A0A087WZC9_HUMAN Loading...

TAR DNA binding protein

AlphaFold DB , UniProt , Accession A0A087WZC9, Species HUMAN (Homo sapiens, Human), Gene TARDBP, Length 127 aa.

						>A0A087WZC9_HUMAN|A0A087WZC9|TARDBP
CKLPNSKQSQDEPLRSRKVFVGRCTEDMTEDELREFFSQYGDVMDVFIPKPFRAFAFVTFADDQIAQSLCGEDLIIKGISVHISNAEPKHNSNRQLERSGRFGGNPGILSTCFLIQEFVITHHRPRL
					

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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	C	44.3	Very low	44.7	Very low	178 Å²	178	142 Å²	142	100%	1.203	76%	0.759	S	S	*	*				0	114.8	0	-58	0	0	0	0	110.3
2	K	42.2	Very low	45.1	Very low	214 Å²	214	136.9 Å²	136.9	93%	0.93	73%	0.728	S	S	*	*			trans	167.3	86.2	147.8	-92.9	162.4	-174.5	174.1	0	110.1
3	L	45.3	Very low	45.5	Very low	168 Å²	168	131.8 Å²	131.8	88%	0.88	71%	0.707	S	S	*	*			trans	-120.5	154.7	147.1	-82.2	158.7	0	0	0	105.4
4	P	51.1	Low	45.8	Very low	105 Å²	105	129.4 Å²	129.4	68%	0.682	69%	0.693	S	S	*	*			cis	-134.7	139.8	0.1	33.2	-13.9	0	0	0	113.2	S6	P4-S6 PolarHBondContact O-N 2.89Å; P4-S6 VanDerWaalsContact O-N 3.15Å
5	N	39.5	Very low	46.6	Very low	144 Å²	144	126.7 Å²	126.7	77%	0.77	67%	0.669	S	S	*	*			trans	-86.9	70.5	162	-169.2	63	0	0	0	108.7	K7	N5-K7 VanDerWaalsContact C-N 3.31Å; N5-K7 PolarHBondContact O-N 3.1Å
6	S	46.8	Very low	47.7	Very low	92 Å²	92	121.1 Å²	121.1	64%	0.643	64%	0.644	S	S	*	*			trans	-84.1	83.1	166.4	-156.7	0	0	0	0	107.9	P4 Q8	P4-S6 PolarHBondContact O-N 2.89Å; P4-S6 VanDerWaalsContact O-N 3.15Å; S6-Q8 VanDerWaalsContact C-N 3.28Å
7	K	45.2	Very low	49.6	Very low	172 Å²	172	118 Å²	118	75%	0.748	62%	0.621	S	S	*	*			trans	-101.7	51.3	157.3	-78.9	-179.3	177.5	161	0	108.5	N5 S9	N5-K7 VanDerWaalsContact C-N 3.31Å; N5-K7 PolarHBondContact O-N 3.1Å; K7-S9 PolarHBondContact O-N 2.89Å; K7-S9 VanDerWaalsContact O-N 3.15Å
8	Q	44.9	Very low	51.6	Low	148 Å²	148	115.6 Å²	115.6	69%	0.692	61%	0.605	S	S	*	*			trans	-79.1	81	151.6	-148.4	170.5	26.5	0	0	104.3	S6 Q10 E12	S6-Q8 VanDerWaalsContact C-N 3.28Å; Q8-Q10 PolarHBondContact O-N 3.1Å; Q8-E12 HydrophobicContact CG-CG 4.2Å
9	S	42.4	Very low	53.5	Low	69 Å²	69	109.6 Å²	109.6	48%	0.483	57%	0.573	S	S	.	*			trans	-48.4	128.8	176.5	-67.5	0	0	0	0	107.8	K7 D11 E12	K7-S9 PolarHBondContact O-N 2.89Å; K7-S9 VanDerWaalsContact O-N 3.15Å; S9-D11 PolarHBondContact O-N 2.84Å; S9-E12 PolarHBondContact O-N 3.09Å
10	Q	43.2	Very low	55.2	Low	196 Å²	196	107.3 Å²	107.3	92%	0.916	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.4	41.1	-173.6	-70.9	-156.3	-46.6	0	0	114.9	Q8	Q8-Q10 PolarHBondContact O-N 3.1Å
11	D	46.4	Very low	56.8	Low	76 Å²	76	102.2 Å²	102.2	41%	0.406	53%	0.532	S	S	.	.	T	Hydrogen-bonded Turn	trans	-134.1	-7	-173.1	-167.9	-97.4	0	0	0	109.7	S9 P13 L14 R15	S9-D11 PolarHBondContact O-N 2.84Å; D11-P13 VanDerWaalsContact C-CD 3.47Å; D11-L14 PolarHBondContact O-N 3.24Å; D11-R15 VanDerWaalsContact CB-NH2 3.34Å; D11-R15 VanDerWaalsContact O-CG 3.3Å; D11-R15 WeakPolarHBondContact O-CG 3.39Å; D11-R15 PolarHBondContact O-N 3.27Å; D11-R15 PolarHBondContact O-NE 3.02Å; D11-R15 IonicContact OD1-CZ 3.57Å; D11-R15 VanDerWaalsContact OD1-CZ 3.3Å; D11-R15 IonicContact OD1-NE 3.8Å; D11-R15 PolarHBondContact OD1-NE 3.36Å; D11-R15 IonicContact OD1-NH2 2.64Å; D11-R15 PolarHBondContact OD1-NH2 3.34Å
12	E	49.7	Very low	58.9	Low	81 Å²	81	94 Å²	94	38%	0.379	48%	0.478	S	S	.	.	H	α-helix	trans	-52.3	-43.8	167.3	-75.5	-66.4	112	0	0	115.4	Q8 S9 L14 R15 S16	Q8-E12 HydrophobicContact CG-CG 4.2Å; S9-E12 PolarHBondContact O-N 3.09Å; E12-L14 VanDerWaalsContact C-N 3.26Å; E12-L14 PolarHBondContact O-N 3.46Å; E12-R15 WeakPolarHBondContact O-CB 3.34Å; E12-R15 PolarHBondContact O-N 3.44Å; E12-R15 VanDerWaalsContact O-N 3.08Å; E12-R15 VanDerWaalsContact OE1-CD 3.27Å; E12-R15 WeakPolarHBondContact OE1-CD 3.12Å; E12-R15 IonicContact OE1-CZ 3.3Å; E12-R15 IonicContact OE1-NE 2.91Å; E12-R15 IonicContact OE1-NH1 2.86Å; E12-R15 PolarHBondContact OE1-NH1 3.15Å; E12-S16 PolarHBondContact O-N 2.89Å; E12-S16 VanDerWaalsContact O-N 3.17Å; E12-S16 PolarHBondContact O-OG 3.41Å
13	P	50.7	Low	61.1	Low	71 Å²	71	92.5 Å²	92.5	46%	0.461	47%	0.466	S	S	.	.	H	α-helix	trans	-69.1	-26.4	-176.4	26	-33	0	0	0	112.3	D11 R17	D11-P13 VanDerWaalsContact C-CD 3.47Å; P13-R17 WeakPolarHBondContact O-CG 3.35Å; P13-R17 PolarHBondContact O-NE 3.36Å; P13-R17 PolarHBondContact O-NH2 3.18Å
14	L	50.3	Low	63	Low	98 Å²	98	84.7 Å²	84.7	51%	0.513	43%	0.426	S	S	.	.	H	α-helix	trans	-76.3	-30.2	174.2	-69.7	163.3	0	0	0	111.7	D11 E12	D11-L14 PolarHBondContact O-N 3.24Å; E12-L14 VanDerWaalsContact C-N 3.26Å; E12-L14 PolarHBondContact O-N 3.46Å
15	R	56.7	Low	64.6	Low	89 Å²	89	81.7 Å²	81.7	34%	0.336	41%	0.406	S	S	.	.	H	α-helix	trans	-68.8	-38.8	177.9	-67	165.8	-159.5	173.2	-3.8	112.1	D11 E12 R17	D11-R15 VanDerWaalsContact CB-NH2 3.34Å; D11-R15 VanDerWaalsContact O-CG 3.3Å; D11-R15 WeakPolarHBondContact O-CG 3.39Å; D11-R15 PolarHBondContact O-N 3.27Å; D11-R15 PolarHBondContact O-NE 3.02Å; D11-R15 IonicContact OD1-CZ 3.57Å; D11-R15 VanDerWaalsContact OD1-CZ 3.3Å; D11-R15 IonicContact OD1-NE 3.8Å; D11-R15 PolarHBondContact OD1-NE 3.36Å; D11-R15 IonicContact OD1-NH2 2.64Å; D11-R15 PolarHBondContact OD1-NH2 3.34Å; E12-R15 WeakPolarHBondContact O-CB 3.34Å; E12-R15 PolarHBondContact O-N 3.44Å; E12-R15 VanDerWaalsContact O-N 3.08Å; E12-R15 VanDerWaalsContact OE1-CD 3.27Å; E12-R15 WeakPolarHBondContact OE1-CD 3.12Å; E12-R15 IonicContact OE1-CZ 3.3Å; E12-R15 IonicContact OE1-NE 2.91Å; E12-R15 IonicContact OE1-NH1 2.86Å; E12-R15 PolarHBondContact OE1-NH1 3.15Å; R15-R17 VanDerWaalsContact C-N 3.29Å; R15-R17 PolarHBondContact O-N 3.38Å
16	S	64.4	Low	66.7	Low	37 Å²	37	82.6 Å²	82.6	26%	0.259	41%	0.405	S	S	.	.	H	α-helix	trans	-74.9	-18.6	-179.3	-50.5	0	0	0	0	113.6	E12 A66	E12-S16 PolarHBondContact O-N 2.89Å; E12-S16 VanDerWaalsContact O-N 3.17Å; E12-S16 PolarHBondContact O-OG 3.41Å; S16-A66 WeakPolarHBondContact O-CB 3.43Å
17	R	80.3	Confident	68.5	Low	68 Å²	68	83.3 Å²	83.3	26%	0.257	40%	0.402	S	S	.	.	H	α-helix	trans	-93.8	-13.7	-177.6	-74.6	-178.2	-72.1	175.2	-1.3	114.3	P13 R15 F60 A61 D63	P13-R17 WeakPolarHBondContact O-CG 3.35Å; P13-R17 PolarHBondContact O-NE 3.36Å; P13-R17 PolarHBondContact O-NH2 3.18Å; R15-R17 VanDerWaalsContact C-N 3.29Å; R15-R17 PolarHBondContact O-N 3.38Å; R17-F60 WeakPolarHBondContact CB-O 3.46Å; R17-F60 PolarHBondContact O-N 3.13Å; R17-A61 WeakPolarHBondContact CD-O 3.3Å; R17-D63 HydrophobicContact CG-CB 3.81Å
18	K	85.3	Confident	70.3	Confident	75 Å²	75	75.3 Å²	75.3	33%	0.326	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	125.5	-176.8	-167.2	177.1	-176.4	170.3	0	110.9	F57 V58 A86	K18-F57 VanDerWaalsContact CE-CB 3.44Å; K18-V58 CarbonylContact C-O 3.46Å; K18-V58 WeakPolarHBondContact CA-O 3.41Å; K18-A86 HydrophobicContact CB-CB 3.97Å; K18-A86 HydrophobicContact CD-CB 4Å; K18-A86 HydrophobicContact CG-CB 3.65Å; K18-A86 VanDerWaalsContact O-CB 3.24Å; K18-A86 WeakPolarHBondContact O-CB 3.49Å; K18-A86 PolarHBondContact O-N 2.66Å
19	V	87.6	Confident	72.4	Confident	2 Å²	2	71.4 Å²	71.4	1%	0.012	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	147.3	175.2	-56	0	0	0	0	111.2	V21 F57 V58 F60 A66 I83	V19-V21 HydrophobicContact CG2-CG2 4.25Å; V19-F57 WeakPolarHBondContact O-CA 3.34Å; V19-V58 HydrophobicContact CG2-CB 3.7Å; V19-V58 HydrophobicContact CG2-CG1 4.42Å; V19-V58 PolarHBondContact N-O 3.1Å; V19-V58 PolarHBondContact O-N 2.98Å; V19-F60 HydrophobicContact CG1-CD2 4.22Å; V19-F60 HydrophobicContact CG1-CE2 4.1Å; V19-F60 HydrophobicContact CG2-CD2 4.22Å; V19-F60 HydrophobicContact CG2-CE2 3.62Å; V19-A66 HydrophobicContact CG1-CB 3.57Å; V19-I83 HydrophobicContact CB-CG2 3.88Å; V19-I83 HydrophobicContact CG1-CG2 4.24Å; V19-I83 HydrophobicContact CG2-CG2 4.2Å
20	F	88.6	Confident	74.6	Confident	63 Å²	63	72.3 Å²	72.3	28%	0.276	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	127	168.6	169.5	-94.3	0	0	0	108.6	F55 F57 I83 S84 A86	F20-F55 HydrophobicContact CD2-CB 4.39Å; F20-F55 HydrophobicContact CD2-CD2 4.44Å; F20-F55 HydrophobicContact CE2-CB 3.43Å; F20-F55 VanDerWaalsContact CE2-CB 3.43Å; F20-F55 HydrophobicContact CE2-CD1 4.4Å; F20-F55 AromaticContact CE2-CD2 3.81Å; F20-F55 HydrophobicContact CE2-CD2 3.81Å; F20-F55 AromaticContact CE2-CG 3.68Å; F20-F55 HydrophobicContact CE2-CG 3.68Å; F20-F55 HydrophobicContact CZ-CB 3.64Å; F20-F55 HydrophobicContact CZ-CG 4.22Å; F20-F57 HydrophobicContact CB-CD1 4.42Å; F20-F57 HydrophobicContact CB-CE1 4.29Å; F20-F57 HydrophobicContact CD2-CD1 4.39Å; F20-F57 AromaticContact CD2-CE1 3.83Å; F20-F57 HydrophobicContact CD2-CE1 3.83Å; F20-F57 HydrophobicContact CD2-CZ 4.15Å; F20-I83 CarbonylContact O-C 3.56Å; F20-I83 WeakPolarHBondContact O-CA 3.47Å; F20-S84 PolarHBondContact N-O 3.48Å; F20-S84 PolarHBondContact O-N 3.34Å; F20-A86 HydrophobicContact CB-CB 4.48Å
21	V	89.1	Confident	76.8	Confident	0 Å²	0	67.6 Å²	67.6	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	112.5	175	-167.6	0	0	0	0	107.5	V19 C24 F37 F55 A56 V58 V81	V19-V21 HydrophobicContact CG2-CG2 4.25Å; V21-C24 WeakPolarHBondContact CG1-SG 3.39Å; V21-F37 HydrophobicContact CG1-CZ 4.46Å; V21-F37 HydrophobicContact CG2-CE2 4.02Å; V21-F37 HydrophobicContact CG2-CZ 3.97Å; V21-F55 CarbonylContact O-C 3.53Å; V21-F55 WeakPolarHBondContact O-CA 3.45Å; V21-F55 WeakPolarHBondContact O-CB 3.41Å; V21-A56 HydrophobicContact CB-CB 4.48Å; V21-A56 PolarHBondContact N-O 3.13Å; V21-A56 PolarHBondContact O-N 2.75Å; V21-V58 HydrophobicContact CG2-CG2 3.85Å; V21-V81 HydrophobicContact CG1-CB 3.91Å; V21-V81 HydrophobicContact CG1-CG1 4.42Å; V21-V81 HydrophobicContact CG1-CG2 4.13Å
22	G	88.2	Confident	78.8	Confident	7 Å²	7	67.2 Å²	67.2	7%	0.072	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	165	177.7	0	0	0	0	0	112.4	C24 V81 H82	G22-C24 PolarHBondContact O-N 3.43Å; G22-V81 WeakPolarHBondContact O-CA 3.42Å; G22-H82 PolarHBondContact N-O 2.94Å; G22-H82 PolarHBondContact O-N 2.84Å
23	R	86.8	Confident	80.7	Confident	181 Å²	181	63.4 Å²	63.4	68%	0.683	31%	0.309	S	S	*	.	S	Bend	trans	63.1	25.4	-177.3	-53.3	-178.6	178.3	170.2	0.9	113.8	A54	R23-A54 PolarHBondContact N-O 3.15Å
24	C	85.9	Confident	82.6	Confident	4 Å²	4	67 Å²	67	3%	0.027	31%	0.314	C	S	.	.			trans	-70.5	149.5	169.7	-59.5	0	0	0	0	110.3	V21 G22 M28 F52 A54	V21-C24 WeakPolarHBondContact CG1-SG 3.39Å; G22-C24 PolarHBondContact O-N 3.43Å; C24-M28 HydrophobicContact CB-SD 4.01Å; C24-F52 HydrophobicContact CB-CZ 4.12Å; C24-F52 WeakPolarHBondContact O-CZ 3.32Å; C24-A54 PolarHBondContact N-O 3.5Å; C24-A54 VanDerWaalsContact N-O 3.15Å; C24-A54 WeakPolarHBondContact O-CA 3.41Å; C24-A54 VanDerWaalsContact O-CB 3.24Å; C24-A54 WeakPolarHBondContact O-CB 3.37Å
25	T	85.8	Confident	84.5	Confident	43 Å²	43	68.9 Å²	68.9	26%	0.264	32%	0.32	S	S	.	.			trans	-101.1	165	167.8	64.7	0	0	0	0	110.8	D27 M28 F52 I79	T25-D27 PolarHBondContact O-N 3.21Å; T25-D27 PolarHBondContact OG1-OD2 3.2Å; T25-D27 VanDerWaalsContact OG1-OD2 3.09Å; T25-M28 WeakPolarHBondContact O-CB 3.26Å; T25-M28 PolarHBondContact O-N 2.64Å; T25-F52 VanDerWaalsContact C-CE1 3.47Å; T25-F52 WeakPolarHBondContact O-CZ 3.25Å; T25-I79 HydrophobicContact CG2-CD1 3.88Å; T25-I79 HydrophobicContact CG2-CG1 4.46Å; T25-I79 HydrophobicContact CG2-CG2 4.2Å; T25-I79 VanDerWaalsContact OG1-CD1 3.23Å; T25-I79 WeakPolarHBondContact OG1-CD1 3.16Å
26	E	83.2	Confident	86	Confident	162 Å²	162	66.6 Å²	66.6	76%	0.757	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-18.3	178	63.6	-175.5	79	0	0	113.1	M28 F52	E26-M28 PolarHBondContact O-N 3.08Å; E26-F52 HydrophobicContact CB-CD1 4.13Å; E26-F52 HydrophobicContact CB-CE1 4.23Å; E26-F52 HydrophobicContact CB-CG 4.39Å; E26-F52 VanDerWaalsContact N-CE1 3.33Å
27	D	83.6	Confident	87.1	Confident	108 Å²	108	64.8 Å²	64.8	58%	0.578	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-19.1	172.5	-51.8	-88.1	0	0	0	113.3	T25 T29	T25-D27 PolarHBondContact O-N 3.21Å; T25-D27 PolarHBondContact OG1-OD2 3.2Å; T25-D27 VanDerWaalsContact OG1-OD2 3.09Å; D27-T29 PolarHBondContact O-N 3.28Å
28	M	83.6	Confident	87.5	Confident	4 Å²	4	65 Å²	65	2%	0.02	31%	0.311	C	S	.	.			trans	-85.9	106.3	178	-65.4	-171.6	-175.9	0	0	110.2	C24 T25 E26 L33 I76 I79 V81	C24-M28 HydrophobicContact CB-SD 4.01Å; T25-M28 WeakPolarHBondContact O-CB 3.26Å; T25-M28 PolarHBondContact O-N 2.64Å; E26-M28 PolarHBondContact O-N 3.08Å; M28-L33 HydrophobicContact SD-CD2 4.45Å; M28-I76 HydrophobicContact CE-CB 3.63Å; M28-I76 HydrophobicContact CE-CG2 3.92Å; M28-I76 WeakPolarHBondContact CE-O 3.16Å; M28-I76 HydrophobicContact SD-CB 4.28Å; M28-I76 HydrophobicContact SD-CD1 4.44Å; M28-I76 HydrophobicContact SD-CG2 4.25Å; M28-I79 HydrophobicContact CE-CB 3.48Å; M28-I79 VanDerWaalsContact CE-CB 3.48Å; M28-I79 HydrophobicContact CE-CD1 3.61Å; M28-I79 HydrophobicContact CE-CG1 4.14Å; M28-I79 HydrophobicContact CE-CG2 3.65Å; M28-V81 HydrophobicContact CE-CG1 3.66Å; M28-V81 HydrophobicContact SD-CG1 3.77Å
29	T	88.4	Confident	87.7	Confident	65 Å²	65	67.4 Å²	67.4	40%	0.399	32%	0.324	S	S	.	.			trans	-86.2	167.3	173.4	62.4	0	0	0	0	111.5	D27 D31 E32 L33	D27-T29 PolarHBondContact O-N 3.28Å; T29-D31 VanDerWaalsContact C-N 3.29Å; T29-D31 PolarHBondContact O-N 3.17Å; T29-E32 PolarHBondContact O-N 3.26Å; T29-E32 WeakPolarHBondContact OG1-CG 3.27Å; T29-E32 PolarHBondContact OG1-N 3.49Å; T29-L33 WeakPolarHBondContact O-CG 3.22Å; T29-L33 PolarHBondContact O-N 3.44Å; T29-L33 VanDerWaalsContact O-N 3.09Å
30	E	89.3	Confident	87.6	Confident	88 Å²	88	71.8 Å²	71.8	41%	0.411	34%	0.341	S	S	.	.	H	α-helix	trans	-60.1	-41.3	178	-157.9	162.5	93.5	0	0	111.8	R34 V46 I48	E30-R34 VanDerWaalsContact O-CB 3.31Å; E30-R34 WeakPolarHBondContact O-CB 3.16Å; E30-R34 PolarHBondContact O-N 3.15Å; E30-V46 HydrophobicContact CB-CG1 4.45Å; E30-V46 HydrophobicContact CG-CB 3.4Å; E30-V46 VanDerWaalsContact CG-CB 3.4Å; E30-V46 HydrophobicContact CG-CG1 3.55Å; E30-V46 HydrophobicContact CG-CG2 4.48Å; E30-I48 HydrophobicContact CB-CD1 4.12Å
31	D	89.2	Confident	87.5	Confident	98 Å²	98	69.3 Å²	69.3	52%	0.524	33%	0.333	S	S	.	.	H	α-helix	trans	-63.1	-44.6	176.4	-58.4	-84.3	0	0	0	112.4	T29 R34 E35	T29-D31 VanDerWaalsContact C-N 3.29Å; T29-D31 PolarHBondContact O-N 3.17Å; D31-R34 WeakPolarHBondContact O-CB 3.45Å; D31-R34 PolarHBondContact O-N 3.3Å; D31-E35 PolarHBondContact O-N 2.86Å
32	E	88.6	Confident	87.5	Confident	68 Å²	68	74.8 Å²	74.8	32%	0.318	36%	0.362	S	S	.	.	H	α-helix	trans	-66.7	-42.5	-179.1	-63.1	-85.9	121.9	0	0	111.3	T29 R34 E35 F36 K77	T29-E32 PolarHBondContact O-N 3.26Å; T29-E32 WeakPolarHBondContact OG1-CG 3.27Å; T29-E32 PolarHBondContact OG1-N 3.49Å; E32-R34 VanDerWaalsContact C-N 3.31Å; E32-E35 PolarHBondContact O-N 2.8Å; E32-F36 VanDerWaalsContact O-CB 3.25Å; E32-F36 WeakPolarHBondContact O-CB 3.46Å; E32-F36 PolarHBondContact O-N 2.78Å; E32-K77 WeakPolarHBondContact OE2-CD 3.44Å; E32-K77 WeakPolarHBondContact OE2-CE 3.42Å; E32-K77 IonicContact OE2-NZ 2.78Å; E32-K77 PolarHBondContact OE2-NZ 2.74Å
33	L	88.8	Confident	87.6	Confident	1 Å²	1	75.3 Å²	75.3	1%	0.005	36%	0.364	C	S	.	.	H	α-helix	trans	-60.1	-45.9	173.3	-74.3	163.3	0	0	0	109.8	M28 T29 F36 F37 V46 I48 A56 I76	M28-L33 HydrophobicContact SD-CD2 4.45Å; T29-L33 WeakPolarHBondContact O-CG 3.22Å; T29-L33 PolarHBondContact O-N 3.44Å; T29-L33 VanDerWaalsContact O-N 3.09Å; L33-F36 PolarHBondContact O-N 3.2Å; L33-F37 HydrophobicContact CB-CD2 4.28Å; L33-F37 HydrophobicContact CB-CE2 4.44Å; L33-F37 HydrophobicContact CD2-CD2 4.4Å; L33-F37 HydrophobicContact CD2-CE2 3.76Å; L33-F37 WeakPolarHBondContact O-CB 3.36Å; L33-F37 WeakPolarHBondContact O-CD2 3.32Å; L33-F37 PolarHBondContact O-N 2.77Å; L33-V46 HydrophobicContact CB-CG1 4.19Å; L33-V46 HydrophobicContact CD1-CG1 4.06Å; L33-I48 HydrophobicContact CD1-CD1 4.07Å; L33-I48 HydrophobicContact CD1-CG1 4.41Å; L33-A56 HydrophobicContact CD1-CB 3.72Å; L33-I76 HydrophobicContact CD2-CD1 3.92Å
34	R	90.3	Very high	87.8	Confident	146 Å²	146	72.6 Å²	72.6	55%	0.551	36%	0.361	S	S	*	.	H	α-helix	trans	-61.5	-49.7	178.8	178.4	-175.9	153	-162.9	-8.1	112	E30 D31 E32 F36 F37 S38 V43 V46	E30-R34 VanDerWaalsContact O-CB 3.31Å; E30-R34 WeakPolarHBondContact O-CB 3.16Å; E30-R34 PolarHBondContact O-N 3.15Å; D31-R34 WeakPolarHBondContact O-CB 3.45Å; D31-R34 PolarHBondContact O-N 3.3Å; E32-R34 VanDerWaalsContact C-N 3.31Å; R34-F36 VanDerWaalsContact C-N 3.33Å; R34-F36 PolarHBondContact O-N 2.83Å; R34-F37 PolarHBondContact O-N 2.78Å; R34-S38 WeakPolarHBondContact O-CB 3.48Å; R34-S38 PolarHBondContact O-N 3.4Å; R34-V43 HydrophobicContact CG-CB 4.15Å; R34-V43 HydrophobicContact CG-CG1 4.19Å; R34-V46 HydrophobicContact CB-CG2 4.15Å
35	E	90.2	Very high	87.8	Confident	138 Å²	138	76.9 Å²	76.9	65%	0.645	38%	0.383	S	S	*	.	H	α-helix	trans	-60.9	-43.7	178.2	-81	-174.1	85	0	0	111.4	D31 E32 S38	D31-E35 PolarHBondContact O-N 2.86Å; E32-E35 PolarHBondContact O-N 2.8Å; E35-S38 WeakPolarHBondContact O-CB 3.21Å; E35-S38 PolarHBondContact O-N 2.82Å
36	F	89.1	Confident	88	Confident	40 Å²	40	75.2 Å²	75.2	18%	0.175	37%	0.373	C	S	.	.	H	α-helix	trans	-64.1	-46.7	177	-175.2	-92.5	0	0	0	111.7	E32 L33 R34 S38 Q39 Y40 L74 I76	E32-F36 VanDerWaalsContact O-CB 3.25Å; E32-F36 WeakPolarHBondContact O-CB 3.46Å; E32-F36 PolarHBondContact O-N 2.78Å; L33-F36 PolarHBondContact O-N 3.2Å; R34-F36 VanDerWaalsContact C-N 3.33Å; R34-F36 PolarHBondContact O-N 2.83Å; F36-S38 VanDerWaalsContact C-N 3.29Å; F36-S38 PolarHBondContact O-N 3.12Å; F36-Q39 VanDerWaalsContact CD2-NE2 3.31Å; F36-Q39 WeakPolarHBondContact O-CG 3.38Å; F36-Q39 PolarHBondContact O-N 2.95Å; F36-Q39 PolarHBondContact O-NE2 3.37Å; F36-Y40 HydrophobicContact CD1-CE2 4.21Å; F36-Y40 AromaticContact CE1-CE2 3.68Å; F36-Y40 HydrophobicContact CE1-CE2 3.68Å; F36-Y40 HydrophobicContact CZ-CE2 4.06Å; F36-L74 HydrophobicContact CE1-CB 4.13Å; F36-L74 HydrophobicContact CE1-CD1 3.69Å; F36-L74 HydrophobicContact CZ-CB 4.33Å; F36-L74 HydrophobicContact CZ-CD1 4.42Å; F36-I76 HydrophobicContact CD1-CD1 3.66Å; F36-I76 HydrophobicContact CD1-CG1 3.65Å; F36-I76 HydrophobicContact CD2-CG1 4.09Å; F36-I76 HydrophobicContact CD2-CG2 4.47Å; F36-I76 HydrophobicContact CE1-CD1 3.95Å; F36-I76 HydrophobicContact CE1-CG1 3.59Å; F36-I76 HydrophobicContact CE2-CG1 4.05Å; F36-I76 HydrophobicContact CG-CD1 4.12Å; F36-I76 HydrophobicContact CG-CG1 3.9Å; F36-I76 HydrophobicContact CG-CG2 4.47Å; F36-I76 HydrophobicContact CZ-CG1 3.81Å
37	F	87.9	Confident	88.2	Confident	0 Å²	0	72.7 Å²	72.7	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-72.8	-23.7	-179.9	-76.2	-61.4	0	0	0	113.2	V21 L33 R34 Q39 Y40 G41 V43 V58 F60 L69 L74 I76 I83	V21-F37 HydrophobicContact CG1-CZ 4.46Å; V21-F37 HydrophobicContact CG2-CE2 4.02Å; V21-F37 HydrophobicContact CG2-CZ 3.97Å; L33-F37 HydrophobicContact CB-CD2 4.28Å; L33-F37 HydrophobicContact CB-CE2 4.44Å; L33-F37 HydrophobicContact CD2-CD2 4.4Å; L33-F37 HydrophobicContact CD2-CE2 3.76Å; L33-F37 WeakPolarHBondContact O-CB 3.36Å; L33-F37 WeakPolarHBondContact O-CD2 3.32Å; L33-F37 PolarHBondContact O-N 2.77Å; R34-F37 PolarHBondContact O-N 2.78Å; F37-Q39 PolarHBondContact O-N 3.43Å; F37-Q39 VanDerWaalsContact O-N 3.13Å; F37-Y40 HydrophobicContact CD1-CD2 4.41Å; F37-Y40 PolarHBondContact O-N 2.82Å; F37-G41 PolarHBondContact O-N 3.48Å; F37-G41 VanDerWaalsContact O-N 3.1Å; F37-G41 VanDerWaalsContact O-O 3.13Å; F37-V43 HydrophobicContact CB-CG2 3.45Å; F37-V43 VanDerWaalsContact CB-CG2 3.45Å; F37-V58 HydrophobicContact CD2-CG1 4.19Å; F37-V58 HydrophobicContact CD2-CG2 3.86Å; F37-V58 HydrophobicContact CE2-CG2 3.85Å; F37-V58 HydrophobicContact CG-CG1 4.45Å; F37-F60 HydrophobicContact CB-CE1 3.88Å; F37-F60 HydrophobicContact CB-CZ 3.83Å; F37-F60 HydrophobicContact CD1-CE1 4.41Å; F37-F60 AromaticContact CD1-CZ 3.65Å; F37-F60 HydrophobicContact CD1-CZ 3.65Å; F37-F60 HydrophobicContact CE1-CZ 4.42Å; F37-F60 HydrophobicContact CG-CE1 4.41Å; F37-F60 AromaticContact CG-CZ 3.85Å; F37-F60 HydrophobicContact CG-CZ 3.85Å; F37-L69 HydrophobicContact CD1-CD1 4.05Å; F37-L69 HydrophobicContact CE1-CD1 4.19Å; F37-L74 HydrophobicContact CE1-CD1 3.8Å; F37-L74 HydrophobicContact CZ-CD1 4.49Å; F37-I76 HydrophobicContact CE2-CD1 4.42Å; F37-I76 HydrophobicContact CZ-CD1 4.45Å; F37-I83 HydrophobicContact CE1-CD1 3.51Å; F37-I83 HydrophobicContact CZ-CD1 3.77Å; F37-I83 HydrophobicContact CZ-CG1 4.39Å
38	S	88.6	Confident	88.4	Confident	71 Å²	71	69.1 Å²	69.1	50%	0.497	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-21.3	175.7	-166.4	0	0	0	0	113.4	R34 E35 F36 Y40 G41	R34-S38 WeakPolarHBondContact O-CB 3.48Å; R34-S38 PolarHBondContact O-N 3.4Å; E35-S38 WeakPolarHBondContact O-CB 3.21Å; E35-S38 PolarHBondContact O-N 2.82Å; F36-S38 VanDerWaalsContact C-N 3.29Å; F36-S38 PolarHBondContact O-N 3.12Å; S38-Y40 VanDerWaalsContact C-N 3.32Å; S38-G41 VanDerWaalsContact CA-O 3.26Å; S38-G41 WeakPolarHBondContact CA-O 3.04Å
39	Q	88.8	Confident	88.4	Confident	126 Å²	126	70 Å²	70	59%	0.589	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-24.4	175.7	84.8	-166.8	-84.8	0	0	112.7	F36 F37	F36-Q39 VanDerWaalsContact CD2-NE2 3.31Å; F36-Q39 WeakPolarHBondContact O-CG 3.38Å; F36-Q39 PolarHBondContact O-N 2.95Å; F36-Q39 PolarHBondContact O-NE2 3.37Å; F37-Q39 PolarHBondContact O-N 3.43Å; F37-Q39 VanDerWaalsContact O-N 3.13Å
40	Y	85.6	Confident	88.1	Confident	95 Å²	95	76.4 Å²	76.4	37%	0.373	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-32.4	178.9	-62	-83.6	0	0	0	111.5	F36 F37 S38 L69 L74	F36-Y40 HydrophobicContact CD1-CE2 4.21Å; F36-Y40 AromaticContact CE1-CE2 3.68Å; F36-Y40 HydrophobicContact CE1-CE2 3.68Å; F36-Y40 HydrophobicContact CZ-CE2 4.06Å; F37-Y40 HydrophobicContact CD1-CD2 4.41Å; F37-Y40 PolarHBondContact O-N 2.82Å; S38-Y40 VanDerWaalsContact C-N 3.32Å; Y40-L69 HydrophobicContact CD1-CD2 3.92Å; Y40-L69 HydrophobicContact CE1-CD2 4.23Å; Y40-L69 HydrophobicContact CG-CD1 4.35Å; Y40-L69 HydrophobicContact CG-CD2 4.16Å; Y40-L74 HydrophobicContact CE2-CD1 4.08Å
41	G	87	Confident	87.9	Confident	11 Å²	11	76.8 Å²	76.8	11%	0.113	38%	0.379	C	S	.	.	S	Bend	trans	-178.1	170.3	-178.7	0	0	0	0	0	114.2	F37 S38 V43 I65	F37-G41 PolarHBondContact O-N 3.48Å; F37-G41 VanDerWaalsContact O-N 3.1Å; F37-G41 VanDerWaalsContact O-O 3.13Å; S38-G41 VanDerWaalsContact CA-O 3.26Å; S38-G41 WeakPolarHBondContact CA-O 3.04Å; G41-V43 PolarHBondContact O-N 3.42Å; G41-I65 VanDerWaalsContact CA-CD1 3.41Å
42	D	89.4	Confident	87.6	Confident	114 Å²	114	75.9 Å²	75.9	61%	0.61	37%	0.371	S	S	*	.			trans	-66.2	116.5	175.9	-75.9	-85.2	0	0	0	111.6	F60 A61	D42-F60 CarbonylContact O-C 3.57Å; D42-F60 WeakPolarHBondContact O-CA 3.4Å; D42-A61 HydrophobicContact CB-CB 3.7Å; D42-A61 PolarHBondContact O-N 3.15Å
43	V	90.6	Very high	87.3	Confident	19 Å²	19	80.8 Å²	80.8	12%	0.115	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	123.4	174.2	-178.2	0	0	0	0	108.7	R34 F37 G41 V46 V58 F60	R34-V43 HydrophobicContact CG-CB 4.15Å; R34-V43 HydrophobicContact CG-CG1 4.19Å; F37-V43 HydrophobicContact CB-CG2 3.45Å; F37-V43 VanDerWaalsContact CB-CG2 3.45Å; G41-V43 PolarHBondContact O-N 3.42Å; V43-V46 HydrophobicContact CG1-CG2 3.56Å; V43-V58 HydrophobicContact CG1-CG1 3.84Å; V43-V58 HydrophobicContact CG2-CG1 4.45Å; V43-F60 HydrophobicContact CG2-CD1 4.21Å; V43-F60 HydrophobicContact CG2-CE1 3.87Å
44	M	89.3	Confident	87.1	Confident	123 Å²	123	82.7 Å²	82.7	61%	0.606	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.3	-47.1	177.8	-67	-80	83	0	0	112	T59 A61	M44-T59 WeakPolarHBondContact CA-O 3.48Å; M44-T59 HydrophobicContact CB-CG2 4.48Å; M44-T59 WeakPolarHBondContact CB-O 3.5Å; M44-T59 PolarHBondContact N-O 2.93Å; M44-A61 HydrophobicContact CE-CB 4.18Å; M44-A61 HydrophobicContact CG-CB 3.85Å; M44-A61 HydrophobicContact SD-CB 4.05Å
45	D	86.9	Confident	87	Confident	94 Å²	94	77.8 Å²	77.8	50%	0.503	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	142.9	-172.4	-161.8	68.4	0	0	0	109.7	T59	D45-T59 PolarHBondContact N-O 2.91Å; D45-T59 PolarHBondContact O-N 2.9Å
46	V	89.8	Confident	86.9	Confident	9 Å²	9	71.3 Å²	71.3	6%	0.055	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	139.6	172.6	-177.7	0	0	0	0	106.6	E30 L33 R34 V43 F57 V58	E30-V46 HydrophobicContact CB-CG1 4.45Å; E30-V46 HydrophobicContact CG-CB 3.4Å; E30-V46 VanDerWaalsContact CG-CB 3.4Å; E30-V46 HydrophobicContact CG-CG1 3.55Å; E30-V46 HydrophobicContact CG-CG2 4.48Å; L33-V46 HydrophobicContact CB-CG1 4.19Å; L33-V46 HydrophobicContact CD1-CG1 4.06Å; R34-V46 HydrophobicContact CB-CG2 4.15Å; V43-V46 HydrophobicContact CG1-CG2 3.56Å; V46-F57 CarbonylContact C-O 3.56Å; V46-F57 WeakPolarHBondContact CA-O 3.24Å; V46-V58 HydrophobicContact CG1-CG2 4.05Å; V46-V58 HydrophobicContact CG2-CG1 4.22Å; V46-V58 HydrophobicContact CG2-CG2 4.19Å
47	F	87.3	Confident	86.9	Confident	108 Å²	108	71.2 Å²	71.2	47%	0.474	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	115	-176.9	178.4	-98.2	0	0	0	110.4	P49 F57	F47-P49 HydrophobicContact CE1-CB 4.01Å; F47-P49 HydrophobicContact CE1-CG 4.4Å; F47-F57 HydrophobicContact CB-CB 4.43Å; F47-F57 HydrophobicContact CD1-CD2 4.04Å; F47-F57 PolarHBondContact N-O 2.77Å; F47-F57 PolarHBondContact O-N 3.3Å
48	I	88.9	Confident	87	Confident	33 Å²	33	71.2 Å²	71.2	17%	0.169	36%	0.355	C	S	.	.			trans	-105.9	109.3	176.3	-52.3	177.7	0	0	0	109.5	E30 L33 F52 A56	E30-I48 HydrophobicContact CB-CD1 4.12Å; L33-I48 HydrophobicContact CD1-CD1 4.07Å; L33-I48 HydrophobicContact CD1-CG1 4.41Å; I48-F52 HydrophobicContact CG2-CD2 4Å; I48-F52 HydrophobicContact CG2-CE2 4.2Å; I48-A56 HydrophobicContact CG1-CB 4.02Å
49	P	82.2	Confident	86.9	Confident	23 Å²	23	69.3 Å²	69.3	15%	0.149	34%	0.34	C	S	.	.			trans	-67.7	139.3	178.8	18.9	-21	0	0	0	111.8	F47 P51 F55 F57	F47-P49 HydrophobicContact CE1-CB 4.01Å; F47-P49 HydrophobicContact CE1-CG 4.4Å; P49-P51 CarbonylContact O-C 3.6Å; P49-P51 VanDerWaalsContact O-O 3.12Å; P49-F55 HydrophobicContact CB-CE2 4.37Å; P49-F55 HydrophobicContact CG-CD2 3.75Å; P49-F55 HydrophobicContact CG-CE2 3.2Å; P49-F55 HydrophobicContact CG-CZ 3.8Å; P49-F57 HydrophobicContact CG-CE2 4.48Å
50	K	83.4	Confident	87	Confident	199 Å²	199	63.3 Å²	63.3	87%	0.865	31%	0.312	S	S	*	.	S	Bend	trans	-107.1	133.5	172.2	-64.4	-177.7	-178.7	178.1	0	109.5
51	P	83.9	Confident	87.1	Confident	97 Å²	97	60.6 Å²	60.6	63%	0.63	31%	0.309	S	S	*	.	S	Bend	cis	-67.1	149.7	2.4	29.7	-36.1	0	0	0	112.4	P49 R53	P49-P51 CarbonylContact O-C 3.6Å; P49-P51 VanDerWaalsContact O-O 3.12Å; P51-R53 WeakPolarHBondContact O-CG 3.34Å; P51-R53 PolarHBondContact O-N 2.81Å
52	F	83.6	Confident	86.9	Confident	78 Å²	78	63.4 Å²	63.4	34%	0.342	32%	0.321	S	S	.	.			trans	-58.2	125.9	-179.2	-174	-98.7	0	0	0	110	C24 T25 E26 I48 A54	C24-F52 HydrophobicContact CB-CZ 4.12Å; C24-F52 WeakPolarHBondContact O-CZ 3.32Å; T25-F52 VanDerWaalsContact C-CE1 3.47Å; T25-F52 WeakPolarHBondContact O-CZ 3.25Å; E26-F52 HydrophobicContact CB-CD1 4.13Å; E26-F52 HydrophobicContact CB-CE1 4.23Å; E26-F52 HydrophobicContact CB-CG 4.39Å; E26-F52 VanDerWaalsContact N-CE1 3.33Å; I48-F52 HydrophobicContact CG2-CD2 4Å; I48-F52 HydrophobicContact CG2-CE2 4.2Å; F52-A54 VanDerWaalsContact CE1-CA 3.45Å; F52-A54 HydrophobicContact CE1-CB 4.15Å; F52-A54 VanDerWaalsContact CE1-N 3.34Å
53	R	81.2	Confident	86.4	Confident	171 Å²	171	60.7 Å²	60.7	65%	0.645	31%	0.307	S	S	*	.			trans	-121.4	25.3	-175.9	-78.1	-177.3	179	-176.3	-1.2	113.1	P51 F55	P51-R53 WeakPolarHBondContact O-CG 3.34Å; P51-R53 PolarHBondContact O-N 2.81Å; R53-F55 HydrophobicContact CB-CD1 3.42Å; R53-F55 VanDerWaalsContact CB-CD1 3.42Å; R53-F55 HydrophobicContact CB-CE1 3.09Å; R53-F55 HydrophobicContact CB-CG 4.45Å; R53-F55 HydrophobicContact CB-CZ 3.91Å; R53-F55 HydrophobicContact CG-CE1 3.95Å; R53-F55 WeakPolarHBondContact O-CD1 3.3Å; R53-F55 PolarHBondContact O-N 2.95Å
54	A	85.9	Confident	86.2	Confident	42 Å²	42	65.6 Å²	65.6	35%	0.347	33%	0.329	S	S	.	.	S	Bend	trans	57.7	30.1	-175.9	0	0	0	0	0	114	R23 C24 F52	R23-A54 PolarHBondContact N-O 3.15Å; C24-A54 PolarHBondContact N-O 3.5Å; C24-A54 VanDerWaalsContact N-O 3.15Å; C24-A54 WeakPolarHBondContact O-CA 3.41Å; C24-A54 VanDerWaalsContact O-CB 3.24Å; C24-A54 WeakPolarHBondContact O-CB 3.37Å; F52-A54 VanDerWaalsContact CE1-CA 3.45Å; F52-A54 HydrophobicContact CE1-CB 4.15Å; F52-A54 VanDerWaalsContact CE1-N 3.34Å
55	F	86.8	Confident	86	Confident	43 Å²	43	61.6 Å²	61.6	19%	0.189	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	152.6	173.5	67.7	-101.1	0	0	0	112.6	F20 V21 P49 R53 F57	F20-F55 HydrophobicContact CD2-CB 4.39Å; F20-F55 HydrophobicContact CD2-CD2 4.44Å; F20-F55 HydrophobicContact CE2-CB 3.43Å; F20-F55 VanDerWaalsContact CE2-CB 3.43Å; F20-F55 HydrophobicContact CE2-CD1 4.4Å; F20-F55 AromaticContact CE2-CD2 3.81Å; F20-F55 HydrophobicContact CE2-CD2 3.81Å; F20-F55 AromaticContact CE2-CG 3.68Å; F20-F55 HydrophobicContact CE2-CG 3.68Å; F20-F55 HydrophobicContact CZ-CB 3.64Å; F20-F55 HydrophobicContact CZ-CG 4.22Å; V21-F55 CarbonylContact O-C 3.53Å; V21-F55 WeakPolarHBondContact O-CA 3.45Å; V21-F55 WeakPolarHBondContact O-CB 3.41Å; P49-F55 HydrophobicContact CB-CE2 4.37Å; P49-F55 HydrophobicContact CG-CD2 3.75Å; P49-F55 HydrophobicContact CG-CE2 3.2Å; P49-F55 HydrophobicContact CG-CZ 3.8Å; R53-F55 HydrophobicContact CB-CD1 3.42Å; R53-F55 VanDerWaalsContact CB-CD1 3.42Å; R53-F55 HydrophobicContact CB-CE1 3.09Å; R53-F55 HydrophobicContact CB-CG 4.45Å; R53-F55 HydrophobicContact CB-CZ 3.91Å; R53-F55 HydrophobicContact CG-CE1 3.95Å; R53-F55 WeakPolarHBondContact O-CD1 3.3Å; R53-F55 PolarHBondContact O-N 2.95Å; F55-F57 AromaticContact CD2-CE2 3.97Å; F55-F57 HydrophobicContact CD2-CE2 3.97Å; F55-F57 HydrophobicContact CD2-CZ 4.4Å; F55-F57 AromaticContact CE2-CE2 3.71Å; F55-F57 HydrophobicContact CE2-CE2 3.71Å; F55-F57 HydrophobicContact CE2-CZ 4.2Å
56	A	88.8	Confident	85.8	Confident	1 Å²	1	57.3 Å²	57.3	1%	0.008	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	161.5	176.1	0	0	0	0	0	110	V21 L33 I48	V21-A56 HydrophobicContact CB-CB 4.48Å; V21-A56 PolarHBondContact N-O 3.13Å; V21-A56 PolarHBondContact O-N 2.75Å; L33-A56 HydrophobicContact CD1-CB 3.72Å; I48-A56 HydrophobicContact CG1-CB 4.02Å
57	F	88.9	Confident	85.5	Confident	39 Å²	39	60.4 Å²	60.4	17%	0.171	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	138.7	170	-65.5	-83	0	0	0	109.9	K18 V19 F20 V46 F47 P49 F55 A86	K18-F57 VanDerWaalsContact CE-CB 3.44Å; V19-F57 WeakPolarHBondContact O-CA 3.34Å; F20-F57 HydrophobicContact CB-CD1 4.42Å; F20-F57 HydrophobicContact CB-CE1 4.29Å; F20-F57 HydrophobicContact CD2-CD1 4.39Å; F20-F57 AromaticContact CD2-CE1 3.83Å; F20-F57 HydrophobicContact CD2-CE1 3.83Å; F20-F57 HydrophobicContact CD2-CZ 4.15Å; V46-F57 CarbonylContact C-O 3.56Å; V46-F57 WeakPolarHBondContact CA-O 3.24Å; F47-F57 HydrophobicContact CB-CB 4.43Å; F47-F57 HydrophobicContact CD1-CD2 4.04Å; F47-F57 PolarHBondContact N-O 2.77Å; F47-F57 PolarHBondContact O-N 3.3Å; P49-F57 HydrophobicContact CG-CE2 4.48Å; F55-F57 AromaticContact CD2-CE2 3.97Å; F55-F57 HydrophobicContact CD2-CE2 3.97Å; F55-F57 HydrophobicContact CD2-CZ 4.4Å; F55-F57 AromaticContact CE2-CE2 3.71Å; F55-F57 HydrophobicContact CE2-CE2 3.71Å; F55-F57 HydrophobicContact CE2-CZ 4.2Å; F57-A86 HydrophobicContact CD1-CB 4.03Å; F57-A86 HydrophobicContact CE1-CB 4.19Å
58	V	89.1	Confident	85.3	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	133	177.3	178.2	0	0	0	0	108	K18 V19 V21 F37 V43 V46 F60	K18-V58 CarbonylContact C-O 3.46Å; K18-V58 WeakPolarHBondContact CA-O 3.41Å; V19-V58 HydrophobicContact CG2-CB 3.7Å; V19-V58 HydrophobicContact CG2-CG1 4.42Å; V19-V58 PolarHBondContact N-O 3.1Å; V19-V58 PolarHBondContact O-N 2.98Å; V21-V58 HydrophobicContact CG2-CG2 3.85Å; F37-V58 HydrophobicContact CD2-CG1 4.19Å; F37-V58 HydrophobicContact CD2-CG2 3.86Å; F37-V58 HydrophobicContact CE2-CG2 3.85Å; F37-V58 HydrophobicContact CG-CG1 4.45Å; V43-V58 HydrophobicContact CG1-CG1 3.84Å; V43-V58 HydrophobicContact CG2-CG1 4.45Å; V46-V58 HydrophobicContact CG1-CG2 4.05Å; V46-V58 HydrophobicContact CG2-CG1 4.22Å; V46-V58 HydrophobicContact CG2-CG2 4.19Å; V58-F60 HydrophobicContact CB-CE2 4.42Å; V58-F60 HydrophobicContact CG1-CD2 4.22Å; V58-F60 HydrophobicContact CG1-CE1 4.48Å; V58-F60 HydrophobicContact CG1-CE2 3.78Å; V58-F60 HydrophobicContact CG1-CZ 3.93Å
59	T	87.8	Confident	85.1	Confident	30 Å²	30	58.7 Å²	58.7	18%	0.184	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	120.3	176.6	-49.6	0	0	0	0	108	M44 D45	M44-T59 WeakPolarHBondContact CA-O 3.48Å; M44-T59 HydrophobicContact CB-CG2 4.48Å; M44-T59 WeakPolarHBondContact CB-O 3.5Å; M44-T59 PolarHBondContact N-O 2.93Å; D45-T59 PolarHBondContact N-O 2.91Å; D45-T59 PolarHBondContact O-N 2.9Å
60	F	89.6	Confident	85.2	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	160.3	176.4	-71.7	-83.7	0	0	0	111.8	R17 V19 F37 D42 V43 V58 D62 I65 A66 L69	R17-F60 WeakPolarHBondContact CB-O 3.46Å; R17-F60 PolarHBondContact O-N 3.13Å; V19-F60 HydrophobicContact CG1-CD2 4.22Å; V19-F60 HydrophobicContact CG1-CE2 4.1Å; V19-F60 HydrophobicContact CG2-CD2 4.22Å; V19-F60 HydrophobicContact CG2-CE2 3.62Å; F37-F60 HydrophobicContact CB-CE1 3.88Å; F37-F60 HydrophobicContact CB-CZ 3.83Å; F37-F60 HydrophobicContact CD1-CE1 4.41Å; F37-F60 AromaticContact CD1-CZ 3.65Å; F37-F60 HydrophobicContact CD1-CZ 3.65Å; F37-F60 HydrophobicContact CE1-CZ 4.42Å; F37-F60 HydrophobicContact CG-CE1 4.41Å; F37-F60 AromaticContact CG-CZ 3.85Å; F37-F60 HydrophobicContact CG-CZ 3.85Å; D42-F60 CarbonylContact O-C 3.57Å; D42-F60 WeakPolarHBondContact O-CA 3.4Å; V43-F60 HydrophobicContact CG2-CD1 4.21Å; V43-F60 HydrophobicContact CG2-CE1 3.87Å; V58-F60 HydrophobicContact CB-CE2 4.42Å; V58-F60 HydrophobicContact CG1-CD2 4.22Å; V58-F60 HydrophobicContact CG1-CE1 4.48Å; V58-F60 HydrophobicContact CG1-CE2 3.78Å; V58-F60 HydrophobicContact CG1-CZ 3.93Å; F60-D62 VanDerWaalsContact C-N 3.33Å; F60-D62 WeakPolarHBondContact CB-O 3.4Å; F60-I65 HydrophobicContact CD1-CG2 4.16Å; F60-I65 HydrophobicContact CE1-CG2 4.15Å; F60-A66 HydrophobicContact CD2-CB 3.97Å; F60-L69 HydrophobicContact CE1-CD1 4.43Å; F60-L69 HydrophobicContact CE2-CD1 4.18Å; F60-L69 HydrophobicContact CZ-CD1 3.72Å
61	A	87.9	Confident	85	Confident	38 Å²	38	52 Å²	52	31%	0.314	29%	0.29	S	S	.	.	S	Bend	trans	-69.8	-36.8	169.4	0	0	0	0	0	111	R17 D42 M44	R17-A61 WeakPolarHBondContact CD-O 3.3Å; D42-A61 HydrophobicContact CB-CB 3.7Å; D42-A61 PolarHBondContact O-N 3.15Å; M44-A61 HydrophobicContact CE-CB 4.18Å; M44-A61 HydrophobicContact CG-CB 3.85Å; M44-A61 HydrophobicContact SD-CB 4.05Å
62	D	83.8	Confident	85	Confident	70 Å²	70	52.3 Å²	52.3	37%	0.374	28%	0.283	S	S	.	.			trans	-115.6	133.1	-173.7	-161.7	-79.8	0	0	0	111.8	F60 Q64 I65	F60-D62 VanDerWaalsContact C-N 3.33Å; F60-D62 WeakPolarHBondContact CB-O 3.4Å; D62-Q64 WeakPolarHBondContact OD1-CB 3.31Å; D62-Q64 WeakPolarHBondContact OD1-CG 3.48Å; D62-Q64 PolarHBondContact OD1-N 2.86Å; D62-I65 HydrophobicContact CB-CD1 3.85Å; D62-I65 HydrophobicContact CB-CG1 4.04Å
63	D	79.6	Confident	85.1	Confident	57 Å²	57	53.6 Å²	53.6	31%	0.305	29%	0.294	S	S	.	.	H	α-helix	trans	-76.4	-25.4	-179.2	60.7	-85.4	0	0	0	113.3	R17 I65 A66 Q67	R17-D63 HydrophobicContact CG-CB 3.81Å; D63-I65 PolarHBondContact O-N 2.69Å; D63-A66 PolarHBondContact O-N 3.32Å; D63-Q67 WeakPolarHBondContact O-CB 3.12Å; D63-Q67 WeakPolarHBondContact O-CG 3.42Å; D63-Q67 PolarHBondContact O-N 3.32Å
64	Q	84.6	Confident	85.3	Confident	122 Å²	122	46.1 Å²	46.1	57%	0.57	27%	0.267	S	S	*	.	H	α-helix	trans	-63.6	-38.5	178.7	-59.5	-79	-74.1	0	0	110.3	D62 Q67 S68	D62-Q64 WeakPolarHBondContact OD1-CB 3.31Å; D62-Q64 WeakPolarHBondContact OD1-CG 3.48Å; D62-Q64 PolarHBondContact OD1-N 2.86Å; Q64-Q67 PolarHBondContact O-N 3.37Å; Q64-S68 VanDerWaalsContact O-CB 3.3Å; Q64-S68 WeakPolarHBondContact O-CB 3.46Å; Q64-S68 PolarHBondContact O-N 3.43Å
65	I	85.8	Confident	85.4	Confident	40 Å²	40	49 Å²	49	21%	0.205	28%	0.275	C	S	.	.	H	α-helix	trans	-68.6	-46.8	-179.7	-54	177.6	0	0	0	109.7	G41 F60 D62 D63 Q67 S68 L69	G41-I65 VanDerWaalsContact CA-CD1 3.41Å; F60-I65 HydrophobicContact CD1-CG2 4.16Å; F60-I65 HydrophobicContact CE1-CG2 4.15Å; D62-I65 HydrophobicContact CB-CD1 3.85Å; D62-I65 HydrophobicContact CB-CG1 4.04Å; D63-I65 PolarHBondContact O-N 2.69Å; I65-Q67 VanDerWaalsContact C-N 3.32Å; I65-Q67 PolarHBondContact O-N 3.31Å; I65-S68 PolarHBondContact O-N 2.79Å; I65-L69 HydrophobicContact CG2-CD1 4.11Å; I65-L69 WeakPolarHBondContact O-CG 3.43Å; I65-L69 PolarHBondContact O-N 2.91Å
66	A	83.4	Confident	85.4	Confident	3 Å²	3	47.2 Å²	47.2	3%	0.025	27%	0.267	C	S	.	.	H	α-helix	trans	-58.6	-42.4	174.8	0	0	0	0	0	112.3	S16 V19 F60 D63 C70	S16-A66 WeakPolarHBondContact O-CB 3.43Å; V19-A66 HydrophobicContact CG1-CB 3.57Å; F60-A66 HydrophobicContact CD2-CB 3.97Å; D63-A66 PolarHBondContact O-N 3.32Å; A66-C70 WeakPolarHBondContact O-CB 3.37Å; A66-C70 PolarHBondContact O-N 3.38Å; A66-C70 VanDerWaalsContact O-N 3.15Å
67	Q	82.2	Confident	85	Confident	75 Å²	75	53.5 Å²	53.5	35%	0.35	30%	0.295	S	S	.	.	H	α-helix	trans	-68	-40	175.8	-75.5	-176.1	-18.2	0	0	112.8	D63 Q64 I65 L69 C70	D63-Q67 WeakPolarHBondContact O-CB 3.12Å; D63-Q67 WeakPolarHBondContact O-CG 3.42Å; D63-Q67 PolarHBondContact O-N 3.32Å; Q64-Q67 PolarHBondContact O-N 3.37Å; I65-Q67 VanDerWaalsContact C-N 3.32Å; I65-Q67 PolarHBondContact O-N 3.31Å; Q67-L69 VanDerWaalsContact C-N 3.3Å; Q67-L69 PolarHBondContact O-N 3.05Å; Q67-C70 WeakPolarHBondContact O-CB 3.49Å; Q67-C70 PolarHBondContact O-N 3.22Å
68	S	84.6	Confident	84.8	Confident	93 Å²	93	54.9 Å²	54.9	65%	0.65	32%	0.32	S	S	*	.	H	α-helix	trans	-68.8	-30.2	-179.8	-169.9	0	0	0	0	112.7	Q64 I65	Q64-S68 VanDerWaalsContact O-CB 3.3Å; Q64-S68 WeakPolarHBondContact O-CB 3.46Å; Q64-S68 PolarHBondContact O-N 3.43Å; I65-S68 PolarHBondContact O-N 2.79Å
69	L	84.6	Confident	84.8	Confident	11 Å²	11	57 Å²	57	6%	0.058	33%	0.33	C	S	.	.	H	α-helix	trans	-84.6	-17.7	176	-65.9	176.1	0	0	0	112.5	F37 Y40 F60 I65 Q67 G71 E72 L74 I83	F37-L69 HydrophobicContact CD1-CD1 4.05Å; F37-L69 HydrophobicContact CE1-CD1 4.19Å; Y40-L69 HydrophobicContact CD1-CD2 3.92Å; Y40-L69 HydrophobicContact CE1-CD2 4.23Å; Y40-L69 HydrophobicContact CG-CD1 4.35Å; Y40-L69 HydrophobicContact CG-CD2 4.16Å; F60-L69 HydrophobicContact CE1-CD1 4.43Å; F60-L69 HydrophobicContact CE2-CD1 4.18Å; F60-L69 HydrophobicContact CZ-CD1 3.72Å; I65-L69 HydrophobicContact CG2-CD1 4.11Å; I65-L69 WeakPolarHBondContact O-CG 3.43Å; I65-L69 PolarHBondContact O-N 2.91Å; Q67-L69 VanDerWaalsContact C-N 3.3Å; Q67-L69 PolarHBondContact O-N 3.05Å; L69-G71 PolarHBondContact O-N 2.73Å; L69-E72 WeakPolarHBondContact O-CB 3.46Å; L69-E72 PolarHBondContact O-N 3.21Å; L69-L74 HydrophobicContact CD2-CD1 4.19Å; L69-I83 HydrophobicContact CB-CD1 4.09Å; L69-I83 HydrophobicContact CB-CG2 4.19Å; L69-I83 WeakPolarHBondContact O-CB 3.35Å; L69-I83 WeakPolarHBondContact O-CG2 3.18Å
70	C	83.3	Confident	84.8	Confident	32 Å²	32	58.7 Å²	58.7	22%	0.216	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	125.3	-179.2	-179.2	0	0	0	0	111.4	A66 Q67 E72 N85	A66-C70 WeakPolarHBondContact O-CB 3.37Å; A66-C70 PolarHBondContact O-N 3.38Å; A66-C70 VanDerWaalsContact O-N 3.15Å; Q67-C70 WeakPolarHBondContact O-CB 3.49Å; Q67-C70 PolarHBondContact O-N 3.22Å; C70-E72 VanDerWaalsContact C-N 3.32Å; C70-N85 VanDerWaalsContact SG-CG 3.5Å; C70-N85 PolarHBondContact SG-N 2.78Å; C70-N85 PolarHBondContact SG-ND2 3.21Å
71	G	80.6	Confident	84.8	Confident	49 Å²	49	58.8 Å²	58.8	51%	0.505	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.8	-6.5	-178.1	0	0	0	0	0	113.8	L69 I83	L69-G71 PolarHBondContact O-N 2.73Å; G71-I83 WeakPolarHBondContact CA-O 3.37Å; G71-I83 PolarHBondContact N-O 3.09Å
72	E	82.6	Confident	84.8	Confident	105 Å²	105	60.3 Å²	60.3	49%	0.491	34%	0.344	S	S	.	.			trans	-87.2	146.9	178.9	-158.8	71	98.1	0	0	111.1	L69 C70 L74 I83	L69-E72 WeakPolarHBondContact O-CB 3.46Å; L69-E72 PolarHBondContact O-N 3.21Å; C70-E72 VanDerWaalsContact C-N 3.32Å; E72-L74 HydrophobicContact CG-CD2 4.14Å; E72-I83 PolarHBondContact O-N 3.2Å; E72-I83 VanDerWaalsContact O-N 3.12Å
73	D	85.9	Confident	85.1	Confident	104 Å²	104	57 Å²	57	56%	0.556	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.7	125.4	166.3	56.2	-93.5	0	0	0	110.9	V81	D73-V81 WeakPolarHBondContact CA-O 3.23Å
74	L	86.4	Confident	85.3	Confident	15 Å²	15	55.9 Å²	55.9	8%	0.079	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	153.2	176.9	-59.3	-173.1	0	0	0	110.1	F36 F37 Y40 L69 E72 S80 V81 I83	F36-L74 HydrophobicContact CE1-CB 4.13Å; F36-L74 HydrophobicContact CE1-CD1 3.69Å; F36-L74 HydrophobicContact CZ-CB 4.33Å; F36-L74 HydrophobicContact CZ-CD1 4.42Å; F37-L74 HydrophobicContact CE1-CD1 3.8Å; F37-L74 HydrophobicContact CZ-CD1 4.49Å; Y40-L74 HydrophobicContact CE2-CD1 4.08Å; L69-L74 HydrophobicContact CD2-CD1 4.19Å; E72-L74 HydrophobicContact CG-CD2 4.14Å; L74-S80 CarbonylContact O-C 3.47Å; L74-S80 WeakPolarHBondContact O-CA 3.35Å; L74-V81 HydrophobicContact CB-CG2 3.84Å; L74-V81 PolarHBondContact N-O 3.39Å; L74-V81 WeakPolarHBondContact O-CG2 3.1Å; L74-V81 PolarHBondContact O-N 2.79Å; L74-I83 HydrophobicContact CD1-CD1 3.29Å; L74-I83 HydrophobicContact CG-CD1 3.69Å
75	I	87.3	Confident	85.2	Confident	103 Å²	103	54 Å²	54	53%	0.528	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	108.9	178.1	-57.5	172.8	0	0	0	108.4	I79	I75-I79 CarbonylContact C-O 3.58Å; I75-I79 WeakPolarHBondContact CA-O 3.24Å
76	I	86	Confident	84.7	Confident	4 Å²	4	52.6 Å²	52.6	2%	0.021	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	116.2	177.8	-56.3	177.3	0	0	0	107.3	M28 L33 F36 F37 G78 I79 V81	M28-I76 HydrophobicContact CE-CB 3.63Å; M28-I76 HydrophobicContact CE-CG2 3.92Å; M28-I76 WeakPolarHBondContact CE-O 3.16Å; M28-I76 HydrophobicContact SD-CB 4.28Å; M28-I76 HydrophobicContact SD-CD1 4.44Å; M28-I76 HydrophobicContact SD-CG2 4.25Å; L33-I76 HydrophobicContact CD2-CD1 3.92Å; F36-I76 HydrophobicContact CD1-CD1 3.66Å; F36-I76 HydrophobicContact CD1-CG1 3.65Å; F36-I76 HydrophobicContact CD2-CG1 4.09Å; F36-I76 HydrophobicContact CD2-CG2 4.47Å; F36-I76 HydrophobicContact CE1-CD1 3.95Å; F36-I76 HydrophobicContact CE1-CG1 3.59Å; F36-I76 HydrophobicContact CE2-CG1 4.05Å; F36-I76 HydrophobicContact CG-CD1 4.12Å; F36-I76 HydrophobicContact CG-CG1 3.9Å; F36-I76 HydrophobicContact CG-CG2 4.47Å; F36-I76 HydrophobicContact CZ-CG1 3.81Å; F37-I76 HydrophobicContact CE2-CD1 4.42Å; F37-I76 HydrophobicContact CZ-CD1 4.45Å; I76-G78 PolarHBondContact O-N 2.83Å; I76-G78 VanDerWaalsContact O-N 3.13Å; I76-I79 PolarHBondContact N-O 2.79Å; I76-I79 WeakPolarHBondContact O-CB 3.17Å; I76-I79 PolarHBondContact O-N 2.99Å; I76-V81 HydrophobicContact CD1-CG1 4.24Å; I76-V81 HydrophobicContact CD1-CG2 3.7Å; I76-V81 HydrophobicContact CG1-CG2 3.97Å
77	K	81.9	Confident	84.1	Confident	134 Å²	134	60.5 Å²	60.5	58%	0.583	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.6	28.4	-179.3	-55.8	172.5	81.6	154.9	0	114.6	E32	E32-K77 WeakPolarHBondContact OE2-CD 3.44Å; E32-K77 WeakPolarHBondContact OE2-CE 3.42Å; E32-K77 IonicContact OE2-NZ 2.78Å; E32-K77 PolarHBondContact OE2-NZ 2.74Å
78	G	85	Confident	82.9	Confident	68 Å²	68	61.2 Å²	61.2	70%	0.701	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.5	6.9	-176.5	0	0	0	0	0	114.7	I76	I76-G78 PolarHBondContact O-N 2.83Å; I76-G78 VanDerWaalsContact O-N 3.13Å
79	I	87.3	Confident	81.5	Confident	44 Å²	44	66.5 Å²	66.5	23%	0.226	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	125.6	177	-59.1	158.2	0	0	0	109.1	T25 M28 I75 I76 V81	T25-I79 HydrophobicContact CG2-CD1 3.88Å; T25-I79 HydrophobicContact CG2-CG1 4.46Å; T25-I79 HydrophobicContact CG2-CG2 4.2Å; T25-I79 VanDerWaalsContact OG1-CD1 3.23Å; T25-I79 WeakPolarHBondContact OG1-CD1 3.16Å; M28-I79 HydrophobicContact CE-CB 3.48Å; M28-I79 VanDerWaalsContact CE-CB 3.48Å; M28-I79 HydrophobicContact CE-CD1 3.61Å; M28-I79 HydrophobicContact CE-CG1 4.14Å; M28-I79 HydrophobicContact CE-CG2 3.65Å; I75-I79 CarbonylContact C-O 3.58Å; I75-I79 WeakPolarHBondContact CA-O 3.24Å; I76-I79 PolarHBondContact N-O 2.79Å; I76-I79 WeakPolarHBondContact O-CB 3.17Å; I76-I79 PolarHBondContact O-N 2.99Å; I79-V81 HydrophobicContact CG2-CG1 4.5Å; I79-V81 PolarHBondContact O-N 2.93Å
80	S	88.6	Confident	79.8	Confident	66 Å²	66	73.1 Å²	73.1	46%	0.462	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	105.7	176.8	-53.6	0	0	0	0	111.2	L74	L74-S80 CarbonylContact O-C 3.47Å; L74-S80 WeakPolarHBondContact O-CA 3.35Å
81	V	90	Very high	78.1	Confident	1 Å²	1	78.4 Å²	78.4	1%	0.006	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	147.2	173.8	-59	0	0	0	0	110.4	V21 G22 M28 D73 L74 I76 I79	V21-V81 HydrophobicContact CG1-CB 3.91Å; V21-V81 HydrophobicContact CG1-CG1 4.42Å; V21-V81 HydrophobicContact CG1-CG2 4.13Å; G22-V81 WeakPolarHBondContact O-CA 3.42Å; M28-V81 HydrophobicContact CE-CG1 3.66Å; M28-V81 HydrophobicContact SD-CG1 3.77Å; D73-V81 WeakPolarHBondContact CA-O 3.23Å; L74-V81 HydrophobicContact CB-CG2 3.84Å; L74-V81 PolarHBondContact N-O 3.39Å; L74-V81 WeakPolarHBondContact O-CG2 3.1Å; L74-V81 PolarHBondContact O-N 2.79Å; I76-V81 HydrophobicContact CD1-CG1 4.24Å; I76-V81 HydrophobicContact CD1-CG2 3.7Å; I76-V81 HydrophobicContact CG1-CG2 3.97Å; I79-V81 HydrophobicContact CG2-CG1 4.5Å; I79-V81 PolarHBondContact O-N 2.93Å
82	H	88.4	Confident	76.5	Confident	70 Å²	70	79.4 Å²	79.4	32%	0.324	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	128.7	177.2	-179.1	68.2	0	0	0	110	G22	G22-H82 PolarHBondContact N-O 2.94Å; G22-H82 PolarHBondContact O-N 2.84Å
83	I	88.9	Confident	74.6	Confident	0 Å²	0	79.5 Å²	79.5	0%	0	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	131.4	-179.6	-57	174.6	0	0	0	109	V19 F20 F37 L69 G71 E72 L74	V19-I83 HydrophobicContact CB-CG2 3.88Å; V19-I83 HydrophobicContact CG1-CG2 4.24Å; V19-I83 HydrophobicContact CG2-CG2 4.2Å; F20-I83 CarbonylContact O-C 3.56Å; F20-I83 WeakPolarHBondContact O-CA 3.47Å; F37-I83 HydrophobicContact CE1-CD1 3.51Å; F37-I83 HydrophobicContact CZ-CD1 3.77Å; F37-I83 HydrophobicContact CZ-CG1 4.39Å; L69-I83 HydrophobicContact CB-CD1 4.09Å; L69-I83 HydrophobicContact CB-CG2 4.19Å; L69-I83 WeakPolarHBondContact O-CB 3.35Å; L69-I83 WeakPolarHBondContact O-CG2 3.18Å; G71-I83 WeakPolarHBondContact CA-O 3.37Å; G71-I83 PolarHBondContact N-O 3.09Å; E72-I83 PolarHBondContact O-N 3.2Å; E72-I83 VanDerWaalsContact O-N 3.12Å; L74-I83 HydrophobicContact CD1-CD1 3.29Å; L74-I83 HydrophobicContact CG-CD1 3.69Å
84	S	84.7	Confident	72.8	Confident	34 Å²	34	85.4 Å²	85.4	24%	0.238	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	168.2	175.6	-166.1	0	0	0	0	110.5	F20 A86	F20-S84 PolarHBondContact N-O 3.48Å; F20-S84 PolarHBondContact O-N 3.34Å; S84-A86 PolarHBondContact O-N 2.98Å
85	N	81.9	Confident	70.9	Confident	83 Å²	83	91.3 Å²	91.3	44%	0.444	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	134	172.5	9.1	57.9	0	0	0	108.9	C70 E87	C70-N85 VanDerWaalsContact SG-CG 3.5Å; C70-N85 PolarHBondContact SG-N 2.78Å; C70-N85 PolarHBondContact SG-ND2 3.21Å; N85-E87 PolarHBondContact O-N 2.88Å
86	A	75.5	Confident	69.1	Low	11 Å²	11	93.1 Å²	93.1	9%	0.091	48%	0.482	C	S	.	.			trans	-70.3	108.9	174.6	0	0	0	0	0	108.8	K18 F20 F57 S84	K18-A86 HydrophobicContact CB-CB 3.97Å; K18-A86 HydrophobicContact CD-CB 4Å; K18-A86 HydrophobicContact CG-CB 3.65Å; K18-A86 VanDerWaalsContact O-CB 3.24Å; K18-A86 WeakPolarHBondContact O-CB 3.49Å; K18-A86 PolarHBondContact O-N 2.66Å; F20-A86 HydrophobicContact CB-CB 4.48Å; F57-A86 HydrophobicContact CD1-CB 4.03Å; F57-A86 HydrophobicContact CE1-CB 4.19Å; S84-A86 PolarHBondContact O-N 2.98Å
87	E	70	Confident	67.1	Low	168 Å²	168	100.6 Å²	100.6	79%	0.785	52%	0.517	S	S	*	.			trans	-59.4	127	170.6	-68.5	-165	103.1	0	0	108.4	N85 K89	N85-E87 PolarHBondContact O-N 2.88Å; E87-K89 PolarHBondContact O-N 3.25Å
88	P	57.9	Low	65.1	Low	91 Å²	91	106.4 Å²	106.4	59%	0.591	54%	0.535	S	S	*	.			trans	-59	120.3	173.9	24.4	-30.9	0	0	0	105.7	H90	P88-H90 PolarHBondContact O-N 3.15Å
89	K	54.6	Low	63.2	Low	204 Å²	204	106.7 Å²	106.7	89%	0.887	53%	0.527	S	S	*	.			trans	-64.9	85.3	169	-151.8	175.6	-171.6	-178.3	0	104.9	E87 N91	E87-K89 PolarHBondContact O-N 3.25Å; K89-N91 VanDerWaalsContact C-N 3.3Å; K89-N91 PolarHBondContact O-N 3.37Å
90	H	48.8	Very low	60.8	Low	150 Å²	150	108 Å²	108	69%	0.694	55%	0.55	S	S	*	*			trans	-57.9	106.9	176.4	-176.2	89.3	0	0	0	103.5	P88 S92	P88-H90 PolarHBondContact O-N 3.15Å; H90-S92 PolarHBondContact CD2-N 3.46Å; H90-S92 PolarHBondContact CD2-OG 3.41Å; H90-S92 PolarHBondContact O-N 3.18Å
91	N	47.3	Very low	58.9	Low	143 Å²	143	116.2 Å²	116.2	77%	0.765	57%	0.571	S	S	*	*			trans	-68.2	75.9	171.3	-168.4	16.1	0	0	0	104.8	K89 N93	K89-N91 VanDerWaalsContact C-N 3.3Å; K89-N91 PolarHBondContact O-N 3.37Å; N91-N93 PolarHBondContact O-N 3.02Å
92	S	46.5	Very low	56.5	Low	70 Å²	70	126.2 Å²	126.2	49%	0.49	62%	0.615	S	S	.	*			trans	-63.4	76.1	156.1	-82.5	0	0	0	0	104.2	H90 R94	H90-S92 PolarHBondContact CD2-N 3.46Å; H90-S92 PolarHBondContact CD2-OG 3.41Å; H90-S92 PolarHBondContact O-N 3.18Å; S92-R94 PolarHBondContact O-N 3.43Å
93	N	43.7	Very low	54	Low	106 Å²	106	126.7 Å²	126.7	57%	0.567	64%	0.639	S	S	*	*			trans	-60.4	71.4	139.3	-167.8	34.9	0	0	0	105.6	N91 Q95	N91-N93 PolarHBondContact O-N 3.02Å; N93-Q95 PolarHBondContact O-N 3.09Å; N93-Q95 PolarHBondContact OD1-N 3.16Å
94	R	48.8	Very low	51.7	Low	228 Å²	228	130.4 Å²	130.4	86%	0.86	68%	0.677	S	S	*	*			trans	-69.8	69.1	142.8	-77.6	-169.3	-158.5	169.9	6.4	104.9	S92 L96	S92-R94 PolarHBondContact O-N 3.43Å; R94-L96 PolarHBondContact O-N 2.67Å
95	Q	45.4	Very low	49.4	Very low	140 Å²	140	136.2 Å²	136.2	65%	0.654	71%	0.705	S	S	*	*			trans	-48.8	119	147.5	-146	175.8	7.5	0	0	104.5	N93	N93-Q95 PolarHBondContact O-N 3.09Å; N93-Q95 PolarHBondContact OD1-N 3.16Å
96	L	49.4	Very low	47.9	Very low	141 Å²	141	138.3 Å²	138.3	74%	0.738	72%	0.724	S	S	*	*			trans	52.4	101.2	135.1	-161	67.7	0	0	0	113.6	R94	R94-L96 PolarHBondContact O-N 2.67Å
97	E	44.6	Very low	46.2	Very low	161 Å²	161	140.6 Å²	140.6	75%	0.752	75%	0.748	S	S	*	*				-147.6	98.8	90.5	-66.6	-147.5	84.9	0	0	111.9	S99	E97-S99 PolarHBondContact O-N 2.74Å; E97-S99 PolarHBondContact OE1-OG 2.8Å
98	R	39.8	Very low	45.3	Very low	256 Å²	256	140.1 Å²	140.1	97%	0.966	75%	0.749	S	S	*	*			trans	-86.4	63.7	148.8	-86	179.5	162.1	175.4	-4.5	107.5
99	S	44.6	Very low	44.5	Very low	74 Å²	74	143.4 Å²	143.4	52%	0.517	76%	0.761	S	S	.	*			trans	-96.8	118.7	170.4	-53.3	0	0	0	0	107.2	E97	E97-S99 PolarHBondContact O-N 2.74Å; E97-S99 PolarHBondContact OE1-OG 2.8Å
100	G	38.2	Very low	44.2	Very low	70 Å²	70	138 Å²	138	72%	0.722	75%	0.749	S	S	*	*			trans	64.1	111.7	147.1	0	0	0	0	0	118.5	F102	G100-F102 PolarHBondContact O-N 3.28Å
101	R	47.6	Very low	44	Very low	239 Å²	239	137.4 Å²	137.4	90%	0.902	76%	0.756	S	S	*	*			trans	-51.9	103.5	153.8	-61.9	174.4	175.1	-144.9	-1.6	110.3
102	F	39	Very low	43.8	Very low	212 Å²	212	135.7 Å²	135.7	93%	0.93	75%	0.754	S	S	*	*			trans	-161.9	130.1	156.2	-89.2	-73.1	0	0	0	111.5	G100	G100-F102 PolarHBondContact O-N 3.28Å
103	G	37.4	Very low	43.3	Very low	80 Å²	80	141.1 Å²	141.1	83%	0.825	77%	0.769	S	S	*	*			trans	86.2	116.8	142	0	0	0	0	0	117.2
104	G	40	Very low	43.2	Very low	77 Å²	77	141.4 Å²	141.4	79%	0.794	77%	0.77	S	S	*	*			trans	-74.8	158.5	-174.4	0	0	0	0	0	116.9
105	N	37.1	Very low	43.2	Very low	157 Å²	157	138.2 Å²	138.2	84%	0.84	77%	0.769	S	S	*	*			trans	-160.2	131.1	140.7	-135.1	-91	0	0	0	109.8
106	P	49.3	Very low	42.9	Very low	127 Å²	127	139.7 Å²	139.7	83%	0.825	78%	0.775	S	S	*	*			trans	-92.7	108.6	174.1	33.4	-26.3	0	0	0	109.7
107	G	40.6	Very low	42.6	Very low	59 Å²	59	140.6 Å²	140.6	61%	0.608	78%	0.776	S	S	*	*			trans	179.3	111.4	175	0	0	0	0	0	114.3
108	I	50.9	Low	42.5	Very low	158 Å²	158	142.2 Å²	142.2	81%	0.81	78%	0.781	S	S	*	*			trans	69.8	108.4	155.2	-66.3	128.2	0	0	0	115.9
109	L	40.3	Very low	42.5	Very low	159 Å²	159	134.6 Å²	134.6	83%	0.832	76%	0.762	S	S	*	*			trans	-162.7	100.8	136.5	-120.5	80.4	0	0	0	105.1
110	S	49.5	Very low	42.4	Very low	91 Å²	91	136.8 Å²	136.8	64%	0.636	77%	0.767	S	S	*	*				49.3	76.2	86.6	-169.7	0	0	0	0	112.2
111	T	43.6	Very low	42.8	Very low	137 Å²	137	139.1 Å²	139.1	84%	0.84	77%	0.767	S	S	*	*			trans	-127.7	83.6	145.1	53.7	0	0	0	0	107.3	F113	T111-F113 PolarHBondContact O-N 2.77Å
112	C	44.2	Very low	42.5	Very low	107 Å²	107	133.8 Å²	133.8	72%	0.723	75%	0.752	S	S	*	*			trans	-32.8	117.9	150.6	-59.2	0	0	0	0	108.9
113	F	35.6	Very low	42.9	Very low	184 Å²	184	131.7 Å²	131.7	81%	0.807	75%	0.745	S	S	*	*	S	Bend		61.3	109.4	95	-103	-108.9	0	0	0	112	T111	T111-F113 PolarHBondContact O-N 2.77Å
114	L	42	Very low	43.1	Very low	113 Å²	113	139.5 Å²	139.5	59%	0.592	75%	0.75	S	S	*	*			trans	55.4	94.8	154.6	-73	99.8	0	0	0	117.9	Q116	L114-Q116 PolarHBondContact O-N 2.9Å
115	I	47.4	Very low	43.7	Very low	161 Å²	161	140.7 Å²	140.7	83%	0.826	74%	0.743	S	S	*	*	S	Bend	trans	-44.1	121	131.6	7.8	173.5	0	0	0	109.6
116	Q	40.6	Very low	43.9	Very low	170 Å²	170	144.2 Å²	144.2	79%	0.794	75%	0.745	S	S	*	*			trans	69.9	61.2	158.6	-118.2	108.9	-9.4	0	0	117.9	L114 F118	L114-Q116 PolarHBondContact O-N 2.9Å; Q116-F118 PolarHBondContact O-N 3.4Å
117	E	42.3	Very low	43.7	Very low	160 Å²	160	149.6 Å²	149.6	75%	0.748	77%	0.766	S	S	*	*			trans	-78.2	111	152.3	-150.9	-176	111.5	0	0	109.8	V119	E117-V119 PolarHBondContact O-N 3.31Å; E117-V119 VanDerWaalsContact O-N 3.09Å
118	F	42.2	Very low	43.8	Very low	196 Å²	196	154.2 Å²	154.2	86%	0.86	77%	0.774	S	S	*	*			trans	-72.4	71.3	179.2	-164.5	-93.2	0	0	0	110.8	Q116	Q116-F118 PolarHBondContact O-N 3.4Å
119	V	39.8	Very low	43.5	Very low	96 Å²	96	153.9 Å²	153.9	58%	0.582	77%	0.772	S	S	*	*			trans	-152.6	87.8	165.7	-167.7	0	0	0	0	110.6	E117 T121	E117-V119 PolarHBondContact O-N 3.31Å; E117-V119 VanDerWaalsContact O-N 3.09Å; V119-T121 VanDerWaalsContact C-N 3.35Å; V119-T121 PolarHBondContact O-N 3.19Å; V119-T121 VanDerWaalsContact O-N 3.1Å
120	I	43.6	Very low	43.7	Very low	120 Å²	120	153.7 Å²	153.7	62%	0.615	77%	0.768	S	S	*	*			trans	-73.3	102.6	154.7	-59.7	179	0	0	0	106.1	H122	I120-H122 VanDerWaalsContact C-N 3.28Å; I120-H122 PolarHBondContact O-N 3.02Å
121	T	46.8	Very low	43.3	Very low	118 Å²	118	157.4 Å²	157.4	72%	0.724	78%	0.776	S	S	*	*			trans	-60.2	89.6	166	-65.6	0	0	0	0	108.5	V119	V119-T121 VanDerWaalsContact C-N 3.35Å; V119-T121 PolarHBondContact O-N 3.19Å; V119-T121 VanDerWaalsContact O-N 3.1Å
122	H	41.2	Very low	43.3	Very low	127 Å²	127	158.6 Å²	158.6	59%	0.588	77%	0.772	S	S	*	*			trans	-98.5	114	157.2	-100.5	-85	0	0	0	108.5	I120 R124	I120-H122 VanDerWaalsContact C-N 3.28Å; I120-H122 PolarHBondContact O-N 3.02Å; H122-R124 PolarHBondContact O-N 2.73Å; H122-R124 VanDerWaalsContact O-N 3.1Å
123	H	45.7	Very low	43.2	Very low	168 Å²	168	162.1 Å²	162.1	78%	0.778	78%	0.775	S	S	*	*			trans	-28.5	110.4	157.5	-97	-101.4	0	0	0	112.9
124	R	42.8	Very low	43.8	Very low	244 Å²	244	160.5 Å²	160.5	92%	0.921	77%	0.773	S	S	*	*			trans	-131.9	100.5	147.4	-92	-161.5	176.1	172.1	2.9	109.5	H122	H122-R124 PolarHBondContact O-N 2.73Å; H122-R124 VanDerWaalsContact O-N 3.1Å
125	P	51.2	Low	43.9	Very low	102 Å²	102	164.2 Å²	164.2	66%	0.662	79%	0.787	S	S	*	*			trans	-94.9	116	152	31.9	-20.7	0	0	0	107.6
126	R	41.3	Very low	43.6	Very low	232 Å²	232	164.4 Å²	164.4	88%	0.875	78%	0.784	S	S	*	*			trans	-158	115.6	149.4	-84.9	-138.7	172.7	149	1.7	112.4
127	L	46	Very low	43.9	Very low	240 Å²	240	163.9 Å²	163.9	100%	1.257	78%	0.783	S	S	*	*			trans	56.3	0	159	-74	107.2	0	0	0	119.1

Retrieved 127 of 127 residues in 210.5 ms (Link to these results)

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