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Alpha-crystallin A chain

Contributes to the transparency and refractive index of the lens. Acts as a chaperone, preventing aggregation of various proteins under a wide range of stress conditions. Required for the correct formation of lens intermediate filaments as part of a complex composed of BFSP1, BFSP2 and CRYAA.

AlphaFold DB , UniProt , Accession P02488, Species MACMU (Macaca mulatta, Rhesus macaque), Gene CRYAA, Length 172 aa.

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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	43.4	Very low	43.3	Very low	237 Å²	237	161.8 Å²	161.8	100%	1.167	80%	0.801	S	S	*	*				0	99.2	0	-76.2	-173.9	172.5	0	0	106.2	V3	M1-V3 PolarHBondContact O-N 3.07Å
2	D	42.2	Very low	43.8	Very low	160 Å²	160	162.2 Å²	162.2	86%	0.856	79%	0.786	S	S	*	*			trans	-75.1	115	176.2	-68.7	-61.3	0	0	0	108.7	T4	D2-T4 VanDerWaalsContact C-N 3.33Å; D2-T4 PolarHBondContact O-N 3.31Å
3	V	45.1	Very low	44.1	Very low	138 Å²	138	159 Å²	159	84%	0.836	78%	0.783	S	S	*	*			trans	-75.9	91.8	174.3	-178.7	0	0	0	0	107.1	M1 I5	M1-V3 PolarHBondContact O-N 3.07Å; V3-I5 PolarHBondContact O-N 3.03Å
4	T	41.5	Very low	44.4	Very low	120 Å²	120	157.6 Å²	157.6	74%	0.736	78%	0.779	S	S	*	*			trans	-61.6	115.2	168.8	29.9	0	0	0	0	109.6	D2 Q6	D2-T4 VanDerWaalsContact C-N 3.33Å; D2-T4 PolarHBondContact O-N 3.31Å; T4-Q6 PolarHBondContact O-N 3.02Å
5	I	48.5	Very low	44.8	Very low	138 Å²	138	149.9 Å²	149.9	71%	0.708	76%	0.757	S	S	*	*			trans	-62.4	100.9	171.3	-60.7	171.3	0	0	0	107.3	V3 H7	V3-I5 PolarHBondContact O-N 3.03Å; I5-H7 PolarHBondContact O-N 3.3Å
6	Q	40.1	Very low	45.1	Very low	175 Å²	175	146.7 Å²	146.7	82%	0.818	75%	0.749	S	S	*	*			trans	-67.1	114.1	167	-73.7	-160.4	-11.4	0	0	107.9	T4 P8	T4-Q6 PolarHBondContact O-N 3.02Å; Q6-P8 WeakPolarHBondContact O-CD 3.49Å
7	H	40.6	Very low	45.8	Very low	154 Å²	154	147.5 Å²	147.5	71%	0.713	75%	0.746	S	S	*	*			trans	-77.3	109.3	165.3	-71.2	-76.5	0	0	0	108	I5 W9	I5-H7 PolarHBondContact O-N 3.3Å; H7-W9 PolarHBondContact O-N 3.38Å
8	P	44.8	Very low	46.6	Very low	106 Å²	106	147.3 Å²	147.3	69%	0.688	74%	0.736	S	S	*	*			trans	-71.4	105	173.7	-6.5	25.1	0	0	0	106.4	Q6 F10	Q6-P8 WeakPolarHBondContact O-CD 3.49Å; P8-F10 PolarHBondContact O-N 3.05Å; P8-F10 VanDerWaalsContact O-N 3.13Å
9	W	45.4	Very low	47.7	Very low	214 Å²	214	146.1 Å²	146.1	81%	0.811	74%	0.74	S	S	*	*	S	Bend	trans	-67.7	-2.7	177.2	41.8	-85.2	0	0	0	112.7	H7 K11	H7-W9 PolarHBondContact O-N 3.38Å; W9-K11 VanDerWaalsContact C-N 3.33Å; W9-K11 PolarHBondContact O-N 3.38Å
10	F	41.4	Very low	49	Very low	152 Å²	152	140.7 Å²	140.7	67%	0.667	72%	0.716	S	S	*	*			trans	-86.4	74.7	160.3	-74.9	-78	0	0	0	110.8	P8 R12	P8-F10 PolarHBondContact O-N 3.05Å; P8-F10 VanDerWaalsContact O-N 3.13Å; F10-R12 VanDerWaalsContact C-N 3.35Å; F10-R12 PolarHBondContact O-N 3.19Å
11	K	43.5	Very low	50.1	Low	186 Å²	186	138.4 Å²	138.4	81%	0.809	70%	0.699	S	S	*	*			trans	-63	101.5	157.3	-76.9	-169.7	175.9	-176.3	0	108.3	W9 T13	W9-K11 VanDerWaalsContact C-N 3.33Å; W9-K11 PolarHBondContact O-N 3.38Å; K11-T13 PolarHBondContact O-N 2.73Å; K11-T13 VanDerWaalsContact O-N 3.1Å
12	R	49.3	Very low	51.4	Low	166 Å²	166	130.5 Å²	130.5	63%	0.626	66%	0.661	S	S	*	*			trans	14.4	88.3	141.5	-62.1	179.1	179.1	-169.8	-4.2	112.6	F10 L14 G15	F10-R12 VanDerWaalsContact C-N 3.35Å; F10-R12 PolarHBondContact O-N 3.19Å; R12-L14 PolarHBondContact O-N 2.72Å; R12-G15 PolarHBondContact O-N 2.85Å
13	T	47.7	Very low	52.4	Low	121 Å²	121	127.7 Å²	127.7	74%	0.742	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.8	-3.7	-164	47.9	0	0	0	0	115.8	K11	K11-T13 PolarHBondContact O-N 2.73Å; K11-T13 VanDerWaalsContact O-N 3.1Å
14	L	47.6	Very low	53.4	Low	139 Å²	139	126.2 Å²	126.2	73%	0.728	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135	11.4	176.8	-65.1	172.6	0	0	0	114.4	R12	R12-L14 PolarHBondContact O-N 2.72Å
15	G	50.9	Low	54.7	Low	43 Å²	43	121.7 Å²	121.7	44%	0.443	60%	0.599	S	S	.	*			trans	-88.3	-3.3	-178.9	0	0	0	0	0	119.6	R12 F17	R12-G15 PolarHBondContact O-N 2.85Å; G15-F17 PolarHBondContact O-N 3.23Å
16	P	49.6	Very low	55.5	Low	98 Å²	98	115.8 Å²	115.8	64%	0.636	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	5.4	-168.2	36.5	-34.9	0	0	0	115	Y18	P16-Y18 PolarHBondContact O-N 2.68Å
17	F	56.8	Low	56.8	Low	160 Å²	160	110 Å²	110	70%	0.702	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-20.8	-178.7	-69	-68.9	0	0	0	113.7	G15	G15-F17 PolarHBondContact O-N 3.23Å
18	Y	59.9	Low	57.5	Low	145 Å²	145	104.9 Å²	104.9	57%	0.569	53%	0.53	S	S	*	.			trans	-145.9	84.6	178.8	-56	-77.5	0	0	0	111.2	P16 S20 R21	P16-Y18 PolarHBondContact O-N 2.68Å; Y18-S20 PolarHBondContact O-N 3.16Å; Y18-R21 PolarHBondContact O-N 3.13Å
19	P	68.8	Low	58.4	Low	124 Å²	124	102 Å²	102	81%	0.805	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-13.2	-179.9	28.5	-36.2	0	0	0	113.2	R21	P19-R21 PolarHBondContact O-N 2.97Å
20	S	73	Confident	58.8	Low	37 Å²	37	93.5 Å²	93.5	26%	0.259	49%	0.485	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-19.8	171.5	48.8	0	0	0	0	113.3	Y18 E63 V64	Y18-S20 PolarHBondContact O-N 3.16Å; S20-E63 CarbonylContact O-C 3.57Å; S20-E63 VanDerWaalsContact O-CA 3.25Å; S20-E63 WeakPolarHBondContact O-CA 3.28Å; S20-V64 WeakPolarHBondContact CB-O 3.37Å; S20-V64 PolarHBondContact O-N 3.4Å
21	R	71.8	Confident	59.7	Low	93 Å²	93	91.9 Å²	91.9	35%	0.351	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	131.2	-175.9	-66.7	-175.1	-179.7	153.2	6.8	112.1	Y18 P19 S62 E63	Y18-R21 PolarHBondContact O-N 3.13Å; P19-R21 PolarHBondContact O-N 2.97Å; R21-S62 WeakPolarHBondContact CA-O 3.28Å; R21-E63 HydrophobicContact CG-CB 4.17Å; R21-E63 HydrophobicContact CG-CG 3.84Å; R21-E63 IonicContact CZ-OE2 3.62Å; R21-E63 IonicContact NE-OE1 3.69Å; R21-E63 IonicContact NE-OE2 3.04Å; R21-E63 PolarHBondContact NE-OE2 3.06Å; R21-E63 IonicContact NH2-OE1 3.79Å; R21-E63 IonicContact NH2-OE2 3.73Å; R21-E63 PolarHBondContact NH2-OE2 2.74Å
22	L	70.3	Confident	60.4	Low	72 Å²	72	85.9 Å²	85.9	38%	0.377	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	122.7	170.9	-71.3	161.5	0	0	0	109.5	Q25 S62	L22-Q25 PolarHBondContact O-NE2 3.18Å; L22-S62 PolarHBondContact N-O 2.69Å; L22-S62 PolarHBondContact O-N 3.1Å
23	F	64.4	Low	60.8	Low	100 Å²	100	85.3 Å²	85.3	44%	0.439	46%	0.462	S	S	.	.			trans	-84.7	154.5	175.7	-63.6	-82.9	0	0	0	111.5
24	D	65.7	Low	61.2	Low	108 Å²	108	84.6 Å²	84.6	58%	0.578	45%	0.446	S	S	*	.			trans	75.8	60.4	167.3	-163.6	36.5	0	0	0	114.6	F26	D24-F26 WeakPolarHBondContact OD1-CD2 3.19Å
25	Q	68.8	Low	61.7	Low	25 Å²	25	80.8 Å²	80.8	12%	0.117	43%	0.426	C	S	.	.			trans	-109.6	48.4	176.9	-58.9	178.8	36.6	0	0	112.7	L22 F27 G60 S62	L22-Q25 PolarHBondContact O-NE2 3.18Å; Q25-F27 HydrophobicContact CB-CE2 4.33Å; Q25-F27 HydrophobicContact CB-CZ 4.36Å; Q25-F27 WeakPolarHBondContact O-CD2 3.31Å; Q25-F27 WeakPolarHBondContact O-CE2 3.21Å; Q25-F27 PolarHBondContact O-N 3.39Å; Q25-G60 VanDerWaalsContact CB-O 3.24Å; Q25-G60 WeakPolarHBondContact CB-O 3.13Å; Q25-G60 VanDerWaalsContact CG-O 3.27Å; Q25-G60 WeakPolarHBondContact CG-O 3.48Å; Q25-G60 PolarHBondContact N-O 2.64Å; Q25-S62 PolarHBondContact NE2-OG 3.23Å
26	F	65.8	Low	62.3	Low	14 Å²	14	83.7 Å²	83.7	6%	0.061	43%	0.431	C	S	.	.			trans	-79.5	2	-173	-71.1	-77.4	0	0	0	115.7	D24 G28 E29 R54 D58	D24-F26 WeakPolarHBondContact OD1-CD2 3.19Å; F26-G28 PolarHBondContact O-N 2.95Å; F26-E29 HydrophobicContact CB-CB 4.08Å; F26-E29 HydrophobicContact CB-CG 4.15Å; F26-E29 HydrophobicContact CD1-CG 4.02Å; F26-E29 WeakPolarHBondContact CD1-OE1 3.25Å; F26-E29 WeakPolarHBondContact CD1-OE2 3.07Å; F26-E29 WeakPolarHBondContact CE1-OE2 3.44Å; F26-E29 HydrophobicContact CG-CG 4.49Å; F26-E29 PolarHBondContact O-N 2.69Å; F26-E29 VanDerWaalsContact O-N 3.08Å; F26-R54 VanDerWaalsContact CE2-NH1 3.27Å; F26-D58 WeakPolarHBondContact CE1-O 3.48Å; F26-D58 WeakPolarHBondContact CZ-O 3.05Å
27	F	66.2	Low	62.7	Low	53 Å²	53	82.9 Å²	82.9	23%	0.232	42%	0.421	C	S	.	.	S	Bend	trans	39.6	39.1	178.4	-56.9	-66	0	0	0	114.5	Q25 D76 F80 R112 F114	Q25-F27 HydrophobicContact CB-CE2 4.33Å; Q25-F27 HydrophobicContact CB-CZ 4.36Å; Q25-F27 WeakPolarHBondContact O-CD2 3.31Å; Q25-F27 WeakPolarHBondContact O-CE2 3.21Å; Q25-F27 PolarHBondContact O-N 3.39Å; F27-D76 WeakPolarHBondContact CE2-O 3.24Å; F27-F80 HydrophobicContact CB-CE2 4.29Å; F27-F80 AromaticContact CD2-CE2 3.89Å; F27-F80 HydrophobicContact CD2-CE2 3.89Å; F27-F80 HydrophobicContact CE2-CE2 4.38Å; F27-F80 HydrophobicContact CG-CE2 4.01Å; F27-R112 WeakPolarHBondContact O-CD 3.41Å; F27-R112 VanDerWaalsContact O-CG 3.26Å; F27-R112 WeakPolarHBondContact O-CG 3.33Å; F27-R112 PolarHBondContact O-NE 3.21Å; F27-F114 HydrophobicContact CD1-CB 3.6Å; F27-F114 HydrophobicContact CD1-CD1 4.09Å; F27-F114 HydrophobicContact CD1-CG 4.06Å; F27-F114 HydrophobicContact CE1-CB 3.16Å; F27-F114 AromaticContact CE1-CD1 3.69Å; F27-F114 HydrophobicContact CE1-CD1 3.69Å; F27-F114 HydrophobicContact CE1-CD2 4.07Å; F27-F114 AromaticContact CE1-CG 3.37Å; F27-F114 HydrophobicContact CE1-CG 3.37Å; F27-F114 HydrophobicContact CE2-CD1 4.21Å; F27-F114 HydrophobicContact CE2-CE1 4.45Å; F27-F114 HydrophobicContact CZ-CB 3.99Å; F27-F114 AromaticContact CZ-CD1 3.73Å; F27-F114 HydrophobicContact CZ-CD1 3.73Å; F27-F114 HydrophobicContact CZ-CD2 4.07Å; F27-F114 HydrophobicContact CZ-CE1 4.2Å; F27-F114 AromaticContact CZ-CG 3.66Å; F27-F114 HydrophobicContact CZ-CG 3.66Å
28	G	55.3	Low	62.5	Low	47 Å²	47	79.8 Å²	79.8	49%	0.485	42%	0.417	S	S	.	.	S	Bend	trans	87	42.1	-178.9	0	0	0	0	0	116.4	F26 I110 R112	F26-G28 PolarHBondContact O-N 2.95Å; G28-I110 WeakPolarHBondContact O-CD1 3.36Å; G28-R112 PolarHBondContact O-NH2 2.96Å
29	E	63.4	Low	62.2	Low	46 Å²	46	81.8 Å²	81.8	22%	0.215	43%	0.429	C	S	.	.	P	Polyproline II helix	trans	-59.5	145.4	156	-81.7	-175.3	178.6	0	0	110.9	F26 F32 R54 K78 H79	F26-E29 HydrophobicContact CB-CB 4.08Å; F26-E29 HydrophobicContact CB-CG 4.15Å; F26-E29 HydrophobicContact CD1-CG 4.02Å; F26-E29 WeakPolarHBondContact CD1-OE1 3.25Å; F26-E29 WeakPolarHBondContact CD1-OE2 3.07Å; F26-E29 WeakPolarHBondContact CE1-OE2 3.44Å; F26-E29 HydrophobicContact CG-CG 4.49Å; F26-E29 PolarHBondContact O-N 2.69Å; F26-E29 VanDerWaalsContact O-N 3.08Å; E29-F32 VanDerWaalsContact OE2-CE2 3.29Å; E29-F32 WeakPolarHBondContact OE2-CE2 3.37Å; E29-F32 WeakPolarHBondContact OE2-CZ 3.45Å; E29-R54 IonicContact OE2-CZ 3.75Å; E29-R54 IonicContact OE2-NH1 3.85Å; E29-R54 PolarHBondContact OE2-NH1 3.48Å; E29-K78 IonicContact OE1-NZ 2.81Å; E29-K78 PolarHBondContact OE1-NZ 3.49Å; E29-H79 IonicContact OE1-CE1 3.96Å; E29-H79 IonicContact OE1-NE2 2.87Å
30	G	55	Low	61.2	Low	34 Å²	34	83 Å²	83	35%	0.351	43%	0.428	S	S	.	.	P	Polyproline II helix	trans	-65.7	159.9	173.6	0	0	0	0	0	112.5	F32	G30-F32 PolarHBondContact O-N 2.79Å
31	L	60.8	Low	59.9	Low	119 Å²	119	84 Å²	84	62%	0.623	44%	0.435	S	S	*	.	P	Polyproline II helix	trans	-63.8	121.6	166.3	-65.7	175.1	0	0	0	107.6	D35 L36	L31-D35 HydrophobicContact CB-CB 4.24Å; L31-D35 HydrophobicContact CD2-CB 4.2Å; L31-L36 HydrophobicContact CB-CD1 4.5Å; L31-L36 HydrophobicContact CB-CD2 4.05Å; L31-L36 HydrophobicContact CB-CG 4.16Å; L31-L36 HydrophobicContact CD1-CD2 3.72Å
32	F	58.3	Low	58.8	Low	59 Å²	59	83.5 Å²	83.5	26%	0.259	45%	0.446	S	S	.	.	P	Polyproline II helix	trans	-74.5	160.2	176.5	-66.8	-91	0	0	0	110.1	E29 G30 Y34 D35 L36	E29-F32 VanDerWaalsContact OE2-CE2 3.29Å; E29-F32 WeakPolarHBondContact OE2-CE2 3.37Å; E29-F32 WeakPolarHBondContact OE2-CZ 3.45Å; G30-F32 PolarHBondContact O-N 2.79Å; F32-Y34 HydrophobicContact CB-CD1 3.45Å; F32-Y34 VanDerWaalsContact CB-CD1 3.45Å; F32-Y34 HydrophobicContact CB-CD2 3.98Å; F32-Y34 HydrophobicContact CB-CE1 3.08Å; F32-Y34 HydrophobicContact CB-CE2 3.65Å; F32-Y34 HydrophobicContact CB-CG 3.9Å; F32-Y34 AromaticContact CD1-CE1 3.75Å; F32-Y34 HydrophobicContact CD1-CE1 3.75Å; F32-Y34 AromaticContact CD2-CE1 3.97Å; F32-Y34 HydrophobicContact CD2-CE1 3.97Å; F32-Y34 HydrophobicContact CD2-CE2 4.01Å; F32-Y34 AromaticContact CD2-CZ 3.37Å; F32-Y34 WeakPolarHBondContact CD2-OH 3.48Å; F32-Y34 VanDerWaalsContact CE2-OH 3.24Å; F32-Y34 WeakPolarHBondContact CE2-OH 3.05Å; F32-Y34 HydrophobicContact CG-CD1 4.21Å; F32-Y34 AromaticContact CG-CE1 3.34Å; F32-Y34 HydrophobicContact CG-CE1 3.34Å; F32-Y34 HydrophobicContact CG-CE2 4.07Å; F32-Y34 AromaticContact CG-CZ 3.26Å; F32-Y34 WeakPolarHBondContact CG-OH 3.49Å; F32-Y34 PolarHBondContact O-N 3.14Å; F32-D35 PolarHBondContact N-OD2 3.1Å; F32-D35 WeakPolarHBondContact O-CA 3.2Å; F32-D35 VanDerWaalsContact O-CB 3.29Å; F32-D35 WeakPolarHBondContact O-CB 3.28Å; F32-D35 PolarHBondContact O-N 3.06Å; F32-L36 PolarHBondContact O-N 2.93Å
33	E	56.5	Low	58.1	Low	155 Å²	155	87.1 Å²	87.1	72%	0.724	47%	0.471	S	S	*	.	H	α-helix	trans	-54.2	-32.7	177.8	-73.9	-171.2	161.6	0	0	112.7	D35 L36 L37	E33-D35 VanDerWaalsContact C-N 3.28Å; E33-D35 PolarHBondContact O-N 2.75Å; E33-L36 PolarHBondContact O-N 2.72Å; E33-L36 VanDerWaalsContact O-N 3.13Å; E33-L37 HydrophobicContact CB-CD1 4.34Å; E33-L37 WeakPolarHBondContact O-CB 3.42Å; E33-L37 WeakPolarHBondContact O-CG 3.14Å; E33-L37 PolarHBondContact O-N 2.97Å
34	Y	56.6	Low	57.4	Low	106 Å²	106	86.6 Å²	86.6	42%	0.416	47%	0.472	S	S	.	.	H	α-helix	trans	-69.3	-22.1	175.3	57.8	-106.1	0	0	0	113.9	F32	F32-Y34 HydrophobicContact CB-CD1 3.45Å; F32-Y34 VanDerWaalsContact CB-CD1 3.45Å; F32-Y34 HydrophobicContact CB-CD2 3.98Å; F32-Y34 HydrophobicContact CB-CE1 3.08Å; F32-Y34 HydrophobicContact CB-CE2 3.65Å; F32-Y34 HydrophobicContact CB-CG 3.9Å; F32-Y34 AromaticContact CD1-CE1 3.75Å; F32-Y34 HydrophobicContact CD1-CE1 3.75Å; F32-Y34 AromaticContact CD2-CE1 3.97Å; F32-Y34 HydrophobicContact CD2-CE1 3.97Å; F32-Y34 HydrophobicContact CD2-CE2 4.01Å; F32-Y34 AromaticContact CD2-CZ 3.37Å; F32-Y34 WeakPolarHBondContact CD2-OH 3.48Å; F32-Y34 VanDerWaalsContact CE2-OH 3.24Å; F32-Y34 WeakPolarHBondContact CE2-OH 3.05Å; F32-Y34 HydrophobicContact CG-CD1 4.21Å; F32-Y34 AromaticContact CG-CE1 3.34Å; F32-Y34 HydrophobicContact CG-CE1 3.34Å; F32-Y34 HydrophobicContact CG-CE2 4.07Å; F32-Y34 AromaticContact CG-CZ 3.26Å; F32-Y34 WeakPolarHBondContact CG-OH 3.49Å; F32-Y34 PolarHBondContact O-N 3.14Å
35	D	58.3	Low	56.8	Low	59 Å²	59	84.1 Å²	84.1	32%	0.316	46%	0.463	S	S	.	.	H	α-helix	trans	-77.3	-26.8	170.7	-64.4	-41	0	0	0	111.2	L31 F32 E33 R54	L31-D35 HydrophobicContact CB-CB 4.24Å; L31-D35 HydrophobicContact CD2-CB 4.2Å; F32-D35 PolarHBondContact N-OD2 3.1Å; F32-D35 WeakPolarHBondContact O-CA 3.2Å; F32-D35 VanDerWaalsContact O-CB 3.29Å; F32-D35 WeakPolarHBondContact O-CB 3.28Å; F32-D35 PolarHBondContact O-N 3.06Å; E33-D35 VanDerWaalsContact C-N 3.28Å; E33-D35 PolarHBondContact O-N 2.75Å; D35-R54 IonicContact OD2-NH2 4Å
36	L	62.9	Low	55.9	Low	104 Å²	104	87.6 Å²	87.6	55%	0.545	49%	0.488	S	S	.	.	H	α-helix	trans	-95.2	-25.1	-174.8	-62.2	177.1	0	0	0	114	L31 F32 E33 P38	L31-L36 HydrophobicContact CB-CD1 4.5Å; L31-L36 HydrophobicContact CB-CD2 4.05Å; L31-L36 HydrophobicContact CB-CG 4.16Å; L31-L36 HydrophobicContact CD1-CD2 3.72Å; F32-L36 PolarHBondContact O-N 2.93Å; E33-L36 PolarHBondContact O-N 2.72Å; E33-L36 VanDerWaalsContact O-N 3.13Å; L36-P38 WeakPolarHBondContact O-CD 3.45Å
37	L	58	Low	55.2	Low	80 Å²	80	95.9 Å²	95.9	42%	0.419	52%	0.52	S	S	.	.			trans	-108.5	88.4	-172.2	-62.8	176.7	0	0	0	112.4	E33 F39 L40	E33-L37 HydrophobicContact CB-CD1 4.34Å; E33-L37 WeakPolarHBondContact O-CB 3.42Å; E33-L37 WeakPolarHBondContact O-CG 3.14Å; E33-L37 PolarHBondContact O-N 2.97Å; L37-F39 PolarHBondContact O-N 3.19Å; L37-L40 HydrophobicContact CD1-CD1 4.43Å
38	P	52.3	Low	54.4	Low	95 Å²	95	101.2 Å²	101.2	62%	0.617	54%	0.54	S	S	*	.	G	3₁₀ helix	trans	-67.4	-16	178.7	27	-34.7	0	0	0	113.7	L36	L36-P38 WeakPolarHBondContact O-CD 3.45Å
39	F	53.4	Low	54.1	Low	187 Å²	187	101 Å²	101	82%	0.82	53%	0.525	S	S	*	.	G	3₁₀ helix	trans	-82.2	-15.3	-170.4	-58.4	-71.1	0	0	0	115.1	L37	L37-F39 PolarHBondContact O-N 3.19Å
40	L	48.5	Very low	53.4	Low	149 Å²	149	105 Å²	105	78%	0.78	54%	0.543	S	S	*	.	G	3₁₀ helix	trans	-96.3	8.6	-178.8	-64.2	179.1	0	0	0	113.6	L37	L37-L40 HydrophobicContact CD1-CD1 4.43Å
41	S	46.8	Very low	53.2	Low	58 Å²	58	108 Å²	108	41%	0.406	56%	0.559	S	S	.	*	S	Bend	trans	-148.2	127.1	177.4	-122	0	0	0	0	114.7	R49	S41-R49 PolarHBondContact OG-NH1 2.85Å
42	S	48.9	Very low	52.7	Low	84 Å²	84	107.9 Å²	107.9	59%	0.587	56%	0.558	S	S	*	*			trans	-57.6	127.8	-173.3	44.5	0	0	0	0	116.1	I44 R49	S42-I44 VanDerWaalsContact C-N 3.26Å; S42-I44 PolarHBondContact O-N 3.01Å; S42-R49 PolarHBondContact O-NH2 3.01Å; S42-R49 PolarHBondContact OG-NH2 3.38Å
43	T	54.7	Low	52.3	Low	148 Å²	148	110.6 Å²	110.6	91%	0.908	57%	0.57	S	S	*	*	S	Bend	trans	37	12.1	149.8	61	0	0	0	0	122.5
44	I	49.6	Very low	52.1	Low	89 Å²	89	105.4 Å²	105.4	46%	0.456	54%	0.544	S	S	.	.	S	Bend	trans	-107.2	124.4	172.3	-60	174.3	0	0	0	108.3	S42 Y48 R49	S42-I44 VanDerWaalsContact C-N 3.26Å; S42-I44 PolarHBondContact O-N 3.01Å; I44-Y48 HydrophobicContact CG2-CG 4.49Å; I44-R49 HydrophobicContact CB-CG 4.21Å; I44-R49 HydrophobicContact CG2-CG 4.1Å
45	S	52.3	Low	52	Low	56 Å²	56	104.6 Å²	104.6	39%	0.392	55%	0.55	S	S	.	.			trans	-42.4	139	-178.5	175.3	0	0	0	0	112.8	Y47 Y48 R49	S45-Y47 PolarHBondContact O-N 3.41Å; S45-Y48 PolarHBondContact O-N 2.99Å; S45-R49 PolarHBondContact O-N 2.78Å
46	P	51.5	Low	51.8	Low	98 Å²	98	106.4 Å²	106.4	64%	0.636	56%	0.563	S	S	*	*	H	α-helix	trans	-53	-32.6	-178.6	19	-31.3	0	0	0	112.8	Y48 R49 Q50	P46-Y48 VanDerWaalsContact C-N 3.33Å; P46-Y48 PolarHBondContact O-N 3.05Å; P46-R49 PolarHBondContact O-N 2.89Å; P46-Q50 PolarHBondContact O-N 2.96Å
47	Y	50	Low	51.3	Low	187 Å²	187	108.9 Å²	108.9	73%	0.733	58%	0.576	S	S	*	*	H	α-helix	trans	-67.2	-26.6	177.4	-60.2	-73.4	0	0	0	114.7	S45	S45-Y47 PolarHBondContact O-N 3.41Å
48	Y	48.9	Very low	51.1	Low	165 Å²	165	107.5 Å²	107.5	65%	0.647	57%	0.569	S	S	*	*	H	α-helix	trans	-86.5	-19.8	175.8	-89.2	-89	0	0	0	112.4	I44 S45 P46	I44-Y48 HydrophobicContact CG2-CG 4.49Å; S45-Y48 PolarHBondContact O-N 2.99Å; P46-Y48 VanDerWaalsContact C-N 3.33Å; P46-Y48 PolarHBondContact O-N 3.05Å
49	R	49.1	Very low	51.3	Low	44 Å²	44	103.6 Å²	103.6	17%	0.166	54%	0.544	C	S	.	.	H	α-helix	trans	-92.1	-22.8	-175.1	-75.6	-110.1	-168.9	166.1	10.1	114.6	S41 S42 I44 S45 P46 S51 L52	S41-R49 PolarHBondContact OG-NH1 2.85Å; S42-R49 PolarHBondContact O-NH2 3.01Å; S42-R49 PolarHBondContact OG-NH2 3.38Å; I44-R49 HydrophobicContact CB-CG 4.21Å; I44-R49 HydrophobicContact CG2-CG 4.1Å; S45-R49 PolarHBondContact O-N 2.78Å; P46-R49 PolarHBondContact O-N 2.89Å; R49-S51 PolarHBondContact O-N 2.83Å; R49-L52 PolarHBondContact O-N 2.8Å
50	Q	49.5	Very low	51.8	Low	130 Å²	130	94.7 Å²	94.7	61%	0.607	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.6	-31.8	170.7	-75.9	-175.9	-33.6	0	0	112.1	P46	P46-Q50 PolarHBondContact O-N 2.96Å
51	S	50	Low	52.9	Low	97 Å²	97	89.1 Å²	89.1	68%	0.678	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	-19.9	-179.6	-175.1	0	0	0	0	115.6	R49	R49-S51 PolarHBondContact O-N 2.83Å
52	L	50	Low	54.6	Low	116 Å²	116	86.4 Å²	86.4	61%	0.607	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	-29.4	-169	-69.4	178.6	0	0	0	113.7	R49	R49-L52 PolarHBondContact O-N 2.8Å
53	F	50.2	Low	56.5	Low	115 Å²	115	83.4 Å²	83.4	50%	0.504	43%	0.433	S	S	.	.	S	Bend	trans	-99.6	-20	-178.1	-72.5	-60.5	0	0	0	114.6	T55	F53-T55 PolarHBondContact O-N 2.86Å
54	R	52.1	Low	58.3	Low	46 Å²	46	78.3 Å²	78.3	17%	0.174	40%	0.402	C	S	.	.	S	Bend	trans	-75.2	113.3	166.4	-70.8	-174.6	179.5	-103.5	3.5	107.3	F26 E29 D35 V56	F26-R54 VanDerWaalsContact CE2-NH1 3.27Å; E29-R54 IonicContact OE2-CZ 3.75Å; E29-R54 IonicContact OE2-NH1 3.85Å; E29-R54 PolarHBondContact OE2-NH1 3.48Å; D35-R54 IonicContact OD2-NH2 4Å; R54-V56 PolarHBondContact O-N 2.8Å
55	T	54.5	Low	60.3	Low	89 Å²	89	78.9 Å²	78.9	55%	0.546	40%	0.398	S	S	.	.			trans	-52.3	139.3	170	-33.4	0	0	0	0	107.5	F53 L57 D58 S59	F53-T55 PolarHBondContact O-N 2.86Å; T55-L57 HydrophobicContact CG2-CB 4.23Å; T55-L57 HydrophobicContact CG2-CD1 4.41Å; T55-L57 HydrophobicContact CG2-CG 4.33Å; T55-L57 PolarHBondContact O-N 2.8Å; T55-D58 PolarHBondContact O-N 2.87Å; T55-S59 PolarHBondContact O-N 2.83Å; T55-S59 VanDerWaalsContact O-N 3.08Å
56	V	54.7	Low	62.1	Low	98 Å²	98	79.7 Å²	79.7	59%	0.594	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.9	-32.9	174.1	175.9	0	0	0	0	110.7	R54 D58 S59 I61	R54-V56 PolarHBondContact O-N 2.8Å; V56-D58 VanDerWaalsContact C-N 3.33Å; V56-D58 PolarHBondContact O-N 2.92Å; V56-S59 PolarHBondContact O-N 3.35Å; V56-S59 PolarHBondContact O-OG 3.41Å; V56-I61 HydrophobicContact CG1-CD1 3.73Å; V56-I61 WeakPolarHBondContact O-CD1 3.46Å
57	L	51.9	Low	63.9	Low	156 Å²	156	78.6 Å²	78.6	82%	0.817	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-31.5	175	-62.6	175.9	0	0	0	114.6	T55	T55-L57 HydrophobicContact CG2-CB 4.23Å; T55-L57 HydrophobicContact CG2-CD1 4.41Å; T55-L57 HydrophobicContact CG2-CG 4.33Å; T55-L57 PolarHBondContact O-N 2.8Å
58	D	54.9	Low	65.7	Low	50 Å²	50	79.6 Å²	79.6	27%	0.267	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-27.1	-179.8	-170.5	41.8	0	0	0	111.3	F26 T55 V56 G60 K78	F26-D58 WeakPolarHBondContact CE1-O 3.48Å; F26-D58 WeakPolarHBondContact CZ-O 3.05Å; T55-D58 PolarHBondContact O-N 2.87Å; V56-D58 VanDerWaalsContact C-N 3.33Å; V56-D58 PolarHBondContact O-N 2.92Å; D58-G60 PolarHBondContact O-N 3.18Å; D58-K78 IonicContact OD1-NZ 2.92Å; D58-K78 PolarHBondContact OD1-NZ 2.81Å
59	S	56.4	Low	67.7	Low	13 Å²	13	76.3 Å²	76.3	9%	0.091	39%	0.389	C	S	.	.	S	Bend	trans	-54.3	116	169.4	74.2	0	0	0	0	108.9	T55 V56 I61	T55-S59 PolarHBondContact O-N 2.83Å; T55-S59 VanDerWaalsContact O-N 3.08Å; V56-S59 PolarHBondContact O-N 3.35Å; V56-S59 PolarHBondContact O-OG 3.41Å; S59-I61 VanDerWaalsContact C-N 3.26Å; S59-I61 VanDerWaalsContact O-CG1 3.26Å; S59-I61 WeakPolarHBondContact O-CG1 3.29Å; S59-I61 PolarHBondContact O-N 2.93Å; S59-I61 WeakPolarHBondContact OG-CG1 3.38Å
60	G	63	Low	69.8	Low	0 Å²	0	79.1 Å²	79.1	0%	0	40%	0.402	C	S	.	.			trans	-57.4	90	178.4	0	0	0	0	0	110.7	Q25 D58 D76	Q25-G60 VanDerWaalsContact CB-O 3.24Å; Q25-G60 WeakPolarHBondContact CB-O 3.13Å; Q25-G60 VanDerWaalsContact CG-O 3.27Å; Q25-G60 WeakPolarHBondContact CG-O 3.48Å; Q25-G60 PolarHBondContact N-O 2.64Å; D58-G60 PolarHBondContact O-N 3.18Å; G60-D76 WeakPolarHBondContact CA-OD2 3.46Å
61	I	71.9	Confident	71.9	Confident	32 Å²	32	73.2 Å²	73.2	16%	0.164	37%	0.374	C	S	.	.			trans	-87.1	124.7	-173.9	-75.1	158	0	0	0	107	V56 S59 E63 D76	V56-I61 HydrophobicContact CG1-CD1 3.73Å; V56-I61 WeakPolarHBondContact O-CD1 3.46Å; S59-I61 VanDerWaalsContact C-N 3.26Å; S59-I61 VanDerWaalsContact O-CG1 3.26Å; S59-I61 WeakPolarHBondContact O-CG1 3.29Å; S59-I61 PolarHBondContact O-N 2.93Å; S59-I61 WeakPolarHBondContact OG-CG1 3.38Å; I61-E63 HydrophobicContact CG2-CB 4.39Å; I61-D76 PolarHBondContact O-N 3.07Å
62	S	82.7	Confident	74.1	Confident	1 Å²	1	68.9 Å²	68.9	1%	0.007	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	133	153.6	75.1	0	0	0	0	109.8	R21 L22 Q25 F74	R21-S62 WeakPolarHBondContact CA-O 3.28Å; L22-S62 PolarHBondContact N-O 2.69Å; L22-S62 PolarHBondContact O-N 3.1Å; Q25-S62 PolarHBondContact NE2-OG 3.23Å; S62-F74 CarbonylContact C-O 3.42Å; S62-F74 WeakPolarHBondContact CA-O 3.29Å; S62-F74 WeakPolarHBondContact CB-O 3.29Å
63	E	88.9	Confident	76.2	Confident	21 Å²	21	63.4 Å²	63.4	10%	0.098	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	128.7	174.1	-171	173.2	172	0	0	111.3	S20 R21 I61 R65 I73 F74	S20-E63 CarbonylContact O-C 3.57Å; S20-E63 VanDerWaalsContact O-CA 3.25Å; S20-E63 WeakPolarHBondContact O-CA 3.28Å; R21-E63 HydrophobicContact CG-CB 4.17Å; R21-E63 HydrophobicContact CG-CG 3.84Å; R21-E63 IonicContact CZ-OE2 3.62Å; R21-E63 IonicContact NE-OE1 3.69Å; R21-E63 IonicContact NE-OE2 3.04Å; R21-E63 PolarHBondContact NE-OE2 3.06Å; R21-E63 IonicContact NH2-OE1 3.79Å; R21-E63 IonicContact NH2-OE2 3.73Å; R21-E63 PolarHBondContact NH2-OE2 2.74Å; I61-E63 HydrophobicContact CG2-CB 4.39Å; E63-R65 VanDerWaalsContact CD-NH2 3.28Å; E63-R65 HydrophobicContact CG-CG 4.1Å; E63-R65 IonicContact OE1-CZ 3.36Å; E63-R65 IonicContact OE1-NE 2.72Å; E63-R65 PolarHBondContact OE1-NE 2.89Å; E63-R65 IonicContact OE1-NH2 3.16Å; E63-R65 PolarHBondContact OE1-NH2 3.04Å; E63-R65 VanDerWaalsContact OE1-NH2 3.16Å; E63-R65 IonicContact OE2-CZ 3.68Å; E63-R65 IonicContact OE2-NE 3.66Å; E63-R65 IonicContact OE2-NH2 2.86Å; E63-R65 PolarHBondContact OE2-NH2 3.39Å; E63-I73 WeakPolarHBondContact O-CA 2.97Å; E63-F74 HydrophobicContact CB-CB 4.34Å; E63-F74 HydrophobicContact CB-CD2 4.27Å; E63-F74 PolarHBondContact N-O 3.22Å; E63-F74 PolarHBondContact O-N 3.29Å
64	V	91.8	Very high	78.3	Confident	42 Å²	42	60.6 Å²	60.6	26%	0.255	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	118.5	172.3	-175.7	0	0	0	0	109.7	S20 F71 I73 Y118	S20-V64 WeakPolarHBondContact CB-O 3.37Å; S20-V64 PolarHBondContact O-N 3.4Å; V64-F71 HydrophobicContact CG1-CE2 3.47Å; V64-F71 VanDerWaalsContact CG1-CE2 3.47Å; V64-F71 HydrophobicContact CG1-CZ 3.63Å; V64-I73 HydrophobicContact CG1-CG1 4.35Å; V64-I73 HydrophobicContact CG2-CG1 4.35Å; V64-I73 HydrophobicContact CG2-CG2 4.49Å; V64-Y118 HydrophobicContact CG2-CD1 3.66Å; V64-Y118 HydrophobicContact CG2-CE1 3.61Å
65	R	91.2	Very high	80.3	Confident	101 Å²	101	58.4 Å²	58.4	38%	0.381	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	136.9	176.7	-62.3	-167.9	-176.4	158.1	11.7	111	E63 F71 V72 F74	E63-R65 VanDerWaalsContact CD-NH2 3.28Å; E63-R65 HydrophobicContact CG-CG 4.1Å; E63-R65 IonicContact OE1-CZ 3.36Å; E63-R65 IonicContact OE1-NE 2.72Å; E63-R65 PolarHBondContact OE1-NE 2.89Å; E63-R65 IonicContact OE1-NH2 3.16Å; E63-R65 PolarHBondContact OE1-NH2 3.04Å; E63-R65 VanDerWaalsContact OE1-NH2 3.16Å; E63-R65 IonicContact OE2-CZ 3.68Å; E63-R65 IonicContact OE2-NE 3.66Å; E63-R65 IonicContact OE2-NH2 2.86Å; E63-R65 PolarHBondContact OE2-NH2 3.39Å; R65-F71 WeakPolarHBondContact O-CD2 3.02Å; R65-V72 HydrophobicContact CB-CB 4.5Å; R65-V72 PolarHBondContact N-O 3.41Å; R65-V72 PolarHBondContact O-N 3.24Å; R65-F74 HydrophobicContact CG-CE2 4.42Å
66	S	90.3	Very high	82	Confident	72 Å²	72	54.8 Å²	54.8	50%	0.503	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	82	-178.1	-165.7	0	0	0	0	107.4	K145	S66-K145 PolarHBondContact OG-NZ 3.33Å
67	D	88.9	Confident	83.8	Confident	75 Å²	75	50.1 Å²	50.1	40%	0.401	24%	0.244	S	C	.	.			trans	-79.3	177.4	-180	-60.5	-28.7	0	0	0	110.3	D69 K70 K145	D67-D69 VanDerWaalsContact C-N 3.35Å; D67-D69 PolarHBondContact O-N 3.04Å; D67-K70 HydrophobicContact CB-CG 4.19Å; D67-K70 PolarHBondContact N-O 2.99Å; D67-K70 WeakPolarHBondContact OD2-CE 3.44Å; D67-K145 VanDerWaalsContact O-CD 3.31Å; D67-K145 WeakPolarHBondContact O-CD 3.3Å; D67-K145 VanDerWaalsContact O-CE 3.28Å; D67-K145 WeakPolarHBondContact O-CE 3.46Å; D67-K145 PolarHBondContact O-NZ 2.86Å
68	R	87.8	Confident	85.6	Confident	208 Å²	208	45.9 Å²	45.9	79%	0.785	22%	0.219	S	C	*	.	S	Bend	trans	-63.1	-42	176.8	-68.3	-176.6	178.9	179.2	-1.2	112.2
69	D	90.9	Very high	87.3	Confident	96 Å²	96	44.9 Å²	44.9	51%	0.513	21%	0.212	S	C	.	.	S	Bend	trans	-100.7	-16.1	-170.5	-53.1	-47.3	0	0	0	113.9	D67 P144 K145 Q147	D67-D69 VanDerWaalsContact C-N 3.35Å; D67-D69 PolarHBondContact O-N 3.04Å; D69-P144 WeakPolarHBondContact O-CA 3.39Å; D69-K145 PolarHBondContact O-N 2.87Å; D69-Q147 PolarHBondContact OD1-NE2 2.69Å
70	K	93.6	Very high	89	Confident	103 Å²	103	44.8 Å²	44.8	45%	0.448	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	156.3	-174.8	65.2	179.4	-178.3	-178.3	0	113.3	D67 V72 G143	D67-K70 HydrophobicContact CB-CG 4.19Å; D67-K70 PolarHBondContact N-O 2.99Å; D67-K70 WeakPolarHBondContact OD2-CE 3.44Å; K70-V72 HydrophobicContact CD-CG2 3.86Å; K70-V72 HydrophobicContact CG-CG2 4.04Å; K70-G143 CarbonylContact C-O 3.59Å; K70-G143 WeakPolarHBondContact CA-O 3.37Å
71	F	94.9	Very high	90.5	Very high	6 Å²	6	46 Å²	46	3%	0.026	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	134.7	169	178.3	-103.1	0	0	0	108.9	V64 R65 I73 L120 P121 V124 S142 G143	V64-F71 HydrophobicContact CG1-CE2 3.47Å; V64-F71 VanDerWaalsContact CG1-CE2 3.47Å; V64-F71 HydrophobicContact CG1-CZ 3.63Å; R65-F71 WeakPolarHBondContact O-CD2 3.02Å; F71-I73 HydrophobicContact CE1-CD1 3.58Å; F71-I73 HydrophobicContact CE1-CG1 3.64Å; F71-I73 HydrophobicContact CZ-CD1 3.99Å; F71-I73 HydrophobicContact CZ-CG1 3.83Å; F71-L120 HydrophobicContact CD1-CD2 4.4Å; F71-L120 HydrophobicContact CE1-CD2 4.44Å; F71-P121 HydrophobicContact CD2-CG 3.74Å; F71-P121 HydrophobicContact CE2-CG 4.05Å; F71-P121 HydrophobicContact CG-CG 4.27Å; F71-V124 HydrophobicContact CB-CG2 3.6Å; F71-V124 HydrophobicContact CG-CG2 4.17Å; F71-S142 CarbonylContact O-C 3.48Å; F71-S142 VanDerWaalsContact O-CA 3.29Å; F71-S142 WeakPolarHBondContact O-CA 3.45Å; F71-G143 PolarHBondContact N-O 3.16Å; F71-G143 PolarHBondContact O-N 2.72Å
72	V	95.7	Very high	91.6	Very high	7 Å²	7	49.2 Å²	49.2	4%	0.042	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	134.9	-176.2	-169.4	0	0	0	0	110.3	R65 K70 F74 T140 F141	R65-V72 HydrophobicContact CB-CB 4.5Å; R65-V72 PolarHBondContact N-O 3.41Å; R65-V72 PolarHBondContact O-N 3.24Å; K70-V72 HydrophobicContact CD-CG2 3.86Å; K70-V72 HydrophobicContact CG-CG2 4.04Å; V72-F74 HydrophobicContact CB-CE2 4.2Å; V72-F74 HydrophobicContact CG1-CD2 4.12Å; V72-F74 HydrophobicContact CG1-CE1 4.08Å; V72-F74 HydrophobicContact CG1-CE2 3.52Å; V72-F74 HydrophobicContact CG1-CZ 3.5Å; V72-T140 HydrophobicContact CG1-CG2 3.93Å; V72-F141 CarbonylContact C-O 3.55Å; V72-F141 VanDerWaalsContact CA-O 3.29Å; V72-F141 WeakPolarHBondContact CA-O 3.42Å
73	I	95	Very high	92.3	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	127.5	170.2	-58.3	160.7	0	0	0	107.2	E63 V64 F71 V94 Y118 T140 F141	E63-I73 WeakPolarHBondContact O-CA 2.97Å; V64-I73 HydrophobicContact CG1-CG1 4.35Å; V64-I73 HydrophobicContact CG2-CG1 4.35Å; V64-I73 HydrophobicContact CG2-CG2 4.49Å; F71-I73 HydrophobicContact CE1-CD1 3.58Å; F71-I73 HydrophobicContact CE1-CG1 3.64Å; F71-I73 HydrophobicContact CZ-CD1 3.99Å; F71-I73 HydrophobicContact CZ-CG1 3.83Å; I73-V94 HydrophobicContact CD1-CB 4.38Å; I73-V94 HydrophobicContact CD1-CG2 4.26Å; I73-Y118 HydrophobicContact CD1-CD1 4.3Å; I73-Y118 HydrophobicContact CD1-CD2 3.69Å; I73-Y118 HydrophobicContact CD1-CE2 4.42Å; I73-Y118 HydrophobicContact CD1-CG 3.61Å; I73-Y118 HydrophobicContact CG1-CG 4.33Å; I73-Y118 HydrophobicContact CG2-CD2 4.19Å; I73-Y118 HydrophobicContact CG2-CE1 4.19Å; I73-Y118 HydrophobicContact CG2-CE2 3.82Å; I73-T140 WeakPolarHBondContact O-CA 3.16Å; I73-F141 HydrophobicContact CB-CB 4.24Å; I73-F141 HydrophobicContact CD1-CD1 3.96Å; I73-F141 HydrophobicContact CD1-CG 4.5Å; I73-F141 PolarHBondContact N-O 2.98Å; I73-F141 PolarHBondContact O-N 3.3Å
74	F	93.4	Very high	92.6	Very high	56 Å²	56	58.6 Å²	58.6	25%	0.246	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	128.7	166.5	-59.4	-81.5	0	0	0	107.7	S62 E63 R65 V72 M138 L139 T140	S62-F74 CarbonylContact C-O 3.42Å; S62-F74 WeakPolarHBondContact CA-O 3.29Å; S62-F74 WeakPolarHBondContact CB-O 3.29Å; E63-F74 HydrophobicContact CB-CB 4.34Å; E63-F74 HydrophobicContact CB-CD2 4.27Å; E63-F74 PolarHBondContact N-O 3.22Å; E63-F74 PolarHBondContact O-N 3.29Å; R65-F74 HydrophobicContact CG-CE2 4.42Å; V72-F74 HydrophobicContact CB-CE2 4.2Å; V72-F74 HydrophobicContact CG1-CD2 4.12Å; V72-F74 HydrophobicContact CG1-CE1 4.08Å; V72-F74 HydrophobicContact CG1-CE2 3.52Å; V72-F74 HydrophobicContact CG1-CZ 3.5Å; F74-M138 HydrophobicContact CB-SD 3.95Å; F74-M138 HydrophobicContact CD1-CG 4.42Å; F74-L139 CarbonylContact C-O 3.46Å; F74-L139 WeakPolarHBondContact CA-O 3.35Å; F74-T140 HydrophobicContact CD1-CG2 4.15Å; F74-T140 HydrophobicContact CE1-CG2 3.84Å
75	L	93.2	Very high	92.9	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	116.4	-179.9	-179	63.5	0	0	0	109.5	V77 I96 F114 M138 L139	L75-V77 HydrophobicContact CD2-CG1 3.92Å; L75-V77 HydrophobicContact CG-CG1 3.82Å; L75-V77 PolarHBondContact O-N 3.31Å; L75-I96 HydrophobicContact CD2-CB 4.28Å; L75-I96 HydrophobicContact CD2-CD1 3.77Å; L75-I96 HydrophobicContact CD2-CG2 3.94Å; L75-F114 HydrophobicContact CD2-CE2 3.93Å; L75-F114 HydrophobicContact CD2-CZ 4.16Å; L75-M138 VanDerWaalsContact C-SD 3.51Å; L75-L139 HydrophobicContact CB-CB 4.47Å; L75-L139 HydrophobicContact CB-CD2 4.43Å; L75-L139 PolarHBondContact N-O 3.44Å; L75-L139 WeakPolarHBondContact O-CB 3.26Å; L75-L139 PolarHBondContact O-N 2.87Å
76	D	90.6	Very high	93.2	Very high	13 Å²	13	55.5 Å²	55.5	7%	0.07	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	119.7	170.6	-176.5	-1.1	0	0	0	109.9	F27 G60 I61 K78 M138	F27-D76 WeakPolarHBondContact CE2-O 3.24Å; G60-D76 WeakPolarHBondContact CA-OD2 3.46Å; I61-D76 PolarHBondContact O-N 3.07Å; D76-K78 VanDerWaalsContact OD1-CB 3.31Å; D76-K78 WeakPolarHBondContact OD1-CB 3.27Å; D76-K78 WeakPolarHBondContact OD1-CG 3.43Å; D76-K78 PolarHBondContact OD1-N 2.81Å; D76-M138 HydrophobicContact CB-CE 4.16Å
77	V	92.7	Very high	93.6	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	27%	0.269	C	S	.	.			trans	-131.7	30.4	176.3	-61.7	0	0	0	0	110.7	L75 H79 F80 L85 F114 L133 G137 L139	L75-V77 HydrophobicContact CD2-CG1 3.92Å; L75-V77 HydrophobicContact CG-CG1 3.82Å; L75-V77 PolarHBondContact O-N 3.31Å; V77-H79 PolarHBondContact O-N 2.94Å; V77-F80 HydrophobicContact CB-CD2 4.26Å; V77-F80 PolarHBondContact O-N 2.78Å; V77-L85 HydrophobicContact CB-CD1 4.32Å; V77-L85 HydrophobicContact CB-CD2 4.22Å; V77-L85 HydrophobicContact CG1-CD2 4.22Å; V77-L85 HydrophobicContact CG2-CD1 3.73Å; V77-L85 HydrophobicContact CG2-CD2 4.46Å; V77-F114 HydrophobicContact CG1-CE1 3.97Å; V77-F114 HydrophobicContact CG1-CZ 3.67Å; V77-L133 HydrophobicContact CG2-CD1 3.51Å; V77-G137 CarbonylContact C-O 3.6Å; V77-G137 VanDerWaalsContact CG2-O 3.26Å; V77-G137 WeakPolarHBondContact CG2-O 3.38Å; V77-G137 PolarHBondContact N-O 2.84Å; V77-L139 HydrophobicContact CG1-CB 4.34Å; V77-L139 HydrophobicContact CG2-CB 3.67Å; V77-L139 HydrophobicContact CG2-CD1 4.49Å
78	K	89.9	Confident	93.9	Very high	67 Å²	67	56.9 Å²	56.9	29%	0.291	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.5	-21.2	-175.9	69	-175.1	-177.7	173	0	115.6	E29 D58 D76 G137	E29-K78 IonicContact OE1-NZ 2.81Å; E29-K78 PolarHBondContact OE1-NZ 3.49Å; D58-K78 IonicContact OD1-NZ 2.92Å; D58-K78 PolarHBondContact OD1-NZ 2.81Å; D76-K78 VanDerWaalsContact OD1-CB 3.31Å; D76-K78 WeakPolarHBondContact OD1-CB 3.27Å; D76-K78 WeakPolarHBondContact OD1-CG 3.43Å; D76-K78 PolarHBondContact OD1-N 2.81Å; K78-G137 PolarHBondContact N-O 3.49Å
79	H	90.3	Very high	94.3	Very high	29 Å²	29	49.6 Å²	49.6	13%	0.134	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	1.6	177.4	-54.6	-61.6	0	0	0	114.5	E29 V77 H100 R103	E29-H79 IonicContact OE1-CE1 3.96Å; E29-H79 IonicContact OE1-NE2 2.87Å; V77-H79 PolarHBondContact O-N 2.94Å; H79-H100 PolarHBondContact O-CD2 3.32Å; H79-R103 PolarHBondContact O-NH1 3.4Å; H79-R103 PolarHBondContact O-NH2 3.45Å
80	F	93	Very high	94.4	Very high	11 Å²	11	50 Å²	50	5%	0.048	25%	0.253	C	S	.	.	S	Bend	trans	-120.7	136.9	-177.5	-61.5	-90.9	0	0	0	110.4	F27 V77 D84 L85 G98 H100 R112 F114	F27-F80 HydrophobicContact CB-CE2 4.29Å; F27-F80 AromaticContact CD2-CE2 3.89Å; F27-F80 HydrophobicContact CD2-CE2 3.89Å; F27-F80 HydrophobicContact CE2-CE2 4.38Å; F27-F80 HydrophobicContact CG-CE2 4.01Å; V77-F80 HydrophobicContact CB-CD2 4.26Å; V77-F80 PolarHBondContact O-N 2.78Å; F80-D84 HydrophobicContact CB-CB 4.35Å; F80-D84 HydrophobicContact CD1-CB 4.23Å; F80-L85 HydrophobicContact CB-CD1 4.18Å; F80-L85 HydrophobicContact CB-CD2 3.72Å; F80-L85 HydrophobicContact CB-CG 3.8Å; F80-L85 HydrophobicContact CG-CD2 4.1Å; F80-G98 VanDerWaalsContact CE1-C 3.41Å; F80-H100 AromaticContact CD1-CD2 3.84Å; F80-H100 AromaticContact CE1-CD2 3.76Å; F80-R112 HydrophobicContact CE1-CB 3.93Å; F80-R112 HydrophobicContact CE2-CB 4.46Å; F80-R112 HydrophobicContact CZ-CB 3.55Å; F80-F114 HydrophobicContact CD2-CD1 4.14Å; F80-F114 AromaticContact CD2-CE1 3.75Å; F80-F114 HydrophobicContact CD2-CE1 3.75Å; F80-F114 HydrophobicContact CE1-CD1 4.17Å; F80-F114 HydrophobicContact CE1-CE1 4.38Å; F80-F114 AromaticContact CE2-CD1 3.47Å; F80-F114 HydrophobicContact CE2-CD1 3.47Å; F80-F114 VanDerWaalsContact CE2-CD1 3.47Å; F80-F114 AromaticContact CE2-CE1 3.58Å; F80-F114 HydrophobicContact CE2-CE1 3.58Å; F80-F114 HydrophobicContact CG-CE1 4.24Å; F80-F114 AromaticContact CZ-CD1 3.49Å; F80-F114 HydrophobicContact CZ-CD1 3.49Å; F80-F114 VanDerWaalsContact CZ-CD1 3.49Å; F80-F114 AromaticContact CZ-CE1 3.92Å; F80-F114 HydrophobicContact CZ-CE1 3.92Å
81	S	93.3	Very high	94.4	Very high	27 Å²	27	51 Å²	51	19%	0.189	26%	0.264	C	S	.	.			trans	-76	161.8	169.2	64.2	0	0	0	0	109.8	E83 D84 L85	S81-E83 PolarHBondContact O-N 2.86Å; S81-E83 VanDerWaalsContact O-N 3.16Å; S81-E83 WeakPolarHBondContact OG-CG 3.16Å; S81-D84 PolarHBondContact O-N 3.35Å; S81-D84 VanDerWaalsContact O-N 3.08Å; S81-D84 PolarHBondContact OG-N 3.35Å; S81-D84 PolarHBondContact OG-OD2 2.79Å; S81-L85 WeakPolarHBondContact O-CG 3.37Å; S81-L85 PolarHBondContact O-N 3.42Å
82	P	95.9	Very high	94.2	Very high	99 Å²	99	54.4 Å²	54.4	64%	0.643	28%	0.282	S	S	*	.	G	3₁₀ helix	trans	-55.5	-32.1	175.8	-19.6	25.4	0	0	0	113.8	L85 L133	P82-L85 PolarHBondContact O-N 2.82Å; P82-L133 HydrophobicContact CB-CD2 4.42Å; P82-L133 HydrophobicContact CG-CD2 3.98Å
83	E	96.5	Very high	94.2	Very high	175 Å²	175	56.6 Å²	56.6	82%	0.818	29%	0.291	S	S	*	.	G	3₁₀ helix	trans	-76.5	-24.2	-180	53.3	-162.8	-177.6	0	0	113.3	S81 L85	S81-E83 PolarHBondContact O-N 2.86Å; S81-E83 VanDerWaalsContact O-N 3.16Å; S81-E83 WeakPolarHBondContact OG-CG 3.16Å; E83-L85 VanDerWaalsContact C-N 3.29Å
84	D	96.3	Very high	94.2	Very high	44 Å²	44	56.6 Å²	56.6	24%	0.235	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-83.1	-5	173.6	-67.3	-32.3	0	0	0	112.7	F80 S81 G98 K99 H100	F80-D84 HydrophobicContact CB-CB 4.35Å; F80-D84 HydrophobicContact CD1-CB 4.23Å; S81-D84 PolarHBondContact O-N 3.35Å; S81-D84 VanDerWaalsContact O-N 3.08Å; S81-D84 PolarHBondContact OG-N 3.35Å; S81-D84 PolarHBondContact OG-OD2 2.79Å; D84-G98 WeakPolarHBondContact O-CA 3.4Å; D84-K99 WeakPolarHBondContact CB-O 3.11Å; D84-K99 PolarHBondContact O-N 3.08Å; D84-H100 HydrophobicContact CB-CB 4.2Å; D84-H100 VanDerWaalsContact CG-CB 3.5Å; D84-H100 WeakPolarHBondContact OD2-CB 3.35Å
85	L	97.5	Very high	94.4	Very high	23 Å²	23	56.7 Å²	56.7	12%	0.12	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	135.4	-174.8	-68.2	168.5	0	0	0	111.9	V77 F80 S81 P82 E83 H97 F114 L133 L139	V77-L85 HydrophobicContact CB-CD1 4.32Å; V77-L85 HydrophobicContact CB-CD2 4.22Å; V77-L85 HydrophobicContact CG1-CD2 4.22Å; V77-L85 HydrophobicContact CG2-CD1 3.73Å; V77-L85 HydrophobicContact CG2-CD2 4.46Å; F80-L85 HydrophobicContact CB-CD1 4.18Å; F80-L85 HydrophobicContact CB-CD2 3.72Å; F80-L85 HydrophobicContact CB-CG 3.8Å; F80-L85 HydrophobicContact CG-CD2 4.1Å; S81-L85 WeakPolarHBondContact O-CG 3.37Å; S81-L85 PolarHBondContact O-N 3.42Å; P82-L85 PolarHBondContact O-N 2.82Å; E83-L85 VanDerWaalsContact C-N 3.29Å; L85-H97 CarbonylContact C-O 3.58Å; L85-F114 HydrophobicContact CD2-CE1 4.01Å; L85-F114 HydrophobicContact CD2-CZ 3.99Å; L85-L133 HydrophobicContact CD1-CD2 3.97Å; L85-L139 HydrophobicContact CD1-CD1 4.21Å
86	T	97.9	Very high	94.5	Very high	54 Å²	54	56.7 Å²	56.7	33%	0.331	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	123.8	175.3	-66.8	0	0	0	0	109.4	K88 I96 H97	T86-K88 HydrophobicContact CG2-CD 3.98Å; T86-K88 VanDerWaalsContact CG2-CE 3.43Å; T86-K88 HydrophobicContact CG2-CG 3.96Å; T86-I96 WeakPolarHBondContact O-CA 3.43Å; T86-H97 PolarHBondContact N-O 3.47Å; T86-H97 PolarHBondContact O-N 2.74Å
87	V	97.5	Very high	94.8	Very high	51 Å²	51	58.5 Å²	58.5	31%	0.309	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	125.2	175.4	-175.5	0	0	0	0	108.9	V94 E95 I96 L139 F141	V87-V94 HydrophobicContact CG1-CG1 3.98Å; V87-E95 CarbonylContact C-O 3.6Å; V87-E95 WeakPolarHBondContact CA-O 3.36Å; V87-I96 HydrophobicContact CG1-CG1 4.26Å; V87-I96 HydrophobicContact CG2-CG1 4.26Å; V87-I96 HydrophobicContact CG2-CG2 4.29Å; V87-L139 HydrophobicContact CG2-CD1 4.1Å; V87-F141 HydrophobicContact CG1-CD2 3.92Å; V87-F141 HydrophobicContact CG1-CE2 4.14Å
88	K	96.6	Very high	95	Very high	126 Å²	126	58.5 Å²	58.5	55%	0.548	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	153.3	-179	-67.8	174.6	179.1	166.4	0	110.3	T86 V94 E95	T86-K88 HydrophobicContact CG2-CD 3.98Å; T86-K88 VanDerWaalsContact CG2-CE 3.43Å; T86-K88 HydrophobicContact CG2-CG 3.96Å; K88-V94 CarbonylContact O-C 3.59Å; K88-V94 WeakPolarHBondContact O-CA 3.46Å; K88-E95 PolarHBondContact N-O 3.39Å; K88-E95 PolarHBondContact O-N 2.99Å
89	V	95.9	Very high	95.3	Very high	54 Å²	54	59.9 Å²	59.9	33%	0.327	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	123.2	168.9	177.7	0	0	0	0	108.6	F93 V94 L120 L129 F141	V89-F93 CarbonylContact C-O 3.38Å; V89-F93 VanDerWaalsContact CA-O 3.28Å; V89-F93 WeakPolarHBondContact CA-O 3.38Å; V89-V94 HydrophobicContact CG2-CG2 4.33Å; V89-L120 HydrophobicContact CG1-CD1 3.59Å; V89-L120 HydrophobicContact CG2-CD1 4.32Å; V89-L129 HydrophobicContact CG2-CD1 3.66Å; V89-F141 HydrophobicContact CG2-CE2 4.41Å; V89-F141 HydrophobicContact CG2-CZ 4.23Å
90	Q	93.7	Very high	95.5	Very high	105 Å²	105	58.9 Å²	58.9	49%	0.491	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	134.4	-179.6	-177.3	172.8	-1.4	0	0	109.7	D92 F93	Q90-D92 VanDerWaalsContact C-N 3.32Å; Q90-D92 PolarHBondContact O-N 2.79Å; Q90-F93 PolarHBondContact N-O 2.76Å; Q90-F93 WeakPolarHBondContact O-CA 3.46Å; Q90-F93 WeakPolarHBondContact O-CB 3.44Å; Q90-F93 PolarHBondContact O-N 3.38Å
91	D	91.9	Very high	95.6	Very high	125 Å²	125	64.5 Å²	64.5	67%	0.668	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.8	43.8	173.4	-56.2	-38	0	0	0	114.5	F93	D91-F93 WeakPolarHBondContact O-CD2 3.45Å; D91-F93 WeakPolarHBondContact O-CE2 3.34Å; D91-F93 PolarHBondContact O-N 2.73Å
92	D	91.8	Very high	95.7	Very high	77 Å²	77	69.6 Å²	69.6	41%	0.412	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.8	21.5	-174.1	-54.3	-42.5	0	0	0	114.9	Q90 L120 Q126	Q90-D92 VanDerWaalsContact C-N 3.32Å; Q90-D92 PolarHBondContact O-N 2.79Å; D92-L120 WeakPolarHBondContact O-CB 3.44Å; D92-L120 PolarHBondContact O-N 3.13Å; D92-Q126 PolarHBondContact OD1-NE2 2.47Å
93	F	95.2	Very high	95.5	Very high	53 Å²	53	69.5 Å²	69.5	23%	0.232	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	139.7	173	-66.3	-87.8	0	0	0	112.4	V89 Q90 D91 R117 Y118 R119	V89-F93 CarbonylContact C-O 3.38Å; V89-F93 VanDerWaalsContact CA-O 3.28Å; V89-F93 WeakPolarHBondContact CA-O 3.38Å; Q90-F93 PolarHBondContact N-O 2.76Å; Q90-F93 WeakPolarHBondContact O-CA 3.46Å; Q90-F93 WeakPolarHBondContact O-CB 3.44Å; Q90-F93 PolarHBondContact O-N 3.38Å; D91-F93 WeakPolarHBondContact O-CD2 3.45Å; D91-F93 WeakPolarHBondContact O-CE2 3.34Å; D91-F93 PolarHBondContact O-N 2.73Å; F93-R117 HydrophobicContact CB-CG 3.6Å; F93-R117 HydrophobicContact CD1-CG 3.59Å; F93-R117 HydrophobicContact CG-CG 3.82Å; F93-Y118 CarbonylContact C-O 3.59Å; F93-Y118 WeakPolarHBondContact CA-O 3.19Å; F93-R119 HydrophobicContact CD1-CB 4Å; F93-R119 HydrophobicContact CE1-CB 3.74Å; F93-R119 HydrophobicContact CE1-CG 4.12Å; F93-R119 HydrophobicContact CZ-CG 4.47Å
94	V	95.9	Very high	95.2	Very high	0 Å²	0	68.2 Å²	68.2	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	120.4	161.3	-171.6	0	0	0	0	107.7	I73 V87 K88 V89 I96 R117 Y118 L120 F141	I73-V94 HydrophobicContact CD1-CB 4.38Å; I73-V94 HydrophobicContact CD1-CG2 4.26Å; V87-V94 HydrophobicContact CG1-CG1 3.98Å; K88-V94 CarbonylContact O-C 3.59Å; K88-V94 WeakPolarHBondContact O-CA 3.46Å; V89-V94 HydrophobicContact CG2-CG2 4.33Å; V94-I96 HydrophobicContact CG1-CD1 4.46Å; V94-I96 HydrophobicContact CG1-CG1 4.08Å; V94-R117 CarbonylContact O-C 3.58Å; V94-R117 VanDerWaalsContact O-CA 3.3Å; V94-R117 WeakPolarHBondContact O-CA 3.31Å; V94-Y118 PolarHBondContact N-O 3.18Å; V94-Y118 PolarHBondContact O-N 2.92Å; V94-L120 HydrophobicContact CG2-CD1 3.56Å; V94-L120 HydrophobicContact CG2-CD2 3.76Å; V94-L120 HydrophobicContact CG2-CG 3.61Å; V94-F141 HydrophobicContact CB-CZ 4.37Å; V94-F141 HydrophobicContact CG1-CD1 4.47Å; V94-F141 HydrophobicContact CG1-CD2 3.9Å; V94-F141 HydrophobicContact CG1-CE1 4.36Å; V94-F141 HydrophobicContact CG1-CE2 3.75Å; V94-F141 HydrophobicContact CG1-CG 4.24Å; V94-F141 HydrophobicContact CG1-CZ 3.98Å; V94-F141 HydrophobicContact CG2-CD1 4.1Å; V94-F141 HydrophobicContact CG2-CE1 3.45Å; V94-F141 VanDerWaalsContact CG2-CE1 3.45Å; V94-F141 HydrophobicContact CG2-CE2 4.06Å; V94-F141 HydrophobicContact CG2-CZ 3.4Å
95	E	96.4	Very high	94.7	Very high	57 Å²	57	68.3 Å²	68.3	27%	0.266	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	121.1	174.7	-60.3	-165.4	162.6	0	0	109.2	V87 K88 R116 R117	V87-E95 CarbonylContact C-O 3.6Å; V87-E95 WeakPolarHBondContact CA-O 3.36Å; K88-E95 PolarHBondContact N-O 3.39Å; K88-E95 PolarHBondContact O-N 2.99Å; E95-R116 CarbonylContact C-O 3.58Å; E95-R116 WeakPolarHBondContact CA-O 3.26Å; E95-R117 HydrophobicContact CG-CG 3.91Å; E95-R117 WeakPolarHBondContact OE1-CD 3.47Å; E95-R117 IonicContact OE1-CZ 3.93Å; E95-R117 IonicContact OE1-NE 3.94Å; E95-R117 IonicContact OE1-NH1 3.07Å; E95-R117 PolarHBondContact OE1-NH1 3.46Å
96	I	96.6	Very high	94.1	Very high	1 Å²	1	74.8 Å²	74.8	1%	0.005	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	117	176.7	-54.4	174.1	0	0	0	107	L75 T86 V87 V94 F114 R116 Y118 L139	L75-I96 HydrophobicContact CD2-CB 4.28Å; L75-I96 HydrophobicContact CD2-CD1 3.77Å; L75-I96 HydrophobicContact CD2-CG2 3.94Å; T86-I96 WeakPolarHBondContact O-CA 3.43Å; V87-I96 HydrophobicContact CG1-CG1 4.26Å; V87-I96 HydrophobicContact CG2-CG1 4.26Å; V87-I96 HydrophobicContact CG2-CG2 4.29Å; V94-I96 HydrophobicContact CG1-CD1 4.46Å; V94-I96 HydrophobicContact CG1-CG1 4.08Å; I96-F114 HydrophobicContact CB-CE2 4.24Å; I96-F114 HydrophobicContact CG2-CE2 3.72Å; I96-F114 HydrophobicContact CG2-CZ 3.78Å; I96-F114 WeakPolarHBondContact O-CE2 3.35Å; I96-R116 HydrophobicContact CB-CB 4.47Å; I96-R116 PolarHBondContact N-O 3.01Å; I96-R116 PolarHBondContact O-N 3.19Å; I96-Y118 HydrophobicContact CD1-CD2 4.35Å; I96-Y118 HydrophobicContact CD1-CE2 4.03Å; I96-L139 HydrophobicContact CD1-CD2 3.76Å; I96-L139 HydrophobicContact CG2-CD1 4.47Å
97	H	97	Very high	93.4	Very high	51 Å²	51	78.9 Å²	78.9	24%	0.236	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	126.5	176.2	174.8	-140.2	0	0	0	108.5	L85 T86 E113 F114 H115	L85-H97 CarbonylContact C-O 3.58Å; T86-H97 PolarHBondContact N-O 3.47Å; T86-H97 PolarHBondContact O-N 2.74Å; H97-E113 IonicContact CD2-OE1 2.85Å; H97-E113 IonicContact CE1-OE1 3.89Å; H97-E113 IonicContact NE2-OE1 3.91Å; H97-E113 PolarHBondContact NE2-OE1 2.83Å; H97-F114 WeakPolarHBondContact CA-O 3.15Å; H97-F114 PolarHBondContact CD2-O 3.05Å; H97-F114 VanDerWaalsContact CD2-O 3.24Å; H97-H115 AromaticContact CD2-CD2 3.83Å; H97-H115 AromaticContact CD2-CE1 3.01Å; H97-H115 PolarHBondContact CD2-CE1 2.85Å; H97-H115 AromaticContact CD2-CG 3.93Å; H97-H115 AromaticContact CD2-ND1 3.46Å; H97-H115 PolarHBondContact CD2-ND1 2.85Å; H97-H115 AromaticContact CD2-NE2 3.25Å; H97-H115 PolarHBondContact CD2-NE2 2.87Å; H97-H115 VanDerWaalsContact CD2-NE2 3.25Å; H97-H115 AromaticContact CE1-CE1 3.86Å; H97-H115 AromaticContact CG-CE1 3.62Å; H97-H115 AromaticContact CG-ND1 3.89Å; H97-H115 AromaticContact NE2-CE1 3.19Å; H97-H115 PolarHBondContact NE2-CE1 2.84Å; H97-H115 AromaticContact NE2-NE2 3.22Å; H97-H115 PolarHBondContact NE2-NE2 3.22Å
98	G	95.9	Very high	93	Very high	0 Å²	0	77.9 Å²	77.9	0%	0	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	131.4	169.1	0	0	0	0	0	109.2	F80 D84 E113 F114	F80-G98 VanDerWaalsContact CE1-C 3.41Å; D84-G98 WeakPolarHBondContact O-CA 3.4Å; G98-E113 CarbonylContact O-C 3.52Å; G98-E113 VanDerWaalsContact O-CA 3.23Å; G98-E113 WeakPolarHBondContact O-CA 2.77Å; G98-F114 PolarHBondContact N-O 3.24Å; G98-F114 PolarHBondContact O-N 2.92Å
99	K	96.8	Very high	92.7	Very high	96 Å²	96	79.3 Å²	79.3	42%	0.417	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	122.6	176.6	-177.5	177	-175	136.1	0	110.7	D84 R112 E113	D84-K99 WeakPolarHBondContact CB-O 3.11Å; D84-K99 PolarHBondContact O-N 3.08Å; K99-R112 WeakPolarHBondContact CA-O 3.29Å; K99-E113 HydrophobicContact CB-CB 4.48Å; K99-E113 HydrophobicContact CB-CG 4.18Å; K99-E113 HydrophobicContact CD-CG 4.37Å; K99-E113 WeakPolarHBondContact CE-OE2 3.31Å; K99-E113 HydrophobicContact CG-CB 4.26Å; K99-E113 HydrophobicContact CG-CG 4.19Å; K99-E113 IonicContact NZ-OE1 4Å; K99-E113 IonicContact NZ-OE2 2.75Å; K99-E113 PolarHBondContact NZ-OE2 2.91Å
100	H	94.4	Very high	92.5	Very high	7 Å²	7	78.1 Å²	78.1	3%	0.032	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	142.6	170.2	77.8	73.8	0	0	0	110.4	H79 F80 D84 I110 R112	H79-H100 PolarHBondContact O-CD2 3.32Å; F80-H100 AromaticContact CD1-CD2 3.84Å; F80-H100 AromaticContact CE1-CD2 3.76Å; D84-H100 HydrophobicContact CB-CB 4.2Å; D84-H100 VanDerWaalsContact CG-CB 3.5Å; D84-H100 WeakPolarHBondContact OD2-CB 3.35Å; H100-I110 PolarHBondContact CE1-O 3.27Å; H100-R112 PolarHBondContact N-O 2.86Å; H100-R112 WeakPolarHBondContact NE2-CB 3.35Å; H100-R112 WeakPolarHBondContact NE2-CD 3.49Å; H100-R112 VanDerWaalsContact NE2-CG 3.33Å; H100-R112 WeakPolarHBondContact NE2-CG 3.09Å; H100-R112 PolarHBondContact NE2-NH1 2.9Å; H100-R112 PolarHBondContact O-N 2.8Å
101	N	94.6	Very high	92.4	Very high	130 Å²	130	76.8 Å²	76.8	70%	0.695	38%	0.381	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70	175.1	176	-68.9	-40.5	0	0	0	111.2	R103	N101-R103 PolarHBondContact O-N 3.01Å
102	E	94.9	Very high	92.4	Very high	134 Å²	134	71.8 Å²	71.8	63%	0.626	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-57.2	126.1	177.4	-171.2	173.4	84	0	0	111.2	Y109 I110	E102-Y109 HydrophobicContact CG-CD1 4.18Å; E102-Y109 HydrophobicContact CG-CG 4.29Å; E102-I110 WeakPolarHBondContact CA-O 3.29Å
103	R	92.3	Very high	92.6	Very high	97 Å²	97	72.5 Å²	72.5	37%	0.366	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	157.6	174.1	67.7	-176.9	-170.6	-151.8	-2.6	109.8	H79 N101 Y109 I110	H79-R103 PolarHBondContact O-NH1 3.4Å; H79-R103 PolarHBondContact O-NH2 3.45Å; N101-R103 PolarHBondContact O-N 3.01Å; R103-Y109 CarbonylContact O-C 3.57Å; R103-Y109 WeakPolarHBondContact O-CA 3.19Å; R103-I110 PolarHBondContact N-O 2.81Å; R103-I110 PolarHBondContact O-N 3.25Å
104	Q	91	Very high	92.5	Very high	148 Å²	148	70.7 Å²	70.7	69%	0.692	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.2	135.2	178.1	-166.6	175.2	-3.9	0	0	110.8	G108 Y109	Q104-G108 CarbonylContact C-O 3.59Å; Q104-G108 VanDerWaalsContact CA-O 3.25Å; Q104-G108 WeakPolarHBondContact CA-O 3.24Å; Q104-G108 WeakPolarHBondContact CG-O 2.87Å; Q104-Y109 HydrophobicContact CB-CD1 4.26Å; Q104-Y109 HydrophobicContact CB-CE1 4.08Å; Q104-Y109 HydrophobicContact CG-CE1 4.47Å
105	D	85.4	Confident	92.4	Very high	45 Å²	45	76.9 Å²	76.9	24%	0.241	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	-175.3	169.5	75.4	-1.1	0	0	0	111.1	H107 G108 I110	D105-H107 PolarHBondContact O-N 2.68Å; D105-H107 VanDerWaalsContact O-N 3.12Å; D105-H107 PolarHBondContact OD1-N 3.25Å; D105-G108 PolarHBondContact N-O 3.38Å; D105-G108 PolarHBondContact O-N 2.8Å; D105-G108 PolarHBondContact OD1-N 3.01Å; D105-I110 HydrophobicContact CB-CG2 3.7Å; D105-I110 VanDerWaalsContact OD2-CG2 3.24Å; D105-I110 WeakPolarHBondContact OD2-CG2 3.42Å
106	D	84.4	Confident	92.3	Very high	160 Å²	160	78.2 Å²	78.2	86%	0.856	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-20.2	-177.7	-62.5	-27.9	0	0	0	113.6
107	H	83.1	Confident	92.1	Very high	140 Å²	140	85.2 Å²	85.2	65%	0.648	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.1	7.2	-173.6	-56.1	94.3	0	0	0	113.2	D105	D105-H107 PolarHBondContact O-N 2.68Å; D105-H107 VanDerWaalsContact O-N 3.12Å; D105-H107 PolarHBondContact OD1-N 3.25Å
108	G	89.7	Confident	92	Very high	30 Å²	30	83.5 Å²	83.5	31%	0.309	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	133.8	-118	-179.3	0	0	0	0	0	111.6	Q104 D105	Q104-G108 CarbonylContact C-O 3.59Å; Q104-G108 VanDerWaalsContact CA-O 3.25Å; Q104-G108 WeakPolarHBondContact CA-O 3.24Å; Q104-G108 WeakPolarHBondContact CG-O 2.87Å; D105-G108 PolarHBondContact N-O 3.38Å; D105-G108 PolarHBondContact O-N 2.8Å; D105-G108 PolarHBondContact OD1-N 3.01Å
109	Y	90.5	Very high	91.8	Very high	155 Å²	155	91.6 Å²	91.6	61%	0.608	43%	0.425	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.5	140.7	-177.4	-69	-87.2	0	0	0	110.4	E102 R103 Q104	E102-Y109 HydrophobicContact CG-CD1 4.18Å; E102-Y109 HydrophobicContact CG-CG 4.29Å; R103-Y109 CarbonylContact O-C 3.57Å; R103-Y109 WeakPolarHBondContact O-CA 3.19Å; Q104-Y109 HydrophobicContact CB-CD1 4.26Å; Q104-Y109 HydrophobicContact CB-CE1 4.08Å; Q104-Y109 HydrophobicContact CG-CE1 4.47Å
110	I	90.4	Very high	91.7	Very high	30 Å²	30	87.3 Å²	87.3	15%	0.154	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	137.8	-175.9	-170.5	145	0	0	0	112.5	G28 H100 E102 R103 D105 R112	G28-I110 WeakPolarHBondContact O-CD1 3.36Å; H100-I110 PolarHBondContact CE1-O 3.27Å; E102-I110 WeakPolarHBondContact CA-O 3.29Å; R103-I110 PolarHBondContact N-O 2.81Å; R103-I110 PolarHBondContact O-N 3.25Å; D105-I110 HydrophobicContact CB-CG2 3.7Å; D105-I110 VanDerWaalsContact OD2-CG2 3.24Å; D105-I110 WeakPolarHBondContact OD2-CG2 3.42Å; I110-R112 HydrophobicContact CG1-CG 4.09Å
111	S	92.9	Very high	91.6	Very high	76 Å²	76	88.5 Å²	88.5	53%	0.531	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	145.6	166.6	58.9	0	0	0	0	108.9
112	R	92.3	Very high	91.4	Very high	21 Å²	21	88.2 Å²	88.2	8%	0.079	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	143.3	-179.9	-58.4	179.4	171.6	81	1.5	110.6	F27 G28 F80 K99 H100 I110	F27-R112 WeakPolarHBondContact O-CD 3.41Å; F27-R112 VanDerWaalsContact O-CG 3.26Å; F27-R112 WeakPolarHBondContact O-CG 3.33Å; F27-R112 PolarHBondContact O-NE 3.21Å; G28-R112 PolarHBondContact O-NH2 2.96Å; F80-R112 HydrophobicContact CE1-CB 3.93Å; F80-R112 HydrophobicContact CE2-CB 4.46Å; F80-R112 HydrophobicContact CZ-CB 3.55Å; K99-R112 WeakPolarHBondContact CA-O 3.29Å; H100-R112 PolarHBondContact N-O 2.86Å; H100-R112 WeakPolarHBondContact NE2-CB 3.35Å; H100-R112 WeakPolarHBondContact NE2-CD 3.49Å; H100-R112 VanDerWaalsContact NE2-CG 3.33Å; H100-R112 WeakPolarHBondContact NE2-CG 3.09Å; H100-R112 PolarHBondContact NE2-NH1 2.9Å; H100-R112 PolarHBondContact O-N 2.8Å; I110-R112 HydrophobicContact CG1-CG 4.09Å
113	E	94.9	Very high	91.2	Very high	92 Å²	92	83.9 Å²	83.9	43%	0.43	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	136.1	173.2	-178.4	165.1	-172	0	0	110.3	H97 G98 K99 H115	H97-E113 IonicContact CD2-OE1 2.85Å; H97-E113 IonicContact CE1-OE1 3.89Å; H97-E113 IonicContact NE2-OE1 3.91Å; H97-E113 PolarHBondContact NE2-OE1 2.83Å; G98-E113 CarbonylContact O-C 3.52Å; G98-E113 VanDerWaalsContact O-CA 3.23Å; G98-E113 WeakPolarHBondContact O-CA 2.77Å; K99-E113 HydrophobicContact CB-CB 4.48Å; K99-E113 HydrophobicContact CB-CG 4.18Å; K99-E113 HydrophobicContact CD-CG 4.37Å; K99-E113 WeakPolarHBondContact CE-OE2 3.31Å; K99-E113 HydrophobicContact CG-CB 4.26Å; K99-E113 HydrophobicContact CG-CG 4.19Å; K99-E113 IonicContact NZ-OE1 4Å; K99-E113 IonicContact NZ-OE2 2.75Å; K99-E113 PolarHBondContact NZ-OE2 2.91Å; E113-H115 IonicContact OE1-CD2 2.87Å; E113-H115 IonicContact OE1-CE1 3.66Å; E113-H115 IonicContact OE1-NE2 3.3Å; E113-H115 PolarHBondContact OE1-NE2 3.25Å
114	F	93.3	Very high	91.3	Very high	14 Å²	14	79.6 Å²	79.6	6%	0.061	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	147.9	171.4	79.2	-93.6	0	0	0	112.7	F27 L75 V77 F80 L85 I96 H97 G98 R116	F27-F114 HydrophobicContact CD1-CB 3.6Å; F27-F114 HydrophobicContact CD1-CD1 4.09Å; F27-F114 HydrophobicContact CD1-CG 4.06Å; F27-F114 HydrophobicContact CE1-CB 3.16Å; F27-F114 AromaticContact CE1-CD1 3.69Å; F27-F114 HydrophobicContact CE1-CD1 3.69Å; F27-F114 HydrophobicContact CE1-CD2 4.07Å; F27-F114 AromaticContact CE1-CG 3.37Å; F27-F114 HydrophobicContact CE1-CG 3.37Å; F27-F114 HydrophobicContact CE2-CD1 4.21Å; F27-F114 HydrophobicContact CE2-CE1 4.45Å; F27-F114 HydrophobicContact CZ-CB 3.99Å; F27-F114 AromaticContact CZ-CD1 3.73Å; F27-F114 HydrophobicContact CZ-CD1 3.73Å; F27-F114 HydrophobicContact CZ-CD2 4.07Å; F27-F114 HydrophobicContact CZ-CE1 4.2Å; F27-F114 AromaticContact CZ-CG 3.66Å; F27-F114 HydrophobicContact CZ-CG 3.66Å; L75-F114 HydrophobicContact CD2-CE2 3.93Å; L75-F114 HydrophobicContact CD2-CZ 4.16Å; V77-F114 HydrophobicContact CG1-CE1 3.97Å; V77-F114 HydrophobicContact CG1-CZ 3.67Å; F80-F114 HydrophobicContact CD2-CD1 4.14Å; F80-F114 AromaticContact CD2-CE1 3.75Å; F80-F114 HydrophobicContact CD2-CE1 3.75Å; F80-F114 HydrophobicContact CE1-CD1 4.17Å; F80-F114 HydrophobicContact CE1-CE1 4.38Å; F80-F114 AromaticContact CE2-CD1 3.47Å; F80-F114 HydrophobicContact CE2-CD1 3.47Å; F80-F114 VanDerWaalsContact CE2-CD1 3.47Å; F80-F114 AromaticContact CE2-CE1 3.58Å; F80-F114 HydrophobicContact CE2-CE1 3.58Å; F80-F114 HydrophobicContact CG-CE1 4.24Å; F80-F114 AromaticContact CZ-CD1 3.49Å; F80-F114 HydrophobicContact CZ-CD1 3.49Å; F80-F114 VanDerWaalsContact CZ-CD1 3.49Å; F80-F114 AromaticContact CZ-CE1 3.92Å; F80-F114 HydrophobicContact CZ-CE1 3.92Å; L85-F114 HydrophobicContact CD2-CE1 4.01Å; L85-F114 HydrophobicContact CD2-CZ 3.99Å; I96-F114 HydrophobicContact CB-CE2 4.24Å; I96-F114 HydrophobicContact CG2-CE2 3.72Å; I96-F114 HydrophobicContact CG2-CZ 3.78Å; I96-F114 WeakPolarHBondContact O-CE2 3.35Å; H97-F114 WeakPolarHBondContact CA-O 3.15Å; H97-F114 PolarHBondContact CD2-O 3.05Å; H97-F114 VanDerWaalsContact CD2-O 3.24Å; G98-F114 PolarHBondContact N-O 3.24Å; G98-F114 PolarHBondContact O-N 2.92Å; F114-R116 HydrophobicContact CD2-CB 3.98Å; F114-R116 HydrophobicContact CE2-CB 4.02Å
115	H	94.2	Very high	91.4	Very high	130 Å²	130	74.8 Å²	74.8	60%	0.602	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.3	118.7	172.9	-67.5	-94.5	0	0	0	108.8	H97 E113	H97-H115 AromaticContact CD2-CD2 3.83Å; H97-H115 AromaticContact CD2-CE1 3.01Å; H97-H115 PolarHBondContact CD2-CE1 2.85Å; H97-H115 AromaticContact CD2-CG 3.93Å; H97-H115 AromaticContact CD2-ND1 3.46Å; H97-H115 PolarHBondContact CD2-ND1 2.85Å; H97-H115 AromaticContact CD2-NE2 3.25Å; H97-H115 PolarHBondContact CD2-NE2 2.87Å; H97-H115 VanDerWaalsContact CD2-NE2 3.25Å; H97-H115 AromaticContact CE1-CE1 3.86Å; H97-H115 AromaticContact CG-CE1 3.62Å; H97-H115 AromaticContact CG-ND1 3.89Å; H97-H115 AromaticContact NE2-CE1 3.19Å; H97-H115 PolarHBondContact NE2-CE1 2.84Å; H97-H115 AromaticContact NE2-NE2 3.22Å; H97-H115 PolarHBondContact NE2-NE2 3.22Å; E113-H115 IonicContact OE1-CD2 2.87Å; E113-H115 IonicContact OE1-CE1 3.66Å; E113-H115 IonicContact OE1-NE2 3.3Å; E113-H115 PolarHBondContact OE1-NE2 3.25Å
116	R	92.8	Very high	91.7	Very high	86 Å²	86	77.1 Å²	77.1	33%	0.325	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	131.1	-177.7	-162.1	73.3	-176.6	128.1	9.2	110.3	E95 I96 F114 Y118	E95-R116 CarbonylContact C-O 3.58Å; E95-R116 WeakPolarHBondContact CA-O 3.26Å; I96-R116 HydrophobicContact CB-CB 4.47Å; I96-R116 PolarHBondContact N-O 3.01Å; I96-R116 PolarHBondContact O-N 3.19Å; F114-R116 HydrophobicContact CD2-CB 3.98Å; F114-R116 HydrophobicContact CE2-CB 4.02Å; R116-Y118 HydrophobicContact CB-CE2 4.22Å; R116-Y118 HydrophobicContact CG-CD2 4.3Å; R116-Y118 HydrophobicContact CG-CE1 4.42Å; R116-Y118 HydrophobicContact CG-CE2 3.38Å; R116-Y118 VanDerWaalsContact CG-CZ 3.46Å; R116-Y118 VanDerWaalsContact CG-OH 3.29Å; R116-Y118 WeakPolarHBondContact CG-OH 3.04Å; R116-Y118 PolarHBondContact NE-OH 2.92Å
117	R	94.3	Very high	92	Very high	148 Å²	148	74.7 Å²	74.7	56%	0.558	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.7	131.2	-177	-169.6	159.7	69.8	179.2	1.4	111.9	F93 V94 E95	F93-R117 HydrophobicContact CB-CG 3.6Å; F93-R117 HydrophobicContact CD1-CG 3.59Å; F93-R117 HydrophobicContact CG-CG 3.82Å; V94-R117 CarbonylContact O-C 3.58Å; V94-R117 VanDerWaalsContact O-CA 3.3Å; V94-R117 WeakPolarHBondContact O-CA 3.31Å; E95-R117 HydrophobicContact CG-CG 3.91Å; E95-R117 WeakPolarHBondContact OE1-CD 3.47Å; E95-R117 IonicContact OE1-CZ 3.93Å; E95-R117 IonicContact OE1-NE 3.94Å; E95-R117 IonicContact OE1-NH1 3.07Å; E95-R117 PolarHBondContact OE1-NH1 3.46Å
118	Y	93.5	Very high	92.5	Very high	15 Å²	15	70.2 Å²	70.2	6%	0.059	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	132.4	-179.6	-60.6	-82.3	0	0	0	110.3	V64 I73 F93 V94 I96 R116 L120	V64-Y118 HydrophobicContact CG2-CD1 3.66Å; V64-Y118 HydrophobicContact CG2-CE1 3.61Å; I73-Y118 HydrophobicContact CD1-CD1 4.3Å; I73-Y118 HydrophobicContact CD1-CD2 3.69Å; I73-Y118 HydrophobicContact CD1-CE2 4.42Å; I73-Y118 HydrophobicContact CD1-CG 3.61Å; I73-Y118 HydrophobicContact CG1-CG 4.33Å; I73-Y118 HydrophobicContact CG2-CD2 4.19Å; I73-Y118 HydrophobicContact CG2-CE1 4.19Å; I73-Y118 HydrophobicContact CG2-CE2 3.82Å; F93-Y118 CarbonylContact C-O 3.59Å; F93-Y118 WeakPolarHBondContact CA-O 3.19Å; V94-Y118 PolarHBondContact N-O 3.18Å; V94-Y118 PolarHBondContact O-N 2.92Å; I96-Y118 HydrophobicContact CD1-CD2 4.35Å; I96-Y118 HydrophobicContact CD1-CE2 4.03Å; R116-Y118 HydrophobicContact CB-CE2 4.22Å; R116-Y118 HydrophobicContact CG-CD2 4.3Å; R116-Y118 HydrophobicContact CG-CE1 4.42Å; R116-Y118 HydrophobicContact CG-CE2 3.38Å; R116-Y118 VanDerWaalsContact CG-CZ 3.46Å; R116-Y118 VanDerWaalsContact CG-OH 3.29Å; R116-Y118 WeakPolarHBondContact CG-OH 3.04Å; R116-Y118 PolarHBondContact NE-OH 2.92Å; Y118-L120 PolarHBondContact O-N 3.28Å
119	R	92.8	Very high	92.8	Very high	170 Å²	170	71 Å²	71	64%	0.642	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.1	125.5	174.9	-171.9	177.4	-179.2	83.5	1.6	109.7	F93	F93-R119 HydrophobicContact CD1-CB 4Å; F93-R119 HydrophobicContact CE1-CB 3.74Å; F93-R119 HydrophobicContact CE1-CG 4.12Å; F93-R119 HydrophobicContact CZ-CG 4.47Å
120	L	93.3	Very high	93.1	Very high	5 Å²	5	66.6 Å²	66.6	3%	0.026	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-76.1	134	171.1	-74.7	137.3	0	0	0	109.6	F71 V89 D92 V94 Y118 V124 L129 F141	F71-L120 HydrophobicContact CD1-CD2 4.4Å; F71-L120 HydrophobicContact CE1-CD2 4.44Å; V89-L120 HydrophobicContact CG1-CD1 3.59Å; V89-L120 HydrophobicContact CG2-CD1 4.32Å; D92-L120 WeakPolarHBondContact O-CB 3.44Å; D92-L120 PolarHBondContact O-N 3.13Å; V94-L120 HydrophobicContact CG2-CD1 3.56Å; V94-L120 HydrophobicContact CG2-CD2 3.76Å; V94-L120 HydrophobicContact CG2-CG 3.61Å; Y118-L120 PolarHBondContact O-N 3.28Å; L120-V124 HydrophobicContact CD2-CB 4.33Å; L120-V124 HydrophobicContact CD2-CG1 4.02Å; L120-L129 HydrophobicContact CD2-CD2 4.47Å; L120-F141 HydrophobicContact CD2-CE1 4.18Å; L120-F141 HydrophobicContact CD2-CZ 4.45Å
121	P	92.3	Very high	93.3	Very high	33 Å²	33	68.1 Å²	68.1	21%	0.214	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-58.8	142.1	163.8	-20.8	31.5	0	0	0	110.6	F71 N123 V124	F71-P121 HydrophobicContact CD2-CG 3.74Å; F71-P121 HydrophobicContact CE2-CG 4.05Å; F71-P121 HydrophobicContact CG-CG 4.27Å; P121-N123 WeakPolarHBondContact CB-OD1 3.26Å; P121-N123 PolarHBondContact O-N 3.32Å; P121-N123 VanDerWaalsContact O-N 3.1Å; P121-V124 HydrophobicContact CB-CG2 4.05Å; P121-V124 HydrophobicContact CG-CG2 4.06Å; P121-V124 PolarHBondContact O-N 2.8Å
122	S	90.9	Very high	93.5	Very high	124 Å²	124	67.9 Å²	67.9	87%	0.867	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-17.3	-178.6	55.9	0	0	0	0	113.9
123	N	91.5	Very high	93.7	Very high	42 Å²	42	69.8 Å²	69.8	23%	0.225	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	9.9	177.3	65.4	-19.3	0	0	0	113.4	P121 K145 I146	P121-N123 WeakPolarHBondContact CB-OD1 3.26Å; P121-N123 PolarHBondContact O-N 3.32Å; P121-N123 VanDerWaalsContact O-N 3.1Å; N123-K145 CarbonylContact O-C 3.5Å; N123-K145 WeakPolarHBondContact O-CA 3.39Å; N123-I146 PolarHBondContact O-N 3.42Å
124	V	93.6	Very high	93.6	Very high	7 Å²	7	67.8 Å²	67.8	4%	0.042	37%	0.368	C	S	.	.	B	Isolated β-bridge	trans	-83.6	131.7	172.6	175.6	0	0	0	0	110.1	F71 L120 P121 Q126 L129 P144 K145	F71-V124 HydrophobicContact CB-CG2 3.6Å; F71-V124 HydrophobicContact CG-CG2 4.17Å; L120-V124 HydrophobicContact CD2-CB 4.33Å; L120-V124 HydrophobicContact CD2-CG1 4.02Å; P121-V124 HydrophobicContact CB-CG2 4.05Å; P121-V124 HydrophobicContact CG-CG2 4.06Å; P121-V124 PolarHBondContact O-N 2.8Å; V124-Q126 PolarHBondContact O-N 2.81Å; V124-L129 HydrophobicContact CG1-CD2 3.78Å; V124-P144 WeakPolarHBondContact CA-O 3.33Å; V124-K145 HydrophobicContact CG2-CG 4.07Å
125	D	92.9	Very high	93.5	Very high	48 Å²	48	72.8 Å²	72.8	26%	0.257	41%	0.412	S	S	.	.			trans	-73.1	104.9	171.4	-176.7	-1.2	0	0	0	110.1	S127 A128 P144 I146	D125-S127 PolarHBondContact O-N 3.07Å; D125-S127 WeakPolarHBondContact OD1-CB 3.43Å; D125-S127 PolarHBondContact OD1-N 3.28Å; D125-S127 PolarHBondContact OD1-OG 2.85Å; D125-S127 PolarHBondContact OD2-OG 2.87Å; D125-A128 HydrophobicContact CB-CB 4.42Å; D125-A128 PolarHBondContact O-N 3.04Å; D125-P144 HydrophobicContact CB-CG 4.16Å; D125-P144 PolarHBondContact N-O 3.23Å; D125-I146 HydrophobicContact CB-CD1 4.09Å; D125-I146 HydrophobicContact CB-CG1 3.78Å
126	Q	91.3	Very high	93.2	Very high	94 Å²	94	72.2 Å²	72.2	44%	0.439	41%	0.413	S	S	.	.	G	3₁₀ helix	trans	-70.2	-18.5	-179.2	-60.4	-172.5	29.9	0	0	113	D92 V124 L129	D92-Q126 PolarHBondContact OD1-NE2 2.47Å; V124-Q126 PolarHBondContact O-N 2.81Å; Q126-L129 HydrophobicContact CB-CD1 4.21Å; Q126-L129 WeakPolarHBondContact O-CD1 3.41Å; Q126-L129 WeakPolarHBondContact O-CG 3.23Å
127	S	91.7	Very high	93.1	Very high	109 Å²	109	68.6 Å²	68.6	76%	0.762	40%	0.402	S	S	*	.	G	3₁₀ helix	trans	-79	-23.1	179.4	73.7	0	0	0	0	113.1	D125	D125-S127 PolarHBondContact O-N 3.07Å; D125-S127 WeakPolarHBondContact OD1-CB 3.43Å; D125-S127 PolarHBondContact OD1-N 3.28Å; D125-S127 PolarHBondContact OD1-OG 2.85Å; D125-S127 PolarHBondContact OD2-OG 2.87Å
128	A	94.1	Very high	93	Very high	46 Å²	46	63.8 Å²	63.8	38%	0.38	39%	0.387	S	S	.	.	G	3₁₀ helix	trans	-108	23.9	-177	0	0	0	0	0	112.9	D125 P144	D125-A128 HydrophobicContact CB-CB 4.42Å; D125-A128 PolarHBondContact O-N 3.04Å; A128-P144 HydrophobicContact CB-CG 3.64Å; A128-P144 WeakPolarHBondContact O-CD 3.03Å
129	L	95.6	Very high	93.1	Very high	45 Å²	45	63.2 Å²	63.2	24%	0.236	39%	0.385	C	S	.	.			trans	-70.3	144.4	176.8	-64	173.2	0	0	0	111.3	V89 L120 V124 Q126 F141	V89-L129 HydrophobicContact CG2-CD1 3.66Å; L120-L129 HydrophobicContact CD2-CD2 4.47Å; V124-L129 HydrophobicContact CG1-CD2 3.78Å; Q126-L129 HydrophobicContact CB-CD1 4.21Å; Q126-L129 WeakPolarHBondContact O-CD1 3.41Å; Q126-L129 WeakPolarHBondContact O-CG 3.23Å; L129-F141 HydrophobicContact CB-CE2 4.48Å; L129-F141 HydrophobicContact CB-CZ 4.22Å; L129-F141 HydrophobicContact CD1-CE2 4.47Å; L129-F141 HydrophobicContact CD1-CZ 3.82Å; L129-F141 HydrophobicContact CD2-CE1 3.91Å; L129-F141 HydrophobicContact CD2-CZ 3.67Å; L129-F141 HydrophobicContact CG-CZ 4.1Å
130	S	96.2	Very high	93.2	Very high	64 Å²	64	56.7 Å²	56.7	45%	0.448	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	148.9	175.8	60.4	0	0	0	0	110.9	S142	S130-S142 PolarHBondContact N-O 2.77Å; S130-S142 PolarHBondContact O-N 2.95Å; S130-S142 PolarHBondContact OG-O 3.44Å; S130-S142 PolarHBondContact OG-OG 2.75Å
131	C	95.8	Very high	93.4	Very high	62 Å²	62	56.7 Å²	56.7	42%	0.419	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	134.4	175	-170.1	0	0	0	0	108.9	T140 F141	C131-T140 CarbonylContact C-O 3.52Å; C131-T140 WeakPolarHBondContact CA-O 3.13Å; C131-F141 HydrophobicContact CB-CD2 4.3Å
132	S	96.4	Very high	93.6	Very high	71 Å²	71	56.8 Å²	56.8	50%	0.497	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	152.2	174.7	60.1	0	0	0	0	110.4	L139 T140	S132-L139 WeakPolarHBondContact O-CA 3.4Å; S132-T140 PolarHBondContact N-O 2.84Å; S132-T140 PolarHBondContact O-N 2.92Å
133	L	95.9	Very high	93.8	Very high	60 Å²	60	51 Å²	51	31%	0.314	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	122.3	172.8	179.6	61.5	0	0	0	108	V77 P82 L85 L139	V77-L133 HydrophobicContact CG2-CD1 3.51Å; P82-L133 HydrophobicContact CB-CD2 4.42Å; P82-L133 HydrophobicContact CG-CD2 3.98Å; L85-L133 HydrophobicContact CD1-CD2 3.97Å; L133-L139 HydrophobicContact CD1-CB 4.16Å
134	S	93.4	Very high	94	Very high	51 Å²	51	51.5 Å²	51.5	36%	0.357	33%	0.331	S	S	.	.			trans	-82.8	163.4	175.6	50.6	0	0	0	0	111.8	D136 G137 M138	S134-D136 WeakPolarHBondContact CB-OD1 3.36Å; S134-D136 PolarHBondContact O-N 3.32Å; S134-D136 PolarHBondContact OG-OD1 3.08Å; S134-G137 PolarHBondContact O-N 3.34Å; S134-M138 PolarHBondContact N-O 3.08Å; S134-M138 VanDerWaalsContact N-O 3.08Å; S134-M138 VanDerWaalsContact OG-CB 3.31Å; S134-M138 WeakPolarHBondContact OG-CB 3.24Å; S134-M138 PolarHBondContact OG-N 3.47Å; S134-M138 PolarHBondContact OG-O 2.98Å
135	A	91.8	Very high	94	Very high	118 Å²	118	52.4 Å²	52.4	98%	0.975	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-21.2	-176.1	0	0	0	0	0	114.2	G137	A135-G137 VanDerWaalsContact C-N 3.29Å
136	D	88.1	Confident	93.9	Very high	118 Å²	118	54.4 Å²	54.4	63%	0.631	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	1.2	174	62.7	-15.6	0	0	0	113.2	S134 M138	S134-D136 WeakPolarHBondContact CB-OD1 3.36Å; S134-D136 PolarHBondContact O-N 3.32Å; S134-D136 PolarHBondContact OG-OD1 3.08Å; D136-M138 PolarHBondContact OD1-N 2.85Å
137	G	90.1	Very high	93.2	Very high	10 Å²	10	56.9 Å²	56.9	10%	0.103	36%	0.355	C	S	.	.	S	Bend	trans	90.3	10	176.9	0	0	0	0	0	115.1	V77 K78 S134 A135 L139	V77-G137 CarbonylContact C-O 3.6Å; V77-G137 VanDerWaalsContact CG2-O 3.26Å; V77-G137 WeakPolarHBondContact CG2-O 3.38Å; V77-G137 PolarHBondContact N-O 2.84Å; K78-G137 PolarHBondContact N-O 3.49Å; S134-G137 PolarHBondContact O-N 3.34Å; A135-G137 VanDerWaalsContact C-N 3.29Å; G137-L139 PolarHBondContact O-N 2.93Å
138	M	92.1	Very high	92	Very high	47 Å²	47	55.3 Å²	55.3	23%	0.232	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	113	176.8	-170.9	65.7	58.8	0	0	111.3	F74 L75 D76 S134 D136	F74-M138 HydrophobicContact CB-SD 3.95Å; F74-M138 HydrophobicContact CD1-CG 4.42Å; L75-M138 VanDerWaalsContact C-SD 3.51Å; D76-M138 HydrophobicContact CB-CE 4.16Å; S134-M138 PolarHBondContact N-O 3.08Å; S134-M138 VanDerWaalsContact N-O 3.08Å; S134-M138 VanDerWaalsContact OG-CB 3.31Å; S134-M138 WeakPolarHBondContact OG-CB 3.24Å; S134-M138 PolarHBondContact OG-N 3.47Å; S134-M138 PolarHBondContact OG-O 2.98Å; D136-M138 PolarHBondContact OD1-N 2.85Å
139	L	95.2	Very high	90.5	Very high	4 Å²	4	56.7 Å²	56.7	2%	0.021	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	123.9	171	-177.3	146.2	0	0	0	109.7	F74 L75 V77 L85 V87 I96 S132 L133 G137 F141	F74-L139 CarbonylContact C-O 3.46Å; F74-L139 WeakPolarHBondContact CA-O 3.35Å; L75-L139 HydrophobicContact CB-CB 4.47Å; L75-L139 HydrophobicContact CB-CD2 4.43Å; L75-L139 PolarHBondContact N-O 3.44Å; L75-L139 WeakPolarHBondContact O-CB 3.26Å; L75-L139 PolarHBondContact O-N 2.87Å; V77-L139 HydrophobicContact CG1-CB 4.34Å; V77-L139 HydrophobicContact CG2-CB 3.67Å; V77-L139 HydrophobicContact CG2-CD1 4.49Å; L85-L139 HydrophobicContact CD1-CD1 4.21Å; V87-L139 HydrophobicContact CG2-CD1 4.1Å; I96-L139 HydrophobicContact CD1-CD2 3.76Å; I96-L139 HydrophobicContact CG2-CD1 4.47Å; S132-L139 WeakPolarHBondContact O-CA 3.4Å; L133-L139 HydrophobicContact CD1-CB 4.16Å; G137-L139 PolarHBondContact O-N 2.93Å; L139-F141 HydrophobicContact CD2-CB 4.38Å
140	T	95.8	Very high	88.8	Confident	32 Å²	32	61.8 Å²	61.8	20%	0.196	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	111.1	177	-56.7	0	0	0	0	109.3	V72 I73 F74 C131 S132	V72-T140 HydrophobicContact CG1-CG2 3.93Å; I73-T140 WeakPolarHBondContact O-CA 3.16Å; F74-T140 HydrophobicContact CD1-CG2 4.15Å; F74-T140 HydrophobicContact CE1-CG2 3.84Å; C131-T140 CarbonylContact C-O 3.52Å; C131-T140 WeakPolarHBondContact CA-O 3.13Å; S132-T140 PolarHBondContact N-O 2.84Å; S132-T140 PolarHBondContact O-N 2.92Å
141	F	97	Very high	86.8	Confident	6 Å²	6	63.8 Å²	63.8	3%	0.026	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	131.7	170.2	177.1	-82.4	0	0	0	108.9	V72 I73 V87 V89 V94 L120 L129 C131 L139	V72-F141 CarbonylContact C-O 3.55Å; V72-F141 VanDerWaalsContact CA-O 3.29Å; V72-F141 WeakPolarHBondContact CA-O 3.42Å; I73-F141 HydrophobicContact CB-CB 4.24Å; I73-F141 HydrophobicContact CD1-CD1 3.96Å; I73-F141 HydrophobicContact CD1-CG 4.5Å; I73-F141 PolarHBondContact N-O 2.98Å; I73-F141 PolarHBondContact O-N 3.3Å; V87-F141 HydrophobicContact CG1-CD2 3.92Å; V87-F141 HydrophobicContact CG1-CE2 4.14Å; V89-F141 HydrophobicContact CG2-CE2 4.41Å; V89-F141 HydrophobicContact CG2-CZ 4.23Å; V94-F141 HydrophobicContact CB-CZ 4.37Å; V94-F141 HydrophobicContact CG1-CD1 4.47Å; V94-F141 HydrophobicContact CG1-CD2 3.9Å; V94-F141 HydrophobicContact CG1-CE1 4.36Å; V94-F141 HydrophobicContact CG1-CE2 3.75Å; V94-F141 HydrophobicContact CG1-CG 4.24Å; V94-F141 HydrophobicContact CG1-CZ 3.98Å; V94-F141 HydrophobicContact CG2-CD1 4.1Å; V94-F141 HydrophobicContact CG2-CE1 3.45Å; V94-F141 VanDerWaalsContact CG2-CE1 3.45Å; V94-F141 HydrophobicContact CG2-CE2 4.06Å; V94-F141 HydrophobicContact CG2-CZ 3.4Å; L120-F141 HydrophobicContact CD2-CE1 4.18Å; L120-F141 HydrophobicContact CD2-CZ 4.45Å; L129-F141 HydrophobicContact CB-CE2 4.48Å; L129-F141 HydrophobicContact CB-CZ 4.22Å; L129-F141 HydrophobicContact CD1-CE2 4.47Å; L129-F141 HydrophobicContact CD1-CZ 3.82Å; L129-F141 HydrophobicContact CD2-CE1 3.91Å; L129-F141 HydrophobicContact CD2-CZ 3.67Å; L129-F141 HydrophobicContact CG-CZ 4.1Å; C131-F141 HydrophobicContact CB-CD2 4.3Å; L139-F141 HydrophobicContact CD2-CB 4.38Å
142	S	96	Very high	84.9	Confident	34 Å²	34	64.3 Å²	64.3	24%	0.238	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	147.8	-179.6	77.2	0	0	0	0	113.6	F71 S130	F71-S142 CarbonylContact O-C 3.48Å; F71-S142 VanDerWaalsContact O-CA 3.29Å; F71-S142 WeakPolarHBondContact O-CA 3.45Å; S130-S142 PolarHBondContact N-O 2.77Å; S130-S142 PolarHBondContact O-N 2.95Å; S130-S142 PolarHBondContact OG-O 3.44Å; S130-S142 PolarHBondContact OG-OG 2.75Å
143	G	95.1	Very high	83.1	Confident	3 Å²	3	66.1 Å²	66.1	3%	0.031	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	137.1	177.1	0	0	0	0	0	111.6	K70 F71	K70-G143 CarbonylContact C-O 3.59Å; K70-G143 WeakPolarHBondContact CA-O 3.37Å; F71-G143 PolarHBondContact N-O 3.16Å; F71-G143 PolarHBondContact O-N 2.72Å
144	P	95.8	Very high	81.2	Confident	52 Å²	52	71.9 Å²	71.9	34%	0.338	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	151.9	174.6	28.9	-29.9	0	0	0	110.5	D69 V124 D125 A128	D69-P144 WeakPolarHBondContact O-CA 3.39Å; V124-P144 WeakPolarHBondContact CA-O 3.33Å; D125-P144 HydrophobicContact CB-CG 4.16Å; D125-P144 PolarHBondContact N-O 3.23Å; A128-P144 HydrophobicContact CB-CG 3.64Å; A128-P144 WeakPolarHBondContact O-CD 3.03Å
145	K	93.8	Very high	79.8	Confident	27 Å²	27	78.3 Å²	78.3	12%	0.117	46%	0.458	C	S	.	.	B	Isolated β-bridge	trans	-96.4	130.8	173.5	-69.7	179.1	176.6	-176.6	0	110.3	S66 D67 D69 N123 V124 Q147	S66-K145 PolarHBondContact OG-NZ 3.33Å; D67-K145 VanDerWaalsContact O-CD 3.31Å; D67-K145 WeakPolarHBondContact O-CD 3.3Å; D67-K145 VanDerWaalsContact O-CE 3.28Å; D67-K145 WeakPolarHBondContact O-CE 3.46Å; D67-K145 PolarHBondContact O-NZ 2.86Å; D69-K145 PolarHBondContact O-N 2.87Å; N123-K145 CarbonylContact O-C 3.5Å; N123-K145 WeakPolarHBondContact O-CA 3.39Å; V124-K145 HydrophobicContact CG2-CG 4.07Å; K145-Q147 PolarHBondContact O-N 3.45Å; K145-Q147 VanDerWaalsContact O-N 3.14Å
146	I	90.3	Very high	78.8	Confident	90 Å²	90	83.1 Å²	83.1	46%	0.462	45%	0.451	S	S	.	.			trans	-69.6	106.5	171.7	-54.2	174.3	0	0	0	107.2	N123 D125 T148	N123-I146 PolarHBondContact O-N 3.42Å; D125-I146 HydrophobicContact CB-CD1 4.09Å; D125-I146 HydrophobicContact CB-CG1 3.78Å; I146-T148 VanDerWaalsContact C-N 3.32Å; I146-T148 PolarHBondContact O-N 3Å
147	Q	77.8	Confident	78.2	Confident	145 Å²	145	81.6 Å²	81.6	68%	0.678	46%	0.455	S	S	*	.			trans	-69.2	92.8	170.7	-65.7	-176.3	4.7	0	0	108.4	D69 K145	D69-Q147 PolarHBondContact OD1-NE2 2.69Å; K145-Q147 PolarHBondContact O-N 3.45Å; K145-Q147 VanDerWaalsContact O-N 3.14Å
148	T	67	Low	77.7	Confident	77 Å²	77	88 Å²	88	47%	0.472	49%	0.485	S	S	.	.			trans	-76.4	128.5	164.1	-53.5	0	0	0	0	106.2	I146 L150 D151	I146-T148 VanDerWaalsContact C-N 3.32Å; I146-T148 PolarHBondContact O-N 3Å; T148-L150 HydrophobicContact CG2-CD1 4.15Å; T148-L150 HydrophobicContact CG2-CG 4.31Å; T148-L150 PolarHBondContact O-N 3.38Å; T148-D151 PolarHBondContact O-N 3.33Å
149	G	62.6	Low	76.9	Confident	74 Å²	74	91.2 Å²	91.2	76%	0.763	51%	0.51	S	S	*	.	G	3₁₀ helix	trans	-56.7	3.9	-174.5	0	0	0	0	0	116.9
150	L	57.9	Low	76.3	Confident	152 Å²	152	98.1 Å²	98.1	80%	0.796	55%	0.552	S	S	*	*	G	3₁₀ helix	trans	-79	-20.2	171.5	-64.8	169	0	0	0	113.2	T148 A152	T148-L150 HydrophobicContact CG2-CD1 4.15Å; T148-L150 HydrophobicContact CG2-CG 4.31Å; T148-L150 PolarHBondContact O-N 3.38Å; L150-A152 VanDerWaalsContact C-N 3.26Å; L150-A152 PolarHBondContact O-N 3.08Å
151	D	55.3	Low	75.5	Confident	107 Å²	107	101.1 Å²	101.1	57%	0.572	58%	0.58	S	S	*	*	G	3₁₀ helix	trans	-90.5	20.5	176.8	-69.4	-22.7	0	0	0	113	T148 T153	T148-D151 PolarHBondContact O-N 3.33Å; D151-T153 PolarHBondContact O-N 3.49Å; D151-T153 PolarHBondContact O-OG1 3.16Å
152	A	55.8	Low	74.7	Confident	72 Å²	72	111.8 Å²	111.8	60%	0.595	62%	0.62	S	S	*	*			trans	-61.2	80.7	153	0	0	0	0	0	106.8	L150 H154	L150-A152 VanDerWaalsContact C-N 3.26Å; L150-A152 PolarHBondContact O-N 3.08Å; A152-H154 PolarHBondContact O-N 3.31Å
153	T	57.9	Low	73.7	Confident	109 Å²	109	119.1 Å²	119.1	67%	0.669	65%	0.65	S	S	*	*			trans	-55.9	107.4	179.3	-35.2	0	0	0	0	104.3	D151 E155	D151-T153 PolarHBondContact O-N 3.49Å; D151-T153 PolarHBondContact O-OG1 3.16Å; T153-E155 PolarHBondContact O-N 3.41Å
154	H	57.1	Low	72.6	Confident	182 Å²	182	127.2 Å²	127.2	84%	0.843	69%	0.688	S	S	*	*			trans	-57.5	95.3	168.1	-82.2	-95.2	0	0	0	105.4	A152 R156	A152-H154 PolarHBondContact O-N 3.31Å; H154-R156 PolarHBondContact O-N 2.93Å
155	E	64.1	Low	71.7	Confident	185 Å²	185	134.2 Å²	134.2	86%	0.864	71%	0.713	S	S	*	*			trans	-63.2	87.2	169.9	-175.7	176.4	-170.8	0	0	105.9	T153 A157	T153-E155 PolarHBondContact O-N 3.41Å; E155-A157 PolarHBondContact O-N 3.27Å
156	R	70.5	Confident	70.4	Confident	219 Å²	219	138.5 Å²	138.5	83%	0.826	74%	0.743	S	S	*	*			trans	-82.7	96.5	174.3	-172.6	179.4	178.7	-171.7	-0.7	106.1	H154 I158	H154-R156 PolarHBondContact O-N 2.93Å; R156-I158 PolarHBondContact O-N 2.9Å
157	A	75.1	Confident	69.3	Low	86 Å²	86	139.6 Å²	139.6	71%	0.711	76%	0.759	S	S	*	*			trans	-56	113.9	165	0	0	0	0	0	108.2	E155 P159	E155-A157 PolarHBondContact O-N 3.27Å; A157-P159 VanDerWaalsContact O-CD 3.28Å; A157-P159 WeakPolarHBondContact O-CD 3.25Å
158	I	79.6	Confident	68.5	Low	144 Å²	144	138 Å²	138	74%	0.738	76%	0.763	S	S	*	*			trans	-84.7	110.7	172.2	-57.3	175.2	0	0	0	105.8	R156 V160	R156-I158 PolarHBondContact O-N 2.9Å; I158-V160 PolarHBondContact O-N 3.33Å
159	P	76.5	Confident	68.4	Low	116 Å²	116	138.4 Å²	138.4	75%	0.753	78%	0.775	S	S	*	*			trans	-66.8	130.6	177.6	26.4	-32.2	0	0	0	109.9	A157 A161	A157-P159 VanDerWaalsContact O-CD 3.28Å; A157-P159 WeakPolarHBondContact O-CD 3.25Å; P159-A161 PolarHBondContact O-N 3.12Å
160	V	81	Confident	68.7	Low	149 Å²	149	140.7 Å²	140.7	90%	0.903	78%	0.776	S	S	*	*			trans	-81.9	106.7	174.7	-179.6	0	0	0	0	108	I158	I158-V160 PolarHBondContact O-N 3.33Å
161	A	79.4	Confident	68.4	Low	95 Å²	95	138.7 Å²	138.7	79%	0.785	78%	0.775	S	S	*	*			trans	-86.9	133.6	171.9	0	0	0	0	0	110.1	P159	P159-A161 PolarHBondContact O-N 3.12Å
162	R	79.4	Confident	68.7	Low	229 Å²	229	143.1 Å²	143.1	86%	0.864	81%	0.814	S	S	*	*			trans	-88.1	121.5	170.3	-175.9	177.3	-178.7	162.1	-0.5	108.3	E164	R162-E164 PolarHBondContact O-N 2.96Å
163	E	75.3	Confident	69.3	Low	188 Å²	188	146.7 Å²	146.7	88%	0.879	83%	0.825	S	S	*	*			trans	-70.3	115.2	169.2	-68.5	-179.7	174.8	0	0	108.8
164	E	73.1	Confident	69.9	Low	174 Å²	174	148.6 Å²	148.6	81%	0.813	83%	0.834	S	S	*	*			trans	-77.9	122	166.5	-69	-160.7	166.5	0	0	109	R162 P166	R162-E164 PolarHBondContact O-N 2.96Å; E164-P166 WeakPolarHBondContact O-CD 3.36Å
165	K	77.3	Confident	70.6	Confident	199 Å²	199	146.8 Å²	146.8	87%	0.865	83%	0.833	S	S	*	*			trans	-61.8	122.5	173.5	-175.1	176.7	-176.1	176.2	0	108.1	S167	K165-S167 PolarHBondContact O-N 3.36Å
166	P	65.5	Low	71	Confident	116 Å²	116	144.5 Å²	144.5	75%	0.753	83%	0.831	S	S	*	*			trans	-63.5	113.5	-178.3	22.6	-30.6	0	0	0	109.5	E164 S168	E164-P166 WeakPolarHBondContact O-CD 3.36Å; P166-S168 PolarHBondContact O-N 2.85Å
167	S	66.4	Low	71	Confident	114 Å²	114	139.9 Å²	139.9	80%	0.797	83%	0.831	S	S	*	*			trans	-67.3	97.4	166.4	162.4	0	0	0	0	107.9	K165 A169	K165-S167 PolarHBondContact O-N 3.36Å; S167-A169 PolarHBondContact O-N 2.94Å; S167-A169 VanDerWaalsContact O-N 3.07Å
168	S	62.3	Low	70.8	Confident	110 Å²	110	143.5 Å²	143.5	77%	0.769	84%	0.84	S	S	*	*			trans	-63.9	102.8	168.3	54.7	0	0	0	0	109.5	P166	P166-S168 PolarHBondContact O-N 2.85Å
169	A	64.2	Low	70.1	Confident	87 Å²	87	143.4 Å²	143.4	72%	0.719	85%	0.847	S	S	*	*			trans	-111.9	95.9	161.9	0	0	0	0	0	107.9	S167 S171	S167-A169 PolarHBondContact O-N 2.94Å; S167-A169 VanDerWaalsContact O-N 3.07Å; A169-S171 PolarHBondContact O-N 2.84Å
170	P	68.8	Low	69.6	Low	121 Å²	121	145.5 Å²	145.5	79%	0.786	85%	0.854	S	S	*	*			trans	-73	115.1	166.3	28.4	-28.5	0	0	0	108.5
171	S	52.9	Low	68.7	Low	111 Å²	111	145.3 Å²	145.3	78%	0.776	85%	0.85	S	S	*	*			trans	-59.6	124.3	162.8	50.7	0	0	0	0	110.6	A169	A169-S171 PolarHBondContact O-N 2.84Å
172	S	59.7	Low	67.7	Low	199 Å²	199	149.8 Å²	149.8	100%	1.392	86%	0.856	S	S	*	*			trans	-157.9	0	148	-74.8	0	0	0	0	108.7

Retrieved 172 of 172 residues in 291 ms (Link to these results)

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