A0A087YAS5_POEFO Loading...

Lissencephaly-1 homolog

Positively regulates the activity of the minus-end directed microtubule motor protein dynein. May enhance dynein-mediated microtubule sliding by targeting dynein to the microtubule plus end. Required for several dynein- and microtubule-dependent processes such as the maintenance of Golgi integrity, the peripheral transport of microtubule fragments and the coupling of the nucleus and centrosome. May be required for proliferation of neuronal precursors and neuronal migration.

AlphaFold DB , UniProt , Accession A0A087YAS5, Species POEFO (Poecilia formosa, Amazon molly), Gene PAFAH1B1, Length 410 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	49.7	Very low	74.5	Confident	245 Å²	245	112.5 Å²	112.5	100%	1.207	55%	0.553	S	S	*	*				0	110.4	0	-165.5	-178.8	-102.4	0	0	106.7
2	V	67.8	Low	75.2	Confident	137 Å²	137	105.6 Å²	105.6	83%	0.83	52%	0.52	S	S	*	.	P	Polyproline II helix	trans	-83.9	118.4	-176.2	-178.9	0	0	0	0	108
3	L	72.1	Confident	75.7	Confident	83 Å²	83	103.2 Å²	103.2	44%	0.435	50%	0.502	S	S	.	.	P	Polyproline II helix	trans	-63.3	133.7	175.2	-72.2	161.3	0	0	0	109.5	Q7 R8 L11	L3-Q7 HydrophobicContact CB-CB 4.48Å; L3-Q7 HydrophobicContact CD2-CB 4.07Å; L3-R8 PolarHBondContact O-NH2 3.03Å; L3-L11 HydrophobicContact CD1-CD2 4.07Å
4	S	83.3	Confident	75.9	Confident	67 Å²	67	96.3 Å²	96.3	47%	0.469	47%	0.469	S	S	.	.	P	Polyproline II helix	trans	-59.8	150.1	169.5	175.4	0	0	0	0	110.1	R6 Q7 R8	S4-R6 PolarHBondContact O-N 3.01Å; S4-Q7 VanDerWaalsContact N-OE1 3.16Å; S4-Q7 WeakPolarHBondContact O-CB 3.28Å; S4-Q7 PolarHBondContact O-N 3.49Å; S4-R8 PolarHBondContact O-N 2.64Å
5	Q	76.2	Confident	76.3	Confident	129 Å²	129	92.8 Å²	92.8	60%	0.603	45%	0.453	S	S	*	.	H	α-helix	trans	-47.2	-48.4	178.9	-156.4	91.4	-4.2	0	0	111.2	Q7 R8 D9	Q5-Q7 PolarHBondContact O-N 3.08Å; Q5-R8 WeakPolarHBondContact O-CB 3.34Å; Q5-R8 PolarHBondContact O-N 3.17Å; Q5-R8 VanDerWaalsContact O-N 3.17Å; Q5-D9 VanDerWaalsContact O-CG 3.24Å; Q5-D9 PolarHBondContact O-N 2.82Å
6	R	76.9	Confident	76.5	Confident	178 Å²	178	87.1 Å²	87.1	67%	0.672	43%	0.426	S	S	*	.	H	α-helix	trans	-61.2	-38.7	178.1	-178.8	177.7	171.6	164	1.8	113.9	S4 R8 D9 E10	S4-R6 PolarHBondContact O-N 3.01Å; R6-R8 VanDerWaalsContact C-N 3.34Å; R6-D9 PolarHBondContact O-N 3.16Å; R6-E10 IonicContact NE-OE1 3.31Å; R6-E10 PolarHBondContact NE-OE1 3.45Å; R6-E10 IonicContact NH2-OE1 3.98Å; R6-E10 WeakPolarHBondContact O-CG 3.27Å; R6-E10 PolarHBondContact O-N 3.43Å
7	Q	77.9	Confident	76.8	Confident	103 Å²	103	83 Å²	83	48%	0.481	41%	0.406	S	S	.	.	H	α-helix	trans	-72.5	-32.3	179.4	-67.6	174	-32.2	0	0	111.6	L3 S4 Q5 L11	L3-Q7 HydrophobicContact CB-CB 4.48Å; L3-Q7 HydrophobicContact CD2-CB 4.07Å; S4-Q7 VanDerWaalsContact N-OE1 3.16Å; S4-Q7 WeakPolarHBondContact O-CB 3.28Å; S4-Q7 PolarHBondContact O-N 3.49Å; Q5-Q7 PolarHBondContact O-N 3.08Å; Q7-L11 VanDerWaalsContact O-CB 3.29Å; Q7-L11 WeakPolarHBondContact O-CB 3.34Å; Q7-L11 PolarHBondContact O-N 3.46Å
8	R	78.7	Confident	77.1	Confident	93 Å²	93	82.9 Å²	82.9	35%	0.351	40%	0.401	S	S	.	.	H	α-helix	trans	-65.5	-44.2	173.8	-167.5	-175.4	-58.9	135.8	7.4	110.5	L3 S4 Q5 R6 L11 N12	L3-R8 PolarHBondContact O-NH2 3.03Å; S4-R8 PolarHBondContact O-N 2.64Å; Q5-R8 WeakPolarHBondContact O-CB 3.34Å; Q5-R8 PolarHBondContact O-N 3.17Å; Q5-R8 VanDerWaalsContact O-N 3.17Å; R6-R8 VanDerWaalsContact C-N 3.34Å; R8-L11 PolarHBondContact O-N 3.18Å; R8-N12 WeakPolarHBondContact O-CB 3.39Å; R8-N12 PolarHBondContact O-N 2.77Å; R8-N12 PolarHBondContact O-OD1 2.82Å
9	D	78.7	Confident	77.4	Confident	73 Å²	73	80.1 Å²	80.1	39%	0.39	39%	0.388	S	S	.	.	H	α-helix	trans	-66.5	-42.6	179.2	-58.8	-22.5	0	0	0	111.8	Q5 R6 L11 N12 R13	Q5-D9 VanDerWaalsContact O-CG 3.24Å; Q5-D9 PolarHBondContact O-N 2.82Å; R6-D9 PolarHBondContact O-N 3.16Å; D9-L11 VanDerWaalsContact C-N 3.33Å; D9-L11 PolarHBondContact O-N 3.33Å; D9-N12 PolarHBondContact O-N 3.44Å; D9-R13 WeakPolarHBondContact O-CG 3.49Å; D9-R13 PolarHBondContact O-N 3.42Å
10	E	78.4	Confident	77.5	Confident	63 Å²	63	82.3 Å²	82.3	29%	0.294	39%	0.392	S	S	.	.	H	α-helix	trans	-63	-37.4	174.7	-74.3	177.7	-167.9	0	0	112.3	R6 A14 Y47	R6-E10 IonicContact NE-OE1 3.31Å; R6-E10 PolarHBondContact NE-OE1 3.45Å; R6-E10 IonicContact NH2-OE1 3.98Å; R6-E10 WeakPolarHBondContact O-CG 3.27Å; R6-E10 PolarHBondContact O-N 3.43Å; E10-A14 WeakPolarHBondContact O-CB 3.36Å; E10-A14 PolarHBondContact O-N 2.79Å; E10-A14 VanDerWaalsContact O-N 3.15Å; E10-Y47 HydrophobicContact CB-CE1 4.35Å; E10-Y47 HydrophobicContact CG-CE1 4.27Å
11	L	79.8	Confident	77.6	Confident	67 Å²	67	81.9 Å²	81.9	35%	0.351	40%	0.398	S	S	.	.	H	α-helix	trans	-68.7	-46	175.8	179.3	63.8	0	0	0	111.4	L3 Q7 R8 D9 R13 A14 I15 L51	L3-L11 HydrophobicContact CD1-CD2 4.07Å; Q7-L11 VanDerWaalsContact O-CB 3.29Å; Q7-L11 WeakPolarHBondContact O-CB 3.34Å; Q7-L11 PolarHBondContact O-N 3.46Å; R8-L11 PolarHBondContact O-N 3.18Å; D9-L11 VanDerWaalsContact C-N 3.33Å; D9-L11 PolarHBondContact O-N 3.33Å; L11-R13 VanDerWaalsContact C-N 3.3Å; L11-R13 PolarHBondContact O-N 3.34Å; L11-A14 PolarHBondContact O-N 2.9Å; L11-A14 VanDerWaalsContact O-N 3.16Å; L11-I15 HydrophobicContact CD1-CD1 3.97Å; L11-I15 HydrophobicContact CD1-CG1 4.24Å; L11-I15 HydrophobicContact CD2-CD1 4.44Å; L11-I15 HydrophobicContact CG-CD1 3.77Å; L11-I15 HydrophobicContact CG-CG1 4.43Å; L11-I15 VanDerWaalsContact O-CG1 3.31Å; L11-I15 WeakPolarHBondContact O-CG1 3.44Å; L11-I15 PolarHBondContact O-N 3.38Å; L11-L51 HydrophobicContact CD1-CD1 4.49Å
12	N	83.4	Confident	79.1	Confident	29 Å²	29	73.1 Å²	73.1	16%	0.155	36%	0.356	C	S	.	.	H	α-helix	trans	-60.3	-41	178.6	-71.6	-8.9	0	0	0	111.2	R8 D9 I15 A16 A35	R8-N12 WeakPolarHBondContact O-CB 3.39Å; R8-N12 PolarHBondContact O-N 2.77Å; R8-N12 PolarHBondContact O-OD1 2.82Å; D9-N12 PolarHBondContact O-N 3.44Å; N12-I15 PolarHBondContact O-N 3.26Å; N12-A16 WeakPolarHBondContact O-CB 3.48Å; N12-A16 PolarHBondContact O-N 3.36Å; N12-A35 HydrophobicContact CB-CB 4.38Å
13	R	80.7	Confident	79.7	Confident	75 Å²	75	69.2 Å²	69.2	28%	0.283	34%	0.344	S	S	.	.	H	α-helix	trans	-64.3	-40.9	174.6	-71.2	175.6	-178	-131.6	-0.2	112.6	D9 L11 A16 D17 L37 E41 Y47	D9-R13 WeakPolarHBondContact O-CG 3.49Å; D9-R13 PolarHBondContact O-N 3.42Å; L11-R13 VanDerWaalsContact C-N 3.3Å; L11-R13 PolarHBondContact O-N 3.34Å; R13-A16 PolarHBondContact O-N 3.35Å; R13-D17 PolarHBondContact O-N 3.4Å; R13-L37 HydrophobicContact CG-CD2 3.83Å; R13-E41 IonicContact CZ-OE2 2.73Å; R13-E41 IonicContact NH1-OE2 3.82Å; R13-E41 PolarHBondContact NH1-OE2 2.89Å; R13-E41 IonicContact NH2-OE2 3.56Å; R13-E41 PolarHBondContact NH2-OE2 3.04Å; R13-Y47 HydrophobicContact CB-CD2 4.46Å; R13-Y47 HydrophobicContact CB-CG 4.42Å
14	A	79.2	Confident	80.3	Confident	6 Å²	6	71.6 Å²	71.6	5%	0.05	35%	0.348	C	S	.	.	H	α-helix	trans	-70.6	-32.1	177.5	0	0	0	0	0	113.6	E10 L11 Y18	E10-A14 WeakPolarHBondContact O-CB 3.36Å; E10-A14 PolarHBondContact O-N 2.79Å; E10-A14 VanDerWaalsContact O-N 3.15Å; L11-A14 PolarHBondContact O-N 2.9Å; L11-A14 VanDerWaalsContact O-N 3.16Å; A14-Y18 PolarHBondContact O-N 3.02Å
15	I	81.4	Confident	80.1	Confident	44 Å²	44	74 Å²	74	23%	0.226	35%	0.351	C	S	.	.	H	α-helix	trans	-70.9	-43.9	173.7	-67.4	167.3	0	0	0	110.4	L11 N12 D17 Y18 L19 F31 L51	L11-I15 HydrophobicContact CD1-CD1 3.97Å; L11-I15 HydrophobicContact CD1-CG1 4.24Å; L11-I15 HydrophobicContact CD2-CD1 4.44Å; L11-I15 HydrophobicContact CG-CD1 3.77Å; L11-I15 HydrophobicContact CG-CG1 4.43Å; L11-I15 VanDerWaalsContact O-CG1 3.31Å; L11-I15 WeakPolarHBondContact O-CG1 3.44Å; L11-I15 PolarHBondContact O-N 3.38Å; N12-I15 PolarHBondContact O-N 3.26Å; I15-D17 VanDerWaalsContact C-N 3.32Å; I15-D17 PolarHBondContact O-N 2.73Å; I15-Y18 PolarHBondContact O-N 3.29Å; I15-L19 HydrophobicContact CG2-CD1 4.03Å; I15-L19 HydrophobicContact CG2-CG 4.4Å; I15-L19 WeakPolarHBondContact O-CG 3.43Å; I15-L19 PolarHBondContact O-N 3.48Å; I15-F31 HydrophobicContact CB-CE1 3.87Å; I15-F31 HydrophobicContact CB-CZ 3.95Å; I15-F31 HydrophobicContact CD1-CZ 4.17Å; I15-F31 HydrophobicContact CG2-CD1 4.14Å; I15-F31 HydrophobicContact CG2-CE1 3.58Å; I15-F31 HydrophobicContact CG2-CE2 4.17Å; I15-F31 HydrophobicContact CG2-CZ 3.6Å; I15-L51 HydrophobicContact CG1-CD2 4.21Å
16	A	80.6	Confident	80.3	Confident	2 Å²	2	75.5 Å²	75.5	2%	0.017	36%	0.358	C	S	.	.	H	α-helix	trans	-60.3	-41.2	176.8	0	0	0	0	0	111.9	N12 R13 R20 Y28 F31 L37 L43	N12-A16 WeakPolarHBondContact O-CB 3.48Å; N12-A16 PolarHBondContact O-N 3.36Å; R13-A16 PolarHBondContact O-N 3.35Å; A16-R20 PolarHBondContact O-N 2.89Å; A16-R20 VanDerWaalsContact O-N 3.14Å; A16-Y28 HydrophobicContact CB-CD2 4.32Å; A16-Y28 HydrophobicContact CB-CE2 3.99Å; A16-Y28 VanDerWaalsContact O-CD2 3.31Å; A16-Y28 WeakPolarHBondContact O-CD2 3.33Å; A16-Y28 WeakPolarHBondContact O-CE2 3.43Å; A16-F31 HydrophobicContact CB-CD1 4.48Å; A16-L37 HydrophobicContact CB-CD1 4.03Å; A16-L43 HydrophobicContact CB-CD2 4.48Å
17	D	81.6	Confident	80.6	Confident	17 Å²	17	69.3 Å²	69.3	9%	0.091	35%	0.346	C	S	.	.	H	α-helix	trans	-60.3	-47.5	173.5	-176.2	71.4	0	0	0	112.4	R13 I15 L19 R20 S21 L43 A48 G49	R13-D17 PolarHBondContact O-N 3.4Å; I15-D17 VanDerWaalsContact C-N 3.32Å; I15-D17 PolarHBondContact O-N 2.73Å; D17-L19 PolarHBondContact O-N 3.41Å; D17-R20 PolarHBondContact O-N 2.78Å; D17-S21 WeakPolarHBondContact O-CB 3.49Å; D17-S21 PolarHBondContact O-N 3.22Å; D17-S21 PolarHBondContact O-OG 2.7Å; D17-L43 HydrophobicContact CB-CD2 3.67Å; D17-A48 VanDerWaalsContact OD2-CA 3.24Å; D17-A48 WeakPolarHBondContact OD2-CA 3.19Å; D17-G49 PolarHBondContact OD2-N 3.08Å; D17-G49 VanDerWaalsContact OD2-N 3.16Å
18	Y	81.8	Confident	80.7	Confident	82 Å²	82	65.8 Å²	65.8	32%	0.322	33%	0.328	S	S	.	.	H	α-helix	trans	-61.8	-42.5	179.5	177.2	-96.3	0	0	0	113	A14 I15 R20 S21 N22 L51 E52	A14-Y18 PolarHBondContact O-N 3.02Å; I15-Y18 PolarHBondContact O-N 3.29Å; Y18-R20 VanDerWaalsContact C-N 3.31Å; Y18-R20 PolarHBondContact O-N 2.9Å; Y18-S21 PolarHBondContact O-N 3.02Å; Y18-S21 PolarHBondContact O-OG 2.94Å; Y18-S21 VanDerWaalsContact O-OG 3.05Å; Y18-N22 WeakPolarHBondContact CE2-ND2 3.35Å; Y18-N22 WeakPolarHBondContact O-CB 3.41Å; Y18-N22 PolarHBondContact O-N 3.15Å; Y18-N22 VanDerWaalsContact O-N 3.14Å; Y18-N22 PolarHBondContact OH-ND2 3.39Å; Y18-L51 HydrophobicContact CD1-CD2 4.26Å; Y18-L51 HydrophobicContact CD2-CD2 4.37Å; Y18-L51 HydrophobicContact CG-CD2 3.91Å; Y18-E52 HydrophobicContact CD2-CG 3.9Å; Y18-E52 HydrophobicContact CE2-CG 3.82Å; Y18-E52 WeakPolarHBondContact CE2-OE1 3.33Å
19	L	82.4	Confident	80.7	Confident	29 Å²	29	63.8 Å²	63.8	15%	0.152	33%	0.328	C	S	.	.	H	α-helix	trans	-63.5	-40.3	177.5	-69.6	171.6	0	0	0	111.1	I15 D17 G23 Y24 A27 Y28 F31	I15-L19 HydrophobicContact CG2-CD1 4.03Å; I15-L19 HydrophobicContact CG2-CG 4.4Å; I15-L19 WeakPolarHBondContact O-CG 3.43Å; I15-L19 PolarHBondContact O-N 3.48Å; D17-L19 PolarHBondContact O-N 3.41Å; L19-G23 PolarHBondContact O-N 2.77Å; L19-Y24 HydrophobicContact CD2-CD2 4.24Å; L19-Y24 PolarHBondContact O-N 2.91Å; L19-A27 HydrophobicContact CD2-CB 4.44Å; L19-Y28 HydrophobicContact CB-CD2 4.44Å; L19-F31 HydrophobicContact CD1-CB 4.07Å; L19-F31 HydrophobicContact CD1-CD1 4.16Å; L19-F31 HydrophobicContact CD1-CG 4.14Å
20	R	78.6	Confident	80.9	Confident	124 Å²	124	63.6 Å²	63.6	47%	0.468	33%	0.33	S	S	.	.	H	α-helix	trans	-69.1	-45.2	176.5	-163.4	-178.4	88	177.6	5.9	112.1	A16 D17 Y18 N22 G23 Y28	A16-R20 PolarHBondContact O-N 2.89Å; A16-R20 VanDerWaalsContact O-N 3.14Å; D17-R20 PolarHBondContact O-N 2.78Å; Y18-R20 VanDerWaalsContact C-N 3.31Å; Y18-R20 PolarHBondContact O-N 2.9Å; R20-N22 PolarHBondContact O-N 2.91Å; R20-G23 PolarHBondContact O-N 2.81Å; R20-Y28 HydrophobicContact CB-CD2 4.19Å; R20-Y28 HydrophobicContact CB-CE2 4.25Å
21	S	80.1	Confident	81.1	Confident	73 Å²	73	62.9 Å²	62.9	51%	0.51	33%	0.326	S	S	.	.	H	α-helix	trans	-63.6	-30.8	-177.9	69.1	0	0	0	0	112.7	D17 Y18	D17-S21 WeakPolarHBondContact O-CB 3.49Å; D17-S21 PolarHBondContact O-N 3.22Å; D17-S21 PolarHBondContact O-OG 2.7Å; Y18-S21 PolarHBondContact O-N 3.02Å; Y18-S21 PolarHBondContact O-OG 2.94Å; Y18-S21 VanDerWaalsContact O-OG 3.05Å
22	N	81.4	Confident	81	Confident	62 Å²	62	62.3 Å²	62.3	33%	0.332	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	6.2	179.9	-67	-7.7	0	0	0	113.7	Y18 R20 Y24	Y18-N22 WeakPolarHBondContact CE2-ND2 3.35Å; Y18-N22 WeakPolarHBondContact O-CB 3.41Å; Y18-N22 PolarHBondContact O-N 3.15Å; Y18-N22 VanDerWaalsContact O-N 3.14Å; Y18-N22 PolarHBondContact OH-ND2 3.39Å; R20-N22 PolarHBondContact O-N 2.91Å; N22-Y24 HydrophobicContact CB-CD2 3.75Å; N22-Y24 HydrophobicContact CB-CE2 3.58Å
23	G	81.3	Confident	80.9	Confident	55 Å²	55	69 Å²	69	57%	0.567	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.4	18.1	172.7	0	0	0	0	0	115.4	L19 R20 E25	L19-G23 PolarHBondContact O-N 2.77Å; R20-G23 PolarHBondContact O-N 2.81Å; G23-E25 VanDerWaalsContact C-N 3.28Å; G23-E25 PolarHBondContact O-N 3.12Å
24	Y	84.6	Confident	80.9	Confident	132 Å²	132	72.8 Å²	72.8	52%	0.518	37%	0.369	S	S	.	.			trans	-85.2	65.3	178.8	-59.9	-59	0	0	0	111.6	L19 N22 E26 A27 Y28	L19-Y24 HydrophobicContact CD2-CD2 4.24Å; L19-Y24 PolarHBondContact O-N 2.91Å; N22-Y24 HydrophobicContact CB-CD2 3.75Å; N22-Y24 HydrophobicContact CB-CE2 3.58Å; Y24-E26 PolarHBondContact O-N 2.7Å; Y24-A27 PolarHBondContact O-N 3.2Å; Y24-Y28 WeakPolarHBondContact O-CB 3.34Å; Y24-Y28 PolarHBondContact O-N 3.4Å
25	E	78.3	Confident	80.8	Confident	117 Å²	117	73.6 Å²	73.6	55%	0.547	38%	0.376	S	S	.	.	H	α-helix	trans	-63.4	-39.1	-168.5	-156.8	64.5	-158.1	0	0	113.8	G23 S29	G23-E25 VanDerWaalsContact C-N 3.28Å; G23-E25 PolarHBondContact O-N 3.12Å; E25-S29 WeakPolarHBondContact O-CB 3.33Å; E25-S29 PolarHBondContact O-N 3.31Å
26	E	81.4	Confident	80.5	Confident	161 Å²	161	80 Å²	80	75%	0.752	41%	0.405	S	S	*	.	H	α-helix	trans	-65.8	-50.7	178.7	-168.3	174.1	-167.3	0	0	110.8	Y24 Y28 S29 T30	Y24-E26 PolarHBondContact O-N 2.7Å; E26-Y28 VanDerWaalsContact C-N 3.33Å; E26-Y28 PolarHBondContact O-N 3.34Å; E26-S29 PolarHBondContact O-N 3.03Å; E26-S29 VanDerWaalsContact O-N 3.13Å; E26-S29 PolarHBondContact O-OG 2.91Å; E26-T30 PolarHBondContact O-N 3.32Å; E26-T30 VanDerWaalsContact O-N 3.11Å; E26-T30 PolarHBondContact O-OG1 3.4Å
27	A	81.2	Confident	80	Confident	49 Å²	49	81.6 Å²	81.6	41%	0.405	41%	0.413	S	S	.	.	H	α-helix	trans	-63.3	-36.9	177.3	0	0	0	0	0	112.6	L19 Y24 F31	L19-A27 HydrophobicContact CD2-CB 4.44Å; Y24-A27 PolarHBondContact O-N 3.2Å; A27-F31 WeakPolarHBondContact O-CB 3.28Å; A27-F31 PolarHBondContact O-N 2.98Å
28	Y	81.3	Confident	79.1	Confident	28 Å²	28	87.5 Å²	87.5	11%	0.11	45%	0.445	C	S	.	.	H	α-helix	trans	-60.6	-46.3	172.3	171.2	-104.5	0	0	0	111.3	A16 L19 R20 Y24 E26 T30 F31 K32	A16-Y28 HydrophobicContact CB-CD2 4.32Å; A16-Y28 HydrophobicContact CB-CE2 3.99Å; A16-Y28 VanDerWaalsContact O-CD2 3.31Å; A16-Y28 WeakPolarHBondContact O-CD2 3.33Å; A16-Y28 WeakPolarHBondContact O-CE2 3.43Å; L19-Y28 HydrophobicContact CB-CD2 4.44Å; R20-Y28 HydrophobicContact CB-CD2 4.19Å; R20-Y28 HydrophobicContact CB-CE2 4.25Å; Y24-Y28 WeakPolarHBondContact O-CB 3.34Å; Y24-Y28 PolarHBondContact O-N 3.4Å; E26-Y28 VanDerWaalsContact C-N 3.33Å; E26-Y28 PolarHBondContact O-N 3.34Å; Y28-T30 PolarHBondContact O-N 3.02Å; Y28-F31 PolarHBondContact O-N 2.97Å; Y28-K32 HydrophobicContact CE1-CD 4.46Å; Y28-K32 WeakPolarHBondContact O-CB 3.4Å; Y28-K32 PolarHBondContact O-N 3.03Å
29	S	78.2	Confident	77.8	Confident	51 Å²	51	90.1 Å²	90.1	36%	0.357	46%	0.464	S	S	.	.	H	α-helix	trans	-64.7	-37.7	-178.4	80.7	0	0	0	0	113	E25 E26 K33	E25-S29 WeakPolarHBondContact O-CB 3.33Å; E25-S29 PolarHBondContact O-N 3.31Å; E26-S29 PolarHBondContact O-N 3.03Å; E26-S29 VanDerWaalsContact O-N 3.13Å; E26-S29 PolarHBondContact O-OG 2.91Å; S29-K33 WeakPolarHBondContact O-CG 3.27Å; S29-K33 PolarHBondContact O-N 3.47Å
30	T	82.9	Confident	76.4	Confident	69 Å²	69	96.5 Å²	96.5	42%	0.423	50%	0.498	S	S	.	.	H	α-helix	trans	-73.3	-48	178	-40.3	0	0	0	0	110.7	E26 Y28 K32 K33 E34	E26-T30 PolarHBondContact O-N 3.32Å; E26-T30 VanDerWaalsContact O-N 3.11Å; E26-T30 PolarHBondContact O-OG1 3.4Å; Y28-T30 PolarHBondContact O-N 3.02Å; T30-K32 VanDerWaalsContact C-N 3.3Å; T30-K32 PolarHBondContact O-N 2.99Å; T30-K33 PolarHBondContact O-N 2.98Å; T30-K33 VanDerWaalsContact O-N 3.13Å; T30-E34 PolarHBondContact O-N 2.79Å; T30-E34 VanDerWaalsContact O-N 3.08Å
31	F	82.5	Confident	75.2	Confident	49 Å²	49	96 Å²	96	22%	0.215	50%	0.502	C	S	.	.	H	α-helix	trans	-62	-37.2	178.5	-175.4	-101.4	0	0	0	112.2	I15 A16 L19 A27 Y28 K33 E34 A35	I15-F31 HydrophobicContact CB-CE1 3.87Å; I15-F31 HydrophobicContact CB-CZ 3.95Å; I15-F31 HydrophobicContact CD1-CZ 4.17Å; I15-F31 HydrophobicContact CG2-CD1 4.14Å; I15-F31 HydrophobicContact CG2-CE1 3.58Å; I15-F31 HydrophobicContact CG2-CE2 4.17Å; I15-F31 HydrophobicContact CG2-CZ 3.6Å; A16-F31 HydrophobicContact CB-CD1 4.48Å; L19-F31 HydrophobicContact CD1-CB 4.07Å; L19-F31 HydrophobicContact CD1-CD1 4.16Å; L19-F31 HydrophobicContact CD1-CG 4.14Å; A27-F31 WeakPolarHBondContact O-CB 3.28Å; A27-F31 PolarHBondContact O-N 2.98Å; Y28-F31 PolarHBondContact O-N 2.97Å; F31-K33 VanDerWaalsContact C-N 3.32Å; F31-K33 PolarHBondContact O-N 3.04Å; F31-E34 PolarHBondContact O-N 3.35Å; F31-A35 HydrophobicContact CE1-CB 4.36Å; F31-A35 WeakPolarHBondContact O-CB 3.41Å; F31-A35 PolarHBondContact O-N 2.93Å
32	K	78	Confident	74	Confident	54 Å²	54	101.6 Å²	101.6	24%	0.235	52%	0.52	C	S	.	.	H	α-helix	trans	-62.2	-38	175.8	-168.2	-174.1	-174.7	-160.8	0	112.4	Y28 T30 L37 N39	Y28-K32 HydrophobicContact CE1-CD 4.46Å; Y28-K32 WeakPolarHBondContact O-CB 3.4Å; Y28-K32 PolarHBondContact O-N 3.03Å; T30-K32 VanDerWaalsContact C-N 3.3Å; T30-K32 PolarHBondContact O-N 2.99Å; K32-L37 HydrophobicContact CG-CB 4.21Å; K32-N39 PolarHBondContact NZ-OD1 2.64Å
33	K	80.8	Confident	72.9	Confident	171 Å²	171	100.9 Å²	100.9	74%	0.743	52%	0.515	S	S	*	.	H	α-helix	trans	-71.2	-41.2	177.2	-72.1	176.1	-175.5	175.3	0	111.9	S29 T30 F31	S29-K33 WeakPolarHBondContact O-CG 3.27Å; S29-K33 PolarHBondContact O-N 3.47Å; T30-K33 PolarHBondContact O-N 2.98Å; T30-K33 VanDerWaalsContact O-N 3.13Å; F31-K33 VanDerWaalsContact C-N 3.32Å; F31-K33 PolarHBondContact O-N 3.04Å
34	E	81.8	Confident	71.8	Confident	153 Å²	153	102.5 Å²	102.5	72%	0.715	51%	0.511	S	S	*	.	H	α-helix	trans	-71.7	-31.8	179.8	-71.2	-179.5	171.1	0	0	113	T30 F31 E36	T30-E34 PolarHBondContact O-N 2.79Å; T30-E34 VanDerWaalsContact O-N 3.08Å; F31-E34 PolarHBondContact O-N 3.35Å; E34-E36 VanDerWaalsContact C-N 3.34Å
35	A	76.1	Confident	70.8	Confident	23 Å²	23	105.6 Å²	105.6	19%	0.19	53%	0.527	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	4.3	-178.4	0	0	0	0	0	114.4	N12 F31 L37	N12-A35 HydrophobicContact CB-CB 4.38Å; F31-A35 HydrophobicContact CE1-CB 4.36Å; F31-A35 WeakPolarHBondContact O-CB 3.41Å; F31-A35 PolarHBondContact O-N 2.93Å; A35-L37 HydrophobicContact CB-CD1 4.07Å; A35-L37 HydrophobicContact CB-CG 4.09Å; A35-L37 PolarHBondContact O-N 2.78Å; A35-L37 VanDerWaalsContact O-N 3.15Å
36	E	75.1	Confident	70.1	Confident	180 Å²	180	106.6 Å²	106.6	84%	0.841	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.9	39.3	-179.2	-63	-177	167.5	0	0	113.9	E34 D38	E34-E36 VanDerWaalsContact C-N 3.34Å; E36-D38 PolarHBondContact O-N 2.84Å
37	L	70.3	Confident	69.4	Low	35 Å²	35	100 Å²	100	18%	0.183	50%	0.498	C	S	.	.			trans	-77.3	121.9	-179.5	-72	163.6	0	0	0	110.7	R13 A16 K32 A35	R13-L37 HydrophobicContact CG-CD2 3.83Å; A16-L37 HydrophobicContact CB-CD1 4.03Å; K32-L37 HydrophobicContact CG-CB 4.21Å; A35-L37 HydrophobicContact CB-CD1 4.07Å; A35-L37 HydrophobicContact CB-CG 4.09Å; A35-L37 PolarHBondContact O-N 2.78Å; A35-L37 VanDerWaalsContact O-N 3.15Å
38	D	63	Low	68.9	Low	141 Å²	141	100.2 Å²	100.2	75%	0.754	50%	0.5	S	S	*	.			trans	-54.2	138.2	-178.5	-98.1	-31	0	0	0	113.2	E36 N40	E36-D38 PolarHBondContact O-N 2.84Å; D38-N40 PolarHBondContact O-N 2.9Å
39	N	54.3	Low	68.5	Low	136 Å²	136	100 Å²	100	73%	0.727	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-6.2	-171	-85.8	-36.2	0	0	0	115.3	K32	K32-N39 PolarHBondContact NZ-OD1 2.64Å
40	N	52.5	Low	68.5	Low	163 Å²	163	99.9 Å²	99.9	87%	0.872	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.9	13.9	-163.9	-123.5	11.1	0	0	0	115.9	D38	D38-N40 PolarHBondContact O-N 2.9Å
41	E	54.2	Low	68.4	Low	115 Å²	115	98.9 Å²	98.9	54%	0.537	49%	0.493	S	S	.	.	S	Bend	trans	-107.1	115.7	168.9	-70.3	-172.9	160.6	0	0	109.3	R13 L43	R13-E41 IonicContact CZ-OE2 2.73Å; R13-E41 IonicContact NH1-OE2 3.82Å; R13-E41 PolarHBondContact NH1-OE2 2.89Å; R13-E41 IonicContact NH2-OE2 3.56Å; R13-E41 PolarHBondContact NH2-OE2 3.04Å; E41-L43 PolarHBondContact O-N 2.8Å; E41-L43 VanDerWaalsContact O-N 3.15Å
42	E	55	Low	68.3	Low	190 Å²	190	101 Å²	101	89%	0.888	50%	0.504	S	S	*	.			trans	-47.4	123.2	159.6	-98.5	-176.6	145.8	0	0	107.5	D44	E42-D44 PolarHBondContact O-N 3.48Å
43	L	58.5	Low	68.5	Low	46 Å²	46	105.2 Å²	105.2	24%	0.241	52%	0.522	C	S	.	.			trans	-52.8	108.2	177.3	-100.3	108.3	0	0	0	108.7	A16 D17 E41 K45	A16-L43 HydrophobicContact CB-CD2 4.48Å; D17-L43 HydrophobicContact CB-CD2 3.67Å; E41-L43 PolarHBondContact O-N 2.8Å; E41-L43 VanDerWaalsContact O-N 3.15Å; L43-K45 PolarHBondContact O-N 3.43Å
44	D	58.7	Low	68.6	Low	89 Å²	89	102.8 Å²	102.8	48%	0.476	51%	0.512	S	S	.	.			trans	-54.6	130.4	-170.5	-155.8	2.6	0	0	0	109.7	E42 K46 Y47	E42-D44 PolarHBondContact O-N 3.48Å; D44-K46 HydrophobicContact CB-CB 4.35Å; D44-K46 PolarHBondContact O-N 3.27Å; D44-Y47 HydrophobicContact CB-CD2 3.96Å; D44-Y47 HydrophobicContact CB-CE2 4.07Å; D44-Y47 PolarHBondContact O-N 2.88Å
45	K	62.8	Low	68.7	Low	197 Å²	197	103.4 Å²	103.4	86%	0.857	51%	0.508	S	S	*	.	G	3₁₀ helix	trans	-50.4	-19.9	179.8	-84.9	-178.5	179	173.8	0	113.1	L43 Y47 A48	L43-K45 PolarHBondContact O-N 3.43Å; K45-Y47 VanDerWaalsContact C-N 3.27Å; K45-Y47 PolarHBondContact O-N 3.39Å; K45-A48 WeakPolarHBondContact O-CB 3.11Å; K45-A48 PolarHBondContact O-N 3.33Å
46	K	64.4	Low	69	Low	138 Å²	138	106.3 Å²	106.3	60%	0.6	52%	0.523	S	S	*	.	G	3₁₀ helix	trans	-57	-30.9	174.7	-168.4	179.9	179.5	-173.3	0	114.5	D44	D44-K46 HydrophobicContact CB-CB 4.35Å; D44-K46 PolarHBondContact O-N 3.27Å
47	Y	66.6	Low	69.3	Low	22 Å²	22	99.9 Å²	99.9	9%	0.086	50%	0.498	C	S	.	.	G	3₁₀ helix	trans	-98.8	-6	-175.3	-59.5	-76.4	0	0	0	113.9	E10 R13 D44 K45 G49 L50	E10-Y47 HydrophobicContact CB-CE1 4.35Å; E10-Y47 HydrophobicContact CG-CE1 4.27Å; R13-Y47 HydrophobicContact CB-CD2 4.46Å; R13-Y47 HydrophobicContact CB-CG 4.42Å; D44-Y47 HydrophobicContact CB-CD2 3.96Å; D44-Y47 HydrophobicContact CB-CE2 4.07Å; D44-Y47 PolarHBondContact O-N 2.88Å; K45-Y47 VanDerWaalsContact C-N 3.27Å; K45-Y47 PolarHBondContact O-N 3.39Å; Y47-G49 PolarHBondContact O-N 2.59Å; Y47-L50 HydrophobicContact CD1-CD2 3.81Å; Y47-L50 HydrophobicContact CE1-CD2 4.43Å; Y47-L50 VanDerWaalsContact O-CB 3.24Å; Y47-L50 WeakPolarHBondContact O-CB 3.37Å; Y47-L50 PolarHBondContact O-N 3.33Å; Y47-L50 VanDerWaalsContact O-N 3.1Å
48	A	69.7	Low	70.1	Confident	54 Å²	54	101.5 Å²	101.5	45%	0.446	51%	0.509	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	114	-179.8	0	0	0	0	0	112.5	D17 K45 L50	D17-A48 VanDerWaalsContact OD2-CA 3.24Å; D17-A48 WeakPolarHBondContact OD2-CA 3.19Å; K45-A48 WeakPolarHBondContact O-CB 3.11Å; K45-A48 PolarHBondContact O-N 3.33Å; A48-L50 PolarHBondContact O-N 2.74Å; A48-L50 VanDerWaalsContact O-N 3.16Å
49	G	72.9	Confident	70.9	Confident	24 Å²	24	97.9 Å²	97.9	25%	0.247	49%	0.489	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.6	16	178.4	0	0	0	0	0	114.5	D17 Y47 L51 K53	D17-G49 PolarHBondContact OD2-N 3.08Å; D17-G49 VanDerWaalsContact OD2-N 3.16Å; Y47-G49 PolarHBondContact O-N 2.59Å; G49-L51 VanDerWaalsContact C-N 3.33Å; G49-L51 PolarHBondContact O-N 2.94Å; G49-K53 WeakPolarHBondContact O-CG 3.49Å; G49-K53 PolarHBondContact O-N 2.78Å
50	L	79.3	Confident	72.1	Confident	48 Å²	48	99.3 Å²	99.3	25%	0.251	48%	0.484	S	S	.	.	H	α-helix	trans	-66.1	-37.3	-179.2	-175	65.2	0	0	0	111.6	Y47 A48 K54	Y47-L50 HydrophobicContact CD1-CD2 3.81Å; Y47-L50 HydrophobicContact CE1-CD2 4.43Å; Y47-L50 VanDerWaalsContact O-CB 3.24Å; Y47-L50 WeakPolarHBondContact O-CB 3.37Å; Y47-L50 PolarHBondContact O-N 3.33Å; Y47-L50 VanDerWaalsContact O-N 3.1Å; A48-L50 PolarHBondContact O-N 2.74Å; A48-L50 VanDerWaalsContact O-N 3.16Å; L50-K54 HydrophobicContact CG-CD 4.33Å; L50-K54 WeakPolarHBondContact O-CB 3.2Å; L50-K54 WeakPolarHBondContact O-CG 3.37Å; L50-K54 PolarHBondContact O-N 3.3Å
51	L	79.9	Confident	73.7	Confident	49 Å²	49	96.6 Å²	96.6	26%	0.257	47%	0.469	S	S	.	.	H	α-helix	trans	-65	-45	-179.4	-169.9	64.4	0	0	0	111.4	L11 I15 Y18 G49 K54 W55	L11-L51 HydrophobicContact CD1-CD1 4.49Å; I15-L51 HydrophobicContact CG1-CD2 4.21Å; Y18-L51 HydrophobicContact CD1-CD2 4.26Å; Y18-L51 HydrophobicContact CD2-CD2 4.37Å; Y18-L51 HydrophobicContact CG-CD2 3.91Å; G49-L51 VanDerWaalsContact C-N 3.33Å; G49-L51 PolarHBondContact O-N 2.94Å; L51-K54 PolarHBondContact O-N 3.04Å; L51-W55 VanDerWaalsContact O-CB 3.28Å; L51-W55 WeakPolarHBondContact O-CB 3.32Å; L51-W55 PolarHBondContact O-N 3.13Å
52	E	80.1	Confident	75.2	Confident	94 Å²	94	96.3 Å²	96.3	44%	0.439	47%	0.468	S	S	.	.	H	α-helix	trans	-65.4	-42.3	178.4	-62.3	-175.2	157.2	0	0	112.4	Y18 K54 W55 T56	Y18-E52 HydrophobicContact CD2-CG 3.9Å; Y18-E52 HydrophobicContact CE2-CG 3.82Å; Y18-E52 WeakPolarHBondContact CE2-OE1 3.33Å; E52-K54 VanDerWaalsContact C-N 3.35Å; E52-K54 PolarHBondContact O-N 3.23Å; E52-W55 PolarHBondContact O-N 3.23Å; E52-T56 WeakPolarHBondContact O-CB 3.45Å; E52-T56 WeakPolarHBondContact O-CG2 3.49Å; E52-T56 PolarHBondContact O-N 3.11Å; E52-T56 PolarHBondContact O-OG1 3.21Å
53	K	82.3	Confident	76.5	Confident	142 Å²	142	94.3 Å²	94.3	62%	0.617	46%	0.456	S	S	*	.	H	α-helix	trans	-63.8	-38.6	175.6	-71.7	175.1	-176.5	171	0	112.4	G49 T56 S57	G49-K53 WeakPolarHBondContact O-CG 3.49Å; G49-K53 PolarHBondContact O-N 2.78Å; K53-T56 WeakPolarHBondContact CA-OG1 3.29Å; K53-T56 PolarHBondContact O-OG1 2.91Å; K53-S57 WeakPolarHBondContact O-CB 3.25Å; K53-S57 PolarHBondContact O-N 3.43Å; K53-S57 PolarHBondContact O-OG 2.98Å
54	K	84.2	Confident	77.8	Confident	120 Å²	120	96.4 Å²	96.4	52%	0.522	46%	0.463	S	S	.	.	H	α-helix	trans	-70.3	-42.5	174.9	-75.7	-174.2	178.1	-178	0	110.9	L50 L51 E52 S57 V58	L50-K54 HydrophobicContact CG-CD 4.33Å; L50-K54 WeakPolarHBondContact O-CB 3.2Å; L50-K54 WeakPolarHBondContact O-CG 3.37Å; L50-K54 PolarHBondContact O-N 3.3Å; L51-K54 PolarHBondContact O-N 3.04Å; E52-K54 VanDerWaalsContact C-N 3.35Å; E52-K54 PolarHBondContact O-N 3.23Å; K54-S57 WeakPolarHBondContact O-CB 3.41Å; K54-S57 PolarHBondContact O-N 3.27Å; K54-V58 VanDerWaalsContact O-CG2 3.3Å; K54-V58 WeakPolarHBondContact O-CG2 3.19Å; K54-V58 PolarHBondContact O-N 3.25Å
55	W	83.6	Confident	79.3	Confident	166 Å²	166	95.4 Å²	95.4	63%	0.629	46%	0.46	S	S	*	.	H	α-helix	trans	-63.6	-44.1	179.6	-169.1	-114.8	0	0	0	112.7	L51 E52 S57 V58 I59	L51-W55 VanDerWaalsContact O-CB 3.28Å; L51-W55 WeakPolarHBondContact O-CB 3.32Å; L51-W55 PolarHBondContact O-N 3.13Å; E52-W55 PolarHBondContact O-N 3.23Å; W55-S57 VanDerWaalsContact C-N 3.3Å; W55-S57 PolarHBondContact O-N 3.43Å; W55-V58 WeakPolarHBondContact O-CB 3.4Å; W55-V58 PolarHBondContact O-N 3.05Å; W55-V58 VanDerWaalsContact O-N 3.15Å; W55-I59 HydrophobicContact CG-CD1 4.45Å; W55-I59 WeakPolarHBondContact O-CG1 3.36Å; W55-I59 PolarHBondContact O-N 3.28Å
56	T	81.2	Confident	80.3	Confident	84 Å²	84	91.7 Å²	91.7	52%	0.515	45%	0.447	S	S	.	.	H	α-helix	trans	-62.2	-37.4	174.1	48.4	0	0	0	0	112.4	E52 K53 I59 R60	E52-T56 WeakPolarHBondContact O-CB 3.45Å; E52-T56 WeakPolarHBondContact O-CG2 3.49Å; E52-T56 PolarHBondContact O-N 3.11Å; E52-T56 PolarHBondContact O-OG1 3.21Å; K53-T56 WeakPolarHBondContact CA-OG1 3.29Å; K53-T56 PolarHBondContact O-OG1 2.91Å; T56-I59 PolarHBondContact O-N 3.28Å; T56-R60 WeakPolarHBondContact O-CB 3.43Å; T56-R60 PolarHBondContact O-N 3.35Å
57	S	81.3	Confident	81.3	Confident	44 Å²	44	88.9 Å²	88.9	31%	0.308	44%	0.436	S	S	.	.	H	α-helix	trans	-66.3	-39.4	173.1	-64.8	0	0	0	0	112.4	K53 K54 W55 R60 L61	K53-S57 WeakPolarHBondContact O-CB 3.25Å; K53-S57 PolarHBondContact O-N 3.43Å; K53-S57 PolarHBondContact O-OG 2.98Å; K54-S57 WeakPolarHBondContact O-CB 3.41Å; K54-S57 PolarHBondContact O-N 3.27Å; W55-S57 VanDerWaalsContact C-N 3.3Å; W55-S57 PolarHBondContact O-N 3.43Å; S57-R60 PolarHBondContact O-N 2.86Å; S57-L61 WeakPolarHBondContact O-CB 3.47Å; S57-L61 WeakPolarHBondContact O-CG 3.48Å; S57-L61 PolarHBondContact O-N 2.88Å
58	V	86.8	Confident	82.3	Confident	70 Å²	70	92.2 Å²	92.2	42%	0.424	46%	0.455	S	S	.	.	H	α-helix	trans	-64	-45.5	175	170.2	0	0	0	0	111	K54 W55 R60 L61 Q62	K54-V58 VanDerWaalsContact O-CG2 3.3Å; K54-V58 WeakPolarHBondContact O-CG2 3.19Å; K54-V58 PolarHBondContact O-N 3.25Å; W55-V58 WeakPolarHBondContact O-CB 3.4Å; W55-V58 PolarHBondContact O-N 3.05Å; W55-V58 VanDerWaalsContact O-N 3.15Å; V58-R60 VanDerWaalsContact C-N 3.31Å; V58-R60 PolarHBondContact O-N 3.43Å; V58-L61 PolarHBondContact O-N 2.79Å; V58-Q62 WeakPolarHBondContact O-CB 3.23Å; V58-Q62 PolarHBondContact O-N 2.91Å
59	I	80.3	Confident	83.2	Confident	64 Å²	64	94.8 Å²	94.8	33%	0.328	46%	0.458	S	S	.	.	H	α-helix	trans	-59.9	-43.3	176.4	-67.8	166.5	0	0	0	111	W55 T56 Q62 K63	W55-I59 HydrophobicContact CG-CD1 4.45Å; W55-I59 WeakPolarHBondContact O-CG1 3.36Å; W55-I59 PolarHBondContact O-N 3.28Å; T56-I59 PolarHBondContact O-N 3.28Å; I59-Q62 PolarHBondContact O-N 2.9Å; I59-K63 WeakPolarHBondContact O-CG 3.46Å; I59-K63 PolarHBondContact O-N 2.8Å
60	R	80.3	Confident	83.6	Confident	167 Å²	167	96.5 Å²	96.5	63%	0.63	47%	0.466	S	S	*	.	H	α-helix	trans	-63.3	-42.6	177	-179.3	176.7	54	111	2.4	111.7	T56 S57 V58 K64	T56-R60 WeakPolarHBondContact O-CB 3.43Å; T56-R60 PolarHBondContact O-N 3.35Å; S57-R60 PolarHBondContact O-N 2.86Å; V58-R60 VanDerWaalsContact C-N 3.31Å; V58-R60 PolarHBondContact O-N 3.43Å; R60-K64 WeakPolarHBondContact O-CB 3.38Å; R60-K64 PolarHBondContact O-N 2.56Å
61	L	85.7	Confident	83.7	Confident	106 Å²	106	99.2 Å²	99.2	56%	0.555	48%	0.476	S	S	*	.	H	α-helix	trans	-66.4	-41.9	175.8	-75.9	168	0	0	0	111.6	S57 V58 K64 V65	S57-L61 WeakPolarHBondContact O-CB 3.47Å; S57-L61 WeakPolarHBondContact O-CG 3.48Å; S57-L61 PolarHBondContact O-N 2.88Å; V58-L61 PolarHBondContact O-N 2.79Å; L61-K64 CarbonylContact O-C 3.53Å; L61-K64 WeakPolarHBondContact O-CA 3.43Å; L61-K64 WeakPolarHBondContact O-CB 3.42Å; L61-K64 PolarHBondContact O-N 3.05Å; L61-K64 VanDerWaalsContact O-N 3.08Å; L61-V65 VanDerWaalsContact O-CG2 3.3Å; L61-V65 WeakPolarHBondContact O-CG2 3.41Å; L61-V65 PolarHBondContact O-N 2.63Å
62	Q	86.6	Confident	83.8	Confident	109 Å²	109	101.1 Å²	101.1	51%	0.509	49%	0.486	S	S	.	.	H	α-helix	trans	-62.9	-43.8	177.3	-173	178.6	-1.9	0	0	111.6	V58 I59 K64 V65 M66	V58-Q62 WeakPolarHBondContact O-CB 3.23Å; V58-Q62 PolarHBondContact O-N 2.91Å; I59-Q62 PolarHBondContact O-N 2.9Å; Q62-K64 VanDerWaalsContact C-N 3.27Å; Q62-K64 PolarHBondContact O-N 2.78Å; Q62-V65 PolarHBondContact O-N 3.21Å; Q62-M66 WeakPolarHBondContact O-CG 3.25Å; Q62-M66 PolarHBondContact O-N 3.49Å
63	K	81.6	Confident	83.9	Confident	147 Å²	147	101.2 Å²	101.2	64%	0.639	49%	0.49	S	S	*	.	H	α-helix	trans	-58.5	-41.3	171	-76.1	-177.7	178.8	-176.5	0	111.5	I59 M66 E67	I59-K63 WeakPolarHBondContact O-CG 3.46Å; I59-K63 PolarHBondContact O-N 2.8Å; K63-M66 PolarHBondContact O-N 2.76Å; K63-E67 WeakPolarHBondContact O-CB 3.35Å; K63-E67 PolarHBondContact O-N 2.97Å
64	K	86.4	Confident	83.5	Confident	90 Å²	90	99.3 Å²	99.3	39%	0.391	48%	0.483	S	S	.	.	H	α-helix	trans	-68.6	-37.7	178.5	-169.6	61.3	-175.1	175.8	0	112.4	R60 L61 Q62 E67 L68	R60-K64 WeakPolarHBondContact O-CB 3.38Å; R60-K64 PolarHBondContact O-N 2.56Å; L61-K64 CarbonylContact O-C 3.53Å; L61-K64 WeakPolarHBondContact O-CA 3.43Å; L61-K64 WeakPolarHBondContact O-CB 3.42Å; L61-K64 PolarHBondContact O-N 3.05Å; L61-K64 VanDerWaalsContact O-N 3.08Å; Q62-K64 VanDerWaalsContact C-N 3.27Å; Q62-K64 PolarHBondContact O-N 2.78Å; K64-E67 VanDerWaalsContact CD-OE2 3.3Å; K64-E67 WeakPolarHBondContact CD-OE2 3.48Å; K64-E67 IonicContact NZ-OE1 2.74Å; K64-E67 PolarHBondContact NZ-OE1 3.32Å; K64-E67 IonicContact NZ-OE2 3.67Å; K64-E67 PolarHBondContact NZ-OE2 3.46Å; K64-E67 PolarHBondContact O-N 3.26Å; K64-L68 HydrophobicContact CG-CD1 4.06Å; K64-L68 HydrophobicContact CG-CG 4.43Å; K64-L68 WeakPolarHBondContact O-CB 3.21Å; K64-L68 WeakPolarHBondContact O-CG 3.3Å; K64-L68 PolarHBondContact O-N 2.73Å
65	V	89.2	Confident	83.1	Confident	69 Å²	69	95.3 Å²	95.3	42%	0.418	47%	0.472	S	S	.	.	H	α-helix	trans	-63.7	-47.9	174.9	168.8	0	0	0	0	109.9	L61 Q62 E67 L68 E69	L61-V65 VanDerWaalsContact O-CG2 3.3Å; L61-V65 WeakPolarHBondContact O-CG2 3.41Å; L61-V65 PolarHBondContact O-N 2.63Å; Q62-V65 PolarHBondContact O-N 3.21Å; V65-E67 VanDerWaalsContact C-N 3.32Å; V65-E67 PolarHBondContact O-N 3.3Å; V65-L68 CarbonylContact O-C 3.58Å; V65-L68 PolarHBondContact O-N 3.04Å; V65-L68 VanDerWaalsContact O-N 3.12Å; V65-E69 HydrophobicContact CG1-CG 4.2Å; V65-E69 WeakPolarHBondContact O-CB 3.44Å; V65-E69 WeakPolarHBondContact O-CG 3.3Å; V65-E69 PolarHBondContact O-N 2.97Å
66	M	84.9	Confident	82.9	Confident	118 Å²	118	92.7 Å²	92.7	58%	0.581	47%	0.465	S	S	*	.	H	α-helix	trans	-58.8	-42	175	-74.9	176.4	152.4	0	0	112.5	Q62 K63 E69 S70	Q62-M66 WeakPolarHBondContact O-CG 3.25Å; Q62-M66 PolarHBondContact O-N 3.49Å; K63-M66 PolarHBondContact O-N 2.76Å; M66-E69 PolarHBondContact O-N 3.34Å; M66-S70 PolarHBondContact O-N 2.84Å
67	E	85	Confident	82.3	Confident	79 Å²	79	94.7 Å²	94.7	37%	0.369	47%	0.469	S	S	.	.	H	α-helix	trans	-62.4	-43	174.8	-169.6	-156.9	143.7	0	0	111.7	K63 K64 V65 K71	K63-E67 WeakPolarHBondContact O-CB 3.35Å; K63-E67 PolarHBondContact O-N 2.97Å; K64-E67 VanDerWaalsContact CD-OE2 3.3Å; K64-E67 WeakPolarHBondContact CD-OE2 3.48Å; K64-E67 IonicContact NZ-OE1 2.74Å; K64-E67 PolarHBondContact NZ-OE1 3.32Å; K64-E67 IonicContact NZ-OE2 3.67Å; K64-E67 PolarHBondContact NZ-OE2 3.46Å; K64-E67 PolarHBondContact O-N 3.26Å; V65-E67 VanDerWaalsContact C-N 3.32Å; V65-E67 PolarHBondContact O-N 3.3Å; E67-K71 WeakPolarHBondContact O-CG 3.48Å; E67-K71 PolarHBondContact O-N 3.38Å; E67-K71 VanDerWaalsContact O-N 3.09Å; E67-K71 WeakPolarHBondContact OE1-CE 3.26Å; E67-K71 IonicContact OE1-NZ 3.47Å; E67-K71 PolarHBondContact OE1-NZ 3.36Å
68	L	86.1	Confident	81.5	Confident	93 Å²	93	97.5 Å²	97.5	49%	0.487	48%	0.477	S	S	.	.	H	α-helix	trans	-71.5	-35.3	179.4	-72.7	171.2	0	0	0	112.5	K64 V65 K71 L72	K64-L68 HydrophobicContact CG-CD1 4.06Å; K64-L68 HydrophobicContact CG-CG 4.43Å; K64-L68 WeakPolarHBondContact O-CB 3.21Å; K64-L68 WeakPolarHBondContact O-CG 3.3Å; K64-L68 PolarHBondContact O-N 2.73Å; V65-L68 CarbonylContact O-C 3.58Å; V65-L68 PolarHBondContact O-N 3.04Å; V65-L68 VanDerWaalsContact O-N 3.12Å; L68-K71 PolarHBondContact O-N 3.07Å; L68-L72 VanDerWaalsContact O-CB 3.23Å; L68-L72 WeakPolarHBondContact O-CB 3.34Å; L68-L72 PolarHBondContact O-N 3.25Å
69	E	89.3	Confident	80.5	Confident	108 Å²	108	100.8 Å²	100.8	51%	0.505	49%	0.491	S	S	.	.	H	α-helix	trans	-66	-40.8	174.1	-76	175.1	166.2	0	0	111.2	V65 M66 L72 N73	V65-E69 HydrophobicContact CG1-CG 4.2Å; V65-E69 WeakPolarHBondContact O-CB 3.44Å; V65-E69 WeakPolarHBondContact O-CG 3.3Å; V65-E69 PolarHBondContact O-N 2.97Å; M66-E69 PolarHBondContact O-N 3.34Å; E69-L72 PolarHBondContact O-N 3.3Å; E69-N73 WeakPolarHBondContact O-CB 3.18Å; E69-N73 PolarHBondContact O-N 2.88Å
70	S	81.9	Confident	80.1	Confident	59 Å²	59	103.4 Å²	103.4	41%	0.413	51%	0.51	S	S	.	.	H	α-helix	trans	-57.8	-51.9	171	-166	0	0	0	0	110.7	M66 L72 N73 E74	M66-S70 PolarHBondContact O-N 2.84Å; S70-L72 VanDerWaalsContact C-N 3.28Å; S70-L72 PolarHBondContact O-N 2.77Å; S70-N73 PolarHBondContact O-N 2.88Å; S70-E74 VanDerWaalsContact O-CG 3.3Å; S70-E74 WeakPolarHBondContact O-CG 3.33Å; S70-E74 PolarHBondContact O-N 2.76Å; S70-E74 PolarHBondContact OG-OE1 3.15Å
71	K	80.6	Confident	78.9	Confident	105 Å²	105	101.1 Å²	101.1	46%	0.457	51%	0.51	S	S	.	.	H	α-helix	trans	-61.4	-36.1	178.5	-72.9	176.9	175.9	177	0	113	E67 L68 A75	E67-K71 WeakPolarHBondContact O-CG 3.48Å; E67-K71 PolarHBondContact O-N 3.38Å; E67-K71 VanDerWaalsContact O-N 3.09Å; E67-K71 WeakPolarHBondContact OE1-CE 3.26Å; E67-K71 IonicContact OE1-NZ 3.47Å; E67-K71 PolarHBondContact OE1-NZ 3.36Å; L68-K71 PolarHBondContact O-N 3.07Å; K71-A75 WeakPolarHBondContact O-CB 3.32Å; K71-A75 PolarHBondContact O-N 3.38Å
72	L	82.9	Confident	77.2	Confident	90 Å²	90	99.7 Å²	99.7	47%	0.471	52%	0.521	S	S	.	.	H	α-helix	trans	-70.8	-39.1	178	-175.6	68.6	0	0	0	111.4	L68 E69 S70 K76	L68-L72 VanDerWaalsContact O-CB 3.23Å; L68-L72 WeakPolarHBondContact O-CB 3.34Å; L68-L72 PolarHBondContact O-N 3.25Å; E69-L72 PolarHBondContact O-N 3.3Å; S70-L72 VanDerWaalsContact C-N 3.28Å; S70-L72 PolarHBondContact O-N 2.77Å; L72-K76 HydrophobicContact CG-CD 4.24Å; L72-K76 VanDerWaalsContact O-CB 3.3Å; L72-K76 WeakPolarHBondContact O-CB 3.4Å; L72-K76 VanDerWaalsContact O-CG 3.22Å; L72-K76 WeakPolarHBondContact O-CG 3.2Å; L72-K76 PolarHBondContact O-N 3.13Å
73	N	81.1	Confident	75.7	Confident	96 Å²	96	95.8 Å²	95.8	51%	0.513	51%	0.51	S	S	.	.	H	α-helix	trans	-66.1	-45.1	174.1	-82.6	-8.3	0	0	0	111.1	E69 S70 A75 K76 E77	E69-N73 WeakPolarHBondContact O-CB 3.18Å; E69-N73 PolarHBondContact O-N 2.88Å; S70-N73 PolarHBondContact O-N 2.88Å; N73-A75 PolarHBondContact O-N 2.87Å; N73-K76 PolarHBondContact O-N 2.67Å; N73-E77 WeakPolarHBondContact O-CB 3.27Å; N73-E77 WeakPolarHBondContact O-CG 3.34Å; N73-E77 PolarHBondContact O-N 2.9Å
74	E	74.8	Confident	74	Confident	101 Å²	101	94.3 Å²	94.3	47%	0.472	52%	0.515	S	S	.	.	H	α-helix	trans	-55.1	-51.2	173.8	-71.8	161.1	-149.5	0	0	110.8	S70 K76 E77 E78	S70-E74 VanDerWaalsContact O-CG 3.3Å; S70-E74 WeakPolarHBondContact O-CG 3.33Å; S70-E74 PolarHBondContact O-N 2.76Å; S70-E74 PolarHBondContact OG-OE1 3.15Å; E74-K76 PolarHBondContact O-N 3.23Å; E74-E77 PolarHBondContact O-N 3.29Å; E74-E78 WeakPolarHBondContact O-CG 3.24Å; E74-E78 PolarHBondContact O-N 3.1Å
75	A	75.4	Confident	72	Confident	36 Å²	36	94 Å²	94	30%	0.298	52%	0.52	S	S	.	.	H	α-helix	trans	-65.5	-34.4	178.5	0	0	0	0	0	113.6	K71 N73 E78 I79	K71-A75 WeakPolarHBondContact O-CB 3.32Å; K71-A75 PolarHBondContact O-N 3.38Å; N73-A75 PolarHBondContact O-N 2.87Å; A75-E78 PolarHBondContact O-N 3.15Å; A75-I79 WeakPolarHBondContact O-CD1 3.39Å; A75-I79 VanDerWaalsContact O-CG1 3.24Å; A75-I79 WeakPolarHBondContact O-CG1 3.29Å; A75-I79 PolarHBondContact O-N 3.09Å
76	K	79.3	Confident	70.2	Confident	111 Å²	111	95.5 Å²	95.5	48%	0.483	53%	0.534	S	S	.	.	H	α-helix	trans	-68.9	-40.6	175.7	-81.3	174.3	179	176.6	0	111.7	L72 N73 E74 E78 I79 T80	L72-K76 HydrophobicContact CG-CD 4.24Å; L72-K76 VanDerWaalsContact O-CB 3.3Å; L72-K76 WeakPolarHBondContact O-CB 3.4Å; L72-K76 VanDerWaalsContact O-CG 3.22Å; L72-K76 WeakPolarHBondContact O-CG 3.2Å; L72-K76 PolarHBondContact O-N 3.13Å; N73-K76 PolarHBondContact O-N 2.67Å; E74-K76 PolarHBondContact O-N 3.23Å; K76-E78 VanDerWaalsContact C-N 3.34Å; K76-I79 PolarHBondContact O-N 3.17Å; K76-T80 WeakPolarHBondContact O-CB 3.33Å; K76-T80 PolarHBondContact O-N 2.91Å; K76-T80 PolarHBondContact O-OG1 3.41Å
77	E	69.1	Low	68.4	Low	127 Å²	127	96.7 Å²	96.7	59%	0.593	54%	0.538	S	S	*	.	H	α-helix	trans	-63	-42.4	174.1	-74.4	-176.1	172.6	0	0	110.6	N73 E74 I79 T80 L81	N73-E77 WeakPolarHBondContact O-CB 3.27Å; N73-E77 WeakPolarHBondContact O-CG 3.34Å; N73-E77 PolarHBondContact O-N 2.9Å; E74-E77 PolarHBondContact O-N 3.29Å; E77-I79 VanDerWaalsContact C-N 3.35Å; E77-I79 PolarHBondContact O-N 3.34Å; E77-T80 PolarHBondContact O-N 3.26Å; E77-L81 PolarHBondContact O-N 2.94Å
78	E	63.6	Low	66.8	Low	103 Å²	103	102.6 Å²	102.6	48%	0.481	56%	0.562	S	S	.	*	H	α-helix	trans	-58.8	-41.1	174.4	-74	175.9	172.8	0	0	113	E74 A75 K76 G82 G83	E74-E78 WeakPolarHBondContact O-CG 3.24Å; E74-E78 PolarHBondContact O-N 3.1Å; A75-E78 PolarHBondContact O-N 3.15Å; K76-E78 VanDerWaalsContact C-N 3.34Å; E78-G82 PolarHBondContact O-N 2.58Å; E78-G83 PolarHBondContact O-N 3.25Å; E78-G83 VanDerWaalsContact O-N 3.09Å
79	I	67.3	Low	65.6	Low	138 Å²	138	103.5 Å²	103.5	71%	0.708	56%	0.559	S	S	*	*	H	α-helix	trans	-71.7	-39.4	179	-69.8	164	0	0	0	111.6	A75 K76 E77 L81	A75-I79 WeakPolarHBondContact O-CD1 3.39Å; A75-I79 VanDerWaalsContact O-CG1 3.24Å; A75-I79 WeakPolarHBondContact O-CG1 3.29Å; A75-I79 PolarHBondContact O-N 3.09Å; K76-I79 PolarHBondContact O-N 3.17Å; E77-I79 VanDerWaalsContact C-N 3.35Å; E77-I79 PolarHBondContact O-N 3.34Å; I79-L81 VanDerWaalsContact C-N 3.26Å; I79-L81 PolarHBondContact O-N 3.46Å
80	T	71.6	Confident	64.5	Low	120 Å²	120	103.7 Å²	103.7	74%	0.736	56%	0.564	S	S	*	*	H	α-helix	trans	-68.9	-28.3	-177.1	-49.4	0	0	0	0	111.7	K76 E77	K76-T80 WeakPolarHBondContact O-CB 3.33Å; K76-T80 PolarHBondContact O-N 2.91Å; K76-T80 PolarHBondContact O-OG1 3.41Å; E77-T80 PolarHBondContact O-N 3.26Å
81	L	54.2	Low	64	Low	119 Å²	119	104.1 Å²	104.1	62%	0.623	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.4	0.9	-175.6	-71.3	158.8	0	0	0	114.3	E77 I79 V85	E77-L81 PolarHBondContact O-N 2.94Å; I79-L81 VanDerWaalsContact C-N 3.26Å; I79-L81 PolarHBondContact O-N 3.46Å; L81-V85 HydrophobicContact CB-CG2 3.66Å; L81-V85 HydrophobicContact CD1-CG2 4.06Å; L81-V85 HydrophobicContact CG-CG2 4.31Å
82	G	51.1	Low	63.7	Low	76 Å²	76	105.5 Å²	105.5	78%	0.784	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	78	25.4	172.6	0	0	0	0	0	115.4	E78	E78-G82 PolarHBondContact O-N 2.58Å
83	G	54.9	Low	63.5	Low	27 Å²	27	105.8 Å²	105.8	28%	0.278	57%	0.57	S	S	.	*	S	Bend	trans	143.7	173.9	178.3	0	0	0	0	0	112.7	E78 V85	E78-G83 PolarHBondContact O-N 3.25Å; E78-G83 VanDerWaalsContact O-N 3.09Å; G83-V85 PolarHBondContact O-N 2.84Å
84	P	44.5	Very low	63.6	Low	115 Å²	115	102.7 Å²	102.7	75%	0.747	55%	0.551	S	S	*	*			trans	-65.3	99.7	175.8	26.1	-31.2	0	0	0	109	S86	P84-S86 VanDerWaalsContact C-N 3.29Å; P84-S86 PolarHBondContact O-N 3.3Å
85	V	45.7	Very low	64.1	Low	83 Å²	83	99 Å²	99	50%	0.503	53%	0.534	S	S	.	.			trans	-68.5	96.7	166	-179.2	0	0	0	0	105.5	L81 G83 Q87	L81-V85 HydrophobicContact CB-CG2 3.66Å; L81-V85 HydrophobicContact CD1-CG2 4.06Å; L81-V85 HydrophobicContact CG-CG2 4.31Å; G83-V85 PolarHBondContact O-N 2.84Å; V85-Q87 PolarHBondContact O-N 2.78Å
86	S	50.4	Low	64.6	Low	101 Å²	101	97.3 Å²	97.3	71%	0.706	52%	0.52	S	S	*	.			trans	-50.8	99.8	146.8	-179	0	0	0	0	104.2	P84 K88	P84-S86 VanDerWaalsContact C-N 3.29Å; P84-S86 PolarHBondContact O-N 3.3Å; S86-K88 PolarHBondContact O-N 3.24Å
87	Q	48.5	Very low	64.7	Low	143 Å²	143	97.5 Å²	97.5	67%	0.668	52%	0.518	S	S	*	.			trans	-46.3	117.8	165.8	-76.1	-178.5	-4.9	0	0	103.2	V85 R89	V85-Q87 PolarHBondContact O-N 2.78Å; Q87-R89 PolarHBondContact O-N 2.96Å
88	K	50.8	Low	65.4	Low	203 Å²	203	95.3 Å²	95.3	88%	0.883	52%	0.515	S	S	*	.			trans	-63	81.6	176.6	-78.3	-177.6	177.3	179.2	0	105.7	S86 D90	S86-K88 PolarHBondContact O-N 3.24Å; K88-D90 PolarHBondContact O-N 3.16Å
89	R	60.4	Low	66.4	Low	112 Å²	112	95.5 Å²	95.5	42%	0.423	53%	0.525	S	S	.	.			trans	-56.9	138.8	176.2	-77.2	175.1	177.2	-173.3	4.7	105.4	Q87 W94 R410	Q87-R89 PolarHBondContact O-N 2.96Å; R89-W94 PolarHBondContact O-NE1 3.17Å; R89-R410 WeakPolarHBondContact CD-OXT 3.36Å; R89-R410 PolarHBondContact NH1-O 2.95Å; R89-R410 PolarHBondContact NH1-OXT 3.31Å
90	D	67.2	Low	67.5	Low	112 Å²	112	92.2 Å²	92.2	60%	0.599	51%	0.507	S	S	*	.			trans	-49.4	133.6	-176.3	-84.6	-37.2	0	0	0	109.2	K88 K92 E93	K88-D90 PolarHBondContact O-N 3.16Å; D90-K92 PolarHBondContact O-N 3.17Å; D90-E93 PolarHBondContact O-N 2.61Å
91	P	70.9	Confident	68.3	Low	68 Å²	68	91.1 Å²	91.1	44%	0.442	49%	0.489	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-12.1	176.6	-29.3	35	0	0	0	114.6	W94 H347	P91-W94 HydrophobicContact CB-CD2 4.24Å; P91-W94 HydrophobicContact CB-CE3 3.98Å; P91-W94 HydrophobicContact CB-CH2 3.69Å; P91-W94 HydrophobicContact CB-CZ2 3.95Å; P91-W94 HydrophobicContact CB-CZ3 3.69Å; P91-W94 HydrophobicContact CG-CH2 3.7Å; P91-W94 HydrophobicContact CG-CZ2 3.76Å; P91-W94 HydrophobicContact CG-CZ3 4.24Å; P91-H347 PolarHBondContact O-CE1 2.81Å
92	K	73.1	Confident	70.1	Confident	134 Å²	134	88.8 Å²	88.8	58%	0.583	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-14.6	176.2	-60	-176.6	-179.2	177.8	0	114.1	D90	D90-K92 PolarHBondContact O-N 3.17Å
93	E	79.4	Confident	72.1	Confident	97 Å²	97	88 Å²	88	45%	0.453	46%	0.459	S	S	.	.	S	Bend	trans	-113.2	7.1	-177	-55	-144.7	131.2	0	0	113.7	D90 I95 K351	D90-E93 PolarHBondContact O-N 2.61Å; E93-I95 PolarHBondContact O-N 2.87Å; E93-K351 IonicContact OE1-NZ 2.84Å; E93-K351 PolarHBondContact OE1-NZ 2.9Å
94	W	83.5	Confident	74	Confident	31 Å²	31	87.4 Å²	87.4	12%	0.117	45%	0.449	C	S	.	.			trans	-64.5	116	178.1	-73.4	-13.7	0	0	0	111.7	R89 P91 H347 F388 A391 P393 C409	R89-W94 PolarHBondContact O-NE1 3.17Å; P91-W94 HydrophobicContact CB-CD2 4.24Å; P91-W94 HydrophobicContact CB-CE3 3.98Å; P91-W94 HydrophobicContact CB-CH2 3.69Å; P91-W94 HydrophobicContact CB-CZ2 3.95Å; P91-W94 HydrophobicContact CB-CZ3 3.69Å; P91-W94 HydrophobicContact CG-CH2 3.7Å; P91-W94 HydrophobicContact CG-CZ2 3.76Å; P91-W94 HydrophobicContact CG-CZ3 4.24Å; W94-H347 PolarHBondContact O-CD2 2.74Å; W94-H347 PolarHBondContact O-NE2 2.8Å; W94-F388 HydrophobicContact CB-CZ 4.14Å; W94-A391 WeakPolarHBondContact CH2-O 3.24Å; W94-P393 HydrophobicContact CD2-CB 3.72Å; W94-P393 HydrophobicContact CE3-CB 4.1Å; W94-P393 HydrophobicContact CG-CB 4.08Å; W94-P393 HydrophobicContact CZ2-CB 4.17Å; W94-P393 HydrophobicContact CZ2-CG 4.49Å; W94-P393 HydrophobicContact CZ3-CB 4.48Å; W94-C409 HydrophobicContact CB-CB 3.57Å; W94-C409 HydrophobicContact CG-CB 4.05Å
95	I	84.3	Confident	76.3	Confident	22 Å²	22	86.4 Å²	86.4	11%	0.113	45%	0.445	C	S	.	.			trans	-125.5	124.7	179.5	-68.2	173.5	0	0	0	106.5	E93 R97 F352 I364 M373 C409 R410	E93-I95 PolarHBondContact O-N 2.87Å; I95-R97 PolarHBondContact O-N 3.06Å; I95-F352 HydrophobicContact CD1-CE2 4.08Å; I95-F352 HydrophobicContact CD1-CZ 4.08Å; I95-F352 HydrophobicContact CG1-CD2 4.45Å; I95-F352 HydrophobicContact CG1-CE2 4.09Å; I95-I364 HydrophobicContact CB-CD1 4.27Å; I95-I364 HydrophobicContact CG2-CD1 3.32Å; I95-M373 HydrophobicContact CD1-CE 3.64Å; I95-M373 HydrophobicContact CD1-SD 3.86Å; I95-C409 WeakPolarHBondContact O-CA 3.32Å; I95-R410 PolarHBondContact O-N 3.46Å
96	P	85.8	Confident	78.3	Confident	1 Å²	1	84.2 Å²	84.2	1%	0.006	44%	0.439	C	S	.	.	B	Isolated β-bridge	trans	-59.9	138.4	175.4	22	-32.1	0	0	0	110.3	L362 I364 L376 V395 W407	P96-L362 HydrophobicContact CG-CD2 4.06Å; P96-I364 HydrophobicContact CG-CD1 3.73Å; P96-I364 HydrophobicContact CG-CG1 4.44Å; P96-L376 HydrophobicContact CB-CD1 4.13Å; P96-L376 HydrophobicContact CG-CD1 4.04Å; P96-L376 WeakPolarHBondContact O-CD1 3.36Å; P96-V395 HydrophobicContact CB-CB 4.45Å; P96-V395 HydrophobicContact CB-CG2 4.06Å; P96-V395 HydrophobicContact CG-CG2 3.98Å; P96-W407 HydrophobicContact CB-CB 3.84Å; P96-W407 HydrophobicContact CB-CG 4.47Å
97	R	83.3	Confident	80.4	Confident	116 Å²	116	79.8 Å²	79.8	44%	0.438	41%	0.407	S	S	.	.			trans	-127.2	147.6	177.2	-61.3	-164.3	-167.7	-149.6	-2.8	110.7	I95 E408 R410	I95-R97 PolarHBondContact O-N 3.06Å; R97-E408 PolarHBondContact N-O 2.8Å; R97-R410 HydrophobicContact CG-CB 4.31Å; R97-R410 VanDerWaalsContact CZ-O 3.26Å; R97-R410 PolarHBondContact NE-O 3.37Å; R97-R410 PolarHBondContact NH2-O 2.79Å
98	P	82.4	Confident	82.6	Confident	80 Å²	80	82.8 Å²	82.8	52%	0.519	41%	0.412	S	S	.	.	S	Bend	trans	-76.3	156.4	170	31.9	-29.4	0	0	0	110.2	L376	P98-L376 HydrophobicContact CG-CD2 4.12Å
99	P	85.8	Confident	84.8	Confident	108 Å²	108	76.4 Å²	76.4	70%	0.701	39%	0.388	S	S	*	.	S	Bend	cis	-74	161.7	-2.5	31.9	-35.5	0	0	0	112.8
100	E	88.6	Confident	86.5	Confident	69 Å²	69	72.1 Å²	72.1	32%	0.322	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-55.4	143	167	60.6	-90.6	-136.2	0	0	110.6	K405 W407	E100-K405 HydrophobicContact CB-CB 4.44Å; E100-K405 HydrophobicContact CB-CD 4.29Å; E100-K405 HydrophobicContact CG-CD 4.16Å; E100-K405 HydrophobicContact CG-CG 4.5Å; E100-K405 WeakPolarHBondContact OE1-CE 3.49Å; E100-K405 IonicContact OE1-NZ 3.59Å; E100-K405 PolarHBondContact OE1-NZ 3.38Å; E100-W407 HydrophobicContact CB-CD2 4.41Å; E100-W407 HydrophobicContact CB-CE3 4.1Å; E100-W407 HydrophobicContact CB-CH2 4.1Å; E100-W407 HydrophobicContact CB-CZ2 4.41Å; E100-W407 HydrophobicContact CB-CZ3 3.94Å
101	R	89.8	Confident	87.9	Confident	97 Å²	97	66.8 Å²	66.8	37%	0.366	35%	0.346	S	S	.	.	S	Bend	trans	-76.8	-44.5	178.3	-176.8	176	166.7	165.2	-13.9	110.7	E138 V406 E408	R101-E138 PolarHBondContact NH2-O 3.49Å; R101-V406 PolarHBondContact N-O 3.45Å; R101-E408 IonicContact NH1-OE1 3.74Å
102	Y	92	Very high	89.1	Confident	69 Å²	69	64.5 Å²	64.5	27%	0.271	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	142.7	176.4	-63.5	-68.2	0	0	0	110.6	E138 T139 K405 V406	Y102-E138 WeakPolarHBondContact CE2-O 3.42Å; Y102-E138 PolarHBondContact OH-O 2.86Å; Y102-T139 WeakPolarHBondContact CE1-O 3.34Å; Y102-T139 PolarHBondContact OH-O 2.72Å; Y102-K405 WeakPolarHBondContact O-CA 3.35Å; Y102-V406 HydrophobicContact CD2-CB 4.43Å; Y102-V406 PolarHBondContact N-O 3.07Å; Y102-V406 PolarHBondContact O-N 3.03Å
103	A	93.4	Very high	90.3	Very high	61 Å²	61	60 Å²	60	50%	0.504	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	98.5	168.6	0	0	0	0	0	108.1	K405	A103-K405 HydrophobicContact CB-CG 4.3Å
104	L	93.7	Very high	91.1	Very high	14 Å²	14	55.3 Å²	55.3	7%	0.073	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	123.5	-175.6	-52.5	-172.3	0	0	0	109.7	M123 W135 G140 T403 V404	L104-M123 HydrophobicContact CD1-CE 3.12Å; L104-M123 HydrophobicContact CG-CE 4.22Å; L104-W135 HydrophobicContact CB-CD2 4.45Å; L104-W135 HydrophobicContact CB-CE3 4.07Å; L104-W135 HydrophobicContact CB-CH2 4.37Å; L104-W135 HydrophobicContact CB-CZ3 4.02Å; L104-W135 HydrophobicContact CD1-CB 3.76Å; L104-W135 HydrophobicContact CD1-CD2 3.76Å; L104-W135 HydrophobicContact CD1-CE3 3.65Å; L104-W135 HydrophobicContact CD1-CG 3.84Å; L104-W135 HydrophobicContact CD1-CZ3 4.42Å; L104-W135 HydrophobicContact CG-CE3 4.37Å; L104-G140 WeakPolarHBondContact CD2-O 3.34Å; L104-T403 WeakPolarHBondContact O-CA 3.19Å; L104-V404 HydrophobicContact CB-CB 4.4Å; L104-V404 PolarHBondContact N-O 3.18Å; L104-V404 PolarHBondContact O-N 3.34Å
105	S	92.6	Very high	91.7	Very high	94 Å²	94	55 Å²	55	66%	0.657	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.4	138.7	175.9	-178.6	0	0	0	0	109.5
106	G	89.2	Confident	92.3	Very high	36 Å²	36	54.5 Å²	54.5	37%	0.371	29%	0.286	S	S	.	.			trans	167.2	-13.8	178.1	0	0	0	0	0	115.1	K133	G106-K133 WeakPolarHBondContact O-CE 3.44Å
107	H	94.4	Very high	92.7	Very high	8 Å²	8	54.5 Å²	54.5	4%	0.037	29%	0.285	C	S	.	.			trans	-72.2	151.7	164.6	-79.8	-67	0	0	0	110.9	V111 S125 S127 D129 Q402	H107-V111 HydrophobicContact CB-CG2 4.44Å; H107-S125 PolarHBondContact NE2-OG 2.78Å; H107-S127 VanDerWaalsContact CE1-CB 3.42Å; H107-S127 WeakPolarHBondContact CE1-CB 3.21Å; H107-S127 WeakPolarHBondContact ND1-CB 3.43Å; H107-D129 WeakPolarHBondContact CA-OD2 3.34Å; H107-D129 IonicContact CG-OD2 2.8Å; H107-D129 IonicContact ND1-OD1 2.72Å; H107-D129 PolarHBondContact ND1-OD1 3.36Å; H107-D129 IonicContact ND1-OD2 3.2Å; H107-D129 PolarHBondContact ND1-OD2 3.24Å; H107-Q402 PolarHBondContact O-OE1 3.33Å
108	R	94.1	Very high	93	Very high	206 Å²	206	51.6 Å²	51.6	78%	0.777	28%	0.282	S	S	*	.	S	Bend	trans	-96.6	-18.8	179.7	-65.3	-177.6	178	-172	-2.2	113.6	D129 Q402	R108-D129 HydrophobicContact CB-CB 4.2Å; R108-D129 PolarHBondContact N-OD2 2.86Å; R108-D129 VanDerWaalsContact N-OD2 3.08Å; R108-Q402 VanDerWaalsContact O-CD 3.3Å; R108-Q402 PolarHBondContact O-NE2 2.93Å; R108-Q402 PolarHBondContact O-OE1 2.85Å
109	N	96.2	Very high	93.3	Very high	69 Å²	69	52.5 Å²	52.5	37%	0.369	29%	0.286	S	S	.	.	S	Bend	trans	-133.3	171.8	-176.7	-74.2	-10	0	0	0	109	S127 E128 D129	N109-S127 PolarHBondContact O-OG 3.44Å; N109-E128 HydrophobicContact CB-CB 3.83Å; N109-E128 PolarHBondContact ND2-O 3.19Å; N109-E128 VanDerWaalsContact ND2-O 3.15Å; N109-D129 HydrophobicContact CB-CB 3.96Å
110	P	96.5	Very high	93.5	Very high	23 Å²	23	52.6 Å²	52.6	15%	0.149	28%	0.275	C	S	.	.			trans	-47.2	140.5	178.5	-35	41.3	0	0	0	114.2	S127 E128 V400	P110-S127 VanDerWaalsContact O-CA 3.25Å; P110-S127 WeakPolarHBondContact O-CA 3.33Å; P110-S127 WeakPolarHBondContact O-CB 3.44Å; P110-S127 PolarHBondContact O-OG 2.79Å; P110-E128 HydrophobicContact CB-CG 4.32Å; P110-E128 WeakPolarHBondContact CD-OE2 3.2Å; P110-E128 WeakPolarHBondContact CG-OE2 3.36Å; P110-E128 PolarHBondContact O-N 2.95Å; P110-V400 HydrophobicContact CB-CB 4.43Å; P110-V400 HydrophobicContact CB-CG1 4.23Å; P110-V400 HydrophobicContact CG-CG1 3.85Å
111	V	97.3	Very high	93.6	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	129.8	171.4	178.4	0	0	0	0	108.1	H107 V114 A126 T384 S399 V404	H107-V111 HydrophobicContact CB-CG2 4.44Å; V111-V114 HydrophobicContact CG1-CG2 3.67Å; V111-A126 CarbonylContact C-O 3.58Å; V111-A126 WeakPolarHBondContact CA-O 3.23Å; V111-A126 WeakPolarHBondContact CG1-O 3.42Å; V111-T384 VanDerWaalsContact O-CB 3.28Å; V111-T384 WeakPolarHBondContact O-CB 3.42Å; V111-T384 WeakPolarHBondContact O-CG2 3.26Å; V111-T384 PolarHBondContact O-OG1 3.5Å; V111-S399 PolarHBondContact N-O 2.86Å; V111-S399 VanDerWaalsContact N-O 3.11Å; V111-V404 HydrophobicContact CG1-CG2 4.12Å; V111-V404 HydrophobicContact CG2-CG2 3.98Å
112	T	96.5	Very high	93.8	Very high	19 Å²	19	47.1 Å²	47.1	12%	0.117	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	-44.9	-177	51.5	0	0	0	0	112	A126 E128 V153 S385	T112-A126 PolarHBondContact N-O 2.94Å; T112-A126 VanDerWaalsContact OG1-C 3.31Å; T112-A126 WeakPolarHBondContact OG1-CB 3.22Å; T112-A126 PolarHBondContact OG1-O 2.82Å; T112-E128 HydrophobicContact CG2-CG 3.7Å; T112-V153 WeakPolarHBondContact CB-O 3.15Å; T112-V153 VanDerWaalsContact CG2-O 3.29Å; T112-V153 WeakPolarHBondContact CG2-O 3.45Å; T112-V153 PolarHBondContact OG1-O 3.33Å; T112-S385 WeakPolarHBondContact O-CB 3.5Å; T112-S385 PolarHBondContact O-OG 3.15Å
113	R	96.9	Very high	93.9	Very high	39 Å²	39	43.8 Å²	43.8	15%	0.147	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	142.8	-179.5	-174	71.2	82.1	168.8	2	111.4	I115 S125 A126 D155 M239 S385	R113-I115 HydrophobicContact CG-CD1 4.06Å; R113-I115 HydrophobicContact CG-CG1 3.97Å; R113-S125 CarbonylContact O-C 3.59Å; R113-S125 WeakPolarHBondContact O-CA 3.27Å; R113-A126 HydrophobicContact CB-CB 4.43Å; R113-A126 PolarHBondContact O-N 3.18Å; R113-D155 WeakPolarHBondContact CG-OD1 3.38Å; R113-D155 IonicContact CZ-OD1 3.01Å; R113-D155 VanDerWaalsContact CZ-OD1 3.23Å; R113-D155 IonicContact CZ-OD2 3.88Å; R113-D155 IonicContact NE-OD1 3.58Å; R113-D155 PolarHBondContact NE-OD1 2.64Å; R113-D155 IonicContact NE-OD2 3.37Å; R113-D155 VanDerWaalsContact NH2-CG 3.29Å; R113-D155 IonicContact NH2-OD1 2.78Å; R113-D155 PolarHBondContact NH2-OD1 2.84Å; R113-D155 VanDerWaalsContact NH2-OD1 3.12Å; R113-D155 IonicContact NH2-OD2 3.53Å; R113-D155 PolarHBondContact NH2-OD2 3.1Å; R113-M239 PolarHBondContact NH2-SD 3.45Å; R113-S385 WeakPolarHBondContact CA-OG 3.42Å
114	V	97	Very high	94.1	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	138.5	168.5	-170.4	0	0	0	0	109.1	V111 M123 V124 S385 V396 V404	V111-V114 HydrophobicContact CG1-CG2 3.67Å; V114-M123 HydrophobicContact CG1-SD 4.2Å; V114-V124 WeakPolarHBondContact CA-O 3.42Å; V114-S385 PolarHBondContact N-OG 2.82Å; V114-V396 HydrophobicContact CB-CG2 4.22Å; V114-V396 HydrophobicContact CG1-CB 3.83Å; V114-V396 HydrophobicContact CG1-CG2 3.49Å; V114-V396 VanDerWaalsContact CG1-CG2 3.49Å; V114-V404 HydrophobicContact CG1-CG1 3.98Å; V114-V404 HydrophobicContact CG2-CG1 4.06Å; V114-V404 HydrophobicContact CG2-CG2 4.08Å
115	I	96.7	Very high	94.3	Very high	23 Å²	23	40.2 Å²	40.2	12%	0.118	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	143.2	179.7	-65.2	-178.4	0	0	0	110.5	R113 M123 V124 I156 F158 D387	R113-I115 HydrophobicContact CG-CD1 4.06Å; R113-I115 HydrophobicContact CG-CG1 3.97Å; I115-M123 WeakPolarHBondContact O-CA 3.44Å; I115-V124 PolarHBondContact N-O 3.29Å; I115-V124 PolarHBondContact O-N 2.86Å; I115-I156 HydrophobicContact CD1-CB 4.19Å; I115-I156 HydrophobicContact CD1-CG2 4.46Å; I115-I156 WeakPolarHBondContact CD1-O 3.36Å; I115-F158 HydrophobicContact CG2-CD2 3.84Å; I115-F158 HydrophobicContact CG2-CE2 4.44Å; I115-D387 WeakPolarHBondContact CA-OD2 3.49Å
116	F	96.1	Very high	94.5	Very high	13 Å²	13	35.8 Å²	35.8	6%	0.057	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	142.7	168.9	-76.3	-71	0	0	0	112.7	M123 Y137 D387 H389 F394 V396	F116-M123 HydrophobicContact CD1-CB 4Å; F116-M123 HydrophobicContact CE1-CB 4.32Å; F116-Y137 AromaticContact CD1-CD1 3.64Å; F116-Y137 HydrophobicContact CD1-CD1 3.64Å; F116-Y137 AromaticContact CD1-CE1 3.77Å; F116-Y137 HydrophobicContact CD1-CE1 3.77Å; F116-Y137 HydrophobicContact CD1-CG 4.35Å; F116-Y137 AromaticContact CE1-CD1 3.5Å; F116-Y137 HydrophobicContact CE1-CD1 3.5Å; F116-Y137 HydrophobicContact CE1-CD2 4.3Å; F116-Y137 AromaticContact CE1-CE1 3.89Å; F116-Y137 HydrophobicContact CE1-CE1 3.89Å; F116-Y137 AromaticContact CE1-CG 3.75Å; F116-Y137 HydrophobicContact CE1-CG 3.75Å; F116-D387 HydrophobicContact CD2-CB 4.19Å; F116-D387 PolarHBondContact N-OD2 2.8Å; F116-H389 HydrophobicContact CD1-CB 4.45Å; F116-H389 AromaticContact CD1-CD2 3.75Å; F116-H389 HydrophobicContact CD2-CB 3.8Å; F116-H389 HydrophobicContact CE1-CB 4.41Å; F116-H389 HydrophobicContact CE2-CB 3.74Å; F116-H389 HydrophobicContact CG-CB 4.14Å; F116-H389 AromaticContact CG-CD2 3.72Å; F116-H389 HydrophobicContact CZ-CB 4.04Å; F116-F394 HydrophobicContact CE1-CB 4.3Å; F116-F394 HydrophobicContact CZ-CB 3.68Å; F116-V396 HydrophobicContact CD2-CG2 3.92Å; F116-V396 HydrophobicContact CE1-CG1 3.72Å; F116-V396 HydrophobicContact CE2-CB 4.18Å; F116-V396 HydrophobicContact CE2-CG1 3.83Å; F116-V396 HydrophobicContact CE2-CG2 3.53Å; F116-V396 HydrophobicContact CZ-CB 4.11Å; F116-V396 HydrophobicContact CZ-CG1 3.25Å; F116-V396 HydrophobicContact CZ-CG2 3.89Å
117	H	94.4	Very high	94.8	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.17	C	C	.	.			trans	-71.1	138.7	166.8	-175.3	-79.1	0	0	0	109.8	V119 F120 V122 F158 G162 F179	H117-V119 VanDerWaalsContact C-N 3.35Å; H117-V119 PolarHBondContact ND1-N 3.16Å; H117-V119 PolarHBondContact O-N 3.13Å; H117-F120 AromaticContact CE1-CD2 3.14Å; H117-F120 WeakPolarHBondContact CE1-CD2 3.14Å; H117-F120 AromaticContact CE1-CE2 3.74Å; H117-F120 AromaticContact CE1-CG 3.73Å; H117-F120 PolarHBondContact CE1-N 2.79Å; H117-F120 AromaticContact ND1-CD2 3.67Å; H117-F120 AromaticContact ND1-CG 3.89Å; H117-F120 PolarHBondContact ND1-N 2.85Å; H117-F120 AromaticContact NE2-CD2 3.44Å; H117-F120 WeakPolarHBondContact NE2-CD2 3.44Å; H117-F120 AromaticContact NE2-CE2 3.91Å; H117-V122 HydrophobicContact CB-CB 4.34Å; H117-V122 WeakPolarHBondContact CB-O 3.2Å; H117-V122 PolarHBondContact N-O 3.14Å; H117-F158 HydrophobicContact CB-CE2 4.29Å; H117-F158 HydrophobicContact CB-CZ 4.27Å; H117-F158 AromaticContact CD2-CE1 3.49Å; H117-F158 VanDerWaalsContact CD2-CE1 3.49Å; H117-F158 WeakPolarHBondContact CD2-CE1 3.3Å; H117-F158 AromaticContact CD2-CZ 3.71Å; H117-G162 WeakPolarHBondContact NE2-CA 3.48Å; H117-G162 PolarHBondContact NE2-O 3.47Å; H117-F179 AromaticContact CD2-CD1 3.78Å; H117-F179 AromaticContact CD2-CE1 3.62Å; H117-F179 AromaticContact NE2-CD1 3.75Å; H117-F179 AromaticContact NE2-CE1 3.94Å
118	P	90.1	Very high	94.9	Very high	55 Å²	55	37.5 Å²	37.5	36%	0.357	19%	0.186	S	C	.	.	S	Bend	trans	-72.5	-20.6	-172.7	26.3	-35.6	0	0	0	115.4
119	V	88.7	Confident	95	Very high	100 Å²	100	29 Å²	29	61%	0.606	16%	0.156	S	C	*	.	S	Bend	trans	-120.5	-57.5	-175	-176.1	0	0	0	0	113.1	H117	H117-V119 VanDerWaalsContact C-N 3.35Å; H117-V119 PolarHBondContact ND1-N 3.16Å; H117-V119 PolarHBondContact O-N 3.13Å
120	F	89.3	Confident	94.9	Very high	109 Å²	109	26.6 Å²	26.6	48%	0.478	15%	0.145	S	C	.	.	S	Bend	trans	-73.6	154.9	177.3	-53.1	-49.7	0	0	0	113.5	H117 V122 F179	H117-F120 AromaticContact CE1-CD2 3.14Å; H117-F120 WeakPolarHBondContact CE1-CD2 3.14Å; H117-F120 AromaticContact CE1-CE2 3.74Å; H117-F120 AromaticContact CE1-CG 3.73Å; H117-F120 PolarHBondContact CE1-N 2.79Å; H117-F120 AromaticContact ND1-CD2 3.67Å; H117-F120 AromaticContact ND1-CG 3.89Å; H117-F120 PolarHBondContact ND1-N 2.85Å; H117-F120 AromaticContact NE2-CD2 3.44Å; H117-F120 WeakPolarHBondContact NE2-CD2 3.44Å; H117-F120 AromaticContact NE2-CE2 3.91Å; F120-V122 HydrophobicContact CB-CB 4.45Å; F120-V122 HydrophobicContact CB-CG2 4.15Å; F120-V122 PolarHBondContact O-N 3.44Å; F120-F179 HydrophobicContact CD2-CD1 4.26Å; F120-F179 HydrophobicContact CD2-CE1 4.02Å; F120-F179 HydrophobicContact CE2-CD1 4.42Å
121	S	90.8	Very high	94.9	Very high	43 Å²	43	26.4 Å²	26.4	30%	0.301	14%	0.144	S	C	.	.	S	Bend	trans	-74.4	45.1	177.8	55.9	0	0	0	0	113.3	Y137	S121-Y137 VanDerWaalsContact C-CD1 3.45Å; S121-Y137 WeakPolarHBondContact CA-OH 3.49Å; S121-Y137 WeakPolarHBondContact O-CD1 3.48Å; S121-Y137 PolarHBondContact O-N 3.29Å
122	V	93.9	Very high	94.9	Very high	8 Å²	8	26.5 Å²	26.5	5%	0.048	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	147.1	-170.3	178.1	0	0	0	0	109.7	H117 F120 V134 W135 Y137 F179	H117-V122 HydrophobicContact CB-CB 4.34Å; H117-V122 WeakPolarHBondContact CB-O 3.2Å; H117-V122 PolarHBondContact N-O 3.14Å; F120-V122 HydrophobicContact CB-CB 4.45Å; F120-V122 HydrophobicContact CB-CG2 4.15Å; F120-V122 PolarHBondContact O-N 3.44Å; V122-V134 HydrophobicContact CG1-CG1 3.17Å; V122-W135 CarbonylContact C-O 3.57Å; V122-W135 WeakPolarHBondContact CA-O 3.31Å; V122-W135 WeakPolarHBondContact CG1-O 3.3Å; V122-Y137 VanDerWaalsContact N-CE1 3.34Å; V122-F179 HydrophobicContact CG1-CZ 4.03Å
123	M	95.1	Very high	94.9	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	156.3	168.8	68.3	169.4	178.9	0	0	111	L104 V114 I115 F116 W135 Y137 V396 V404 V406	L104-M123 HydrophobicContact CD1-CE 3.12Å; L104-M123 HydrophobicContact CG-CE 4.22Å; V114-M123 HydrophobicContact CG1-SD 4.2Å; I115-M123 WeakPolarHBondContact O-CA 3.44Å; F116-M123 HydrophobicContact CD1-CB 4Å; F116-M123 HydrophobicContact CE1-CB 4.32Å; M123-W135 HydrophobicContact CE-CB 3.77Å; M123-W135 HydrophobicContact CE-CG 4.06Å; M123-W135 HydrophobicContact CG-CB 3.94Å; M123-W135 PolarHBondContact N-O 2.87Å; M123-W135 PolarHBondContact O-N 2.98Å; M123-Y137 HydrophobicContact CB-CD1 4.41Å; M123-V396 HydrophobicContact SD-CB 4.03Å; M123-V396 HydrophobicContact SD-CG1 3.33Å; M123-V396 WeakPolarHBondContact SD-CG1 3.23Å; M123-V404 HydrophobicContact CE-CB 4.5Å; M123-V404 HydrophobicContact CE-CG1 3.66Å; M123-V404 HydrophobicContact SD-CG1 3.97Å; M123-V406 HydrophobicContact CE-CG2 3.67Å; M123-V406 HydrophobicContact SD-CG2 4.18Å
124	V	96.6	Very high	94.8	Very high	0 Å²	0	25 Å²	25	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	136.1	-178.6	-177.1	0	0	0	0	109.9	V114 I115 I132 K133 V134 I156 F158 L165 F179	V114-V124 WeakPolarHBondContact CA-O 3.42Å; I115-V124 PolarHBondContact N-O 3.29Å; I115-V124 PolarHBondContact O-N 2.86Å; V124-I132 HydrophobicContact CG1-CG2 3.16Å; V124-K133 CarbonylContact C-O 3.55Å; V124-K133 VanDerWaalsContact CA-O 3.3Å; V124-K133 WeakPolarHBondContact CA-O 3.03Å; V124-V134 HydrophobicContact CG2-CG2 4.15Å; V124-I156 HydrophobicContact CG1-CD1 3.92Å; V124-F158 HydrophobicContact CB-CE2 4.07Å; V124-F158 HydrophobicContact CB-CZ 4.33Å; V124-F158 HydrophobicContact CG2-CE2 3.64Å; V124-F158 HydrophobicContact CG2-CZ 3.48Å; V124-F158 VanDerWaalsContact CG2-CZ 3.48Å; V124-L165 HydrophobicContact CG1-CD2 4.23Å; V124-F179 HydrophobicContact CG2-CE2 4.13Å
125	S	97.1	Very high	94.7	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	138.8	175.2	61.6	0	0	0	0	111.8	H107 R113 I132 K133 W135	H107-S125 PolarHBondContact NE2-OG 2.78Å; R113-S125 CarbonylContact O-C 3.59Å; R113-S125 WeakPolarHBondContact O-CA 3.27Å; S125-I132 CarbonylContact O-C 3.56Å; S125-I132 VanDerWaalsContact O-CA 3.28Å; S125-I132 WeakPolarHBondContact O-CA 3.46Å; S125-K133 PolarHBondContact N-O 2.9Å; S125-K133 PolarHBondContact O-N 2.91Å; S125-W135 PolarHBondContact OG-NE1 2.77Å
126	A	97.1	Very high	94.6	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	152.2	168.7	0	0	0	0	0	110.3	V111 T112 R113 V153 I156	V111-A126 CarbonylContact C-O 3.58Å; V111-A126 WeakPolarHBondContact CA-O 3.23Å; V111-A126 WeakPolarHBondContact CG1-O 3.42Å; T112-A126 PolarHBondContact N-O 2.94Å; T112-A126 VanDerWaalsContact OG1-C 3.31Å; T112-A126 WeakPolarHBondContact OG1-CB 3.22Å; T112-A126 PolarHBondContact OG1-O 2.82Å; R113-A126 HydrophobicContact CB-CB 4.43Å; R113-A126 PolarHBondContact O-N 3.18Å; A126-V153 HydrophobicContact CB-CB 3.88Å; A126-V153 HydrophobicContact CB-CG1 3.46Å; A126-V153 VanDerWaalsContact CB-CG1 3.46Å; A126-I156 HydrophobicContact CB-CD1 3.2Å; A126-I156 HydrophobicContact CB-CG1 3.63Å; A126-I156 VanDerWaalsContact N-CD1 3.3Å
127	S	97.2	Very high	94.3	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	162.1	178.9	172.8	0	0	0	0	112.2	H107 N109 P110 D129 A130 T131 V153	H107-S127 VanDerWaalsContact CE1-CB 3.42Å; H107-S127 WeakPolarHBondContact CE1-CB 3.21Å; H107-S127 WeakPolarHBondContact ND1-CB 3.43Å; N109-S127 PolarHBondContact O-OG 3.44Å; P110-S127 VanDerWaalsContact O-CA 3.25Å; P110-S127 WeakPolarHBondContact O-CA 3.33Å; P110-S127 WeakPolarHBondContact O-CB 3.44Å; P110-S127 PolarHBondContact O-OG 2.79Å; S127-D129 WeakPolarHBondContact CB-OD1 3.38Å; S127-D129 PolarHBondContact O-N 2.7Å; S127-D129 PolarHBondContact OG-N 2.91Å; S127-D129 VanDerWaalsContact OG-N 3.17Å; S127-D129 PolarHBondContact OG-OD1 3.04Å; S127-A130 PolarHBondContact O-N 2.73Å; S127-T131 PolarHBondContact N-O 2.93Å; S127-V153 PolarHBondContact O-N 3.22Å; S127-V153 VanDerWaalsContact O-N 3.09Å
128	E	96.3	Very high	94.1	Very high	81 Å²	81	29.8 Å²	29.8	38%	0.379	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-4	167.1	-65.9	-178.7	179.3	0	0	113.2	N109 P110 T112 A130 S152	N109-E128 HydrophobicContact CB-CB 3.83Å; N109-E128 PolarHBondContact ND2-O 3.19Å; N109-E128 VanDerWaalsContact ND2-O 3.15Å; P110-E128 HydrophobicContact CB-CG 4.32Å; P110-E128 WeakPolarHBondContact CD-OE2 3.2Å; P110-E128 WeakPolarHBondContact CG-OE2 3.36Å; P110-E128 PolarHBondContact O-N 2.95Å; T112-E128 HydrophobicContact CG2-CG 3.7Å; E128-A130 PolarHBondContact O-N 2.86Å; E128-S152 PolarHBondContact O-OG 3.39Å
129	D	94.6	Very high	94	Very high	28 Å²	28	30.1 Å²	30.1	15%	0.15	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	9.6	171.7	67.4	14.9	0	0	0	113.6	H107 R108 N109 S127 T131	H107-D129 WeakPolarHBondContact CA-OD2 3.34Å; H107-D129 IonicContact CG-OD2 2.8Å; H107-D129 IonicContact ND1-OD1 2.72Å; H107-D129 PolarHBondContact ND1-OD1 3.36Å; H107-D129 IonicContact ND1-OD2 3.2Å; H107-D129 PolarHBondContact ND1-OD2 3.24Å; R108-D129 HydrophobicContact CB-CB 4.2Å; R108-D129 PolarHBondContact N-OD2 2.86Å; R108-D129 VanDerWaalsContact N-OD2 3.08Å; N109-D129 HydrophobicContact CB-CB 3.96Å; S127-D129 WeakPolarHBondContact CB-OD1 3.38Å; S127-D129 PolarHBondContact O-N 2.7Å; S127-D129 PolarHBondContact OG-N 2.91Å; S127-D129 VanDerWaalsContact OG-N 3.17Å; S127-D129 PolarHBondContact OG-OD1 3.04Å; D129-T131 VanDerWaalsContact CG-OG1 3.23Å; D129-T131 PolarHBondContact O-N 3.03Å; D129-T131 WeakPolarHBondContact OD1-CA 3.49Å; D129-T131 VanDerWaalsContact OD1-CB 3.3Å; D129-T131 WeakPolarHBondContact OD1-CB 3.05Å; D129-T131 PolarHBondContact OD1-N 2.79Å; D129-T131 PolarHBondContact OD1-OG1 3.31Å; D129-T131 PolarHBondContact OD2-OG1 3.14Å
130	A	95.1	Very high	93.9	Very high	17 Å²	17	26 Å²	26	14%	0.14	14%	0.138	C	C	.	.	S	Bend	trans	62.3	15.9	-176.2	0	0	0	0	0	114.3	S127 E128 H149 D151	S127-A130 PolarHBondContact O-N 2.73Å; E128-A130 PolarHBondContact O-N 2.86Å; A130-H149 HydrophobicContact CB-CB 4.42Å; A130-D151 VanDerWaalsContact CB-O 3.23Å; A130-D151 WeakPolarHBondContact CB-O 3.49Å
131	T	95.8	Very high	93.9	Very high	20 Å²	20	25.7 Å²	25.7	12%	0.123	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	152.9	178.4	76.4	0	0	0	0	112.6	S127 D129 T145 K147	S127-T131 PolarHBondContact N-O 2.93Å; D129-T131 VanDerWaalsContact CG-OG1 3.23Å; D129-T131 PolarHBondContact O-N 3.03Å; D129-T131 WeakPolarHBondContact OD1-CA 3.49Å; D129-T131 VanDerWaalsContact OD1-CB 3.3Å; D129-T131 WeakPolarHBondContact OD1-CB 3.05Å; D129-T131 PolarHBondContact OD1-N 2.79Å; D129-T131 PolarHBondContact OD1-OG1 3.31Å; D129-T131 PolarHBondContact OD2-OG1 3.14Å; T131-T145 HydrophobicContact CG2-CG2 4.06Å; T131-K147 HydrophobicContact CG2-CG 4.26Å
132	I	97.1	Very high	94	Very high	1 Å²	1	28.5 Å²	28.5	1%	0.005	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	126.4	170	-59.6	161.8	0	0	0	106.8	V124 S125 T145 L146 V153 I156 L165 W177	V124-I132 HydrophobicContact CG1-CG2 3.16Å; S125-I132 CarbonylContact O-C 3.56Å; S125-I132 VanDerWaalsContact O-CA 3.28Å; S125-I132 WeakPolarHBondContact O-CA 3.46Å; I132-T145 CarbonylContact O-C 3.57Å; I132-T145 WeakPolarHBondContact O-CA 3.22Å; I132-L146 HydrophobicContact CB-CB 4.13Å; I132-L146 HydrophobicContact CB-CD1 4.37Å; I132-L146 HydrophobicContact CG2-CD1 4.13Å; I132-L146 PolarHBondContact N-O 2.83Å; I132-L146 VanDerWaalsContact N-O 3.15Å; I132-L146 PolarHBondContact O-N 2.65Å; I132-V153 HydrophobicContact CD1-CG1 4.26Å; I132-V153 HydrophobicContact CG1-CG1 4.02Å; I132-V153 HydrophobicContact CG1-CG2 4.16Å; I132-I156 HydrophobicContact CG1-CD1 4.47Å; I132-I156 HydrophobicContact CG2-CD1 4.05Å; I132-L165 HydrophobicContact CG2-CD2 4.34Å; I132-W177 HydrophobicContact CD1-CZ2 4.42Å
133	K	96.2	Very high	93.9	Very high	26 Å²	26	32 Å²	32	11%	0.113	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	144.5	-179.2	-69.3	-177.5	178.7	-79.6	0	110.9	G106 V124 S125 W135 F142 R144 T145	G106-K133 WeakPolarHBondContact O-CE 3.44Å; V124-K133 CarbonylContact C-O 3.55Å; V124-K133 VanDerWaalsContact CA-O 3.3Å; V124-K133 WeakPolarHBondContact CA-O 3.03Å; S125-K133 PolarHBondContact N-O 2.9Å; S125-K133 PolarHBondContact O-N 2.91Å; K133-W135 HydrophobicContact CB-CZ2 3.84Å; K133-W135 HydrophobicContact CD-CH2 4.17Å; K133-W135 HydrophobicContact CD-CZ2 3.55Å; K133-W135 HydrophobicContact CG-CZ2 4.35Å; K133-F142 HydrophobicContact CB-CE2 4.29Å; K133-F142 HydrophobicContact CD-CE2 4.17Å; K133-F142 HydrophobicContact CG-CE2 4.09Å; K133-R144 WeakPolarHBondContact CA-O 3.28Å; K133-T145 HydrophobicContact CG-CG2 4.3Å; K133-T145 PolarHBondContact NZ-OG1 2.67Å; K133-T145 VanDerWaalsContact NZ-OG1 3.12Å
134	V	96.3	Very high	93.7	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	128.1	-178.3	-175.9	0	0	0	0	107.8	V122 V124 E143 R144 F179 F182	V122-V134 HydrophobicContact CG1-CG1 3.17Å; V124-V134 HydrophobicContact CG2-CG2 4.15Å; V134-E143 HydrophobicContact CG1-CB 4.37Å; V134-E143 PolarHBondContact O-N 2.79Å; V134-R144 HydrophobicContact CB-CB 4.45Å; V134-R144 PolarHBondContact N-O 3.37Å; V134-R144 PolarHBondContact O-N 3.29Å; V134-F179 HydrophobicContact CG1-CE2 4.24Å; V134-F179 HydrophobicContact CG1-CZ 4Å; V134-F179 HydrophobicContact CG2-CE2 4.22Å; V134-F182 HydrophobicContact CG2-CE1 4.25Å
135	W	95.3	Very high	93.6	Very high	10 Å²	10	39.7 Å²	39.7	4%	0.038	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	139.2	-173.4	-46.5	86.3	0	0	0	110	L104 V122 M123 S125 K133 Y137 D141 F142	L104-W135 HydrophobicContact CB-CD2 4.45Å; L104-W135 HydrophobicContact CB-CE3 4.07Å; L104-W135 HydrophobicContact CB-CH2 4.37Å; L104-W135 HydrophobicContact CB-CZ3 4.02Å; L104-W135 HydrophobicContact CD1-CB 3.76Å; L104-W135 HydrophobicContact CD1-CD2 3.76Å; L104-W135 HydrophobicContact CD1-CE3 3.65Å; L104-W135 HydrophobicContact CD1-CG 3.84Å; L104-W135 HydrophobicContact CD1-CZ3 4.42Å; L104-W135 HydrophobicContact CG-CE3 4.37Å; V122-W135 CarbonylContact C-O 3.57Å; V122-W135 WeakPolarHBondContact CA-O 3.31Å; V122-W135 WeakPolarHBondContact CG1-O 3.3Å; M123-W135 HydrophobicContact CE-CB 3.77Å; M123-W135 HydrophobicContact CE-CG 4.06Å; M123-W135 HydrophobicContact CG-CB 3.94Å; M123-W135 PolarHBondContact N-O 2.87Å; M123-W135 PolarHBondContact O-N 2.98Å; S125-W135 PolarHBondContact OG-NE1 2.77Å; K133-W135 HydrophobicContact CB-CZ2 3.84Å; K133-W135 HydrophobicContact CD-CH2 4.17Å; K133-W135 HydrophobicContact CD-CZ2 3.55Å; K133-W135 HydrophobicContact CG-CZ2 4.35Å; W135-Y137 PolarHBondContact O-N 3.02Å; W135-D141 WeakPolarHBondContact CA-O 3.27Å; W135-F142 HydrophobicContact CD2-CD2 4.48Å; W135-F142 HydrophobicContact CE3-CB 3.87Å; W135-F142 HydrophobicContact CE3-CD2 4.12Å; W135-F142 HydrophobicContact CH2-CD2 4.17Å; W135-F142 HydrophobicContact CZ2-CD2 4.5Å; W135-F142 HydrophobicContact CZ3-CB 3.76Å; W135-F142 AromaticContact CZ3-CD2 3.97Å; W135-F142 HydrophobicContact CZ3-CD2 3.97Å; W135-F142 HydrophobicContact CZ3-CG 4.31Å
136	D	93.5	Very high	93.5	Very high	25 Å²	25	40 Å²	40	13%	0.134	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	118.9	165	179.2	-7.5	0	0	0	108.3	E138 T139 G140 D141	D136-E138 VanDerWaalsContact C-N 3.34Å; D136-E138 WeakPolarHBondContact OD1-CB 3.4Å; D136-E138 PolarHBondContact OD1-N 3.38Å; D136-T139 VanDerWaalsContact CB-OG1 3.28Å; D136-T139 WeakPolarHBondContact CB-OG1 3.36Å; D136-T139 PolarHBondContact OD1-N 3.19Å; D136-T139 WeakPolarHBondContact OD2-CG2 3.38Å; D136-T139 PolarHBondContact OD2-OG1 2.77Å; D136-G140 CarbonylContact O-C 3.58Å; D136-G140 WeakPolarHBondContact O-CA 2.81Å; D136-G140 PolarHBondContact O-N 3.24Å; D136-D141 PolarHBondContact N-O 2.64Å
137	Y	91.1	Very high	93.3	Very high	10 Å²	10	47.8 Å²	47.8	4%	0.039	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-13.6	-178.1	67	-107.8	0	0	0	113	F116 S121 V122 M123 W135 F394	F116-Y137 AromaticContact CD1-CD1 3.64Å; F116-Y137 HydrophobicContact CD1-CD1 3.64Å; F116-Y137 AromaticContact CD1-CE1 3.77Å; F116-Y137 HydrophobicContact CD1-CE1 3.77Å; F116-Y137 HydrophobicContact CD1-CG 4.35Å; F116-Y137 AromaticContact CE1-CD1 3.5Å; F116-Y137 HydrophobicContact CE1-CD1 3.5Å; F116-Y137 HydrophobicContact CE1-CD2 4.3Å; F116-Y137 AromaticContact CE1-CE1 3.89Å; F116-Y137 HydrophobicContact CE1-CE1 3.89Å; F116-Y137 AromaticContact CE1-CG 3.75Å; F116-Y137 HydrophobicContact CE1-CG 3.75Å; S121-Y137 VanDerWaalsContact C-CD1 3.45Å; S121-Y137 WeakPolarHBondContact CA-OH 3.49Å; S121-Y137 WeakPolarHBondContact O-CD1 3.48Å; S121-Y137 PolarHBondContact O-N 3.29Å; V122-Y137 VanDerWaalsContact N-CE1 3.34Å; M123-Y137 HydrophobicContact CB-CD1 4.41Å; W135-Y137 PolarHBondContact O-N 3.02Å; Y137-F394 AromaticContact CD2-CD2 3.86Å; Y137-F394 HydrophobicContact CD2-CD2 3.86Å; Y137-F394 HydrophobicContact CD2-CE2 4.1Å; Y137-F394 HydrophobicContact CD2-CG 4.28Å; Y137-F394 AromaticContact CE2-CD2 3.54Å; Y137-F394 HydrophobicContact CE2-CD2 3.54Å; Y137-F394 AromaticContact CE2-CE2 3.69Å; Y137-F394 HydrophobicContact CE2-CE2 3.69Å; Y137-F394 HydrophobicContact CE2-CG 4.38Å
138	E	89.1	Confident	93	Very high	92 Å²	92	49.6 Å²	49.6	43%	0.43	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-41.1	179.2	-65.8	-168.8	169	0	0	112	R101 Y102 D136	R101-E138 PolarHBondContact NH2-O 3.49Å; Y102-E138 WeakPolarHBondContact CE2-O 3.42Å; Y102-E138 PolarHBondContact OH-O 2.86Å; D136-E138 VanDerWaalsContact C-N 3.34Å; D136-E138 WeakPolarHBondContact OD1-CB 3.4Å; D136-E138 PolarHBondContact OD1-N 3.38Å
139	T	87.9	Confident	93	Very high	63 Å²	63	46.5 Å²	46.5	39%	0.387	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94	-29	178.3	57.7	0	0	0	0	112.8	Y102 D136 D141	Y102-T139 WeakPolarHBondContact CE1-O 3.34Å; Y102-T139 PolarHBondContact OH-O 2.72Å; D136-T139 VanDerWaalsContact CB-OG1 3.28Å; D136-T139 WeakPolarHBondContact CB-OG1 3.36Å; D136-T139 PolarHBondContact OD1-N 3.19Å; D136-T139 WeakPolarHBondContact OD2-CG2 3.38Å; D136-T139 PolarHBondContact OD2-OG1 2.77Å; T139-D141 PolarHBondContact OG1-N 3.26Å
140	G	87.6	Confident	93	Very high	14 Å²	14	51.1 Å²	51.1	14%	0.144	27%	0.267	C	S	.	.			trans	83.2	12.5	-171.9	0	0	0	0	0	113.5	L104 D136	L104-G140 WeakPolarHBondContact CD2-O 3.34Å; D136-G140 CarbonylContact O-C 3.58Å; D136-G140 WeakPolarHBondContact O-CA 2.81Å; D136-G140 PolarHBondContact O-N 3.24Å
141	D	89.1	Confident	93	Very high	102 Å²	102	53.9 Å²	53.9	55%	0.545	28%	0.28	S	S	.	.			trans	-82.6	143.6	-176.4	-71.8	-30.7	0	0	0	112.5	W135 D136 T139	W135-D141 WeakPolarHBondContact CA-O 3.27Å; D136-D141 PolarHBondContact N-O 2.64Å; T139-D141 PolarHBondContact OG1-N 3.26Å
142	F	92.7	Very high	93	Very high	101 Å²	101	54 Å²	54	44%	0.443	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	120.9	171.4	168	-98.3	0	0	0	109.6	K133 W135 R144 T145	K133-F142 HydrophobicContact CB-CE2 4.29Å; K133-F142 HydrophobicContact CD-CE2 4.17Å; K133-F142 HydrophobicContact CG-CE2 4.09Å; W135-F142 HydrophobicContact CD2-CD2 4.48Å; W135-F142 HydrophobicContact CE3-CB 3.87Å; W135-F142 HydrophobicContact CE3-CD2 4.12Å; W135-F142 HydrophobicContact CH2-CD2 4.17Å; W135-F142 HydrophobicContact CZ2-CD2 4.5Å; W135-F142 HydrophobicContact CZ3-CB 3.76Å; W135-F142 AromaticContact CZ3-CD2 3.97Å; W135-F142 HydrophobicContact CZ3-CD2 3.97Å; W135-F142 HydrophobicContact CZ3-CG 4.31Å; F142-R144 WeakPolarHBondContact CE2-O 3.44Å; F142-R144 VanDerWaalsContact CZ-C 3.4Å; F142-T145 VanDerWaalsContact CE2-OG1 3.3Å; F142-T145 WeakPolarHBondContact CE2-OG1 3.35Å; F142-T145 WeakPolarHBondContact CZ-OG1 3.38Å
143	E	91.1	Very high	93	Very high	81 Å²	81	53.9 Å²	53.9	38%	0.379	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	-63	178.2	-64.9	-164.3	171	0	0	111.7	V134	V134-E143 HydrophobicContact CG1-CB 4.37Å; V134-E143 PolarHBondContact O-N 2.79Å
144	R	91.9	Very high	93	Very high	120 Å²	120	55.1 Å²	55.1	45%	0.453	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	159	-167.2	-61.9	-171.8	-147.3	-177.7	11.8	113.1	K133 V134 F142 F182	K133-R144 WeakPolarHBondContact CA-O 3.28Å; V134-R144 HydrophobicContact CB-CB 4.45Å; V134-R144 PolarHBondContact N-O 3.37Å; V134-R144 PolarHBondContact O-N 3.29Å; F142-R144 WeakPolarHBondContact CE2-O 3.44Å; F142-R144 VanDerWaalsContact CZ-C 3.4Å; R144-F182 HydrophobicContact CB-CD1 4.41Å; R144-F182 HydrophobicContact CB-CE1 4.42Å
145	T	94.6	Very high	93.1	Very high	42 Å²	42	55.1 Å²	55.1	26%	0.258	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	123.4	170	-60.9	0	0	0	0	109.3	T131 I132 K133 F142 K147	T131-T145 HydrophobicContact CG2-CG2 4.06Å; I132-T145 CarbonylContact O-C 3.57Å; I132-T145 WeakPolarHBondContact O-CA 3.22Å; K133-T145 HydrophobicContact CG-CG2 4.3Å; K133-T145 PolarHBondContact NZ-OG1 2.67Å; K133-T145 VanDerWaalsContact NZ-OG1 3.12Å; F142-T145 VanDerWaalsContact CE2-OG1 3.3Å; F142-T145 WeakPolarHBondContact CE2-OG1 3.35Å; F142-T145 WeakPolarHBondContact CZ-OG1 3.38Å; T145-K147 HydrophobicContact CG2-CG 3.84Å
146	L	94	Very high	93.1	Very high	8 Å²	8	54.6 Å²	54.6	4%	0.042	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	122.1	168	-56.1	171.8	0	0	0	108.4	I132 L165 W177 F182	I132-L146 HydrophobicContact CB-CB 4.13Å; I132-L146 HydrophobicContact CB-CD1 4.37Å; I132-L146 HydrophobicContact CG2-CD1 4.13Å; I132-L146 PolarHBondContact N-O 2.83Å; I132-L146 VanDerWaalsContact N-O 3.15Å; I132-L146 PolarHBondContact O-N 2.65Å; L146-L165 HydrophobicContact CD1-CD2 3.86Å; L146-W177 HydrophobicContact CB-CE3 4.15Å; L146-W177 HydrophobicContact CB-CH2 4.3Å; L146-W177 HydrophobicContact CB-CZ3 4.02Å; L146-W177 HydrophobicContact CD1-CB 4.48Å; L146-W177 HydrophobicContact CD1-CD2 4.2Å; L146-W177 HydrophobicContact CD1-CE3 4.31Å; L146-W177 HydrophobicContact CD1-CG 4.27Å; L146-W177 HydrophobicContact CD2-CE3 4.13Å; L146-W177 HydrophobicContact CG-CE3 4.44Å; L146-F182 HydrophobicContact CD2-CB 3.73Å; L146-F182 HydrophobicContact CD2-CD1 3.8Å; L146-F182 HydrophobicContact CD2-CG 4.26Å; L146-F182 WeakPolarHBondContact CD2-O 3.18Å
147	K	93.7	Very high	93.3	Very high	162 Å²	162	54 Å²	54	70%	0.704	28%	0.282	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.1	140.5	177.3	-62.8	-175.1	-179.9	176.8	0	109.3	T131 T145	T131-K147 HydrophobicContact CG2-CG 4.26Å; T145-K147 HydrophobicContact CG2-CG 3.84Å
148	G	90.8	Very high	93.5	Very high	38 Å²	38	54.5 Å²	54.5	39%	0.392	29%	0.285	S	S	.	.			trans	164.2	-18.7	175.4	0	0	0	0	0	114.6	K175	G148-K175 WeakPolarHBondContact O-CE 3.46Å; G148-K175 PolarHBondContact O-NZ 3.37Å
149	H	95.2	Very high	93.7	Very high	16 Å²	16	50.9 Å²	50.9	7%	0.074	27%	0.268	C	S	.	.			trans	-73	147.2	167.4	-79.9	-66.4	0	0	0	111	A130 V153 S167 S169 D171 T173	A130-H149 HydrophobicContact CB-CB 4.42Å; H149-V153 HydrophobicContact CB-CG2 4.07Å; H149-S167 PolarHBondContact NE2-OG 2.78Å; H149-S169 WeakPolarHBondContact ND1-CB 3.45Å; H149-D171 IonicContact CE1-OD2 2.8Å; H149-D171 IonicContact CG-OD2 3.01Å; H149-D171 IonicContact ND1-OD1 2.81Å; H149-D171 IonicContact ND1-OD2 2.72Å; H149-D171 PolarHBondContact ND1-OD2 3.12Å; H149-T173 PolarHBondContact CE1-OG1 2.89Å; H149-T173 PolarHBondContact ND1-OG1 2.8Å
150	T	94.8	Very high	93.8	Very high	125 Å²	125	53.5 Å²	53.5	77%	0.767	28%	0.276	S	S	*	.	S	Bend	trans	-94.2	-18.2	179.1	56.9	0	0	0	0	112.6	D171	T150-D171 PolarHBondContact N-OD2 2.65Å; T150-D171 VanDerWaalsContact N-OD2 3.15Å; T150-D171 WeakPolarHBondContact OG1-CB 3.44Å
151	D	95.9	Very high	93.9	Very high	76 Å²	76	56.4 Å²	56.4	41%	0.406	29%	0.291	S	S	.	.	S	Bend	trans	-138.7	175.5	179.2	-159.5	-6.6	0	0	0	110.4	A130 V153 S169 A170 D171	A130-D151 VanDerWaalsContact CB-O 3.23Å; A130-D151 WeakPolarHBondContact CB-O 3.49Å; D151-V153 PolarHBondContact O-N 3.21Å; D151-S169 PolarHBondContact O-OG 3.26Å; D151-A170 HydrophobicContact CB-CB 4.12Å; D151-A170 WeakPolarHBondContact OD2-CB 3.32Å; D151-D171 HydrophobicContact CB-CB 4.01Å
152	S	95.6	Very high	93.9	Very high	21 Å²	21	51.6 Å²	51.6	15%	0.147	27%	0.266	C	S	.	.			trans	-42.4	122.8	-177.5	-58.8	0	0	0	0	113.7	E128 S169 A170	E128-S152 PolarHBondContact O-OG 3.39Å; S152-S169 CarbonylContact O-C 3.52Å; S152-S169 VanDerWaalsContact O-CA 3.23Å; S152-S169 WeakPolarHBondContact O-CA 3.45Å; S152-S169 WeakPolarHBondContact O-CB 3.37Å; S152-S169 PolarHBondContact O-OG 3.42Å; S152-S169 VanDerWaalsContact O-OG 3.04Å; S152-A170 PolarHBondContact O-N 3.24Å
153	V	97.5	Very high	93.9	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	122.5	174.8	-177.1	0	0	0	0	108.1	T112 A126 S127 I132 H149 D151 I156 C168	T112-V153 WeakPolarHBondContact CB-O 3.15Å; T112-V153 VanDerWaalsContact CG2-O 3.29Å; T112-V153 WeakPolarHBondContact CG2-O 3.45Å; T112-V153 PolarHBondContact OG1-O 3.33Å; A126-V153 HydrophobicContact CB-CB 3.88Å; A126-V153 HydrophobicContact CB-CG1 3.46Å; A126-V153 VanDerWaalsContact CB-CG1 3.46Å; S127-V153 PolarHBondContact O-N 3.22Å; S127-V153 VanDerWaalsContact O-N 3.09Å; I132-V153 HydrophobicContact CD1-CG1 4.26Å; I132-V153 HydrophobicContact CG1-CG1 4.02Å; I132-V153 HydrophobicContact CG1-CG2 4.16Å; H149-V153 HydrophobicContact CB-CG2 4.07Å; D151-V153 PolarHBondContact O-N 3.21Å; V153-I156 HydrophobicContact CG1-CG1 4.44Å; V153-C168 CarbonylContact C-O 3.49Å; V153-C168 WeakPolarHBondContact CA-O 3.39Å; V153-C168 WeakPolarHBondContact CG1-O 3.35Å
154	Q	96.3	Very high	94.1	Very high	51 Å²	51	50.2 Å²	50.2	24%	0.238	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	-39.4	-173.3	-66.1	-67.6	-31.4	0	0	112.8	C168 V195	Q154-C168 PolarHBondContact N-O 3.43Å; Q154-V195 WeakPolarHBondContact CB-O 3.39Å
155	D	96.9	Very high	94.3	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	159.1	-175.7	-156	0.6	0	0	0	111.2	R113 S167 C168 S197 V198 R241	R113-D155 WeakPolarHBondContact CG-OD1 3.38Å; R113-D155 IonicContact CZ-OD1 3.01Å; R113-D155 VanDerWaalsContact CZ-OD1 3.23Å; R113-D155 IonicContact CZ-OD2 3.88Å; R113-D155 IonicContact NE-OD1 3.58Å; R113-D155 PolarHBondContact NE-OD1 2.64Å; R113-D155 IonicContact NE-OD2 3.37Å; R113-D155 VanDerWaalsContact NH2-CG 3.29Å; R113-D155 IonicContact NH2-OD1 2.78Å; R113-D155 PolarHBondContact NH2-OD1 2.84Å; R113-D155 VanDerWaalsContact NH2-OD1 3.12Å; R113-D155 IonicContact NH2-OD2 3.53Å; R113-D155 PolarHBondContact NH2-OD2 3.1Å; D155-S167 WeakPolarHBondContact O-CA 3.4Å; D155-C168 WeakPolarHBondContact CB-SG 3.37Å; D155-C168 PolarHBondContact N-SG 3.17Å; D155-C168 VanDerWaalsContact N-SG 3.42Å; D155-C168 PolarHBondContact O-N 3Å; D155-S197 WeakPolarHBondContact OD2-CA 3.49Å; D155-S197 VanDerWaalsContact OD2-CB 3.3Å; D155-S197 WeakPolarHBondContact OD2-CB 3.16Å; D155-S197 PolarHBondContact OD2-OG 2.78Å; D155-V198 HydrophobicContact CB-CG1 4.28Å; D155-V198 PolarHBondContact OD2-N 3.37Å; D155-R241 IonicContact OD1-NH2 3.39Å; D155-R241 PolarHBondContact OD1-NH2 2.87Å; D155-R241 IonicContact OD2-NH2 2.88Å; D155-R241 PolarHBondContact OD2-NH2 2.96Å
156	I	97	Very high	94.4	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	152	179.1	-61.2	163.5	0	0	0	107.8	I115 V124 A126 I132 V153 L165 A166	I115-I156 HydrophobicContact CD1-CB 4.19Å; I115-I156 HydrophobicContact CD1-CG2 4.46Å; I115-I156 WeakPolarHBondContact CD1-O 3.36Å; V124-I156 HydrophobicContact CG1-CD1 3.92Å; A126-I156 HydrophobicContact CB-CD1 3.2Å; A126-I156 HydrophobicContact CB-CG1 3.63Å; A126-I156 VanDerWaalsContact N-CD1 3.3Å; I132-I156 HydrophobicContact CG1-CD1 4.47Å; I132-I156 HydrophobicContact CG2-CD1 4.05Å; V153-I156 HydrophobicContact CG1-CG1 4.44Å; I156-L165 HydrophobicContact CG2-CD1 3.12Å; I156-L165 HydrophobicContact CG2-CD2 4.32Å; I156-L165 HydrophobicContact CG2-CG 3.91Å; I156-A166 CarbonylContact C-O 3.52Å; I156-A166 VanDerWaalsContact CA-O 3.3Å; I156-A166 WeakPolarHBondContact CA-O 3.19Å
157	S	96.3	Very high	94.6	Very high	11 Å²	11	42.1 Å²	42.1	8%	0.077	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	134.8	167.4	-173.5	0	0	0	0	111	A166 I200	S157-A166 PolarHBondContact N-O 2.84Å; S157-A166 PolarHBondContact O-N 2.99Å; S157-I200 WeakPolarHBondContact O-CD1 2.82Å; S157-I200 PolarHBondContact OG-N 3.07Å; S157-I200 VanDerWaalsContact OG-N 3.15Å
158	F	95.6	Very high	94.7	Very high	22 Å²	22	34.4 Å²	34.4	10%	0.096	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	153.7	168.3	-83.5	-73.2	0	0	0	111.8	I115 H117 V124 L165 F179	I115-F158 HydrophobicContact CG2-CD2 3.84Å; I115-F158 HydrophobicContact CG2-CE2 4.44Å; H117-F158 HydrophobicContact CB-CE2 4.29Å; H117-F158 HydrophobicContact CB-CZ 4.27Å; H117-F158 AromaticContact CD2-CE1 3.49Å; H117-F158 VanDerWaalsContact CD2-CE1 3.49Å; H117-F158 WeakPolarHBondContact CD2-CE1 3.3Å; H117-F158 AromaticContact CD2-CZ 3.71Å; V124-F158 HydrophobicContact CB-CE2 4.07Å; V124-F158 HydrophobicContact CB-CZ 4.33Å; V124-F158 HydrophobicContact CG2-CE2 3.64Å; V124-F158 HydrophobicContact CG2-CZ 3.48Å; V124-F158 VanDerWaalsContact CG2-CZ 3.48Å; F158-L165 HydrophobicContact CD1-CB 4.32Å; F158-L165 HydrophobicContact CD1-CD1 3.72Å; F158-L165 HydrophobicContact CD2-CD1 3.87Å; F158-L165 HydrophobicContact CE1-CB 4.07Å; F158-L165 HydrophobicContact CE1-CD1 3.6Å; F158-L165 HydrophobicContact CE1-CG 4.32Å; F158-L165 HydrophobicContact CE2-CD1 3.76Å; F158-L165 HydrophobicContact CG-CD1 3.86Å; F158-L165 HydrophobicContact CZ-CD1 3.63Å; F158-F179 AromaticContact CE1-CD2 3.84Å; F158-F179 HydrophobicContact CE1-CD2 3.84Å; F158-F179 HydrophobicContact CE1-CE2 4.16Å; F158-F179 HydrophobicContact CE1-CG 4.16Å; F158-F179 HydrophobicContact CZ-CD2 4.09Å; F158-F179 AromaticContact CZ-CE2 3.94Å; F158-F179 HydrophobicContact CZ-CE2 3.94Å; F158-F179 HydrophobicContact CZ-CZ 4.47Å
159	D	93.7	Very high	94.9	Very high	16 Å²	16	32.6 Å²	32.6	9%	0.086	17%	0.172	C	C	.	.			trans	-74.9	160.8	161.4	179.2	37.6	0	0	0	110.7	T161 G162 L164 I200	D159-T161 PolarHBondContact O-N 2.84Å; D159-T161 WeakPolarHBondContact OD2-CB 3.19Å; D159-T161 WeakPolarHBondContact OD2-CG2 3.35Å; D159-T161 PolarHBondContact OD2-N 3.26Å; D159-T161 PolarHBondContact OD2-OG1 3.45Å; D159-G162 PolarHBondContact O-N 3.34Å; D159-L164 HydrophobicContact CB-CB 4.07Å; D159-L164 PolarHBondContact N-O 2.76Å; D159-I200 HydrophobicContact CB-CD1 4.06Å; D159-I200 HydrophobicContact CB-CG2 4.15Å
160	Q	88.9	Confident	95	Very high	118 Å²	118	32.6 Å²	32.6	55%	0.551	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-31.7	176.7	-62.4	-165.2	-5.2	0	0	112.7	G162 P202	Q160-G162 VanDerWaalsContact C-N 3.28Å; Q160-P202 PolarHBondContact NE2-O 3.39Å
161	T	90	Very high	94.9	Very high	75 Å²	75	27.6 Å²	27.6	46%	0.46	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-16.2	177.2	68.4	0	0	0	0	113.3	D159 K163	D159-T161 PolarHBondContact O-N 2.84Å; D159-T161 WeakPolarHBondContact OD2-CB 3.19Å; D159-T161 WeakPolarHBondContact OD2-CG2 3.35Å; D159-T161 PolarHBondContact OD2-N 3.26Å; D159-T161 PolarHBondContact OD2-OG1 3.45Å; T161-K163 PolarHBondContact O-N 3.43Å; T161-K163 PolarHBondContact OG1-N 3.16Å
162	G	90.1	Very high	94.9	Very high	1 Å²	1	28 Å²	28	1%	0.01	14%	0.144	C	C	.	.	S	Bend	trans	73.9	-3.5	-173.1	0	0	0	0	0	115	H117 D159 Q160	H117-G162 WeakPolarHBondContact NE2-CA 3.48Å; H117-G162 PolarHBondContact NE2-O 3.47Å; D159-G162 PolarHBondContact O-N 3.34Å; Q160-G162 VanDerWaalsContact C-N 3.28Å
163	K	92.8	Very high	94.9	Very high	114 Å²	114	27.6 Å²	27.6	50%	0.496	14%	0.141	S	C	.	.	S	Bend	trans	-73	-35.2	-178.1	-65.3	-177.9	-179.6	-179.4	0	113.1	T161 F179	T161-K163 PolarHBondContact O-N 3.43Å; T161-K163 PolarHBondContact OG1-N 3.16Å; K163-F179 WeakPolarHBondContact O-CB 3.39Å; K163-F179 PolarHBondContact O-N 3.09Å
164	L	94.4	Very high	94.9	Very high	38 Å²	38	27.7 Å²	27.7	20%	0.199	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	136	-176.6	-63.9	173.3	0	0	0	110.4	D159 I185 I200 V221	D159-L164 HydrophobicContact CB-CB 4.07Å; D159-L164 PolarHBondContact N-O 2.76Å; L164-I185 HydrophobicContact CD2-CD1 3.41Å; L164-I185 VanDerWaalsContact CD2-CD1 3.41Å; L164-I200 HydrophobicContact CB-CD1 4.45Å; L164-V221 HydrophobicContact CD1-CG1 3.82Å
165	L	96.3	Very high	94.9	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	124.7	172.2	-176.3	67.3	0	0	0	108.9	V124 I132 L146 I156 F158 L176 W177	V124-L165 HydrophobicContact CG1-CD2 4.23Å; I132-L165 HydrophobicContact CG2-CD2 4.34Å; L146-L165 HydrophobicContact CD1-CD2 3.86Å; I156-L165 HydrophobicContact CG2-CD1 3.12Å; I156-L165 HydrophobicContact CG2-CD2 4.32Å; I156-L165 HydrophobicContact CG2-CG 3.91Å; F158-L165 HydrophobicContact CD1-CB 4.32Å; F158-L165 HydrophobicContact CD1-CD1 3.72Å; F158-L165 HydrophobicContact CD2-CD1 3.87Å; F158-L165 HydrophobicContact CE1-CB 4.07Å; F158-L165 HydrophobicContact CE1-CD1 3.6Å; F158-L165 HydrophobicContact CE1-CG 4.32Å; F158-L165 HydrophobicContact CE2-CD1 3.76Å; F158-L165 HydrophobicContact CG-CD1 3.86Å; F158-L165 HydrophobicContact CZ-CD1 3.63Å; L165-L176 WeakPolarHBondContact O-CA 3.17Å; L165-W177 HydrophobicContact CB-CB 4.2Å; L165-W177 PolarHBondContact N-O 3.15Å; L165-W177 PolarHBondContact O-N 3.4Å
166	A	96.9	Very high	94.9	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	136.8	169.5	0	0	0	0	0	109.4	I156 S157 K175 L176 V198 I200 I207	I156-A166 CarbonylContact C-O 3.52Å; I156-A166 VanDerWaalsContact CA-O 3.3Å; I156-A166 WeakPolarHBondContact CA-O 3.19Å; S157-A166 PolarHBondContact N-O 2.84Å; S157-A166 PolarHBondContact O-N 2.99Å; A166-K175 WeakPolarHBondContact CA-O 3.39Å; A166-L176 HydrophobicContact CB-CD2 4.11Å; A166-V198 HydrophobicContact CB-CG1 4.33Å; A166-V198 HydrophobicContact CB-CG2 3.86Å; A166-I200 HydrophobicContact CB-CD1 3.88Å; A166-I200 HydrophobicContact CB-CG1 3.85Å; A166-I207 HydrophobicContact CB-CD1 4.3Å
167	S	97	Very high	94.9	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	148.7	171	63.8	0	0	0	0	111.1	H149 D155 I174 K175 W177	H149-S167 PolarHBondContact NE2-OG 2.78Å; D155-S167 WeakPolarHBondContact O-CA 3.4Å; S167-I174 CarbonylContact O-C 3.57Å; S167-I174 WeakPolarHBondContact O-CA 3.15Å; S167-I174 WeakPolarHBondContact O-CG2 3.45Å; S167-K175 PolarHBondContact N-O 2.84Å; S167-K175 PolarHBondContact O-N 3.12Å; S167-W177 PolarHBondContact OG-NE1 2.9Å
168	C	96.1	Very high	94.8	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	151.9	174.2	71.7	0	0	0	0	111.8	V153 Q154 D155 I174 V195 V198	V153-C168 CarbonylContact C-O 3.49Å; V153-C168 WeakPolarHBondContact CA-O 3.39Å; V153-C168 WeakPolarHBondContact CG1-O 3.35Å; Q154-C168 PolarHBondContact N-O 3.43Å; D155-C168 WeakPolarHBondContact CB-SG 3.37Å; D155-C168 PolarHBondContact N-SG 3.17Å; D155-C168 VanDerWaalsContact N-SG 3.42Å; D155-C168 PolarHBondContact O-N 3Å; C168-I174 HydrophobicContact CB-CG1 4.38Å; C168-V195 HydrophobicContact CB-CB 3.88Å; C168-V195 HydrophobicContact CB-CG1 3.49Å; C168-V195 VanDerWaalsContact CB-CG1 3.49Å; C168-V195 PolarHBondContact SG-O 3.37Å; C168-V198 HydrophobicContact CB-CB 3.96Å; C168-V198 HydrophobicContact CB-CG1 4.03Å
169	S	96.6	Very high	94.5	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	163.2	-175.3	168	0	0	0	0	112.5	H149 D151 S152 D171 M172 T173 V195	H149-S169 WeakPolarHBondContact ND1-CB 3.45Å; D151-S169 PolarHBondContact O-OG 3.26Å; S152-S169 CarbonylContact O-C 3.52Å; S152-S169 VanDerWaalsContact O-CA 3.23Å; S152-S169 WeakPolarHBondContact O-CA 3.45Å; S152-S169 WeakPolarHBondContact O-CB 3.37Å; S152-S169 PolarHBondContact O-OG 3.42Å; S152-S169 VanDerWaalsContact O-OG 3.04Å; S169-D171 VanDerWaalsContact CB-OD1 3.24Å; S169-D171 WeakPolarHBondContact CB-OD1 3.3Å; S169-D171 PolarHBondContact O-N 3.4Å; S169-D171 PolarHBondContact OG-N 2.65Å; S169-D171 VanDerWaalsContact OG-N 3.09Å; S169-D171 PolarHBondContact OG-OD1 2.96Å; S169-D171 PolarHBondContact OG-OD2 3.32Å; S169-M172 PolarHBondContact O-N 3.22Å; S169-T173 PolarHBondContact N-O 2.86Å; S169-V195 PolarHBondContact O-N 3.41Å
170	A	95.6	Very high	94.2	Very high	17 Å²	17	33.8 Å²	33.8	14%	0.14	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-16.7	167.6	0	0	0	0	0	113.1	D151 S152 M172 N194	D151-A170 HydrophobicContact CB-CB 4.12Å; D151-A170 WeakPolarHBondContact OD2-CB 3.32Å; S152-A170 PolarHBondContact O-N 3.24Å; A170-M172 PolarHBondContact O-N 3.42Å; A170-N194 HydrophobicContact CB-CB 4.41Å
171	D	93.8	Very high	93.9	Very high	20 Å²	20	30 Å²	30	11%	0.107	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	4.7	173.4	69.2	14.9	0	0	0	114.6	H149 T150 D151 S169 T173	H149-D171 IonicContact CE1-OD2 2.8Å; H149-D171 IonicContact CG-OD2 3.01Å; H149-D171 IonicContact ND1-OD1 2.81Å; H149-D171 IonicContact ND1-OD2 2.72Å; H149-D171 PolarHBondContact ND1-OD2 3.12Å; T150-D171 PolarHBondContact N-OD2 2.65Å; T150-D171 VanDerWaalsContact N-OD2 3.15Å; T150-D171 WeakPolarHBondContact OG1-CB 3.44Å; D151-D171 HydrophobicContact CB-CB 4.01Å; S169-D171 VanDerWaalsContact CB-OD1 3.24Å; S169-D171 WeakPolarHBondContact CB-OD1 3.3Å; S169-D171 PolarHBondContact O-N 3.4Å; S169-D171 PolarHBondContact OG-N 2.65Å; S169-D171 VanDerWaalsContact OG-N 3.09Å; S169-D171 PolarHBondContact OG-OD1 2.96Å; S169-D171 PolarHBondContact OG-OD2 3.32Å; D171-T173 PolarHBondContact O-N 3.18Å; D171-T173 WeakPolarHBondContact OD1-CA 3.43Å; D171-T173 VanDerWaalsContact OD1-CB 3.23Å; D171-T173 WeakPolarHBondContact OD1-CB 3.39Å; D171-T173 WeakPolarHBondContact OD1-CG2 3.43Å; D171-T173 PolarHBondContact OD1-N 2.85Å; D171-T173 PolarHBondContact OD1-OG1 2.88Å; D171-T173 PolarHBondContact OD2-OG1 2.82Å
172	M	95.3	Very high	93.8	Very high	85 Å²	85	28.1 Å²	28.1	42%	0.419	15%	0.147	S	C	.	.	S	Bend	trans	68.8	10.8	-179.9	-45.5	174.3	-74.7	0	0	113.7	S169 A170	S169-M172 PolarHBondContact O-N 3.22Å; A170-M172 PolarHBondContact O-N 3.42Å
173	T	96.1	Very high	93.8	Very high	12 Å²	12	34.9 Å²	34.9	7%	0.074	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	152.6	179.4	78.9	0	0	0	0	111.9	H149 S169 D171 T187 H189	H149-T173 PolarHBondContact CE1-OG1 2.89Å; H149-T173 PolarHBondContact ND1-OG1 2.8Å; S169-T173 PolarHBondContact N-O 2.86Å; D171-T173 PolarHBondContact O-N 3.18Å; D171-T173 WeakPolarHBondContact OD1-CA 3.43Å; D171-T173 VanDerWaalsContact OD1-CB 3.23Å; D171-T173 WeakPolarHBondContact OD1-CB 3.39Å; D171-T173 WeakPolarHBondContact OD1-CG2 3.43Å; D171-T173 PolarHBondContact OD1-N 2.85Å; D171-T173 PolarHBondContact OD1-OG1 2.88Å; D171-T173 PolarHBondContact OD2-OG1 2.82Å; T173-T187 HydrophobicContact CG2-CG2 4.04Å; T173-H189 VanDerWaalsContact CG2-CE1 3.42Å; T173-H189 WeakPolarHBondContact CG2-CE1 3.44Å
174	I	97.2	Very high	93.9	Very high	1 Å²	1	31.9 Å²	31.9	1%	0.005	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	122.7	168.2	-53.9	156.3	0	0	0	106.5	S167 C168 M188 V195 V198 S209 W219	S167-I174 CarbonylContact O-C 3.57Å; S167-I174 WeakPolarHBondContact O-CA 3.15Å; S167-I174 WeakPolarHBondContact O-CG2 3.45Å; C168-I174 HydrophobicContact CB-CG1 4.38Å; I174-M188 HydrophobicContact CB-CB 4.31Å; I174-M188 HydrophobicContact CB-CE 3.68Å; I174-M188 HydrophobicContact CG2-CE 3.34Å; I174-M188 PolarHBondContact N-O 3.39Å; I174-M188 VanDerWaalsContact N-O 3.1Å; I174-M188 PolarHBondContact O-N 3.31Å; I174-V195 HydrophobicContact CD1-CG1 4.45Å; I174-V195 HydrophobicContact CG1-CG1 4.11Å; I174-V195 HydrophobicContact CG1-CG2 4.42Å; I174-V198 HydrophobicContact CG2-CG2 3.88Å; I174-S209 WeakPolarHBondContact CD1-OG 3.41Å; I174-W219 HydrophobicContact CD1-CD2 4.42Å; I174-W219 HydrophobicContact CD1-CZ2 3.88Å
175	K	96.8	Very high	93.8	Very high	26 Å²	26	33.7 Å²	33.7	11%	0.113	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	138.5	178.7	-71.2	179.8	-176.6	-85.3	0	110.3	G148 A166 S167 W177 R186 T187	G148-K175 WeakPolarHBondContact O-CE 3.46Å; G148-K175 PolarHBondContact O-NZ 3.37Å; A166-K175 WeakPolarHBondContact CA-O 3.39Å; S167-K175 PolarHBondContact N-O 2.84Å; S167-K175 PolarHBondContact O-N 3.12Å; K175-W177 HydrophobicContact CB-CZ2 3.95Å; K175-W177 HydrophobicContact CD-CH2 4.23Å; K175-W177 HydrophobicContact CD-CZ2 3.69Å; K175-W177 HydrophobicContact CG-CZ2 4.47Å; K175-R186 WeakPolarHBondContact CA-O 3.36Å; K175-T187 HydrophobicContact CG-CG2 4.08Å; K175-T187 PolarHBondContact NZ-OG1 2.99Å
176	L	96.7	Very high	93.7	Very high	2 Å²	2	38.2 Å²	38.2	1%	0.01	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	127	170.4	-88	169.5	0	0	0	108.8	L165 A166 C184 I185 R186 M188 I207 V221	L165-L176 WeakPolarHBondContact O-CA 3.17Å; A166-L176 HydrophobicContact CB-CD2 4.11Å; L176-C184 CarbonylContact O-C 3.58Å; L176-I185 PolarHBondContact O-N 3.16Å; L176-R186 HydrophobicContact CB-CB 4.37Å; L176-R186 PolarHBondContact N-O 2.91Å; L176-R186 PolarHBondContact O-N 3.15Å; L176-M188 HydrophobicContact CD1-CE 4.13Å; L176-M188 HydrophobicContact CD1-SD 4.46Å; L176-M188 HydrophobicContact CG-CE 4.12Å; L176-I207 HydrophobicContact CD1-CD1 3.61Å; L176-I207 HydrophobicContact CD2-CD1 3.43Å; L176-I207 VanDerWaalsContact CD2-CD1 3.43Å; L176-I207 HydrophobicContact CG-CD1 3.66Å; L176-V221 HydrophobicContact CD1-CG1 4.12Å
177	W	95.9	Very high	93.6	Very high	7 Å²	7	40.5 Å²	40.5	3%	0.027	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	138.3	-179.5	-46.6	81	0	0	0	109.6	I132 L146 L165 S167 K175 E183 C184	I132-W177 HydrophobicContact CD1-CZ2 4.42Å; L146-W177 HydrophobicContact CB-CE3 4.15Å; L146-W177 HydrophobicContact CB-CH2 4.3Å; L146-W177 HydrophobicContact CB-CZ3 4.02Å; L146-W177 HydrophobicContact CD1-CB 4.48Å; L146-W177 HydrophobicContact CD1-CD2 4.2Å; L146-W177 HydrophobicContact CD1-CE3 4.31Å; L146-W177 HydrophobicContact CD1-CG 4.27Å; L146-W177 HydrophobicContact CD2-CE3 4.13Å; L146-W177 HydrophobicContact CG-CE3 4.44Å; L165-W177 HydrophobicContact CB-CB 4.2Å; L165-W177 PolarHBondContact N-O 3.15Å; L165-W177 PolarHBondContact O-N 3.4Å; S167-W177 PolarHBondContact OG-NE1 2.9Å; K175-W177 HydrophobicContact CB-CZ2 3.95Å; K175-W177 HydrophobicContact CD-CH2 4.23Å; K175-W177 HydrophobicContact CD-CZ2 3.69Å; K175-W177 HydrophobicContact CG-CZ2 4.47Å; W177-E183 WeakPolarHBondContact CA-O 3.43Å; W177-C184 HydrophobicContact CD2-CB 4.42Å; W177-C184 HydrophobicContact CE3-CB 3.85Å; W177-C184 HydrophobicContact CH2-CB 4.3Å; W177-C184 HydrophobicContact CZ3-CB 3.79Å
178	D	94.2	Very high	93.5	Very high	48 Å²	48	40.7 Å²	40.7	26%	0.257	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	123.2	163.7	-179.4	19.2	0	0	0	108.4	Q180 G181 F182 E183 I185	D178-Q180 VanDerWaalsContact C-N 3.29Å; D178-Q180 PolarHBondContact OD1-N 3.37Å; D178-G181 PolarHBondContact OD2-N 3.48Å; D178-F182 WeakPolarHBondContact O-CA 3.18Å; D178-F182 PolarHBondContact O-N 3.47Å; D178-E183 PolarHBondContact N-O 3.48Å; D178-I185 HydrophobicContact CB-CD1 3.76Å; D178-I185 HydrophobicContact CB-CG1 3.84Å
179	F	90.3	Very high	93.5	Very high	12 Å²	12	47.1 Å²	47.1	5%	0.053	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-14.6	178.6	-161	-103.6	0	0	0	112.6	H117 F120 V122 V124 V134 F158 K163 F182	H117-F179 AromaticContact CD2-CD1 3.78Å; H117-F179 AromaticContact CD2-CE1 3.62Å; H117-F179 AromaticContact NE2-CD1 3.75Å; H117-F179 AromaticContact NE2-CE1 3.94Å; F120-F179 HydrophobicContact CD2-CD1 4.26Å; F120-F179 HydrophobicContact CD2-CE1 4.02Å; F120-F179 HydrophobicContact CE2-CD1 4.42Å; V122-F179 HydrophobicContact CG1-CZ 4.03Å; V124-F179 HydrophobicContact CG2-CE2 4.13Å; V134-F179 HydrophobicContact CG1-CE2 4.24Å; V134-F179 HydrophobicContact CG1-CZ 4Å; V134-F179 HydrophobicContact CG2-CE2 4.22Å; F158-F179 AromaticContact CE1-CD2 3.84Å; F158-F179 HydrophobicContact CE1-CD2 3.84Å; F158-F179 HydrophobicContact CE1-CE2 4.16Å; F158-F179 HydrophobicContact CE1-CG 4.16Å; F158-F179 HydrophobicContact CZ-CD2 4.09Å; F158-F179 AromaticContact CZ-CE2 3.94Å; F158-F179 HydrophobicContact CZ-CE2 3.94Å; F158-F179 HydrophobicContact CZ-CZ 4.47Å; K163-F179 WeakPolarHBondContact O-CB 3.39Å; K163-F179 PolarHBondContact O-N 3.09Å; F179-F182 HydrophobicContact CD2-CE1 4.31Å; F179-F182 HydrophobicContact CE1-CZ 4.41Å; F179-F182 HydrophobicContact CE2-CE1 4.03Å; F179-F182 HydrophobicContact CE2-CZ 4.43Å; F179-F182 HydrophobicContact CZ-CE1 4.29Å; F179-F182 HydrophobicContact CZ-CZ 4.31Å; F179-F182 WeakPolarHBondContact O-CD2 3.49Å; F179-F182 WeakPolarHBondContact O-CE2 3.28Å; F179-F182 WeakPolarHBondContact O-CZ 3.41Å
180	Q	87	Confident	93.3	Very high	133 Å²	133	48.8 Å²	48.8	62%	0.621	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-50.4	174.2	-62.2	-170.8	-13.1	0	0	111.3	D178 F182	D178-Q180 VanDerWaalsContact C-N 3.29Å; D178-Q180 PolarHBondContact OD1-N 3.37Å; Q180-F182 WeakPolarHBondContact O-CD2 3.34Å
181	G	82.3	Confident	93.3	Very high	38 Å²	38	48.4 Å²	48.4	39%	0.392	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-20.3	177.4	0	0	0	0	0	115	D178 E183	D178-G181 PolarHBondContact OD2-N 3.48Å; G181-E183 PolarHBondContact O-N 2.59Å
182	F	87.7	Confident	93.3	Very high	36 Å²	36	53.7 Å²	53.7	16%	0.158	28%	0.283	C	S	.	.			trans	59.4	25.5	-170.7	-62.8	-102.1	0	0	0	113.1	V134 R144 L146 D178 F179 Q180	V134-F182 HydrophobicContact CG2-CE1 4.25Å; R144-F182 HydrophobicContact CB-CD1 4.41Å; R144-F182 HydrophobicContact CB-CE1 4.42Å; L146-F182 HydrophobicContact CD2-CB 3.73Å; L146-F182 HydrophobicContact CD2-CD1 3.8Å; L146-F182 HydrophobicContact CD2-CG 4.26Å; L146-F182 WeakPolarHBondContact CD2-O 3.18Å; D178-F182 WeakPolarHBondContact O-CA 3.18Å; D178-F182 PolarHBondContact O-N 3.47Å; F179-F182 HydrophobicContact CD2-CE1 4.31Å; F179-F182 HydrophobicContact CE1-CZ 4.41Å; F179-F182 HydrophobicContact CE2-CE1 4.03Å; F179-F182 HydrophobicContact CE2-CZ 4.43Å; F179-F182 HydrophobicContact CZ-CE1 4.29Å; F179-F182 HydrophobicContact CZ-CZ 4.31Å; F179-F182 WeakPolarHBondContact O-CD2 3.49Å; F179-F182 WeakPolarHBondContact O-CE2 3.28Å; F179-F182 WeakPolarHBondContact O-CZ 3.41Å; Q180-F182 WeakPolarHBondContact O-CD2 3.34Å
183	E	91.1	Very high	93.4	Very high	143 Å²	143	53.5 Å²	53.5	67%	0.668	28%	0.28	S	S	*	.			trans	-102.8	147.9	-179.9	-62	-171.6	154.1	0	0	110.8	W177 D178 G181 I185	W177-E183 WeakPolarHBondContact CA-O 3.43Å; D178-E183 PolarHBondContact N-O 3.48Å; G181-E183 PolarHBondContact O-N 2.59Å; E183-I185 PolarHBondContact O-N 2.84Å
184	C	93.7	Very high	93.4	Very high	51 Å²	51	53.9 Å²	53.9	35%	0.345	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	107.1	172	176.3	0	0	0	0	108.8	L176 W177 R186	L176-C184 CarbonylContact O-C 3.58Å; W177-C184 HydrophobicContact CD2-CB 4.42Å; W177-C184 HydrophobicContact CE3-CB 3.85Å; W177-C184 HydrophobicContact CH2-CB 4.3Å; W177-C184 HydrophobicContact CZ3-CB 3.79Å; C184-R186 PolarHBondContact SG-O 3.37Å
185	I	93.9	Very high	93.4	Very high	76 Å²	76	53.8 Å²	53.8	39%	0.39	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	-47.2	177.5	-57.7	160.1	0	0	0	110.1	L164 L176 D178 E183	L164-I185 HydrophobicContact CD2-CD1 3.41Å; L164-I185 VanDerWaalsContact CD2-CD1 3.41Å; L176-I185 PolarHBondContact O-N 3.16Å; D178-I185 HydrophobicContact CB-CD1 3.76Å; D178-I185 HydrophobicContact CB-CG1 3.84Å; E183-I185 PolarHBondContact O-N 2.84Å
186	R	93.6	Very high	93.3	Very high	95 Å²	95	53.1 Å²	53.1	36%	0.358	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	148.6	-174.1	-85.3	-176	-107.9	-79	-1.9	112.1	K175 L176 C184 V221 A222	K175-R186 WeakPolarHBondContact CA-O 3.36Å; L176-R186 HydrophobicContact CB-CB 4.37Å; L176-R186 PolarHBondContact N-O 2.91Å; L176-R186 PolarHBondContact O-N 3.15Å; C184-R186 PolarHBondContact SG-O 3.37Å; R186-V221 PolarHBondContact NE-O 2.97Å; R186-V221 VanDerWaalsContact NE-O 3.16Å; R186-V221 PolarHBondContact NH2-O 3.46Å; R186-A222 PolarHBondContact NH1-O 3.27Å; R186-A222 PolarHBondContact NH2-O 2.85Å
187	T	95.6	Very high	93.3	Very high	49 Å²	49	53 Å²	53	30%	0.301	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	118.8	166	-56.4	0	0	0	0	107.9	T173 K175 H189	T173-T187 HydrophobicContact CG2-CG2 4.04Å; K175-T187 HydrophobicContact CG-CG2 4.08Å; K175-T187 PolarHBondContact NZ-OG1 2.99Å; T187-H189 WeakPolarHBondContact CG2-NE2 3.36Å
188	M	94.9	Very high	93.4	Very high	4 Å²	4	52.7 Å²	52.7	2%	0.02	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	128.8	-179.7	-61	176.5	-73.3	0	0	109.4	I174 L176 I207 W219	I174-M188 HydrophobicContact CB-CB 4.31Å; I174-M188 HydrophobicContact CB-CE 3.68Å; I174-M188 HydrophobicContact CG2-CE 3.34Å; I174-M188 PolarHBondContact N-O 3.39Å; I174-M188 VanDerWaalsContact N-O 3.1Å; I174-M188 PolarHBondContact O-N 3.31Å; L176-M188 HydrophobicContact CD1-CE 4.13Å; L176-M188 HydrophobicContact CD1-SD 4.46Å; L176-M188 HydrophobicContact CG-CE 4.12Å; M188-I207 HydrophobicContact CE-CD1 3.73Å; M188-W219 HydrophobicContact CB-CD2 4.44Å; M188-W219 HydrophobicContact CB-CE3 3.98Å; M188-W219 HydrophobicContact CB-CZ3 4.14Å; M188-W219 HydrophobicContact CG-CE3 4.42Å; M188-W219 HydrophobicContact SD-CB 3.61Å; M188-W219 HydrophobicContact SD-CD2 4.15Å; M188-W219 HydrophobicContact SD-CE3 4.19Å; M188-W219 HydrophobicContact SD-CG 3.92Å
189	H	94.9	Very high	93.5	Very high	134 Å²	134	50.5 Å²	50.5	62%	0.62	27%	0.267	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.5	144.5	178.8	-62.3	-81.9	0	0	0	109.9	T173 T187 W219	T173-H189 VanDerWaalsContact CG2-CE1 3.42Å; T173-H189 WeakPolarHBondContact CG2-CE1 3.44Å; T187-H189 WeakPolarHBondContact CG2-NE2 3.36Å; H189-W219 WeakPolarHBondContact O-CZ3 3.46Å
190	G	92.4	Very high	93.8	Very high	35 Å²	35	50.5 Å²	50.5	36%	0.361	27%	0.267	S	S	.	.			trans	148.5	1.6	172.5	0	0	0	0	0	115.9	K217	G190-K217 WeakPolarHBondContact O-CE 3.38Å; G190-K217 PolarHBondContact O-NZ 2.93Å
191	H	95.4	Very high	94.1	Very high	10 Å²	10	44.4 Å²	44.4	5%	0.046	24%	0.239	C	C	.	.			trans	-85.3	146.8	159.8	-82.8	-65.1	0	0	0	110	V195 S209 S211 D213 W219	H191-V195 HydrophobicContact CB-CG2 3.89Å; H191-S209 PolarHBondContact NE2-OG 3.18Å; H191-S211 WeakPolarHBondContact ND1-CB 3.46Å; H191-D213 IonicContact CE1-OD2 2.7Å; H191-D213 IonicContact CG-OD2 2.64Å; H191-D213 IonicContact ND1-OD1 3.22Å; H191-D213 IonicContact ND1-OD2 2.94Å; H191-D213 PolarHBondContact ND1-OD2 3.13Å; H191-W219 AromaticContact CD2-CZ2 3.85Å
192	D	94.6	Very high	94.6	Very high	131 Å²	131	44 Å²	44	70%	0.701	23%	0.229	S	C	*	.	S	Bend	trans	-96.6	0.7	-177.3	-60.8	-37.5	0	0	0	112.7	D213	D192-D213 HydrophobicContact CB-CB 4.3Å; D192-D213 PolarHBondContact N-OD2 2.85Å
193	H	96.5	Very high	94.6	Very high	80 Å²	80	46.2 Å²	46.2	37%	0.37	24%	0.243	S	C	.	.	S	Bend	trans	-157	167.8	179	-150.3	-58.4	0	0	0	111	V195 S211 R212 D213	H193-V195 PolarHBondContact O-N 3.11Å; H193-S211 PolarHBondContact O-OG 2.89Å; H193-R212 HydrophobicContact CB-CB 4Å; H193-D213 HydrophobicContact CB-CB 4.27Å
194	N	95.8	Very high	94.5	Very high	20 Å²	20	40 Å²	40	11%	0.107	22%	0.217	C	C	.	.			trans	-28.5	121.5	171.7	-177.5	-19.3	0	0	0	113.7	A170 S211 R212	A170-N194 HydrophobicContact CB-CB 4.41Å; N194-S211 WeakPolarHBondContact O-CA 3.42Å; N194-S211 PolarHBondContact O-OG 3.47Å; N194-R212 PolarHBondContact O-N 2.84Å
195	V	97.3	Very high	94.5	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	109.2	175.4	-171.7	0	0	0	0	108.7	Q154 C168 S169 I174 H191 H193 A210	Q154-V195 WeakPolarHBondContact CB-O 3.39Å; C168-V195 HydrophobicContact CB-CB 3.88Å; C168-V195 HydrophobicContact CB-CG1 3.49Å; C168-V195 VanDerWaalsContact CB-CG1 3.49Å; C168-V195 PolarHBondContact SG-O 3.37Å; S169-V195 PolarHBondContact O-N 3.41Å; I174-V195 HydrophobicContact CD1-CG1 4.45Å; I174-V195 HydrophobicContact CG1-CG1 4.11Å; I174-V195 HydrophobicContact CG1-CG2 4.42Å; H191-V195 HydrophobicContact CB-CG2 3.89Å; H193-V195 PolarHBondContact O-N 3.11Å; V195-A210 CarbonylContact C-O 3.55Å; V195-A210 WeakPolarHBondContact CA-O 3.46Å; V195-A210 VanDerWaalsContact CG1-O 3.28Å; V195-A210 WeakPolarHBondContact CG1-O 3.32Å
196	S	96.1	Very high	94.6	Very high	12 Å²	12	40.9 Å²	40.9	8%	0.084	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	-27.4	-173.3	37.5	0	0	0	0	113.7	A210 W236 V237 R238	S196-A210 PolarHBondContact N-O 3.02Å; S196-A210 PolarHBondContact OG-O 2.59Å; S196-W236 PolarHBondContact OG-NE1 2.74Å; S196-V237 PolarHBondContact OG-O 2.62Å; S196-R238 WeakPolarHBondContact CB-O 3.16Å; S196-R238 PolarHBondContact OG-O 2.98Å
197	S	96.8	Very high	94.7	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	147.7	-178.7	-176.8	0	0	0	0	112.7	D155 S209 A210 M239 V240	D155-S197 WeakPolarHBondContact OD2-CA 3.49Å; D155-S197 VanDerWaalsContact OD2-CB 3.3Å; D155-S197 WeakPolarHBondContact OD2-CB 3.16Å; D155-S197 PolarHBondContact OD2-OG 2.78Å; S197-S209 CarbonylContact O-C 3.53Å; S197-S209 VanDerWaalsContact O-CA 3.27Å; S197-S209 WeakPolarHBondContact O-CA 3.4Å; S197-A210 PolarHBondContact N-O 2.89Å; S197-A210 PolarHBondContact O-N 3.25Å; S197-M239 VanDerWaalsContact OG-CG 3.31Å; S197-M239 WeakPolarHBondContact OG-CG 3.44Å; S197-V240 PolarHBondContact OG-N 2.59Å
198	V	97.1	Very high	94.8	Very high	0 Å²	0	34 Å²	34	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	142.2	175.5	67.9	0	0	0	0	110	D155 A166 C168 I174 I207 V208	D155-V198 HydrophobicContact CB-CG1 4.28Å; D155-V198 PolarHBondContact OD2-N 3.37Å; A166-V198 HydrophobicContact CB-CG1 4.33Å; A166-V198 HydrophobicContact CB-CG2 3.86Å; C168-V198 HydrophobicContact CB-CB 3.96Å; C168-V198 HydrophobicContact CB-CG1 4.03Å; I174-V198 HydrophobicContact CG2-CG2 3.88Å; V198-I207 HydrophobicContact CG2-CG2 3.43Å; V198-I207 VanDerWaalsContact CG2-CG2 3.43Å; V198-V208 CarbonylContact C-O 3.57Å; V198-V208 WeakPolarHBondContact CA-O 3.41Å
199	A	96.5	Very high	94.9	Very high	1 Å²	1	33.9 Å²	33.9	1%	0.008	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	132.5	174.8	0	0	0	0	0	110.7	V208 P242	A199-V208 PolarHBondContact N-O 3.37Å; A199-V208 PolarHBondContact O-N 3.01Å; A199-P242 VanDerWaalsContact CB-CD 3.47Å; A199-P242 HydrophobicContact CB-CG 4.23Å
200	I	95.9	Very high	95	Very high	12 Å²	12	27.5 Å²	27.5	6%	0.062	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	133.4	170	-63.9	169.4	0	0	0	107.9	S157 D159 L164 A166 I207	S157-I200 WeakPolarHBondContact O-CD1 2.82Å; S157-I200 PolarHBondContact OG-N 3.07Å; S157-I200 VanDerWaalsContact OG-N 3.15Å; D159-I200 HydrophobicContact CB-CD1 4.06Å; D159-I200 HydrophobicContact CB-CG2 4.15Å; L164-I200 HydrophobicContact CB-CD1 4.45Å; A166-I200 HydrophobicContact CB-CD1 3.88Å; A166-I200 HydrophobicContact CB-CG1 3.85Å; I200-I207 HydrophobicContact CG1-CG1 3.95Å
201	M	94.8	Very high	95.2	Very high	5 Å²	5	25.8 Å²	25.8	3%	0.025	14%	0.139	C	C	.	.			trans	-67.8	150.6	175.8	-69	-63.9	-35.3	0	0	110.5	N203 G204 H206 V208 M218 P242 G246 I249	M201-N203 WeakPolarHBondContact CB-OD1 3.32Å; M201-N203 PolarHBondContact O-N 3.33Å; M201-G204 PolarHBondContact O-N 3.28Å; M201-H206 HydrophobicContact CB-CB 4.23Å; M201-H206 WeakPolarHBondContact CB-O 3.3Å; M201-H206 HydrophobicContact CG-CB 3.72Å; M201-H206 WeakPolarHBondContact CG-O 2.9Å; M201-H206 PolarHBondContact N-O 3.07Å; M201-V208 HydrophobicContact CG-CG2 3.99Å; M201-V208 HydrophobicContact SD-CG2 3.43Å; M201-V208 WeakPolarHBondContact SD-CG2 3.45Å; M201-M218 HydrophobicContact SD-CE 4.45Å; M201-P242 HydrophobicContact CE-CB 3.37Å; M201-P242 HydrophobicContact CE-CG 4.43Å; M201-P242 HydrophobicContact SD-CB 3.61Å; M201-P242 HydrophobicContact SD-CG 4.39Å; M201-G246 VanDerWaalsContact CE-O 3.23Å; M201-G246 WeakPolarHBondContact CE-O 2.91Å; M201-I249 HydrophobicContact SD-CD1 4.28Å; M201-I249 HydrophobicContact SD-CG1 4.29Å
202	P	91.1	Very high	95.3	Very high	30 Å²	30	31 Å²	31	20%	0.195	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-25.4	178	-30.6	39.5	0	0	0	115.7	Q160 G204 N243 Q244	Q160-P202 PolarHBondContact NE2-O 3.39Å; P202-G204 VanDerWaalsContact C-N 3.29Å; P202-N243 WeakPolarHBondContact CG-O 3.44Å; P202-Q244 WeakPolarHBondContact CG-O 3.15Å
203	N	88.8	Confident	95.3	Very high	82 Å²	82	26.2 Å²	26.2	44%	0.439	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-13.7	176.2	67.6	-26.7	0	0	0	113.5	M201 D205	M201-N203 WeakPolarHBondContact CB-OD1 3.32Å; M201-N203 PolarHBondContact O-N 3.33Å; N203-D205 PolarHBondContact ND2-OD2 3.24Å; N203-D205 VanDerWaalsContact ND2-OD2 3.16Å; N203-D205 PolarHBondContact O-N 2.63Å; N203-D205 VanDerWaalsContact O-N 3.17Å
204	G	89.5	Confident	95.2	Very high	13 Å²	13	26.6 Å²	26.6	13%	0.134	13%	0.133	C	C	.	.	S	Bend	trans	77.3	-14.6	-178.7	0	0	0	0	0	115	M201 P202 V221	M201-G204 PolarHBondContact O-N 3.28Å; P202-G204 VanDerWaalsContact C-N 3.29Å; G204-V221 WeakPolarHBondContact O-CG2 3.41Å
205	D	92.9	Very high	95.2	Very high	96 Å²	96	26.7 Å²	26.7	51%	0.513	13%	0.134	S	C	.	.	S	Bend	trans	-81.3	-21.3	-175.9	-53.4	-43.5	0	0	0	113.7	N203 V221	N203-D205 PolarHBondContact ND2-OD2 3.24Å; N203-D205 VanDerWaalsContact ND2-OD2 3.16Å; N203-D205 PolarHBondContact O-N 2.63Å; N203-D205 VanDerWaalsContact O-N 3.17Å; D205-V221 WeakPolarHBondContact O-CG2 3.43Å; D205-V221 PolarHBondContact O-N 2.99Å
206	H	95.4	Very high	95.2	Very high	50 Å²	50	26.8 Å²	26.8	23%	0.231	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	147.7	-172	-63.2	-42.5	0	0	0	112.9	M201 M218 W219	M201-H206 HydrophobicContact CB-CB 4.23Å; M201-H206 WeakPolarHBondContact CB-O 3.3Å; M201-H206 HydrophobicContact CG-CB 3.72Å; M201-H206 WeakPolarHBondContact CG-O 2.9Å; M201-H206 PolarHBondContact N-O 3.07Å; H206-M218 HydrophobicContact CB-CG 4.2Å; H206-W219 CarbonylContact C-O 3.51Å; H206-W219 WeakPolarHBondContact CA-O 3.32Å
207	I	96.8	Very high	95.3	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	142.8	172.2	-68.7	163.7	0	0	0	108.7	A166 L176 M188 V198 I200 M218 W219 V221	A166-I207 HydrophobicContact CB-CD1 4.3Å; L176-I207 HydrophobicContact CD1-CD1 3.61Å; L176-I207 HydrophobicContact CD2-CD1 3.43Å; L176-I207 VanDerWaalsContact CD2-CD1 3.43Å; L176-I207 HydrophobicContact CG-CD1 3.66Å; M188-I207 HydrophobicContact CE-CD1 3.73Å; V198-I207 HydrophobicContact CG2-CG2 3.43Å; V198-I207 VanDerWaalsContact CG2-CG2 3.43Å; I200-I207 HydrophobicContact CG1-CG1 3.95Å; I207-M218 CarbonylContact O-C 3.59Å; I207-M218 VanDerWaalsContact O-CA 3.23Å; I207-M218 WeakPolarHBondContact O-CA 3.35Å; I207-W219 HydrophobicContact CB-CB 4.32Å; I207-W219 PolarHBondContact N-O 2.77Å; I207-W219 PolarHBondContact O-N 2.67Å; I207-V221 HydrophobicContact CD1-CG2 3.75Å; I207-V221 HydrophobicContact CG1-CG2 3.7Å
208	V	97.2	Very high	95.3	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	136.1	173	-170.4	0	0	0	0	108.9	V198 A199 M201 I216 K217 M218 V240 I249	V198-V208 CarbonylContact C-O 3.57Å; V198-V208 WeakPolarHBondContact CA-O 3.41Å; A199-V208 PolarHBondContact N-O 3.37Å; A199-V208 PolarHBondContact O-N 3.01Å; M201-V208 HydrophobicContact CG-CG2 3.99Å; M201-V208 HydrophobicContact SD-CG2 3.43Å; M201-V208 WeakPolarHBondContact SD-CG2 3.45Å; V208-I216 HydrophobicContact CG1-CG2 3.45Å; V208-I216 VanDerWaalsContact CG1-CG2 3.45Å; V208-K217 CarbonylContact C-O 3.43Å; V208-K217 WeakPolarHBondContact CA-O 3.43Å; V208-M218 HydrophobicContact CG2-CE 3.92Å; V208-V240 HydrophobicContact CB-CG1 4.44Å; V208-V240 HydrophobicContact CB-CG2 4.41Å; V208-V240 HydrophobicContact CG1-CB 4.38Å; V208-V240 HydrophobicContact CG1-CG1 4.01Å; V208-V240 HydrophobicContact CG1-CG2 3.5Å; V208-V240 VanDerWaalsContact CG1-CG2 3.5Å; V208-I249 HydrophobicContact CB-CD1 4.46Å; V208-I249 HydrophobicContact CG1-CD1 4Å; V208-I249 HydrophobicContact CG1-CG2 4.34Å; V208-I249 HydrophobicContact CG2-CD1 3.64Å; V208-I249 HydrophobicContact CG2-CG1 4.4Å
209	S	97.3	Very high	95.3	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	148.7	177	59.6	0	0	0	0	112	I174 H191 S197 I216 K217 W219	I174-S209 WeakPolarHBondContact CD1-OG 3.41Å; H191-S209 PolarHBondContact NE2-OG 3.18Å; S197-S209 CarbonylContact O-C 3.53Å; S197-S209 VanDerWaalsContact O-CA 3.27Å; S197-S209 WeakPolarHBondContact O-CA 3.4Å; S209-I216 CarbonylContact O-C 3.49Å; S209-I216 WeakPolarHBondContact O-CA 3.24Å; S209-I216 VanDerWaalsContact O-CG2 3.3Å; S209-I216 WeakPolarHBondContact O-CG2 3.21Å; S209-K217 PolarHBondContact N-O 2.93Å; S209-K217 PolarHBondContact O-N 2.82Å; S209-K217 PolarHBondContact OG-O 2.99Å; S209-W219 PolarHBondContact OG-NE1 2.94Å
210	A	97.1	Very high	95.2	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	142.4	174.3	0	0	0	0	0	110.2	V195 S196 S197 V237 V240	V195-A210 CarbonylContact C-O 3.55Å; V195-A210 WeakPolarHBondContact CA-O 3.46Å; V195-A210 VanDerWaalsContact CG1-O 3.28Å; V195-A210 WeakPolarHBondContact CG1-O 3.32Å; S196-A210 PolarHBondContact N-O 3.02Å; S196-A210 PolarHBondContact OG-O 2.59Å; S197-A210 PolarHBondContact N-O 2.89Å; S197-A210 PolarHBondContact O-N 3.25Å; A210-V237 HydrophobicContact CB-CB 3.93Å; A210-V237 HydrophobicContact CB-CG1 3.54Å; A210-V240 HydrophobicContact CB-CB 4.01Å; A210-V240 HydrophobicContact CB-CG1 3.89Å
211	S	97	Very high	95.1	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	164.1	-177.6	172.3	0	0	0	0	112.8	H191 H193 N194 D213 K214 T215 V237	H191-S211 WeakPolarHBondContact ND1-CB 3.46Å; H193-S211 PolarHBondContact O-OG 2.89Å; N194-S211 WeakPolarHBondContact O-CA 3.42Å; N194-S211 PolarHBondContact O-OG 3.47Å; S211-D213 WeakPolarHBondContact CB-OD1 3.45Å; S211-D213 PolarHBondContact O-N 2.81Å; S211-D213 PolarHBondContact OG-N 2.99Å; S211-D213 VanDerWaalsContact OG-N 3.14Å; S211-K214 PolarHBondContact O-N 2.95Å; S211-T215 PolarHBondContact N-O 2.89Å; S211-V237 PolarHBondContact O-N 2.73Å
212	R	96.4	Very high	95	Very high	120 Å²	120	34.5 Å²	34.5	45%	0.453	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-14.3	168.3	-173.8	164.2	175.6	-172	-1.4	113.7	H193 N194 K214 W236	H193-R212 HydrophobicContact CB-CB 4Å; N194-R212 PolarHBondContact O-N 2.84Å; R212-K214 PolarHBondContact O-N 2.98Å; R212-W236 HydrophobicContact CB-CB 4.45Å; R212-W236 HydrophobicContact CB-CD2 3.81Å; R212-W236 HydrophobicContact CB-CG 3.75Å; R212-W236 HydrophobicContact CB-CZ2 4.38Å; R212-W236 HydrophobicContact CG-CB 4.11Å; R212-W236 HydrophobicContact CG-CD2 3.75Å; R212-W236 HydrophobicContact CG-CE3 4.04Å; R212-W236 HydrophobicContact CG-CG 3.78Å
213	D	94.4	Very high	95	Very high	30 Å²	30	35.9 Å²	35.9	16%	0.16	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	3.9	171.3	71.2	11.5	0	0	0	114.1	H191 D192 H193 S211 T215	H191-D213 IonicContact CE1-OD2 2.7Å; H191-D213 IonicContact CG-OD2 2.64Å; H191-D213 IonicContact ND1-OD1 3.22Å; H191-D213 IonicContact ND1-OD2 2.94Å; H191-D213 PolarHBondContact ND1-OD2 3.13Å; D192-D213 HydrophobicContact CB-CB 4.3Å; D192-D213 PolarHBondContact N-OD2 2.85Å; H193-D213 HydrophobicContact CB-CB 4.27Å; S211-D213 WeakPolarHBondContact CB-OD1 3.45Å; S211-D213 PolarHBondContact O-N 2.81Å; S211-D213 PolarHBondContact OG-N 2.99Å; S211-D213 VanDerWaalsContact OG-N 3.14Å; D213-T215 PolarHBondContact O-N 3.03Å; D213-T215 WeakPolarHBondContact OD1-CA 3.23Å; D213-T215 VanDerWaalsContact OD1-CB 3.3Å; D213-T215 WeakPolarHBondContact OD1-CB 3.39Å; D213-T215 PolarHBondContact OD1-N 2.78Å; D213-T215 PolarHBondContact OD1-OG1 2.89Å; D213-T215 PolarHBondContact OD2-OG1 2.85Å
214	K	95.8	Very high	95.1	Very high	87 Å²	87	32.5 Å²	32.5	38%	0.378	17%	0.174	S	C	.	.	S	Bend	trans	72.2	9.5	178.5	-44.9	172.1	176.5	-151.7	0	113.2	S211 R212 R234 E235	S211-K214 PolarHBondContact O-N 2.95Å; R212-K214 PolarHBondContact O-N 2.98Å; K214-R234 VanDerWaalsContact CD-O 3.25Å; K214-R234 WeakPolarHBondContact CD-O 3.19Å; K214-R234 VanDerWaalsContact CE-O 3.29Å; K214-R234 WeakPolarHBondContact CE-O 3.42Å; K214-R234 PolarHBondContact NZ-O 3.28Å; K214-E235 IonicContact NZ-OE1 3.22Å; K214-E235 PolarHBondContact NZ-OE1 3.1Å; K214-E235 IonicContact NZ-OE2 2.78Å
215	T	96.3	Very high	95.4	Very high	22 Å²	22	40.1 Å²	40.1	14%	0.135	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	155.1	-179.5	78.5	0	0	0	0	111.8	S211 D213 T229 T231	S211-T215 PolarHBondContact N-O 2.89Å; D213-T215 PolarHBondContact O-N 3.03Å; D213-T215 WeakPolarHBondContact OD1-CA 3.23Å; D213-T215 VanDerWaalsContact OD1-CB 3.3Å; D213-T215 WeakPolarHBondContact OD1-CB 3.39Å; D213-T215 PolarHBondContact OD1-N 2.78Å; D213-T215 PolarHBondContact OD1-OG1 2.89Å; D213-T215 PolarHBondContact OD2-OG1 2.85Å; T215-T229 HydrophobicContact CG2-CG2 4.27Å; T215-T231 HydrophobicContact CG2-CG2 4.11Å
216	I	97.2	Very high	95.5	Very high	3 Å²	3	38.1 Å²	38.1	2%	0.015	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	131.5	165.5	-59.3	161.7	0	0	0	106.2	V208 S209 T229 F230 V237 V240 S251 W261	V208-I216 HydrophobicContact CG1-CG2 3.45Å; V208-I216 VanDerWaalsContact CG1-CG2 3.45Å; S209-I216 CarbonylContact O-C 3.49Å; S209-I216 WeakPolarHBondContact O-CA 3.24Å; S209-I216 VanDerWaalsContact O-CG2 3.3Å; S209-I216 WeakPolarHBondContact O-CG2 3.21Å; I216-T229 CarbonylContact O-C 3.54Å; I216-T229 WeakPolarHBondContact O-CA 3.47Å; I216-F230 HydrophobicContact CB-CB 4.17Å; I216-F230 HydrophobicContact CB-CD2 4.21Å; I216-F230 HydrophobicContact CG2-CD2 4.06Å; I216-F230 PolarHBondContact N-O 3.18Å; I216-F230 PolarHBondContact O-N 3.02Å; I216-V237 HydrophobicContact CD1-CG1 4.2Å; I216-V237 HydrophobicContact CG1-CG1 3.97Å; I216-V237 HydrophobicContact CG1-CG2 4.34Å; I216-V240 HydrophobicContact CG2-CG2 4.07Å; I216-S251 WeakPolarHBondContact CD1-OG 3.2Å; I216-W261 HydrophobicContact CD1-CZ2 4.33Å
217	K	97	Very high	95.5	Very high	29 Å²	29	39.1 Å²	39.1	13%	0.126	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	146.3	178.2	-69.2	177.2	-169.1	-93.2	0	110.4	G190 V208 S209 W219 K228 T229	G190-K217 WeakPolarHBondContact O-CE 3.38Å; G190-K217 PolarHBondContact O-NZ 2.93Å; V208-K217 CarbonylContact C-O 3.43Å; V208-K217 WeakPolarHBondContact CA-O 3.43Å; S209-K217 PolarHBondContact N-O 2.93Å; S209-K217 PolarHBondContact O-N 2.82Å; S209-K217 PolarHBondContact OG-O 2.99Å; K217-W219 HydrophobicContact CB-CZ2 3.74Å; K217-W219 HydrophobicContact CD-CH2 4.13Å; K217-W219 HydrophobicContact CD-CZ2 3.68Å; K217-W219 HydrophobicContact CG-CZ2 4.35Å; K217-K228 CarbonylContact C-O 3.55Å; K217-K228 WeakPolarHBondContact CA-O 3.45Å; K217-T229 HydrophobicContact CG-CG2 4.17Å
218	M	96.8	Very high	95.4	Very high	3 Å²	3	41.1 Å²	41.1	2%	0.015	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	129.5	174.4	-176.5	174.4	-77.3	0	0	109	M201 H206 I207 V208 C226 V227 K228 F230 I249 V263	M201-M218 HydrophobicContact SD-CE 4.45Å; H206-M218 HydrophobicContact CB-CG 4.2Å; I207-M218 CarbonylContact O-C 3.59Å; I207-M218 VanDerWaalsContact O-CA 3.23Å; I207-M218 WeakPolarHBondContact O-CA 3.35Å; V208-M218 HydrophobicContact CG2-CE 3.92Å; M218-C226 CarbonylContact O-C 3.55Å; M218-C226 WeakPolarHBondContact O-CA 3.37Å; M218-V227 PolarHBondContact O-N 3.41Å; M218-K228 HydrophobicContact CB-CB 3.99Å; M218-K228 PolarHBondContact N-O 2.83Å; M218-K228 PolarHBondContact O-N 3.37Å; M218-K228 HydrophobicContact SD-CD 4.21Å; M218-K228 HydrophobicContact SD-CG 4.45Å; M218-F230 HydrophobicContact CB-CE2 4.18Å; M218-F230 HydrophobicContact CE-CE2 4.21Å; M218-F230 HydrophobicContact CE-CZ 4.1Å; M218-I249 HydrophobicContact CE-CD1 3.58Å; M218-V263 HydrophobicContact CE-CB 4.42Å; M218-V263 HydrophobicContact CE-CG1 3.53Å; M218-V263 HydrophobicContact CE-CG2 4.16Å; M218-V263 HydrophobicContact SD-CG1 4.07Å
219	W	96.7	Very high	95.3	Very high	5 Å²	5	43.5 Å²	43.5	2%	0.019	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	142.1	-173.3	-46.7	81.7	0	0	0	109.5	I174 M188 H189 H191 H206 I207 S209 K217 Y225 C226	I174-W219 HydrophobicContact CD1-CD2 4.42Å; I174-W219 HydrophobicContact CD1-CZ2 3.88Å; M188-W219 HydrophobicContact CB-CD2 4.44Å; M188-W219 HydrophobicContact CB-CE3 3.98Å; M188-W219 HydrophobicContact CB-CZ3 4.14Å; M188-W219 HydrophobicContact CG-CE3 4.42Å; M188-W219 HydrophobicContact SD-CB 3.61Å; M188-W219 HydrophobicContact SD-CD2 4.15Å; M188-W219 HydrophobicContact SD-CE3 4.19Å; M188-W219 HydrophobicContact SD-CG 3.92Å; H189-W219 WeakPolarHBondContact O-CZ3 3.46Å; H191-W219 AromaticContact CD2-CZ2 3.85Å; H206-W219 CarbonylContact C-O 3.51Å; H206-W219 WeakPolarHBondContact CA-O 3.32Å; I207-W219 HydrophobicContact CB-CB 4.32Å; I207-W219 PolarHBondContact N-O 2.77Å; I207-W219 PolarHBondContact O-N 2.67Å; S209-W219 PolarHBondContact OG-NE1 2.94Å; K217-W219 HydrophobicContact CB-CZ2 3.74Å; K217-W219 HydrophobicContact CD-CH2 4.13Å; K217-W219 HydrophobicContact CD-CZ2 3.68Å; K217-W219 HydrophobicContact CG-CZ2 4.35Å; W219-Y225 CarbonylContact C-O 3.56Å; W219-Y225 VanDerWaalsContact CA-O 3.27Å; W219-Y225 WeakPolarHBondContact CA-O 3.34Å; W219-C226 HydrophobicContact CD2-CB 4.37Å; W219-C226 HydrophobicContact CE3-CB 3.8Å; W219-C226 HydrophobicContact CH2-CB 4.22Å; W219-C226 HydrophobicContact CZ3-CB 3.73Å
220	E	95.7	Very high	95.2	Very high	68 Å²	68	43.8 Å²	43.8	32%	0.318	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	129.4	170.4	179.9	175.6	-131.8	0	0	110.2	A222 T223 G224 Y225 V227	E220-A222 HydrophobicContact CG-CB 4.34Å; E220-T223 WeakPolarHBondContact CB-OG1 3.2Å; E220-T223 WeakPolarHBondContact OE2-CB 3.42Å; E220-T223 WeakPolarHBondContact OE2-CG2 3.13Å; E220-T223 PolarHBondContact OE2-OG1 3.24Å; E220-G224 WeakPolarHBondContact O-CA 3.29Å; E220-G224 PolarHBondContact O-N 3.24Å; E220-Y225 PolarHBondContact N-O 3.45Å; E220-V227 HydrophobicContact CB-CG2 3.81Å
221	V	93.9	Very high	95.1	Very high	19 Å²	19	48.7 Å²	48.7	12%	0.115	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-36.7	-175.3	173.4	0	0	0	0	111.9	L164 L176 R186 G204 D205 I207	L164-V221 HydrophobicContact CD1-CG1 3.82Å; L176-V221 HydrophobicContact CD1-CG1 4.12Å; R186-V221 PolarHBondContact NE-O 2.97Å; R186-V221 VanDerWaalsContact NE-O 3.16Å; R186-V221 PolarHBondContact NH2-O 3.46Å; G204-V221 WeakPolarHBondContact O-CG2 3.41Å; D205-V221 WeakPolarHBondContact O-CG2 3.43Å; D205-V221 PolarHBondContact O-N 2.99Å; I207-V221 HydrophobicContact CD1-CG2 3.75Å; I207-V221 HydrophobicContact CG1-CG2 3.7Å
222	A	92.1	Very high	94.8	Very high	68 Å²	68	50.2 Å²	50.2	56%	0.562	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-38.2	-178.4	0	0	0	0	0	113	R186 E220	R186-A222 PolarHBondContact NH1-O 3.27Å; R186-A222 PolarHBondContact NH2-O 2.85Å; E220-A222 HydrophobicContact CG-CB 4.34Å
223	T	91.4	Very high	94.7	Very high	58 Å²	58	45.1 Å²	45.1	36%	0.356	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.7	-26.8	-175.9	61.3	0	0	0	0	113.1	E220 Y225	E220-T223 WeakPolarHBondContact CB-OG1 3.2Å; E220-T223 WeakPolarHBondContact OE2-CB 3.42Å; E220-T223 WeakPolarHBondContact OE2-CG2 3.13Å; E220-T223 PolarHBondContact OE2-OG1 3.24Å; T223-Y225 VanDerWaalsContact C-N 3.27Å; T223-Y225 VanDerWaalsContact CB-CD2 3.49Å; T223-Y225 HydrophobicContact CG2-CD2 4.24Å; T223-Y225 WeakPolarHBondContact OG1-CD2 3.23Å; T223-Y225 PolarHBondContact OG1-N 2.59Å
224	G	91.4	Very high	94.6	Very high	12 Å²	12	52.2 Å²	52.2	12%	0.124	28%	0.278	C	S	.	.			trans	77.4	8.7	-170.4	0	0	0	0	0	113.8	E220	E220-G224 WeakPolarHBondContact O-CA 3.29Å; E220-G224 PolarHBondContact O-N 3.24Å
225	Y	94.4	Very high	94.7	Very high	173 Å²	173	52.4 Å²	52.4	68%	0.678	28%	0.281	S	S	*	.			trans	-83.5	145.8	-179.2	-67	-44.8	0	0	0	113	W219 E220 T223 V227	W219-Y225 CarbonylContact C-O 3.56Å; W219-Y225 VanDerWaalsContact CA-O 3.27Å; W219-Y225 WeakPolarHBondContact CA-O 3.34Å; E220-Y225 PolarHBondContact N-O 3.45Å; T223-Y225 VanDerWaalsContact C-N 3.27Å; T223-Y225 VanDerWaalsContact CB-CD2 3.49Å; T223-Y225 HydrophobicContact CG2-CD2 4.24Å; T223-Y225 WeakPolarHBondContact OG1-CD2 3.23Å; T223-Y225 PolarHBondContact OG1-N 2.59Å; Y225-V227 PolarHBondContact O-N 3.29Å
226	C	95.1	Very high	94.7	Very high	54 Å²	54	52.9 Å²	52.9	37%	0.365	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	111.7	171.3	-177.2	0	0	0	0	110	M218 W219	M218-C226 CarbonylContact O-C 3.55Å; M218-C226 WeakPolarHBondContact O-CA 3.37Å; W219-C226 HydrophobicContact CD2-CB 4.37Å; W219-C226 HydrophobicContact CE3-CB 3.8Å; W219-C226 HydrophobicContact CH2-CB 4.22Å; W219-C226 HydrophobicContact CZ3-CB 3.73Å
227	V	94.8	Very high	94.7	Very high	71 Å²	71	52.7 Å²	52.7	43%	0.43	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	-40.8	-178.4	-174.4	0	0	0	0	111.2	M218 E220 Y225	M218-V227 PolarHBondContact O-N 3.41Å; E220-V227 HydrophobicContact CB-CG2 3.81Å; Y225-V227 PolarHBondContact O-N 3.29Å
228	K	94.8	Very high	94.6	Very high	41 Å²	41	53.3 Å²	53.3	18%	0.178	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	139.8	-177.1	-56.7	-170.5	177.1	-173.8	0	110.7	K217 M218 F230 V263 A264 K266	K217-K228 CarbonylContact C-O 3.55Å; K217-K228 WeakPolarHBondContact CA-O 3.45Å; M218-K228 HydrophobicContact CB-CB 3.99Å; M218-K228 PolarHBondContact N-O 2.83Å; M218-K228 PolarHBondContact O-N 3.37Å; M218-K228 HydrophobicContact SD-CD 4.21Å; M218-K228 HydrophobicContact SD-CG 4.45Å; K228-F230 HydrophobicContact CB-CE2 3.99Å; K228-F230 HydrophobicContact CB-CZ 4.24Å; K228-F230 HydrophobicContact CD-CZ 4.33Å; K228-V263 PolarHBondContact NZ-O 2.81Å; K228-A264 PolarHBondContact NZ-O 2.91Å; K228-K266 HydrophobicContact CB-CD 4.44Å; K228-K266 HydrophobicContact CD-CD 4.4Å; K228-K266 HydrophobicContact CD-CG 4.05Å; K228-K266 VanDerWaalsContact CG-CE 3.43Å
229	T	95.8	Very high	94.6	Very high	51 Å²	51	53.6 Å²	53.6	31%	0.313	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	127.3	166.1	-58.9	0	0	0	0	107.5	T215 I216 K217 T231	T215-T229 HydrophobicContact CG2-CG2 4.27Å; I216-T229 CarbonylContact O-C 3.54Å; I216-T229 WeakPolarHBondContact O-CA 3.47Å; K217-T229 HydrophobicContact CG-CG2 4.17Å; T229-T231 HydrophobicContact CG2-CG2 4.19Å
230	F	95.4	Very high	94.7	Very high	5 Å²	5	53.4 Å²	53.4	2%	0.022	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	124.7	174.6	-50.5	-104.1	0	0	0	108.1	I216 M218 K228 I249 W261 K266	I216-F230 HydrophobicContact CB-CB 4.17Å; I216-F230 HydrophobicContact CB-CD2 4.21Å; I216-F230 HydrophobicContact CG2-CD2 4.06Å; I216-F230 PolarHBondContact N-O 3.18Å; I216-F230 PolarHBondContact O-N 3.02Å; M218-F230 HydrophobicContact CB-CE2 4.18Å; M218-F230 HydrophobicContact CE-CE2 4.21Å; M218-F230 HydrophobicContact CE-CZ 4.1Å; K228-F230 HydrophobicContact CB-CE2 3.99Å; K228-F230 HydrophobicContact CB-CZ 4.24Å; K228-F230 HydrophobicContact CD-CZ 4.33Å; F230-I249 HydrophobicContact CZ-CD1 4.36Å; F230-W261 HydrophobicContact CB-CD2 4.47Å; F230-W261 HydrophobicContact CB-CE3 4.21Å; F230-W261 HydrophobicContact CB-CZ3 4.32Å; F230-W261 HydrophobicContact CD1-CB 4.24Å; F230-W261 HydrophobicContact CD1-CD2 4.41Å; F230-W261 HydrophobicContact CD1-CE3 4.15Å; F230-W261 HydrophobicContact CD1-CG 4.47Å; F230-W261 HydrophobicContact CE1-CB 4.35Å; F230-K266 HydrophobicContact CD1-CB 3.89Å; F230-K266 HydrophobicContact CD1-CG 4.22Å; F230-K266 HydrophobicContact CE1-CB 3.93Å; F230-K266 HydrophobicContact CE1-CG 3.92Å; F230-K266 HydrophobicContact CZ-CG 4.49Å
231	T	94.3	Very high	94.7	Very high	104 Å²	104	52.3 Å²	52.3	64%	0.638	28%	0.275	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.5	140.1	178.3	52.8	0	0	0	0	108.9	T215 T229	T215-T231 HydrophobicContact CG2-CG2 4.11Å; T229-T231 HydrophobicContact CG2-CG2 4.19Å
232	G	91	Very high	94.8	Very high	32 Å²	32	52.5 Å²	52.5	33%	0.33	28%	0.276	S	S	.	.			trans	163	-26.5	172.7	0	0	0	0	0	114.6	R259	G232-R259 VanDerWaalsContact CA-NH1 3.33Å; G232-R259 PolarHBondContact O-NH1 2.91Å; G232-R259 PolarHBondContact O-NH2 2.84Å; G232-R259 VanDerWaalsContact O-NH2 3.15Å
233	H	94.1	Very high	94.9	Very high	12 Å²	12	49.9 Å²	49.9	6%	0.056	25%	0.252	C	S	.	.			trans	-62.6	143.7	167	-81.9	-63.4	0	0	0	110.4	V237 S251 S253 D255 T257 W261	H233-V237 HydrophobicContact CB-CG2 3.89Å; H233-S251 PolarHBondContact CD2-OG 3.08Å; H233-S251 PolarHBondContact NE2-OG 3.19Å; H233-S253 VanDerWaalsContact CE1-CB 3.49Å; H233-S253 WeakPolarHBondContact CE1-CB 3.38Å; H233-S253 WeakPolarHBondContact ND1-CB 3.29Å; H233-D255 WeakPolarHBondContact CA-OD2 3.28Å; H233-D255 IonicContact CE1-OD1 3.62Å; H233-D255 IonicContact CG-OD2 3.63Å; H233-D255 IonicContact ND1-OD1 3.52Å; H233-D255 PolarHBondContact ND1-OD1 2.96Å; H233-D255 IonicContact ND1-OD2 2.89Å; H233-D255 PolarHBondContact ND1-OD2 3.05Å; H233-T257 PolarHBondContact CE1-OG1 3.09Å; H233-T257 VanDerWaalsContact CE1-OG1 3.27Å; H233-T257 PolarHBondContact ND1-OG1 3.33Å; H233-W261 AromaticContact CD2-CZ2 3.96Å
234	R	93.4	Very high	94.7	Very high	179 Å²	179	51.7 Å²	51.7	68%	0.675	26%	0.257	S	S	*	.	S	Bend	trans	-88.4	-21.4	-178.6	-64.6	-174.5	179.4	-159	-0.7	112.6	K214 D255	K214-R234 VanDerWaalsContact CD-O 3.25Å; K214-R234 WeakPolarHBondContact CD-O 3.19Å; K214-R234 VanDerWaalsContact CE-O 3.29Å; K214-R234 WeakPolarHBondContact CE-O 3.42Å; K214-R234 PolarHBondContact NZ-O 3.28Å; R234-D255 HydrophobicContact CB-CB 4.26Å; R234-D255 PolarHBondContact N-OD2 2.89Å
235	E	96.6	Very high	94.5	Very high	91 Å²	91	56.5 Å²	56.5	43%	0.425	28%	0.28	S	S	.	.	S	Bend	trans	-135.8	-175.9	-175.7	-68.4	-55.7	142.5	0	0	111.4	K214 V237 S253 N254 D255	K214-E235 IonicContact NZ-OE1 3.22Å; K214-E235 PolarHBondContact NZ-OE1 3.1Å; K214-E235 IonicContact NZ-OE2 2.78Å; E235-V237 PolarHBondContact O-N 3.04Å; E235-S253 PolarHBondContact O-OG 3.25Å; E235-N254 HydrophobicContact CB-CB 3.87Å; E235-D255 HydrophobicContact CB-CB 4.19Å; E235-D255 HydrophobicContact CG-CB 4.42Å
236	W	96.4	Very high	94.3	Very high	32 Å²	32	49 Å²	49	12%	0.121	26%	0.255	C	S	.	.			trans	-51.3	120.9	-178.6	-175.9	-1.6	0	0	0	112.2	S196 R212 R238 S253 N254	S196-W236 PolarHBondContact OG-NE1 2.74Å; R212-W236 HydrophobicContact CB-CB 4.45Å; R212-W236 HydrophobicContact CB-CD2 3.81Å; R212-W236 HydrophobicContact CB-CG 3.75Å; R212-W236 HydrophobicContact CB-CZ2 4.38Å; R212-W236 HydrophobicContact CG-CB 4.11Å; R212-W236 HydrophobicContact CG-CD2 3.75Å; R212-W236 HydrophobicContact CG-CE3 4.04Å; R212-W236 HydrophobicContact CG-CG 3.78Å; W236-R238 VanDerWaalsContact CH2-NH1 3.26Å; W236-S253 CarbonylContact O-C 3.54Å; W236-S253 VanDerWaalsContact O-CA 3.24Å; W236-S253 WeakPolarHBondContact O-CA 3.41Å; W236-S253 PolarHBondContact O-OG 3.49Å; W236-S253 VanDerWaalsContact O-OG 3.13Å; W236-N254 HydrophobicContact CB-CB 4.37Å; W236-N254 PolarHBondContact O-N 2.93Å
237	V	97.5	Very high	94.1	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	116.9	171.2	-169.1	0	0	0	0	110	S196 A210 S211 I216 H233 E235 C252	S196-V237 PolarHBondContact OG-O 2.62Å; A210-V237 HydrophobicContact CB-CB 3.93Å; A210-V237 HydrophobicContact CB-CG1 3.54Å; S211-V237 PolarHBondContact O-N 2.73Å; I216-V237 HydrophobicContact CD1-CG1 4.2Å; I216-V237 HydrophobicContact CG1-CG1 3.97Å; I216-V237 HydrophobicContact CG1-CG2 4.34Å; H233-V237 HydrophobicContact CB-CG2 3.89Å; E235-V237 PolarHBondContact O-N 3.04Å; V237-C252 CarbonylContact C-O 3.53Å; V237-C252 WeakPolarHBondContact CA-O 3.48Å; V237-C252 VanDerWaalsContact CG1-O 3.27Å; V237-C252 WeakPolarHBondContact CG1-O 3.38Å
238	R	95.9	Very high	94.1	Very high	42 Å²	42	47.6 Å²	47.6	16%	0.158	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	-47.9	-174	-75.7	-70.6	-179.9	-173.5	0.6	113.2	S196 W236 C252 N254 V278 E280	S196-R238 WeakPolarHBondContact CB-O 3.16Å; S196-R238 PolarHBondContact OG-O 2.98Å; W236-R238 VanDerWaalsContact CH2-NH1 3.26Å; R238-C252 PolarHBondContact N-O 3.26Å; R238-N254 WeakPolarHBondContact CG-OD1 3.3Å; R238-N254 PolarHBondContact NE-OD1 2.98Å; R238-V278 HydrophobicContact CG-CG1 4.43Å; R238-E280 WeakPolarHBondContact CD-OE2 3.33Å; R238-E280 IonicContact NE-OE1 3.9Å; R238-E280 IonicContact NE-OE2 3.37Å
239	M	96.8	Very high	94.2	Very high	9 Å²	9	45.7 Å²	45.7	4%	0.044	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	151.1	-176.4	-150.8	170.6	78.3	0	0	111.3	R113 S197 R241 S251 C252 C281 I282	R113-M239 PolarHBondContact NH2-SD 3.45Å; S197-M239 VanDerWaalsContact OG-CG 3.31Å; S197-M239 WeakPolarHBondContact OG-CG 3.44Å; M239-R241 HydrophobicContact CE-CG 3.71Å; M239-S251 VanDerWaalsContact O-CA 3.26Å; M239-S251 WeakPolarHBondContact O-CA 3.14Å; M239-C252 WeakPolarHBondContact CB-SG 3.21Å; M239-C252 PolarHBondContact N-SG 3.07Å; M239-C252 PolarHBondContact O-N 3.18Å; M239-C281 HydrophobicContact CE-CB 4.33Å; M239-C281 HydrophobicContact SD-CB 4.44Å; M239-I282 HydrophobicContact CE-CB 3.92Å; M239-I282 WeakPolarHBondContact CE-O 3.36Å
240	V	96.9	Very high	94.2	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	133.4	173.7	65.8	0	0	0	0	109.9	S197 V208 A210 I216 I249 A250	S197-V240 PolarHBondContact OG-N 2.59Å; V208-V240 HydrophobicContact CB-CG1 4.44Å; V208-V240 HydrophobicContact CB-CG2 4.41Å; V208-V240 HydrophobicContact CG1-CB 4.38Å; V208-V240 HydrophobicContact CG1-CG1 4.01Å; V208-V240 HydrophobicContact CG1-CG2 3.5Å; V208-V240 VanDerWaalsContact CG1-CG2 3.5Å; A210-V240 HydrophobicContact CB-CB 4.01Å; A210-V240 HydrophobicContact CB-CG1 3.89Å; I216-V240 HydrophobicContact CG2-CG2 4.07Å; V240-I249 HydrophobicContact CG2-CG2 3.19Å; V240-A250 CarbonylContact C-O 3.58Å; V240-A250 WeakPolarHBondContact CA-O 3.44Å
241	R	96.7	Very high	94.3	Very high	46 Å²	46	43 Å²	43	17%	0.174	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	130	177.3	-68	-65.3	171.9	-168.3	-7.1	111.7	D155 M239 A250 W284	D155-R241 IonicContact OD1-NH2 3.39Å; D155-R241 PolarHBondContact OD1-NH2 2.87Å; D155-R241 IonicContact OD2-NH2 2.88Å; D155-R241 PolarHBondContact OD2-NH2 2.96Å; M239-R241 HydrophobicContact CE-CG 3.71Å; R241-A250 PolarHBondContact N-O 3.09Å; R241-A250 PolarHBondContact O-N 3.02Å; R241-W284 PolarHBondContact O-NE1 3.38Å
242	P	95.8	Very high	94.4	Very high	22 Å²	22	38 Å²	38	14%	0.143	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	148.5	172.4	30.6	-33.9	0	0	0	111.2	A199 M201 W284	A199-P242 VanDerWaalsContact CB-CD 3.47Å; A199-P242 HydrophobicContact CB-CG 4.23Å; M201-P242 HydrophobicContact CE-CB 3.37Å; M201-P242 HydrophobicContact CE-CG 4.43Å; M201-P242 HydrophobicContact SD-CB 3.61Å; M201-P242 HydrophobicContact SD-CG 4.39Å; P242-W284 PolarHBondContact O-NE1 2.85Å
243	N	93.4	Very high	94.7	Very high	13 Å²	13	36.5 Å²	36.5	7%	0.07	17%	0.174	C	C	.	.			trans	-69.9	160.6	167.4	-175	33.1	0	0	0	110.5	P202 D245 G246 L248 W284	P202-N243 WeakPolarHBondContact CG-O 3.44Å; N243-D245 VanDerWaalsContact C-N 3.25Å; N243-D245 PolarHBondContact O-N 3.08Å; N243-G246 PolarHBondContact O-N 3.13Å; N243-L248 HydrophobicContact CB-CB 3.97Å; N243-L248 WeakPolarHBondContact CB-O 3.45Å; N243-L248 PolarHBondContact N-O 3.07Å; N243-W284 HydrophobicContact CB-CD2 4.17Å; N243-W284 HydrophobicContact CB-CZ2 4.12Å
244	Q	88.4	Confident	94.8	Very high	97 Å²	97	38 Å²	38	45%	0.453	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-36.5	-179.3	-62.9	-163.3	-25.8	0	0	113.2	P202 G246	P202-Q244 WeakPolarHBondContact CG-O 3.15Å; Q244-G246 VanDerWaalsContact C-N 3.27Å; Q244-G246 PolarHBondContact O-N 3.36Å
245	D	87.3	Confident	94.8	Very high	113 Å²	113	30.8 Å²	30.8	60%	0.604	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-9.5	177	-60.3	-33.2	0	0	0	113.7	N243 T247	N243-D245 VanDerWaalsContact C-N 3.25Å; N243-D245 PolarHBondContact O-N 3.08Å; D245-T247 HydrophobicContact CB-CG2 4.16Å; D245-T247 PolarHBondContact O-N 3.29Å; D245-T247 VanDerWaalsContact O-N 3.12Å
246	G	89.1	Confident	94.7	Very high	16 Å²	16	30.3 Å²	30.3	17%	0.165	16%	0.155	C	C	.	.	S	Bend	trans	69.5	1.4	-175.6	0	0	0	0	0	116	M201 N243 Q244	M201-G246 VanDerWaalsContact CE-O 3.23Å; M201-G246 WeakPolarHBondContact CE-O 2.91Å; N243-G246 PolarHBondContact O-N 3.13Å; Q244-G246 VanDerWaalsContact C-N 3.27Å; Q244-G246 PolarHBondContact O-N 3.36Å
247	T	92.1	Very high	94.7	Very high	79 Å²	79	29.1 Å²	29.1	49%	0.485	15%	0.152	S	C	.	.	S	Bend	trans	-78.3	-28.6	-179	56	0	0	0	0	113.7	D245 V263	D245-T247 HydrophobicContact CB-CG2 4.16Å; D245-T247 PolarHBondContact O-N 3.29Å; D245-T247 VanDerWaalsContact O-N 3.12Å; T247-V263 WeakPolarHBondContact O-CB 3.28Å; T247-V263 WeakPolarHBondContact O-CG2 3.46Å; T247-V263 PolarHBondContact O-N 2.95Å
248	L	94.5	Very high	94.6	Very high	15 Å²	15	29.1 Å²	29.1	8%	0.079	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	151.1	-177	-62.6	175.9	0	0	0	110.9	N243 V260 W261 V262 K269 W284 P309	N243-L248 HydrophobicContact CB-CB 3.97Å; N243-L248 WeakPolarHBondContact CB-O 3.45Å; N243-L248 PolarHBondContact N-O 3.07Å; L248-V260 HydrophobicContact CB-CG1 4.17Å; L248-V260 HydrophobicContact CD1-CG1 4.28Å; L248-V260 HydrophobicContact CD2-CG1 4.26Å; L248-V260 HydrophobicContact CG-CG1 4.48Å; L248-W261 WeakPolarHBondContact CA-O 3.33Å; L248-V262 HydrophobicContact CD2-CB 4.46Å; L248-V262 HydrophobicContact CD2-CG2 3.8Å; L248-K269 HydrophobicContact CD2-CD 4.34Å; L248-W284 HydrophobicContact CB-CH2 4.32Å; L248-W284 HydrophobicContact CB-CZ2 4.33Å; L248-W284 HydrophobicContact CD1-CH2 4.45Å; L248-P309 HydrophobicContact CD1-CG 3.94Å
249	I	96.4	Very high	94.6	Very high	1 Å²	1	28.3 Å²	28.3	1%	0.005	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	134.6	172	-66.9	166.3	0	0	0	108.1	M201 V208 M218 F230 V240 V260 W261 V263	M201-I249 HydrophobicContact SD-CD1 4.28Å; M201-I249 HydrophobicContact SD-CG1 4.29Å; V208-I249 HydrophobicContact CB-CD1 4.46Å; V208-I249 HydrophobicContact CG1-CD1 4Å; V208-I249 HydrophobicContact CG1-CG2 4.34Å; V208-I249 HydrophobicContact CG2-CD1 3.64Å; V208-I249 HydrophobicContact CG2-CG1 4.4Å; M218-I249 HydrophobicContact CE-CD1 3.58Å; F230-I249 HydrophobicContact CZ-CD1 4.36Å; V240-I249 HydrophobicContact CG2-CG2 3.19Å; I249-V260 CarbonylContact O-C 3.49Å; I249-V260 WeakPolarHBondContact O-CA 3.37Å; I249-W261 PolarHBondContact N-O 3.34Å; I249-W261 PolarHBondContact O-N 2.93Å; I249-V263 HydrophobicContact CD1-CG2 3.5Å; I249-V263 VanDerWaalsContact CD1-CG2 3.5Å; I249-V263 HydrophobicContact CG1-CG2 3.6Å
250	A	96.9	Very high	94.6	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	141.9	169.2	0	0	0	0	0	110.3	V240 R241 R259 V260 I282 W284 L311	V240-A250 CarbonylContact C-O 3.58Å; V240-A250 WeakPolarHBondContact CA-O 3.44Å; R241-A250 PolarHBondContact N-O 3.09Å; R241-A250 PolarHBondContact O-N 3.02Å; A250-R259 CarbonylContact C-O 3.55Å; A250-R259 WeakPolarHBondContact CA-O 3.47Å; A250-V260 HydrophobicContact CB-CG2 4.35Å; A250-I282 HydrophobicContact CB-CD1 4.42Å; A250-I282 HydrophobicContact CB-CG2 3.97Å; A250-W284 HydrophobicContact CB-CH2 4.31Å; A250-W284 HydrophobicContact CB-CZ2 3.44Å; A250-W284 VanDerWaalsContact CB-CZ2 3.44Å; A250-L311 HydrophobicContact CB-CD1 3.86Å; A250-L311 HydrophobicContact CB-CD2 3.86Å
251	S	96.9	Very high	94.6	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	145.2	174.7	61.9	0	0	0	0	112.4	I216 H233 M239 V258 R259 W261 I282	I216-S251 WeakPolarHBondContact CD1-OG 3.2Å; H233-S251 PolarHBondContact CD2-OG 3.08Å; H233-S251 PolarHBondContact NE2-OG 3.19Å; M239-S251 VanDerWaalsContact O-CA 3.26Å; M239-S251 WeakPolarHBondContact O-CA 3.14Å; S251-V258 CarbonylContact O-C 3.57Å; S251-V258 WeakPolarHBondContact O-CA 3.49Å; S251-R259 PolarHBondContact N-O 3.43Å; S251-R259 PolarHBondContact O-N 3.01Å; S251-W261 PolarHBondContact OG-NE1 3.24Å; S251-I282 WeakPolarHBondContact O-CD1 3.34Å
252	C	96.2	Very high	94.5	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	154	172.2	46.3	0	0	0	0	110.2	V237 R238 M239 V258 V279 I282	V237-C252 CarbonylContact C-O 3.53Å; V237-C252 WeakPolarHBondContact CA-O 3.48Å; V237-C252 VanDerWaalsContact CG1-O 3.27Å; V237-C252 WeakPolarHBondContact CG1-O 3.38Å; R238-C252 PolarHBondContact N-O 3.26Å; M239-C252 WeakPolarHBondContact CB-SG 3.21Å; M239-C252 PolarHBondContact N-SG 3.07Å; M239-C252 PolarHBondContact O-N 3.18Å; C252-V258 HydrophobicContact CB-CG2 4.45Å; C252-V279 HydrophobicContact CB-CB 3.71Å; C252-V279 HydrophobicContact CB-CG1 3.48Å; C252-V279 VanDerWaalsContact CB-CG1 3.48Å; C252-I282 HydrophobicContact CB-CD1 3.37Å; C252-I282 HydrophobicContact CB-CG1 3.76Å
253	S	96.5	Very high	94.4	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	163.5	-177.7	170.3	0	0	0	0	112.6	H233 E235 W236 D255 Q256 T257 V279	H233-S253 VanDerWaalsContact CE1-CB 3.49Å; H233-S253 WeakPolarHBondContact CE1-CB 3.38Å; H233-S253 WeakPolarHBondContact ND1-CB 3.29Å; E235-S253 PolarHBondContact O-OG 3.25Å; W236-S253 CarbonylContact O-C 3.54Å; W236-S253 VanDerWaalsContact O-CA 3.24Å; W236-S253 WeakPolarHBondContact O-CA 3.41Å; W236-S253 PolarHBondContact O-OG 3.49Å; W236-S253 VanDerWaalsContact O-OG 3.13Å; S253-D255 WeakPolarHBondContact CB-OD1 3.37Å; S253-D255 PolarHBondContact O-N 2.89Å; S253-D255 PolarHBondContact OG-N 2.95Å; S253-D255 PolarHBondContact OG-OD1 3.44Å; S253-D255 PolarHBondContact OG-OD2 3.44Å; S253-Q256 PolarHBondContact O-N 3.14Å; S253-T257 PolarHBondContact N-O 2.84Å; S253-V279 PolarHBondContact O-N 3.12Å
254	N	96.1	Very high	94.3	Very high	42 Å²	42	30.8 Å²	30.8	23%	0.225	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-16	169	-76	14.8	0	0	0	113.3	E235 W236 R238 Q256 V278	E235-N254 HydrophobicContact CB-CB 3.87Å; W236-N254 HydrophobicContact CB-CB 4.37Å; W236-N254 PolarHBondContact O-N 2.93Å; R238-N254 WeakPolarHBondContact CG-OD1 3.3Å; R238-N254 PolarHBondContact NE-OD1 2.98Å; N254-Q256 PolarHBondContact O-N 3.3Å; N254-Q256 VanDerWaalsContact O-N 3.13Å; N254-V278 HydrophobicContact CB-CG1 4.37Å; N254-V278 HydrophobicContact CB-CG2 4.11Å; N254-V278 WeakPolarHBondContact OD1-CG1 3.35Å
255	D	94.3	Very high	94.5	Very high	29 Å²	29	29.9 Å²	29.9	16%	0.155	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	9	172.9	65	18.1	0	0	0	113.6	H233 R234 E235 S253 T257	H233-D255 WeakPolarHBondContact CA-OD2 3.28Å; H233-D255 IonicContact CE1-OD1 3.62Å; H233-D255 IonicContact CG-OD2 3.63Å; H233-D255 IonicContact ND1-OD1 3.52Å; H233-D255 PolarHBondContact ND1-OD1 2.96Å; H233-D255 IonicContact ND1-OD2 2.89Å; H233-D255 PolarHBondContact ND1-OD2 3.05Å; R234-D255 HydrophobicContact CB-CB 4.26Å; R234-D255 PolarHBondContact N-OD2 2.89Å; E235-D255 HydrophobicContact CB-CB 4.19Å; E235-D255 HydrophobicContact CG-CB 4.42Å; S253-D255 WeakPolarHBondContact CB-OD1 3.37Å; S253-D255 PolarHBondContact O-N 2.89Å; S253-D255 PolarHBondContact OG-N 2.95Å; S253-D255 PolarHBondContact OG-OD1 3.44Å; S253-D255 PolarHBondContact OG-OD2 3.44Å; D255-T257 VanDerWaalsContact CG-OG1 3.31Å; D255-T257 WeakPolarHBondContact O-CG2 3.33Å; D255-T257 PolarHBondContact O-N 3.38Å; D255-T257 WeakPolarHBondContact OD1-CB 3.45Å; D255-T257 WeakPolarHBondContact OD1-CG2 3.37Å; D255-T257 PolarHBondContact OD1-N 3.18Å; D255-T257 PolarHBondContact OD1-OG1 3.02Å
256	Q	95.2	Very high	94.7	Very high	80 Å²	80	28.9 Å²	28.9	37%	0.374	17%	0.167	S	C	.	.	S	Bend	trans	68.3	11.3	177.6	-42.1	177.2	-18.4	0	0	113.3	S253 N254 E276	S253-Q256 PolarHBondContact O-N 3.14Å; N254-Q256 PolarHBondContact O-N 3.3Å; N254-Q256 VanDerWaalsContact O-N 3.13Å; Q256-E276 PolarHBondContact NE2-O 2.95Å
257	T	95.2	Very high	94.8	Very high	8 Å²	8	34.3 Å²	34.3	5%	0.049	19%	0.188	C	C	.	.			trans	-106.6	147.9	-178.9	76.8	0	0	0	0	111.8	H233 S253 D255 R273	H233-T257 PolarHBondContact CE1-OG1 3.09Å; H233-T257 VanDerWaalsContact CE1-OG1 3.27Å; H233-T257 PolarHBondContact ND1-OG1 3.33Å; S253-T257 PolarHBondContact N-O 2.84Å; D255-T257 VanDerWaalsContact CG-OG1 3.31Å; D255-T257 WeakPolarHBondContact O-CG2 3.33Å; D255-T257 PolarHBondContact O-N 3.38Å; D255-T257 WeakPolarHBondContact OD1-CB 3.45Å; D255-T257 WeakPolarHBondContact OD1-CG2 3.37Å; D255-T257 PolarHBondContact OD1-N 3.18Å; D255-T257 PolarHBondContact OD1-OG1 3.02Å; T257-R273 HydrophobicContact CG2-CG 3.79Å
258	V	96.7	Very high	94.8	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	125.5	162.6	177.1	0	0	0	0	108.1	S251 C252 L272 V279 I282 L311	S251-V258 CarbonylContact O-C 3.57Å; S251-V258 WeakPolarHBondContact O-CA 3.49Å; C252-V258 HydrophobicContact CB-CG2 4.45Å; V258-L272 HydrophobicContact CB-CB 4.14Å; V258-L272 HydrophobicContact CB-CD1 4.21Å; V258-L272 HydrophobicContact CG1-CD1 4.06Å; V258-L272 PolarHBondContact N-O 3.05Å; V258-L272 VanDerWaalsContact N-O 3.08Å; V258-L272 PolarHBondContact O-N 2.84Å; V258-V279 HydrophobicContact CG2-CB 4.35Å; V258-V279 HydrophobicContact CG2-CG1 3.79Å; V258-V279 HydrophobicContact CG2-CG2 4.18Å; V258-I282 HydrophobicContact CG1-CD1 3.71Å; V258-I282 HydrophobicContact CG1-CG1 4.44Å; V258-I282 HydrophobicContact CG2-CD1 4.21Å; V258-I282 HydrophobicContact CG2-CG1 4.46Å; V258-L311 HydrophobicContact CG1-CD2 3.51Å
259	R	96.2	Very high	94.7	Very high	25 Å²	25	37.6 Å²	37.6	9%	0.094	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	140.5	179.6	-70.4	-176.4	176.7	-151	1.6	110.9	G232 A250 S251 W261 A270 E271	G232-R259 VanDerWaalsContact CA-NH1 3.33Å; G232-R259 PolarHBondContact O-NH1 2.91Å; G232-R259 PolarHBondContact O-NH2 2.84Å; G232-R259 VanDerWaalsContact O-NH2 3.15Å; A250-R259 CarbonylContact C-O 3.55Å; A250-R259 WeakPolarHBondContact CA-O 3.47Å; S251-R259 PolarHBondContact N-O 3.43Å; S251-R259 PolarHBondContact O-N 3.01Å; R259-W261 HydrophobicContact CB-CZ2 3.84Å; R259-W261 HydrophobicContact CG-CZ2 4.36Å; R259-A270 WeakPolarHBondContact CA-O 3.37Å; R259-E271 HydrophobicContact CG-CB 4.46Å; R259-E271 HydrophobicContact CG-CG 4.06Å; R259-E271 IonicContact CZ-OE1 3.67Å; R259-E271 IonicContact NE-OE1 3.4Å; R259-E271 PolarHBondContact NE-OE1 2.89Å; R259-E271 IonicContact NH2-OE1 3.24Å; R259-E271 PolarHBondContact NH2-OE1 2.86Å; R259-E271 IonicContact NH2-OE2 3.77Å
260	V	96.6	Very high	94.4	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	124.8	172.7	-177.2	0	0	0	0	109.5	L248 I249 A250 C268 K269 A270 W284 L311 V325	L248-V260 HydrophobicContact CB-CG1 4.17Å; L248-V260 HydrophobicContact CD1-CG1 4.28Å; L248-V260 HydrophobicContact CD2-CG1 4.26Å; L248-V260 HydrophobicContact CG-CG1 4.48Å; I249-V260 CarbonylContact O-C 3.49Å; I249-V260 WeakPolarHBondContact O-CA 3.37Å; A250-V260 HydrophobicContact CB-CG2 4.35Å; V260-C268 CarbonylContact O-C 3.51Å; V260-C268 WeakPolarHBondContact O-CA 3.13Å; V260-K269 PolarHBondContact O-N 3.21Å; V260-A270 HydrophobicContact CB-CB 4.39Å; V260-A270 PolarHBondContact N-O 3.01Å; V260-A270 PolarHBondContact O-N 2.78Å; V260-W284 HydrophobicContact CG1-CH2 3.9Å; V260-W284 HydrophobicContact CG1-CZ2 4.3Å; V260-W284 HydrophobicContact CG2-CH2 4.22Å; V260-L311 HydrophobicContact CG2-CD2 4.44Å; V260-V325 HydrophobicContact CB-CG1 3.93Å; V260-V325 HydrophobicContact CG1-CG1 3.83Å; V260-V325 HydrophobicContact CG2-CG1 3.72Å; V260-V325 HydrophobicContact CG2-CG2 4.05Å
261	W	95.9	Very high	94.3	Very high	7 Å²	7	41.4 Å²	41.4	3%	0.027	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	142.1	-174.4	-47.6	84.1	0	0	0	110.5	I216 F230 H233 L248 I249 S251 R259 E267 C268	I216-W261 HydrophobicContact CD1-CZ2 4.33Å; F230-W261 HydrophobicContact CB-CD2 4.47Å; F230-W261 HydrophobicContact CB-CE3 4.21Å; F230-W261 HydrophobicContact CB-CZ3 4.32Å; F230-W261 HydrophobicContact CD1-CB 4.24Å; F230-W261 HydrophobicContact CD1-CD2 4.41Å; F230-W261 HydrophobicContact CD1-CE3 4.15Å; F230-W261 HydrophobicContact CD1-CG 4.47Å; F230-W261 HydrophobicContact CE1-CB 4.35Å; H233-W261 AromaticContact CD2-CZ2 3.96Å; L248-W261 WeakPolarHBondContact CA-O 3.33Å; I249-W261 PolarHBondContact N-O 3.34Å; I249-W261 PolarHBondContact O-N 2.93Å; S251-W261 PolarHBondContact OG-NE1 3.24Å; R259-W261 HydrophobicContact CB-CZ2 3.84Å; R259-W261 HydrophobicContact CG-CZ2 4.36Å; W261-E267 WeakPolarHBondContact CA-O 3.34Å; W261-C268 HydrophobicContact CE3-CB 4.05Å; W261-C268 HydrophobicContact CZ3-CB 4.08Å
262	V	95.5	Very high	94.1	Very high	40 Å²	40	41.5 Å²	41.5	24%	0.242	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	120.7	167.9	177.9	0	0	0	0	108.6	L248 A264 K266 E267 K269	L248-V262 HydrophobicContact CD2-CB 4.46Å; L248-V262 HydrophobicContact CD2-CG2 3.8Å; V262-A264 VanDerWaalsContact C-N 3.31Å; V262-A264 HydrophobicContact CG1-CB 4.34Å; V262-A264 PolarHBondContact O-N 2.91Å; V262-K266 WeakPolarHBondContact O-CA 3.35Å; V262-K266 PolarHBondContact O-N 2.77Å; V262-E267 PolarHBondContact N-O 2.87Å; V262-K269 HydrophobicContact CG2-CB 4.1Å
263	V	92.7	Very high	93.8	Very high	21 Å²	21	48.2 Å²	48.2	13%	0.127	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-40.4	-175.2	171.3	0	0	0	0	111.8	M218 K228 T247 I249	M218-V263 HydrophobicContact CE-CB 4.42Å; M218-V263 HydrophobicContact CE-CG1 3.53Å; M218-V263 HydrophobicContact CE-CG2 4.16Å; M218-V263 HydrophobicContact SD-CG1 4.07Å; K228-V263 PolarHBondContact NZ-O 2.81Å; T247-V263 WeakPolarHBondContact O-CB 3.28Å; T247-V263 WeakPolarHBondContact O-CG2 3.46Å; T247-V263 PolarHBondContact O-N 2.95Å; I249-V263 HydrophobicContact CD1-CG2 3.5Å; I249-V263 VanDerWaalsContact CD1-CG2 3.5Å; I249-V263 HydrophobicContact CG1-CG2 3.6Å
264	A	92.1	Very high	93.6	Very high	74 Å²	74	53.9 Å²	53.9	61%	0.612	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-55.8	-177.4	0	0	0	0	0	111.9	K228 V262	K228-A264 PolarHBondContact NZ-O 2.91Å; V262-A264 VanDerWaalsContact C-N 3.31Å; V262-A264 HydrophobicContact CG1-CB 4.34Å; V262-A264 PolarHBondContact O-N 2.91Å
265	T	91.6	Very high	93.5	Very high	77 Å²	77	52.5 Å²	52.5	47%	0.472	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-15.1	-171.1	60.4	0	0	0	0	114.5	E267	T265-E267 PolarHBondContact O-N 2.76Å; T265-E267 PolarHBondContact OG1-N 3.39Å; T265-E267 PolarHBondContact OG1-OE2 2.78Å
266	K	91.3	Very high	93.4	Very high	92 Å²	92	59 Å²	59	40%	0.4	30%	0.295	S	S	.	.			trans	66.6	9.7	-171.5	-49.4	173.7	-176.3	178	0	114.8	K228 F230 V262	K228-K266 HydrophobicContact CB-CD 4.44Å; K228-K266 HydrophobicContact CD-CD 4.4Å; K228-K266 HydrophobicContact CD-CG 4.05Å; K228-K266 VanDerWaalsContact CG-CE 3.43Å; F230-K266 HydrophobicContact CD1-CB 3.89Å; F230-K266 HydrophobicContact CD1-CG 4.22Å; F230-K266 HydrophobicContact CE1-CB 3.93Å; F230-K266 HydrophobicContact CE1-CG 3.92Å; F230-K266 HydrophobicContact CZ-CG 4.49Å; V262-K266 WeakPolarHBondContact O-CA 3.35Å; V262-K266 PolarHBondContact O-N 2.77Å
267	E	92.2	Very high	93.5	Very high	131 Å²	131	59 Å²	59	61%	0.612	29%	0.294	S	S	*	.			trans	-81.3	145.9	-179.7	-66.1	172.3	161.6	0	0	111.2	W261 V262 T265 K269	W261-E267 WeakPolarHBondContact CA-O 3.34Å; V262-E267 PolarHBondContact N-O 2.87Å; T265-E267 PolarHBondContact O-N 2.76Å; T265-E267 PolarHBondContact OG1-N 3.39Å; T265-E267 PolarHBondContact OG1-OE2 2.78Å; E267-K269 PolarHBondContact O-N 2.85Å
268	C	92.3	Very high	93.5	Very high	50 Å²	50	59.2 Å²	59.2	34%	0.338	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	108	172	-175.2	0	0	0	0	108.5	V260 W261 A270	V260-C268 CarbonylContact O-C 3.51Å; V260-C268 WeakPolarHBondContact O-CA 3.13Å; W261-C268 HydrophobicContact CE3-CB 4.05Å; W261-C268 HydrophobicContact CZ3-CB 4.08Å; C268-A270 PolarHBondContact SG-O 2.76Å; C268-A270 VanDerWaalsContact SG-O 3.35Å
269	K	91.3	Very high	93.5	Very high	112 Å²	112	59.2 Å²	59.2	49%	0.487	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	-43.1	178.4	179	178	177.5	-179.4	0	111.9	L248 V260 V262 E267	L248-K269 HydrophobicContact CD2-CD 4.34Å; V260-K269 PolarHBondContact O-N 3.21Å; V262-K269 HydrophobicContact CG2-CB 4.1Å; E267-K269 PolarHBondContact O-N 2.85Å
270	A	91.5	Very high	93.5	Very high	12 Å²	12	59 Å²	59	10%	0.099	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	139.1	-176.3	0	0	0	0	0	110.5	R259 V260 C268 V325	R259-A270 WeakPolarHBondContact CA-O 3.37Å; V260-A270 HydrophobicContact CB-CB 4.39Å; V260-A270 PolarHBondContact N-O 3.01Å; V260-A270 PolarHBondContact O-N 2.78Å; C268-A270 PolarHBondContact SG-O 2.76Å; C268-A270 VanDerWaalsContact SG-O 3.35Å; A270-V325 HydrophobicContact CB-CG1 4.33Å
271	E	93.9	Very high	93.5	Very high	69 Å²	69	59.1 Å²	59.1	32%	0.322	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	110.7	171.6	-174.2	172.9	-164.1	0	0	108.4	R259 R273	R259-E271 HydrophobicContact CG-CB 4.46Å; R259-E271 HydrophobicContact CG-CG 4.06Å; R259-E271 IonicContact CZ-OE1 3.67Å; R259-E271 IonicContact NE-OE1 3.4Å; R259-E271 PolarHBondContact NE-OE1 2.89Å; R259-E271 IonicContact NH2-OE1 3.24Å; R259-E271 PolarHBondContact NH2-OE1 2.86Å; R259-E271 IonicContact NH2-OE2 3.77Å; E271-R273 VanDerWaalsContact CD-CZ 3.48Å; E271-R273 HydrophobicContact CG-CG 4.04Å; E271-R273 IonicContact OE1-CZ 3.85Å; E271-R273 IonicContact OE1-NE 3.96Å; E271-R273 PolarHBondContact OE1-NE 3.15Å; E271-R273 IonicContact OE1-NH2 2.96Å; E271-R273 PolarHBondContact OE1-NH2 3.41Å; E271-R273 IonicContact OE2-CZ 2.67Å; E271-R273 IonicContact OE2-NE 2.65Å; E271-R273 IonicContact OE2-NH2 3.07Å; E271-R273 PolarHBondContact OE2-NH2 2.81Å
272	L	93.3	Very high	93.5	Very high	2 Å²	2	59 Å²	59	1%	0.01	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	115.3	-173.4	-53.3	172.7	0	0	0	108.4	V258 L311 W323 G328	V258-L272 HydrophobicContact CB-CB 4.14Å; V258-L272 HydrophobicContact CB-CD1 4.21Å; V258-L272 HydrophobicContact CG1-CD1 4.06Å; V258-L272 PolarHBondContact N-O 3.05Å; V258-L272 VanDerWaalsContact N-O 3.08Å; V258-L272 PolarHBondContact O-N 2.84Å; L272-L311 HydrophobicContact CD1-CD2 4.3Å; L272-W323 HydrophobicContact CB-CD2 4.15Å; L272-W323 HydrophobicContact CB-CE3 3.84Å; L272-W323 HydrophobicContact CB-CH2 3.92Å; L272-W323 HydrophobicContact CB-CZ2 4.32Å; L272-W323 HydrophobicContact CB-CZ3 3.72Å; L272-W323 HydrophobicContact CD1-CB 3.81Å; L272-W323 HydrophobicContact CD1-CD2 3.83Å; L272-W323 HydrophobicContact CD1-CE3 4.08Å; L272-W323 HydrophobicContact CD1-CG 3.72Å; L272-W323 HydrophobicContact CD2-CD2 4.45Å; L272-W323 HydrophobicContact CD2-CE3 3.87Å; L272-W323 HydrophobicContact CD2-CZ3 4.33Å; L272-W323 HydrophobicContact CG-CD2 4.36Å; L272-W323 HydrophobicContact CG-CE3 4.14Å; L272-W323 HydrophobicContact CG-CZ3 4.48Å; L272-G328 WeakPolarHBondContact CD2-O 3.48Å
273	R	89.3	Confident	93.5	Very high	141 Å²	141	57.7 Å²	57.7	53%	0.532	29%	0.29	S	S	.	.			trans	-130.4	85.3	-174	-60.9	-167.5	179.7	163.7	4.5	111.2	T257 E271	T257-R273 HydrophobicContact CG2-CG 3.79Å; E271-R273 VanDerWaalsContact CD-CZ 3.48Å; E271-R273 HydrophobicContact CG-CG 4.04Å; E271-R273 IonicContact OE1-CZ 3.85Å; E271-R273 IonicContact OE1-NE 3.96Å; E271-R273 PolarHBondContact OE1-NE 3.15Å; E271-R273 IonicContact OE1-NH2 2.96Å; E271-R273 PolarHBondContact OE1-NH2 3.41Å; E271-R273 IonicContact OE2-CZ 2.67Å; E271-R273 IonicContact OE2-NE 2.65Å; E271-R273 IonicContact OE2-NH2 3.07Å; E271-R273 PolarHBondContact OE2-NH2 2.81Å
274	E	92.1	Very high	93.7	Very high	120 Å²	120	57.7 Å²	57.7	56%	0.561	29%	0.287	S	S	*	.			trans	-140.9	-2.3	172.8	-63.4	-75.9	150.6	0	0	112.6	K321 W323 C330	E274-K321 HydrophobicContact CB-CD 4.15Å; E274-K321 WeakPolarHBondContact O-CE 3.4Å; E274-K321 PolarHBondContact O-NZ 3.46Å; E274-W323 HydrophobicContact CB-CH2 3.46Å; E274-W323 VanDerWaalsContact CB-CH2 3.46Å; E274-W323 HydrophobicContact CB-CZ2 4.37Å; E274-W323 HydrophobicContact CB-CZ3 4.03Å; E274-W323 HydrophobicContact CG-CH2 3.72Å; E274-W323 HydrophobicContact CG-CZ3 3.74Å; E274-C330 HydrophobicContact CG-CB 4.26Å
275	H	94	Very high	93.7	Very high	12 Å²	12	54.4 Å²	54.4	6%	0.056	26%	0.26	C	S	.	.			trans	-79.6	140.6	175.5	-82.5	-65.8	0	0	0	110.1	H277 V279 S313 S315 D317 W323	H275-H277 VanDerWaalsContact C-N 3.32Å; H275-V279 HydrophobicContact CB-CG2 3.93Å; H275-S313 PolarHBondContact NE2-OG 3.45Å; H275-S315 VanDerWaalsContact CE1-CB 3.49Å; H275-S315 WeakPolarHBondContact CE1-CB 3.18Å; H275-S315 WeakPolarHBondContact ND1-CB 3.39Å; H275-D317 IonicContact CE1-OD2 3.4Å; H275-D317 IonicContact CG-OD2 3.36Å; H275-D317 IonicContact ND1-OD1 3.12Å; H275-D317 IonicContact ND1-OD2 3.42Å; H275-D317 PolarHBondContact ND1-OD2 2.8Å; H275-W323 AromaticContact CD2-CZ2 3.91Å
276	E	93.2	Very high	93.7	Very high	165 Å²	165	51.8 Å²	51.8	77%	0.771	24%	0.244	S	C	*	.	S	Bend	trans	-86.6	-11.3	-180	-62.6	-178.2	173.7	0	0	111.9	Q256 D317	Q256-E276 PolarHBondContact NE2-O 2.95Å; E276-D317 HydrophobicContact CB-CB 4.23Å; E276-D317 PolarHBondContact N-OD2 3.33Å
277	H	95.9	Very high	93.5	Very high	80 Å²	80	53.6 Å²	53.6	37%	0.37	25%	0.254	S	S	.	.	S	Bend	trans	-146.2	175.5	-178.1	-151	-77.5	0	0	0	111.8	H275 V279 S315 R316 D317	H275-H277 VanDerWaalsContact C-N 3.32Å; H277-V279 PolarHBondContact O-N 3.45Å; H277-S315 PolarHBondContact O-OG 3.46Å; H277-R316 HydrophobicContact CB-CB 4.13Å; H277-R316 VanDerWaalsContact ND1-CB 3.3Å; H277-R316 WeakPolarHBondContact ND1-CB 3.43Å; H277-D317 HydrophobicContact CB-CB 4.05Å
278	V	96.6	Very high	93.1	Very high	14 Å²	14	49.9 Å²	49.9	9%	0.085	24%	0.243	C	C	.	.			trans	-43.2	129	175	173.7	0	0	0	0	112.2	R238 N254 S315 R316	R238-V278 HydrophobicContact CG-CG1 4.43Å; N254-V278 HydrophobicContact CB-CG1 4.37Å; N254-V278 HydrophobicContact CB-CG2 4.11Å; N254-V278 WeakPolarHBondContact OD1-CG1 3.35Å; V278-S315 WeakPolarHBondContact O-CA 3.25Å; V278-S315 PolarHBondContact O-OG 2.92Å; V278-S315 VanDerWaalsContact O-OG 3.1Å; V278-R316 HydrophobicContact CB-CG 4.1Å; V278-R316 HydrophobicContact CG1-CG 4.47Å; V278-R316 PolarHBondContact O-N 2.89Å
279	V	97.1	Very high	92.9	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	121.6	174.3	-172.3	0	0	0	0	109.3	C252 S253 V258 H275 H277 G314	C252-V279 HydrophobicContact CB-CB 3.71Å; C252-V279 HydrophobicContact CB-CG1 3.48Å; C252-V279 VanDerWaalsContact CB-CG1 3.48Å; S253-V279 PolarHBondContact O-N 3.12Å; V258-V279 HydrophobicContact CG2-CB 4.35Å; V258-V279 HydrophobicContact CG2-CG1 3.79Å; V258-V279 HydrophobicContact CG2-CG2 4.18Å; H275-V279 HydrophobicContact CB-CG2 3.93Å; H277-V279 PolarHBondContact O-N 3.45Å; V279-G314 WeakPolarHBondContact CG1-O 3.36Å
280	E	95.8	Very high	92.7	Very high	20 Å²	20	43.8 Å²	43.8	9%	0.093	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	-40.8	-174.3	-72.8	-66.4	163.1	0	0	112.4	R238 G314 R316 V341	R238-E280 WeakPolarHBondContact CD-OE2 3.33Å; R238-E280 IonicContact NE-OE1 3.9Å; R238-E280 IonicContact NE-OE2 3.37Å; E280-G314 PolarHBondContact N-O 3.48Å; E280-R316 HydrophobicContact CG-CG 3.93Å; E280-R316 IonicContact OE1-CZ 2.84Å; E280-R316 IonicContact OE1-NE 3.6Å; E280-R316 PolarHBondContact OE1-NE 2.92Å; E280-R316 IonicContact OE1-NH2 2.91Å; E280-R316 PolarHBondContact OE1-NH2 2.83Å; E280-V341 WeakPolarHBondContact CB-O 3.23Å
281	C	95.4	Very high	92.5	Very high	2 Å²	2	47.3 Å²	47.3	1%	0.014	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	156.8	-172.3	57	0	0	0	0	112.7	M239 S313 G314 R342 I344	M239-C281 HydrophobicContact CE-CB 4.33Å; M239-C281 HydrophobicContact SD-CB 4.44Å; C281-S313 CarbonylContact O-C 3.57Å; C281-S313 VanDerWaalsContact O-CA 3.29Å; C281-S313 WeakPolarHBondContact O-CA 3.11Å; C281-G314 PolarHBondContact N-O 2.82Å; C281-G314 PolarHBondContact O-N 2.77Å; C281-R342 WeakPolarHBondContact CB-O 3.33Å; C281-I344 VanDerWaalsContact SG-CD1 3.56Å
282	I	96.9	Very high	92.1	Very high	4 Å²	4	45.5 Å²	45.5	2%	0.021	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	142.6	-175.9	-67.7	175.4	0	0	0	109.8	M239 A250 S251 C252 V258 L311 L312	M239-I282 HydrophobicContact CE-CB 3.92Å; M239-I282 WeakPolarHBondContact CE-O 3.36Å; A250-I282 HydrophobicContact CB-CD1 4.42Å; A250-I282 HydrophobicContact CB-CG2 3.97Å; S251-I282 WeakPolarHBondContact O-CD1 3.34Å; C252-I282 HydrophobicContact CB-CD1 3.37Å; C252-I282 HydrophobicContact CB-CG1 3.76Å; V258-I282 HydrophobicContact CG1-CD1 3.71Å; V258-I282 HydrophobicContact CG1-CG1 4.44Å; V258-I282 HydrophobicContact CG2-CD1 4.21Å; V258-I282 HydrophobicContact CG2-CG1 4.46Å; I282-L311 HydrophobicContact CG2-CD1 3.34Å; I282-L311 HydrophobicContact CG2-CD2 3.93Å; I282-L311 HydrophobicContact CG2-CG 3.73Å; I282-L312 CarbonylContact C-O 3.56Å; I282-L312 WeakPolarHBondContact CA-O 3.25Å
283	S	96.1	Very high	91.8	Very high	14 Å²	14	45.4 Å²	45.4	10%	0.098	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	131	170.7	-168.4	0	0	0	0	111.4	L312 I344	S283-L312 PolarHBondContact N-O 3.38Å; S283-L312 PolarHBondContact O-N 3.09Å; S283-I344 WeakPolarHBondContact CB-O 3.46Å
284	W	95.4	Very high	91.6	Very high	21 Å²	21	40.7 Å²	40.7	8%	0.08	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	140.1	173	-72.2	101.6	0	0	0	110.4	R241 P242 N243 L248 A250 V260 P309 L311 V325 F346	R241-W284 PolarHBondContact O-NE1 3.38Å; P242-W284 PolarHBondContact O-NE1 2.85Å; N243-W284 HydrophobicContact CB-CD2 4.17Å; N243-W284 HydrophobicContact CB-CZ2 4.12Å; L248-W284 HydrophobicContact CB-CH2 4.32Å; L248-W284 HydrophobicContact CB-CZ2 4.33Å; L248-W284 HydrophobicContact CD1-CH2 4.45Å; A250-W284 HydrophobicContact CB-CH2 4.31Å; A250-W284 HydrophobicContact CB-CZ2 3.44Å; A250-W284 VanDerWaalsContact CB-CZ2 3.44Å; V260-W284 HydrophobicContact CG1-CH2 3.9Å; V260-W284 HydrophobicContact CG1-CZ2 4.3Å; V260-W284 HydrophobicContact CG2-CH2 4.22Å; W284-P309 HydrophobicContact CE3-CB 4.13Å; W284-P309 HydrophobicContact CZ3-CB 3.7Å; W284-P309 HydrophobicContact CZ3-CG 3.91Å; W284-L311 HydrophobicContact CD2-CD1 3.49Å; W284-L311 VanDerWaalsContact CD2-CD1 3.49Å; W284-L311 HydrophobicContact CE3-CD1 3.69Å; W284-L311 HydrophobicContact CG-CD1 3.88Å; W284-L311 HydrophobicContact CH2-CD1 4.36Å; W284-L311 HydrophobicContact CZ2-CD1 4.22Å; W284-L311 HydrophobicContact CZ3-CD1 4.1Å; W284-V325 HydrophobicContact CH2-CG2 4.18Å; W284-V325 HydrophobicContact CZ3-CG2 3.88Å; W284-F346 WeakPolarHBondContact O-CD2 3.43Å
285	A	93.4	Very high	91.2	Very high	4 Å²	4	39.6 Å²	39.6	3%	0.033	21%	0.209	C	C	.	.	P	Polyproline II helix	trans	-68.4	130.7	172.4	0	0	0	0	0	110.4	A289 I293 F310 F346	A285-A289 HydrophobicContact CB-CB 4.41Å; A285-I293 HydrophobicContact CB-CD1 3.85Å; A285-F310 HydrophobicContact CB-CB 3.73Å; A285-F310 PolarHBondContact N-O 3.05Å; A285-F346 HydrophobicContact CB-CD2 4.25Å; A285-F346 HydrophobicContact CB-CE1 4.29Å; A285-F346 HydrophobicContact CB-CE2 3.63Å; A285-F346 HydrophobicContact CB-CZ 3.65Å
286	P	90.6	Very high	90.7	Very high	22 Å²	22	39.8 Å²	39.8	14%	0.143	21%	0.213	C	C	.	.	P	Polyproline II helix	trans	-71.4	157.5	168.2	31	-34.2	0	0	0	110.3	S288 A289 H290 F346	P286-S288 WeakPolarHBondContact CG-OG 3.34Å; P286-S288 PolarHBondContact O-N 3Å; P286-A289 HydrophobicContact CG-CB 4.06Å; P286-A289 WeakPolarHBondContact O-CB 3.5Å; P286-A289 PolarHBondContact O-N 2.85Å; P286-H290 PolarHBondContact O-CD2 3.3Å; P286-F346 VanDerWaalsContact CD-CB 3.48Å; P286-F346 HydrophobicContact CG-CB 3.99Å
287	E	86.7	Confident	90.1	Very high	130 Å²	130	34 Å²	34	61%	0.607	19%	0.188	S	C	*	.	G	3₁₀ helix	trans	-53.4	-31.2	175.7	-64.1	-171.5	152.4	0	0	112.6	A289 H290	E287-A289 PolarHBondContact O-N 3.35Å; E287-H290 PolarHBondContact O-N 3.19Å
288	S	85.3	Confident	88.8	Confident	54 Å²	54	33.2 Å²	33.2	38%	0.378	20%	0.202	S	C	.	.	G	3₁₀ helix	trans	-63.4	-24.3	176.3	61.7	0	0	0	0	114.1	P286 P348	P286-S288 WeakPolarHBondContact CG-OG 3.34Å; P286-S288 PolarHBondContact O-N 3Å; S288-P348 PolarHBondContact OG-O 3.42Å
289	A	87.1	Confident	87.2	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-87.5	-19.8	179.7	0	0	0	0	0	113	A285 P286 E287 T292 I293 F346 Y367	A285-A289 HydrophobicContact CB-CB 4.41Å; P286-A289 HydrophobicContact CG-CB 4.06Å; P286-A289 WeakPolarHBondContact O-CB 3.5Å; P286-A289 PolarHBondContact O-N 2.85Å; E287-A289 PolarHBondContact O-N 3.35Å; A289-T292 PolarHBondContact O-N 2.99Å; A289-I293 HydrophobicContact CB-CD1 4.04Å; A289-I293 WeakPolarHBondContact O-CG1 3.15Å; A289-I293 PolarHBondContact O-N 2.79Å; A289-F346 HydrophobicContact CB-CD1 3.89Å; A289-F346 HydrophobicContact CB-CE1 4.08Å; A289-Y367 PolarHBondContact O-OH 3.11Å
290	H	88.2	Confident	85.2	Confident	33 Å²	33	44.2 Å²	44.2	15%	0.153	26%	0.26	C	S	.	.	H	α-helix	trans	-56.2	-46.5	-173.2	-68.3	-171.2	0	0	0	113.9	P286 E287 T292 I293 L294 P307 F310	P286-H290 PolarHBondContact O-CD2 3.3Å; E287-H290 PolarHBondContact O-N 3.19Å; H290-T292 VanDerWaalsContact C-N 3.33Å; H290-T292 PolarHBondContact O-N 2.87Å; H290-I293 PolarHBondContact O-N 3.34Å; H290-L294 WeakPolarHBondContact O-CG 3.41Å; H290-L294 PolarHBondContact O-N 2.8Å; H290-P307 HydrophobicContact CB-CG 4.5Å; H290-P307 PolarHBondContact CE1-O 2.8Å; H290-P307 PolarHBondContact ND1-O 3.43Å; H290-F310 HydrophobicContact CB-CE2 4.4Å; H290-F310 AromaticContact CD2-CD2 3.74Å
291	P	86.6	Confident	83.1	Confident	86 Å²	86	46.8 Å²	46.8	56%	0.558	28%	0.28	S	S	*	.	H	α-helix	trans	-62	-41.2	-179.9	-22.2	34.3	0	0	0	112.5	L294 D295	P291-L294 PolarHBondContact O-N 3.15Å; P291-D295 WeakPolarHBondContact O-CB 3.48Å; P291-D295 PolarHBondContact O-N 3.4Å
292	T	85.4	Confident	80.8	Confident	32 Å²	32	55.9 Å²	55.9	20%	0.196	32%	0.32	C	S	.	.	H	α-helix	trans	-69.5	-35.6	-179.5	-50.7	0	0	0	0	111.5	A289 H290 A296 Y367 K368	A289-T292 PolarHBondContact O-N 2.99Å; H290-T292 VanDerWaalsContact C-N 3.33Å; H290-T292 PolarHBondContact O-N 2.87Å; T292-A296 WeakPolarHBondContact O-CB 3.34Å; T292-A296 PolarHBondContact O-N 3.43Å; T292-Y367 VanDerWaalsContact CB-OH 3.25Å; T292-Y367 WeakPolarHBondContact CB-OH 3.47Å; T292-Y367 HydrophobicContact CG2-CE1 4.5Å; T292-Y367 HydrophobicContact CG2-CE2 3.77Å; T292-Y367 WeakPolarHBondContact CG2-OH 3.45Å; T292-K368 HydrophobicContact CG2-CB 4.35Å
293	I	86.6	Confident	78.4	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-64.9	-45	174.2	-68.2	168.7	0	0	0	111.1	A285 A289 H290 A296 T297 F310 M322 L331 F346 Y367	A285-I293 HydrophobicContact CB-CD1 3.85Å; A289-I293 HydrophobicContact CB-CD1 4.04Å; A289-I293 WeakPolarHBondContact O-CG1 3.15Å; A289-I293 PolarHBondContact O-N 2.79Å; H290-I293 PolarHBondContact O-N 3.34Å; I293-A296 PolarHBondContact O-N 2.93Å; I293-T297 HydrophobicContact CG2-CG2 4.46Å; I293-T297 WeakPolarHBondContact O-CB 3.15Å; I293-T297 VanDerWaalsContact O-CG2 3.28Å; I293-T297 WeakPolarHBondContact O-CG2 3.43Å; I293-T297 PolarHBondContact O-N 3.37Å; I293-T297 PolarHBondContact O-OG1 3.35Å; I293-F310 HydrophobicContact CB-CD2 4.32Å; I293-F310 HydrophobicContact CB-CE2 4.27Å; I293-F310 HydrophobicContact CD1-CB 3.92Å; I293-F310 HydrophobicContact CD1-CD2 3.74Å; I293-F310 HydrophobicContact CD1-CE2 4.49Å; I293-F310 HydrophobicContact CD1-CG 3.96Å; I293-F310 HydrophobicContact CG2-CD1 3.93Å; I293-F310 HydrophobicContact CG2-CD2 3.96Å; I293-F310 HydrophobicContact CG2-CE1 3.85Å; I293-F310 HydrophobicContact CG2-CE2 3.88Å; I293-F310 HydrophobicContact CG2-CG 3.97Å; I293-F310 HydrophobicContact CG2-CZ 3.82Å; I293-M322 HydrophobicContact CB-CE 4.36Å; I293-M322 HydrophobicContact CD1-SD 4Å; I293-M322 HydrophobicContact CG1-CE 4.14Å; I293-M322 HydrophobicContact CG1-SD 3.86Å; I293-M322 HydrophobicContact CG2-CE 3.63Å; I293-M322 HydrophobicContact CG2-SD 4.23Å; I293-L331 HydrophobicContact CG2-CD1 4.09Å; I293-F346 HydrophobicContact CD1-CE1 4.06Å; I293-F346 HydrophobicContact CD1-CZ 4.14Å; I293-Y367 HydrophobicContact CB-CE2 4.44Å; I293-Y367 HydrophobicContact CG1-CE2 3.64Å
294	L	85.4	Confident	76.1	Confident	42 Å²	42	70.9 Å²	70.9	22%	0.22	40%	0.4	C	S	.	.	H	α-helix	trans	-62.5	-45.9	178.3	-69.4	170	0	0	0	111.4	H290 P291 A296 T297 G298 P307 F310	H290-L294 WeakPolarHBondContact O-CG 3.41Å; H290-L294 PolarHBondContact O-N 2.8Å; P291-L294 PolarHBondContact O-N 3.15Å; L294-A296 PolarHBondContact O-N 3.38Å; L294-T297 PolarHBondContact O-N 3.15Å; L294-T297 PolarHBondContact O-OG1 3.08Å; L294-G298 PolarHBondContact O-N 3.34Å; L294-P307 HydrophobicContact CD1-CB 3.69Å; L294-P307 HydrophobicContact CD1-CG 4.01Å; L294-P307 HydrophobicContact CD2-CB 4.09Å; L294-P307 HydrophobicContact CG-CB 4.25Å; L294-F310 HydrophobicContact CD2-CZ 4.12Å
295	D	84.3	Confident	74.2	Confident	96 Å²	96	72 Å²	72	51%	0.513	42%	0.419	S	S	.	.	H	α-helix	trans	-61.4	-42.9	176.4	-172.4	39	0	0	0	111.8	P291 T297 K368	P291-D295 WeakPolarHBondContact O-CB 3.48Å; P291-D295 PolarHBondContact O-N 3.4Å; D295-T297 VanDerWaalsContact C-N 3.29Å; D295-T297 PolarHBondContact O-N 3.04Å; D295-K368 WeakPolarHBondContact OD2-CE 3.31Å; D295-K368 IonicContact OD2-NZ 3.12Å; D295-K368 PolarHBondContact OD2-NZ 3.28Å
296	A	82.3	Confident	72.9	Confident	16 Å²	16	81 Å²	81	13%	0.132	46%	0.457	C	S	.	.	H	α-helix	trans	-68.3	-25.3	179	0	0	0	0	0	114.3	T292 I293 L294 M332 Y367 K368	T292-A296 WeakPolarHBondContact O-CB 3.34Å; T292-A296 PolarHBondContact O-N 3.43Å; I293-A296 PolarHBondContact O-N 2.93Å; L294-A296 PolarHBondContact O-N 3.38Å; A296-M332 HydrophobicContact CB-CE 4.01Å; A296-Y367 HydrophobicContact CB-CD2 4.22Å; A296-Y367 HydrophobicContact CB-CE2 4.48Å; A296-K368 HydrophobicContact CB-CB 4.36Å
297	T	80.1	Confident	72	Confident	43 Å²	43	82.4 Å²	82.4	26%	0.264	47%	0.466	S	S	.	.	H	α-helix	trans	-101.5	-10.2	-175.7	54.8	0	0	0	0	113	I293 L294 D295 S299 M322 L331 M332	I293-T297 HydrophobicContact CG2-CG2 4.46Å; I293-T297 WeakPolarHBondContact O-CB 3.15Å; I293-T297 VanDerWaalsContact O-CG2 3.28Å; I293-T297 WeakPolarHBondContact O-CG2 3.43Å; I293-T297 PolarHBondContact O-N 3.37Å; I293-T297 PolarHBondContact O-OG1 3.35Å; L294-T297 PolarHBondContact O-N 3.15Å; L294-T297 PolarHBondContact O-OG1 3.08Å; D295-T297 VanDerWaalsContact C-N 3.29Å; D295-T297 PolarHBondContact O-N 3.04Å; T297-S299 PolarHBondContact O-N 3.19Å; T297-M322 HydrophobicContact CG2-CE 4.14Å; T297-L331 HydrophobicContact CG2-CB 3.84Å; T297-L331 HydrophobicContact CG2-CD1 4.13Å; T297-L331 HydrophobicContact CG2-CD2 4.29Å; T297-L331 HydrophobicContact CG2-CG 4.32Å; T297-M332 HydrophobicContact CG2-CE 3.89Å
298	G	70.2	Confident	71.4	Confident	64 Å²	64	76.9 Å²	76.9	66%	0.66	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.5	17.6	-177	0	0	0	0	0	113.2	L294 E300	L294-G298 PolarHBondContact O-N 3.34Å; G298-E300 PolarHBondContact O-N 3.1Å; G298-E300 VanDerWaalsContact O-N 3.17Å
299	S	62.2	Low	71.6	Confident	66 Å²	66	75.5 Å²	75.5	46%	0.462	43%	0.434	S	S	.	.			trans	-78.6	101.1	-179.2	-158.8	0	0	0	0	108.7	T297 S301	T297-S299 PolarHBondContact O-N 3.19Å; S299-S301 PolarHBondContact O-N 3.5Å; S299-S301 VanDerWaalsContact O-N 3.16Å
300	E	54.3	Low	71.9	Confident	179 Å²	179	75.9 Å²	75.9	84%	0.836	44%	0.436	S	S	*	.			trans	-59.3	119.8	167.8	-72.1	-164.7	163.3	0	0	108.2	G298 K302	G298-E300 PolarHBondContact O-N 3.1Å; G298-E300 VanDerWaalsContact O-N 3.17Å; E300-K302 PolarHBondContact O-N 2.96Å
301	S	52.5	Low	72.3	Confident	74 Å²	74	74.3 Å²	74.3	52%	0.517	43%	0.428	S	S	.	.			trans	-53.3	103.7	170	172	0	0	0	0	108.2	S299 K303	S299-S301 PolarHBondContact O-N 3.5Å; S299-S301 VanDerWaalsContact O-N 3.16Å; S301-K303 PolarHBondContact O-N 2.99Å
302	K	48.2	Very low	72.8	Confident	193 Å²	193	70.2 Å²	70.2	84%	0.839	40%	0.402	S	S	*	.			trans	-58.2	115.4	165.7	-82.3	-174	177.7	177.3	0	106.6	E300 S304	E300-K302 PolarHBondContact O-N 2.96Å; K302-S304 PolarHBondContact O-N 3.24Å
303	K	45	Very low	73.3	Confident	199 Å²	199	68.7 Å²	68.7	87%	0.865	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-34.4	107.1	176.4	-69.3	173.6	175.5	175.2	0	111.2	S301	S301-K303 PolarHBondContact O-N 2.99Å
304	S	47.6	Very low	73.8	Confident	134 Å²	134	68.7 Å²	68.7	94%	0.937	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	133.1	-4	156.1	69.6	0	0	0	0	117.1	K302	K302-S304 PolarHBondContact O-N 3.24Å
305	G	56.5	Low	74.4	Confident	46 Å²	46	66.7 Å²	66.7	47%	0.474	38%	0.382	S	S	.	.	S	Bend	trans	-107.6	142.7	176	0	0	0	0	0	114
306	K	65.6	Low	75	Confident	192 Å²	192	64.3 Å²	64.3	84%	0.835	37%	0.365	S	S	*	.			trans	-59.9	130.6	161.4	-73.4	-171.9	177.5	-172.5	0	108
307	P	72.1	Confident	75.6	Confident	51 Å²	51	64.9 Å²	64.9	33%	0.331	37%	0.366	S	S	.	.			trans	-64.7	139.6	179.8	26.4	-33.7	0	0	0	111.2	H290 L294 F310	H290-P307 HydrophobicContact CB-CG 4.5Å; H290-P307 PolarHBondContact CE1-O 2.8Å; H290-P307 PolarHBondContact ND1-O 3.43Å; L294-P307 HydrophobicContact CD1-CB 3.69Å; L294-P307 HydrophobicContact CD1-CG 4.01Å; L294-P307 HydrophobicContact CD2-CB 4.09Å; L294-P307 HydrophobicContact CG-CB 4.25Å; P307-F310 HydrophobicContact CB-CE2 4.44Å
308	G	74.4	Confident	76.3	Confident	15 Å²	15	67.3 Å²	67.3	16%	0.155	37%	0.373	C	S	.	.			trans	90.4	-163.7	-178.6	0	0	0	0	0	114
309	P	90	Very high	77.5	Confident	25 Å²	25	65.2 Å²	65.2	16%	0.162	35%	0.348	C	S	.	.			cis	-80.4	143.5	11.2	31.5	-32.7	0	0	0	112.7	L248 W284 V325	L248-P309 HydrophobicContact CD1-CG 3.94Å; W284-P309 HydrophobicContact CE3-CB 4.13Å; W284-P309 HydrophobicContact CZ3-CB 3.7Å; W284-P309 HydrophobicContact CZ3-CG 3.91Å; P309-V325 HydrophobicContact CG-CB 4.1Å; P309-V325 HydrophobicContact CG-CG1 4.36Å; P309-V325 VanDerWaalsContact O-CB 3.27Å; P309-V325 WeakPolarHBondContact O-CB 3.28Å; P309-V325 WeakPolarHBondContact O-CG2 3.31Å; P309-V325 PolarHBondContact O-N 3.02Å
310	F	93.4	Very high	79.2	Confident	8 Å²	8	62.1 Å²	62.1	4%	0.035	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	149.8	178.5	-54.4	-71.6	0	0	0	111.7	A285 H290 I293 L294 P307 W323 D324 L331	A285-F310 HydrophobicContact CB-CB 3.73Å; A285-F310 PolarHBondContact N-O 3.05Å; H290-F310 HydrophobicContact CB-CE2 4.4Å; H290-F310 AromaticContact CD2-CD2 3.74Å; I293-F310 HydrophobicContact CB-CD2 4.32Å; I293-F310 HydrophobicContact CB-CE2 4.27Å; I293-F310 HydrophobicContact CD1-CB 3.92Å; I293-F310 HydrophobicContact CD1-CD2 3.74Å; I293-F310 HydrophobicContact CD1-CE2 4.49Å; I293-F310 HydrophobicContact CD1-CG 3.96Å; I293-F310 HydrophobicContact CG2-CD1 3.93Å; I293-F310 HydrophobicContact CG2-CD2 3.96Å; I293-F310 HydrophobicContact CG2-CE1 3.85Å; I293-F310 HydrophobicContact CG2-CE2 3.88Å; I293-F310 HydrophobicContact CG2-CG 3.97Å; I293-F310 HydrophobicContact CG2-CZ 3.82Å; L294-F310 HydrophobicContact CD2-CZ 4.12Å; P307-F310 HydrophobicContact CB-CE2 4.44Å; F310-W323 VanDerWaalsContact CA-O 3.27Å; F310-W323 WeakPolarHBondContact CA-O 3.21Å; F310-D324 HydrophobicContact CD1-CB 4.04Å; F310-D324 HydrophobicContact CE1-CB 4.02Å; F310-L331 HydrophobicContact CD1-CD1 3.61Å; F310-L331 HydrophobicContact CE1-CD1 3.74Å
311	L	95.1	Very high	81.1	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	142.2	-175.8	-165.3	71.3	0	0	0	110.4	A250 V258 V260 L272 I282 W284 M322 W323 V325	A250-L311 HydrophobicContact CB-CD1 3.86Å; A250-L311 HydrophobicContact CB-CD2 3.86Å; V258-L311 HydrophobicContact CG1-CD2 3.51Å; V260-L311 HydrophobicContact CG2-CD2 4.44Å; L272-L311 HydrophobicContact CD1-CD2 4.3Å; I282-L311 HydrophobicContact CG2-CD1 3.34Å; I282-L311 HydrophobicContact CG2-CD2 3.93Å; I282-L311 HydrophobicContact CG2-CG 3.73Å; W284-L311 HydrophobicContact CD2-CD1 3.49Å; W284-L311 VanDerWaalsContact CD2-CD1 3.49Å; W284-L311 HydrophobicContact CE3-CD1 3.69Å; W284-L311 HydrophobicContact CG-CD1 3.88Å; W284-L311 HydrophobicContact CH2-CD1 4.36Å; W284-L311 HydrophobicContact CZ2-CD1 4.22Å; W284-L311 HydrophobicContact CZ3-CD1 4.1Å; L311-M322 CarbonylContact O-C 3.56Å; L311-M322 WeakPolarHBondContact O-CA 3.44Å; L311-W323 HydrophobicContact CB-CB 4.41Å; L311-W323 PolarHBondContact N-O 3.41Å; L311-W323 PolarHBondContact O-N 3.43Å; L311-V325 HydrophobicContact CB-CG2 3.94Å
312	L	96.9	Very high	83.2	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	146.8	164.6	-66.5	171.8	0	0	0	110.1	I282 S283 I320 K321 M322 I344 F346 I353	I282-L312 CarbonylContact C-O 3.56Å; I282-L312 WeakPolarHBondContact CA-O 3.25Å; S283-L312 PolarHBondContact N-O 3.38Å; S283-L312 PolarHBondContact O-N 3.09Å; L312-I320 HydrophobicContact CD2-CG2 4.31Å; L312-K321 CarbonylContact C-O 3.52Å; L312-K321 WeakPolarHBondContact CA-O 3.46Å; L312-M322 HydrophobicContact CD2-CB 3.61Å; L312-M322 HydrophobicContact CD2-CG 3.67Å; L312-M322 HydrophobicContact CD2-SD 4.18Å; L312-I344 HydrophobicContact CB-CG2 3.94Å; L312-I344 HydrophobicContact CD1-CG2 3.53Å; L312-I344 HydrophobicContact CG-CG2 4.35Å; L312-F346 HydrophobicContact CB-CE2 4.29Å; L312-F346 HydrophobicContact CD1-CD1 4.23Å; L312-F346 HydrophobicContact CD1-CD2 3.61Å; L312-F346 HydrophobicContact CD1-CE1 3.87Å; L312-F346 HydrophobicContact CD1-CE2 3.2Å; L312-F346 HydrophobicContact CD1-CG 4.13Å; L312-F346 HydrophobicContact CD1-CZ 3.35Å; L312-F346 HydrophobicContact CD2-CE2 4.44Å; L312-F346 HydrophobicContact CD2-CZ 4.03Å; L312-F346 HydrophobicContact CG-CD2 4.24Å; L312-F346 HydrophobicContact CG-CE1 4.32Å; L312-F346 HydrophobicContact CG-CE2 3.36Å; L312-F346 HydrophobicContact CG-CZ 3.41Å; L312-F346 VanDerWaalsContact CG-CZ 3.41Å; L312-I353 HydrophobicContact CD1-CB 4.4Å; L312-I353 HydrophobicContact CD1-CD1 3.63Å; L312-I353 HydrophobicContact CD1-CG1 3.73Å; L312-I353 HydrophobicContact CD1-CG2 3.78Å; L312-I353 HydrophobicContact CD2-CD1 3.68Å; L312-I353 HydrophobicContact CG-CD1 4.3Å
313	S	97.4	Very high	85.4	Confident	0 Å²	0	42 Å²	42	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	144.4	167.9	60.2	0	0	0	0	111.4	H275 C281 I320 K321 W323 I344	H275-S313 PolarHBondContact NE2-OG 3.45Å; C281-S313 CarbonylContact O-C 3.57Å; C281-S313 VanDerWaalsContact O-CA 3.29Å; C281-S313 WeakPolarHBondContact O-CA 3.11Å; S313-I320 CarbonylContact O-C 3.59Å; S313-I320 WeakPolarHBondContact O-CA 3.43Å; S313-K321 PolarHBondContact N-O 3.22Å; S313-K321 PolarHBondContact O-N 3.36Å; S313-W323 PolarHBondContact OG-NE1 2.84Å; S313-I344 VanDerWaalsContact C-CD1 3.45Å
314	G	96.9	Very high	87.6	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	135.8	178.3	0	0	0	0	0	110.5	V279 E280 C281	V279-G314 WeakPolarHBondContact CG1-O 3.36Å; E280-G314 PolarHBondContact N-O 3.48Å; C281-G314 PolarHBondContact N-O 2.82Å; C281-G314 PolarHBondContact O-N 2.77Å
315	S	97.3	Very high	89.7	Confident	0 Å²	0	27 Å²	27	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	162.9	-171.9	167.7	0	0	0	0	111.7	H275 H277 V278 D317 K318 T319 V341	H275-S315 VanDerWaalsContact CE1-CB 3.49Å; H275-S315 WeakPolarHBondContact CE1-CB 3.18Å; H275-S315 WeakPolarHBondContact ND1-CB 3.39Å; H277-S315 PolarHBondContact O-OG 3.46Å; V278-S315 WeakPolarHBondContact O-CA 3.25Å; V278-S315 PolarHBondContact O-OG 2.92Å; V278-S315 VanDerWaalsContact O-OG 3.1Å; S315-D317 VanDerWaalsContact CB-CG 3.43Å; S315-D317 WeakPolarHBondContact CB-OD1 3.47Å; S315-D317 WeakPolarHBondContact CB-OD2 3.28Å; S315-D317 PolarHBondContact O-N 3.24Å; S315-D317 PolarHBondContact OG-N 3.38Å; S315-D317 VanDerWaalsContact OG-N 3.09Å; S315-D317 PolarHBondContact OG-OD1 3.2Å; S315-D317 PolarHBondContact OG-OD2 2.7Å; S315-K318 PolarHBondContact O-N 3.14Å; S315-T319 PolarHBondContact N-O 3.41Å; S315-V341 PolarHBondContact O-N 2.89Å
316	R	96.4	Very high	91.1	Very high	45 Å²	45	28 Å²	28	17%	0.17	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-12	169.1	-63.8	-166.8	-169.3	-165.2	-4.1	113.2	H277 V278 E280 K318 W340	H277-R316 HydrophobicContact CB-CB 4.13Å; H277-R316 VanDerWaalsContact ND1-CB 3.3Å; H277-R316 WeakPolarHBondContact ND1-CB 3.43Å; V278-R316 HydrophobicContact CB-CG 4.1Å; V278-R316 HydrophobicContact CG1-CG 4.47Å; V278-R316 PolarHBondContact O-N 2.89Å; E280-R316 HydrophobicContact CG-CG 3.93Å; E280-R316 IonicContact OE1-CZ 2.84Å; E280-R316 IonicContact OE1-NE 3.6Å; E280-R316 PolarHBondContact OE1-NE 2.92Å; E280-R316 IonicContact OE1-NH2 2.91Å; E280-R316 PolarHBondContact OE1-NH2 2.83Å; R316-K318 PolarHBondContact O-N 2.86Å; R316-W340 HydrophobicContact CB-CB 4.34Å; R316-W340 VanDerWaalsContact CB-CD1 3.5Å; R316-W340 HydrophobicContact CB-CD2 4.26Å; R316-W340 HydrophobicContact CB-CG 3.78Å; R316-W340 HydrophobicContact CG-CB 4.02Å; R316-W340 HydrophobicContact CG-CD2 3.79Å; R316-W340 HydrophobicContact CG-CE3 4.34Å; R316-W340 HydrophobicContact CG-CG 3.61Å; R316-W340 VanDerWaalsContact O-CD1 3.27Å
317	D	94.9	Very high	92.1	Very high	28 Å²	28	22.4 Å²	22.4	15%	0.15	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	3.1	168.9	65.2	24.8	0	0	0	113.3	H275 E276 H277 S315 T319	H275-D317 IonicContact CE1-OD2 3.4Å; H275-D317 IonicContact CG-OD2 3.36Å; H275-D317 IonicContact ND1-OD1 3.12Å; H275-D317 IonicContact ND1-OD2 3.42Å; H275-D317 PolarHBondContact ND1-OD2 2.8Å; E276-D317 HydrophobicContact CB-CB 4.23Å; E276-D317 PolarHBondContact N-OD2 3.33Å; H277-D317 HydrophobicContact CB-CB 4.05Å; S315-D317 VanDerWaalsContact CB-CG 3.43Å; S315-D317 WeakPolarHBondContact CB-OD1 3.47Å; S315-D317 WeakPolarHBondContact CB-OD2 3.28Å; S315-D317 PolarHBondContact O-N 3.24Å; S315-D317 PolarHBondContact OG-N 3.38Å; S315-D317 VanDerWaalsContact OG-N 3.09Å; S315-D317 PolarHBondContact OG-OD1 3.2Å; S315-D317 PolarHBondContact OG-OD2 2.7Å; D317-T319 VanDerWaalsContact CG-OG1 3.25Å; D317-T319 PolarHBondContact O-N 3.47Å; D317-T319 WeakPolarHBondContact OD1-CA 3.35Å; D317-T319 VanDerWaalsContact OD1-CB 3.26Å; D317-T319 WeakPolarHBondContact OD1-CB 3.37Å; D317-T319 PolarHBondContact OD1-N 2.97Å; D317-T319 PolarHBondContact OD1-OG1 2.89Å; D317-T319 PolarHBondContact OD2-OG1 3.3Å
318	K	95.3	Very high	92.8	Very high	95 Å²	95	21.6 Å²	21.6	41%	0.413	13%	0.128	S	C	.	.	S	Bend	trans	71.2	9.8	177.8	-40.3	170.5	-177.9	-161.3	0	113.8	S315 R316 H337 D338	S315-K318 PolarHBondContact O-N 3.14Å; R316-K318 PolarHBondContact O-N 2.86Å; K318-H337 WeakPolarHBondContact CB-O 3.13Å; K318-D338 WeakPolarHBondContact CD-O 3.35Å; K318-D338 WeakPolarHBondContact CE-O 3.43Å; K318-D338 PolarHBondContact NZ-O 2.77Å
319	T	95.9	Very high	93.5	Very high	20 Å²	20	26.1 Å²	26.1	12%	0.123	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	151.5	179.6	76.7	0	0	0	0	111.7	S315 D317 T333 V335	S315-T319 PolarHBondContact N-O 3.41Å; D317-T319 VanDerWaalsContact CG-OG1 3.25Å; D317-T319 PolarHBondContact O-N 3.47Å; D317-T319 WeakPolarHBondContact OD1-CA 3.35Å; D317-T319 VanDerWaalsContact OD1-CB 3.26Å; D317-T319 WeakPolarHBondContact OD1-CB 3.37Å; D317-T319 PolarHBondContact OD1-N 2.97Å; D317-T319 PolarHBondContact OD1-OG1 2.89Å; D317-T319 PolarHBondContact OD2-OG1 3.3Å; T319-T333 HydrophobicContact CG2-CG2 4.06Å; T319-V335 HydrophobicContact CG2-CG2 4.14Å
320	I	96.7	Very high	93.6	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	122.9	167.8	-57.4	170.4	0	0	0	106.6	L312 S313 T333 L334 V341 I344 S355 W365	L312-I320 HydrophobicContact CD2-CG2 4.31Å; S313-I320 CarbonylContact O-C 3.59Å; S313-I320 WeakPolarHBondContact O-CA 3.43Å; I320-T333 CarbonylContact O-C 3.54Å; I320-T333 WeakPolarHBondContact O-CA 3.42Å; I320-L334 HydrophobicContact CB-CB 4.19Å; I320-L334 HydrophobicContact CG2-CD1 4.4Å; I320-L334 PolarHBondContact N-O 3.09Å; I320-L334 PolarHBondContact O-N 3.4Å; I320-V341 HydrophobicContact CD1-CG1 4.37Å; I320-V341 HydrophobicContact CG1-CG1 4.1Å; I320-V341 HydrophobicContact CG1-CG2 4.19Å; I320-I344 HydrophobicContact CB-CD1 4.3Å; I320-I344 HydrophobicContact CD1-CD1 4.4Å; I320-I344 HydrophobicContact CD1-CG1 4.25Å; I320-I344 HydrophobicContact CG1-CD1 3.93Å; I320-I344 HydrophobicContact CG1-CG1 4.3Å; I320-I344 HydrophobicContact CG2-CD1 3.73Å; I320-I344 HydrophobicContact CG2-CG1 4.43Å; I320-S355 VanDerWaalsContact CD1-CB 3.44Å; I320-S355 WeakPolarHBondContact CD1-OG 3.4Å; I320-W365 HydrophobicContact CD1-CZ2 4.21Å
321	K	95.8	Very high	93.5	Very high	22 Å²	22	28.4 Å²	28.4	10%	0.096	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	143.1	177.3	-70.1	-178.1	-175.3	-88.6	0	110.3	E274 L312 S313 W323 M332 T333	E274-K321 HydrophobicContact CB-CD 4.15Å; E274-K321 WeakPolarHBondContact O-CE 3.4Å; E274-K321 PolarHBondContact O-NZ 3.46Å; L312-K321 CarbonylContact C-O 3.52Å; L312-K321 WeakPolarHBondContact CA-O 3.46Å; S313-K321 PolarHBondContact N-O 3.22Å; S313-K321 PolarHBondContact O-N 3.36Å; K321-W323 HydrophobicContact CB-CZ2 3.81Å; K321-W323 HydrophobicContact CD-CH2 4.15Å; K321-W323 HydrophobicContact CD-CZ2 3.63Å; K321-W323 HydrophobicContact CG-CZ2 4.36Å; K321-M332 WeakPolarHBondContact CA-O 3.06Å; K321-T333 HydrophobicContact CG-CG2 4.09Å; K321-T333 PolarHBondContact NZ-OG1 3.49Å; K321-T333 VanDerWaalsContact NZ-OG1 3.11Å
322	M	95.4	Very high	93.4	Very high	2 Å²	2	29 Å²	29	1%	0.01	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	135.9	171.9	-168.2	172.1	72.5	0	0	109.6	I293 T297 L311 L312 C330 L331 M332 F346	I293-M322 HydrophobicContact CB-CE 4.36Å; I293-M322 HydrophobicContact CD1-SD 4Å; I293-M322 HydrophobicContact CG1-CE 4.14Å; I293-M322 HydrophobicContact CG1-SD 3.86Å; I293-M322 HydrophobicContact CG2-CE 3.63Å; I293-M322 HydrophobicContact CG2-SD 4.23Å; T297-M322 HydrophobicContact CG2-CE 4.14Å; L311-M322 CarbonylContact O-C 3.56Å; L311-M322 WeakPolarHBondContact O-CA 3.44Å; L312-M322 HydrophobicContact CD2-CB 3.61Å; L312-M322 HydrophobicContact CD2-CG 3.67Å; L312-M322 HydrophobicContact CD2-SD 4.18Å; M322-C330 CarbonylContact O-C 3.55Å; M322-L331 HydrophobicContact CE-CB 4.09Å; M322-L331 HydrophobicContact CE-CD1 3.95Å; M322-L331 PolarHBondContact O-N 2.9Å; M322-M332 HydrophobicContact CB-CG 3.7Å; M322-M332 HydrophobicContact CE-CE 3.36Å; M322-M332 HydrophobicContact CE-CG 3.82Å; M322-M332 HydrophobicContact CE-SD 3.57Å; M322-M332 VanDerWaalsContact CE-SD 3.57Å; M322-M332 PolarHBondContact N-O 2.81Å; M322-M332 PolarHBondContact O-N 3.48Å; M322-M332 HydrophobicContact SD-SD 4.34Å; M322-F346 HydrophobicContact SD-CZ 4.49Å
323	W	94.3	Very high	93.2	Very high	1 Å²	1	31.8 Å²	31.8	0%	0.004	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	145	-169.8	-50.1	86.8	0	0	0	110.8	L272 E274 H275 F310 L311 S313 K321 M329 C330	L272-W323 HydrophobicContact CB-CD2 4.15Å; L272-W323 HydrophobicContact CB-CE3 3.84Å; L272-W323 HydrophobicContact CB-CH2 3.92Å; L272-W323 HydrophobicContact CB-CZ2 4.32Å; L272-W323 HydrophobicContact CB-CZ3 3.72Å; L272-W323 HydrophobicContact CD1-CB 3.81Å; L272-W323 HydrophobicContact CD1-CD2 3.83Å; L272-W323 HydrophobicContact CD1-CE3 4.08Å; L272-W323 HydrophobicContact CD1-CG 3.72Å; L272-W323 HydrophobicContact CD2-CD2 4.45Å; L272-W323 HydrophobicContact CD2-CE3 3.87Å; L272-W323 HydrophobicContact CD2-CZ3 4.33Å; L272-W323 HydrophobicContact CG-CD2 4.36Å; L272-W323 HydrophobicContact CG-CE3 4.14Å; L272-W323 HydrophobicContact CG-CZ3 4.48Å; E274-W323 HydrophobicContact CB-CH2 3.46Å; E274-W323 VanDerWaalsContact CB-CH2 3.46Å; E274-W323 HydrophobicContact CB-CZ2 4.37Å; E274-W323 HydrophobicContact CB-CZ3 4.03Å; E274-W323 HydrophobicContact CG-CH2 3.72Å; E274-W323 HydrophobicContact CG-CZ3 3.74Å; H275-W323 AromaticContact CD2-CZ2 3.91Å; F310-W323 VanDerWaalsContact CA-O 3.27Å; F310-W323 WeakPolarHBondContact CA-O 3.21Å; L311-W323 HydrophobicContact CB-CB 4.41Å; L311-W323 PolarHBondContact N-O 3.41Å; L311-W323 PolarHBondContact O-N 3.43Å; S313-W323 PolarHBondContact OG-NE1 2.84Å; K321-W323 HydrophobicContact CB-CZ2 3.81Å; K321-W323 HydrophobicContact CD-CH2 4.15Å; K321-W323 HydrophobicContact CD-CZ2 3.63Å; K321-W323 HydrophobicContact CG-CZ2 4.36Å; W323-M329 WeakPolarHBondContact CA-O 3.45Å; W323-C330 HydrophobicContact CD2-CB 4.35Å; W323-C330 HydrophobicContact CE3-CB 3.67Å; W323-C330 HydrophobicContact CH2-CB 4.31Å; W323-C330 HydrophobicContact CZ3-CB 3.65Å
324	D	92.1	Very high	93.1	Very high	15 Å²	15	32.1 Å²	32.1	8%	0.08	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	113.4	160	175.4	8.2	0	0	0	108.6	F310 S326 T327 G328 M329 L331	F310-D324 HydrophobicContact CD1-CB 4.04Å; F310-D324 HydrophobicContact CE1-CB 4.02Å; D324-S326 PolarHBondContact O-N 2.96Å; D324-S326 WeakPolarHBondContact OD1-CB 3.46Å; D324-S326 PolarHBondContact OD1-N 2.91Å; D324-S326 PolarHBondContact OD1-OG 3.19Å; D324-S326 PolarHBondContact OD2-OG 2.9Å; D324-S326 VanDerWaalsContact OD2-OG 3.08Å; D324-T327 WeakPolarHBondContact CB-OG1 3.33Å; D324-T327 PolarHBondContact O-N 3.32Å; D324-T327 VanDerWaalsContact OD2-CG2 3.28Å; D324-T327 WeakPolarHBondContact OD2-CG2 3.47Å; D324-T327 PolarHBondContact OD2-OG1 2.96Å; D324-G328 WeakPolarHBondContact O-CA 3.31Å; D324-G328 PolarHBondContact O-N 2.81Å; D324-M329 PolarHBondContact N-O 2.91Å; D324-M329 PolarHBondContact O-N 2.79Å; D324-L331 HydrophobicContact CB-CD1 3.99Å; D324-L331 HydrophobicContact CB-CD2 4.03Å; D324-L331 HydrophobicContact CB-CG 4.08Å
325	V	90.4	Very high	92.9	Very high	2 Å²	2	37.2 Å²	37.2	1%	0.012	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-22.1	-177.8	176.1	0	0	0	0	111.7	V260 A270 W284 P309 L311	V260-V325 HydrophobicContact CB-CG1 3.93Å; V260-V325 HydrophobicContact CG1-CG1 3.83Å; V260-V325 HydrophobicContact CG2-CG1 3.72Å; V260-V325 HydrophobicContact CG2-CG2 4.05Å; A270-V325 HydrophobicContact CB-CG1 4.33Å; W284-V325 HydrophobicContact CH2-CG2 4.18Å; W284-V325 HydrophobicContact CZ3-CG2 3.88Å; P309-V325 HydrophobicContact CG-CB 4.1Å; P309-V325 HydrophobicContact CG-CG1 4.36Å; P309-V325 VanDerWaalsContact O-CB 3.27Å; P309-V325 WeakPolarHBondContact O-CB 3.28Å; P309-V325 WeakPolarHBondContact O-CG2 3.31Å; P309-V325 PolarHBondContact O-N 3.02Å; L311-V325 HydrophobicContact CB-CG2 3.94Å
326	S	87.8	Confident	92.5	Very high	67 Å²	67	38.3 Å²	38.3	47%	0.469	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-37.4	178.9	73.2	0	0	0	0	112	D324	D324-S326 PolarHBondContact O-N 2.96Å; D324-S326 WeakPolarHBondContact OD1-CB 3.46Å; D324-S326 PolarHBondContact OD1-N 2.91Å; D324-S326 PolarHBondContact OD1-OG 3.19Å; D324-S326 PolarHBondContact OD2-OG 2.9Å; D324-S326 VanDerWaalsContact OD2-OG 3.08Å
327	T	86.4	Confident	92.4	Very high	74 Å²	74	36.4 Å²	36.4	45%	0.454	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100	-17.8	-179.6	56.4	0	0	0	0	113.2	D324 M329	D324-T327 WeakPolarHBondContact CB-OG1 3.33Å; D324-T327 PolarHBondContact O-N 3.32Å; D324-T327 VanDerWaalsContact OD2-CG2 3.28Å; D324-T327 WeakPolarHBondContact OD2-CG2 3.47Å; D324-T327 PolarHBondContact OD2-OG1 2.96Å; T327-M329 HydrophobicContact CG2-CE 3.99Å; T327-M329 PolarHBondContact O-N 3.32Å
328	G	86.1	Confident	92.2	Very high	34 Å²	34	40.2 Å²	40.2	35%	0.351	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.4	8.5	-173.7	0	0	0	0	0	113.7	L272 D324	L272-G328 WeakPolarHBondContact CD2-O 3.48Å; D324-G328 WeakPolarHBondContact O-CA 3.31Å; D324-G328 PolarHBondContact O-N 2.81Å
329	M	89.5	Confident	92.2	Very high	110 Å²	110	37.9 Å²	37.9	54%	0.542	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	140.8	-174.8	-64	-169.5	-64.3	0	0	112	W323 D324 T327 L331	W323-M329 WeakPolarHBondContact CA-O 3.45Å; D324-M329 PolarHBondContact N-O 2.91Å; D324-M329 PolarHBondContact O-N 2.79Å; T327-M329 HydrophobicContact CG2-CE 3.99Å; T327-M329 PolarHBondContact O-N 3.32Å; M329-L331 PolarHBondContact O-N 2.88Å
330	C	92.6	Very high	92.3	Very high	42 Å²	42	41 Å²	41	28%	0.284	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	112.1	165.9	179.7	0	0	0	0	109.1	E274 M322 W323	E274-C330 HydrophobicContact CG-CB 4.26Å; M322-C330 CarbonylContact O-C 3.55Å; W323-C330 HydrophobicContact CD2-CB 4.35Å; W323-C330 HydrophobicContact CE3-CB 3.67Å; W323-C330 HydrophobicContact CH2-CB 4.31Å; W323-C330 HydrophobicContact CZ3-CB 3.65Å
331	L	90.9	Very high	92.3	Very high	40 Å²	40	41 Å²	41	21%	0.209	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	-39.6	-178	-62.7	174.8	0	0	0	112.5	I293 T297 F310 M322 D324 M329	I293-L331 HydrophobicContact CG2-CD1 4.09Å; T297-L331 HydrophobicContact CG2-CB 3.84Å; T297-L331 HydrophobicContact CG2-CD1 4.13Å; T297-L331 HydrophobicContact CG2-CD2 4.29Å; T297-L331 HydrophobicContact CG2-CG 4.32Å; F310-L331 HydrophobicContact CD1-CD1 3.61Å; F310-L331 HydrophobicContact CE1-CD1 3.74Å; M322-L331 HydrophobicContact CE-CB 4.09Å; M322-L331 HydrophobicContact CE-CD1 3.95Å; M322-L331 PolarHBondContact O-N 2.9Å; D324-L331 HydrophobicContact CB-CD1 3.99Å; D324-L331 HydrophobicContact CB-CD2 4.03Å; D324-L331 HydrophobicContact CB-CG 4.08Å; M329-L331 PolarHBondContact O-N 2.88Å
332	M	91.5	Very high	92.3	Very high	11 Å²	11	43.5 Å²	43.5	5%	0.054	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.8	154.3	178.2	59.1	-175.7	63.8	0	0	111.4	A296 T297 K321 M322 L334 Y367	A296-M332 HydrophobicContact CB-CE 4.01Å; T297-M332 HydrophobicContact CG2-CE 3.89Å; K321-M332 WeakPolarHBondContact CA-O 3.06Å; M322-M332 HydrophobicContact CB-CG 3.7Å; M322-M332 HydrophobicContact CE-CE 3.36Å; M322-M332 HydrophobicContact CE-CG 3.82Å; M322-M332 HydrophobicContact CE-SD 3.57Å; M322-M332 VanDerWaalsContact CE-SD 3.57Å; M322-M332 PolarHBondContact N-O 2.81Å; M322-M332 PolarHBondContact O-N 3.48Å; M322-M332 HydrophobicContact SD-SD 4.34Å; M332-L334 HydrophobicContact SD-CD2 4.45Å; M332-Y367 HydrophobicContact CE-CD2 4.45Å; M332-Y367 HydrophobicContact SD-CD2 4.37Å
333	T	94.4	Very high	92.3	Very high	60 Å²	60	43.6 Å²	43.6	37%	0.368	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	122.2	170.7	-58.4	0	0	0	0	107.8	T319 I320 K321 V335	T319-T333 HydrophobicContact CG2-CG2 4.06Å; I320-T333 CarbonylContact O-C 3.54Å; I320-T333 WeakPolarHBondContact O-CA 3.42Å; K321-T333 HydrophobicContact CG-CG2 4.09Å; K321-T333 PolarHBondContact NZ-OG1 3.49Å; K321-T333 VanDerWaalsContact NZ-OG1 3.11Å; T333-V335 HydrophobicContact CG2-CG2 3.97Å
334	L	93.8	Very high	92.4	Very high	7 Å²	7	43.9 Å²	43.9	4%	0.037	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	120.3	172.8	-55.4	172.1	0	0	0	107.8	I320 M332 I353 W365	I320-L334 HydrophobicContact CB-CB 4.19Å; I320-L334 HydrophobicContact CG2-CD1 4.4Å; I320-L334 PolarHBondContact N-O 3.09Å; I320-L334 PolarHBondContact O-N 3.4Å; M332-L334 HydrophobicContact SD-CD2 4.45Å; L334-I353 HydrophobicContact CD1-CD1 4.11Å; L334-W365 HydrophobicContact CB-CD2 4.41Å; L334-W365 HydrophobicContact CB-CE3 3.91Å; L334-W365 HydrophobicContact CB-CH2 4.5Å; L334-W365 HydrophobicContact CB-CZ3 3.96Å; L334-W365 HydrophobicContact CD1-CB 4.04Å; L334-W365 HydrophobicContact CD1-CD2 4.2Å; L334-W365 HydrophobicContact CD1-CE3 4.24Å; L334-W365 HydrophobicContact CD1-CG 4.12Å; L334-W365 HydrophobicContact CD2-CE3 4.39Å; L334-W365 HydrophobicContact CG-CE3 4.41Å
335	V	93.6	Very high	92.6	Very high	106 Å²	106	45 Å²	45	64%	0.642	26%	0.257	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.2	134.1	179.8	-176	0	0	0	0	108.1	T319 T333	T319-V335 HydrophobicContact CG2-CG2 4.14Å; T333-V335 HydrophobicContact CG2-CG2 3.97Å
336	G	88.4	Confident	92.7	Very high	23 Å²	23	45.7 Å²	45.7	24%	0.237	26%	0.26	C	S	.	.			trans	169.2	-25.6	169	0	0	0	0	0	115.1	R363	G336-R363 PolarHBondContact O-NH1 3.39Å; G336-R363 PolarHBondContact O-NH2 3.02Å; G336-R363 VanDerWaalsContact O-NH2 3.1Å
337	H	93.6	Very high	92.9	Very high	6 Å²	6	42.5 Å²	42.5	3%	0.028	24%	0.237	C	C	.	.			trans	-60	146.4	171.5	-84.8	-66.2	0	0	0	110.8	K318 V341 S355 A357 D359 T361 R363 W365	K318-H337 WeakPolarHBondContact CB-O 3.13Å; H337-V341 HydrophobicContact CB-CG2 4.17Å; H337-S355 PolarHBondContact NE2-OG 2.98Å; H337-A357 HydrophobicContact CB-CB 4.22Å; H337-A357 VanDerWaalsContact ND1-CB 3.28Å; H337-A357 WeakPolarHBondContact ND1-CB 3.44Å; H337-D359 IonicContact CE1-OD1 3.48Å; H337-D359 IonicContact CE1-OD2 3.97Å; H337-D359 IonicContact CG-OD2 3.92Å; H337-D359 IonicContact ND1-OD1 3.56Å; H337-D359 PolarHBondContact ND1-OD1 2.92Å; H337-D359 IonicContact ND1-OD2 2.86Å; H337-D359 PolarHBondContact ND1-OD2 3.48Å; H337-T361 PolarHBondContact CE1-OG1 2.99Å; H337-T361 PolarHBondContact ND1-OG1 3.49Å; H337-R363 VanDerWaalsContact CE1-CD 3.43Å; H337-R363 WeakPolarHBondContact CE1-CD 2.97Å; H337-R363 PolarHBondContact ND1-NE 3.48Å; H337-W365 AromaticContact CD2-CZ2 3.92Å
338	D	92.8	Very high	92.9	Very high	107 Å²	107	40.9 Å²	40.9	57%	0.572	23%	0.228	S	C	*	.	S	Bend	trans	-92.2	-11.3	-177.1	-62.6	-57.6	0	0	0	112.5	K318 D359 R363	K318-D338 WeakPolarHBondContact CD-O 3.35Å; K318-D338 WeakPolarHBondContact CE-O 3.43Å; K318-D338 PolarHBondContact NZ-O 2.77Å; D338-D359 HydrophobicContact CB-CB 3.99Å; D338-D359 PolarHBondContact N-OD2 3.47Å; D338-D359 VanDerWaalsContact N-OD2 3.15Å; D338-R363 IonicContact OD2-NH2 3.78Å; D338-R363 PolarHBondContact OD2-NH2 3.4Å
339	N	95.2	Very high	92.8	Very high	47 Å²	47	40 Å²	40	25%	0.251	22%	0.219	S	C	.	.	S	Bend	trans	-148.6	-172.7	-177.7	-152.5	-3	0	0	0	111.9	V341 D358 D359	N339-V341 PolarHBondContact O-N 3.48Å; N339-D358 HydrophobicContact CB-CB 3.93Å; N339-D358 WeakPolarHBondContact ND2-CB 3.42Å; N339-D358 PolarHBondContact ND2-O 3.12Å; N339-D359 HydrophobicContact CB-CB 4.18Å
340	W	96.3	Very high	92.6	Very high	86 Å²	86	34.8 Å²	34.8	33%	0.326	19%	0.193	S	C	.	.			trans	-56.7	127.8	-173.2	-55.9	-11.7	0	0	0	113.3	R316 R342 A357 D358	R316-W340 HydrophobicContact CB-CB 4.34Å; R316-W340 VanDerWaalsContact CB-CD1 3.5Å; R316-W340 HydrophobicContact CB-CD2 4.26Å; R316-W340 HydrophobicContact CB-CG 3.78Å; R316-W340 HydrophobicContact CG-CB 4.02Å; R316-W340 HydrophobicContact CG-CD2 3.79Å; R316-W340 HydrophobicContact CG-CE3 4.34Å; R316-W340 HydrophobicContact CG-CG 3.61Å; R316-W340 VanDerWaalsContact O-CD1 3.27Å; W340-R342 PolarHBondContact O-N 2.91Å; W340-A357 CarbonylContact O-C 3.58Å; W340-A357 WeakPolarHBondContact O-CA 3.3Å; W340-A357 WeakPolarHBondContact O-CB 3.42Å; W340-D358 HydrophobicContact CB-CB 4.35Å; W340-D358 VanDerWaalsContact CE3-OD2 3.27Å; W340-D358 PolarHBondContact O-N 2.77Å
341	V	97.3	Very high	92.4	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	120.2	176.8	-173.4	0	0	0	0	109.6	E280 S315 I320 H337 N339 I344	E280-V341 WeakPolarHBondContact CB-O 3.23Å; S315-V341 PolarHBondContact O-N 2.89Å; I320-V341 HydrophobicContact CD1-CG1 4.37Å; I320-V341 HydrophobicContact CG1-CG1 4.1Å; I320-V341 HydrophobicContact CG1-CG2 4.19Å; H337-V341 HydrophobicContact CB-CG2 4.17Å; N339-V341 PolarHBondContact O-N 3.48Å; V341-I344 HydrophobicContact CG1-CD1 3.93Å; V341-I344 HydrophobicContact CG1-CG1 3.72Å
342	R	96.1	Very high	92.5	Very high	74 Å²	74	34.7 Å²	34.7	28%	0.279	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	-34.2	-173.9	-66.3	-60.2	-168.7	123	5.1	113.9	C281 W340 C356 D358 V383 T384	C281-R342 WeakPolarHBondContact CB-O 3.33Å; W340-R342 PolarHBondContact O-N 2.91Å; R342-C356 PolarHBondContact N-O 2.76Å; R342-D358 WeakPolarHBondContact CG-OD1 3.3Å; R342-D358 IonicContact CZ-OD1 3.54Å; R342-D358 IonicContact CZ-OD2 3.58Å; R342-D358 VanDerWaalsContact NE-CG 3.33Å; R342-D358 IonicContact NE-OD1 3.65Å; R342-D358 PolarHBondContact NE-OD1 3.37Å; R342-D358 IonicContact NE-OD2 3.74Å; R342-D358 PolarHBondContact NE-OD2 3.15Å; R342-D358 VanDerWaalsContact NE-OD2 3.12Å; R342-D358 IonicContact NH2-OD1 3.01Å; R342-D358 PolarHBondContact NH2-OD1 3.31Å; R342-D358 IonicContact NH2-OD2 3.36Å; R342-D358 PolarHBondContact NH2-OD2 3.17Å; R342-V383 WeakPolarHBondContact CB-O 3.5Å; R342-V383 WeakPolarHBondContact CG-O 3.43Å; R342-T384 WeakPolarHBondContact CB-O 3.37Å
343	G	95.2	Very high	92.7	Very high	4 Å²	4	34.1 Å²	34.1	4%	0.041	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	140.9	-179.2	0	0	0	0	0	111.2	S355 C356	G343-S355 CarbonylContact O-C 3.54Å; G343-S355 WeakPolarHBondContact O-CA 3.41Å; G343-S355 WeakPolarHBondContact O-CB 3.17Å; G343-C356 PolarHBondContact N-O 3.01Å; G343-C356 PolarHBondContact N-SG 3.4Å; G343-C356 VanDerWaalsContact N-SG 3.42Å; G343-C356 PolarHBondContact O-N 3.23Å
344	I	96.6	Very high	92.7	Very high	6 Å²	6	31.4 Å²	31.4	3%	0.031	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	136	174.1	-62.5	161.5	0	0	0	108.2	C281 S283 L312 S313 I320 V341 I353 V354	C281-I344 VanDerWaalsContact SG-CD1 3.56Å; S283-I344 WeakPolarHBondContact CB-O 3.46Å; L312-I344 HydrophobicContact CB-CG2 3.94Å; L312-I344 HydrophobicContact CD1-CG2 3.53Å; L312-I344 HydrophobicContact CG-CG2 4.35Å; S313-I344 VanDerWaalsContact C-CD1 3.45Å; I320-I344 HydrophobicContact CB-CD1 4.3Å; I320-I344 HydrophobicContact CD1-CD1 4.4Å; I320-I344 HydrophobicContact CD1-CG1 4.25Å; I320-I344 HydrophobicContact CG1-CD1 3.93Å; I320-I344 HydrophobicContact CG1-CG1 4.3Å; I320-I344 HydrophobicContact CG2-CD1 3.73Å; I320-I344 HydrophobicContact CG2-CG1 4.43Å; V341-I344 HydrophobicContact CG1-CD1 3.93Å; V341-I344 HydrophobicContact CG1-CG1 3.72Å; I344-I353 HydrophobicContact CG2-CG2 3.74Å; I344-V354 CarbonylContact C-O 3.51Å; I344-V354 WeakPolarHBondContact CA-O 3.41Å
345	L	95.4	Very high	92.9	Very high	40 Å²	40	31 Å²	31	21%	0.209	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	149.5	171.8	-69.3	176.3	0	0	0	111	I353 V354 L386 D387	L345-I353 WeakPolarHBondContact O-CA 3.49Å; L345-V354 PolarHBondContact N-O 2.91Å; L345-V354 PolarHBondContact O-N 2.72Å; L345-L386 HydrophobicContact CB-CD1 4.23Å; L345-L386 HydrophobicContact CD1-CD1 3.72Å; L345-L386 HydrophobicContact CD1-CG 4.33Å; L345-L386 WeakPolarHBondContact CD1-O 3.32Å; L345-L386 HydrophobicContact CG-CD1 4.14Å; L345-D387 HydrophobicContact CD1-CB 4.48Å
346	F	93.8	Very high	93	Very high	15 Å²	15	26 Å²	26	7%	0.066	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	138.1	161.8	-76.8	-85.3	0	0	0	109.9	W284 A285 P286 A289 I293 L312 M322 I353	W284-F346 WeakPolarHBondContact O-CD2 3.43Å; A285-F346 HydrophobicContact CB-CD2 4.25Å; A285-F346 HydrophobicContact CB-CE1 4.29Å; A285-F346 HydrophobicContact CB-CE2 3.63Å; A285-F346 HydrophobicContact CB-CZ 3.65Å; P286-F346 VanDerWaalsContact CD-CB 3.48Å; P286-F346 HydrophobicContact CG-CB 3.99Å; A289-F346 HydrophobicContact CB-CD1 3.89Å; A289-F346 HydrophobicContact CB-CE1 4.08Å; I293-F346 HydrophobicContact CD1-CE1 4.06Å; I293-F346 HydrophobicContact CD1-CZ 4.14Å; L312-F346 HydrophobicContact CB-CE2 4.29Å; L312-F346 HydrophobicContact CD1-CD1 4.23Å; L312-F346 HydrophobicContact CD1-CD2 3.61Å; L312-F346 HydrophobicContact CD1-CE1 3.87Å; L312-F346 HydrophobicContact CD1-CE2 3.2Å; L312-F346 HydrophobicContact CD1-CG 4.13Å; L312-F346 HydrophobicContact CD1-CZ 3.35Å; L312-F346 HydrophobicContact CD2-CE2 4.44Å; L312-F346 HydrophobicContact CD2-CZ 4.03Å; L312-F346 HydrophobicContact CG-CD2 4.24Å; L312-F346 HydrophobicContact CG-CE1 4.32Å; L312-F346 HydrophobicContact CG-CE2 3.36Å; L312-F346 HydrophobicContact CG-CZ 3.41Å; L312-F346 VanDerWaalsContact CG-CZ 3.41Å; M322-F346 HydrophobicContact SD-CZ 4.49Å; F346-I353 HydrophobicContact CD1-CG1 4Å; F346-I353 HydrophobicContact CE1-CD1 4.19Å; F346-I353 HydrophobicContact CE1-CG1 3.99Å
347	H	91.3	Very high	93.4	Very high	1 Å²	1	24.9 Å²	24.9	1%	0.005	12%	0.123	C	C	.	.			trans	-60.5	141.1	166.6	-178	-99.3	0	0	0	109.9	P91 W94 G349 G350 F352 F388	P91-H347 PolarHBondContact O-CE1 2.81Å; W94-H347 PolarHBondContact O-CD2 2.74Å; W94-H347 PolarHBondContact O-NE2 2.8Å; H347-G349 PolarHBondContact ND1-N 2.92Å; H347-G349 VanDerWaalsContact ND1-N 3.16Å; H347-G349 PolarHBondContact O-N 2.58Å; H347-G349 VanDerWaalsContact O-N 3.14Å; H347-G350 WeakPolarHBondContact O-CA 3.3Å; H347-G350 PolarHBondContact O-N 3.33Å; H347-F352 HydrophobicContact CB-CB 3.94Å; H347-F352 WeakPolarHBondContact CB-O 3.33Å; H347-F352 PolarHBondContact N-O 3.33Å; H347-F388 AromaticContact CD2-CE1 3.92Å; H347-F388 AromaticContact CD2-CE2 3.53Å; H347-F388 AromaticContact CD2-CZ 3.37Å; H347-F388 WeakPolarHBondContact CD2-CZ 3.24Å; H347-F388 AromaticContact NE2-CE1 3.93Å; H347-F388 AromaticContact NE2-CZ 3.45Å; H347-F388 WeakPolarHBondContact NE2-CZ 3.44Å
348	P	86.2	Confident	93.5	Very high	39 Å²	39	24.9 Å²	24.9	25%	0.253	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-36.3	-177.6	-26.5	33.6	0	0	0	113.5	S288 G350 F388	S288-P348 PolarHBondContact OG-O 3.42Å; P348-G350 PolarHBondContact O-N 2.84Å; P348-F388 HydrophobicContact CG-CD1 3.45Å; P348-F388 VanDerWaalsContact CG-CD1 3.45Å; P348-F388 HydrophobicContact CG-CE1 3.85Å; P348-F388 HydrophobicContact CG-CG 4.3Å
349	G	83.5	Confident	93.6	Very high	16 Å²	16	21 Å²	21	17%	0.165	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-2.6	175.1	0	0	0	0	0	115.5	H347 K351	H347-G349 PolarHBondContact ND1-N 2.92Å; H347-G349 VanDerWaalsContact ND1-N 3.16Å; H347-G349 PolarHBondContact O-N 2.58Å; H347-G349 VanDerWaalsContact O-N 3.14Å; G349-K351 PolarHBondContact O-N 2.8Å; G349-K351 VanDerWaalsContact O-N 3.13Å
350	G	86.3	Confident	93.6	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	11%	0.108	C	C	.	.	S	Bend	trans	75.5	-8.8	175.1	0	0	0	0	0	116	H347 P348 Y367	H347-G350 WeakPolarHBondContact O-CA 3.3Å; H347-G350 PolarHBondContact O-N 3.33Å; P348-G350 PolarHBondContact O-N 2.84Å; G350-Y367 WeakPolarHBondContact O-CE1 3.48Å; G350-Y367 PolarHBondContact O-OH 3.16Å
351	K	88.5	Confident	93.5	Very high	76 Å²	76	19.4 Å²	19.4	33%	0.33	10%	0.097	S	C	.	.	S	Bend	trans	-76	-30.9	-176	-172.7	175.4	176.7	179.3	0	114.4	E93 G349 Y367	E93-K351 IonicContact OE1-NZ 2.84Å; E93-K351 PolarHBondContact OE1-NZ 2.9Å; G349-K351 PolarHBondContact O-N 2.8Å; G349-K351 VanDerWaalsContact O-N 3.13Å; K351-Y367 WeakPolarHBondContact O-CE1 3.47Å
352	F	92.8	Very high	93.4	Very high	4 Å²	4	19.4 Å²	19.4	2%	0.018	10%	0.097	C	C	.	.			trans	-126.4	160.3	-172.3	-55.8	-64.3	0	0	0	112.1	I95 H347 I364 W365 D366 M373	I95-F352 HydrophobicContact CD1-CE2 4.08Å; I95-F352 HydrophobicContact CD1-CZ 4.08Å; I95-F352 HydrophobicContact CG1-CD2 4.45Å; I95-F352 HydrophobicContact CG1-CE2 4.09Å; H347-F352 HydrophobicContact CB-CB 3.94Å; H347-F352 WeakPolarHBondContact CB-O 3.33Å; H347-F352 PolarHBondContact N-O 3.33Å; F352-I364 HydrophobicContact CB-CG2 4.02Å; F352-I364 HydrophobicContact CD1-CG2 4.37Å; F352-I364 HydrophobicContact CG-CG2 4.18Å; F352-W365 WeakPolarHBondContact CA-O 3.49Å; F352-D366 HydrophobicContact CD1-CB 4.34Å; F352-D366 HydrophobicContact CE1-CB 4.32Å; F352-M373 HydrophobicContact CD1-SD 4.27Å; F352-M373 HydrophobicContact CE1-SD 3.49Å; F352-M373 WeakPolarHBondContact CE1-SD 3.33Å; F352-M373 HydrophobicContact CZ-SD 3.89Å
353	I	95.2	Very high	93.4	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	137.6	166.3	-64.6	165	0	0	0	107.5	L312 L334 I344 L345 F346 I364 W365 Y367	L312-I353 HydrophobicContact CD1-CB 4.4Å; L312-I353 HydrophobicContact CD1-CD1 3.63Å; L312-I353 HydrophobicContact CD1-CG1 3.73Å; L312-I353 HydrophobicContact CD1-CG2 3.78Å; L312-I353 HydrophobicContact CD2-CD1 3.68Å; L312-I353 HydrophobicContact CG-CD1 4.3Å; L334-I353 HydrophobicContact CD1-CD1 4.11Å; I344-I353 HydrophobicContact CG2-CG2 3.74Å; L345-I353 WeakPolarHBondContact O-CA 3.49Å; F346-I353 HydrophobicContact CD1-CG1 4Å; F346-I353 HydrophobicContact CE1-CD1 4.19Å; F346-I353 HydrophobicContact CE1-CG1 3.99Å; I353-I364 CarbonylContact O-C 3.56Å; I353-I364 WeakPolarHBondContact O-CA 3.4Å; I353-W365 HydrophobicContact CB-CB 4.19Å; I353-W365 PolarHBondContact N-O 2.88Å; I353-W365 PolarHBondContact O-N 3.15Å; I353-Y367 HydrophobicContact CD1-CD1 3.64Å; I353-Y367 HydrophobicContact CD1-CE1 4.33Å; I353-Y367 HydrophobicContact CD1-CG 3.94Å; I353-Y367 HydrophobicContact CG1-CD1 3.67Å; I353-Y367 HydrophobicContact CG1-CE1 4.09Å; I353-Y367 HydrophobicContact CG1-CG 4.47Å
354	V	95.6	Very high	93.4	Very high	2 Å²	2	16.9 Å²	16.9	1%	0.012	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	132.1	174.6	-173.9	0	0	0	0	108.2	I344 L345 L362 R363 L386 F388	I344-V354 CarbonylContact C-O 3.51Å; I344-V354 WeakPolarHBondContact CA-O 3.41Å; L345-V354 PolarHBondContact N-O 2.91Å; L345-V354 PolarHBondContact O-N 2.72Å; V354-L362 HydrophobicContact CG1-CD1 3.51Å; V354-L362 HydrophobicContact CG1-CD2 4.45Å; V354-L362 HydrophobicContact CG1-CG 4.04Å; V354-R363 WeakPolarHBondContact CA-O 3.43Å; V354-L386 HydrophobicContact CB-CD1 4.15Å; V354-L386 HydrophobicContact CG1-CD1 3.78Å; V354-L386 HydrophobicContact CG1-CD2 4.41Å; V354-F388 HydrophobicContact CG2-CD2 4.2Å; V354-F388 HydrophobicContact CG2-CE2 4.49Å
355	S	96.9	Very high	93.3	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	150.2	178.6	64.4	0	0	0	0	112.6	I320 H337 G343 L362 R363 W365	I320-S355 VanDerWaalsContact CD1-CB 3.44Å; I320-S355 WeakPolarHBondContact CD1-OG 3.4Å; H337-S355 PolarHBondContact NE2-OG 2.98Å; G343-S355 CarbonylContact O-C 3.54Å; G343-S355 WeakPolarHBondContact O-CA 3.41Å; G343-S355 WeakPolarHBondContact O-CB 3.17Å; S355-L362 CarbonylContact O-C 3.57Å; S355-L362 WeakPolarHBondContact O-CA 3.35Å; S355-R363 PolarHBondContact N-O 3.01Å; S355-R363 PolarHBondContact O-N 3.4Å; S355-W365 PolarHBondContact OG-NE1 3.27Å
356	C	96.6	Very high	93.1	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	152	173	75.9	0	0	0	0	111	R342 G343 T361 L362 V383 L386	R342-C356 PolarHBondContact N-O 2.76Å; G343-C356 PolarHBondContact N-O 3.01Å; G343-C356 PolarHBondContact N-SG 3.4Å; G343-C356 VanDerWaalsContact N-SG 3.42Å; G343-C356 PolarHBondContact O-N 3.23Å; C356-T361 WeakPolarHBondContact CA-O 3.3Å; C356-L362 HydrophobicContact CB-CD1 4.17Å; C356-V383 HydrophobicContact CB-CB 3.8Å; C356-V383 HydrophobicContact CB-CG1 3.5Å; C356-V383 VanDerWaalsContact CB-CG1 3.5Å; C356-L386 HydrophobicContact CB-CB 4.49Å; C356-L386 HydrophobicContact CB-CD2 3.61Å; C356-L386 VanDerWaalsContact N-CD2 3.34Å
357	A	96.8	Very high	92.9	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	8%	0.076	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	171.8	-173.9	0	0	0	0	0	113.4	H337 W340 D359 K360 T361 V383	H337-A357 HydrophobicContact CB-CB 4.22Å; H337-A357 VanDerWaalsContact ND1-CB 3.28Å; H337-A357 WeakPolarHBondContact ND1-CB 3.44Å; W340-A357 CarbonylContact O-C 3.58Å; W340-A357 WeakPolarHBondContact O-CA 3.3Å; W340-A357 WeakPolarHBondContact O-CB 3.42Å; A357-D359 WeakPolarHBondContact CB-OD1 3.36Å; A357-D359 PolarHBondContact O-N 2.93Å; A357-D359 VanDerWaalsContact O-N 3.08Å; A357-K360 PolarHBondContact O-N 3.39Å; A357-T361 PolarHBondContact N-O 3.08Å; A357-V383 PolarHBondContact O-N 3.24Å
358	D	95.5	Very high	92.7	Very high	5 Å²	5	19.7 Å²	19.7	3%	0.027	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	4.7	173.4	-70.7	0.3	0	0	0	112.9	N339 W340 R342 F382	N339-D358 HydrophobicContact CB-CB 3.93Å; N339-D358 WeakPolarHBondContact ND2-CB 3.42Å; N339-D358 PolarHBondContact ND2-O 3.12Å; W340-D358 HydrophobicContact CB-CB 4.35Å; W340-D358 VanDerWaalsContact CE3-OD2 3.27Å; W340-D358 PolarHBondContact O-N 2.77Å; R342-D358 WeakPolarHBondContact CG-OD1 3.3Å; R342-D358 IonicContact CZ-OD1 3.54Å; R342-D358 IonicContact CZ-OD2 3.58Å; R342-D358 VanDerWaalsContact NE-CG 3.33Å; R342-D358 IonicContact NE-OD1 3.65Å; R342-D358 PolarHBondContact NE-OD1 3.37Å; R342-D358 IonicContact NE-OD2 3.74Å; R342-D358 PolarHBondContact NE-OD2 3.15Å; R342-D358 VanDerWaalsContact NE-OD2 3.12Å; R342-D358 IonicContact NH2-OD1 3.01Å; R342-D358 PolarHBondContact NH2-OD1 3.31Å; R342-D358 IonicContact NH2-OD2 3.36Å; R342-D358 PolarHBondContact NH2-OD2 3.17Å; D358-F382 HydrophobicContact CB-CB 4.19Å; D358-F382 HydrophobicContact CB-CD1 4.07Å; D358-F382 HydrophobicContact CB-CD2 4.13Å; D358-F382 HydrophobicContact CB-CG 3.87Å; D358-F382 WeakPolarHBondContact O-CD1 3.46Å; D358-F382 WeakPolarHBondContact O-CE1 3.5Å
359	D	94	Very high	92.7	Very high	26 Å²	26	22.2 Å²	22.2	14%	0.139	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	8.5	168.6	68.5	2.1	0	0	0	112.4	H337 D338 N339 A357 T361 R363	H337-D359 IonicContact CE1-OD1 3.48Å; H337-D359 IonicContact CE1-OD2 3.97Å; H337-D359 IonicContact CG-OD2 3.92Å; H337-D359 IonicContact ND1-OD1 3.56Å; H337-D359 PolarHBondContact ND1-OD1 2.92Å; H337-D359 IonicContact ND1-OD2 2.86Å; H337-D359 PolarHBondContact ND1-OD2 3.48Å; D338-D359 HydrophobicContact CB-CB 3.99Å; D338-D359 PolarHBondContact N-OD2 3.47Å; D338-D359 VanDerWaalsContact N-OD2 3.15Å; N339-D359 HydrophobicContact CB-CB 4.18Å; A357-D359 WeakPolarHBondContact CB-OD1 3.36Å; A357-D359 PolarHBondContact O-N 2.93Å; A357-D359 VanDerWaalsContact O-N 3.08Å; D359-T361 WeakPolarHBondContact O-CG2 3.46Å; D359-T361 PolarHBondContact O-N 2.58Å; D359-T361 WeakPolarHBondContact OD1-CB 3.48Å; D359-T361 PolarHBondContact OD1-N 3.08Å; D359-T361 PolarHBondContact OD1-OG1 3.22Å; D359-T361 PolarHBondContact OD2-OG1 2.74Å; D359-T361 VanDerWaalsContact OD2-OG1 3.09Å; D359-R363 IonicContact OD2-CZ 3.4Å; D359-R363 IonicContact OD2-NE 2.99Å; D359-R363 IonicContact OD2-NH2 3.62Å; D359-R363 PolarHBondContact OD2-NH2 2.94Å
360	K	95	Very high	92.8	Very high	84 Å²	84	28 Å²	28	37%	0.365	13%	0.129	S	C	.	.	S	Bend	trans	69.5	7.5	-179.3	-41	176.4	177.8	-165.3	0	113.6	A357 A378 E380 H381 F382	A357-K360 PolarHBondContact O-N 3.39Å; K360-A378 PolarHBondContact O-N 2.95Å; K360-A378 VanDerWaalsContact O-N 3.07Å; K360-E380 VanDerWaalsContact CD-O 3.31Å; K360-E380 WeakPolarHBondContact CD-O 3.49Å; K360-E380 VanDerWaalsContact CE-O 3.28Å; K360-E380 WeakPolarHBondContact CE-O 3.34Å; K360-E380 PolarHBondContact NZ-O 3.48Å; K360-H381 WeakPolarHBondContact CB-O 3.44Å; K360-F382 HydrophobicContact CG-CD1 4.25Å
361	T	95.4	Very high	92.9	Very high	16 Å²	16	34.6 Å²	34.6	10%	0.098	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	147.7	-175.2	74.5	0	0	0	0	113	H337 C356 A357 D359 R363 T375 L376	H337-T361 PolarHBondContact CE1-OG1 2.99Å; H337-T361 PolarHBondContact ND1-OG1 3.49Å; C356-T361 WeakPolarHBondContact CA-O 3.3Å; A357-T361 PolarHBondContact N-O 3.08Å; D359-T361 WeakPolarHBondContact O-CG2 3.46Å; D359-T361 PolarHBondContact O-N 2.58Å; D359-T361 WeakPolarHBondContact OD1-CB 3.48Å; D359-T361 PolarHBondContact OD1-N 3.08Å; D359-T361 PolarHBondContact OD1-OG1 3.22Å; D359-T361 PolarHBondContact OD2-OG1 2.74Å; D359-T361 VanDerWaalsContact OD2-OG1 3.09Å; T361-R363 PolarHBondContact OG1-NE 3.2Å; T361-R363 VanDerWaalsContact OG1-NE 3.16Å; T361-T375 HydrophobicContact CG2-CG2 3.85Å; T361-L376 CarbonylContact C-O 3.54Å; T361-L376 WeakPolarHBondContact CA-O 3.3Å; T361-L376 WeakPolarHBondContact CB-O 3.39Å
362	L	95.4	Very high	93	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	124.3	159.5	-177.5	73.8	0	0	0	107.2	P96 V354 S355 C356 L376 A378 L386 V395 T397	P96-L362 HydrophobicContact CG-CD2 4.06Å; V354-L362 HydrophobicContact CG1-CD1 3.51Å; V354-L362 HydrophobicContact CG1-CD2 4.45Å; V354-L362 HydrophobicContact CG1-CG 4.04Å; S355-L362 CarbonylContact O-C 3.57Å; S355-L362 WeakPolarHBondContact O-CA 3.35Å; C356-L362 HydrophobicContact CB-CD1 4.17Å; L362-L376 HydrophobicContact CB-CB 4.3Å; L362-L376 HydrophobicContact CD2-CD1 4.22Å; L362-L376 PolarHBondContact N-O 2.93Å; L362-L376 PolarHBondContact O-N 3.06Å; L362-A378 HydrophobicContact CB-CB 4.03Å; L362-L386 HydrophobicContact CD1-CB 4.35Å; L362-L386 HydrophobicContact CD1-CD2 4Å; L362-V395 HydrophobicContact CD2-CG1 4.37Å; L362-T397 HydrophobicContact CD1-CG2 4.06Å; L362-T397 HydrophobicContact CD2-CG2 4.09Å
363	R	95.4	Very high	92.9	Very high	22 Å²	22	37 Å²	37	8%	0.083	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	143.8	-179.6	-66.5	-173.3	-168.7	-150.2	13.2	111.2	G336 H337 D338 V354 S355 D359 T361 W365 K374 T375	G336-R363 PolarHBondContact O-NH1 3.39Å; G336-R363 PolarHBondContact O-NH2 3.02Å; G336-R363 VanDerWaalsContact O-NH2 3.1Å; H337-R363 VanDerWaalsContact CE1-CD 3.43Å; H337-R363 WeakPolarHBondContact CE1-CD 2.97Å; H337-R363 PolarHBondContact ND1-NE 3.48Å; D338-R363 IonicContact OD2-NH2 3.78Å; D338-R363 PolarHBondContact OD2-NH2 3.4Å; V354-R363 WeakPolarHBondContact CA-O 3.43Å; S355-R363 PolarHBondContact N-O 3.01Å; S355-R363 PolarHBondContact O-N 3.4Å; D359-R363 IonicContact OD2-CZ 3.4Å; D359-R363 IonicContact OD2-NE 2.99Å; D359-R363 IonicContact OD2-NH2 3.62Å; D359-R363 PolarHBondContact OD2-NH2 2.94Å; T361-R363 PolarHBondContact OG1-NE 3.2Å; T361-R363 VanDerWaalsContact OG1-NE 3.16Å; R363-W365 HydrophobicContact CB-CZ2 4.19Å; R363-K374 WeakPolarHBondContact CA-O 3.46Å; R363-T375 HydrophobicContact CG-CG2 4.03Å
364	I	95.1	Very high	92.7	Very high	2 Å²	2	41.6 Å²	41.6	1%	0.01	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	124	177.7	-53.1	169.9	0	0	0	107.4	I95 P96 F352 I353 M373 K374	I95-I364 HydrophobicContact CB-CD1 4.27Å; I95-I364 HydrophobicContact CG2-CD1 3.32Å; P96-I364 HydrophobicContact CG-CD1 3.73Å; P96-I364 HydrophobicContact CG-CG1 4.44Å; F352-I364 HydrophobicContact CB-CG2 4.02Å; F352-I364 HydrophobicContact CD1-CG2 4.37Å; F352-I364 HydrophobicContact CG-CG2 4.18Å; I353-I364 CarbonylContact O-C 3.56Å; I353-I364 WeakPolarHBondContact O-CA 3.4Å; I364-M373 PolarHBondContact O-N 2.89Å; I364-K374 HydrophobicContact CB-CB 4.24Å; I364-K374 HydrophobicContact CD1-CB 4.05Å; I364-K374 HydrophobicContact CG1-CB 4.43Å; I364-K374 PolarHBondContact N-O 3.03Å; I364-K374 PolarHBondContact O-N 3.5Å
365	W	94.5	Very high	92.7	Very high	6 Å²	6	44.8 Å²	44.8	2%	0.023	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	130.3	-173.8	-54.1	82.5	0	0	0	110.2	I320 L334 H337 F352 I353 S355 R363 C372	I320-W365 HydrophobicContact CD1-CZ2 4.21Å; L334-W365 HydrophobicContact CB-CD2 4.41Å; L334-W365 HydrophobicContact CB-CE3 3.91Å; L334-W365 HydrophobicContact CB-CH2 4.5Å; L334-W365 HydrophobicContact CB-CZ3 3.96Å; L334-W365 HydrophobicContact CD1-CB 4.04Å; L334-W365 HydrophobicContact CD1-CD2 4.2Å; L334-W365 HydrophobicContact CD1-CE3 4.24Å; L334-W365 HydrophobicContact CD1-CG 4.12Å; L334-W365 HydrophobicContact CD2-CE3 4.39Å; L334-W365 HydrophobicContact CG-CE3 4.41Å; H337-W365 AromaticContact CD2-CZ2 3.92Å; F352-W365 WeakPolarHBondContact CA-O 3.49Å; I353-W365 HydrophobicContact CB-CB 4.19Å; I353-W365 PolarHBondContact N-O 2.88Å; I353-W365 PolarHBondContact O-N 3.15Å; S355-W365 PolarHBondContact OG-NE1 3.27Å; R363-W365 HydrophobicContact CB-CZ2 4.19Å; W365-C372 HydrophobicContact CD2-CB 4.4Å; W365-C372 HydrophobicContact CE3-CB 3.87Å; W365-C372 HydrophobicContact CH2-CB 4.24Å; W365-C372 HydrophobicContact CZ3-CB 3.79Å
366	D	91.8	Very high	92.5	Very high	13 Å²	13	45.1 Å²	45.1	7%	0.07	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	92.8	165.3	177.1	-4	0	0	0	106.8	F352 K368 N369 K370 R371 M373	F352-D366 HydrophobicContact CD1-CB 4.34Å; F352-D366 HydrophobicContact CE1-CB 4.32Å; D366-K368 VanDerWaalsContact C-N 3.27Å; D366-K368 PolarHBondContact O-N 3.4Å; D366-K368 PolarHBondContact OD1-N 3.29Å; D366-N369 CarbonylContact O-C 3.55Å; D366-N369 PolarHBondContact O-N 3.43Å; D366-N369 PolarHBondContact OD1-N 3.46Å; D366-N369 PolarHBondContact OD2-ND2 3.39Å; D366-K370 PolarHBondContact O-N 3.22Å; D366-R371 HydrophobicContact CB-CG 4.17Å; D366-R371 PolarHBondContact N-O 3.4Å; D366-R371 PolarHBondContact O-N 2.87Å; D366-R371 IonicContact OD2-NE 2.65Å; D366-R371 IonicContact OD2-NH2 3.23Å; D366-M373 HydrophobicContact CB-CB 4.31Å
367	Y	88.3	Confident	92.3	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-15.7	-174	65.7	-93.6	0	0	0	112.8	A289 T292 I293 A296 M332 G350 K351 I353 K370	A289-Y367 PolarHBondContact O-OH 3.11Å; T292-Y367 VanDerWaalsContact CB-OH 3.25Å; T292-Y367 WeakPolarHBondContact CB-OH 3.47Å; T292-Y367 HydrophobicContact CG2-CE1 4.5Å; T292-Y367 HydrophobicContact CG2-CE2 3.77Å; T292-Y367 WeakPolarHBondContact CG2-OH 3.45Å; I293-Y367 HydrophobicContact CB-CE2 4.44Å; I293-Y367 HydrophobicContact CG1-CE2 3.64Å; A296-Y367 HydrophobicContact CB-CD2 4.22Å; A296-Y367 HydrophobicContact CB-CE2 4.48Å; M332-Y367 HydrophobicContact CE-CD2 4.45Å; M332-Y367 HydrophobicContact SD-CD2 4.37Å; G350-Y367 WeakPolarHBondContact O-CE1 3.48Å; G350-Y367 PolarHBondContact O-OH 3.16Å; K351-Y367 WeakPolarHBondContact O-CE1 3.47Å; I353-Y367 HydrophobicContact CD1-CD1 3.64Å; I353-Y367 HydrophobicContact CD1-CE1 4.33Å; I353-Y367 HydrophobicContact CD1-CG 3.94Å; I353-Y367 HydrophobicContact CG1-CD1 3.67Å; I353-Y367 HydrophobicContact CG1-CE1 4.09Å; I353-Y367 HydrophobicContact CG1-CG 4.47Å; Y367-K370 PolarHBondContact O-N 2.91Å
368	K	87.9	Confident	92.1	Very high	103 Å²	103	49.9 Å²	49.9	45%	0.448	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-43.6	168.5	179.4	173.4	171.8	161.9	0	111	T292 D295 A296 D366	T292-K368 HydrophobicContact CG2-CB 4.35Å; D295-K368 WeakPolarHBondContact OD2-CE 3.31Å; D295-K368 IonicContact OD2-NZ 3.12Å; D295-K368 PolarHBondContact OD2-NZ 3.28Å; A296-K368 HydrophobicContact CB-CB 4.36Å; D366-K368 VanDerWaalsContact C-N 3.27Å; D366-K368 PolarHBondContact O-N 3.4Å; D366-K368 PolarHBondContact OD1-N 3.29Å
369	N	85.9	Confident	92.1	Very high	92 Å²	92	49.9 Å²	49.9	49%	0.492	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.3	6.7	177.2	-64.8	-47.9	0	0	0	113.5	D366 R371	D366-N369 CarbonylContact O-C 3.55Å; D366-N369 PolarHBondContact O-N 3.43Å; D366-N369 PolarHBondContact OD1-N 3.46Å; D366-N369 PolarHBondContact OD2-ND2 3.39Å; N369-R371 HydrophobicContact CB-CG 4Å; N369-R371 PolarHBondContact O-N 3.15Å; N369-R371 VanDerWaalsContact O-N 3.15Å
370	K	85.1	Confident	92	Very high	137 Å²	137	56.4 Å²	56.4	60%	0.596	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.4	38	-178.3	-59.3	-176.8	-179	179.3	0	114	D366 Y367	D366-K370 PolarHBondContact O-N 3.22Å; Y367-K370 PolarHBondContact O-N 2.91Å
371	R	89.1	Confident	92	Very high	138 Å²	138	55.9 Å²	55.9	52%	0.521	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	148.6	-176.3	67.9	-178.7	178.9	173	-0.9	112.8	D366 N369 M373	D366-R371 HydrophobicContact CB-CG 4.17Å; D366-R371 PolarHBondContact N-O 3.4Å; D366-R371 PolarHBondContact O-N 2.87Å; D366-R371 IonicContact OD2-NE 2.65Å; D366-R371 IonicContact OD2-NH2 3.23Å; N369-R371 HydrophobicContact CB-CG 4Å; N369-R371 PolarHBondContact O-N 3.15Å; N369-R371 VanDerWaalsContact O-N 3.15Å; R371-M373 PolarHBondContact O-N 3.16Å
372	C	91.9	Very high	92	Very high	46 Å²	46	58.2 Å²	58.2	31%	0.311	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	109.9	164.7	-174.4	0	0	0	0	108.2	W365	W365-C372 HydrophobicContact CD2-CB 4.4Å; W365-C372 HydrophobicContact CE3-CB 3.87Å; W365-C372 HydrophobicContact CH2-CB 4.24Å; W365-C372 HydrophobicContact CZ3-CB 3.79Å
373	M	90.1	Very high	92.1	Very high	86 Å²	86	58.2 Å²	58.2	42%	0.424	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	-39.2	-177.3	-177.5	175.2	-176.8	0	0	111.7	I95 F352 I364 D366 R371	I95-M373 HydrophobicContact CD1-CE 3.64Å; I95-M373 HydrophobicContact CD1-SD 3.86Å; F352-M373 HydrophobicContact CD1-SD 4.27Å; F352-M373 HydrophobicContact CE1-SD 3.49Å; F352-M373 WeakPolarHBondContact CE1-SD 3.33Å; F352-M373 HydrophobicContact CZ-SD 3.89Å; I364-M373 PolarHBondContact O-N 2.89Å; D366-M373 HydrophobicContact CB-CB 4.31Å; R371-M373 PolarHBondContact O-N 3.16Å
374	K	91.3	Very high	92.1	Very high	96 Å²	96	58.2 Å²	58.2	42%	0.417	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	138.5	-178.5	-166.4	74	-179.6	-177.8	0	110.4	R363 I364 L376	R363-K374 WeakPolarHBondContact CA-O 3.46Å; I364-K374 HydrophobicContact CB-CB 4.24Å; I364-K374 HydrophobicContact CD1-CB 4.05Å; I364-K374 HydrophobicContact CG1-CB 4.43Å; I364-K374 PolarHBondContact N-O 3.03Å; I364-K374 PolarHBondContact O-N 3.5Å; K374-L376 HydrophobicContact CG-CD2 4.01Å; K374-L376 HydrophobicContact CG-CG 4.15Å
375	T	93.9	Very high	92.1	Very high	68 Å²	68	58.1 Å²	58.1	42%	0.417	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	130	168.5	-55.3	0	0	0	0	108	T361 R363	T361-T375 HydrophobicContact CG2-CG2 3.85Å; R363-T375 HydrophobicContact CG-CG2 4.03Å
376	L	93.3	Very high	92.2	Very high	8 Å²	8	58.2 Å²	58.2	4%	0.042	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	127.1	178.1	-61.2	173.1	0	0	0	108.3	P96 P98 T361 L362 K374 A378	P96-L376 HydrophobicContact CB-CD1 4.13Å; P96-L376 HydrophobicContact CG-CD1 4.04Å; P96-L376 WeakPolarHBondContact O-CD1 3.36Å; P98-L376 HydrophobicContact CG-CD2 4.12Å; T361-L376 CarbonylContact C-O 3.54Å; T361-L376 WeakPolarHBondContact CA-O 3.3Å; T361-L376 WeakPolarHBondContact CB-O 3.39Å; L362-L376 HydrophobicContact CB-CB 4.3Å; L362-L376 HydrophobicContact CD2-CD1 4.22Å; L362-L376 PolarHBondContact N-O 2.93Å; L362-L376 PolarHBondContact O-N 3.06Å; K374-L376 HydrophobicContact CG-CD2 4.01Å; K374-L376 HydrophobicContact CG-CG 4.15Å; L376-A378 PolarHBondContact O-N 3.25Å; L376-A378 VanDerWaalsContact O-N 3.12Å
377	S	93.6	Very high	92.4	Very high	100 Å²	100	59.1 Å²	59.1	70%	0.699	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.6	97.5	168.1	-171	0	0	0	0	107.5
378	A	91.3	Very high	92.7	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	29%	0.293	C	S	.	.			trans	-80	-43.6	-169.1	0	0	0	0	0	111.3	K360 L362 L376 V383 K405 W407	K360-A378 PolarHBondContact O-N 2.95Å; K360-A378 VanDerWaalsContact O-N 3.07Å; L362-A378 HydrophobicContact CB-CB 4.03Å; L376-A378 PolarHBondContact O-N 3.25Å; L376-A378 VanDerWaalsContact O-N 3.12Å; A378-V383 HydrophobicContact CB-CG2 4.06Å; A378-K405 WeakPolarHBondContact O-CD 3.36Å; A378-K405 WeakPolarHBondContact O-CE 3.34Å; A378-K405 PolarHBondContact O-NZ 2.97Å; A378-W407 HydrophobicContact CB-CH2 4.31Å; A378-W407 HydrophobicContact CB-CZ2 3.68Å; A378-W407 WeakPolarHBondContact O-CZ2 3.37Å
379	H	95	Very high	92.8	Very high	5 Å²	5	55.7 Å²	55.7	2%	0.023	28%	0.277	C	S	.	.			trans	-136.7	165.4	-168.8	-77.2	-87.8	0	0	0	112.1	H381 V383 T397 S399 D401 T403	H379-H381 VanDerWaalsContact C-N 3.28Å; H379-H381 WeakPolarHBondContact CB-O 3.29Å; H379-V383 HydrophobicContact CB-CG2 4.22Å; H379-T397 PolarHBondContact NE2-O 3.09Å; H379-T397 PolarHBondContact NE2-OG1 2.82Å; H379-S399 WeakPolarHBondContact CB-OG 3.35Å; H379-S399 VanDerWaalsContact CE1-CB 3.5Å; H379-S399 WeakPolarHBondContact CE1-CB 3.3Å; H379-S399 WeakPolarHBondContact ND1-CB 3.47Å; H379-D401 VanDerWaalsContact CB-OD2 3.25Å; H379-D401 WeakPolarHBondContact CB-OD2 3.37Å; H379-D401 IonicContact CG-OD2 2.92Å; H379-D401 IonicContact ND1-OD1 3.88Å; H379-D401 PolarHBondContact ND1-OD1 2.88Å; H379-D401 IonicContact ND1-OD2 2.78Å; H379-D401 PolarHBondContact ND1-OD2 2.91Å; H379-T403 PolarHBondContact CE1-OG1 3.33Å; H379-T403 VanDerWaalsContact CE1-OG1 3.3Å; H379-T403 PolarHBondContact ND1-OG1 2.98Å; H379-T403 VanDerWaalsContact ND1-OG1 3.15Å
380	E	92.8	Very high	92.8	Very high	163 Å²	163	61.1 Å²	61.1	76%	0.762	29%	0.29	S	S	*	.	S	Bend	trans	-77.6	-22	175.5	-64	-173.8	175.3	0	0	111.8	K360 D401	K360-E380 VanDerWaalsContact CD-O 3.31Å; K360-E380 WeakPolarHBondContact CD-O 3.49Å; K360-E380 VanDerWaalsContact CE-O 3.28Å; K360-E380 WeakPolarHBondContact CE-O 3.34Å; K360-E380 PolarHBondContact NZ-O 3.48Å; E380-D401 PolarHBondContact N-OD2 2.99Å
381	H	95	Very high	92.7	Very high	72 Å²	72	58.3 Å²	58.3	33%	0.333	29%	0.293	S	S	.	.	S	Bend	trans	-124.9	-178	175.4	-147.7	-82.5	0	0	0	111.8	K360 H379 V400 D401	K360-H381 WeakPolarHBondContact CB-O 3.44Å; H379-H381 VanDerWaalsContact C-N 3.28Å; H379-H381 WeakPolarHBondContact CB-O 3.29Å; H381-V400 HydrophobicContact CB-CB 4.27Å; H381-V400 WeakPolarHBondContact ND1-CB 3.21Å; H381-D401 HydrophobicContact CB-CB 4Å
382	F	96.2	Very high	92.5	Very high	65 Å²	65	52.5 Å²	52.5	29%	0.285	27%	0.274	S	S	.	.			trans	-54.8	133.3	-179	-54.8	-19.2	0	0	0	112.4	D358 K360 S399 V400	D358-F382 HydrophobicContact CB-CB 4.19Å; D358-F382 HydrophobicContact CB-CD1 4.07Å; D358-F382 HydrophobicContact CB-CD2 4.13Å; D358-F382 HydrophobicContact CB-CG 3.87Å; D358-F382 WeakPolarHBondContact O-CD1 3.46Å; D358-F382 WeakPolarHBondContact O-CE1 3.5Å; K360-F382 HydrophobicContact CG-CD1 4.25Å; F382-S399 WeakPolarHBondContact O-CA 3.42Å; F382-S399 PolarHBondContact O-OG 3.33Å; F382-S399 VanDerWaalsContact O-OG 3.07Å; F382-V400 HydrophobicContact CB-CG2 3.99Å; F382-V400 PolarHBondContact O-N 2.99Å
383	V	96.9	Very high	92.4	Very high	0 Å²	0	52 Å²	52	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	120.4	177.9	-167.5	0	0	0	0	108.5	R342 C356 A357 A378 H379 G398	R342-V383 WeakPolarHBondContact CB-O 3.5Å; R342-V383 WeakPolarHBondContact CG-O 3.43Å; C356-V383 HydrophobicContact CB-CB 3.8Å; C356-V383 HydrophobicContact CB-CG1 3.5Å; C356-V383 VanDerWaalsContact CB-CG1 3.5Å; A357-V383 PolarHBondContact O-N 3.24Å; A378-V383 HydrophobicContact CB-CG2 4.06Å; H379-V383 HydrophobicContact CB-CG2 4.22Å; V383-G398 VanDerWaalsContact CG1-O 3.29Å; V383-G398 WeakPolarHBondContact CG1-O 3.3Å
384	T	95.7	Very high	92.5	Very high	23 Å²	23	48.6 Å²	48.6	14%	0.141	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	-34	-172.8	54.6	0	0	0	0	112.6	V111 R342 G398 V400	V111-T384 VanDerWaalsContact O-CB 3.28Å; V111-T384 WeakPolarHBondContact O-CB 3.42Å; V111-T384 WeakPolarHBondContact O-CG2 3.26Å; V111-T384 PolarHBondContact O-OG1 3.5Å; R342-T384 WeakPolarHBondContact CB-O 3.37Å; T384-G398 PolarHBondContact N-O 3.05Å; T384-G398 PolarHBondContact OG1-O 3.44Å; T384-G398 VanDerWaalsContact OG1-O 3.09Å; T384-V400 HydrophobicContact CG2-CG2 3.52Å
385	S	95.4	Very high	92.6	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	158.4	-174.4	57.1	0	0	0	0	111.8	T112 R113 V114 T397 G398	T112-S385 WeakPolarHBondContact O-CB 3.5Å; T112-S385 PolarHBondContact O-OG 3.15Å; R113-S385 WeakPolarHBondContact CA-OG 3.42Å; V114-S385 PolarHBondContact N-OG 2.82Å; S385-T397 WeakPolarHBondContact O-CA 3.21Å; S385-G398 PolarHBondContact N-O 3.4Å; S385-G398 PolarHBondContact O-N 3.22Å
386	L	96.1	Very high	92.7	Very high	8 Å²	8	40.8 Å²	40.8	4%	0.042	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	151.2	173.1	79.3	104.7	0	0	0	109.5	L345 V354 C356 L362 V396 T397	L345-L386 HydrophobicContact CB-CD1 4.23Å; L345-L386 HydrophobicContact CD1-CD1 3.72Å; L345-L386 HydrophobicContact CD1-CG 4.33Å; L345-L386 WeakPolarHBondContact CD1-O 3.32Å; L345-L386 HydrophobicContact CG-CD1 4.14Å; V354-L386 HydrophobicContact CB-CD1 4.15Å; V354-L386 HydrophobicContact CG1-CD1 3.78Å; V354-L386 HydrophobicContact CG1-CD2 4.41Å; C356-L386 HydrophobicContact CB-CB 4.49Å; C356-L386 HydrophobicContact CB-CD2 3.61Å; C356-L386 VanDerWaalsContact N-CD2 3.34Å; L362-L386 HydrophobicContact CD1-CB 4.35Å; L362-L386 HydrophobicContact CD1-CD2 4Å; L386-V396 CarbonylContact C-O 3.59Å; L386-V396 WeakPolarHBondContact CA-O 3.35Å; L386-T397 HydrophobicContact CB-CG2 4.13Å
387	D	96.2	Very high	92.9	Very high	31 Å²	31	40.4 Å²	40.4	17%	0.166	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	149.2	167.3	-164	19.6	0	0	0	111.2	I115 F116 L345 V395 V396	I115-D387 WeakPolarHBondContact CA-OD2 3.49Å; F116-D387 HydrophobicContact CD2-CB 4.19Å; F116-D387 PolarHBondContact N-OD2 2.8Å; L345-D387 HydrophobicContact CD1-CB 4.48Å; D387-V395 WeakPolarHBondContact O-CA 3.28Å; D387-V395 WeakPolarHBondContact O-CG1 3.39Å; D387-V396 HydrophobicContact CB-CG2 3.78Å; D387-V396 PolarHBondContact N-O 3.31Å; D387-V396 PolarHBondContact O-N 3.07Å
388	F	93.8	Very high	93	Very high	9 Å²	9	35.7 Å²	35.7	4%	0.039	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	124	-178.5	-158.1	-64.8	0	0	0	109.1	W94 H347 P348 V354 R390 V395	W94-F388 HydrophobicContact CB-CZ 4.14Å; H347-F388 AromaticContact CD2-CE1 3.92Å; H347-F388 AromaticContact CD2-CE2 3.53Å; H347-F388 AromaticContact CD2-CZ 3.37Å; H347-F388 WeakPolarHBondContact CD2-CZ 3.24Å; H347-F388 AromaticContact NE2-CE1 3.93Å; H347-F388 AromaticContact NE2-CZ 3.45Å; H347-F388 WeakPolarHBondContact NE2-CZ 3.44Å; P348-F388 HydrophobicContact CG-CD1 3.45Å; P348-F388 VanDerWaalsContact CG-CD1 3.45Å; P348-F388 HydrophobicContact CG-CE1 3.85Å; P348-F388 HydrophobicContact CG-CG 4.3Å; V354-F388 HydrophobicContact CG2-CD2 4.2Å; V354-F388 HydrophobicContact CG2-CE2 4.49Å; F388-R390 PolarHBondContact O-N 3.16Å; F388-V395 HydrophobicContact CD2-CB 4.41Å; F388-V395 HydrophobicContact CD2-CG1 4.47Å; F388-V395 HydrophobicContact CD2-CG2 3.26Å; F388-V395 HydrophobicContact CE2-CG2 3.23Å; F388-V395 HydrophobicContact CG-CG2 4.01Å; F388-V395 HydrophobicContact CZ-CG2 3.98Å
389	H	91.4	Very high	93.3	Very high	23 Å²	23	35.7 Å²	35.7	11%	0.106	18%	0.178	C	C	.	.			trans	-67.7	131.1	-177.8	-167.9	-84.6	0	0	0	111.3	F116 A391 A392 F394	F116-H389 HydrophobicContact CD1-CB 4.45Å; F116-H389 AromaticContact CD1-CD2 3.75Å; F116-H389 HydrophobicContact CD2-CB 3.8Å; F116-H389 HydrophobicContact CE1-CB 4.41Å; F116-H389 HydrophobicContact CE2-CB 3.74Å; F116-H389 HydrophobicContact CG-CB 4.14Å; F116-H389 AromaticContact CG-CD2 3.72Å; F116-H389 HydrophobicContact CZ-CB 4.04Å; H389-A391 VanDerWaalsContact C-N 3.29Å; H389-A391 PolarHBondContact ND1-N 3.16Å; H389-A391 VanDerWaalsContact ND1-N 3.18Å; H389-A391 PolarHBondContact O-N 3.17Å; H389-A392 HydrophobicContact CB-CB 4.26Å; H389-A392 WeakPolarHBondContact ND1-CB 3.42Å; H389-A392 PolarHBondContact ND1-N 3.15Å; H389-F394 HydrophobicContact CB-CB 4.41Å; H389-F394 PolarHBondContact N-O 3.1Å
390	R	84.6	Confident	93.4	Very high	205 Å²	205	37.4 Å²	37.4	77%	0.774	19%	0.189	S	C	*	.	S	Bend	trans	-64.9	-30.2	-172.2	-66.7	-175.4	-179.2	179.9	1.2	114.2	F388	F388-R390 PolarHBondContact O-N 3.16Å
391	A	83.3	Confident	93.5	Very high	78 Å²	78	31.5 Å²	31.5	65%	0.645	16%	0.163	S	C	*	.	S	Bend	trans	-125.2	-3.8	-171.3	0	0	0	0	0	114.7	W94 H389	W94-A391 WeakPolarHBondContact CH2-O 3.24Å; H389-A391 VanDerWaalsContact C-N 3.29Å; H389-A391 PolarHBondContact ND1-N 3.16Å; H389-A391 VanDerWaalsContact ND1-N 3.18Å; H389-A391 PolarHBondContact O-N 3.17Å
392	A	86	Confident	93.5	Very high	16 Å²	16	31.4 Å²	31.4	13%	0.132	16%	0.163	C	C	.	.	S	Bend	trans	-131.6	152.1	-171.6	0	0	0	0	0	109.1	H389 F394	H389-A392 HydrophobicContact CB-CB 4.26Å; H389-A392 WeakPolarHBondContact ND1-CB 3.42Å; H389-A392 PolarHBondContact ND1-N 3.15Å; A392-F394 HydrophobicContact CB-CD2 3.81Å; A392-F394 HydrophobicContact CB-CE2 4.26Å; A392-F394 PolarHBondContact O-N 3.2Å
393	P	88.1	Confident	93.4	Very high	35 Å²	35	29.6 Å²	29.6	23%	0.227	16%	0.157	C	C	.	.	S	Bend	trans	-79.7	52.4	-174.4	34.2	-37.1	0	0	0	111.7	W94 C409	W94-P393 HydrophobicContact CD2-CB 3.72Å; W94-P393 HydrophobicContact CE3-CB 4.1Å; W94-P393 HydrophobicContact CG-CB 4.08Å; W94-P393 HydrophobicContact CZ2-CB 4.17Å; W94-P393 HydrophobicContact CZ2-CG 4.49Å; W94-P393 HydrophobicContact CZ3-CB 4.48Å; P393-C409 HydrophobicContact CB-CB 3.82Å; P393-C409 WeakPolarHBondContact O-CB 3.24Å; P393-C409 PolarHBondContact O-N 2.72Å
394	F	92.1	Very high	93.4	Very high	16 Å²	16	29.6 Å²	29.6	7%	0.07	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	137.1	-178.5	-61.1	-65.7	0	0	0	112.2	F116 Y137 H389 A392 V406 W407 E408	F116-F394 HydrophobicContact CE1-CB 4.3Å; F116-F394 HydrophobicContact CZ-CB 3.68Å; Y137-F394 AromaticContact CD2-CD2 3.86Å; Y137-F394 HydrophobicContact CD2-CD2 3.86Å; Y137-F394 HydrophobicContact CD2-CE2 4.1Å; Y137-F394 HydrophobicContact CD2-CG 4.28Å; Y137-F394 AromaticContact CE2-CD2 3.54Å; Y137-F394 HydrophobicContact CE2-CD2 3.54Å; Y137-F394 AromaticContact CE2-CE2 3.69Å; Y137-F394 HydrophobicContact CE2-CE2 3.69Å; Y137-F394 HydrophobicContact CE2-CG 4.38Å; H389-F394 HydrophobicContact CB-CB 4.41Å; H389-F394 PolarHBondContact N-O 3.1Å; A392-F394 HydrophobicContact CB-CD2 3.81Å; A392-F394 HydrophobicContact CB-CE2 4.26Å; A392-F394 PolarHBondContact O-N 3.2Å; F394-V406 HydrophobicContact CD1-CG1 4.23Å; F394-W407 WeakPolarHBondContact CA-O 3.22Å; F394-E408 HydrophobicContact CE1-CG 4.48Å
395	V	94.8	Very high	93.4	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	140.3	167.6	-172.6	0	0	0	0	107.7	P96 L362 D387 F388 W407 C409	P96-V395 HydrophobicContact CB-CB 4.45Å; P96-V395 HydrophobicContact CB-CG2 4.06Å; P96-V395 HydrophobicContact CG-CG2 3.98Å; L362-V395 HydrophobicContact CD2-CG1 4.37Å; D387-V395 WeakPolarHBondContact O-CA 3.28Å; D387-V395 WeakPolarHBondContact O-CG1 3.39Å; F388-V395 HydrophobicContact CD2-CB 4.41Å; F388-V395 HydrophobicContact CD2-CG1 4.47Å; F388-V395 HydrophobicContact CD2-CG2 3.26Å; F388-V395 HydrophobicContact CE2-CG2 3.23Å; F388-V395 HydrophobicContact CG-CG2 4.01Å; F388-V395 HydrophobicContact CZ-CG2 3.98Å; V395-W407 HydrophobicContact CB-CB 4.18Å; V395-W407 PolarHBondContact N-O 3.26Å; V395-W407 PolarHBondContact O-N 3.48Å; V395-C409 VanDerWaalsContact CG2-SG 3.59Å
396	V	96.2	Very high	93.4	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	140.1	173.9	-69.9	0	0	0	0	109.2	V114 F116 M123 L386 D387 K405 V406	V114-V396 HydrophobicContact CB-CG2 4.22Å; V114-V396 HydrophobicContact CG1-CB 3.83Å; V114-V396 HydrophobicContact CG1-CG2 3.49Å; V114-V396 VanDerWaalsContact CG1-CG2 3.49Å; F116-V396 HydrophobicContact CD2-CG2 3.92Å; F116-V396 HydrophobicContact CE1-CG1 3.72Å; F116-V396 HydrophobicContact CE2-CB 4.18Å; F116-V396 HydrophobicContact CE2-CG1 3.83Å; F116-V396 HydrophobicContact CE2-CG2 3.53Å; F116-V396 HydrophobicContact CZ-CB 4.11Å; F116-V396 HydrophobicContact CZ-CG1 3.25Å; F116-V396 HydrophobicContact CZ-CG2 3.89Å; M123-V396 HydrophobicContact SD-CB 4.03Å; M123-V396 HydrophobicContact SD-CG1 3.33Å; M123-V396 WeakPolarHBondContact SD-CG1 3.23Å; L386-V396 CarbonylContact C-O 3.59Å; L386-V396 WeakPolarHBondContact CA-O 3.35Å; D387-V396 HydrophobicContact CB-CG2 3.78Å; D387-V396 PolarHBondContact N-O 3.31Å; D387-V396 PolarHBondContact O-N 3.07Å; V396-K405 WeakPolarHBondContact CA-O 3.34Å; V396-V406 HydrophobicContact CG1-CG1 4.29Å; V396-V406 HydrophobicContact CG1-CG2 4.18Å
397	T	96.9	Very high	93.3	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	136.8	176.5	58.2	0	0	0	0	110.2	L362 H379 S385 L386 V404 K405 W407	L362-T397 HydrophobicContact CD1-CG2 4.06Å; L362-T397 HydrophobicContact CD2-CG2 4.09Å; H379-T397 PolarHBondContact NE2-O 3.09Å; H379-T397 PolarHBondContact NE2-OG1 2.82Å; S385-T397 WeakPolarHBondContact O-CA 3.21Å; L386-T397 HydrophobicContact CB-CG2 4.13Å; T397-V404 CarbonylContact O-C 3.55Å; T397-V404 WeakPolarHBondContact O-CA 3.09Å; T397-K405 PolarHBondContact N-O 3Å; T397-K405 PolarHBondContact O-N 3.04Å; T397-W407 PolarHBondContact OG1-NE1 3Å
398	G	96.5	Very high	93	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	147.8	171.8	0	0	0	0	0	110.6	V383 T384 S385	V383-G398 VanDerWaalsContact CG1-O 3.29Å; V383-G398 WeakPolarHBondContact CG1-O 3.3Å; T384-G398 PolarHBondContact N-O 3.05Å; T384-G398 PolarHBondContact OG1-O 3.44Å; T384-G398 VanDerWaalsContact OG1-O 3.09Å; S385-G398 PolarHBondContact N-O 3.4Å; S385-G398 PolarHBondContact O-N 3.22Å
399	S	97	Very high	92.7	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	163.6	-176.1	168.6	0	0	0	0	112.6	V111 H379 F382 D401 Q402 T403	V111-S399 PolarHBondContact N-O 2.86Å; V111-S399 VanDerWaalsContact N-O 3.11Å; H379-S399 WeakPolarHBondContact CB-OG 3.35Å; H379-S399 VanDerWaalsContact CE1-CB 3.5Å; H379-S399 WeakPolarHBondContact CE1-CB 3.3Å; H379-S399 WeakPolarHBondContact ND1-CB 3.47Å; F382-S399 WeakPolarHBondContact O-CA 3.42Å; F382-S399 PolarHBondContact O-OG 3.33Å; F382-S399 VanDerWaalsContact O-OG 3.07Å; S399-D401 WeakPolarHBondContact CB-OD1 3.21Å; S399-D401 PolarHBondContact O-N 2.91Å; S399-D401 PolarHBondContact OG-N 3.41Å; S399-D401 PolarHBondContact OG-OD1 3.33Å; S399-D401 VanDerWaalsContact OG-OD1 3.1Å; S399-D401 PolarHBondContact OG-OD2 3.39Å; S399-D401 VanDerWaalsContact OG-OD2 3.08Å; S399-Q402 PolarHBondContact O-N 2.69Å; S399-T403 PolarHBondContact N-O 2.98Å
400	V	96.1	Very high	91.9	Very high	42 Å²	42	36.4 Å²	36.4	26%	0.255	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-20.5	172.9	179.6	0	0	0	0	112.1	P110 H381 F382 T384 Q402	P110-V400 HydrophobicContact CB-CB 4.43Å; P110-V400 HydrophobicContact CB-CG1 4.23Å; P110-V400 HydrophobicContact CG-CG1 3.85Å; H381-V400 HydrophobicContact CB-CB 4.27Å; H381-V400 WeakPolarHBondContact ND1-CB 3.21Å; F382-V400 HydrophobicContact CB-CG2 3.99Å; F382-V400 PolarHBondContact O-N 2.99Å; T384-V400 HydrophobicContact CG2-CG2 3.52Å; V400-Q402 PolarHBondContact O-N 3.01Å
401	D	94.4	Very high	92.2	Very high	38 Å²	38	28 Å²	28	20%	0.203	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	7.8	172.8	65.4	18.8	0	0	0	114.2	H379 E380 H381 S399 T403	H379-D401 VanDerWaalsContact CB-OD2 3.25Å; H379-D401 WeakPolarHBondContact CB-OD2 3.37Å; H379-D401 IonicContact CG-OD2 2.92Å; H379-D401 IonicContact ND1-OD1 3.88Å; H379-D401 PolarHBondContact ND1-OD1 2.88Å; H379-D401 IonicContact ND1-OD2 2.78Å; H379-D401 PolarHBondContact ND1-OD2 2.91Å; E380-D401 PolarHBondContact N-OD2 2.99Å; H381-D401 HydrophobicContact CB-CB 4Å; S399-D401 WeakPolarHBondContact CB-OD1 3.21Å; S399-D401 PolarHBondContact O-N 2.91Å; S399-D401 PolarHBondContact OG-N 3.41Å; S399-D401 PolarHBondContact OG-OD1 3.33Å; S399-D401 VanDerWaalsContact OG-OD1 3.1Å; S399-D401 PolarHBondContact OG-OD2 3.39Å; S399-D401 VanDerWaalsContact OG-OD2 3.08Å; D401-T403 VanDerWaalsContact CG-OG1 3.26Å; D401-T403 PolarHBondContact O-N 3.31Å; D401-T403 WeakPolarHBondContact OD1-CB 3.47Å; D401-T403 PolarHBondContact OD1-N 3.12Å; D401-T403 PolarHBondContact OD1-OG1 3.17Å; D401-T403 PolarHBondContact OD2-OG1 2.93Å
402	Q	95.1	Very high	92.7	Very high	71 Å²	71	25.3 Å²	25.3	33%	0.332	12%	0.124	S	C	.	.	S	Bend	trans	69.4	9.5	176.4	-39.7	-180	-2.7	0	0	113.8	H107 R108 S399 V400	H107-Q402 PolarHBondContact O-OE1 3.33Å; R108-Q402 VanDerWaalsContact O-CD 3.3Å; R108-Q402 PolarHBondContact O-NE2 2.93Å; R108-Q402 PolarHBondContact O-OE1 2.85Å; S399-Q402 PolarHBondContact O-N 2.69Å; V400-Q402 PolarHBondContact O-N 3.01Å
403	T	95.7	Very high	93.1	Very high	27 Å²	27	25.8 Å²	25.8	17%	0.166	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	148.4	178.2	70.2	0	0	0	0	112	L104 H379 S399 D401	L104-T403 WeakPolarHBondContact O-CA 3.19Å; H379-T403 PolarHBondContact CE1-OG1 3.33Å; H379-T403 VanDerWaalsContact CE1-OG1 3.3Å; H379-T403 PolarHBondContact ND1-OG1 2.98Å; H379-T403 VanDerWaalsContact ND1-OG1 3.15Å; S399-T403 PolarHBondContact N-O 2.98Å; D401-T403 VanDerWaalsContact CG-OG1 3.26Å; D401-T403 PolarHBondContact O-N 3.31Å; D401-T403 WeakPolarHBondContact OD1-CB 3.47Å; D401-T403 PolarHBondContact OD1-N 3.12Å; D401-T403 PolarHBondContact OD1-OG1 3.17Å; D401-T403 PolarHBondContact OD2-OG1 2.93Å
404	V	96.5	Very high	93.4	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	120.7	165.9	-179	0	0	0	0	107.5	L104 V111 V114 M123 T397	L104-V404 HydrophobicContact CB-CB 4.4Å; L104-V404 PolarHBondContact N-O 3.18Å; L104-V404 PolarHBondContact O-N 3.34Å; V111-V404 HydrophobicContact CG1-CG2 4.12Å; V111-V404 HydrophobicContact CG2-CG2 3.98Å; V114-V404 HydrophobicContact CG1-CG1 3.98Å; V114-V404 HydrophobicContact CG2-CG1 4.06Å; V114-V404 HydrophobicContact CG2-CG2 4.08Å; M123-V404 HydrophobicContact CE-CB 4.5Å; M123-V404 HydrophobicContact CE-CG1 3.66Å; M123-V404 HydrophobicContact SD-CG1 3.97Å; T397-V404 CarbonylContact O-C 3.55Å; T397-V404 WeakPolarHBondContact O-CA 3.09Å
405	K	95.9	Very high	93.5	Very high	25 Å²	25	25.9 Å²	25.9	11%	0.109	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	135.7	177.9	-72.2	-176.2	-178.3	-162.7	0	111	E100 Y102 A103 A378 V396 T397 W407	E100-K405 HydrophobicContact CB-CB 4.44Å; E100-K405 HydrophobicContact CB-CD 4.29Å; E100-K405 HydrophobicContact CG-CD 4.16Å; E100-K405 HydrophobicContact CG-CG 4.5Å; E100-K405 WeakPolarHBondContact OE1-CE 3.49Å; E100-K405 IonicContact OE1-NZ 3.59Å; E100-K405 PolarHBondContact OE1-NZ 3.38Å; Y102-K405 WeakPolarHBondContact O-CA 3.35Å; A103-K405 HydrophobicContact CB-CG 4.3Å; A378-K405 WeakPolarHBondContact O-CD 3.36Å; A378-K405 WeakPolarHBondContact O-CE 3.34Å; A378-K405 PolarHBondContact O-NZ 2.97Å; V396-K405 WeakPolarHBondContact CA-O 3.34Å; T397-K405 PolarHBondContact N-O 3Å; T397-K405 PolarHBondContact O-N 3.04Å; K405-W407 HydrophobicContact CB-CZ2 4.07Å; K405-W407 HydrophobicContact CD-CH2 4.32Å; K405-W407 HydrophobicContact CD-CZ2 3.81Å
406	V	95.3	Very high	93.4	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	124.4	174.4	-170.9	0	0	0	0	108.4	R101 Y102 M123 F394 V396	R101-V406 PolarHBondContact N-O 3.45Å; Y102-V406 HydrophobicContact CD2-CB 4.43Å; Y102-V406 PolarHBondContact N-O 3.07Å; Y102-V406 PolarHBondContact O-N 3.03Å; M123-V406 HydrophobicContact CE-CG2 3.67Å; M123-V406 HydrophobicContact SD-CG2 4.18Å; F394-V406 HydrophobicContact CD1-CG1 4.23Å; V396-V406 HydrophobicContact CG1-CG1 4.29Å; V396-V406 HydrophobicContact CG1-CG2 4.18Å
407	W	94	Very high	93.2	Very high	3 Å²	3	29.6 Å²	29.6	1%	0.011	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	130.3	-178.9	-52.4	86.4	0	0	0	109.9	P96 E100 A378 F394 V395 T397 K405	P96-W407 HydrophobicContact CB-CB 3.84Å; P96-W407 HydrophobicContact CB-CG 4.47Å; E100-W407 HydrophobicContact CB-CD2 4.41Å; E100-W407 HydrophobicContact CB-CE3 4.1Å; E100-W407 HydrophobicContact CB-CH2 4.1Å; E100-W407 HydrophobicContact CB-CZ2 4.41Å; E100-W407 HydrophobicContact CB-CZ3 3.94Å; A378-W407 HydrophobicContact CB-CH2 4.31Å; A378-W407 HydrophobicContact CB-CZ2 3.68Å; A378-W407 WeakPolarHBondContact O-CZ2 3.37Å; F394-W407 WeakPolarHBondContact CA-O 3.22Å; V395-W407 HydrophobicContact CB-CB 4.18Å; V395-W407 PolarHBondContact N-O 3.26Å; V395-W407 PolarHBondContact O-N 3.48Å; T397-W407 PolarHBondContact OG1-NE1 3Å; K405-W407 HydrophobicContact CB-CZ2 4.07Å; K405-W407 HydrophobicContact CD-CH2 4.32Å; K405-W407 HydrophobicContact CD-CZ2 3.81Å
408	E	90	Very high	92.9	Very high	53 Å²	53	31.8 Å²	31.8	25%	0.248	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	131.5	170.5	-173.6	176.5	-119.4	0	0	109.8	R97 R101 F394 R410	R97-E408 PolarHBondContact N-O 2.8Å; R101-E408 IonicContact NH1-OE1 3.74Å; F394-E408 HydrophobicContact CE1-CG 4.48Å; E408-R410 HydrophobicContact CG-CG 4.5Å; E408-R410 IonicContact OE2-CZ 2.85Å; E408-R410 IonicContact OE2-NE 3.38Å; E408-R410 PolarHBondContact OE2-NE 2.81Å; E408-R410 IonicContact OE2-NH2 3.8Å; E408-R410 PolarHBondContact OE2-NH2 3.41Å
409	C	86.5	Confident	92.6	Very high	8 Å²	8	34.5 Å²	34.5	5%	0.054	16%	0.161	C	C	.	.	B	Isolated β-bridge	trans	-87.4	132.8	174.8	-59	0	0	0	0	110.3	W94 I95 P393 V395	W94-C409 HydrophobicContact CB-CB 3.57Å; W94-C409 HydrophobicContact CG-CB 4.05Å; I95-C409 WeakPolarHBondContact O-CA 3.32Å; P393-C409 HydrophobicContact CB-CB 3.82Å; P393-C409 WeakPolarHBondContact O-CB 3.24Å; P393-C409 PolarHBondContact O-N 2.72Å; V395-C409 VanDerWaalsContact CG2-SG 3.59Å
410	R	74.6	Confident	92.2	Very high	147 Å²	147	37.6 Å²	37.6	56%	0.555	18%	0.176	S	C	*	.			trans	-131.7	0	177.5	-63.7	-175.4	-173.6	177.9	2.6	111.7	R89 I95 R97 E408	R89-R410 WeakPolarHBondContact CD-OXT 3.36Å; R89-R410 PolarHBondContact NH1-O 2.95Å; R89-R410 PolarHBondContact NH1-OXT 3.31Å; I95-R410 PolarHBondContact O-N 3.46Å; R97-R410 HydrophobicContact CG-CB 4.31Å; R97-R410 VanDerWaalsContact CZ-O 3.26Å; R97-R410 PolarHBondContact NE-O 3.37Å; R97-R410 PolarHBondContact NH2-O 2.79Å; E408-R410 HydrophobicContact CG-CG 4.5Å; E408-R410 IonicContact OE2-CZ 2.85Å; E408-R410 IonicContact OE2-NE 3.38Å; E408-R410 PolarHBondContact OE2-NE 2.81Å; E408-R410 IonicContact OE2-NH2 3.8Å; E408-R410 PolarHBondContact OE2-NH2 3.41Å

Retrieved 410 of 410 residues in 156.9 ms (Link to these results)

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