContact O-CB 2.86Å; D58-L63 PolarHBondContact O-N 2.75Å; R61-L63 VanDerWaalsContact C-N 3.32Å; R61-L63 PolarHBondContact O-N 2.66Å; L63-L110 HydrophobicContact CD1-CD1 4.4Å; L63-L110 HydrophobicContact CD2-CD1 4.32Å; L63-Y111 HydrophobicContact CD2-CD2 4.13Å; L63-Y111 HydrophobicContact CD2-CE2 3.76Å
64	Q	97	Very high	97.7	Very high	148 Å²	148	65.4 Å²	65.4	69%	0.692	35%	0.349	S	S	*	.			trans	-94.9	146.7	179	-58.9	-58.3	-57.1	0	0	111.1	G62 P66	G62-Q64 PolarHBondContact O-N 3.11Å; G62-Q64 PolarHBondContact O-NE2 3.09Å; Q64-P66 VanDerWaalsContact C-CD 3.45Å; Q64-P66 WeakPolarHBondContact O-CD 3.32Å
65	T	97.4	Very high	97.7	Very high	19 Å²	19	64.6 Å²	64.6	12%	0.117	34%	0.344	C	S	.	.			trans	-125.4	64.7	179.2	47.4	0	0	0	0	110.9	L54 V67 W68 Y111	L54-T65 HydrophobicContact CD2-CG2 3.78Å; L54-T65 HydrophobicContact CG-CG2 4.38Å; T65-V67 PolarHBondContact O-N 2.81Å; T65-V67 VanDerWaalsContact O-N 3.09Å; T65-W68 VanDerWaalsContact CB-CD2 3.5Å; T65-W68 HydrophobicContact CG2-CD2 4.18Å; T65-W68 HydrophobicContact CG2-CE3 4.49Å; T65-W68 HydrophobicContact CG2-CH2 4.11Å; T65-W68 HydrophobicContact CG2-CZ2 3.73Å; T65-W68 HydrophobicContact CG2-CZ3 4.45Å; T65-W68 WeakPolarHBondContact O-CB 3.48Å; T65-W68 PolarHBondContact O-N 3.24Å; T65-W68 WeakPolarHBondContact OG1-CZ3 3.18Å; T65-Y111 HydrophobicContact CG2-CD2 4.47Å
66	P	97	Very high	97.7	Very high	100 Å²	100	72.1 Å²	72.1	65%	0.649	37%	0.37	S	S	*	.	H	α-helix	trans	-58.3	-29.1	-174.1	23.9	-34.5	0	0	0	113.4	Q64 W68 T69 E70	Q64-P66 VanDerWaalsContact C-CD 3.45Å; Q64-P66 WeakPolarHBondContact O-CD 3.32Å; P66-W68 PolarHBondContact O-N 3.47Å; P66-T69 WeakPolarHBondContact O-CB 3.37Å; P66-T69 PolarHBondContact O-N 2.88Å; P66-T69 VanDerWaalsContact O-N 3.14Å; P66-E70 PolarHBondContact O-N 2.97Å
67	V	97	Very high	97.6	Very high	9 Å²	9	75.2 Å²	75.2	6%	0.055	37%	0.369	C	S	.	.	H	α-helix	trans	-60	-27.9	177	76.1	0	0	0	0	112.7	P29 T65 T69 E70 Y71 A109	P29-V67 HydrophobicContact CG-CG2 4.29Å; T65-V67 PolarHBondContact O-N 2.81Å; T65-V67 VanDerWaalsContact O-N 3.09Å; V67-T69 PolarHBondContact O-N 3.4Å; V67-E70 WeakPolarHBondContact O-CB 3.25Å; V67-E70 PolarHBondContact O-N 3.37Å; V67-Y71 HydrophobicContact CG1-CE2 4.36Å; V67-Y71 HydrophobicContact CG2-CD1 4.32Å; V67-Y71 HydrophobicContact CG2-CE1 3.58Å; V67-Y71 HydrophobicContact CG2-CE2 4.12Å; V67-Y71 VanDerWaalsContact CG2-CZ 3.45Å; V67-Y71 WeakPolarHBondContact CG2-OH 3.28Å; V67-Y71 WeakPolarHBondContact O-CD1 3.26Å; V67-Y71 PolarHBondContact O-N 3.47Å; V67-A109 HydrophobicContact CB-CB 3.87Å; V67-A109 HydrophobicContact CG1-CB 3.94Å; V67-A109 HydrophobicContact CG2-CB 4.01Å
68	W	98.3	Very high	97.4	Very high	21 Å²	21	74.8 Å²	74.8	8%	0.08	37%	0.37	C	S	.	.	H	α-helix	trans	-66.3	-39.6	177	-64.4	-2.8	0	0	0	112	V51 M52 L54 T65 P66 E70 Y71 E72 L84 K86 Y111	V51-W68 HydrophobicContact CG2-CD2 3.96Å; V51-W68 HydrophobicContact CG2-CG 4.28Å; V51-W68 HydrophobicContact CG2-CZ2 4.04Å; M52-W68 WeakPolarHBondContact O-CZ2 3.47Å; L54-W68 HydrophobicContact CG-CH2 4.03Å; T65-W68 VanDerWaalsContact CB-CD2 3.5Å; T65-W68 HydrophobicContact CG2-CD2 4.18Å; T65-W68 HydrophobicContact CG2-CE3 4.49Å; T65-W68 HydrophobicContact CG2-CH2 4.11Å; T65-W68 HydrophobicContact CG2-CZ2 3.73Å; T65-W68 HydrophobicContact CG2-CZ3 4.45Å; T65-W68 WeakPolarHBondContact O-CB 3.48Å; T65-W68 PolarHBondContact O-N 3.24Å; T65-W68 WeakPolarHBondContact OG1-CZ3 3.18Å; P66-W68 PolarHBondContact O-N 3.47Å; W68-E70 VanDerWaalsContact C-N 3.27Å; W68-E70 PolarHBondContact O-N 3.01Å; W68-Y71 PolarHBondContact O-N 2.81Å; W68-E72 WeakPolarHBondContact O-CG 3.27Å; W68-E72 PolarHBondContact O-N 3.44Å; W68-L84 HydrophobicContact CB-CD2 4.22Å; W68-K86 HydrophobicContact CE3-CD 4.37Å; W68-K86 HydrophobicContact CH2-CD 4.36Å; W68-K86 HydrophobicContact CZ3-CD 3.77Å; W68-K86 HydrophobicContact CZ3-CG 4.27Å; W68-Y111 PolarHBondContact NE1-O 3.18Å
69	T	97.9	Very high	97.2	Very high	95 Å²	95	76.4 Å²	76.4	58%	0.583	39%	0.393	S	S	*	.	H	α-helix	trans	-64	-37.3	175.8	-56.1	0	0	0	0	111	P66 V67 E72 S73	P66-T69 WeakPolarHBondContact O-CB 3.37Å; P66-T69 PolarHBondContact O-N 2.88Å; P66-T69 VanDerWaalsContact O-N 3.14Å; V67-T69 PolarHBondContact O-N 3.4Å; T69-E72 PolarHBondContact O-N 3.24Å; T69-S73 WeakPolarHBondContact O-CB 3.47Å; T69-S73 PolarHBondContact O-N 3.43Å
70	E	97.9	Very high	97.1	Very high	94 Å²	94	72.3 Å²	72.3	44%	0.439	38%	0.376	S	S	.	.	H	α-helix	trans	-64.8	-45.4	174.8	-171.3	171.1	-170.2	0	0	111.5	P29 P66 V67 W68 E72 S73 I74	P29-E70 HydrophobicContact CB-CG 4.18Å; P29-E70 WeakPolarHBondContact CB-OE1 3.38Å; P29-E70 HydrophobicContact CG-CG 4.33Å; P66-E70 PolarHBondContact O-N 2.97Å; V67-E70 WeakPolarHBondContact O-CB 3.25Å; V67-E70 PolarHBondContact O-N 3.37Å; W68-E70 VanDerWaalsContact C-N 3.27Å; W68-E70 PolarHBondContact O-N 3.01Å; E70-E72 PolarHBondContact O-N 3.06Å; E70-S73 WeakPolarHBondContact O-CB 3.32Å; E70-S73 PolarHBondContact O-N 3.31Å; E70-I74 HydrophobicContact CG-CD1 3.99Å; E70-I74 WeakPolarHBondContact O-CG1 3.48Å; E70-I74 PolarHBondContact O-N 3.29Å
71	Y	98.3	Very high	96.8	Very high	0 Å²	0	70.6 Å²	70.6	0%	0	38%	0.377	C	S	.	.	H	α-helix	trans	-60	-45.7	174.5	-62.3	-16.7	0	0	0	112.3	I28 P29 L32 V51 V67 W68 S73 I74 L75 L84 G112 L114	I28-Y71 HydrophobicContact CB-CE1 4.12Å; I28-Y71 WeakPolarHBondContact CB-OH 3.49Å; I28-Y71 HydrophobicContact CG2-CE1 3.6Å; I28-Y71 HydrophobicContact CG2-CE2 4.39Å; I28-Y71 VanDerWaalsContact CG2-CZ 3.48Å; I28-Y71 WeakPolarHBondContact CG2-OH 3.35Å; P29-Y71 HydrophobicContact CG-CE1 3.88Å; L32-Y71 HydrophobicContact CD2-CD1 3.89Å; L32-Y71 HydrophobicContact CD2-CG 4.22Å; V51-Y71 HydrophobicContact CG1-CD2 3.98Å; V51-Y71 HydrophobicContact CG1-CE2 4.2Å; V67-Y71 HydrophobicContact CG1-CE2 4.36Å; V67-Y71 HydrophobicContact CG2-CD1 4.32Å; V67-Y71 HydrophobicContact CG2-CE1 3.58Å; V67-Y71 HydrophobicContact CG2-CE2 4.12Å; V67-Y71 VanDerWaalsContact CG2-CZ 3.45Å; V67-Y71 WeakPolarHBondContact CG2-OH 3.28Å; V67-Y71 WeakPolarHBondContact O-CD1 3.26Å; V67-Y71 PolarHBondContact O-N 3.47Å; W68-Y71 PolarHBondContact O-N 2.81Å; Y71-S73 VanDerWaalsContact C-N 3.28Å; Y71-S73 PolarHBondContact O-N 3Å; Y71-I74 PolarHBondContact O-N 3.19Å; Y71-L75 WeakPolarHBondContact O-CB 3.3Å; Y71-L75 VanDerWaalsContact O-CG 3.22Å; Y71-L75 WeakPolarHBondContact O-CG 3.45Å; Y71-L75 PolarHBondContact O-N 2.91Å; Y71-L84 HydrophobicContact CD2-CD2 4.5Å; Y71-G112 VanDerWaalsContact CE2-O 3.27Å; Y71-G112 WeakPolarHBondContact CE2-O 3.29Å; Y71-G112 PolarHBondContact OH-O 3.14Å; Y71-L114 HydrophobicContact CD2-CD1 4.23Å; Y71-L114 HydrophobicContact CD2-CD2 4.28Å; Y71-L114 HydrophobicContact CE2-CB 4.21Å; Y71-L114 HydrophobicContact CE2-CD2 4.49Å; Y71-L114 HydrophobicContact CG-CD2 4.38Å
72	E	98.3	Very high	96.7	Very high	56 Å²	56	67.3 Å²	67.3	26%	0.262	37%	0.365	S	S	.	.	H	α-helix	trans	-58.3	-42.2	175.6	-74.7	178.5	167.8	0	0	111.3	W68 T69 E70 R76 L84	W68-E72 WeakPolarHBondContact O-CG 3.27Å; W68-E72 PolarHBondContact O-N 3.44Å; T69-E72 PolarHBondContact O-N 3.24Å; E70-E72 PolarHBondContact O-N 3.06Å; E72-R76 WeakPolarHBondContact O-CB 3.49Å; E72-R76 VanDerWaalsContact O-CG 3.26Å; E72-R76 WeakPolarHBondContact O-CG 3.45Å; E72-R76 PolarHBondContact O-N 2.95Å; E72-L84 HydrophobicContact CG-CB 3.75Å; E72-L84 HydrophobicContact CG-CD2 4.08Å
73	S	98	Very high	96.6	Very high	50 Å²	50	69 Å²	69	35%	0.35	38%	0.375	S	S	.	.	H	α-helix	trans	-63.7	-43.1	175.9	-175.4	0	0	0	0	112.2	T69 E70 Y71 R77	T69-S73 WeakPolarHBondContact O-CB 3.47Å; T69-S73 PolarHBondContact O-N 3.43Å; E70-S73 WeakPolarHBondContact O-CB 3.32Å; E70-S73 PolarHBondContact O-N 3.31Å; Y71-S73 VanDerWaalsContact C-N 3.28Å; Y71-S73 PolarHBondContact O-N 3Å; S73-R77 WeakPolarHBondContact O-CG 3.42Å; S73-R77 PolarHBondContact O-N 3.3Å; S73-R77 PolarHBondContact OG-NH1 3.29Å
74	I	97.9	Very high	96.6	Very high	4 Å²	4	67.1 Å²	67.1	2%	0.021	36%	0.364	C	S	.	.	H	α-helix	trans	-65.5	-46.5	178.7	-70.1	162.5	0	0	0	110.6	P29 L32 E33 L36 E70 Y71 R76 R77 A78	P29-I74 HydrophobicContact CB-CD1 3.83Å; L32-I74 HydrophobicContact CB-CG2 4.42Å; L32-I74 HydrophobicContact CD2-CB 4Å; L32-I74 HydrophobicContact CD2-CD1 4.24Å; L32-I74 HydrophobicContact CD2-CG2 3.71Å; L32-I74 HydrophobicContact CG-CG2 3.69Å; E33-I74 HydrophobicContact CG-CB 4.42Å; E33-I74 HydrophobicContact CG-CD1 3.98Å; E33-I74 HydrophobicContact CG-CG1 3.87Å; E33-I74 HydrophobicContact CG-CG2 3.68Å; L36-I74 HydrophobicContact CD1-CG2 3.81Å; E70-I74 HydrophobicContact CG-CD1 3.99Å; E70-I74 WeakPolarHBondContact O-CG1 3.48Å; E70-I74 PolarHBondContact O-N 3.29Å; Y71-I74 PolarHBondContact O-N 3.19Å; I74-R76 VanDerWaalsContact C-N 3.33Å; I74-R76 PolarHBondContact O-N 3.42Å; I74-R77 VanDerWaalsContact CG1-NH2 3.3Å; I74-R77 PolarHBondContact O-N 3.17Å; I74-A78 PolarHBondContact O-N 2.98Å
75	L	97.6	Very high	96.7	Very high	4 Å²	4	61.5 Å²	61.5	2%	0.021	34%	0.344	C	S	.	.	H	α-helix	trans	-58.4	-44.6	177.1	-73.7	166.1	0	0	0	111.3	L36 L41 A49 Y71 A78 G79 C80 L84	L36-L75 HydrophobicContact CD1-CD2 3.99Å; L36-L75 HydrophobicContact CD2-CD2 4.43Å; L41-L75 HydrophobicContact CD1-CD2 3.67Å; A49-L75 HydrophobicContact CB-CD1 3.66Å; A49-L75 HydrophobicContact CB-CD2 3.98Å; Y71-L75 WeakPolarHBondContact O-CB 3.3Å; Y71-L75 VanDerWaalsContact O-CG 3.22Å; Y71-L75 WeakPolarHBondContact O-CG 3.45Å; Y71-L75 PolarHBondContact O-N 2.91Å; L75-A78 CarbonylContact O-C 3.57Å; L75-A78 PolarHBondContact O-N 2.61Å; L75-G79 PolarHBondContact O-N 2.94Å; L75-C80 HydrophobicContact CB-CB 4.12Å; L75-C80 HydrophobicContact CD2-CB 4.45Å; L75-C80 VanDerWaalsContact O-CB 3.3Å; L75-C80 WeakPolarHBondContact O-CB 3.36Å; L75-C80 PolarHBondContact O-N 3.26Å; L75-L84 HydrophobicContact CD1-CD1 3.92Å
76	R	97.3	Very high	96.7	Very high	186 Å²	186	65.3 Å²	65.3	70%	0.702	36%	0.359	S	S	*	.	H	α-helix	trans	-62.3	-44.9	175.7	-75.8	179.6	-176	-158.6	4.5	112.4	E72 I74 A78 G79	E72-R76 WeakPolarHBondContact O-CB 3.49Å; E72-R76 VanDerWaalsContact O-CG 3.26Å; E72-R76 WeakPolarHBondContact O-CG 3.45Å; E72-R76 PolarHBondContact O-N 2.95Å; I74-R76 VanDerWaalsContact C-N 3.33Å; I74-R76 PolarHBondContact O-N 3.42Å; R76-A78 PolarHBondContact O-N 3.47Å; R76-G79 PolarHBondContact O-N 2.82Å
77	R	96.8	Very high	96.8	Very high	155 Å²	155	61.1 Å²	61.1	59%	0.585	33%	0.331	S	S	*	.	H	α-helix	trans	-60.5	-31.1	175.5	-74.5	-165.5	-61.5	-96.6	6.3	112.3	E33 S73 I74 G79	E33-R77 IonicContact OE1-CZ 3.77Å; E33-R77 IonicContact OE1-NH2 2.72Å; E33-R77 PolarHBondContact OE1-NH2 3.5Å; S73-R77 WeakPolarHBondContact O-CG 3.42Å; S73-R77 PolarHBondContact O-N 3.3Å; S73-R77 PolarHBondContact OG-NH1 3.29Å; I74-R77 VanDerWaalsContact CG1-NH2 3.3Å; I74-R77 PolarHBondContact O-N 3.17Å; R77-G79 PolarHBondContact O-N 2.98Å
78	A	93.6	Very high	96.9	Very high	56 Å²	56	64.6 Å²	64.6	46%	0.463	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	4.4	174.5	0	0	0	0	0	114.1	L36 I74 L75 R76	L36-A78 HydrophobicContact CB-CB 3.93Å; L36-A78 HydrophobicContact CD1-CB 3.66Å; L36-A78 HydrophobicContact CG-CB 4.33Å; I74-A78 PolarHBondContact O-N 2.98Å; L75-A78 CarbonylContact O-C 3.57Å; L75-A78 PolarHBondContact O-N 2.61Å; R76-A78 PolarHBondContact O-N 3.47Å
79	G	93.9	Very high	96.8	Very high	59 Å²	59	68.5 Å²	68.5	61%	0.608	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	87	5.3	178.2	0	0	0	0	0	115.1	L75 R76 R77 V81	L75-G79 PolarHBondContact O-N 2.94Å; R76-G79 PolarHBondContact O-N 2.82Å; R77-G79 PolarHBondContact O-N 2.98Å; G79-V81 PolarHBondContact O-N 2.81Å
80	C	94.6	Very high	96.8	Very high	13 Å²	13	70.4 Å²	70.4	9%	0.088	36%	0.361	C	S	.	.			trans	-79.1	111.4	173.4	-178.3	0	0	0	0	110.6	L41 L75	L41-C80 HydrophobicContact CD1-CB 3.88Å; L75-C80 HydrophobicContact CB-CB 4.12Å; L75-C80 HydrophobicContact CD2-CB 4.45Å; L75-C80 VanDerWaalsContact O-CB 3.3Å; L75-C80 WeakPolarHBondContact O-CB 3.36Å; L75-C80 PolarHBondContact O-N 3.26Å
81	V	91.9	Very high	96.8	Very high	130 Å²	130	71.3 Å²	71.3	79%	0.788	37%	0.365	S	S	*	.			trans	-91	-9.2	177.2	-61.1	0	0	0	0	113.6	G79	G79-V81 PolarHBondContact O-N 2.81Å
82	R	94.4	Very high	96.8	Very high	125 Å²	125	71.8 Å²	71.8	47%	0.472	37%	0.368	S	S	.	.	S	Bend	trans	-72.5	144.8	176.3	-59.7	-60.2	-167.7	-135.6	-8	110.4	E46	E46-R82 WeakPolarHBondContact O-CD 3.35Å; E46-R82 WeakPolarHBondContact O-CG 3.32Å
83	A	96	Very high	96.6	Very high	78 Å²	78	73.2 Å²	73.2	65%	0.645	37%	0.371	S	S	*	.			trans	-68.4	149.6	175.6	0	0	0	0	0	111.4	S47 A85	S47-A83 WeakPolarHBondContact CB-O 3.34Å; S47-A83 PolarHBondContact OG-O 2.91Å; A83-A85 PolarHBondContact O-N 2.8Å
84	L	98.1	Very high	96.6	Very high	7 Å²	7	75 Å²	75	4%	0.037	37%	0.374	C	S	.	.			trans	-69.9	115.9	173.5	-177.1	66.3	0	0	0	109.6	A49 V51 W68 Y71 E72 L75 L114	A49-L84 HydrophobicContact CB-CD1 3.75Å; V51-L84 HydrophobicContact CG1-CD1 4.16Å; V51-L84 HydrophobicContact CG1-CD2 3.77Å; V51-L84 HydrophobicContact CG1-CG 4.19Å; V51-L84 HydrophobicContact CG2-CD2 3.99Å; V51-L84 HydrophobicContact CG2-CG 4.12Å; W68-L84 HydrophobicContact CB-CD2 4.22Å; Y71-L84 HydrophobicContact CD2-CD2 4.5Å; E72-L84 HydrophobicContact CG-CB 3.75Å; E72-L84 HydrophobicContact CG-CD2 4.08Å; L75-L84 HydrophobicContact CD1-CD1 3.92Å; L84-L114 HydrophobicContact CD1-CD1 3.77Å
85	A	98.4	Very high	96.6	Very high	31 Å²	31	78.4 Å²	78.4	26%	0.256	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	145.4	179.8	0	0	0	0	0	111.2	S47 A49 A50 V51 A83	S47-A85 PolarHBondContact OG-N 2.85Å; A49-A85 PolarHBondContact O-N 2.96Å; A50-A85 CarbonylContact C-O 3.59Å; A50-A85 VanDerWaalsContact CA-O 3.32Å; A50-A85 WeakPolarHBondContact CA-O 3.49Å; A50-A85 HydrophobicContact CB-CB 3.97Å; V51-A85 WeakPolarHBondContact CG2-O 3.17Å; V51-A85 PolarHBondContact N-O 3.22Å; A83-A85 PolarHBondContact O-N 2.8Å
86	K	98.4	Very high	96.3	Very high	99 Å²	99	79.4 Å²	79.4	43%	0.43	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	118.3	173.6	-62	173.7	-177.6	71.2	0	107	V51 E53 W68	V51-K86 HydrophobicContact CG2-CG 4.11Å; E53-K86 HydrophobicContact CB-CB 4.15Å; E53-K86 HydrophobicContact CG-CB 4.19Å; W68-K86 HydrophobicContact CE3-CD 4.37Å; W68-K86 HydrophobicContact CH2-CD 4.36Å; W68-K86 HydrophobicContact CZ3-CD 3.77Å; W68-K86 HydrophobicContact CZ3-CG 4.27Å
87	I	98.1	Very high	96.1	Very high	12 Å²	12	77.9 Å²	77.9	6%	0.062	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	138.9	-173.2	-59.9	179.8	0	0	0	109	A50 V51 M52 E53 E91 F92 R95	A50-I87 HydrophobicContact CB-CD1 3.4Å; A50-I87 HydrophobicContact CB-CG1 3.98Å; V51-I87 PolarHBondContact O-N 3.07Å; M52-I87 CarbonylContact C-O 3.54Å; E53-I87 WeakPolarHBondContact CB-O 3.21Å; E53-I87 PolarHBondContact N-O 3.35Å; I87-E91 HydrophobicContact CG2-CB 3.61Å; I87-E91 VanDerWaalsContact CG2-CD 3.44Å; I87-E91 HydrophobicContact CG2-CG 3.53Å; I87-F92 HydrophobicContact CG2-CB 4.36Å; I87-R95 VanDerWaalsContact CD1-NH1 3.31Å
88	E	98.4	Very high	96	Very high	81 Å²	81	78.5 Å²	78.5	38%	0.379	40%	0.401	S	S	.	.			trans	-52.2	146.7	175.9	-168.8	-73.5	133.1	0	0	111	F90 E91 F92	E88-F90 VanDerWaalsContact CD-N 3.29Å; E88-F90 PolarHBondContact O-N 3.34Å; E88-F90 WeakPolarHBondContact OE1-CD2 3.15Å; E88-F90 PolarHBondContact OE1-N 3.22Å; E88-F90 WeakPolarHBondContact OE2-CA 3.34Å; E88-F90 WeakPolarHBondContact OE2-CB 3.46Å; E88-F90 PolarHBondContact OE2-N 3.45Å; E88-E91 HydrophobicContact CB-CB 4.39Å; E88-E91 PolarHBondContact O-N 3.06Å; E88-E91 PolarHBondContact OE2-N 3.01Å; E88-F92 WeakPolarHBondContact O-CB 3.38Å; E88-F92 PolarHBondContact O-N 2.77Å
89	R	97.8	Very high	95.8	Very high	104 Å²	104	77.9 Å²	77.9	39%	0.392	40%	0.396	S	S	.	.	H	α-helix	trans	-52.9	-49.1	-171.9	173.9	174.5	-178.1	-166.4	-0.7	114.2	M52 V55 F92 Y93	M52-R89 HydrophobicContact CG-CB 4.27Å; M52-R89 HydrophobicContact SD-CB 4.08Å; M52-R89 HydrophobicContact SD-CG 3.76Å; V55-R89 HydrophobicContact CG1-CB 4.47Å; R89-F92 WeakPolarHBondContact O-CB 3.17Å; R89-F92 PolarHBondContact O-N 2.98Å; R89-Y93 HydrophobicContact CG-CD2 4.29Å; R89-Y93 HydrophobicContact CG-CE2 3.57Å; R89-Y93 PolarHBondContact NE-OH 3.33Å; R89-Y93 PolarHBondContact NH2-OH 3.45Å; R89-Y93 WeakPolarHBondContact O-CD2 3.42Å; R89-Y93 PolarHBondContact O-N 2.81Å; R89-Y93 VanDerWaalsContact O-N 3.14Å
90	F	97.1	Very high	95.7	Very high	134 Å²	134	85.5 Å²	85.5	59%	0.588	41%	0.413	S	S	*	.	H	α-helix	trans	-73.3	-37.6	-179.6	-62.5	-71.1	0	0	0	111.9	E88 F92 Y93 E94	E88-F90 VanDerWaalsContact CD-N 3.29Å; E88-F90 PolarHBondContact O-N 3.34Å; E88-F90 WeakPolarHBondContact OE1-CD2 3.15Å; E88-F90 PolarHBondContact OE1-N 3.22Å; E88-F90 WeakPolarHBondContact OE2-CA 3.34Å; E88-F90 WeakPolarHBondContact OE2-CB 3.46Å; E88-F90 PolarHBondContact OE2-N 3.45Å; F90-F92 VanDerWaalsContact C-N 3.28Å; F90-F92 PolarHBondContact O-N 3.28Å; F90-Y93 HydrophobicContact CD1-CD2 4.12Å; F90-Y93 HydrophobicContact CD1-CE2 4.48Å; F90-Y93 PolarHBondContact O-N 3.47Å; F90-E94 PolarHBondContact O-N 3.47Å
91	E	98.3	Very high	95.2	Very high	113 Å²	113	88.1 Å²	88.1	53%	0.528	44%	0.435	S	S	.	.	H	α-helix	trans	-61.2	-39.1	172.3	-173.9	-172.9	163.1	0	0	111.5	I87 E88 Y93 E94 R95	I87-E91 HydrophobicContact CG2-CB 3.61Å; I87-E91 VanDerWaalsContact CG2-CD 3.44Å; I87-E91 HydrophobicContact CG2-CG 3.53Å; E88-E91 HydrophobicContact CB-CB 4.39Å; E88-E91 PolarHBondContact O-N 3.06Å; E88-E91 PolarHBondContact OE2-N 3.01Å; E91-Y93 PolarHBondContact O-N 3.14Å; E91-E94 PolarHBondContact O-N 3.11Å; E91-R95 WeakPolarHBondContact O-CB 3.46Å; E91-R95 PolarHBondContact O-N 3.28Å
92	F	98.1	Very high	95	Very high	11 Å²	11	87.6 Å²	87.6	5%	0.048	43%	0.432	C	S	.	.	H	α-helix	trans	-60.4	-44.6	174.2	-171.2	-83.1	0	0	0	111.2	M52 I87 E88 R89 F90 R95 A96 N113 I115	M52-F92 HydrophobicContact CB-CB 4.3Å; M52-F92 HydrophobicContact CB-CD1 4.23Å; M52-F92 HydrophobicContact CB-CD2 3.87Å; M52-F92 HydrophobicContact CB-CE2 4.23Å; M52-F92 HydrophobicContact CB-CG 3.87Å; M52-F92 HydrophobicContact CG-CB 4.14Å; M52-F92 HydrophobicContact CG-CG 4.2Å; M52-F92 HydrophobicContact SD-CD1 4.48Å; I87-F92 HydrophobicContact CG2-CB 4.36Å; E88-F92 WeakPolarHBondContact O-CB 3.38Å; E88-F92 PolarHBondContact O-N 2.77Å; R89-F92 WeakPolarHBondContact O-CB 3.17Å; R89-F92 PolarHBondContact O-N 2.98Å; F90-F92 VanDerWaalsContact C-N 3.28Å; F90-F92 PolarHBondContact O-N 3.28Å; F92-R95 PolarHBondContact O-N 2.87Å; F92-A96 WeakPolarHBondContact O-CB 3.44Å; F92-A96 PolarHBondContact O-N 2.87Å; F92-N113 HydrophobicContact CE1-CB 3.77Å; F92-N113 HydrophobicContact CZ-CB 3.6Å; F92-I115 HydrophobicContact CD1-CD1 4.37Å; F92-I115 HydrophobicContact CD2-CD1 3.89Å; F92-I115 HydrophobicContact CE1-CD1 4.1Å; F92-I115 HydrophobicContact CE1-CG1 4.33Å; F92-I115 HydrophobicContact CE2-CD1 3.6Å; F92-I115 HydrophobicContact CE2-CG1 3.74Å; F92-I115 HydrophobicContact CG-CD1 4.27Å; F92-I115 HydrophobicContact CZ-CD1 3.71Å; F92-I115 HydrophobicContact CZ-CG1 3.62Å
93	Y	94.6	Very high	94.5	Very high	86 Å²	86	85.7 Å²	85.7	34%	0.337	43%	0.434	S	S	.	.	H	α-helix	trans	-62.5	-43.9	175.5	-63.3	-33.4	0	0	0	112.5	M52 R89 F90 E91 R95 A96 K97	M52-Y93 HydrophobicContact SD-CE1 4.21Å; R89-Y93 HydrophobicContact CG-CD2 4.29Å; R89-Y93 HydrophobicContact CG-CE2 3.57Å; R89-Y93 PolarHBondContact NE-OH 3.33Å; R89-Y93 PolarHBondContact NH2-OH 3.45Å; R89-Y93 WeakPolarHBondContact O-CD2 3.42Å; R89-Y93 PolarHBondContact O-N 2.81Å; R89-Y93 VanDerWaalsContact O-N 3.14Å; F90-Y93 HydrophobicContact CD1-CD2 4.12Å; F90-Y93 HydrophobicContact CD1-CE2 4.48Å; F90-Y93 PolarHBondContact O-N 3.47Å; E91-Y93 PolarHBondContact O-N 3.14Å; Y93-R95 VanDerWaalsContact C-N 3.3Å; Y93-R95 PolarHBondContact O-N 2.76Å; Y93-A96 PolarHBondContact O-N 3.29Å; Y93-K97 WeakPolarHBondContact O-CG 3.39Å; Y93-K97 PolarHBondContact O-N 3.02Å
94	E	97.9	Very high	93.9	Very high	86 Å²	86	85.8 Å²	85.8	40%	0.402	44%	0.435	S	S	.	.	H	α-helix	trans	-64.4	-36.1	177.4	-72.8	-54.2	121.9	0	0	112.4	F90 E91 K97 K98	F90-E94 PolarHBondContact O-N 3.47Å; E91-E94 PolarHBondContact O-N 3.11Å; E94-K97 IonicContact OE1-NZ 2.7Å; E94-K97 PolarHBondContact OE1-NZ 3.22Å; E94-K98 WeakPolarHBondContact O-CG 3.3Å
95	R	96.7	Very high	93.3	Very high	76 Å²	76	87.5 Å²	87.5	29%	0.287	45%	0.446	S	S	.	.	H	α-helix	trans	-69.9	-40.2	174.2	-169.6	171.4	174.8	164.7	-7	111.9	I87 E91 F92 Y93 K98 A99 I115	I87-R95 VanDerWaalsContact CD1-NH1 3.31Å; E91-R95 WeakPolarHBondContact O-CB 3.46Å; E91-R95 PolarHBondContact O-N 3.28Å; F92-R95 PolarHBondContact O-N 2.87Å; Y93-R95 VanDerWaalsContact C-N 3.3Å; Y93-R95 PolarHBondContact O-N 2.76Å; R95-K98 PolarHBondContact O-N 3.42Å; R95-A99 PolarHBondContact O-N 3.45Å; R95-I115 HydrophobicContact CB-CD1 4.1Å; R95-I115 HydrophobicContact CG-CD1 3.98Å
96	A	92.6	Very high	92.7	Very high	26 Å²	26	87.5 Å²	87.5	22%	0.215	45%	0.449	C	S	.	.	H	α-helix	trans	-65.1	-39.4	177.6	0	0	0	0	0	112.5	F92 Y93 K98 A99 I115	F92-A96 WeakPolarHBondContact O-CB 3.44Å; F92-A96 PolarHBondContact O-N 2.87Å; Y93-A96 PolarHBondContact O-N 3.29Å; A96-K98 PolarHBondContact O-N 3.47Å; A96-A99 WeakPolarHBondContact O-CB 3.37Å; A96-A99 PolarHBondContact O-N 3.41Å; A96-I115 HydrophobicContact CB-CD1 4.4Å
97	K	92.6	Very high	92.3	Very high	154 Å²	154	85.1 Å²	85.1	67%	0.67	44%	0.439	S	S	*	.	H	α-helix	trans	-59.9	-28.3	174.6	-73.2	172.5	-173.1	171.6	0	113.4	Y93 E94	Y93-K97 WeakPolarHBondContact O-CG 3.39Å; Y93-K97 PolarHBondContact O-N 3.02Å; E94-K97 IonicContact OE1-NZ 2.7Å; E94-K97 PolarHBondContact OE1-NZ 3.22Å
98	K	93.6	Very high	91.9	Very high	168 Å²	168	90.7 Å²	90.7	73%	0.73	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.8	-2	178.7	-63.1	172.2	-173.3	172.5	0	112.6	E94 R95 A96	E94-K98 WeakPolarHBondContact O-CG 3.3Å; R95-K98 PolarHBondContact O-N 3.42Å; A96-K98 PolarHBondContact O-N 3.47Å
99	A	90.1	Very high	91.7	Very high	43 Å²	43	88.4 Å²	88.4	36%	0.355	47%	0.469	S	S	.	.	S	Bend	trans	-68.5	149.3	178.9	0	0	0	0	0	110.6	R95 A96 A101	R95-A99 PolarHBondContact O-N 3.45Å; A96-A99 WeakPolarHBondContact O-CB 3.37Å; A96-A99 PolarHBondContact O-N 3.41Å; A99-A101 VanDerWaalsContact C-N 3.28Å; A99-A101 PolarHBondContact O-N 3.26Å
100	F	91.3	Very high	91.6	Very high	218 Å²	218	89 Å²	89	96%	0.956	48%	0.479	S	S	*	.	S	Bend	trans	-63.1	-36.4	177.6	178.5	-96.2	0	0	0	112.5
101	A	85.9	Confident	91.6	Very high	68 Å²	68	83.9 Å²	83.9	56%	0.562	46%	0.456	S	S	*	.			trans	-150.9	152.6	176.6	0	0	0	0	0	110	A99	A99-A101 VanDerWaalsContact C-N 3.28Å; A99-A101 PolarHBondContact O-N 3.26Å
102	V	86	Confident	91.5	Very high	119 Å²	119	78.6 Å²	78.6	72%	0.721	43%	0.432	S	S	*	.			trans	-119.6	127.9	169.3	177.8	0	0	0	0	107.4
103	V	85	Confident	91.4	Very high	86 Å²	86	82 Å²	82	52%	0.521	45%	0.451	S	S	.	.			trans	-102.5	113.7	176.5	-175.7	0	0	0	0	107.8	L31 T105	L31-V103 HydrophobicContact CD2-CG1 3.99Å; V103-T105 HydrophobicContact CG1-CG2 4.17Å
104	A	84.1	Confident	91.6	Very high	80 Å²	80	79.6 Å²	79.6	66%	0.661	44%	0.444	S	S	*	.			trans	-71.8	131.1	168.5	0	0	0	0	0	108.8
105	T	85	Confident	91.5	Very high	42 Å²	42	76.6 Å²	76.6	26%	0.258	43%	0.43	S	S	.	.			trans	-125.9	168.9	-177.7	68.7	0	0	0	0	109.4	L26 I28 L31 V103 E107	L26-T105 WeakPolarHBondContact O-CB 3.38Å; I28-T105 HydrophobicContact CG1-CG2 4Å; L31-T105 HydrophobicContact CD2-CG2 3.91Å; V103-T105 HydrophobicContact CG1-CG2 4.17Å; T105-E107 WeakPolarHBondContact OG1-CB 3.19Å; T105-E107 PolarHBondContact OG1-N 3.24Å
106	G	84.4	Confident	91.6	Very high	31 Å²	31	75.5 Å²	75.5	32%	0.32	43%	0.43	S	S	.	.			trans	-91.8	19.4	172.4	0	0	0	0	0	112.6	I24 L26 T108	I24-G106 WeakPolarHBondContact O-CA 3.43Å; I24-G106 PolarHBondContact O-N 2.91Å; L26-G106 PolarHBondContact O-N 3.16Å; L26-G106 VanDerWaalsContact O-N 3.09Å; G106-T108 PolarHBondContact O-N 2.86Å
107	E	90	Very high	91.8	Very high	49 Å²	49	80 Å²	80	23%	0.229	44%	0.441	C	S	.	.			trans	-63.9	128.9	178.7	-177.2	56.5	-102.2	0	0	110.5	G27 I28 P29 T105 A109	G27-E107 WeakPolarHBondContact CA-OE2 3.36Å; I28-E107 HydrophobicContact CB-CB 4.4Å; I28-E107 HydrophobicContact CB-CG 4.27Å; I28-E107 HydrophobicContact CD1-CB 3.83Å; I28-E107 HydrophobicContact CD1-CG 3.89Å; I28-E107 HydrophobicContact CG1-CB 3.74Å; I28-E107 HydrophobicContact CG1-CG 4.02Å; I28-E107 PolarHBondContact N-OE2 3.27Å; P29-E107 WeakPolarHBondContact CD-OE2 3.26Å; T105-E107 WeakPolarHBondContact OG1-CB 3.19Å; T105-E107 PolarHBondContact OG1-N 3.24Å; E107-A109 HydrophobicContact CG-CB 4.1Å; E107-A109 VanDerWaalsContact OE1-CB 3.26Å; E107-A109 WeakPolarHBondContact OE1-CB 3.35Å; E107-A109 PolarHBondContact OE1-N 2.98Å
108	T	91.4	Very high	91.8	Very high	129 Å²	129	79.7 Å²	79.7	79%	0.791	44%	0.44	S	S	*	.			trans	-105.2	-12	-177.9	60.3	0	0	0	0	111.9	G106 L110	G106-T108 PolarHBondContact O-N 2.86Å; T108-L110 PolarHBondContact O-N 3.44Å
109	A	94.4	Very high	91.7	Very high	34 Å²	34	72.2 Å²	72.2	28%	0.281	41%	0.41	S	S	.	.	S	Bend	trans	-61.1	124.2	177.9	0	0	0	0	0	111.5	V67 E107 Y111 G112	V67-A109 HydrophobicContact CB-CB 3.87Å; V67-A109 HydrophobicContact CG1-CB 3.94Å; V67-A109 HydrophobicContact CG2-CB 4.01Å; E107-A109 HydrophobicContact CG-CB 4.1Å; E107-A109 VanDerWaalsContact OE1-CB 3.26Å; E107-A109 WeakPolarHBondContact OE1-CB 3.35Å; E107-A109 PolarHBondContact OE1-N 2.98Å; A109-Y111 PolarHBondContact O-N 3.34Å; A109-G112 PolarHBondContact O-N 2.7Å
110	L	94.4	Very high	91.6	Very high	115 Å²	115	75 Å²	75	60%	0.602	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	138.1	173.8	-63.7	-179.4	0	0	0	110.4	L63 T108 G112	L63-L110 HydrophobicContact CD1-CD1 4.4Å; L63-L110 HydrophobicContact CD2-CD1 4.32Å; T108-L110 PolarHBondContact O-N 3.44Å; L110-G112 PolarHBondContact O-N 3.31Å; L110-G112 VanDerWaalsContact O-N 3.16Å
111	Y	97.4	Very high	91.1	Very high	27 Å²	27	71.3 Å²	71.3	11%	0.106	41%	0.412	C	S	.	.	T	Hydrogen-bonded Turn	trans	55.4	26.4	-174.8	-61.1	-96.8	0	0	0	113.6	M52 E53 L54 V55 D58 L63 T65 W68 A109 N113	M52-Y111 HydrophobicContact CB-CD1 4.37Å; M52-Y111 HydrophobicContact CE-CD1 3.53Å; M52-Y111 HydrophobicContact CE-CE1 3.59Å; M52-Y111 HydrophobicContact CE-CG 4.45Å; M52-Y111 HydrophobicContact CG-CD1 4.35Å; E53-Y111 VanDerWaalsContact O-CE1 3.32Å; E53-Y111 WeakPolarHBondContact O-CE1 3.36Å; L54-Y111 HydrophobicContact CD2-CD1 4.04Å; L54-Y111 HydrophobicContact CD2-CD2 3.48Å; L54-Y111 VanDerWaalsContact CD2-CD2 3.48Å; L54-Y111 HydrophobicContact CD2-CE1 3.99Å; L54-Y111 HydrophobicContact CD2-CE2 3.43Å; L54-Y111 VanDerWaalsContact CD2-CE2 3.43Å; L54-Y111 HydrophobicContact CD2-CG 3.81Å; V55-Y111 WeakPolarHBondContact CG2-OH 3.47Å; V55-Y111 PolarHBondContact N-OH 2.93Å; D58-Y111 WeakPolarHBondContact OD2-CE2 3.43Å; D58-Y111 PolarHBondContact OD2-OH 3.19Å; L63-Y111 HydrophobicContact CD2-CD2 4.13Å; L63-Y111 HydrophobicContact CD2-CE2 3.76Å; T65-Y111 HydrophobicContact CG2-CD2 4.47Å; W68-Y111 PolarHBondContact NE1-O 3.18Å; A109-Y111 PolarHBondContact O-N 3.34Å; Y111-N113 VanDerWaalsContact C-N 3.27Å; Y111-N113 PolarHBondContact O-N 2.81Å
112	G	96.1	Very high	90	Very high	2 Å²	2	72.4 Å²	72.4	2%	0.021	42%	0.421	C	S	.	.			trans	-74	-10.4	177.5	0	0	0	0	0	114.8	I28 Y71 A109 L110 L114	I28-G112 WeakPolarHBondContact CD1-O 3.38Å; Y71-G112 VanDerWaalsContact CE2-O 3.27Å; Y71-G112 WeakPolarHBondContact CE2-O 3.29Å; Y71-G112 PolarHBondContact OH-O 3.14Å; A109-G112 PolarHBondContact O-N 2.7Å; L110-G112 PolarHBondContact O-N 3.31Å; L110-G112 VanDerWaalsContact O-N 3.16Å; G112-L114 PolarHBondContact O-N 2.95Å
113	N	96.1	Very high	88.6	Confident	83 Å²	83	74.8 Å²	74.8	44%	0.444	43%	0.429	S	S	.	.			trans	-58.8	133.2	-179.7	-57.7	-60	0	0	0	111.5	V51 F92 Y111	V51-N113 WeakPolarHBondContact CA-O 3.33Å; V51-N113 WeakPolarHBondContact CG1-O 3.23Å; F92-N113 HydrophobicContact CE1-CB 3.77Å; F92-N113 HydrophobicContact CZ-CB 3.6Å; Y111-N113 VanDerWaalsContact C-N 3.27Å; Y111-N113 PolarHBondContact O-N 2.81Å
114	L	98	Very high	86.8	Confident	35 Å²	35	75.9 Å²	75.9	18%	0.183	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	130.7	-176	-178.9	66.6	0	0	0	110.5	I28 L32 A49 A50 V51 Y71 L84 G112 L116	I28-L114 HydrophobicContact CG2-CB 4.35Å; I28-L114 HydrophobicContact CG2-CD2 4.34Å; L32-L114 HydrophobicContact CD1-CD2 3.66Å; L32-L114 HydrophobicContact CD2-CD2 3.71Å; L32-L114 HydrophobicContact CG-CD2 4.19Å; A49-L114 HydrophobicContact CB-CD1 4.36Å; A50-L114 WeakPolarHBondContact O-CA 3.27Å; V51-L114 HydrophobicContact CG1-CD1 3.9Å; Y71-L114 HydrophobicContact CD2-CD1 4.23Å; Y71-L114 HydrophobicContact CD2-CD2 4.28Å; Y71-L114 HydrophobicContact CE2-CB 4.21Å; Y71-L114 HydrophobicContact CE2-CD2 4.49Å; Y71-L114 HydrophobicContact CG-CD2 4.38Å; L84-L114 HydrophobicContact CD1-CD1 3.77Å; G112-L114 PolarHBondContact O-N 2.95Å; L114-L116 HydrophobicContact CD1-CD2 4.48Å; L114-L116 HydrophobicContact CD2-CD2 4.04Å; L114-L116 HydrophobicContact CD2-CG 4.47Å; L114-L116 HydrophobicContact CG-CD2 4.11Å; L114-L116 HydrophobicContact CG-CG 4.46Å
115	I	97.6	Very high	85	Confident	23 Å²	23	77.8 Å²	77.8	12%	0.118	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	130	171	-66	172.5	0	0	0	108.3	A49 A50 F92 R95 A96	A49-I115 CarbonylContact C-O 3.57Å; A49-I115 VanDerWaalsContact CA-O 3.3Å; A49-I115 WeakPolarHBondContact CA-O 3.44Å; A50-I115 PolarHBondContact N-O 3.24Å; A50-I115 PolarHBondContact O-N 3.5Å; F92-I115 HydrophobicContact CD1-CD1 4.37Å; F92-I115 HydrophobicContact CD2-CD1 3.89Å; F92-I115 HydrophobicContact CE1-CD1 4.1Å; F92-I115 HydrophobicContact CE1-CG1 4.33Å; F92-I115 HydrophobicContact CE2-CD1 3.6Å; F92-I115 HydrophobicContact CE2-CG1 3.74Å; F92-I115 HydrophobicContact CG-CD1 4.27Å; F92-I115 HydrophobicContact CZ-CD1 3.71Å; F92-I115 HydrophobicContact CZ-CG1 3.62Å; R95-I115 HydrophobicContact CB-CD1 4.1Å; R95-I115 HydrophobicContact CG-CD1 3.98Å; A96-I115 HydrophobicContact CB-CD1 4.4Å
116	L	97.3	Very high	83	Confident	53 Å²	53	83 Å²	83	28%	0.277	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	140.9	172.3	-59.4	177.5	0	0	0	110.4	L32 V35 L36 L39 L41 P48 A49 L114	L32-L116 HydrophobicContact CD1-CD1 3.7Å; L32-L116 HydrophobicContact CD1-CD2 4.01Å; L32-L116 HydrophobicContact CD1-CG 4.38Å; V35-L116 HydrophobicContact CG1-CD1 3.91Å; L36-L116 HydrophobicContact CD2-CD1 4.49Å; L39-L116 HydrophobicContact CD2-CB 4.3Å; L39-L116 HydrophobicContact CD2-CD1 4.34Å; L41-L116 HydrophobicContact CD2-CB 4.33Å; L41-L116 HydrophobicContact CD2-CD2 4.23Å; P48-L116 CarbonylContact O-C 3.51Å; P48-L116 WeakPolarHBondContact O-CA 3.34Å; A49-L116 HydrophobicContact CB-CD2 3.91Å; L114-L116 HydrophobicContact CD1-CD2 4.48Å; L114-L116 HydrophobicContact CD2-CD2 4.04Å; L114-L116 HydrophobicContact CD2-CG 4.47Å; L114-L116 HydrophobicContact CG-CD2 4.11Å; L114-L116 HydrophobicContact CG-CG 4.46Å
117	R	96.3	Very high	81	Confident	122 Å²	122	92.2 Å²	92.2	46%	0.46	50%	0.504	S	S	.	.			trans	-108.2	112.6	173.2	-170	170.4	169.1	149.5	-0.1	109.3	D42 V45 P48 G119	D42-R117 HydrophobicContact CB-CB 4.24Å; D42-R117 HydrophobicContact CB-CG 3.83Å; D42-R117 PolarHBondContact N-O 3.29Å; D42-R117 IonicContact OD2-CZ 3.56Å; D42-R117 IonicContact OD2-NE 2.79Å; D42-R117 PolarHBondContact OD2-NE 2.79Å; D42-R117 IonicContact OD2-NH2 3.61Å; V45-R117 VanDerWaalsContact CG1-CZ 3.47Å; P48-R117 HydrophobicContact CB-CB 4.44Å; P48-R117 PolarHBondContact O-N 3.5Å; R117-G119 PolarHBondContact O-N 3.05Å
118	K	93.3	Very high	80.5	Confident	147 Å²	147	94.4 Å²	94.4	64%	0.639	52%	0.518	S	S	*	.	B	Isolated β-bridge	trans	-64.7	130.4	176.8	-178.5	-179.7	175.5	-176.3	0	110.2	L39 P40	L39-K118 HydrophobicContact CD1-CB 4.1Å; L39-K118 HydrophobicContact CD1-CD 4.06Å; L39-K118 HydrophobicContact CD1-CG 4.02Å; L39-K118 HydrophobicContact CD2-CB 4.45Å; L39-K118 HydrophobicContact CG-CB 4.3Å; L39-K118 HydrophobicContact CG-CG 4.21Å; P40-K118 WeakPolarHBondContact O-CA 3.22Å
119	G	91.8	Very high	79.9	Confident	11 Å²	11	92.6 Å²	92.6	11%	0.113	50%	0.503	C	S	.	.			trans	-94.4	-168	172.2	0	0	0	0	0	113.1	P40 D42 R117	P40-G119 PolarHBondContact O-N 2.91Å; D42-G119 VanDerWaalsContact CA-CA 3.42Å; R117-G119 PolarHBondContact O-N 3.05Å
120	V	88.7	Confident	79.1	Confident	100 Å²	100	95.8 Å²	95.8	61%	0.606	52%	0.516	S	S	*	.			trans	-91.2	146.9	172.4	-64.1	0	0	0	0	110.2	Y44 A122	Y44-V120 HydrophobicContact CE2-CG2 4.27Å; V120-A122 PolarHBondContact O-N 3.06Å
121	L	79.1	Confident	78.2	Confident	141 Å²	141	94.7 Å²	94.7	74%	0.738	51%	0.51	S	S	*	.			trans	-74.8	117.2	162.6	-70.2	170.2	0	0	0	106.9	P40 L123	P40-L121 HydrophobicContact CB-CD2 4.14Å; P40-L121 HydrophobicContact CG-CD2 3.65Å; P40-L121 HydrophobicContact CG-CG 3.98Å; L121-L123 PolarHBondContact O-N 3.23Å
122	A	63.6	Low	77	Confident	91 Å²	91	98.9 Å²	98.9	75%	0.752	54%	0.536	S	S	*	.			trans	-67.5	115.8	159.2	0	0	0	0	0	106.4	V120 N124	V120-A122 PolarHBondContact O-N 3.06Å; A122-N124 PolarHBondContact O-N 3.39Å
123	L	56.7	Low	75.8	Confident	170 Å²	170	105.4 Å²	105.4	89%	0.89	57%	0.57	S	S	*	*			trans	-55.6	116.6	161	-83.7	157.8	0	0	0	105.7	L121 P125	L121-L123 PolarHBondContact O-N 3.23Å; L123-P125 WeakPolarHBondContact O-CD 3.47Å
124	N	47.8	Very low	74.3	Confident	109 Å²	109	107 Å²	107	58%	0.583	58%	0.579	S	S	*	*			trans	-56.8	124.9	178.4	-141.6	8.7	0	0	0	107.6	A122 L126	A122-N124 PolarHBondContact O-N 3.39Å; N124-L126 PolarHBondContact O-N 2.96Å
125	P	46.8	Very low	72.5	Confident	119 Å²	119	112.5 Å²	112.5	77%	0.773	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.5	12.4	173.8	23.8	-24.6	0	0	0	113.2	L123	L123-P125 WeakPolarHBondContact O-CD 3.47Å
126	L	41.8	Very low	70.4	Confident	153 Å²	153	120 Å²	120	80%	0.801	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.3	31.4	-176	-67.9	173.2	0	0	0	113	N124	N124-L126 PolarHBondContact O-N 2.96Å
127	L	41.7	Very low	67.9	Low	224 Å²	224	126.1 Å²	126.1	100%	1.173	68%	0.684	S	S	*	*			trans	-110.2	0	150.2	-88.3	168.8	0	0	0	108.5

Retrieved 127 of 127 residues in 41.9 ms (Link to these results)

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