A0A087YJF9_POEFO Loading...

Anaphase-promoting complex subunit 10

Component of the anaphase promoting complex/cyclosome (APC/C), a cell cycle-regulated E3 ubiquitin ligase that controls progression through mitosis and the G1 phase of the cell cycle. The APC/C complex acts by mediating ubiquitination and subsequent degradation of target proteins: it mainly mediates the formation of 'Lys-11'-linked polyubiquitin chains and, to a lower extent, the formation of 'Lys-48'- and 'Lys-63'-linked polyubiquitin chains. The APC/C complex catalyzes assembly of branched 'Lys-11'-/'Lys-48'-linked branched ubiquitin chains on target proteins. Component of the anaphase promoting complex/cyclosome (APC/C), a cell cycle-regulated E3 ubiquitin-protein ligase complex that controls progression through mitosis and the G1 phase of the cell cycle.

AlphaFold DB (M3ZHT2), UniProt , Accession A0A087YJF9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 186 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.2	Very low	71.7	Confident	239 Å²	239	100.3 Å²	100.3	100%	1.177	63%	0.627	S	S	*	*				0	120.4	0	-67.6	176.5	-154.1	0	0	106.7	T3	M1-T3 PolarHBondContact O-N 3.48Å
2	A	43.7	Very low	73.1	Confident	104 Å²	104	97.2 Å²	97.2	86%	0.86	60%	0.603	S	S	*	*			trans	-66.8	115.5	175	0	0	0	0	0	107.6
3	T	51.3	Low	74.2	Confident	124 Å²	124	89.7 Å²	89.7	76%	0.761	56%	0.556	S	S	*	*	P	Polyproline II helix	trans	-53.8	131.8	166	36.1	0	0	0	0	107.9	M1 S5	M1-T3 PolarHBondContact O-N 3.48Å; T3-S5 PolarHBondContact O-N 3.18Å; T3-S5 VanDerWaalsContact O-N 3.09Å
4	P	59.7	Low	75.1	Confident	93 Å²	93	90.2 Å²	90.2	60%	0.604	55%	0.547	S	S	*	.	P	Polyproline II helix	trans	-54	123.9	174.3	21.6	-30.2	0	0	0	108.3	K6 V114	P4-K6 PolarHBondContact O-N 3.33Å; P4-V114 HydrophobicContact CB-CG1 4.44Å; P4-V114 HydrophobicContact CB-CG2 4.28Å; P4-V114 HydrophobicContact CG-CG1 4.19Å
5	S	76.5	Confident	75.9	Confident	108 Å²	108	91.8 Å²	91.8	76%	0.755	55%	0.546	S	S	*	.	P	Polyproline II helix	trans	-58.4	127.3	-179.8	56.1	0	0	0	0	109.1	T3	T3-S5 PolarHBondContact O-N 3.18Å; T3-S5 VanDerWaalsContact O-N 3.09Å
6	K	83.8	Confident	76.3	Confident	134 Å²	134	88.6 Å²	88.6	58%	0.583	53%	0.525	S	S	*	.	P	Polyproline II helix	trans	-51.7	146.9	178.1	-54.5	-168.8	-173.3	-150.6	0	111.1	P4 P8 V114 E115	P4-K6 PolarHBondContact O-N 3.33Å; K6-P8 WeakPolarHBondContact O-CD 3.23Å; K6-V114 WeakPolarHBondContact CA-O 3.27Å; K6-E115 HydrophobicContact CD-CB 4.33Å; K6-E115 WeakPolarHBondContact CE-OE2 3.32Å; K6-E115 HydrophobicContact CG-CB 4.5Å; K6-E115 IonicContact NZ-OE2 2.67Å; K6-E115 PolarHBondContact NZ-OE2 3.09Å
7	T	83.3	Confident	76.9	Confident	29 Å²	29	87.2 Å²	87.2	18%	0.178	51%	0.512	C	S	.	.	P	Polyproline II helix	trans	-65	120	175.5	-55.9	0	0	0	0	109.2	M113 V114	T7-M113 WeakPolarHBondContact OG1-CA 3.45Å; T7-V114 PolarHBondContact N-O 2.98Å; T7-V114 PolarHBondContact OG1-N 3.27Å
8	P	85.5	Confident	77.3	Confident	102 Å²	102	94.1 Å²	94.1	66%	0.662	53%	0.528	S	S	*	.	P	Polyproline II helix	trans	-66.8	141.2	-177.9	27.2	-33.8	0	0	0	110.3	K6 G10	K6-P8 WeakPolarHBondContact O-CD 3.23Å; P8-G10 PolarHBondContact O-N 2.82Å
9	P	88.8	Confident	77.7	Confident	83 Å²	83	93.5 Å²	93.5	54%	0.539	53%	0.527	S	S	.	.	P	Polyproline II helix	trans	-66.4	131.7	174.4	27.8	-33.1	0	0	0	109.9
10	G	86.7	Confident	77.9	Confident	29 Å²	29	91.2 Å²	91.2	30%	0.299	53%	0.525	S	S	.	.	B	Isolated β-bridge	trans	-69.7	161	169.6	0	0	0	0	0	111.9	P8 W119	P8-G10 PolarHBondContact O-N 2.82Å; G10-W119 VanDerWaalsContact CA-O 3.26Å; G10-W119 WeakPolarHBondContact CA-O 3.46Å; G10-W119 PolarHBondContact N-O 3.2Å
11	A	89.1	Confident	78.2	Confident	58 Å²	58	89.9 Å²	89.9	48%	0.479	52%	0.519	S	S	.	.	P	Polyproline II helix	trans	-62.9	155.2	172.9	0	0	0	0	0	111.2	P13 H121	A11-P13 WeakPolarHBondContact O-CD 3.25Å; A11-H121 PolarHBondContact O-CE1 3.27Å; A11-H121 PolarHBondContact O-NE2 3.45Å
12	D	88.9	Confident	80.6	Confident	63 Å²	63	78.9 Å²	78.9	34%	0.337	47%	0.465	S	S	.	.	P	Polyproline II helix	trans	-59.6	125.1	175.5	-179.2	-9.1	0	0	0	110.3	K14 Q15	D12-K14 PolarHBondContact O-N 3.13Å; D12-K14 WeakPolarHBondContact OD1-CB 3.21Å; D12-K14 PolarHBondContact OD1-N 3.1Å; D12-Q15 HydrophobicContact CB-CG 4.27Å; D12-Q15 WeakPolarHBondContact O-CB 3.16Å; D12-Q15 PolarHBondContact O-N 3.1Å
13	P	87.3	Confident	82.8	Confident	0 Å²	0	81.1 Å²	81.1	0%	0	45%	0.451	C	S	.	.	H	α-helix	trans	-54.3	-26.9	177	-25.3	32.3	0	0	0	113.9	A11 Q15 L16 E17 C78 W119 K158 Y160	A11-P13 WeakPolarHBondContact O-CD 3.25Å; P13-Q15 VanDerWaalsContact C-N 3.25Å; P13-Q15 PolarHBondContact O-N 3.33Å; P13-L16 WeakPolarHBondContact O-CB 3.2Å; P13-L16 PolarHBondContact O-N 3.31Å; P13-L16 VanDerWaalsContact O-N 3.09Å; P13-E17 PolarHBondContact O-N 2.97Å; P13-C78 HydrophobicContact CG-CB 3.93Å; P13-W119 VanDerWaalsContact CD-CG 3.43Å; P13-W119 HydrophobicContact CG-CD2 3.4Å; P13-W119 VanDerWaalsContact CG-CD2 3.4Å; P13-W119 HydrophobicContact CG-CE3 3.46Å; P13-W119 VanDerWaalsContact CG-CE3 3.46Å; P13-W119 HydrophobicContact CG-CG 3.93Å; P13-W119 HydrophobicContact CG-CH2 3.98Å; P13-W119 HydrophobicContact CG-CZ2 3.98Å; P13-W119 HydrophobicContact CG-CZ3 3.76Å; P13-K158 HydrophobicContact CB-CD 4.21Å; P13-Y160 HydrophobicContact CB-CE2 3.94Å; P13-Y160 WeakPolarHBondContact CB-OH 3.42Å
14	K	87.3	Confident	84.8	Confident	97 Å²	97	77.1 Å²	77.1	42%	0.422	42%	0.424	S	S	.	.	H	α-helix	trans	-62.9	-31.1	173.8	-67.8	-179.5	178.4	175.7	0	112.5	D12 L16 E17 R18	D12-K14 PolarHBondContact O-N 3.13Å; D12-K14 WeakPolarHBondContact OD1-CB 3.21Å; D12-K14 PolarHBondContact OD1-N 3.1Å; K14-L16 VanDerWaalsContact C-N 3.33Å; K14-E17 PolarHBondContact O-N 3.25Å; K14-R18 VanDerWaalsContact O-CG 3.28Å; K14-R18 WeakPolarHBondContact O-CG 3.46Å; K14-R18 PolarHBondContact O-N 2.82Å
15	Q	86.5	Confident	86.5	Confident	114 Å²	114	72.9 Å²	72.9	53%	0.533	40%	0.396	S	S	.	.	H	α-helix	trans	-67.7	-38.3	173.8	-64.4	-178.5	-7.9	0	0	111	D12 P13 R18 T19	D12-Q15 HydrophobicContact CB-CG 4.27Å; D12-Q15 WeakPolarHBondContact O-CB 3.16Å; D12-Q15 PolarHBondContact O-N 3.1Å; P13-Q15 VanDerWaalsContact C-N 3.25Å; P13-Q15 PolarHBondContact O-N 3.33Å; Q15-R18 PolarHBondContact O-N 2.79Å; Q15-T19 PolarHBondContact O-N 2.81Å
16	L	83.1	Confident	87.2	Confident	40 Å²	40	67.8 Å²	67.8	21%	0.209	36%	0.36	C	S	.	.	H	α-helix	trans	-65	-42.7	176.1	-170.4	71.4	0	0	0	111.1	P13 K14 R18 T19 V22 M76	P13-L16 WeakPolarHBondContact O-CB 3.2Å; P13-L16 PolarHBondContact O-N 3.31Å; P13-L16 VanDerWaalsContact O-N 3.09Å; K14-L16 VanDerWaalsContact C-N 3.33Å; L16-R18 VanDerWaalsContact C-N 3.32Å; L16-R18 PolarHBondContact O-N 3.01Å; L16-T19 WeakPolarHBondContact O-CB 3.48Å; L16-T19 PolarHBondContact O-N 3.28Å; L16-T19 PolarHBondContact O-OG1 3.02Å; L16-V22 HydrophobicContact CB-CG2 4.47Å; L16-V22 HydrophobicContact CD2-CG2 3.69Å; L16-V22 HydrophobicContact CG-CG2 3.57Å; L16-M76 HydrophobicContact CD1-CE 4.39Å; L16-M76 HydrophobicContact CD2-CE 3.38Å; L16-M76 HydrophobicContact CD2-SD 3.55Å; L16-M76 VanDerWaalsContact CD2-SD 3.55Å
17	E	85	Confident	87.5	Confident	65 Å²	65	66 Å²	66	30%	0.304	37%	0.365	S	S	.	.	H	α-helix	trans	-59.4	-40.7	173.5	-71.4	171.9	-168.8	0	0	112.4	P13 K14 T19 G20 Y160	P13-E17 PolarHBondContact O-N 2.97Å; K14-E17 PolarHBondContact O-N 3.25Å; E17-T19 PolarHBondContact O-N 3.38Å; E17-G20 PolarHBondContact O-N 2.72Å; E17-Y160 HydrophobicContact CG-CD1 4.49Å; E17-Y160 HydrophobicContact CG-CE1 3.5Å; E17-Y160 VanDerWaalsContact CG-CE1 3.5Å; E17-Y160 VanDerWaalsContact OE1-CE1 3.23Å; E17-Y160 WeakPolarHBondContact OE1-CE1 3.45Å; E17-Y160 VanDerWaalsContact OE1-CZ 3.32Å; E17-Y160 PolarHBondContact OE1-OH 3.05Å
18	R	85.3	Confident	87.9	Confident	211 Å²	211	68.5 Å²	68.5	80%	0.796	37%	0.374	S	S	*	.	H	α-helix	trans	-62.7	-24.6	178	-75	172.5	-175	-176.1	2.1	113.8	K14 Q15 L16 G20	K14-R18 VanDerWaalsContact O-CG 3.28Å; K14-R18 WeakPolarHBondContact O-CG 3.46Å; K14-R18 PolarHBondContact O-N 2.82Å; Q15-R18 PolarHBondContact O-N 2.79Å; L16-R18 VanDerWaalsContact C-N 3.32Å; L16-R18 PolarHBondContact O-N 3.01Å; R18-G20 PolarHBondContact O-N 2.68Å
19	T	84.9	Confident	88.4	Confident	84 Å²	84	64.3 Å²	64.3	52%	0.515	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-17.3	173.9	70.4	0	0	0	0	112.9	Q15 L16 E17 T21	Q15-T19 PolarHBondContact O-N 2.81Å; L16-T19 WeakPolarHBondContact O-CB 3.48Å; L16-T19 PolarHBondContact O-N 3.28Å; L16-T19 PolarHBondContact O-OG1 3.02Å; E17-T19 PolarHBondContact O-N 3.38Å; T19-T21 PolarHBondContact O-N 3.25Å; T19-T21 PolarHBondContact OG1-N 3.32Å; T19-T21 PolarHBondContact OG1-OG1 2.73Å
20	G	81.4	Confident	88.8	Confident	47 Å²	47	65.2 Å²	65.2	49%	0.485	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.7	3.1	-176.9	0	0	0	0	0	114.8	E17 R18	E17-G20 PolarHBondContact O-N 2.72Å; R18-G20 PolarHBondContact O-N 2.68Å
21	T	85	Confident	89.2	Confident	64 Å²	64	65.3 Å²	65.3	39%	0.393	34%	0.344	S	S	.	.	S	Bend	trans	-80.8	-19.2	-177.9	62.3	0	0	0	0	113.6	T19 V163	T19-T21 PolarHBondContact O-N 3.25Å; T19-T21 PolarHBondContact OG1-N 3.32Å; T19-T21 PolarHBondContact OG1-OG1 2.73Å; T21-V163 PolarHBondContact O-N 2.99Å
22	V	89.1	Confident	89.6	Confident	8 Å²	8	64.6 Å²	64.6	5%	0.048	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	158.1	-179.4	-58.5	0	0	0	0	110.9	L16 K75 Y160 T161 V163	L16-V22 HydrophobicContact CB-CG2 4.47Å; L16-V22 HydrophobicContact CD2-CG2 3.69Å; L16-V22 HydrophobicContact CG-CG2 3.57Å; V22-K75 HydrophobicContact CG1-CD 4.26Å; V22-Y160 HydrophobicContact CB-CD1 4.24Å; V22-Y160 HydrophobicContact CB-CG 4.5Å; V22-Y160 HydrophobicContact CG2-CD1 3.75Å; V22-Y160 HydrophobicContact CG2-CE1 4.38Å; V22-Y160 HydrophobicContact CG2-CG 4.18Å; V22-T161 VanDerWaalsContact CA-O 3.28Å; V22-T161 WeakPolarHBondContact CA-O 3.23Å; V22-T161 WeakPolarHBondContact CB-O 3.43Å; V22-V163 VanDerWaalsContact C-CG2 3.49Å
23	R	91.3	Very high	89.9	Confident	150 Å²	150	63 Å²	63	57%	0.566	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.4	137.8	177.8	179.1	-174.1	-63.8	-175.5	1.3	110.2	Y160 T161 V163	R23-Y160 WeakPolarHBondContact O-CA 3.12Å; R23-T161 HydrophobicContact CB-CG2 3.87Å; R23-T161 PolarHBondContact N-O 2.93Å; R23-T161 WeakPolarHBondContact O-CG2 3.34Å; R23-T161 PolarHBondContact O-N 2.91Å; R23-V163 HydrophobicContact CB-CG2 3.71Å
24	E	93.3	Very high	90.3	Very high	41 Å²	41	65.7 Å²	65.7	19%	0.192	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	132.2	173.4	-155.2	-73.1	147.6	0	0	110	G26 R46 K158 V159 Y160	E24-G26 VanDerWaalsContact OE1-CA 3.23Å; E24-G26 WeakPolarHBondContact OE1-CA 3.35Å; E24-G26 PolarHBondContact OE1-N 2.91Å; E24-G26 PolarHBondContact OE2-N 2.82Å; E24-R46 IonicContact OE1-CZ 3.51Å; E24-R46 IonicContact OE1-NH1 2.72Å; E24-R46 PolarHBondContact OE1-NH1 3.08Å; E24-R46 IonicContact OE1-NH2 3.37Å; E24-R46 PolarHBondContact OE1-NH2 2.82Å; E24-R46 IonicContact OE2-NH2 3.51Å; E24-K158 HydrophobicContact CG-CB 4.45Å; E24-V159 CarbonylContact C-O 3.6Å; E24-V159 WeakPolarHBondContact CA-O 3.39Å; E24-Y160 HydrophobicContact CB-CD1 4.29Å; E24-Y160 HydrophobicContact CB-CE1 3.88Å; E24-Y160 HydrophobicContact CG-CE1 4.16Å
25	I	93.9	Very high	90.7	Very high	3 Å²	3	62.2 Å²	62.2	2%	0.015	33%	0.333	C	S	.	.			trans	-126.6	10.3	-175.7	52.9	162.1	0	0	0	113.4	S27 Q28 F68 T72 V74 V159 T161	I25-S27 PolarHBondContact O-N 3.05Å; I25-Q28 PolarHBondContact O-N 3.13Å; I25-F68 HydrophobicContact CB-CE1 4.48Å; I25-F68 HydrophobicContact CD1-CE1 3.64Å; I25-F68 HydrophobicContact CD1-CZ 3.76Å; I25-F68 HydrophobicContact CG1-CE1 4.15Å; I25-F68 HydrophobicContact CG1-CZ 4.44Å; I25-T72 HydrophobicContact CD1-CG2 3.5Å; I25-T72 VanDerWaalsContact CD1-CG2 3.5Å; I25-V74 HydrophobicContact CD1-CG2 3.87Å; I25-V159 HydrophobicContact CD1-CG1 4.03Å; I25-V159 HydrophobicContact CG1-CB 4.17Å; I25-V159 HydrophobicContact CG1-CG1 4Å; I25-V159 WeakPolarHBondContact CG1-O 3.23Å; I25-V159 PolarHBondContact N-O 3.21Å; I25-T161 HydrophobicContact CG2-CG2 3.39Å
26	G	91	Very high	91.1	Very high	1 Å²	1	60 Å²	60	1%	0.01	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-64.8	-25.7	-179.8	0	0	0	0	0	113	E24 Q28 A29 W31 R46	E24-G26 VanDerWaalsContact OE1-CA 3.23Å; E24-G26 WeakPolarHBondContact OE1-CA 3.35Å; E24-G26 PolarHBondContact OE1-N 2.91Å; E24-G26 PolarHBondContact OE2-N 2.82Å; G26-Q28 VanDerWaalsContact C-N 3.25Å; G26-Q28 PolarHBondContact O-N 3.47Å; G26-A29 PolarHBondContact O-N 3.16Å; G26-W31 PolarHBondContact O-NE1 3.05Å; G26-R46 VanDerWaalsContact C-NH2 3.31Å
27	S	91.6	Very high	91.6	Very high	98 Å²	98	61 Å²	61	69%	0.685	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-68.2	-20.1	172.3	56.6	0	0	0	0	114.3	I25 A29	I25-S27 PolarHBondContact O-N 3.05Å; S27-A29 VanDerWaalsContact C-N 3.34Å
28	Q	91.9	Very high	92	Very high	80 Å²	80	63.9 Å²	63.9	37%	0.374	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-89.3	-4	177.4	-64.6	176.4	48.7	0	0	112.7	I25 G26	I25-Q28 PolarHBondContact O-N 3.13Å; G26-Q28 VanDerWaalsContact C-N 3.25Å; G26-Q28 PolarHBondContact O-N 3.47Å
29	A	95.1	Very high	92.3	Very high	14 Å²	14	56.6 Å²	56.6	12%	0.116	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	150.6	-178.7	0	0	0	0	0	111.9	G26 S27 I66 Q67 F68	G26-A29 PolarHBondContact O-N 3.16Å; S27-A29 VanDerWaalsContact C-N 3.34Å; A29-I66 HydrophobicContact CB-CG2 3.44Å; A29-I66 VanDerWaalsContact CB-CG2 3.44Å; A29-Q67 CarbonylContact C-O 3.58Å; A29-Q67 WeakPolarHBondContact CA-O 3.34Å; A29-F68 HydrophobicContact CB-CD1 3.78Å; A29-F68 HydrophobicContact CB-CE1 3.63Å; A29-F68 HydrophobicContact CB-CG 4.49Å; A29-F68 HydrophobicContact CB-CZ 4.22Å
30	V	96.1	Very high	92.8	Very high	103 Å²	103	55.9 Å²	55.9	62%	0.624	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.6	128.7	163.4	-179.7	0	0	0	0	107.8	Q67	V30-Q67 PolarHBondContact N-O 2.94Å; V30-Q67 PolarHBondContact O-N 3.2Å
31	W	96.6	Very high	93.4	Very high	30 Å²	30	54.1 Å²	54.1	11%	0.114	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	135.5	-178.4	-65.9	72.4	0	0	0	109.9	G26 V42 L45 V64 N65 I66 I157 V159	G26-W31 PolarHBondContact O-NE1 3.05Å; W31-V42 HydrophobicContact CB-CG1 3.62Å; W31-V42 HydrophobicContact CB-CG2 4.42Å; W31-V42 HydrophobicContact CG-CG1 4.37Å; W31-L45 HydrophobicContact CE3-CD2 4.31Å; W31-L45 HydrophobicContact CZ3-CD2 4.34Å; W31-V64 HydrophobicContact CE3-CG1 3.74Å; W31-V64 HydrophobicContact CZ3-CG1 3.91Å; W31-N65 CarbonylContact C-O 3.57Å; W31-N65 WeakPolarHBondContact CA-O 3.46Å; W31-I66 HydrophobicContact CD2-CG1 4.06Å; W31-I66 HydrophobicContact CD2-CG2 4.43Å; W31-I66 HydrophobicContact CE3-CD1 4.03Å; W31-I66 HydrophobicContact CE3-CG1 3.67Å; W31-I66 HydrophobicContact CH2-CD1 3.43Å; W31-I66 VanDerWaalsContact CH2-CD1 3.43Å; W31-I66 HydrophobicContact CH2-CG1 3.94Å; W31-I66 HydrophobicContact CZ2-CD1 4.06Å; W31-I66 HydrophobicContact CZ2-CG1 4.3Å; W31-I66 HydrophobicContact CZ2-CG2 4.12Å; W31-I66 HydrophobicContact CZ3-CD1 3.4Å; W31-I66 VanDerWaalsContact CZ3-CD1 3.4Å; W31-I66 HydrophobicContact CZ3-CG1 3.61Å; W31-I157 HydrophobicContact CH2-CB 3.99Å; W31-I157 HydrophobicContact CH2-CG2 3.68Å; W31-I157 HydrophobicContact CZ3-CB 3.94Å; W31-I157 HydrophobicContact CZ3-CD1 4.31Å; W31-I157 HydrophobicContact CZ3-CG2 3.85Å; W31-V159 HydrophobicContact CH2-CG2 3.75Å; W31-V159 HydrophobicContact CZ2-CG2 3.89Å
32	S	96.1	Very high	93.8	Very high	44 Å²	44	53 Å²	53	31%	0.308	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	148.5	171	64.5	0	0	0	0	111.3	N65	S32-N65 PolarHBondContact N-O 3.41Å; S32-N65 PolarHBondContact O-N 3.26Å; S32-N65 WeakPolarHBondContact OG-CB 3.39Å
33	L	96.8	Very high	94	Very high	30 Å²	30	58.6 Å²	58.6	16%	0.157	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	151.1	-177.4	-57.1	168.7	0	0	0	109.2	S35 C36 V42 L45 W54 L63 V64	L33-S35 VanDerWaalsContact C-N 3.28Å; L33-S35 PolarHBondContact O-N 2.93Å; L33-C36 HydrophobicContact CD1-CB 4.32Å; L33-V42 HydrophobicContact CD1-CB 4.33Å; L33-V42 HydrophobicContact CD1-CG2 3.48Å; L33-V42 VanDerWaalsContact CD1-CG2 3.48Å; L33-V42 HydrophobicContact CD2-CG2 4.4Å; L33-V42 HydrophobicContact CG-CG2 3.57Å; L33-L45 HydrophobicContact CD2-CD2 4.09Å; L33-W54 HydrophobicContact CB-CZ2 4.17Å; L33-W54 HydrophobicContact CD1-CD2 4.13Å; L33-W54 HydrophobicContact CD1-CG 3.88Å; L33-W54 HydrophobicContact CD2-CD2 3.91Å; L33-W54 HydrophobicContact CD2-CE3 4.09Å; L33-W54 HydrophobicContact CD2-CG 4.43Å; L33-W54 HydrophobicContact CD2-CH2 4.23Å; L33-W54 HydrophobicContact CD2-CZ2 4.05Å; L33-W54 HydrophobicContact CD2-CZ3 4.27Å; L33-L63 CarbonylContact C-O 3.59Å; L33-L63 VanDerWaalsContact CA-O 3.31Å; L33-L63 WeakPolarHBondContact CA-O 3.42Å; L33-V64 HydrophobicContact CD2-CB 4.15Å; L33-V64 HydrophobicContact CD2-CG1 3.92Å; L33-V64 HydrophobicContact CD2-CG2 3.73Å
34	S	95.6	Very high	94.1	Very high	56 Å²	56	53.5 Å²	53.5	39%	0.392	32%	0.324	S	S	.	.	S	Bend	trans	-62.5	-38.5	172.6	52.4	0	0	0	0	112.2	H62 L63	S34-H62 WeakPolarHBondContact OG-CA 3.34Å; S34-L63 PolarHBondContact N-O 3.2Å; S34-L63 PolarHBondContact OG-N 2.97Å
35	S	95.5	Very high	94.1	Very high	23 Å²	23	51.6 Å²	51.6	16%	0.161	32%	0.315	C	S	.	.			trans	-159.1	159	179.4	56.2	0	0	0	0	109.5	L33 W54 D57	L33-S35 VanDerWaalsContact C-N 3.28Å; L33-S35 PolarHBondContact O-N 2.93Å; S35-W54 PolarHBondContact O-NE1 2.86Å; S35-D57 WeakPolarHBondContact CB-O 3.26Å; S35-D57 PolarHBondContact OG-N 3.37Å; S35-D57 PolarHBondContact OG-O 3.02Å
36	C	94.6	Very high	94.1	Very high	67 Å²	67	54.2 Å²	54.2	45%	0.453	33%	0.325	S	S	.	.			trans	-153	147.6	171.7	54.9	0	0	0	0	110.2	L33 Q55	L33-C36 HydrophobicContact CD1-CB 4.32Å; C36-Q55 WeakPolarHBondContact CA-O 3.28Å
37	K	93.6	Very high	94.2	Very high	62 Å²	62	57.3 Å²	57.3	27%	0.27	34%	0.341	S	S	.	.	B	Isolated β-bridge	trans	-73.7	147.3	163.6	-70.5	-164.8	179	168.1	0	110.4	G39 F40 Q55 D57	K37-G39 PolarHBondContact O-N 2.88Å; K37-F40 HydrophobicContact CB-CB 4.37Å; K37-F40 HydrophobicContact CB-CD2 4.11Å; K37-F40 PolarHBondContact O-N 2.86Å; K37-Q55 HydrophobicContact CD-CG 4.05Å; K37-Q55 HydrophobicContact CG-CG 4.25Å; K37-Q55 PolarHBondContact N-O 3.19Å; K37-D57 HydrophobicContact CG-CB 3.81Å
38	P	92.6	Very high	94.2	Very high	126 Å²	126	57 Å²	57	82%	0.818	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	125	173.3	-25	34.3	0	0	0	111.1
39	G	92.6	Very high	94.3	Very high	57 Å²	57	56.1 Å²	56.1	59%	0.588	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.2	-3	-177.9	0	0	0	0	0	115.9	K37 Q44	K37-G39 PolarHBondContact O-N 2.88Å; G39-Q44 PolarHBondContact O-NE2 2.83Å; G39-Q44 PolarHBondContact O-OE1 2.89Å
40	F	94.2	Very high	94.1	Very high	69 Å²	69	58.5 Å²	58.5	30%	0.303	34%	0.34	S	S	.	.	B	Isolated β-bridge	trans	-129.2	61.7	178.6	-60	-88.3	0	0	0	109.6	K37 Y53 W54 Q55	K37-F40 HydrophobicContact CB-CB 4.37Å; K37-F40 HydrophobicContact CB-CD2 4.11Å; K37-F40 PolarHBondContact O-N 2.86Å; F40-Y53 AromaticContact CD1-CD2 3.83Å; F40-Y53 HydrophobicContact CD1-CD2 3.83Å; F40-Y53 AromaticContact CD1-CE2 3.53Å; F40-Y53 HydrophobicContact CD1-CE2 3.53Å; F40-Y53 WeakPolarHBondContact CD1-O 3.33Å; F40-Y53 HydrophobicContact CE1-CD2 4.3Å; F40-Y53 HydrophobicContact CE1-CE1 4.41Å; F40-Y53 AromaticContact CE1-CE2 3.61Å; F40-Y53 HydrophobicContact CE1-CE2 3.61Å; F40-Y53 AromaticContact CE1-CZ 3.67Å; F40-Y53 HydrophobicContact CG-CE2 4.49Å; F40-W54 VanDerWaalsContact O-CD1 3.26Å; F40-Q55 HydrophobicContact CB-CB 3.85Å; F40-Q55 HydrophobicContact CG-CB 4.28Å; F40-Q55 PolarHBondContact O-N 2.91Å
41	G	93.9	Very high	94	Very high	11 Å²	11	60.9 Å²	60.9	11%	0.113	34%	0.344	C	S	.	.	S	Bend	trans	-111.5	-149.6	-172.8	0	0	0	0	0	114	D43	G41-D43 VanDerWaalsContact C-N 3.28Å; G41-D43 PolarHBondContact O-N 2.93Å
42	V	93.9	Very high	93.9	Very high	41 Å²	41	61.2 Å²	61.2	25%	0.248	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-35.2	179.9	173.7	0	0	0	0	111.8	W31 L33 Q44 L45 R46	W31-V42 HydrophobicContact CB-CG1 3.62Å; W31-V42 HydrophobicContact CB-CG2 4.42Å; W31-V42 HydrophobicContact CG-CG1 4.37Å; L33-V42 HydrophobicContact CD1-CB 4.33Å; L33-V42 HydrophobicContact CD1-CG2 3.48Å; L33-V42 VanDerWaalsContact CD1-CG2 3.48Å; L33-V42 HydrophobicContact CD2-CG2 4.4Å; L33-V42 HydrophobicContact CG-CG2 3.57Å; V42-Q44 VanDerWaalsContact C-N 3.33Å; V42-Q44 PolarHBondContact O-N 2.79Å; V42-L45 WeakPolarHBondContact O-CB 3.46Å; V42-L45 PolarHBondContact O-N 2.8Å; V42-L45 VanDerWaalsContact O-N 3.08Å; V42-R46 HydrophobicContact CG1-CG 4.45Å; V42-R46 PolarHBondContact O-N 2.87Å
43	D	93.6	Very high	93.9	Very high	125 Å²	125	61.8 Å²	61.8	67%	0.668	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-44	-175.3	-60	-32.8	0	0	0	111	G41 L45 R46 D47	G41-D43 VanDerWaalsContact C-N 3.28Å; G41-D43 PolarHBondContact O-N 2.93Å; D43-L45 VanDerWaalsContact C-N 3.26Å; D43-L45 PolarHBondContact O-N 3.4Å; D43-R46 PolarHBondContact O-N 3.03Å; D43-D47 WeakPolarHBondContact O-CB 3.24Å; D43-D47 PolarHBondContact O-N 3.31Å; D43-D47 VanDerWaalsContact O-N 3.12Å
44	Q	94.3	Very high	93.9	Very high	43 Å²	43	60.3 Å²	60.3	20%	0.201	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-23.7	177	-70.6	70.9	37.9	0	0	113	G39 V42 R46 T52 Y53 R155	G39-Q44 PolarHBondContact O-NE2 2.83Å; G39-Q44 PolarHBondContact O-OE1 2.89Å; V42-Q44 VanDerWaalsContact C-N 3.33Å; V42-Q44 PolarHBondContact O-N 2.79Å; Q44-R46 PolarHBondContact O-N 2.92Å; Q44-T52 HydrophobicContact CG-CG2 4.41Å; Q44-Y53 WeakPolarHBondContact CB-O 3.35Å; Q44-R155 VanDerWaalsContact O-O 3.09Å
45	L	92.8	Very high	94	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-5.4	177.4	-165	69.5	0	0	0	113.2	W31 L33 V42 D43 W54 V64 M154 Q156 I157	W31-L45 HydrophobicContact CE3-CD2 4.31Å; W31-L45 HydrophobicContact CZ3-CD2 4.34Å; L33-L45 HydrophobicContact CD2-CD2 4.09Å; V42-L45 WeakPolarHBondContact O-CB 3.46Å; V42-L45 PolarHBondContact O-N 2.8Å; V42-L45 VanDerWaalsContact O-N 3.08Å; D43-L45 VanDerWaalsContact C-N 3.26Å; D43-L45 PolarHBondContact O-N 3.4Å; L45-W54 HydrophobicContact CB-CB 4.38Å; L45-W54 HydrophobicContact CD1-CB 3.97Å; L45-V64 HydrophobicContact CD2-CG1 4.01Å; L45-V64 HydrophobicContact CD2-CG2 4.41Å; L45-M154 HydrophobicContact CD1-CB 3.57Å; L45-M154 WeakPolarHBondContact CD1-O 3.44Å; L45-Q156 PolarHBondContact O-OE1 2.72Å; L45-I157 HydrophobicContact CD1-CD1 3.89Å; L45-I157 HydrophobicContact CD1-CG1 3.73Å; L45-I157 HydrophobicContact CD2-CD1 3.7Å; L45-I157 HydrophobicContact CD2-CG1 4.16Å; L45-I157 HydrophobicContact CG-CB 4.33Å; L45-I157 HydrophobicContact CG-CD1 3.97Å; L45-I157 HydrophobicContact CG-CG1 3.88Å; L45-I157 PolarHBondContact O-N 2.79Å
46	R	93.7	Very high	94	Very high	58 Å²	58	57.3 Å²	57.3	22%	0.219	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-136.9	-1.7	-166.4	-71.2	-70.2	-56.4	165.4	3.8	113.4	E24 G26 V42 D43 Q44 D48 Q156 I157	E24-R46 IonicContact OE1-CZ 3.51Å; E24-R46 IonicContact OE1-NH1 2.72Å; E24-R46 PolarHBondContact OE1-NH1 3.08Å; E24-R46 IonicContact OE1-NH2 3.37Å; E24-R46 PolarHBondContact OE1-NH2 2.82Å; E24-R46 IonicContact OE2-NH2 3.51Å; G26-R46 VanDerWaalsContact C-NH2 3.31Å; V42-R46 HydrophobicContact CG1-CG 4.45Å; V42-R46 PolarHBondContact O-N 2.87Å; D43-R46 PolarHBondContact O-N 3.03Å; Q44-R46 PolarHBondContact O-N 2.92Å; R46-D48 VanDerWaalsContact C-N 3.27Å; R46-D48 PolarHBondContact O-N 3.39Å; R46-Q156 VanDerWaalsContact CA-OE1 3.31Å; R46-Q156 VanDerWaalsContact N-OE1 3.14Å; R46-I157 PolarHBondContact NH1-O 3.42Å
47	D	92.6	Very high	94	Very high	67 Å²	67	58.1 Å²	58.1	36%	0.358	32%	0.315	S	S	.	.	S	Bend	trans	-81.2	-1.1	-172.2	64.4	7	0	0	0	114.4	D43 N49 T52	D43-D47 WeakPolarHBondContact O-CB 3.24Å; D43-D47 PolarHBondContact O-N 3.31Å; D43-D47 VanDerWaalsContact O-N 3.12Å; D47-N49 PolarHBondContact O-N 2.84Å; D47-N49 WeakPolarHBondContact OD1-CB 3.4Å; D47-N49 PolarHBondContact OD1-N 3.19Å; D47-T52 PolarHBondContact OD1-OG1 3.16Å; D47-T52 VanDerWaalsContact OD1-OG1 3.05Å; D47-T52 VanDerWaalsContact OD2-CB 3.3Å; D47-T52 WeakPolarHBondContact OD2-CB 3.4Å; D47-T52 WeakPolarHBondContact OD2-CG2 3.34Å; D47-T52 PolarHBondContact OD2-OG1 2.89Å
48	D	92.3	Very high	94	Very high	92 Å²	92	56.2 Å²	56.2	49%	0.492	31%	0.313	S	S	.	.	S	Bend	trans	63.1	17	-176.7	-78.2	-45.4	0	0	0	114.2	R46 Q156 K158	R46-D48 VanDerWaalsContact C-N 3.27Å; R46-D48 PolarHBondContact O-N 3.39Å; D48-Q156 VanDerWaalsContact N-NE2 3.1Å; D48-Q156 PolarHBondContact OD1-NE2 2.86Å; D48-K158 WeakPolarHBondContact OD1-CE 3.42Å; D48-K158 IonicContact OD1-NZ 3.93Å; D48-K158 PolarHBondContact OD1-NZ 2.98Å; D48-K158 IonicContact OD2-NZ 3.03Å
49	N	92.7	Very high	94	Very high	61 Å²	61	55.2 Å²	55.2	33%	0.326	31%	0.309	S	S	.	.			trans	-101.6	135.9	170.1	-171.8	0.3	0	0	0	110	D47 E51 T52	D47-N49 PolarHBondContact O-N 2.84Å; D47-N49 WeakPolarHBondContact OD1-CB 3.4Å; D47-N49 PolarHBondContact OD1-N 3.19Å; N49-E51 WeakPolarHBondContact OD1-CB 3.44Å; N49-E51 PolarHBondContact OD1-N 2.88Å; N49-T52 WeakPolarHBondContact CB-OG1 3.48Å; N49-T52 PolarHBondContact O-OG1 3.19Å
50	L	92.4	Very high	94	Very high	63 Å²	63	56.4 Å²	56.4	33%	0.33	30%	0.299	S	S	.	.	S	Bend	trans	-90.1	-10.4	178.9	-60.5	-179.2	0	0	0	112.3	Y80 W119 R155 Q156	L50-Y80 HydrophobicContact CB-CE1 4.42Å; L50-Y80 HydrophobicContact CD1-CD2 4.32Å; L50-Y80 HydrophobicContact CD1-CE1 4.49Å; L50-Y80 HydrophobicContact CD1-CE2 3.76Å; L50-Y80 HydrophobicContact CD2-CD1 3.99Å; L50-Y80 HydrophobicContact CD2-CD2 3.81Å; L50-Y80 HydrophobicContact CD2-CE1 4.22Å; L50-Y80 HydrophobicContact CD2-CE2 4.06Å; L50-Y80 HydrophobicContact CD2-CG 3.74Å; L50-Y80 HydrophobicContact CG-CE2 4.49Å; L50-W119 HydrophobicContact CD2-CZ2 4.09Å; L50-R155 WeakPolarHBondContact O-CD 3.26Å; L50-R155 PolarHBondContact O-NH1 3.21Å; L50-Q156 HydrophobicContact CD2-CB 4.25Å
51	E	93.1	Very high	94.1	Very high	153 Å²	153	55.9 Å²	55.9	72%	0.715	30%	0.303	S	S	*	.	S	Bend	trans	-81.9	-31.4	178.2	-62.2	-177.2	162.4	0	0	112.3	N49 Y53 R155	N49-E51 WeakPolarHBondContact OD1-CB 3.44Å; N49-E51 PolarHBondContact OD1-N 2.88Å; E51-Y53 WeakPolarHBondContact O-CD1 3.18Å; E51-R155 PolarHBondContact O-NH1 3.2Å
52	T	95.2	Very high	94.2	Very high	38 Å²	38	55.3 Å²	55.3	23%	0.233	30%	0.297	C	S	.	.			trans	-82.9	157.8	175.3	49.3	0	0	0	0	110.8	Q44 D47 N49 R155	Q44-T52 HydrophobicContact CG-CG2 4.41Å; D47-T52 PolarHBondContact OD1-OG1 3.16Å; D47-T52 VanDerWaalsContact OD1-OG1 3.05Å; D47-T52 VanDerWaalsContact OD2-CB 3.3Å; D47-T52 WeakPolarHBondContact OD2-CB 3.4Å; D47-T52 WeakPolarHBondContact OD2-CG2 3.34Å; D47-T52 PolarHBondContact OD2-OG1 2.89Å; N49-T52 WeakPolarHBondContact CB-OG1 3.48Å; N49-T52 PolarHBondContact O-OG1 3.19Å; T52-R155 WeakPolarHBondContact O-CA 3.47Å
53	Y	96.4	Very high	94.4	Very high	55 Å²	55	55.1 Å²	55.1	22%	0.216	30%	0.295	C	S	.	.			trans	-155.7	152.5	-178.5	48	-89.9	0	0	0	111.7	F40 Q44 E51 Q55 H153 M154	F40-Y53 AromaticContact CD1-CD2 3.83Å; F40-Y53 HydrophobicContact CD1-CD2 3.83Å; F40-Y53 AromaticContact CD1-CE2 3.53Å; F40-Y53 HydrophobicContact CD1-CE2 3.53Å; F40-Y53 WeakPolarHBondContact CD1-O 3.33Å; F40-Y53 HydrophobicContact CE1-CD2 4.3Å; F40-Y53 HydrophobicContact CE1-CE1 4.41Å; F40-Y53 AromaticContact CE1-CE2 3.61Å; F40-Y53 HydrophobicContact CE1-CE2 3.61Å; F40-Y53 AromaticContact CE1-CZ 3.67Å; F40-Y53 HydrophobicContact CG-CE2 4.49Å; Q44-Y53 WeakPolarHBondContact CB-O 3.35Å; E51-Y53 WeakPolarHBondContact O-CD1 3.18Å; Y53-Q55 HydrophobicContact CD2-CB 4.21Å; Y53-Q55 HydrophobicContact CE2-CB 4.27Å; Y53-H153 HydrophobicContact CD2-CB 4.36Å; Y53-H153 AromaticContact CD2-CD2 3.72Å; Y53-H153 AromaticContact CD2-CE1 3.98Å; Y53-H153 AromaticContact CD2-CG 3.77Å; Y53-H153 AromaticContact CD2-ND1 3.92Å; Y53-H153 AromaticContact CD2-NE2 3.89Å; Y53-H153 AromaticContact CE2-CD2 3.88Å; Y53-H153 AromaticContact CE2-CE1 3.51Å; Y53-H153 AromaticContact CE2-ND1 3.87Å; Y53-H153 AromaticContact CE2-NE2 3.52Å; Y53-H153 AromaticContact CZ-CE1 3.94Å; Y53-M154 WeakPolarHBondContact CA-O 3.48Å
54	W	96.9	Very high	94.6	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	133.1	157	166.3	42.8	0	0	0	109.1	L33 S35 F40 L45 H62 V64 T152 H153 M154	L33-W54 HydrophobicContact CB-CZ2 4.17Å; L33-W54 HydrophobicContact CD1-CD2 4.13Å; L33-W54 HydrophobicContact CD1-CG 3.88Å; L33-W54 HydrophobicContact CD2-CD2 3.91Å; L33-W54 HydrophobicContact CD2-CE3 4.09Å; L33-W54 HydrophobicContact CD2-CG 4.43Å; L33-W54 HydrophobicContact CD2-CH2 4.23Å; L33-W54 HydrophobicContact CD2-CZ2 4.05Å; L33-W54 HydrophobicContact CD2-CZ3 4.27Å; S35-W54 PolarHBondContact O-NE1 2.86Å; F40-W54 VanDerWaalsContact O-CD1 3.26Å; L45-W54 HydrophobicContact CB-CB 4.38Å; L45-W54 HydrophobicContact CD1-CB 3.97Å; W54-H62 HydrophobicContact CH2-CB 3.82Å; W54-H62 HydrophobicContact CZ2-CB 4.28Å; W54-V64 HydrophobicContact CE3-CG2 3.86Å; W54-V64 HydrophobicContact CH2-CG2 3.81Å; W54-V64 HydrophobicContact CZ3-CG2 3.26Å; W54-T152 HydrophobicContact CE3-CG2 4.49Å; W54-T152 HydrophobicContact CH2-CG2 4.17Å; W54-T152 HydrophobicContact CZ3-CG2 4.03Å; W54-H153 WeakPolarHBondContact O-CA 3.39Å; W54-M154 HydrophobicContact CE3-CB 3.95Å; W54-M154 HydrophobicContact CE3-CG 3.92Å; W54-M154 HydrophobicContact CE3-SD 3.79Å; W54-M154 HydrophobicContact CZ3-CG 4.15Å; W54-M154 HydrophobicContact CZ3-SD 3.56Å; W54-M154 VanDerWaalsContact CZ3-SD 3.56Å; W54-M154 PolarHBondContact N-O 3.35Å; W54-M154 PolarHBondContact O-N 3.12Å; W54-M154 VanDerWaalsContact O-N 3.11Å
55	Q	96.6	Very high	94.7	Very high	15 Å²	15	47.7 Å²	47.7	7%	0.07	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	119.9	167.3	-179	168	5.9	0	0	109.4	C36 K37 F40 Y53 T152	C36-Q55 WeakPolarHBondContact CA-O 3.28Å; K37-Q55 HydrophobicContact CD-CG 4.05Å; K37-Q55 HydrophobicContact CG-CG 4.25Å; K37-Q55 PolarHBondContact N-O 3.19Å; F40-Q55 HydrophobicContact CB-CB 3.85Å; F40-Q55 HydrophobicContact CG-CB 4.28Å; F40-Q55 PolarHBondContact O-N 2.91Å; Y53-Q55 HydrophobicContact CD2-CB 4.21Å; Y53-Q55 HydrophobicContact CE2-CB 4.27Å; Q55-T152 WeakPolarHBondContact CA-O 3.39Å
56	S	96.5	Very high	94.9	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.256	C	S	.	.			trans	-71.6	157.9	172.9	69.7	0	0	0	0	111.7	H62 D151 T152	S56-H62 VanDerWaalsContact CB-ND1 3.32Å; S56-H62 WeakPolarHBondContact CB-ND1 3.37Å; S56-H62 PolarHBondContact OG-CD2 3.08Å; S56-H62 PolarHBondContact OG-CE1 2.72Å; S56-H62 PolarHBondContact OG-ND1 3.31Å; S56-H62 VanDerWaalsContact OG-ND1 3.14Å; S56-H62 PolarHBondContact OG-NE2 3.42Å; S56-H62 VanDerWaalsContact OG-NE2 3.11Å; S56-D151 VanDerWaalsContact O-CB 3.27Å; S56-D151 WeakPolarHBondContact O-CB 3.12Å; S56-D151 WeakPolarHBondContact OG-CA 3.31Å; S56-T152 PolarHBondContact N-O 3.43Å; S56-T152 PolarHBondContact OG-N 3.5Å
57	D	94.4	Very high	95	Very high	85 Å²	85	48 Å²	48	46%	0.455	26%	0.26	S	S	.	.			trans	-148.5	83	175.9	-169.8	1.1	0	0	0	109.2	S35 K37	S35-D57 WeakPolarHBondContact CB-O 3.26Å; S35-D57 PolarHBondContact OG-N 3.37Å; S35-D57 PolarHBondContact OG-O 3.02Å; K37-D57 HydrophobicContact CG-CB 3.81Å
58	G	92.4	Very high	95.1	Very high	21 Å²	21	45.4 Å²	45.4	22%	0.216	25%	0.246	C	C	.	.	S	Bend	trans	178.5	-169.6	-172.4	0	0	0	0	0	114.6	H62	G58-H62 PolarHBondContact O-CE1 3.23Å
59	S	93.7	Very high	95	Very high	106 Å²	106	52.9 Å²	52.9	74%	0.741	27%	0.267	S	S	*	.	S	Bend	trans	-81.1	138.9	173.8	54.5	0	0	0	0	111.1
60	Q	92.2	Very high	95	Very high	82 Å²	82	57.9 Å²	57.9	38%	0.383	28%	0.281	S	S	.	.	S	Bend	trans	-63.3	149.3	169.1	-71.6	174.7	-3.4	0	0	111.2	N145 G149 R150	Q60-N145 PolarHBondContact NE2-ND2 2.9Å; Q60-G149 PolarHBondContact NE2-O 2.97Å; Q60-R150 PolarHBondContact NE2-O 2.76Å
61	P	96.1	Very high	95.1	Very high	57 Å²	57	62.5 Å²	62.5	37%	0.37	29%	0.294	S	S	.	.	S	Bend	cis	-78.3	143.1	0.2	31.9	-35.2	0	0	0	113.3	L63 V142 L143	P61-L63 HydrophobicContact CB-CD2 4.21Å; P61-L63 HydrophobicContact CG-CD2 4.12Å; P61-V142 VanDerWaalsContact CA-O 3.23Å; P61-V142 WeakPolarHBondContact CA-O 3.45Å; P61-V142 WeakPolarHBondContact CB-O 3.44Å; P61-L143 HydrophobicContact CB-CD2 3.94Å
62	H	97.3	Very high	95.1	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	131.6	173.2	-55.2	-63.2	0	0	0	109.6	S34 W54 S56 G58 A141 V142 R150 T152	S34-H62 WeakPolarHBondContact OG-CA 3.34Å; W54-H62 HydrophobicContact CH2-CB 3.82Å; W54-H62 HydrophobicContact CZ2-CB 4.28Å; S56-H62 VanDerWaalsContact CB-ND1 3.32Å; S56-H62 WeakPolarHBondContact CB-ND1 3.37Å; S56-H62 PolarHBondContact OG-CD2 3.08Å; S56-H62 PolarHBondContact OG-CE1 2.72Å; S56-H62 PolarHBondContact OG-ND1 3.31Å; S56-H62 VanDerWaalsContact OG-ND1 3.14Å; S56-H62 PolarHBondContact OG-NE2 3.42Å; S56-H62 VanDerWaalsContact OG-NE2 3.11Å; G58-H62 PolarHBondContact O-CE1 3.23Å; H62-A141 WeakPolarHBondContact O-CA 3.48Å; H62-V142 HydrophobicContact CB-CB 4.27Å; H62-V142 PolarHBondContact N-O 2.97Å; H62-V142 VanDerWaalsContact N-O 3.1Å; H62-V142 PolarHBondContact O-N 2.8Å; H62-R150 PolarHBondContact NE2-O 2.75Å; H62-T152 HydrophobicContact CB-CG2 3.96Å
63	L	96.8	Very high	95	Very high	37 Å²	37	56.1 Å²	56.1	19%	0.194	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	135	-168.6	-51.4	176.2	0	0	0	111.3	L33 S34 P61 Q139 I140 A141	L33-L63 CarbonylContact C-O 3.59Å; L33-L63 VanDerWaalsContact CA-O 3.31Å; L33-L63 WeakPolarHBondContact CA-O 3.42Å; S34-L63 PolarHBondContact N-O 3.2Å; S34-L63 PolarHBondContact OG-N 2.97Å; P61-L63 HydrophobicContact CB-CD2 4.21Å; P61-L63 HydrophobicContact CG-CD2 4.12Å; L63-Q139 HydrophobicContact CD2-CG 4.36Å; L63-I140 CarbonylContact C-O 3.57Å; L63-I140 WeakPolarHBondContact CA-O 3.47Å; L63-A141 HydrophobicContact CD2-CB 3.54Å
64	V	97.5	Very high	94.9	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	115.9	162.6	-172.1	0	0	0	0	107.9	W31 L33 L45 W54 I66 Q139 I140 M154 I157	W31-V64 HydrophobicContact CE3-CG1 3.74Å; W31-V64 HydrophobicContact CZ3-CG1 3.91Å; L33-V64 HydrophobicContact CD2-CB 4.15Å; L33-V64 HydrophobicContact CD2-CG1 3.92Å; L33-V64 HydrophobicContact CD2-CG2 3.73Å; L45-V64 HydrophobicContact CD2-CG1 4.01Å; L45-V64 HydrophobicContact CD2-CG2 4.41Å; W54-V64 HydrophobicContact CE3-CG2 3.86Å; W54-V64 HydrophobicContact CH2-CG2 3.81Å; W54-V64 HydrophobicContact CZ3-CG2 3.26Å; V64-I66 HydrophobicContact CG1-CG1 4.29Å; V64-Q139 CarbonylContact O-C 3.59Å; V64-Q139 WeakPolarHBondContact O-CA 3.37Å; V64-I140 HydrophobicContact CB-CB 4.18Å; V64-I140 HydrophobicContact CB-CD1 4.41Å; V64-I140 PolarHBondContact N-O 3.4Å; V64-I140 PolarHBondContact O-N 2.78Å; V64-M154 HydrophobicContact CG2-SD 4.11Å; V64-I157 HydrophobicContact CB-CD1 4.44Å; V64-I157 HydrophobicContact CG1-CD1 4.15Å; V64-I157 HydrophobicContact CG2-CD1 4.1Å
65	N	96.8	Very high	94.6	Very high	12 Å²	12	57.2 Å²	57.2	6%	0.064	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	131.2	178.2	-59.8	-57.5	0	0	0	109.5	W31 S32 F102 M137 Q139	W31-N65 CarbonylContact C-O 3.57Å; W31-N65 WeakPolarHBondContact CA-O 3.46Å; S32-N65 PolarHBondContact N-O 3.41Å; S32-N65 PolarHBondContact O-N 3.26Å; S32-N65 WeakPolarHBondContact OG-CB 3.39Å; N65-F102 HydrophobicContact CB-CE1 4.29Å; N65-M137 HydrophobicContact CB-CE 3.71Å; N65-M137 VanDerWaalsContact OD1-CE 3.24Å; N65-M137 WeakPolarHBondContact OD1-CE 3.46Å; N65-Q139 WeakPolarHBondContact OD1-CG 3.18Å; N65-Q139 PolarHBondContact OD1-NE2 3.34Å
66	I	96.7	Very high	94.5	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	109.7	-177.5	-50.6	173.3	0	0	0	106.7	A29 W31 V64 F68 M137 I138 I140 V159	A29-I66 HydrophobicContact CB-CG2 3.44Å; A29-I66 VanDerWaalsContact CB-CG2 3.44Å; W31-I66 HydrophobicContact CD2-CG1 4.06Å; W31-I66 HydrophobicContact CD2-CG2 4.43Å; W31-I66 HydrophobicContact CE3-CD1 4.03Å; W31-I66 HydrophobicContact CE3-CG1 3.67Å; W31-I66 HydrophobicContact CH2-CD1 3.43Å; W31-I66 VanDerWaalsContact CH2-CD1 3.43Å; W31-I66 HydrophobicContact CH2-CG1 3.94Å; W31-I66 HydrophobicContact CZ2-CD1 4.06Å; W31-I66 HydrophobicContact CZ2-CG1 4.3Å; W31-I66 HydrophobicContact CZ2-CG2 4.12Å; W31-I66 HydrophobicContact CZ3-CD1 3.4Å; W31-I66 VanDerWaalsContact CZ3-CD1 3.4Å; W31-I66 HydrophobicContact CZ3-CG1 3.61Å; V64-I66 HydrophobicContact CG1-CG1 4.29Å; I66-F68 HydrophobicContact CG2-CE1 4.46Å; I66-F68 HydrophobicContact CG2-CE2 4.1Å; I66-F68 HydrophobicContact CG2-CZ 3.87Å; I66-M137 CarbonylContact O-C 3.49Å; I66-M137 WeakPolarHBondContact O-CA 3.27Å; I66-I138 HydrophobicContact CB-CB 4.27Å; I66-I138 PolarHBondContact N-O 3.49Å; I66-I138 PolarHBondContact O-N 2.88Å; I66-I140 HydrophobicContact CD1-CD1 3.99Å; I66-V159 HydrophobicContact CD1-CG2 3.82Å
67	Q	96	Very high	94.4	Very high	65 Å²	65	57.6 Å²	57.6	30%	0.304	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	124.9	-176	-69.5	-172.6	-14.7	0	0	111.3	A29 V30 M137	A29-Q67 CarbonylContact C-O 3.58Å; A29-Q67 WeakPolarHBondContact CA-O 3.34Å; V30-Q67 PolarHBondContact N-O 2.94Å; V30-Q67 PolarHBondContact O-N 3.2Å; Q67-M137 HydrophobicContact CG-CB 4.39Å; Q67-M137 HydrophobicContact CG-CG 3.9Å; Q67-M137 HydrophobicContact CG-SD 4.15Å
68	F	95.1	Very high	94.4	Very high	12 Å²	12	53.5 Å²	53.5	5%	0.053	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	141.3	176.9	-60.1	-78.6	0	0	0	110.7	I25 A29 I66 R70 T72 V74 F136 I138 V159	I25-F68 HydrophobicContact CB-CE1 4.48Å; I25-F68 HydrophobicContact CD1-CE1 3.64Å; I25-F68 HydrophobicContact CD1-CZ 3.76Å; I25-F68 HydrophobicContact CG1-CE1 4.15Å; I25-F68 HydrophobicContact CG1-CZ 4.44Å; A29-F68 HydrophobicContact CB-CD1 3.78Å; A29-F68 HydrophobicContact CB-CE1 3.63Å; A29-F68 HydrophobicContact CB-CG 4.49Å; A29-F68 HydrophobicContact CB-CZ 4.22Å; I66-F68 HydrophobicContact CG2-CE1 4.46Å; I66-F68 HydrophobicContact CG2-CE2 4.1Å; I66-F68 HydrophobicContact CG2-CZ 3.87Å; F68-R70 VanDerWaalsContact CB-O 3.25Å; F68-R70 WeakPolarHBondContact CB-O 3.46Å; F68-R70 PolarHBondContact O-N 2.83Å; F68-T72 HydrophobicContact CD1-CG2 4.23Å; F68-T72 HydrophobicContact CE1-CG2 4.37Å; F68-T72 HydrophobicContact CG-CG2 4.47Å; F68-V74 HydrophobicContact CE2-CG2 4.15Å; F68-V74 HydrophobicContact CZ-CG2 4.26Å; F68-F136 PolarHBondContact N-O 2.92Å; F68-I138 HydrophobicContact CE2-CD1 3.95Å; F68-I138 HydrophobicContact CE2-CG1 4.2Å; F68-I138 HydrophobicContact CZ-CD1 4.47Å; F68-V159 HydrophobicContact CZ-CG1 4.19Å
69	R	91	Very high	94.5	Very high	248 Å²	248	52.6 Å²	52.6	94%	0.936	24%	0.242	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-62.8	-27	175.6	-177.7	174.9	176.7	167.8	0.6	113.2
70	R	92.7	Very high	94.7	Very high	166 Å²	166	49.5 Å²	49.5	63%	0.626	21%	0.214	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-132.4	157.8	178.7	61.7	179.9	175.6	175.8	-1.8	109.5	F68 T72	F68-R70 VanDerWaalsContact CB-O 3.25Å; F68-R70 WeakPolarHBondContact CB-O 3.46Å; F68-R70 PolarHBondContact O-N 2.83Å; R70-T72 PolarHBondContact O-N 2.84Å; R70-T72 PolarHBondContact O-OG1 2.81Å
71	R	92.8	Very high	94.8	Very high	160 Å²	160	45.6 Å²	45.6	60%	0.604	20%	0.197	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-56.3	114.9	172	-166.2	176.7	-178.4	-172.4	-3.5	108.5	S134 F136	R71-S134 PolarHBondContact NE-O 3.45Å; R71-S134 PolarHBondContact NH2-O 3.1Å; R71-F136 HydrophobicContact CB-CD1 4.5Å; R71-F136 HydrophobicContact CB-CD2 4.22Å; R71-F136 HydrophobicContact CB-CE1 4.07Å; R71-F136 HydrophobicContact CB-CE2 3.75Å; R71-F136 HydrophobicContact CB-CZ 3.68Å; R71-F136 HydrophobicContact CG-CD2 4.28Å; R71-F136 HydrophobicContact CG-CE2 4.03Å; R71-F136 HydrophobicContact CG-CZ 4.46Å; R71-F136 VanDerWaalsContact N-CE1 3.28Å
72	T	93.4	Very high	94.7	Very high	12 Å²	12	43.9 Å²	43.9	7%	0.074	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	132.2	-171.5	-59.5	0	0	0	0	109.1	I25 F68 R70 V74 S134 T135	I25-T72 HydrophobicContact CD1-CG2 3.5Å; I25-T72 VanDerWaalsContact CD1-CG2 3.5Å; F68-T72 HydrophobicContact CD1-CG2 4.23Å; F68-T72 HydrophobicContact CE1-CG2 4.37Å; F68-T72 HydrophobicContact CG-CG2 4.47Å; R70-T72 PolarHBondContact O-N 2.84Å; R70-T72 PolarHBondContact O-OG1 2.81Å; T72-V74 HydrophobicContact CG2-CG2 4.43Å; T72-S134 WeakPolarHBondContact O-CA 3.3Å; T72-T135 PolarHBondContact N-O 3.29Å; T72-T135 PolarHBondContact O-N 2.82Å
73	T	93.9	Very high	94.5	Very high	45 Å²	45	46.1 Å²	46.1	28%	0.276	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	124.2	175.4	-52	0	0	0	0	109	P132 S134 T161 P162	T73-P132 HydrophobicContact CG2-CB 3.51Å; T73-P132 HydrophobicContact CG2-CG 4.39Å; T73-S134 PolarHBondContact OG1-OG 2.82Å; T73-S134 VanDerWaalsContact OG1-OG 3.13Å; T73-T161 WeakPolarHBondContact O-CA 3.46Å; T73-T161 VanDerWaalsContact O-CB 3.26Å; T73-T161 WeakPolarHBondContact O-CB 3.41Å; T73-T161 PolarHBondContact O-OG1 3.42Å; T73-P162 HydrophobicContact CG2-CG 3.7Å
74	V	93.8	Very high	94.3	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	129.4	179.9	-170.2	0	0	0	0	108.6	I25 F68 T72 L124 I133 I138 V159 Y160	I25-V74 HydrophobicContact CD1-CG2 3.87Å; F68-V74 HydrophobicContact CE2-CG2 4.15Å; F68-V74 HydrophobicContact CZ-CG2 4.26Å; T72-V74 HydrophobicContact CG2-CG2 4.43Å; V74-L124 HydrophobicContact CB-CD1 4.33Å; V74-L124 HydrophobicContact CG1-CD1 3.78Å; V74-I133 PolarHBondContact N-O 3.44Å; V74-I133 PolarHBondContact O-N 3.28Å; V74-I133 VanDerWaalsContact O-N 3.16Å; V74-I138 HydrophobicContact CB-CD1 4.09Å; V74-I138 HydrophobicContact CG1-CD1 3.94Å; V74-I138 HydrophobicContact CG2-CD1 3.8Å; V74-V159 HydrophobicContact CG1-CG1 3.44Å; V74-V159 VanDerWaalsContact CG1-CG1 3.44Å; V74-V159 HydrophobicContact CG2-CG1 4.37Å; V74-Y160 WeakPolarHBondContact CG1-O 3.46Å
75	K	92	Very high	94.1	Very high	78 Å²	78	56 Å²	56	34%	0.339	24%	0.244	S	C	.	.			trans	-103.7	-38.7	-178.7	176.9	174	-177.9	-179.2	0	111.8	V22 L124 L125 P132 Y160 P162	V22-K75 HydrophobicContact CG1-CD 4.26Å; K75-L124 PolarHBondContact O-N 2.83Å; K75-L125 HydrophobicContact CG-CD2 4.49Å; K75-P132 HydrophobicContact CB-CB 4.26Å; K75-P132 HydrophobicContact CB-CG 4.31Å; K75-P132 HydrophobicContact CG-CG 4.47Å; K75-Y160 PolarHBondContact N-O 3.37Å; K75-P162 HydrophobicContact CB-CB 4.41Å; K75-P162 HydrophobicContact CB-CG 4.38Å; K75-P162 HydrophobicContact CD-CB 4.16Å
76	M	92.6	Very high	93.9	Very high	23 Å²	23	55.8 Å²	55.8	11%	0.113	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	143	-174.2	-167.1	-167	-64.9	0	0	111.3	L16 C78 H121 I122 Y160	L16-M76 HydrophobicContact CD1-CE 4.39Å; L16-M76 HydrophobicContact CD2-CE 3.38Å; L16-M76 HydrophobicContact CD2-SD 3.55Å; L16-M76 VanDerWaalsContact CD2-SD 3.55Å; M76-C78 PolarHBondContact SD-SG 2.81Å; M76-H121 HydrophobicContact SD-CB 4.03Å; M76-I122 WeakPolarHBondContact CA-O 3.45Å; M76-Y160 PolarHBondContact N-O 3.33Å; M76-Y160 PolarHBondContact O-N 3.46Å
77	L	94.8	Very high	93.8	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	127.2	167.9	174.3	71.1	0	0	0	107.9	I79 V96 I122 L124 I140 I157 V159	L77-I79 HydrophobicContact CD2-CD1 4.09Å; L77-I79 HydrophobicContact CD2-CG1 4.41Å; L77-I79 HydrophobicContact CG-CD1 4.43Å; L77-I79 HydrophobicContact CG-CG1 4.22Å; L77-V96 HydrophobicContact CD2-CG1 4.39Å; L77-V96 HydrophobicContact CD2-CG2 4.04Å; L77-I122 HydrophobicContact CB-CB 4.32Å; L77-I122 HydrophobicContact CD2-CD1 4.26Å; L77-I122 PolarHBondContact N-O 2.89Å; L77-I122 PolarHBondContact O-N 2.83Å; L77-L124 HydrophobicContact CB-CD1 4.23Å; L77-L124 HydrophobicContact CB-CG 4.43Å; L77-I140 HydrophobicContact CD1-CD1 3.88Å; L77-I140 HydrophobicContact CD2-CD1 3.59Å; L77-I140 HydrophobicContact CD2-CG1 3.76Å; L77-I140 HydrophobicContact CG-CD1 4.3Å; L77-I157 HydrophobicContact CD1-CG2 3.56Å; L77-V159 HydrophobicContact CD1-CG2 3.81Å
78	C	95.1	Very high	93.7	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	128.6	175.4	-63.4	0	0	0	0	109.2	P13 M76 W119 I120 H121 I157 K158 Y160	P13-C78 HydrophobicContact CG-CB 3.93Å; M76-C78 PolarHBondContact SD-SG 2.81Å; C78-W119 HydrophobicContact CB-CE3 4.04Å; C78-W119 HydrophobicContact CB-CZ3 4.18Å; C78-I120 WeakPolarHBondContact CA-O 3.47Å; C78-H121 PolarHBondContact SG-CD2 2.88Å; C78-I157 WeakPolarHBondContact O-CA 3.5Å; C78-K158 HydrophobicContact CB-CB 4.26Å; C78-K158 PolarHBondContact N-O 2.97Å; C78-K158 PolarHBondContact O-N 3.34Å; C78-Y160 HydrophobicContact CB-CE2 4.12Å; C78-Y160 VanDerWaalsContact SG-CE2 3.59Å
79	I	95.4	Very high	93.7	Very high	1 Å²	1	63.1 Å²	63.1	1%	0.005	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	135.4	178.3	-63.8	173.4	0	0	0	107.7	L77 I94 W119 I120 I122 I140 M154 I157	L77-I79 HydrophobicContact CD2-CD1 4.09Å; L77-I79 HydrophobicContact CD2-CG1 4.41Å; L77-I79 HydrophobicContact CG-CD1 4.43Å; L77-I79 HydrophobicContact CG-CG1 4.22Å; I79-I94 HydrophobicContact CD1-CD1 4.14Å; I79-W119 CarbonylContact O-C 3.59Å; I79-I120 PolarHBondContact N-O 3.45Å; I79-I120 PolarHBondContact O-N 3.37Å; I79-I122 HydrophobicContact CD1-CD1 3.81Å; I79-I140 HydrophobicContact CD1-CD1 4.41Å; I79-I140 HydrophobicContact CD1-CG2 4.12Å; I79-M154 HydrophobicContact CB-CE 4.37Å; I79-M154 HydrophobicContact CD1-CE 3.96Å; I79-M154 HydrophobicContact CG1-CE 4.12Å; I79-M154 HydrophobicContact CG2-CE 3.38Å; I79-I157 HydrophobicContact CG1-CG1 4.4Å; I79-I157 HydrophobicContact CG1-CG2 4.44Å
80	Y	96	Very high	93.9	Very high	41 Å²	41	51.3 Å²	51.3	16%	0.161	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	125.5	171	-168.1	-85.3	0	0	0	110.7	L50 D82 W119 R155 Q156	L50-Y80 HydrophobicContact CB-CE1 4.42Å; L50-Y80 HydrophobicContact CD1-CD2 4.32Å; L50-Y80 HydrophobicContact CD1-CE1 4.49Å; L50-Y80 HydrophobicContact CD1-CE2 3.76Å; L50-Y80 HydrophobicContact CD2-CD1 3.99Å; L50-Y80 HydrophobicContact CD2-CD2 3.81Å; L50-Y80 HydrophobicContact CD2-CE1 4.22Å; L50-Y80 HydrophobicContact CD2-CE2 4.06Å; L50-Y80 HydrophobicContact CD2-CG 3.74Å; L50-Y80 HydrophobicContact CG-CE2 4.49Å; Y80-D82 HydrophobicContact CE1-CB 4.19Å; Y80-W119 AromaticContact CD2-CD1 3.81Å; Y80-W119 AromaticContact CD2-CD2 3.67Å; Y80-W119 HydrophobicContact CD2-CD2 3.67Å; Y80-W119 AromaticContact CD2-CE2 3.61Å; Y80-W119 HydrophobicContact CD2-CE3 4.27Å; Y80-W119 AromaticContact CD2-CG 3.83Å; Y80-W119 HydrophobicContact CD2-CG 3.83Å; Y80-W119 HydrophobicContact CD2-CZ2 4.2Å; Y80-W119 AromaticContact CD2-NE1 3.66Å; Y80-W119 HydrophobicContact CE2-CG 4.49Å; Y80-W119 HydrophobicContact CG-CD2 4.42Å; Y80-R155 HydrophobicContact CD1-CB 3.8Å; Y80-R155 HydrophobicContact CD1-CG 4.31Å; Y80-Q156 PolarHBondContact N-O 3.35Å
81	A	94.4	Very high	94.1	Very high	1 Å²	1	43.4 Å²	43.4	1%	0.008	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	139.8	172.7	0	0	0	0	0	110	T90 P91 P116 G118 I120	A81-T90 HydrophobicContact CB-CG2 4.4Å; A81-P91 HydrophobicContact CB-CG 4.32Å; A81-P116 HydrophobicContact CB-CG 4.18Å; A81-G118 PolarHBondContact N-O 3.22Å; A81-G118 PolarHBondContact O-N 3.36Å; A81-G118 VanDerWaalsContact O-O 3.1Å; A81-I120 HydrophobicContact CB-CD1 3.87Å
82	D	94.6	Very high	94.2	Very high	21 Å²	21	36.9 Å²	36.9	11%	0.112	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	112	178.3	179.2	33.8	0	0	0	112	Y80 K84 S85 D86 P116	Y80-D82 HydrophobicContact CE1-CB 4.19Å; D82-K84 VanDerWaalsContact C-N 3.27Å; D82-K84 PolarHBondContact O-N 3.44Å; D82-K84 PolarHBondContact OD1-N 3.35Å; D82-S85 PolarHBondContact O-N 3.1Å; D82-S85 WeakPolarHBondContact OD2-CB 3.36Å; D82-S85 PolarHBondContact OD2-N 3.18Å; D82-S85 PolarHBondContact OD2-OG 3.21Å; D82-D86 WeakPolarHBondContact O-CB 3.32Å; D82-D86 PolarHBondContact O-N 3.4Å; D82-P116 CarbonylContact C-O 3.55Å; D82-P116 WeakPolarHBondContact CA-O 3.44Å
83	Y	93.8	Very high	94.3	Very high	46 Å²	46	39.1 Å²	39.1	18%	0.18	19%	0.191	C	C	.	.	H	α-helix	trans	-62.9	-32.6	-179.8	-177.4	-106.8	0	0	0	113.3	S85 E87 T90 E115 P116 H146 Q147	Y83-S85 VanDerWaalsContact C-N 3.28Å; Y83-S85 PolarHBondContact O-N 2.88Å; Y83-E87 WeakPolarHBondContact CE2-O 3.15Å; Y83-E87 WeakPolarHBondContact O-CA 3.23Å; Y83-E87 PolarHBondContact O-N 2.9Å; Y83-T90 WeakPolarHBondContact CA-OG1 3.34Å; Y83-T90 HydrophobicContact CD2-CG2 4.41Å; Y83-E115 HydrophobicContact CD1-CB 3.73Å; Y83-E115 HydrophobicContact CD1-CG 3.6Å; Y83-E115 HydrophobicContact CD2-CG 4.29Å; Y83-E115 HydrophobicContact CE1-CB 4.29Å; Y83-E115 HydrophobicContact CE1-CG 3.63Å; Y83-E115 WeakPolarHBondContact CE1-OE1 3.28Å; Y83-E115 HydrophobicContact CE2-CG 4.33Å; Y83-E115 HydrophobicContact CG-CB 3.84Å; Y83-E115 HydrophobicContact CG-CG 3.93Å; Y83-P116 WeakPolarHBondContact CB-O 2.94Å; Y83-P116 PolarHBondContact N-O 2.99Å; Y83-H146 HydrophobicContact CD2-CB 4.35Å; Y83-H146 HydrophobicContact CE2-CB 3.88Å; Y83-H146 AromaticContact CE2-CD2 3.92Å; Y83-H146 AromaticContact CE2-CG 3.94Å; Y83-Q147 PolarHBondContact OH-NE2 3.06Å
84	K	92.8	Very high	94.5	Very high	172 Å²	172	37 Å²	37	75%	0.748	18%	0.178	S	C	*	.	H	α-helix	trans	-67.6	-33.3	-179.2	-67.7	-177.6	179.1	178.6	0	112.3	D82	D82-K84 VanDerWaalsContact C-N 3.27Å; D82-K84 PolarHBondContact O-N 3.44Å; D82-K84 PolarHBondContact OD1-N 3.35Å
85	S	93.1	Very high	94.6	Very high	74 Å²	74	37 Å²	37	52%	0.517	18%	0.178	S	C	.	.	H	α-helix	trans	-90.1	-33.2	-177.9	-57.8	0	0	0	0	112.5	D82 Y83	D82-S85 PolarHBondContact O-N 3.1Å; D82-S85 WeakPolarHBondContact OD2-CB 3.36Å; D82-S85 PolarHBondContact OD2-N 3.18Å; D82-S85 PolarHBondContact OD2-OG 3.21Å; Y83-S85 VanDerWaalsContact C-N 3.28Å; Y83-S85 PolarHBondContact O-N 2.88Å
86	D	93.1	Very high	94.8	Very high	6 Å²	6	33.5 Å²	33.5	3%	0.032	16%	0.163	C	C	.	.	H	α-helix	trans	-108.8	-14	-169.1	-62.8	-45	0	0	0	114.2	D82 S88 Y89 T90 H153 R155	D82-D86 WeakPolarHBondContact O-CB 3.32Å; D82-D86 PolarHBondContact O-N 3.4Å; D86-S88 PolarHBondContact O-N 3.3Å; D86-Y89 WeakPolarHBondContact O-CB 3.49Å; D86-Y89 WeakPolarHBondContact O-CD2 3.41Å; D86-Y89 PolarHBondContact O-N 2.64Å; D86-T90 WeakPolarHBondContact CB-OG1 3.41Å; D86-H153 HydrophobicContact CB-CB 4.23Å; D86-H153 IonicContact OD1-CG 2.72Å; D86-H153 IonicContact OD1-ND1 3.61Å; D86-H153 PolarHBondContact OD1-ND1 3.48Å; D86-R155 IonicContact OD1-CZ 3.67Å; D86-R155 IonicContact OD1-NE 2.92Å; D86-R155 IonicContact OD1-NH2 3.53Å; D86-R155 PolarHBondContact OD1-NH2 2.98Å; D86-R155 IonicContact OD2-CZ 2.76Å; D86-R155 IonicContact OD2-NE 2.76Å; D86-R155 PolarHBondContact OD2-NE 3.45Å; D86-R155 IonicContact OD2-NH2 3.58Å
87	E	93.4	Very high	95	Very high	118 Å²	118	35.2 Å²	35.2	55%	0.551	17%	0.168	S	C	*	.	G	3₁₀ helix	trans	45.6	-106.6	177.5	-59.4	-177.4	169.5	0	0	113.8	Y83 Y89 T90	Y83-E87 WeakPolarHBondContact CE2-O 3.15Å; Y83-E87 WeakPolarHBondContact O-CA 3.23Å; Y83-E87 PolarHBondContact O-N 2.9Å; E87-Y89 VanDerWaalsContact C-N 3.34Å; E87-T90 PolarHBondContact O-N 3.23Å; E87-T90 PolarHBondContact O-OG1 2.83Å
88	S	94.6	Very high	95	Very high	31 Å²	31	36 Å²	36	22%	0.217	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-74.4	-19.3	179.5	66.2	0	0	0	0	113.9	D86 T90 N145 H146 G149	D86-S88 PolarHBondContact O-N 3.3Å; S88-T90 VanDerWaalsContact C-N 3.26Å; S88-T90 PolarHBondContact O-N 3.36Å; S88-N145 VanDerWaalsContact O-CB 3.29Å; S88-N145 WeakPolarHBondContact O-CB 3.33Å; S88-H146 WeakPolarHBondContact CA-O 3.11Å; S88-H146 VanDerWaalsContact O-O 3.1Å; S88-G149 WeakPolarHBondContact O-CA 3.37Å
89	Y	94.8	Very high	95	Very high	82 Å²	82	36.4 Å²	36.4	32%	0.322	18%	0.177	S	C	.	.	G	3₁₀ helix	trans	-79	-10.6	176.1	-63.3	-88.7	0	0	0	112.5	D86 E87 D151 T152 H153	D86-Y89 WeakPolarHBondContact O-CB 3.49Å; D86-Y89 WeakPolarHBondContact O-CD2 3.41Å; D86-Y89 PolarHBondContact O-N 2.64Å; E87-Y89 VanDerWaalsContact C-N 3.34Å; Y89-D151 HydrophobicContact CD1-CB 4Å; Y89-D151 WeakPolarHBondContact CD1-O 3.32Å; Y89-D151 HydrophobicContact CE1-CB 3.92Å; Y89-T152 VanDerWaalsContact O-CA 3.31Å; Y89-T152 WeakPolarHBondContact O-CA 3.39Å; Y89-T152 PolarHBondContact O-OG1 3.03Å; Y89-H153 AromaticContact CD1-CD2 3.71Å; Y89-H153 AromaticContact CD1-NE2 3.52Å; Y89-H153 AromaticContact CD2-CE1 3.96Å; Y89-H153 AromaticContact CE1-NE2 3.91Å; Y89-H153 AromaticContact CG-CD2 3.89Å; Y89-H153 AromaticContact CG-CE1 3.75Å; Y89-H153 AromaticContact CG-ND1 3.94Å; Y89-H153 AromaticContact CG-NE2 3.72Å; Y89-H153 PolarHBondContact O-N 3.46Å
90	T	95.8	Very high	94.8	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.202	C	C	.	.	S	Bend	trans	-70.4	124.9	179.8	-50.5	0	0	0	0	111	A81 Y83 D86 E87 S88 S92 P116 N145 H146	A81-T90 HydrophobicContact CB-CG2 4.4Å; Y83-T90 WeakPolarHBondContact CA-OG1 3.34Å; Y83-T90 HydrophobicContact CD2-CG2 4.41Å; D86-T90 WeakPolarHBondContact CB-OG1 3.41Å; E87-T90 PolarHBondContact O-N 3.23Å; E87-T90 PolarHBondContact O-OG1 2.83Å; S88-T90 VanDerWaalsContact C-N 3.26Å; S88-T90 PolarHBondContact O-N 3.36Å; T90-S92 PolarHBondContact O-N 3.05Å; T90-P116 HydrophobicContact CG2-CG 3.57Å; T90-N145 CarbonylContact O-C 3.51Å; T90-N145 WeakPolarHBondContact O-CA 3.35Å; T90-H146 PolarHBondContact O-N 2.99Å; T90-H146 PolarHBondContact O-ND1 3.28Å
91	P	96	Very high	94.4	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	133.1	176.3	25.1	-33.5	0	0	0	110.6	A81 I94 M113 V142 N145 H146	A81-P91 HydrophobicContact CB-CG 4.32Å; P91-I94 HydrophobicContact CB-CD1 3.89Å; P91-I94 HydrophobicContact CB-CG1 3.96Å; P91-I94 HydrophobicContact CG-CD1 4.02Å; P91-M113 HydrophobicContact CB-CE 3.99Å; P91-M113 HydrophobicContact CG-CE 3.9Å; P91-M113 VanDerWaalsContact O-CE 3.23Å; P91-M113 WeakPolarHBondContact O-CE 3.43Å; P91-V142 HydrophobicContact CB-CG1 3.73Å; P91-V142 HydrophobicContact CB-CG2 4.36Å; P91-N145 WeakPolarHBondContact CA-OD1 3.36Å; P91-H146 PolarHBondContact O-CE1 2.96Å; P91-H146 PolarHBondContact O-ND1 2.75Å
92	S	95.4	Very high	94.1	Very high	24 Å²	24	47.7 Å²	47.7	17%	0.168	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	-31.8	175.3	62.4	0	0	0	0	111.4	T90 E112 M113 A144 N145	T90-S92 PolarHBondContact O-N 3.05Å; S92-E112 CarbonylContact O-C 3.57Å; S92-E112 WeakPolarHBondContact O-CA 3.23Å; S92-M113 PolarHBondContact O-N 3.39Å; S92-A144 PolarHBondContact N-O 2.77Å; S92-A144 VanDerWaalsContact OG-C 3.24Å; S92-A144 PolarHBondContact OG-O 3.37Å; S92-A144 VanDerWaalsContact OG-O 3.09Å; S92-N145 PolarHBondContact OG-N 3.2Å; S92-N145 PolarHBondContact OG-O 2.9Å
93	K	96.2	Very high	93.7	Very high	59 Å²	59	55.6 Å²	55.6	26%	0.257	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	118.4	-178.3	-168.7	170	-178.8	140.2	0	110.8	Q110 L111 E112 L143 A144	K93-Q110 HydrophobicContact CG-CG 4.5Å; K93-L111 WeakPolarHBondContact CA-O 3.49Å; K93-E112 HydrophobicContact CD-CG 4.35Å; K93-E112 WeakPolarHBondContact CE-OE1 3.38Å; K93-E112 HydrophobicContact CG-CG 4.1Å; K93-E112 IonicContact NZ-OE1 3.73Å; K93-E112 PolarHBondContact NZ-OE1 2.81Å; K93-L143 HydrophobicContact CB-CB 4.29Å; K93-L143 HydrophobicContact CD-CB 4.39Å; K93-L143 HydrophobicContact CD-CD1 4.33Å; K93-L143 HydrophobicContact CG-CB 4.15Å; K93-L143 HydrophobicContact CG-CD1 4.19Å; K93-L143 PolarHBondContact O-N 3.07Å; K93-A144 HydrophobicContact CB-CB 4.12Å; K93-A144 PolarHBondContact N-O 3.23Å; K93-A144 PolarHBondContact O-N 2.68Å
94	I	96.8	Very high	93.7	Very high	1 Å²	1	57 Å²	57	1%	0.005	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	135.8	178.6	-62.7	-178	0	0	0	109.5	I79 P91 V96 Q110 L111 M113 I140 A141 V142	I79-I94 HydrophobicContact CD1-CD1 4.14Å; P91-I94 HydrophobicContact CB-CD1 3.89Å; P91-I94 HydrophobicContact CB-CG1 3.96Å; P91-I94 HydrophobicContact CG-CD1 4.02Å; I94-V96 HydrophobicContact CG2-CG2 4.38Å; I94-Q110 CarbonylContact O-C 3.52Å; I94-Q110 WeakPolarHBondContact O-CA 3.42Å; I94-L111 PolarHBondContact N-O 3.19Å; I94-L111 PolarHBondContact O-N 2.72Å; I94-M113 HydrophobicContact CD1-CE 3.46Å; I94-M113 VanDerWaalsContact CD1-CE 3.46Å; I94-M113 HydrophobicContact CD1-SD 4.45Å; I94-M113 HydrophobicContact CG1-CE 3.82Å; I94-I140 HydrophobicContact CG2-CG2 3.54Å; I94-A141 CarbonylContact C-O 3.55Å; I94-A141 WeakPolarHBondContact CA-O 3.34Å; I94-V142 HydrophobicContact CG1-CG2 4.37Å
95	S	96.8	Very high	93.7	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	126.7	170.3	164.3	0	0	0	0	109	R97 E107 A141	S95-R97 PolarHBondContact OG-NE 3.06Å; S95-E107 VanDerWaalsContact CB-OE2 3.29Å; S95-E107 WeakPolarHBondContact CB-OE2 3.45Å; S95-E107 VanDerWaalsContact OG-CD 3.28Å; S95-E107 WeakPolarHBondContact OG-CG 3.29Å; S95-E107 PolarHBondContact OG-OE2 2.57Å; S95-A141 PolarHBondContact N-O 3.11Å; S95-A141 PolarHBondContact O-N 2.94Å
96	V	96.6	Very high	93.7	Very high	3 Å²	3	53.4 Å²	53.4	2%	0.018	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	123.6	173	-175.2	0	0	0	0	108.3	L77 I94 I108 R109 I122 L124 I138	L77-V96 HydrophobicContact CD2-CG1 4.39Å; L77-V96 HydrophobicContact CD2-CG2 4.04Å; I94-V96 HydrophobicContact CG2-CG2 4.38Å; V96-I108 HydrophobicContact CB-CG1 4.46Å; V96-I108 HydrophobicContact CG1-CD1 4.17Å; V96-I108 HydrophobicContact CG1-CG1 4.29Å; V96-I108 WeakPolarHBondContact O-CG1 3.44Å; V96-I108 PolarHBondContact O-N 2.9Å; V96-R109 PolarHBondContact N-O 2.89Å; V96-R109 PolarHBondContact O-N 3.07Å; V96-I122 HydrophobicContact CG2-CD1 4.09Å; V96-I122 HydrophobicContact CG2-CG2 4.27Å; V96-L124 HydrophobicContact CG1-CD2 3.86Å; V96-I138 HydrophobicContact CG1-CG2 4.04Å
97	R	96.1	Very high	93.8	Very high	60 Å²	60	57.7 Å²	57.7	23%	0.226	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	147.2	-176.9	-52.2	169.3	-176.2	172.2	-6.4	109.6	S95 L105 Q106 E107 I138 Q139	S95-R97 PolarHBondContact OG-NE 3.06Å; R97-L105 HydrophobicContact CB-CB 4.2Å; R97-Q106 CarbonylContact C-O 3.6Å; R97-Q106 WeakPolarHBondContact CA-O 3.47Å; R97-E107 HydrophobicContact CG-CB 4.18Å; R97-I138 CarbonylContact O-C 3.59Å; R97-I138 WeakPolarHBondContact O-CA 3.5Å; R97-Q139 HydrophobicContact CB-CB 4.3Å; R97-Q139 PolarHBondContact N-O 2.87Å; R97-Q139 VanDerWaalsContact NH1-OE1 3.14Å; R97-Q139 PolarHBondContact O-N 2.99Å
98	V	95.4	Very high	93.8	Very high	16 Å²	16	54.1 Å²	54.1	10%	0.097	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	151.2	178.9	-59.4	0	0	0	0	110.1	Q106 I108 I133 T135 M137 I138	V98-Q106 PolarHBondContact N-O 3.03Å; V98-Q106 PolarHBondContact O-N 3.43Å; V98-I108 HydrophobicContact CB-CD1 4.49Å; V98-I108 HydrophobicContact CG1-CD1 3.47Å; V98-I108 VanDerWaalsContact CG1-CD1 3.47Å; V98-I108 HydrophobicContact CG1-CG1 4.1Å; V98-I108 HydrophobicContact CG2-CD1 4.24Å; V98-I108 HydrophobicContact CG2-CG1 4.38Å; V98-I108 HydrophobicContact CG2-CG2 3.48Å; V98-I108 VanDerWaalsContact CG2-CG2 3.48Å; V98-I133 HydrophobicContact CG1-CG2 4.45Å; V98-I133 HydrophobicContact CG2-CG2 4.12Å; V98-T135 HydrophobicContact CB-CG2 4.19Å; V98-T135 HydrophobicContact CG1-CG2 4.21Å; V98-M137 WeakPolarHBondContact CA-O 3.42Å; V98-I138 HydrophobicContact CG1-CG1 4.18Å
99	G	93.6	Very high	93.7	Very high	9 Å²	9	59.1 Å²	59.1	9%	0.093	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-177.6	-178.1	-179.8	0	0	0	0	0	113.5	N104 T135 M137	G99-N104 VanDerWaalsContact CA-O 3.23Å; G99-N104 WeakPolarHBondContact CA-O 3.47Å; G99-T135 PolarHBondContact N-OG1 2.79Å; G99-T135 PolarHBondContact O-OG1 2.52Å; G99-M137 PolarHBondContact N-O 3.34Å; G99-M137 VanDerWaalsContact N-O 3.08Å; G99-M137 WeakPolarHBondContact O-CB 3.36Å; G99-M137 PolarHBondContact O-N 2.82Å
100	N	90.8	Very high	93.6	Very high	98 Å²	98	59 Å²	59	52%	0.524	28%	0.281	S	S	.	.	S	Bend	trans	-87.9	-29.8	177.5	-65.1	-22.9	0	0	0	112.2
101	N	87.8	Confident	93.6	Very high	78 Å²	78	61.3 Å²	61.3	42%	0.417	29%	0.293	S	S	.	.	S	Bend	trans	-152.4	170.4	-176.5	53.5	36.7	0	0	0	109.6	H103 N104	N101-H103 PolarHBondContact O-N 3.29Å; N101-H103 VanDerWaalsContact O-N 3.16Å; N101-H103 PolarHBondContact OD1-N 3.48Å; N101-N104 PolarHBondContact O-N 3.31Å; N101-N104 WeakPolarHBondContact OD1-CB 3.47Å; N101-N104 PolarHBondContact OD1-N 3Å
102	F	88	Confident	93.5	Very high	103 Å²	103	67.2 Å²	67.2	45%	0.452	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-26.8	-177.8	-69.2	-82.9	0	0	0	114.3	N65 M137	N65-F102 HydrophobicContact CB-CE1 4.29Å; F102-M137 HydrophobicContact CD1-CE 3.32Å; F102-M137 HydrophobicContact CD1-SD 3.98Å; F102-M137 HydrophobicContact CE1-CE 3.24Å; F102-M137 HydrophobicContact CE1-SD 4.15Å; F102-M137 HydrophobicContact CG-CE 4.13Å; F102-M137 HydrophobicContact CG-SD 4.2Å; F102-M137 HydrophobicContact CZ-CE 4.01Å
103	H	88.1	Confident	93.3	Very high	187 Å²	187	66.3 Å²	66.3	87%	0.866	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-17.5	-177.2	-56.4	-60	0	0	0	113.6	N101	N101-H103 PolarHBondContact O-N 3.29Å; N101-H103 VanDerWaalsContact O-N 3.16Å; N101-H103 PolarHBondContact OD1-N 3.48Å
104	N	92.6	Very high	93.2	Very high	77 Å²	77	66 Å²	66	41%	0.412	32%	0.317	S	S	.	.	S	Bend	trans	-118.2	47.4	-178.2	-170.6	6.2	0	0	0	111	G99 N101	G99-N104 VanDerWaalsContact CA-O 3.23Å; G99-N104 WeakPolarHBondContact CA-O 3.47Å; N101-N104 PolarHBondContact O-N 3.31Å; N101-N104 WeakPolarHBondContact OD1-CB 3.47Å; N101-N104 PolarHBondContact OD1-N 3Å
105	L	93.4	Very high	93	Very high	37 Å²	37	68.7 Å²	68.7	19%	0.194	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	124.9	173.1	-68.5	172.9	0	0	0	109.3	R97 M137 Q139	R97-L105 HydrophobicContact CB-CB 4.2Å; L105-M137 HydrophobicContact CD1-CE 4.17Å; L105-M137 HydrophobicContact CD2-CB 4.48Å; L105-M137 HydrophobicContact CD2-CE 4.47Å; L105-M137 HydrophobicContact CD2-CG 4.17Å; L105-M137 HydrophobicContact CD2-SD 4.03Å; L105-Q139 HydrophobicContact CD1-CB 3.83Å; L105-Q139 VanDerWaalsContact CD1-CD 3.42Å; L105-Q139 HydrophobicContact CD1-CG 4.25Å; L105-Q139 VanDerWaalsContact CD1-NE2 3.34Å; L105-Q139 HydrophobicContact CD2-CB 4.36Å
106	Q	93.4	Very high	92.8	Very high	133 Å²	133	68.7 Å²	68.7	62%	0.621	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.5	133.2	174.3	-65.4	-173.8	-9.7	0	0	109.7	R97 V98 I108	R97-Q106 CarbonylContact C-O 3.6Å; R97-Q106 WeakPolarHBondContact CA-O 3.47Å; V98-Q106 PolarHBondContact N-O 3.03Å; V98-Q106 PolarHBondContact O-N 3.43Å; Q106-I108 PolarHBondContact O-N 3.18Å
107	E	94.1	Very high	92.6	Very high	96 Å²	96	71.2 Å²	71.2	45%	0.449	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	123.4	172.6	-174.9	174.7	108	0	0	110.2	S95 R97	S95-E107 VanDerWaalsContact CB-OE2 3.29Å; S95-E107 WeakPolarHBondContact CB-OE2 3.45Å; S95-E107 VanDerWaalsContact OG-CD 3.28Å; S95-E107 WeakPolarHBondContact OG-CG 3.29Å; S95-E107 PolarHBondContact OG-OE2 2.57Å; R97-E107 HydrophobicContact CG-CB 4.18Å
108	I	92.6	Very high	92.5	Very high	43 Å²	43	68.7 Å²	68.7	22%	0.221	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	-30	178.7	50.9	163.2	0	0	0	112	V96 V98 Q106 L124 I133	V96-I108 HydrophobicContact CB-CG1 4.46Å; V96-I108 HydrophobicContact CG1-CD1 4.17Å; V96-I108 HydrophobicContact CG1-CG1 4.29Å; V96-I108 WeakPolarHBondContact O-CG1 3.44Å; V96-I108 PolarHBondContact O-N 2.9Å; V98-I108 HydrophobicContact CB-CD1 4.49Å; V98-I108 HydrophobicContact CG1-CD1 3.47Å; V98-I108 VanDerWaalsContact CG1-CD1 3.47Å; V98-I108 HydrophobicContact CG1-CG1 4.1Å; V98-I108 HydrophobicContact CG2-CD1 4.24Å; V98-I108 HydrophobicContact CG2-CG1 4.38Å; V98-I108 HydrophobicContact CG2-CG2 3.48Å; V98-I108 VanDerWaalsContact CG2-CG2 3.48Å; Q106-I108 PolarHBondContact O-N 3.18Å; I108-L124 HydrophobicContact CD1-CB 4.41Å; I108-L124 HydrophobicContact CD1-CD2 3.78Å; I108-I133 HydrophobicContact CB-CD1 4.27Å; I108-I133 HydrophobicContact CD1-CD1 3.51Å; I108-I133 HydrophobicContact CG1-CD1 4.5Å; I108-I133 HydrophobicContact CG2-CD1 4.11Å
109	R	92.4	Very high	92.5	Very high	136 Å²	136	69.2 Å²	69.2	51%	0.513	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	132	-176.4	-163.2	74.5	-175.9	-168	1.4	109.8	V96 I122	V96-R109 PolarHBondContact N-O 2.89Å; V96-R109 PolarHBondContact O-N 3.07Å; R109-I122 HydrophobicContact CG-CG2 4.3Å
110	Q	94.7	Very high	92.6	Very high	79 Å²	79	69.3 Å²	69.3	37%	0.369	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	138	165.9	-165.2	-178	-88.5	0	0	108.4	K93 I94	K93-Q110 HydrophobicContact CG-CG 4.5Å; I94-Q110 CarbonylContact O-C 3.52Å; I94-Q110 WeakPolarHBondContact O-CA 3.42Å
111	L	93.8	Very high	92.7	Very high	48 Å²	48	67.7 Å²	67.7	25%	0.251	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	131.4	177.6	-176.7	65.6	0	0	0	109.3	K93 I94 M113 I120 I122	K93-L111 WeakPolarHBondContact CA-O 3.49Å; I94-L111 PolarHBondContact N-O 3.19Å; I94-L111 PolarHBondContact O-N 2.72Å; L111-M113 HydrophobicContact CD2-CG 3.68Å; L111-M113 HydrophobicContact CD2-SD 3.68Å; L111-M113 HydrophobicContact CG-CG 3.71Å; L111-M113 HydrophobicContact CG-SD 4.32Å; L111-I120 HydrophobicContact CD2-CG2 3.48Å; L111-I120 VanDerWaalsContact CD2-CG2 3.48Å; L111-I122 HydrophobicContact CD2-CD1 4.3Å; L111-I122 HydrophobicContact CD2-CG1 4.24Å
112	E	94.7	Very high	93	Very high	124 Å²	124	64.4 Å²	64.4	58%	0.579	31%	0.31	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.2	128.8	167.9	-68.6	-179.1	176.7	0	0	107.8	S92 K93	S92-E112 CarbonylContact O-C 3.57Å; S92-E112 WeakPolarHBondContact O-CA 3.23Å; K93-E112 HydrophobicContact CD-CG 4.35Å; K93-E112 WeakPolarHBondContact CE-OE1 3.38Å; K93-E112 HydrophobicContact CG-CG 4.1Å; K93-E112 IonicContact NZ-OE1 3.73Å; K93-E112 PolarHBondContact NZ-OE1 2.81Å
113	M	91.6	Very high	93.1	Very high	5 Å²	5	62.8 Å²	62.8	3%	0.025	31%	0.311	C	S	.	.			trans	-121.5	138	-174.2	-56.3	179.8	-60.5	0	0	108.5	T7 P91 S92 I94 L111 P116 I120 H146	T7-M113 WeakPolarHBondContact OG1-CA 3.45Å; P91-M113 HydrophobicContact CB-CE 3.99Å; P91-M113 HydrophobicContact CG-CE 3.9Å; P91-M113 VanDerWaalsContact O-CE 3.23Å; P91-M113 WeakPolarHBondContact O-CE 3.43Å; S92-M113 PolarHBondContact O-N 3.39Å; I94-M113 HydrophobicContact CD1-CE 3.46Å; I94-M113 VanDerWaalsContact CD1-CE 3.46Å; I94-M113 HydrophobicContact CD1-SD 4.45Å; I94-M113 HydrophobicContact CG1-CE 3.82Å; L111-M113 HydrophobicContact CD2-CG 3.68Å; L111-M113 HydrophobicContact CD2-SD 3.68Å; L111-M113 HydrophobicContact CG-CG 3.71Å; L111-M113 HydrophobicContact CG-SD 4.32Å; M113-P116 HydrophobicContact CB-CB 4.49Å; M113-P116 HydrophobicContact CB-CG 4.2Å; M113-I120 HydrophobicContact CE-CD1 4.35Å; M113-I120 HydrophobicContact SD-CB 4.49Å; M113-I120 HydrophobicContact SD-CD1 3.42Å; M113-I120 WeakPolarHBondContact SD-CD1 3.42Å; M113-I120 HydrophobicContact SD-CG1 3.95Å; M113-I120 HydrophobicContact SD-CG2 4.01Å; M113-H146 PolarHBondContact O-CE1 3.09Å; M113-H146 PolarHBondContact O-NE2 2.86Å
114	V	93.7	Very high	93.2	Very high	52 Å²	52	54 Å²	54	32%	0.315	27%	0.271	S	S	.	.	S	Bend	trans	-122.4	109.3	-179.8	-178.5	0	0	0	0	107.4	P4 K6 T7	P4-V114 HydrophobicContact CB-CG1 4.44Å; P4-V114 HydrophobicContact CB-CG2 4.28Å; P4-V114 HydrophobicContact CG-CG1 4.19Å; K6-V114 WeakPolarHBondContact CA-O 3.27Å; T7-V114 PolarHBondContact N-O 2.98Å; T7-V114 PolarHBondContact OG1-N 3.27Å
115	E	92.9	Very high	93.1	Very high	58 Å²	58	53.1 Å²	53.1	27%	0.271	27%	0.266	S	S	.	.	S	Bend	trans	46.4	56.8	-178.3	-55.9	-172.1	170.5	0	0	113.3	K6 Y83 S117 H146	K6-E115 HydrophobicContact CD-CB 4.33Å; K6-E115 WeakPolarHBondContact CE-OE2 3.32Å; K6-E115 HydrophobicContact CG-CB 4.5Å; K6-E115 IonicContact NZ-OE2 2.67Å; K6-E115 PolarHBondContact NZ-OE2 3.09Å; Y83-E115 HydrophobicContact CD1-CB 3.73Å; Y83-E115 HydrophobicContact CD1-CG 3.6Å; Y83-E115 HydrophobicContact CD2-CG 4.29Å; Y83-E115 HydrophobicContact CE1-CB 4.29Å; Y83-E115 HydrophobicContact CE1-CG 3.63Å; Y83-E115 WeakPolarHBondContact CE1-OE1 3.28Å; Y83-E115 HydrophobicContact CE2-CG 4.33Å; Y83-E115 HydrophobicContact CG-CB 3.84Å; Y83-E115 HydrophobicContact CG-CG 3.93Å; E115-S117 PolarHBondContact O-N 2.63Å; E115-H146 PolarHBondContact N-NE2 2.87Å
116	P	93	Very high	92.6	Very high	1 Å²	1	54.6 Å²	54.6	1%	0.006	27%	0.274	C	S	.	.			trans	-62.3	138.4	178.7	28.5	-34.5	0	0	0	110.2	A81 D82 Y83 T90 M113 I120	A81-P116 HydrophobicContact CB-CG 4.18Å; D82-P116 CarbonylContact C-O 3.55Å; D82-P116 WeakPolarHBondContact CA-O 3.44Å; Y83-P116 WeakPolarHBondContact CB-O 2.94Å; Y83-P116 PolarHBondContact N-O 2.99Å; T90-P116 HydrophobicContact CG2-CG 3.57Å; M113-P116 HydrophobicContact CB-CB 4.49Å; M113-P116 HydrophobicContact CB-CG 4.2Å; P116-I120 HydrophobicContact CB-CD1 3.9Å; P116-I120 HydrophobicContact CB-CG1 4.33Å; P116-I120 HydrophobicContact CG-CD1 4.47Å
117	S	92.8	Very high	91.9	Very high	55 Å²	55	56.1 Å²	56.1	39%	0.385	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	57.5	-179.3	68.7	0	0	0	0	111.3	E115	E115-S117 PolarHBondContact O-N 2.63Å
118	G	94.2	Very high	91.2	Very high	8 Å²	8	62.6 Å²	62.6	8%	0.082	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	152.5	-151.7	178.8	0	0	0	0	0	114.7	A81	A81-G118 PolarHBondContact N-O 3.22Å; A81-G118 PolarHBondContact O-N 3.36Å; A81-G118 VanDerWaalsContact O-O 3.1Å
119	W	95.2	Very high	90.7	Very high	27 Å²	27	63.9 Å²	63.9	10%	0.102	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	134.3	179	-70.8	103.4	0	0	0	111.7	G10 P13 L50 C78 I79 Y80 Q156 K158	G10-W119 VanDerWaalsContact CA-O 3.26Å; G10-W119 WeakPolarHBondContact CA-O 3.46Å; G10-W119 PolarHBondContact N-O 3.2Å; P13-W119 VanDerWaalsContact CD-CG 3.43Å; P13-W119 HydrophobicContact CG-CD2 3.4Å; P13-W119 VanDerWaalsContact CG-CD2 3.4Å; P13-W119 HydrophobicContact CG-CE3 3.46Å; P13-W119 VanDerWaalsContact CG-CE3 3.46Å; P13-W119 HydrophobicContact CG-CG 3.93Å; P13-W119 HydrophobicContact CG-CH2 3.98Å; P13-W119 HydrophobicContact CG-CZ2 3.98Å; P13-W119 HydrophobicContact CG-CZ3 3.76Å; L50-W119 HydrophobicContact CD2-CZ2 4.09Å; C78-W119 HydrophobicContact CB-CE3 4.04Å; C78-W119 HydrophobicContact CB-CZ3 4.18Å; I79-W119 CarbonylContact O-C 3.59Å; Y80-W119 AromaticContact CD2-CD1 3.81Å; Y80-W119 AromaticContact CD2-CD2 3.67Å; Y80-W119 HydrophobicContact CD2-CD2 3.67Å; Y80-W119 AromaticContact CD2-CE2 3.61Å; Y80-W119 HydrophobicContact CD2-CE3 4.27Å; Y80-W119 AromaticContact CD2-CG 3.83Å; Y80-W119 HydrophobicContact CD2-CG 3.83Å; Y80-W119 HydrophobicContact CD2-CZ2 4.2Å; Y80-W119 AromaticContact CD2-NE1 3.66Å; Y80-W119 HydrophobicContact CE2-CG 4.49Å; Y80-W119 HydrophobicContact CG-CD2 4.42Å; W119-Q156 HydrophobicContact CH2-CB 3.9Å; W119-Q156 HydrophobicContact CH2-CG 3.53Å; W119-Q156 HydrophobicContact CZ2-CG 4.44Å; W119-Q156 HydrophobicContact CZ3-CB 4.34Å; W119-Q156 HydrophobicContact CZ3-CG 4.21Å; W119-K158 HydrophobicContact CH2-CD 4.19Å; W119-K158 HydrophobicContact CH2-CG 4.24Å; W119-K158 HydrophobicContact CZ3-CG 4.35Å
120	I	94.7	Very high	90.2	Very high	11 Å²	11	63.2 Å²	63.2	6%	0.056	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	119.6	175.9	-62.2	137	0	0	0	107.3	C78 I79 A81 L111 M113 P116 I122	C78-I120 WeakPolarHBondContact CA-O 3.47Å; I79-I120 PolarHBondContact N-O 3.45Å; I79-I120 PolarHBondContact O-N 3.37Å; A81-I120 HydrophobicContact CB-CD1 3.87Å; L111-I120 HydrophobicContact CD2-CG2 3.48Å; L111-I120 VanDerWaalsContact CD2-CG2 3.48Å; M113-I120 HydrophobicContact CE-CD1 4.35Å; M113-I120 HydrophobicContact SD-CB 4.49Å; M113-I120 HydrophobicContact SD-CD1 3.42Å; M113-I120 WeakPolarHBondContact SD-CD1 3.42Å; M113-I120 HydrophobicContact SD-CG1 3.95Å; M113-I120 HydrophobicContact SD-CG2 4.01Å; P116-I120 HydrophobicContact CB-CD1 3.9Å; P116-I120 HydrophobicContact CB-CG1 4.33Å; P116-I120 HydrophobicContact CG-CD1 4.47Å; I120-I122 HydrophobicContact CG2-CG1 4.14Å
121	H	93.2	Very high	89.9	Confident	64 Å²	64	65 Å²	65	30%	0.296	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	118.4	-178.8	-67.7	-169.5	0	0	0	109.9	A11 M76 C78	A11-H121 PolarHBondContact O-CE1 3.27Å; A11-H121 PolarHBondContact O-NE2 3.45Å; M76-H121 HydrophobicContact SD-CB 4.03Å; C78-H121 PolarHBondContact SG-CD2 2.88Å
122	I	93.1	Very high	89.7	Confident	8 Å²	8	64.8 Å²	64.8	4%	0.041	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	107.7	179.8	-52.4	174.9	0	0	0	108.1	M76 L77 I79 V96 R109 L111 I120 L124	M76-I122 WeakPolarHBondContact CA-O 3.45Å; L77-I122 HydrophobicContact CB-CB 4.32Å; L77-I122 HydrophobicContact CD2-CD1 4.26Å; L77-I122 PolarHBondContact N-O 2.89Å; L77-I122 PolarHBondContact O-N 2.83Å; I79-I122 HydrophobicContact CD1-CD1 3.81Å; V96-I122 HydrophobicContact CG2-CD1 4.09Å; V96-I122 HydrophobicContact CG2-CG2 4.27Å; R109-I122 HydrophobicContact CG-CG2 4.3Å; L111-I122 HydrophobicContact CD2-CD1 4.3Å; L111-I122 HydrophobicContact CD2-CG1 4.24Å; I120-I122 HydrophobicContact CG2-CG1 4.14Å; I122-L124 HydrophobicContact CG2-CD2 3.91Å; I122-L124 PolarHBondContact O-N 3.4Å
123	S	91.6	Very high	89.6	Confident	69 Å²	69	60.1 Å²	60.1	48%	0.483	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	120.6	175.4	-61.1	0	0	0	0	110.5	L125	S123-L125 PolarHBondContact O-N 3.3Å
124	L	90.4	Very high	89.6	Confident	2 Å²	2	62 Å²	62	1%	0.01	32%	0.32	C	S	.	.			trans	-97.4	67.7	178.2	-53.7	-172.3	0	0	0	109.6	V74 K75 L77 V96 I108 I122 I133 I138	V74-L124 HydrophobicContact CB-CD1 4.33Å; V74-L124 HydrophobicContact CG1-CD1 3.78Å; K75-L124 PolarHBondContact O-N 2.83Å; L77-L124 HydrophobicContact CB-CD1 4.23Å; L77-L124 HydrophobicContact CB-CG 4.43Å; V96-L124 HydrophobicContact CG1-CD2 3.86Å; I108-L124 HydrophobicContact CD1-CB 4.41Å; I108-L124 HydrophobicContact CD1-CD2 3.78Å; I122-L124 HydrophobicContact CG2-CD2 3.91Å; I122-L124 PolarHBondContact O-N 3.4Å; L124-I133 HydrophobicContact CB-CD1 4.39Å; L124-I133 WeakPolarHBondContact O-CG1 3.42Å; L124-I133 PolarHBondContact O-N 2.89Å; L124-I138 HydrophobicContact CD1-CD1 4.04Å
125	L	89.1	Confident	89.6	Confident	59 Å²	59	59.8 Å²	59.8	31%	0.309	31%	0.307	S	S	.	.	B	Isolated β-bridge	trans	-106.8	142.5	179.2	-58.7	174.7	0	0	0	110	K75 S123 Q127 E131 P132	K75-L125 HydrophobicContact CG-CD2 4.49Å; S123-L125 PolarHBondContact O-N 3.3Å; L125-Q127 PolarHBondContact O-N 3.08Å; L125-E131 WeakPolarHBondContact CA-O 3.31Å; L125-P132 HydrophobicContact CD2-CG 4.28Å
126	N	84.3	Confident	89.8	Confident	68 Å²	68	60.7 Å²	60.7	36%	0.364	31%	0.31	S	S	.	.			trans	-69	127.9	171.1	-171.7	-17.1	0	0	0	109.4	R128 N130 E131	N126-R128 PolarHBondContact O-N 2.91Å; N126-R128 PolarHBondContact OD1-N 3.11Å; N126-N130 VanDerWaalsContact O-CA 3.27Å; N126-N130 WeakPolarHBondContact O-CA 3.32Å; N126-N130 PolarHBondContact O-N 3.14Å; N126-E131 PolarHBondContact N-O 2.98Å
127	Q	78.1	Confident	89.9	Confident	165 Å²	165	60.8 Å²	60.8	77%	0.771	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-27.4	-177.8	-63.7	-179.7	2.5	0	0	113.3	L125	L125-Q127 PolarHBondContact O-N 3.08Å
128	R	80.1	Confident	90	Very high	232 Å²	232	58.1 Å²	58.1	88%	0.875	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	-42.2	-177.3	-78.9	-174	-84.6	-154.7	-5.5	113.8	N126	N126-R128 PolarHBondContact O-N 2.91Å; N126-R128 PolarHBondContact OD1-N 3.11Å
129	T	80.8	Confident	90.2	Very high	71 Å²	71	58.4 Å²	58.4	44%	0.436	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.3	-10.4	-173.8	61.5	0	0	0	0	113.1	E131	T129-E131 PolarHBondContact O-N 3.21Å; T129-E131 VanDerWaalsContact O-N 3.1Å; T129-E131 WeakPolarHBondContact OG1-CB 3.4Å; T129-E131 PolarHBondContact OG1-OE2 2.79Å
130	N	83.2	Confident	90.3	Very high	121 Å²	121	57.1 Å²	57.1	65%	0.647	29%	0.286	S	S	*	.			trans	55.2	19.7	-171.1	-159.1	36.3	0	0	0	113.4	N126	N126-N130 VanDerWaalsContact O-CA 3.27Å; N126-N130 WeakPolarHBondContact O-CA 3.32Å; N126-N130 PolarHBondContact O-N 3.14Å
131	E	87.2	Confident	90.4	Very high	118 Å²	118	56.6 Å²	56.6	55%	0.551	28%	0.283	S	S	*	.	P	Polyproline II helix	trans	-92.9	150.3	179.1	-67.9	172.2	150.3	0	0	110.9	L125 N126 T129	L125-E131 WeakPolarHBondContact CA-O 3.31Å; N126-E131 PolarHBondContact N-O 2.98Å; T129-E131 PolarHBondContact O-N 3.21Å; T129-E131 VanDerWaalsContact O-N 3.1Å; T129-E131 WeakPolarHBondContact OG1-CB 3.4Å; T129-E131 PolarHBondContact OG1-OE2 2.79Å
132	P	89.9	Confident	90.6	Very high	43 Å²	43	53.5 Å²	53.5	28%	0.279	27%	0.269	S	S	.	.	B	Isolated β-bridge	trans	-57.3	145	171.3	-25.4	36.4	0	0	0	112.9	T73 K75 L125 P162	T73-P132 HydrophobicContact CG2-CB 3.51Å; T73-P132 HydrophobicContact CG2-CG 4.39Å; K75-P132 HydrophobicContact CB-CB 4.26Å; K75-P132 HydrophobicContact CB-CG 4.31Å; K75-P132 HydrophobicContact CG-CG 4.47Å; L125-P132 HydrophobicContact CD2-CG 4.28Å; P132-P162 HydrophobicContact CB-CG 4.28Å; P132-P162 HydrophobicContact CG-CG 4.12Å
133	I	91.8	Very high	90.8	Very high	26 Å²	26	55.4 Å²	55.4	13%	0.133	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	129.5	-177.4	-66.8	171.1	0	0	0	110.2	V74 V98 I108 L124	V74-I133 PolarHBondContact N-O 3.44Å; V74-I133 PolarHBondContact O-N 3.28Å; V74-I133 VanDerWaalsContact O-N 3.16Å; V98-I133 HydrophobicContact CG1-CG2 4.45Å; V98-I133 HydrophobicContact CG2-CG2 4.12Å; I108-I133 HydrophobicContact CB-CD1 4.27Å; I108-I133 HydrophobicContact CD1-CD1 3.51Å; I108-I133 HydrophobicContact CG1-CD1 4.5Å; I108-I133 HydrophobicContact CG2-CD1 4.11Å; L124-I133 HydrophobicContact CB-CD1 4.39Å; L124-I133 WeakPolarHBondContact O-CG1 3.42Å; L124-I133 PolarHBondContact O-N 2.89Å
134	S	93.1	Very high	91	Very high	44 Å²	44	53.5 Å²	53.5	31%	0.308	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	108.2	175.1	-63.9	0	0	0	0	111	R71 T72 T73	R71-S134 PolarHBondContact NE-O 3.45Å; R71-S134 PolarHBondContact NH2-O 3.1Å; T72-S134 WeakPolarHBondContact O-CA 3.3Å; T73-S134 PolarHBondContact OG1-OG 2.82Å; T73-S134 VanDerWaalsContact OG1-OG 3.13Å
135	T	94.1	Very high	91.2	Very high	5 Å²	5	53.6 Å²	53.6	3%	0.031	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	161.5	-172.1	-171.9	0	0	0	0	112.1	T72 V98 G99 M137 I138	T72-T135 PolarHBondContact N-O 3.29Å; T72-T135 PolarHBondContact O-N 2.82Å; V98-T135 HydrophobicContact CB-CG2 4.19Å; V98-T135 HydrophobicContact CG1-CG2 4.21Å; G99-T135 PolarHBondContact N-OG1 2.79Å; G99-T135 PolarHBondContact O-OG1 2.52Å; T135-M137 WeakPolarHBondContact CG2-O 3.23Å; T135-M137 PolarHBondContact OG1-N 3.33Å; T135-M137 PolarHBondContact OG1-O 2.79Å; T135-I138 HydrophobicContact CG2-CD1 4.3Å; T135-I138 HydrophobicContact CG2-CG1 3.67Å
136	F	95.1	Very high	91.4	Very high	78 Å²	78	51.9 Å²	51.9	34%	0.342	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	-29.2	169.7	-73.5	-90.9	0	0	0	111.9	F68 R71	F68-F136 PolarHBondContact N-O 2.92Å; R71-F136 HydrophobicContact CB-CD1 4.5Å; R71-F136 HydrophobicContact CB-CD2 4.22Å; R71-F136 HydrophobicContact CB-CE1 4.07Å; R71-F136 HydrophobicContact CB-CE2 3.75Å; R71-F136 HydrophobicContact CB-CZ 3.68Å; R71-F136 HydrophobicContact CG-CD2 4.28Å; R71-F136 HydrophobicContact CG-CE2 4.03Å; R71-F136 HydrophobicContact CG-CZ 4.46Å; R71-F136 VanDerWaalsContact N-CE1 3.28Å
137	M	95.4	Very high	91.8	Very high	2 Å²	2	54.8 Å²	54.8	1%	0.01	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	140.5	-176.9	-175.4	177.5	175.3	0	0	110.7	N65 I66 Q67 V98 G99 F102 L105 T135 Q139	N65-M137 HydrophobicContact CB-CE 3.71Å; N65-M137 VanDerWaalsContact OD1-CE 3.24Å; N65-M137 WeakPolarHBondContact OD1-CE 3.46Å; I66-M137 CarbonylContact O-C 3.49Å; I66-M137 WeakPolarHBondContact O-CA 3.27Å; Q67-M137 HydrophobicContact CG-CB 4.39Å; Q67-M137 HydrophobicContact CG-CG 3.9Å; Q67-M137 HydrophobicContact CG-SD 4.15Å; V98-M137 WeakPolarHBondContact CA-O 3.42Å; G99-M137 PolarHBondContact N-O 3.34Å; G99-M137 VanDerWaalsContact N-O 3.08Å; G99-M137 WeakPolarHBondContact O-CB 3.36Å; G99-M137 PolarHBondContact O-N 2.82Å; F102-M137 HydrophobicContact CD1-CE 3.32Å; F102-M137 HydrophobicContact CD1-SD 3.98Å; F102-M137 HydrophobicContact CE1-CE 3.24Å; F102-M137 HydrophobicContact CE1-SD 4.15Å; F102-M137 HydrophobicContact CG-CE 4.13Å; F102-M137 HydrophobicContact CG-SD 4.2Å; F102-M137 HydrophobicContact CZ-CE 4.01Å; L105-M137 HydrophobicContact CD1-CE 4.17Å; L105-M137 HydrophobicContact CD2-CB 4.48Å; L105-M137 HydrophobicContact CD2-CE 4.47Å; L105-M137 HydrophobicContact CD2-CG 4.17Å; L105-M137 HydrophobicContact CD2-SD 4.03Å; T135-M137 WeakPolarHBondContact CG2-O 3.23Å; T135-M137 PolarHBondContact OG1-N 3.33Å; T135-M137 PolarHBondContact OG1-O 2.79Å; M137-Q139 HydrophobicContact CE-CB 4.39Å
138	I	96.4	Very high	92.4	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	136.1	166.3	-57.8	175.3	0	0	0	106.9	I66 F68 V74 V96 R97 V98 L124 T135 I140 V159	I66-I138 HydrophobicContact CB-CB 4.27Å; I66-I138 PolarHBondContact N-O 3.49Å; I66-I138 PolarHBondContact O-N 2.88Å; F68-I138 HydrophobicContact CE2-CD1 3.95Å; F68-I138 HydrophobicContact CE2-CG1 4.2Å; F68-I138 HydrophobicContact CZ-CD1 4.47Å; V74-I138 HydrophobicContact CB-CD1 4.09Å; V74-I138 HydrophobicContact CG1-CD1 3.94Å; V74-I138 HydrophobicContact CG2-CD1 3.8Å; V96-I138 HydrophobicContact CG1-CG2 4.04Å; R97-I138 CarbonylContact O-C 3.59Å; R97-I138 WeakPolarHBondContact O-CA 3.5Å; V98-I138 HydrophobicContact CG1-CG1 4.18Å; L124-I138 HydrophobicContact CD1-CD1 4.04Å; T135-I138 HydrophobicContact CG2-CD1 4.3Å; T135-I138 HydrophobicContact CG2-CG1 3.67Å; I138-I140 HydrophobicContact CG2-CG1 4.49Å; I138-V159 HydrophobicContact CD1-CG1 4.3Å
139	Q	97.2	Very high	93	Very high	13 Å²	13	43.7 Å²	43.7	6%	0.061	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	124.9	171.2	177.2	178.3	91.4	0	0	108.7	L63 V64 N65 R97 L105 M137	L63-Q139 HydrophobicContact CD2-CG 4.36Å; V64-Q139 CarbonylContact O-C 3.59Å; V64-Q139 WeakPolarHBondContact O-CA 3.37Å; N65-Q139 WeakPolarHBondContact OD1-CG 3.18Å; N65-Q139 PolarHBondContact OD1-NE2 3.34Å; R97-Q139 HydrophobicContact CB-CB 4.3Å; R97-Q139 PolarHBondContact N-O 2.87Å; R97-Q139 VanDerWaalsContact NH1-OE1 3.14Å; R97-Q139 PolarHBondContact O-N 2.99Å; L105-Q139 HydrophobicContact CD1-CB 3.83Å; L105-Q139 VanDerWaalsContact CD1-CD 3.42Å; L105-Q139 HydrophobicContact CD1-CG 4.25Å; L105-Q139 VanDerWaalsContact CD1-NE2 3.34Å; L105-Q139 HydrophobicContact CD2-CB 4.36Å; M137-Q139 HydrophobicContact CE-CB 4.39Å
140	I	97.1	Very high	93.6	Very high	0 Å²	0	49 Å²	49	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	118.6	172	-52.7	165.8	0	0	0	106.1	L63 V64 I66 L77 I79 I94 I138 I157	L63-I140 CarbonylContact C-O 3.57Å; L63-I140 WeakPolarHBondContact CA-O 3.47Å; V64-I140 HydrophobicContact CB-CB 4.18Å; V64-I140 HydrophobicContact CB-CD1 4.41Å; V64-I140 PolarHBondContact N-O 3.4Å; V64-I140 PolarHBondContact O-N 2.78Å; I66-I140 HydrophobicContact CD1-CD1 3.99Å; L77-I140 HydrophobicContact CD1-CD1 3.88Å; L77-I140 HydrophobicContact CD2-CD1 3.59Å; L77-I140 HydrophobicContact CD2-CG1 3.76Å; L77-I140 HydrophobicContact CG-CD1 4.3Å; I79-I140 HydrophobicContact CD1-CD1 4.41Å; I79-I140 HydrophobicContact CD1-CG2 4.12Å; I94-I140 HydrophobicContact CG2-CG2 3.54Å; I138-I140 HydrophobicContact CG2-CG1 4.49Å; I140-I157 HydrophobicContact CD1-CD1 3.84Å; I140-I157 HydrophobicContact CD1-CG2 4.07Å
141	A	97.1	Very high	94.2	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	113.4	179.9	0	0	0	0	0	109.5	H62 L63 I94 S95 L143	H62-A141 WeakPolarHBondContact O-CA 3.48Å; L63-A141 HydrophobicContact CD2-CB 3.54Å; I94-A141 CarbonylContact C-O 3.55Å; I94-A141 WeakPolarHBondContact CA-O 3.34Å; S95-A141 PolarHBondContact N-O 3.11Å; S95-A141 PolarHBondContact O-N 2.94Å; A141-L143 HydrophobicContact CB-CD2 4.07Å; A141-L143 PolarHBondContact O-N 3.21Å
142	V	97.2	Very high	94.6	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	105	169.1	-176.8	0	0	0	0	107.4	P61 H62 P91 I94 N145 T152 M154	P61-V142 VanDerWaalsContact CA-O 3.23Å; P61-V142 WeakPolarHBondContact CA-O 3.45Å; P61-V142 WeakPolarHBondContact CB-O 3.44Å; H62-V142 HydrophobicContact CB-CB 4.27Å; H62-V142 PolarHBondContact N-O 2.97Å; H62-V142 VanDerWaalsContact N-O 3.1Å; H62-V142 PolarHBondContact O-N 2.8Å; P91-V142 HydrophobicContact CB-CG1 3.73Å; P91-V142 HydrophobicContact CB-CG2 4.36Å; I94-V142 HydrophobicContact CG1-CG2 4.37Å; V142-N145 WeakPolarHBondContact CG1-OD1 3.42Å; V142-T152 HydrophobicContact CB-CG2 4.45Å; V142-T152 HydrophobicContact CG1-CG2 4.46Å; V142-T152 HydrophobicContact CG2-CG2 4.19Å; V142-M154 HydrophobicContact CG2-SD 4.11Å
143	L	96.6	Very high	95	Very high	48 Å²	48	37 Å²	37	25%	0.251	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	-33.3	-175.9	-58	-175.8	0	0	0	112	P61 K93 A141	P61-L143 HydrophobicContact CB-CD2 3.94Å; K93-L143 HydrophobicContact CB-CB 4.29Å; K93-L143 HydrophobicContact CD-CB 4.39Å; K93-L143 HydrophobicContact CD-CD1 4.33Å; K93-L143 HydrophobicContact CG-CB 4.15Å; K93-L143 HydrophobicContact CG-CD1 4.19Å; K93-L143 PolarHBondContact O-N 3.07Å; A141-L143 HydrophobicContact CB-CD2 4.07Å; A141-L143 PolarHBondContact O-N 3.21Å
144	A	95.9	Very high	95.1	Very high	28 Å²	28	35.7 Å²	35.7	23%	0.231	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	155.2	177.6	0	0	0	0	0	110.6	S92 K93	S92-A144 PolarHBondContact N-O 2.77Å; S92-A144 VanDerWaalsContact OG-C 3.24Å; S92-A144 PolarHBondContact OG-O 3.37Å; S92-A144 VanDerWaalsContact OG-O 3.09Å; K93-A144 HydrophobicContact CB-CB 4.12Å; K93-A144 PolarHBondContact N-O 3.23Å; K93-A144 PolarHBondContact O-N 2.68Å
145	N	95.6	Very high	95.2	Very high	4 Å²	4	34.7 Å²	34.7	2%	0.021	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	170.3	172.7	-61.4	-45.7	0	0	0	110.9	Q60 S88 T90 P91 S92 V142 G149 D151 T152	Q60-N145 PolarHBondContact NE2-ND2 2.9Å; S88-N145 VanDerWaalsContact O-CB 3.29Å; S88-N145 WeakPolarHBondContact O-CB 3.33Å; T90-N145 CarbonylContact O-C 3.51Å; T90-N145 WeakPolarHBondContact O-CA 3.35Å; P91-N145 WeakPolarHBondContact CA-OD1 3.36Å; S92-N145 PolarHBondContact OG-N 3.2Å; S92-N145 PolarHBondContact OG-O 2.9Å; V142-N145 WeakPolarHBondContact CG1-OD1 3.42Å; N145-G149 WeakPolarHBondContact CB-O 3.41Å; N145-G149 PolarHBondContact ND2-O 3.44Å; N145-D151 PolarHBondContact ND2-O 2.92Å; N145-T152 WeakPolarHBondContact OD1-CB 3.29Å; N145-T152 PolarHBondContact OD1-OG1 2.94Å
146	H	92.9	Very high	95.3	Very high	24 Å²	24	34.6 Å²	34.6	11%	0.111	17%	0.166	C	C	.	.	G	3₁₀ helix	trans	-66.6	150.7	170.7	-72.6	75.6	0	0	0	110.3	Y83 S88 T90 P91 M113 E115 N148 G149	Y83-H146 HydrophobicContact CD2-CB 4.35Å; Y83-H146 HydrophobicContact CE2-CB 3.88Å; Y83-H146 AromaticContact CE2-CD2 3.92Å; Y83-H146 AromaticContact CE2-CG 3.94Å; S88-H146 WeakPolarHBondContact CA-O 3.11Å; S88-H146 VanDerWaalsContact O-O 3.1Å; T90-H146 PolarHBondContact O-N 2.99Å; T90-H146 PolarHBondContact O-ND1 3.28Å; P91-H146 PolarHBondContact O-CE1 2.96Å; P91-H146 PolarHBondContact O-ND1 2.75Å; M113-H146 PolarHBondContact O-CE1 3.09Å; M113-H146 PolarHBondContact O-NE2 2.86Å; E115-H146 PolarHBondContact N-NE2 2.87Å; H146-N148 PolarHBondContact O-N 2.84Å; H146-G149 PolarHBondContact O-N 3.43Å
147	Q	92.4	Very high	95.3	Very high	128 Å²	128	30.9 Å²	30.9	60%	0.598	15%	0.149	S	C	*	.	G	3₁₀ helix	trans	53.4	24.4	177.9	-51.5	178.2	4.9	0	0	114.4	Y83 G149	Y83-Q147 PolarHBondContact OH-NE2 3.06Å; Q147-G149 PolarHBondContact O-N 2.93Å
148	N	91.4	Very high	95.4	Very high	157 Å²	157	31.2 Å²	31.2	84%	0.84	15%	0.151	S	C	*	.	G	3₁₀ helix	trans	55.9	34.1	-173.7	-58.3	-35.6	0	0	0	114	H146 R150	H146-N148 PolarHBondContact O-N 2.84Å; N148-R150 PolarHBondContact O-N 2.76Å
149	G	92.7	Very high	95.3	Very high	8 Å²	8	31.2 Å²	31.2	8%	0.082	15%	0.151	C	C	.	.			trans	-56.7	136.9	174.4	0	0	0	0	0	112	Q60 S88 N145 H146 Q147	Q60-G149 PolarHBondContact NE2-O 2.97Å; S88-G149 WeakPolarHBondContact O-CA 3.37Å; N145-G149 WeakPolarHBondContact CB-O 3.41Å; N145-G149 PolarHBondContact ND2-O 3.44Å; H146-G149 PolarHBondContact O-N 3.43Å; Q147-G149 PolarHBondContact O-N 2.93Å
150	R	94	Very high	95.2	Very high	183 Å²	183	30.6 Å²	30.6	69%	0.691	15%	0.148	S	C	*	.	S	Bend	trans	-71.4	-51.5	-176.1	-178.3	177.7	175.9	170.1	-2.8	111.8	Q60 H62 N148	Q60-R150 PolarHBondContact NE2-O 2.76Å; H62-R150 PolarHBondContact NE2-O 2.75Å; N148-R150 PolarHBondContact O-N 2.76Å
151	D	95.3	Very high	95	Very high	16 Å²	16	31.8 Å²	31.8	9%	0.086	16%	0.155	C	C	.	.	S	Bend	trans	-100.2	161.2	-178.8	-58	-35.1	0	0	0	110.7	S56 Y89 N145	S56-D151 VanDerWaalsContact O-CB 3.27Å; S56-D151 WeakPolarHBondContact O-CB 3.12Å; S56-D151 WeakPolarHBondContact OG-CA 3.31Å; Y89-D151 HydrophobicContact CD1-CB 4Å; Y89-D151 WeakPolarHBondContact CD1-O 3.32Å; Y89-D151 HydrophobicContact CE1-CB 3.92Å; N145-D151 PolarHBondContact ND2-O 2.92Å
152	T	96.1	Very high	94.7	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.163	C	C	.	.			trans	-118	145.1	179.3	-165.3	0	0	0	0	111.3	W54 Q55 S56 H62 Y89 V142 N145	W54-T152 HydrophobicContact CE3-CG2 4.49Å; W54-T152 HydrophobicContact CH2-CG2 4.17Å; W54-T152 HydrophobicContact CZ3-CG2 4.03Å; Q55-T152 WeakPolarHBondContact CA-O 3.39Å; S56-T152 PolarHBondContact N-O 3.43Å; S56-T152 PolarHBondContact OG-N 3.5Å; H62-T152 HydrophobicContact CB-CG2 3.96Å; Y89-T152 VanDerWaalsContact O-CA 3.31Å; Y89-T152 WeakPolarHBondContact O-CA 3.39Å; Y89-T152 PolarHBondContact O-OG1 3.03Å; V142-T152 HydrophobicContact CB-CG2 4.45Å; V142-T152 HydrophobicContact CG1-CG2 4.46Å; V142-T152 HydrophobicContact CG2-CG2 4.19Å; N145-T152 WeakPolarHBondContact OD1-CB 3.29Å; N145-T152 PolarHBondContact OD1-OG1 2.94Å
153	H	96.7	Very high	94.1	Very high	12 Å²	12	35.1 Å²	35.1	6%	0.056	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	125	166.3	-70.8	176.9	0	0	0	109.3	Y53 W54 D86 Y89	Y53-H153 HydrophobicContact CD2-CB 4.36Å; Y53-H153 AromaticContact CD2-CD2 3.72Å; Y53-H153 AromaticContact CD2-CE1 3.98Å; Y53-H153 AromaticContact CD2-CG 3.77Å; Y53-H153 AromaticContact CD2-ND1 3.92Å; Y53-H153 AromaticContact CD2-NE2 3.89Å; Y53-H153 AromaticContact CE2-CD2 3.88Å; Y53-H153 AromaticContact CE2-CE1 3.51Å; Y53-H153 AromaticContact CE2-ND1 3.87Å; Y53-H153 AromaticContact CE2-NE2 3.52Å; Y53-H153 AromaticContact CZ-CE1 3.94Å; W54-H153 WeakPolarHBondContact O-CA 3.39Å; D86-H153 HydrophobicContact CB-CB 4.23Å; D86-H153 IonicContact OD1-CG 2.72Å; D86-H153 IonicContact OD1-ND1 3.61Å; D86-H153 PolarHBondContact OD1-ND1 3.48Å; Y89-H153 AromaticContact CD1-CD2 3.71Å; Y89-H153 AromaticContact CD1-NE2 3.52Å; Y89-H153 AromaticContact CD2-CE1 3.96Å; Y89-H153 AromaticContact CE1-NE2 3.91Å; Y89-H153 AromaticContact CG-CD2 3.89Å; Y89-H153 AromaticContact CG-CE1 3.75Å; Y89-H153 AromaticContact CG-ND1 3.94Å; Y89-H153 AromaticContact CG-NE2 3.72Å; Y89-H153 PolarHBondContact O-N 3.46Å
154	M	94.9	Very high	92.6	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	120.7	166.8	-62.6	-173.5	72.8	0	0	108.5	L45 Y53 W54 V64 I79 V142 I157	L45-M154 HydrophobicContact CD1-CB 3.57Å; L45-M154 WeakPolarHBondContact CD1-O 3.44Å; Y53-M154 WeakPolarHBondContact CA-O 3.48Å; W54-M154 HydrophobicContact CE3-CB 3.95Å; W54-M154 HydrophobicContact CE3-CG 3.92Å; W54-M154 HydrophobicContact CE3-SD 3.79Å; W54-M154 HydrophobicContact CZ3-CG 4.15Å; W54-M154 HydrophobicContact CZ3-SD 3.56Å; W54-M154 VanDerWaalsContact CZ3-SD 3.56Å; W54-M154 PolarHBondContact N-O 3.35Å; W54-M154 PolarHBondContact O-N 3.12Å; W54-M154 VanDerWaalsContact O-N 3.11Å; V64-M154 HydrophobicContact CG2-SD 4.11Å; I79-M154 HydrophobicContact CB-CE 4.37Å; I79-M154 HydrophobicContact CD1-CE 3.96Å; I79-M154 HydrophobicContact CG1-CE 4.12Å; I79-M154 HydrophobicContact CG2-CE 3.38Å; V142-M154 HydrophobicContact CG2-SD 4.11Å; M154-I157 HydrophobicContact CE-CD1 3.34Å; M154-I157 HydrophobicContact CE-CG1 3.77Å; M154-I157 HydrophobicContact SD-CD1 4.11Å
155	R	95.1	Very high	90.7	Very high	23 Å²	23	44.8 Å²	44.8	9%	0.087	22%	0.215	C	C	.	.			trans	-80.8	-50.1	-174.4	-69.2	165.9	179.6	-78.5	-7.5	111.4	Q44 L50 E51 T52 Y80 D86	Q44-R155 VanDerWaalsContact O-O 3.09Å; L50-R155 WeakPolarHBondContact O-CD 3.26Å; L50-R155 PolarHBondContact O-NH1 3.21Å; E51-R155 PolarHBondContact O-NH1 3.2Å; T52-R155 WeakPolarHBondContact O-CA 3.47Å; Y80-R155 HydrophobicContact CD1-CB 3.8Å; Y80-R155 HydrophobicContact CD1-CG 4.31Å; D86-R155 IonicContact OD1-CZ 3.67Å; D86-R155 IonicContact OD1-NE 2.92Å; D86-R155 IonicContact OD1-NH2 3.53Å; D86-R155 PolarHBondContact OD1-NH2 2.98Å; D86-R155 IonicContact OD2-CZ 2.76Å; D86-R155 IonicContact OD2-NE 2.76Å; D86-R155 PolarHBondContact OD2-NE 3.45Å; D86-R155 IonicContact OD2-NH2 3.58Å
156	Q	95.8	Very high	88.4	Confident	2 Å²	2	47.2 Å²	47.2	1%	0.009	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	142.1	-176.7	-172.1	63.7	-20.8	0	0	112.1	L45 R46 D48 L50 Y80 W119 K158	L45-Q156 PolarHBondContact O-OE1 2.72Å; R46-Q156 VanDerWaalsContact CA-OE1 3.31Å; R46-Q156 VanDerWaalsContact N-OE1 3.14Å; D48-Q156 VanDerWaalsContact N-NE2 3.1Å; D48-Q156 PolarHBondContact OD1-NE2 2.86Å; L50-Q156 HydrophobicContact CD2-CB 4.25Å; Y80-Q156 PolarHBondContact N-O 3.35Å; W119-Q156 HydrophobicContact CH2-CB 3.9Å; W119-Q156 HydrophobicContact CH2-CG 3.53Å; W119-Q156 HydrophobicContact CZ2-CG 4.44Å; W119-Q156 HydrophobicContact CZ3-CB 4.34Å; W119-Q156 HydrophobicContact CZ3-CG 4.21Å; Q156-K158 HydrophobicContact CG-CG 4.39Å
157	I	96.4	Very high	86.1	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	129.1	171.6	-54.4	-178.3	0	0	0	110.8	W31 L45 R46 V64 L77 C78 I79 I140 M154	W31-I157 HydrophobicContact CH2-CB 3.99Å; W31-I157 HydrophobicContact CH2-CG2 3.68Å; W31-I157 HydrophobicContact CZ3-CB 3.94Å; W31-I157 HydrophobicContact CZ3-CD1 4.31Å; W31-I157 HydrophobicContact CZ3-CG2 3.85Å; L45-I157 HydrophobicContact CD1-CD1 3.89Å; L45-I157 HydrophobicContact CD1-CG1 3.73Å; L45-I157 HydrophobicContact CD2-CD1 3.7Å; L45-I157 HydrophobicContact CD2-CG1 4.16Å; L45-I157 HydrophobicContact CG-CB 4.33Å; L45-I157 HydrophobicContact CG-CD1 3.97Å; L45-I157 HydrophobicContact CG-CG1 3.88Å; L45-I157 PolarHBondContact O-N 2.79Å; R46-I157 PolarHBondContact NH1-O 3.42Å; V64-I157 HydrophobicContact CB-CD1 4.44Å; V64-I157 HydrophobicContact CG1-CD1 4.15Å; V64-I157 HydrophobicContact CG2-CD1 4.1Å; L77-I157 HydrophobicContact CD1-CG2 3.56Å; C78-I157 WeakPolarHBondContact O-CA 3.5Å; I79-I157 HydrophobicContact CG1-CG1 4.4Å; I79-I157 HydrophobicContact CG1-CG2 4.44Å; I140-I157 HydrophobicContact CD1-CD1 3.84Å; I140-I157 HydrophobicContact CD1-CG2 4.07Å; M154-I157 HydrophobicContact CE-CD1 3.34Å; M154-I157 HydrophobicContact CE-CG1 3.77Å; M154-I157 HydrophobicContact SD-CD1 4.11Å
158	K	95.6	Very high	84.1	Confident	9 Å²	9	46.5 Å²	46.5	4%	0.039	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	137.6	174.2	-58.6	-164.9	175.1	-148.3	0	110.9	P13 E24 D48 C78 W119 Q156 Y160	P13-K158 HydrophobicContact CB-CD 4.21Å; E24-K158 HydrophobicContact CG-CB 4.45Å; D48-K158 WeakPolarHBondContact OD1-CE 3.42Å; D48-K158 IonicContact OD1-NZ 3.93Å; D48-K158 PolarHBondContact OD1-NZ 2.98Å; D48-K158 IonicContact OD2-NZ 3.03Å; C78-K158 HydrophobicContact CB-CB 4.26Å; C78-K158 PolarHBondContact N-O 2.97Å; C78-K158 PolarHBondContact O-N 3.34Å; W119-K158 HydrophobicContact CH2-CD 4.19Å; W119-K158 HydrophobicContact CH2-CG 4.24Å; W119-K158 HydrophobicContact CZ3-CG 4.35Å; Q156-K158 HydrophobicContact CG-CG 4.39Å; K158-Y160 HydrophobicContact CB-CD2 4.45Å; K158-Y160 HydrophobicContact CB-CE2 3.63Å; K158-Y160 HydrophobicContact CD-CE2 4.5Å; K158-Y160 WeakPolarHBondContact CD-OH 3.39Å
159	V	95.2	Very high	82.4	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	129.1	179.2	-170.1	0	0	0	0	108.8	E24 I25 W31 I66 F68 V74 L77 I138	E24-V159 CarbonylContact C-O 3.6Å; E24-V159 WeakPolarHBondContact CA-O 3.39Å; I25-V159 HydrophobicContact CD1-CG1 4.03Å; I25-V159 HydrophobicContact CG1-CB 4.17Å; I25-V159 HydrophobicContact CG1-CG1 4Å; I25-V159 WeakPolarHBondContact CG1-O 3.23Å; I25-V159 PolarHBondContact N-O 3.21Å; W31-V159 HydrophobicContact CH2-CG2 3.75Å; W31-V159 HydrophobicContact CZ2-CG2 3.89Å; I66-V159 HydrophobicContact CD1-CG2 3.82Å; F68-V159 HydrophobicContact CZ-CG1 4.19Å; V74-V159 HydrophobicContact CG1-CG1 3.44Å; V74-V159 VanDerWaalsContact CG1-CG1 3.44Å; V74-V159 HydrophobicContact CG2-CG1 4.37Å; L77-V159 HydrophobicContact CD1-CG2 3.81Å; I138-V159 HydrophobicContact CD1-CG1 4.3Å
160	Y	94.6	Very high	80.5	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	125.3	-174.3	-68.6	-74.1	0	0	0	112.3	P13 E17 V22 R23 E24 V74 K75 M76 C78 K158	P13-Y160 HydrophobicContact CB-CE2 3.94Å; P13-Y160 WeakPolarHBondContact CB-OH 3.42Å; E17-Y160 HydrophobicContact CG-CD1 4.49Å; E17-Y160 HydrophobicContact CG-CE1 3.5Å; E17-Y160 VanDerWaalsContact CG-CE1 3.5Å; E17-Y160 VanDerWaalsContact OE1-CE1 3.23Å; E17-Y160 WeakPolarHBondContact OE1-CE1 3.45Å; E17-Y160 VanDerWaalsContact OE1-CZ 3.32Å; E17-Y160 PolarHBondContact OE1-OH 3.05Å; V22-Y160 HydrophobicContact CB-CD1 4.24Å; V22-Y160 HydrophobicContact CB-CG 4.5Å; V22-Y160 HydrophobicContact CG2-CD1 3.75Å; V22-Y160 HydrophobicContact CG2-CE1 4.38Å; V22-Y160 HydrophobicContact CG2-CG 4.18Å; R23-Y160 WeakPolarHBondContact O-CA 3.12Å; E24-Y160 HydrophobicContact CB-CD1 4.29Å; E24-Y160 HydrophobicContact CB-CE1 3.88Å; E24-Y160 HydrophobicContact CG-CE1 4.16Å; V74-Y160 WeakPolarHBondContact CG1-O 3.46Å; K75-Y160 PolarHBondContact N-O 3.37Å; M76-Y160 PolarHBondContact N-O 3.33Å; M76-Y160 PolarHBondContact O-N 3.46Å; C78-Y160 HydrophobicContact CB-CE2 4.12Å; C78-Y160 VanDerWaalsContact SG-CE2 3.59Å; K158-Y160 HydrophobicContact CB-CD2 4.45Å; K158-Y160 HydrophobicContact CB-CE2 3.63Å; K158-Y160 HydrophobicContact CD-CE2 4.5Å; K158-Y160 WeakPolarHBondContact CD-OH 3.39Å
161	T	93.3	Very high	78.6	Confident	25 Å²	25	50.1 Å²	50.1	15%	0.153	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	146.4	163.6	-175.4	0	0	0	0	109.4	V22 R23 I25 T73 V163	V22-T161 VanDerWaalsContact CA-O 3.28Å; V22-T161 WeakPolarHBondContact CA-O 3.23Å; V22-T161 WeakPolarHBondContact CB-O 3.43Å; R23-T161 HydrophobicContact CB-CG2 3.87Å; R23-T161 PolarHBondContact N-O 2.93Å; R23-T161 WeakPolarHBondContact O-CG2 3.34Å; R23-T161 PolarHBondContact O-N 2.91Å; I25-T161 HydrophobicContact CG2-CG2 3.39Å; T73-T161 WeakPolarHBondContact O-CA 3.46Å; T73-T161 VanDerWaalsContact O-CB 3.26Å; T73-T161 WeakPolarHBondContact O-CB 3.41Å; T73-T161 PolarHBondContact O-OG1 3.42Å; T161-V163 PolarHBondContact O-N 2.81Å
162	P	90.5	Very high	76.8	Confident	26 Å²	26	54.7 Å²	54.7	17%	0.169	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58	135.5	159.2	28.4	-32	0	0	0	108.3	T73 K75 P132 E164	T73-P162 HydrophobicContact CG2-CG 3.7Å; K75-P162 HydrophobicContact CB-CB 4.41Å; K75-P162 HydrophobicContact CB-CG 4.38Å; K75-P162 HydrophobicContact CD-CB 4.16Å; P132-P162 HydrophobicContact CB-CG 4.28Å; P132-P162 HydrophobicContact CG-CG 4.12Å; P162-E164 PolarHBondContact O-N 3.31Å
163	V	84.2	Confident	75.2	Confident	44 Å²	44	62.1 Å²	62.1	27%	0.267	32%	0.324	S	S	.	.	P	Polyproline II helix	trans	-72.9	117.5	164.3	172.6	0	0	0	0	105.2	T21 V22 R23 T161 E165	T21-V163 PolarHBondContact O-N 2.99Å; V22-V163 VanDerWaalsContact C-CG2 3.49Å; R23-V163 HydrophobicContact CB-CG2 3.71Å; T161-V163 PolarHBondContact O-N 2.81Å; V163-E165 VanDerWaalsContact C-N 3.33Å; V163-E165 PolarHBondContact O-N 2.95Å
164	E	66.4	Low	73.4	Confident	161 Å²	161	63.8 Å²	63.8	75%	0.752	34%	0.337	S	S	*	.			trans	-56.3	109.5	160.7	-72.7	-177.5	178.9	0	0	105.3	P162 S166	P162-E164 PolarHBondContact O-N 3.31Å; E164-S166 PolarHBondContact O-N 2.65Å
165	E	54.8	Low	72.2	Confident	118 Å²	118	68.3 Å²	68.3	55%	0.551	37%	0.365	S	S	*	.			trans	-61.5	87.7	164.8	-79	-164.5	151	0	0	104.9	V163 S167 R173	V163-E165 VanDerWaalsContact C-N 3.33Å; V163-E165 PolarHBondContact O-N 2.95Å; E165-S167 VanDerWaalsContact C-N 3.3Å; E165-S167 WeakPolarHBondContact O-CA 3.37Å; E165-S167 PolarHBondContact O-N 3Å; E165-R173 IonicContact OE1-CZ 3.94Å; E165-R173 IonicContact OE1-NH1 2.78Å; E165-R173 PolarHBondContact OE1-NH1 3.38Å
166	S	48.2	Very low	71.6	Confident	56 Å²	56	70.8 Å²	70.8	39%	0.392	38%	0.383	S	S	.	.			trans	-23.9	93.5	-178.4	28.1	0	0	0	0	110.7	E164 I168 R183	E164-S166 PolarHBondContact O-N 2.65Å; S166-I168 PolarHBondContact O-N 2.83Å; S166-R183 VanDerWaalsContact CB-CZ 3.47Å; S166-R183 PolarHBondContact OG-NH1 3.31Å; S166-R183 PolarHBondContact OG-NH2 3.09Å
167	S	45.5	Very low	70.7	Confident	80 Å²	80	76.1 Å²	76.1	56%	0.559	42%	0.415	S	S	*	.			trans	-67.3	125.3	-179.4	48.1	0	0	0	0	104.9	E165 G169	E165-S167 VanDerWaalsContact C-N 3.3Å; E165-S167 WeakPolarHBondContact O-CA 3.37Å; E165-S167 PolarHBondContact O-N 3Å; S167-G169 WeakPolarHBondContact CB-O 3.44Å; S167-G169 PolarHBondContact O-N 3.42Å
168	I	49.4	Very low	70	Confident	56 Å²	56	81.8 Å²	81.8	29%	0.287	45%	0.446	S	S	.	.	B	Isolated β-bridge	trans	-74.6	77.3	170.7	-55.3	176.8	0	0	0	104.4	S166 F171 C174 F179 R183	S166-I168 PolarHBondContact O-N 2.83Å; I168-F171 PolarHBondContact O-N 3.02Å; I168-C174 HydrophobicContact CD1-CB 4.32Å; I168-F179 HydrophobicContact CD1-CD1 3.59Å; I168-F179 HydrophobicContact CD1-CE1 3.44Å; I168-F179 VanDerWaalsContact CD1-CE1 3.44Å; I168-F179 HydrophobicContact CG2-CE1 4.15Å; I168-R183 HydrophobicContact CD1-CG 4.21Å; I168-R183 HydrophobicContact CG1-CG 4.28Å
169	G	54.8	Low	69	Low	55 Å²	55	86.2 Å²	86.2	57%	0.567	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.1	-137.1	-169.6	0	0	0	0	0	113.3	S167 F171	S167-G169 WeakPolarHBondContact CB-O 3.44Å; S167-G169 PolarHBondContact O-N 3.42Å; G169-F171 PolarHBondContact O-N 3.29Å
170	K	53.6	Low	68.1	Low	211 Å²	211	90 Å²	90	92%	0.917	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	4.9	-178.4	-68.3	-177.2	178.8	179.1	0	114.3
171	F	54	Low	67.3	Low	159 Å²	159	96.2 Å²	96.2	70%	0.697	51%	0.514	S	S	*	.	B	Isolated β-bridge	trans	-103.4	148	-170.7	-65.6	-77.4	0	0	0	112.7	I168 G169	I168-F171 PolarHBondContact O-N 3.02Å; G169-F171 PolarHBondContact O-N 3.29Å
172	P	57.1	Low	66.6	Low	111 Å²	111	103.9 Å²	103.9	72%	0.721	54%	0.541	S	S	*	.	P	Polyproline II helix	trans	-63.6	164	174.9	26.2	-32.7	0	0	0	112	C174	P172-C174 PolarHBondContact O-N 3.35Å
173	R	63	Low	65.7	Low	156 Å²	156	108 Å²	108	59%	0.589	55%	0.553	S	S	*	*	P	Polyproline II helix	trans	-54.5	119.7	-175.2	-176.6	177.7	174.3	168	-6.1	112.3	E165 T175	E165-R173 IonicContact OE1-CZ 3.94Å; E165-R173 IonicContact OE1-NH1 2.78Å; E165-R173 PolarHBondContact OE1-NH1 3.38Å; R173-T175 HydrophobicContact CG-CG2 3.97Å
174	C	59.8	Low	64.9	Low	48 Å²	48	110.2 Å²	110.2	32%	0.324	57%	0.568	S	S	.	*	P	Polyproline II helix	trans	-83.4	120.9	157.8	-92.9	0	0	0	0	109.1	I168 P172 F179	I168-C174 HydrophobicContact CD1-CB 4.32Å; P172-C174 PolarHBondContact O-N 3.35Å; C174-F179 HydrophobicContact CB-CB 3.9Å; C174-F179 HydrophobicContact CB-CD1 3.3Å; C174-F179 HydrophobicContact CB-CD2 4.41Å; C174-F179 HydrophobicContact CB-CE1 3.87Å; C174-F179 HydrophobicContact CB-CG 3.61Å
175	T	69.7	Low	65.2	Low	95 Å²	95	111.3 Å²	111.3	58%	0.583	58%	0.577	S	S	*	*			trans	-94.3	-13	-179	47.8	0	0	0	0	113.6	R173	R173-T175 HydrophobicContact CG-CG2 3.97Å
176	T	81.5	Confident	65.4	Low	75 Å²	75	119.9 Å²	119.9	46%	0.46	60%	0.604	S	S	.	*			trans	-71.4	137.8	-175.6	-42.6	0	0	0	0	111.7	D178 F179 M180	T176-D178 VanDerWaalsContact C-N 3.27Å; T176-D178 HydrophobicContact CG2-CB 4.33Å; T176-D178 PolarHBondContact O-N 3.29Å; T176-F179 PolarHBondContact O-N 2.77Å; T176-F179 VanDerWaalsContact O-N 3.1Å; T176-M180 PolarHBondContact O-N 2.96Å; T176-M180 VanDerWaalsContact O-N 3.1Å
177	V	77.8	Confident	66.2	Low	114 Å²	114	123.1 Å²	123.1	69%	0.691	61%	0.614	S	S	*	*	H	α-helix	trans	-56.1	-42.5	179.5	178.6	0	0	0	0	111.5	F179 M180 M181	V177-F179 PolarHBondContact O-N 3.48Å; V177-M180 PolarHBondContact O-N 3.05Å; V177-M180 VanDerWaalsContact O-N 3.13Å; V177-M181 PolarHBondContact O-N 2.93Å
178	D	80.9	Confident	67.3	Low	119 Å²	119	125.3 Å²	125.3	64%	0.636	62%	0.617	S	S	*	*	H	α-helix	trans	-56.9	-39.4	179	-55.8	-40.3	0	0	0	112.1	T176 Y182	T176-D178 VanDerWaalsContact C-N 3.27Å; T176-D178 HydrophobicContact CG2-CB 4.33Å; T176-D178 PolarHBondContact O-N 3.29Å; D178-Y182 WeakPolarHBondContact O-CD2 3.47Å
179	F	75.7	Confident	68.3	Low	102 Å²	102	129.2 Å²	129.2	45%	0.447	64%	0.636	S	S	.	*	H	α-helix	trans	-78	-34.2	-179.7	-152.2	-89.4	0	0	0	112	I168 C174 T176 V177 M181	I168-F179 HydrophobicContact CD1-CD1 3.59Å; I168-F179 HydrophobicContact CD1-CE1 3.44Å; I168-F179 VanDerWaalsContact CD1-CE1 3.44Å; I168-F179 HydrophobicContact CG2-CE1 4.15Å; C174-F179 HydrophobicContact CB-CB 3.9Å; C174-F179 HydrophobicContact CB-CD1 3.3Å; C174-F179 HydrophobicContact CB-CD2 4.41Å; C174-F179 HydrophobicContact CB-CE1 3.87Å; C174-F179 HydrophobicContact CB-CG 3.61Å; T176-F179 PolarHBondContact O-N 2.77Å; T176-F179 VanDerWaalsContact O-N 3.1Å; V177-F179 PolarHBondContact O-N 3.48Å; F179-M181 VanDerWaalsContact C-N 3.32Å
180	M	75.8	Confident	69.1	Low	79 Å²	79	133.5 Å²	133.5	39%	0.389	64%	0.64	S	S	.	*	H	α-helix	trans	-68.2	-32	176	-68.5	-160.3	-176.6	0	0	112.4	T176 V177 Y182 R183	T176-M180 PolarHBondContact O-N 2.96Å; T176-M180 VanDerWaalsContact O-N 3.1Å; V177-M180 PolarHBondContact O-N 3.05Å; V177-M180 VanDerWaalsContact O-N 3.13Å; M180-Y182 VanDerWaalsContact C-N 3.27Å; M180-Y182 PolarHBondContact O-N 3.05Å; M180-R183 VanDerWaalsContact O-CB 3.23Å; M180-R183 WeakPolarHBondContact O-CB 3.12Å; M180-R183 PolarHBondContact O-N 2.67Å
181	M	78.2	Confident	70.1	Confident	130 Å²	130	128.7 Å²	128.7	64%	0.64	62%	0.622	S	S	*	*	H	α-helix	trans	-61.2	-35.2	-178.8	-165.8	173.1	98.3	0	0	112.6	V177 F179	V177-M181 PolarHBondContact O-N 2.93Å; F179-M181 VanDerWaalsContact C-N 3.32Å
182	Y	78.8	Confident	71.2	Confident	186 Å²	186	126.7 Å²	126.7	73%	0.729	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.9	8.4	-180	-55.9	-72.7	0	0	0	113.6	D178 M180 T184	D178-Y182 WeakPolarHBondContact O-CD2 3.47Å; M180-Y182 VanDerWaalsContact C-N 3.27Å; M180-Y182 PolarHBondContact O-N 3.05Å; Y182-T184 PolarHBondContact O-N 3.19Å
183	R	71.3	Confident	72.2	Confident	112 Å²	112	127.8 Å²	127.8	42%	0.423	61%	0.61	S	S	.	*	S	Bend	trans	-69.7	-34	-171.4	-178.3	-175.1	144.4	-162.3	-17.3	113.6	S166 I168 M180	S166-R183 VanDerWaalsContact CB-CZ 3.47Å; S166-R183 PolarHBondContact OG-NH1 3.31Å; S166-R183 PolarHBondContact OG-NH2 3.09Å; I168-R183 HydrophobicContact CD1-CG 4.21Å; I168-R183 HydrophobicContact CG1-CG 4.28Å; M180-R183 VanDerWaalsContact O-CB 3.23Å; M180-R183 WeakPolarHBondContact O-CB 3.12Å; M180-R183 PolarHBondContact O-N 2.67Å
184	T	66.3	Low	72.9	Confident	92 Å²	92	125.6 Å²	125.6	56%	0.564	61%	0.612	S	S	*	*			trans	-140	130.7	-178.8	52.2	0	0	0	0	109.7	Y182	Y182-T184 PolarHBondContact O-N 3.19Å
185	I	73.1	Confident	74	Confident	183 Å²	183	132.1 Å²	132.1	94%	0.938	64%	0.636	S	S	*	*			trans	-74.9	125.3	160.7	-59.3	173.8	0	0	0	105.9
186	R	58.8	Low	74.4	Confident	298 Å²	298	135.5 Å²	135.5	100%	1.125	64%	0.64	S	S	*	*			trans	-119.1	0	-175.2	-156.4	179.7	-169.4	161.6	2	110.8

Retrieved 186 of 186 residues in 298.8 ms (Link to these results)

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