A0A077Z8J3_TRITR Loading...

DUF7107 domain-containing protein

AlphaFold DB , UniProt , Accession A0A077Z8J3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 101 aa.

						>A0A077Z8J3_TRITR|A0A077Z8J3
MTSIQRCRRHRDCPYASQSDVFGYMCVRRVCVVALRSNFACAERSRCGIGGRCMNGFCFGLWDGFTQPSTTTLSDFDHLPEYNGTDAFATSSEELLDDMEE
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38.9	Very low	73.3	Confident	244 Å²	244	137.2 Å²	137.2	100%	1.202	64%	0.635	S	S	*	*				0	103	0	-75.1	172.7	171.3	0	0	107.6	S3	M1-S3 PolarHBondContact O-N 3.15Å; M1-S3 VanDerWaalsContact O-N 3.15Å
2	T	56.3	Low	74.2	Confident	144 Å²	144	131 Å²	131	88%	0.883	61%	0.61	S	S	*	*			trans	-74.5	99.3	173.6	31.1	0	0	0	0	108	I4	T2-I4 PolarHBondContact O-N 3.03Å
3	S	64.9	Low	74.9	Confident	111 Å²	111	121.3 Å²	121.3	78%	0.776	57%	0.566	S	S	*	*			trans	-63.5	119.1	175	56.2	0	0	0	0	108.8	M1 Q5	M1-S3 PolarHBondContact O-N 3.15Å; M1-S3 VanDerWaalsContact O-N 3.15Å; S3-Q5 PolarHBondContact O-N 3.19Å
4	I	70.9	Confident	75.2	Confident	131 Å²	131	116.9 Å²	116.9	67%	0.672	55%	0.553	S	S	*	*			trans	-65.9	106.4	173.9	-61.9	176.9	0	0	0	107.8	T2 V30	T2-I4 PolarHBondContact O-N 3.03Å; I4-V30 HydrophobicContact CG2-CB 4.36Å; I4-V30 HydrophobicContact CG2-CG1 3.43Å; I4-V30 VanDerWaalsContact CG2-CG1 3.43Å; I4-V30 HydrophobicContact CG2-CG2 4.04Å
5	Q	81.6	Confident	75.1	Confident	90 Å²	90	118.6 Å²	118.6	42%	0.421	55%	0.554	S	S	.	*			trans	-76.2	125.9	177.5	-176.9	171.4	-11.1	0	0	109.7	S3 D12 C31	S3-Q5 PolarHBondContact O-N 3.19Å; Q5-D12 PolarHBondContact NE2-O 3.39Å; Q5-C31 HydrophobicContact CB-CB 4.17Å; Q5-C31 PolarHBondContact O-N 2.95Å
6	R	86.8	Confident	74.8	Confident	219 Å²	219	111.4 Å²	111.4	83%	0.826	52%	0.52	S	S	*	.	B	Isolated β-bridge	trans	-85.3	148.2	174.5	-66.9	-177.8	179.9	176.1	0.2	110.4	R29	R6-R29 CarbonylContact C-O 3.43Å; R6-R29 WeakPolarHBondContact CA-O 3.47Å
7	C	86.4	Confident	74.4	Confident	8 Å²	8	108.5 Å²	108.5	5%	0.054	52%	0.516	C	S	.	.			trans	-141.9	158.9	179.8	56.7	0	0	0	0	110.8	D12 C26 R29 V30	C7-D12 HydrophobicContact CB-CB 3.91Å; C7-C26 VanDerWaalsContact C-SG 3.54Å; C7-C26 HydrophobicContact CB-CB 3.77Å; C7-C26 WeakPolarHBondContact CB-SG 3.22Å; C7-C26 WeakPolarHBondContact SG-CA 3.31Å; C7-C26 WeakPolarHBondContact SG-CB 3.12Å; C7-C26 CovalentContact SG-SG 2.02Å; C7-C26 PolarHBondContact SG-SG 2.89Å; C7-R29 PolarHBondContact N-O 3.04Å; C7-R29 CarbonylContact O-C 3.58Å; C7-R29 WeakPolarHBondContact O-CA 3.38Å; C7-R29 VanDerWaalsContact O-CB 3.27Å; C7-R29 WeakPolarHBondContact O-CB 3.43Å; C7-V30 PolarHBondContact SG-N 2.74Å; C7-V30 VanDerWaalsContact SG-N 3.39Å
8	R	86.5	Confident	73.9	Confident	229 Å²	229	109.1 Å²	109.1	86%	0.864	52%	0.518	S	S	*	.	S	Bend	trans	-109.8	-30.1	165.1	-67.6	-176.4	177.9	-177.1	-0	111	D12	R8-D12 WeakPolarHBondContact CA-OD2 3.49Å; R8-D12 PolarHBondContact N-OD2 3.46Å
9	R	80.2	Confident	73.7	Confident	147 Å²	147	107.4 Å²	107.4	56%	0.555	52%	0.519	S	S	*	.	S	Bend	trans	-135.7	157.7	-179.5	-59.7	-178.6	-176.4	-175.8	0.7	108.8	R11 D12	R9-R11 HydrophobicContact CB-CG 4Å; R9-R11 VanDerWaalsContact NH1-NH2 3.16Å; R9-R11 PolarHBondContact O-N 2.04Å; R9-D12 PolarHBondContact N-OD2 2.95Å; R9-D12 VanDerWaalsContact O-CB 3.26Å; R9-D12 WeakPolarHBondContact O-CB 3.42Å; R9-D12 VanDerWaalsContact O-CG 3.31Å; R9-D12 PolarHBondContact O-N 2.92Å
10	H	75	Confident	73.7	Confident	36 Å²	36	105.7 Å²	105.7	17%	0.167	51%	0.513	C	S	.	.	G	3₁₀ helix	trans	-61.2	-31.3	-179.4	-60.7	-97.5	0	0	0	113.1	D12 C13 M25 C26 R52	H10-D12 PolarHBondContact O-N 2.87Å; H10-C13 WeakPolarHBondContact O-CB 3.46Å; H10-C13 PolarHBondContact O-N 2.99Å; H10-M25 WeakPolarHBondContact ND1-CB 3.01Å; H10-C26 HydrophobicContact CB-CB 4.48Å; H10-C26 PolarHBondContact CE1-O 3.31Å; H10-C26 PolarHBondContact ND1-N 2.86Å; H10-R52 PolarHBondContact CD2-NE 3.2Å; H10-R52 PolarHBondContact CD2-NH1 2.73Å; H10-R52 VanDerWaalsContact CD2-NH1 3.29Å; H10-R52 PolarHBondContact CD2-NH2 2.96Å; H10-R52 WeakPolarHBondContact CE1-CD 2.99Å; H10-R52 PolarHBondContact CE1-NE 3.03Å; H10-R52 VanDerWaalsContact ND1-CD 3.34Å; H10-R52 WeakPolarHBondContact ND1-CD 3.49Å; H10-R52 PolarHBondContact NE2-NE 3.23Å
11	R	79.1	Confident	73.9	Confident	150 Å²	150	103 Å²	103	57%	0.566	50%	0.502	S	S	*	.	G	3₁₀ helix	trans	-64.3	-14.5	173.9	70.6	-179	-175.1	-179.4	4.7	114.9	R9 C13 Y15	R9-R11 HydrophobicContact CB-CG 4Å; R9-R11 VanDerWaalsContact NH1-NH2 3.16Å; R9-R11 PolarHBondContact O-N 2.04Å; R11-C13 VanDerWaalsContact C-N 3.26Å; R11-Y15 WeakPolarHBondContact CA-OH 3.02Å; R11-Y15 HydrophobicContact CB-CE2 3.76Å; R11-Y15 WeakPolarHBondContact CB-OH 3.44Å
12	D	83.9	Confident	75.8	Confident	63 Å²	63	96.1 Å²	96.1	34%	0.337	47%	0.466	S	S	.	.	G	3₁₀ helix	trans	-83.6	-10.2	175.6	-47.6	-25.5	0	0	0	111.1	Q5 C7 R8 R9 H10	Q5-D12 PolarHBondContact NE2-O 3.39Å; C7-D12 HydrophobicContact CB-CB 3.91Å; R8-D12 WeakPolarHBondContact CA-OD2 3.49Å; R8-D12 PolarHBondContact N-OD2 3.46Å; R9-D12 PolarHBondContact N-OD2 2.95Å; R9-D12 VanDerWaalsContact O-CB 3.26Å; R9-D12 WeakPolarHBondContact O-CB 3.42Å; R9-D12 VanDerWaalsContact O-CG 3.31Å; R9-D12 PolarHBondContact O-N 2.92Å; H10-D12 PolarHBondContact O-N 2.87Å
13	C	83.1	Confident	77	Confident	5 Å²	5	89.3 Å²	89.3	3%	0.034	42%	0.424	C	S	.	.	S	Bend	trans	-94.7	156.6	173.3	-58.8	0	0	0	0	110.4	H10 R11 Y15 C31	H10-C13 WeakPolarHBondContact O-CB 3.46Å; H10-C13 PolarHBondContact O-N 2.99Å; R11-C13 VanDerWaalsContact C-N 3.26Å; C13-Y15 PolarHBondContact O-N 3.17Å; C13-Y15 VanDerWaalsContact O-N 3.13Å; C13-C31 WeakPolarHBondContact CA-SG 3.47Å; C13-C31 HydrophobicContact CB-CB 3.78Å; C13-C31 WeakPolarHBondContact CB-SG 3.47Å; C13-C31 WeakPolarHBondContact SG-CA 3.38Å; C13-C31 WeakPolarHBondContact SG-CB 3.31Å; C13-C31 CovalentContact SG-SG 2.04Å; C13-C31 PolarHBondContact SG-SG 3.49Å
14	P	79.9	Confident	77.9	Confident	60 Å²	60	88.9 Å²	88.9	39%	0.39	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-55.1	121.8	174.3	-21.3	31.4	0	0	0	110.3	Y24	P14-Y24 HydrophobicContact CB-CD2 3.82Å; P14-Y24 HydrophobicContact CB-CE2 4.36Å; P14-Y24 HydrophobicContact CB-CG 4.46Å; P14-Y24 HydrophobicContact CG-CD2 4.07Å; P14-Y24 HydrophobicContact CG-CG 4.36Å
15	Y	72.7	Confident	78.4	Confident	142 Å²	142	83.2 Å²	83.2	56%	0.557	38%	0.377	S	S	*	.	P	Polyproline II helix	trans	-68.4	137.8	177.8	-84.8	-88.5	0	0	0	110.4	R11 C13	R11-Y15 WeakPolarHBondContact CA-OH 3.02Å; R11-Y15 HydrophobicContact CB-CE2 3.76Å; R11-Y15 WeakPolarHBondContact CB-OH 3.44Å; C13-Y15 PolarHBondContact O-N 3.17Å; C13-Y15 VanDerWaalsContact O-N 3.13Å
16	A	70.2	Confident	78.4	Confident	3 Å²	3	79.6 Å²	79.6	3%	0.025	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-75	125.4	166.7	0	0	0	0	0	108.8	D20 G23 N55 F59	A16-D20 HydrophobicContact CB-CB 4.33Å; A16-G23 VanDerWaalsContact CB-CA 3.49Å; A16-N55 PolarHBondContact O-ND2 3.13Å; A16-F59 HydrophobicContact CB-CE1 3.76Å; A16-F59 HydrophobicContact CB-CE2 4.37Å; A16-F59 HydrophobicContact CB-CZ 3.59Å
17	S	68.3	Low	78.1	Confident	63 Å²	63	71.2 Å²	71.2	44%	0.441	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-65.3	161	166.3	-169.7	0	0	0	0	110.4	S19 D20	S17-S19 PolarHBondContact O-N 3.24Å; S17-S19 VanDerWaalsContact O-N 3.14Å; S17-D20 WeakPolarHBondContact CA-OD2 3.02Å; S17-D20 WeakPolarHBondContact CB-OD2 3.27Å; S17-D20 PolarHBondContact N-OD2 2.8Å; S17-D20 WeakPolarHBondContact O-CB 3.26Å; S17-D20 PolarHBondContact O-N 2.96Å
18	Q	66.2	Low	78	Confident	119 Å²	119	82.5 Å²	82.5	56%	0.556	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-27.2	176.5	-68.1	179.9	0.1	0	0	112.5	R36 N55 F57	Q18-R36 PolarHBondContact O-NH1 3.42Å; Q18-N55 HydrophobicContact CG-CB 4.1Å; Q18-F57 HydrophobicContact CB-CE2 4.07Å; Q18-F57 HydrophobicContact CG-CE2 4.01Å
19	S	69	Low	77.9	Confident	76 Å²	76	80.6 Å²	80.6	53%	0.531	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-10.1	178.3	-47.8	0	0	0	0	113.5	S17	S17-S19 PolarHBondContact O-N 3.24Å; S17-S19 VanDerWaalsContact O-N 3.14Å
20	D	74.2	Confident	78.1	Confident	74 Å²	74	75.9 Å²	75.9	40%	0.396	36%	0.356	S	S	.	.			trans	-83.2	131	-174.8	-64.9	-35.2	0	0	0	111.3	A16 S17 F22 R36	A16-D20 HydrophobicContact CB-CB 4.33Å; S17-D20 WeakPolarHBondContact CA-OD2 3.02Å; S17-D20 WeakPolarHBondContact CB-OD2 3.27Å; S17-D20 PolarHBondContact N-OD2 2.8Å; S17-D20 WeakPolarHBondContact O-CB 3.26Å; S17-D20 PolarHBondContact O-N 2.96Å; D20-F22 VanDerWaalsContact C-N 3.26Å; D20-F22 WeakPolarHBondContact CB-O 3.36Å; D20-R36 PolarHBondContact O-NH1 2.79Å
21	V	77.3	Confident	78.6	Confident	48 Å²	48	75 Å²	75	29%	0.291	35%	0.354	S	S	.	.	S	Bend	trans	-73.8	-25.7	173.5	-177.2	0	0	0	0	111	L35 R36 P68	V21-L35 HydrophobicContact CG1-CD2 4.4Å; V21-R36 PolarHBondContact O-N 3.13Å; V21-P68 HydrophobicContact CG1-CB 4.37Å
22	F	80.4	Confident	78.7	Confident	101 Å²	101	70 Å²	70	44%	0.443	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	144	-177.1	-55.4	-89.6	0	0	0	110.3	D20 V33 A34 L35 W62	D20-F22 VanDerWaalsContact C-N 3.26Å; D20-F22 WeakPolarHBondContact CB-O 3.36Å; F22-V33 HydrophobicContact CD1-CG1 4.14Å; F22-A34 CarbonylContact C-O 3.39Å; F22-A34 WeakPolarHBondContact CA-O 3.14Å; F22-L35 HydrophobicContact CD1-CD2 3.51Å; F22-L35 HydrophobicContact CD1-CG 4.4Å; F22-L35 HydrophobicContact CE1-CD2 3.38Å; F22-L35 HydrophobicContact CE1-CG 4.4Å; F22-L35 HydrophobicContact CG-CD2 4.43Å; F22-L35 HydrophobicContact CZ-CD2 4.19Å; F22-W62 HydrophobicContact CD1-CE3 4.27Å; F22-W62 AromaticContact CE1-CE3 3.67Å; F22-W62 HydrophobicContact CE1-CE3 3.67Å; F22-W62 AromaticContact CE1-CZ3 3.59Å; F22-W62 HydrophobicContact CE1-CZ3 3.59Å; F22-W62 HydrophobicContact CZ-CZ3 4.29Å
23	G	80.8	Confident	78.7	Confident	1 Å²	1	69.9 Å²	69.9	1%	0.01	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	-178.7	173.3	0	0	0	0	0	112	A16 V33 A34	A16-G23 VanDerWaalsContact CB-CA 3.49Å; G23-V33 WeakPolarHBondContact O-CA 3.17Å; G23-A34 PolarHBondContact N-O 3.01Å; G23-A34 PolarHBondContact O-N 2.02Å
24	Y	83.4	Confident	78.6	Confident	101 Å²	101	69.6 Å²	69.6	40%	0.396	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	133.9	169.3	-62.5	-93.8	0	0	0	110.2	P14 V32 V33	P14-Y24 HydrophobicContact CB-CD2 3.82Å; P14-Y24 HydrophobicContact CB-CE2 4.36Å; P14-Y24 HydrophobicContact CB-CG 4.46Å; P14-Y24 HydrophobicContact CG-CD2 4.07Å; P14-Y24 HydrophobicContact CG-CG 4.36Å; Y24-V32 VanDerWaalsContact CA-O 3.31Å; Y24-V32 WeakPolarHBondContact CA-O 2.92Å; Y24-V33 HydrophobicContact CD1-CG2 4.23Å; Y24-V33 HydrophobicContact CE1-CG2 3.67Å
25	M	81.5	Confident	78.8	Confident	12 Å²	12	67 Å²	67	6%	0.059	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	147.1	176.8	68.9	-178	-98.8	0	0	110.4	H10 V27 C31 V32 A34 L61	H10-M25 WeakPolarHBondContact ND1-CB 3.01Å; M25-V27 HydrophobicContact CE-CG2 3.42Å; M25-V27 VanDerWaalsContact CE-CG2 3.42Å; M25-V27 HydrophobicContact CG-CG2 4.07Å; M25-V27 PolarHBondContact O-N 3.06Å; M25-V27 HydrophobicContact SD-CG2 4.47Å; M25-C31 WeakPolarHBondContact O-CA 3.33Å; M25-V32 HydrophobicContact CG-CG2 3.95Å; M25-V32 PolarHBondContact N-O 3.45Å; M25-V32 WeakPolarHBondContact O-CG2 3.39Å; M25-V32 PolarHBondContact O-N 2.97Å; M25-A34 HydrophobicContact CB-CB 4.29Å; M25-A34 HydrophobicContact CG-CB 3.88Å; M25-A34 HydrophobicContact SD-CB 3.83Å; M25-L61 HydrophobicContact CE-CD1 4.17Å; M25-L61 HydrophobicContact CE-CD2 3.69Å; M25-L61 HydrophobicContact CE-CG 3.63Å; M25-L61 HydrophobicContact CG-CD2 3.87Å; M25-L61 HydrophobicContact SD-CD2 3.56Å; M25-L61 VanDerWaalsContact SD-CD2 3.56Å; M25-L61 HydrophobicContact SD-CG 3.8Å
26	C	81.7	Confident	79.2	Confident	14 Å²	14	60.5 Å²	60.5	10%	0.095	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	111.3	177.2	-169.5	0	0	0	0	110.5	C7 H10	C7-C26 VanDerWaalsContact C-SG 3.54Å; C7-C26 HydrophobicContact CB-CB 3.77Å; C7-C26 WeakPolarHBondContact CB-SG 3.22Å; C7-C26 WeakPolarHBondContact SG-CA 3.31Å; C7-C26 WeakPolarHBondContact SG-CB 3.12Å; C7-C26 CovalentContact SG-SG 2.02Å; C7-C26 PolarHBondContact SG-SG 2.89Å; H10-C26 HydrophobicContact CB-CB 4.48Å; H10-C26 PolarHBondContact CE1-O 3.31Å; H10-C26 PolarHBondContact ND1-N 2.86Å
27	V	80.1	Confident	79.5	Confident	44 Å²	44	62.2 Å²	62.2	27%	0.267	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	127.9	172.7	176.9	0	0	0	0	109.2	M25 R29 V30 V32 L61	M25-V27 HydrophobicContact CE-CG2 3.42Å; M25-V27 VanDerWaalsContact CE-CG2 3.42Å; M25-V27 HydrophobicContact CG-CG2 4.07Å; M25-V27 PolarHBondContact O-N 3.06Å; M25-V27 HydrophobicContact SD-CG2 4.47Å; V27-R29 PolarHBondContact O-N 3.37Å; V27-V30 PolarHBondContact N-O 2.81Å; V27-V30 PolarHBondContact O-N 3.14Å; V27-V30 VanDerWaalsContact O-O 3.08Å; V27-V32 HydrophobicContact CB-CG2 3.85Å; V27-V32 HydrophobicContact CG2-CG2 3.73Å; V27-L61 HydrophobicContact CG2-CD1 4.25Å; V27-L61 HydrophobicContact CG2-CD2 3.83Å; V27-L61 HydrophobicContact CG2-CG 4.47Å
28	R	83.6	Confident	80	Confident	244 Å²	244	62.3 Å²	62.3	92%	0.921	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.2	41.1	179.7	-64.1	-175.4	174.8	-177.8	-0.9	113	V30	R28-V30 VanDerWaalsContact C-N 3.31Å; R28-V30 PolarHBondContact O-N 2.98Å
29	R	85.6	Confident	80.7	Confident	190 Å²	190	60.7 Å²	60.7	72%	0.717	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.7	19.8	-178.3	-52.9	178.5	178.9	178.7	0.1	116	R6 C7 V27	R6-R29 CarbonylContact C-O 3.43Å; R6-R29 WeakPolarHBondContact CA-O 3.47Å; C7-R29 PolarHBondContact N-O 3.04Å; C7-R29 CarbonylContact O-C 3.58Å; C7-R29 WeakPolarHBondContact O-CA 3.38Å; C7-R29 VanDerWaalsContact O-CB 3.27Å; C7-R29 WeakPolarHBondContact O-CB 3.43Å; V27-R29 PolarHBondContact O-N 3.37Å
30	V	84.9	Confident	81.4	Confident	47 Å²	47	57.6 Å²	57.6	29%	0.285	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	135.4	176.1	177.1	0	0	0	0	109.7	I4 C7 V27 R28 V32	I4-V30 HydrophobicContact CG2-CB 4.36Å; I4-V30 HydrophobicContact CG2-CG1 3.43Å; I4-V30 VanDerWaalsContact CG2-CG1 3.43Å; I4-V30 HydrophobicContact CG2-CG2 4.04Å; C7-V30 PolarHBondContact SG-N 2.74Å; C7-V30 VanDerWaalsContact SG-N 3.39Å; V27-V30 PolarHBondContact N-O 2.81Å; V27-V30 PolarHBondContact O-N 3.14Å; V27-V30 VanDerWaalsContact O-O 3.08Å; R28-V30 VanDerWaalsContact C-N 3.31Å; R28-V30 PolarHBondContact O-N 2.98Å; V30-V32 HydrophobicContact CG1-CG1 4.07Å; V30-V32 PolarHBondContact O-N 2.82Å
31	C	83.9	Confident	81.8	Confident	17 Å²	17	54.1 Å²	54.1	12%	0.115	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	113.4	170.1	-63	0	0	0	0	109	Q5 C13 M25	Q5-C31 HydrophobicContact CB-CB 4.17Å; Q5-C31 PolarHBondContact O-N 2.95Å; C13-C31 WeakPolarHBondContact CA-SG 3.47Å; C13-C31 HydrophobicContact CB-CB 3.78Å; C13-C31 WeakPolarHBondContact CB-SG 3.47Å; C13-C31 WeakPolarHBondContact SG-CA 3.38Å; C13-C31 WeakPolarHBondContact SG-CB 3.31Å; C13-C31 CovalentContact SG-SG 2.04Å; C13-C31 PolarHBondContact SG-SG 3.49Å; M25-C31 WeakPolarHBondContact O-CA 3.33Å
32	V	82.8	Confident	82	Confident	46 Å²	46	55.3 Å²	55.3	28%	0.279	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	151.9	177.9	-62.6	0	0	0	0	109.8	Y24 M25 V27 V30 A34 L61	Y24-V32 VanDerWaalsContact CA-O 3.31Å; Y24-V32 WeakPolarHBondContact CA-O 2.92Å; M25-V32 HydrophobicContact CG-CG2 3.95Å; M25-V32 PolarHBondContact N-O 3.45Å; M25-V32 WeakPolarHBondContact O-CG2 3.39Å; M25-V32 PolarHBondContact O-N 2.97Å; V27-V32 HydrophobicContact CB-CG2 3.85Å; V27-V32 HydrophobicContact CG2-CG2 3.73Å; V30-V32 HydrophobicContact CG1-CG1 4.07Å; V30-V32 PolarHBondContact O-N 2.82Å; V32-A34 PolarHBondContact O-N 2.77Å; V32-L61 HydrophobicContact CB-CD2 4.5Å; V32-L61 HydrophobicContact CG2-CD2 3.35Å
33	V	83.4	Confident	82	Confident	60 Å²	60	58.5 Å²	58.5	36%	0.364	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	132.9	178.3	-179.2	0	0	0	0	109.3	F22 G23 Y24 W62	F22-V33 HydrophobicContact CD1-CG1 4.14Å; G23-V33 WeakPolarHBondContact O-CA 3.17Å; Y24-V33 HydrophobicContact CD1-CG2 4.23Å; Y24-V33 HydrophobicContact CE1-CG2 3.67Å; V33-W62 PolarHBondContact O-N 2.83Å
34	A	81.6	Confident	81.8	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	148.9	174.3	0	0	0	0	0	109.6	F22 G23 M25 V32 F59 G60	F22-A34 CarbonylContact C-O 3.39Å; F22-A34 WeakPolarHBondContact CA-O 3.14Å; G23-A34 PolarHBondContact N-O 3.01Å; G23-A34 PolarHBondContact O-N 2.02Å; M25-A34 HydrophobicContact CB-CB 4.29Å; M25-A34 HydrophobicContact CG-CB 3.88Å; M25-A34 HydrophobicContact SD-CB 3.83Å; V32-A34 PolarHBondContact O-N 2.77Å; A34-F59 HydrophobicContact CB-CB 4.13Å; A34-G60 CarbonylContact C-O 3.58Å; A34-G60 WeakPolarHBondContact CA-O 3.37Å; A34-G60 WeakPolarHBondContact CB-O 2.91Å
35	L	83.5	Confident	81.6	Confident	6 Å²	6	63.6 Å²	63.6	3%	0.031	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	136.8	176.5	-89.1	174.7	0	0	0	111.7	V21 F22 S37 F59 G60 W62 T66 P68	V21-L35 HydrophobicContact CG1-CD2 4.4Å; F22-L35 HydrophobicContact CD1-CD2 3.51Å; F22-L35 HydrophobicContact CD1-CG 4.4Å; F22-L35 HydrophobicContact CE1-CD2 3.38Å; F22-L35 HydrophobicContact CE1-CG 4.4Å; F22-L35 HydrophobicContact CG-CD2 4.43Å; F22-L35 HydrophobicContact CZ-CD2 4.19Å; L35-S37 PolarHBondContact O-N 2.98Å; L35-F59 CarbonylContact O-C 3.55Å; L35-F59 WeakPolarHBondContact O-CA 3.1Å; L35-G60 PolarHBondContact N-O 3.42Å; L35-G60 PolarHBondContact O-N 3.45Å; L35-W62 HydrophobicContact CD1-CB 4.35Å; L35-W62 HydrophobicContact CD1-CD2 3.65Å; L35-W62 HydrophobicContact CD1-CE3 3.02Å; L35-W62 HydrophobicContact CD1-CG 4.29Å; L35-W62 HydrophobicContact CD1-CH2 4.2Å; L35-W62 HydrophobicContact CD1-CZ3 3.32Å; L35-W62 HydrophobicContact CD2-CE3 3.46Å; L35-W62 VanDerWaalsContact CD2-CE3 3.46Å; L35-W62 HydrophobicContact CD2-CZ3 3.59Å; L35-W62 HydrophobicContact CG-CB 4.28Å; L35-W62 HydrophobicContact CG-CD2 4.01Å; L35-W62 HydrophobicContact CG-CE3 3.15Å; L35-W62 HydrophobicContact CG-CZ3 3.7Å; L35-T66 WeakPolarHBondContact CD1-O 3.29Å; L35-P68 HydrophobicContact CD2-CB 4.28Å
36	R	81.1	Confident	81.5	Confident	5 Å²	5	68.6 Å²	68.6	2%	0.019	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	133.9	169.1	-167.4	173.2	54.1	-154.2	-22	110.3	Q18 D20 V21 F57 C58 F59 S69 F76	Q18-R36 PolarHBondContact O-NH1 3.42Å; D20-R36 PolarHBondContact O-NH1 2.79Å; V21-R36 PolarHBondContact O-N 3.13Å; R36-F57 HydrophobicContact CG-CB 4.24Å; R36-C58 CarbonylContact C-O 3.6Å; R36-C58 WeakPolarHBondContact CA-O 3.34Å; R36-F59 HydrophobicContact CB-CD1 3.94Å; R36-F59 HydrophobicContact CB-CE1 3.6Å; R36-F59 HydrophobicContact CB-CZ 3.94Å; R36-F59 HydrophobicContact CG-CE1 4.21Å; R36-F59 HydrophobicContact CG-CE2 4.29Å; R36-F59 HydrophobicContact CG-CZ 4.03Å; R36-F59 VanDerWaalsContact N-CD1 3.34Å; R36-S69 PolarHBondContact O-OG 3.14Å; R36-F76 VanDerWaalsContact CZ-CE1 3.45Å
37	S	76.3	Confident	81.5	Confident	39 Å²	39	68.2 Å²	68.2	27%	0.273	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	171.9	173	-55.2	0	0	0	0	110.9	L35 F39 C58	L35-S37 PolarHBondContact O-N 2.98Å; S37-F39 PolarHBondContact O-N 2.6Å; S37-F39 VanDerWaalsContact O-N 3.13Å; S37-C58 PolarHBondContact N-O 2.79Å
38	N	78.6	Confident	81.1	Confident	64 Å²	64	67 Å²	67	34%	0.342	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	27	175.7	-68	-25.7	0	0	0	113.7	S69 T71 L79	N38-S69 WeakPolarHBondContact OD1-CB 3.36Å; N38-T71 VanDerWaalsContact CG-OG1 3.28Å; N38-T71 PolarHBondContact OD1-OG1 2.78Å; N38-L79 HydrophobicContact CB-CD2 4.46Å
39	F	80.7	Confident	80.5	Confident	85 Å²	85	62.6 Å²	62.6	37%	0.373	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	136.1	-176.4	-63.7	-75.5	0	0	0	110.4	S37 C58 P80 Y82	S37-F39 PolarHBondContact O-N 2.6Å; S37-F39 VanDerWaalsContact O-N 3.13Å; F39-C58 HydrophobicContact CB-CB 4.31Å; F39-C58 WeakPolarHBondContact O-CB 3.25Å; F39-C58 PolarHBondContact O-N 3.41Å; F39-P80 WeakPolarHBondContact CA-O 3.46Å; F39-P80 HydrophobicContact CD1-CG 4.02Å; F39-P80 HydrophobicContact CE1-CG 4.13Å; F39-Y82 HydrophobicContact CB-CD2 4.37Å; F39-Y82 HydrophobicContact CD1-CD2 4.45Å; F39-Y82 HydrophobicContact CD2-CD2 4.21Å; F39-Y82 HydrophobicContact CG-CD2 4.09Å
40	A	83.7	Confident	79.7	Confident	12 Å²	12	55.3 Å²	55.3	10%	0.099	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	159.2	164.2	0	0	0	0	0	109.7	G56 L79 P80 E81 Y82	A40-G56 CarbonylContact C-O 3.58Å; A40-G56 WeakPolarHBondContact CA-O 3.31Å; A40-L79 HydrophobicContact CB-CB 4.07Å; A40-P80 PolarHBondContact N-O 2.99Å; A40-E81 WeakPolarHBondContact O-CA 3.31Å; A40-Y82 PolarHBondContact O-N 3.32Å
41	C	83.9	Confident	79.4	Confident	1 Å²	1	54 Å²	54	1%	0.007	31%	0.305	C	S	.	.			trans	-139.8	28.5	173.9	56.9	0	0	0	0	109.8	S45 R46 C53 G56 F57	C41-S45 WeakPolarHBondContact O-CA 3.1Å; C41-S45 PolarHBondContact O-N 3.34Å; C41-R46 WeakPolarHBondContact CB-O 3.46Å; C41-C53 HydrophobicContact CB-CB 3.7Å; C41-C53 WeakPolarHBondContact CB-SG 3.3Å; C41-C53 PolarHBondContact O-SG 2.75Å; C41-C53 WeakPolarHBondContact SG-CA 3.49Å; C41-C53 WeakPolarHBondContact SG-CB 3.24Å; C41-C53 CovalentContact SG-SG 2.01Å; C41-C53 PolarHBondContact SG-SG 3.44Å; C41-G56 PolarHBondContact N-O 2.65Å; C41-F57 PolarHBondContact SG-N 3.33Å; C41-F57 VanDerWaalsContact SG-N 3.36Å; C41-F57 PolarHBondContact SG-O 2.83Å; C41-F57 VanDerWaalsContact SG-O 3.33Å
42	A	81.4	Confident	79.1	Confident	73 Å²	73	58.1 Å²	58.1	60%	0.603	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-39.2	-173.3	0	0	0	0	0	112.2	G56 E81	A42-G56 PolarHBondContact N-O 3.48Å; A42-E81 PolarHBondContact N-OE2 3.02Å
43	E	80	Confident	79.1	Confident	168 Å²	168	57.5 Å²	57.5	79%	0.785	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-48.5	-179.8	-38.1	175.1	140.1	0	0	111.2	E81	E43-E81 WeakPolarHBondContact CA-OE2 3.13Å; E43-E81 VanDerWaalsContact CB-OE1 3.23Å; E43-E81 WeakPolarHBondContact CB-OE1 3.16Å; E43-E81 VanDerWaalsContact CB-OE2 3.31Å; E43-E81 WeakPolarHBondContact CB-OE2 3.44Å; E43-E81 VanDerWaalsContact CG-OE2 3.28Å; E43-E81 WeakPolarHBondContact CG-OE2 2.82Å; E43-E81 PolarHBondContact N-OE2 2.93Å
44	R	77.2	Confident	79	Confident	122 Å²	122	55.2 Å²	55.2	46%	0.46	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-21.4	-176	-76.5	163.5	-169.8	-137.6	8.6	115.3	R46 E81 N83	R44-R46 HydrophobicContact CB-CB 4.12Å; R44-R46 HydrophobicContact CB-CG 4.08Å; R44-R46 WeakPolarHBondContact O-CG 3.04Å; R44-R46 PolarHBondContact O-N 3.11Å; R44-E81 WeakPolarHBondContact CB-OE1 3.48Å; R44-E81 WeakPolarHBondContact CD-OE1 3.44Å; R44-E81 WeakPolarHBondContact CG-OE1 3.46Å; R44-E81 PolarHBondContact N-OE1 3.06Å; R44-E81 IonicContact NE-OE1 3.65Å; R44-N83 PolarHBondContact NH1-OD1 3.32Å
45	S	78.9	Confident	78.9	Confident	87 Å²	87	59 Å²	59	61%	0.608	32%	0.32	S	S	*	.			trans	56.9	25.3	-170.4	-61.2	0	0	0	0	114.4	C41	C41-S45 WeakPolarHBondContact O-CA 3.1Å; C41-S45 PolarHBondContact O-N 3.34Å
46	R	79.3	Confident	78.9	Confident	116 Å²	116	59.6 Å²	59.6	44%	0.438	33%	0.328	S	S	.	.			trans	-112.4	147.6	-175.4	-67.9	179.2	-176.7	-150.5	0.6	111.7	C41 R44 C58 Y82 D86	C41-R46 WeakPolarHBondContact CB-O 3.46Å; R44-R46 HydrophobicContact CB-CB 4.12Å; R44-R46 HydrophobicContact CB-CG 4.08Å; R44-R46 WeakPolarHBondContact O-CG 3.04Å; R44-R46 PolarHBondContact O-N 3.11Å; R46-C58 PolarHBondContact O-SG 2.01Å; R46-Y82 HydrophobicContact CB-CD1 4.16Å; R46-Y82 WeakPolarHBondContact O-CB 2.95Å; R46-D86 WeakPolarHBondContact CB-OD1 3.34Å; R46-D86 WeakPolarHBondContact CD-OD2 3.44Å; R46-D86 WeakPolarHBondContact CG-OD1 2.92Å; R46-D86 VanDerWaalsContact CG-OD2 3.24Å; R46-D86 WeakPolarHBondContact CG-OD2 3.3Å; R46-D86 IonicContact CZ-OD2 3.19Å; R46-D86 IonicContact NE-OD2 3.04Å; R46-D86 PolarHBondContact NE-OD2 2.99Å; R46-D86 IonicContact NH1-OD2 3.18Å; R46-D86 PolarHBondContact NH1-OD2 3.04Å
47	C	80.8	Confident	79.1	Confident	7 Å²	7	60.5 Å²	60.5	5%	0.047	33%	0.332	C	S	.	.			trans	-147.2	161.7	177.4	-63.6	0	0	0	0	110	R52 C53 C58 Y82	C47-R52 VanDerWaalsContact SG-C 3.51Å; C47-C53 PolarHBondContact SG-N 2.8Å; C47-C53 VanDerWaalsContact SG-N 3.37Å; C47-C58 WeakPolarHBondContact CA-SG 3.39Å; C47-C58 HydrophobicContact CB-CB 3.82Å; C47-C58 WeakPolarHBondContact CB-SG 3.24Å; C47-C58 WeakPolarHBondContact SG-CA 3.17Å; C47-C58 WeakPolarHBondContact SG-CB 3.21Å; C47-C58 CovalentContact SG-SG 2.04Å; C47-C58 PolarHBondContact SG-SG 3.29Å; C47-Y82 VanDerWaalsContact CA-CD1 3.45Å
48	G	72.6	Confident	79.4	Confident	17 Å²	17	58.8 Å²	58.8	18%	0.175	32%	0.32	C	S	.	.	S	Bend	trans	-66.7	-177.4	179.8	0	0	0	0	0	114.9	G50 G51 Y82	G48-G50 PolarHBondContact O-N 2.71Å; G48-G51 VanDerWaalsContact O-CA 3.31Å; G48-G51 WeakPolarHBondContact O-CA 3.03Å; G48-G51 PolarHBondContact O-N 3.29Å; G48-Y82 WeakPolarHBondContact CA-OH 3.48Å
49	I	70.3	Confident	79.7	Confident	152 Å²	152	55.9 Å²	55.9	78%	0.779	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	123.5	-174.7	-60.3	175.5	0	0	0	111.7	G51 A87	I49-G51 PolarHBondContact O-N 3.08Å; I49-G51 VanDerWaalsContact O-N 3.14Å; I49-A87 HydrophobicContact CB-CB 4.34Å; I49-A87 HydrophobicContact CG1-CB 4.19Å
50	G	70	Confident	79.7	Confident	38 Å²	38	52.5 Å²	52.5	39%	0.392	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.8	-3.4	-176.9	0	0	0	0	0	114.7	G48	G48-G50 PolarHBondContact O-N 2.71Å
51	G	77	Confident	79.2	Confident	20 Å²	20	55.2 Å²	55.2	21%	0.206	31%	0.307	C	S	.	.			trans	-81.4	154.6	175.6	0	0	0	0	0	112.4	G48 I49 F59	G48-G51 VanDerWaalsContact O-CA 3.31Å; G48-G51 WeakPolarHBondContact O-CA 3.03Å; G48-G51 PolarHBondContact O-N 3.29Å; I49-G51 PolarHBondContact O-N 3.08Å; I49-G51 VanDerWaalsContact O-N 3.14Å; G51-F59 CarbonylContact C-O 3.43Å; G51-F59 VanDerWaalsContact CA-O 3.24Å; G51-F59 WeakPolarHBondContact CA-O 3.12Å
52	R	79	Confident	78.4	Confident	103 Å²	103	60.3 Å²	60.3	39%	0.389	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	136.4	179.5	-162.2	165.4	-157.6	-93.4	-0.4	111.8	H10 C47 M54 F59	H10-R52 PolarHBondContact CD2-NE 3.2Å; H10-R52 PolarHBondContact CD2-NH1 2.73Å; H10-R52 VanDerWaalsContact CD2-NH1 3.29Å; H10-R52 PolarHBondContact CD2-NH2 2.96Å; H10-R52 WeakPolarHBondContact CE1-CD 2.99Å; H10-R52 PolarHBondContact CE1-NE 3.03Å; H10-R52 VanDerWaalsContact ND1-CD 3.34Å; H10-R52 WeakPolarHBondContact ND1-CD 3.49Å; H10-R52 PolarHBondContact NE2-NE 3.23Å; C47-R52 VanDerWaalsContact SG-C 3.51Å; R52-M54 PolarHBondContact O-N 2.9Å; R52-F59 PolarHBondContact N-O 3.42Å; R52-F59 PolarHBondContact O-N 3.12Å
53	C	81.8	Confident	77.6	Confident	32 Å²	32	61.5 Å²	61.5	22%	0.216	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	122	174.1	-170.3	0	0	0	0	110.7	C41 C47 F57	C41-C53 HydrophobicContact CB-CB 3.7Å; C41-C53 WeakPolarHBondContact CB-SG 3.3Å; C41-C53 PolarHBondContact O-SG 2.75Å; C41-C53 WeakPolarHBondContact SG-CA 3.49Å; C41-C53 WeakPolarHBondContact SG-CB 3.24Å; C41-C53 CovalentContact SG-SG 2.01Å; C41-C53 PolarHBondContact SG-SG 3.44Å; C47-C53 PolarHBondContact SG-N 2.8Å; C47-C53 VanDerWaalsContact SG-N 3.37Å; C53-F57 WeakPolarHBondContact CA-O 3.12Å
54	M	81.2	Confident	76.4	Confident	13 Å²	13	55.9 Å²	55.9	6%	0.064	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	123.4	175.3	-62.5	-169.8	-74.2	0	0	108.9	R52 G56 F57 F59	R52-M54 PolarHBondContact O-N 2.9Å; M54-G56 PolarHBondContact O-N 2.88Å; M54-F57 PolarHBondContact N-O 3.36Å; M54-F57 PolarHBondContact O-N 2.64Å; M54-F57 VanDerWaalsContact O-O 3.12Å; M54-F59 HydrophobicContact CB-CD2 3.86Å; M54-F59 HydrophobicContact CB-CE2 4.06Å; M54-F59 HydrophobicContact CE-CB 3.37Å; M54-F59 HydrophobicContact CE-CD1 4.03Å; M54-F59 HydrophobicContact CE-CD2 3.69Å; M54-F59 HydrophobicContact CE-CE2 4.46Å; M54-F59 HydrophobicContact CE-CG 3.44Å; M54-F59 VanDerWaalsContact CE-CG 3.44Å; M54-F59 HydrophobicContact CG-CD2 4.49Å
55	N	80	Confident	75	Confident	78 Å²	78	58.8 Å²	58.8	42%	0.417	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.9	35.2	-178.3	-65.4	-26	0	0	0	114.4	A16 Q18 F57	A16-N55 PolarHBondContact O-ND2 3.13Å; Q18-N55 HydrophobicContact CG-CB 4.1Å; N55-F57 VanDerWaalsContact C-N 3.29Å; N55-F57 VanDerWaalsContact O-CD2 3.25Å; N55-F57 WeakPolarHBondContact O-CD2 3.37Å; N55-F57 PolarHBondContact O-N 2.61Å
56	G	83.5	Confident	73.6	Confident	19 Å²	19	57.7 Å²	57.7	20%	0.196	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	80.6	4.2	-179.4	0	0	0	0	0	114.6	A40 C41 A42 M54	A40-G56 CarbonylContact C-O 3.58Å; A40-G56 WeakPolarHBondContact CA-O 3.31Å; C41-G56 PolarHBondContact N-O 2.65Å; A42-G56 PolarHBondContact N-O 3.48Å; M54-G56 PolarHBondContact O-N 2.88Å
57	F	84.1	Confident	72.2	Confident	24 Å²	24	60.2 Å²	60.2	11%	0.105	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	146.7	177.9	-61	-74.7	0	0	0	112	Q18 R36 C41 C53 M54 N55 F59 F76 L79	Q18-F57 HydrophobicContact CB-CE2 4.07Å; Q18-F57 HydrophobicContact CG-CE2 4.01Å; R36-F57 HydrophobicContact CG-CB 4.24Å; C41-F57 PolarHBondContact SG-N 3.33Å; C41-F57 VanDerWaalsContact SG-N 3.36Å; C41-F57 PolarHBondContact SG-O 2.83Å; C41-F57 VanDerWaalsContact SG-O 3.33Å; C53-F57 WeakPolarHBondContact CA-O 3.12Å; M54-F57 PolarHBondContact N-O 3.36Å; M54-F57 PolarHBondContact O-N 2.64Å; M54-F57 VanDerWaalsContact O-O 3.12Å; N55-F57 VanDerWaalsContact C-N 3.29Å; N55-F57 VanDerWaalsContact O-CD2 3.25Å; N55-F57 WeakPolarHBondContact O-CD2 3.37Å; N55-F57 PolarHBondContact O-N 2.61Å; F57-F59 HydrophobicContact CB-CD2 4.44Å; F57-F59 HydrophobicContact CB-CE2 3.92Å; F57-F59 WeakPolarHBondContact O-CD2 3.46Å; F57-F76 HydrophobicContact CE1-CB 4.15Å; F57-F76 WeakPolarHBondContact CE1-O 3.4Å; F57-F76 HydrophobicContact CZ-CB 4.23Å; F57-L79 HydrophobicContact CD1-CD1 3.75Å; F57-L79 HydrophobicContact CE1-CD1 3.92Å
58	C	83.3	Confident	70.9	Confident	3 Å²	3	62.6 Å²	62.6	2%	0.02	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	134.6	174	-72.8	0	0	0	0	111.2	R36 S37 F39 R46 C47	R36-C58 CarbonylContact C-O 3.6Å; R36-C58 WeakPolarHBondContact CA-O 3.34Å; S37-C58 PolarHBondContact N-O 2.79Å; F39-C58 HydrophobicContact CB-CB 4.31Å; F39-C58 WeakPolarHBondContact O-CB 3.25Å; F39-C58 PolarHBondContact O-N 3.41Å; R46-C58 PolarHBondContact O-SG 2.01Å; C47-C58 WeakPolarHBondContact CA-SG 3.39Å; C47-C58 HydrophobicContact CB-CB 3.82Å; C47-C58 WeakPolarHBondContact CB-SG 3.24Å; C47-C58 WeakPolarHBondContact SG-CA 3.17Å; C47-C58 WeakPolarHBondContact SG-CB 3.21Å; C47-C58 CovalentContact SG-SG 2.04Å; C47-C58 PolarHBondContact SG-SG 3.29Å
59	F	84.6	Confident	69.9	Low	3 Å²	3	62.8 Å²	62.8	1%	0.013	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	123.9	172.9	-73.7	-102.5	0	0	0	110.4	A16 A34 L35 R36 G51 R52 M54 F57	A16-F59 HydrophobicContact CB-CE1 3.76Å; A16-F59 HydrophobicContact CB-CE2 4.37Å; A16-F59 HydrophobicContact CB-CZ 3.59Å; A34-F59 HydrophobicContact CB-CB 4.13Å; L35-F59 CarbonylContact O-C 3.55Å; L35-F59 WeakPolarHBondContact O-CA 3.1Å; R36-F59 HydrophobicContact CB-CD1 3.94Å; R36-F59 HydrophobicContact CB-CE1 3.6Å; R36-F59 HydrophobicContact CB-CZ 3.94Å; R36-F59 HydrophobicContact CG-CE1 4.21Å; R36-F59 HydrophobicContact CG-CE2 4.29Å; R36-F59 HydrophobicContact CG-CZ 4.03Å; R36-F59 VanDerWaalsContact N-CD1 3.34Å; G51-F59 CarbonylContact C-O 3.43Å; G51-F59 VanDerWaalsContact CA-O 3.24Å; G51-F59 WeakPolarHBondContact CA-O 3.12Å; R52-F59 PolarHBondContact N-O 3.42Å; R52-F59 PolarHBondContact O-N 3.12Å; M54-F59 HydrophobicContact CB-CD2 3.86Å; M54-F59 HydrophobicContact CB-CE2 4.06Å; M54-F59 HydrophobicContact CE-CB 3.37Å; M54-F59 HydrophobicContact CE-CD1 4.03Å; M54-F59 HydrophobicContact CE-CD2 3.69Å; M54-F59 HydrophobicContact CE-CE2 4.46Å; M54-F59 HydrophobicContact CE-CG 3.44Å; M54-F59 VanDerWaalsContact CE-CG 3.44Å; M54-F59 HydrophobicContact CG-CD2 4.49Å; F57-F59 HydrophobicContact CB-CD2 4.44Å; F57-F59 HydrophobicContact CB-CE2 3.92Å; F57-F59 WeakPolarHBondContact O-CD2 3.46Å
60	G	80.3	Confident	68.9	Low	15 Å²	15	61.6 Å²	61.6	16%	0.155	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	160	173.3	0	0	0	0	0	111.9	A34 L35 W62	A34-G60 CarbonylContact C-O 3.58Å; A34-G60 WeakPolarHBondContact CA-O 3.37Å; A34-G60 WeakPolarHBondContact CB-O 2.91Å; L35-G60 PolarHBondContact N-O 3.42Å; L35-G60 PolarHBondContact O-N 3.45Å; G60-W62 PolarHBondContact O-N 2.75Å
61	L	74.9	Confident	67.9	Low	69 Å²	69	61.4 Å²	61.4	36%	0.361	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	134.5	166.4	-76.5	171	0	0	0	109.9	M25 V27 V32 D63	M25-L61 HydrophobicContact CE-CD1 4.17Å; M25-L61 HydrophobicContact CE-CD2 3.69Å; M25-L61 HydrophobicContact CE-CG 3.63Å; M25-L61 HydrophobicContact CG-CD2 3.87Å; M25-L61 HydrophobicContact SD-CD2 3.56Å; M25-L61 VanDerWaalsContact SD-CD2 3.56Å; M25-L61 HydrophobicContact SD-CG 3.8Å; V27-L61 HydrophobicContact CG2-CD1 4.25Å; V27-L61 HydrophobicContact CG2-CD2 3.83Å; V27-L61 HydrophobicContact CG2-CG 4.47Å; V32-L61 HydrophobicContact CB-CD2 4.5Å; V32-L61 HydrophobicContact CG2-CD2 3.35Å; L61-D63 PolarHBondContact O-N 3.37Å
62	W	67.3	Low	66.5	Low	108 Å²	108	64.9 Å²	64.9	41%	0.409	35%	0.354	S	S	.	.			trans	-66.9	102.2	168	179.1	-72.4	0	0	0	107.2	F22 V33 L35 G60 G64	F22-W62 HydrophobicContact CD1-CE3 4.27Å; F22-W62 AromaticContact CE1-CE3 3.67Å; F22-W62 HydrophobicContact CE1-CE3 3.67Å; F22-W62 AromaticContact CE1-CZ3 3.59Å; F22-W62 HydrophobicContact CE1-CZ3 3.59Å; F22-W62 HydrophobicContact CZ-CZ3 4.29Å; V33-W62 PolarHBondContact O-N 2.83Å; L35-W62 HydrophobicContact CD1-CB 4.35Å; L35-W62 HydrophobicContact CD1-CD2 3.65Å; L35-W62 HydrophobicContact CD1-CE3 3.02Å; L35-W62 HydrophobicContact CD1-CG 4.29Å; L35-W62 HydrophobicContact CD1-CH2 4.2Å; L35-W62 HydrophobicContact CD1-CZ3 3.32Å; L35-W62 HydrophobicContact CD2-CE3 3.46Å; L35-W62 VanDerWaalsContact CD2-CE3 3.46Å; L35-W62 HydrophobicContact CD2-CZ3 3.59Å; L35-W62 HydrophobicContact CG-CB 4.28Å; L35-W62 HydrophobicContact CG-CD2 4.01Å; L35-W62 HydrophobicContact CG-CE3 3.15Å; L35-W62 HydrophobicContact CG-CZ3 3.7Å; G60-W62 PolarHBondContact O-N 2.75Å; W62-G64 VanDerWaalsContact C-N 3.31Å; W62-G64 VanDerWaalsContact CD1-N 3.32Å; W62-G64 VanDerWaalsContact NE1-CA 3.31Å
63	D	63.4	Low	65	Low	97 Å²	97	65.4 Å²	65.4	52%	0.519	36%	0.364	S	S	.	.			trans	-88.8	3.4	178.5	69	-10.2	0	0	0	112.9	L61 F65 T66	L61-D63 PolarHBondContact O-N 3.37Å; D63-F65 PolarHBondContact O-N 3.37Å; D63-F65 PolarHBondContact OD1-N 3.14Å; D63-T66 PolarHBondContact OD1-N 2.95Å; D63-T66 PolarHBondContact OD1-OG1 2.99Å
64	G	54.4	Low	63.5	Low	50 Å²	50	68.5 Å²	68.5	52%	0.515	39%	0.386	S	S	.	.	S	Bend	trans	84	-18.1	-176.2	0	0	0	0	0	114.4	W62	W62-G64 VanDerWaalsContact C-N 3.31Å; W62-G64 VanDerWaalsContact CD1-N 3.32Å; W62-G64 VanDerWaalsContact NE1-CA 3.31Å
65	F	48.2	Very low	62.4	Low	184 Å²	184	71.4 Å²	71.4	81%	0.807	40%	0.402	S	S	*	.	S	Bend	trans	-109	-23.6	-176.6	-72.8	-84.5	0	0	0	113	D63 Q67	D63-F65 PolarHBondContact O-N 3.37Å; D63-F65 PolarHBondContact OD1-N 3.14Å; F65-Q67 PolarHBondContact O-N 2.04Å
66	T	49.3	Very low	61.5	Low	63 Å²	63	68.4 Å²	68.4	39%	0.387	39%	0.385	S	S	.	.	S	Bend	trans	-67.5	101.7	172.5	23.3	0	0	0	0	109.3	L35 D63	L35-T66 WeakPolarHBondContact CD1-O 3.29Å; D63-T66 PolarHBondContact OD1-N 2.95Å; D63-T66 PolarHBondContact OD1-OG1 2.99Å
67	Q	50.7	Low	60.6	Low	170 Å²	170	74.5 Å²	74.5	79%	0.794	41%	0.413	S	S	*	.			trans	-53.6	132.1	167.4	-68.7	176.4	63.6	0	0	107.6	F65 S69	F65-Q67 PolarHBondContact O-N 2.04Å; Q67-S69 PolarHBondContact O-N 3.31Å; Q67-S69 VanDerWaalsContact O-N 3.11Å
68	P	52.3	Low	59.8	Low	57 Å²	57	80.8 Å²	80.8	37%	0.37	44%	0.443	S	S	.	.			trans	-53.9	127.3	173.5	23.5	-31.9	0	0	0	107	V21 L35 T70	V21-P68 HydrophobicContact CG1-CB 4.37Å; L35-P68 HydrophobicContact CD2-CB 4.28Å; P68-T70 PolarHBondContact O-N 3.25Å
69	S	52.5	Low	59.1	Low	20 Å²	20	81.5 Å²	81.5	14%	0.14	45%	0.446	C	S	.	.			trans	-46.2	109.4	175.5	28.1	0	0	0	0	109	R36 N38 Q67 T71	R36-S69 PolarHBondContact O-OG 3.14Å; N38-S69 WeakPolarHBondContact OD1-CB 3.36Å; Q67-S69 PolarHBondContact O-N 3.31Å; Q67-S69 VanDerWaalsContact O-N 3.11Å; S69-T71 PolarHBondContact O-N 2.81Å
70	T	49.2	Very low	58.7	Low	128 Å²	128	85 Å²	85	79%	0.785	47%	0.469	S	S	*	.			trans	-70.7	2.9	-178.4	49.5	0	0	0	0	113	P68 T72	P68-T70 PolarHBondContact O-N 3.25Å; T70-T72 PolarHBondContact O-N 3.24Å
71	T	48.9	Very low	58.6	Low	34 Å²	34	86.2 Å²	86.2	21%	0.209	47%	0.471	C	S	.	.			trans	-58	109.4	176.9	-43.9	0	0	0	0	108.1	N38 S69 D75 F76 L79	N38-T71 VanDerWaalsContact CG-OG1 3.28Å; N38-T71 PolarHBondContact OD1-OG1 2.78Å; S69-T71 PolarHBondContact O-N 2.81Å; T71-D75 HydrophobicContact CG2-CB 3.46Å; T71-D75 VanDerWaalsContact CG2-CB 3.46Å; T71-F76 HydrophobicContact CG2-CE1 4.27Å; T71-F76 WeakPolarHBondContact O-CE1 3.28Å; T71-F76 WeakPolarHBondContact O-CZ 3.23Å; T71-L79 HydrophobicContact CG2-CD2 3.84Å
72	T	47.9	Very low	58.5	Low	92 Å²	92	84.7 Å²	84.7	56%	0.564	46%	0.461	S	S	*	.			trans	-56.1	150.1	-178	10.5	0	0	0	0	110.5	T70 S74 D75	T70-T72 PolarHBondContact O-N 3.24Å; T72-S74 PolarHBondContact O-N 3.43Å; T72-D75 WeakPolarHBondContact CB-OD2 3.26Å; T72-D75 PolarHBondContact O-N 2.76Å; T72-D75 PolarHBondContact OG1-OD2 3.39Å
73	L	48.3	Very low	59	Low	115 Å²	115	85.4 Å²	85.4	60%	0.602	47%	0.472	S	S	*	.	G	3₁₀ helix	trans	-49.3	-27.2	-175.5	-94.9	142.2	0	0	0	115.4	F76	L73-F76 HydrophobicContact CB-CE2 4.11Å; L73-F76 HydrophobicContact CD2-CD2 4.24Å; L73-F76 HydrophobicContact CD2-CE2 3.8Å; L73-F76 HydrophobicContact CG-CE2 3.8Å; L73-F76 WeakPolarHBondContact O-CD2 3.13Å
74	S	49.2	Very low	59.3	Low	96 Å²	96	82.3 Å²	82.3	67%	0.671	46%	0.464	S	S	*	.	G	3₁₀ helix	trans	-78.8	-19.3	-179.2	-47.2	0	0	0	0	114.7	T72 F76	T72-S74 PolarHBondContact O-N 3.43Å; S74-F76 VanDerWaalsContact C-N 3.32Å
75	D	58.2	Low	59.8	Low	75 Å²	75	84.2 Å²	84.2	40%	0.401	47%	0.465	S	S	.	.	G	3₁₀ helix	trans	-89	-0.6	-175.2	-64.6	-71.2	0	0	0	112.3	T71 T72 H78 L79	T71-D75 HydrophobicContact CG2-CB 3.46Å; T71-D75 VanDerWaalsContact CG2-CB 3.46Å; T72-D75 WeakPolarHBondContact CB-OD2 3.26Å; T72-D75 PolarHBondContact O-N 2.76Å; T72-D75 PolarHBondContact OG1-OD2 3.39Å; D75-H78 PolarHBondContact O-N 3.02Å; D75-L79 PolarHBondContact O-N 3.27Å
76	F	61.4	Low	60.1	Low	15 Å²	15	76.8 Å²	76.8	7%	0.066	43%	0.434	C	S	.	.	G	3₁₀ helix	trans	-70.3	-34.1	-176.5	-62.3	-43	0	0	0	114.2	R36 F57 T71 L73 S74 H78 L79	R36-F76 VanDerWaalsContact CZ-CE1 3.45Å; F57-F76 HydrophobicContact CE1-CB 4.15Å; F57-F76 WeakPolarHBondContact CE1-O 3.4Å; F57-F76 HydrophobicContact CZ-CB 4.23Å; T71-F76 HydrophobicContact CG2-CE1 4.27Å; T71-F76 WeakPolarHBondContact O-CE1 3.28Å; T71-F76 WeakPolarHBondContact O-CZ 3.23Å; L73-F76 HydrophobicContact CB-CE2 4.11Å; L73-F76 HydrophobicContact CD2-CD2 4.24Å; L73-F76 HydrophobicContact CD2-CE2 3.8Å; L73-F76 HydrophobicContact CG-CE2 3.8Å; L73-F76 WeakPolarHBondContact O-CD2 3.13Å; S74-F76 VanDerWaalsContact C-N 3.32Å; F76-H78 PolarHBondContact O-N 2.91Å; F76-H78 VanDerWaalsContact O-N 3.14Å; F76-L79 HydrophobicContact CD1-CD1 3.89Å; F76-L79 HydrophobicContact CD1-CG 4.32Å; F76-L79 PolarHBondContact O-N 3.23Å
77	D	64.1	Low	60.4	Low	147 Å²	147	74.9 Å²	74.9	79%	0.786	42%	0.424	S	S	*	.	G	3₁₀ helix	trans	-62.9	-18.1	175	-73.6	-74.7	0	0	0	112.7
78	H	68.1	Low	60.3	Low	155 Å²	155	74.8 Å²	74.8	72%	0.718	42%	0.422	S	S	*	.	G	3₁₀ helix	trans	-117.4	16.6	-174.6	-57.1	90.4	0	0	0	113.1	D75 F76	D75-H78 PolarHBondContact O-N 3.02Å; F76-H78 PolarHBondContact O-N 2.91Å; F76-H78 VanDerWaalsContact O-N 3.14Å
79	L	67.9	Low	60.1	Low	19 Å²	19	73 Å²	73	10%	0.099	41%	0.411	C	S	.	.	P	Polyproline II helix	trans	-62	131.9	177.2	-73.7	179.9	0	0	0	110	N38 A40 F57 T71 D75 F76 E81	N38-L79 HydrophobicContact CB-CD2 4.46Å; A40-L79 HydrophobicContact CB-CB 4.07Å; F57-L79 HydrophobicContact CD1-CD1 3.75Å; F57-L79 HydrophobicContact CE1-CD1 3.92Å; T71-L79 HydrophobicContact CG2-CD2 3.84Å; D75-L79 PolarHBondContact O-N 3.27Å; F76-L79 HydrophobicContact CD1-CD1 3.89Å; F76-L79 HydrophobicContact CD1-CG 4.32Å; F76-L79 PolarHBondContact O-N 3.23Å; L79-E81 PolarHBondContact O-N 3.26Å
80	P	77.2	Confident	59.9	Low	75 Å²	75	74.9 Å²	74.9	49%	0.487	42%	0.422	S	S	.	.	P	Polyproline II helix	trans	-61.8	142.9	175.9	27.1	-33.7	0	0	0	109.4	F39 A40	F39-P80 WeakPolarHBondContact CA-O 3.46Å; F39-P80 HydrophobicContact CD1-CG 4.02Å; F39-P80 HydrophobicContact CE1-CG 4.13Å; A40-P80 PolarHBondContact N-O 2.99Å
81	E	77.8	Confident	59.9	Low	41 Å²	41	71.6 Å²	71.6	19%	0.192	40%	0.404	C	S	.	.	B	Isolated β-bridge	trans	-71.2	138.2	176.3	-174.6	150.2	122	0	0	111.2	A40 A42 E43 R44 L79 N83	A40-E81 WeakPolarHBondContact O-CA 3.31Å; A42-E81 PolarHBondContact N-OE2 3.02Å; E43-E81 WeakPolarHBondContact CA-OE2 3.13Å; E43-E81 VanDerWaalsContact CB-OE1 3.23Å; E43-E81 WeakPolarHBondContact CB-OE1 3.16Å; E43-E81 VanDerWaalsContact CB-OE2 3.31Å; E43-E81 WeakPolarHBondContact CB-OE2 3.44Å; E43-E81 VanDerWaalsContact CG-OE2 3.28Å; E43-E81 WeakPolarHBondContact CG-OE2 2.82Å; E43-E81 PolarHBondContact N-OE2 2.93Å; R44-E81 WeakPolarHBondContact CB-OE1 3.48Å; R44-E81 WeakPolarHBondContact CD-OE1 3.44Å; R44-E81 WeakPolarHBondContact CG-OE1 3.46Å; R44-E81 PolarHBondContact N-OE1 3.06Å; R44-E81 IonicContact NE-OE1 3.65Å; L79-E81 PolarHBondContact O-N 3.26Å; E81-N83 PolarHBondContact O-N 2.88Å; E81-N83 VanDerWaalsContact O-N 3.12Å
82	Y	73.4	Confident	60	Low	38 Å²	38	73 Å²	73	15%	0.149	42%	0.416	C	S	.	.			trans	-62.1	115.4	176.3	-172.8	-99.2	0	0	0	111.2	F39 A40 R46 C47 G48 G84 T85	F39-Y82 HydrophobicContact CB-CD2 4.37Å; F39-Y82 HydrophobicContact CD1-CD2 4.45Å; F39-Y82 HydrophobicContact CD2-CD2 4.21Å; F39-Y82 HydrophobicContact CG-CD2 4.09Å; A40-Y82 PolarHBondContact O-N 3.32Å; R46-Y82 HydrophobicContact CB-CD1 4.16Å; R46-Y82 WeakPolarHBondContact O-CB 2.95Å; C47-Y82 VanDerWaalsContact CA-CD1 3.45Å; G48-Y82 WeakPolarHBondContact CA-OH 3.48Å; Y82-G84 VanDerWaalsContact CE1-C 3.46Å; Y82-G84 VanDerWaalsContact CE1-O 3.26Å; Y82-G84 WeakPolarHBondContact CE1-O 2.98Å; Y82-G84 VanDerWaalsContact CZ-CA 3.44Å; Y82-G84 WeakPolarHBondContact OH-CA 3.19Å; Y82-T85 PolarHBondContact OH-O 3.42Å
83	N	75.9	Confident	60	Low	122 Å²	122	74.4 Å²	74.4	65%	0.652	42%	0.416	S	S	*	.			trans	-114.6	17.3	179.5	-170.4	26.7	0	0	0	112.6	R44 E81	R44-N83 PolarHBondContact NH1-OD1 3.32Å; E81-N83 PolarHBondContact O-N 2.88Å; E81-N83 VanDerWaalsContact O-N 3.12Å
84	G	69.9	Low	60.1	Low	33 Å²	33	75.9 Å²	75.9	34%	0.34	42%	0.42	S	S	.	.	S	Bend	trans	-86.1	173.3	176.5	0	0	0	0	0	112.8	Y82 D86	Y82-G84 VanDerWaalsContact CE1-C 3.46Å; Y82-G84 VanDerWaalsContact CE1-O 3.26Å; Y82-G84 WeakPolarHBondContact CE1-O 2.98Å; Y82-G84 VanDerWaalsContact CZ-CA 3.44Å; Y82-G84 WeakPolarHBondContact OH-CA 3.19Å; G84-D86 PolarHBondContact O-N 3.49Å
85	T	64.8	Low	60	Low	89 Å²	89	76.7 Å²	76.7	55%	0.546	42%	0.416	S	S	.	.	P	Polyproline II helix	trans	-62.6	129.4	175.3	-17.2	0	0	0	0	109.6	Y82 A87 T90	Y82-T85 PolarHBondContact OH-O 3.42Å; T85-A87 PolarHBondContact O-N 3.27Å; T85-T90 HydrophobicContact CG2-CG2 3.94Å
86	D	54.9	Low	59.7	Low	28 Å²	28	78.2 Å²	78.2	15%	0.15	42%	0.424	C	S	.	.	P	Polyproline II helix	trans	-60.7	138.5	172.2	-79.9	-51.7	0	0	0	109.1	R46 G84 F88 A89 T90	R46-D86 WeakPolarHBondContact CB-OD1 3.34Å; R46-D86 WeakPolarHBondContact CD-OD2 3.44Å; R46-D86 WeakPolarHBondContact CG-OD1 2.92Å; R46-D86 VanDerWaalsContact CG-OD2 3.24Å; R46-D86 WeakPolarHBondContact CG-OD2 3.3Å; R46-D86 IonicContact CZ-OD2 3.19Å; R46-D86 IonicContact NE-OD2 3.04Å; R46-D86 PolarHBondContact NE-OD2 2.99Å; R46-D86 IonicContact NH1-OD2 3.18Å; R46-D86 PolarHBondContact NH1-OD2 3.04Å; G84-D86 PolarHBondContact O-N 3.49Å; D86-F88 PolarHBondContact O-N 3.41Å; D86-A89 HydrophobicContact CB-CB 3.68Å; D86-A89 PolarHBondContact O-N 3.19Å; D86-T90 PolarHBondContact O-N 2.8Å
87	A	56.1	Low	59.4	Low	23 Å²	23	83.5 Å²	83.5	19%	0.19	45%	0.452	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54	-24.5	168.8	0	0	0	0	0	112.7	I49 T85 T90 S91	I49-A87 HydrophobicContact CB-CB 4.34Å; I49-A87 HydrophobicContact CG1-CB 4.19Å; T85-A87 PolarHBondContact O-N 3.27Å; A87-T90 PolarHBondContact O-OG1 3.18Å; A87-S91 PolarHBondContact O-OG 2.96Å
88	F	48.8	Very low	59	Low	169 Å²	169	83.3 Å²	83.3	74%	0.741	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	-22.7	176.3	-66.8	-78.3	0	0	0	113.4	D86 S91 S92	D86-F88 PolarHBondContact O-N 3.41Å; F88-S91 PolarHBondContact O-N 2.94Å; F88-S91 PolarHBondContact O-OG 3.24Å; F88-S92 PolarHBondContact O-N 2.96Å; F88-S92 PolarHBondContact O-OG 2.65Å
89	A	48.1	Very low	58.3	Low	18 Å²	18	82.3 Å²	82.3	15%	0.149	45%	0.449	C	S	.	.	H	α-helix	trans	-70.8	-38.8	177.3	0	0	0	0	0	111.1	D86 S91 S92 E93	D86-A89 HydrophobicContact CB-CB 3.68Å; D86-A89 PolarHBondContact O-N 3.19Å; A89-S91 PolarHBondContact O-N 2.92Å; A89-S92 WeakPolarHBondContact CA-OG 3.29Å; A89-S92 PolarHBondContact O-N 3.29Å; A89-S92 PolarHBondContact O-OG 3.12Å; A89-E93 PolarHBondContact O-N 3.25Å
90	T	48.7	Very low	57.7	Low	61 Å²	61	89.3 Å²	89.3	37%	0.374	48%	0.481	S	S	.	.	H	α-helix	trans	-58.6	-31.3	172.5	49.8	0	0	0	0	111.6	T85 D86 A87 E94	T85-T90 HydrophobicContact CG2-CG2 3.94Å; D86-T90 PolarHBondContact O-N 2.8Å; A87-T90 PolarHBondContact O-OG1 3.18Å; T90-E94 VanDerWaalsContact O-CB 3.29Å; T90-E94 WeakPolarHBondContact O-CB 3.43Å; T90-E94 WeakPolarHBondContact O-CG 3.35Å; T90-E94 PolarHBondContact O-N 3.13Å
91	S	49.4	Very low	56	Low	58 Å²	58	97.9 Å²	97.9	41%	0.406	52%	0.515	S	S	.	.	H	α-helix	trans	-77.7	-20	176.2	-5.9	0	0	0	0	113.6	A87 F88 A89 L95	A87-S91 PolarHBondContact O-OG 2.96Å; F88-S91 PolarHBondContact O-N 2.94Å; F88-S91 PolarHBondContact O-OG 3.24Å; A89-S91 PolarHBondContact O-N 2.92Å; S91-L95 WeakPolarHBondContact O-CB 3.09Å; S91-L95 WeakPolarHBondContact O-CD1 3.17Å
92	S	49.3	Very low	54.9	Low	65 Å²	65	100.8 Å²	100.8	46%	0.455	53%	0.531	S	S	.	.	H	α-helix	trans	-92.2	-32.2	176.7	44	0	0	0	0	113.1	F88 A89 L96	F88-S92 PolarHBondContact O-N 2.96Å; F88-S92 PolarHBondContact O-OG 2.65Å; A89-S92 WeakPolarHBondContact CA-OG 3.29Å; A89-S92 PolarHBondContact O-N 3.29Å; A89-S92 PolarHBondContact O-OG 3.12Å; S92-L96 WeakPolarHBondContact O-CD1 3.45Å; S92-L96 WeakPolarHBondContact O-CG 3.48Å; S92-L96 PolarHBondContact O-N 3.24Å
93	E	49.2	Very low	54	Low	121 Å²	121	104.1 Å²	104.1	57%	0.565	55%	0.551	S	S	*	*	H	α-helix	trans	-79	-42.4	179.3	-65.9	-179.5	106.7	0	0	111.1	A89 L95 L96 D97	A89-E93 PolarHBondContact O-N 3.25Å; E93-L95 PolarHBondContact O-N 3.48Å; E93-L96 PolarHBondContact O-N 3.43Å; E93-L96 VanDerWaalsContact O-N 3.13Å; E93-D97 PolarHBondContact O-N 3.49Å
94	E	49.4	Very low	52.8	Low	146 Å²	146	103.1 Å²	103.1	68%	0.682	55%	0.545	S	S	*	.	H	α-helix	trans	-68	-20.3	175.3	-59.4	-101	132.3	0	0	112.6	T90	T90-E94 VanDerWaalsContact O-CB 3.29Å; T90-E94 WeakPolarHBondContact O-CB 3.43Å; T90-E94 WeakPolarHBondContact O-CG 3.35Å; T90-E94 PolarHBondContact O-N 3.13Å
95	L	47.9	Very low	51.8	Low	112 Å²	112	107.2 Å²	107.2	59%	0.586	56%	0.557	S	S	*	*	H	α-helix	trans	-84.5	-15.1	175.7	-110.2	146.3	0	0	0	113.2	S91 E93	S91-L95 WeakPolarHBondContact O-CB 3.09Å; S91-L95 WeakPolarHBondContact O-CD1 3.17Å; E93-L95 PolarHBondContact O-N 3.48Å
96	L	52	Low	50.9	Low	108 Å²	108	108.3 Å²	108.3	57%	0.565	56%	0.558	S	S	*	*	H	α-helix	trans	-84.1	-35.5	175.4	-78.2	162.2	0	0	0	111.4	S92 E93 D98 M99	S92-L96 WeakPolarHBondContact O-CD1 3.45Å; S92-L96 WeakPolarHBondContact O-CG 3.48Å; S92-L96 PolarHBondContact O-N 3.24Å; E93-L96 PolarHBondContact O-N 3.43Å; E93-L96 VanDerWaalsContact O-N 3.13Å; L96-D98 PolarHBondContact O-N 3.07Å; L96-M99 HydrophobicContact CD2-CE 4Å; L96-M99 PolarHBondContact O-N 3.31Å
97	D	54.3	Low	50.7	Low	125 Å²	125	113.7 Å²	113.7	67%	0.668	59%	0.585	S	S	*	*	H	α-helix	trans	-62.5	-28.6	174.3	-89.9	-56.6	0	0	0	112.6	E93 M99	E93-D97 PolarHBondContact O-N 3.49Å; D97-M99 VanDerWaalsContact C-N 3.27Å; D97-M99 PolarHBondContact O-N 3.38Å
98	D	55.8	Low	50.3	Low	143 Å²	143	120.1 Å²	120.1	77%	0.765	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.3	-7.6	175.4	-84.6	-31	0	0	0	114	L96	L96-D98 PolarHBondContact O-N 3.07Å
99	M	54.4	Low	50.4	Low	134 Å²	134	116.4 Å²	116.4	66%	0.66	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.4	-5.8	-178.5	-73.8	-162.8	-48	0	0	115.6	L96 D97 E101	L96-M99 HydrophobicContact CD2-CE 4Å; L96-M99 PolarHBondContact O-N 3.31Å; D97-M99 VanDerWaalsContact C-N 3.27Å; D97-M99 PolarHBondContact O-N 3.38Å; M99-E101 VanDerWaalsContact C-N 3.32Å; M99-E101 PolarHBondContact O-N 3.46Å
100	E	54	Low	50.6	Low	167 Å²	167	124.6 Å²	124.6	78%	0.78	64%	0.642	S	S	*	*			trans	-94.5	66.7	163.2	-69.1	-169.3	101.6	0	0	107.9
101	E	42.8	Very low	50.8	Low	255 Å²	255	130.4 Å²	130.4	100%	1.192	67%	0.666	S	S	*	*				25.2	0	112.4	-159.8	171.7	-170.4	0	0	116.3	M99	M99-E101 VanDerWaalsContact C-N 3.32Å; M99-E101 PolarHBondContact O-N 3.46Å

Retrieved 101 of 101 residues in 41.9 ms (Link to these results)

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