A0A087YFS4_POEFO Loading...

PHD finger protein 5A

AlphaFold DB (E9QHY3), UniProt , Accession A0A087YFS4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 102 aa.

						>A0A087YFS4_POEFO|A0A087YFS4
MAKHHPDLIFCRKQAGVGDGKCVICDSYVRPCTLVRICDECNYGSYQGRCVICGGPGVSDAYYCKECTIQEKDRDGCPKIVNLGSSKTDLFYERKKYGFKKR
					

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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	56.3	Low	75.8	Confident	128 Å²	128	80.7 Å²	80.7	63%	0.631	41%	0.412	S	S	*	.				0	-30.5	0	-83.6	-179.8	156.4	0	0	113.1	H5 D26 I52	M1-H5 PolarHBondContact O-CD2 3.5Å; M1-D26 PolarHBondContact N-OD1 2.94Å; M1-D26 PolarHBondContact N-OD2 3.29Å; M1-I52 HydrophobicContact CB-CG2 4.12Å
2	A	61.1	Low	75.8	Confident	7 Å²	7	89.1 Å²	89.1	6%	0.058	44%	0.435	C	S	.	.			trans	-78.4	-44.5	177.3	0	0	0	0	0	111.8	H4 H5 F10 D26 I80	A2-H4 VanDerWaalsContact C-N 3.28Å; A2-H4 PolarHBondContact O-N 3.42Å; A2-H5 PolarHBondContact O-N 2.72Å; A2-F10 HydrophobicContact CB-CE1 4.48Å; A2-F10 HydrophobicContact CB-CZ 4.04Å; A2-D26 PolarHBondContact N-OD1 2.98Å; A2-D26 PolarHBondContact N-OD2 3.38Å; A2-I80 HydrophobicContact CB-CD1 3.98Å
3	K	67.5	Low	75.2	Confident	152 Å²	152	89.4 Å²	89.4	66%	0.661	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-26.5	-177.5	-175.3	179.9	174.3	-173.4	0	114.3	H5 D26	K3-H5 VanDerWaalsContact C-N 3.35Å; K3-D26 PolarHBondContact N-OD2 3.45Å
4	H	76.8	Confident	72.6	Confident	142 Å²	142	95.3 Å²	95.3	66%	0.657	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-10.1	-173.6	-58.7	-75.7	0	0	0	113.8	A2	A2-H4 VanDerWaalsContact C-N 3.28Å; A2-H4 PolarHBondContact O-N 3.42Å
5	H	78.3	Confident	70.5	Confident	54 Å²	54	92 Å²	92	25%	0.25	45%	0.454	C	S	.	.			trans	-124.4	98.8	-172.9	-66.1	-88.6	0	0	0	108.5	M1 A2 K3 D7 L8 S86	M1-H5 PolarHBondContact O-CD2 3.5Å; A2-H5 PolarHBondContact O-N 2.72Å; K3-H5 VanDerWaalsContact C-N 3.35Å; H5-D7 WeakPolarHBondContact CB-OD1 3.4Å; H5-D7 PolarHBondContact O-N 3.38Å; H5-L8 HydrophobicContact CB-CD1 3.61Å; H5-L8 HydrophobicContact CB-CG 3.72Å; H5-L8 PolarHBondContact O-N 2.6Å; H5-S86 VanDerWaalsContact CE1-CB 3.46Å; H5-S86 WeakPolarHBondContact CE1-CB 3.39Å; H5-S86 PolarHBondContact CE1-OG 3.23Å; H5-S86 PolarHBondContact ND1-OG 2.72Å
6	P	80.4	Confident	69.1	Low	135 Å²	135	87.3 Å²	87.3	88%	0.877	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-13.1	-174.3	29.4	-35.6	0	0	0	113.1	L8	P6-L8 VanDerWaalsContact C-N 3.34Å
7	D	84.2	Confident	67.5	Low	50 Å²	50	86.6 Å²	86.6	27%	0.267	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-7	178.3	61.1	-44.6	0	0	0	113.6	H5 N82 G84 S85	H5-D7 WeakPolarHBondContact CB-OD1 3.4Å; H5-D7 PolarHBondContact O-N 3.38Å; D7-N82 PolarHBondContact O-ND2 2.74Å; D7-G84 WeakPolarHBondContact OD2-CA 3.46Å; D7-S85 WeakPolarHBondContact OD2-CB 3.14Å; D7-S85 PolarHBondContact OD2-N 2.99Å; D7-S85 PolarHBondContact OD2-OG 2.91Å
8	L	81.8	Confident	66.9	Low	31 Å²	31	82.3 Å²	82.3	16%	0.162	42%	0.418	C	S	.	.			trans	-79	128.3	179.3	-62.5	177.9	0	0	0	111.8	H5 P6 I80	H5-L8 HydrophobicContact CB-CD1 3.61Å; H5-L8 HydrophobicContact CB-CG 3.72Å; H5-L8 PolarHBondContact O-N 2.6Å; P6-L8 VanDerWaalsContact C-N 3.34Å; L8-I80 HydrophobicContact CB-CD1 4.32Å; L8-I80 HydrophobicContact CB-CG2 4.18Å; L8-I80 HydrophobicContact CD1-CD1 3.93Å; L8-I80 HydrophobicContact CD2-CG2 4.02Å
9	I	83	Confident	66.5	Low	102 Å²	102	78.9 Å²	78.9	52%	0.523	40%	0.401	S	S	.	.			trans	-108.8	125.8	-174.8	-55.5	174.1	0	0	0	109.2	I80 V81 N82	I9-I80 WeakPolarHBondContact O-CA 3.47Å; I9-V81 HydrophobicContact CB-CG2 4.09Å; I9-V81 HydrophobicContact CG2-CG2 4.05Å; I9-V81 WeakPolarHBondContact O-CG2 3.35Å; I9-V81 PolarHBondContact O-N 2.91Å; I9-N82 PolarHBondContact N-OD1 2.76Å
10	F	83.3	Confident	66.5	Low	60 Å²	60	76.9 Å²	76.9	26%	0.263	40%	0.401	S	S	.	.	B	Isolated β-bridge	trans	-88.5	150	176.2	-64	-80.1	0	0	0	112	A2 R12 P78 I80	A2-F10 HydrophobicContact CB-CE1 4.48Å; A2-F10 HydrophobicContact CB-CZ 4.04Å; F10-R12 HydrophobicContact CB-CG 4.32Å; F10-P78 HydrophobicContact CD1-CB 4.46Å; F10-P78 WeakPolarHBondContact CD1-O 2.93Å; F10-I80 HydrophobicContact CD1-CG1 4.09Å; F10-I80 HydrophobicContact CE1-CD1 4.38Å; F10-I80 HydrophobicContact CE1-CG1 3.96Å
11	C	81.3	Confident	67.2	Low	27 Å²	27	74.9 Å²	74.9	18%	0.182	39%	0.389	C	S	.	.			trans	-69	-45.2	-179.4	-179.1	0	0	0	0	114.5	K13 C77 K79 V81	C11-K13 VanDerWaalsContact C-N 3.32Å; C11-K13 PolarHBondContact O-N 3.32Å; C11-C77 HydrophobicContact CB-CB 4.07Å; C11-C77 PolarHBondContact N-O 3.17Å; C11-K79 HydrophobicContact CB-CB 4.5Å; C11-K79 WeakPolarHBondContact CB-O 3.39Å; C11-K79 PolarHBondContact N-O 3.35Å; C11-V81 HydrophobicContact CB-CG1 4.01Å
12	R	75.6	Confident	68.7	Low	181 Å²	181	69 Å²	69	68%	0.683	36%	0.36	S	S	*	.			trans	62.7	16.7	179.8	-56.1	-172.7	176.6	-174.7	-1.6	117.7	F10 C77	F10-R12 HydrophobicContact CB-CG 4.32Å; R12-C77 PolarHBondContact N-O 3.27Å
13	K	68.7	Low	69.9	Low	93 Å²	93	68.6 Å²	68.6	40%	0.404	36%	0.357	S	S	.	.	S	Bend	trans	-80.5	-177.1	171.3	-67.6	179	-177.8	178.5	0	112.6	C11 C38 E40 G76 C77	C11-K13 VanDerWaalsContact C-N 3.32Å; C11-K13 PolarHBondContact O-N 3.32Å; K13-C38 HydrophobicContact CB-CB 3.47Å; K13-C38 VanDerWaalsContact CB-CB 3.47Å; K13-E40 IonicContact NZ-OE1 2.85Å; K13-E40 PolarHBondContact NZ-OE1 3.24Å; K13-E40 IonicContact NZ-OE2 2.56Å; K13-E40 PolarHBondContact NZ-OE2 3.09Å; K13-G76 CarbonylContact O-C 3.6Å; K13-G76 VanDerWaalsContact O-CA 3.24Å; K13-G76 WeakPolarHBondContact O-CA 3.37Å; K13-C77 HydrophobicContact CB-CB 4.36Å; K13-C77 WeakPolarHBondContact O-CA 3.12Å; K13-C77 VanDerWaalsContact O-CB 3.28Å; K13-C77 WeakPolarHBondContact O-CB 3.44Å; K13-C77 PolarHBondContact O-N 2.93Å
14	Q	38.5	Very low	70.9	Confident	172 Å²	172	63.3 Å²	63.3	80%	0.804	34%	0.335	S	S	*	.	S	Bend	trans	-62	-179.8	174.3	-154.3	104.8	11.4	0	0	112.4	I37 C38	Q14-I37 CarbonylContact O-C 3.44Å; Q14-C38 WeakPolarHBondContact O-CA 3.25Å; Q14-C38 WeakPolarHBondContact O-CB 3.46Å; Q14-C38 PolarHBondContact O-N 3.48Å
15	A	40.6	Very low	71.4	Confident	46 Å²	46	58.3 Å²	58.3	38%	0.38	32%	0.316	S	S	.	.			trans	-147.5	132.7	-146	0	0	0	0	0	118.1	R36 I37	A15-R36 WeakPolarHBondContact CA-O 3.26Å; A15-R36 HydrophobicContact CB-CB 3.09Å; A15-R36 HydrophobicContact CB-CG 4.42Å; A15-R36 WeakPolarHBondContact CB-O 2.97Å; A15-R36 WeakPolarHBondContact O-CB 3.43Å; A15-I37 CarbonylContact C-O 3.53Å; A15-I37 VanDerWaalsContact CA-C 3.47Å; A15-I37 WeakPolarHBondContact CA-O 3.25Å
16	G	48.5	Very low	71.6	Confident	16 Å²	16	56.6 Å²	56.6	17%	0.165	31%	0.309	C	S	.	.			trans	-138.2	-167.2	164.6	0	0	0	0	0	123.8	V35 R36 I37	G16-V35 CarbonylContact C-O 3.02Å; G16-V35 VanDerWaalsContact C-O 3.29Å; G16-V35 CarbonylContact O-C 3.36Å; G16-R36 CarbonylContact O-C 3.22Å; G16-R36 WeakPolarHBondContact O-CA 3.28Å; G16-R36 PolarHBondContact O-N 3.01Å; G16-R36 VanDerWaalsContact O-N 3.16Å; G16-I37 WeakPolarHBondContact CA-O 3.24Å; G16-I37 PolarHBondContact N-O 3.32Å; G16-I37 WeakPolarHBondContact O-CB 3.49Å; G16-I37 VanDerWaalsContact O-CG1 3.31Å; G16-I37 WeakPolarHBondContact O-CG1 3.47Å; G16-I37 PolarHBondContact O-N 3.48Å
17	V	42.6	Very low	71.8	Confident	77 Å²	77	51.7 Å²	51.7	47%	0.467	28%	0.278	S	S	.	.			trans	-67.3	152.9	-154.8	-172.9	0	0	0	0	120.9	V35 I37 D60	V17-V35 WeakPolarHBondContact CA-O 3.46Å; V17-I37 WeakPolarHBondContact O-CD1 3.08Å; V17-I37 VanDerWaalsContact O-CG1 3.31Å; V17-I37 WeakPolarHBondContact O-CG1 3.34Å; V17-D60 HydrophobicContact CG1-CB 4.21Å; V17-D60 WeakPolarHBondContact CG1-OD1 2.94Å
18	G	55.5	Low	71.8	Confident	8 Å²	8	57.7 Å²	57.7	8%	0.082	30%	0.298	C	S	.	.			trans	-138.4	-151.7	178.1	0	0	0	0	0	117.8	S59 D60 A61	G18-S59 CarbonylContact C-O 3.2Å; G18-S59 CarbonylContact O-C 3.52Å; G18-D60 CarbonylContact O-C 3.41Å; G18-D60 WeakPolarHBondContact O-CA 3.43Å; G18-A61 VanDerWaalsContact C-CA 3.49Å; G18-A61 VanDerWaalsContact CA-CB 3.49Å; G18-A61 PolarHBondContact O-N 3.25Å
19	D	60.5	Low	72	Confident	18 Å²	18	60.9 Å²	60.9	10%	0.096	32%	0.318	C	S	.	.			trans	-112.7	113.6	176.6	-66.8	-73.2	0	0	0	122.9	K21 C50 G57 V58 S59 D60 A61	D19-K21 WeakPolarHBondContact O-CG 3.08Å; D19-K21 PolarHBondContact O-N 2.93Å; D19-C50 WeakPolarHBondContact OD2-CA 3.22Å; D19-C50 WeakPolarHBondContact OD2-CB 2.93Å; D19-C50 PolarHBondContact OD2-SG 3.18Å; D19-G57 WeakPolarHBondContact OD1-CA 3.3Å; D19-V58 PolarHBondContact OD1-N 3.21Å; D19-S59 VanDerWaalsContact CA-O 3.24Å; D19-S59 WeakPolarHBondContact CA-O 3.22Å; D19-S59 PolarHBondContact OD1-N 2.86Å; D19-D60 CarbonylContact C-O 2.96Å; D19-A61 VanDerWaalsContact C-CB 3.5Å
20	G	66.5	Low	72.3	Confident	39 Å²	39	64.3 Å²	64.3	40%	0.402	33%	0.325	S	S	.	.	S	Bend	trans	46.6	-14.2	152.6	0	0	0	0	0	123	S59 D60	G20-S59 WeakPolarHBondContact CA-OG 3.25Å; G20-S59 PolarHBondContact N-OG 2.95Å; G20-D60 WeakPolarHBondContact CA-O 3.5Å; G20-D60 PolarHBondContact N-O 2.95Å
21	K	81.4	Confident	72.6	Confident	35 Å²	35	65.7 Å²	65.7	15%	0.152	34%	0.34	C	S	.	.	S	Bend	trans	-138.6	161.1	-172.2	50.6	170.2	170.7	167.5	0	110.1	D19 V23 D26 Y28 I52	D19-K21 WeakPolarHBondContact O-CG 3.08Å; D19-K21 PolarHBondContact O-N 2.93Å; K21-V23 PolarHBondContact O-N 2.65Å; K21-D26 IonicContact NZ-OD1 3.92Å; K21-Y28 HydrophobicContact CB-CD1 3.96Å; K21-Y28 HydrophobicContact CB-CE1 3.81Å; K21-Y28 HydrophobicContact CD-CE1 4.33Å; K21-I52 HydrophobicContact CD-CD1 4.15Å; K21-I52 HydrophobicContact CG-CD1 4.46Å
22	C	87	Confident	73.1	Confident	3 Å²	3	67.8 Å²	67.8	2%	0.02	35%	0.354	C	S	.	.	B	Isolated β-bridge	trans	-61.1	118.9	175.1	-171.8	0	0	0	0	110.9	I24 C25 D26 S27 Y62 C64 C67	C22-I24 PolarHBondContact O-N 3.48Å; C22-C25 PolarHBondContact SG-SG 3.03Å; C22-D26 WeakPolarHBondContact O-CA 2.81Å; C22-D26 PolarHBondContact O-N 3.1Å; C22-S27 WeakPolarHBondContact CB-O 3.46Å; C22-S27 PolarHBondContact N-O 3.13Å; C22-Y62 WeakPolarHBondContact CA-O 3.45Å; C22-C64 HydrophobicContact CB-CB 3.96Å; C22-C64 PolarHBondContact SG-N 3.23Å; C22-C64 VanDerWaalsContact SG-SG 3.63Å; C22-C67 VanDerWaalsContact SG-SG 3.63Å
23	V	86	Confident	73.7	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-19.2	-177.1	-68.5	0	0	0	0	114.4	K21 V35 V51 A61 Y62 Y63 P78	K21-V23 PolarHBondContact O-N 2.65Å; V23-V35 HydrophobicContact CB-CG2 4.3Å; V23-V35 HydrophobicContact CG1-CG1 4.33Å; V23-V35 HydrophobicContact CG1-CG2 3.68Å; V23-V35 HydrophobicContact CG2-CG2 3.63Å; V23-V51 HydrophobicContact CG1-CG2 3.66Å; V23-A61 HydrophobicContact CG1-CB 3.75Å; V23-Y62 PolarHBondContact N-O 3.12Å; V23-Y63 HydrophobicContact CG2-CD1 3.74Å; V23-Y63 HydrophobicContact CG2-CE1 3.4Å; V23-Y63 VanDerWaalsContact CG2-CE1 3.4Å; V23-Y63 HydrophobicContact CG2-CE2 4.45Å; V23-Y63 HydrophobicContact CG2-CG 4.39Å; V23-P78 HydrophobicContact CB-CB 4.12Å; V23-P78 HydrophobicContact CB-CG 4.33Å; V23-P78 HydrophobicContact CG2-CB 3.73Å; V23-P78 HydrophobicContact CG2-CG 3.84Å
24	I	87.8	Confident	74.7	Confident	40 Å²	40	60.1 Å²	60.1	21%	0.205	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-54	-177.7	-56	-55.7	0	0	0	111.7	C22 Y63 K72	C22-I24 PolarHBondContact O-N 3.48Å; I24-Y63 HydrophobicContact CD1-CE1 4.05Å; I24-Y63 HydrophobicContact CG1-CD1 3.83Å; I24-Y63 HydrophobicContact CG1-CE1 3.73Å; I24-K72 HydrophobicContact CG1-CB 4.39Å; I24-K72 HydrophobicContact CG2-CD 3.87Å
25	C	87.3	Confident	77	Confident	37 Å²	37	52 Å²	52	25%	0.25	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.5	1.8	-173.1	68.9	0	0	0	0	114.1	C22 S27 C64	C22-C25 PolarHBondContact SG-SG 3.03Å; C25-S27 PolarHBondContact O-N 3.1Å; C25-S27 VanDerWaalsContact O-N 3.12Å; C25-S27 WeakPolarHBondContact SG-CB 3.31Å; C25-C64 PolarHBondContact SG-SG 3.02Å
26	D	84	Confident	79.1	Confident	18 Å²	18	56.3 Å²	56.3	10%	0.096	30%	0.301	C	S	.	.			trans	59.3	15.5	-176.9	-64.6	-78.1	0	0	0	114.7	M1 A2 K3 K21 C22	M1-D26 PolarHBondContact N-OD1 2.94Å; M1-D26 PolarHBondContact N-OD2 3.29Å; A2-D26 PolarHBondContact N-OD1 2.98Å; A2-D26 PolarHBondContact N-OD2 3.38Å; K3-D26 PolarHBondContact N-OD2 3.45Å; K21-D26 IonicContact NZ-OD1 3.92Å; C22-D26 WeakPolarHBondContact O-CA 2.81Å; C22-D26 PolarHBondContact O-N 3.1Å
27	S	84.7	Confident	80.9	Confident	33 Å²	33	55.8 Å²	55.8	23%	0.231	29%	0.294	C	S	.	.			trans	-69.6	139.8	176.2	-179.9	0	0	0	0	112.3	C22 C25 V29	C22-S27 WeakPolarHBondContact CB-O 3.46Å; C22-S27 PolarHBondContact N-O 3.13Å; C25-S27 PolarHBondContact O-N 3.1Å; C25-S27 VanDerWaalsContact O-N 3.12Å; C25-S27 WeakPolarHBondContact SG-CB 3.31Å; S27-V29 VanDerWaalsContact OG-CG2 3.25Å; S27-V29 WeakPolarHBondContact OG-CG2 3.48Å; S27-V29 PolarHBondContact OG-N 3.43Å; S27-V29 PolarHBondContact OG-O 3.46Å
28	Y	83.4	Confident	83.1	Confident	176 Å²	176	52.4 Å²	52.4	69%	0.69	27%	0.274	S	S	*	.			trans	-94.7	-3.7	173.6	-64.9	-83.1	0	0	0	113.3	K21	K21-Y28 HydrophobicContact CB-CD1 3.96Å; K21-Y28 HydrophobicContact CB-CE1 3.81Å; K21-Y28 HydrophobicContact CD-CE1 4.33Å
29	V	86.2	Confident	84.6	Confident	97 Å²	97	58.9 Å²	58.9	59%	0.588	31%	0.306	S	S	*	.	S	Bend	trans	-109.2	148	-172.7	-62.7	0	0	0	0	111.7	S27	S27-V29 VanDerWaalsContact OG-CG2 3.25Å; S27-V29 WeakPolarHBondContact OG-CG2 3.48Å; S27-V29 PolarHBondContact OG-N 3.43Å; S27-V29 PolarHBondContact OG-O 3.46Å
30	R	89	Confident	85.9	Confident	174 Å²	174	63.9 Å²	63.9	66%	0.657	33%	0.329	S	S	*	.			trans	56	58.3	175	-60.2	175.3	159.2	178	-5.6	113.4	C64 K65	R30-C64 CarbonylContact O-C 3.58Å; R30-C64 VanDerWaalsContact O-CA 3.25Å; R30-C64 WeakPolarHBondContact O-CA 3.31Å; R30-K65 HydrophobicContact CB-CB 4.26Å; R30-K65 PolarHBondContact O-N 2.52Å
31	P	89.7	Confident	86.9	Confident	89 Å²	89	62.7 Å²	62.7	58%	0.578	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59.4	137.9	168.5	28.7	-34.2	0	0	0	109.5	Y62	P31-Y62 HydrophobicContact CB-CD1 4.17Å; P31-Y62 HydrophobicContact CB-CD2 4.31Å; P31-Y62 HydrophobicContact CB-CG 3.82Å
32	C	91.2	Very high	87.2	Confident	72 Å²	72	64.1 Å²	64.1	49%	0.486	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	-50.8	-175.2	-172.3	0	0	0	0	111.5	Y63 K65	C32-Y63 PolarHBondContact N-O 3.16Å; C32-K65 HydrophobicContact CB-CB 4.04Å
33	T	89.3	Confident	87.3	Confident	45 Å²	45	72.4 Å²	72.4	28%	0.276	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	134	-175.6	-54.5	0	0	0	0	109.9	Y62 Y63 T68	T33-Y62 CarbonylContact O-C 3.38Å; T33-Y62 WeakPolarHBondContact O-CA 3.47Å; T33-Y63 HydrophobicContact CG2-CD2 4.45Å; T33-Y63 PolarHBondContact N-O 2.83Å; T33-Y63 PolarHBondContact O-N 2.66Å; T33-T68 VanDerWaalsContact OG1-CG2 3.26Å; T33-T68 WeakPolarHBondContact OG1-CG2 2.82Å; T33-T68 PolarHBondContact OG1-OG1 2.89Å
34	L	88.2	Confident	87.5	Confident	68 Å²	68	74.1 Å²	74.1	36%	0.356	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	140.1	173.2	-86.6	162	0	0	0	111	D60 Y62	L34-D60 HydrophobicContact CD2-CB 4.09Å; L34-Y62 HydrophobicContact CD2-CD1 3.69Å; L34-Y62 HydrophobicContact CD2-CE1 3.08Å; L34-Y62 HydrophobicContact CD2-CE2 4.38Å; L34-Y62 VanDerWaalsContact CD2-CZ 3.46Å; L34-Y62 HydrophobicContact CG-CD1 3.89Å; L34-Y62 HydrophobicContact CG-CE1 3.47Å; L34-Y62 VanDerWaalsContact CG-CE1 3.47Å
35	V	87.6	Confident	87.5	Confident	0 Å²	0	76.3 Å²	76.3	0%	0	39%	0.393	C	S	.	.			trans	-71.8	147.4	178	164.9	0	0	0	0	111.6	G16 V17 V23 V51 A61 Y63 P78	G16-V35 CarbonylContact C-O 3.02Å; G16-V35 VanDerWaalsContact C-O 3.29Å; G16-V35 CarbonylContact O-C 3.36Å; V17-V35 WeakPolarHBondContact CA-O 3.46Å; V23-V35 HydrophobicContact CB-CG2 4.3Å; V23-V35 HydrophobicContact CG1-CG1 4.33Å; V23-V35 HydrophobicContact CG1-CG2 3.68Å; V23-V35 HydrophobicContact CG2-CG2 3.63Å; V35-V51 HydrophobicContact CG1-CG1 4.42Å; V35-A61 HydrophobicContact CB-CB 3.7Å; V35-A61 WeakPolarHBondContact CB-O 3.35Å; V35-A61 HydrophobicContact CG1-CB 4.26Å; V35-A61 HydrophobicContact CG2-CB 3.63Å; V35-A61 PolarHBondContact N-O 2.83Å; V35-Y63 HydrophobicContact CB-CE2 4.23Å; V35-Y63 HydrophobicContact CG2-CD2 3.7Å; V35-Y63 HydrophobicContact CG2-CE2 3.58Å; V35-Y63 HydrophobicContact CG2-CG 4.34Å; V35-P78 HydrophobicContact CG1-CG 3.53Å
36	R	85.7	Confident	87.4	Confident	138 Å²	138	80.9 Å²	80.9	52%	0.521	41%	0.406	S	S	.	.			trans	-129.5	112	-175.3	-65.7	-64.9	-174	165.5	-0.1	108.7	A15 G16 P78	A15-R36 WeakPolarHBondContact CA-O 3.26Å; A15-R36 HydrophobicContact CB-CB 3.09Å; A15-R36 HydrophobicContact CB-CG 4.42Å; A15-R36 WeakPolarHBondContact CB-O 2.97Å; A15-R36 WeakPolarHBondContact O-CB 3.43Å; G16-R36 CarbonylContact O-C 3.22Å; G16-R36 WeakPolarHBondContact O-CA 3.28Å; G16-R36 PolarHBondContact O-N 3.01Å; G16-R36 VanDerWaalsContact O-N 3.16Å; R36-P78 WeakPolarHBondContact O-CD 2.99Å
37	I	85.9	Confident	87.5	Confident	5 Å²	5	85.7 Å²	85.7	3%	0.026	43%	0.428	C	S	.	.			trans	-97.3	136	170.2	-55.8	-177.5	0	0	0	114.5	Q14 A15 G16 V17 C41 N42 V51 C77 K79	Q14-I37 CarbonylContact O-C 3.44Å; A15-I37 CarbonylContact C-O 3.53Å; A15-I37 VanDerWaalsContact CA-C 3.47Å; A15-I37 WeakPolarHBondContact CA-O 3.25Å; G16-I37 WeakPolarHBondContact CA-O 3.24Å; G16-I37 PolarHBondContact N-O 3.32Å; G16-I37 WeakPolarHBondContact O-CB 3.49Å; G16-I37 VanDerWaalsContact O-CG1 3.31Å; G16-I37 WeakPolarHBondContact O-CG1 3.47Å; G16-I37 PolarHBondContact O-N 3.48Å; V17-I37 WeakPolarHBondContact O-CD1 3.08Å; V17-I37 VanDerWaalsContact O-CG1 3.31Å; V17-I37 WeakPolarHBondContact O-CG1 3.34Å; I37-C41 HydrophobicContact CG2-CB 3.26Å; I37-N42 HydrophobicContact CG2-CB 4.26Å; I37-V51 HydrophobicContact CD1-CG1 3.29Å; I37-V51 HydrophobicContact CG1-CG1 3.55Å; I37-C77 VanDerWaalsContact CA-SG 3.53Å; I37-K79 HydrophobicContact CD1-CD 4.01Å; I37-K79 HydrophobicContact CG2-CB 4.41Å; I37-K79 HydrophobicContact CG2-CD 4.08Å
38	C	88.2	Confident	87.4	Confident	6 Å²	6	86.8 Å²	86.8	4%	0.041	44%	0.444	C	S	.	.			trans	-66.2	161	178.9	61.9	0	0	0	0	114.5	K13 Q14 E40 C41 N42 C77	K13-C38 HydrophobicContact CB-CB 3.47Å; K13-C38 VanDerWaalsContact CB-CB 3.47Å; Q14-C38 WeakPolarHBondContact O-CA 3.25Å; Q14-C38 WeakPolarHBondContact O-CB 3.46Å; Q14-C38 PolarHBondContact O-N 3.48Å; C38-E40 PolarHBondContact O-N 3.06Å; C38-C41 CarbonylContact O-C 3.19Å; C38-C41 PolarHBondContact O-N 3.06Å; C38-C41 WeakPolarHBondContact SG-CB 3.39Å; C38-C41 PolarHBondContact SG-N 2.82Å; C38-C41 PolarHBondContact SG-SG 3.45Å; C38-N42 PolarHBondContact O-N 3.33Å; C38-C77 HydrophobicContact CB-CB 4.23Å; C38-C77 PolarHBondContact N-SG 3.09Å; C38-C77 VanDerWaalsContact N-SG 3.38Å
39	D	87.6	Confident	87.5	Confident	143 Å²	143	83.2 Å²	83.2	77%	0.765	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-41.3	176.9	-61	-36.6	0	0	0	111.9	C41 N42 Y43	D39-C41 PolarHBondContact O-N 3.38Å; D39-N42 CarbonylContact O-C 3.56Å; D39-N42 PolarHBondContact O-N 3.31Å; D39-N42 VanDerWaalsContact O-N 3.09Å; D39-Y43 WeakPolarHBondContact O-CB 2.99Å; D39-Y43 PolarHBondContact O-N 3.42Å; D39-Y43 VanDerWaalsContact O-N 3.09Å
40	E	87.3	Confident	87.3	Confident	123 Å²	123	79 Å²	79	58%	0.575	40%	0.404	S	S	*	.	G	3₁₀ helix	trans	-64.1	-40	178.5	-169.6	179.7	139.4	0	0	112.8	K13 C38 N42	K13-E40 IonicContact NZ-OE1 2.85Å; K13-E40 PolarHBondContact NZ-OE1 3.24Å; K13-E40 IonicContact NZ-OE2 2.56Å; K13-E40 PolarHBondContact NZ-OE2 3.09Å; C38-E40 PolarHBondContact O-N 3.06Å; E40-N42 PolarHBondContact O-N 3.37Å
41	C	86.9	Confident	87.1	Confident	14 Å²	14	70.8 Å²	70.8	10%	0.095	37%	0.373	C	S	.	.	G	3₁₀ helix	trans	-78.4	-5.9	176.6	-78.5	0	0	0	0	113.3	I37 C38 D39 K79	I37-C41 HydrophobicContact CG2-CB 3.26Å; C38-C41 CarbonylContact O-C 3.19Å; C38-C41 PolarHBondContact O-N 3.06Å; C38-C41 WeakPolarHBondContact SG-CB 3.39Å; C38-C41 PolarHBondContact SG-N 2.82Å; C38-C41 PolarHBondContact SG-SG 3.45Å; D39-C41 PolarHBondContact O-N 3.38Å; C41-K79 HydrophobicContact CB-CB 4.13Å; C41-K79 HydrophobicContact CB-CD 3.93Å; C41-K79 HydrophobicContact CB-CG 4.11Å; C41-K79 WeakPolarHBondContact O-CE 3.34Å; C41-K79 PolarHBondContact O-NZ 3.34Å
42	N	87.7	Confident	86.7	Confident	65 Å²	65	67.3 Å²	67.3	35%	0.348	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-123.5	31.6	176.6	-165.6	38.6	0	0	0	111.9	I37 C38 D39 E40 Q47	I37-N42 HydrophobicContact CG2-CB 4.26Å; C38-N42 PolarHBondContact O-N 3.33Å; D39-N42 CarbonylContact O-C 3.56Å; D39-N42 PolarHBondContact O-N 3.31Å; D39-N42 VanDerWaalsContact O-N 3.09Å; E40-N42 PolarHBondContact O-N 3.37Å; N42-Q47 WeakPolarHBondContact O-CG 3.43Å; N42-Q47 PolarHBondContact O-NE2 2.85Å; N42-Q47 WeakPolarHBondContact OD1-CA 2.85Å
43	Y	89.6	Confident	86.1	Confident	178 Å²	178	66.5 Å²	66.5	70%	0.698	34%	0.344	S	S	*	.	S	Bend	trans	-107.2	138.9	179.3	-176.2	-103.8	0	0	0	112.4	D39 S45 Y46	D39-Y43 WeakPolarHBondContact O-CB 2.99Å; D39-Y43 PolarHBondContact O-N 3.42Å; D39-Y43 VanDerWaalsContact O-N 3.09Å; Y43-S45 PolarHBondContact O-N 3.31Å; Y43-Y46 WeakPolarHBondContact O-CB 3.32Å; Y43-Y46 PolarHBondContact O-N 3.23Å
44	G	90.8	Very high	85.8	Confident	36 Å²	36	65.9 Å²	65.9	37%	0.371	35%	0.347	S	S	.	.	G	3₁₀ helix	trans	54.2	-123.8	173.2	0	0	0	0	0	113.5	Y46 Q47	G44-Y46 PolarHBondContact O-N 3.45Å; G44-Y46 VanDerWaalsContact O-N 3.11Å; G44-Q47 VanDerWaalsContact O-CB 3.3Å; G44-Q47 WeakPolarHBondContact O-CB 3.21Å; G44-Q47 WeakPolarHBondContact O-CG 3.46Å; G44-Q47 PolarHBondContact O-N 2.56Å; G44-Q47 VanDerWaalsContact O-N 3.11Å
45	S	86.6	Confident	85.5	Confident	86 Å²	86	63.7 Å²	63.7	60%	0.601	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	-66.8	-10.7	-178	65.2	0	0	0	0	114.4	Y43 R49	Y43-S45 PolarHBondContact O-N 3.31Å; S45-R49 PolarHBondContact O-NE 2.84Å; S45-R49 PolarHBondContact O-NH2 2.64Å
46	Y	85.3	Confident	85.2	Confident	133 Å²	133	69.3 Å²	69.3	52%	0.522	38%	0.377	S	S	.	.	G	3₁₀ helix	trans	-88.4	-6.2	175.6	-65.3	-83.1	0	0	0	114	Y43 G44 R49 K79	Y43-Y46 WeakPolarHBondContact O-CB 3.32Å; Y43-Y46 PolarHBondContact O-N 3.23Å; G44-Y46 PolarHBondContact O-N 3.45Å; G44-Y46 VanDerWaalsContact O-N 3.11Å; Y46-R49 WeakPolarHBondContact O-CB 3.32Å; Y46-R49 PolarHBondContact O-N 3.5Å; Y46-K79 PolarHBondContact O-NZ 3.11Å
47	Q	87.1	Confident	85	Confident	119 Å²	119	64.4 Å²	64.4	56%	0.556	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	141.1	176.4	-74.9	176.7	-11.7	0	0	111.9	N42 G44 R49	N42-Q47 WeakPolarHBondContact O-CG 3.43Å; N42-Q47 PolarHBondContact O-NE2 2.85Å; N42-Q47 WeakPolarHBondContact OD1-CA 2.85Å; G44-Q47 VanDerWaalsContact O-CB 3.3Å; G44-Q47 WeakPolarHBondContact O-CB 3.21Å; G44-Q47 WeakPolarHBondContact O-CG 3.46Å; G44-Q47 PolarHBondContact O-N 2.56Å; G44-Q47 VanDerWaalsContact O-N 3.11Å; Q47-R49 PolarHBondContact O-N 3.3Å; Q47-R49 VanDerWaalsContact O-N 3.08Å
48	G	81.8	Confident	84.6	Confident	56 Å²	56	70.6 Å²	70.6	58%	0.577	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.9	22.3	178.2	0	0	0	0	0	113.5	G57	G48-G57 WeakPolarHBondContact O-CA 3.39Å; G48-G57 PolarHBondContact O-N 2.69Å
49	R	85.3	Confident	84.2	Confident	100 Å²	100	73.2 Å²	73.2	38%	0.377	43%	0.425	S	S	.	.	B	Isolated β-bridge	trans	-95.9	141.6	177.2	-68.5	-167.2	-178.6	-144.3	9.8	112.6	S45 Y46 Q47 V51 G54 G55 K79	S45-R49 PolarHBondContact O-NE 2.84Å; S45-R49 PolarHBondContact O-NH2 2.64Å; Y46-R49 WeakPolarHBondContact O-CB 3.32Å; Y46-R49 PolarHBondContact O-N 3.5Å; Q47-R49 PolarHBondContact O-N 3.3Å; Q47-R49 VanDerWaalsContact O-N 3.08Å; R49-V51 PolarHBondContact O-N 3.21Å; R49-G54 WeakPolarHBondContact CD-O 3.2Å; R49-G54 PolarHBondContact NH1-O 3.41Å; R49-G55 CarbonylContact C-O 3.29Å; R49-G55 VanDerWaalsContact CA-O 3.24Å; R49-G55 WeakPolarHBondContact CA-O 3.35Å; R49-K79 PolarHBondContact O-NZ 3.48Å
50	C	82.8	Confident	83.8	Confident	9 Å²	9	70.2 Å²	70.2	6%	0.061	41%	0.409	C	S	.	.			trans	-53	129.6	176.4	175.5	0	0	0	0	112.8	D19 I52 C53 G54 G55	D19-C50 WeakPolarHBondContact OD2-CA 3.22Å; D19-C50 WeakPolarHBondContact OD2-CB 2.93Å; D19-C50 PolarHBondContact OD2-SG 3.18Å; C50-I52 PolarHBondContact O-N 3.07Å; C50-I52 PolarHBondContact SG-N 3.46Å; C50-I52 VanDerWaalsContact SG-N 3.39Å; C50-C53 WeakPolarHBondContact CB-SG 3.46Å; C50-C53 PolarHBondContact SG-N 3.29Å; C50-C53 PolarHBondContact SG-SG 3.11Å; C50-G54 WeakPolarHBondContact O-CA 3.24Å; C50-G54 PolarHBondContact O-N 3.08Å; C50-G55 PolarHBondContact N-O 3.29Å
51	V	84.3	Confident	83.7	Confident	1 Å²	1	64.3 Å²	64.3	1%	0.006	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-27.8	179.1	-75	0	0	0	0	114.2	V23 V35 I37 R49 A61 K79 I80	V23-V51 HydrophobicContact CG1-CG2 3.66Å; V35-V51 HydrophobicContact CG1-CG1 4.42Å; I37-V51 HydrophobicContact CD1-CG1 3.29Å; I37-V51 HydrophobicContact CG1-CG1 3.55Å; R49-V51 PolarHBondContact O-N 3.21Å; V51-A61 HydrophobicContact CG2-CB 4.38Å; V51-K79 HydrophobicContact CG1-CD 4.44Å; V51-I80 PolarHBondContact O-N 3.11Å
52	I	82.1	Confident	83.7	Confident	16 Å²	16	67.2 Å²	67.2	8%	0.082	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.6	-44.3	-175.7	-68.7	155.2	0	0	0	111.5	M1 K21 C50 I80	M1-I52 HydrophobicContact CB-CG2 4.12Å; K21-I52 HydrophobicContact CD-CD1 4.15Å; K21-I52 HydrophobicContact CG-CD1 4.46Å; C50-I52 PolarHBondContact O-N 3.07Å; C50-I52 PolarHBondContact SG-N 3.46Å; C50-I52 VanDerWaalsContact SG-N 3.39Å; I52-I80 HydrophobicContact CB-CD1 4.32Å; I52-I80 HydrophobicContact CG1-CD1 4.36Å; I52-I80 HydrophobicContact CG2-CD1 4.13Å
53	C	79.1	Confident	83.8	Confident	56 Å²	56	64.3 Å²	64.3	38%	0.378	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.1	-16.4	-169.8	85.1	0	0	0	0	114.3	C50 G55 K87	C50-C53 WeakPolarHBondContact CB-SG 3.46Å; C50-C53 PolarHBondContact SG-N 3.29Å; C50-C53 PolarHBondContact SG-SG 3.11Å; C53-G55 PolarHBondContact O-N 3.26Å; C53-G55 PolarHBondContact SG-N 3.4Å; C53-G55 VanDerWaalsContact SG-N 3.35Å; C53-K87 PolarHBondContact O-NZ 3.31Å
54	G	81.3	Confident	84	Confident	32 Å²	32	56 Å²	56	33%	0.33	34%	0.344	S	S	.	.			trans	72.3	6.2	-177.6	0	0	0	0	0	115.5	R49 C50	R49-G54 WeakPolarHBondContact CD-O 3.2Å; R49-G54 PolarHBondContact NH1-O 3.41Å; C50-G54 WeakPolarHBondContact O-CA 3.24Å; C50-G54 PolarHBondContact O-N 3.08Å
55	G	82.1	Confident	84.1	Confident	22 Å²	22	59.8 Å²	59.8	23%	0.227	35%	0.35	C	S	.	.	S	Bend	trans	-80.6	-177.2	171.2	0	0	0	0	0	112.8	R49 C50 C53 G57	R49-G55 CarbonylContact C-O 3.29Å; R49-G55 VanDerWaalsContact CA-O 3.24Å; R49-G55 WeakPolarHBondContact CA-O 3.35Å; C50-G55 PolarHBondContact N-O 3.29Å; C53-G55 PolarHBondContact O-N 3.26Å; C53-G55 PolarHBondContact SG-N 3.4Å; C53-G55 VanDerWaalsContact SG-N 3.35Å; G55-G57 PolarHBondContact O-N 3.18Å
56	P	81.9	Confident	84.5	Confident	118 Å²	118	61.2 Å²	61.2	77%	0.766	35%	0.347	S	S	*	.	B	Isolated β-bridge	trans	-61.8	127.8	173.7	26.6	-32.9	0	0	0	110.2
57	G	80.6	Confident	84.8	Confident	35 Å²	35	55 Å²	55	36%	0.361	32%	0.323	S	S	.	.			trans	-77.3	144.2	175.8	0	0	0	0	0	110.8	D19 G48 G55	D19-G57 WeakPolarHBondContact OD1-CA 3.3Å; G48-G57 WeakPolarHBondContact O-CA 3.39Å; G48-G57 PolarHBondContact O-N 2.69Å; G55-G57 PolarHBondContact O-N 3.18Å
58	V	79.3	Confident	85.1	Confident	135 Å²	135	50.7 Å²	50.7	82%	0.818	31%	0.305	S	S	*	.			trans	-123.4	-28.5	-173.6	-178.4	0	0	0	0	112.1	D19	D19-V58 PolarHBondContact OD1-N 3.21Å
59	S	77.8	Confident	85.7	Confident	60 Å²	60	54 Å²	54	42%	0.42	31%	0.308	S	S	.	.	S	Bend	trans	-136.1	169.1	-176.1	53.2	0	0	0	0	109.6	G18 D19 G20	G18-S59 CarbonylContact C-O 3.2Å; G18-S59 CarbonylContact O-C 3.52Å; D19-S59 VanDerWaalsContact CA-O 3.24Å; D19-S59 WeakPolarHBondContact CA-O 3.22Å; D19-S59 PolarHBondContact OD1-N 2.86Å; G20-S59 WeakPolarHBondContact CA-OG 3.25Å; G20-S59 PolarHBondContact N-OG 2.95Å
60	D	79.5	Confident	86.2	Confident	80 Å²	80	54.7 Å²	54.7	43%	0.428	32%	0.315	S	S	.	.			trans	-83	138.6	173.8	-68.4	-22.4	0	0	0	111.7	V17 G18 D19 G20 L34 Y62	V17-D60 HydrophobicContact CG1-CB 4.21Å; V17-D60 WeakPolarHBondContact CG1-OD1 2.94Å; G18-D60 CarbonylContact O-C 3.41Å; G18-D60 WeakPolarHBondContact O-CA 3.43Å; D19-D60 CarbonylContact C-O 2.96Å; G20-D60 WeakPolarHBondContact CA-O 3.5Å; G20-D60 PolarHBondContact N-O 2.95Å; L34-D60 HydrophobicContact CD2-CB 4.09Å; D60-Y62 HydrophobicContact CB-CE2 3.94Å; D60-Y62 VanDerWaalsContact O-CD2 3.22Å; D60-Y62 WeakPolarHBondContact O-CD2 3.17Å; D60-Y62 WeakPolarHBondContact O-CE2 3.38Å
61	A	85	Confident	86.7	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	34%	0.335	C	S	.	.			trans	-92.8	156.4	177.5	0	0	0	0	0	110.8	G18 D19 V23 V35 V51	G18-A61 VanDerWaalsContact C-CA 3.49Å; G18-A61 VanDerWaalsContact CA-CB 3.49Å; G18-A61 PolarHBondContact O-N 3.25Å; D19-A61 VanDerWaalsContact C-CB 3.5Å; V23-A61 HydrophobicContact CG1-CB 3.75Å; V35-A61 HydrophobicContact CB-CB 3.7Å; V35-A61 WeakPolarHBondContact CB-O 3.35Å; V35-A61 HydrophobicContact CG1-CB 4.26Å; V35-A61 HydrophobicContact CG2-CB 3.63Å; V35-A61 PolarHBondContact N-O 2.83Å; V51-A61 HydrophobicContact CG2-CB 4.38Å
62	Y	88.3	Confident	86.9	Confident	75 Å²	75	62.5 Å²	62.5	29%	0.294	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	161.6	-178.4	-59.3	-89.9	0	0	0	110.1	C22 V23 P31 T33 L34 D60	C22-Y62 WeakPolarHBondContact CA-O 3.45Å; V23-Y62 PolarHBondContact N-O 3.12Å; P31-Y62 HydrophobicContact CB-CD1 4.17Å; P31-Y62 HydrophobicContact CB-CD2 4.31Å; P31-Y62 HydrophobicContact CB-CG 3.82Å; T33-Y62 CarbonylContact O-C 3.38Å; T33-Y62 WeakPolarHBondContact O-CA 3.47Å; L34-Y62 HydrophobicContact CD2-CD1 3.69Å; L34-Y62 HydrophobicContact CD2-CE1 3.08Å; L34-Y62 HydrophobicContact CD2-CE2 4.38Å; L34-Y62 VanDerWaalsContact CD2-CZ 3.46Å; L34-Y62 HydrophobicContact CG-CD1 3.89Å; L34-Y62 HydrophobicContact CG-CE1 3.47Å; L34-Y62 VanDerWaalsContact CG-CE1 3.47Å; D60-Y62 HydrophobicContact CB-CE2 3.94Å; D60-Y62 VanDerWaalsContact O-CD2 3.22Å; D60-Y62 WeakPolarHBondContact O-CD2 3.17Å; D60-Y62 WeakPolarHBondContact O-CE2 3.38Å
63	Y	90.2	Very high	87.2	Confident	4 Å²	4	63.5 Å²	63.5	2%	0.016	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	135.8	156.6	-63.3	-90.1	0	0	0	107.4	V23 I24 C32 T33 V35 D73 P78	V23-Y63 HydrophobicContact CG2-CD1 3.74Å; V23-Y63 HydrophobicContact CG2-CE1 3.4Å; V23-Y63 VanDerWaalsContact CG2-CE1 3.4Å; V23-Y63 HydrophobicContact CG2-CE2 4.45Å; V23-Y63 HydrophobicContact CG2-CG 4.39Å; I24-Y63 HydrophobicContact CD1-CE1 4.05Å; I24-Y63 HydrophobicContact CG1-CD1 3.83Å; I24-Y63 HydrophobicContact CG1-CE1 3.73Å; C32-Y63 PolarHBondContact N-O 3.16Å; T33-Y63 HydrophobicContact CG2-CD2 4.45Å; T33-Y63 PolarHBondContact N-O 2.83Å; T33-Y63 PolarHBondContact O-N 2.66Å; V35-Y63 HydrophobicContact CB-CE2 4.23Å; V35-Y63 HydrophobicContact CG2-CD2 3.7Å; V35-Y63 HydrophobicContact CG2-CE2 3.58Å; V35-Y63 HydrophobicContact CG2-CG 4.34Å; Y63-D73 HydrophobicContact CD1-CB 3.91Å; Y63-D73 HydrophobicContact CD2-CB 3.61Å; Y63-D73 HydrophobicContact CE1-CB 4.11Å; Y63-D73 HydrophobicContact CE2-CB 3.82Å; Y63-D73 HydrophobicContact CG-CB 3.65Å; Y63-P78 VanDerWaalsContact OH-CG 3.32Å; Y63-P78 WeakPolarHBondContact OH-CG 3.45Å
64	C	92.9	Very high	87.7	Confident	4 Å²	4	69.1 Å²	69.1	3%	0.027	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	161.5	172.5	71.9	0	0	0	0	110.6	C22 C25 R30 E66 C67 T68	C22-C64 HydrophobicContact CB-CB 3.96Å; C22-C64 PolarHBondContact SG-N 3.23Å; C22-C64 VanDerWaalsContact SG-SG 3.63Å; C25-C64 PolarHBondContact SG-SG 3.02Å; R30-C64 CarbonylContact O-C 3.58Å; R30-C64 VanDerWaalsContact O-CA 3.25Å; R30-C64 WeakPolarHBondContact O-CA 3.31Å; C64-E66 PolarHBondContact O-N 2.77Å; C64-C67 PolarHBondContact O-N 2.88Å; C64-C67 VanDerWaalsContact O-N 3.11Å; C64-T68 PolarHBondContact O-N 3.23Å; C64-T68 PolarHBondContact O-OG1 2.91Å
65	K	93.8	Very high	88	Confident	114 Å²	114	72.3 Å²	72.3	50%	0.496	38%	0.378	S	S	.	.	H	α-helix	trans	-53.6	-40.5	179.6	-170	172.1	-175.9	175.1	0	112.9	R30 C32 T68 I69	R30-K65 HydrophobicContact CB-CB 4.26Å; R30-K65 PolarHBondContact O-N 2.52Å; C32-K65 HydrophobicContact CB-CB 4.04Å; K65-T68 PolarHBondContact O-N 2.73Å; K65-I69 HydrophobicContact CG-CD1 3.93Å; K65-I69 VanDerWaalsContact O-CG1 3.25Å; K65-I69 WeakPolarHBondContact O-CG1 3.33Å; K65-I69 PolarHBondContact O-N 3.36Å
66	E	94	Very high	88.2	Confident	117 Å²	117	72 Å²	72	55%	0.547	38%	0.376	S	S	.	.	H	α-helix	trans	-65.7	-41.7	179	-66.9	170.2	-174	0	0	112.6	C64 T68 I69 Q70	C64-E66 PolarHBondContact O-N 2.77Å; E66-T68 VanDerWaalsContact C-N 3.29Å; E66-T68 PolarHBondContact O-N 2.8Å; E66-I69 PolarHBondContact O-N 3.41Å; E66-Q70 WeakPolarHBondContact O-CG 3.48Å; E66-Q70 PolarHBondContact O-N 3.39Å; E66-Q70 VanDerWaalsContact O-N 3.1Å
67	C	92.5	Very high	88.5	Confident	3 Å²	3	66.5 Å²	66.5	2%	0.02	34%	0.339	C	S	.	.	H	α-helix	trans	-68.1	-33.5	177	-70.2	0	0	0	0	111.7	C22 C64 Q70 E71 K72	C22-C67 VanDerWaalsContact SG-SG 3.63Å; C64-C67 PolarHBondContact O-N 2.88Å; C64-C67 VanDerWaalsContact O-N 3.11Å; C67-Q70 CarbonylContact O-C 3.4Å; C67-Q70 PolarHBondContact O-N 3.18Å; C67-E71 PolarHBondContact O-N 3.3Å; C67-K72 HydrophobicContact CB-CB 4.36Å; C67-K72 WeakPolarHBondContact O-CB 3.39Å; C67-K72 PolarHBondContact O-N 2.81Å
68	T	92.8	Very high	88.9	Confident	28 Å²	28	65 Å²	65	17%	0.172	32%	0.323	C	S	.	.	H	α-helix	trans	-69.8	-41.7	176.4	-49	0	0	0	0	111.4	T33 C64 K65 E66 Q70 E71	T33-T68 VanDerWaalsContact OG1-CG2 3.26Å; T33-T68 WeakPolarHBondContact OG1-CG2 2.82Å; T33-T68 PolarHBondContact OG1-OG1 2.89Å; C64-T68 PolarHBondContact O-N 3.23Å; C64-T68 PolarHBondContact O-OG1 2.91Å; K65-T68 PolarHBondContact O-N 2.73Å; E66-T68 VanDerWaalsContact C-N 3.29Å; E66-T68 PolarHBondContact O-N 2.8Å; T68-Q70 PolarHBondContact O-N 3.02Å; T68-E71 WeakPolarHBondContact O-CA 3.43Å; T68-E71 PolarHBondContact O-N 3.41Å
69	I	95.1	Very high	89.3	Confident	124 Å²	124	59.1 Å²	59.1	64%	0.636	29%	0.287	S	S	*	.	H	α-helix	trans	-63.7	-34	175.7	-69.6	164	0	0	0	111.3	K65 E66 E71	K65-I69 HydrophobicContact CG-CD1 3.93Å; K65-I69 VanDerWaalsContact O-CG1 3.25Å; K65-I69 WeakPolarHBondContact O-CG1 3.33Å; K65-I69 PolarHBondContact O-N 3.36Å; E66-I69 PolarHBondContact O-N 3.41Å; I69-E71 PolarHBondContact O-N 3.23Å
70	Q	94.6	Very high	89.7	Confident	115 Å²	115	57.2 Å²	57.2	54%	0.537	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	7.1	174.3	-67.4	176.4	3.2	0	0	113.2	E66 C67 T68 K72	E66-Q70 WeakPolarHBondContact O-CG 3.48Å; E66-Q70 PolarHBondContact O-N 3.39Å; E66-Q70 VanDerWaalsContact O-N 3.1Å; C67-Q70 CarbonylContact O-C 3.4Å; C67-Q70 PolarHBondContact O-N 3.18Å; T68-Q70 PolarHBondContact O-N 3.02Å; Q70-K72 HydrophobicContact CB-CD 4.35Å; Q70-K72 HydrophobicContact CB-CG 4.02Å; Q70-K72 PolarHBondContact O-N 3.02Å; Q70-K72 VanDerWaalsContact O-N 3.1Å
71	E	93	Very high	90.1	Very high	102 Å²	102	57.8 Å²	57.8	48%	0.477	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.8	19.7	-179.9	-51.5	-162.9	143.7	0	0	115.3	C67 T68 I69 D73 R74	C67-E71 PolarHBondContact O-N 3.3Å; T68-E71 WeakPolarHBondContact O-CA 3.43Å; T68-E71 PolarHBondContact O-N 3.41Å; I69-E71 PolarHBondContact O-N 3.23Å; E71-D73 PolarHBondContact O-N 3.21Å; E71-R74 WeakPolarHBondContact O-CB 3.24Å; E71-R74 PolarHBondContact O-N 2.91Å; E71-R74 IonicContact OE1-CZ 3.3Å; E71-R74 VanDerWaalsContact OE1-CZ 3.3Å; E71-R74 IonicContact OE1-NH1 2.72Å; E71-R74 PolarHBondContact OE1-NH1 3.07Å; E71-R74 IonicContact OE1-NH2 3.5Å; E71-R74 PolarHBondContact OE1-NH2 2.72Å; E71-R74 IonicContact OE2-NH1 3.42Å; E71-R74 PolarHBondContact OE2-NH1 2.79Å
72	K	89.4	Confident	90.1	Very high	73 Å²	73	60.1 Å²	60.1	32%	0.317	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-70.9	-14.1	-179.7	-62	-174	175.4	163.7	0	113.5	I24 C67 Q70 R74	I24-K72 HydrophobicContact CG1-CB 4.39Å; I24-K72 HydrophobicContact CG2-CD 3.87Å; C67-K72 HydrophobicContact CB-CB 4.36Å; C67-K72 WeakPolarHBondContact O-CB 3.39Å; C67-K72 PolarHBondContact O-N 2.81Å; Q70-K72 HydrophobicContact CB-CD 4.35Å; Q70-K72 HydrophobicContact CB-CG 4.02Å; Q70-K72 PolarHBondContact O-N 3.02Å; Q70-K72 VanDerWaalsContact O-N 3.1Å; K72-R74 PolarHBondContact O-N 2.63Å
73	D	88.8	Confident	89.6	Confident	37 Å²	37	62.2 Å²	62.2	20%	0.198	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-73.4	-11.4	171	61.6	-49.1	0	0	0	112.9	Y63 E71	Y63-D73 HydrophobicContact CD1-CB 3.91Å; Y63-D73 HydrophobicContact CD2-CB 3.61Å; Y63-D73 HydrophobicContact CE1-CB 4.11Å; Y63-D73 HydrophobicContact CE2-CB 3.82Å; Y63-D73 HydrophobicContact CG-CB 3.65Å; E71-D73 PolarHBondContact O-N 3.21Å
74	R	88.8	Confident	89.3	Confident	173 Å²	173	62.6 Å²	62.6	65%	0.653	31%	0.311	S	S	*	.	G	3₁₀ helix	trans	-96.6	-4.4	179.3	-56	-173.5	-178.5	163	6.4	114.4	E71 K72 G76	E71-R74 WeakPolarHBondContact O-CB 3.24Å; E71-R74 PolarHBondContact O-N 2.91Å; E71-R74 IonicContact OE1-CZ 3.3Å; E71-R74 VanDerWaalsContact OE1-CZ 3.3Å; E71-R74 IonicContact OE1-NH1 2.72Å; E71-R74 PolarHBondContact OE1-NH1 3.07Å; E71-R74 IonicContact OE1-NH2 3.5Å; E71-R74 PolarHBondContact OE1-NH2 2.72Å; E71-R74 IonicContact OE2-NH1 3.42Å; E71-R74 PolarHBondContact OE2-NH1 2.79Å; K72-R74 PolarHBondContact O-N 2.63Å; R74-G76 PolarHBondContact O-N 3.24Å; R74-G76 VanDerWaalsContact O-N 3.13Å
75	D	86.9	Confident	88.9	Confident	99 Å²	99	64.8 Å²	64.8	53%	0.529	33%	0.327	S	S	.	.	S	Bend	trans	-69.8	-6.1	-179.2	-68.8	-27.2	0	0	0	113.9
76	G	86.7	Confident	88.5	Confident	17 Å²	17	61.7 Å²	61.7	18%	0.175	32%	0.319	C	S	.	.			trans	97.1	-156.4	-177.4	0	0	0	0	0	113.2	K13 R74 P78	K13-G76 CarbonylContact O-C 3.6Å; K13-G76 VanDerWaalsContact O-CA 3.24Å; K13-G76 WeakPolarHBondContact O-CA 3.37Å; R74-G76 PolarHBondContact O-N 3.24Å; R74-G76 VanDerWaalsContact O-N 3.13Å; G76-P78 WeakPolarHBondContact O-CD 3.4Å
77	C	88.3	Confident	87.9	Confident	1 Å²	1	60.4 Å²	60.4	1%	0.007	31%	0.312	C	S	.	.			trans	-67.1	116.1	-168.1	172.8	0	0	0	0	110.6	C11 R12 K13 I37 C38 K79	C11-C77 HydrophobicContact CB-CB 4.07Å; C11-C77 PolarHBondContact N-O 3.17Å; R12-C77 PolarHBondContact N-O 3.27Å; K13-C77 HydrophobicContact CB-CB 4.36Å; K13-C77 WeakPolarHBondContact O-CA 3.12Å; K13-C77 VanDerWaalsContact O-CB 3.28Å; K13-C77 WeakPolarHBondContact O-CB 3.44Å; K13-C77 PolarHBondContact O-N 2.93Å; I37-C77 VanDerWaalsContact CA-SG 3.53Å; C38-C77 HydrophobicContact CB-CB 4.23Å; C38-C77 PolarHBondContact N-SG 3.09Å; C38-C77 VanDerWaalsContact N-SG 3.38Å; C77-K79 PolarHBondContact O-N 3.44Å; C77-K79 VanDerWaalsContact SG-CB 3.52Å
78	P	88.3	Confident	87.6	Confident	4 Å²	4	62.8 Å²	62.8	3%	0.026	33%	0.326	C	S	.	.			trans	-86.7	19	-177.2	38.1	-37.5	0	0	0	112.2	F10 V23 V35 R36 Y63 G76	F10-P78 HydrophobicContact CD1-CB 4.46Å; F10-P78 WeakPolarHBondContact CD1-O 2.93Å; V23-P78 HydrophobicContact CB-CB 4.12Å; V23-P78 HydrophobicContact CB-CG 4.33Å; V23-P78 HydrophobicContact CG2-CB 3.73Å; V23-P78 HydrophobicContact CG2-CG 3.84Å; V35-P78 HydrophobicContact CG1-CG 3.53Å; R36-P78 WeakPolarHBondContact O-CD 2.99Å; Y63-P78 VanDerWaalsContact OH-CG 3.32Å; Y63-P78 WeakPolarHBondContact OH-CG 3.45Å; G76-P78 WeakPolarHBondContact O-CD 3.4Å
79	K	87.9	Confident	87.2	Confident	12 Å²	12	65.8 Å²	65.8	5%	0.052	34%	0.341	C	S	.	.			trans	-73.7	129.6	177.3	-172.2	123.1	168.2	-170.9	0	109.5	C11 I37 C41 Y46 R49 V51 C77	C11-K79 HydrophobicContact CB-CB 4.5Å; C11-K79 WeakPolarHBondContact CB-O 3.39Å; C11-K79 PolarHBondContact N-O 3.35Å; I37-K79 HydrophobicContact CD1-CD 4.01Å; I37-K79 HydrophobicContact CG2-CB 4.41Å; I37-K79 HydrophobicContact CG2-CD 4.08Å; C41-K79 HydrophobicContact CB-CB 4.13Å; C41-K79 HydrophobicContact CB-CD 3.93Å; C41-K79 HydrophobicContact CB-CG 4.11Å; C41-K79 WeakPolarHBondContact O-CE 3.34Å; C41-K79 PolarHBondContact O-NZ 3.34Å; Y46-K79 PolarHBondContact O-NZ 3.11Å; R49-K79 PolarHBondContact O-NZ 3.48Å; V51-K79 HydrophobicContact CG1-CD 4.44Å; C77-K79 PolarHBondContact O-N 3.44Å; C77-K79 VanDerWaalsContact SG-CB 3.52Å
80	I	87.1	Confident	86.8	Confident	19 Å²	19	63.7 Å²	63.7	10%	0.097	33%	0.331	C	S	.	.	B	Isolated β-bridge	trans	-79.9	126.7	176.6	-57.2	-176.3	0	0	0	108.9	A2 L8 I9 F10 V51 I52 N82	A2-I80 HydrophobicContact CB-CD1 3.98Å; L8-I80 HydrophobicContact CB-CD1 4.32Å; L8-I80 HydrophobicContact CB-CG2 4.18Å; L8-I80 HydrophobicContact CD1-CD1 3.93Å; L8-I80 HydrophobicContact CD2-CG2 4.02Å; I9-I80 WeakPolarHBondContact O-CA 3.47Å; F10-I80 HydrophobicContact CD1-CG1 4.09Å; F10-I80 HydrophobicContact CE1-CD1 4.38Å; F10-I80 HydrophobicContact CE1-CG1 3.96Å; V51-I80 PolarHBondContact O-N 3.11Å; I52-I80 HydrophobicContact CB-CD1 4.32Å; I52-I80 HydrophobicContact CG1-CD1 4.36Å; I52-I80 HydrophobicContact CG2-CD1 4.13Å; I80-N82 WeakPolarHBondContact CG2-O 3.4Å
81	V	87.5	Confident	86.3	Confident	93 Å²	93	63.1 Å²	63.1	56%	0.564	33%	0.327	S	S	*	.			trans	-95.4	-24.9	-174.9	-64.2	0	0	0	0	113.4	I9 C11	I9-V81 HydrophobicContact CB-CG2 4.09Å; I9-V81 HydrophobicContact CG2-CG2 4.05Å; I9-V81 WeakPolarHBondContact O-CG2 3.35Å; I9-V81 PolarHBondContact O-N 2.91Å; C11-V81 HydrophobicContact CB-CG1 4.01Å
82	N	85.2	Confident	85.9	Confident	49 Å²	49	65.7 Å²	65.7	26%	0.262	33%	0.333	S	S	.	.	S	Bend	trans	-105.3	155.6	-179.4	70.4	-41.4	0	0	0	112.3	D7 I9 I80	D7-N82 PolarHBondContact O-ND2 2.74Å; I9-N82 PolarHBondContact N-OD1 2.76Å; I80-N82 WeakPolarHBondContact CG2-O 3.4Å
83	L	78.3	Confident	85.8	Confident	119 Å²	119	68.1 Å²	68.1	62%	0.623	35%	0.346	S	S	*	.			trans	-80.8	-13.6	-174.4	-136.2	87	0	0	0	114.1	K87	L83-K87 HydrophobicContact CD2-CB 4.49Å; L83-K87 HydrophobicContact CG-CD 4.34Å; L83-K87 WeakPolarHBondContact O-CB 3.38Å
84	G	83.8	Confident	85.5	Confident	11 Å²	11	75.2 Å²	75.2	11%	0.113	37%	0.37	C	S	.	.			trans	70	145.8	-177.1	0	0	0	0	0	114.4	D7 S86 K87 T88	D7-G84 WeakPolarHBondContact OD2-CA 3.46Å; G84-S86 PolarHBondContact O-N 2.96Å; G84-K87 PolarHBondContact O-N 3.13Å; G84-T88 PolarHBondContact O-N 2.73Å
85	S	84.8	Confident	85.1	Confident	51 Å²	51	71.9 Å²	71.9	36%	0.357	36%	0.36	S	S	.	.	H	α-helix	trans	-55.6	-44.2	179.2	50.7	0	0	0	0	112.8	D7 K87 T88 D89	D7-S85 WeakPolarHBondContact OD2-CB 3.14Å; D7-S85 PolarHBondContact OD2-N 2.99Å; D7-S85 PolarHBondContact OD2-OG 2.91Å; S85-K87 VanDerWaalsContact C-N 3.28Å; S85-K87 PolarHBondContact O-N 3.21Å; S85-T88 WeakPolarHBondContact CA-OG1 3.34Å; S85-T88 PolarHBondContact O-N 2.89Å; S85-T88 VanDerWaalsContact O-N 3.09Å; S85-T88 PolarHBondContact O-OG1 3.41Å; S85-D89 PolarHBondContact O-N 3.09Å
86	S	84.3	Confident	84.6	Confident	48 Å²	48	74.8 Å²	74.8	34%	0.336	37%	0.368	S	S	.	.	H	α-helix	trans	-64.9	-30.1	-175.5	-52.3	0	0	0	0	113.8	H5 G84 L90	H5-S86 VanDerWaalsContact CE1-CB 3.46Å; H5-S86 WeakPolarHBondContact CE1-CB 3.39Å; H5-S86 PolarHBondContact CE1-OG 3.23Å; H5-S86 PolarHBondContact ND1-OG 2.72Å; G84-S86 PolarHBondContact O-N 2.96Å; S86-L90 WeakPolarHBondContact O-CB 3.43Å; S86-L90 PolarHBondContact O-N 3.37Å
87	K	82.4	Confident	83.9	Confident	91 Å²	91	83 Å²	83	40%	0.396	40%	0.395	S	S	.	.	H	α-helix	trans	-77.2	-36.9	173.8	-86.3	-176.7	175.3	175.1	0	112	C53 L83 G84 S85 F91	C53-K87 PolarHBondContact O-NZ 3.31Å; L83-K87 HydrophobicContact CD2-CB 4.49Å; L83-K87 HydrophobicContact CG-CD 4.34Å; L83-K87 WeakPolarHBondContact O-CB 3.38Å; G84-K87 PolarHBondContact O-N 3.13Å; S85-K87 VanDerWaalsContact C-N 3.28Å; S85-K87 PolarHBondContact O-N 3.21Å; K87-F91 PolarHBondContact O-N 3.36Å; K87-F91 VanDerWaalsContact O-N 3.13Å
88	T	84.8	Confident	82.8	Confident	53 Å²	53	85 Å²	85	33%	0.325	42%	0.416	S	S	.	.	H	α-helix	trans	-65.3	-43.2	177.5	51	0	0	0	0	110.5	G84 S85 F91 Y92	G84-T88 PolarHBondContact O-N 2.73Å; S85-T88 WeakPolarHBondContact CA-OG1 3.34Å; S85-T88 PolarHBondContact O-N 2.89Å; S85-T88 VanDerWaalsContact O-N 3.09Å; S85-T88 PolarHBondContact O-OG1 3.41Å; T88-F91 WeakPolarHBondContact O-CB 3.16Å; T88-F91 PolarHBondContact O-N 3.5Å; T88-F91 VanDerWaalsContact O-N 3.16Å; T88-Y92 WeakPolarHBondContact O-CD2 3.38Å; T88-Y92 PolarHBondContact O-N 3.16Å; T88-Y92 VanDerWaalsContact O-N 3.12Å
89	D	85.7	Confident	81.5	Confident	90 Å²	90	93.1 Å²	93.1	48%	0.481	45%	0.451	S	S	.	.	H	α-helix	trans	-63.6	-47.8	179.9	-63.9	-12	0	0	0	110.7	S85 F91 Y92 E93	S85-D89 PolarHBondContact O-N 3.09Å; D89-F91 PolarHBondContact O-N 3.08Å; D89-Y92 PolarHBondContact O-N 3.19Å; D89-Y92 VanDerWaalsContact O-N 3.08Å; D89-E93 WeakPolarHBondContact O-CB 3.22Å; D89-E93 WeakPolarHBondContact O-CG 3.39Å; D89-E93 PolarHBondContact O-N 3.4Å
90	L	85.3	Confident	80.4	Confident	80 Å²	80	102 Å²	102	42%	0.419	49%	0.49	S	S	.	.	H	α-helix	trans	-57.2	-34.1	175.5	-117.7	135.9	0	0	0	113.2	S86 R94	S86-L90 WeakPolarHBondContact O-CB 3.43Å; S86-L90 PolarHBondContact O-N 3.37Å; L90-R94 WeakPolarHBondContact O-CB 3.34Å; L90-R94 VanDerWaalsContact O-CG 3.22Å; L90-R94 WeakPolarHBondContact O-CG 3.47Å; L90-R94 PolarHBondContact O-N 3.21Å
91	F	84.8	Confident	79	Confident	104 Å²	104	111.1 Å²	111.1	46%	0.456	53%	0.529	S	S	.	.	H	α-helix	trans	-68.1	-46	176.4	172.5	-96.8	0	0	0	111.6	K87 T88 D89 R94 K95	K87-F91 PolarHBondContact O-N 3.36Å; K87-F91 VanDerWaalsContact O-N 3.13Å; T88-F91 WeakPolarHBondContact O-CB 3.16Å; T88-F91 PolarHBondContact O-N 3.5Å; T88-F91 VanDerWaalsContact O-N 3.16Å; D89-F91 PolarHBondContact O-N 3.08Å; F91-R94 PolarHBondContact O-N 3.12Å; F91-K95 HydrophobicContact CE1-CD 4.02Å; F91-K95 HydrophobicContact CZ-CD 4.09Å; F91-K95 VanDerWaalsContact CZ-CE 3.45Å; F91-K95 PolarHBondContact O-N 3.18Å
92	Y	85.1	Confident	77.6	Confident	156 Å²	156	121.6 Å²	121.6	61%	0.612	56%	0.558	S	S	*	*	H	α-helix	trans	-72.4	-36.8	-179.8	-74.2	-71	0	0	0	112.6	T88 D89 R94 K95 K96	T88-Y92 WeakPolarHBondContact O-CD2 3.38Å; T88-Y92 PolarHBondContact O-N 3.16Å; T88-Y92 VanDerWaalsContact O-N 3.12Å; D89-Y92 PolarHBondContact O-N 3.19Å; D89-Y92 VanDerWaalsContact O-N 3.08Å; Y92-R94 VanDerWaalsContact C-N 3.34Å; Y92-R94 PolarHBondContact O-N 3.46Å; Y92-K95 PolarHBondContact O-N 3.2Å; Y92-K96 PolarHBondContact O-N 3.25Å
93	E	86.9	Confident	77.2	Confident	124 Å²	124	125.3 Å²	125.3	58%	0.579	57%	0.573	S	S	*	*	H	α-helix	trans	-60.3	-43.1	172.9	-74.6	-177	163	0	0	111.9	D89 K95 K96	D89-E93 WeakPolarHBondContact O-CB 3.22Å; D89-E93 WeakPolarHBondContact O-CG 3.39Å; D89-E93 PolarHBondContact O-N 3.4Å; E93-K95 VanDerWaalsContact C-N 3.29Å; E93-K95 PolarHBondContact O-N 2.84Å; E93-K96 WeakPolarHBondContact O-CB 3.42Å; E93-K96 PolarHBondContact O-N 3.17Å
94	R	82.6	Confident	77.2	Confident	186 Å²	186	125.6 Å²	125.6	70%	0.702	57%	0.57	S	S	*	*	H	α-helix	trans	-64.2	-33.4	175.7	-76.2	175.9	-176.3	-173.9	3.8	112.8	L90 F91 Y92	L90-R94 WeakPolarHBondContact O-CB 3.34Å; L90-R94 VanDerWaalsContact O-CG 3.22Å; L90-R94 WeakPolarHBondContact O-CG 3.47Å; L90-R94 PolarHBondContact O-N 3.21Å; F91-R94 PolarHBondContact O-N 3.12Å; Y92-R94 VanDerWaalsContact C-N 3.34Å; Y92-R94 PolarHBondContact O-N 3.46Å
95	K	79.9	Confident	76.8	Confident	103 Å²	103	131.9 Å²	131.9	45%	0.448	60%	0.596	S	S	.	*	H	α-helix	trans	-71	-30.7	174.8	-89.6	-171.2	174.1	-176.2	0	113	F91 Y92 E93 Y97 G98 F99	F91-K95 HydrophobicContact CE1-CD 4.02Å; F91-K95 HydrophobicContact CZ-CD 4.09Å; F91-K95 VanDerWaalsContact CZ-CE 3.45Å; F91-K95 PolarHBondContact O-N 3.18Å; Y92-K95 PolarHBondContact O-N 3.2Å; E93-K95 VanDerWaalsContact C-N 3.29Å; E93-K95 PolarHBondContact O-N 2.84Å; K95-Y97 PolarHBondContact O-N 3.05Å; K95-G98 PolarHBondContact O-N 3.27Å; K95-F99 HydrophobicContact CG-CE2 4.12Å
96	K	77.9	Confident	76.3	Confident	160 Å²	160	136.7 Å²	136.7	70%	0.696	61%	0.61	S	S	*	*	H	α-helix	trans	-58.6	-31.8	-176.3	-169.8	179	179	-178.2	0	113.6	Y92 E93	Y92-K96 PolarHBondContact O-N 3.25Å; E93-K96 WeakPolarHBondContact O-CB 3.42Å; E93-K96 PolarHBondContact O-N 3.17Å
97	Y	71.3	Confident	75.8	Confident	189 Å²	189	142.3 Å²	142.3	74%	0.741	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.8	15	-176.8	-61.1	-78.1	0	0	0	114.4	K95	K95-Y97 PolarHBondContact O-N 3.05Å
98	G	64.5	Low	75.4	Confident	44 Å²	44	145.7 Å²	145.7	45%	0.454	64%	0.642	S	S	.	*			trans	83.9	144.2	-179.8	0	0	0	0	0	113.5	K95 K100	K95-G98 PolarHBondContact O-N 3.27Å; G98-K100 PolarHBondContact O-N 2.93Å
99	F	62	Low	74.7	Confident	174 Å²	174	152.3 Å²	152.3	76%	0.763	67%	0.665	S	S	*	*			trans	-63.9	97.9	178	-101.7	-93.1	0	0	0	110.5	K95 K101	K95-F99 HydrophobicContact CG-CE2 4.12Å; F99-K101 PolarHBondContact O-N 3.24Å
100	K	63.8	Low	73.9	Confident	199 Å²	199	157.1 Å²	157.1	87%	0.865	68%	0.679	S	S	*	*			trans	-72.8	109.6	156.1	-76.6	-172.6	177.4	-179.2	0	107.3	G98 R102	G98-K100 PolarHBondContact O-N 2.93Å; K100-R102 PolarHBondContact O-N 3.23Å
101	K	57.6	Low	72.9	Confident	209 Å²	209	163.5 Å²	163.5	91%	0.909	70%	0.701	S	S	*	*			trans	-52.5	124.4	169.9	-111	178.8	176.5	178.3	0	107.7	F99	F99-K101 PolarHBondContact O-N 3.24Å
102	R	58.8	Low	71.9	Confident	314 Å²	314	168.9 Å²	168.9	100%	1.185	72%	0.723	S	S	*	*			trans	-77.2	0	175.4	-164.3	-179	-174.3	-168.5	0.3	109.9	K100	K100-R102 PolarHBondContact O-N 3.23Å

Retrieved 102 of 102 residues in 22.8 ms (Link to these results)

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