A0A093H954_STRCA Loading...

Glycoprotein hormone beta-5

Functions as a heterodimeric glycoprotein hormone with GPHA2 able to bind and activate the thyroid-stimulating hormone receptor (TSHR), leading to increased cAMP production. Plays a central role in controlling thyroid cell metabolism.

AlphaFold DB , UniProt , Accession A0A093H954, Species STRCA (Struthio camelus australis), Gene n/a, Length 130 aa.

						>A0A093H954_STRCA|A0A093H954
MKLQHLVLGALPLLLLVGCLSALRTSGINLRTFIGCAVREFTFLAKKPGCKGLRITTDACWGRCQTWEKPVLEPPYIEAYHRVCTYNETKLVTVKLPRCAPNVDPFYTYPVAIRCDCDVCSTATTECETA
					

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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	51.3	Low	51.8	Low	210 Å²	210	129.2 Å²	129.2	100%	1.034	68%	0.681	S	S	*	*				0	19.3	0	-59	-178.5	72.6	0	0	114.8
2	K	52.2	Low	52.5	Low	187 Å²	187	124.2 Å²	124.2	81%	0.813	66%	0.662	S	S	*	*			trans	-101.2	-13.9	176.2	-85.4	-177.8	172.1	178	0	114.9
3	L	46.1	Very low	53	Low	143 Å²	143	123.8 Å²	123.8	75%	0.749	66%	0.659	S	S	*	*	H	α-helix	trans	-82	-25.2	-175	-161.9	63.9	0	0	0	113.3
4	Q	46.2	Very low	53.4	Low	152 Å²	152	123.9 Å²	123.9	71%	0.71	66%	0.658	S	S	*	*	H	α-helix	trans	-77.5	-22.4	-177.2	-67.4	-174.3	-64.9	0	0	113.8
5	H	47.7	Very low	53.8	Low	151 Å²	151	123.9 Å²	123.9	70%	0.699	66%	0.658	S	S	*	*	H	α-helix	trans	-80.4	-26.4	177.8	-74.1	-62.6	0	0	0	113.7
6	L	49.1	Very low	54.2	Low	132 Å²	132	123.1 Å²	123.1	69%	0.691	65%	0.653	S	S	*	*	H	α-helix	trans	-70	-35	175.1	-95.2	102.2	0	0	0	112.3	A10	L6-A10 PolarHBondContact O-N 3.04Å
7	V	51.8	Low	54.4	Low	98 Å²	98	121.6 Å²	121.6	59%	0.594	65%	0.65	S	S	*	*	H	α-helix	trans	-73.1	-34	-177.8	-173.6	0	0	0	0	111.4
8	L	54.4	Low	54.7	Low	139 Å²	139	116.9 Å²	116.9	73%	0.728	63%	0.634	S	S	*	*	H	α-helix	trans	-74.7	-26.5	-177.8	-144.3	74.9	0	0	0	113.3	P12	L8-P12 WeakPolarHBondContact O-CD 3.17Å
9	G	54.2	Low	54.9	Low	47 Å²	47	115.2 Å²	115.2	49%	0.485	63%	0.631	S	S	.	*	H	α-helix	trans	-84.9	-24.8	176.4	0	0	0	0	0	114.4
10	A	58.3	Low	54.9	Low	46 Å²	46	116.2 Å²	116.2	38%	0.38	64%	0.635	S	S	.	*	H	α-helix	trans	-79.5	-35.6	-177.8	0	0	0	0	0	113.1	L6 L13 L14	L6-A10 PolarHBondContact O-N 3.04Å; A10-L13 PolarHBondContact O-N 2.83Å; A10-L14 WeakPolarHBondContact O-CD1 3.4Å; A10-L14 PolarHBondContact O-N 2.88Å
11	L	58.5	Low	55	Low	116 Å²	116	114.7 Å²	114.7	61%	0.607	63%	0.633	S	S	*	*	H	α-helix	trans	-61.3	-47.2	-177.8	-145.6	78.3	0	0	0	114.3	L13 L14 L15	L11-L13 VanDerWaalsContact C-N 3.31Å; L11-L13 PolarHBondContact O-N 2.84Å; L11-L14 PolarHBondContact O-N 2.79Å; L11-L15 WeakPolarHBondContact O-CG 3.07Å; L11-L15 PolarHBondContact O-N 3.19Å
12	P	59.8	Low	55.3	Low	69 Å²	69	108.3 Å²	108.3	45%	0.448	61%	0.613	S	S	.	*	H	α-helix	trans	-68.4	-29.9	176.3	24.7	-31.9	0	0	0	112.7	L8 L15 L16	L8-P12 WeakPolarHBondContact O-CD 3.17Å; P12-L15 PolarHBondContact O-N 3.22Å; P12-L16 WeakPolarHBondContact O-CD1 3.31Å; P12-L16 PolarHBondContact O-N 3.45Å
13	L	59	Low	55.5	Low	119 Å²	119	106.2 Å²	106.2	62%	0.623	61%	0.611	S	S	*	*	H	α-helix	trans	-69.8	-40.9	177.2	-153.5	81.5	0	0	0	111.8	A10 L11 L16 V17	A10-L13 PolarHBondContact O-N 2.83Å; L11-L13 VanDerWaalsContact C-N 3.31Å; L11-L13 PolarHBondContact O-N 2.84Å; L13-L16 PolarHBondContact O-N 2.72Å; L13-V17 WeakPolarHBondContact O-CG2 3.36Å; L13-V17 PolarHBondContact O-N 3.44Å
14	L	59.5	Low	56	Low	125 Å²	125	109.8 Å²	109.8	65%	0.654	61%	0.614	S	S	*	*	H	α-helix	trans	-64.3	-37	174.2	-90.9	145.4	0	0	0	112.5	A10 L11 V17 G18	A10-L14 WeakPolarHBondContact O-CD1 3.4Å; A10-L14 PolarHBondContact O-N 2.88Å; L11-L14 PolarHBondContact O-N 2.79Å; L14-V17 PolarHBondContact O-N 2.04Å; L14-G18 PolarHBondContact O-N 2.83Å
15	L	59.5	Low	56.7	Low	125 Å²	125	109 Å²	109	65%	0.654	62%	0.62	S	S	*	*	H	α-helix	trans	-66.6	-39.4	176.3	-75.4	163.8	0	0	0	112.5	L11 P12 G18 C19	L11-L15 WeakPolarHBondContact O-CG 3.07Å; L11-L15 PolarHBondContact O-N 3.19Å; P12-L15 PolarHBondContact O-N 3.22Å; L15-G18 PolarHBondContact O-N 2.77Å; L15-C19 WeakPolarHBondContact O-CB 3.31Å; L15-C19 PolarHBondContact O-N 2.72Å
16	L	59.8	Low	57.6	Low	110 Å²	110	107.2 Å²	107.2	58%	0.576	62%	0.624	S	S	*	*	H	α-helix	trans	-63.8	-44.6	174.9	-78.1	157.1	0	0	0	111.7	P12 L13 C19 L20	P12-L16 WeakPolarHBondContact O-CD1 3.31Å; P12-L16 PolarHBondContact O-N 3.45Å; L13-L16 PolarHBondContact O-N 2.72Å; L16-C19 PolarHBondContact O-N 2.95Å; L16-L20 WeakPolarHBondContact O-CD1 3.48Å; L16-L20 PolarHBondContact O-N 3.43Å; L16-L20 VanDerWaalsContact O-N 3.14Å
17	V	58.2	Low	58.5	Low	99 Å²	99	104.5 Å²	104.5	60%	0.6	63%	0.628	S	S	*	*	H	α-helix	trans	-64.9	-40	177.7	177	0	0	0	0	111.7	L13 L14 C19 L20 S21	L13-V17 WeakPolarHBondContact O-CG2 3.36Å; L13-V17 PolarHBondContact O-N 3.44Å; L14-V17 PolarHBondContact O-N 2.04Å; V17-C19 VanDerWaalsContact C-N 3.33Å; V17-C19 PolarHBondContact O-N 2.95Å; V17-L20 PolarHBondContact O-N 3.38Å; V17-S21 PolarHBondContact O-N 3.37Å
18	G	59	Low	59.6	Low	36 Å²	36	105.6 Å²	105.6	37%	0.371	63%	0.629	S	S	.	*	H	α-helix	trans	-60.4	-40.6	173.3	0	0	0	0	0	112.7	L14 L15 S21 A22	L14-G18 PolarHBondContact O-N 2.83Å; L15-G18 PolarHBondContact O-N 2.77Å; G18-S21 PolarHBondContact O-N 2.71Å; G18-S21 PolarHBondContact O-OG 2.89Å; G18-A22 PolarHBondContact O-N 2.97Å
19	C	57.9	Low	61	Low	84 Å²	84	103.2 Å²	103.2	57%	0.568	62%	0.617	S	S	*	*	H	α-helix	trans	-67.3	-36.4	179.2	-157.3	0	0	0	0	113	L15 L16 V17 S21 A22	L15-C19 WeakPolarHBondContact O-CB 3.31Å; L15-C19 PolarHBondContact O-N 2.72Å; L16-C19 PolarHBondContact O-N 2.95Å; V17-C19 VanDerWaalsContact C-N 3.33Å; V17-C19 PolarHBondContact O-N 2.95Å; C19-S21 VanDerWaalsContact C-N 3.32Å; C19-S21 PolarHBondContact O-N 2.8Å; C19-A22 PolarHBondContact O-N 3.01Å
20	L	55.6	Low	62.5	Low	135 Å²	135	104.6 Å²	104.6	71%	0.707	61%	0.613	S	S	*	*	H	α-helix	trans	-65.2	-35.2	173.6	-87.8	91.1	0	0	0	112.3	L16 V17 A22 L23	L16-L20 WeakPolarHBondContact O-CD1 3.48Å; L16-L20 PolarHBondContact O-N 3.43Å; L16-L20 VanDerWaalsContact O-N 3.14Å; V17-L20 PolarHBondContact O-N 3.38Å; L20-A22 VanDerWaalsContact C-N 3.32Å; L20-A22 PolarHBondContact O-N 3.45Å; L20-L23 PolarHBondContact O-N 3.11Å
21	S	56.8	Low	63.9	Low	85 Å²	85	112.2 Å²	112.2	59%	0.594	63%	0.632	S	S	*	*	H	α-helix	trans	-75.2	-19.6	178.8	65.4	0	0	0	0	114.3	V17 G18 C19	V17-S21 PolarHBondContact O-N 3.37Å; G18-S21 PolarHBondContact O-N 2.71Å; G18-S21 PolarHBondContact O-OG 2.89Å; C19-S21 VanDerWaalsContact C-N 3.32Å; C19-S21 PolarHBondContact O-N 2.8Å
22	A	57	Low	65.4	Low	76 Å²	76	111.4 Å²	111.4	63%	0.628	63%	0.632	S	S	*	*	H	α-helix	trans	-84.3	-14	175.8	0	0	0	0	0	113.4	G18 C19 L20 R24	G18-A22 PolarHBondContact O-N 2.97Å; C19-A22 PolarHBondContact O-N 3.01Å; L20-A22 VanDerWaalsContact C-N 3.32Å; L20-A22 PolarHBondContact O-N 3.45Å; A22-R24 PolarHBondContact O-N 3.47Å
23	L	56.7	Low	66.9	Low	144 Å²	144	110.3 Å²	110.3	75%	0.754	62%	0.62	S	S	*	*			trans	-77.7	55.9	172.3	-130.6	78	0	0	0	110.4	L20 T25	L20-L23 PolarHBondContact O-N 3.11Å; L23-T25 PolarHBondContact O-N 3.16Å; L23-T25 VanDerWaalsContact O-N 3.11Å
24	R	57.6	Low	68.6	Low	217 Å²	217	110.7 Å²	110.7	82%	0.819	62%	0.622	S	S	*	*			trans	-72.4	103.4	165.3	-71.6	-162.6	176.9	-172.4	0.3	107	A22 S26	A22-R24 PolarHBondContact O-N 3.47Å; R24-S26 PolarHBondContact O-N 3.12Å
25	T	60.1	Low	70.3	Confident	137 Å²	137	105.8 Å²	105.8	84%	0.84	60%	0.601	S	S	*	*			trans	-54.9	105	162.7	30.2	0	0	0	0	107.2	L23 G27	L23-T25 PolarHBondContact O-N 3.16Å; L23-T25 VanDerWaalsContact O-N 3.11Å; T25-G27 PolarHBondContact O-N 3.42Å
26	S	66.3	Low	72.2	Confident	113 Å²	113	101 Å²	101	79%	0.79	58%	0.578	S	S	*	*			trans	-62.8	106.6	173.7	-61.6	0	0	0	0	106.6	R24 I28	R24-S26 PolarHBondContact O-N 3.12Å; S26-I28 PolarHBondContact O-N 3.17Å
27	G	68.9	Low	73.9	Confident	75 Å²	75	97.2 Å²	97.2	77%	0.773	56%	0.563	S	S	*	*			trans	-58.4	126.9	178	0	0	0	0	0	109.7	T25 N29	T25-G27 PolarHBondContact O-N 3.42Å; G27-N29 PolarHBondContact O-N 2.97Å
28	I	74.6	Confident	75.8	Confident	120 Å²	120	95.2 Å²	95.2	62%	0.615	55%	0.55	S	S	*	*			trans	-70.5	121.8	177.1	-61.7	172.6	0	0	0	108.1	S26 L30 F33	S26-I28 PolarHBondContact O-N 3.17Å; I28-L30 PolarHBondContact O-N 2.88Å; I28-L30 VanDerWaalsContact O-N 3.13Å; I28-F33 HydrophobicContact CG2-CB 4.14Å; I28-F33 HydrophobicContact CG2-CD2 3.7Å; I28-F33 HydrophobicContact CG2-CG 4.19Å
29	N	85	Confident	77.5	Confident	89 Å²	89	97.4 Å²	97.4	48%	0.476	55%	0.547	S	S	.	.			trans	-75.4	104.1	172	-174.8	-22.2	0	0	0	109.5	G27 R31 T32 F33	G27-N29 PolarHBondContact O-N 2.97Å; N29-R31 PolarHBondContact O-N 2.88Å; N29-R31 VanDerWaalsContact O-N 3.11Å; N29-R31 WeakPolarHBondContact OD1-CB 3.28Å; N29-R31 PolarHBondContact OD1-N 2.89Å; N29-T32 WeakPolarHBondContact CB-OG1 3.07Å; N29-T32 PolarHBondContact O-N 2.85Å; N29-T32 PolarHBondContact O-OG1 3.4Å; N29-F33 PolarHBondContact O-N 3.01Å
30	L	85.4	Confident	79.4	Confident	76 Å²	76	100.3 Å²	100.3	40%	0.398	55%	0.553	S	S	.	*	T	Hydrogen-bonded Turn	trans	-57.6	-27.5	-179.3	-59	176.4	0	0	0	112.8	I28 T32 W61	I28-L30 PolarHBondContact O-N 2.88Å; I28-L30 VanDerWaalsContact O-N 3.13Å; L30-T32 VanDerWaalsContact C-N 3.29Å; L30-T32 PolarHBondContact O-N 3.05Å; L30-W61 HydrophobicContact CB-CH2 4.08Å; L30-W61 HydrophobicContact CD2-CZ3 4.18Å; L30-W61 WeakPolarHBondContact O-CH2 3.25Å
31	R	86.3	Confident	81.3	Confident	207 Å²	207	99.6 Å²	99.6	78%	0.781	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-25.6	179.4	-60.8	-172.9	178.5	-161.1	0.2	112.9	N29 R63	N29-R31 PolarHBondContact O-N 2.88Å; N29-R31 VanDerWaalsContact O-N 3.11Å; N29-R31 WeakPolarHBondContact OD1-CB 3.28Å; N29-R31 PolarHBondContact OD1-N 2.89Å; R31-R63 PolarHBondContact O-NH1 3.48Å; R31-R63 PolarHBondContact O-NH2 3.19Å
32	T	90.5	Very high	83.3	Confident	98 Å²	98	98.5 Å²	98.5	60%	0.601	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.1	1.5	-177	62	0	0	0	0	112.6	N29 L30 I34	N29-T32 WeakPolarHBondContact CB-OG1 3.07Å; N29-T32 PolarHBondContact O-N 2.85Å; N29-T32 PolarHBondContact O-OG1 3.4Å; L30-T32 VanDerWaalsContact C-N 3.29Å; L30-T32 PolarHBondContact O-N 3.05Å; T32-I34 PolarHBondContact O-N 2.94Å
33	F	92.4	Very high	85.2	Confident	46 Å²	46	97 Å²	97	20%	0.202	51%	0.513	C	S	.	.			trans	-64.3	125	178.9	179.1	-107.8	0	0	0	110.7	I28 N29 G35 A37 W61	I28-F33 HydrophobicContact CG2-CB 4.14Å; I28-F33 HydrophobicContact CG2-CD2 3.7Å; I28-F33 HydrophobicContact CG2-CG 4.19Å; N29-F33 PolarHBondContact O-N 3.01Å; F33-G35 VanDerWaalsContact CE1-C 3.45Å; F33-G35 WeakPolarHBondContact CE1-O 3.45Å; F33-A37 HydrophobicContact CE1-CB 4.15Å; F33-A37 HydrophobicContact CZ-CB 4.04Å; F33-W61 AromaticContact CD1-CZ3 3.96Å; F33-W61 HydrophobicContact CD1-CZ3 3.96Å
34	I	94.3	Very high	87.2	Confident	128 Å²	128	93.8 Å²	93.8	66%	0.656	50%	0.496	S	S	*	.			trans	-116	125.3	170.4	-57.2	176	0	0	0	106.2	T32	T32-I34 PolarHBondContact O-N 2.94Å
35	G	95.4	Very high	89.1	Confident	21 Å²	21	83.5 Å²	83.5	22%	0.216	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	137.8	170.6	-168.8	0	0	0	0	0	110.6	F33 G62 R63	F33-G35 VanDerWaalsContact CE1-C 3.45Å; F33-G35 WeakPolarHBondContact CE1-O 3.45Å; G35-G62 CarbonylContact O-C 3.58Å; G35-G62 WeakPolarHBondContact O-CA 3.07Å; G35-R63 PolarHBondContact N-O 2.03Å; G35-R63 PolarHBondContact O-N 3.19Å
36	C	97.6	Very high	90.9	Very high	25 Å²	25	84.2 Å²	84.2	17%	0.169	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	131.2	175.3	-173.9	0	0	0	0	108.3	C84 C115 D116	C36-C84 VanDerWaalsContact CA-SG 3.53Å; C36-C84 HydrophobicContact CB-CB 3.77Å; C36-C84 WeakPolarHBondContact CB-SG 3.26Å; C36-C84 WeakPolarHBondContact SG-CA 3.37Å; C36-C84 WeakPolarHBondContact SG-CB 3.43Å; C36-C84 CovalentContact SG-SG 2.04Å; C36-C84 PolarHBondContact SG-SG 2.83Å; C36-C115 VanDerWaalsContact SG-CB 3.53Å; C36-D116 PolarHBondContact SG-O 3.11Å; C36-D116 VanDerWaalsContact SG-O 3.36Å
37	A	96.4	Very high	92.4	Very high	31 Å²	31	81.3 Å²	81.3	26%	0.256	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	154.8	-173.8	0	0	0	0	0	111.7	F33 W61	F33-A37 HydrophobicContact CE1-CB 4.15Å; F33-A37 HydrophobicContact CZ-CB 4.04Å; A37-W61 PolarHBondContact N-O 2.83Å; A37-W61 PolarHBondContact O-N 3.3Å; A37-W61 VanDerWaalsContact O-O 3.11Å
38	V	97.4	Very high	93.7	Very high	56 Å²	56	83.5 Å²	83.5	34%	0.339	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	129.5	169.9	-178.6	0	0	0	0	108.8	D58 A112 C115	V38-D58 HydrophobicContact CG1-CB 3.63Å; V38-A112 HydrophobicContact CG1-CB 4.16Å; V38-A112 HydrophobicContact CG2-CB 4.25Å; V38-C115 HydrophobicContact CG2-CB 4.42Å; V38-C115 VanDerWaalsContact CG2-SG 3.54Å
39	R	95.9	Very high	94.8	Very high	82 Å²	82	80 Å²	80	31%	0.309	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	153.3	177.9	-66.3	-169.1	66.8	-156.5	-7.8	111.6	F41 A59 W61	R39-F41 PolarHBondContact O-N 3.46Å; R39-A59 PolarHBondContact N-O 3.46Å; R39-A59 PolarHBondContact O-N 2.98Å; R39-A59 VanDerWaalsContact O-O 3.09Å; R39-W61 HydrophobicContact CB-CB 4.3Å; R39-W61 VanDerWaalsContact CD-CE3 3.43Å; R39-W61 HydrophobicContact CG-CB 4.36Å; R39-W61 VanDerWaalsContact NH1-CE3 3.25Å; R39-W61 VanDerWaalsContact NH1-CZ3 3.34Å
40	E	97	Very high	95.4	Very high	145 Å²	145	76.7 Å²	76.7	68%	0.678	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.2	130.1	173.7	-167.3	-179.6	70.6	0	0	111.1	T56	E40-T56 HydrophobicContact CG-CG2 3.21Å; E40-T56 WeakPolarHBondContact OE2-CG2 3.17Å
41	F	96.3	Very high	96	Very high	121 Å²	121	77.7 Å²	77.7	53%	0.531	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	141.7	176.8	178.4	-109.7	0	0	0	109.9	R39 F43 T56 T57 A59	R39-F41 PolarHBondContact O-N 3.46Å; F41-F43 HydrophobicContact CD1-CB 4.32Å; F41-F43 HydrophobicContact CE1-CB 3.74Å; F41-F43 HydrophobicContact CZ-CB 4.5Å; F41-T56 WeakPolarHBondContact O-CA 3.42Å; F41-T57 PolarHBondContact N-O 3.47Å; F41-T57 PolarHBondContact O-N 3.44Å; F41-T57 VanDerWaalsContact O-O 3.08Å; F41-A59 HydrophobicContact CB-CB 3.8Å; F41-A59 HydrophobicContact CG-CB 4.49Å
42	T	98	Very high	96.5	Very high	61 Å²	61	69.1 Å²	69.1	37%	0.374	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	124.4	178.6	-60.3	0	0	0	0	110.7	R54 I55 T56	T42-R54 HydrophobicContact CG2-CB 4.38Å; T42-I55 CarbonylContact C-O 3.42Å; T42-I55 VanDerWaalsContact CA-O 3.24Å; T42-I55 WeakPolarHBondContact CA-O 3.46Å; T42-T56 PolarHBondContact OG1-OG1 3.3Å
43	F	97.4	Very high	96.9	Very high	45 Å²	45	67.3 Å²	67.3	20%	0.197	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	165.3	176.8	72.9	-80.6	0	0	0	111.6	F41 A45 R54 I55 T57 Y107 Y109	F41-F43 HydrophobicContact CD1-CB 4.32Å; F41-F43 HydrophobicContact CE1-CB 3.74Å; F41-F43 HydrophobicContact CZ-CB 4.5Å; F43-A45 HydrophobicContact CD2-CB 4.48Å; F43-A45 HydrophobicContact CE2-CB 3.88Å; F43-R54 WeakPolarHBondContact O-CA 3.16Å; F43-I55 HydrophobicContact CD1-CB 4.32Å; F43-I55 HydrophobicContact CE1-CB 3.86Å; F43-I55 HydrophobicContact CE1-CG2 3.85Å; F43-I55 HydrophobicContact CE2-CD1 4.44Å; F43-I55 HydrophobicContact CZ-CB 4.06Å; F43-I55 HydrophobicContact CZ-CD1 4.02Å; F43-I55 HydrophobicContact CZ-CG2 4.22Å; F43-I55 PolarHBondContact N-O 2.78Å; F43-I55 PolarHBondContact O-N 3.49Å; F43-T57 HydrophobicContact CD1-CG2 4.09Å; F43-T57 HydrophobicContact CE1-CG2 3.74Å; F43-Y107 HydrophobicContact CE2-CE1 4.01Å; F43-Y107 HydrophobicContact CZ-CE1 4.26Å; F43-Y109 HydrophobicContact CE1-CD2 4.13Å; F43-Y109 HydrophobicContact CE1-CE2 4.29Å; F43-Y109 HydrophobicContact CZ-CD1 4.31Å; F43-Y109 AromaticContact CZ-CD2 3.99Å; F43-Y109 HydrophobicContact CZ-CD2 3.99Å; F43-Y109 HydrophobicContact CZ-CE2 4.42Å; F43-Y109 AromaticContact CZ-CG 3.94Å; F43-Y109 HydrophobicContact CZ-CG 3.94Å
44	L	98.2	Very high	97.2	Very high	77 Å²	77	73.9 Å²	73.9	40%	0.403	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	103	175	177.6	59.8	0	0	0	109	K46 R54	L44-K46 HydrophobicContact CD2-CD 4.47Å; L44-K46 HydrophobicContact CD2-CG 4.41Å; L44-K46 HydrophobicContact CG-CG 4.05Å; L44-K46 PolarHBondContact O-N 2.89Å; L44-R54 HydrophobicContact CD1-CG 4.29Å
45	A	98.1	Very high	97.4	Very high	0 Å²	0	68.3 Å²	68.3	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	125	172.5	0	0	0	0	0	109.8	F43 G52 L53 I55 L96 Y107	F43-A45 HydrophobicContact CD2-CB 4.48Å; F43-A45 HydrophobicContact CE2-CB 3.88Å; A45-G52 WeakPolarHBondContact O-CA 3.37Å; A45-L53 PolarHBondContact N-O 3.2Å; A45-L53 PolarHBondContact O-N 3.39Å; A45-I55 HydrophobicContact CB-CD1 3.53Å; A45-I55 HydrophobicContact CB-CG1 4.19Å; A45-L96 HydrophobicContact CB-CD2 4.12Å; A45-Y107 HydrophobicContact CB-CD1 3.92Å; A45-Y107 HydrophobicContact CB-CE1 3.78Å; A45-Y107 HydrophobicContact CB-CE2 4.43Å; A45-Y107 HydrophobicContact CB-CG 4.31Å
46	K	97.4	Very high	97.5	Very high	152 Å²	152	70.9 Å²	70.9	66%	0.661	37%	0.369	S	S	*	.			trans	-124.5	132.3	179	-65.6	-179.1	-178.3	175.1	0	109.2	L44	L44-K46 HydrophobicContact CD2-CD 4.47Å; L44-K46 HydrophobicContact CD2-CG 4.41Å; L44-K46 HydrophobicContact CG-CG 4.05Å; L44-K46 PolarHBondContact O-N 2.89Å
47	K	97.1	Very high	97.5	Very high	53 Å²	53	70.4 Å²	70.4	23%	0.23	37%	0.366	C	S	.	.			trans	-134.4	131.4	170.5	-169.2	176.7	-172.7	176.2	0	107.9	G49 C50 L96 D104 F106	K47-G49 PolarHBondContact O-N 3.26Å; K47-C50 HydrophobicContact CB-CB 4.45Å; K47-C50 PolarHBondContact O-N 2.73Å; K47-C50 VanDerWaalsContact O-N 3.11Å; K47-L96 HydrophobicContact CB-CD1 3.36Å; K47-L96 HydrophobicContact CD-CD1 4.22Å; K47-L96 HydrophobicContact CG-CD1 4.43Å; K47-D104 VanDerWaalsContact CE-O 3.31Å; K47-D104 WeakPolarHBondContact CE-O 3Å; K47-D104 PolarHBondContact NZ-O 2.94Å; K47-D104 IonicContact NZ-OD2 2.73Å; K47-D104 PolarHBondContact NZ-OD2 2.95Å; K47-F106 PolarHBondContact NZ-O 3.13Å
48	P	97.3	Very high	97.6	Very high	121 Å²	121	72.5 Å²	72.5	79%	0.786	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.3	134.1	176.4	-27	35.4	0	0	0	111.4	C50	P48-C50 VanDerWaalsContact C-N 3.32Å; P48-C50 PolarHBondContact O-N 3.5Å
49	G	96.8	Very high	97.6	Very high	45 Å²	45	70.2 Å²	70.2	46%	0.464	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.9	-1.4	-179.2	0	0	0	0	0	115.8	K47 C99 A100	K47-G49 PolarHBondContact O-N 3.26Å; G49-C99 CarbonylContact O-C 3.59Å; G49-C99 VanDerWaalsContact O-CA 3.28Å; G49-C99 WeakPolarHBondContact O-CA 3.08Å; G49-A100 PolarHBondContact O-N 3.25Å
50	C	98.1	Very high	97.7	Very high	21 Å²	21	67.5 Å²	67.5	14%	0.142	35%	0.353	C	S	.	.	S	Bend	trans	-118.1	156.6	172.7	-63.1	0	0	0	0	111.8	K47 P48 L96 C99	K47-C50 HydrophobicContact CB-CB 4.45Å; K47-C50 PolarHBondContact O-N 2.73Å; K47-C50 VanDerWaalsContact O-N 3.11Å; P48-C50 VanDerWaalsContact C-N 3.32Å; P48-C50 PolarHBondContact O-N 3.5Å; C50-L96 HydrophobicContact CB-CB 3.94Å; C50-L96 HydrophobicContact CB-CD1 4.01Å; C50-C99 HydrophobicContact CB-CB 4.12Å; C50-C99 WeakPolarHBondContact CB-SG 3.1Å; C50-C99 WeakPolarHBondContact SG-CB 3.33Å; C50-C99 CovalentContact SG-SG 2.04Å; C50-C99 PolarHBondContact SG-SG 2.74Å
51	K	97.8	Very high	97.6	Very high	97 Å²	97	65.2 Å²	65.2	42%	0.422	34%	0.338	S	S	.	.			trans	-73.9	133.6	166.6	174.7	171.8	172	178.6	0	109.5	P97 R98	K51-P97 HydrophobicContact CB-CG 4.27Å; K51-P97 WeakPolarHBondContact CB-O 3.41Å; K51-P97 HydrophobicContact CG-CG 4.41Å; K51-P97 PolarHBondContact N-O 3.2Å; K51-P97 WeakPolarHBondContact O-CD 3.4Å; K51-R98 HydrophobicContact CB-CB 4.09Å; K51-R98 PolarHBondContact N-O 2.99Å
52	G	97.3	Very high	97.6	Very high	26 Å²	26	60.5 Å²	60.5	27%	0.268	32%	0.324	S	S	.	.			trans	-61.8	148.3	176.7	0	0	0	0	0	113.4	A45	A45-G52 WeakPolarHBondContact O-CA 3.37Å
53	L	98.1	Very high	97.5	Very high	60 Å²	60	63.9 Å²	63.9	31%	0.314	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	130.7	-178.2	-178.9	63.2	0	0	0	109.8	A45 I55 L96	A45-L53 PolarHBondContact N-O 3.2Å; A45-L53 PolarHBondContact O-N 3.39Å; L53-I55 HydrophobicContact CD2-CG1 4.28Å; L53-I55 HydrophobicContact CG-CG1 4.2Å; L53-L96 HydrophobicContact CB-CD2 3.68Å; L53-L96 HydrophobicContact CD2-CD2 4.28Å
54	R	98.4	Very high	97.4	Very high	184 Å²	184	62.9 Å²	62.9	69%	0.694	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.2	124.7	169.5	-75.1	-175.1	179.5	-83.7	1.6	108.7	T42 F43 L44	T42-R54 HydrophobicContact CG2-CB 4.38Å; F43-R54 WeakPolarHBondContact O-CA 3.16Å; L44-R54 HydrophobicContact CD1-CG 4.29Å
55	I	98.3	Very high	97.3	Very high	12 Å²	12	66.1 Å²	66.1	6%	0.062	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	129.3	-179.4	-61.2	178.1	0	0	0	107.6	T42 F43 A45 L53 V94 Y107 Y109	T42-I55 CarbonylContact C-O 3.42Å; T42-I55 VanDerWaalsContact CA-O 3.24Å; T42-I55 WeakPolarHBondContact CA-O 3.46Å; F43-I55 HydrophobicContact CD1-CB 4.32Å; F43-I55 HydrophobicContact CE1-CB 3.86Å; F43-I55 HydrophobicContact CE1-CG2 3.85Å; F43-I55 HydrophobicContact CE2-CD1 4.44Å; F43-I55 HydrophobicContact CZ-CB 4.06Å; F43-I55 HydrophobicContact CZ-CD1 4.02Å; F43-I55 HydrophobicContact CZ-CG2 4.22Å; F43-I55 PolarHBondContact N-O 2.78Å; F43-I55 PolarHBondContact O-N 3.49Å; A45-I55 HydrophobicContact CB-CD1 3.53Å; A45-I55 HydrophobicContact CB-CG1 4.19Å; L53-I55 HydrophobicContact CD2-CG1 4.28Å; L53-I55 HydrophobicContact CG-CG1 4.2Å; I55-V94 HydrophobicContact CD1-CG2 3.58Å; I55-Y107 HydrophobicContact CD1-CD1 4.47Å; I55-Y109 HydrophobicContact CD1-CD1 4.37Å; I55-Y109 HydrophobicContact CD1-CE1 3.94Å; I55-Y109 HydrophobicContact CG2-CE1 4.16Å; I55-Y109 HydrophobicContact CG2-CE2 4.17Å; I55-Y109 WeakPolarHBondContact CG2-OH 3Å
56	T	98.3	Very high	97.2	Very high	74 Å²	74	69.8 Å²	69.8	45%	0.454	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	124.8	171	-58.8	0	0	0	0	107.6	E40 F41 T42	E40-T56 HydrophobicContact CG-CG2 3.21Å; E40-T56 WeakPolarHBondContact OE2-CG2 3.17Å; F41-T56 WeakPolarHBondContact O-CA 3.42Å; T42-T56 PolarHBondContact OG1-OG1 3.3Å
57	T	98.1	Very high	97.1	Very high	16 Å²	16	67.3 Å²	67.3	10%	0.098	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	161.5	-175.1	-171.4	0	0	0	0	111.1	F41 F43 Y109 V111	F41-T57 PolarHBondContact N-O 3.47Å; F41-T57 PolarHBondContact O-N 3.44Å; F41-T57 VanDerWaalsContact O-O 3.08Å; F43-T57 HydrophobicContact CD1-CG2 4.09Å; F43-T57 HydrophobicContact CE1-CG2 3.74Å; T57-Y109 HydrophobicContact CG2-CD2 4.47Å; T57-Y109 HydrophobicContact CG2-CE2 4.05Å; T57-Y109 WeakPolarHBondContact OG1-CE2 3.21Å; T57-V111 WeakPolarHBondContact OG1-CG2 3.48Å
58	D	98.3	Very high	97.1	Very high	74 Å²	74	70.2 Å²	70.2	40%	0.396	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	131	169.3	-69.1	-34	0	0	0	111.6	V38 V111 A112	V38-D58 HydrophobicContact CG1-CB 3.63Å; D58-V111 HydrophobicContact CB-CG1 3.94Å; D58-A112 PolarHBondContact O-N 3.36Å
59	A	97.8	Very high	97.1	Very high	8 Å²	8	69.5 Å²	69.5	7%	0.066	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	165.6	-179.1	0	0	0	0	0	110.9	R39 F41 Y86	R39-A59 PolarHBondContact N-O 3.46Å; R39-A59 PolarHBondContact O-N 2.98Å; R39-A59 VanDerWaalsContact O-O 3.09Å; F41-A59 HydrophobicContact CB-CB 3.8Å; F41-A59 HydrophobicContact CG-CB 4.49Å; A59-Y86 WeakPolarHBondContact CB-OH 3.48Å
60	C	97.1	Very high	97.1	Very high	25 Å²	25	72.8 Å²	72.8	17%	0.169	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	133.5	179.1	-62	0	0	0	0	112.5	Y86 C115	C60-Y86 VanDerWaalsContact SG-CA 3.59Å; C60-Y86 VanDerWaalsContact SG-CD1 3.55Å; C60-C115 WeakPolarHBondContact CA-SG 3.4Å; C60-C115 HydrophobicContact CB-CB 3.66Å; C60-C115 WeakPolarHBondContact CB-SG 3.47Å; C60-C115 VanDerWaalsContact SG-CA 3.58Å; C60-C115 WeakPolarHBondContact SG-CB 3.13Å; C60-C115 CovalentContact SG-SG 2.03Å; C60-C115 PolarHBondContact SG-SG 3.04Å
61	W	96.3	Very high	97	Very high	97 Å²	97	74 Å²	74	37%	0.367	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	140.1	178.9	-175.7	90.6	0	0	0	111.5	L30 F33 A37 R39	L30-W61 HydrophobicContact CB-CH2 4.08Å; L30-W61 HydrophobicContact CD2-CZ3 4.18Å; L30-W61 WeakPolarHBondContact O-CH2 3.25Å; F33-W61 AromaticContact CD1-CZ3 3.96Å; F33-W61 HydrophobicContact CD1-CZ3 3.96Å; A37-W61 PolarHBondContact N-O 2.83Å; A37-W61 PolarHBondContact O-N 3.3Å; A37-W61 VanDerWaalsContact O-O 3.11Å; R39-W61 HydrophobicContact CB-CB 4.3Å; R39-W61 VanDerWaalsContact CD-CE3 3.43Å; R39-W61 HydrophobicContact CG-CB 4.36Å; R39-W61 VanDerWaalsContact NH1-CE3 3.25Å; R39-W61 VanDerWaalsContact NH1-CZ3 3.34Å
62	G	95.3	Very high	97	Very high	22 Å²	22	77.5 Å²	77.5	23%	0.227	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	162.1	-169.5	179.1	0	0	0	0	0	114.4	G35	G35-G62 CarbonylContact O-C 3.58Å; G35-G62 WeakPolarHBondContact O-CA 3.07Å
63	R	95.3	Very high	96.9	Very high	133 Å²	133	83.6 Å²	83.6	50%	0.502	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	121.4	176	-65	-179.6	-175.1	163.3	5.6	109.3	R31 G35	R31-R63 PolarHBondContact O-NH1 3.48Å; R31-R63 PolarHBondContact O-NH2 3.19Å; G35-R63 PolarHBondContact N-O 2.03Å; G35-R63 PolarHBondContact O-N 3.19Å
64	C	96.6	Very high	96.7	Very high	23 Å²	23	85.2 Å²	85.2	16%	0.155	43%	0.427	C	S	.	.			trans	-95.7	147.7	179.5	-65.2	0	0	0	0	110.6	T66 R82 C84 C117	C64-T66 PolarHBondContact O-N 3.47Å; C64-R82 HydrophobicContact CB-CB 4.08Å; C64-R82 WeakPolarHBondContact CB-O 3.36Å; C64-C84 PolarHBondContact SG-N 3.19Å; C64-C84 VanDerWaalsContact SG-N 3.36Å; C64-C117 WeakPolarHBondContact CA-SG 3.35Å; C64-C117 HydrophobicContact CB-CB 3.69Å; C64-C117 WeakPolarHBondContact CB-SG 3.23Å; C64-C117 WeakPolarHBondContact SG-CA 3.33Å; C64-C117 WeakPolarHBondContact SG-CB 3.43Å; C64-C117 CovalentContact SG-SG 2.03Å; C64-C117 PolarHBondContact SG-SG 2.74Å
65	Q	95.5	Very high	96.4	Very high	146 Å²	146	81.6 Å²	81.6	68%	0.682	43%	0.427	S	S	*	.			trans	-71.8	129.1	172.3	-174.8	174.2	-1.9	0	0	109.2
66	T	95.8	Very high	96.3	Very high	77 Å²	77	87.9 Å²	87.9	47%	0.472	45%	0.451	S	S	.	.			trans	-128	156.3	174.5	60.2	0	0	0	0	109.4	C64 Y80 R82	C64-T66 PolarHBondContact O-N 3.47Å; T66-Y80 VanDerWaalsContact CA-O 3.23Å; T66-Y80 WeakPolarHBondContact CA-O 3.33Å; T66-Y80 WeakPolarHBondContact CB-O 3.37Å; T66-R82 WeakPolarHBondContact CG2-O 3.49Å
67	W	95.9	Very high	96.2	Very high	99 Å²	99	88.4 Å²	88.4	38%	0.375	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156	156.4	174.3	54.5	-95.6	0	0	0	110.6	K69 E78 Y80	W67-K69 HydrophobicContact CE3-CB 3.96Å; W67-K69 HydrophobicContact CZ3-CB 3.78Å; W67-E78 HydrophobicContact CH2-CG 3.95Å; W67-E78 HydrophobicContact CZ3-CB 4.31Å; W67-E78 HydrophobicContact CZ3-CG 3.88Å; W67-E78 WeakPolarHBondContact CZ3-O 3.24Å; W67-Y80 AromaticContact CD1-CD1 3.7Å; W67-Y80 AromaticContact CD1-CG 3.98Å; W67-Y80 HydrophobicContact CD2-CG 4.39Å; W67-Y80 AromaticContact CE2-CG 3.66Å; W67-Y80 HydrophobicContact CZ2-CD2 4.18Å; W67-Y80 AromaticContact CZ2-CG 3.97Å; W67-Y80 HydrophobicContact CZ2-CG 3.97Å; W67-Y80 PolarHBondContact N-O 3.24Å; W67-Y80 VanDerWaalsContact N-O 3.14Å; W67-Y80 VanDerWaalsContact NE1-CB 3.34Å; W67-Y80 AromaticContact NE1-CD1 3.42Å; W67-Y80 AromaticContact NE1-CG 3.37Å; W67-Y80 PolarHBondContact O-N 3.45Å
68	E	96.9	Very high	96.1	Very high	115 Å²	115	91.7 Å²	91.7	54%	0.537	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	133.2	168.9	-69	-174.9	157.5	0	0	107.4	I77 E78 A79 H81	E68-I77 HydrophobicContact CB-CG2 3.87Å; E68-I77 HydrophobicContact CG-CG2 4.1Å; E68-E78 CarbonylContact C-O 3.58Å; E68-E78 WeakPolarHBondContact CA-O 3.47Å; E68-A79 HydrophobicContact CG-CB 4.19Å; E68-H81 WeakPolarHBondContact CG-NE2 3.4Å; E68-H81 IonicContact OE1-CE1 3.76Å; E68-H81 PolarHBondContact OE1-CE1 3.5Å; E68-H81 IonicContact OE1-NE2 3.84Å; E68-H81 PolarHBondContact OE1-NE2 3.46Å; E68-H81 VanDerWaalsContact OE1-NE2 3.13Å
69	K	96.6	Very high	95.9	Very high	106 Å²	106	90.8 Å²	90.8	46%	0.461	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	120.2	179.4	175.7	-177.3	154.5	-140.6	0	108.7	W67 V71 E78	W67-K69 HydrophobicContact CE3-CB 3.96Å; W67-K69 HydrophobicContact CZ3-CB 3.78Å; K69-V71 PolarHBondContact O-N 3.41Å; K69-E78 HydrophobicContact CB-CB 4.31Å; K69-E78 PolarHBondContact N-O 3.38Å; K69-E78 IonicContact NZ-OE2 3.09Å; K69-E78 PolarHBondContact NZ-OE2 3.14Å; K69-E78 PolarHBondContact O-N 3.37Å
70	P	96.6	Very high	95.7	Very high	113 Å²	113	94.5 Å²	94.5	73%	0.734	48%	0.48	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62	136.2	172.4	-21.6	33.2	0	0	0	111	Y76	P70-Y76 WeakPolarHBondContact CA-O 3.41Å
71	V	97.1	Very high	95.5	Very high	47 Å²	47	98.2 Å²	98.2	29%	0.285	50%	0.495	S	S	.	.			trans	-129.1	154.4	175.3	-65.3	0	0	0	0	110	K69 E73 Y76 E78	K69-V71 PolarHBondContact O-N 3.41Å; V71-E73 WeakPolarHBondContact CG2-O 3.25Å; V71-Y76 VanDerWaalsContact CG2-C 3.43Å; V71-Y76 PolarHBondContact N-O 3.47Å; V71-Y76 WeakPolarHBondContact O-CA 3Å; V71-E78 HydrophobicContact CG1-CB 4.04Å
72	L	97.1	Very high	95.5	Very high	171 Å²	171	96.6 Å²	96.6	90%	0.895	49%	0.488	S	S	*	.	S	Bend	trans	-77.7	-24.8	-174.5	-63.8	178	0	0	0	113.2	Y76	L72-Y76 WeakPolarHBondContact O-CE1 2.99Å
73	E	95.3	Very high	95.6	Very high	154 Å²	154	98.6 Å²	98.6	72%	0.72	50%	0.496	S	S	*	.	S	Bend	trans	-97.7	146.5	-178.1	-68.1	167.3	-166.7	0	0	110.3	V71 Y76	V71-E73 WeakPolarHBondContact CG2-O 3.25Å; E73-Y76 WeakPolarHBondContact O-CA 3.16Å; E73-Y76 PolarHBondContact O-N 3.04Å
74	P	93.9	Very high	95.7	Very high	94 Å²	94	93.9 Å²	93.9	61%	0.61	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.3	136.2	171.4	-23.5	30.4	0	0	0	111.5	Y76	P74-Y76 VanDerWaalsContact C-N 3.34Å; P74-Y76 VanDerWaalsContact CA-N 3.32Å; P74-Y76 HydrophobicContact CB-CE2 4.23Å; P74-Y76 HydrophobicContact CG-CE1 4.02Å; P74-Y76 HydrophobicContact CG-CE2 4.09Å
75	P	93.3	Very high	95.7	Very high	108 Å²	108	93.5 Å²	93.5	70%	0.701	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	cis	-85.8	17.4	13.7	35.2	-37	0	0	0	115.4	I77	P75-I77 PolarHBondContact O-N 3.48Å
76	Y	95.6	Very high	95.7	Very high	144 Å²	144	90.8 Å²	90.8	57%	0.565	47%	0.465	S	S	*	.	S	Bend	trans	67.5	-9.2	178.5	-48.6	-70.6	0	0	0	116	P70 V71 L72 E73 P74	P70-Y76 WeakPolarHBondContact CA-O 3.41Å; V71-Y76 VanDerWaalsContact CG2-C 3.43Å; V71-Y76 PolarHBondContact N-O 3.47Å; V71-Y76 WeakPolarHBondContact O-CA 3Å; L72-Y76 WeakPolarHBondContact O-CE1 2.99Å; E73-Y76 WeakPolarHBondContact O-CA 3.16Å; E73-Y76 PolarHBondContact O-N 3.04Å; P74-Y76 VanDerWaalsContact C-N 3.34Å; P74-Y76 VanDerWaalsContact CA-N 3.32Å; P74-Y76 HydrophobicContact CB-CE2 4.23Å; P74-Y76 HydrophobicContact CG-CE1 4.02Å; P74-Y76 HydrophobicContact CG-CE2 4.09Å
77	I	96.6	Very high	95.8	Very high	84 Å²	84	90.5 Å²	90.5	43%	0.431	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	124.3	175.9	-58.3	176.7	0	0	0	108.9	E68 P75 A79	E68-I77 HydrophobicContact CB-CG2 3.87Å; E68-I77 HydrophobicContact CG-CG2 4.1Å; P75-I77 PolarHBondContact O-N 3.48Å; I77-A79 HydrophobicContact CG2-CB 4.32Å
78	E	94.9	Very high	95.8	Very high	86 Å²	86	90.3 Å²	90.3	40%	0.402	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	111.6	163.5	-175.9	-175.3	-180	0	0	107.6	W67 E68 K69 V71	W67-E78 HydrophobicContact CH2-CG 3.95Å; W67-E78 HydrophobicContact CZ3-CB 4.31Å; W67-E78 HydrophobicContact CZ3-CG 3.88Å; W67-E78 WeakPolarHBondContact CZ3-O 3.24Å; E68-E78 CarbonylContact C-O 3.58Å; E68-E78 WeakPolarHBondContact CA-O 3.47Å; K69-E78 HydrophobicContact CB-CB 4.31Å; K69-E78 PolarHBondContact N-O 3.38Å; K69-E78 IonicContact NZ-OE2 3.09Å; K69-E78 PolarHBondContact NZ-OE2 3.14Å; K69-E78 PolarHBondContact O-N 3.37Å; V71-E78 HydrophobicContact CG1-CB 4.04Å
79	A	93.6	Very high	95.8	Very high	55 Å²	55	88.2 Å²	88.2	46%	0.455	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	137.3	-173.3	0	0	0	0	0	112.2	E68 I77	E68-A79 HydrophobicContact CG-CB 4.19Å; I77-A79 HydrophobicContact CG2-CB 4.32Å
80	Y	94.7	Very high	95.9	Very high	86 Å²	86	89.4 Å²	89.4	34%	0.337	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	89.3	173.8	-173.9	-96.7	0	0	0	109.4	T66 W67 R82	T66-Y80 VanDerWaalsContact CA-O 3.23Å; T66-Y80 WeakPolarHBondContact CA-O 3.33Å; T66-Y80 WeakPolarHBondContact CB-O 3.37Å; W67-Y80 AromaticContact CD1-CD1 3.7Å; W67-Y80 AromaticContact CD1-CG 3.98Å; W67-Y80 HydrophobicContact CD2-CG 4.39Å; W67-Y80 AromaticContact CE2-CG 3.66Å; W67-Y80 HydrophobicContact CZ2-CD2 4.18Å; W67-Y80 AromaticContact CZ2-CG 3.97Å; W67-Y80 HydrophobicContact CZ2-CG 3.97Å; W67-Y80 PolarHBondContact N-O 3.24Å; W67-Y80 VanDerWaalsContact N-O 3.14Å; W67-Y80 VanDerWaalsContact NE1-CB 3.34Å; W67-Y80 AromaticContact NE1-CD1 3.42Å; W67-Y80 AromaticContact NE1-CG 3.37Å; W67-Y80 PolarHBondContact O-N 3.45Å; Y80-R82 HydrophobicContact CD1-CG 3.94Å; Y80-R82 HydrophobicContact CE1-CB 4.39Å; Y80-R82 HydrophobicContact CE1-CG 3.3Å; Y80-R82 HydrophobicContact CE2-CG 4.19Å; Y80-R82 VanDerWaalsContact CE2-NE 3.34Å; Y80-R82 VanDerWaalsContact CZ-CG 3.44Å; Y80-R82 VanDerWaalsContact CZ-NE 3.28Å; Y80-R82 PolarHBondContact OH-NE 3.29Å
81	H	93.4	Very high	96	Very high	103 Å²	103	89.8 Å²	89.8	48%	0.477	46%	0.459	S	S	.	.			trans	-106.6	101.3	-177.2	-62.2	157.5	0	0	0	110.4	E68	E68-H81 WeakPolarHBondContact CG-NE2 3.4Å; E68-H81 IonicContact OE1-CE1 3.76Å; E68-H81 PolarHBondContact OE1-CE1 3.5Å; E68-H81 IonicContact OE1-NE2 3.84Å; E68-H81 PolarHBondContact OE1-NE2 3.46Å; E68-H81 VanDerWaalsContact OE1-NE2 3.13Å
82	R	95.7	Very high	96	Very high	62 Å²	62	89.7 Å²	89.7	23%	0.234	46%	0.458	C	S	.	.			trans	-109.2	141.1	174.8	-58.1	-60	-172.5	173.3	4.4	110.3	C64 T66 Y80 C117 D118 V119	C64-R82 HydrophobicContact CB-CB 4.08Å; C64-R82 WeakPolarHBondContact CB-O 3.36Å; T66-R82 WeakPolarHBondContact CG2-O 3.49Å; Y80-R82 HydrophobicContact CD1-CG 3.94Å; Y80-R82 HydrophobicContact CE1-CB 4.39Å; Y80-R82 HydrophobicContact CE1-CG 3.3Å; Y80-R82 HydrophobicContact CE2-CG 4.19Å; Y80-R82 VanDerWaalsContact CE2-NE 3.34Å; Y80-R82 VanDerWaalsContact CZ-CG 3.44Å; Y80-R82 VanDerWaalsContact CZ-NE 3.28Å; Y80-R82 PolarHBondContact OH-NE 3.29Å; R82-C117 HydrophobicContact CB-CB 4.27Å; R82-D118 CarbonylContact C-O 3.5Å; R82-D118 WeakPolarHBondContact CA-O 3.36Å; R82-D118 IonicContact CZ-OD1 2.95Å; R82-D118 IonicContact NH1-OD1 3.13Å; R82-D118 PolarHBondContact NH1-OD1 2.8Å; R82-V119 VanDerWaalsContact NH1-N 3.16Å
83	V	96.6	Very high	96.1	Very high	65 Å²	65	85.1 Å²	85.1	39%	0.394	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	155.2	173.7	-59.4	0	0	0	0	109.8	T85 C117 D118 C120	V83-T85 PolarHBondContact O-N 2.98Å; V83-C117 WeakPolarHBondContact O-CA 3.33Å; V83-D118 PolarHBondContact N-O 2.95Å; V83-D118 PolarHBondContact O-N 3.37Å; V83-C120 HydrophobicContact CG2-CB 3.7Å
84	C	97.2	Very high	96.2	Very high	33 Å²	33	79.5 Å²	79.5	22%	0.223	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	112.1	172.5	178.5	0	0	0	0	108.5	C36 C64	C36-C84 VanDerWaalsContact CA-SG 3.53Å; C36-C84 HydrophobicContact CB-CB 3.77Å; C36-C84 WeakPolarHBondContact CB-SG 3.26Å; C36-C84 WeakPolarHBondContact SG-CA 3.37Å; C36-C84 WeakPolarHBondContact SG-CB 3.43Å; C36-C84 CovalentContact SG-SG 2.04Å; C36-C84 PolarHBondContact SG-SG 2.83Å; C64-C84 PolarHBondContact SG-N 3.19Å; C64-C84 VanDerWaalsContact SG-N 3.36Å
85	T	96.9	Very high	96.4	Very high	16 Å²	16	81.8 Å²	81.8	10%	0.098	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	169.3	-174.1	-166.9	0	0	0	0	112	V83 C115 D116 D118	V83-T85 PolarHBondContact O-N 2.98Å; T85-C115 WeakPolarHBondContact O-CA 3.48Å; T85-D116 PolarHBondContact N-O 3.49Å; T85-D116 PolarHBondContact O-N 2.94Å; T85-D118 HydrophobicContact CG2-CB 4.09Å
86	Y	96.8	Very high	96.7	Very high	89 Å²	89	76.8 Å²	76.8	35%	0.349	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	127	175.6	-62.8	-94.9	0	0	0	110.1	A59 C60 T89 A112	A59-Y86 WeakPolarHBondContact CB-OH 3.48Å; C60-Y86 VanDerWaalsContact SG-CA 3.59Å; C60-Y86 VanDerWaalsContact SG-CD1 3.55Å; Y86-T89 HydrophobicContact CD1-CG2 3.5Å; Y86-T89 HydrophobicContact CE1-CG2 4.43Å; Y86-T89 HydrophobicContact CG-CG2 3.81Å; Y86-A112 HydrophobicContact CD1-CB 3.76Å; Y86-A112 HydrophobicContact CE1-CB 3.61Å
87	N	96.5	Very high	96.8	Very high	71 Å²	71	72.1 Å²	72.1	38%	0.38	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	-43.6	171.2	179.3	-93.1	0	0	0	111.1	R114 D116	N87-R114 HydrophobicContact CB-CG 4.43Å; N87-R114 PolarHBondContact N-O 3.02Å; N87-R114 PolarHBondContact OD1-NE 3.27Å; N87-R114 PolarHBondContact OD1-NH2 3.44Å; N87-D116 HydrophobicContact CB-CB 4.06Å; N87-D116 WeakPolarHBondContact CB-OD2 3.38Å; N87-D116 PolarHBondContact ND2-OD2 3.36Å; N87-D116 VanDerWaalsContact ND2-OD2 3.12Å; N87-D116 PolarHBondContact OD1-OD2 2.96Å
88	E	97.1	Very high	96.8	Very high	95 Å²	95	77 Å²	77	44%	0.444	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	132.1	176.2	-170.8	-179.6	171.1	0	0	109.6	I113 R114	E88-I113 HydrophobicContact CB-CB 4.17Å; E88-I113 HydrophobicContact CG-CB 4.04Å; E88-I113 HydrophobicContact CG-CG2 4.3Å; E88-I113 PolarHBondContact O-N 2.84Å; E88-R114 HydrophobicContact CB-CB 3.97Å; E88-R114 PolarHBondContact N-O 2.04Å; E88-R114 VanDerWaalsContact N-O 3.16Å; E88-R114 PolarHBondContact O-N 3.32Å; E88-R114 VanDerWaalsContact O-N 3.17Å
89	T	97.1	Very high	97	Very high	70 Å²	70	74.7 Å²	74.7	43%	0.429	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	155.7	-178.7	64.3	0	0	0	0	112.1	Y86 P110 V111	Y86-T89 HydrophobicContact CD1-CG2 3.5Å; Y86-T89 HydrophobicContact CE1-CG2 4.43Å; Y86-T89 HydrophobicContact CG-CG2 3.81Å; T89-P110 HydrophobicContact CG2-CB 4.37Å; T89-V111 VanDerWaalsContact CA-O 3.25Å; T89-V111 WeakPolarHBondContact CA-O 3.48Å
90	K	97.8	Very high	97.2	Very high	132 Å²	132	74.3 Å²	74.3	57%	0.574	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.6	133.4	168.6	179.4	179.7	177.6	-179.2	0	109.4	V111 I113	K90-V111 PolarHBondContact N-O 2.95Å; K90-V111 PolarHBondContact O-N 2.85Å; K90-I113 HydrophobicContact CB-CD1 3.97Å; K90-I113 HydrophobicContact CB-CG1 4.05Å
91	L	98.2	Very high	97.3	Very high	120 Å²	120	75.8 Å²	75.8	63%	0.628	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.2	132.2	171.9	-64.5	178.3	0	0	0	110.5	T108 P110	L91-T108 HydrophobicContact CB-CG2 4.05Å; L91-T108 HydrophobicContact CD2-CG2 4.39Å; L91-P110 HydrophobicContact CD2-CB 4.29Å
92	V	98.2	Very high	97.3	Very high	46 Å²	46	79.2 Å²	79.2	28%	0.279	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	142.4	175.3	176.4	0	0	0	0	109.2	T108 Y109 V111	V92-T108 CarbonylContact O-C 3.56Å; V92-T108 VanDerWaalsContact O-CA 3.26Å; V92-T108 WeakPolarHBondContact O-CA 3.4Å; V92-Y109 HydrophobicContact CB-CE1 4.47Å; V92-Y109 HydrophobicContact CG1-CE1 4.43Å; V92-Y109 PolarHBondContact N-O 2.03Å; V92-Y109 PolarHBondContact O-N 3.06Å; V92-V111 HydrophobicContact CB-CG2 3.96Å; V92-V111 HydrophobicContact CG2-CB 4.48Å; V92-V111 HydrophobicContact CG2-CG2 3.55Å
93	T	98.5	Very high	97.4	Very high	75 Å²	75	78.4 Å²	78.4	46%	0.46	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	132.2	180	-55.4	0	0	0	0	110.5	F106 Y107 T108	T93-F106 HydrophobicContact CG2-CB 3.72Å; T93-F106 HydrophobicContact CG2-CD1 3.94Å; T93-F106 HydrophobicContact CG2-CG 4.17Å; T93-Y107 CarbonylContact C-O 3.57Å; T93-Y107 VanDerWaalsContact CA-O 3.31Å; T93-Y107 WeakPolarHBondContact CA-O 3.1Å; T93-T108 PolarHBondContact OG1-OG1 3.2Å
94	V	98.1	Very high	97.5	Very high	35 Å²	35	79.2 Å²	79.2	21%	0.212	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	160.5	175.7	-62.1	0	0	0	0	111.1	I55 F106 Y107 Y109	I55-V94 HydrophobicContact CD1-CG2 3.58Å; V94-F106 CarbonylContact O-C 3.57Å; V94-F106 WeakPolarHBondContact O-CA 2.98Å; V94-Y107 PolarHBondContact N-O 3.31Å; V94-Y107 PolarHBondContact O-N 2.8Å; V94-Y109 HydrophobicContact CG1-CE1 3.97Å; V94-Y109 HydrophobicContact CG2-CE1 4.19Å
95	K	98.1	Very high	97.5	Very high	142 Å²	142	79.1 Å²	79.1	62%	0.617	42%	0.416	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.3	120.1	176	-169.4	179.6	-179.9	174.4	0	110.7	P105 F106	K95-P105 HydrophobicContact CD-CG 4.48Å; K95-P105 HydrophobicContact CG-CB 3.82Å; K95-P105 HydrophobicContact CG-CG 4.07Å; K95-F106 HydrophobicContact CB-CD1 4.38Å; K95-F106 HydrophobicContact CB-CE1 4.28Å; K95-F106 HydrophobicContact CG-CE1 4.47Å
96	L	98.3	Very high	97.5	Very high	4 Å²	4	83.5 Å²	83.5	2%	0.021	43%	0.434	C	S	.	.	P	Polyproline II helix	trans	-75.6	144.4	175.7	-62.8	179.6	0	0	0	111.5	A45 K47 C50 L53 P105 Y107	A45-L96 HydrophobicContact CB-CD2 4.12Å; K47-L96 HydrophobicContact CB-CD1 3.36Å; K47-L96 HydrophobicContact CD-CD1 4.22Å; K47-L96 HydrophobicContact CG-CD1 4.43Å; C50-L96 HydrophobicContact CB-CB 3.94Å; C50-L96 HydrophobicContact CB-CD1 4.01Å; L53-L96 HydrophobicContact CB-CD2 3.68Å; L53-L96 HydrophobicContact CD2-CD2 4.28Å; L96-P105 PolarHBondContact N-O 2.03Å; L96-Y107 HydrophobicContact CD1-CD2 4.35Å; L96-Y107 HydrophobicContact CD1-CG 4.46Å
97	P	97.9	Very high	97.6	Very high	45 Å²	45	82.3 Å²	82.3	29%	0.292	43%	0.429	S	S	.	.	S	Bend	trans	-78.8	154.1	179.4	31.4	-34.7	0	0	0	112.2	K51 C99	K51-P97 HydrophobicContact CB-CG 4.27Å; K51-P97 WeakPolarHBondContact CB-O 3.41Å; K51-P97 HydrophobicContact CG-CG 4.41Å; K51-P97 PolarHBondContact N-O 3.2Å; K51-P97 WeakPolarHBondContact O-CD 3.4Å; P97-C99 PolarHBondContact O-N 3.01Å
98	R	97.6	Very high	97.7	Very high	187 Å²	187	82.4 Å²	82.4	71%	0.706	43%	0.433	S	S	*	.	S	Bend	trans	49.4	56.4	168.1	-65.7	-178	-113.7	159.7	-17.3	113.7	K51	K51-R98 HydrophobicContact CB-CB 4.09Å; K51-R98 PolarHBondContact N-O 2.99Å
99	C	97.9	Very high	97.7	Very high	37 Å²	37	79.1 Å²	79.1	25%	0.25	42%	0.416	C	S	.	.	P	Polyproline II helix	trans	-80.5	146.9	170.6	-58.5	0	0	0	0	111.1	G49 C50 P97 V103 P105	G49-C99 CarbonylContact O-C 3.59Å; G49-C99 VanDerWaalsContact O-CA 3.28Å; G49-C99 WeakPolarHBondContact O-CA 3.08Å; C50-C99 HydrophobicContact CB-CB 4.12Å; C50-C99 WeakPolarHBondContact CB-SG 3.1Å; C50-C99 WeakPolarHBondContact SG-CB 3.33Å; C50-C99 CovalentContact SG-SG 2.04Å; C50-C99 PolarHBondContact SG-SG 2.74Å; P97-C99 PolarHBondContact O-N 3.01Å; C99-V103 HydrophobicContact CB-CB 4.27Å; C99-V103 HydrophobicContact CB-CG1 4.34Å; C99-P105 HydrophobicContact CB-CB 4.44Å
100	A	97.9	Very high	97.7	Very high	47 Å²	47	78.7 Å²	78.7	39%	0.388	42%	0.415	S	S	.	.	P	Polyproline II helix	trans	-62.7	158.1	171.3	0	0	0	0	0	111.1	G49 N102 V103	G49-A100 PolarHBondContact O-N 3.25Å; A100-N102 PolarHBondContact O-N 3.23Å; A100-V103 HydrophobicContact CB-CG2 3.93Å; A100-V103 WeakPolarHBondContact O-CB 3.38Å; A100-V103 PolarHBondContact O-N 2.86Å
101	P	96.5	Very high	97.7	Very high	117 Å²	117	73.3 Å²	73.3	76%	0.76	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	139.8	172.9	-23.8	34	0	0	0	111.1	V103	P101-V103 PolarHBondContact O-N 2.89Å
102	N	94.9	Very high	97.7	Very high	176 Å²	176	67.7 Å²	67.7	94%	0.941	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.7	7.7	-178.9	-49.7	-41.3	0	0	0	116.4	A100	A100-N102 PolarHBondContact O-N 3.23Å
103	V	97.6	Very high	97.7	Very high	45 Å²	45	69.5 Å²	69.5	27%	0.273	37%	0.371	S	S	.	.			trans	-89.9	126.3	169.6	177.5	0	0	0	0	109.2	C99 A100 P101 P105	C99-V103 HydrophobicContact CB-CB 4.27Å; C99-V103 HydrophobicContact CB-CG1 4.34Å; A100-V103 HydrophobicContact CB-CG2 3.93Å; A100-V103 WeakPolarHBondContact O-CB 3.38Å; A100-V103 PolarHBondContact O-N 2.86Å; P101-V103 PolarHBondContact O-N 2.89Å; V103-P105 WeakPolarHBondContact O-CD 3Å
104	D	97.5	Very high	97.7	Very high	82 Å²	82	72 Å²	72	44%	0.439	37%	0.372	S	S	.	.			trans	-60.8	121	171.7	165.7	36.6	0	0	0	110.1	K47 F106	K47-D104 VanDerWaalsContact CE-O 3.31Å; K47-D104 WeakPolarHBondContact CE-O 3Å; K47-D104 PolarHBondContact NZ-O 2.94Å; K47-D104 IonicContact NZ-OD2 2.73Å; K47-D104 PolarHBondContact NZ-OD2 2.95Å; D104-F106 VanDerWaalsContact C-N 3.3Å; D104-F106 PolarHBondContact O-N 3.27Å; D104-F106 WeakPolarHBondContact OD1-CD2 3.45Å; D104-F106 PolarHBondContact OD1-N 3.11Å
105	P	97.8	Very high	97.7	Very high	30 Å²	30	70.7 Å²	70.7	20%	0.195	37%	0.365	C	S	.	.			trans	-82.1	-6	-176.8	35.8	-38.3	0	0	0	113.4	K95 L96 C99 V103	K95-P105 HydrophobicContact CD-CG 4.48Å; K95-P105 HydrophobicContact CG-CB 3.82Å; K95-P105 HydrophobicContact CG-CG 4.07Å; L96-P105 PolarHBondContact N-O 2.03Å; C99-P105 HydrophobicContact CB-CB 4.44Å; V103-P105 WeakPolarHBondContact O-CD 3Å
106	F	98.3	Very high	97.7	Very high	108 Å²	108	66.8 Å²	66.8	47%	0.474	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	139.9	-175	-64.3	-67.7	0	0	0	112.7	K47 T93 V94 K95 D104	K47-F106 PolarHBondContact NZ-O 3.13Å; T93-F106 HydrophobicContact CG2-CB 3.72Å; T93-F106 HydrophobicContact CG2-CD1 3.94Å; T93-F106 HydrophobicContact CG2-CG 4.17Å; V94-F106 CarbonylContact O-C 3.57Å; V94-F106 WeakPolarHBondContact O-CA 2.98Å; K95-F106 HydrophobicContact CB-CD1 4.38Å; K95-F106 HydrophobicContact CB-CE1 4.28Å; K95-F106 HydrophobicContact CG-CE1 4.47Å; D104-F106 VanDerWaalsContact C-N 3.3Å; D104-F106 PolarHBondContact O-N 3.27Å; D104-F106 WeakPolarHBondContact OD1-CD2 3.45Å; D104-F106 PolarHBondContact OD1-N 3.11Å
107	Y	98.2	Very high	97.6	Very high	64 Å²	64	68.9 Å²	68.9	25%	0.251	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	123.5	178.4	-177	-88.3	0	0	0	109.2	F43 A45 I55 T93 V94 L96 Y109	F43-Y107 HydrophobicContact CE2-CE1 4.01Å; F43-Y107 HydrophobicContact CZ-CE1 4.26Å; A45-Y107 HydrophobicContact CB-CD1 3.92Å; A45-Y107 HydrophobicContact CB-CE1 3.78Å; A45-Y107 HydrophobicContact CB-CE2 4.43Å; A45-Y107 HydrophobicContact CB-CG 4.31Å; I55-Y107 HydrophobicContact CD1-CD1 4.47Å; T93-Y107 CarbonylContact C-O 3.57Å; T93-Y107 VanDerWaalsContact CA-O 3.31Å; T93-Y107 WeakPolarHBondContact CA-O 3.1Å; V94-Y107 PolarHBondContact N-O 3.31Å; V94-Y107 PolarHBondContact O-N 2.8Å; L96-Y107 HydrophobicContact CD1-CD2 4.35Å; L96-Y107 HydrophobicContact CD1-CG 4.46Å; Y107-Y109 AromaticContact CD1-CD1 3.94Å; Y107-Y109 HydrophobicContact CD1-CD1 3.94Å; Y107-Y109 HydrophobicContact CE1-CD1 4.07Å; Y107-Y109 HydrophobicContact CE1-CG 4.36Å
108	T	98.2	Very high	97.6	Very high	74 Å²	74	70.2 Å²	70.2	45%	0.454	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	135.7	-175.7	-57.4	0	0	0	0	110.4	L91 V92 T93	L91-T108 HydrophobicContact CB-CG2 4.05Å; L91-T108 HydrophobicContact CD2-CG2 4.39Å; V92-T108 CarbonylContact O-C 3.56Å; V92-T108 VanDerWaalsContact O-CA 3.26Å; V92-T108 WeakPolarHBondContact O-CA 3.4Å; T93-T108 PolarHBondContact OG1-OG1 3.2Å
109	Y	97.4	Very high	97.5	Very high	25 Å²	25	65.6 Å²	65.6	10%	0.098	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	156.9	-179.3	64	-82.9	0	0	0	111.7	F43 I55 T57 V92 V94 Y107 V111	F43-Y109 HydrophobicContact CE1-CD2 4.13Å; F43-Y109 HydrophobicContact CE1-CE2 4.29Å; F43-Y109 HydrophobicContact CZ-CD1 4.31Å; F43-Y109 AromaticContact CZ-CD2 3.99Å; F43-Y109 HydrophobicContact CZ-CD2 3.99Å; F43-Y109 HydrophobicContact CZ-CE2 4.42Å; F43-Y109 AromaticContact CZ-CG 3.94Å; F43-Y109 HydrophobicContact CZ-CG 3.94Å; I55-Y109 HydrophobicContact CD1-CD1 4.37Å; I55-Y109 HydrophobicContact CD1-CE1 3.94Å; I55-Y109 HydrophobicContact CG2-CE1 4.16Å; I55-Y109 HydrophobicContact CG2-CE2 4.17Å; I55-Y109 WeakPolarHBondContact CG2-OH 3Å; T57-Y109 HydrophobicContact CG2-CD2 4.47Å; T57-Y109 HydrophobicContact CG2-CE2 4.05Å; T57-Y109 WeakPolarHBondContact OG1-CE2 3.21Å; V92-Y109 HydrophobicContact CB-CE1 4.47Å; V92-Y109 HydrophobicContact CG1-CE1 4.43Å; V92-Y109 PolarHBondContact N-O 2.03Å; V92-Y109 PolarHBondContact O-N 3.06Å; V94-Y109 HydrophobicContact CG1-CE1 3.97Å; V94-Y109 HydrophobicContact CG2-CE1 4.19Å; Y107-Y109 AromaticContact CD1-CD1 3.94Å; Y107-Y109 HydrophobicContact CD1-CD1 3.94Å; Y107-Y109 HydrophobicContact CE1-CD1 4.07Å; Y107-Y109 HydrophobicContact CE1-CG 4.36Å; Y109-V111 HydrophobicContact CD2-CG2 4.23Å; Y109-V111 HydrophobicContact CE2-CG2 3.72Å
110	P	97.1	Very high	97.3	Very high	61 Å²	61	65.3 Å²	65.3	40%	0.396	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	140.8	176	32.1	-34.1	0	0	0	111.7	T89 L91	T89-P110 HydrophobicContact CG2-CB 4.37Å; L91-P110 HydrophobicContact CD2-CB 4.29Å
111	V	98.3	Very high	97.1	Very high	19 Å²	19	65.8 Å²	65.8	12%	0.115	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	133.2	170.8	-176.8	0	0	0	0	108.4	T57 D58 T89 K90 V92 Y109 I113	T57-V111 WeakPolarHBondContact OG1-CG2 3.48Å; D58-V111 HydrophobicContact CB-CG1 3.94Å; T89-V111 VanDerWaalsContact CA-O 3.25Å; T89-V111 WeakPolarHBondContact CA-O 3.48Å; K90-V111 PolarHBondContact N-O 2.95Å; K90-V111 PolarHBondContact O-N 2.85Å; V92-V111 HydrophobicContact CB-CG2 3.96Å; V92-V111 HydrophobicContact CG2-CB 4.48Å; V92-V111 HydrophobicContact CG2-CG2 3.55Å; Y109-V111 HydrophobicContact CD2-CG2 4.23Å; Y109-V111 HydrophobicContact CE2-CG2 3.72Å; V111-I113 PolarHBondContact O-N 3.34Å
112	A	98.2	Very high	97	Very high	3 Å²	3	66 Å²	66	3%	0.025	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	124.9	176.9	0	0	0	0	0	111.2	V38 D58 Y86	V38-A112 HydrophobicContact CG1-CB 4.16Å; V38-A112 HydrophobicContact CG2-CB 4.25Å; D58-A112 PolarHBondContact O-N 3.36Å; Y86-A112 HydrophobicContact CD1-CB 3.76Å; Y86-A112 HydrophobicContact CE1-CB 3.61Å
113	I	98.2	Very high	96.9	Very high	84 Å²	84	61.8 Å²	61.8	43%	0.431	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	-41.4	167	-54.7	-56.8	0	0	0	109.5	E88 K90 V111	E88-I113 HydrophobicContact CB-CB 4.17Å; E88-I113 HydrophobicContact CG-CB 4.04Å; E88-I113 HydrophobicContact CG-CG2 4.3Å; E88-I113 PolarHBondContact O-N 2.84Å; K90-I113 HydrophobicContact CB-CD1 3.97Å; K90-I113 HydrophobicContact CB-CG1 4.05Å; V111-I113 PolarHBondContact O-N 3.34Å
114	R	97.9	Very high	96.6	Very high	126 Å²	126	65.5 Å²	65.5	48%	0.475	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	145	174.8	-172.1	168.3	65.5	-166.7	-1.8	111.1	N87 E88 D116	N87-R114 HydrophobicContact CB-CG 4.43Å; N87-R114 PolarHBondContact N-O 3.02Å; N87-R114 PolarHBondContact OD1-NE 3.27Å; N87-R114 PolarHBondContact OD1-NH2 3.44Å; E88-R114 HydrophobicContact CB-CB 3.97Å; E88-R114 PolarHBondContact N-O 2.04Å; E88-R114 VanDerWaalsContact N-O 3.16Å; E88-R114 PolarHBondContact O-N 3.32Å; E88-R114 VanDerWaalsContact O-N 3.17Å; R114-D116 IonicContact NE-OD2 2.72Å
115	C	97.9	Very high	96.4	Very high	8 Å²	8	63.7 Å²	63.7	5%	0.054	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	138.6	-179.6	-58.6	0	0	0	0	109.9	C36 V38 C60 T85	C36-C115 VanDerWaalsContact SG-CB 3.53Å; V38-C115 HydrophobicContact CG2-CB 4.42Å; V38-C115 VanDerWaalsContact CG2-SG 3.54Å; C60-C115 WeakPolarHBondContact CA-SG 3.4Å; C60-C115 HydrophobicContact CB-CB 3.66Å; C60-C115 WeakPolarHBondContact CB-SG 3.47Å; C60-C115 VanDerWaalsContact SG-CA 3.58Å; C60-C115 WeakPolarHBondContact SG-CB 3.13Å; C60-C115 CovalentContact SG-SG 2.03Å; C60-C115 PolarHBondContact SG-SG 3.04Å; T85-C115 WeakPolarHBondContact O-CA 3.48Å
116	D	97.6	Very high	96.2	Very high	60 Å²	60	70.2 Å²	70.2	32%	0.321	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	162.1	-178.1	-71.6	-41.1	0	0	0	111.8	C36 T85 N87 R114	C36-D116 PolarHBondContact SG-O 3.11Å; C36-D116 VanDerWaalsContact SG-O 3.36Å; T85-D116 PolarHBondContact N-O 3.49Å; T85-D116 PolarHBondContact O-N 2.94Å; N87-D116 HydrophobicContact CB-CB 4.06Å; N87-D116 WeakPolarHBondContact CB-OD2 3.38Å; N87-D116 PolarHBondContact ND2-OD2 3.36Å; N87-D116 VanDerWaalsContact ND2-OD2 3.12Å; N87-D116 PolarHBondContact OD1-OD2 2.96Å; R114-D116 IonicContact NE-OD2 2.72Å
117	C	97.8	Very high	96	Very high	49 Å²	49	67.8 Å²	67.8	33%	0.331	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	101.5	169.5	-72.1	0	0	0	0	110	C64 R82 V83	C64-C117 WeakPolarHBondContact CA-SG 3.35Å; C64-C117 HydrophobicContact CB-CB 3.69Å; C64-C117 WeakPolarHBondContact CB-SG 3.23Å; C64-C117 WeakPolarHBondContact SG-CA 3.33Å; C64-C117 WeakPolarHBondContact SG-CB 3.43Å; C64-C117 CovalentContact SG-SG 2.03Å; C64-C117 PolarHBondContact SG-SG 2.74Å; R82-C117 HydrophobicContact CB-CB 4.27Å; V83-C117 WeakPolarHBondContact O-CA 3.33Å
118	D	96.5	Very high	95.7	Very high	72 Å²	72	72.6 Å²	72.6	39%	0.385	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	176.9	-176.7	-151.7	-10.7	0	0	0	112.2	R82 V83 T85	R82-D118 CarbonylContact C-O 3.5Å; R82-D118 WeakPolarHBondContact CA-O 3.36Å; R82-D118 IonicContact CZ-OD1 2.95Å; R82-D118 IonicContact NH1-OD1 3.13Å; R82-D118 PolarHBondContact NH1-OD1 2.8Å; V83-D118 PolarHBondContact N-O 2.95Å; V83-D118 PolarHBondContact O-N 3.37Å; T85-D118 HydrophobicContact CG2-CB 4.09Å
119	V	95.3	Very high	95.1	Very high	90 Å²	90	75.9 Å²	75.9	55%	0.545	43%	0.433	S	S	.	.			trans	-63.7	141.2	168.9	-172.4	0	0	0	0	108.5	R82 S121	R82-V119 VanDerWaalsContact NH1-N 3.16Å; V119-S121 PolarHBondContact O-N 2.81Å
120	C	94.6	Very high	93.2	Very high	31 Å²	31	83.1 Å²	83.1	21%	0.209	50%	0.498	C	S	.	.			trans	-68.4	118.6	171.3	-169.7	0	0	0	0	110.6	V83 C127	V83-C120 HydrophobicContact CG2-CB 3.7Å; C120-C127 VanDerWaalsContact C-SG 3.54Å; C120-C127 HydrophobicContact CB-CB 3.83Å; C120-C127 WeakPolarHBondContact CB-SG 3.47Å; C120-C127 WeakPolarHBondContact SG-CA 3.35Å; C120-C127 WeakPolarHBondContact SG-CB 3.44Å; C120-C127 CovalentContact SG-SG 2.03Å; C120-C127 PolarHBondContact SG-SG 3.14Å
121	S	92.9	Very high	93.1	Very high	57 Å²	57	84.2 Å²	84.2	40%	0.399	50%	0.503	S	S	.	.			trans	-86.7	112.3	176.8	178.2	0	0	0	0	110.9	V119 A123 T124 T125	V119-S121 PolarHBondContact O-N 2.81Å; S121-A123 PolarHBondContact O-N 2.84Å; S121-A123 PolarHBondContact OG-N 2.87Å; S121-T124 PolarHBondContact O-N 3.13Å; S121-T125 WeakPolarHBondContact O-CB 3.33Å; S121-T125 PolarHBondContact O-N 3.09Å
122	T	94.6	Very high	92.8	Very high	121 Å²	121	87.6 Å²	87.6	74%	0.742	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-10.5	176.2	54.6	0	0	0	0	113.7	T124 T125 C127	T122-T124 VanDerWaalsContact C-N 3.33Å; T122-T125 WeakPolarHBondContact CA-O 3.46Å; T122-C127 HydrophobicContact CG2-CB 4.21Å
123	A	93.5	Very high	92.5	Very high	89 Å²	89	92.3 Å²	92.3	74%	0.736	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.2	-29.6	177.3	0	0	0	0	0	112.7	S121	S121-A123 PolarHBondContact O-N 2.84Å; S121-A123 PolarHBondContact OG-N 2.87Å
124	T	90.4	Very high	92.1	Very high	122 Å²	122	92.8 Å²	92.8	75%	0.748	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.7	-6.8	-173.6	55.1	0	0	0	0	113.4	S121 T122	S121-T124 PolarHBondContact O-N 3.13Å; T122-T124 VanDerWaalsContact C-N 3.33Å
125	T	92.9	Very high	91.8	Very high	45 Å²	45	90.8 Å²	90.8	28%	0.276	56%	0.563	S	S	.	*	S	Bend	trans	-141.6	132.8	-171.9	-53.6	0	0	0	0	109.6	S121 T122 C127	S121-T125 WeakPolarHBondContact O-CB 3.33Å; S121-T125 PolarHBondContact O-N 3.09Å; T122-T125 WeakPolarHBondContact CA-O 3.46Å; T125-C127 PolarHBondContact O-N 3.48Å; T125-C127 PolarHBondContact O-SG 2.99Å
126	E	94.1	Very high	91.4	Very high	167 Å²	167	96.3 Å²	96.3	78%	0.78	60%	0.597	S	S	*	*			trans	-76	111.3	171.4	-69.1	173.2	179.6	0	0	108.4	E128	E126-E128 PolarHBondContact O-N 2.83Å
127	C	94.1	Very high	90.9	Very high	57 Å²	57	98.9 Å²	98.9	39%	0.385	62%	0.617	S	S	.	*			trans	-89.6	79	-175.1	-58.6	0	0	0	0	110.1	C120 T122 T125	C120-C127 VanDerWaalsContact C-SG 3.54Å; C120-C127 HydrophobicContact CB-CB 3.83Å; C120-C127 WeakPolarHBondContact CB-SG 3.47Å; C120-C127 WeakPolarHBondContact SG-CA 3.35Å; C120-C127 WeakPolarHBondContact SG-CB 3.44Å; C120-C127 CovalentContact SG-SG 2.03Å; C120-C127 PolarHBondContact SG-SG 3.14Å; T122-C127 HydrophobicContact CG2-CB 4.21Å; T125-C127 PolarHBondContact O-N 3.48Å; T125-C127 PolarHBondContact O-SG 2.99Å
128	E	91.3	Very high	90.4	Very high	165 Å²	165	102.7 Å²	102.7	77%	0.771	64%	0.639	S	S	*	*			trans	-112.3	152.1	-178.1	-59.1	-167.8	159.5	0	0	112.2	E126	E126-E128 PolarHBondContact O-N 2.83Å
129	T	85.6	Confident	89.9	Confident	143 Å²	143	105.3 Å²	105.3	88%	0.877	66%	0.66	S	S	*	*			trans	-89.8	129.7	168.9	54.7	0	0	0	0	109.2
130	A	59.5	Low	89.4	Confident	176 Å²	176	106.6 Å²	106.6	100%	1.455	67%	0.671	S	S	*	*			trans	-72.8	0	177.3	0	0	0	0	0	113.4

Retrieved 130 of 130 residues in 168.8 ms (Link to these results)

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