A0A096LXD7_POEFO Loading...

Protein yippee-like

AlphaFold DB (Q65Z54), UniProt , Accession A0A096LXD7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 119 aa.

						>A0A096LXD7_POEFO|A0A096LXD7
MVKLTKAKTFQAYLDSCHRRYSCVHCRAHLANHDDLISKSFQGSQGRAYLFNSVVNVGCGPAEERLLLTGLHAVADIYCENCHTTLGWKYEQAFELSQKYKEGKYIIELSHMIKDNGWD
					

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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	39.4	Very low	55.9	Low	241 Å²	241	149.5 Å²	149.5	100%	1.187	77%	0.769	S	S	*	*				0	108.4	0	-74.5	173.1	170.6	0	0	107.9	K3	M1-K3 PolarHBondContact O-N 2.64Å
2	V	46.8	Very low	58.3	Low	138 Å²	138	140.9 Å²	140.9	84%	0.836	74%	0.737	S	S	*	*			trans	-72.7	112.6	174.3	179.5	0	0	0	0	106.5	L4	V2-L4 VanDerWaalsContact C-N 3.32Å; V2-L4 PolarHBondContact O-N 2.72Å
3	K	45.3	Very low	60.3	Low	191 Å²	191	141.4 Å²	141.4	83%	0.83	72%	0.724	S	S	*	*			trans	-65.8	100.1	169	-77.1	-173.9	177.5	-179.8	0	106.2	M1 T5	M1-K3 PolarHBondContact O-N 2.64Å; K3-T5 PolarHBondContact O-N 2.81Å
4	L	48.3	Very low	61.9	Low	163 Å²	163	133 Å²	133	85%	0.853	68%	0.681	S	S	*	*			trans	-65.3	85.5	168.3	-152.2	87.5	0	0	0	106.2	V2 K6	V2-L4 VanDerWaalsContact C-N 3.32Å; V2-L4 PolarHBondContact O-N 2.72Å; L4-K6 PolarHBondContact O-N 2.83Å
5	T	52.9	Low	62.6	Low	102 Å²	102	132.4 Å²	132.4	63%	0.626	68%	0.68	S	S	*	*			trans	-59.9	113.8	170.7	46	0	0	0	0	105.4	K3 A7	K3-T5 PolarHBondContact O-N 2.81Å; T5-A7 PolarHBondContact O-N 2.85Å
6	K	50.3	Low	62.9	Low	195 Å²	195	131.2 Å²	131.2	85%	0.848	69%	0.687	S	S	*	*			trans	-43.1	117.1	175.5	-83.1	-179.9	171.6	178.8	0	107.1	L4 K8	L4-K6 PolarHBondContact O-N 2.83Å; K6-K8 PolarHBondContact O-N 2.84Å
7	A	54.2	Low	63.2	Low	90 Å²	90	124.1 Å²	124.1	74%	0.744	65%	0.651	S	S	*	*			trans	-52.3	111.5	170.1	0	0	0	0	0	105.7	T5 T9	T5-A7 PolarHBondContact O-N 2.85Å; A7-T9 PolarHBondContact O-N 2.8Å
8	K	59.3	Low	64.1	Low	137 Å²	137	126.2 Å²	126.2	60%	0.596	66%	0.656	S	S	*	*			trans	-59.4	114.9	174.3	-81.7	178.1	175.5	168.4	0	105.3	K6 F10 E80	K6-K8 PolarHBondContact O-N 2.84Å; K8-F10 PolarHBondContact O-N 3.01Å; K8-E80 WeakPolarHBondContact CD-OE2 3.4Å; K8-E80 WeakPolarHBondContact CE-OE1 3.26Å; K8-E80 IonicContact NZ-OE1 2.71Å; K8-E80 PolarHBondContact NZ-OE1 2.73Å; K8-E80 IonicContact NZ-OE2 2.93Å; K8-E80 PolarHBondContact NZ-OE2 3.21Å
9	T	64.6	Low	65.6	Low	119 Å²	119	124.9 Å²	124.9	73%	0.73	64%	0.642	S	S	*	*	S	Bend	trans	-70.6	-7.3	179.4	46.5	0	0	0	0	112.2	A7	A7-T9 PolarHBondContact O-N 2.8Å
10	F	74	Confident	67	Low	172 Å²	172	119.8 Å²	119.8	75%	0.754	61%	0.614	S	S	*	*			trans	-127.1	127.2	-178.9	-56.6	-78.1	0	0	0	109.8	K8	K8-F10 PolarHBondContact O-N 3.01Å
11	Q	80	Confident	68.4	Low	97 Å²	97	114.2 Å²	114.2	45%	0.453	59%	0.586	S	S	.	*	P	Polyproline II helix	trans	-93.6	140.9	165.6	-64.1	-179.6	18.1	0	0	108.1	Y13 N56 N81	Q11-Y13 PolarHBondContact O-N 3.4Å; Q11-N56 WeakPolarHBondContact CA-OD1 3.49Å; Q11-N81 VanDerWaalsContact NE2-CG 3.26Å; Q11-N81 PolarHBondContact NE2-OD1 2.86Å
12	A	83.9	Confident	71.1	Confident	46 Å²	46	102.8 Å²	102.8	38%	0.38	53%	0.529	S	S	.	.	P	Polyproline II helix	trans	-64	122.2	168.4	0	0	0	0	0	108.9	V55 N56	A12-V55 HydrophobicContact CB-CB 3.87Å; A12-V55 HydrophobicContact CB-CG1 4.24Å; A12-V55 HydrophobicContact CB-CG2 4.18Å; A12-N56 PolarHBondContact N-OD1 2.96Å; A12-N56 PolarHBondContact O-ND2 2.81Å
13	Y	84.2	Confident	73.5	Confident	147 Å²	147	96.2 Å²	96.2	58%	0.576	49%	0.489	S	S	*	.	P	Polyproline II helix	trans	-101.4	124.7	173.6	-166.3	-99.6	0	0	0	108.9	Q11 D15 H29	Q11-Y13 PolarHBondContact O-N 3.4Å; Y13-D15 HydrophobicContact CD1-CB 4.46Å; Y13-D15 WeakPolarHBondContact CD1-OD1 3.47Å; Y13-D15 WeakPolarHBondContact CE1-OD1 3.3Å; Y13-D15 PolarHBondContact O-N 3.09Å; Y13-H29 AromaticContact CD2-CE1 3.46Å; Y13-H29 VanDerWaalsContact CD2-CE1 3.46Å; Y13-H29 WeakPolarHBondContact CD2-CE1 3.14Å; Y13-H29 AromaticContact CD2-ND1 3.98Å; Y13-H29 AromaticContact CE2-CE1 3.22Å; Y13-H29 WeakPolarHBondContact CE2-CE1 3.32Å; Y13-H29 AromaticContact CE2-NE2 3.64Å; Y13-H29 AromaticContact CZ-CE1 3.79Å
14	L	83.3	Confident	76	Confident	24 Å²	24	89.5 Å²	89.5	13%	0.126	46%	0.464	C	S	.	.			trans	-89.2	91	-179	-63	177.3	0	0	0	107.7	R20 H29 N32 V55	L14-R20 WeakPolarHBondContact O-CD 3.12Å; L14-R20 PolarHBondContact O-NE 2.84Å; L14-R20 PolarHBondContact O-NH2 3.41Å; L14-H29 HydrophobicContact CD1-CB 4.06Å; L14-H29 HydrophobicContact CG-CB 4.21Å; L14-H29 PolarHBondContact N-ND1 3.27Å; L14-N32 WeakPolarHBondContact CD1-OD1 3.43Å; L14-V55 HydrophobicContact CD1-CG2 3.96Å; L14-V55 HydrophobicContact CD2-CG1 4.24Å; L14-V55 HydrophobicContact CD2-CG2 4.01Å; L14-V55 HydrophobicContact CG-CG2 4.01Å
15	D	72.1	Confident	78.3	Confident	124 Å²	124	87.1 Å²	87.1	66%	0.663	45%	0.448	S	S	*	.			trans	-72.1	-32.7	-173.7	-84	-53.9	0	0	0	114	Y13 R20	Y13-D15 HydrophobicContact CD1-CB 4.46Å; Y13-D15 WeakPolarHBondContact CD1-OD1 3.47Å; Y13-D15 WeakPolarHBondContact CE1-OD1 3.3Å; Y13-D15 PolarHBondContact O-N 3.09Å; D15-R20 PolarHBondContact O-NH2 2.99Å
16	S	68	Low	80.4	Confident	113 Å²	113	83.9 Å²	83.9	79%	0.79	43%	0.43	S	S	*	.	S	Bend	trans	-90.3	-7.7	-155	52.7	0	0	0	0	117.9
17	C	68.2	Low	82.5	Confident	11 Å²	11	82 Å²	82	7%	0.074	42%	0.418	C	S	.	.			trans	-132.2	118	-170.9	-172.6	0	0	0	0	113.2	R19 R20 N32 D34	C17-R19 PolarHBondContact O-N 3.38Å; C17-R19 PolarHBondContact SG-O 3.4Å; C17-R20 WeakPolarHBondContact O-CD 3.39Å; C17-R20 WeakPolarHBondContact O-CG 3.42Å; C17-R20 PolarHBondContact O-NE 3.09Å; C17-R20 PolarHBondContact O-NH1 3Å; C17-R20 PolarHBondContact O-NH2 2.85Å; C17-R20 VanDerWaalsContact O-NH2 3.1Å; C17-N32 HydrophobicContact CB-CB 4.39Å; C17-D34 PolarHBondContact SG-OD2 3.28Å; C17-D34 VanDerWaalsContact SG-OD2 3.33Å
18	H	78.7	Confident	84.4	Confident	161 Å²	161	77.8 Å²	77.8	75%	0.745	38%	0.383	S	S	*	.	S	Bend	trans	-62.7	-17.2	178.1	-69.5	-74.3	0	0	0	114.4
19	R	92.2	Very high	86.1	Confident	103 Å²	103	72.4 Å²	72.4	39%	0.389	36%	0.359	S	S	.	.	S	Bend	trans	-103.5	92.8	-179.4	-61.4	-177.5	-61.2	-174.1	3.1	110.4	C17 H33 D34 W118	C17-R19 PolarHBondContact O-N 3.38Å; C17-R19 PolarHBondContact SG-O 3.4Å; R19-H33 HydrophobicContact CB-CB 3.55Å; R19-H33 WeakPolarHBondContact O-CB 3.3Å; R19-H33 PolarHBondContact O-N 2.91Å; R19-D34 IonicContact NH2-OD1 3.35Å; R19-D34 PolarHBondContact NH2-OD1 2.97Å; R19-W118 HydrophobicContact CB-CD2 3.79Å; R19-W118 HydrophobicContact CB-CE3 4.18Å; R19-W118 HydrophobicContact CB-CG 4.14Å; R19-W118 HydrophobicContact CB-CH2 4.44Å; R19-W118 HydrophobicContact CB-CZ2 4.07Å; R19-W118 HydrophobicContact CB-CZ3 4.49Å; R19-W118 HydrophobicContact CG-CB 4.24Å; R19-W118 HydrophobicContact CG-CD2 3.72Å; R19-W118 HydrophobicContact CG-CE3 3.98Å; R19-W118 HydrophobicContact CG-CG 3.79Å
20	R	93.7	Very high	87.7	Confident	22 Å²	22	66.8 Å²	66.8	8%	0.083	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	158.2	179.7	-41.9	-171.3	-163.3	80.4	-0.6	111.9	L14 D15 C17 A31 N32 D115 W118	L14-R20 WeakPolarHBondContact O-CD 3.12Å; L14-R20 PolarHBondContact O-NE 2.84Å; L14-R20 PolarHBondContact O-NH2 3.41Å; D15-R20 PolarHBondContact O-NH2 2.99Å; C17-R20 WeakPolarHBondContact O-CD 3.39Å; C17-R20 WeakPolarHBondContact O-CG 3.42Å; C17-R20 PolarHBondContact O-NE 3.09Å; C17-R20 PolarHBondContact O-NH1 3Å; C17-R20 PolarHBondContact O-NH2 2.85Å; C17-R20 VanDerWaalsContact O-NH2 3.1Å; R20-A31 WeakPolarHBondContact CA-O 3.37Å; R20-N32 WeakPolarHBondContact CD-OD1 3.49Å; R20-N32 WeakPolarHBondContact CG-OD1 3.35Å; R20-D115 PolarHBondContact O-N 3.25Å; R20-W118 PolarHBondContact O-NE1 3.05Å
21	Y	97	Very high	88.8	Confident	3 Å²	3	58.7 Å²	58.7	1%	0.012	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	134.7	171.4	-60.2	-84.9	0	0	0	109.6	L30 A31 H33 Y49 F51 M112 I113 K114 W118	Y21-L30 WeakPolarHBondContact O-CA 3.5Å; Y21-L30 PolarHBondContact O-N 2.8Å; Y21-A31 PolarHBondContact N-O 3.44Å; Y21-A31 PolarHBondContact O-N 3.12Å; Y21-H33 HydrophobicContact CE2-CB 4.24Å; Y21-H33 AromaticContact CE2-ND1 3.76Å; Y21-H33 AromaticContact CZ-ND1 3.84Å; Y21-H33 PolarHBondContact OH-ND1 2.79Å; Y21-Y49 HydrophobicContact CE1-CD2 4.11Å; Y21-Y49 AromaticContact CE1-CE2 3.97Å; Y21-Y49 HydrophobicContact CE1-CE2 3.97Å; Y21-F51 AromaticContact CD2-CE1 3.53Å; Y21-F51 HydrophobicContact CD2-CE1 3.53Å; Y21-F51 AromaticContact CD2-CZ 3.57Å; Y21-F51 HydrophobicContact CD2-CZ 3.57Å; Y21-F51 AromaticContact CE2-CE1 3.49Å; Y21-F51 HydrophobicContact CE2-CE1 3.49Å; Y21-F51 VanDerWaalsContact CE2-CE1 3.49Å; Y21-F51 AromaticContact CE2-CZ 3.63Å; Y21-F51 HydrophobicContact CE2-CZ 3.63Å; Y21-F51 HydrophobicContact CG-CE1 4.41Å; Y21-F51 HydrophobicContact CG-CZ 4.04Å; Y21-M112 HydrophobicContact CD1-CG 4.2Å; Y21-M112 HydrophobicContact CD1-SD 3.51Å; Y21-M112 VanDerWaalsContact CD1-SD 3.51Å; Y21-M112 HydrophobicContact CE1-SD 4.11Å; Y21-M112 HydrophobicContact CG-SD 3.88Å; Y21-I113 CarbonylContact C-O 3.56Å; Y21-I113 VanDerWaalsContact CA-O 3.23Å; Y21-I113 WeakPolarHBondContact CA-O 3.24Å; Y21-K114 HydrophobicContact CD1-CG 4.18Å; Y21-K114 HydrophobicContact CE1-CG 3.86Å; Y21-W118 HydrophobicContact CD1-CZ2 4.42Å; Y21-W118 HydrophobicContact CD2-CZ2 4.48Å; Y21-W118 HydrophobicContact CE1-CH2 4Å; Y21-W118 AromaticContact CE1-CZ2 3.96Å; Y21-W118 HydrophobicContact CE1-CZ2 3.96Å; Y21-W118 AromaticContact CE2-CH2 4Å; Y21-W118 HydrophobicContact CE2-CH2 4Å; Y21-W118 HydrophobicContact CE2-CZ2 4.01Å; Y21-W118 AromaticContact CZ-CH2 3.53Å; Y21-W118 AromaticContact CZ-CZ2 3.76Å; Y21-W118 WeakPolarHBondContact OH-CH2 3.28Å
22	S	96.5	Very high	89.5	Confident	0 Å²	0	55 Å²	55	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	155	179.5	-74	0	0	0	0	110.8	V24 A28 H29 M112 I113 D115	S22-V24 PolarHBondContact O-N 3.28Å; S22-A28 CarbonylContact C-O 3.49Å; S22-A28 WeakPolarHBondContact CA-O 3.44Å; S22-H29 WeakPolarHBondContact OG-CA 3.5Å; S22-H29 PolarHBondContact OG-CD2 2.8Å; S22-M112 CarbonylContact O-C 3.52Å; S22-M112 VanDerWaalsContact O-CA 3.28Å; S22-M112 WeakPolarHBondContact O-CA 3.28Å; S22-I113 PolarHBondContact N-O 2.97Å; S22-I113 WeakPolarHBondContact O-CG1 3.33Å; S22-I113 PolarHBondContact O-N 3.24Å; S22-D115 VanDerWaalsContact CB-OD1 3.24Å; S22-D115 WeakPolarHBondContact CB-OD1 3.12Å; S22-D115 VanDerWaalsContact OG-CG 3.26Å; S22-D115 PolarHBondContact OG-OD1 2.77Å; S22-D115 PolarHBondContact OG-OD2 3.39Å
23	C	97.8	Very high	90	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	129.6	177	179.7	0	0	0	0	110.1	H25 R27 A28 L30 C82	C23-H25 PolarHBondContact O-N 3.18Å; C23-R27 VanDerWaalsContact O-CA 3.28Å; C23-R27 WeakPolarHBondContact O-CA 3.43Å; C23-R27 PolarHBondContact O-N 2.93Å; C23-A28 PolarHBondContact N-O 2.96Å; C23-L30 HydrophobicContact CB-CD1 4.07Å; C23-L30 HydrophobicContact CB-CD2 4.45Å; C23-L30 HydrophobicContact CB-CG 4.31Å; C23-C82 VanDerWaalsContact SG-SG 3.61Å
24	V	97.1	Very high	90.5	Very high	51 Å²	51	52.7 Å²	52.7	31%	0.309	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-30.3	-179.5	68.3	0	0	0	0	112.6	S22 H111 I113	S22-V24 PolarHBondContact O-N 3.28Å; V24-H111 PolarHBondContact N-O 3.28Å; V24-I113 HydrophobicContact CB-CG2 3.96Å; V24-I113 HydrophobicContact CG2-CG2 3.72Å
25	H	96.4	Very high	91.1	Very high	112 Å²	112	53.3 Å²	53.3	52%	0.519	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-34.4	-172.3	-59	-71.6	0	0	0	113.8	C23 T84 H111	C23-H25 PolarHBondContact O-N 3.18Å; H25-T84 PolarHBondContact CD2-OG1 3.29Å; H25-H111 AromaticContact NE2-ND1 3.66Å
26	C	96	Very high	92.3	Very high	35 Å²	35	49 Å²	49	24%	0.236	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-134.9	1.1	-173.2	71.4	0	0	0	0	115.2	A28 N81 C82	C26-A28 PolarHBondContact O-N 2.77Å; C26-A28 VanDerWaalsContact O-N 3.1Å; C26-N81 VanDerWaalsContact CB-ND2 3.25Å; C26-N81 WeakPolarHBondContact CB-ND2 3.49Å; C26-N81 PolarHBondContact SG-ND2 3.34Å; C26-C82 HydrophobicContact CB-CB 3.82Å; C26-C82 VanDerWaalsContact SG-SG 3.63Å
27	R	94.8	Very high	93.7	Very high	156 Å²	156	47.3 Å²	47.3	59%	0.589	23%	0.225	S	C	*	.			trans	62.6	11.1	179.2	-50.8	-58.9	-178.6	124.6	-4.1	115.5	C23 H29	C23-R27 VanDerWaalsContact O-CA 3.28Å; C23-R27 WeakPolarHBondContact O-CA 3.43Å; C23-R27 PolarHBondContact O-N 2.93Å; R27-H29 PolarHBondContact O-N 3.26Å
28	A	95.1	Very high	95.1	Very high	1 Å²	1	48.3 Å²	48.3	1%	0.008	23%	0.232	C	C	.	.			trans	-59.1	132	168.2	0	0	0	0	0	109.6	S22 C23 C26 N56 N81	S22-A28 CarbonylContact C-O 3.49Å; S22-A28 WeakPolarHBondContact CA-O 3.44Å; C23-A28 PolarHBondContact N-O 2.96Å; C26-A28 PolarHBondContact O-N 2.77Å; C26-A28 VanDerWaalsContact O-N 3.1Å; A28-N56 HydrophobicContact CB-CB 4.49Å; A28-N81 HydrophobicContact CB-CB 4.18Å
29	H	95.4	Very high	96	Very high	24 Å²	24	45.1 Å²	45.1	11%	0.111	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	140	179	-64.7	-170.2	0	0	0	109.8	Y13 L14 S22 R27 N56	Y13-H29 AromaticContact CD2-CE1 3.46Å; Y13-H29 VanDerWaalsContact CD2-CE1 3.46Å; Y13-H29 WeakPolarHBondContact CD2-CE1 3.14Å; Y13-H29 AromaticContact CD2-ND1 3.98Å; Y13-H29 AromaticContact CE2-CE1 3.22Å; Y13-H29 WeakPolarHBondContact CE2-CE1 3.32Å; Y13-H29 AromaticContact CE2-NE2 3.64Å; Y13-H29 AromaticContact CZ-CE1 3.79Å; L14-H29 HydrophobicContact CD1-CB 4.06Å; L14-H29 HydrophobicContact CG-CB 4.21Å; L14-H29 PolarHBondContact N-ND1 3.27Å; S22-H29 WeakPolarHBondContact OG-CA 3.5Å; S22-H29 PolarHBondContact OG-CD2 2.8Å; R27-H29 PolarHBondContact O-N 3.26Å; H29-N56 WeakPolarHBondContact O-CB 3.44Å; H29-N56 PolarHBondContact O-ND2 2.77Å
30	L	97.4	Very high	96.2	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	-51.7	-179.1	-63.5	176.9	0	0	0	111.6	Y21 C23 V54 V55 V57 L86 I107 M112	Y21-L30 WeakPolarHBondContact O-CA 3.5Å; Y21-L30 PolarHBondContact O-N 2.8Å; C23-L30 HydrophobicContact CB-CD1 4.07Å; C23-L30 HydrophobicContact CB-CD2 4.45Å; C23-L30 HydrophobicContact CB-CG 4.31Å; L30-V54 HydrophobicContact CB-CG1 4.41Å; L30-V54 CarbonylContact O-C 3.47Å; L30-V54 VanDerWaalsContact O-CA 3.25Å; L30-V54 WeakPolarHBondContact O-CA 3.16Å; L30-V54 WeakPolarHBondContact O-CG1 3.35Å; L30-V55 PolarHBondContact O-N 2.8Å; L30-V57 HydrophobicContact CD2-CG1 3.93Å; L30-L86 HydrophobicContact CD1-CD1 3.89Å; L30-L86 HydrophobicContact CD1-CD2 4.47Å; L30-L86 HydrophobicContact CD2-CD1 3.54Å; L30-L86 HydrophobicContact CG-CD1 4.38Å; L30-I107 HydrophobicContact CB-CD1 4.12Å; L30-I107 HydrophobicContact CD1-CD1 4.32Å; L30-M112 HydrophobicContact CD1-CB 4.24Å
31	A	97	Very high	96.4	Very high	2 Å²	2	45.8 Å²	45.8	2%	0.017	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	152.2	-176.7	0	0	0	0	0	112	R20 Y21 F51 V54	R20-A31 WeakPolarHBondContact CA-O 3.37Å; Y21-A31 PolarHBondContact N-O 3.44Å; Y21-A31 PolarHBondContact O-N 3.12Å; A31-F51 HydrophobicContact CB-CD1 3.65Å; A31-F51 HydrophobicContact CB-CE1 3.82Å; A31-F51 HydrophobicContact CB-CG 4.07Å; A31-F51 HydrophobicContact CB-CZ 4.37Å; A31-V54 HydrophobicContact CB-CG2 4.4Å
32	N	94.7	Very high	96.3	Very high	20 Å²	20	51.2 Å²	51.2	11%	0.107	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	152.7	165.7	-73.1	-35.6	0	0	0	110	L14 C17 R20 D34 D35	L14-N32 WeakPolarHBondContact CD1-OD1 3.43Å; C17-N32 HydrophobicContact CB-CB 4.39Å; R20-N32 WeakPolarHBondContact CD-OD1 3.49Å; R20-N32 WeakPolarHBondContact CG-OD1 3.35Å; N32-D34 PolarHBondContact O-N 3.24Å; N32-D35 PolarHBondContact O-N 3.04Å
33	H	94.6	Very high	96.1	Very high	35 Å²	35	51.8 Å²	51.8	16%	0.162	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-64.2	-27.9	173.2	-172.6	67.1	0	0	0	112.6	R19 Y21 D35 L36 W118	R19-H33 HydrophobicContact CB-CB 3.55Å; R19-H33 WeakPolarHBondContact O-CB 3.3Å; R19-H33 PolarHBondContact O-N 2.91Å; Y21-H33 HydrophobicContact CE2-CB 4.24Å; Y21-H33 AromaticContact CE2-ND1 3.76Å; Y21-H33 AromaticContact CZ-ND1 3.84Å; Y21-H33 PolarHBondContact OH-ND1 2.79Å; H33-D35 PolarHBondContact O-N 2.95Å; H33-L36 VanDerWaalsContact CE1-CD2 3.41Å; H33-L36 WeakPolarHBondContact CE1-CD2 3.42Å; H33-L36 WeakPolarHBondContact O-CB 3.19Å; H33-L36 PolarHBondContact O-N 2.93Å; H33-W118 HydrophobicContact CB-CH2 3.98Å; H33-W118 HydrophobicContact CB-CZ2 4.21Å; H33-W118 AromaticContact CE1-CH2 3.79Å; H33-W118 AromaticContact CE1-CZ3 3.81Å; H33-W118 AromaticContact CG-CH2 3.63Å; H33-W118 AromaticContact CG-CZ3 3.97Å; H33-W118 AromaticContact ND1-CH2 3.17Å; H33-W118 WeakPolarHBondContact ND1-CH2 3.22Å; H33-W118 AromaticContact ND1-CZ3 3.62Å
34	D	93.8	Very high	95.8	Very high	109 Å²	109	55.7 Å²	55.7	58%	0.583	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-69.6	-17.8	177.9	-53.1	-35.2	0	0	0	112.4	C17 R19 N32 L36	C17-D34 PolarHBondContact SG-OD2 3.28Å; C17-D34 VanDerWaalsContact SG-OD2 3.33Å; R19-D34 IonicContact NH2-OD1 3.35Å; R19-D34 PolarHBondContact NH2-OD1 2.97Å; N32-D34 PolarHBondContact O-N 3.24Å; D34-L36 VanDerWaalsContact C-N 3.33Å
35	D	95.9	Very high	95.5	Very high	38 Å²	38	60.7 Å²	60.7	20%	0.203	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-84.7	-4.2	170.8	-76.6	-62.3	0	0	0	112.8	N32 H33 I37 F51 N52	N32-D35 PolarHBondContact O-N 3.04Å; H33-D35 PolarHBondContact O-N 2.95Å; D35-I37 PolarHBondContact O-N 2.78Å; D35-F51 HydrophobicContact CB-CD1 4.44Å; D35-F51 CarbonylContact O-C 3.56Å; D35-F51 VanDerWaalsContact O-CA 3.27Å; D35-F51 WeakPolarHBondContact O-CA 3.49Å; D35-N52 HydrophobicContact CB-CB 4.33Å; D35-N52 PolarHBondContact O-N 2.87Å
36	L	96.9	Very high	95.4	Very high	33 Å²	33	56.2 Å²	56.2	17%	0.173	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	119.2	179.5	-178.2	70.1	0	0	0	110.7	H33 D34 K39 Y49 F51	H33-L36 VanDerWaalsContact CE1-CD2 3.41Å; H33-L36 WeakPolarHBondContact CE1-CD2 3.42Å; H33-L36 WeakPolarHBondContact O-CB 3.19Å; H33-L36 PolarHBondContact O-N 2.93Å; D34-L36 VanDerWaalsContact C-N 3.33Å; L36-K39 HydrophobicContact CD1-CG 4.45Å; L36-K39 HydrophobicContact CD2-CD 4.22Å; L36-K39 HydrophobicContact CD2-CG 3.79Å; L36-Y49 HydrophobicContact CD1-CD2 3.83Å; L36-Y49 HydrophobicContact CD1-CG 3.82Å; L36-F51 HydrophobicContact CB-CD1 4.22Å; L36-F51 HydrophobicContact CB-CE1 3.99Å; L36-F51 HydrophobicContact CD1-CD1 4.17Å; L36-F51 HydrophobicContact CD1-CE1 3.7Å; L36-F51 HydrophobicContact CD1-CE2 4.46Å; L36-F51 HydrophobicContact CD1-CZ 3.88Å; L36-F51 HydrophobicContact CG-CE1 4.45Å
37	I	98	Very high	95.5	Very high	77 Å²	77	62.8 Å²	62.8	40%	0.395	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	-46.1	177	-61.2	172.5	0	0	0	110.8	D35 L50 N52 K104	D35-I37 PolarHBondContact O-N 2.78Å; I37-L50 HydrophobicContact CB-CB 4.42Å; I37-L50 HydrophobicContact CB-CD2 4.07Å; I37-L50 HydrophobicContact CB-CG 4.3Å; I37-L50 HydrophobicContact CD1-CD2 4.18Å; I37-L50 HydrophobicContact CD1-CG 4.36Å; I37-L50 HydrophobicContact CG2-CD2 3.91Å; I37-L50 PolarHBondContact N-O 2.7Å; I37-N52 HydrophobicContact CD1-CB 3.9Å; I37-N52 HydrophobicContact CG1-CB 4.13Å; I37-K104 HydrophobicContact CD1-CD 3.65Å; I37-K104 HydrophobicContact CD1-CG 3.99Å
38	S	98.1	Very high	95.7	Very high	32 Å²	32	55.3 Å²	55.3	22%	0.224	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	143.5	-175.4	179.2	0	0	0	0	112.9	S40 Y49 L50	S38-S40 PolarHBondContact OG-N 3.29Å; S38-Y49 WeakPolarHBondContact O-CA 3.22Å; S38-L50 PolarHBondContact N-O 2.93Å; S38-L50 PolarHBondContact O-N 3.03Å
39	K	97.1	Very high	95.9	Very high	95 Å²	95	56.7 Å²	56.7	41%	0.413	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	-1.9	175.5	-63.4	-175.3	-179.5	174.8	0	113.7	L36 F41 Y49	L36-K39 HydrophobicContact CD1-CG 4.45Å; L36-K39 HydrophobicContact CD2-CD 4.22Å; L36-K39 HydrophobicContact CD2-CG 3.79Å; K39-F41 PolarHBondContact O-N 2.78Å; K39-Y49 VanDerWaalsContact CA-CD1 3.45Å; K39-Y49 HydrophobicContact CB-CD1 3.79Å; K39-Y49 HydrophobicContact CB-CE1 3.46Å; K39-Y49 VanDerWaalsContact CB-CE1 3.46Å; K39-Y49 HydrophobicContact CD-CE1 4.1Å; K39-Y49 HydrophobicContact CD-CE2 4.46Å; K39-Y49 HydrophobicContact CG-CD1 3.88Å; K39-Y49 HydrophobicContact CG-CE1 3.55Å; K39-Y49 HydrophobicContact CG-CE2 4.25Å; K39-Y49 HydrophobicContact CG-CG 4.37Å
40	S	96.2	Very high	96	Very high	113 Å²	113	55.6 Å²	55.6	79%	0.79	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.4	30.6	-169.3	-53.3	0	0	0	0	113.1	S38	S38-S40 PolarHBondContact OG-N 3.29Å
41	F	97.6	Very high	96.1	Very high	26 Å²	26	55.6 Å²	55.6	11%	0.114	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	156.4	-179.5	-82.2	-106	0	0	0	111	K39 A48 L50 K101 I106	K39-F41 PolarHBondContact O-N 2.78Å; F41-A48 CarbonylContact C-O 3.55Å; F41-A48 WeakPolarHBondContact CB-O 3.43Å; F41-A48 PolarHBondContact N-O 2.71Å; F41-A48 PolarHBondContact O-N 2.88Å; F41-L50 HydrophobicContact CD1-CB 4.5Å; F41-L50 HydrophobicContact CD2-CB 3.77Å; F41-L50 HydrophobicContact CE1-CB 4.49Å; F41-L50 HydrophobicContact CE1-CD1 4.22Å; F41-L50 HydrophobicContact CE1-CD2 4.26Å; F41-L50 HydrophobicContact CE2-CB 3.78Å; F41-L50 HydrophobicContact CE2-CD2 3.84Å; F41-L50 HydrophobicContact CE2-CG 4.34Å; F41-L50 HydrophobicContact CG-CB 4.16Å; F41-L50 HydrophobicContact CZ-CB 4.16Å; F41-L50 HydrophobicContact CZ-CD1 4.38Å; F41-L50 HydrophobicContact CZ-CD2 3.62Å; F41-L50 HydrophobicContact CZ-CG 4.27Å; F41-K101 HydrophobicContact CE1-CD 4.32Å; F41-I106 HydrophobicContact CB-CD1 3.99Å; F41-I106 HydrophobicContact CB-CG1 4.25Å; F41-I106 HydrophobicContact CD1-CD1 4.3Å
42	Q	95.8	Very high	96.2	Very high	117 Å²	117	59 Å²	59	55%	0.547	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	127.6	177.1	-170.2	72.5	4.4	0	0	108.3	G46	Q42-G46 CarbonylContact C-O 3.47Å; Q42-G46 VanDerWaalsContact CD-C 3.4Å; Q42-G46 VanDerWaalsContact NE2-C 3.35Å; Q42-G46 PolarHBondContact NE2-O 3.03Å; Q42-G46 PolarHBondContact OE1-O 2.81Å
43	G	92.9	Very high	96.2	Very high	12 Å²	12	60.4 Å²	60.4	12%	0.124	32%	0.32	C	S	.	.			trans	-83.8	-163.3	168.9	0	0	0	0	0	112.5	G46 E108	G43-G46 PolarHBondContact N-O 2.96Å; G43-E108 WeakPolarHBondContact CA-OE1 3.38Å
44	S	90.9	Very high	96.4	Very high	82 Å²	82	59.3 Å²	59.3	57%	0.573	32%	0.316	S	S	*	.	S	Bend	trans	-73.5	-34.1	175	73.1	0	0	0	0	113.2	E108	S44-E108 PolarHBondContact N-OE1 3.37Å; S44-E108 PolarHBondContact OG-OE2 3.24Å
45	Q	91.1	Very high	96.5	Very high	155 Å²	155	55.9 Å²	55.9	72%	0.724	30%	0.299	S	S	*	.	S	Bend	trans	-112	-5.5	-172.8	-57.6	-50.4	-54.7	0	0	113.4	E108	Q45-E108 PolarHBondContact N-OE1 2.89Å
46	G	95.1	Very high	96.6	Very high	19 Å²	19	54.7 Å²	54.7	20%	0.196	29%	0.293	C	S	.	.	S	Bend	trans	162.4	-155	-177.5	0	0	0	0	0	114.3	Q42 G43	Q42-G46 CarbonylContact C-O 3.47Å; Q42-G46 VanDerWaalsContact CD-C 3.4Å; Q42-G46 VanDerWaalsContact NE2-C 3.35Å; Q42-G46 PolarHBondContact NE2-O 3.03Å; Q42-G46 PolarHBondContact OE1-O 2.81Å; G43-G46 PolarHBondContact N-O 2.96Å
47	R	97.9	Very high	96.6	Very high	172 Å²	172	54 Å²	54	65%	0.649	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.9	144.3	178.1	-65.9	-176.7	-63.7	165	0.5	110.8	L109	R47-L109 HydrophobicContact CB-CD1 4.38Å; R47-L109 HydrophobicContact CB-CD2 4.2Å; R47-L109 WeakPolarHBondContact O-CD1 3.14Å; R47-L109 PolarHBondContact O-N 3.37Å
48	A	98.4	Very high	96.5	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	158.2	178.8	0	0	0	0	0	111	F41 I106 I107 E108	F41-A48 CarbonylContact C-O 3.55Å; F41-A48 WeakPolarHBondContact CB-O 3.43Å; F41-A48 PolarHBondContact N-O 2.71Å; F41-A48 PolarHBondContact O-N 2.88Å; A48-I106 HydrophobicContact CB-CD1 3.53Å; A48-I106 HydrophobicContact CB-CG1 3.59Å; A48-I107 CarbonylContact C-O 3.59Å; A48-I107 VanDerWaalsContact CA-O 3.28Å; A48-I107 WeakPolarHBondContact CA-O 3.2Å; A48-I107 WeakPolarHBondContact CB-O 3.41Å; A48-E108 HydrophobicContact CB-CG 4.21Å
49	Y	98.6	Very high	96.5	Very high	30 Å²	30	51.8 Å²	51.8	12%	0.118	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	143.6	178	-69.7	-8.9	0	0	0	110.7	Y21 L36 S38 K39 F51 I106 I107 L109 M112	Y21-Y49 HydrophobicContact CE1-CD2 4.11Å; Y21-Y49 AromaticContact CE1-CE2 3.97Å; Y21-Y49 HydrophobicContact CE1-CE2 3.97Å; L36-Y49 HydrophobicContact CD1-CD2 3.83Å; L36-Y49 HydrophobicContact CD1-CG 3.82Å; S38-Y49 WeakPolarHBondContact O-CA 3.22Å; K39-Y49 VanDerWaalsContact CA-CD1 3.45Å; K39-Y49 HydrophobicContact CB-CD1 3.79Å; K39-Y49 HydrophobicContact CB-CE1 3.46Å; K39-Y49 VanDerWaalsContact CB-CE1 3.46Å; K39-Y49 HydrophobicContact CD-CE1 4.1Å; K39-Y49 HydrophobicContact CD-CE2 4.46Å; K39-Y49 HydrophobicContact CG-CD1 3.88Å; K39-Y49 HydrophobicContact CG-CE1 3.55Å; K39-Y49 HydrophobicContact CG-CE2 4.25Å; K39-Y49 HydrophobicContact CG-CG 4.37Å; Y49-F51 HydrophobicContact CD2-CZ 4.12Å; Y49-I106 VanDerWaalsContact O-CA 3.3Å; Y49-I106 WeakPolarHBondContact O-CA 2.98Å; Y49-I107 PolarHBondContact N-O 3.35Å; Y49-I107 PolarHBondContact O-N 3.2Å; Y49-L109 HydrophobicContact CD1-CD1 3.52Å; Y49-L109 HydrophobicContact CD2-CD1 4.16Å; Y49-L109 HydrophobicContact CE1-CD1 3.57Å; Y49-L109 HydrophobicContact CE1-CD2 4.03Å; Y49-L109 HydrophobicContact CE1-CG 4.3Å; Y49-L109 HydrophobicContact CE2-CD1 4.2Å; Y49-L109 HydrophobicContact CG-CD1 3.84Å; Y49-M112 HydrophobicContact CD2-CE 3.78Å; Y49-M112 HydrophobicContact CD2-SD 4.42Å; Y49-M112 HydrophobicContact CG-CE 4Å
50	L	98.7	Very high	96.5	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	126.1	173.1	-171.2	75.8	0	0	0	109.8	I37 S38 F41 Y90 Y100 K104 Y105	I37-L50 HydrophobicContact CB-CB 4.42Å; I37-L50 HydrophobicContact CB-CD2 4.07Å; I37-L50 HydrophobicContact CB-CG 4.3Å; I37-L50 HydrophobicContact CD1-CD2 4.18Å; I37-L50 HydrophobicContact CD1-CG 4.36Å; I37-L50 HydrophobicContact CG2-CD2 3.91Å; I37-L50 PolarHBondContact N-O 2.7Å; S38-L50 PolarHBondContact N-O 2.93Å; S38-L50 PolarHBondContact O-N 3.03Å; F41-L50 HydrophobicContact CD1-CB 4.5Å; F41-L50 HydrophobicContact CD2-CB 3.77Å; F41-L50 HydrophobicContact CE1-CB 4.49Å; F41-L50 HydrophobicContact CE1-CD1 4.22Å; F41-L50 HydrophobicContact CE1-CD2 4.26Å; F41-L50 HydrophobicContact CE2-CB 3.78Å; F41-L50 HydrophobicContact CE2-CD2 3.84Å; F41-L50 HydrophobicContact CE2-CG 4.34Å; F41-L50 HydrophobicContact CG-CB 4.16Å; F41-L50 HydrophobicContact CZ-CB 4.16Å; F41-L50 HydrophobicContact CZ-CD1 4.38Å; F41-L50 HydrophobicContact CZ-CD2 3.62Å; F41-L50 HydrophobicContact CZ-CG 4.27Å; L50-Y90 HydrophobicContact CD1-CD2 4.3Å; L50-Y90 HydrophobicContact CD1-CE2 4.1Å; L50-Y100 HydrophobicContact CD2-CE2 4.28Å; L50-K104 HydrophobicContact CD1-CB 3.7Å; L50-K104 HydrophobicContact CD2-CB 4.36Å; L50-K104 HydrophobicContact CG-CB 4.08Å; L50-Y105 CarbonylContact C-O 3.56Å; L50-Y105 WeakPolarHBondContact CA-O 3.42Å
51	F	98.7	Very high	96.5	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	146.6	178.8	-65.9	-84.1	0	0	0	111.8	Y21 A31 D35 L36 Y49 V54 K104 Y105 I107 M112	Y21-F51 AromaticContact CD2-CE1 3.53Å; Y21-F51 HydrophobicContact CD2-CE1 3.53Å; Y21-F51 AromaticContact CD2-CZ 3.57Å; Y21-F51 HydrophobicContact CD2-CZ 3.57Å; Y21-F51 AromaticContact CE2-CE1 3.49Å; Y21-F51 HydrophobicContact CE2-CE1 3.49Å; Y21-F51 VanDerWaalsContact CE2-CE1 3.49Å; Y21-F51 AromaticContact CE2-CZ 3.63Å; Y21-F51 HydrophobicContact CE2-CZ 3.63Å; Y21-F51 HydrophobicContact CG-CE1 4.41Å; Y21-F51 HydrophobicContact CG-CZ 4.04Å; A31-F51 HydrophobicContact CB-CD1 3.65Å; A31-F51 HydrophobicContact CB-CE1 3.82Å; A31-F51 HydrophobicContact CB-CG 4.07Å; A31-F51 HydrophobicContact CB-CZ 4.37Å; D35-F51 HydrophobicContact CB-CD1 4.44Å; D35-F51 CarbonylContact O-C 3.56Å; D35-F51 VanDerWaalsContact O-CA 3.27Å; D35-F51 WeakPolarHBondContact O-CA 3.49Å; L36-F51 HydrophobicContact CB-CD1 4.22Å; L36-F51 HydrophobicContact CB-CE1 3.99Å; L36-F51 HydrophobicContact CD1-CD1 4.17Å; L36-F51 HydrophobicContact CD1-CE1 3.7Å; L36-F51 HydrophobicContact CD1-CE2 4.46Å; L36-F51 HydrophobicContact CD1-CZ 3.88Å; L36-F51 HydrophobicContact CG-CE1 4.45Å; Y49-F51 HydrophobicContact CD2-CZ 4.12Å; F51-V54 HydrophobicContact CB-CG2 3.89Å; F51-V54 HydrophobicContact CG-CG2 4.42Å; F51-K104 WeakPolarHBondContact O-CB 3.44Å; F51-Y105 PolarHBondContact N-O 3.1Å; F51-Y105 PolarHBondContact O-N 3.04Å; F51-I107 HydrophobicContact CD2-CB 4.43Å; F51-I107 HydrophobicContact CD2-CD1 4.13Å; F51-I107 HydrophobicContact CD2-CG1 4.26Å; F51-I107 HydrophobicContact CE2-CB 4.15Å; F51-I107 HydrophobicContact CE2-CD1 4.18Å; F51-I107 HydrophobicContact CE2-CG1 4.39Å; F51-M112 HydrophobicContact CE2-CE 4.12Å; F51-M112 HydrophobicContact CE2-SD 4.1Å; F51-M112 HydrophobicContact CZ-CE 4.47Å; F51-M112 HydrophobicContact CZ-SD 4.08Å
52	N	98.3	Very high	96.6	Very high	74 Å²	74	49.6 Å²	49.6	40%	0.396	29%	0.287	S	S	.	.	S	Bend	trans	-71.7	-40.9	173.1	-175.3	63.8	0	0	0	112.3	D35 I37 K104	D35-N52 HydrophobicContact CB-CB 4.33Å; D35-N52 PolarHBondContact O-N 2.87Å; I37-N52 HydrophobicContact CD1-CB 3.9Å; I37-N52 HydrophobicContact CG1-CB 4.13Å; N52-K104 PolarHBondContact OD1-NZ 3.27Å
53	S	96.5	Very high	96.7	Very high	49 Å²	49	48.6 Å²	48.6	34%	0.343	28%	0.282	S	S	.	.			trans	-141	146.9	179.9	-169	0	0	0	0	110.6
54	V	97.8	Very high	96.9	Very high	13 Å²	13	54.3 Å²	54.3	8%	0.079	31%	0.305	C	S	.	.			trans	-140.5	140.6	176.7	178.9	0	0	0	0	108.4	L30 A31 F51 V57 Y105 I107	L30-V54 HydrophobicContact CB-CG1 4.41Å; L30-V54 CarbonylContact O-C 3.47Å; L30-V54 VanDerWaalsContact O-CA 3.25Å; L30-V54 WeakPolarHBondContact O-CA 3.16Å; L30-V54 WeakPolarHBondContact O-CG1 3.35Å; A31-V54 HydrophobicContact CB-CG2 4.4Å; F51-V54 HydrophobicContact CB-CG2 3.89Å; F51-V54 HydrophobicContact CG-CG2 4.42Å; V54-V57 HydrophobicContact CB-CG2 4.2Å; V54-V57 HydrophobicContact CG1-CB 4.28Å; V54-V57 HydrophobicContact CG1-CG1 3.55Å; V54-V57 HydrophobicContact CG1-CG2 3.69Å; V54-Y105 HydrophobicContact CB-CD1 4.12Å; V54-Y105 HydrophobicContact CB-CD2 4.29Å; V54-Y105 HydrophobicContact CB-CG 3.97Å; V54-Y105 VanDerWaalsContact CG2-CB 3.41Å; V54-Y105 HydrophobicContact CG2-CD1 4.17Å; V54-Y105 HydrophobicContact CG2-CD2 3.97Å; V54-Y105 HydrophobicContact CG2-CG 3.59Å; V54-I107 HydrophobicContact CG1-CD1 3.87Å; V54-I107 HydrophobicContact CG2-CD1 3.84Å
55	V	96.5	Very high	97.2	Very high	36 Å²	36	53.4 Å²	53.4	22%	0.218	29%	0.289	C	S	.	.			trans	-115.2	165.3	178.7	-61.1	0	0	0	0	111.3	A12 L14 L30 V57	A12-V55 HydrophobicContact CB-CB 3.87Å; A12-V55 HydrophobicContact CB-CG1 4.24Å; A12-V55 HydrophobicContact CB-CG2 4.18Å; L14-V55 HydrophobicContact CD1-CG2 3.96Å; L14-V55 HydrophobicContact CD2-CG1 4.24Å; L14-V55 HydrophobicContact CD2-CG2 4.01Å; L14-V55 HydrophobicContact CG-CG2 4.01Å; L30-V55 PolarHBondContact O-N 2.8Å; V55-V57 PolarHBondContact O-N 2.77Å
56	N	96.9	Very high	97.5	Very high	13 Å²	13	52.9 Å²	52.9	7%	0.07	29%	0.291	C	S	.	.	S	Bend	trans	56.6	32.6	179.2	-53.8	-46.2	0	0	0	113.8	Q11 A12 A28 H29 E80	Q11-N56 WeakPolarHBondContact CA-OD1 3.49Å; A12-N56 PolarHBondContact N-OD1 2.96Å; A12-N56 PolarHBondContact O-ND2 2.81Å; A28-N56 HydrophobicContact CB-CB 4.49Å; H29-N56 WeakPolarHBondContact O-CB 3.44Å; H29-N56 PolarHBondContact O-ND2 2.77Å; N56-E80 PolarHBondContact O-N 3.01Å
57	V	97.5	Very high	97.5	Very high	20 Å²	20	54.2 Å²	54.2	12%	0.121	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	138.7	175.7	-63.7	0	0	0	0	111.6	L30 V54 V55 I77 Y78 L86	L30-V57 HydrophobicContact CD2-CG1 3.93Å; V54-V57 HydrophobicContact CB-CG2 4.2Å; V54-V57 HydrophobicContact CG1-CB 4.28Å; V54-V57 HydrophobicContact CG1-CG1 3.55Å; V54-V57 HydrophobicContact CG1-CG2 3.69Å; V55-V57 PolarHBondContact O-N 2.77Å; V57-I77 HydrophobicContact CB-CB 4.37Å; V57-Y78 CarbonylContact C-O 3.52Å; V57-Y78 VanDerWaalsContact CA-O 3.24Å; V57-Y78 WeakPolarHBondContact CA-O 3.24Å; V57-L86 HydrophobicContact CG1-CD1 3.64Å
58	G	96.5	Very high	97.2	Very high	6 Å²	6	54.5 Å²	54.5	6%	0.062	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	149	167.2	0	0	0	0	0	109.2	I77 Y78 E80	G58-I77 VanDerWaalsContact O-CA 3.27Å; G58-I77 WeakPolarHBondContact O-CA 3.27Å; G58-Y78 PolarHBondContact N-O 2.79Å; G58-Y78 PolarHBondContact O-N 2.78Å; G58-E80 VanDerWaalsContact N-CG 3.29Å
59	C	96.8	Very high	97	Very high	56 Å²	56	56.7 Å²	56.7	38%	0.378	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	135	174.9	-62.3	0	0	0	0	109.5	A75 D76	C59-A75 HydrophobicContact CB-CB 4.46Å; C59-D76 CarbonylContact C-O 3.59Å; C59-D76 WeakPolarHBondContact CA-O 3.48Å
60	G	96.9	Very high	96.8	Very high	26 Å²	26	56 Å²	56	27%	0.268	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	-175.2	165.4	0	0	0	0	0	112.1	D76	G60-D76 PolarHBondContact N-O 3.31Å
61	P	97.8	Very high	96.8	Very high	100 Å²	100	58.7 Å²	58.7	65%	0.649	34%	0.336	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65	151.1	170.2	30.3	-34.3	0	0	0	110.8
62	A	98	Very high	96.7	Very high	61 Å²	61	58.7 Å²	58.7	50%	0.504	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	133.8	172.5	0	0	0	0	0	110.4	V74 E91	A62-V74 CarbonylContact C-O 3.5Å; A62-V74 WeakPolarHBondContact CA-O 3.27Å; A62-E91 HydrophobicContact CB-CB 4.37Å; A62-E91 HydrophobicContact CB-CG 3.96Å
63	E	98.1	Very high	96.8	Very high	96 Å²	96	55.8 Å²	55.8	45%	0.449	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	143.2	179	-64.3	177.1	165.4	0	0	110	R65 A73 V74	E63-R65 IonicContact OE2-CZ 3.67Å; E63-R65 IonicContact OE2-NE 3.4Å; E63-R65 IonicContact OE2-NH2 3.73Å; E63-R65 PolarHBondContact OE2-NH2 3.2Å; E63-A73 CarbonylContact O-C 3.56Å; E63-A73 WeakPolarHBondContact O-CA 3.49Å; E63-V74 PolarHBondContact N-O 2.97Å; E63-V74 PolarHBondContact O-N 2.87Å
64	E	98.3	Very high	96.9	Very high	132 Å²	132	53.4 Å²	53.4	62%	0.617	31%	0.306	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75	128.8	173.7	-69.2	-174.7	175.1	0	0	110.8	L71 H72	E64-L71 HydrophobicContact CB-CD1 4.26Å; E64-H72 CarbonylContact C-O 3.59Å; E64-H72 WeakPolarHBondContact CA-O 3.25Å
65	R	97.3	Very high	96.9	Very high	63 Å²	63	52.9 Å²	52.9	24%	0.238	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	133.3	177.6	-60.4	-170.8	-170	162.9	-1	110.4	E63 L67 H72 V74 D76	E63-R65 IonicContact OE2-CZ 3.67Å; E63-R65 IonicContact OE2-NE 3.4Å; E63-R65 IonicContact OE2-NH2 3.73Å; E63-R65 PolarHBondContact OE2-NH2 3.2Å; R65-L67 HydrophobicContact CB-CD2 4.36Å; R65-L67 HydrophobicContact CB-CG 4.49Å; R65-L67 PolarHBondContact O-N 3.4Å; R65-H72 PolarHBondContact N-O 3.27Å; R65-H72 PolarHBondContact O-N 3.19Å; R65-V74 HydrophobicContact CB-CG2 4.14Å; R65-V74 VanDerWaalsContact CD-CG2 3.49Å; R65-V74 HydrophobicContact CG-CG2 3.81Å; R65-D76 IonicContact CZ-OD1 2.96Å; R65-D76 IonicContact CZ-OD2 2.86Å; R65-D76 IonicContact NH1-OD1 2.7Å; R65-D76 PolarHBondContact NH1-OD1 2.72Å; R65-D76 IonicContact NH1-OD2 3.64Å; R65-D76 VanDerWaalsContact NH2-CG 3.29Å; R65-D76 IonicContact NH2-OD1 2.81Å; R65-D76 PolarHBondContact NH2-OD1 2.85Å; R65-D76 IonicContact NH2-OD2 2.64Å; R65-D76 PolarHBondContact NH2-OD2 3.32Å
66	L	96.4	Very high	97	Very high	145 Å²	145	53.7 Å²	53.7	76%	0.759	31%	0.306	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.8	112.1	167.5	-74.3	171	0	0	0	108.5	L71	L66-L71 HydrophobicContact CD2-CB 3.98Å; L66-L71 HydrophobicContact CD2-CD1 3.78Å; L66-L71 HydrophobicContact CD2-CG 4.49Å; L66-L71 HydrophobicContact CG-CD1 4.02Å
67	L	95.1	Very high	97.1	Very high	46 Å²	46	53.1 Å²	53.1	24%	0.241	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	174.1	176.4	-59.3	177	0	0	0	109.6	R65 T69 G70 H72 V74 W88 Y90	R65-L67 HydrophobicContact CB-CD2 4.36Å; R65-L67 HydrophobicContact CB-CG 4.49Å; R65-L67 PolarHBondContact O-N 3.4Å; L67-T69 PolarHBondContact O-N 2.88Å; L67-G70 PolarHBondContact N-O 2.89Å; L67-G70 PolarHBondContact O-N 2.92Å; L67-H72 HydrophobicContact CD1-CB 4.24Å; L67-V74 HydrophobicContact CD1-CG1 4.25Å; L67-W88 HydrophobicContact CD1-CZ2 4.18Å; L67-W88 HydrophobicContact CD2-CZ2 4.33Å; L67-Y90 HydrophobicContact CD1-CE1 3.71Å
68	L	92.9	Very high	97.1	Very high	179 Å²	179	55.8 Å²	55.8	94%	0.937	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	-32.5	-178.9	-178	63.9	0	0	0	113.4
69	T	92.6	Very high	97.1	Very high	45 Å²	45	55.5 Å²	55.5	28%	0.276	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.9	21.4	-178.3	65.5	0	0	0	0	113.2	L67 H72 Q98 K101	L67-T69 PolarHBondContact O-N 2.88Å; T69-H72 PolarHBondContact OG1-CE1 2.78Å; T69-H72 VanDerWaalsContact OG1-CE1 3.24Å; T69-Q98 PolarHBondContact OG1-OE1 2.95Å; T69-K101 PolarHBondContact OG1-NZ 3.03Å
70	G	95.3	Very high	97.1	Very high	16 Å²	16	55.6 Å²	55.6	17%	0.165	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	105.4	-169.8	178.8	0	0	0	0	0	114.6	L67 H72	L67-G70 PolarHBondContact N-O 2.89Å; L67-G70 PolarHBondContact O-N 2.92Å; G70-H72 PolarHBondContact O-CE1 3.47Å; G70-H72 PolarHBondContact O-ND1 3.35Å
71	L	97.6	Very high	97	Very high	56 Å²	56	58.2 Å²	58.2	29%	0.293	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	133.8	-178.2	-171.1	68	0	0	0	111.2	E64 L66 F94	E64-L71 HydrophobicContact CB-CD1 4.26Å; L66-L71 HydrophobicContact CD2-CB 3.98Å; L66-L71 HydrophobicContact CD2-CD1 3.78Å; L66-L71 HydrophobicContact CD2-CG 4.49Å; L66-L71 HydrophobicContact CG-CD1 4.02Å; L71-F94 HydrophobicContact CB-CD2 4Å; L71-F94 HydrophobicContact CD2-CD2 3.79Å; L71-F94 HydrophobicContact CD2-CE2 3.91Å; L71-F94 HydrophobicContact CD2-CG 4.38Å; L71-F94 HydrophobicContact CG-CD2 3.72Å; L71-F94 HydrophobicContact CG-CE2 3.89Å; L71-F94 WeakPolarHBondContact O-CD2 3.49Å
72	H	98.5	Very high	96.9	Very high	1 Å²	1	55.4 Å²	55.4	1%	0.005	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	145.9	175.3	-61.3	72.9	0	0	0	110	E64 R65 L67 T69 G70 V74 Y90 Q92	E64-H72 CarbonylContact C-O 3.59Å; E64-H72 WeakPolarHBondContact CA-O 3.25Å; R65-H72 PolarHBondContact N-O 3.27Å; R65-H72 PolarHBondContact O-N 3.19Å; L67-H72 HydrophobicContact CD1-CB 4.24Å; T69-H72 PolarHBondContact OG1-CE1 2.78Å; T69-H72 VanDerWaalsContact OG1-CE1 3.24Å; G70-H72 PolarHBondContact O-CE1 3.47Å; G70-H72 PolarHBondContact O-ND1 3.35Å; H72-V74 HydrophobicContact CB-CG1 3.91Å; H72-Y90 HydrophobicContact CB-CD1 4.09Å; H72-Y90 HydrophobicContact CB-CE1 4.24Å; H72-Y90 AromaticContact CD2-CD1 3.54Å; H72-Y90 AromaticContact CD2-CE1 3.58Å; H72-Y90 AromaticContact CG-CD1 3.96Å; H72-Y90 AromaticContact CG-CE1 3.84Å; H72-Q92 CarbonylContact C-O 3.57Å; H72-Q92 VanDerWaalsContact CA-O 3.28Å; H72-Q92 WeakPolarHBondContact CA-O 3.16Å
73	A	98.6	Very high	96.9	Very high	12 Å²	12	58.1 Å²	58.1	10%	0.099	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	123.8	160.1	0	0	0	0	0	108.4	E63 E91 Q92	E63-A73 CarbonylContact O-C 3.56Å; E63-A73 WeakPolarHBondContact O-CA 3.49Å; A73-E91 HydrophobicContact CB-CB 4.43Å; A73-E91 PolarHBondContact O-N 3.06Å; A73-Q92 HydrophobicContact CB-CB 3.85Å; A73-Q92 PolarHBondContact N-O 3.22Å; A73-Q92 PolarHBondContact O-N 3.1Å; A73-Q92 VanDerWaalsContact O-N 3.09Å
74	V	98.5	Very high	96.8	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	146.4	-178	-57.7	0	0	0	0	110.9	A62 E63 R65 L67 H72 W88 K89 Y90	A62-V74 CarbonylContact C-O 3.5Å; A62-V74 WeakPolarHBondContact CA-O 3.27Å; E63-V74 PolarHBondContact N-O 2.97Å; E63-V74 PolarHBondContact O-N 2.87Å; R65-V74 HydrophobicContact CB-CG2 4.14Å; R65-V74 VanDerWaalsContact CD-CG2 3.49Å; R65-V74 HydrophobicContact CG-CG2 3.81Å; L67-V74 HydrophobicContact CD1-CG1 4.25Å; H72-V74 HydrophobicContact CB-CG1 3.91Å; V74-W88 HydrophobicContact CB-CB 4.21Å; V74-W88 HydrophobicContact CB-CG 4.01Å; V74-W88 HydrophobicContact CG1-CG 4.36Å; V74-W88 HydrophobicContact CG2-CG 4.32Å; V74-K89 CarbonylContact C-O 3.57Å; V74-K89 WeakPolarHBondContact CA-O 3.3Å; V74-Y90 HydrophobicContact CG1-CD1 3.89Å; V74-Y90 HydrophobicContact CG1-CE1 4.24Å; V74-Y90 HydrophobicContact CG1-CG 4.46Å
75	A	98.6	Very high	96.8	Very high	1 Å²	1	52.7 Å²	52.7	1%	0.008	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	123.6	174.8	0	0	0	0	0	109.3	C59 I77 W88 K89 E91	C59-A75 HydrophobicContact CB-CB 4.46Å; A75-I77 PolarHBondContact O-N 2.87Å; A75-W88 CarbonylContact O-C 3.6Å; A75-W88 WeakPolarHBondContact O-CA 3.35Å; A75-W88 VanDerWaalsContact O-CB 3.3Å; A75-W88 WeakPolarHBondContact O-CB 3.27Å; A75-K89 PolarHBondContact N-O 3.48Å; A75-K89 PolarHBondContact O-N 2.75Å; A75-E91 HydrophobicContact CB-CG 4.06Å
76	D	98.4	Very high	96.8	Very high	54 Å²	54	49.7 Å²	49.7	29%	0.289	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.6	137.5	176	-73.1	-29.1	0	0	0	110.4	C59 G60 R65	C59-D76 CarbonylContact C-O 3.59Å; C59-D76 WeakPolarHBondContact CA-O 3.48Å; G60-D76 PolarHBondContact N-O 3.31Å; R65-D76 IonicContact CZ-OD1 2.96Å; R65-D76 IonicContact CZ-OD2 2.86Å; R65-D76 IonicContact NH1-OD1 2.7Å; R65-D76 PolarHBondContact NH1-OD1 2.72Å; R65-D76 IonicContact NH1-OD2 3.64Å; R65-D76 VanDerWaalsContact NH2-CG 3.29Å; R65-D76 IonicContact NH2-OD1 2.81Å; R65-D76 PolarHBondContact NH2-OD1 2.85Å; R65-D76 IonicContact NH2-OD2 2.64Å; R65-D76 PolarHBondContact NH2-OD2 3.32Å
77	I	98.5	Very high	96.9	Very high	1 Å²	1	42.9 Å²	42.9	1%	0.005	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	139.7	175.7	63.5	171.5	0	0	0	110.5	V57 G58 A75 L86 G87 K89 Y105 I107	V57-I77 HydrophobicContact CB-CB 4.37Å; G58-I77 VanDerWaalsContact O-CA 3.27Å; G58-I77 WeakPolarHBondContact O-CA 3.27Å; A75-I77 PolarHBondContact O-N 2.87Å; I77-L86 HydrophobicContact CD1-CB 4.47Å; I77-L86 HydrophobicContact CG1-CB 4.27Å; I77-L86 PolarHBondContact O-N 3.34Å; I77-G87 VanDerWaalsContact CG1-C 3.48Å; I77-G87 WeakPolarHBondContact CG1-O 3.14Å; I77-G87 PolarHBondContact N-O 2.91Å; I77-K89 HydrophobicContact CG2-CB 4.09Å; I77-Y105 HydrophobicContact CD1-CD1 4.21Å; I77-Y105 HydrophobicContact CG2-CD1 4.32Å; I77-I107 HydrophobicContact CD1-CG1 4.1Å
78	Y	98.1	Very high	97.1	Very high	75 Å²	75	41.6 Å²	41.6	29%	0.294	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	149.2	177	52.5	-90.5	0	0	0	110	V57 G58 E80 H83 T84	V57-Y78 CarbonylContact C-O 3.52Å; V57-Y78 VanDerWaalsContact CA-O 3.24Å; V57-Y78 WeakPolarHBondContact CA-O 3.24Å; G58-Y78 PolarHBondContact N-O 2.79Å; G58-Y78 PolarHBondContact O-N 2.78Å; Y78-E80 PolarHBondContact O-N 2.88Å; Y78-H83 AromaticContact CD2-ND1 3.95Å; Y78-T84 CarbonylContact C-O 3.58Å; Y78-T84 VanDerWaalsContact CA-O 3.26Å; Y78-T84 WeakPolarHBondContact CA-O 3.43Å
79	C	97.6	Very high	97.4	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	127.7	173.6	-177.5	0	0	0	0	109.6	N81 H83 T84 L86	C79-N81 PolarHBondContact O-N 3.37Å; C79-H83 WeakPolarHBondContact O-CA 3.42Å; C79-H83 PolarHBondContact O-N 2.91Å; C79-T84 PolarHBondContact N-O 2.94Å; C79-L86 HydrophobicContact CB-CD1 4.05Å; C79-L86 HydrophobicContact CB-CD2 4.34Å; C79-L86 HydrophobicContact CB-CG 4.37Å
80	E	96.3	Very high	97.7	Very high	59 Å²	59	33 Å²	33	28%	0.276	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-20.1	179.3	-70.2	-171.6	133.7	0	0	112.8	K8 N56 G58 Y78	K8-E80 WeakPolarHBondContact CD-OE2 3.4Å; K8-E80 WeakPolarHBondContact CE-OE1 3.26Å; K8-E80 IonicContact NZ-OE1 2.71Å; K8-E80 PolarHBondContact NZ-OE1 2.73Å; K8-E80 IonicContact NZ-OE2 2.93Å; K8-E80 PolarHBondContact NZ-OE2 3.21Å; N56-E80 PolarHBondContact O-N 3.01Å; G58-E80 VanDerWaalsContact N-CG 3.29Å; Y78-E80 PolarHBondContact O-N 2.88Å
81	N	95.1	Very high	97.8	Very high	80 Å²	80	35.6 Å²	35.6	43%	0.428	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-45.1	-177.5	-173.5	59.9	0	0	0	113.5	Q11 C26 A28 C79	Q11-N81 VanDerWaalsContact NE2-CG 3.26Å; Q11-N81 PolarHBondContact NE2-OD1 2.86Å; C26-N81 VanDerWaalsContact CB-ND2 3.25Å; C26-N81 WeakPolarHBondContact CB-ND2 3.49Å; C26-N81 PolarHBondContact SG-ND2 3.34Å; A28-N81 HydrophobicContact CB-CB 4.18Å; C79-N81 PolarHBondContact O-N 3.37Å
82	C	96.3	Very high	97.8	Very high	41 Å²	41	37.1 Å²	37.1	28%	0.277	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113.1	-0.3	-177.5	69.4	0	0	0	0	114.5	C23 C26 T84	C23-C82 VanDerWaalsContact SG-SG 3.61Å; C26-C82 HydrophobicContact CB-CB 3.82Å; C26-C82 VanDerWaalsContact SG-SG 3.63Å; C82-T84 PolarHBondContact O-N 2.8Å; C82-T84 PolarHBondContact SG-OG1 3.34Å
83	H	96.2	Very high	97.8	Very high	119 Å²	119	37 Å²	37	55%	0.551	19%	0.188	S	C	*	.			trans	58.7	10.1	179.3	-57.6	-62.3	0	0	0	115.9	Y78 C79 T85	Y78-H83 AromaticContact CD2-ND1 3.95Å; C79-H83 WeakPolarHBondContact O-CA 3.42Å; C79-H83 PolarHBondContact O-N 2.91Å; H83-T85 PolarHBondContact O-N 3.38Å
84	T	97.1	Very high	97.7	Very high	36 Å²	36	40.9 Å²	40.9	22%	0.221	20%	0.202	C	C	.	.			trans	-64.3	130.3	171.1	-48.6	0	0	0	0	109.6	H25 Y78 C79 C82 L86	H25-T84 PolarHBondContact CD2-OG1 3.29Å; Y78-T84 CarbonylContact C-O 3.58Å; Y78-T84 VanDerWaalsContact CA-O 3.26Å; Y78-T84 WeakPolarHBondContact CA-O 3.43Å; C79-T84 PolarHBondContact N-O 2.94Å; C82-T84 PolarHBondContact O-N 2.8Å; C82-T84 PolarHBondContact SG-OG1 3.34Å; T84-L86 WeakPolarHBondContact O-CG 3.43Å; T84-L86 PolarHBondContact O-N 3.48Å
85	T	97.7	Very high	97.6	Very high	78 Å²	78	45.2 Å²	45.2	48%	0.479	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	129.9	168.1	-53.5	0	0	0	0	110	H83 H111	H83-T85 PolarHBondContact O-N 3.38Å; T85-H111 PolarHBondContact O-CD2 3.17Å
86	L	98.3	Very high	97.6	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	-26.1	-175.7	-55.9	177.2	0	0	0	112.6	L30 V57 I77 C79 T84 I107 E108 H111	L30-L86 HydrophobicContact CD1-CD1 3.89Å; L30-L86 HydrophobicContact CD1-CD2 4.47Å; L30-L86 HydrophobicContact CD2-CD1 3.54Å; L30-L86 HydrophobicContact CG-CD1 4.38Å; V57-L86 HydrophobicContact CG1-CD1 3.64Å; I77-L86 HydrophobicContact CD1-CB 4.47Å; I77-L86 HydrophobicContact CG1-CB 4.27Å; I77-L86 PolarHBondContact O-N 3.34Å; C79-L86 HydrophobicContact CB-CD1 4.05Å; C79-L86 HydrophobicContact CB-CD2 4.34Å; C79-L86 HydrophobicContact CB-CG 4.37Å; T84-L86 WeakPolarHBondContact O-CG 3.43Å; T84-L86 PolarHBondContact O-N 3.48Å; L86-I107 HydrophobicContact CB-CG2 4.29Å; L86-I107 WeakPolarHBondContact O-CA 3.46Å; L86-E108 PolarHBondContact O-N 2.99Å; L86-H111 HydrophobicContact CD2-CB 3.7Å
87	G	98.3	Very high	97.5	Very high	2 Å²	2	53.7 Å²	53.7	2%	0.021	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	157.4	-140.2	-172.6	0	0	0	0	0	109.9	I77 I106	I77-G87 VanDerWaalsContact CG1-C 3.48Å; I77-G87 WeakPolarHBondContact CG1-O 3.14Å; I77-G87 PolarHBondContact N-O 2.91Å; G87-I106 WeakPolarHBondContact CA-O 3.18Å
88	W	98.6	Very high	97.5	Very high	19 Å²	19	54.9 Å²	54.9	7%	0.072	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	163	178.3	62.1	86.6	0	0	0	113.3	L67 V74 A75 Y90 I106	L67-W88 HydrophobicContact CD1-CZ2 4.18Å; L67-W88 HydrophobicContact CD2-CZ2 4.33Å; V74-W88 HydrophobicContact CB-CB 4.21Å; V74-W88 HydrophobicContact CB-CG 4.01Å; V74-W88 HydrophobicContact CG1-CG 4.36Å; V74-W88 HydrophobicContact CG2-CG 4.32Å; A75-W88 CarbonylContact O-C 3.6Å; A75-W88 WeakPolarHBondContact O-CA 3.35Å; A75-W88 VanDerWaalsContact O-CB 3.3Å; A75-W88 WeakPolarHBondContact O-CB 3.27Å; W88-Y90 AromaticContact NE1-CE1 3.92Å; W88-Y90 AromaticContact NE1-CE2 3.57Å; W88-Y90 AromaticContact NE1-CZ 3.48Å; W88-I106 HydrophobicContact CB-CG2 4.45Å; W88-I106 HydrophobicContact CD2-CG2 3.27Å; W88-I106 VanDerWaalsContact CE2-CG2 3.41Å; W88-I106 HydrophobicContact CE3-CG2 3.59Å; W88-I106 HydrophobicContact CG-CG2 3.67Å; W88-I106 HydrophobicContact CH2-CD1 3.97Å; W88-I106 HydrophobicContact CH2-CG2 4.14Å; W88-I106 HydrophobicContact CZ2-CD1 3.75Å; W88-I106 HydrophobicContact CZ2-CG2 3.86Å; W88-I106 HydrophobicContact CZ3-CG2 4Å; W88-I106 VanDerWaalsContact N-CG2 3.35Å; W88-I106 PolarHBondContact N-O 3.21Å; W88-I106 WeakPolarHBondContact O-CG2 3.43Å; W88-I106 PolarHBondContact O-N 2.8Å
89	K	98.8	Very high	97.5	Very high	37 Å²	37	54.8 Å²	54.8	16%	0.161	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	136.1	166.9	-177.8	-174.9	165.4	-138.1	0	109	V74 A75 I77 E91 K104 Y105	V74-K89 CarbonylContact C-O 3.57Å; V74-K89 WeakPolarHBondContact CA-O 3.3Å; A75-K89 PolarHBondContact N-O 3.48Å; A75-K89 PolarHBondContact O-N 2.75Å; I77-K89 HydrophobicContact CG2-CB 4.09Å; K89-E91 VanDerWaalsContact CD-OE1 3.3Å; K89-E91 WeakPolarHBondContact CD-OE1 3.49Å; K89-E91 WeakPolarHBondContact CE-OE1 3.38Å; K89-E91 IonicContact NZ-OE1 3.78Å; K89-E91 PolarHBondContact NZ-OE1 3.2Å; K89-E91 IonicContact NZ-OE2 3.71Å; K89-E91 PolarHBondContact NZ-OE2 3.38Å; K89-E91 PolarHBondContact O-N 3.29Å; K89-K104 WeakPolarHBondContact CA-O 3.05Å; K89-Y105 HydrophobicContact CB-CD1 3.82Å; K89-Y105 HydrophobicContact CB-CE1 3.87Å; K89-Y105 HydrophobicContact CD-CD1 4.3Å; K89-Y105 HydrophobicContact CD-CE1 3.55Å; K89-Y105 HydrophobicContact CG-CD1 3.97Å; K89-Y105 HydrophobicContact CG-CE1 3.73Å
90	Y	98.6	Very high	97.5	Very high	7 Å²	7	60.7 Å²	60.7	3%	0.027	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	114	169.2	-73	-88.1	0	0	0	109.2	L50 L67 H72 V74 W88 K101 G103 K104	L50-Y90 HydrophobicContact CD1-CD2 4.3Å; L50-Y90 HydrophobicContact CD1-CE2 4.1Å; L67-Y90 HydrophobicContact CD1-CE1 3.71Å; H72-Y90 HydrophobicContact CB-CD1 4.09Å; H72-Y90 HydrophobicContact CB-CE1 4.24Å; H72-Y90 AromaticContact CD2-CD1 3.54Å; H72-Y90 AromaticContact CD2-CE1 3.58Å; H72-Y90 AromaticContact CG-CD1 3.96Å; H72-Y90 AromaticContact CG-CE1 3.84Å; V74-Y90 HydrophobicContact CG1-CD1 3.89Å; V74-Y90 HydrophobicContact CG1-CE1 4.24Å; V74-Y90 HydrophobicContact CG1-CG 4.46Å; W88-Y90 AromaticContact NE1-CE1 3.92Å; W88-Y90 AromaticContact NE1-CE2 3.57Å; W88-Y90 AromaticContact NE1-CZ 3.48Å; Y90-K101 WeakPolarHBondContact CB-O 3.33Å; Y90-K101 HydrophobicContact CD1-CB 4.13Å; Y90-K101 HydrophobicContact CD1-CD 4.4Å; Y90-K101 HydrophobicContact CD2-CB 4.08Å; Y90-K101 HydrophobicContact CE1-CB 4.49Å; Y90-K101 HydrophobicContact CE1-CD 3.98Å; Y90-K101 HydrophobicContact CE2-CB 4.47Å; Y90-K101 HydrophobicContact CE2-CD 4.4Å; Y90-K101 HydrophobicContact CG-CB 3.9Å; Y90-G103 PolarHBondContact O-N 2.99Å; Y90-K104 PolarHBondContact N-O 3.48Å
91	E	98.4	Very high	97.6	Very high	70 Å²	70	58 Å²	58	33%	0.327	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	-40	176.2	-65	-64.2	168.6	0	0	111.1	A62 A73 A75 K89	A62-E91 HydrophobicContact CB-CB 4.37Å; A62-E91 HydrophobicContact CB-CG 3.96Å; A73-E91 HydrophobicContact CB-CB 4.43Å; A73-E91 PolarHBondContact O-N 3.06Å; A75-E91 HydrophobicContact CB-CG 4.06Å; K89-E91 VanDerWaalsContact CD-OE1 3.3Å; K89-E91 WeakPolarHBondContact CD-OE1 3.49Å; K89-E91 WeakPolarHBondContact CE-OE1 3.38Å; K89-E91 IonicContact NZ-OE1 3.78Å; K89-E91 PolarHBondContact NZ-OE1 3.2Å; K89-E91 IonicContact NZ-OE2 3.71Å; K89-E91 PolarHBondContact NZ-OE2 3.38Å; K89-E91 PolarHBondContact O-N 3.29Å
92	Q	98.4	Very high	97.7	Very high	87 Å²	87	57.3 Å²	57.3	41%	0.407	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	142.4	179.7	-162.8	174.2	22.5	0	0	111.7	H72 A73 E102	H72-Q92 CarbonylContact C-O 3.57Å; H72-Q92 VanDerWaalsContact CA-O 3.28Å; H72-Q92 WeakPolarHBondContact CA-O 3.16Å; A73-Q92 HydrophobicContact CB-CB 3.85Å; A73-Q92 PolarHBondContact N-O 3.22Å; A73-Q92 PolarHBondContact O-N 3.1Å; A73-Q92 VanDerWaalsContact O-N 3.09Å; Q92-E102 WeakPolarHBondContact CA-OE1 3.28Å
93	A	97.6	Very high	97.8	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	135.6	167.7	0	0	0	0	0	109.7	Q98 K99 E102	A93-Q98 HydrophobicContact CB-CB 3.81Å; A93-K99 HydrophobicContact CB-CD 4.43Å; A93-K99 WeakPolarHBondContact O-CE 3.22Å; A93-K99 PolarHBondContact O-NZ 2.99Å; A93-E102 HydrophobicContact CB-CG 4.22Å; A93-E102 PolarHBondContact N-OE1 3.06Å
94	F	96.6	Very high	98	Very high	93 Å²	93	53.4 Å²	53.4	41%	0.408	27%	0.269	S	S	.	.	S	Bend	trans	-89.1	-18.5	-177.4	-63.7	-85.1	0	0	0	112.8	L71	L71-F94 HydrophobicContact CB-CD2 4Å; L71-F94 HydrophobicContact CD2-CD2 3.79Å; L71-F94 HydrophobicContact CD2-CE2 3.91Å; L71-F94 HydrophobicContact CD2-CG 4.38Å; L71-F94 HydrophobicContact CG-CD2 3.72Å; L71-F94 HydrophobicContact CG-CE2 3.89Å; L71-F94 WeakPolarHBondContact O-CD2 3.49Å
95	E	97.3	Very high	98	Very high	91 Å²	91	53.7 Å²	53.7	43%	0.425	27%	0.267	S	S	.	.	S	Bend	trans	-95.4	133.4	174.7	-65.7	-179.7	-155.3	0	0	111.5	S97 Q98 K99	E95-S97 PolarHBondContact O-N 3.24Å; E95-Q98 HydrophobicContact CB-CB 4.4Å; E95-Q98 HydrophobicContact CB-CG 4.01Å; E95-Q98 PolarHBondContact O-N 3.03Å; E95-K99 PolarHBondContact O-N 3.39Å
96	L	96.9	Very high	98.1	Very high	159 Å²	159	50 Å²	50	83%	0.832	24%	0.244	S	C	*	.	G	3₁₀ helix	trans	-57	-37.8	179.8	-70.3	175.1	0	0	0	112.8	Q98 K99	L96-Q98 PolarHBondContact O-N 3.41Å; L96-K99 HydrophobicContact CD2-CG 4.48Å; L96-K99 WeakPolarHBondContact O-CB 3.46Å; L96-K99 PolarHBondContact O-N 3.2Å
97	S	97.4	Very high	98.1	Very high	74 Å²	74	50 Å²	50	52%	0.517	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-64.2	-18.8	178.4	64.9	0	0	0	0	113.2	E95 Y100	E95-S97 PolarHBondContact O-N 3.24Å; S97-Y100 WeakPolarHBondContact O-CD1 3.46Å; S97-Y100 WeakPolarHBondContact O-CE1 3.34Å
98	Q	97.7	Very high	98.1	Very high	26 Å²	26	50.2 Å²	50.2	12%	0.121	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-104.9	-4.2	-177.2	-54.8	-51.8	-50.5	0	0	113.2	T69 A93 E95 L96 Y100 K101	T69-Q98 PolarHBondContact OG1-OE1 2.95Å; A93-Q98 HydrophobicContact CB-CB 3.81Å; E95-Q98 HydrophobicContact CB-CB 4.4Å; E95-Q98 HydrophobicContact CB-CG 4.01Å; E95-Q98 PolarHBondContact O-N 3.03Å; L96-Q98 PolarHBondContact O-N 3.41Å; Q98-Y100 PolarHBondContact O-N 2.79Å; Q98-Y100 VanDerWaalsContact O-N 3.12Å; Q98-K101 WeakPolarHBondContact O-CB 3.1Å; Q98-K101 WeakPolarHBondContact O-CG 3.25Å; Q98-K101 PolarHBondContact O-N 2.83Å
99	K	98	Very high	98	Very high	72 Å²	72	51.4 Å²	51.4	31%	0.313	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-57.8	-27.6	-177.9	-74	-65.2	-166.9	-174.6	0	114.4	A93 E95 L96 K101 E102	A93-K99 HydrophobicContact CB-CD 4.43Å; A93-K99 WeakPolarHBondContact O-CE 3.22Å; A93-K99 PolarHBondContact O-NZ 2.99Å; E95-K99 PolarHBondContact O-N 3.39Å; L96-K99 HydrophobicContact CD2-CG 4.48Å; L96-K99 WeakPolarHBondContact O-CB 3.46Å; L96-K99 PolarHBondContact O-N 3.2Å; K99-K101 PolarHBondContact O-N 3.19Å; K99-K101 VanDerWaalsContact O-N 3.09Å; K99-E102 VanDerWaalsContact CD-CD 3.43Å; K99-E102 HydrophobicContact CD-CG 4.32Å; K99-E102 WeakPolarHBondContact CD-OE1 3.35Å; K99-E102 WeakPolarHBondContact CE-OE1 3.28Å; K99-E102 IonicContact NZ-OE1 3.27Å; K99-E102 PolarHBondContact NZ-OE1 2.8Å; K99-E102 IonicContact NZ-OE2 2.8Å; K99-E102 WeakPolarHBondContact O-CB 3.47Å; K99-E102 PolarHBondContact O-N 2.61Å
100	Y	97.8	Very high	98	Very high	124 Å²	124	53 Å²	53	49%	0.486	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-61.4	-18.7	176.3	77.2	-90.2	0	0	0	113.6	L50 S97 Q98 K104	L50-Y100 HydrophobicContact CD2-CE2 4.28Å; S97-Y100 WeakPolarHBondContact O-CD1 3.46Å; S97-Y100 WeakPolarHBondContact O-CE1 3.34Å; Q98-Y100 PolarHBondContact O-N 2.79Å; Q98-Y100 VanDerWaalsContact O-N 3.12Å; Y100-K104 WeakPolarHBondContact O-CG 3.49Å
101	K	98.3	Very high	97.9	Very high	4 Å²	4	54.4 Å²	54.4	2%	0.017	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-78.6	-20.4	177.1	-61.9	177.5	177.6	175.9	0	112.7	F41 T69 Y90 Q98 K99 G103 K104	F41-K101 HydrophobicContact CE1-CD 4.32Å; T69-K101 PolarHBondContact OG1-NZ 3.03Å; Y90-K101 WeakPolarHBondContact CB-O 3.33Å; Y90-K101 HydrophobicContact CD1-CB 4.13Å; Y90-K101 HydrophobicContact CD1-CD 4.4Å; Y90-K101 HydrophobicContact CD2-CB 4.08Å; Y90-K101 HydrophobicContact CE1-CB 4.49Å; Y90-K101 HydrophobicContact CE1-CD 3.98Å; Y90-K101 HydrophobicContact CE2-CB 4.47Å; Y90-K101 HydrophobicContact CE2-CD 4.4Å; Y90-K101 HydrophobicContact CG-CB 3.9Å; Q98-K101 WeakPolarHBondContact O-CB 3.1Å; Q98-K101 WeakPolarHBondContact O-CG 3.25Å; Q98-K101 PolarHBondContact O-N 2.83Å; K99-K101 PolarHBondContact O-N 3.19Å; K99-K101 VanDerWaalsContact O-N 3.09Å; K101-G103 PolarHBondContact O-N 2.92Å; K101-K104 WeakPolarHBondContact O-CB 2.98Å; K101-K104 VanDerWaalsContact O-CG 3.22Å; K101-K104 WeakPolarHBondContact O-CG 3.45Å; K101-K104 PolarHBondContact O-N 3.33Å
102	E	98.5	Very high	97.9	Very high	64 Å²	64	51.7 Å²	51.7	30%	0.299	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	134.2	-177.8	-65	-175.3	163.2	0	0	111.3	Q92 A93 K99 K104	Q92-E102 WeakPolarHBondContact CA-OE1 3.28Å; A93-E102 HydrophobicContact CB-CG 4.22Å; A93-E102 PolarHBondContact N-OE1 3.06Å; K99-E102 VanDerWaalsContact CD-CD 3.43Å; K99-E102 HydrophobicContact CD-CG 4.32Å; K99-E102 WeakPolarHBondContact CD-OE1 3.35Å; K99-E102 WeakPolarHBondContact CE-OE1 3.28Å; K99-E102 IonicContact NZ-OE1 3.27Å; K99-E102 PolarHBondContact NZ-OE1 2.8Å; K99-E102 IonicContact NZ-OE2 2.8Å; K99-E102 WeakPolarHBondContact O-CB 3.47Å; K99-E102 PolarHBondContact O-N 2.61Å; E102-K104 PolarHBondContact O-N 2.75Å
103	G	98.4	Very high	97.8	Very high	31 Å²	31	49.5 Å²	49.5	32%	0.32	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.1	-0.7	-174.4	0	0	0	0	0	115.1	Y90 K101 Y105	Y90-G103 PolarHBondContact O-N 2.99Å; K101-G103 PolarHBondContact O-N 2.92Å; G103-Y105 VanDerWaalsContact O-CE2 3.27Å; G103-Y105 WeakPolarHBondContact O-CE2 3.42Å
104	K	98.7	Very high	97.6	Very high	47 Å²	47	52.5 Å²	52.5	20%	0.204	27%	0.266	C	S	.	.			trans	-91.9	158.2	179.3	-48	-51.6	173.3	-160.9	0	111.4	I37 L50 F51 N52 K89 Y90 Y100 K101 E102	I37-K104 HydrophobicContact CD1-CD 3.65Å; I37-K104 HydrophobicContact CD1-CG 3.99Å; L50-K104 HydrophobicContact CD1-CB 3.7Å; L50-K104 HydrophobicContact CD2-CB 4.36Å; L50-K104 HydrophobicContact CG-CB 4.08Å; F51-K104 WeakPolarHBondContact O-CB 3.44Å; N52-K104 PolarHBondContact OD1-NZ 3.27Å; K89-K104 WeakPolarHBondContact CA-O 3.05Å; Y90-K104 PolarHBondContact N-O 3.48Å; Y100-K104 WeakPolarHBondContact O-CG 3.49Å; K101-K104 WeakPolarHBondContact O-CB 2.98Å; K101-K104 VanDerWaalsContact O-CG 3.22Å; K101-K104 WeakPolarHBondContact O-CG 3.45Å; K101-K104 PolarHBondContact O-N 3.33Å; E102-K104 PolarHBondContact O-N 2.75Å
105	Y	98.8	Very high	97.2	Very high	43 Å²	43	49 Å²	49	17%	0.169	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	134.6	-172.9	-59.1	-97.6	0	0	0	110.2	L50 F51 V54 I77 K89 G103	L50-Y105 CarbonylContact C-O 3.56Å; L50-Y105 WeakPolarHBondContact CA-O 3.42Å; F51-Y105 PolarHBondContact N-O 3.1Å; F51-Y105 PolarHBondContact O-N 3.04Å; V54-Y105 HydrophobicContact CB-CD1 4.12Å; V54-Y105 HydrophobicContact CB-CD2 4.29Å; V54-Y105 HydrophobicContact CB-CG 3.97Å; V54-Y105 VanDerWaalsContact CG2-CB 3.41Å; V54-Y105 HydrophobicContact CG2-CD1 4.17Å; V54-Y105 HydrophobicContact CG2-CD2 3.97Å; V54-Y105 HydrophobicContact CG2-CG 3.59Å; I77-Y105 HydrophobicContact CD1-CD1 4.21Å; I77-Y105 HydrophobicContact CG2-CD1 4.32Å; K89-Y105 HydrophobicContact CB-CD1 3.82Å; K89-Y105 HydrophobicContact CB-CE1 3.87Å; K89-Y105 HydrophobicContact CD-CD1 4.3Å; K89-Y105 HydrophobicContact CD-CE1 3.55Å; K89-Y105 HydrophobicContact CG-CD1 3.97Å; K89-Y105 HydrophobicContact CG-CE1 3.73Å; G103-Y105 VanDerWaalsContact O-CE2 3.27Å; G103-Y105 WeakPolarHBondContact O-CE2 3.42Å
106	I	98.3	Very high	96.5	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	134.6	166.9	-149	-170.6	0	0	0	108.7	F41 A48 Y49 G87 W88	F41-I106 HydrophobicContact CB-CD1 3.99Å; F41-I106 HydrophobicContact CB-CG1 4.25Å; F41-I106 HydrophobicContact CD1-CD1 4.3Å; A48-I106 HydrophobicContact CB-CD1 3.53Å; A48-I106 HydrophobicContact CB-CG1 3.59Å; Y49-I106 VanDerWaalsContact O-CA 3.3Å; Y49-I106 WeakPolarHBondContact O-CA 2.98Å; G87-I106 WeakPolarHBondContact CA-O 3.18Å; W88-I106 HydrophobicContact CB-CG2 4.45Å; W88-I106 HydrophobicContact CD2-CG2 3.27Å; W88-I106 VanDerWaalsContact CE2-CG2 3.41Å; W88-I106 HydrophobicContact CE3-CG2 3.59Å; W88-I106 HydrophobicContact CG-CG2 3.67Å; W88-I106 HydrophobicContact CH2-CD1 3.97Å; W88-I106 HydrophobicContact CH2-CG2 4.14Å; W88-I106 HydrophobicContact CZ2-CD1 3.75Å; W88-I106 HydrophobicContact CZ2-CG2 3.86Å; W88-I106 HydrophobicContact CZ3-CG2 4Å; W88-I106 VanDerWaalsContact N-CG2 3.35Å; W88-I106 PolarHBondContact N-O 3.21Å; W88-I106 WeakPolarHBondContact O-CG2 3.43Å; W88-I106 PolarHBondContact O-N 2.8Å
107	I	98.6	Very high	95.7	Very high	0 Å²	0	47 Å²	47	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	127.6	169.9	-59.8	176.1	0	0	0	108.3	L30 A48 Y49 F51 V54 I77 L86 M112	L30-I107 HydrophobicContact CB-CD1 4.12Å; L30-I107 HydrophobicContact CD1-CD1 4.32Å; A48-I107 CarbonylContact C-O 3.59Å; A48-I107 VanDerWaalsContact CA-O 3.28Å; A48-I107 WeakPolarHBondContact CA-O 3.2Å; A48-I107 WeakPolarHBondContact CB-O 3.41Å; Y49-I107 PolarHBondContact N-O 3.35Å; Y49-I107 PolarHBondContact O-N 3.2Å; F51-I107 HydrophobicContact CD2-CB 4.43Å; F51-I107 HydrophobicContact CD2-CD1 4.13Å; F51-I107 HydrophobicContact CD2-CG1 4.26Å; F51-I107 HydrophobicContact CE2-CB 4.15Å; F51-I107 HydrophobicContact CE2-CD1 4.18Å; F51-I107 HydrophobicContact CE2-CG1 4.39Å; V54-I107 HydrophobicContact CG1-CD1 3.87Å; V54-I107 HydrophobicContact CG2-CD1 3.84Å; I77-I107 HydrophobicContact CD1-CG1 4.1Å; L86-I107 HydrophobicContact CB-CG2 4.29Å; L86-I107 WeakPolarHBondContact O-CA 3.46Å; I107-M112 HydrophobicContact CB-CE 3.94Å; I107-M112 HydrophobicContact CB-SD 4.36Å; I107-M112 HydrophobicContact CG2-CB 4.06Å; I107-M112 HydrophobicContact CG2-CE 3.81Å; I107-M112 HydrophobicContact CG2-CG 4.26Å; I107-M112 HydrophobicContact CG2-SD 3.95Å; I107-M112 WeakPolarHBondContact O-CE 3.17Å
108	E	98.5	Very high	95.1	Very high	7 Å²	7	44.9 Å²	44.9	3%	0.033	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	140.4	176.9	-56	-167.9	108.2	0	0	111.2	G43 S44 Q45 A48 L86 S110 H111	G43-E108 WeakPolarHBondContact CA-OE1 3.38Å; S44-E108 PolarHBondContact N-OE1 3.37Å; S44-E108 PolarHBondContact OG-OE2 3.24Å; Q45-E108 PolarHBondContact N-OE1 2.89Å; A48-E108 HydrophobicContact CB-CG 4.21Å; L86-E108 PolarHBondContact O-N 2.99Å; E108-S110 PolarHBondContact O-N 3.18Å; E108-H111 PolarHBondContact O-N 2.64Å; E108-H111 IonicContact OE2-CD2 3.98Å; E108-H111 IonicContact OE2-NE2 3.96Å
109	L	97.5	Very high	93.8	Very high	43 Å²	43	52.6 Å²	52.6	23%	0.225	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-64.4	-25.7	-175.5	-91.5	65.2	0	0	0	112.5	R47 Y49 H111 M112	R47-L109 HydrophobicContact CB-CD1 4.38Å; R47-L109 HydrophobicContact CB-CD2 4.2Å; R47-L109 WeakPolarHBondContact O-CD1 3.14Å; R47-L109 PolarHBondContact O-N 3.37Å; Y49-L109 HydrophobicContact CD1-CD1 3.52Å; Y49-L109 HydrophobicContact CD2-CD1 4.16Å; Y49-L109 HydrophobicContact CE1-CD1 3.57Å; Y49-L109 HydrophobicContact CE1-CD2 4.03Å; Y49-L109 HydrophobicContact CE1-CG 4.3Å; Y49-L109 HydrophobicContact CE2-CD1 4.2Å; Y49-L109 HydrophobicContact CG-CD1 3.84Å; L109-H111 PolarHBondContact O-N 2.88Å; L109-M112 HydrophobicContact CD1-CE 3.66Å; L109-M112 HydrophobicContact CG-CE 4.2Å; L109-M112 VanDerWaalsContact O-O 3.13Å
110	S	97.3	Very high	93.6	Very high	70 Å²	70	51.6 Å²	51.6	49%	0.49	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-62.4	-20.6	174.9	46.1	0	0	0	0	113.4	E108	E108-S110 PolarHBondContact O-N 3.18Å
111	H	97.8	Very high	93.3	Very high	37 Å²	37	47.8 Å²	47.8	17%	0.171	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-111.6	-1	-173.5	-58.8	-54.7	0	0	0	114.1	V24 H25 T85 L86 E108 L109	V24-H111 PolarHBondContact N-O 3.28Å; H25-H111 AromaticContact NE2-ND1 3.66Å; T85-H111 PolarHBondContact O-CD2 3.17Å; L86-H111 HydrophobicContact CD2-CB 3.7Å; E108-H111 PolarHBondContact O-N 2.64Å; E108-H111 IonicContact OE2-CD2 3.98Å; E108-H111 IonicContact OE2-NE2 3.96Å; L109-H111 PolarHBondContact O-N 2.88Å
112	M	96.7	Very high	93.1	Very high	14 Å²	14	50.2 Å²	50.2	7%	0.069	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	155.5	177.6	77.9	178.6	129.4	0	0	113.1	Y21 S22 L30 Y49 F51 I107 L109	Y21-M112 HydrophobicContact CD1-CG 4.2Å; Y21-M112 HydrophobicContact CD1-SD 3.51Å; Y21-M112 VanDerWaalsContact CD1-SD 3.51Å; Y21-M112 HydrophobicContact CE1-SD 4.11Å; Y21-M112 HydrophobicContact CG-SD 3.88Å; S22-M112 CarbonylContact O-C 3.52Å; S22-M112 VanDerWaalsContact O-CA 3.28Å; S22-M112 WeakPolarHBondContact O-CA 3.28Å; L30-M112 HydrophobicContact CD1-CB 4.24Å; Y49-M112 HydrophobicContact CD2-CE 3.78Å; Y49-M112 HydrophobicContact CD2-SD 4.42Å; Y49-M112 HydrophobicContact CG-CE 4Å; F51-M112 HydrophobicContact CE2-CE 4.12Å; F51-M112 HydrophobicContact CE2-SD 4.1Å; F51-M112 HydrophobicContact CZ-CE 4.47Å; F51-M112 HydrophobicContact CZ-SD 4.08Å; I107-M112 HydrophobicContact CB-CE 3.94Å; I107-M112 HydrophobicContact CB-SD 4.36Å; I107-M112 HydrophobicContact CG2-CB 4.06Å; I107-M112 HydrophobicContact CG2-CE 3.81Å; I107-M112 HydrophobicContact CG2-CG 4.26Å; I107-M112 HydrophobicContact CG2-SD 3.95Å; I107-M112 WeakPolarHBondContact O-CE 3.17Å; L109-M112 HydrophobicContact CD1-CE 3.66Å; L109-M112 HydrophobicContact CG-CE 4.2Å; L109-M112 VanDerWaalsContact O-O 3.13Å
113	I	96.3	Very high	92.7	Very high	40 Å²	40	49.4 Å²	49.4	21%	0.205	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	155.7	173	54.6	165.5	0	0	0	109.7	Y21 S22 V24	Y21-I113 CarbonylContact C-O 3.56Å; Y21-I113 VanDerWaalsContact CA-O 3.23Å; Y21-I113 WeakPolarHBondContact CA-O 3.24Å; S22-I113 PolarHBondContact N-O 2.97Å; S22-I113 WeakPolarHBondContact O-CG1 3.33Å; S22-I113 PolarHBondContact O-N 3.24Å; V24-I113 HydrophobicContact CB-CG2 3.96Å; V24-I113 HydrophobicContact CG2-CG2 3.72Å
114	K	94.7	Very high	92.4	Very high	64 Å²	64	50.6 Å²	50.6	28%	0.278	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	120	166.2	-66	-175.9	172.8	-175	0	108.9	Y21 N116 G117 W118 D119	Y21-K114 HydrophobicContact CD1-CG 4.18Å; Y21-K114 HydrophobicContact CE1-CG 3.86Å; K114-N116 PolarHBondContact O-N 3Å; K114-G117 PolarHBondContact O-N 3.27Å; K114-W118 HydrophobicContact CB-CD2 4.31Å; K114-W118 HydrophobicContact CB-CZ2 3.99Å; K114-W118 HydrophobicContact CD-CD2 3.78Å; K114-W118 HydrophobicContact CD-CE3 3.82Å; K114-W118 HydrophobicContact CD-CH2 3.75Å; K114-W118 HydrophobicContact CD-CZ2 3.72Å; K114-W118 HydrophobicContact CD-CZ3 3.82Å; K114-W118 WeakPolarHBondContact CD-O 3.23Å; K114-W118 VanDerWaalsContact CE-CH2 3.48Å; K114-W118 HydrophobicContact CG-CD2 4.3Å; K114-W118 HydrophobicContact CG-CH2 3.94Å; K114-W118 HydrophobicContact CG-CZ2 3.52Å; K114-W118 PolarHBondContact NZ-O 2.97Å; K114-D119 PolarHBondContact NZ-OXT 3.37Å
115	D	87.6	Confident	92	Very high	20 Å²	20	50.8 Å²	50.8	11%	0.107	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-60.8	136.8	174.6	-72	-29.8	0	0	0	110.2	R20 S22 G117 W118	R20-D115 PolarHBondContact O-N 3.25Å; S22-D115 VanDerWaalsContact CB-OD1 3.24Å; S22-D115 WeakPolarHBondContact CB-OD1 3.12Å; S22-D115 VanDerWaalsContact OG-CG 3.26Å; S22-D115 PolarHBondContact OG-OD1 2.77Å; S22-D115 PolarHBondContact OG-OD2 3.39Å; D115-G117 PolarHBondContact O-N 3.43Å; D115-W118 PolarHBondContact O-NE1 2.66Å
116	N	83.2	Confident	91.5	Very high	151 Å²	151	51.4 Å²	51.4	81%	0.807	29%	0.291	S	S	*	.	G	3₁₀ helix	trans	57.7	11.9	-177.5	-50.7	-44.8	0	0	0	115.9	K114 W118	K114-N116 PolarHBondContact O-N 3Å; N116-W118 VanDerWaalsContact C-N 3.33Å; N116-W118 PolarHBondContact O-N 3.21Å
117	G	79.4	Confident	91	Very high	55 Å²	55	55.3 Å²	55.3	57%	0.567	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	62.4	30.6	170.4	0	0	0	0	0	115.7	K114 D115	K114-G117 PolarHBondContact O-N 3.27Å; D115-G117 PolarHBondContact O-N 3.43Å
118	W	86.2	Confident	90.3	Very high	31 Å²	31	59.9 Å²	59.9	12%	0.117	34%	0.339	C	S	.	.			trans	-59.8	152.1	177.7	52.5	-98.3	0	0	0	112.8	R19 R20 Y21 H33 K114 D115 N116	R19-W118 HydrophobicContact CB-CD2 3.79Å; R19-W118 HydrophobicContact CB-CE3 4.18Å; R19-W118 HydrophobicContact CB-CG 4.14Å; R19-W118 HydrophobicContact CB-CH2 4.44Å; R19-W118 HydrophobicContact CB-CZ2 4.07Å; R19-W118 HydrophobicContact CB-CZ3 4.49Å; R19-W118 HydrophobicContact CG-CB 4.24Å; R19-W118 HydrophobicContact CG-CD2 3.72Å; R19-W118 HydrophobicContact CG-CE3 3.98Å; R19-W118 HydrophobicContact CG-CG 3.79Å; R20-W118 PolarHBondContact O-NE1 3.05Å; Y21-W118 HydrophobicContact CD1-CZ2 4.42Å; Y21-W118 HydrophobicContact CD2-CZ2 4.48Å; Y21-W118 HydrophobicContact CE1-CH2 4Å; Y21-W118 AromaticContact CE1-CZ2 3.96Å; Y21-W118 HydrophobicContact CE1-CZ2 3.96Å; Y21-W118 AromaticContact CE2-CH2 4Å; Y21-W118 HydrophobicContact CE2-CH2 4Å; Y21-W118 HydrophobicContact CE2-CZ2 4.01Å; Y21-W118 AromaticContact CZ-CH2 3.53Å; Y21-W118 AromaticContact CZ-CZ2 3.76Å; Y21-W118 WeakPolarHBondContact OH-CH2 3.28Å; H33-W118 HydrophobicContact CB-CH2 3.98Å; H33-W118 HydrophobicContact CB-CZ2 4.21Å; H33-W118 AromaticContact CE1-CH2 3.79Å; H33-W118 AromaticContact CE1-CZ3 3.81Å; H33-W118 AromaticContact CG-CH2 3.63Å; H33-W118 AromaticContact CG-CZ3 3.97Å; H33-W118 AromaticContact ND1-CH2 3.17Å; H33-W118 WeakPolarHBondContact ND1-CH2 3.22Å; H33-W118 AromaticContact ND1-CZ3 3.62Å; K114-W118 HydrophobicContact CB-CD2 4.31Å; K114-W118 HydrophobicContact CB-CZ2 3.99Å; K114-W118 HydrophobicContact CD-CD2 3.78Å; K114-W118 HydrophobicContact CD-CE3 3.82Å; K114-W118 HydrophobicContact CD-CH2 3.75Å; K114-W118 HydrophobicContact CD-CZ2 3.72Å; K114-W118 HydrophobicContact CD-CZ3 3.82Å; K114-W118 WeakPolarHBondContact CD-O 3.23Å; K114-W118 VanDerWaalsContact CE-CH2 3.48Å; K114-W118 HydrophobicContact CG-CD2 4.3Å; K114-W118 HydrophobicContact CG-CH2 3.94Å; K114-W118 HydrophobicContact CG-CZ2 3.52Å; K114-W118 PolarHBondContact NZ-O 2.97Å; D115-W118 PolarHBondContact O-NE1 2.66Å; N116-W118 VanDerWaalsContact C-N 3.33Å; N116-W118 PolarHBondContact O-N 3.21Å
119	D	68.7	Low	89.6	Confident	187 Å²	187	64.7 Å²	64.7	100%	1	37%	0.367	S	S	*	.			trans	-78	0	179.8	-67.3	-41.9	0	0	0	113.5	K114	K114-D119 PolarHBondContact NZ-OXT 3.37Å

Retrieved 119 of 119 residues in 231.2 ms (Link to these results)

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