A0A077ZCW1_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZCW1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 111 aa.

						>A0A077ZCW1_TRITR|A0A077ZCW1
MFAAEHCQAQELNDPSRNYIEGRLGNRRIWWCPSGYGYLSFCPQPTDWDNYNWCCTWPYMGTWKPSCCPFAIPTGAVVAVIIAGVVFTAVIIALSCWCCYCCPLYKQLYEY
					

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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	M	44.2	Very low	45.6	Very low	221 Å²	221	120.5 Å²	120.5	100%	1.089	64%	0.641	S	S	*	*				0	-22.6	0	-78.5	171.2	-176.7	0	0	113.7	A3	M1-A3 VanDerWaalsContact C-N 3.33Å; M1-A3 PolarHBondContact O-N 2.87Å
2	F	47	Very low	45.8	Very low	178 Å²	178	120.8 Å²	120.8	78%	0.781	64%	0.642	S	S	*	*	H	α-helix	trans	-64.8	-19.3	-178.7	-68.7	-74.6	0	0	0	117.7
3	A	43.6	Very low	46.4	Very low	77 Å²	77	113.7 Å²	113.7	64%	0.636	60%	0.604	S	S	*	*	H	α-helix	trans	-77.4	-26.2	-177.4	0	0	0	0	0	113.7	M1 C7	M1-A3 VanDerWaalsContact C-N 3.33Å; M1-A3 PolarHBondContact O-N 2.87Å; A3-C7 PolarHBondContact O-N 3.35Å
4	A	44.5	Very low	46.6	Very low	67 Å²	67	110.6 Å²	110.6	55%	0.554	59%	0.587	S	S	*	*	H	α-helix	trans	-76.7	-35.7	-176.2	0	0	0	0	0	112.8	H6 C7 Q8	A4-H6 VanDerWaalsContact C-N 3.35Å; A4-C7 PolarHBondContact O-N 3.39Å; A4-Q8 PolarHBondContact O-N 3.37Å
5	E	48.6	Very low	46.9	Very low	140 Å²	140	105.1 Å²	105.1	65%	0.654	56%	0.56	S	S	*	*	H	α-helix	trans	-67.8	-33.4	176.5	-80.3	-179.3	95.7	0	0	112.5	A9	E5-A9 WeakPolarHBondContact O-CB 2.94Å; E5-A9 PolarHBondContact O-N 3.46Å
6	H	47.7	Very low	47.4	Very low	130 Å²	130	103.5 Å²	103.5	60%	0.602	56%	0.56	S	S	*	*	H	α-helix	trans	-66.9	-37.6	174.7	-89.6	67.5	0	0	0	112.2	A4 A9 Q10	A4-H6 VanDerWaalsContact C-N 3.35Å; H6-A9 PolarHBondContact O-N 3.14Å; H6-Q10 WeakPolarHBondContact O-CB 3.25Å; H6-Q10 VanDerWaalsContact O-CG 3.29Å; H6-Q10 WeakPolarHBondContact O-CG 3.48Å; H6-Q10 PolarHBondContact O-N 3.05Å; H6-Q10 PolarHBondContact O-OE1 3.21Å
7	C	42.9	Very low	47.8	Very low	76 Å²	76	108.6 Å²	108.6	51%	0.514	57%	0.57	S	S	.	*	H	α-helix	trans	-66.3	-41.1	176.6	-69.7	0	0	0	0	112.7	A3 A4 Q10 E11	A3-C7 PolarHBondContact O-N 3.35Å; A4-C7 PolarHBondContact O-N 3.39Å; C7-Q10 PolarHBondContact O-N 3.23Å; C7-E11 PolarHBondContact O-N 3.18Å
8	Q	45.3	Very low	48.5	Very low	149 Å²	149	106.7 Å²	106.7	70%	0.696	56%	0.56	S	S	*	*	H	α-helix	trans	-70.2	-36.1	177.3	-68.2	-153.4	-55.7	0	0	112.6	A4 Q10 L12	A4-Q8 PolarHBondContact O-N 3.37Å; Q8-Q10 VanDerWaalsContact C-N 3.29Å; Q8-Q10 PolarHBondContact O-N 3.26Å; Q8-L12 PolarHBondContact O-N 3.05Å
9	A	46.7	Very low	49.2	Very low	50 Å²	50	102.3 Å²	102.3	41%	0.413	54%	0.535	S	S	.	.	H	α-helix	trans	-63.4	-37.6	170.6	0	0	0	0	0	111	E5 H6 N13	E5-A9 WeakPolarHBondContact O-CB 2.94Å; E5-A9 PolarHBondContact O-N 3.46Å; H6-A9 PolarHBondContact O-N 3.14Å; A9-N13 WeakPolarHBondContact O-CB 3.2Å; A9-N13 PolarHBondContact O-N 3.15Å; A9-N13 VanDerWaalsContact O-N 3.15Å; A9-N13 PolarHBondContact O-ND2 2.68Å
10	Q	48.1	Very low	50	Low	118 Å²	118	102 Å²	102	55%	0.551	53%	0.533	S	S	*	.	H	α-helix	trans	-72.7	-36.9	178.6	-77.4	174.4	-97.1	0	0	113.6	H6 C7 Q8 N13 D14	H6-Q10 WeakPolarHBondContact O-CB 3.25Å; H6-Q10 VanDerWaalsContact O-CG 3.29Å; H6-Q10 WeakPolarHBondContact O-CG 3.48Å; H6-Q10 PolarHBondContact O-N 3.05Å; H6-Q10 PolarHBondContact O-OE1 3.21Å; C7-Q10 PolarHBondContact O-N 3.23Å; Q8-Q10 VanDerWaalsContact C-N 3.29Å; Q8-Q10 PolarHBondContact O-N 3.26Å; Q10-N13 CarbonylContact O-C 3.57Å; Q10-N13 VanDerWaalsContact O-C 3.26Å; Q10-N13 WeakPolarHBondContact O-CA 3.46Å; Q10-N13 PolarHBondContact O-N 3.41Å; Q10-N13 VanDerWaalsContact O-N 3.12Å; Q10-D14 PolarHBondContact O-N 3.44Å
11	E	43.6	Very low	51	Low	119 Å²	119	103.8 Å²	103.8	56%	0.556	54%	0.539	S	S	*	.	H	α-helix	trans	-68.1	-34.6	176.6	-91.7	-169.4	102.4	0	0	113.3	C7 N13 D14	C7-E11 PolarHBondContact O-N 3.18Å; E11-N13 VanDerWaalsContact C-N 3.27Å; E11-D14 PolarHBondContact O-N 3.21Å
12	L	48	Very low	52.3	Low	125 Å²	125	94.4 Å²	94.4	65%	0.654	50%	0.499	S	S	*	.	H	α-helix	trans	-74	-24.8	171.8	-160.8	70.8	0	0	0	111.8	Q8	Q8-L12 PolarHBondContact O-N 3.05Å
13	N	52.6	Low	53.3	Low	28 Å²	28	94 Å²	94	15%	0.15	49%	0.492	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-0.4	175.2	-78.2	-46.3	0	0	0	113.6	A9 Q10 E11 P15 Y36	A9-N13 WeakPolarHBondContact O-CB 3.2Å; A9-N13 PolarHBondContact O-N 3.15Å; A9-N13 VanDerWaalsContact O-N 3.15Å; A9-N13 PolarHBondContact O-ND2 2.68Å; Q10-N13 CarbonylContact O-C 3.57Å; Q10-N13 VanDerWaalsContact O-C 3.26Å; Q10-N13 WeakPolarHBondContact O-CA 3.46Å; Q10-N13 PolarHBondContact O-N 3.41Å; Q10-N13 VanDerWaalsContact O-N 3.12Å; E11-N13 VanDerWaalsContact C-N 3.27Å; N13-P15 WeakPolarHBondContact O-CD 3.45Å; N13-Y36 WeakPolarHBondContact OD1-CE1 3.46Å; N13-Y36 PolarHBondContact OD1-OH 3.33Å
14	D	49.3	Very low	54.5	Low	70 Å²	70	93.8 Å²	93.8	37%	0.374	48%	0.48	S	S	.	.			trans	-73.5	99.3	178.1	-112.8	-54.8	0	0	0	107.5	Q10 E11 S16 R17	Q10-D14 PolarHBondContact O-N 3.44Å; E11-D14 PolarHBondContact O-N 3.21Å; D14-S16 PolarHBondContact O-N 2.81Å; D14-R17 PolarHBondContact O-N 3.09Å
15	P	51.7	Low	55.8	Low	28 Å²	28	94 Å²	94	18%	0.182	49%	0.488	C	S	.	.	H	α-helix	trans	-73.3	-28.1	-163.6	42.3	-40.8	0	0	0	106.1	N13 R17 N18 Y19 A71	N13-P15 WeakPolarHBondContact O-CD 3.45Å; P15-R17 VanDerWaalsContact C-N 3.26Å; P15-R17 PolarHBondContact O-N 2.69Å; P15-R17 VanDerWaalsContact O-N 3.07Å; P15-N18 PolarHBondContact O-N 2.95Å; P15-Y19 HydrophobicContact CB-CD1 4.44Å; P15-Y19 HydrophobicContact CB-CE1 3.5Å; P15-Y19 VanDerWaalsContact CB-CE1 3.5Å; P15-Y19 HydrophobicContact CB-CE2 3.85Å; P15-Y19 WeakPolarHBondContact CB-OH 3.22Å; P15-Y19 HydrophobicContact CG-CE1 4.43Å; P15-Y19 HydrophobicContact CG-CE2 4.16Å; P15-Y19 WeakPolarHBondContact CG-OH 3.32Å; P15-Y19 WeakPolarHBondContact O-CD2 3.43Å; P15-Y19 WeakPolarHBondContact O-CE2 3.48Å; P15-Y19 PolarHBondContact O-N 3.37Å; P15-A71 VanDerWaalsContact CG-O 3.27Å; P15-A71 WeakPolarHBondContact CG-O 3.34Å
16	S	55	Low	57	Low	80 Å²	80	94 Å²	94	56%	0.559	49%	0.493	S	S	*	.	H	α-helix	trans	-53	-25.5	175.2	69.8	0	0	0	0	116.8	D14 Y19	D14-S16 PolarHBondContact O-N 2.81Å; S16-Y19 VanDerWaalsContact CA-CE2 3.5Å
17	R	53.2	Low	58	Low	190 Å²	190	89.8 Å²	89.8	72%	0.717	47%	0.471	S	S	*	.	H	α-helix	trans	-98.9	-21.7	-176.8	-85	-170.9	168.4	179.9	-1.3	114.8	D14 P15	D14-R17 PolarHBondContact O-N 3.09Å; P15-R17 VanDerWaalsContact C-N 3.26Å; P15-R17 PolarHBondContact O-N 2.69Å; P15-R17 VanDerWaalsContact O-N 3.07Å
18	N	60.4	Low	59.4	Low	75 Å²	75	94.9 Å²	94.9	40%	0.401	48%	0.48	S	S	.	.	H	α-helix	trans	-130.2	17.1	-169.5	-64.3	-47.5	0	0	0	113.7	P15 I20 P33	P15-N18 PolarHBondContact O-N 2.95Å; N18-I20 PolarHBondContact O-N 3.45Å; N18-P33 HydrophobicContact CB-CB 4.25Å; N18-P33 HydrophobicContact CB-CG 3.81Å; N18-P33 WeakPolarHBondContact O-CB 3.38Å; N18-P33 WeakPolarHBondContact O-CD 3.26Å
19	Y	62.2	Low	60.8	Low	23 Å²	23	87.9 Å²	87.9	9%	0.09	45%	0.447	C	S	.	.			trans	-63	127	171.7	-67.9	-60.9	0	0	0	111.1	P15 S16 E21 W30 W31 W53 C54 A71	P15-Y19 HydrophobicContact CB-CD1 4.44Å; P15-Y19 HydrophobicContact CB-CE1 3.5Å; P15-Y19 VanDerWaalsContact CB-CE1 3.5Å; P15-Y19 HydrophobicContact CB-CE2 3.85Å; P15-Y19 WeakPolarHBondContact CB-OH 3.22Å; P15-Y19 HydrophobicContact CG-CE1 4.43Å; P15-Y19 HydrophobicContact CG-CE2 4.16Å; P15-Y19 WeakPolarHBondContact CG-OH 3.32Å; P15-Y19 WeakPolarHBondContact O-CD2 3.43Å; P15-Y19 WeakPolarHBondContact O-CE2 3.48Å; P15-Y19 PolarHBondContact O-N 3.37Å; S16-Y19 VanDerWaalsContact CA-CE2 3.5Å; Y19-E21 PolarHBondContact O-N 3.29Å; Y19-W30 VanDerWaalsContact CB-CE3 3.43Å; Y19-W30 HydrophobicContact CD1-CB 3.84Å; Y19-W30 HydrophobicContact CD2-CB 4.48Å; Y19-W30 HydrophobicContact CE1-CB 4.42Å; Y19-W30 HydrophobicContact CG-CB 3.86Å; Y19-W30 HydrophobicContact CG-CE3 4.25Å; Y19-W30 HydrophobicContact CG-CG 4.47Å; Y19-W31 WeakPolarHBondContact CA-O 3.41Å; Y19-W53 AromaticContact CD2-CE3 3.75Å; Y19-W53 HydrophobicContact CD2-CE3 3.75Å; Y19-W53 AromaticContact CD2-CZ3 3.46Å; Y19-W53 HydrophobicContact CD2-CZ3 3.46Å; Y19-W53 VanDerWaalsContact CD2-CZ3 3.46Å; Y19-W53 HydrophobicContact CE1-CE3 4.33Å; Y19-W53 AromaticContact CE2-CE3 3.2Å; Y19-W53 HydrophobicContact CE2-CE3 3.2Å; Y19-W53 HydrophobicContact CE2-CH2 4.48Å; Y19-W53 AromaticContact CE2-CZ3 3.15Å; Y19-W53 HydrophobicContact CE2-CZ3 3.15Å; Y19-W53 AromaticContact CZ-CE3 3.5Å; Y19-W53 AromaticContact CZ-CZ3 3.96Å; Y19-C54 HydrophobicContact CD1-CB 4.31Å; Y19-C54 HydrophobicContact CE1-CB 3.92Å; Y19-C54 WeakPolarHBondContact CE1-O 3.34Å; Y19-C54 PolarHBondContact OH-O 3.45Å; Y19-A71 HydrophobicContact CE2-CB 4.24Å; Y19-A71 WeakPolarHBondContact OH-CA 3.29Å; Y19-A71 PolarHBondContact OH-O 2.89Å
20	I	65.9	Low	62.1	Low	96 Å²	96	89.1 Å²	89.1	49%	0.492	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	114.9	170.3	-57.2	165.6	0	0	0	106.1	N18 G22 W31	N18-I20 PolarHBondContact O-N 3.45Å; I20-G22 PolarHBondContact O-N 2.87Å; I20-W31 HydrophobicContact CB-CB 4.28Å; I20-W31 PolarHBondContact N-O 2.8Å; I20-W31 VanDerWaalsContact N-O 3.11Å; I20-W31 PolarHBondContact O-N 3.3Å
21	E	71.2	Confident	63.2	Low	140 Å²	140	86.4 Å²	86.4	65%	0.654	43%	0.426	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.5	131.7	172.5	62.2	173.5	-179.8	0	0	109.9	Y19 W30	Y19-E21 PolarHBondContact O-N 3.29Å; E21-W30 HydrophobicContact CB-CE3 4.1Å; E21-W30 HydrophobicContact CB-CZ3 3.95Å
22	G	70.4	Confident	64.3	Low	23 Å²	23	81 Å²	81	24%	0.237	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	174.7	173.8	0	0	0	0	0	111	I20 I29	I20-G22 PolarHBondContact O-N 2.87Å; G22-I29 PolarHBondContact N-O 3.43Å; G22-I29 PolarHBondContact O-N 3.35Å
23	R	68.4	Low	64.9	Low	171 Å²	171	77.6 Å²	77.6	65%	0.645	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.5	116.8	-179.6	-153.7	-178.9	-177.9	173.9	-2.5	109	G25 N26 R27	R23-G25 WeakPolarHBondContact CD-O 3.36Å; R23-G25 WeakPolarHBondContact CG-O 3.15Å; R23-G25 PolarHBondContact NE-O 3.22Å; R23-N26 PolarHBondContact NH2-OD1 3.41Å; R23-R27 WeakPolarHBondContact CA-O 3.29Å; R23-R27 WeakPolarHBondContact CG-O 3.31Å
24	L	68.2	Low	65.2	Low	72 Å²	72	80.6 Å²	80.6	38%	0.377	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	112.6	159.3	-87.2	90.4	0	0	0	108.1	N26 R27 I29 W31 P43	L24-N26 PolarHBondContact O-N 3.38Å; L24-R27 PolarHBondContact N-O 3.46Å; L24-R27 WeakPolarHBondContact O-CB 3.4Å; L24-R27 PolarHBondContact O-N 2.65Å; L24-R27 VanDerWaalsContact O-N 3.07Å; L24-I29 HydrophobicContact CB-CD1 3.61Å; L24-I29 HydrophobicContact CD1-CD1 3.46Å; L24-I29 VanDerWaalsContact CD1-CD1 3.46Å; L24-I29 HydrophobicContact CG-CD1 4.03Å; L24-W31 HydrophobicContact CD1-CH2 3.54Å; L24-W31 HydrophobicContact CD1-CZ2 3.18Å; L24-P43 VanDerWaalsContact CD2-CD 3.45Å; L24-P43 HydrophobicContact CD2-CG 3.99Å
25	G	73.2	Confident	65.6	Low	70 Å²	70	77.4 Å²	77.4	72%	0.722	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.1	-118.3	-177.8	0	0	0	0	0	111.9	R23	R23-G25 WeakPolarHBondContact CD-O 3.36Å; R23-G25 WeakPolarHBondContact CG-O 3.15Å; R23-G25 PolarHBondContact NE-O 3.22Å
26	N	73.7	Confident	66	Low	142 Å²	142	78.9 Å²	78.9	76%	0.759	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96	3.4	179.4	-159	29.1	0	0	0	114	R23 L24	R23-N26 PolarHBondContact NH2-OD1 3.41Å; L24-N26 PolarHBondContact O-N 3.38Å
27	R	68.6	Low	66.1	Low	41 Å²	41	79 Å²	79	16%	0.155	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	134.8	-169	-173.1	175.9	172.9	-153.1	-10	111.4	R23 L24 I29 W48 D49 N50 Y51 N52	R23-R27 WeakPolarHBondContact CA-O 3.29Å; R23-R27 WeakPolarHBondContact CG-O 3.31Å; L24-R27 PolarHBondContact N-O 3.46Å; L24-R27 WeakPolarHBondContact O-CB 3.4Å; L24-R27 PolarHBondContact O-N 2.65Å; L24-R27 VanDerWaalsContact O-N 3.07Å; R27-I29 HydrophobicContact CG-CG1 4.3Å; R27-W48 PolarHBondContact NH1-O 2.89Å; R27-W48 PolarHBondContact NH2-O 3.23Å; R27-D49 PolarHBondContact NE-O 3.45Å; R27-D49 VanDerWaalsContact NH1-CA 3.3Å; R27-D49 PolarHBondContact NH1-O 2.84Å; R27-D49 IonicContact NH1-OD1 3.96Å; R27-D49 VanDerWaalsContact NH2-C 3.26Å; R27-D49 PolarHBondContact NH2-O 3.46Å; R27-N50 VanDerWaalsContact NH2-C 3.3Å; R27-Y51 VanDerWaalsContact NH2-CA 3.27Å; R27-Y51 PolarHBondContact NH2-O 3.14Å; R27-N52 PolarHBondContact NE-OD1 3.48Å; R27-N52 PolarHBondContact NH2-OD1 2.88Å
28	R	72.2	Confident	66.3	Low	183 Å²	183	74.8 Å²	74.8	69%	0.691	40%	0.395	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.5	130	173.2	-65	-172.3	-177.2	-146.3	2.7	109.4
29	I	74.3	Confident	66.3	Low	1 Å²	1	77 Å²	77	1%	0.005	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	138.6	-177.1	-67.4	175.6	0	0	0	108.7	G22 L24 R27 W31 C42 P43 N52	G22-I29 PolarHBondContact N-O 3.43Å; G22-I29 PolarHBondContact O-N 3.35Å; L24-I29 HydrophobicContact CB-CD1 3.61Å; L24-I29 HydrophobicContact CD1-CD1 3.46Å; L24-I29 VanDerWaalsContact CD1-CD1 3.46Å; L24-I29 HydrophobicContact CG-CD1 4.03Å; R27-I29 HydrophobicContact CG-CG1 4.3Å; I29-W31 HydrophobicContact CG2-CD2 4.31Å; I29-C42 HydrophobicContact CG2-CB 4.32Å; I29-P43 HydrophobicContact CD1-CG 4.42Å; I29-N52 WeakPolarHBondContact CA-O 3.46Å
30	W	73.8	Confident	66.2	Low	77 Å²	77	78.7 Å²	78.7	29%	0.292	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	108.2	178.6	-62.1	99.9	0	0	0	108.6	Y19 E21 N52 W53 C54	Y19-W30 VanDerWaalsContact CB-CE3 3.43Å; Y19-W30 HydrophobicContact CD1-CB 3.84Å; Y19-W30 HydrophobicContact CD2-CB 4.48Å; Y19-W30 HydrophobicContact CE1-CB 4.42Å; Y19-W30 HydrophobicContact CG-CB 3.86Å; Y19-W30 HydrophobicContact CG-CE3 4.25Å; Y19-W30 HydrophobicContact CG-CG 4.47Å; E21-W30 HydrophobicContact CB-CE3 4.1Å; E21-W30 HydrophobicContact CB-CZ3 3.95Å; W30-N52 PolarHBondContact N-O 3.35Å; W30-W53 HydrophobicContact CB-CE3 4.36Å; W30-W53 AromaticContact CD1-CD2 3.73Å; W30-W53 AromaticContact CD1-CE2 3.81Å; W30-W53 HydrophobicContact CG-CD2 4.24Å; W30-W53 HydrophobicContact CG-CE3 4.14Å; W30-W53 HydrophobicContact CG-CZ3 4.47Å; W30-W53 AromaticContact NE1-CE2 3.83Å; W30-W53 AromaticContact NE1-CZ2 3.9Å; W30-C54 WeakPolarHBondContact O-CB 2.89Å; W30-C54 PolarHBondContact O-N 2.88Å
31	W	70.6	Confident	65.9	Low	60 Å²	60	80 Å²	80	23%	0.227	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	148.1	-179.7	-59.7	97	0	0	0	111.5	Y19 I20 L24 I29 S40 C42	Y19-W31 WeakPolarHBondContact CA-O 3.41Å; I20-W31 HydrophobicContact CB-CB 4.28Å; I20-W31 PolarHBondContact N-O 2.8Å; I20-W31 VanDerWaalsContact N-O 3.11Å; I20-W31 PolarHBondContact O-N 3.3Å; L24-W31 HydrophobicContact CD1-CH2 3.54Å; L24-W31 HydrophobicContact CD1-CZ2 3.18Å; I29-W31 HydrophobicContact CG2-CD2 4.31Å; W31-S40 WeakPolarHBondContact CZ3-O 3.35Å; W31-C42 HydrophobicContact CE3-CB 4.2Å; W31-C42 WeakPolarHBondContact CH2-O 3.46Å; W31-C42 HydrophobicContact CZ3-CB 4.3Å; W31-C42 VanDerWaalsContact CZ3-N 3.33Å; W31-C42 WeakPolarHBondContact CZ3-O 3.18Å
32	C	66.8	Low	65.7	Low	7 Å²	7	73.5 Å²	73.5	5%	0.047	39%	0.393	C	S	.	.			trans	-74.5	136.3	170.3	-77.3	0	0	0	0	110.8	S34 C54 P65	C32-S34 VanDerWaalsContact C-N 3.26Å; C32-S34 PolarHBondContact O-N 2.93Å; C32-S34 VanDerWaalsContact O-N 3.12Å; C32-C54 HydrophobicContact CB-CB 3.99Å; C32-C54 WeakPolarHBondContact CB-SG 3.3Å; C32-C54 WeakPolarHBondContact SG-CB 3.5Å; C32-C54 CovalentContact SG-SG 2.01Å; C32-C54 PolarHBondContact SG-SG 3.32Å; C32-P65 HydrophobicContact CB-CB 4.37Å
33	P	62	Low	65.5	Low	53 Å²	53	74.2 Å²	74.2	34%	0.344	39%	0.394	S	S	.	.	S	Bend	trans	-67.2	-14	-171.4	25.2	-35.7	0	0	0	115.6	N18	N18-P33 HydrophobicContact CB-CB 4.25Å; N18-P33 HydrophobicContact CB-CG 3.81Å; N18-P33 WeakPolarHBondContact O-CB 3.38Å; N18-P33 WeakPolarHBondContact O-CD 3.26Å
34	S	58.8	Low	65.5	Low	91 Å²	91	69.9 Å²	69.9	64%	0.636	38%	0.381	S	S	*	.	S	Bend	trans	-139.2	-0	-175.4	-62	0	0	0	0	116.4	C32 Y36	C32-S34 VanDerWaalsContact C-N 3.26Å; C32-S34 PolarHBondContact O-N 2.93Å; C32-S34 VanDerWaalsContact O-N 3.12Å; S34-Y36 PolarHBondContact O-N 3.46Å
35	G	57.5	Low	65.5	Low	3 Å²	3	73 Å²	73	3%	0.031	41%	0.406	C	S	.	.	G	3₁₀ helix	trans	56.4	-7.2	-178	0	0	0	0	0	115.6	G37 Y38 P65	G35-G37 PolarHBondContact O-N 2.79Å; G35-Y38 CarbonylContact C-O 3.49Å; G35-Y38 WeakPolarHBondContact CA-O 3.39Å; G35-Y38 CarbonylContact O-C 3.53Å; G35-Y38 WeakPolarHBondContact O-CA 3.36Å; G35-Y38 VanDerWaalsContact O-CB 3.28Å; G35-Y38 WeakPolarHBondContact O-CB 3.49Å; G35-Y38 PolarHBondContact O-N 3.32Å; G35-P65 VanDerWaalsContact O-CD 3.28Å; G35-P65 WeakPolarHBondContact O-CD 3.49Å; G35-P65 WeakPolarHBondContact O-CG 3.32Å
36	Y	59.2	Low	65.4	Low	59 Å²	59	74.7 Å²	74.7	23%	0.231	40%	0.402	C	S	.	.	G	3₁₀ helix	trans	49	39.1	-174.8	-61.9	-92.9	0	0	0	113.5	N13 S34 Y38 T56 W63	N13-Y36 WeakPolarHBondContact OD1-CE1 3.46Å; N13-Y36 PolarHBondContact OD1-OH 3.33Å; S34-Y36 PolarHBondContact O-N 3.46Å; Y36-Y38 PolarHBondContact O-N 3.4Å; Y36-T56 HydrophobicContact CD2-CG2 3.9Å; Y36-T56 HydrophobicContact CE2-CG2 3.22Å; Y36-W63 WeakPolarHBondContact CB-O 3.27Å; Y36-W63 HydrophobicContact CD1-CB 3.51Å; Y36-W63 HydrophobicContact CD1-CG 4.15Å; Y36-W63 HydrophobicContact CD2-CB 4.26Å; Y36-W63 HydrophobicContact CE1-CB 3.84Å; Y36-W63 HydrophobicContact CE1-CG 4.15Å; Y36-W63 HydrophobicContact CG-CB 3.71Å
37	G	57.8	Low	65.3	Low	83 Å²	83	69.9 Å²	69.9	86%	0.856	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	82.2	-3.7	-175.1	0	0	0	0	0	114.4	G35	G35-G37 PolarHBondContact O-N 2.79Å
38	Y	57.6	Low	65.5	Low	100 Å²	100	76.5 Å²	76.5	39%	0.392	40%	0.401	S	S	.	.	S	Bend	trans	-98.2	154.4	166.6	-58.6	-84.3	0	0	0	109.8	G35 Y36 S40 T62 K64	G35-Y38 CarbonylContact C-O 3.49Å; G35-Y38 WeakPolarHBondContact CA-O 3.39Å; G35-Y38 CarbonylContact O-C 3.53Å; G35-Y38 WeakPolarHBondContact O-CA 3.36Å; G35-Y38 VanDerWaalsContact O-CB 3.28Å; G35-Y38 WeakPolarHBondContact O-CB 3.49Å; G35-Y38 PolarHBondContact O-N 3.32Å; Y36-Y38 PolarHBondContact O-N 3.4Å; Y38-S40 PolarHBondContact O-N 2.82Å; Y38-T62 PolarHBondContact OH-OG1 2.87Å; Y38-K64 HydrophobicContact CD2-CB 4.38Å; Y38-K64 HydrophobicContact CD2-CG 4.1Å; Y38-K64 HydrophobicContact CE2-CB 4.28Å; Y38-K64 HydrophobicContact CE2-CG 4.27Å; Y38-K64 HydrophobicContact CG-CG 4.27Å
39	L	60.3	Low	65.5	Low	123 Å²	123	74.1 Å²	74.1	64%	0.644	40%	0.402	S	S	*	.			trans	-58	131.2	167.4	-85.1	79.8	0	0	0	107.9	F41	L39-F41 VanDerWaalsContact C-N 3.27Å; L39-F41 HydrophobicContact CB-CD2 3.26Å; L39-F41 HydrophobicContact CB-CE2 3.05Å; L39-F41 HydrophobicContact CB-CG 4.17Å; L39-F41 HydrophobicContact CB-CZ 3.76Å; L39-F41 HydrophobicContact CD1-CE2 4.37Å; L39-F41 HydrophobicContact CD2-CD2 4.4Å; L39-F41 HydrophobicContact CD2-CE1 4.24Å; L39-F41 HydrophobicContact CD2-CE2 3.37Å; L39-F41 HydrophobicContact CD2-CZ 3.25Å; L39-F41 HydrophobicContact CG-CD2 4.4Å; L39-F41 HydrophobicContact CG-CE2 3.72Å; L39-F41 HydrophobicContact CG-CZ 4.1Å; L39-F41 WeakPolarHBondContact O-CD2 3.5Å; L39-F41 PolarHBondContact O-N 3.26Å
40	S	59.5	Low	65.7	Low	57 Å²	57	80 Å²	80	40%	0.399	43%	0.434	S	S	.	.			trans	-60.5	93.2	170	53.6	0	0	0	0	107.6	W31 Y38	W31-S40 WeakPolarHBondContact CZ3-O 3.35Å; Y38-S40 PolarHBondContact O-N 2.82Å
41	F	61	Low	65.7	Low	124 Å²	124	79.1 Å²	79.1	54%	0.544	43%	0.431	S	S	.	.			trans	-112.2	97.5	179.5	-80.1	-62.6	0	0	0	108.8	L39	L39-F41 VanDerWaalsContact C-N 3.27Å; L39-F41 HydrophobicContact CB-CD2 3.26Å; L39-F41 HydrophobicContact CB-CE2 3.05Å; L39-F41 HydrophobicContact CB-CG 4.17Å; L39-F41 HydrophobicContact CB-CZ 3.76Å; L39-F41 HydrophobicContact CD1-CE2 4.37Å; L39-F41 HydrophobicContact CD2-CD2 4.4Å; L39-F41 HydrophobicContact CD2-CE1 4.24Å; L39-F41 HydrophobicContact CD2-CE2 3.37Å; L39-F41 HydrophobicContact CD2-CZ 3.25Å; L39-F41 HydrophobicContact CG-CD2 4.4Å; L39-F41 HydrophobicContact CG-CE2 3.72Å; L39-F41 HydrophobicContact CG-CZ 4.1Å; L39-F41 WeakPolarHBondContact O-CD2 3.5Å; L39-F41 PolarHBondContact O-N 3.26Å
42	C	66.9	Low	66	Low	3 Å²	3	78.7 Å²	78.7	2%	0.02	43%	0.433	C	S	.	.	S	Bend	trans	-141	111.9	166.9	-172.5	0	0	0	0	107.9	I29 W31 C67	I29-C42 HydrophobicContact CG2-CB 4.32Å; W31-C42 HydrophobicContact CE3-CB 4.2Å; W31-C42 WeakPolarHBondContact CH2-O 3.46Å; W31-C42 HydrophobicContact CZ3-CB 4.3Å; W31-C42 VanDerWaalsContact CZ3-N 3.33Å; W31-C42 WeakPolarHBondContact CZ3-O 3.18Å; C42-C67 WeakPolarHBondContact CA-SG 3.07Å; C42-C67 HydrophobicContact CB-CB 4.35Å; C42-C67 WeakPolarHBondContact CB-SG 3.09Å; C42-C67 WeakPolarHBondContact SG-CB 3.32Å; C42-C67 CovalentContact SG-SG 2.01Å; C42-C67 PolarHBondContact SG-SG 3.16Å
43	P	66.1	Low	66.3	Low	39 Å²	39	81.8 Å²	81.8	25%	0.253	44%	0.444	S	S	.	.	S	Bend	cis	-85.7	144.5	6.8	36	-28.2	0	0	0	113.6	L24 I29 D47 C67	L24-P43 VanDerWaalsContact CD2-CD 3.45Å; L24-P43 HydrophobicContact CD2-CG 3.99Å; I29-P43 HydrophobicContact CD1-CG 4.42Å; P43-D47 HydrophobicContact CB-CB 4.18Å; P43-C67 WeakPolarHBondContact CA-SG 3.34Å
44	Q	67.4	Low	66.9	Low	79 Å²	79	79.4 Å²	79.4	37%	0.369	43%	0.428	S	S	.	.			trans	-69.7	149.1	161.3	-158.6	171	-92	0	0	108.3	T46 D47	Q44-T46 PolarHBondContact NE2-OG1 2.99Å; Q44-T46 PolarHBondContact O-N 3.47Å; Q44-D47 WeakPolarHBondContact CA-OD2 2.7Å; Q44-D47 HydrophobicContact CB-CB 4.45Å; Q44-D47 WeakPolarHBondContact CB-OD2 3.27Å; Q44-D47 PolarHBondContact N-OD2 3.42Å; Q44-D47 WeakPolarHBondContact O-CB 3.18Å; Q44-D47 PolarHBondContact O-N 3.23Å
45	P	67.4	Low	67.5	Low	139 Å²	139	75.3 Å²	75.3	90%	0.903	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-13.6	178.3	20.5	-35.2	0	0	0	115
46	T	72.9	Confident	68.2	Low	104 Å²	104	76.1 Å²	76.1	64%	0.638	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.7	-8.4	175.3	55.8	0	0	0	0	113.7	Q44	Q44-T46 PolarHBondContact NE2-OG1 2.99Å; Q44-T46 PolarHBondContact O-N 3.47Å
47	D	71.1	Confident	68.6	Low	42 Å²	42	78.1 Å²	78.1	23%	0.225	41%	0.411	C	S	.	.	S	Bend	trans	-81.2	141.3	-175.1	-69.5	-32.7	0	0	0	111.3	P43 Q44 Y51	P43-D47 HydrophobicContact CB-CB 4.18Å; Q44-D47 WeakPolarHBondContact CA-OD2 2.7Å; Q44-D47 HydrophobicContact CB-CB 4.45Å; Q44-D47 WeakPolarHBondContact CB-OD2 3.27Å; Q44-D47 PolarHBondContact N-OD2 3.42Å; Q44-D47 WeakPolarHBondContact O-CB 3.18Å; Q44-D47 PolarHBondContact O-N 3.23Å; D47-Y51 HydrophobicContact CB-CD1 4.38Å
48	W	71.4	Confident	69.3	Low	179 Å²	179	79 Å²	79	68%	0.678	40%	0.401	S	S	*	.			trans	-69.6	156.1	178.4	-72	-49.9	0	0	0	112.8	R27 N50 Y51	R27-W48 PolarHBondContact NH1-O 2.89Å; R27-W48 PolarHBondContact NH2-O 3.23Å; W48-N50 PolarHBondContact O-N 3.33Å; W48-Y51 HydrophobicContact CB-CD2 4.08Å; W48-Y51 HydrophobicContact CB-CE2 4.33Å; W48-Y51 HydrophobicContact CE3-CD2 4.45Å; W48-Y51 AromaticContact CE3-CE2 3.58Å; W48-Y51 HydrophobicContact CE3-CE2 3.58Å; W48-Y51 AromaticContact CE3-CZ 3.71Å; W48-Y51 HydrophobicContact CZ3-CE2 4.35Å; W48-Y51 WeakPolarHBondContact O-CB 3.41Å; W48-Y51 PolarHBondContact O-N 3.41Å; W48-Y51 VanDerWaalsContact O-N 3.08Å
49	D	74	Confident	69.7	Low	134 Å²	134	80 Å²	80	72%	0.717	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-7.7	176.3	-76.3	-50.8	0	0	0	115	R27	R27-D49 PolarHBondContact NE-O 3.45Å; R27-D49 VanDerWaalsContact NH1-CA 3.3Å; R27-D49 PolarHBondContact NH1-O 2.84Å; R27-D49 IonicContact NH1-OD1 3.96Å; R27-D49 VanDerWaalsContact NH2-C 3.26Å; R27-D49 PolarHBondContact NH2-O 3.46Å
50	N	76.7	Confident	70.2	Confident	123 Å²	123	81.6 Å²	81.6	66%	0.658	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.8	-8.7	178.6	-65	-37.9	0	0	0	113.8	R27 W48 N52	R27-N50 VanDerWaalsContact NH2-C 3.3Å; W48-N50 PolarHBondContact O-N 3.33Å; N50-N52 PolarHBondContact O-N 2.95Å; N50-N52 VanDerWaalsContact O-N 3.16Å
51	Y	75	Confident	70.5	Confident	59 Å²	59	82.9 Å²	82.9	23%	0.231	43%	0.434	C	S	.	.			trans	-84.4	78.8	-176.2	-78.6	-143	0	0	0	113.3	R27 D47 W48 C67 C68 P69	R27-Y51 VanDerWaalsContact NH2-CA 3.27Å; R27-Y51 PolarHBondContact NH2-O 3.14Å; D47-Y51 HydrophobicContact CB-CD1 4.38Å; W48-Y51 HydrophobicContact CB-CD2 4.08Å; W48-Y51 HydrophobicContact CB-CE2 4.33Å; W48-Y51 HydrophobicContact CE3-CD2 4.45Å; W48-Y51 AromaticContact CE3-CE2 3.58Å; W48-Y51 HydrophobicContact CE3-CE2 3.58Å; W48-Y51 AromaticContact CE3-CZ 3.71Å; W48-Y51 HydrophobicContact CZ3-CE2 4.35Å; W48-Y51 WeakPolarHBondContact O-CB 3.41Å; W48-Y51 PolarHBondContact O-N 3.41Å; W48-Y51 VanDerWaalsContact O-N 3.08Å; Y51-C67 HydrophobicContact CD1-CB 4.08Å; Y51-C67 WeakPolarHBondContact CD1-O 3.03Å; Y51-C67 HydrophobicContact CG-CB 4.4Å; Y51-C68 CarbonylContact C-O 3.53Å; Y51-C68 VanDerWaalsContact C-O 3.28Å; Y51-C68 VanDerWaalsContact CA-O 3.32Å; Y51-C68 WeakPolarHBondContact CA-O 3Å; Y51-P69 HydrophobicContact CD2-CB 4.29Å; Y51-P69 HydrophobicContact CD2-CG 4.46Å; Y51-P69 HydrophobicContact CE2-CB 4.36Å; Y51-P69 HydrophobicContact CE2-CG 4.13Å
52	N	76.9	Confident	70.8	Confident	51 Å²	51	79.8 Å²	79.8	27%	0.273	43%	0.425	S	S	.	.			trans	-90.8	-15.9	-170.7	-65.3	-25.9	0	0	0	114.4	R27 I29 W30 N50 C68	R27-N52 PolarHBondContact NE-OD1 3.48Å; R27-N52 PolarHBondContact NH2-OD1 2.88Å; I29-N52 WeakPolarHBondContact CA-O 3.46Å; W30-N52 PolarHBondContact N-O 3.35Å; N50-N52 PolarHBondContact O-N 2.95Å; N50-N52 VanDerWaalsContact O-N 3.16Å; N52-C68 PolarHBondContact N-O 2.91Å; N52-C68 VanDerWaalsContact N-O 3.15Å
53	W	73.2	Confident	70.8	Confident	72 Å²	72	84.5 Å²	84.5	27%	0.273	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	138.7	-167.9	-72.8	82.5	0	0	0	111.2	Y19 W30 C55 C67 C68 F70 A71	Y19-W53 AromaticContact CD2-CE3 3.75Å; Y19-W53 HydrophobicContact CD2-CE3 3.75Å; Y19-W53 AromaticContact CD2-CZ3 3.46Å; Y19-W53 HydrophobicContact CD2-CZ3 3.46Å; Y19-W53 VanDerWaalsContact CD2-CZ3 3.46Å; Y19-W53 HydrophobicContact CE1-CE3 4.33Å; Y19-W53 AromaticContact CE2-CE3 3.2Å; Y19-W53 HydrophobicContact CE2-CE3 3.2Å; Y19-W53 HydrophobicContact CE2-CH2 4.48Å; Y19-W53 AromaticContact CE2-CZ3 3.15Å; Y19-W53 HydrophobicContact CE2-CZ3 3.15Å; Y19-W53 AromaticContact CZ-CE3 3.5Å; Y19-W53 AromaticContact CZ-CZ3 3.96Å; W30-W53 HydrophobicContact CB-CE3 4.36Å; W30-W53 AromaticContact CD1-CD2 3.73Å; W30-W53 AromaticContact CD1-CE2 3.81Å; W30-W53 HydrophobicContact CG-CD2 4.24Å; W30-W53 HydrophobicContact CG-CE3 4.14Å; W30-W53 HydrophobicContact CG-CZ3 4.47Å; W30-W53 AromaticContact NE1-CE2 3.83Å; W30-W53 AromaticContact NE1-CZ2 3.9Å; W53-C55 PolarHBondContact O-N 2.92Å; W53-C67 CarbonylContact O-C 3.26Å; W53-C67 VanDerWaalsContact O-CA 3.29Å; W53-C67 WeakPolarHBondContact O-CA 3.1Å; W53-C68 PolarHBondContact N-O 3.26Å; W53-C68 PolarHBondContact O-N 2.72Å; W53-F70 WeakPolarHBondContact CB-O 3.1Å; W53-A71 HydrophobicContact CD2-CB 3.76Å; W53-A71 HydrophobicContact CE3-CB 3.24Å; W53-A71 HydrophobicContact CG-CB 4.49Å; W53-A71 HydrophobicContact CH2-CB 4.01Å; W53-A71 HydrophobicContact CZ2-CB 4.45Å; W53-A71 HydrophobicContact CZ3-CB 3.39Å
54	C	73.2	Confident	71	Confident	3 Å²	3	85.8 Å²	85.8	2%	0.02	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	127	170.7	-167.3	0	0	0	0	110.7	Y19 W30 C32 S66	Y19-C54 HydrophobicContact CD1-CB 4.31Å; Y19-C54 HydrophobicContact CE1-CB 3.92Å; Y19-C54 WeakPolarHBondContact CE1-O 3.34Å; Y19-C54 PolarHBondContact OH-O 3.45Å; W30-C54 WeakPolarHBondContact O-CB 2.89Å; W30-C54 PolarHBondContact O-N 2.88Å; C32-C54 HydrophobicContact CB-CB 3.99Å; C32-C54 WeakPolarHBondContact CB-SG 3.3Å; C32-C54 WeakPolarHBondContact SG-CB 3.5Å; C32-C54 CovalentContact SG-SG 2.01Å; C32-C54 PolarHBondContact SG-SG 3.32Å; C54-S66 CarbonylContact C-O 3.28Å; C54-S66 WeakPolarHBondContact CA-O 3.48Å
55	C	71.8	Confident	71.1	Confident	6 Å²	6	82.5 Å²	82.5	4%	0.041	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	141.7	170.8	-88.6	0	0	0	0	109	W53 P65 S66 C68	W53-C55 PolarHBondContact O-N 2.92Å; C55-P65 CarbonylContact O-C 3.34Å; C55-S66 WeakPolarHBondContact CB-OG 3.04Å; C55-S66 PolarHBondContact N-O 2.64Å; C55-S66 PolarHBondContact O-N 2.7Å; C55-S66 VanDerWaalsContact O-O 3.1Å; C55-S66 PolarHBondContact O-OG 3.15Å; C55-C68 HydrophobicContact CB-CB 3.9Å; C55-C68 WeakPolarHBondContact CB-SG 3.04Å; C55-C68 WeakPolarHBondContact SG-CB 2.9Å; C55-C68 CovalentContact SG-SG 2.02Å; C55-C68 PolarHBondContact SG-SG 2.79Å
56	T	72.4	Confident	71.3	Confident	19 Å²	19	76.3 Å²	76.3	12%	0.117	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	136	167.6	57.1	0	0	0	0	108.4	Y36 K64	Y36-T56 HydrophobicContact CD2-CG2 3.9Å; Y36-T56 HydrophobicContact CE2-CG2 3.22Å; T56-K64 WeakPolarHBondContact CA-O 3.23Å
57	W	68.7	Low	71.4	Confident	102 Å²	102	71.6 Å²	71.6	39%	0.386	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	146.6	169.4	65.2	66.6	0	0	0	109.9	Y59 K64 S66	W57-Y59 PolarHBondContact O-N 2.82Å; W57-K64 HydrophobicContact CZ2-CB 4.46Å; W57-K64 HydrophobicContact CZ2-CD 3.92Å; W57-K64 HydrophobicContact CZ2-CG 4.31Å; W57-K64 PolarHBondContact N-O 3.23Å; W57-K64 VanDerWaalsContact N-O 3.14Å; W57-K64 PolarHBondContact O-N 3.07Å; W57-S66 WeakPolarHBondContact CZ3-OG 3.46Å
58	P	72.3	Confident	71.5	Confident	100 Å²	100	70.2 Å²	70.2	65%	0.649	36%	0.355	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.2	120.3	172.5	28.9	-32.7	0	0	0	109	W63	P58-W63 HydrophobicContact CB-CZ3 4.3Å; P58-W63 HydrophobicContact CG-CZ3 4.47Å
59	Y	65.9	Low	71.6	Confident	121 Å²	121	63.5 Å²	63.5	48%	0.475	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	120.1	174.8	-173.4	-98.9	0	0	0	109.3	W57 G61 T62	W57-Y59 PolarHBondContact O-N 2.82Å; Y59-G61 PolarHBondContact O-N 3.39Å; Y59-G61 VanDerWaalsContact O-N 3.16Å; Y59-T62 PolarHBondContact N-O 2.94Å; Y59-T62 CarbonylContact O-C 3.58Å; Y59-T62 PolarHBondContact O-N 3Å; Y59-T62 PolarHBondContact O-OG1 3.2Å; Y59-T62 VanDerWaalsContact O-OG1 3.09Å
60	M	69.9	Low	71.4	Confident	157 Å²	157	63.6 Å²	63.6	77%	0.773	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.3	40.1	175.9	-59.8	-65.7	-166.5	0	0	114.1	T62	M60-T62 PolarHBondContact O-N 2.88Å
61	G	66.9	Low	70.8	Confident	85 Å²	85	58.8 Å²	58.8	88%	0.876	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.1	-2.7	179.5	0	0	0	0	0	115.2	Y59	Y59-G61 PolarHBondContact O-N 3.39Å; Y59-G61 VanDerWaalsContact O-N 3.16Å
62	T	67.5	Low	70.2	Confident	58 Å²	58	60.2 Å²	60.2	36%	0.356	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	166.8	169.1	61.8	0	0	0	0	110.3	Y38 Y59 M60	Y38-T62 PolarHBondContact OH-OG1 2.87Å; Y59-T62 PolarHBondContact N-O 2.94Å; Y59-T62 CarbonylContact O-C 3.58Å; Y59-T62 PolarHBondContact O-N 3Å; Y59-T62 PolarHBondContact O-OG1 3.2Å; Y59-T62 VanDerWaalsContact O-OG1 3.09Å; M60-T62 PolarHBondContact O-N 2.88Å
63	W	66.2	Low	69.7	Low	103 Å²	103	60.7 Å²	60.7	39%	0.39	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	121.7	173.2	-65.1	92.2	0	0	0	107.2	Y36 P58	Y36-W63 WeakPolarHBondContact CB-O 3.27Å; Y36-W63 HydrophobicContact CD1-CB 3.51Å; Y36-W63 HydrophobicContact CD1-CG 4.15Å; Y36-W63 HydrophobicContact CD2-CB 4.26Å; Y36-W63 HydrophobicContact CE1-CB 3.84Å; Y36-W63 HydrophobicContact CE1-CG 4.15Å; Y36-W63 HydrophobicContact CG-CB 3.71Å; P58-W63 HydrophobicContact CB-CZ3 4.3Å; P58-W63 HydrophobicContact CG-CZ3 4.47Å
64	K	70	Confident	69.4	Low	65 Å²	65	61.4 Å²	61.4	28%	0.283	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	127.9	175.6	-169.7	178.8	173.6	-163.8	0	109	Y38 T56 W57	Y38-K64 HydrophobicContact CD2-CB 4.38Å; Y38-K64 HydrophobicContact CD2-CG 4.1Å; Y38-K64 HydrophobicContact CE2-CB 4.28Å; Y38-K64 HydrophobicContact CE2-CG 4.27Å; Y38-K64 HydrophobicContact CG-CG 4.27Å; T56-K64 WeakPolarHBondContact CA-O 3.23Å; W57-K64 HydrophobicContact CZ2-CB 4.46Å; W57-K64 HydrophobicContact CZ2-CD 3.92Å; W57-K64 HydrophobicContact CZ2-CG 4.31Å; W57-K64 PolarHBondContact N-O 3.23Å; W57-K64 VanDerWaalsContact N-O 3.14Å; W57-K64 PolarHBondContact O-N 3.07Å
65	P	69	Low	69.1	Low	10 Å²	10	63.6 Å²	63.6	7%	0.065	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	146.8	175.7	32.2	-36.4	0	0	0	110.7	C32 G35 C55	C32-P65 HydrophobicContact CB-CB 4.37Å; G35-P65 VanDerWaalsContact O-CD 3.28Å; G35-P65 WeakPolarHBondContact O-CD 3.49Å; G35-P65 WeakPolarHBondContact O-CG 3.32Å; C55-P65 CarbonylContact O-C 3.34Å
66	S	71.7	Confident	69	Low	9 Å²	9	65.2 Å²	65.2	6%	0.063	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	168.1	-178.2	65	0	0	0	0	111.3	C54 C55 W57	C54-S66 CarbonylContact C-O 3.28Å; C54-S66 WeakPolarHBondContact CA-O 3.48Å; C55-S66 WeakPolarHBondContact CB-OG 3.04Å; C55-S66 PolarHBondContact N-O 2.64Å; C55-S66 PolarHBondContact O-N 2.7Å; C55-S66 VanDerWaalsContact O-O 3.1Å; C55-S66 PolarHBondContact O-OG 3.15Å; W57-S66 WeakPolarHBondContact CZ3-OG 3.46Å
67	C	74.5	Confident	69.1	Low	6 Å²	6	67.1 Å²	67.1	4%	0.041	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	146.6	169.6	-54	0	0	0	0	113.1	C42 P43 Y51 W53	C42-C67 WeakPolarHBondContact CA-SG 3.07Å; C42-C67 HydrophobicContact CB-CB 4.35Å; C42-C67 WeakPolarHBondContact CB-SG 3.09Å; C42-C67 WeakPolarHBondContact SG-CB 3.32Å; C42-C67 CovalentContact SG-SG 2.01Å; C42-C67 PolarHBondContact SG-SG 3.16Å; P43-C67 WeakPolarHBondContact CA-SG 3.34Å; Y51-C67 HydrophobicContact CD1-CB 4.08Å; Y51-C67 WeakPolarHBondContact CD1-O 3.03Å; Y51-C67 HydrophobicContact CG-CB 4.4Å; W53-C67 CarbonylContact O-C 3.26Å; W53-C67 VanDerWaalsContact O-CA 3.29Å; W53-C67 WeakPolarHBondContact O-CA 3.1Å
68	C	74.3	Confident	69.6	Low	12 Å²	12	66 Å²	66	8%	0.081	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	160.8	170.6	-75.9	0	0	0	0	110.6	Y51 N52 W53 C55 F70	Y51-C68 CarbonylContact C-O 3.53Å; Y51-C68 VanDerWaalsContact C-O 3.28Å; Y51-C68 VanDerWaalsContact CA-O 3.32Å; Y51-C68 WeakPolarHBondContact CA-O 3Å; N52-C68 PolarHBondContact N-O 2.91Å; N52-C68 VanDerWaalsContact N-O 3.15Å; W53-C68 PolarHBondContact N-O 3.26Å; W53-C68 PolarHBondContact O-N 2.72Å; C55-C68 HydrophobicContact CB-CB 3.9Å; C55-C68 WeakPolarHBondContact CB-SG 3.04Å; C55-C68 WeakPolarHBondContact SG-CB 2.9Å; C55-C68 CovalentContact SG-SG 2.02Å; C55-C68 PolarHBondContact SG-SG 2.79Å; C68-F70 WeakPolarHBondContact CB-O 2.86Å; C68-F70 PolarHBondContact O-N 2.9Å
69	P	73.4	Confident	70.2	Confident	39 Å²	39	63.8 Å²	63.8	25%	0.253	38%	0.378	S	S	.	.	S	Bend	trans	-68.3	-25.3	168.6	26.9	-31.8	0	0	0	112.8	Y51	Y51-P69 HydrophobicContact CD2-CB 4.29Å; Y51-P69 HydrophobicContact CD2-CG 4.46Å; Y51-P69 HydrophobicContact CE2-CB 4.36Å; Y51-P69 HydrophobicContact CE2-CG 4.13Å
70	F	68.9	Low	71.1	Confident	135 Å²	135	63.2 Å²	63.2	59%	0.592	39%	0.386	S	S	*	.	S	Bend	trans	-126.4	157.3	-177.3	-59.5	-73.7	0	0	0	111.6	W53 C68 I72	W53-F70 WeakPolarHBondContact CB-O 3.1Å; C68-F70 WeakPolarHBondContact CB-O 2.86Å; C68-F70 PolarHBondContact O-N 2.9Å; F70-I72 PolarHBondContact O-N 2.99Å; F70-I72 VanDerWaalsContact O-N 3.15Å
71	A	64.5	Low	72	Confident	22 Å²	22	60.7 Å²	60.7	18%	0.182	38%	0.375	C	S	.	.	S	Bend	trans	-61.4	-17.9	175.5	0	0	0	0	0	114	P15 Y19 W53	P15-A71 VanDerWaalsContact CG-O 3.27Å; P15-A71 WeakPolarHBondContact CG-O 3.34Å; Y19-A71 HydrophobicContact CE2-CB 4.24Å; Y19-A71 WeakPolarHBondContact OH-CA 3.29Å; Y19-A71 PolarHBondContact OH-O 2.89Å; W53-A71 HydrophobicContact CD2-CB 3.76Å; W53-A71 HydrophobicContact CE3-CB 3.24Å; W53-A71 HydrophobicContact CG-CB 4.49Å; W53-A71 HydrophobicContact CH2-CB 4.01Å; W53-A71 HydrophobicContact CZ2-CB 4.45Å; W53-A71 HydrophobicContact CZ3-CB 3.39Å
72	I	63.8	Low	73.1	Confident	90 Å²	90	61.3 Å²	61.3	46%	0.462	36%	0.357	S	S	.	.	S	Bend	trans	-104.2	133.2	-171.2	-57.6	170.6	0	0	0	107.7	F70 T74 A76 V77	F70-I72 PolarHBondContact O-N 2.99Å; F70-I72 VanDerWaalsContact O-N 3.15Å; I72-T74 PolarHBondContact O-N 3.15Å; I72-A76 HydrophobicContact CG2-CB 3.76Å; I72-V77 HydrophobicContact CB-CG2 4.11Å; I72-V77 HydrophobicContact CG2-CG2 3.79Å
73	P	65.7	Low	74.3	Confident	61 Å²	61	61.2 Å²	61.2	40%	0.396	36%	0.363	S	S	.	.			trans	-54.9	130.7	173.9	22.9	-32.5	0	0	0	108.9	G75 A76 V77	P73-G75 PolarHBondContact O-N 3.43Å; P73-A76 HydrophobicContact CG-CB 3.91Å; P73-A76 WeakPolarHBondContact O-CB 3.35Å; P73-A76 PolarHBondContact O-N 2.95Å; P73-V77 PolarHBondContact O-N 3.46Å
74	T	67.4	Low	75.6	Confident	87 Å²	87	58 Å²	58	53%	0.534	36%	0.361	S	S	.	.	H	α-helix	trans	-51.1	-33.1	-177.5	47.7	0	0	0	0	112.2	I72 A76 V77 V78	I72-T74 PolarHBondContact O-N 3.15Å; T74-A76 PolarHBondContact O-N 3.47Å; T74-V77 PolarHBondContact O-N 3.25Å; T74-V78 WeakPolarHBondContact O-CG2 2.89Å; T74-V78 PolarHBondContact O-N 3.1Å
75	G	66.6	Low	76.8	Confident	49 Å²	49	59.4 Å²	59.4	51%	0.505	38%	0.375	S	S	.	.	H	α-helix	trans	-60.6	-37.9	173.9	0	0	0	0	0	114.5	P73 V78 A79	P73-G75 PolarHBondContact O-N 3.43Å; G75-V78 PolarHBondContact O-N 3.36Å; G75-A79 VanDerWaalsContact O-CB 3.28Å; G75-A79 WeakPolarHBondContact O-CB 3.03Å; G75-A79 PolarHBondContact O-N 3.16Å
76	A	70.1	Confident	78	Confident	40 Å²	40	62.9 Å²	62.9	33%	0.331	40%	0.396	S	S	.	.	H	α-helix	trans	-70.8	-38.2	177.3	0	0	0	0	0	111.6	I72 P73 T74 V78 A79 V80	I72-A76 HydrophobicContact CG2-CB 3.76Å; P73-A76 HydrophobicContact CG-CB 3.91Å; P73-A76 WeakPolarHBondContact O-CB 3.35Å; P73-A76 PolarHBondContact O-N 2.95Å; T74-A76 PolarHBondContact O-N 3.47Å; A76-V78 VanDerWaalsContact C-N 3.34Å; A76-V78 PolarHBondContact O-N 3.43Å; A76-A79 PolarHBondContact O-N 2.88Å; A76-V80 VanDerWaalsContact O-CG2 3.3Å; A76-V80 WeakPolarHBondContact O-CG2 3.45Å; A76-V80 PolarHBondContact O-N 2.93Å
77	V	73.9	Confident	79	Confident	59 Å²	59	69.1 Å²	69.1	36%	0.358	42%	0.422	S	S	.	.	H	α-helix	trans	-60.5	-47.1	174.2	-178.6	0	0	0	0	110.2	I72 P73 T74 V80 I81	I72-V77 HydrophobicContact CB-CG2 4.11Å; I72-V77 HydrophobicContact CG2-CG2 3.79Å; P73-V77 PolarHBondContact O-N 3.46Å; T74-V77 PolarHBondContact O-N 3.25Å; V77-V80 PolarHBondContact O-N 3.48Å; V77-I81 HydrophobicContact CG1-CD1 4.08Å; V77-I81 VanDerWaalsContact O-CG1 3.31Å; V77-I81 WeakPolarHBondContact O-CG1 3.28Å; V77-I81 PolarHBondContact O-N 3.05Å; V77-I81 VanDerWaalsContact O-N 3.1Å
78	V	79.6	Confident	79.8	Confident	78 Å²	78	72.6 Å²	72.6	47%	0.473	44%	0.443	S	S	.	.	H	α-helix	trans	-63.4	-42.9	177.2	175	0	0	0	0	111.3	T74 G75 A76 V80 I81 I82	T74-V78 WeakPolarHBondContact O-CG2 2.89Å; T74-V78 PolarHBondContact O-N 3.1Å; G75-V78 PolarHBondContact O-N 3.36Å; A76-V78 VanDerWaalsContact C-N 3.34Å; A76-V78 PolarHBondContact O-N 3.43Å; V78-V80 VanDerWaalsContact C-N 3.35Å; V78-V80 PolarHBondContact O-N 3.43Å; V78-I81 PolarHBondContact O-N 3.47Å; V78-I82 HydrophobicContact CG1-CD1 3.72Å; V78-I82 HydrophobicContact CG1-CG1 4.35Å; V78-I82 WeakPolarHBondContact O-CG1 3.04Å; V78-I82 PolarHBondContact O-N 2.88Å
79	A	83.4	Confident	80.6	Confident	54 Å²	54	74.6 Å²	74.6	45%	0.446	46%	0.46	S	S	.	.	H	α-helix	trans	-61.3	-41.1	178	0	0	0	0	0	112.4	G75 A76 I82 A83	G75-A79 VanDerWaalsContact O-CB 3.28Å; G75-A79 WeakPolarHBondContact O-CB 3.03Å; G75-A79 PolarHBondContact O-N 3.16Å; A76-A79 PolarHBondContact O-N 2.88Å; A79-I82 PolarHBondContact O-N 3.24Å; A79-A83 VanDerWaalsContact O-CB 3.23Å; A79-A83 WeakPolarHBondContact O-CB 3.11Å; A79-A83 PolarHBondContact O-N 3.43Å
80	V	85.9	Confident	81.4	Confident	108 Å²	108	76.1 Å²	76.1	66%	0.655	47%	0.469	S	S	*	.	H	α-helix	trans	-65.3	-41.1	176.6	170.7	0	0	0	0	111.3	A76 V77 V78 A83 G84	A76-V80 VanDerWaalsContact O-CG2 3.3Å; A76-V80 WeakPolarHBondContact O-CG2 3.45Å; A76-V80 PolarHBondContact O-N 2.93Å; V77-V80 PolarHBondContact O-N 3.48Å; V78-V80 VanDerWaalsContact C-N 3.35Å; V78-V80 PolarHBondContact O-N 3.43Å; V80-A83 PolarHBondContact O-N 2.84Å; V80-G84 PolarHBondContact O-N 3.3Å
81	I	88.6	Confident	82.3	Confident	105 Å²	105	73.8 Å²	73.8	54%	0.538	46%	0.462	S	S	.	.	H	α-helix	trans	-62.3	-49	176.4	-66.9	165.2	0	0	0	110.2	V77 V78 A83 G84 V85	V77-I81 HydrophobicContact CG1-CD1 4.08Å; V77-I81 VanDerWaalsContact O-CG1 3.31Å; V77-I81 WeakPolarHBondContact O-CG1 3.28Å; V77-I81 PolarHBondContact O-N 3.05Å; V77-I81 VanDerWaalsContact O-N 3.1Å; V78-I81 PolarHBondContact O-N 3.47Å; I81-A83 PolarHBondContact O-N 2.85Å; I81-G84 PolarHBondContact O-N 2.9Å; I81-V85 WeakPolarHBondContact O-CG2 3.37Å; I81-V85 PolarHBondContact O-N 3.31Å
82	I	91.1	Very high	83.4	Confident	97 Å²	97	77.2 Å²	77.2	50%	0.497	48%	0.476	S	S	.	.	H	α-helix	trans	-61.9	-44.4	178.4	-65.4	169.2	0	0	0	110.5	V78 A79 G84 V85 V86	V78-I82 HydrophobicContact CG1-CD1 3.72Å; V78-I82 HydrophobicContact CG1-CG1 4.35Å; V78-I82 WeakPolarHBondContact O-CG1 3.04Å; V78-I82 PolarHBondContact O-N 2.88Å; A79-I82 PolarHBondContact O-N 3.24Å; I82-G84 VanDerWaalsContact C-N 3.31Å; I82-G84 PolarHBondContact O-N 3.21Å; I82-V85 PolarHBondContact O-N 3.32Å; I82-V86 HydrophobicContact CG2-CG2 4.23Å; I82-V86 WeakPolarHBondContact O-CG2 3.2Å; I82-V86 PolarHBondContact O-N 3.29Å
83	A	91.2	Very high	84.3	Confident	57 Å²	57	74.9 Å²	74.9	47%	0.471	47%	0.47	S	S	.	.	H	α-helix	trans	-59.4	-42.4	176.7	0	0	0	0	0	111.5	A79 V80 I81 V86 F87	A79-A83 VanDerWaalsContact O-CB 3.23Å; A79-A83 WeakPolarHBondContact O-CB 3.11Å; A79-A83 PolarHBondContact O-N 3.43Å; V80-A83 PolarHBondContact O-N 2.84Å; I81-A83 PolarHBondContact O-N 2.85Å; A83-V86 PolarHBondContact O-N 3.07Å; A83-F87 WeakPolarHBondContact O-CB 3.43Å; A83-F87 PolarHBondContact O-N 3.27Å
84	G	94.4	Very high	85.1	Confident	35 Å²	35	76.1 Å²	76.1	36%	0.361	47%	0.473	S	S	.	.	H	α-helix	trans	-61	-44.1	174.8	0	0	0	0	0	113.1	V80 I81 I82 T88	V80-G84 PolarHBondContact O-N 3.3Å; I81-G84 PolarHBondContact O-N 2.9Å; I82-G84 VanDerWaalsContact C-N 3.31Å; I82-G84 PolarHBondContact O-N 3.21Å; G84-T88 WeakPolarHBondContact O-CB 3.39Å; G84-T88 PolarHBondContact O-N 3.25Å; G84-T88 PolarHBondContact O-OG1 2.01Å
85	V	94.3	Very high	85.6	Confident	94 Å²	94	74.6 Å²	74.6	57%	0.57	47%	0.466	S	S	*	.	H	α-helix	trans	-64	-48.3	176.5	173.6	0	0	0	0	111.2	I81 I82 F87 T88 A89	I81-V85 WeakPolarHBondContact O-CG2 3.37Å; I81-V85 PolarHBondContact O-N 3.31Å; I82-V85 PolarHBondContact O-N 3.32Å; V85-F87 VanDerWaalsContact C-N 3.35Å; V85-F87 PolarHBondContact O-N 2.77Å; V85-T88 PolarHBondContact O-N 2.02Å; V85-A89 WeakPolarHBondContact O-CB 3.29Å; V85-A89 PolarHBondContact O-N 3.49Å
86	V	94	Very high	85.7	Confident	83 Å²	83	75.8 Å²	75.8	50%	0.503	47%	0.466	S	S	.	.	H	α-helix	trans	-62.6	-43.9	178.9	173.4	0	0	0	0	110.6	I82 A83 T88 A89 V90	I82-V86 HydrophobicContact CG2-CG2 4.23Å; I82-V86 WeakPolarHBondContact O-CG2 3.2Å; I82-V86 PolarHBondContact O-N 3.29Å; A83-V86 PolarHBondContact O-N 3.07Å; V86-T88 VanDerWaalsContact C-N 3.34Å; V86-T88 PolarHBondContact O-N 2.99Å; V86-A89 PolarHBondContact O-N 3.08Å; V86-V90 HydrophobicContact CG1-CG2 4.37Å; V86-V90 VanDerWaalsContact O-CG2 3.29Å; V86-V90 WeakPolarHBondContact O-CG2 3.04Å; V86-V90 PolarHBondContact O-N 2.01Å
87	F	92.8	Very high	85.6	Confident	141 Å²	141	83.9 Å²	83.9	62%	0.618	49%	0.488	S	S	*	.	H	α-helix	trans	-62.9	-42	178.6	-169.3	-105.6	0	0	0	111.7	A83 V85 V90 I91	A83-F87 WeakPolarHBondContact O-CB 3.43Å; A83-F87 PolarHBondContact O-N 3.27Å; V85-F87 VanDerWaalsContact C-N 3.35Å; V85-F87 PolarHBondContact O-N 2.77Å; F87-V90 PolarHBondContact O-N 2.77Å; F87-I91 HydrophobicContact CD1-CD1 3.6Å; F87-I91 HydrophobicContact CD1-CG1 4.41Å; F87-I91 HydrophobicContact CE1-CD1 3.29Å; F87-I91 HydrophobicContact CE1-CG1 4.24Å; F87-I91 HydrophobicContact CG-CD1 4.47Å; F87-I91 HydrophobicContact CZ-CD1 3.92Å; F87-I91 WeakPolarHBondContact O-CG1 3.42Å; F87-I91 PolarHBondContact O-N 3.49Å
88	T	91.9	Very high	85.1	Confident	78 Å²	78	84.6 Å²	84.6	48%	0.479	50%	0.495	S	S	.	.	H	α-helix	trans	-63.3	-44.3	175.4	-52.7	0	0	0	0	111	G84 V85 V86 V90 I91 I92	G84-T88 WeakPolarHBondContact O-CB 3.39Å; G84-T88 PolarHBondContact O-N 3.25Å; G84-T88 PolarHBondContact O-OG1 2.01Å; V85-T88 PolarHBondContact O-N 2.02Å; V86-T88 VanDerWaalsContact C-N 3.34Å; V86-T88 PolarHBondContact O-N 2.99Å; T88-V90 VanDerWaalsContact C-N 3.35Å; T88-V90 PolarHBondContact O-N 3.45Å; T88-I91 PolarHBondContact O-N 3.32Å; T88-I92 HydrophobicContact CG2-CD1 4.02Å; T88-I92 VanDerWaalsContact O-CG1 3.26Å; T88-I92 WeakPolarHBondContact O-CG1 3.44Å; T88-I92 PolarHBondContact O-N 2.84Å
89	A	90.3	Very high	83.9	Confident	54 Å²	54	83.2 Å²	83.2	45%	0.446	49%	0.488	S	S	.	.	H	α-helix	trans	-62.9	-39.8	177	0	0	0	0	0	112.5	V85 V86 I92 A93	V85-A89 WeakPolarHBondContact O-CB 3.29Å; V85-A89 PolarHBondContact O-N 3.49Å; V86-A89 PolarHBondContact O-N 3.08Å; A89-I92 PolarHBondContact O-N 3.12Å; A89-A93 WeakPolarHBondContact O-CB 3.43Å; A89-A93 PolarHBondContact O-N 3.05Å
90	V	91	Very high	82.4	Confident	72 Å²	72	91.4 Å²	91.4	44%	0.436	51%	0.509	S	S	.	.	H	α-helix	trans	-66	-42.8	175.5	170.9	0	0	0	0	111.1	V86 F87 T88 I92 A93 L94	V86-V90 HydrophobicContact CG1-CG2 4.37Å; V86-V90 VanDerWaalsContact O-CG2 3.29Å; V86-V90 WeakPolarHBondContact O-CG2 3.04Å; V86-V90 PolarHBondContact O-N 2.01Å; F87-V90 PolarHBondContact O-N 2.77Å; T88-V90 VanDerWaalsContact C-N 3.35Å; T88-V90 PolarHBondContact O-N 3.45Å; V90-I92 VanDerWaalsContact C-N 3.31Å; V90-I92 PolarHBondContact O-N 3.15Å; V90-A93 PolarHBondContact O-N 3.21Å; V90-L94 HydrophobicContact CG1-CD1 3.78Å; V90-L94 HydrophobicContact CG1-CG 4.21Å; V90-L94 WeakPolarHBondContact O-CB 3.37Å; V90-L94 VanDerWaalsContact O-CG 3.27Å; V90-L94 WeakPolarHBondContact O-CG 3.05Å; V90-L94 PolarHBondContact O-N 3.11Å
91	I	88.3	Confident	80.8	Confident	86 Å²	86	91.6 Å²	91.6	44%	0.441	51%	0.514	S	S	.	.	H	α-helix	trans	-60.6	-43.6	174.9	-71.9	173	0	0	0	110.7	F87 T88 L94 S95	F87-I91 HydrophobicContact CD1-CD1 3.6Å; F87-I91 HydrophobicContact CD1-CG1 4.41Å; F87-I91 HydrophobicContact CE1-CD1 3.29Å; F87-I91 HydrophobicContact CE1-CG1 4.24Å; F87-I91 HydrophobicContact CG-CD1 4.47Å; F87-I91 HydrophobicContact CZ-CD1 3.92Å; F87-I91 WeakPolarHBondContact O-CG1 3.42Å; F87-I91 PolarHBondContact O-N 3.49Å; T88-I91 PolarHBondContact O-N 3.32Å; I91-L94 PolarHBondContact O-N 2.82Å; I91-S95 WeakPolarHBondContact O-CB 3.49Å; I91-S95 PolarHBondContact O-N 3.46Å; I91-S95 PolarHBondContact O-OG 3.34Å
92	I	86.4	Confident	79.4	Confident	94 Å²	94	88.8 Å²	88.8	48%	0.482	50%	0.503	S	S	.	.	H	α-helix	trans	-62.5	-48.7	177.3	-66.7	164.3	0	0	0	110	T88 A89 V90 L94 S95 C96	T88-I92 HydrophobicContact CG2-CD1 4.02Å; T88-I92 VanDerWaalsContact O-CG1 3.26Å; T88-I92 WeakPolarHBondContact O-CG1 3.44Å; T88-I92 PolarHBondContact O-N 2.84Å; A89-I92 PolarHBondContact O-N 3.12Å; V90-I92 VanDerWaalsContact C-N 3.31Å; V90-I92 PolarHBondContact O-N 3.15Å; I92-L94 PolarHBondContact O-N 3.3Å; I92-S95 WeakPolarHBondContact CA-OG 3.11Å; I92-S95 PolarHBondContact O-N 2.93Å; I92-S95 VanDerWaalsContact O-N 3.14Å; I92-S95 PolarHBondContact O-OG 3.47Å; I92-C96 PolarHBondContact O-N 3.47Å; I92-C96 PolarHBondContact O-SG 2.8Å
93	A	83.8	Confident	77.7	Confident	40 Å²	40	89.5 Å²	89.5	33%	0.331	51%	0.514	S	S	.	.	H	α-helix	trans	-61	-42.4	178.5	0	0	0	0	0	112.5	A89 V90 C96 W97	A89-A93 WeakPolarHBondContact O-CB 3.43Å; A89-A93 PolarHBondContact O-N 3.05Å; V90-A93 PolarHBondContact O-N 3.21Å; A93-C96 WeakPolarHBondContact O-CB 3.37Å; A93-C96 PolarHBondContact O-N 2.84Å; A93-W97 PolarHBondContact O-N 2.78Å
94	L	83.1	Confident	76	Confident	88 Å²	88	92.6 Å²	92.6	46%	0.461	52%	0.522	S	S	.	.	H	α-helix	trans	-64.7	-39.3	174.4	-73.7	173.1	0	0	0	111.5	V90 I91 I92 C96 W97 C98	V90-L94 HydrophobicContact CG1-CD1 3.78Å; V90-L94 HydrophobicContact CG1-CG 4.21Å; V90-L94 WeakPolarHBondContact O-CB 3.37Å; V90-L94 VanDerWaalsContact O-CG 3.27Å; V90-L94 WeakPolarHBondContact O-CG 3.05Å; V90-L94 PolarHBondContact O-N 3.11Å; I91-L94 PolarHBondContact O-N 2.82Å; I92-L94 PolarHBondContact O-N 3.3Å; L94-C96 VanDerWaalsContact C-N 3.3Å; L94-C96 PolarHBondContact O-N 2.92Å; L94-W97 HydrophobicContact CD2-CE3 4.24Å; L94-W97 PolarHBondContact O-N 2.9Å; L94-C98 VanDerWaalsContact O-CB 3.22Å; L94-C98 WeakPolarHBondContact O-CB 3.41Å; L94-C98 PolarHBondContact O-N 3.49Å; L94-C98 PolarHBondContact O-SG 2.71Å; L94-C98 VanDerWaalsContact O-SG 3.33Å
95	S	76.6	Confident	74.1	Confident	54 Å²	54	97 Å²	97	38%	0.378	53%	0.528	S	S	.	.	H	α-helix	trans	-63.7	-37.4	173.8	73.8	0	0	0	0	111.5	I91 I92 C98 C99	I91-S95 WeakPolarHBondContact O-CB 3.49Å; I91-S95 PolarHBondContact O-N 3.46Å; I91-S95 PolarHBondContact O-OG 3.34Å; I92-S95 WeakPolarHBondContact CA-OG 3.11Å; I92-S95 PolarHBondContact O-N 2.93Å; I92-S95 VanDerWaalsContact O-N 3.14Å; I92-S95 PolarHBondContact O-OG 3.47Å; S95-C98 CarbonylContact O-C 3.43Å; S95-C98 PolarHBondContact O-N 3.32Å; S95-C99 PolarHBondContact O-N 3.25Å; S95-C99 PolarHBondContact O-SG 3.14Å
96	C	69.7	Low	72.4	Confident	75 Å²	75	98.4 Å²	98.4	51%	0.507	53%	0.527	S	S	.	.	H	α-helix	trans	-69.4	-35.7	174.7	-66.8	0	0	0	0	113.4	I92 A93 L94 C99	I92-C96 PolarHBondContact O-N 3.47Å; I92-C96 PolarHBondContact O-SG 2.8Å; A93-C96 WeakPolarHBondContact O-CB 3.37Å; A93-C96 PolarHBondContact O-N 2.84Å; L94-C96 VanDerWaalsContact C-N 3.3Å; L94-C96 PolarHBondContact O-N 2.92Å; C96-C99 VanDerWaalsContact CA-SG 3.56Å; C96-C99 WeakPolarHBondContact O-CB 3.19Å; C96-C99 PolarHBondContact O-N 2.76Å
97	W	67.9	Low	70.8	Confident	209 Å²	209	100.3 Å²	100.3	79%	0.792	53%	0.53	S	S	*	.	H	α-helix	trans	-75.6	-34.1	173.7	-71.3	-14	0	0	0	112.3	A93 L94 C99	A93-W97 PolarHBondContact O-N 2.78Å; L94-W97 HydrophobicContact CD2-CE3 4.24Å; L94-W97 PolarHBondContact O-N 2.9Å; W97-C99 PolarHBondContact O-N 2.78Å
98	C	63.5	Low	69.4	Low	75 Å²	75	99.2 Å²	99.2	51%	0.507	53%	0.53	S	S	.	.	G	3₁₀ helix	trans	-76.7	-1.6	169.5	-68.1	0	0	0	0	113	L94 S95 Y100 C101 C102	L94-C98 VanDerWaalsContact O-CB 3.22Å; L94-C98 WeakPolarHBondContact O-CB 3.41Å; L94-C98 PolarHBondContact O-N 3.49Å; L94-C98 PolarHBondContact O-SG 2.71Å; L94-C98 VanDerWaalsContact O-SG 3.33Å; S95-C98 CarbonylContact O-C 3.43Å; S95-C98 PolarHBondContact O-N 3.32Å; C98-Y100 PolarHBondContact O-N 3.12Å; C98-Y100 VanDerWaalsContact O-N 3.09Å; C98-C101 WeakPolarHBondContact O-CA 3.49Å; C98-C101 PolarHBondContact O-N 2.63Å; C98-C102 PolarHBondContact O-N 3.24Å
99	C	53.2	Low	67.9	Low	48 Å²	48	103.4 Å²	103.4	32%	0.324	54%	0.538	S	S	.	.	G	3₁₀ helix	trans	-60.3	-18.1	177.4	-82.8	0	0	0	0	113.6	S95 C96 W97 C101 C102	S95-C99 PolarHBondContact O-N 3.25Å; S95-C99 PolarHBondContact O-SG 3.14Å; C96-C99 VanDerWaalsContact CA-SG 3.56Å; C96-C99 WeakPolarHBondContact O-CB 3.19Å; C96-C99 PolarHBondContact O-N 2.76Å; W97-C99 PolarHBondContact O-N 2.78Å; C99-C101 PolarHBondContact O-N 3.05Å; C99-C102 PolarHBondContact O-N 2.92Å
100	Y	52.6	Low	66.1	Low	226 Å²	226	107.1 Å²	107.1	89%	0.886	55%	0.546	S	S	*	.	G	3₁₀ helix	trans	-62.6	-19.4	168.9	-151.3	-90.1	0	0	0	112.4	C98	C98-Y100 PolarHBondContact O-N 3.12Å; C98-Y100 VanDerWaalsContact O-N 3.09Å
101	C	52.6	Low	64.1	Low	113 Å²	113	114.8 Å²	114.8	76%	0.764	57%	0.569	S	S	*	*	G	3₁₀ helix	trans	-115.4	3	-179.6	-67.7	0	0	0	0	114.3	C98 C99	C98-C101 WeakPolarHBondContact O-CA 3.49Å; C98-C101 PolarHBondContact O-N 2.63Å; C99-C101 PolarHBondContact O-N 3.05Å
102	C	58.3	Low	62.9	Low	46 Å²	46	116.2 Å²	116.2	31%	0.311	58%	0.576	S	S	.	*			trans	-85.7	128.5	-176.4	-71.6	0	0	0	0	112.3	C98 C99 L104 Y105	C98-C102 PolarHBondContact O-N 3.24Å; C99-C102 PolarHBondContact O-N 2.92Å; C102-L104 PolarHBondContact O-N 3.27Å; C102-Y105 PolarHBondContact O-N 2.97Å
103	P	55.5	Low	61.7	Low	111 Å²	111	117.4 Å²	117.4	72%	0.721	58%	0.58	S	S	*	*	H	α-helix	trans	-62.7	-17	-179.8	25.5	-34.2	0	0	0	113.8	Q107	P103-Q107 PolarHBondContact O-N 2.83Å
104	L	55	Low	60.4	Low	122 Å²	122	121.7 Å²	121.7	64%	0.639	59%	0.594	S	S	*	*	H	α-helix	trans	-76.3	-33.7	177.9	-157.3	76.9	0	0	0	113.3	C102 Q107 L108	C102-L104 PolarHBondContact O-N 3.27Å; L104-Q107 PolarHBondContact O-N 3.44Å; L104-L108 HydrophobicContact CG-CD1 4.5Å; L104-L108 PolarHBondContact O-N 2.64Å
105	Y	56.3	Low	59.1	Low	127 Å²	127	123.6 Å²	123.6	50%	0.498	60%	0.602	S	S	.	*	H	α-helix	trans	-70.3	-38.6	175.6	-179	-95	0	0	0	111	C102 Q107 L108 Y109	C102-Y105 PolarHBondContact O-N 2.97Å; Y105-Q107 PolarHBondContact O-N 2.84Å; Y105-L108 PolarHBondContact O-N 3.41Å; Y105-Y109 AromaticContact CD2-CD2 3.96Å; Y105-Y109 HydrophobicContact CD2-CD2 3.96Å; Y105-Y109 HydrophobicContact CD2-CE2 4.36Å; Y105-Y109 AromaticContact CE2-CD2 3.47Å; Y105-Y109 HydrophobicContact CE2-CD2 3.47Å; Y105-Y109 VanDerWaalsContact CE2-CD2 3.47Å; Y105-Y109 AromaticContact CE2-CE2 3.7Å; Y105-Y109 HydrophobicContact CE2-CE2 3.7Å; Y105-Y109 HydrophobicContact CE2-CG 4.24Å; Y105-Y109 AromaticContact CZ-CD2 3.79Å; Y105-Y109 PolarHBondContact O-N 3.09Å
106	K	57.7	Low	58	Low	125 Å²	125	128 Å²	128	54%	0.543	62%	0.616	S	S	.	*	H	α-helix	trans	-61.9	-32.8	174.9	-138.3	-162.3	-168.3	-103.7	0	112.2	E110	K106-E110 WeakPolarHBondContact CE-OE2 3.28Å; K106-E110 VanDerWaalsContact NZ-CD 3.26Å; K106-E110 IonicContact NZ-OE1 3.05Å; K106-E110 PolarHBondContact NZ-OE1 3.22Å; K106-E110 IonicContact NZ-OE2 2.68Å; K106-E110 PolarHBondContact NZ-OE2 2.98Å; K106-E110 WeakPolarHBondContact O-CB 3.28Å; K106-E110 PolarHBondContact O-N 3.32Å
107	Q	60.8	Low	57.2	Low	123 Å²	123	131.5 Å²	131.5	58%	0.575	62%	0.624	S	S	*	*	H	α-helix	trans	-69.2	-54.7	171.4	-71.9	-153.9	-57.2	0	0	110.9	P103 L104 Y105 Y109 Y111	P103-Q107 PolarHBondContact O-N 2.83Å; L104-Q107 PolarHBondContact O-N 3.44Å; Y105-Q107 PolarHBondContact O-N 2.84Å; Q107-Y109 VanDerWaalsContact C-N 3.3Å; Q107-Y109 PolarHBondContact O-N 3.27Å; Q107-Y109 VanDerWaalsContact O-N 3.14Å; Q107-Y111 VanDerWaalsContact C-OH 3.26Å; Q107-Y111 VanDerWaalsContact O-CE1 3.25Å; Q107-Y111 WeakPolarHBondContact O-CE1 3.34Å; Q107-Y111 WeakPolarHBondContact O-CE2 2.91Å; Q107-Y111 PolarHBondContact O-OH 3.16Å
108	L	63	Low	56.5	Low	117 Å²	117	126 Å²	126	61%	0.613	61%	0.612	S	S	*	*	H	α-helix	trans	-64.8	-20.8	-173	-91.8	100.3	0	0	0	117	L104 Y105	L104-L108 HydrophobicContact CG-CD1 4.5Å; L104-L108 PolarHBondContact O-N 2.64Å; Y105-L108 PolarHBondContact O-N 3.41Å
109	Y	60.1	Low	55.9	Low	166 Å²	166	129.9 Å²	129.9	65%	0.651	62%	0.62	S	S	*	*	H	α-helix	trans	-119	-3.8	-172.4	-88.1	-85.8	0	0	0	116.1	Y105 Q107	Y105-Y109 AromaticContact CD2-CD2 3.96Å; Y105-Y109 HydrophobicContact CD2-CD2 3.96Å; Y105-Y109 HydrophobicContact CD2-CE2 4.36Å; Y105-Y109 AromaticContact CE2-CD2 3.47Å; Y105-Y109 HydrophobicContact CE2-CD2 3.47Å; Y105-Y109 VanDerWaalsContact CE2-CD2 3.47Å; Y105-Y109 AromaticContact CE2-CE2 3.7Å; Y105-Y109 HydrophobicContact CE2-CE2 3.7Å; Y105-Y109 HydrophobicContact CE2-CG 4.24Å; Y105-Y109 AromaticContact CZ-CD2 3.79Å; Y105-Y109 PolarHBondContact O-N 3.09Å; Q107-Y109 VanDerWaalsContact C-N 3.3Å; Q107-Y109 PolarHBondContact O-N 3.27Å; Q107-Y109 VanDerWaalsContact O-N 3.14Å
110	E	53.6	Low	56.1	Low	132 Å²	132	136.8 Å²	136.8	62%	0.617	64%	0.644	S	S	*	*			trans	-103.4	52.5	170.9	-76.9	-171.5	153.4	0	0	112.4	K106	K106-E110 WeakPolarHBondContact CE-OE2 3.28Å; K106-E110 VanDerWaalsContact NZ-CD 3.26Å; K106-E110 IonicContact NZ-OE1 3.05Å; K106-E110 PolarHBondContact NZ-OE1 3.22Å; K106-E110 IonicContact NZ-OE2 2.68Å; K106-E110 PolarHBondContact NZ-OE2 2.98Å; K106-E110 WeakPolarHBondContact O-CB 3.28Å; K106-E110 PolarHBondContact O-N 3.32Å
111	Y	48.2	Very low	56.5	Low	233 Å²	233	128.6 Å²	128.6	91%	0.914	62%	0.622	S	S	*	*			trans	-125.3	0	160.5	-26.3	-79.5	0	0	0	109.4	Q107	Q107-Y111 VanDerWaalsContact C-OH 3.26Å; Q107-Y111 VanDerWaalsContact O-CE1 3.25Å; Q107-Y111 WeakPolarHBondContact O-CE1 3.34Å; Q107-Y111 WeakPolarHBondContact O-CE2 2.91Å; Q107-Y111 PolarHBondContact O-OH 3.16Å

Retrieved 111 of 111 residues in 181 ms (Link to these results)

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