A0A093HEB2_STRCA Loading...

E3 ubiquitin-protein ligase RING2

AlphaFold DB , UniProt , Accession A0A093HEB2, Species STRCA (Struthio camelus australis), Gene n/a, Length 336 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.9	Very low	49.5	Very low	240 Å²	240	140.6 Å²	140.6	100%	1.182	81%	0.807	S	S	*	*				0	90.9	0	-76.3	170.9	164.9	0	0	106.6	Q3	M1-Q3 PolarHBondContact O-N 3.2Å
2	S	32.6	Very low	53.1	Low	126 Å²	126	135.4 Å²	135.4	88%	0.881	78%	0.782	S	S	*	*			trans	-81	115.3	-177.7	-49.8	0	0	0	0	107.9	A4	S2-A4 PolarHBondContact O-N 3.44Å
3	Q	37.7	Very low	56	Low	189 Å²	189	134.9 Å²	134.9	88%	0.883	77%	0.774	S	S	*	*			trans	-70.6	113.5	172.5	-68.5	-173.9	18.4	0	0	107.7	M1 V5	M1-Q3 PolarHBondContact O-N 3.2Å; Q3-V5 PolarHBondContact O-N 3.03Å
4	A	36.4	Very low	58.6	Low	91 Å²	91	132.4 Å²	132.4	75%	0.752	77%	0.768	S	S	*	*			trans	-75.2	110.8	170.2	0	0	0	0	0	108	S2 Q6	S2-A4 PolarHBondContact O-N 3.44Å; A4-Q6 PolarHBondContact O-N 3.09Å; A4-Q6 VanDerWaalsContact O-N 3.08Å
5	V	40.3	Very low	61	Low	125 Å²	125	131.3 Å²	131.3	76%	0.758	75%	0.751	S	S	*	*			trans	-59.6	108.3	165	176	0	0	0	0	107.2	Q3 T7	Q3-V5 PolarHBondContact O-N 3.03Å; V5-T7 PolarHBondContact O-N 3.48Å
6	Q	37.3	Very low	63.1	Low	172 Å²	172	128.1 Å²	128.1	80%	0.804	73%	0.734	S	S	*	*			trans	-71.2	93.6	173.4	-74.3	177.2	0.7	0	0	108.5	A4 N8	A4-Q6 PolarHBondContact O-N 3.09Å; A4-Q6 VanDerWaalsContact O-N 3.08Å; Q6-N8 PolarHBondContact O-N 3.42Å; Q6-N8 VanDerWaalsContact O-N 3.17Å
7	T	44.1	Very low	65	Low	125 Å²	125	131.8 Å²	131.8	77%	0.767	73%	0.733	S	S	*	*			trans	-62.2	114.6	160.9	57	0	0	0	0	107.3	V5 G9	V5-T7 PolarHBondContact O-N 3.48Å; T7-G9 VanDerWaalsContact C-N 3.28Å; T7-G9 PolarHBondContact O-N 3.13Å
8	N	49.7	Very low	66.7	Low	165 Å²	165	131 Å²	131	88%	0.882	72%	0.723	S	S	*	*			trans	-59.9	86.6	176.9	-91.4	-37.6	0	0	0	110.9	Q6	Q6-N8 PolarHBondContact O-N 3.42Å; Q6-N8 VanDerWaalsContact O-N 3.17Å
9	G	59.5	Low	68.3	Low	50 Å²	50	129.2 Å²	129.2	52%	0.515	71%	0.712	S	S	.	*	P	Polyproline II helix	trans	-67.9	140.9	167.6	0	0	0	0	0	110	T7 Q11	T7-G9 VanDerWaalsContact C-N 3.28Å; T7-G9 PolarHBondContact O-N 3.13Å; G9-Q11 PolarHBondContact O-N 3.44Å; G9-Q11 VanDerWaalsContact O-N 3.15Å
10	T	80.4	Confident	69.8	Low	148 Å²	148	125.3 Å²	125.3	91%	0.908	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-58.8	119.6	171.6	-59.1	0	0	0	0	108.7
11	Q	90.1	Very high	71.1	Confident	116 Å²	116	126.5 Å²	126.5	54%	0.542	70%	0.699	S	S	.	*	P	Polyproline II helix	trans	-65.4	152.6	179.9	-67.8	-65.8	-27.2	0	0	110.7	G9	G9-Q11 PolarHBondContact O-N 3.44Å; G9-Q11 VanDerWaalsContact O-N 3.15Å
12	P	92.8	Very high	74	Confident	78 Å²	78	121.8 Å²	121.8	51%	0.506	67%	0.669	S	S	.	*	P	Polyproline II helix	trans	-53.4	147.2	171.2	-24.8	34.1	0	0	0	111.6	S14 K15 T16	P12-S14 PolarHBondContact O-N 3.43Å; P12-K15 HydrophobicContact CB-CB 4.43Å; P12-K15 PolarHBondContact O-N 2.89Å; P12-T16 PolarHBondContact O-N 2.96Å; P12-T16 PolarHBondContact O-OG1 2.93Å
13	L	90.6	Very high	77.1	Confident	129 Å²	129	119.7 Å²	119.7	68%	0.675	65%	0.645	S	S	*	*	H	α-helix	trans	-58.7	-38.5	-178.8	-168.3	68.5	0	0	0	111.7	K15 T16 W17	L13-K15 VanDerWaalsContact C-N 3.27Å; L13-K15 PolarHBondContact O-N 3.37Å; L13-T16 PolarHBondContact O-N 3.38Å; L13-W17 VanDerWaalsContact CD1-NE1 3.3Å; L13-W17 VanDerWaalsContact O-CD1 3.23Å; L13-W17 PolarHBondContact O-N 3.29Å
14	S	92.4	Very high	79.9	Confident	99 Å²	99	116.4 Å²	116.4	69%	0.692	63%	0.633	S	S	*	*	H	α-helix	trans	-60	-36.8	175.2	52.6	0	0	0	0	112.6	P12 E18	P12-S14 PolarHBondContact O-N 3.43Å; S14-E18 WeakPolarHBondContact O-CB 3.4Å; S14-E18 PolarHBondContact O-N 2.86Å
15	K	94	Very high	82.8	Confident	117 Å²	117	117.7 Å²	117.7	51%	0.509	62%	0.623	S	S	.	*	H	α-helix	trans	-78	-36.6	179.9	-173.6	58.5	-178.1	175.9	0	112.5	P12 L13 W17 E18	P12-K15 HydrophobicContact CB-CB 4.43Å; P12-K15 PolarHBondContact O-N 2.89Å; L13-K15 VanDerWaalsContact C-N 3.27Å; L13-K15 PolarHBondContact O-N 3.37Å; K15-W17 VanDerWaalsContact C-N 3.27Å; K15-W17 PolarHBondContact O-N 2.95Å; K15-E18 WeakPolarHBondContact CD-OE2 3.4Å; K15-E18 IonicContact NZ-OE2 2.67Å; K15-E18 PolarHBondContact NZ-OE2 3.2Å; K15-E18 PolarHBondContact O-N 3.46Å
16	T	94.7	Very high	85.5	Confident	79 Å²	79	118.7 Å²	118.7	49%	0.485	61%	0.613	S	S	.	*	H	α-helix	trans	-63.5	-34.2	-179.6	-57.1	0	0	0	0	112.1	P12 L13	P12-T16 PolarHBondContact O-N 2.96Å; P12-T16 PolarHBondContact O-OG1 2.93Å; L13-T16 PolarHBondContact O-N 3.38Å
17	W	95.6	Very high	88.4	Confident	192 Å²	192	115.4 Å²	115.4	73%	0.727	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.9	11.4	-178.7	-56.4	109.8	0	0	0	113.5	L13 K15 L19	L13-W17 VanDerWaalsContact CD1-NE1 3.3Å; L13-W17 VanDerWaalsContact O-CD1 3.23Å; L13-W17 PolarHBondContact O-N 3.29Å; K15-W17 VanDerWaalsContact C-N 3.27Å; K15-W17 PolarHBondContact O-N 2.95Å; W17-L19 PolarHBondContact O-N 3.44Å
18	E	96	Very high	90.9	Very high	117 Å²	117	114.3 Å²	114.3	55%	0.547	60%	0.601	S	S	.	*	P	Polyproline II helix	trans	-70.8	121.2	173.6	-175	178.8	-154.5	0	0	109.1	S14 K15	S14-E18 WeakPolarHBondContact O-CB 3.4Å; S14-E18 PolarHBondContact O-N 2.86Å; K15-E18 WeakPolarHBondContact CD-OE2 3.4Å; K15-E18 IonicContact NZ-OE2 2.67Å; K15-E18 PolarHBondContact NZ-OE2 3.2Å; K15-E18 PolarHBondContact O-N 3.46Å
19	L	97.4	Very high	93.1	Very high	96 Å²	96	113.9 Å²	113.9	50%	0.503	59%	0.593	S	S	.	*	P	Polyproline II helix	trans	-79.8	132.7	177.5	-59.1	-178.2	0	0	0	110.3	W17 E23 L24	W17-L19 PolarHBondContact O-N 3.44Å; L19-E23 HydrophobicContact CB-CB 4.07Å; L19-E23 HydrophobicContact CD2-CB 4.15Å; L19-L24 HydrophobicContact CB-CD2 4.05Å; L19-L24 HydrophobicContact CB-CG 4.13Å; L19-L24 HydrophobicContact CD1-CD2 3.93Å
20	S	96.9	Very high	94.9	Very high	52 Å²	52	119.3 Å²	119.3	36%	0.364	61%	0.605	S	S	.	*	P	Polyproline II helix	trans	-65.6	161.8	167.5	64.4	0	0	0	0	111.4	Y22 E23 L24	S20-Y22 PolarHBondContact O-N 3.47Å; S20-Y22 VanDerWaalsContact O-N 3.16Å; S20-E23 VanDerWaalsContact CB-OE2 3.3Å; S20-E23 WeakPolarHBondContact CB-OE2 3.45Å; S20-E23 PolarHBondContact N-OE2 3.31Å; S20-E23 PolarHBondContact O-N 3.48Å; S20-E23 WeakPolarHBondContact OG-CG 3.48Å; S20-E23 PolarHBondContact OG-N 2.91Å; S20-E23 PolarHBondContact OG-OE2 3.23Å; S20-L24 PolarHBondContact O-N 3.35Å; S20-L24 VanDerWaalsContact O-N 3.08Å
21	L	97.6	Very high	95.5	Very high	151 Å²	151	116.1 Å²	116.1	79%	0.791	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.1	-32	173.6	-64.2	-179.5	0	0	0	112.3	L24 Q25	L21-L24 HydrophobicContact CD2-CD1 4.37Å; L21-Q25 WeakPolarHBondContact O-CG 3.44Å
22	Y	97.7	Very high	95.6	Very high	140 Å²	140	116.4 Å²	116.4	55%	0.549	60%	0.598	S	S	.	*	T	Hydrogen-bonded Turn	trans	-67.5	-47.2	173.2	168.4	-101.2	0	0	0	111.8	S20 L24 Q25 R26	S20-Y22 PolarHBondContact O-N 3.47Å; S20-Y22 VanDerWaalsContact O-N 3.16Å; Y22-L24 VanDerWaalsContact C-N 3.26Å; Y22-L24 PolarHBondContact O-N 3.44Å; Y22-Q25 VanDerWaalsContact CD2-NE2 3.27Å; Y22-Q25 CarbonylContact O-C 3.6Å; Y22-Q25 PolarHBondContact O-N 3.1Å; Y22-Q25 VanDerWaalsContact O-N 3.13Å; Y22-Q25 PolarHBondContact O-NE2 3.42Å; Y22-R26 HydrophobicContact CE1-CB 4.29Å; Y22-R26 PolarHBondContact O-N 3.05Å
23	E	97.6	Very high	95.6	Very high	83 Å²	83	119 Å²	119	39%	0.388	61%	0.613	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.7	-27.5	-178.1	-71.8	160	127.6	0	0	113.3	L19 S20 Q25 R26	L19-E23 HydrophobicContact CB-CB 4.07Å; L19-E23 HydrophobicContact CD2-CB 4.15Å; S20-E23 VanDerWaalsContact CB-OE2 3.3Å; S20-E23 WeakPolarHBondContact CB-OE2 3.45Å; S20-E23 PolarHBondContact N-OE2 3.31Å; S20-E23 PolarHBondContact O-N 3.48Å; S20-E23 WeakPolarHBondContact OG-CG 3.48Å; S20-E23 PolarHBondContact OG-N 2.91Å; S20-E23 PolarHBondContact OG-OE2 3.23Å; E23-Q25 PolarHBondContact O-N 3.42Å; E23-R26 WeakPolarHBondContact O-CG 3.4Å
24	L	97.6	Very high	95.6	Very high	120 Å²	120	119 Å²	119	63%	0.628	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65	-24.6	174.6	-72.1	172.9	0	0	0	113.5	L19 S20 L21 Y22	L19-L24 HydrophobicContact CB-CD2 4.05Å; L19-L24 HydrophobicContact CB-CG 4.13Å; L19-L24 HydrophobicContact CD1-CD2 3.93Å; S20-L24 PolarHBondContact O-N 3.35Å; S20-L24 VanDerWaalsContact O-N 3.08Å; L21-L24 HydrophobicContact CD2-CD1 4.37Å; Y22-L24 VanDerWaalsContact C-N 3.26Å; Y22-L24 PolarHBondContact O-N 3.44Å
25	Q	97	Very high	95.1	Very high	118 Å²	118	117.4 Å²	117.4	55%	0.551	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.5	4.5	-176.3	62.5	75.9	68.8	0	0	113.8	L21 Y22 E23 T27	L21-Q25 WeakPolarHBondContact O-CG 3.44Å; Y22-Q25 VanDerWaalsContact CD2-NE2 3.27Å; Y22-Q25 CarbonylContact O-C 3.6Å; Y22-Q25 PolarHBondContact O-N 3.1Å; Y22-Q25 VanDerWaalsContact O-N 3.13Å; Y22-Q25 PolarHBondContact O-NE2 3.42Å; E23-Q25 PolarHBondContact O-N 3.42Å; Q25-T27 PolarHBondContact O-N 3.34Å
26	R	97	Very high	94.9	Very high	145 Å²	145	117.5 Å²	117.5	55%	0.547	62%	0.618	S	S	.	*	P	Polyproline II helix	trans	-63.4	138.8	-177.4	69.9	-174.4	-75.8	-104.8	-2.8	110.7	Y22 E23	Y22-R26 HydrophobicContact CE1-CB 4.29Å; Y22-R26 PolarHBondContact O-N 3.05Å; E23-R26 WeakPolarHBondContact O-CG 3.4Å
27	T	97.6	Very high	94.3	Very high	103 Å²	103	120.9 Å²	120.9	63%	0.632	63%	0.628	S	S	*	*	P	Polyproline II helix	trans	-93.4	157.3	172.2	55.5	0	0	0	0	110.6	Q25	Q25-T27 PolarHBondContact O-N 3.34Å
28	P	97.8	Very high	93.8	Very high	103 Å²	103	118.6 Å²	118.6	67%	0.669	63%	0.629	S	S	*	*	P	Polyproline II helix	trans	-54.1	144.3	172.2	-25.1	35.4	0	0	0	111.9
29	Q	96	Very high	93.1	Very high	155 Å²	155	120.3 Å²	120.3	72%	0.724	65%	0.647	S	S	*	*			trans	-86.6	115.9	167.3	-69.6	-66.4	-31.6	0	0	107.2
30	E	95.9	Very high	92.4	Very high	164 Å²	164	119.6 Å²	119.6	77%	0.766	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-63.3	138.3	-178.8	-65.9	-60.9	150.1	0	0	110.6
31	A	93.2	Very high	91.7	Very high	81 Å²	81	120 Å²	120	67%	0.669	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-71.3	136.6	179	0	0	0	0	0	110.5	T33	A31-T33 PolarHBondContact O-N 2.92Å
32	I	93	Very high	90.8	Very high	123 Å²	123	115.4 Å²	115.4	63%	0.631	63%	0.628	S	S	*	*	P	Polyproline II helix	trans	-72.8	123	174.7	-56.2	179.4	0	0	0	108.3	D34 L36	I32-D34 WeakPolarHBondContact CG2-OD1 3.27Å; I32-L36 HydrophobicContact CD1-CD2 3.97Å; I32-L36 HydrophobicContact CG2-CB 3.72Å; I32-L36 HydrophobicContact CG2-CD2 4.13Å
33	T	92.8	Very high	89.9	Confident	133 Å²	133	117.8 Å²	117.8	82%	0.816	64%	0.636	S	S	*	*			trans	-125.3	-3.1	-175	52.9	0	0	0	0	113.7	A31 G35	A31-T33 PolarHBondContact O-N 2.92Å; T33-G35 PolarHBondContact O-N 3.48Å
34	D	89.1	Confident	89.3	Confident	128 Å²	128	117.5 Å²	117.5	68%	0.684	64%	0.643	S	S	*	*	S	Bend	trans	-86.2	17.9	-174.2	60.7	-13.9	0	0	0	113.9	I32 L36	I32-D34 WeakPolarHBondContact CG2-OD1 3.27Å; D34-L36 PolarHBondContact O-N 3.06Å
35	G	82.9	Confident	88.8	Confident	66 Å²	66	114.7 Å²	114.7	68%	0.68	63%	0.628	S	S	*	*			trans	70.5	16.8	177.6	0	0	0	0	0	114	T33 E37	T33-G35 PolarHBondContact O-N 3.48Å; G35-E37 PolarHBondContact O-N 2.75Å
36	L	88.6	Confident	88.2	Confident	119 Å²	119	114.1 Å²	114.1	62%	0.623	63%	0.626	S	S	*	*			trans	-54.2	125.5	174.5	-176.8	66.8	0	0	0	111	I32 D34	I32-L36 HydrophobicContact CD1-CD2 3.97Å; I32-L36 HydrophobicContact CG2-CB 3.72Å; I32-L36 HydrophobicContact CG2-CD2 4.13Å; D34-L36 PolarHBondContact O-N 3.06Å
37	E	83.4	Confident	87.7	Confident	150 Å²	150	111.3 Å²	111.3	70%	0.701	63%	0.628	S	S	*	*			trans	-80.2	145.9	178.1	-64.1	-168.9	159.5	0	0	112.1	G35 V39	G35-E37 PolarHBondContact O-N 2.75Å; E37-V39 PolarHBondContact O-N 2.88Å
38	I	84	Confident	87.5	Confident	144 Å²	144	111.5 Å²	111.5	74%	0.738	62%	0.622	S	S	*	*			trans	-74.2	112.7	178.2	-59.2	172.9	0	0	0	108.5	V40	I38-V40 HydrophobicContact CG2-CB 4.04Å; I38-V40 HydrophobicContact CG2-CG2 4.25Å; I38-V40 PolarHBondContact O-N 3.32Å
39	V	82.8	Confident	87.3	Confident	152 Å²	152	107 Å²	107	92%	0.921	59%	0.592	S	S	*	*			trans	-73.3	1	178.4	-94.8	0	0	0	0	114.7	E37	E37-V39 PolarHBondContact O-N 2.88Å
40	V	82.3	Confident	87.3	Confident	81 Å²	81	101.7 Å²	101.7	49%	0.491	57%	0.568	S	S	.	*	S	Bend	trans	-96.8	128.7	-179.8	-166.7	0	0	0	0	109.4	I38	I38-V40 HydrophobicContact CG2-CB 4.04Å; I38-V40 HydrophobicContact CG2-CG2 4.25Å; I38-V40 PolarHBondContact O-N 3.32Å
41	S	82	Confident	87.3	Confident	60 Å²	60	93.9 Å²	93.9	42%	0.42	53%	0.531	S	S	.	.			trans	-62.4	133.8	174.3	-175	0	0	0	0	110.3	R43 S44	S41-R43 PolarHBondContact O-N 3.47Å; S41-R43 PolarHBondContact OG-N 3.33Å; S41-S44 VanDerWaalsContact O-CB 3.29Å; S41-S44 WeakPolarHBondContact O-CB 3.49Å; S41-S44 PolarHBondContact O-N 2.97Å; S41-S44 PolarHBondContact O-OG 3.46Å
42	P	78.9	Confident	87.5	Confident	56 Å²	56	93 Å²	93	36%	0.364	52%	0.519	S	S	.	.	G	3₁₀ helix	trans	-53.7	-30.8	173.8	-29	35.8	0	0	0	113.2	S44 L45 I113 Y114	P42-S44 PolarHBondContact O-N 2.94Å; P42-S44 VanDerWaalsContact O-N 3.16Å; P42-L45 WeakPolarHBondContact O-CB 3.42Å; P42-L45 PolarHBondContact O-N 2.94Å; P42-I113 HydrophobicContact CB-CG2 4.11Å; P42-Y114 HydrophobicContact CB-CE1 3.82Å; P42-Y114 HydrophobicContact CB-CE2 4.4Å; P42-Y114 PolarHBondContact O-OH 2.97Å
43	R	77.8	Confident	87.7	Confident	190 Å²	190	90.2 Å²	90.2	72%	0.717	51%	0.505	S	S	*	.	G	3₁₀ helix	trans	-59.8	-26.6	177.1	-64.7	-176.2	-169.9	-84.8	-2.2	113.3	S41 L45 H46	S41-R43 PolarHBondContact O-N 3.47Å; S41-R43 PolarHBondContact OG-N 3.33Å; R43-L45 PolarHBondContact O-N 3.33Å; R43-H46 WeakPolarHBondContact O-CB 3.38Å; R43-H46 PolarHBondContact O-N 2.92Å
44	S	86.7	Confident	87.8	Confident	77 Å²	77	86.8 Å²	86.8	54%	0.538	49%	0.485	S	S	.	.	G	3₁₀ helix	trans	-70.5	-14.2	176.4	-59.5	0	0	0	0	113.1	S41 P42	S41-S44 VanDerWaalsContact O-CB 3.29Å; S41-S44 WeakPolarHBondContact O-CB 3.49Å; S41-S44 PolarHBondContact O-N 2.97Å; S41-S44 PolarHBondContact O-OG 3.46Å; P42-S44 PolarHBondContact O-N 2.94Å; P42-S44 VanDerWaalsContact O-N 3.16Å
45	L	86.9	Confident	88.1	Confident	60 Å²	60	86.5 Å²	86.5	31%	0.314	48%	0.483	S	S	.	.	G	3₁₀ helix	trans	-95.8	9.6	178.6	-58	176.3	0	0	0	113	P42 R43 S47 E48 L49 I113	P42-L45 WeakPolarHBondContact O-CB 3.42Å; P42-L45 PolarHBondContact O-N 2.94Å; R43-L45 PolarHBondContact O-N 3.33Å; L45-S47 VanDerWaalsContact C-N 3.35Å; L45-S47 PolarHBondContact O-N 3.41Å; L45-E48 WeakPolarHBondContact CA-OE2 3.33Å; L45-E48 PolarHBondContact O-N 2.98Å; L45-L49 HydrophobicContact CB-CD1 3.84Å; L45-L49 HydrophobicContact CB-CG 4.23Å; L45-L49 VanDerWaalsContact O-CG 3.3Å; L45-L49 WeakPolarHBondContact O-CG 3.24Å; L45-L49 PolarHBondContact O-N 2.91Å; L45-I113 HydrophobicContact CD1-CD1 3.97Å; L45-I113 HydrophobicContact CD1-CG2 4.11Å
46	H	83.1	Confident	88.5	Confident	107 Å²	107	86.9 Å²	86.9	50%	0.495	47%	0.47	S	S	.	.	H	α-helix	trans	-61.8	-41.1	-171.4	-174.8	58.7	0	0	0	112.3	R43 E48 M50	R43-H46 WeakPolarHBondContact O-CB 3.38Å; R43-H46 PolarHBondContact O-N 2.92Å; H46-E48 VanDerWaalsContact C-N 3.35Å; H46-E48 PolarHBondContact O-N 3.37Å; H46-M50 WeakPolarHBondContact CD2-CE 2.94Å; H46-M50 VanDerWaalsContact CE1-CE 3.43Å; H46-M50 WeakPolarHBondContact CE1-CE 3.48Å; H46-M50 WeakPolarHBondContact NE2-CE 3.38Å; H46-M50 WeakPolarHBondContact O-CB 3.44Å; H46-M50 PolarHBondContact O-N 2.98Å
47	S	87.3	Confident	88.7	Confident	85 Å²	85	82.5 Å²	82.5	59%	0.594	45%	0.446	S	S	*	.	H	α-helix	trans	-66.6	-34.8	178.2	31.7	0	0	0	0	113.1	L45	L45-S47 VanDerWaalsContact C-N 3.35Å; L45-S47 PolarHBondContact O-N 3.41Å
48	E	93.1	Very high	89.3	Confident	107 Å²	107	75.4 Å²	75.4	50%	0.5	41%	0.413	S	S	.	.	H	α-helix	trans	-79.4	-25.4	-174.6	-63.9	66.2	-141.7	0	0	112.1	L45 H46	L45-E48 WeakPolarHBondContact CA-OE2 3.33Å; L45-E48 PolarHBondContact O-N 2.98Å; H46-E48 VanDerWaalsContact C-N 3.35Å; H46-E48 PolarHBondContact O-N 3.37Å
49	L	93.9	Very high	89.8	Confident	9 Å²	9	72.3 Å²	72.3	5%	0.047	39%	0.394	C	S	.	.	H	α-helix	trans	-105.3	0.2	-175.6	-55.5	178.5	0	0	0	113.2	L45 M57 L58 F106 I110 I113 Y114	L45-L49 HydrophobicContact CB-CD1 3.84Å; L45-L49 HydrophobicContact CB-CG 4.23Å; L45-L49 VanDerWaalsContact O-CG 3.3Å; L45-L49 WeakPolarHBondContact O-CG 3.24Å; L45-L49 PolarHBondContact O-N 2.91Å; L49-M57 CarbonylContact O-C 3.54Å; L49-M57 WeakPolarHBondContact O-CA 3.21Å; L49-L58 WeakPolarHBondContact O-CG 3.43Å; L49-L58 PolarHBondContact O-N 3.45Å; L49-F106 HydrophobicContact CD2-CE1 3.9Å; L49-F106 HydrophobicContact CD2-CZ 3.65Å; L49-I110 HydrophobicContact CD2-CG1 3.93Å; L49-I113 HydrophobicContact CD1-CD1 4.15Å; L49-I113 HydrophobicContact CD1-CG2 4.42Å; L49-Y114 HydrophobicContact CD1-CD2 4.29Å; L49-Y114 HydrophobicContact CD1-CE2 3.69Å
50	M	94.7	Very high	90.4	Very high	43 Å²	43	70.5 Å²	70.5	21%	0.212	38%	0.379	C	S	.	.	B	Isolated β-bridge	trans	-91.8	140.8	-177.9	-173.4	-168.3	-49.9	0	0	112.4	H46 P52 L55	H46-M50 WeakPolarHBondContact CD2-CE 2.94Å; H46-M50 VanDerWaalsContact CE1-CE 3.43Å; H46-M50 WeakPolarHBondContact CE1-CE 3.48Å; H46-M50 WeakPolarHBondContact NE2-CE 3.38Å; H46-M50 WeakPolarHBondContact O-CB 3.44Å; H46-M50 PolarHBondContact O-N 2.98Å; M50-P52 WeakPolarHBondContact O-CD 3.5Å; M50-L55 VanDerWaalsContact CG-C 3.47Å; M50-L55 HydrophobicContact SD-CB 4.18Å; M50-L55 HydrophobicContact SD-CD2 4.43Å
51	C	97.4	Very high	91.2	Very high	0 Å²	0	66.7 Å²	66.7	0%	0	36%	0.356	C	S	.	.			trans	-76.4	123.8	168.9	-176.9	0	0	0	0	110.6	I53 C54 L55 D56 L58 C72	C51-I53 PolarHBondContact O-N 3.35Å; C51-C54 VanDerWaalsContact CB-SG 3.54Å; C51-L55 VanDerWaalsContact O-CA 3.3Å; C51-L55 WeakPolarHBondContact O-CA 3.24Å; C51-L55 PolarHBondContact O-N 3.1Å; C51-D56 WeakPolarHBondContact CB-O 3.25Å; C51-D56 PolarHBondContact N-O 3.08Å; C51-L58 HydrophobicContact CB-CD2 3.71Å; C51-L58 HydrophobicContact CB-CG 4.3Å; C51-C72 VanDerWaalsContact CB-SG 3.52Å; C51-C72 PolarHBondContact SG-N 2.92Å; C51-C72 VanDerWaalsContact SG-N 3.38Å
52	P	96.9	Very high	92	Very high	64 Å²	64	64.5 Å²	64.5	42%	0.416	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-6.5	178.9	-22.5	33.5	0	0	0	115.5	M50 R70 F71	M50-P52 WeakPolarHBondContact O-CD 3.5Å; P52-R70 WeakPolarHBondContact CD-O 3.12Å; P52-F71 HydrophobicContact CB-CE1 4.16Å; P52-F71 HydrophobicContact CG-CD1 4.33Å; P52-F71 HydrophobicContact CG-CE1 3.97Å
53	I	96.8	Very high	92.9	Very high	64 Å²	64	62.4 Å²	62.4	33%	0.328	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	-53.8	-177.8	-61	166.7	0	0	0	110.6	C51 F71 C75 I76 A79 P88	C51-I53 PolarHBondContact O-N 3.35Å; I53-F71 HydrophobicContact CD1-CB 4.29Å; I53-F71 HydrophobicContact CD1-CD1 3.48Å; I53-F71 VanDerWaalsContact CD1-CD1 3.48Å; I53-F71 HydrophobicContact CD1-CE1 4.11Å; I53-F71 HydrophobicContact CD1-CG 4.08Å; I53-F71 HydrophobicContact CG1-CD1 3.78Å; I53-F71 HydrophobicContact CG1-CE1 4.16Å; I53-C75 HydrophobicContact CB-CB 3.89Å; I53-C75 HydrophobicContact CD1-CB 3.73Å; I53-C75 HydrophobicContact CG1-CB 4.42Å; I53-C75 HydrophobicContact CG2-CB 3.88Å; I53-I76 HydrophobicContact CD1-CD1 4.47Å; I53-A79 HydrophobicContact CD1-CB 4.26Å; I53-P88 HydrophobicContact CD1-CG 4.08Å; I53-P88 HydrophobicContact CG1-CB 4.34Å; I53-P88 HydrophobicContact CG1-CG 4.4Å
54	C	95.8	Very high	93.9	Very high	60 Å²	60	53.3 Å²	53.3	41%	0.405	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-6.5	-179.5	66.1	0	0	0	0	113.7	C51 D56	C51-C54 VanDerWaalsContact CB-SG 3.54Å; C54-D56 PolarHBondContact O-N 3.15Å; C54-D56 VanDerWaalsContact O-N 3.13Å
55	L	94.4	Very high	94.4	Very high	123 Å²	123	54.6 Å²	54.6	64%	0.644	29%	0.288	S	S	*	.	S	Bend	trans	58.1	23.1	-178.6	-48.6	-179.6	0	0	0	113.7	M50 C51	M50-L55 VanDerWaalsContact CG-C 3.47Å; M50-L55 HydrophobicContact SD-CB 4.18Å; M50-L55 HydrophobicContact SD-CD2 4.43Å; C51-L55 VanDerWaalsContact O-CA 3.3Å; C51-L55 WeakPolarHBondContact O-CA 3.24Å; C51-L55 PolarHBondContact O-N 3.1Å
56	D	92.4	Very high	94.8	Very high	73 Å²	73	57.4 Å²	57.4	39%	0.39	30%	0.299	S	S	.	.	S	Bend	trans	-119.8	164.6	178	-168.6	11.9	0	0	0	109.3	C51 C54 L58	C51-D56 WeakPolarHBondContact CB-O 3.25Å; C51-D56 PolarHBondContact N-O 3.08Å; C54-D56 PolarHBondContact O-N 3.15Å; C54-D56 VanDerWaalsContact O-N 3.13Å; D56-L58 PolarHBondContact O-N 3.28Å
57	M	91.8	Very high	95.4	Very high	27 Å²	27	53.6 Å²	53.6	13%	0.133	28%	0.284	C	S	.	.	B	Isolated β-bridge	trans	-56.9	137.5	178.5	-177.2	-176.6	-56.7	0	0	111.2	L49 K59 I110 Y114 R117	L49-M57 CarbonylContact O-C 3.54Å; L49-M57 WeakPolarHBondContact O-CA 3.21Å; M57-K59 PolarHBondContact O-N 3.11Å; M57-I110 HydrophobicContact CG-CG2 4.08Å; M57-I110 HydrophobicContact SD-CG2 3.55Å; M57-I110 VanDerWaalsContact SD-CG2 3.55Å; M57-Y114 HydrophobicContact CE-CD1 4.09Å; M57-Y114 HydrophobicContact CE-CD2 3.53Å; M57-Y114 HydrophobicContact CE-CE1 4.12Å; M57-Y114 HydrophobicContact CE-CE2 3.57Å; M57-Y114 HydrophobicContact CE-CG 3.79Å; M57-Y114 HydrophobicContact SD-CD2 3.95Å; M57-Y114 HydrophobicContact SD-CE2 4.44Å; M57-Y114 HydrophobicContact SD-CG 4.28Å; M57-R117 PolarHBondContact O-NH2 3.31Å
58	L	95.5	Very high	95.9	Very high	2 Å²	2	55 Å²	55	1%	0.01	28%	0.284	C	S	.	.			trans	-55.2	134.4	-175.9	-72.4	158.7	0	0	0	112	L49 C51 D56 T61 R70 F71 F106 I110 R117	L49-L58 WeakPolarHBondContact O-CG 3.43Å; L49-L58 PolarHBondContact O-N 3.45Å; C51-L58 HydrophobicContact CB-CD2 3.71Å; C51-L58 HydrophobicContact CB-CG 4.3Å; D56-L58 PolarHBondContact O-N 3.28Å; L58-T61 HydrophobicContact CD1-CG2 4.4Å; L58-R70 HydrophobicContact CD1-CB 3.8Å; L58-R70 HydrophobicContact CD2-CB 4.23Å; L58-F71 VanDerWaalsContact CD2-CA 3.4Å; L58-F106 HydrophobicContact CD1-CD1 4.19Å; L58-F106 HydrophobicContact CD1-CE1 3.6Å; L58-I110 HydrophobicContact CB-CD1 3.85Å; L58-R117 PolarHBondContact O-NH1 3.48Å
59	K	94.6	Very high	96.2	Very high	79 Å²	79	52.6 Å²	52.6	34%	0.343	27%	0.273	S	S	.	.	S	Bend	trans	-125.4	129	175	-67	-179.2	-175.9	-174.9	0	109	M57 C72 A73 R117 E121	M57-K59 PolarHBondContact O-N 3.11Å; K59-C72 PolarHBondContact N-SG 3.13Å; K59-C72 WeakPolarHBondContact O-CA 3.39Å; K59-C72 WeakPolarHBondContact O-CB 3.45Å; K59-A73 PolarHBondContact O-N 3.13Å; K59-R117 VanDerWaalsContact CE-CZ 3.4Å; K59-R117 VanDerWaalsContact CG-NH1 3.34Å; K59-R117 VanDerWaalsContact CG-NH2 3.26Å; K59-E121 WeakPolarHBondContact CE-OE1 3.34Å; K59-E121 VanDerWaalsContact NZ-CD 3.3Å; K59-E121 IonicContact NZ-OE1 2.72Å; K59-E121 PolarHBondContact NZ-OE1 3.3Å; K59-E121 VanDerWaalsContact NZ-OE1 3.14Å; K59-E121 IonicContact NZ-OE2 3.68Å; K59-E121 PolarHBondContact NZ-OE2 3.46Å
60	N	97.1	Very high	96.4	Very high	113 Å²	113	56.3 Å²	56.3	60%	0.604	29%	0.286	S	S	*	.	S	Bend	trans	49.6	64.2	-177.3	-52	105.1	0	0	0	110.6	M62 A73 D107	N60-M62 PolarHBondContact O-N 2.8Å; N60-A73 HydrophobicContact CB-CB 3.98Å; N60-A73 WeakPolarHBondContact O-CB 3.05Å; N60-A73 PolarHBondContact O-N 2.68Å; N60-A73 VanDerWaalsContact O-N 3.13Å; N60-D107 WeakPolarHBondContact CA-OD2 3.24Å
61	T	98.1	Very high	96.6	Very high	1 Å²	1	54.3 Å²	54.3	1%	0.006	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.4	128.8	-165.1	-59.4	0	0	0	0	111.6	L58 R70 P102 D103 F106 D107	L58-T61 HydrophobicContact CD1-CG2 4.4Å; T61-R70 HydrophobicContact CG2-CB 3.92Å; T61-R70 HydrophobicContact CG2-CG 4.07Å; T61-P102 WeakPolarHBondContact O-CA 3.38Å; T61-D103 HydrophobicContact CG2-CB 4.11Å; T61-D103 PolarHBondContact O-N 2.95Å; T61-F106 HydrophobicContact CG2-CB 4.48Å; T61-F106 HydrophobicContact CG2-CD1 4.06Å; T61-D107 WeakPolarHBondContact CB-OD1 3.31Å; T61-D107 PolarHBondContact N-OD1 3.37Å; T61-D107 PolarHBondContact N-OD2 3.2Å; T61-D107 VanDerWaalsContact N-OD2 3.11Å; T61-D107 PolarHBondContact OG1-OD1 3.17Å
62	M	98.3	Very high	96.6	Very high	14 Å²	14	54.7 Å²	54.7	7%	0.069	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	127.9	171.2	-67	-66.3	-69.6	0	0	109.6	N60 R70 F71 A73 I76 L100 R101 P102	N60-M62 PolarHBondContact O-N 2.8Å; M62-R70 WeakPolarHBondContact O-CA 3.48Å; M62-F71 PolarHBondContact N-O 3.36Å; M62-F71 PolarHBondContact O-N 2.82Å; M62-A73 HydrophobicContact CG-CB 3.75Å; M62-I76 HydrophobicContact CB-CG2 3.77Å; M62-I76 HydrophobicContact CG-CG2 4.11Å; M62-L100 HydrophobicContact CE-CB 3.62Å; M62-L100 HydrophobicContact CE-CD1 4.15Å; M62-R101 WeakPolarHBondContact CA-O 3.5Å; M62-P102 HydrophobicContact SD-CB 4.16Å; M62-P102 HydrophobicContact SD-CG 3.94Å
63	T	98.4	Very high	96.7	Very high	12 Å²	12	52.5 Å²	52.5	7%	0.074	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	133.2	-176.9	-56.8	0	0	0	0	110.6	L68 H69 R70 L100 R101 D103	T63-L68 HydrophobicContact CG2-CB 4.32Å; T63-L68 HydrophobicContact CG2-CD2 4.03Å; T63-H69 WeakPolarHBondContact CA-O 3.44Å; T63-R70 HydrophobicContact CG2-CG 4.37Å; T63-L100 CarbonylContact O-C 3.38Å; T63-L100 WeakPolarHBondContact O-CA 3.32Å; T63-R101 PolarHBondContact N-O 3.49Å; T63-R101 PolarHBondContact O-N 2.9Å; T63-D103 WeakPolarHBondContact OG1-CB 3.43Å; T63-D103 PolarHBondContact OG1-OD2 2.95Å; T63-D103 VanDerWaalsContact OG1-OD2 3.13Å
64	T	98.1	Very high	96.7	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	132.4	174.1	55.1	0	0	0	0	111	E66 C67 L68 H69 F71 L94 L100	T64-E66 VanDerWaalsContact C-N 3.31Å; T64-E66 PolarHBondContact O-N 3.44Å; T64-C67 PolarHBondContact OG1-SG 3.16Å; T64-L68 VanDerWaalsContact O-CA 3.25Å; T64-L68 WeakPolarHBondContact O-CA 3.49Å; T64-L68 PolarHBondContact O-N 3.03Å; T64-L68 PolarHBondContact OG1-N 3.13Å; T64-H69 PolarHBondContact N-O 3.38Å; T64-H69 PolarHBondContact OG1-N 3.18Å; T64-H69 PolarHBondContact OG1-O 3.46Å; T64-F71 HydrophobicContact CG2-CD2 4.41Å; T64-F71 HydrophobicContact CG2-CE2 3.88Å; T64-L94 HydrophobicContact CG2-CD1 3.75Å; T64-L94 HydrophobicContact CG2-CD2 3.89Å; T64-L94 HydrophobicContact CG2-CG 4.46Å; T64-L100 HydrophobicContact CG2-CD2 3.61Å
65	K	97.2	Very high	96.8	Very high	104 Å²	104	53.4 Å²	53.4	45%	0.452	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-30.1	-176.6	-71.2	176.8	178.9	174.1	0	114.1	R98 S99 R101	K65-R98 WeakPolarHBondContact CE-O 3.37Å; K65-R98 PolarHBondContact NZ-O 2.76Å; K65-S99 WeakPolarHBondContact CB-O 3.16Å; K65-S99 WeakPolarHBondContact CG-O 3.4Å; K65-S99 PolarHBondContact N-O 3.45Å; K65-R101 HydrophobicContact CD-CG 4.34Å; K65-R101 HydrophobicContact CG-CG 4.12Å
66	E	95.4	Very high	97	Very high	119 Å²	119	47.6 Å²	47.6	56%	0.556	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.6	-23.5	-169.7	175	53.5	-145	0	0	113.5	T64 K92	T64-E66 VanDerWaalsContact C-N 3.31Å; T64-E66 PolarHBondContact O-N 3.44Å; E66-K92 HydrophobicContact CG-CD 3.59Å; E66-K92 PolarHBondContact O-NZ 3.06Å; E66-K92 IonicContact OE1-NZ 2.88Å; E66-K92 PolarHBondContact OE1-NZ 2.97Å
67	C	96.9	Very high	97.2	Very high	26 Å²	26	46.9 Å²	46.9	18%	0.176	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-134.7	1.6	-178.6	46.8	0	0	0	0	114.5	T64 H69 C90 K92	T64-C67 PolarHBondContact OG1-SG 3.16Å; C67-H69 PolarHBondContact O-N 3.44Å; C67-H69 PolarHBondContact SG-ND1 3.11Å; C67-H69 VanDerWaalsContact SG-ND1 3.42Å; C67-C90 PolarHBondContact SG-SG 3.04Å; C67-K92 HydrophobicContact CB-CD 4Å
68	L	97.6	Very high	97.4	Very high	115 Å²	115	48.8 Å²	48.8	60%	0.602	25%	0.248	S	C	*	.			trans	54.7	15.9	177.2	-56.3	179.1	0	0	0	115.4	T63 T64	T63-L68 HydrophobicContact CG2-CB 4.32Å; T63-L68 HydrophobicContact CG2-CD2 4.03Å; T64-L68 VanDerWaalsContact O-CA 3.25Å; T64-L68 WeakPolarHBondContact O-CA 3.49Å; T64-L68 PolarHBondContact O-N 3.03Å; T64-L68 PolarHBondContact OG1-N 3.13Å
69	H	98.3	Very high	97.4	Very high	57 Å²	57	50.1 Å²	50.1	26%	0.264	26%	0.259	S	S	.	.			trans	-66.7	140.1	168.8	-68.1	113.5	0	0	0	110.4	T63 T64 C67 F71 T89 C90	T63-H69 WeakPolarHBondContact CA-O 3.44Å; T64-H69 PolarHBondContact N-O 3.38Å; T64-H69 PolarHBondContact OG1-N 3.18Å; T64-H69 PolarHBondContact OG1-O 3.46Å; C67-H69 PolarHBondContact O-N 3.44Å; C67-H69 PolarHBondContact SG-ND1 3.11Å; C67-H69 VanDerWaalsContact SG-ND1 3.42Å; H69-F71 HydrophobicContact CB-CE2 3.76Å; H69-F71 HydrophobicContact CB-CZ 3.89Å; H69-T89 VanDerWaalsContact CD2-CG2 3.49Å; H69-T89 WeakPolarHBondContact CD2-CG2 3.48Å; H69-T89 WeakPolarHBondContact NE2-CG2 3.3Å; H69-C90 VanDerWaalsContact CE1-CB 3.44Å; H69-C90 WeakPolarHBondContact CE1-CB 3.32Å; H69-C90 VanDerWaalsContact CE1-SG 3.56Å
70	R	98.4	Very high	97.4	Very high	87 Å²	87	46.9 Å²	46.9	33%	0.328	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	140.6	-173.3	-63.9	-174.8	175.2	86	0.2	111.1	P52 L58 T61 M62 T63 D103	P52-R70 WeakPolarHBondContact CD-O 3.12Å; L58-R70 HydrophobicContact CD1-CB 3.8Å; L58-R70 HydrophobicContact CD2-CB 4.23Å; T61-R70 HydrophobicContact CG2-CB 3.92Å; T61-R70 HydrophobicContact CG2-CG 4.07Å; M62-R70 WeakPolarHBondContact O-CA 3.48Å; T63-R70 HydrophobicContact CG2-CG 4.37Å; R70-D103 IonicContact NE-OD2 3.98Å; R70-D103 IonicContact NH2-OD2 3.89Å
71	F	98.4	Very high	97.2	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	158.9	179.5	-54.2	-81.8	0	0	0	110.5	P52 I53 L58 M62 T64 H69 I76 P88 T89	P52-F71 HydrophobicContact CB-CE1 4.16Å; P52-F71 HydrophobicContact CG-CD1 4.33Å; P52-F71 HydrophobicContact CG-CE1 3.97Å; I53-F71 HydrophobicContact CD1-CB 4.29Å; I53-F71 HydrophobicContact CD1-CD1 3.48Å; I53-F71 VanDerWaalsContact CD1-CD1 3.48Å; I53-F71 HydrophobicContact CD1-CE1 4.11Å; I53-F71 HydrophobicContact CD1-CG 4.08Å; I53-F71 HydrophobicContact CG1-CD1 3.78Å; I53-F71 HydrophobicContact CG1-CE1 4.16Å; L58-F71 VanDerWaalsContact CD2-CA 3.4Å; M62-F71 PolarHBondContact N-O 3.36Å; M62-F71 PolarHBondContact O-N 2.82Å; T64-F71 HydrophobicContact CG2-CD2 4.41Å; T64-F71 HydrophobicContact CG2-CE2 3.88Å; H69-F71 HydrophobicContact CB-CE2 3.76Å; H69-F71 HydrophobicContact CB-CZ 3.89Å; F71-I76 HydrophobicContact CB-CB 3.72Å; F71-I76 HydrophobicContact CB-CG1 4.43Å; F71-I76 HydrophobicContact CB-CG2 4.21Å; F71-I76 HydrophobicContact CD2-CB 4.25Å; F71-I76 HydrophobicContact CD2-CD1 3.82Å; F71-I76 HydrophobicContact CD2-CG1 4.03Å; F71-I76 HydrophobicContact CE2-CD1 4.08Å; F71-I76 HydrophobicContact CG-CB 4.1Å; F71-I76 HydrophobicContact CG-CD1 4.12Å; F71-I76 HydrophobicContact CG-CG1 4.33Å; F71-P88 HydrophobicContact CE1-CB 3.94Å; F71-P88 HydrophobicContact CE1-CG 4.08Å; F71-P88 HydrophobicContact CZ-CB 4.18Å; F71-P88 HydrophobicContact CZ-CG 4.16Å; F71-T89 VanDerWaalsContact CZ-OG1 3.3Å; F71-T89 WeakPolarHBondContact CZ-OG1 3.2Å
72	C	98.4	Very high	96.8	Very high	9 Å²	9	54.5 Å²	54.5	6%	0.061	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	145.7	166	-54.3	0	0	0	0	110.1	C51 K59 D74 C75 I76	C51-C72 VanDerWaalsContact CB-SG 3.52Å; C51-C72 PolarHBondContact SG-N 2.92Å; C51-C72 VanDerWaalsContact SG-N 3.38Å; K59-C72 PolarHBondContact N-SG 3.13Å; K59-C72 WeakPolarHBondContact O-CA 3.39Å; K59-C72 WeakPolarHBondContact O-CB 3.45Å; C72-D74 PolarHBondContact O-N 2.89Å; C72-C75 HydrophobicContact CB-CB 3.96Å; C72-C75 PolarHBondContact O-N 3.32Å; C72-I76 WeakPolarHBondContact O-CG2 3.42Å; C72-I76 PolarHBondContact O-N 3.35Å
73	A	98	Very high	96.3	Very high	18 Å²	18	55.6 Å²	55.6	15%	0.149	30%	0.295	C	S	.	.	H	α-helix	trans	-53.3	-51.1	179.6	0	0	0	0	0	112.7	K59 N60 M62 C75 I77	K59-A73 PolarHBondContact O-N 3.13Å; N60-A73 HydrophobicContact CB-CB 3.98Å; N60-A73 WeakPolarHBondContact O-CB 3.05Å; N60-A73 PolarHBondContact O-N 2.68Å; N60-A73 VanDerWaalsContact O-N 3.13Å; M62-A73 HydrophobicContact CG-CB 3.75Å; A73-C75 VanDerWaalsContact C-N 3.31Å; A73-C75 PolarHBondContact O-N 3.04Å; A73-I77 VanDerWaalsContact O-CB 3.3Å; A73-I77 WeakPolarHBondContact O-CB 3.39Å; A73-I77 WeakPolarHBondContact O-CD1 3.47Å; A73-I77 WeakPolarHBondContact O-CG1 3.2Å; A73-I77 PolarHBondContact O-N 3.37Å
74	D	97.9	Very high	95.9	Very high	119 Å²	119	60.6 Å²	60.6	64%	0.636	32%	0.321	S	S	*	.	H	α-helix	trans	-65.2	-37.3	-178.1	-63	-25.4	0	0	0	112.1	C72 T78	C72-D74 PolarHBondContact O-N 2.89Å; D74-T78 WeakPolarHBondContact O-CB 3.49Å; D74-T78 PolarHBondContact O-N 3.33Å; D74-T78 PolarHBondContact O-OG1 2.9Å
75	C	98.1	Very high	95.7	Very high	24 Å²	24	65.7 Å²	65.7	16%	0.162	34%	0.343	C	S	.	.	H	α-helix	trans	-64.2	-53.4	179.4	-71.4	0	0	0	0	111.4	I53 C72 A73 T78 A79	I53-C75 HydrophobicContact CB-CB 3.89Å; I53-C75 HydrophobicContact CD1-CB 3.73Å; I53-C75 HydrophobicContact CG1-CB 4.42Å; I53-C75 HydrophobicContact CG2-CB 3.88Å; C72-C75 HydrophobicContact CB-CB 3.96Å; C72-C75 PolarHBondContact O-N 3.32Å; A73-C75 VanDerWaalsContact C-N 3.31Å; A73-C75 PolarHBondContact O-N 3.04Å; C75-T78 PolarHBondContact O-N 2.81Å; C75-A79 WeakPolarHBondContact O-CB 3.45Å; C75-A79 PolarHBondContact O-N 3.16Å
76	I	97.8	Very high	95.7	Very high	0 Å²	0	63.2 Å²	63.2	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-71.8	-33.6	-177.1	-168.6	60.2	0	0	0	112.4	I53 M62 F71 C72 A79 L80 P88 L94 L100	I53-I76 HydrophobicContact CD1-CD1 4.47Å; M62-I76 HydrophobicContact CB-CG2 3.77Å; M62-I76 HydrophobicContact CG-CG2 4.11Å; F71-I76 HydrophobicContact CB-CB 3.72Å; F71-I76 HydrophobicContact CB-CG1 4.43Å; F71-I76 HydrophobicContact CB-CG2 4.21Å; F71-I76 HydrophobicContact CD2-CB 4.25Å; F71-I76 HydrophobicContact CD2-CD1 3.82Å; F71-I76 HydrophobicContact CD2-CG1 4.03Å; F71-I76 HydrophobicContact CE2-CD1 4.08Å; F71-I76 HydrophobicContact CG-CB 4.1Å; F71-I76 HydrophobicContact CG-CD1 4.12Å; F71-I76 HydrophobicContact CG-CG1 4.33Å; C72-I76 WeakPolarHBondContact O-CG2 3.42Å; C72-I76 PolarHBondContact O-N 3.35Å; I76-A79 PolarHBondContact O-N 2.87Å; I76-L80 HydrophobicContact CD1-CG 4.46Å; I76-L80 HydrophobicContact CG1-CD1 4.39Å; I76-L80 HydrophobicContact CG1-CG 4.46Å; I76-L80 WeakPolarHBondContact O-CB 3.39Å; I76-L80 VanDerWaalsContact O-CG 3.31Å; I76-L80 WeakPolarHBondContact O-CG 3.43Å; I76-L80 PolarHBondContact O-N 3.38Å; I76-P88 HydrophobicContact CD1-CG 3.87Å; I76-L94 HydrophobicContact CD1-CD1 4.39Å; I76-L100 HydrophobicContact CB-CD1 4.38Å; I76-L100 HydrophobicContact CG1-CD1 3.7Å; I76-L100 HydrophobicContact CG1-CD2 4.1Å; I76-L100 HydrophobicContact CG2-CD1 3.72Å
77	I	96.2	Very high	95.8	Very high	58 Å²	58	57.5 Å²	57.5	30%	0.297	31%	0.307	S	S	.	.	H	α-helix	trans	-66.2	-42.2	175.7	-68.1	168.3	0	0	0	110.1	A73 L80 R81 K97	A73-I77 VanDerWaalsContact O-CB 3.3Å; A73-I77 WeakPolarHBondContact O-CB 3.39Å; A73-I77 WeakPolarHBondContact O-CD1 3.47Å; A73-I77 WeakPolarHBondContact O-CG1 3.2Å; A73-I77 PolarHBondContact O-N 3.37Å; I77-L80 PolarHBondContact O-N 3.2Å; I77-R81 WeakPolarHBondContact O-CB 3.44Å; I77-R81 PolarHBondContact O-N 3.03Å; I77-K97 HydrophobicContact CD1-CD 4.44Å
78	T	96.1	Very high	95.8	Very high	67 Å²	67	58.7 Å²	58.7	41%	0.411	31%	0.314	S	S	.	.	H	α-helix	trans	-64.7	-45.1	175.9	-61	0	0	0	0	111.4	D74 C75 L80 R81 S82	D74-T78 WeakPolarHBondContact O-CB 3.49Å; D74-T78 PolarHBondContact O-N 3.33Å; D74-T78 PolarHBondContact O-OG1 2.9Å; C75-T78 PolarHBondContact O-N 2.81Å; T78-L80 VanDerWaalsContact C-N 3.34Å; T78-L80 PolarHBondContact O-N 2.82Å; T78-R81 PolarHBondContact O-N 3.23Å; T78-R81 VanDerWaalsContact O-N 3.11Å; T78-S82 PolarHBondContact O-N 2.91Å
79	A	95.7	Very high	95.7	Very high	31 Å²	31	56.3 Å²	56.3	26%	0.256	30%	0.304	S	S	.	.	H	α-helix	trans	-59.2	-44	176.3	0	0	0	0	0	111.9	I53 C75 I76 R81 G83 P88	I53-A79 HydrophobicContact CD1-CB 4.26Å; C75-A79 WeakPolarHBondContact O-CB 3.45Å; C75-A79 PolarHBondContact O-N 3.16Å; I76-A79 PolarHBondContact O-N 2.87Å; A79-R81 VanDerWaalsContact C-N 3.29Å; A79-R81 PolarHBondContact O-N 3.36Å; A79-G83 VanDerWaalsContact O-CA 3.27Å; A79-G83 WeakPolarHBondContact O-CA 3.35Å; A79-G83 PolarHBondContact O-N 3.46Å; A79-P88 HydrophobicContact CB-CG 4.38Å
80	L	95.2	Very high	95.7	Very high	11 Å²	11	55.9 Å²	55.9	6%	0.058	31%	0.307	C	S	.	.	H	α-helix	trans	-69.6	-24.7	177	-72.3	178.5	0	0	0	113.3	I76 I77 T78 K85 L94 L100	I76-L80 HydrophobicContact CD1-CG 4.46Å; I76-L80 HydrophobicContact CG1-CD1 4.39Å; I76-L80 HydrophobicContact CG1-CG 4.46Å; I76-L80 WeakPolarHBondContact O-CB 3.39Å; I76-L80 VanDerWaalsContact O-CG 3.31Å; I76-L80 WeakPolarHBondContact O-CG 3.43Å; I76-L80 PolarHBondContact O-N 3.38Å; I77-L80 PolarHBondContact O-N 3.2Å; T78-L80 VanDerWaalsContact C-N 3.34Å; T78-L80 PolarHBondContact O-N 2.82Å; L80-K85 PolarHBondContact O-NZ 3.09Å; L80-L94 HydrophobicContact CD2-CB 3.89Å; L80-L94 HydrophobicContact CD2-CD1 4.29Å; L80-L100 HydrophobicContact CD1-CD1 3.82Å; L80-L100 HydrophobicContact CD1-CG 4.43Å
81	R	93.1	Very high	95.5	Very high	183 Å²	183	59.5 Å²	59.5	69%	0.691	32%	0.321	S	S	*	.	H	α-helix	trans	-76.2	-46.1	177.9	-176.2	173.4	59.7	86.9	0.4	111.7	I77 T78 A79	I77-R81 WeakPolarHBondContact O-CB 3.44Å; I77-R81 PolarHBondContact O-N 3.03Å; T78-R81 PolarHBondContact O-N 3.23Å; T78-R81 VanDerWaalsContact O-N 3.11Å; A79-R81 VanDerWaalsContact C-N 3.29Å; A79-R81 PolarHBondContact O-N 3.36Å
82	S	89	Confident	95.4	Very high	90 Å²	90	63.6 Å²	63.6	63%	0.629	34%	0.339	S	S	*	.	H	α-helix	trans	-97.6	-19.6	-171.9	-52	0	0	0	0	114	T78	T78-S82 PolarHBondContact O-N 2.91Å
83	G	87.8	Confident	95.3	Very high	38 Å²	38	71 Å²	71	39%	0.392	37%	0.37	S	S	.	.	S	Bend	trans	-113.1	-171.2	-171.9	0	0	0	0	0	114.4	A79	A79-G83 VanDerWaalsContact O-CA 3.27Å; A79-G83 WeakPolarHBondContact O-CA 3.35Å; A79-G83 PolarHBondContact O-N 3.46Å
84	N	89.9	Confident	95.2	Very high	117 Å²	117	70.2 Å²	70.2	63%	0.626	36%	0.363	S	S	*	.			trans	-64.1	146.7	175.5	-65.7	-17.3	0	0	0	110.5	E86	N84-E86 HydrophobicContact CB-CG 3.77Å; N84-E86 PolarHBondContact O-N 2.87Å
85	K	95.1	Very high	94.9	Very high	107 Å²	107	69.2 Å²	69.2	47%	0.465	36%	0.361	S	S	.	.	S	Bend	trans	-75.6	57.9	177.4	-57.7	-55.1	-179.9	-166.9	0	110.8	L80 L94	L80-K85 PolarHBondContact O-NZ 3.09Å; K85-L94 CarbonylContact C-O 3.51Å; K85-L94 WeakPolarHBondContact CA-O 3.39Å; K85-L94 VanDerWaalsContact CB-O 3.32Å; K85-L94 WeakPolarHBondContact CB-O 3.42Å; K85-L94 CarbonylContact O-C 3.51Å; K85-L94 PolarHBondContact O-N 2.65Å
86	E	96.6	Very high	94.6	Very high	51 Å²	51	70.5 Å²	70.5	24%	0.238	37%	0.37	C	S	.	.	B	Isolated β-bridge	trans	-141.2	159	-175.5	71.4	-174.3	-172.9	0	0	111.8	N84 P88 R91 K92	N84-E86 HydrophobicContact CB-CG 3.77Å; N84-E86 PolarHBondContact O-N 2.87Å; E86-P88 WeakPolarHBondContact O-CD 3.19Å; E86-R91 WeakPolarHBondContact OE1-CD 3.47Å; E86-R91 IonicContact OE1-CZ 2.67Å; E86-R91 IonicContact OE1-NE 2.75Å; E86-R91 IonicContact OE1-NH1 3.1Å; E86-R91 PolarHBondContact OE1-NH1 3.09Å; E86-R91 VanDerWaalsContact OE1-NH1 3.1Å; E86-K92 CarbonylContact C-O 3.5Å; E86-K92 WeakPolarHBondContact CA-O 3.31Å
87	C	97.6	Very high	94.5	Very high	0 Å²	0	76.8 Å²	76.8	0%	0	40%	0.397	C	S	.	.			trans	-70	125.8	176.1	179.4	0	0	0	0	110.4	T89 C90 R91 K92 L94	C87-T89 PolarHBondContact O-N 3.45Å; C87-T89 VanDerWaalsContact O-N 3.15Å; C87-C90 PolarHBondContact O-N 3.04Å; C87-R91 VanDerWaalsContact O-CA 3.23Å; C87-R91 WeakPolarHBondContact O-CA 3.43Å; C87-R91 PolarHBondContact O-N 3.42Å; C87-K92 PolarHBondContact N-O 2.78Å; C87-L94 VanDerWaalsContact CA-CD1 3.49Å; C87-L94 HydrophobicContact CB-CD1 3.9Å; C87-L94 HydrophobicContact CB-CG 4.12Å
88	P	96.4	Very high	94.4	Very high	50 Å²	50	83.8 Å²	83.8	33%	0.325	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-30.4	179.4	-29.4	37.5	0	0	0	114.4	I53 F71 I76 A79 E86	I53-P88 HydrophobicContact CD1-CG 4.08Å; I53-P88 HydrophobicContact CG1-CB 4.34Å; I53-P88 HydrophobicContact CG1-CG 4.4Å; F71-P88 HydrophobicContact CE1-CB 3.94Å; F71-P88 HydrophobicContact CE1-CG 4.08Å; F71-P88 HydrophobicContact CZ-CB 4.18Å; F71-P88 HydrophobicContact CZ-CG 4.16Å; I76-P88 HydrophobicContact CD1-CG 3.87Å; A79-P88 HydrophobicContact CB-CG 4.38Å; E86-P88 WeakPolarHBondContact O-CD 3.19Å
89	T	96.5	Very high	94.4	Very high	65 Å²	65	82 Å²	82	40%	0.399	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-47.9	-177.6	-49.2	0	0	0	0	113.1	H69 F71 C87	H69-T89 VanDerWaalsContact CD2-CG2 3.49Å; H69-T89 WeakPolarHBondContact CD2-CG2 3.48Å; H69-T89 WeakPolarHBondContact NE2-CG2 3.3Å; F71-T89 VanDerWaalsContact CZ-OG1 3.3Å; F71-T89 WeakPolarHBondContact CZ-OG1 3.2Å; C87-T89 PolarHBondContact O-N 3.45Å; C87-T89 VanDerWaalsContact O-N 3.15Å
90	C	96.8	Very high	94.5	Very high	48 Å²	48	80.9 Å²	80.9	32%	0.324	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.9	7.2	-169.2	76.3	0	0	0	0	114.7	C67 H69 C87 K92	C67-C90 PolarHBondContact SG-SG 3.04Å; H69-C90 VanDerWaalsContact CE1-CB 3.44Å; H69-C90 WeakPolarHBondContact CE1-CB 3.32Å; H69-C90 VanDerWaalsContact CE1-SG 3.56Å; C87-C90 PolarHBondContact O-N 3.04Å; C90-K92 PolarHBondContact O-N 3.47Å
91	R	96	Very high	94.6	Very high	163 Å²	163	87.8 Å²	87.8	62%	0.615	43%	0.425	S	S	*	.			trans	58	9.4	176.7	-46.3	-52.9	-171.4	87.4	9.4	116.3	E86 C87	E86-R91 WeakPolarHBondContact OE1-CD 3.47Å; E86-R91 IonicContact OE1-CZ 2.67Å; E86-R91 IonicContact OE1-NE 2.75Å; E86-R91 IonicContact OE1-NH1 3.1Å; E86-R91 PolarHBondContact OE1-NH1 3.09Å; E86-R91 VanDerWaalsContact OE1-NH1 3.1Å; C87-R91 VanDerWaalsContact O-CA 3.23Å; C87-R91 WeakPolarHBondContact O-CA 3.43Å; C87-R91 PolarHBondContact O-N 3.42Å
92	K	95.7	Very high	94.9	Very high	87 Å²	87	83.8 Å²	83.8	38%	0.378	42%	0.423	S	S	.	.			trans	-61.4	143.4	170.1	-73.7	-163.8	-170	-175.8	0	110.2	E66 C67 E86 C87 C90 L94	E66-K92 HydrophobicContact CG-CD 3.59Å; E66-K92 PolarHBondContact O-NZ 3.06Å; E66-K92 IonicContact OE1-NZ 2.88Å; E66-K92 PolarHBondContact OE1-NZ 2.97Å; C67-K92 HydrophobicContact CB-CD 4Å; E86-K92 CarbonylContact C-O 3.5Å; E86-K92 WeakPolarHBondContact CA-O 3.31Å; C87-K92 PolarHBondContact N-O 2.78Å; C90-K92 PolarHBondContact O-N 3.47Å; K92-L94 PolarHBondContact O-N 3.35Å
93	K	96.3	Very high	95.3	Very high	165 Å²	165	81 Å²	81	72%	0.717	40%	0.401	S	S	*	.	B	Isolated β-bridge	trans	-61.7	127.4	-174.7	-168.1	172.5	-175.4	175.4	0	112.5	V95	K93-V95 HydrophobicContact CG-CG2 4.44Å
94	L	96.1	Very high	95.8	Very high	1 Å²	1	83.2 Å²	83.2	1%	0.005	41%	0.408	C	S	.	.			trans	-120.9	91.7	173.8	-66.3	-176.6	0	0	0	109.4	T64 I76 L80 K85 C87 K92 S96 L100	T64-L94 HydrophobicContact CG2-CD1 3.75Å; T64-L94 HydrophobicContact CG2-CD2 3.89Å; T64-L94 HydrophobicContact CG2-CG 4.46Å; I76-L94 HydrophobicContact CD1-CD1 4.39Å; L80-L94 HydrophobicContact CD2-CB 3.89Å; L80-L94 HydrophobicContact CD2-CD1 4.29Å; K85-L94 CarbonylContact C-O 3.51Å; K85-L94 WeakPolarHBondContact CA-O 3.39Å; K85-L94 VanDerWaalsContact CB-O 3.32Å; K85-L94 WeakPolarHBondContact CB-O 3.42Å; K85-L94 CarbonylContact O-C 3.51Å; K85-L94 PolarHBondContact O-N 2.65Å; C87-L94 VanDerWaalsContact CA-CD1 3.49Å; C87-L94 HydrophobicContact CB-CD1 3.9Å; C87-L94 HydrophobicContact CB-CG 4.12Å; K92-L94 PolarHBondContact O-N 3.35Å; L94-S96 VanDerWaalsContact C-N 3.29Å; L94-S96 PolarHBondContact O-N 3.19Å; L94-L100 HydrophobicContact CD1-CD2 4.28Å
95	V	91.6	Very high	96.2	Very high	97 Å²	97	84 Å²	84	59%	0.588	41%	0.412	S	S	*	.			trans	-57	-41.3	-172.8	-178.8	0	0	0	0	112.4	K93 S99	K93-V95 HydrophobicContact CG-CG2 4.44Å; V95-S99 PolarHBondContact N-OG 2.99Å
96	S	92.4	Very high	96.2	Very high	51 Å²	51	80.1 Å²	80.1	36%	0.357	40%	0.396	S	S	.	.	S	Bend	trans	-165.6	-173.9	179	66.6	0	0	0	0	111.4	L94 R98 S99	L94-S96 VanDerWaalsContact C-N 3.29Å; L94-S96 PolarHBondContact O-N 3.19Å; S96-R98 PolarHBondContact O-N 2.89Å; S96-R98 WeakPolarHBondContact OG-CB 3.25Å; S96-R98 PolarHBondContact OG-N 3.49Å; S96-S99 VanDerWaalsContact O-CB 3.3Å; S96-S99 WeakPolarHBondContact O-CB 3.25Å; S96-S99 PolarHBondContact O-N 2.99Å; S96-S99 PolarHBondContact O-OG 2.95Å
97	K	93.6	Very high	96.2	Very high	132 Å²	132	79.6 Å²	79.6	57%	0.574	39%	0.394	S	S	*	.	G	3₁₀ helix	trans	-51.9	-25.8	169.7	-171.3	174.8	179.5	177.2	0	113.2	I77 S99 L100	I77-K97 HydrophobicContact CD1-CD 4.44Å; K97-S99 PolarHBondContact O-N 3.12Å; K97-L100 WeakPolarHBondContact O-CB 3.28Å; K97-L100 PolarHBondContact O-N 2.81Å
98	R	95.3	Very high	96.1	Very high	206 Å²	206	82.1 Å²	82.1	78%	0.777	42%	0.415	S	S	*	.	G	3₁₀ helix	trans	-64	-23.2	175.3	-176.8	-179.6	-68.8	-87.6	0.4	113.3	K65 S96 L100	K65-R98 WeakPolarHBondContact CE-O 3.37Å; K65-R98 PolarHBondContact NZ-O 2.76Å; S96-R98 PolarHBondContact O-N 2.89Å; S96-R98 WeakPolarHBondContact OG-CB 3.25Å; S96-R98 PolarHBondContact OG-N 3.49Å; R98-L100 PolarHBondContact O-N 2.97Å
99	S	96.3	Very high	95.9	Very high	28 Å²	28	83.8 Å²	83.8	20%	0.196	42%	0.421	C	S	.	.	G	3₁₀ helix	trans	-76.2	-3.9	175.2	-58.1	0	0	0	0	113	K65 V95 S96 K97	K65-S99 WeakPolarHBondContact CB-O 3.16Å; K65-S99 WeakPolarHBondContact CG-O 3.4Å; K65-S99 PolarHBondContact N-O 3.45Å; V95-S99 PolarHBondContact N-OG 2.99Å; S96-S99 VanDerWaalsContact O-CB 3.3Å; S96-S99 WeakPolarHBondContact O-CB 3.25Å; S96-S99 PolarHBondContact O-N 2.99Å; S96-S99 PolarHBondContact O-OG 2.95Å; K97-S99 PolarHBondContact O-N 3.12Å
100	L	97.6	Very high	95.7	Very high	8 Å²	8	81 Å²	81	4%	0.042	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	162.6	178.7	-50.7	174.2	0	0	0	111.1	M62 T63 T64 I76 L80 L94 K97 R98	M62-L100 HydrophobicContact CE-CB 3.62Å; M62-L100 HydrophobicContact CE-CD1 4.15Å; T63-L100 CarbonylContact O-C 3.38Å; T63-L100 WeakPolarHBondContact O-CA 3.32Å; T64-L100 HydrophobicContact CG2-CD2 3.61Å; I76-L100 HydrophobicContact CB-CD1 4.38Å; I76-L100 HydrophobicContact CG1-CD1 3.7Å; I76-L100 HydrophobicContact CG1-CD2 4.1Å; I76-L100 HydrophobicContact CG2-CD1 3.72Å; L80-L100 HydrophobicContact CD1-CD1 3.82Å; L80-L100 HydrophobicContact CD1-CG 4.43Å; L94-L100 HydrophobicContact CD1-CD2 4.28Å; K97-L100 WeakPolarHBondContact O-CB 3.28Å; K97-L100 PolarHBondContact O-N 2.81Å; R98-L100 PolarHBondContact O-N 2.97Å
101	R	97.9	Very high	95.4	Very high	157 Å²	157	82.1 Å²	82.1	59%	0.592	41%	0.412	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.8	144.6	165.9	-67.4	-163.4	-100.2	164.1	-6.7	110.7	M62 T63 K65	M62-R101 WeakPolarHBondContact CA-O 3.5Å; T63-R101 PolarHBondContact N-O 3.49Å; T63-R101 PolarHBondContact O-N 2.9Å; K65-R101 HydrophobicContact CD-CG 4.34Å; K65-R101 HydrophobicContact CG-CG 4.12Å
102	P	98.3	Very high	95.2	Very high	99 Å²	99	82.8 Å²	82.8	64%	0.643	42%	0.419	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60.8	145.7	164.6	-18.8	31.8	0	0	0	110.9	T61 M62	T61-P102 WeakPolarHBondContact O-CA 3.38Å; M62-P102 HydrophobicContact SD-CB 4.16Å; M62-P102 HydrophobicContact SD-CG 3.94Å
103	D	98.2	Very high	94.8	Very high	31 Å²	31	80.7 Å²	80.7	17%	0.166	41%	0.412	C	S	.	.			trans	-125.7	72	179.5	-163.5	-14.2	0	0	0	110.9	T61 T63 R70 N105 F106 D107	T61-D103 HydrophobicContact CG2-CB 4.11Å; T61-D103 PolarHBondContact O-N 2.95Å; T63-D103 WeakPolarHBondContact OG1-CB 3.43Å; T63-D103 PolarHBondContact OG1-OD2 2.95Å; T63-D103 VanDerWaalsContact OG1-OD2 3.13Å; R70-D103 IonicContact NE-OD2 3.98Å; R70-D103 IonicContact NH2-OD2 3.89Å; D103-N105 PolarHBondContact O-N 2.84Å; D103-F106 HydrophobicContact CB-CB 4.16Å; D103-F106 PolarHBondContact O-N 3.3Å; D103-F106 VanDerWaalsContact O-N 3.13Å; D103-F106 PolarHBondContact OD1-N 3.32Å; D103-D107 PolarHBondContact O-N 3.21Å
104	P	97.5	Very high	94.4	Very high	84 Å²	84	75.5 Å²	75.5	55%	0.545	39%	0.388	S	S	.	.	H	α-helix	trans	-66.6	-23.5	-176.3	28	-35.7	0	0	0	112.8	F106 D107 A108	P104-F106 VanDerWaalsContact C-N 3.33Å; P104-D107 PolarHBondContact O-N 2.95Å; P104-A108 WeakPolarHBondContact O-CB 3.5Å; P104-A108 PolarHBondContact O-N 2.86Å
105	N	97.5	Very high	93.7	Very high	133 Å²	133	80.7 Å²	80.7	71%	0.711	42%	0.422	S	S	*	.	H	α-helix	trans	-67.1	-38.7	175	-68.9	-14.6	0	0	0	110.7	D103 A108 L109	D103-N105 PolarHBondContact O-N 2.84Å; N105-A108 PolarHBondContact O-N 3.21Å; N105-L109 PolarHBondContact O-N 3.36Å
106	F	97	Very high	93	Very high	26 Å²	26	79.2 Å²	79.2	11%	0.114	42%	0.416	C	S	.	.	H	α-helix	trans	-69.8	-39	175.7	-157.3	-98.8	0	0	0	112	L49 L58 T61 D103 P104 A108 L109 I110	L49-F106 HydrophobicContact CD2-CE1 3.9Å; L49-F106 HydrophobicContact CD2-CZ 3.65Å; L58-F106 HydrophobicContact CD1-CD1 4.19Å; L58-F106 HydrophobicContact CD1-CE1 3.6Å; T61-F106 HydrophobicContact CG2-CB 4.48Å; T61-F106 HydrophobicContact CG2-CD1 4.06Å; D103-F106 HydrophobicContact CB-CB 4.16Å; D103-F106 PolarHBondContact O-N 3.3Å; D103-F106 VanDerWaalsContact O-N 3.13Å; D103-F106 PolarHBondContact OD1-N 3.32Å; P104-F106 VanDerWaalsContact C-N 3.33Å; F106-A108 VanDerWaalsContact C-N 3.32Å; F106-A108 PolarHBondContact O-N 3.39Å; F106-L109 HydrophobicContact CD2-CD2 4.43Å; F106-L109 HydrophobicContact CE2-CD2 4.42Å; F106-L109 WeakPolarHBondContact O-CB 3.47Å; F106-L109 PolarHBondContact O-N 2.96Å; F106-I110 HydrophobicContact CD1-CD1 3.66Å; F106-I110 HydrophobicContact CD1-CG1 4.22Å; F106-I110 HydrophobicContact CE1-CD1 3.79Å; F106-I110 HydrophobicContact CE1-CG1 4.2Å; F106-I110 WeakPolarHBondContact O-CG1 3.23Å; F106-I110 PolarHBondContact O-N 3.18Å
107	D	95.2	Very high	92.1	Very high	40 Å²	40	78.7 Å²	78.7	21%	0.214	41%	0.406	C	S	.	.	H	α-helix	trans	-61.9	-40.3	173	-68.7	-27.2	0	0	0	111.7	N60 T61 D103 P104 I110 S111	N60-D107 WeakPolarHBondContact CA-OD2 3.24Å; T61-D107 WeakPolarHBondContact CB-OD1 3.31Å; T61-D107 PolarHBondContact N-OD1 3.37Å; T61-D107 PolarHBondContact N-OD2 3.2Å; T61-D107 VanDerWaalsContact N-OD2 3.11Å; T61-D107 PolarHBondContact OG1-OD1 3.17Å; D103-D107 PolarHBondContact O-N 3.21Å; P104-D107 PolarHBondContact O-N 2.95Å; D107-I110 PolarHBondContact O-N 3.43Å; D107-S111 PolarHBondContact O-N 3.22Å; D107-S111 PolarHBondContact O-OG 2.55Å
108	A	95.1	Very high	91.2	Very high	53 Å²	53	78.5 Å²	78.5	44%	0.438	41%	0.412	S	S	.	.	H	α-helix	trans	-65.5	-39.2	175	0	0	0	0	0	112.1	P104 N105 F106 S111 K112	P104-A108 WeakPolarHBondContact O-CB 3.5Å; P104-A108 PolarHBondContact O-N 2.86Å; N105-A108 PolarHBondContact O-N 3.21Å; F106-A108 VanDerWaalsContact C-N 3.32Å; F106-A108 PolarHBondContact O-N 3.39Å; A108-S111 PolarHBondContact O-N 2.88Å; A108-K112 WeakPolarHBondContact O-CG 3.49Å; A108-K112 PolarHBondContact O-N 2.92Å
109	L	93.3	Very high	90.4	Very high	86 Å²	86	75.7 Å²	75.7	45%	0.45	41%	0.407	S	S	.	.	H	α-helix	trans	-62.2	-47.3	174	177.9	62.7	0	0	0	111.3	N105 F106 S111 K112 I113	N105-L109 PolarHBondContact O-N 3.36Å; F106-L109 HydrophobicContact CD2-CD2 4.43Å; F106-L109 HydrophobicContact CE2-CD2 4.42Å; F106-L109 WeakPolarHBondContact O-CB 3.47Å; F106-L109 PolarHBondContact O-N 2.96Å; L109-S111 VanDerWaalsContact C-N 3.26Å; L109-S111 PolarHBondContact O-N 3.43Å; L109-K112 PolarHBondContact O-N 2.96Å; L109-K112 VanDerWaalsContact O-N 3.11Å; L109-I113 HydrophobicContact CD1-CD1 3.94Å; L109-I113 HydrophobicContact CD1-CG1 4.34Å; L109-I113 HydrophobicContact CG-CD1 3.88Å; L109-I113 WeakPolarHBondContact O-CG1 3.41Å; L109-I113 PolarHBondContact O-N 2.97Å
110	I	92.4	Very high	89.2	Confident	5 Å²	5	80.5 Å²	80.5	3%	0.026	42%	0.422	C	S	.	.	H	α-helix	trans	-55.7	-45.3	174.6	-70.8	165.3	0	0	0	110.3	L49 M57 L58 F106 D107 K112 I113 Y114	L49-I110 HydrophobicContact CD2-CG1 3.93Å; M57-I110 HydrophobicContact CG-CG2 4.08Å; M57-I110 HydrophobicContact SD-CG2 3.55Å; M57-I110 VanDerWaalsContact SD-CG2 3.55Å; L58-I110 HydrophobicContact CB-CD1 3.85Å; F106-I110 HydrophobicContact CD1-CD1 3.66Å; F106-I110 HydrophobicContact CD1-CG1 4.22Å; F106-I110 HydrophobicContact CE1-CD1 3.79Å; F106-I110 HydrophobicContact CE1-CG1 4.2Å; F106-I110 WeakPolarHBondContact O-CG1 3.23Å; F106-I110 PolarHBondContact O-N 3.18Å; D107-I110 PolarHBondContact O-N 3.43Å; I110-K112 VanDerWaalsContact C-N 3.27Å; I110-K112 PolarHBondContact O-N 2.91Å; I110-I113 PolarHBondContact O-N 3.49Å; I110-Y114 PolarHBondContact O-N 2.89Å
111	S	91	Very high	88.2	Confident	72 Å²	72	82.2 Å²	82.2	50%	0.503	43%	0.43	S	S	.	.	H	α-helix	trans	-65	-29.2	-180	-54.6	0	0	0	0	113	D107 A108 L109 Y114 P115	D107-S111 PolarHBondContact O-N 3.22Å; D107-S111 PolarHBondContact O-OG 2.55Å; A108-S111 PolarHBondContact O-N 2.88Å; L109-S111 VanDerWaalsContact C-N 3.26Å; L109-S111 PolarHBondContact O-N 3.43Å; S111-Y114 CarbonylContact O-C 3.6Å; S111-P115 VanDerWaalsContact O-CA 3.24Å; S111-P115 WeakPolarHBondContact O-CA 3.46Å
112	K	90.3	Very high	87.3	Confident	177 Å²	177	76.7 Å²	76.7	77%	0.77	42%	0.418	S	S	*	.	H	α-helix	trans	-76.3	-35.3	174.4	-71.9	-67.4	-175.9	-178.8	0	112.6	A108 L109 I110	A108-K112 WeakPolarHBondContact O-CG 3.49Å; A108-K112 PolarHBondContact O-N 2.92Å; L109-K112 PolarHBondContact O-N 2.96Å; L109-K112 VanDerWaalsContact O-N 3.11Å; I110-K112 VanDerWaalsContact C-N 3.27Å; I110-K112 PolarHBondContact O-N 2.91Å
113	I	88.9	Confident	86.4	Confident	43 Å²	43	77 Å²	77	22%	0.221	41%	0.411	C	S	.	.	H	α-helix	trans	-75.9	-34.4	177	-61.1	165.8	0	0	0	110.6	P42 L45 L49 L109 I110	P42-I113 HydrophobicContact CB-CG2 4.11Å; L45-I113 HydrophobicContact CD1-CD1 3.97Å; L45-I113 HydrophobicContact CD1-CG2 4.11Å; L49-I113 HydrophobicContact CD1-CD1 4.15Å; L49-I113 HydrophobicContact CD1-CG2 4.42Å; L109-I113 HydrophobicContact CD1-CD1 3.94Å; L109-I113 HydrophobicContact CD1-CG1 4.34Å; L109-I113 HydrophobicContact CG-CD1 3.88Å; L109-I113 WeakPolarHBondContact O-CG1 3.41Å; L109-I113 PolarHBondContact O-N 2.97Å; I110-I113 PolarHBondContact O-N 3.49Å
114	Y	87	Confident	85.4	Confident	56 Å²	56	80.4 Å²	80.4	22%	0.22	43%	0.425	C	S	.	.			trans	-128.9	77.7	179.9	-64.9	-82	0	0	0	111.8	P42 L49 M57 I110 S111 S116	P42-Y114 HydrophobicContact CB-CE1 3.82Å; P42-Y114 HydrophobicContact CB-CE2 4.4Å; P42-Y114 PolarHBondContact O-OH 2.97Å; L49-Y114 HydrophobicContact CD1-CD2 4.29Å; L49-Y114 HydrophobicContact CD1-CE2 3.69Å; M57-Y114 HydrophobicContact CE-CD1 4.09Å; M57-Y114 HydrophobicContact CE-CD2 3.53Å; M57-Y114 HydrophobicContact CE-CE1 4.12Å; M57-Y114 HydrophobicContact CE-CE2 3.57Å; M57-Y114 HydrophobicContact CE-CG 3.79Å; M57-Y114 HydrophobicContact SD-CD2 3.95Å; M57-Y114 HydrophobicContact SD-CE2 4.44Å; M57-Y114 HydrophobicContact SD-CG 4.28Å; I110-Y114 PolarHBondContact O-N 2.89Å; S111-Y114 CarbonylContact O-C 3.6Å; Y114-S116 VanDerWaalsContact C-N 3.31Å; Y114-S116 PolarHBondContact O-N 2.94Å
115	P	81.5	Confident	84.7	Confident	111 Å²	111	83.3 Å²	83.3	72%	0.721	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-28.3	-175.1	-23.1	34.7	0	0	0	115.2	S111	S111-P115 VanDerWaalsContact O-CA 3.24Å; S111-P115 WeakPolarHBondContact O-CA 3.46Å
116	S	76.6	Confident	84.1	Confident	66 Å²	66	83.5 Å²	83.5	46%	0.462	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.2	40.8	-174.6	47.7	0	0	0	0	112.3	Y114 E119 Y120	Y114-S116 VanDerWaalsContact C-N 3.31Å; Y114-S116 PolarHBondContact O-N 2.94Å; S116-E119 PolarHBondContact O-N 2.88Å; S116-Y120 PolarHBondContact O-N 3.28Å
117	R	74	Confident	83.6	Confident	39 Å²	39	84.7 Å²	84.7	15%	0.147	43%	0.432	C	S	.	.	H	α-helix	trans	-58.1	-49.7	-179.6	179.9	-176.3	175.6	170.9	13.4	112.8	M57 L58 K59 E119 Y120 E121	M57-R117 PolarHBondContact O-NH2 3.31Å; L58-R117 PolarHBondContact O-NH1 3.48Å; K59-R117 VanDerWaalsContact CE-CZ 3.4Å; K59-R117 VanDerWaalsContact CG-NH1 3.34Å; K59-R117 VanDerWaalsContact CG-NH2 3.26Å; R117-E119 PolarHBondContact O-N 3.05Å; R117-Y120 WeakPolarHBondContact O-CB 3.07Å; R117-Y120 PolarHBondContact O-N 3.31Å; R117-E121 HydrophobicContact CG-CG 4.36Å; R117-E121 IonicContact CZ-OE1 3.67Å; R117-E121 VanDerWaalsContact CZ-OE1 3.26Å; R117-E121 IonicContact NE-OE1 2.89Å; R117-E121 PolarHBondContact NE-OE1 3.38Å; R117-E121 IonicContact NH2-OE1 3.72Å; R117-E121 PolarHBondContact NH2-OE1 2.81Å; R117-E121 PolarHBondContact O-N 3.37Å
118	D	73.6	Confident	83	Confident	128 Å²	128	88.6 Å²	88.6	68%	0.684	45%	0.452	S	S	*	.	H	α-helix	trans	-62.3	-34.6	-176.2	-65.6	-20	0	0	0	111.3	A122	D118-A122 WeakPolarHBondContact O-CB 3.34Å; D118-A122 PolarHBondContact O-N 3.24Å
119	E	78.8	Confident	82.4	Confident	148 Å²	148	88.6 Å²	88.6	69%	0.692	45%	0.451	S	S	*	.	H	α-helix	trans	-68.4	-41.1	174.4	-61.9	-177.1	170.4	0	0	111.7	S116 R117 H123	S116-E119 PolarHBondContact O-N 2.88Å; R117-E119 PolarHBondContact O-N 3.05Å; E119-H123 VanDerWaalsContact O-CB 3.27Å; E119-H123 WeakPolarHBondContact O-CB 3.27Å; E119-H123 PolarHBondContact O-N 3.45Å
120	Y	72.4	Confident	81.9	Confident	128 Å²	128	91.6 Å²	91.6	50%	0.502	46%	0.457	S	S	.	.	H	α-helix	trans	-65.4	-46.8	176.9	-170.6	-102.1	0	0	0	111.8	S116 R117 H123 Q124	S116-Y120 PolarHBondContact O-N 3.28Å; R117-Y120 WeakPolarHBondContact O-CB 3.07Å; R117-Y120 PolarHBondContact O-N 3.31Å; Y120-H123 PolarHBondContact O-N 3.07Å; Y120-Q124 HydrophobicContact CD1-CG 4.31Å; Y120-Q124 VanDerWaalsContact CD1-OE1 3.31Å; Y120-Q124 VanDerWaalsContact CE1-CD 3.43Å; Y120-Q124 HydrophobicContact CE1-CG 3.99Å; Y120-Q124 WeakPolarHBondContact O-CG 3.17Å; Y120-Q124 PolarHBondContact O-N 3.41Å
121	E	76.8	Confident	81.4	Confident	45 Å²	45	95.8 Å²	95.8	21%	0.21	48%	0.479	C	S	.	.	H	α-helix	trans	-61.7	-46.9	175.6	-74.6	-172.9	-171	0	0	111	K59 R117 H123 Q124 E125	K59-E121 WeakPolarHBondContact CE-OE1 3.34Å; K59-E121 VanDerWaalsContact NZ-CD 3.3Å; K59-E121 IonicContact NZ-OE1 2.72Å; K59-E121 PolarHBondContact NZ-OE1 3.3Å; K59-E121 VanDerWaalsContact NZ-OE1 3.14Å; K59-E121 IonicContact NZ-OE2 3.68Å; K59-E121 PolarHBondContact NZ-OE2 3.46Å; R117-E121 HydrophobicContact CG-CG 4.36Å; R117-E121 IonicContact CZ-OE1 3.67Å; R117-E121 VanDerWaalsContact CZ-OE1 3.26Å; R117-E121 IonicContact NE-OE1 2.89Å; R117-E121 PolarHBondContact NE-OE1 3.38Å; R117-E121 IonicContact NH2-OE1 3.72Å; R117-E121 PolarHBondContact NH2-OE1 2.81Å; R117-E121 PolarHBondContact O-N 3.37Å; E121-H123 VanDerWaalsContact C-N 3.26Å; E121-H123 PolarHBondContact O-N 3.36Å; E121-Q124 PolarHBondContact O-N 3.19Å; E121-E125 WeakPolarHBondContact O-CB 3.25Å; E121-E125 PolarHBondContact O-N 3.26Å
122	A	79.1	Confident	80.7	Confident	40 Å²	40	95.1 Å²	95.1	33%	0.331	47%	0.474	S	S	.	.	H	α-helix	trans	-62.6	-33.4	176.7	0	0	0	0	0	112.4	D118 R126	D118-A122 WeakPolarHBondContact O-CB 3.34Å; D118-A122 PolarHBondContact O-N 3.24Å; A122-R126 VanDerWaalsContact O-CB 3.25Å; A122-R126 WeakPolarHBondContact O-CB 3.33Å; A122-R126 PolarHBondContact O-N 3.23Å
123	H	78.7	Confident	79.9	Confident	107 Å²	107	95 Å²	95	50%	0.495	47%	0.473	S	S	.	.	H	α-helix	trans	-69.1	-47	173.8	-170.5	90.5	0	0	0	111.7	E119 Y120 E121 E125 R126 V127	E119-H123 VanDerWaalsContact O-CB 3.27Å; E119-H123 WeakPolarHBondContact O-CB 3.27Å; E119-H123 PolarHBondContact O-N 3.45Å; Y120-H123 PolarHBondContact O-N 3.07Å; E121-H123 VanDerWaalsContact C-N 3.26Å; E121-H123 PolarHBondContact O-N 3.36Å; H123-E125 PolarHBondContact O-N 2.85Å; H123-R126 PolarHBondContact O-N 3.46Å; H123-V127 WeakPolarHBondContact O-CG2 3.37Å; H123-V127 PolarHBondContact O-N 3.41Å
124	Q	76.1	Confident	78.8	Confident	101 Å²	101	100.2 Å²	100.2	47%	0.472	50%	0.496	S	S	.	.	H	α-helix	trans	-59.9	-45.2	175.9	-75.3	-172.2	-79.8	0	0	111.7	Y120 E121 R126 V127 L128	Y120-Q124 HydrophobicContact CD1-CG 4.31Å; Y120-Q124 VanDerWaalsContact CD1-OE1 3.31Å; Y120-Q124 VanDerWaalsContact CE1-CD 3.43Å; Y120-Q124 HydrophobicContact CE1-CG 3.99Å; Y120-Q124 WeakPolarHBondContact O-CG 3.17Å; Y120-Q124 PolarHBondContact O-N 3.41Å; E121-Q124 PolarHBondContact O-N 3.19Å; Q124-R126 VanDerWaalsContact C-N 3.33Å; Q124-R126 PolarHBondContact O-N 2.98Å; Q124-V127 PolarHBondContact O-N 2.84Å; Q124-L128 WeakPolarHBondContact O-CB 3.34Å; Q124-L128 PolarHBondContact O-N 3.31Å
125	E	83.6	Confident	77.9	Confident	145 Å²	145	103.1 Å²	103.1	68%	0.678	52%	0.516	S	S	*	.	H	α-helix	trans	-61.7	-42.4	177.7	-170.8	175.7	-162.8	0	0	111.1	E121 H123 V127 L128 A129	E121-E125 WeakPolarHBondContact O-CB 3.25Å; E121-E125 PolarHBondContact O-N 3.26Å; H123-E125 PolarHBondContact O-N 2.85Å; E125-V127 PolarHBondContact O-N 3.23Å; E125-L128 PolarHBondContact O-N 3.28Å; E125-A129 WeakPolarHBondContact O-CB 3.5Å; E125-A129 PolarHBondContact O-N 3.1Å
126	R	85.7	Confident	77.2	Confident	138 Å²	138	103.3 Å²	103.3	52%	0.521	51%	0.511	S	S	.	.	H	α-helix	trans	-62.6	-41.1	175.6	-171	-174.9	-61.4	108.7	-0.9	112.4	A122 H123 Q124 R130	A122-R126 VanDerWaalsContact O-CB 3.25Å; A122-R126 WeakPolarHBondContact O-CB 3.33Å; A122-R126 PolarHBondContact O-N 3.23Å; H123-R126 PolarHBondContact O-N 3.46Å; Q124-R126 VanDerWaalsContact C-N 3.33Å; Q124-R126 PolarHBondContact O-N 2.98Å; R126-R130 WeakPolarHBondContact O-CB 3.26Å; R126-R130 PolarHBondContact O-N 3.06Å
127	V	84.9	Confident	76.7	Confident	51 Å²	51	106.5 Å²	106.5	31%	0.309	52%	0.518	S	S	.	.	H	α-helix	trans	-68.3	-45.8	177.1	171.9	0	0	0	0	110.5	H123 Q124 E125 A129 R130 I131	H123-V127 WeakPolarHBondContact O-CG2 3.37Å; H123-V127 PolarHBondContact O-N 3.41Å; Q124-V127 PolarHBondContact O-N 2.84Å; E125-V127 PolarHBondContact O-N 3.23Å; V127-A129 VanDerWaalsContact C-N 3.35Å; V127-A129 PolarHBondContact O-N 3.4Å; V127-R130 WeakPolarHBondContact O-CB 3.42Å; V127-R130 PolarHBondContact O-N 2.97Å; V127-R130 VanDerWaalsContact O-N 3.11Å; V127-I131 HydrophobicContact CG1-CD1 3.92Å; V127-I131 WeakPolarHBondContact O-CG1 3.12Å; V127-I131 PolarHBondContact O-N 3.34Å
128	L	82.9	Confident	76.4	Confident	122 Å²	122	112.6 Å²	112.6	64%	0.639	55%	0.548	S	S	*	.	H	α-helix	trans	-62.7	-42	178.3	-168.4	71.3	0	0	0	111.3	Q124 E125 R130 I131 S132	Q124-L128 WeakPolarHBondContact O-CB 3.34Å; Q124-L128 PolarHBondContact O-N 3.31Å; E125-L128 PolarHBondContact O-N 3.28Å; L128-R130 VanDerWaalsContact C-N 3.3Å; L128-R130 PolarHBondContact O-N 2.81Å; L128-I131 PolarHBondContact O-N 2.83Å; L128-S132 WeakPolarHBondContact O-CB 3.39Å; L128-S132 PolarHBondContact O-N 3.36Å; L128-S132 PolarHBondContact O-OG 3.37Å
129	A	83.8	Confident	76.3	Confident	52 Å²	52	108.7 Å²	108.7	43%	0.43	53%	0.534	S	S	.	.	H	α-helix	trans	-63.3	-35.2	173.9	0	0	0	0	0	112.4	E125 V127 S132 K133	E125-A129 WeakPolarHBondContact O-CB 3.5Å; E125-A129 PolarHBondContact O-N 3.1Å; V127-A129 VanDerWaalsContact C-N 3.35Å; V127-A129 PolarHBondContact O-N 3.4Å; A129-S132 WeakPolarHBondContact CA-OG 3.44Å; A129-S132 PolarHBondContact O-OG 3.07Å; A129-K133 VanDerWaalsContact O-CB 3.24Å; A129-K133 WeakPolarHBondContact O-CB 3.17Å; A129-K133 PolarHBondContact O-N 3.03Å; A129-K133 VanDerWaalsContact O-N 3.11Å
130	R	82.6	Confident	76.3	Confident	149 Å²	149	106.7 Å²	106.7	56%	0.562	53%	0.527	S	S	*	.	H	α-helix	trans	-67.1	-43.8	173.7	-174.5	-179.2	-65.5	146.9	-1.7	111.1	R126 V127 L128 K133 H134	R126-R130 WeakPolarHBondContact O-CB 3.26Å; R126-R130 PolarHBondContact O-N 3.06Å; V127-R130 WeakPolarHBondContact O-CB 3.42Å; V127-R130 PolarHBondContact O-N 2.97Å; V127-R130 VanDerWaalsContact O-N 3.11Å; L128-R130 VanDerWaalsContact C-N 3.3Å; L128-R130 PolarHBondContact O-N 2.81Å; R130-K133 PolarHBondContact O-N 2.92Å; R130-H134 PolarHBondContact O-N 3.29Å; R130-H134 VanDerWaalsContact O-N 3.1Å; R130-H134 PolarHBondContact O-ND1 2.72Å
131	I	81.4	Confident	76.6	Confident	94 Å²	94	103.7 Å²	103.7	48%	0.482	53%	0.525	S	S	.	.	H	α-helix	trans	-65.6	-47.4	178.4	-66.8	167.5	0	0	0	110.4	V127 L128 K133 H134 N135	V127-I131 HydrophobicContact CG1-CD1 3.92Å; V127-I131 WeakPolarHBondContact O-CG1 3.12Å; V127-I131 PolarHBondContact O-N 3.34Å; L128-I131 PolarHBondContact O-N 2.83Å; I131-K133 PolarHBondContact O-N 3.37Å; I131-H134 PolarHBondContact O-N 3.23Å; I131-H134 VanDerWaalsContact O-N 3.08Å; I131-N135 WeakPolarHBondContact O-CB 3.19Å; I131-N135 PolarHBondContact O-N 3.49Å
132	S	77.1	Confident	76.8	Confident	57 Å²	57	106.6 Å²	106.6	40%	0.399	54%	0.539	S	S	.	.	H	α-helix	trans	-60.2	-35.9	178.6	67.4	0	0	0	0	112.1	L128 A129	L128-S132 WeakPolarHBondContact O-CB 3.39Å; L128-S132 PolarHBondContact O-N 3.36Å; L128-S132 PolarHBondContact O-OG 3.37Å; A129-S132 WeakPolarHBondContact CA-OG 3.44Å; A129-S132 PolarHBondContact O-OG 3.07Å
133	K	72.8	Confident	77.1	Confident	175 Å²	175	108.4 Å²	108.4	76%	0.761	55%	0.548	S	S	*	.	H	α-helix	trans	-70	-32.6	175.4	-172.2	176.3	-179.7	-179.7	0	113.8	A129 R130 I131	A129-K133 VanDerWaalsContact O-CB 3.24Å; A129-K133 WeakPolarHBondContact O-CB 3.17Å; A129-K133 PolarHBondContact O-N 3.03Å; A129-K133 VanDerWaalsContact O-N 3.11Å; R130-K133 PolarHBondContact O-N 2.92Å; I131-K133 PolarHBondContact O-N 3.37Å
134	H	66.6	Low	77.4	Confident	153 Å²	153	107.8 Å²	107.8	71%	0.708	55%	0.548	S	S	*	.	H	α-helix	trans	-91	-18	179.8	-74.1	77.8	0	0	0	113.3	R130 I131	R130-H134 PolarHBondContact O-N 3.29Å; R130-H134 VanDerWaalsContact O-N 3.1Å; R130-H134 PolarHBondContact O-ND1 2.72Å; I131-H134 PolarHBondContact O-N 3.23Å; I131-H134 VanDerWaalsContact O-N 3.08Å
135	N	67.1	Low	78.1	Confident	117 Å²	117	109.4 Å²	109.4	63%	0.626	56%	0.556	S	S	*	*	S	Bend	trans	-70.1	147.2	169.5	-118.4	-6.7	0	0	0	109.4	I131 Q137	I131-N135 WeakPolarHBondContact O-CB 3.19Å; I131-N135 PolarHBondContact O-N 3.49Å; N135-Q137 PolarHBondContact O-N 3.34Å
136	N	67	Low	78.2	Confident	115 Å²	115	107.5 Å²	107.5	62%	0.615	55%	0.546	S	S	*	.	S	Bend	trans	-70.5	41	-165.5	-157.3	11.7	0	0	0	114.8	Q138 A139 L140	N136-Q138 PolarHBondContact O-N 3.19Å; N136-A139 VanDerWaalsContact CG-CB 3.47Å; N136-A139 WeakPolarHBondContact ND2-CB 3.48Å; N136-A139 PolarHBondContact O-N 2.83Å; N136-A139 WeakPolarHBondContact OD1-CB 3.43Å; N136-A139 PolarHBondContact OD1-N 2.85Å; N136-L140 WeakPolarHBondContact O-CB 3.15Å; N136-L140 PolarHBondContact O-N 3.06Å
137	Q	65.8	Low	78.4	Confident	132 Å²	132	102.1 Å²	102.1	62%	0.617	53%	0.534	S	S	*	.	H	α-helix	trans	-62.1	-33.7	-179.2	-172.7	144	43.2	0	0	111.3	N135 S141	N135-Q137 PolarHBondContact O-N 3.34Å; Q137-S141 VanDerWaalsContact O-CB 3.24Å; Q137-S141 WeakPolarHBondContact O-CB 3.49Å; Q137-S141 PolarHBondContact O-N 3.42Å; Q137-S141 PolarHBondContact O-OG 3.43Å; Q137-S141 VanDerWaalsContact O-OG 3.06Å
138	Q	67	Low	78.6	Confident	167 Å²	167	104.9 Å²	104.9	78%	0.78	55%	0.546	S	S	*	.	H	α-helix	trans	-66.8	-48.9	175.5	-70.5	-177.3	-4.6	0	0	112.1	N136 L140 S141 H142	N136-Q138 PolarHBondContact O-N 3.19Å; Q138-L140 PolarHBondContact O-N 2.88Å; Q138-S141 WeakPolarHBondContact CA-OG 3.43Å; Q138-S141 PolarHBondContact O-N 3.06Å; Q138-S141 PolarHBondContact O-OG 2.83Å; Q138-H142 WeakPolarHBondContact O-CB 3.46Å; Q138-H142 PolarHBondContact O-N 3.25Å
139	A	72.8	Confident	79	Confident	46 Å²	46	105.3 Å²	105.3	38%	0.38	54%	0.543	S	S	.	.	H	α-helix	trans	-70.2	-32.3	178.1	0	0	0	0	0	112.7	N136 S143	N136-A139 VanDerWaalsContact CG-CB 3.47Å; N136-A139 WeakPolarHBondContact ND2-CB 3.48Å; N136-A139 PolarHBondContact O-N 2.83Å; N136-A139 WeakPolarHBondContact OD1-CB 3.43Å; N136-A139 PolarHBondContact OD1-N 2.85Å; A139-S143 VanDerWaalsContact O-CB 3.24Å; A139-S143 WeakPolarHBondContact O-CB 3.3Å; A139-S143 PolarHBondContact O-N 2.99Å
140	L	78.5	Confident	79	Confident	107 Å²	107	107.3 Å²	107.3	56%	0.56	55%	0.546	S	S	*	.	H	α-helix	trans	-63.7	-46.4	172.1	-178.7	61.1	0	0	0	110.9	N136 Q138 H142 S143 I144	N136-L140 WeakPolarHBondContact O-CB 3.15Å; N136-L140 PolarHBondContact O-N 3.06Å; Q138-L140 PolarHBondContact O-N 2.88Å; L140-H142 PolarHBondContact O-N 3.01Å; L140-S143 PolarHBondContact O-N 3.49Å; L140-I144 HydrophobicContact CD1-CD1 3.93Å; L140-I144 HydrophobicContact CD1-CG1 4.29Å; L140-I144 HydrophobicContact CG-CD1 3.88Å; L140-I144 WeakPolarHBondContact O-CB 3.49Å; L140-I144 VanDerWaalsContact O-CG1 3.25Å; L140-I144 WeakPolarHBondContact O-CG1 3.4Å; L140-I144 PolarHBondContact O-N 2.73Å
141	S	78	Confident	79.2	Confident	65 Å²	65	105.6 Å²	105.6	46%	0.455	54%	0.544	S	S	.	.	H	α-helix	trans	-61.9	-42.4	177.3	66.1	0	0	0	0	112.4	Q137 Q138 I144 E145	Q137-S141 VanDerWaalsContact O-CB 3.24Å; Q137-S141 WeakPolarHBondContact O-CB 3.49Å; Q137-S141 PolarHBondContact O-N 3.42Å; Q137-S141 PolarHBondContact O-OG 3.43Å; Q137-S141 VanDerWaalsContact O-OG 3.06Å; Q138-S141 WeakPolarHBondContact CA-OG 3.43Å; Q138-S141 PolarHBondContact O-N 3.06Å; Q138-S141 PolarHBondContact O-OG 2.83Å; S141-I144 PolarHBondContact O-N 3.38Å; S141-E145 WeakPolarHBondContact O-CB 3.43Å; S141-E145 PolarHBondContact O-N 2.98Å
142	H	81.6	Confident	79.4	Confident	106 Å²	106	103.5 Å²	103.5	49%	0.491	54%	0.541	S	S	.	.	H	α-helix	trans	-65.7	-42.2	177.4	-171.4	-84	0	0	0	112	Q138 L140 E145 E146	Q138-H142 WeakPolarHBondContact O-CB 3.46Å; Q138-H142 PolarHBondContact O-N 3.25Å; L140-H142 PolarHBondContact O-N 3.01Å; H142-E145 PolarHBondContact O-N 3.46Å; H142-E146 VanDerWaalsContact CE1-CD 3.49Å; H142-E146 IonicContact CE1-OE1 3.26Å; H142-E146 IonicContact CE1-OE2 2.97Å; H142-E146 WeakPolarHBondContact O-CB 3.15Å; H142-E146 WeakPolarHBondContact O-CG 3.39Å; H142-E146 PolarHBondContact O-N 2.83Å
143	S	85.2	Confident	79.7	Confident	77 Å²	77	105.6 Å²	105.6	54%	0.538	55%	0.545	S	S	.	.	H	α-helix	trans	-63.6	-41.4	176.5	-178.1	0	0	0	0	112.2	A139 L140 G147	A139-S143 VanDerWaalsContact O-CB 3.24Å; A139-S143 WeakPolarHBondContact O-CB 3.3Å; A139-S143 PolarHBondContact O-N 2.99Å; L140-S143 PolarHBondContact O-N 3.49Å; S143-G147 PolarHBondContact O-N 2.94Å
144	I	85.9	Confident	80	Confident	95 Å²	95	101.5 Å²	101.5	49%	0.487	53%	0.532	S	S	.	.	H	α-helix	trans	-65.3	-45.1	176	-68.8	167.8	0	0	0	110.8	L140 S141 G147 L148	L140-I144 HydrophobicContact CD1-CD1 3.93Å; L140-I144 HydrophobicContact CD1-CG1 4.29Å; L140-I144 HydrophobicContact CG-CD1 3.88Å; L140-I144 WeakPolarHBondContact O-CB 3.49Å; L140-I144 VanDerWaalsContact O-CG1 3.25Å; L140-I144 WeakPolarHBondContact O-CG1 3.4Å; L140-I144 PolarHBondContact O-N 2.73Å; S141-I144 PolarHBondContact O-N 3.38Å; I144-G147 PolarHBondContact O-N 2.87Å; I144-L148 HydrophobicContact CG2-CD1 3.89Å; I144-L148 PolarHBondContact O-N 2.87Å
145	E	89.3	Confident	80.7	Confident	135 Å²	135	103.5 Å²	103.5	63%	0.631	53%	0.533	S	S	*	.	H	α-helix	trans	-64.6	-44.1	179.3	-174.6	170.3	-161	0	0	112.1	S141 H142 L148 K149	S141-E145 WeakPolarHBondContact O-CB 3.43Å; S141-E145 PolarHBondContact O-N 2.98Å; H142-E145 PolarHBondContact O-N 3.46Å; E145-L148 PolarHBondContact O-N 2.87Å; E145-K149 WeakPolarHBondContact O-CB 3.49Å; E145-K149 PolarHBondContact O-N 2.91Å
146	E	86.2	Confident	80.9	Confident	104 Å²	104	104.4 Å²	104.4	49%	0.486	54%	0.537	S	S	.	.	H	α-helix	trans	-63.8	-40.6	173.8	-75.7	-150.8	141.6	0	0	112.1	H142 L148 K149 I150	H142-E146 VanDerWaalsContact CE1-CD 3.49Å; H142-E146 IonicContact CE1-OE1 3.26Å; H142-E146 IonicContact CE1-OE2 2.97Å; H142-E146 WeakPolarHBondContact O-CB 3.15Å; H142-E146 WeakPolarHBondContact O-CG 3.39Å; H142-E146 PolarHBondContact O-N 2.83Å; E146-L148 PolarHBondContact O-N 3.09Å; E146-K149 PolarHBondContact O-N 2.81Å; E146-I150 WeakPolarHBondContact O-CB 3.21Å; E146-I150 VanDerWaalsContact O-CG1 3.27Å; E146-I150 WeakPolarHBondContact O-CG1 3.25Å; E146-I150 PolarHBondContact O-N 2.83Å
147	G	88.9	Confident	80.8	Confident	25 Å²	25	105.1 Å²	105.1	26%	0.258	54%	0.537	S	S	.	.	H	α-helix	trans	-59.1	-46.3	174.8	0	0	0	0	0	112.5	S143 I144 K149 I150 Q151	S143-G147 PolarHBondContact O-N 2.94Å; I144-G147 PolarHBondContact O-N 2.87Å; G147-K149 VanDerWaalsContact C-N 3.34Å; G147-K149 PolarHBondContact O-N 2.94Å; G147-I150 PolarHBondContact O-N 2.92Å; G147-Q151 WeakPolarHBondContact O-CB 3.08Å; G147-Q151 WeakPolarHBondContact O-CG 3.29Å; G147-Q151 PolarHBondContact O-N 3.43Å
148	L	90.4	Very high	80.5	Confident	109 Å²	109	108.8 Å²	108.8	57%	0.571	55%	0.545	S	S	*	.	H	α-helix	trans	-60.5	-41.9	174.4	-86	152.5	0	0	0	111.9	I144 E145 E146 Q151 A152	I144-L148 HydrophobicContact CG2-CD1 3.89Å; I144-L148 PolarHBondContact O-N 2.87Å; E145-L148 PolarHBondContact O-N 2.87Å; E146-L148 PolarHBondContact O-N 3.09Å; L148-Q151 PolarHBondContact O-N 2.95Å; L148-A152 WeakPolarHBondContact O-CB 3.45Å; L148-A152 PolarHBondContact O-N 2.78Å
149	K	90.1	Very high	80	Confident	131 Å²	131	103 Å²	103	57%	0.57	53%	0.531	S	S	*	.	H	α-helix	trans	-67.1	-43.1	179.5	-167.1	175.3	-176.8	177.9	0	112.3	E145 E146 G147 A152 M153	E145-K149 WeakPolarHBondContact O-CB 3.49Å; E145-K149 PolarHBondContact O-N 2.91Å; E146-K149 PolarHBondContact O-N 2.81Å; G147-K149 VanDerWaalsContact C-N 3.34Å; G147-K149 PolarHBondContact O-N 2.94Å; K149-A152 PolarHBondContact O-N 3.45Å; K149-M153 HydrophobicContact CG-CE 4.31Å; K149-M153 WeakPolarHBondContact O-CG 3.39Å; K149-M153 PolarHBondContact O-N 3.29Å
150	I	84.5	Confident	79.2	Confident	94 Å²	94	108.8 Å²	108.8	48%	0.482	55%	0.548	S	S	.	.	H	α-helix	trans	-64.3	-43.1	176.1	-68.4	165.5	0	0	0	110.3	E146 G147 A152 M153 N154	E146-I150 WeakPolarHBondContact O-CB 3.21Å; E146-I150 VanDerWaalsContact O-CG1 3.27Å; E146-I150 WeakPolarHBondContact O-CG1 3.25Å; E146-I150 PolarHBondContact O-N 2.83Å; G147-I150 PolarHBondContact O-N 2.92Å; I150-A152 VanDerWaalsContact C-N 3.33Å; I150-A152 PolarHBondContact O-N 3.31Å; I150-M153 PolarHBondContact O-N 2.75Å; I150-N154 WeakPolarHBondContact O-CB 3.44Å; I150-N154 VanDerWaalsContact O-CG 3.3Å; I150-N154 PolarHBondContact O-N 3.48Å; I150-N154 PolarHBondContact O-ND2 3.26Å
151	Q	86.9	Confident	77.9	Confident	114 Å²	114	112 Å²	112	53%	0.533	56%	0.557	S	S	.	*	H	α-helix	trans	-61.5	-40.8	175.3	-72.1	175	26.7	0	0	111.9	G147 L148 R155	G147-Q151 WeakPolarHBondContact O-CB 3.08Å; G147-Q151 WeakPolarHBondContact O-CG 3.29Å; G147-Q151 PolarHBondContact O-N 3.43Å; L148-Q151 PolarHBondContact O-N 2.95Å; Q151-R155 WeakPolarHBondContact O-CG 3.18Å; Q151-R155 PolarHBondContact O-N 3.06Å; Q151-R155 VanDerWaalsContact O-N 3.1Å
152	A	86.7	Confident	76.5	Confident	50 Å²	50	116.3 Å²	116.3	41%	0.413	57%	0.57	S	S	.	*	H	α-helix	trans	-65	-43.2	175.5	0	0	0	0	0	112.4	L148 K149 I150 R155 L156	L148-A152 WeakPolarHBondContact O-CB 3.45Å; L148-A152 PolarHBondContact O-N 2.78Å; K149-A152 PolarHBondContact O-N 3.45Å; I150-A152 VanDerWaalsContact C-N 3.33Å; I150-A152 PolarHBondContact O-N 3.31Å; A152-R155 PolarHBondContact O-N 2.81Å; A152-L156 PolarHBondContact O-N 2.67Å
153	M	82	Confident	75	Confident	100 Å²	100	119.5 Å²	119.5	49%	0.493	59%	0.585	S	S	.	*	H	α-helix	trans	-64.1	-41.5	176.4	-73.3	-172	176.9	0	0	112.4	K149 I150 R155 L156 Q157	K149-M153 HydrophobicContact CG-CE 4.31Å; K149-M153 WeakPolarHBondContact O-CG 3.39Å; K149-M153 PolarHBondContact O-N 3.29Å; I150-M153 PolarHBondContact O-N 2.75Å; M153-R155 VanDerWaalsContact C-N 3.33Å; M153-R155 PolarHBondContact O-N 2.97Å; M153-L156 PolarHBondContact O-N 3.14Å; M153-Q157 PolarHBondContact O-N 3.09Å
154	N	79.8	Confident	73.4	Confident	89 Å²	89	123 Å²	123	48%	0.476	60%	0.596	S	S	.	*	H	α-helix	trans	-65.9	-34.1	177.5	-73.2	-19.9	0	0	0	112.4	I150 Q157 R158	I150-N154 WeakPolarHBondContact O-CB 3.44Å; I150-N154 VanDerWaalsContact O-CG 3.3Å; I150-N154 PolarHBondContact O-N 3.48Å; I150-N154 PolarHBondContact O-ND2 3.26Å; N154-Q157 PolarHBondContact O-N 3.36Å; N154-R158 WeakPolarHBondContact O-CB 3.28Å; N154-R158 PolarHBondContact O-N 2.94Å; N154-R158 VanDerWaalsContact O-N 3.09Å
155	R	81.4	Confident	71.5	Confident	195 Å²	195	126.7 Å²	126.7	74%	0.736	61%	0.611	S	S	*	*	H	α-helix	trans	-62.6	-41.5	172.4	-73.9	175.1	-174.4	-142.4	3.6	111.9	Q151 A152 M153 G159	Q151-R155 WeakPolarHBondContact O-CG 3.18Å; Q151-R155 PolarHBondContact O-N 3.06Å; Q151-R155 VanDerWaalsContact O-N 3.1Å; A152-R155 PolarHBondContact O-N 2.81Å; M153-R155 VanDerWaalsContact C-N 3.33Å; M153-R155 PolarHBondContact O-N 2.97Å; R155-G159 PolarHBondContact O-N 3.2Å
156	L	71.3	Confident	69.2	Low	136 Å²	136	127.7 Å²	127.7	71%	0.712	62%	0.621	S	S	*	*	H	α-helix	trans	-69.1	-37.6	178.5	-70.2	164.6	0	0	0	112.8	A152 M153	A152-L156 PolarHBondContact O-N 2.67Å; M153-L156 PolarHBondContact O-N 3.14Å
157	Q	65.6	Low	66.9	Low	131 Å²	131	126 Å²	126	61%	0.612	63%	0.631	S	S	*	*	H	α-helix	trans	-70.9	-33.9	177.4	-70.5	-177.6	8.8	0	0	112.7	M153 N154 G159 K160 K161	M153-Q157 PolarHBondContact O-N 3.09Å; N154-Q157 PolarHBondContact O-N 3.36Å; Q157-G159 VanDerWaalsContact C-N 3.31Å; Q157-G159 PolarHBondContact O-N 3.03Å; Q157-K160 PolarHBondContact O-N 3.2Å; Q157-K160 VanDerWaalsContact O-N 3.13Å; Q157-K161 PolarHBondContact O-N 3.37Å
158	R	58.9	Low	64.6	Low	208 Å²	208	131 Å²	131	79%	0.785	66%	0.663	S	S	*	*	H	α-helix	trans	-68.3	-29.8	178.6	-154.8	169.3	166.4	-168.7	-5.6	112.6	N154 K160	N154-R158 WeakPolarHBondContact O-CB 3.28Å; N154-R158 PolarHBondContact O-N 2.94Å; N154-R158 VanDerWaalsContact O-N 3.09Å; R158-K160 VanDerWaalsContact C-N 3.34Å
159	G	56.9	Low	61.9	Low	47 Å²	47	129.5 Å²	129.5	49%	0.485	67%	0.673	S	S	.	*	H	α-helix	trans	-70.5	-24.8	170.8	0	0	0	0	0	114.4	R155 Q157	R155-G159 PolarHBondContact O-N 3.2Å; Q157-G159 VanDerWaalsContact C-N 3.31Å; Q157-G159 PolarHBondContact O-N 3.03Å
160	K	55.4	Low	59.4	Low	167 Å²	167	127.4 Å²	127.4	73%	0.726	68%	0.68	S	S	*	*	H	α-helix	trans	-82.2	-22.4	179.3	-121.5	177	-179.8	-179.7	0	113.6	Q157 R158	Q157-K160 PolarHBondContact O-N 3.2Å; Q157-K160 VanDerWaalsContact O-N 3.13Å; R158-K160 VanDerWaalsContact C-N 3.34Å
161	K	50.3	Low	57.4	Low	174 Å²	174	132 Å²	132	76%	0.757	70%	0.699	S	S	*	*	H	α-helix	trans	-80.5	-18.3	179.1	-153	176.5	-179.3	-175.6	0	113.3	Q157 Q163	Q157-K161 PolarHBondContact O-N 3.37Å; K161-Q163 VanDerWaalsContact C-N 3.29Å; K161-Q163 PolarHBondContact O-N 3.38Å
162	Q	50.1	Low	54.9	Low	156 Å²	156	132.4 Å²	132.4	73%	0.729	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.8	-3	176.2	-90.7	174.3	-13.7	0	0	114.7
163	Q	48.7	Very low	52.8	Low	173 Å²	173	136.6 Å²	136.6	81%	0.808	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.8	-3.9	177.4	-98.7	-176.3	-2.8	0	0	115	K161	K161-Q163 VanDerWaalsContact C-N 3.29Å; K161-Q163 PolarHBondContact O-N 3.38Å
164	I	52	Low	50.5	Low	151 Å²	151	135.6 Å²	135.6	77%	0.774	74%	0.736	S	S	*	*	S	Bend	trans	-105.3	-17.8	-176.7	-63.4	177.4	0	0	0	113.1
165	E	46.8	Very low	48.2	Very low	171 Å²	171	138.4 Å²	138.4	80%	0.799	75%	0.751	S	S	*	*			trans	-123.4	76.4	175	-75.6	-177.6	147.7	0	0	110.2
166	N	41.1	Very low	46.5	Very low	157 Å²	157	133.7 Å²	133.7	84%	0.84	75%	0.748	S	S	*	*			trans	-135	71.9	161.8	-102	-4.6	0	0	0	108.7
167	G	38.1	Very low	45.1	Very low	67 Å²	67	132.4 Å²	132.4	69%	0.691	75%	0.75	S	S	*	*			trans	-108.2	108.7	156.5	0	0	0	0	0	108.9
168	S	38.9	Very low	43.7	Very low	132 Å²	132	134.3 Å²	134.3	92%	0.923	76%	0.759	S	S	*	*			trans	83.7	123.5	147.8	-44.6	0	0	0	0	119.8
169	G	34.3	Very low	42.4	Very low	76 Å²	76	130.1 Å²	130.1	78%	0.784	76%	0.76	S	S	*	*			trans	98.7	91.1	151.2	0	0	0	0	0	115.1
170	A	38.8	Very low	41.4	Very low	88 Å²	88	133.3 Å²	133.3	73%	0.727	78%	0.775	S	S	*	*				76.4	107.9	78	0	0	0	0	0	114.5
171	E	41.3	Very low	40.6	Very low	189 Å²	189	133.5 Å²	133.5	88%	0.883	78%	0.784	S	S	*	*			trans	65.2	137	141.2	-51	175	-178.4	0	0	116.6
172	D	35.2	Very low	39.7	Very low	124 Å²	124	129.3 Å²	129.3	66%	0.663	78%	0.782	S	S	*	*			cis	-178.8	151.1	45.9	-175.6	31.4	0	0	0	110.7
173	N	42.2	Very low	39	Very low	138 Å²	138	127 Å²	127	74%	0.738	78%	0.783	S	S	*	*			trans	52.1	121.3	155.8	-71	-30.7	0	0	0	121.2
174	G	34.2	Very low	38.3	Very low	78 Å²	78	123.7 Å²	123.7	80%	0.804	78%	0.775	S	S	*	*				96.4	137.5	67.8	0	0	0	0	0	107.8
175	D	31.5	Very low	37.4	Very low	149 Å²	149	124.7 Å²	124.7	80%	0.797	78%	0.776	S	S	*	*			cis	-165	164.9	15	177.4	25.8	0	0	0	107.5
176	S	45	Very low	36.8	Very low	95 Å²	95	121.7 Å²	121.7	66%	0.664	77%	0.774	S	S	*	*			trans	-63.1	169	-179.4	-20.3	0	0	0	0	116.8
177	S	41.5	Very low	36.3	Very low	109 Å²	109	121.3 Å²	121.3	76%	0.762	77%	0.772	S	S	*	*			trans	98.5	98.3	144.1	76	0	0	0	0	120.4
178	H	36	Very low	36.2	Very low	171 Å²	171	127.3 Å²	127.3	79%	0.792	78%	0.782	S	S	*	*				23.9	118	111	-162.6	-69.5	0	0	0	119
179	C	32.2	Very low	35.9	Very low	121 Å²	121	129.8 Å²	129.8	82%	0.818	78%	0.779	S	S	*	*				175.2	163.8	118	58.7	0	0	0	0	113.9
180	S	36.8	Very low	35.8	Very low	113 Å²	113	131 Å²	131	79%	0.79	78%	0.782	S	S	*	*			trans	-75.8	160.4	-156.2	-45.9	0	0	0	0	118.5
181	N	36.7	Very low	35.2	Very low	171 Å²	171	130.4 Å²	130.4	91%	0.914	78%	0.784	S	S	*	*			trans	-78	144	172.9	-109.9	-1.2	0	0	0	113.7
182	A	31.8	Very low	35.2	Very low	87 Å²	87	127.5 Å²	127.5	72%	0.719	78%	0.781	S	S	*	*			trans	-152.5	124.7	151.5	0	0	0	0	0	111.1
183	S	35.2	Very low	34.9	Very low	107 Å²	107	126.3 Å²	126.3	75%	0.748	78%	0.783	S	S	*	*			trans	55.7	135.1	136.8	-52.7	0	0	0	0	119.2
184	T	34.5	Very low	34.4	Very low	104 Å²	104	126.5 Å²	126.5	64%	0.638	78%	0.784	S	S	*	*			cis	169.1	163.3	33.2	18.1	0	0	0	0	110.5
185	H	34.2	Very low	34.2	Very low	171 Å²	171	131.9 Å²	131.9	79%	0.792	79%	0.785	S	S	*	*			trans	74.1	147.2	158.3	-57.1	-56.4	0	0	0	118.6
186	S	33.2	Very low	34.2	Very low	109 Å²	109	136.3 Å²	136.3	76%	0.762	79%	0.791	S	S	*	*			cis	-168.1	170.6	9.9	-115.9	0	0	0	0	112.1
187	N	31	Very low	33.4	Very low	149 Å²	149	138.4 Å²	138.4	80%	0.797	80%	0.8	S	S	*	*			trans	-57.2	156	-172.8	-60.5	-41.8	0	0	0	120.3
188	Q	36	Very low	32.9	Very low	192 Å²	192	143 Å²	143	90%	0.897	81%	0.806	S	S	*	*				176.2	159.8	109.5	-96.4	175.3	18.7	0	0	116.5
189	E	31.2	Very low	32.7	Very low	184 Å²	184	140.6 Å²	140.6	86%	0.86	80%	0.804	S	S	*	*			trans	-51.6	152	-163.2	-57.6	-172.6	124.3	0	0	123.7
190	A	33.1	Very low	32.7	Very low	103 Å²	103	139.2 Å²	139.2	85%	0.851	80%	0.795	S	S	*	*				176.6	134.6	115.7	0	0	0	0	0	112.8
191	G	27.3	Very low	32.3	Very low	75 Å²	75	141.1 Å²	141.1	77%	0.773	80%	0.797	S	S	*	*			trans	-93.4	-164.6	172.7	0	0	0	0	0	113.7
192	P	40.5	Very low	31.9	Very low	128 Å²	128	140 Å²	140	83%	0.831	79%	0.79	S	S	*	*			cis	-138.5	157.8	10.1	39.5	-19.5	0	0	0	118.6
193	S	29.6	Very low	32.2	Very low	99 Å²	99	140.9 Å²	140.9	69%	0.692	79%	0.791	S	S	*	*			trans	48.6	114.9	138.5	-143.8	0	0	0	0	123.9
194	N	31.2	Very low	31.9	Very low	142 Å²	142	138.8 Å²	138.8	76%	0.759	79%	0.787	S	S	*	*				180	122.8	108.5	-93.4	-40.9	0	0	0	115.1
195	K	30.6	Very low	31.6	Very low	191 Å²	191	141.3 Å²	141.3	83%	0.83	80%	0.796	S	S	*	*			trans	63.5	99.9	147.2	-68.5	-178.4	178.4	177.3	0	123.5
196	R	30.4	Very low	31.4	Very low	241 Å²	241	140.9 Å²	140.9	91%	0.909	79%	0.794	S	S	*	*			trans	35.3	128.9	132.5	-78.4	-177.8	172.8	178.7	-2.9	119.1
197	T	29	Very low	31.6	Very low	140 Å²	140	144 Å²	144	86%	0.859	80%	0.801	S	S	*	*				-157.9	137.4	56.3	32.9	0	0	0	0	110.1
198	K	31.1	Very low	31.5	Very low	204 Å²	204	144.5 Å²	144.5	89%	0.887	80%	0.804	S	S	*	*			trans	-111.7	130.7	-169.2	-158.4	-177.8	179	-173.6	0	109.3
199	T	31.5	Very low	31.7	Very low	122 Å²	122	142.2 Å²	142.2	75%	0.748	80%	0.798	S	S	*	*			trans	-79.8	166.1	163.9	49.8	0	0	0	0	110.7
200	S	31	Very low	31.7	Very low	91 Å²	91	140.5 Å²	140.5	64%	0.636	80%	0.795	S	S	*	*			trans	74.8	118.6	163.8	58.8	0	0	0	0	120.1
201	D	29	Very low	32.2	Very low	154 Å²	154	143.1 Å²	143.1	82%	0.824	79%	0.794	S	S	*	*			trans	78.4	106.1	130.2	-55.2	-17.4	0	0	0	120.3
202	D	28.7	Very low	32.3	Very low	146 Å²	146	145.6 Å²	145.6	78%	0.781	80%	0.795	S	S	*	*				136.6	131.7	100.5	-169.2	33	0	0	0	113.8
203	S	37.8	Very low	32.2	Very low	106 Å²	106	145.6 Å²	145.6	74%	0.741	79%	0.793	S	S	*	*			trans	62.2	109.5	154.8	-71.2	0	0	0	0	120.9
204	G	28.3	Very low	32.3	Very low	64 Å²	64	147.3 Å²	147.3	66%	0.66	80%	0.798	S	S	*	*			trans	166.2	117	142.8	0	0	0	0	0	115
205	L	30	Very low	32.3	Very low	157 Å²	157	144.4 Å²	144.4	82%	0.822	79%	0.794	S	S	*	*			trans	73.9	152.2	154.7	-43.3	176.6	0	0	0	113.7
206	E	28.8	Very low	32.8	Very low	161 Å²	161	142.7 Å²	142.7	75%	0.752	79%	0.793	S	S	*	*			cis	-165.7	153	-7.5	-117.4	176.9	-174.4	0	0	104.6	D208	E206-D208 PolarHBondContact O-N 2.67Å
207	L	38.2	Very low	32.9	Very low	175 Å²	175	138 Å²	138	92%	0.916	79%	0.786	S	S	*	*			trans	-79.8	109.5	-179.1	-149.1	88.2	0	0	0	108.6
208	D	28.9	Very low	33.6	Very low	159 Å²	159	135.8 Å²	135.8	85%	0.85	77%	0.773	S	S	*	*			trans	-121.6	127.6	161.1	-87.9	-29.4	0	0	0	110.9	E206	E206-D208 PolarHBondContact O-N 2.67Å
209	N	39.4	Very low	34	Very low	145 Å²	145	132.9 Å²	132.9	78%	0.775	77%	0.772	S	S	*	*			trans	-28	130.8	175.4	-91.7	-24.8	0	0	0	116.8
210	N	30.8	Very low	34.5	Very low	148 Å²	148	134.4 Å²	134.4	79%	0.791	77%	0.773	S	S	*	*				173.8	121.1	103.5	-86.6	-45.8	0	0	0	112
211	N	43.1	Very low	34.9	Very low	157 Å²	157	138 Å²	138	84%	0.84	79%	0.785	S	S	*	*			trans	35.6	95.8	142.6	-158.4	32.7	0	0	0	118.3
212	T	31	Very low	35.7	Very low	127 Å²	127	134.2 Å²	134.2	78%	0.779	78%	0.782	S	S	*	*			trans	-158.1	124.6	147.7	-70.5	0	0	0	0	110.4
213	T	37.7	Very low	36.9	Very low	129 Å²	129	129.4 Å²	129.4	79%	0.791	76%	0.763	S	S	*	*			trans	-6.4	112.1	160.6	-32.7	0	0	0	0	116	A215	T213-A215 PolarHBondContact O-N 3.2Å
214	V	31.6	Very low	38.7	Very low	134 Å²	134	127.1 Å²	127.1	81%	0.812	75%	0.747	S	S	*	*			trans	-70.3	102	173.4	-176.9	0	0	0	0	108.9
215	A	32.4	Very low	41.6	Very low	82 Å²	82	130.4 Å²	130.4	68%	0.678	75%	0.745	S	S	*	*			trans	-71.8	126.1	158.4	0	0	0	0	0	108	T213 D217	T213-A215 PolarHBondContact O-N 3.2Å; A215-D217 PolarHBondContact O-N 2.94Å
216	I	40.3	Very low	44.5	Very low	155 Å²	155	123.9 Å²	123.9	80%	0.795	71%	0.71	S	S	*	*			trans	-81.6	107.9	168.8	-60.4	167.1	0	0	0	105.1	P218	I216-P218 WeakPolarHBondContact O-CD 3.22Å
217	D	32.4	Very low	47.6	Very low	143 Å²	143	121.3 Å²	121.3	77%	0.765	70%	0.699	S	S	*	*			trans	-83	112.5	169	-97.7	-26.4	0	0	0	109.4	A215	A215-D217 PolarHBondContact O-N 2.94Å
218	P	43.6	Very low	50.2	Low	92 Å²	92	113.1 Å²	113.1	60%	0.597	66%	0.656	S	S	*	*			trans	-83.9	114.9	147.5	31.6	-24	0	0	0	107.1	I216 M220	I216-P218 WeakPolarHBondContact O-CD 3.22Å; P218-M220 PolarHBondContact O-N 3.04Å
219	V	40.3	Very low	53.4	Low	143 Å²	143	106.2 Å²	106.2	87%	0.867	62%	0.619	S	S	*	*			trans	-61.5	92	165	-177.6	0	0	0	0	107.3
220	M	40.5	Very low	56	Low	155 Å²	155	99.3 Å²	99.3	76%	0.764	58%	0.582	S	S	*	*			trans	-104	108.8	167.2	-79.4	-69	-173.6	0	0	107.4	P218 G222	P218-M220 PolarHBondContact O-N 3.04Å; M220-G222 PolarHBondContact O-N 2.94Å
221	D	39.8	Very low	58.9	Low	167 Å²	167	95.9 Å²	95.9	89%	0.893	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-49.2	121.6	174	-166.6	20.9	0	0	0	111.6	A223	D221-A223 PolarHBondContact O-N 2.89Å
222	G	45.8	Very low	61.2	Low	73 Å²	73	89.9 Å²	89.9	75%	0.753	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.8	4.4	156.8	0	0	0	0	0	120.5	M220 S224	M220-G222 PolarHBondContact O-N 2.94Å; G222-S224 PolarHBondContact O-N 3.13Å
223	A	54.1	Low	64	Low	45 Å²	45	84.2 Å²	84.2	37%	0.372	49%	0.493	S	S	.	.			trans	-81.4	110.7	177	0	0	0	0	0	111.5	D221 E225	D221-A223 PolarHBondContact O-N 2.89Å; A223-E225 PolarHBondContact O-N 2.72Å; A223-E225 VanDerWaalsContact O-N 3.07Å
224	S	76.6	Confident	66.3	Low	58 Å²	58	81.9 Å²	81.9	41%	0.406	48%	0.479	S	S	.	.			trans	-50.9	113.5	169.8	-56.6	0	0	0	0	109.8	G222 G252 E312	G222-S224 PolarHBondContact O-N 3.13Å; S224-G252 WeakPolarHBondContact O-CA 3.15Å; S224-G252 PolarHBondContact O-N 2.79Å; S224-E312 WeakPolarHBondContact CB-OE1 3.46Å; S224-E312 PolarHBondContact OG-OE1 3.21Å
225	E	88.3	Confident	68.7	Low	133 Å²	133	80.9 Å²	80.9	62%	0.621	47%	0.474	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.9	137.4	174.6	-66.4	-172.2	139.7	0	0	110.3	A223 K249	A223-E225 PolarHBondContact O-N 2.72Å; A223-E225 VanDerWaalsContact O-N 3.07Å; E225-K249 IonicContact OE1-NZ 2.67Å; E225-K249 WeakPolarHBondContact OE2-CE 3.46Å; E225-K249 IonicContact OE2-NZ 2.81Å; E225-K249 PolarHBondContact OE2-NZ 3.27Å
226	I	90.3	Very high	71.1	Confident	20 Å²	20	80.2 Å²	80.2	10%	0.103	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	128.8	178.9	-63	-172.5	0	0	0	109.8	K249 T250 L311 E312 M325	I226-K249 WeakPolarHBondContact O-CA 3.24Å; I226-T250 PolarHBondContact N-O 3.48Å; I226-T250 PolarHBondContact O-N 3.43Å; I226-L311 VanDerWaalsContact CD1-C 3.43Å; I226-L311 HydrophobicContact CD1-CB 3.8Å; I226-L311 WeakPolarHBondContact CD1-O 3.3Å; I226-E312 HydrophobicContact CD1-CB 4.35Å; I226-M325 HydrophobicContact CG2-CE 4.32Å
227	E	93.8	Very high	72.9	Confident	108 Å²	108	75 Å²	75	51%	0.505	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	134	170.5	-66.4	179.4	-178.4	0	0	110.1	K249 P324 M325	E227-K249 HydrophobicContact CG-CG 4.02Å; E227-P324 HydrophobicContact CB-CB 4.21Å; E227-P324 HydrophobicContact CB-CG 4.38Å; E227-P324 CarbonylContact O-C 3.6Å; E227-P324 VanDerWaalsContact O-CA 3.28Å; E227-P324 WeakPolarHBondContact O-CA 3.47Å; E227-M325 PolarHBondContact O-N 2.97Å
228	L	94.5	Very high	74.5	Confident	3 Å²	3	76.6 Å²	76.6	2%	0.016	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	148.5	-179.8	65	89.1	0	0	0	113	F230 I248 T250 L259 L311 M325 L327	L228-F230 HydrophobicContact CD1-CB 3.85Å; L228-F230 HydrophobicContact CD1-CG 4.35Å; L228-I248 HydrophobicContact CD1-CB 3.73Å; L228-I248 HydrophobicContact CD1-CD1 3.91Å; L228-I248 HydrophobicContact CD1-CG1 4.23Å; L228-I248 HydrophobicContact CD1-CG2 4.44Å; L228-I248 HydrophobicContact CG-CB 4.03Å; L228-I248 PolarHBondContact N-O 3.38Å; L228-I248 PolarHBondContact O-N 3.36Å; L228-T250 HydrophobicContact CD2-CG2 4.47Å; L228-L259 HydrophobicContact CD2-CD1 3.95Å; L228-L259 HydrophobicContact CD2-CD2 4.13Å; L228-L311 HydrophobicContact CD2-CD1 3.84Å; L228-M325 CarbonylContact C-O 3.37Å; L228-M325 WeakPolarHBondContact CA-O 3.29Å; L228-M325 HydrophobicContact CB-CB 4.19Å; L228-M325 VanDerWaalsContact CB-O 3.25Å; L228-M325 WeakPolarHBondContact CB-O 3.43Å; L228-M325 HydrophobicContact CD2-CE 4.49Å; L228-L327 HydrophobicContact CD2-CD1 4.33Å
229	V	94.6	Very high	75.2	Confident	14 Å²	14	80.4 Å²	80.4	9%	0.085	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	118	173.6	-174.7	0	0	0	0	107.3	R231 T245 Y247 P324 M325 E326 L327	V229-R231 HydrophobicContact CG1-CG 4.1Å; V229-T245 HydrophobicContact CG1-CG2 3.63Å; V229-Y247 HydrophobicContact CG1-CD1 4.41Å; V229-Y247 HydrophobicContact CG1-CE1 4.09Å; V229-Y247 HydrophobicContact CG2-CD1 4.03Å; V229-Y247 HydrophobicContact CG2-CE1 4.07Å; V229-P324 HydrophobicContact CG2-CB 4.15Å; V229-M325 PolarHBondContact N-O 2.96Å; V229-E326 HydrophobicContact CB-CG 4.36Å; V229-E326 WeakPolarHBondContact O-CA 3.44Å; V229-L327 PolarHBondContact O-N 3.32Å
230	F	94.4	Very high	76.1	Confident	0 Å²	0	78.6 Å²	78.6	0%	0	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	109	-171.7	-159.6	-160.8	0	0	0	110.1	L228 R246 I248 L263 I293 L327 Y329	L228-F230 HydrophobicContact CD1-CB 3.85Å; L228-F230 HydrophobicContact CD1-CG 4.35Å; F230-R246 HydrophobicContact CB-CB 4.31Å; F230-R246 PolarHBondContact N-O 3.4Å; F230-R246 PolarHBondContact O-N 2.87Å; F230-I248 HydrophobicContact CB-CD1 4.03Å; F230-I248 HydrophobicContact CD1-CD1 3.69Å; F230-I248 HydrophobicContact CG-CD1 4.33Å; F230-L263 HydrophobicContact CE1-CB 4.03Å; F230-L263 HydrophobicContact CE1-CD1 4.34Å; F230-L263 HydrophobicContact CE1-CD2 4.16Å; F230-L263 HydrophobicContact CE1-CG 4.42Å; F230-L263 HydrophobicContact CZ-CD2 4.11Å; F230-I293 HydrophobicContact CE2-CD1 3.94Å; F230-I293 HydrophobicContact CE2-CG2 4.17Å; F230-I293 HydrophobicContact CZ-CD1 3.54Å; F230-L327 WeakPolarHBondContact CA-O 3.4Å; F230-L327 HydrophobicContact CD2-CB 3.74Å; F230-L327 HydrophobicContact CE2-CB 4.1Å; F230-Y329 HydrophobicContact CD1-CD1 4.28Å; F230-Y329 AromaticContact CD2-CD1 3.75Å; F230-Y329 HydrophobicContact CD2-CD1 3.75Å; F230-Y329 HydrophobicContact CE1-CD1 4.23Å; F230-Y329 AromaticContact CE2-CD1 3.67Å; F230-Y329 HydrophobicContact CE2-CD1 3.67Å; F230-Y329 HydrophobicContact CE2-CG 4.17Å; F230-Y329 HydrophobicContact CG-CD1 4.05Å; F230-Y329 HydrophobicContact CG-CE1 4.47Å; F230-Y329 AromaticContact CZ-CD1 3.92Å; F230-Y329 HydrophobicContact CZ-CD1 3.92Å; F230-Y329 HydrophobicContact CZ-CG 4.26Å
231	R	92.4	Very high	76.6	Confident	76 Å²	76	79.4 Å²	79.4	29%	0.287	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	152	-170.7	-64.5	-170.9	-177.5	137.4	9.6	112.1	V229 T245 E326 L327 Y328 Y329	V229-R231 HydrophobicContact CG1-CG 4.1Å; R231-T245 HydrophobicContact CG-CG2 3.84Å; R231-E326 IonicContact CZ-OE1 3.8Å; R231-E326 IonicContact CZ-OE2 3.14Å; R231-E326 VanDerWaalsContact NH1-CD 3.27Å; R231-E326 IonicContact NH1-OE1 3.85Å; R231-E326 PolarHBondContact NH1-OE1 3.13Å; R231-E326 VanDerWaalsContact NH1-OE1 3.13Å; R231-E326 IonicContact NH1-OE2 3.39Å; R231-E326 PolarHBondContact NH1-OE2 3.15Å; R231-E326 IonicContact NH2-OE1 2.95Å; R231-E326 PolarHBondContact NH2-OE1 3.43Å; R231-L327 PolarHBondContact N-O 3.25Å; R231-Y328 HydrophobicContact CB-CD1 3.88Å; R231-Y328 HydrophobicContact CB-CE1 3.92Å; R231-Y328 PolarHBondContact NH1-OH 2.99Å; R231-Y328 CarbonylContact O-C 3.55Å; R231-Y328 WeakPolarHBondContact O-CA 3.38Å; R231-Y329 WeakPolarHBondContact O-CD1 3.36Å; R231-Y329 WeakPolarHBondContact O-CE1 3.42Å; R231-Y329 PolarHBondContact O-N 3.13Å
232	P	91.4	Very high	77.4	Confident	30 Å²	30	75.2 Å²	75.2	20%	0.195	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	145.4	165.9	28.3	-35.6	0	0	0	110.7	M237 A243 Y329	P232-M237 VanDerWaalsContact CA-SD 3.56Å; P232-M237 HydrophobicContact CB-CB 4.28Å; P232-M237 HydrophobicContact CB-CE 3.99Å; P232-M237 HydrophobicContact CB-CG 4.27Å; P232-M237 HydrophobicContact CB-SD 3.29Å; P232-M237 WeakPolarHBondContact CB-SD 3.15Å; P232-A243 HydrophobicContact CB-CB 3.96Å; P232-A243 HydrophobicContact CG-CB 3.99Å; P232-Y329 HydrophobicContact CB-CE2 4.39Å
233	H	89.3	Confident	78.4	Confident	9 Å²	9	72.9 Å²	72.9	4%	0.042	40%	0.4	C	S	.	.			trans	-68.3	125.5	177.9	-171.2	-73.2	0	0	0	110.5	T235 L236 M237 Y294 F302 Y329 A330	H233-T235 PolarHBondContact CE1-OG1 3.03Å; H233-T235 PolarHBondContact ND1-N 2.81Å; H233-T235 PolarHBondContact ND1-OG1 2.8Å; H233-T235 PolarHBondContact O-N 2.6Å; H233-L236 HydrophobicContact CB-CB 4.05Å; H233-L236 WeakPolarHBondContact ND1-CG 3.35Å; H233-L236 PolarHBondContact ND1-N 2.83Å; H233-L236 PolarHBondContact O-N 2.81Å; H233-M237 PolarHBondContact O-N 2.84Å; H233-Y294 AromaticContact CD2-CD2 3.81Å; H233-Y294 AromaticContact CD2-CG 3.84Å; H233-F302 AromaticContact NE2-CD1 3.8Å; H233-F302 AromaticContact NE2-CD2 3.7Å; H233-F302 AromaticContact NE2-CG 3.39Å; H233-F302 WeakPolarHBondContact NE2-CG 3.46Å; H233-Y329 VanDerWaalsContact CB-O 3.26Å; H233-Y329 WeakPolarHBondContact CB-O 3.3Å; H233-Y329 PolarHBondContact N-O 2.77Å; H233-A330 HydrophobicContact CB-CB 3.96Å
234	P	85.6	Confident	79.6	Confident	79 Å²	79	76.9 Å²	76.9	51%	0.513	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-20.9	-164.9	24.5	-35.5	0	0	0	115.1	F302	P234-F302 HydrophobicContact CG-CE1 4.39Å; P234-F302 HydrophobicContact CG-CE2 3.92Å; P234-F302 HydrophobicContact CG-CZ 3.58Å
235	T	83.4	Confident	80.1	Confident	113 Å²	113	76.3 Å²	76.3	69%	0.693	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.2	-10.8	-179.3	59.4	0	0	0	0	114.5	H233	H233-T235 PolarHBondContact CE1-OG1 3.03Å; H233-T235 PolarHBondContact ND1-N 2.81Å; H233-T235 PolarHBondContact ND1-OG1 2.8Å; H233-T235 PolarHBondContact O-N 2.6Å
236	L	82	Confident	80.2	Confident	69 Å²	69	70.7 Å²	70.7	36%	0.361	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.2	-8.3	-175.2	-66.7	177.3	0	0	0	112.6	H233 Y294 A330	H233-L236 HydrophobicContact CB-CB 4.05Å; H233-L236 WeakPolarHBondContact ND1-CG 3.35Å; H233-L236 PolarHBondContact ND1-N 2.83Å; H233-L236 PolarHBondContact O-N 2.81Å; L236-Y294 HydrophobicContact CD1-CE1 4.46Å; L236-Y294 HydrophobicContact CD1-CE2 4.37Å; L236-A330 HydrophobicContact CB-CB 3.72Å; L236-A330 HydrophobicContact CD1-CB 3.99Å
237	M	77.9	Confident	80.3	Confident	45 Å²	45	78.5 Å²	78.5	22%	0.222	41%	0.408	C	S	.	.	S	Bend	trans	-113.2	137	173.1	-64.4	-166.3	61.1	0	0	108.9	P232 H233 A243 Y329	P232-M237 VanDerWaalsContact CA-SD 3.56Å; P232-M237 HydrophobicContact CB-CB 4.28Å; P232-M237 HydrophobicContact CB-CE 3.99Å; P232-M237 HydrophobicContact CB-CG 4.27Å; P232-M237 HydrophobicContact CB-SD 3.29Å; P232-M237 WeakPolarHBondContact CB-SD 3.15Å; H233-M237 PolarHBondContact O-N 2.84Å; M237-A243 HydrophobicContact CE-CB 4.03Å; M237-Y329 HydrophobicContact CE-CD2 4.43Å; M237-Y329 HydrophobicContact CE-CE2 3.8Å; M237-Y329 HydrophobicContact SD-CD2 3.66Å; M237-Y329 HydrophobicContact SD-CE2 3.51Å; M237-Y329 VanDerWaalsContact SD-CE2 3.51Å
238	E	67	Low	80.3	Confident	176 Å²	176	74.4 Å²	74.4	82%	0.822	39%	0.389	S	S	*	.			trans	-70.6	149.7	166.5	-64.6	-173.3	159.7	0	0	108.6	D240	E238-D240 PolarHBondContact O-N 2.95Å
239	N	58	Low	80.2	Confident	173 Å²	173	79.9 Å²	79.9	93%	0.925	41%	0.413	S	S	*	.			trans	-70.6	69.8	178.5	-67.5	-34.5	0	0	0	109.9
240	D	58.1	Low	80.2	Confident	104 Å²	104	81.5 Å²	81.5	56%	0.556	42%	0.422	S	S	*	.			trans	-87.8	134.5	172.4	-162.4	-7.7	0	0	0	108.3	E238 S242 A243	E238-D240 PolarHBondContact O-N 2.95Å; D240-S242 PolarHBondContact O-N 3.21Å; D240-A243 WeakPolarHBondContact O-CB 3.08Å; D240-A243 PolarHBondContact O-N 3.02Å
241	D	51.3	Low	80.1	Confident	172 Å²	172	83.4 Å²	83.4	92%	0.92	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-13.5	-179.4	-84.4	-34.5	0	0	0	112.4	A243	D241-A243 VanDerWaalsContact C-N 3.34Å
242	S	56	Low	80	Confident	79 Å²	79	79.8 Å²	79.8	55%	0.552	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-14.1	174.9	-52.7	0	0	0	0	114.1	D240 Q244	D240-S242 PolarHBondContact O-N 3.21Å; S242-Q244 VanDerWaalsContact C-N 3.34Å; S242-Q244 PolarHBondContact O-N 3.19Å
243	A	68.2	Low	80.1	Confident	25 Å²	25	83.5 Å²	83.5	21%	0.207	44%	0.44	C	S	.	.			trans	-85	67.5	-175.5	0	0	0	0	0	112.3	P232 M237 D240 D241	P232-A243 HydrophobicContact CB-CB 3.96Å; P232-A243 HydrophobicContact CG-CB 3.99Å; M237-A243 HydrophobicContact CE-CB 4.03Å; D240-A243 WeakPolarHBondContact O-CB 3.08Å; D240-A243 PolarHBondContact O-N 3.02Å; D241-A243 VanDerWaalsContact C-N 3.34Å
244	Q	78.8	Confident	80.3	Confident	128 Å²	128	83.8 Å²	83.8	60%	0.598	45%	0.445	S	S	*	.			trans	-75.6	141.9	-178.9	-161	177.2	1.7	0	0	112.4	S242 Y329	S242-Q244 VanDerWaalsContact C-N 3.34Å; S242-Q244 PolarHBondContact O-N 3.19Å; Q244-Y329 PolarHBondContact O-OH 3.31Å
245	T	87.7	Confident	80.7	Confident	46 Å²	46	81.3 Å²	81.3	28%	0.282	43%	0.428	S	S	.	.			trans	-69.4	130.9	165.4	-66.1	0	0	0	0	110	V229 R231 Y247	V229-T245 HydrophobicContact CG1-CG2 3.63Å; R231-T245 HydrophobicContact CG-CG2 3.84Å; T245-Y247 HydrophobicContact CG2-CE2 4.28Å
246	R	89.4	Confident	81.3	Confident	16 Å²	16	76.1 Å²	76.1	6%	0.06	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	136.7	-176.3	-55.3	176.4	-175.1	-79	-0.7	110.3	F230 I248 E270	F230-R246 HydrophobicContact CB-CB 4.31Å; F230-R246 PolarHBondContact N-O 3.4Å; F230-R246 PolarHBondContact O-N 2.87Å; R246-I248 HydrophobicContact CB-CD1 4.28Å; R246-I248 HydrophobicContact CB-CG1 4.33Å; R246-E270 IonicContact CZ-OE1 3.13Å; R246-E270 IonicContact CZ-OE2 3.56Å; R246-E270 VanDerWaalsContact NH1-CD 3.34Å; R246-E270 IonicContact NH1-OE1 3.89Å; R246-E270 PolarHBondContact NH1-OE1 3.06Å; R246-E270 IonicContact NH1-OE2 2.87Å; R246-E270 PolarHBondContact NH1-OE2 3.03Å; R246-E270 IonicContact NH2-OE1 2.6Å; R246-E270 IonicContact NH2-OE2 3.36Å; R246-E270 PolarHBondContact NH2-OE2 3.19Å
247	Y	93.4	Very high	81.8	Confident	184 Å²	184	75.9 Å²	75.9	72%	0.722	40%	0.395	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.5	121.2	174.4	-58.3	-87.2	0	0	0	108	V229 T245	V229-Y247 HydrophobicContact CG1-CD1 4.41Å; V229-Y247 HydrophobicContact CG1-CE1 4.09Å; V229-Y247 HydrophobicContact CG2-CD1 4.03Å; V229-Y247 HydrophobicContact CG2-CE1 4.07Å; T245-Y247 HydrophobicContact CG2-CE2 4.28Å
248	I	93.4	Very high	82.5	Confident	21 Å²	21	79.3 Å²	79.3	11%	0.108	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	133.8	-169.9	-58.1	167.7	0	0	0	108.7	L228 F230 R246 Y262	L228-I248 HydrophobicContact CD1-CB 3.73Å; L228-I248 HydrophobicContact CD1-CD1 3.91Å; L228-I248 HydrophobicContact CD1-CG1 4.23Å; L228-I248 HydrophobicContact CD1-CG2 4.44Å; L228-I248 HydrophobicContact CG-CB 4.03Å; L228-I248 PolarHBondContact N-O 3.38Å; L228-I248 PolarHBondContact O-N 3.36Å; F230-I248 HydrophobicContact CB-CD1 4.03Å; F230-I248 HydrophobicContact CD1-CD1 3.69Å; F230-I248 HydrophobicContact CG-CD1 4.33Å; R246-I248 HydrophobicContact CB-CD1 4.28Å; R246-I248 HydrophobicContact CB-CG1 4.33Å; I248-Y262 HydrophobicContact CD1-CD1 3.94Å; I248-Y262 HydrophobicContact CD1-CE1 3.33Å; I248-Y262 HydrophobicContact CG1-CE1 4.11Å
249	K	92.9	Very high	83.8	Confident	119 Å²	119	71.3 Å²	71.3	52%	0.517	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	129.4	167.4	-164.5	-175.3	-158.6	-159.3	0	108	E225 I226 E227	E225-K249 IonicContact OE1-NZ 2.67Å; E225-K249 WeakPolarHBondContact OE2-CE 3.46Å; E225-K249 IonicContact OE2-NZ 2.81Å; E225-K249 PolarHBondContact OE2-NZ 3.27Å; I226-K249 WeakPolarHBondContact O-CA 3.24Å; E227-K249 HydrophobicContact CG-CG 4.02Å
250	T	93.1	Very high	85.4	Confident	47 Å²	47	63.1 Å²	63.1	29%	0.288	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	175.2	-179.1	-165.9	0	0	0	0	111.3	I226 L228 A254 L311	I226-T250 PolarHBondContact N-O 3.48Å; I226-T250 PolarHBondContact O-N 3.43Å; L228-T250 HydrophobicContact CD2-CG2 4.47Å; T250-A254 HydrophobicContact CG2-CB 4.25Å; T250-L311 HydrophobicContact CG2-CD1 3.41Å; T250-L311 VanDerWaalsContact CG2-CD1 3.41Å
251	S	93.4	Very high	86.9	Confident	41 Å²	41	63 Å²	63	29%	0.287	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	141.9	175.4	176.7	0	0	0	0	111	N253 A254	S251-N253 PolarHBondContact O-N 2.86Å; S251-N253 PolarHBondContact OG-N 2.76Å; S251-A254 WeakPolarHBondContact O-CB 3.4Å; S251-A254 PolarHBondContact O-N 2.73Å
252	G	89.7	Confident	88.9	Confident	0 Å²	0	59 Å²	59	0%	0	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-22.7	173.9	0	0	0	0	0	113.8	S224 A254 L311 E312	S224-G252 WeakPolarHBondContact O-CA 3.15Å; S224-G252 PolarHBondContact O-N 2.79Å; G252-A254 VanDerWaalsContact C-N 3.27Å; G252-A254 PolarHBondContact O-N 3.39Å; G252-L311 PolarHBondContact O-N 3.42Å; G252-L311 VanDerWaalsContact O-N 3.17Å; G252-E312 PolarHBondContact O-N 3.42Å
253	N	92.7	Very high	90.5	Very high	107 Å²	107	55.2 Å²	55.2	57%	0.572	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-11.4	175.1	-65.2	4.5	0	0	0	112.9	S251	S251-N253 PolarHBondContact O-N 2.86Å; S251-N253 PolarHBondContact OG-N 2.76Å
254	A	93.8	Very high	91.4	Very high	16 Å²	16	54.3 Å²	54.3	13%	0.132	26%	0.263	C	S	.	.			trans	-61	149.1	171.9	0	0	0	0	0	109.7	T250 S251 G252 S310 L311	T250-A254 HydrophobicContact CG2-CB 4.25Å; S251-A254 WeakPolarHBondContact O-CB 3.4Å; S251-A254 PolarHBondContact O-N 2.73Å; G252-A254 VanDerWaalsContact C-N 3.27Å; G252-A254 PolarHBondContact O-N 3.39Å; A254-S310 CarbonylContact O-C 3.53Å; A254-S310 VanDerWaalsContact O-CA 3.25Å; A254-S310 WeakPolarHBondContact O-CA 3.46Å; A254-L311 HydrophobicContact CB-CD1 4.03Å; A254-L311 HydrophobicContact CB-CG 4.37Å; A254-L311 WeakPolarHBondContact O-CG 3.47Å; A254-L311 PolarHBondContact O-N 2.96Å
255	T	95.6	Very high	91.8	Very high	27 Å²	27	50.3 Å²	50.3	17%	0.166	25%	0.248	C	C	.	.	B	Isolated β-bridge	trans	-105.2	166.1	179.6	73.5	0	0	0	0	112.2	D257 H258 L259 G307 F309	T255-D257 PolarHBondContact O-N 2.9Å; T255-D257 PolarHBondContact OG1-N 2.99Å; T255-H258 PolarHBondContact N-ND1 3.46Å; T255-H258 WeakPolarHBondContact O-CB 3.36Å; T255-H258 PolarHBondContact O-N 3.06Å; T255-H258 PolarHBondContact OG1-N 2.93Å; T255-H258 PolarHBondContact OG1-ND1 3.44Å; T255-L259 PolarHBondContact O-N 3.43Å; T255-G307 WeakPolarHBondContact CB-O 3.45Å; T255-G307 PolarHBondContact OG1-O 3.1Å; T255-F309 CarbonylContact C-O 3.56Å; T255-F309 WeakPolarHBondContact CA-O 3.35Å; T255-F309 WeakPolarHBondContact CB-O 3.48Å
256	V	94.1	Very high	91.9	Very high	4 Å²	4	52.5 Å²	52.5	2%	0.024	25%	0.25	C	S	.	.	H	α-helix	trans	-58.4	-37.1	174.1	176.6	0	0	0	0	111.6	H258 L259 S260 I293 L305 N306 G307 F309 V314	V256-H258 VanDerWaalsContact C-N 3.3Å; V256-H258 PolarHBondContact O-N 3.43Å; V256-L259 WeakPolarHBondContact O-CB 3.3Å; V256-L259 PolarHBondContact O-N 3.02Å; V256-L259 VanDerWaalsContact O-N 3.12Å; V256-S260 PolarHBondContact O-N 2.91Å; V256-I293 HydrophobicContact CG1-CB 3.62Å; V256-I293 HydrophobicContact CG1-CG1 3.61Å; V256-I293 HydrophobicContact CG1-CG2 4.21Å; V256-L305 HydrophobicContact CG1-CB 3.95Å; V256-L305 HydrophobicContact CG2-CB 3.93Å; V256-L305 HydrophobicContact CG2-CD1 4.15Å; V256-N306 WeakPolarHBondContact CB-O 3.14Å; V256-N306 WeakPolarHBondContact CG2-O 3.42Å; V256-G307 PolarHBondContact N-O 3.43Å; V256-F309 HydrophobicContact CG2-CB 4.32Å; V256-F309 PolarHBondContact N-O 3.35Å; V256-V314 HydrophobicContact CG2-CG2 3.99Å
257	D	93.4	Very high	91.7	Very high	64 Å²	64	53.5 Å²	53.5	34%	0.342	26%	0.257	S	S	.	.	H	α-helix	trans	-61.5	-37.8	173.3	-76.6	-25.4	0	0	0	112.3	T255 L259 S260 K261 E288 G307	T255-D257 PolarHBondContact O-N 2.9Å; T255-D257 PolarHBondContact OG1-N 2.99Å; D257-L259 VanDerWaalsContact C-N 3.32Å; D257-L259 PolarHBondContact O-N 3.06Å; D257-S260 PolarHBondContact O-N 3.43Å; D257-K261 WeakPolarHBondContact O-CB 3.38Å; D257-K261 PolarHBondContact O-N 3.11Å; D257-E288 HydrophobicContact CB-CB 3.89Å; D257-E288 HydrophobicContact CB-CG 4.26Å; D257-G307 VanDerWaalsContact CG-C 3.44Å; D257-G307 PolarHBondContact N-O 2.92Å; D257-G307 WeakPolarHBondContact OD1-CA 3.19Å; D257-G307 VanDerWaalsContact OD2-C 3.25Å; D257-G307 WeakPolarHBondContact OD2-CA 3.39Å
258	H	93.4	Very high	91.2	Very high	117 Å²	117	45 Å²	45	54%	0.542	23%	0.225	S	C	.	.	H	α-helix	trans	-63	-39.3	174.3	-65.2	101.8	0	0	0	111.4	T255 V256 Y262	T255-H258 PolarHBondContact N-ND1 3.46Å; T255-H258 WeakPolarHBondContact O-CB 3.36Å; T255-H258 PolarHBondContact O-N 3.06Å; T255-H258 PolarHBondContact OG1-N 2.93Å; T255-H258 PolarHBondContact OG1-ND1 3.44Å; V256-H258 VanDerWaalsContact C-N 3.3Å; V256-H258 PolarHBondContact O-N 3.43Å; H258-Y262 WeakPolarHBondContact O-CB 3.46Å; H258-Y262 PolarHBondContact O-N 3.35Å
259	L	92.8	Very high	90.6	Very high	7 Å²	7	47.2 Å²	47.2	4%	0.037	24%	0.236	C	C	.	.	H	α-helix	trans	-67.2	-41.5	175.6	-70.3	-174.7	0	0	0	112.7	L228 T255 V256 D257 Y262 L263 L311 L327	L228-L259 HydrophobicContact CD2-CD1 3.95Å; L228-L259 HydrophobicContact CD2-CD2 4.13Å; T255-L259 PolarHBondContact O-N 3.43Å; V256-L259 WeakPolarHBondContact O-CB 3.3Å; V256-L259 PolarHBondContact O-N 3.02Å; V256-L259 VanDerWaalsContact O-N 3.12Å; D257-L259 VanDerWaalsContact C-N 3.32Å; D257-L259 PolarHBondContact O-N 3.06Å; L259-Y262 PolarHBondContact O-N 3.41Å; L259-L263 WeakPolarHBondContact O-CB 3.45Å; L259-L263 PolarHBondContact O-N 3.22Å; L259-L311 HydrophobicContact CD1-CD1 4.06Å; L259-L311 HydrophobicContact CD1-CD2 3.44Å; L259-L311 VanDerWaalsContact CD1-CD2 3.44Å; L259-L311 HydrophobicContact CD1-CG 4.36Å; L259-L311 HydrophobicContact CD2-CD1 4.27Å; L259-L311 HydrophobicContact CG-CD1 4.22Å; L259-L311 HydrophobicContact CG-CD2 4.12Å; L259-L327 HydrophobicContact CD1-CD1 3.44Å; L259-L327 VanDerWaalsContact CD1-CD1 3.44Å
260	S	91.4	Very high	90.2	Very high	2 Å²	2	43.9 Å²	43.9	1%	0.014	22%	0.223	C	C	.	.	H	α-helix	trans	-61.2	-48.8	175.7	177	0	0	0	0	111.2	V256 D257 Y262 L263 A264 E288 Y291	V256-S260 PolarHBondContact O-N 2.91Å; D257-S260 PolarHBondContact O-N 3.43Å; S260-Y262 PolarHBondContact O-N 2.91Å; S260-L263 WeakPolarHBondContact O-CB 3.17Å; S260-L263 PolarHBondContact O-N 3.3Å; S260-A264 PolarHBondContact O-N 2.97Å; S260-A264 VanDerWaalsContact O-N 3.07Å; S260-E288 WeakPolarHBondContact CB-O 3.29Å; S260-E288 VanDerWaalsContact OG-C 3.29Å; S260-E288 PolarHBondContact OG-O 3.27Å; S260-Y291 PolarHBondContact OG-O 3.13Å
261	K	90.8	Very high	89.4	Confident	100 Å²	100	44.8 Å²	44.8	44%	0.435	22%	0.224	S	C	.	.	H	α-helix	trans	-63.4	-41.3	176.9	-172.6	170.9	-175.3	168	0	112.2	D257 L263 A264 V265 E288	D257-K261 WeakPolarHBondContact O-CB 3.38Å; D257-K261 PolarHBondContact O-N 3.11Å; K261-L263 VanDerWaalsContact C-N 3.29Å; K261-L263 PolarHBondContact O-N 2.97Å; K261-A264 PolarHBondContact O-N 3.23Å; K261-V265 HydrophobicContact CG-CG2 4.47Å; K261-V265 WeakPolarHBondContact O-CB 3.37Å; K261-V265 WeakPolarHBondContact O-CG2 3.02Å; K261-V265 PolarHBondContact O-N 3.2Å; K261-E288 HydrophobicContact CB-CB 4.28Å
262	Y	92.6	Very high	88.6	Confident	88 Å²	88	45.9 Å²	45.9	35%	0.345	23%	0.226	S	C	.	.	H	α-helix	trans	-55.9	-45.8	173.9	163.8	-93.9	0	0	0	111.1	I248 H258 L259 S260 V265 R266	I248-Y262 HydrophobicContact CD1-CD1 3.94Å; I248-Y262 HydrophobicContact CD1-CE1 3.33Å; I248-Y262 HydrophobicContact CG1-CE1 4.11Å; H258-Y262 WeakPolarHBondContact O-CB 3.46Å; H258-Y262 PolarHBondContact O-N 3.35Å; L259-Y262 PolarHBondContact O-N 3.41Å; S260-Y262 PolarHBondContact O-N 2.91Å; Y262-V265 PolarHBondContact O-N 3.03Å; Y262-R266 HydrophobicContact CE1-CB 4.45Å; Y262-R266 WeakPolarHBondContact O-CB 3.43Å; Y262-R266 PolarHBondContact O-N 3.11Å
263	L	89.7	Confident	87.9	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-63	-46.8	-179.8	-179	63.7	0	0	0	112	F230 L259 S260 K261 R266 L267 Y291 Y329	F230-L263 HydrophobicContact CE1-CB 4.03Å; F230-L263 HydrophobicContact CE1-CD1 4.34Å; F230-L263 HydrophobicContact CE1-CD2 4.16Å; F230-L263 HydrophobicContact CE1-CG 4.42Å; F230-L263 HydrophobicContact CZ-CD2 4.11Å; L259-L263 WeakPolarHBondContact O-CB 3.45Å; L259-L263 PolarHBondContact O-N 3.22Å; S260-L263 WeakPolarHBondContact O-CB 3.17Å; S260-L263 PolarHBondContact O-N 3.3Å; K261-L263 VanDerWaalsContact C-N 3.29Å; K261-L263 PolarHBondContact O-N 2.97Å; L263-R266 PolarHBondContact O-N 3.18Å; L263-L267 HydrophobicContact CD1-CD1 3.9Å; L263-L267 HydrophobicContact CD1-CG 4.21Å; L263-L267 HydrophobicContact CG-CD1 3.97Å; L263-L267 WeakPolarHBondContact O-CB 3.4Å; L263-L267 WeakPolarHBondContact O-CG 3.41Å; L263-L267 PolarHBondContact O-N 3.13Å; L263-Y291 HydrophobicContact CB-CD2 4.42Å; L263-Y291 HydrophobicContact CD2-CD1 3.57Å; L263-Y291 HydrophobicContact CD2-CD2 3.94Å; L263-Y291 HydrophobicContact CD2-CE1 4.06Å; L263-Y291 HydrophobicContact CD2-CE2 4.4Å; L263-Y291 HydrophobicContact CD2-CG 3.52Å; L263-Y291 HydrophobicContact CG-CD1 4.43Å; L263-Y291 HydrophobicContact CG-CD2 4.13Å; L263-Y291 HydrophobicContact CG-CE2 4.3Å; L263-Y291 HydrophobicContact CG-CG 4.21Å; L263-Y329 HydrophobicContact CD1-CD1 4.35Å; L263-Y329 HydrophobicContact CD1-CD2 4.43Å; L263-Y329 HydrophobicContact CD1-CE1 4.11Å; L263-Y329 HydrophobicContact CD1-CE2 4.15Å; L263-Y329 HydrophobicContact CD2-CD1 3.8Å; L263-Y329 HydrophobicContact CD2-CD2 3.3Å; L263-Y329 HydrophobicContact CD2-CE1 4.31Å; L263-Y329 HydrophobicContact CD2-CE2 3.83Å; L263-Y329 HydrophobicContact CD2-CG 3.26Å; L263-Y329 HydrophobicContact CG-CD2 4.42Å
264	A	88.3	Confident	86.7	Confident	7 Å²	7	55.4 Å²	55.4	6%	0.058	27%	0.269	C	S	.	.	H	α-helix	trans	-57.7	-50.2	176.7	0	0	0	0	0	112.2	S260 K261 R266 L267 A268 A286 Q290 Y291	S260-A264 PolarHBondContact O-N 2.97Å; S260-A264 VanDerWaalsContact O-N 3.07Å; K261-A264 PolarHBondContact O-N 3.23Å; A264-R266 VanDerWaalsContact C-N 3.31Å; A264-R266 PolarHBondContact O-N 2.88Å; A264-L267 PolarHBondContact O-N 3.02Å; A264-A268 WeakPolarHBondContact O-CB 3.36Å; A264-A268 PolarHBondContact O-N 3.11Å; A264-A286 HydrophobicContact CB-CB 4.05Å; A264-Q290 HydrophobicContact CB-CB 4.47Å; A264-Y291 HydrophobicContact CB-CD2 4.15Å; A264-Y291 HydrophobicContact CB-CE2 4.07Å
265	V	87.3	Confident	85.2	Confident	44 Å²	44	61.3 Å²	61.3	27%	0.267	29%	0.292	S	S	.	.	H	α-helix	trans	-61.2	-42.8	177.1	169.1	0	0	0	0	110.8	K261 Y262 A268 L269 L283 A286	K261-V265 HydrophobicContact CG-CG2 4.47Å; K261-V265 WeakPolarHBondContact O-CB 3.37Å; K261-V265 WeakPolarHBondContact O-CG2 3.02Å; K261-V265 PolarHBondContact O-N 3.2Å; Y262-V265 PolarHBondContact O-N 3.03Å; V265-A268 PolarHBondContact O-N 2.6Å; V265-L269 HydrophobicContact CG1-CD1 3.94Å; V265-L269 HydrophobicContact CG1-CG 4.45Å; V265-L269 VanDerWaalsContact O-CG 3.3Å; V265-L269 WeakPolarHBondContact O-CG 3.3Å; V265-L269 PolarHBondContact O-N 3.34Å; V265-L283 HydrophobicContact CB-CD1 4.45Å; V265-L283 HydrophobicContact CG1-CD1 3.89Å; V265-L283 HydrophobicContact CG2-CD1 4.38Å; V265-A286 HydrophobicContact CG2-CB 3.67Å
266	R	88.4	Confident	83.2	Confident	91 Å²	91	62.9 Å²	62.9	34%	0.343	31%	0.313	S	S	.	.	H	α-helix	trans	-66.1	-43.2	-176.5	-173.5	67.9	-161.2	-170.8	-0.4	112.1	Y262 L263 A264 L269 E270	Y262-R266 HydrophobicContact CE1-CB 4.45Å; Y262-R266 WeakPolarHBondContact O-CB 3.43Å; Y262-R266 PolarHBondContact O-N 3.11Å; L263-R266 PolarHBondContact O-N 3.18Å; A264-R266 VanDerWaalsContact C-N 3.31Å; A264-R266 PolarHBondContact O-N 2.88Å; R266-L269 PolarHBondContact O-N 2.95Å; R266-E270 IonicContact CZ-OE1 3.62Å; R266-E270 IonicContact NE-OE1 3.88Å; R266-E270 PolarHBondContact NE-OE1 3.32Å; R266-E270 IonicContact NH2-OE1 3.54Å; R266-E270 WeakPolarHBondContact O-CG 3.24Å; R266-E270 PolarHBondContact O-N 3.48Å
267	L	84.9	Confident	81.1	Confident	38 Å²	38	70.6 Å²	70.6	20%	0.199	35%	0.349	C	S	.	.	H	α-helix	trans	-66.1	-42	176.6	-73.5	169.3	0	0	0	111.7	L263 A264 L269 E270 E271 Y291	L263-L267 HydrophobicContact CD1-CD1 3.9Å; L263-L267 HydrophobicContact CD1-CG 4.21Å; L263-L267 HydrophobicContact CG-CD1 3.97Å; L263-L267 WeakPolarHBondContact O-CB 3.4Å; L263-L267 WeakPolarHBondContact O-CG 3.41Å; L263-L267 PolarHBondContact O-N 3.13Å; A264-L267 PolarHBondContact O-N 3.02Å; L267-L269 VanDerWaalsContact C-N 3.31Å; L267-L269 PolarHBondContact O-N 3.49Å; L267-E270 PolarHBondContact O-N 2.93Å; L267-E271 PolarHBondContact O-N 2.81Å; L267-Y291 HydrophobicContact CD1-CE1 4.19Å; L267-Y291 HydrophobicContact CD1-CE2 4.14Å; L267-Y291 WeakPolarHBondContact CD1-OH 3.18Å
268	A	83.5	Confident	78.7	Confident	6 Å²	6	72.5 Å²	72.5	5%	0.05	37%	0.368	C	S	.	.	H	α-helix	trans	-59.7	-40.8	174.6	0	0	0	0	0	112.1	A264 V265 L272	A264-A268 WeakPolarHBondContact O-CB 3.36Å; A264-A268 PolarHBondContact O-N 3.11Å; V265-A268 PolarHBondContact O-N 2.6Å; A268-L272 VanDerWaalsContact O-CG 3.29Å; A268-L272 WeakPolarHBondContact O-CG 3.47Å; A268-L272 PolarHBondContact O-N 3.17Å; A268-L272 VanDerWaalsContact O-N 3.09Å
269	L	81.8	Confident	76.4	Confident	66 Å²	66	70.9 Å²	70.9	35%	0.346	36%	0.363	S	S	.	.	H	α-helix	trans	-68.4	-34.7	176.5	-71.8	172.1	0	0	0	113.3	V265 R266 L267 L272 R273 L283	V265-L269 HydrophobicContact CG1-CD1 3.94Å; V265-L269 HydrophobicContact CG1-CG 4.45Å; V265-L269 VanDerWaalsContact O-CG 3.3Å; V265-L269 WeakPolarHBondContact O-CG 3.3Å; V265-L269 PolarHBondContact O-N 3.34Å; R266-L269 PolarHBondContact O-N 2.95Å; L267-L269 VanDerWaalsContact C-N 3.31Å; L267-L269 PolarHBondContact O-N 3.49Å; L269-L272 HydrophobicContact CD2-CD1 4.48Å; L269-R273 WeakPolarHBondContact O-CG 3.35Å; L269-R273 PolarHBondContact O-N 3.26Å; L269-L283 HydrophobicContact CG-CD1 4.49Å
270	E	82.8	Confident	74.2	Confident	49 Å²	49	78.4 Å²	78.4	23%	0.229	40%	0.398	C	S	.	.	H	α-helix	trans	-71.1	-40	176.7	-77.2	167	-171.5	0	0	111.6	R246 R266 L267 L272 R273 S274	R246-E270 IonicContact CZ-OE1 3.13Å; R246-E270 IonicContact CZ-OE2 3.56Å; R246-E270 VanDerWaalsContact NH1-CD 3.34Å; R246-E270 IonicContact NH1-OE1 3.89Å; R246-E270 PolarHBondContact NH1-OE1 3.06Å; R246-E270 IonicContact NH1-OE2 2.87Å; R246-E270 PolarHBondContact NH1-OE2 3.03Å; R246-E270 IonicContact NH2-OE1 2.6Å; R246-E270 IonicContact NH2-OE2 3.36Å; R246-E270 PolarHBondContact NH2-OE2 3.19Å; R266-E270 IonicContact CZ-OE1 3.62Å; R266-E270 IonicContact NE-OE1 3.88Å; R266-E270 PolarHBondContact NE-OE1 3.32Å; R266-E270 IonicContact NH2-OE1 3.54Å; R266-E270 WeakPolarHBondContact O-CG 3.24Å; R266-E270 PolarHBondContact O-N 3.48Å; L267-E270 PolarHBondContact O-N 2.93Å; E270-L272 VanDerWaalsContact C-N 3.35Å; E270-L272 PolarHBondContact O-N 3.49Å; E270-R273 PolarHBondContact O-N 3.39Å; E270-S274 WeakPolarHBondContact O-CB 3.2Å; E270-S274 PolarHBondContact O-N 3.37Å
271	E	77.3	Confident	72.1	Confident	67 Å²	67	85.9 Å²	85.9	31%	0.313	44%	0.435	S	S	.	.	H	α-helix	trans	-63.1	-41.4	174.4	-171.6	168.9	-153.4	0	0	111.7	L267 R273 S274 K275	L267-E271 PolarHBondContact O-N 2.81Å; E271-R273 VanDerWaalsContact C-N 3.28Å; E271-R273 PolarHBondContact O-N 3.38Å; E271-S274 PolarHBondContact O-N 2.96Å; E271-K275 HydrophobicContact CG-CD 4.11Å; E271-K275 PolarHBondContact O-N 3.33Å; E271-K275 IonicContact OE1-NZ 3.2Å; E271-K275 PolarHBondContact OE1-NZ 3.26Å
272	L	75.8	Confident	70.3	Confident	63 Å²	63	84 Å²	84	33%	0.33	43%	0.429	S	S	.	.	H	α-helix	trans	-60	-36.7	174.2	-75.8	170.8	0	0	0	112.8	A268 L269 E270	A268-L272 VanDerWaalsContact O-CG 3.29Å; A268-L272 WeakPolarHBondContact O-CG 3.47Å; A268-L272 PolarHBondContact O-N 3.17Å; A268-L272 VanDerWaalsContact O-N 3.09Å; L269-L272 HydrophobicContact CD2-CD1 4.48Å; E270-L272 VanDerWaalsContact C-N 3.35Å; E270-L272 PolarHBondContact O-N 3.49Å
273	R	74.9	Confident	68.9	Low	206 Å²	206	83.1 Å²	83.1	78%	0.777	43%	0.43	S	S	*	.	H	α-helix	trans	-76.2	-31	177.2	-72.8	178.1	-176.8	-153.1	0.2	112.8	L269 E270 E271	L269-R273 WeakPolarHBondContact O-CG 3.35Å; L269-R273 PolarHBondContact O-N 3.26Å; E270-R273 PolarHBondContact O-N 3.39Å; E271-R273 VanDerWaalsContact C-N 3.28Å; E271-R273 PolarHBondContact O-N 3.38Å
274	S	68.5	Low	67.6	Low	101 Å²	101	90.3 Å²	90.3	71%	0.706	47%	0.469	S	S	*	.	H	α-helix	trans	-83.9	-34.1	-175.3	-176.7	0	0	0	0	113.9	E270 E271	E270-S274 WeakPolarHBondContact O-CB 3.2Å; E270-S274 PolarHBondContact O-N 3.37Å; E271-S274 PolarHBondContact O-N 2.96Å
275	K	61.5	Low	66.7	Low	140 Å²	140	94.3 Å²	94.3	61%	0.609	49%	0.493	S	S	*	.	H	α-helix	trans	-105.3	-0.8	-168.2	-75.6	-177.4	-175.1	165	0	115.9	E271	E271-K275 HydrophobicContact CG-CD 4.11Å; E271-K275 PolarHBondContact O-N 3.33Å; E271-K275 IonicContact OE1-NZ 3.2Å; E271-K275 PolarHBondContact OE1-NZ 3.26Å
276	G	54.2	Low	66.1	Low	60 Å²	60	92.8 Å²	92.8	62%	0.619	49%	0.485	S	S	*	.			trans	48.6	76.6	174	0	0	0	0	0	112.7
277	E	50	Low	65.8	Low	166 Å²	166	90 Å²	90	78%	0.776	48%	0.479	S	S	*	.	S	Bend	trans	75.3	115.2	174.7	-52.3	-173.4	150.6	0	0	117.4
278	S	42.3	Very low	65.5	Low	104 Å²	104	91.5 Å²	91.5	73%	0.727	49%	0.485	S	S	*	.	S	Bend	trans	170.9	-1.3	138.6	42.6	0	0	0	0	115.4
279	N	45.5	Very low	65.4	Low	84 Å²	84	98.9 Å²	98.9	45%	0.449	52%	0.516	S	S	.	.			trans	-131.3	65.5	-179	-76.8	-36.6	0	0	0	114.3	M281	N279-M281 PolarHBondContact O-N 3.16Å
280	Q	47.7	Very low	65.5	Low	165 Å²	165	98.7 Å²	98.7	77%	0.771	51%	0.513	S	S	*	.	G	3₁₀ helix	trans	-60.1	-21.7	165.7	-152	96.7	31	0	0	112.1	N282	Q280-N282 VanDerWaalsContact C-N 3.32Å; Q280-N282 PolarHBondContact O-N 2.95Å
281	M	46	Very low	65.8	Low	159 Å²	159	98.6 Å²	98.6	78%	0.783	51%	0.511	S	S	*	.	G	3₁₀ helix	trans	-70.1	-16.2	-176.6	-67.4	-117.6	-145.8	0	0	115.2	N279 T285	N279-M281 PolarHBondContact O-N 3.16Å; M281-T285 PolarHBondContact O-OG1 2.84Å
282	N	54.2	Low	66.5	Low	60 Å²	60	96.8 Å²	96.8	32%	0.321	51%	0.505	S	S	.	.	G	3₁₀ helix	trans	-84.9	-27.9	-171.4	-153.7	-16	0	0	0	113.2	Q280 T285 A286	Q280-N282 VanDerWaalsContact C-N 3.32Å; Q280-N282 PolarHBondContact O-N 2.95Å; N282-T285 PolarHBondContact O-N 2.63Å; N282-A286 PolarHBondContact O-N 3.33Å
283	L	62.7	Low	67.4	Low	69 Å²	69	94 Å²	94	36%	0.361	49%	0.49	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-38.9	-177.4	-172.6	63.7	0	0	0	112.7	V265 L269 T285 A286	V265-L283 HydrophobicContact CB-CD1 4.45Å; V265-L283 HydrophobicContact CG1-CD1 3.89Å; V265-L283 HydrophobicContact CG2-CD1 4.38Å; L269-L283 HydrophobicContact CG-CD1 4.49Å; L283-T285 PolarHBondContact O-N 2.92Å; L283-A286 WeakPolarHBondContact O-CB 3.37Å; L283-A286 PolarHBondContact O-N 3.47Å
284	D	62.1	Low	68.3	Low	151 Å²	151	85.8 Å²	85.8	81%	0.807	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-19	177.5	-65.3	-32.3	0	0	0	112.4
285	T	68.3	Low	69.5	Low	92 Å²	92	81 Å²	81	56%	0.564	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	-7.3	179.1	-47.6	0	0	0	0	112.1	M281 N282 L283 S287	M281-T285 PolarHBondContact O-OG1 2.84Å; N282-T285 PolarHBondContact O-N 2.63Å; L283-T285 PolarHBondContact O-N 2.92Å; T285-S287 PolarHBondContact O-N 3.4Å; T285-S287 VanDerWaalsContact O-N 3.16Å
286	A	75.7	Confident	70.9	Confident	12 Å²	12	75.6 Å²	75.6	10%	0.099	41%	0.407	C	S	.	.			trans	-64.5	115.4	-177.9	0	0	0	0	0	111.7	A264 V265 N282 L283 Q290	A264-A286 HydrophobicContact CB-CB 4.05Å; V265-A286 HydrophobicContact CG2-CB 3.67Å; N282-A286 PolarHBondContact O-N 3.33Å; L283-A286 WeakPolarHBondContact O-CB 3.37Å; L283-A286 PolarHBondContact O-N 3.47Å; A286-Q290 VanDerWaalsContact CA-OE1 3.25Å
287	S	81.9	Confident	72.4	Confident	32 Å²	32	74.2 Å²	74.2	22%	0.224	39%	0.387	C	S	.	.			trans	-133.8	151	-174.5	176.6	0	0	0	0	111.5	T285 K289 Q290	T285-S287 PolarHBondContact O-N 3.4Å; T285-S287 VanDerWaalsContact O-N 3.16Å; S287-K289 PolarHBondContact O-N 3.13Å; S287-K289 PolarHBondContact OG-N 3.27Å; S287-Q290 PolarHBondContact O-N 3.23Å; S287-Q290 VanDerWaalsContact O-N 3.13Å; S287-Q290 PolarHBondContact O-OE1 3.25Å
288	E	78.9	Confident	73.7	Confident	69 Å²	69	72.1 Å²	72.1	32%	0.322	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-16.5	169.8	65	-81.3	-173.1	0	0	114.2	D257 S260 K261	D257-E288 HydrophobicContact CB-CB 3.89Å; D257-E288 HydrophobicContact CB-CG 4.26Å; S260-E288 WeakPolarHBondContact CB-O 3.29Å; S260-E288 VanDerWaalsContact OG-C 3.29Å; S260-E288 PolarHBondContact OG-O 3.27Å; K261-E288 HydrophobicContact CB-CB 4.28Å
289	K	81.8	Confident	75.4	Confident	161 Å²	161	72.1 Å²	72.1	70%	0.7	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	-6.4	179	-61.8	-176.1	-178.5	179.6	0	114.6	S287 T332	S287-K289 PolarHBondContact O-N 3.13Å; S287-K289 PolarHBondContact OG-N 3.27Å; K289-T332 WeakPolarHBondContact O-CB 3.47Å; K289-T332 PolarHBondContact O-OG1 3.27Å; K289-T332 VanDerWaalsContact O-OG1 3.13Å
290	Q	83.4	Confident	76.9	Confident	63 Å²	63	70.9 Å²	70.9	29%	0.294	40%	0.397	S	S	.	.	S	Bend	trans	-81	-25.6	-175.4	-70.3	175	-64.2	0	0	113.1	A264 A286 S287 P331 T332	A264-Q290 HydrophobicContact CB-CB 4.47Å; A286-Q290 VanDerWaalsContact CA-OE1 3.25Å; S287-Q290 PolarHBondContact O-N 3.23Å; S287-Q290 VanDerWaalsContact O-N 3.13Å; S287-Q290 PolarHBondContact O-OE1 3.25Å; Q290-P331 WeakPolarHBondContact O-CA 3.41Å; Q290-T332 PolarHBondContact O-N 3.08Å
291	Y	89.6	Confident	78.8	Confident	47 Å²	47	69 Å²	69	18%	0.184	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	135.9	-178.6	-67.5	-84.6	0	0	0	111.8	S260 L263 A264 L267 Y329 A330 P331 T332	S260-Y291 PolarHBondContact OG-O 3.13Å; L263-Y291 HydrophobicContact CB-CD2 4.42Å; L263-Y291 HydrophobicContact CD2-CD1 3.57Å; L263-Y291 HydrophobicContact CD2-CD2 3.94Å; L263-Y291 HydrophobicContact CD2-CE1 4.06Å; L263-Y291 HydrophobicContact CD2-CE2 4.4Å; L263-Y291 HydrophobicContact CD2-CG 3.52Å; L263-Y291 HydrophobicContact CG-CD1 4.43Å; L263-Y291 HydrophobicContact CG-CD2 4.13Å; L263-Y291 HydrophobicContact CG-CE2 4.3Å; L263-Y291 HydrophobicContact CG-CG 4.21Å; A264-Y291 HydrophobicContact CB-CD2 4.15Å; A264-Y291 HydrophobicContact CB-CE2 4.07Å; L267-Y291 HydrophobicContact CD1-CE1 4.19Å; L267-Y291 HydrophobicContact CD1-CE2 4.14Å; L267-Y291 WeakPolarHBondContact CD1-OH 3.18Å; Y291-Y329 HydrophobicContact CD1-CD2 4.13Å; Y291-Y329 HydrophobicContact CE1-CD2 4.36Å; Y291-A330 WeakPolarHBondContact CA-O 3.3Å; Y291-P331 HydrophobicContact CE1-CG 4.11Å; Y291-T332 WeakPolarHBondContact CA-OG1 3.22Å; Y291-T332 PolarHBondContact N-OG1 2.81Å
292	T	92.1	Very high	80.9	Confident	29 Å²	29	64.7 Å²	64.7	18%	0.178	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	132.2	170.8	-56.7	0	0	0	0	108.8	Y294 V304 Y329 A330 T332	T292-Y294 HydrophobicContact CG2-CD2 4.41Å; T292-Y294 HydrophobicContact CG2-CE1 4.26Å; T292-Y294 HydrophobicContact CG2-CE2 3.68Å; T292-Y294 VanDerWaalsContact O-CD2 3.31Å; T292-Y294 WeakPolarHBondContact O-CD2 3.34Å; T292-Y294 WeakPolarHBondContact O-CE2 3.43Å; T292-V304 HydrophobicContact CG2-CB 4.5Å; T292-V304 HydrophobicContact CG2-CG1 3.63Å; T292-V304 HydrophobicContact CG2-CG2 4.15Å; T292-Y329 WeakPolarHBondContact O-CA 3.18Å; T292-A330 PolarHBondContact N-O 3.23Å; T292-A330 PolarHBondContact O-N 3.04Å; T292-A330 VanDerWaalsContact O-N 3.09Å; T292-T332 PolarHBondContact N-OG1 3.19Å; T292-T332 VanDerWaalsContact N-OG1 3.16Å; T292-T332 PolarHBondContact OG1-OG1 3.16Å
293	I	94	Very high	82.8	Confident	4 Å²	4	64 Å²	64	2%	0.021	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	136.1	-177.2	-47.5	-50	0	0	0	109.7	F230 V256 L305 L327 Y328	F230-I293 HydrophobicContact CE2-CD1 3.94Å; F230-I293 HydrophobicContact CE2-CG2 4.17Å; F230-I293 HydrophobicContact CZ-CD1 3.54Å; V256-I293 HydrophobicContact CG1-CB 3.62Å; V256-I293 HydrophobicContact CG1-CG1 3.61Å; V256-I293 HydrophobicContact CG1-CG2 4.21Å; I293-L305 HydrophobicContact CG2-CD1 4.13Å; I293-L305 PolarHBondContact O-N 3.49Å; I293-L327 HydrophobicContact CG2-CB 4.37Å; I293-L327 HydrophobicContact CG2-CD1 4.3Å; I293-Y328 CarbonylContact C-O 3.5Å; I293-Y328 WeakPolarHBondContact CA-O 3.31Å
294	Y	94	Very high	84.2	Confident	33 Å²	33	64.7 Å²	64.7	13%	0.129	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	151.8	-177.2	-55.4	-101.5	0	0	0	110.3	H233 L236 T292 F302 T303 V304 Y328 A330	H233-Y294 AromaticContact CD2-CD2 3.81Å; H233-Y294 AromaticContact CD2-CG 3.84Å; L236-Y294 HydrophobicContact CD1-CE1 4.46Å; L236-Y294 HydrophobicContact CD1-CE2 4.37Å; T292-Y294 HydrophobicContact CG2-CD2 4.41Å; T292-Y294 HydrophobicContact CG2-CE1 4.26Å; T292-Y294 HydrophobicContact CG2-CE2 3.68Å; T292-Y294 VanDerWaalsContact O-CD2 3.31Å; T292-Y294 WeakPolarHBondContact O-CD2 3.34Å; T292-Y294 WeakPolarHBondContact O-CE2 3.43Å; Y294-F302 HydrophobicContact CD1-CB 4.15Å; Y294-T303 CarbonylContact C-O 3.46Å; Y294-T303 VanDerWaalsContact CA-O 3.25Å; Y294-T303 WeakPolarHBondContact CA-O 3.41Å; Y294-V304 HydrophobicContact CD1-CG2 3.74Å; Y294-V304 HydrophobicContact CE1-CG2 3.35Å; Y294-Y328 PolarHBondContact N-O 2.91Å; Y294-Y328 PolarHBondContact O-N 3.47Å; Y294-A330 HydrophobicContact CE2-CB 3.93Å
295	I	94.2	Very high	85.7	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	138.8	167.8	-170.1	157.8	0	0	0	109.3	T297 F302 T303 L305 V314 Y318 W319 M325 L327	I295-T297 PolarHBondContact O-N 3.06Å; I295-F302 WeakPolarHBondContact O-CA 3.33Å; I295-T303 PolarHBondContact N-O 2.82Å; I295-T303 PolarHBondContact O-N 2.8Å; I295-L305 HydrophobicContact CB-CD1 4.24Å; I295-L305 HydrophobicContact CB-CD2 4.38Å; I295-L305 HydrophobicContact CB-CG 4.37Å; I295-L305 HydrophobicContact CG2-CD1 4.44Å; I295-L305 HydrophobicContact CG2-CD2 3.69Å; I295-L305 HydrophobicContact CG2-CG 4.1Å; I295-V314 HydrophobicContact CD1-CG1 4.08Å; I295-Y318 HydrophobicContact CG2-CD1 4.26Å; I295-Y318 HydrophobicContact CG2-CG 4.18Å; I295-W319 HydrophobicContact CD1-CB 4.37Å; I295-W319 HydrophobicContact CD1-CE3 4.26Å; I295-M325 HydrophobicContact CD1-CG 4.18Å; I295-M325 HydrophobicContact CD1-SD 4.1Å; I295-L327 HydrophobicContact CB-CD2 3.97Å; I295-L327 HydrophobicContact CD1-CD2 3.92Å; I295-L327 HydrophobicContact CG1-CD2 4.1Å
296	A	90.9	Very high	86.8	Confident	27 Å²	27	57.6 Å²	57.6	22%	0.223	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	122.2	174.1	0	0	0	0	0	109.3	Q301 F302 Y328	A296-Q301 CarbonylContact C-O 3.59Å; A296-Q301 WeakPolarHBondContact CA-O 3.27Å; A296-F302 HydrophobicContact CB-CD1 4.39Å; A296-F302 HydrophobicContact CB-CE1 4.07Å; A296-Y328 HydrophobicContact CB-CE2 3.92Å
297	T	84.6	Confident	87.4	Confident	32 Å²	32	57.7 Å²	57.7	20%	0.196	33%	0.33	C	S	.	.			trans	-86.7	161.5	174.1	46.7	0	0	0	0	110.6	I295 N299 G300 Q301 T303	I295-T297 PolarHBondContact O-N 3.06Å; T297-N299 VanDerWaalsContact CB-OD1 3.23Å; T297-N299 WeakPolarHBondContact CB-OD1 3.41Å; T297-N299 PolarHBondContact O-N 3.38Å; T297-N299 PolarHBondContact OG1-OD1 3.27Å; T297-G300 PolarHBondContact O-N 2.94Å; T297-Q301 PolarHBondContact N-O 3.25Å; T297-Q301 PolarHBondContact OG1-O 3.16Å; T297-T303 VanDerWaalsContact CG2-OG1 3.28Å; T297-T303 WeakPolarHBondContact CG2-OG1 3.46Å
298	A	77.9	Confident	87.9	Confident	121 Å²	121	60 Å²	60	100%	1	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-20.2	-174.6	0	0	0	0	0	114.9	G300	A298-G300 VanDerWaalsContact C-N 3.32Å
299	N	77.9	Confident	88.6	Confident	104 Å²	104	58.8 Å²	58.8	56%	0.556	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	10.4	175	59.3	-11	0	0	0	113.7	T297 Q301	T297-N299 VanDerWaalsContact CB-OD1 3.23Å; T297-N299 WeakPolarHBondContact CB-OD1 3.41Å; T297-N299 PolarHBondContact O-N 3.38Å; T297-N299 PolarHBondContact OG1-OD1 3.27Å; N299-Q301 PolarHBondContact ND2-OE1 2.8Å; N299-Q301 PolarHBondContact O-N 3.5Å
300	G	77.6	Confident	89.3	Confident	58 Å²	58	52.8 Å²	52.8	60%	0.598	32%	0.318	S	S	*	.	S	Bend	trans	73.1	8.9	179.4	0	0	0	0	0	114.6	T297 A298	T297-G300 PolarHBondContact O-N 2.94Å; A298-G300 VanDerWaalsContact C-N 3.32Å
301	Q	86.8	Confident	89.8	Confident	125 Å²	125	49.8 Å²	49.8	58%	0.584	30%	0.304	S	S	*	.	P	Polyproline II helix	trans	-86.4	155.3	174.2	-67.5	179.9	-22.1	0	0	110.8	A296 T297 N299	A296-Q301 CarbonylContact C-O 3.59Å; A296-Q301 WeakPolarHBondContact CA-O 3.27Å; T297-Q301 PolarHBondContact N-O 3.25Å; T297-Q301 PolarHBondContact OG1-O 3.16Å; N299-Q301 PolarHBondContact ND2-OE1 2.8Å; N299-Q301 PolarHBondContact O-N 3.5Å
302	F	91.3	Very high	89.9	Confident	69 Å²	69	50.5 Å²	50.5	30%	0.303	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	118.6	175.9	-69.5	-88.1	0	0	0	109.5	H233 P234 Y294 I295 A296 Y328	H233-F302 AromaticContact NE2-CD1 3.8Å; H233-F302 AromaticContact NE2-CD2 3.7Å; H233-F302 AromaticContact NE2-CG 3.39Å; H233-F302 WeakPolarHBondContact NE2-CG 3.46Å; P234-F302 HydrophobicContact CG-CE1 4.39Å; P234-F302 HydrophobicContact CG-CE2 3.92Å; P234-F302 HydrophobicContact CG-CZ 3.58Å; Y294-F302 HydrophobicContact CD1-CB 4.15Å; I295-F302 WeakPolarHBondContact O-CA 3.33Å; A296-F302 HydrophobicContact CB-CD1 4.39Å; A296-F302 HydrophobicContact CB-CE1 4.07Å; F302-Y328 HydrophobicContact CD1-CD2 4.05Å; F302-Y328 HydrophobicContact CD1-CG 4.12Å; F302-Y328 AromaticContact CE1-CD1 3.84Å; F302-Y328 HydrophobicContact CE1-CD1 3.84Å; F302-Y328 AromaticContact CE1-CD2 3.58Å; F302-Y328 HydrophobicContact CE1-CD2 3.58Å; F302-Y328 HydrophobicContact CE1-CE1 4.04Å; F302-Y328 AromaticContact CE1-CE2 3.84Å; F302-Y328 HydrophobicContact CE1-CE2 3.84Å; F302-Y328 AromaticContact CE1-CG 3.6Å; F302-Y328 HydrophobicContact CE1-CG 3.6Å; F302-Y328 HydrophobicContact CZ-CE1 4.5Å
303	T	92.1	Very high	89.9	Confident	47 Å²	47	52.3 Å²	52.3	29%	0.288	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	128.9	177.2	-60.9	0	0	0	0	109.8	Y294 I295 T297 L305 Y318	Y294-T303 CarbonylContact C-O 3.46Å; Y294-T303 VanDerWaalsContact CA-O 3.25Å; Y294-T303 WeakPolarHBondContact CA-O 3.41Å; I295-T303 PolarHBondContact N-O 2.82Å; I295-T303 PolarHBondContact O-N 2.8Å; T297-T303 VanDerWaalsContact CG2-OG1 3.28Å; T297-T303 WeakPolarHBondContact CG2-OG1 3.46Å; T303-L305 PolarHBondContact O-N 3.15Å; T303-Y318 HydrophobicContact CG2-CE1 4.22Å
304	V	93.4	Very high	89.9	Confident	82 Å²	82	52.1 Å²	52.1	50%	0.497	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	128.4	172.7	178	0	0	0	0	109.5	T292 Y294	T292-V304 HydrophobicContact CG2-CB 4.5Å; T292-V304 HydrophobicContact CG2-CG1 3.63Å; T292-V304 HydrophobicContact CG2-CG2 4.15Å; Y294-V304 HydrophobicContact CD1-CG2 3.74Å; Y294-V304 HydrophobicContact CE1-CG2 3.35Å
305	L	92.9	Very high	89.7	Confident	8 Å²	8	52.3 Å²	52.3	4%	0.042	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-87.9	140.2	175.1	-66.1	-179.9	0	0	0	110.9	V256 I293 I295 T303 V314 Y318 L327	V256-L305 HydrophobicContact CG1-CB 3.95Å; V256-L305 HydrophobicContact CG2-CB 3.93Å; V256-L305 HydrophobicContact CG2-CD1 4.15Å; I293-L305 HydrophobicContact CG2-CD1 4.13Å; I293-L305 PolarHBondContact O-N 3.49Å; I295-L305 HydrophobicContact CB-CD1 4.24Å; I295-L305 HydrophobicContact CB-CD2 4.38Å; I295-L305 HydrophobicContact CB-CG 4.37Å; I295-L305 HydrophobicContact CG2-CD1 4.44Å; I295-L305 HydrophobicContact CG2-CD2 3.69Å; I295-L305 HydrophobicContact CG2-CG 4.1Å; T303-L305 PolarHBondContact O-N 3.15Å; L305-V314 HydrophobicContact CD1-CG1 3.66Å; L305-V314 HydrophobicContact CD1-CG2 4.18Å; L305-V314 HydrophobicContact CD2-CG1 4Å; L305-V314 HydrophobicContact CD2-CG2 4.26Å; L305-Y318 HydrophobicContact CD2-CD2 3.91Å; L305-Y318 HydrophobicContact CD2-CE2 3.95Å; L305-Y318 HydrophobicContact CD2-CG 4.33Å; L305-L327 HydrophobicContact CD1-CD2 3.75Å
306	N	91.5	Very high	89.5	Confident	87 Å²	87	58.5 Å²	58.5	47%	0.465	35%	0.352	S	S	.	.	P	Polyproline II helix	trans	-73.3	131.9	173.6	-171.9	-36.9	0	0	0	109.7	V256 S308 F309	V256-N306 WeakPolarHBondContact CB-O 3.14Å; V256-N306 WeakPolarHBondContact CG2-O 3.42Å; N306-S308 PolarHBondContact O-N 2.98Å; N306-S308 VanDerWaalsContact O-N 3.13Å; N306-S308 PolarHBondContact OD1-N 3.37Å; N306-S308 PolarHBondContact OD1-OG 2.78Å; N306-F309 HydrophobicContact CB-CD1 4.09Å; N306-F309 HydrophobicContact CB-CD2 3.83Å; N306-F309 HydrophobicContact CB-CE1 4Å; N306-F309 HydrophobicContact CB-CE2 3.73Å; N306-F309 HydrophobicContact CB-CG 4.01Å; N306-F309 HydrophobicContact CB-CZ 3.82Å; N306-F309 WeakPolarHBondContact O-CB 3.42Å; N306-F309 PolarHBondContact O-N 2.96Å
307	G	89.4	Confident	89.5	Confident	13 Å²	13	62.3 Å²	62.3	13%	0.134	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.2	-34.4	178.1	0	0	0	0	0	115.1	T255 V256 D257 F309	T255-G307 WeakPolarHBondContact CB-O 3.45Å; T255-G307 PolarHBondContact OG1-O 3.1Å; V256-G307 PolarHBondContact N-O 3.43Å; D257-G307 VanDerWaalsContact CG-C 3.44Å; D257-G307 PolarHBondContact N-O 2.92Å; D257-G307 WeakPolarHBondContact OD1-CA 3.19Å; D257-G307 VanDerWaalsContact OD2-C 3.25Å; D257-G307 WeakPolarHBondContact OD2-CA 3.39Å; G307-F309 VanDerWaalsContact C-N 3.34Å; G307-F309 PolarHBondContact O-N 2.8Å
308	S	91.6	Very high	89.6	Confident	80 Å²	80	63.7 Å²	63.7	56%	0.559	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-7.4	-177.5	75.4	0	0	0	0	114.5	N306	N306-S308 PolarHBondContact O-N 2.98Å; N306-S308 VanDerWaalsContact O-N 3.13Å; N306-S308 PolarHBondContact OD1-N 3.37Å; N306-S308 PolarHBondContact OD1-OG 2.78Å
309	F	94.1	Very high	90.2	Very high	45 Å²	45	60 Å²	60	20%	0.197	33%	0.326	C	S	.	.			trans	-76	135.5	-179.7	-68.2	-13.7	0	0	0	111.2	T255 V256 N306 G307 L313 V314 Y318	T255-F309 CarbonylContact C-O 3.56Å; T255-F309 WeakPolarHBondContact CA-O 3.35Å; T255-F309 WeakPolarHBondContact CB-O 3.48Å; V256-F309 HydrophobicContact CG2-CB 4.32Å; V256-F309 PolarHBondContact N-O 3.35Å; N306-F309 HydrophobicContact CB-CD1 4.09Å; N306-F309 HydrophobicContact CB-CD2 3.83Å; N306-F309 HydrophobicContact CB-CE1 4Å; N306-F309 HydrophobicContact CB-CE2 3.73Å; N306-F309 HydrophobicContact CB-CG 4.01Å; N306-F309 HydrophobicContact CB-CZ 3.82Å; N306-F309 WeakPolarHBondContact O-CB 3.42Å; N306-F309 PolarHBondContact O-N 2.96Å; G307-F309 VanDerWaalsContact C-N 3.34Å; G307-F309 PolarHBondContact O-N 2.8Å; F309-L313 HydrophobicContact CB-CD2 4.27Å; F309-L313 HydrophobicContact CD1-CD2 3.83Å; F309-L313 HydrophobicContact CE1-CD2 4.36Å; F309-L313 HydrophobicContact CG-CD2 4.05Å; F309-V314 HydrophobicContact CB-CG2 3.86Å; F309-Y318 HydrophobicContact CD2-CE2 4.34Å; F309-Y318 HydrophobicContact CE2-CE2 4.27Å
310	S	95.3	Very high	90.4	Very high	34 Å²	34	62.9 Å²	62.9	24%	0.238	33%	0.333	C	S	.	.	B	Isolated β-bridge	trans	-72	152.5	170	64.7	0	0	0	0	110.8	A254 E312 L313 V314	A254-S310 CarbonylContact O-C 3.53Å; A254-S310 VanDerWaalsContact O-CA 3.25Å; A254-S310 WeakPolarHBondContact O-CA 3.46Å; S310-E312 PolarHBondContact O-N 2.96Å; S310-L313 PolarHBondContact O-N 2.94Å; S310-L313 VanDerWaalsContact OG-CB 3.3Å; S310-L313 WeakPolarHBondContact OG-CB 3.47Å; S310-L313 PolarHBondContact OG-N 3.15Å; S310-V314 WeakPolarHBondContact O-CG2 3.34Å; S310-V314 PolarHBondContact O-N 2.9Å
311	L	94.1	Very high	90.7	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-65.8	-29.7	178.1	-62.5	-177	0	0	0	112.1	I226 L228 T250 G252 A254 L259 V314 S315 M325 L327	I226-L311 VanDerWaalsContact CD1-C 3.43Å; I226-L311 HydrophobicContact CD1-CB 3.8Å; I226-L311 WeakPolarHBondContact CD1-O 3.3Å; L228-L311 HydrophobicContact CD2-CD1 3.84Å; T250-L311 HydrophobicContact CG2-CD1 3.41Å; T250-L311 VanDerWaalsContact CG2-CD1 3.41Å; G252-L311 PolarHBondContact O-N 3.42Å; G252-L311 VanDerWaalsContact O-N 3.17Å; A254-L311 HydrophobicContact CB-CD1 4.03Å; A254-L311 HydrophobicContact CB-CG 4.37Å; A254-L311 WeakPolarHBondContact O-CG 3.47Å; A254-L311 PolarHBondContact O-N 2.96Å; L259-L311 HydrophobicContact CD1-CD1 4.06Å; L259-L311 HydrophobicContact CD1-CD2 3.44Å; L259-L311 VanDerWaalsContact CD1-CD2 3.44Å; L259-L311 HydrophobicContact CD1-CG 4.36Å; L259-L311 HydrophobicContact CD2-CD1 4.27Å; L259-L311 HydrophobicContact CG-CD1 4.22Å; L259-L311 HydrophobicContact CG-CD2 4.12Å; L311-V314 PolarHBondContact O-N 3.32Å; L311-S315 VanDerWaalsContact O-CB 3.31Å; L311-S315 WeakPolarHBondContact O-CB 3.3Å; L311-S315 PolarHBondContact O-N 2.76Å; L311-M325 HydrophobicContact CB-CE 4.42Å; L311-M325 HydrophobicContact CD2-CE 4.2Å; L311-L327 HydrophobicContact CD2-CD1 4.49Å
312	E	92.6	Very high	90.6	Very high	63 Å²	63	66 Å²	66	29%	0.294	34%	0.342	S	S	.	.	H	α-helix	trans	-61.6	-49.4	170.7	-169.8	166.2	-131.6	0	0	111	S224 I226 G252 S310 V314 S315 E316	S224-E312 WeakPolarHBondContact CB-OE1 3.46Å; S224-E312 PolarHBondContact OG-OE1 3.21Å; I226-E312 HydrophobicContact CD1-CB 4.35Å; G252-E312 PolarHBondContact O-N 3.42Å; S310-E312 PolarHBondContact O-N 2.96Å; E312-V314 VanDerWaalsContact C-N 3.31Å; E312-V314 PolarHBondContact O-N 2.88Å; E312-S315 WeakPolarHBondContact O-CB 3.32Å; E312-S315 PolarHBondContact O-N 3.17Å; E312-E316 WeakPolarHBondContact O-CG 3.23Å; E312-E316 PolarHBondContact O-N 3.08Å
313	L	92.6	Very high	90.4	Very high	66 Å²	66	70 Å²	70	35%	0.346	36%	0.36	S	S	.	.	H	α-helix	trans	-61.9	-39.2	175.7	178.4	63.7	0	0	0	112	F309 S310 K317	F309-L313 HydrophobicContact CB-CD2 4.27Å; F309-L313 HydrophobicContact CD1-CD2 3.83Å; F309-L313 HydrophobicContact CE1-CD2 4.36Å; F309-L313 HydrophobicContact CG-CD2 4.05Å; S310-L313 PolarHBondContact O-N 2.94Å; S310-L313 VanDerWaalsContact OG-CB 3.3Å; S310-L313 WeakPolarHBondContact OG-CB 3.47Å; S310-L313 PolarHBondContact OG-N 3.15Å; L313-K317 WeakPolarHBondContact O-CB 3.43Å; L313-K317 PolarHBondContact O-N 3.39Å
314	V	92.5	Very high	90.3	Very high	0 Å²	0	70.4 Å²	70.4	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-64.9	-44	177.4	175.6	0	0	0	0	110.7	V256 I295 L305 F309 S310 L311 E312 K317 Y318 W319 M325	V256-V314 HydrophobicContact CG2-CG2 3.99Å; I295-V314 HydrophobicContact CD1-CG1 4.08Å; L305-V314 HydrophobicContact CD1-CG1 3.66Å; L305-V314 HydrophobicContact CD1-CG2 4.18Å; L305-V314 HydrophobicContact CD2-CG1 4Å; L305-V314 HydrophobicContact CD2-CG2 4.26Å; F309-V314 HydrophobicContact CB-CG2 3.86Å; S310-V314 WeakPolarHBondContact O-CG2 3.34Å; S310-V314 PolarHBondContact O-N 2.9Å; L311-V314 PolarHBondContact O-N 3.32Å; E312-V314 VanDerWaalsContact C-N 3.31Å; E312-V314 PolarHBondContact O-N 2.88Å; V314-K317 PolarHBondContact O-N 2.98Å; V314-Y318 HydrophobicContact CG1-CD2 4.22Å; V314-Y318 WeakPolarHBondContact O-CB 2.95Å; V314-Y318 PolarHBondContact O-N 3.32Å; V314-W319 PolarHBondContact O-N 3.39Å; V314-M325 HydrophobicContact CB-SD 4.33Å; V314-M325 HydrophobicContact CG1-CE 4.29Å; V314-M325 HydrophobicContact CG1-SD 3.62Å
315	S	90.9	Very high	90.3	Very high	37 Å²	37	66.7 Å²	66.7	26%	0.259	34%	0.341	S	S	.	.	I	π-helix	trans	-59.8	-49.1	177.7	-176	0	0	0	0	111.4	L311 E312 K317 W319 K320	L311-S315 VanDerWaalsContact O-CB 3.31Å; L311-S315 WeakPolarHBondContact O-CB 3.3Å; L311-S315 PolarHBondContact O-N 2.76Å; E312-S315 WeakPolarHBondContact O-CB 3.32Å; E312-S315 PolarHBondContact O-N 3.17Å; S315-K317 PolarHBondContact O-N 3.49Å; S315-W319 WeakPolarHBondContact O-CB 3.34Å; S315-W319 PolarHBondContact O-N 2.69Å; S315-K320 PolarHBondContact O-N 2.98Å
316	E	90.3	Very high	90.4	Very high	131 Å²	131	69 Å²	69	61%	0.612	35%	0.351	S	S	*	.	I	π-helix	trans	-65.4	-39.5	179.6	-71.2	-177.7	169	0	0	113	E312 K320	E312-E316 WeakPolarHBondContact O-CG 3.23Å; E312-E316 PolarHBondContact O-N 3.08Å; E316-K320 WeakPolarHBondContact O-CE 3.49Å; E316-K320 WeakPolarHBondContact O-CG 3.39Å
317	K	89.3	Confident	90.5	Very high	106 Å²	106	64.8 Å²	64.8	46%	0.461	33%	0.329	S	S	.	.	I	π-helix	trans	-86.3	-41.4	-171.7	-172.3	173.4	176	-166.3	0	113.2	L313 V314 S315 K320	L313-K317 WeakPolarHBondContact O-CB 3.43Å; L313-K317 PolarHBondContact O-N 3.39Å; V314-K317 PolarHBondContact O-N 2.98Å; S315-K317 PolarHBondContact O-N 3.49Å; K317-K320 WeakPolarHBondContact O-CE 3.25Å
318	Y	87.8	Confident	90.7	Very high	61 Å²	61	65.4 Å²	65.4	24%	0.239	33%	0.327	C	S	.	.	I	π-helix	trans	-114.3	-31.8	-168.4	-61.6	-83.1	0	0	0	113.9	I295 T303 L305 F309 V314	I295-Y318 HydrophobicContact CG2-CD1 4.26Å; I295-Y318 HydrophobicContact CG2-CG 4.18Å; T303-Y318 HydrophobicContact CG2-CE1 4.22Å; L305-Y318 HydrophobicContact CD2-CD2 3.91Å; L305-Y318 HydrophobicContact CD2-CE2 3.95Å; L305-Y318 HydrophobicContact CD2-CG 4.33Å; F309-Y318 HydrophobicContact CD2-CE2 4.34Å; F309-Y318 HydrophobicContact CE2-CE2 4.27Å; V314-Y318 HydrophobicContact CG1-CD2 4.22Å; V314-Y318 WeakPolarHBondContact O-CB 2.95Å; V314-Y318 PolarHBondContact O-N 3.32Å
319	W	89.3	Confident	90.8	Very high	45 Å²	45	61.7 Å²	61.7	17%	0.17	30%	0.301	C	S	.	.	I	π-helix	trans	-90	-57	-176	-169.3	-121.7	0	0	0	112.8	I295 V314 S315 V321 K323 P324 M325 E326	I295-W319 HydrophobicContact CD1-CB 4.37Å; I295-W319 HydrophobicContact CD1-CE3 4.26Å; V314-W319 PolarHBondContact O-N 3.39Å; S315-W319 WeakPolarHBondContact O-CB 3.34Å; S315-W319 PolarHBondContact O-N 2.69Å; W319-V321 PolarHBondContact NE1-O 3.14Å; W319-V321 WeakPolarHBondContact O-CG2 3.43Å; W319-V321 PolarHBondContact O-N 2.77Å; W319-K323 HydrophobicContact CZ2-CB 4.4Å; W319-K323 PolarHBondContact NE1-O 3Å; W319-P324 VanDerWaalsContact CZ2-O 3.22Å; W319-P324 WeakPolarHBondContact CZ2-O 3.49Å; W319-M325 HydrophobicContact CB-CG 4.17Å; W319-M325 HydrophobicContact CB-SD 4.23Å; W319-M325 HydrophobicContact CD2-CB 4.4Å; W319-M325 HydrophobicContact CD2-CG 4.09Å; W319-M325 HydrophobicContact CE3-CG 4.4Å; W319-M325 HydrophobicContact CG-CB 4.26Å; W319-M325 HydrophobicContact CG-CG 3.98Å; W319-E326 HydrophobicContact CH2-CB 3.73Å; W319-E326 HydrophobicContact CH2-CG 3.7Å; W319-E326 HydrophobicContact CZ2-CG 4.31Å; W319-E326 HydrophobicContact CZ3-CB 3.97Å; W319-E326 HydrophobicContact CZ3-CG 4.44Å
320	K	83.4	Confident	90.6	Very high	164 Å²	164	59.6 Å²	59.6	71%	0.713	29%	0.292	S	S	*	.			trans	53.3	23.2	176.2	-60.1	-178.3	179	-179.6	0	115.4	S315 E316 K317	S315-K320 PolarHBondContact O-N 2.98Å; E316-K320 WeakPolarHBondContact O-CE 3.49Å; E316-K320 WeakPolarHBondContact O-CG 3.39Å; K317-K320 WeakPolarHBondContact O-CE 3.25Å
321	V	84.5	Confident	90.3	Very high	75 Å²	75	61 Å²	61	46%	0.455	30%	0.301	S	S	.	.	S	Bend	trans	-125.7	139.3	179.6	178.3	0	0	0	0	109.2	W319 K323	W319-V321 PolarHBondContact NE1-O 3.14Å; W319-V321 WeakPolarHBondContact O-CG2 3.43Å; W319-V321 PolarHBondContact O-N 2.77Å; V321-K323 HydrophobicContact CG1-CB 3.9Å; V321-K323 HydrophobicContact CG1-CD 4.04Å; V321-K323 HydrophobicContact CG1-CG 3.81Å; V321-K323 PolarHBondContact O-N 3.37Å
322	N	83.3	Confident	89.9	Confident	172 Å²	172	63.6 Å²	63.6	92%	0.92	32%	0.317	S	S	*	.	S	Bend	trans	-80.4	60.1	174.6	-164.7	18.5	0	0	0	111.4
323	K	87.9	Confident	89	Confident	153 Å²	153	68.3 Å²	68.3	67%	0.665	34%	0.336	S	S	*	.	S	Bend	trans	-141.4	158.5	176	-73.2	-175.3	179.9	-177.3	0	108.5	W319 V321 M325	W319-K323 HydrophobicContact CZ2-CB 4.4Å; W319-K323 PolarHBondContact NE1-O 3Å; V321-K323 HydrophobicContact CG1-CB 3.9Å; V321-K323 HydrophobicContact CG1-CD 4.04Å; V321-K323 HydrophobicContact CG1-CG 3.81Å; V321-K323 PolarHBondContact O-N 3.37Å; K323-M325 PolarHBondContact O-N 3.37Å
324	P	90.1	Very high	86.9	Confident	57 Å²	57	73.9 Å²	73.9	37%	0.37	36%	0.36	S	S	.	.			trans	-51.4	131.1	172.3	-27	35.5	0	0	0	111	E227 V229 W319 E326	E227-P324 HydrophobicContact CB-CB 4.21Å; E227-P324 HydrophobicContact CB-CG 4.38Å; E227-P324 CarbonylContact O-C 3.6Å; E227-P324 VanDerWaalsContact O-CA 3.28Å; E227-P324 WeakPolarHBondContact O-CA 3.47Å; V229-P324 HydrophobicContact CG2-CB 4.15Å; W319-P324 VanDerWaalsContact CZ2-O 3.22Å; W319-P324 WeakPolarHBondContact CZ2-O 3.49Å; P324-E326 PolarHBondContact O-N 3.25Å
325	M	93.2	Very high	84.3	Confident	3 Å²	3	83.2 Å²	83.2	2%	0.015	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	128.4	-174.3	-177.2	170	53.4	0	0	110.6	I226 E227 L228 V229 I295 L311 V314 W319 K323 L327	I226-M325 HydrophobicContact CG2-CE 4.32Å; E227-M325 PolarHBondContact O-N 2.97Å; L228-M325 CarbonylContact C-O 3.37Å; L228-M325 WeakPolarHBondContact CA-O 3.29Å; L228-M325 HydrophobicContact CB-CB 4.19Å; L228-M325 VanDerWaalsContact CB-O 3.25Å; L228-M325 WeakPolarHBondContact CB-O 3.43Å; L228-M325 HydrophobicContact CD2-CE 4.49Å; V229-M325 PolarHBondContact N-O 2.96Å; I295-M325 HydrophobicContact CD1-CG 4.18Å; I295-M325 HydrophobicContact CD1-SD 4.1Å; L311-M325 HydrophobicContact CB-CE 4.42Å; L311-M325 HydrophobicContact CD2-CE 4.2Å; V314-M325 HydrophobicContact CB-SD 4.33Å; V314-M325 HydrophobicContact CG1-CE 4.29Å; V314-M325 HydrophobicContact CG1-SD 3.62Å; W319-M325 HydrophobicContact CB-CG 4.17Å; W319-M325 HydrophobicContact CB-SD 4.23Å; W319-M325 HydrophobicContact CD2-CB 4.4Å; W319-M325 HydrophobicContact CD2-CG 4.09Å; W319-M325 HydrophobicContact CE3-CG 4.4Å; W319-M325 HydrophobicContact CG-CB 4.26Å; W319-M325 HydrophobicContact CG-CG 3.98Å; K323-M325 PolarHBondContact O-N 3.37Å; M325-L327 HydrophobicContact CE-CD1 3.89Å; M325-L327 HydrophobicContact CE-CD2 4.34Å; M325-L327 HydrophobicContact CE-CG 4.18Å; M325-L327 HydrophobicContact CG-CD2 4.06Å; M325-L327 HydrophobicContact CG-CG 4.16Å; M325-L327 HydrophobicContact SD-CD2 4.1Å; M325-L327 HydrophobicContact SD-CG 4.46Å
326	E	93.9	Very high	81.4	Confident	56 Å²	56	94.3 Å²	94.3	26%	0.262	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	112.5	176.5	-64.4	-163.5	164.9	0	0	111	V229 R231 W319 P324 Y328	V229-E326 HydrophobicContact CB-CG 4.36Å; V229-E326 WeakPolarHBondContact O-CA 3.44Å; R231-E326 IonicContact CZ-OE1 3.8Å; R231-E326 IonicContact CZ-OE2 3.14Å; R231-E326 VanDerWaalsContact NH1-CD 3.27Å; R231-E326 IonicContact NH1-OE1 3.85Å; R231-E326 PolarHBondContact NH1-OE1 3.13Å; R231-E326 VanDerWaalsContact NH1-OE1 3.13Å; R231-E326 IonicContact NH1-OE2 3.39Å; R231-E326 PolarHBondContact NH1-OE2 3.15Å; R231-E326 IonicContact NH2-OE1 2.95Å; R231-E326 PolarHBondContact NH2-OE1 3.43Å; W319-E326 HydrophobicContact CH2-CB 3.73Å; W319-E326 HydrophobicContact CH2-CG 3.7Å; W319-E326 HydrophobicContact CZ2-CG 4.31Å; W319-E326 HydrophobicContact CZ3-CB 3.97Å; W319-E326 HydrophobicContact CZ3-CG 4.44Å; P324-E326 PolarHBondContact O-N 3.25Å; E326-Y328 HydrophobicContact CB-CE2 4.2Å; E326-Y328 PolarHBondContact OE2-OH 3.33Å; E326-Y328 VanDerWaalsContact OE2-OH 3.09Å
327	L	94.9	Very high	80.9	Confident	0 Å²	0	92.5 Å²	92.5	0%	0	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	151.2	176	-63.8	-176.7	0	0	0	110.6	L228 V229 F230 R231 L259 I293 I295 L305 L311 M325	L228-L327 HydrophobicContact CD2-CD1 4.33Å; V229-L327 PolarHBondContact O-N 3.32Å; F230-L327 WeakPolarHBondContact CA-O 3.4Å; F230-L327 HydrophobicContact CD2-CB 3.74Å; F230-L327 HydrophobicContact CE2-CB 4.1Å; R231-L327 PolarHBondContact N-O 3.25Å; L259-L327 HydrophobicContact CD1-CD1 3.44Å; L259-L327 VanDerWaalsContact CD1-CD1 3.44Å; I293-L327 HydrophobicContact CG2-CB 4.37Å; I293-L327 HydrophobicContact CG2-CD1 4.3Å; I295-L327 HydrophobicContact CB-CD2 3.97Å; I295-L327 HydrophobicContact CD1-CD2 3.92Å; I295-L327 HydrophobicContact CG1-CD2 4.1Å; L305-L327 HydrophobicContact CD1-CD2 3.75Å; L311-L327 HydrophobicContact CD2-CD1 4.49Å; M325-L327 HydrophobicContact CE-CD1 3.89Å; M325-L327 HydrophobicContact CE-CD2 4.34Å; M325-L327 HydrophobicContact CE-CG 4.18Å; M325-L327 HydrophobicContact CG-CD2 4.06Å; M325-L327 HydrophobicContact CG-CG 4.16Å; M325-L327 HydrophobicContact SD-CD2 4.1Å; M325-L327 HydrophobicContact SD-CG 4.46Å
328	Y	94	Very high	80.5	Confident	26 Å²	26	91.7 Å²	91.7	10%	0.102	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	146.6	-178	-61.1	-98.4	0	0	0	109.9	R231 I293 Y294 A296 F302 E326	R231-Y328 HydrophobicContact CB-CD1 3.88Å; R231-Y328 HydrophobicContact CB-CE1 3.92Å; R231-Y328 PolarHBondContact NH1-OH 2.99Å; R231-Y328 CarbonylContact O-C 3.55Å; R231-Y328 WeakPolarHBondContact O-CA 3.38Å; I293-Y328 CarbonylContact C-O 3.5Å; I293-Y328 WeakPolarHBondContact CA-O 3.31Å; Y294-Y328 PolarHBondContact N-O 2.91Å; Y294-Y328 PolarHBondContact O-N 3.47Å; A296-Y328 HydrophobicContact CB-CE2 3.92Å; F302-Y328 HydrophobicContact CD1-CD2 4.05Å; F302-Y328 HydrophobicContact CD1-CG 4.12Å; F302-Y328 AromaticContact CE1-CD1 3.84Å; F302-Y328 HydrophobicContact CE1-CD1 3.84Å; F302-Y328 AromaticContact CE1-CD2 3.58Å; F302-Y328 HydrophobicContact CE1-CD2 3.58Å; F302-Y328 HydrophobicContact CE1-CE1 4.04Å; F302-Y328 AromaticContact CE1-CE2 3.84Å; F302-Y328 HydrophobicContact CE1-CE2 3.84Å; F302-Y328 AromaticContact CE1-CG 3.6Å; F302-Y328 HydrophobicContact CE1-CG 3.6Å; F302-Y328 HydrophobicContact CZ-CE1 4.5Å; E326-Y328 HydrophobicContact CB-CE2 4.2Å; E326-Y328 PolarHBondContact OE2-OH 3.33Å; E326-Y328 VanDerWaalsContact OE2-OH 3.09Å
329	Y	92.6	Very high	80.1	Confident	1 Å²	1	93.4 Å²	93.4	0%	0.004	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	149.4	177.8	62.2	-95.6	0	0	0	112.1	F230 R231 P232 H233 M237 Q244 L263 Y291 T292	F230-Y329 HydrophobicContact CD1-CD1 4.28Å; F230-Y329 AromaticContact CD2-CD1 3.75Å; F230-Y329 HydrophobicContact CD2-CD1 3.75Å; F230-Y329 HydrophobicContact CE1-CD1 4.23Å; F230-Y329 AromaticContact CE2-CD1 3.67Å; F230-Y329 HydrophobicContact CE2-CD1 3.67Å; F230-Y329 HydrophobicContact CE2-CG 4.17Å; F230-Y329 HydrophobicContact CG-CD1 4.05Å; F230-Y329 HydrophobicContact CG-CE1 4.47Å; F230-Y329 AromaticContact CZ-CD1 3.92Å; F230-Y329 HydrophobicContact CZ-CD1 3.92Å; F230-Y329 HydrophobicContact CZ-CG 4.26Å; R231-Y329 WeakPolarHBondContact O-CD1 3.36Å; R231-Y329 WeakPolarHBondContact O-CE1 3.42Å; R231-Y329 PolarHBondContact O-N 3.13Å; P232-Y329 HydrophobicContact CB-CE2 4.39Å; H233-Y329 VanDerWaalsContact CB-O 3.26Å; H233-Y329 WeakPolarHBondContact CB-O 3.3Å; H233-Y329 PolarHBondContact N-O 2.77Å; M237-Y329 HydrophobicContact CE-CD2 4.43Å; M237-Y329 HydrophobicContact CE-CE2 3.8Å; M237-Y329 HydrophobicContact SD-CD2 3.66Å; M237-Y329 HydrophobicContact SD-CE2 3.51Å; M237-Y329 VanDerWaalsContact SD-CE2 3.51Å; Q244-Y329 PolarHBondContact O-OH 3.31Å; L263-Y329 HydrophobicContact CD1-CD1 4.35Å; L263-Y329 HydrophobicContact CD1-CD2 4.43Å; L263-Y329 HydrophobicContact CD1-CE1 4.11Å; L263-Y329 HydrophobicContact CD1-CE2 4.15Å; L263-Y329 HydrophobicContact CD2-CD1 3.8Å; L263-Y329 HydrophobicContact CD2-CD2 3.3Å; L263-Y329 HydrophobicContact CD2-CE1 4.31Å; L263-Y329 HydrophobicContact CD2-CE2 3.83Å; L263-Y329 HydrophobicContact CD2-CG 3.26Å; L263-Y329 HydrophobicContact CG-CD2 4.42Å; Y291-Y329 HydrophobicContact CD1-CD2 4.13Å; Y291-Y329 HydrophobicContact CE1-CD2 4.36Å; T292-Y329 WeakPolarHBondContact O-CA 3.18Å
330	A	90.3	Very high	79.6	Confident	1 Å²	1	96.3 Å²	96.3	1%	0.008	47%	0.465	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	151.2	167.6	0	0	0	0	0	109.7	H233 L236 Y291 T292 Y294 T332	H233-A330 HydrophobicContact CB-CB 3.96Å; L236-A330 HydrophobicContact CB-CB 3.72Å; L236-A330 HydrophobicContact CD1-CB 3.99Å; Y291-A330 WeakPolarHBondContact CA-O 3.3Å; T292-A330 PolarHBondContact N-O 3.23Å; T292-A330 PolarHBondContact O-N 3.04Å; T292-A330 VanDerWaalsContact O-N 3.09Å; Y294-A330 HydrophobicContact CE2-CB 3.93Å; A330-T332 PolarHBondContact O-N 3.02Å
331	P	88.6	Confident	79.3	Confident	65 Å²	65	92.1 Å²	92.1	42%	0.422	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.4	134.3	171.8	-23.1	33	0	0	0	110.7	Q290 Y291 K333	Q290-P331 WeakPolarHBondContact O-CA 3.41Å; Y291-P331 HydrophobicContact CE1-CG 4.11Å; P331-K333 PolarHBondContact O-N 3.37Å
332	T	85.3	Confident	79	Confident	54 Å²	54	93.2 Å²	93.2	33%	0.331	45%	0.449	S	S	.	.			trans	-68	116.6	177.5	-58.2	0	0	0	0	108.9	K289 Q290 Y291 T292 A330 E334	K289-T332 WeakPolarHBondContact O-CB 3.47Å; K289-T332 PolarHBondContact O-OG1 3.27Å; K289-T332 VanDerWaalsContact O-OG1 3.13Å; Q290-T332 PolarHBondContact O-N 3.08Å; Y291-T332 WeakPolarHBondContact CA-OG1 3.22Å; Y291-T332 PolarHBondContact N-OG1 2.81Å; T292-T332 PolarHBondContact N-OG1 3.19Å; T292-T332 VanDerWaalsContact N-OG1 3.16Å; T292-T332 PolarHBondContact OG1-OG1 3.16Å; A330-T332 PolarHBondContact O-N 3.02Å; T332-E334 PolarHBondContact O-N 3.4Å
333	K	73.4	Confident	78.7	Confident	161 Å²	161	87.6 Å²	87.6	70%	0.7	42%	0.415	S	S	*	.			trans	-78.6	110.7	170.8	-64.1	-176.8	-178.6	-178.7	0	107.1	P331 H335	P331-K333 PolarHBondContact O-N 3.37Å; K333-H335 PolarHBondContact O-N 3.24Å; K333-H335 VanDerWaalsContact O-N 3.15Å
334	E	50.4	Low	78	Confident	183 Å²	183	82.5 Å²	82.5	86%	0.855	40%	0.396	S	S	*	.			trans	-56.7	120	171.1	-69	-173.5	160.4	0	0	108.8	T332 K336	T332-E334 PolarHBondContact O-N 3.4Å; E334-K336 VanDerWaalsContact C-N 3.35Å; E334-K336 PolarHBondContact O-N 2.67Å
335	H	37.6	Very low	76.9	Confident	196 Å²	196	84.7 Å²	84.7	91%	0.907	40%	0.398	S	S	*	.			trans	-67.7	102.9	159.9	-89.1	-81.2	0	0	0	106.4	K333	K333-H335 PolarHBondContact O-N 3.24Å; K333-H335 VanDerWaalsContact O-N 3.15Å
336	K	29.2	Very low	75.5	Confident	270 Å²	270	92.1 Å²	92.1	100%	1.174	43%	0.433	S	S	*	.			trans	-63.2	0	171.7	-154	178.7	-170.8	178.7	0	111.5	E334	E334-K336 VanDerWaalsContact C-N 3.35Å; E334-K336 PolarHBondContact O-N 2.67Å

Retrieved 336 of 336 residues in 1811.1 ms (Link to these results)

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