A0A087YHQ5_POEFO Loading...

Dynein light chain roadblock

Acts as one of several non-catalytic accessory components of the cytoplasmic dynein 1 complex that are thought to be involved in linking dynein to cargos and to adapter proteins that regulate dynein function. Cytoplasmic dynein 1 acts as a motor for the intracellular retrograde motility of vesicles and organelles along microtubules.

AlphaFold DB , UniProt , Accession A0A087YHQ5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 102 aa.

						>A0A087YHQ5_POEFO|A0A087YHQ5
CFFVFLQADAEETLKRIEGHKGVIGTIIVNSEGLPIRTTLDNSTTSLYARLLRSFTTLARSAVRDVDPQNDLTFVRIRSKKQEILVAPENNFLLIVIQNPSE
					

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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	C	41.3	Very low	51.4	Low	141 Å²	141	97.4 Å²	97.4	95%	0.953	54%	0.536	S	S	*	.				0	-43.9	0	-66	0	0	0	0	114	F3 V4 F5	C1-F3 VanDerWaalsContact C-N 3.32Å; C1-F3 PolarHBondContact O-N 3.18Å; C1-V4 PolarHBondContact O-N 3.27Å; C1-F5 WeakPolarHBondContact O-CD2 3.22Å
2	F	44.1	Very low	53.4	Low	91 Å²	91	98.6 Å²	98.6	40%	0.399	54%	0.535	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-36.5	-179	-121.9	-95.5	0	0	0	114.6	I17	F2-I17 HydrophobicContact CE1-CD1 4.07Å; F2-I17 HydrophobicContact CE1-CG1 3.8Å; F2-I17 HydrophobicContact CE1-CG2 4.22Å; F2-I17 HydrophobicContact CZ-CG1 4.25Å; F2-I17 HydrophobicContact CZ-CG2 4.43Å
3	F	44	Very low	55.2	Low	91 Å²	91	91.4 Å²	91.4	40%	0.399	50%	0.496	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-22.5	-176.2	-110.9	-96.1	0	0	0	115.4	C1 F5 L6 T73 F74 A87	C1-F3 VanDerWaalsContact C-N 3.32Å; C1-F3 PolarHBondContact O-N 3.18Å; F3-F5 PolarHBondContact O-N 2.79Å; F3-L6 HydrophobicContact CE1-CD1 4.46Å; F3-T73 WeakPolarHBondContact CZ-O 3.31Å; F3-F74 HydrophobicContact CD2-CB 4.24Å; F3-F74 HydrophobicContact CD2-CD1 4.43Å; F3-F74 HydrophobicContact CD2-CG 4.43Å; F3-F74 HydrophobicContact CE1-CB 4.49Å; F3-F74 HydrophobicContact CE2-CB 3.33Å; F3-F74 HydrophobicContact CE2-CD1 4.27Å; F3-F74 AromaticContact CE2-CG 3.95Å; F3-F74 HydrophobicContact CE2-CG 3.95Å; F3-F74 HydrophobicContact CZ-CB 3.48Å; F3-F74 VanDerWaalsContact CZ-CB 3.48Å; F3-F74 HydrophobicContact CZ-CG 4.39Å; F3-A87 HydrophobicContact CE1-CB 4.37Å; F3-A87 HydrophobicContact CE2-CB 3.89Å; F3-A87 HydrophobicContact CZ-CB 3.38Å
4	V	43	Very low	56.9	Low	117 Å²	117	86.1 Å²	86.1	71%	0.709	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-16.7	178.6	-179.6	0	0	0	0	111	C1	C1-V4 PolarHBondContact O-N 3.27Å
5	F	46.7	Very low	58.6	Low	104 Å²	104	88.8 Å²	88.8	46%	0.456	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-15.9	-177.1	-95.1	-90.9	0	0	0	115	C1 F3 Q7 A8 T13	C1-F5 WeakPolarHBondContact O-CD2 3.22Å; F3-F5 PolarHBondContact O-N 2.79Å; F5-Q7 PolarHBondContact O-N 2.79Å; F5-A8 PolarHBondContact O-N 2.82Å; F5-T13 HydrophobicContact CB-CG2 4.27Å; F5-T13 PolarHBondContact O-OG1 3.13Å
6	L	48.8	Very low	60.1	Low	22 Å²	22	91.8 Å²	91.8	12%	0.115	48%	0.475	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-17.3	-175.5	-88.7	158.5	0	0	0	114.5	F3 A8 T13 E89 L94	F3-L6 HydrophobicContact CE1-CD1 4.46Å; L6-A8 VanDerWaalsContact C-N 3.31Å; L6-A8 PolarHBondContact O-N 3.2Å; L6-T13 HydrophobicContact CD2-CG2 4.33Å; L6-T13 HydrophobicContact CG-CG2 4.44Å; L6-E89 WeakPolarHBondContact CD2-OE2 3.12Å; L6-L94 HydrophobicContact CD1-CD2 4.44Å; L6-L94 HydrophobicContact CD2-CD2 4.14Å
7	Q	51.3	Low	61.5	Low	189 Å²	189	87.1 Å²	87.1	88%	0.883	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-14.3	179.7	-77.8	-169	-68.3	0	0	114.5	F5	F5-Q7 PolarHBondContact O-N 2.79Å
8	A	47	Very low	62.7	Low	60 Å²	60	87.1 Å²	87.1	50%	0.496	45%	0.448	S	S	.	.	S	Bend	trans	-104	112.6	174.7	0	0	0	0	0	109.1	F5 L6 T13	F5-A8 PolarHBondContact O-N 2.82Å; L6-A8 VanDerWaalsContact C-N 3.31Å; L6-A8 PolarHBondContact O-N 3.2Å; A8-T13 PolarHBondContact O-OG1 2.79Å
9	D	62.4	Low	63.6	Low	118 Å²	118	85.9 Å²	85.9	63%	0.631	46%	0.46	S	S	*	.			trans	32.2	96.9	174.3	-143.1	-35.7	0	0	0	114.6	E11 E12 T13	D9-E11 PolarHBondContact O-N 3.17Å; D9-E12 HydrophobicContact CB-CB 4.19Å; D9-E12 PolarHBondContact O-N 2.82Å; D9-T13 PolarHBondContact O-N 3.25Å; D9-T13 VanDerWaalsContact O-N 3.09Å
10	A	66.9	Low	64.6	Low	57 Å²	57	87.5 Å²	87.5	47%	0.471	46%	0.464	S	S	.	.	H	α-helix	trans	-49.6	-34.3	-174	0	0	0	0	0	112.7	L14	A10-L14 WeakPolarHBondContact O-CB 3.34Å; A10-L14 VanDerWaalsContact O-CD1 3.23Å; A10-L14 WeakPolarHBondContact O-CD1 3.43Å; A10-L14 WeakPolarHBondContact O-CG 3.42Å; A10-L14 PolarHBondContact O-N 2.8Å
11	E	70.3	Confident	65.2	Low	81 Å²	81	92.4 Å²	92.4	38%	0.379	48%	0.482	S	S	.	.	H	α-helix	trans	-71.8	-36.7	178.7	-166.6	165.6	124.9	0	0	113.6	D9 K15 R37	D9-E11 PolarHBondContact O-N 3.17Å; E11-K15 WeakPolarHBondContact O-CG 3.45Å; E11-K15 PolarHBondContact O-N 3.37Å; E11-K15 IonicContact OE1-NZ 3.78Å; E11-R37 IonicContact OE1-NH1 3.11Å; E11-R37 IonicContact OE2-CZ 2.82Å; E11-R37 IonicContact OE2-NH1 3.8Å; E11-R37 PolarHBondContact OE2-NH1 2.88Å; E11-R37 IonicContact OE2-NH2 3.78Å; E11-R37 PolarHBondContact OE2-NH2 2.8Å
12	E	75.3	Confident	67.3	Low	112 Å²	112	86.5 Å²	86.5	52%	0.523	45%	0.445	S	S	.	.	H	α-helix	trans	-68.6	-43.9	174.7	-167.4	-173.2	119	0	0	110.4	D9 L14 K15 R16	D9-E12 HydrophobicContact CB-CB 4.19Å; D9-E12 PolarHBondContact O-N 2.82Å; E12-L14 VanDerWaalsContact C-N 3.32Å; E12-L14 PolarHBondContact O-N 3.14Å; E12-K15 PolarHBondContact O-N 3.27Å; E12-R16 WeakPolarHBondContact O-CG 3.19Å; E12-R16 PolarHBondContact O-N 3.22Å
13	T	76.9	Confident	69.4	Low	5 Å²	5	83.5 Å²	83.5	3%	0.031	43%	0.434	C	S	.	.	H	α-helix	trans	-63.4	-38.9	179.1	-65.7	0	0	0	0	111.7	F5 L6 A8 D9 R16 I17	F5-T13 HydrophobicContact CB-CG2 4.27Å; F5-T13 PolarHBondContact O-OG1 3.13Å; L6-T13 HydrophobicContact CD2-CG2 4.33Å; L6-T13 HydrophobicContact CG-CG2 4.44Å; A8-T13 PolarHBondContact O-OG1 2.79Å; D9-T13 PolarHBondContact O-N 3.25Å; D9-T13 VanDerWaalsContact O-N 3.09Å; T13-R16 WeakPolarHBondContact O-CB 3.49Å; T13-R16 PolarHBondContact O-N 3.11Å; T13-I17 HydrophobicContact CG2-CD1 4.07Å; T13-I17 VanDerWaalsContact O-CG1 3.28Å; T13-I17 WeakPolarHBondContact O-CG1 3.47Å; T13-I17 PolarHBondContact O-N 2.8Å
14	L	79.4	Confident	71.6	Confident	17 Å²	17	83.5 Å²	83.5	9%	0.089	44%	0.437	C	S	.	.	H	α-helix	trans	-60.5	-46.7	172.9	-76.1	162	0	0	0	112.5	A10 E12 R16 I17 E18 I28 L94	A10-L14 WeakPolarHBondContact O-CB 3.34Å; A10-L14 VanDerWaalsContact O-CD1 3.23Å; A10-L14 WeakPolarHBondContact O-CD1 3.43Å; A10-L14 WeakPolarHBondContact O-CG 3.42Å; A10-L14 PolarHBondContact O-N 2.8Å; E12-L14 VanDerWaalsContact C-N 3.32Å; E12-L14 PolarHBondContact O-N 3.14Å; L14-R16 VanDerWaalsContact C-N 3.25Å; L14-R16 PolarHBondContact O-N 3.44Å; L14-I17 PolarHBondContact O-N 2.94Å; L14-I17 VanDerWaalsContact O-N 3.08Å; L14-E18 WeakPolarHBondContact O-CG 3.42Å; L14-E18 PolarHBondContact O-N 3.36Å; L14-I28 HydrophobicContact CD1-CD1 3.36Å; L14-I28 HydrophobicContact CD1-CG1 4.38Å; L14-I28 HydrophobicContact CD2-CD1 4.24Å; L14-I28 HydrophobicContact CD2-CG1 4.43Å; L14-I28 HydrophobicContact CG-CD1 4.44Å; L14-L94 HydrophobicContact CD2-CD1 3.58Å
15	K	81.8	Confident	73.8	Confident	127 Å²	127	78 Å²	78	55%	0.552	40%	0.404	S	S	*	.	H	α-helix	trans	-59.9	-36.9	176.8	-75	176.3	-177.3	166.1	0	112.1	E11 E12 G19	E11-K15 WeakPolarHBondContact O-CG 3.45Å; E11-K15 PolarHBondContact O-N 3.37Å; E11-K15 IonicContact OE1-NZ 3.78Å; E12-K15 PolarHBondContact O-N 3.27Å; K15-G19 PolarHBondContact O-N 3.46Å
16	R	82.6	Confident	76	Confident	137 Å²	137	73.3 Å²	73.3	52%	0.517	38%	0.384	S	S	.	.	H	α-helix	trans	-66.4	-39.6	175.3	-66	172.4	74.3	99.2	6.9	111.8	E12 T13 L14 G19 H20	E12-R16 WeakPolarHBondContact O-CG 3.19Å; E12-R16 PolarHBondContact O-N 3.22Å; T13-R16 WeakPolarHBondContact O-CB 3.49Å; T13-R16 PolarHBondContact O-N 3.11Å; L14-R16 VanDerWaalsContact C-N 3.25Å; L14-R16 PolarHBondContact O-N 3.44Å; R16-G19 PolarHBondContact O-N 3.39Å; R16-H20 PolarHBondContact O-CD2 3.46Å; R16-H20 PolarHBondContact O-N 2.94Å
17	I	84	Confident	78	Confident	12 Å²	12	72.2 Å²	72.2	6%	0.062	38%	0.378	C	S	.	.	H	α-helix	trans	-67.5	-44.8	176.6	-65.3	165.6	0	0	0	110.2	F2 T13 L14 G19 H20 V23 T26 V96	F2-I17 HydrophobicContact CE1-CD1 4.07Å; F2-I17 HydrophobicContact CE1-CG1 3.8Å; F2-I17 HydrophobicContact CE1-CG2 4.22Å; F2-I17 HydrophobicContact CZ-CG1 4.25Å; F2-I17 HydrophobicContact CZ-CG2 4.43Å; T13-I17 HydrophobicContact CG2-CD1 4.07Å; T13-I17 VanDerWaalsContact O-CG1 3.28Å; T13-I17 WeakPolarHBondContact O-CG1 3.47Å; T13-I17 PolarHBondContact O-N 2.8Å; L14-I17 PolarHBondContact O-N 2.94Å; L14-I17 VanDerWaalsContact O-N 3.08Å; I17-G19 PolarHBondContact O-N 3.48Å; I17-H20 WeakPolarHBondContact O-CB 3.41Å; I17-H20 PolarHBondContact O-N 2.79Å; I17-H20 VanDerWaalsContact O-N 3.09Å; I17-V23 HydrophobicContact CG2-CG1 4.41Å; I17-V23 HydrophobicContact CG2-CG2 4.28Å; I17-V23 WeakPolarHBondContact O-CG2 3.5Å; I17-T26 HydrophobicContact CG2-CG2 4.2Å; I17-V96 HydrophobicContact CG2-CG1 3.78Å; I17-V96 HydrophobicContact CG2-CG2 4.2Å
18	E	82.9	Confident	79.8	Confident	86 Å²	86	64.6 Å²	64.6	40%	0.402	34%	0.343	S	S	.	.	H	α-helix	trans	-61.7	-31.9	176.4	-71.6	171	-177	0	0	112.5	L14 H20 T26 T39	L14-E18 WeakPolarHBondContact O-CG 3.42Å; L14-E18 PolarHBondContact O-N 3.36Å; E18-H20 VanDerWaalsContact C-N 3.28Å; E18-H20 PolarHBondContact O-N 2.79Å; E18-T26 HydrophobicContact CG-CG2 3.83Å; E18-T26 PolarHBondContact OE1-OG1 3.09Å; E18-T39 HydrophobicContact CG-CG2 4.45Å; E18-T39 WeakPolarHBondContact OE1-CG2 3.18Å
19	G	80.3	Confident	81.8	Confident	66 Å²	66	61.8 Å²	61.8	68%	0.68	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-8.4	175.7	0	0	0	0	0	115.2	K15 R16 I17	K15-G19 PolarHBondContact O-N 3.46Å; R16-G19 PolarHBondContact O-N 3.39Å; I17-G19 PolarHBondContact O-N 3.48Å
20	H	83.3	Confident	83.1	Confident	116 Å²	116	57.3 Å²	57.3	54%	0.537	30%	0.296	S	S	.	.	S	Bend	trans	-76.1	131.3	178.8	-105.8	-110.4	0	0	0	111.4	R16 I17 E18 G22 V23	R16-H20 PolarHBondContact O-CD2 3.46Å; R16-H20 PolarHBondContact O-N 2.94Å; I17-H20 WeakPolarHBondContact O-CB 3.41Å; I17-H20 PolarHBondContact O-N 2.79Å; I17-H20 VanDerWaalsContact O-N 3.09Å; E18-H20 VanDerWaalsContact C-N 3.28Å; E18-H20 PolarHBondContact O-N 2.79Å; H20-G22 PolarHBondContact O-N 2.85Å; H20-V23 HydrophobicContact CB-CG2 3.86Å; H20-V23 PolarHBondContact O-N 2.8Å; H20-V23 VanDerWaalsContact O-N 3.14Å
21	K	78	Confident	83.8	Confident	192 Å²	192	57.3 Å²	57.3	84%	0.835	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	132.4	171.5	-67.9	-170.9	178	-172.2	0	109.8
22	G	83.9	Confident	84.3	Confident	17 Å²	17	60.6 Å²	60.6	18%	0.175	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	94.1	-10.6	-175.6	0	0	0	0	0	115.4	H20 I24 Q98 N99	H20-G22 PolarHBondContact O-N 2.85Å; G22-I24 PolarHBondContact O-N 2.84Å; G22-Q98 CarbonylContact O-C 3.58Å; G22-Q98 WeakPolarHBondContact O-CA 3.23Å; G22-N99 PolarHBondContact O-N 3.32Å
23	V	89.4	Confident	84.3	Confident	28 Å²	28	56.3 Å²	56.3	17%	0.17	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	121.3	172.8	-178	0	0	0	0	110.1	I17 H20 T26 V96 Q98	I17-V23 HydrophobicContact CG2-CG1 4.41Å; I17-V23 HydrophobicContact CG2-CG2 4.28Å; I17-V23 WeakPolarHBondContact O-CG2 3.5Å; H20-V23 HydrophobicContact CB-CG2 3.86Å; H20-V23 PolarHBondContact O-N 2.8Å; H20-V23 VanDerWaalsContact O-N 3.14Å; V23-T26 HydrophobicContact CG1-CG2 4.38Å; V23-V96 HydrophobicContact CG1-CG1 4.05Å; V23-Q98 HydrophobicContact CG2-CG 4.08Å
24	I	89.5	Confident	84.8	Confident	91 Å²	91	60.9 Å²	60.9	47%	0.467	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	-41.2	178.6	-58.3	174.1	0	0	0	109.7	G22 I97 N99	G22-I24 PolarHBondContact O-N 2.84Å; I24-I97 HydrophobicContact CB-CG2 4.28Å; I24-I97 HydrophobicContact CD1-CG2 4.27Å; I24-I97 PolarHBondContact N-O 2.93Å; I24-N99 HydrophobicContact CD1-CB 4.1Å; I24-N99 HydrophobicContact CG1-CB 4.33Å
25	G	90.1	Very high	85.2	Confident	2 Å²	2	62.3 Å²	62.3	2%	0.021	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-177	165.7	177.3	0	0	0	0	0	114.7	T39 I97	G25-T39 WeakPolarHBondContact CA-OG1 3.35Å; G25-I97 PolarHBondContact N-O 2.92Å; G25-I97 PolarHBondContact O-N 3.33Å
26	T	91	Very high	85.5	Confident	4 Å²	4	60.7 Å²	60.7	3%	0.025	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	145.9	-179.7	61.2	0	0	0	0	109.4	I17 E18 V23 T38 T39 I95 V96	I17-T26 HydrophobicContact CG2-CG2 4.2Å; E18-T26 HydrophobicContact CG-CG2 3.83Å; E18-T26 PolarHBondContact OE1-OG1 3.09Å; V23-T26 HydrophobicContact CG1-CG2 4.38Å; T26-T38 VanDerWaalsContact O-CA 3.31Å; T26-T38 WeakPolarHBondContact O-CA 3.38Å; T26-T38 PolarHBondContact O-OG1 2.82Å; T26-T39 PolarHBondContact N-OG1 3.19Å; T26-T39 PolarHBondContact O-N 3.3Å; T26-T39 VanDerWaalsContact O-N 3.11Å; T26-I95 CarbonylContact C-O 3.59Å; T26-I95 WeakPolarHBondContact CA-O 3.33Å; T26-V96 HydrophobicContact CG2-CG1 4.41Å; T26-V96 HydrophobicContact CG2-CG2 4.45Å
27	I	90.9	Very high	85.7	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	132.9	174.5	-54.6	165.3	0	0	0	107.9	V29 P35 R37 L40 T45 Y48 I95	I27-V29 HydrophobicContact CG2-CG2 3.74Å; I27-P35 HydrophobicContact CG2-CB 4.44Å; I27-R37 WeakPolarHBondContact CA-O 3.33Å; I27-L40 HydrophobicContact CD1-CD1 4.03Å; I27-L40 HydrophobicContact CG1-CD1 4.22Å; I27-T45 HydrophobicContact CD1-CG2 4.25Å; I27-T45 HydrophobicContact CG1-CG2 4.24Å; I27-T45 HydrophobicContact CG2-CG2 3.7Å; I27-Y48 HydrophobicContact CD1-CD2 4.46Å; I27-Y48 HydrophobicContact CD1-CG 4.41Å; I27-I95 HydrophobicContact CB-CB 4.16Å; I27-I95 HydrophobicContact CB-CD1 4.42Å; I27-I95 HydrophobicContact CG2-CD1 4.44Å; I27-I95 PolarHBondContact N-O 2.98Å; I27-I95 PolarHBondContact O-N 3.12Å
28	I	89.6	Confident	85.9	Confident	29 Å²	29	62.1 Å²	62.1	15%	0.149	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	124.3	171	-54	172.3	0	0	0	107.8	L14 P35 I36 R37 F92 L94	L14-I28 HydrophobicContact CD1-CD1 3.36Å; L14-I28 HydrophobicContact CD1-CG1 4.38Å; L14-I28 HydrophobicContact CD2-CD1 4.24Å; L14-I28 HydrophobicContact CD2-CG1 4.43Å; L14-I28 HydrophobicContact CG-CD1 4.44Å; I28-P35 CarbonylContact O-C 3.55Å; I28-P35 WeakPolarHBondContact O-CA 3.47Å; I28-I36 HydrophobicContact CG2-CD1 4.37Å; I28-I36 PolarHBondContact O-N 3.45Å; I28-R37 HydrophobicContact CD1-CB 4.12Å; I28-R37 HydrophobicContact CG1-CB 4.49Å; I28-R37 PolarHBondContact N-O 3.08Å; I28-F92 HydrophobicContact CG2-CD1 4.42Å; I28-L94 HydrophobicContact CG1-CD1 4.05Å
29	V	90.3	Very high	86.2	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	140	-180	-167.6	0	0	0	0	109.2	I27 G33 L34 A49 F92 L93 I95	I27-V29 HydrophobicContact CG2-CG2 3.74Å; V29-G33 VanDerWaalsContact CG1-CA 3.45Å; V29-L34 WeakPolarHBondContact CA-O 3.4Å; V29-L34 WeakPolarHBondContact CG1-O 3.12Å; V29-A49 HydrophobicContact CB-CB 4.49Å; V29-A49 HydrophobicContact CG1-CB 3.96Å; V29-A49 HydrophobicContact CG2-CB 3.62Å; V29-F92 CarbonylContact O-C 3.53Å; V29-F92 WeakPolarHBondContact O-CA 3.35Å; V29-L93 HydrophobicContact CB-CB 4.16Å; V29-L93 PolarHBondContact N-O 2.9Å; V29-L93 PolarHBondContact O-N 2.8Å; V29-I95 HydrophobicContact CG2-CD1 3.84Å
30	N	88.8	Confident	86.6	Confident	24 Å²	24	60.5 Å²	60.5	13%	0.128	31%	0.314	C	S	.	.			trans	-77.1	177.8	173.7	77.6	-3.4	0	0	0	112.3	E32 G33 L34 I36 R53 N91	N30-E32 PolarHBondContact ND2-OE2 3.31Å; N30-E32 PolarHBondContact O-N 3.02Å; N30-E32 VanDerWaalsContact OD1-CA 3.29Å; N30-E32 WeakPolarHBondContact OD1-CA 3.38Å; N30-E32 WeakPolarHBondContact OD1-CB 3.38Å; N30-E32 PolarHBondContact OD1-N 2.85Å; N30-G33 PolarHBondContact O-N 3.49Å; N30-G33 VanDerWaalsContact O-N 3.12Å; N30-G33 PolarHBondContact OD1-N 3.49Å; N30-L34 PolarHBondContact N-O 3.43Å; N30-L34 PolarHBondContact OD1-N 2.87Å; N30-L34 PolarHBondContact OD1-O 3.42Å; N30-I36 HydrophobicContact CB-CD1 3.84Å; N30-I36 HydrophobicContact CB-CG1 4.02Å; N30-R53 PolarHBondContact O-NH1 3.41Å; N30-N91 CarbonylContact C-O 3.56Å
31	S	81.1	Confident	86.9	Confident	57 Å²	57	58.6 Å²	58.6	40%	0.399	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-15	174.9	52	0	0	0	0	113.8	R53 N91	S31-R53 PolarHBondContact O-NH1 3.16Å; S31-R53 PolarHBondContact O-NH2 3.3Å; S31-N91 WeakPolarHBondContact CA-O 3.41Å; S31-N91 WeakPolarHBondContact CB-O 3.47Å; S31-N91 PolarHBondContact N-O 3.09Å
32	E	80.3	Confident	87.3	Confident	150 Å²	150	55.3 Å²	55.3	70%	0.701	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	-7.6	177.1	-54.5	175	111.6	0	0	112.4	N30 L34	N30-E32 PolarHBondContact ND2-OE2 3.31Å; N30-E32 PolarHBondContact O-N 3.02Å; N30-E32 VanDerWaalsContact OD1-CA 3.29Å; N30-E32 WeakPolarHBondContact OD1-CA 3.38Å; N30-E32 WeakPolarHBondContact OD1-CB 3.38Å; N30-E32 PolarHBondContact OD1-N 2.85Å; E32-L34 HydrophobicContact CB-CG 4.46Å
33	G	76.9	Confident	87.5	Confident	23 Å²	23	58.9 Å²	58.9	24%	0.237	32%	0.322	C	S	.	.	S	Bend	trans	87.1	10.5	-176.9	0	0	0	0	0	114	V29 N30	V29-G33 VanDerWaalsContact CG1-CA 3.45Å; N30-G33 PolarHBondContact O-N 3.49Å; N30-G33 VanDerWaalsContact O-N 3.12Å; N30-G33 PolarHBondContact OD1-N 3.49Å
34	L	86.4	Confident	87.5	Confident	101 Å²	101	59.5 Å²	59.5	53%	0.529	33%	0.326	S	S	.	.			trans	-89.3	131	175.9	-61	175.1	0	0	0	110.6	V29 N30 E32 I36	V29-L34 WeakPolarHBondContact CA-O 3.4Å; V29-L34 WeakPolarHBondContact CG1-O 3.12Å; N30-L34 PolarHBondContact N-O 3.43Å; N30-L34 PolarHBondContact OD1-N 2.87Å; N30-L34 PolarHBondContact OD1-O 3.42Å; E32-L34 HydrophobicContact CB-CG 4.46Å; L34-I36 PolarHBondContact O-N 3.1Å
35	P	88.4	Confident	87.5	Confident	46 Å²	46	55.2 Å²	55.2	30%	0.299	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	124.7	175.2	29.1	-32.7	0	0	0	110.5	I27 I28 T45	I27-P35 HydrophobicContact CG2-CB 4.44Å; I28-P35 CarbonylContact O-C 3.55Å; I28-P35 WeakPolarHBondContact O-CA 3.47Å; P35-T45 HydrophobicContact CB-CG2 3.42Å; P35-T45 VanDerWaalsContact CB-CG2 3.42Å; P35-T45 HydrophobicContact CG-CG2 3.85Å
36	I	88.4	Confident	87.5	Confident	94 Å²	94	58.1 Å²	58.1	48%	0.482	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	-44	176.5	-53.9	176.6	0	0	0	110	I28 N30 L34 F92	I28-I36 HydrophobicContact CG2-CD1 4.37Å; I28-I36 PolarHBondContact O-N 3.45Å; N30-I36 HydrophobicContact CB-CD1 3.84Å; N30-I36 HydrophobicContact CB-CG1 4.02Å; L34-I36 PolarHBondContact O-N 3.1Å; I36-F92 HydrophobicContact CD1-CD1 3.6Å; I36-F92 HydrophobicContact CD1-CE1 3.38Å
37	R	86.2	Confident	87.5	Confident	139 Å²	139	62 Å²	62	53%	0.525	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	145.1	177.2	-69.5	-156.5	179.9	175.4	11.2	110.2	E11 I27 I28	E11-R37 IonicContact OE1-NH1 3.11Å; E11-R37 IonicContact OE2-CZ 2.82Å; E11-R37 IonicContact OE2-NH1 3.8Å; E11-R37 PolarHBondContact OE2-NH1 2.88Å; E11-R37 IonicContact OE2-NH2 3.78Å; E11-R37 PolarHBondContact OE2-NH2 2.8Å; I27-R37 WeakPolarHBondContact CA-O 3.33Å; I28-R37 HydrophobicContact CD1-CB 4.12Å; I28-R37 HydrophobicContact CG1-CB 4.49Å; I28-R37 PolarHBondContact N-O 3.08Å
38	T	89.1	Confident	87.5	Confident	40 Å²	40	64.3 Å²	64.3	25%	0.245	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	147.6	173.6	-178.8	0	0	0	0	110.2	T26 L40 T45	T26-T38 VanDerWaalsContact O-CA 3.31Å; T26-T38 WeakPolarHBondContact O-CA 3.38Å; T26-T38 PolarHBondContact O-OG1 2.82Å; T38-L40 WeakPolarHBondContact CG2-O 3.35Å; T38-L40 PolarHBondContact OG1-N 3.16Å; T38-T45 HydrophobicContact CG2-CG2 3.83Å; T38-T45 PolarHBondContact OG1-OG1 3.44Å
39	T	88.4	Confident	87.5	Confident	73 Å²	73	62.9 Å²	62.9	45%	0.448	35%	0.346	S	S	.	.	S	Bend	trans	-96.6	-0.2	167.3	64.2	0	0	0	0	112.5	E18 G25 T26	E18-T39 HydrophobicContact CG-CG2 4.45Å; E18-T39 WeakPolarHBondContact OE1-CG2 3.18Å; G25-T39 WeakPolarHBondContact CA-OG1 3.35Å; T26-T39 PolarHBondContact N-OG1 3.19Å; T26-T39 PolarHBondContact O-N 3.3Å; T26-T39 VanDerWaalsContact O-N 3.11Å
40	L	88.3	Confident	87.5	Confident	44 Å²	44	71.3 Å²	71.3	23%	0.23	38%	0.378	C	S	.	.	S	Bend	trans	-103.6	171.9	-179.2	-65.6	170.1	0	0	0	110.7	I27 T38 I97	I27-L40 HydrophobicContact CD1-CD1 4.03Å; I27-L40 HydrophobicContact CG1-CD1 4.22Å; T38-L40 WeakPolarHBondContact CG2-O 3.35Å; T38-L40 PolarHBondContact OG1-N 3.16Å; L40-I97 HydrophobicContact CD1-CD1 3.61Å; L40-I97 HydrophobicContact CD1-CG1 4.42Å
41	D	89.4	Confident	87.5	Confident	77 Å²	77	74.7 Å²	74.7	41%	0.412	40%	0.395	S	S	.	.			trans	-66.7	148.9	175.9	68.8	-81.6	0	0	0	111.5	S43 T44 T45	D41-S43 PolarHBondContact O-N 3.08Å; D41-S43 VanDerWaalsContact O-N 3.15Å; D41-S43 WeakPolarHBondContact OD2-CB 3.07Å; D41-S43 PolarHBondContact OD2-N 3.42Å; D41-S43 PolarHBondContact OD2-OG 2.88Å; D41-T44 PolarHBondContact O-N 3.49Å; D41-T44 PolarHBondContact O-OG1 3.08Å; D41-T44 VanDerWaalsContact O-OG1 3.11Å; D41-T44 WeakPolarHBondContact OD1-CB 3.16Å; D41-T44 WeakPolarHBondContact OD1-CG2 3.47Å; D41-T44 PolarHBondContact OD1-OG1 3.34Å; D41-T44 WeakPolarHBondContact OD2-CG2 3.3Å; D41-T44 PolarHBondContact OD2-N 2.83Å; D41-T44 PolarHBondContact OD2-OG1 3.21Å; D41-T45 VanDerWaalsContact O-CB 3.25Å; D41-T45 WeakPolarHBondContact O-CB 3.46Å; D41-T45 PolarHBondContact O-N 3.07Å; D41-T45 PolarHBondContact O-OG1 3.38Å
42	N	86.3	Confident	88	Confident	123 Å²	123	72.5 Å²	72.5	66%	0.658	38%	0.379	S	S	*	.	H	α-helix	trans	-61.3	-28.7	-175.4	-70.3	-37.1	0	0	0	112.9	S46	N42-S46 WeakPolarHBondContact O-CB 3.35Å; N42-S46 PolarHBondContact O-N 2.84Å; N42-S46 VanDerWaalsContact O-N 3.07Å; N42-S46 PolarHBondContact O-OG 3.49Å
43	S	88.1	Confident	88.4	Confident	91 Å²	91	69 Å²	69	64%	0.636	36%	0.36	S	S	*	.	H	α-helix	trans	-73.3	-47.8	-176.9	78.7	0	0	0	0	111.6	D41 L47	D41-S43 PolarHBondContact O-N 3.08Å; D41-S43 VanDerWaalsContact O-N 3.15Å; D41-S43 WeakPolarHBondContact OD2-CB 3.07Å; D41-S43 PolarHBondContact OD2-N 3.42Å; D41-S43 PolarHBondContact OD2-OG 2.88Å; S43-L47 PolarHBondContact O-N 2.95Å
44	T	89.1	Confident	89	Confident	42 Å²	42	71.3 Å²	71.3	26%	0.258	37%	0.372	S	S	.	.	H	α-helix	trans	-67.8	-40.5	174.6	60.4	0	0	0	0	110.7	D41 S46 L47 Y48	D41-T44 PolarHBondContact O-N 3.49Å; D41-T44 PolarHBondContact O-OG1 3.08Å; D41-T44 VanDerWaalsContact O-OG1 3.11Å; D41-T44 WeakPolarHBondContact OD1-CB 3.16Å; D41-T44 WeakPolarHBondContact OD1-CG2 3.47Å; D41-T44 PolarHBondContact OD1-OG1 3.34Å; D41-T44 WeakPolarHBondContact OD2-CG2 3.3Å; D41-T44 PolarHBondContact OD2-N 2.83Å; D41-T44 PolarHBondContact OD2-OG1 3.21Å; T44-S46 PolarHBondContact O-N 3.23Å; T44-L47 WeakPolarHBondContact O-CB 3.28Å; T44-L47 PolarHBondContact O-N 3.37Å; T44-L47 VanDerWaalsContact O-N 3.16Å; T44-Y48 WeakPolarHBondContact O-CD2 3.41Å; T44-Y48 PolarHBondContact O-N 2.84Å
45	T	90.7	Very high	89.3	Confident	0 Å²	0	70.4 Å²	70.4	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-56.8	-48.7	178.5	-63.9	0	0	0	0	112.2	I27 P35 T38 D41 L47 Y48 A49	I27-T45 HydrophobicContact CD1-CG2 4.25Å; I27-T45 HydrophobicContact CG1-CG2 4.24Å; I27-T45 HydrophobicContact CG2-CG2 3.7Å; P35-T45 HydrophobicContact CB-CG2 3.42Å; P35-T45 VanDerWaalsContact CB-CG2 3.42Å; P35-T45 HydrophobicContact CG-CG2 3.85Å; T38-T45 HydrophobicContact CG2-CG2 3.83Å; T38-T45 PolarHBondContact OG1-OG1 3.44Å; D41-T45 VanDerWaalsContact O-CB 3.25Å; D41-T45 WeakPolarHBondContact O-CB 3.46Å; D41-T45 PolarHBondContact O-N 3.07Å; D41-T45 PolarHBondContact O-OG1 3.38Å; T45-L47 VanDerWaalsContact C-N 3.29Å; T45-L47 PolarHBondContact O-N 3.19Å; T45-Y48 PolarHBondContact O-N 2.68Å; T45-A49 VanDerWaalsContact O-CB 3.26Å; T45-A49 WeakPolarHBondContact O-CB 3.45Å; T45-A49 PolarHBondContact O-N 3.43Å
46	S	90	Very high	89.4	Confident	63 Å²	63	68.3 Å²	68.3	44%	0.441	35%	0.35	S	S	.	.	H	α-helix	trans	-63.5	-37.9	179.4	-59	0	0	0	0	111.7	N42 T44 R50	N42-S46 WeakPolarHBondContact O-CB 3.35Å; N42-S46 PolarHBondContact O-N 2.84Å; N42-S46 VanDerWaalsContact O-N 3.07Å; N42-S46 PolarHBondContact O-OG 3.49Å; T44-S46 PolarHBondContact O-N 3.23Å; S46-R50 WeakPolarHBondContact O-CB 3.23Å; S46-R50 PolarHBondContact O-N 3.01Å; S46-R50 VanDerWaalsContact O-N 3.15Å
47	L	90.3	Very high	89.4	Confident	85 Å²	85	66.8 Å²	66.8	45%	0.445	35%	0.345	S	S	.	.	H	α-helix	trans	-64.1	-49.5	175.6	-179.7	65.2	0	0	0	111.4	S43 T44 T45 R50 L51	S43-L47 PolarHBondContact O-N 2.95Å; T44-L47 WeakPolarHBondContact O-CB 3.28Å; T44-L47 PolarHBondContact O-N 3.37Å; T44-L47 VanDerWaalsContact O-N 3.16Å; T45-L47 VanDerWaalsContact C-N 3.29Å; T45-L47 PolarHBondContact O-N 3.19Å; L47-R50 PolarHBondContact O-N 2.86Å; L47-L51 HydrophobicContact CD1-CD1 3.82Å; L47-L51 HydrophobicContact CD1-CG 4.24Å; L47-L51 HydrophobicContact CG-CD1 3.92Å; L47-L51 WeakPolarHBondContact O-CB 3.34Å; L47-L51 VanDerWaalsContact O-CG 3.3Å; L47-L51 WeakPolarHBondContact O-CG 3.4Å; L47-L51 PolarHBondContact O-N 3.06Å
48	Y	90.4	Very high	89.7	Confident	49 Å²	49	65.8 Å²	65.8	19%	0.192	35%	0.349	C	S	.	.	H	α-helix	trans	-63.2	-45.1	178.6	-82.3	-67.7	0	0	0	111.9	I27 T44 T45 R50 L51 L52 Q82 I84 I97	I27-Y48 HydrophobicContact CD1-CD2 4.46Å; I27-Y48 HydrophobicContact CD1-CG 4.41Å; T44-Y48 WeakPolarHBondContact O-CD2 3.41Å; T44-Y48 PolarHBondContact O-N 2.84Å; T45-Y48 PolarHBondContact O-N 2.68Å; Y48-R50 VanDerWaalsContact C-N 3.35Å; Y48-R50 PolarHBondContact O-N 3.39Å; Y48-L51 PolarHBondContact O-N 3.4Å; Y48-L52 HydrophobicContact CD1-CD1 4.07Å; Y48-L52 VanDerWaalsContact O-CB 3.23Å; Y48-L52 WeakPolarHBondContact O-CB 3.47Å; Y48-L52 WeakPolarHBondContact O-CG 3.3Å; Y48-L52 PolarHBondContact O-N 3.15Å; Y48-Q82 PolarHBondContact OH-NE2 2.83Å; Y48-Q82 PolarHBondContact OH-OE1 2.9Å; Y48-I84 HydrophobicContact CE1-CD1 4.06Å; Y48-I97 HydrophobicContact CD1-CD1 4.42Å; Y48-I97 HydrophobicContact CD2-CD1 4.12Å; Y48-I97 HydrophobicContact CE1-CD1 4.26Å; Y48-I97 HydrophobicContact CE2-CD1 3.96Å; Y48-I97 HydrophobicContact CG-CD1 4.38Å
49	A	90.5	Very high	89.8	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-55.6	-49.4	178	0	0	0	0	0	111.3	V29 T45 R53	V29-A49 HydrophobicContact CB-CB 4.49Å; V29-A49 HydrophobicContact CG1-CB 3.96Å; V29-A49 HydrophobicContact CG2-CB 3.62Å; T45-A49 VanDerWaalsContact O-CB 3.26Å; T45-A49 WeakPolarHBondContact O-CB 3.45Å; T45-A49 PolarHBondContact O-N 3.43Å; A49-R53 WeakPolarHBondContact O-CB 3.04Å; A49-R53 PolarHBondContact O-N 2.84Å
50	R	89.3	Confident	89.9	Confident	176 Å²	176	65 Å²	65	66%	0.664	34%	0.338	S	S	*	.	H	α-helix	trans	-64.8	-49	179.9	-171.7	178	69.6	164.1	1.4	112.4	S46 L47 Y48 S54	S46-R50 WeakPolarHBondContact O-CB 3.23Å; S46-R50 PolarHBondContact O-N 3.01Å; S46-R50 VanDerWaalsContact O-N 3.15Å; L47-R50 PolarHBondContact O-N 2.86Å; Y48-R50 VanDerWaalsContact C-N 3.35Å; Y48-R50 PolarHBondContact O-N 3.39Å; R50-S54 PolarHBondContact O-N 3.4Å
51	L	90.1	Very high	90.1	Very high	95 Å²	95	65.6 Å²	65.6	50%	0.497	35%	0.346	S	S	.	.	H	α-helix	trans	-65.8	-49.7	-176.7	-70.4	175.7	0	0	0	111.6	L47 Y48 R53 S54 F55	L47-L51 HydrophobicContact CD1-CD1 3.82Å; L47-L51 HydrophobicContact CD1-CG 4.24Å; L47-L51 HydrophobicContact CG-CD1 3.92Å; L47-L51 WeakPolarHBondContact O-CB 3.34Å; L47-L51 VanDerWaalsContact O-CG 3.3Å; L47-L51 WeakPolarHBondContact O-CG 3.4Å; L47-L51 PolarHBondContact O-N 3.06Å; Y48-L51 PolarHBondContact O-N 3.4Å; L51-R53 VanDerWaalsContact C-N 3.3Å; L51-R53 PolarHBondContact O-N 3.32Å; L51-S54 PolarHBondContact O-N 3.41Å; L51-F55 WeakPolarHBondContact O-CB 3.43Å; L51-F55 PolarHBondContact O-N 2.83Å
52	L	90.9	Very high	90.2	Very high	12 Å²	12	64.5 Å²	64.5	6%	0.063	35%	0.348	C	S	.	.	H	α-helix	trans	-70.6	-29.1	-177.2	-65.4	173.7	0	0	0	111.9	Y48 T56 I77 I84 V86 L93 I95	Y48-L52 HydrophobicContact CD1-CD1 4.07Å; Y48-L52 VanDerWaalsContact O-CB 3.23Å; Y48-L52 WeakPolarHBondContact O-CB 3.47Å; Y48-L52 WeakPolarHBondContact O-CG 3.3Å; Y48-L52 PolarHBondContact O-N 3.15Å; L52-T56 VanDerWaalsContact O-CB 3.3Å; L52-T56 WeakPolarHBondContact O-CB 3.16Å; L52-T56 PolarHBondContact O-N 3.21Å; L52-T56 PolarHBondContact O-OG1 3.47Å; L52-I77 HydrophobicContact CD2-CD1 4.34Å; L52-I84 HydrophobicContact CD1-CG2 3.95Å; L52-I84 HydrophobicContact CD2-CG2 4.41Å; L52-V86 HydrophobicContact CD1-CG2 4.18Å; L52-V86 HydrophobicContact CD2-CG2 4.06Å; L52-L93 HydrophobicContact CB-CD2 4.42Å; L52-I95 HydrophobicContact CB-CD1 4.11Å; L52-I95 HydrophobicContact CB-CG1 4.49Å; L52-I95 HydrophobicContact CD1-CB 4.26Å; L52-I95 HydrophobicContact CD1-CD1 3.68Å; L52-I95 HydrophobicContact CD1-CG1 3.8Å; L52-I95 HydrophobicContact CD1-CG2 3.43Å; L52-I95 VanDerWaalsContact CD1-CG2 3.43Å
53	R	89.5	Confident	90.4	Very high	77 Å²	77	60.6 Å²	60.6	29%	0.291	33%	0.328	S	S	.	.	H	α-helix	trans	-65.2	-49.7	172.4	178.1	53.9	179.5	-81.7	-7.3	112.3	N30 S31 A49 L51 F55 T56 T57 L93	N30-R53 PolarHBondContact O-NH1 3.41Å; S31-R53 PolarHBondContact O-NH1 3.16Å; S31-R53 PolarHBondContact O-NH2 3.3Å; A49-R53 WeakPolarHBondContact O-CB 3.04Å; A49-R53 PolarHBondContact O-N 2.84Å; L51-R53 VanDerWaalsContact C-N 3.3Å; L51-R53 PolarHBondContact O-N 3.32Å; R53-F55 VanDerWaalsContact C-N 3.32Å; R53-F55 PolarHBondContact O-N 3.15Å; R53-T56 PolarHBondContact O-N 2.57Å; R53-T57 PolarHBondContact O-N 3.18Å; R53-T57 VanDerWaalsContact O-N 3.07Å; R53-T57 PolarHBondContact O-OG1 2.86Å; R53-L93 HydrophobicContact CB-CD2 4.43Å
54	S	90.1	Very high	90.6	Very high	70 Å²	70	61.9 Å²	61.9	49%	0.49	32%	0.319	S	S	.	.	H	α-helix	trans	-59.8	-47	176.9	178.9	0	0	0	0	110.4	R50 L51 T56 T57 L58	R50-S54 PolarHBondContact O-N 3.4Å; L51-S54 PolarHBondContact O-N 3.41Å; S54-T56 PolarHBondContact O-N 2.86Å; S54-T57 WeakPolarHBondContact O-CB 3.45Å; S54-T57 PolarHBondContact O-N 3.1Å; S54-L58 PolarHBondContact O-N 2.92Å; S54-L58 VanDerWaalsContact O-N 3.08Å
55	F	91.8	Very high	90.8	Very high	83 Å²	83	66.5 Å²	66.5	36%	0.364	34%	0.342	S	S	.	.	H	α-helix	trans	-58.1	-47	176.6	172.6	-96.3	0	0	0	113	L51 R53 T57 L58 A59 V75 I77	L51-F55 WeakPolarHBondContact O-CB 3.43Å; L51-F55 PolarHBondContact O-N 2.83Å; R53-F55 VanDerWaalsContact C-N 3.32Å; R53-F55 PolarHBondContact O-N 3.15Å; F55-T57 VanDerWaalsContact C-N 3.27Å; F55-T57 PolarHBondContact O-N 2.75Å; F55-L58 PolarHBondContact O-N 2.95Å; F55-A59 WeakPolarHBondContact O-CB 3.25Å; F55-A59 PolarHBondContact O-N 3.11Å; F55-V75 HydrophobicContact CE1-CB 4.32Å; F55-V75 HydrophobicContact CE1-CG1 3.72Å; F55-V75 HydrophobicContact CE1-CG2 4.33Å; F55-V75 HydrophobicContact CZ-CG1 4.06Å; F55-I77 HydrophobicContact CD1-CD1 4.25Å; F55-I77 HydrophobicContact CE1-CD1 3.71Å; F55-I77 HydrophobicContact CE1-CG1 4.43Å; F55-I77 HydrophobicContact CZ-CD1 3.92Å; F55-I77 HydrophobicContact CZ-CG1 4.48Å
56	T	90.2	Very high	90.9	Very high	2 Å²	2	72.7 Å²	72.7	1%	0.012	38%	0.38	C	S	.	.	H	α-helix	trans	-64	-34.6	179.7	-55.7	0	0	0	0	111.6	L52 R53 S54 A59 R60 L72 V86 P88 L93	L52-T56 VanDerWaalsContact O-CB 3.3Å; L52-T56 WeakPolarHBondContact O-CB 3.16Å; L52-T56 PolarHBondContact O-N 3.21Å; L52-T56 PolarHBondContact O-OG1 3.47Å; R53-T56 PolarHBondContact O-N 2.57Å; S54-T56 PolarHBondContact O-N 2.86Å; T56-A59 PolarHBondContact O-N 3.24Å; T56-R60 VanDerWaalsContact O-CB 3.28Å; T56-R60 WeakPolarHBondContact O-CB 3.49Å; T56-R60 PolarHBondContact O-N 2.87Å; T56-L72 HydrophobicContact CG2-CD2 3.88Å; T56-V86 WeakPolarHBondContact OG1-CG1 3.32Å; T56-P88 HydrophobicContact CG2-CB 4.35Å; T56-P88 HydrophobicContact CG2-CG 4.25Å; T56-L93 HydrophobicContact CG2-CD1 3.88Å
57	T	89.5	Confident	90.9	Very high	61 Å²	61	72.9 Å²	72.9	37%	0.374	38%	0.376	S	S	.	.	H	α-helix	trans	-66.4	-43.6	177.1	-54.1	0	0	0	0	111	R53 S54 F55 S61	R53-T57 PolarHBondContact O-N 3.18Å; R53-T57 VanDerWaalsContact O-N 3.07Å; R53-T57 PolarHBondContact O-OG1 2.86Å; S54-T57 WeakPolarHBondContact O-CB 3.45Å; S54-T57 PolarHBondContact O-N 3.1Å; F55-T57 VanDerWaalsContact C-N 3.27Å; F55-T57 PolarHBondContact O-N 2.75Å; T57-S61 PolarHBondContact O-N 2.81Å; T57-S61 VanDerWaalsContact O-N 3.08Å; T57-S61 PolarHBondContact O-OG 3.11Å
58	L	92	Very high	90.9	Very high	118 Å²	118	74.2 Å²	74.2	62%	0.618	39%	0.389	S	S	*	.	H	α-helix	trans	-65.2	-46.3	174.5	-68	171.3	0	0	0	111.5	S54 F55 R60 S61 A62	S54-L58 PolarHBondContact O-N 2.92Å; S54-L58 VanDerWaalsContact O-N 3.08Å; F55-L58 PolarHBondContact O-N 2.95Å; L58-R60 VanDerWaalsContact C-N 3.34Å; L58-R60 PolarHBondContact O-N 2.84Å; L58-S61 PolarHBondContact O-N 2.82Å; L58-S61 VanDerWaalsContact O-N 3.16Å; L58-A62 WeakPolarHBondContact O-CB 3.42Å; L58-A62 PolarHBondContact O-N 3.47Å
59	A	91.9	Very high	90.9	Very high	21 Å²	21	80.5 Å²	80.5	17%	0.174	42%	0.421	C	S	.	.	H	α-helix	trans	-61.1	-42.2	178.7	0	0	0	0	0	111.8	F55 T56 S61 A62 V63 L72	F55-A59 WeakPolarHBondContact O-CB 3.25Å; F55-A59 PolarHBondContact O-N 3.11Å; T56-A59 PolarHBondContact O-N 3.24Å; A59-S61 VanDerWaalsContact C-N 3.33Å; A59-S61 PolarHBondContact O-N 2.58Å; A59-A62 PolarHBondContact O-N 3.16Å; A59-V63 WeakPolarHBondContact O-CG2 3.38Å; A59-V63 PolarHBondContact O-N 2.94Å; A59-L72 HydrophobicContact CB-CD2 3.89Å
60	R	90	Very high	90.7	Very high	76 Å²	76	84.5 Å²	84.5	29%	0.287	44%	0.442	S	S	.	.	H	α-helix	trans	-62.3	-42.2	175.2	-176.2	-175.7	-64.7	139.2	-2	111.5	T56 L58 V63 R64 L72	T56-R60 VanDerWaalsContact O-CB 3.28Å; T56-R60 WeakPolarHBondContact O-CB 3.49Å; T56-R60 PolarHBondContact O-N 2.87Å; L58-R60 VanDerWaalsContact C-N 3.34Å; L58-R60 PolarHBondContact O-N 2.84Å; R60-V63 PolarHBondContact O-N 2.9Å; R60-R64 WeakPolarHBondContact O-CG 3.47Å; R60-R64 PolarHBondContact O-N 3.34Å; R60-R64 VanDerWaalsContact O-N 3.08Å; R60-L72 HydrophobicContact CB-CB 4.21Å; R60-L72 HydrophobicContact CB-CD2 4.21Å; R60-L72 HydrophobicContact CG-CB 4.36Å
61	S	91.3	Very high	90.5	Very high	57 Å²	57	80.3 Å²	80.3	40%	0.399	43%	0.433	S	S	.	.	H	α-helix	trans	-63.8	-47.5	177.9	-52.8	0	0	0	0	110.4	T57 L58 A59 V63 R64 D65	T57-S61 PolarHBondContact O-N 2.81Å; T57-S61 VanDerWaalsContact O-N 3.08Å; T57-S61 PolarHBondContact O-OG 3.11Å; L58-S61 PolarHBondContact O-N 2.82Å; L58-S61 VanDerWaalsContact O-N 3.16Å; A59-S61 VanDerWaalsContact C-N 3.33Å; A59-S61 PolarHBondContact O-N 2.58Å; S61-V63 VanDerWaalsContact C-N 3.35Å; S61-V63 PolarHBondContact O-N 3.47Å; S61-R64 PolarHBondContact O-N 3Å; S61-R64 VanDerWaalsContact O-N 3.1Å; S61-D65 PolarHBondContact O-N 3.41Å
62	A	92.5	Very high	90.2	Very high	53 Å²	53	77 Å²	77	44%	0.438	42%	0.415	S	S	.	.	H	α-helix	trans	-60.9	-38.5	177.4	0	0	0	0	0	113.4	L58 A59 D65 V66	L58-A62 WeakPolarHBondContact O-CB 3.42Å; L58-A62 PolarHBondContact O-N 3.47Å; A59-A62 PolarHBondContact O-N 3.16Å; A62-D65 PolarHBondContact O-N 3Å; A62-V66 WeakPolarHBondContact O-CG2 3.41Å; A62-V66 PolarHBondContact O-N 3.01Å
63	V	91.2	Very high	90	Very high	41 Å²	41	80.2 Å²	80.2	25%	0.248	44%	0.436	C	S	.	.	H	α-helix	trans	-64.2	-43.1	174.3	169.9	0	0	0	0	111	A59 R60 S61 D65 V66 D67 N70 L72	A59-V63 WeakPolarHBondContact O-CG2 3.38Å; A59-V63 PolarHBondContact O-N 2.94Å; R60-V63 PolarHBondContact O-N 2.9Å; S61-V63 VanDerWaalsContact C-N 3.35Å; S61-V63 PolarHBondContact O-N 3.47Å; V63-D65 VanDerWaalsContact C-N 3.34Å; V63-D65 PolarHBondContact O-N 3.27Å; V63-V66 PolarHBondContact O-N 3.08Å; V63-D67 PolarHBondContact O-N 3.19Å; V63-N70 HydrophobicContact CG1-CB 4.08Å; V63-L72 HydrophobicContact CG2-CD1 4.14Å
64	R	90.6	Very high	89.9	Confident	119 Å²	119	82.1 Å²	82.1	45%	0.449	45%	0.446	S	S	.	.	H	α-helix	trans	-68.6	-31.1	178.3	-72.2	175.9	177.5	-169.2	-4.3	113.4	R60 S61 V66 D67 P68 D71	R60-R64 WeakPolarHBondContact O-CG 3.47Å; R60-R64 PolarHBondContact O-N 3.34Å; R60-R64 VanDerWaalsContact O-N 3.08Å; S61-R64 PolarHBondContact O-N 3Å; S61-R64 VanDerWaalsContact O-N 3.1Å; R64-V66 VanDerWaalsContact C-N 3.27Å; R64-D67 CarbonylContact O-C 3.55Å; R64-P68 WeakPolarHBondContact O-CA 3.21Å; R64-D71 IonicContact CZ-OD1 2.82Å; R64-D71 IonicContact NE-OD1 3.98Å; R64-D71 PolarHBondContact NE-OD1 3Å; R64-D71 IonicContact NH2-OD1 2.83Å; R64-D71 PolarHBondContact NH2-OD1 2.89Å
65	D	93.1	Very high	89.9	Confident	138 Å²	138	80 Å²	80	74%	0.738	43%	0.43	S	S	*	.	H	α-helix	trans	-67.9	-29.7	174.5	-66.8	-22.4	0	0	0	111.6	S61 A62 V63	S61-D65 PolarHBondContact O-N 3.41Å; A62-D65 PolarHBondContact O-N 3Å; V63-D65 VanDerWaalsContact C-N 3.34Å; V63-D65 PolarHBondContact O-N 3.27Å
66	V	93.3	Very high	89.9	Confident	130 Å²	130	83.5 Å²	83.5	79%	0.788	44%	0.441	S	S	*	.	H	α-helix	trans	-80.6	-48.6	175.2	173.6	0	0	0	0	111.4	A62 V63 R64	A62-V66 WeakPolarHBondContact O-CG2 3.41Å; A62-V66 PolarHBondContact O-N 3.01Å; V63-V66 PolarHBondContact O-N 3.08Å; R64-V66 VanDerWaalsContact C-N 3.27Å
67	D	91.3	Very high	89.9	Confident	68 Å²	68	85.9 Å²	85.9	36%	0.364	45%	0.453	S	S	.	.			trans	-144	111.5	175.6	-174.9	-12.2	0	0	0	110.2	V63 R64 Q69 N70	V63-D67 PolarHBondContact O-N 3.19Å; R64-D67 CarbonylContact O-C 3.55Å; D67-Q69 PolarHBondContact O-N 3.31Å; D67-Q69 WeakPolarHBondContact OD1-CB 3.47Å; D67-Q69 PolarHBondContact OD1-N 3.42Å; D67-N70 HydrophobicContact CB-CB 4.17Å; D67-N70 PolarHBondContact O-N 3.21Å; D67-N70 VanDerWaalsContact O-N 3.1Å
68	P	89.9	Confident	90	Very high	112 Å²	112	90.6 Å²	90.6	73%	0.727	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-14.2	-178.8	28.4	-35.3	0	0	0	113.6	R64	R64-P68 WeakPolarHBondContact O-CA 3.21Å
69	Q	90.1	Very high	89.9	Confident	182 Å²	182	87.5 Å²	87.5	85%	0.85	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	-11.9	175.3	-58.7	-156.1	-42.5	0	0	113	D67	D67-Q69 PolarHBondContact O-N 3.31Å; D67-Q69 WeakPolarHBondContact OD1-CB 3.47Å; D67-Q69 PolarHBondContact OD1-N 3.42Å
70	N	86.7	Confident	89.7	Confident	84 Å²	84	96.3 Å²	96.3	45%	0.449	49%	0.487	S	S	.	.			trans	-96.4	127.8	179.6	-157.7	150	0	0	0	110.9	V63 D67	V63-N70 HydrophobicContact CG1-CB 4.08Å; D67-N70 HydrophobicContact CB-CB 4.17Å; D67-N70 PolarHBondContact O-N 3.21Å; D67-N70 VanDerWaalsContact O-N 3.1Å
71	D	84	Confident	89.4	Confident	87 Å²	87	101.5 Å²	101.5	47%	0.465	51%	0.511	S	S	.	.			trans	-99.9	145.5	167.4	-85.1	-55.2	0	0	0	112.5	R64 T73	R64-D71 IonicContact CZ-OD1 2.82Å; R64-D71 IonicContact NE-OD1 3.98Å; R64-D71 PolarHBondContact NE-OD1 3Å; R64-D71 IonicContact NH2-OD1 2.83Å; R64-D71 PolarHBondContact NH2-OD1 2.89Å; D71-T73 PolarHBondContact O-N 3.04Å; D71-T73 VanDerWaalsContact O-N 3.16Å
72	L	85.1	Confident	89.3	Confident	25 Å²	25	101.3 Å²	101.3	13%	0.131	50%	0.504	C	S	.	.			trans	-68.9	111.1	175.1	-178.8	71.6	0	0	0	110	T56 A59 R60 V63 V75 P88	T56-L72 HydrophobicContact CG2-CD2 3.88Å; A59-L72 HydrophobicContact CB-CD2 3.89Å; R60-L72 HydrophobicContact CB-CB 4.21Å; R60-L72 HydrophobicContact CB-CD2 4.21Å; R60-L72 HydrophobicContact CG-CB 4.36Å; V63-L72 HydrophobicContact CG2-CD1 4.14Å; L72-V75 HydrophobicContact CD1-CG2 3.76Å; L72-V75 HydrophobicContact CD2-CG2 3.8Å; L72-V75 HydrophobicContact CG-CG2 4.15Å; L72-P88 WeakPolarHBondContact O-CG 3.42Å
73	T	86.3	Confident	89.2	Confident	81 Å²	81	99.4 Å²	99.4	50%	0.497	49%	0.486	S	S	.	.			trans	-90.5	-42.4	-179.8	50.1	0	0	0	0	112.6	F3 D71 P88	F3-T73 WeakPolarHBondContact CZ-O 3.31Å; D71-T73 PolarHBondContact O-N 3.04Å; D71-T73 VanDerWaalsContact O-N 3.16Å; T73-P88 WeakPolarHBondContact O-CD 3.46Å
74	F	87.1	Confident	89.2	Confident	116 Å²	116	98 Å²	98	51%	0.509	48%	0.478	S	S	.	.			trans	-156.2	155.1	177.6	68.2	-85.5	0	0	0	112.3	F3 V86	F3-F74 HydrophobicContact CD2-CB 4.24Å; F3-F74 HydrophobicContact CD2-CD1 4.43Å; F3-F74 HydrophobicContact CD2-CG 4.43Å; F3-F74 HydrophobicContact CE1-CB 4.49Å; F3-F74 HydrophobicContact CE2-CB 3.33Å; F3-F74 HydrophobicContact CE2-CD1 4.27Å; F3-F74 AromaticContact CE2-CG 3.95Å; F3-F74 HydrophobicContact CE2-CG 3.95Å; F3-F74 HydrophobicContact CZ-CB 3.48Å; F3-F74 VanDerWaalsContact CZ-CB 3.48Å; F3-F74 HydrophobicContact CZ-CG 4.39Å; F74-V86 CarbonylContact C-O 3.56Å; F74-V86 WeakPolarHBondContact CA-O 3.48Å
75	V	89.8	Confident	89.2	Confident	25 Å²	25	94.1 Å²	94.1	15%	0.152	47%	0.465	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	135.3	170.3	-172.4	0	0	0	0	109.3	F55 L72 I77 L85 V86	F55-V75 HydrophobicContact CE1-CB 4.32Å; F55-V75 HydrophobicContact CE1-CG1 3.72Å; F55-V75 HydrophobicContact CE1-CG2 4.33Å; F55-V75 HydrophobicContact CZ-CG1 4.06Å; L72-V75 HydrophobicContact CD1-CG2 3.76Å; L72-V75 HydrophobicContact CD2-CG2 3.8Å; L72-V75 HydrophobicContact CG-CG2 4.15Å; V75-I77 HydrophobicContact CG1-CD1 4.5Å; V75-I77 HydrophobicContact CG1-CG1 3.91Å; V75-L85 CarbonylContact O-C 3.59Å; V75-L85 WeakPolarHBondContact O-CA 3.34Å; V75-V86 HydrophobicContact CB-CB 4.38Å; V75-V86 PolarHBondContact N-O 2.76Å; V75-V86 PolarHBondContact O-N 2.86Å
76	R	92	Very high	89.1	Confident	157 Å²	157	87.6 Å²	87.6	59%	0.592	43%	0.43	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.6	115	174.5	-173.1	174.2	79	140.1	-9.6	109.5	E83 I84 L85	R76-E83 WeakPolarHBondContact CD-OE1 3.49Å; R76-E83 HydrophobicContact CG-CG 4.26Å; R76-E83 IonicContact CZ-OE1 3.18Å; R76-E83 IonicContact NE-OE1 3.73Å; R76-E83 IonicContact NH1-OE1 3.21Å; R76-E83 PolarHBondContact NH1-OE1 3.08Å; R76-E83 VanDerWaalsContact NH1-OE1 3.11Å; R76-I84 CarbonylContact C-O 3.36Å; R76-I84 WeakPolarHBondContact CA-O 3.28Å; R76-L85 HydrophobicContact CG-CG 4.25Å
77	I	91.3	Very high	88.9	Confident	53 Å²	53	81.7 Å²	81.7	27%	0.272	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	107	-179	-49.9	176.7	0	0	0	107.7	L52 F55 V75 E83 I84	L52-I77 HydrophobicContact CD2-CD1 4.34Å; F55-I77 HydrophobicContact CD1-CD1 4.25Å; F55-I77 HydrophobicContact CE1-CD1 3.71Å; F55-I77 HydrophobicContact CE1-CG1 4.43Å; F55-I77 HydrophobicContact CZ-CD1 3.92Å; F55-I77 HydrophobicContact CZ-CG1 4.48Å; V75-I77 HydrophobicContact CG1-CD1 4.5Å; V75-I77 HydrophobicContact CG1-CG1 3.91Å; I77-E83 CarbonylContact O-C 3.59Å; I77-E83 WeakPolarHBondContact O-CA 3.39Å; I77-I84 HydrophobicContact CB-CB 4.37Å; I77-I84 PolarHBondContact N-O 3.23Å; I77-I84 PolarHBondContact O-N 2.8Å
78	R	91.6	Very high	88.7	Confident	159 Å²	159	79.6 Å²	79.6	60%	0.6	39%	0.386	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.7	118.6	175.6	-172.2	177.3	177.8	106.2	-2.8	110	E83 P100	R78-E83 HydrophobicContact CB-CG 4.41Å; R78-E83 IonicContact CZ-OE2 3.42Å; R78-E83 IonicContact NH1-OE2 2.77Å; R78-E83 PolarHBondContact NH1-OE2 2.9Å; R78-P100 PolarHBondContact NH2-O 3.07Å
79	S	88.9	Confident	88.4	Confident	53 Å²	53	77.4 Å²	77.4	37%	0.371	37%	0.365	S	S	.	.			trans	-109.5	168.5	170.1	-59.7	0	0	0	0	110.3	K81 Q82 P100	S79-K81 PolarHBondContact O-N 2.77Å; S79-Q82 WeakPolarHBondContact CA-O 3.41Å; S79-Q82 VanDerWaalsContact CB-O 3.22Å; S79-Q82 WeakPolarHBondContact CB-O 3.47Å; S79-Q82 PolarHBondContact N-O 3.18Å; S79-P100 WeakPolarHBondContact O-CG 3.36Å
80	K	87.7	Confident	87.6	Confident	206 Å²	206	75.1 Å²	75.1	90%	0.896	36%	0.359	S	S	*	.	S	Bend	trans	-62.5	-27.1	175.5	-66.5	-174.2	179.2	-178.4	0	113.5
81	K	84.9	Confident	87.2	Confident	185 Å²	185	77.1 Å²	77.1	80%	0.804	37%	0.37	S	S	*	.	S	Bend	trans	-104.6	-27.3	-175.9	-65.3	-174.5	177.3	-177.1	0	114.1	S79 P100	S79-K81 PolarHBondContact O-N 2.77Å; K81-P100 WeakPolarHBondContact O-CD 3.5Å
82	Q	87.3	Confident	87.3	Confident	53 Å²	53	77.8 Å²	77.8	25%	0.248	37%	0.369	C	S	.	.			trans	-152.8	146.8	-172.8	58.8	-174.4	-9.6	0	0	111	Y48 S79 I84 I97 Q98 P100	Y48-Q82 PolarHBondContact OH-NE2 2.83Å; Y48-Q82 PolarHBondContact OH-OE1 2.9Å; S79-Q82 WeakPolarHBondContact CA-O 3.41Å; S79-Q82 VanDerWaalsContact CB-O 3.22Å; S79-Q82 WeakPolarHBondContact CB-O 3.47Å; S79-Q82 PolarHBondContact N-O 3.18Å; Q82-I84 HydrophobicContact CG-CD1 4.44Å; Q82-I84 HydrophobicContact CG-CG1 4.34Å; Q82-I97 HydrophobicContact CB-CG2 4.42Å; Q82-Q98 CarbonylContact C-O 3.6Å; Q82-Q98 WeakPolarHBondContact CA-O 3.26Å; Q82-P100 VanDerWaalsContact CA-CD 3.42Å
83	E	90.9	Very high	87.4	Confident	14 Å²	14	77 Å²	77	7%	0.065	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	123.7	168.7	-173.3	161.8	155.1	0	0	108.1	R76 I77 R78 L85 Q98 P100	R76-E83 WeakPolarHBondContact CD-OE1 3.49Å; R76-E83 HydrophobicContact CG-CG 4.26Å; R76-E83 IonicContact CZ-OE1 3.18Å; R76-E83 IonicContact NE-OE1 3.73Å; R76-E83 IonicContact NH1-OE1 3.21Å; R76-E83 PolarHBondContact NH1-OE1 3.08Å; R76-E83 VanDerWaalsContact NH1-OE1 3.11Å; I77-E83 CarbonylContact O-C 3.59Å; I77-E83 WeakPolarHBondContact O-CA 3.39Å; R78-E83 HydrophobicContact CB-CG 4.41Å; R78-E83 IonicContact CZ-OE2 3.42Å; R78-E83 IonicContact NH1-OE2 2.77Å; R78-E83 PolarHBondContact NH1-OE2 2.9Å; E83-L85 HydrophobicContact CG-CD1 4.13Å; E83-Q98 HydrophobicContact CB-CB 4.4Å; E83-Q98 PolarHBondContact N-O 3.42Å; E83-Q98 PolarHBondContact O-N 2.74Å; E83-P100 HydrophobicContact CB-CB 4.44Å
84	I	91.8	Very high	87.6	Confident	12 Å²	12	73.9 Å²	73.9	6%	0.062	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	122.6	-177.8	-52.7	176.5	0	0	0	107.8	Y48 L52 R76 I77 Q82 V86 I95 V96	Y48-I84 HydrophobicContact CE1-CD1 4.06Å; L52-I84 HydrophobicContact CD1-CG2 3.95Å; L52-I84 HydrophobicContact CD2-CG2 4.41Å; R76-I84 CarbonylContact C-O 3.36Å; R76-I84 WeakPolarHBondContact CA-O 3.28Å; I77-I84 HydrophobicContact CB-CB 4.37Å; I77-I84 PolarHBondContact N-O 3.23Å; I77-I84 PolarHBondContact O-N 2.8Å; Q82-I84 HydrophobicContact CG-CD1 4.44Å; Q82-I84 HydrophobicContact CG-CG1 4.34Å; I84-V86 HydrophobicContact CG2-CG2 3.92Å; I84-I95 HydrophobicContact CG2-CG2 4Å; I84-V96 WeakPolarHBondContact CA-O 3.44Å
85	L	91	Very high	87.8	Confident	36 Å²	36	68.4 Å²	68.4	19%	0.188	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	128.4	172.3	-63.3	82.4	0	0	0	108	V75 R76 E83 I95 V96 Q98	V75-L85 CarbonylContact O-C 3.59Å; V75-L85 WeakPolarHBondContact O-CA 3.34Å; R76-L85 HydrophobicContact CG-CG 4.25Å; E83-L85 HydrophobicContact CG-CD1 4.13Å; L85-I95 CarbonylContact O-C 3.45Å; L85-I95 WeakPolarHBondContact O-CA 3.4Å; L85-V96 HydrophobicContact CB-CB 4.27Å; L85-V96 PolarHBondContact N-O 3.2Å; L85-V96 PolarHBondContact O-N 2.88Å; L85-Q98 HydrophobicContact CD1-CG 4Å
86	V	90.5	Very high	87.8	Confident	1 Å²	1	67.4 Å²	67.4	1%	0.006	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	124.7	179.2	-172.1	0	0	0	0	108.5	L52 T56 F74 V75 I84 L93 L94 I95	L52-V86 HydrophobicContact CD1-CG2 4.18Å; L52-V86 HydrophobicContact CD2-CG2 4.06Å; T56-V86 WeakPolarHBondContact OG1-CG1 3.32Å; F74-V86 CarbonylContact C-O 3.56Å; F74-V86 WeakPolarHBondContact CA-O 3.48Å; V75-V86 HydrophobicContact CB-CB 4.38Å; V75-V86 PolarHBondContact N-O 2.76Å; V75-V86 PolarHBondContact O-N 2.86Å; I84-V86 HydrophobicContact CG2-CG2 3.92Å; V86-L93 HydrophobicContact CG1-CD1 3.7Å; V86-L93 HydrophobicContact CG1-CD2 4.16Å; V86-L93 HydrophobicContact CG1-CG 3.89Å; V86-L94 CarbonylContact C-O 3.55Å; V86-L94 WeakPolarHBondContact CA-O 3.37Å; V86-I95 HydrophobicContact CG1-CG1 4.41Å
87	A	88.5	Confident	87.7	Confident	7 Å²	7	60.1 Å²	60.1	6%	0.058	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	107.7	-178.4	0	0	0	0	0	109	F3 L94	F3-A87 HydrophobicContact CE1-CB 4.37Å; F3-A87 HydrophobicContact CE2-CB 3.89Å; F3-A87 HydrophobicContact CZ-CB 3.38Å; A87-L94 HydrophobicContact CB-CB 4.22Å; A87-L94 PolarHBondContact N-O 2.8Å; A87-L94 PolarHBondContact O-N 3.23Å
88	P	87	Confident	87.7	Confident	24 Å²	24	59.2 Å²	59.2	16%	0.156	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	124.5	167.6	29.4	-32.2	0	0	0	110.7	T56 L72 T73 L93	T56-P88 HydrophobicContact CG2-CB 4.35Å; T56-P88 HydrophobicContact CG2-CG 4.25Å; L72-P88 WeakPolarHBondContact O-CG 3.42Å; T73-P88 WeakPolarHBondContact O-CD 3.46Å; P88-L93 HydrophobicContact CB-CD1 4.07Å
89	E	83.3	Confident	87.6	Confident	65 Å²	65	54.7 Å²	54.7	30%	0.304	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	123.4	178.7	-177.6	174.2	-170.3	0	0	110.8	L6 N91 F92	L6-E89 WeakPolarHBondContact CD2-OE2 3.12Å; E89-N91 VanDerWaalsContact C-N 3.32Å; E89-N91 PolarHBondContact O-N 3.43Å; E89-N91 VanDerWaalsContact O-N 3.08Å; E89-F92 PolarHBondContact N-O 2.73Å; E89-F92 WeakPolarHBondContact O-CA 3.29Å; E89-F92 WeakPolarHBondContact O-CB 3.23Å; E89-F92 PolarHBondContact O-N 2.94Å
90	N	73.8	Confident	87.2	Confident	134 Å²	134	53 Å²	53	72%	0.717	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	41.2	51.8	170.7	-63.7	-35.4	0	0	0	115	F92	N90-F92 VanDerWaalsContact O-CD2 3.23Å; N90-F92 WeakPolarHBondContact O-CD2 3.42Å; N90-F92 PolarHBondContact O-N 2.88Å
91	N	79.3	Confident	86.4	Confident	126 Å²	126	47.9 Å²	47.9	67%	0.674	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	71.5	2.4	-176.9	-69.3	1.8	0	0	0	116.9	N30 S31 E89	N30-N91 CarbonylContact C-O 3.56Å; S31-N91 WeakPolarHBondContact CA-O 3.41Å; S31-N91 WeakPolarHBondContact CB-O 3.47Å; S31-N91 PolarHBondContact N-O 3.09Å; E89-N91 VanDerWaalsContact C-N 3.32Å; E89-N91 PolarHBondContact O-N 3.43Å; E89-N91 VanDerWaalsContact O-N 3.08Å
92	F	85.5	Confident	85	Confident	102 Å²	102	47.6 Å²	47.6	45%	0.447	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	156.3	168.5	-57	-81.4	0	0	0	111	I28 V29 I36 E89 N90	I28-F92 HydrophobicContact CG2-CD1 4.42Å; V29-F92 CarbonylContact O-C 3.53Å; V29-F92 WeakPolarHBondContact O-CA 3.35Å; I36-F92 HydrophobicContact CD1-CD1 3.6Å; I36-F92 HydrophobicContact CD1-CE1 3.38Å; E89-F92 PolarHBondContact N-O 2.73Å; E89-F92 WeakPolarHBondContact O-CA 3.29Å; E89-F92 WeakPolarHBondContact O-CB 3.23Å; E89-F92 PolarHBondContact O-N 2.94Å; N90-F92 VanDerWaalsContact O-CD2 3.23Å; N90-F92 WeakPolarHBondContact O-CD2 3.42Å; N90-F92 PolarHBondContact O-N 2.88Å
93	L	88.2	Confident	84.9	Confident	7 Å²	7	47.3 Å²	47.3	4%	0.037	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	111	171.8	-163.9	78	0	0	0	107.6	V29 L52 R53 T56 V86 P88 I95	V29-L93 HydrophobicContact CB-CB 4.16Å; V29-L93 PolarHBondContact N-O 2.9Å; V29-L93 PolarHBondContact O-N 2.8Å; L52-L93 HydrophobicContact CB-CD2 4.42Å; R53-L93 HydrophobicContact CB-CD2 4.43Å; T56-L93 HydrophobicContact CG2-CD1 3.88Å; V86-L93 HydrophobicContact CG1-CD1 3.7Å; V86-L93 HydrophobicContact CG1-CD2 4.16Å; V86-L93 HydrophobicContact CG1-CG 3.89Å; P88-L93 HydrophobicContact CB-CD1 4.07Å; L93-I95 HydrophobicContact CD2-CD1 4.06Å; L93-I95 HydrophobicContact CD2-CG1 4.2Å; L93-I95 HydrophobicContact CG-CG1 4.33Å
94	L	89.4	Confident	84.6	Confident	17 Å²	17	49.1 Å²	49.1	9%	0.089	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	126.7	172	178.2	66.4	0	0	0	108.8	L6 L14 I28 V86 A87 V96	L6-L94 HydrophobicContact CD1-CD2 4.44Å; L6-L94 HydrophobicContact CD2-CD2 4.14Å; L14-L94 HydrophobicContact CD2-CD1 3.58Å; I28-L94 HydrophobicContact CG1-CD1 4.05Å; V86-L94 CarbonylContact C-O 3.55Å; V86-L94 WeakPolarHBondContact CA-O 3.37Å; A87-L94 HydrophobicContact CB-CB 4.22Å; A87-L94 PolarHBondContact N-O 2.8Å; A87-L94 PolarHBondContact O-N 3.23Å; L94-V96 HydrophobicContact CD1-CG2 4.48Å; L94-V96 HydrophobicContact CD2-CG2 4.44Å; L94-V96 HydrophobicContact CG-CG2 4.21Å
95	I	90.4	Very high	84.2	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	126.8	176.9	-59.1	155.2	0	0	0	107.2	T26 I27 V29 L52 I84 L85 V86 L93 I97	T26-I95 CarbonylContact C-O 3.59Å; T26-I95 WeakPolarHBondContact CA-O 3.33Å; I27-I95 HydrophobicContact CB-CB 4.16Å; I27-I95 HydrophobicContact CB-CD1 4.42Å; I27-I95 HydrophobicContact CG2-CD1 4.44Å; I27-I95 PolarHBondContact N-O 2.98Å; I27-I95 PolarHBondContact O-N 3.12Å; V29-I95 HydrophobicContact CG2-CD1 3.84Å; L52-I95 HydrophobicContact CB-CD1 4.11Å; L52-I95 HydrophobicContact CB-CG1 4.49Å; L52-I95 HydrophobicContact CD1-CB 4.26Å; L52-I95 HydrophobicContact CD1-CD1 3.68Å; L52-I95 HydrophobicContact CD1-CG1 3.8Å; L52-I95 HydrophobicContact CD1-CG2 3.43Å; L52-I95 VanDerWaalsContact CD1-CG2 3.43Å; I84-I95 HydrophobicContact CG2-CG2 4Å; L85-I95 CarbonylContact O-C 3.45Å; L85-I95 WeakPolarHBondContact O-CA 3.4Å; V86-I95 HydrophobicContact CG1-CG1 4.41Å; L93-I95 HydrophobicContact CD2-CD1 4.06Å; L93-I95 HydrophobicContact CD2-CG1 4.2Å; L93-I95 HydrophobicContact CG-CG1 4.33Å; I95-I97 HydrophobicContact CG2-CG1 4.32Å
96	V	90.5	Very high	83.8	Confident	5 Å²	5	52 Å²	52	3%	0.03	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	127.8	175.6	-174.2	0	0	0	0	108	I17 V23 T26 I84 L85 L94 Q98	I17-V96 HydrophobicContact CG2-CG1 3.78Å; I17-V96 HydrophobicContact CG2-CG2 4.2Å; V23-V96 HydrophobicContact CG1-CG1 4.05Å; T26-V96 HydrophobicContact CG2-CG1 4.41Å; T26-V96 HydrophobicContact CG2-CG2 4.45Å; I84-V96 WeakPolarHBondContact CA-O 3.44Å; L85-V96 HydrophobicContact CB-CB 4.27Å; L85-V96 PolarHBondContact N-O 3.2Å; L85-V96 PolarHBondContact O-N 2.88Å; L94-V96 HydrophobicContact CD1-CG2 4.48Å; L94-V96 HydrophobicContact CD2-CG2 4.44Å; L94-V96 HydrophobicContact CG-CG2 4.21Å; V96-Q98 HydrophobicContact CG1-CG 3.9Å
97	I	90.9	Very high	83.4	Confident	4 Å²	4	55.2 Å²	55.2	2%	0.021	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	126.1	177.7	-51.1	-170.9	0	0	0	107.9	I24 G25 L40 Y48 Q82 I95	I24-I97 HydrophobicContact CB-CG2 4.28Å; I24-I97 HydrophobicContact CD1-CG2 4.27Å; I24-I97 PolarHBondContact N-O 2.93Å; G25-I97 PolarHBondContact N-O 2.92Å; G25-I97 PolarHBondContact O-N 3.33Å; L40-I97 HydrophobicContact CD1-CD1 3.61Å; L40-I97 HydrophobicContact CD1-CG1 4.42Å; Y48-I97 HydrophobicContact CD1-CD1 4.42Å; Y48-I97 HydrophobicContact CD2-CD1 4.12Å; Y48-I97 HydrophobicContact CE1-CD1 4.26Å; Y48-I97 HydrophobicContact CE2-CD1 3.96Å; Y48-I97 HydrophobicContact CG-CD1 4.38Å; Q82-I97 HydrophobicContact CB-CG2 4.42Å; I95-I97 HydrophobicContact CG2-CG1 4.32Å
98	Q	90.3	Very high	83	Confident	34 Å²	34	58.4 Å²	58.4	16%	0.159	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	156.3	-176.9	-53.9	-173.2	-20	0	0	110.6	G22 V23 Q82 E83 L85 V96	G22-Q98 CarbonylContact O-C 3.58Å; G22-Q98 WeakPolarHBondContact O-CA 3.23Å; V23-Q98 HydrophobicContact CG2-CG 4.08Å; Q82-Q98 CarbonylContact C-O 3.6Å; Q82-Q98 WeakPolarHBondContact CA-O 3.26Å; E83-Q98 HydrophobicContact CB-CB 4.4Å; E83-Q98 PolarHBondContact N-O 3.42Å; E83-Q98 PolarHBondContact O-N 2.74Å; L85-Q98 HydrophobicContact CD1-CG 4Å; V96-Q98 HydrophobicContact CG1-CG 3.9Å
99	N	89.3	Confident	82.7	Confident	63 Å²	63	60.9 Å²	60.9	34%	0.337	32%	0.318	S	S	.	.			trans	-84.3	123.5	170.9	-168.4	-19.1	0	0	0	109.3	G22 I24 S101	G22-N99 PolarHBondContact O-N 3.32Å; I24-N99 HydrophobicContact CD1-CB 4.1Å; I24-N99 HydrophobicContact CG1-CB 4.33Å; N99-S101 PolarHBondContact O-N 2.83Å; N99-S101 PolarHBondContact OD1-N 2.82Å; N99-S101 VanDerWaalsContact OD1-N 3.13Å
100	P	80.3	Confident	82.7	Confident	17 Å²	17	60.5 Å²	60.5	11%	0.11	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-7.9	-179.1	30.2	-39.1	0	0	0	113.9	R78 S79 K81 Q82 E83	R78-P100 PolarHBondContact NH2-O 3.07Å; S79-P100 WeakPolarHBondContact O-CG 3.36Å; K81-P100 WeakPolarHBondContact O-CD 3.5Å; Q82-P100 VanDerWaalsContact CA-CD 3.42Å; E83-P100 HydrophobicContact CB-CB 4.44Å
101	S	71.8	Confident	83.4	Confident	99 Å²	99	54.4 Å²	54.4	69%	0.692	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.5	1.2	-174	-44.5	0	0	0	0	114.2	N99	N99-S101 PolarHBondContact O-N 2.83Å; N99-S101 PolarHBondContact OD1-N 2.82Å; N99-S101 VanDerWaalsContact OD1-N 3.13Å
102	E	55.5	Low	83.8	Confident	179 Å²	179	47.9 Å²	47.9	84%	0.836	25%	0.251	S	S	*	.			trans	-94.5	0	169.8	-81.5	-95.9	120.6	0	0	111.1

Retrieved 102 of 102 residues in 219.7 ms (Link to these results)

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