A0A096MQQ9_PAPAN Loading...

Toll-interacting protein

Component of the signaling pathway of IL-1 and Toll-like receptors. Inhibits cell activation by microbial products. Recruits IRAK1 to the IL-1 receptor complex. Inhibits IRAK1 phosphorylation and kinase activity. Connects the ubiquitin pathway to autophagy by functioning as a ubiquitin-ATG8 family adapter and thus mediating autophagic clearance of ubiquitin conjugates. The TOLLIP-dependent selective autophagy pathway plays an important role in clearance of cytotoxic polyQ proteins aggregates. In a complex with TOM1, recruits ubiquitin-conjugated proteins onto early endosomes. Binds to phosphatidylinositol 3-phosphate (PtdIns(3)P).

AlphaFold DB (Q9H0E2), UniProt , Accession A0A096MQQ9, Species PAPAN (Papio anubis, Olive baboon), Gene TOLLIP, Length 274 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	58.8	Low	71.5	Confident	211 Å²	211	110 Å²	110	100%	1.039	60%	0.598	S	S	*	*				0	124.6	0	-77.3	-173.7	-177.5	0	0	108	T3	M1-T3 PolarHBondContact O-N 2.92Å
2	A	62.9	Low	71.7	Confident	38 Å²	38	106 Å²	106	31%	0.314	58%	0.58	S	S	.	*	P	Polyproline II helix	trans	-65.5	127.9	170.8	0	0	0	0	0	109.2	Y13 E16	A2-Y13 HydrophobicContact CB-CD1 4.43Å; A2-E16 WeakPolarHBondContact CB-O 3.47Å
3	T	66.8	Low	71.5	Confident	89 Å²	89	108.4 Å²	108.4	55%	0.546	58%	0.577	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-104	127.7	173.1	-51.5	0	0	0	0	107.9	M1 I14	M1-T3 PolarHBondContact O-N 2.92Å; T3-I14 PolarHBondContact N-O 3.2Å; T3-I14 PolarHBondContact O-N 3.21Å
4	T	67.4	Low	71.9	Confident	71 Å²	71	107.8 Å²	107.8	44%	0.436	57%	0.572	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-82.2	121.2	173.9	-47.4	0	0	0	0	109.2	P11 Y13	T4-P11 HydrophobicContact CG2-CB 3.68Å; T4-Y13 HydrophobicContact CG2-CE1 4.35Å; T4-Y13 WeakPolarHBondContact OG1-CE1 3.23Å
5	V	74.7	Confident	72.3	Confident	64 Å²	64	104.5 Å²	104.5	39%	0.388	57%	0.574	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-110.2	121.2	173.4	-179.4	0	0	0	0	108.5	T7 V12 I14	V5-T7 PolarHBondContact O-N 3.48Å; V5-V12 PolarHBondContact N-O 3.39Å; V5-V12 PolarHBondContact O-N 2.83Å; V5-I14 HydrophobicContact CB-CD1 4.09Å; V5-I14 HydrophobicContact CG2-CD1 3.77Å; V5-I14 HydrophobicContact CG2-CG1 4.33Å
6	S	73	Confident	72.6	Confident	105 Å²	105	108.1 Å²	108.1	73%	0.734	59%	0.585	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-74.6	120.5	173.9	-176.6	0	0	0	0	109.9
7	T	76.8	Confident	72.7	Confident	57 Å²	57	108.2 Å²	108.2	35%	0.35	59%	0.585	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-105.4	169.4	170.3	73.6	0	0	0	0	110.1	V5 R9 G10 V12	V5-T7 PolarHBondContact O-N 3.48Å; T7-R9 PolarHBondContact O-N 2.81Å; T7-R9 PolarHBondContact OG1-N 2.99Å; T7-R9 VanDerWaalsContact OG1-N 3.15Å; T7-G10 PolarHBondContact N-O 3.1Å; T7-G10 PolarHBondContact O-N 3Å; T7-G10 PolarHBondContact OG1-O 3.19Å; T7-V12 HydrophobicContact CG2-CB 4.16Å; T7-V12 HydrophobicContact CG2-CG2 3.53Å
8	Q	77.6	Confident	72.8	Confident	212 Å²	212	104.9 Å²	104.9	99%	0.991	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.6	-17.4	170.9	-66.8	-171.9	13.4	0	0	113.2
9	R	75.7	Confident	73.1	Confident	247 Å²	247	108.5 Å²	108.5	93%	0.932	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.6	6.9	178.1	-63.8	-172.3	178	-173.3	-0.2	113.7	T7	T7-R9 PolarHBondContact O-N 2.81Å; T7-R9 PolarHBondContact OG1-N 2.99Å; T7-R9 VanDerWaalsContact OG1-N 3.15Å
10	G	78.6	Confident	73.1	Confident	26 Å²	26	108 Å²	108	27%	0.268	58%	0.58	S	S	.	*	E	Extended strand (participates in β ladder)	trans	108.7	-179.2	-175.8	0	0	0	0	0	113.4	T7 V12	T7-G10 PolarHBondContact N-O 3.1Å; T7-G10 PolarHBondContact O-N 3Å; T7-G10 PolarHBondContact OG1-O 3.19Å; G10-V12 PolarHBondContact O-N 2.89Å
11	P	74.2	Confident	73	Confident	90 Å²	90	107.3 Å²	107.3	58%	0.584	57%	0.572	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-68.4	125.8	-178.3	25.9	-31.5	0	0	0	111.3	T4	T4-P11 HydrophobicContact CG2-CB 3.68Å
12	V	73.6	Confident	73.9	Confident	62 Å²	62	104.6 Å²	104.6	38%	0.376	56%	0.561	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-107.2	129.1	172.8	179.2	0	0	0	0	108.2	V5 T7 G10 I14	V5-V12 PolarHBondContact N-O 3.39Å; V5-V12 PolarHBondContact O-N 2.83Å; T7-V12 HydrophobicContact CG2-CB 4.16Å; T7-V12 HydrophobicContact CG2-CG2 3.53Å; G10-V12 PolarHBondContact O-N 2.89Å; V12-I14 HydrophobicContact CG1-CG1 3.98Å
13	Y	69.5	Low	74.6	Confident	137 Å²	137	111.1 Å²	111.1	54%	0.537	58%	0.577	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-87.7	120.4	172.6	-71.9	-92	0	0	0	109.1	A2 T4	A2-Y13 HydrophobicContact CB-CD1 4.43Å; T4-Y13 HydrophobicContact CG2-CE1 4.35Å; T4-Y13 WeakPolarHBondContact OG1-CE1 3.23Å
14	I	76.7	Confident	74.8	Confident	100 Å²	100	114.2 Å²	114.2	51%	0.513	59%	0.589	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-116.7	123.5	177.8	-52.6	-179.8	0	0	0	108.1	T3 V5 V12	T3-I14 PolarHBondContact N-O 3.2Å; T3-I14 PolarHBondContact O-N 3.21Å; V5-I14 HydrophobicContact CB-CD1 4.09Å; V5-I14 HydrophobicContact CG2-CD1 3.77Å; V5-I14 HydrophobicContact CG2-CG1 4.33Å; V12-I14 HydrophobicContact CG1-CG1 3.98Å
15	G	78.1	Confident	75.2	Confident	58 Å²	58	115.4 Å²	115.4	60%	0.598	60%	0.596	S	S	*	*	S	Bend	trans	130.9	-168	-178.8	0	0	0	0	0	112.4	L17	G15-L17 PolarHBondContact O-N 3.27Å
16	E	76.8	Confident	75.3	Confident	163 Å²	163	114.6 Å²	114.6	76%	0.762	59%	0.592	S	S	*	*	S	Bend	trans	-61.9	129.1	174.6	-72.1	-170.5	154.4	0	0	111.2	A2	A2-E16 WeakPolarHBondContact CB-O 3.47Å
17	L	74.7	Confident	75.9	Confident	109 Å²	109	113.1 Å²	113.1	57%	0.571	58%	0.579	S	S	*	*	P	Polyproline II helix	trans	-62.1	130.2	-179.9	-157.2	66.7	0	0	0	110.3	G15 F21	G15-L17 PolarHBondContact O-N 3.27Å; L17-F21 HydrophobicContact CD1-CB 3.89Å; L17-F21 HydrophobicContact CD1-CD1 3.4Å; L17-F21 VanDerWaalsContact CD1-CD1 3.4Å; L17-F21 HydrophobicContact CD1-CD2 3.38Å; L17-F21 HydrophobicContact CD1-CE1 3.61Å; L17-F21 HydrophobicContact CD1-CE2 3.59Å; L17-F21 HydrophobicContact CD1-CG 3.27Å; L17-F21 HydrophobicContact CD1-CZ 3.69Å; L17-F21 HydrophobicContact CD2-CB 3.82Å; L17-F21 HydrophobicContact CD2-CD1 3.48Å; L17-F21 VanDerWaalsContact CD2-CD1 3.48Å; L17-F21 HydrophobicContact CD2-CE1 4.18Å; L17-F21 HydrophobicContact CD2-CG 3.78Å; L17-F21 HydrophobicContact CG-CB 3.41Å; L17-F21 VanDerWaalsContact CG-CB 3.41Å; L17-F21 HydrophobicContact CG-CD1 3.6Å; L17-F21 HydrophobicContact CG-CD2 3.95Å; L17-F21 HydrophobicContact CG-CE1 4.28Å; L17-F21 HydrophobicContact CG-CG 3.38Å
18	P	74.1	Confident	76.3	Confident	50 Å²	50	118.5 Å²	118.5	33%	0.325	60%	0.6	S	S	.	*	P	Polyproline II helix	trans	-52.3	144.1	173.8	-26.1	33.8	0	0	0	111.5	D20 F21	P18-D20 WeakPolarHBondContact CB-OD1 3.29Å; P18-D20 PolarHBondContact O-N 3.14Å; P18-F21 HydrophobicContact CB-CB 4.43Å; P18-F21 VanDerWaalsContact O-CB 3.25Å; P18-F21 WeakPolarHBondContact O-CB 3.33Å; P18-F21 PolarHBondContact O-N 3.25Å
19	Q	78.5	Confident	76.8	Confident	173 Å²	173	115.8 Å²	115.8	81%	0.808	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.3	-19.6	179.6	-70.1	-172.9	-6.2	0	0	112.9	R23	Q19-R23 PolarHBondContact O-NE 3.07Å; Q19-R23 VanDerWaalsContact O-NE 3.13Å; Q19-R23 PolarHBondContact O-NH1 3.22Å
20	D	74	Confident	77.2	Confident	97 Å²	97	108.8 Å²	108.8	52%	0.519	57%	0.565	S	S	.	*	T	Hydrogen-bonded Turn	trans	-103.4	9.9	177.8	63.3	-31.6	0	0	0	113.7	P18 L22 R23	P18-D20 WeakPolarHBondContact CB-OD1 3.29Å; P18-D20 PolarHBondContact O-N 3.14Å; D20-L22 PolarHBondContact O-N 3.35Å; D20-R23 HydrophobicContact CB-CB 4.26Å; D20-R23 WeakPolarHBondContact O-CB 3.4Å; D20-R23 PolarHBondContact O-N 2.85Å
21	F	71.6	Confident	77.6	Confident	94 Å²	94	113.6 Å²	113.6	41%	0.412	58%	0.575	S	S	.	*	T	Hydrogen-bonded Turn	trans	-61	126.6	175.3	-167.4	-93.9	0	0	0	110.5	L17 P18 R23	L17-F21 HydrophobicContact CD1-CB 3.89Å; L17-F21 HydrophobicContact CD1-CD1 3.4Å; L17-F21 VanDerWaalsContact CD1-CD1 3.4Å; L17-F21 HydrophobicContact CD1-CD2 3.38Å; L17-F21 HydrophobicContact CD1-CE1 3.61Å; L17-F21 HydrophobicContact CD1-CE2 3.59Å; L17-F21 HydrophobicContact CD1-CG 3.27Å; L17-F21 HydrophobicContact CD1-CZ 3.69Å; L17-F21 HydrophobicContact CD2-CB 3.82Å; L17-F21 HydrophobicContact CD2-CD1 3.48Å; L17-F21 VanDerWaalsContact CD2-CD1 3.48Å; L17-F21 HydrophobicContact CD2-CE1 4.18Å; L17-F21 HydrophobicContact CD2-CG 3.78Å; L17-F21 HydrophobicContact CG-CB 3.41Å; L17-F21 VanDerWaalsContact CG-CB 3.41Å; L17-F21 HydrophobicContact CG-CD1 3.6Å; L17-F21 HydrophobicContact CG-CD2 3.95Å; L17-F21 HydrophobicContact CG-CE1 4.28Å; L17-F21 HydrophobicContact CG-CG 3.38Å; P18-F21 HydrophobicContact CB-CB 4.43Å; P18-F21 VanDerWaalsContact O-CB 3.25Å; P18-F21 WeakPolarHBondContact O-CB 3.33Å; P18-F21 PolarHBondContact O-N 3.25Å; F21-R23 PolarHBondContact O-N 3.17Å; F21-R23 VanDerWaalsContact O-N 3.16Å
22	L	77.4	Confident	78.2	Confident	155 Å²	155	114.2 Å²	114.2	81%	0.812	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	62.8	1.8	-169	-56.3	172.7	0	0	0	115.8	D20 I24	D20-L22 PolarHBondContact O-N 3.35Å; L22-I24 PolarHBondContact O-N 3.09Å
23	R	76.4	Confident	78.8	Confident	175 Å²	175	115.6 Å²	115.6	66%	0.66	58%	0.579	S	S	*	*			trans	-78.5	104.7	169.4	-62	-167.3	-177.6	162.6	-0.5	108.7	Q19 D20 F21 T25	Q19-R23 PolarHBondContact O-NE 3.07Å; Q19-R23 VanDerWaalsContact O-NE 3.13Å; Q19-R23 PolarHBondContact O-NH1 3.22Å; D20-R23 HydrophobicContact CB-CB 4.26Å; D20-R23 WeakPolarHBondContact O-CB 3.4Å; D20-R23 PolarHBondContact O-N 2.85Å; F21-R23 PolarHBondContact O-N 3.17Å; F21-R23 VanDerWaalsContact O-N 3.16Å; R23-T25 PolarHBondContact O-N 3.1Å
24	I	71.5	Confident	79.5	Confident	153 Å²	153	114.2 Å²	114.2	79%	0.785	58%	0.577	S	S	*	*			trans	-70.8	100.2	169.7	-57.9	172.9	0	0	0	106.9	L22 P26	L22-I24 PolarHBondContact O-N 3.09Å; I24-P26 VanDerWaalsContact O-CD 3.3Å; I24-P26 WeakPolarHBondContact O-CD 3.45Å
25	T	76.7	Confident	79.9	Confident	97 Å²	97	114.2 Å²	114.2	60%	0.595	58%	0.577	S	S	*	*	P	Polyproline II helix	trans	-69.4	117.8	172.3	-62.4	0	0	0	0	107.7	R23 T27	R23-T25 PolarHBondContact O-N 3.1Å; T25-T27 PolarHBondContact O-N 3.21Å
26	P	77	Confident	80.3	Confident	46 Å²	46	115.6 Å²	115.6	30%	0.299	57%	0.571	S	S	.	*	P	Polyproline II helix	trans	-59.7	134.2	-179.5	21.7	-31.5	0	0	0	110	I24 Q30 R31	I24-P26 VanDerWaalsContact O-CD 3.3Å; I24-P26 WeakPolarHBondContact O-CD 3.45Å; P26-Q30 VanDerWaalsContact CA-OE1 3.28Å; P26-Q30 HydrophobicContact CB-CB 3.84Å; P26-R31 HydrophobicContact CB-CG 4.24Å; P26-R31 HydrophobicContact CG-CG 3.9Å; P26-R31 PolarHBondContact O-NE 2.86Å; P26-R31 PolarHBondContact O-NH2 3.27Å
27	T	85.3	Confident	80.7	Confident	74 Å²	74	109.9 Å²	109.9	45%	0.454	55%	0.552	S	S	.	*	P	Polyproline II helix	trans	-56.1	158.3	172.7	65.9	0	0	0	0	109.5	T25 Q29 Q30 R31	T25-T27 PolarHBondContact O-N 3.21Å; T27-Q29 PolarHBondContact O-N 3.2Å; T27-Q29 VanDerWaalsContact O-N 3.16Å; T27-Q30 PolarHBondContact O-N 2.95Å; T27-Q30 WeakPolarHBondContact OG1-CG 3Å; T27-Q30 PolarHBondContact OG1-N 2.84Å; T27-Q30 VanDerWaalsContact OG1-N 3.13Å; T27-R31 PolarHBondContact O-N 2.9Å
28	Q	85.3	Confident	81.1	Confident	171 Å²	171	109 Å²	109	80%	0.799	55%	0.545	S	S	*	.	H	α-helix	trans	-53.2	-38.4	176	-71.5	-172.9	0	0	0	111.4	R31 Q32	Q28-R31 PolarHBondContact O-N 2.72Å; Q28-Q32 PolarHBondContact O-N 3.19Å
29	Q	86.5	Confident	81.7	Confident	154 Å²	154	108.8 Å²	108.8	72%	0.72	55%	0.548	S	S	*	.	H	α-helix	trans	-64.2	-45.7	175.7	-169.1	175.7	5.7	0	0	112.6	T27 R31 Q32 V33	T27-Q29 PolarHBondContact O-N 3.2Å; T27-Q29 VanDerWaalsContact O-N 3.16Å; Q29-R31 VanDerWaalsContact C-N 3.33Å; Q29-R31 PolarHBondContact O-N 3.47Å; Q29-Q32 PolarHBondContact O-N 3.37Å; Q29-V33 WeakPolarHBondContact O-CG2 3.05Å; Q29-V33 PolarHBondContact O-N 3.26Å
30	Q	85.3	Confident	81.9	Confident	101 Å²	101	102 Å²	102	47%	0.472	52%	0.521	S	S	.	.	H	α-helix	trans	-63.1	-39.5	176.9	-75.5	169.5	-21.2	0	0	112.1	P26 T27 V33 Q34	P26-Q30 VanDerWaalsContact CA-OE1 3.28Å; P26-Q30 HydrophobicContact CB-CB 3.84Å; T27-Q30 PolarHBondContact O-N 2.95Å; T27-Q30 WeakPolarHBondContact OG1-CG 3Å; T27-Q30 PolarHBondContact OG1-N 2.84Å; T27-Q30 VanDerWaalsContact OG1-N 3.13Å; Q30-V33 PolarHBondContact O-N 2.98Å; Q30-Q34 PolarHBondContact O-N 2.85Å
31	R	86.1	Confident	82.3	Confident	127 Å²	127	100.6 Å²	100.6	48%	0.479	51%	0.511	S	S	.	.	H	α-helix	trans	-61.4	-45.2	173.9	-103.7	-177.7	-77.6	-172.1	-6	111.8	P26 T27 Q28 Q29 Q34 L35	P26-R31 HydrophobicContact CB-CG 4.24Å; P26-R31 HydrophobicContact CG-CG 3.9Å; P26-R31 PolarHBondContact O-NE 2.86Å; P26-R31 PolarHBondContact O-NH2 3.27Å; T27-R31 PolarHBondContact O-N 2.9Å; Q28-R31 PolarHBondContact O-N 2.72Å; Q29-R31 VanDerWaalsContact C-N 3.33Å; Q29-R31 PolarHBondContact O-N 3.47Å; R31-Q34 PolarHBondContact O-N 2.81Å; R31-L35 WeakPolarHBondContact O-CG 3.41Å; R31-L35 PolarHBondContact O-N 2.89Å
32	Q	87.6	Confident	82.6	Confident	102 Å²	102	101.2 Å²	101.2	48%	0.477	52%	0.515	S	S	.	.	H	α-helix	trans	-59.9	-47.9	177.3	-171.1	62.1	49.8	0	0	111.2	Q28 Q29 Q34 L35 D36	Q28-Q32 PolarHBondContact O-N 3.19Å; Q29-Q32 PolarHBondContact O-N 3.37Å; Q32-Q34 VanDerWaalsContact C-N 3.28Å; Q32-Q34 PolarHBondContact O-N 3.47Å; Q32-L35 PolarHBondContact O-N 2.74Å; Q32-L35 VanDerWaalsContact O-N 3.15Å; Q32-D36 PolarHBondContact NE2-OD1 3.32Å; Q32-D36 WeakPolarHBondContact O-CB 3.35Å; Q32-D36 PolarHBondContact O-N 3.24Å
33	V	85.1	Confident	82.7	Confident	92 Å²	92	101 Å²	101	56%	0.558	51%	0.514	S	S	*	.	H	α-helix	trans	-58.7	-40	177.7	172.4	0	0	0	0	111.8	Q29 Q30 A37	Q29-V33 WeakPolarHBondContact O-CG2 3.05Å; Q29-V33 PolarHBondContact O-N 3.26Å; Q30-V33 PolarHBondContact O-N 2.98Å; V33-A37 VanDerWaalsContact O-CB 3.31Å; V33-A37 WeakPolarHBondContact O-CB 3.35Å; V33-A37 PolarHBondContact O-N 2.89Å
34	Q	84.7	Confident	82.6	Confident	108 Å²	108	95.2 Å²	95.2	51%	0.505	50%	0.495	S	S	.	.	H	α-helix	trans	-67.5	-41	177.4	-172.5	177.8	15	0	0	112.4	Q30 R31 Q32 A37 Q38	Q30-Q34 PolarHBondContact O-N 2.85Å; R31-Q34 PolarHBondContact O-N 2.81Å; Q32-Q34 VanDerWaalsContact C-N 3.28Å; Q32-Q34 PolarHBondContact O-N 3.47Å; Q34-A37 PolarHBondContact O-N 3.23Å; Q34-Q38 WeakPolarHBondContact O-CG 3.46Å; Q34-Q38 PolarHBondContact O-N 3.38Å
35	L	85.5	Confident	82.7	Confident	99 Å²	99	88.7 Å²	88.7	52%	0.518	46%	0.46	S	S	.	.	H	α-helix	trans	-64.7	-44.1	175.9	-70.9	173.1	0	0	0	111.2	R31 Q32 A37 Q38 A39	R31-L35 WeakPolarHBondContact O-CG 3.41Å; R31-L35 PolarHBondContact O-N 2.89Å; Q32-L35 PolarHBondContact O-N 2.74Å; Q32-L35 VanDerWaalsContact O-N 3.15Å; L35-A37 VanDerWaalsContact C-N 3.33Å; L35-A37 PolarHBondContact O-N 3.43Å; L35-Q38 PolarHBondContact O-N 3.18Å; L35-A39 WeakPolarHBondContact O-CB 3.5Å; L35-A39 PolarHBondContact O-N 2.98Å
36	D	86.7	Confident	82	Confident	87 Å²	87	87.1 Å²	87.1	47%	0.465	46%	0.464	S	S	.	.	H	α-helix	trans	-62.7	-42.1	177.1	-65	-13.8	0	0	0	110.9	Q32 A39 A40	Q32-D36 PolarHBondContact NE2-OD1 3.32Å; Q32-D36 WeakPolarHBondContact O-CB 3.35Å; Q32-D36 PolarHBondContact O-N 3.24Å; D36-A39 PolarHBondContact O-N 3.4Å; D36-A40 WeakPolarHBondContact O-CB 3.39Å; D36-A40 PolarHBondContact O-N 3.48Å
37	A	84.3	Confident	81.3	Confident	44 Å²	44	88.2 Å²	88.2	36%	0.364	48%	0.484	S	S	.	.	H	α-helix	trans	-60.2	-47.9	175.1	0	0	0	0	0	111.2	V33 Q34 L35 A40 Q41	V33-A37 VanDerWaalsContact O-CB 3.31Å; V33-A37 WeakPolarHBondContact O-CB 3.35Å; V33-A37 PolarHBondContact O-N 2.89Å; Q34-A37 PolarHBondContact O-N 3.23Å; L35-A37 VanDerWaalsContact C-N 3.33Å; L35-A37 PolarHBondContact O-N 3.43Å; A37-A40 PolarHBondContact O-N 2.98Å; A37-Q41 WeakPolarHBondContact O-CG 3.46Å; A37-Q41 PolarHBondContact O-N 3.42Å
38	Q	84.2	Confident	80	Confident	90 Å²	90	85.9 Å²	85.9	42%	0.421	47%	0.472	S	S	.	.	H	α-helix	trans	-62	-43.8	177.1	-74	-179.6	10.9	0	0	112.4	Q34 L35 A40 Q41 Q42	Q34-Q38 WeakPolarHBondContact O-CG 3.46Å; Q34-Q38 PolarHBondContact O-N 3.38Å; L35-Q38 PolarHBondContact O-N 3.18Å; Q38-A40 VanDerWaalsContact C-N 3.34Å; Q38-A40 PolarHBondContact O-N 3.37Å; Q38-Q41 PolarHBondContact O-N 3Å; Q38-Q42 WeakPolarHBondContact O-CG 3.39Å; Q38-Q42 PolarHBondContact O-N 3.15Å
39	A	85.1	Confident	78.9	Confident	46 Å²	46	84.8 Å²	84.8	38%	0.38	48%	0.476	S	S	.	.	H	α-helix	trans	-60.6	-43.9	176.1	0	0	0	0	0	111.1	L35 D36 Q41 Q42 L43	L35-A39 WeakPolarHBondContact O-CB 3.5Å; L35-A39 PolarHBondContact O-N 2.98Å; D36-A39 PolarHBondContact O-N 3.4Å; A39-Q41 VanDerWaalsContact C-N 3.33Å; A39-Q41 PolarHBondContact O-N 2.87Å; A39-Q42 PolarHBondContact O-N 2.95Å; A39-L43 WeakPolarHBondContact O-CG 3.31Å; A39-L43 PolarHBondContact O-N 3.46Å
40	A	84	Confident	78.4	Confident	30 Å²	30	79.8 Å²	79.8	25%	0.248	47%	0.466	C	S	.	.	H	α-helix	trans	-61.8	-38.5	174.6	0	0	0	0	0	112.4	D36 A37 Q38 L43 Q44 Y83	D36-A40 WeakPolarHBondContact O-CB 3.39Å; D36-A40 PolarHBondContact O-N 3.48Å; A37-A40 PolarHBondContact O-N 2.98Å; Q38-A40 VanDerWaalsContact C-N 3.34Å; Q38-A40 PolarHBondContact O-N 3.37Å; A40-L43 PolarHBondContact O-N 2.91Å; A40-Q44 WeakPolarHBondContact O-CB 3.03Å; A40-Q44 PolarHBondContact O-N 2.92Å; A40-Y83 HydrophobicContact CB-CD1 4Å; A40-Y83 HydrophobicContact CB-CG 4.25Å
41	Q	81.5	Confident	78.2	Confident	68 Å²	68	78.8 Å²	78.8	32%	0.318	47%	0.467	S	S	.	.	H	α-helix	trans	-61.8	-46.4	173.9	-44.7	-153.2	-36.4	0	0	111.5	A37 Q38 A39 L43 Q44 Y45 Y83	A37-Q41 WeakPolarHBondContact O-CG 3.46Å; A37-Q41 PolarHBondContact O-N 3.42Å; Q38-Q41 PolarHBondContact O-N 3Å; A39-Q41 VanDerWaalsContact C-N 3.33Å; A39-Q41 PolarHBondContact O-N 2.87Å; Q41-L43 VanDerWaalsContact C-N 3.34Å; Q41-L43 PolarHBondContact O-N 3.44Å; Q41-Q44 PolarHBondContact O-N 2.97Å; Q41-Y45 VanDerWaalsContact O-CD2 3.26Å; Q41-Y45 WeakPolarHBondContact O-CD2 3.3Å; Q41-Y45 PolarHBondContact O-N 3Å; Q41-Y83 VanDerWaalsContact CA-CE1 3.47Å; Q41-Y83 HydrophobicContact CB-CE1 4.1Å; Q41-Y83 WeakPolarHBondContact CB-OH 3.26Å; Q41-Y83 VanDerWaalsContact CD-OH 3.25Å; Q41-Y83 HydrophobicContact CG-CE1 4.03Å; Q41-Y83 HydrophobicContact CG-CE2 3.87Å; Q41-Y83 VanDerWaalsContact CG-CZ 3.47Å; Q41-Y83 WeakPolarHBondContact CG-OH 3.34Å; Q41-Y83 PolarHBondContact NE2-OH 3.43Å
42	Q	78.1	Confident	78.2	Confident	106 Å²	106	73 Å²	73	50%	0.495	45%	0.446	S	S	.	.	H	α-helix	trans	-64.6	-37.8	178.6	-69.4	178.4	11.1	0	0	112	Q38 A39 G46	Q38-Q42 WeakPolarHBondContact O-CG 3.39Å; Q38-Q42 PolarHBondContact O-N 3.15Å; A39-Q42 PolarHBondContact O-N 2.95Å; Q42-G46 WeakPolarHBondContact O-CA 3.47Å; Q42-G46 PolarHBondContact O-N 3.3Å
43	L	79.6	Confident	78.3	Confident	151 Å²	151	68.3 Å²	68.3	79%	0.791	43%	0.425	S	S	*	.	H	α-helix	trans	-68.6	-35.2	176	-69.8	171.4	0	0	0	112.3	A39 A40 Q41	A39-L43 WeakPolarHBondContact O-CG 3.31Å; A39-L43 PolarHBondContact O-N 3.46Å; A40-L43 PolarHBondContact O-N 2.91Å; Q41-L43 VanDerWaalsContact C-N 3.34Å; Q41-L43 PolarHBondContact O-N 3.44Å
44	Q	74.7	Confident	78.8	Confident	54 Å²	54	68.3 Å²	68.3	25%	0.252	42%	0.415	S	S	.	.	H	α-helix	trans	-76.6	-32.5	179.1	-82.3	-168.9	-154	0	0	113.8	A40 Q41 Y83 P109 P110	A40-Q44 WeakPolarHBondContact O-CB 3.03Å; A40-Q44 PolarHBondContact O-N 2.92Å; Q41-Q44 PolarHBondContact O-N 2.97Å; Q44-Y83 HydrophobicContact CB-CD1 4.18Å; Q44-Y83 HydrophobicContact CB-CE1 3.86Å; Q44-Y83 HydrophobicContact CG-CD1 3.75Å; Q44-Y83 HydrophobicContact CG-CE1 3.96Å; Q44-Y83 VanDerWaalsContact OE1-CB 3.31Å; Q44-P109 HydrophobicContact CB-CB 4.28Å; Q44-P110 WeakPolarHBondContact O-CD 3.33Å
45	Y	74.2	Confident	79.3	Confident	15 Å²	15	63.1 Å²	63.1	6%	0.059	39%	0.391	C	S	.	.	H	α-helix	trans	-110.7	-3.1	-178.4	-62.1	-73.9	0	0	0	114.1	Q41 G47 A48 V52 Y83 T107 P109 M181	Q41-Y45 VanDerWaalsContact O-CD2 3.26Å; Q41-Y45 WeakPolarHBondContact O-CD2 3.3Å; Q41-Y45 PolarHBondContact O-N 3Å; Y45-G47 PolarHBondContact O-N 3.02Å; Y45-A48 WeakPolarHBondContact O-CB 3.4Å; Y45-A48 PolarHBondContact O-N 3.11Å; Y45-V52 HydrophobicContact CD1-CG1 3.86Å; Y45-V52 HydrophobicContact CE1-CG1 4.01Å; Y45-Y83 HydrophobicContact CE2-CE1 4.19Å; Y45-Y83 WeakPolarHBondContact CE2-OH 3.37Å; Y45-T107 HydrophobicContact CE1-CG2 3.71Å; Y45-T107 VanDerWaalsContact OH-CB 3.27Å; Y45-T107 WeakPolarHBondContact OH-CB 3.37Å; Y45-T107 WeakPolarHBondContact OH-CG2 3.48Å; Y45-T107 PolarHBondContact OH-O 3.27Å; Y45-P109 HydrophobicContact CE1-CB 4.21Å; Y45-M181 HydrophobicContact CG-SD 4.28Å
46	G	61.7	Low	79.9	Confident	65 Å²	65	59.6 Å²	59.6	67%	0.67	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-5.3	-169.5	0	0	0	0	0	116.3	Q42	Q42-G46 WeakPolarHBondContact O-CA 3.47Å; Q42-G46 PolarHBondContact O-N 3.3Å
47	G	61.7	Low	80.5	Confident	69 Å²	69	55.4 Å²	55.4	71%	0.711	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.5	0.9	169.3	0	0	0	0	0	114.3	Y45 V49	Y45-G47 PolarHBondContact O-N 3.02Å; G47-V49 VanDerWaalsContact C-N 3.33Å; G47-V49 PolarHBondContact O-N 3.24Å
48	A	59	Low	81.1	Confident	25 Å²	25	55 Å²	55	21%	0.207	34%	0.343	C	S	.	.			trans	-77.7	81.9	-175.1	0	0	0	0	0	110.7	Y45 V52 P110	Y45-A48 WeakPolarHBondContact O-CB 3.4Å; Y45-A48 PolarHBondContact O-N 3.11Å; A48-V52 HydrophobicContact CB-CG1 4.41Å; A48-P110 HydrophobicContact CB-CG 3.93Å
49	V	61.2	Low	81.8	Confident	148 Å²	148	50.8 Å²	50.8	90%	0.897	32%	0.323	S	S	*	.			trans	-84.3	115.9	168.6	-170.5	0	0	0	0	108.1	G47	G47-V49 VanDerWaalsContact C-N 3.33Å; G47-V49 PolarHBondContact O-N 3.24Å
50	G	75.9	Confident	82.5	Confident	48 Å²	48	49.5 Å²	49.5	50%	0.495	31%	0.311	S	S	.	.	S	Bend	trans	121.2	-96.7	174.2	0	0	0	0	0	113.2	A177	G50-A177 WeakPolarHBondContact O-CB 3.13Å; G50-A177 PolarHBondContact O-N 2.73Å
51	T	80.2	Confident	83.2	Confident	81 Å²	81	49.7 Å²	49.7	50%	0.497	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	153.2	-172.6	56.9	0	0	0	0	112.6	L175	T51-L175 CarbonylContact C-O 3.45Å; T51-L175 WeakPolarHBondContact CA-O 3.46Å; T51-L175 WeakPolarHBondContact CB-O 3.17Å
52	V	86.2	Confident	84	Confident	5 Å²	5	46.5 Å²	46.5	3%	0.03	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	143	172.4	-69.6	0	0	0	0	109.1	Y45 A48 T107 L175 A177 V180	Y45-V52 HydrophobicContact CD1-CG1 3.86Å; Y45-V52 HydrophobicContact CE1-CG1 4.01Å; A48-V52 HydrophobicContact CB-CG1 4.41Å; V52-T107 HydrophobicContact CB-CG2 4.02Å; V52-T107 HydrophobicContact CG2-CG2 4.17Å; V52-L175 HydrophobicContact CG2-CB 4.14Å; V52-L175 PolarHBondContact N-O 3.41Å; V52-L175 PolarHBondContact O-N 2.96Å; V52-A177 HydrophobicContact CG1-CB 3.95Å; V52-V180 HydrophobicContact CG2-CB 4.09Å; V52-V180 HydrophobicContact CG2-CG2 3.51Å
53	G	91.3	Very high	85	Confident	4 Å²	4	46.4 Å²	46.4	4%	0.041	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	142.3	175.1	0	0	0	0	0	111.3	T107 V108 Y172 A173	G53-T107 CarbonylContact O-C 3.47Å; G53-T107 WeakPolarHBondContact O-CA 3.31Å; G53-T107 WeakPolarHBondContact O-CG2 3.34Å; G53-V108 PolarHBondContact O-N 3.34Å; G53-Y172 VanDerWaalsContact CA-CZ 3.5Å; G53-Y172 WeakPolarHBondContact CA-OH 3.27Å; G53-A173 CarbonylContact C-O 3.53Å
54	R	94.3	Very high	85.8	Confident	91 Å²	91	39.6 Å²	39.6	34%	0.343	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	115.9	164.1	-177.2	178	64.5	-170.8	6.2	108.8	C106 Y172 A173 L175	R54-C106 CarbonylContact C-O 3.46Å; R54-C106 VanDerWaalsContact CA-O 3.31Å; R54-C106 WeakPolarHBondContact CA-O 3.37Å; R54-Y172 CarbonylContact O-C 3.5Å; R54-Y172 WeakPolarHBondContact O-CA 3.41Å; R54-A173 PolarHBondContact N-O 2.89Å; R54-A173 PolarHBondContact O-N 2.85Å; R54-L175 HydrophobicContact CB-CD1 3.84Å; R54-L175 HydrophobicContact CB-CG 4.07Å; R54-L175 HydrophobicContact CG-CD1 4.33Å
55	L	96.6	Very high	86.9	Confident	0 Å²	0	39 Å²	39	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	117.6	172.5	-178.6	65.3	0	0	0	108.5	I57 C106 V108 F115 I138 L142 M170 Y172	L55-I57 HydrophobicContact CD1-CG1 4.49Å; L55-I57 HydrophobicContact CD2-CD1 3.66Å; L55-I57 HydrophobicContact CD2-CG1 3.93Å; L55-I57 HydrophobicContact CG-CD1 4Å; L55-I57 HydrophobicContact CG-CG1 3.69Å; L55-C106 HydrophobicContact CB-CB 4.44Å; L55-C106 PolarHBondContact N-O 2.95Å; L55-C106 WeakPolarHBondContact O-CB 3.41Å; L55-C106 PolarHBondContact O-N 3.11Å; L55-V108 HydrophobicContact CB-CG2 3.49Å; L55-V108 VanDerWaalsContact CB-CG2 3.49Å; L55-F115 HydrophobicContact CD2-CD1 4.14Å; L55-F115 HydrophobicContact CD2-CE1 4.15Å; L55-I138 HydrophobicContact CD2-CD1 3.94Å; L55-I138 HydrophobicContact CD2-CG1 4.03Å; L55-L142 HydrophobicContact CD1-CD1 3.8Å; L55-M170 HydrophobicContact CD1-CB 4.38Å; L55-Y172 HydrophobicContact CB-CD2 4.2Å; L55-Y172 HydrophobicContact CD1-CD2 4.3Å
56	N	97.4	Very high	87.9	Confident	24 Å²	24	42.6 Å²	42.6	13%	0.128	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	124.2	170.3	-50.6	-57.2	0	0	0	108	H105 M170 S171	N56-H105 PolarHBondContact OD1-ND1 3.12Å; N56-M170 VanDerWaalsContact O-CA 3.3Å; N56-M170 WeakPolarHBondContact O-CA 3.34Å; N56-S171 PolarHBondContact N-O 3.06Å; N56-S171 PolarHBondContact ND2-OG 2.85Å; N56-S171 VanDerWaalsContact ND2-OG 3.1Å; N56-S171 PolarHBondContact O-N 3.16Å
57	I	98.2	Very high	89.4	Confident	0 Å²	0	42 Å²	42	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	111.1	-179.6	-52.3	177.4	0	0	0	107.9	L55 V59 L79 I104 F115 L168 M170	L55-I57 HydrophobicContact CD1-CG1 4.49Å; L55-I57 HydrophobicContact CD2-CD1 3.66Å; L55-I57 HydrophobicContact CD2-CG1 3.93Å; L55-I57 HydrophobicContact CG-CD1 4Å; L55-I57 HydrophobicContact CG-CG1 3.69Å; I57-V59 HydrophobicContact CG2-CG2 4.28Å; I57-L79 HydrophobicContact CD1-CD1 3.41Å; I57-L79 VanDerWaalsContact CD1-CD1 3.41Å; I57-L79 HydrophobicContact CD1-CD2 4.16Å; I57-L79 HydrophobicContact CD1-CG 4.43Å; I57-L79 HydrophobicContact CG2-CD1 4.35Å; I57-I104 PolarHBondContact N-O 3.13Å; I57-I104 PolarHBondContact O-N 3.46Å; I57-F115 HydrophobicContact CD1-CD1 4.3Å; I57-F115 HydrophobicContact CD1-CE1 4Å; I57-F115 HydrophobicContact CD1-CE2 4.23Å; I57-F115 HydrophobicContact CD1-CZ 3.95Å; I57-L168 HydrophobicContact CG2-CD2 4.29Å; I57-M170 HydrophobicContact CB-CG 4.49Å; I57-M170 HydrophobicContact CG1-CG 4.25Å; I57-M170 HydrophobicContact CG1-SD 4.44Å; I57-M170 HydrophobicContact CG2-CG 4.17Å
58	T	98.6	Very high	90.7	Very high	36 Å²	36	40.5 Å²	40.5	22%	0.221	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	110	167.5	-51.6	0	0	0	0	108.4	V60 K102 V103 L168 V169	T58-V60 HydrophobicContact CG2-CG2 3.99Å; T58-V60 PolarHBondContact O-N 3.43Å; T58-K102 CarbonylContact C-O 3.57Å; T58-K102 WeakPolarHBondContact CA-O 3.36Å; T58-V103 HydrophobicContact CG2-CG2 4.29Å; T58-L168 WeakPolarHBondContact O-CA 3.29Å; T58-V169 PolarHBondContact N-O 3.26Å; T58-V169 PolarHBondContact O-N 2.98Å
59	V	98.7	Very high	91.6	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.006	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	100.5	170.3	-173.4	0	0	0	0	107.4	I57 C77 T88 W100 N101 K102 I104 I166 L168	I57-V59 HydrophobicContact CG2-CG2 4.28Å; V59-C77 HydrophobicContact CG1-CB 4.17Å; V59-T88 HydrophobicContact CB-CG2 3.9Å; V59-T88 HydrophobicContact CG1-CG2 4.04Å; V59-T88 HydrophobicContact CG2-CG2 4.03Å; V59-W100 HydrophobicContact CG1-CD2 4.27Å; V59-W100 HydrophobicContact CG1-CE3 3.71Å; V59-W100 HydrophobicContact CG1-CZ3 4.21Å; V59-N101 WeakPolarHBondContact O-CA 3.32Å; V59-N101 PolarHBondContact O-N 3.45Å; V59-K102 PolarHBondContact N-O 3.19Å; V59-K102 PolarHBondContact O-N 3.01Å; V59-K102 VanDerWaalsContact O-N 3.12Å; V59-I104 HydrophobicContact CG2-CD1 4.01Å; V59-I166 HydrophobicContact CG1-CD1 4.11Å; V59-L168 HydrophobicContact CB-CD2 4.32Å; V59-L168 HydrophobicContact CG1-CD2 4.24Å; V59-L168 HydrophobicContact CG2-CD2 4.12Å
60	V	98.7	Very high	92.6	Very high	19 Å²	19	42.9 Å²	42.9	12%	0.115	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	-68.1	-170.8	-174.8	0	0	0	0	110.3	T58 W100 N101 N167 V169	T58-V60 HydrophobicContact CG2-CG2 3.99Å; T58-V60 PolarHBondContact O-N 3.43Å; V60-W100 PolarHBondContact O-N 3.47Å; V60-N101 PolarHBondContact O-N 3.22Å; V60-N167 HydrophobicContact CB-CB 4.29Å; V60-N167 WeakPolarHBondContact CB-OD1 3.45Å; V60-N167 WeakPolarHBondContact CG1-OD1 3.38Å; V60-N167 PolarHBondContact N-O 3.22Å; V60-N167 VanDerWaalsContact N-O 3.12Å; V60-V169 HydrophobicContact CG2-CG2 3.83Å
61	Q	98.6	Very high	93.2	Very high	33 Å²	33	45.8 Å²	45.8	15%	0.154	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.1	163.4	-171.5	62	-176.5	-33.1	0	0	110.8	P98 R99 W151 N167	Q61-P98 CarbonylContact C-O 3.56Å; Q61-P98 VanDerWaalsContact CA-O 3.22Å; Q61-P98 WeakPolarHBondContact CA-O 3.16Å; Q61-P98 WeakPolarHBondContact CB-O 3.25Å; Q61-R99 HydrophobicContact CB-CB 4.49Å; Q61-R99 HydrophobicContact CB-CG 3.91Å; Q61-R99 VanDerWaalsContact OE1-NH1 3.14Å; Q61-R99 VanDerWaalsContact OE1-NH2 3.17Å; Q61-W151 HydrophobicContact CG-CH2 3.65Å; Q61-W151 HydrophobicContact CG-CZ2 4.15Å; Q61-W151 HydrophobicContact CG-CZ3 4.43Å; Q61-N167 HydrophobicContact CG-CB 3.92Å; Q61-N167 PolarHBondContact O-N 3.21Å
62	A	98.7	Very high	93.8	Very high	1 Å²	1	49 Å²	49	1%	0.008	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	158.7	168.8	0	0	0	0	0	111.4	L64 N97 P98 W100 I119 M165 I166	A62-L64 HydrophobicContact CB-CD2 4.37Å; A62-N97 WeakPolarHBondContact O-CA 3.35Å; A62-P98 HydrophobicContact CB-CG 4Å; A62-P98 PolarHBondContact N-O 2.94Å; A62-P98 WeakPolarHBondContact O-CD 3.16Å; A62-W100 HydrophobicContact CB-CH2 3.91Å; A62-W100 HydrophobicContact CB-CZ3 3.82Å; A62-I119 HydrophobicContact CB-CD1 4.12Å; A62-M165 CarbonylContact C-O 3.49Å; A62-M165 WeakPolarHBondContact CA-O 3.13Å; A62-I166 HydrophobicContact CB-CB 4.36Å; A62-I166 HydrophobicContact CB-CG1 4.28Å
63	K	98.5	Very high	94.2	Very high	105 Å²	105	48.8 Å²	48.8	46%	0.457	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	98	168.6	-69.9	179.9	179.4	176.2	0	107.4	K96 W151 G164 M165	K63-K96 CarbonylContact C-O 3.27Å; K63-K96 WeakPolarHBondContact CA-O 3.45Å; K63-W151 HydrophobicContact CB-CZ3 4.39Å; K63-W151 HydrophobicContact CD-CH2 4Å; K63-W151 HydrophobicContact CD-CZ3 4.3Å; K63-W151 HydrophobicContact CG-CH2 3.93Å; K63-W151 HydrophobicContact CG-CZ3 4.06Å; K63-G164 CarbonylContact O-C 3.6Å; K63-G164 WeakPolarHBondContact O-CA 3.4Å; K63-M165 PolarHBondContact N-O 2.97Å; K63-M165 PolarHBondContact O-N 2.97Å
64	L	98.1	Very high	94.5	Very high	8 Å²	8	51 Å²	51	4%	0.042	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	148.6	-177.7	-56.7	174.8	0	0	0	111.1	A62 M73 K96 I119 I131 A132 L154 E163	A62-L64 HydrophobicContact CB-CD2 4.37Å; L64-M73 HydrophobicContact CD1-CE 3.69Å; L64-K96 PolarHBondContact N-O 3.04Å; L64-K96 WeakPolarHBondContact O-CE 3.44Å; L64-I119 HydrophobicContact CD2-CD1 4.02Å; L64-I131 HydrophobicContact CD1-CD1 3.59Å; L64-A132 HydrophobicContact CD2-CB 4.15Å; L64-L154 HydrophobicContact CD2-CD1 3.76Å; L64-E163 CarbonylContact C-O 3.59Å; L64-E163 WeakPolarHBondContact CA-O 3.48Å
65	A	97.1	Very high	94.7	Very high	42 Å²	42	46.6 Å²	46.6	35%	0.347	24%	0.237	S	C	.	.	S	Bend	trans	-73.9	-34.9	179.8	0	0	0	0	0	112.6	K96 K162 E163	A65-K96 WeakPolarHBondContact O-CE 3.47Å; A65-K96 PolarHBondContact O-NZ 3.33Å; A65-K162 WeakPolarHBondContact CB-O 3.44Å; A65-E163 PolarHBondContact N-O 2.75Å
66	K	94.5	Very high	94.8	Very high	89 Å²	89	47.3 Å²	47.3	39%	0.387	24%	0.24	S	C	.	.			trans	-135.2	150.9	-171.8	-170.4	167.5	177.6	178.2	0	112.1	Y68 M73	K66-Y68 HydrophobicContact CB-CE2 4.21Å; K66-Y68 HydrophobicContact CD-CD1 4.32Å; K66-Y68 HydrophobicContact CD-CE1 3.83Å; K66-Y68 HydrophobicContact CG-CE1 4.33Å; K66-M73 WeakPolarHBondContact O-CE 3.45Å
67	N	93.2	Very high	94.8	Very high	52 Å²	52	46.2 Å²	46.2	28%	0.278	23%	0.234	S	C	.	.			trans	-97.5	117.8	164.6	-169.7	75.2	0	0	0	107.6	G69 T71 M73 K96	N67-G69 PolarHBondContact ND2-O 3.34Å; N67-T71 PolarHBondContact ND2-O 3Å; N67-M73 WeakPolarHBondContact OD1-CG 3.39Å; N67-M73 PolarHBondContact OD1-N 3.04Å; N67-K96 HydrophobicContact CB-CG 4.26Å
68	Y	88.9	Confident	94.9	Very high	39 Å²	39	49.7 Å²	49.7	15%	0.153	25%	0.248	C	C	.	.			trans	-89.1	-18.6	-177.7	-70.9	-75.9	0	0	0	113.7	K66 M73 I131 R157 Q158 E163	K66-Y68 HydrophobicContact CB-CE2 4.21Å; K66-Y68 HydrophobicContact CD-CD1 4.32Å; K66-Y68 HydrophobicContact CD-CE1 3.83Å; K66-Y68 HydrophobicContact CG-CE1 4.33Å; Y68-M73 HydrophobicContact CD2-SD 4.01Å; Y68-M73 HydrophobicContact CG-SD 4.41Å; Y68-M73 PolarHBondContact N-SD 3.09Å; Y68-I131 HydrophobicContact CD2-CB 3.73Å; Y68-I131 HydrophobicContact CD2-CG2 3.59Å; Y68-I131 HydrophobicContact CE2-CB 4.02Å; Y68-I131 HydrophobicContact CE2-CG2 4.34Å; Y68-I131 HydrophobicContact CG-CG2 4.17Å; Y68-R157 HydrophobicContact CE1-CB 4.16Å; Y68-R157 HydrophobicContact CE1-CG 4.5Å; Y68-Q158 WeakPolarHBondContact OH-CG 3.26Å; Y68-E163 WeakPolarHBondContact CE2-OE1 3.25Å; Y68-E163 VanDerWaalsContact CZ-OE1 3.25Å; Y68-E163 PolarHBondContact OH-OE1 3.36Å; Y68-E163 PolarHBondContact OH-OE2 3.27Å
69	G	78.6	Confident	94.8	Very high	18 Å²	18	48.1 Å²	48.1	19%	0.186	24%	0.237	C	C	.	.	S	Bend	trans	-78.8	156.7	175.7	0	0	0	0	0	113.4	N67 T71	N67-G69 PolarHBondContact ND2-O 3.34Å; G69-T71 VanDerWaalsContact C-N 3.28Å; G69-T71 CarbonylContact C-O 3.38Å; G69-T71 VanDerWaalsContact C-O 3.27Å; G69-T71 WeakPolarHBondContact CA-O 3.35Å
70	M	82.1	Confident	94.8	Very high	205 Å²	205	54.7 Å²	54.7	100%	1.01	26%	0.262	S	S	*	.	S	Bend	trans	-65.2	-38.5	163.5	-169.8	85.4	161.3	0	0	110.1
71	T	88.1	Confident	94.6	Very high	108 Å²	108	53.9 Å²	53.9	66%	0.663	26%	0.257	S	S	*	.	S	Bend	trans	-96.7	177.1	168.4	54.5	0	0	0	0	110.2	N67 G69 M73	N67-T71 PolarHBondContact ND2-O 3Å; G69-T71 VanDerWaalsContact C-N 3.28Å; G69-T71 CarbonylContact C-O 3.38Å; G69-T71 VanDerWaalsContact C-O 3.27Å; G69-T71 WeakPolarHBondContact CA-O 3.35Å; T71-M73 PolarHBondContact O-N 2.87Å
72	R	93.8	Very high	94.3	Very high	148 Å²	148	53.9 Å²	53.9	56%	0.558	27%	0.266	S	S	*	.			trans	-57.5	137.2	166.7	-75.9	-172.5	149.8	-163.2	-2.7	109.7	N93 A95	R72-N93 WeakPolarHBondContact CB-OD1 3.19Å; R72-N93 WeakPolarHBondContact CD-OD1 3.09Å; R72-N93 WeakPolarHBondContact CG-OD1 3.27Å; R72-N93 PolarHBondContact NH1-ND2 3.45Å; R72-N93 PolarHBondContact NH1-O 2.84Å; R72-A95 HydrophobicContact CB-CB 3.87Å; R72-A95 HydrophobicContact CG-CB 3.73Å
73	M	95.3	Very high	93.7	Very high	1 Å²	1	57.2 Å²	57.2	1%	0.005	28%	0.279	C	S	.	.			trans	-71.3	155.3	175.7	-65.9	178.9	-48	0	0	111.7	L64 K66 N67 Y68 T71 P75 G94 A95 D121 I131	L64-M73 HydrophobicContact CD1-CE 3.69Å; K66-M73 WeakPolarHBondContact O-CE 3.45Å; N67-M73 WeakPolarHBondContact OD1-CG 3.39Å; N67-M73 PolarHBondContact OD1-N 3.04Å; Y68-M73 HydrophobicContact CD2-SD 4.01Å; Y68-M73 HydrophobicContact CG-SD 4.41Å; Y68-M73 PolarHBondContact N-SD 3.09Å; T71-M73 PolarHBondContact O-N 2.87Å; M73-P75 WeakPolarHBondContact O-CD 3.43Å; M73-G94 PolarHBondContact O-N 2.97Å; M73-A95 WeakPolarHBondContact CE-O 3.15Å; M73-A95 PolarHBondContact O-N 2.76Å; M73-D121 WeakPolarHBondContact CA-OD1 3.49Å; M73-D121 HydrophobicContact CB-CB 4.43Å; M73-D121 WeakPolarHBondContact CB-OD1 3.48Å; M73-D121 HydrophobicContact CG-CB 4.4Å; M73-D121 HydrophobicContact SD-CB 4.49Å; M73-I131 HydrophobicContact CE-CD1 3.86Å; M73-I131 HydrophobicContact SD-CD1 3.89Å; M73-I131 HydrophobicContact SD-CG2 4.1Å
74	D	96.8	Very high	93.4	Very high	50 Å²	50	53 Å²	53	27%	0.267	26%	0.263	S	S	.	.			trans	-115.3	75.8	176.4	-68.9	-29.2	0	0	0	109.3	T90 H92 N93 D121 E122	D74-T90 HydrophobicContact CB-CG2 3.68Å; D74-T90 VanDerWaalsContact O-CG2 3.25Å; D74-T90 WeakPolarHBondContact O-CG2 3.37Å; D74-H92 WeakPolarHBondContact OD1-CA 3.42Å; D74-N93 PolarHBondContact OD1-N 2.92Å; D74-D121 PolarHBondContact N-OD1 3.04Å; D74-E122 HydrophobicContact CB-CB 4.29Å; D74-E122 WeakPolarHBondContact O-CB 3.46Å; D74-E122 PolarHBondContact O-N 3.34Å
75	P	98.1	Very high	93.3	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	145.8	-168.2	33	-39.8	0	0	0	114.5	M73 A91 P98 W100 I119 F120 I131	M73-P75 WeakPolarHBondContact O-CD 3.43Å; P75-A91 WeakPolarHBondContact CD-O 3.31Å; P75-A91 HydrophobicContact CG-CB 4.41Å; P75-A91 WeakPolarHBondContact O-CB 3.27Å; P75-A91 PolarHBondContact O-N 2.66Å; P75-P98 HydrophobicContact CB-CB 4.4Å; P75-P98 HydrophobicContact CB-CG 4.32Å; P75-P98 HydrophobicContact CG-CB 3.31Å; P75-P98 HydrophobicContact CG-CG 3.55Å; P75-W100 HydrophobicContact CB-CZ2 4.13Å; P75-W100 HydrophobicContact CG-CZ2 4.24Å; P75-W100 PolarHBondContact O-NE1 3.16Å; P75-I119 HydrophobicContact CB-CG2 3.93Å; P75-F120 CarbonylContact C-O 3.55Å; P75-F120 WeakPolarHBondContact CA-O 3.41Å; P75-I131 HydrophobicContact CB-CD1 4.1Å
76	Y	98.6	Very high	93.3	Very high	14 Å²	14	57.3 Å²	57.3	6%	0.055	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	157	168.6	71.7	-87.9	0	0	0	111	R78 I119 F120 E122 D128	Y76-R78 PolarHBondContact OH-NH2 3.03Å; Y76-I119 CarbonylContact O-C 3.53Å; Y76-I119 WeakPolarHBondContact O-CA 3.39Å; Y76-F120 HydrophobicContact CD1-CB 3.96Å; Y76-F120 HydrophobicContact CE1-CB 3.44Å; Y76-F120 VanDerWaalsContact CE1-CB 3.44Å; Y76-F120 HydrophobicContact CE1-CG 4.37Å; Y76-F120 HydrophobicContact CE2-CB 4.03Å; Y76-F120 HydrophobicContact CE2-CD2 4.13Å; Y76-F120 HydrophobicContact CE2-CG 4.32Å; Y76-F120 HydrophobicContact CG-CB 4.47Å; Y76-F120 VanDerWaalsContact CZ-CB 3.49Å; Y76-F120 AromaticContact CZ-CG 3.94Å; Y76-F120 PolarHBondContact N-O 3.46Å; Y76-F120 PolarHBondContact O-N 2.97Å; Y76-E122 HydrophobicContact CD1-CB 4.16Å; Y76-E122 HydrophobicContact CE1-CB 4.2Å; Y76-D128 HydrophobicContact CE1-CB 4.38Å; Y76-D128 VanDerWaalsContact CE1-OD2 3.29Å; Y76-D128 WeakPolarHBondContact CE1-OD2 3.49Å; Y76-D128 PolarHBondContact OH-OD2 3.25Å
77	C	98.7	Very high	93.5	Very high	1 Å²	1	57.5 Å²	57.5	1%	0.007	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	138.4	178.3	-66.1	0	0	0	0	110.8	V59 E87 T88 W100 E118	V59-C77 HydrophobicContact CG1-CB 4.17Å; C77-E87 CarbonylContact O-C 3.58Å; C77-E87 VanDerWaalsContact O-CA 3.26Å; C77-E87 WeakPolarHBondContact O-CA 3.4Å; C77-T88 HydrophobicContact CB-CG2 3.9Å; C77-T88 PolarHBondContact N-OG1 2.87Å; C77-T88 PolarHBondContact O-N 3.08Å; C77-W100 WeakPolarHBondContact SG-CH2 3.47Å; C77-E118 CarbonylContact C-O 3.59Å; C77-E118 VanDerWaalsContact CA-O 3.24Å; C77-E118 WeakPolarHBondContact CA-O 3.42Å
78	R	98.6	Very high	93.7	Very high	74 Å²	74	55.4 Å²	55.4	28%	0.279	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	123.9	168	-179.2	-179.8	-70	157.5	5.1	109.2	Y76 V85 Y86 E87 L117 E118 F120	Y76-R78 PolarHBondContact OH-NH2 3.03Å; R78-V85 HydrophobicContact CG-CG1 3.57Å; R78-Y86 CarbonylContact C-O 3.59Å; R78-Y86 WeakPolarHBondContact CA-O 3.45Å; R78-E87 HydrophobicContact CB-CG 4.18Å; R78-E87 HydrophobicContact CG-CG 4.12Å; R78-E87 IonicContact CZ-OE1 3.15Å; R78-E87 IonicContact NE-OE1 2.72Å; R78-E87 PolarHBondContact NE-OE1 3.24Å; R78-E87 IonicContact NH2-OE1 2.73Å; R78-E87 PolarHBondContact NH2-OE1 3.13Å; R78-L117 WeakPolarHBondContact O-CA 3.42Å; R78-E118 PolarHBondContact N-O 2.95Å; R78-E118 PolarHBondContact O-N 3.39Å; R78-F120 HydrophobicContact CB-CD2 4.19Å; R78-F120 HydrophobicContact CB-CE2 3.99Å
79	L	98.2	Very high	94.2	Very high	2 Å²	2	57.5 Å²	57.5	1%	0.01	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	126.9	-179.7	-175.4	136.9	0	0	0	110.3	I57 L81 V85 Y86 F115 Y116 L117	I57-L79 HydrophobicContact CD1-CD1 3.41Å; I57-L79 VanDerWaalsContact CD1-CD1 3.41Å; I57-L79 HydrophobicContact CD1-CD2 4.16Å; I57-L79 HydrophobicContact CD1-CG 4.43Å; I57-L79 HydrophobicContact CG2-CD1 4.35Å; L79-L81 HydrophobicContact CD2-CB 4.15Å; L79-V85 CarbonylContact O-C 3.57Å; L79-V85 WeakPolarHBondContact O-CA 3.31Å; L79-Y86 HydrophobicContact CD2-CD2 3.86Å; L79-Y86 PolarHBondContact N-O 2.91Å; L79-Y86 PolarHBondContact O-N 3.48Å; L79-F115 HydrophobicContact CD1-CD2 3.41Å; L79-F115 VanDerWaalsContact CD1-CD2 3.41Å; L79-F115 HydrophobicContact CD1-CE2 3.5Å; L79-F115 VanDerWaalsContact CD1-CE2 3.5Å; L79-F115 HydrophobicContact CD1-CG 4.22Å; L79-F115 HydrophobicContact CD1-CZ 4.37Å; L79-F115 HydrophobicContact CG-CD2 3.83Å; L79-F115 HydrophobicContact CG-CE2 4.4Å; L79-F115 HydrophobicContact CG-CG 4.46Å; L79-Y116 CarbonylContact C-O 3.54Å; L79-Y116 WeakPolarHBondContact CA-O 3.39Å; L79-L117 HydrophobicContact CD1-CD1 4.44Å
80	R	97.6	Very high	95.1	Very high	140 Å²	140	58 Å²	58	53%	0.528	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	118.9	175.7	-172.8	177.4	68.8	-166.4	1.1	110.6	A84 V85 F115 Y116	R80-A84 WeakPolarHBondContact CA-O 3.41Å; R80-V85 HydrophobicContact CG-CG2 4.27Å; R80-F115 WeakPolarHBondContact O-CA 3.19Å; R80-F115 WeakPolarHBondContact O-CB 3.36Å; R80-Y116 PolarHBondContact N-O 2.91Å; R80-Y116 PolarHBondContact O-N 2.96Å
81	L	95.3	Very high	95.8	Very high	1 Å²	1	48.9 Å²	48.9	1%	0.005	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	111	176.8	178.9	79.7	0	0	0	109	L79 Y83 A84 C106 T107 V108 V112 S114 F115 I138	L79-L81 HydrophobicContact CD2-CB 4.15Å; L81-Y83 PolarHBondContact O-N 3.21Å; L81-A84 PolarHBondContact N-O 3.43Å; L81-A84 PolarHBondContact O-N 3.19Å; L81-C106 HydrophobicContact CD2-CB 3.47Å; L81-C106 VanDerWaalsContact CD2-CB 3.47Å; L81-T107 WeakPolarHBondContact CD2-O 3.3Å; L81-V108 HydrophobicContact CD2-CG2 4.07Å; L81-V112 HydrophobicContact CD1-CG1 3.54Å; L81-V112 HydrophobicContact CG-CG1 4.2Å; L81-S114 WeakPolarHBondContact CD1-O 3.33Å; L81-F115 HydrophobicContact CB-CB 4.15Å; L81-F115 HydrophobicContact CD1-CB 3.78Å; L81-I138 HydrophobicContact CD1-CD1 4.23Å
82	G	90.7	Very high	96.2	Very high	33 Å²	33	50.4 Å²	50.4	34%	0.34	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.2	-134.9	-166.7	0	0	0	0	0	111	A84	G82-A84 VanDerWaalsContact C-N 3.3Å
83	Y	87.2	Confident	96.2	Very high	72 Å²	72	47.6 Å²	47.6	28%	0.282	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-17.1	171.2	68.6	-112.9	0	0	0	114	A40 Q41 Q44 Y45 L81	A40-Y83 HydrophobicContact CB-CD1 4Å; A40-Y83 HydrophobicContact CB-CG 4.25Å; Q41-Y83 VanDerWaalsContact CA-CE1 3.47Å; Q41-Y83 HydrophobicContact CB-CE1 4.1Å; Q41-Y83 WeakPolarHBondContact CB-OH 3.26Å; Q41-Y83 VanDerWaalsContact CD-OH 3.25Å; Q41-Y83 HydrophobicContact CG-CE1 4.03Å; Q41-Y83 HydrophobicContact CG-CE2 3.87Å; Q41-Y83 VanDerWaalsContact CG-CZ 3.47Å; Q41-Y83 WeakPolarHBondContact CG-OH 3.34Å; Q41-Y83 PolarHBondContact NE2-OH 3.43Å; Q44-Y83 HydrophobicContact CB-CD1 4.18Å; Q44-Y83 HydrophobicContact CB-CE1 3.86Å; Q44-Y83 HydrophobicContact CG-CD1 3.75Å; Q44-Y83 HydrophobicContact CG-CE1 3.96Å; Q44-Y83 VanDerWaalsContact OE1-CB 3.31Å; Y45-Y83 HydrophobicContact CE2-CE1 4.19Å; Y45-Y83 WeakPolarHBondContact CE2-OH 3.37Å; L81-Y83 PolarHBondContact O-N 3.21Å
84	A	91.8	Very high	96.3	Very high	15 Å²	15	48.3 Å²	48.3	12%	0.124	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	136.3	-169.2	0	0	0	0	0	110.8	R80 L81 G82 Y86	R80-A84 WeakPolarHBondContact CA-O 3.41Å; L81-A84 PolarHBondContact N-O 3.43Å; L81-A84 PolarHBondContact O-N 3.19Å; G82-A84 VanDerWaalsContact C-N 3.3Å; A84-Y86 HydrophobicContact CB-CD2 4.47Å; A84-Y86 HydrophobicContact CB-CE2 3.58Å
85	V	96.1	Very high	96.2	Very high	79 Å²	79	46.4 Å²	46.4	48%	0.479	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	132.9	175.3	-179.3	0	0	0	0	108.7	R78 L79 R80	R78-V85 HydrophobicContact CG-CG1 3.57Å; L79-V85 CarbonylContact O-C 3.57Å; L79-V85 WeakPolarHBondContact O-CA 3.31Å; R80-V85 HydrophobicContact CG-CG2 4.27Å
86	Y	97.6	Very high	96.2	Very high	62 Å²	62	50.5 Å²	50.5	24%	0.243	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	147.7	178.2	-55.5	-90.1	0	0	0	109.6	R78 L79 A84 I104 C106	R78-Y86 CarbonylContact C-O 3.59Å; R78-Y86 WeakPolarHBondContact CA-O 3.45Å; L79-Y86 HydrophobicContact CD2-CD2 3.86Å; L79-Y86 PolarHBondContact N-O 2.91Å; L79-Y86 PolarHBondContact O-N 3.48Å; A84-Y86 HydrophobicContact CB-CD2 4.47Å; A84-Y86 HydrophobicContact CB-CE2 3.58Å; Y86-I104 VanDerWaalsContact CB-CG2 3.44Å; Y86-I104 HydrophobicContact CD1-CG2 3.57Å; Y86-I104 HydrophobicContact CD2-CG2 4.1Å; Y86-I104 HydrophobicContact CE1-CG2 4.32Å; Y86-I104 HydrophobicContact CG-CG2 3.44Å; Y86-I104 VanDerWaalsContact CG-CG2 3.44Å; Y86-C106 HydrophobicContact CE2-CB 4.02Å
87	E	98	Very high	96.1	Very high	93 Å²	93	54.8 Å²	54.8	44%	0.435	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	149.8	179.6	-66.7	-178.6	154	0	0	111.4	C77 R78	C77-E87 CarbonylContact O-C 3.58Å; C77-E87 VanDerWaalsContact O-CA 3.26Å; C77-E87 WeakPolarHBondContact O-CA 3.4Å; R78-E87 HydrophobicContact CB-CG 4.18Å; R78-E87 HydrophobicContact CG-CG 4.12Å; R78-E87 IonicContact CZ-OE1 3.15Å; R78-E87 IonicContact NE-OE1 2.72Å; R78-E87 PolarHBondContact NE-OE1 3.24Å; R78-E87 IonicContact NH2-OE1 2.73Å; R78-E87 PolarHBondContact NH2-OE1 3.13Å
88	T	98.6	Very high	96.1	Very high	9 Å²	9	54.8 Å²	54.8	6%	0.055	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-86.4	158.1	166	65.1	0	0	0	0	109.9	V59 C77 W100 K102 I104	V59-T88 HydrophobicContact CB-CG2 3.9Å; V59-T88 HydrophobicContact CG1-CG2 4.04Å; V59-T88 HydrophobicContact CG2-CG2 4.03Å; C77-T88 HydrophobicContact CB-CG2 3.9Å; C77-T88 PolarHBondContact N-OG1 2.87Å; C77-T88 PolarHBondContact O-N 3.08Å; T88-W100 HydrophobicContact CG2-CB 4.36Å; T88-W100 HydrophobicContact CG2-CG 4.35Å; T88-K102 HydrophobicContact CG2-CB 4.02Å; T88-K102 HydrophobicContact CG2-CG 4.22Å; T88-I104 HydrophobicContact CG2-CD1 4.24Å
89	P	98.1	Very high	96.1	Very high	82 Å²	82	58.5 Å²	58.5	53%	0.532	30%	0.296	S	S	.	.	P	Polyproline II helix	trans	-56	158.7	160.3	-20.9	33.2	0	0	0	111	W100	P89-W100 PolarHBondContact O-NE1 2.78Å
90	T	98	Very high	96.1	Very high	29 Å²	29	59.8 Å²	59.8	18%	0.178	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-73	132.1	174	-59.2	0	0	0	0	111.6	D74 H92 E122	D74-T90 HydrophobicContact CB-CG2 3.68Å; D74-T90 VanDerWaalsContact O-CG2 3.25Å; D74-T90 WeakPolarHBondContact O-CG2 3.37Å; T90-H92 PolarHBondContact O-N 3.05Å; T90-H92 VanDerWaalsContact O-N 3.17Å; T90-E122 WeakPolarHBondContact CB-OE2 3.49Å; T90-E122 HydrophobicContact CG2-CB 4.1Å; T90-E122 VanDerWaalsContact CG2-OE2 3.23Å; T90-E122 WeakPolarHBondContact CG2-OE2 3.34Å; T90-E122 PolarHBondContact OG1-OE2 3.49Å
91	A	97.8	Very high	96.1	Very high	13 Å²	13	58 Å²	58	11%	0.107	30%	0.302	C	S	.	.			trans	-84	81.9	169.9	0	0	0	0	0	109.2	P75 N93 G94 P98	P75-A91 WeakPolarHBondContact CD-O 3.31Å; P75-A91 HydrophobicContact CG-CB 4.41Å; P75-A91 WeakPolarHBondContact O-CB 3.27Å; P75-A91 PolarHBondContact O-N 2.66Å; A91-N93 PolarHBondContact O-N 2.93Å; A91-G94 WeakPolarHBondContact O-CA 3.39Å; A91-G94 PolarHBondContact O-N 3.38Å; A91-P98 HydrophobicContact CB-CB 3.7Å
92	H	96.1	Very high	96.3	Very high	140 Å²	140	62.4 Å²	62.4	65%	0.648	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	131.6	179.3	-62.3	-60.6	0	0	0	111.7	D74 T90 G94	D74-H92 WeakPolarHBondContact OD1-CA 3.42Å; T90-H92 PolarHBondContact O-N 3.05Å; T90-H92 VanDerWaalsContact O-N 3.17Å; H92-G94 PolarHBondContact O-N 3.4Å
93	N	93.7	Very high	96.6	Very high	89 Å²	89	63.7 Å²	63.7	48%	0.476	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.6	21.4	-177.7	-157.7	38.3	0	0	0	113.8	R72 D74 A91 A95	R72-N93 WeakPolarHBondContact CB-OD1 3.19Å; R72-N93 WeakPolarHBondContact CD-OD1 3.09Å; R72-N93 WeakPolarHBondContact CG-OD1 3.27Å; R72-N93 PolarHBondContact NH1-ND2 3.45Å; R72-N93 PolarHBondContact NH1-O 2.84Å; D74-N93 PolarHBondContact OD1-N 2.92Å; A91-N93 PolarHBondContact O-N 2.93Å; N93-A95 VanDerWaalsContact C-N 3.28Å; N93-A95 PolarHBondContact O-N 3.3Å
94	G	96	Very high	97.1	Very high	17 Å²	17	60.7 Å²	60.7	18%	0.175	31%	0.31	C	S	.	.			trans	-67.4	-26.1	-176.4	0	0	0	0	0	113.6	M73 A91 H92 K96 N97	M73-G94 PolarHBondContact O-N 2.97Å; A91-G94 WeakPolarHBondContact O-CA 3.39Å; A91-G94 PolarHBondContact O-N 3.38Å; H92-G94 PolarHBondContact O-N 3.4Å; G94-K96 PolarHBondContact O-N 3.49Å; G94-N97 CarbonylContact O-C 3.44Å; G94-N97 PolarHBondContact O-N 3.24Å
95	A	95.6	Very high	97.3	Very high	9 Å²	9	65.5 Å²	65.5	7%	0.074	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	49.4	-121.7	176.7	0	0	0	0	0	111.7	R72 M73 N93	R72-A95 HydrophobicContact CB-CB 3.87Å; R72-A95 HydrophobicContact CG-CB 3.73Å; M73-A95 WeakPolarHBondContact CE-O 3.15Å; M73-A95 PolarHBondContact O-N 2.76Å; N93-A95 VanDerWaalsContact C-N 3.28Å; N93-A95 PolarHBondContact O-N 3.3Å
96	K	97.5	Very high	97.2	Very high	87 Å²	87	61.8 Å²	61.8	38%	0.378	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82	-13.3	179.4	-66.8	-176.4	59	172.3	0	114.8	K63 L64 A65 N67 G94 P98	K63-K96 CarbonylContact C-O 3.27Å; K63-K96 WeakPolarHBondContact CA-O 3.45Å; L64-K96 PolarHBondContact N-O 3.04Å; L64-K96 WeakPolarHBondContact O-CE 3.44Å; A65-K96 WeakPolarHBondContact O-CE 3.47Å; A65-K96 PolarHBondContact O-NZ 3.33Å; N67-K96 HydrophobicContact CB-CG 4.26Å; G94-K96 PolarHBondContact O-N 3.49Å; K96-P98 VanDerWaalsContact C-CD 3.41Å
97	N	98	Very high	96.9	Very high	104 Å²	104	60.2 Å²	60.2	56%	0.556	30%	0.304	S	S	*	.	S	Bend	trans	-130.9	56	-173.3	-57.9	-78.1	0	0	0	112	A62 G94	A62-N97 WeakPolarHBondContact O-CA 3.35Å; G94-N97 CarbonylContact O-C 3.44Å; G94-N97 PolarHBondContact O-N 3.24Å
98	P	98.2	Very high	96.6	Very high	1 Å²	1	56 Å²	56	1%	0.006	29%	0.285	C	S	.	.			trans	-68.3	152.1	-179.6	32.3	-38.5	0	0	0	112.7	Q61 A62 P75 A91 K96 W100	Q61-P98 CarbonylContact C-O 3.56Å; Q61-P98 VanDerWaalsContact CA-O 3.22Å; Q61-P98 WeakPolarHBondContact CA-O 3.16Å; Q61-P98 WeakPolarHBondContact CB-O 3.25Å; A62-P98 HydrophobicContact CB-CG 4Å; A62-P98 PolarHBondContact N-O 2.94Å; A62-P98 WeakPolarHBondContact O-CD 3.16Å; P75-P98 HydrophobicContact CB-CB 4.4Å; P75-P98 HydrophobicContact CB-CG 4.32Å; P75-P98 HydrophobicContact CG-CB 3.31Å; P75-P98 HydrophobicContact CG-CG 3.55Å; A91-P98 HydrophobicContact CB-CB 3.7Å; K96-P98 VanDerWaalsContact C-CD 3.41Å; P98-W100 HydrophobicContact CB-CH2 3.81Å; P98-W100 HydrophobicContact CB-CZ2 3.64Å; P98-W100 HydrophobicContact CB-CZ3 4.34Å; P98-W100 HydrophobicContact CG-CH2 3.33Å; P98-W100 HydrophobicContact CG-CZ2 3.64Å; P98-W100 HydrophobicContact CG-CZ3 3.97Å
99	R	98.5	Very high	96.1	Very high	152 Å²	152	55.8 Å²	55.8	57%	0.574	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.2	131.4	177.1	-63.6	179.9	174.9	-95	-1.7	108.3	Q61	Q61-R99 HydrophobicContact CB-CB 4.49Å; Q61-R99 HydrophobicContact CB-CG 3.91Å; Q61-R99 VanDerWaalsContact OE1-NH1 3.14Å; Q61-R99 VanDerWaalsContact OE1-NH2 3.17Å
100	W	98.6	Very high	95.5	Very high	28 Å²	28	55.6 Å²	55.6	11%	0.106	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	-40.4	-178.7	-59.3	-79.1	0	0	0	112	V59 V60 A62 P75 C77 T88 P89 P98 K102 I119 I166	V59-W100 HydrophobicContact CG1-CD2 4.27Å; V59-W100 HydrophobicContact CG1-CE3 3.71Å; V59-W100 HydrophobicContact CG1-CZ3 4.21Å; V60-W100 PolarHBondContact O-N 3.47Å; A62-W100 HydrophobicContact CB-CH2 3.91Å; A62-W100 HydrophobicContact CB-CZ3 3.82Å; P75-W100 HydrophobicContact CB-CZ2 4.13Å; P75-W100 HydrophobicContact CG-CZ2 4.24Å; P75-W100 PolarHBondContact O-NE1 3.16Å; C77-W100 WeakPolarHBondContact SG-CH2 3.47Å; T88-W100 HydrophobicContact CG2-CB 4.36Å; T88-W100 HydrophobicContact CG2-CG 4.35Å; P89-W100 PolarHBondContact O-NE1 2.78Å; P98-W100 HydrophobicContact CB-CH2 3.81Å; P98-W100 HydrophobicContact CB-CZ2 3.64Å; P98-W100 HydrophobicContact CB-CZ3 4.34Å; P98-W100 HydrophobicContact CG-CH2 3.33Å; P98-W100 HydrophobicContact CG-CZ2 3.64Å; P98-W100 HydrophobicContact CG-CZ3 3.97Å; W100-K102 HydrophobicContact CB-CB 4.35Å; W100-K102 PolarHBondContact O-N 3.19Å; W100-K102 VanDerWaalsContact O-N 3.13Å; W100-I119 HydrophobicContact CH2-CD1 4.45Å; W100-I119 HydrophobicContact CH2-CG2 4.37Å; W100-I119 HydrophobicContact CZ2-CG2 4.43Å; W100-I166 HydrophobicContact CZ3-CD1 4.47Å
101	N	97.7	Very high	95	Very high	104 Å²	104	58.1 Å²	58.1	56%	0.556	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	47.7	37.9	-174.3	-55.6	-57.5	0	0	0	112.7	V59 V60	V59-N101 WeakPolarHBondContact O-CA 3.32Å; V59-N101 PolarHBondContact O-N 3.45Å; V60-N101 PolarHBondContact O-N 3.22Å
102	K	98	Very high	94.7	Very high	93 Å²	93	59.1 Å²	59.1	40%	0.404	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	123.8	-175.8	177.7	63.1	177.7	-176.9	0	109.8	T58 V59 T88 W100 I104	T58-K102 CarbonylContact C-O 3.57Å; T58-K102 WeakPolarHBondContact CA-O 3.36Å; V59-K102 PolarHBondContact N-O 3.19Å; V59-K102 PolarHBondContact O-N 3.01Å; V59-K102 VanDerWaalsContact O-N 3.12Å; T88-K102 HydrophobicContact CG2-CB 4.02Å; T88-K102 HydrophobicContact CG2-CG 4.22Å; W100-K102 HydrophobicContact CB-CB 4.35Å; W100-K102 PolarHBondContact O-N 3.19Å; W100-K102 VanDerWaalsContact O-N 3.13Å; K102-I104 HydrophobicContact CG-CG1 4.18Å
103	V	97.9	Very high	94.7	Very high	60 Å²	60	56.3 Å²	56.3	36%	0.364	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	127.5	168.4	-171.1	0	0	0	0	109.3	T58	T58-V103 HydrophobicContact CG2-CG2 4.29Å
104	I	97.3	Very high	94.8	Very high	9 Å²	9	53.3 Å²	53.3	5%	0.046	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	122.2	173.8	-56.7	178.3	0	0	0	107.7	I57 V59 Y86 T88 K102 C106	I57-I104 PolarHBondContact N-O 3.13Å; I57-I104 PolarHBondContact O-N 3.46Å; V59-I104 HydrophobicContact CG2-CD1 4.01Å; Y86-I104 VanDerWaalsContact CB-CG2 3.44Å; Y86-I104 HydrophobicContact CD1-CG2 3.57Å; Y86-I104 HydrophobicContact CD2-CG2 4.1Å; Y86-I104 HydrophobicContact CE1-CG2 4.32Å; Y86-I104 HydrophobicContact CG-CG2 3.44Å; Y86-I104 VanDerWaalsContact CG-CG2 3.44Å; T88-I104 HydrophobicContact CG2-CD1 4.24Å; K102-I104 HydrophobicContact CG-CG1 4.18Å; I104-C106 VanDerWaalsContact CG2-SG 3.58Å
105	H	95.4	Very high	94.9	Very high	116 Å²	116	52.7 Å²	52.7	54%	0.537	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	111.8	176	-58.6	-71.3	0	0	0	109.3	N56	N56-H105 PolarHBondContact OD1-ND1 3.12Å
106	C	93.7	Very high	95	Very high	1 Å²	1	54.2 Å²	54.2	1%	0.007	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	131.3	-177.6	-49.3	0	0	0	0	109.8	R54 L55 L81 Y86 I104	R54-C106 CarbonylContact C-O 3.46Å; R54-C106 VanDerWaalsContact CA-O 3.31Å; R54-C106 WeakPolarHBondContact CA-O 3.37Å; L55-C106 HydrophobicContact CB-CB 4.44Å; L55-C106 PolarHBondContact N-O 2.95Å; L55-C106 WeakPolarHBondContact O-CB 3.41Å; L55-C106 PolarHBondContact O-N 3.11Å; L81-C106 HydrophobicContact CD2-CB 3.47Å; L81-C106 VanDerWaalsContact CD2-CB 3.47Å; Y86-C106 HydrophobicContact CE2-CB 4.02Å; I104-C106 VanDerWaalsContact CG2-SG 3.58Å
107	T	91.6	Very high	95.1	Very high	28 Å²	28	50.1 Å²	50.1	17%	0.172	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	128.6	162.7	-51	0	0	0	0	108	Y45 V52 G53 L81 P109 V180	Y45-T107 HydrophobicContact CE1-CG2 3.71Å; Y45-T107 VanDerWaalsContact OH-CB 3.27Å; Y45-T107 WeakPolarHBondContact OH-CB 3.37Å; Y45-T107 WeakPolarHBondContact OH-CG2 3.48Å; Y45-T107 PolarHBondContact OH-O 3.27Å; V52-T107 HydrophobicContact CB-CG2 4.02Å; V52-T107 HydrophobicContact CG2-CG2 4.17Å; G53-T107 CarbonylContact O-C 3.47Å; G53-T107 WeakPolarHBondContact O-CA 3.31Å; G53-T107 WeakPolarHBondContact O-CG2 3.34Å; L81-T107 WeakPolarHBondContact CD2-O 3.3Å; T107-P109 WeakPolarHBondContact O-CD 3.48Å; T107-V180 HydrophobicContact CG2-CG1 3.83Å; T107-V180 HydrophobicContact CG2-CG2 4.34Å
108	V	92.7	Very high	95.1	Very high	5 Å²	5	46.5 Å²	46.5	3%	0.03	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	112.3	177.6	-168.8	0	0	0	0	108.9	G53 L55 L81 V112 I138 Y172	G53-V108 PolarHBondContact O-N 3.34Å; L55-V108 HydrophobicContact CB-CG2 3.49Å; L55-V108 VanDerWaalsContact CB-CG2 3.49Å; L81-V108 HydrophobicContact CD2-CG2 4.07Å; V108-V112 HydrophobicContact CG1-CB 4.28Å; V108-V112 WeakPolarHBondContact CG1-O 3.43Å; V108-I138 HydrophobicContact CG1-CD1 4.08Å; V108-Y172 HydrophobicContact CB-CE2 4.06Å; V108-Y172 HydrophobicContact CG1-CE2 4.43Å; V108-Y172 HydrophobicContact CG2-CD2 4.2Å; V108-Y172 HydrophobicContact CG2-CE2 3.65Å
109	P	87.6	Confident	95.1	Very high	5 Å²	5	46.4 Å²	46.4	3%	0.032	25%	0.253	C	S	.	.			trans	-65.4	151.9	176.2	-14.6	27.8	0	0	0	111.5	Q44 Y45 T107 G111 V112	Q44-P109 HydrophobicContact CB-CB 4.28Å; Y45-P109 HydrophobicContact CE1-CB 4.21Å; T107-P109 WeakPolarHBondContact O-CD 3.48Å; P109-G111 PolarHBondContact O-N 2.91Å; P109-V112 HydrophobicContact CB-CB 4.47Å; P109-V112 HydrophobicContact CB-CG2 3.79Å; P109-V112 HydrophobicContact CG-CB 4.44Å; P109-V112 HydrophobicContact CG-CG2 3.84Å; P109-V112 WeakPolarHBondContact O-CB 3.34Å; P109-V112 PolarHBondContact O-N 2.98Å; P109-V112 VanDerWaalsContact O-N 3.12Å
110	P	85	Confident	95.1	Very high	77 Å²	77	40.2 Å²	40.2	50%	0.5	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.8	135.6	170.9	-23.9	32.8	0	0	0	111.9	Q44 A48 V112	Q44-P110 WeakPolarHBondContact O-CD 3.33Å; A48-P110 HydrophobicContact CB-CG 3.93Å; P110-V112 PolarHBondContact O-N 3.32Å
111	G	88.1	Confident	95	Very high	83 Å²	83	39.3 Å²	39.3	86%	0.856	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	78.7	-7.2	-179.9	0	0	0	0	0	115.4	P109	P109-G111 PolarHBondContact O-N 2.91Å
112	V	92	Very high	94.9	Very high	34 Å²	34	38.2 Å²	38.2	21%	0.206	22%	0.219	C	C	.	.			trans	-85.7	121	174.1	179.5	0	0	0	0	109.6	L81 V108 P109 P110 S114	L81-V112 HydrophobicContact CD1-CG1 3.54Å; L81-V112 HydrophobicContact CG-CG1 4.2Å; V108-V112 HydrophobicContact CG1-CB 4.28Å; V108-V112 WeakPolarHBondContact CG1-O 3.43Å; P109-V112 HydrophobicContact CB-CB 4.47Å; P109-V112 HydrophobicContact CB-CG2 3.79Å; P109-V112 HydrophobicContact CG-CB 4.44Å; P109-V112 HydrophobicContact CG-CG2 3.84Å; P109-V112 WeakPolarHBondContact O-CB 3.34Å; P109-V112 PolarHBondContact O-N 2.98Å; P109-V112 VanDerWaalsContact O-N 3.12Å; P110-V112 PolarHBondContact O-N 3.32Å; V112-S114 WeakPolarHBondContact CG1-O 3.44Å
113	D	94.7	Very high	94.6	Very high	81 Å²	81	37.8 Å²	37.8	43%	0.433	22%	0.215	S	C	.	.			trans	-120.4	1.6	-177.4	69	-4.2	0	0	0	113.5	T137 I138	D113-T137 CarbonylContact O-C 3.34Å; D113-I138 WeakPolarHBondContact O-CB 3.23Å; D113-I138 WeakPolarHBondContact O-CG1 3.2Å; D113-I138 PolarHBondContact O-N 3.05Å
114	S	97	Very high	94.2	Very high	26 Å²	26	39.2 Å²	39.2	18%	0.182	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	155.8	-171.3	47.1	0	0	0	0	111.4	L81 V112 I136	L81-S114 WeakPolarHBondContact CD1-O 3.33Å; V112-S114 WeakPolarHBondContact CG1-O 3.44Å; S114-I136 CarbonylContact C-O 3.58Å; S114-I136 WeakPolarHBondContact CA-O 3.47Å; S114-I136 WeakPolarHBondContact CB-O 3.17Å
115	F	97.9	Very high	93.7	Very high	3 Å²	3	48.6 Å²	48.6	1%	0.013	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	155.5	173.1	64.1	-90.3	0	0	0	111	L55 I57 L79 R80 L81 L117 I136 I138 L168 M170	L55-F115 HydrophobicContact CD2-CD1 4.14Å; L55-F115 HydrophobicContact CD2-CE1 4.15Å; I57-F115 HydrophobicContact CD1-CD1 4.3Å; I57-F115 HydrophobicContact CD1-CE1 4Å; I57-F115 HydrophobicContact CD1-CE2 4.23Å; I57-F115 HydrophobicContact CD1-CZ 3.95Å; L79-F115 HydrophobicContact CD1-CD2 3.41Å; L79-F115 VanDerWaalsContact CD1-CD2 3.41Å; L79-F115 HydrophobicContact CD1-CE2 3.5Å; L79-F115 VanDerWaalsContact CD1-CE2 3.5Å; L79-F115 HydrophobicContact CD1-CG 4.22Å; L79-F115 HydrophobicContact CD1-CZ 4.37Å; L79-F115 HydrophobicContact CG-CD2 3.83Å; L79-F115 HydrophobicContact CG-CE2 4.4Å; L79-F115 HydrophobicContact CG-CG 4.46Å; R80-F115 WeakPolarHBondContact O-CA 3.19Å; R80-F115 WeakPolarHBondContact O-CB 3.36Å; L81-F115 HydrophobicContact CB-CB 4.15Å; L81-F115 HydrophobicContact CD1-CB 3.78Å; F115-L117 HydrophobicContact CD2-CB 4.49Å; F115-L117 HydrophobicContact CE2-CB 4.35Å; F115-I136 HydrophobicContact CD1-CB 4.4Å; F115-I136 HydrophobicContact CD2-CB 4.46Å; F115-I136 HydrophobicContact CE1-CB 3.9Å; F115-I136 HydrophobicContact CE1-CG2 3.75Å; F115-I136 HydrophobicContact CE2-CB 3.98Å; F115-I136 HydrophobicContact CE2-CD1 3.82Å; F115-I136 HydrophobicContact CE2-CG1 4.31Å; F115-I136 HydrophobicContact CZ-CB 3.68Å; F115-I136 HydrophobicContact CZ-CD1 3.76Å; F115-I136 HydrophobicContact CZ-CG1 4.26Å; F115-I136 HydrophobicContact CZ-CG2 3.74Å; F115-I136 PolarHBondContact N-O 3.12Å; F115-I136 PolarHBondContact O-N 3.42Å; F115-I138 HydrophobicContact CD1-CG1 4.18Å; F115-L168 HydrophobicContact CE2-CD1 4.27Å; F115-L168 HydrophobicContact CZ-CD1 4.08Å; F115-M170 HydrophobicContact CE1-SD 3.78Å; F115-M170 HydrophobicContact CZ-SD 3.74Å
116	Y	98	Very high	93.4	Very high	42 Å²	42	46.3 Å²	46.3	17%	0.165	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	132.5	175.4	-160.4	-110.3	0	0	0	109.4	L79 R80 E118 W133 H135	L79-Y116 CarbonylContact C-O 3.54Å; L79-Y116 WeakPolarHBondContact CA-O 3.39Å; R80-Y116 PolarHBondContact N-O 2.91Å; R80-Y116 PolarHBondContact O-N 2.96Å; Y116-E118 HydrophobicContact CD1-CG 3.57Å; Y116-E118 HydrophobicContact CE1-CG 3.31Å; Y116-W133 HydrophobicContact CE1-CB 4.21Å; Y116-W133 HydrophobicContact CE2-CD2 4.28Å; Y116-W133 AromaticContact CE2-CE3 3.52Å; Y116-W133 HydrophobicContact CE2-CE3 3.52Å; Y116-W133 HydrophobicContact CE2-CZ3 4.02Å; Y116-W133 AromaticContact CZ-CD2 3.88Å; Y116-W133 AromaticContact CZ-CE3 3.59Å; Y116-W133 VanDerWaalsContact OH-CG 3.26Å; Y116-H135 HydrophobicContact CD2-CB 3.97Å; Y116-H135 HydrophobicContact CE2-CB 4.27Å
117	L	98.6	Very high	93.4	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	127.5	175.5	-175.8	153.3	0	0	0	108.9	R78 L79 F115 I119 W133 T134 I166 L168	R78-L117 WeakPolarHBondContact O-CA 3.42Å; L79-L117 HydrophobicContact CD1-CD1 4.44Å; F115-L117 HydrophobicContact CD2-CB 4.49Å; F115-L117 HydrophobicContact CE2-CB 4.35Å; L117-I119 HydrophobicContact CD2-CG1 3.89Å; L117-W133 CarbonylContact O-C 3.28Å; L117-W133 WeakPolarHBondContact O-CA 3.47Å; L117-T134 HydrophobicContact CB-CG2 4.05Å; L117-T134 HydrophobicContact CD2-CG2 4.37Å; L117-T134 PolarHBondContact N-O 3.42Å; L117-T134 PolarHBondContact O-N 2.81Å; L117-I166 HydrophobicContact CD1-CD1 3.74Å; L117-I166 HydrophobicContact CD2-CD1 3.56Å; L117-I166 HydrophobicContact CG-CD1 4.34Å; L117-L168 HydrophobicContact CD1-CD1 4.18Å; L117-L168 HydrophobicContact CD1-CD2 4.06Å
118	E	98.5	Very high	93.6	Very high	28 Å²	28	56.2 Å²	56.2	13%	0.131	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	148.1	174.5	-62.8	-179.4	116.5	0	0	109.2	C77 R78 Y116 F120 R130 W133	C77-E118 CarbonylContact C-O 3.59Å; C77-E118 VanDerWaalsContact CA-O 3.24Å; C77-E118 WeakPolarHBondContact CA-O 3.42Å; R78-E118 PolarHBondContact N-O 2.95Å; R78-E118 PolarHBondContact O-N 3.39Å; Y116-E118 HydrophobicContact CD1-CG 3.57Å; Y116-E118 HydrophobicContact CE1-CG 3.31Å; E118-F120 HydrophobicContact CB-CD2 4.1Å; E118-F120 HydrophobicContact CB-CE2 3.51Å; E118-F120 HydrophobicContact CB-CZ 4.3Å; E118-F120 HydrophobicContact CG-CE2 4.37Å; E118-R130 HydrophobicContact CB-CG 4.44Å; E118-R130 WeakPolarHBondContact OE1-CD 3.44Å; E118-R130 IonicContact OE1-CZ 3.71Å; E118-R130 IonicContact OE1-NE 3.78Å; E118-R130 IonicContact OE1-NH1 2.81Å; E118-R130 PolarHBondContact OE1-NH1 2.98Å; E118-W133 HydrophobicContact CG-CB 4.14Å
119	I	98.5	Very high	93.7	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	123.9	170	-48.6	-177.6	0	0	0	106.9	A62 L64 P75 Y76 W100 L117 I131 A132 L154 I166	A62-I119 HydrophobicContact CB-CD1 4.12Å; L64-I119 HydrophobicContact CD2-CD1 4.02Å; P75-I119 HydrophobicContact CB-CG2 3.93Å; Y76-I119 CarbonylContact O-C 3.53Å; Y76-I119 WeakPolarHBondContact O-CA 3.39Å; W100-I119 HydrophobicContact CH2-CD1 4.45Å; W100-I119 HydrophobicContact CH2-CG2 4.37Å; W100-I119 HydrophobicContact CZ2-CG2 4.43Å; L117-I119 HydrophobicContact CD2-CG1 3.89Å; I119-I131 HydrophobicContact CB-CG1 4.18Å; I119-I131 HydrophobicContact CG2-CD1 3.96Å; I119-I131 HydrophobicContact CG2-CG1 3.96Å; I119-I131 VanDerWaalsContact O-CG1 3.26Å; I119-I131 WeakPolarHBondContact O-CG1 2.99Å; I119-I131 PolarHBondContact O-N 3.15Å; I119-A132 HydrophobicContact CB-CB 4.13Å; I119-A132 HydrophobicContact CD1-CB 4.21Å; I119-A132 HydrophobicContact CG1-CB 4.31Å; I119-A132 PolarHBondContact N-O 2.81Å; I119-A132 PolarHBondContact O-N 3.17Å; I119-L154 HydrophobicContact CD1-CD1 3.66Å; I119-L154 HydrophobicContact CD1-CD2 3.99Å; I119-I166 HydrophobicContact CD1-CD1 4.14Å
120	F	97.9	Very high	94.2	Very high	22 Å²	22	62.2 Å²	62.2	10%	0.096	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	153.7	176.1	-71.9	-94.3	0	0	0	109.9	P75 Y76 R78 E118 D128 D129 R130	P75-F120 CarbonylContact C-O 3.55Å; P75-F120 WeakPolarHBondContact CA-O 3.41Å; Y76-F120 HydrophobicContact CD1-CB 3.96Å; Y76-F120 HydrophobicContact CE1-CB 3.44Å; Y76-F120 VanDerWaalsContact CE1-CB 3.44Å; Y76-F120 HydrophobicContact CE1-CG 4.37Å; Y76-F120 HydrophobicContact CE2-CB 4.03Å; Y76-F120 HydrophobicContact CE2-CD2 4.13Å; Y76-F120 HydrophobicContact CE2-CG 4.32Å; Y76-F120 HydrophobicContact CG-CB 4.47Å; Y76-F120 VanDerWaalsContact CZ-CB 3.49Å; Y76-F120 AromaticContact CZ-CG 3.94Å; Y76-F120 PolarHBondContact N-O 3.46Å; Y76-F120 PolarHBondContact O-N 2.97Å; R78-F120 HydrophobicContact CB-CD2 4.19Å; R78-F120 HydrophobicContact CB-CE2 3.99Å; E118-F120 HydrophobicContact CB-CD2 4.1Å; E118-F120 HydrophobicContact CB-CE2 3.51Å; E118-F120 HydrophobicContact CB-CZ 4.3Å; E118-F120 HydrophobicContact CG-CE2 4.37Å; F120-D128 HydrophobicContact CB-CB 4.37Å; F120-D128 HydrophobicContact CD1-CB 4.14Å; F120-D129 CarbonylContact C-O 3.5Å; F120-D129 VanDerWaalsContact CA-O 3.25Å; F120-D129 WeakPolarHBondContact CA-O 3.37Å; F120-R130 HydrophobicContact CD1-CB 3.93Å; F120-R130 HydrophobicContact CE1-CB 3.61Å; F120-R130 HydrophobicContact CE1-CG 4.18Å; F120-R130 HydrophobicContact CZ-CB 4.07Å; F120-R130 HydrophobicContact CZ-CG 4.16Å
121	D	97	Very high	94.7	Very high	9 Å²	9	58.6 Å²	58.6	5%	0.048	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	113.9	164.4	177.8	37	0	0	0	107.8	M73 D74 R123 D128 D129 I131	M73-D121 WeakPolarHBondContact CA-OD1 3.49Å; M73-D121 HydrophobicContact CB-CB 4.43Å; M73-D121 WeakPolarHBondContact CB-OD1 3.48Å; M73-D121 HydrophobicContact CG-CB 4.4Å; M73-D121 HydrophobicContact SD-CB 4.49Å; D74-D121 PolarHBondContact N-OD1 3.04Å; D121-R123 IonicContact OD2-CZ 3.26Å; D121-R123 IonicContact OD2-NE 3.88Å; D121-R123 IonicContact OD2-NH2 3.65Å; D121-D128 WeakPolarHBondContact O-CA 3.41Å; D121-D129 PolarHBondContact N-O 3.42Å; D121-D129 PolarHBondContact O-N 2.89Å; D121-D129 VanDerWaalsContact O-N 3.08Å; D121-I131 HydrophobicContact CB-CD1 4.33Å; D121-I131 HydrophobicContact CB-CG2 3.76Å
122	E	96.2	Very high	95.2	Very high	81 Å²	81	54.6 Å²	54.6	38%	0.379	28%	0.278	S	S	.	.			trans	-67.7	133.8	178.2	-173.5	177.8	-179.5	0	0	110	D74 Y76 T90 D128	D74-E122 HydrophobicContact CB-CB 4.29Å; D74-E122 WeakPolarHBondContact O-CB 3.46Å; D74-E122 PolarHBondContact O-N 3.34Å; Y76-E122 HydrophobicContact CD1-CB 4.16Å; Y76-E122 HydrophobicContact CE1-CB 4.2Å; T90-E122 WeakPolarHBondContact CB-OE2 3.49Å; T90-E122 HydrophobicContact CG2-CB 4.1Å; T90-E122 VanDerWaalsContact CG2-OE2 3.23Å; T90-E122 WeakPolarHBondContact CG2-OE2 3.34Å; T90-E122 PolarHBondContact OG1-OE2 3.49Å; E122-D128 WeakPolarHBondContact CA-OD1 3.18Å
123	R	91.9	Very high	95.5	Very high	83 Å²	83	56.1 Å²	56.1	31%	0.313	28%	0.281	S	S	.	.			trans	-125.4	129.6	-177.6	-63.8	-174.6	178.9	-128.9	5	111.6	D121 F125 S126 M127 D128 D129	D121-R123 IonicContact OD2-CZ 3.26Å; D121-R123 IonicContact OD2-NE 3.88Å; D121-R123 IonicContact OD2-NH2 3.65Å; R123-F125 VanDerWaalsContact C-N 3.34Å; R123-F125 PolarHBondContact O-N 2.95Å; R123-S126 WeakPolarHBondContact CB-OG 3.41Å; R123-S126 WeakPolarHBondContact CD-OG 3.44Å; R123-M127 WeakPolarHBondContact CD-O 3.41Å; R123-D128 PolarHBondContact N-OD1 3.4Å; R123-D128 VanDerWaalsContact N-OD1 3.08Å; R123-D129 IonicContact NH2-OD2 3.67Å; R123-D129 PolarHBondContact NH2-OD2 3.42Å
124	A	87.7	Confident	95.7	Very high	91 Å²	91	52.9 Å²	52.9	75%	0.752	26%	0.264	S	S	*	.	S	Bend	trans	-66	-30.1	-177.1	0	0	0	0	0	114.7
125	F	87.2	Confident	95.8	Very high	206 Å²	206	56.6 Å²	56.6	90%	0.904	28%	0.278	S	S	*	.	S	Bend	trans	-129.5	10.7	-169.9	-54.5	-67.3	0	0	0	114.1	R123	R123-F125 VanDerWaalsContact C-N 3.34Å; R123-F125 PolarHBondContact O-N 2.95Å
126	S	90	Very high	95.8	Very high	68 Å²	68	56.7 Å²	56.7	48%	0.476	28%	0.278	S	S	.	.	S	Bend	trans	-148.7	172.3	178.2	67.4	0	0	0	0	109.9	R123	R123-S126 WeakPolarHBondContact CB-OG 3.41Å; R123-S126 WeakPolarHBondContact CD-OG 3.44Å
127	M	93.5	Very high	95.8	Very high	176 Å²	176	58.8 Å²	58.8	87%	0.867	30%	0.296	S	S	*	.	P	Polyproline II helix	trans	-59.4	146.1	168.8	-64.6	-176.5	-69.6	0	0	110.6	R123	R123-M127 WeakPolarHBondContact CD-O 3.41Å
128	D	95.6	Very high	95.6	Very high	61 Å²	61	59 Å²	59	33%	0.326	30%	0.297	S	S	.	.	P	Polyproline II helix	trans	-61.1	143.7	174.5	-61.9	-16.1	0	0	0	110.9	Y76 F120 D121 E122 R123	Y76-D128 HydrophobicContact CE1-CB 4.38Å; Y76-D128 VanDerWaalsContact CE1-OD2 3.29Å; Y76-D128 WeakPolarHBondContact CE1-OD2 3.49Å; Y76-D128 PolarHBondContact OH-OD2 3.25Å; F120-D128 HydrophobicContact CB-CB 4.37Å; F120-D128 HydrophobicContact CD1-CB 4.14Å; D121-D128 WeakPolarHBondContact O-CA 3.41Å; E122-D128 WeakPolarHBondContact CA-OD1 3.18Å; R123-D128 PolarHBondContact N-OD1 3.4Å; R123-D128 VanDerWaalsContact N-OD1 3.08Å
129	D	95	Very high	95.5	Very high	27 Å²	27	59.1 Å²	59.1	14%	0.144	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	124.9	-176.6	-167.9	15.3	0	0	0	110.6	F120 D121 R123 I131 R157	F120-D129 CarbonylContact C-O 3.5Å; F120-D129 VanDerWaalsContact CA-O 3.25Å; F120-D129 WeakPolarHBondContact CA-O 3.37Å; D121-D129 PolarHBondContact N-O 3.42Å; D121-D129 PolarHBondContact O-N 2.89Å; D121-D129 VanDerWaalsContact O-N 3.08Å; R123-D129 IonicContact NH2-OD2 3.67Å; R123-D129 PolarHBondContact NH2-OD2 3.42Å; D129-I131 PolarHBondContact O-N 2.97Å; D129-I131 VanDerWaalsContact O-N 3.16Å; D129-R157 VanDerWaalsContact CG-NH2 3.27Å; D129-R157 IonicContact OD1-CZ 3.44Å; D129-R157 IonicContact OD1-NH1 3.68Å; D129-R157 IonicContact OD1-NH2 2.63Å; D129-R157 PolarHBondContact OD1-NH2 2.95Å; D129-R157 IonicContact OD2-CZ 3.31Å; D129-R157 VanDerWaalsContact OD2-CZ 3.31Å; D129-R157 IonicContact OD2-NH1 2.73Å; D129-R157 PolarHBondContact OD2-NH1 3.46Å; D129-R157 IonicContact OD2-NH2 3.12Å; D129-R157 PolarHBondContact OD2-NH2 3.08Å; D129-R157 VanDerWaalsContact OD2-NH2 3.12Å
130	R	97	Very high	95.3	Very high	108 Å²	108	64.4 Å²	64.4	41%	0.408	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	109.1	173.9	-171.1	-179	67.9	-175.2	0.7	109.4	E118 F120	E118-R130 HydrophobicContact CB-CG 4.44Å; E118-R130 WeakPolarHBondContact OE1-CD 3.44Å; E118-R130 IonicContact OE1-CZ 3.71Å; E118-R130 IonicContact OE1-NE 3.78Å; E118-R130 IonicContact OE1-NH1 2.81Å; E118-R130 PolarHBondContact OE1-NH1 2.98Å; F120-R130 HydrophobicContact CD1-CB 3.93Å; F120-R130 HydrophobicContact CE1-CB 3.61Å; F120-R130 HydrophobicContact CE1-CG 4.18Å; F120-R130 HydrophobicContact CZ-CB 4.07Å; F120-R130 HydrophobicContact CZ-CG 4.16Å
131	I	97.1	Very high	95.1	Very high	1 Å²	1	64.5 Å²	64.5	1%	0.005	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	-28.7	-175.1	58.6	175.1	0	0	0	113.2	L64 Y68 M73 P75 I119 D121 D129 E163	L64-I131 HydrophobicContact CD1-CD1 3.59Å; Y68-I131 HydrophobicContact CD2-CB 3.73Å; Y68-I131 HydrophobicContact CD2-CG2 3.59Å; Y68-I131 HydrophobicContact CE2-CB 4.02Å; Y68-I131 HydrophobicContact CE2-CG2 4.34Å; Y68-I131 HydrophobicContact CG-CG2 4.17Å; M73-I131 HydrophobicContact CE-CD1 3.86Å; M73-I131 HydrophobicContact SD-CD1 3.89Å; M73-I131 HydrophobicContact SD-CG2 4.1Å; P75-I131 HydrophobicContact CB-CD1 4.1Å; I119-I131 HydrophobicContact CB-CG1 4.18Å; I119-I131 HydrophobicContact CG2-CD1 3.96Å; I119-I131 HydrophobicContact CG2-CG1 3.96Å; I119-I131 VanDerWaalsContact O-CG1 3.26Å; I119-I131 WeakPolarHBondContact O-CG1 2.99Å; I119-I131 PolarHBondContact O-N 3.15Å; D121-I131 HydrophobicContact CB-CD1 4.33Å; D121-I131 HydrophobicContact CB-CG2 3.76Å; D129-I131 PolarHBondContact O-N 2.97Å; D129-I131 VanDerWaalsContact O-N 3.16Å; I131-E163 VanDerWaalsContact O-CG 3.23Å; I131-E163 WeakPolarHBondContact O-CG 3.23Å
132	A	98.5	Very high	95.1	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	162.7	179.6	0	0	0	0	0	112	L64 I119 L154 S155 E163	L64-A132 HydrophobicContact CD2-CB 4.15Å; I119-A132 HydrophobicContact CB-CB 4.13Å; I119-A132 HydrophobicContact CD1-CB 4.21Å; I119-A132 HydrophobicContact CG1-CB 4.31Å; I119-A132 PolarHBondContact N-O 2.81Å; I119-A132 PolarHBondContact O-N 3.17Å; A132-L154 HydrophobicContact CB-CB 4.16Å; A132-L154 HydrophobicContact CB-CD1 4.13Å; A132-L154 HydrophobicContact CB-CD2 4.34Å; A132-L154 HydrophobicContact CB-CG 4.46Å; A132-S155 CarbonylContact C-O 3.56Å; A132-S155 WeakPolarHBondContact CA-O 3.23Å; A132-E163 HydrophobicContact CB-CB 4.17Å; A132-E163 HydrophobicContact CB-CG 3.56Å
133	W	98.7	Very high	94.8	Very high	66 Å²	66	64.3 Å²	64.3	25%	0.25	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.6	163.7	174.7	60.6	-89.3	0	0	0	112.1	Y116 L117 E118 L154 S155	Y116-W133 HydrophobicContact CE1-CB 4.21Å; Y116-W133 HydrophobicContact CE2-CD2 4.28Å; Y116-W133 AromaticContact CE2-CE3 3.52Å; Y116-W133 HydrophobicContact CE2-CE3 3.52Å; Y116-W133 HydrophobicContact CE2-CZ3 4.02Å; Y116-W133 AromaticContact CZ-CD2 3.88Å; Y116-W133 AromaticContact CZ-CE3 3.59Å; Y116-W133 VanDerWaalsContact OH-CG 3.26Å; L117-W133 CarbonylContact O-C 3.28Å; L117-W133 WeakPolarHBondContact O-CA 3.47Å; E118-W133 HydrophobicContact CG-CB 4.14Å; W133-L154 WeakPolarHBondContact O-CA 3.18Å; W133-S155 VanDerWaalsContact CE2-CB 3.5Å; W133-S155 VanDerWaalsContact CZ2-CB 3.42Å; W133-S155 PolarHBondContact N-O 3.06Å; W133-S155 PolarHBondContact O-N 2.98Å
134	T	98.7	Very high	94.8	Very high	13 Å²	13	66.6 Å²	66.6	8%	0.08	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	154.6	171.2	-169.6	0	0	0	0	110.7	L117 I136 S153 L154 I166	L117-T134 HydrophobicContact CB-CG2 4.05Å; L117-T134 HydrophobicContact CD2-CG2 4.37Å; L117-T134 PolarHBondContact N-O 3.42Å; L117-T134 PolarHBondContact O-N 2.81Å; T134-I136 HydrophobicContact CG2-CD1 3.84Å; T134-I136 HydrophobicContact CG2-CG1 3.96Å; T134-S153 VanDerWaalsContact CB-O 3.27Å; T134-S153 WeakPolarHBondContact CB-O 3.04Å; T134-S153 PolarHBondContact OG1-O 3.25Å; T134-L154 HydrophobicContact CG2-CD2 4.05Å; T134-I166 HydrophobicContact CG2-CG2 4.26Å
135	H	98	Very high	95	Very high	104 Å²	104	64.9 Å²	64.9	48%	0.481	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	120.1	174.5	-179.7	-99.9	0	0	0	108.9	Y116	Y116-H135 HydrophobicContact CD2-CB 3.97Å; Y116-H135 HydrophobicContact CE2-CB 4.27Å
136	I	97.9	Very high	95.4	Very high	4 Å²	4	60.6 Å²	60.6	2%	0.021	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	116.2	-171.7	-60.8	176.3	0	0	0	109.3	S114 F115 T134 Y152 L168 M170	S114-I136 CarbonylContact C-O 3.58Å; S114-I136 WeakPolarHBondContact CA-O 3.47Å; S114-I136 WeakPolarHBondContact CB-O 3.17Å; F115-I136 HydrophobicContact CD1-CB 4.4Å; F115-I136 HydrophobicContact CD2-CB 4.46Å; F115-I136 HydrophobicContact CE1-CB 3.9Å; F115-I136 HydrophobicContact CE1-CG2 3.75Å; F115-I136 HydrophobicContact CE2-CB 3.98Å; F115-I136 HydrophobicContact CE2-CD1 3.82Å; F115-I136 HydrophobicContact CE2-CG1 4.31Å; F115-I136 HydrophobicContact CZ-CB 3.68Å; F115-I136 HydrophobicContact CZ-CD1 3.76Å; F115-I136 HydrophobicContact CZ-CG1 4.26Å; F115-I136 HydrophobicContact CZ-CG2 3.74Å; F115-I136 PolarHBondContact N-O 3.12Å; F115-I136 PolarHBondContact O-N 3.42Å; T134-I136 HydrophobicContact CG2-CD1 3.84Å; T134-I136 HydrophobicContact CG2-CG1 3.96Å; I136-Y152 HydrophobicContact CD1-CD1 3.68Å; I136-Y152 HydrophobicContact CD1-CD2 3.86Å; I136-Y152 HydrophobicContact CD1-CE1 4.12Å; I136-Y152 HydrophobicContact CD1-CE2 4.29Å; I136-Y152 HydrophobicContact CD1-CG 3.55Å; I136-Y152 HydrophobicContact CG1-CD1 3.76Å; I136-Y152 HydrophobicContact CG1-CE1 4.18Å; I136-Y152 HydrophobicContact CG1-CG 4.12Å; I136-Y152 HydrophobicContact CG2-CD1 4.18Å; I136-Y152 HydrophobicContact CG2-CE1 3.69Å; I136-L168 HydrophobicContact CD1-CD1 3.39Å; I136-M170 HydrophobicContact CG2-CE 4.43Å
137	T	97.5	Very high	95.7	Very high	86 Å²	86	62 Å²	62	53%	0.528	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	128.1	164.4	-54.4	0	0	0	0	109.1	D113 P139	D113-T137 CarbonylContact O-C 3.34Å; T137-P139 WeakPolarHBondContact O-CD 3.24Å
138	I	96.1	Very high	95.9	Very high	4 Å²	4	56.4 Å²	56.4	2%	0.021	29%	0.287	C	S	.	.			trans	-61.4	113.9	177.7	-60.7	171.5	0	0	0	108.3	L55 L81 V108 D113 F115 L142	L55-I138 HydrophobicContact CD2-CD1 3.94Å; L55-I138 HydrophobicContact CD2-CG1 4.03Å; L81-I138 HydrophobicContact CD1-CD1 4.23Å; V108-I138 HydrophobicContact CG1-CD1 4.08Å; D113-I138 WeakPolarHBondContact O-CB 3.23Å; D113-I138 WeakPolarHBondContact O-CG1 3.2Å; D113-I138 PolarHBondContact O-N 3.05Å; F115-I138 HydrophobicContact CD1-CG1 4.18Å; I138-L142 HydrophobicContact CG2-CD1 4.16Å
139	P	95.3	Very high	96	Very high	32 Å²	32	58.6 Å²	58.6	21%	0.208	30%	0.299	C	S	.	.			trans	-61.3	139.5	-178.7	-24.3	34.3	0	0	0	112.3	T137 S141 L142	T137-P139 WeakPolarHBondContact O-CD 3.24Å; P139-S141 WeakPolarHBondContact CB-OG 3.3Å; P139-S141 PolarHBondContact O-N 3.11Å; P139-L142 HydrophobicContact CB-CG 4.35Å; P139-L142 HydrophobicContact CG-CD1 4.43Å; P139-L142 WeakPolarHBondContact O-CB 3.31Å; P139-L142 PolarHBondContact O-N 2.76Å; P139-L142 VanDerWaalsContact O-N 3.08Å
140	E	93.9	Very high	96.2	Very high	111 Å²	111	62.6 Å²	62.6	52%	0.519	32%	0.315	S	S	.	.	H	α-helix	trans	-63.8	-26.5	178.1	-168.6	55.1	-148.1	0	0	112.5	L142 R143 Q144	E140-L142 PolarHBondContact O-N 2.83Å; E140-R143 WeakPolarHBondContact O-CB 3.29Å; E140-R143 PolarHBondContact O-N 2.73Å; E140-R143 WeakPolarHBondContact OE2-CD 3.26Å; E140-R143 IonicContact OE2-CZ 3.7Å; E140-R143 IonicContact OE2-NE 3.94Å; E140-R143 IonicContact OE2-NH1 2.75Å; E140-R143 PolarHBondContact OE2-NH1 3.19Å; E140-Q144 PolarHBondContact O-N 2.83Å
141	S	95.4	Very high	96.2	Very high	24 Å²	24	61.4 Å²	61.4	17%	0.168	31%	0.311	C	S	.	.	H	α-helix	trans	-57.7	-34.1	173.5	51.7	0	0	0	0	112.8	P139 R143 Q144 K146 E148	P139-S141 WeakPolarHBondContact CB-OG 3.3Å; P139-S141 PolarHBondContact O-N 3.11Å; S141-R143 VanDerWaalsContact C-N 3.35Å; S141-Q144 WeakPolarHBondContact O-CB 3.38Å; S141-Q144 PolarHBondContact O-N 3.48Å; S141-K146 VanDerWaalsContact O-CB 3.31Å; S141-K146 WeakPolarHBondContact O-CB 3.11Å; S141-K146 PolarHBondContact O-N 3.41Å; S141-E148 VanDerWaalsContact CB-OE1 3.23Å; S141-E148 WeakPolarHBondContact CB-OE1 3.4Å; S141-E148 PolarHBondContact OG-OE1 3.4Å
142	L	95.9	Very high	96.3	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-64.4	-40.9	175.7	-64.2	-177.2	0	0	0	111.3	L55 I138 P139 E140 Q144 G145 K146 E148 M170 Y172	L55-L142 HydrophobicContact CD1-CD1 3.8Å; I138-L142 HydrophobicContact CG2-CD1 4.16Å; P139-L142 HydrophobicContact CB-CG 4.35Å; P139-L142 HydrophobicContact CG-CD1 4.43Å; P139-L142 WeakPolarHBondContact O-CB 3.31Å; P139-L142 PolarHBondContact O-N 2.76Å; P139-L142 VanDerWaalsContact O-N 3.08Å; E140-L142 PolarHBondContact O-N 2.83Å; L142-Q144 PolarHBondContact O-N 3.3Å; L142-G145 WeakPolarHBondContact O-CA 3.42Å; L142-G145 PolarHBondContact O-N 3.22Å; L142-K146 VanDerWaalsContact CD2-O 3.23Å; L142-K146 WeakPolarHBondContact CD2-O 3.42Å; L142-E148 HydrophobicContact CD2-CB 3.81Å; L142-E148 HydrophobicContact CD2-CG 3.56Å; L142-E148 HydrophobicContact CG-CG 4.09Å; L142-M170 HydrophobicContact CD1-CB 3.65Å; L142-M170 HydrophobicContact CD1-CE 4.33Å; L142-M170 HydrophobicContact CD1-SD 4.42Å; L142-M170 HydrophobicContact CD2-CB 4.07Å; L142-M170 WeakPolarHBondContact CD2-O 3.49Å; L142-Y172 WeakPolarHBondContact O-CB 3.47Å
143	R	90.1	Very high	96.3	Very high	85 Å²	85	65 Å²	65	32%	0.321	33%	0.332	S	S	.	.	H	α-helix	trans	-64.4	-22.3	178.3	-62.5	-167.1	179.7	87.9	4.4	112.5	E140 S141 G145 Y172	E140-R143 WeakPolarHBondContact O-CB 3.29Å; E140-R143 PolarHBondContact O-N 2.73Å; E140-R143 WeakPolarHBondContact OE2-CD 3.26Å; E140-R143 IonicContact OE2-CZ 3.7Å; E140-R143 IonicContact OE2-NE 3.94Å; E140-R143 IonicContact OE2-NH1 2.75Å; E140-R143 PolarHBondContact OE2-NH1 3.19Å; S141-R143 VanDerWaalsContact C-N 3.35Å; R143-G145 PolarHBondContact O-N 3.02Å; R143-Y172 HydrophobicContact CG-CD1 4.36Å; R143-Y172 HydrophobicContact CG-CE1 4.36Å
144	Q	91.7	Very high	96.3	Very high	131 Å²	131	61.8 Å²	61.8	61%	0.612	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	6.3	172	-59	170.9	6.1	0	0	113.2	E140 S141 L142	E140-Q144 PolarHBondContact O-N 2.83Å; S141-Q144 WeakPolarHBondContact O-CB 3.38Å; S141-Q144 PolarHBondContact O-N 3.48Å; L142-Q144 PolarHBondContact O-N 3.3Å
145	G	91.6	Very high	96.3	Very high	55 Å²	55	61.5 Å²	61.5	57%	0.567	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.5	7.6	179.6	0	0	0	0	0	114.7	L142 R143	L142-G145 WeakPolarHBondContact O-CA 3.42Å; L142-G145 PolarHBondContact O-N 3.22Å; R143-G145 PolarHBondContact O-N 3.02Å
146	K	95.7	Very high	96.3	Very high	117 Å²	117	57.5 Å²	57.5	51%	0.509	31%	0.305	S	S	.	.			trans	-75	152.6	175.1	-61	-177.1	178.5	174.8	0	110.7	S141 L142	S141-K146 VanDerWaalsContact O-CB 3.31Å; S141-K146 WeakPolarHBondContact O-CB 3.11Å; S141-K146 PolarHBondContact O-N 3.41Å; L142-K146 VanDerWaalsContact CD2-O 3.23Å; L142-K146 WeakPolarHBondContact CD2-O 3.42Å
147	V	97.2	Very high	96.2	Very high	98 Å²	98	64.4 Å²	64.4	59%	0.594	33%	0.331	S	S	*	.			trans	-97.6	131.1	168.5	-178.4	0	0	0	0	107.9	V169 M170	V147-V169 HydrophobicContact CG1-CG1 3.64Å; V147-M170 WeakPolarHBondContact CA-O 3.34Å
148	E	97.1	Very high	96.1	Very high	57 Å²	57	64.5 Å²	64.5	27%	0.266	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	123.4	176.4	-69.3	-73.7	168.7	0	0	109.6	S141 L142 V169 M170	S141-E148 VanDerWaalsContact CB-OE1 3.23Å; S141-E148 WeakPolarHBondContact CB-OE1 3.4Å; S141-E148 PolarHBondContact OG-OE1 3.4Å; L142-E148 HydrophobicContact CD2-CB 3.81Å; L142-E148 HydrophobicContact CD2-CG 3.56Å; L142-E148 HydrophobicContact CG-CG 4.09Å; E148-V169 CarbonylContact O-C 3.58Å; E148-V169 VanDerWaalsContact O-CA 3.26Å; E148-V169 WeakPolarHBondContact O-CA 3.34Å; E148-M170 PolarHBondContact N-O 2.93Å; E148-M170 PolarHBondContact O-N 3.25Å
149	D	98	Very high	96.2	Very high	108 Å²	108	65.5 Å²	65.5	58%	0.578	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.6	109.1	169.3	-179.7	1	0	0	0	108.3	N167 V169	D149-N167 PolarHBondContact OD1-ND2 2.72Å; D149-V169 HydrophobicContact CB-CG2 3.99Å
150	K	98.1	Very high	96.3	Very high	111 Å²	111	69.7 Å²	69.7	48%	0.483	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	150.1	-170.7	-173.6	172.4	177.5	-175.8	0	112.7	Y152 N167 L168	K150-Y152 HydrophobicContact CB-CE2 3.82Å; K150-Y152 HydrophobicContact CD-CE1 4.25Å; K150-Y152 HydrophobicContact CD-CE2 4.44Å; K150-Y152 HydrophobicContact CG-CE2 4.14Å; K150-N167 WeakPolarHBondContact O-CA 3.44Å; K150-N167 PolarHBondContact O-ND2 3.15Å; K150-L168 PolarHBondContact N-O 2.86Å; K150-L168 PolarHBondContact O-N 2.92Å
151	W	98.6	Very high	96.5	Very high	83 Å²	83	69.3 Å²	69.3	31%	0.314	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	128.7	165.8	-70.3	87.4	0	0	0	110.5	Q61 K63 M165 I166 N167	Q61-W151 HydrophobicContact CG-CH2 3.65Å; Q61-W151 HydrophobicContact CG-CZ2 4.15Å; Q61-W151 HydrophobicContact CG-CZ3 4.43Å; K63-W151 HydrophobicContact CB-CZ3 4.39Å; K63-W151 HydrophobicContact CD-CH2 4Å; K63-W151 HydrophobicContact CD-CZ3 4.3Å; K63-W151 HydrophobicContact CG-CH2 3.93Å; K63-W151 HydrophobicContact CG-CZ3 4.06Å; W151-M165 HydrophobicContact CB-CB 4.41Å; W151-M165 HydrophobicContact CB-SD 4.27Å; W151-M165 HydrophobicContact CD2-CB 4.47Å; W151-M165 HydrophobicContact CE3-CB 3.62Å; W151-M165 HydrophobicContact CZ3-CB 4.32Å; W151-I166 CarbonylContact C-O 3.49Å; W151-I166 VanDerWaalsContact CA-O 3.31Å; W151-I166 WeakPolarHBondContact CA-O 3.29Å; W151-N167 HydrophobicContact CD2-CB 3.72Å; W151-N167 HydrophobicContact CE3-CB 3.76Å; W151-N167 HydrophobicContact CG-CB 4.42Å; W151-N167 HydrophobicContact CH2-CB 3.81Å; W151-N167 HydrophobicContact CZ2-CB 3.73Å; W151-N167 HydrophobicContact CZ3-CB 3.81Å
152	Y	98.6	Very high	96.6	Very high	26 Å²	26	74.8 Å²	74.8	10%	0.102	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	133.8	175.9	-66	-90.9	0	0	0	109.5	I136 K150 M165 I166 L168 M170	I136-Y152 HydrophobicContact CD1-CD1 3.68Å; I136-Y152 HydrophobicContact CD1-CD2 3.86Å; I136-Y152 HydrophobicContact CD1-CE1 4.12Å; I136-Y152 HydrophobicContact CD1-CE2 4.29Å; I136-Y152 HydrophobicContact CD1-CG 3.55Å; I136-Y152 HydrophobicContact CG1-CD1 3.76Å; I136-Y152 HydrophobicContact CG1-CE1 4.18Å; I136-Y152 HydrophobicContact CG1-CG 4.12Å; I136-Y152 HydrophobicContact CG2-CD1 4.18Å; I136-Y152 HydrophobicContact CG2-CE1 3.69Å; K150-Y152 HydrophobicContact CB-CE2 3.82Å; K150-Y152 HydrophobicContact CD-CE1 4.25Å; K150-Y152 HydrophobicContact CD-CE2 4.44Å; K150-Y152 HydrophobicContact CG-CE2 4.14Å; Y152-M165 CarbonylContact O-C 3.53Å; Y152-M165 WeakPolarHBondContact O-CA 3.23Å; Y152-I166 PolarHBondContact N-O 2.88Å; Y152-I166 PolarHBondContact O-N 3.45Å; Y152-L168 HydrophobicContact CD2-CB 4.24Å; Y152-L168 HydrophobicContact CD2-CD1 3.96Å; Y152-L168 HydrophobicContact CD2-CG 4.13Å; Y152-L168 HydrophobicContact CE2-CB 4.1Å; Y152-L168 HydrophobicContact CE2-CD1 4.2Å; Y152-L168 HydrophobicContact CE2-CG 4.43Å; Y152-M170 HydrophobicContact CE2-CE 3.91Å; Y152-M170 WeakPolarHBondContact OH-CE 3.27Å
153	S	98.6	Very high	96.7	Very high	49 Å²	49	74.8 Å²	74.8	34%	0.343	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	145	175.3	-60.8	0	0	0	0	111.1	T134 D161	T134-S153 VanDerWaalsContact CB-O 3.27Å; T134-S153 WeakPolarHBondContact CB-O 3.04Å; T134-S153 PolarHBondContact OG1-O 3.25Å; S153-D161 WeakPolarHBondContact CB-OD1 3.34Å
154	L	98.8	Very high	97.1	Very high	0 Å²	0	71.7 Å²	71.7	0%	0	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	134.5	178.5	-66.6	169	0	0	0	109.9	L64 I119 A132 W133 T134 D161 K162 E163 G164 I166	L64-L154 HydrophobicContact CD2-CD1 3.76Å; I119-L154 HydrophobicContact CD1-CD1 3.66Å; I119-L154 HydrophobicContact CD1-CD2 3.99Å; A132-L154 HydrophobicContact CB-CB 4.16Å; A132-L154 HydrophobicContact CB-CD1 4.13Å; A132-L154 HydrophobicContact CB-CD2 4.34Å; A132-L154 HydrophobicContact CB-CG 4.46Å; W133-L154 WeakPolarHBondContact O-CA 3.18Å; T134-L154 HydrophobicContact CG2-CD2 4.05Å; L154-D161 CarbonylContact O-C 3.57Å; L154-D161 VanDerWaalsContact O-C 3.28Å; L154-D161 VanDerWaalsContact O-CA 3.29Å; L154-D161 WeakPolarHBondContact O-CA 3.07Å; L154-K162 PolarHBondContact O-N 2.91Å; L154-E163 HydrophobicContact CB-CB 3.97Å; L154-E163 WeakPolarHBondContact O-CA 3.09Å; L154-E163 VanDerWaalsContact O-CB 3.27Å; L154-E163 WeakPolarHBondContact O-CB 3.35Å; L154-E163 PolarHBondContact O-N 2.73Å; L154-G164 PolarHBondContact N-O 2.83Å; L154-I166 HydrophobicContact CD1-CB 4.22Å; L154-I166 HydrophobicContact CD2-CB 4.13Å; L154-I166 HydrophobicContact CD2-CG2 3.82Å; L154-I166 HydrophobicContact CG-CB 4.32Å; L154-I166 HydrophobicContact CG-CG2 4.29Å
155	S	98.6	Very high	97.5	Very high	7 Å²	7	69.3 Å²	69.3	5%	0.049	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	157.9	170.1	-63.4	0	0	0	0	110.1	A132 W133 D160 D161	A132-S155 CarbonylContact C-O 3.56Å; A132-S155 WeakPolarHBondContact CA-O 3.23Å; W133-S155 VanDerWaalsContact CE2-CB 3.5Å; W133-S155 VanDerWaalsContact CZ2-CB 3.42Å; W133-S155 PolarHBondContact N-O 3.06Å; W133-S155 PolarHBondContact O-N 2.98Å; S155-D160 WeakPolarHBondContact OG-CA 3.25Å; S155-D161 PolarHBondContact OG-N 2.96Å
156	G	97.7	Very high	97.8	Very high	20 Å²	20	66.7 Å²	66.7	21%	0.206	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	180	-152.5	-176.3	0	0	0	0	0	112.4	Q158 G159 E163	G156-Q158 PolarHBondContact O-N 3.43Å; G156-G159 PolarHBondContact N-O 3.02Å; G156-G159 PolarHBondContact O-N 3.02Å; G156-G159 VanDerWaalsContact O-N 3.13Å; G156-E163 WeakPolarHBondContact CA-OE2 3.26Å
157	R	96.3	Very high	98	Very high	148 Å²	148	61.6 Å²	61.6	56%	0.558	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-22	-179	-64.3	177.7	172.2	154.6	0.9	112.5	Y68 D129 G159 E163	Y68-R157 HydrophobicContact CE1-CB 4.16Å; Y68-R157 HydrophobicContact CE1-CG 4.5Å; D129-R157 VanDerWaalsContact CG-NH2 3.27Å; D129-R157 IonicContact OD1-CZ 3.44Å; D129-R157 IonicContact OD1-NH1 3.68Å; D129-R157 IonicContact OD1-NH2 2.63Å; D129-R157 PolarHBondContact OD1-NH2 2.95Å; D129-R157 IonicContact OD2-CZ 3.31Å; D129-R157 VanDerWaalsContact OD2-CZ 3.31Å; D129-R157 IonicContact OD2-NH1 2.73Å; D129-R157 PolarHBondContact OD2-NH1 3.46Å; D129-R157 IonicContact OD2-NH2 3.12Å; D129-R157 PolarHBondContact OD2-NH2 3.08Å; D129-R157 VanDerWaalsContact OD2-NH2 3.12Å; R157-G159 PolarHBondContact O-N 3.36Å; R157-E163 PolarHBondContact N-OE2 3.4Å
158	Q	95.7	Very high	98	Very high	89 Å²	89	56.9 Å²	56.9	42%	0.416	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-10	175.6	-60.1	-71.2	102.9	0	0	112.8	Y68 G156 K162 E163	Y68-Q158 WeakPolarHBondContact OH-CG 3.26Å; G156-Q158 PolarHBondContact O-N 3.43Å; Q158-K162 HydrophobicContact CB-CB 4Å; Q158-K162 VanDerWaalsContact O-CD 3.29Å; Q158-K162 WeakPolarHBondContact O-CD 3.35Å; Q158-E163 WeakPolarHBondContact CB-OE2 3.49Å; Q158-E163 WeakPolarHBondContact CG-OE2 3.37Å; Q158-E163 PolarHBondContact N-OE2 3.06Å
159	G	97	Very high	98.1	Very high	25 Å²	25	56 Å²	56	26%	0.258	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	112.2	-178.2	-177.4	0	0	0	0	0	112.8	G156 R157 D161 K162	G156-G159 PolarHBondContact N-O 3.02Å; G156-G159 PolarHBondContact O-N 3.02Å; G156-G159 VanDerWaalsContact O-N 3.13Å; R157-G159 PolarHBondContact O-N 3.36Å; G159-D161 PolarHBondContact O-N 3.15Å; G159-K162 PolarHBondContact O-N 3.05Å
160	D	97.9	Very high	98.1	Very high	119 Å²	119	50.9 Å²	50.9	64%	0.636	26%	0.257	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.4	132	-178.4	-59.7	-31	0	0	0	111.3	S155 K162	S155-D160 WeakPolarHBondContact OG-CA 3.25Å; D160-K162 WeakPolarHBondContact O-CG 3.42Å; D160-K162 PolarHBondContact O-N 2.82Å
161	D	98.1	Very high	98.1	Very high	104 Å²	104	47.2 Å²	47.2	56%	0.556	25%	0.246	S	C	*	.	E	Extended strand (participates in β ladder)	trans	54.9	19.1	-178.8	-61.8	-33.9	0	0	0	115.4	S153 L154 S155 G159	S153-D161 WeakPolarHBondContact CB-OD1 3.34Å; L154-D161 CarbonylContact O-C 3.57Å; L154-D161 VanDerWaalsContact O-C 3.28Å; L154-D161 VanDerWaalsContact O-CA 3.29Å; L154-D161 WeakPolarHBondContact O-CA 3.07Å; S155-D161 PolarHBondContact OG-N 2.96Å; G159-D161 PolarHBondContact O-N 3.15Å
162	K	98.2	Very high	98	Very high	138 Å²	138	45 Å²	45	60%	0.6	24%	0.238	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-108.7	-2.3	-176.3	-74.3	171.3	-175.1	179	0	114.1	A65 L154 Q158 G159 D160 G164	A65-K162 WeakPolarHBondContact CB-O 3.44Å; L154-K162 PolarHBondContact O-N 2.91Å; Q158-K162 HydrophobicContact CB-CB 4Å; Q158-K162 VanDerWaalsContact O-CD 3.29Å; Q158-K162 WeakPolarHBondContact O-CD 3.35Å; G159-K162 PolarHBondContact O-N 3.05Å; D160-K162 WeakPolarHBondContact O-CG 3.42Å; D160-K162 PolarHBondContact O-N 2.82Å; K162-G164 VanDerWaalsContact C-N 3.31Å
163	E	98.1	Very high	97.7	Very high	1 Å²	1	45.3 Å²	45.3	1%	0.005	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	-2	-175.9	-152.1	60	-119.9	0	0	112.9	L64 A65 Y68 I131 A132 L154 G156 R157 Q158	L64-E163 CarbonylContact C-O 3.59Å; L64-E163 WeakPolarHBondContact CA-O 3.48Å; A65-E163 PolarHBondContact N-O 2.75Å; Y68-E163 WeakPolarHBondContact CE2-OE1 3.25Å; Y68-E163 VanDerWaalsContact CZ-OE1 3.25Å; Y68-E163 PolarHBondContact OH-OE1 3.36Å; Y68-E163 PolarHBondContact OH-OE2 3.27Å; I131-E163 VanDerWaalsContact O-CG 3.23Å; I131-E163 WeakPolarHBondContact O-CG 3.23Å; A132-E163 HydrophobicContact CB-CB 4.17Å; A132-E163 HydrophobicContact CB-CG 3.56Å; L154-E163 HydrophobicContact CB-CB 3.97Å; L154-E163 WeakPolarHBondContact O-CA 3.09Å; L154-E163 VanDerWaalsContact O-CB 3.27Å; L154-E163 WeakPolarHBondContact O-CB 3.35Å; L154-E163 PolarHBondContact O-N 2.73Å; G156-E163 WeakPolarHBondContact CA-OE2 3.26Å; R157-E163 PolarHBondContact N-OE2 3.4Å; Q158-E163 WeakPolarHBondContact CB-OE2 3.49Å; Q158-E163 WeakPolarHBondContact CG-OE2 3.37Å; Q158-E163 PolarHBondContact N-OE2 3.06Å
164	G	98.3	Very high	97.3	Very high	19 Å²	19	48.3 Å²	48.3	20%	0.196	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	116.3	-151.4	178.8	0	0	0	0	0	112.1	K63 L154 K162	K63-G164 CarbonylContact O-C 3.6Å; K63-G164 WeakPolarHBondContact O-CA 3.4Å; L154-G164 PolarHBondContact N-O 2.83Å; K162-G164 VanDerWaalsContact C-N 3.31Å
165	M	98.6	Very high	96.7	Very high	82 Å²	82	49.9 Å²	49.9	40%	0.404	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	151.1	179.6	-59.1	-179.2	-71.3	0	0	111.8	A62 K63 W151 Y152	A62-M165 CarbonylContact C-O 3.49Å; A62-M165 WeakPolarHBondContact CA-O 3.13Å; K63-M165 PolarHBondContact N-O 2.97Å; K63-M165 PolarHBondContact O-N 2.97Å; W151-M165 HydrophobicContact CB-CB 4.41Å; W151-M165 HydrophobicContact CB-SD 4.27Å; W151-M165 HydrophobicContact CD2-CB 4.47Å; W151-M165 HydrophobicContact CE3-CB 3.62Å; W151-M165 HydrophobicContact CZ3-CB 4.32Å; Y152-M165 CarbonylContact O-C 3.53Å; Y152-M165 WeakPolarHBondContact O-CA 3.23Å
166	I	98.8	Very high	95.9	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	136.8	172.8	-170.5	168.2	0	0	0	110.9	V59 A62 W100 L117 I119 T134 W151 Y152 L154 L168	V59-I166 HydrophobicContact CG1-CD1 4.11Å; A62-I166 HydrophobicContact CB-CB 4.36Å; A62-I166 HydrophobicContact CB-CG1 4.28Å; W100-I166 HydrophobicContact CZ3-CD1 4.47Å; L117-I166 HydrophobicContact CD1-CD1 3.74Å; L117-I166 HydrophobicContact CD2-CD1 3.56Å; L117-I166 HydrophobicContact CG-CD1 4.34Å; I119-I166 HydrophobicContact CD1-CD1 4.14Å; T134-I166 HydrophobicContact CG2-CG2 4.26Å; W151-I166 CarbonylContact C-O 3.49Å; W151-I166 VanDerWaalsContact CA-O 3.31Å; W151-I166 WeakPolarHBondContact CA-O 3.29Å; Y152-I166 PolarHBondContact N-O 2.88Å; Y152-I166 PolarHBondContact O-N 3.45Å; L154-I166 HydrophobicContact CD1-CB 4.22Å; L154-I166 HydrophobicContact CD2-CB 4.13Å; L154-I166 HydrophobicContact CD2-CG2 3.82Å; L154-I166 HydrophobicContact CG-CB 4.32Å; L154-I166 HydrophobicContact CG-CG2 4.29Å; I166-L168 HydrophobicContact CD1-CD2 4.04Å; I166-L168 HydrophobicContact CG1-CD2 4.05Å; I166-L168 HydrophobicContact CG1-CG 4.5Å; I166-L168 HydrophobicContact CG2-CG 4.5Å
167	N	98.8	Very high	94.8	Very high	9 Å²	9	52.3 Å²	52.3	5%	0.048	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	121.8	177.2	178.8	-139.4	0	0	0	110.6	V60 Q61 D149 K150 W151	V60-N167 HydrophobicContact CB-CB 4.29Å; V60-N167 WeakPolarHBondContact CB-OD1 3.45Å; V60-N167 WeakPolarHBondContact CG1-OD1 3.38Å; V60-N167 PolarHBondContact N-O 3.22Å; V60-N167 VanDerWaalsContact N-O 3.12Å; Q61-N167 HydrophobicContact CG-CB 3.92Å; Q61-N167 PolarHBondContact O-N 3.21Å; D149-N167 PolarHBondContact OD1-ND2 2.72Å; K150-N167 WeakPolarHBondContact O-CA 3.44Å; K150-N167 PolarHBondContact O-ND2 3.15Å; W151-N167 HydrophobicContact CD2-CB 3.72Å; W151-N167 HydrophobicContact CE3-CB 3.76Å; W151-N167 HydrophobicContact CG-CB 4.42Å; W151-N167 HydrophobicContact CH2-CB 3.81Å; W151-N167 HydrophobicContact CZ2-CB 3.73Å; W151-N167 HydrophobicContact CZ3-CB 3.81Å
168	L	98.7	Very high	93.6	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	135.3	178.3	-56	180	0	0	0	109.7	I57 T58 V59 F115 L117 I136 K150 Y152 I166 M170	I57-L168 HydrophobicContact CG2-CD2 4.29Å; T58-L168 WeakPolarHBondContact O-CA 3.29Å; V59-L168 HydrophobicContact CB-CD2 4.32Å; V59-L168 HydrophobicContact CG1-CD2 4.24Å; V59-L168 HydrophobicContact CG2-CD2 4.12Å; F115-L168 HydrophobicContact CE2-CD1 4.27Å; F115-L168 HydrophobicContact CZ-CD1 4.08Å; L117-L168 HydrophobicContact CD1-CD1 4.18Å; L117-L168 HydrophobicContact CD1-CD2 4.06Å; I136-L168 HydrophobicContact CD1-CD1 3.39Å; K150-L168 PolarHBondContact N-O 2.86Å; K150-L168 PolarHBondContact O-N 2.92Å; Y152-L168 HydrophobicContact CD2-CB 4.24Å; Y152-L168 HydrophobicContact CD2-CD1 3.96Å; Y152-L168 HydrophobicContact CD2-CG 4.13Å; Y152-L168 HydrophobicContact CE2-CB 4.1Å; Y152-L168 HydrophobicContact CE2-CD1 4.2Å; Y152-L168 HydrophobicContact CE2-CG 4.43Å; I166-L168 HydrophobicContact CD1-CD2 4.04Å; I166-L168 HydrophobicContact CG1-CD2 4.05Å; I166-L168 HydrophobicContact CG1-CG 4.5Å; I166-L168 HydrophobicContact CG2-CG 4.5Å; L168-M170 HydrophobicContact CB-CG 4.36Å
169	V	98.4	Very high	92.5	Very high	37 Å²	37	52 Å²	52	22%	0.224	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	123.6	165.8	-174.2	0	0	0	0	108.1	T58 V60 V147 E148 D149	T58-V169 PolarHBondContact N-O 3.26Å; T58-V169 PolarHBondContact O-N 2.98Å; V60-V169 HydrophobicContact CG2-CG2 3.83Å; V147-V169 HydrophobicContact CG1-CG1 3.64Å; E148-V169 CarbonylContact O-C 3.58Å; E148-V169 VanDerWaalsContact O-CA 3.26Å; E148-V169 WeakPolarHBondContact O-CA 3.34Å; D149-V169 HydrophobicContact CB-CG2 3.99Å
170	M	98.2	Very high	91.1	Very high	1 Å²	1	52.9 Å²	52.9	1%	0.005	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	143.9	-174.4	-64	-174.7	-70.3	0	0	112	L55 N56 I57 F115 I136 L142 V147 E148 Y152 L168	L55-M170 HydrophobicContact CD1-CB 4.38Å; N56-M170 VanDerWaalsContact O-CA 3.3Å; N56-M170 WeakPolarHBondContact O-CA 3.34Å; I57-M170 HydrophobicContact CB-CG 4.49Å; I57-M170 HydrophobicContact CG1-CG 4.25Å; I57-M170 HydrophobicContact CG1-SD 4.44Å; I57-M170 HydrophobicContact CG2-CG 4.17Å; F115-M170 HydrophobicContact CE1-SD 3.78Å; F115-M170 HydrophobicContact CZ-SD 3.74Å; I136-M170 HydrophobicContact CG2-CE 4.43Å; L142-M170 HydrophobicContact CD1-CB 3.65Å; L142-M170 HydrophobicContact CD1-CE 4.33Å; L142-M170 HydrophobicContact CD1-SD 4.42Å; L142-M170 HydrophobicContact CD2-CB 4.07Å; L142-M170 WeakPolarHBondContact CD2-O 3.49Å; V147-M170 WeakPolarHBondContact CA-O 3.34Å; E148-M170 PolarHBondContact N-O 2.93Å; E148-M170 PolarHBondContact O-N 3.25Å; Y152-M170 HydrophobicContact CE2-CE 3.91Å; Y152-M170 WeakPolarHBondContact OH-CE 3.27Å; L168-M170 HydrophobicContact CB-CG 4.36Å
171	S	97.5	Very high	89.6	Confident	34 Å²	34	50.3 Å²	50.3	24%	0.238	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	150.8	169.7	66.9	0	0	0	0	110.2	N56	N56-S171 PolarHBondContact N-O 3.06Å; N56-S171 PolarHBondContact ND2-OG 2.85Å; N56-S171 VanDerWaalsContact ND2-OG 3.1Å; N56-S171 PolarHBondContact O-N 3.16Å
172	Y	96.3	Very high	87.9	Confident	37 Å²	37	48.7 Å²	48.7	15%	0.145	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	139.1	-179.2	-174.7	-82.6	0	0	0	110.8	G53 R54 L55 V108 L142 R143 L174	G53-Y172 VanDerWaalsContact CA-CZ 3.5Å; G53-Y172 WeakPolarHBondContact CA-OH 3.27Å; R54-Y172 CarbonylContact O-C 3.5Å; R54-Y172 WeakPolarHBondContact O-CA 3.41Å; L55-Y172 HydrophobicContact CB-CD2 4.2Å; L55-Y172 HydrophobicContact CD1-CD2 4.3Å; V108-Y172 HydrophobicContact CB-CE2 4.06Å; V108-Y172 HydrophobicContact CG1-CE2 4.43Å; V108-Y172 HydrophobicContact CG2-CD2 4.2Å; V108-Y172 HydrophobicContact CG2-CE2 3.65Å; L142-Y172 WeakPolarHBondContact O-CB 3.47Å; R143-Y172 HydrophobicContact CG-CD1 4.36Å; R143-Y172 HydrophobicContact CG-CE1 4.36Å; Y172-L174 HydrophobicContact CE1-CD2 3.79Å; Y172-L174 HydrophobicContact CE1-CG 4.3Å
173	A	93.2	Very high	86.1	Confident	33 Å²	33	48 Å²	48	27%	0.273	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	153.9	176.1	0	0	0	0	0	110.1	G53 R54	G53-A173 CarbonylContact C-O 3.53Å; R54-A173 PolarHBondContact N-O 2.89Å; R54-A173 PolarHBondContact O-N 2.85Å
174	L	90	Very high	84.1	Confident	111 Å²	111	53.3 Å²	53.3	58%	0.581	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95	133	169	-65.7	173.6	0	0	0	109.1	Y172	Y172-L174 HydrophobicContact CE1-CD2 3.79Å; Y172-L174 HydrophobicContact CE1-CG 4.3Å
175	L	85.6	Confident	82	Confident	34 Å²	34	57.9 Å²	57.9	18%	0.178	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	149.7	173.9	-64.6	-178.2	0	0	0	110.1	T51 V52 R54 A177	T51-L175 CarbonylContact C-O 3.45Å; T51-L175 WeakPolarHBondContact CA-O 3.46Å; T51-L175 WeakPolarHBondContact CB-O 3.17Å; V52-L175 HydrophobicContact CG2-CB 4.14Å; V52-L175 PolarHBondContact N-O 3.41Å; V52-L175 PolarHBondContact O-N 2.96Å; R54-L175 HydrophobicContact CB-CD1 3.84Å; R54-L175 HydrophobicContact CB-CG 4.07Å; R54-L175 HydrophobicContact CG-CD1 4.33Å; L175-A177 PolarHBondContact O-N 2.78Å
176	P	81.8	Confident	79.6	Confident	66 Å²	66	58.2 Å²	58.2	43%	0.429	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.9	130.7	167.8	-22.3	33.3	0	0	0	110.9	A178 M179	P176-A178 PolarHBondContact O-N 3.43Å; P176-A178 VanDerWaalsContact O-N 3.11Å; P176-M179 HydrophobicContact CB-CG 4.37Å; P176-M179 HydrophobicContact CG-CE 4.3Å; P176-M179 HydrophobicContact CG-SD 4.27Å; P176-M179 WeakPolarHBondContact O-CB 3.37Å; P176-M179 PolarHBondContact O-N 3.28Å
177	A	74.7	Confident	77.5	Confident	11 Å²	11	62.2 Å²	62.2	9%	0.091	37%	0.372	C	S	.	.	G	3₁₀ helix	trans	-56.8	-32	-177.3	0	0	0	0	0	112.8	G50 V52 L175 M179 V180 M181	G50-A177 WeakPolarHBondContact O-CB 3.13Å; G50-A177 PolarHBondContact O-N 2.73Å; V52-A177 HydrophobicContact CG1-CB 3.95Å; L175-A177 PolarHBondContact O-N 2.78Å; A177-M179 PolarHBondContact O-N 3.34Å; A177-M179 VanDerWaalsContact O-N 3.11Å; A177-V180 PolarHBondContact O-N 2.95Å; A177-M181 PolarHBondContact O-N 3.49Å
178	A	71.6	Confident	75.2	Confident	90 Å²	90	66.6 Å²	66.6	74%	0.744	40%	0.395	S	S	*	.	G	3₁₀ helix	trans	-58.8	-21	176.2	0	0	0	0	0	114.2	P176	P176-A178 PolarHBondContact O-N 3.43Å; P176-A178 VanDerWaalsContact O-N 3.11Å
179	M	71.8	Confident	72.6	Confident	140 Å²	140	71.8 Å²	71.8	69%	0.69	42%	0.421	S	S	*	.	G	3₁₀ helix	trans	-81.4	-16.6	178	-66	-173.1	170.1	0	0	113.6	P176 A177	P176-M179 HydrophobicContact CB-CG 4.37Å; P176-M179 HydrophobicContact CG-CE 4.3Å; P176-M179 HydrophobicContact CG-SD 4.27Å; P176-M179 WeakPolarHBondContact O-CB 3.37Å; P176-M179 PolarHBondContact O-N 3.28Å; A177-M179 PolarHBondContact O-N 3.34Å; A177-M179 VanDerWaalsContact O-N 3.11Å
180	V	69.2	Low	70	Confident	44 Å²	44	73.6 Å²	73.6	27%	0.267	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.2	-22.7	-175.1	-174.4	0	0	0	0	112.3	V52 T107 A177	V52-V180 HydrophobicContact CG2-CB 4.09Å; V52-V180 HydrophobicContact CG2-CG2 3.51Å; T107-V180 HydrophobicContact CG2-CG1 3.83Å; T107-V180 HydrophobicContact CG2-CG2 4.34Å; A177-V180 PolarHBondContact O-N 2.95Å
181	M	65.5	Low	67.9	Low	65 Å²	65	76 Å²	76	32%	0.32	45%	0.448	S	S	.	.	S	Bend	trans	-74.5	130.5	177	-66.3	-61.6	-72.7	0	0	110.7	Y45 A177	Y45-M181 HydrophobicContact CG-SD 4.28Å; A177-M181 PolarHBondContact O-N 3.49Å
182	P	63.5	Low	65.6	Low	70 Å²	70	79.8 Å²	79.8	46%	0.455	47%	0.469	S	S	.	.	P	Polyproline II helix	trans	-61.3	145.5	168.9	26.1	-32	0	0	0	109.3	Q184	P182-Q184 PolarHBondContact O-N 3.27Å
183	P	58.7	Low	63.5	Low	124 Å²	124	83.7 Å²	83.7	81%	0.805	48%	0.484	S	S	*	.	P	Polyproline II helix	trans	-56.5	126.8	176.9	23.2	-32	0	0	0	109
184	Q	56.3	Low	61.9	Low	112 Å²	112	92.3 Å²	92.3	52%	0.523	52%	0.519	S	S	.	.	P	Polyproline II helix	trans	-63.1	132.4	175.7	-69	-145.5	-28.3	0	0	109.1	P182 V186	P182-Q184 PolarHBondContact O-N 3.27Å; Q184-V186 PolarHBondContact O-N 3.36Å; Q184-V186 VanDerWaalsContact O-N 3.1Å
185	P	54.2	Low	60.3	Low	116 Å²	116	96.5 Å²	96.5	75%	0.753	54%	0.536	S	S	*	.	P	Polyproline II helix	trans	-61.6	118.3	173.1	18.4	-22.7	0	0	0	108.6	V187	P185-V187 PolarHBondContact O-N 3.16Å
186	V	49.8	Very low	58.9	Low	89 Å²	89	96.8 Å²	96.8	54%	0.539	55%	0.547	S	S	.	.			trans	-71.2	111.7	174.9	179.3	0	0	0	0	107.6	Q184 L188 P201	Q184-V186 PolarHBondContact O-N 3.36Å; Q184-V186 VanDerWaalsContact O-N 3.1Å; V186-L188 HydrophobicContact CG1-CD2 4.44Å; V186-P201 HydrophobicContact CG1-CB 3.61Å
187	V	53.3	Low	57.2	Low	84 Å²	84	98.1 Å²	98.1	51%	0.509	55%	0.554	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-89.2	114.8	171.6	-172.1	0	0	0	0	107.8	P185 M189	P185-V187 PolarHBondContact O-N 3.16Å; V187-M189 PolarHBondContact O-N 3.41Å
188	L	50.6	Low	55.9	Low	100 Å²	100	98.6 Å²	98.6	52%	0.524	56%	0.559	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-80.7	103.9	171.6	-67.2	170.8	0	0	0	108.2	V186 Y199 P201	V186-L188 HydrophobicContact CG1-CD2 4.44Å; L188-Y199 HydrophobicContact CB-CD1 4.03Å; L188-P201 HydrophobicContact CD2-CB 4.41Å
189	M	44	Very low	54.8	Low	110 Å²	110	101.8 Å²	101.8	54%	0.542	55%	0.553	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-88.8	127.1	170.1	-82.9	-84.4	171.3	0	0	109	V187 T191 I202	V187-M189 PolarHBondContact O-N 3.41Å; M189-T191 PolarHBondContact O-N 3.44Å; M189-I202 HydrophobicContact CB-CD1 4.32Å
190	P	44.8	Very low	54	Low	75 Å²	75	97.4 Å²	97.4	49%	0.487	53%	0.534	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	117.7	171.1	26	-29.9	0	0	0	108.5	V197 Y199	P190-V197 HydrophobicContact CB-CG1 3.92Å; P190-Y199 HydrophobicContact CB-CD1 4.28Å; P190-Y199 HydrophobicContact CB-CE1 3.87Å; P190-Y199 HydrophobicContact CG-CE1 4.44Å
191	T	52.8	Low	52.8	Low	50 Å²	50	99.4 Å²	99.4	31%	0.307	55%	0.548	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	127	174.1	-52.9	0	0	0	0	107.9	M189 Y193 G198 V200	M189-T191 PolarHBondContact O-N 3.44Å; T191-Y193 HydrophobicContact CG2-CE2 4.42Å; T191-Y193 PolarHBondContact O-N 3.19Å; T191-G198 PolarHBondContact N-O 2.94Å; T191-G198 PolarHBondContact O-N 2.81Å; T191-G198 VanDerWaalsContact O-O 3.06Å; T191-V200 VanDerWaalsContact OG1-CG2 3.23Å; T191-V200 WeakPolarHBondContact OG1-CG2 3.36Å
192	V	49.4	Very low	52.1	Low	114 Å²	114	100.6 Å²	100.6	69%	0.691	56%	0.555	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-86.1	112.3	177.2	-174.7	0	0	0	0	108.2	V197	V192-V197 HydrophobicContact CG2-CG2 4.31Å
193	Y	52.3	Low	51.5	Low	119 Å²	119	102.5 Å²	102.5	47%	0.467	57%	0.565	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-88.7	157.5	167.7	-62.2	-81.4	0	0	0	109.4	T191 Q195 G196 V200	T191-Y193 HydrophobicContact CG2-CE2 4.42Å; T191-Y193 PolarHBondContact O-N 3.19Å; Y193-Q195 PolarHBondContact O-N 3.38Å; Y193-G196 WeakPolarHBondContact CA-O 3.19Å; Y193-G196 PolarHBondContact N-O 3.23Å; Y193-G196 PolarHBondContact O-N 2.93Å; Y193-G196 VanDerWaalsContact O-O 3.11Å; Y193-V200 VanDerWaalsContact OH-CG1 3.29Å; Y193-V200 WeakPolarHBondContact OH-CG1 3.31Å
194	Q	61.1	Low	51.1	Low	214 Å²	214	99.1 Å²	99.1	100%	1	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.3	-14.7	176.2	-101.3	-171	-16.5	0	0	114.3
195	Q	55.3	Low	50.6	Low	200 Å²	200	101.4 Å²	101.4	94%	0.935	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.8	10.7	177.3	-71.7	-175.3	-23.4	0	0	114.5	Y193	Y193-Q195 PolarHBondContact O-N 3.38Å
196	G	56.5	Low	50.2	Low	39 Å²	39	101.2 Å²	101.2	40%	0.402	56%	0.564	S	S	.	*	E	Extended strand (participates in β ladder)	trans	146.2	174.7	176	0	0	0	0	0	114.7	Y193	Y193-G196 WeakPolarHBondContact CA-O 3.19Å; Y193-G196 PolarHBondContact N-O 3.23Å; Y193-G196 PolarHBondContact O-N 2.93Å; Y193-G196 VanDerWaalsContact O-O 3.11Å
197	V	46.7	Very low	49.7	Very low	95 Å²	95	101.4 Å²	101.4	58%	0.576	58%	0.575	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-85.4	120	174.6	-170	0	0	0	0	109	P190 V192	P190-V197 HydrophobicContact CB-CG1 3.92Å; V192-V197 HydrophobicContact CG2-CG2 4.31Å
198	G	47.4	Very low	49.1	Very low	20 Å²	20	103.3 Å²	103.3	21%	0.206	59%	0.586	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-115.1	151.2	173.9	0	0	0	0	0	111.2	T191	T191-G198 PolarHBondContact N-O 2.94Å; T191-G198 PolarHBondContact O-N 2.81Å; T191-G198 VanDerWaalsContact O-O 3.06Å
199	Y	47.6	Very low	48.5	Very low	157 Å²	157	104.1 Å²	104.1	62%	0.616	60%	0.599	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-100.6	119.3	170.9	-67.3	-87.4	0	0	0	108.4	L188 P190	L188-Y199 HydrophobicContact CB-CD1 4.03Å; P190-Y199 HydrophobicContact CB-CD1 4.28Å; P190-Y199 HydrophobicContact CB-CE1 3.87Å; P190-Y199 HydrophobicContact CG-CE1 4.44Å
200	V	54.6	Low	48.2	Very low	49 Å²	49	103.3 Å²	103.3	30%	0.297	60%	0.604	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-108.6	131.2	172.2	-92.7	0	0	0	0	109.3	T191 Y193 I202	T191-V200 VanDerWaalsContact OG1-CG2 3.23Å; T191-V200 WeakPolarHBondContact OG1-CG2 3.36Å; Y193-V200 VanDerWaalsContact OH-CG1 3.29Å; Y193-V200 WeakPolarHBondContact OH-CG1 3.31Å; V200-I202 PolarHBondContact O-N 2.92Å
201	P	45.3	Very low	48.1	Very low	85 Å²	85	106.4 Å²	106.4	55%	0.552	62%	0.624	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-69.1	117.7	171.9	28.1	-31	0	0	0	108.5	V186 L188	V186-P201 HydrophobicContact CG1-CB 3.61Å; L188-P201 HydrophobicContact CD2-CB 4.41Å
202	I	50.7	Low	47.8	Very low	90 Å²	90	107.7 Å²	107.7	46%	0.462	65%	0.648	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-94.5	109.4	168.5	-62.1	179.2	0	0	0	107	M189 V200	M189-I202 HydrophobicContact CB-CD1 4.32Å; V200-I202 PolarHBondContact O-N 2.92Å
203	T	50.3	Low	47.6	Very low	111 Å²	111	110.9 Å²	110.9	68%	0.681	66%	0.657	S	S	*	*			trans	-78.4	130.7	165.2	44.4	0	0	0	0	108.7	M205	T203-M205 PolarHBondContact O-N 2.58Å
204	G	50	Low	47.4	Very low	52 Å²	52	111.2 Å²	111.2	54%	0.536	67%	0.671	S	S	.	*			trans	-45.3	106.5	-164.2	0	0	0	0	0	115.6
205	M	46.2	Very low	46.7	Very low	160 Å²	160	107.2 Å²	107.2	79%	0.788	66%	0.664	S	S	*	*			trans	-89	141.2	156.6	-72.5	-67.1	-152.1	0	0	108.4	T203 A207	T203-M205 PolarHBondContact O-N 2.58Å; M205-A207 PolarHBondContact O-N 3.24Å; M205-A207 VanDerWaalsContact O-N 3.17Å
206	P	45.2	Very low	46.3	Very low	113 Å²	113	103.9 Å²	103.9	73%	0.734	66%	0.657	S	S	*	*			trans	-64.2	120.7	176.7	27.3	-31.1	0	0	0	108.6	V208	P206-V208 VanDerWaalsContact C-N 3.29Å; P206-V208 PolarHBondContact O-N 3.08Å
207	A	39.4	Very low	45.5	Very low	92 Å²	92	106.6 Å²	106.6	76%	0.76	68%	0.676	S	S	*	*			trans	-69.5	83.7	177.9	0	0	0	0	0	110.3	M205 C209	M205-A207 PolarHBondContact O-N 3.24Å; M205-A207 VanDerWaalsContact O-N 3.17Å; A207-C209 PolarHBondContact O-N 2.81Å
208	V	41.6	Very low	45.6	Very low	124 Å²	124	109.7 Å²	109.7	75%	0.752	69%	0.689	S	S	*	*			trans	-87.4	87.6	156.2	-175	0	0	0	0	106.3	P206 S210	P206-V208 VanDerWaalsContact C-N 3.29Å; P206-V208 PolarHBondContact O-N 3.08Å; V208-S210 PolarHBondContact O-N 2.83Å
209	C	37.4	Very low	45.7	Very low	117 Å²	117	113.8 Å²	113.8	79%	0.791	71%	0.711	S	S	*	*			trans	-65.3	99.3	174.3	-65.4	0	0	0	0	109.5	A207	A207-C209 PolarHBondContact O-N 2.81Å
210	S	38	Very low	45.7	Very low	93 Å²	93	112.4 Å²	112.4	65%	0.65	72%	0.721	S	S	*	*			trans	-101.3	119.3	155.8	-72.5	0	0	0	0	108.2	V208 G212	V208-S210 PolarHBondContact O-N 2.83Å; S210-G212 PolarHBondContact O-N 3.19Å
211	P	42.4	Very low	45.1	Very low	140 Å²	140	114.6 Å²	114.6	91%	0.909	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.1	108.9	178.1	28	-28.7	0	0	0	109
212	G	46.8	Very low	45	Very low	78 Å²	78	115 Å²	115	80%	0.804	76%	0.755	S	S	*	*	T	Hydrogen-bonded Turn	trans	148.8	-3.8	170.7	0	0	0	0	0	118.1	S210	S210-G212 PolarHBondContact O-N 3.19Å
213	M	45.2	Very low	44.6	Very low	180 Å²	180	117.7 Å²	117.7	89%	0.887	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-101	120.2	176.2	-87	180	174.9	0	0	112.2
214	V	47.2	Very low	44.2	Very low	126 Å²	126	120.1 Å²	120.1	76%	0.764	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-65.1	131.3	164.7	-73	0	0	0	0	109.2	V216	V214-V216 PolarHBondContact O-N 2.82Å
215	P	46.6	Very low	43.7	Very low	130 Å²	130	121.9 Å²	121.9	84%	0.844	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-68.7	119	178.2	-11.3	25.6	0	0	0	109.4
216	V	46.9	Very low	43.4	Very low	130 Å²	130	122.3 Å²	122.3	79%	0.788	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-76.6	121.8	165.6	177.4	0	0	0	0	107.3	V214 L218	V214-V216 PolarHBondContact O-N 2.82Å; V216-L218 PolarHBondContact O-N 2.78Å; V216-L218 VanDerWaalsContact O-N 3.1Å
217	A	40.9	Very low	43.6	Very low	97 Å²	97	121.9 Å²	121.9	80%	0.802	79%	0.791	S	S	*	*			trans	-62.4	109.8	176.3	0	0	0	0	0	110.1
218	L	48.3	Very low	44.1	Very low	160 Å²	160	128.1 Å²	128.1	84%	0.838	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-75.7	136.1	164.4	-82.3	154.7	0	0	0	108.5	V216	V216-L218 PolarHBondContact O-N 2.78Å; V216-L218 VanDerWaalsContact O-N 3.1Å
219	P	48.5	Very low	44.8	Very low	106 Å²	106	124.4 Å²	124.4	69%	0.688	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-61.2	147.4	177.4	25.9	-32.2	0	0	0	110.1	A221	P219-A221 PolarHBondContact O-N 2.79Å; P219-A221 VanDerWaalsContact O-N 3.14Å
220	P	48.1	Very low	46.1	Very low	127 Å²	127	120.1 Å²	120.1	83%	0.825	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-57.8	122.9	-178.6	23	-31.7	0	0	0	109.6	A222	P220-A222 PolarHBondContact O-N 2.88Å
221	A	42.6	Very low	48	Very low	96 Å²	96	123.9 Å²	123.9	79%	0.793	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-57.6	127.6	167.4	0	0	0	0	0	107.7	P219 V223	P219-A221 PolarHBondContact O-N 2.79Å; P219-A221 VanDerWaalsContact O-N 3.14Å; A221-V223 PolarHBondContact O-N 3.05Å; A221-V223 VanDerWaalsContact O-N 3.09Å
222	A	43.6	Very low	49.9	Very low	93 Å²	93	124.7 Å²	124.7	77%	0.769	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-46.1	119.9	178.9	0	0	0	0	0	109.7	P220 N224	P220-A222 PolarHBondContact O-N 2.88Å; A222-N224 VanDerWaalsContact C-N 3.32Å; A222-N224 PolarHBondContact O-N 3.08Å
223	V	42.3	Very low	51.5	Low	146 Å²	146	123 Å²	123	89%	0.885	72%	0.717	S	S	*	*			trans	-52.9	100.5	168.1	-98.4	0	0	0	0	107.3	A221 A225	A221-V223 PolarHBondContact O-N 3.05Å; A221-V223 VanDerWaalsContact O-N 3.09Å; V223-A225 PolarHBondContact O-N 3.1Å
224	N	40.8	Very low	53.4	Low	163 Å²	163	114.9 Å²	114.9	87%	0.872	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-62.8	121.5	173.4	-131	-13.7	0	0	0	106.3	A222 Q226	A222-N224 VanDerWaalsContact C-N 3.32Å; A222-N224 PolarHBondContact O-N 3.08Å; N224-Q226 PolarHBondContact O-N 2.64Å
225	A	39.9	Very low	55.2	Low	88 Å²	88	115.3 Å²	115.3	73%	0.727	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-48.5	122.4	-171.4	0	0	0	0	0	110.5	V223	V223-A225 PolarHBondContact O-N 3.1Å
226	Q	40.8	Very low	57.1	Low	170 Å²	170	110.6 Å²	110.6	79%	0.794	64%	0.64	S	S	*	*	P	Polyproline II helix	trans	-48.8	141.3	161.8	-72.2	177.8	-71.8	0	0	107.9	N224 R228	N224-Q226 PolarHBondContact O-N 2.64Å; Q226-R228 VanDerWaalsContact C-N 3.26Å; Q226-R228 PolarHBondContact O-N 2.81Å
227	P	49.1	Very low	59	Low	103 Å²	103	104.4 Å²	104.4	67%	0.669	60%	0.603	S	S	*	*			trans	-60.1	101.8	170.1	13.6	-8.9	0	0	0	105.7	C229	P227-C229 PolarHBondContact O-N 2.97Å
228	R	50.2	Low	61.2	Low	224 Å²	224	102.9 Å²	102.9	85%	0.845	58%	0.579	S	S	*	*			trans	-61.9	109.9	173.1	-77.7	-178	170.4	159.3	-2.4	103.9	Q226 S230	Q226-R228 VanDerWaalsContact C-N 3.26Å; Q226-R228 PolarHBondContact O-N 2.81Å; R228-S230 PolarHBondContact O-N 3.26Å
229	C	55.6	Low	63.1	Low	45 Å²	45	101 Å²	101	30%	0.304	57%	0.57	S	S	.	*			trans	-41.3	98	155.4	172.1	0	0	0	0	105.7	P227 L253	P227-C229 PolarHBondContact O-N 2.97Å; C229-L253 HydrophobicContact CB-CD2 3.89Å; C229-L253 WeakPolarHBondContact SG-CD2 3.2Å
230	S	65.4	Low	64.9	Low	27 Å²	27	101 Å²	101	19%	0.189	56%	0.562	C	S	.	*			trans	-79.4	140.4	-170.1	72	0	0	0	0	106.6	R228 E232 D233 L234	R228-S230 PolarHBondContact O-N 3.26Å; S230-E232 PolarHBondContact O-N 3.05Å; S230-E232 VanDerWaalsContact O-N 3.08Å; S230-D233 PolarHBondContact O-N 2.63Å; S230-D233 PolarHBondContact OG-N 2.83Å; S230-D233 VanDerWaalsContact OG-N 3.09Å; S230-D233 PolarHBondContact OG-OD2 2.81Å; S230-L234 PolarHBondContact O-N 3.33Å
231	E	77.1	Confident	66.7	Low	173 Å²	173	96.5 Å²	96.5	81%	0.808	53%	0.529	S	S	*	.	H	α-helix	trans	-57.4	-23.7	175.3	-162.1	168	-178.7	0	0	111	K235	E231-K235 WeakPolarHBondContact O-CB 3.45Å; E231-K235 PolarHBondContact O-N 2.91Å
232	E	81.4	Confident	68.7	Low	156 Å²	156	96.8 Å²	96.8	73%	0.729	52%	0.523	S	S	*	.	H	α-helix	trans	-65.7	-44.9	171.9	-60.6	164.1	179.7	0	0	112.5	S230 K235 A236	S230-E232 PolarHBondContact O-N 3.05Å; S230-E232 VanDerWaalsContact O-N 3.08Å; E232-K235 PolarHBondContact O-N 2.79Å; E232-A236 WeakPolarHBondContact O-CB 3.45Å; E232-A236 PolarHBondContact O-N 2.81Å
233	D	81.8	Confident	70.6	Confident	43 Å²	43	100.3 Å²	100.3	23%	0.23	53%	0.529	C	S	.	.	H	α-helix	trans	-65.5	-41.5	176.2	-69	-47.3	0	0	0	111.6	S230 K235 A236 I237 L253	S230-D233 PolarHBondContact O-N 2.63Å; S230-D233 PolarHBondContact OG-N 2.83Å; S230-D233 VanDerWaalsContact OG-N 3.09Å; S230-D233 PolarHBondContact OG-OD2 2.81Å; D233-K235 VanDerWaalsContact C-N 3.35Å; D233-K235 PolarHBondContact O-N 3.12Å; D233-A236 PolarHBondContact O-N 2.73Å; D233-I237 WeakPolarHBondContact O-CG1 3.38Å; D233-I237 PolarHBondContact O-N 3.21Å; D233-L253 HydrophobicContact CB-CD2 4.39Å
234	L	84.7	Confident	72.5	Confident	9 Å²	9	95.4 Å²	95.4	5%	0.047	50%	0.497	C	S	.	.	H	α-helix	trans	-58.8	-46.8	175.6	-103.5	165.8	0	0	0	111.5	S230 I237 Q238 I249 R250	S230-L234 PolarHBondContact O-N 3.33Å; L234-I237 PolarHBondContact O-N 3.16Å; L234-Q238 WeakPolarHBondContact O-CB 3.4Å; L234-Q238 PolarHBondContact O-N 2.88Å; L234-I249 HydrophobicContact CD2-CB 4.25Å; L234-I249 HydrophobicContact CD2-CG2 3.8Å; L234-R250 HydrophobicContact CD1-CB 4.47Å; L234-R250 HydrophobicContact CD1-CG 4.48Å; L234-R250 HydrophobicContact CD2-CB 4.03Å
235	K	84.8	Confident	74.7	Confident	135 Å²	135	93.5 Å²	93.5	59%	0.587	49%	0.487	S	S	*	.	H	α-helix	trans	-65.3	-42.3	178.1	-168.3	176.2	-178.6	-179.6	0	112.1	E231 E232 D233 I237 Q238 D239	E231-K235 WeakPolarHBondContact O-CB 3.45Å; E231-K235 PolarHBondContact O-N 2.91Å; E232-K235 PolarHBondContact O-N 2.79Å; D233-K235 VanDerWaalsContact C-N 3.35Å; D233-K235 PolarHBondContact O-N 3.12Å; K235-I237 VanDerWaalsContact C-N 3.33Å; K235-I237 PolarHBondContact O-N 3.26Å; K235-Q238 PolarHBondContact O-N 2.87Å; K235-D239 PolarHBondContact O-N 3.04Å
236	A	86.7	Confident	76.9	Confident	31 Å²	31	93.9 Å²	93.9	26%	0.256	47%	0.474	S	S	.	.	H	α-helix	trans	-63.3	-37	179	0	0	0	0	0	112.9	E232 D233 M240	E232-A236 WeakPolarHBondContact O-CB 3.45Å; E232-A236 PolarHBondContact O-N 2.81Å; D233-A236 PolarHBondContact O-N 2.73Å; A236-M240 WeakPolarHBondContact O-CG 3.49Å; A236-M240 PolarHBondContact O-N 2.96Å
237	I	86.2	Confident	79	Confident	0 Å²	0	93.4 Å²	93.4	0%	0	47%	0.472	C	S	.	.	H	α-helix	trans	-76.7	-35.4	176.5	-61.6	174.8	0	0	0	110.9	D233 L234 K235 D239 M240 F241 I249 L253 K260 A263 I264 L267	D233-I237 WeakPolarHBondContact O-CG1 3.38Å; D233-I237 PolarHBondContact O-N 3.21Å; L234-I237 PolarHBondContact O-N 3.16Å; K235-I237 VanDerWaalsContact C-N 3.33Å; K235-I237 PolarHBondContact O-N 3.26Å; I237-D239 VanDerWaalsContact C-N 3.29Å; I237-D239 PolarHBondContact O-N 3.08Å; I237-M240 WeakPolarHBondContact O-CB 3.34Å; I237-M240 PolarHBondContact O-N 2.81Å; I237-F241 HydrophobicContact CG2-CD2 3.86Å; I237-F241 HydrophobicContact CG2-CE2 4.29Å; I237-F241 PolarHBondContact O-N 2.95Å; I237-I249 HydrophobicContact CB-CG2 3.81Å; I237-I249 HydrophobicContact CG2-CD1 4.35Å; I237-I249 HydrophobicContact CG2-CG1 4.4Å; I237-I249 HydrophobicContact CG2-CG2 3.54Å; I237-L253 HydrophobicContact CD1-CD1 3.18Å; I237-K260 HydrophobicContact CD1-CG 4.21Å; I237-K260 HydrophobicContact CG1-CG 4.36Å; I237-A263 HydrophobicContact CD1-CB 4.18Å; I237-I264 HydrophobicContact CG1-CG1 4.39Å; I237-L267 HydrophobicContact CG2-CD1 3.37Å
238	Q	87.4	Confident	80.8	Confident	66 Å²	66	91 Å²	91	31%	0.308	46%	0.455	S	S	.	.	H	α-helix	trans	-60.8	-38.5	173.4	-173.1	172.3	38.3	0	0	112.1	L234 K235 M240 F241 I249	L234-Q238 WeakPolarHBondContact O-CB 3.4Å; L234-Q238 PolarHBondContact O-N 2.88Å; K235-Q238 PolarHBondContact O-N 2.87Å; Q238-M240 VanDerWaalsContact C-N 3.26Å; Q238-M240 PolarHBondContact O-N 3.29Å; Q238-F241 CarbonylContact O-C 3.53Å; Q238-F241 PolarHBondContact O-N 3.12Å; Q238-I249 HydrophobicContact CB-CD1 4.07Å; Q238-I249 HydrophobicContact CG-CD1 4.47Å
239	D	88.5	Confident	82.6	Confident	121 Å²	121	80.3 Å²	80.3	65%	0.647	42%	0.415	S	S	*	.	H	α-helix	trans	-65.3	-28.1	174.2	-72.1	-17.2	0	0	0	112.5	K235 I237	K235-D239 PolarHBondContact O-N 3.04Å; I237-D239 VanDerWaalsContact C-N 3.29Å; I237-D239 PolarHBondContact O-N 3.08Å
240	M	86.1	Confident	84.1	Confident	105 Å²	105	83.8 Å²	83.8	52%	0.517	42%	0.421	S	S	.	.	H	α-helix	trans	-81.7	-31.7	176.4	-67.7	178.5	66.9	0	0	113.2	A236 I237 Q238 P242 I264	A236-M240 WeakPolarHBondContact O-CG 3.49Å; A236-M240 PolarHBondContact O-N 2.96Å; I237-M240 WeakPolarHBondContact O-CB 3.34Å; I237-M240 PolarHBondContact O-N 2.81Å; Q238-M240 VanDerWaalsContact C-N 3.26Å; Q238-M240 PolarHBondContact O-N 3.29Å; M240-P242 VanDerWaalsContact C-CD 3.44Å; M240-P242 WeakPolarHBondContact O-CD 3.22Å; M240-I264 HydrophobicContact CE-CD1 4.04Å; M240-I264 HydrophobicContact CE-CG1 4.33Å; M240-I264 HydrophobicContact CE-CG2 4.06Å; M240-I264 HydrophobicContact SD-CD1 3.9Å; M240-I264 HydrophobicContact SD-CG1 4.34Å
241	F	86.6	Confident	85	Confident	32 Å²	32	86 Å²	86	14%	0.14	44%	0.437	C	S	.	.			trans	-124.1	67.8	-177.6	-62.7	-89.6	0	0	0	111.1	I237 Q238 N243 M244 I264 L267 L268	I237-F241 HydrophobicContact CG2-CD2 3.86Å; I237-F241 HydrophobicContact CG2-CE2 4.29Å; I237-F241 PolarHBondContact O-N 2.95Å; Q238-F241 CarbonylContact O-C 3.53Å; Q238-F241 PolarHBondContact O-N 3.12Å; F241-N243 PolarHBondContact O-N 3.06Å; F241-N243 VanDerWaalsContact O-N 3.08Å; F241-M244 HydrophobicContact CB-CB 3.88Å; F241-M244 PolarHBondContact O-N 2.92Å; F241-I264 HydrophobicContact CE2-CG2 4.37Å; F241-I264 HydrophobicContact CZ-CG2 4.4Å; F241-L267 HydrophobicContact CD1-CB 4.34Å; F241-L267 HydrophobicContact CD2-CB 4.33Å; F241-L267 HydrophobicContact CD2-CD1 4.05Å; F241-L267 HydrophobicContact CE1-CB 3.94Å; F241-L267 HydrophobicContact CE2-CB 3.95Å; F241-L267 HydrophobicContact CE2-CD1 4.13Å; F241-L267 HydrophobicContact CZ-CB 3.73Å; F241-L268 HydrophobicContact CE1-CD2 3.9Å; F241-L268 HydrophobicContact CE1-CG 4.28Å; F241-L268 HydrophobicContact CZ-CD2 3.87Å; F241-L268 HydrophobicContact CZ-CG 3.92Å
242	P	83.7	Confident	85.5	Confident	103 Å²	103	78.3 Å²	78.3	67%	0.669	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-18.4	-177.3	25.8	-35.2	0	0	0	113.7	M240	M240-P242 VanDerWaalsContact C-CD 3.44Å; M240-P242 WeakPolarHBondContact O-CD 3.22Å
243	N	82.9	Confident	85.7	Confident	166 Å²	166	70.9 Å²	70.9	89%	0.888	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-1.6	178.1	-61.9	-16.7	0	0	0	113.3	F241	F241-N243 PolarHBondContact O-N 3.06Å; F241-N243 VanDerWaalsContact O-N 3.08Å
244	M	82.9	Confident	85.8	Confident	44 Å²	44	74.8 Å²	74.8	22%	0.217	38%	0.384	C	S	.	.	S	Bend	trans	-108.5	135.6	-175	-164.5	68.6	69.7	0	0	111.2	F241 V248 I249 L267 M270	F241-M244 HydrophobicContact CB-CB 3.88Å; F241-M244 PolarHBondContact O-N 2.92Å; M244-V248 HydrophobicContact CG-CB 4.08Å; M244-V248 HydrophobicContact CG-CG1 4Å; M244-V248 HydrophobicContact SD-CB 4.27Å; M244-V248 HydrophobicContact SD-CG1 3.85Å; M244-I249 HydrophobicContact CB-CD1 4.42Å; M244-I249 HydrophobicContact CB-CG1 4.38Å; M244-I249 HydrophobicContact CG-CG1 4.15Å; M244-L267 HydrophobicContact CE-CD2 4.46Å; M244-L267 HydrophobicContact CG-CD2 4.15Å; M244-M270 HydrophobicContact CE-CB 4.47Å
245	D	87	Confident	85.7	Confident	123 Å²	123	77.9 Å²	77.9	66%	0.658	41%	0.411	S	S	*	.			trans	-62.7	139.6	178.9	-79.5	-49.5	0	0	0	112.2	E247 V248 I249	D245-E247 PolarHBondContact O-N 2.92Å; D245-V248 HydrophobicContact CB-CG2 4.03Å; D245-V248 WeakPolarHBondContact O-CB 3.37Å; D245-V248 PolarHBondContact O-N 2.88Å; D245-I249 PolarHBondContact O-N 2.97Å; D245-I249 VanDerWaalsContact O-N 3.15Å
246	Q	86.1	Confident	85.7	Confident	95 Å²	95	74.9 Å²	74.9	44%	0.444	40%	0.398	S	S	.	.	H	α-helix	trans	-59.4	-31.4	-178.7	-168.3	178.7	-1.3	0	0	112.5	R250	Q246-R250 WeakPolarHBondContact O-CB 3.47Å; Q246-R250 PolarHBondContact O-N 3.37Å
247	E	85.3	Confident	85.4	Confident	161 Å²	161	83.9 Å²	83.9	75%	0.752	43%	0.426	S	S	*	.	H	α-helix	trans	-67.9	-36.9	175.3	-66.2	-166.8	160.5	0	0	112.4	D245 R250 S251	D245-E247 PolarHBondContact O-N 2.92Å; E247-R250 PolarHBondContact O-N 2.85Å; E247-S251 VanDerWaalsContact O-CB 3.31Å; E247-S251 WeakPolarHBondContact O-CB 3.16Å; E247-S251 PolarHBondContact O-N 3.32Å
248	V	86.9	Confident	84.8	Confident	51 Å²	51	84.9 Å²	84.9	31%	0.309	44%	0.436	S	S	.	.	H	α-helix	trans	-66	-46.1	176.2	178.1	0	0	0	0	109.6	M244 D245 R250 S251 V252 L267	M244-V248 HydrophobicContact CG-CB 4.08Å; M244-V248 HydrophobicContact CG-CG1 4Å; M244-V248 HydrophobicContact SD-CB 4.27Å; M244-V248 HydrophobicContact SD-CG1 3.85Å; D245-V248 HydrophobicContact CB-CG2 4.03Å; D245-V248 WeakPolarHBondContact O-CB 3.37Å; D245-V248 PolarHBondContact O-N 2.88Å; V248-R250 VanDerWaalsContact C-N 3.33Å; V248-R250 PolarHBondContact O-N 3.12Å; V248-S251 PolarHBondContact O-N 2.53Å; V248-V252 HydrophobicContact CG1-CG2 4.45Å; V248-V252 WeakPolarHBondContact O-CG2 3.19Å; V248-V252 PolarHBondContact O-N 3.17Å; V248-L267 HydrophobicContact CG1-CD2 4.27Å
249	I	87.2	Confident	84.5	Confident	1 Å²	1	85.7 Å²	85.7	1%	0.005	44%	0.442	C	S	.	.	H	α-helix	trans	-59.5	-45.6	177	-60.3	174.4	0	0	0	110.6	L234 I237 Q238 M244 D245 V252 L253 L267	L234-I249 HydrophobicContact CD2-CB 4.25Å; L234-I249 HydrophobicContact CD2-CG2 3.8Å; I237-I249 HydrophobicContact CB-CG2 3.81Å; I237-I249 HydrophobicContact CG2-CD1 4.35Å; I237-I249 HydrophobicContact CG2-CG1 4.4Å; I237-I249 HydrophobicContact CG2-CG2 3.54Å; Q238-I249 HydrophobicContact CB-CD1 4.07Å; Q238-I249 HydrophobicContact CG-CD1 4.47Å; M244-I249 HydrophobicContact CB-CD1 4.42Å; M244-I249 HydrophobicContact CB-CG1 4.38Å; M244-I249 HydrophobicContact CG-CG1 4.15Å; D245-I249 PolarHBondContact O-N 2.97Å; D245-I249 VanDerWaalsContact O-N 3.15Å; I249-V252 PolarHBondContact O-N 3.13Å; I249-L253 PolarHBondContact O-N 3.46Å; I249-L267 HydrophobicContact CG1-CD1 4.26Å; I249-L267 HydrophobicContact CG2-CD1 4.47Å
250	R	86.6	Confident	84.3	Confident	118 Å²	118	83.4 Å²	83.4	45%	0.445	43%	0.427	S	S	.	.	H	α-helix	trans	-60.4	-47.8	176.8	-179.5	-179.5	-90.2	150.4	-7	111.3	L234 Q246 E247 V248 V252 L253 E254	L234-R250 HydrophobicContact CD1-CB 4.47Å; L234-R250 HydrophobicContact CD1-CG 4.48Å; L234-R250 HydrophobicContact CD2-CB 4.03Å; Q246-R250 WeakPolarHBondContact O-CB 3.47Å; Q246-R250 PolarHBondContact O-N 3.37Å; E247-R250 PolarHBondContact O-N 2.85Å; V248-R250 VanDerWaalsContact C-N 3.33Å; V248-R250 PolarHBondContact O-N 3.12Å; R250-V252 VanDerWaalsContact C-N 3.34Å; R250-V252 PolarHBondContact O-N 3.13Å; R250-L253 PolarHBondContact O-N 2.99Å; R250-E254 HydrophobicContact CG-CG 4.47Å; R250-E254 WeakPolarHBondContact O-CB 3.39Å; R250-E254 WeakPolarHBondContact O-CG 3.42Å; R250-E254 PolarHBondContact O-N 3.5Å
251	S	85.5	Confident	84.3	Confident	73 Å²	73	83.9 Å²	83.9	51%	0.51	43%	0.431	S	S	.	.	H	α-helix	trans	-59.2	-43.9	179.1	178.1	0	0	0	0	112	E247 V248 E254 A255	E247-S251 VanDerWaalsContact O-CB 3.31Å; E247-S251 WeakPolarHBondContact O-CB 3.16Å; E247-S251 PolarHBondContact O-N 3.32Å; V248-S251 PolarHBondContact O-N 2.53Å; S251-E254 PolarHBondContact O-N 2.99Å; S251-A255 WeakPolarHBondContact O-CB 3.19Å; S251-A255 PolarHBondContact O-N 2.98Å
252	V	87.3	Confident	84.2	Confident	11 Å²	11	83.5 Å²	83.5	7%	0.067	43%	0.434	C	S	.	.	H	α-helix	trans	-66.1	-41.4	177.3	175.2	0	0	0	0	111	V248 I249 R250 E254 A255 Q256 A263 L267 M270	V248-V252 HydrophobicContact CG1-CG2 4.45Å; V248-V252 WeakPolarHBondContact O-CG2 3.19Å; V248-V252 PolarHBondContact O-N 3.17Å; I249-V252 PolarHBondContact O-N 3.13Å; R250-V252 VanDerWaalsContact C-N 3.34Å; R250-V252 PolarHBondContact O-N 3.13Å; V252-E254 VanDerWaalsContact C-N 3.34Å; V252-E254 PolarHBondContact O-N 3.03Å; V252-A255 PolarHBondContact O-N 2.88Å; V252-Q256 HydrophobicContact CG1-CG 4.41Å; V252-Q256 WeakPolarHBondContact O-CB 3.44Å; V252-Q256 VanDerWaalsContact O-CG 3.31Å; V252-Q256 WeakPolarHBondContact O-CG 2.86Å; V252-Q256 PolarHBondContact O-N 2.85Å; V252-A263 HydrophobicContact CG1-CB 3.9Å; V252-L267 HydrophobicContact CB-CD2 4.42Å; V252-L267 HydrophobicContact CG1-CG 4.26Å; V252-L267 HydrophobicContact CG2-CD2 3.98Å; V252-L267 HydrophobicContact CG2-CG 4.48Å; V252-M270 HydrophobicContact CG2-CE 4.29Å; V252-M270 HydrophobicContact CG2-SD 4.28Å
253	L	85.6	Confident	84.4	Confident	0 Å²	0	78.6 Å²	78.6	0%	0	40%	0.402	C	S	.	.	H	α-helix	trans	-65.6	-39.4	178.6	-145.8	103.7	0	0	0	112.1	C229 D233 I237 I249 R250 Q256 R257 G258 A263	C229-L253 HydrophobicContact CB-CD2 3.89Å; C229-L253 WeakPolarHBondContact SG-CD2 3.2Å; D233-L253 HydrophobicContact CB-CD2 4.39Å; I237-L253 HydrophobicContact CD1-CD1 3.18Å; I249-L253 PolarHBondContact O-N 3.46Å; R250-L253 PolarHBondContact O-N 2.99Å; L253-Q256 CarbonylContact O-C 3.49Å; L253-Q256 PolarHBondContact O-N 3.21Å; L253-R257 PolarHBondContact O-N 2.88Å; L253-R257 VanDerWaalsContact O-N 3.12Å; L253-G258 PolarHBondContact O-N 2.83Å; L253-A263 HydrophobicContact CD1-CB 3.87Å
254	E	83.5	Confident	84.6	Confident	126 Å²	126	71.8 Å²	71.8	59%	0.589	37%	0.366	S	S	*	.	H	α-helix	trans	-64.1	-44.5	174.4	-76.1	178.7	-173.2	0	0	111.3	R250 S251 V252 Q256 R257	R250-E254 HydrophobicContact CG-CG 4.47Å; R250-E254 WeakPolarHBondContact O-CB 3.39Å; R250-E254 WeakPolarHBondContact O-CG 3.42Å; R250-E254 PolarHBondContact O-N 3.5Å; S251-E254 PolarHBondContact O-N 2.99Å; V252-E254 VanDerWaalsContact C-N 3.34Å; V252-E254 PolarHBondContact O-N 3.03Å; E254-Q256 VanDerWaalsContact C-N 3.25Å; E254-Q256 PolarHBondContact O-N 3.43Å; E254-R257 PolarHBondContact O-N 3.29Å
255	A	83.2	Confident	84.8	Confident	74 Å²	74	74.1 Å²	74.1	61%	0.612	38%	0.379	S	S	*	.	H	α-helix	trans	-60	-36.9	175.5	0	0	0	0	0	112.1	S251 V252 R257	S251-A255 WeakPolarHBondContact O-CB 3.19Å; S251-A255 PolarHBondContact O-N 2.98Å; V252-A255 PolarHBondContact O-N 2.88Å; A255-R257 VanDerWaalsContact C-N 3.29Å; A255-R257 PolarHBondContact O-N 2.85Å
256	Q	84.1	Confident	84.8	Confident	71 Å²	71	69.7 Å²	69.7	33%	0.332	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	11.4	177.5	-59.8	-59.5	-11.5	0	0	113.8	V252 L253 E254 G258 N259 A262 A263 S266	V252-Q256 HydrophobicContact CG1-CG 4.41Å; V252-Q256 WeakPolarHBondContact O-CB 3.44Å; V252-Q256 VanDerWaalsContact O-CG 3.31Å; V252-Q256 WeakPolarHBondContact O-CG 2.86Å; V252-Q256 PolarHBondContact O-N 2.85Å; L253-Q256 CarbonylContact O-C 3.49Å; L253-Q256 PolarHBondContact O-N 3.21Å; E254-Q256 VanDerWaalsContact C-N 3.25Å; E254-Q256 PolarHBondContact O-N 3.43Å; Q256-G258 PolarHBondContact O-N 2.87Å; Q256-N259 HydrophobicContact CB-CB 4.41Å; Q256-N259 VanDerWaalsContact O-CB 3.27Å; Q256-N259 WeakPolarHBondContact O-CB 3.17Å; Q256-N259 PolarHBondContact O-N 2.58Å; Q256-A262 HydrophobicContact CB-CB 4.11Å; Q256-A262 HydrophobicContact CG-CB 3.99Å; Q256-A263 HydrophobicContact CG-CB 4.44Å; Q256-S266 PolarHBondContact NE2-OG 2.99Å
257	R	81.8	Confident	84.8	Confident	221 Å²	221	65.1 Å²	65.1	83%	0.834	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.8	36.8	177.9	-56.8	-177.3	176.9	-134.5	-0.6	113.7	L253 E254 A255	L253-R257 PolarHBondContact O-N 2.88Å; L253-R257 VanDerWaalsContact O-N 3.12Å; E254-R257 PolarHBondContact O-N 3.29Å; A255-R257 VanDerWaalsContact C-N 3.29Å; A255-R257 PolarHBondContact O-N 2.85Å
258	G	72.5	Confident	84.8	Confident	21 Å²	21	61.6 Å²	61.6	22%	0.216	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.3	7.7	-179.2	0	0	0	0	0	114.9	L253 Q256 K260	L253-G258 PolarHBondContact O-N 2.83Å; Q256-G258 PolarHBondContact O-N 2.87Å; G258-K260 PolarHBondContact O-N 2.96Å
259	N	82.3	Confident	84.6	Confident	82 Å²	82	66.3 Å²	66.3	44%	0.439	34%	0.341	S	S	.	.			trans	-77.3	102	174.3	-173.5	-27.8	0	0	0	110.8	Q256 D261 A262 A263	Q256-N259 HydrophobicContact CB-CB 4.41Å; Q256-N259 VanDerWaalsContact O-CB 3.27Å; Q256-N259 WeakPolarHBondContact O-CB 3.17Å; Q256-N259 PolarHBondContact O-N 2.58Å; N259-D261 PolarHBondContact O-N 2.81Å; N259-D261 PolarHBondContact OD1-N 3.27Å; N259-A262 HydrophobicContact CB-CB 3.97Å; N259-A262 PolarHBondContact O-N 3.16Å; N259-A262 PolarHBondContact OD1-N 3Å; N259-A262 VanDerWaalsContact OD1-N 3.11Å; N259-A263 WeakPolarHBondContact O-CB 3.43Å; N259-A263 PolarHBondContact O-N 2.84Å
260	K	84	Confident	84	Confident	73 Å²	73	71.6 Å²	71.6	32%	0.317	37%	0.367	S	S	.	.	H	α-helix	trans	-57.5	-44.9	180	177.5	172.3	175.5	174.8	0	113.6	I237 G258 A263 I264	I237-K260 HydrophobicContact CD1-CG 4.21Å; I237-K260 HydrophobicContact CG1-CG 4.36Å; G258-K260 PolarHBondContact O-N 2.96Å; K260-A263 PolarHBondContact O-N 2.93Å; K260-I264 HydrophobicContact CG-CD1 3.87Å; K260-I264 VanDerWaalsContact O-CG1 3.3Å; K260-I264 WeakPolarHBondContact O-CG1 3.37Å; K260-I264 PolarHBondContact O-N 2.88Å
261	D	85.2	Confident	83.1	Confident	115 Å²	115	68.6 Å²	68.6	62%	0.615	37%	0.373	S	S	*	.	H	α-helix	trans	-68	-38.8	-177.8	-63.1	-42.7	0	0	0	111.7	N259 N265	N259-D261 PolarHBondContact O-N 2.81Å; N259-D261 PolarHBondContact OD1-N 3.27Å; D261-N265 PolarHBondContact O-N 2.98Å; D261-N265 VanDerWaalsContact O-N 3.15Å; D261-N265 PolarHBondContact O-ND2 3.33Å
262	A	86	Confident	81.9	Confident	24 Å²	24	73.1 Å²	73.1	20%	0.198	39%	0.386	C	S	.	.	H	α-helix	trans	-65.8	-40.1	173.8	0	0	0	0	0	111.4	Q256 N259 N265 S266	Q256-A262 HydrophobicContact CB-CB 4.11Å; Q256-A262 HydrophobicContact CG-CB 3.99Å; N259-A262 HydrophobicContact CB-CB 3.97Å; N259-A262 PolarHBondContact O-N 3.16Å; N259-A262 PolarHBondContact OD1-N 3Å; N259-A262 VanDerWaalsContact OD1-N 3.11Å; A262-N265 PolarHBondContact O-N 2.75Å; A262-S266 PolarHBondContact O-N 2.84Å; A262-S266 PolarHBondContact O-OG 2.87Å
263	A	86.6	Confident	79.9	Confident	0 Å²	0	81.1 Å²	81.1	0%	0	42%	0.423	C	S	.	.	H	α-helix	trans	-64.4	-42.9	177.3	0	0	0	0	0	112.4	I237 V252 L253 Q256 N259 K260 N265 S266 L267	I237-A263 HydrophobicContact CD1-CB 4.18Å; V252-A263 HydrophobicContact CG1-CB 3.9Å; L253-A263 HydrophobicContact CD1-CB 3.87Å; Q256-A263 HydrophobicContact CG-CB 4.44Å; N259-A263 WeakPolarHBondContact O-CB 3.43Å; N259-A263 PolarHBondContact O-N 2.84Å; K260-A263 PolarHBondContact O-N 2.93Å; A263-N265 PolarHBondContact O-N 3.19Å; A263-S266 PolarHBondContact O-N 2.75Å; A263-L267 WeakPolarHBondContact O-CG 3.46Å; A263-L267 PolarHBondContact O-N 3.25Å
264	I	87.3	Confident	77.8	Confident	24 Å²	24	90.5 Å²	90.5	12%	0.123	48%	0.483	C	S	.	.	H	α-helix	trans	-60.6	-46	175.8	-68.8	163.8	0	0	0	110.8	I237 M240 F241 K260 S266 L267 L268	I237-I264 HydrophobicContact CG1-CG1 4.39Å; M240-I264 HydrophobicContact CE-CD1 4.04Å; M240-I264 HydrophobicContact CE-CG1 4.33Å; M240-I264 HydrophobicContact CE-CG2 4.06Å; M240-I264 HydrophobicContact SD-CD1 3.9Å; M240-I264 HydrophobicContact SD-CG1 4.34Å; F241-I264 HydrophobicContact CE2-CG2 4.37Å; F241-I264 HydrophobicContact CZ-CG2 4.4Å; K260-I264 HydrophobicContact CG-CD1 3.87Å; K260-I264 VanDerWaalsContact O-CG1 3.3Å; K260-I264 WeakPolarHBondContact O-CG1 3.37Å; K260-I264 PolarHBondContact O-N 2.88Å; I264-S266 VanDerWaalsContact C-N 3.33Å; I264-S266 PolarHBondContact O-N 2.79Å; I264-L267 PolarHBondContact O-N 3.31Å; I264-L268 HydrophobicContact CG2-CD1 4.18Å; I264-L268 HydrophobicContact CG2-CG 4.49Å; I264-L268 WeakPolarHBondContact O-CG 2.81Å; I264-L268 PolarHBondContact O-N 3.22Å
265	N	86.7	Confident	77.5	Confident	93 Å²	93	88.7 Å²	88.7	50%	0.497	48%	0.478	S	S	.	.	H	α-helix	trans	-62.9	-38.9	177.9	-75	-47.5	0	0	0	112.5	D261 A262 A263 Q269	D261-N265 PolarHBondContact O-N 2.98Å; D261-N265 VanDerWaalsContact O-N 3.15Å; D261-N265 PolarHBondContact O-ND2 3.33Å; A262-N265 PolarHBondContact O-N 2.75Å; A263-N265 PolarHBondContact O-N 3.19Å; N265-Q269 WeakPolarHBondContact O-CG 3.47Å; N265-Q269 PolarHBondContact O-N 2.67Å
266	S	86.4	Confident	77.2	Confident	29 Å²	29	89.5 Å²	89.5	20%	0.203	47%	0.471	C	S	.	.	H	α-helix	trans	-66	-39.5	174.2	-69.3	0	0	0	0	112.5	Q256 A262 A263 I264 Q269 M270	Q256-S266 PolarHBondContact NE2-OG 2.99Å; A262-S266 PolarHBondContact O-N 2.84Å; A262-S266 PolarHBondContact O-OG 2.87Å; A263-S266 PolarHBondContact O-N 2.75Å; I264-S266 VanDerWaalsContact C-N 3.33Å; I264-S266 PolarHBondContact O-N 2.79Å; S266-Q269 PolarHBondContact O-N 3.4Å; S266-M270 WeakPolarHBondContact O-CG 3.06Å; S266-M270 PolarHBondContact O-N 2.96Å
267	L	87.4	Confident	76.8	Confident	0 Å²	0	90.5 Å²	90.5	0%	0	48%	0.479	C	S	.	.	H	α-helix	trans	-70.8	-36.6	179.3	-72.6	168.8	0	0	0	112.8	I237 F241 M244 V248 I249 V252 A263 I264 Q269 M270 G271	I237-L267 HydrophobicContact CG2-CD1 3.37Å; F241-L267 HydrophobicContact CD1-CB 4.34Å; F241-L267 HydrophobicContact CD2-CB 4.33Å; F241-L267 HydrophobicContact CD2-CD1 4.05Å; F241-L267 HydrophobicContact CE1-CB 3.94Å; F241-L267 HydrophobicContact CE2-CB 3.95Å; F241-L267 HydrophobicContact CE2-CD1 4.13Å; F241-L267 HydrophobicContact CZ-CB 3.73Å; M244-L267 HydrophobicContact CE-CD2 4.46Å; M244-L267 HydrophobicContact CG-CD2 4.15Å; V248-L267 HydrophobicContact CG1-CD2 4.27Å; I249-L267 HydrophobicContact CG1-CD1 4.26Å; I249-L267 HydrophobicContact CG2-CD1 4.47Å; V252-L267 HydrophobicContact CB-CD2 4.42Å; V252-L267 HydrophobicContact CG1-CG 4.26Å; V252-L267 HydrophobicContact CG2-CD2 3.98Å; V252-L267 HydrophobicContact CG2-CG 4.48Å; A263-L267 WeakPolarHBondContact O-CG 3.46Å; A263-L267 PolarHBondContact O-N 3.25Å; I264-L267 PolarHBondContact O-N 3.31Å; L267-Q269 VanDerWaalsContact C-N 3.3Å; L267-Q269 PolarHBondContact O-N 3.18Å; L267-M270 PolarHBondContact O-N 3.29Å; L267-M270 VanDerWaalsContact O-N 3.16Å; L267-G271 PolarHBondContact O-N 2.97Å
268	L	85.8	Confident	76.6	Confident	87 Å²	87	82.8 Å²	82.8	46%	0.455	46%	0.458	S	S	.	.	H	α-helix	trans	-59	-42.6	172.6	-73.5	170.8	0	0	0	111.4	F241 I264 M270 G271	F241-L268 HydrophobicContact CE1-CD2 3.9Å; F241-L268 HydrophobicContact CE1-CG 4.28Å; F241-L268 HydrophobicContact CZ-CD2 3.87Å; F241-L268 HydrophobicContact CZ-CG 3.92Å; I264-L268 HydrophobicContact CG2-CD1 4.18Å; I264-L268 HydrophobicContact CG2-CG 4.49Å; I264-L268 WeakPolarHBondContact O-CG 2.81Å; I264-L268 PolarHBondContact O-N 3.22Å; L268-M270 VanDerWaalsContact C-N 3.26Å; L268-M270 PolarHBondContact O-N 3.28Å; L268-G271 PolarHBondContact O-N 3.45Å
269	Q	82	Confident	76.8	Confident	149 Å²	149	86.7 Å²	86.7	70%	0.696	47%	0.473	S	S	*	.	H	α-helix	trans	-66.3	-27.1	177.6	-70.8	175	12.2	0	0	113.1	N265 S266 L267	N265-Q269 WeakPolarHBondContact O-CG 3.47Å; N265-Q269 PolarHBondContact O-N 2.67Å; S266-Q269 PolarHBondContact O-N 3.4Å; L267-Q269 VanDerWaalsContact C-N 3.3Å; L267-Q269 PolarHBondContact O-N 3.18Å
270	M	73.6	Confident	76.4	Confident	112 Å²	112	87 Å²	87	55%	0.552	48%	0.475	S	S	*	.	H	α-helix	trans	-81.2	-21.1	177.2	-70.1	-179.9	177.2	0	0	113.2	M244 V252 S266 L267 L268	M244-M270 HydrophobicContact CE-CB 4.47Å; V252-M270 HydrophobicContact CG2-CE 4.29Å; V252-M270 HydrophobicContact CG2-SD 4.28Å; S266-M270 WeakPolarHBondContact O-CG 3.06Å; S266-M270 PolarHBondContact O-N 2.96Å; L267-M270 PolarHBondContact O-N 3.29Å; L267-M270 VanDerWaalsContact O-N 3.16Å; L268-M270 VanDerWaalsContact C-N 3.26Å; L268-M270 PolarHBondContact O-N 3.28Å
271	G	68.1	Low	75.9	Confident	56 Å²	56	88 Å²	88	58%	0.577	49%	0.487	S	S	*	.	S	Bend	trans	-92.6	-2.1	-177.9	0	0	0	0	0	115.4	L267 L268	L267-G271 PolarHBondContact O-N 2.97Å; L268-G271 PolarHBondContact O-N 3.45Å
272	E	60.7	Low	75.2	Confident	168 Å²	168	85.9 Å²	85.9	79%	0.785	48%	0.477	S	S	*	.			trans	-98.6	7.4	-177.1	-76.3	-173.4	151.2	0	0	114.4
273	E	45.7	Very low	74.3	Confident	179 Å²	179	91.1 Å²	91.1	84%	0.836	50%	0.5	S	S	*	.			trans	-87.9	129.2	169.4	-103.1	-173	132.6	0	0	111.4
274	P	41.1	Very low	73.2	Confident	196 Å²	196	99.4 Å²	99.4	100%	1.273	55%	0.545	S	S	*	.			trans	-70.8	0	-178.6	29.7	-35.1	0	0	0	114.4

Retrieved 274 of 274 residues in 70.9 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).