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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 , UniProt , Accession I3MAA7, Species ICTTR (Ictidomys tridecemlineatus, Thirteen-lined ground squirrel), Gene ANAPC10, Length 185 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	44.3	Very low	78.7	Confident	244 Å²	244	97.8 Å²	97.8	100%	1.202	58%	0.581	S	S	*	*				0	123.4	0	-63.3	-177.6	-157.9	0	0	107.5
2	T	55.5	Low	79.9	Confident	132 Å²	132	95 Å²	95	81%	0.81	56%	0.561	S	S	*	*			trans	-83.5	116.6	178.5	43.5	0	0	0	0	109.4	P4	T2-P4 WeakPolarHBondContact O-CD 3.17Å
3	T	61.8	Low	81	Confident	52 Å²	52	87.7 Å²	87.7	32%	0.319	52%	0.518	S	S	.	.			trans	-59.8	118.4	175	-15.8	0	0	0	0	108.5	N5 K6 E115	T3-N5 VanDerWaalsContact C-N 3.26Å; T3-N5 PolarHBondContact O-N 3.19Å; T3-N5 VanDerWaalsContact O-N 3.17Å; T3-K6 WeakPolarHBondContact OG1-CE 3.26Å; T3-E115 WeakPolarHBondContact CG2-OE1 3.45Å; T3-E115 PolarHBondContact OG1-OE1 3.29Å; T3-E115 PolarHBondContact OG1-OE2 2.99Å; T3-E115 VanDerWaalsContact OG1-OE2 3.08Å
4	P	67.6	Low	81.7	Confident	118 Å²	118	88.2 Å²	88.2	77%	0.766	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-16.6	-162.5	20.8	-30.5	0	0	0	115	T2	T2-P4 WeakPolarHBondContact O-CD 3.17Å
5	N	83.9	Confident	82.4	Confident	131 Å²	131	89.7 Å²	89.7	70%	0.701	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131	46.2	-173	-69.2	-21.8	0	0	0	113	T3 V114	T3-N5 VanDerWaalsContact C-N 3.26Å; T3-N5 PolarHBondContact O-N 3.19Å; T3-N5 VanDerWaalsContact O-N 3.17Å; N5-V114 WeakPolarHBondContact O-CB 3.47Å
6	K	90.1	Very high	82.8	Confident	94 Å²	94	87.2 Å²	87.2	41%	0.409	50%	0.495	S	S	.	.	P	Polyproline II helix	trans	-63.7	144.3	176.8	-57.8	-166.4	-169.6	-148.1	0	111.2	T3 P8 V114 E115	T3-K6 WeakPolarHBondContact OG1-CE 3.26Å; K6-P8 WeakPolarHBondContact O-CD 3.1Å; K6-V114 CarbonylContact C-O 3.52Å; K6-V114 VanDerWaalsContact CA-O 3.3Å; K6-V114 WeakPolarHBondContact CA-O 3.3Å; K6-E115 HydrophobicContact CD-CB 4.18Å; K6-E115 WeakPolarHBondContact CE-OE2 3.45Å; K6-E115 HydrophobicContact CG-CB 4.3Å; K6-E115 IonicContact NZ-OE2 2.63Å; K6-E115 PolarHBondContact NZ-OE2 3.15Å
7	T	90.2	Very high	83.3	Confident	29 Å²	29	85.6 Å²	85.6	18%	0.178	48%	0.483	C	S	.	.	P	Polyproline II helix	trans	-63.5	120.4	170.5	-55.6	0	0	0	0	108.8	L113 V114	T7-L113 HydrophobicContact CG2-CD2 4.1Å; T7-L113 WeakPolarHBondContact OG1-CA 3.5Å; T7-V114 PolarHBondContact N-O 2.66Å; T7-V114 PolarHBondContact OG1-N 3.17Å
8	P	91.9	Very high	83.7	Confident	105 Å²	105	92.4 Å²	92.4	68%	0.682	50%	0.5	S	S	*	.	P	Polyproline II helix	trans	-66.2	140.3	-177.6	26.7	-33.8	0	0	0	110.3	K6 G10	K6-P8 WeakPolarHBondContact O-CD 3.1Å; P8-G10 PolarHBondContact O-N 3.34Å
9	P	94.1	Very high	84.1	Confident	82 Å²	82	91.8 Å²	91.8	53%	0.532	50%	0.499	S	S	.	.	P	Polyproline II helix	trans	-65.9	127.1	173.9	28.3	-33.4	0	0	0	109.3
10	G	92.8	Very high	84.2	Confident	30 Å²	30	89.6 Å²	89.6	31%	0.309	50%	0.499	S	S	.	.	B	Isolated β-bridge	trans	-72.4	163.1	171.9	0	0	0	0	0	112	P8 W119	P8-G10 PolarHBondContact O-N 3.34Å; G10-W119 WeakPolarHBondContact CA-O 3.42Å; G10-W119 PolarHBondContact N-O 3.13Å
11	A	93.5	Very high	84.5	Confident	59 Å²	59	88.2 Å²	88.2	49%	0.488	49%	0.493	S	S	.	.	P	Polyproline II helix	trans	-61.3	155	175.4	0	0	0	0	0	111.7	P13 H121	A11-P13 WeakPolarHBondContact O-CD 3.18Å; A11-H121 PolarHBondContact O-NE2 3.19Å
12	D	93.5	Very high	86.8	Confident	64 Å²	64	77 Å²	77	34%	0.342	44%	0.438	S	S	.	.	P	Polyproline II helix	trans	-59.1	124.3	173.8	179.9	-8.4	0	0	0	109.9	K14 Q15	D12-K14 PolarHBondContact O-N 2.99Å; D12-K14 VanDerWaalsContact O-N 3.07Å; D12-K14 WeakPolarHBondContact OD1-CB 3.49Å; D12-K14 PolarHBondContact OD1-N 2.96Å; D12-Q15 HydrophobicContact CB-CG 4.25Å; D12-Q15 VanDerWaalsContact O-CB 3.31Å; D12-Q15 WeakPolarHBondContact O-CB 3.21Å; D12-Q15 PolarHBondContact O-N 3.1Å
13	P	93.1	Very high	88.7	Confident	0 Å²	0	78 Å²	78	0%	0	43%	0.427	C	S	.	.	H	α-helix	trans	-54	-26.9	177.1	-25.2	32.9	0	0	0	113.9	A11 Q15 L16 E17 C78 W119 K157 Y159	A11-P13 WeakPolarHBondContact O-CD 3.18Å; P13-Q15 PolarHBondContact O-N 3.21Å; P13-L16 WeakPolarHBondContact O-CB 3.24Å; P13-L16 PolarHBondContact O-N 3.26Å; P13-L16 VanDerWaalsContact O-N 3.08Å; P13-E17 PolarHBondContact O-N 2.98Å; P13-C78 HydrophobicContact CB-CB 4.43Å; P13-C78 HydrophobicContact CG-CB 3.88Å; P13-W119 VanDerWaalsContact CD-CD1 3.46Å; P13-W119 VanDerWaalsContact CD-CG 3.4Å; P13-W119 HydrophobicContact CG-CB 4.46Å; P13-W119 HydrophobicContact CG-CD2 3.38Å; P13-W119 HydrophobicContact CG-CE3 3.48Å; P13-W119 VanDerWaalsContact CG-CE3 3.48Å; P13-W119 HydrophobicContact CG-CG 3.87Å; P13-W119 HydrophobicContact CG-CH2 4.05Å; P13-W119 HydrophobicContact CG-CZ2 4Å; P13-W119 HydrophobicContact CG-CZ3 3.81Å; P13-K157 HydrophobicContact CB-CD 4.21Å; P13-Y159 HydrophobicContact CB-CE2 4Å; P13-Y159 WeakPolarHBondContact CB-OH 3.38Å
14	K	91.7	Very high	90.3	Very high	95 Å²	95	77.4 Å²	77.4	41%	0.413	42%	0.421	S	S	.	.	H	α-helix	trans	-62.8	-30.5	173.7	-67.1	-179.3	179.2	175.8	0	112.5	D12 L16 E17 R18	D12-K14 PolarHBondContact O-N 2.99Å; D12-K14 VanDerWaalsContact O-N 3.07Å; D12-K14 WeakPolarHBondContact OD1-CB 3.49Å; D12-K14 PolarHBondContact OD1-N 2.96Å; K14-L16 VanDerWaalsContact C-N 3.34Å; K14-E17 PolarHBondContact O-N 3.42Å; K14-R18 VanDerWaalsContact O-CG 3.25Å; K14-R18 WeakPolarHBondContact O-CG 3.4Å; K14-R18 PolarHBondContact O-N 2.81Å
15	Q	91.4	Very high	91.7	Very high	111 Å²	111	71.9 Å²	71.9	52%	0.519	38%	0.384	S	S	.	.	H	α-helix	trans	-67	-39.6	173.4	-64.3	-179.4	-7.6	0	0	110.9	D12 P13 R18 T19	D12-Q15 HydrophobicContact CB-CG 4.25Å; D12-Q15 VanDerWaalsContact O-CB 3.31Å; D12-Q15 WeakPolarHBondContact O-CB 3.21Å; D12-Q15 PolarHBondContact O-N 3.1Å; P13-Q15 PolarHBondContact O-N 3.21Å; Q15-R18 PolarHBondContact O-N 3.25Å; Q15-T19 WeakPolarHBondContact O-CG2 3.28Å; Q15-T19 PolarHBondContact O-N 2.81Å
16	L	89.6	Confident	92.2	Very high	49 Å²	49	65.7 Å²	65.7	26%	0.257	35%	0.352	S	S	.	.	H	α-helix	trans	-64.6	-42.1	175.4	-175.1	65.8	0	0	0	111.1	P13 K14 R18 T19 V22	P13-L16 WeakPolarHBondContact O-CB 3.24Å; P13-L16 PolarHBondContact O-N 3.26Å; P13-L16 VanDerWaalsContact O-N 3.08Å; K14-L16 VanDerWaalsContact C-N 3.34Å; L16-R18 PolarHBondContact O-N 3.3Å; L16-T19 WeakPolarHBondContact O-CB 3.33Å; L16-T19 PolarHBondContact O-N 3.41Å; L16-T19 PolarHBondContact O-OG1 3.2Å; L16-V22 HydrophobicContact CD1-CG2 4.45Å; L16-V22 HydrophobicContact CD2-CG2 3.9Å; L16-V22 HydrophobicContact CG-CG2 3.62Å
17	E	90.4	Very high	92.4	Very high	61 Å²	61	66.2 Å²	66.2	29%	0.285	37%	0.367	S	S	.	.	H	α-helix	trans	-59.6	-42.8	173.7	-71.4	171.2	-166.7	0	0	112.5	P13 K14 T19 G20 K157 Y159	P13-E17 PolarHBondContact O-N 2.98Å; K14-E17 PolarHBondContact O-N 3.42Å; E17-T19 PolarHBondContact O-N 2.75Å; E17-G20 PolarHBondContact O-N 3.13Å; E17-K157 IonicContact OE1-NZ 2.74Å; E17-Y159 HydrophobicContact CG-CD1 4.42Å; E17-Y159 HydrophobicContact CG-CE1 3.44Å; E17-Y159 VanDerWaalsContact CG-CE1 3.44Å; E17-Y159 VanDerWaalsContact OE1-CE1 3.25Å; E17-Y159 WeakPolarHBondContact OE1-CE1 3.44Å; E17-Y159 VanDerWaalsContact OE1-CZ 3.3Å; E17-Y159 PolarHBondContact OE1-OH 3.33Å
18	R	91.5	Very high	92.7	Very high	207 Å²	207	68.5 Å²	68.5	78%	0.781	38%	0.376	S	S	*	.	H	α-helix	trans	-61.9	-22.7	179	-75.2	170.7	-174.1	-179.5	2.4	113.7	K14 Q15 L16 G20	K14-R18 VanDerWaalsContact O-CG 3.25Å; K14-R18 WeakPolarHBondContact O-CG 3.4Å; K14-R18 PolarHBondContact O-N 2.81Å; Q15-R18 PolarHBondContact O-N 3.25Å; L16-R18 PolarHBondContact O-N 3.3Å; R18-G20 PolarHBondContact O-N 2.82Å
19	T	90.1	Very high	92.9	Very high	81 Å²	81	64.2 Å²	64.2	50%	0.497	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-18.2	173.2	71.8	0	0	0	0	113	Q15 L16 E17 T21	Q15-T19 WeakPolarHBondContact O-CG2 3.28Å; Q15-T19 PolarHBondContact O-N 2.81Å; L16-T19 WeakPolarHBondContact O-CB 3.33Å; L16-T19 PolarHBondContact O-N 3.41Å; L16-T19 PolarHBondContact O-OG1 3.2Å; E17-T19 PolarHBondContact O-N 2.75Å; T19-T21 PolarHBondContact O-N 2.97Å; T19-T21 PolarHBondContact OG1-N 3.24Å; T19-T21 PolarHBondContact OG1-OG1 2.89Å
20	G	87.8	Confident	93.1	Very high	47 Å²	47	65 Å²	65	49%	0.485	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.4	3.1	-175.5	0	0	0	0	0	114.8	E17 R18	E17-G20 PolarHBondContact O-N 3.13Å; R18-G20 PolarHBondContact O-N 2.82Å
21	T	88.7	Confident	93.4	Very high	61 Å²	61	65.1 Å²	65.1	37%	0.374	34%	0.343	S	S	.	.	S	Bend	trans	-82.1	-16.1	-177.8	64.1	0	0	0	0	113.6	T19 V162	T19-T21 PolarHBondContact O-N 2.97Å; T19-T21 PolarHBondContact OG1-N 3.24Å; T19-T21 PolarHBondContact OG1-OG1 2.89Å; T21-V162 PolarHBondContact O-N 2.95Å
22	V	93.4	Very high	93.6	Very high	8 Å²	8	64.3 Å²	64.3	5%	0.048	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	160.3	179.7	-58.6	0	0	0	0	111	L16 K75 Y159 T160 V162	L16-V22 HydrophobicContact CD1-CG2 4.45Å; L16-V22 HydrophobicContact CD2-CG2 3.9Å; L16-V22 HydrophobicContact CG-CG2 3.62Å; V22-K75 HydrophobicContact CG1-CD 4.11Å; V22-Y159 HydrophobicContact CB-CD1 4.25Å; V22-Y159 HydrophobicContact CB-CG 4.47Å; V22-Y159 HydrophobicContact CG2-CD1 3.72Å; V22-Y159 HydrophobicContact CG2-CE1 4.39Å; V22-Y159 HydrophobicContact CG2-CG 4.13Å; V22-T160 VanDerWaalsContact CA-O 3.29Å; V22-T160 WeakPolarHBondContact CA-O 3.42Å; V22-T160 WeakPolarHBondContact CB-O 3.46Å; V22-V162 VanDerWaalsContact C-CG2 3.44Å
23	R	94.9	Very high	93.8	Very high	153 Å²	153	62.7 Å²	62.7	58%	0.577	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.7	136.6	177	-179.2	-173	-64.6	-177.1	0.2	110	Y159 T160 V162	R23-Y159 WeakPolarHBondContact O-CA 3.5Å; R23-T160 HydrophobicContact CB-CG2 3.94Å; R23-T160 PolarHBondContact N-O 2.81Å; R23-T160 WeakPolarHBondContact O-CG2 3.3Å; R23-T160 PolarHBondContact O-N 2.89Å; R23-V162 HydrophobicContact CB-CG2 3.73Å
24	E	96.1	Very high	94	Very high	41 Å²	41	65.4 Å²	65.4	19%	0.192	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	133.1	173.3	-151.3	-73.3	154.2	0	0	109.9	G26 R46 K157 I158 Y159	E24-G26 WeakPolarHBondContact OE1-CA 3.46Å; E24-G26 PolarHBondContact OE1-N 3.07Å; E24-G26 VanDerWaalsContact OE1-N 3.11Å; E24-G26 PolarHBondContact OE2-N 2.8Å; E24-R46 IonicContact OE1-CZ 3.94Å; E24-R46 VanDerWaalsContact OE1-CZ 3.29Å; E24-R46 IonicContact OE1-NH1 2.89Å; E24-R46 PolarHBondContact OE1-NH1 3.08Å; E24-R46 IonicContact OE1-NH2 3.38Å; E24-R46 PolarHBondContact OE1-NH2 2.81Å; E24-R46 IonicContact OE2-NH2 3.29Å; E24-R46 PolarHBondContact OE2-NH2 2.96Å; E24-K157 HydrophobicContact CG-CB 4.37Å; E24-I158 CarbonylContact C-O 3.57Å; E24-I158 WeakPolarHBondContact CA-O 3.37Å; E24-I158 PolarHBondContact OE1-N 3.42Å; E24-Y159 HydrophobicContact CB-CD1 4.21Å; E24-Y159 HydrophobicContact CB-CE1 3.8Å; E24-Y159 HydrophobicContact CG-CE1 3.98Å
25	I	96.7	Very high	94.3	Very high	1 Å²	1	62 Å²	62	1%	0.005	33%	0.332	C	S	.	.			trans	-128.7	15.2	-175	51.9	165.6	0	0	0	113.2	S27 Q28 F68 T72 V74 I158 T160	I25-S27 PolarHBondContact O-N 3.1Å; I25-Q28 PolarHBondContact O-N 3.3Å; I25-Q28 VanDerWaalsContact O-N 3.08Å; I25-F68 HydrophobicContact CD1-CE1 3.83Å; I25-F68 HydrophobicContact CD1-CZ 3.87Å; I25-F68 HydrophobicContact CG1-CE1 4.24Å; I25-F68 HydrophobicContact CG1-CZ 4.45Å; I25-T72 HydrophobicContact CD1-CG2 3.5Å; I25-V74 HydrophobicContact CD1-CG1 3.83Å; I25-I158 HydrophobicContact CD1-CG1 4.29Å; I25-I158 HydrophobicContact CG1-CG1 4.17Å; I25-I158 HydrophobicContact CG1-CG2 4.1Å; I25-I158 WeakPolarHBondContact CG1-O 3.36Å; I25-I158 PolarHBondContact N-O 2.94Å; I25-T160 HydrophobicContact CG2-CG2 3.41Å; I25-T160 VanDerWaalsContact CG2-CG2 3.41Å
26	G	95.1	Very high	94.5	Very high	2 Å²	2	59.9 Å²	59.9	2%	0.021	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-65.4	-29.3	179.5	0	0	0	0	0	112.3	E24 Q28 A29 W31	E24-G26 WeakPolarHBondContact OE1-CA 3.46Å; E24-G26 PolarHBondContact OE1-N 3.07Å; E24-G26 VanDerWaalsContact OE1-N 3.11Å; E24-G26 PolarHBondContact OE2-N 2.8Å; G26-Q28 PolarHBondContact O-N 3.15Å; G26-A29 PolarHBondContact O-N 3.3Å; G26-W31 PolarHBondContact O-NE1 2.91Å
27	S	94.9	Very high	94.8	Very high	104 Å²	104	60.5 Å²	60.5	73%	0.727	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-67.8	-16.7	173.3	60	0	0	0	0	114.6	I25	I25-S27 PolarHBondContact O-N 3.1Å
28	Q	95.3	Very high	95	Very high	78 Å²	78	63.5 Å²	63.5	36%	0.364	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-91.3	-2	177.7	-61.1	178.9	37.5	0	0	112.9	I25 G26	I25-Q28 PolarHBondContact O-N 3.3Å; I25-Q28 VanDerWaalsContact O-N 3.08Å; G26-Q28 PolarHBondContact O-N 3.15Å
29	A	97.2	Very high	95.2	Very high	14 Å²	14	56.3 Å²	56.3	12%	0.116	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	151.6	-178.1	0	0	0	0	0	111.7	G26 I66 Q67 F68	G26-A29 PolarHBondContact O-N 3.3Å; A29-I66 HydrophobicContact CB-CG2 3.43Å; A29-I66 VanDerWaalsContact CB-CG2 3.43Å; A29-Q67 CarbonylContact C-O 3.57Å; A29-Q67 WeakPolarHBondContact CA-O 3.33Å; A29-Q67 WeakPolarHBondContact CB-O 3.36Å; A29-F68 HydrophobicContact CB-CD1 3.81Å; A29-F68 HydrophobicContact CB-CE1 3.7Å; A29-F68 HydrophobicContact CB-CG 4.48Å; A29-F68 HydrophobicContact CB-CZ 4.27Å
30	V	97.9	Very high	95.5	Very high	99 Å²	99	55.7 Å²	55.7	60%	0.6	34%	0.336	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.9	129.1	163.7	179.8	0	0	0	0	107.8	Q67	V30-Q67 PolarHBondContact N-O 3.36Å; V30-Q67 PolarHBondContact O-N 3.41Å
31	W	98.2	Very high	95.9	Very high	32 Å²	32	54 Å²	54	12%	0.121	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	136.1	-179	-65.9	72.8	0	0	0	109.7	G26 V42 R46 V64 N65 I66 I156 I158	G26-W31 PolarHBondContact O-NE1 2.91Å; W31-V42 HydrophobicContact CB-CG1 3.61Å; W31-V42 HydrophobicContact CB-CG2 4.42Å; W31-V42 HydrophobicContact CG-CG1 4.39Å; W31-R46 HydrophobicContact CD2-CG 4.46Å; W31-V64 HydrophobicContact CE3-CG1 3.76Å; W31-V64 HydrophobicContact CZ3-CG1 3.92Å; W31-N65 WeakPolarHBondContact CA-O 3.33Å; W31-I66 HydrophobicContact CD2-CG1 4.08Å; W31-I66 HydrophobicContact CE3-CD1 4.12Å; W31-I66 HydrophobicContact CE3-CG1 3.69Å; W31-I66 HydrophobicContact CH2-CD1 3.41Å; W31-I66 VanDerWaalsContact CH2-CD1 3.41Å; W31-I66 HydrophobicContact CH2-CG1 3.86Å; W31-I66 HydrophobicContact CZ2-CD1 4.06Å; W31-I66 HydrophobicContact CZ2-CG1 4.23Å; W31-I66 HydrophobicContact CZ2-CG2 4.15Å; W31-I66 HydrophobicContact CZ3-CD1 3.45Å; W31-I66 VanDerWaalsContact CZ3-CD1 3.45Å; W31-I66 HydrophobicContact CZ3-CG1 3.58Å; W31-I156 HydrophobicContact CH2-CB 4.12Å; W31-I156 HydrophobicContact CH2-CG2 3.7Å; W31-I156 HydrophobicContact CZ3-CB 4.03Å; W31-I156 HydrophobicContact CZ3-CD1 4.29Å; W31-I156 HydrophobicContact CZ3-CG2 3.85Å; W31-I158 HydrophobicContact CH2-CG2 4.39Å; W31-I158 HydrophobicContact CZ2-CG2 3.99Å
32	S	97.9	Very high	96.3	Very high	42 Å²	42	53.1 Å²	53.1	29%	0.294	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	149.4	171.7	51.4	0	0	0	0	110.6	N65	S32-N65 PolarHBondContact N-O 2.83Å; S32-N65 PolarHBondContact O-N 2.99Å; S32-N65 WeakPolarHBondContact OG-CB 3.41Å
33	L	98.3	Very high	96.4	Very high	30 Å²	30	58.7 Å²	58.7	16%	0.157	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	151.1	-177.8	-57.2	168.5	0	0	0	109	S35 C36 V42 L45 W54 L63 V64	L33-S35 VanDerWaalsContact C-N 3.27Å; L33-S35 PolarHBondContact O-N 2.9Å; L33-C36 HydrophobicContact CD1-CB 4.41Å; L33-V42 HydrophobicContact CD1-CB 4.33Å; L33-V42 HydrophobicContact CD1-CG2 3.51Å; L33-V42 HydrophobicContact CD2-CG2 4.42Å; L33-V42 HydrophobicContact CG-CG2 3.58Å; L33-L45 HydrophobicContact CD2-CD2 3.9Å; L33-W54 HydrophobicContact CB-CZ2 4.13Å; L33-W54 HydrophobicContact CD1-CD2 4.07Å; L33-W54 HydrophobicContact CD1-CG 3.82Å; L33-W54 HydrophobicContact CD2-CD2 3.89Å; L33-W54 HydrophobicContact CD2-CE3 4.04Å; L33-W54 HydrophobicContact CD2-CG 4.41Å; L33-W54 HydrophobicContact CD2-CH2 4.22Å; L33-W54 HydrophobicContact CD2-CZ2 4.06Å; L33-W54 HydrophobicContact CD2-CZ3 4.23Å; L33-W54 HydrophobicContact CG-CD2 4.49Å; L33-W54 HydrophobicContact CG-CZ2 4.5Å; L33-L63 CarbonylContact C-O 3.49Å; L33-L63 VanDerWaalsContact CA-O 3.29Å; L33-L63 WeakPolarHBondContact CA-O 3.49Å; L33-V64 HydrophobicContact CD2-CB 4.13Å; L33-V64 HydrophobicContact CD2-CG1 3.93Å; L33-V64 HydrophobicContact CD2-CG2 3.72Å
34	S	97.6	Very high	96.5	Very high	57 Å²	57	53.6 Å²	53.6	40%	0.399	33%	0.325	S	S	.	.	S	Bend	trans	-62.3	-37.4	173.4	51.9	0	0	0	0	112.3	H62 L63	S34-H62 WeakPolarHBondContact OG-CA 3.29Å; S34-L63 PolarHBondContact N-O 3.12Å; S34-L63 PolarHBondContact OG-N 3.39Å
35	S	97.6	Very high	96.4	Very high	23 Å²	23	51.6 Å²	51.6	16%	0.161	32%	0.315	C	S	.	.			trans	-159.4	159.9	179.4	56.1	0	0	0	0	109.6	L33 W54 D57	L33-S35 VanDerWaalsContact C-N 3.27Å; L33-S35 PolarHBondContact O-N 2.9Å; S35-W54 PolarHBondContact O-NE1 3.41Å; S35-D57 WeakPolarHBondContact CB-O 3.36Å; S35-D57 PolarHBondContact OG-N 3.1Å; S35-D57 PolarHBondContact OG-O 3.36Å
36	C	96.1	Very high	96.4	Very high	67 Å²	67	54.3 Å²	54.3	45%	0.453	33%	0.326	S	S	.	.			trans	-153.6	148.6	171	55	0	0	0	0	110.4	L33 Q55	L33-C36 HydrophobicContact CD1-CB 4.41Å; C36-Q55 WeakPolarHBondContact CA-O 3.42Å
37	K	95.6	Very high	96.4	Very high	62 Å²	62	57.4 Å²	57.4	27%	0.27	34%	0.342	S	S	.	.	B	Isolated β-bridge	trans	-74.4	148.6	162.8	-70.3	-164.8	178.1	169.1	0	110.5	G39 F40 Q55 D57	K37-G39 PolarHBondContact O-N 2.99Å; K37-F40 HydrophobicContact CB-CB 4.38Å; K37-F40 HydrophobicContact CB-CD2 4.1Å; K37-F40 PolarHBondContact O-N 2.7Å; K37-Q55 HydrophobicContact CD-CG 4.08Å; K37-Q55 HydrophobicContact CG-CG 4.27Å; K37-Q55 PolarHBondContact N-O 3.01Å; K37-D57 HydrophobicContact CG-CB 3.86Å
38	P	95	Very high	96.5	Very high	124 Å²	124	57.1 Å²	57.1	81%	0.805	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	125.5	173.5	-25.4	34.6	0	0	0	111.2	F40	P38-F40 WeakPolarHBondContact O-CD2 3.37Å
39	G	94.9	Very high	96.5	Very high	56 Å²	56	56.3 Å²	56.3	58%	0.577	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.8	-1.6	-178.4	0	0	0	0	0	116	K37 Q44	K37-G39 PolarHBondContact O-N 2.99Å; G39-Q44 PolarHBondContact O-NE2 3.46Å; G39-Q44 PolarHBondContact O-OE1 2.72Å
40	F	96.3	Very high	96.4	Very high	69 Å²	69	58.6 Å²	58.6	30%	0.303	34%	0.34	S	S	.	.	B	Isolated β-bridge	trans	-128.8	60.6	179.2	-60.5	-88.2	0	0	0	109.8	K37 P38 Y53 W54 Q55	K37-F40 HydrophobicContact CB-CB 4.38Å; K37-F40 HydrophobicContact CB-CD2 4.1Å; K37-F40 PolarHBondContact O-N 2.7Å; P38-F40 WeakPolarHBondContact O-CD2 3.37Å; F40-Y53 AromaticContact CD1-CD2 3.8Å; F40-Y53 HydrophobicContact CD1-CD2 3.8Å; F40-Y53 AromaticContact CD1-CE2 3.49Å; F40-Y53 HydrophobicContact CD1-CE2 3.49Å; F40-Y53 VanDerWaalsContact CD1-CE2 3.49Å; F40-Y53 WeakPolarHBondContact CD1-O 3.48Å; F40-Y53 HydrophobicContact CE1-CD2 4.28Å; F40-Y53 HydrophobicContact CE1-CE1 4.41Å; F40-Y53 AromaticContact CE1-CE2 3.57Å; F40-Y53 HydrophobicContact CE1-CE2 3.57Å; F40-Y53 AromaticContact CE1-CZ 3.64Å; F40-Y53 HydrophobicContact CG-CE2 4.48Å; F40-W54 VanDerWaalsContact O-CD1 3.25Å; F40-Q55 HydrophobicContact CB-CB 3.84Å; F40-Q55 HydrophobicContact CG-CB 4.26Å; F40-Q55 PolarHBondContact O-N 3.22Å
41	G	96.1	Very high	96.3	Very high	11 Å²	11	61.3 Å²	61.3	11%	0.113	35%	0.346	C	S	.	.	S	Bend	trans	-112.2	-150.2	-171.6	0	0	0	0	0	114.1	D43 L45	G41-D43 VanDerWaalsContact C-N 3.26Å; G41-D43 PolarHBondContact O-N 2.82Å; G41-L45 PolarHBondContact O-N 3.46Å
42	V	96.5	Very high	96.2	Very high	42 Å²	42	61.7 Å²	61.7	26%	0.255	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-35.9	179.3	173.1	0	0	0	0	111.6	W31 L33 Q44 L45 R46	W31-V42 HydrophobicContact CB-CG1 3.61Å; W31-V42 HydrophobicContact CB-CG2 4.42Å; W31-V42 HydrophobicContact CG-CG1 4.39Å; L33-V42 HydrophobicContact CD1-CB 4.33Å; L33-V42 HydrophobicContact CD1-CG2 3.51Å; L33-V42 HydrophobicContact CD2-CG2 4.42Å; L33-V42 HydrophobicContact CG-CG2 3.58Å; V42-Q44 PolarHBondContact O-N 3.23Å; V42-L45 WeakPolarHBondContact O-CB 3.41Å; V42-L45 PolarHBondContact O-N 3.36Å; V42-L45 VanDerWaalsContact O-N 3.12Å; V42-R46 PolarHBondContact O-N 3.2Å
43	D	96.1	Very high	96.3	Very high	126 Å²	126	62.2 Å²	62.2	67%	0.674	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-47	-175.6	-59.6	-31	0	0	0	110.8	G41 L45 R46 D47	G41-D43 VanDerWaalsContact C-N 3.26Å; G41-D43 PolarHBondContact O-N 2.82Å; D43-L45 PolarHBondContact O-N 3.08Å; D43-R46 CarbonylContact O-C 3.58Å; D43-R46 PolarHBondContact O-N 2.85Å; D43-R46 VanDerWaalsContact O-N 3.14Å; D43-D47 WeakPolarHBondContact O-CB 3.37Å; D43-D47 PolarHBondContact O-N 2.8Å; D43-D47 VanDerWaalsContact O-N 3.09Å
44	Q	96.8	Very high	96.3	Very high	45 Å²	45	60.8 Å²	60.8	21%	0.21	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-26.3	177.2	-71.2	70.5	36.7	0	0	112.8	G39 V42 R46 T52 Y53	G39-Q44 PolarHBondContact O-NE2 3.46Å; G39-Q44 PolarHBondContact O-OE1 2.72Å; V42-Q44 PolarHBondContact O-N 3.23Å; Q44-R46 PolarHBondContact O-N 2.86Å; Q44-T52 HydrophobicContact CG-CG2 4.37Å; Q44-Y53 WeakPolarHBondContact CB-O 3.32Å
45	L	95.1	Very high	96.3	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-12	177.9	-168.6	60.3	0	0	0	113.2	L33 G41 V42 D43 W54 V64 M153 Q155 I156	L33-L45 HydrophobicContact CD2-CD2 3.9Å; G41-L45 PolarHBondContact O-N 3.46Å; V42-L45 WeakPolarHBondContact O-CB 3.41Å; V42-L45 PolarHBondContact O-N 3.36Å; V42-L45 VanDerWaalsContact O-N 3.12Å; D43-L45 PolarHBondContact O-N 3.08Å; L45-W54 HydrophobicContact CB-CB 4.27Å; L45-W54 HydrophobicContact CD1-CB 4.14Å; L45-W54 HydrophobicContact CD2-CE3 4.45Å; L45-V64 HydrophobicContact CD2-CG1 4.08Å; L45-V64 HydrophobicContact CD2-CG2 4.27Å; L45-M153 HydrophobicContact CD1-CB 3.59Å; L45-M153 VanDerWaalsContact CD1-O 3.32Å; L45-M153 WeakPolarHBondContact CD1-O 3.46Å; L45-Q155 PolarHBondContact O-OE1 3.29Å; L45-I156 HydrophobicContact CD1-CD1 3.86Å; L45-I156 HydrophobicContact CD1-CG1 3.71Å; L45-I156 HydrophobicContact CD2-CD1 3.72Å; L45-I156 HydrophobicContact CD2-CG1 4.31Å; L45-I156 HydrophobicContact CG-CB 4.42Å; L45-I156 HydrophobicContact CG-CD1 3.96Å; L45-I156 HydrophobicContact CG-CG1 3.99Å; L45-I156 PolarHBondContact O-N 2.84Å
46	R	96.1	Very high	96.3	Very high	58 Å²	58	57.7 Å²	57.7	22%	0.219	32%	0.317	C	S	.	.	S	Bend	trans	-136	5.1	-164	-70.3	-62.8	-54.7	172.1	1.8	113.9	E24 W31 V42 D43 Q44 D48 I156	E24-R46 IonicContact OE1-CZ 3.94Å; E24-R46 VanDerWaalsContact OE1-CZ 3.29Å; E24-R46 IonicContact OE1-NH1 2.89Å; E24-R46 PolarHBondContact OE1-NH1 3.08Å; E24-R46 IonicContact OE1-NH2 3.38Å; E24-R46 PolarHBondContact OE1-NH2 2.81Å; E24-R46 IonicContact OE2-NH2 3.29Å; E24-R46 PolarHBondContact OE2-NH2 2.96Å; W31-R46 HydrophobicContact CD2-CG 4.46Å; V42-R46 PolarHBondContact O-N 3.2Å; D43-R46 CarbonylContact O-C 3.58Å; D43-R46 PolarHBondContact O-N 2.85Å; D43-R46 VanDerWaalsContact O-N 3.14Å; Q44-R46 PolarHBondContact O-N 2.86Å; R46-D48 VanDerWaalsContact C-N 3.3Å; R46-D48 PolarHBondContact O-N 3.29Å; R46-I156 PolarHBondContact NH1-O 3.34Å
47	D	95.7	Very high	96.3	Very high	67 Å²	67	58.4 Å²	58.4	36%	0.358	32%	0.316	S	S	.	.	S	Bend	trans	-84.4	5.4	-175.1	63.2	3.5	0	0	0	114.7	D43 N49 T52 Q155	D43-D47 WeakPolarHBondContact O-CB 3.37Å; D43-D47 PolarHBondContact O-N 2.8Å; D43-D47 VanDerWaalsContact O-N 3.09Å; D47-N49 PolarHBondContact O-N 3.11Å; D47-N49 VanDerWaalsContact O-N 3.12Å; D47-N49 WeakPolarHBondContact OD1-CB 3.34Å; D47-N49 PolarHBondContact OD1-N 2.89Å; D47-T52 VanDerWaalsContact CG-OG1 3.24Å; D47-T52 PolarHBondContact OD1-OG1 2.93Å; D47-T52 VanDerWaalsContact OD2-CB 3.3Å; D47-T52 WeakPolarHBondContact OD2-CB 3.29Å; D47-T52 WeakPolarHBondContact OD2-CG2 3.16Å; D47-T52 PolarHBondContact OD2-OG1 3.38Å; D47-Q155 PolarHBondContact OD1-NE2 2.82Å
48	D	95.2	Very high	96.3	Very high	97 Å²	97	56.4 Å²	56.4	52%	0.519	31%	0.314	S	S	.	.	S	Bend	trans	56.3	16.9	-173	-77.8	-51.2	0	0	0	115.3	R46 Q155 K157	R46-D48 VanDerWaalsContact C-N 3.3Å; R46-D48 PolarHBondContact O-N 3.29Å; D48-Q155 VanDerWaalsContact CA-NE2 3.26Å; D48-K157 WeakPolarHBondContact OD1-CE 3.44Å; D48-K157 IonicContact OD1-NZ 3.62Å; D48-K157 PolarHBondContact OD1-NZ 2.81Å; D48-K157 IonicContact OD2-NZ 2.91Å
49	N	95.7	Very high	96.3	Very high	61 Å²	61	55.5 Å²	55.5	33%	0.326	31%	0.31	S	S	.	.			trans	-100.3	144.7	171.1	-170.5	-1.9	0	0	0	110	D47 E51 T52 Q155	D47-N49 PolarHBondContact O-N 3.11Å; D47-N49 VanDerWaalsContact O-N 3.12Å; D47-N49 WeakPolarHBondContact OD1-CB 3.34Å; D47-N49 PolarHBondContact OD1-N 2.89Å; N49-E51 WeakPolarHBondContact OD1-CB 3.26Å; N49-E51 PolarHBondContact OD1-N 2.89Å; N49-T52 WeakPolarHBondContact CB-OG1 3.31Å; N49-Q155 PolarHBondContact O-NE2 2.96Å; N49-Q155 VanDerWaalsContact O-NE2 3.09Å
50	L	95.6	Very high	96.3	Very high	62 Å²	62	56.8 Å²	56.8	33%	0.325	30%	0.301	S	S	.	.	S	Bend	trans	-101	-10.2	178.1	-60.5	-179.4	0	0	0	112.2	Y80 W119 R154 Q155	L50-Y80 HydrophobicContact CD1-CD2 4.27Å; L50-Y80 HydrophobicContact CD1-CE1 4.49Å; L50-Y80 HydrophobicContact CD1-CE2 3.76Å; L50-Y80 HydrophobicContact CD2-CD1 4Å; L50-Y80 HydrophobicContact CD2-CD2 3.84Å; L50-Y80 HydrophobicContact CD2-CE1 4.27Å; L50-Y80 HydrophobicContact CD2-CE2 4.13Å; L50-Y80 HydrophobicContact CD2-CG 3.74Å; L50-W119 HydrophobicContact CD2-CZ2 4.06Å; L50-R154 WeakPolarHBondContact O-CD 3.31Å; L50-R154 PolarHBondContact O-NH1 2.91Å; L50-Q155 HydrophobicContact CD2-CB 3.98Å
51	E	95.8	Very high	96.4	Very high	157 Å²	157	56 Å²	56	73%	0.734	30%	0.303	S	S	*	.	S	Bend	trans	-80.3	-32.1	176.2	-62.3	-177.5	165.1	0	0	111.9	N49 Y53 R154	N49-E51 WeakPolarHBondContact OD1-CB 3.26Å; N49-E51 PolarHBondContact OD1-N 2.89Å; E51-Y53 WeakPolarHBondContact O-CD1 3.42Å; E51-R154 PolarHBondContact O-NH1 2.95Å
52	T	97.3	Very high	96.5	Very high	39 Å²	39	55.5 Å²	55.5	24%	0.239	30%	0.297	C	S	.	.			trans	-83	158.5	174.7	51	0	0	0	0	111.1	Q44 D47 N49 R154	Q44-T52 HydrophobicContact CG-CG2 4.37Å; D47-T52 VanDerWaalsContact CG-OG1 3.24Å; D47-T52 PolarHBondContact OD1-OG1 2.93Å; D47-T52 VanDerWaalsContact OD2-CB 3.3Å; D47-T52 WeakPolarHBondContact OD2-CB 3.29Å; D47-T52 WeakPolarHBondContact OD2-CG2 3.16Å; D47-T52 PolarHBondContact OD2-OG1 3.38Å; N49-T52 WeakPolarHBondContact CB-OG1 3.31Å; T52-R154 WeakPolarHBondContact O-CA 3.22Å
53	Y	98.1	Very high	96.6	Very high	54 Å²	54	55.2 Å²	55.2	21%	0.212	29%	0.294	C	S	.	.			trans	-156.3	152.9	-178.8	47.3	-89.5	0	0	0	111.8	F40 Q44 E51 Q55 H152 M153	F40-Y53 AromaticContact CD1-CD2 3.8Å; F40-Y53 HydrophobicContact CD1-CD2 3.8Å; F40-Y53 AromaticContact CD1-CE2 3.49Å; F40-Y53 HydrophobicContact CD1-CE2 3.49Å; F40-Y53 VanDerWaalsContact CD1-CE2 3.49Å; F40-Y53 WeakPolarHBondContact CD1-O 3.48Å; F40-Y53 HydrophobicContact CE1-CD2 4.28Å; F40-Y53 HydrophobicContact CE1-CE1 4.41Å; F40-Y53 AromaticContact CE1-CE2 3.57Å; F40-Y53 HydrophobicContact CE1-CE2 3.57Å; F40-Y53 AromaticContact CE1-CZ 3.64Å; F40-Y53 HydrophobicContact CG-CE2 4.48Å; Q44-Y53 WeakPolarHBondContact CB-O 3.32Å; E51-Y53 WeakPolarHBondContact O-CD1 3.42Å; Y53-Q55 HydrophobicContact CD2-CB 4.23Å; Y53-Q55 HydrophobicContact CE2-CB 4.29Å; Y53-H152 HydrophobicContact CD2-CB 4.4Å; Y53-H152 AromaticContact CD2-CD2 3.71Å; Y53-H152 AromaticContact CD2-CE1 3.97Å; Y53-H152 AromaticContact CD2-CG 3.78Å; Y53-H152 AromaticContact CD2-ND1 3.94Å; Y53-H152 AromaticContact CD2-NE2 3.86Å; Y53-H152 AromaticContact CE2-CD2 3.89Å; Y53-H152 AromaticContact CE2-CE1 3.52Å; Y53-H152 AromaticContact CE2-ND1 3.9Å; Y53-H152 AromaticContact CE2-NE2 3.51Å; Y53-H152 AromaticContact CZ-CE1 3.96Å; Y53-M153 WeakPolarHBondContact CA-O 3.45Å
54	W	98.2	Very high	96.7	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	133.3	157	165.5	42.9	0	0	0	109.1	L33 S35 F40 L45 H62 V64 T151 H152 M153	L33-W54 HydrophobicContact CB-CZ2 4.13Å; L33-W54 HydrophobicContact CD1-CD2 4.07Å; L33-W54 HydrophobicContact CD1-CG 3.82Å; L33-W54 HydrophobicContact CD2-CD2 3.89Å; L33-W54 HydrophobicContact CD2-CE3 4.04Å; L33-W54 HydrophobicContact CD2-CG 4.41Å; L33-W54 HydrophobicContact CD2-CH2 4.22Å; L33-W54 HydrophobicContact CD2-CZ2 4.06Å; L33-W54 HydrophobicContact CD2-CZ3 4.23Å; L33-W54 HydrophobicContact CG-CD2 4.49Å; L33-W54 HydrophobicContact CG-CZ2 4.5Å; S35-W54 PolarHBondContact O-NE1 3.41Å; F40-W54 VanDerWaalsContact O-CD1 3.25Å; L45-W54 HydrophobicContact CB-CB 4.27Å; L45-W54 HydrophobicContact CD1-CB 4.14Å; L45-W54 HydrophobicContact CD2-CE3 4.45Å; W54-H62 HydrophobicContact CH2-CB 3.82Å; W54-H62 HydrophobicContact CZ2-CB 4.27Å; W54-V64 HydrophobicContact CE3-CG2 3.86Å; W54-V64 HydrophobicContact CH2-CG2 3.86Å; W54-V64 HydrophobicContact CZ3-CG2 3.27Å; W54-T151 HydrophobicContact CE3-CG2 4.47Å; W54-T151 HydrophobicContact CH2-CG2 4.17Å; W54-T151 HydrophobicContact CZ3-CG2 4.04Å; W54-H152 VanDerWaalsContact O-CA 3.32Å; W54-H152 WeakPolarHBondContact O-CA 3.44Å; W54-M153 HydrophobicContact CE3-CB 4Å; W54-M153 HydrophobicContact CE3-CG 4.01Å; W54-M153 HydrophobicContact CE3-SD 3.86Å; W54-M153 HydrophobicContact CZ3-CG 4.23Å; W54-M153 HydrophobicContact CZ3-SD 3.65Å; W54-M153 PolarHBondContact N-O 2.85Å; W54-M153 PolarHBondContact O-N 2.83Å; W54-M153 VanDerWaalsContact O-N 3.13Å
55	Q	98.2	Very high	96.8	Very high	15 Å²	15	47.6 Å²	47.6	7%	0.07	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	119.6	167.2	-179.6	168.7	3.1	0	0	109.5	C36 K37 F40 Y53 T151	C36-Q55 WeakPolarHBondContact CA-O 3.42Å; K37-Q55 HydrophobicContact CD-CG 4.08Å; K37-Q55 HydrophobicContact CG-CG 4.27Å; K37-Q55 PolarHBondContact N-O 3.01Å; F40-Q55 HydrophobicContact CB-CB 3.84Å; F40-Q55 HydrophobicContact CG-CB 4.26Å; F40-Q55 PolarHBondContact O-N 3.22Å; Y53-Q55 HydrophobicContact CD2-CB 4.23Å; Y53-Q55 HydrophobicContact CE2-CB 4.29Å; Q55-T151 WeakPolarHBondContact CA-O 3.3Å
56	S	98	Very high	96.9	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.255	C	S	.	.			trans	-71.6	159.4	173.2	69.1	0	0	0	0	111.9	H62 D150 T151	S56-H62 VanDerWaalsContact CB-ND1 3.31Å; S56-H62 WeakPolarHBondContact CB-ND1 3.21Å; S56-H62 PolarHBondContact OG-CD2 2.8Å; S56-H62 VanDerWaalsContact OG-CD2 3.23Å; S56-H62 PolarHBondContact OG-CE1 2.94Å; S56-H62 PolarHBondContact OG-ND1 2.89Å; S56-H62 VanDerWaalsContact OG-ND1 3.13Å; S56-H62 PolarHBondContact OG-NE2 3.16Å; S56-H62 VanDerWaalsContact OG-NE2 3.15Å; S56-D150 VanDerWaalsContact O-CB 3.28Å; S56-D150 WeakPolarHBondContact O-CB 3.45Å; S56-D150 WeakPolarHBondContact OG-CA 3.41Å; S56-T151 PolarHBondContact N-O 3.01Å; S56-T151 PolarHBondContact OG-N 3.36Å
57	D	96.5	Very high	97	Very high	81 Å²	81	47.9 Å²	47.9	43%	0.433	26%	0.259	S	S	.	.			trans	-149.4	83.2	175.5	-170.4	0.8	0	0	0	109.3	S35 K37	S35-D57 WeakPolarHBondContact CB-O 3.36Å; S35-D57 PolarHBondContact OG-N 3.1Å; S35-D57 PolarHBondContact OG-O 3.36Å; K37-D57 HydrophobicContact CG-CB 3.86Å
58	G	94.5	Very high	97.1	Very high	21 Å²	21	45.2 Å²	45.2	22%	0.216	24%	0.244	C	C	.	.	S	Bend	trans	177.8	-169.2	-172.9	0	0	0	0	0	114.7	H62	G58-H62 PolarHBondContact O-CE1 2.95Å
59	S	96.2	Very high	97	Very high	104 Å²	104	52.4 Å²	52.4	73%	0.727	26%	0.264	S	S	*	.	S	Bend	trans	-80.6	139.4	174.3	54.1	0	0	0	0	111.2
60	Q	94.9	Very high	97	Very high	83 Å²	83	57.5 Å²	57.5	39%	0.388	28%	0.279	S	S	.	.	S	Bend	trans	-63.6	149.3	168.7	-72.1	174.7	-3.1	0	0	111.1	L142 N144 G148 R149	Q60-L142 PolarHBondContact OE1-O 2.9Å; Q60-N144 PolarHBondContact NE2-ND2 3.03Å; Q60-G148 PolarHBondContact NE2-O 3.07Å; Q60-R149 PolarHBondContact NE2-O 3.41Å
61	P	97.9	Very high	97	Very high	52 Å²	52	59 Å²	59	34%	0.338	28%	0.282	S	S	.	.	S	Bend	cis	-77.9	143.4	-0.3	32	-35.5	0	0	0	113.4	L63 A140 V141 L142	P61-L63 HydrophobicContact CB-CD2 4.17Å; P61-L63 HydrophobicContact CG-CD2 4.09Å; P61-A140 HydrophobicContact CB-CB 4.45Å; P61-V141 VanDerWaalsContact CA-O 3.23Å; P61-V141 WeakPolarHBondContact CA-O 3.25Å; P61-V141 WeakPolarHBondContact CB-O 3.35Å; P61-L142 HydrophobicContact CB-CD2 3.88Å
62	H	98.4	Very high	97	Very high	1 Å²	1	52 Å²	52	1%	0.005	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	131.7	173.1	-55.2	-64.1	0	0	0	109.7	S34 W54 S56 G58 A140 V141 R149 T151	S34-H62 WeakPolarHBondContact OG-CA 3.29Å; W54-H62 HydrophobicContact CH2-CB 3.82Å; W54-H62 HydrophobicContact CZ2-CB 4.27Å; S56-H62 VanDerWaalsContact CB-ND1 3.31Å; S56-H62 WeakPolarHBondContact CB-ND1 3.21Å; S56-H62 PolarHBondContact OG-CD2 2.8Å; S56-H62 VanDerWaalsContact OG-CD2 3.23Å; S56-H62 PolarHBondContact OG-CE1 2.94Å; S56-H62 PolarHBondContact OG-ND1 2.89Å; S56-H62 VanDerWaalsContact OG-ND1 3.13Å; S56-H62 PolarHBondContact OG-NE2 3.16Å; S56-H62 VanDerWaalsContact OG-NE2 3.15Å; G58-H62 PolarHBondContact O-CE1 2.95Å; H62-A140 WeakPolarHBondContact O-CA 3.13Å; H62-V141 HydrophobicContact CB-CB 4.28Å; H62-V141 PolarHBondContact N-O 2.8Å; H62-V141 VanDerWaalsContact N-O 3.08Å; H62-V141 PolarHBondContact O-N 2.81Å; H62-R149 PolarHBondContact NE2-O 3.2Å; H62-T151 HydrophobicContact CB-CG2 3.94Å
63	L	98.3	Very high	96.9	Very high	36 Å²	36	52.3 Å²	52.3	19%	0.188	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	136	-167.7	-51.1	176.1	0	0	0	111.6	L33 S34 P61 Q138 I139 A140	L33-L63 CarbonylContact C-O 3.49Å; L33-L63 VanDerWaalsContact CA-O 3.29Å; L33-L63 WeakPolarHBondContact CA-O 3.49Å; S34-L63 PolarHBondContact N-O 3.12Å; S34-L63 PolarHBondContact OG-N 3.39Å; P61-L63 HydrophobicContact CB-CD2 4.17Å; P61-L63 HydrophobicContact CG-CD2 4.09Å; L63-Q138 HydrophobicContact CD2-CG 4.27Å; L63-I139 CarbonylContact C-O 3.59Å; L63-I139 WeakPolarHBondContact CA-O 3.29Å; L63-A140 HydrophobicContact CD2-CB 3.52Å
64	V	98.6	Very high	96.8	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	117.8	162	-172	0	0	0	0	108	W31 L33 L45 W54 I66 Q138 I139 M153 I156	W31-V64 HydrophobicContact CE3-CG1 3.76Å; W31-V64 HydrophobicContact CZ3-CG1 3.92Å; L33-V64 HydrophobicContact CD2-CB 4.13Å; L33-V64 HydrophobicContact CD2-CG1 3.93Å; L33-V64 HydrophobicContact CD2-CG2 3.72Å; L45-V64 HydrophobicContact CD2-CG1 4.08Å; L45-V64 HydrophobicContact CD2-CG2 4.27Å; W54-V64 HydrophobicContact CE3-CG2 3.86Å; W54-V64 HydrophobicContact CH2-CG2 3.86Å; W54-V64 HydrophobicContact CZ3-CG2 3.27Å; V64-I66 HydrophobicContact CG1-CG1 4.36Å; V64-Q138 CarbonylContact O-C 3.59Å; V64-Q138 WeakPolarHBondContact O-CA 3.49Å; V64-I139 HydrophobicContact CB-CB 4.17Å; V64-I139 HydrophobicContact CB-CD1 4.35Å; V64-I139 PolarHBondContact N-O 2.78Å; V64-I139 PolarHBondContact O-N 3.46Å; V64-M153 HydrophobicContact CG2-SD 4.06Å; V64-I156 HydrophobicContact CB-CD1 4.4Å; V64-I156 HydrophobicContact CG1-CD1 4.08Å; V64-I156 HydrophobicContact CG2-CD1 4.04Å
65	N	98.3	Very high	96.7	Very high	12 Å²	12	53.5 Å²	53.5	6%	0.064	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	127	179.8	-61.5	-57.4	0	0	0	109.7	W31 S32 F102 M136 Q138	W31-N65 WeakPolarHBondContact CA-O 3.33Å; S32-N65 PolarHBondContact N-O 2.83Å; S32-N65 PolarHBondContact O-N 2.99Å; S32-N65 WeakPolarHBondContact OG-CB 3.41Å; N65-F102 HydrophobicContact CB-CE1 4.22Å; N65-M136 HydrophobicContact CB-CE 3.79Å; N65-M136 VanDerWaalsContact OD1-CE 3.28Å; N65-M136 WeakPolarHBondContact OD1-CE 3.45Å; N65-Q138 WeakPolarHBondContact OD1-CG 3.25Å; N65-Q138 PolarHBondContact OD1-NE2 2.95Å
66	I	98.3	Very high	96.5	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	111.7	-178	-51.5	171.7	0	0	0	107.3	A29 W31 V64 F68 M136 I137 I139	A29-I66 HydrophobicContact CB-CG2 3.43Å; A29-I66 VanDerWaalsContact CB-CG2 3.43Å; W31-I66 HydrophobicContact CD2-CG1 4.08Å; W31-I66 HydrophobicContact CE3-CD1 4.12Å; W31-I66 HydrophobicContact CE3-CG1 3.69Å; W31-I66 HydrophobicContact CH2-CD1 3.41Å; W31-I66 VanDerWaalsContact CH2-CD1 3.41Å; W31-I66 HydrophobicContact CH2-CG1 3.86Å; W31-I66 HydrophobicContact CZ2-CD1 4.06Å; W31-I66 HydrophobicContact CZ2-CG1 4.23Å; W31-I66 HydrophobicContact CZ2-CG2 4.15Å; W31-I66 HydrophobicContact CZ3-CD1 3.45Å; W31-I66 VanDerWaalsContact CZ3-CD1 3.45Å; W31-I66 HydrophobicContact CZ3-CG1 3.58Å; V64-I66 HydrophobicContact CG1-CG1 4.36Å; I66-F68 HydrophobicContact CG2-CE2 4.13Å; I66-F68 HydrophobicContact CG2-CZ 3.99Å; I66-M136 CarbonylContact O-C 3.58Å; I66-M136 WeakPolarHBondContact O-CA 3.35Å; I66-I137 HydrophobicContact CB-CB 4.31Å; I66-I137 PolarHBondContact N-O 3.05Å; I66-I137 PolarHBondContact O-N 3.26Å; I66-I139 HydrophobicContact CD1-CD1 4.08Å
67	Q	98	Very high	96.5	Very high	63 Å²	63	53.6 Å²	53.6	29%	0.294	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	124.9	-176.4	-68.7	-174.4	-13.3	0	0	111.7	A29 V30 M136	A29-Q67 CarbonylContact C-O 3.57Å; A29-Q67 WeakPolarHBondContact CA-O 3.33Å; A29-Q67 WeakPolarHBondContact CB-O 3.36Å; V30-Q67 PolarHBondContact N-O 3.36Å; V30-Q67 PolarHBondContact O-N 3.41Å; Q67-M136 HydrophobicContact CG-CB 4.43Å; Q67-M136 HydrophobicContact CG-CG 3.93Å; Q67-M136 HydrophobicContact CG-SD 4.16Å
68	F	97.4	Very high	96.6	Very high	12 Å²	12	49.7 Å²	49.7	5%	0.053	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	141.4	177.1	-61.8	-77.9	0	0	0	111.2	I25 A29 I66 R70 T72 V74 F135 I137 I158	I25-F68 HydrophobicContact CD1-CE1 3.83Å; I25-F68 HydrophobicContact CD1-CZ 3.87Å; I25-F68 HydrophobicContact CG1-CE1 4.24Å; I25-F68 HydrophobicContact CG1-CZ 4.45Å; A29-F68 HydrophobicContact CB-CD1 3.81Å; A29-F68 HydrophobicContact CB-CE1 3.7Å; A29-F68 HydrophobicContact CB-CG 4.48Å; A29-F68 HydrophobicContact CB-CZ 4.27Å; I66-F68 HydrophobicContact CG2-CE2 4.13Å; I66-F68 HydrophobicContact CG2-CZ 3.99Å; F68-R70 WeakPolarHBondContact CB-O 3.37Å; F68-R70 PolarHBondContact O-N 3.42Å; F68-T72 HydrophobicContact CD1-CG2 4.2Å; F68-T72 HydrophobicContact CE1-CG2 4.24Å; F68-T72 HydrophobicContact CG-CG2 4.46Å; F68-V74 HydrophobicContact CE2-CG1 4.06Å; F68-V74 HydrophobicContact CZ-CG1 4.13Å; F68-F135 PolarHBondContact N-O 3.12Å; F68-I137 HydrophobicContact CE2-CD1 4.06Å; F68-I137 HydrophobicContact CE2-CG1 4.39Å; F68-I158 HydrophobicContact CE2-CD1 4.28Å; F68-I158 HydrophobicContact CZ-CD1 3.83Å
69	R	93.6	Very high	96.7	Very high	248 Å²	248	48.7 Å²	48.7	94%	0.936	23%	0.23	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-61.8	-25.5	175	-175.6	175.8	177.4	179.3	0.8	113.5
70	R	95	Very high	96.8	Very high	167 Å²	167	45.7 Å²	45.7	63%	0.63	20%	0.202	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-134.7	161	178.9	62.1	-178.1	175.9	-175.5	-2.2	109.6	F68 T72	F68-R70 WeakPolarHBondContact CB-O 3.37Å; F68-R70 PolarHBondContact O-N 3.42Å; R70-T72 PolarHBondContact O-N 3.38Å; R70-T72 PolarHBondContact O-OG1 2.89Å
71	K	95.3	Very high	97	Very high	93 Å²	93	41.8 Å²	41.8	40%	0.404	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	104.1	175.7	-152.2	177.9	-174.8	169	0	109.4	R133 F135	K71-R133 WeakPolarHBondContact CE-O 3.25Å; K71-R133 HydrophobicContact CG-CG 4.16Å; K71-F135 HydrophobicContact CB-CD1 4.4Å; K71-F135 HydrophobicContact CB-CD2 4.1Å; K71-F135 HydrophobicContact CB-CE1 4.05Å; K71-F135 HydrophobicContact CB-CE2 3.71Å; K71-F135 HydrophobicContact CB-CG 4.44Å; K71-F135 HydrophobicContact CB-CZ 3.68Å; K71-F135 HydrophobicContact CD-CD2 4.26Å; K71-F135 HydrophobicContact CD-CE2 3.85Å; K71-F135 HydrophobicContact CG-CD2 3.82Å; K71-F135 HydrophobicContact CG-CE2 3.71Å; K71-F135 HydrophobicContact CG-CG 4.42Å; K71-F135 HydrophobicContact CG-CZ 4.23Å; K71-F135 VanDerWaalsContact N-CE1 3.29Å
72	T	95.8	Very high	96.9	Very high	12 Å²	12	40.3 Å²	40.3	7%	0.074	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	139	-170.7	-61.8	0	0	0	0	110	I25 F68 R70 V74 R133 T134	I25-T72 HydrophobicContact CD1-CG2 3.5Å; F68-T72 HydrophobicContact CD1-CG2 4.2Å; F68-T72 HydrophobicContact CE1-CG2 4.24Å; F68-T72 HydrophobicContact CG-CG2 4.46Å; R70-T72 PolarHBondContact O-N 3.38Å; R70-T72 PolarHBondContact O-OG1 2.89Å; T72-V74 HydrophobicContact CG2-CG1 4.33Å; T72-R133 WeakPolarHBondContact O-CA 3.44Å; T72-T134 PolarHBondContact N-O 3.37Å; T72-T134 PolarHBondContact O-N 2.67Å
73	T	95.9	Very high	96.8	Very high	45 Å²	45	42.5 Å²	42.5	28%	0.276	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	127.4	173.3	-54.5	0	0	0	0	108.8	P131 T132 T160 P161	T73-P131 HydrophobicContact CG2-CB 3.52Å; T73-P131 HydrophobicContact CG2-CG 4.47Å; T73-T132 WeakPolarHBondContact CA-O 3.42Å; T73-T160 VanDerWaalsContact O-CB 3.26Å; T73-T160 WeakPolarHBondContact O-CB 3.45Å; T73-T160 PolarHBondContact O-OG1 3.32Å; T73-P161 HydrophobicContact CG2-CG 3.68Å
74	V	96	Very high	96.7	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	135	-177.5	-64.8	0	0	0	0	108.8	I25 F68 T72 L124 P131 T132 T134 I137 I158	I25-V74 HydrophobicContact CD1-CG1 3.83Å; F68-V74 HydrophobicContact CE2-CG1 4.06Å; F68-V74 HydrophobicContact CZ-CG1 4.13Å; T72-V74 HydrophobicContact CG2-CG1 4.33Å; V74-L124 HydrophobicContact CB-CD1 3.92Å; V74-L124 HydrophobicContact CG2-CB 4.15Å; V74-L124 HydrophobicContact CG2-CD1 3.74Å; V74-P131 CarbonylContact O-C 3.56Å; V74-P131 WeakPolarHBondContact O-CA 3.42Å; V74-P131 VanDerWaalsContact O-CB 3.31Å; V74-P131 WeakPolarHBondContact O-CB 3.31Å; V74-T132 VanDerWaalsContact CG2-O 3.29Å; V74-T132 WeakPolarHBondContact CG2-O 3.37Å; V74-T132 PolarHBondContact N-O 2.74Å; V74-T132 PolarHBondContact O-N 3.17Å; V74-T132 VanDerWaalsContact O-N 3.16Å; V74-T134 HydrophobicContact CG2-CG2 4.18Å; V74-I137 HydrophobicContact CB-CD1 4.25Å; V74-I137 HydrophobicContact CG1-CD1 4Å; V74-I137 HydrophobicContact CG2-CD1 3.93Å; V74-I158 HydrophobicContact CB-CD1 4.45Å; V74-I158 HydrophobicContact CG1-CD1 3.97Å; V74-I158 HydrophobicContact CG1-CG1 4.34Å
75	K	94.8	Very high	96.6	Very high	78 Å²	78	52.3 Å²	52.3	34%	0.339	23%	0.232	S	C	.	.			trans	-113.8	-45.8	-175.6	177.3	175.2	179.5	-176.6	0	112.1	V22 L124 P131 Y159 P161	V22-K75 HydrophobicContact CG1-CD 4.11Å; K75-L124 PolarHBondContact O-N 2.86Å; K75-P131 HydrophobicContact CB-CB 4.25Å; K75-P131 HydrophobicContact CB-CG 4.26Å; K75-P131 HydrophobicContact CG-CG 4.38Å; K75-Y159 PolarHBondContact N-O 2.77Å; K75-P161 HydrophobicContact CB-CG 4.5Å; K75-P161 HydrophobicContact CD-CB 4.16Å
76	T	95.9	Very high	96.5	Very high	17 Å²	17	52 Å²	52	10%	0.104	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	134.7	-175.6	-51.5	0	0	0	0	110.1	H121 Y159	T76-H121 HydrophobicContact CG2-CB 4.37Å; T76-Y159 PolarHBondContact N-O 2.99Å; T76-Y159 PolarHBondContact O-N 3.19Å
77	L	97.4	Very high	96.4	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	129.2	165.5	172.2	72.6	0	0	0	107.9	I79 V96 V122 L124 I139 I156 I158	L77-I79 HydrophobicContact CD2-CD1 3.97Å; L77-I79 HydrophobicContact CD2-CG1 4.31Å; L77-I79 HydrophobicContact CG-CD1 4.34Å; L77-I79 HydrophobicContact CG-CG1 4.15Å; L77-V96 HydrophobicContact CD2-CG1 4.35Å; L77-V96 HydrophobicContact CD2-CG2 4.09Å; L77-V122 HydrophobicContact CB-CB 4.22Å; L77-V122 PolarHBondContact N-O 2.84Å; L77-V122 WeakPolarHBondContact O-CB 3.49Å; L77-V122 PolarHBondContact O-N 3.47Å; L77-L124 HydrophobicContact CB-CD1 3.92Å; L77-L124 HydrophobicContact CB-CD2 4.19Å; L77-L124 HydrophobicContact CB-CG 4.11Å; L77-I139 HydrophobicContact CD1-CD1 3.88Å; L77-I139 HydrophobicContact CD2-CD1 3.62Å; L77-I139 HydrophobicContact CD2-CG1 3.76Å; L77-I139 HydrophobicContact CG-CD1 4.32Å; L77-I156 HydrophobicContact CD1-CG2 3.52Å; L77-I158 HydrophobicContact CD1-CB 4.37Å
78	C	97.9	Very high	96.3	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	128.5	176.1	-61.4	0	0	0	0	108.6	P13 W119 I120 H121 I156 K157 Y159	P13-C78 HydrophobicContact CB-CB 4.43Å; P13-C78 HydrophobicContact CG-CB 3.88Å; C78-W119 HydrophobicContact CB-CE3 3.99Å; C78-W119 HydrophobicContact CB-CZ3 4.16Å; C78-I120 VanDerWaalsContact CA-O 3.32Å; C78-I120 WeakPolarHBondContact CA-O 3.4Å; C78-H121 VanDerWaalsContact SG-CE1 3.54Å; C78-H121 PolarHBondContact SG-ND1 2.91Å; C78-H121 VanDerWaalsContact SG-ND1 3.38Å; C78-I156 CarbonylContact O-C 3.57Å; C78-I156 WeakPolarHBondContact O-CA 3.36Å; C78-K157 HydrophobicContact CB-CB 4.24Å; C78-K157 PolarHBondContact N-O 3.34Å; C78-K157 PolarHBondContact O-N 3.45Å; C78-Y159 HydrophobicContact CB-CE2 4.19Å; C78-Y159 VanDerWaalsContact SG-CE2 3.55Å
79	I	97.9	Very high	96.3	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	134.4	179.8	-64.9	169.7	0	0	0	107.6	L77 I94 W119 I120 V122 I139 M153 I156	L77-I79 HydrophobicContact CD2-CD1 3.97Å; L77-I79 HydrophobicContact CD2-CG1 4.31Å; L77-I79 HydrophobicContact CG-CD1 4.34Å; L77-I79 HydrophobicContact CG-CG1 4.15Å; I79-I94 HydrophobicContact CD1-CD1 4.17Å; I79-W119 CarbonylContact O-C 3.54Å; I79-I120 PolarHBondContact N-O 2.9Å; I79-I120 PolarHBondContact O-N 3.23Å; I79-V122 HydrophobicContact CD1-CG2 4.49Å; I79-I139 HydrophobicContact CD1-CD1 4.47Å; I79-I139 HydrophobicContact CD1-CG2 4.14Å; I79-M153 HydrophobicContact CB-CE 4.31Å; I79-M153 HydrophobicContact CD1-CE 4.15Å; I79-M153 HydrophobicContact CG1-CE 4.08Å; I79-M153 HydrophobicContact CG2-CE 3.35Å; I79-I156 HydrophobicContact CG1-CG1 4.46Å
80	Y	98.3	Very high	96.5	Very high	40 Å²	40	47.8 Å²	47.8	16%	0.157	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	126.8	172.1	-167.3	-84.4	0	0	0	110.9	L50 D82 W119 R154 Q155	L50-Y80 HydrophobicContact CD1-CD2 4.27Å; L50-Y80 HydrophobicContact CD1-CE1 4.49Å; L50-Y80 HydrophobicContact CD1-CE2 3.76Å; L50-Y80 HydrophobicContact CD2-CD1 4Å; L50-Y80 HydrophobicContact CD2-CD2 3.84Å; L50-Y80 HydrophobicContact CD2-CE1 4.27Å; L50-Y80 HydrophobicContact CD2-CE2 4.13Å; L50-Y80 HydrophobicContact CD2-CG 3.74Å; Y80-D82 HydrophobicContact CE1-CB 4.14Å; Y80-W119 AromaticContact CD2-CD1 3.76Å; Y80-W119 AromaticContact CD2-CD2 3.66Å; Y80-W119 HydrophobicContact CD2-CD2 3.66Å; Y80-W119 AromaticContact CD2-CE2 3.61Å; Y80-W119 HydrophobicContact CD2-CE3 4.28Å; Y80-W119 AromaticContact CD2-CG 3.8Å; Y80-W119 HydrophobicContact CD2-CG 3.8Å; Y80-W119 HydrophobicContact CD2-CZ2 4.22Å; Y80-W119 AromaticContact CD2-NE1 3.63Å; Y80-W119 HydrophobicContact CE2-CG 4.46Å; Y80-W119 AromaticContact CE2-NE1 3.98Å; Y80-W119 HydrophobicContact CG-CD2 4.4Å; Y80-R154 HydrophobicContact CD1-CB 3.82Å; Y80-R154 HydrophobicContact CD1-CG 4.35Å; Y80-Q155 PolarHBondContact N-O 2.87Å
81	A	97.2	Very high	96.7	Very high	1 Å²	1	39.9 Å²	39.9	1%	0.008	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	139.5	172.6	0	0	0	0	0	109.9	T90 P116 G118 I120	A81-T90 HydrophobicContact CB-CG2 4.39Å; A81-P116 HydrophobicContact CB-CG 4.07Å; A81-G118 PolarHBondContact N-O 2.91Å; A81-G118 PolarHBondContact O-N 3.46Å; A81-I120 HydrophobicContact CB-CD1 4.12Å
82	D	97.1	Very high	96.8	Very high	21 Å²	21	36.7 Å²	36.7	11%	0.112	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	110.1	178.2	178	31.5	0	0	0	112	Y80 K84 S85 D86 P116	Y80-D82 HydrophobicContact CE1-CB 4.14Å; D82-K84 VanDerWaalsContact C-N 3.26Å; D82-K84 PolarHBondContact O-N 2.78Å; D82-K84 PolarHBondContact OD1-N 2.99Å; D82-S85 PolarHBondContact O-N 3.32Å; D82-S85 WeakPolarHBondContact OD2-CB 2.92Å; D82-S85 PolarHBondContact OD2-N 2.95Å; D82-S85 PolarHBondContact OD2-OG 2.84Å; D82-D86 WeakPolarHBondContact O-CB 3.25Å; D82-D86 PolarHBondContact O-N 2.85Å; D82-P116 CarbonylContact C-O 3.48Å; D82-P116 WeakPolarHBondContact CA-O 3.36Å
83	Y	96.7	Very high	96.9	Very high	48 Å²	48	39.3 Å²	39.3	19%	0.188	19%	0.193	C	C	.	.	H	α-helix	trans	-61.4	-33	-179.4	-177.4	-102	0	0	0	113.3	S85 E87 T90 E115 P116 H145 Q146	Y83-S85 VanDerWaalsContact C-N 3.26Å; Y83-S85 PolarHBondContact O-N 3.2Å; Y83-E87 WeakPolarHBondContact O-CA 3.31Å; Y83-E87 PolarHBondContact O-N 2.81Å; Y83-T90 WeakPolarHBondContact CA-OG1 3.36Å; Y83-T90 HydrophobicContact CD2-CG2 4.39Å; Y83-E115 HydrophobicContact CD1-CB 3.78Å; Y83-E115 HydrophobicContact CD1-CG 3.59Å; Y83-E115 HydrophobicContact CD2-CB 4.39Å; Y83-E115 HydrophobicContact CD2-CG 4.14Å; Y83-E115 HydrophobicContact CE1-CB 4.37Å; Y83-E115 HydrophobicContact CE1-CG 3.66Å; Y83-E115 HydrophobicContact CE2-CG 4.2Å; Y83-E115 HydrophobicContact CG-CB 3.79Å; Y83-E115 HydrophobicContact CG-CG 3.83Å; Y83-P116 WeakPolarHBondContact CB-O 3.41Å; Y83-P116 PolarHBondContact N-O 3.09Å; Y83-H145 HydrophobicContact CD2-CB 4.33Å; Y83-H145 AromaticContact CD2-CD2 3.98Å; Y83-H145 HydrophobicContact CE2-CB 3.86Å; Y83-H145 AromaticContact CE2-CD2 3.78Å; Y83-H145 AromaticContact CE2-CG 3.87Å; Y83-Q146 PolarHBondContact OH-NE2 2.74Å
84	K	95.6	Very high	97	Very high	170 Å²	170	37.2 Å²	37.2	74%	0.739	18%	0.18	S	C	*	.	H	α-helix	trans	-67	-32.7	-179.9	-68	-177.6	179.7	177.3	0	112.3	D82	D82-K84 VanDerWaalsContact C-N 3.26Å; D82-K84 PolarHBondContact O-N 2.78Å; D82-K84 PolarHBondContact OD1-N 2.99Å
85	S	95.8	Very high	97.1	Very high	71 Å²	71	37.2 Å²	37.2	50%	0.497	18%	0.18	S	C	.	.	H	α-helix	trans	-89.7	-32.3	-177.7	-59.1	0	0	0	0	112.3	D82 Y83	D82-S85 PolarHBondContact O-N 3.32Å; D82-S85 WeakPolarHBondContact OD2-CB 2.92Å; D82-S85 PolarHBondContact OD2-N 2.95Å; D82-S85 PolarHBondContact OD2-OG 2.84Å; Y83-S85 VanDerWaalsContact C-N 3.26Å; Y83-S85 PolarHBondContact O-N 3.2Å
86	D	96.1	Very high	97.3	Very high	5 Å²	5	33.5 Å²	33.5	3%	0.027	16%	0.163	C	C	.	.	H	α-helix	trans	-111.3	-14.4	-167.8	-63.7	-44.8	0	0	0	114.3	D82 S88 Y89 T90 H152 R154	D82-D86 WeakPolarHBondContact O-CB 3.25Å; D82-D86 PolarHBondContact O-N 2.85Å; D86-S88 PolarHBondContact O-N 2.94Å; D86-Y89 WeakPolarHBondContact O-CB 3.36Å; D86-Y89 WeakPolarHBondContact O-CD2 3.13Å; D86-Y89 PolarHBondContact O-N 2.84Å; D86-T90 WeakPolarHBondContact CB-OG1 3.41Å; D86-H152 HydrophobicContact CB-CB 4.24Å; D86-H152 IonicContact OD1-CG 3.52Å; D86-H152 IonicContact OD1-ND1 3.59Å; D86-H152 PolarHBondContact OD1-ND1 3.03Å; D86-R154 IonicContact OD1-CZ 3.85Å; D86-R154 IonicContact OD1-NE 2.95Å; D86-R154 IonicContact OD1-NH2 3.66Å; D86-R154 PolarHBondContact OD1-NH2 3.45Å; D86-R154 IonicContact OD2-CZ 2.66Å; D86-R154 IonicContact OD2-NE 2.77Å; D86-R154 PolarHBondContact OD2-NE 2.82Å; D86-R154 IonicContact OD2-NH2 3.95Å
87	E	95.8	Very high	97.4	Very high	123 Å²	123	35.4 Å²	35.4	58%	0.575	17%	0.169	S	C	*	.	G	3₁₀ helix	trans	45.5	-109.7	178.1	-58.8	-176.8	169.1	0	0	113.4	Y83 Y89 T90	Y83-E87 WeakPolarHBondContact O-CA 3.31Å; Y83-E87 PolarHBondContact O-N 2.81Å; E87-Y89 VanDerWaalsContact C-N 3.3Å; E87-Y89 PolarHBondContact O-N 3.31Å; E87-T90 WeakPolarHBondContact O-CB 3.11Å; E87-T90 PolarHBondContact O-N 2.78Å; E87-T90 PolarHBondContact O-OG1 3.15Å
88	S	97.1	Very high	97.3	Very high	33 Å²	33	36.1 Å²	36.1	23%	0.231	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-70.6	-19.6	179.2	67.3	0	0	0	0	114.1	D86 T90 N144 H145 G148	D86-S88 PolarHBondContact O-N 2.94Å; S88-T90 VanDerWaalsContact C-N 3.25Å; S88-T90 PolarHBondContact O-N 2.82Å; S88-N144 VanDerWaalsContact O-CB 3.22Å; S88-N144 WeakPolarHBondContact O-CB 3.47Å; S88-H145 WeakPolarHBondContact CA-O 3.32Å; S88-H145 VanDerWaalsContact O-O 3.14Å; S88-G148 WeakPolarHBondContact O-CA 3.36Å
89	Y	97.5	Very high	97.2	Very high	80 Å²	80	36.5 Å²	36.5	31%	0.314	18%	0.177	S	C	.	.	G	3₁₀ helix	trans	-78.7	-9.4	176.3	-64.7	-91.4	0	0	0	112.7	D86 E87 P91 D150 T151 H152	D86-Y89 WeakPolarHBondContact O-CB 3.36Å; D86-Y89 WeakPolarHBondContact O-CD2 3.13Å; D86-Y89 PolarHBondContact O-N 2.84Å; E87-Y89 VanDerWaalsContact C-N 3.3Å; E87-Y89 PolarHBondContact O-N 3.31Å; Y89-P91 WeakPolarHBondContact O-CD 3.49Å; Y89-D150 HydrophobicContact CD1-CB 4.03Å; Y89-D150 HydrophobicContact CE1-CB 3.9Å; Y89-T151 CarbonylContact O-C 3.58Å; Y89-T151 WeakPolarHBondContact O-CA 3.34Å; Y89-T151 PolarHBondContact O-OG1 2.77Å; Y89-H152 AromaticContact CD1-CD2 3.63Å; Y89-H152 AromaticContact CD1-CE1 3.97Å; Y89-H152 AromaticContact CD1-NE2 3.46Å; Y89-H152 WeakPolarHBondContact CD1-NE2 3.38Å; Y89-H152 AromaticContact CE1-NE2 3.83Å; Y89-H152 AromaticContact CG-CD2 3.9Å; Y89-H152 AromaticContact CG-CE1 3.76Å; Y89-H152 AromaticContact CG-ND1 3.94Å; Y89-H152 AromaticContact CG-NE2 3.73Å; Y89-H152 PolarHBondContact O-N 2.95Å
90	T	98.1	Very high	97	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	20%	0.2	C	C	.	.	S	Bend	trans	-72.2	124.6	-179.4	-53.4	0	0	0	0	111.5	A81 Y83 D86 E87 S88 S92 P116 N144 H145	A81-T90 HydrophobicContact CB-CG2 4.39Å; Y83-T90 WeakPolarHBondContact CA-OG1 3.36Å; Y83-T90 HydrophobicContact CD2-CG2 4.39Å; D86-T90 WeakPolarHBondContact CB-OG1 3.41Å; E87-T90 WeakPolarHBondContact O-CB 3.11Å; E87-T90 PolarHBondContact O-N 2.78Å; E87-T90 PolarHBondContact O-OG1 3.15Å; S88-T90 VanDerWaalsContact C-N 3.25Å; S88-T90 PolarHBondContact O-N 2.82Å; T90-S92 PolarHBondContact O-N 2.77Å; T90-P116 HydrophobicContact CG2-CG 3.55Å; T90-N144 CarbonylContact O-C 3.56Å; T90-N144 WeakPolarHBondContact O-CA 3.48Å; T90-H145 PolarHBondContact O-N 3.31Å; T90-H145 PolarHBondContact O-ND1 2.86Å
91	P	98	Very high	96.7	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-53	128.8	172.5	-21.9	28.1	0	0	0	111.9	Y89 I94 L113 V141 N144 H145 T151 M153	Y89-P91 WeakPolarHBondContact O-CD 3.49Å; P91-I94 HydrophobicContact CB-CD1 3.77Å; P91-I94 HydrophobicContact CB-CG1 3.82Å; P91-I94 HydrophobicContact CG-CD1 4.31Å; P91-L113 HydrophobicContact CB-CD1 4.32Å; P91-V141 HydrophobicContact CB-CG1 3.96Å; P91-V141 HydrophobicContact CB-CG2 4.43Å; P91-V141 HydrophobicContact CG-CG1 4.38Å; P91-V141 HydrophobicContact CG-CG2 4.37Å; P91-N144 WeakPolarHBondContact CA-OD1 3.48Å; P91-H145 PolarHBondContact O-CE1 2.9Å; P91-H145 PolarHBondContact O-ND1 3.22Å; P91-T151 WeakPolarHBondContact CG-OG1 3.38Å; P91-M153 HydrophobicContact CG-CG 4.39Å
92	S	97.6	Very high	96.4	Very high	27 Å²	27	47.1 Å²	47.1	19%	0.189	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	-29.6	173	62.6	0	0	0	0	111.8	T90 E112 L113 A143 N144	T90-S92 PolarHBondContact O-N 2.77Å; S92-E112 WeakPolarHBondContact O-CA 3.42Å; S92-L113 PolarHBondContact O-N 3.36Å; S92-A143 PolarHBondContact N-O 3.07Å; S92-A143 VanDerWaalsContact OG-C 3.23Å; S92-A143 PolarHBondContact OG-O 2.87Å; S92-A143 VanDerWaalsContact OG-O 3.11Å; S92-N144 WeakPolarHBondContact OG-CA 3.42Å; S92-N144 PolarHBondContact OG-N 2.99Å; S92-N144 PolarHBondContact OG-O 2.9Å
93	K	98.2	Very high	96.2	Very high	66 Å²	66	55 Å²	55	29%	0.287	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	116.9	180	-165.4	173.1	-174.5	163.3	0	110.8	L111 E112 L142 A143	K93-L111 WeakPolarHBondContact CA-O 3.46Å; K93-E112 IonicContact NZ-OE1 3.97Å; K93-L142 HydrophobicContact CB-CB 4.23Å; K93-L142 HydrophobicContact CD-CB 4.32Å; K93-L142 HydrophobicContact CD-CD1 4.24Å; K93-L142 HydrophobicContact CG-CB 4.17Å; K93-L142 HydrophobicContact CG-CD1 4.2Å; K93-L142 PolarHBondContact O-N 2.91Å; K93-A143 HydrophobicContact CB-CB 4.05Å; K93-A143 PolarHBondContact N-O 3.41Å; K93-A143 VanDerWaalsContact N-O 3.07Å; K93-A143 PolarHBondContact O-N 2.52Å
94	I	98.3	Very high	96.1	Very high	1 Å²	1	55.5 Å²	55.5	1%	0.005	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	130.6	179.6	-59.6	-177.2	0	0	0	109.4	I79 P91 V96 Q110 L111 L113 I139 A140	I79-I94 HydrophobicContact CD1-CD1 4.17Å; P91-I94 HydrophobicContact CB-CD1 3.77Å; P91-I94 HydrophobicContact CB-CG1 3.82Å; P91-I94 HydrophobicContact CG-CD1 4.31Å; I94-V96 HydrophobicContact CG2-CG2 4.31Å; I94-Q110 CarbonylContact O-C 3.5Å; I94-Q110 WeakPolarHBondContact O-CA 3.48Å; I94-L111 HydrophobicContact CB-CB 4.46Å; I94-L111 PolarHBondContact N-O 3.3Å; I94-L111 PolarHBondContact O-N 3.4Å; I94-L113 HydrophobicContact CD1-CD1 3.68Å; I94-L113 HydrophobicContact CG1-CD1 4.1Å; I94-I139 HydrophobicContact CG2-CG2 3.55Å; I94-A140 CarbonylContact C-O 3.53Å; I94-A140 WeakPolarHBondContact CA-O 3.46Å
95	S	98.3	Very high	96.1	Very high	0 Å²	0	49 Å²	49	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	129.1	170.2	164.2	0	0	0	0	109.2	R97 E107 A140	S95-R97 PolarHBondContact OG-NE 3.01Å; S95-R97 VanDerWaalsContact OG-NE 3.15Å; S95-E107 VanDerWaalsContact CB-OE2 3.25Å; S95-E107 WeakPolarHBondContact CB-OE2 3.23Å; S95-E107 PolarHBondContact OG-OE2 3.47Å; S95-A140 PolarHBondContact N-O 2.84Å; S95-A140 PolarHBondContact O-N 2.61Å
96	V	98.1	Very high	96.1	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	123	174.5	-175.9	0	0	0	0	108.7	L77 I94 I108 R109 V122 L124 I137	L77-V96 HydrophobicContact CD2-CG1 4.35Å; L77-V96 HydrophobicContact CD2-CG2 4.09Å; I94-V96 HydrophobicContact CG2-CG2 4.31Å; V96-I108 HydrophobicContact CG1-CD1 4.42Å; V96-I108 HydrophobicContact CG1-CG1 4.39Å; V96-I108 VanDerWaalsContact O-CG1 3.3Å; V96-I108 WeakPolarHBondContact O-CG1 3.41Å; V96-I108 PolarHBondContact O-N 2.78Å; V96-R109 PolarHBondContact N-O 3.11Å; V96-R109 PolarHBondContact O-N 3.09Å; V96-V122 HydrophobicContact CG2-CG1 4.21Å; V96-L124 HydrophobicContact CG1-CD2 3.69Å; V96-I137 HydrophobicContact CG1-CG2 4.02Å
97	R	97.6	Very high	96.1	Very high	58 Å²	58	56.9 Å²	56.9	22%	0.219	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	149.1	-174.7	-52.2	164	-174.8	175.1	-7.1	109.8	S95 L105 Q106 E107 I137 Q138	S95-R97 PolarHBondContact OG-NE 3.01Å; S95-R97 VanDerWaalsContact OG-NE 3.15Å; R97-L105 HydrophobicContact CB-CB 4.14Å; R97-Q106 CarbonylContact C-O 3.58Å; R97-Q106 WeakPolarHBondContact CA-O 3.32Å; R97-E107 HydrophobicContact CG-CB 4.18Å; R97-I137 CarbonylContact O-C 3.55Å; R97-I137 VanDerWaalsContact O-CA 3.31Å; R97-I137 WeakPolarHBondContact O-CA 3.18Å; R97-Q138 HydrophobicContact CB-CB 4.32Å; R97-Q138 PolarHBondContact N-O 2.82Å; R97-Q138 PolarHBondContact O-N 2.82Å
98	V	97.1	Very high	96	Very high	14 Å²	14	54 Å²	54	9%	0.085	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	150.6	178.8	-57.4	0	0	0	0	110.3	L105 Q106 I108 T132 T134 M136 I137	V98-L105 WeakPolarHBondContact O-CA 3.48Å; V98-Q106 PolarHBondContact N-O 3.22Å; V98-Q106 PolarHBondContact O-N 3.28Å; V98-I108 HydrophobicContact CG1-CD1 3.53Å; V98-I108 HydrophobicContact CG1-CG1 4.05Å; V98-I108 HydrophobicContact CG2-CD1 4.36Å; V98-I108 HydrophobicContact CG2-CG1 4.45Å; V98-I108 HydrophobicContact CG2-CG2 3.5Å; V98-T132 HydrophobicContact CG2-CG2 4.1Å; V98-T134 HydrophobicContact CB-CG2 4.26Å; V98-T134 HydrophobicContact CG1-CG2 4.33Å; V98-M136 WeakPolarHBondContact CA-O 3.36Å; V98-I137 HydrophobicContact CG1-CG1 4.14Å
99	G	95.6	Very high	95.9	Very high	9 Å²	9	57 Å²	57	9%	0.093	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-174.8	-175.9	178.9	0	0	0	0	0	113	T134 F135 M136	G99-T134 PolarHBondContact N-OG1 2.76Å; G99-T134 PolarHBondContact O-OG1 2.82Å; G99-F135 PolarHBondContact O-N 3.08Å; G99-M136 PolarHBondContact N-O 3.38Å; G99-M136 VanDerWaalsContact N-O 3.08Å; G99-M136 PolarHBondContact O-N 2.94Å
100	N	93.5	Very high	95.9	Very high	90 Å²	90	56.9 Å²	56.9	48%	0.481	27%	0.272	S	S	.	.	S	Bend	trans	-88.6	-28	174.7	-54.4	-44.3	0	0	0	112.4	N104 F135	N100-N104 PolarHBondContact N-OD1 3.32Å; N100-F135 HydrophobicContact CB-CD2 4.28Å
101	N	91.4	Very high	95.8	Very high	70 Å²	70	58.2 Å²	58.2	37%	0.374	28%	0.279	S	S	.	.	S	Bend	trans	-153.6	177.6	179.8	61.8	48.7	0	0	0	110.5	H103 N104	N101-H103 PolarHBondContact O-N 2.91Å; N101-H103 PolarHBondContact OD1-N 3.38Å; N101-N104 VanDerWaalsContact CG-ND2 3.3Å; N101-N104 PolarHBondContact N-OD1 3.12Å; N101-N104 PolarHBondContact ND2-ND2 3.14Å; N101-N104 VanDerWaalsContact ND2-ND2 3.13Å; N101-N104 PolarHBondContact O-N 3.09Å; N101-N104 PolarHBondContact O-OD1 3.05Å; N101-N104 VanDerWaalsContact OD1-CG 3.22Å; N101-N104 PolarHBondContact OD1-N 3.46Å; N101-N104 PolarHBondContact OD1-ND2 3.15Å; N101-N104 PolarHBondContact OD1-OD1 3.22Å
102	F	91.9	Very high	95.8	Very high	104 Å²	104	64.8 Å²	64.8	46%	0.456	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-25.9	-178	-70.2	-82.2	0	0	0	114.8	N65 M136	N65-F102 HydrophobicContact CB-CE1 4.22Å; F102-M136 HydrophobicContact CD1-CE 3.34Å; F102-M136 HydrophobicContact CD1-SD 4.05Å; F102-M136 HydrophobicContact CD2-SD 4.49Å; F102-M136 HydrophobicContact CE1-CE 3.24Å; F102-M136 HydrophobicContact CE1-SD 4.21Å; F102-M136 HydrophobicContact CG-CE 4.07Å; F102-M136 HydrophobicContact CG-SD 4.19Å; F102-M136 HydrophobicContact CZ-CE 3.93Å
103	H	91.5	Very high	95.7	Very high	185 Å²	185	63.9 Å²	63.9	86%	0.856	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.4	-11.6	-174.3	-54.1	-55.8	0	0	0	113.5	N101	N101-H103 PolarHBondContact O-N 2.91Å; N101-H103 PolarHBondContact OD1-N 3.38Å
104	N	94.7	Very high	95.6	Very high	59 Å²	59	63.6 Å²	63.6	32%	0.316	31%	0.306	S	S	.	.	S	Bend	trans	-122	28	-177.4	65.9	24.6	0	0	0	113.3	N100 N101 Q106	N100-N104 PolarHBondContact N-OD1 3.32Å; N101-N104 VanDerWaalsContact CG-ND2 3.3Å; N101-N104 PolarHBondContact N-OD1 3.12Å; N101-N104 PolarHBondContact ND2-ND2 3.14Å; N101-N104 VanDerWaalsContact ND2-ND2 3.13Å; N101-N104 PolarHBondContact O-N 3.09Å; N101-N104 PolarHBondContact O-OD1 3.05Å; N101-N104 VanDerWaalsContact OD1-CG 3.22Å; N101-N104 PolarHBondContact OD1-N 3.46Å; N101-N104 PolarHBondContact OD1-ND2 3.15Å; N101-N104 PolarHBondContact OD1-OD1 3.22Å; N104-Q106 PolarHBondContact O-N 3.43Å
105	L	95.8	Very high	95.5	Very high	34 Å²	34	65.2 Å²	65.2	18%	0.178	31%	0.314	C	S	.	.			trans	-69.5	126.7	173.7	-66.4	174.2	0	0	0	110.2	R97 V98 M136 Q138	R97-L105 HydrophobicContact CB-CB 4.14Å; V98-L105 WeakPolarHBondContact O-CA 3.48Å; L105-M136 HydrophobicContact CD1-CE 4.06Å; L105-M136 HydrophobicContact CD1-SD 4.48Å; L105-M136 HydrophobicContact CD2-CB 4.39Å; L105-M136 HydrophobicContact CD2-CE 4.39Å; L105-M136 HydrophobicContact CD2-CG 4.08Å; L105-M136 HydrophobicContact CD2-SD 3.99Å; L105-Q138 HydrophobicContact CD1-CB 3.71Å; L105-Q138 VanDerWaalsContact CD1-CD 3.43Å; L105-Q138 HydrophobicContact CD1-CG 4.2Å; L105-Q138 HydrophobicContact CD2-CB 4.4Å
106	Q	95.4	Very high	95.5	Very high	146 Å²	146	65.2 Å²	65.2	68%	0.682	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.8	133.8	173.2	-66.9	-173.7	-17.9	0	0	109.6	R97 V98 N104 I108	R97-Q106 CarbonylContact C-O 3.58Å; R97-Q106 WeakPolarHBondContact CA-O 3.32Å; V98-Q106 PolarHBondContact N-O 3.22Å; V98-Q106 PolarHBondContact O-N 3.28Å; N104-Q106 PolarHBondContact O-N 3.43Å; Q106-I108 PolarHBondContact O-N 3.25Å
107	E	95.8	Very high	95.4	Very high	96 Å²	96	67.6 Å²	67.6	45%	0.449	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	123.6	172.8	-174.7	174.4	108	0	0	109.9	S95 R97	S95-E107 VanDerWaalsContact CB-OE2 3.25Å; S95-E107 WeakPolarHBondContact CB-OE2 3.23Å; S95-E107 PolarHBondContact OG-OE2 3.47Å; R97-E107 HydrophobicContact CG-CB 4.18Å
108	I	94.9	Very high	95.3	Very high	61 Å²	61	65.1 Å²	65.1	31%	0.313	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	-23.9	175.6	54.2	162.5	0	0	0	111.9	V96 V98 Q106 L124	V96-I108 HydrophobicContact CG1-CD1 4.42Å; V96-I108 HydrophobicContact CG1-CG1 4.39Å; V96-I108 VanDerWaalsContact O-CG1 3.3Å; V96-I108 WeakPolarHBondContact O-CG1 3.41Å; V96-I108 PolarHBondContact O-N 2.78Å; V98-I108 HydrophobicContact CG1-CD1 3.53Å; V98-I108 HydrophobicContact CG1-CG1 4.05Å; V98-I108 HydrophobicContact CG2-CD1 4.36Å; V98-I108 HydrophobicContact CG2-CG1 4.45Å; V98-I108 HydrophobicContact CG2-CG2 3.5Å; Q106-I108 PolarHBondContact O-N 3.25Å; I108-L124 HydrophobicContact CD1-CB 4.46Å; I108-L124 HydrophobicContact CD1-CD2 3.94Å
109	R	94.9	Very high	95.4	Very high	96 Å²	96	65.7 Å²	65.7	36%	0.362	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157	136.2	-177.3	-159.3	153.3	-175.9	153.7	4.1	111.4	V96 L111 V122 P123	V96-R109 PolarHBondContact N-O 3.11Å; V96-R109 PolarHBondContact O-N 3.09Å; R109-L111 HydrophobicContact CG-CD2 4.33Å; R109-V122 HydrophobicContact CG-CG1 4.47Å; R109-P123 PolarHBondContact NH1-O 2.8Å; R109-P123 VanDerWaalsContact NH1-O 3.11Å
110	Q	96.7	Very high	95.5	Very high	79 Å²	79	66 Å²	66	37%	0.369	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	141.3	168.9	-163.8	-175.7	-89.4	0	0	109	I94	I94-Q110 CarbonylContact O-C 3.5Å; I94-Q110 WeakPolarHBondContact O-CA 3.48Å
111	L	96.4	Very high	95.6	Very high	28 Å²	28	64.6 Å²	64.6	15%	0.147	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	132.8	-179.5	-56.5	166.3	0	0	0	108.6	K93 I94 R109 L113 V122	K93-L111 WeakPolarHBondContact CA-O 3.46Å; I94-L111 HydrophobicContact CB-CB 4.46Å; I94-L111 PolarHBondContact N-O 3.3Å; I94-L111 PolarHBondContact O-N 3.4Å; R109-L111 HydrophobicContact CG-CD2 4.33Å; L111-L113 HydrophobicContact CB-CD2 4.47Å; L111-V122 HydrophobicContact CD1-CB 4.2Å; L111-V122 HydrophobicContact CD1-CG1 3.83Å; L111-V122 HydrophobicContact CD1-CG2 3.32Å; L111-V122 HydrophobicContact CD2-CG1 4.41Å; L111-V122 HydrophobicContact CG-CG1 4.48Å
112	E	97.4	Very high	95.8	Very high	138 Å²	138	61.3 Å²	61.3	65%	0.645	30%	0.296	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.8	122.1	167	-67	-175.4	173.5	0	0	107.5	S92 K93	S92-E112 WeakPolarHBondContact O-CA 3.42Å; K93-E112 IonicContact NZ-OE1 3.97Å
113	L	96.2	Very high	96	Very high	8 Å²	8	58.7 Å²	58.7	4%	0.042	29%	0.29	C	S	.	.			trans	-110.1	130.1	-174.9	-56.9	174.9	0	0	0	108.2	T7 P91 S92 I94 L111 P116 I120 H145	T7-L113 HydrophobicContact CG2-CD2 4.1Å; T7-L113 WeakPolarHBondContact OG1-CA 3.5Å; P91-L113 HydrophobicContact CB-CD1 4.32Å; S92-L113 PolarHBondContact O-N 3.36Å; I94-L113 HydrophobicContact CD1-CD1 3.68Å; I94-L113 HydrophobicContact CG1-CD1 4.1Å; L111-L113 HydrophobicContact CB-CD2 4.47Å; L113-P116 HydrophobicContact CB-CG 4.16Å; L113-P116 HydrophobicContact CD1-CG 4.5Å; L113-I120 HydrophobicContact CD1-CD1 3.64Å; L113-I120 HydrophobicContact CD2-CD1 3.82Å; L113-I120 HydrophobicContact CD2-CG1 4.24Å; L113-I120 HydrophobicContact CD2-CG2 4.09Å; L113-I120 HydrophobicContact CG-CD1 4.37Å; L113-H145 PolarHBondContact O-CE1 3.44Å; L113-H145 PolarHBondContact O-NE2 3.29Å
114	V	97	Very high	96.1	Very high	59 Å²	59	49.9 Å²	49.9	36%	0.358	25%	0.249	S	C	.	.	S	Bend	trans	-120.9	105.2	179.5	-179.1	0	0	0	0	107.4	N5 K6 T7	N5-V114 WeakPolarHBondContact O-CB 3.47Å; K6-V114 CarbonylContact C-O 3.52Å; K6-V114 VanDerWaalsContact CA-O 3.3Å; K6-V114 WeakPolarHBondContact CA-O 3.3Å; T7-V114 PolarHBondContact N-O 2.66Å; T7-V114 PolarHBondContact OG1-N 3.17Å
115	E	96.1	Very high	95.8	Very high	35 Å²	35	49.5 Å²	49.5	16%	0.164	25%	0.249	C	C	.	.	S	Bend	trans	43.5	56.1	-177.4	-57.6	-175.3	-157	0	0	113.5	T3 K6 Y83 H145	T3-E115 WeakPolarHBondContact CG2-OE1 3.45Å; T3-E115 PolarHBondContact OG1-OE1 3.29Å; T3-E115 PolarHBondContact OG1-OE2 2.99Å; T3-E115 VanDerWaalsContact OG1-OE2 3.08Å; K6-E115 HydrophobicContact CD-CB 4.18Å; K6-E115 WeakPolarHBondContact CE-OE2 3.45Å; K6-E115 HydrophobicContact CG-CB 4.3Å; K6-E115 IonicContact NZ-OE2 2.63Å; K6-E115 PolarHBondContact NZ-OE2 3.15Å; Y83-E115 HydrophobicContact CD1-CB 3.78Å; Y83-E115 HydrophobicContact CD1-CG 3.59Å; Y83-E115 HydrophobicContact CD2-CB 4.39Å; Y83-E115 HydrophobicContact CD2-CG 4.14Å; Y83-E115 HydrophobicContact CE1-CB 4.37Å; Y83-E115 HydrophobicContact CE1-CG 3.66Å; Y83-E115 HydrophobicContact CE2-CG 4.2Å; Y83-E115 HydrophobicContact CG-CB 3.79Å; Y83-E115 HydrophobicContact CG-CG 3.83Å; E115-H145 PolarHBondContact N-NE2 2.74Å
116	P	96.7	Very high	95.2	Very high	1 Å²	1	50.7 Å²	50.7	1%	0.006	26%	0.255	C	S	.	.			trans	-59.9	144.9	178.4	29.1	-36.1	0	0	0	110.2	A81 D82 Y83 T90 L113 I120	A81-P116 HydrophobicContact CB-CG 4.07Å; D82-P116 CarbonylContact C-O 3.48Å; D82-P116 WeakPolarHBondContact CA-O 3.36Å; Y83-P116 WeakPolarHBondContact CB-O 3.41Å; Y83-P116 PolarHBondContact N-O 3.09Å; T90-P116 HydrophobicContact CG2-CG 3.55Å; L113-P116 HydrophobicContact CB-CG 4.16Å; L113-P116 HydrophobicContact CD1-CG 4.5Å; P116-I120 HydrophobicContact CB-CD1 3.96Å; P116-I120 HydrophobicContact CB-CG1 4.41Å; P116-I120 HydrophobicContact CG-CD1 4.49Å
117	S	96.1	Very high	94.5	Very high	49 Å²	49	51.7 Å²	51.7	34%	0.343	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	42.4	-176.7	47.6	0	0	0	0	112
118	G	96.8	Very high	94	Very high	7 Å²	7	54.2 Å²	54.2	7%	0.072	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	162.2	-151.9	-179.1	0	0	0	0	0	114.3	A81	A81-G118 PolarHBondContact N-O 2.91Å; A81-G118 PolarHBondContact O-N 3.46Å
119	W	97.8	Very high	93.5	Very high	26 Å²	26	60.2 Å²	60.2	10%	0.098	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	132.1	-179.3	-70.9	102.5	0	0	0	112.1	G10 P13 L50 C78 I79 Y80 Q155 K157	G10-W119 WeakPolarHBondContact CA-O 3.42Å; G10-W119 PolarHBondContact N-O 3.13Å; P13-W119 VanDerWaalsContact CD-CD1 3.46Å; P13-W119 VanDerWaalsContact CD-CG 3.4Å; P13-W119 HydrophobicContact CG-CB 4.46Å; P13-W119 HydrophobicContact CG-CD2 3.38Å; P13-W119 HydrophobicContact CG-CE3 3.48Å; P13-W119 VanDerWaalsContact CG-CE3 3.48Å; P13-W119 HydrophobicContact CG-CG 3.87Å; P13-W119 HydrophobicContact CG-CH2 4.05Å; P13-W119 HydrophobicContact CG-CZ2 4Å; P13-W119 HydrophobicContact CG-CZ3 3.81Å; L50-W119 HydrophobicContact CD2-CZ2 4.06Å; C78-W119 HydrophobicContact CB-CE3 3.99Å; C78-W119 HydrophobicContact CB-CZ3 4.16Å; I79-W119 CarbonylContact O-C 3.54Å; Y80-W119 AromaticContact CD2-CD1 3.76Å; Y80-W119 AromaticContact CD2-CD2 3.66Å; Y80-W119 HydrophobicContact CD2-CD2 3.66Å; Y80-W119 AromaticContact CD2-CE2 3.61Å; Y80-W119 HydrophobicContact CD2-CE3 4.28Å; Y80-W119 AromaticContact CD2-CG 3.8Å; Y80-W119 HydrophobicContact CD2-CG 3.8Å; Y80-W119 HydrophobicContact CD2-CZ2 4.22Å; Y80-W119 AromaticContact CD2-NE1 3.63Å; Y80-W119 HydrophobicContact CE2-CG 4.46Å; Y80-W119 AromaticContact CE2-NE1 3.98Å; Y80-W119 HydrophobicContact CG-CD2 4.4Å; W119-Q155 HydrophobicContact CH2-CB 3.77Å; W119-Q155 HydrophobicContact CH2-CG 3.54Å; W119-Q155 HydrophobicContact CZ2-CG 4.38Å; W119-Q155 HydrophobicContact CZ3-CB 4.24Å; W119-Q155 HydrophobicContact CZ3-CG 4.29Å; W119-K157 HydrophobicContact CH2-CD 4.23Å; W119-K157 HydrophobicContact CH2-CG 4.18Å; W119-K157 HydrophobicContact CZ3-CG 4.35Å
120	I	97.8	Very high	93.2	Very high	15 Å²	15	62.1 Å²	62.1	8%	0.077	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	119.5	175.5	-58.9	152.5	0	0	0	107.1	C78 I79 A81 L113 P116 V122	C78-I120 VanDerWaalsContact CA-O 3.32Å; C78-I120 WeakPolarHBondContact CA-O 3.4Å; I79-I120 PolarHBondContact N-O 2.9Å; I79-I120 PolarHBondContact O-N 3.23Å; A81-I120 HydrophobicContact CB-CD1 4.12Å; L113-I120 HydrophobicContact CD1-CD1 3.64Å; L113-I120 HydrophobicContact CD2-CD1 3.82Å; L113-I120 HydrophobicContact CD2-CG1 4.24Å; L113-I120 HydrophobicContact CD2-CG2 4.09Å; L113-I120 HydrophobicContact CG-CD1 4.37Å; P116-I120 HydrophobicContact CB-CD1 3.96Å; P116-I120 HydrophobicContact CB-CG1 4.41Å; P116-I120 HydrophobicContact CG-CD1 4.49Å; I120-V122 HydrophobicContact CG2-CG2 4.17Å
121	H	96.4	Very high	93	Very high	61 Å²	61	60.5 Å²	60.5	28%	0.282	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	121.7	178.9	-71	-113.9	0	0	0	109.8	A11 T76 C78 P123	A11-H121 PolarHBondContact O-NE2 3.19Å; T76-H121 HydrophobicContact CG2-CB 4.37Å; C78-H121 VanDerWaalsContact SG-CE1 3.54Å; C78-H121 PolarHBondContact SG-ND1 2.91Å; C78-H121 VanDerWaalsContact SG-ND1 3.38Å; H121-P123 WeakPolarHBondContact O-CD 3.43Å
122	V	96.3	Very high	92.9	Very high	0 Å²	0	60 Å²	60	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	104.6	-176.8	-168.9	0	0	0	0	108.6	L77 I79 V96 R109 L111 I120 L124	L77-V122 HydrophobicContact CB-CB 4.22Å; L77-V122 PolarHBondContact N-O 2.84Å; L77-V122 WeakPolarHBondContact O-CB 3.49Å; L77-V122 PolarHBondContact O-N 3.47Å; I79-V122 HydrophobicContact CD1-CG2 4.49Å; V96-V122 HydrophobicContact CG2-CG1 4.21Å; R109-V122 HydrophobicContact CG-CG1 4.47Å; L111-V122 HydrophobicContact CD1-CB 4.2Å; L111-V122 HydrophobicContact CD1-CG1 3.83Å; L111-V122 HydrophobicContact CD1-CG2 3.32Å; L111-V122 HydrophobicContact CD2-CG1 4.41Å; L111-V122 HydrophobicContact CG-CG1 4.48Å; I120-V122 HydrophobicContact CG2-CG2 4.17Å; V122-L124 HydrophobicContact CG1-CD2 4.36Å; V122-L124 PolarHBondContact O-N 2.82Å
123	P	95	Very high	92.8	Very high	50 Å²	50	61 Å²	61	33%	0.325	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	122.9	174.2	-15	26.3	0	0	0	110.4	R109 H121 T125	R109-P123 PolarHBondContact NH1-O 2.8Å; R109-P123 VanDerWaalsContact NH1-O 3.11Å; H121-P123 WeakPolarHBondContact O-CD 3.43Å; P123-T125 HydrophobicContact CB-CG2 4.47Å; P123-T125 PolarHBondContact O-N 3.45Å
124	L	93.9	Very high	92.8	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	30%	0.303	C	S	.	.			trans	-97.3	63.5	176.4	-55.9	-178.3	0	0	0	109.3	V74 K75 L77 V96 I108 V122 T132 I137	V74-L124 HydrophobicContact CB-CD1 3.92Å; V74-L124 HydrophobicContact CG2-CB 4.15Å; V74-L124 HydrophobicContact CG2-CD1 3.74Å; K75-L124 PolarHBondContact O-N 2.86Å; L77-L124 HydrophobicContact CB-CD1 3.92Å; L77-L124 HydrophobicContact CB-CD2 4.19Å; L77-L124 HydrophobicContact CB-CG 4.11Å; V96-L124 HydrophobicContact CG1-CD2 3.69Å; I108-L124 HydrophobicContact CD1-CB 4.46Å; I108-L124 HydrophobicContact CD1-CD2 3.94Å; V122-L124 HydrophobicContact CG1-CD2 4.36Å; V122-L124 PolarHBondContact O-N 2.82Å; L124-T132 PolarHBondContact O-N 3.41Å; L124-T132 PolarHBondContact O-OG1 2.54Å; L124-T132 VanDerWaalsContact O-OG1 3.1Å; L124-I137 HydrophobicContact CD1-CD1 3.93Å
125	T	88.9	Confident	92.8	Very high	51 Å²	51	61.7 Å²	61.7	31%	0.313	30%	0.302	S	S	.	.	B	Isolated β-bridge	trans	-102.9	144.8	179.6	54.7	0	0	0	0	111.2	P123 K130	P123-T125 HydrophobicContact CB-CG2 4.47Å; P123-T125 PolarHBondContact O-N 3.45Å; T125-K130 CarbonylContact C-O 3.6Å; T125-K130 WeakPolarHBondContact CA-O 3.32Å
126	D	81.8	Confident	92.9	Very high	59 Å²	59	60.1 Å²	60.1	32%	0.316	30%	0.295	S	S	.	.			trans	-72	179.5	168.6	70.4	11.7	0	0	0	112.4	H128 K129 K130	D126-H128 PolarHBondContact O-N 2.97Å; D126-H128 VanDerWaalsContact OD1-CA 3.25Å; D126-H128 WeakPolarHBondContact OD1-CA 3.28Å; D126-H128 WeakPolarHBondContact OD1-CB 3.32Å; D126-H128 PolarHBondContact OD1-N 2.64Å; D126-K129 PolarHBondContact O-N 3.26Å; D126-K129 PolarHBondContact OD1-N 3.48Å; D126-K129 VanDerWaalsContact OD1-N 3.12Å; D126-K130 PolarHBondContact N-O 3.33Å; D126-K130 PolarHBondContact OD1-N 3.08Å
127	N	81.1	Confident	93	Very high	166 Å²	166	60 Å²	60	89%	0.888	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-17.9	177.2	-65.2	-15.9	0	0	0	113.6
128	H	84.8	Confident	93.1	Very high	150 Å²	150	58.4 Å²	58.4	69%	0.694	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100	15.1	178.7	-58.4	-70.3	0	0	0	112.7	D126 K130	D126-H128 PolarHBondContact O-N 2.97Å; D126-H128 VanDerWaalsContact OD1-CA 3.25Å; D126-H128 WeakPolarHBondContact OD1-CA 3.28Å; D126-H128 WeakPolarHBondContact OD1-CB 3.32Å; D126-H128 PolarHBondContact OD1-N 2.64Å; H128-K130 HydrophobicContact CB-CG 4.47Å; H128-K130 PolarHBondContact O-N 3.01Å
129	K	85.1	Confident	93.2	Very high	186 Å²	186	58 Å²	58	81%	0.809	28%	0.278	S	S	*	.	S	Bend	trans	60.4	20	-176.8	-57.2	177.7	178.9	178	0	113.5	D126	D126-K129 PolarHBondContact O-N 3.26Å; D126-K129 PolarHBondContact OD1-N 3.48Å; D126-K129 VanDerWaalsContact OD1-N 3.12Å
130	K	89.3	Confident	93.2	Very high	136 Å²	136	56.8 Å²	56.8	59%	0.591	27%	0.273	S	S	*	.	P	Polyproline II helix	trans	-95.5	148.2	175.7	-64.6	179.7	180	177.3	0	110.2	T125 D126 H128 T132	T125-K130 CarbonylContact C-O 3.6Å; T125-K130 WeakPolarHBondContact CA-O 3.32Å; D126-K130 PolarHBondContact N-O 3.33Å; D126-K130 PolarHBondContact OD1-N 3.08Å; H128-K130 HydrophobicContact CB-CG 4.47Å; H128-K130 PolarHBondContact O-N 3.01Å; K130-T132 PolarHBondContact O-N 3.32Å
131	P	92.9	Very high	93.2	Very high	45 Å²	45	56.1 Å²	56.1	29%	0.292	27%	0.27	S	S	.	.	B	Isolated β-bridge	trans	-53.7	131.4	173.4	-28.3	37.4	0	0	0	111.9	T73 V74 K75 P161	T73-P131 HydrophobicContact CG2-CB 3.52Å; T73-P131 HydrophobicContact CG2-CG 4.47Å; V74-P131 CarbonylContact O-C 3.56Å; V74-P131 WeakPolarHBondContact O-CA 3.42Å; V74-P131 VanDerWaalsContact O-CB 3.31Å; V74-P131 WeakPolarHBondContact O-CB 3.31Å; K75-P131 HydrophobicContact CB-CB 4.25Å; K75-P131 HydrophobicContact CB-CG 4.26Å; K75-P131 HydrophobicContact CG-CG 4.38Å; P131-P161 HydrophobicContact CB-CG 4.24Å; P131-P161 HydrophobicContact CG-CG 4.12Å
132	T	94.4	Very high	93.3	Very high	17 Å²	17	55.4 Å²	55.4	10%	0.104	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	143.2	179.5	-56	0	0	0	0	110.5	T73 V74 V98 L124 K130	T73-T132 WeakPolarHBondContact CA-O 3.42Å; V74-T132 VanDerWaalsContact CG2-O 3.29Å; V74-T132 WeakPolarHBondContact CG2-O 3.37Å; V74-T132 PolarHBondContact N-O 2.74Å; V74-T132 PolarHBondContact O-N 3.17Å; V74-T132 VanDerWaalsContact O-N 3.16Å; V98-T132 HydrophobicContact CG2-CG2 4.1Å; L124-T132 PolarHBondContact O-N 3.41Å; L124-T132 PolarHBondContact O-OG1 2.54Å; L124-T132 VanDerWaalsContact O-OG1 3.1Å; K130-T132 PolarHBondContact O-N 3.32Å
133	R	95.1	Very high	93.4	Very high	160 Å²	160	56.7 Å²	56.7	60%	0.604	28%	0.278	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.4	111.1	178.8	-157.5	174.4	154.7	-149.4	-4.1	109.5	K71 T72	K71-R133 WeakPolarHBondContact CE-O 3.25Å; K71-R133 HydrophobicContact CG-CG 4.16Å; T72-R133 WeakPolarHBondContact O-CA 3.44Å
134	T	96.1	Very high	93.6	Very high	4 Å²	4	54.5 Å²	54.5	3%	0.025	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	160.3	-167.1	-169.3	0	0	0	0	112	T72 V74 V98 G99 M136 I137	T72-T134 PolarHBondContact N-O 3.37Å; T72-T134 PolarHBondContact O-N 2.67Å; V74-T134 HydrophobicContact CG2-CG2 4.18Å; V98-T134 HydrophobicContact CB-CG2 4.26Å; V98-T134 HydrophobicContact CG1-CG2 4.33Å; G99-T134 PolarHBondContact N-OG1 2.76Å; G99-T134 PolarHBondContact O-OG1 2.82Å; T134-M136 WeakPolarHBondContact CG2-O 3.49Å; T134-M136 PolarHBondContact OG1-N 2.76Å; T134-M136 PolarHBondContact OG1-O 3.45Å; T134-I137 HydrophobicContact CG2-CD1 4.23Å; T134-I137 HydrophobicContact CG2-CG1 3.66Å
135	F	97.3	Very high	93.7	Very high	77 Å²	77	55.7 Å²	55.7	34%	0.338	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	-30.1	169.1	-74.2	-88.1	0	0	0	111.8	F68 K71 G99 N100	F68-F135 PolarHBondContact N-O 3.12Å; K71-F135 HydrophobicContact CB-CD1 4.4Å; K71-F135 HydrophobicContact CB-CD2 4.1Å; K71-F135 HydrophobicContact CB-CE1 4.05Å; K71-F135 HydrophobicContact CB-CE2 3.71Å; K71-F135 HydrophobicContact CB-CG 4.44Å; K71-F135 HydrophobicContact CB-CZ 3.68Å; K71-F135 HydrophobicContact CD-CD2 4.26Å; K71-F135 HydrophobicContact CD-CE2 3.85Å; K71-F135 HydrophobicContact CG-CD2 3.82Å; K71-F135 HydrophobicContact CG-CE2 3.71Å; K71-F135 HydrophobicContact CG-CG 4.42Å; K71-F135 HydrophobicContact CG-CZ 4.23Å; K71-F135 VanDerWaalsContact N-CE1 3.29Å; G99-F135 PolarHBondContact O-N 3.08Å; N100-F135 HydrophobicContact CB-CD2 4.28Å
136	M	97.6	Very high	94	Very high	2 Å²	2	59.3 Å²	59.3	1%	0.01	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	144.7	-175.4	-175.1	177	173.9	0	0	110.9	N65 I66 Q67 V98 G99 F102 L105 T134 Q138	N65-M136 HydrophobicContact CB-CE 3.79Å; N65-M136 VanDerWaalsContact OD1-CE 3.28Å; N65-M136 WeakPolarHBondContact OD1-CE 3.45Å; I66-M136 CarbonylContact O-C 3.58Å; I66-M136 WeakPolarHBondContact O-CA 3.35Å; Q67-M136 HydrophobicContact CG-CB 4.43Å; Q67-M136 HydrophobicContact CG-CG 3.93Å; Q67-M136 HydrophobicContact CG-SD 4.16Å; V98-M136 WeakPolarHBondContact CA-O 3.36Å; G99-M136 PolarHBondContact N-O 3.38Å; G99-M136 VanDerWaalsContact N-O 3.08Å; G99-M136 PolarHBondContact O-N 2.94Å; F102-M136 HydrophobicContact CD1-CE 3.34Å; F102-M136 HydrophobicContact CD1-SD 4.05Å; F102-M136 HydrophobicContact CD2-SD 4.49Å; F102-M136 HydrophobicContact CE1-CE 3.24Å; F102-M136 HydrophobicContact CE1-SD 4.21Å; F102-M136 HydrophobicContact CG-CE 4.07Å; F102-M136 HydrophobicContact CG-SD 4.19Å; F102-M136 HydrophobicContact CZ-CE 3.93Å; L105-M136 HydrophobicContact CD1-CE 4.06Å; L105-M136 HydrophobicContact CD1-SD 4.48Å; L105-M136 HydrophobicContact CD2-CB 4.39Å; L105-M136 HydrophobicContact CD2-CE 4.39Å; L105-M136 HydrophobicContact CD2-CG 4.08Å; L105-M136 HydrophobicContact CD2-SD 3.99Å; T134-M136 WeakPolarHBondContact CG2-O 3.49Å; T134-M136 PolarHBondContact OG1-N 2.76Å; T134-M136 PolarHBondContact OG1-O 3.45Å; M136-Q138 HydrophobicContact CE-CB 4.41Å
137	I	98.1	Very high	94.6	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	137.6	167.7	-55.7	174.9	0	0	0	107.3	I66 F68 V74 V96 R97 V98 L124 T134 I158	I66-I137 HydrophobicContact CB-CB 4.31Å; I66-I137 PolarHBondContact N-O 3.05Å; I66-I137 PolarHBondContact O-N 3.26Å; F68-I137 HydrophobicContact CE2-CD1 4.06Å; F68-I137 HydrophobicContact CE2-CG1 4.39Å; V74-I137 HydrophobicContact CB-CD1 4.25Å; V74-I137 HydrophobicContact CG1-CD1 4Å; V74-I137 HydrophobicContact CG2-CD1 3.93Å; V96-I137 HydrophobicContact CG1-CG2 4.02Å; R97-I137 CarbonylContact O-C 3.55Å; R97-I137 VanDerWaalsContact O-CA 3.31Å; R97-I137 WeakPolarHBondContact O-CA 3.18Å; V98-I137 HydrophobicContact CG1-CG1 4.14Å; L124-I137 HydrophobicContact CD1-CD1 3.93Å; T134-I137 HydrophobicContact CG2-CD1 4.23Å; T134-I137 HydrophobicContact CG2-CG1 3.66Å; I137-I158 HydrophobicContact CD1-CD1 3.24Å
138	Q	98.5	Very high	95.3	Very high	14 Å²	14	56.4 Å²	56.4	7%	0.065	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	125.5	171.7	178.2	178.1	90.5	0	0	108.7	L63 V64 N65 R97 L105 M136	L63-Q138 HydrophobicContact CD2-CG 4.27Å; V64-Q138 CarbonylContact O-C 3.59Å; V64-Q138 WeakPolarHBondContact O-CA 3.49Å; N65-Q138 WeakPolarHBondContact OD1-CG 3.25Å; N65-Q138 PolarHBondContact OD1-NE2 2.95Å; R97-Q138 HydrophobicContact CB-CB 4.32Å; R97-Q138 PolarHBondContact N-O 2.82Å; R97-Q138 PolarHBondContact O-N 2.82Å; L105-Q138 HydrophobicContact CD1-CB 3.71Å; L105-Q138 VanDerWaalsContact CD1-CD 3.43Å; L105-Q138 HydrophobicContact CD1-CG 4.2Å; L105-Q138 HydrophobicContact CD2-CB 4.4Å; M136-Q138 HydrophobicContact CE-CB 4.41Å
139	I	98.5	Very high	95.9	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	120	170.6	-52.6	164.6	0	0	0	105.8	L63 V64 I66 L77 I79 I94 I156	L63-I139 CarbonylContact C-O 3.59Å; L63-I139 WeakPolarHBondContact CA-O 3.29Å; V64-I139 HydrophobicContact CB-CB 4.17Å; V64-I139 HydrophobicContact CB-CD1 4.35Å; V64-I139 PolarHBondContact N-O 2.78Å; V64-I139 PolarHBondContact O-N 3.46Å; I66-I139 HydrophobicContact CD1-CD1 4.08Å; L77-I139 HydrophobicContact CD1-CD1 3.88Å; L77-I139 HydrophobicContact CD2-CD1 3.62Å; L77-I139 HydrophobicContact CD2-CG1 3.76Å; L77-I139 HydrophobicContact CG-CD1 4.32Å; I79-I139 HydrophobicContact CD1-CD1 4.47Å; I79-I139 HydrophobicContact CD1-CG2 4.14Å; I94-I139 HydrophobicContact CG2-CG2 3.55Å; I139-I156 HydrophobicContact CD1-CD1 3.84Å; I139-I156 HydrophobicContact CD1-CG2 4.13Å
140	A	98.4	Very high	96.5	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	112.9	-179.6	0	0	0	0	0	109.4	P61 H62 L63 I94 S95 L142	P61-A140 HydrophobicContact CB-CB 4.45Å; H62-A140 WeakPolarHBondContact O-CA 3.13Å; L63-A140 HydrophobicContact CD2-CB 3.52Å; I94-A140 CarbonylContact C-O 3.53Å; I94-A140 WeakPolarHBondContact CA-O 3.46Å; S95-A140 PolarHBondContact N-O 2.84Å; S95-A140 PolarHBondContact O-N 2.61Å; A140-L142 HydrophobicContact CB-CD2 3.99Å; A140-L142 PolarHBondContact O-N 3.13Å
141	V	98.5	Very high	96.9	Very high	1 Å²	1	43 Å²	43	1%	0.006	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	103.5	168.8	-177.6	0	0	0	0	107.3	P61 H62 P91 N144 T151 M153	P61-V141 VanDerWaalsContact CA-O 3.23Å; P61-V141 WeakPolarHBondContact CA-O 3.25Å; P61-V141 WeakPolarHBondContact CB-O 3.35Å; H62-V141 HydrophobicContact CB-CB 4.28Å; H62-V141 PolarHBondContact N-O 2.8Å; H62-V141 VanDerWaalsContact N-O 3.08Å; H62-V141 PolarHBondContact O-N 2.81Å; P91-V141 HydrophobicContact CB-CG1 3.96Å; P91-V141 HydrophobicContact CB-CG2 4.43Å; P91-V141 HydrophobicContact CG-CG1 4.38Å; P91-V141 HydrophobicContact CG-CG2 4.37Å; V141-N144 WeakPolarHBondContact CG1-OD1 3.46Å; V141-T151 HydrophobicContact CB-CG2 4.43Å; V141-T151 HydrophobicContact CG1-CG2 4.46Å; V141-T151 HydrophobicContact CG2-CG2 4.19Å; V141-M153 HydrophobicContact CG2-SD 4.2Å
142	L	98.3	Very high	97.1	Very high	46 Å²	46	41.5 Å²	41.5	24%	0.241	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	-31.6	-176.1	-57	-174.9	0	0	0	112.1	Q60 P61 K93 A140	Q60-L142 PolarHBondContact OE1-O 2.9Å; P61-L142 HydrophobicContact CB-CD2 3.88Å; K93-L142 HydrophobicContact CB-CB 4.23Å; K93-L142 HydrophobicContact CD-CB 4.32Å; K93-L142 HydrophobicContact CD-CD1 4.24Å; K93-L142 HydrophobicContact CG-CB 4.17Å; K93-L142 HydrophobicContact CG-CD1 4.2Å; K93-L142 PolarHBondContact O-N 2.91Å; A140-L142 HydrophobicContact CB-CD2 3.99Å; A140-L142 PolarHBondContact O-N 3.13Å
143	A	98.1	Very high	97.3	Very high	27 Å²	27	40.7 Å²	40.7	22%	0.223	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	155.1	177.6	0	0	0	0	0	110.3	S92 K93	S92-A143 PolarHBondContact N-O 3.07Å; S92-A143 VanDerWaalsContact OG-C 3.23Å; S92-A143 PolarHBondContact OG-O 2.87Å; S92-A143 VanDerWaalsContact OG-O 3.11Å; K93-A143 HydrophobicContact CB-CB 4.05Å; K93-A143 PolarHBondContact N-O 3.41Å; K93-A143 VanDerWaalsContact N-O 3.07Å; K93-A143 PolarHBondContact O-N 2.52Å
144	N	98	Very high	97.4	Very high	4 Å²	4	34.3 Å²	34.3	2%	0.021	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	170.1	170.7	-60.4	-52.1	0	0	0	111	Q60 S88 T90 P91 S92 V141 G148 D150 T151	Q60-N144 PolarHBondContact NE2-ND2 3.03Å; S88-N144 VanDerWaalsContact O-CB 3.22Å; S88-N144 WeakPolarHBondContact O-CB 3.47Å; T90-N144 CarbonylContact O-C 3.56Å; T90-N144 WeakPolarHBondContact O-CA 3.48Å; P91-N144 WeakPolarHBondContact CA-OD1 3.48Å; S92-N144 WeakPolarHBondContact OG-CA 3.42Å; S92-N144 PolarHBondContact OG-N 2.99Å; S92-N144 PolarHBondContact OG-O 2.9Å; V141-N144 WeakPolarHBondContact CG1-OD1 3.46Å; N144-G148 PolarHBondContact ND2-O 2.9Å; N144-D150 PolarHBondContact ND2-O 2.97Å; N144-T151 WeakPolarHBondContact OD1-CB 3.47Å; N144-T151 PolarHBondContact OD1-OG1 2.78Å
145	H	97	Very high	97.5	Very high	24 Å²	24	34.1 Å²	34.1	11%	0.111	16%	0.164	C	C	.	.	G	3₁₀ helix	trans	-64.9	151.2	170.9	-72.7	73.8	0	0	0	110.3	Y83 S88 T90 P91 L113 E115 N147 G148	Y83-H145 HydrophobicContact CD2-CB 4.33Å; Y83-H145 AromaticContact CD2-CD2 3.98Å; Y83-H145 HydrophobicContact CE2-CB 3.86Å; Y83-H145 AromaticContact CE2-CD2 3.78Å; Y83-H145 AromaticContact CE2-CG 3.87Å; S88-H145 WeakPolarHBondContact CA-O 3.32Å; S88-H145 VanDerWaalsContact O-O 3.14Å; T90-H145 PolarHBondContact O-N 3.31Å; T90-H145 PolarHBondContact O-ND1 2.86Å; P91-H145 PolarHBondContact O-CE1 2.9Å; P91-H145 PolarHBondContact O-ND1 3.22Å; L113-H145 PolarHBondContact O-CE1 3.44Å; L113-H145 PolarHBondContact O-NE2 3.29Å; E115-H145 PolarHBondContact N-NE2 2.74Å; H145-N147 PolarHBondContact O-N 2.75Å; H145-G148 PolarHBondContact O-N 3.43Å
146	Q	95.4	Very high	97.5	Very high	127 Å²	127	30.5 Å²	30.5	59%	0.593	15%	0.147	S	C	*	.	G	3₁₀ helix	trans	53.9	24.9	176.9	-55.2	174	-16.4	0	0	114.2	Y83 G148	Y83-Q146 PolarHBondContact OH-NE2 2.74Å; Q146-G148 PolarHBondContact O-N 3.11Å
147	N	94.3	Very high	97.5	Very high	156 Å²	156	30.9 Å²	30.9	83%	0.834	15%	0.149	S	C	*	.	G	3₁₀ helix	trans	55.6	33.3	-173.6	-57.3	-38.3	0	0	0	113.9	H145 R149	H145-N147 PolarHBondContact O-N 2.75Å; N147-R149 PolarHBondContact O-N 2.79Å
148	G	96.1	Very high	97.5	Very high	8 Å²	8	30.9 Å²	30.9	8%	0.082	15%	0.149	C	C	.	.			trans	-57.1	135.8	175.3	0	0	0	0	0	112	Q60 S88 N144 H145 Q146	Q60-G148 PolarHBondContact NE2-O 3.07Å; S88-G148 WeakPolarHBondContact O-CA 3.36Å; N144-G148 PolarHBondContact ND2-O 2.9Å; H145-G148 PolarHBondContact O-N 3.43Å; Q146-G148 PolarHBondContact O-N 3.11Å
149	R	96.5	Very high	97.4	Very high	176 Å²	176	30.2 Å²	30.2	66%	0.664	15%	0.146	S	C	*	.	S	Bend	trans	-69.8	-53.3	-175.8	-179.9	178.6	173.5	172.4	-4	111.7	Q60 H62 N147	Q60-R149 PolarHBondContact NE2-O 3.41Å; H62-R149 PolarHBondContact NE2-O 3.2Å; N147-R149 PolarHBondContact O-N 2.79Å
150	D	97.3	Very high	97.3	Very high	16 Å²	16	31.5 Å²	31.5	9%	0.086	15%	0.154	C	C	.	.	S	Bend	trans	-99.8	163	-178.4	-59.3	-37.6	0	0	0	110.9	S56 Y89 N144	S56-D150 VanDerWaalsContact O-CB 3.28Å; S56-D150 WeakPolarHBondContact O-CB 3.45Å; S56-D150 WeakPolarHBondContact OG-CA 3.41Å; Y89-D150 HydrophobicContact CD1-CB 4.03Å; Y89-D150 HydrophobicContact CE1-CB 3.9Å; N144-D150 PolarHBondContact ND2-O 2.97Å
151	T	97.9	Very high	97	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.163	C	C	.	.			trans	-120.3	145.1	-179	-162.3	0	0	0	0	111.7	W54 Q55 S56 H62 Y89 P91 V141 N144	W54-T151 HydrophobicContact CE3-CG2 4.47Å; W54-T151 HydrophobicContact CH2-CG2 4.17Å; W54-T151 HydrophobicContact CZ3-CG2 4.04Å; Q55-T151 WeakPolarHBondContact CA-O 3.3Å; S56-T151 PolarHBondContact N-O 3.01Å; S56-T151 PolarHBondContact OG-N 3.36Å; H62-T151 HydrophobicContact CB-CG2 3.94Å; Y89-T151 CarbonylContact O-C 3.58Å; Y89-T151 WeakPolarHBondContact O-CA 3.34Å; Y89-T151 PolarHBondContact O-OG1 2.77Å; P91-T151 WeakPolarHBondContact CG-OG1 3.38Å; V141-T151 HydrophobicContact CB-CG2 4.43Å; V141-T151 HydrophobicContact CG1-CG2 4.46Å; V141-T151 HydrophobicContact CG2-CG2 4.19Å; N144-T151 WeakPolarHBondContact OD1-CB 3.47Å; N144-T151 PolarHBondContact OD1-OG1 2.78Å
152	H	98.3	Very high	96.6	Very high	13 Å²	13	35 Å²	35	6%	0.06	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	125	166.7	-71	176.2	0	0	0	109.6	Y53 W54 D86 Y89	Y53-H152 HydrophobicContact CD2-CB 4.4Å; Y53-H152 AromaticContact CD2-CD2 3.71Å; Y53-H152 AromaticContact CD2-CE1 3.97Å; Y53-H152 AromaticContact CD2-CG 3.78Å; Y53-H152 AromaticContact CD2-ND1 3.94Å; Y53-H152 AromaticContact CD2-NE2 3.86Å; Y53-H152 AromaticContact CE2-CD2 3.89Å; Y53-H152 AromaticContact CE2-CE1 3.52Å; Y53-H152 AromaticContact CE2-ND1 3.9Å; Y53-H152 AromaticContact CE2-NE2 3.51Å; Y53-H152 AromaticContact CZ-CE1 3.96Å; W54-H152 VanDerWaalsContact O-CA 3.32Å; W54-H152 WeakPolarHBondContact O-CA 3.44Å; D86-H152 HydrophobicContact CB-CB 4.24Å; D86-H152 IonicContact OD1-CG 3.52Å; D86-H152 IonicContact OD1-ND1 3.59Å; D86-H152 PolarHBondContact OD1-ND1 3.03Å; Y89-H152 AromaticContact CD1-CD2 3.63Å; Y89-H152 AromaticContact CD1-CE1 3.97Å; Y89-H152 AromaticContact CD1-NE2 3.46Å; Y89-H152 WeakPolarHBondContact CD1-NE2 3.38Å; Y89-H152 AromaticContact CE1-NE2 3.83Å; Y89-H152 AromaticContact CG-CD2 3.9Å; Y89-H152 AromaticContact CG-CE1 3.76Å; Y89-H152 AromaticContact CG-ND1 3.94Å; Y89-H152 AromaticContact CG-NE2 3.73Å; Y89-H152 PolarHBondContact O-N 2.95Å
153	M	97.2	Very high	95.2	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	120.4	165	-65	-175.1	75	0	0	108.5	L45 Y53 W54 V64 I79 P91 V141 I156	L45-M153 HydrophobicContact CD1-CB 3.59Å; L45-M153 VanDerWaalsContact CD1-O 3.32Å; L45-M153 WeakPolarHBondContact CD1-O 3.46Å; Y53-M153 WeakPolarHBondContact CA-O 3.45Å; W54-M153 HydrophobicContact CE3-CB 4Å; W54-M153 HydrophobicContact CE3-CG 4.01Å; W54-M153 HydrophobicContact CE3-SD 3.86Å; W54-M153 HydrophobicContact CZ3-CG 4.23Å; W54-M153 HydrophobicContact CZ3-SD 3.65Å; W54-M153 PolarHBondContact N-O 2.85Å; W54-M153 PolarHBondContact O-N 2.83Å; W54-M153 VanDerWaalsContact O-N 3.13Å; V64-M153 HydrophobicContact CG2-SD 4.06Å; I79-M153 HydrophobicContact CB-CE 4.31Å; I79-M153 HydrophobicContact CD1-CE 4.15Å; I79-M153 HydrophobicContact CG1-CE 4.08Å; I79-M153 HydrophobicContact CG2-CE 3.35Å; P91-M153 HydrophobicContact CG-CG 4.39Å; V141-M153 HydrophobicContact CG2-SD 4.2Å; M153-I156 HydrophobicContact CE-CD1 3.32Å; M153-I156 HydrophobicContact CE-CG1 3.63Å; M153-I156 HydrophobicContact SD-CD1 4.07Å
154	R	97.6	Very high	93.3	Very high	25 Å²	25	45 Å²	45	9%	0.094	22%	0.217	C	C	.	.			trans	-80.9	-43.6	-175	-69.5	165.9	179.4	-78.1	-8.5	111.9	L50 E51 T52 Y80 D86	L50-R154 WeakPolarHBondContact O-CD 3.31Å; L50-R154 PolarHBondContact O-NH1 2.91Å; E51-R154 PolarHBondContact O-NH1 2.95Å; T52-R154 WeakPolarHBondContact O-CA 3.22Å; Y80-R154 HydrophobicContact CD1-CB 3.82Å; Y80-R154 HydrophobicContact CD1-CG 4.35Å; D86-R154 IonicContact OD1-CZ 3.85Å; D86-R154 IonicContact OD1-NE 2.95Å; D86-R154 IonicContact OD1-NH2 3.66Å; D86-R154 PolarHBondContact OD1-NH2 3.45Å; D86-R154 IonicContact OD2-CZ 2.66Å; D86-R154 IonicContact OD2-NE 2.77Å; D86-R154 PolarHBondContact OD2-NE 2.82Å; D86-R154 IonicContact OD2-NH2 3.95Å
155	Q	97.9	Very high	91	Very high	1 Å²	1	46.9 Å²	46.9	1%	0.005	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	142.1	-175.7	-161	58.8	-117.8	0	0	111.5	L45 D47 D48 N49 L50 Y80 W119	L45-Q155 PolarHBondContact O-OE1 3.29Å; D47-Q155 PolarHBondContact OD1-NE2 2.82Å; D48-Q155 VanDerWaalsContact CA-NE2 3.26Å; N49-Q155 PolarHBondContact O-NE2 2.96Å; N49-Q155 VanDerWaalsContact O-NE2 3.09Å; L50-Q155 HydrophobicContact CD2-CB 3.98Å; Y80-Q155 PolarHBondContact N-O 2.87Å; W119-Q155 HydrophobicContact CH2-CB 3.77Å; W119-Q155 HydrophobicContact CH2-CG 3.54Å; W119-Q155 HydrophobicContact CZ2-CG 4.38Å; W119-Q155 HydrophobicContact CZ3-CB 4.24Å; W119-Q155 HydrophobicContact CZ3-CG 4.29Å
156	I	98.1	Very high	88.7	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	133.3	170.6	-58.7	178.3	0	0	0	109	W31 L45 R46 V64 L77 C78 I79 I139 M153	W31-I156 HydrophobicContact CH2-CB 4.12Å; W31-I156 HydrophobicContact CH2-CG2 3.7Å; W31-I156 HydrophobicContact CZ3-CB 4.03Å; W31-I156 HydrophobicContact CZ3-CD1 4.29Å; W31-I156 HydrophobicContact CZ3-CG2 3.85Å; L45-I156 HydrophobicContact CD1-CD1 3.86Å; L45-I156 HydrophobicContact CD1-CG1 3.71Å; L45-I156 HydrophobicContact CD2-CD1 3.72Å; L45-I156 HydrophobicContact CD2-CG1 4.31Å; L45-I156 HydrophobicContact CG-CB 4.42Å; L45-I156 HydrophobicContact CG-CD1 3.96Å; L45-I156 HydrophobicContact CG-CG1 3.99Å; L45-I156 PolarHBondContact O-N 2.84Å; R46-I156 PolarHBondContact NH1-O 3.34Å; V64-I156 HydrophobicContact CB-CD1 4.4Å; V64-I156 HydrophobicContact CG1-CD1 4.08Å; V64-I156 HydrophobicContact CG2-CD1 4.04Å; L77-I156 HydrophobicContact CD1-CG2 3.52Å; C78-I156 CarbonylContact O-C 3.57Å; C78-I156 WeakPolarHBondContact O-CA 3.36Å; I79-I156 HydrophobicContact CG1-CG1 4.46Å; I139-I156 HydrophobicContact CD1-CD1 3.84Å; I139-I156 HydrophobicContact CD1-CG2 4.13Å; M153-I156 HydrophobicContact CE-CD1 3.32Å; M153-I156 HydrophobicContact CE-CG1 3.63Å; M153-I156 HydrophobicContact SD-CD1 4.07Å
157	K	98	Very high	86.7	Confident	11 Å²	11	46.3 Å²	46.3	5%	0.048	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	144	170.8	-61.5	-166.6	176.4	-140	0	110.7	P13 E17 E24 D48 C78 W119 Y159	P13-K157 HydrophobicContact CB-CD 4.21Å; E17-K157 IonicContact OE1-NZ 2.74Å; E24-K157 HydrophobicContact CG-CB 4.37Å; D48-K157 WeakPolarHBondContact OD1-CE 3.44Å; D48-K157 IonicContact OD1-NZ 3.62Å; D48-K157 PolarHBondContact OD1-NZ 2.81Å; D48-K157 IonicContact OD2-NZ 2.91Å; C78-K157 HydrophobicContact CB-CB 4.24Å; C78-K157 PolarHBondContact N-O 3.34Å; C78-K157 PolarHBondContact O-N 3.45Å; W119-K157 HydrophobicContact CH2-CD 4.23Å; W119-K157 HydrophobicContact CH2-CG 4.18Å; W119-K157 HydrophobicContact CZ3-CG 4.35Å; K157-Y159 HydrophobicContact CB-CE2 3.68Å; K157-Y159 WeakPolarHBondContact CD-OH 3.48Å
158	I	97.6	Very high	85	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	133	178.8	-179.9	156.5	0	0	0	110.6	E24 I25 W31 F68 V74 L77 I137	E24-I158 CarbonylContact C-O 3.57Å; E24-I158 WeakPolarHBondContact CA-O 3.37Å; E24-I158 PolarHBondContact OE1-N 3.42Å; I25-I158 HydrophobicContact CD1-CG1 4.29Å; I25-I158 HydrophobicContact CG1-CG1 4.17Å; I25-I158 HydrophobicContact CG1-CG2 4.1Å; I25-I158 WeakPolarHBondContact CG1-O 3.36Å; I25-I158 PolarHBondContact N-O 2.94Å; W31-I158 HydrophobicContact CH2-CG2 4.39Å; W31-I158 HydrophobicContact CZ2-CG2 3.99Å; F68-I158 HydrophobicContact CE2-CD1 4.28Å; F68-I158 HydrophobicContact CZ-CD1 3.83Å; V74-I158 HydrophobicContact CB-CD1 4.45Å; V74-I158 HydrophobicContact CG1-CD1 3.97Å; V74-I158 HydrophobicContact CG1-CG1 4.34Å; L77-I158 HydrophobicContact CD1-CB 4.37Å; I137-I158 HydrophobicContact CD1-CD1 3.24Å
159	Y	97.1	Very high	83.2	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	129.9	-171.7	-66	-76.7	0	0	0	112.3	P13 E17 V22 R23 E24 K75 T76 C78 K157	P13-Y159 HydrophobicContact CB-CE2 4Å; P13-Y159 WeakPolarHBondContact CB-OH 3.38Å; E17-Y159 HydrophobicContact CG-CD1 4.42Å; E17-Y159 HydrophobicContact CG-CE1 3.44Å; E17-Y159 VanDerWaalsContact CG-CE1 3.44Å; E17-Y159 VanDerWaalsContact OE1-CE1 3.25Å; E17-Y159 WeakPolarHBondContact OE1-CE1 3.44Å; E17-Y159 VanDerWaalsContact OE1-CZ 3.3Å; E17-Y159 PolarHBondContact OE1-OH 3.33Å; V22-Y159 HydrophobicContact CB-CD1 4.25Å; V22-Y159 HydrophobicContact CB-CG 4.47Å; V22-Y159 HydrophobicContact CG2-CD1 3.72Å; V22-Y159 HydrophobicContact CG2-CE1 4.39Å; V22-Y159 HydrophobicContact CG2-CG 4.13Å; R23-Y159 WeakPolarHBondContact O-CA 3.5Å; E24-Y159 HydrophobicContact CB-CD1 4.21Å; E24-Y159 HydrophobicContact CB-CE1 3.8Å; E24-Y159 HydrophobicContact CG-CE1 3.98Å; K75-Y159 PolarHBondContact N-O 2.77Å; T76-Y159 PolarHBondContact N-O 2.99Å; T76-Y159 PolarHBondContact O-N 3.19Å; C78-Y159 HydrophobicContact CB-CE2 4.19Å; C78-Y159 VanDerWaalsContact SG-CE2 3.55Å; K157-Y159 HydrophobicContact CB-CE2 3.68Å; K157-Y159 WeakPolarHBondContact CD-OH 3.48Å
160	T	95.5	Very high	81.3	Confident	26 Å²	26	50.3 Å²	50.3	16%	0.16	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	147.4	162.5	-176.6	0	0	0	0	109.2	V22 R23 I25 T73 V162	V22-T160 VanDerWaalsContact CA-O 3.29Å; V22-T160 WeakPolarHBondContact CA-O 3.42Å; V22-T160 WeakPolarHBondContact CB-O 3.46Å; R23-T160 HydrophobicContact CB-CG2 3.94Å; R23-T160 PolarHBondContact N-O 2.81Å; R23-T160 WeakPolarHBondContact O-CG2 3.3Å; R23-T160 PolarHBondContact O-N 2.89Å; I25-T160 HydrophobicContact CG2-CG2 3.41Å; I25-T160 VanDerWaalsContact CG2-CG2 3.41Å; T73-T160 VanDerWaalsContact O-CB 3.26Å; T73-T160 WeakPolarHBondContact O-CB 3.45Å; T73-T160 PolarHBondContact O-OG1 3.32Å; T160-V162 PolarHBondContact O-N 2.97Å
161	P	93.3	Very high	79.6	Confident	31 Å²	31	55 Å²	55	20%	0.201	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.4	136.5	160.6	28.1	-32.1	0	0	0	108.6	T73 K75 P131 E163	T73-P161 HydrophobicContact CG2-CG 3.68Å; K75-P161 HydrophobicContact CB-CG 4.5Å; K75-P161 HydrophobicContact CD-CB 4.16Å; P131-P161 HydrophobicContact CB-CG 4.24Å; P131-P161 HydrophobicContact CG-CG 4.12Å; P161-E163 PolarHBondContact O-N 2.95Å
162	V	88.6	Confident	78	Confident	44 Å²	44	61.2 Å²	61.2	27%	0.267	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-75	122	163.9	171.6	0	0	0	0	105.6	T21 V22 R23 T160 E164	T21-V162 PolarHBondContact O-N 2.95Å; V22-V162 VanDerWaalsContact C-CG2 3.44Å; R23-V162 HydrophobicContact CB-CG2 3.73Å; T160-V162 PolarHBondContact O-N 2.97Å; V162-E164 PolarHBondContact O-N 3.04Å
163	E	69.4	Low	76.4	Confident	166 Å²	166	62.4 Å²	62.4	78%	0.776	33%	0.33	S	S	*	.			trans	-56	115.5	165.4	-76.4	-178.6	175.2	0	0	106.5	P161 S165	P161-E163 PolarHBondContact O-N 2.95Å; E163-S165 PolarHBondContact O-N 3.24Å
164	E	57.4	Low	75.3	Confident	118 Å²	118	67.2 Å²	67.2	55%	0.551	36%	0.36	S	S	*	.			trans	-66.1	75	164.8	-76.2	-161.2	128.7	0	0	107.3	V162 S166 R172	V162-E164 PolarHBondContact O-N 3.04Å; E164-S166 PolarHBondContact O-N 3.2Å; E164-R172 IonicContact OE1-CZ 3.68Å; E164-R172 IonicContact OE1-NH1 2.8Å; E164-R172 PolarHBondContact OE1-NH1 3.2Å
165	S	50.7	Low	74.7	Confident	43 Å²	43	69.4 Å²	69.4	30%	0.301	38%	0.376	S	S	.	.			trans	38.2	50.8	144.9	-64.1	0	0	0	0	113.5	E163 I167 R182	E163-S165 PolarHBondContact O-N 3.24Å; S165-I167 PolarHBondContact O-N 3.43Å; S165-I167 VanDerWaalsContact O-N 3.1Å; S165-R182 PolarHBondContact OG-NH1 3.08Å; S165-R182 PolarHBondContact OG-NH2 2.79Å
166	S	48.6	Very low	73.9	Confident	73 Å²	73	76 Å²	76	51%	0.51	41%	0.41	S	S	.	.			trans	-67.8	121.8	-177.9	54.3	0	0	0	0	105.4	E164 G168	E164-S166 PolarHBondContact O-N 3.2Å; S166-G168 VanDerWaalsContact CB-O 3.26Å; S166-G168 WeakPolarHBondContact CB-O 3.41Å; S166-G168 PolarHBondContact O-N 3.03Å; S166-G168 PolarHBondContact OG-O 3.35Å
167	I	52.7	Low	73.2	Confident	66 Å²	66	81.2 Å²	81.2	34%	0.338	44%	0.438	S	S	.	.	B	Isolated β-bridge	trans	-72.3	81.7	170.8	-59.1	173.6	0	0	0	104.5	S165 K169 F170 C173 F178	S165-I167 PolarHBondContact O-N 3.43Å; S165-I167 VanDerWaalsContact O-N 3.1Å; I167-K169 PolarHBondContact O-N 2.94Å; I167-F170 PolarHBondContact O-N 2.96Å; I167-C173 HydrophobicContact CD1-CB 3.7Å; I167-F178 HydrophobicContact CD1-CD1 4.47Å
168	G	59.8	Low	72.4	Confident	58 Å²	58	86.6 Å²	86.6	60%	0.598	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.9	-128.3	-171	0	0	0	0	0	113	S166 F170	S166-G168 VanDerWaalsContact CB-O 3.26Å; S166-G168 WeakPolarHBondContact CB-O 3.41Å; S166-G168 PolarHBondContact O-N 3.03Å; S166-G168 PolarHBondContact OG-O 3.35Å; G168-F170 VanDerWaalsContact C-N 3.3Å
169	K	58.3	Low	71.5	Confident	211 Å²	211	90.4 Å²	90.4	92%	0.917	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-1.5	-179.5	-67.5	-174.4	179.8	178.1	0	114.1	I167	I167-K169 PolarHBondContact O-N 2.94Å
170	F	57	Low	70.8	Confident	154 Å²	154	96.8 Å²	96.8	68%	0.675	51%	0.512	S	S	*	.	B	Isolated β-bridge	trans	-101	149.5	-171.7	-65.7	-78	0	0	0	112.2	I167 G168	I167-F170 PolarHBondContact O-N 2.96Å; G168-F170 VanDerWaalsContact C-N 3.3Å
171	P	60.8	Low	70.2	Confident	114 Å²	114	104.3 Å²	104.3	74%	0.74	54%	0.538	S	S	*	.	P	Polyproline II helix	trans	-61.1	162.3	175.9	24.7	-32.3	0	0	0	111.9	C173	P171-C173 PolarHBondContact O-N 3.4Å
172	R	65.1	Low	69.4	Low	132 Å²	132	109 Å²	109	50%	0.498	55%	0.552	S	S	.	*	P	Polyproline II helix	trans	-53.1	121	-177.1	-177.7	178.2	176.7	168.7	-2.9	111.2	E164 T174	E164-R172 IonicContact OE1-CZ 3.68Å; E164-R172 IonicContact OE1-NH1 2.8Å; E164-R172 PolarHBondContact OE1-NH1 3.2Å; R172-T174 HydrophobicContact CG-CG2 4.14Å
173	C	64.9	Low	68.7	Low	38 Å²	38	111 Å²	111	26%	0.257	57%	0.567	S	S	.	*	P	Polyproline II helix	trans	-84.8	123.3	164.5	-136.6	0	0	0	0	108.3	I167 P171 F178 M179	I167-C173 HydrophobicContact CD1-CB 3.7Å; P171-C173 PolarHBondContact O-N 3.4Å; C173-F178 HydrophobicContact CB-CB 3.81Å; C173-F178 HydrophobicContact CB-CD1 3.97Å; C173-F178 HydrophobicContact CB-CG 3.93Å; C173-F178 WeakPolarHBondContact SG-CG 3.19Å; C173-M179 WeakPolarHBondContact O-CE 3.15Å
174	T	73.7	Confident	69.1	Low	101 Å²	101	111.7 Å²	111.7	62%	0.62	58%	0.575	S	S	*	*			trans	-97.9	-14.1	-172.9	49.1	0	0	0	0	113.5	R172	R172-T174 HydrophobicContact CG-CG2 4.14Å
175	T	83.8	Confident	69.7	Low	71 Å²	71	120.4 Å²	120.4	44%	0.436	60%	0.603	S	S	.	*	S	Bend	trans	-72	140.4	-177.2	-43.9	0	0	0	0	111.5	D177 F178 M179	T175-D177 HydrophobicContact CG2-CB 4.31Å; T175-D177 PolarHBondContact O-N 3.45Å; T175-F178 PolarHBondContact O-N 3.31Å; T175-F178 VanDerWaalsContact O-N 3.15Å; T175-M179 PolarHBondContact O-N 3.23Å; T175-M179 VanDerWaalsContact O-N 3.1Å
176	I	81.3	Confident	70.7	Confident	138 Å²	138	124.3 Å²	124.3	71%	0.708	62%	0.618	S	S	*	*	H	α-helix	trans	-55.4	-42.7	178.8	-63.4	174.1	0	0	0	110.8	F178 M179 M180	I176-F178 VanDerWaalsContact C-N 3.29Å; I176-F178 PolarHBondContact O-N 2.65Å; I176-M179 PolarHBondContact O-N 3.24Å; I176-M180 PolarHBondContact O-N 2.85Å
177	D	84	Confident	71.8	Confident	111 Å²	111	126.9 Å²	126.9	59%	0.594	62%	0.623	S	S	*	*	H	α-helix	trans	-56.4	-42.9	179.8	-55.7	-39.3	0	0	0	112.1	T175 Y181	T175-D177 HydrophobicContact CG2-CB 4.31Å; T175-D177 PolarHBondContact O-N 3.45Å; D177-Y181 WeakPolarHBondContact O-CD2 3.43Å
178	F	80.3	Confident	72.9	Confident	124 Å²	124	130.3 Å²	130.3	54%	0.544	64%	0.639	S	S	.	*	H	α-helix	trans	-72.9	-35.6	177.3	-99.5	-93	0	0	0	112.6	I167 C173 T175 I176 M180	I167-F178 HydrophobicContact CD1-CD1 4.47Å; C173-F178 HydrophobicContact CB-CB 3.81Å; C173-F178 HydrophobicContact CB-CD1 3.97Å; C173-F178 HydrophobicContact CB-CG 3.93Å; C173-F178 WeakPolarHBondContact SG-CG 3.19Å; T175-F178 PolarHBondContact O-N 3.31Å; T175-F178 VanDerWaalsContact O-N 3.15Å; I176-F178 VanDerWaalsContact C-N 3.29Å; I176-F178 PolarHBondContact O-N 2.65Å; F178-M180 VanDerWaalsContact C-N 3.35Å
179	M	79.8	Confident	73.7	Confident	80 Å²	80	134.6 Å²	134.6	39%	0.394	64%	0.642	S	S	.	*	H	α-helix	trans	-69.1	-33.9	178.3	-68.6	-164.5	-175.4	0	0	112.4	C173 T175 I176 Y181 R182	C173-M179 WeakPolarHBondContact O-CE 3.15Å; T175-M179 PolarHBondContact O-N 3.23Å; T175-M179 VanDerWaalsContact O-N 3.1Å; I176-M179 PolarHBondContact O-N 3.24Å; M179-Y181 VanDerWaalsContact C-N 3.28Å; M179-Y181 PolarHBondContact O-N 3.17Å; M179-R182 VanDerWaalsContact O-CB 3.24Å; M179-R182 WeakPolarHBondContact O-CB 3.39Å; M179-R182 PolarHBondContact O-N 2.63Å
180	M	82.4	Confident	74.6	Confident	134 Å²	134	129.8 Å²	129.8	66%	0.66	62%	0.624	S	S	*	*	H	α-helix	trans	-59.8	-37.3	-179.2	-179.6	173.6	161.9	0	0	112.5	I176 F178	I176-M180 PolarHBondContact O-N 2.85Å; F178-M180 VanDerWaalsContact C-N 3.35Å
181	Y	82.1	Confident	75.8	Confident	184 Å²	184	128.2 Å²	128.2	72%	0.722	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.3	9	-179.5	-56.5	-72.8	0	0	0	113.7	D177 M179	D177-Y181 WeakPolarHBondContact O-CD2 3.43Å; M179-Y181 VanDerWaalsContact C-N 3.28Å; M179-Y181 PolarHBondContact O-N 3.17Å
182	R	76.1	Confident	76.9	Confident	130 Å²	130	129.2 Å²	129.2	49%	0.491	61%	0.612	S	S	.	*	S	Bend	trans	-69.5	-35.6	-172.5	177	-175.5	161.8	-161.4	-6.1	113.9	S165 M179	S165-R182 PolarHBondContact OG-NH1 3.08Å; S165-R182 PolarHBondContact OG-NH2 2.79Å; M179-R182 VanDerWaalsContact O-CB 3.24Å; M179-R182 WeakPolarHBondContact O-CB 3.39Å; M179-R182 PolarHBondContact O-N 2.63Å
183	S	74.6	Confident	77.8	Confident	84 Å²	84	129 Å²	129	59%	0.587	62%	0.621	S	S	*	*			trans	-144.3	135.1	-176.1	58.4	0	0	0	0	110.6
184	I	78.7	Confident	78.9	Confident	182 Å²	182	136.6 Å²	136.6	93%	0.933	65%	0.652	S	S	*	*			trans	-78.8	122.7	162.4	-60.8	168.6	0	0	0	106
185	R	69.9	Low	79.3	Confident	300 Å²	300	139.8 Å²	139.8	100%	1.132	66%	0.655	S	S	*	*			trans	-123.6	0	-179.9	-176.6	176.8	179.1	141.2	1.2	110.3

Retrieved 185 of 185 residues in 1081.9 ms (Link to these results)

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