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Ephrin-A3

Cell surface GPI-bound ligand for Eph receptors, a family of receptor tyrosine kinases which are crucial for migration, repulsion and adhesion during neuronal, vascular and epithelial development. Binds promiscuously Eph receptors residing on adjacent cells, leading to contact-dependent bidirectional signaling into neighboring cells. The signaling pathway downstream of the receptor is referred to as forward signaling while the signaling pathway downstream of the ephrin ligand is referred to as reverse signaling.

AlphaFold DB , UniProt , Accession A0A096M749, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 221 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	56.6	Low	62.4	Low	216 Å²	216	111.5 Å²	111.5	100%	1.064	62%	0.615	S	S	*	*				0	-55.1	0	-65	-68	-86.9	0	0	112.4	L3 A4 S5	M1-L3 PolarHBondContact O-N 3.3Å; M1-A4 PolarHBondContact O-N 3.37Å; M1-S5 PolarHBondContact O-OG 2.97Å
2	A	59.1	Low	62.3	Low	71 Å²	71	107.7 Å²	107.7	59%	0.587	60%	0.597	S	S	*	*	H	α-helix	trans	-68.5	-31.1	-176.4	0	0	0	0	0	115.7	S5 L6	A2-S5 WeakPolarHBondContact CA-OG 3.39Å; A2-S5 PolarHBondContact O-OG 3.42Å; A2-L6 PolarHBondContact O-N 3.07Å
3	L	57.4	Low	62.2	Low	147 Å²	147	104.9 Å²	104.9	77%	0.77	59%	0.59	S	S	*	*	H	α-helix	trans	-71.8	-34.3	178.9	-77.2	164.1	0	0	0	112.8	M1 L6 S7	M1-L3 PolarHBondContact O-N 3.3Å; L3-L6 PolarHBondContact O-N 2.96Å; L3-S7 PolarHBondContact O-N 3.37Å
4	A	61.1	Low	61.9	Low	62 Å²	62	106 Å²	106	51%	0.512	59%	0.592	S	S	.	*	H	α-helix	trans	-69.7	-35.5	177.3	0	0	0	0	0	111.9	M1 S7 L8	M1-A4 PolarHBondContact O-N 3.37Å; A4-S7 PolarHBondContact O-OG 3.27Å; A4-S7 VanDerWaalsContact O-OG 3.14Å; A4-L8 WeakPolarHBondContact O-CB 3.29Å; A4-L8 PolarHBondContact O-N 3.08Å; A4-L8 VanDerWaalsContact O-N 3.1Å
5	S	62.3	Low	61.5	Low	65 Å²	65	105.9 Å²	105.9	46%	0.455	60%	0.595	S	S	.	*	H	α-helix	trans	-68.5	-35.7	173.7	43.2	0	0	0	0	112.6	M1 A2 W9	M1-S5 PolarHBondContact O-OG 2.97Å; A2-S5 WeakPolarHBondContact CA-OG 3.39Å; A2-S5 PolarHBondContact O-OG 3.42Å; S5-W9 WeakPolarHBondContact O-CB 3.38Å; S5-W9 VanDerWaalsContact O-CD1 3.26Å; S5-W9 PolarHBondContact O-N 2.91Å; S5-W9 VanDerWaalsContact O-N 3.13Å
6	L	64.8	Low	60.9	Low	110 Å²	110	113.3 Å²	113.3	58%	0.576	61%	0.612	S	S	*	*	H	α-helix	trans	-69	-41.6	175.6	-87.6	154.8	0	0	0	111.9	A2 L3 W9 V10	A2-L6 PolarHBondContact O-N 3.07Å; L3-L6 PolarHBondContact O-N 2.96Å; L6-W9 PolarHBondContact O-N 2.95Å; L6-V10 VanDerWaalsContact O-CG2 3.31Å; L6-V10 WeakPolarHBondContact O-CG2 3.29Å; L6-V10 PolarHBondContact O-N 2.89Å
7	S	65.8	Low	60.3	Low	61 Å²	61	110.1 Å²	110.1	43%	0.427	61%	0.611	S	S	.	*	H	α-helix	trans	-67.1	-37.7	177.6	74.8	0	0	0	0	112.2	L3 A4 V10 L11	L3-S7 PolarHBondContact O-N 3.37Å; A4-S7 PolarHBondContact O-OG 3.27Å; A4-S7 VanDerWaalsContact O-OG 3.14Å; S7-V10 PolarHBondContact O-N 2.88Å; S7-L11 WeakPolarHBondContact O-CB 3.48Å; S7-L11 WeakPolarHBondContact O-CD1 3.49Å; S7-L11 WeakPolarHBondContact O-CG 3.14Å; S7-L11 PolarHBondContact O-N 2.86Å
8	L	65	Low	60.1	Low	117 Å²	117	109.8 Å²	109.8	61%	0.613	62%	0.618	S	S	*	*	H	α-helix	trans	-65	-39.3	176	-140.1	80	0	0	0	111.7	A4 L11 T12	A4-L8 WeakPolarHBondContact O-CB 3.29Å; A4-L8 PolarHBondContact O-N 3.08Å; A4-L8 VanDerWaalsContact O-N 3.1Å; L8-L11 PolarHBondContact O-N 2.93Å; L8-T12 WeakPolarHBondContact O-CG2 3.46Å; L8-T12 PolarHBondContact O-N 3.03Å; L8-T12 PolarHBondContact O-OG1 3.02Å; L8-T12 VanDerWaalsContact O-OG1 3.05Å
9	W	64.2	Low	59.7	Low	195 Å²	195	110.3 Å²	110.3	74%	0.739	62%	0.624	S	S	*	*	H	α-helix	trans	-66.6	-37.1	174.2	-95.6	80.4	0	0	0	113.3	S5 L6 T12 S13	S5-W9 WeakPolarHBondContact O-CB 3.38Å; S5-W9 VanDerWaalsContact O-CD1 3.26Å; S5-W9 PolarHBondContact O-N 2.91Å; S5-W9 VanDerWaalsContact O-N 3.13Å; L6-W9 PolarHBondContact O-N 2.95Å; W9-T12 WeakPolarHBondContact CA-OG1 3.38Å; W9-T12 PolarHBondContact O-OG1 3Å; W9-S13 WeakPolarHBondContact O-CB 3.47Å; W9-S13 PolarHBondContact O-N 2.82Å; W9-S13 VanDerWaalsContact O-N 3.1Å; W9-S13 PolarHBondContact O-OG 3.29Å
10	V	67.3	Low	59.5	Low	78 Å²	78	112.6 Å²	112.6	47%	0.473	63%	0.633	S	S	.	*	H	α-helix	trans	-69.9	-39.2	175.1	171.7	0	0	0	0	110.7	L6 S7 S13 L14	L6-V10 VanDerWaalsContact O-CG2 3.31Å; L6-V10 WeakPolarHBondContact O-CG2 3.29Å; L6-V10 PolarHBondContact O-N 2.89Å; S7-V10 PolarHBondContact O-N 2.88Å; V10-S13 WeakPolarHBondContact CA-OG 3.48Å; V10-S13 PolarHBondContact O-N 2.95Å; V10-S13 PolarHBondContact O-OG 3.15Å; V10-L14 HydrophobicContact CG1-CD1 3.68Å; V10-L14 WeakPolarHBondContact O-CB 3.23Å; V10-L14 WeakPolarHBondContact O-CD1 3.47Å; V10-L14 VanDerWaalsContact O-CG 3.31Å; V10-L14 WeakPolarHBondContact O-CG 3.41Å; V10-L14 PolarHBondContact O-N 2.94Å
11	L	62.9	Low	59.1	Low	105 Å²	105	115.6 Å²	115.6	55%	0.55	64%	0.642	S	S	.	*	H	α-helix	trans	-67.9	-40.5	176.6	-78.6	159.4	0	0	0	112.6	S7 L8 L14 T15	S7-L11 WeakPolarHBondContact O-CB 3.48Å; S7-L11 WeakPolarHBondContact O-CD1 3.49Å; S7-L11 WeakPolarHBondContact O-CG 3.14Å; S7-L11 PolarHBondContact O-N 2.86Å; L8-L11 PolarHBondContact O-N 2.93Å; L11-L14 PolarHBondContact O-N 2.93Å; L11-T15 WeakPolarHBondContact O-CG2 3.43Å; L11-T15 PolarHBondContact O-N 3.44Å; L11-T15 VanDerWaalsContact O-N 3.08Å; L11-T15 PolarHBondContact O-OG1 3.13Å
12	T	61.3	Low	59.1	Low	65 Å²	65	109.6 Å²	109.6	40%	0.399	62%	0.618	S	S	.	*	H	α-helix	trans	-70.9	-30.7	176.7	52.8	0	0	0	0	113.1	L8 W9 T15 W16	L8-T12 WeakPolarHBondContact O-CG2 3.46Å; L8-T12 PolarHBondContact O-N 3.03Å; L8-T12 PolarHBondContact O-OG1 3.02Å; L8-T12 VanDerWaalsContact O-OG1 3.05Å; W9-T12 WeakPolarHBondContact CA-OG1 3.38Å; W9-T12 PolarHBondContact O-OG1 3Å; T12-T15 PolarHBondContact O-OG1 3.03Å; T12-W16 PolarHBondContact O-N 3.09Å
13	S	61.1	Low	59.4	Low	72 Å²	72	110.8 Å²	110.8	50%	0.503	62%	0.621	S	S	.	*	H	α-helix	trans	-75.3	-31.5	173.1	49.1	0	0	0	0	113	W9 V10	W9-S13 WeakPolarHBondContact O-CB 3.47Å; W9-S13 PolarHBondContact O-N 2.82Å; W9-S13 VanDerWaalsContact O-N 3.1Å; W9-S13 PolarHBondContact O-OG 3.29Å; V10-S13 WeakPolarHBondContact CA-OG 3.48Å; V10-S13 PolarHBondContact O-N 2.95Å; V10-S13 PolarHBondContact O-OG 3.15Å
14	L	57.4	Low	60.5	Low	120 Å²	120	105.2 Å²	105.2	63%	0.628	60%	0.597	S	S	*	*	H	α-helix	trans	-72.3	-33.5	173.9	-79	159.2	0	0	0	113.1	V10 L11	V10-L14 HydrophobicContact CG1-CD1 3.68Å; V10-L14 WeakPolarHBondContact O-CB 3.23Å; V10-L14 WeakPolarHBondContact O-CD1 3.47Å; V10-L14 VanDerWaalsContact O-CG 3.31Å; V10-L14 WeakPolarHBondContact O-CG 3.41Å; V10-L14 PolarHBondContact O-N 2.94Å; L11-L14 PolarHBondContact O-N 2.93Å
15	T	55.8	Low	62	Low	104 Å²	104	106.6 Å²	106.6	64%	0.638	60%	0.595	S	S	*	*	H	α-helix	trans	-81.2	-20.2	178.7	54.4	0	0	0	0	114	L11 T12	L11-T15 WeakPolarHBondContact O-CG2 3.43Å; L11-T15 PolarHBondContact O-N 3.44Å; L11-T15 VanDerWaalsContact O-N 3.08Å; L11-T15 PolarHBondContact O-OG1 3.13Å; T12-T15 PolarHBondContact O-OG1 3.03Å
16	W	52.7	Low	63.5	Low	225 Å²	225	110.1 Å²	110.1	85%	0.852	60%	0.599	S	S	*	*	H	α-helix	trans	-82.6	-13	171.5	-92.3	-25.7	0	0	0	114.3	T12 S18	T12-W16 PolarHBondContact O-N 3.09Å; W16-S18 PolarHBondContact O-N 2.97Å
17	G	51.1	Low	65	Low	59 Å²	59	107 Å²	107	61%	0.608	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81	-0.4	-171.8	0	0	0	0	0	116.5
18	S	56.3	Low	66.5	Low	104 Å²	104	107.4 Å²	107.4	73%	0.727	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-151.4	45.6	-172.5	-52.3	0	0	0	0	114.6	W16 L20	W16-S18 PolarHBondContact O-N 2.97Å; S18-L20 VanDerWaalsContact C-N 3.3Å; S18-L20 PolarHBondContact O-N 2.76Å
19	V	52.2	Low	68	Low	120 Å²	120	102 Å²	102	73%	0.727	56%	0.555	S	S	*	*			trans	-83.5	90.5	150.2	-172.3	0	0	0	0	105.3	Q21	V19-Q21 PolarHBondContact O-N 2.78Å
20	L	56.6	Low	69.5	Low	156 Å²	156	98.9 Å²	98.9	82%	0.817	55%	0.545	S	S	*	.			trans	-59.8	93.8	162.8	-79.2	165.9	0	0	0	105.9	S18 V22	S18-L20 VanDerWaalsContact C-N 3.3Å; S18-L20 PolarHBondContact O-N 2.76Å; L20-V22 VanDerWaalsContact C-N 3.28Å; L20-V22 PolarHBondContact O-N 3.21Å
21	Q	50.7	Low	70.9	Confident	176 Å²	176	95.3 Å²	95.3	82%	0.822	52%	0.523	S	S	*	.			trans	-59.9	101	165.5	-84.5	179.1	-82.8	0	0	106	V19 S23	V19-Q21 PolarHBondContact O-N 2.78Å; Q21-S23 PolarHBondContact O-N 3.39Å
22	V	57.1	Low	72.3	Confident	90 Å²	90	92 Å²	92	55%	0.545	51%	0.505	S	S	.	.			trans	-65.3	93.6	168.1	-179.7	0	0	0	0	105.9	L20	L20-V22 VanDerWaalsContact C-N 3.28Å; L20-V22 PolarHBondContact O-N 3.21Å
23	S	63.8	Low	73.7	Confident	95 Å²	95	90.5 Å²	90.5	66%	0.664	50%	0.498	S	S	*	.	P	Polyproline II helix	trans	-84.1	118.7	175.5	-167.6	0	0	0	0	107.8	Q21 N25	Q21-S23 PolarHBondContact O-N 3.39Å; S23-N25 PolarHBondContact O-N 3.31Å
24	A	81.4	Confident	75.1	Confident	31 Å²	31	91.3 Å²	91.3	26%	0.256	50%	0.504	S	S	.	.	P	Polyproline II helix	trans	-63.4	126.4	168.1	0	0	0	0	0	109.5	N50 Y52	A24-N50 WeakPolarHBondContact CB-O 3.43Å; A24-Y52 HydrophobicContact CB-CD2 3.91Å; A24-Y52 HydrophobicContact CB-CE2 3.72Å
25	N	91.6	Very high	76.8	Confident	90 Å²	90	87.1 Å²	87.1	48%	0.481	48%	0.482	S	S	.	.	P	Polyproline II helix	trans	-72.7	151.2	178.1	-71.9	-36.1	0	0	0	110.4	S23 D51 Y52	S23-N25 PolarHBondContact O-N 3.31Å; N25-D51 WeakPolarHBondContact CB-OD1 3.47Å; N25-D51 PolarHBondContact N-OD1 2.98Å; N25-D51 WeakPolarHBondContact O-CA 3.41Å; N25-D51 WeakPolarHBondContact O-CB 3.35Å; N25-Y52 PolarHBondContact O-N 2.76Å
26	R	95.4	Very high	78.5	Confident	139 Å²	139	85.7 Å²	85.7	53%	0.525	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	125.1	176.4	-64.6	-172.7	162.6	-95.1	-8.6	109.8	Y52 D54	R26-Y52 WeakPolarHBondContact CA-O 3.42Å; R26-Y52 HydrophobicContact CG-CD2 4.47Å; R26-D54 IonicContact NH1-OD1 3.25Å; R26-D54 PolarHBondContact NH1-OD1 3.05Å; R26-D54 IonicContact NH1-OD2 2.91Å; R26-D54 PolarHBondContact NH1-OD2 3.42Å
27	H	96.3	Very high	80.4	Confident	46 Å²	46	80 Å²	80	21%	0.213	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	129.5	178	-57	-93.4	0	0	0	109.1	M45 Q46 D51 Y52 L53 D54	H27-M45 HydrophobicContact CB-CE 4Å; H27-M45 HydrophobicContact CB-SD 3.49Å; H27-M45 WeakPolarHBondContact CB-SD 3.44Å; H27-Q46 PolarHBondContact CE1-O 2.98Å; H27-D51 IonicContact CD2-OD2 3.75Å; H27-D51 IonicContact CE1-OD2 2.69Å; H27-D51 IonicContact NE2-OD2 3.66Å; H27-D51 PolarHBondContact NE2-OD2 2.77Å; H27-Y52 PolarHBondContact CD2-O 2.91Å; H27-Y52 PolarHBondContact N-O 2.99Å; H27-L53 CarbonylContact O-C 3.56Å; H27-L53 WeakPolarHBondContact O-CA 3.19Å; H27-D54 PolarHBondContact O-N 2.95Å
28	S	96.6	Very high	82.4	Confident	69 Å²	69	77.1 Å²	77.1	48%	0.483	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	136.4	-176.8	55.7	0	0	0	0	112.3	D54	S28-D54 WeakPolarHBondContact CA-O 3.44Å
29	V	96.8	Very high	83.9	Confident	2 Å²	2	79 Å²	79	1%	0.012	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	122.3	175.3	-178.2	0	0	0	0	110	W31 L38 Y43 M45 L53 D54 I55 Y56 L148	V29-W31 HydrophobicContact CG1-CE3 4.24Å; V29-L38 HydrophobicContact CG1-CD1 4.22Å; V29-L38 HydrophobicContact CG1-CD2 4.28Å; V29-Y43 HydrophobicContact CG1-CE1 4.23Å; V29-M45 HydrophobicContact CG2-CE 3.27Å; V29-M45 HydrophobicContact CG2-SD 4.23Å; V29-L53 HydrophobicContact CB-CD1 4.4Å; V29-L53 HydrophobicContact CG2-CD1 3.74Å; V29-D54 PolarHBondContact N-O 2.97Å; V29-I55 WeakPolarHBondContact O-CA 3.4Å; V29-Y56 PolarHBondContact O-N 2.96Å; V29-L148 HydrophobicContact CG2-CD2 4.26Å
30	Y	95.9	Very high	85.4	Confident	130 Å²	130	81.6 Å²	81.6	51%	0.51	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	115.1	170.3	-65.9	-85.7	0	0	0	109.9	N32 N35 L38 Y56	Y30-N32 PolarHBondContact O-N 3.04Å; Y30-N35 PolarHBondContact O-ND2 2.91Å; Y30-L38 VanDerWaalsContact O-CD1 3.32Å; Y30-L38 WeakPolarHBondContact O-CD1 3.47Å; Y30-Y56 HydrophobicContact CD1-CD2 4.48Å; Y30-Y56 HydrophobicContact CD1-CG 4.22Å; Y30-Y56 HydrophobicContact CE1-CD2 4.26Å; Y30-Y56 HydrophobicContact CE1-CG 4.05Å
31	W	95.6	Very high	86.7	Confident	3 Å²	3	79 Å²	79	1%	0.011	39%	0.394	C	S	.	.			trans	-98	79.5	-169.6	-160.5	-75.6	0	0	0	112.1	V29 L38 I55 Y56 P58 L75 S135 L146 L148	V29-W31 HydrophobicContact CG1-CE3 4.24Å; W31-L38 HydrophobicContact CB-CD1 4.42Å; W31-L38 HydrophobicContact CD2-CD1 4.1Å; W31-L38 HydrophobicContact CD2-CD2 4.43Å; W31-L38 HydrophobicContact CE3-CD1 4.22Å; W31-L38 HydrophobicContact CE3-CD2 3.98Å; W31-L38 HydrophobicContact CG-CD1 4.22Å; W31-L38 HydrophobicContact CH2-CD2 4.16Å; W31-L38 HydrophobicContact CZ3-CD2 3.85Å; W31-I55 HydrophobicContact CB-CG2 3.69Å; W31-I55 HydrophobicContact CD2-CG2 4.13Å; W31-I55 HydrophobicContact CE3-CD1 4.35Å; W31-I55 HydrophobicContact CE3-CG2 3.81Å; W31-I55 HydrophobicContact CG-CG2 4.12Å; W31-I55 HydrophobicContact CZ3-CD1 4.39Å; W31-Y56 WeakPolarHBondContact CB-O 3.29Å; W31-Y56 PolarHBondContact N-O 2.89Å; W31-P58 VanDerWaalsContact O-CD 3.24Å; W31-P58 WeakPolarHBondContact O-CD 3.4Å; W31-P58 VanDerWaalsContact O-CG 3.23Å; W31-P58 WeakPolarHBondContact O-CG 3.4Å; W31-L75 HydrophobicContact CD2-CD1 4.16Å; W31-L75 HydrophobicContact CE3-CD1 4.26Å; W31-L75 HydrophobicContact CH2-CD1 3.66Å; W31-L75 HydrophobicContact CZ2-CD1 3.54Å; W31-L75 HydrophobicContact CZ3-CD1 4.02Å; W31-S135 PolarHBondContact NE1-OG 3.38Å; W31-L146 HydrophobicContact CZ2-CB 3.97Å; W31-L148 HydrophobicContact CH2-CB 3.97Å; W31-L148 HydrophobicContact CZ3-CB 3.77Å; W31-L148 HydrophobicContact CZ3-CD2 4.2Å
32	N	92.1	Very high	88.3	Confident	35 Å²	35	72.8 Å²	72.8	19%	0.187	38%	0.378	C	S	.	.	S	Bend	trans	-143.2	165.5	179.7	61.7	56.8	0	0	0	111.5	Y30 S34 N35 P58	Y30-N32 PolarHBondContact O-N 3.04Å; N32-S34 VanDerWaalsContact C-N 3.27Å; N32-S34 PolarHBondContact O-N 2.96Å; N32-S34 WeakPolarHBondContact OD1-CA 3.4Å; N32-S34 WeakPolarHBondContact OD1-CB 3.45Å; N32-S34 PolarHBondContact OD1-N 2.95Å; N32-S34 VanDerWaalsContact OD1-N 3.14Å; N32-N35 WeakPolarHBondContact O-CB 3.42Å; N32-N35 PolarHBondContact O-N 3.04Å; N32-N35 PolarHBondContact OD1-N 3.01Å; N32-P58 HydrophobicContact CB-CB 4.42Å; N32-P58 HydrophobicContact CB-CG 4.11Å
33	S	90.6	Very high	90.1	Very high	35 Å²	35	71 Å²	71	25%	0.245	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-22	-178	82.5	0	0	0	0	113.8	N35 R39 E71	S33-N35 PolarHBondContact O-N 2.66Å; S33-R39 WeakPolarHBondContact O-CD 3.44Å; S33-R39 PolarHBondContact O-NE 3.44Å; S33-E71 VanDerWaalsContact CB-OE1 3.25Å; S33-E71 WeakPolarHBondContact CB-OE1 3.43Å; S33-E71 PolarHBondContact N-OE2 2.82Å; S33-E71 PolarHBondContact OG-OE1 3.34Å
34	S	90.3	Very high	91.6	Very high	89 Å²	89	68.9 Å²	68.9	62%	0.622	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-25.5	174.7	-58	0	0	0	0	112.4	N32 I36	N32-S34 VanDerWaalsContact C-N 3.27Å; N32-S34 PolarHBondContact O-N 2.96Å; N32-S34 WeakPolarHBondContact OD1-CA 3.4Å; N32-S34 WeakPolarHBondContact OD1-CB 3.45Å; N32-S34 PolarHBondContact OD1-N 2.95Å; N32-S34 VanDerWaalsContact OD1-N 3.14Å; S34-I36 PolarHBondContact O-N 3.46Å; S34-I36 VanDerWaalsContact O-N 3.14Å
35	N	93	Very high	92.3	Very high	31 Å²	31	68.3 Å²	68.3	17%	0.166	34%	0.337	C	S	.	.			trans	-73.6	103.1	175	-172.9	-17.4	0	0	0	110.7	Y30 N32 S33 H37 L38	Y30-N35 PolarHBondContact O-ND2 2.91Å; N32-N35 WeakPolarHBondContact O-CB 3.42Å; N32-N35 PolarHBondContact O-N 3.04Å; N32-N35 PolarHBondContact OD1-N 3.01Å; S33-N35 PolarHBondContact O-N 2.66Å; N35-H37 PolarHBondContact O-N 3.04Å; N35-H37 WeakPolarHBondContact OD1-CB 3.47Å; N35-H37 PolarHBondContact OD1-N 3.48Å; N35-H37 VanDerWaalsContact OD1-N 3.14Å; N35-L38 HydrophobicContact CB-CD1 4.1Å; N35-L38 HydrophobicContact CB-CG 4.48Å; N35-L38 PolarHBondContact O-N 2.82Å
36	I	91.6	Very high	92.5	Very high	74 Å²	74	69.8 Å²	69.8	38%	0.379	34%	0.341	S	S	.	.	H	α-helix	trans	-62.3	-26.5	-175.9	68.6	174.3	0	0	0	113.8	S34 L38 R39	S34-I36 PolarHBondContact O-N 3.46Å; S34-I36 VanDerWaalsContact O-N 3.14Å; I36-L38 VanDerWaalsContact C-N 3.35Å; I36-R39 PolarHBondContact O-N 2.79Å
37	H	92.9	Very high	92.5	Very high	105 Å²	105	63.2 Å²	63.2	49%	0.486	32%	0.316	S	S	.	.	H	α-helix	trans	-67.7	-39.4	-178.7	-63.6	-74.2	0	0	0	110.8	N35 R39 R40 Y43	N35-H37 PolarHBondContact O-N 3.04Å; N35-H37 WeakPolarHBondContact OD1-CB 3.47Å; N35-H37 PolarHBondContact OD1-N 3.48Å; N35-H37 VanDerWaalsContact OD1-N 3.14Å; H37-R39 VanDerWaalsContact C-N 3.33Å; H37-R39 PolarHBondContact O-N 2.84Å; H37-R40 PolarHBondContact O-N 3.09Å; H37-Y43 HydrophobicContact CB-CD1 3.84Å; H37-Y43 HydrophobicContact CB-CD2 3.85Å; H37-Y43 HydrophobicContact CB-CE1 4.16Å; H37-Y43 HydrophobicContact CB-CE2 4.2Å; H37-Y43 HydrophobicContact CB-CG 3.67Å; H37-Y43 VanDerWaalsContact O-CB 3.25Å; H37-Y43 WeakPolarHBondContact O-CB 3.32Å
38	L	93.4	Very high	92.4	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-72.9	-24.6	-179.6	-70.8	172.6	0	0	0	113.6	V29 Y30 W31 N35 I36 Y43 L146 R147 L148	V29-L38 HydrophobicContact CG1-CD1 4.22Å; V29-L38 HydrophobicContact CG1-CD2 4.28Å; Y30-L38 VanDerWaalsContact O-CD1 3.32Å; Y30-L38 WeakPolarHBondContact O-CD1 3.47Å; W31-L38 HydrophobicContact CB-CD1 4.42Å; W31-L38 HydrophobicContact CD2-CD1 4.1Å; W31-L38 HydrophobicContact CD2-CD2 4.43Å; W31-L38 HydrophobicContact CE3-CD1 4.22Å; W31-L38 HydrophobicContact CE3-CD2 3.98Å; W31-L38 HydrophobicContact CG-CD1 4.22Å; W31-L38 HydrophobicContact CH2-CD2 4.16Å; W31-L38 HydrophobicContact CZ3-CD2 3.85Å; N35-L38 HydrophobicContact CB-CD1 4.1Å; N35-L38 HydrophobicContact CB-CG 4.48Å; N35-L38 PolarHBondContact O-N 2.82Å; I36-L38 VanDerWaalsContact C-N 3.35Å; L38-Y43 HydrophobicContact CD2-CD1 3.79Å; L38-Y43 HydrophobicContact CD2-CE1 4.04Å; L38-Y43 HydrophobicContact CG-CD1 4.25Å; L38-Y43 HydrophobicContact CG-CE1 4.4Å; L38-L146 HydrophobicContact CB-CB 4.07Å; L38-L146 HydrophobicContact CB-CD2 3.9Å; L38-L146 HydrophobicContact CB-CG 4.43Å; L38-L146 WeakPolarHBondContact O-CA 3.39Å; L38-R147 WeakPolarHBondContact CD2-O 3.47Å; L38-R147 PolarHBondContact O-N 2.73Å; L38-L148 HydrophobicContact CD2-CB 4.2Å
39	R	88.8	Confident	92.1	Very high	144 Å²	144	60.1 Å²	60.1	54%	0.543	30%	0.296	S	S	.	.	H	α-helix	trans	-77.6	-25.1	178.3	-67.5	-166	-66.4	-168.5	1.2	113.3	S33 I36 H37 L146	S33-R39 WeakPolarHBondContact O-CD 3.44Å; S33-R39 PolarHBondContact O-NE 3.44Å; I36-R39 PolarHBondContact O-N 2.79Å; H37-R39 VanDerWaalsContact C-N 3.33Å; H37-R39 PolarHBondContact O-N 2.84Å; R39-L146 HydrophobicContact CG-CD2 3.75Å
40	R	83.6	Confident	91.9	Very high	173 Å²	173	61.6 Å²	61.6	65%	0.653	30%	0.304	S	S	*	.	S	Bend	trans	-97.6	154.2	-176.3	-66.5	-178.6	179.8	173.9	0.9	110.7	H37	H37-R40 PolarHBondContact O-N 3.09Å
41	E	82.4	Confident	91.9	Very high	101 Å²	101	55.6 Å²	55.6	47%	0.472	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	143.7	165.8	-68.6	-168.3	-179.1	0	0	109.9	R84 R147	E41-R84 IonicContact OE2-CZ 3.86Å; E41-R84 IonicContact OE2-NE 2.95Å; E41-R84 IonicContact OE2-NH2 3.86Å; E41-R147 IonicContact OE1-CZ 3.81Å; E41-R147 IonicContact OE1-NH1 3.3Å; E41-R147 PolarHBondContact OE1-NH1 3.43Å; E41-R147 IonicContact OE1-NH2 3.99Å; E41-R147 PolarHBondContact OE1-NH2 3.03Å
42	G	85.4	Confident	91.9	Very high	46 Å²	46	58.4 Å²	58.4	47%	0.474	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	101.3	-2.3	169	0	0	0	0	0	116.3	T44 Y83	G42-T44 PolarHBondContact O-N 3.27Å; G42-T44 PolarHBondContact O-OG1 2.98Å; G42-Y83 PolarHBondContact N-OH 3.14Å
43	Y	94.5	Very high	92.1	Very high	53 Å²	53	56.8 Å²	56.8	21%	0.208	28%	0.283	C	S	.	.			trans	-64.1	112.5	170.8	-176.4	-143.5	0	0	0	110.3	V29 H37 L38 L148 R149	V29-Y43 HydrophobicContact CG1-CE1 4.23Å; H37-Y43 HydrophobicContact CB-CD1 3.84Å; H37-Y43 HydrophobicContact CB-CD2 3.85Å; H37-Y43 HydrophobicContact CB-CE1 4.16Å; H37-Y43 HydrophobicContact CB-CE2 4.2Å; H37-Y43 HydrophobicContact CB-CG 3.67Å; H37-Y43 VanDerWaalsContact O-CB 3.25Å; H37-Y43 WeakPolarHBondContact O-CB 3.32Å; L38-Y43 HydrophobicContact CD2-CD1 3.79Å; L38-Y43 HydrophobicContact CD2-CE1 4.04Å; L38-Y43 HydrophobicContact CG-CD1 4.25Å; L38-Y43 HydrophobicContact CG-CE1 4.4Å; Y43-L148 HydrophobicContact CD1-CD1 3.61Å; Y43-L148 HydrophobicContact CE1-CD1 3.7Å; Y43-L148 HydrophobicContact CG-CD1 4.16Å; Y43-R149 PolarHBondContact O-N 3.14Å
44	T	95.6	Very high	92.4	Very high	50 Å²	50	55.4 Å²	55.4	31%	0.307	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	131.7	-173	-51.1	0	0	0	0	108.9	G42 R149	G42-T44 PolarHBondContact O-N 3.27Å; G42-T44 PolarHBondContact O-OG1 2.98Å; T44-R149 CarbonylContact C-O 3.53Å; T44-R149 VanDerWaalsContact CA-O 3.24Å; T44-R149 WeakPolarHBondContact CA-O 3.35Å; T44-R149 HydrophobicContact CG2-CB 4.41Å; T44-R149 HydrophobicContact CG2-CG 4.26Å; T44-R149 PolarHBondContact OG1-NE 3.14Å; T44-R149 PolarHBondContact OG1-NH2 3.42Å
45	M	95.4	Very high	92.8	Very high	20 Å²	20	51.3 Å²	51.3	10%	0.099	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	133.6	174.2	178	174.4	-77.2	0	0	108.9	H27 V29 V47 L53 L148 R149 V150 Y151	H27-M45 HydrophobicContact CB-CE 4Å; H27-M45 HydrophobicContact CB-SD 3.49Å; H27-M45 WeakPolarHBondContact CB-SD 3.44Å; V29-M45 HydrophobicContact CG2-CE 3.27Å; V29-M45 HydrophobicContact CG2-SD 4.23Å; M45-V47 HydrophobicContact CG-CG1 4Å; M45-V47 HydrophobicContact SD-CG1 4.28Å; M45-L53 HydrophobicContact CE-CD1 4.4Å; M45-L53 HydrophobicContact SD-CD1 3.74Å; M45-L148 HydrophobicContact CB-CD1 4.04Å; M45-R149 PolarHBondContact N-O 3.19Å; M45-V150 CarbonylContact O-C 3.57Å; M45-V150 VanDerWaalsContact O-CA 3.28Å; M45-V150 WeakPolarHBondContact O-CA 3.44Å; M45-Y151 PolarHBondContact O-N 2.94Å
46	Q	96	Very high	93	Very high	120 Å²	120	52.3 Å²	52.3	56%	0.561	25%	0.246	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-99.8	133	174.5	-177	175.2	40.3	0	0	109	H27 Y151 C153	H27-Q46 PolarHBondContact CE1-O 2.98Å; Q46-Y151 WeakPolarHBondContact CA-O 3.47Å; Q46-Y151 HydrophobicContact CG-CD1 4.19Å; Q46-C153 HydrophobicContact CG-CB 3.77Å; Q46-C153 WeakPolarHBondContact CG-SG 3.31Å
47	V	95.4	Very high	93.1	Very high	2 Å²	2	49.2 Å²	49.2	1%	0.012	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	153.9	179.8	-57.7	0	0	0	0	109.9	M45 D51 F113 V150 Y151 V152 C153	M45-V47 HydrophobicContact CG-CG1 4Å; M45-V47 HydrophobicContact SD-CG1 4.28Å; V47-D51 HydrophobicContact CB-CB 4.3Å; V47-F113 HydrophobicContact CB-CD2 4.13Å; V47-F113 HydrophobicContact CB-CE2 4.3Å; V47-F113 HydrophobicContact CG1-CD2 4.37Å; V47-F113 HydrophobicContact CG1-CE2 4.08Å; V47-F113 HydrophobicContact CG2-CB 4.39Å; V47-F113 HydrophobicContact CG2-CD1 3.82Å; V47-F113 HydrophobicContact CG2-CD2 3.69Å; V47-F113 HydrophobicContact CG2-CE1 4.02Å; V47-F113 HydrophobicContact CG2-CE2 3.89Å; V47-F113 HydrophobicContact CG2-CG 3.68Å; V47-F113 HydrophobicContact CG2-CZ 4.07Å; V47-V150 HydrophobicContact CB-CG1 4.4Å; V47-V150 HydrophobicContact CG1-CG1 3.93Å; V47-V150 HydrophobicContact CG2-CG1 3.56Å; V47-Y151 PolarHBondContact N-O 2.91Å; V47-V152 HydrophobicContact CG2-CB 4.47Å; V47-V152 HydrophobicContact CG2-CG2 3.85Å; V47-V152 CarbonylContact O-C 3.59Å; V47-V152 WeakPolarHBondContact O-CA 3.31Å; V47-C153 PolarHBondContact O-N 3.26Å; V47-C153 PolarHBondContact O-SG 3.08Å; V47-C153 VanDerWaalsContact O-SG 3.42Å
48	N	93.9	Very high	93.1	Very high	44 Å²	44	44.5 Å²	44.5	24%	0.235	21%	0.209	C	C	.	.			trans	-91.4	167.1	170.1	-63.6	-41.2	0	0	0	111.2	D51 C153 T156	N48-D51 PolarHBondContact N-OD2 2.78Å; N48-D51 WeakPolarHBondContact O-CB 3.34Å; N48-D51 PolarHBondContact O-N 2.87Å; N48-C153 PolarHBondContact OD1-SG 2.68Å; N48-T156 HydrophobicContact CB-CG2 4.43Å
49	V	91.6	Very high	93	Very high	5 Å²	5	47.2 Å²	47.2	3%	0.03	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	144.6	164.4	-177	0	0	0	0	108.7	D51 F113 V127 V152 C154 T156	V49-D51 PolarHBondContact O-N 3.37Å; V49-D51 VanDerWaalsContact O-N 3.17Å; V49-F113 CarbonylContact C-O 3.51Å; V49-F113 WeakPolarHBondContact CA-O 3.49Å; V49-V127 HydrophobicContact CG2-CG2 3.47Å; V49-V127 VanDerWaalsContact CG2-CG2 3.47Å; V49-V152 HydrophobicContact CG2-CG1 4.06Å; V49-C154 PolarHBondContact N-O 2.97Å; V49-T156 WeakPolarHBondContact O-CG2 3.3Å
50	N	91.8	Very high	93	Very high	34 Å²	34	42.9 Å²	42.9	18%	0.182	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.9	-8.1	-175.6	-58.5	-49.9	0	0	0	116.3	A24 F113 T156 D159	A24-N50 WeakPolarHBondContact CB-O 3.43Å; N50-F113 PolarHBondContact N-O 3.45Å; N50-T156 PolarHBondContact ND2-OG1 2.9Å; N50-D159 PolarHBondContact ND2-OD1 2.76Å; N50-D159 VanDerWaalsContact ND2-OD1 3.1Å; N50-D159 PolarHBondContact ND2-OD2 2.84Å
51	D	95.3	Very high	93	Very high	3 Å²	3	39.5 Å²	39.5	2%	0.016	20%	0.201	C	C	.	.			trans	-64.7	163.9	171.8	-78	-4.9	0	0	0	111.9	N25 H27 V47 N48 V49 K112 F113	N25-D51 WeakPolarHBondContact CB-OD1 3.47Å; N25-D51 PolarHBondContact N-OD1 2.98Å; N25-D51 WeakPolarHBondContact O-CA 3.41Å; N25-D51 WeakPolarHBondContact O-CB 3.35Å; H27-D51 IonicContact CD2-OD2 3.75Å; H27-D51 IonicContact CE1-OD2 2.69Å; H27-D51 IonicContact NE2-OD2 3.66Å; H27-D51 PolarHBondContact NE2-OD2 2.77Å; V47-D51 HydrophobicContact CB-CB 4.3Å; N48-D51 PolarHBondContact N-OD2 2.78Å; N48-D51 WeakPolarHBondContact O-CB 3.34Å; N48-D51 PolarHBondContact O-N 2.87Å; V49-D51 PolarHBondContact O-N 3.37Å; V49-D51 VanDerWaalsContact O-N 3.17Å; D51-K112 WeakPolarHBondContact O-CA 3.5Å; D51-F113 PolarHBondContact O-N 3.45Å
52	Y	95.7	Very high	92.6	Very high	63 Å²	63	39.6 Å²	39.6	25%	0.247	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	140.2	175.8	-64.5	-96.8	0	0	0	111.9	A24 N25 R26 H27 E111 K112	A24-Y52 HydrophobicContact CB-CD2 3.91Å; A24-Y52 HydrophobicContact CB-CE2 3.72Å; N25-Y52 PolarHBondContact O-N 2.76Å; R26-Y52 WeakPolarHBondContact CA-O 3.42Å; R26-Y52 HydrophobicContact CG-CD2 4.47Å; H27-Y52 PolarHBondContact CD2-O 2.91Å; H27-Y52 PolarHBondContact N-O 2.99Å; Y52-E111 CarbonylContact C-O 3.53Å; Y52-E111 WeakPolarHBondContact CA-O 3.33Å; Y52-K112 HydrophobicContact CD1-CB 3.84Å; Y52-K112 HydrophobicContact CD1-CG 4.06Å; Y52-K112 HydrophobicContact CE1-CB 3.65Å; Y52-K112 HydrophobicContact CE1-CD 3.89Å; Y52-K112 HydrophobicContact CE1-CG 3.67Å; Y52-K112 HydrophobicContact CE2-CD 4.47Å; Y52-K112 HydrophobicContact CE2-CG 4.29Å
53	L	97	Very high	91.7	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	114.2	164.7	165.9	61.9	0	0	0	109.3	H27 V29 M45 I55 S110 E111 F113 Y133 L148 V150	H27-L53 CarbonylContact O-C 3.56Å; H27-L53 WeakPolarHBondContact O-CA 3.19Å; V29-L53 HydrophobicContact CB-CD1 4.4Å; V29-L53 HydrophobicContact CG2-CD1 3.74Å; M45-L53 HydrophobicContact CE-CD1 4.4Å; M45-L53 HydrophobicContact SD-CD1 3.74Å; L53-I55 HydrophobicContact CD1-CG1 4.05Å; L53-I55 HydrophobicContact CD2-CD1 4.07Å; L53-I55 HydrophobicContact CD2-CG1 4.18Å; L53-I55 HydrophobicContact CG-CD1 4.26Å; L53-I55 HydrophobicContact CG-CG1 3.83Å; L53-S110 CarbonylContact O-C 3.47Å; L53-S110 WeakPolarHBondContact O-CA 3.16Å; L53-E111 HydrophobicContact CB-CB 4.4Å; L53-E111 PolarHBondContact N-O 3.23Å; L53-E111 PolarHBondContact O-N 3.09Å; L53-F113 HydrophobicContact CB-CE2 3.54Å; L53-F113 HydrophobicContact CB-CZ 4.05Å; L53-F113 HydrophobicContact CD2-CE2 4.49Å; L53-F113 HydrophobicContact CD2-CZ 4.18Å; L53-Y133 HydrophobicContact CD2-CE2 4.48Å; L53-L148 HydrophobicContact CD2-CD2 4.01Å; L53-V150 HydrophobicContact CD2-CG2 4.09Å
54	D	97.4	Very high	90.2	Very high	7 Å²	7	45 Å²	45	4%	0.037	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	106.1	175.4	-71.2	-27.4	0	0	0	109.4	R26 H27 S28 V29 Y56 K108 F109 S110	R26-D54 IonicContact NH1-OD1 3.25Å; R26-D54 PolarHBondContact NH1-OD1 3.05Å; R26-D54 IonicContact NH1-OD2 2.91Å; R26-D54 PolarHBondContact NH1-OD2 3.42Å; H27-D54 PolarHBondContact O-N 2.95Å; S28-D54 WeakPolarHBondContact CA-O 3.44Å; V29-D54 PolarHBondContact N-O 2.97Å; D54-Y56 HydrophobicContact CB-CE2 4.07Å; D54-K108 IonicContact OD2-NZ 4Å; D54-F109 CarbonylContact C-O 3.6Å; D54-F109 WeakPolarHBondContact CA-O 3.41Å; D54-S110 VanDerWaalsContact OD1-CB 3.26Å; D54-S110 WeakPolarHBondContact OD1-CB 3.24Å; D54-S110 PolarHBondContact OD1-OG 2.81Å
55	I	97.5	Very high	88.6	Confident	3 Å²	3	51 Å²	51	2%	0.015	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	116.9	176.5	-56.8	-179.8	0	0	0	109.1	V29 W31 L53 L75 K108 F109	V29-I55 WeakPolarHBondContact O-CA 3.4Å; W31-I55 HydrophobicContact CB-CG2 3.69Å; W31-I55 HydrophobicContact CD2-CG2 4.13Å; W31-I55 HydrophobicContact CE3-CD1 4.35Å; W31-I55 HydrophobicContact CE3-CG2 3.81Å; W31-I55 HydrophobicContact CG-CG2 4.12Å; W31-I55 HydrophobicContact CZ3-CD1 4.39Å; L53-I55 HydrophobicContact CD1-CG1 4.05Å; L53-I55 HydrophobicContact CD2-CD1 4.07Å; L53-I55 HydrophobicContact CD2-CG1 4.18Å; L53-I55 HydrophobicContact CG-CD1 4.26Å; L53-I55 HydrophobicContact CG-CG1 3.83Å; I55-L75 HydrophobicContact CD1-CD2 3.61Å; I55-K108 VanDerWaalsContact O-CA 3.31Å; I55-K108 WeakPolarHBondContact O-CA 3.3Å; I55-F109 HydrophobicContact CB-CD1 4.45Å; I55-F109 HydrophobicContact CD1-CD1 4.18Å; I55-F109 HydrophobicContact CG1-CD1 4.49Å; I55-F109 PolarHBondContact N-O 3.32Å; I55-F109 PolarHBondContact O-N 2.9Å
56	Y	96.9	Very high	86.6	Confident	52 Å²	52	58.8 Å²	58.8	20%	0.204	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	122.2	177.9	-68.6	-87.8	0	0	0	110.8	V29 Y30 W31 D54 P106 K108	V29-Y56 PolarHBondContact O-N 2.96Å; Y30-Y56 HydrophobicContact CD1-CD2 4.48Å; Y30-Y56 HydrophobicContact CD1-CG 4.22Å; Y30-Y56 HydrophobicContact CE1-CD2 4.26Å; Y30-Y56 HydrophobicContact CE1-CG 4.05Å; W31-Y56 WeakPolarHBondContact CB-O 3.29Å; W31-Y56 PolarHBondContact N-O 2.89Å; D54-Y56 HydrophobicContact CB-CE2 4.07Å; Y56-P106 HydrophobicContact CD1-CB 4.25Å; Y56-K108 HydrophobicContact CD1-CB 3.86Å; Y56-K108 HydrophobicContact CE1-CB 3.86Å; Y56-K108 HydrophobicContact CE1-CD 4.1Å; Y56-K108 HydrophobicContact CG-CB 4.46Å
57	C	95.2	Very high	84.6	Confident	8 Å²	8	59.6 Å²	59.6	5%	0.054	30%	0.296	C	S	.	.	P	Polyproline II helix	trans	-66.8	154.9	173.5	-67.9	0	0	0	0	111.6	H59 C97 I107	C57-H59 PolarHBondContact O-N 3.47Å; C57-C97 VanDerWaalsContact CA-SG 3.54Å; C57-C97 HydrophobicContact CB-CB 3.62Å; C57-C97 WeakPolarHBondContact CB-SG 3.47Å; C57-C97 VanDerWaalsContact SG-CA 3.5Å; C57-C97 WeakPolarHBondContact SG-CB 3.43Å; C57-C97 CovalentContact SG-SG 2.04Å; C57-C97 PolarHBondContact SG-SG 3.17Å; C57-I107 HydrophobicContact CB-CB 4.45Å; C57-I107 WeakPolarHBondContact CB-O 3.42Å; C57-I107 PolarHBondContact N-O 3.43Å
58	P	93.1	Very high	82.9	Confident	7 Å²	7	61.5 Å²	61.5	5%	0.045	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-55.5	134.8	169.5	-19.7	30.4	0	0	0	110.7	W31 N32 Y60 E71 Y73	W31-P58 VanDerWaalsContact O-CD 3.24Å; W31-P58 WeakPolarHBondContact O-CD 3.4Å; W31-P58 VanDerWaalsContact O-CG 3.23Å; W31-P58 WeakPolarHBondContact O-CG 3.4Å; N32-P58 HydrophobicContact CB-CB 4.42Å; N32-P58 HydrophobicContact CB-CG 4.11Å; P58-Y60 HydrophobicContact CB-CD2 4.47Å; P58-Y60 HydrophobicContact CB-CE2 3.62Å; P58-E71 HydrophobicContact CB-CB 4.16Å; P58-E71 HydrophobicContact CG-CB 4.04Å; P58-Y73 HydrophobicContact CG-CD2 3.83Å; P58-Y73 HydrophobicContact CG-CE2 3.75Å
59	H	91.4	Very high	81.8	Confident	57 Å²	57	64.5 Å²	64.5	26%	0.264	34%	0.336	S	S	.	.			trans	-132.4	132.3	178.9	179.3	-97.8	0	0	0	109.2	C57 P100 A102 P106	C57-H59 PolarHBondContact O-N 3.47Å; H59-P100 WeakPolarHBondContact CA-O 3.26Å; H59-A102 PolarHBondContact NE2-O 2.85Å; H59-P106 HydrophobicContact CB-CB 3.73Å; H59-P106 HydrophobicContact CB-CG 3.65Å
60	Y	87.6	Confident	81.4	Confident	53 Å²	53	64.8 Å²	64.8	21%	0.208	34%	0.34	C	S	.	.			trans	-133	137.7	-176.6	-59.1	-84.5	0	0	0	109.2	P58 Q64 E71 P100 H101	P58-Y60 HydrophobicContact CB-CD2 4.47Å; P58-Y60 HydrophobicContact CB-CE2 3.62Å; Y60-Q64 VanDerWaalsContact CD1-OE1 3.31Å; Y60-E71 HydrophobicContact CE2-CB 4.24Å; Y60-E71 WeakPolarHBondContact OH-CG 3.05Å; Y60-P100 HydrophobicContact CD2-CB 3.92Å; Y60-P100 PolarHBondContact N-O 3.22Å; Y60-H101 PolarHBondContact O-ND1 3.42Å
61	N	83.4	Confident	81.3	Confident	102 Å²	102	65.5 Å²	65.5	55%	0.545	34%	0.342	S	S	.	.			trans	-65.6	151.9	177.7	-66.1	-17.9	0	0	0	111.1	T63 Q64	N61-T63 PolarHBondContact O-N 2.96Å; N61-T63 VanDerWaalsContact O-N 3.09Å; N61-Q64 PolarHBondContact O-N 2.76Å
62	D	74.1	Confident	81.1	Confident	103 Å²	103	67 Å²	67	55%	0.551	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-59.7	-24.4	-177.5	-74.5	-38.4	0	0	0	113.9	Q64 R65	D62-Q64 PolarHBondContact O-N 3.46Å; D62-R65 WeakPolarHBondContact O-CB 3.49Å; D62-R65 PolarHBondContact O-N 2.89Å
63	T	67.1	Low	80.9	Confident	118 Å²	118	65 Å²	65	72%	0.724	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	-62.6	-24.2	175.7	55.2	0	0	0	0	112.9	N61	N61-T63 PolarHBondContact O-N 2.96Å; N61-T63 VanDerWaalsContact O-N 3.09Å
64	Q	62.5	Low	80.9	Confident	95 Å²	95	65.5 Å²	65.5	44%	0.444	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-88.9	-3.5	-179.3	-63.9	-179	0.6	0	0	113.4	Y60 N61 D62 M66 V67	Y60-Q64 VanDerWaalsContact CD1-OE1 3.31Å; N61-Q64 PolarHBondContact O-N 2.76Å; D62-Q64 PolarHBondContact O-N 3.46Å; Q64-M66 PolarHBondContact O-N 2.83Å; Q64-V67 PolarHBondContact O-N 3.28Å; Q64-V67 VanDerWaalsContact O-N 3.09Å
65	R	61.4	Low	80.8	Confident	176 Å²	176	65.5 Å²	65.5	66%	0.664	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-59.1	-21.6	179.4	-161.8	176.9	-164.5	177.3	5	113.4	D62	D62-R65 WeakPolarHBondContact O-CB 3.49Å; D62-R65 PolarHBondContact O-N 2.89Å
66	M	54.3	Low	80.8	Confident	182 Å²	182	67.4 Å²	67.4	90%	0.897	35%	0.352	S	S	*	.	G	3₁₀ helix	trans	-85.5	-15.3	-179.1	-60.7	-62.2	-169.2	0	0	114.2	Q64	Q64-M66 PolarHBondContact O-N 2.83Å
67	V	54.5	Low	80.8	Confident	137 Å²	137	65.2 Å²	65.2	83%	0.83	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.2	-11.6	-170.6	-176.6	0	0	0	0	112.9	Q64	Q64-V67 PolarHBondContact O-N 3.28Å; Q64-V67 VanDerWaalsContact O-N 3.09Å
68	G	58.7	Low	80.9	Confident	43 Å²	43	65.3 Å²	65.3	44%	0.443	34%	0.344	S	S	.	.			trans	168.7	161.3	173.7	0	0	0	0	0	111.7	G70	G68-G70 PolarHBondContact O-N 2.95Å
69	T	71	Confident	81.1	Confident	107 Å²	107	67.7 Å²	67.7	66%	0.656	36%	0.36	S	S	*	.			trans	-70.8	114.3	167.2	48.7	0	0	0	0	107.6
70	G	82.8	Confident	81.3	Confident	11 Å²	11	70.7 Å²	70.7	11%	0.113	37%	0.37	C	S	.	.			trans	-52.4	150.9	177.5	0	0	0	0	0	111.9	G68 Q72	G68-G70 PolarHBondContact O-N 2.95Å; G70-Q72 PolarHBondContact O-N 3.1Å
71	E	89.6	Confident	81.7	Confident	48 Å²	48	76.5 Å²	76.5	22%	0.224	39%	0.392	C	S	.	.			trans	-53.2	132	-177.3	-66.4	-176.3	-178.8	0	0	112.2	S33 P58 Y60 Y73	S33-E71 VanDerWaalsContact CB-OE1 3.25Å; S33-E71 WeakPolarHBondContact CB-OE1 3.43Å; S33-E71 PolarHBondContact N-OE2 2.82Å; S33-E71 PolarHBondContact OG-OE1 3.34Å; P58-E71 HydrophobicContact CB-CB 4.16Å; P58-E71 HydrophobicContact CG-CB 4.04Å; Y60-E71 HydrophobicContact CE2-CB 4.24Å; Y60-E71 WeakPolarHBondContact OH-CG 3.05Å; E71-Y73 HydrophobicContact CB-CE2 3.7Å; E71-Y73 HydrophobicContact CG-CE2 4.47Å; E71-Y73 WeakPolarHBondContact OE2-CE2 3.25Å; E71-Y73 PolarHBondContact OE2-OH 2.99Å
72	Q	91.2	Very high	82.3	Confident	36 Å²	36	71.7 Å²	71.7	17%	0.168	37%	0.366	C	S	.	.			trans	-132.2	137.3	179.5	-74.8	168.3	48.6	0	0	109.6	G70 C97 P100 P137 T138 H139	G70-Q72 PolarHBondContact O-N 3.1Å; Q72-C97 VanDerWaalsContact CA-O 3.27Å; Q72-C97 WeakPolarHBondContact CA-O 2.98Å; Q72-C97 WeakPolarHBondContact CB-O 3.47Å; Q72-P100 HydrophobicContact CG-CG 4.11Å; Q72-P137 WeakPolarHBondContact O-CA 3.48Å; Q72-T138 HydrophobicContact CB-CG2 4.31Å; Q72-T138 WeakPolarHBondContact CB-OG1 3.39Å; Q72-T138 PolarHBondContact O-N 2.92Å; Q72-T138 PolarHBondContact O-OG1 3.38Å; Q72-H139 PolarHBondContact OE1-NE2 3.42Å
73	Y	92.9	Very high	83.3	Confident	19 Å²	19	67.2 Å²	67.2	8%	0.075	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	147.6	-172.2	-63.8	-72.3	0	0	0	111.7	P58 E71 C97 T136 P137 L146	P58-Y73 HydrophobicContact CG-CD2 3.83Å; P58-Y73 HydrophobicContact CG-CE2 3.75Å; E71-Y73 HydrophobicContact CB-CE2 3.7Å; E71-Y73 HydrophobicContact CG-CE2 4.47Å; E71-Y73 WeakPolarHBondContact OE2-CE2 3.25Å; E71-Y73 PolarHBondContact OE2-OH 2.99Å; Y73-C97 PolarHBondContact N-O 2.91Å; Y73-C97 PolarHBondContact O-N 2.97Å; Y73-T136 WeakPolarHBondContact CA-O 3.42Å; Y73-P137 HydrophobicContact CD1-CB 4.16Å; Y73-P137 HydrophobicContact CE1-CB 4Å; Y73-L146 HydrophobicContact CE1-CD1 4.09Å; Y73-L146 HydrophobicContact CE2-CD1 4.1Å
74	V	95.3	Very high	84.5	Confident	12 Å²	12	67.1 Å²	67.1	7%	0.073	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	126.4	163.3	-170.1	0	0	0	0	108	Y76 K93 E96 S135 T136 T138	V74-Y76 HydrophobicContact CB-CD2 4.5Å; V74-Y76 HydrophobicContact CB-CE2 3.59Å; V74-Y76 HydrophobicContact CG1-CD2 4.33Å; V74-Y76 HydrophobicContact CG1-CE1 4.12Å; V74-Y76 HydrophobicContact CG1-CE2 3.54Å; V74-Y76 VanDerWaalsContact CG1-CZ 3.4Å; V74-Y76 WeakPolarHBondContact CG1-OH 3.38Å; V74-Y76 WeakPolarHBondContact O-CD2 3.24Å; V74-Y76 WeakPolarHBondContact O-CE2 3.28Å; V74-K93 HydrophobicContact CG1-CD 3.97Å; V74-K93 HydrophobicContact CG1-CG 3.88Å; V74-E96 HydrophobicContact CB-CG 4.31Å; V74-E96 HydrophobicContact CG1-CG 3.86Å; V74-E96 HydrophobicContact CG2-CG 4.04Å; V74-S135 WeakPolarHBondContact O-CA 3.38Å; V74-S135 WeakPolarHBondContact O-CB 3.48Å; V74-T136 PolarHBondContact N-O 2.99Å; V74-T136 PolarHBondContact O-N 3.08Å; V74-T136 VanDerWaalsContact O-N 3.16Å; V74-T138 HydrophobicContact CG2-CG2 3.7Å
75	L	96.3	Very high	86	Confident	6 Å²	6	67.5 Å²	67.5	3%	0.031	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	131.5	-179.4	-172.6	74.2	0	0	0	109.8	W31 I55 R94 W95 F109 Y133	W31-L75 HydrophobicContact CD2-CD1 4.16Å; W31-L75 HydrophobicContact CE3-CD1 4.26Å; W31-L75 HydrophobicContact CH2-CD1 3.66Å; W31-L75 HydrophobicContact CZ2-CD1 3.54Å; W31-L75 HydrophobicContact CZ3-CD1 4.02Å; I55-L75 HydrophobicContact CD1-CD2 3.61Å; L75-R94 PolarHBondContact O-N 3.42Å; L75-W95 HydrophobicContact CB-CB 4.09Å; L75-W95 HydrophobicContact CD2-CB 4.18Å; L75-W95 PolarHBondContact N-O 3.12Å; L75-W95 PolarHBondContact O-N 3.38Å; L75-F109 HydrophobicContact CD2-CD1 4.06Å; L75-F109 HydrophobicContact CD2-CE1 4.35Å; L75-Y133 HydrophobicContact CD2-CD1 4.33Å; L75-Y133 HydrophobicContact CG-CD1 4.46Å
76	Y	96.6	Very high	87.4	Confident	44 Å²	44	60.4 Å²	60.4	17%	0.173	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	143.4	179.2	-58.5	-94.7	0	0	0	110.3	V74 P88 F92 K93 Y133 I134 T136	V74-Y76 HydrophobicContact CB-CD2 4.5Å; V74-Y76 HydrophobicContact CB-CE2 3.59Å; V74-Y76 HydrophobicContact CG1-CD2 4.33Å; V74-Y76 HydrophobicContact CG1-CE1 4.12Å; V74-Y76 HydrophobicContact CG1-CE2 3.54Å; V74-Y76 VanDerWaalsContact CG1-CZ 3.4Å; V74-Y76 WeakPolarHBondContact CG1-OH 3.38Å; V74-Y76 WeakPolarHBondContact O-CD2 3.24Å; V74-Y76 WeakPolarHBondContact O-CE2 3.28Å; Y76-P88 HydrophobicContact CD1-CB 3.86Å; Y76-P88 HydrophobicContact CD2-CB 3.71Å; Y76-P88 HydrophobicContact CE1-CB 3.83Å; Y76-P88 HydrophobicContact CE2-CB 3.67Å; Y76-P88 HydrophobicContact CG-CB 3.81Å; Y76-F92 VanDerWaalsContact CA-O 3.31Å; Y76-F92 WeakPolarHBondContact CA-O 3.08Å; Y76-K93 HydrophobicContact CD1-CB 4.08Å; Y76-K93 HydrophobicContact CE1-CB 3.92Å; Y76-Y133 WeakPolarHBondContact O-CA 3.31Å; Y76-I134 PolarHBondContact N-O 3.29Å; Y76-I134 PolarHBondContact O-N 2.79Å; Y76-T136 WeakPolarHBondContact CE2-OG1 3.41Å
77	M	97.1	Very high	89.3	Confident	5 Å²	5	54.3 Å²	54.3	3%	0.025	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	120.8	164	-172.1	175.2	-170.7	0	0	107.7	G91 F92 Y123 F125 Y131 Y132 Y133	M77-G91 CarbonylContact O-C 3.52Å; M77-G91 WeakPolarHBondContact O-CA 3.43Å; M77-F92 HydrophobicContact CB-CE1 4.1Å; M77-F92 HydrophobicContact CB-CE2 4.08Å; M77-F92 HydrophobicContact CB-CZ 3.79Å; M77-F92 HydrophobicContact CG-CE1 4.29Å; M77-F92 HydrophobicContact CG-CZ 4.06Å; M77-F92 PolarHBondContact N-O 3.48Å; M77-F92 PolarHBondContact O-N 3.41Å; M77-F92 HydrophobicContact SD-CE1 4.19Å; M77-F92 HydrophobicContact SD-CE2 4.37Å; M77-F92 HydrophobicContact SD-CZ 3.56Å; M77-F92 VanDerWaalsContact SD-CZ 3.56Å; M77-Y123 HydrophobicContact CE-CD1 3.59Å; M77-Y123 HydrophobicContact CE-CD2 4.33Å; M77-Y123 HydrophobicContact CE-CE1 3.25Å; M77-Y123 HydrophobicContact CE-CE2 4.03Å; M77-Y123 HydrophobicContact CE-CG 4.11Å; M77-Y123 VanDerWaalsContact CE-CZ 3.47Å; M77-Y123 HydrophobicContact SD-CD1 4.05Å; M77-Y123 HydrophobicContact SD-CD2 3.97Å; M77-Y123 HydrophobicContact SD-CE1 4.13Å; M77-Y123 HydrophobicContact SD-CE2 4.03Å; M77-Y123 HydrophobicContact SD-CG 3.95Å; M77-F125 HydrophobicContact CE-CE1 3.69Å; M77-F125 HydrophobicContact CE-CZ 4.23Å; M77-Y131 HydrophobicContact CE-CD1 3.39Å; M77-Y131 HydrophobicContact CE-CE1 4.29Å; M77-Y131 HydrophobicContact CE-CG 3.87Å; M77-Y132 WeakPolarHBondContact CA-O 3.16Å; M77-Y133 HydrophobicContact CB-CD1 4.4Å; M77-Y133 HydrophobicContact CB-CE1 4.19Å; M77-Y133 HydrophobicContact CG-CE1 4.26Å; M77-Y133 HydrophobicContact SD-CE1 4.45Å
78	V	97	Very high	91.2	Very high	11 Å²	11	49 Å²	49	7%	0.067	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	163	-168.6	-63.4	0	0	0	0	112.2	Y132 I134	V78-Y132 PolarHBondContact N-O 2.85Å; V78-I134 HydrophobicContact CG1-CD1 3.8Å; V78-I134 HydrophobicContact CG1-CG1 3.8Å; V78-I134 HydrophobicContact CG2-CB 4.48Å; V78-I134 HydrophobicContact CG2-CD1 4.16Å; V78-I134 HydrophobicContact CG2-CG1 3.98Å; V78-I134 HydrophobicContact CG2-CG2 3.83Å
79	S	97.2	Very high	92.9	Very high	56 Å²	56	54.6 Å²	54.6	39%	0.392	26%	0.264	S	S	.	.			trans	-66.6	165.3	167.2	64.5	0	0	0	0	112.1	R81 G82 Y83 L90	S79-R81 PolarHBondContact O-N 3.47Å; S79-G82 WeakPolarHBondContact O-CA 3.47Å; S79-G82 PolarHBondContact O-N 3.21Å; S79-G82 PolarHBondContact OG-N 3.31Å; S79-Y83 PolarHBondContact O-N 2.94Å; S79-L90 PolarHBondContact N-O 2.94Å; S79-L90 PolarHBondContact OG-O 3.34Å
80	Y	96.3	Very high	94.1	Very high	120 Å²	120	52.4 Å²	52.4	47%	0.471	25%	0.248	S	C	.	.	H	α-helix	trans	-51.8	-41	173.5	177.6	-108.7	0	0	0	113	Y83 R84 Y132	Y80-Y83 WeakPolarHBondContact O-CB 3.17Å; Y80-Y83 PolarHBondContact O-N 3.41Å; Y80-R84 HydrophobicContact CD1-CG 4.43Å; Y80-R84 HydrophobicContact CD2-CG 4.47Å; Y80-R84 HydrophobicContact CE1-CG 3.95Å; Y80-R84 HydrophobicContact CE2-CG 4.05Å; Y80-R84 WeakPolarHBondContact O-CG 3.39Å; Y80-R84 PolarHBondContact O-N 2.87Å; Y80-R84 PolarHBondContact OH-NH1 2.86Å; Y80-Y132 AromaticContact CD2-CE1 3.72Å; Y80-Y132 HydrophobicContact CD2-CE1 3.72Å; Y80-Y132 HydrophobicContact CD2-CE2 4.28Å; Y80-Y132 AromaticContact CD2-CZ 3.56Å; Y80-Y132 VanDerWaalsContact CD2-OH 3.29Å; Y80-Y132 WeakPolarHBondContact CD2-OH 3.33Å; Y80-Y132 HydrophobicContact CE2-CE1 4.41Å
81	R	96.2	Very high	94.6	Very high	176 Å²	176	53.6 Å²	53.6	66%	0.664	26%	0.26	S	S	*	.	H	α-helix	trans	-64.6	-40.9	177.1	-173.5	179.7	177.8	-178.5	-1.1	111.6	S79 Y83 R84 N85 L90	S79-R81 PolarHBondContact O-N 3.47Å; R81-Y83 VanDerWaalsContact C-N 3.34Å; R81-R84 PolarHBondContact O-N 2.98Å; R81-N85 WeakPolarHBondContact O-CB 3.36Å; R81-N85 PolarHBondContact O-N 2.83Å; R81-N85 VanDerWaalsContact O-N 3.09Å; R81-L90 HydrophobicContact CB-CD1 4.02Å; R81-L90 HydrophobicContact CG-CD1 3.79Å
82	G	95.4	Very high	94.9	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-61.5	-41.6	173.5	0	0	0	0	0	112.4	S79 N85 C86 D87	S79-G82 WeakPolarHBondContact O-CA 3.47Å; S79-G82 PolarHBondContact O-N 3.21Å; S79-G82 PolarHBondContact OG-N 3.31Å; G82-N85 PolarHBondContact O-N 3.42Å; G82-C86 CarbonylContact O-C 3.59Å; G82-C86 WeakPolarHBondContact O-CA 3.45Å; G82-C86 PolarHBondContact O-N 3.44Å; G82-D87 PolarHBondContact O-N 2.99Å
83	Y	95.2	Very high	95.1	Very high	10 Å²	10	59.1 Å²	59.1	4%	0.039	28%	0.283	C	S	.	.	H	α-helix	trans	-62.6	-42.9	176.3	173.3	-93.1	0	0	0	113.7	G42 S79 Y80 R81 Y132 I134 R147 R149	G42-Y83 PolarHBondContact N-OH 3.14Å; S79-Y83 PolarHBondContact O-N 2.94Å; Y80-Y83 WeakPolarHBondContact O-CB 3.17Å; Y80-Y83 PolarHBondContact O-N 3.41Å; R81-Y83 VanDerWaalsContact C-N 3.34Å; Y83-Y132 AromaticContact CD1-CD1 3.88Å; Y83-Y132 HydrophobicContact CD1-CD1 3.88Å; Y83-Y132 HydrophobicContact CD1-CE1 4.23Å; Y83-Y132 AromaticContact CD2-CD1 3.71Å; Y83-Y132 HydrophobicContact CD2-CD1 3.71Å; Y83-Y132 HydrophobicContact CD2-CG 4.29Å; Y83-Y132 HydrophobicContact CE1-CD1 4.43Å; Y83-Y132 HydrophobicContact CE2-CD1 4.24Å; Y83-Y132 AromaticContact CG-CD1 3.49Å; Y83-Y132 HydrophobicContact CG-CD1 3.49Å; Y83-Y132 VanDerWaalsContact CG-CD1 3.49Å; Y83-Y132 HydrophobicContact CG-CE1 4.29Å; Y83-Y132 HydrophobicContact CG-CG 4.11Å; Y83-I134 HydrophobicContact CD2-CG2 4.19Å; Y83-R147 HydrophobicContact CD2-CB 3.88Å; Y83-R147 HydrophobicContact CD2-CG 4.32Å; Y83-R147 HydrophobicContact CE2-CB 3.55Å; Y83-R147 HydrophobicContact CE2-CG 3.65Å; Y83-R147 PolarHBondContact O-NH1 2.03Å; Y83-R147 VanDerWaalsContact O-NH1 3.14Å; Y83-R149 HydrophobicContact CE2-CB 4.48Å
84	R	93.4	Very high	95.2	Very high	115 Å²	115	61.7 Å²	61.7	43%	0.434	29%	0.293	S	S	.	.	H	α-helix	trans	-68.7	-38.9	178.8	-68.7	-59.7	-61.4	-99.6	6.7	112.1	E41 Y80 R81	E41-R84 IonicContact OE2-CZ 3.86Å; E41-R84 IonicContact OE2-NE 2.95Å; E41-R84 IonicContact OE2-NH2 3.86Å; Y80-R84 HydrophobicContact CD1-CG 4.43Å; Y80-R84 HydrophobicContact CD2-CG 4.47Å; Y80-R84 HydrophobicContact CE1-CG 3.95Å; Y80-R84 HydrophobicContact CE2-CG 4.05Å; Y80-R84 WeakPolarHBondContact O-CG 3.39Å; Y80-R84 PolarHBondContact O-N 2.87Å; Y80-R84 PolarHBondContact OH-NH1 2.86Å; R81-R84 PolarHBondContact O-N 2.98Å
85	N	92.9	Very high	95.2	Very high	104 Å²	104	65.6 Å²	65.6	56%	0.556	31%	0.306	S	S	*	.	H	α-helix	trans	-95.5	-0.6	-174.7	-65.2	-10.8	0	0	0	114.1	R81 G82 D87	R81-N85 WeakPolarHBondContact O-CB 3.36Å; R81-N85 PolarHBondContact O-N 2.83Å; R81-N85 VanDerWaalsContact O-N 3.09Å; G82-N85 PolarHBondContact O-N 3.42Å; N85-D87 HydrophobicContact CB-CB 4.34Å; N85-D87 PolarHBondContact O-N 3.35Å
86	C	92.4	Very high	95.2	Very high	26 Å²	26	68.8 Å²	68.8	18%	0.176	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.1	38.4	-171.6	-73.3	0	0	0	0	112.9	G82 P88 C145	G82-C86 CarbonylContact O-C 3.59Å; G82-C86 WeakPolarHBondContact O-CA 3.45Å; G82-C86 PolarHBondContact O-N 3.44Å; C86-P88 WeakPolarHBondContact O-CD 3.36Å; C86-C145 VanDerWaalsContact CA-SG 3.56Å; C86-C145 HydrophobicContact CB-CB 3.53Å; C86-C145 WeakPolarHBondContact CB-SG 3.32Å; C86-C145 WeakPolarHBondContact SG-CB 3.39Å; C86-C145 CovalentContact SG-SG 2.03Å; C86-C145 PolarHBondContact SG-SG 3.49Å
87	D	93.4	Very high	95	Very high	54 Å²	54	67.1 Å²	67.1	29%	0.289	32%	0.316	S	S	.	.			trans	-101.8	108.5	-174.9	-173.4	-5.3	0	0	0	111.5	G82 N85 Q89 L90	G82-D87 PolarHBondContact O-N 2.99Å; N85-D87 HydrophobicContact CB-CB 4.34Å; N85-D87 PolarHBondContact O-N 3.35Å; D87-Q89 PolarHBondContact O-N 2.98Å; D87-Q89 VanDerWaalsContact OD1-CB 3.3Å; D87-Q89 WeakPolarHBondContact OD1-CB 3.4Å; D87-Q89 WeakPolarHBondContact OD1-CG 3.42Å; D87-Q89 PolarHBondContact OD1-N 2.88Å; D87-L90 HydrophobicContact CB-CD1 4.27Å; D87-L90 HydrophobicContact CB-CG 4.38Å; D87-L90 PolarHBondContact O-N 2.97Å
88	P	93.6	Very high	94.8	Very high	27 Å²	27	70.5 Å²	70.5	18%	0.175	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-72.2	-13.1	-179.7	31.4	-36.2	0	0	0	113.6	Y76 C86 L90 T136	Y76-P88 HydrophobicContact CD1-CB 3.86Å; Y76-P88 HydrophobicContact CD2-CB 3.71Å; Y76-P88 HydrophobicContact CE1-CB 3.83Å; Y76-P88 HydrophobicContact CE2-CB 3.67Å; Y76-P88 HydrophobicContact CG-CB 3.81Å; C86-P88 WeakPolarHBondContact O-CD 3.36Å; P88-L90 PolarHBondContact O-N 2.95Å; P88-T136 HydrophobicContact CB-CG2 4.38Å; P88-T136 HydrophobicContact CG-CG2 4.04Å
89	Q	94.6	Very high	94.4	Very high	160 Å²	160	78.4 Å²	78.4	75%	0.748	36%	0.363	S	S	*	.	G	3₁₀ helix	trans	-74.1	-17.7	178.9	-58	-60.6	-44.6	0	0	112.5	D87 G91	D87-Q89 PolarHBondContact O-N 2.98Å; D87-Q89 VanDerWaalsContact OD1-CB 3.3Å; D87-Q89 WeakPolarHBondContact OD1-CB 3.4Å; D87-Q89 WeakPolarHBondContact OD1-CG 3.42Å; D87-Q89 PolarHBondContact OD1-N 2.88Å; Q89-G91 PolarHBondContact O-N 2.9Å
90	L	96.2	Very high	94	Very high	61 Å²	61	76.2 Å²	76.2	32%	0.319	35%	0.347	S	S	.	.	G	3₁₀ helix	trans	-91.4	34.1	-179.9	-61.1	179.8	0	0	0	112.6	S79 R81 D87 P88	S79-L90 PolarHBondContact N-O 2.94Å; S79-L90 PolarHBondContact OG-O 3.34Å; R81-L90 HydrophobicContact CB-CD1 4.02Å; R81-L90 HydrophobicContact CG-CD1 3.79Å; D87-L90 HydrophobicContact CB-CD1 4.27Å; D87-L90 HydrophobicContact CB-CG 4.38Å; D87-L90 PolarHBondContact O-N 2.97Å; P88-L90 PolarHBondContact O-N 2.95Å
91	G	94.7	Very high	93.6	Very high	36 Å²	36	72.5 Å²	72.5	37%	0.371	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-175.9	-159.7	-176.9	0	0	0	0	0	112.3	M77 Q89	M77-G91 CarbonylContact O-C 3.52Å; M77-G91 WeakPolarHBondContact O-CA 3.43Å; Q89-G91 PolarHBondContact O-N 2.9Å
92	F	94.6	Very high	93.2	Very high	91 Å²	91	64.8 Å²	64.8	40%	0.399	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	150	-179.7	59.3	-86.7	0	0	0	111.4	Y76 M77 R94 Y123	Y76-F92 VanDerWaalsContact CA-O 3.31Å; Y76-F92 WeakPolarHBondContact CA-O 3.08Å; M77-F92 HydrophobicContact CB-CE1 4.1Å; M77-F92 HydrophobicContact CB-CE2 4.08Å; M77-F92 HydrophobicContact CB-CZ 3.79Å; M77-F92 HydrophobicContact CG-CE1 4.29Å; M77-F92 HydrophobicContact CG-CZ 4.06Å; M77-F92 PolarHBondContact N-O 3.48Å; M77-F92 PolarHBondContact O-N 3.41Å; M77-F92 HydrophobicContact SD-CE1 4.19Å; M77-F92 HydrophobicContact SD-CE2 4.37Å; M77-F92 HydrophobicContact SD-CZ 3.56Å; M77-F92 VanDerWaalsContact SD-CZ 3.56Å; F92-R94 PolarHBondContact O-N 2.96Å; F92-Y123 AromaticContact CE1-CD2 3.96Å; F92-Y123 HydrophobicContact CE1-CD2 3.96Å; F92-Y123 AromaticContact CE1-CE2 3.94Å; F92-Y123 HydrophobicContact CE1-CE2 3.94Å; F92-Y123 AromaticContact CZ-CD2 3.54Å; F92-Y123 HydrophobicContact CZ-CD2 3.54Å; F92-Y123 AromaticContact CZ-CE2 3.96Å; F92-Y123 HydrophobicContact CZ-CE2 3.96Å; F92-Y123 HydrophobicContact CZ-CG 4.37Å
93	K	95.5	Very high	92.5	Very high	109 Å²	109	70 Å²	70	47%	0.474	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	127.4	176.4	172.4	179.9	155.1	-179.3	0	109.4	V74 Y76 E96	V74-K93 HydrophobicContact CG1-CD 3.97Å; V74-K93 HydrophobicContact CG1-CG 3.88Å; Y76-K93 HydrophobicContact CD1-CB 4.08Å; Y76-K93 HydrophobicContact CE1-CB 3.92Å; K93-E96 HydrophobicContact CD-CG 4.46Å; K93-E96 WeakPolarHBondContact CE-OE1 3.23Å; K93-E96 IonicContact NZ-OE1 2.59Å; K93-E96 PolarHBondContact NZ-OE1 3.47Å; K93-E96 IonicContact NZ-OE2 2.88Å; K93-E96 PolarHBondContact NZ-OE2 2.76Å
94	R	95.1	Very high	91.9	Very high	73 Å²	73	78.1 Å²	78.1	28%	0.275	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	-38.9	179	-165.5	69.5	-176.2	97.3	-2.8	112.9	L75 F92 F109 E111	L75-R94 PolarHBondContact O-N 3.42Å; F92-R94 PolarHBondContact O-N 2.96Å; R94-F109 HydrophobicContact CG-CE1 3.79Å; R94-F109 HydrophobicContact CG-CE2 4.18Å; R94-F109 HydrophobicContact CG-CZ 3.45Å; R94-F109 VanDerWaalsContact CG-CZ 3.45Å; R94-F109 VanDerWaalsContact CZ-CZ 3.5Å; R94-E111 IonicContact CZ-OE1 3.87Å; R94-E111 IonicContact CZ-OE2 3.61Å; R94-E111 VanDerWaalsContact CZ-OE2 3.3Å; R94-E111 IonicContact NE-OE1 2.78Å; R94-E111 IonicContact NE-OE2 3.37Å; R94-E111 PolarHBondContact NE-OE2 2.96Å; R94-E111 VanDerWaalsContact NH2-CD 3.31Å; R94-E111 IonicContact NH2-OE1 2.73Å; R94-E111 PolarHBondContact NH2-OE1 3.32Å; R94-E111 IonicContact NH2-OE2 3.15Å; R94-E111 PolarHBondContact NH2-OE2 3.47Å; R94-E111 VanDerWaalsContact NH2-OE2 3.15Å
95	W	96	Very high	91.5	Very high	94 Å²	94	75.3 Å²	75.3	36%	0.356	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	163.3	-177.1	-166.7	-108.4	0	0	0	112.8	L75 I107 F109	L75-W95 HydrophobicContact CB-CB 4.09Å; L75-W95 HydrophobicContact CD2-CB 4.18Å; L75-W95 PolarHBondContact N-O 3.12Å; L75-W95 PolarHBondContact O-N 3.38Å; W95-I107 HydrophobicContact CZ2-CG2 3.98Å; W95-F109 HydrophobicContact CB-CB 4.21Å; W95-F109 HydrophobicContact CB-CD1 4.37Å; W95-F109 HydrophobicContact CB-CD2 4.05Å; W95-F109 HydrophobicContact CB-CG 3.92Å; W95-F109 HydrophobicContact CD2-CB 3.76Å; W95-F109 AromaticContact CD2-CD2 3.7Å; W95-F109 HydrophobicContact CD2-CD2 3.7Å; W95-F109 AromaticContact CD2-CG 3.98Å; W95-F109 HydrophobicContact CD2-CG 3.98Å; W95-F109 HydrophobicContact CE3-CB 4.39Å; W95-F109 AromaticContact CE3-CD2 3.5Å; W95-F109 HydrophobicContact CE3-CD2 3.5Å; W95-F109 HydrophobicContact CE3-CE2 4.23Å; W95-F109 HydrophobicContact CE3-CG 4.25Å; W95-F109 HydrophobicContact CG-CB 3.64Å; W95-F109 AromaticContact CG-CD2 3.95Å; W95-F109 HydrophobicContact CG-CD2 3.95Å; W95-F109 AromaticContact CG-CG 3.82Å; W95-F109 HydrophobicContact CG-CG 3.82Å; W95-F109 HydrophobicContact CZ3-CD2 4.18Å
96	E	95.2	Very high	91.3	Very high	73 Å²	73	72.7 Å²	72.7	34%	0.341	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	119.7	173.6	-88.9	174.3	175	0	0	111.8	V74 K93 N98	V74-E96 HydrophobicContact CB-CG 4.31Å; V74-E96 HydrophobicContact CG1-CG 3.86Å; V74-E96 HydrophobicContact CG2-CG 4.04Å; K93-E96 HydrophobicContact CD-CG 4.46Å; K93-E96 WeakPolarHBondContact CE-OE1 3.23Å; K93-E96 IonicContact NZ-OE1 2.59Å; K93-E96 PolarHBondContact NZ-OE1 3.47Å; K93-E96 IonicContact NZ-OE2 2.88Å; K93-E96 PolarHBondContact NZ-OE2 2.76Å; E96-N98 PolarHBondContact O-N 3.31Å
97	C	93.4	Very high	91.3	Very high	9 Å²	9	73.7 Å²	73.7	6%	0.061	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	77.3	169	-65.9	0	0	0	0	109.3	C57 Q72 Y73	C57-C97 VanDerWaalsContact CA-SG 3.54Å; C57-C97 HydrophobicContact CB-CB 3.62Å; C57-C97 WeakPolarHBondContact CB-SG 3.47Å; C57-C97 VanDerWaalsContact SG-CA 3.5Å; C57-C97 WeakPolarHBondContact SG-CB 3.43Å; C57-C97 CovalentContact SG-SG 2.04Å; C57-C97 PolarHBondContact SG-SG 3.17Å; Q72-C97 VanDerWaalsContact CA-O 3.27Å; Q72-C97 WeakPolarHBondContact CA-O 2.98Å; Q72-C97 WeakPolarHBondContact CB-O 3.47Å; Y73-C97 PolarHBondContact N-O 2.91Å; Y73-C97 PolarHBondContact O-N 2.97Å
98	N	91.6	Very high	91.3	Very high	76 Å²	76	75.9 Å²	75.9	41%	0.406	38%	0.379	S	S	.	.			trans	-106.9	-0.8	-176.2	62.6	1.6	0	0	0	114.3	E96 P100	E96-N98 PolarHBondContact O-N 3.31Å; N98-P100 VanDerWaalsContact C-CD 3.47Å; N98-P100 WeakPolarHBondContact O-CD 3.48Å
99	R	90.2	Very high	91.4	Very high	177 Å²	177	75.1 Å²	75.1	67%	0.668	37%	0.373	S	S	*	.			trans	-122.3	75.4	-177.5	-70.7	175.1	-170.9	-173.7	3	111.2	H101 I107	R99-H101 VanDerWaalsContact C-N 3.26Å; R99-H101 PolarHBondContact O-N 3.25Å; R99-I107 HydrophobicContact CB-CD1 3.54Å; R99-I107 HydrophobicContact CG-CD1 4.34Å
100	P	88.5	Confident	91.5	Very high	10 Å²	10	69.8 Å²	69.8	7%	0.065	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-23	-179.1	24.2	-32.4	0	0	0	114	H59 Y60 Q72 N98	H59-P100 WeakPolarHBondContact CA-O 3.26Å; Y60-P100 HydrophobicContact CD2-CB 3.92Å; Y60-P100 PolarHBondContact N-O 3.22Å; Q72-P100 HydrophobicContact CG-CG 4.11Å; N98-P100 VanDerWaalsContact C-CD 3.47Å; N98-P100 WeakPolarHBondContact O-CD 3.48Å
101	H	87.9	Confident	91.4	Very high	42 Å²	42	67.3 Å²	67.3	19%	0.194	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.5	45.9	-179	-56.9	-67.5	0	0	0	111.5	Y60 R99	Y60-H101 PolarHBondContact O-ND1 3.42Å; R99-H101 VanDerWaalsContact C-N 3.26Å; R99-H101 PolarHBondContact O-N 3.25Å
102	A	86.6	Confident	91.4	Very high	14 Å²	14	68.5 Å²	68.5	12%	0.116	34%	0.336	C	S	.	.			trans	-62.5	138.7	175.5	0	0	0	0	0	110.3	H59 H104 I107	H59-A102 PolarHBondContact NE2-O 2.85Å; A102-H104 VanDerWaalsContact C-N 3.31Å; A102-H104 PolarHBondContact O-N 2.95Å; A102-I107 HydrophobicContact CB-CD1 4.17Å; A102-I107 HydrophobicContact CB-CG1 3.98Å
103	P	82.4	Confident	91.4	Very high	110 Å²	110	64.2 Å²	64.2	71%	0.714	32%	0.317	S	S	*	.	S	Bend	trans	-70.7	-16.5	-164.6	25.4	-35.6	0	0	0	115.8
104	H	80.8	Confident	91.3	Very high	180 Å²	180	61.4 Å²	61.4	83%	0.833	31%	0.305	S	S	*	.	S	Bend	trans	-123.4	-51.9	-172.6	-60.9	-50.4	0	0	0	113.6	A102	A102-H104 VanDerWaalsContact C-N 3.31Å; A102-H104 PolarHBondContact O-N 2.95Å
105	A	86.1	Confident	91.1	Very high	55 Å²	55	62.1 Å²	62.1	46%	0.455	31%	0.308	S	S	.	.	S	Bend	trans	-152.2	161.8	-173.5	0	0	0	0	0	110.4	I107	A105-I107 PolarHBondContact O-N 3.21Å
106	P	87.6	Confident	90.9	Very high	49 Å²	49	64.6 Å²	64.6	32%	0.318	32%	0.318	S	S	.	.			trans	-54.9	131.8	169.7	-19.9	29.3	0	0	0	110.5	Y56 H59 K108	Y56-P106 HydrophobicContact CD1-CB 4.25Å; H59-P106 HydrophobicContact CB-CB 3.73Å; H59-P106 HydrophobicContact CB-CG 3.65Å; P106-K108 PolarHBondContact O-N 3.16Å
107	I	92.6	Very high	90.6	Very high	48 Å²	48	62.2 Å²	62.2	25%	0.246	31%	0.31	C	S	.	.			trans	-66.1	133.9	174.5	-63.2	174.5	0	0	0	108	C57 W95 R99 A102 A105	C57-I107 HydrophobicContact CB-CB 4.45Å; C57-I107 WeakPolarHBondContact CB-O 3.42Å; C57-I107 PolarHBondContact N-O 3.43Å; W95-I107 HydrophobicContact CZ2-CG2 3.98Å; R99-I107 HydrophobicContact CB-CD1 3.54Å; R99-I107 HydrophobicContact CG-CD1 4.34Å; A102-I107 HydrophobicContact CB-CD1 4.17Å; A102-I107 HydrophobicContact CB-CG1 3.98Å; A105-I107 PolarHBondContact O-N 3.21Å
108	K	94.7	Very high	90.3	Very high	99 Å²	99	67.1 Å²	67.1	43%	0.43	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	138.8	175.3	72.5	176.9	-173.2	171.4	0	111.6	D54 I55 Y56 P106	D54-K108 IonicContact OD2-NZ 4Å; I55-K108 VanDerWaalsContact O-CA 3.31Å; I55-K108 WeakPolarHBondContact O-CA 3.3Å; Y56-K108 HydrophobicContact CD1-CB 3.86Å; Y56-K108 HydrophobicContact CE1-CB 3.86Å; Y56-K108 HydrophobicContact CE1-CD 4.1Å; Y56-K108 HydrophobicContact CG-CB 4.46Å; P106-K108 PolarHBondContact O-N 3.16Å
109	F	95.6	Very high	90.1	Very high	11 Å²	11	69.8 Å²	69.8	5%	0.048	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	130.9	165.5	167.7	-105.8	0	0	0	108.2	D54 I55 L75 R94 W95 E111	D54-F109 CarbonylContact C-O 3.6Å; D54-F109 WeakPolarHBondContact CA-O 3.41Å; I55-F109 HydrophobicContact CB-CD1 4.45Å; I55-F109 HydrophobicContact CD1-CD1 4.18Å; I55-F109 HydrophobicContact CG1-CD1 4.49Å; I55-F109 PolarHBondContact N-O 3.32Å; I55-F109 PolarHBondContact O-N 2.9Å; L75-F109 HydrophobicContact CD2-CD1 4.06Å; L75-F109 HydrophobicContact CD2-CE1 4.35Å; R94-F109 HydrophobicContact CG-CE1 3.79Å; R94-F109 HydrophobicContact CG-CE2 4.18Å; R94-F109 HydrophobicContact CG-CZ 3.45Å; R94-F109 VanDerWaalsContact CG-CZ 3.45Å; R94-F109 VanDerWaalsContact CZ-CZ 3.5Å; W95-F109 HydrophobicContact CB-CB 4.21Å; W95-F109 HydrophobicContact CB-CD1 4.37Å; W95-F109 HydrophobicContact CB-CD2 4.05Å; W95-F109 HydrophobicContact CB-CG 3.92Å; W95-F109 HydrophobicContact CD2-CB 3.76Å; W95-F109 AromaticContact CD2-CD2 3.7Å; W95-F109 HydrophobicContact CD2-CD2 3.7Å; W95-F109 AromaticContact CD2-CG 3.98Å; W95-F109 HydrophobicContact CD2-CG 3.98Å; W95-F109 HydrophobicContact CE3-CB 4.39Å; W95-F109 AromaticContact CE3-CD2 3.5Å; W95-F109 HydrophobicContact CE3-CD2 3.5Å; W95-F109 HydrophobicContact CE3-CE2 4.23Å; W95-F109 HydrophobicContact CE3-CG 4.25Å; W95-F109 HydrophobicContact CG-CB 3.64Å; W95-F109 AromaticContact CG-CD2 3.95Å; W95-F109 HydrophobicContact CG-CD2 3.95Å; W95-F109 AromaticContact CG-CG 3.82Å; W95-F109 HydrophobicContact CG-CG 3.82Å; W95-F109 HydrophobicContact CZ3-CD2 4.18Å; F109-E111 HydrophobicContact CE1-CB 4.01Å; F109-E111 HydrophobicContact CZ-CB 4.23Å; F109-E111 WeakPolarHBondContact CZ-OE2 3.3Å
110	S	95.4	Very high	89.7	Confident	48 Å²	48	66.9 Å²	66.9	34%	0.336	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	122.1	179.9	-62.4	0	0	0	0	109.5	L53 D54	L53-S110 CarbonylContact O-C 3.47Å; L53-S110 WeakPolarHBondContact O-CA 3.16Å; D54-S110 VanDerWaalsContact OD1-CB 3.26Å; D54-S110 WeakPolarHBondContact OD1-CB 3.24Å; D54-S110 PolarHBondContact OD1-OG 2.81Å
111	E	95.3	Very high	89.2	Confident	9 Å²	9	73.5 Å²	73.5	4%	0.042	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	137.5	169.1	-170.5	72	-99	0	0	109.1	Y52 L53 R94 F109 F113 F125 Y133	Y52-E111 CarbonylContact C-O 3.53Å; Y52-E111 WeakPolarHBondContact CA-O 3.33Å; L53-E111 HydrophobicContact CB-CB 4.4Å; L53-E111 PolarHBondContact N-O 3.23Å; L53-E111 PolarHBondContact O-N 3.09Å; R94-E111 IonicContact CZ-OE1 3.87Å; R94-E111 IonicContact CZ-OE2 3.61Å; R94-E111 VanDerWaalsContact CZ-OE2 3.3Å; R94-E111 IonicContact NE-OE1 2.78Å; R94-E111 IonicContact NE-OE2 3.37Å; R94-E111 PolarHBondContact NE-OE2 2.96Å; R94-E111 VanDerWaalsContact NH2-CD 3.31Å; R94-E111 IonicContact NH2-OE1 2.73Å; R94-E111 PolarHBondContact NH2-OE1 3.32Å; R94-E111 IonicContact NH2-OE2 3.15Å; R94-E111 PolarHBondContact NH2-OE2 3.47Å; R94-E111 VanDerWaalsContact NH2-OE2 3.15Å; F109-E111 HydrophobicContact CE1-CB 4.01Å; F109-E111 HydrophobicContact CZ-CB 4.23Å; F109-E111 WeakPolarHBondContact CZ-OE2 3.3Å; E111-F113 HydrophobicContact CG-CZ 4.45Å; E111-F125 HydrophobicContact CG-CE2 4.08Å; E111-F125 HydrophobicContact CG-CZ 3.71Å; E111-Y133 PolarHBondContact OE2-OH 2.86Å
112	K	94.7	Very high	88.9	Confident	62 Å²	62	72.7 Å²	72.7	27%	0.27	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	127	171.7	-171.5	-171.5	176.8	-165.5	0	109.1	D51 Y52 Q114 F125	D51-K112 WeakPolarHBondContact O-CA 3.5Å; Y52-K112 HydrophobicContact CD1-CB 3.84Å; Y52-K112 HydrophobicContact CD1-CG 4.06Å; Y52-K112 HydrophobicContact CE1-CB 3.65Å; Y52-K112 HydrophobicContact CE1-CD 3.89Å; Y52-K112 HydrophobicContact CE1-CG 3.67Å; Y52-K112 HydrophobicContact CE2-CD 4.47Å; Y52-K112 HydrophobicContact CE2-CG 4.29Å; K112-Q114 HydrophobicContact CD-CB 4.25Å; K112-Q114 HydrophobicContact CG-CB 4.4Å; K112-Q114 PolarHBondContact O-N 3.25Å; K112-F125 WeakPolarHBondContact O-CE2 3.47Å
113	F	94.4	Very high	89.1	Confident	0 Å²	0	75.8 Å²	75.8	0%	0	41%	0.412	C	S	.	.			trans	-82.1	67	178.7	-66.8	-86.2	0	0	0	111.4	V47 V49 N50 D51 L53 E111 F125 V150 V152	V47-F113 HydrophobicContact CB-CD2 4.13Å; V47-F113 HydrophobicContact CB-CE2 4.3Å; V47-F113 HydrophobicContact CG1-CD2 4.37Å; V47-F113 HydrophobicContact CG1-CE2 4.08Å; V47-F113 HydrophobicContact CG2-CB 4.39Å; V47-F113 HydrophobicContact CG2-CD1 3.82Å; V47-F113 HydrophobicContact CG2-CD2 3.69Å; V47-F113 HydrophobicContact CG2-CE1 4.02Å; V47-F113 HydrophobicContact CG2-CE2 3.89Å; V47-F113 HydrophobicContact CG2-CG 3.68Å; V47-F113 HydrophobicContact CG2-CZ 4.07Å; V49-F113 CarbonylContact C-O 3.51Å; V49-F113 WeakPolarHBondContact CA-O 3.49Å; N50-F113 PolarHBondContact N-O 3.45Å; D51-F113 PolarHBondContact O-N 3.45Å; L53-F113 HydrophobicContact CB-CE2 3.54Å; L53-F113 HydrophobicContact CB-CZ 4.05Å; L53-F113 HydrophobicContact CD2-CE2 4.49Å; L53-F113 HydrophobicContact CD2-CZ 4.18Å; E111-F113 HydrophobicContact CG-CZ 4.45Å; F113-F125 HydrophobicContact CB-CB 4.32Å; F113-F125 HydrophobicContact CB-CD2 4.47Å; F113-F125 HydrophobicContact CB-CG 4.33Å; F113-F125 HydrophobicContact CD1-CB 4.16Å; F113-F125 AromaticContact CD1-CD1 3.39Å; F113-F125 HydrophobicContact CD1-CD1 3.39Å; F113-F125 HydrophobicContact CD1-CD2 4.17Å; F113-F125 AromaticContact CD1-CE1 3.67Å; F113-F125 HydrophobicContact CD1-CE1 3.67Å; F113-F125 HydrophobicContact CD1-CE2 4.4Å; F113-F125 AromaticContact CD1-CG 3.65Å; F113-F125 HydrophobicContact CD1-CG 3.65Å; F113-F125 HydrophobicContact CD1-CZ 4.17Å; F113-F125 AromaticContact CE1-CD1 3.74Å; F113-F125 HydrophobicContact CE1-CD1 3.74Å; F113-F125 AromaticContact CE1-CE1 3.58Å; F113-F125 HydrophobicContact CE1-CE1 3.58Å; F113-F125 HydrophobicContact CE1-CG 4.41Å; F113-F125 HydrophobicContact CE1-CZ 4.15Å; F113-F125 HydrophobicContact CG-CD1 4.49Å; F113-F125 HydrophobicContact CG-CG 4.4Å; F113-V150 HydrophobicContact CE1-CB 4.42Å; F113-V150 HydrophobicContact CE1-CG1 3.7Å; F113-V150 HydrophobicContact CE2-CG1 4.4Å; F113-V150 HydrophobicContact CZ-CB 4.37Å; F113-V150 HydrophobicContact CZ-CG1 3.59Å; F113-V150 HydrophobicContact CZ-CG2 4.48Å; F113-V152 HydrophobicContact CD1-CG2 3.69Å; F113-V152 HydrophobicContact CE1-CG2 4.27Å; F113-V152 HydrophobicContact CG-CG2 4.44Å
114	Q	92.9	Very high	89.7	Confident	50 Å²	50	74.5 Å²	74.5	23%	0.234	40%	0.397	C	S	.	.			trans	-94.3	146.3	-179.8	64.3	-169.9	5.2	0	0	111.9	K112 Y116 F125	K112-Q114 HydrophobicContact CD-CB 4.25Å; K112-Q114 HydrophobicContact CG-CB 4.4Å; K112-Q114 PolarHBondContact O-N 3.25Å; Q114-Y116 WeakPolarHBondContact CG-O 3.48Å; Q114-F125 PolarHBondContact O-N 2.86Å
115	R	91.5	Very high	90.4	Very high	89 Å²	89	66 Å²	66	34%	0.336	36%	0.358	S	S	.	.	S	Bend	trans	-70.2	-35.4	177.6	-171.7	174.1	-176.7	156.3	-0.8	112.6	E124 F125 E163	R115-E124 WeakPolarHBondContact O-CB 3.47Å; R115-F125 WeakPolarHBondContact CA-O 3.4Å; R115-E163 IonicContact NH2-OE1 3.57Å
116	Y	90.4	Very high	90.8	Very high	145 Å²	145	67 Å²	67	57%	0.569	35%	0.352	S	S	*	.	S	Bend	trans	-124.5	128.6	-178.5	-54.9	-62.3	0	0	0	110	Q114	Q114-Y116 WeakPolarHBondContact CG-O 3.48Å
117	S	89.8	Confident	91.1	Very high	24 Å²	24	68 Å²	68	17%	0.168	36%	0.358	C	S	.	.			trans	-95.1	125.6	177.9	174.2	0	0	0	0	111.1	F119 G122 E124	S117-F119 PolarHBondContact O-N 3.45Å; S117-F119 PolarHBondContact OG-N 3.14Å; S117-F119 VanDerWaalsContact OG-N 3.09Å; S117-F119 PolarHBondContact OG-O 3.19Å; S117-G122 VanDerWaalsContact OG-CA 3.23Å; S117-G122 WeakPolarHBondContact OG-CA 3.41Å; S117-E124 PolarHBondContact N-OE1 3.16Å
118	A	88.1	Confident	91.2	Very high	111 Å²	111	67.8 Å²	67.8	92%	0.917	37%	0.367	S	S	*	.	S	Bend	trans	-71.2	-11.9	170.2	0	0	0	0	0	113.3
119	F	85.6	Confident	91.3	Very high	132 Å²	132	67.3 Å²	67.3	58%	0.579	37%	0.367	S	S	*	.	S	Bend	trans	-103.6	134.7	178.3	-173.6	-127.6	0	0	0	110.5	S117 L121 G122	S117-F119 PolarHBondContact O-N 3.45Å; S117-F119 PolarHBondContact OG-N 3.14Å; S117-F119 VanDerWaalsContact OG-N 3.09Å; S117-F119 PolarHBondContact OG-O 3.19Å; F119-L121 HydrophobicContact CD1-CB 3.96Å; F119-L121 HydrophobicContact CE1-CB 3.52Å; F119-L121 HydrophobicContact CE1-CD1 4.33Å; F119-L121 HydrophobicContact CE1-CG 4.31Å; F119-L121 HydrophobicContact CZ-CB 4.13Å; F119-L121 HydrophobicContact CZ-CD1 4.23Å; F119-L121 HydrophobicContact CZ-CG 4.45Å; F119-L121 PolarHBondContact O-N 3.41Å; F119-G122 VanDerWaalsContact CD1-N 3.29Å; F119-G122 PolarHBondContact O-N 3.02Å
120	S	81.8	Confident	91.3	Very high	116 Å²	116	70.1 Å²	70.1	81%	0.811	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-24.4	-177.5	54.1	0	0	0	0	114.3
121	L	79.6	Confident	91.4	Very high	149 Å²	149	68.2 Å²	68.2	78%	0.78	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.2	11.3	172.1	-55.4	168.4	0	0	0	112.1	F119	F119-L121 HydrophobicContact CD1-CB 3.96Å; F119-L121 HydrophobicContact CE1-CB 3.52Å; F119-L121 HydrophobicContact CE1-CD1 4.33Å; F119-L121 HydrophobicContact CE1-CG 4.31Å; F119-L121 HydrophobicContact CZ-CB 4.13Å; F119-L121 HydrophobicContact CZ-CD1 4.23Å; F119-L121 HydrophobicContact CZ-CG 4.45Å; F119-L121 PolarHBondContact O-N 3.41Å
122	G	81.9	Confident	91.6	Very high	26 Å²	26	68.8 Å²	68.8	27%	0.268	37%	0.367	S	S	.	.			trans	-77.3	155	174.8	0	0	0	0	0	110	S117 F119	S117-G122 VanDerWaalsContact OG-CA 3.23Å; S117-G122 WeakPolarHBondContact OG-CA 3.41Å; F119-G122 VanDerWaalsContact CD1-N 3.29Å; F119-G122 PolarHBondContact O-N 3.02Å
123	Y	90.6	Very high	91.7	Very high	78 Å²	78	65.8 Å²	65.8	31%	0.306	35%	0.354	S	S	.	.			trans	-95.6	144.9	-176.5	-160.7	-89.6	0	0	0	110.3	M77 F92 F125 Y131	M77-Y123 HydrophobicContact CE-CD1 3.59Å; M77-Y123 HydrophobicContact CE-CD2 4.33Å; M77-Y123 HydrophobicContact CE-CE1 3.25Å; M77-Y123 HydrophobicContact CE-CE2 4.03Å; M77-Y123 HydrophobicContact CE-CG 4.11Å; M77-Y123 VanDerWaalsContact CE-CZ 3.47Å; M77-Y123 HydrophobicContact SD-CD1 4.05Å; M77-Y123 HydrophobicContact SD-CD2 3.97Å; M77-Y123 HydrophobicContact SD-CE1 4.13Å; M77-Y123 HydrophobicContact SD-CE2 4.03Å; M77-Y123 HydrophobicContact SD-CG 3.95Å; F92-Y123 AromaticContact CE1-CD2 3.96Å; F92-Y123 HydrophobicContact CE1-CD2 3.96Å; F92-Y123 AromaticContact CE1-CE2 3.94Å; F92-Y123 HydrophobicContact CE1-CE2 3.94Å; F92-Y123 AromaticContact CZ-CD2 3.54Å; F92-Y123 HydrophobicContact CZ-CD2 3.54Å; F92-Y123 AromaticContact CZ-CE2 3.96Å; F92-Y123 HydrophobicContact CZ-CE2 3.96Å; F92-Y123 HydrophobicContact CZ-CG 4.37Å; Y123-F125 AromaticContact CD1-CD1 3.95Å; Y123-F125 HydrophobicContact CD1-CD1 3.95Å; Y123-F125 HydrophobicContact CD1-CD2 4.18Å; Y123-F125 AromaticContact CD1-CE1 3.62Å; Y123-F125 HydrophobicContact CD1-CE1 3.62Å; Y123-F125 AromaticContact CD1-CE2 3.88Å; Y123-F125 HydrophobicContact CD1-CE2 3.88Å; Y123-F125 HydrophobicContact CD1-CG 4.24Å; Y123-F125 AromaticContact CD1-CZ 3.59Å; Y123-F125 HydrophobicContact CD1-CZ 3.59Å; Y123-F125 HydrophobicContact CE1-CD1 4.11Å; Y123-F125 AromaticContact CE1-CE1 3.99Å; Y123-F125 HydrophobicContact CE1-CE1 3.99Å; Y123-F125 HydrophobicContact CE1-CZ 4.4Å; Y123-F125 HydrophobicContact CG-CZ 4.31Å; Y123-Y131 AromaticContact CE1-CD1 3.71Å; Y123-Y131 HydrophobicContact CE1-CD1 3.71Å; Y123-Y131 AromaticContact CE1-CE1 3.42Å; Y123-Y131 HydrophobicContact CE1-CE1 3.42Å; Y123-Y131 VanDerWaalsContact CE1-CE1 3.42Å; Y123-Y131 AromaticContact CZ-CE1 3.93Å; Y123-Y131 WeakPolarHBondContact OH-CE1 3.21Å
124	E	94.6	Very high	91.8	Very high	84 Å²	84	65.8 Å²	65.8	39%	0.393	35%	0.354	S	S	.	.			trans	-109.9	136.4	180	-65.9	-174	160	0	0	109.9	R115 S117	R115-E124 WeakPolarHBondContact O-CB 3.47Å; S117-E124 PolarHBondContact N-OE1 3.16Å
125	F	94.9	Very high	91.9	Very high	1 Å²	1	63.4 Å²	63.4	0%	0.004	34%	0.343	C	S	.	.			trans	-116.9	134.2	-174	-61.6	-88.8	0	0	0	110.8	M77 E111 K112 F113 Q114 R115 Y123 Y131 V152	M77-F125 HydrophobicContact CE-CE1 3.69Å; M77-F125 HydrophobicContact CE-CZ 4.23Å; E111-F125 HydrophobicContact CG-CE2 4.08Å; E111-F125 HydrophobicContact CG-CZ 3.71Å; K112-F125 WeakPolarHBondContact O-CE2 3.47Å; F113-F125 HydrophobicContact CB-CB 4.32Å; F113-F125 HydrophobicContact CB-CD2 4.47Å; F113-F125 HydrophobicContact CB-CG 4.33Å; F113-F125 HydrophobicContact CD1-CB 4.16Å; F113-F125 AromaticContact CD1-CD1 3.39Å; F113-F125 HydrophobicContact CD1-CD1 3.39Å; F113-F125 HydrophobicContact CD1-CD2 4.17Å; F113-F125 AromaticContact CD1-CE1 3.67Å; F113-F125 HydrophobicContact CD1-CE1 3.67Å; F113-F125 HydrophobicContact CD1-CE2 4.4Å; F113-F125 AromaticContact CD1-CG 3.65Å; F113-F125 HydrophobicContact CD1-CG 3.65Å; F113-F125 HydrophobicContact CD1-CZ 4.17Å; F113-F125 AromaticContact CE1-CD1 3.74Å; F113-F125 HydrophobicContact CE1-CD1 3.74Å; F113-F125 AromaticContact CE1-CE1 3.58Å; F113-F125 HydrophobicContact CE1-CE1 3.58Å; F113-F125 HydrophobicContact CE1-CG 4.41Å; F113-F125 HydrophobicContact CE1-CZ 4.15Å; F113-F125 HydrophobicContact CG-CD1 4.49Å; F113-F125 HydrophobicContact CG-CG 4.4Å; Q114-F125 PolarHBondContact O-N 2.86Å; R115-F125 WeakPolarHBondContact CA-O 3.4Å; Y123-F125 AromaticContact CD1-CD1 3.95Å; Y123-F125 HydrophobicContact CD1-CD1 3.95Å; Y123-F125 HydrophobicContact CD1-CD2 4.18Å; Y123-F125 AromaticContact CD1-CE1 3.62Å; Y123-F125 HydrophobicContact CD1-CE1 3.62Å; Y123-F125 AromaticContact CD1-CE2 3.88Å; Y123-F125 HydrophobicContact CD1-CE2 3.88Å; Y123-F125 HydrophobicContact CD1-CG 4.24Å; Y123-F125 AromaticContact CD1-CZ 3.59Å; Y123-F125 HydrophobicContact CD1-CZ 3.59Å; Y123-F125 HydrophobicContact CE1-CD1 4.11Å; Y123-F125 AromaticContact CE1-CE1 3.99Å; Y123-F125 HydrophobicContact CE1-CE1 3.99Å; Y123-F125 HydrophobicContact CE1-CZ 4.4Å; Y123-F125 HydrophobicContact CG-CZ 4.31Å; F125-Y131 WeakPolarHBondContact CA-OH 3.49Å; F125-Y131 HydrophobicContact CB-CE2 4.23Å; F125-Y131 HydrophobicContact CD1-CD1 4.11Å; F125-Y131 AromaticContact CD1-CD2 3.67Å; F125-Y131 HydrophobicContact CD1-CD2 3.67Å; F125-Y131 HydrophobicContact CD1-CE1 4.07Å; F125-Y131 AromaticContact CD1-CE2 3.59Å; F125-Y131 HydrophobicContact CD1-CE2 3.59Å; F125-Y131 AromaticContact CD1-CG 3.9Å; F125-Y131 HydrophobicContact CD1-CG 3.9Å; F125-Y131 AromaticContact CD1-CZ 3.78Å; F125-Y131 HydrophobicContact CE1-CD1 4.24Å; F125-Y131 HydrophobicContact CE1-CD2 4.21Å; F125-Y131 HydrophobicContact CE1-CG 4.04Å; F125-Y131 HydrophobicContact CG-CE2 4.4Å; F125-V152 HydrophobicContact CB-CG2 4.49Å
126	H	94.3	Very high	92	Very high	75 Å²	75	60.7 Å²	60.7	35%	0.347	34%	0.337	S	S	.	.			trans	-115.3	144.3	-176.8	-59.9	-64.7	0	0	0	111.2	Q129 Y131 V152	H126-Q129 HydrophobicContact CB-CG 3.97Å; H126-Q129 WeakPolarHBondContact O-CB 3.37Å; H126-Q129 PolarHBondContact O-N 3.48Å; H126-Y131 PolarHBondContact N-OH 2.84Å; H126-V152 WeakPolarHBondContact O-CB 3.36Å
127	V	95	Very high	92	Very high	72 Å²	72	55.3 Å²	55.3	44%	0.436	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	139.7	174.6	-176.8	0	0	0	0	110	V49 Q129 C153	V49-V127 HydrophobicContact CG2-CG2 3.47Å; V49-V127 VanDerWaalsContact CG2-CG2 3.47Å; V127-Q129 PolarHBondContact O-N 2.81Å; V127-C153 WeakPolarHBondContact CG1-O 3.26Å
128	G	94.7	Very high	91.8	Very high	43 Å²	43	56.7 Å²	56.7	44%	0.443	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.7	3.3	-178.9	0	0	0	0	0	114.5	V152	G128-V152 WeakPolarHBondContact CA-O 3.37Å; G128-V152 PolarHBondContact N-O 2.85Å
129	Q	95.9	Very high	91.2	Very high	88 Å²	88	56.5 Å²	56.5	41%	0.411	31%	0.307	S	S	.	.			trans	-99.8	151.2	178.4	-65.3	-166.8	2.6	0	0	113	H126 V127 Y131 V152	H126-Q129 HydrophobicContact CB-CG 3.97Å; H126-Q129 WeakPolarHBondContact O-CB 3.37Å; H126-Q129 PolarHBondContact O-N 3.48Å; V127-Q129 PolarHBondContact O-N 2.81Å; Q129-Y131 HydrophobicContact CB-CE2 3.78Å; Q129-Y131 PolarHBondContact OE1-OH 2.87Å; Q129-V152 PolarHBondContact O-N 2.89Å
130	E	96.8	Very high	90.3	Very high	71 Å²	71	56.6 Å²	56.6	33%	0.332	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	134.3	173.8	-65.7	-177.8	136.9	0	0	110.5	Y132 R149 V150 Y151	E130-Y132 HydrophobicContact CB-CE2 4.07Å; E130-Y132 WeakPolarHBondContact O-CE2 3.33Å; E130-Y132 PolarHBondContact OE2-OH 3.27Å; E130-R149 HydrophobicContact CB-CG 4.49Å; E130-R149 WeakPolarHBondContact OE1-CD 3.31Å; E130-R149 IonicContact OE1-CZ 2.82Å; E130-R149 IonicContact OE1-NE 2.79Å; E130-R149 IonicContact OE1-NH1 3.18Å; E130-R149 PolarHBondContact OE1-NH1 3.41Å; E130-R149 IonicContact OE2-NH1 3.63Å; E130-V150 CarbonylContact C-O 3.5Å; E130-V150 VanDerWaalsContact CA-O 3.31Å; E130-V150 WeakPolarHBondContact CA-O 3.46Å; E130-Y151 HydrophobicContact CG-CD2 3.79Å
131	Y	97.5	Very high	89.3	Confident	7 Å²	7	60.4 Å²	60.4	3%	0.027	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	143.3	179.5	-61.3	-75.4	0	0	0	110	M77 Y123 F125 H126 Q129 V150 V152	M77-Y131 HydrophobicContact CE-CD1 3.39Å; M77-Y131 HydrophobicContact CE-CE1 4.29Å; M77-Y131 HydrophobicContact CE-CG 3.87Å; Y123-Y131 AromaticContact CE1-CD1 3.71Å; Y123-Y131 HydrophobicContact CE1-CD1 3.71Å; Y123-Y131 AromaticContact CE1-CE1 3.42Å; Y123-Y131 HydrophobicContact CE1-CE1 3.42Å; Y123-Y131 VanDerWaalsContact CE1-CE1 3.42Å; Y123-Y131 AromaticContact CZ-CE1 3.93Å; Y123-Y131 WeakPolarHBondContact OH-CE1 3.21Å; F125-Y131 WeakPolarHBondContact CA-OH 3.49Å; F125-Y131 HydrophobicContact CB-CE2 4.23Å; F125-Y131 HydrophobicContact CD1-CD1 4.11Å; F125-Y131 AromaticContact CD1-CD2 3.67Å; F125-Y131 HydrophobicContact CD1-CD2 3.67Å; F125-Y131 HydrophobicContact CD1-CE1 4.07Å; F125-Y131 AromaticContact CD1-CE2 3.59Å; F125-Y131 HydrophobicContact CD1-CE2 3.59Å; F125-Y131 AromaticContact CD1-CG 3.9Å; F125-Y131 HydrophobicContact CD1-CG 3.9Å; F125-Y131 AromaticContact CD1-CZ 3.78Å; F125-Y131 HydrophobicContact CE1-CD1 4.24Å; F125-Y131 HydrophobicContact CE1-CD2 4.21Å; F125-Y131 HydrophobicContact CE1-CG 4.04Å; F125-Y131 HydrophobicContact CG-CE2 4.4Å; H126-Y131 PolarHBondContact N-OH 2.84Å; Q129-Y131 HydrophobicContact CB-CE2 3.78Å; Q129-Y131 PolarHBondContact OE1-OH 2.87Å; Y131-V150 PolarHBondContact N-O 2.8Å; Y131-V150 PolarHBondContact O-N 2.87Å; Y131-V152 HydrophobicContact CD2-CG2 3.71Å; Y131-V152 HydrophobicContact CE2-CB 4.36Å; Y131-V152 HydrophobicContact CE2-CG2 3.58Å
132	Y	97.6	Very high	88.6	Confident	21 Å²	21	55.6 Å²	55.6	8%	0.082	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	127.2	-169.5	-52.7	-91.3	0	0	0	111.4	M77 V78 Y80 Y83 E130 R149	M77-Y132 WeakPolarHBondContact CA-O 3.16Å; V78-Y132 PolarHBondContact N-O 2.85Å; Y80-Y132 AromaticContact CD2-CE1 3.72Å; Y80-Y132 HydrophobicContact CD2-CE1 3.72Å; Y80-Y132 HydrophobicContact CD2-CE2 4.28Å; Y80-Y132 AromaticContact CD2-CZ 3.56Å; Y80-Y132 VanDerWaalsContact CD2-OH 3.29Å; Y80-Y132 WeakPolarHBondContact CD2-OH 3.33Å; Y80-Y132 HydrophobicContact CE2-CE1 4.41Å; Y83-Y132 AromaticContact CD1-CD1 3.88Å; Y83-Y132 HydrophobicContact CD1-CD1 3.88Å; Y83-Y132 HydrophobicContact CD1-CE1 4.23Å; Y83-Y132 AromaticContact CD2-CD1 3.71Å; Y83-Y132 HydrophobicContact CD2-CD1 3.71Å; Y83-Y132 HydrophobicContact CD2-CG 4.29Å; Y83-Y132 HydrophobicContact CE1-CD1 4.43Å; Y83-Y132 HydrophobicContact CE2-CD1 4.24Å; Y83-Y132 AromaticContact CG-CD1 3.49Å; Y83-Y132 HydrophobicContact CG-CD1 3.49Å; Y83-Y132 VanDerWaalsContact CG-CD1 3.49Å; Y83-Y132 HydrophobicContact CG-CE1 4.29Å; Y83-Y132 HydrophobicContact CG-CG 4.11Å; E130-Y132 HydrophobicContact CB-CE2 4.07Å; E130-Y132 WeakPolarHBondContact O-CE2 3.33Å; E130-Y132 PolarHBondContact OE2-OH 3.27Å; Y132-R149 HydrophobicContact CD1-CB 4.22Å; Y132-R149 HydrophobicContact CD1-CG 4.01Å; Y132-R149 HydrophobicContact CE1-CB 4.33Å; Y132-R149 HydrophobicContact CE1-CG 3.72Å
133	Y	97.6	Very high	87.6	Confident	0 Å²	0	66 Å²	66	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	135.5	176.3	-65.7	-93.1	0	0	0	109.4	L53 L75 Y76 M77 E111 R147 L148 V150	L53-Y133 HydrophobicContact CD2-CE2 4.48Å; L75-Y133 HydrophobicContact CD2-CD1 4.33Å; L75-Y133 HydrophobicContact CG-CD1 4.46Å; Y76-Y133 WeakPolarHBondContact O-CA 3.31Å; M77-Y133 HydrophobicContact CB-CD1 4.4Å; M77-Y133 HydrophobicContact CB-CE1 4.19Å; M77-Y133 HydrophobicContact CG-CE1 4.26Å; M77-Y133 HydrophobicContact SD-CE1 4.45Å; E111-Y133 PolarHBondContact OE2-OH 2.86Å; Y133-R147 CarbonylContact O-C 3.58Å; Y133-R147 VanDerWaalsContact O-CA 3.26Å; Y133-R147 WeakPolarHBondContact O-CA 3.49Å; Y133-L148 PolarHBondContact N-O 3.15Å; Y133-L148 PolarHBondContact O-N 3.32Å; Y133-V150 HydrophobicContact CD2-CG2 3.98Å; Y133-V150 HydrophobicContact CE2-CG2 3.98Å
134	I	96.6	Very high	87	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	160.4	171.4	67.7	170.1	0	0	0	110.1	Y76 V78 Y83 L146 R147	Y76-I134 PolarHBondContact N-O 3.29Å; Y76-I134 PolarHBondContact O-N 2.79Å; V78-I134 HydrophobicContact CG1-CD1 3.8Å; V78-I134 HydrophobicContact CG1-CG1 3.8Å; V78-I134 HydrophobicContact CG2-CB 4.48Å; V78-I134 HydrophobicContact CG2-CD1 4.16Å; V78-I134 HydrophobicContact CG2-CG1 3.98Å; V78-I134 HydrophobicContact CG2-CG2 3.83Å; Y83-I134 HydrophobicContact CD2-CG2 4.19Å; I134-L146 CarbonylContact C-O 3.55Å; I134-L146 VanDerWaalsContact CA-O 3.24Å; I134-L146 WeakPolarHBondContact CA-O 3.45Å; I134-R147 HydrophobicContact CG2-CB 3.85Å
135	S	95.3	Very high	86.9	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	142.6	168	77.6	0	0	0	0	113.4	W31 V74 C145 L146	W31-S135 PolarHBondContact NE1-OG 3.38Å; V74-S135 WeakPolarHBondContact O-CA 3.38Å; V74-S135 WeakPolarHBondContact O-CB 3.48Å; S135-C145 WeakPolarHBondContact O-CA 3.49Å; S135-C145 VanDerWaalsContact O-CB 3.3Å; S135-C145 WeakPolarHBondContact O-CB 3.25Å; S135-L146 PolarHBondContact N-O 3.15Å; S135-L146 PolarHBondContact O-N 2.69Å; S135-L146 WeakPolarHBondContact OG-CB 3.34Å
136	T	93.1	Very high	86.9	Confident	32 Å²	32	63.9 Å²	63.9	20%	0.196	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	137.2	170.8	58.5	0	0	0	0	110.2	Y73 V74 Y76 P88	Y73-T136 WeakPolarHBondContact CA-O 3.42Å; V74-T136 PolarHBondContact N-O 2.99Å; V74-T136 PolarHBondContact O-N 3.08Å; V74-T136 VanDerWaalsContact O-N 3.16Å; Y76-T136 WeakPolarHBondContact CE2-OG1 3.41Å; P88-T136 HydrophobicContact CB-CG2 4.38Å; P88-T136 HydrophobicContact CG-CG2 4.04Å
137	P	90.4	Very high	86.9	Confident	31 Å²	31	61.5 Å²	61.5	20%	0.201	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	143.7	173.9	21.9	-26.2	0	0	0	110.9	Q72 Y73 H140	Q72-P137 WeakPolarHBondContact O-CA 3.48Å; Y73-P137 HydrophobicContact CD1-CB 4.16Å; Y73-P137 HydrophobicContact CE1-CB 4Å; P137-H140 HydrophobicContact CB-CB 4.17Å; P137-H140 HydrophobicContact CG-CB 4.08Å; P137-H140 WeakPolarHBondContact CG-O 3.15Å
138	T	85.4	Confident	87.1	Confident	54 Å²	54	58.1 Å²	58.1	33%	0.331	30%	0.303	S	S	.	.	S	Bend	trans	-76.8	-31.5	-178	50.5	0	0	0	0	113.2	Q72 V74	Q72-T138 HydrophobicContact CB-CG2 4.31Å; Q72-T138 WeakPolarHBondContact CB-OG1 3.39Å; Q72-T138 PolarHBondContact O-N 2.92Å; Q72-T138 PolarHBondContact O-OG1 3.38Å; V74-T138 HydrophobicContact CG2-CG2 3.7Å
139	H	76.9	Confident	87.2	Confident	107 Å²	107	59.6 Å²	59.6	50%	0.495	30%	0.295	S	S	.	.	S	Bend	trans	-109.9	-2.3	-172.3	-61.1	-68.5	0	0	0	114.2	Q72	Q72-H139 PolarHBondContact OE1-NE2 3.42Å
140	H	66.3	Low	87.3	Confident	133 Å²	133	55.4 Å²	55.4	62%	0.616	28%	0.276	S	S	*	.			trans	-126	122.9	-177.9	-64.3	-42.1	0	0	0	110.7	P137 G142	P137-H140 HydrophobicContact CB-CB 4.17Å; P137-H140 HydrophobicContact CG-CB 4.08Å; P137-H140 WeakPolarHBondContact CG-O 3.15Å; H140-G142 PolarHBondContact O-N 3.43Å; H140-G142 VanDerWaalsContact O-N 3.08Å
141	H	61.1	Low	87.3	Confident	197 Å²	197	55.9 Å²	55.9	91%	0.912	28%	0.275	S	S	*	.			trans	-84.1	33.2	178.7	-60.6	-62	0	0	0	113.2
142	G	63.5	Low	87.2	Confident	47 Å²	47	55.6 Å²	55.6	49%	0.485	27%	0.274	S	S	.	.			trans	-78.1	151.2	180	0	0	0	0	0	113.1	H140 S144	H140-G142 PolarHBondContact O-N 3.43Å; H140-G142 VanDerWaalsContact O-N 3.08Å; G142-S144 VanDerWaalsContact C-N 3.29Å; G142-S144 PolarHBondContact O-N 3Å
143	R	61.8	Low	86.8	Confident	244 Å²	244	55.5 Å²	55.5	92%	0.921	28%	0.276	S	S	*	.	S	Bend	trans	-79.5	-2.6	176.9	-69.2	-172.4	176.9	-175.7	-0.5	114.7	C145	R143-C145 PolarHBondContact O-N 2.9Å
144	S	78.4	Confident	86.3	Confident	102 Å²	102	58.7 Å²	58.7	71%	0.713	30%	0.298	S	S	*	.			trans	-86.4	104.7	178.8	56.7	0	0	0	0	110.3	G142	G142-S144 VanDerWaalsContact C-N 3.29Å; G142-S144 PolarHBondContact O-N 3Å
145	C	91.2	Very high	85.4	Confident	9 Å²	9	61.4 Å²	61.4	6%	0.061	32%	0.317	C	S	.	.			trans	-93.9	151.8	170.3	80	0	0	0	0	111.5	C86 S135 R143	C86-C145 VanDerWaalsContact CA-SG 3.56Å; C86-C145 HydrophobicContact CB-CB 3.53Å; C86-C145 WeakPolarHBondContact CB-SG 3.32Å; C86-C145 WeakPolarHBondContact SG-CB 3.39Å; C86-C145 CovalentContact SG-SG 2.03Å; C86-C145 PolarHBondContact SG-SG 3.49Å; S135-C145 WeakPolarHBondContact O-CA 3.49Å; S135-C145 VanDerWaalsContact O-CB 3.3Å; S135-C145 WeakPolarHBondContact O-CB 3.25Å; R143-C145 PolarHBondContact O-N 2.9Å
146	L	94.9	Very high	84	Confident	8 Å²	8	62.4 Å²	62.4	4%	0.042	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	142.1	163.5	-59.4	178.5	0	0	0	108.2	W31 L38 R39 Y73 I134 S135	W31-L146 HydrophobicContact CZ2-CB 3.97Å; L38-L146 HydrophobicContact CB-CB 4.07Å; L38-L146 HydrophobicContact CB-CD2 3.9Å; L38-L146 HydrophobicContact CB-CG 4.43Å; L38-L146 WeakPolarHBondContact O-CA 3.39Å; R39-L146 HydrophobicContact CG-CD2 3.75Å; Y73-L146 HydrophobicContact CE1-CD1 4.09Å; Y73-L146 HydrophobicContact CE2-CD1 4.1Å; I134-L146 CarbonylContact C-O 3.55Å; I134-L146 VanDerWaalsContact CA-O 3.24Å; I134-L146 WeakPolarHBondContact CA-O 3.45Å; S135-L146 PolarHBondContact N-O 3.15Å; S135-L146 PolarHBondContact O-N 2.69Å; S135-L146 WeakPolarHBondContact OG-CB 3.34Å
147	R	95.8	Very high	82.4	Confident	26 Å²	26	65.4 Å²	65.4	10%	0.098	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	149	-175.9	63	-175	144.7	176.7	-3.2	114.1	L38 E41 Y83 Y133 I134	L38-R147 WeakPolarHBondContact CD2-O 3.47Å; L38-R147 PolarHBondContact O-N 2.73Å; E41-R147 IonicContact OE1-CZ 3.81Å; E41-R147 IonicContact OE1-NH1 3.3Å; E41-R147 PolarHBondContact OE1-NH1 3.43Å; E41-R147 IonicContact OE1-NH2 3.99Å; E41-R147 PolarHBondContact OE1-NH2 3.03Å; Y83-R147 HydrophobicContact CD2-CB 3.88Å; Y83-R147 HydrophobicContact CD2-CG 4.32Å; Y83-R147 HydrophobicContact CE2-CB 3.55Å; Y83-R147 HydrophobicContact CE2-CG 3.65Å; Y83-R147 PolarHBondContact O-NH1 2.03Å; Y83-R147 VanDerWaalsContact O-NH1 3.14Å; Y133-R147 CarbonylContact O-C 3.58Å; Y133-R147 VanDerWaalsContact O-CA 3.26Å; Y133-R147 WeakPolarHBondContact O-CA 3.49Å; I134-R147 HydrophobicContact CG2-CB 3.85Å
148	L	97.5	Very high	80.9	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	133.7	-179.6	171.5	66	0	0	0	109.2	V29 W31 L38 Y43 M45 L53 Y133 V150	V29-L148 HydrophobicContact CG2-CD2 4.26Å; W31-L148 HydrophobicContact CH2-CB 3.97Å; W31-L148 HydrophobicContact CZ3-CB 3.77Å; W31-L148 HydrophobicContact CZ3-CD2 4.2Å; L38-L148 HydrophobicContact CD2-CB 4.2Å; Y43-L148 HydrophobicContact CD1-CD1 3.61Å; Y43-L148 HydrophobicContact CE1-CD1 3.7Å; Y43-L148 HydrophobicContact CG-CD1 4.16Å; M45-L148 HydrophobicContact CB-CD1 4.04Å; L53-L148 HydrophobicContact CD2-CD2 4.01Å; Y133-L148 PolarHBondContact N-O 3.15Å; Y133-L148 PolarHBondContact O-N 3.32Å; L148-V150 HydrophobicContact CD2-CG2 3.87Å; L148-V150 HydrophobicContact CG-CG2 3.9Å
149	R	97.7	Very high	79.4	Confident	74 Å²	74	65.5 Å²	65.5	28%	0.279	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	133.8	166.6	-178.7	173.6	65	162.6	-5.5	108.9	Y43 T44 M45 Y83 E130 Y132	Y43-R149 PolarHBondContact O-N 3.14Å; T44-R149 CarbonylContact C-O 3.53Å; T44-R149 VanDerWaalsContact CA-O 3.24Å; T44-R149 WeakPolarHBondContact CA-O 3.35Å; T44-R149 HydrophobicContact CG2-CB 4.41Å; T44-R149 HydrophobicContact CG2-CG 4.26Å; T44-R149 PolarHBondContact OG1-NE 3.14Å; T44-R149 PolarHBondContact OG1-NH2 3.42Å; M45-R149 PolarHBondContact N-O 3.19Å; Y83-R149 HydrophobicContact CE2-CB 4.48Å; E130-R149 HydrophobicContact CB-CG 4.49Å; E130-R149 WeakPolarHBondContact OE1-CD 3.31Å; E130-R149 IonicContact OE1-CZ 2.82Å; E130-R149 IonicContact OE1-NE 2.79Å; E130-R149 IonicContact OE1-NH1 3.18Å; E130-R149 PolarHBondContact OE1-NH1 3.41Å; E130-R149 IonicContact OE2-NH1 3.63Å; Y132-R149 HydrophobicContact CD1-CB 4.22Å; Y132-R149 HydrophobicContact CD1-CG 4.01Å; Y132-R149 HydrophobicContact CE1-CB 4.33Å; Y132-R149 HydrophobicContact CE1-CG 3.72Å
150	V	97.7	Very high	78.3	Confident	0 Å²	0	65 Å²	65	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	124.1	176.5	-174.8	0	0	0	0	108.8	M45 V47 L53 F113 E130 Y131 Y133 L148	M45-V150 CarbonylContact O-C 3.57Å; M45-V150 VanDerWaalsContact O-CA 3.28Å; M45-V150 WeakPolarHBondContact O-CA 3.44Å; V47-V150 HydrophobicContact CB-CG1 4.4Å; V47-V150 HydrophobicContact CG1-CG1 3.93Å; V47-V150 HydrophobicContact CG2-CG1 3.56Å; L53-V150 HydrophobicContact CD2-CG2 4.09Å; F113-V150 HydrophobicContact CE1-CB 4.42Å; F113-V150 HydrophobicContact CE1-CG1 3.7Å; F113-V150 HydrophobicContact CE2-CG1 4.4Å; F113-V150 HydrophobicContact CZ-CB 4.37Å; F113-V150 HydrophobicContact CZ-CG1 3.59Å; F113-V150 HydrophobicContact CZ-CG2 4.48Å; E130-V150 CarbonylContact C-O 3.5Å; E130-V150 VanDerWaalsContact CA-O 3.31Å; E130-V150 WeakPolarHBondContact CA-O 3.46Å; Y131-V150 PolarHBondContact N-O 2.8Å; Y131-V150 PolarHBondContact O-N 2.87Å; Y133-V150 HydrophobicContact CD2-CG2 3.98Å; Y133-V150 HydrophobicContact CE2-CG2 3.98Å; L148-V150 HydrophobicContact CD2-CG2 3.87Å; L148-V150 HydrophobicContact CG-CG2 3.9Å
151	Y	97.3	Very high	77.7	Confident	82 Å²	82	66.3 Å²	66.3	32%	0.322	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	122.6	175.3	176	-115	0	0	0	109.7	M45 Q46 V47 E130 C153	M45-Y151 PolarHBondContact O-N 2.94Å; Q46-Y151 WeakPolarHBondContact CA-O 3.47Å; Q46-Y151 HydrophobicContact CG-CD1 4.19Å; V47-Y151 PolarHBondContact N-O 2.91Å; E130-Y151 HydrophobicContact CG-CD2 3.79Å; Y151-C153 HydrophobicContact CD1-CB 3.88Å; Y151-C153 HydrophobicContact CE1-CB 3.52Å
152	V	96.2	Very high	77.4	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	109.5	177.6	-178.4	0	0	0	0	108	V47 V49 F113 F125 H126 G128 Q129 Y131	V47-V152 HydrophobicContact CG2-CB 4.47Å; V47-V152 HydrophobicContact CG2-CG2 3.85Å; V47-V152 CarbonylContact O-C 3.59Å; V47-V152 WeakPolarHBondContact O-CA 3.31Å; V49-V152 HydrophobicContact CG2-CG1 4.06Å; F113-V152 HydrophobicContact CD1-CG2 3.69Å; F113-V152 HydrophobicContact CE1-CG2 4.27Å; F113-V152 HydrophobicContact CG-CG2 4.44Å; F125-V152 HydrophobicContact CB-CG2 4.49Å; H126-V152 WeakPolarHBondContact O-CB 3.36Å; G128-V152 WeakPolarHBondContact CA-O 3.37Å; G128-V152 PolarHBondContact N-O 2.85Å; Q129-V152 PolarHBondContact O-N 2.89Å; Y131-V152 HydrophobicContact CD2-CG2 3.71Å; Y131-V152 HydrophobicContact CE2-CB 4.36Å; Y131-V152 HydrophobicContact CE2-CG2 3.58Å
153	C	89	Confident	76.9	Confident	19 Å²	19	66.6 Å²	66.6	13%	0.128	36%	0.361	C	S	.	.			trans	-95.8	-50.8	-166.1	61.8	0	0	0	0	115.6	Q46 V47 N48 V127 Y151	Q46-C153 HydrophobicContact CG-CB 3.77Å; Q46-C153 WeakPolarHBondContact CG-SG 3.31Å; V47-C153 PolarHBondContact O-N 3.26Å; V47-C153 PolarHBondContact O-SG 3.08Å; V47-C153 VanDerWaalsContact O-SG 3.42Å; N48-C153 PolarHBondContact OD1-SG 2.68Å; V127-C153 WeakPolarHBondContact CG1-O 3.26Å; Y151-C153 HydrophobicContact CD1-CB 3.88Å; Y151-C153 HydrophobicContact CE1-CB 3.52Å
154	C	86.6	Confident	76.3	Confident	67 Å²	67	59.5 Å²	59.5	45%	0.453	35%	0.346	S	S	.	.			trans	-133.8	145.8	-167.7	-57	0	0	0	0	110.9	V49	V49-C154 PolarHBondContact N-O 2.97Å
155	S	76.9	Confident	74.9	Confident	58 Å²	58	62.9 Å²	62.9	41%	0.406	35%	0.351	S	S	.	.			trans	-66	148.1	159.9	45.9	0	0	0	0	110
156	T	67.5	Low	72.6	Confident	21 Å²	21	68.5 Å²	68.5	13%	0.129	39%	0.388	C	S	.	.			trans	-74.5	149.5	166.1	45.2	0	0	0	0	108.7	N48 V49 N50 S158 D159	N48-T156 HydrophobicContact CB-CG2 4.43Å; V49-T156 WeakPolarHBondContact O-CG2 3.3Å; N50-T156 PolarHBondContact ND2-OG1 2.9Å; T156-S158 PolarHBondContact O-N 3.39Å; T156-S158 PolarHBondContact OG1-OG 3Å; T156-D159 PolarHBondContact N-OD2 2.79Å; T156-D159 PolarHBondContact O-N 3.01Å; T156-D159 PolarHBondContact OG1-OD2 2.91Å
157	A	58.3	Low	70.3	Confident	94 Å²	94	74.5 Å²	74.5	78%	0.777	43%	0.425	S	S	*	.	G	3₁₀ helix	trans	-56.5	-16.2	-175.7	0	0	0	0	0	114
158	S	58.7	Low	68.1	Low	56 Å²	56	81.6 Å²	81.6	39%	0.392	46%	0.459	S	S	.	.	G	3₁₀ helix	trans	-76.3	-19.8	172.1	50.3	0	0	0	0	115.1	T156 V160	T156-S158 PolarHBondContact O-N 3.39Å; T156-S158 PolarHBondContact OG1-OG 3Å; S158-V160 VanDerWaalsContact C-N 3.32Å
159	D	54.4	Low	65.4	Low	31 Å²	31	87.2 Å²	87.2	17%	0.166	50%	0.495	C	S	.	.	G	3₁₀ helix	trans	-87.8	-0.7	-179.6	-48.2	-58.2	0	0	0	112.6	N50 T156	N50-D159 PolarHBondContact ND2-OD1 2.76Å; N50-D159 VanDerWaalsContact ND2-OD1 3.1Å; N50-D159 PolarHBondContact ND2-OD2 2.84Å; T156-D159 PolarHBondContact N-OD2 2.79Å; T156-D159 PolarHBondContact O-N 3.01Å; T156-D159 PolarHBondContact OG1-OD2 2.91Å
160	V	53.8	Low	62.5	Low	97 Å²	97	90 Å²	90	59%	0.588	52%	0.516	S	S	*	.	S	Bend	trans	-79.3	-23.1	178.8	-176.5	0	0	0	0	111.5	S158 D162	S158-V160 VanDerWaalsContact C-N 3.32Å; V160-D162 VanDerWaalsContact C-N 3.33Å
161	D	54.1	Low	59.8	Low	160 Å²	160	99.6 Å²	99.6	86%	0.856	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.1	-7.8	175.3	-91.4	-14.3	0	0	0	113.5
162	D	54	Low	57.3	Low	124 Å²	124	100.9 Å²	100.9	66%	0.663	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.6	10.7	-177.9	-88.4	-31.6	0	0	0	113.3	V160 P164	V160-D162 VanDerWaalsContact C-N 3.33Å; D162-P164 VanDerWaalsContact O-CD 3.29Å; D162-P164 WeakPolarHBondContact O-CD 3.37Å
163	E	52.4	Low	54.8	Low	127 Å²	127	108.3 Å²	108.3	59%	0.593	61%	0.609	S	S	*	*	S	Bend	trans	-66.2	117.9	166.1	-90.1	-93.5	116.3	0	0	108.3	R115 E165	R115-E163 IonicContact NH2-OE1 3.57Å; E163-E165 PolarHBondContact O-N 2.76Å; E163-E165 VanDerWaalsContact O-N 3.09Å
164	P	49.9	Very low	52.4	Low	94 Å²	94	118.7 Å²	118.7	61%	0.61	65%	0.646	S	S	*	*			trans	-62	119.7	173.1	25.1	-30.6	0	0	0	107.9	D162	D162-P164 VanDerWaalsContact O-CD 3.29Å; D162-P164 WeakPolarHBondContact O-CD 3.37Å
165	E	48.1	Very low	50.3	Low	174 Å²	174	121.7 Å²	121.7	81%	0.813	66%	0.664	S	S	*	*			trans	-45.8	135.8	167.4	-89.4	-171.3	145.9	0	0	108.5	E163 T167	E163-E165 PolarHBondContact O-N 2.76Å; E163-E165 VanDerWaalsContact O-N 3.09Å; E165-T167 PolarHBondContact O-N 2.81Å
166	P	43.5	Very low	48.9	Very low	127 Å²	127	122.5 Å²	122.5	83%	0.825	68%	0.681	S	S	*	*			trans	-54.4	109	174.7	-18.5	28.6	0	0	0	107.6	E168	P166-E168 PolarHBondContact O-N 2.84Å
167	T	47.2	Very low	47.5	Very low	134 Å²	134	129 Å²	129	82%	0.822	72%	0.715	S	S	*	*			trans	-63.7	114.4	175.5	-24.8	0	0	0	0	105.1	E165	E165-T167 PolarHBondContact O-N 2.81Å
168	E	48.4	Very low	46.7	Very low	174 Å²	174	134 Å²	134	81%	0.813	72%	0.719	S	S	*	*			trans	-49.1	135.7	173.1	-79.1	-162.5	146.3	0	0	108.5	P166 D170	P166-E168 PolarHBondContact O-N 2.84Å; E168-D170 PolarHBondContact O-N 2.9Å
169	P	42.3	Very low	46.2	Very low	118 Å²	118	137.8 Å²	137.8	77%	0.766	73%	0.733	S	S	*	*			trans	-65.1	108	175.8	26	-31.3	0	0	0	108.5	Y171	P169-Y171 VanDerWaalsContact C-N 3.34Å; P169-Y171 PolarHBondContact O-N 2.54Å
170	D	36.9	Very low	45.5	Very low	134 Å²	134	143 Å²	143	72%	0.717	76%	0.761	S	S	*	*			trans	-62	93.5	172.1	-170.6	19.3	0	0	0	108.7	E168 T172	E168-D170 PolarHBondContact O-N 2.9Å; D170-T172 PolarHBondContact O-N 2.91Å
171	Y	41	Very low	44.7	Very low	200 Å²	200	144.9 Å²	144.9	78%	0.784	77%	0.768	S	S	*	*			trans	-75.9	71.5	175.1	64	-83.6	0	0	0	108.9	P169 L173	P169-Y171 VanDerWaalsContact C-N 3.34Å; P169-Y171 PolarHBondContact O-N 2.54Å; Y171-L173 VanDerWaalsContact C-N 3.34Å; Y171-L173 PolarHBondContact O-N 3.25Å
172	T	43.8	Very low	44.2	Very low	110 Å²	110	144.6 Å²	144.6	68%	0.675	77%	0.765	S	S	*	*			trans	-73.5	94.4	166.9	44.9	0	0	0	0	108.9	D170 R174	D170-T172 PolarHBondContact O-N 2.91Å; T172-R174 PolarHBondContact O-N 2.72Å; T172-R174 VanDerWaalsContact O-N 3.08Å
173	L	43.9	Very low	43.5	Very low	156 Å²	156	146.1 Å²	146.1	82%	0.817	77%	0.773	S	S	*	*			trans	-60.4	109.9	169.2	-70.9	171.3	0	0	0	109.1	Y171	Y171-L173 VanDerWaalsContact C-N 3.34Å; Y171-L173 PolarHBondContact O-N 3.25Å
174	R	38.3	Very low	42.7	Very low	237 Å²	237	148.1 Å²	148.1	89%	0.894	78%	0.782	S	S	*	*			trans	-66.5	131.1	168.7	-159.5	176.3	-164.5	-158.4	3.7	108.8	T172 G176	T172-R174 PolarHBondContact O-N 2.72Å; T172-R174 VanDerWaalsContact O-N 3.08Å; R174-G176 PolarHBondContact O-N 3.1Å
175	P	42.5	Very low	41.9	Very low	130 Å²	130	153.3 Å²	153.3	84%	0.844	79%	0.791	S	S	*	*	S	Bend	trans	-76.9	115.8	-176.7	29.1	-30.6	0	0	0	109.5
176	G	48.8	Very low	41.4	Very low	74 Å²	74	150.3 Å²	150.3	76%	0.763	78%	0.781	S	S	*	*			trans	158.3	19.9	172.3	0	0	0	0	0	119.7	R174	R174-G176 PolarHBondContact O-N 3.1Å
177	L	38.3	Very low	41.6	Very low	159 Å²	159	149.3 Å²	149.3	83%	0.832	77%	0.774	S	S	*	*			trans	-123.1	108.4	173.8	-82.1	161.8	0	0	0	110.6	I179	L177-I179 HydrophobicContact CB-CD1 4.04Å; L177-I179 HydrophobicContact CD2-CD1 4.17Å
178	K	40.3	Very low	41.4	Very low	199 Å²	199	151.6 Å²	151.6	87%	0.865	77%	0.773	S	S	*	*			trans	-85.7	118.3	161	-74.7	-179.4	175.7	178.8	0	107.1
179	I	48	Very low	41.1	Very low	135 Å²	135	149.7 Å²	149.7	69%	0.692	77%	0.773	S	S	*	*			trans	-124.4	105.3	158	-69.6	98.4	0	0	0	105.4	L177	L177-I179 HydrophobicContact CB-CD1 4.04Å; L177-I179 HydrophobicContact CD2-CD1 4.17Å
180	D	39.4	Very low	41	Very low	141 Å²	141	149.6 Å²	149.6	75%	0.754	77%	0.772	S	S	*	*			trans	-68.5	150	160.6	-70.3	-55.6	0	0	0	109.3
181	D	37.6	Very low	40.9	Very low	135 Å²	135	152.8 Å²	152.8	72%	0.722	78%	0.78	S	S	*	*			trans	64	116.4	168.7	-88	-36.5	0	0	0	118.3
182	I	44.3	Very low	40.9	Very low	155 Å²	155	151.5 Å²	151.5	80%	0.795	79%	0.786	S	S	*	*				-166	100.9	106.3	-80.8	143.3	0	0	0	106.7	E184	I182-E184 HydrophobicContact CG2-CB 4.43Å; I182-E184 PolarHBondContact O-N 3.15Å
183	D	39.2	Very low	40.8	Very low	155 Å²	155	154.6 Å²	154.6	83%	0.829	79%	0.792	S	S	*	*			trans	-66.4	107.8	152.9	-85.4	-42	0	0	0	108.4
184	E	34.9	Very low	40.6	Very low	170 Å²	170	156.8 Å²	156.8	79%	0.794	80%	0.795	S	S	*	*			trans	-161	104.5	150	-145.5	149	-174.7	0	0	113.8	I182	I182-E184 HydrophobicContact CG2-CB 4.43Å; I182-E184 PolarHBondContact O-N 3.15Å
185	Y	33.8	Very low	40.6	Very low	203 Å²	203	150.9 Å²	150.9	80%	0.796	79%	0.791	S	S	*	*				67.5	102.3	129.7	-140.8	-97.4	0	0	0	121.2
186	N	36.3	Very low	40.5	Very low	111 Å²	111	151.1 Å²	151.1	59%	0.594	79%	0.789	S	S	*	*				170.9	123.2	95.3	-172.2	12.9	0	0	0	111	F188	N186-F188 PolarHBondContact O-N 2.99Å
187	P	48.4	Very low	40	Very low	106 Å²	106	153.1 Å²	153.1	69%	0.688	79%	0.791	S	S	*	*			trans	-91.4	77.2	-178.5	36.5	-35.7	0	0	0	112.2
188	F	43.5	Very low	39.9	Very low	181 Å²	181	148.2 Å²	148.2	79%	0.794	78%	0.78	S	S	*	*			trans	-148.5	82.9	164.6	-86.7	-78.1	0	0	0	111.7	N186	N186-F188 PolarHBondContact O-N 2.99Å
189	V	41.9	Very low	39.9	Very low	134 Å²	134	144.2 Å²	144.2	81%	0.812	78%	0.776	S	S	*	*			trans	-115.4	120.9	156.2	-164.5	0	0	0	0	106.4	K191	V189-K191 PolarHBondContact O-N 3.36Å
190	P	40	Very low	39.6	Very low	116 Å²	116	142.9 Å²	142.9	75%	0.753	78%	0.779	S	S	*	*			trans	-60.6	134	173.6	-7.3	18.9	0	0	0	108.5	L192	P190-L192 PolarHBondContact O-N 3.32Å
191	K	34.9	Very low	39.6	Very low	201 Å²	201	141.1 Å²	141.1	87%	0.874	78%	0.775	S	S	*	*			trans	-51.5	111.4	168.7	-93.5	176.9	174	169.7	0	108.3	V189 E193	V189-K191 PolarHBondContact O-N 3.36Å; K191-E193 PolarHBondContact O-N 2.88Å; K191-E193 VanDerWaalsContact O-N 3.07Å
192	L	40.7	Very low	40	Very low	174 Å²	174	137.6 Å²	137.6	91%	0.911	76%	0.761	S	S	*	*			trans	-71	104.7	163.5	-157.6	73.4	0	0	0	106	P190 K194	P190-L192 PolarHBondContact O-N 3.32Å; L192-K194 PolarHBondContact O-N 2.59Å
193	E	42.3	Very low	40.3	Very low	175 Å²	175	140.1 Å²	140.1	82%	0.818	76%	0.761	S	S	*	*			trans	-53.6	132.8	173.2	-61.5	-174.8	150	0	0	108.5	K191 S195	K191-E193 PolarHBondContact O-N 2.88Å; K191-E193 VanDerWaalsContact O-N 3.07Å; E193-S195 PolarHBondContact O-N 3.05Å
194	K	39.2	Very low	40.9	Very low	201 Å²	201	137.8 Å²	137.8	87%	0.874	75%	0.748	S	S	*	*			trans	-51.2	112.2	175.6	-75.6	175.6	176.7	173.8	0	108.1	L192 V196	L192-K194 PolarHBondContact O-N 2.59Å; K194-V196 PolarHBondContact O-N 3.35Å
195	S	37.7	Very low	41.6	Very low	114 Å²	114	138.8 Å²	138.8	80%	0.797	75%	0.745	S	S	*	*			trans	-60.2	107.9	162.5	52.7	0	0	0	0	107	E193 S197	E193-S195 PolarHBondContact O-N 3.05Å; S195-S197 VanDerWaalsContact C-N 3.27Å; S195-S197 PolarHBondContact O-N 2.95Å
196	V	41.1	Very low	42.5	Very low	135 Å²	135	134.6 Å²	134.6	82%	0.818	74%	0.735	S	S	*	*			trans	-60.4	97.4	164	173	0	0	0	0	105.8	K194 G198	K194-V196 PolarHBondContact O-N 3.35Å; V196-G198 VanDerWaalsContact C-N 3.32Å; V196-G198 PolarHBondContact O-N 3.13Å
197	S	37.3	Very low	43.5	Very low	115 Å²	115	134.2 Å²	134.2	80%	0.804	73%	0.733	S	S	*	*			trans	-66.7	101.8	163.6	-173.1	0	0	0	0	105.9	S195 S199	S195-S197 VanDerWaalsContact C-N 3.27Å; S195-S197 PolarHBondContact O-N 2.95Å; S197-S199 PolarHBondContact O-N 3.02Å; S197-S199 VanDerWaalsContact O-N 3.15Å
198	G	36.8	Very low	43.8	Very low	57 Å²	57	134.3 Å²	134.3	59%	0.588	73%	0.727	S	S	*	*			trans	-53.2	120.1	170.5	0	0	0	0	0	108	V196 S200	V196-G198 VanDerWaalsContact C-N 3.32Å; V196-G198 PolarHBondContact O-N 3.13Å; G198-S200 VanDerWaalsContact C-N 3.33Å; G198-S200 PolarHBondContact O-N 3.1Å
199	S	41.1	Very low	44.6	Very low	114 Å²	114	129.3 Å²	129.3	80%	0.797	71%	0.712	S	S	*	*			trans	-60.3	98.8	170	56.1	0	0	0	0	108.2	S197	S197-S199 PolarHBondContact O-N 3.02Å; S197-S199 VanDerWaalsContact O-N 3.15Å
200	S	40.8	Very low	45.7	Very low	107 Å²	107	126.4 Å²	126.4	75%	0.748	69%	0.694	S	S	*	*			trans	-62.3	124	161.6	-177.2	0	0	0	0	106.7	G198 S202	G198-S200 VanDerWaalsContact C-N 3.33Å; G198-S200 PolarHBondContact O-N 3.1Å; S200-S202 PolarHBondContact O-N 3.38Å
201	P	40.3	Very low	46.9	Very low	104 Å²	104	124.2 Å²	124.2	68%	0.675	68%	0.679	S	S	*	*			trans	-64.7	115.6	176.4	2.2	9.3	0	0	0	107	R203	P201-R203 PolarHBondContact O-N 2.78Å
202	S	44.6	Very low	48.5	Very low	61 Å²	61	120.7 Å²	120.7	43%	0.427	67%	0.667	S	S	.	*			trans	-55.1	130.8	171.3	58	0	0	0	0	108.3	S200 D204 R205	S200-S202 PolarHBondContact O-N 3.38Å; S202-D204 PolarHBondContact O-N 3.26Å; S202-R205 PolarHBondContact O-N 3.49Å
203	R	51.8	Low	49.6	Very low	208 Å²	208	118.4 Å²	118.4	79%	0.785	66%	0.655	S	S	*	*	H	α-helix	trans	-48.2	-24.6	172.9	-94.7	164.7	48.6	-169.3	-6.7	112.3	P201 L206 L207	P201-R203 PolarHBondContact O-N 2.78Å; R203-L206 PolarHBondContact O-N 3.47Å; R203-L207 WeakPolarHBondContact O-CB 3.46Å; R203-L207 WeakPolarHBondContact O-CG 3.33Å; R203-L207 PolarHBondContact O-N 3.46Å
204	D	51	Low	50.4	Low	106 Å²	106	117 Å²	117	57%	0.567	65%	0.646	S	S	*	*	H	α-helix	trans	-67.8	-36.4	178.4	-52.5	-41	0	0	0	112.7	S202 L208	S202-D204 PolarHBondContact O-N 3.26Å; D204-L208 WeakPolarHBondContact O-CB 3.48Å; D204-L208 WeakPolarHBondContact O-CD1 3.42Å; D204-L208 WeakPolarHBondContact O-CG 3.36Å; D204-L208 PolarHBondContact O-N 2.52Å
205	R	49.6	Very low	51.7	Low	192 Å²	192	111.4 Å²	111.4	73%	0.725	63%	0.625	S	S	*	*	H	α-helix	trans	-71.8	-34	178.2	-127.8	-174.4	174.4	-161.1	-2.5	111.9	S202 T209	S202-R205 PolarHBondContact O-N 3.49Å; R205-T209 WeakPolarHBondContact O-CG2 3.31Å; R205-T209 PolarHBondContact O-N 3.14Å; R205-T209 PolarHBondContact O-OG1 3.38Å; R205-T209 VanDerWaalsContact O-OG1 3.13Å
206	L	53.4	Low	53	Low	114 Å²	114	108.3 Å²	108.3	60%	0.597	61%	0.607	S	S	*	*	H	α-helix	trans	-71.8	-41.6	177.6	-145.9	138.5	0	0	0	110.8	R203 T209 V210	R203-L206 PolarHBondContact O-N 3.47Å; L206-T209 WeakPolarHBondContact CA-OG1 3.49Å; L206-T209 PolarHBondContact O-N 3.07Å; L206-T209 PolarHBondContact O-OG1 3.37Å; L206-V210 HydrophobicContact CD2-CG2 4.32Å; L206-V210 WeakPolarHBondContact O-CB 3.23Å; L206-V210 VanDerWaalsContact O-CG2 3.23Å; L206-V210 WeakPolarHBondContact O-CG2 3.19Å; L206-V210 PolarHBondContact O-N 3.4Å
207	L	56.7	Low	53.9	Low	103 Å²	103	105 Å²	105	54%	0.539	59%	0.593	S	S	.	*	H	α-helix	trans	-64.4	-39.7	173.7	-77.5	166.7	0	0	0	112.6	R203 V210 T211	R203-L207 WeakPolarHBondContact O-CB 3.46Å; R203-L207 WeakPolarHBondContact O-CG 3.33Å; R203-L207 PolarHBondContact O-N 3.46Å; L207-V210 PolarHBondContact O-N 2.9Å; L207-T211 WeakPolarHBondContact O-CB 3.36Å; L207-T211 WeakPolarHBondContact O-CG2 3.46Å; L207-T211 PolarHBondContact O-N 3.01Å; L207-T211 PolarHBondContact O-OG1 3.17Å
208	L	56.1	Low	54.8	Low	108 Å²	108	105.1 Å²	105.1	57%	0.565	59%	0.585	S	S	*	*	H	α-helix	trans	-65.1	-40.9	174.3	-84.2	159.3	0	0	0	112.2	D204 T211 M212	D204-L208 WeakPolarHBondContact O-CB 3.48Å; D204-L208 WeakPolarHBondContact O-CD1 3.42Å; D204-L208 WeakPolarHBondContact O-CG 3.36Å; D204-L208 PolarHBondContact O-N 2.52Å; L208-T211 VanDerWaalsContact CA-OG1 3.29Å; L208-T211 WeakPolarHBondContact CA-OG1 3.47Å; L208-T211 PolarHBondContact O-OG1 3.31Å; L208-T211 VanDerWaalsContact O-OG1 3.04Å; L208-M212 WeakPolarHBondContact O-CB 3.34Å; L208-M212 WeakPolarHBondContact O-CG 3.38Å; L208-M212 PolarHBondContact O-N 2.04Å
209	T	59.7	Low	55.8	Low	77 Å²	77	110.8 Å²	110.8	47%	0.472	59%	0.593	S	S	.	*	H	α-helix	trans	-68.2	-38.7	176.4	49.9	0	0	0	0	112.7	R205 L206 L213	R205-T209 WeakPolarHBondContact O-CG2 3.31Å; R205-T209 PolarHBondContact O-N 3.14Å; R205-T209 PolarHBondContact O-OG1 3.38Å; R205-T209 VanDerWaalsContact O-OG1 3.13Å; L206-T209 WeakPolarHBondContact CA-OG1 3.49Å; L206-T209 PolarHBondContact O-N 3.07Å; L206-T209 PolarHBondContact O-OG1 3.37Å; T209-L213 WeakPolarHBondContact O-CB 3.27Å; T209-L213 WeakPolarHBondContact O-CD1 3.05Å; T209-L213 WeakPolarHBondContact O-CG 3.24Å; T209-L213 PolarHBondContact O-N 3.47Å
210	V	64.4	Low	56.5	Low	73 Å²	73	112.6 Å²	112.6	44%	0.442	59%	0.593	S	S	.	*	H	α-helix	trans	-70	-40	178.4	172.9	0	0	0	0	111	L206 L207 L213 F214	L206-V210 HydrophobicContact CD2-CG2 4.32Å; L206-V210 WeakPolarHBondContact O-CB 3.23Å; L206-V210 VanDerWaalsContact O-CG2 3.23Å; L206-V210 WeakPolarHBondContact O-CG2 3.19Å; L206-V210 PolarHBondContact O-N 3.4Å; L207-V210 PolarHBondContact O-N 2.9Å; V210-L213 PolarHBondContact O-N 3.28Å; V210-F214 WeakPolarHBondContact O-CB 3.45Å; V210-F214 PolarHBondContact O-N 2.89Å
211	T	65.9	Low	56.8	Low	70 Å²	70	115.4 Å²	115.4	43%	0.429	61%	0.612	S	S	.	*	H	α-helix	trans	-67.5	-39	176	42.1	0	0	0	0	112.5	L207 L208 F214 L215	L207-T211 WeakPolarHBondContact O-CB 3.36Å; L207-T211 WeakPolarHBondContact O-CG2 3.46Å; L207-T211 PolarHBondContact O-N 3.01Å; L207-T211 PolarHBondContact O-OG1 3.17Å; L208-T211 VanDerWaalsContact CA-OG1 3.29Å; L208-T211 WeakPolarHBondContact CA-OG1 3.47Å; L208-T211 PolarHBondContact O-OG1 3.31Å; L208-T211 VanDerWaalsContact O-OG1 3.04Å; T211-F214 PolarHBondContact O-N 3.34Å; T211-L215 WeakPolarHBondContact O-CB 3.1Å; T211-L215 VanDerWaalsContact O-CG 3.3Å; T211-L215 WeakPolarHBondContact O-CG 3.42Å; T211-L215 PolarHBondContact O-N 3.34Å
212	M	67.9	Low	57.6	Low	127 Å²	127	116 Å²	116	63%	0.626	61%	0.609	S	S	*	*	H	α-helix	trans	-69.1	-37.1	176.3	-68.6	-64.4	-82.4	0	0	112.6	L208 L215 A216	L208-M212 WeakPolarHBondContact O-CB 3.34Å; L208-M212 WeakPolarHBondContact O-CG 3.38Å; L208-M212 PolarHBondContact O-N 2.04Å; M212-L215 HydrophobicContact SD-CD1 4.35Å; M212-A216 WeakPolarHBondContact O-CB 3.05Å; M212-A216 PolarHBondContact O-N 3.45Å
213	L	63.8	Low	58.3	Low	125 Å²	125	118.9 Å²	118.9	65%	0.654	62%	0.619	S	S	*	*	H	α-helix	trans	-66.6	-37.9	173	-81.9	160.4	0	0	0	112.2	T209 V210 A216 A217	T209-L213 WeakPolarHBondContact O-CB 3.27Å; T209-L213 WeakPolarHBondContact O-CD1 3.05Å; T209-L213 WeakPolarHBondContact O-CG 3.24Å; T209-L213 PolarHBondContact O-N 3.47Å; V210-L213 PolarHBondContact O-N 3.28Å; L213-A216 PolarHBondContact O-N 3.04Å; L213-A217 PolarHBondContact O-N 2.88Å; L213-A217 VanDerWaalsContact O-N 3.12Å
214	F	60.3	Low	58.7	Low	145 Å²	145	113.9 Å²	113.9	64%	0.636	61%	0.61	S	S	*	*	H	α-helix	trans	-69.7	-38.5	176.5	-125.5	-90.2	0	0	0	112.5	V210 T211 A217 L218	V210-F214 WeakPolarHBondContact O-CB 3.45Å; V210-F214 PolarHBondContact O-N 2.89Å; T211-F214 PolarHBondContact O-N 3.34Å; F214-A217 PolarHBondContact O-N 3.21Å; F214-L218 WeakPolarHBondContact O-CG 3.33Å; F214-L218 PolarHBondContact O-N 3Å
215	L	65.5	Low	59.2	Low	84 Å²	84	114.4 Å²	114.4	44%	0.44	61%	0.612	S	S	.	*	H	α-helix	trans	-64.9	-43.2	173.8	-75.8	167.2	0	0	0	111	T211 M212 A217 L218 F219	T211-L215 WeakPolarHBondContact O-CB 3.1Å; T211-L215 VanDerWaalsContact O-CG 3.3Å; T211-L215 WeakPolarHBondContact O-CG 3.42Å; T211-L215 PolarHBondContact O-N 3.34Å; M212-L215 HydrophobicContact SD-CD1 4.35Å; L215-A217 VanDerWaalsContact C-N 3.31Å; L215-A217 PolarHBondContact O-N 3.22Å; L215-L218 PolarHBondContact O-N 3.17Å; L215-L218 VanDerWaalsContact O-N 3.16Å; L215-F219 WeakPolarHBondContact O-CD2 3.45Å; L215-F219 PolarHBondContact O-N 3.09Å
216	A	64.1	Low	59.7	Low	49 Å²	49	109.6 Å²	109.6	41%	0.405	61%	0.605	S	S	.	*	H	α-helix	trans	-60.9	-38.4	176.3	0	0	0	0	0	112.7	M212 L213 L218 F219 I220	M212-A216 WeakPolarHBondContact O-CB 3.05Å; M212-A216 PolarHBondContact O-N 3.45Å; L213-A216 PolarHBondContact O-N 3.04Å; A216-L218 VanDerWaalsContact C-N 3.33Å; A216-L218 PolarHBondContact O-N 2.91Å; A216-F219 PolarHBondContact O-N 3.09Å; A216-I220 WeakPolarHBondContact O-CD1 3.22Å; A216-I220 WeakPolarHBondContact O-CG1 3.36Å
217	A	60.5	Low	60.2	Low	65 Å²	65	109.3 Å²	109.3	54%	0.537	61%	0.606	S	S	.	*	H	α-helix	trans	-68.6	-28.6	176.7	0	0	0	0	0	113.5	L213 F214 L215	L213-A217 PolarHBondContact O-N 2.88Å; L213-A217 VanDerWaalsContact O-N 3.12Å; F214-A217 PolarHBondContact O-N 3.21Å; L215-A217 VanDerWaalsContact C-N 3.31Å; L215-A217 PolarHBondContact O-N 3.22Å
218	L	57.5	Low	60.4	Low	119 Å²	119	109.7 Å²	109.7	62%	0.623	61%	0.61	S	S	*	*	H	α-helix	trans	-77.5	-21.3	177.4	-76	165.1	0	0	0	113.7	F214 L215 A216	F214-L218 WeakPolarHBondContact O-CG 3.33Å; F214-L218 PolarHBondContact O-N 3Å; L215-L218 PolarHBondContact O-N 3.17Å; L215-L218 VanDerWaalsContact O-N 3.16Å; A216-L218 VanDerWaalsContact C-N 3.33Å; A216-L218 PolarHBondContact O-N 2.91Å
219	F	56.5	Low	60.8	Low	175 Å²	175	109.8 Å²	109.8	77%	0.768	61%	0.614	S	S	*	*	S	Bend	trans	-89.6	-8.1	177.7	-73.6	-68	0	0	0	114.1	L215 A216	L215-F219 WeakPolarHBondContact O-CD2 3.45Å; L215-F219 PolarHBondContact O-N 3.09Å; A216-F219 PolarHBondContact O-N 3.09Å
220	I	56.3	Low	60.8	Low	153 Å²	153	112.6 Å²	112.6	79%	0.785	63%	0.625	S	S	*	*			trans	-104.3	-4.6	-178.1	-59.2	166.5	0	0	0	111.9	A216	A216-I220 WeakPolarHBondContact O-CD1 3.22Å; A216-I220 WeakPolarHBondContact O-CG1 3.36Å
221	S	47.4	Very low	60.5	Low	166 Å²	166	116.2 Å²	116.2	100%	1.161	64%	0.642	S	S	*	*			trans	-110.6	0	178.5	-174.1	0	0	0	0	114

Retrieved 221 of 221 residues in 41.4 ms (Link to these results)

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