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Vacuolar proton pump subunit B

Non-catalytic subunit of the V1 complex of vacuolar(H+)-ATPase (V-ATPase), a multisubunit enzyme composed of a peripheral complex (V1) that hydrolyzes ATP and a membrane integral complex (V0) that translocates protons. V-ATPase is responsible for acidifying and maintaining the pH of intracellular compartments and in some cell types, is targeted to the plasma membrane, where it is responsible for acidifying the extracellular environment.

AlphaFold DB , UniProt , Accession F6WPC2, Species MACMU (Macaca mulatta, Rhesus macaque), Gene ATP6V1B1, Length 513 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	42.6	Very low	33.9	Very low	252 Å²	252	143.5 Å²	143.5	100%	1.241	83%	0.833	S	S	*	*				0	100	0	-89.3	-178.5	177.2	0	0	108.4
2	A	31	Very low	34	Very low	103 Å²	103	145.8 Å²	145.8	85%	0.851	84%	0.838	S	S	*	*			trans	-155.8	118.7	156.3	0	0	0	0	0	105.2
3	M	29.3	Very low	34	Very low	182 Å²	182	142.9 Å²	142.9	90%	0.897	83%	0.828	S	S	*	*			trans	-66.2	130.8	-170.4	-78.7	162.2	134.1	0	0	111.8	I5	M3-I5 PolarHBondContact O-N 2.56Å
4	E	30.9	Very low	34.9	Very low	196 Å²	196	141.5 Å²	141.5	92%	0.916	83%	0.83	S	S	*	*			trans	-70.5	117	153.9	-77.2	179	150.2	0	0	108	D6	E4-D6 PolarHBondContact O-N 2.9Å
5	I	33.7	Very low	35.2	Very low	153 Å²	153	138.7 Å²	138.7	79%	0.785	82%	0.821	S	S	*	*			trans	-86.6	100.5	173.5	-62	173.8	0	0	0	106.9	M3 S7	M3-I5 PolarHBondContact O-N 2.56Å; I5-S7 PolarHBondContact O-N 3.41Å; I5-S7 VanDerWaalsContact O-N 3.16Å
6	D	30.9	Very low	35.9	Very low	108 Å²	108	135.4 Å²	135.4	58%	0.578	83%	0.826	S	S	*	*			trans	-72.9	94.9	172.6	-162.9	2.7	0	0	0	108.8	E4 R8	E4-D6 PolarHBondContact O-N 2.9Å; D6-R8 VanDerWaalsContact C-N 3.26Å; D6-R8 PolarHBondContact O-N 3.27Å; D6-R8 WeakPolarHBondContact OD1-CG 3.1Å; D6-R8 IonicContact OD1-NE 3.16Å; D6-R8 IonicContact OD2-CZ 2.66Å; D6-R8 VanDerWaalsContact OD2-CZ 3.24Å; D6-R8 IonicContact OD2-NE 2.82Å; D6-R8 PolarHBondContact OD2-NE 3.27Å; D6-R8 IonicContact OD2-NH2 3.42Å; D6-R8 PolarHBondContact OD2-NH2 2.99Å
7	S	37.1	Very low	36.3	Very low	108 Å²	108	134.5 Å²	134.5	76%	0.755	83%	0.825	S	S	*	*			trans	-81.6	71.8	173.8	63	0	0	0	0	110.3	I5	I5-S7 PolarHBondContact O-N 3.41Å; I5-S7 VanDerWaalsContact O-N 3.16Å
8	R	31.3	Very low	37.2	Very low	197 Å²	197	133.9 Å²	133.9	74%	0.743	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-78.8	123.6	165.7	-62.7	-172.3	-162.5	-177	5.9	109.3	D6 G10	D6-R8 VanDerWaalsContact C-N 3.26Å; D6-R8 PolarHBondContact O-N 3.27Å; D6-R8 WeakPolarHBondContact OD1-CG 3.1Å; D6-R8 IonicContact OD1-NE 3.16Å; D6-R8 IonicContact OD2-CZ 2.66Å; D6-R8 VanDerWaalsContact OD2-CZ 3.24Å; D6-R8 IonicContact OD2-NE 2.82Å; D6-R8 PolarHBondContact OD2-NE 3.27Å; D6-R8 IonicContact OD2-NH2 3.42Å; D6-R8 PolarHBondContact OD2-NH2 2.99Å; R8-G10 PolarHBondContact O-N 3.18Å
9	P	38.2	Very low	38.1	Very low	127 Å²	127	135.1 Å²	135.1	83%	0.825	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-69.4	118.2	164.8	27.9	-28.8	0	0	0	108.1
10	G	33.8	Very low	39	Very low	78 Å²	78	130.7 Å²	130.7	80%	0.804	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-66.8	135.9	172.5	0	0	0	0	0	111.3	R8	R8-G10 PolarHBondContact O-N 3.18Å
11	G	34.6	Very low	39.5	Very low	74 Å²	74	126.7 Å²	126.7	76%	0.763	78%	0.78	S	S	*	*			trans	80.3	88.1	162.3	0	0	0	0	0	116
12	L	34.3	Very low	40.2	Very low	171 Å²	171	117.3 Å²	117.3	90%	0.895	74%	0.742	S	S	*	*			trans	-72.9	129.4	159.8	-81.8	155.5	0	0	0	109.6
13	P	34.6	Very low	41.4	Very low	109 Å²	109	120.5 Å²	120.5	71%	0.708	73%	0.732	S	S	*	*			trans	-71.2	129.2	159.7	-1.8	18	0	0	0	108.7	S15	P13-S15 PolarHBondContact O-N 2.95Å; P13-S15 VanDerWaalsContact O-N 3.08Å
14	S	45.7	Very low	42.7	Very low	123 Å²	123	118.2 Å²	118.2	86%	0.86	72%	0.719	S	S	*	*	S	Bend	trans	-66.9	97.7	173.4	52.8	0	0	0	0	111.4
15	S	40.3	Very low	44	Very low	99 Å²	99	115.2 Å²	115.2	69%	0.692	71%	0.705	S	S	*	*	S	Bend	trans	-169.8	131.8	155.2	53.3	0	0	0	0	108.1	P13 C17	P13-S15 PolarHBondContact O-N 2.95Å; P13-S15 VanDerWaalsContact O-N 3.08Å; S15-C17 PolarHBondContact O-N 3.48Å
16	G	45.9	Very low	45.1	Very low	87 Å²	87	114 Å²	114	90%	0.897	70%	0.697	S	S	*	*			trans	-50	87.4	-172	0	0	0	0	0	114.9	N18	G16-N18 PolarHBondContact O-N 3.06Å
17	C	42.2	Very low	46.3	Very low	120 Å²	120	114.4 Å²	114.4	81%	0.811	70%	0.696	S	S	*	*			trans	-86.8	110.7	173.6	-143.9	0	0	0	0	107.3	S15 L19	S15-C17 PolarHBondContact O-N 3.48Å; C17-L19 PolarHBondContact O-N 3.19Å
18	N	52.5	Low	47.1	Very low	124 Å²	124	112 Å²	112	66%	0.663	68%	0.683	S	S	*	*			trans	-50.1	105.3	-178.7	-85	-31.9	0	0	0	110.9	G16 G20 A21 A22	G16-N18 PolarHBondContact O-N 3.06Å; N18-G20 PolarHBondContact O-N 3.26Å; N18-A21 HydrophobicContact CB-CB 3.75Å; N18-A21 WeakPolarHBondContact O-CA 3.36Å; N18-A21 WeakPolarHBondContact O-CB 3.28Å; N18-A21 PolarHBondContact O-N 3.04Å; N18-A22 PolarHBondContact O-N 3.49Å; N18-A22 VanDerWaalsContact O-N 3.11Å
19	L	55.1	Low	48.2	Very low	156 Å²	156	107 Å²	107	82%	0.817	67%	0.673	S	S	*	*	H	α-helix	trans	-50.9	-29.7	169.1	-87.9	147.9	0	0	0	111.8	C17 R23	C17-L19 PolarHBondContact O-N 3.19Å; L19-R23 VanDerWaalsContact O-CB 3.31Å; L19-R23 WeakPolarHBondContact O-CB 3.28Å; L19-R23 PolarHBondContact O-N 2.85Å; L19-R23 VanDerWaalsContact O-N 3.11Å
20	G	55.3	Low	48.9	Very low	46 Å²	46	104.2 Å²	104.2	47%	0.474	66%	0.655	S	S	.	*	H	α-helix	trans	-63.7	-44.5	170.8	0	0	0	0	0	113.6	N18 R23 E24	N18-G20 PolarHBondContact O-N 3.26Å; G20-R23 PolarHBondContact O-N 2.87Å; G20-E24 WeakPolarHBondContact O-CB 3.38Å; G20-E24 WeakPolarHBondContact O-CG 3.35Å; G20-E24 PolarHBondContact O-N 3.46Å
21	A	50.8	Low	49.6	Very low	48 Å²	48	110.5 Å²	110.5	40%	0.397	65%	0.654	S	S	.	*	H	α-helix	trans	-69.6	-36.6	179.2	0	0	0	0	0	112.2	N18 R23 H25	N18-A21 HydrophobicContact CB-CB 3.75Å; N18-A21 WeakPolarHBondContact O-CA 3.36Å; N18-A21 WeakPolarHBondContact O-CB 3.28Å; N18-A21 PolarHBondContact O-N 3.04Å; A21-R23 VanDerWaalsContact C-N 3.32Å; A21-H25 VanDerWaalsContact O-CB 3.23Å; A21-H25 WeakPolarHBondContact O-CB 3.05Å; A21-H25 PolarHBondContact O-N 3.34Å
22	A	55.8	Low	51.1	Low	55 Å²	55	113.9 Å²	113.9	46%	0.455	66%	0.655	S	S	.	*	H	α-helix	trans	-66.2	-35.6	173.2	0	0	0	0	0	112.1	N18 H25 M26	N18-A22 PolarHBondContact O-N 3.49Å; N18-A22 VanDerWaalsContact O-N 3.11Å; A22-H25 PolarHBondContact O-N 3.46Å; A22-M26 PolarHBondContact O-N 3.23Å
23	R	57.5	Low	52.9	Low	170 Å²	170	114.2 Å²	114.2	64%	0.642	65%	0.645	S	S	*	*	H	α-helix	trans	-74	-39.8	177	-153.3	175.4	-171.2	175	1.7	111.8	L19 G20 A21 H25 Q27	L19-R23 VanDerWaalsContact O-CB 3.31Å; L19-R23 WeakPolarHBondContact O-CB 3.28Å; L19-R23 PolarHBondContact O-N 2.85Å; L19-R23 VanDerWaalsContact O-N 3.11Å; G20-R23 PolarHBondContact O-N 2.87Å; A21-R23 VanDerWaalsContact C-N 3.32Å; R23-H25 VanDerWaalsContact C-N 3.32Å; R23-Q27 VanDerWaalsContact O-CB 3.28Å; R23-Q27 WeakPolarHBondContact O-CB 3.44Å; R23-Q27 VanDerWaalsContact O-CG 3.25Å; R23-Q27 WeakPolarHBondContact O-CG 3.41Å; R23-Q27 PolarHBondContact O-N 3.13Å
24	E	57.1	Low	54.9	Low	133 Å²	133	113.8 Å²	113.8	62%	0.621	64%	0.636	S	S	*	*	H	α-helix	trans	-62.8	-38	169.8	-79	178.2	165	0	0	111.6	G20 Q27 A28	G20-E24 WeakPolarHBondContact O-CB 3.38Å; G20-E24 WeakPolarHBondContact O-CG 3.35Å; G20-E24 PolarHBondContact O-N 3.46Å; E24-Q27 PolarHBondContact O-N 3.07Å; E24-A28 WeakPolarHBondContact O-CB 3.43Å; E24-A28 PolarHBondContact O-N 3.05Å
25	H	58.2	Low	56.5	Low	134 Å²	134	112.7 Å²	112.7	62%	0.62	62%	0.624	S	S	*	*	H	α-helix	trans	-69.1	-44.5	176.9	-167.5	55	0	0	0	112.1	A21 A22 R23 Q27 A28 V29	A21-H25 VanDerWaalsContact O-CB 3.23Å; A21-H25 WeakPolarHBondContact O-CB 3.05Å; A21-H25 PolarHBondContact O-N 3.34Å; A22-H25 PolarHBondContact O-N 3.46Å; R23-H25 VanDerWaalsContact C-N 3.32Å; H25-Q27 VanDerWaalsContact C-N 3.34Å; H25-Q27 PolarHBondContact O-N 3.32Å; H25-A28 WeakPolarHBondContact O-CB 3.46Å; H25-A28 PolarHBondContact O-N 3.49Å; H25-V29 WeakPolarHBondContact O-CG2 3.24Å; H25-V29 PolarHBondContact O-N 2.92Å
26	M	56.2	Low	58.5	Low	126 Å²	126	115.1 Å²	115.1	62%	0.621	62%	0.624	S	S	*	*	H	α-helix	trans	-59.5	-44.8	170.3	-89.9	-171	-56.9	0	0	111.8	A22 A28 V29 T30	A22-M26 PolarHBondContact O-N 3.23Å; M26-A28 VanDerWaalsContact C-N 3.29Å; M26-A28 PolarHBondContact O-N 2.9Å; M26-V29 PolarHBondContact O-N 3.15Å; M26-T30 PolarHBondContact O-N 3.27Å; M26-T30 PolarHBondContact O-OG1 3.29Å; M26-T30 VanDerWaalsContact O-OG1 3.06Å
27	Q	56	Low	60.4	Low	118 Å²	118	116.4 Å²	116.4	55%	0.551	62%	0.616	S	S	*	*	H	α-helix	trans	-64.5	-34.8	177.7	-78.3	178.8	-17.1	0	0	111.8	R23 E24 H25 T30 R31	R23-Q27 VanDerWaalsContact O-CB 3.28Å; R23-Q27 WeakPolarHBondContact O-CB 3.44Å; R23-Q27 VanDerWaalsContact O-CG 3.25Å; R23-Q27 WeakPolarHBondContact O-CG 3.41Å; R23-Q27 PolarHBondContact O-N 3.13Å; E24-Q27 PolarHBondContact O-N 3.07Å; H25-Q27 VanDerWaalsContact C-N 3.34Å; H25-Q27 PolarHBondContact O-N 3.32Å; Q27-T30 WeakPolarHBondContact CA-OG1 2.97Å; Q27-T30 PolarHBondContact O-N 3Å; Q27-T30 PolarHBondContact O-OG1 3.34Å; Q27-R31 VanDerWaalsContact O-CA 3.28Å; Q27-R31 WeakPolarHBondContact O-CA 3.36Å; Q27-R31 WeakPolarHBondContact O-CB 3.47Å; Q27-R31 PolarHBondContact O-N 3.03Å
28	A	53.3	Low	62.5	Low	58 Å²	58	117.1 Å²	117.1	48%	0.479	60%	0.602	S	S	.	*	H	α-helix	trans	-66.9	-39.7	174.8	0	0	0	0	0	111.8	E24 H25 M26 R31	E24-A28 WeakPolarHBondContact O-CB 3.43Å; E24-A28 PolarHBondContact O-N 3.05Å; H25-A28 WeakPolarHBondContact O-CB 3.46Å; H25-A28 PolarHBondContact O-N 3.49Å; M26-A28 VanDerWaalsContact C-N 3.29Å; M26-A28 PolarHBondContact O-N 2.9Å; A28-R31 PolarHBondContact O-N 2.87Å
29	V	55.4	Low	64.3	Low	90 Å²	90	114.7 Å²	114.7	55%	0.545	59%	0.592	S	S	.	*	H	α-helix	trans	-65.9	-38.8	175	173.8	0	0	0	0	111.4	H25 M26 Y33	H25-V29 WeakPolarHBondContact O-CG2 3.24Å; H25-V29 PolarHBondContact O-N 2.92Å; M26-V29 PolarHBondContact O-N 3.15Å; V29-Y33 WeakPolarHBondContact O-CD2 3.39Å
30	T	52.8	Low	66	Low	70 Å²	70	111.1 Å²	111.1	43%	0.429	58%	0.576	S	S	.	*	H	α-helix	trans	-87.6	-8.5	178.1	54.8	0	0	0	0	114.4	M26 Q27 N32 Y33 T35	M26-T30 PolarHBondContact O-N 3.27Å; M26-T30 PolarHBondContact O-OG1 3.29Å; M26-T30 VanDerWaalsContact O-OG1 3.06Å; Q27-T30 WeakPolarHBondContact CA-OG1 2.97Å; Q27-T30 PolarHBondContact O-N 3Å; Q27-T30 PolarHBondContact O-OG1 3.34Å; T30-N32 PolarHBondContact O-N 3.47Å; T30-Y33 PolarHBondContact O-N 3.23Å; T30-T35 HydrophobicContact CG2-CG2 4.41Å
31	R	49.1	Very low	67.7	Low	210 Å²	210	110.1 Å²	110.1	79%	0.792	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.3	-29.7	-165.7	-157.2	170.5	175.1	173.6	-2.7	113.7	Q27 A28	Q27-R31 VanDerWaalsContact O-CA 3.28Å; Q27-R31 WeakPolarHBondContact O-CA 3.36Å; Q27-R31 WeakPolarHBondContact O-CB 3.47Å; Q27-R31 PolarHBondContact O-N 3.03Å; A28-R31 PolarHBondContact O-N 2.87Å
32	N	64.6	Low	69.6	Low	145 Å²	145	116.3 Å²	116.3	78%	0.775	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.2	3.6	-172.1	-59.8	-20.7	0	0	0	113	T30	T30-N32 PolarHBondContact O-N 3.47Å
33	Y	73.4	Confident	71.2	Confident	178 Å²	178	115.8 Å²	115.8	70%	0.698	56%	0.563	S	S	*	*	S	Bend	trans	-109.4	137.4	179.4	-68.5	-79.9	0	0	0	111.1	V29 T30 T35	V29-Y33 WeakPolarHBondContact O-CD2 3.39Å; T30-Y33 PolarHBondContact O-N 3.23Å; Y33-T35 PolarHBondContact O-N 2.78Å; Y33-T35 VanDerWaalsContact O-N 3.1Å
34	I	76.1	Confident	72.8	Confident	100 Å²	100	108.3 Å²	108.3	51%	0.513	54%	0.536	S	S	.	.			trans	-76.8	99.3	172.4	-56.8	173.5	0	0	0	107.8	H36 D111	I34-H36 HydrophobicContact CG2-CB 4.44Å; I34-D111 HydrophobicContact CD1-CB 3.97Å
35	T	79.8	Confident	74.3	Confident	100 Å²	100	105.4 Å²	105.4	61%	0.613	53%	0.529	S	S	*	.			trans	-92.1	0.1	177.9	60.9	0	0	0	0	113	T30 Y33	T30-T35 HydrophobicContact CG2-CG2 4.41Å; Y33-T35 PolarHBondContact O-N 2.78Å; Y33-T35 VanDerWaalsContact O-N 3.1Å
36	H	80.8	Confident	75.7	Confident	150 Å²	150	101.2 Å²	101.2	69%	0.694	52%	0.515	S	S	*	.	S	Bend	trans	-75	136.3	178.4	-65.1	-58.4	0	0	0	110.6	I34 R38	I34-H36 HydrophobicContact CG2-CB 4.44Å; H36-R38 PolarHBondContact O-N 2.68Å
37	P	85.8	Confident	77.3	Confident	113 Å²	113	97.5 Å²	97.5	73%	0.734	50%	0.5	S	S	*	.	P	Polyproline II helix	trans	-65.3	137.8	177.1	28.2	-33.7	0	0	0	109.8
38	R	88.2	Confident	78.7	Confident	135 Å²	135	96.9 Å²	96.9	51%	0.509	50%	0.5	S	S	.	.	P	Polyproline II helix	trans	-69	140.9	176.9	-67.2	174.7	178.3	176.6	-1.1	110.3	H36 E107 F108	H36-R38 PolarHBondContact O-N 2.68Å; R38-E107 HydrophobicContact CB-CG 3.82Å; R38-E107 WeakPolarHBondContact CD-OE1 3.5Å; R38-E107 IonicContact NE-OE1 2.73Å; R38-E107 IonicContact NH1-OE1 3.73Å; R38-E107 PolarHBondContact NH1-OE1 3.36Å; R38-F108 WeakPolarHBondContact CB-O 3.32Å
39	V	88.6	Confident	80.2	Confident	74 Å²	74	96.7 Å²	96.7	45%	0.448	50%	0.504	S	S	.	.	P	Polyproline II helix	trans	-96.2	124.4	-177.9	-173.6	0	0	0	0	109	Y41 F108	V39-Y41 HydrophobicContact CB-CE2 3.83Å; V39-Y41 HydrophobicContact CG1-CD1 4.43Å; V39-Y41 HydrophobicContact CG1-CD2 4.22Å; V39-Y41 HydrophobicContact CG1-CE1 3.83Å; V39-Y41 HydrophobicContact CG1-CE2 3.61Å; V39-F108 PolarHBondContact O-N 3.4Å
40	T	91	Very high	81.7	Confident	80 Å²	80	93.4 Å²	93.4	49%	0.491	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	128.2	174.6	-43.9	0	0	0	0	110.4	T105 C106	T40-T105 HydrophobicContact CG2-CG2 4.11Å; T40-C106 CarbonylContact C-O 3.56Å; T40-C106 WeakPolarHBondContact CA-O 3.47Å
41	Y	91.1	Very high	83.5	Confident	25 Å²	25	90.8 Å²	90.8	10%	0.098	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	147.5	176.4	-55	-92.2	0	0	0	110.8	V39 V57 K58 T105 C106 F108	V39-Y41 HydrophobicContact CB-CE2 3.83Å; V39-Y41 HydrophobicContact CG1-CD1 4.43Å; V39-Y41 HydrophobicContact CG1-CD2 4.22Å; V39-Y41 HydrophobicContact CG1-CE1 3.83Å; V39-Y41 HydrophobicContact CG1-CE2 3.61Å; Y41-V57 HydrophobicContact CD2-CG1 4.49Å; Y41-V57 HydrophobicContact CE1-CG1 4.48Å; Y41-V57 HydrophobicContact CE2-CG1 3.89Å; Y41-K58 PolarHBondContact OH-N 2.72Å; Y41-K58 VanDerWaalsContact OH-N 3.1Å; Y41-T105 WeakPolarHBondContact O-CA 3.4Å; Y41-C106 PolarHBondContact N-O 3.21Å; Y41-C106 PolarHBondContact O-N 3.45Å; Y41-C106 PolarHBondContact O-SG 3.08Å; Y41-F108 AromaticContact CD2-CD2 3.44Å; Y41-F108 HydrophobicContact CD2-CD2 3.44Å; Y41-F108 VanDerWaalsContact CD2-CD2 3.44Å; Y41-F108 AromaticContact CD2-CE2 3.61Å; Y41-F108 HydrophobicContact CD2-CE2 3.61Å; Y41-F108 AromaticContact CE2-CD2 3.54Å; Y41-F108 HydrophobicContact CE2-CD2 3.54Å; Y41-F108 AromaticContact CE2-CE2 3.93Å; Y41-F108 HydrophobicContact CE2-CE2 3.93Å; Y41-F108 HydrophobicContact CE2-CG 4.2Å
42	R	90.9	Very high	85.5	Confident	179 Å²	179	80.8 Å²	80.8	68%	0.675	43%	0.43	S	S	*	.			trans	-118.6	22.6	172.4	-73	-176.3	174.7	172.6	-0.6	111.7	V44 T105	R42-V44 PolarHBondContact O-N 2.95Å; R42-T105 HydrophobicContact CG-CG2 3.5Å; R42-T105 VanDerWaalsContact CG-CG2 3.5Å
43	T	89.4	Confident	86.8	Confident	44 Å²	44	75.2 Å²	75.2	27%	0.27	40%	0.401	S	S	.	.			trans	-103.2	50.3	-169.8	46	0	0	0	0	111	C45 D55	T43-C45 PolarHBondContact O-N 2.7Å; T43-D55 WeakPolarHBondContact CB-O 3.28Å; T43-D55 PolarHBondContact O-N 3.13Å; T43-D55 PolarHBondContact OG1-O 2.8Å
44	V	90.6	Very high	87.7	Confident	12 Å²	12	66.8 Å²	66.8	7%	0.073	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	120.3	171.3	-179.8	0	0	0	0	108.4	R42 V47 V52 L54 A101	R42-V44 PolarHBondContact O-N 2.95Å; V44-V47 HydrophobicContact CG1-CG2 4.23Å; V44-V52 HydrophobicContact CG1-CG1 3.78Å; V44-V52 HydrophobicContact CG2-CG1 4.45Å; V44-L54 HydrophobicContact CB-CD2 4.21Å; V44-L54 HydrophobicContact CG2-CD2 3.6Å; V44-A101 HydrophobicContact CG1-CB 4.38Å
45	C	89.6	Confident	88.4	Confident	72 Å²	72	63.8 Å²	63.8	49%	0.486	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	-51.4	-179.8	-90.1	0	0	0	0	112.3	T43 V53 D55	T43-C45 PolarHBondContact O-N 2.7Å; C45-V53 PolarHBondContact N-O 3.14Å; C45-D55 WeakPolarHBondContact SG-CB 3.31Å
46	S	88.1	Confident	88.9	Confident	46 Å²	46	67.7 Å²	67.7	32%	0.322	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	156	-175.6	58.8	0	0	0	0	111.5	V53	S46-V53 PolarHBondContact O-N 3.14Å
47	V	88.9	Confident	89.4	Confident	49 Å²	49	60.7 Å²	60.7	30%	0.297	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	116.8	177.9	-179.3	0	0	0	0	107.5	V44 L51 V52 T96 I99	V44-V47 HydrophobicContact CG1-CG2 4.23Å; V47-L51 WeakPolarHBondContact CA-O 3.22Å; V47-V52 HydrophobicContact CG1-CG2 4.43Å; V47-V52 HydrophobicContact CG2-CG2 4.36Å; V47-T96 VanDerWaalsContact CG1-CB 3.49Å; V47-T96 HydrophobicContact CG1-CG2 3.87Å; V47-I99 HydrophobicContact CG2-CB 4.41Å; V47-I99 HydrophobicContact CG2-CG2 3.86Å
48	N	85.5	Confident	89.5	Confident	104 Å²	104	62.9 Å²	62.9	56%	0.556	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.5	108.6	-176.3	-70	-8.8	0	0	0	109.1	L51	N48-L51 PolarHBondContact N-O 3.43Å; N48-L51 WeakPolarHBondContact O-CB 3.26Å; N48-L51 PolarHBondContact O-N 2.81Å
49	G	85.2	Confident	89.5	Confident	54 Å²	54	65.8 Å²	65.8	56%	0.557	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.6	-124.4	-177.6	0	0	0	0	0	111.1	L51 T96	G49-L51 VanDerWaalsContact C-N 3.29Å; G49-L51 PolarHBondContact O-N 3.42Å; G49-T96 WeakPolarHBondContact O-CB 3.32Å; G49-T96 WeakPolarHBondContact O-CG2 3.4Å; G49-T96 PolarHBondContact O-OG1 3.46Å
50	P	86.6	Confident	89.5	Confident	21 Å²	21	63.1 Å²	63.1	14%	0.136	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-2.3	177.5	31.5	-33.4	0	0	0	115.2	V92 I263 A307	P50-V92 PolarHBondContact O-N 2.99Å; P50-I263 HydrophobicContact CB-CD1 3.73Å; P50-A307 HydrophobicContact CG-CB 3.7Å
51	L	89.9	Confident	89.5	Confident	15 Å²	15	64 Å²	64	8%	0.079	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	140.9	-170.9	-54	175.8	0	0	0	112	V47 N48 G49 L81 I89 Q91 R308	V47-L51 WeakPolarHBondContact CA-O 3.22Å; N48-L51 PolarHBondContact N-O 3.43Å; N48-L51 WeakPolarHBondContact O-CB 3.26Å; N48-L51 PolarHBondContact O-N 2.81Å; G49-L51 VanDerWaalsContact C-N 3.29Å; G49-L51 PolarHBondContact O-N 3.42Å; L51-L81 HydrophobicContact CD2-CD1 3.83Å; L51-I89 HydrophobicContact CB-CG2 4.35Å; L51-I89 HydrophobicContact CD1-CG2 4.4Å; L51-I89 HydrophobicContact CD2-CG2 4.38Å; L51-Q91 HydrophobicContact CD2-CB 4.04Å; L51-Q91 HydrophobicContact CD2-CG 4.37Å; L51-R308 HydrophobicContact CD1-CG 3.92Å
52	V	91.9	Very high	89.5	Confident	0 Å²	0	71 Å²	71	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	124.4	173	-179.8	0	0	0	0	108.5	V44 V47 L54 F68 V90 V92 T96 I99	V44-V52 HydrophobicContact CG1-CG1 3.78Å; V44-V52 HydrophobicContact CG2-CG1 4.45Å; V47-V52 HydrophobicContact CG1-CG2 4.43Å; V47-V52 HydrophobicContact CG2-CG2 4.36Å; V52-L54 HydrophobicContact CG1-CD2 4.24Å; V52-F68 HydrophobicContact CB-CE1 4.4Å; V52-F68 HydrophobicContact CB-CZ 4.35Å; V52-F68 HydrophobicContact CG1-CE1 4.02Å; V52-F68 HydrophobicContact CG1-CZ 4.41Å; V52-V90 PolarHBondContact N-O 3.26Å; V52-V90 PolarHBondContact O-N 2.94Å; V52-V92 HydrophobicContact CB-CG2 4.38Å; V52-V92 HydrophobicContact CG2-CG2 3.56Å; V52-T96 HydrophobicContact CG2-CG2 3.93Å; V52-I99 HydrophobicContact CG2-CD1 3.85Å
53	V	92.2	Very high	89.5	Confident	29 Å²	29	63.1 Å²	63.1	18%	0.176	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	121.3	178.7	-174.8	0	0	0	0	109.1	C45 S46	C45-V53 PolarHBondContact N-O 3.14Å; S46-V53 PolarHBondContact O-N 3.14Å
54	L	92.4	Very high	89.7	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	141.9	176.5	-60.3	173.8	0	0	0	109.7	V44 V52 V57 K87 A88 V90 C106 F108	V44-L54 HydrophobicContact CB-CD2 4.21Å; V44-L54 HydrophobicContact CG2-CD2 3.6Å; V52-L54 HydrophobicContact CG1-CD2 4.24Å; L54-V57 HydrophobicContact CB-CG2 3.71Å; L54-K87 VanDerWaalsContact O-CA 3.3Å; L54-K87 WeakPolarHBondContact O-CA 3.33Å; L54-A88 PolarHBondContact N-O 3.32Å; L54-A88 PolarHBondContact O-N 2.64Å; L54-V90 HydrophobicContact CD1-CG2 3.7Å; L54-V90 HydrophobicContact CG-CG2 4.37Å; L54-C106 HydrophobicContact CD1-CB 4.28Å; L54-C106 VanDerWaalsContact CD2-SG 3.53Å; L54-F108 HydrophobicContact CD1-CE2 3.65Å; L54-F108 HydrophobicContact CD1-CZ 3.49Å; L54-F108 VanDerWaalsContact CD1-CZ 3.49Å
55	D	90.9	Very high	89.8	Confident	38 Å²	38	61.4 Å²	61.4	20%	0.203	31%	0.312	C	S	.	.			trans	-119.7	161.1	174.1	-170.9	24	0	0	0	111	T43 C45 V57 T86	T43-D55 WeakPolarHBondContact CB-O 3.28Å; T43-D55 PolarHBondContact O-N 3.13Å; T43-D55 PolarHBondContact OG1-O 2.8Å; C45-D55 WeakPolarHBondContact SG-CB 3.31Å; D55-V57 PolarHBondContact O-N 2.74Å; D55-T86 CarbonylContact C-O 3.55Å; D55-T86 PolarHBondContact OD1-OG1 3.28Å
56	R	90.1	Very high	89.9	Confident	181 Å²	181	58 Å²	58	68%	0.683	29%	0.289	S	S	*	.	S	Bend	trans	58	29.4	-178.1	-52.5	-179.3	-176.7	175.7	-0.9	114.1	T86	R56-T86 PolarHBondContact N-O 3.08Å
57	V	90.5	Very high	90.2	Very high	4 Å²	4	58.6 Å²	58.6	2%	0.024	29%	0.287	C	S	.	.			trans	-78.5	133.9	172.7	-171.4	0	0	0	0	108.6	Y41 L54 D55 A60 T86 A88 F108	Y41-V57 HydrophobicContact CD2-CG1 4.49Å; Y41-V57 HydrophobicContact CE1-CG1 4.48Å; Y41-V57 HydrophobicContact CE2-CG1 3.89Å; L54-V57 HydrophobicContact CB-CG2 3.71Å; D55-V57 PolarHBondContact O-N 2.74Å; V57-A60 HydrophobicContact CB-CB 4.49Å; V57-A60 HydrophobicContact CG1-CB 3.81Å; V57-T86 PolarHBondContact N-O 2.85Å; V57-A88 HydrophobicContact CG2-CB 4.27Å; V57-F108 HydrophobicContact CB-CZ 4.45Å; V57-F108 HydrophobicContact CG1-CD1 4.42Å; V57-F108 HydrophobicContact CG1-CD2 4.45Å; V57-F108 HydrophobicContact CG1-CE1 3.92Å; V57-F108 HydrophobicContact CG1-CE2 3.93Å; V57-F108 HydrophobicContact CG1-CZ 3.63Å; V57-F108 HydrophobicContact CG2-CE2 4.2Å; V57-F108 HydrophobicContact CG2-CZ 3.98Å
58	K	88.7	Confident	90.3	Very high	158 Å²	158	56.2 Å²	56.2	69%	0.687	27%	0.272	S	S	*	.	S	Bend	trans	-93.1	121.5	178	-63.7	-178	179.5	179.3	0	109.4	Y41 A60	Y41-K58 PolarHBondContact OH-N 2.72Å; Y41-K58 VanDerWaalsContact OH-N 3.1Å; K58-A60 VanDerWaalsContact C-N 3.33Å; K58-A60 PolarHBondContact O-N 2.66Å
59	F	87.4	Confident	90.7	Very high	197 Å²	197	53.2 Å²	53.2	86%	0.864	26%	0.258	S	S	*	.	S	Bend	trans	50.7	45.8	172.4	-53.8	-72.7	0	0	0	114.2	Q61	F59-Q61 PolarHBondContact O-N 3.47Å
60	A	88.4	Confident	91	Very high	17 Å²	17	50.9 Å²	50.9	14%	0.14	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-59.4	138.1	173.1	0	0	0	0	0	110.4	V57 K58 V83 A88 F108	V57-A60 HydrophobicContact CB-CB 4.49Å; V57-A60 HydrophobicContact CG1-CB 3.81Å; K58-A60 VanDerWaalsContact C-N 3.33Å; K58-A60 PolarHBondContact O-N 2.66Å; A60-V83 HydrophobicContact CB-CG1 3.94Å; A60-V83 HydrophobicContact CB-CG2 3.75Å; A60-A88 HydrophobicContact CB-CB 4.05Å; A60-F108 HydrophobicContact CB-CE1 4.22Å
61	Q	90.6	Very high	91.2	Very high	100 Å²	100	53.1 Å²	53.1	47%	0.467	25%	0.247	S	C	.	.	P	Polyproline II helix	trans	-97.2	153	176.9	-62	-176	1.5	0	0	111	F59 E64 V80	F59-Q61 PolarHBondContact O-N 3.47Å; Q61-E64 HydrophobicContact CB-CB 4.1Å; Q61-E64 HydrophobicContact CB-CG 4.49Å; Q61-E64 PolarHBondContact N-OE2 2.9Å; Q61-E64 WeakPolarHBondContact O-CB 3.28Å; Q61-V80 WeakPolarHBondContact O-CB 3.49Å; Q61-V80 WeakPolarHBondContact O-CG1 3.31Å
62	Y	91.9	Very high	91.1	Very high	172 Å²	172	57.7 Å²	57.7	68%	0.675	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	140.8	172.9	178.6	-98.9	0	0	0	110.2	E64 L81	Y62-E64 PolarHBondContact O-N 3.31Å; Y62-E64 VanDerWaalsContact O-N 3.15Å; Y62-L81 WeakPolarHBondContact CD2-O 3.34Å; Y62-L81 WeakPolarHBondContact CE2-O 3.36Å
63	A	90.6	Very high	91	Very high	13 Å²	13	60.1 Å²	60.1	11%	0.107	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.2	13.5	-178.6	0	0	0	0	0	115.6	Q79 V80 I112	A63-Q79 PolarHBondContact O-NE2 3.42Å; A63-V80 VanDerWaalsContact CA-O 3.28Å; A63-V80 WeakPolarHBondContact CA-O 3.4Å; A63-V80 PolarHBondContact N-O 2.82Å; A63-I112 HydrophobicContact CB-CG2 4.48Å
64	E	92.8	Very high	90.9	Very high	8 Å²	8	61.6 Å²	61.6	4%	0.037	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	145	177.4	-166.2	-174.2	162.1	0	0	111.6	Q61 Y62 Q79 V80 F108 G110 D111	Q61-E64 HydrophobicContact CB-CB 4.1Å; Q61-E64 HydrophobicContact CB-CG 4.49Å; Q61-E64 PolarHBondContact N-OE2 2.9Å; Q61-E64 WeakPolarHBondContact O-CB 3.28Å; Y62-E64 PolarHBondContact O-N 3.31Å; Y62-E64 VanDerWaalsContact O-N 3.15Å; E64-Q79 WeakPolarHBondContact O-CA 3.47Å; E64-V80 HydrophobicContact CB-CB 4.33Å; E64-V80 HydrophobicContact CB-CG2 3.91Å; E64-V80 WeakPolarHBondContact O-CG2 3.24Å; E64-V80 PolarHBondContact O-N 3.11Å; E64-F108 WeakPolarHBondContact OE1-CB 3.28Å; E64-G110 WeakPolarHBondContact OE1-CA 3.23Å; E64-G110 PolarHBondContact OE1-N 3.28Å; E64-D111 WeakPolarHBondContact CA-O 3.42Å; E64-D111 WeakPolarHBondContact CG-O 3.44Å
65	I	92.8	Very high	90.8	Very high	12 Å²	12	68.8 Å²	68.8	6%	0.062	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	136.2	174.9	-70.2	-60.2	0	0	0	111.8	G78 Q79 F93 T109 D111 L113	I65-G78 WeakPolarHBondContact CA-O 3.49Å; I65-G78 WeakPolarHBondContact CD1-O 3.29Å; I65-Q79 HydrophobicContact CD1-CB 4.21Å; I65-Q79 HydrophobicContact CD1-CG 4.49Å; I65-F93 HydrophobicContact CD1-CE2 4.15Å; I65-F93 HydrophobicContact CD1-CZ 4.15Å; I65-T109 HydrophobicContact CB-CG2 4.42Å; I65-T109 HydrophobicContact CG2-CG2 4.04Å; I65-T109 WeakPolarHBondContact O-CB 3.45Å; I65-T109 WeakPolarHBondContact O-CG2 3.48Å; I65-T109 PolarHBondContact O-N 2.64Å; I65-T109 PolarHBondContact O-OG1 3.28Å; I65-D111 PolarHBondContact N-O 3.34Å; I65-L113 HydrophobicContact CD1-CB 3.78Å; I65-L113 HydrophobicContact CD1-CD1 4.01Å; I65-L113 HydrophobicContact CD1-CD2 4.19Å; I65-L113 HydrophobicContact CD1-CG 4.19Å; I65-L113 HydrophobicContact CG1-CB 3.69Å; I65-L113 HydrophobicContact CG1-CD1 3.96Å; I65-L113 HydrophobicContact CG1-CG 4.33Å
66	V	92.8	Very high	90.8	Very high	0 Å²	0	68.8 Å²	68.8	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	132.4	177.9	-175.1	0	0	0	0	109.3	F68 S77 G78 V80 V90 C106 E107 F108	V66-F68 HydrophobicContact CB-CE2 4.13Å; V66-F68 HydrophobicContact CG1-CD2 4.36Å; V66-F68 HydrophobicContact CG1-CE1 4.48Å; V66-F68 HydrophobicContact CG1-CE2 3.89Å; V66-F68 HydrophobicContact CG1-CZ 3.96Å; V66-S77 CarbonylContact O-C 3.39Å; V66-S77 WeakPolarHBondContact O-CA 3.44Å; V66-G78 PolarHBondContact N-O 3.06Å; V66-G78 PolarHBondContact O-N 2.96Å; V66-V80 HydrophobicContact CG2-CG2 3.76Å; V66-V90 HydrophobicContact CB-CG1 4.07Å; V66-V90 HydrophobicContact CG2-CG1 4.07Å; V66-V90 HydrophobicContact CG2-CG2 4.23Å; V66-C106 HydrophobicContact CG1-CB 3.85Å; V66-E107 WeakPolarHBondContact CA-O 3.39Å; V66-F108 HydrophobicContact CG1-CD2 4.35Å; V66-F108 HydrophobicContact CG1-CE2 4.29Å; V66-F108 HydrophobicContact CG2-CD1 3.72Å; V66-F108 HydrophobicContact CG2-CD2 4.47Å; V66-F108 HydrophobicContact CG2-CE1 3.61Å; V66-F108 HydrophobicContact CG2-CE2 4.4Å; V66-F108 HydrophobicContact CG2-CG 4.17Å; V66-F108 HydrophobicContact CG2-CZ 3.99Å
67	H	93.4	Very high	90.8	Very high	58 Å²	58	61.5 Å²	61.5	27%	0.269	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	121.4	171.7	-63.2	-57.3	0	0	0	110.1	C106 E107 T109	H67-C106 CarbonylContact O-C 3.59Å; H67-C106 WeakPolarHBondContact O-CA 3.38Å; H67-E107 PolarHBondContact N-O 2.73Å; H67-E107 PolarHBondContact O-N 3.02Å; H67-T109 VanDerWaalsContact CD2-CG2 3.4Å; H67-T109 WeakPolarHBondContact CD2-CG2 3.48Å; H67-T109 WeakPolarHBondContact NE2-CG2 3.3Å
68	F	92.2	Very high	90.8	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	132.9	173.4	-66	-88.6	0	0	0	109.4	V52 V66 Q75 R76 V90 V92 T104 T105 C106	V52-F68 HydrophobicContact CB-CE1 4.4Å; V52-F68 HydrophobicContact CB-CZ 4.35Å; V52-F68 HydrophobicContact CG1-CE1 4.02Å; V52-F68 HydrophobicContact CG1-CZ 4.41Å; V66-F68 HydrophobicContact CB-CE2 4.13Å; V66-F68 HydrophobicContact CG1-CD2 4.36Å; V66-F68 HydrophobicContact CG1-CE1 4.48Å; V66-F68 HydrophobicContact CG1-CE2 3.89Å; V66-F68 HydrophobicContact CG1-CZ 3.96Å; F68-Q75 CarbonylContact O-C 3.57Å; F68-Q75 VanDerWaalsContact O-CA 3.26Å; F68-Q75 WeakPolarHBondContact O-CA 3.33Å; F68-R76 HydrophobicContact CB-CB 4.23Å; F68-R76 PolarHBondContact N-O 3.04Å; F68-R76 PolarHBondContact O-N 3Å; F68-V90 HydrophobicContact CE2-CB 4.45Å; F68-V90 HydrophobicContact CE2-CG1 3.66Å; F68-V90 HydrophobicContact CZ-CB 3.96Å; F68-V90 HydrophobicContact CZ-CG1 3.65Å; F68-V92 HydrophobicContact CD2-CG2 4.06Å; F68-V92 HydrophobicContact CE2-CG2 3.73Å; F68-V92 HydrophobicContact CZ-CG2 4.07Å; F68-T104 HydrophobicContact CD1-CG2 4.21Å; F68-T105 WeakPolarHBondContact CA-O 3.45Å; F68-C106 HydrophobicContact CD1-CB 3.85Å; F68-C106 HydrophobicContact CE1-CB 3.78Å
69	T	93.7	Very high	91	Very high	41 Å²	41	55.2 Å²	55.2	25%	0.252	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	114.1	165.5	-54	0	0	0	0	107.8	T104 T105	T69-T104 WeakPolarHBondContact O-CG2 3.25Å; T69-T105 WeakPolarHBondContact CB-OG1 3.27Å; T69-T105 PolarHBondContact N-O 3.12Å; T69-T105 PolarHBondContact O-N 3.32Å; T69-T105 VanDerWaalsContact O-N 3.1Å; T69-T105 PolarHBondContact O-OG1 2.92Å
70	L	92	Very high	91.2	Very high	5 Å²	5	45.9 Å²	45.9	3%	0.026	25%	0.245	C	C	.	.			trans	-73.5	166	179	-86.7	75.8	0	0	0	111	D72 G73 T74 R76 I99	L70-D72 WeakPolarHBondContact CB-OD1 3.48Å; L70-D72 PolarHBondContact O-N 2.94Å; L70-G73 PolarHBondContact O-N 3.42Å; L70-T74 WeakPolarHBondContact CB-OG1 3.39Å; L70-T74 PolarHBondContact N-O 3.01Å; L70-R76 HydrophobicContact CD1-CB 4.41Å; L70-R76 HydrophobicContact CD1-CG 3.98Å; L70-I99 HydrophobicContact CD1-CG1 4.23Å; L70-I99 HydrophobicContact CD2-CG1 4.37Å; L70-I99 HydrophobicContact CG-CG1 4.26Å
71	P	89.3	Confident	91.3	Very high	68 Å²	68	46.2 Å²	46.2	44%	0.442	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-22.5	179.4	-20.8	34	0	0	0	114	G73 D100 K103	P71-G73 VanDerWaalsContact C-N 3.25Å; P71-D100 HydrophobicContact CG-CB 3.87Å; P71-K103 HydrophobicContact CB-CB 3.99Å; P71-K103 HydrophobicContact CB-CD 4.21Å; P71-K103 HydrophobicContact CG-CB 3.63Å; P71-K103 HydrophobicContact CG-CD 4.45Å
72	D	89.5	Confident	91.3	Very high	111 Å²	111	45.8 Å²	45.8	59%	0.594	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-4.2	174.8	61.8	1.6	0	0	0	113	L70 T74	L70-D72 WeakPolarHBondContact CB-OD1 3.48Å; L70-D72 PolarHBondContact O-N 2.94Å; D72-T74 VanDerWaalsContact C-N 3.33Å; D72-T74 VanDerWaalsContact CG-OG1 3.3Å; D72-T74 WeakPolarHBondContact OD1-CB 3.41Å; D72-T74 WeakPolarHBondContact OD1-CG2 3.46Å; D72-T74 PolarHBondContact OD1-N 3.17Å; D72-T74 PolarHBondContact OD1-OG1 2.89Å; D72-T74 WeakPolarHBondContact OD2-CG2 3.35Å; D72-T74 PolarHBondContact OD2-OG1 3.41Å
73	G	87.8	Confident	91.3	Very high	51 Å²	51	40.1 Å²	40.1	53%	0.526	23%	0.226	S	C	.	.	S	Bend	trans	85.3	-1	-175.9	0	0	0	0	0	114.2	L70 P71	L70-G73 PolarHBondContact O-N 3.42Å; P71-G73 VanDerWaalsContact C-N 3.25Å
74	T	90.8	Very high	91.3	Very high	60 Å²	60	42.4 Å²	42.4	37%	0.368	24%	0.244	S	C	.	.			trans	-68.9	137.6	175.6	62.7	0	0	0	0	110.5	L70 D72	L70-T74 WeakPolarHBondContact CB-OG1 3.39Å; L70-T74 PolarHBondContact N-O 3.01Å; D72-T74 VanDerWaalsContact C-N 3.33Å; D72-T74 VanDerWaalsContact CG-OG1 3.3Å; D72-T74 WeakPolarHBondContact OD1-CB 3.41Å; D72-T74 WeakPolarHBondContact OD1-CG2 3.46Å; D72-T74 PolarHBondContact OD1-N 3.17Å; D72-T74 PolarHBondContact OD1-OG1 2.89Å; D72-T74 WeakPolarHBondContact OD2-CG2 3.35Å; D72-T74 PolarHBondContact OD2-OG1 3.41Å
75	Q	90.8	Very high	91.2	Very high	150 Å²	150	45.5 Å²	45.5	70%	0.701	28%	0.278	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.7	135.1	177.5	-68	-173.7	-11.1	0	0	110.3	F68	F68-Q75 CarbonylContact O-C 3.57Å; F68-Q75 VanDerWaalsContact O-CA 3.26Å; F68-Q75 WeakPolarHBondContact O-CA 3.33Å
76	R	90.4	Very high	91.2	Very high	39 Å²	39	48.8 Å²	48.8	15%	0.147	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	155.1	174.5	-67.4	-171.9	-175.2	164.7	11.1	109.9	F68 L70 V92 E94 G95 S97	F68-R76 HydrophobicContact CB-CB 4.23Å; F68-R76 PolarHBondContact N-O 3.04Å; F68-R76 PolarHBondContact O-N 3Å; L70-R76 HydrophobicContact CD1-CB 4.41Å; L70-R76 HydrophobicContact CD1-CG 3.98Å; R76-V92 HydrophobicContact CB-CG1 3.92Å; R76-E94 WeakPolarHBondContact CA-OE2 3.39Å; R76-E94 VanDerWaalsContact CB-OE2 3.3Å; R76-E94 WeakPolarHBondContact CB-OE2 3.27Å; R76-E94 HydrophobicContact CG-CB 4.03Å; R76-E94 HydrophobicContact CG-CG 4.47Å; R76-G95 PolarHBondContact NH1-O 3.44Å; R76-S97 VanDerWaalsContact CZ-O 3.23Å; R76-S97 PolarHBondContact NH1-O 2.95Å; R76-S97 PolarHBondContact NH2-O 3.41Å
77	S	90.9	Very high	91.1	Very high	27 Å²	27	54.2 Å²	54.2	19%	0.189	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	151	177.4	-55.8	0	0	0	0	110	V66 F93 E94	V66-S77 CarbonylContact O-C 3.39Å; V66-S77 WeakPolarHBondContact O-CA 3.44Å; S77-F93 PolarHBondContact O-N 3Å; S77-E94 PolarHBondContact N-OE1 2.94Å; S77-E94 PolarHBondContact N-OE2 3.34Å
78	G	90.3	Very high	91.1	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	168.1	175.1	0	0	0	0	0	112.1	I65 V66 Q91	I65-G78 WeakPolarHBondContact CA-O 3.49Å; I65-G78 WeakPolarHBondContact CD1-O 3.29Å; V66-G78 PolarHBondContact N-O 3.06Å; V66-G78 PolarHBondContact O-N 2.96Å; G78-Q91 CarbonylContact C-O 3.52Å; G78-Q91 WeakPolarHBondContact CA-O 3.43Å
79	Q	92.1	Very high	91.1	Very high	31 Å²	31	53.7 Å²	53.7	15%	0.145	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	135.6	-179.4	-173.7	173.5	37	0	0	110.3	A63 E64 I65 L81 V90 Q91 F93	A63-Q79 PolarHBondContact O-NE2 3.42Å; E64-Q79 WeakPolarHBondContact O-CA 3.47Å; I65-Q79 HydrophobicContact CD1-CB 4.21Å; I65-Q79 HydrophobicContact CD1-CG 4.49Å; Q79-L81 PolarHBondContact O-N 3.04Å; Q79-V90 WeakPolarHBondContact O-CA 3.15Å; Q79-V90 WeakPolarHBondContact O-CG1 3.47Å; Q79-Q91 PolarHBondContact N-O 2.75Å; Q79-Q91 PolarHBondContact O-N 3.48Å; Q79-F93 HydrophobicContact CB-CE1 4.02Å; Q79-F93 HydrophobicContact CB-CZ 3.9Å
80	V	93.2	Very high	91	Very high	1 Å²	1	51.8 Å²	51.8	1%	0.006	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	119.4	173.5	-177.6	0	0	0	0	109.3	Q61 A63 E64 V66 V83 A88 V90 F108	Q61-V80 WeakPolarHBondContact O-CB 3.49Å; Q61-V80 WeakPolarHBondContact O-CG1 3.31Å; A63-V80 VanDerWaalsContact CA-O 3.28Å; A63-V80 WeakPolarHBondContact CA-O 3.4Å; A63-V80 PolarHBondContact N-O 2.82Å; E64-V80 HydrophobicContact CB-CB 4.33Å; E64-V80 HydrophobicContact CB-CG2 3.91Å; E64-V80 WeakPolarHBondContact O-CG2 3.24Å; E64-V80 PolarHBondContact O-N 3.11Å; V66-V80 HydrophobicContact CG2-CG2 3.76Å; V80-V83 HydrophobicContact CG1-CG2 3.5Å; V80-V83 VanDerWaalsContact CG1-CG2 3.5Å; V80-A88 HydrophobicContact CG1-CB 4.47Å; V80-V90 HydrophobicContact CG2-CG2 4.12Å; V80-F108 HydrophobicContact CG2-CD1 4.49Å; V80-F108 HydrophobicContact CG2-CE1 3.87Å
81	L	89.9	Confident	90.9	Very high	23 Å²	23	51.9 Å²	51.9	12%	0.12	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	-36.7	177.5	-68.9	-174.9	0	0	0	112.8	L51 Y62 Q79 I89 Q91	L51-L81 HydrophobicContact CD2-CD1 3.83Å; Y62-L81 WeakPolarHBondContact CD2-O 3.34Å; Y62-L81 WeakPolarHBondContact CE2-O 3.36Å; Q79-L81 PolarHBondContact O-N 3.04Å; L81-I89 PolarHBondContact N-O 3.38Å; L81-Q91 HydrophobicContact CD1-CB 3.69Å; L81-Q91 HydrophobicContact CD1-CG 4.45Å; L81-Q91 HydrophobicContact CD2-CB 4.48Å; L81-Q91 HydrophobicContact CG-CB 3.86Å
82	E	90.4	Very high	91	Very high	92 Å²	92	48.7 Å²	48.7	43%	0.43	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	141.3	-176.1	-168.7	178.7	156.1	0	0	110.4	A88 I89	E82-A88 CarbonylContact O-C 3.6Å; E82-A88 WeakPolarHBondContact O-CA 3.41Å; E82-I89 HydrophobicContact CB-CB 4.22Å; E82-I89 HydrophobicContact CB-CD1 4.21Å; E82-I89 HydrophobicContact CB-CG1 4.4Å; E82-I89 PolarHBondContact N-O 3.49Å; E82-I89 PolarHBondContact O-N 3.11Å
83	V	91.9	Very high	90.9	Very high	53 Å²	53	43.8 Å²	43.8	32%	0.321	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	122.4	175.9	-176.7	0	0	0	0	108.5	A60 V80 K87	A60-V83 HydrophobicContact CB-CG1 3.94Å; A60-V83 HydrophobicContact CB-CG2 3.75Å; V80-V83 HydrophobicContact CG1-CG2 3.5Å; V80-V83 VanDerWaalsContact CG1-CG2 3.5Å; V83-K87 WeakPolarHBondContact CA-O 3.45Å
84	A	91.3	Very high	90.8	Very high	60 Å²	60	43.6 Å²	43.6	50%	0.496	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	97	178	0	0	0	0	0	109.5	T86 K87	A84-T86 PolarHBondContact O-N 3.33Å; A84-K87 PolarHBondContact N-O 3.16Å; A84-K87 PolarHBondContact O-N 3.46Å
85	G	90.3	Very high	90.6	Very high	73 Å²	73	41.7 Å²	41.7	75%	0.753	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.4	-107.3	-177	0	0	0	0	0	111.8
86	T	91.5	Very high	90.4	Very high	81 Å²	81	35.8 Å²	35.8	50%	0.497	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.2	-0.5	177.8	58.3	0	0	0	0	113.8	D55 R56 V57 A84	D55-T86 CarbonylContact C-O 3.55Å; D55-T86 PolarHBondContact OD1-OG1 3.28Å; R56-T86 PolarHBondContact N-O 3.08Å; V57-T86 PolarHBondContact N-O 2.85Å; A84-T86 PolarHBondContact O-N 3.33Å
87	K	91.9	Very high	90.2	Very high	115 Å²	115	38.5 Å²	38.5	50%	0.5	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	138.6	178.7	-65.3	-175	-179.8	-175.5	0	110.4	L54 V83 A84	L54-K87 VanDerWaalsContact O-CA 3.3Å; L54-K87 WeakPolarHBondContact O-CA 3.33Å; V83-K87 WeakPolarHBondContact CA-O 3.45Å; A84-K87 PolarHBondContact N-O 3.16Å; A84-K87 PolarHBondContact O-N 3.46Å
88	A	92.8	Very high	89.9	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	131.1	173.4	0	0	0	0	0	109.3	L54 V57 A60 V80 E82 F108	L54-A88 PolarHBondContact N-O 3.32Å; L54-A88 PolarHBondContact O-N 2.64Å; V57-A88 HydrophobicContact CG2-CB 4.27Å; A60-A88 HydrophobicContact CB-CB 4.05Å; V80-A88 HydrophobicContact CG1-CB 4.47Å; E82-A88 CarbonylContact O-C 3.6Å; E82-A88 WeakPolarHBondContact O-CA 3.41Å; A88-F108 HydrophobicContact CB-CZ 4.46Å
89	I	92	Very high	89.8	Confident	47 Å²	47	41.1 Å²	41.1	24%	0.241	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	118.7	172.8	-56.4	-179.7	0	0	0	106.9	L51 L81 E82	L51-I89 HydrophobicContact CB-CG2 4.35Å; L51-I89 HydrophobicContact CD1-CG2 4.4Å; L51-I89 HydrophobicContact CD2-CG2 4.38Å; L81-I89 PolarHBondContact N-O 3.38Å; E82-I89 HydrophobicContact CB-CB 4.22Å; E82-I89 HydrophobicContact CB-CD1 4.21Å; E82-I89 HydrophobicContact CB-CG1 4.4Å; E82-I89 PolarHBondContact N-O 3.49Å; E82-I89 PolarHBondContact O-N 3.11Å
90	V	92.4	Very high	89.6	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	131.7	-176.9	-171.3	0	0	0	0	109.3	V52 L54 V66 F68 Q79 V80	V52-V90 PolarHBondContact N-O 3.26Å; V52-V90 PolarHBondContact O-N 2.94Å; L54-V90 HydrophobicContact CD1-CG2 3.7Å; L54-V90 HydrophobicContact CG-CG2 4.37Å; V66-V90 HydrophobicContact CB-CG1 4.07Å; V66-V90 HydrophobicContact CG2-CG1 4.07Å; V66-V90 HydrophobicContact CG2-CG2 4.23Å; F68-V90 HydrophobicContact CE2-CB 4.45Å; F68-V90 HydrophobicContact CE2-CG1 3.66Å; F68-V90 HydrophobicContact CZ-CB 3.96Å; F68-V90 HydrophobicContact CZ-CG1 3.65Å; Q79-V90 WeakPolarHBondContact O-CA 3.15Å; Q79-V90 WeakPolarHBondContact O-CG1 3.47Å; V80-V90 HydrophobicContact CG2-CG2 4.12Å
91	Q	90.5	Very high	89.3	Confident	8 Å²	8	44.2 Å²	44.2	4%	0.037	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	126.1	173.3	178.6	175.3	26.6	0	0	109.7	L51 G78 Q79 L81 I263	L51-Q91 HydrophobicContact CD2-CB 4.04Å; L51-Q91 HydrophobicContact CD2-CG 4.37Å; G78-Q91 CarbonylContact C-O 3.52Å; G78-Q91 WeakPolarHBondContact CA-O 3.43Å; Q79-Q91 PolarHBondContact N-O 2.75Å; Q79-Q91 PolarHBondContact O-N 3.48Å; L81-Q91 HydrophobicContact CD1-CB 3.69Å; L81-Q91 HydrophobicContact CD1-CG 4.45Å; L81-Q91 HydrophobicContact CD2-CB 4.48Å; L81-Q91 HydrophobicContact CG-CB 3.86Å; Q91-I263 HydrophobicContact CG-CD1 3.8Å; Q91-I263 HydrophobicContact CG-CG1 4.43Å; Q91-I263 HydrophobicContact CG-CG2 4.02Å
92	V	90.8	Very high	89	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	123.8	-178.3	-175.1	0	0	0	0	110	P50 V52 F68 R76 G95 T96 I99 I263	P50-V92 PolarHBondContact O-N 2.99Å; V52-V92 HydrophobicContact CB-CG2 4.38Å; V52-V92 HydrophobicContact CG2-CG2 3.56Å; F68-V92 HydrophobicContact CD2-CG2 4.06Å; F68-V92 HydrophobicContact CE2-CG2 3.73Å; F68-V92 HydrophobicContact CZ-CG2 4.07Å; R76-V92 HydrophobicContact CB-CG1 3.92Å; V92-G95 VanDerWaalsContact CG1-O 3.23Å; V92-G95 WeakPolarHBondContact CG1-O 3.44Å; V92-G95 PolarHBondContact O-N 2.86Å; V92-T96 HydrophobicContact CB-CG2 4.34Å; V92-T96 HydrophobicContact CG2-CG2 4.3Å; V92-I99 HydrophobicContact CG2-CD1 4.03Å; V92-I263 WeakPolarHBondContact O-CD1 3.47Å
93	F	86.8	Confident	89	Confident	8 Å²	8	56.1 Å²	56.1	4%	0.035	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-46.8	-174.7	-61.3	-30.8	0	0	0	112.6	I65 S77 Q79 G95 L113 P261 I263 I267	I65-F93 HydrophobicContact CD1-CE2 4.15Å; I65-F93 HydrophobicContact CD1-CZ 4.15Å; S77-F93 PolarHBondContact O-N 3Å; Q79-F93 HydrophobicContact CB-CE1 4.02Å; Q79-F93 HydrophobicContact CB-CZ 3.9Å; F93-G95 PolarHBondContact O-N 3.33Å; F93-L113 HydrophobicContact CE2-CD2 4.32Å; F93-L113 HydrophobicContact CZ-CD2 4.23Å; F93-P261 WeakPolarHBondContact O-CB 3.46Å; F93-I263 HydrophobicContact CD1-CB 4.45Å; F93-I263 HydrophobicContact CD1-CG2 3.52Å; F93-I263 HydrophobicContact CE1-CG2 4.1Å; F93-I267 HydrophobicContact CD2-CD1 4.34Å; F93-I267 HydrophobicContact CE1-CG2 4.4Å; F93-I267 HydrophobicContact CE2-CD1 4.26Å; F93-I267 HydrophobicContact CZ-CD1 4.47Å; F93-I267 HydrophobicContact CZ-CG2 4.31Å
94	E	86.5	Confident	88.9	Confident	48 Å²	48	53.6 Å²	53.6	22%	0.224	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	6.8	-178.2	-54.2	91.2	155.4	0	0	114.1	R76 S77 K131	R76-E94 WeakPolarHBondContact CA-OE2 3.39Å; R76-E94 VanDerWaalsContact CB-OE2 3.3Å; R76-E94 WeakPolarHBondContact CB-OE2 3.27Å; R76-E94 HydrophobicContact CG-CB 4.03Å; R76-E94 HydrophobicContact CG-CG 4.47Å; S77-E94 PolarHBondContact N-OE1 2.94Å; S77-E94 PolarHBondContact N-OE2 3.34Å; E94-K131 IonicContact OE1-NZ 3.84Å
95	G	85.1	Confident	89	Confident	20 Å²	20	51.9 Å²	51.9	21%	0.206	30%	0.3	C	S	.	.			trans	85.3	176.2	-176.2	0	0	0	0	0	113.6	R76 V92 F93	R76-G95 PolarHBondContact NH1-O 3.44Å; V92-G95 VanDerWaalsContact CG1-O 3.23Å; V92-G95 WeakPolarHBondContact CG1-O 3.44Å; V92-G95 PolarHBondContact O-N 2.86Å; F93-G95 PolarHBondContact O-N 3.33Å
96	T	87.3	Confident	89.1	Confident	25 Å²	25	48.4 Å²	48.4	15%	0.153	27%	0.265	C	S	.	.	S	Bend	trans	-108.2	1.1	-169.8	57.8	0	0	0	0	114.3	V47 G49 V52 V92 G98 I99	V47-T96 VanDerWaalsContact CG1-CB 3.49Å; V47-T96 HydrophobicContact CG1-CG2 3.87Å; G49-T96 WeakPolarHBondContact O-CB 3.32Å; G49-T96 WeakPolarHBondContact O-CG2 3.4Å; G49-T96 PolarHBondContact O-OG1 3.46Å; V52-T96 HydrophobicContact CG2-CG2 3.93Å; V92-T96 HydrophobicContact CB-CG2 4.34Å; V92-T96 HydrophobicContact CG2-CG2 4.3Å; T96-G98 PolarHBondContact O-N 2.97Å; T96-I99 HydrophobicContact CG2-CD1 4.24Å; T96-I99 WeakPolarHBondContact O-CB 3.48Å; T96-I99 WeakPolarHBondContact O-CG1 3.1Å; T96-I99 PolarHBondContact O-N 3.08Å; T96-I99 VanDerWaalsContact O-N 3.1Å
97	S	86.9	Confident	89.1	Confident	97 Å²	97	47.5 Å²	47.5	68%	0.678	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	121.6	-179.8	-52.9	0	0	0	0	111.1	R76	R76-S97 VanDerWaalsContact CZ-O 3.23Å; R76-S97 PolarHBondContact NH1-O 2.95Å; R76-S97 PolarHBondContact NH2-O 3.41Å
98	G	84.4	Confident	89.2	Confident	61 Å²	61	42.6 Å²	42.6	63%	0.629	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	88.6	2.3	180	0	0	0	0	0	115.6	T96 D100	T96-G98 PolarHBondContact O-N 2.97Å; G98-D100 PolarHBondContact O-N 2.97Å
99	I	87.7	Confident	88.9	Confident	21 Å²	21	43.4 Å²	43.4	11%	0.108	24%	0.238	C	C	.	.			trans	-73.8	119.2	171.9	-64.4	-177.7	0	0	0	109.6	V47 V52 L70 V92 T96 T104	V47-I99 HydrophobicContact CG2-CB 4.41Å; V47-I99 HydrophobicContact CG2-CG2 3.86Å; V52-I99 HydrophobicContact CG2-CD1 3.85Å; L70-I99 HydrophobicContact CD1-CG1 4.23Å; L70-I99 HydrophobicContact CD2-CG1 4.37Å; L70-I99 HydrophobicContact CG-CG1 4.26Å; V92-I99 HydrophobicContact CG2-CD1 4.03Å; T96-I99 HydrophobicContact CG2-CD1 4.24Å; T96-I99 WeakPolarHBondContact O-CB 3.48Å; T96-I99 WeakPolarHBondContact O-CG1 3.1Å; T96-I99 PolarHBondContact O-N 3.08Å; T96-I99 VanDerWaalsContact O-N 3.1Å; I99-T104 HydrophobicContact CG2-CG2 4.21Å
100	D	88.1	Confident	88.7	Confident	57 Å²	57	42.5 Å²	42.5	31%	0.305	24%	0.241	S	C	.	.			trans	-97.4	133.7	173.7	179.2	11.6	0	0	0	110.3	P71 G98 R102 K103 T104	P71-D100 HydrophobicContact CG-CB 3.87Å; G98-D100 PolarHBondContact O-N 2.97Å; D100-R102 PolarHBondContact O-N 3.13Å; D100-R102 PolarHBondContact OD1-N 3.34Å; D100-K103 HydrophobicContact CB-CB 4.39Å; D100-K103 WeakPolarHBondContact OD2-CB 3.27Å; D100-K103 WeakPolarHBondContact OD2-CD 3.39Å; D100-K103 VanDerWaalsContact OD2-CG 3.3Å; D100-K103 WeakPolarHBondContact OD2-CG 3.25Å; D100-T104 PolarHBondContact N-OG1 3.45Å; D100-T104 WeakPolarHBondContact O-CB 3.34Å; D100-T104 PolarHBondContact O-N 2.88Å; D100-T104 PolarHBondContact O-OG1 3.33Å
101	A	85.7	Confident	88.5	Confident	40 Å²	40	44.5 Å²	44.5	33%	0.331	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-28.1	179.6	0	0	0	0	0	113.4	V44	V44-A101 HydrophobicContact CG1-CB 4.38Å
102	R	85.4	Confident	88.6	Confident	219 Å²	219	46.5 Å²	46.5	83%	0.826	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	-36.5	-174.6	-67.6	-174.7	179.6	-178.7	1.3	114.3	D100	D100-R102 PolarHBondContact O-N 3.13Å; D100-R102 PolarHBondContact OD1-N 3.34Å
103	K	88.9	Confident	88.5	Confident	145 Å²	145	48 Å²	48	63%	0.63	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.7	-21.5	-170.4	-67.9	177.7	-173.4	175.9	0	113.8	P71 D100	P71-K103 HydrophobicContact CB-CB 3.99Å; P71-K103 HydrophobicContact CB-CD 4.21Å; P71-K103 HydrophobicContact CG-CB 3.63Å; P71-K103 HydrophobicContact CG-CD 4.45Å; D100-K103 HydrophobicContact CB-CB 4.39Å; D100-K103 WeakPolarHBondContact OD2-CB 3.27Å; D100-K103 WeakPolarHBondContact OD2-CD 3.39Å; D100-K103 VanDerWaalsContact OD2-CG 3.3Å; D100-K103 WeakPolarHBondContact OD2-CG 3.25Å
104	T	91.5	Very high	88.7	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	29%	0.289	C	S	.	.			trans	-70.2	132.7	-179.3	-50.7	0	0	0	0	110.3	F68 T69 I99 D100	F68-T104 HydrophobicContact CD1-CG2 4.21Å; T69-T104 WeakPolarHBondContact O-CG2 3.25Å; I99-T104 HydrophobicContact CG2-CG2 4.21Å; D100-T104 PolarHBondContact N-OG1 3.45Å; D100-T104 WeakPolarHBondContact O-CB 3.34Å; D100-T104 PolarHBondContact O-N 2.88Å; D100-T104 PolarHBondContact O-OG1 3.33Å
105	T	92.4	Very high	89	Confident	25 Å²	25	51.2 Å²	51.2	15%	0.153	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	139.2	171.9	44.2	0	0	0	0	109.8	T40 Y41 R42 F68 T69	T40-T105 HydrophobicContact CG2-CG2 4.11Å; Y41-T105 WeakPolarHBondContact O-CA 3.4Å; R42-T105 HydrophobicContact CG-CG2 3.5Å; R42-T105 VanDerWaalsContact CG-CG2 3.5Å; F68-T105 WeakPolarHBondContact CA-O 3.45Å; T69-T105 WeakPolarHBondContact CB-OG1 3.27Å; T69-T105 PolarHBondContact N-O 3.12Å; T69-T105 PolarHBondContact O-N 3.32Å; T69-T105 VanDerWaalsContact O-N 3.1Å; T69-T105 PolarHBondContact O-OG1 2.92Å
106	C	92	Very high	89.4	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	127.4	174.1	51.9	0	0	0	0	109.7	T40 Y41 L54 V66 H67 F68	T40-C106 CarbonylContact C-O 3.56Å; T40-C106 WeakPolarHBondContact CA-O 3.47Å; Y41-C106 PolarHBondContact N-O 3.21Å; Y41-C106 PolarHBondContact O-N 3.45Å; Y41-C106 PolarHBondContact O-SG 3.08Å; L54-C106 HydrophobicContact CD1-CB 4.28Å; L54-C106 VanDerWaalsContact CD2-SG 3.53Å; V66-C106 HydrophobicContact CG1-CB 3.85Å; H67-C106 CarbonylContact O-C 3.59Å; H67-C106 WeakPolarHBondContact O-CA 3.38Å; F68-C106 HydrophobicContact CD1-CB 3.85Å; F68-C106 HydrophobicContact CE1-CB 3.78Å
107	E	92.9	Very high	89.6	Confident	61 Å²	61	51 Å²	51	29%	0.285	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	123	178.5	-176.7	-174.8	152.6	0	0	109	R38 V66 H67	R38-E107 HydrophobicContact CB-CG 3.82Å; R38-E107 WeakPolarHBondContact CD-OE1 3.5Å; R38-E107 IonicContact NE-OE1 2.73Å; R38-E107 IonicContact NH1-OE1 3.73Å; R38-E107 PolarHBondContact NH1-OE1 3.36Å; V66-E107 WeakPolarHBondContact CA-O 3.39Å; H67-E107 PolarHBondContact N-O 2.73Å; H67-E107 PolarHBondContact O-N 3.02Å
108	F	91.9	Very high	89.9	Confident	12 Å²	12	46.5 Å²	46.5	5%	0.053	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	127.6	177.9	-79.9	-104.9	0	0	0	109.5	R38 V39 Y41 L54 V57 A60 E64 V66 V80 A88	R38-F108 WeakPolarHBondContact CB-O 3.32Å; V39-F108 PolarHBondContact O-N 3.4Å; Y41-F108 AromaticContact CD2-CD2 3.44Å; Y41-F108 HydrophobicContact CD2-CD2 3.44Å; Y41-F108 VanDerWaalsContact CD2-CD2 3.44Å; Y41-F108 AromaticContact CD2-CE2 3.61Å; Y41-F108 HydrophobicContact CD2-CE2 3.61Å; Y41-F108 AromaticContact CE2-CD2 3.54Å; Y41-F108 HydrophobicContact CE2-CD2 3.54Å; Y41-F108 AromaticContact CE2-CE2 3.93Å; Y41-F108 HydrophobicContact CE2-CE2 3.93Å; Y41-F108 HydrophobicContact CE2-CG 4.2Å; L54-F108 HydrophobicContact CD1-CE2 3.65Å; L54-F108 HydrophobicContact CD1-CZ 3.49Å; L54-F108 VanDerWaalsContact CD1-CZ 3.49Å; V57-F108 HydrophobicContact CB-CZ 4.45Å; V57-F108 HydrophobicContact CG1-CD1 4.42Å; V57-F108 HydrophobicContact CG1-CD2 4.45Å; V57-F108 HydrophobicContact CG1-CE1 3.92Å; V57-F108 HydrophobicContact CG1-CE2 3.93Å; V57-F108 HydrophobicContact CG1-CZ 3.63Å; V57-F108 HydrophobicContact CG2-CE2 4.2Å; V57-F108 HydrophobicContact CG2-CZ 3.98Å; A60-F108 HydrophobicContact CB-CE1 4.22Å; E64-F108 WeakPolarHBondContact OE1-CB 3.28Å; V66-F108 HydrophobicContact CG1-CD2 4.35Å; V66-F108 HydrophobicContact CG1-CE2 4.29Å; V66-F108 HydrophobicContact CG2-CD1 3.72Å; V66-F108 HydrophobicContact CG2-CD2 4.47Å; V66-F108 HydrophobicContact CG2-CE1 3.61Å; V66-F108 HydrophobicContact CG2-CE2 4.4Å; V66-F108 HydrophobicContact CG2-CG 4.17Å; V66-F108 HydrophobicContact CG2-CZ 3.99Å; V80-F108 HydrophobicContact CG2-CD1 4.49Å; V80-F108 HydrophobicContact CG2-CE1 3.87Å; A88-F108 HydrophobicContact CB-CZ 4.46Å
109	T	88.4	Confident	90.3	Very high	17 Å²	17	47.2 Å²	47.2	10%	0.104	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	-23.4	-175.2	57.5	0	0	0	0	113.3	I65 H67 D111	I65-T109 HydrophobicContact CB-CG2 4.42Å; I65-T109 HydrophobicContact CG2-CG2 4.04Å; I65-T109 WeakPolarHBondContact O-CB 3.45Å; I65-T109 WeakPolarHBondContact O-CG2 3.48Å; I65-T109 PolarHBondContact O-N 2.64Å; I65-T109 PolarHBondContact O-OG1 3.28Å; H67-T109 VanDerWaalsContact CD2-CG2 3.4Å; H67-T109 WeakPolarHBondContact CD2-CG2 3.48Å; H67-T109 WeakPolarHBondContact NE2-CG2 3.3Å; T109-D111 VanDerWaalsContact C-N 3.3Å; T109-D111 PolarHBondContact OG1-O 2.94Å
110	G	86.9	Confident	90.4	Very high	29 Å²	29	51.8 Å²	51.8	30%	0.299	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	79.1	8	-176.4	0	0	0	0	0	114.5	E64	E64-G110 WeakPolarHBondContact OE1-CA 3.23Å; E64-G110 PolarHBondContact OE1-N 3.28Å
111	D	88.6	Confident	90.6	Very high	42 Å²	42	49.2 Å²	49.2	23%	0.225	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	163.5	-178.4	-157.4	3.3	0	0	0	110.9	I34 E64 I65 T109 R114	I34-D111 HydrophobicContact CD1-CB 3.97Å; E64-D111 WeakPolarHBondContact CA-O 3.42Å; E64-D111 WeakPolarHBondContact CG-O 3.44Å; I65-D111 PolarHBondContact N-O 3.34Å; T109-D111 VanDerWaalsContact C-N 3.3Å; T109-D111 PolarHBondContact OG1-O 2.94Å; D111-R114 IonicContact OD1-CZ 2.72Å; D111-R114 IonicContact OD1-NE 3.75Å; D111-R114 PolarHBondContact OD1-NE 2.99Å; D111-R114 IonicContact OD1-NH2 2.64Å; D111-R114 PolarHBondContact OD1-NH2 3.47Å; D111-R114 IonicContact OD2-CZ 3.59Å; D111-R114 IonicContact OD2-NE 3.13Å; D111-R114 PolarHBondContact OD2-NE 3.2Å; D111-R114 IonicContact OD2-NH2 3.51Å; D111-R114 PolarHBondContact OD2-NH2 3.18Å
112	I	91.4	Very high	90.9	Very high	49 Å²	49	48.8 Å²	48.8	25%	0.251	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	171.1	176.1	60.8	178	0	0	0	111.4	A63 R114 D146	A63-I112 HydrophobicContact CB-CG2 4.48Å; I112-R114 HydrophobicContact CG1-CG 4.49Å; I112-R114 PolarHBondContact O-N 2.94Å; I112-D146 HydrophobicContact CD1-CB 3.96Å; I112-D146 VanDerWaalsContact CD1-CG 3.44Å; I112-D146 VanDerWaalsContact CD1-OD2 3.3Å; I112-D146 WeakPolarHBondContact CD1-OD2 3.44Å
113	L	90.4	Very high	91.1	Very high	33 Å²	33	39.6 Å²	39.6	17%	0.173	21%	0.208	C	C	.	.			trans	-68.1	105.3	178.2	-174.3	48.9	0	0	0	111	I65 F93 I147 I267	I65-L113 HydrophobicContact CD1-CB 3.78Å; I65-L113 HydrophobicContact CD1-CD1 4.01Å; I65-L113 HydrophobicContact CD1-CD2 4.19Å; I65-L113 HydrophobicContact CD1-CG 4.19Å; I65-L113 HydrophobicContact CG1-CB 3.69Å; I65-L113 HydrophobicContact CG1-CD1 3.96Å; I65-L113 HydrophobicContact CG1-CG 4.33Å; F93-L113 HydrophobicContact CE2-CD2 4.32Å; F93-L113 HydrophobicContact CZ-CD2 4.23Å; L113-I147 HydrophobicContact CB-CD1 4.14Å; L113-I147 HydrophobicContact CB-CG1 4.13Å; L113-I147 HydrophobicContact CD2-CD1 3.44Å; L113-I147 VanDerWaalsContact CD2-CD1 3.44Å; L113-I147 HydrophobicContact CD2-CG1 4.24Å; L113-I147 HydrophobicContact CG-CD1 3.87Å; L113-I147 HydrophobicContact CG-CG1 4.11Å; L113-I147 HydrophobicContact CG-CG2 4.11Å; L113-I147 PolarHBondContact O-N 3.48Å; L113-I267 HydrophobicContact CD2-CG2 4.16Å
114	R	90.8	Very high	91.3	Very high	116 Å²	116	34.4 Å²	34.4	44%	0.438	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	132.4	171.5	-57.8	-176.3	-170.2	-131	-0.1	110.7	D111 I112 F144 L145	D111-R114 IonicContact OD1-CZ 2.72Å; D111-R114 IonicContact OD1-NE 3.75Å; D111-R114 PolarHBondContact OD1-NE 2.99Å; D111-R114 IonicContact OD1-NH2 2.64Å; D111-R114 PolarHBondContact OD1-NH2 3.47Å; D111-R114 IonicContact OD2-CZ 3.59Å; D111-R114 IonicContact OD2-NE 3.13Å; D111-R114 PolarHBondContact OD2-NE 3.2Å; D111-R114 IonicContact OD2-NH2 3.51Å; D111-R114 PolarHBondContact OD2-NH2 3.18Å; I112-R114 HydrophobicContact CG1-CG 4.49Å; I112-R114 PolarHBondContact O-N 2.94Å; R114-F144 HydrophobicContact CB-CB 4.07Å; R114-L145 CarbonylContact C-O 3.58Å; R114-L145 WeakPolarHBondContact CA-O 3.34Å
115	T	91.5	Very high	91.4	Very high	7 Å²	7	34.5 Å²	34.5	4%	0.043	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	135.2	173.9	-171.8	0	0	0	0	110.1	V117 L145 I147 L271 T274	T115-V117 HydrophobicContact CG2-CG1 3.91Å; T115-V117 PolarHBondContact O-N 3.22Å; T115-L145 PolarHBondContact N-O 3.1Å; T115-L145 PolarHBondContact O-N 3.1Å; T115-L145 VanDerWaalsContact O-N 3.13Å; T115-I147 HydrophobicContact CG2-CG2 4Å; T115-L271 HydrophobicContact CG2-CD2 4.25Å; T115-T274 HydrophobicContact CG2-CG2 3.62Å
116	P	93.1	Very high	91.5	Very high	41 Å²	41	33.3 Å²	33.3	27%	0.266	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	127.1	166.9	29	-32.9	0	0	0	108.5	A141 F144	P116-A141 HydrophobicContact CB-CB 3.51Å; P116-F144 HydrophobicContact CB-CD1 4.24Å; P116-F144 HydrophobicContact CB-CE1 3.83Å; P116-F144 HydrophobicContact CB-CZ 4.49Å
117	V	92.9	Very high	91.5	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	143.5	174.5	-64.8	0	0	0	0	110.3	T115 E142 D143 L145 T274 F278	T115-V117 HydrophobicContact CG2-CG1 3.91Å; T115-V117 PolarHBondContact O-N 3.22Å; V117-E142 PolarHBondContact O-N 2.85Å; V117-D143 HydrophobicContact CG2-CB 4.17Å; V117-D143 WeakPolarHBondContact CG2-O 3.48Å; V117-D143 PolarHBondContact N-O 3.48Å; V117-D143 PolarHBondContact O-N 3.26Å; V117-L145 HydrophobicContact CG1-CD1 4.24Å; V117-L145 HydrophobicContact CG1-CG 4.49Å; V117-L145 HydrophobicContact CG2-CD1 3.77Å; V117-L145 HydrophobicContact CG2-CG 3.79Å; V117-T274 HydrophobicContact CG1-CG2 4.44Å; V117-F278 HydrophobicContact CB-CB 4.15Å; V117-F278 HydrophobicContact CB-CD1 4.1Å; V117-F278 HydrophobicContact CB-CD2 3.99Å; V117-F278 HydrophobicContact CB-CE2 4.43Å; V117-F278 HydrophobicContact CB-CG 3.8Å; V117-F278 HydrophobicContact CG1-CB 4.29Å; V117-F278 HydrophobicContact CG1-CG 4.47Å; V117-F278 HydrophobicContact CG2-CB 4.26Å; V117-F278 HydrophobicContact CG2-CD1 4.38Å; V117-F278 HydrophobicContact CG2-CD2 3.39Å; V117-F278 HydrophobicContact CG2-CE2 3.74Å; V117-F278 HydrophobicContact CG2-CG 3.75Å; V117-F278 HydrophobicContact CG2-CZ 4.39Å
118	S	93.4	Very high	91.3	Very high	2 Å²	2	31.8 Å²	31.8	1%	0.014	17%	0.172	C	C	.	.			trans	-159.7	155.9	173.7	171.4	0	0	0	0	109.6	D120 M121 M140 E142	S118-D120 PolarHBondContact O-N 3.45Å; S118-D120 PolarHBondContact OG-N 3.28Å; S118-M121 WeakPolarHBondContact O-CB 3.2Å; S118-M121 VanDerWaalsContact O-CG 3.3Å; S118-M121 WeakPolarHBondContact O-CG 3.44Å; S118-M121 PolarHBondContact O-N 3.05Å; S118-M140 VanDerWaalsContact CB-O 3.31Å; S118-M140 WeakPolarHBondContact CB-O 3.33Å; S118-E142 VanDerWaalsContact CA-OE1 3.3Å; S118-E142 WeakPolarHBondContact CA-OE1 3.49Å; S118-E142 WeakPolarHBondContact CB-OE1 3.31Å; S118-E142 PolarHBondContact OG-OE1 2.84Å
119	E	91.3	Very high	91.1	Very high	75 Å²	75	32.5 Å²	32.5	35%	0.35	18%	0.178	S	C	.	.	G	3₁₀ helix	trans	-62.2	-26.6	171.8	-68.9	-157.1	-151.6	0	0	112.8	M121 L122 E142 F278 C283 K285	E119-M121 PolarHBondContact O-N 3.02Å; E119-L122 PolarHBondContact O-N 3.18Å; E119-L122 VanDerWaalsContact O-N 3.16Å; E119-E142 PolarHBondContact N-OE1 2.83Å; E119-F278 HydrophobicContact CG-CE1 4.1Å; E119-C283 VanDerWaalsContact CD-SG 3.5Å; E119-C283 HydrophobicContact CG-CB 4.4Å; E119-C283 WeakPolarHBondContact CG-SG 3.23Å; E119-C283 WeakPolarHBondContact OE1-CB 3.49Å; E119-C283 PolarHBondContact OE1-SG 3.46Å; E119-K285 IonicContact OE2-NZ 3.51Å; E119-K285 PolarHBondContact OE2-NZ 3.05Å
120	D	91.3	Very high	91.1	Very high	117 Å²	117	32.8 Å²	32.8	63%	0.626	18%	0.184	S	C	*	.	G	3₁₀ helix	trans	-66.7	-2.8	178	-69.2	-15.1	0	0	0	113.5	S118 L122 R124	S118-D120 PolarHBondContact O-N 3.45Å; S118-D120 PolarHBondContact OG-N 3.28Å; D120-L122 VanDerWaalsContact C-N 3.29Å; D120-R124 WeakPolarHBondContact O-CG 3.5Å
121	M	91.8	Very high	91.3	Very high	4 Å²	4	36.3 Å²	36.3	2%	0.02	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-74.7	-18.6	172.6	-65.1	-176.5	72.2	0	0	112.9	S118 E119 R124 F126 V139 F254 T275	S118-M121 WeakPolarHBondContact O-CB 3.2Å; S118-M121 VanDerWaalsContact O-CG 3.3Å; S118-M121 WeakPolarHBondContact O-CG 3.44Å; S118-M121 PolarHBondContact O-N 3.05Å; E119-M121 PolarHBondContact O-N 3.02Å; M121-R124 WeakPolarHBondContact O-CB 3.41Å; M121-R124 PolarHBondContact O-N 3.18Å; M121-F126 HydrophobicContact CB-CE2 4.04Å; M121-F126 HydrophobicContact CB-CZ 4.2Å; M121-F126 HydrophobicContact CE-CD2 4.12Å; M121-F126 HydrophobicContact CE-CE2 3.59Å; M121-F126 HydrophobicContact CE-CZ 3.83Å; M121-F126 HydrophobicContact CG-CE2 4.22Å; M121-F126 HydrophobicContact CG-CZ 3.99Å; M121-V139 HydrophobicContact CG-CG1 3.84Å; M121-V139 HydrophobicContact CG-CG2 4.1Å; M121-V139 HydrophobicContact SD-CG1 4.3Å; M121-F254 HydrophobicContact CE-CE1 4.32Å; M121-F254 HydrophobicContact CE-CZ 3.78Å; M121-T275 HydrophobicContact CB-CG2 4.48Å; M121-T275 HydrophobicContact CE-CG2 4.05Å; M121-T275 HydrophobicContact SD-CG2 4.04Å
122	L	91.6	Very high	91.5	Very high	30 Å²	30	36.1 Å²	36.1	16%	0.157	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	132.7	172.9	-65	174.8	0	0	0	110.1	E119 D120 R124 A222 C252 L279 K285	E119-L122 PolarHBondContact O-N 3.18Å; E119-L122 VanDerWaalsContact O-N 3.16Å; D120-L122 VanDerWaalsContact C-N 3.29Å; L122-R124 VanDerWaalsContact C-N 3.3Å; L122-R124 PolarHBondContact O-N 3.21Å; L122-A222 HydrophobicContact CD2-CB 4.03Å; L122-C252 HydrophobicContact CD2-CB 4.46Å; L122-L279 HydrophobicContact CD1-CD2 4.16Å; L122-L279 HydrophobicContact CD2-CD1 3.79Å; L122-L279 HydrophobicContact CD2-CD2 4.47Å; L122-L279 HydrophobicContact CG-CD1 4.4Å; L122-L279 HydrophobicContact CG-CD2 4.25Å; L122-K285 HydrophobicContact CD1-CD 4.26Å
123	G	90.4	Very high	91.5	Very high	27 Å²	27	37.9 Å²	37.9	28%	0.278	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.9	0.9	-173.5	0	0	0	0	0	115.6	M248 V251	G123-M248 WeakPolarHBondContact CA-O 3.45Å; G123-M248 PolarHBondContact N-O 3.48Å; G123-V251 WeakPolarHBondContact CA-O 3.35Å; G123-V251 PolarHBondContact N-O 3.32Å
124	R	92.8	Very high	91.4	Very high	35 Å²	35	38.6 Å²	38.6	13%	0.132	21%	0.205	C	C	.	.			trans	-99	156.3	179.1	-59.7	-72.1	-45.5	-97.1	5.1	112	D120 M121 L122 F126 D134 P137 L253	D120-R124 WeakPolarHBondContact O-CG 3.5Å; M121-R124 WeakPolarHBondContact O-CB 3.41Å; M121-R124 PolarHBondContact O-N 3.18Å; L122-R124 VanDerWaalsContact C-N 3.3Å; L122-R124 PolarHBondContact O-N 3.21Å; R124-F126 HydrophobicContact CB-CD2 4.34Å; R124-F126 HydrophobicContact CB-CE1 4.31Å; R124-F126 HydrophobicContact CB-CE2 3.47Å; R124-F126 VanDerWaalsContact CB-CE2 3.47Å; R124-F126 HydrophobicContact CB-CZ 3.45Å; R124-F126 VanDerWaalsContact CB-CZ 3.45Å; R124-F126 HydrophobicContact CG-CE2 4.41Å; R124-F126 HydrophobicContact CG-CZ 4.01Å; R124-D134 WeakPolarHBondContact CA-OD2 3.47Å; R124-D134 IonicContact CZ-OD1 2.63Å; R124-D134 IonicContact CZ-OD2 2.88Å; R124-D134 IonicContact NE-OD1 2.95Å; R124-D134 IonicContact NE-OD2 2.9Å; R124-D134 PolarHBondContact NE-OD2 2.94Å; R124-D134 IonicContact NH2-OD1 3.28Å; R124-D134 PolarHBondContact NH2-OD1 3.5Å; R124-D134 IonicContact NH2-OD2 3.97Å; R124-D134 PolarHBondContact NH2-OD2 2.86Å; R124-P137 PolarHBondContact NH1-O 3.3Å; R124-P137 PolarHBondContact NH2-O 3.01Å; R124-L253 PolarHBondContact O-N 3Å; R124-L253 VanDerWaalsContact O-N 3.14Å
125	V	93.9	Very high	91.3	Very high	3 Å²	3	43 Å²	43	2%	0.018	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	123.8	172.7	-165.5	0	0	0	0	110.3	I133 D134 M248 L253 L255	V125-I133 HydrophobicContact CB-CD1 4.35Å; V125-I133 HydrophobicContact CB-CG1 3.92Å; V125-I133 HydrophobicContact CG1-CD1 3.44Å; V125-I133 VanDerWaalsContact CG1-CD1 3.44Å; V125-I133 HydrophobicContact CG1-CG1 3.55Å; V125-I133 WeakPolarHBondContact O-CG1 3.45Å; V125-I133 PolarHBondContact O-N 3.25Å; V125-D134 HydrophobicContact CB-CB 4.27Å; V125-D134 HydrophobicContact CG2-CB 4.5Å; V125-D134 PolarHBondContact N-OD2 3.43Å; V125-M248 HydrophobicContact CG2-CE 3.46Å; V125-M248 VanDerWaalsContact CG2-CE 3.46Å; V125-L253 WeakPolarHBondContact CA-O 3.25Å; V125-L253 HydrophobicContact CB-CB 4.34Å; V125-L253 HydrophobicContact CG1-CB 3.87Å; V125-L253 HydrophobicContact CG2-CB 4.23Å; V125-L253 HydrophobicContact CG2-CD1 3.97Å; V125-L255 HydrophobicContact CG1-CD1 3.67Å; V125-L255 HydrophobicContact CG1-CG 4.11Å
126	F	94.6	Very high	91.2	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	156.4	179.7	-55.7	-76.9	0	0	0	111.2	M121 R124 K131 P132 V139 L253 F254 L255	M121-F126 HydrophobicContact CB-CE2 4.04Å; M121-F126 HydrophobicContact CB-CZ 4.2Å; M121-F126 HydrophobicContact CE-CD2 4.12Å; M121-F126 HydrophobicContact CE-CE2 3.59Å; M121-F126 HydrophobicContact CE-CZ 3.83Å; M121-F126 HydrophobicContact CG-CE2 4.22Å; M121-F126 HydrophobicContact CG-CZ 3.99Å; R124-F126 HydrophobicContact CB-CD2 4.34Å; R124-F126 HydrophobicContact CB-CE1 4.31Å; R124-F126 HydrophobicContact CB-CE2 3.47Å; R124-F126 VanDerWaalsContact CB-CE2 3.47Å; R124-F126 HydrophobicContact CB-CZ 3.45Å; R124-F126 VanDerWaalsContact CB-CZ 3.45Å; R124-F126 HydrophobicContact CG-CE2 4.41Å; R124-F126 HydrophobicContact CG-CZ 4.01Å; F126-K131 CarbonylContact C-O 3.54Å; F126-K131 WeakPolarHBondContact CA-O 3.4Å; F126-P132 HydrophobicContact CD1-CB 4.23Å; F126-P132 HydrophobicContact CE1-CB 4.27Å; F126-V139 HydrophobicContact CE1-CG2 3.41Å; F126-V139 VanDerWaalsContact CE1-CG2 3.41Å; F126-V139 HydrophobicContact CZ-CG2 3.58Å; F126-L253 PolarHBondContact N-O 3.3Å; F126-F254 HydrophobicContact CB-CD1 3.71Å; F126-F254 HydrophobicContact CB-CE1 3.87Å; F126-F254 HydrophobicContact CD2-CD1 4.36Å; F126-F254 AromaticContact CD2-CE1 3.91Å; F126-F254 HydrophobicContact CD2-CE1 3.91Å; F126-F254 HydrophobicContact CD2-CZ 4.13Å; F126-F254 HydrophobicContact CG-CD1 4.38Å; F126-F254 HydrophobicContact CG-CE1 4.07Å; F126-F254 WeakPolarHBondContact O-CA 3.36Å; F126-L255 PolarHBondContact O-N 2.88Å
127	N	92.4	Very high	91.2	Very high	29 Å²	29	46.9 Å²	46.9	16%	0.155	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	178.8	167.6	76.5	-8.9	0	0	0	111.8	S129 G130 K131 I133 L255	N127-S129 PolarHBondContact O-N 3.21Å; N127-S129 VanDerWaalsContact O-N 3.09Å; N127-S129 WeakPolarHBondContact OD1-CA 3.25Å; N127-S129 PolarHBondContact OD1-N 3.38Å; N127-G130 PolarHBondContact O-N 2.91Å; N127-G130 PolarHBondContact OD1-N 3.36Å; N127-G130 VanDerWaalsContact OD1-N 3.09Å; N127-K131 PolarHBondContact N-O 3.35Å; N127-K131 WeakPolarHBondContact OD1-CA 3.33Å; N127-K131 WeakPolarHBondContact OD1-CB 3.47Å; N127-K131 PolarHBondContact OD1-N 3.37Å; N127-K131 PolarHBondContact OD1-O 2.92Å; N127-I133 HydrophobicContact CB-CG2 3.78Å; N127-L255 CarbonylContact C-O 3.58Å; N127-L255 VanDerWaalsContact CA-O 3.26Å; N127-L255 WeakPolarHBondContact CA-O 3.39Å
128	G	87.6	Confident	91.1	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-14.1	176.6	0	0	0	0	0	115.8	L255 T268 L271	G128-L255 PolarHBondContact N-O 3.09Å; G128-T268 WeakPolarHBondContact CA-OG1 3.41Å; G128-T268 PolarHBondContact O-OG1 3.26Å; G128-L271 VanDerWaalsContact O-CD1 3.31Å; G128-L271 WeakPolarHBondContact O-CD1 3.37Å
129	S	87.9	Confident	90.9	Very high	27 Å²	27	53.3 Å²	53.3	19%	0.189	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.6	6.3	175.1	-74	0	0	0	0	113.6	N127 K131 E264	N127-S129 PolarHBondContact O-N 3.21Å; N127-S129 VanDerWaalsContact O-N 3.09Å; N127-S129 WeakPolarHBondContact OD1-CA 3.25Å; N127-S129 PolarHBondContact OD1-N 3.38Å; S129-K131 VanDerWaalsContact C-N 3.3Å; S129-K131 PolarHBondContact O-N 3.11Å; S129-E264 WeakPolarHBondContact OG-CG 3.3Å; S129-E264 PolarHBondContact OG-OE1 3.33Å
130	G	88.3	Confident	90.9	Very high	23 Å²	23	57.2 Å²	57.2	24%	0.237	32%	0.317	C	S	.	.	S	Bend	trans	76.6	10.4	-178.9	0	0	0	0	0	115	N127	N127-G130 PolarHBondContact O-N 2.91Å; N127-G130 PolarHBondContact OD1-N 3.36Å; N127-G130 VanDerWaalsContact OD1-N 3.09Å
131	K	91	Very high	90.8	Very high	103 Å²	103	53.4 Å²	53.4	45%	0.448	30%	0.302	S	S	.	.			trans	-84.4	137.7	174.5	-61.7	174.2	-176.8	164.9	0	109.7	E94 F126 N127 S129	E94-K131 IonicContact OE1-NZ 3.84Å; F126-K131 CarbonylContact C-O 3.54Å; F126-K131 WeakPolarHBondContact CA-O 3.4Å; N127-K131 PolarHBondContact N-O 3.35Å; N127-K131 WeakPolarHBondContact OD1-CA 3.33Å; N127-K131 WeakPolarHBondContact OD1-CB 3.47Å; N127-K131 PolarHBondContact OD1-N 3.37Å; N127-K131 PolarHBondContact OD1-O 2.92Å; S129-K131 VanDerWaalsContact C-N 3.3Å; S129-K131 PolarHBondContact O-N 3.11Å
132	P	93.2	Very high	90.8	Very high	37 Å²	37	58.5 Å²	58.5	24%	0.24	33%	0.326	C	S	.	.	B	Isolated β-bridge	trans	-69.8	135.6	-178.5	28.6	-35.3	0	0	0	112.6	F126	F126-P132 HydrophobicContact CD1-CB 4.23Å; F126-P132 HydrophobicContact CE1-CB 4.27Å
133	I	91.8	Very high	90.7	Very high	86 Å²	86	60.7 Å²	60.7	44%	0.441	34%	0.338	S	S	.	.			trans	-113.5	-5.1	178.5	57.3	165	0	0	0	113.4	V125 N127 K135 L255	V125-I133 HydrophobicContact CB-CD1 4.35Å; V125-I133 HydrophobicContact CB-CG1 3.92Å; V125-I133 HydrophobicContact CG1-CD1 3.44Å; V125-I133 VanDerWaalsContact CG1-CD1 3.44Å; V125-I133 HydrophobicContact CG1-CG1 3.55Å; V125-I133 WeakPolarHBondContact O-CG1 3.45Å; V125-I133 PolarHBondContact O-N 3.25Å; N127-I133 HydrophobicContact CB-CG2 3.78Å; I133-K135 PolarHBondContact O-N 3.08Å; I133-L255 HydrophobicContact CD1-CB 4.31Å; I133-L255 HydrophobicContact CD1-CD1 4.16Å
134	D	88.3	Confident	90.7	Very high	49 Å²	49	64.7 Å²	64.7	26%	0.262	35%	0.348	S	S	.	.	S	Bend	trans	-81.5	7.3	176.7	55.6	12.8	0	0	0	114.1	R124 V125 G136	R124-D134 WeakPolarHBondContact CA-OD2 3.47Å; R124-D134 IonicContact CZ-OD1 2.63Å; R124-D134 IonicContact CZ-OD2 2.88Å; R124-D134 IonicContact NE-OD1 2.95Å; R124-D134 IonicContact NE-OD2 2.9Å; R124-D134 PolarHBondContact NE-OD2 2.94Å; R124-D134 IonicContact NH2-OD1 3.28Å; R124-D134 PolarHBondContact NH2-OD1 3.5Å; R124-D134 IonicContact NH2-OD2 3.97Å; R124-D134 PolarHBondContact NH2-OD2 2.86Å; V125-D134 HydrophobicContact CB-CB 4.27Å; V125-D134 HydrophobicContact CG2-CB 4.5Å; V125-D134 PolarHBondContact N-OD2 3.43Å; D134-G136 PolarHBondContact O-N 2.94Å; D134-G136 PolarHBondContact OD1-N 2.88Å
135	K	88.9	Confident	90.7	Very high	209 Å²	209	64.8 Å²	64.8	91%	0.909	35%	0.351	S	S	*	.	S	Bend	trans	62.4	13.4	-173.5	-51.5	175.5	-179.6	175.2	0	114	I133	I133-K135 PolarHBondContact O-N 3.08Å
136	G	88.8	Confident	90.7	Very high	29 Å²	29	66.9 Å²	66.9	30%	0.299	36%	0.362	S	S	.	.	P	Polyproline II helix	trans	-75.3	169.2	169.3	0	0	0	0	0	112.2	D134	D134-G136 PolarHBondContact O-N 2.94Å; D134-G136 PolarHBondContact OD1-N 2.88Å
137	P	92.6	Very high	90.6	Very high	99 Å²	99	67 Å²	67	64%	0.643	36%	0.362	S	S	*	.	P	Polyproline II helix	trans	-65.2	166.7	174.4	29.8	-35	0	0	0	111.6	R124	R124-P137 PolarHBondContact NH1-O 3.3Å; R124-P137 PolarHBondContact NH2-O 3.01Å
138	V	90.8	Very high	90.5	Very high	114 Å²	114	69.2 Å²	69.2	69%	0.691	37%	0.374	S	S	*	.	P	Polyproline II helix	trans	-60.1	149.1	167.6	-65.1	0	0	0	0	110.3	M140	V138-M140 PolarHBondContact O-N 3.11Å
139	V	89.8	Confident	90.7	Very high	24 Å²	24	70 Å²	70	15%	0.145	38%	0.382	C	S	.	.	P	Polyproline II helix	trans	-64	128.5	179.1	-176.6	0	0	0	0	109.1	M121 F126 A141	M121-V139 HydrophobicContact CG-CG1 3.84Å; M121-V139 HydrophobicContact CG-CG2 4.1Å; M121-V139 HydrophobicContact SD-CG1 4.3Å; F126-V139 HydrophobicContact CE1-CG2 3.41Å; F126-V139 VanDerWaalsContact CE1-CG2 3.41Å; F126-V139 HydrophobicContact CZ-CG2 3.58Å; V139-A141 PolarHBondContact O-N 3.07Å
140	M	90.6	Very high	90.8	Very high	156 Å²	156	76.6 Å²	76.6	77%	0.768	41%	0.41	S	S	*	.			trans	-80.2	108.9	167.4	-64.8	-158.4	-135.9	0	0	107.5	S118 V138	S118-M140 VanDerWaalsContact CB-O 3.31Å; S118-M140 WeakPolarHBondContact CB-O 3.33Å; V138-M140 PolarHBondContact O-N 3.11Å
141	A	90.4	Very high	91	Very high	38 Å²	38	81.8 Å²	81.8	31%	0.314	44%	0.439	S	S	.	.			trans	-71.5	131	-174.4	0	0	0	0	0	111.1	P116 V139 F144	P116-A141 HydrophobicContact CB-CB 3.51Å; V139-A141 PolarHBondContact O-N 3.07Å; A141-F144 HydrophobicContact CB-CD2 4.29Å; A141-F144 HydrophobicContact CB-CE1 4.12Å; A141-F144 HydrophobicContact CB-CE2 3.77Å; A141-F144 HydrophobicContact CB-CZ 3.67Å
142	E	90.9	Very high	91	Very high	111 Å²	111	78.4 Å²	78.4	52%	0.519	43%	0.426	S	S	.	.	S	Bend	trans	-80.1	-39.3	163.9	-69.7	167.7	-132.4	0	0	110	V117 S118 E119 F278	V117-E142 PolarHBondContact O-N 2.85Å; S118-E142 VanDerWaalsContact CA-OE1 3.3Å; S118-E142 WeakPolarHBondContact CA-OE1 3.49Å; S118-E142 WeakPolarHBondContact CB-OE1 3.31Å; S118-E142 PolarHBondContact OG-OE1 2.84Å; E119-E142 PolarHBondContact N-OE1 2.83Å; E142-F278 HydrophobicContact CB-CZ 4.45Å; E142-F278 WeakPolarHBondContact OE2-CZ 3.21Å
143	D	89.5	Confident	91.1	Very high	75 Å²	75	81.2 Å²	81.2	40%	0.401	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	163.6	174.6	-160.1	4.8	0	0	0	111.2	V117 L145	V117-D143 HydrophobicContact CG2-CB 4.17Å; V117-D143 WeakPolarHBondContact CG2-O 3.48Å; V117-D143 PolarHBondContact N-O 3.48Å; V117-D143 PolarHBondContact O-N 3.26Å; D143-L145 WeakPolarHBondContact OD2-CD2 3.17Å
144	F	90.8	Very high	91.1	Very high	112 Å²	112	82.2 Å²	82.2	49%	0.491	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	102.6	174.8	-74.1	-83.6	0	0	0	110	R114 P116 A141	R114-F144 HydrophobicContact CB-CB 4.07Å; P116-F144 HydrophobicContact CB-CD1 4.24Å; P116-F144 HydrophobicContact CB-CE1 3.83Å; P116-F144 HydrophobicContact CB-CZ 4.49Å; A141-F144 HydrophobicContact CB-CD2 4.29Å; A141-F144 HydrophobicContact CB-CE1 4.12Å; A141-F144 HydrophobicContact CB-CE2 3.77Å; A141-F144 HydrophobicContact CB-CZ 3.67Å
145	L	92.4	Very high	91.4	Very high	37 Å²	37	87.2 Å²	87.2	19%	0.194	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	143.1	-177.3	-61.2	-176.6	0	0	0	111.7	R114 T115 V117 D143 I147 T274 F278	R114-L145 CarbonylContact C-O 3.58Å; R114-L145 WeakPolarHBondContact CA-O 3.34Å; T115-L145 PolarHBondContact N-O 3.1Å; T115-L145 PolarHBondContact O-N 3.1Å; T115-L145 VanDerWaalsContact O-N 3.13Å; V117-L145 HydrophobicContact CG1-CD1 4.24Å; V117-L145 HydrophobicContact CG1-CG 4.49Å; V117-L145 HydrophobicContact CG2-CD1 3.77Å; V117-L145 HydrophobicContact CG2-CG 3.79Å; D143-L145 WeakPolarHBondContact OD2-CD2 3.17Å; L145-I147 PolarHBondContact O-N 3.14Å; L145-T274 HydrophobicContact CB-CG2 3.59Å; L145-T274 HydrophobicContact CD1-CG2 4.2Å; L145-F278 HydrophobicContact CD1-CB 4.06Å; L145-F278 HydrophobicContact CD1-CD2 4.16Å
146	D	93.8	Very high	91.5	Very high	46 Å²	46	79.4 Å²	79.4	25%	0.246	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	131	171.1	178.2	8.1	0	0	0	110.1	I112 N148 G149	I112-D146 HydrophobicContact CD1-CB 3.96Å; I112-D146 VanDerWaalsContact CD1-CG 3.44Å; I112-D146 VanDerWaalsContact CD1-OD2 3.3Å; I112-D146 WeakPolarHBondContact CD1-OD2 3.44Å; D146-N148 PolarHBondContact O-N 3.48Å; D146-N148 PolarHBondContact OD1-N 3.44Å; D146-N148 PolarHBondContact OD1-ND2 3.39Å; D146-G149 PolarHBondContact O-N 2.84Å; D146-G149 VanDerWaalsContact O-N 3.09Å
147	I	93.2	Very high	91.7	Very high	2 Å²	2	81.9 Å²	81.9	1%	0.01	44%	0.444	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-24.6	-179.5	64.1	156.5	0	0	0	113.2	L113 T115 L145 G149 I267 R270 L271 T274 R331	L113-I147 HydrophobicContact CB-CD1 4.14Å; L113-I147 HydrophobicContact CB-CG1 4.13Å; L113-I147 HydrophobicContact CD2-CD1 3.44Å; L113-I147 VanDerWaalsContact CD2-CD1 3.44Å; L113-I147 HydrophobicContact CD2-CG1 4.24Å; L113-I147 HydrophobicContact CG-CD1 3.87Å; L113-I147 HydrophobicContact CG-CG1 4.11Å; L113-I147 HydrophobicContact CG-CG2 4.11Å; L113-I147 PolarHBondContact O-N 3.48Å; T115-I147 HydrophobicContact CG2-CG2 4Å; L145-I147 PolarHBondContact O-N 3.14Å; I147-G149 PolarHBondContact O-N 3.31Å; I147-I267 HydrophobicContact CD1-CB 4.32Å; I147-I267 HydrophobicContact CD1-CG2 4.05Å; I147-R270 HydrophobicContact CB-CB 4.08Å; I147-R270 HydrophobicContact CD1-CB 4.14Å; I147-R270 HydrophobicContact CG1-CB 4.45Å; I147-R270 WeakPolarHBondContact O-CB 3.15Å; I147-L271 HydrophobicContact CG2-CD2 3.61Å; I147-L271 HydrophobicContact CG2-CG 4.44Å; I147-T274 WeakPolarHBondContact CA-OG1 3.5Å; I147-T274 PolarHBondContact O-OG1 3.12Å; I147-T274 VanDerWaalsContact O-OG1 3.12Å; I147-R331 PolarHBondContact O-NH1 2.72Å
148	N	91.3	Very high	91.7	Very high	76 Å²	76	80.5 Å²	80.5	41%	0.406	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-15.2	177.5	-63.7	-55.7	0	0	0	112.2	D146	D146-N148 PolarHBondContact O-N 3.48Å; D146-N148 PolarHBondContact OD1-N 3.44Å; D146-N148 PolarHBondContact OD1-ND2 3.39Å
149	G	89.8	Confident	91.7	Very high	16 Å²	16	80.8 Å²	80.8	17%	0.165	42%	0.421	C	S	.	.			trans	69.3	-174.5	-177.2	0	0	0	0	0	112.8	D146 I147	D146-G149 PolarHBondContact O-N 2.84Å; D146-G149 VanDerWaalsContact O-N 3.09Å; I147-G149 PolarHBondContact O-N 3.31Å
150	Q	91.2	Very high	91.7	Very high	166 Å²	166	80.3 Å²	80.3	78%	0.776	42%	0.418	S	S	*	.			trans	-119.4	138.4	174.3	-67.5	-174.8	0.6	0	0	110	I152	Q150-I152 PolarHBondContact O-N 3.24Å
151	P	92.1	Very high	91.4	Very high	132 Å²	132	77.9 Å²	77.9	86%	0.857	41%	0.405	S	S	*	.	P	Polyproline II helix	trans	-65.1	127.9	178.1	26.9	-33.4	0	0	0	110.4
152	I	91.2	Very high	91.3	Very high	33 Å²	33	78.5 Å²	78.5	17%	0.169	40%	0.401	C	S	.	.	P	Polyproline II helix	trans	-75.4	128.4	177.5	-56.5	175.4	0	0	0	109.3	Q150 P154 R157 Y281 V335	Q150-I152 PolarHBondContact O-N 3.24Å; I152-P154 WeakPolarHBondContact O-CD 3.43Å; I152-R157 HydrophobicContact CG2-CG 3.66Å; I152-Y281 HydrophobicContact CD1-CE2 4.03Å; I152-Y281 WeakPolarHBondContact CD1-OH 3.3Å; I152-V335 HydrophobicContact CD1-CG1 4.24Å; I152-V335 HydrophobicContact CG2-CG1 3.73Å
153	N	94.3	Very high	91.1	Very high	96 Å²	96	73.7 Å²	73.7	51%	0.513	38%	0.379	S	S	.	.	P	Polyproline II helix	trans	-60.5	123.4	175.1	-176.3	-13	0	0	0	110.7	H155 S156 R157	N153-H155 VanDerWaalsContact C-N 3.25Å; N153-H155 PolarHBondContact O-N 2.86Å; N153-H155 PolarHBondContact OD1-N 3.4Å; N153-S156 PolarHBondContact O-N 2.98Å; N153-R157 PolarHBondContact O-N 2.86Å
154	P	93.5	Very high	91.1	Very high	106 Å²	106	70.3 Å²	70.3	69%	0.688	36%	0.361	S	S	*	.	G	3₁₀ helix	trans	-56.3	-33.6	179.4	-27.3	35.5	0	0	0	114.7	I152 S156 R157	I152-P154 WeakPolarHBondContact O-CD 3.43Å; P154-S156 VanDerWaalsContact C-N 3.29Å; P154-S156 PolarHBondContact O-N 3.27Å; P154-R157 PolarHBondContact O-N 2.82Å
155	H	92.8	Very high	91	Very high	155 Å²	155	66.4 Å²	66.4	72%	0.718	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-67.7	-32.1	178.5	-178.1	-75.9	0	0	0	112.2	N153 R157	N153-H155 VanDerWaalsContact C-N 3.25Å; N153-H155 PolarHBondContact O-N 2.86Å; N153-H155 PolarHBondContact OD1-N 3.4Å; H155-R157 VanDerWaalsContact C-N 3.26Å; H155-R157 PolarHBondContact O-N 2.85Å
156	S	91.4	Very high	90.9	Very high	45 Å²	45	64.7 Å²	64.7	32%	0.315	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-85.7	2.7	-179.1	-54.8	0	0	0	0	112.6	N153 P154 V335 E336	N153-S156 PolarHBondContact O-N 2.98Å; P154-S156 VanDerWaalsContact C-N 3.29Å; P154-S156 PolarHBondContact O-N 3.27Å; S156-V335 CarbonylContact O-C 3.53Å; S156-V335 WeakPolarHBondContact O-CA 3.26Å; S156-E336 PolarHBondContact O-N 3.4Å
157	R	93.2	Very high	90.7	Very high	80 Å²	80	62.5 Å²	62.5	30%	0.302	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	133.8	177.6	-74.5	-174.9	176.4	-119.7	2.7	110.5	I152 N153 P154 H155 E330 A332 R334	I152-R157 HydrophobicContact CG2-CG 3.66Å; N153-R157 PolarHBondContact O-N 2.86Å; P154-R157 PolarHBondContact O-N 2.82Å; H155-R157 VanDerWaalsContact C-N 3.26Å; H155-R157 PolarHBondContact O-N 2.85Å; R157-E330 PolarHBondContact NH2-O 2.85Å; R157-A332 PolarHBondContact NH1-O 3.23Å; R157-R334 WeakPolarHBondContact CA-O 3.49Å
158	I	92.7	Very high	90.7	Very high	70 Å²	70	62.4 Å²	62.4	36%	0.359	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	138.5	170.7	-69	178	0	0	0	108.9	R334 E336	I158-R334 HydrophobicContact CB-CB 4.14Å; I158-R334 PolarHBondContact N-O 3.25Å; I158-E336 HydrophobicContact CD1-CB 4.07Å; I158-E336 HydrophobicContact CD1-CG 4.3Å; I158-E336 HydrophobicContact CG1-CB 4.04Å
159	Y	91.8	Very high	90.9	Very high	121 Å²	121	58.8 Å²	58.8	48%	0.475	30%	0.303	S	S	.	.	P	Polyproline II helix	trans	-70.7	130.9	176.8	-170.5	-106.8	0	0	0	111.3	E161 L395 S398	Y159-E161 HydrophobicContact CD1-CG 4.16Å; Y159-E161 PolarHBondContact O-N 3.14Å; Y159-L395 HydrophobicContact CE2-CD2 3.83Å; Y159-L395 VanDerWaalsContact OH-CD2 3.27Å; Y159-L395 WeakPolarHBondContact OH-CD2 3.48Å; Y159-S398 WeakPolarHBondContact CE1-OG 3.35Å; Y159-S398 PolarHBondContact OH-OG 2.82Å
160	P	88.6	Confident	91.1	Very high	14 Å²	14	58 Å²	58	9%	0.091	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-68	123.2	177.9	-25.5	37	0	0	0	113.4	A178 R179 L395	P160-A178 HydrophobicContact CB-CB 3.85Å; P160-R179 WeakPolarHBondContact CB-O 3.4Å; P160-L395 HydrophobicContact CB-CD1 3.97Å; P160-L395 HydrophobicContact CG-CD1 3.91Å
161	E	85.5	Confident	91.2	Very high	104 Å²	104	50.1 Å²	50.1	49%	0.486	26%	0.259	S	S	.	.			trans	-124.7	-20.3	178.7	-62.2	-176.4	172	0	0	113.9	Y159 A399 M404	Y159-E161 HydrophobicContact CD1-CG 4.16Å; Y159-E161 PolarHBondContact O-N 3.14Å; E161-A399 WeakPolarHBondContact O-CA 3.48Å; E161-M404 HydrophobicContact CB-CE 3.69Å; E161-M404 WeakPolarHBondContact O-CE 3.48Å
162	E	86.5	Confident	91.3	Very high	52 Å²	52	43.9 Å²	43.9	24%	0.243	22%	0.218	C	C	.	.	P	Polyproline II helix	trans	-85.5	131.9	-176.8	-70.2	165.4	-137.1	0	0	111.3	A178 R179 R334	E162-A178 CarbonylContact O-C 3.58Å; E162-A178 WeakPolarHBondContact O-CA 3.42Å; E162-R179 HydrophobicContact CB-CB 4.11Å; E162-R179 WeakPolarHBondContact O-CB 3.45Å; E162-R179 PolarHBondContact O-N 2.63Å; E162-R179 IonicContact OE1-NH1 2.88Å; E162-R179 PolarHBondContact OE1-NH1 3.04Å; E162-R179 IonicContact OE2-CZ 3.1Å; E162-R179 IonicContact OE2-NE 2.7Å; E162-R179 IonicContact OE2-NH1 2.66Å; E162-R179 PolarHBondContact OE2-NH1 3.45Å; E162-R334 IonicContact OE1-CZ 2.9Å; E162-R334 IonicContact OE1-NH1 3.59Å; E162-R334 PolarHBondContact OE1-NH1 3.35Å; E162-R334 IonicContact OE1-NH2 2.56Å; E162-R334 PolarHBondContact OE1-NH2 2.9Å; E162-R334 IonicContact OE2-NH1 3.47Å
163	M	88.4	Confident	91.4	Very high	9 Å²	9	42.3 Å²	42.3	4%	0.044	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	135.9	176.6	-175.6	176	166.5	0	0	111.9	D172 V207 A399 T405 V467	M163-D172 HydrophobicContact CE-CB 3.79Å; M163-D172 WeakPolarHBondContact CE-O 3.33Å; M163-V207 HydrophobicContact CB-CG2 4.05Å; M163-V207 HydrophobicContact CG-CG2 4.08Å; M163-V207 HydrophobicContact SD-CG2 4.26Å; M163-A399 HydrophobicContact CB-CB 4.05Å; M163-T405 HydrophobicContact CB-CG2 4.43Å; M163-T405 HydrophobicContact SD-CG2 3.43Å; M163-T405 WeakPolarHBondContact SD-CG2 3.47Å; M163-V467 HydrophobicContact CE-CG1 4.19Å; M163-V467 HydrophobicContact CE-CG2 3.63Å; M163-V467 HydrophobicContact SD-CG2 4.35Å
164	I	88.9	Confident	91.4	Very high	5 Å²	5	38.1 Å²	38.1	3%	0.026	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	126.5	164.1	-65.5	173.1	0	0	0	108	T166 I177 R179 T343	I164-T166 HydrophobicContact CG2-CG2 4.47Å; I164-I177 PolarHBondContact N-O 3.23Å; I164-R179 HydrophobicContact CD1-CB 4.25Å; I164-R179 HydrophobicContact CD1-CG 4.44Å; I164-R179 HydrophobicContact CG1-CB 4.15Å; I164-T343 HydrophobicContact CD1-CG2 3.77Å; I164-T343 WeakPolarHBondContact CD1-OG1 3.43Å
165	Q	89.2	Confident	91.4	Very high	29 Å²	29	33.4 Å²	33.4	14%	0.136	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	119.5	168.8	-177.4	-179.7	-43.7	0	0	108	D172 A204 G205 V207 R465 V467	Q165-D172 WeakPolarHBondContact CG-OD2 3.4Å; Q165-A204 WeakPolarHBondContact O-CA 3.35Å; Q165-G205 PolarHBondContact N-O 2.94Å; Q165-G205 PolarHBondContact O-N 3.02Å; Q165-V207 HydrophobicContact CB-CG2 4Å; Q165-R465 PolarHBondContact NE2-O 2.66Å; Q165-V467 HydrophobicContact CB-CG2 4.24Å; Q165-V467 HydrophobicContact CG-CG2 3.87Å
166	T	89.2	Confident	91.5	Very high	1 Å²	1	26 Å²	26	1%	0.006	12%	0.122	C	C	.	.			trans	-92.5	-14.8	176.9	63.7	0	0	0	0	112.7	I164 I168 I171 D172 I177 I200 Q203	I164-T166 HydrophobicContact CG2-CG2 4.47Å; T166-I168 PolarHBondContact O-N 2.85Å; T166-I168 PolarHBondContact OG1-N 2.92Å; T166-I171 HydrophobicContact CG2-CG2 3.99Å; T166-D172 WeakPolarHBondContact CB-OD1 3.35Å; T166-D172 PolarHBondContact N-OD1 3.05Å; T166-D172 PolarHBondContact N-OD2 2.92Å; T166-D172 PolarHBondContact OG1-OD1 3.39Å; T166-I177 HydrophobicContact CG2-CD1 3.94Å; T166-I200 HydrophobicContact CG2-CG2 4.28Å; T166-Q203 WeakPolarHBondContact O-CB 3.37Å; T166-Q203 PolarHBondContact O-OE1 3.14Å
167	G	89.7	Confident	91.6	Very high	0 Å²	0	24 Å²	24	0%	0	11%	0.108	C	C	.	.	S	Bend	trans	83.2	-7.9	-174.8	0	0	0	0	0	113.1	D172 Q459 N464 R465	G167-D172 PolarHBondContact N-OD2 2.86Å; G167-Q459 PolarHBondContact O-NE2 3.29Å; G167-Q459 PolarHBondContact O-OE1 3.26Å; G167-N464 WeakPolarHBondContact CA-OD1 3.31Å; G167-R465 WeakPolarHBondContact CA-O 3.41Å; G167-R465 PolarHBondContact O-N 2.95Å
168	I	94.4	Very high	91.5	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	9%	0.093	C	C	.	.			trans	-99.3	113.3	-177.5	-64.1	176.3	0	0	0	109.3	T166 P170 I171 D172 I196 Q199 I200 P384 I386	T166-I168 PolarHBondContact O-N 2.85Å; T166-I168 PolarHBondContact OG1-N 2.92Å; I168-P170 HydrophobicContact CG2-CG 3.71Å; I168-I171 HydrophobicContact CB-CB 4.26Å; I168-I171 HydrophobicContact CB-CD1 4.02Å; I168-I171 HydrophobicContact CB-CG1 4.22Å; I168-I171 HydrophobicContact CD1-CD1 3.94Å; I168-I171 HydrophobicContact CG2-CB 4.24Å; I168-I171 HydrophobicContact CG2-CD1 3.87Å; I168-I171 HydrophobicContact CG2-CG1 3.82Å; I168-I171 PolarHBondContact O-N 2.9Å; I168-D172 PolarHBondContact O-N 2.64Å; I168-I196 HydrophobicContact CD1-CG2 4.05Å; I168-Q199 HydrophobicContact CD1-CB 4.39Å; I168-Q199 HydrophobicContact CD1-CG 4.07Å; I168-Q199 HydrophobicContact CG1-CG 4.19Å; I168-I200 HydrophobicContact CD1-CD1 4.38Å; I168-I200 HydrophobicContact CD1-CG1 3.72Å; I168-P384 HydrophobicContact CG2-CG 3.75Å; I168-I386 HydrophobicContact CG2-CD1 4.06Å
169	S	94.1	Very high	91.3	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-52.1	-49.7	-175	-59.3	0	0	0	0	115.2	I171 D172 V173 F456 Q459 R465 S470	S169-I171 PolarHBondContact O-N 3Å; S169-D172 PolarHBondContact O-N 2.99Å; S169-V173 PolarHBondContact O-N 3.01Å; S169-F456 WeakPolarHBondContact CB-O 3.38Å; S169-Q459 VanDerWaalsContact N-OE1 3.15Å; S169-Q459 PolarHBondContact OG-OE1 2.85Å; S169-R465 WeakPolarHBondContact OG-CD 3.43Å; S169-R465 PolarHBondContact OG-NH1 2.87Å; S169-S470 PolarHBondContact OG-OG 3.21Å
170	P	93.9	Very high	91.3	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-68.1	-20.2	179	25.9	-36	0	0	0	114.1	I168 M174 P384 I386 V388 I457	I168-P170 HydrophobicContact CG2-CG 3.71Å; P170-M174 WeakPolarHBondContact O-CB 3.08Å; P170-P384 HydrophobicContact CG-CG 4.37Å; P170-I386 HydrophobicContact CB-CB 4.39Å; P170-I386 HydrophobicContact CB-CG2 4.29Å; P170-I386 HydrophobicContact CG-CB 4.27Å; P170-I386 HydrophobicContact CG-CD1 4Å; P170-V388 HydrophobicContact CB-CG1 4.1Å; P170-I457 HydrophobicContact CG-CG2 4.48Å
171	I	94.4	Very high	91.6	Very high	1 Å²	1	11 Å²	11	1%	0.005	5%	0.052	C	C	.	.	H	α-helix	trans	-83.3	-53	172.9	-61.4	176.2	0	0	0	108.6	T166 I168 S169 V173 N175 S176 I177 I200 I371 I386	T166-I171 HydrophobicContact CG2-CG2 3.99Å; I168-I171 HydrophobicContact CB-CB 4.26Å; I168-I171 HydrophobicContact CB-CD1 4.02Å; I168-I171 HydrophobicContact CB-CG1 4.22Å; I168-I171 HydrophobicContact CD1-CD1 3.94Å; I168-I171 HydrophobicContact CG2-CB 4.24Å; I168-I171 HydrophobicContact CG2-CD1 3.87Å; I168-I171 HydrophobicContact CG2-CG1 3.82Å; I168-I171 PolarHBondContact O-N 2.9Å; S169-I171 PolarHBondContact O-N 3Å; I171-V173 PolarHBondContact O-N 3.27Å; I171-N175 CarbonylContact O-C 3.48Å; I171-N175 WeakPolarHBondContact O-CA 3.43Å; I171-N175 PolarHBondContact O-N 3.31Å; I171-N175 VanDerWaalsContact O-O 3.09Å; I171-S176 WeakPolarHBondContact O-CA 3.45Å; I171-S176 PolarHBondContact O-N 3.45Å; I171-I177 HydrophobicContact CG2-CD1 3.65Å; I171-I177 HydrophobicContact CG2-CG1 3.88Å; I171-I200 HydrophobicContact CD1-CD1 3.94Å; I171-I200 HydrophobicContact CD1-CG1 4.46Å; I171-I371 HydrophobicContact CD1-CD1 3.88Å; I171-I371 HydrophobicContact CG1-CD1 3.98Å; I171-I371 HydrophobicContact CG2-CD1 4.06Å; I171-I386 HydrophobicContact CD1-CD1 3.87Å; I171-I386 HydrophobicContact CG1-CD1 3.74Å
172	D	93.7	Very high	92.1	Very high	0 Å²	0	6.5 Å²	6.5	0%	0	3%	0.031	C	C	.	.	H	α-helix	trans	-65.4	-38.4	-171.9	-72.9	-10.9	0	0	0	113.4	M163 Q165 T166 G167 I168 S169 S176 H409 V467	M163-D172 HydrophobicContact CE-CB 3.79Å; M163-D172 WeakPolarHBondContact CE-O 3.33Å; Q165-D172 WeakPolarHBondContact CG-OD2 3.4Å; T166-D172 WeakPolarHBondContact CB-OD1 3.35Å; T166-D172 PolarHBondContact N-OD1 3.05Å; T166-D172 PolarHBondContact N-OD2 2.92Å; T166-D172 PolarHBondContact OG1-OD1 3.39Å; G167-D172 PolarHBondContact N-OD2 2.86Å; I168-D172 PolarHBondContact O-N 2.64Å; S169-D172 PolarHBondContact O-N 2.99Å; D172-S176 WeakPolarHBondContact O-CB 3.34Å; D172-S176 PolarHBondContact O-OG 3.45Å; D172-H409 PolarHBondContact O-CE1 2.67Å; D172-H409 PolarHBondContact O-NE2 2.9Å; D172-V467 HydrophobicContact CB-CG2 4.24Å
173	V	93.3	Very high	92.6	Very high	0 Å²	0	4 Å²	4	0%	0	2%	0.02	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.9	-38.4	-176.7	176.2	0	0	0	0	113.5	S169 I171 M396 H409 S413 L416 F456 S470 L471	S169-V173 PolarHBondContact O-N 3.01Å; I171-V173 PolarHBondContact O-N 3.27Å; V173-M396 WeakPolarHBondContact O-CE 3.43Å; V173-H409 WeakPolarHBondContact CA-NE2 3.37Å; V173-H409 PolarHBondContact O-NE2 3.22Å; V173-S413 VanDerWaalsContact O-CB 3.27Å; V173-S413 WeakPolarHBondContact O-CB 3.32Å; V173-S413 PolarHBondContact O-OG 3.17Å; V173-L416 HydrophobicContact CG1-CD1 4.45Å; V173-F456 HydrophobicContact CB-CZ 3.81Å; V173-F456 HydrophobicContact CG1-CE2 4.47Å; V173-F456 HydrophobicContact CG1-CZ 3.89Å; V173-F456 HydrophobicContact CG2-CZ 4.24Å; V173-S470 VanDerWaalsContact CG2-CB 3.41Å; V173-L471 HydrophobicContact CG1-CD2 3.93Å; V173-L471 HydrophobicContact CG2-CD2 4.15Å; V173-L471 HydrophobicContact CG2-CG 4.3Å
174	M	93.5	Very high	93	Very high	9 Å²	9	3.6 Å²	3.6	4%	0.044	2%	0.018	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.6	-33.2	-174.2	-52.9	-68.1	-65.5	0	0	112.5	P170 V388 M396 L416 Y417 F456	P170-M174 WeakPolarHBondContact O-CB 3.08Å; M174-V388 HydrophobicContact CB-CG1 4.21Å; M174-V388 HydrophobicContact CE-CB 4.31Å; M174-V388 HydrophobicContact CE-CG2 4.37Å; M174-V388 HydrophobicContact CG-CG1 4.01Å; M174-M396 VanDerWaalsContact O-SD 3.41Å; M174-L416 HydrophobicContact CE-CB 4.15Å; M174-L416 HydrophobicContact SD-CB 3.94Å; M174-L416 HydrophobicContact SD-CD1 4.15Å; M174-Y417 HydrophobicContact CE-CD2 4.24Å; M174-F456 HydrophobicContact CG-CE1 4.01Å; M174-F456 HydrophobicContact CG-CZ 4.4Å; M174-F456 HydrophobicContact SD-CE1 4.42Å
175	N	94.8	Very high	93.4	Very high	7 Å²	7	3.4 Å²	3.4	4%	0.037	2%	0.016	C	C	.	.	S	Bend	trans	-138.5	50.3	-171.5	-65.1	-66.2	0	0	0	111	I171 I177 S391 L392 S393	I171-N175 CarbonylContact O-C 3.48Å; I171-N175 WeakPolarHBondContact O-CA 3.43Å; I171-N175 PolarHBondContact O-N 3.31Å; I171-N175 VanDerWaalsContact O-O 3.09Å; N175-I177 PolarHBondContact O-N 3.32Å; N175-S391 VanDerWaalsContact ND2-CB 3.34Å; N175-S391 WeakPolarHBondContact ND2-CB 3.47Å; N175-S391 PolarHBondContact OD1-O 3.44Å; N175-L392 WeakPolarHBondContact OD1-CA 3.29Å; N175-L392 PolarHBondContact OD1-N 3.38Å; N175-S393 PolarHBondContact OD1-N 3.02Å
176	S	93.2	Very high	93.8	Very high	0 Å²	0	2.2 Å²	2.2	0%	0	1%	0.011	C	C	.	.	P	Polyproline II helix	trans	-53.7	138	-171.8	-40.1	0	0	0	0	111.6	I171 D172 S393 H409	I171-S176 WeakPolarHBondContact O-CA 3.45Å; I171-S176 PolarHBondContact O-N 3.45Å; D172-S176 WeakPolarHBondContact O-CB 3.34Å; D172-S176 PolarHBondContact O-OG 3.45Å; S176-S393 WeakPolarHBondContact O-CB 3.41Å; S176-S393 PolarHBondContact O-OG 3.1Å; S176-H409 PolarHBondContact OG-CE1 2.99Å; S176-H409 PolarHBondContact OG-NE2 3.03Å
177	I	93.8	Very high	94.1	Very high	1 Å²	1	2.1 Å²	2.1	1%	0.005	1%	0.011	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	128.9	-177.1	-55.5	178.9	0	0	0	109.3	I164 T166 I171 N175 Q181 I183 T343 I345 I371	I164-I177 PolarHBondContact N-O 3.23Å; T166-I177 HydrophobicContact CG2-CD1 3.94Å; I171-I177 HydrophobicContact CG2-CD1 3.65Å; I171-I177 HydrophobicContact CG2-CG1 3.88Å; N175-I177 PolarHBondContact O-N 3.32Å; I177-Q181 HydrophobicContact CG2-CB 4.31Å; I177-I183 HydrophobicContact CD1-CG2 3.72Å; I177-I183 HydrophobicContact CG1-CD1 4.15Å; I177-I183 HydrophobicContact CG1-CG2 3.97Å; I177-I183 HydrophobicContact CG2-CG2 3.89Å; I177-T343 HydrophobicContact CG2-CG2 4.24Å; I177-I345 HydrophobicContact CD1-CD1 4.38Å; I177-I371 HydrophobicContact CD1-CD1 4.27Å
178	A	91.9	Very high	94.4	Very high	0 Å²	0	2.2 Å²	2.2	0%	0	1%	0.011	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	150.5	173.1	0	0	0	0	0	111.7	P160 E162 G180 Q181 L395 A399	P160-A178 HydrophobicContact CB-CB 3.85Å; E162-A178 CarbonylContact O-C 3.58Å; E162-A178 WeakPolarHBondContact O-CA 3.42Å; A178-G180 PolarHBondContact O-N 2.9Å; A178-Q181 HydrophobicContact CB-CB 4.25Å; A178-Q181 WeakPolarHBondContact O-CB 3.37Å; A178-Q181 PolarHBondContact O-N 2.95Å; A178-L395 HydrophobicContact CB-CB 4.01Å; A178-L395 HydrophobicContact CB-CD1 4.26Å; A178-A399 HydrophobicContact CB-CB 4.18Å
179	R	89.4	Confident	94.3	Very high	10 Å²	10	5.7 Å²	5.7	4%	0.038	4%	0.04	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	113	177.7	-171.5	-171.7	113.9	-178.9	10.3	110.8	P160 E162 I164 H286 R334 G339 S341	P160-R179 WeakPolarHBondContact CB-O 3.4Å; E162-R179 HydrophobicContact CB-CB 4.11Å; E162-R179 WeakPolarHBondContact O-CB 3.45Å; E162-R179 PolarHBondContact O-N 2.63Å; E162-R179 IonicContact OE1-NH1 2.88Å; E162-R179 PolarHBondContact OE1-NH1 3.04Å; E162-R179 IonicContact OE2-CZ 3.1Å; E162-R179 IonicContact OE2-NE 2.7Å; E162-R179 IonicContact OE2-NH1 2.66Å; E162-R179 PolarHBondContact OE2-NH1 3.45Å; I164-R179 HydrophobicContact CD1-CB 4.25Å; I164-R179 HydrophobicContact CD1-CG 4.44Å; I164-R179 HydrophobicContact CG1-CB 4.15Å; R179-H286 PolarHBondContact NH1-CE1 3.39Å; R179-H286 VanDerWaalsContact NH1-CE1 3.32Å; R179-H286 PolarHBondContact NH1-NE2 2.67Å; R179-H286 PolarHBondContact NH2-CE1 3.16Å; R179-R334 VanDerWaalsContact CZ-CZ 3.47Å; R179-R334 VanDerWaalsContact NH2-NH2 3.2Å; R179-G339 PolarHBondContact NH2-O 3.03Å; R179-S341 WeakPolarHBondContact CD-OG 3.17Å; R179-S341 VanDerWaalsContact CG-OG 3.3Å; R179-S341 WeakPolarHBondContact CG-OG 3.2Å; R179-S341 PolarHBondContact NE-OG 2.73Å
180	G	91.2	Very high	94.1	Very high	3 Å²	3	8.9 Å²	8.9	3%	0.031	7%	0.073	C	C	.	.	T	Hydrogen-bonded Turn	trans	101.2	-0.7	-170.9	0	0	0	0	0	113.9	A178 G333 I342 T343	A178-G180 PolarHBondContact O-N 2.9Å; G180-G333 WeakPolarHBondContact O-CA 3.42Å; G180-G333 PolarHBondContact O-N 2.8Å; G180-I342 WeakPolarHBondContact CA-O 3.43Å; G180-T343 PolarHBondContact N-OG1 3.39Å
181	Q	94.8	Very high	94.1	Very high	0 Å²	0	9.3 Å²	9.3	0%	0	8%	0.075	C	C	.	.			trans	-74.9	151.2	177.3	-170.8	170.8	5	0	0	111.5	I177 A178 I183 T343 Q344 E368 S393 L395	I177-Q181 HydrophobicContact CG2-CB 4.31Å; A178-Q181 HydrophobicContact CB-CB 4.25Å; A178-Q181 WeakPolarHBondContact O-CB 3.37Å; A178-Q181 PolarHBondContact O-N 2.95Å; Q181-I183 HydrophobicContact CG-CB 4.46Å; Q181-T343 WeakPolarHBondContact O-CG2 3.34Å; Q181-Q344 PolarHBondContact O-N 3.37Å; Q181-E368 HydrophobicContact CG-CB 4.29Å; Q181-E368 WeakPolarHBondContact CG-OE2 3.31Å; Q181-E368 PolarHBondContact NE2-O 2.78Å; Q181-S393 PolarHBondContact NE2-OG 3.46Å; Q181-S393 PolarHBondContact OE1-OG 3.41Å; Q181-L395 HydrophobicContact CB-CD1 3.99Å; Q181-L395 HydrophobicContact CG-CD1 3.83Å; Q181-L395 HydrophobicContact CG-CG 4.3Å
182	K	95.8	Very high	94.1	Very high	10 Å²	10	9.8 Å²	9.8	4%	0.043	8%	0.078	C	C	.	.	B	Isolated β-bridge	trans	-107.2	107.4	167.6	49.9	-177.4	-171	-87.5	0	110	Y329 E330 A332 Q344 I366 E368	K182-Y329 WeakPolarHBondContact CD-O 3.48Å; K182-E330 WeakPolarHBondContact CE-OE1 3.3Å; K182-E330 IonicContact NZ-OE1 3.26Å; K182-E330 PolarHBondContact NZ-OE1 2.74Å; K182-E330 IonicContact NZ-OE2 3.45Å; K182-E330 PolarHBondContact NZ-OE2 3.4Å; K182-A332 HydrophobicContact CB-CB 4.12Å; K182-Q344 HydrophobicContact CB-CB 4.37Å; K182-I366 WeakPolarHBondContact CE-O 3.37Å; K182-E368 HydrophobicContact CG-CG 4.15Å; K182-E368 IonicContact NZ-OE1 3.6Å; K182-E368 PolarHBondContact NZ-OE1 3.27Å; K182-E368 PolarHBondContact O-N 2.94Å; K182-E368 VanDerWaalsContact O-N 3.1Å
183	I	96.3	Very high	94.2	Very high	0 Å²	0	10.6 Å²	10.6	0%	0	8%	0.082	C	C	.	.			trans	-132.6	111.8	-176.9	-172.1	168.7	0	0	0	111.4	I177 Q181 Q344 I345 I371	I177-I183 HydrophobicContact CD1-CG2 3.72Å; I177-I183 HydrophobicContact CG1-CD1 4.15Å; I177-I183 HydrophobicContact CG1-CG2 3.97Å; I177-I183 HydrophobicContact CG2-CG2 3.89Å; Q181-I183 HydrophobicContact CG-CB 4.46Å; I183-Q344 PolarHBondContact N-O 2.87Å; I183-I345 HydrophobicContact CG2-CG1 4.29Å; I183-I345 WeakPolarHBondContact O-CA 3.47Å; I183-I371 HydrophobicContact CD1-CD1 4.02Å; I183-I371 HydrophobicContact CD1-CG1 3.87Å; I183-I371 HydrophobicContact CG1-CD1 4.35Å; I183-I371 HydrophobicContact CG1-CG1 4.2Å
184	P	97.5	Very high	94.2	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	9%	0.088	C	C	.	.			trans	-78.4	155.8	-179.3	33.5	-37	0	0	0	112.5	F186 P346 T363 T367 G369 Q370 I371	P184-F186 HydrophobicContact CB-CD1 3.99Å; P184-F186 HydrophobicContact CB-CE1 3.67Å; P184-F186 HydrophobicContact CG-CD1 4.1Å; P184-F186 HydrophobicContact CG-CE1 3.5Å; P184-F186 HydrophobicContact CG-CZ 4.24Å; P184-P346 CarbonylContact C-O 3.45Å; P184-P346 WeakPolarHBondContact CA-O 3.46Å; P184-P346 HydrophobicContact CB-CG 3.96Å; P184-P346 WeakPolarHBondContact CB-O 3.21Å; P184-T363 HydrophobicContact CB-CG2 3.9Å; P184-T363 HydrophobicContact CG-CG2 3.97Å; P184-T367 WeakPolarHBondContact CD-OG1 3.41Å; P184-T367 HydrophobicContact CG-CG2 4.32Å; P184-T367 WeakPolarHBondContact CG-OG1 3.29Å; P184-G369 WeakPolarHBondContact CD-O 3.3Å; P184-G369 WeakPolarHBondContact CG-O 3.36Å; P184-Q370 HydrophobicContact CG-CB 3.9Å; P184-I371 PolarHBondContact O-N 3.49Å
185	I	97.6	Very high	94.1	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	112.7	164.6	-58.1	177.5	0	0	0	108.2	I196 I200 I345 P346 I347 L348 I371 V373	I185-I196 HydrophobicContact CD1-CG2 4.42Å; I185-I200 HydrophobicContact CD1-CD1 3.93Å; I185-I345 HydrophobicContact CD1-CG2 3.7Å; I185-I345 HydrophobicContact CG1-CG2 3.81Å; I185-P346 PolarHBondContact N-O 3.24Å; I185-I347 HydrophobicContact CB-CG1 4.3Å; I185-I347 HydrophobicContact CB-CG2 4.48Å; I185-I347 HydrophobicContact CD1-CG1 4.38Å; I185-L348 PolarHBondContact O-N 3.35Å; I185-I371 CarbonylContact C-O 3.5Å; I185-I371 WeakPolarHBondContact CA-O 3.09Å; I185-I371 HydrophobicContact CG1-CB 4.31Å; I185-I371 HydrophobicContact CG1-CD1 4.42Å; I185-V373 HydrophobicContact CG2-CG2 3.56Å
186	F	97.4	Very high	94	Very high	4 Å²	4	14.4 Å²	14.4	2%	0.018	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	113.7	173.2	-71.2	8.6	0	0	0	108.2	P184 L348 M350 I355 P360 T363 Q370 I371 Y372 V373	P184-F186 HydrophobicContact CB-CD1 3.99Å; P184-F186 HydrophobicContact CB-CE1 3.67Å; P184-F186 HydrophobicContact CG-CD1 4.1Å; P184-F186 HydrophobicContact CG-CE1 3.5Å; P184-F186 HydrophobicContact CG-CZ 4.24Å; F186-L348 HydrophobicContact CB-CD1 4.45Å; F186-L348 HydrophobicContact CD1-CD1 3.74Å; F186-L348 HydrophobicContact CD1-CD2 3.6Å; F186-L348 HydrophobicContact CD1-CG 3.6Å; F186-L348 HydrophobicContact CE1-CD1 4.22Å; F186-L348 HydrophobicContact CE1-CD2 3.39Å; F186-L348 HydrophobicContact CE1-CG 3.98Å; F186-L348 HydrophobicContact CG-CD1 4.11Å; F186-L348 HydrophobicContact CG-CG 4.43Å; F186-L348 HydrophobicContact CZ-CD2 4.32Å; F186-M350 HydrophobicContact CB-CE 4.05Å; F186-M350 HydrophobicContact CB-SD 3.95Å; F186-M350 HydrophobicContact CD2-SD 4.05Å; F186-M350 HydrophobicContact CG-SD 4.26Å; F186-I355 HydrophobicContact CD2-CG1 4.41Å; F186-I355 HydrophobicContact CE2-CG1 4.44Å; F186-P360 HydrophobicContact CD2-CB 3.98Å; F186-P360 HydrophobicContact CE1-CB 4.44Å; F186-P360 HydrophobicContact CE2-CB 3.6Å; F186-P360 HydrophobicContact CZ-CB 3.87Å; F186-P360 WeakPolarHBondContact CZ-O 3.35Å; F186-T363 HydrophobicContact CE1-CG2 3.97Å; F186-T363 HydrophobicContact CZ-CG2 4.41Å; F186-Q370 HydrophobicContact CD1-CB 4.29Å; F186-Q370 HydrophobicContact CD2-CB 4.15Å; F186-Q370 HydrophobicContact CD2-CG 4.15Å; F186-Q370 HydrophobicContact CE1-CB 4.14Å; F186-Q370 HydrophobicContact CE2-CB 4Å; F186-Q370 HydrophobicContact CE2-CG 4.04Å; F186-Q370 HydrophobicContact CG-CB 4.3Å; F186-Q370 HydrophobicContact CZ-CB 4Å; F186-Q370 HydrophobicContact CZ-CG 4.49Å; F186-I371 PolarHBondContact N-O 3.49Å; F186-Y372 HydrophobicContact CB-CD2 4.17Å; F186-Y372 HydrophobicContact CD2-CD2 4.47Å; F186-V373 PolarHBondContact O-N 3.49Å
187	S	96.4	Very high	94	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	-172.6	177.5	-161.1	0	0	0	0	110.8	L191 H193 L348 T349 M350	S187-L191 WeakPolarHBondContact OG-CB 3.44Å; S187-H193 WeakPolarHBondContact OG-CB 3.34Å; S187-H193 PolarHBondContact OG-ND1 3.45Å; S187-L348 PolarHBondContact N-O 2.96Å; S187-T349 CarbonylContact O-C 3.53Å; S187-T349 WeakPolarHBondContact O-CA 3.2Å; S187-M350 WeakPolarHBondContact O-CB 3.23Å; S187-M350 WeakPolarHBondContact O-CE 3.45Å; S187-M350 PolarHBondContact O-N 2.97Å
188	A	94.6	Very high	93.8	Very high	1 Å²	1	14.4 Å²	14.4	1%	0.008	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	166.3	174.8	0	0	0	0	0	111.1	G190 L191 D353	A188-G190 PolarHBondContact O-N 3.23Å; A188-L191 HydrophobicContact CB-CD1 3.79Å; A188-L191 HydrophobicContact CB-CG 4.18Å; A188-L191 WeakPolarHBondContact O-CB 3.3Å; A188-L191 PolarHBondContact O-N 3.37Å; A188-L191 VanDerWaalsContact O-N 3.12Å; A188-D353 WeakPolarHBondContact CB-OD1 3.38Å
189	A	92.2	Very high	93.8	Very high	74 Å²	74	14.4 Å²	14.4	61%	0.612	10%	0.101	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.2	127.8	177.1	0	0	0	0	0	111.2	R375	A189-R375 PolarHBondContact O-NH1 2.74Å; A189-R375 PolarHBondContact O-NH2 2.79Å
190	G	90.4	Very high	93.9	Very high	67 Å²	67	14 Å²	14	69%	0.691	10%	0.099	S	C	*	.	T	Hydrogen-bonded Turn	trans	83.8	2.5	-179.6	0	0	0	0	0	115.7	A188	A188-G190 PolarHBondContact O-N 3.23Å
191	L	94.8	Very high	93.6	Very high	8 Å²	8	14 Å²	14	4%	0.042	10%	0.099	C	C	.	.	S	Bend	trans	-90.4	153.6	173.1	-61.6	-174.9	0	0	0	111.6	S187 A188 H193 V373 R375 H378	S187-L191 WeakPolarHBondContact OG-CB 3.44Å; A188-L191 HydrophobicContact CB-CD1 3.79Å; A188-L191 HydrophobicContact CB-CG 4.18Å; A188-L191 WeakPolarHBondContact O-CB 3.3Å; A188-L191 PolarHBondContact O-N 3.37Å; A188-L191 VanDerWaalsContact O-N 3.12Å; L191-H193 PolarHBondContact O-N 2.85Å; L191-H193 PolarHBondContact O-ND1 2.86Å; L191-V373 HydrophobicContact CB-CG1 4.19Å; L191-V373 HydrophobicContact CD1-CB 4.43Å; L191-V373 HydrophobicContact CD1-CG1 4.07Å; L191-V373 WeakPolarHBondContact CD1-O 3.4Å; L191-R375 HydrophobicContact CD1-CB 4.44Å; L191-R375 HydrophobicContact CD2-CB 4.03Å; L191-R375 HydrophobicContact CD2-CG 4.14Å; L191-H378 HydrophobicContact CD2-CB 3.84Å
192	P	94.6	Very high	93.1	Very high	12 Å²	12	16.1 Å²	16.1	8%	0.078	11%	0.107	C	C	.	.			trans	-82.6	51.3	-172.2	35.3	-38.4	0	0	0	113.2	N194 E195 I196 Y383 P385	P192-N194 VanDerWaalsContact C-N 3.32Å; P192-E195 WeakPolarHBondContact CA-OE2 3.31Å; P192-E195 HydrophobicContact CB-CB 4.37Å; P192-E195 HydrophobicContact CB-CG 4.44Å; P192-E195 VanDerWaalsContact CB-OE2 3.31Å; P192-E195 WeakPolarHBondContact CB-OE2 3.25Å; P192-I196 WeakPolarHBondContact O-CD1 3.28Å; P192-I196 VanDerWaalsContact O-CG1 3.25Å; P192-I196 WeakPolarHBondContact O-CG1 3.47Å; P192-I196 PolarHBondContact O-N 2.92Å; P192-Y383 HydrophobicContact CB-CE2 4.4Å; P192-Y383 HydrophobicContact CG-CD2 4.41Å; P192-P385 HydrophobicContact CG-CG 3.78Å
193	H	94	Very high	92.7	Very high	16 Å²	16	16.4 Å²	16.4	7%	0.074	11%	0.108	C	C	.	.	H	α-helix	trans	-71.2	-28.2	179.1	51.3	-90.5	0	0	0	113	S187 L191 A197 I347	S187-H193 WeakPolarHBondContact OG-CB 3.34Å; S187-H193 PolarHBondContact OG-ND1 3.45Å; L191-H193 PolarHBondContact O-N 2.85Å; L191-H193 PolarHBondContact O-ND1 2.86Å; H193-A197 WeakPolarHBondContact O-CB 3.48Å; H193-A197 PolarHBondContact O-N 3.3Å; H193-I347 HydrophobicContact CB-CG2 4.12Å
194	N	93.1	Very high	91.9	Very high	23 Å²	23	17.1 Å²	17.1	12%	0.123	11%	0.114	C	C	.	.	H	α-helix	trans	-70.2	-39.7	178.9	-65	-45.5	0	0	0	110.9	P192 A197 A198 T234 F237 F238	P192-N194 VanDerWaalsContact C-N 3.32Å; N194-A197 PolarHBondContact O-N 2.89Å; N194-A198 WeakPolarHBondContact O-CB 3.18Å; N194-A198 PolarHBondContact O-N 3.46Å; N194-T234 HydrophobicContact CB-CG2 4.49Å; N194-F237 HydrophobicContact CB-CD1 4.42Å; N194-F237 HydrophobicContact CB-CE1 4.27Å; N194-F238 HydrophobicContact CB-CE2 3.94Å; N194-F238 HydrophobicContact CB-CZ 3.62Å; N194-F238 WeakPolarHBondContact O-CE1 3.29Å
195	E	92.5	Very high	90.9	Very high	74 Å²	74	18 Å²	18	35%	0.346	12%	0.123	S	C	.	.	H	α-helix	trans	-66.6	-41.3	176.8	-63.6	83.6	166.6	0	0	111.1	P192 A198 Q199 F237 Y383	P192-E195 WeakPolarHBondContact CA-OE2 3.31Å; P192-E195 HydrophobicContact CB-CB 4.37Å; P192-E195 HydrophobicContact CB-CG 4.44Å; P192-E195 VanDerWaalsContact CB-OE2 3.31Å; P192-E195 WeakPolarHBondContact CB-OE2 3.25Å; E195-A198 PolarHBondContact O-N 2.88Å; E195-Q199 WeakPolarHBondContact O-CB 3.28Å; E195-Q199 PolarHBondContact O-N 3.42Å; E195-F237 HydrophobicContact CB-CZ 4.45Å; E195-F237 HydrophobicContact CG-CE2 4.47Å; E195-F237 HydrophobicContact CG-CZ 3.95Å; E195-Y383 HydrophobicContact CB-CE2 4.09Å; E195-Y383 PolarHBondContact O-OH 2.98Å
196	I	93.4	Very high	89.6	Confident	0 Å²	0	19.5 Å²	19.5	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-62.7	-45	173.6	-64.3	166.3	0	0	0	110.1	I168 I185 P192 Q199 I200 V373 Y383 P384	I168-I196 HydrophobicContact CD1-CG2 4.05Å; I185-I196 HydrophobicContact CD1-CG2 4.42Å; P192-I196 WeakPolarHBondContact O-CD1 3.28Å; P192-I196 VanDerWaalsContact O-CG1 3.25Å; P192-I196 WeakPolarHBondContact O-CG1 3.47Å; P192-I196 PolarHBondContact O-N 2.92Å; I196-Q199 WeakPolarHBondContact O-CB 3.5Å; I196-Q199 PolarHBondContact O-N 3.21Å; I196-I200 HydrophobicContact CG2-CD1 3.97Å; I196-I200 HydrophobicContact CG2-CG1 4.49Å; I196-I200 WeakPolarHBondContact O-CG1 3.29Å; I196-I200 PolarHBondContact O-N 3.42Å; I196-V373 HydrophobicContact CD1-CG1 4.18Å; I196-V373 HydrophobicContact CD1-CG2 4.03Å; I196-Y383 HydrophobicContact CG1-CE2 4.41Å; I196-P384 HydrophobicContact CD1-CB 3.84Å; I196-P384 HydrophobicContact CG1-CB 3.75Å
197	A	92.1	Very high	87.8	Confident	1 Å²	1	19.8 Å²	19.8	1%	0.008	13%	0.133	C	C	.	.	H	α-helix	trans	-62.9	-43.6	178.8	0	0	0	0	0	112.5	H193 N194 Q199 I200 C201 F238 I347	H193-A197 WeakPolarHBondContact O-CB 3.48Å; H193-A197 PolarHBondContact O-N 3.3Å; N194-A197 PolarHBondContact O-N 2.89Å; A197-Q199 VanDerWaalsContact C-N 3.33Å; A197-I200 PolarHBondContact O-N 3.11Å; A197-C201 PolarHBondContact O-N 3.35Å; A197-F238 HydrophobicContact CB-CE1 4.31Å; A197-F238 HydrophobicContact CB-CZ 4.41Å; A197-I347 HydrophobicContact CB-CD1 3.35Å
198	A	90.5	Very high	86	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-62.3	-42	174.6	0	0	0	0	0	110.9	N194 E195 I200 C201 R202 F237 F238	N194-A198 WeakPolarHBondContact O-CB 3.18Å; N194-A198 PolarHBondContact O-N 3.46Å; E195-A198 PolarHBondContact O-N 2.88Å; A198-I200 PolarHBondContact O-N 3.37Å; A198-C201 WeakPolarHBondContact O-CB 3.48Å; A198-C201 PolarHBondContact O-N 3.04Å; A198-R202 VanDerWaalsContact CB-NH1 3.35Å; A198-R202 WeakPolarHBondContact O-CG 3.29Å; A198-R202 PolarHBondContact O-N 3.41Å; A198-F237 HydrophobicContact CB-CE1 3.81Å; A198-F237 HydrophobicContact CB-CZ 4.03Å; A198-F238 HydrophobicContact CB-CD1 4.3Å; A198-F238 HydrophobicContact CB-CE1 4.05Å
199	Q	91.5	Very high	84.1	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-58.9	-47.5	174	-176.7	175.3	0.2	0	0	112	I168 E195 I196 A197 C201 R202 Q203 Y383 E463	I168-Q199 HydrophobicContact CD1-CB 4.39Å; I168-Q199 HydrophobicContact CD1-CG 4.07Å; I168-Q199 HydrophobicContact CG1-CG 4.19Å; E195-Q199 WeakPolarHBondContact O-CB 3.28Å; E195-Q199 PolarHBondContact O-N 3.42Å; I196-Q199 WeakPolarHBondContact O-CB 3.5Å; I196-Q199 PolarHBondContact O-N 3.21Å; A197-Q199 VanDerWaalsContact C-N 3.33Å; Q199-C201 VanDerWaalsContact C-N 3.34Å; Q199-C201 PolarHBondContact O-N 3.07Å; Q199-R202 VanDerWaalsContact CA-NH2 3.34Å; Q199-R202 PolarHBondContact O-N 3.32Å; Q199-Q203 HydrophobicContact CG-CG 4.38Å; Q199-Q203 VanDerWaalsContact CG-OE1 3.29Å; Q199-Q203 VanDerWaalsContact NE2-OE1 3.09Å; Q199-Q203 WeakPolarHBondContact O-CB 3.04Å; Q199-Q203 WeakPolarHBondContact O-CG 3.48Å; Q199-Q203 PolarHBondContact O-N 3.4Å; Q199-Y383 PolarHBondContact OE1-OH 3.24Å; Q199-E463 PolarHBondContact NE2-O 3.46Å
200	I	90.4	Very high	81.6	Confident	1 Å²	1	33.4 Å²	33.4	1%	0.005	20%	0.196	C	C	.	.	H	α-helix	trans	-59.6	-45.7	176.2	-65.7	166.9	0	0	0	110.1	T166 I168 I171 I185 I196 A197 A198 R202 Q203 A204 L288 I345	T166-I200 HydrophobicContact CG2-CG2 4.28Å; I168-I200 HydrophobicContact CD1-CD1 4.38Å; I168-I200 HydrophobicContact CD1-CG1 3.72Å; I171-I200 HydrophobicContact CD1-CD1 3.94Å; I171-I200 HydrophobicContact CD1-CG1 4.46Å; I185-I200 HydrophobicContact CD1-CD1 3.93Å; I196-I200 HydrophobicContact CG2-CD1 3.97Å; I196-I200 HydrophobicContact CG2-CG1 4.49Å; I196-I200 WeakPolarHBondContact O-CG1 3.29Å; I196-I200 PolarHBondContact O-N 3.42Å; A197-I200 PolarHBondContact O-N 3.11Å; A198-I200 PolarHBondContact O-N 3.37Å; I200-R202 VanDerWaalsContact C-N 3.32Å; I200-R202 PolarHBondContact O-N 2.98Å; I200-Q203 PolarHBondContact O-N 3.08Å; I200-A204 WeakPolarHBondContact O-CA 3.19Å; I200-A204 WeakPolarHBondContact O-CB 3.38Å; I200-A204 PolarHBondContact O-N 2.69Å; I200-L288 HydrophobicContact CG2-CD2 4.36Å; I200-I345 HydrophobicContact CG2-CD1 3.81Å
201	C	86.3	Confident	79.2	Confident	4 Å²	4	38.7 Å²	38.7	3%	0.027	20%	0.2	C	C	.	.	H	α-helix	trans	-58.2	-41.5	176.9	-81	0	0	0	0	113.5	A197 A198 Q199 I223 F242 I290	A197-C201 PolarHBondContact O-N 3.35Å; A198-C201 WeakPolarHBondContact O-CB 3.48Å; A198-C201 PolarHBondContact O-N 3.04Å; Q199-C201 VanDerWaalsContact C-N 3.34Å; Q199-C201 PolarHBondContact O-N 3.07Å; C201-I223 HydrophobicContact CB-CD1 4.09Å; C201-I223 WeakPolarHBondContact O-CD1 3.2Å; C201-F242 HydrophobicContact CB-CE1 3.57Å; C201-F242 HydrophobicContact CB-CZ 4.11Å; C201-I290 WeakPolarHBondContact SG-CD1 3.41Å
202	R	84.6	Confident	76.5	Confident	43 Å²	43	43.2 Å²	43.2	16%	0.162	24%	0.238	C	C	.	.	H	α-helix	trans	-69.9	-36.1	-179.1	-69.9	-176.1	-57.2	-98.1	8.4	112.6	A198 Q199 I200 D241 N245 P461	A198-R202 VanDerWaalsContact CB-NH1 3.35Å; A198-R202 WeakPolarHBondContact O-CG 3.29Å; A198-R202 PolarHBondContact O-N 3.41Å; Q199-R202 VanDerWaalsContact CA-NH2 3.34Å; Q199-R202 PolarHBondContact O-N 3.32Å; I200-R202 VanDerWaalsContact C-N 3.32Å; I200-R202 PolarHBondContact O-N 2.98Å; R202-D241 IonicContact CZ-OD1 3.11Å; R202-D241 IonicContact CZ-OD2 3.64Å; R202-D241 IonicContact NH1-OD1 2.76Å; R202-D241 PolarHBondContact NH1-OD1 2.73Å; R202-D241 IonicContact NH1-OD2 3.4Å; R202-D241 PolarHBondContact NH1-OD2 3.29Å; R202-N245 VanDerWaalsContact CD-CG 3.41Å; R202-N245 WeakPolarHBondContact CD-ND2 3.5Å; R202-N245 HydrophobicContact CG-CB 4.38Å; R202-P461 PolarHBondContact NH2-O 2.89Å
203	Q	85.4	Confident	74.1	Confident	17 Å²	17	46.4 Å²	46.4	8%	0.079	26%	0.258	C	S	.	.	H	α-helix	trans	-105	-12.3	-167.3	-63.4	177.9	-7.1	0	0	113.1	T166 Q199 I200 G205 E463 N464	T166-Q203 WeakPolarHBondContact O-CB 3.37Å; T166-Q203 PolarHBondContact O-OE1 3.14Å; Q199-Q203 HydrophobicContact CG-CG 4.38Å; Q199-Q203 VanDerWaalsContact CG-OE1 3.29Å; Q199-Q203 VanDerWaalsContact NE2-OE1 3.09Å; Q199-Q203 WeakPolarHBondContact O-CB 3.04Å; Q199-Q203 WeakPolarHBondContact O-CG 3.48Å; Q199-Q203 PolarHBondContact O-N 3.4Å; I200-Q203 PolarHBondContact O-N 3.08Å; Q203-G205 PolarHBondContact O-N 2.72Å; Q203-G205 VanDerWaalsContact O-N 3.14Å; Q203-E463 VanDerWaalsContact NE2-C 3.33Å; Q203-E463 PolarHBondContact NE2-O 3.18Å; Q203-E463 PolarHBondContact OE1-O 3.27Å; Q203-N464 HydrophobicContact CG-CB 4.09Å
204	A	81.1	Confident	71.6	Confident	15 Å²	15	54 Å²	54	12%	0.124	30%	0.298	C	S	.	.			trans	-57	118.6	179.6	0	0	0	0	0	110.5	Q165 I200 F221 L288	Q165-A204 WeakPolarHBondContact O-CA 3.35Å; I200-A204 WeakPolarHBondContact O-CA 3.19Å; I200-A204 WeakPolarHBondContact O-CB 3.38Å; I200-A204 PolarHBondContact O-N 2.69Å; A204-F221 HydrophobicContact CB-CE1 3.88Å; A204-F221 HydrophobicContact CB-CZ 3.88Å; A204-L288 HydrophobicContact CB-CD2 3.88Å
205	G	75.1	Confident	69.5	Low	19 Å²	19	58 Å²	58	20%	0.196	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	168	174.5	0	0	0	0	0	110.7	Q165 Q203	Q165-G205 PolarHBondContact N-O 2.94Å; Q165-G205 PolarHBondContact O-N 3.02Å; Q203-G205 PolarHBondContact O-N 2.72Å; Q203-G205 VanDerWaalsContact O-N 3.14Å
206	L	70.5	Confident	67.6	Low	31 Å²	31	57.7 Å²	57.7	16%	0.162	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	145.6	169.2	-74.6	162.7	0	0	0	109.5	K208 Y216	L206-K208 PolarHBondContact O-N 3.01Å; L206-Y216 HydrophobicContact CB-CD1 4.32Å; L206-Y216 HydrophobicContact CB-CE1 4.03Å
207	V	61.2	Low	65.7	Low	9 Å²	9	63.5 Å²	63.5	6%	0.055	34%	0.342	C	S	.	.			trans	-60.1	112.1	170.8	179	0	0	0	0	108.1	M163 Q165 K209 V467	M163-V207 HydrophobicContact CB-CG2 4.05Å; M163-V207 HydrophobicContact CG-CG2 4.08Å; M163-V207 HydrophobicContact SD-CG2 4.26Å; Q165-V207 HydrophobicContact CB-CG2 4Å; V207-K209 PolarHBondContact O-N 3.16Å; V207-V467 HydrophobicContact CG2-CG2 4.12Å
208	K	57.9	Low	64	Low	140 Å²	140	68.3 Å²	68.3	61%	0.609	37%	0.368	S	S	*	.			trans	-65.4	108.2	-178	-66	-170.4	176.9	-166.8	0	109.3	L206 D218	L206-K208 PolarHBondContact O-N 3.01Å; K208-D218 IonicContact NZ-OD2 2.71Å; K208-D218 PolarHBondContact NZ-OD2 3.43Å; K208-D218 VanDerWaalsContact NZ-OD2 3.16Å
209	K	54.2	Low	62.4	Low	81 Å²	81	73.4 Å²	73.4	35%	0.352	40%	0.395	S	S	.	.			trans	-77.5	141	171.3	-67.3	-174.2	-169.7	-167.6	0	109.2	V207 K211 Y216 G403 M404	V207-K209 PolarHBondContact O-N 3.16Å; K209-K211 PolarHBondContact O-N 3.02Å; K209-Y216 VanDerWaalsContact CD-OH 3.28Å; K209-Y216 WeakPolarHBondContact CD-OH 3.3Å; K209-Y216 WeakPolarHBondContact CE-OH 3.44Å; K209-Y216 VanDerWaalsContact CG-OH 3.28Å; K209-Y216 WeakPolarHBondContact CG-OH 3.4Å; K209-G403 WeakPolarHBondContact CE-O 3.09Å; K209-G403 PolarHBondContact NZ-O 3.38Å; K209-M404 PolarHBondContact NZ-SD 3.06Å
210	S	40.9	Very low	61.5	Low	140 Å²	140	76.6 Å²	76.6	98%	0.979	41%	0.412	S	S	*	.	S	Bend	trans	-64.8	-7	176.2	-41.6	0	0	0	0	114.2
211	K	38.8	Very low	61.1	Low	178 Å²	178	78.3 Å²	78.3	77%	0.774	42%	0.419	S	S	*	.	S	Bend	trans	-110.5	111.2	173.4	-95.1	-177.7	173.9	177.9	0	109.5	K209 V213	K209-K211 PolarHBondContact O-N 3.02Å; K211-V213 PolarHBondContact O-N 3.11Å
212	A	38.4	Very low	61.3	Low	103 Å²	103	78.1 Å²	78.1	85%	0.851	42%	0.419	S	S	*	.			trans	-50.3	107.8	171.8	0	0	0	0	0	110.9
213	V	43.2	Very low	61.6	Low	80 Å²	80	76.5 Å²	76.5	49%	0.485	41%	0.413	S	S	.	.			trans	-97.6	142.3	157.2	-174	0	0	0	0	105.9	K211 D215 Y216	K211-V213 PolarHBondContact O-N 3.11Å; V213-D215 PolarHBondContact O-N 2.87Å; V213-Y216 HydrophobicContact CB-CD2 3.77Å; V213-Y216 HydrophobicContact CB-CE2 3.75Å; V213-Y216 HydrophobicContact CG2-CD2 4.46Å; V213-Y216 HydrophobicContact CG2-CE2 4.01Å; V213-Y216 WeakPolarHBondContact O-CD2 3.44Å; V213-Y216 PolarHBondContact O-N 3.48Å
214	L	43.2	Very low	62.1	Low	174 Å²	174	75.7 Å²	75.7	91%	0.911	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-10.6	-175.7	-87.1	92.6	0	0	0	114.5
215	D	47.3	Very low	62.7	Low	107 Å²	107	75 Å²	75	57%	0.572	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	1.1	179.7	-67.2	-23.2	0	0	0	114.6	V213 H217	V213-D215 PolarHBondContact O-N 2.87Å; D215-H217 VanDerWaalsContact C-N 3.33Å; D215-H217 PolarHBondContact O-N 2.95Å
216	Y	52.6	Low	63.8	Low	68 Å²	68	74 Å²	74	27%	0.267	39%	0.394	S	S	.	.			trans	-90.4	30.9	-176.9	-77.5	-82.4	0	0	0	114.3	L206 K209 V213 D218	L206-Y216 HydrophobicContact CB-CD1 4.32Å; L206-Y216 HydrophobicContact CB-CE1 4.03Å; K209-Y216 VanDerWaalsContact CD-OH 3.28Å; K209-Y216 WeakPolarHBondContact CD-OH 3.3Å; K209-Y216 WeakPolarHBondContact CE-OH 3.44Å; K209-Y216 VanDerWaalsContact CG-OH 3.28Å; K209-Y216 WeakPolarHBondContact CG-OH 3.4Å; V213-Y216 HydrophobicContact CB-CD2 3.77Å; V213-Y216 HydrophobicContact CB-CE2 3.75Å; V213-Y216 HydrophobicContact CG2-CD2 4.46Å; V213-Y216 HydrophobicContact CG2-CE2 4.01Å; V213-Y216 WeakPolarHBondContact O-CD2 3.44Å; V213-Y216 PolarHBondContact O-N 3.48Å; Y216-D218 PolarHBondContact O-N 3.06Å
217	H	54.6	Low	64.9	Low	123 Å²	123	72.6 Å²	72.6	57%	0.569	39%	0.386	S	S	*	.			trans	-75.4	117	168.6	-116.6	-87	0	0	0	108.9	D215 D219 N220	D215-H217 VanDerWaalsContact C-N 3.33Å; D215-H217 PolarHBondContact O-N 2.95Å; H217-D219 IonicContact CE1-OD2 3.52Å; H217-D219 PolarHBondContact CE1-OD2 3.24Å; H217-D219 IonicContact ND1-OD2 3.55Å; H217-D219 PolarHBondContact ND1-OD2 3.26Å; H217-D219 PolarHBondContact O-N 3.02Å; H217-N220 PolarHBondContact O-N 3.41Å
218	D	56.3	Low	66.5	Low	101 Å²	101	72.1 Å²	72.1	54%	0.54	38%	0.383	S	S	.	.	G	3₁₀ helix	trans	-55.4	-20.2	174.2	-73.8	-26.3	0	0	0	111	K208 Y216 N220 F221	K208-D218 IonicContact NZ-OD2 2.71Å; K208-D218 PolarHBondContact NZ-OD2 3.43Å; K208-D218 VanDerWaalsContact NZ-OD2 3.16Å; Y216-D218 PolarHBondContact O-N 3.06Å; D218-N220 VanDerWaalsContact C-N 3.31Å; D218-N220 PolarHBondContact O-N 2.98Å; D218-F221 PolarHBondContact O-N 2.87Å
219	D	56.9	Low	68.2	Low	108 Å²	108	66 Å²	66	58%	0.578	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-71.5	-15	177.3	-58.5	-41.5	0	0	0	115	H217 F221	H217-D219 IonicContact CE1-OD2 3.52Å; H217-D219 PolarHBondContact CE1-OD2 3.24Å; H217-D219 IonicContact ND1-OD2 3.55Å; H217-D219 PolarHBondContact ND1-OD2 3.26Å; H217-D219 PolarHBondContact O-N 3.02Å; D219-F221 VanDerWaalsContact C-N 3.3Å
220	N	71.9	Confident	70.1	Confident	67 Å²	67	62.7 Å²	62.7	36%	0.358	35%	0.347	S	S	.	.	G	3₁₀ helix	trans	-86.7	2	178.2	-84.2	-1.9	0	0	0	113.5	H217 D218 H286	H217-N220 PolarHBondContact O-N 3.41Å; D218-N220 VanDerWaalsContact C-N 3.31Å; D218-N220 PolarHBondContact O-N 2.98Å; N220-H286 PolarHBondContact O-N 2.94Å
221	F	83.8	Confident	72.5	Confident	36 Å²	36	61 Å²	61	16%	0.158	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	123	177.4	-157.9	-98.5	0	0	0	111	A204 D218 D219 I223 N250 H286 L288	A204-F221 HydrophobicContact CB-CE1 3.88Å; A204-F221 HydrophobicContact CB-CZ 3.88Å; D218-F221 PolarHBondContact O-N 2.87Å; D219-F221 VanDerWaalsContact C-N 3.3Å; F221-I223 HydrophobicContact CD1-CG1 4.2Å; F221-I223 HydrophobicContact CE1-CD1 4.48Å; F221-I223 HydrophobicContact CE1-CG1 4Å; F221-N250 PolarHBondContact O-ND2 3Å; F221-H286 WeakPolarHBondContact CA-O 3.33Å; F221-H286 HydrophobicContact CD2-CB 3.91Å; F221-H286 HydrophobicContact CE2-CB 4.45Å; F221-L288 HydrophobicContact CE1-CB 3.81Å; F221-L288 HydrophobicContact CE1-CD2 4.19Å; F221-L288 HydrophobicContact CZ-CB 3.58Å; F221-L288 HydrophobicContact CZ-CD2 4.13Å; F221-L288 HydrophobicContact CZ-CG 4.42Å
222	A	89.2	Confident	75	Confident	1 Å²	1	56.8 Å²	56.8	1%	0.008	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	145.8	177.8	0	0	0	0	0	110.4	L122 N250 H286 V287 L288	L122-A222 HydrophobicContact CD2-CB 4.03Å; A222-N250 WeakPolarHBondContact CA-O 3.4Å; A222-H286 PolarHBondContact N-O 2.76Å; A222-V287 HydrophobicContact CB-CG2 4.42Å; A222-V287 CarbonylContact O-C 3.43Å; A222-V287 VanDerWaalsContact O-CA 3.29Å; A222-V287 WeakPolarHBondContact O-CA 3.5Å; A222-L288 PolarHBondContact O-N 3.21Å
223	I	91.4	Very high	77.5	Confident	8 Å²	8	59.5 Å²	59.5	4%	0.041	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	127.2	179.4	-59.6	171.7	0	0	0	108.1	C201 F221 N250 V251 C252 L288	C201-I223 HydrophobicContact CB-CD1 4.09Å; C201-I223 WeakPolarHBondContact O-CD1 3.2Å; F221-I223 HydrophobicContact CD1-CG1 4.2Å; F221-I223 HydrophobicContact CE1-CD1 4.48Å; F221-I223 HydrophobicContact CE1-CG1 4Å; I223-N250 PolarHBondContact N-O 2.97Å; I223-V251 HydrophobicContact CB-CG1 4.4Å; I223-V251 HydrophobicContact CB-CG2 4.01Å; I223-V251 HydrophobicContact CD1-CG2 4.25Å; I223-V251 HydrophobicContact CG2-CG1 4.36Å; I223-V251 CarbonylContact O-C 3.56Å; I223-V251 VanDerWaalsContact O-CA 3.3Å; I223-V251 WeakPolarHBondContact O-CA 3.05Å; I223-C252 PolarHBondContact O-N 3.12Å; I223-L288 WeakPolarHBondContact CA-O 3.4Å
224	V	95.3	Very high	79.7	Confident	0 Å²	0	57 Å²	57	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	115.6	170.3	-179	0	0	0	0	107.7	C252 F254 A272 A276 L279 V287 L288 V289 I290	V224-C252 HydrophobicContact CG2-CB 4.42Å; V224-F254 HydrophobicContact CG1-CD2 4.2Å; V224-F254 HydrophobicContact CG1-CE2 4.08Å; V224-A272 HydrophobicContact CG1-CB 3.9Å; V224-A276 HydrophobicContact CB-CB 4.48Å; V224-A276 HydrophobicContact CG2-CB 4.16Å; V224-L279 HydrophobicContact CG2-CD1 4.09Å; V224-V287 HydrophobicContact CB-CG1 4.28Å; V224-V287 HydrophobicContact CG2-CG1 3.68Å; V224-L288 PolarHBondContact N-O 3.13Å; V224-V289 HydrophobicContact CB-CG2 4.39Å; V224-V289 VanDerWaalsContact O-CA 3.29Å; V224-V289 WeakPolarHBondContact O-CA 3.47Å; V224-I290 PolarHBondContact O-N 3.41Å
225	F	94.9	Very high	81.9	Confident	0 Å²	0	49 Å²	49	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	125.3	-177	-172.8	-85.8	0	0	0	109.7	A227 F238 F242 C252 L253 F254 L255 I290 T292	F225-A227 HydrophobicContact CD1-CB 4.47Å; F225-A227 HydrophobicContact CE1-CB 3.88Å; F225-F238 HydrophobicContact CE1-CB 4.42Å; F225-F238 HydrophobicContact CE1-CD1 4.45Å; F225-F238 AromaticContact CE1-CD2 3.95Å; F225-F238 HydrophobicContact CE1-CD2 3.95Å; F225-F238 HydrophobicContact CE1-CE2 4.31Å; F225-F238 HydrophobicContact CE1-CG 4.03Å; F225-F238 AromaticContact CE2-CD1 3.84Å; F225-F238 HydrophobicContact CE2-CD1 3.84Å; F225-F238 HydrophobicContact CE2-CD2 4.48Å; F225-F238 AromaticContact CE2-CE1 3.69Å; F225-F238 HydrophobicContact CE2-CE1 3.69Å; F225-F238 HydrophobicContact CE2-CE2 4.36Å; F225-F238 HydrophobicContact CE2-CG 4.24Å; F225-F238 AromaticContact CE2-CZ 3.96Å; F225-F238 HydrophobicContact CE2-CZ 3.96Å; F225-F238 HydrophobicContact CZ-CB 4.44Å; F225-F238 AromaticContact CZ-CD1 3.68Å; F225-F238 HydrophobicContact CZ-CD1 3.68Å; F225-F238 AromaticContact CZ-CD2 3.54Å; F225-F238 HydrophobicContact CZ-CD2 3.54Å; F225-F238 AromaticContact CZ-CE1 3.66Å; F225-F238 HydrophobicContact CZ-CE1 3.66Å; F225-F238 AromaticContact CZ-CE2 3.53Å; F225-F238 HydrophobicContact CZ-CE2 3.53Å; F225-F238 AromaticContact CZ-CG 3.62Å; F225-F238 HydrophobicContact CZ-CG 3.62Å; F225-F238 AromaticContact CZ-CZ 3.58Å; F225-F238 HydrophobicContact CZ-CZ 3.58Å; F225-F242 HydrophobicContact CD2-CE2 4.24Å; F225-F242 HydrophobicContact CD2-CZ 4.18Å; F225-F242 HydrophobicContact CG-CE2 4.26Å; F225-C252 PolarHBondContact N-O 3.28Å; F225-L253 HydrophobicContact CB-CD2 3.7Å; F225-L253 HydrophobicContact CD1-CD2 3.57Å; F225-L253 HydrophobicContact CE1-CD2 4.48Å; F225-L253 HydrophobicContact CG-CD2 3.86Å; F225-L253 CarbonylContact O-C 3.57Å; F225-F254 PolarHBondContact O-N 3Å; F225-L255 HydrophobicContact CD1-CD2 4.47Å; F225-L255 HydrophobicContact CE1-CD2 4.48Å; F225-I290 HydrophobicContact CD2-CB 3.8Å; F225-I290 HydrophobicContact CD2-CG2 3.95Å; F225-I290 HydrophobicContact CE2-CB 4.13Å; F225-I290 HydrophobicContact CE2-CG2 3.74Å; F225-T292 HydrophobicContact CE1-CG2 3.96Å; F225-T292 HydrophobicContact CE2-CG2 4.24Å; F225-T292 HydrophobicContact CZ-CG2 3.49Å; F225-T292 VanDerWaalsContact CZ-CG2 3.49Å
226	A	96.4	Very high	84	Confident	0 Å²	0	52 Å²	52	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	117	177.4	0	0	0	0	0	110.2	F254 T268 A272 I290 L291 T292	A226-F254 CarbonylContact C-O 3.48Å; A226-F254 WeakPolarHBondContact CA-O 3.43Å; A226-F254 HydrophobicContact CB-CB 4.43Å; A226-T268 HydrophobicContact CB-CG2 4.25Å; A226-A272 HydrophobicContact CB-CB 3.64Å; A226-I290 PolarHBondContact N-O 3.26Å; A226-L291 HydrophobicContact CB-CD2 3.61Å; A226-T292 PolarHBondContact O-N 2.84Å; A226-T292 VanDerWaalsContact O-O 3.06Å
227	A	94.8	Very high	85.9	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	130.1	175.3	0	0	0	0	0	110.1	F225 V230 F254 L255 N256 T292	F225-A227 HydrophobicContact CD1-CB 4.47Å; F225-A227 HydrophobicContact CE1-CB 3.88Å; A227-V230 HydrophobicContact CB-CB 4.41Å; A227-V230 HydrophobicContact CB-CG1 3.93Å; A227-V230 HydrophobicContact CB-CG2 3.59Å; A227-F254 PolarHBondContact N-O 3.44Å; A227-L255 HydrophobicContact CB-CD2 3.59Å; A227-N256 WeakPolarHBondContact O-CB 3.45Å; A227-N256 PolarHBondContact O-N 3.01Å; A227-T292 CarbonylContact C-O 3.42Å; A227-T292 VanDerWaalsContact C-O 3.25Å; A227-T292 WeakPolarHBondContact CA-O 3.43Å; A227-T292 HydrophobicContact CB-CG2 4.35Å
228	M	95.5	Very high	87.6	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	116.4	-174.4	-63.9	166.4	-71.4	0	0	108.7	V230 R265 T268 P269 L291 T292 D293 M294 S296 Y297	M228-V230 PolarHBondContact O-N 3.43Å; M228-R265 HydrophobicContact CB-CB 4.4Å; M228-R265 HydrophobicContact CB-CG 4.38Å; M228-T268 HydrophobicContact CG-CG2 3.77Å; M228-P269 HydrophobicContact SD-CB 4.06Å; M228-P269 HydrophobicContact SD-CG 3.84Å; M228-L291 HydrophobicContact CE-CB 4.13Å; M228-T292 PolarHBondContact N-O 2.88Å; M228-D293 PolarHBondContact O-N 2.98Å; M228-M294 HydrophobicContact CE-SD 3.83Å; M228-S296 WeakPolarHBondContact O-CB 3.34Å; M228-Y297 HydrophobicContact SD-CD2 4.16Å
229	G	93	Very high	89.1	Confident	12 Å²	12	44.7 Å²	44.7	12%	0.124	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	64.8	23.2	179.1	0	0	0	0	0	114.5	N256	G229-N256 PolarHBondContact N-O 3.21Å; G229-N256 PolarHBondContact N-OD1 3.47Å
230	V	92.6	Very high	90.7	Very high	11 Å²	11	41.7 Å²	41.7	7%	0.067	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	151.7	-177.5	-63.1	0	0	0	0	112.1	A227 M228 T234 A235 N256 L257 A258 T292	A227-V230 HydrophobicContact CB-CB 4.41Å; A227-V230 HydrophobicContact CB-CG1 3.93Å; A227-V230 HydrophobicContact CB-CG2 3.59Å; M228-V230 PolarHBondContact O-N 3.43Å; V230-T234 HydrophobicContact CB-CG2 4.28Å; V230-T234 HydrophobicContact CG1-CG2 4.42Å; V230-A235 HydrophobicContact CG2-CB 4.15Å; V230-N256 PolarHBondContact N-O 3.41Å; V230-L257 HydrophobicContact CG2-CD2 4.45Å; V230-L257 CarbonylContact O-C 3.55Å; V230-L257 WeakPolarHBondContact O-CA 3.47Å; V230-A258 PolarHBondContact O-N 3Å; V230-T292 HydrophobicContact CG1-CG2 4.45Å
231	N	92.6	Very high	91.5	Very high	105 Å²	105	38.7 Å²	38.7	56%	0.561	19%	0.188	S	C	*	.			trans	-68.1	154.5	173.6	-69.7	-20.9	0	0	0	111.1	E233 T234 A235	N231-E233 PolarHBondContact O-N 3.48Å; N231-T234 PolarHBondContact O-N 3.39Å; N231-T234 VanDerWaalsContact O-N 3.14Å; N231-A235 PolarHBondContact O-N 2.91Å
232	M	90.1	Very high	91.6	Very high	89 Å²	89	37 Å²	37	44%	0.438	18%	0.18	S	C	.	.	H	α-helix	trans	-57.5	-34.9	176.8	-175.7	64.1	68.5	0	0	112.5	R236 L257	M232-R236 WeakPolarHBondContact O-CB 3.43Å; M232-R236 VanDerWaalsContact O-CG 3.26Å; M232-R236 WeakPolarHBondContact O-CG 3.39Å; M232-R236 PolarHBondContact O-N 3.31Å; M232-L257 HydrophobicContact CE-CD1 3.51Å; M232-L257 HydrophobicContact CE-CD2 4.44Å; M232-L257 HydrophobicContact SD-CD1 4.35Å; M232-L257 HydrophobicContact SD-CD2 4.45Å
233	E	91.1	Very high	91.4	Very high	160 Å²	160	42 Å²	42	75%	0.748	20%	0.204	S	C	*	.	H	α-helix	trans	-64.7	-47.4	176.4	-175.9	172	-165.5	0	0	111.7	N231 A235 R236 F237	N231-E233 PolarHBondContact O-N 3.48Å; E233-A235 PolarHBondContact O-N 2.78Å; E233-R236 PolarHBondContact O-N 3.01Å; E233-F237 WeakPolarHBondContact O-CB 3.22Å; E233-F237 PolarHBondContact O-N 3.36Å
234	T	90.2	Very high	91.1	Very high	26 Å²	26	48.6 Å²	48.6	16%	0.16	23%	0.234	C	C	.	.	H	α-helix	trans	-61.2	-44.4	175.9	-52.1	0	0	0	0	111.7	N194 V230 N231 R236 F237 F238	N194-T234 HydrophobicContact CB-CG2 4.49Å; V230-T234 HydrophobicContact CB-CG2 4.28Å; V230-T234 HydrophobicContact CG1-CG2 4.42Å; N231-T234 PolarHBondContact O-N 3.39Å; N231-T234 VanDerWaalsContact O-N 3.14Å; T234-R236 VanDerWaalsContact C-N 3.33Å; T234-R236 PolarHBondContact O-N 3.01Å; T234-F237 WeakPolarHBondContact O-CB 3.44Å; T234-F237 PolarHBondContact O-N 3.23Å; T234-F238 HydrophobicContact CG2-CD2 3.89Å; T234-F238 HydrophobicContact CG2-CE2 3.55Å; T234-F238 WeakPolarHBondContact O-CD2 3.3Å; T234-F238 PolarHBondContact O-N 2.89Å; T234-F238 VanDerWaalsContact O-N 3.1Å
235	A	89.9	Confident	90.2	Very high	6 Å²	6	51.8 Å²	51.8	5%	0.05	25%	0.251	C	S	.	.	H	α-helix	trans	-62.4	-40.6	176.8	0	0	0	0	0	112.1	V230 N231 E233 K239 L257	V230-A235 HydrophobicContact CG2-CB 4.15Å; N231-A235 PolarHBondContact O-N 2.91Å; E233-A235 PolarHBondContact O-N 2.78Å; A235-K239 WeakPolarHBondContact O-CB 3.32Å; A235-K239 PolarHBondContact O-N 3.4Å; A235-K239 VanDerWaalsContact O-N 3.1Å; A235-L257 HydrophobicContact CB-CD2 3.52Å
236	R	91.3	Very high	89	Confident	170 Å²	170	54.9 Å²	54.9	64%	0.642	28%	0.283	S	S	*	.	H	α-helix	trans	-65.8	-41.8	174.2	-76.3	176.3	-174.5	175.6	2.3	112	M232 E233 T234 K239 S240	M232-R236 WeakPolarHBondContact O-CB 3.43Å; M232-R236 VanDerWaalsContact O-CG 3.26Å; M232-R236 WeakPolarHBondContact O-CG 3.39Å; M232-R236 PolarHBondContact O-N 3.31Å; E233-R236 PolarHBondContact O-N 3.01Å; T234-R236 VanDerWaalsContact C-N 3.33Å; T234-R236 PolarHBondContact O-N 3.01Å; R236-K239 PolarHBondContact O-N 2.84Å; R236-S240 WeakPolarHBondContact O-CB 3.05Å; R236-S240 PolarHBondContact O-N 3.17Å; R236-S240 PolarHBondContact O-OG 2.94Å
237	F	92	Very high	87.9	Confident	60 Å²	60	56.9 Å²	56.9	26%	0.263	30%	0.296	S	S	.	.	H	α-helix	trans	-54.7	-56.3	177.3	168.8	-100.8	0	0	0	110.7	N194 E195 A198 E233 T234 K239 S240 D241	N194-F237 HydrophobicContact CB-CD1 4.42Å; N194-F237 HydrophobicContact CB-CE1 4.27Å; E195-F237 HydrophobicContact CB-CZ 4.45Å; E195-F237 HydrophobicContact CG-CE2 4.47Å; E195-F237 HydrophobicContact CG-CZ 3.95Å; A198-F237 HydrophobicContact CB-CE1 3.81Å; A198-F237 HydrophobicContact CB-CZ 4.03Å; E233-F237 WeakPolarHBondContact O-CB 3.22Å; E233-F237 PolarHBondContact O-N 3.36Å; T234-F237 WeakPolarHBondContact O-CB 3.44Å; T234-F237 PolarHBondContact O-N 3.23Å; F237-K239 PolarHBondContact O-N 3.32Å; F237-S240 PolarHBondContact O-N 2.71Å; F237-S240 PolarHBondContact O-OG 3.32Å; F237-D241 WeakPolarHBondContact O-CB 3.07Å; F237-D241 PolarHBondContact O-N 2.97Å
238	F	89.9	Confident	87.2	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-60.4	-44.1	178.8	-75.5	-65	0	0	0	112.7	N194 A197 A198 F225 T234 S240 D241 F242	N194-F238 HydrophobicContact CB-CE2 3.94Å; N194-F238 HydrophobicContact CB-CZ 3.62Å; N194-F238 WeakPolarHBondContact O-CE1 3.29Å; A197-F238 HydrophobicContact CB-CE1 4.31Å; A197-F238 HydrophobicContact CB-CZ 4.41Å; A198-F238 HydrophobicContact CB-CD1 4.3Å; A198-F238 HydrophobicContact CB-CE1 4.05Å; F225-F238 HydrophobicContact CE1-CB 4.42Å; F225-F238 HydrophobicContact CE1-CD1 4.45Å; F225-F238 AromaticContact CE1-CD2 3.95Å; F225-F238 HydrophobicContact CE1-CD2 3.95Å; F225-F238 HydrophobicContact CE1-CE2 4.31Å; F225-F238 HydrophobicContact CE1-CG 4.03Å; F225-F238 AromaticContact CE2-CD1 3.84Å; F225-F238 HydrophobicContact CE2-CD1 3.84Å; F225-F238 HydrophobicContact CE2-CD2 4.48Å; F225-F238 AromaticContact CE2-CE1 3.69Å; F225-F238 HydrophobicContact CE2-CE1 3.69Å; F225-F238 HydrophobicContact CE2-CE2 4.36Å; F225-F238 HydrophobicContact CE2-CG 4.24Å; F225-F238 AromaticContact CE2-CZ 3.96Å; F225-F238 HydrophobicContact CE2-CZ 3.96Å; F225-F238 HydrophobicContact CZ-CB 4.44Å; F225-F238 AromaticContact CZ-CD1 3.68Å; F225-F238 HydrophobicContact CZ-CD1 3.68Å; F225-F238 AromaticContact CZ-CD2 3.54Å; F225-F238 HydrophobicContact CZ-CD2 3.54Å; F225-F238 AromaticContact CZ-CE1 3.66Å; F225-F238 HydrophobicContact CZ-CE1 3.66Å; F225-F238 AromaticContact CZ-CE2 3.53Å; F225-F238 HydrophobicContact CZ-CE2 3.53Å; F225-F238 AromaticContact CZ-CG 3.62Å; F225-F238 HydrophobicContact CZ-CG 3.62Å; F225-F238 AromaticContact CZ-CZ 3.58Å; F225-F238 HydrophobicContact CZ-CZ 3.58Å; T234-F238 HydrophobicContact CG2-CD2 3.89Å; T234-F238 HydrophobicContact CG2-CE2 3.55Å; T234-F238 WeakPolarHBondContact O-CD2 3.3Å; T234-F238 PolarHBondContact O-N 2.89Å; T234-F238 VanDerWaalsContact O-N 3.1Å; F238-S240 PolarHBondContact O-N 3.45Å; F238-D241 PolarHBondContact O-N 3.33Å; F238-F242 HydrophobicContact CB-CD2 4.4Å; F238-F242 HydrophobicContact CB-CE2 3.96Å; F238-F242 HydrophobicContact CD1-CE2 4.12Å; F238-F242 HydrophobicContact CD1-CZ 4.07Å; F238-F242 HydrophobicContact CG-CE2 4.46Å; F238-F242 WeakPolarHBondContact O-CD2 3.19Å; F238-F242 WeakPolarHBondContact O-CG 3.35Å; F238-F242 PolarHBondContact O-N 2.81Å
239	K	88.5	Confident	86.6	Confident	79 Å²	79	60.9 Å²	60.9	34%	0.343	33%	0.327	S	S	.	.	H	α-helix	trans	-60.6	-48.3	178.1	-178	171.5	177.5	172.8	0	111.9	A235 R236 F237 D241 F242 E243	A235-K239 WeakPolarHBondContact O-CB 3.32Å; A235-K239 PolarHBondContact O-N 3.4Å; A235-K239 VanDerWaalsContact O-N 3.1Å; R236-K239 PolarHBondContact O-N 2.84Å; F237-K239 PolarHBondContact O-N 3.32Å; K239-D241 VanDerWaalsContact C-N 3.31Å; K239-D241 PolarHBondContact O-N 2.77Å; K239-F242 PolarHBondContact O-N 2.72Å; K239-E243 WeakPolarHBondContact CE-OE1 3.04Å; K239-E243 IonicContact NZ-OE1 2.97Å; K239-E243 WeakPolarHBondContact O-CB 3.47Å; K239-E243 VanDerWaalsContact O-CG 3.29Å; K239-E243 WeakPolarHBondContact O-CG 3.34Å; K239-E243 PolarHBondContact O-N 3.44Å
240	S	89.9	Confident	86.3	Confident	46 Å²	46	63.5 Å²	63.5	32%	0.322	34%	0.339	S	S	.	.	H	α-helix	trans	-65.3	-36.3	179.5	63.8	0	0	0	0	112.4	R236 F237 F238 Q244	R236-S240 WeakPolarHBondContact O-CB 3.05Å; R236-S240 PolarHBondContact O-N 3.17Å; R236-S240 PolarHBondContact O-OG 2.94Å; F237-S240 PolarHBondContact O-N 2.71Å; F237-S240 PolarHBondContact O-OG 3.32Å; F238-S240 PolarHBondContact O-N 3.45Å; S240-Q244 WeakPolarHBondContact O-CB 3.38Å; S240-Q244 WeakPolarHBondContact O-CG 3.38Å; S240-Q244 PolarHBondContact O-N 2.82Å
241	D	88.8	Confident	86.2	Confident	4 Å²	4	63 Å²	63	2%	0.021	34%	0.336	C	S	.	.	H	α-helix	trans	-66.1	-49.1	177.4	-169	69	0	0	0	110.5	R202 F237 F238 K239 E243 Q244 N245	R202-D241 IonicContact CZ-OD1 3.11Å; R202-D241 IonicContact CZ-OD2 3.64Å; R202-D241 IonicContact NH1-OD1 2.76Å; R202-D241 PolarHBondContact NH1-OD1 2.73Å; R202-D241 IonicContact NH1-OD2 3.4Å; R202-D241 PolarHBondContact NH1-OD2 3.29Å; F237-D241 WeakPolarHBondContact O-CB 3.07Å; F237-D241 PolarHBondContact O-N 2.97Å; F238-D241 PolarHBondContact O-N 3.33Å; K239-D241 VanDerWaalsContact C-N 3.31Å; K239-D241 PolarHBondContact O-N 2.77Å; D241-E243 VanDerWaalsContact C-N 3.31Å; D241-E243 PolarHBondContact O-N 2.81Å; D241-Q244 PolarHBondContact O-N 3.37Å; D241-N245 VanDerWaalsContact CG-ND2 3.32Å; D241-N245 PolarHBondContact O-N 3.4Å; D241-N245 VanDerWaalsContact O-N 3.09Å; D241-N245 PolarHBondContact O-ND2 3.46Å; D241-N245 PolarHBondContact OD1-ND2 3.28Å; D241-N245 VanDerWaalsContact OD1-ND2 3.16Å; D241-N245 PolarHBondContact OD2-ND2 3.15Å
242	F	85.8	Confident	86.2	Confident	0 Å²	0	58 Å²	58	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-65.8	-32	178.6	-60.9	-41.6	0	0	0	113.5	C201 F225 F238 K239 M248 V251 L253	C201-F242 HydrophobicContact CB-CE1 3.57Å; C201-F242 HydrophobicContact CB-CZ 4.11Å; F225-F242 HydrophobicContact CD2-CE2 4.24Å; F225-F242 HydrophobicContact CD2-CZ 4.18Å; F225-F242 HydrophobicContact CG-CE2 4.26Å; F238-F242 HydrophobicContact CB-CD2 4.4Å; F238-F242 HydrophobicContact CB-CE2 3.96Å; F238-F242 HydrophobicContact CD1-CE2 4.12Å; F238-F242 HydrophobicContact CD1-CZ 4.07Å; F238-F242 HydrophobicContact CG-CE2 4.46Å; F238-F242 WeakPolarHBondContact O-CD2 3.19Å; F238-F242 WeakPolarHBondContact O-CG 3.35Å; F238-F242 PolarHBondContact O-N 2.81Å; K239-F242 PolarHBondContact O-N 2.72Å; F242-M248 HydrophobicContact CB-SD 4.12Å; F242-M248 PolarHBondContact O-N 3.31Å; F242-V251 HydrophobicContact CD1-CG2 4.5Å; F242-V251 HydrophobicContact CD2-CG1 4.25Å; F242-V251 HydrophobicContact CE2-CG1 4.49Å; F242-V251 HydrophobicContact CG-CG1 4.49Å; F242-L253 HydrophobicContact CD2-CD1 4.12Å; F242-L253 HydrophobicContact CD2-CD2 3.85Å; F242-L253 HydrophobicContact CD2-CG 4.43Å; F242-L253 HydrophobicContact CE2-CD2 3.78Å
243	E	85.7	Confident	86.4	Confident	106 Å²	106	53.9 Å²	53.9	50%	0.495	29%	0.289	S	S	.	.	H	α-helix	trans	-69.1	-43.1	173.7	-75.1	174.5	179	0	0	112.2	K239 D241	K239-E243 WeakPolarHBondContact CE-OE1 3.04Å; K239-E243 IonicContact NZ-OE1 2.97Å; K239-E243 WeakPolarHBondContact O-CB 3.47Å; K239-E243 VanDerWaalsContact O-CG 3.29Å; K239-E243 WeakPolarHBondContact O-CG 3.34Å; K239-E243 PolarHBondContact O-N 3.44Å; D241-E243 VanDerWaalsContact C-N 3.31Å; D241-E243 PolarHBondContact O-N 2.81Å
244	Q	84.7	Confident	86.7	Confident	146 Å²	146	46.3 Å²	46.3	68%	0.682	25%	0.253	S	S	*	.	H	α-helix	trans	-70.4	-35	-177.8	-75.4	174.1	21.1	0	0	113.2	S240 D241 G246	S240-Q244 WeakPolarHBondContact O-CB 3.38Å; S240-Q244 WeakPolarHBondContact O-CG 3.38Å; S240-Q244 PolarHBondContact O-N 2.82Å; D241-Q244 PolarHBondContact O-N 3.37Å; Q244-G246 VanDerWaalsContact C-N 3.27Å; Q244-G246 PolarHBondContact O-N 2.74Å
245	N	76.6	Confident	86.9	Confident	67 Å²	67	45.7 Å²	45.7	36%	0.358	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-2	-177.1	-64.1	-62.9	0	0	0	113.5	R202 D241 T247	R202-N245 VanDerWaalsContact CD-CG 3.41Å; R202-N245 WeakPolarHBondContact CD-ND2 3.5Å; R202-N245 HydrophobicContact CG-CB 4.38Å; D241-N245 VanDerWaalsContact CG-ND2 3.32Å; D241-N245 PolarHBondContact O-N 3.4Å; D241-N245 VanDerWaalsContact O-N 3.09Å; D241-N245 PolarHBondContact O-ND2 3.46Å; D241-N245 PolarHBondContact OD1-ND2 3.28Å; D241-N245 VanDerWaalsContact OD1-ND2 3.16Å; D241-N245 PolarHBondContact OD2-ND2 3.15Å; N245-T247 PolarHBondContact O-N 3.3Å; N245-T247 VanDerWaalsContact O-N 3.13Å
246	G	70.4	Confident	87.1	Confident	65 Å²	65	45.4 Å²	45.4	67%	0.67	25%	0.246	S	C	*	.	S	Bend	trans	69.2	4.2	-179.7	0	0	0	0	0	114.6	Q244 M248	Q244-G246 VanDerWaalsContact C-N 3.27Å; Q244-G246 PolarHBondContact O-N 2.74Å; G246-M248 VanDerWaalsContact C-N 3.26Å; G246-M248 PolarHBondContact O-N 3.41Å
247	T	72.2	Confident	87.2	Confident	43 Å²	43	38.5 Å²	38.5	26%	0.264	22%	0.222	S	C	.	.	G	3₁₀ helix	trans	-78.2	-9.7	178.7	41.7	0	0	0	0	113.2	N245 G249 N250 V251	N245-T247 PolarHBondContact O-N 3.3Å; N245-T247 VanDerWaalsContact O-N 3.13Å; T247-G249 PolarHBondContact O-N 3.1Å; T247-N250 PolarHBondContact O-N 3.46Å; T247-V251 WeakPolarHBondContact O-CG2 3.48Å
248	M	80.6	Confident	87.2	Confident	35 Å²	35	37.9 Å²	37.9	17%	0.172	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-49	-38.9	-178.9	-166.2	69.9	178.4	0	0	113	G123 V125 F242 G246 N250 V251 L253	G123-M248 WeakPolarHBondContact CA-O 3.45Å; G123-M248 PolarHBondContact N-O 3.48Å; V125-M248 HydrophobicContact CG2-CE 3.46Å; V125-M248 VanDerWaalsContact CG2-CE 3.46Å; F242-M248 HydrophobicContact CB-SD 4.12Å; F242-M248 PolarHBondContact O-N 3.31Å; G246-M248 VanDerWaalsContact C-N 3.26Å; G246-M248 PolarHBondContact O-N 3.41Å; M248-N250 PolarHBondContact O-N 3.46Å; M248-V251 PolarHBondContact O-N 2.72Å; M248-L253 HydrophobicContact CE-CD1 3.74Å; M248-L253 HydrophobicContact SD-CD1 3.89Å
249	G	83.3	Confident	87.3	Confident	48 Å²	48	43.6 Å²	43.6	50%	0.495	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-56	-27	-179.3	0	0	0	0	0	115	T247	T247-G249 PolarHBondContact O-N 3.1Å
250	N	85.9	Confident	87.4	Confident	68 Å²	68	41.7 Å²	41.7	36%	0.364	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-109.6	9.3	-178.7	-65.2	2.9	0	0	0	112.8	F221 A222 I223 T247 M248	F221-N250 PolarHBondContact O-ND2 3Å; A222-N250 WeakPolarHBondContact CA-O 3.4Å; I223-N250 PolarHBondContact N-O 2.97Å; T247-N250 PolarHBondContact O-N 3.46Å; M248-N250 PolarHBondContact O-N 3.46Å
251	V	90.1	Very high	87.4	Confident	1 Å²	1	41.4 Å²	41.4	1%	0.006	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	127.6	-176.4	-177.6	0	0	0	0	109.8	G123 I223 F242 T247 M248 L253	G123-V251 WeakPolarHBondContact CA-O 3.35Å; G123-V251 PolarHBondContact N-O 3.32Å; I223-V251 HydrophobicContact CB-CG1 4.4Å; I223-V251 HydrophobicContact CB-CG2 4.01Å; I223-V251 HydrophobicContact CD1-CG2 4.25Å; I223-V251 HydrophobicContact CG2-CG1 4.36Å; I223-V251 CarbonylContact O-C 3.56Å; I223-V251 VanDerWaalsContact O-CA 3.3Å; I223-V251 WeakPolarHBondContact O-CA 3.05Å; F242-V251 HydrophobicContact CD1-CG2 4.5Å; F242-V251 HydrophobicContact CD2-CG1 4.25Å; F242-V251 HydrophobicContact CE2-CG1 4.49Å; F242-V251 HydrophobicContact CG-CG1 4.49Å; T247-V251 WeakPolarHBondContact O-CG2 3.48Å; M248-V251 PolarHBondContact O-N 2.72Å; V251-L253 HydrophobicContact CG1-CD1 4.29Å; V251-L253 HydrophobicContact CG1-CD2 4.34Å; V251-L253 HydrophobicContact CG1-CG 3.88Å
252	C	93.8	Very high	87.4	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	120.6	167.1	179.1	0	0	0	0	109.3	L122 I223 V224 F225 F254	L122-C252 HydrophobicContact CD2-CB 4.46Å; I223-C252 PolarHBondContact O-N 3.12Å; V224-C252 HydrophobicContact CG2-CB 4.42Å; F225-C252 PolarHBondContact N-O 3.28Å; C252-F254 WeakPolarHBondContact SG-CE2 3.49Å
253	L	94.4	Very high	87.5	Confident	1 Å²	1	43.2 Å²	43.2	1%	0.005	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	123.8	-176.4	-75.6	152.7	0	0	0	111.1	R124 V125 F126 F225 F242 M248 V251 L255	R124-L253 PolarHBondContact O-N 3Å; R124-L253 VanDerWaalsContact O-N 3.14Å; V125-L253 WeakPolarHBondContact CA-O 3.25Å; V125-L253 HydrophobicContact CB-CB 4.34Å; V125-L253 HydrophobicContact CG1-CB 3.87Å; V125-L253 HydrophobicContact CG2-CB 4.23Å; V125-L253 HydrophobicContact CG2-CD1 3.97Å; F126-L253 PolarHBondContact N-O 3.3Å; F225-L253 HydrophobicContact CB-CD2 3.7Å; F225-L253 HydrophobicContact CD1-CD2 3.57Å; F225-L253 HydrophobicContact CE1-CD2 4.48Å; F225-L253 HydrophobicContact CG-CD2 3.86Å; F225-L253 CarbonylContact O-C 3.57Å; F242-L253 HydrophobicContact CD2-CD1 4.12Å; F242-L253 HydrophobicContact CD2-CD2 3.85Å; F242-L253 HydrophobicContact CD2-CG 4.43Å; F242-L253 HydrophobicContact CE2-CD2 3.78Å; M248-L253 HydrophobicContact CE-CD1 3.74Å; M248-L253 HydrophobicContact SD-CD1 3.89Å; V251-L253 HydrophobicContact CG1-CD1 4.29Å; V251-L253 HydrophobicContact CG1-CD2 4.34Å; V251-L253 HydrophobicContact CG1-CG 3.88Å; L253-L255 HydrophobicContact CD2-CD2 4.36Å
254	F	95.9	Very high	87.7	Confident	1 Å²	1	38.6 Å²	38.6	0%	0.004	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	116.3	165.1	-64.8	-86.1	0	0	0	108.4	M121 F126 V224 F225 A226 A227 C252 T268 L271 A272 T275	M121-F254 HydrophobicContact CE-CE1 4.32Å; M121-F254 HydrophobicContact CE-CZ 3.78Å; F126-F254 HydrophobicContact CB-CD1 3.71Å; F126-F254 HydrophobicContact CB-CE1 3.87Å; F126-F254 HydrophobicContact CD2-CD1 4.36Å; F126-F254 AromaticContact CD2-CE1 3.91Å; F126-F254 HydrophobicContact CD2-CE1 3.91Å; F126-F254 HydrophobicContact CD2-CZ 4.13Å; F126-F254 HydrophobicContact CG-CD1 4.38Å; F126-F254 HydrophobicContact CG-CE1 4.07Å; F126-F254 WeakPolarHBondContact O-CA 3.36Å; V224-F254 HydrophobicContact CG1-CD2 4.2Å; V224-F254 HydrophobicContact CG1-CE2 4.08Å; F225-F254 PolarHBondContact O-N 3Å; A226-F254 CarbonylContact C-O 3.48Å; A226-F254 WeakPolarHBondContact CA-O 3.43Å; A226-F254 HydrophobicContact CB-CB 4.43Å; A227-F254 PolarHBondContact N-O 3.44Å; C252-F254 WeakPolarHBondContact SG-CE2 3.49Å; F254-T268 HydrophobicContact CB-CG2 4.22Å; F254-L271 HydrophobicContact CD1-CB 4.43Å; F254-L271 HydrophobicContact CE1-CB 4.19Å; F254-A272 HydrophobicContact CD2-CB 3.83Å; F254-A272 HydrophobicContact CE2-CB 4.2Å; F254-A272 HydrophobicContact CG-CB 4.49Å; F254-T275 WeakPolarHBondContact CZ-OG1 3.5Å
255	L	94.9	Very high	88.2	Confident	13 Å²	13	32.9 Å²	32.9	7%	0.068	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	114.4	-177.3	-58.8	178.6	0	0	0	110.1	V125 F126 N127 G128 I133 F225 A227 L253	V125-L255 HydrophobicContact CG1-CD1 3.67Å; V125-L255 HydrophobicContact CG1-CG 4.11Å; F126-L255 PolarHBondContact O-N 2.88Å; N127-L255 CarbonylContact C-O 3.58Å; N127-L255 VanDerWaalsContact CA-O 3.26Å; N127-L255 WeakPolarHBondContact CA-O 3.39Å; G128-L255 PolarHBondContact N-O 3.09Å; I133-L255 HydrophobicContact CD1-CB 4.31Å; I133-L255 HydrophobicContact CD1-CD1 4.16Å; F225-L255 HydrophobicContact CD1-CD2 4.47Å; F225-L255 HydrophobicContact CE1-CD2 4.48Å; A227-L255 HydrophobicContact CB-CD2 3.59Å; L253-L255 HydrophobicContact CD2-CD2 4.36Å
256	N	94.9	Very high	88.9	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	116.2	163.8	174.8	-90.8	0	0	0	108.5	A227 G229 V230 D260 E264 R265	A227-N256 WeakPolarHBondContact O-CB 3.45Å; A227-N256 PolarHBondContact O-N 3.01Å; G229-N256 PolarHBondContact N-O 3.21Å; G229-N256 PolarHBondContact N-OD1 3.47Å; V230-N256 PolarHBondContact N-O 3.41Å; N256-D260 VanDerWaalsContact ND2-CB 3.25Å; N256-D260 WeakPolarHBondContact ND2-CB 3.24Å; N256-E264 VanDerWaalsContact ND2-CB 3.34Å; N256-E264 WeakPolarHBondContact ND2-CB 3.13Å; N256-E264 PolarHBondContact ND2-OE2 3.46Å; N256-E264 VanDerWaalsContact ND2-OE2 3.17Å; N256-R265 WeakPolarHBondContact OD1-CG 3.45Å; N256-R265 PolarHBondContact OD1-NE 2.95Å
257	L	93.9	Very high	90	Very high	26 Å²	26	28 Å²	28	14%	0.136	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	163.5	-177.9	-60.6	169.3	0	0	0	111.1	V230 M232 A235 N259 D260	V230-L257 HydrophobicContact CG2-CD2 4.45Å; V230-L257 CarbonylContact O-C 3.55Å; V230-L257 WeakPolarHBondContact O-CA 3.47Å; M232-L257 HydrophobicContact CE-CD1 3.51Å; M232-L257 HydrophobicContact CE-CD2 4.44Å; M232-L257 HydrophobicContact SD-CD1 4.35Å; M232-L257 HydrophobicContact SD-CD2 4.45Å; A235-L257 HydrophobicContact CB-CD2 3.52Å; L257-N259 WeakPolarHBondContact CB-OD1 3.33Å; L257-N259 PolarHBondContact O-N 3.1Å; L257-D260 WeakPolarHBondContact CB-OD2 3.4Å; L257-D260 PolarHBondContact N-OD2 2.86Å; L257-D260 WeakPolarHBondContact O-CB 3.48Å; L257-D260 PolarHBondContact O-N 2.84Å
258	A	91.5	Very high	91.1	Very high	47 Å²	47	25.9 Å²	25.9	39%	0.388	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-27.5	176.9	0	0	0	0	0	113.8	V230 R265	V230-A258 PolarHBondContact O-N 3Å; A258-R265 PolarHBondContact O-NH2 2.87Å
259	N	90.7	Very high	91.9	Very high	120 Å²	120	24.2 Å²	24.2	64%	0.642	15%	0.148	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-13.5	175.6	64.9	-67.5	0	0	0	113.6	L257	L257-N259 WeakPolarHBondContact CB-OD1 3.33Å; L257-N259 PolarHBondContact O-N 3.1Å
260	D	91.2	Very high	92.5	Very high	39 Å²	39	23.1 Å²	23.1	21%	0.209	13%	0.129	C	C	.	.	S	Bend	trans	-78.3	154.8	176.7	-62.9	-25.8	0	0	0	109.9	N256 L257	N256-D260 VanDerWaalsContact ND2-CB 3.25Å; N256-D260 WeakPolarHBondContact ND2-CB 3.24Å; L257-D260 WeakPolarHBondContact CB-OD2 3.4Å; L257-D260 PolarHBondContact N-OD2 2.86Å; L257-D260 WeakPolarHBondContact O-CB 3.48Å; L257-D260 PolarHBondContact O-N 2.84Å
261	P	89.9	Confident	93	Very high	40 Å²	40	20.2 Å²	20.2	26%	0.26	11%	0.113	S	C	.	.			trans	-55.4	141.3	-177.8	-21.8	29.5	0	0	0	113	F93 I263 E264	F93-P261 WeakPolarHBondContact O-CB 3.46Å; P261-I263 PolarHBondContact O-N 3.06Å; P261-E264 HydrophobicContact CB-CG 4.36Å; P261-E264 HydrophobicContact CG-CG 4.47Å; P261-E264 PolarHBondContact O-N 3.02Å
262	T	88.5	Confident	93.3	Very high	34 Å²	34	20.1 Å²	20.1	21%	0.209	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-26.8	-177.3	51.8	0	0	0	0	112.6	R265 A300 E303	T262-R265 WeakPolarHBondContact O-CB 3.38Å; T262-R265 WeakPolarHBondContact O-CG 3.19Å; T262-R265 PolarHBondContact O-N 3.35Å; T262-R265 VanDerWaalsContact O-N 3.17Å; T262-A300 WeakPolarHBondContact O-CB 3.16Å; T262-E303 VanDerWaalsContact CB-OE2 3.26Å; T262-E303 WeakPolarHBondContact CB-OE2 3.31Å; T262-E303 VanDerWaalsContact CG2-OE2 3.26Å; T262-E303 WeakPolarHBondContact CG2-OE2 3.35Å; T262-E303 PolarHBondContact OG1-OE2 2.64Å
263	I	87.7	Confident	93.5	Very high	7 Å²	7	20.1 Å²	20.1	4%	0.036	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-30.7	-177.5	-53.8	162.8	0	0	0	111.5	P50 Q91 V92 F93 P261 R265 I266	P50-I263 HydrophobicContact CB-CD1 3.73Å; Q91-I263 HydrophobicContact CG-CD1 3.8Å; Q91-I263 HydrophobicContact CG-CG1 4.43Å; Q91-I263 HydrophobicContact CG-CG2 4.02Å; V92-I263 WeakPolarHBondContact O-CD1 3.47Å; F93-I263 HydrophobicContact CD1-CB 4.45Å; F93-I263 HydrophobicContact CD1-CG2 3.52Å; F93-I263 HydrophobicContact CE1-CG2 4.1Å; P261-I263 PolarHBondContact O-N 3.06Å; I263-R265 PolarHBondContact O-N 3.49Å; I263-I266 WeakPolarHBondContact O-CB 3.3Å; I263-I266 PolarHBondContact O-N 2.86Å
264	E	91.1	Very high	93.6	Very high	9 Å²	9	20.1 Å²	20.1	4%	0.042	11%	0.113	C	C	.	.	H	α-helix	trans	-59.1	-29.7	172.6	-68	-164.9	159.9	0	0	111.6	S129 N256 P261 I266 I267 T268	S129-E264 WeakPolarHBondContact OG-CG 3.3Å; S129-E264 PolarHBondContact OG-OE1 3.33Å; N256-E264 VanDerWaalsContact ND2-CB 3.34Å; N256-E264 WeakPolarHBondContact ND2-CB 3.13Å; N256-E264 PolarHBondContact ND2-OE2 3.46Å; N256-E264 VanDerWaalsContact ND2-OE2 3.17Å; P261-E264 HydrophobicContact CB-CG 4.36Å; P261-E264 HydrophobicContact CG-CG 4.47Å; P261-E264 PolarHBondContact O-N 3.02Å; E264-I266 PolarHBondContact O-N 3.16Å; E264-I267 WeakPolarHBondContact O-CG1 3.39Å; E264-I267 PolarHBondContact O-N 3.38Å; E264-T268 WeakPolarHBondContact O-CB 3.35Å; E264-T268 PolarHBondContact O-N 3.22Å; E264-T268 PolarHBondContact O-OG1 2.9Å
265	R	94.1	Very high	93.5	Very high	26 Å²	26	20 Å²	20	10%	0.098	11%	0.112	C	C	.	.	H	α-helix	trans	-62	-28.6	176.6	-58	171.5	-168.5	171.1	7.4	112.2	M228 N256 A258 T262 I263 P269 Y297 A300	M228-R265 HydrophobicContact CB-CB 4.4Å; M228-R265 HydrophobicContact CB-CG 4.38Å; N256-R265 WeakPolarHBondContact OD1-CG 3.45Å; N256-R265 PolarHBondContact OD1-NE 2.95Å; A258-R265 PolarHBondContact O-NH2 2.87Å; T262-R265 WeakPolarHBondContact O-CB 3.38Å; T262-R265 WeakPolarHBondContact O-CG 3.19Å; T262-R265 PolarHBondContact O-N 3.35Å; T262-R265 VanDerWaalsContact O-N 3.17Å; I263-R265 PolarHBondContact O-N 3.49Å; R265-P269 WeakPolarHBondContact O-CD 3.19Å; R265-Y297 VanDerWaalsContact O-CD2 3.3Å; R265-Y297 WeakPolarHBondContact O-CD2 3.44Å; R265-A300 HydrophobicContact CB-CB 4.18Å
266	I	92.6	Very high	93.6	Very high	22 Å²	22	19.4 Å²	19.4	11%	0.113	11%	0.109	C	C	.	.	H	α-helix	trans	-72.1	-38.2	-180	-60.5	177.6	0	0	0	110.8	I263 E264 R270 A300 L301 V304	I263-I266 WeakPolarHBondContact O-CB 3.3Å; I263-I266 PolarHBondContact O-N 2.86Å; E264-I266 PolarHBondContact O-N 3.16Å; I266-R270 PolarHBondContact O-NH1 3.21Å; I266-A300 HydrophobicContact CG1-CB 4.32Å; I266-L301 HydrophobicContact CD1-CD1 4.47Å; I266-V304 HydrophobicContact CD1-CB 4.38Å; I266-V304 HydrophobicContact CD1-CG2 3.64Å
267	I	93.3	Very high	93.6	Very high	7 Å²	7	20.5 Å²	20.5	4%	0.036	11%	0.114	C	C	.	.	H	α-helix	trans	-88	-26.4	-179.2	59.4	169.1	0	0	0	112.9	F93 L113 I147 E264 R270 L271	F93-I267 HydrophobicContact CD2-CD1 4.34Å; F93-I267 HydrophobicContact CE1-CG2 4.4Å; F93-I267 HydrophobicContact CE2-CD1 4.26Å; F93-I267 HydrophobicContact CZ-CD1 4.47Å; F93-I267 HydrophobicContact CZ-CG2 4.31Å; L113-I267 HydrophobicContact CD2-CG2 4.16Å; I147-I267 HydrophobicContact CD1-CB 4.32Å; I147-I267 HydrophobicContact CD1-CG2 4.05Å; E264-I267 WeakPolarHBondContact O-CG1 3.39Å; E264-I267 PolarHBondContact O-N 3.38Å; I267-R270 WeakPolarHBondContact O-CA 3.03Å; I267-R270 WeakPolarHBondContact O-CB 3.33Å; I267-R270 PolarHBondContact O-N 3.26Å; I267-L271 HydrophobicContact CD1-CD1 4.48Å; I267-L271 WeakPolarHBondContact O-CG 3.47Å; I267-L271 PolarHBondContact O-N 2.84Å
268	T	95.8	Very high	93.7	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-50	-52.1	-179.4	-62.3	0	0	0	0	114.1	G128 A226 M228 F254 E264 R270 L271 A272	G128-T268 WeakPolarHBondContact CA-OG1 3.41Å; G128-T268 PolarHBondContact O-OG1 3.26Å; A226-T268 HydrophobicContact CB-CG2 4.25Å; M228-T268 HydrophobicContact CG-CG2 3.77Å; F254-T268 HydrophobicContact CB-CG2 4.22Å; E264-T268 WeakPolarHBondContact O-CB 3.35Å; E264-T268 PolarHBondContact O-N 3.22Å; E264-T268 PolarHBondContact O-OG1 2.9Å; T268-R270 VanDerWaalsContact C-N 3.28Å; T268-R270 PolarHBondContact O-N 2.69Å; T268-L271 PolarHBondContact O-N 2.85Å; T268-A272 PolarHBondContact O-N 3.07Å
269	P	96.9	Very high	93.8	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-69	-29.6	-179.7	27	-33	0	0	0	111.9	M228 R265 A272 L273 L291 Y297 I328	M228-P269 HydrophobicContact SD-CB 4.06Å; M228-P269 HydrophobicContact SD-CG 3.84Å; R265-P269 WeakPolarHBondContact O-CD 3.19Å; P269-A272 PolarHBondContact O-N 3.37Å; P269-L273 WeakPolarHBondContact O-CB 3.44Å; P269-L273 VanDerWaalsContact O-CG 3.25Å; P269-L273 WeakPolarHBondContact O-CG 3.21Å; P269-L273 PolarHBondContact O-N 3.15Å; P269-L291 HydrophobicContact CB-CD1 4.46Å; P269-L291 HydrophobicContact CB-CD2 4.23Å; P269-Y297 HydrophobicContact CG-CD2 3.73Å; P269-Y297 HydrophobicContact CG-CE2 3.6Å; P269-I328 HydrophobicContact CB-CD1 4.23Å; P269-I328 HydrophobicContact CB-CG2 4.38Å; P269-I328 HydrophobicContact CG-CD1 3.89Å
270	R	96.1	Very high	93.9	Very high	25 Å²	25	11.5 Å²	11.5	9%	0.094	6%	0.06	C	C	.	.	H	α-helix	trans	-68.8	-41	176.3	-69	177.8	171.5	81	2.3	111.5	I147 I266 I267 T268 T274 Y297 D324	I147-R270 HydrophobicContact CB-CB 4.08Å; I147-R270 HydrophobicContact CD1-CB 4.14Å; I147-R270 HydrophobicContact CG1-CB 4.45Å; I147-R270 WeakPolarHBondContact O-CB 3.15Å; I266-R270 PolarHBondContact O-NH1 3.21Å; I267-R270 WeakPolarHBondContact O-CA 3.03Å; I267-R270 WeakPolarHBondContact O-CB 3.33Å; I267-R270 PolarHBondContact O-N 3.26Å; T268-R270 VanDerWaalsContact C-N 3.28Å; T268-R270 PolarHBondContact O-N 2.69Å; R270-T274 WeakPolarHBondContact O-CB 3.35Å; R270-T274 PolarHBondContact O-N 2.99Å; R270-T274 PolarHBondContact O-OG1 3.18Å; R270-Y297 PolarHBondContact NH1-OH 3.28Å; R270-D324 IonicContact CZ-OD1 3.3Å; R270-D324 IonicContact NH2-OD1 3.73Å; R270-D324 PolarHBondContact NH2-OD1 2.97Å
271	L	95.6	Very high	93.9	Very high	6 Å²	6	10.8 Å²	10.8	3%	0.031	5%	0.054	C	C	.	.	H	α-helix	trans	-62.2	-47.1	172.9	-69.2	170.9	0	0	0	111.4	T115 G128 I147 F254 I267 T268 T274 T275	T115-L271 HydrophobicContact CG2-CD2 4.25Å; G128-L271 VanDerWaalsContact O-CD1 3.31Å; G128-L271 WeakPolarHBondContact O-CD1 3.37Å; I147-L271 HydrophobicContact CG2-CD2 3.61Å; I147-L271 HydrophobicContact CG2-CG 4.44Å; F254-L271 HydrophobicContact CD1-CB 4.43Å; F254-L271 HydrophobicContact CE1-CB 4.19Å; I267-L271 HydrophobicContact CD1-CD1 4.48Å; I267-L271 WeakPolarHBondContact O-CG 3.47Å; I267-L271 PolarHBondContact O-N 2.84Å; T268-L271 PolarHBondContact O-N 2.85Å; L271-T274 PolarHBondContact O-N 3.38Å; L271-T275 PolarHBondContact O-N 3.41Å; L271-T275 PolarHBondContact O-OG1 3.26Å
272	A	96.8	Very high	94	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-60.3	-48.1	177.9	0	0	0	0	0	112	V224 A226 F254 T268 P269 T274 T275 A276 L291	V224-A272 HydrophobicContact CG1-CB 3.9Å; A226-A272 HydrophobicContact CB-CB 3.64Å; F254-A272 HydrophobicContact CD2-CB 3.83Å; F254-A272 HydrophobicContact CE2-CB 4.2Å; F254-A272 HydrophobicContact CG-CB 4.49Å; T268-A272 PolarHBondContact O-N 3.07Å; P269-A272 PolarHBondContact O-N 3.37Å; A272-T274 PolarHBondContact O-N 3Å; A272-T275 PolarHBondContact O-N 2.88Å; A272-A276 WeakPolarHBondContact O-CB 3.29Å; A272-A276 PolarHBondContact O-N 3.46Å; A272-L291 HydrophobicContact CB-CD2 4.45Å
273	L	96.9	Very high	94	Very high	0 Å²	0	13 Å²	13	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-67.7	-33.7	179.6	-72.2	172.8	0	0	0	113.1	P269 T275 A276 E277 V289 I328 R331 Q344	P269-L273 WeakPolarHBondContact O-CB 3.44Å; P269-L273 VanDerWaalsContact O-CG 3.25Å; P269-L273 WeakPolarHBondContact O-CG 3.21Å; P269-L273 PolarHBondContact O-N 3.15Å; L273-T275 VanDerWaalsContact C-N 3.34Å; L273-A276 PolarHBondContact O-N 2.87Å; L273-E277 WeakPolarHBondContact O-CB 3.25Å; L273-E277 VanDerWaalsContact O-CG 3.3Å; L273-E277 WeakPolarHBondContact O-CG 3.27Å; L273-E277 PolarHBondContact O-N 3.33Å; L273-V289 HydrophobicContact CD2-CB 4.5Å; L273-V289 HydrophobicContact CD2-CG1 3.98Å; L273-V289 HydrophobicContact CD2-CG2 4.3Å; L273-I328 HydrophobicContact CD1-CB 4.16Å; L273-I328 HydrophobicContact CD1-CG2 3.5Å; L273-I328 VanDerWaalsContact CD1-O 3.3Å; L273-I328 WeakPolarHBondContact CD1-O 3.34Å; L273-R331 VanDerWaalsContact CB-CZ 3.47Å; L273-R331 HydrophobicContact CD1-CB 4.38Å; L273-Q344 HydrophobicContact CD2-CG 4.34Å; L273-Q344 VanDerWaalsContact CD2-NE2 3.27Å
274	T	96.4	Very high	94.1	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-68.6	-38.2	176.4	-54.5	0	0	0	0	111.3	T115 V117 L145 I147 R270 L271 A272 E277 F278 R331	T115-T274 HydrophobicContact CG2-CG2 3.62Å; V117-T274 HydrophobicContact CG1-CG2 4.44Å; L145-T274 HydrophobicContact CB-CG2 3.59Å; L145-T274 HydrophobicContact CD1-CG2 4.2Å; I147-T274 WeakPolarHBondContact CA-OG1 3.5Å; I147-T274 PolarHBondContact O-OG1 3.12Å; I147-T274 VanDerWaalsContact O-OG1 3.12Å; R270-T274 WeakPolarHBondContact O-CB 3.35Å; R270-T274 PolarHBondContact O-N 2.99Å; R270-T274 PolarHBondContact O-OG1 3.18Å; L271-T274 PolarHBondContact O-N 3.38Å; A272-T274 PolarHBondContact O-N 3Å; T274-E277 PolarHBondContact O-N 3.33Å; T274-F278 WeakPolarHBondContact O-CB 3.42Å; T274-F278 PolarHBondContact O-N 3.2Å; T274-R331 VanDerWaalsContact CA-NH2 3.32Å; T274-R331 PolarHBondContact OG1-NH2 3.2Å
275	T	95.6	Very high	94	Very high	0 Å²	0	19 Å²	19	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-64.7	-42.3	171.6	-50.2	0	0	0	0	110.7	M121 F254 L271 A272 L273 F278 L279	M121-T275 HydrophobicContact CB-CG2 4.48Å; M121-T275 HydrophobicContact CE-CG2 4.05Å; M121-T275 HydrophobicContact SD-CG2 4.04Å; F254-T275 WeakPolarHBondContact CZ-OG1 3.5Å; L271-T275 PolarHBondContact O-N 3.41Å; L271-T275 PolarHBondContact O-OG1 3.26Å; A272-T275 PolarHBondContact O-N 2.88Å; L273-T275 VanDerWaalsContact C-N 3.34Å; T275-F278 PolarHBondContact O-N 3.33Å; T275-L279 HydrophobicContact CG2-CD1 4.17Å; T275-L279 VanDerWaalsContact O-CG 3.29Å; T275-L279 WeakPolarHBondContact O-CG 3.41Å; T275-L279 PolarHBondContact O-N 2.82Å
276	A	96	Very high	93.9	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-63.9	-39.8	176.6	0	0	0	0	0	112.8	V224 A272 L273 L279 A280 V287 V289	V224-A276 HydrophobicContact CB-CB 4.48Å; V224-A276 HydrophobicContact CG2-CB 4.16Å; A272-A276 WeakPolarHBondContact O-CB 3.29Å; A272-A276 PolarHBondContact O-N 3.46Å; L273-A276 PolarHBondContact O-N 2.87Å; A276-L279 PolarHBondContact O-N 3.5Å; A276-A280 WeakPolarHBondContact O-CB 3.41Å; A276-A280 PolarHBondContact O-N 3.06Å; A276-V287 HydrophobicContact CB-CG1 3.77Å; A276-V289 HydrophobicContact CB-CG2 3.49Å; A276-V289 VanDerWaalsContact CB-CG2 3.49Å
277	E	95.3	Very high	93.9	Very high	23 Å²	23	17.4 Å²	17.4	11%	0.107	8%	0.082	C	C	.	.	H	α-helix	trans	-66.7	-40.5	175.8	-76.2	175.5	174.1	0	0	112.6	L273 T274 Y281 R331 I342	L273-E277 WeakPolarHBondContact O-CB 3.25Å; L273-E277 VanDerWaalsContact O-CG 3.3Å; L273-E277 WeakPolarHBondContact O-CG 3.27Å; L273-E277 PolarHBondContact O-N 3.33Å; T274-E277 PolarHBondContact O-N 3.33Å; E277-Y281 HydrophobicContact CB-CD2 4.09Å; E277-Y281 HydrophobicContact CB-CE2 4.36Å; E277-Y281 HydrophobicContact CG-CD2 4.19Å; E277-Y281 HydrophobicContact CG-CE2 3.96Å; E277-Y281 VanDerWaalsContact O-CB 3.31Å; E277-Y281 WeakPolarHBondContact O-CB 3.17Å; E277-Y281 PolarHBondContact O-N 3.45Å; E277-R331 WeakPolarHBondContact OE1-CB 3.31Å; E277-R331 WeakPolarHBondContact OE1-CG 3Å; E277-R331 IonicContact OE1-CZ 2.75Å; E277-R331 IonicContact OE1-NE 2.75Å; E277-R331 PolarHBondContact OE1-NE 3.28Å; E277-R331 IonicContact OE1-NH2 3.47Å; E277-R331 PolarHBondContact OE1-NH2 2.89Å; E277-R331 IonicContact OE2-CZ 2.77Å; E277-R331 IonicContact OE2-NE 2.94Å; E277-R331 IonicContact OE2-NH2 3.33Å; E277-R331 PolarHBondContact OE2-NH2 3.25Å; E277-I342 HydrophobicContact CB-CD1 4.25Å; E277-I342 HydrophobicContact CG-CD1 3.57Å
278	F	95.2	Very high	94	Very high	3 Å²	3	17.2 Å²	17.2	1%	0.013	8%	0.081	C	C	.	.	I	π-helix	trans	-59.2	-53.6	172.8	175.9	-98	0	0	0	110.7	V117 E119 E142 L145 T274 T275 A280 Q282 C283	V117-F278 HydrophobicContact CB-CB 4.15Å; V117-F278 HydrophobicContact CB-CD1 4.1Å; V117-F278 HydrophobicContact CB-CD2 3.99Å; V117-F278 HydrophobicContact CB-CE2 4.43Å; V117-F278 HydrophobicContact CB-CG 3.8Å; V117-F278 HydrophobicContact CG1-CB 4.29Å; V117-F278 HydrophobicContact CG1-CG 4.47Å; V117-F278 HydrophobicContact CG2-CB 4.26Å; V117-F278 HydrophobicContact CG2-CD1 4.38Å; V117-F278 HydrophobicContact CG2-CD2 3.39Å; V117-F278 HydrophobicContact CG2-CE2 3.74Å; V117-F278 HydrophobicContact CG2-CG 3.75Å; V117-F278 HydrophobicContact CG2-CZ 4.39Å; E119-F278 HydrophobicContact CG-CE1 4.1Å; E142-F278 HydrophobicContact CB-CZ 4.45Å; E142-F278 WeakPolarHBondContact OE2-CZ 3.21Å; L145-F278 HydrophobicContact CD1-CB 4.06Å; L145-F278 HydrophobicContact CD1-CD2 4.16Å; T274-F278 WeakPolarHBondContact O-CB 3.42Å; T274-F278 PolarHBondContact O-N 3.2Å; T275-F278 PolarHBondContact O-N 3.33Å; F278-A280 PolarHBondContact O-N 3.02Å; F278-Q282 HydrophobicContact CD2-CB 4.16Å; F278-Q282 VanDerWaalsContact CD2-CD 3.44Å; F278-Q282 HydrophobicContact CD2-CG 4.1Å; F278-Q282 HydrophobicContact CE2-CB 4.28Å; F278-Q282 WeakPolarHBondContact O-CA 3.25Å; F278-Q282 VanDerWaalsContact O-CB 3.25Å; F278-Q282 WeakPolarHBondContact O-CB 3.47Å; F278-Q282 PolarHBondContact O-N 3.13Å; F278-C283 PolarHBondContact O-N 3.44Å
279	L	93.7	Very high	94	Very high	1 Å²	1	17.2 Å²	17.2	1%	0.005	8%	0.081	C	C	.	.	I	π-helix	trans	-62.8	-40.2	-179.5	-68.5	170.9	0	0	0	112.8	L122 V224 T275 A276 C283 E284 K285 V287	L122-L279 HydrophobicContact CD1-CD2 4.16Å; L122-L279 HydrophobicContact CD2-CD1 3.79Å; L122-L279 HydrophobicContact CD2-CD2 4.47Å; L122-L279 HydrophobicContact CG-CD1 4.4Å; L122-L279 HydrophobicContact CG-CD2 4.25Å; V224-L279 HydrophobicContact CG2-CD1 4.09Å; T275-L279 HydrophobicContact CG2-CD1 4.17Å; T275-L279 VanDerWaalsContact O-CG 3.29Å; T275-L279 WeakPolarHBondContact O-CG 3.41Å; T275-L279 PolarHBondContact O-N 2.82Å; A276-L279 PolarHBondContact O-N 3.5Å; L279-C283 CarbonylContact O-C 3.6Å; L279-C283 WeakPolarHBondContact O-CB 3.06Å; L279-E284 PolarHBondContact O-N 3.49Å; L279-K285 HydrophobicContact CD2-CD 4.43Å; L279-K285 WeakPolarHBondContact O-CB 3.3Å; L279-K285 PolarHBondContact O-N 3.5Å; L279-V287 HydrophobicContact CB-CG2 3.78Å
280	A	92.9	Very high	94	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	8%	0.081	C	C	.	.	I	π-helix	trans	-78.5	-45.8	-176.9	0	0	0	0	0	112.8	A276 F278 E284 K285 V287 G340 I342	A276-A280 WeakPolarHBondContact O-CB 3.41Å; A276-A280 PolarHBondContact O-N 3.06Å; F278-A280 PolarHBondContact O-N 3.02Å; A280-E284 VanDerWaalsContact O-CA 3.28Å; A280-E284 WeakPolarHBondContact O-CA 3.34Å; A280-E284 PolarHBondContact O-N 2.91Å; A280-K285 WeakPolarHBondContact CA-O 3.3Å; A280-V287 HydrophobicContact CB-CB 4.44Å; A280-V287 HydrophobicContact CB-CG2 3.84Å; A280-G340 VanDerWaalsContact O-CA 3.28Å; A280-G340 WeakPolarHBondContact O-CA 3.38Å; A280-I342 HydrophobicContact CB-CD1 4Å; A280-I342 HydrophobicContact CB-CG1 3.38Å
281	Y	92.1	Very high	94	Very high	24 Å²	24	16 Å²	16	9%	0.094	8%	0.076	C	C	.	.	I	π-helix	trans	-94.7	-30.9	-172.2	-57	-42.9	0	0	0	112.3	I152 E277 V335 R338 I342	I152-Y281 HydrophobicContact CD1-CE2 4.03Å; I152-Y281 WeakPolarHBondContact CD1-OH 3.3Å; E277-Y281 HydrophobicContact CB-CD2 4.09Å; E277-Y281 HydrophobicContact CB-CE2 4.36Å; E277-Y281 HydrophobicContact CG-CD2 4.19Å; E277-Y281 HydrophobicContact CG-CE2 3.96Å; E277-Y281 VanDerWaalsContact O-CB 3.31Å; E277-Y281 WeakPolarHBondContact O-CB 3.17Å; E277-Y281 PolarHBondContact O-N 3.45Å; Y281-V335 HydrophobicContact CD1-CG1 4.49Å; Y281-V335 HydrophobicContact CD1-CG2 3.66Å; Y281-V335 HydrophobicContact CE1-CB 4.43Å; Y281-V335 HydrophobicContact CE1-CG1 3.9Å; Y281-V335 HydrophobicContact CE1-CG2 3.77Å; Y281-V335 HydrophobicContact CG-CG2 4.49Å; Y281-R338 VanDerWaalsContact CB-NH1 3.34Å; Y281-R338 VanDerWaalsContact O-CD 3.25Å; Y281-R338 WeakPolarHBondContact O-CD 3.35Å; Y281-R338 PolarHBondContact O-NH1 3.29Å; Y281-I342 HydrophobicContact CD2-CD1 4.39Å; Y281-I342 HydrophobicContact CE2-CD1 3.7Å
282	Q	90.6	Very high	94	Very high	96 Å²	96	15.8 Å²	15.8	45%	0.449	8%	0.075	S	C	.	.	I	π-helix	trans	-92.6	-41.1	178.8	-54.2	-168.1	12.4	0	0	112	F278	F278-Q282 HydrophobicContact CD2-CB 4.16Å; F278-Q282 VanDerWaalsContact CD2-CD 3.44Å; F278-Q282 HydrophobicContact CD2-CG 4.1Å; F278-Q282 HydrophobicContact CE2-CB 4.28Å; F278-Q282 WeakPolarHBondContact O-CA 3.25Å; F278-Q282 VanDerWaalsContact O-CB 3.25Å; F278-Q282 WeakPolarHBondContact O-CB 3.47Å; F278-Q282 PolarHBondContact O-N 3.13Å
283	C	89.6	Confident	93.8	Very high	25 Å²	25	16.6 Å²	16.6	17%	0.169	8%	0.08	C	C	.	.	S	Bend	trans	-96.5	1.7	-179.1	-45.2	0	0	0	0	113.7	E119 F278 L279 K285	E119-C283 VanDerWaalsContact CD-SG 3.5Å; E119-C283 HydrophobicContact CG-CB 4.4Å; E119-C283 WeakPolarHBondContact CG-SG 3.23Å; E119-C283 WeakPolarHBondContact OE1-CB 3.49Å; E119-C283 PolarHBondContact OE1-SG 3.46Å; F278-C283 PolarHBondContact O-N 3.44Å; L279-C283 CarbonylContact O-C 3.6Å; L279-C283 WeakPolarHBondContact O-CB 3.06Å; C283-K285 HydrophobicContact CB-CG 4.28Å; C283-K285 PolarHBondContact O-N 3.09Å; C283-K285 VanDerWaalsContact O-N 3.14Å
284	E	89.9	Confident	93.8	Very high	107 Å²	107	16.7 Å²	16.7	50%	0.5	8%	0.08	S	C	.	.			trans	58.7	21.9	177.8	-53.4	-167	139.7	0	0	116	L279 A280 G340	L279-E284 PolarHBondContact O-N 3.49Å; A280-E284 VanDerWaalsContact O-CA 3.28Å; A280-E284 WeakPolarHBondContact O-CA 3.34Å; A280-E284 PolarHBondContact O-N 2.91Å; E284-G340 WeakPolarHBondContact O-CA 3.46Å
285	K	89.6	Confident	93.7	Very high	34 Å²	34	16.9 Å²	16.9	15%	0.148	8%	0.081	C	C	.	.			trans	-78.4	155.6	178.9	-59.6	-174.7	-174.9	172.8	0	112.2	E119 L122 L279 A280 C283 V287 G340 S341	E119-K285 IonicContact OE2-NZ 3.51Å; E119-K285 PolarHBondContact OE2-NZ 3.05Å; L122-K285 HydrophobicContact CD1-CD 4.26Å; L279-K285 HydrophobicContact CD2-CD 4.43Å; L279-K285 WeakPolarHBondContact O-CB 3.3Å; L279-K285 PolarHBondContact O-N 3.5Å; A280-K285 WeakPolarHBondContact CA-O 3.3Å; C283-K285 HydrophobicContact CB-CG 4.28Å; C283-K285 PolarHBondContact O-N 3.09Å; C283-K285 VanDerWaalsContact O-N 3.14Å; K285-V287 HydrophobicContact CB-CG2 4.45Å; K285-G340 VanDerWaalsContact O-CA 3.24Å; K285-G340 WeakPolarHBondContact O-CA 3.28Å; K285-S341 PolarHBondContact O-N 3.27Å
286	H	91.1	Very high	93.7	Very high	14 Å²	14	17.8 Å²	17.8	7%	0.065	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	111	168.9	-61.3	-33.6	0	0	0	108.9	R179 N220 F221 A222 G339 S341	R179-H286 PolarHBondContact NH1-CE1 3.39Å; R179-H286 VanDerWaalsContact NH1-CE1 3.32Å; R179-H286 PolarHBondContact NH1-NE2 2.67Å; R179-H286 PolarHBondContact NH2-CE1 3.16Å; N220-H286 PolarHBondContact O-N 2.94Å; F221-H286 WeakPolarHBondContact CA-O 3.33Å; F221-H286 HydrophobicContact CD2-CB 3.91Å; F221-H286 HydrophobicContact CE2-CB 4.45Å; A222-H286 PolarHBondContact N-O 2.76Å; H286-G339 PolarHBondContact CE1-O 3.04Å; H286-G339 VanDerWaalsContact CE1-O 3.28Å; H286-S341 PolarHBondContact ND1-OG 2.85Å
287	V	93.4	Very high	93.7	Very high	1 Å²	1	17.8 Å²	17.8	1%	0.006	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	125	-173.2	-172.6	0	0	0	0	110.8	A222 V224 A276 L279 A280 K285 V289 S341 I342 T343	A222-V287 HydrophobicContact CB-CG2 4.42Å; A222-V287 CarbonylContact O-C 3.43Å; A222-V287 VanDerWaalsContact O-CA 3.29Å; A222-V287 WeakPolarHBondContact O-CA 3.5Å; V224-V287 HydrophobicContact CB-CG1 4.28Å; V224-V287 HydrophobicContact CG2-CG1 3.68Å; A276-V287 HydrophobicContact CB-CG1 3.77Å; L279-V287 HydrophobicContact CB-CG2 3.78Å; A280-V287 HydrophobicContact CB-CB 4.44Å; A280-V287 HydrophobicContact CB-CG2 3.84Å; K285-V287 HydrophobicContact CB-CG2 4.45Å; V287-V289 HydrophobicContact CG1-CG2 3.93Å; V287-S341 PolarHBondContact N-O 3.06Å; V287-I342 WeakPolarHBondContact O-CA 3.45Å; V287-T343 PolarHBondContact O-N 3.06Å
288	L	94.1	Very high	93.7	Very high	2 Å²	2	16.8 Å²	16.8	1%	0.01	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	116.6	166	-179.8	62.9	0	0	0	109.2	I200 A204 F221 A222 I223 V224 I290 T343 I345	I200-L288 HydrophobicContact CG2-CD2 4.36Å; A204-L288 HydrophobicContact CB-CD2 3.88Å; F221-L288 HydrophobicContact CE1-CB 3.81Å; F221-L288 HydrophobicContact CE1-CD2 4.19Å; F221-L288 HydrophobicContact CZ-CB 3.58Å; F221-L288 HydrophobicContact CZ-CD2 4.13Å; F221-L288 HydrophobicContact CZ-CG 4.42Å; A222-L288 PolarHBondContact O-N 3.21Å; I223-L288 WeakPolarHBondContact CA-O 3.4Å; V224-L288 PolarHBondContact N-O 3.13Å; L288-I290 HydrophobicContact CG-CG1 4.37Å; L288-T343 HydrophobicContact CD1-CG2 4.01Å; L288-I345 HydrophobicContact CD1-CD1 3.7Å; L288-I345 HydrophobicContact CD1-CG1 3.93Å
289	V	96.6	Very high	93.7	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	123.1	177.7	-173.9	0	0	0	0	109.3	V224 L273 A276 V287 L291 I342 T343 Q344 I345	V224-V289 HydrophobicContact CB-CG2 4.39Å; V224-V289 VanDerWaalsContact O-CA 3.29Å; V224-V289 WeakPolarHBondContact O-CA 3.47Å; L273-V289 HydrophobicContact CD2-CB 4.5Å; L273-V289 HydrophobicContact CD2-CG1 3.98Å; L273-V289 HydrophobicContact CD2-CG2 4.3Å; A276-V289 HydrophobicContact CB-CG2 3.49Å; A276-V289 VanDerWaalsContact CB-CG2 3.49Å; V287-V289 HydrophobicContact CG1-CG2 3.93Å; V289-L291 HydrophobicContact CG1-CD2 3.7Å; V289-L291 HydrophobicContact CG1-CG 4.04Å; V289-I342 HydrophobicContact CG2-CG2 3.76Å; V289-T343 PolarHBondContact N-O 3.16Å; V289-Q344 HydrophobicContact CB-CG 4.24Å; V289-Q344 WeakPolarHBondContact O-CA 3.36Å; V289-I345 PolarHBondContact O-N 3Å
290	I	96	Very high	93.7	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	123.7	171	-56.8	-162.6	0	0	0	108.6	C201 V224 F225 A226 L288 I345 I347	C201-I290 WeakPolarHBondContact SG-CD1 3.41Å; V224-I290 PolarHBondContact O-N 3.41Å; F225-I290 HydrophobicContact CD2-CB 3.8Å; F225-I290 HydrophobicContact CD2-CG2 3.95Å; F225-I290 HydrophobicContact CE2-CB 4.13Å; F225-I290 HydrophobicContact CE2-CG2 3.74Å; A226-I290 PolarHBondContact N-O 3.26Å; L288-I290 HydrophobicContact CG-CG1 4.37Å; I290-I345 WeakPolarHBondContact CA-O 3.43Å; I290-I345 HydrophobicContact CG1-CB 4.45Å; I290-I347 HydrophobicContact CG2-CD1 3.81Å; I290-I347 HydrophobicContact CG2-CG1 4.3Å
291	L	96.8	Very high	93.7	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	118.8	177.7	-54.9	177.5	0	0	0	108.2	A226 M228 P269 A272 V289 M294 I328 I345 P346 I347	A226-L291 HydrophobicContact CB-CD2 3.61Å; M228-L291 HydrophobicContact CE-CB 4.13Å; P269-L291 HydrophobicContact CB-CD1 4.46Å; P269-L291 HydrophobicContact CB-CD2 4.23Å; A272-L291 HydrophobicContact CB-CD2 4.45Å; V289-L291 HydrophobicContact CG1-CD2 3.7Å; V289-L291 HydrophobicContact CG1-CG 4.04Å; L291-M294 HydrophobicContact CB-SD 3.97Å; L291-M294 HydrophobicContact CD1-SD 4.18Å; L291-I328 HydrophobicContact CD1-CG2 3.71Å; L291-I345 PolarHBondContact N-O 2.88Å; L291-P346 HydrophobicContact CB-CB 4.3Å; L291-P346 CarbonylContact O-C 3.25Å; L291-P346 WeakPolarHBondContact O-CA 3.27Å; L291-I347 PolarHBondContact O-N 2.85Å
292	T	94.6	Very high	93.8	Very high	2 Å²	2	24.6 Å²	24.6	1%	0.012	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	137.1	176.6	-177.9	0	0	0	0	109	F225 A226 A227 M228 V230	F225-T292 HydrophobicContact CE1-CG2 3.96Å; F225-T292 HydrophobicContact CE2-CG2 4.24Å; F225-T292 HydrophobicContact CZ-CG2 3.49Å; F225-T292 VanDerWaalsContact CZ-CG2 3.49Å; A226-T292 PolarHBondContact O-N 2.84Å; A226-T292 VanDerWaalsContact O-O 3.06Å; A227-T292 CarbonylContact C-O 3.42Å; A227-T292 VanDerWaalsContact C-O 3.25Å; A227-T292 WeakPolarHBondContact CA-O 3.43Å; A227-T292 HydrophobicContact CB-CG2 4.35Å; M228-T292 PolarHBondContact N-O 2.88Å; V230-T292 HydrophobicContact CG1-CG2 4.45Å
293	D	94.4	Very high	93.8	Very high	17 Å²	17	24.5 Å²	24.5	9%	0.091	12%	0.116	C	C	.	.			cis	-101.8	127.2	-12.5	-174.4	-6.8	0	0	0	109.6	M228 S295 S296 Y297 L348 T349	M228-D293 PolarHBondContact O-N 2.98Å; D293-S295 PolarHBondContact O-N 3.24Å; D293-S295 WeakPolarHBondContact OD1-CB 3.36Å; D293-S295 PolarHBondContact OD1-N 2.89Å; D293-S296 PolarHBondContact O-N 2.92Å; D293-S296 VanDerWaalsContact O-N 3.17Å; D293-Y297 PolarHBondContact O-N 3.48Å; D293-L348 VanDerWaalsContact OD1-CA 3.28Å; D293-L348 WeakPolarHBondContact OD1-CA 3.33Å; D293-T349 PolarHBondContact OD1-N 3.27Å; D293-T349 VanDerWaalsContact OD1-N 3.1Å; D293-T349 WeakPolarHBondContact OD2-CB 3.48Å; D293-T349 WeakPolarHBondContact OD2-CG2 3.33Å; D293-T349 PolarHBondContact OD2-OG1 3.31Å
294	M	95.9	Very high	93.8	Very high	1 Å²	1	23.7 Å²	23.7	1%	0.005	11%	0.111	C	C	.	.	H	α-helix	trans	-66.2	-19.6	176.6	-66.6	-58.7	-57.2	0	0	112.7	M228 L291 Y297 A298 L325 I328 Y329 P346 I347 L348	M228-M294 HydrophobicContact CE-SD 3.83Å; L291-M294 HydrophobicContact CB-SD 3.97Å; L291-M294 HydrophobicContact CD1-SD 4.18Å; M294-Y297 HydrophobicContact CE-CD1 4.05Å; M294-Y297 HydrophobicContact CE-CG 4.23Å; M294-Y297 WeakPolarHBondContact O-CB 3.42Å; M294-Y297 PolarHBondContact O-N 2.89Å; M294-A298 PolarHBondContact O-N 3.26Å; M294-L325 HydrophobicContact CE-CD2 3.53Å; M294-I328 HydrophobicContact CE-CD1 4.46Å; M294-Y329 HydrophobicContact CE-CE1 3.95Å; M294-Y329 HydrophobicContact CG-CE1 4.43Å; M294-Y329 WeakPolarHBondContact CG-OH 3.33Å; M294-Y329 HydrophobicContact SD-CE1 4.34Å; M294-P346 HydrophobicContact CG-CB 3.91Å; M294-I347 PolarHBondContact N-O 3.01Å; M294-L348 HydrophobicContact CB-CB 4.05Å
295	S	95.1	Very high	93.8	Very high	5 Å²	5	18.8 Å²	18.8	4%	0.035	9%	0.088	C	C	.	.	H	α-helix	trans	-68.9	-42.5	171.6	-68.6	0	0	0	0	111.8	D293 Y297 A298 E299 T349	D293-S295 PolarHBondContact O-N 3.24Å; D293-S295 WeakPolarHBondContact OD1-CB 3.36Å; D293-S295 PolarHBondContact OD1-N 2.89Å; S295-Y297 VanDerWaalsContact C-N 3.28Å; S295-Y297 PolarHBondContact O-N 2.86Å; S295-A298 PolarHBondContact O-N 2.76Å; S295-E299 WeakPolarHBondContact O-CG 3.47Å; S295-E299 PolarHBondContact O-N 3.23Å; S295-T349 WeakPolarHBondContact CB-O 3.45Å; S295-T349 PolarHBondContact OG-N 3.14Å; S295-T349 PolarHBondContact OG-O 3.44Å
296	S	95	Very high	93.8	Very high	19 Å²	19	20.4 Å²	20.4	13%	0.133	11%	0.108	C	C	.	.	H	α-helix	trans	-65.2	-32.3	174.2	-60.7	0	0	0	0	112.5	M228 D293 A300	M228-S296 WeakPolarHBondContact O-CB 3.34Å; D293-S296 PolarHBondContact O-N 2.92Å; D293-S296 VanDerWaalsContact O-N 3.17Å; S296-A300 WeakPolarHBondContact O-CB 3.34Å; S296-A300 PolarHBondContact O-N 3.12Å; S296-A300 VanDerWaalsContact O-N 3.09Å
297	Y	96.1	Very high	93.7	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-61.9	-51.1	169.6	177.2	-88.9	0	0	0	111.7	M228 R265 P269 R270 D293 M294 S295 E299 A300 L301 D324 L325 I328	M228-Y297 HydrophobicContact SD-CD2 4.16Å; R265-Y297 VanDerWaalsContact O-CD2 3.3Å; R265-Y297 WeakPolarHBondContact O-CD2 3.44Å; P269-Y297 HydrophobicContact CG-CD2 3.73Å; P269-Y297 HydrophobicContact CG-CE2 3.6Å; R270-Y297 PolarHBondContact NH1-OH 3.28Å; D293-Y297 PolarHBondContact O-N 3.48Å; M294-Y297 HydrophobicContact CE-CD1 4.05Å; M294-Y297 HydrophobicContact CE-CG 4.23Å; M294-Y297 WeakPolarHBondContact O-CB 3.42Å; M294-Y297 PolarHBondContact O-N 2.89Å; S295-Y297 VanDerWaalsContact C-N 3.28Å; S295-Y297 PolarHBondContact O-N 2.86Å; Y297-E299 VanDerWaalsContact C-N 3.3Å; Y297-E299 PolarHBondContact O-N 3.49Å; Y297-A300 PolarHBondContact O-N 2.79Å; Y297-L301 PolarHBondContact O-N 3.18Å; Y297-D324 VanDerWaalsContact CE1-OD2 3.26Å; Y297-D324 WeakPolarHBondContact CE1-OD2 3.03Å; Y297-D324 VanDerWaalsContact CZ-OD2 3.26Å; Y297-D324 PolarHBondContact OH-OD2 3.48Å; Y297-L325 HydrophobicContact CD1-CD2 4.15Å; Y297-L325 HydrophobicContact CE1-CD2 4.2Å; Y297-I328 HydrophobicContact CE1-CD1 3.96Å; Y297-I328 HydrophobicContact CE2-CD1 3.79Å; Y297-I328 VanDerWaalsContact CZ-CD1 3.49Å
298	A	95.9	Very high	93.2	Very high	1 Å²	1	25.5 Å²	25.5	1%	0.008	14%	0.135	C	C	.	.	H	α-helix	trans	-64.5	-34.4	-179.2	0	0	0	0	0	112.6	M294 S295 L301 R302 F317 M321 I359	M294-A298 PolarHBondContact O-N 3.26Å; S295-A298 PolarHBondContact O-N 2.76Å; A298-L301 PolarHBondContact O-N 3.27Å; A298-R302 WeakPolarHBondContact O-CB 3.38Å; A298-R302 PolarHBondContact O-N 3.32Å; A298-F317 HydrophobicContact CB-CD1 4.38Å; A298-F317 HydrophobicContact CB-CE1 3.91Å; A298-M321 HydrophobicContact CB-SD 4.17Å; A298-I359 HydrophobicContact CB-CD1 3.83Å; A298-I359 HydrophobicContact CB-CG1 3.82Å
299	E	94.3	Very high	92.9	Very high	88 Å²	88	34.3 Å²	34.3	41%	0.411	18%	0.176	S	C	.	.	H	α-helix	trans	-66.5	-42.1	173.4	-74.2	-175.6	165.7	0	0	112.6	S295 Y297 L301 R302 E303	S295-E299 WeakPolarHBondContact O-CG 3.47Å; S295-E299 PolarHBondContact O-N 3.23Å; Y297-E299 VanDerWaalsContact C-N 3.3Å; Y297-E299 PolarHBondContact O-N 3.49Å; E299-L301 VanDerWaalsContact C-N 3.32Å; E299-L301 PolarHBondContact O-N 3.02Å; E299-R302 WeakPolarHBondContact O-CB 3.34Å; E299-R302 PolarHBondContact O-N 3.46Å; E299-E303 PolarHBondContact O-N 3.5Å
300	A	93.3	Very high	92.6	Very high	1 Å²	1	36.7 Å²	36.7	1%	0.008	19%	0.187	C	C	.	.	H	α-helix	trans	-61.9	-42.1	173.4	0	0	0	0	0	111	T262 R265 I266 S296 Y297 R302 E303 V304	T262-A300 WeakPolarHBondContact O-CB 3.16Å; R265-A300 HydrophobicContact CB-CB 4.18Å; I266-A300 HydrophobicContact CG1-CB 4.32Å; S296-A300 WeakPolarHBondContact O-CB 3.34Å; S296-A300 PolarHBondContact O-N 3.12Å; S296-A300 VanDerWaalsContact O-N 3.09Å; Y297-A300 PolarHBondContact O-N 2.79Å; A300-R302 VanDerWaalsContact C-N 3.31Å; A300-R302 PolarHBondContact O-N 2.92Å; A300-E303 WeakPolarHBondContact O-CB 3.31Å; A300-E303 PolarHBondContact O-N 2.67Å; A300-V304 WeakPolarHBondContact O-CG2 3.48Å; A300-V304 PolarHBondContact O-N 3.09Å
301	L	93.8	Very high	92.5	Very high	9 Å²	9	43 Å²	43	5%	0.047	23%	0.225	C	C	.	.	H	α-helix	trans	-61.9	-39.7	176	-162.6	70.7	0	0	0	111.9	I266 Y297 A298 E299 V304 S305 P318 Y320 M321 D324	I266-L301 HydrophobicContact CD1-CD1 4.47Å; Y297-L301 PolarHBondContact O-N 3.18Å; A298-L301 PolarHBondContact O-N 3.27Å; E299-L301 VanDerWaalsContact C-N 3.32Å; E299-L301 PolarHBondContact O-N 3.02Å; L301-V304 PolarHBondContact O-N 2.97Å; L301-S305 WeakPolarHBondContact O-CB 3.34Å; L301-S305 PolarHBondContact O-N 2.9Å; L301-P318 HydrophobicContact CD2-CG 3.79Å; L301-P318 HydrophobicContact CG-CG 3.84Å; L301-Y320 HydrophobicContact CD1-CE2 4.18Å; L301-Y320 HydrophobicContact CD2-CE2 4.25Å; L301-Y320 HydrophobicContact CG-CE2 4.25Å; L301-M321 HydrophobicContact CD2-CB 4.49Å; L301-M321 HydrophobicContact CD2-CG 4.39Å; L301-D324 HydrophobicContact CD2-CB 4.14Å; L301-D324 WeakPolarHBondContact CD2-OD2 3.33Å
302	R	94.1	Very high	92.4	Very high	94 Å²	94	47 Å²	47	36%	0.355	25%	0.251	S	S	.	.	H	α-helix	trans	-63.2	-43.5	173.7	-178.1	179.8	69.8	-175.7	-4.2	112.3	A298 E299 A300 V304 S305 A306 G316 F317	A298-R302 WeakPolarHBondContact O-CB 3.38Å; A298-R302 PolarHBondContact O-N 3.32Å; E299-R302 WeakPolarHBondContact O-CB 3.34Å; E299-R302 PolarHBondContact O-N 3.46Å; A300-R302 VanDerWaalsContact C-N 3.31Å; A300-R302 PolarHBondContact O-N 2.92Å; R302-V304 VanDerWaalsContact C-N 3.33Å; R302-V304 PolarHBondContact O-N 3.46Å; R302-S305 PolarHBondContact O-N 3.42Å; R302-A306 WeakPolarHBondContact O-CB 3.31Å; R302-A306 PolarHBondContact O-N 3.36Å; R302-G316 WeakPolarHBondContact CG-O 3.13Å; R302-F317 HydrophobicContact CB-CD1 3.97Å; R302-F317 HydrophobicContact CB-CE1 4.24Å; R302-F317 HydrophobicContact CG-CD1 4.49Å
303	E	90.9	Very high	92.3	Very high	94 Å²	94	48.7 Å²	48.7	44%	0.439	27%	0.269	S	S	.	.	H	α-helix	trans	-60.2	-44.6	178.1	-173.4	-175.3	177.5	0	0	111.3	T262 E299 A300 A306 A307	T262-E303 VanDerWaalsContact CB-OE2 3.26Å; T262-E303 WeakPolarHBondContact CB-OE2 3.31Å; T262-E303 VanDerWaalsContact CG2-OE2 3.26Å; T262-E303 WeakPolarHBondContact CG2-OE2 3.35Å; T262-E303 PolarHBondContact OG1-OE2 2.64Å; E299-E303 PolarHBondContact O-N 3.5Å; A300-E303 WeakPolarHBondContact O-CB 3.31Å; A300-E303 PolarHBondContact O-N 2.67Å; E303-A306 PolarHBondContact O-N 2.95Å; E303-A307 WeakPolarHBondContact O-CB 3.42Å; E303-A307 PolarHBondContact O-N 2.84Å
304	V	88.3	Confident	92.2	Very high	9 Å²	9	54.1 Å²	54.1	6%	0.055	29%	0.288	C	S	.	.	H	α-helix	trans	-65.3	-42.8	177.9	176.1	0	0	0	0	111.6	I266 A300 L301 R302 A307 R308	I266-V304 HydrophobicContact CD1-CB 4.38Å; I266-V304 HydrophobicContact CD1-CG2 3.64Å; A300-V304 WeakPolarHBondContact O-CG2 3.48Å; A300-V304 PolarHBondContact O-N 3.09Å; L301-V304 PolarHBondContact O-N 2.97Å; R302-V304 VanDerWaalsContact C-N 3.33Å; R302-V304 PolarHBondContact O-N 3.46Å; V304-A307 PolarHBondContact O-N 3.32Å; V304-R308 VanDerWaalsContact O-CG 3.31Å; V304-R308 WeakPolarHBondContact O-CG 3.3Å; V304-R308 PolarHBondContact O-N 2.95Å
305	S	91.1	Very high	91.9	Very high	3 Å²	3	60 Å²	60	2%	0.021	31%	0.31	C	S	.	.	H	α-helix	trans	-62.9	-42.6	176.7	-174.2	0	0	0	0	112.1	L301 R302 R308 E309 E310	L301-S305 WeakPolarHBondContact O-CB 3.34Å; L301-S305 PolarHBondContact O-N 2.9Å; R302-S305 PolarHBondContact O-N 3.42Å; S305-R308 PolarHBondContact O-N 3.2Å; S305-R308 VanDerWaalsContact O-N 3.17Å; S305-E309 PolarHBondContact O-N 3.33Å; S305-E310 WeakPolarHBondContact CA-OE2 3.09Å; S305-E310 VanDerWaalsContact CB-OE2 3.3Å; S305-E310 WeakPolarHBondContact CB-OE2 3.47Å; S305-E310 PolarHBondContact O-N 2.9Å; S305-E310 PolarHBondContact OG-OE2 2.79Å
306	A	90.2	Very high	91.8	Very high	69 Å²	69	61.4 Å²	61.4	57%	0.57	33%	0.325	S	S	*	.	H	α-helix	trans	-65.4	-40.3	176.9	0	0	0	0	0	112.1	R302 E303 R308 E309	R302-A306 WeakPolarHBondContact O-CB 3.31Å; R302-A306 PolarHBondContact O-N 3.36Å; E303-A306 PolarHBondContact O-N 2.95Å; A306-R308 PolarHBondContact O-N 3.41Å; A306-E309 PolarHBondContact O-N 2.99Å; A306-E309 VanDerWaalsContact O-N 3.07Å
307	A	87.2	Confident	91.8	Very high	38 Å²	38	60.7 Å²	60.7	31%	0.314	32%	0.32	S	S	.	.	H	α-helix	trans	-64.3	-22.3	175.4	0	0	0	0	0	113.3	P50 E303 V304	P50-A307 HydrophobicContact CG-CB 3.7Å; E303-A307 WeakPolarHBondContact O-CB 3.42Å; E303-A307 PolarHBondContact O-N 2.84Å; V304-A307 PolarHBondContact O-N 3.32Å
308	R	84.2	Confident	91.7	Very high	84 Å²	84	61 Å²	61	32%	0.317	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-0.4	175.7	-69	176.1	72.8	-152.7	-8.1	113.6	L51 V304 S305 A306 E310	L51-R308 HydrophobicContact CD1-CG 3.92Å; V304-R308 VanDerWaalsContact O-CG 3.31Å; V304-R308 WeakPolarHBondContact O-CG 3.3Å; V304-R308 PolarHBondContact O-N 2.95Å; S305-R308 PolarHBondContact O-N 3.2Å; S305-R308 VanDerWaalsContact O-N 3.17Å; A306-R308 PolarHBondContact O-N 3.41Å; R308-E310 HydrophobicContact CB-CG 3.9Å; R308-E310 IonicContact CZ-OE1 3.28Å; R308-E310 IonicContact NE-OE1 3.46Å; R308-E310 IonicContact NH1-OE1 2.76Å; R308-E310 PolarHBondContact NH1-OE1 3.18Å; R308-E310 IonicContact NH2-OE1 3.26Å; R308-E310 PolarHBondContact NH2-OE1 3.07Å; R308-E310 PolarHBondContact O-N 2.83Å
309	E	87.9	Confident	91.6	Very high	186 Å²	186	64.1 Å²	64.1	87%	0.869	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.4	34.3	-175.2	-57.5	-174.8	165.5	0	0	112.9	S305 A306	S305-E309 PolarHBondContact O-N 3.33Å; A306-E309 PolarHBondContact O-N 2.99Å; A306-E309 VanDerWaalsContact O-N 3.07Å
310	E	90.3	Very high	91.7	Very high	51 Å²	51	63.6 Å²	63.6	24%	0.238	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-69.9	156.1	175.7	-69.2	179.1	149.3	0	0	111.3	S305 R308 P312 Y320	S305-E310 WeakPolarHBondContact CA-OE2 3.09Å; S305-E310 VanDerWaalsContact CB-OE2 3.3Å; S305-E310 WeakPolarHBondContact CB-OE2 3.47Å; S305-E310 PolarHBondContact O-N 2.9Å; S305-E310 PolarHBondContact OG-OE2 2.79Å; R308-E310 HydrophobicContact CB-CG 3.9Å; R308-E310 IonicContact CZ-OE1 3.28Å; R308-E310 IonicContact NE-OE1 3.46Å; R308-E310 IonicContact NH1-OE1 2.76Å; R308-E310 PolarHBondContact NH1-OE1 3.18Å; R308-E310 IonicContact NH2-OE1 3.26Å; R308-E310 PolarHBondContact NH2-OE1 3.07Å; R308-E310 PolarHBondContact O-N 2.83Å; E310-P312 VanDerWaalsContact O-CD 3.24Å; E310-P312 WeakPolarHBondContact O-CD 3.41Å; E310-Y320 WeakPolarHBondContact OE2-CE1 3.29Å; E310-Y320 PolarHBondContact OE2-OH 2.88Å
311	V	93.7	Very high	91.8	Very high	131 Å²	131	63.9 Å²	63.9	79%	0.794	35%	0.35	S	S	*	.	P	Polyproline II helix	trans	-65.3	117	174.2	-178.8	0	0	0	0	109
312	P	94.4	Very high	91.9	Very high	86 Å²	86	68.7 Å²	68.7	56%	0.558	37%	0.368	S	S	*	.	B	Isolated β-bridge	trans	-73.7	144.8	-177.8	29.5	-33.7	0	0	0	111.1	E310	E310-P312 VanDerWaalsContact O-CD 3.24Å; E310-P312 WeakPolarHBondContact O-CD 3.41Å
313	G	92.4	Very high	92	Very high	36 Å²	36	68.4 Å²	68.4	37%	0.371	38%	0.377	S	S	.	.			trans	-87.8	-151.2	169.1	0	0	0	0	0	112.8	R315 G316 F317	G313-R315 PolarHBondContact O-N 3.23Å; G313-G316 PolarHBondContact O-N 2.99Å; G313-F317 WeakPolarHBondContact CA-O 3.33Å; G313-F317 PolarHBondContact N-O 3.43Å
314	R	91.8	Very high	92.2	Very high	131 Å²	131	65 Å²	65	49%	0.494	36%	0.362	S	S	.	.	G	3₁₀ helix	trans	-62.9	130.4	-177.8	-163.6	171.7	86.7	-162.2	3.5	110.6	G316 F317 T356 P358 D361	R314-G316 PolarHBondContact O-N 3.17Å; R314-G316 VanDerWaalsContact O-N 3.17Å; R314-F317 WeakPolarHBondContact O-CD2 3.41Å; R314-F317 PolarHBondContact O-N 2.66Å; R314-T356 PolarHBondContact NH2-O 2.89Å; R314-P358 HydrophobicContact CB-CG 4.33Å; R314-P358 HydrophobicContact CG-CG 4.26Å; R314-P358 VanDerWaalsContact NH2-CA 3.34Å; R314-D361 IonicContact CZ-OD2 2.78Å; R314-D361 IonicContact NH1-OD2 3.32Å; R314-D361 PolarHBondContact NH1-OD2 3.25Å; R314-D361 IonicContact NH2-OD2 3.01Å; R314-D361 PolarHBondContact NH2-OD2 3.18Å
315	R	90.3	Very high	92.6	Very high	125 Å²	125	64.6 Å²	64.6	47%	0.472	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	53.8	27.5	-178.4	-57.9	-167.7	-176.9	-178.4	6.6	114.4	G313 F317 D354 H357 P358	G313-R315 PolarHBondContact O-N 3.23Å; R315-F317 VanDerWaalsContact C-N 3.34Å; R315-F317 HydrophobicContact CB-CD2 4.25Å; R315-F317 HydrophobicContact CB-CE2 4.35Å; R315-F317 PolarHBondContact O-N 3.42Å; R315-D354 IonicContact CZ-OD2 3.35Å; R315-D354 IonicContact NH1-OD2 3.32Å; R315-D354 PolarHBondContact NH1-OD2 2.83Å; R315-D354 VanDerWaalsContact NH1-OD2 3.11Å; R315-D354 IonicContact NH2-OD2 2.67Å; R315-D354 PolarHBondContact NH2-OD2 2.79Å; R315-H357 PolarHBondContact NH1-CD2 3.38Å; R315-P358 HydrophobicContact CB-CG 4.17Å; R315-P358 HydrophobicContact CG-CG 4.15Å
316	G	92.5	Very high	92.9	Very high	34 Å²	34	65.4 Å²	65.4	35%	0.351	37%	0.366	S	S	.	.	G	3₁₀ helix	trans	85.5	-3.6	175.8	0	0	0	0	0	115.4	R302 G313 R314	R302-G316 WeakPolarHBondContact CG-O 3.13Å; G313-G316 PolarHBondContact O-N 2.99Å; R314-G316 PolarHBondContact O-N 3.17Å; R314-G316 VanDerWaalsContact O-N 3.17Å
317	F	95.2	Very high	93.2	Very high	5 Å²	5	65.3 Å²	65.3	2%	0.022	36%	0.359	C	S	.	.			trans	-71.6	153.8	175.1	-69.7	-79.9	0	0	0	111.8	A298 R302 G313 R314 R315 M321 H357 P358 I359	A298-F317 HydrophobicContact CB-CD1 4.38Å; A298-F317 HydrophobicContact CB-CE1 3.91Å; R302-F317 HydrophobicContact CB-CD1 3.97Å; R302-F317 HydrophobicContact CB-CE1 4.24Å; R302-F317 HydrophobicContact CG-CD1 4.49Å; G313-F317 WeakPolarHBondContact CA-O 3.33Å; G313-F317 PolarHBondContact N-O 3.43Å; R314-F317 WeakPolarHBondContact O-CD2 3.41Å; R314-F317 PolarHBondContact O-N 2.66Å; R315-F317 VanDerWaalsContact C-N 3.34Å; R315-F317 HydrophobicContact CB-CD2 4.25Å; R315-F317 HydrophobicContact CB-CE2 4.35Å; R315-F317 PolarHBondContact O-N 3.42Å; F317-M321 HydrophobicContact CB-CE 3.75Å; F317-M321 HydrophobicContact CB-SD 3.75Å; F317-M321 HydrophobicContact CD1-CE 4.17Å; F317-M321 HydrophobicContact CD1-SD 3.48Å; F317-M321 WeakPolarHBondContact CD1-SD 3.2Å; F317-M321 HydrophobicContact CD2-CE 4.28Å; F317-M321 HydrophobicContact CE1-SD 4.27Å; F317-M321 HydrophobicContact CG-CE 3.81Å; F317-M321 HydrophobicContact CG-SD 3.71Å; F317-H357 AromaticContact CE2-CE1 3.46Å; F317-H357 VanDerWaalsContact CE2-CE1 3.46Å; F317-H357 WeakPolarHBondContact CE2-CE1 3.49Å; F317-H357 AromaticContact CE2-NE2 3.87Å; F317-H357 AromaticContact CZ-CE1 3.7Å; F317-P358 HydrophobicContact CD2-CB 4.08Å; F317-P358 HydrophobicContact CD2-CG 4.04Å; F317-P358 HydrophobicContact CE2-CB 4.45Å; F317-P358 HydrophobicContact CE2-CG 4.32Å; F317-I359 HydrophobicContact CE1-CD1 4.15Å; F317-I359 HydrophobicContact CE1-CG1 4.3Å; F317-I359 HydrophobicContact CZ-CD1 3.78Å; F317-I359 HydrophobicContact CZ-CG1 4.07Å
318	P	95	Very high	93.6	Very high	6 Å²	6	63.6 Å²	63.6	4%	0.039	34%	0.344	C	S	.	.	B	Isolated β-bridge	trans	-63.4	148.4	178.3	19.3	-26.9	0	0	0	112.5	L301 Y320 M321	L301-P318 HydrophobicContact CD2-CG 3.79Å; L301-P318 HydrophobicContact CG-CG 3.84Å; P318-Y320 HydrophobicContact CB-CD1 3.94Å; P318-Y320 HydrophobicContact CB-CD2 4.12Å; P318-Y320 HydrophobicContact CB-CE1 3.54Å; P318-Y320 HydrophobicContact CB-CE2 3.74Å; P318-Y320 HydrophobicContact CB-CG 4.21Å; P318-Y320 VanDerWaalsContact CB-CZ 3.43Å; P318-Y320 HydrophobicContact CG-CD2 4.41Å; P318-Y320 HydrophobicContact CG-CE2 3.93Å; P318-Y320 PolarHBondContact O-N 2.97Å; P318-M321 HydrophobicContact CG-CB 4.31Å; P318-M321 WeakPolarHBondContact O-CB 3.42Å; P318-M321 PolarHBondContact O-N 2.8Å; P318-M321 VanDerWaalsContact O-N 3.17Å
319	G	93.8	Very high	94.2	Very high	67 Å²	67	59.6 Å²	59.6	69%	0.691	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-24.6	177	0	0	0	0	0	114.2
320	Y	94.9	Very high	94.6	Very high	77 Å²	77	54.2 Å²	54.2	30%	0.302	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	6.7	178.4	54.1	-96.4	0	0	0	114.2	L301 E310 P318 Y322 T323 D324	L301-Y320 HydrophobicContact CD1-CE2 4.18Å; L301-Y320 HydrophobicContact CD2-CE2 4.25Å; L301-Y320 HydrophobicContact CG-CE2 4.25Å; E310-Y320 WeakPolarHBondContact OE2-CE1 3.29Å; E310-Y320 PolarHBondContact OE2-OH 2.88Å; P318-Y320 HydrophobicContact CB-CD1 3.94Å; P318-Y320 HydrophobicContact CB-CD2 4.12Å; P318-Y320 HydrophobicContact CB-CE1 3.54Å; P318-Y320 HydrophobicContact CB-CE2 3.74Å; P318-Y320 HydrophobicContact CB-CG 4.21Å; P318-Y320 VanDerWaalsContact CB-CZ 3.43Å; P318-Y320 HydrophobicContact CG-CD2 4.41Å; P318-Y320 HydrophobicContact CG-CE2 3.93Å; P318-Y320 PolarHBondContact O-N 2.97Å; Y320-Y322 PolarHBondContact O-N 2.76Å; Y320-T323 PolarHBondContact O-N 2.82Å; Y320-T323 VanDerWaalsContact O-N 3.1Å; Y320-D324 HydrophobicContact CD2-CB 4.38Å; Y320-D324 PolarHBondContact O-N 2.66Å
321	M	95.4	Very high	94.8	Very high	6 Å²	6	52.6 Å²	52.6	3%	0.03	30%	0.296	C	S	.	.	H	α-helix	trans	-56.8	-35.4	-178.7	-175.3	168.9	71.3	0	0	112.9	A298 L301 F317 P318 D324 L325 P358 L362	A298-M321 HydrophobicContact CB-SD 4.17Å; L301-M321 HydrophobicContact CD2-CB 4.49Å; L301-M321 HydrophobicContact CD2-CG 4.39Å; F317-M321 HydrophobicContact CB-CE 3.75Å; F317-M321 HydrophobicContact CB-SD 3.75Å; F317-M321 HydrophobicContact CD1-CE 4.17Å; F317-M321 HydrophobicContact CD1-SD 3.48Å; F317-M321 WeakPolarHBondContact CD1-SD 3.2Å; F317-M321 HydrophobicContact CD2-CE 4.28Å; F317-M321 HydrophobicContact CE1-SD 4.27Å; F317-M321 HydrophobicContact CG-CE 3.81Å; F317-M321 HydrophobicContact CG-SD 3.71Å; P318-M321 HydrophobicContact CG-CB 4.31Å; P318-M321 WeakPolarHBondContact O-CB 3.42Å; P318-M321 PolarHBondContact O-N 2.8Å; P318-M321 VanDerWaalsContact O-N 3.17Å; M321-D324 PolarHBondContact O-N 2.7Å; M321-L325 HydrophobicContact CG-CD1 4.05Å; M321-L325 HydrophobicContact CG-CG 4.34Å; M321-L325 WeakPolarHBondContact O-CB 3.37Å; M321-L325 WeakPolarHBondContact O-CG 3.46Å; M321-L325 PolarHBondContact O-N 3.39Å; M321-P358 HydrophobicContact CE-CB 3.6Å; M321-L362 HydrophobicContact CB-CD1 4.17Å; M321-L362 HydrophobicContact CE-CD1 3.42Å; M321-L362 VanDerWaalsContact CE-CD1 3.42Å; M321-L362 HydrophobicContact CE-CG 4.4Å; M321-L362 HydrophobicContact CG-CD1 4.1Å
322	Y	96.6	Very high	94.8	Very high	111 Å²	111	46.4 Å²	46.4	44%	0.435	26%	0.259	S	S	.	.	H	α-helix	trans	-60.5	-51.1	175.5	175.7	-98.2	0	0	0	111.7	Y320 D324 A326 L362 F365 I366	Y320-Y322 PolarHBondContact O-N 2.76Å; Y322-D324 VanDerWaalsContact C-N 3.34Å; Y322-D324 PolarHBondContact O-N 2.74Å; Y322-A326 WeakPolarHBondContact O-CB 3.35Å; Y322-A326 PolarHBondContact O-N 3.02Å; Y322-L362 HydrophobicContact CD2-CD2 4.03Å; Y322-F365 HydrophobicContact CE2-CB 4.16Å; Y322-I366 HydrophobicContact CD2-CD1 3.98Å; Y322-I366 HydrophobicContact CD2-CG1 4Å; Y322-I366 HydrophobicContact CE2-CD1 4.06Å; Y322-I366 HydrophobicContact CE2-CG1 3.54Å
323	T	96.4	Very high	94.7	Very high	87 Å²	87	42.6 Å²	42.6	53%	0.534	23%	0.234	S	C	.	.	H	α-helix	trans	-64.6	-41	-179.8	-51.6	0	0	0	0	111.2	Y320 A326 T327	Y320-T323 PolarHBondContact O-N 2.82Å; Y320-T323 VanDerWaalsContact O-N 3.1Å; T323-A326 WeakPolarHBondContact O-CB 3.36Å; T323-A326 PolarHBondContact O-N 3.11Å; T323-T327 VanDerWaalsContact O-CG2 3.3Å; T323-T327 WeakPolarHBondContact O-CG2 3.37Å; T323-T327 PolarHBondContact O-N 3.35Å
324	D	95.6	Very high	94.7	Very high	23 Å²	23	42.8 Å²	42.8	12%	0.123	22%	0.224	C	C	.	.	H	α-helix	trans	-66	-45.1	-179	-169.9	68.9	0	0	0	111.9	R270 Y297 L301 Y320 M321 Y322 A326 T327	R270-D324 IonicContact CZ-OD1 3.3Å; R270-D324 IonicContact NH2-OD1 3.73Å; R270-D324 PolarHBondContact NH2-OD1 2.97Å; Y297-D324 VanDerWaalsContact CE1-OD2 3.26Å; Y297-D324 WeakPolarHBondContact CE1-OD2 3.03Å; Y297-D324 VanDerWaalsContact CZ-OD2 3.26Å; Y297-D324 PolarHBondContact OH-OD2 3.48Å; L301-D324 HydrophobicContact CD2-CB 4.14Å; L301-D324 WeakPolarHBondContact CD2-OD2 3.33Å; Y320-D324 HydrophobicContact CD2-CB 4.38Å; Y320-D324 PolarHBondContact O-N 2.66Å; M321-D324 PolarHBondContact O-N 2.7Å; Y322-D324 VanDerWaalsContact C-N 3.34Å; Y322-D324 PolarHBondContact O-N 2.74Å; D324-A326 VanDerWaalsContact C-N 3.31Å; D324-A326 PolarHBondContact O-N 3.22Å; D324-T327 PolarHBondContact O-N 3.27Å; D324-T327 PolarHBondContact O-OG1 2.83Å
325	L	96.8	Very high	94.7	Very high	1 Å²	1	37.4 Å²	37.4	1%	0.005	21%	0.206	C	C	.	.	H	α-helix	trans	-61.9	-37.8	171.5	-70.5	175.4	0	0	0	112.2	M294 Y297 M321 T327 I328 Y329 L362 I366	M294-L325 HydrophobicContact CE-CD2 3.53Å; Y297-L325 HydrophobicContact CD1-CD2 4.15Å; Y297-L325 HydrophobicContact CE1-CD2 4.2Å; M321-L325 HydrophobicContact CG-CD1 4.05Å; M321-L325 HydrophobicContact CG-CG 4.34Å; M321-L325 WeakPolarHBondContact O-CB 3.37Å; M321-L325 WeakPolarHBondContact O-CG 3.46Å; M321-L325 PolarHBondContact O-N 3.39Å; L325-T327 VanDerWaalsContact C-N 3.32Å; L325-T327 PolarHBondContact O-N 3.5Å; L325-I328 PolarHBondContact O-N 3.35Å; L325-I328 VanDerWaalsContact O-N 3.17Å; L325-Y329 HydrophobicContact CB-CD2 4.2Å; L325-Y329 HydrophobicContact CB-CE2 3.99Å; L325-Y329 HydrophobicContact CD2-CE2 4.25Å; L325-Y329 WeakPolarHBondContact O-CD2 3.48Å; L325-Y329 PolarHBondContact O-N 2.88Å; L325-L362 HydrophobicContact CD1-CB 4.31Å; L325-I366 HydrophobicContact CB-CD1 3.75Å
326	A	96.6	Very high	94.6	Very high	20 Å²	20	37.4 Å²	37.4	17%	0.165	21%	0.211	C	C	.	.	H	α-helix	trans	-63.6	-36.7	177.9	0	0	0	0	0	112.3	Y322 T323 D324 I328 Y329 E330 I366	Y322-A326 WeakPolarHBondContact O-CB 3.35Å; Y322-A326 PolarHBondContact O-N 3.02Å; T323-A326 WeakPolarHBondContact O-CB 3.36Å; T323-A326 PolarHBondContact O-N 3.11Å; D324-A326 VanDerWaalsContact C-N 3.31Å; D324-A326 PolarHBondContact O-N 3.22Å; A326-I328 PolarHBondContact O-N 2.96Å; A326-Y329 PolarHBondContact O-N 3.47Å; A326-E330 VanDerWaalsContact O-CB 3.29Å; A326-E330 WeakPolarHBondContact O-CB 3.45Å; A326-E330 WeakPolarHBondContact O-CG 3.45Å; A326-E330 PolarHBondContact O-N 3.18Å; A326-I366 HydrophobicContact CB-CD1 4.13Å; A326-I366 HydrophobicContact CB-CG1 4.4Å; A326-I366 HydrophobicContact CB-CG2 4.35Å
327	T	96.1	Very high	94.4	Very high	67 Å²	67	39.4 Å²	39.4	41%	0.411	23%	0.232	S	C	.	.	H	α-helix	trans	-62.9	-25.3	176.6	65.7	0	0	0	0	113.2	T323 D324 L325 R331	T323-T327 VanDerWaalsContact O-CG2 3.3Å; T323-T327 WeakPolarHBondContact O-CG2 3.37Å; T323-T327 PolarHBondContact O-N 3.35Å; D324-T327 PolarHBondContact O-N 3.27Å; D324-T327 PolarHBondContact O-OG1 2.83Å; L325-T327 VanDerWaalsContact C-N 3.32Å; L325-T327 PolarHBondContact O-N 3.5Å; T327-R331 WeakPolarHBondContact O-CD 3.37Å; T327-R331 WeakPolarHBondContact O-CG 3.02Å
328	I	96.4	Very high	94	Very high	1 Å²	1	44.9 Å²	44.9	1%	0.005	25%	0.252	C	S	.	.	H	α-helix	trans	-85.8	-53.5	176.5	-64.1	175.5	0	0	0	109.8	P269 L273 L291 M294 Y297 L325 A326 E330 R331 Q344	P269-I328 HydrophobicContact CB-CD1 4.23Å; P269-I328 HydrophobicContact CB-CG2 4.38Å; P269-I328 HydrophobicContact CG-CD1 3.89Å; L273-I328 HydrophobicContact CD1-CB 4.16Å; L273-I328 HydrophobicContact CD1-CG2 3.5Å; L273-I328 VanDerWaalsContact CD1-O 3.3Å; L273-I328 WeakPolarHBondContact CD1-O 3.34Å; L291-I328 HydrophobicContact CD1-CG2 3.71Å; M294-I328 HydrophobicContact CE-CD1 4.46Å; Y297-I328 HydrophobicContact CE1-CD1 3.96Å; Y297-I328 HydrophobicContact CE2-CD1 3.79Å; Y297-I328 VanDerWaalsContact CZ-CD1 3.49Å; L325-I328 PolarHBondContact O-N 3.35Å; L325-I328 VanDerWaalsContact O-N 3.17Å; A326-I328 PolarHBondContact O-N 2.96Å; I328-E330 PolarHBondContact O-N 3.01Å; I328-R331 PolarHBondContact O-N 3.18Å; I328-Q344 PolarHBondContact O-NE2 2.71Å; I328-Q344 VanDerWaalsContact O-NE2 3.1Å
329	Y	96.8	Very high	93.5	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-70.4	-33.2	-172.2	-63.5	-33.3	0	0	0	113.9	K182 M294 L325 A326 R331 A332 P346 T363 I366 T367	K182-Y329 WeakPolarHBondContact CD-O 3.48Å; M294-Y329 HydrophobicContact CE-CE1 3.95Å; M294-Y329 HydrophobicContact CG-CE1 4.43Å; M294-Y329 WeakPolarHBondContact CG-OH 3.33Å; M294-Y329 HydrophobicContact SD-CE1 4.34Å; L325-Y329 HydrophobicContact CB-CD2 4.2Å; L325-Y329 HydrophobicContact CB-CE2 3.99Å; L325-Y329 HydrophobicContact CD2-CE2 4.25Å; L325-Y329 WeakPolarHBondContact O-CD2 3.48Å; L325-Y329 PolarHBondContact O-N 2.88Å; A326-Y329 PolarHBondContact O-N 3.47Å; Y329-R331 PolarHBondContact O-N 3.44Å; Y329-A332 PolarHBondContact O-N 3.24Å; Y329-P346 HydrophobicContact CD1-CB 4.39Å; Y329-P346 HydrophobicContact CD1-CG 4.06Å; Y329-P346 HydrophobicContact CE1-CB 3.55Å; Y329-P346 HydrophobicContact CE1-CG 3.57Å; Y329-T363 HydrophobicContact CE2-CG2 3.69Å; Y329-T363 PolarHBondContact OH-OG1 2.81Å; Y329-I366 HydrophobicContact CD2-CB 4.16Å; Y329-I366 HydrophobicContact CD2-CD1 4.19Å; Y329-I366 HydrophobicContact CD2-CG2 3.87Å; Y329-I366 HydrophobicContact CG-CG2 4.34Å; Y329-T367 HydrophobicContact CD2-CG2 3.99Å; Y329-T367 HydrophobicContact CE2-CG2 4.31Å; Y329-T367 HydrophobicContact CG-CG2 4.14Å
330	E	95.5	Very high	93.3	Very high	74 Å²	74	43 Å²	43	35%	0.346	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	1.2	-178.8	-69.9	-61.7	159.3	0	0	114.1	R157 K182 A326 I328 A332	R157-E330 PolarHBondContact NH2-O 2.85Å; K182-E330 WeakPolarHBondContact CE-OE1 3.3Å; K182-E330 IonicContact NZ-OE1 3.26Å; K182-E330 PolarHBondContact NZ-OE1 2.74Å; K182-E330 IonicContact NZ-OE2 3.45Å; K182-E330 PolarHBondContact NZ-OE2 3.4Å; A326-E330 VanDerWaalsContact O-CB 3.29Å; A326-E330 WeakPolarHBondContact O-CB 3.45Å; A326-E330 WeakPolarHBondContact O-CG 3.45Å; A326-E330 PolarHBondContact O-N 3.18Å; I328-E330 PolarHBondContact O-N 3.01Å; E330-A332 PolarHBondContact O-N 3.31Å
331	R	95.1	Very high	93.1	Very high	16 Å²	16	39.4 Å²	39.4	6%	0.06	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-8.6	173.3	-66.9	174.6	67.6	174.5	7.7	113	I147 L273 T274 E277 T327 I328 Y329	I147-R331 PolarHBondContact O-NH1 2.72Å; L273-R331 VanDerWaalsContact CB-CZ 3.47Å; L273-R331 HydrophobicContact CD1-CB 4.38Å; T274-R331 VanDerWaalsContact CA-NH2 3.32Å; T274-R331 PolarHBondContact OG1-NH2 3.2Å; E277-R331 WeakPolarHBondContact OE1-CB 3.31Å; E277-R331 WeakPolarHBondContact OE1-CG 3Å; E277-R331 IonicContact OE1-CZ 2.75Å; E277-R331 IonicContact OE1-NE 2.75Å; E277-R331 PolarHBondContact OE1-NE 3.28Å; E277-R331 IonicContact OE1-NH2 3.47Å; E277-R331 PolarHBondContact OE1-NH2 2.89Å; E277-R331 IonicContact OE2-CZ 2.77Å; E277-R331 IonicContact OE2-NE 2.94Å; E277-R331 IonicContact OE2-NH2 3.33Å; E277-R331 PolarHBondContact OE2-NH2 3.25Å; T327-R331 WeakPolarHBondContact O-CD 3.37Å; T327-R331 WeakPolarHBondContact O-CG 3.02Å; I328-R331 PolarHBondContact O-N 3.18Å; Y329-R331 PolarHBondContact O-N 3.44Å
332	A	93.8	Very high	93.1	Very high	2 Å²	2	39.1 Å²	39.1	2%	0.017	22%	0.219	C	C	.	.			trans	-73.5	153.4	172.9	0	0	0	0	0	112.4	R157 K182 Y329 E330 Q344	R157-A332 PolarHBondContact NH1-O 3.23Å; K182-A332 HydrophobicContact CB-CB 4.12Å; Y329-A332 PolarHBondContact O-N 3.24Å; E330-A332 PolarHBondContact O-N 3.31Å; A332-Q344 HydrophobicContact CB-CB 4.25Å; A332-Q344 HydrophobicContact CB-CG 3.77Å
333	G	92.6	Very high	93.1	Very high	5 Å²	5	34 Å²	34	5%	0.052	20%	0.199	C	C	.	.	B	Isolated β-bridge	trans	138.2	-166.1	171	0	0	0	0	0	115.3	G180 I342	G180-G333 WeakPolarHBondContact O-CA 3.42Å; G180-G333 PolarHBondContact O-N 2.8Å; G333-I342 PolarHBondContact N-O 2.79Å; G333-I342 PolarHBondContact O-N 2.88Å
334	R	91.6	Very high	93.1	Very high	41 Å²	41	29.9 Å²	29.9	16%	0.155	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	146	175.2	-68.8	179.4	69.2	168.1	0.8	109.4	R157 I158 E162 R179	R157-R334 WeakPolarHBondContact CA-O 3.49Å; I158-R334 HydrophobicContact CB-CB 4.14Å; I158-R334 PolarHBondContact N-O 3.25Å; E162-R334 IonicContact OE1-CZ 2.9Å; E162-R334 IonicContact OE1-NH1 3.59Å; E162-R334 PolarHBondContact OE1-NH1 3.35Å; E162-R334 IonicContact OE1-NH2 2.56Å; E162-R334 PolarHBondContact OE1-NH2 2.9Å; E162-R334 IonicContact OE2-NH1 3.47Å; R179-R334 VanDerWaalsContact CZ-CZ 3.47Å; R179-R334 VanDerWaalsContact NH2-NH2 3.2Å
335	V	91.6	Very high	93.1	Very high	17 Å²	17	29 Å²	29	10%	0.103	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	146.5	178.2	-60.5	0	0	0	0	110.7	I152 S156 Y281 R338	I152-V335 HydrophobicContact CD1-CG1 4.24Å; I152-V335 HydrophobicContact CG2-CG1 3.73Å; S156-V335 CarbonylContact O-C 3.53Å; S156-V335 WeakPolarHBondContact O-CA 3.26Å; Y281-V335 HydrophobicContact CD1-CG1 4.49Å; Y281-V335 HydrophobicContact CD1-CG2 3.66Å; Y281-V335 HydrophobicContact CE1-CB 4.43Å; Y281-V335 HydrophobicContact CE1-CG1 3.9Å; Y281-V335 HydrophobicContact CE1-CG2 3.77Å; Y281-V335 HydrophobicContact CG-CG2 4.49Å; V335-R338 HydrophobicContact CG2-CB 3.72Å; V335-R338 HydrophobicContact CG2-CG 3.73Å
336	E	89.6	Confident	93.2	Very high	126 Å²	126	28.9 Å²	28.9	59%	0.589	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.2	135.2	177.2	-168.9	178.2	-162.8	0	0	111	S156 I158	S156-E336 PolarHBondContact O-N 3.4Å; I158-E336 HydrophobicContact CD1-CB 4.07Å; I158-E336 HydrophobicContact CD1-CG 4.3Å; I158-E336 HydrophobicContact CG1-CB 4.04Å
337	G	86.4	Confident	93.2	Very high	76 Å²	76	28 Å²	28	78%	0.784	16%	0.161	S	C	*	.	T	Hydrogen-bonded Turn	trans	81	5.9	179.6	0	0	0	0	0	115.6
338	R	88.6	Confident	93.2	Very high	119 Å²	119	24.8 Å²	24.8	45%	0.449	14%	0.141	S	C	.	.			trans	-127.1	139.9	171.8	-52.4	-170.8	-179	-149.2	6.8	111	Y281 V335	Y281-R338 VanDerWaalsContact CB-NH1 3.34Å; Y281-R338 VanDerWaalsContact O-CD 3.25Å; Y281-R338 WeakPolarHBondContact O-CD 3.35Å; Y281-R338 PolarHBondContact O-NH1 3.29Å; V335-R338 HydrophobicContact CG2-CB 3.72Å; V335-R338 HydrophobicContact CG2-CG 3.73Å
339	G	84	Confident	93.1	Very high	35 Å²	35	26 Å²	26	36%	0.361	15%	0.149	S	C	.	.	S	Bend	trans	-73.2	-32.1	-177.3	0	0	0	0	0	114.6	R179 H286	R179-G339 PolarHBondContact NH2-O 3.03Å; H286-G339 PolarHBondContact CE1-O 3.04Å; H286-G339 VanDerWaalsContact CE1-O 3.28Å
340	G	88.3	Confident	93	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	15%	0.15	C	C	.	.			trans	-75.6	173.4	-173.2	0	0	0	0	0	115.3	A280 E284 K285	A280-G340 VanDerWaalsContact O-CA 3.28Å; A280-G340 WeakPolarHBondContact O-CA 3.38Å; E284-G340 WeakPolarHBondContact O-CA 3.46Å; K285-G340 VanDerWaalsContact O-CA 3.24Å; K285-G340 WeakPolarHBondContact O-CA 3.28Å
341	S	92.4	Very high	92.9	Very high	1 Å²	1	24.6 Å²	24.6	1%	0.007	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	151.6	-177.4	60.7	0	0	0	0	112	R179 K285 H286 V287	R179-S341 WeakPolarHBondContact CD-OG 3.17Å; R179-S341 VanDerWaalsContact CG-OG 3.3Å; R179-S341 WeakPolarHBondContact CG-OG 3.2Å; R179-S341 PolarHBondContact NE-OG 2.73Å; K285-S341 PolarHBondContact O-N 3.27Å; H286-S341 PolarHBondContact ND1-OG 2.85Å; V287-S341 PolarHBondContact N-O 3.06Å
342	I	95.5	Very high	92.7	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	112.5	177.3	-54.8	174	0	0	0	109.3	G180 E277 A280 Y281 V287 V289 G333 Q344	G180-I342 WeakPolarHBondContact CA-O 3.43Å; E277-I342 HydrophobicContact CB-CD1 4.25Å; E277-I342 HydrophobicContact CG-CD1 3.57Å; A280-I342 HydrophobicContact CB-CD1 4Å; A280-I342 HydrophobicContact CB-CG1 3.38Å; Y281-I342 HydrophobicContact CD2-CD1 4.39Å; Y281-I342 HydrophobicContact CE2-CD1 3.7Å; V287-I342 WeakPolarHBondContact O-CA 3.45Å; V289-I342 HydrophobicContact CG2-CG2 3.76Å; G333-I342 PolarHBondContact N-O 2.79Å; G333-I342 PolarHBondContact O-N 2.88Å; I342-Q344 HydrophobicContact CG2-CG 4.32Å
343	T	95.4	Very high	92.6	Very high	3 Å²	3	33.8 Å²	33.8	2%	0.018	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	132.6	171.1	-55.1	0	0	0	0	108.6	I164 I177 G180 Q181 V287 L288 V289	I164-T343 HydrophobicContact CD1-CG2 3.77Å; I164-T343 WeakPolarHBondContact CD1-OG1 3.43Å; I177-T343 HydrophobicContact CG2-CG2 4.24Å; G180-T343 PolarHBondContact N-OG1 3.39Å; Q181-T343 WeakPolarHBondContact O-CG2 3.34Å; V287-T343 PolarHBondContact O-N 3.06Å; L288-T343 HydrophobicContact CD1-CG2 4.01Å; V289-T343 PolarHBondContact N-O 3.16Å
344	Q	96.4	Very high	92.7	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	128.6	179.8	-69.8	-172.4	21.8	0	0	111.5	Q181 K182 I183 L273 V289 I328 A332 I342 P346	Q181-Q344 PolarHBondContact O-N 3.37Å; K182-Q344 HydrophobicContact CB-CB 4.37Å; I183-Q344 PolarHBondContact N-O 2.87Å; L273-Q344 HydrophobicContact CD2-CG 4.34Å; L273-Q344 VanDerWaalsContact CD2-NE2 3.27Å; V289-Q344 HydrophobicContact CB-CG 4.24Å; V289-Q344 WeakPolarHBondContact O-CA 3.36Å; I328-Q344 PolarHBondContact O-NE2 2.71Å; I328-Q344 VanDerWaalsContact O-NE2 3.1Å; A332-Q344 HydrophobicContact CB-CB 4.25Å; A332-Q344 HydrophobicContact CB-CG 3.77Å; I342-Q344 HydrophobicContact CG2-CG 4.32Å; Q344-P346 VanDerWaalsContact C-CD 3.46Å; Q344-P346 WeakPolarHBondContact O-CD 3.15Å
345	I	96.6	Very high	92.8	Very high	4 Å²	4	36.8 Å²	36.8	2%	0.021	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	80.8	170.3	-55	179.6	0	0	0	108.9	I177 I183 I185 I200 L288 V289 I290 L291	I177-I345 HydrophobicContact CD1-CD1 4.38Å; I183-I345 HydrophobicContact CG2-CG1 4.29Å; I183-I345 WeakPolarHBondContact O-CA 3.47Å; I185-I345 HydrophobicContact CD1-CG2 3.7Å; I185-I345 HydrophobicContact CG1-CG2 3.81Å; I200-I345 HydrophobicContact CG2-CD1 3.81Å; L288-I345 HydrophobicContact CD1-CD1 3.7Å; L288-I345 HydrophobicContact CD1-CG1 3.93Å; V289-I345 PolarHBondContact O-N 3Å; I290-I345 WeakPolarHBondContact CA-O 3.43Å; I290-I345 HydrophobicContact CG1-CB 4.45Å; L291-I345 PolarHBondContact N-O 2.88Å
346	P	97.2	Very high	92.9	Very high	0 Å²	0	40 Å²	40	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	135.2	174	27.6	-30.3	0	0	0	111	P184 I185 L291 M294 Y329 Q344	P184-P346 CarbonylContact C-O 3.45Å; P184-P346 WeakPolarHBondContact CA-O 3.46Å; P184-P346 HydrophobicContact CB-CG 3.96Å; P184-P346 WeakPolarHBondContact CB-O 3.21Å; I185-P346 PolarHBondContact N-O 3.24Å; L291-P346 HydrophobicContact CB-CB 4.3Å; L291-P346 CarbonylContact O-C 3.25Å; L291-P346 WeakPolarHBondContact O-CA 3.27Å; M294-P346 HydrophobicContact CG-CB 3.91Å; Y329-P346 HydrophobicContact CD1-CB 4.39Å; Y329-P346 HydrophobicContact CD1-CG 4.06Å; Y329-P346 HydrophobicContact CE1-CB 3.55Å; Y329-P346 HydrophobicContact CE1-CG 3.57Å; Q344-P346 VanDerWaalsContact C-CD 3.46Å; Q344-P346 WeakPolarHBondContact O-CD 3.15Å
347	I	96.9	Very high	93.2	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	130.3	179.5	-53.3	176	0	0	0	107.4	I185 H193 A197 I290 L291 M294	I185-I347 HydrophobicContact CB-CG1 4.3Å; I185-I347 HydrophobicContact CB-CG2 4.48Å; I185-I347 HydrophobicContact CD1-CG1 4.38Å; H193-I347 HydrophobicContact CB-CG2 4.12Å; A197-I347 HydrophobicContact CB-CD1 3.35Å; I290-I347 HydrophobicContact CG2-CD1 3.81Å; I290-I347 HydrophobicContact CG2-CG1 4.3Å; L291-I347 PolarHBondContact O-N 2.85Å; M294-I347 PolarHBondContact N-O 3.01Å
348	L	95.9	Very high	93.6	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	140.9	175.3	68.5	87.8	0	0	0	111.6	I185 F186 S187 D293 M294 M350 I359 P360 T363	I185-L348 PolarHBondContact O-N 3.35Å; F186-L348 HydrophobicContact CB-CD1 4.45Å; F186-L348 HydrophobicContact CD1-CD1 3.74Å; F186-L348 HydrophobicContact CD1-CD2 3.6Å; F186-L348 HydrophobicContact CD1-CG 3.6Å; F186-L348 HydrophobicContact CE1-CD1 4.22Å; F186-L348 HydrophobicContact CE1-CD2 3.39Å; F186-L348 HydrophobicContact CE1-CG 3.98Å; F186-L348 HydrophobicContact CG-CD1 4.11Å; F186-L348 HydrophobicContact CG-CG 4.43Å; F186-L348 HydrophobicContact CZ-CD2 4.32Å; S187-L348 PolarHBondContact N-O 2.96Å; D293-L348 VanDerWaalsContact OD1-CA 3.28Å; D293-L348 WeakPolarHBondContact OD1-CA 3.33Å; M294-L348 HydrophobicContact CB-CB 4.05Å; L348-M350 HydrophobicContact CD1-CG 3.61Å; L348-I359 HydrophobicContact CD2-CG2 4.3Å; L348-P360 HydrophobicContact CD1-CB 4.07Å; L348-T363 HydrophobicContact CD2-CG2 3.83Å
349	T	95.6	Very high	93.9	Very high	27 Å²	27	25.6 Å²	25.6	17%	0.166	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	114.4	171.1	61.6	0	0	0	0	110.7	S187 D293 S295 P351	S187-T349 CarbonylContact O-C 3.53Å; S187-T349 WeakPolarHBondContact O-CA 3.2Å; D293-T349 PolarHBondContact OD1-N 3.27Å; D293-T349 VanDerWaalsContact OD1-N 3.1Å; D293-T349 WeakPolarHBondContact OD2-CB 3.48Å; D293-T349 WeakPolarHBondContact OD2-CG2 3.33Å; D293-T349 PolarHBondContact OD2-OG1 3.31Å; S295-T349 WeakPolarHBondContact CB-O 3.45Å; S295-T349 PolarHBondContact OG-N 3.14Å; S295-T349 PolarHBondContact OG-O 3.44Å; T349-P351 WeakPolarHBondContact O-CD 3.5Å
350	M	94.8	Very high	94.5	Very high	4 Å²	4	24 Å²	24	2%	0.02	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	124.7	178.5	-61.3	178.9	-65.4	0	0	109.8	F186 S187 L348 N352 D353 I355 P360 Y372	F186-M350 HydrophobicContact CB-CE 4.05Å; F186-M350 HydrophobicContact CB-SD 3.95Å; F186-M350 HydrophobicContact CD2-SD 4.05Å; F186-M350 HydrophobicContact CG-SD 4.26Å; S187-M350 WeakPolarHBondContact O-CB 3.23Å; S187-M350 WeakPolarHBondContact O-CE 3.45Å; S187-M350 PolarHBondContact O-N 2.97Å; L348-M350 HydrophobicContact CD1-CG 3.61Å; M350-N352 PolarHBondContact O-N 3.46Å; M350-D353 PolarHBondContact O-N 3.49Å; M350-I355 HydrophobicContact SD-CB 4.32Å; M350-I355 HydrophobicContact SD-CG1 4.43Å; M350-P360 HydrophobicContact CG-CB 4.11Å; M350-P360 HydrophobicContact CG-CG 3.98Å; M350-P360 HydrophobicContact SD-CB 4.17Å; M350-P360 HydrophobicContact SD-CG 4.3Å; M350-Y372 HydrophobicContact CE-CD2 4.23Å; M350-Y372 HydrophobicContact CE-CE2 3.49Å; M350-Y372 VanDerWaalsContact CE-CE2 3.49Å; M350-Y372 HydrophobicContact SD-CE2 4.02Å
351	P	92.6	Very high	94.9	Very high	40 Å²	40	26.2 Å²	26.2	26%	0.26	15%	0.146	S	C	.	.	G	3₁₀ helix	trans	-63.9	130.5	173.4	-23.3	35.9	0	0	0	110.6	T349 D353 D354	T349-P351 WeakPolarHBondContact O-CD 3.5Å; P351-D353 PolarHBondContact O-N 3.34Å; P351-D354 WeakPolarHBondContact O-CB 2.86Å; P351-D354 PolarHBondContact O-N 2.8Å; P351-D354 VanDerWaalsContact O-N 3.14Å
352	N	91.3	Very high	95	Very high	155 Å²	155	27.8 Å²	27.8	83%	0.829	15%	0.154	S	C	*	.	G	3₁₀ helix	trans	55.9	27.7	179.6	-54.1	-39	0	0	0	114.9	M350 D354	M350-N352 PolarHBondContact O-N 3.46Å; N352-D354 PolarHBondContact O-N 2.86Å; N352-D354 VanDerWaalsContact O-N 3.12Å
353	D	92.3	Very high	95.1	Very high	56 Å²	56	27.8 Å²	27.8	30%	0.299	15%	0.154	S	C	.	.	G	3₁₀ helix	trans	57.5	23	-176.6	-49.2	-12	0	0	0	112.9	A188 M350 P351 I355 R375	A188-D353 WeakPolarHBondContact CB-OD1 3.38Å; M350-D353 PolarHBondContact O-N 3.49Å; P351-D353 PolarHBondContact O-N 3.34Å; D353-I355 PolarHBondContact O-N 2.91Å; D353-R375 IonicContact OD1-CZ 2.72Å; D353-R375 IonicContact OD1-NE 2.72Å; D353-R375 IonicContact OD1-NH2 3.48Å; D353-R375 PolarHBondContact OD1-NH2 3.48Å; D353-R375 IonicContact OD2-CZ 3.56Å; D353-R375 IonicContact OD2-NE 3.41Å; D353-R375 PolarHBondContact OD2-NE 2.98Å; D353-R375 IonicContact OD2-NH2 3.6Å
354	D	93.6	Very high	95	Very high	39 Å²	39	28.4 Å²	28.4	21%	0.209	16%	0.161	C	C	.	.			trans	-90.5	104	-174.9	178	15.7	0	0	0	111.9	R315 P351 N352 T356 H357	R315-D354 IonicContact CZ-OD2 3.35Å; R315-D354 IonicContact NH1-OD2 3.32Å; R315-D354 PolarHBondContact NH1-OD2 2.83Å; R315-D354 VanDerWaalsContact NH1-OD2 3.11Å; R315-D354 IonicContact NH2-OD2 2.67Å; R315-D354 PolarHBondContact NH2-OD2 2.79Å; P351-D354 WeakPolarHBondContact O-CB 2.86Å; P351-D354 PolarHBondContact O-N 2.8Å; P351-D354 VanDerWaalsContact O-N 3.14Å; N352-D354 PolarHBondContact O-N 2.86Å; N352-D354 VanDerWaalsContact O-N 3.12Å; D354-T356 PolarHBondContact O-N 3.49Å; D354-T356 WeakPolarHBondContact OD1-CA 3.48Å; D354-T356 WeakPolarHBondContact OD1-CB 3.34Å; D354-T356 PolarHBondContact OD1-N 3.04Å; D354-T356 PolarHBondContact OD1-OG1 3.1Å; D354-T356 PolarHBondContact OD2-OG1 3.03Å; D354-H357 HydrophobicContact CB-CB 4.46Å; D354-H357 WeakPolarHBondContact O-CB 3.33Å; D354-H357 PolarHBondContact O-N 3.34Å; D354-H357 VanDerWaalsContact O-N 3.16Å
355	I	93.4	Very high	95	Very high	71 Å²	71	34.6 Å²	34.6	36%	0.364	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-20.3	176.2	-162.2	171	0	0	0	113.3	F186 M350 D353 H357 P360 Y372	F186-I355 HydrophobicContact CD2-CG1 4.41Å; F186-I355 HydrophobicContact CE2-CG1 4.44Å; M350-I355 HydrophobicContact SD-CB 4.32Å; M350-I355 HydrophobicContact SD-CG1 4.43Å; D353-I355 PolarHBondContact O-N 2.91Å; I355-H357 PolarHBondContact O-N 3.32Å; I355-P360 WeakPolarHBondContact O-CG 3.41Å; I355-Y372 HydrophobicContact CD1-CD2 4.24Å; I355-Y372 HydrophobicContact CD1-CE2 4.01Å; I355-Y372 HydrophobicContact CG1-CE2 4.47Å
356	T	94.1	Very high	95	Very high	83 Å²	83	35 Å²	35	51%	0.509	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-1.6	178.2	75.7	0	0	0	0	112.8	R314 D354	R314-T356 PolarHBondContact NH2-O 2.89Å; D354-T356 PolarHBondContact O-N 3.49Å; D354-T356 WeakPolarHBondContact OD1-CA 3.48Å; D354-T356 WeakPolarHBondContact OD1-CB 3.34Å; D354-T356 PolarHBondContact OD1-N 3.04Å; D354-T356 PolarHBondContact OD1-OG1 3.1Å; D354-T356 PolarHBondContact OD2-OG1 3.03Å
357	H	95.8	Very high	94.9	Very high	12 Å²	12	35 Å²	35	6%	0.056	19%	0.19	C	C	.	.	S	Bend	trans	-57.6	142.6	174.4	-171.8	-81.7	0	0	0	110.6	R315 F317 D354 I355 I359 P360 D361	R315-H357 PolarHBondContact NH1-CD2 3.38Å; F317-H357 AromaticContact CE2-CE1 3.46Å; F317-H357 VanDerWaalsContact CE2-CE1 3.46Å; F317-H357 WeakPolarHBondContact CE2-CE1 3.49Å; F317-H357 AromaticContact CE2-NE2 3.87Å; F317-H357 AromaticContact CZ-CE1 3.7Å; D354-H357 HydrophobicContact CB-CB 4.46Å; D354-H357 WeakPolarHBondContact O-CB 3.33Å; D354-H357 PolarHBondContact O-N 3.34Å; D354-H357 VanDerWaalsContact O-N 3.16Å; I355-H357 PolarHBondContact O-N 3.32Å; H357-I359 VanDerWaalsContact CE1-CD1 3.47Å; H357-I359 WeakPolarHBondContact CE1-CD1 3.38Å; H357-I359 PolarHBondContact ND1-N 2.84Å; H357-I359 PolarHBondContact O-N 3.04Å; H357-P360 HydrophobicContact CB-CG 3.82Å; H357-P360 WeakPolarHBondContact O-CD 3.41Å; H357-P360 VanDerWaalsContact O-CG 3.27Å; H357-P360 WeakPolarHBondContact O-CG 3.26Å; H357-D361 WeakPolarHBondContact O-CB 3.21Å; H357-D361 PolarHBondContact O-N 3.27Å
358	P	95.3	Very high	94.8	Very high	4 Å²	4	37 Å²	37	3%	0.026	20%	0.2	C	C	.	.	H	α-helix	trans	-48.2	-37.4	179.9	-28.2	29.9	0	0	0	115.7	R314 R315 F317 M321 L362	R314-P358 HydrophobicContact CB-CG 4.33Å; R314-P358 HydrophobicContact CG-CG 4.26Å; R314-P358 VanDerWaalsContact NH2-CA 3.34Å; R315-P358 HydrophobicContact CB-CG 4.17Å; R315-P358 HydrophobicContact CG-CG 4.15Å; F317-P358 HydrophobicContact CD2-CB 4.08Å; F317-P358 HydrophobicContact CD2-CG 4.04Å; F317-P358 HydrophobicContact CE2-CB 4.45Å; F317-P358 HydrophobicContact CE2-CG 4.32Å; M321-P358 HydrophobicContact CE-CB 3.6Å; P358-L362 WeakPolarHBondContact O-CB 3.42Å; P358-L362 WeakPolarHBondContact O-CG 3.15Å; P358-L362 PolarHBondContact O-N 2.73Å
359	I	95.5	Very high	94.8	Very high	3 Å²	3	37 Å²	37	2%	0.015	20%	0.2	C	C	.	.	H	α-helix	trans	-64.9	-60.7	-177.7	-58.7	165	0	0	0	112.2	A298 F317 L348 H357 D361 T363	A298-I359 HydrophobicContact CB-CD1 3.83Å; A298-I359 HydrophobicContact CB-CG1 3.82Å; F317-I359 HydrophobicContact CE1-CD1 4.15Å; F317-I359 HydrophobicContact CE1-CG1 4.3Å; F317-I359 HydrophobicContact CZ-CD1 3.78Å; F317-I359 HydrophobicContact CZ-CG1 4.07Å; L348-I359 HydrophobicContact CD2-CG2 4.3Å; H357-I359 VanDerWaalsContact CE1-CD1 3.47Å; H357-I359 WeakPolarHBondContact CE1-CD1 3.38Å; H357-I359 PolarHBondContact ND1-N 2.84Å; H357-I359 PolarHBondContact O-N 3.04Å; I359-D361 VanDerWaalsContact C-N 3.34Å; I359-D361 PolarHBondContact O-N 2.85Å; I359-T363 VanDerWaalsContact O-CB 3.31Å; I359-T363 WeakPolarHBondContact O-CB 3.49Å; I359-T363 PolarHBondContact O-N 2.9Å; I359-T363 PolarHBondContact O-OG1 3.16Å
360	P	96.1	Very high	94.8	Very high	2 Å²	2	37.4 Å²	37.4	1%	0.013	20%	0.199	C	C	.	.	H	α-helix	trans	-63.5	-37	176.1	23.2	-33.9	0	0	0	112.7	F186 L348 M350 I355 H357 T363 G364	F186-P360 HydrophobicContact CD2-CB 3.98Å; F186-P360 HydrophobicContact CE1-CB 4.44Å; F186-P360 HydrophobicContact CE2-CB 3.6Å; F186-P360 HydrophobicContact CZ-CB 3.87Å; F186-P360 WeakPolarHBondContact CZ-O 3.35Å; L348-P360 HydrophobicContact CD1-CB 4.07Å; M350-P360 HydrophobicContact CG-CB 4.11Å; M350-P360 HydrophobicContact CG-CG 3.98Å; M350-P360 HydrophobicContact SD-CB 4.17Å; M350-P360 HydrophobicContact SD-CG 4.3Å; I355-P360 WeakPolarHBondContact O-CG 3.41Å; H357-P360 HydrophobicContact CB-CG 3.82Å; H357-P360 WeakPolarHBondContact O-CD 3.41Å; H357-P360 VanDerWaalsContact O-CG 3.27Å; H357-P360 WeakPolarHBondContact O-CG 3.26Å; P360-T363 PolarHBondContact O-N 3.23Å; P360-G364 PolarHBondContact O-N 2.5Å
361	D	95.4	Very high	94.9	Very high	46 Å²	46	37.3 Å²	37.3	25%	0.246	20%	0.199	C	C	.	.	H	α-helix	trans	-60.9	-52.6	179.7	-169.6	33.9	0	0	0	111.4	R314 H357 I359 T363 G364 F365	R314-D361 IonicContact CZ-OD2 2.78Å; R314-D361 IonicContact NH1-OD2 3.32Å; R314-D361 PolarHBondContact NH1-OD2 3.25Å; R314-D361 IonicContact NH2-OD2 3.01Å; R314-D361 PolarHBondContact NH2-OD2 3.18Å; H357-D361 WeakPolarHBondContact O-CB 3.21Å; H357-D361 PolarHBondContact O-N 3.27Å; I359-D361 VanDerWaalsContact C-N 3.34Å; I359-D361 PolarHBondContact O-N 2.85Å; D361-T363 PolarHBondContact O-N 3.35Å; D361-G364 PolarHBondContact O-N 2.77Å; D361-F365 WeakPolarHBondContact O-CD2 3.47Å; D361-F365 PolarHBondContact O-N 3.4Å; D361-F365 WeakPolarHBondContact OD1-CE2 3.42Å
362	L	96.1	Very high	95.1	Very high	35 Å²	35	36.9 Å²	36.9	18%	0.183	19%	0.192	C	C	.	.	H	α-helix	trans	-66.3	-37.4	176.3	-63.5	-174.6	0	0	0	112.4	M321 Y322 L325 P358 G364 F365 I366	M321-L362 HydrophobicContact CB-CD1 4.17Å; M321-L362 HydrophobicContact CE-CD1 3.42Å; M321-L362 VanDerWaalsContact CE-CD1 3.42Å; M321-L362 HydrophobicContact CE-CG 4.4Å; M321-L362 HydrophobicContact CG-CD1 4.1Å; Y322-L362 HydrophobicContact CD2-CD2 4.03Å; L325-L362 HydrophobicContact CD1-CB 4.31Å; P358-L362 WeakPolarHBondContact O-CB 3.42Å; P358-L362 WeakPolarHBondContact O-CG 3.15Å; P358-L362 PolarHBondContact O-N 2.73Å; L362-G364 PolarHBondContact O-N 2.98Å; L362-F365 HydrophobicContact CD2-CD2 4.37Å; L362-F365 PolarHBondContact O-N 3.04Å; L362-I366 WeakPolarHBondContact O-CD1 3.42Å; L362-I366 WeakPolarHBondContact O-CG1 3.45Å; L362-I366 PolarHBondContact O-N 2.91Å
363	T	96.3	Very high	95.3	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-63.4	-42.1	176.9	-59.5	0	0	0	0	111.2	P184 F186 Y329 L348 I359 P360 D361 F365 I366 T367	P184-T363 HydrophobicContact CB-CG2 3.9Å; P184-T363 HydrophobicContact CG-CG2 3.97Å; F186-T363 HydrophobicContact CE1-CG2 3.97Å; F186-T363 HydrophobicContact CZ-CG2 4.41Å; Y329-T363 HydrophobicContact CE2-CG2 3.69Å; Y329-T363 PolarHBondContact OH-OG1 2.81Å; L348-T363 HydrophobicContact CD2-CG2 3.83Å; I359-T363 VanDerWaalsContact O-CB 3.31Å; I359-T363 WeakPolarHBondContact O-CB 3.49Å; I359-T363 PolarHBondContact O-N 2.9Å; I359-T363 PolarHBondContact O-OG1 3.16Å; P360-T363 PolarHBondContact O-N 3.23Å; D361-T363 PolarHBondContact O-N 3.35Å; T363-F365 VanDerWaalsContact C-N 3.29Å; T363-F365 PolarHBondContact O-N 2.9Å; T363-I366 PolarHBondContact O-N 3.43Å; T363-T367 HydrophobicContact CG2-CG2 3.88Å; T363-T367 WeakPolarHBondContact O-CB 3.42Å; T363-T367 WeakPolarHBondContact O-CG2 3.44Å; T363-T367 PolarHBondContact O-N 2.99Å; T363-T367 PolarHBondContact O-OG1 3.25Å
364	G	94.3	Very high	95.5	Very high	16 Å²	16	28 Å²	28	17%	0.165	15%	0.145	C	C	.	.	H	α-helix	trans	-67.6	-24.8	177.2	0	0	0	0	0	114.1	P360 D361 L362	P360-G364 PolarHBondContact O-N 2.5Å; D361-G364 PolarHBondContact O-N 2.77Å; L362-G364 PolarHBondContact O-N 2.98Å
365	F	95.4	Very high	95.5	Very high	130 Å²	130	29.8 Å²	29.8	57%	0.57	15%	0.149	S	C	*	.	H	α-helix	trans	-73	-34.4	171.4	-73.6	-52.9	0	0	0	113.2	Y322 D361 L362 T363	Y322-F365 HydrophobicContact CE2-CB 4.16Å; D361-F365 WeakPolarHBondContact O-CD2 3.47Å; D361-F365 PolarHBondContact O-N 3.4Å; D361-F365 WeakPolarHBondContact OD1-CE2 3.42Å; L362-F365 HydrophobicContact CD2-CD2 4.37Å; L362-F365 PolarHBondContact O-N 3.04Å; T363-F365 VanDerWaalsContact C-N 3.29Å; T363-F365 PolarHBondContact O-N 2.9Å
366	I	96.4	Very high	95.5	Very high	11 Å²	11	32.9 Å²	32.9	6%	0.056	16%	0.162	C	C	.	.	H	α-helix	trans	-87.5	-44.2	-175.7	-59.9	160.8	0	0	0	111.1	K182 Y322 L325 A326 Y329 L362 T363	K182-I366 WeakPolarHBondContact CE-O 3.37Å; Y322-I366 HydrophobicContact CD2-CD1 3.98Å; Y322-I366 HydrophobicContact CD2-CG1 4Å; Y322-I366 HydrophobicContact CE2-CD1 4.06Å; Y322-I366 HydrophobicContact CE2-CG1 3.54Å; L325-I366 HydrophobicContact CB-CD1 3.75Å; A326-I366 HydrophobicContact CB-CD1 4.13Å; A326-I366 HydrophobicContact CB-CG1 4.4Å; A326-I366 HydrophobicContact CB-CG2 4.35Å; Y329-I366 HydrophobicContact CD2-CB 4.16Å; Y329-I366 HydrophobicContact CD2-CD1 4.19Å; Y329-I366 HydrophobicContact CD2-CG2 3.87Å; Y329-I366 HydrophobicContact CG-CG2 4.34Å; L362-I366 WeakPolarHBondContact O-CD1 3.42Å; L362-I366 WeakPolarHBondContact O-CG1 3.45Å; L362-I366 PolarHBondContact O-N 2.91Å; T363-I366 PolarHBondContact O-N 3.43Å
367	T	95.9	Very high	95.6	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.138	C	C	.	.	S	Bend	trans	-83.1	166.5	-174.6	60.7	0	0	0	0	112.7	P184 Y329 T363 G369	P184-T367 WeakPolarHBondContact CD-OG1 3.41Å; P184-T367 HydrophobicContact CG-CG2 4.32Å; P184-T367 WeakPolarHBondContact CG-OG1 3.29Å; Y329-T367 HydrophobicContact CD2-CG2 3.99Å; Y329-T367 HydrophobicContact CE2-CG2 4.31Å; Y329-T367 HydrophobicContact CG-CG2 4.14Å; T363-T367 HydrophobicContact CG2-CG2 3.88Å; T363-T367 WeakPolarHBondContact O-CB 3.42Å; T363-T367 WeakPolarHBondContact O-CG2 3.44Å; T363-T367 PolarHBondContact O-N 2.99Å; T363-T367 PolarHBondContact O-OG1 3.25Å; T367-G369 VanDerWaalsContact C-N 3.31Å; T367-G369 PolarHBondContact O-N 2.87Å; T367-G369 PolarHBondContact OG1-O 3.29Å
368	E	95.1	Very high	95.5	Very high	44 Å²	44	31.6 Å²	31.6	21%	0.206	15%	0.15	C	C	.	.	S	Bend	trans	-98.3	34.7	-168.6	-68.7	155	-172.9	0	0	112.2	Q181 K182 R394 L395	Q181-E368 HydrophobicContact CG-CB 4.29Å; Q181-E368 WeakPolarHBondContact CG-OE2 3.31Å; Q181-E368 PolarHBondContact NE2-O 2.78Å; K182-E368 HydrophobicContact CG-CG 4.15Å; K182-E368 IonicContact NZ-OE1 3.6Å; K182-E368 PolarHBondContact NZ-OE1 3.27Å; K182-E368 PolarHBondContact O-N 2.94Å; K182-E368 VanDerWaalsContact O-N 3.1Å; E368-R394 HydrophobicContact CB-CB 4.45Å; E368-R394 VanDerWaalsContact O-CB 3.3Å; E368-R394 WeakPolarHBondContact O-CB 3.28Å; E368-R394 WeakPolarHBondContact O-CG 3.44Å; E368-R394 PolarHBondContact O-N 3.4Å; E368-L395 WeakPolarHBondContact OE2-CD1 3.4Å
369	G	94.6	Very high	95.5	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	138.4	-170.5	-173	0	0	0	0	0	111.7	P184 T367 L392	P184-G369 WeakPolarHBondContact CD-O 3.3Å; P184-G369 WeakPolarHBondContact CG-O 3.36Å; T367-G369 VanDerWaalsContact C-N 3.31Å; T367-G369 PolarHBondContact O-N 2.87Å; T367-G369 PolarHBondContact OG1-O 3.29Å; G369-L392 CarbonylContact C-O 3.51Å; G369-L392 WeakPolarHBondContact CA-O 3.2Å
370	Q	96.1	Very high	95.4	Very high	35 Å²	35	42.1 Å²	42.1	16%	0.164	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.7	148.6	173.5	64.5	-79.4	-4.6	0	0	110.4	P184 F186 P390 S391 L392	P184-Q370 HydrophobicContact CG-CB 3.9Å; F186-Q370 HydrophobicContact CD1-CB 4.29Å; F186-Q370 HydrophobicContact CD2-CB 4.15Å; F186-Q370 HydrophobicContact CD2-CG 4.15Å; F186-Q370 HydrophobicContact CE1-CB 4.14Å; F186-Q370 HydrophobicContact CE2-CB 4Å; F186-Q370 HydrophobicContact CE2-CG 4.04Å; F186-Q370 HydrophobicContact CG-CB 4.3Å; F186-Q370 HydrophobicContact CZ-CB 4Å; F186-Q370 HydrophobicContact CZ-CG 4.49Å; Q370-P390 PolarHBondContact NE2-O 3.01Å; Q370-S391 CarbonylContact O-C 2.85Å; Q370-S391 WeakPolarHBondContact O-CA 3.43Å; Q370-S391 WeakPolarHBondContact O-CB 3.15Å; Q370-L392 PolarHBondContact N-O 2.83Å; Q370-L392 PolarHBondContact O-N 3.45Å
371	I	97.1	Very high	95.3	Very high	1 Å²	1	50.5 Å²	50.5	1%	0.005	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	122.4	168.1	-63.1	167.9	0	0	0	107.4	I171 I177 I183 P184 I185 F186 I386	I171-I371 HydrophobicContact CD1-CD1 3.88Å; I171-I371 HydrophobicContact CG1-CD1 3.98Å; I171-I371 HydrophobicContact CG2-CD1 4.06Å; I177-I371 HydrophobicContact CD1-CD1 4.27Å; I183-I371 HydrophobicContact CD1-CD1 4.02Å; I183-I371 HydrophobicContact CD1-CG1 3.87Å; I183-I371 HydrophobicContact CG1-CD1 4.35Å; I183-I371 HydrophobicContact CG1-CG1 4.2Å; P184-I371 PolarHBondContact O-N 3.49Å; I185-I371 CarbonylContact C-O 3.5Å; I185-I371 WeakPolarHBondContact CA-O 3.09Å; I185-I371 HydrophobicContact CG1-CB 4.31Å; I185-I371 HydrophobicContact CG1-CD1 4.42Å; F186-I371 PolarHBondContact N-O 3.49Å; I371-I386 HydrophobicContact CG2-CD1 4.17Å; I371-I386 HydrophobicContact CG2-CG1 4.22Å; I371-I386 HydrophobicContact CG2-CG2 4Å
372	Y	96.9	Very high	95.3	Very high	32 Å²	32	48.8 Å²	48.8	13%	0.125	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	117.1	-175.2	-165.6	-85.6	0	0	0	111.1	F186 M350 I355 D374 I386 N387 P390 S391	F186-Y372 HydrophobicContact CB-CD2 4.17Å; F186-Y372 HydrophobicContact CD2-CD2 4.47Å; M350-Y372 HydrophobicContact CE-CD2 4.23Å; M350-Y372 HydrophobicContact CE-CE2 3.49Å; M350-Y372 VanDerWaalsContact CE-CE2 3.49Å; M350-Y372 HydrophobicContact SD-CE2 4.02Å; I355-Y372 HydrophobicContact CD1-CD2 4.24Å; I355-Y372 HydrophobicContact CD1-CE2 4.01Å; I355-Y372 HydrophobicContact CG1-CE2 4.47Å; Y372-D374 HydrophobicContact CD1-CB 4.21Å; Y372-D374 HydrophobicContact CE1-CB 4.23Å; Y372-I386 WeakPolarHBondContact O-CA 3.41Å; Y372-N387 HydrophobicContact CD1-CB 4.19Å; Y372-N387 PolarHBondContact O-N 2.94Å; Y372-P390 HydrophobicContact CD1-CG 3.74Å; Y372-P390 HydrophobicContact CD2-CB 4.32Å; Y372-P390 HydrophobicContact CD2-CG 4.15Å; Y372-P390 HydrophobicContact CE1-CG 4.42Å; Y372-P390 HydrophobicContact CG-CB 4.21Å; Y372-P390 HydrophobicContact CG-CG 3.58Å; Y372-S391 PolarHBondContact N-OG 2.78Å
373	V	96.6	Very high	95.2	Very high	2 Å²	2	48.9 Å²	48.9	1%	0.012	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	121.1	174.9	-170.9	0	0	0	0	108.7	I185 F186 L191 I196 P385	I185-V373 HydrophobicContact CG2-CG2 3.56Å; F186-V373 PolarHBondContact O-N 3.49Å; L191-V373 HydrophobicContact CB-CG1 4.19Å; L191-V373 HydrophobicContact CD1-CB 4.43Å; L191-V373 HydrophobicContact CD1-CG1 4.07Å; L191-V373 WeakPolarHBondContact CD1-O 3.4Å; I196-V373 HydrophobicContact CD1-CG1 4.18Å; I196-V373 HydrophobicContact CD1-CG2 4.03Å; V373-P385 CarbonylContact C-O 3.39Å; V373-P385 WeakPolarHBondContact CA-O 3.3Å; V373-P385 HydrophobicContact CG1-CG 3.8Å
374	D	95	Very high	95.1	Very high	21 Å²	21	48.9 Å²	48.9	11%	0.112	23%	0.225	C	C	.	.			trans	-108	131.7	-168.9	-173.6	1.4	0	0	0	112.5	Y372 Q376 L377 H378 P385 N387	Y372-D374 HydrophobicContact CD1-CB 4.21Å; Y372-D374 HydrophobicContact CE1-CB 4.23Å; D374-Q376 VanDerWaalsContact C-N 3.32Å; D374-Q376 PolarHBondContact O-N 3.17Å; D374-Q376 PolarHBondContact OD1-N 2.97Å; D374-L377 HydrophobicContact CB-CD1 4.33Å; D374-L377 HydrophobicContact CB-CG 4.41Å; D374-H378 PolarHBondContact O-N 2.93Å; D374-P385 PolarHBondContact N-O 3.47Å; D374-N387 HydrophobicContact CB-CB 3.62Å; D374-N387 PolarHBondContact OD2-ND2 3.29Å
375	R	94.8	Very high	95.1	Very high	77 Å²	77	48.1 Å²	48.1	29%	0.291	22%	0.218	S	C	.	.	H	α-helix	trans	-66.3	-32.7	177.5	-170.7	179.2	-60.8	-82.4	-1.5	112.5	A189 L191 D353 L377 H378 N379	A189-R375 PolarHBondContact O-NH1 2.74Å; A189-R375 PolarHBondContact O-NH2 2.79Å; L191-R375 HydrophobicContact CD1-CB 4.44Å; L191-R375 HydrophobicContact CD2-CB 4.03Å; L191-R375 HydrophobicContact CD2-CG 4.14Å; D353-R375 IonicContact OD1-CZ 2.72Å; D353-R375 IonicContact OD1-NE 2.72Å; D353-R375 IonicContact OD1-NH2 3.48Å; D353-R375 PolarHBondContact OD1-NH2 3.48Å; D353-R375 IonicContact OD2-CZ 3.56Å; D353-R375 IonicContact OD2-NE 3.41Å; D353-R375 PolarHBondContact OD2-NE 2.98Å; D353-R375 IonicContact OD2-NH2 3.6Å; R375-L377 PolarHBondContact O-N 3.06Å; R375-H378 PolarHBondContact O-N 2.9Å; R375-N379 VanDerWaalsContact O-CG 3.27Å; R375-N379 PolarHBondContact O-N 3.1Å; R375-N379 PolarHBondContact O-OD1 3.19Å
376	Q	93.7	Very high	95.2	Very high	137 Å²	137	42 Å²	42	64%	0.64	19%	0.19	S	C	*	.	H	α-helix	trans	-65.8	-40.8	-178.6	-64.7	-171.4	-2.5	0	0	112.2	D374 R380	D374-Q376 VanDerWaalsContact C-N 3.32Å; D374-Q376 PolarHBondContact O-N 3.17Å; D374-Q376 PolarHBondContact OD1-N 2.97Å; Q376-R380 WeakPolarHBondContact O-CG 3.41Å; Q376-R380 PolarHBondContact O-N 3.46Å
377	L	94.2	Very high	95.1	Very high	2 Å²	2	42.5 Å²	42.5	1%	0.01	19%	0.193	C	C	.	.	H	α-helix	trans	-68.4	-39.9	175.4	-65.5	177.1	0	0	0	111	D374 R375 R380 I382 P385 I386 N387 E453	D374-L377 HydrophobicContact CB-CD1 4.33Å; D374-L377 HydrophobicContact CB-CG 4.41Å; R375-L377 PolarHBondContact O-N 3.06Å; L377-R380 PolarHBondContact O-N 3.07Å; L377-R380 VanDerWaalsContact O-N 3.16Å; L377-I382 HydrophobicContact CD2-CD1 3.88Å; L377-I382 PolarHBondContact O-N 2.75Å; L377-P385 HydrophobicContact CB-CB 3.75Å; L377-I386 WeakPolarHBondContact CD1-O 3.48Å; L377-N387 HydrophobicContact CD1-CB 4.26Å; L377-E453 HydrophobicContact CD2-CG 4.29Å
378	H	95.4	Very high	95	Very high	66 Å²	66	42.5 Å²	42.5	31%	0.306	19%	0.194	S	C	.	.	H	α-helix	trans	-62.8	-44.5	178.2	-173.9	56.7	0	0	0	112.7	L191 D374 R375 R380 Q381 P385	L191-H378 HydrophobicContact CD2-CB 3.84Å; D374-H378 PolarHBondContact O-N 2.93Å; R375-H378 PolarHBondContact O-N 2.9Å; H378-R380 PolarHBondContact O-N 3.26Å; H378-R380 VanDerWaalsContact O-N 3.13Å; H378-Q381 WeakPolarHBondContact O-CA 3.41Å; H378-Q381 PolarHBondContact O-N 2.94Å; H378-P385 HydrophobicContact CB-CB 3.85Å; H378-P385 HydrophobicContact CB-CG 3.91Å
379	N	94.8	Very high	95	Very high	117 Å²	117	42.6 Å²	42.6	63%	0.626	20%	0.195	S	C	*	.	H	α-helix	trans	-61.8	-22.7	177.2	-71.6	-7.8	0	0	0	112.9	R375 Q381	R375-N379 VanDerWaalsContact O-CG 3.27Å; R375-N379 PolarHBondContact O-N 3.1Å; R375-N379 PolarHBondContact O-OD1 3.19Å; N379-Q381 VanDerWaalsContact C-N 3.28Å
380	R	94.1	Very high	95	Very high	110 Å²	110	44.5 Å²	44.5	42%	0.415	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.6	10.2	175.1	-67.5	172	59.7	-158.6	-5.2	113.2	Q376 L377 H378 I382 E453	Q376-R380 WeakPolarHBondContact O-CG 3.41Å; Q376-R380 PolarHBondContact O-N 3.46Å; L377-R380 PolarHBondContact O-N 3.07Å; L377-R380 VanDerWaalsContact O-N 3.16Å; H378-R380 PolarHBondContact O-N 3.26Å; H378-R380 VanDerWaalsContact O-N 3.13Å; R380-I382 VanDerWaalsContact C-N 3.25Å; R380-I382 HydrophobicContact CB-CD1 4.1Å; R380-I382 HydrophobicContact CB-CG1 4.38Å; R380-I382 PolarHBondContact O-N 3.39Å; R380-E453 IonicContact CZ-OE2 3.58Å; R380-E453 IonicContact NH1-OE1 3.91Å; R380-E453 PolarHBondContact NH1-OE1 2.83Å; R380-E453 VanDerWaalsContact NH1-OE1 3.11Å; R380-E453 IonicContact NH1-OE2 3.53Å; R380-E453 PolarHBondContact NH1-OE2 3.34Å; R380-E453 IonicContact NH2-OE2 3.71Å; R380-E453 PolarHBondContact NH2-OE2 2.85Å
381	Q	93.9	Very high	95	Very high	179 Å²	179	43 Å²	43	84%	0.836	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.5	31.7	179.6	-56.1	179.6	-30.7	0	0	113.5	H378 N379	H378-Q381 WeakPolarHBondContact O-CA 3.41Å; H378-Q381 PolarHBondContact O-N 2.94Å; N379-Q381 VanDerWaalsContact C-N 3.28Å
382	I	94.1	Very high	94.9	Very high	9 Å²	9	47 Å²	47	5%	0.046	22%	0.222	C	C	.	.			trans	-91.4	131.2	173.1	-62.3	161.5	0	0	0	108.5	L377 R380 E453 I457 N458	L377-I382 HydrophobicContact CD2-CD1 3.88Å; L377-I382 PolarHBondContact O-N 2.75Å; R380-I382 VanDerWaalsContact C-N 3.25Å; R380-I382 HydrophobicContact CB-CD1 4.1Å; R380-I382 HydrophobicContact CB-CG1 4.38Å; R380-I382 PolarHBondContact O-N 3.39Å; I382-E453 HydrophobicContact CD1-CB 3.96Å; I382-I457 HydrophobicContact CG2-CB 4.34Å; I382-I457 HydrophobicContact CG2-CG2 3.88Å; I382-N458 HydrophobicContact CG2-CB 4.18Å
383	Y	94.1	Very high	94.8	Very high	38 Å²	38	45.9 Å²	45.9	15%	0.149	22%	0.219	C	C	.	.	S	Bend	trans	-129.9	137.5	176.7	-179.9	-82.5	0	0	0	111.3	P192 E195 I196 Q199 N458 Q459 P461	P192-Y383 HydrophobicContact CB-CE2 4.4Å; P192-Y383 HydrophobicContact CG-CD2 4.41Å; E195-Y383 HydrophobicContact CB-CE2 4.09Å; E195-Y383 PolarHBondContact O-OH 2.98Å; I196-Y383 HydrophobicContact CG1-CE2 4.41Å; Q199-Y383 PolarHBondContact OE1-OH 3.24Å; Y383-N458 PolarHBondContact N-OD1 3.09Å; Y383-N458 CarbonylContact O-C 3.53Å; Y383-N458 WeakPolarHBondContact O-CA 3.5Å; Y383-N458 PolarHBondContact O-OD1 3Å; Y383-Q459 VanDerWaalsContact CD1-O 3.27Å; Y383-Q459 WeakPolarHBondContact CD1-O 3.42Å; Y383-Q459 PolarHBondContact O-N 2.93Å; Y383-P461 HydrophobicContact CD1-CB 4.49Å; Y383-P461 VanDerWaalsContact CE1-CA 3.48Å; Y383-P461 HydrophobicContact CE1-CB 3.75Å
384	P	94.1	Very high	94.6	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	24%	0.243	C	C	.	.	S	Bend	cis	-71.2	138.6	-12.6	30	-35.7	0	0	0	110.7	I168 P170 I196 I386 I457	I168-P384 HydrophobicContact CG2-CG 3.75Å; P170-P384 HydrophobicContact CG-CG 4.37Å; I196-P384 HydrophobicContact CD1-CB 3.84Å; I196-P384 HydrophobicContact CG1-CB 3.75Å; P384-I386 HydrophobicContact CB-CD1 4.03Å; P384-I386 HydrophobicContact CB-CG1 4.15Å; P384-I386 HydrophobicContact CG-CD1 3.92Å; P384-I386 HydrophobicContact CG-CG1 4.38Å; P384-I386 PolarHBondContact O-N 2.75Å; P384-I457 WeakPolarHBondContact CD-O 3.4Å; P384-I457 VanDerWaalsContact O-CG2 3.23Å; P384-I457 WeakPolarHBondContact O-CG2 3.26Å
385	P	95.9	Very high	94.5	Very high	0 Å²	0	52 Å²	52	0%	0	24%	0.241	C	C	.	.			trans	-77.4	63.2	-176.7	30.4	-34.3	0	0	0	112.1	P192 V373 D374 L377 H378	P192-P385 HydrophobicContact CG-CG 3.78Å; V373-P385 CarbonylContact C-O 3.39Å; V373-P385 WeakPolarHBondContact CA-O 3.3Å; V373-P385 HydrophobicContact CG1-CG 3.8Å; D374-P385 PolarHBondContact N-O 3.47Å; L377-P385 HydrophobicContact CB-CB 3.75Å; H378-P385 HydrophobicContact CB-CB 3.85Å; H378-P385 HydrophobicContact CB-CG 3.91Å
386	I	95.8	Very high	94.3	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	122.8	-178.8	-64.9	170.3	0	0	0	109.5	I168 P170 I171 I371 Y372 L377 P384	I168-I386 HydrophobicContact CG2-CD1 4.06Å; P170-I386 HydrophobicContact CB-CB 4.39Å; P170-I386 HydrophobicContact CB-CG2 4.29Å; P170-I386 HydrophobicContact CG-CB 4.27Å; P170-I386 HydrophobicContact CG-CD1 4Å; I171-I386 HydrophobicContact CD1-CD1 3.87Å; I171-I386 HydrophobicContact CG1-CD1 3.74Å; I371-I386 HydrophobicContact CG2-CD1 4.17Å; I371-I386 HydrophobicContact CG2-CG1 4.22Å; I371-I386 HydrophobicContact CG2-CG2 4Å; Y372-I386 WeakPolarHBondContact O-CA 3.41Å; L377-I386 WeakPolarHBondContact CD1-O 3.48Å; P384-I386 HydrophobicContact CB-CD1 4.03Å; P384-I386 HydrophobicContact CB-CG1 4.15Å; P384-I386 HydrophobicContact CG-CD1 3.92Å; P384-I386 HydrophobicContact CG-CG1 4.38Å; P384-I386 PolarHBondContact O-N 2.75Å
387	N	95.5	Very high	94.2	Very high	22 Å²	22	51.5 Å²	51.5	12%	0.118	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	112.4	173.6	-172.6	-13.4	0	0	0	110	Y372 D374 L377 L389 P390 S391	Y372-N387 HydrophobicContact CD1-CB 4.19Å; Y372-N387 PolarHBondContact O-N 2.94Å; D374-N387 HydrophobicContact CB-CB 3.62Å; D374-N387 PolarHBondContact OD2-ND2 3.29Å; L377-N387 HydrophobicContact CD1-CB 4.26Å; N387-L389 VanDerWaalsContact C-N 3.29Å; N387-L389 PolarHBondContact O-N 3.01Å; N387-L389 PolarHBondContact OD1-N 2.82Å; N387-L389 VanDerWaalsContact OD1-N 3.15Å; N387-P390 HydrophobicContact CB-CG 4.25Å; N387-P390 VanDerWaalsContact CG-CD 3.47Å; N387-P390 WeakPolarHBondContact O-CD 3.21Å; N387-P390 VanDerWaalsContact OD1-CD 3.31Å; N387-P390 WeakPolarHBondContact OD1-CD 3.37Å; N387-S391 WeakPolarHBondContact O-CB 3.33Å; N387-S391 PolarHBondContact O-OG 3.3Å
388	V	94.3	Very high	93.9	Very high	1 Å²	1	53.1 Å²	53.1	1%	0.006	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	-16.1	-174.6	-61.6	0	0	0	0	113.9	P170 M174 Y417 Y420 F452	P170-V388 HydrophobicContact CB-CG1 4.1Å; M174-V388 HydrophobicContact CB-CG1 4.21Å; M174-V388 HydrophobicContact CE-CB 4.31Å; M174-V388 HydrophobicContact CE-CG2 4.37Å; M174-V388 HydrophobicContact CG-CG1 4.01Å; V388-Y417 WeakPolarHBondContact O-CE2 3.34Å; V388-Y420 HydrophobicContact CG2-CD1 3.52Å; V388-Y420 HydrophobicContact CG2-CE1 3.66Å; V388-Y420 HydrophobicContact CG2-CG 4.1Å; V388-F452 HydrophobicContact CG2-CE1 4.11Å; V388-F452 HydrophobicContact CG2-CZ 4.4Å
389	L	94.4	Very high	93.5	Very high	45 Å²	45	50 Å²	50	24%	0.236	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	-54.3	-178.6	-68.4	172.7	0	0	0	113.4	N387 S391 Y417 Y420 A421 K424	N387-L389 VanDerWaalsContact C-N 3.29Å; N387-L389 PolarHBondContact O-N 3.01Å; N387-L389 PolarHBondContact OD1-N 2.82Å; N387-L389 VanDerWaalsContact OD1-N 3.15Å; L389-S391 VanDerWaalsContact C-N 3.27Å; L389-Y417 HydrophobicContact CD2-CE1 4.15Å; L389-Y417 HydrophobicContact CD2-CE2 4.04Å; L389-Y417 PolarHBondContact O-OH 2.9Å; L389-Y417 VanDerWaalsContact O-OH 3.07Å; L389-Y420 HydrophobicContact CD1-CD1 3.95Å; L389-Y420 HydrophobicContact CD1-CE1 3.82Å; L389-Y420 HydrophobicContact CD2-CD1 3.85Å; L389-Y420 HydrophobicContact CD2-CE1 4.43Å; L389-Y420 HydrophobicContact CG-CD1 3.61Å; L389-Y420 HydrophobicContact CG-CE1 3.69Å; L389-A421 HydrophobicContact CD2-CB 3.83Å; L389-K424 HydrophobicContact CD1-CB 4.47Å; L389-K424 HydrophobicContact CD1-CG 3.99Å
390	P	94.7	Very high	93.3	Very high	41 Å²	41	45.7 Å²	45.7	27%	0.266	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	-8.1	175.5	32.9	-36.6	0	0	0	113.2	Q370 Y372 N387	Q370-P390 PolarHBondContact NE2-O 3.01Å; Y372-P390 HydrophobicContact CD1-CG 3.74Å; Y372-P390 HydrophobicContact CD2-CB 4.32Å; Y372-P390 HydrophobicContact CD2-CG 4.15Å; Y372-P390 HydrophobicContact CE1-CG 4.42Å; Y372-P390 HydrophobicContact CG-CB 4.21Å; Y372-P390 HydrophobicContact CG-CG 3.58Å; N387-P390 HydrophobicContact CB-CG 4.25Å; N387-P390 VanDerWaalsContact CG-CD 3.47Å; N387-P390 WeakPolarHBondContact O-CD 3.21Å; N387-P390 VanDerWaalsContact OD1-CD 3.31Å; N387-P390 WeakPolarHBondContact OD1-CD 3.37Å
391	S	95.3	Very high	92.8	Very high	4 Å²	4	41.4 Å²	41.4	3%	0.028	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	143.3	174.9	-60.5	0	0	0	0	110.9	N175 Q370 Y372 N387 L389	N175-S391 VanDerWaalsContact ND2-CB 3.34Å; N175-S391 WeakPolarHBondContact ND2-CB 3.47Å; N175-S391 PolarHBondContact OD1-O 3.44Å; Q370-S391 CarbonylContact O-C 2.85Å; Q370-S391 WeakPolarHBondContact O-CA 3.43Å; Q370-S391 WeakPolarHBondContact O-CB 3.15Å; Y372-S391 PolarHBondContact N-OG 2.78Å; N387-S391 WeakPolarHBondContact O-CB 3.33Å; N387-S391 PolarHBondContact O-OG 3.3Å; L389-S391 VanDerWaalsContact C-N 3.27Å
392	L	94.8	Very high	92.3	Very high	85 Å²	85	41.4 Å²	41.4	45%	0.445	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	143.6	180	-178.9	66.4	0	0	0	110.2	N175 G369 Q370 R394	N175-L392 WeakPolarHBondContact OD1-CA 3.29Å; N175-L392 PolarHBondContact OD1-N 3.38Å; G369-L392 CarbonylContact C-O 3.51Å; G369-L392 WeakPolarHBondContact CA-O 3.2Å; Q370-L392 PolarHBondContact N-O 2.83Å; Q370-L392 PolarHBondContact O-N 3.45Å; L392-R394 HydrophobicContact CD2-CG 4.31Å
393	S	95.4	Very high	91.6	Very high	7 Å²	7	43.8 Å²	43.8	5%	0.049	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	118.3	162.3	175	0	0	0	0	109.7	N175 S176 Q181 M396	N175-S393 PolarHBondContact OD1-N 3.02Å; S176-S393 WeakPolarHBondContact O-CB 3.41Å; S176-S393 PolarHBondContact O-OG 3.1Å; Q181-S393 PolarHBondContact NE2-OG 3.46Å; Q181-S393 PolarHBondContact OE1-OG 3.41Å; S393-M396 WeakPolarHBondContact O-CB 3.38Å
394	R	93.3	Very high	91	Very high	138 Å²	138	44 Å²	44	52%	0.521	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-31.5	-178	-65.2	-176.6	-171.4	168.2	8.9	112.7	E368 L392 M396	E368-R394 HydrophobicContact CB-CB 4.45Å; E368-R394 VanDerWaalsContact O-CB 3.3Å; E368-R394 WeakPolarHBondContact O-CB 3.28Å; E368-R394 WeakPolarHBondContact O-CG 3.44Å; E368-R394 PolarHBondContact O-N 3.4Å; L392-R394 HydrophobicContact CD2-CG 4.31Å; R394-M396 VanDerWaalsContact C-N 3.31Å
395	L	92.4	Very high	90.5	Very high	13 Å²	13	44.9 Å²	44.9	7%	0.068	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-1.1	179.9	-60.4	-171.7	0	0	0	113.6	Y159 P160 A178 Q181 E368 K397 S398 A399	Y159-L395 HydrophobicContact CE2-CD2 3.83Å; Y159-L395 VanDerWaalsContact OH-CD2 3.27Å; Y159-L395 WeakPolarHBondContact OH-CD2 3.48Å; P160-L395 HydrophobicContact CB-CD1 3.97Å; P160-L395 HydrophobicContact CG-CD1 3.91Å; A178-L395 HydrophobicContact CB-CB 4.01Å; A178-L395 HydrophobicContact CB-CD1 4.26Å; Q181-L395 HydrophobicContact CB-CD1 3.99Å; Q181-L395 HydrophobicContact CG-CD1 3.83Å; Q181-L395 HydrophobicContact CG-CG 4.3Å; E368-L395 WeakPolarHBondContact OE2-CD1 3.4Å; L395-K397 PolarHBondContact O-N 3.35Å; L395-S398 PolarHBondContact O-N 2.87Å; L395-A399 PolarHBondContact O-N 3.25Å
396	M	91.4	Very high	90.1	Very high	22 Å²	22	46.4 Å²	46.4	11%	0.108	24%	0.244	C	C	.	.	H	α-helix	trans	-51.6	-43.5	180	-173.5	-165.5	176.1	0	0	112.4	V173 M174 S393 R394 S398 A399 I400 S413	V173-M396 WeakPolarHBondContact O-CE 3.43Å; M174-M396 VanDerWaalsContact O-SD 3.41Å; S393-M396 WeakPolarHBondContact O-CB 3.38Å; R394-M396 VanDerWaalsContact C-N 3.31Å; M396-S398 PolarHBondContact O-N 3.02Å; M396-S398 VanDerWaalsContact O-N 3.12Å; M396-A399 PolarHBondContact O-N 3.48Å; M396-A399 VanDerWaalsContact O-N 3.11Å; M396-I400 HydrophobicContact CE-CD1 3.94Å; M396-I400 HydrophobicContact CE-CG2 4.32Å; M396-I400 HydrophobicContact CG-CD1 4.24Å; M396-I400 HydrophobicContact CG-CG2 4.12Å; M396-I400 WeakPolarHBondContact O-CG1 3.5Å; M396-I400 WeakPolarHBondContact O-CG2 3.46Å; M396-I400 PolarHBondContact O-N 3.42Å; M396-I400 VanDerWaalsContact O-N 3.14Å; M396-S413 WeakPolarHBondContact CE-OG 2.99Å
397	K	89.8	Confident	89.8	Confident	183 Å²	183	51 Å²	51	80%	0.796	26%	0.263	S	S	*	.	H	α-helix	trans	-58.6	-29.2	-177.4	-66	-174.8	-179.6	-178.6	0	113.8	L395	L395-K397 PolarHBondContact O-N 3.35Å
398	S	88.3	Confident	89.5	Confident	36 Å²	36	49.9 Å²	49.9	25%	0.252	26%	0.258	S	S	.	.	H	α-helix	trans	-88.6	-27.2	-177	-47	0	0	0	0	111.7	Y159 L395 M396	Y159-S398 WeakPolarHBondContact CE1-OG 3.35Å; Y159-S398 PolarHBondContact OH-OG 2.82Å; L395-S398 PolarHBondContact O-N 2.87Å; M396-S398 PolarHBondContact O-N 3.02Å; M396-S398 VanDerWaalsContact O-N 3.12Å
399	A	88	Confident	89.5	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-82.9	-19.9	179.4	0	0	0	0	0	113.6	E161 M163 A178 L395 M396 M404	E161-A399 WeakPolarHBondContact O-CA 3.48Å; M163-A399 HydrophobicContact CB-CB 4.05Å; A178-A399 HydrophobicContact CB-CB 4.18Å; L395-A399 PolarHBondContact O-N 3.25Å; M396-A399 PolarHBondContact O-N 3.48Å; M396-A399 VanDerWaalsContact O-N 3.11Å; A399-M404 VanDerWaalsContact O-CB 3.32Å; A399-M404 WeakPolarHBondContact O-CB 3.44Å
400	I	90.3	Very high	89.4	Confident	27 Å²	27	48.6 Å²	48.6	14%	0.138	26%	0.255	C	S	.	.	S	Bend	trans	-106	162.1	-176.8	73.2	-176.2	0	0	0	112	M396 H409	M396-I400 HydrophobicContact CE-CD1 3.94Å; M396-I400 HydrophobicContact CE-CG2 4.32Å; M396-I400 HydrophobicContact CG-CD1 4.24Å; M396-I400 HydrophobicContact CG-CG2 4.12Å; M396-I400 WeakPolarHBondContact O-CG1 3.5Å; M396-I400 WeakPolarHBondContact O-CG2 3.46Å; M396-I400 PolarHBondContact O-N 3.42Å; M396-I400 VanDerWaalsContact O-N 3.14Å; I400-H409 HydrophobicContact CB-CB 4.25Å; I400-H409 VanDerWaalsContact CG2-CE1 3.44Å; I400-H409 WeakPolarHBondContact CG2-CE1 2.88Å; I400-H409 WeakPolarHBondContact CG2-ND1 3.15Å
401	G	84.2	Confident	89.3	Confident	19 Å²	19	48.6 Å²	48.6	20%	0.196	25%	0.253	C	S	.	.	S	Bend	trans	115.9	-173	175.1	0	0	0	0	0	113.7	G403 M404 T405	G401-G403 PolarHBondContact O-N 3.09Å; G401-M404 PolarHBondContact O-N 3.01Å; G401-T405 PolarHBondContact N-OG1 2.8Å; G401-T405 PolarHBondContact O-N 3.01Å; G401-T405 VanDerWaalsContact O-N 3.08Å
402	E	81.8	Confident	89.2	Confident	179 Å²	179	48.4 Å²	48.4	84%	0.836	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	128.6	-176.8	-168.6	168.8	-166.4	0	0	111.1
403	G	80.2	Confident	89.2	Confident	59 Å²	59	44.6 Å²	44.6	61%	0.608	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	90.8	-15.1	-176.4	0	0	0	0	0	115.4	K209 G401	K209-G403 WeakPolarHBondContact CE-O 3.09Å; K209-G403 PolarHBondContact NZ-O 3.38Å; G401-G403 PolarHBondContact O-N 3.09Å
404	M	82.4	Confident	89.1	Confident	44 Å²	44	48.3 Å²	48.3	22%	0.217	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106	-64.5	173.4	-61.5	-56.3	-164.3	0	0	111.9	E161 K209 A399 G401	E161-M404 HydrophobicContact CB-CE 3.69Å; E161-M404 WeakPolarHBondContact O-CE 3.48Å; K209-M404 PolarHBondContact NZ-SD 3.06Å; A399-M404 VanDerWaalsContact O-CB 3.32Å; A399-M404 WeakPolarHBondContact O-CB 3.44Å; G401-M404 PolarHBondContact O-N 3.01Å
405	T	83.6	Confident	89.2	Confident	17 Å²	17	42 Å²	42	10%	0.104	23%	0.228	C	C	.	.	S	Bend	trans	-117.6	-102.8	178.7	51.3	0	0	0	0	110.3	M163 G401 H409 V467	M163-T405 HydrophobicContact CB-CG2 4.43Å; M163-T405 HydrophobicContact SD-CG2 3.43Å; M163-T405 WeakPolarHBondContact SD-CG2 3.47Å; G401-T405 PolarHBondContact N-OG1 2.8Å; G401-T405 PolarHBondContact O-N 3.01Å; G401-T405 VanDerWaalsContact O-N 3.08Å; T405-H409 PolarHBondContact OG1-ND1 3.01Å; T405-H409 VanDerWaalsContact OG1-ND1 3.14Å; T405-V467 HydrophobicContact CG2-CG1 4.29Å
406	R	86.1	Confident	89.3	Confident	33 Å²	33	41.4 Å²	41.4	13%	0.125	23%	0.225	C	C	.	.			trans	-135.7	150	176.9	-157.5	171	71.7	-179.4	6.6	108.7	D408 H409 F468 L471 D472	R406-D408 VanDerWaalsContact CB-OD1 3.28Å; R406-D408 WeakPolarHBondContact CB-OD1 3.46Å; R406-D408 WeakPolarHBondContact CD-OD1 3.36Å; R406-D408 WeakPolarHBondContact CG-OD1 3.2Å; R406-D408 IonicContact CZ-OD1 2.78Å; R406-D408 IonicContact CZ-OD2 3.9Å; R406-D408 VanDerWaalsContact CZ-OD2 3.26Å; R406-D408 IonicContact NE-OD1 3.59Å; R406-D408 PolarHBondContact NE-OD1 2.77Å; R406-D408 IonicContact NE-OD2 2.88Å; R406-D408 PolarHBondContact NE-OD2 3.44Å; R406-D408 VanDerWaalsContact NE-OD2 3.13Å; R406-D408 IonicContact NH2-OD1 2.79Å; R406-D408 IonicContact NH2-OD2 3.24Å; R406-D408 PolarHBondContact NH2-OD2 3.1Å; R406-D408 PolarHBondContact O-N 3.09Å; R406-H409 WeakPolarHBondContact O-CB 3.43Å; R406-H409 PolarHBondContact O-N 2.83Å; R406-F468 HydrophobicContact CB-CE1 4.33Å; R406-L471 HydrophobicContact CB-CD1 3.92Å; R406-D472 IonicContact CZ-OD1 3.52Å; R406-D472 IonicContact NH1-OD1 2.68Å; R406-D472 PolarHBondContact NH1-OD1 3.26Å; R406-D472 IonicContact NH2-OD1 2.81Å
407	K	89.3	Confident	89.5	Confident	95 Å²	95	44.9 Å²	44.9	41%	0.413	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-26.3	-173.5	61.5	-178.4	172.9	-172.3	0	115.1	E496	K407-E496 WeakPolarHBondContact CE-OE1 3.41Å; K407-E496 WeakPolarHBondContact CE-OE2 3.44Å; K407-E496 IonicContact NZ-OE1 3.11Å; K407-E496 PolarHBondContact NZ-OE1 3.02Å; K407-E496 IonicContact NZ-OE2 2.74Å; K407-E496 PolarHBondContact NZ-OE2 3.41Å
408	D	90.2	Very high	89.7	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-5.7	-174.7	65.2	-45	0	0	0	113.8	R406 G410 D411 V412 W475 V493 F497	R406-D408 VanDerWaalsContact CB-OD1 3.28Å; R406-D408 WeakPolarHBondContact CB-OD1 3.46Å; R406-D408 WeakPolarHBondContact CD-OD1 3.36Å; R406-D408 WeakPolarHBondContact CG-OD1 3.2Å; R406-D408 IonicContact CZ-OD1 2.78Å; R406-D408 IonicContact CZ-OD2 3.9Å; R406-D408 VanDerWaalsContact CZ-OD2 3.26Å; R406-D408 IonicContact NE-OD1 3.59Å; R406-D408 PolarHBondContact NE-OD1 2.77Å; R406-D408 IonicContact NE-OD2 2.88Å; R406-D408 PolarHBondContact NE-OD2 3.44Å; R406-D408 VanDerWaalsContact NE-OD2 3.13Å; R406-D408 IonicContact NH2-OD1 2.79Å; R406-D408 IonicContact NH2-OD2 3.24Å; R406-D408 PolarHBondContact NH2-OD2 3.1Å; R406-D408 PolarHBondContact O-N 3.09Å; D408-G410 PolarHBondContact O-N 3.24Å; D408-D411 PolarHBondContact O-N 3.29Å; D408-V412 HydrophobicContact CB-CG2 4.26Å; D408-V412 WeakPolarHBondContact O-CB 2.85Å; D408-V412 VanDerWaalsContact O-CG2 3.31Å; D408-V412 WeakPolarHBondContact O-CG2 3.4Å; D408-V412 PolarHBondContact O-N 3.15Å; D408-W475 HydrophobicContact CB-CZ2 4.39Å; D408-W475 PolarHBondContact OD2-NE1 2.76Å; D408-V493 HydrophobicContact CB-CG1 3.54Å; D408-F497 HydrophobicContact CB-CD2 4.37Å; D408-F497 HydrophobicContact CB-CE2 4.13Å
409	H	93	Very high	90.1	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-54.1	-50.1	-173.2	-171.4	163.9	0	0	0	111.8	D172 V173 S176 I400 T405 R406 D411 S413 L471	D172-H409 PolarHBondContact O-CE1 2.67Å; D172-H409 PolarHBondContact O-NE2 2.9Å; V173-H409 WeakPolarHBondContact CA-NE2 3.37Å; V173-H409 PolarHBondContact O-NE2 3.22Å; S176-H409 PolarHBondContact OG-CE1 2.99Å; S176-H409 PolarHBondContact OG-NE2 3.03Å; I400-H409 HydrophobicContact CB-CB 4.25Å; I400-H409 VanDerWaalsContact CG2-CE1 3.44Å; I400-H409 WeakPolarHBondContact CG2-CE1 2.88Å; I400-H409 WeakPolarHBondContact CG2-ND1 3.15Å; T405-H409 PolarHBondContact OG1-ND1 3.01Å; T405-H409 VanDerWaalsContact OG1-ND1 3.14Å; R406-H409 WeakPolarHBondContact O-CB 3.43Å; R406-H409 PolarHBondContact O-N 2.83Å; H409-D411 PolarHBondContact O-N 2.79Å; H409-S413 VanDerWaalsContact O-CB 3.31Å; H409-S413 WeakPolarHBondContact O-CB 3.5Å; H409-S413 PolarHBondContact O-N 3.3Å; H409-L471 HydrophobicContact CB-CD1 4.19Å; H409-L471 HydrophobicContact CB-CD2 4.17Å
410	G	92.8	Very high	90.4	Very high	18 Å²	18	35.1 Å²	35.1	19%	0.186	19%	0.193	C	C	.	.	H	α-helix	trans	-62.4	-40.7	-179.6	0	0	0	0	0	113.3	D408 N414	D408-G410 PolarHBondContact O-N 3.24Å; G410-N414 WeakPolarHBondContact O-CB 3.43Å; G410-N414 PolarHBondContact O-N 2.67Å; G410-N414 PolarHBondContact O-ND2 3.4Å
411	D	93.3	Very high	90.7	Very high	41 Å²	41	35.2 Å²	35.2	22%	0.219	20%	0.197	C	C	.	.	H	α-helix	trans	-70.8	-44.6	-178	-61.2	-35.4	0	0	0	111.5	D408 H409 N414 Q415 I489 P490	D408-D411 PolarHBondContact O-N 3.29Å; H409-D411 PolarHBondContact O-N 2.79Å; D411-N414 PolarHBondContact O-N 2.65Å; D411-Q415 WeakPolarHBondContact O-CB 3.26Å; D411-Q415 PolarHBondContact O-N 2.94Å; D411-I489 HydrophobicContact CB-CG1 4.28Å; D411-I489 HydrophobicContact CB-CG2 4.17Å; D411-P490 VanDerWaalsContact CG-CD 3.42Å; D411-P490 VanDerWaalsContact OD2-CD 3.24Å; D411-P490 WeakPolarHBondContact OD2-CD 3.41Å
412	V	92.8	Very high	91.1	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-60.8	-47.9	176.9	171.5	0	0	0	0	110.4	D408 N414 Q415 L416 L471 W475 L478	D408-V412 HydrophobicContact CB-CG2 4.26Å; D408-V412 WeakPolarHBondContact O-CB 2.85Å; D408-V412 VanDerWaalsContact O-CG2 3.31Å; D408-V412 WeakPolarHBondContact O-CG2 3.4Å; D408-V412 PolarHBondContact O-N 3.15Å; V412-N414 PolarHBondContact O-N 3.34Å; V412-Q415 PolarHBondContact O-N 2.87Å; V412-L416 HydrophobicContact CG1-CD1 3.73Å; V412-L416 HydrophobicContact CG1-CG 4.22Å; V412-L416 WeakPolarHBondContact O-CB 3.47Å; V412-L416 VanDerWaalsContact O-CG 3.25Å; V412-L416 WeakPolarHBondContact O-CG 3.4Å; V412-L416 PolarHBondContact O-N 2.77Å; V412-L471 HydrophobicContact CG1-CD2 4.4Å; V412-W475 HydrophobicContact CG2-CD2 4.26Å; V412-W475 VanDerWaalsContact CG2-CE2 3.43Å; V412-W475 HydrophobicContact CG2-CZ2 3.57Å; V412-W475 VanDerWaalsContact CG2-NE1 3.3Å; V412-L478 HydrophobicContact CG1-CD1 4.1Å; V412-L478 HydrophobicContact CG2-CD1 4.49Å
413	S	94.6	Very high	91.7	Very high	6 Å²	6	29 Å²	29	4%	0.042	17%	0.165	C	C	.	.	H	α-helix	trans	-60.1	-47.4	178.7	-175.1	0	0	0	0	112.2	V173 M396 H409 Q415 L416 Y417	V173-S413 VanDerWaalsContact O-CB 3.27Å; V173-S413 WeakPolarHBondContact O-CB 3.32Å; V173-S413 PolarHBondContact O-OG 3.17Å; M396-S413 WeakPolarHBondContact CE-OG 2.99Å; H409-S413 VanDerWaalsContact O-CB 3.31Å; H409-S413 WeakPolarHBondContact O-CB 3.5Å; H409-S413 PolarHBondContact O-N 3.3Å; S413-Q415 VanDerWaalsContact C-N 3.33Å; S413-Q415 PolarHBondContact O-N 2.57Å; S413-L416 PolarHBondContact O-N 3.01Å; S413-Y417 WeakPolarHBondContact O-CB 3.45Å; S413-Y417 PolarHBondContact O-N 3.21Å
414	N	94.1	Very high	92.4	Very high	84 Å²	84	28.1 Å²	28.1	45%	0.449	14%	0.144	S	C	.	.	H	α-helix	trans	-61.8	-38.9	177.7	-77.4	-35.5	0	0	0	112.8	G410 D411 V412 A418	G410-N414 WeakPolarHBondContact O-CB 3.43Å; G410-N414 PolarHBondContact O-N 2.67Å; G410-N414 PolarHBondContact O-ND2 3.4Å; D411-N414 PolarHBondContact O-N 2.65Å; V412-N414 PolarHBondContact O-N 3.34Å; N414-A418 WeakPolarHBondContact O-CB 3.4Å; N414-A418 PolarHBondContact O-N 3.27Å; N414-A418 VanDerWaalsContact O-N 3.11Å
415	Q	94.3	Very high	92.9	Very high	7 Å²	7	31.1 Å²	31.1	3%	0.033	16%	0.161	C	C	.	.	H	α-helix	trans	-72.3	-43.6	178.4	-175.3	66	36.4	0	0	111.4	D411 V412 S413 Y417 A418 C419 L478 L486 R488 I489	D411-Q415 WeakPolarHBondContact O-CB 3.26Å; D411-Q415 PolarHBondContact O-N 2.94Å; V412-Q415 PolarHBondContact O-N 2.87Å; S413-Q415 VanDerWaalsContact C-N 3.33Å; S413-Q415 PolarHBondContact O-N 2.57Å; Q415-Y417 VanDerWaalsContact C-N 3.3Å; Q415-Y417 PolarHBondContact O-N 3.01Å; Q415-A418 PolarHBondContact O-N 3.12Å; Q415-C419 PolarHBondContact NE2-SG 3.2Å; Q415-C419 VanDerWaalsContact NE2-SG 3.37Å; Q415-C419 WeakPolarHBondContact O-CB 3.5Å; Q415-C419 PolarHBondContact O-N 3.13Å; Q415-C419 PolarHBondContact O-SG 3.38Å; Q415-C419 VanDerWaalsContact O-SG 3.35Å; Q415-L478 HydrophobicContact CB-CD1 4.46Å; Q415-L478 HydrophobicContact CB-CD2 4.33Å; Q415-L478 HydrophobicContact CG-CD1 4.35Å; Q415-L478 HydrophobicContact CG-CD2 3.65Å; Q415-L486 HydrophobicContact CG-CD2 3.88Å; Q415-R488 HydrophobicContact CB-CB 4.49Å; Q415-I489 HydrophobicContact CB-CD1 3.8Å; Q415-I489 HydrophobicContact CB-CG1 3.77Å; Q415-I489 HydrophobicContact CG-CD1 3.86Å; Q415-I489 HydrophobicContact CG-CG1 4.04Å
416	L	94.8	Very high	93.4	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-58.5	-43.5	174.4	-73.4	171.9	0	0	0	111.1	V173 M174 V412 S413 C419 Y420 F448 F452 F456 L478	V173-L416 HydrophobicContact CG1-CD1 4.45Å; M174-L416 HydrophobicContact CE-CB 4.15Å; M174-L416 HydrophobicContact SD-CB 3.94Å; M174-L416 HydrophobicContact SD-CD1 4.15Å; V412-L416 HydrophobicContact CG1-CD1 3.73Å; V412-L416 HydrophobicContact CG1-CG 4.22Å; V412-L416 WeakPolarHBondContact O-CB 3.47Å; V412-L416 VanDerWaalsContact O-CG 3.25Å; V412-L416 WeakPolarHBondContact O-CG 3.4Å; V412-L416 PolarHBondContact O-N 2.77Å; S413-L416 PolarHBondContact O-N 3.01Å; L416-C419 PolarHBondContact O-N 2.94Å; L416-Y420 VanDerWaalsContact O-CB 3.29Å; L416-Y420 WeakPolarHBondContact O-CB 3.02Å; L416-Y420 PolarHBondContact O-N 3.02Å; L416-F448 HydrophobicContact CD2-CE2 3.74Å; L416-F448 HydrophobicContact CD2-CZ 3.66Å; L416-F452 HydrophobicContact CB-CE2 4.28Å; L416-F452 HydrophobicContact CD1-CE2 4.39Å; L416-F452 HydrophobicContact CD2-CD2 4.21Å; L416-F452 HydrophobicContact CD2-CE2 4.1Å; L416-F452 HydrophobicContact CG-CE2 4.5Å; L416-F456 HydrophobicContact CD1-CE2 4.25Å; L416-F456 HydrophobicContact CD1-CZ 4.16Å; L416-L478 HydrophobicContact CD2-CD1 4.49Å; L416-L478 HydrophobicContact CD2-CD2 3.81Å; L416-L478 HydrophobicContact CD2-CG 3.89Å; L416-L478 HydrophobicContact CG-CD1 4.46Å; L416-L478 HydrophobicContact CG-CD2 4.29Å; L416-L478 HydrophobicContact CG-CG 4.36Å
417	Y	95.5	Very high	93.7	Very high	94 Å²	94	32.6 Å²	32.6	37%	0.369	17%	0.168	S	C	.	.	H	α-helix	trans	-60.8	-47	177.1	-174	-81.4	0	0	0	111.3	M174 V388 L389 S413 Q415 Y420 A421	M174-Y417 HydrophobicContact CE-CD2 4.24Å; V388-Y417 WeakPolarHBondContact O-CE2 3.34Å; L389-Y417 HydrophobicContact CD2-CE1 4.15Å; L389-Y417 HydrophobicContact CD2-CE2 4.04Å; L389-Y417 PolarHBondContact O-OH 2.9Å; L389-Y417 VanDerWaalsContact O-OH 3.07Å; S413-Y417 WeakPolarHBondContact O-CB 3.45Å; S413-Y417 PolarHBondContact O-N 3.21Å; Q415-Y417 VanDerWaalsContact C-N 3.3Å; Q415-Y417 PolarHBondContact O-N 3.01Å; Y417-Y420 PolarHBondContact O-N 3.49Å; Y417-A421 WeakPolarHBondContact O-CB 3.46Å; Y417-A421 PolarHBondContact O-N 2.96Å
418	A	95.3	Very high	93.9	Very high	13 Å²	13	30.8 Å²	30.8	11%	0.107	17%	0.171	C	C	.	.	H	α-helix	trans	-62.8	-45.4	179	0	0	0	0	0	112.1	N414 Q415 Y420 A421 I422	N414-A418 WeakPolarHBondContact O-CB 3.4Å; N414-A418 PolarHBondContact O-N 3.27Å; N414-A418 VanDerWaalsContact O-N 3.11Å; Q415-A418 PolarHBondContact O-N 3.12Å; A418-Y420 VanDerWaalsContact C-N 3.32Å; A418-Y420 PolarHBondContact O-N 3.41Å; A418-A421 PolarHBondContact O-N 2.91Å; A418-I422 VanDerWaalsContact O-CG1 3.3Å; A418-I422 WeakPolarHBondContact O-CG1 3.25Å; A418-I422 PolarHBondContact O-N 3.1Å
419	C	94.8	Very high	93.9	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.007	19%	0.193	C	C	.	.	H	α-helix	trans	-62.6	-38.7	176.2	-69.7	0	0	0	0	112	Q415 L416 G423 Y445 F448 F481	Q415-C419 PolarHBondContact NE2-SG 3.2Å; Q415-C419 VanDerWaalsContact NE2-SG 3.37Å; Q415-C419 WeakPolarHBondContact O-CB 3.5Å; Q415-C419 PolarHBondContact O-N 3.13Å; Q415-C419 PolarHBondContact O-SG 3.38Å; Q415-C419 VanDerWaalsContact O-SG 3.35Å; L416-C419 PolarHBondContact O-N 2.94Å; C419-G423 PolarHBondContact O-N 3.21Å; C419-Y445 HydrophobicContact CB-CD1 4.35Å; C419-Y445 HydrophobicContact CB-CE1 4.1Å; C419-F448 HydrophobicContact CB-CD1 3.87Å; C419-F448 HydrophobicContact CB-CE1 3.48Å; C419-F448 VanDerWaalsContact CB-CE1 3.48Å; C419-F448 HydrophobicContact CB-CE2 4.42Å; C419-F448 HydrophobicContact CB-CZ 3.79Å; C419-F481 HydrophobicContact CB-CE2 4.17Å; C419-F481 HydrophobicContact CB-CZ 4.39Å
420	Y	95.3	Very high	93.9	Very high	1 Å²	1	38.2 Å²	38.2	0%	0.004	21%	0.206	C	C	.	.	H	α-helix	trans	-69.1	-41.2	178.6	-172.1	-102.8	0	0	0	112.1	V388 L389 L416 Y417 A418 G423 K424 L449 F452 E453	V388-Y420 HydrophobicContact CG2-CD1 3.52Å; V388-Y420 HydrophobicContact CG2-CE1 3.66Å; V388-Y420 HydrophobicContact CG2-CG 4.1Å; L389-Y420 HydrophobicContact CD1-CD1 3.95Å; L389-Y420 HydrophobicContact CD1-CE1 3.82Å; L389-Y420 HydrophobicContact CD2-CD1 3.85Å; L389-Y420 HydrophobicContact CD2-CE1 4.43Å; L389-Y420 HydrophobicContact CG-CD1 3.61Å; L389-Y420 HydrophobicContact CG-CE1 3.69Å; L416-Y420 VanDerWaalsContact O-CB 3.29Å; L416-Y420 WeakPolarHBondContact O-CB 3.02Å; L416-Y420 PolarHBondContact O-N 3.02Å; Y417-Y420 PolarHBondContact O-N 3.49Å; A418-Y420 VanDerWaalsContact C-N 3.32Å; A418-Y420 PolarHBondContact O-N 3.41Å; Y420-G423 PolarHBondContact O-N 3.47Å; Y420-K424 HydrophobicContact CE1-CG 4.22Å; Y420-K424 VanDerWaalsContact CZ-CE 3.49Å; Y420-K424 WeakPolarHBondContact O-CG 3.39Å; Y420-K424 PolarHBondContact O-N 2.92Å; Y420-K424 WeakPolarHBondContact OH-CE 2.91Å; Y420-L449 HydrophobicContact CD2-CD1 3.48Å; Y420-L449 VanDerWaalsContact CD2-CD1 3.48Å; Y420-L449 HydrophobicContact CE2-CD1 3.33Å; Y420-L449 HydrophobicContact CG-CD1 4.38Å; Y420-F452 AromaticContact CD2-CD1 3.37Å; Y420-F452 HydrophobicContact CD2-CD1 3.37Å; Y420-F452 AromaticContact CD2-CE1 3.65Å; Y420-F452 HydrophobicContact CD2-CE1 3.65Å; Y420-F452 HydrophobicContact CD2-CG 4.2Å; Y420-F452 AromaticContact CE2-CD1 3.61Å; Y420-F452 HydrophobicContact CE2-CD1 3.61Å; Y420-F452 AromaticContact CE2-CE1 3.93Å; Y420-F452 HydrophobicContact CE2-CE1 3.93Å; Y420-F452 HydrophobicContact CG-CD1 4.28Å; Y420-F452 HydrophobicContact CG-CE1 4.15Å; Y420-E453 HydrophobicContact CE2-CG 4.06Å
421	A	95.6	Very high	93.8	Very high	28 Å²	28	41.7 Å²	41.7	23%	0.231	23%	0.233	C	C	.	.	H	α-helix	trans	-61.3	-50.5	175.2	0	0	0	0	0	111.7	L389 Y417 A418 G423 K424 D425	L389-A421 HydrophobicContact CD2-CB 3.83Å; Y417-A421 WeakPolarHBondContact O-CB 3.46Å; Y417-A421 PolarHBondContact O-N 2.96Å; A418-A421 PolarHBondContact O-N 2.91Å; A421-G423 VanDerWaalsContact C-N 3.32Å; A421-G423 PolarHBondContact O-N 2.62Å; A421-K424 PolarHBondContact O-N 3.38Å; A421-D425 PolarHBondContact O-N 2.91Å; A421-D425 VanDerWaalsContact O-N 3.12Å
422	I	94.6	Very high	93.8	Very high	67 Å²	67	45.8 Å²	45.8	34%	0.344	26%	0.259	S	S	.	.	H	α-helix	trans	-61.1	-43.1	176.9	-63.9	165.9	0	0	0	110.2	A418 K424 D425 V426 Y445	A418-I422 VanDerWaalsContact O-CG1 3.3Å; A418-I422 WeakPolarHBondContact O-CG1 3.25Å; A418-I422 PolarHBondContact O-N 3.1Å; I422-K424 VanDerWaalsContact C-N 3.3Å; I422-K424 PolarHBondContact O-N 2.75Å; I422-D425 PolarHBondContact O-N 2.9Å; I422-V426 HydrophobicContact CG2-CG2 4.1Å; I422-V426 WeakPolarHBondContact O-CB 3.2Å; I422-V426 VanDerWaalsContact O-CG2 3.24Å; I422-V426 WeakPolarHBondContact O-CG2 3.35Å; I422-V426 PolarHBondContact O-N 3.49Å; I422-Y445 HydrophobicContact CB-CD1 4.19Å; I422-Y445 HydrophobicContact CB-CE1 4.13Å; I422-Y445 HydrophobicContact CD1-CE1 4.24Å; I422-Y445 HydrophobicContact CG2-CD1 4Å; I422-Y445 HydrophobicContact CG2-CD2 3.82Å; I422-Y445 HydrophobicContact CG2-CE1 4.03Å; I422-Y445 HydrophobicContact CG2-CE2 3.85Å; I422-Y445 HydrophobicContact CG2-CG 3.91Å
423	G	94.2	Very high	93.6	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-59.9	-36.2	177.4	0	0	0	0	0	113.7	C419 Y420 A421 Q427	C419-G423 PolarHBondContact O-N 3.21Å; Y420-G423 PolarHBondContact O-N 3.47Å; A421-G423 VanDerWaalsContact C-N 3.32Å; A421-G423 PolarHBondContact O-N 2.62Å; G423-Q427 WeakPolarHBondContact O-CB 3.39Å; G423-Q427 PolarHBondContact O-N 3.25Å
424	K	93.8	Very high	93.3	Very high	41 Å²	41	51.7 Å²	51.7	18%	0.178	30%	0.301	C	S	.	.	H	α-helix	trans	-69	-41.7	174	-74.9	-63.5	-175.5	-169.3	0	112.5	L389 Y420 A421 I422 V426 Q427 A428 L449 E453	L389-K424 HydrophobicContact CD1-CB 4.47Å; L389-K424 HydrophobicContact CD1-CG 3.99Å; Y420-K424 HydrophobicContact CE1-CG 4.22Å; Y420-K424 VanDerWaalsContact CZ-CE 3.49Å; Y420-K424 WeakPolarHBondContact O-CG 3.39Å; Y420-K424 PolarHBondContact O-N 2.92Å; Y420-K424 WeakPolarHBondContact OH-CE 2.91Å; A421-K424 PolarHBondContact O-N 3.38Å; I422-K424 VanDerWaalsContact C-N 3.3Å; I422-K424 PolarHBondContact O-N 2.75Å; K424-V426 VanDerWaalsContact C-N 3.35Å; K424-Q427 WeakPolarHBondContact O-CB 3.38Å; K424-Q427 PolarHBondContact O-N 3.14Å; K424-A428 PolarHBondContact O-N 3.44Å; K424-L449 HydrophobicContact CD-CD1 4.04Å; K424-L449 HydrophobicContact CD-CD2 4.25Å; K424-L449 HydrophobicContact CG-CD1 4.16Å; K424-E453 IonicContact NZ-OE1 3.93Å; K424-E453 PolarHBondContact NZ-OE1 3.41Å
425	D	93.8	Very high	92.9	Very high	107 Å²	107	53 Å²	53	57%	0.572	30%	0.304	S	S	*	.	H	α-helix	trans	-62.9	-44.1	175.3	-69.8	-20.4	0	0	0	110.9	A421 I422 Q427 A428 M429	A421-D425 PolarHBondContact O-N 2.91Å; A421-D425 VanDerWaalsContact O-N 3.12Å; I422-D425 PolarHBondContact O-N 2.9Å; D425-Q427 VanDerWaalsContact C-N 3.34Å; D425-Q427 PolarHBondContact O-N 3.2Å; D425-A428 WeakPolarHBondContact O-CB 3.47Å; D425-A428 PolarHBondContact O-N 3.49Å; D425-M429 WeakPolarHBondContact O-CG 3.49Å; D425-M429 PolarHBondContact O-N 2.76Å
426	V	94.1	Very high	92.4	Very high	2 Å²	2	62.2 Å²	62.2	1%	0.012	35%	0.348	C	S	.	.	H	α-helix	trans	-63.2	-38.8	175.1	175.8	0	0	0	0	111.6	I422 K424 A428 M429 K430 L438 D442 L446	I422-V426 HydrophobicContact CG2-CG2 4.1Å; I422-V426 WeakPolarHBondContact O-CB 3.2Å; I422-V426 VanDerWaalsContact O-CG2 3.24Å; I422-V426 WeakPolarHBondContact O-CG2 3.35Å; I422-V426 PolarHBondContact O-N 3.49Å; K424-V426 VanDerWaalsContact C-N 3.35Å; V426-A428 VanDerWaalsContact C-N 3.31Å; V426-A428 PolarHBondContact O-N 3.12Å; V426-M429 HydrophobicContact CB-CE 4.26Å; V426-M429 HydrophobicContact CG2-CE 3.76Å; V426-M429 PolarHBondContact O-N 2.94Å; V426-K430 WeakPolarHBondContact O-CB 3.5Å; V426-K430 PolarHBondContact O-N 2.81Å; V426-L438 HydrophobicContact CG1-CD2 3.75Å; V426-D442 HydrophobicContact CG1-CB 3.65Å; V426-D442 HydrophobicContact CG2-CB 4.36Å; V426-D442 WeakPolarHBondContact CG2-OD1 3.41Å; V426-L446 HydrophobicContact CB-CD2 4.46Å; V426-L446 HydrophobicContact CG1-CD1 4.11Å; V426-L446 HydrophobicContact CG1-CD2 3.93Å; V426-L446 HydrophobicContact CG1-CG 3.74Å
427	Q	92.8	Very high	92	Very high	79 Å²	79	65.3 Å²	65.3	37%	0.369	37%	0.373	S	S	.	.	H	α-helix	trans	-61.6	-39.9	174.2	-176.5	175.5	40.1	0	0	111.7	G423 K424 D425 A431 L446 L449	G423-Q427 WeakPolarHBondContact O-CB 3.39Å; G423-Q427 PolarHBondContact O-N 3.25Å; K424-Q427 WeakPolarHBondContact O-CB 3.38Å; K424-Q427 PolarHBondContact O-N 3.14Å; D425-Q427 VanDerWaalsContact C-N 3.34Å; D425-Q427 PolarHBondContact O-N 3.2Å; Q427-A431 PolarHBondContact O-N 3.39Å; Q427-L446 HydrophobicContact CB-CD2 3.96Å; Q427-L449 HydrophobicContact CB-CD2 3.98Å; Q427-L449 HydrophobicContact CG-CD2 4.33Å
428	A	92.8	Very high	91.7	Very high	57 Å²	57	62.1 Å²	62.1	47%	0.471	36%	0.362	S	S	.	.	H	α-helix	trans	-67.3	-42.5	174.7	0	0	0	0	0	111.5	K424 D425 V426 A431 V432	K424-A428 PolarHBondContact O-N 3.44Å; D425-A428 WeakPolarHBondContact O-CB 3.47Å; D425-A428 PolarHBondContact O-N 3.49Å; V426-A428 VanDerWaalsContact C-N 3.31Å; V426-A428 PolarHBondContact O-N 3.12Å; A428-A431 WeakPolarHBondContact O-CB 3.44Å; A428-A431 PolarHBondContact O-N 3.16Å; A428-V432 PolarHBondContact O-N 3.23Å
429	M	89.9	Confident	91.6	Very high	94 Å²	94	65 Å²	65	46%	0.463	38%	0.379	S	S	.	.	H	α-helix	trans	-62.3	-42.1	175.3	-70.2	-170.6	-67.7	0	0	112.2	D425 V426 A431 V432 V433	D425-M429 WeakPolarHBondContact O-CG 3.49Å; D425-M429 PolarHBondContact O-N 2.76Å; V426-M429 HydrophobicContact CB-CE 4.26Å; V426-M429 HydrophobicContact CG2-CE 3.76Å; V426-M429 PolarHBondContact O-N 2.94Å; M429-A431 VanDerWaalsContact C-N 3.25Å; M429-A431 PolarHBondContact O-N 3.37Å; M429-V432 PolarHBondContact O-N 3.17Å; M429-V433 PolarHBondContact O-N 3.11Å
430	K	92.8	Very high	91.3	Very high	63 Å²	63	69.5 Å²	69.5	27%	0.274	41%	0.41	S	S	.	.	H	α-helix	trans	-56	-40.8	174.6	176.1	169.6	176.4	163.7	0	111.7	V426 V432 G434 E435 L438 L446	V426-K430 WeakPolarHBondContact O-CB 3.5Å; V426-K430 PolarHBondContact O-N 2.81Å; K430-V432 VanDerWaalsContact C-N 3.26Å; K430-V432 PolarHBondContact O-N 3.32Å; K430-G434 VanDerWaalsContact O-CA 3.3Å; K430-G434 WeakPolarHBondContact O-CA 3.43Å; K430-G434 PolarHBondContact O-N 3.16Å; K430-E435 WeakPolarHBondContact CE-OE2 3.44Å; K430-E435 IonicContact NZ-OE1 2.76Å; K430-E435 PolarHBondContact NZ-OE1 3.45Å; K430-E435 IonicContact NZ-OE2 2.9Å; K430-E435 PolarHBondContact NZ-OE2 3.37Å; K430-L438 HydrophobicContact CB-CD1 3.96Å; K430-L438 HydrophobicContact CB-CD2 4.47Å; K430-L438 HydrophobicContact CD-CD1 3.98Å; K430-L438 HydrophobicContact CG-CD1 3.96Å; K430-L446 HydrophobicContact CB-CD1 4.46Å; K430-L446 HydrophobicContact CD-CD1 3.62Å
431	A	91.5	Very high	91	Very high	90 Å²	90	74.5 Å²	74.5	74%	0.744	43%	0.433	S	S	*	.	H	α-helix	trans	-67.9	-25.8	179.2	0	0	0	0	0	113.2	Q427 A428 M429	Q427-A431 PolarHBondContact O-N 3.39Å; A428-A431 WeakPolarHBondContact O-CB 3.44Å; A428-A431 PolarHBondContact O-N 3.16Å; M429-A431 VanDerWaalsContact C-N 3.25Å; M429-A431 PolarHBondContact O-N 3.37Å
432	V	92.3	Very high	90.9	Very high	127 Å²	127	74.7 Å²	74.7	77%	0.77	43%	0.431	S	S	*	.	H	α-helix	trans	-91.5	-48.3	-178.2	176.9	0	0	0	0	112.2	A428 M429 K430	A428-V432 PolarHBondContact O-N 3.23Å; M429-V432 PolarHBondContact O-N 3.17Å; K430-V432 VanDerWaalsContact C-N 3.26Å; K430-V432 PolarHBondContact O-N 3.32Å
433	V	89.8	Confident	90.7	Very high	100 Å²	100	75.2 Å²	75.2	61%	0.606	43%	0.434	S	S	*	.	H	α-helix	trans	-98.8	-17.3	-169.9	-163.6	0	0	0	0	112.2	M429 A437	M429-V433 PolarHBondContact O-N 3.11Å; V433-A437 HydrophobicContact CB-CB 4.2Å; V433-A437 HydrophobicContact CG1-CB 3.41Å; V433-A437 VanDerWaalsContact CG1-CB 3.41Å
434	G	88.1	Confident	90.7	Very high	31 Å²	31	77.4 Å²	77.4	32%	0.32	45%	0.445	S	S	.	.			trans	90.2	172.3	-174.7	0	0	0	0	0	113	K430	K430-G434 VanDerWaalsContact O-CA 3.3Å; K430-G434 WeakPolarHBondContact O-CA 3.43Å; K430-G434 PolarHBondContact O-N 3.16Å
435	E	85.5	Confident	90.7	Very high	111 Å²	111	76.6 Å²	76.6	52%	0.519	44%	0.441	S	S	.	.	S	Bend	trans	-76.4	-31.1	-172.1	-175.3	152.7	-150.7	0	0	113.7	K430 A437 L438	K430-E435 WeakPolarHBondContact CE-OE2 3.44Å; K430-E435 IonicContact NZ-OE1 2.76Å; K430-E435 PolarHBondContact NZ-OE1 3.45Å; K430-E435 IonicContact NZ-OE2 2.9Å; K430-E435 PolarHBondContact NZ-OE2 3.37Å; E435-A437 PolarHBondContact O-N 2.76Å; E435-L438 HydrophobicContact CG-CD1 4.39Å; E435-L438 WeakPolarHBondContact O-CB 3.3Å; E435-L438 PolarHBondContact O-N 2.61Å
436	E	84.3	Confident	90.7	Very high	201 Å²	201	72.3 Å²	72.3	94%	0.939	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-17.9	-175.3	-59.4	-177.2	172.2	0	0	113.6
437	A	86.7	Confident	90.6	Very high	65 Å²	65	76 Å²	76	54%	0.537	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-2.1	-179.9	0	0	0	0	0	113.7	V433 E435	V433-A437 HydrophobicContact CB-CB 4.2Å; V433-A437 HydrophobicContact CG1-CB 3.41Å; V433-A437 VanDerWaalsContact CG1-CB 3.41Å; E435-A437 PolarHBondContact O-N 2.76Å
438	L	88.9	Confident	90.8	Very high	26 Å²	26	72.2 Å²	72.2	14%	0.136	42%	0.418	C	S	.	.			trans	-82.3	142.4	-177.2	-67.9	161.3	0	0	0	111.1	V426 K430 E435 D442 L443 L446	V426-L438 HydrophobicContact CG1-CD2 3.75Å; K430-L438 HydrophobicContact CB-CD1 3.96Å; K430-L438 HydrophobicContact CB-CD2 4.47Å; K430-L438 HydrophobicContact CD-CD1 3.98Å; K430-L438 HydrophobicContact CG-CD1 3.96Å; E435-L438 HydrophobicContact CG-CD1 4.39Å; E435-L438 WeakPolarHBondContact O-CB 3.3Å; E435-L438 PolarHBondContact O-N 2.61Å; L438-D442 HydrophobicContact CB-CB 4.04Å; L438-D442 HydrophobicContact CD2-CB 3.8Å; L438-L443 HydrophobicContact CB-CD2 4.28Å; L438-L443 HydrophobicContact CB-CG 4.4Å; L438-L443 HydrophobicContact CD1-CD2 4.18Å; L438-L446 HydrophobicContact CD1-CD1 3.69Å
439	T	91.5	Very high	90.8	Very high	74 Å²	74	69.6 Å²	69.6	45%	0.454	40%	0.396	S	S	.	.			trans	-73.1	163.7	172.3	67.5	0	0	0	0	110.9	E441 D442 L443	T439-E441 PolarHBondContact O-N 3.3Å; T439-D442 WeakPolarHBondContact CB-OD2 3.34Å; T439-D442 PolarHBondContact N-OD2 3.25Å; T439-D442 WeakPolarHBondContact O-CB 3.44Å; T439-D442 PolarHBondContact O-N 2.84Å; T439-D442 VanDerWaalsContact O-N 3.14Å; T439-D442 PolarHBondContact OG1-N 2.97Å; T439-D442 PolarHBondContact OG1-OD2 2.97Å; T439-L443 PolarHBondContact O-N 3.48Å; T439-L443 VanDerWaalsContact O-N 3.08Å
440	S	88.9	Confident	91	Very high	96 Å²	96	70.4 Å²	70.4	67%	0.671	40%	0.398	S	S	*	.	H	α-helix	trans	-60.1	-31	173.6	52.3	0	0	0	0	112.6	L444	S440-L444 PolarHBondContact O-N 3.06Å
441	E	90	Very high	91.1	Very high	105 Å²	105	71.2 Å²	71.2	49%	0.491	40%	0.402	S	S	.	.	H	α-helix	trans	-68.8	-42.8	174.5	-66.5	-173.4	-171.2	0	0	111.5	T439 L443 L444 Y445 M485	T439-E441 PolarHBondContact O-N 3.3Å; E441-L443 VanDerWaalsContact C-N 3.29Å; E441-L443 PolarHBondContact O-N 3.14Å; E441-L444 WeakPolarHBondContact O-CB 3.38Å; E441-L444 PolarHBondContact O-N 2.86Å; E441-L444 VanDerWaalsContact O-N 3.11Å; E441-Y445 VanDerWaalsContact O-CD2 3.23Å; E441-Y445 WeakPolarHBondContact O-CD2 3.46Å; E441-Y445 PolarHBondContact O-N 2.64Å; E441-Y445 VanDerWaalsContact O-N 3.07Å; E441-M485 HydrophobicContact CB-CE 3.86Å; E441-M485 HydrophobicContact CG-CE 3.8Å; E441-M485 HydrophobicContact CG-SD 4.27Å
442	D	92.3	Very high	91.2	Very high	33 Å²	33	67 Å²	67	18%	0.176	37%	0.367	C	S	.	.	H	α-helix	trans	-61.4	-39.3	177.5	-65.8	-36.2	0	0	0	111.8	V426 L438 T439 L444 Y445 L446	V426-D442 HydrophobicContact CG1-CB 3.65Å; V426-D442 HydrophobicContact CG2-CB 4.36Å; V426-D442 WeakPolarHBondContact CG2-OD1 3.41Å; L438-D442 HydrophobicContact CB-CB 4.04Å; L438-D442 HydrophobicContact CD2-CB 3.8Å; T439-D442 WeakPolarHBondContact CB-OD2 3.34Å; T439-D442 PolarHBondContact N-OD2 3.25Å; T439-D442 WeakPolarHBondContact O-CB 3.44Å; T439-D442 PolarHBondContact O-N 2.84Å; T439-D442 VanDerWaalsContact O-N 3.14Å; T439-D442 PolarHBondContact OG1-N 2.97Å; T439-D442 PolarHBondContact OG1-OD2 2.97Å; D442-L444 VanDerWaalsContact C-N 3.3Å; D442-L444 PolarHBondContact O-N 2.84Å; D442-Y445 PolarHBondContact O-N 3.29Å; D442-L446 WeakPolarHBondContact O-CG 3.22Å; D442-L446 PolarHBondContact O-N 3.19Å
443	L	91.4	Very high	91.3	Very high	77 Å²	77	61 Å²	61	40%	0.403	33%	0.33	S	S	.	.	H	α-helix	trans	-61	-38.8	174.7	-68.6	175.5	0	0	0	112	L438 T439 E441 L446 E447	L438-L443 HydrophobicContact CB-CD2 4.28Å; L438-L443 HydrophobicContact CB-CG 4.4Å; L438-L443 HydrophobicContact CD1-CD2 4.18Å; T439-L443 PolarHBondContact O-N 3.48Å; T439-L443 VanDerWaalsContact O-N 3.08Å; E441-L443 VanDerWaalsContact C-N 3.29Å; E441-L443 PolarHBondContact O-N 3.14Å; L443-L446 PolarHBondContact O-N 3.23Å; L443-E447 PolarHBondContact O-N 3.28Å
444	L	93.3	Very high	91.5	Very high	46 Å²	46	62.3 Å²	62.3	24%	0.241	33%	0.328	C	S	.	.	H	α-helix	trans	-66.1	-39.9	174.7	-67.8	171.6	0	0	0	111.9	S440 E441 D442 L446 E447 F448 I480 F481 M485	S440-L444 PolarHBondContact O-N 3.06Å; E441-L444 WeakPolarHBondContact O-CB 3.38Å; E441-L444 PolarHBondContact O-N 2.86Å; E441-L444 VanDerWaalsContact O-N 3.11Å; D442-L444 VanDerWaalsContact C-N 3.3Å; D442-L444 PolarHBondContact O-N 2.84Å; L444-L446 VanDerWaalsContact C-N 3.31Å; L444-L446 PolarHBondContact O-N 2.84Å; L444-E447 PolarHBondContact O-N 3.17Å; L444-F448 WeakPolarHBondContact O-CB 3.24Å; L444-F448 PolarHBondContact O-N 3.21Å; L444-I480 HydrophobicContact CD2-CG2 4.19Å; L444-F481 HydrophobicContact CB-CD1 4.14Å; L444-F481 HydrophobicContact CB-CE1 3.87Å; L444-M485 HydrophobicContact CD1-SD 4.41Å
445	Y	94.3	Very high	91.7	Very high	24 Å²	24	64.8 Å²	64.8	9%	0.094	33%	0.334	C	S	.	.	H	α-helix	trans	-64	-36.3	175.2	-77.2	-68.1	0	0	0	112.5	C419 I422 E441 D442 L449 F481 M485	C419-Y445 HydrophobicContact CB-CD1 4.35Å; C419-Y445 HydrophobicContact CB-CE1 4.1Å; I422-Y445 HydrophobicContact CB-CD1 4.19Å; I422-Y445 HydrophobicContact CB-CE1 4.13Å; I422-Y445 HydrophobicContact CD1-CE1 4.24Å; I422-Y445 HydrophobicContact CG2-CD1 4Å; I422-Y445 HydrophobicContact CG2-CD2 3.82Å; I422-Y445 HydrophobicContact CG2-CE1 4.03Å; I422-Y445 HydrophobicContact CG2-CE2 3.85Å; I422-Y445 HydrophobicContact CG2-CG 3.91Å; E441-Y445 VanDerWaalsContact O-CD2 3.23Å; E441-Y445 WeakPolarHBondContact O-CD2 3.46Å; E441-Y445 PolarHBondContact O-N 2.64Å; E441-Y445 VanDerWaalsContact O-N 3.07Å; D442-Y445 PolarHBondContact O-N 3.29Å; Y445-L449 WeakPolarHBondContact O-CB 3.33Å; Y445-L449 PolarHBondContact O-N 3.3Å; Y445-F481 AromaticContact CD1-CE1 3.67Å; Y445-F481 HydrophobicContact CD1-CE1 3.67Å; Y445-F481 AromaticContact CD1-CZ 3.5Å; Y445-F481 HydrophobicContact CD1-CZ 3.5Å; Y445-F481 HydrophobicContact CD2-CE1 4.38Å; Y445-F481 AromaticContact CE1-CE1 3.73Å; Y445-F481 HydrophobicContact CE1-CE1 3.73Å; Y445-F481 AromaticContact CE1-CZ 3.73Å; Y445-F481 HydrophobicContact CE1-CZ 3.73Å; Y445-F481 HydrophobicContact CE2-CE1 4.44Å; Y445-F481 AromaticContact CG-CE1 4Å; Y445-F481 HydrophobicContact CG-CE1 4Å; Y445-F481 HydrophobicContact CG-CZ 4.17Å; Y445-M485 HydrophobicContact CE2-CE 3.71Å
446	L	92.9	Very high	92.1	Very high	18 Å²	18	59.5 Å²	59.5	9%	0.094	31%	0.309	C	S	.	.	H	α-helix	trans	-68.2	-41.6	174.1	-70.2	176.1	0	0	0	112.4	V426 Q427 K430 L438 D442 L443 L444 L449 Q450	V426-L446 HydrophobicContact CB-CD2 4.46Å; V426-L446 HydrophobicContact CG1-CD1 4.11Å; V426-L446 HydrophobicContact CG1-CD2 3.93Å; V426-L446 HydrophobicContact CG1-CG 3.74Å; Q427-L446 HydrophobicContact CB-CD2 3.96Å; K430-L446 HydrophobicContact CB-CD1 4.46Å; K430-L446 HydrophobicContact CD-CD1 3.62Å; L438-L446 HydrophobicContact CD1-CD1 3.69Å; D442-L446 WeakPolarHBondContact O-CG 3.22Å; D442-L446 PolarHBondContact O-N 3.19Å; L443-L446 PolarHBondContact O-N 3.23Å; L444-L446 VanDerWaalsContact C-N 3.31Å; L444-L446 PolarHBondContact O-N 2.84Å; L446-L449 PolarHBondContact O-N 2.87Å; L446-Q450 PolarHBondContact O-N 3.1Å; L446-Q450 VanDerWaalsContact O-N 3.16Å
447	E	93.7	Very high	92.6	Very high	78 Å²	78	50 Å²	50	36%	0.364	26%	0.264	S	S	.	.	H	α-helix	trans	-62.6	-45	174.7	-170.8	-174.1	161.5	0	0	111	L443 L444 L449 Q450 K451	L443-E447 PolarHBondContact O-N 3.28Å; L444-E447 PolarHBondContact O-N 3.17Å; E447-L449 VanDerWaalsContact C-N 3.34Å; E447-L449 PolarHBondContact O-N 3.29Å; E447-Q450 PolarHBondContact O-N 2.88Å; E447-K451 HydrophobicContact CG-CD 4.25Å; E447-K451 PolarHBondContact O-N 3.27Å; E447-K451 WeakPolarHBondContact OE1-CE 3.46Å; E447-K451 IonicContact OE1-NZ 3.8Å; E447-K451 PolarHBondContact OE1-NZ 3.19Å
448	F	95.3	Very high	92.9	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-57.6	-46.8	174	170.5	-95.3	0	0	0	111.2	L416 C419 L444 Q450 K451 F452 L477 F481	L416-F448 HydrophobicContact CD2-CE2 3.74Å; L416-F448 HydrophobicContact CD2-CZ 3.66Å; C419-F448 HydrophobicContact CB-CD1 3.87Å; C419-F448 HydrophobicContact CB-CE1 3.48Å; C419-F448 VanDerWaalsContact CB-CE1 3.48Å; C419-F448 HydrophobicContact CB-CE2 4.42Å; C419-F448 HydrophobicContact CB-CZ 3.79Å; L444-F448 WeakPolarHBondContact O-CB 3.24Å; L444-F448 PolarHBondContact O-N 3.21Å; F448-Q450 VanDerWaalsContact C-N 3.33Å; F448-Q450 PolarHBondContact O-N 3.01Å; F448-K451 PolarHBondContact O-N 3.31Å; F448-F452 HydrophobicContact CE1-CB 4.17Å; F448-F452 HydrophobicContact CE1-CD2 4.32Å; F448-F452 HydrophobicContact CE1-CG 4.29Å; F448-F452 HydrophobicContact CE2-CB 4.5Å; F448-F452 HydrophobicContact CE2-CD2 4.29Å; F448-F452 HydrophobicContact CZ-CB 4.16Å; F448-F452 AromaticContact CZ-CD2 3.72Å; F448-F452 HydrophobicContact CZ-CD2 3.72Å; F448-F452 HydrophobicContact CZ-CE2 4.44Å; F448-F452 HydrophobicContact CZ-CG 4.12Å; F448-F452 WeakPolarHBondContact O-CB 3.26Å; F448-F452 PolarHBondContact O-N 2.96Å; F448-L477 HydrophobicContact CD2-CB 4.16Å; F448-L477 HydrophobicContact CE2-CB 3.83Å; F448-F481 HydrophobicContact CB-CE2 3.68Å; F448-F481 HydrophobicContact CB-CZ 3.52Å; F448-F481 HydrophobicContact CD1-CE2 4.32Å; F448-F481 HydrophobicContact CD1-CZ 4.38Å; F448-F481 HydrophobicContact CD2-CD2 4.48Å; F448-F481 AromaticContact CD2-CE2 3.54Å; F448-F481 HydrophobicContact CD2-CE2 3.54Å; F448-F481 HydrophobicContact CD2-CZ 4.25Å; F448-F481 HydrophobicContact CE2-CE2 4.25Å; F448-F481 AromaticContact CG-CE2 3.57Å; F448-F481 HydrophobicContact CG-CE2 3.57Å; F448-F481 AromaticContact CG-CZ 3.8Å; F448-F481 HydrophobicContact CG-CZ 3.8Å
449	L	94.4	Very high	93	Very high	2 Å²	2	48.8 Å²	48.8	1%	0.01	25%	0.249	C	C	.	.	H	α-helix	trans	-56.7	-47.3	-179.3	-175.1	72.9	0	0	0	111.6	Y420 K424 Q427 Y445 L446 E447 F452 E453	Y420-L449 HydrophobicContact CD2-CD1 3.48Å; Y420-L449 VanDerWaalsContact CD2-CD1 3.48Å; Y420-L449 HydrophobicContact CE2-CD1 3.33Å; Y420-L449 HydrophobicContact CG-CD1 4.38Å; K424-L449 HydrophobicContact CD-CD1 4.04Å; K424-L449 HydrophobicContact CD-CD2 4.25Å; K424-L449 HydrophobicContact CG-CD1 4.16Å; Q427-L449 HydrophobicContact CB-CD2 3.98Å; Q427-L449 HydrophobicContact CG-CD2 4.33Å; Y445-L449 WeakPolarHBondContact O-CB 3.33Å; Y445-L449 PolarHBondContact O-N 3.3Å; L446-L449 PolarHBondContact O-N 2.87Å; E447-L449 VanDerWaalsContact C-N 3.34Å; E447-L449 PolarHBondContact O-N 3.29Å; L449-F452 PolarHBondContact O-N 3.23Å; L449-E453 WeakPolarHBondContact O-CB 3.38Å; L449-E453 WeakPolarHBondContact O-CG 3.39Å; L449-E453 PolarHBondContact O-N 3.29Å
450	Q	92.9	Very high	93	Very high	111 Å²	111	46.5 Å²	46.5	52%	0.519	24%	0.24	S	C	.	.	H	α-helix	trans	-64.9	-44.2	178.3	-68.4	-173.6	6.2	0	0	112.2	L446 E447 F448 K454	L446-Q450 PolarHBondContact O-N 3.1Å; L446-Q450 VanDerWaalsContact O-N 3.16Å; E447-Q450 PolarHBondContact O-N 2.88Å; F448-Q450 VanDerWaalsContact C-N 3.33Å; F448-Q450 PolarHBondContact O-N 3.01Å; Q450-K454 VanDerWaalsContact O-CB 3.3Å; Q450-K454 WeakPolarHBondContact O-CB 3.3Å; Q450-K454 WeakPolarHBondContact O-CG 3Å; Q450-K454 PolarHBondContact O-N 3.5Å
451	K	94.6	Very high	92.9	Very high	81 Å²	81	44.5 Å²	44.5	35%	0.352	23%	0.225	S	C	.	.	H	α-helix	trans	-69.6	-34.7	179.4	-76	179.5	170	172.1	0	112.3	E447 F448 N455 L477 I480	E447-K451 HydrophobicContact CG-CD 4.25Å; E447-K451 PolarHBondContact O-N 3.27Å; E447-K451 WeakPolarHBondContact OE1-CE 3.46Å; E447-K451 IonicContact OE1-NZ 3.8Å; E447-K451 PolarHBondContact OE1-NZ 3.19Å; F448-K451 PolarHBondContact O-N 3.31Å; K451-N455 WeakPolarHBondContact O-CB 3.49Å; K451-N455 PolarHBondContact O-N 3.43Å; K451-L477 HydrophobicContact CB-CD2 3.68Å; K451-I480 HydrophobicContact CB-CD1 4.34Å; K451-I480 HydrophobicContact CD-CD1 3.52Å
452	F	95.2	Very high	92.9	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	23%	0.23	C	C	.	.	I	π-helix	trans	-64.6	-50.2	175.8	-176.2	-96.2	0	0	0	110.7	V388 L416 Y420 F448 L449 K454 F456 I457 L477	V388-F452 HydrophobicContact CG2-CE1 4.11Å; V388-F452 HydrophobicContact CG2-CZ 4.4Å; L416-F452 HydrophobicContact CB-CE2 4.28Å; L416-F452 HydrophobicContact CD1-CE2 4.39Å; L416-F452 HydrophobicContact CD2-CD2 4.21Å; L416-F452 HydrophobicContact CD2-CE2 4.1Å; L416-F452 HydrophobicContact CG-CE2 4.5Å; Y420-F452 AromaticContact CD2-CD1 3.37Å; Y420-F452 HydrophobicContact CD2-CD1 3.37Å; Y420-F452 AromaticContact CD2-CE1 3.65Å; Y420-F452 HydrophobicContact CD2-CE1 3.65Å; Y420-F452 HydrophobicContact CD2-CG 4.2Å; Y420-F452 AromaticContact CE2-CD1 3.61Å; Y420-F452 HydrophobicContact CE2-CD1 3.61Å; Y420-F452 AromaticContact CE2-CE1 3.93Å; Y420-F452 HydrophobicContact CE2-CE1 3.93Å; Y420-F452 HydrophobicContact CG-CD1 4.28Å; Y420-F452 HydrophobicContact CG-CE1 4.15Å; F448-F452 HydrophobicContact CE1-CB 4.17Å; F448-F452 HydrophobicContact CE1-CD2 4.32Å; F448-F452 HydrophobicContact CE1-CG 4.29Å; F448-F452 HydrophobicContact CE2-CB 4.5Å; F448-F452 HydrophobicContact CE2-CD2 4.29Å; F448-F452 HydrophobicContact CZ-CB 4.16Å; F448-F452 AromaticContact CZ-CD2 3.72Å; F448-F452 HydrophobicContact CZ-CD2 3.72Å; F448-F452 HydrophobicContact CZ-CE2 4.44Å; F448-F452 HydrophobicContact CZ-CG 4.12Å; F448-F452 WeakPolarHBondContact O-CB 3.26Å; F448-F452 PolarHBondContact O-N 2.96Å; L449-F452 PolarHBondContact O-N 3.23Å; F452-K454 PolarHBondContact O-N 3.17Å; F452-F456 HydrophobicContact CD2-CB 4.01Å; F452-F456 HydrophobicContact CD2-CD1 4.03Å; F452-F456 HydrophobicContact CD2-CG 4.09Å; F452-F456 HydrophobicContact CE1-CD1 4.32Å; F452-F456 HydrophobicContact CE2-CB 4.22Å; F452-F456 AromaticContact CE2-CD1 3.35Å; F452-F456 HydrophobicContact CE2-CD1 3.35Å; F452-F456 AromaticContact CE2-CE1 3.72Å; F452-F456 HydrophobicContact CE2-CE1 3.72Å; F452-F456 AromaticContact CE2-CG 3.8Å; F452-F456 HydrophobicContact CE2-CG 3.8Å; F452-F456 HydrophobicContact CE2-CZ 4.43Å; F452-F456 HydrophobicContact CG-CB 4.45Å; F452-F456 AromaticContact CZ-CD1 3.54Å; F452-F456 HydrophobicContact CZ-CD1 3.54Å; F452-F456 AromaticContact CZ-CE1 3.8Å; F452-F456 HydrophobicContact CZ-CE1 3.8Å; F452-F456 HydrophobicContact CZ-CG 4.4Å; F452-F456 WeakPolarHBondContact O-CA 2.98Å; F452-F456 VanDerWaalsContact O-CB 3.29Å; F452-F456 WeakPolarHBondContact O-CB 3.26Å; F452-F456 PolarHBondContact O-N 3.21Å; F452-I457 HydrophobicContact CD1-CD1 3.84Å; F452-I457 HydrophobicContact CD1-CG1 3.93Å; F452-I457 HydrophobicContact CE1-CD1 3.66Å; F452-I457 HydrophobicContact CE1-CG1 3.7Å; F452-I457 HydrophobicContact CZ-CG1 4.42Å; F452-I457 PolarHBondContact O-N 3.41Å; F452-L477 HydrophobicContact CB-CD1 4.18Å; F452-L477 HydrophobicContact CD2-CD1 3.76Å; F452-L477 HydrophobicContact CG-CD1 4.41Å
453	E	94.5	Very high	92.8	Very high	1 Å²	1	49 Å²	49	1%	0.005	24%	0.239	C	C	.	.	I	π-helix	trans	-64	-38.8	177.7	-71.2	174.4	157.2	0	0	112.4	L377 R380 I382 Y420 K424 L449 I457 N458	L377-E453 HydrophobicContact CD2-CG 4.29Å; R380-E453 IonicContact CZ-OE2 3.58Å; R380-E453 IonicContact NH1-OE1 3.91Å; R380-E453 PolarHBondContact NH1-OE1 2.83Å; R380-E453 VanDerWaalsContact NH1-OE1 3.11Å; R380-E453 IonicContact NH1-OE2 3.53Å; R380-E453 PolarHBondContact NH1-OE2 3.34Å; R380-E453 IonicContact NH2-OE2 3.71Å; R380-E453 PolarHBondContact NH2-OE2 2.85Å; I382-E453 HydrophobicContact CD1-CB 3.96Å; Y420-E453 HydrophobicContact CE2-CG 4.06Å; K424-E453 IonicContact NZ-OE1 3.93Å; K424-E453 PolarHBondContact NZ-OE1 3.41Å; L449-E453 WeakPolarHBondContact O-CB 3.38Å; L449-E453 WeakPolarHBondContact O-CG 3.39Å; L449-E453 PolarHBondContact O-N 3.29Å; E453-I457 HydrophobicContact CG-CD1 4.14Å; E453-N458 WeakPolarHBondContact O-CB 3.3Å; E453-N458 PolarHBondContact O-N 3.05Å; E453-N458 VanDerWaalsContact O-N 3.12Å
454	K	93.1	Very high	92.7	Very high	129 Å²	129	49.3 Å²	49.3	56%	0.561	24%	0.241	S	C	*	.	I	π-helix	trans	-83	-28.3	-177.2	-75.1	-176.3	176	-178	0	116.1	Q450 F452 N458	Q450-K454 VanDerWaalsContact O-CB 3.3Å; Q450-K454 WeakPolarHBondContact O-CB 3.3Å; Q450-K454 WeakPolarHBondContact O-CG 3Å; Q450-K454 PolarHBondContact O-N 3.5Å; F452-K454 PolarHBondContact O-N 3.17Å; K454-N458 WeakPolarHBondContact O-CB 3.23Å
455	N	92.8	Very high	92.7	Very high	83 Å²	83	48.2 Å²	48.2	44%	0.444	23%	0.234	S	C	.	.	I	π-helix	trans	-113.1	-35.2	-173.7	-59	-22.7	0	0	0	112.5	K451 R465	K451-N455 WeakPolarHBondContact O-CB 3.49Å; K451-N455 PolarHBondContact O-N 3.43Å; N455-R465 PolarHBondContact O-NH1 2.74Å; N455-R465 VanDerWaalsContact O-NH1 3.15Å
456	F	93.8	Very high	92.5	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	24%	0.239	C	C	.	.	I	π-helix	trans	-94.8	-51	-174.7	-174.8	-90	0	0	0	112.1	S169 V173 M174 L416 F452 S470 L473 L477	S169-F456 WeakPolarHBondContact CB-O 3.38Å; V173-F456 HydrophobicContact CB-CZ 3.81Å; V173-F456 HydrophobicContact CG1-CE2 4.47Å; V173-F456 HydrophobicContact CG1-CZ 3.89Å; V173-F456 HydrophobicContact CG2-CZ 4.24Å; M174-F456 HydrophobicContact CG-CE1 4.01Å; M174-F456 HydrophobicContact CG-CZ 4.4Å; M174-F456 HydrophobicContact SD-CE1 4.42Å; L416-F456 HydrophobicContact CD1-CE2 4.25Å; L416-F456 HydrophobicContact CD1-CZ 4.16Å; F452-F456 HydrophobicContact CD2-CB 4.01Å; F452-F456 HydrophobicContact CD2-CD1 4.03Å; F452-F456 HydrophobicContact CD2-CG 4.09Å; F452-F456 HydrophobicContact CE1-CD1 4.32Å; F452-F456 HydrophobicContact CE2-CB 4.22Å; F452-F456 AromaticContact CE2-CD1 3.35Å; F452-F456 HydrophobicContact CE2-CD1 3.35Å; F452-F456 AromaticContact CE2-CE1 3.72Å; F452-F456 HydrophobicContact CE2-CE1 3.72Å; F452-F456 AromaticContact CE2-CG 3.8Å; F452-F456 HydrophobicContact CE2-CG 3.8Å; F452-F456 HydrophobicContact CE2-CZ 4.43Å; F452-F456 HydrophobicContact CG-CB 4.45Å; F452-F456 AromaticContact CZ-CD1 3.54Å; F452-F456 HydrophobicContact CZ-CD1 3.54Å; F452-F456 AromaticContact CZ-CE1 3.8Å; F452-F456 HydrophobicContact CZ-CE1 3.8Å; F452-F456 HydrophobicContact CZ-CG 4.4Å; F452-F456 WeakPolarHBondContact O-CA 2.98Å; F452-F456 VanDerWaalsContact O-CB 3.29Å; F452-F456 WeakPolarHBondContact O-CB 3.26Å; F452-F456 PolarHBondContact O-N 3.21Å; F456-S470 WeakPolarHBondContact CE2-O 3.34Å; F456-L473 HydrophobicContact CD2-CB 4.3Å; F456-L477 HydrophobicContact CB-CD1 3.61Å; F456-L477 HydrophobicContact CD2-CD1 4.32Å; F456-L477 HydrophobicContact CG-CD1 4.25Å
457	I	93.4	Very high	92.4	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.235	C	C	.	.	I	π-helix	trans	-72.5	-48.6	175.2	-54.7	-178.7	0	0	0	109.6	P170 I382 P384 F452 E453 Q459	P170-I457 HydrophobicContact CG-CG2 4.48Å; I382-I457 HydrophobicContact CG2-CB 4.34Å; I382-I457 HydrophobicContact CG2-CG2 3.88Å; P384-I457 WeakPolarHBondContact CD-O 3.4Å; P384-I457 VanDerWaalsContact O-CG2 3.23Å; P384-I457 WeakPolarHBondContact O-CG2 3.26Å; F452-I457 HydrophobicContact CD1-CD1 3.84Å; F452-I457 HydrophobicContact CD1-CG1 3.93Å; F452-I457 HydrophobicContact CE1-CD1 3.66Å; F452-I457 HydrophobicContact CE1-CG1 3.7Å; F452-I457 HydrophobicContact CZ-CG1 4.42Å; F452-I457 PolarHBondContact O-N 3.41Å; E453-I457 HydrophobicContact CG-CD1 4.14Å; I457-Q459 PolarHBondContact O-N 3.25Å
458	N	93.4	Very high	92.2	Very high	59 Å²	59	47.6 Å²	47.6	32%	0.316	23%	0.234	S	C	.	.			trans	-67.6	123.7	-178.8	-159.2	34.6	0	0	0	111.3	I382 Y383 E453 K454 R465	I382-N458 HydrophobicContact CG2-CB 4.18Å; Y383-N458 PolarHBondContact N-OD1 3.09Å; Y383-N458 CarbonylContact O-C 3.53Å; Y383-N458 WeakPolarHBondContact O-CA 3.5Å; Y383-N458 PolarHBondContact O-OD1 3Å; E453-N458 WeakPolarHBondContact O-CB 3.3Å; E453-N458 PolarHBondContact O-N 3.05Å; E453-N458 VanDerWaalsContact O-N 3.12Å; K454-N458 WeakPolarHBondContact O-CB 3.23Å; N458-R465 PolarHBondContact O-NH2 3.48Å
459	Q	91.3	Very high	92.1	Very high	7 Å²	7	52.5 Å²	52.5	3%	0.033	26%	0.256	C	S	.	.			trans	-148.9	151.8	-175	-176.6	171.6	-25.5	0	0	108.2	G167 S169 Y383 I457 E463	G167-Q459 PolarHBondContact O-NE2 3.29Å; G167-Q459 PolarHBondContact O-OE1 3.26Å; S169-Q459 VanDerWaalsContact N-OE1 3.15Å; S169-Q459 PolarHBondContact OG-OE1 2.85Å; Y383-Q459 VanDerWaalsContact CD1-O 3.27Å; Y383-Q459 WeakPolarHBondContact CD1-O 3.42Å; Y383-Q459 PolarHBondContact O-N 2.93Å; I457-Q459 PolarHBondContact O-N 3.25Å; Q459-E463 HydrophobicContact CG-CB 3.89Å; Q459-E463 HydrophobicContact CG-CG 4.14Å; Q459-E463 WeakPolarHBondContact CG-OE2 3.47Å; Q459-E463 PolarHBondContact NE2-O 3.02Å
460	G	90.8	Very high	92	Very high	26 Å²	26	52.4 Å²	52.4	27%	0.268	26%	0.256	S	S	.	.			trans	-71.6	152.2	173.4	0	0	0	0	0	112.8	Y462 E463	G460-Y462 PolarHBondContact O-N 3.32Å; G460-E463 PolarHBondContact N-OE2 3.49Å; G460-E463 PolarHBondContact O-N 2.67Å
461	P	88.5	Confident	92	Very high	54 Å²	54	47.1 Å²	47.1	35%	0.351	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-19.3	176.7	25.6	-34	0	0	0	114.6	R202 Y383	R202-P461 PolarHBondContact NH2-O 2.89Å; Y383-P461 HydrophobicContact CD1-CB 4.49Å; Y383-P461 VanDerWaalsContact CE1-CA 3.48Å; Y383-P461 HydrophobicContact CE1-CB 3.75Å
462	Y	88.8	Confident	91.9	Very high	155 Å²	155	46.7 Å²	46.7	61%	0.608	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-113.1	-0.2	177.5	-60.4	-78.3	0	0	0	112.9	G460	G460-Y462 PolarHBondContact O-N 3.32Å
463	E	90.5	Very high	91.7	Very high	78 Å²	78	49.1 Å²	49.1	36%	0.364	25%	0.246	S	C	.	.			trans	-76.8	127.9	177.6	-170.5	-177.6	169.3	0	0	108.5	Q199 Q203 Q459 G460 R465	Q199-E463 PolarHBondContact NE2-O 3.46Å; Q203-E463 VanDerWaalsContact NE2-C 3.33Å; Q203-E463 PolarHBondContact NE2-O 3.18Å; Q203-E463 PolarHBondContact OE1-O 3.27Å; Q459-E463 HydrophobicContact CG-CB 3.89Å; Q459-E463 HydrophobicContact CG-CG 4.14Å; Q459-E463 WeakPolarHBondContact CG-OE2 3.47Å; Q459-E463 PolarHBondContact NE2-O 3.02Å; G460-E463 PolarHBondContact N-OE2 3.49Å; G460-E463 PolarHBondContact O-N 2.67Å; E463-R465 HydrophobicContact CG-CG 4.29Å; E463-R465 IonicContact OE1-CZ 3.76Å; E463-R465 VanDerWaalsContact OE1-CZ 3.28Å; E463-R465 IonicContact OE1-NE 3.93Å; E463-R465 PolarHBondContact OE1-NE 3.36Å; E463-R465 IonicContact OE1-NH2 2.86Å; E463-R465 PolarHBondContact OE1-NH2 3.48Å; E463-R465 IonicContact OE2-NE 2.8Å; E463-R465 IonicContact OE2-NH2 3.84Å; E463-R465 PolarHBondContact OE2-NH2 2.92Å
464	N	90.4	Very high	91.6	Very high	83 Å²	83	49 Å²	49	44%	0.444	25%	0.245	S	C	.	.			trans	-114.1	105.4	176.5	-175.7	-6.9	0	0	0	108.2	G167 Q203	G167-N464 WeakPolarHBondContact CA-OD1 3.31Å; Q203-N464 HydrophobicContact CG-CB 4.09Å
465	R	91.9	Very high	91.6	Very high	24 Å²	24	43 Å²	43	9%	0.091	22%	0.219	C	C	.	.			trans	-93.1	135.6	178.1	-69.4	177.3	-176.4	165	10.1	109.7	Q165 G167 S169 N455 N458 E463 E469	Q165-R465 PolarHBondContact NE2-O 2.66Å; G167-R465 WeakPolarHBondContact CA-O 3.41Å; G167-R465 PolarHBondContact O-N 2.95Å; S169-R465 WeakPolarHBondContact OG-CD 3.43Å; S169-R465 PolarHBondContact OG-NH1 2.87Å; N455-R465 PolarHBondContact O-NH1 2.74Å; N455-R465 VanDerWaalsContact O-NH1 3.15Å; N458-R465 PolarHBondContact O-NH2 3.48Å; E463-R465 HydrophobicContact CG-CG 4.29Å; E463-R465 IonicContact OE1-CZ 3.76Å; E463-R465 VanDerWaalsContact OE1-CZ 3.28Å; E463-R465 IonicContact OE1-NE 3.93Å; E463-R465 PolarHBondContact OE1-NE 3.36Å; E463-R465 IonicContact OE1-NH2 2.86Å; E463-R465 PolarHBondContact OE1-NH2 3.48Å; E463-R465 IonicContact OE2-NE 2.8Å; E463-R465 IonicContact OE2-NH2 3.84Å; E463-R465 PolarHBondContact OE2-NH2 2.92Å; R465-E469 WeakPolarHBondContact CA-OE2 3.47Å
466	S	91	Very high	91.5	Very high	29 Å²	29	44.8 Å²	44.8	20%	0.203	22%	0.223	C	C	.	.			trans	-72.4	153.7	170.1	71.9	0	0	0	0	111.2	F468 E469 S470	S466-F468 PolarHBondContact O-N 2.87Å; S466-F468 VanDerWaalsContact O-N 3.13Å; S466-E469 PolarHBondContact N-OE2 2.82Å; S466-E469 PolarHBondContact O-N 2.78Å; S466-E469 VanDerWaalsContact O-N 3.08Å; S466-E469 VanDerWaalsContact OG-CG 3.29Å; S466-E469 WeakPolarHBondContact OG-CG 3.42Å; S466-E469 PolarHBondContact OG-N 3.4Å; S466-E469 PolarHBondContact OG-OE2 2.86Å; S466-S470 PolarHBondContact O-N 2.78Å; S466-S470 PolarHBondContact O-OG 3.29Å
467	V	89.7	Confident	91.4	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-54.9	-35.8	176.2	-175.6	0	0	0	0	111	M163 Q165 D172 V207 T405 S470 L471	M163-V467 HydrophobicContact CE-CG1 4.19Å; M163-V467 HydrophobicContact CE-CG2 3.63Å; M163-V467 HydrophobicContact SD-CG2 4.35Å; Q165-V467 HydrophobicContact CB-CG2 4.24Å; Q165-V467 HydrophobicContact CG-CG2 3.87Å; D172-V467 HydrophobicContact CB-CG2 4.24Å; V207-V467 HydrophobicContact CG2-CG2 4.12Å; T405-V467 HydrophobicContact CG2-CG1 4.29Å; V467-S470 PolarHBondContact O-N 2.85Å; V467-L471 HydrophobicContact CG1-CD1 4.25Å; V467-L471 HydrophobicContact CG1-CG 4.47Å; V467-L471 WeakPolarHBondContact O-CB 3.44Å; V467-L471 VanDerWaalsContact O-CG 3.25Å; V467-L471 WeakPolarHBondContact O-CG 3.02Å; V467-L471 PolarHBondContact O-N 3.32Å
468	F	91.1	Very high	91.3	Very high	78 Å²	78	45.2 Å²	45.2	34%	0.342	23%	0.225	S	C	.	.	H	α-helix	trans	-68	-42.8	178.8	-56.4	-65.7	0	0	0	112.6	R406 S466 L471 D472	R406-F468 HydrophobicContact CB-CE1 4.33Å; S466-F468 PolarHBondContact O-N 2.87Å; S466-F468 VanDerWaalsContact O-N 3.13Å; F468-L471 PolarHBondContact O-N 3.2Å; F468-D472 PolarHBondContact O-N 3.43Å
469	E	91.4	Very high	91.2	Very high	102 Å²	102	45.9 Å²	45.9	48%	0.477	22%	0.223	S	C	.	.	H	α-helix	trans	-62.5	-43.9	174.1	-72.8	162.4	-176.9	0	0	111.2	R465 S466 L471 D472 L473	R465-E469 WeakPolarHBondContact CA-OE2 3.47Å; S466-E469 PolarHBondContact N-OE2 2.82Å; S466-E469 PolarHBondContact O-N 2.78Å; S466-E469 VanDerWaalsContact O-N 3.08Å; S466-E469 VanDerWaalsContact OG-CG 3.29Å; S466-E469 WeakPolarHBondContact OG-CG 3.42Å; S466-E469 PolarHBondContact OG-N 3.4Å; S466-E469 PolarHBondContact OG-OE2 2.86Å; E469-L471 VanDerWaalsContact C-N 3.33Å; E469-L471 PolarHBondContact O-N 2.82Å; E469-D472 PolarHBondContact O-N 2.96Å; E469-L473 WeakPolarHBondContact O-CG 3.46Å; E469-L473 PolarHBondContact O-N 2.98Å
470	S	92.6	Very high	91	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-63.2	-38.2	177	-60.9	0	0	0	0	111.9	S169 V173 F456 S466 V467 L473 G474	S169-S470 PolarHBondContact OG-OG 3.21Å; V173-S470 VanDerWaalsContact CG2-CB 3.41Å; F456-S470 WeakPolarHBondContact CE2-O 3.34Å; S466-S470 PolarHBondContact O-N 2.78Å; S466-S470 PolarHBondContact O-OG 3.29Å; V467-S470 PolarHBondContact O-N 2.85Å; S470-L473 PolarHBondContact O-N 2.83Å; S470-G474 PolarHBondContact O-N 3.21Å
471	L	92.9	Very high	91	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-66.7	-39.2	173.9	-72.6	172.6	0	0	0	112.3	V173 R406 H409 V412 V467 F468 E469 G474 W475	V173-L471 HydrophobicContact CG1-CD2 3.93Å; V173-L471 HydrophobicContact CG2-CD2 4.15Å; V173-L471 HydrophobicContact CG2-CG 4.3Å; R406-L471 HydrophobicContact CB-CD1 3.92Å; H409-L471 HydrophobicContact CB-CD1 4.19Å; H409-L471 HydrophobicContact CB-CD2 4.17Å; V412-L471 HydrophobicContact CG1-CD2 4.4Å; V467-L471 HydrophobicContact CG1-CD1 4.25Å; V467-L471 HydrophobicContact CG1-CG 4.47Å; V467-L471 WeakPolarHBondContact O-CB 3.44Å; V467-L471 VanDerWaalsContact O-CG 3.25Å; V467-L471 WeakPolarHBondContact O-CG 3.02Å; V467-L471 PolarHBondContact O-N 3.32Å; F468-L471 PolarHBondContact O-N 3.2Å; E469-L471 VanDerWaalsContact C-N 3.33Å; E469-L471 PolarHBondContact O-N 2.82Å; L471-G474 WeakPolarHBondContact O-CA 3.44Å; L471-G474 PolarHBondContact O-N 2.87Å; L471-W475 VanDerWaalsContact O-CD1 3.3Å; L471-W475 PolarHBondContact O-N 3.26Å
472	D	92.2	Very high	91	Very high	73 Å²	73	46.4 Å²	46.4	39%	0.39	22%	0.22	S	C	.	.	H	α-helix	trans	-67.5	-36.5	176.5	-72.2	-17.7	0	0	0	111.9	R406 F468 E469 G474 W475 K476	R406-D472 IonicContact CZ-OD1 3.52Å; R406-D472 IonicContact NH1-OD1 2.68Å; R406-D472 PolarHBondContact NH1-OD1 3.26Å; R406-D472 IonicContact NH2-OD1 2.81Å; F468-D472 PolarHBondContact O-N 3.43Å; E469-D472 PolarHBondContact O-N 2.96Å; D472-G474 VanDerWaalsContact C-N 3.34Å; D472-W475 PolarHBondContact O-N 3.07Å; D472-K476 PolarHBondContact O-N 3.27Å
473	L	92.3	Very high	90.9	Very high	50 Å²	50	42.9 Å²	42.9	26%	0.262	21%	0.208	S	C	.	.	H	α-helix	trans	-61.8	-41.6	168.5	-72.2	174.2	0	0	0	111.5	F456 E469 S470 W475 K476 L477	F456-L473 HydrophobicContact CD2-CB 4.3Å; E469-L473 WeakPolarHBondContact O-CG 3.46Å; E469-L473 PolarHBondContact O-N 2.98Å; S470-L473 PolarHBondContact O-N 2.83Å; L473-W475 PolarHBondContact O-N 3.17Å; L473-K476 WeakPolarHBondContact O-CB 3.5Å; L473-K476 PolarHBondContact O-N 2.86Å; L473-L477 WeakPolarHBondContact O-CG 3.15Å; L473-L477 PolarHBondContact O-N 2.79Å; L473-L477 VanDerWaalsContact O-N 3.1Å
474	G	92.1	Very high	90.7	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-55.9	-48.5	172.9	0	0	0	0	0	112.1	S470 L471 D472 K476 L477 L478	S470-G474 PolarHBondContact O-N 3.21Å; L471-G474 WeakPolarHBondContact O-CA 3.44Å; L471-G474 PolarHBondContact O-N 2.87Å; D472-G474 VanDerWaalsContact C-N 3.34Å; G474-K476 PolarHBondContact O-N 3.47Å; G474-L477 PolarHBondContact O-N 2.99Å; G474-L478 WeakPolarHBondContact O-CG 3.1Å; G474-L478 PolarHBondContact O-N 3.05Å
475	W	92.2	Very high	90.6	Very high	1 Å²	1	44.8 Å²	44.8	0%	0.004	21%	0.214	C	C	.	.	H	α-helix	trans	-62.6	-40.1	175	-83.1	105.7	0	0	0	113.4	D408 V412 L471 D472 L473 L477 L478 R479 I489 V493 F497	D408-W475 HydrophobicContact CB-CZ2 4.39Å; D408-W475 PolarHBondContact OD2-NE1 2.76Å; V412-W475 HydrophobicContact CG2-CD2 4.26Å; V412-W475 VanDerWaalsContact CG2-CE2 3.43Å; V412-W475 HydrophobicContact CG2-CZ2 3.57Å; V412-W475 VanDerWaalsContact CG2-NE1 3.3Å; L471-W475 VanDerWaalsContact O-CD1 3.3Å; L471-W475 PolarHBondContact O-N 3.26Å; D472-W475 PolarHBondContact O-N 3.07Å; L473-W475 PolarHBondContact O-N 3.17Å; W475-L477 PolarHBondContact O-N 2.95Å; W475-L478 HydrophobicContact CE3-CD1 4.44Å; W475-L478 PolarHBondContact O-N 3.18Å; W475-R479 VanDerWaalsContact O-CG 3.26Å; W475-R479 WeakPolarHBondContact O-CG 3.48Å; W475-R479 PolarHBondContact O-N 3.37Å; W475-I489 HydrophobicContact CH2-CD1 3.97Å; W475-I489 HydrophobicContact CH2-CG2 4.1Å; W475-I489 HydrophobicContact CZ3-CD1 4.3Å; W475-V493 HydrophobicContact CH2-CG1 4.02Å; W475-V493 HydrophobicContact CZ2-CG1 3.66Å; W475-F497 HydrophobicContact CD2-CB 3.76Å; W475-F497 VanDerWaalsContact CE2-CB 3.42Å; W475-F497 AromaticContact CE2-CG 3.97Å; W475-F497 HydrophobicContact CE3-CB 4.15Å; W475-F497 HydrophobicContact CG-CB 4.34Å; W475-F497 HydrophobicContact CH2-CB 3.94Å; W475-F497 HydrophobicContact CZ2-CB 3.55Å; W475-F497 HydrophobicContact CZ2-CD2 4.21Å; W475-F497 HydrophobicContact CZ2-CG 4.08Å; W475-F497 HydrophobicContact CZ3-CB 4.23Å; W475-F497 AromaticContact NE1-CG 3.94Å
476	K	91.1	Very high	90.4	Very high	122 Å²	122	43.9 Å²	43.9	53%	0.53	21%	0.211	S	C	.	.	H	α-helix	trans	-57.8	-36.2	176	-172	176.8	-179.7	177.3	0	111.6	D472 L473 G474	D472-K476 PolarHBondContact O-N 3.27Å; L473-K476 WeakPolarHBondContact O-CB 3.5Å; L473-K476 PolarHBondContact O-N 2.86Å; G474-K476 PolarHBondContact O-N 3.47Å
477	L	92	Very high	90.4	Very high	8 Å²	8	51.3 Å²	51.3	4%	0.042	24%	0.24	C	C	.	.	H	α-helix	trans	-76.1	-39.5	175.6	-65.6	177.6	0	0	0	112.8	F448 K451 F452 F456 L473 G474 W475 R479 I480	F448-L477 HydrophobicContact CD2-CB 4.16Å; F448-L477 HydrophobicContact CE2-CB 3.83Å; K451-L477 HydrophobicContact CB-CD2 3.68Å; F452-L477 HydrophobicContact CB-CD1 4.18Å; F452-L477 HydrophobicContact CD2-CD1 3.76Å; F452-L477 HydrophobicContact CG-CD1 4.41Å; F456-L477 HydrophobicContact CB-CD1 3.61Å; F456-L477 HydrophobicContact CD2-CD1 4.32Å; F456-L477 HydrophobicContact CG-CD1 4.25Å; L473-L477 WeakPolarHBondContact O-CG 3.15Å; L473-L477 PolarHBondContact O-N 2.79Å; L473-L477 VanDerWaalsContact O-N 3.1Å; G474-L477 PolarHBondContact O-N 2.99Å; W475-L477 PolarHBondContact O-N 2.95Å; L477-R479 PolarHBondContact O-N 3.07Å; L477-I480 HydrophobicContact CD2-CD1 4.26Å; L477-I480 WeakPolarHBondContact O-CB 3.14Å; L477-I480 WeakPolarHBondContact O-CD1 3.37Å; L477-I480 VanDerWaalsContact O-CG1 3.27Å; L477-I480 WeakPolarHBondContact O-CG1 3.38Å; L477-I480 PolarHBondContact O-N 3.4Å
478	L	91.6	Very high	90.4	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-65.3	-25.7	177.6	-69	176.2	0	0	0	113	V412 Q415 L416 G474 W475 I480 F481 L486 I489	V412-L478 HydrophobicContact CG1-CD1 4.1Å; V412-L478 HydrophobicContact CG2-CD1 4.49Å; Q415-L478 HydrophobicContact CB-CD1 4.46Å; Q415-L478 HydrophobicContact CB-CD2 4.33Å; Q415-L478 HydrophobicContact CG-CD1 4.35Å; Q415-L478 HydrophobicContact CG-CD2 3.65Å; L416-L478 HydrophobicContact CD2-CD1 4.49Å; L416-L478 HydrophobicContact CD2-CD2 3.81Å; L416-L478 HydrophobicContact CD2-CG 3.89Å; L416-L478 HydrophobicContact CG-CD1 4.46Å; L416-L478 HydrophobicContact CG-CD2 4.29Å; L416-L478 HydrophobicContact CG-CG 4.36Å; G474-L478 WeakPolarHBondContact O-CG 3.1Å; G474-L478 PolarHBondContact O-N 3.05Å; W475-L478 HydrophobicContact CE3-CD1 4.44Å; W475-L478 PolarHBondContact O-N 3.18Å; L478-I480 PolarHBondContact O-N 3.21Å; L478-F481 PolarHBondContact O-N 3.29Å; L478-F481 VanDerWaalsContact O-N 3.09Å; L478-L486 HydrophobicContact CB-CD2 4.29Å; L478-L486 HydrophobicContact CD2-CD2 4.07Å; L478-I489 HydrophobicContact CD1-CD1 3.85Å
479	R	89.9	Confident	90.4	Very high	73 Å²	73	55.1 Å²	55.1	28%	0.275	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-12	175.9	-72.7	168.1	-164	178.8	-1.9	114.9	W475 L477 F481 F497 Y498 R500	W475-R479 VanDerWaalsContact O-CG 3.26Å; W475-R479 WeakPolarHBondContact O-CG 3.48Å; W475-R479 PolarHBondContact O-N 3.37Å; L477-R479 PolarHBondContact O-N 3.07Å; R479-F481 PolarHBondContact O-N 3.34Å; R479-F497 PolarHBondContact NH2-O 2.9Å; R479-Y498 HydrophobicContact CG-CD2 4.34Å; R479-Y498 HydrophobicContact CG-CE2 4.33Å; R479-R500 PolarHBondContact NH1-O 3.22Å; R479-R500 PolarHBondContact NH2-O 2.62Å
480	I	88.9	Confident	90.4	Very high	34 Å²	34	53.2 Å²	53.2	17%	0.174	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-31.4	170.2	-58.9	165	0	0	0	109.6	L444 K451 L477 L478	L444-I480 HydrophobicContact CD2-CG2 4.19Å; K451-I480 HydrophobicContact CB-CD1 4.34Å; K451-I480 HydrophobicContact CD-CD1 3.52Å; L477-I480 HydrophobicContact CD2-CD1 4.26Å; L477-I480 WeakPolarHBondContact O-CB 3.14Å; L477-I480 WeakPolarHBondContact O-CD1 3.37Å; L477-I480 VanDerWaalsContact O-CG1 3.27Å; L477-I480 WeakPolarHBondContact O-CG1 3.38Å; L477-I480 PolarHBondContact O-N 3.4Å; L478-I480 PolarHBondContact O-N 3.21Å
481	F	89.3	Confident	90.1	Very high	2 Å²	2	58.8 Å²	58.8	1%	0.009	28%	0.275	C	S	.	.	S	Bend	trans	-86.9	142.8	177.4	-61	-77	0	0	0	111.8	C419 L444 Y445 F448 L478 R479 M485 L486 Y498	C419-F481 HydrophobicContact CB-CE2 4.17Å; C419-F481 HydrophobicContact CB-CZ 4.39Å; L444-F481 HydrophobicContact CB-CD1 4.14Å; L444-F481 HydrophobicContact CB-CE1 3.87Å; Y445-F481 AromaticContact CD1-CE1 3.67Å; Y445-F481 HydrophobicContact CD1-CE1 3.67Å; Y445-F481 AromaticContact CD1-CZ 3.5Å; Y445-F481 HydrophobicContact CD1-CZ 3.5Å; Y445-F481 HydrophobicContact CD2-CE1 4.38Å; Y445-F481 AromaticContact CE1-CE1 3.73Å; Y445-F481 HydrophobicContact CE1-CE1 3.73Å; Y445-F481 AromaticContact CE1-CZ 3.73Å; Y445-F481 HydrophobicContact CE1-CZ 3.73Å; Y445-F481 HydrophobicContact CE2-CE1 4.44Å; Y445-F481 AromaticContact CG-CE1 4Å; Y445-F481 HydrophobicContact CG-CE1 4Å; Y445-F481 HydrophobicContact CG-CZ 4.17Å; F448-F481 HydrophobicContact CB-CE2 3.68Å; F448-F481 HydrophobicContact CB-CZ 3.52Å; F448-F481 HydrophobicContact CD1-CE2 4.32Å; F448-F481 HydrophobicContact CD1-CZ 4.38Å; F448-F481 HydrophobicContact CD2-CD2 4.48Å; F448-F481 AromaticContact CD2-CE2 3.54Å; F448-F481 HydrophobicContact CD2-CE2 3.54Å; F448-F481 HydrophobicContact CD2-CZ 4.25Å; F448-F481 HydrophobicContact CE2-CE2 4.25Å; F448-F481 AromaticContact CG-CE2 3.57Å; F448-F481 HydrophobicContact CG-CE2 3.57Å; F448-F481 AromaticContact CG-CZ 3.8Å; F448-F481 HydrophobicContact CG-CZ 3.8Å; L478-F481 PolarHBondContact O-N 3.29Å; L478-F481 VanDerWaalsContact O-N 3.09Å; R479-F481 PolarHBondContact O-N 3.34Å; F481-M485 HydrophobicContact CB-CB 4.25Å; F481-M485 HydrophobicContact CD1-CE 4.23Å; F481-M485 HydrophobicContact CD1-SD 4.02Å; F481-L486 HydrophobicContact CB-CD2 4.26Å; F481-Y498 PolarHBondContact O-OH 2.92Å
482	P	88.9	Confident	89.9	Confident	62 Å²	62	62.4 Å²	62.4	40%	0.403	31%	0.305	S	S	.	.			trans	-56.6	148.9	164.6	-22.7	32.7	0	0	0	111.6	E484 M485	P482-E484 PolarHBondContact O-N 2.88Å; P482-E484 VanDerWaalsContact O-N 3.07Å; P482-M485 HydrophobicContact CG-SD 4.36Å; P482-M485 PolarHBondContact O-N 3.47Å
483	K	86.4	Confident	89.6	Confident	81 Å²	81	59.6 Å²	59.6	35%	0.352	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-51.1	-36.2	179.7	-68.4	-174	173.8	-170.3	0	113.2	M485 L486 I494 Y498	K483-M485 PolarHBondContact O-N 3.1Å; K483-L486 PolarHBondContact O-N 2.85Å; K483-I494 HydrophobicContact CD-CG2 4.3Å; K483-I494 HydrophobicContact CG-CG2 4.3Å; K483-Y498 HydrophobicContact CD-CD1 4.06Å; K483-Y498 HydrophobicContact CD-CE1 4.09Å; K483-Y498 HydrophobicContact CD-CG 4.45Å; K483-Y498 VanDerWaalsContact CE-CE1 3.43Å; K483-Y498 HydrophobicContact CG-CD1 3.82Å; K483-Y498 HydrophobicContact CG-CD2 4.06Å; K483-Y498 HydrophobicContact CG-CE1 3.52Å; K483-Y498 HydrophobicContact CG-CE2 3.81Å; K483-Y498 HydrophobicContact CG-CG 4.05Å
484	E	87.1	Confident	89.4	Confident	180 Å²	180	57.3 Å²	57.3	84%	0.841	28%	0.279	S	S	*	.	G	3₁₀ helix	trans	-66.5	-22.6	-177.4	-60.2	176.9	-174	0	0	113.5	P482	P482-E484 PolarHBondContact O-N 2.88Å; P482-E484 VanDerWaalsContact O-N 3.07Å
485	M	87	Confident	89.1	Confident	22 Å²	22	61.6 Å²	61.6	11%	0.108	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-84.4	-14.3	179.9	-64.8	-170.8	75.9	0	0	113.1	E441 L444 Y445 F481 P482 K483 K487	E441-M485 HydrophobicContact CB-CE 3.86Å; E441-M485 HydrophobicContact CG-CE 3.8Å; E441-M485 HydrophobicContact CG-SD 4.27Å; L444-M485 HydrophobicContact CD1-SD 4.41Å; Y445-M485 HydrophobicContact CE2-CE 3.71Å; F481-M485 HydrophobicContact CB-CB 4.25Å; F481-M485 HydrophobicContact CD1-CE 4.23Å; F481-M485 HydrophobicContact CD1-SD 4.02Å; P482-M485 HydrophobicContact CG-SD 4.36Å; P482-M485 PolarHBondContact O-N 3.47Å; K483-M485 PolarHBondContact O-N 3.1Å; M485-K487 VanDerWaalsContact C-N 3.28Å; M485-K487 PolarHBondContact O-N 3.23Å
486	L	89.3	Confident	88.7	Confident	5 Å²	5	65.5 Å²	65.5	3%	0.026	32%	0.319	C	S	.	.			trans	-82.8	66.4	-177.9	-58.6	179.3	0	0	0	111.8	Q415 L478 F481 K483 R488 I494 Y498	Q415-L486 HydrophobicContact CG-CD2 3.88Å; L478-L486 HydrophobicContact CB-CD2 4.29Å; L478-L486 HydrophobicContact CD2-CD2 4.07Å; F481-L486 HydrophobicContact CB-CD2 4.26Å; K483-L486 PolarHBondContact O-N 2.85Å; L486-R488 VanDerWaalsContact C-N 3.34Å; L486-R488 PolarHBondContact O-N 2.85Å; L486-I494 HydrophobicContact CB-CD1 4.17Å; L486-Y498 HydrophobicContact CD1-CD2 4.05Å; L486-Y498 HydrophobicContact CD1-CE2 4.04Å
487	K	90.1	Very high	88.4	Confident	185 Å²	185	60 Å²	60	80%	0.804	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-20.5	-170.8	-63.2	176.1	-176	172.8	0	115.2	M485	M485-K487 VanDerWaalsContact C-N 3.28Å; M485-K487 PolarHBondContact O-N 3.23Å
488	R	90	Very high	87.8	Confident	148 Å²	148	62 Å²	62	56%	0.558	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.7	0.1	-176.4	-58.3	-171.1	169.7	-142.7	-1.6	114	Q415 L486	Q415-R488 HydrophobicContact CB-CB 4.49Å; L486-R488 VanDerWaalsContact C-N 3.34Å; L486-R488 PolarHBondContact O-N 2.85Å
489	I	90.6	Very high	86.9	Confident	9 Å²	9	65.9 Å²	65.9	5%	0.046	33%	0.33	C	S	.	.	S	Bend	trans	-106.7	130.3	-178.9	-53.6	-177.5	0	0	0	109.1	D411 Q415 W475 L478 V493 I494	D411-I489 HydrophobicContact CB-CG1 4.28Å; D411-I489 HydrophobicContact CB-CG2 4.17Å; Q415-I489 HydrophobicContact CB-CD1 3.8Å; Q415-I489 HydrophobicContact CB-CG1 3.77Å; Q415-I489 HydrophobicContact CG-CD1 3.86Å; Q415-I489 HydrophobicContact CG-CG1 4.04Å; W475-I489 HydrophobicContact CH2-CD1 3.97Å; W475-I489 HydrophobicContact CH2-CG2 4.1Å; W475-I489 HydrophobicContact CZ3-CD1 4.3Å; L478-I489 HydrophobicContact CD1-CD1 3.85Å; I489-V493 HydrophobicContact CG2-CB 3.88Å; I489-V493 HydrophobicContact CG2-CG1 3.85Å; I489-I494 HydrophobicContact CB-CD1 4.11Å; I489-I494 HydrophobicContact CB-CG1 3.9Å; I489-I494 HydrophobicContact CG2-CD1 4.34Å; I489-I494 HydrophobicContact CG2-CG1 3.61Å
490	P	91.1	Very high	85.8	Confident	62 Å²	62	68.3 Å²	68.3	40%	0.403	34%	0.339	S	S	.	.			trans	-61.3	144.6	174	-21.8	32.9	0	0	0	112.4	D411 A492 V493 I494	D411-P490 VanDerWaalsContact CG-CD 3.42Å; D411-P490 VanDerWaalsContact OD2-CD 3.24Å; D411-P490 WeakPolarHBondContact OD2-CD 3.41Å; P490-A492 VanDerWaalsContact C-N 3.26Å; P490-A492 PolarHBondContact O-N 2.88Å; P490-V493 HydrophobicContact CB-CG2 4.45Å; P490-V493 PolarHBondContact O-N 2.74Å; P490-I494 PolarHBondContact O-N 2.82Å; P490-I494 VanDerWaalsContact O-N 3.15Å
491	Q	87.3	Confident	83.7	Confident	118 Å²	118	74.9 Å²	74.9	55%	0.551	37%	0.369	S	S	*	.	H	α-helix	trans	-57.3	-38.3	-176.6	-154	67.6	21.6	0	0	113.2	V493 I494 D495	Q491-V493 PolarHBondContact O-N 2.79Å; Q491-I494 PolarHBondContact O-N 2.67Å; Q491-D495 PolarHBondContact O-N 3.2Å
492	A	87.4	Confident	81.4	Confident	75 Å²	75	77.1 Å²	77.1	62%	0.62	39%	0.392	S	S	*	.	H	α-helix	trans	-58.2	-36.5	177.4	0	0	0	0	0	112.9	P490	P490-A492 VanDerWaalsContact C-N 3.26Å; P490-A492 PolarHBondContact O-N 2.88Å
493	V	87.4	Confident	78.7	Confident	15 Å²	15	79.1 Å²	79.1	9%	0.091	41%	0.414	C	S	.	.	H	α-helix	trans	-77.6	-39.8	178.7	177.5	0	0	0	0	110.4	D408 W475 I489 P490 Q491 D495 E496 F497	D408-V493 HydrophobicContact CB-CG1 3.54Å; W475-V493 HydrophobicContact CH2-CG1 4.02Å; W475-V493 HydrophobicContact CZ2-CG1 3.66Å; I489-V493 HydrophobicContact CG2-CB 3.88Å; I489-V493 HydrophobicContact CG2-CG1 3.85Å; P490-V493 HydrophobicContact CB-CG2 4.45Å; P490-V493 PolarHBondContact O-N 2.74Å; Q491-V493 PolarHBondContact O-N 2.79Å; V493-D495 PolarHBondContact O-N 3.44Å; V493-E496 PolarHBondContact O-N 2.62Å; V493-F497 HydrophobicContact CG1-CD2 3.92Å; V493-F497 HydrophobicContact CG1-CE2 4.4Å; V493-F497 WeakPolarHBondContact O-CD2 3.41Å; V493-F497 PolarHBondContact O-N 2.84Å; V493-F497 VanDerWaalsContact O-N 3.13Å
494	I	86.9	Confident	76.2	Confident	2 Å²	2	82.3 Å²	82.3	1%	0.01	44%	0.435	C	S	.	.	H	α-helix	trans	-59.4	-47.9	176.3	-63.8	175.5	0	0	0	110.6	K483 L486 I489 P490 Q491 E496 F497 Y498	K483-I494 HydrophobicContact CD-CG2 4.3Å; K483-I494 HydrophobicContact CG-CG2 4.3Å; L486-I494 HydrophobicContact CB-CD1 4.17Å; I489-I494 HydrophobicContact CB-CD1 4.11Å; I489-I494 HydrophobicContact CB-CG1 3.9Å; I489-I494 HydrophobicContact CG2-CD1 4.34Å; I489-I494 HydrophobicContact CG2-CG1 3.61Å; P490-I494 PolarHBondContact O-N 2.82Å; P490-I494 VanDerWaalsContact O-N 3.15Å; Q491-I494 PolarHBondContact O-N 2.67Å; I494-E496 PolarHBondContact O-N 2.6Å; I494-F497 PolarHBondContact O-N 2.89Å; I494-Y498 HydrophobicContact CG2-CD2 4.48Å; I494-Y498 HydrophobicContact CG2-CG 4.42Å; I494-Y498 WeakPolarHBondContact O-CB 3.3Å; I494-Y498 PolarHBondContact O-N 3.44Å
495	D	85.4	Confident	73.6	Confident	89 Å²	89	82.3 Å²	82.3	48%	0.476	43%	0.434	S	S	.	.	H	α-helix	trans	-65.1	-29.9	-174.6	-69.2	-28.1	0	0	0	112.8	Q491 V493	Q491-D495 PolarHBondContact O-N 3.2Å; V493-D495 PolarHBondContact O-N 3.44Å
496	E	85.2	Confident	70.9	Confident	83 Å²	83	88.6 Å²	88.6	39%	0.388	47%	0.468	S	S	.	.	H	α-helix	trans	-81	-41.7	179.2	-175	176.7	171.8	0	0	113.7	K407 V493 I494	K407-E496 WeakPolarHBondContact CE-OE1 3.41Å; K407-E496 WeakPolarHBondContact CE-OE2 3.44Å; K407-E496 IonicContact NZ-OE1 3.11Å; K407-E496 PolarHBondContact NZ-OE1 3.02Å; K407-E496 IonicContact NZ-OE2 2.74Å; K407-E496 PolarHBondContact NZ-OE2 3.41Å; V493-E496 PolarHBondContact O-N 2.62Å; I494-E496 PolarHBondContact O-N 2.6Å
497	F	84.3	Confident	68.2	Low	6 Å²	6	95.7 Å²	95.7	3%	0.026	51%	0.506	C	S	.	.	H	α-helix	trans	-103.7	-21.4	-170.1	-69.3	-80.7	0	0	0	114.4	D408 W475 R479 V493 I494	D408-F497 HydrophobicContact CB-CD2 4.37Å; D408-F497 HydrophobicContact CB-CE2 4.13Å; W475-F497 HydrophobicContact CD2-CB 3.76Å; W475-F497 VanDerWaalsContact CE2-CB 3.42Å; W475-F497 AromaticContact CE2-CG 3.97Å; W475-F497 HydrophobicContact CE3-CB 4.15Å; W475-F497 HydrophobicContact CG-CB 4.34Å; W475-F497 HydrophobicContact CH2-CB 3.94Å; W475-F497 HydrophobicContact CZ2-CB 3.55Å; W475-F497 HydrophobicContact CZ2-CD2 4.21Å; W475-F497 HydrophobicContact CZ2-CG 4.08Å; W475-F497 HydrophobicContact CZ3-CB 4.23Å; W475-F497 AromaticContact NE1-CG 3.94Å; R479-F497 PolarHBondContact NH2-O 2.9Å; V493-F497 HydrophobicContact CG1-CD2 3.92Å; V493-F497 HydrophobicContact CG1-CE2 4.4Å; V493-F497 WeakPolarHBondContact O-CD2 3.41Å; V493-F497 PolarHBondContact O-N 2.84Å; V493-F497 VanDerWaalsContact O-N 3.13Å; I494-F497 PolarHBondContact O-N 2.89Å
498	Y	80.4	Confident	65.2	Low	51 Å²	51	90.9 Å²	90.9	20%	0.2	50%	0.5	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-37.4	179.8	-165.9	-87.1	0	0	0	111.9	R479 F481 K483 L486 I494 R500	R479-Y498 HydrophobicContact CG-CD2 4.34Å; R479-Y498 HydrophobicContact CG-CE2 4.33Å; F481-Y498 PolarHBondContact O-OH 2.92Å; K483-Y498 HydrophobicContact CD-CD1 4.06Å; K483-Y498 HydrophobicContact CD-CE1 4.09Å; K483-Y498 HydrophobicContact CD-CG 4.45Å; K483-Y498 VanDerWaalsContact CE-CE1 3.43Å; K483-Y498 HydrophobicContact CG-CD1 3.82Å; K483-Y498 HydrophobicContact CG-CD2 4.06Å; K483-Y498 HydrophobicContact CG-CE1 3.52Å; K483-Y498 HydrophobicContact CG-CE2 3.81Å; K483-Y498 HydrophobicContact CG-CG 4.05Å; L486-Y498 HydrophobicContact CD1-CD2 4.05Å; L486-Y498 HydrophobicContact CD1-CE2 4.04Å; I494-Y498 HydrophobicContact CG2-CD2 4.48Å; I494-Y498 HydrophobicContact CG2-CG 4.42Å; I494-Y498 WeakPolarHBondContact O-CB 3.3Å; I494-Y498 PolarHBondContact O-N 3.44Å; Y498-R500 PolarHBondContact O-N 2.97Å
499	S	71.9	Confident	62.6	Low	81 Å²	81	89 Å²	89	57%	0.566	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-5	-175.4	-55.3	0	0	0	0	114.9	E501	S499-E501 VanDerWaalsContact C-N 3.34Å; S499-E501 PolarHBondContact O-N 3.25Å
500	R	65.9	Low	59.7	Low	125 Å²	125	96.8 Å²	96.8	47%	0.472	55%	0.549	S	S	.	.			trans	-68.8	90.3	175.7	-76.7	-174.2	-179.4	-170.4	-1.2	109.2	R479 Y498 G502	R479-R500 PolarHBondContact NH1-O 3.22Å; R479-R500 PolarHBondContact NH2-O 2.62Å; Y498-R500 PolarHBondContact O-N 2.97Å; R500-G502 PolarHBondContact O-N 3.05Å
501	E	45.3	Very low	57.1	Low	172 Å²	172	99.8 Å²	99.8	80%	0.804	57%	0.566	S	S	*	*			trans	-49.7	114.1	162.2	-79.8	-178.5	158.6	0	0	107.2	S499 A503	S499-E501 VanDerWaalsContact C-N 3.34Å; S499-E501 PolarHBondContact O-N 3.25Å; E501-A503 PolarHBondContact O-N 3.39Å
502	G	40.8	Very low	54.3	Low	48 Å²	48	98.4 Å²	98.4	50%	0.495	58%	0.575	S	S	.	*			trans	-57.5	129.7	171.3	0	0	0	0	0	106.4	R500 L504	R500-G502 PolarHBondContact O-N 3.05Å; G502-L504 PolarHBondContact O-N 3.1Å
503	A	31.9	Very low	51.6	Low	104 Å²	104	106.9 Å²	106.9	86%	0.86	61%	0.609	S	S	*	*			trans	-41.6	108.6	173.3	0	0	0	0	0	109.2	E501 Q505	E501-A503 PolarHBondContact O-N 3.39Å; A503-Q505 PolarHBondContact O-N 3.21Å; A503-Q505 VanDerWaalsContact O-N 3.08Å
504	L	35.5	Very low	49.8	Very low	149 Å²	149	111.5 Å²	111.5	78%	0.78	64%	0.635	S	S	*	*			trans	-74	91	178.5	-87.7	151.8	0	0	0	108	G502	G502-L504 PolarHBondContact O-N 3.1Å
505	Q	31.7	Very low	47.9	Very low	179 Å²	179	117.2 Å²	117.2	84%	0.836	67%	0.668	S	S	*	*			trans	-165.5	138.5	153	-104.9	146.2	14.4	0	0	109.1	A503	A503-Q505 PolarHBondContact O-N 3.21Å; A503-Q505 VanDerWaalsContact O-N 3.08Å
506	D	30.8	Very low	45.8	Very low	154 Å²	154	118.8 Å²	118.8	82%	0.824	68%	0.678	S	S	*	*	S	Bend	trans	93.3	41.2	171.3	-54	-15.4	0	0	0	119.9
507	L	32.5	Very low	43.5	Very low	154 Å²	154	120.9 Å²	120.9	81%	0.806	70%	0.695	S	S	*	*			trans	-132.1	90.1	143.9	-83.4	163.3	0	0	0	108.1
508	A	27.2	Very low	40.9	Very low	84 Å²	84	128.1 Å²	128.1	69%	0.694	74%	0.737	S	S	*	*			trans	-59.3	143.8	167.6	0	0	0	0	0	109.7	D510	A508-D510 PolarHBondContact O-N 3.28Å
509	P	34.2	Very low	38.3	Very low	109 Å²	109	133.2 Å²	133.2	71%	0.708	77%	0.773	S	S	*	*			trans	-74.3	112.9	170.4	29.4	-28.9	0	0	0	108.4	T511	P509-T511 PolarHBondContact O-N 3.18Å
510	D	31.7	Very low	35.9	Very low	173 Å²	173	136.9 Å²	136.9	93%	0.925	79%	0.788	S	S	*	*			trans	-68.8	82.3	162.8	-91.3	-19.1	0	0	0	108.7	A508	A508-D510 PolarHBondContact O-N 3.28Å
511	T	35.3	Very low	33.6	Very low	124 Å²	124	137.8 Å²	137.8	76%	0.761	81%	0.812	S	S	*	*			trans	-112.1	99.4	153.4	42.3	0	0	0	0	107.3	P509	P509-T511 PolarHBondContact O-N 3.18Å
512	A	29.1	Very low	32.6	Very low	90 Å²	90	135 Å²	135	74%	0.744	81%	0.813	S	S	*	*			trans	179.1	120.1	140.8	0	0	0	0	0	112.2
513	L	30.9	Very low	31.9	Very low	252 Å²	252	142.9 Å²	142.9	100%	1.319	84%	0.842	S	S	*	*			trans	68.6	0	151.6	-70.2	162.1	0	0	0	120

Retrieved 513 of 513 residues in 2307.5 ms (Link to these results)

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