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Cystathionine beta-synthase

Hydro-lyase catalyzing the first step of the transsulfuration pathway, where the hydroxyl group of L-serine is displaced by L-homocysteine in a beta-replacement reaction to form L-cystathionine, the precursor of L-cysteine. This catabolic route allows the elimination of L-methionine and the toxic metabolite L-homocysteine. Also involved in the production of hydrogen sulfide, a gasotransmitter with signaling and cytoprotective effects on neurons.

AlphaFold DB , UniProt , Accession A0A087Y704, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 494 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	K	45.6	Very low	41.2	Very low	238 Å²	238	115.2 Å²	115.2	100%	1.035	61%	0.612	S	S	*	*				0	-8.1	0	-80.9	-173.3	176	-178	0	114.3
2	C	39.2	Very low	41.5	Very low	104 Å²	104	117.9 Å²	117.9	70%	0.703	62%	0.615	S	S	*	*			trans	-90.1	-12.9	175.3	-78.4	0	0	0	0	115.9	T5	C2-T5 PolarHBondContact O-OG1 3.21Å
3	H	37.4	Very low	41.6	Very low	166 Å²	166	119.2 Å²	119.2	77%	0.769	62%	0.616	S	S	*	*	S	Bend	trans	-88.4	-21.9	-177.2	-82.3	-41.4	0	0	0	114.9
4	Q	37.8	Very low	41.3	Very low	146 Å²	146	120.1 Å²	120.1	68%	0.682	62%	0.616	S	S	*	*	H	α-helix	trans	-78.8	-25	177	-84.8	172.9	-43.7	0	0	113.6	E8	Q4-E8 PolarHBondContact O-N 2.82Å
5	T	42.9	Very low	41.1	Very low	74 Å²	74	121.9 Å²	121.9	45%	0.454	62%	0.618	S	S	.	*	H	α-helix	trans	-79.7	-22.9	-178.4	38.7	0	0	0	0	114	C2 N9	C2-T5 PolarHBondContact O-OG1 3.21Å; T5-N9 WeakPolarHBondContact O-CB 3.25Å; T5-N9 VanDerWaalsContact O-CG 3.32Å; T5-N9 PolarHBondContact O-N 3Å; T5-N9 PolarHBondContact O-ND2 3Å
6	C	41.3	Very low	41.2	Very low	88 Å²	88	117.6 Å²	117.6	60%	0.595	61%	0.607	S	S	*	*	H	α-helix	trans	-81.3	-35.4	177.1	-66.8	0	0	0	0	112.2	G10	C6-G10 PolarHBondContact O-N 3.16Å
7	E	43.4	Very low	40.9	Very low	149 Å²	149	119.2 Å²	119.2	70%	0.696	61%	0.61	S	S	*	*	H	α-helix	trans	-71.5	-36.1	176.8	-70.5	178.2	165.3	0	0	112	A11	E7-A11 VanDerWaalsContact O-CB 3.29Å; E7-A11 WeakPolarHBondContact O-CB 3.42Å; E7-A11 PolarHBondContact O-N 2.97Å
8	E	41.2	Very low	40.5	Very low	130 Å²	130	119.9 Å²	119.9	61%	0.607	61%	0.611	S	S	*	*	H	α-helix	trans	-71.2	-29.7	175	-77.5	-175.5	166.1	0	0	113.7	Q4 K12	Q4-E8 PolarHBondContact O-N 2.82Å; E8-K12 WeakPolarHBondContact O-CG 3.11Å; E8-K12 PolarHBondContact O-N 2.58Å
9	N	43.3	Very low	40.7	Very low	96 Å²	96	118.3 Å²	118.3	51%	0.513	61%	0.608	S	S	.	*	H	α-helix	trans	-78.6	-40.6	174.3	-75.7	-14	0	0	0	111.3	T5 A11 K12 E13	T5-N9 WeakPolarHBondContact O-CB 3.25Å; T5-N9 VanDerWaalsContact O-CG 3.32Å; T5-N9 PolarHBondContact O-N 3Å; T5-N9 PolarHBondContact O-ND2 3Å; N9-A11 PolarHBondContact O-N 3.34Å; N9-K12 PolarHBondContact O-N 3.15Å; N9-E13 PolarHBondContact O-N 2.81Å
10	G	39.2	Very low	40.6	Very low	27 Å²	27	115.9 Å²	115.9	28%	0.278	61%	0.606	S	S	.	*	H	α-helix	trans	-61.9	-41.1	173.6	0	0	0	0	0	112.6	C6 K12 E13 E14	C6-G10 PolarHBondContact O-N 3.16Å; G10-K12 VanDerWaalsContact C-N 3.3Å; G10-K12 PolarHBondContact O-N 3.09Å; G10-E13 PolarHBondContact O-N 3.4Å; G10-E14 WeakPolarHBondContact O-CB 3.21Å; G10-E14 WeakPolarHBondContact O-CG 3.01Å; G10-E14 PolarHBondContact O-N 3.21Å
11	A	42.3	Very low	40.5	Very low	49 Å²	49	114.4 Å²	114.4	41%	0.405	61%	0.611	S	S	.	*	H	α-helix	trans	-71.8	-20.5	176.2	0	0	0	0	0	114	E7 N9 K15	E7-A11 VanDerWaalsContact O-CB 3.29Å; E7-A11 WeakPolarHBondContact O-CB 3.42Å; E7-A11 PolarHBondContact O-N 2.97Å; N9-A11 PolarHBondContact O-N 3.34Å; A11-K15 VanDerWaalsContact O-CB 3.3Å; A11-K15 WeakPolarHBondContact O-CB 3.31Å; A11-K15 WeakPolarHBondContact O-CG 3.44Å; A11-K15 PolarHBondContact O-N 3.42Å
12	K	44.1	Very low	40.6	Very low	148 Å²	148	110.7 Å²	110.7	64%	0.643	60%	0.597	S	S	*	*	H	α-helix	trans	-84.3	-36.7	172	-81.5	178.8	-179.4	171.9	0	112	E8 N9 G10 A16	E8-K12 WeakPolarHBondContact O-CG 3.11Å; E8-K12 PolarHBondContact O-N 2.58Å; N9-K12 PolarHBondContact O-N 3.15Å; G10-K12 VanDerWaalsContact C-N 3.3Å; G10-K12 PolarHBondContact O-N 3.09Å; K12-A16 VanDerWaalsContact O-CB 3.23Å; K12-A16 WeakPolarHBondContact O-CB 3.37Å; K12-A16 PolarHBondContact O-N 3.49Å
13	E	42.6	Very low	41.3	Very low	135 Å²	135	109.1 Å²	109.1	63%	0.631	58%	0.58	S	S	*	*	H	α-helix	trans	-69.8	-42.5	173	-78.5	177	160.3	0	0	111.3	N9 G10 A16 E17	N9-E13 PolarHBondContact O-N 2.81Å; G10-E13 PolarHBondContact O-N 3.4Å; E13-A16 PolarHBondContact O-N 2.83Å; E13-E17 WeakPolarHBondContact O-CB 3.42Å; E13-E17 PolarHBondContact O-N 3.37Å
14	E	38.2	Very low	43	Very low	132 Å²	132	109.9 Å²	109.9	62%	0.617	58%	0.581	S	S	*	*	H	α-helix	trans	-64.9	-38.8	172.7	-80.2	-178.9	154.2	0	0	112	G10 E17 E18	G10-E14 WeakPolarHBondContact O-CB 3.21Å; G10-E14 WeakPolarHBondContact O-CG 3.01Å; G10-E14 PolarHBondContact O-N 3.21Å; E14-E17 PolarHBondContact O-N 2.71Å; E14-E18 VanDerWaalsContact O-CB 3.25Å; E14-E18 WeakPolarHBondContact O-CB 3.42Å; E14-E18 WeakPolarHBondContact O-CG 3.36Å; E14-E18 PolarHBondContact O-N 3.33Å
15	K	38.7	Very low	45.2	Very low	147 Å²	147	105.3 Å²	105.3	64%	0.639	56%	0.558	S	S	*	*	H	α-helix	trans	-67.1	-35.9	171.6	-91.1	180	174.6	176.6	0	112.7	A11 T19	A11-K15 VanDerWaalsContact O-CB 3.3Å; A11-K15 WeakPolarHBondContact O-CB 3.31Å; A11-K15 WeakPolarHBondContact O-CG 3.44Å; A11-K15 PolarHBondContact O-N 3.42Å; K15-T19 WeakPolarHBondContact O-CB 3.49Å; K15-T19 WeakPolarHBondContact O-CG2 3.36Å; K15-T19 PolarHBondContact O-N 3.08Å; K15-T19 PolarHBondContact O-OG1 3.13Å
16	A	42.8	Very low	47.5	Very low	53 Å²	53	105 Å²	105	44%	0.438	55%	0.553	S	S	.	*	H	α-helix	trans	-68.8	-41.6	176.4	0	0	0	0	0	111.2	K12 E13 T19 A20	K12-A16 VanDerWaalsContact O-CB 3.23Å; K12-A16 WeakPolarHBondContact O-CB 3.37Å; K12-A16 PolarHBondContact O-N 3.49Å; E13-A16 PolarHBondContact O-N 2.83Å; A16-T19 VanDerWaalsContact CA-OG1 3.31Å; A16-T19 WeakPolarHBondContact CA-OG1 3.36Å; A16-T19 PolarHBondContact O-N 3.25Å; A16-T19 PolarHBondContact O-OG1 2.99Å; A16-A20 WeakPolarHBondContact O-CB 3.47Å; A16-A20 PolarHBondContact O-N 3.27Å
17	E	35.5	Very low	50	Low	144 Å²	144	104.9 Å²	104.9	67%	0.673	54%	0.54	S	S	*	.	H	α-helix	trans	-69.3	-37.9	173.6	-77.5	-172.3	149.5	0	0	112.4	E13 E14 A20 A21	E13-E17 WeakPolarHBondContact O-CB 3.42Å; E13-E17 PolarHBondContact O-N 3.37Å; E14-E17 PolarHBondContact O-N 2.71Å; E17-A20 PolarHBondContact O-N 3.08Å; E17-A21 WeakPolarHBondContact O-CB 3.08Å; E17-A21 PolarHBondContact O-N 2.73Å
18	E	33.5	Very low	52.5	Low	132 Å²	132	97.8 Å²	97.8	62%	0.617	51%	0.507	S	S	*	.	H	α-helix	trans	-66.3	-37.5	171.6	-84.6	-171.4	143.4	0	0	112	E14 A21 Q22	E14-E18 VanDerWaalsContact O-CB 3.25Å; E14-E18 WeakPolarHBondContact O-CB 3.42Å; E14-E18 WeakPolarHBondContact O-CG 3.36Å; E14-E18 PolarHBondContact O-N 3.33Å; E18-A21 PolarHBondContact O-N 2.67Å; E18-Q22 PolarHBondContact O-N 2.93Å
19	T	43.8	Very low	55	Low	90 Å²	90	93.7 Å²	93.7	55%	0.552	49%	0.489	S	S	*	.	H	α-helix	trans	-70.1	-32.8	171.9	49.3	0	0	0	0	112.7	K15 A16 A21 Q22	K15-T19 WeakPolarHBondContact O-CB 3.49Å; K15-T19 WeakPolarHBondContact O-CG2 3.36Å; K15-T19 PolarHBondContact O-N 3.08Å; K15-T19 PolarHBondContact O-OG1 3.13Å; A16-T19 VanDerWaalsContact CA-OG1 3.31Å; A16-T19 WeakPolarHBondContact CA-OG1 3.36Å; A16-T19 PolarHBondContact O-N 3.25Å; A16-T19 PolarHBondContact O-OG1 2.99Å; T19-A21 VanDerWaalsContact C-N 3.33Å; T19-Q22 PolarHBondContact O-N 3.49Å
20	A	40.1	Very low	57.5	Low	70 Å²	70	92.4 Å²	92.4	58%	0.579	48%	0.481	S	S	*	.	H	α-helix	trans	-69	-33.1	173.1	0	0	0	0	0	111.9	A16 E17 Q22 M23	A16-A20 WeakPolarHBondContact O-CB 3.47Å; A16-A20 PolarHBondContact O-N 3.27Å; E17-A20 PolarHBondContact O-N 3.08Å; A20-Q22 PolarHBondContact O-N 2.85Å; A20-M23 PolarHBondContact O-N 3.4Å
21	A	38.7	Very low	60.2	Low	85 Å²	85	96.6 Å²	96.6	70%	0.702	50%	0.504	S	S	*	.	H	α-helix	trans	-68.3	-15.8	174.8	0	0	0	0	0	113.7	E17 E18 T19	E17-A21 WeakPolarHBondContact O-CB 3.08Å; E17-A21 PolarHBondContact O-N 2.73Å; E18-A21 PolarHBondContact O-N 2.67Å; T19-A21 VanDerWaalsContact C-N 3.33Å
22	Q	45.9	Very low	62.9	Low	160 Å²	160	97.4 Å²	97.4	75%	0.748	51%	0.506	S	S	*	.	H	α-helix	trans	-94	-13.2	179.1	-73.2	-177.3	0.3	0	0	114.9	E18 T19 A20 K24	E18-Q22 PolarHBondContact O-N 2.93Å; T19-Q22 PolarHBondContact O-N 3.49Å; A20-Q22 PolarHBondContact O-N 2.85Å; Q22-K24 PolarHBondContact O-N 3.44Å; Q22-K24 VanDerWaalsContact O-N 3.17Å
23	M	54.8	Low	65.4	Low	71 Å²	71	101 Å²	101	35%	0.35	52%	0.516	S	S	.	.			trans	-86	83.6	171.3	-81.6	-167	-163.1	0	0	111.1	A20 W25 R191 S194	A20-M23 PolarHBondContact O-N 3.4Å; M23-W25 PolarHBondContact O-N 2.94Å; M23-R191 HydrophobicContact CE-CB 3.7Å; M23-R191 HydrophobicContact CE-CG 3.57Å; M23-R191 HydrophobicContact SD-CB 4.32Å; M23-S194 WeakPolarHBondContact CE-OG 3.07Å
24	K	72.3	Confident	68	Low	182 Å²	182	96.9 Å²	96.9	79%	0.791	50%	0.501	S	S	*	.			trans	-74.9	65.8	168.9	-157	175	-172.8	175.5	0	110.7	Q22 W190	Q22-K24 PolarHBondContact O-N 3.44Å; Q22-K24 VanDerWaalsContact O-N 3.17Å; K24-W190 VanDerWaalsContact O-CZ3 3.28Å; K24-W190 WeakPolarHBondContact O-CZ3 3.35Å
25	W	85.6	Confident	70.8	Confident	50 Å²	50	94.9 Å²	94.9	19%	0.189	50%	0.502	C	S	.	.			trans	-63.1	131.4	171.3	170.6	51.7	0	0	0	109.7	M23 R27 D180 R187 W190	M23-W25 PolarHBondContact O-N 2.94Å; W25-R27 HydrophobicContact CE3-CG 4.43Å; W25-R27 HydrophobicContact CH2-CG 3.79Å; W25-R27 HydrophobicContact CZ2-CG 4.06Å; W25-R27 HydrophobicContact CZ3-CG 3.98Å; W25-D180 HydrophobicContact CH2-CB 3.69Å; W25-D180 HydrophobicContact CZ2-CB 4.48Å; W25-R187 VanDerWaalsContact CD2-CD 3.42Å; W25-R187 HydrophobicContact CD2-CG 4.45Å; W25-R187 HydrophobicContact CH2-CG 4.47Å; W25-R187 HydrophobicContact CZ2-CG 4.1Å; W25-W190 AromaticContact CD1-CD1 3.43Å; W25-W190 VanDerWaalsContact CD1-CD1 3.43Å; W25-W190 AromaticContact CD1-CD2 3.84Å; W25-W190 AromaticContact CD1-CE2 3.96Å; W25-W190 AromaticContact CD1-CG 3.5Å; W25-W190 AromaticContact CD1-NE1 3.69Å; W25-W190 HydrophobicContact CG-CG 4.42Å; W25-W190 AromaticContact NE1-CD1 3.87Å
26	I	91.5	Very high	73.5	Confident	66 Å²	66	90.6 Å²	90.6	34%	0.338	48%	0.482	S	S	.	.			trans	-108.1	124.4	176.9	-49.6	179.3	0	0	0	107.8	L30 W190 R206	I26-L30 HydrophobicContact CG2-CD1 3.87Å; I26-W190 HydrophobicContact CB-CH2 4.07Å; I26-W190 HydrophobicContact CB-CZ2 4.04Å; I26-W190 HydrophobicContact CD1-CH2 3.9Å; I26-W190 HydrophobicContact CG1-CH2 3.72Å; I26-W190 HydrophobicContact CG1-CZ2 4.23Å; I26-W190 HydrophobicContact CG1-CZ3 4.35Å; I26-R206 VanDerWaalsContact CG2-CZ 3.49Å; I26-R206 VanDerWaalsContact CG2-NE 3.31Å
27	R	93.8	Very high	75.8	Confident	87 Å²	87	93.9 Å²	93.9	33%	0.328	48%	0.483	S	S	.	.			trans	-64.5	140.6	-178.8	-64.3	179.8	59.4	120.7	-7.7	111.4	W25 D29 L30 F179 D180 R206	W25-R27 HydrophobicContact CE3-CG 4.43Å; W25-R27 HydrophobicContact CH2-CG 3.79Å; W25-R27 HydrophobicContact CZ2-CG 4.06Å; W25-R27 HydrophobicContact CZ3-CG 3.98Å; R27-D29 WeakPolarHBondContact CB-OD1 3.31Å; R27-D29 IonicContact CZ-OD1 2.66Å; R27-D29 IonicContact CZ-OD2 2.66Å; R27-D29 IonicContact NE-OD1 2.69Å; R27-D29 PolarHBondContact NE-OD1 2.88Å; R27-D29 IonicContact NE-OD2 2.84Å; R27-D29 IonicContact NH2-OD1 2.9Å; R27-D29 IonicContact NH2-OD2 3.4Å; R27-D29 PolarHBondContact NH2-OD2 3.37Å; R27-D29 PolarHBondContact O-N 3.5Å; R27-L30 HydrophobicContact CB-CD2 4.16Å; R27-L30 HydrophobicContact CB-CG 4.13Å; R27-F179 VanDerWaalsContact NH2-CZ 3.31Å; R27-D180 IonicContact NH1-OD2 3.69Å; R27-R206 WeakPolarHBondContact O-CD 3.48Å; R27-R206 PolarHBondContact O-NH1 2.94Å
28	P	94.7	Very high	78.3	Confident	0 Å²	0	91.1 Å²	91.1	0%	0	48%	0.477	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-10.4	-179.4	34.6	-39.6	0	0	0	113.3	F179 I186 Y205 F289 P291 T292	P28-F179 HydrophobicContact CG-CD2 3.93Å; P28-F179 HydrophobicContact CG-CE2 4.21Å; P28-I186 HydrophobicContact CG-CD1 4.18Å; P28-Y205 HydrophobicContact CB-CD2 4.15Å; P28-Y205 HydrophobicContact CB-CG 3.99Å; P28-F289 HydrophobicContact CB-CD2 4.32Å; P28-F289 HydrophobicContact CB-CE2 3.63Å; P28-F289 HydrophobicContact CB-CZ 3.99Å; P28-F289 HydrophobicContact CG-CD2 3.98Å; P28-F289 HydrophobicContact CG-CE1 4.32Å; P28-F289 HydrophobicContact CG-CE2 3.61Å; P28-F289 HydrophobicContact CG-CG 4.5Å; P28-F289 HydrophobicContact CG-CZ 3.8Å; P28-P291 WeakPolarHBondContact O-CA 3.48Å; P28-T292 PolarHBondContact O-N 3.31Å; P28-T292 PolarHBondContact O-OG1 2.87Å
29	D	94.8	Very high	80.9	Confident	44 Å²	44	88.3 Å²	88.3	24%	0.235	48%	0.484	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.9	10.1	-171.6	70.4	-23.8	0	0	0	114.2	R27 F289 I290	R27-D29 WeakPolarHBondContact CB-OD1 3.31Å; R27-D29 IonicContact CZ-OD1 2.66Å; R27-D29 IonicContact CZ-OD2 2.66Å; R27-D29 IonicContact NE-OD1 2.69Å; R27-D29 PolarHBondContact NE-OD1 2.88Å; R27-D29 IonicContact NE-OD2 2.84Å; R27-D29 IonicContact NH2-OD1 2.9Å; R27-D29 IonicContact NH2-OD2 3.4Å; R27-D29 PolarHBondContact NH2-OD2 3.37Å; R27-D29 PolarHBondContact O-N 3.5Å; D29-F289 HydrophobicContact CB-CB 4.06Å; D29-F289 HydrophobicContact CB-CD2 3.91Å; D29-F289 HydrophobicContact CB-CG 4.34Å; D29-I290 VanDerWaalsContact CA-O 3.24Å; D29-I290 WeakPolarHBondContact CA-O 3.28Å; D29-I290 WeakPolarHBondContact CB-O 3.44Å
30	L	95.9	Very high	83.1	Confident	68 Å²	68	85.3 Å²	85.3	36%	0.356	47%	0.468	S	S	.	.	S	Bend	trans	-63.2	143.8	176.2	-57	177.2	0	0	0	109.9	I26 R27 S32 T292	I26-L30 HydrophobicContact CG2-CD1 3.87Å; R27-L30 HydrophobicContact CB-CD2 4.16Å; R27-L30 HydrophobicContact CB-CG 4.13Å; L30-S32 PolarHBondContact O-N 3.06Å; L30-T292 PolarHBondContact N-OG1 2.91Å; L30-T292 WeakPolarHBondContact O-CA 3.49Å; L30-T292 WeakPolarHBondContact O-CB 3.23Å; L30-T292 WeakPolarHBondContact O-CG2 3.37Å; L30-T292 PolarHBondContact O-OG1 3.35Å
31	P	95.6	Very high	85.5	Confident	115 Å²	115	85.1 Å²	85.1	75%	0.747	46%	0.461	S	S	*	.	P	Polyproline II helix	trans	-53.3	140.9	173.2	-26.4	34.5	0	0	0	112.1
32	S	97.6	Very high	87.9	Confident	66 Å²	66	84.9 Å²	84.9	46%	0.462	45%	0.447	S	S	.	.	P	Polyproline II helix	trans	-62.6	140.9	175.1	-167.3	0	0	0	0	110.9	L30 C34 T292	L30-S32 PolarHBondContact O-N 3.06Å; S32-C34 WeakPolarHBondContact OG-CB 3.39Å; S32-C34 PolarHBondContact OG-N 3.46Å; S32-T292 WeakPolarHBondContact CB-O 3.43Å
33	R	97.5	Very high	90	Very high	225 Å²	225	82.7 Å²	82.7	85%	0.849	45%	0.449	S	S	*	.			trans	-97	4.6	171.3	-61.8	-172	-62.8	-123.1	1	112.7	S35	R33-S35 PolarHBondContact O-N 3.41Å
34	C	97.3	Very high	91.9	Very high	47 Å²	47	84.2 Å²	84.2	32%	0.318	46%	0.455	S	S	.	.			trans	-66	128.3	-179.7	-174.3	0	0	0	0	110	S32 W36 R248	S32-C34 WeakPolarHBondContact OG-CB 3.39Å; S32-C34 PolarHBondContact OG-N 3.46Å; C34-W36 VanDerWaalsContact SG-CB 3.53Å; C34-R248 PolarHBondContact SG-NH1 2.94Å
35	S	96	Very high	93	Very high	91 Å²	91	77.5 Å²	77.5	64%	0.636	43%	0.431	S	S	*	.			trans	-95.2	13.2	178.5	56.8	0	0	0	0	113.5	R33	R33-S35 PolarHBondContact O-N 3.41Å
36	W	96.1	Very high	93.5	Very high	56 Å²	56	80.4 Å²	80.4	21%	0.212	46%	0.456	C	S	.	.			trans	-58.1	140.5	176.6	176	94.2	0	0	0	110	C34 P38 R248 E252 L298	C34-W36 VanDerWaalsContact SG-CB 3.53Å; W36-P38 HydrophobicContact CH2-CB 4.47Å; W36-P38 HydrophobicContact CH2-CG 3.74Å; W36-P38 HydrophobicContact CZ3-CG 4.1Å; W36-R248 HydrophobicContact CD2-CB 4.49Å; W36-R248 HydrophobicContact CD2-CG 3.89Å; W36-R248 HydrophobicContact CE3-CG 3.89Å; W36-R248 HydrophobicContact CH2-CB 4.02Å; W36-R248 HydrophobicContact CH2-CG 3.63Å; W36-R248 HydrophobicContact CZ2-CB 3.58Å; W36-R248 HydrophobicContact CZ2-CG 3.6Å; W36-R248 HydrophobicContact CZ3-CG 3.78Å; W36-E252 HydrophobicContact CZ2-CG 4.37Å; W36-E252 PolarHBondContact NE1-OE1 2.84Å; W36-L298 HydrophobicContact CH2-CD1 4.27Å; W36-L298 HydrophobicContact CH2-CD2 3.86Å; W36-L298 HydrophobicContact CZ3-CD1 4.05Å; W36-L298 HydrophobicContact CZ3-CD2 3.8Å; W36-L298 HydrophobicContact CZ3-CG 4.43Å
37	R	92	Very high	93.8	Very high	123 Å²	123	80.5 Å²	80.5	46%	0.464	46%	0.455	S	S	.	.			trans	-148	148.4	175.4	58.8	-171	179.9	-74.7	-7.7	109.1	G39 A40 E44	R37-G39 PolarHBondContact O-N 2.79Å; R37-A40 HydrophobicContact CG-CB 3.88Å; R37-A40 WeakPolarHBondContact O-CB 3.44Å; R37-A40 PolarHBondContact O-N 3.4Å; R37-A40 VanDerWaalsContact O-N 3.13Å; R37-E44 IonicContact CZ-OE2 3.45Å; R37-E44 IonicContact NH1-OE2 2.7Å; R37-E44 IonicContact NH2-OE1 3.87Å; R37-E44 IonicContact NH2-OE2 3.54Å; R37-E44 PolarHBondContact NH2-OE2 3.19Å
38	P	87.9	Confident	93.8	Very high	85 Å²	85	78.2 Å²	78.2	55%	0.552	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	132	175.3	-24	32.7	0	0	0	111.4	W36 A40	W36-P38 HydrophobicContact CH2-CB 4.47Å; W36-P38 HydrophobicContact CH2-CG 3.74Å; W36-P38 HydrophobicContact CZ3-CG 4.1Å; P38-A40 VanDerWaalsContact C-N 3.34Å; P38-A40 PolarHBondContact O-N 2.7Å
39	G	86.9	Confident	93.4	Very high	73 Å²	73	82.2 Å²	82.2	75%	0.753	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.7	-1.1	179.4	0	0	0	0	0	115.8	R37	R37-G39 PolarHBondContact O-N 2.79Å
40	A	90.6	Very high	93.1	Very high	27 Å²	27	83.1 Å²	83.1	22%	0.223	48%	0.48	C	S	.	.			trans	-62.4	135.1	170.3	0	0	0	0	0	110.8	R37 P38	R37-A40 HydrophobicContact CG-CB 3.88Å; R37-A40 WeakPolarHBondContact O-CB 3.44Å; R37-A40 PolarHBondContact O-N 3.4Å; R37-A40 VanDerWaalsContact O-N 3.13Å; P38-A40 VanDerWaalsContact C-N 3.34Å; P38-A40 PolarHBondContact O-N 2.7Å
41	P	90.9	Very high	92.7	Very high	66 Å²	66	84.8 Å²	84.8	43%	0.429	50%	0.495	S	S	.	.			trans	-57.7	141.1	173.7	-22.5	31.1	0	0	0	111.9	S43 E44	P41-S43 PolarHBondContact O-N 2.87Å; P41-S43 VanDerWaalsContact O-N 3.16Å; P41-E44 HydrophobicContact CB-CG 4.39Å; P41-E44 VanDerWaalsContact CD-OE1 3.31Å; P41-E44 WeakPolarHBondContact CD-OE1 3.36Å; P41-E44 HydrophobicContact CG-CG 4.44Å; P41-E44 WeakPolarHBondContact O-CB 3.49Å; P41-E44 PolarHBondContact O-N 2.82Å
42	M	87.6	Confident	92.2	Very high	81 Å²	81	84.6 Å²	84.6	40%	0.399	48%	0.479	S	S	.	.	G	3₁₀ helix	trans	-60.9	-28.6	178.2	-157.5	65.8	82.6	0	0	113	E44 S45 Q49 Y215	M42-E44 PolarHBondContact O-N 2.83Å; M42-S45 VanDerWaalsContact O-CB 3.25Å; M42-S45 WeakPolarHBondContact O-CB 3.46Å; M42-S45 PolarHBondContact O-N 3.24Å; M42-Q49 VanDerWaalsContact CG-NE2 3.32Å; M42-Q49 PolarHBondContact SD-NE2 2.96Å; M42-Y215 HydrophobicContact CE-CE1 4.22Å; M42-Y215 WeakPolarHBondContact CE-OH 3.39Å; M42-Y215 HydrophobicContact SD-CE1 4.5Å
43	S	91.2	Very high	91.6	Very high	114 Å²	114	87.4 Å²	87.4	80%	0.797	49%	0.487	S	S	*	.	G	3₁₀ helix	trans	-63.6	-17.3	175.1	55	0	0	0	0	114	P41 S45	P41-S43 PolarHBondContact O-N 2.87Å; P41-S43 VanDerWaalsContact O-N 3.16Å; S43-S45 VanDerWaalsContact C-N 3.35Å
44	E	93.8	Very high	91.1	Very high	102 Å²	102	85.4 Å²	85.4	48%	0.477	49%	0.485	S	S	.	.	G	3₁₀ helix	trans	-82.2	-12.8	173	-65.5	-177.4	-160.3	0	0	112.5	R37 P41 M42 P46	R37-E44 IonicContact CZ-OE2 3.45Å; R37-E44 IonicContact NH1-OE2 2.7Å; R37-E44 IonicContact NH2-OE1 3.87Å; R37-E44 IonicContact NH2-OE2 3.54Å; R37-E44 PolarHBondContact NH2-OE2 3.19Å; P41-E44 HydrophobicContact CB-CG 4.39Å; P41-E44 VanDerWaalsContact CD-OE1 3.31Å; P41-E44 WeakPolarHBondContact CD-OE1 3.36Å; P41-E44 HydrophobicContact CG-CG 4.44Å; P41-E44 WeakPolarHBondContact O-CB 3.49Å; P41-E44 PolarHBondContact O-N 2.82Å; M42-E44 PolarHBondContact O-N 2.83Å; E44-P46 WeakPolarHBondContact O-CD 3.39Å
45	S	96.1	Very high	90.7	Very high	41 Å²	41	85.5 Å²	85.5	29%	0.287	49%	0.485	S	S	.	.			trans	-71.1	124.2	-179.5	179.3	0	0	0	0	110.8	M42 S43 H47	M42-S45 VanDerWaalsContact O-CB 3.25Å; M42-S45 WeakPolarHBondContact O-CB 3.46Å; M42-S45 PolarHBondContact O-N 3.24Å; S43-S45 VanDerWaalsContact C-N 3.35Å; S45-H47 PolarHBondContact O-N 3.08Å; S45-H47 PolarHBondContact OG-N 2.89Å
46	P	96.4	Very high	90.6	Very high	111 Å²	111	84.8 Å²	84.8	72%	0.721	48%	0.478	S	S	*	.			trans	-82	-1.5	175.1	35.4	-36.8	0	0	0	112.9	E44	E44-P46 WeakPolarHBondContact O-CD 3.39Å
47	H	96.8	Very high	90.5	Very high	68 Å²	68	94.5 Å²	94.5	32%	0.315	52%	0.515	S	S	.	.	S	Bend	trans	-91.8	150	-172.1	-61.4	-63.7	0	0	0	112.4	S45 L212	S45-H47 PolarHBondContact O-N 3.08Å; S45-H47 PolarHBondContact OG-N 2.89Å; H47-L212 HydrophobicContact CB-CD1 3.6Å; H47-L212 HydrophobicContact CB-CD2 4.21Å
48	S	93.4	Very high	90.8	Very high	40 Å²	40	95.9 Å²	95.9	28%	0.28	53%	0.53	S	S	.	.			trans	-56.4	143.7	171.7	59	0	0	0	0	110.8	R107 D111	S48-R107 PolarHBondContact O-NH2 2.83Å; S48-R107 PolarHBondContact OG-NH2 3.02Å; S48-D111 PolarHBondContact OG-OD1 3.42Å
49	Q	88.3	Confident	91.2	Very high	84 Å²	84	94.6 Å²	94.6	39%	0.393	52%	0.518	S	S	.	.			trans	-134	73.8	176.2	-66.7	-166.9	-17.1	0	0	109.5	M42	M42-Q49 VanDerWaalsContact CG-NE2 3.32Å; M42-Q49 PolarHBondContact SD-NE2 2.96Å
50	P	87.8	Confident	91.7	Very high	62 Å²	62	96.4 Å²	96.4	40%	0.403	52%	0.517	S	S	.	.			trans	-61	140.1	179.9	25.7	-32.7	0	0	0	109.8
51	P	86.5	Confident	92	Very high	104 Å²	104	98.4 Å²	98.4	68%	0.675	52%	0.524	S	S	*	.			trans	-63.9	140.8	179.7	26.7	-34	0	0	0	110.7	I53	P51-I53 HydrophobicContact CB-CG1 4.48Å; P51-I53 HydrophobicContact CG-CD1 4.31Å; P51-I53 HydrophobicContact CG-CG1 4.29Å; P51-I53 PolarHBondContact O-N 3.33Å; P51-I53 VanDerWaalsContact O-N 3.08Å
52	R	86.8	Confident	92.3	Very high	110 Å²	110	99.1 Å²	99.1	42%	0.415	52%	0.523	S	S	.	.			trans	-76.4	97.9	173.8	-165.5	-179.9	67.7	156.1	9.2	109.7	E220 E224	R52-E220 PolarHBondContact NH1-O 3.19Å; R52-E224 IonicContact CZ-OE2 3.67Å; R52-E224 IonicContact NH1-OE2 2.72Å; R52-E224 PolarHBondContact NH1-OE2 2.99Å; R52-E224 IonicContact NH2-OE2 3.52Å; R52-E224 PolarHBondContact NH2-OE2 3.03Å
53	I	84.8	Confident	92.8	Very high	125 Å²	125	95.8 Å²	95.8	64%	0.641	51%	0.507	S	S	*	.	P	Polyproline II helix	trans	-90.1	131.9	-177.2	-60.7	167.5	0	0	0	109.6	P51	P51-I53 HydrophobicContact CB-CG1 4.48Å; P51-I53 HydrophobicContact CG-CD1 4.31Å; P51-I53 HydrophobicContact CG-CG1 4.29Å; P51-I53 PolarHBondContact O-N 3.33Å; P51-I53 VanDerWaalsContact O-N 3.08Å
54	K	86.6	Confident	93	Very high	183 Å²	183	91.7 Å²	91.7	80%	0.796	48%	0.483	S	S	*	.	P	Polyproline II helix	trans	-66.1	133.6	172.3	-172.9	173.8	-178	172.1	0	109.5
55	P	88.6	Confident	93.2	Very high	49 Å²	49	91.2 Å²	91.2	32%	0.318	48%	0.48	S	S	.	.	P	Polyproline II helix	trans	-59.2	139	-178.6	-23.8	33.5	0	0	0	111.4	L59 H68	P55-L59 HydrophobicContact CB-CD2 3.91Å; P55-H68 WeakPolarHBondContact CD-NE2 3.32Å; P55-H68 WeakPolarHBondContact CG-CD2 3.46Å
56	P	93.2	Very high	93.3	Very high	77 Å²	77	90.5 Å²	90.5	50%	0.5	47%	0.473	S	S	.	.	P	Polyproline II helix	trans	-65.2	161.2	174.1	29.2	-34.9	0	0	0	110.8	I58 L59	P56-I58 WeakPolarHBondContact CG-O 3.29Å; P56-I58 PolarHBondContact O-N 3.41Å; P56-L59 HydrophobicContact CG-CD2 4.33Å
57	R	94.7	Very high	93.3	Very high	260 Å²	260	85.8 Å²	85.8	98%	0.981	44%	0.444	S	S	*	.	S	Bend	trans	-60.8	-35.1	178.2	-68.5	-175	-179.7	-177.8	0.4	113
58	I	97.1	Very high	93.4	Very high	151 Å²	151	86.7 Å²	86.7	77%	0.774	45%	0.448	S	S	*	.	S	Bend	trans	-114.6	116.1	173.5	-60.3	174.2	0	0	0	106	P56	P56-I58 WeakPolarHBondContact CG-O 3.29Å; P56-I58 PolarHBondContact O-N 3.41Å
59	L	97.5	Very high	93.6	Very high	58 Å²	58	84.9 Å²	84.9	30%	0.304	44%	0.436	S	S	.	.			trans	-72.2	135.4	177.9	-58.4	178.8	0	0	0	109.5	P55 P56 N61 H65	P55-L59 HydrophobicContact CB-CD2 3.91Å; P56-L59 HydrophobicContact CG-CD2 4.33Å; L59-N61 PolarHBondContact O-N 3.49Å; L59-H65 HydrophobicContact CD1-CB 3.86Å
60	P	96.3	Very high	94.1	Very high	111 Å²	111	83.2 Å²	83.2	72%	0.721	43%	0.432	S	S	*	.	S	Bend	trans	-66.1	-30.2	179.7	26	-34	0	0	0	112.4
61	N	97.6	Very high	94.6	Very high	70 Å²	70	82 Å²	82	37%	0.374	42%	0.422	S	S	.	.	S	Bend	trans	-161.3	179.3	171.9	58.1	49	0	0	0	109.1	L59 L63 G64 V142	L59-N61 PolarHBondContact O-N 3.49Å; N61-L63 PolarHBondContact O-N 2.95Å; N61-L63 WeakPolarHBondContact OD1-CB 3.03Å; N61-L63 PolarHBondContact OD1-N 3.17Å; N61-G64 PolarHBondContact O-N 3.41Å; N61-V142 HydrophobicContact CB-CG1 4.17Å
62	I	98.2	Very high	95.2	Very high	81 Å²	81	79.4 Å²	79.4	42%	0.415	41%	0.405	S	S	.	.	G	3₁₀ helix	trans	-63.3	-22.9	-175.6	-166.7	58.3	0	0	0	113.9	G64 H65 A96 L138 V142	I62-G64 PolarHBondContact O-N 3.34Å; I62-H65 HydrophobicContact CD1-CB 4.34Å; I62-H65 WeakPolarHBondContact O-CB 3.23Å; I62-H65 PolarHBondContact O-N 3.26Å; I62-A96 HydrophobicContact CD1-CB 4.28Å; I62-A96 HydrophobicContact CG1-CB 3.84Å; I62-L138 HydrophobicContact CG2-CD1 4.15Å; I62-V142 HydrophobicContact CG2-CG2 3.76Å
63	L	97.3	Very high	95.8	Very high	11 Å²	11	80.6 Å²	80.6	6%	0.058	41%	0.409	C	S	.	.	G	3₁₀ helix	trans	-65.4	-25.5	179.6	-60.8	-171.1	0	0	0	112.2	N61 H65 I66 M106 L138 I139 V142 K143	N61-L63 PolarHBondContact O-N 2.95Å; N61-L63 WeakPolarHBondContact OD1-CB 3.03Å; N61-L63 PolarHBondContact OD1-N 3.17Å; L63-H65 PolarHBondContact O-N 3.25Å; L63-I66 HydrophobicContact CD2-CD1 4.25Å; L63-I66 PolarHBondContact O-N 3.42Å; L63-M106 HydrophobicContact CB-CE 3.45Å; L63-M106 VanDerWaalsContact CB-CE 3.45Å; L63-M106 HydrophobicContact CD1-CE 4.34Å; L63-M106 HydrophobicContact CD2-CE 4.36Å; L63-M106 HydrophobicContact CG-CE 4.25Å; L63-M106 VanDerWaalsContact O-CE 3.28Å; L63-M106 WeakPolarHBondContact O-CE 3.32Å; L63-L138 HydrophobicContact CD2-CD2 4.34Å; L63-L138 HydrophobicContact CD2-CG 4.2Å; L63-I139 HydrophobicContact CD1-CG1 4.22Å; L63-I139 HydrophobicContact CD1-CG2 4.3Å; L63-I139 HydrophobicContact CD2-CB 4.43Å; L63-I139 HydrophobicContact CD2-CG1 3.66Å; L63-V142 HydrophobicContact CD1-CB 3.96Å; L63-V142 HydrophobicContact CD1-CG1 3.74Å; L63-V142 HydrophobicContact CD2-CB 4.48Å; L63-V142 HydrophobicContact CD2-CG2 4.22Å; L63-V142 HydrophobicContact CG-CB 4.11Å; L63-V142 HydrophobicContact CG-CG1 3.93Å; L63-V142 HydrophobicContact CG-CG2 4.14Å; L63-K143 HydrophobicContact CD1-CG 4.22Å
64	G	96.1	Very high	96.5	Very high	28 Å²	28	75 Å²	75	29%	0.289	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	-67.6	-7	171.3	0	0	0	0	0	114.7	N61 I62	N61-G64 PolarHBondContact O-N 3.41Å; I62-G64 PolarHBondContact O-N 3.34Å
65	H	97.1	Very high	97	Very high	92 Å²	92	70.1 Å²	70.1	43%	0.426	36%	0.363	S	S	.	.	G	3₁₀ helix	trans	-98.8	26.3	173.5	-160.6	-62.3	0	0	0	111.8	L59 I62 L63 F94 A96	L59-H65 HydrophobicContact CD1-CB 3.86Å; I62-H65 HydrophobicContact CD1-CB 4.34Å; I62-H65 WeakPolarHBondContact O-CB 3.23Å; I62-H65 PolarHBondContact O-N 3.26Å; L63-H65 PolarHBondContact O-N 3.25Å; H65-F94 PolarHBondContact CE1-O 2.82Å; H65-F94 VanDerWaalsContact CE1-O 3.29Å; H65-F94 PolarHBondContact ND1-O 3.45Å; H65-A96 HydrophobicContact CB-CB 4.42Å; H65-A96 PolarHBondContact O-N 3.41Å
66	I	97.9	Very high	97.5	Very high	25 Å²	25	73.5 Å²	73.5	13%	0.128	37%	0.373	C	S	.	.	S	Bend	trans	-103.3	127.7	170.3	-65.9	169.9	0	0	0	107.9	L63 A96 D102 R103 M106	L63-I66 HydrophobicContact CD2-CD1 4.25Å; L63-I66 PolarHBondContact O-N 3.42Å; I66-A96 HydrophobicContact CG1-CB 4.02Å; I66-D102 HydrophobicContact CD1-CB 3.87Å; I66-D102 HydrophobicContact CG1-CB 3.89Å; I66-D102 HydrophobicContact CG2-CB 4.03Å; I66-R103 HydrophobicContact CG2-CB 4.47Å; I66-R103 HydrophobicContact CG2-CG 4.04Å; I66-M106 HydrophobicContact CB-CE 4.36Å; I66-M106 HydrophobicContact CD1-CE 3.61Å; I66-M106 HydrophobicContact CG1-CE 4.45Å
67	G	97.6	Very high	97.7	Very high	12 Å²	12	69.9 Å²	69.9	12%	0.124	35%	0.349	C	S	.	.	S	Bend	trans	93.9	-170.8	-173.5	0	0	0	0	0	113.9	T69 N95	G67-T69 PolarHBondContact O-N 2.95Å; G67-T69 VanDerWaalsContact O-N 3.14Å; G67-N95 PolarHBondContact N-OD1 3.19Å
68	H	97.3	Very high	97.9	Very high	87 Å²	87	57.9 Å²	57.9	40%	0.403	31%	0.305	S	S	.	.			trans	52.7	34.9	-178.2	-59.2	-76.8	0	0	0	113.8	P55 E221	P55-H68 WeakPolarHBondContact CD-NE2 3.32Å; P55-H68 WeakPolarHBondContact CG-CD2 3.46Å; H68-E221 PolarHBondContact N-OE1 2.97Å; H68-E221 PolarHBondContact N-OE2 3.42Å
69	T	98.6	Very high	98	Very high	3 Å²	3	58.3 Å²	58.3	2%	0.018	30%	0.301	C	S	.	.			trans	-70.3	149.3	-176.4	57.3	0	0	0	0	111.3	G67 K90 C91 E92 R103 E221 Q225	G67-T69 PolarHBondContact O-N 2.95Å; G67-T69 VanDerWaalsContact O-N 3.14Å; T69-K90 PolarHBondContact O-NZ 2.74Å; T69-K90 WeakPolarHBondContact OG1-CE 3.49Å; T69-K90 PolarHBondContact OG1-NZ 2.76Å; T69-C91 WeakPolarHBondContact CB-O 3.23Å; T69-E92 PolarHBondContact OG1-OE1 3.25Å; T69-R103 PolarHBondContact OG1-NH2 3.06Å; T69-E221 PolarHBondContact N-OE2 2.99Å; T69-Q225 PolarHBondContact O-NE2 2.79Å
70	P	98.8	Very high	98	Very high	49 Å²	49	61 Å²	61	32%	0.318	31%	0.312	S	S	.	.			trans	-69.9	145.8	-176.8	26.1	-30.2	0	0	0	111.7	V72 C91 F94	P70-V72 HydrophobicContact CB-CG2 4.03Å; P70-V72 HydrophobicContact CG-CG2 4.44Å; P70-C91 HydrophobicContact CG-CB 4.07Å; P70-C91 PolarHBondContact O-N 3.32Å; P70-F94 HydrophobicContact CG-CD2 3.57Å; P70-F94 HydrophobicContact CG-CE2 3.92Å; P70-F94 HydrophobicContact CG-CG 4.23Å
71	L	98.9	Very high	98.1	Very high	35 Å²	35	59 Å²	59	18%	0.183	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	110	166	-173.2	70.7	0	0	0	107.9	F88 A89 K90 Q225 C226 V350	L71-F88 HydrophobicContact CD1-CB 3.64Å; L71-F88 HydrophobicContact CD2-CB 4.21Å; L71-F88 HydrophobicContact CD2-CD1 4.47Å; L71-F88 HydrophobicContact CD2-CG 4.28Å; L71-F88 HydrophobicContact CG-CB 3.77Å; L71-F88 HydrophobicContact CG-CD1 4.37Å; L71-F88 HydrophobicContact CG-CG 4.24Å; L71-A89 WeakPolarHBondContact CA-O 3.35Å; L71-K90 HydrophobicContact CD1-CB 4.05Å; L71-K90 HydrophobicContact CD1-CD 4.32Å; L71-Q225 HydrophobicContact CB-CB 4.04Å; L71-Q225 HydrophobicContact CB-CG 4.34Å; L71-Q225 HydrophobicContact CD2-CB 3.65Å; L71-Q225 HydrophobicContact CG-CB 4.48Å; L71-C226 VanDerWaalsContact CD2-SG 3.52Å; L71-V350 HydrophobicContact CD1-CG1 3.94Å; L71-V350 HydrophobicContact CD1-CG2 4.19Å
72	V	98.9	Very high	98.1	Very high	51 Å²	51	58.2 Å²	58.2	31%	0.309	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	128.3	-169.4	-177	0	0	0	0	110	P70 F88 A89 L323	P70-V72 HydrophobicContact CB-CG2 4.03Å; P70-V72 HydrophobicContact CG-CG2 4.44Å; V72-F88 CarbonylContact O-C 3.5Å; V72-F88 VanDerWaalsContact O-CA 3.29Å; V72-F88 WeakPolarHBondContact O-CA 3.49Å; V72-A89 PolarHBondContact N-O 3.03Å; V72-A89 PolarHBondContact O-N 3.42Å; V72-L323 HydrophobicContact CG1-CD2 4.38Å
73	R	98.8	Very high	98.1	Very high	134 Å²	134	55.3 Å²	55.3	51%	0.506	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	134.5	175	179.7	179.6	-74	-174.5	-7.5	110.9	N75 E86 F88	R73-N75 PolarHBondContact O-ND2 3.42Å; R73-N75 VanDerWaalsContact O-ND2 3.11Å; R73-E86 IonicContact CZ-OE1 2.78Å; R73-E86 IonicContact NE-OE1 2.69Å; R73-E86 IonicContact NH2-OE1 3.5Å; R73-E86 PolarHBondContact NH2-OE1 3Å; R73-F88 HydrophobicContact CB-CD1 4.04Å; R73-F88 HydrophobicContact CB-CE1 4.05Å; R73-F88 HydrophobicContact CG-CE1 4.41Å
74	L	98.8	Very high	98.1	Very high	7 Å²	7	62.2 Å²	62.2	4%	0.037	32%	0.315	C	S	.	.			trans	-91.2	131.1	172.3	-64.8	153.1	0	0	0	109.5	P78 M87 A89 L317 E321 L323 M333	L74-P78 HydrophobicContact CB-CG 3.71Å; L74-M87 HydrophobicContact CB-CB 4.28Å; L74-M87 HydrophobicContact CD1-CB 3.87Å; L74-M87 PolarHBondContact N-O 2.67Å; L74-A89 HydrophobicContact CD1-CB 4.31Å; L74-A89 HydrophobicContact CD2-CB 4.29Å; L74-A89 HydrophobicContact CG-CB 4.3Å; L74-L317 HydrophobicContact CD2-CD2 4.05Å; L74-E321 HydrophobicContact CD2-CB 4.26Å; L74-E321 HydrophobicContact CD2-CG 3.73Å; L74-L323 HydrophobicContact CD2-CD1 3.73Å; L74-M333 HydrophobicContact CD1-CE 3.18Å; L74-M333 HydrophobicContact CD1-SD 4.31Å; L74-M333 HydrophobicContact CD2-CE 3.82Å; L74-M333 HydrophobicContact CG-CE 4.12Å
75	N	98.3	Very high	98.2	Very high	81 Å²	81	61.3 Å²	61.3	43%	0.433	30%	0.304	S	S	.	.			trans	-117.7	-32.3	-166.1	-60.8	-73.2	0	0	0	114.3	R73 K79 E321	R73-N75 PolarHBondContact O-ND2 3.42Å; R73-N75 VanDerWaalsContact O-ND2 3.11Å; N75-K79 WeakPolarHBondContact O-CD 3.42Å; N75-K79 WeakPolarHBondContact O-CE 3.38Å; N75-K79 WeakPolarHBondContact O-CG 3.34Å; N75-E321 PolarHBondContact N-OE1 3.11Å; N75-E321 VanDerWaalsContact N-OE1 3.08Å; N75-E321 PolarHBondContact N-OE2 2.91Å
76	K	98.6	Very high	98.3	Very high	121 Å²	121	59.3 Å²	59.3	53%	0.526	30%	0.295	S	S	.	.	S	Bend	trans	-102.4	-51.6	-175.3	-63.4	-172.4	-166.2	151.7	0	111.4	K79 E80 E320 E321	K76-K79 PolarHBondContact O-N 3.06Å; K76-K79 VanDerWaalsContact O-N 3.13Å; K76-E80 PolarHBondContact O-N 2.93Å; K76-E320 HydrophobicContact CB-CB 4.31Å; K76-E320 HydrophobicContact CD-CB 4.17Å; K76-E320 VanDerWaalsContact CD-O 3.29Å; K76-E320 WeakPolarHBondContact CD-O 3.23Å; K76-E320 WeakPolarHBondContact CE-O 3.44Å; K76-E320 PolarHBondContact NZ-O 2.71Å; K76-E321 WeakPolarHBondContact CA-OE1 3.23Å; K76-E321 PolarHBondContact N-OE1 3.03Å
77	I	98.5	Very high	98.3	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-57.5	-49.3	-176.2	-65.9	173.8	0	0	0	111	K79 E80 F81 M313 K316 L317 E320 E321 M333 V337	I77-K79 VanDerWaalsContact C-N 3.26Å; I77-K79 PolarHBondContact O-N 3.37Å; I77-E80 PolarHBondContact O-N 3.3Å; I77-F81 HydrophobicContact CG2-CD2 3.98Å; I77-F81 HydrophobicContact CG2-CE2 4.1Å; I77-F81 WeakPolarHBondContact O-CD2 3.38Å; I77-F81 PolarHBondContact O-N 2.9Å; I77-M313 HydrophobicContact CD1-SD 4.47Å; I77-M313 HydrophobicContact CG2-SD 4.39Å; I77-K316 HydrophobicContact CD1-CB 4.48Å; I77-K316 HydrophobicContact CD1-CG 4.15Å; I77-K316 HydrophobicContact CG1-CD 4.33Å; I77-K316 HydrophobicContact CG1-CG 4.2Å; I77-L317 HydrophobicContact CD1-CD2 3.72Å; I77-L317 HydrophobicContact CD1-CG 4.07Å; I77-E320 HydrophobicContact CG1-CB 4.38Å; I77-E321 HydrophobicContact CD1-CG 3.76Å; I77-E321 HydrophobicContact CG1-CG 4.04Å; I77-E321 PolarHBondContact N-OE1 3.07Å; I77-M333 HydrophobicContact CG2-SD 4.43Å; I77-V337 HydrophobicContact CG2-CG1 3.81Å
78	P	98.4	Very high	98.4	Very high	8 Å²	8	58.8 Å²	58.8	5%	0.052	29%	0.289	C	S	.	.	H	α-helix	trans	-59.8	-36.7	-179.8	-24	34.8	0	0	0	113.4	L74 F81 G82 L83 M87	L74-P78 HydrophobicContact CB-CG 3.71Å; P78-F81 PolarHBondContact O-N 3.3Å; P78-G82 PolarHBondContact O-N 2.86Å; P78-L83 HydrophobicContact CB-CB 4.17Å; P78-L83 HydrophobicContact CB-CD1 4.2Å; P78-L83 WeakPolarHBondContact O-CB 3.29Å; P78-L83 PolarHBondContact O-N 2.89Å; P78-M87 HydrophobicContact CB-CB 4.48Å; P78-M87 HydrophobicContact CB-CG 4.25Å; P78-M87 HydrophobicContact CB-SD 3.96Å; P78-M87 HydrophobicContact CG-CB 3.78Å; P78-M87 HydrophobicContact CG-CG 4.02Å; P78-M87 HydrophobicContact CG-SD 3.77Å
79	K	97.9	Very high	98.5	Very high	160 Å²	160	54.6 Å²	54.6	70%	0.696	27%	0.269	S	S	*	.	H	α-helix	trans	-68.9	-41.1	178.6	-64.6	-178.1	-174.5	172.7	0	112.2	N75 K76 I77 F81 G82	N75-K79 WeakPolarHBondContact O-CD 3.42Å; N75-K79 WeakPolarHBondContact O-CE 3.38Å; N75-K79 WeakPolarHBondContact O-CG 3.34Å; K76-K79 PolarHBondContact O-N 3.06Å; K76-K79 VanDerWaalsContact O-N 3.13Å; I77-K79 VanDerWaalsContact C-N 3.26Å; I77-K79 PolarHBondContact O-N 3.37Å; K79-F81 VanDerWaalsContact C-N 3.25Å; K79-F81 PolarHBondContact O-N 3.24Å; K79-G82 PolarHBondContact O-N 3.17Å
80	E	98.1	Very high	98.5	Very high	115 Å²	115	54.5 Å²	54.5	54%	0.537	27%	0.268	S	S	.	.	H	α-helix	trans	-60.1	-38.9	176.5	-176.2	178.8	142.6	0	0	111.6	K76 I77 G82 K316	K76-E80 PolarHBondContact O-N 2.93Å; I77-E80 PolarHBondContact O-N 3.3Å; E80-G82 VanDerWaalsContact C-N 3.27Å; E80-G82 PolarHBondContact O-N 2.97Å; E80-K316 WeakPolarHBondContact OE1-CE 3.21Å; E80-K316 IonicContact OE1-NZ 3.59Å; E80-K316 PolarHBondContact OE1-NZ 2.69Å; E80-K316 WeakPolarHBondContact OE2-CE 3.4Å; E80-K316 IonicContact OE2-NZ 2.81Å; E80-K316 PolarHBondContact OE2-NZ 2.95Å
81	F	98	Very high	98.5	Very high	70 Å²	70	52.1 Å²	52.1	31%	0.307	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85	7.3	177	-74.2	-93.8	0	0	0	113.7	I77 P78 K79 L83 M313 K316 V337 Q341	I77-F81 HydrophobicContact CG2-CD2 3.98Å; I77-F81 HydrophobicContact CG2-CE2 4.1Å; I77-F81 WeakPolarHBondContact O-CD2 3.38Å; I77-F81 PolarHBondContact O-N 2.9Å; P78-F81 PolarHBondContact O-N 3.3Å; K79-F81 VanDerWaalsContact C-N 3.25Å; K79-F81 PolarHBondContact O-N 3.24Å; F81-L83 VanDerWaalsContact C-N 3.29Å; F81-L83 HydrophobicContact CB-CD1 4.38Å; F81-L83 HydrophobicContact CB-CG 4.18Å; F81-L83 PolarHBondContact O-N 2.74Å; F81-M313 HydrophobicContact CE2-CE 3.93Å; F81-M313 HydrophobicContact CZ-CE 3.72Å; F81-K316 HydrophobicContact CE2-CD 4.48Å; F81-V337 HydrophobicContact CB-CB 4.25Å; F81-V337 HydrophobicContact CD1-CB 3.95Å; F81-V337 HydrophobicContact CD1-CG2 3.85Å; F81-V337 HydrophobicContact CD2-CB 4.24Å; F81-V337 HydrophobicContact CD2-CG1 4.08Å; F81-V337 HydrophobicContact CE1-CB 4.37Å; F81-V337 HydrophobicContact CE1-CG2 3.8Å; F81-V337 HydrophobicContact CE2-CG1 4.45Å; F81-V337 HydrophobicContact CE2-CG2 4.47Å; F81-V337 HydrophobicContact CG-CB 3.88Å; F81-V337 HydrophobicContact CG-CG1 4.2Å; F81-V337 HydrophobicContact CG-CG2 4.22Å; F81-V337 HydrophobicContact CZ-CG2 4.13Å; F81-Q341 PolarHBondContact O-NE2 3.43Å
82	G	98.2	Very high	98.5	Very high	53 Å²	53	50.5 Å²	50.5	55%	0.546	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.7	22.9	176.5	0	0	0	0	0	115	P78 K79 E80	P78-G82 PolarHBondContact O-N 2.86Å; K79-G82 PolarHBondContact O-N 3.17Å; E80-G82 VanDerWaalsContact C-N 3.27Å; E80-G82 PolarHBondContact O-N 2.97Å
83	L	98.3	Very high	98.5	Very high	19 Å²	19	49 Å²	49	10%	0.099	23%	0.234	C	C	.	.			trans	-75.9	136.9	-177.3	-60.7	175.7	0	0	0	111.6	P78 F81 M87 V337 A340 Q341	P78-L83 HydrophobicContact CB-CB 4.17Å; P78-L83 HydrophobicContact CB-CD1 4.2Å; P78-L83 WeakPolarHBondContact O-CB 3.29Å; P78-L83 PolarHBondContact O-N 2.89Å; F81-L83 VanDerWaalsContact C-N 3.29Å; F81-L83 HydrophobicContact CB-CD1 4.38Å; F81-L83 HydrophobicContact CB-CG 4.18Å; F81-L83 PolarHBondContact O-N 2.74Å; L83-M87 HydrophobicContact CD1-CG 4.49Å; L83-M87 HydrophobicContact CD1-SD 3.26Å; L83-M87 WeakPolarHBondContact CD1-SD 3.24Å; L83-V337 HydrophobicContact CD1-CB 4.29Å; L83-V337 HydrophobicContact CD1-CG1 4.31Å; L83-A340 HydrophobicContact CD1-CB 4.22Å; L83-A340 HydrophobicContact CD2-CB 4.14Å; L83-Q341 VanDerWaalsContact CD2-CD 3.44Å; L83-Q341 HydrophobicContact CD2-CG 3.98Å
84	K	97.6	Very high	98.5	Very high	156 Å²	156	47.8 Å²	47.8	68%	0.678	23%	0.232	S	C	*	.			trans	-92.8	-27.7	-179.5	-60.4	-179.7	-177.6	177.2	0	113.5
85	C	98.5	Very high	98.5	Very high	9 Å²	9	47.7 Å²	47.7	6%	0.061	23%	0.232	C	C	.	.	S	Bend	trans	-74.5	161.1	-179.8	70.5	0	0	0	0	112.5	L343 E344 Q347	C85-L343 HydrophobicContact CB-CB 3.62Å; C85-L343 HydrophobicContact CB-CD1 4.15Å; C85-E344 WeakPolarHBondContact CA-O 3.46Å; C85-Q347 HydrophobicContact CB-CB 4.3Å; C85-Q347 WeakPolarHBondContact CB-O 3.41Å
86	E	98.5	Very high	98.5	Very high	50 Å²	50	45.4 Å²	45.4	23%	0.234	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	133	167.7	-58.7	-173.5	86.4	0	0	109.9	R73 F88 Q347 R348 C349	R73-E86 IonicContact CZ-OE1 2.78Å; R73-E86 IonicContact NE-OE1 2.69Å; R73-E86 IonicContact NH2-OE1 3.5Å; R73-E86 PolarHBondContact NH2-OE1 3Å; E86-F88 HydrophobicContact CB-CE2 3.65Å; E86-F88 HydrophobicContact CB-CZ 3.93Å; E86-Q347 PolarHBondContact N-O 3.48Å; E86-R348 HydrophobicContact CB-CG 4.22Å; E86-R348 WeakPolarHBondContact O-CA 3.47Å; E86-R348 IonicContact OE2-CZ 4Å; E86-R348 IonicContact OE2-NE 3.93Å; E86-R348 PolarHBondContact OE2-NE 3.19Å; E86-R348 IonicContact OE2-NH2 3.18Å; E86-C349 PolarHBondContact O-N 2.61Å
87	M	98.8	Very high	98.5	Very high	2 Å²	2	39.9 Å²	39.9	1%	0.01	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	137.8	173.8	-65.3	-169.4	70.9	0	0	111.9	L74 P78 L83 M333 A336 C349 V351	L74-M87 HydrophobicContact CB-CB 4.28Å; L74-M87 HydrophobicContact CD1-CB 3.87Å; L74-M87 PolarHBondContact N-O 2.67Å; P78-M87 HydrophobicContact CB-CB 4.48Å; P78-M87 HydrophobicContact CB-CG 4.25Å; P78-M87 HydrophobicContact CB-SD 3.96Å; P78-M87 HydrophobicContact CG-CB 3.78Å; P78-M87 HydrophobicContact CG-CG 4.02Å; P78-M87 HydrophobicContact CG-SD 3.77Å; L83-M87 HydrophobicContact CD1-CG 4.49Å; L83-M87 HydrophobicContact CD1-SD 3.26Å; L83-M87 WeakPolarHBondContact CD1-SD 3.24Å; M87-M333 HydrophobicContact CE-SD 3.91Å; M87-A336 HydrophobicContact CE-CB 3.6Å; M87-C349 CarbonylContact C-O 3.58Å; M87-C349 WeakPolarHBondContact CA-O 3.4Å; M87-C349 HydrophobicContact CG-CB 4.22Å; M87-V351 HydrophobicContact CE-CG2 3.74Å
88	F	98.9	Very high	98.5	Very high	24 Å²	24	40.3 Å²	40.3	11%	0.105	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	143.1	178.2	-54.5	-88.2	0	0	0	111.3	L71 V72 R73 E86 R348 C349 V350 V351	L71-F88 HydrophobicContact CD1-CB 3.64Å; L71-F88 HydrophobicContact CD2-CB 4.21Å; L71-F88 HydrophobicContact CD2-CD1 4.47Å; L71-F88 HydrophobicContact CD2-CG 4.28Å; L71-F88 HydrophobicContact CG-CB 3.77Å; L71-F88 HydrophobicContact CG-CD1 4.37Å; L71-F88 HydrophobicContact CG-CG 4.24Å; V72-F88 CarbonylContact O-C 3.5Å; V72-F88 VanDerWaalsContact O-CA 3.29Å; V72-F88 WeakPolarHBondContact O-CA 3.49Å; R73-F88 HydrophobicContact CB-CD1 4.04Å; R73-F88 HydrophobicContact CB-CE1 4.05Å; R73-F88 HydrophobicContact CG-CE1 4.41Å; E86-F88 HydrophobicContact CB-CE2 3.65Å; E86-F88 HydrophobicContact CB-CZ 3.93Å; F88-R348 HydrophobicContact CE2-CB 4.21Å; F88-R348 HydrophobicContact CE2-CG 3.99Å; F88-C349 PolarHBondContact N-O 3.31Å; F88-V350 HydrophobicContact CB-CG2 4.26Å; F88-V350 HydrophobicContact CD2-CG2 4.5Å; F88-V350 CarbonylContact O-C 3.56Å; F88-V350 WeakPolarHBondContact O-CA 3.42Å; F88-V351 PolarHBondContact O-N 3.49Å
89	A	98.9	Very high	98.5	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	121.9	171	0	0	0	0	0	109.9	L71 V72 L74 C91 L323 V351 L353	L71-A89 WeakPolarHBondContact CA-O 3.35Å; V72-A89 PolarHBondContact N-O 3.03Å; V72-A89 PolarHBondContact O-N 3.42Å; L74-A89 HydrophobicContact CD1-CB 4.31Å; L74-A89 HydrophobicContact CD2-CB 4.29Å; L74-A89 HydrophobicContact CG-CB 4.3Å; A89-C91 PolarHBondContact O-N 2.6Å; A89-L323 HydrophobicContact CB-CD1 4Å; A89-V351 CarbonylContact C-O 3.56Å; A89-V351 WeakPolarHBondContact CA-O 3.31Å; A89-L353 HydrophobicContact CB-CD1 3.59Å; A89-L353 HydrophobicContact CB-CG 3.95Å
90	K	98.9	Very high	98.5	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	104.2	168.4	-176.5	61.5	168	169.8	0	108.1	T69 L71 E92 E221 I222 V350 V351 I352 L353	T69-K90 PolarHBondContact O-NZ 2.74Å; T69-K90 WeakPolarHBondContact OG1-CE 3.49Å; T69-K90 PolarHBondContact OG1-NZ 2.76Å; L71-K90 HydrophobicContact CD1-CB 4.05Å; L71-K90 HydrophobicContact CD1-CD 4.32Å; K90-E92 HydrophobicContact CG-CG 4.44Å; K90-E92 PolarHBondContact O-N 2.99Å; K90-E92 VanDerWaalsContact O-N 3.15Å; K90-E221 WeakPolarHBondContact CE-OE2 3.47Å; K90-E221 IonicContact NZ-OE2 3.76Å; K90-E221 PolarHBondContact NZ-OE2 3.26Å; K90-I222 HydrophobicContact CD-CG1 4.14Å; K90-I222 HydrophobicContact CG-CD1 4.32Å; K90-I222 HydrophobicContact CG-CG1 4.22Å; K90-V350 HydrophobicContact CB-CG1 4.09Å; K90-V351 PolarHBondContact N-O 3.23Å; K90-I352 HydrophobicContact CB-CD1 3.75Å; K90-I352 HydrophobicContact CG-CD1 3.97Å; K90-L353 PolarHBondContact O-N 3.17Å
91	C	98.9	Very high	98.5	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	80.5	-165.8	-58.2	0	0	0	0	112.1	T69 P70 A89 Y93 F94	T69-C91 WeakPolarHBondContact CB-O 3.23Å; P70-C91 HydrophobicContact CG-CB 4.07Å; P70-C91 PolarHBondContact O-N 3.32Å; A89-C91 PolarHBondContact O-N 2.6Å; C91-Y93 HydrophobicContact CB-CD1 4.22Å; C91-Y93 HydrophobicContact CB-CE1 3.64Å; C91-Y93 HydrophobicContact CB-CE2 4.18Å; C91-Y93 PolarHBondContact O-N 2.55Å; C91-Y93 PolarHBondContact SG-OH 2.78Å; C91-F94 HydrophobicContact CB-CD2 3.68Å; C91-F94 HydrophobicContact CB-CE2 3.99Å; C91-F94 PolarHBondContact O-N 3.02Å
92	E	98.9	Very high	98.6	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	14%	0.135	C	C	.	.	G	3₁₀ helix	trans	-72.5	-9	-177.6	-69.1	-66.7	133.9	0	0	114.2	T69 K90 F94 N95 S99 I100 R103 I352 L353	T69-E92 PolarHBondContact OG1-OE1 3.25Å; K90-E92 HydrophobicContact CG-CG 4.44Å; K90-E92 PolarHBondContact O-N 2.99Å; K90-E92 VanDerWaalsContact O-N 3.15Å; E92-F94 PolarHBondContact O-N 2.84Å; E92-N95 PolarHBondContact O-N 2.95Å; E92-N95 PolarHBondContact O-ND2 3.02Å; E92-N95 PolarHBondContact OE2-ND2 2.69Å; E92-S99 CarbonylContact O-C 3.53Å; E92-S99 VanDerWaalsContact O-C 3.24Å; E92-I100 HydrophobicContact CB-CB 3.6Å; E92-I100 HydrophobicContact CB-CD1 4.36Å; E92-I100 HydrophobicContact CB-CG1 3.98Å; E92-I100 HydrophobicContact CG-CB 3.97Å; E92-I100 HydrophobicContact CG-CD1 3.82Å; E92-I100 HydrophobicContact CG-CG1 3.75Å; E92-R103 IonicContact OE1-CZ 3.48Å; E92-R103 IonicContact OE1-NE 3.64Å; E92-R103 PolarHBondContact OE1-NE 2.84Å; E92-R103 IonicContact OE1-NH2 3.64Å; E92-R103 PolarHBondContact OE1-NH2 2.79Å; E92-R103 IonicContact OE2-CZ 2.74Å; E92-R103 IonicContact OE2-NE 2.76Å; E92-R103 PolarHBondContact OE2-NE 3.42Å; E92-R103 IonicContact OE2-NH2 3.31Å; E92-R103 PolarHBondContact OE2-NH2 2.86Å; E92-I352 HydrophobicContact CG-CG2 4.23Å; E92-L353 WeakPolarHBondContact CB-O 3.48Å; E92-L353 PolarHBondContact N-O 2.76Å; E92-L353 VanDerWaalsContact N-O 3.11Å
93	Y	98.6	Very high	98.6	Very high	21 Å²	21	22.5 Å²	22.5	8%	0.082	11%	0.11	C	C	.	.	G	3₁₀ helix	trans	-74	-4.2	174.2	58.4	-103.8	0	0	0	114.6	C91 L323 C325 L353 D355	C91-Y93 HydrophobicContact CB-CD1 4.22Å; C91-Y93 HydrophobicContact CB-CE1 3.64Å; C91-Y93 HydrophobicContact CB-CE2 4.18Å; C91-Y93 PolarHBondContact O-N 2.55Å; C91-Y93 PolarHBondContact SG-OH 2.78Å; Y93-L323 VanDerWaalsContact OH-CD2 3.24Å; Y93-L323 WeakPolarHBondContact OH-CD2 3.34Å; Y93-C325 HydrophobicContact CD1-CB 3.9Å; Y93-C325 HydrophobicContact CE1-CB 3.8Å; Y93-L353 HydrophobicContact CD1-CB 4.07Å; Y93-L353 HydrophobicContact CE1-CB 3.95Å; Y93-L353 HydrophobicContact CE1-CD1 4.07Å; Y93-D355 WeakPolarHBondContact CB-O 3.29Å
94	F	98.8	Very high	98.6	Very high	108 Å²	108	21.6 Å²	21.6	47%	0.474	11%	0.106	S	C	.	.	G	3₁₀ helix	trans	-86.9	-4.1	171.8	-79.7	-75.9	0	0	0	114.3	H65 P70 C91 E92	H65-F94 PolarHBondContact CE1-O 2.82Å; H65-F94 VanDerWaalsContact CE1-O 3.29Å; H65-F94 PolarHBondContact ND1-O 3.45Å; P70-F94 HydrophobicContact CG-CD2 3.57Å; P70-F94 HydrophobicContact CG-CE2 3.92Å; P70-F94 HydrophobicContact CG-CG 4.23Å; C91-F94 HydrophobicContact CB-CD2 3.68Å; C91-F94 HydrophobicContact CB-CE2 3.99Å; C91-F94 PolarHBondContact O-N 3.02Å; E92-F94 PolarHBondContact O-N 2.84Å
95	N	98.8	Very high	98.7	Very high	5 Å²	5	14.2 Å²	14.2	3%	0.027	7%	0.073	C	C	.	.	S	Bend	trans	-61.5	156.5	170	-69.8	-67.5	0	0	0	110.5	G67 E92 G97 G98 S99 D102	G67-N95 PolarHBondContact N-OD1 3.19Å; E92-N95 PolarHBondContact O-N 2.95Å; E92-N95 PolarHBondContact O-ND2 3.02Å; E92-N95 PolarHBondContact OE2-ND2 2.69Å; N95-G97 PolarHBondContact O-N 3.2Å; N95-G98 WeakPolarHBondContact O-CA 3.48Å; N95-G98 PolarHBondContact O-N 3.25Å; N95-S99 WeakPolarHBondContact CB-O 3.41Å; N95-S99 PolarHBondContact ND2-O 2.88Å; N95-D102 HydrophobicContact CB-CB 3.93Å; N95-D102 WeakPolarHBondContact CB-OD2 3.24Å
96	A	98.4	Very high	98.6	Very high	33 Å²	33	14.8 Å²	14.8	27%	0.273	8%	0.076	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.4	-44.3	-173.8	0	0	0	0	0	116	I62 H65 I66 G98 L138	I62-A96 HydrophobicContact CD1-CB 4.28Å; I62-A96 HydrophobicContact CG1-CB 3.84Å; H65-A96 HydrophobicContact CB-CB 4.42Å; H65-A96 PolarHBondContact O-N 3.41Å; I66-A96 HydrophobicContact CG1-CB 4.02Å; A96-G98 VanDerWaalsContact C-N 3.3Å; A96-L138 HydrophobicContact CB-CD2 3.82Å
97	G	97.9	Very high	98.6	Very high	5 Å²	5	12.9 Å²	12.9	5%	0.052	7%	0.066	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-7.7	177.1	0	0	0	0	0	113.6	N95 D102 R358	N95-G97 PolarHBondContact O-N 3.2Å; G97-D102 WeakPolarHBondContact CA-OD2 3.31Å; G97-D102 PolarHBondContact N-OD2 2.9Å; G97-R358 PolarHBondContact O-NH1 3.07Å; G97-R358 PolarHBondContact O-NH2 3.35Å
98	G	98.4	Very high	98.6	Very high	8 Å²	8	12.8 Å²	12.8	8%	0.082	7%	0.066	C	C	.	.	S	Bend	trans	92	18.8	175.2	0	0	0	0	0	114.3	N95 A96 D102 S356	N95-G98 WeakPolarHBondContact O-CA 3.48Å; N95-G98 PolarHBondContact O-N 3.25Å; A96-G98 VanDerWaalsContact C-N 3.3Å; G98-D102 PolarHBondContact N-OD2 3.37Å; G98-S356 PolarHBondContact O-N 3.19Å
99	S	98.7	Very high	98.6	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	6%	0.061	C	C	.	.	B	Isolated β-bridge	trans	-153.9	164.4	178.6	83.4	0	0	0	0	115	E92 N95 K101 D102 P354	E92-S99 CarbonylContact O-C 3.53Å; E92-S99 VanDerWaalsContact O-C 3.24Å; N95-S99 WeakPolarHBondContact CB-O 3.41Å; N95-S99 PolarHBondContact ND2-O 2.88Å; S99-K101 PolarHBondContact O-N 2.9Å; S99-K101 VanDerWaalsContact O-N 3.12Å; S99-K101 PolarHBondContact OG-N 3.07Å; S99-K101 VanDerWaalsContact OG-N 3.15Å; S99-D102 WeakPolarHBondContact O-CB 3.37Å; S99-D102 PolarHBondContact O-N 3.4Å; S99-D102 PolarHBondContact OG-OD1 2.94Å; S99-P354 CarbonylContact C-O 3.47Å; S99-P354 VanDerWaalsContact CA-O 3.28Å; S99-P354 WeakPolarHBondContact CA-O 3.07Å
100	I	98.7	Very high	98.5	Very high	4 Å²	4	15.6 Å²	15.6	2%	0.021	8%	0.079	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-24.4	171.6	-164.1	168.2	0	0	0	113.5	E92 D102 R103 T242 I352 P354	E92-I100 HydrophobicContact CB-CB 3.6Å; E92-I100 HydrophobicContact CB-CD1 4.36Å; E92-I100 HydrophobicContact CB-CG1 3.98Å; E92-I100 HydrophobicContact CG-CB 3.97Å; E92-I100 HydrophobicContact CG-CD1 3.82Å; E92-I100 HydrophobicContact CG-CG1 3.75Å; I100-D102 PolarHBondContact O-N 2.94Å; I100-R103 PolarHBondContact O-N 3Å; I100-T242 HydrophobicContact CD1-CG2 3.46Å; I100-T242 VanDerWaalsContact CD1-CG2 3.46Å; I100-I352 HydrophobicContact CD1-CG2 3.68Å; I100-P354 HydrophobicContact CB-CB 4.47Å; I100-P354 HydrophobicContact CG2-CB 3.86Å; I100-P354 PolarHBondContact N-O 3.26Å
101	K	98.6	Very high	98.5	Very high	21 Å²	21	17 Å²	17	9%	0.091	9%	0.086	C	C	.	.	H	α-helix	trans	-71.3	-21.9	-175.5	-63.7	-63.1	-169.2	-71.9	0	112	S99 R103 I104 T105 N131 T132	S99-K101 PolarHBondContact O-N 2.9Å; S99-K101 VanDerWaalsContact O-N 3.12Å; S99-K101 PolarHBondContact OG-N 3.07Å; S99-K101 VanDerWaalsContact OG-N 3.15Å; K101-R103 PolarHBondContact O-N 3.48Å; K101-R103 VanDerWaalsContact O-N 3.1Å; K101-I104 HydrophobicContact CB-CG1 4.4Å; K101-I104 HydrophobicContact CD-CD1 3.78Å; K101-I104 HydrophobicContact CD-CG1 4.16Å; K101-I104 WeakPolarHBondContact O-CG1 3.11Å; K101-I104 PolarHBondContact O-N 3.28Å; K101-T105 WeakPolarHBondContact O-CG2 3.5Å; K101-T105 PolarHBondContact O-N 3.42Å; K101-T105 PolarHBondContact O-OG1 2.89Å; K101-N131 HydrophobicContact CB-CB 4.06Å; K101-N131 HydrophobicContact CG-CB 3.66Å; K101-T132 WeakPolarHBondContact CD-OG1 3.24Å
102	D	98.8	Very high	98.5	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-55	-34.7	177.5	-54.6	-8.1	0	0	0	111.5	I66 N95 G97 G98 S99 I100 T105 M106	I66-D102 HydrophobicContact CD1-CB 3.87Å; I66-D102 HydrophobicContact CG1-CB 3.89Å; I66-D102 HydrophobicContact CG2-CB 4.03Å; N95-D102 HydrophobicContact CB-CB 3.93Å; N95-D102 WeakPolarHBondContact CB-OD2 3.24Å; G97-D102 WeakPolarHBondContact CA-OD2 3.31Å; G97-D102 PolarHBondContact N-OD2 2.9Å; G98-D102 PolarHBondContact N-OD2 3.37Å; S99-D102 WeakPolarHBondContact O-CB 3.37Å; S99-D102 PolarHBondContact O-N 3.4Å; S99-D102 PolarHBondContact OG-OD1 2.94Å; I100-D102 PolarHBondContact O-N 2.94Å; D102-T105 VanDerWaalsContact CA-OG1 3.26Å; D102-T105 WeakPolarHBondContact CA-OG1 3.21Å; D102-T105 PolarHBondContact O-OG1 3.42Å; D102-M106 WeakPolarHBondContact O-CB 3.13Å; D102-M106 PolarHBondContact O-N 2.94Å
103	R	98.6	Very high	98.5	Very high	8 Å²	8	20 Å²	20	3%	0.03	10%	0.102	C	C	.	.	H	α-helix	trans	-61.7	-49	175.3	-62.1	-176.1	179	-94.4	1.7	112.6	I66 T69 E92 I100 K101 T105 M106 R107 A213 T217 T218 E221	I66-R103 HydrophobicContact CG2-CB 4.47Å; I66-R103 HydrophobicContact CG2-CG 4.04Å; T69-R103 PolarHBondContact OG1-NH2 3.06Å; E92-R103 IonicContact OE1-CZ 3.48Å; E92-R103 IonicContact OE1-NE 3.64Å; E92-R103 PolarHBondContact OE1-NE 2.84Å; E92-R103 IonicContact OE1-NH2 3.64Å; E92-R103 PolarHBondContact OE1-NH2 2.79Å; E92-R103 IonicContact OE2-CZ 2.74Å; E92-R103 IonicContact OE2-NE 2.76Å; E92-R103 PolarHBondContact OE2-NE 3.42Å; E92-R103 IonicContact OE2-NH2 3.31Å; E92-R103 PolarHBondContact OE2-NH2 2.86Å; I100-R103 PolarHBondContact O-N 3Å; K101-R103 PolarHBondContact O-N 3.48Å; K101-R103 VanDerWaalsContact O-N 3.1Å; R103-T105 VanDerWaalsContact C-N 3.32Å; R103-M106 PolarHBondContact O-N 3.27Å; R103-R107 WeakPolarHBondContact O-CB 3.35Å; R103-R107 PolarHBondContact O-N 2.9Å; R103-R107 VanDerWaalsContact O-N 3.08Å; R103-A213 HydrophobicContact CB-CB 4.32Å; R103-T217 PolarHBondContact NH1-OG1 3.24Å; R103-T218 WeakPolarHBondContact CD-OG1 3.36Å; R103-T218 PolarHBondContact NE-OG1 2.97Å; R103-E221 IonicContact CZ-OE1 2.67Å; R103-E221 IonicContact CZ-OE2 2.79Å; R103-E221 IonicContact NH1-OE1 3.54Å; R103-E221 PolarHBondContact NH1-OE1 3.15Å; R103-E221 IonicContact NH1-OE2 3.75Å; R103-E221 IonicContact NH2-OE1 3.97Å; R103-E221 PolarHBondContact NH2-OE1 2.92Å; R103-E221 IonicContact NH2-OE2 3.92Å; R103-E221 PolarHBondContact NH2-OE2 3.36Å
104	I	98.5	Very high	98.4	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-72.1	-34.2	-176.6	73.8	161.7	0	0	0	110.4	K101 R107 M108 T132 Q204 N210 A213 H214	K101-I104 HydrophobicContact CB-CG1 4.4Å; K101-I104 HydrophobicContact CD-CD1 3.78Å; K101-I104 HydrophobicContact CD-CG1 4.16Å; K101-I104 WeakPolarHBondContact O-CG1 3.11Å; K101-I104 PolarHBondContact O-N 3.28Å; I104-R107 PolarHBondContact O-N 2.85Å; I104-M108 HydrophobicContact CD1-CE 4.25Å; I104-M108 HydrophobicContact CG1-CE 4.23Å; I104-M108 VanDerWaalsContact O-CB 3.3Å; I104-M108 WeakPolarHBondContact O-CB 3.27Å; I104-M108 WeakPolarHBondContact O-CG 3.39Å; I104-M108 PolarHBondContact O-N 2.95Å; I104-T132 HydrophobicContact CD1-CG2 3.99Å; I104-T132 HydrophobicContact CG1-CG2 4.37Å; I104-Q204 HydrophobicContact CD1-CB 4.07Å; I104-N210 HydrophobicContact CB-CB 4.25Å; I104-N210 HydrophobicContact CD1-CB 4.27Å; I104-N210 HydrophobicContact CG2-CB 4.28Å; I104-N210 WeakPolarHBondContact CG2-OD1 3.38Å; I104-A213 HydrophobicContact CG2-CB 4.17Å; I104-H214 VanDerWaalsContact CG2-NE2 3.28Å; I104-H214 WeakPolarHBondContact CG2-NE2 3.46Å
105	T	98.6	Very high	98.3	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-69.2	-38.6	179.1	54.8	0	0	0	0	110.9	K101 D102 R103 M108 V109 T132 G135 L136 I139	K101-T105 WeakPolarHBondContact O-CG2 3.5Å; K101-T105 PolarHBondContact O-N 3.42Å; K101-T105 PolarHBondContact O-OG1 2.89Å; D102-T105 VanDerWaalsContact CA-OG1 3.26Å; D102-T105 WeakPolarHBondContact CA-OG1 3.21Å; D102-T105 PolarHBondContact O-OG1 3.42Å; R103-T105 VanDerWaalsContact C-N 3.32Å; T105-M108 HydrophobicContact CG2-CE 4.38Å; T105-V109 WeakPolarHBondContact O-CB 3.44Å; T105-V109 VanDerWaalsContact O-CG2 3.29Å; T105-V109 WeakPolarHBondContact O-CG2 3.27Å; T105-V109 PolarHBondContact O-N 3.29Å; T105-V109 VanDerWaalsContact O-N 3.17Å; T105-T132 HydrophobicContact CG2-CG2 3.62Å; T105-T132 VanDerWaalsContact CG2-O 3.27Å; T105-T132 WeakPolarHBondContact CG2-O 3.3Å; T105-G135 WeakPolarHBondContact OG1-CA 3.28Å; T105-L136 HydrophobicContact CG2-CD2 3.97Å; T105-L136 HydrophobicContact CG2-CG 3.64Å; T105-I139 WeakPolarHBondContact O-CD1 3.47Å; T105-I139 WeakPolarHBondContact OG1-CD1 3.47Å
106	M	98.1	Very high	98.2	Very high	22 Å²	22	26.2 Å²	26.2	11%	0.108	16%	0.156	C	C	.	.	H	α-helix	trans	-59.6	-56	171.9	-176.2	71.4	78.5	0	0	110.1	L63 I66 D102 R103 M108 V109 E110 I139	L63-M106 HydrophobicContact CB-CE 3.45Å; L63-M106 VanDerWaalsContact CB-CE 3.45Å; L63-M106 HydrophobicContact CD1-CE 4.34Å; L63-M106 HydrophobicContact CD2-CE 4.36Å; L63-M106 HydrophobicContact CG-CE 4.25Å; L63-M106 VanDerWaalsContact O-CE 3.28Å; L63-M106 WeakPolarHBondContact O-CE 3.32Å; I66-M106 HydrophobicContact CB-CE 4.36Å; I66-M106 HydrophobicContact CD1-CE 3.61Å; I66-M106 HydrophobicContact CG1-CE 4.45Å; D102-M106 WeakPolarHBondContact O-CB 3.13Å; D102-M106 PolarHBondContact O-N 2.94Å; R103-M106 PolarHBondContact O-N 3.27Å; M106-M108 PolarHBondContact O-N 2.82Å; M106-V109 PolarHBondContact O-N 3.28Å; M106-V109 VanDerWaalsContact O-N 3.15Å; M106-E110 HydrophobicContact CG-CG 4.17Å; M106-E110 WeakPolarHBondContact O-CG 3.26Å; M106-E110 PolarHBondContact O-N 2.62Å; M106-E110 HydrophobicContact SD-CG 4.18Å; M106-I139 HydrophobicContact CB-CD1 4.3Å; M106-I139 VanDerWaalsContact N-CD1 3.27Å
107	R	98.5	Very high	98.2	Very high	10 Å²	10	29.2 Å²	29.2	4%	0.038	17%	0.166	C	C	.	.	H	α-helix	trans	-61.7	-41.6	-174.4	-176.2	54.9	-177.9	-81.6	-0.6	112.8	S48 R103 I104 D111 S209 A213 D216	S48-R107 PolarHBondContact O-NH2 2.83Å; S48-R107 PolarHBondContact OG-NH2 3.02Å; R103-R107 WeakPolarHBondContact O-CB 3.35Å; R103-R107 PolarHBondContact O-N 2.9Å; R103-R107 VanDerWaalsContact O-N 3.08Å; I104-R107 PolarHBondContact O-N 2.85Å; R107-D111 WeakPolarHBondContact CD-OD2 3.25Å; R107-D111 IonicContact CZ-OD1 2.87Å; R107-D111 IonicContact CZ-OD2 3.62Å; R107-D111 VanDerWaalsContact NE-CG 3.31Å; R107-D111 IonicContact NE-OD1 3.61Å; R107-D111 PolarHBondContact NE-OD1 3.49Å; R107-D111 VanDerWaalsContact NE-OD1 3.08Å; R107-D111 IonicContact NE-OD2 3.2Å; R107-D111 PolarHBondContact NE-OD2 3.37Å; R107-D111 IonicContact NH2-OD2 3.76Å; R107-D111 WeakPolarHBondContact O-CB 3.18Å; R107-D111 VanDerWaalsContact O-CG 3.31Å; R107-D111 PolarHBondContact O-N 3.19Å; R107-S209 VanDerWaalsContact CG-O 3.31Å; R107-S209 WeakPolarHBondContact CG-O 3.21Å; R107-A213 HydrophobicContact CB-CB 3.78Å; R107-A213 HydrophobicContact CG-CB 4.09Å; R107-D216 IonicContact CZ-OD2 2.82Å; R107-D216 IonicContact NH1-OD2 3.08Å; R107-D216 PolarHBondContact NH1-OD2 3.42Å; R107-D216 IonicContact NH2-OD2 2.81Å; R107-D216 PolarHBondContact NH2-OD2 3Å
108	M	98.7	Very high	98.2	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-63.4	-40	176.7	-74.8	-173.6	-53.8	0	0	112.3	I104 T105 M106 A112 T132 L202 Q204 N207	I104-M108 HydrophobicContact CD1-CE 4.25Å; I104-M108 HydrophobicContact CG1-CE 4.23Å; I104-M108 VanDerWaalsContact O-CB 3.3Å; I104-M108 WeakPolarHBondContact O-CB 3.27Å; I104-M108 WeakPolarHBondContact O-CG 3.39Å; I104-M108 PolarHBondContact O-N 2.95Å; T105-M108 HydrophobicContact CG2-CE 4.38Å; M106-M108 PolarHBondContact O-N 2.82Å; M108-A112 WeakPolarHBondContact O-CB 3.42Å; M108-A112 PolarHBondContact O-N 3.2Å; M108-A112 VanDerWaalsContact O-N 3.17Å; M108-T132 HydrophobicContact CE-CG2 4.08Å; M108-L202 HydrophobicContact CB-CB 4.31Å; M108-L202 HydrophobicContact CB-CD1 3.99Å; M108-L202 HydrophobicContact CE-CB 4.43Å; M108-L202 HydrophobicContact SD-CB 4.1Å; M108-Q204 HydrophobicContact CE-CB 4.44Å; M108-Q204 HydrophobicContact SD-CB 4.36Å; M108-N207 HydrophobicContact CG-CB 4.43Å; M108-N207 HydrophobicContact SD-CB 4.12Å
109	V	98.5	Very high	98.1	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-70.8	-46.4	178.4	169.5	0	0	0	0	110.7	T105 M106 A112 E113 L118 I124 L136 I139 K143 Y145 L202	T105-V109 WeakPolarHBondContact O-CB 3.44Å; T105-V109 VanDerWaalsContact O-CG2 3.29Å; T105-V109 WeakPolarHBondContact O-CG2 3.27Å; T105-V109 PolarHBondContact O-N 3.29Å; T105-V109 VanDerWaalsContact O-N 3.17Å; M106-V109 PolarHBondContact O-N 3.28Å; M106-V109 VanDerWaalsContact O-N 3.15Å; V109-A112 PolarHBondContact O-N 3.18Å; V109-E113 HydrophobicContact CG1-CG 4.25Å; V109-E113 WeakPolarHBondContact O-CB 3.39Å; V109-E113 VanDerWaalsContact O-CG 3.29Å; V109-E113 WeakPolarHBondContact O-CG 3.21Å; V109-E113 PolarHBondContact O-N 3.19Å; V109-L118 HydrophobicContact CG1-CD2 3.94Å; V109-I124 HydrophobicContact CG2-CD1 4.08Å; V109-L136 HydrophobicContact CG2-CD2 3.82Å; V109-I139 HydrophobicContact CB-CG2 4.2Å; V109-I139 HydrophobicContact CG1-CG2 3.86Å; V109-I139 HydrophobicContact CG2-CG2 4.06Å; V109-K143 HydrophobicContact CG1-CD 4.2Å; V109-Y145 HydrophobicContact CG1-CE2 4.07Å; V109-L202 HydrophobicContact CG2-CD1 3.81Å
110	E	97.6	Very high	98	Very high	83 Å²	83	42.8 Å²	42.8	39%	0.388	23%	0.23	S	C	.	.	H	α-helix	trans	-61.9	-47.2	179.4	-71.5	177.7	154.7	0	0	112.2	M106 A112 E113 E114	M106-E110 HydrophobicContact CG-CG 4.17Å; M106-E110 WeakPolarHBondContact O-CG 3.26Å; M106-E110 PolarHBondContact O-N 2.62Å; M106-E110 HydrophobicContact SD-CG 4.18Å; E110-A112 VanDerWaalsContact C-N 3.28Å; E110-A112 PolarHBondContact O-N 3.25Å; E110-E113 PolarHBondContact O-N 2.98Å; E110-E114 WeakPolarHBondContact O-CB 3.27Å; E110-E114 PolarHBondContact O-N 3.29Å
111	D	98.4	Very high	97.9	Very high	28 Å²	28	45.2 Å²	45.2	15%	0.15	26%	0.256	C	S	.	.	H	α-helix	trans	-63.2	-35.7	177.2	-72.3	-27.8	0	0	0	111.1	S48 R107 A115 S209	S48-D111 PolarHBondContact OG-OD1 3.42Å; R107-D111 WeakPolarHBondContact CD-OD2 3.25Å; R107-D111 IonicContact CZ-OD1 2.87Å; R107-D111 IonicContact CZ-OD2 3.62Å; R107-D111 VanDerWaalsContact NE-CG 3.31Å; R107-D111 IonicContact NE-OD1 3.61Å; R107-D111 PolarHBondContact NE-OD1 3.49Å; R107-D111 VanDerWaalsContact NE-OD1 3.08Å; R107-D111 IonicContact NE-OD2 3.2Å; R107-D111 PolarHBondContact NE-OD2 3.37Å; R107-D111 IonicContact NH2-OD2 3.76Å; R107-D111 WeakPolarHBondContact O-CB 3.18Å; R107-D111 VanDerWaalsContact O-CG 3.31Å; R107-D111 PolarHBondContact O-N 3.19Å; D111-A115 VanDerWaalsContact O-CB 3.24Å; D111-A115 WeakPolarHBondContact O-CB 3.22Å; D111-A115 PolarHBondContact O-N 2.94Å; D111-S209 WeakPolarHBondContact OD2-CB 3.47Å; D111-S209 PolarHBondContact OD2-OG 3.46Å
112	A	98.3	Very high	97.9	Very high	7 Å²	7	44.9 Å²	44.9	6%	0.058	26%	0.255	C	S	.	.	H	α-helix	trans	-72.7	-35.7	177.8	0	0	0	0	0	113	M108 V109 E110 G116 I117 L118 L202	M108-A112 WeakPolarHBondContact O-CB 3.42Å; M108-A112 PolarHBondContact O-N 3.2Å; M108-A112 VanDerWaalsContact O-N 3.17Å; V109-A112 PolarHBondContact O-N 3.18Å; E110-A112 VanDerWaalsContact C-N 3.28Å; E110-A112 PolarHBondContact O-N 3.25Å; A112-G116 PolarHBondContact O-N 2.57Å; A112-I117 HydrophobicContact CB-CB 4.38Å; A112-I117 PolarHBondContact O-N 2.78Å; A112-L118 HydrophobicContact CB-CB 3.96Å; A112-L118 PolarHBondContact O-N 3.02Å; A112-L202 HydrophobicContact CB-CD2 4.02Å
113	E	98.1	Very high	97.9	Very high	57 Å²	57	45.4 Å²	45.4	27%	0.266	26%	0.258	S	S	.	.	H	α-helix	trans	-65.2	-47.7	172.2	-75	172.7	167.4	0	0	110.7	V109 E110 A115 G116 L118 K143 Y145	V109-E113 HydrophobicContact CG1-CG 4.25Å; V109-E113 WeakPolarHBondContact O-CB 3.39Å; V109-E113 VanDerWaalsContact O-CG 3.29Å; V109-E113 WeakPolarHBondContact O-CG 3.21Å; V109-E113 PolarHBondContact O-N 3.19Å; E110-E113 PolarHBondContact O-N 2.98Å; E113-A115 VanDerWaalsContact C-N 3.32Å; E113-A115 PolarHBondContact O-N 3.27Å; E113-G116 PolarHBondContact O-N 3.24Å; E113-L118 HydrophobicContact CG-CB 4.4Å; E113-L118 HydrophobicContact CG-CD2 4.26Å; E113-K143 VanDerWaalsContact CD-NZ 3.31Å; E113-K143 WeakPolarHBondContact OE1-CD 3.47Å; E113-K143 IonicContact OE1-NZ 2.93Å; E113-K143 PolarHBondContact OE1-NZ 3.34Å; E113-K143 VanDerWaalsContact OE1-NZ 3.11Å; E113-K143 IonicContact OE2-NZ 2.67Å; E113-K143 PolarHBondContact OE2-NZ 2.96Å; E113-Y145 WeakPolarHBondContact CG-OH 3.33Å; E113-Y145 WeakPolarHBondContact OE1-CE2 3.3Å; E113-Y145 PolarHBondContact OE1-OH 2.87Å
114	E	97.3	Very high	97.9	Very high	156 Å²	156	45 Å²	45	73%	0.729	26%	0.257	S	S	*	.	H	α-helix	trans	-62.4	-39.2	178.7	-174.4	175.6	-170.3	0	0	111.8	E110 G116	E110-E114 WeakPolarHBondContact O-CB 3.27Å; E110-E114 PolarHBondContact O-N 3.29Å; E114-G116 PolarHBondContact O-N 3.47Å
115	A	97.1	Very high	97.9	Very high	68 Å²	68	45 Å²	45	56%	0.562	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-5.1	175	0	0	0	0	0	113.9	D111 E113 I117	D111-A115 VanDerWaalsContact O-CB 3.24Å; D111-A115 WeakPolarHBondContact O-CB 3.22Å; D111-A115 PolarHBondContact O-N 2.94Å; E113-A115 VanDerWaalsContact C-N 3.32Å; E113-A115 PolarHBondContact O-N 3.27Å; A115-I117 HydrophobicContact CB-CD1 3.89Å; A115-I117 HydrophobicContact CB-CG1 3.94Å; A115-I117 PolarHBondContact O-N 2.86Å
116	G	97.3	Very high	97.9	Very high	41 Å²	41	45 Å²	45	42%	0.423	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.4	14.5	-176.2	0	0	0	0	0	114.4	A112 E113 E114	A112-G116 PolarHBondContact O-N 2.57Å; E113-G116 PolarHBondContact O-N 3.24Å; E114-G116 PolarHBondContact O-N 3.47Å
117	I	97.3	Very high	97.7	Very high	95 Å²	95	44 Å²	44	49%	0.487	25%	0.252	S	S	.	.	S	Bend	trans	-71.7	-47.7	175.5	-64.7	170.9	0	0	0	108.8	A112 A115 H200	A112-I117 HydrophobicContact CB-CB 4.38Å; A112-I117 PolarHBondContact O-N 2.78Å; A115-I117 HydrophobicContact CB-CD1 3.89Å; A115-I117 HydrophobicContact CB-CG1 3.94Å; A115-I117 PolarHBondContact O-N 2.86Å; I117-H200 PolarHBondContact O-CE1 2.9Å; I117-H200 PolarHBondContact O-NE2 3.34Å; I117-H200 VanDerWaalsContact O-NE2 3.15Å
118	L	98	Very high	97.2	Very high	6 Å²	6	43.5 Å²	43.5	3%	0.031	25%	0.25	C	S	.	.	S	Bend	trans	-98.9	128.1	180	-167.6	68.9	0	0	0	110.4	V109 A112 E113 D122 I124 Y145 H200	V109-L118 HydrophobicContact CG1-CD2 3.94Å; A112-L118 HydrophobicContact CB-CB 3.96Å; A112-L118 PolarHBondContact O-N 3.02Å; E113-L118 HydrophobicContact CG-CB 4.4Å; E113-L118 HydrophobicContact CG-CD2 4.26Å; L118-D122 HydrophobicContact CD1-CB 3.71Å; L118-I124 HydrophobicContact CD1-CG1 4.03Å; L118-I124 HydrophobicContact CD2-CD1 4.05Å; L118-I124 HydrophobicContact CD2-CG1 4.35Å; L118-Y145 HydrophobicContact CD1-CD1 4.37Å; L118-Y145 HydrophobicContact CD1-CE1 4.22Å; L118-Y145 HydrophobicContact CD2-CD1 4.36Å; L118-Y145 HydrophobicContact CD2-CD2 4.23Å; L118-Y145 HydrophobicContact CD2-CE1 3.84Å; L118-Y145 HydrophobicContact CD2-CE2 3.68Å; L118-Y145 VanDerWaalsContact CD2-CZ 3.48Å; L118-Y145 HydrophobicContact CG-CD1 4.31Å; L118-Y145 HydrophobicContact CG-CE1 3.7Å; L118-Y145 HydrophobicContact CG-CE2 4.45Å; L118-H200 VanDerWaalsContact CD1-CD2 3.47Å; L118-H200 WeakPolarHBondContact CD1-CD2 3.27Å
119	R	97.7	Very high	95.9	Very high	167 Å²	167	44.1 Å²	44.1	63%	0.63	25%	0.254	S	S	*	.			trans	-120.5	153.2	-179.3	-60.3	179.7	-177.6	-169.4	0	111.6	G121 D122 Y145	R119-G121 PolarHBondContact O-N 2.8Å; R119-D122 PolarHBondContact N-OD2 3.14Å; R119-D122 WeakPolarHBondContact O-CB 3.03Å; R119-D122 PolarHBondContact O-N 3.26Å; R119-Y145 VanDerWaalsContact O-CE1 3.29Å; R119-Y145 WeakPolarHBondContact O-CE1 3.47Å
120	P	96.5	Very high	95.1	Very high	125 Å²	125	44.1 Å²	44.1	81%	0.812	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.6	127.8	179.3	-27.9	35.2	0	0	0	112.7
121	G	95.7	Very high	95.1	Very high	55 Å²	55	40.7 Å²	40.7	57%	0.567	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	85.3	-3	-177.9	0	0	0	0	0	115.6	R119	R119-G121 PolarHBondContact O-N 2.8Å
122	D	98.6	Very high	95.1	Very high	15 Å²	15	39.4 Å²	39.4	8%	0.08	23%	0.232	C	C	.	.	P	Polyproline II helix	trans	-61.9	164.7	173	-77	1.8	0	0	0	112.2	L118 R119 Y145 R146 N198 H200	L118-D122 HydrophobicContact CD1-CB 3.71Å; R119-D122 PolarHBondContact N-OD2 3.14Å; R119-D122 WeakPolarHBondContact O-CB 3.03Å; R119-D122 PolarHBondContact O-N 3.26Å; D122-Y145 HydrophobicContact CB-CD1 4.47Å; D122-R146 PolarHBondContact O-N 2.9Å; D122-R146 VanDerWaalsContact O-N 3.12Å; D122-N198 WeakPolarHBondContact CB-O 3.26Å; D122-H200 IonicContact OD2-CD2 3.11Å; D122-H200 IonicContact OD2-CE1 2.67Å; D122-H200 IonicContact OD2-NE2 3.57Å; D122-H200 PolarHBondContact OD2-NE2 3.22Å
123	T	98.8	Very high	95	Very high	10 Å²	10	39 Å²	39	6%	0.061	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	126.7	178.2	-56.3	0	0	0	0	111.5	I125 R146 I148 I196 N198 S199 H200	T123-I125 HydrophobicContact CG2-CG1 4.07Å; T123-R146 CarbonylContact C-O 3.58Å; T123-R146 WeakPolarHBondContact CA-O 3.19Å; T123-R146 HydrophobicContact CG2-CB 4.14Å; T123-R146 HydrophobicContact CG2-CG 4.05Å; T123-I148 HydrophobicContact CG2-CD1 3.79Å; T123-I148 HydrophobicContact CG2-CG1 3.97Å; T123-I196 HydrophobicContact CG2-CG2 4.39Å; T123-N198 PolarHBondContact N-O 3.45Å; T123-S199 CarbonylContact O-C 3.55Å; T123-S199 WeakPolarHBondContact O-CA 3.39Å; T123-H200 PolarHBondContact O-N 3.09Å
124	I	98.7	Very high	95	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	126.2	171.4	-59.1	172.8	0	0	0	108.7	V109 L118 L136 Y145 R146 C147 I148 L202	V109-I124 HydrophobicContact CG2-CD1 4.08Å; L118-I124 HydrophobicContact CD1-CG1 4.03Å; L118-I124 HydrophobicContact CD2-CD1 4.05Å; L118-I124 HydrophobicContact CD2-CG1 4.35Å; I124-L136 HydrophobicContact CG2-CD1 4.02Å; I124-L136 HydrophobicContact CG2-CD2 4.28Å; I124-L136 HydrophobicContact CG2-CG 4.5Å; I124-Y145 HydrophobicContact CD1-CD2 3.84Å; I124-Y145 HydrophobicContact CD1-CG 4Å; I124-Y145 HydrophobicContact CG1-CG 4.45Å; I124-R146 PolarHBondContact N-O 2.88Å; I124-C147 WeakPolarHBondContact O-CA 3.01Å; I124-I148 PolarHBondContact O-N 3.41Å; I124-L202 HydrophobicContact CG2-CD1 4.13Å; I124-L202 HydrophobicContact CG2-CG 4.36Å
125	I	98.3	Very high	95.1	Very high	0 Å²	0	29 Å²	29	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	126.1	176.3	-52.4	176.4	0	0	0	107.9	T123 I148 V150 A189 L192 K193 I196 H200 V201	T123-I125 HydrophobicContact CG2-CG1 4.07Å; I125-I148 VanDerWaalsContact CA-O 3.28Å; I125-I148 WeakPolarHBondContact CA-O 3.29Å; I125-I148 HydrophobicContact CG1-CB 4.25Å; I125-I148 HydrophobicContact CG1-CD1 4.36Å; I125-V150 HydrophobicContact CG2-CG2 4.18Å; I125-A189 HydrophobicContact CG2-CB 3.98Å; I125-L192 HydrophobicContact CD1-CB 3.98Å; I125-L192 HydrophobicContact CG2-CB 4.4Å; I125-K193 HydrophobicContact CD1-CB 4.24Å; I125-I196 HydrophobicContact CD1-CD1 4.11Å; I125-H200 PolarHBondContact N-O 2.81Å; I125-V201 HydrophobicContact CB-CG2 3.98Å; I125-V201 HydrophobicContact CG2-CG2 4.23Å; I125-V201 VanDerWaalsContact O-CA 3.24Å; I125-V201 WeakPolarHBondContact O-CA 3.37Å; I125-V201 WeakPolarHBondContact O-CG2 3.16Å
126	E	97.9	Very high	95.2	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	128	-179.8	-168.4	69.9	-171.1	0	0	113.3	T132 L136 I148 I149 V150 L202 D203 Q204	E126-T132 HydrophobicContact CG-CG2 4.32Å; E126-L136 HydrophobicContact CB-CD1 3.41Å; E126-L136 VanDerWaalsContact CB-CD1 3.41Å; E126-L136 HydrophobicContact CG-CD1 3.54Å; E126-I148 PolarHBondContact N-O 3.07Å; E126-I148 VanDerWaalsContact N-O 3.07Å; E126-I149 HydrophobicContact CB-CD1 4.3Å; E126-V150 PolarHBondContact O-N 3.15Å; E126-L202 PolarHBondContact OE2-N 3.42Å; E126-D203 PolarHBondContact OE1-N 3.17Å; E126-D203 PolarHBondContact OE2-N 2.81Å; E126-Q204 WeakPolarHBondContact OE1-CB 3.49Å; E126-Q204 WeakPolarHBondContact OE1-CG 3.42Å; E126-Q204 PolarHBondContact OE1-N 2.91Å
127	P	93.9	Very high	95.2	Very high	1 Å²	1	23.9 Å²	23.9	1%	0.006	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	115.8	168	30.9	-31.3	0	0	0	110.6	V150 H185 I186 A189 Q204 Y205	P127-V150 WeakPolarHBondContact CA-O 3.46Å; P127-H185 WeakPolarHBondContact CB-O 3.17Å; P127-I186 HydrophobicContact CB-CB 4.48Å; P127-I186 HydrophobicContact CB-CG1 4.04Å; P127-I186 HydrophobicContact CG-CG1 4.37Å; P127-A189 HydrophobicContact CB-CB 3.96Å; P127-A189 HydrophobicContact CG-CB 4.02Å; P127-Q204 PolarHBondContact O-NE2 3.15Å; P127-Y205 HydrophobicContact CG-CE2 4.13Å
128	T	88.7	Confident	95.3	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	12%	0.118	C	C	.	.			trans	-151.5	153.6	-173.3	-173.6	0	0	0	0	115.4	G130 T132 I149 V150 M151 Q204	T128-G130 PolarHBondContact O-N 3.42Å; T128-G130 PolarHBondContact OG1-N 3.36Å; T128-G130 VanDerWaalsContact OG1-N 3.15Å; T128-T132 WeakPolarHBondContact OG1-CB 3.36Å; T128-I149 HydrophobicContact CG2-CG2 3.52Å; T128-V150 PolarHBondContact N-O 3.17Å; T128-M151 VanDerWaalsContact O-CB 3.28Å; T128-M151 WeakPolarHBondContact O-CB 3.34Å; T128-Q204 PolarHBondContact OG1-NE2 2.86Å
129	S	71.3	Confident	95.3	Very high	13 Å²	13	20.1 Å²	20.1	9%	0.091	12%	0.116	C	C	.	.	S	Bend	trans	-78.8	5.6	168.3	54.5	0	0	0	0	113.6	K159	S129-K159 PolarHBondContact O-NZ 3.02Å
130	G	82.9	Confident	95.4	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	9%	0.087	C	C	.	.	S	Bend	trans	124.9	-50.8	162.7	0	0	0	0	0	114.5	T128 T132 G133 I134	T128-G130 PolarHBondContact O-N 3.42Å; T128-G130 PolarHBondContact OG1-N 3.36Å; T128-G130 VanDerWaalsContact OG1-N 3.15Å; G130-T132 PolarHBondContact O-N 3.08Å; G130-G133 CarbonylContact O-C 3.6Å; G130-G133 VanDerWaalsContact O-CA 3.32Å; G130-G133 WeakPolarHBondContact O-CA 3.12Å; G130-G133 PolarHBondContact O-N 3Å; G130-I134 PolarHBondContact O-N 2.98Å
131	N	96.7	Very high	95.5	Very high	10 Å²	10	9.2 Å²	9.2	5%	0.053	7%	0.073	C	C	.	.	H	α-helix	trans	-64.2	-40.2	-173.9	-78.2	-24.9	0	0	0	113.1	K101 G133 I134 G135 D355 N359	K101-N131 HydrophobicContact CB-CB 4.06Å; K101-N131 HydrophobicContact CG-CB 3.66Å; N131-G133 PolarHBondContact O-N 2.99Å; N131-I134 PolarHBondContact O-N 3.1Å; N131-G135 PolarHBondContact O-N 3.41Å; N131-D355 WeakPolarHBondContact ND2-CB 3.36Å; N131-D355 PolarHBondContact ND2-OD2 3.42Å; N131-N359 PolarHBondContact OD1-ND2 3.48Å
132	T	97.8	Very high	95.6	Very high	1 Å²	1	9.4 Å²	9.4	1%	0.006	6%	0.063	C	C	.	.	H	α-helix	trans	-63.7	-34.8	171.7	-42.9	0	0	0	0	111	K101 I104 T105 M108 E126 T128 G130 G135 L136 Q204	K101-T132 WeakPolarHBondContact CD-OG1 3.24Å; I104-T132 HydrophobicContact CD1-CG2 3.99Å; I104-T132 HydrophobicContact CG1-CG2 4.37Å; T105-T132 HydrophobicContact CG2-CG2 3.62Å; T105-T132 VanDerWaalsContact CG2-O 3.27Å; T105-T132 WeakPolarHBondContact CG2-O 3.3Å; M108-T132 HydrophobicContact CE-CG2 4.08Å; E126-T132 HydrophobicContact CG-CG2 4.32Å; T128-T132 WeakPolarHBondContact OG1-CB 3.36Å; G130-T132 PolarHBondContact O-N 3.08Å; T132-G135 PolarHBondContact O-N 2.87Å; T132-L136 HydrophobicContact CG2-CD1 4.33Å; T132-L136 WeakPolarHBondContact O-CG 3.38Å; T132-L136 PolarHBondContact O-N 2.81Å; T132-Q204 HydrophobicContact CG2-CB 4.38Å; T132-Q204 PolarHBondContact OG1-OE1 3.2Å
133	G	97.2	Very high	95.6	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-64.4	-43	174.1	0	0	0	0	0	112.3	G130 N131 L136 A137 I149 L163	G130-G133 CarbonylContact O-C 3.6Å; G130-G133 VanDerWaalsContact O-CA 3.32Å; G130-G133 WeakPolarHBondContact O-CA 3.12Å; G130-G133 PolarHBondContact O-N 3Å; N131-G133 PolarHBondContact O-N 2.99Å; G133-L136 PolarHBondContact O-N 3.21Å; G133-A137 VanDerWaalsContact O-CB 3.24Å; G133-A137 WeakPolarHBondContact O-CB 3.15Å; G133-A137 PolarHBondContact O-N 3.45Å; G133-I149 VanDerWaalsContact CA-CD1 3.44Å; G133-L163 WeakPolarHBondContact O-CD2 3.32Å
134	I	98.4	Very high	95.5	Very high	2 Å²	2	14.1 Å²	14.1	1%	0.01	10%	0.096	C	C	.	.	H	α-helix	trans	-62.8	-44.9	177.3	-67.9	171	0	0	0	110.7	G130 N131 A137 L138 K159 V162 L163 L166	G130-I134 PolarHBondContact O-N 2.98Å; N131-I134 PolarHBondContact O-N 3.1Å; I134-A137 PolarHBondContact O-N 2.86Å; I134-L138 WeakPolarHBondContact O-CB 3.29Å; I134-L138 PolarHBondContact O-N 2.6Å; I134-K159 HydrophobicContact CD1-CG 4.23Å; I134-V162 HydrophobicContact CD1-CB 4.34Å; I134-V162 HydrophobicContact CD1-CG1 4.03Å; I134-V162 HydrophobicContact CG1-CG1 4.03Å; I134-V162 HydrophobicContact CG2-CG1 3.93Å; I134-L163 HydrophobicContact CG1-CD2 3.99Å; I134-L163 HydrophobicContact CG1-CG 4.03Å; I134-L166 HydrophobicContact CG2-CD1 4.13Å
135	G	98.6	Very high	95.5	Very high	1 Å²	1	15.2 Å²	15.2	1%	0.01	10%	0.1	C	C	.	.	H	α-helix	trans	-61.3	-44.3	176.7	0	0	0	0	0	112.8	T105 N131 T132 L138 I139	T105-G135 WeakPolarHBondContact OG1-CA 3.28Å; N131-G135 PolarHBondContact O-N 3.41Å; T132-G135 PolarHBondContact O-N 2.87Å; G135-L138 PolarHBondContact O-N 3.39Å; G135-I139 WeakPolarHBondContact O-CD1 3.39Å; G135-I139 WeakPolarHBondContact O-CG1 3.45Å; G135-I139 PolarHBondContact O-N 3.47Å
136	L	98.6	Very high	95.6	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-67.1	-41.1	176.2	-71.5	172.3	0	0	0	112.3	T105 V109 I124 E126 T132 G133 L138 I139 A140 L202	T105-L136 HydrophobicContact CG2-CD2 3.97Å; T105-L136 HydrophobicContact CG2-CG 3.64Å; V109-L136 HydrophobicContact CG2-CD2 3.82Å; I124-L136 HydrophobicContact CG2-CD1 4.02Å; I124-L136 HydrophobicContact CG2-CD2 4.28Å; I124-L136 HydrophobicContact CG2-CG 4.5Å; E126-L136 HydrophobicContact CB-CD1 3.41Å; E126-L136 VanDerWaalsContact CB-CD1 3.41Å; E126-L136 HydrophobicContact CG-CD1 3.54Å; T132-L136 HydrophobicContact CG2-CD1 4.33Å; T132-L136 WeakPolarHBondContact O-CG 3.38Å; T132-L136 PolarHBondContact O-N 2.81Å; G133-L136 PolarHBondContact O-N 3.21Å; L136-L138 VanDerWaalsContact C-N 3.33Å; L136-L138 PolarHBondContact O-N 2.7Å; L136-I139 PolarHBondContact O-N 3.32Å; L136-A140 WeakPolarHBondContact O-CB 3.47Å; L136-A140 PolarHBondContact O-N 2.85Å; L136-L202 HydrophobicContact CD2-CD1 3.7Å
137	A	98.6	Very high	95.6	Very high	1 Å²	1	20.6 Å²	20.6	1%	0.008	12%	0.121	C	C	.	.	H	α-helix	trans	-63.1	-40.1	176.3	0	0	0	0	0	111.5	G133 I134 A140 A141 L163 L166 A168	G133-A137 VanDerWaalsContact O-CB 3.24Å; G133-A137 WeakPolarHBondContact O-CB 3.15Å; G133-A137 PolarHBondContact O-N 3.45Å; I134-A137 PolarHBondContact O-N 2.86Å; A137-A140 PolarHBondContact O-N 3.01Å; A137-A141 WeakPolarHBondContact O-CB 3.47Å; A137-A141 PolarHBondContact O-N 2.76Å; A137-L163 HydrophobicContact CB-CD2 3.7Å; A137-L166 HydrophobicContact CB-CB 3.9Å; A137-L166 HydrophobicContact CB-CD1 3.93Å; A137-A168 HydrophobicContact CB-CB 3.83Å
138	L	98.8	Very high	95.8	Very high	21 Å²	21	20.7 Å²	20.7	11%	0.11	12%	0.122	C	C	.	.	H	α-helix	trans	-61.5	-47.6	174.5	179.5	69.6	0	0	0	111.4	I62 L63 A96 I134 G135 L136 A141 V142 L166	I62-L138 HydrophobicContact CG2-CD1 4.15Å; L63-L138 HydrophobicContact CD2-CD2 4.34Å; L63-L138 HydrophobicContact CD2-CG 4.2Å; A96-L138 HydrophobicContact CB-CD2 3.82Å; I134-L138 WeakPolarHBondContact O-CB 3.29Å; I134-L138 PolarHBondContact O-N 2.6Å; G135-L138 PolarHBondContact O-N 3.39Å; L136-L138 VanDerWaalsContact C-N 3.33Å; L136-L138 PolarHBondContact O-N 2.7Å; L138-A141 PolarHBondContact O-N 2.91Å; L138-V142 WeakPolarHBondContact O-CG2 3.2Å; L138-V142 PolarHBondContact O-N 3.13Å; L138-V142 VanDerWaalsContact O-N 3.17Å; L138-L166 HydrophobicContact CB-CD1 4.38Å; L138-L166 HydrophobicContact CD1-CD2 4.04Å
139	I	98.5	Very high	96.2	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-65.6	-42.5	178.2	-67.3	161	0	0	0	110.8	L63 T105 M106 V109 G135 L136 A141 V142 K143	L63-I139 HydrophobicContact CD1-CG1 4.22Å; L63-I139 HydrophobicContact CD1-CG2 4.3Å; L63-I139 HydrophobicContact CD2-CB 4.43Å; L63-I139 HydrophobicContact CD2-CG1 3.66Å; T105-I139 WeakPolarHBondContact O-CD1 3.47Å; T105-I139 WeakPolarHBondContact OG1-CD1 3.47Å; M106-I139 HydrophobicContact CB-CD1 4.3Å; M106-I139 VanDerWaalsContact N-CD1 3.27Å; V109-I139 HydrophobicContact CB-CG2 4.2Å; V109-I139 HydrophobicContact CG1-CG2 3.86Å; V109-I139 HydrophobicContact CG2-CG2 4.06Å; G135-I139 WeakPolarHBondContact O-CD1 3.39Å; G135-I139 WeakPolarHBondContact O-CG1 3.45Å; G135-I139 PolarHBondContact O-N 3.47Å; L136-I139 PolarHBondContact O-N 3.32Å; I139-A141 VanDerWaalsContact C-N 3.34Å; I139-A141 PolarHBondContact O-N 3.14Å; I139-V142 PolarHBondContact O-N 3Å; I139-K143 HydrophobicContact CG2-CD 3.85Å; I139-K143 HydrophobicContact CG2-CG 4.16Å; I139-K143 WeakPolarHBondContact O-CB 3.29Å; I139-K143 PolarHBondContact O-N 3.39Å
140	A	98.6	Very high	97.4	Very high	2 Å²	2	20.1 Å²	20.1	2%	0.017	12%	0.118	C	C	.	.	H	α-helix	trans	-59.9	-43.4	177.2	0	0	0	0	0	111.9	L136 A137 V142 K143 G144 Y145 C147	L136-A140 WeakPolarHBondContact O-CB 3.47Å; L136-A140 PolarHBondContact O-N 2.85Å; A137-A140 PolarHBondContact O-N 3.01Å; A140-V142 VanDerWaalsContact C-N 3.32Å; A140-V142 PolarHBondContact O-N 3.3Å; A140-K143 PolarHBondContact O-N 3.49Å; A140-G144 WeakPolarHBondContact O-CA 3.21Å; A140-G144 PolarHBondContact O-N 2.8Å; A140-Y145 PolarHBondContact O-N 2.84Å; A140-C147 HydrophobicContact CB-CB 3.71Å
141	A	98.6	Very high	97.7	Very high	62 Å²	62	20.1 Å²	20.1	51%	0.512	12%	0.118	S	C	.	.	H	α-helix	trans	-61.9	-38.4	175.6	0	0	0	0	0	112.6	A137 L138 I139	A137-A141 WeakPolarHBondContact O-CB 3.47Å; A137-A141 PolarHBondContact O-N 2.76Å; L138-A141 PolarHBondContact O-N 2.91Å; I139-A141 VanDerWaalsContact C-N 3.34Å; I139-A141 PolarHBondContact O-N 3.14Å
142	V	98.5	Very high	97.1	Very high	58 Å²	58	20.2 Å²	20.2	35%	0.352	12%	0.119	S	C	.	.	H	α-helix	trans	-77.2	-39	179.6	174.2	0	0	0	0	112.3	N61 I62 L63 L138 I139 A140	N61-V142 HydrophobicContact CB-CG1 4.17Å; I62-V142 HydrophobicContact CG2-CG2 3.76Å; L63-V142 HydrophobicContact CD1-CB 3.96Å; L63-V142 HydrophobicContact CD1-CG1 3.74Å; L63-V142 HydrophobicContact CD2-CB 4.48Å; L63-V142 HydrophobicContact CD2-CG2 4.22Å; L63-V142 HydrophobicContact CG-CB 4.11Å; L63-V142 HydrophobicContact CG-CG1 3.93Å; L63-V142 HydrophobicContact CG-CG2 4.14Å; L138-V142 WeakPolarHBondContact O-CG2 3.2Å; L138-V142 PolarHBondContact O-N 3.13Å; L138-V142 VanDerWaalsContact O-N 3.17Å; I139-V142 PolarHBondContact O-N 3Å; A140-V142 VanDerWaalsContact C-N 3.32Å; A140-V142 PolarHBondContact O-N 3.3Å
143	K	98.3	Very high	96.2	Very high	74 Å²	74	25.9 Å²	25.9	32%	0.322	15%	0.145	S	C	.	.	H	α-helix	trans	-96	-7.4	-173.4	-65.5	-165.5	175	-135.5	0	114.4	L63 V109 E113 I139 A140 Y145	L63-K143 HydrophobicContact CD1-CG 4.22Å; V109-K143 HydrophobicContact CG1-CD 4.2Å; E113-K143 VanDerWaalsContact CD-NZ 3.31Å; E113-K143 WeakPolarHBondContact OE1-CD 3.47Å; E113-K143 IonicContact OE1-NZ 2.93Å; E113-K143 PolarHBondContact OE1-NZ 3.34Å; E113-K143 VanDerWaalsContact OE1-NZ 3.11Å; E113-K143 IonicContact OE2-NZ 2.67Å; E113-K143 PolarHBondContact OE2-NZ 2.96Å; I139-K143 HydrophobicContact CG2-CD 3.85Å; I139-K143 HydrophobicContact CG2-CG 4.16Å; I139-K143 WeakPolarHBondContact O-CB 3.29Å; I139-K143 PolarHBondContact O-N 3.39Å; A140-K143 PolarHBondContact O-N 3.49Å; K143-Y145 HydrophobicContact CB-CD2 3.82Å; K143-Y145 HydrophobicContact CB-CE2 3.57Å; K143-Y145 HydrophobicContact CD-CE2 3.91Å; K143-Y145 HydrophobicContact CG-CE2 4.4Å
144	G	97.9	Very high	95.3	Very high	50 Å²	50	29.4 Å²	29.4	52%	0.515	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.8	33.8	177.8	0	0	0	0	0	114.4	A140	A140-G144 WeakPolarHBondContact O-CA 3.21Å; A140-G144 PolarHBondContact O-N 2.8Å
145	Y	98.7	Very high	94.3	Very high	23 Å²	23	30 Å²	30	9%	0.09	16%	0.163	C	C	.	.			trans	-91.6	149.5	170.9	-60.3	-61.6	0	0	0	110.9	V109 E113 L118 R119 D122 I124 A140 K143	V109-Y145 HydrophobicContact CG1-CE2 4.07Å; E113-Y145 WeakPolarHBondContact CG-OH 3.33Å; E113-Y145 WeakPolarHBondContact OE1-CE2 3.3Å; E113-Y145 PolarHBondContact OE1-OH 2.87Å; L118-Y145 HydrophobicContact CD1-CD1 4.37Å; L118-Y145 HydrophobicContact CD1-CE1 4.22Å; L118-Y145 HydrophobicContact CD2-CD1 4.36Å; L118-Y145 HydrophobicContact CD2-CD2 4.23Å; L118-Y145 HydrophobicContact CD2-CE1 3.84Å; L118-Y145 HydrophobicContact CD2-CE2 3.68Å; L118-Y145 VanDerWaalsContact CD2-CZ 3.48Å; L118-Y145 HydrophobicContact CG-CD1 4.31Å; L118-Y145 HydrophobicContact CG-CE1 3.7Å; L118-Y145 HydrophobicContact CG-CE2 4.45Å; R119-Y145 VanDerWaalsContact O-CE1 3.29Å; R119-Y145 WeakPolarHBondContact O-CE1 3.47Å; D122-Y145 HydrophobicContact CB-CD1 4.47Å; I124-Y145 HydrophobicContact CD1-CD2 3.84Å; I124-Y145 HydrophobicContact CD1-CG 4Å; I124-Y145 HydrophobicContact CG1-CG 4.45Å; A140-Y145 PolarHBondContact O-N 2.84Å; K143-Y145 HydrophobicContact CB-CD2 3.82Å; K143-Y145 HydrophobicContact CB-CE2 3.57Å; K143-Y145 HydrophobicContact CD-CE2 3.91Å; K143-Y145 HydrophobicContact CG-CE2 4.4Å
146	R	98.6	Very high	93.5	Very high	108 Å²	108	30.1 Å²	30.1	41%	0.408	16%	0.164	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	138.2	163.2	-176.7	-179.2	178	-156.7	-2.2	108.4	D122 T123 I124 E169	D122-R146 PolarHBondContact O-N 2.9Å; D122-R146 VanDerWaalsContact O-N 3.12Å; T123-R146 CarbonylContact C-O 3.58Å; T123-R146 WeakPolarHBondContact CA-O 3.19Å; T123-R146 HydrophobicContact CG2-CB 4.14Å; T123-R146 HydrophobicContact CG2-CG 4.05Å; I124-R146 PolarHBondContact N-O 2.88Å; R146-E169 IonicContact CZ-OE1 2.66Å; R146-E169 IonicContact CZ-OE2 2.74Å; R146-E169 IonicContact NE-OE1 2.67Å; R146-E169 PolarHBondContact NE-OE1 3.46Å; R146-E169 IonicContact NE-OE2 2.73Å; R146-E169 IonicContact NH2-OE1 3.05Å; R146-E169 PolarHBondContact NH2-OE1 2.82Å; R146-E169 IonicContact NH2-OE2 2.73Å; R146-E169 PolarHBondContact NH2-OE2 3.42Å
147	C	98.6	Very high	92.9	Very high	5 Å²	5	35.1 Å²	35.1	3%	0.034	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	128.7	-177.5	-168.9	0	0	0	0	111.4	I124 A140 A168 E169	I124-C147 WeakPolarHBondContact O-CA 3.01Å; A140-C147 HydrophobicContact CB-CB 3.71Å; C147-A168 HydrophobicContact CB-CB 4.19Å; C147-A168 WeakPolarHBondContact O-CA 3.45Å; C147-E169 PolarHBondContact O-N 3Å
148	I	98.4	Very high	92.5	Very high	4 Å²	4	36.4 Å²	36.4	2%	0.021	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	118.1	176.8	-51.4	179.2	0	0	0	108.7	T123 I124 I125 E126 E169 V171 L192 I196	T123-I148 HydrophobicContact CG2-CD1 3.79Å; T123-I148 HydrophobicContact CG2-CG1 3.97Å; I124-I148 PolarHBondContact O-N 3.41Å; I125-I148 VanDerWaalsContact CA-O 3.28Å; I125-I148 WeakPolarHBondContact CA-O 3.29Å; I125-I148 HydrophobicContact CG1-CB 4.25Å; I125-I148 HydrophobicContact CG1-CD1 4.36Å; E126-I148 PolarHBondContact N-O 3.07Å; E126-I148 VanDerWaalsContact N-O 3.07Å; I148-E169 CarbonylContact C-O 3.57Å; I148-E169 WeakPolarHBondContact CA-O 3.46Å; I148-E169 HydrophobicContact CG1-CB 4.19Å; I148-E169 HydrophobicContact CG2-CB 4.4Å; I148-V171 HydrophobicContact CG2-CG2 4.13Å; I148-L192 HydrophobicContact CG2-CD1 4.31Å; I148-I196 HydrophobicContact CD1-CD1 3.37Å
149	I	98	Very high	92.1	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	123.8	180	-59.5	-50.6	0	0	0	110.1	E126 T128 G133 M151 L163 A168 E169 I170 V171	E126-I149 HydrophobicContact CB-CD1 4.3Å; T128-I149 HydrophobicContact CG2-CG2 3.52Å; G133-I149 VanDerWaalsContact CA-CD1 3.44Å; I149-M151 HydrophobicContact CG2-CE 3.62Å; I149-L163 HydrophobicContact CB-CD1 4.23Å; I149-L163 HydrophobicContact CG1-CD1 4.33Å; I149-L163 HydrophobicContact CG1-CD2 3.84Å; I149-L163 HydrophobicContact CG2-CD1 3.98Å; I149-A168 HydrophobicContact CG1-CB 4.26Å; I149-E169 PolarHBondContact N-O 2.82Å; I149-I170 WeakPolarHBondContact O-CA 3.25Å; I149-V171 PolarHBondContact O-N 2.79Å
150	V	95.5	Very high	91.7	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	116.8	175.2	-167	0	0	0	0	108.8	I125 E126 P127 T128 V171 T173 H185 T188 A189 L192	I125-V150 HydrophobicContact CG2-CG2 4.18Å; E126-V150 PolarHBondContact O-N 3.15Å; P127-V150 WeakPolarHBondContact CA-O 3.46Å; T128-V150 PolarHBondContact N-O 3.17Å; V150-V171 WeakPolarHBondContact CA-O 3.28Å; V150-V171 HydrophobicContact CG1-CB 4.35Å; V150-V171 HydrophobicContact CG1-CG1 4.35Å; V150-V171 HydrophobicContact CG2-CB 4.31Å; V150-T173 HydrophobicContact CG1-CG2 3.8Å; V150-H185 HydrophobicContact CG1-CB 3.93Å; V150-H185 WeakPolarHBondContact CG1-O 3.28Å; V150-T188 HydrophobicContact CG1-CG2 3.72Å; V150-A189 HydrophobicContact CB-CB 4.3Å; V150-A189 HydrophobicContact CG2-CB 3.88Å; V150-L192 HydrophobicContact CG2-CD1 3.77Å
151	M	89.3	Confident	91.5	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	149.6	-174.9	67.9	170.1	66	0	0	113.6	T128 I149 M155 V160 L163 I170 V171 R172 T173	T128-M151 VanDerWaalsContact O-CB 3.28Å; T128-M151 WeakPolarHBondContact O-CB 3.34Å; I149-M151 HydrophobicContact CG2-CE 3.62Å; M151-M155 HydrophobicContact CB-CG 4.49Å; M151-M155 HydrophobicContact SD-CB 4.11Å; M151-V160 HydrophobicContact SD-CG2 3.96Å; M151-L163 HydrophobicContact CE-CD1 3.06Å; M151-I170 HydrophobicContact CE-CG2 4.4Å; M151-I170 HydrophobicContact CG-CG2 4.25Å; M151-I170 HydrophobicContact SD-CG2 4.37Å; M151-V171 PolarHBondContact N-O 3.02Å; M151-R172 CarbonylContact O-C 3.56Å; M151-R172 VanDerWaalsContact O-CA 3.29Å; M151-R172 WeakPolarHBondContact O-CA 3.45Å; M151-R172 PolarHBondContact SD-NH1 3.19Å; M151-R172 VanDerWaalsContact SD-NH1 3.42Å; M151-T173 PolarHBondContact O-N 3.46Å
152	P	84	Confident	91.4	Very high	12 Å²	12	38.3 Å²	38.3	8%	0.078	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	154.8	171.4	-23.7	34.9	0	0	0	113.4	K154 M155 R172 T173	P152-K154 VanDerWaalsContact C-N 3.33Å; P152-K154 HydrophobicContact CB-CG 4.37Å; P152-K154 PolarHBondContact O-N 3.46Å; P152-M155 HydrophobicContact CB-CE 4.15Å; P152-M155 HydrophobicContact CB-CG 4.49Å; P152-M155 HydrophobicContact CG-CE 3.93Å; P152-M155 WeakPolarHBondContact O-CG 3.35Å; P152-M155 PolarHBondContact O-N 3.4Å; P152-R172 PolarHBondContact O-NH1 3.17Å; P152-T173 CarbonylContact C-O 3.56Å; P152-T173 WeakPolarHBondContact CA-O 3.5Å
153	E	79.6	Confident	91.3	Very high	120 Å²	120	35.5 Å²	35.5	56%	0.561	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63	-31.9	177.5	-73.5	168.8	167.3	0	0	114.1	M155 R172 T173 S175	E153-M155 PolarHBondContact O-N 3.37Å; E153-M155 VanDerWaalsContact O-N 3.11Å; E153-R172 HydrophobicContact CG-CB 4.09Å; E153-R172 PolarHBondContact O-NH1 3.46Å; E153-T173 WeakPolarHBondContact CG-O 3.4Å; E153-T173 PolarHBondContact N-O 2.92Å; E153-S175 PolarHBondContact N-OG 3.49Å
154	K	76.5	Confident	91.1	Very high	74 Å²	74	38 Å²	38	32%	0.322	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-17.8	-178	72.7	173	-172.1	171.7	0	114.8	P152 S175 K363	P152-K154 VanDerWaalsContact C-N 3.33Å; P152-K154 HydrophobicContact CB-CG 4.37Å; P152-K154 PolarHBondContact O-N 3.46Å; K154-S175 WeakPolarHBondContact CB-OG 3.49Å; K154-S175 PolarHBondContact N-OG 3.43Å; K154-K363 PolarHBondContact O-NZ 2.67Å; K154-K363 VanDerWaalsContact O-NZ 3.09Å
155	M	78.6	Confident	91.1	Very high	14 Å²	14	40 Å²	40	7%	0.069	20%	0.203	C	C	.	.	S	Bend	trans	-67.1	138.8	-178.8	-56.1	-58.9	158.2	0	0	110.1	M151 P152 E153 R172	M151-M155 HydrophobicContact CB-CG 4.49Å; M151-M155 HydrophobicContact SD-CB 4.11Å; P152-M155 HydrophobicContact CB-CE 4.15Å; P152-M155 HydrophobicContact CB-CG 4.49Å; P152-M155 HydrophobicContact CG-CE 3.93Å; P152-M155 WeakPolarHBondContact O-CG 3.35Å; P152-M155 PolarHBondContact O-N 3.4Å; E153-M155 PolarHBondContact O-N 3.37Å; E153-M155 VanDerWaalsContact O-N 3.11Å; M155-R172 PolarHBondContact O-NH1 2.9Å; M155-R172 PolarHBondContact O-NH2 3.43Å
156	S	80.6	Confident	91.1	Very high	4 Å²	4	41.1 Å²	41.1	3%	0.028	21%	0.21	C	C	.	.			trans	-55.4	152.4	-171.5	72.7	0	0	0	0	114.3	E158 K159 N359	S156-E158 VanDerWaalsContact C-N 3.29Å; S156-E158 WeakPolarHBondContact CB-OE2 3.45Å; S156-K159 PolarHBondContact O-N 2.8Å; S156-K159 WeakPolarHBondContact OG-CG 3.37Å; S156-N359 VanDerWaalsContact CB-O 3.23Å; S156-N359 WeakPolarHBondContact CB-O 3.14Å; S156-N359 PolarHBondContact OG-O 3.44Å
157	M	86.3	Confident	91.1	Very high	105 Å²	105	38.9 Å²	38.9	52%	0.517	22%	0.22	S	C	.	.	H	α-helix	trans	-70.4	-30.7	179	-73.7	-55.1	-56.9	0	0	111.6	K159 V160 D161	M157-K159 PolarHBondContact O-N 2.87Å; M157-V160 HydrophobicContact CE-CB 4.34Å; M157-V160 HydrophobicContact CE-CG1 4.15Å; M157-V160 WeakPolarHBondContact O-CA 3.39Å; M157-V160 WeakPolarHBondContact O-CB 3.47Å; M157-V160 PolarHBondContact O-N 2.86Å; M157-D161 PolarHBondContact O-N 3.14Å
158	E	91	Very high	91	Very high	29 Å²	29	39 Å²	39	14%	0.136	22%	0.222	C	C	.	.	H	α-helix	trans	-57.1	-37.6	175	-64.5	88.1	157.1	0	0	111.5	S156 D161 V162 R358 M361 S362	S156-E158 VanDerWaalsContact C-N 3.29Å; S156-E158 WeakPolarHBondContact CB-OE2 3.45Å; E158-D161 PolarHBondContact O-N 3.46Å; E158-V162 VanDerWaalsContact O-CG2 3.32Å; E158-V162 WeakPolarHBondContact O-CG2 3.48Å; E158-V162 PolarHBondContact O-N 3.08Å; E158-V162 VanDerWaalsContact O-N 3.13Å; E158-R358 WeakPolarHBondContact CB-O 3.44Å; E158-M361 HydrophobicContact CG-CB 4.44Å; E158-M361 PolarHBondContact OE1-N 2.62Å; E158-S362 VanDerWaalsContact OE1-CB 3.25Å; E158-S362 WeakPolarHBondContact OE1-CB 3.43Å; E158-S362 PolarHBondContact OE1-N 2.83Å; E158-S362 PolarHBondContact OE1-OG 2.82Å; E158-S362 PolarHBondContact OE2-OG 2.86Å
159	K	89.8	Confident	91	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-66	-39.9	174.4	-74.3	168.6	170.8	178.1	0	112	S129 I134 S156 M157 L163 E283 N359	S129-K159 PolarHBondContact O-NZ 3.02Å; I134-K159 HydrophobicContact CD1-CG 4.23Å; S156-K159 PolarHBondContact O-N 2.8Å; S156-K159 WeakPolarHBondContact OG-CG 3.37Å; M157-K159 PolarHBondContact O-N 2.87Å; K159-L163 WeakPolarHBondContact O-CB 3.46Å; K159-L163 VanDerWaalsContact O-CG 3.28Å; K159-L163 WeakPolarHBondContact O-CG 3.29Å; K159-L163 PolarHBondContact O-N 2.92Å; K159-E283 IonicContact NZ-OE2 2.89Å; K159-E283 PolarHBondContact NZ-OE2 3.07Å; K159-N359 HydrophobicContact CG-CB 4.32Å
160	V	90.3	Very high	90.8	Very high	5 Å²	5	45 Å²	45	3%	0.03	25%	0.251	C	S	.	.	H	α-helix	trans	-64.5	-43	177	162.2	0	0	0	0	111.5	M151 M157 V162 L163 K164 I170	M151-V160 HydrophobicContact SD-CG2 3.96Å; M157-V160 HydrophobicContact CE-CB 4.34Å; M157-V160 HydrophobicContact CE-CG1 4.15Å; M157-V160 WeakPolarHBondContact O-CA 3.39Å; M157-V160 WeakPolarHBondContact O-CB 3.47Å; M157-V160 PolarHBondContact O-N 2.86Å; V160-V162 PolarHBondContact O-N 2.83Å; V160-L163 PolarHBondContact O-N 2.9Å; V160-K164 HydrophobicContact CG1-CD 3.96Å; V160-K164 HydrophobicContact CG1-CG 4.4Å; V160-K164 WeakPolarHBondContact O-CG 3.5Å; V160-K164 PolarHBondContact O-N 2.82Å; V160-I170 HydrophobicContact CB-CD1 4.17Å; V160-I170 HydrophobicContact CG1-CD1 3.8Å; V160-I170 HydrophobicContact CG2-CD1 4.12Å; V160-I170 HydrophobicContact CG2-CG2 4.49Å
161	D	94.1	Very high	90.7	Very high	91 Å²	91	47.1 Å²	47.1	49%	0.487	26%	0.264	S	S	.	.	H	α-helix	trans	-64.9	-42.2	-179.2	-65.6	-24.5	0	0	0	111.1	M157 E158 K164 A165	M157-D161 PolarHBondContact O-N 3.14Å; E158-D161 PolarHBondContact O-N 3.46Å; D161-K164 PolarHBondContact O-N 3.04Å; D161-A165 WeakPolarHBondContact O-CB 3.5Å; D161-A165 PolarHBondContact O-N 3.48Å
162	V	97.1	Very high	90.6	Very high	28 Å²	28	50.6 Å²	50.6	17%	0.17	28%	0.277	C	S	.	.	H	α-helix	trans	-61.5	-45.9	174.2	172.6	0	0	0	0	111.4	I134 E158 V160 A165 L166	I134-V162 HydrophobicContact CD1-CB 4.34Å; I134-V162 HydrophobicContact CD1-CG1 4.03Å; I134-V162 HydrophobicContact CG1-CG1 4.03Å; I134-V162 HydrophobicContact CG2-CG1 3.93Å; E158-V162 VanDerWaalsContact O-CG2 3.32Å; E158-V162 WeakPolarHBondContact O-CG2 3.48Å; E158-V162 PolarHBondContact O-N 3.08Å; E158-V162 VanDerWaalsContact O-N 3.13Å; V160-V162 PolarHBondContact O-N 2.83Å; V162-A165 PolarHBondContact O-N 3.18Å; V162-L166 HydrophobicContact CG1-CD1 3.93Å; V162-L166 WeakPolarHBondContact O-CG 3.24Å; V162-L166 PolarHBondContact O-N 3.48Å
163	L	96.4	Very high	90.7	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-63.2	-44	179.8	-77.5	171.1	0	0	0	112.7	G133 I134 A137 I149 M151 K159 V160 A165 L166 G167 A168 I170	G133-L163 WeakPolarHBondContact O-CD2 3.32Å; I134-L163 HydrophobicContact CG1-CD2 3.99Å; I134-L163 HydrophobicContact CG1-CG 4.03Å; A137-L163 HydrophobicContact CB-CD2 3.7Å; I149-L163 HydrophobicContact CB-CD1 4.23Å; I149-L163 HydrophobicContact CG1-CD1 4.33Å; I149-L163 HydrophobicContact CG1-CD2 3.84Å; I149-L163 HydrophobicContact CG2-CD1 3.98Å; M151-L163 HydrophobicContact CE-CD1 3.06Å; K159-L163 WeakPolarHBondContact O-CB 3.46Å; K159-L163 VanDerWaalsContact O-CG 3.28Å; K159-L163 WeakPolarHBondContact O-CG 3.29Å; K159-L163 PolarHBondContact O-N 2.92Å; V160-L163 PolarHBondContact O-N 2.9Å; L163-A165 VanDerWaalsContact C-N 3.33Å; L163-A165 PolarHBondContact O-N 2.64Å; L163-L166 CarbonylContact O-C 3.57Å; L163-L166 PolarHBondContact O-N 3.47Å; L163-G167 PolarHBondContact O-N 3.32Å; L163-A168 HydrophobicContact CB-CB 4.31Å; L163-A168 HydrophobicContact CD2-CB 4.17Å; L163-A168 WeakPolarHBondContact O-CB 3.41Å; L163-A168 PolarHBondContact O-N 2.88Å; L163-I170 HydrophobicContact CB-CD1 3.68Å; L163-I170 HydrophobicContact CB-CG1 4.17Å; L163-I170 HydrophobicContact CD1-CD1 4.28Å; L163-I170 HydrophobicContact CD1-CG1 4.46Å
164	K	95.1	Very high	90.7	Very high	127 Å²	127	47.2 Å²	47.2	55%	0.552	27%	0.265	S	S	*	.	H	α-helix	trans	-61.2	-43.3	174.9	-74.2	176.5	177.2	175.4	0	111.3	V160 D161 L166 G167 I170	V160-K164 HydrophobicContact CG1-CD 3.96Å; V160-K164 HydrophobicContact CG1-CG 4.4Å; V160-K164 WeakPolarHBondContact O-CG 3.5Å; V160-K164 PolarHBondContact O-N 2.82Å; D161-K164 PolarHBondContact O-N 3.04Å; K164-L166 PolarHBondContact O-N 2.98Å; K164-G167 PolarHBondContact O-N 3.2Å; K164-I170 HydrophobicContact CG-CD1 3.75Å
165	A	97.6	Very high	90.7	Very high	91 Å²	91	46.1 Å²	46.1	75%	0.752	27%	0.267	S	S	*	.	H	α-helix	trans	-64	-30.8	177.8	0	0	0	0	0	112.6	D161 V162 L163 G167	D161-A165 WeakPolarHBondContact O-CB 3.5Å; D161-A165 PolarHBondContact O-N 3.48Å; V162-A165 PolarHBondContact O-N 3.18Å; L163-A165 VanDerWaalsContact C-N 3.33Å; L163-A165 PolarHBondContact O-N 2.64Å; A165-G167 PolarHBondContact O-N 2.83Å
166	L	98.2	Very high	90.6	Very high	46 Å²	46	50.9 Å²	50.9	24%	0.241	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-1.7	172.6	-69.3	170.3	0	0	0	113.5	I134 A137 L138 V162 L163 K164	I134-L166 HydrophobicContact CG2-CD1 4.13Å; A137-L166 HydrophobicContact CB-CB 3.9Å; A137-L166 HydrophobicContact CB-CD1 3.93Å; L138-L166 HydrophobicContact CB-CD1 4.38Å; L138-L166 HydrophobicContact CD1-CD2 4.04Å; V162-L166 HydrophobicContact CG1-CD1 3.93Å; V162-L166 WeakPolarHBondContact O-CG 3.24Å; V162-L166 PolarHBondContact O-N 3.48Å; L163-L166 CarbonylContact O-C 3.57Å; L163-L166 PolarHBondContact O-N 3.47Å; K164-L166 PolarHBondContact O-N 2.98Å
167	G	97.4	Very high	90.5	Very high	61 Å²	61	51.9 Å²	51.9	63%	0.629	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.2	15	179.4	0	0	0	0	0	114.7	L163 K164 A165	L163-G167 PolarHBondContact O-N 3.32Å; K164-G167 PolarHBondContact O-N 3.2Å; A165-G167 PolarHBondContact O-N 2.83Å
168	A	97.7	Very high	90.4	Very high	8 Å²	8	49 Å²	49	7%	0.066	30%	0.303	C	S	.	.			trans	-78.9	139.6	174.9	0	0	0	0	0	111.7	A137 C147 I149 L163	A137-A168 HydrophobicContact CB-CB 3.83Å; C147-A168 HydrophobicContact CB-CB 4.19Å; C147-A168 WeakPolarHBondContact O-CA 3.45Å; I149-A168 HydrophobicContact CG1-CB 4.26Å; L163-A168 HydrophobicContact CB-CB 4.31Å; L163-A168 HydrophobicContact CD2-CB 4.17Å; L163-A168 WeakPolarHBondContact O-CB 3.41Å; L163-A168 PolarHBondContact O-N 2.88Å
169	E	97.6	Very high	90	Very high	86 Å²	86	48.6 Å²	48.6	40%	0.402	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	143.5	166.2	-67.4	170	-129.5	0	0	109.5	R146 C147 I148 I149	R146-E169 IonicContact CZ-OE1 2.66Å; R146-E169 IonicContact CZ-OE2 2.74Å; R146-E169 IonicContact NE-OE1 2.67Å; R146-E169 PolarHBondContact NE-OE1 3.46Å; R146-E169 IonicContact NE-OE2 2.73Å; R146-E169 IonicContact NH2-OE1 3.05Å; R146-E169 PolarHBondContact NH2-OE1 2.82Å; R146-E169 IonicContact NH2-OE2 2.73Å; R146-E169 PolarHBondContact NH2-OE2 3.42Å; C147-E169 PolarHBondContact O-N 3Å; I148-E169 CarbonylContact C-O 3.57Å; I148-E169 WeakPolarHBondContact CA-O 3.46Å; I148-E169 HydrophobicContact CG1-CB 4.19Å; I148-E169 HydrophobicContact CG2-CB 4.4Å; I149-E169 PolarHBondContact N-O 2.82Å
170	I	94.5	Very high	89.8	Confident	44 Å²	44	52 Å²	52	23%	0.226	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	125.1	-173.6	-56.2	172	0	0	0	109.5	I149 M151 V160 L163 K164	I149-I170 WeakPolarHBondContact O-CA 3.25Å; M151-I170 HydrophobicContact CE-CG2 4.4Å; M151-I170 HydrophobicContact CG-CG2 4.25Å; M151-I170 HydrophobicContact SD-CG2 4.37Å; V160-I170 HydrophobicContact CB-CD1 4.17Å; V160-I170 HydrophobicContact CG1-CD1 3.8Å; V160-I170 HydrophobicContact CG2-CD1 4.12Å; V160-I170 HydrophobicContact CG2-CG2 4.49Å; L163-I170 HydrophobicContact CB-CD1 3.68Å; L163-I170 HydrophobicContact CB-CG1 4.17Å; L163-I170 HydrophobicContact CD1-CD1 4.28Å; L163-I170 HydrophobicContact CD1-CG1 4.46Å; K164-I170 HydrophobicContact CG-CD1 3.75Å
171	V	93.8	Very high	89.7	Confident	45 Å²	45	52.9 Å²	52.9	27%	0.273	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	120.6	171.9	-179.1	0	0	0	0	108.1	I148 I149 V150 M151 T188 L192	I148-V171 HydrophobicContact CG2-CG2 4.13Å; I149-V171 PolarHBondContact O-N 2.79Å; V150-V171 WeakPolarHBondContact CA-O 3.28Å; V150-V171 HydrophobicContact CG1-CB 4.35Å; V150-V171 HydrophobicContact CG1-CG1 4.35Å; V150-V171 HydrophobicContact CG2-CB 4.31Å; M151-V171 PolarHBondContact N-O 3.02Å; V171-T188 HydrophobicContact CG1-CG2 3.95Å; V171-L192 HydrophobicContact CB-CD1 4.48Å; V171-L192 HydrophobicContact CG2-CD1 3.98Å
172	R	86.3	Confident	89.4	Confident	73 Å²	73	51.7 Å²	51.7	28%	0.275	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	144.1	176.6	-67.6	-65.1	-159.3	151.4	11.4	110.4	M151 P152 E153 M155	M151-R172 CarbonylContact O-C 3.56Å; M151-R172 VanDerWaalsContact O-CA 3.29Å; M151-R172 WeakPolarHBondContact O-CA 3.45Å; M151-R172 PolarHBondContact SD-NH1 3.19Å; M151-R172 VanDerWaalsContact SD-NH1 3.42Å; P152-R172 PolarHBondContact O-NH1 3.17Å; E153-R172 HydrophobicContact CG-CB 4.09Å; E153-R172 PolarHBondContact O-NH1 3.46Å; M155-R172 PolarHBondContact O-NH1 2.9Å; M155-R172 PolarHBondContact O-NH2 3.43Å
173	T	85.8	Confident	88.8	Confident	4 Å²	4	55.3 Å²	55.3	3%	0.025	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	154.3	173.4	62.5	0	0	0	0	111.7	V150 M151 P152 E153 S175 E183 H185 T188	V150-T173 HydrophobicContact CG1-CG2 3.8Å; M151-T173 PolarHBondContact O-N 3.46Å; P152-T173 CarbonylContact C-O 3.56Å; P152-T173 WeakPolarHBondContact CA-O 3.5Å; E153-T173 WeakPolarHBondContact CG-O 3.4Å; E153-T173 PolarHBondContact N-O 2.92Å; T173-S175 PolarHBondContact O-N 3.12Å; T173-E183 WeakPolarHBondContact CB-O 3.4Å; T173-H185 HydrophobicContact CG2-CB 4.23Å; T173-H185 WeakPolarHBondContact OG1-CB 3.22Å; T173-H185 PolarHBondContact OG1-N 3Å; T173-T188 HydrophobicContact CG2-CG2 4.19Å
174	P	80.3	Confident	88.5	Confident	56 Å²	56	55.4 Å²	55.4	36%	0.364	34%	0.338	S	S	.	.			trans	-55.9	136	176.3	-24.8	34.6	0	0	0	112	S176 A177	P174-S176 VanDerWaalsContact C-N 3.29Å; P174-S176 PolarHBondContact O-N 2.79Å; P174-A177 HydrophobicContact CB-CB 4.39Å; P174-A177 PolarHBondContact O-N 3.48Å
175	S	77.4	Confident	88.2	Confident	52 Å²	52	50.4 Å²	50.4	36%	0.364	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-18.2	-179.1	-57.2	0	0	0	0	113.6	E153 K154 T173	E153-S175 PolarHBondContact N-OG 3.49Å; K154-S175 WeakPolarHBondContact CB-OG 3.49Å; K154-S175 PolarHBondContact N-OG 3.43Å; T173-S175 PolarHBondContact O-N 3.12Å
176	S	76.5	Confident	87.9	Confident	114 Å²	114	46.2 Å²	46.2	80%	0.797	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-9.9	177.3	51.7	0	0	0	0	113.7	P174 A178	P174-S176 VanDerWaalsContact C-N 3.29Å; P174-S176 PolarHBondContact O-N 2.79Å; S176-A178 PolarHBondContact O-N 3.32Å
177	A	77	Confident	87.6	Confident	25 Å²	25	47.3 Å²	47.3	21%	0.207	28%	0.282	C	S	.	.	S	Bend	trans	-68.5	124.9	-179.7	0	0	0	0	0	110.5	P174 E183	P174-A177 HydrophobicContact CB-CB 4.39Å; P174-A177 PolarHBondContact O-N 3.48Å; A177-E183 HydrophobicContact CB-CB 4.32Å
178	A	84.1	Confident	87.5	Confident	44 Å²	44	44.7 Å²	44.7	36%	0.364	25%	0.254	S	S	.	.			trans	-58.7	150.6	171.1	0	0	0	0	0	110.7	S176 D180 S181 S184	S176-A178 PolarHBondContact O-N 3.32Å; A178-D180 PolarHBondContact O-N 3.42Å; A178-D180 VanDerWaalsContact O-N 3.07Å; A178-S181 WeakPolarHBondContact O-CB 3.3Å; A178-S181 PolarHBondContact O-N 2.69Å; A178-S184 WeakPolarHBondContact O-CB 3.35Å
179	F	84.1	Confident	87.4	Confident	20 Å²	20	44.3 Å²	44.3	9%	0.088	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-28.5	-174.2	78.9	-83.5	0	0	0	114.7	R27 P28 S184 I186 D288 F289	R27-F179 VanDerWaalsContact NH2-CZ 3.31Å; P28-F179 HydrophobicContact CG-CD2 3.93Å; P28-F179 HydrophobicContact CG-CE2 4.21Å; F179-S184 WeakPolarHBondContact O-CB 3.47Å; F179-S184 PolarHBondContact O-OG 2.87Å; F179-I186 HydrophobicContact CB-CD1 4.01Å; F179-D288 WeakPolarHBondContact CD1-OD2 3.43Å; F179-D288 PolarHBondContact N-OD2 3.04Å; F179-F289 HydrophobicContact CB-CD1 3.53Å; F179-F289 HydrophobicContact CB-CE1 3.72Å; F179-F289 HydrophobicContact CD1-CB 3.99Å; F179-F289 AromaticContact CD1-CD1 3.82Å; F179-F289 HydrophobicContact CD1-CD1 3.82Å; F179-F289 HydrophobicContact CD1-CG 4.28Å; F179-F289 HydrophobicContact CD2-CB 4.35Å; F179-F289 AromaticContact CD2-CD1 3.75Å; F179-F289 HydrophobicContact CD2-CD1 3.75Å; F179-F289 HydrophobicContact CD2-CE1 4.26Å; F179-F289 HydrophobicContact CD2-CG 4.07Å; F179-F289 HydrophobicContact CE1-CB 3.78Å; F179-F289 HydrophobicContact CE1-CD1 4.43Å; F179-F289 HydrophobicContact CE1-CG 4.46Å; F179-F289 HydrophobicContact CE2-CB 4.14Å; F179-F289 HydrophobicContact CE2-CD1 4.37Å; F179-F289 HydrophobicContact CE2-CG 4.25Å; F179-F289 HydrophobicContact CG-CB 4.25Å; F179-F289 AromaticContact CG-CD1 3.41Å; F179-F289 HydrophobicContact CG-CD1 3.41Å; F179-F289 VanDerWaalsContact CG-CD1 3.41Å; F179-F289 HydrophobicContact CG-CE1 4.04Å; F179-F289 HydrophobicContact CG-CG 4.07Å; F179-F289 HydrophobicContact CZ-CB 3.82Å; F179-F289 HydrophobicContact CZ-CG 4.41Å
180	D	85.4	Confident	87.2	Confident	72 Å²	72	41.7 Å²	41.7	39%	0.385	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-4.6	-179.8	62.6	-10.1	0	0	0	114.3	W25 R27 A178	W25-D180 HydrophobicContact CH2-CB 3.69Å; W25-D180 HydrophobicContact CZ2-CB 4.48Å; R27-D180 IonicContact NH1-OD2 3.69Å; A178-D180 PolarHBondContact O-N 3.42Å; A178-D180 VanDerWaalsContact O-N 3.07Å
181	S	87.7	Confident	87.2	Confident	23 Å²	23	44.7 Å²	44.7	16%	0.161	25%	0.246	C	C	.	.	S	Bend	trans	-67.8	144.6	173.8	128.6	0	0	0	0	110.9	A178 E183 S184 R187	A178-S181 WeakPolarHBondContact O-CB 3.3Å; A178-S181 PolarHBondContact O-N 2.69Å; S181-E183 PolarHBondContact O-N 3.22Å; S181-E183 VanDerWaalsContact O-N 3.1Å; S181-E183 PolarHBondContact OG-N 2.84Å; S181-E183 PolarHBondContact OG-OE2 3.36Å; S181-S184 WeakPolarHBondContact O-CB 3.44Å; S181-S184 PolarHBondContact O-N 3.23Å; S181-S184 PolarHBondContact O-OG 3.39Å; S181-R187 VanDerWaalsContact O-CB 3.28Å; S181-R187 WeakPolarHBondContact O-CB 3.39Å; S181-R187 VanDerWaalsContact O-CG 3.24Å; S181-R187 WeakPolarHBondContact O-CG 3.38Å
182	P	86.6	Confident	87.3	Confident	66 Å²	66	43.8 Å²	43.8	43%	0.429	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-29.1	176.4	-25.1	33.8	0	0	0	114.6	S184	P182-S184 VanDerWaalsContact C-N 3.32Å
183	E	85.8	Confident	87.7	Confident	105 Å²	105	43.9 Å²	43.9	49%	0.491	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-7.9	-179.6	-57.3	70.9	-149.9	0	0	112.7	T173 A177 S181	T173-E183 WeakPolarHBondContact CB-O 3.4Å; A177-E183 HydrophobicContact CB-CB 4.32Å; S181-E183 PolarHBondContact O-N 3.22Å; S181-E183 VanDerWaalsContact O-N 3.1Å; S181-E183 PolarHBondContact OG-N 2.84Å; S181-E183 PolarHBondContact OG-OE2 3.36Å
184	S	89.4	Confident	88.1	Confident	1 Å²	1	46.9 Å²	46.9	1%	0.007	26%	0.263	C	S	.	.	S	Bend	trans	-63	149.5	178	94.4	0	0	0	0	111.1	A178 F179 S181 P182 I186 R187 T188	A178-S184 WeakPolarHBondContact O-CB 3.35Å; F179-S184 WeakPolarHBondContact O-CB 3.47Å; F179-S184 PolarHBondContact O-OG 2.87Å; S181-S184 WeakPolarHBondContact O-CB 3.44Å; S181-S184 PolarHBondContact O-N 3.23Å; S181-S184 PolarHBondContact O-OG 3.39Å; P182-S184 VanDerWaalsContact C-N 3.32Å; S184-I186 PolarHBondContact O-N 3.38Å; S184-I186 PolarHBondContact OG-N 3.23Å; S184-R187 PolarHBondContact O-N 3.29Å; S184-R187 PolarHBondContact OG-N 3.26Å; S184-T188 VanDerWaalsContact O-CB 3.25Å; S184-T188 WeakPolarHBondContact O-CB 3.43Å; S184-T188 PolarHBondContact O-N 3.15Å; S184-T188 PolarHBondContact O-OG1 3.21Å
185	H	88.9	Confident	88.9	Confident	23 Å²	23	49.7 Å²	49.7	11%	0.106	27%	0.271	C	S	.	.	H	α-helix	trans	-54.9	-33.2	174.3	60.2	-66.9	0	0	0	112.7	P127 V150 T173 A189	P127-H185 WeakPolarHBondContact CB-O 3.17Å; V150-H185 HydrophobicContact CG1-CB 3.93Å; V150-H185 WeakPolarHBondContact CG1-O 3.28Å; T173-H185 HydrophobicContact CG2-CB 4.23Å; T173-H185 WeakPolarHBondContact OG1-CB 3.22Å; T173-H185 PolarHBondContact OG1-N 3Å; H185-A189 WeakPolarHBondContact O-CB 3.16Å; H185-A189 PolarHBondContact O-N 3.12Å; H185-A189 VanDerWaalsContact O-N 3.07Å
186	I	91.7	Very high	89.8	Confident	2 Å²	2	48.7 Å²	48.7	1%	0.01	26%	0.261	C	S	.	.	H	α-helix	trans	-68.4	-56.1	177.2	-65.3	154.3	0	0	0	110.2	P28 P127 F179 S184 T188 A189 W190 Y205 F289	P28-I186 HydrophobicContact CG-CD1 4.18Å; P127-I186 HydrophobicContact CB-CB 4.48Å; P127-I186 HydrophobicContact CB-CG1 4.04Å; P127-I186 HydrophobicContact CG-CG1 4.37Å; F179-I186 HydrophobicContact CB-CD1 4.01Å; S184-I186 PolarHBondContact O-N 3.38Å; S184-I186 PolarHBondContact OG-N 3.23Å; I186-T188 VanDerWaalsContact C-N 3.29Å; I186-T188 PolarHBondContact O-N 3.41Å; I186-A189 PolarHBondContact O-N 3.36Å; I186-W190 VanDerWaalsContact O-CD1 3.28Å; I186-W190 PolarHBondContact O-N 3.28Å; I186-W190 VanDerWaalsContact O-N 3.12Å; I186-Y205 HydrophobicContact CD1-CE2 4.29Å; I186-Y205 HydrophobicContact CG1-CE2 4.04Å; I186-F289 HydrophobicContact CD1-CE1 3.85Å; I186-F289 HydrophobicContact CD1-CZ 3.99Å
187	R	92.4	Very high	90.7	Very high	70 Å²	70	48.1 Å²	48.1	26%	0.264	26%	0.255	S	S	.	.	H	α-helix	trans	-63.2	-36.8	-178.9	-76.6	-84.4	-62.5	-169.5	2	111.9	W25 S181 S184 W190 R191	W25-R187 VanDerWaalsContact CD2-CD 3.42Å; W25-R187 HydrophobicContact CD2-CG 4.45Å; W25-R187 HydrophobicContact CH2-CG 4.47Å; W25-R187 HydrophobicContact CZ2-CG 4.1Å; S181-R187 VanDerWaalsContact O-CB 3.28Å; S181-R187 WeakPolarHBondContact O-CB 3.39Å; S181-R187 VanDerWaalsContact O-CG 3.24Å; S181-R187 WeakPolarHBondContact O-CG 3.38Å; S184-R187 PolarHBondContact O-N 3.29Å; S184-R187 PolarHBondContact OG-N 3.26Å; R187-W190 PolarHBondContact O-N 2.76Å; R187-R191 PolarHBondContact O-N 3.23Å
188	T	94.1	Very high	91.7	Very high	5 Å²	5	52.5 Å²	52.5	3%	0.031	28%	0.275	C	S	.	.	H	α-helix	trans	-62.2	-43.5	174.1	-65	0	0	0	0	111.9	V150 V171 T173 S184 I186 W190 R191 L192	V150-T188 HydrophobicContact CG1-CG2 3.72Å; V171-T188 HydrophobicContact CG1-CG2 3.95Å; T173-T188 HydrophobicContact CG2-CG2 4.19Å; S184-T188 VanDerWaalsContact O-CB 3.25Å; S184-T188 WeakPolarHBondContact O-CB 3.43Å; S184-T188 PolarHBondContact O-N 3.15Å; S184-T188 PolarHBondContact O-OG1 3.21Å; I186-T188 VanDerWaalsContact C-N 3.29Å; I186-T188 PolarHBondContact O-N 3.41Å; T188-W190 VanDerWaalsContact C-N 3.34Å; T188-W190 PolarHBondContact O-N 3.11Å; T188-R191 PolarHBondContact O-N 3.15Å; T188-L192 HydrophobicContact CG2-CD1 4.18Å; T188-L192 WeakPolarHBondContact O-CG 3.35Å; T188-L192 PolarHBondContact O-N 2.98Å
189	A	95.3	Very high	92.4	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-61.5	-41.2	175.2	0	0	0	0	0	112.4	I125 P127 V150 H185 I186 L192 K193 V201	I125-A189 HydrophobicContact CG2-CB 3.98Å; P127-A189 HydrophobicContact CB-CB 3.96Å; P127-A189 HydrophobicContact CG-CB 4.02Å; V150-A189 HydrophobicContact CB-CB 4.3Å; V150-A189 HydrophobicContact CG2-CB 3.88Å; H185-A189 WeakPolarHBondContact O-CB 3.16Å; H185-A189 PolarHBondContact O-N 3.12Å; H185-A189 VanDerWaalsContact O-N 3.07Å; I186-A189 PolarHBondContact O-N 3.36Å; A189-L192 PolarHBondContact O-N 2.77Å; A189-K193 WeakPolarHBondContact O-CB 3.13Å; A189-K193 PolarHBondContact O-N 3.42Å; A189-V201 HydrophobicContact CB-CG2 4.38Å
190	W	94.1	Very high	93	Very high	31 Å²	31	51.7 Å²	51.7	12%	0.117	27%	0.265	C	S	.	.	H	α-helix	trans	-67.4	-36.3	176.4	-82.3	90.7	0	0	0	113.2	K24 W25 I26 I186 R187 T188 K193 S194	K24-W190 VanDerWaalsContact O-CZ3 3.28Å; K24-W190 WeakPolarHBondContact O-CZ3 3.35Å; W25-W190 AromaticContact CD1-CD1 3.43Å; W25-W190 VanDerWaalsContact CD1-CD1 3.43Å; W25-W190 AromaticContact CD1-CD2 3.84Å; W25-W190 AromaticContact CD1-CE2 3.96Å; W25-W190 AromaticContact CD1-CG 3.5Å; W25-W190 AromaticContact CD1-NE1 3.69Å; W25-W190 HydrophobicContact CG-CG 4.42Å; W25-W190 AromaticContact NE1-CD1 3.87Å; I26-W190 HydrophobicContact CB-CH2 4.07Å; I26-W190 HydrophobicContact CB-CZ2 4.04Å; I26-W190 HydrophobicContact CD1-CH2 3.9Å; I26-W190 HydrophobicContact CG1-CH2 3.72Å; I26-W190 HydrophobicContact CG1-CZ2 4.23Å; I26-W190 HydrophobicContact CG1-CZ3 4.35Å; I186-W190 VanDerWaalsContact O-CD1 3.28Å; I186-W190 PolarHBondContact O-N 3.28Å; I186-W190 VanDerWaalsContact O-N 3.12Å; R187-W190 PolarHBondContact O-N 2.76Å; T188-W190 VanDerWaalsContact C-N 3.34Å; T188-W190 PolarHBondContact O-N 3.11Å; W190-K193 HydrophobicContact CE3-CD 4.48Å; W190-K193 PolarHBondContact O-N 3.11Å; W190-S194 PolarHBondContact O-N 2.94Å
191	R	94.6	Very high	93.6	Very high	107 Å²	107	49.2 Å²	49.2	40%	0.404	25%	0.252	S	S	.	.	H	α-helix	trans	-61.7	-52.5	171.2	171.5	176.1	69.6	-166.5	-2.6	111	M23 R187 T188 K193 S194 E195	M23-R191 HydrophobicContact CE-CB 3.7Å; M23-R191 HydrophobicContact CE-CG 3.57Å; M23-R191 HydrophobicContact SD-CB 4.32Å; R187-R191 PolarHBondContact O-N 3.23Å; T188-R191 PolarHBondContact O-N 3.15Å; R191-K193 PolarHBondContact O-N 3.05Å; R191-S194 PolarHBondContact O-N 3.26Å; R191-S194 PolarHBondContact O-OG 3.49Å; R191-E195 WeakPolarHBondContact CD-OE1 3.39Å; R191-E195 HydrophobicContact CG-CG 4.48Å; R191-E195 WeakPolarHBondContact CG-OE1 3.33Å; R191-E195 WeakPolarHBondContact O-CG 3.47Å; R191-E195 PolarHBondContact O-N 2.92Å
192	L	95.2	Very high	94	Very high	26 Å²	26	48.7 Å²	48.7	14%	0.136	25%	0.248	C	C	.	.	H	α-helix	trans	-57.5	-37.7	179	-69	171.1	0	0	0	111.7	I125 I148 V150 V171 T188 A189 S194 E195 I196	I125-L192 HydrophobicContact CD1-CB 3.98Å; I125-L192 HydrophobicContact CG2-CB 4.4Å; I148-L192 HydrophobicContact CG2-CD1 4.31Å; V150-L192 HydrophobicContact CG2-CD1 3.77Å; V171-L192 HydrophobicContact CB-CD1 4.48Å; V171-L192 HydrophobicContact CG2-CD1 3.98Å; T188-L192 HydrophobicContact CG2-CD1 4.18Å; T188-L192 WeakPolarHBondContact O-CG 3.35Å; T188-L192 PolarHBondContact O-N 2.98Å; A189-L192 PolarHBondContact O-N 2.77Å; L192-S194 VanDerWaalsContact C-N 3.29Å; L192-S194 PolarHBondContact O-N 3.04Å; L192-E195 PolarHBondContact O-N 2.73Å; L192-E195 VanDerWaalsContact O-N 3.15Å; L192-I196 HydrophobicContact CB-CD1 4.33Å; L192-I196 WeakPolarHBondContact O-CB 3.28Å; L192-I196 WeakPolarHBondContact O-CG1 3.21Å; L192-I196 PolarHBondContact O-N 3Å
193	K	95.7	Very high	94.5	Very high	75 Å²	75	46.1 Å²	46.1	33%	0.326	23%	0.231	S	C	.	.	H	α-helix	trans	-59.6	-36	173.7	175.3	175.1	174.4	-76.2	0	113.6	I125 A189 W190 R191 E195 S199 V201	I125-K193 HydrophobicContact CD1-CB 4.24Å; A189-K193 WeakPolarHBondContact O-CB 3.13Å; A189-K193 PolarHBondContact O-N 3.42Å; W190-K193 HydrophobicContact CE3-CD 4.48Å; W190-K193 PolarHBondContact O-N 3.11Å; R191-K193 PolarHBondContact O-N 3.05Å; K193-E195 VanDerWaalsContact C-N 3.34Å; K193-S199 WeakPolarHBondContact CA-OG 3.26Å; K193-S199 PolarHBondContact O-OG 3.08Å; K193-V201 HydrophobicContact CB-CG2 3.9Å; K193-V201 HydrophobicContact CD-CB 4.03Å; K193-V201 HydrophobicContact CD-CG2 3.75Å; K193-V201 HydrophobicContact CG-CG2 4.36Å
194	S	94.3	Very high	95	Very high	67 Å²	67	41.1 Å²	41.1	47%	0.469	21%	0.207	S	C	.	.	H	α-helix	trans	-76	-24	177	68.2	0	0	0	0	113.4	M23 W190 R191 L192	M23-S194 WeakPolarHBondContact CE-OG 3.07Å; W190-S194 PolarHBondContact O-N 2.94Å; R191-S194 PolarHBondContact O-N 3.26Å; R191-S194 PolarHBondContact O-OG 3.49Å; L192-S194 VanDerWaalsContact C-N 3.29Å; L192-S194 PolarHBondContact O-N 3.04Å
195	E	95.8	Very high	95.4	Very high	116 Å²	116	41.1 Å²	41.1	54%	0.542	21%	0.207	S	C	.	.	H	α-helix	trans	-91.6	-26.5	-177	-67.4	169.8	-179.6	0	0	112.7	R191 L192 K193	R191-E195 WeakPolarHBondContact CD-OE1 3.39Å; R191-E195 HydrophobicContact CG-CG 4.48Å; R191-E195 WeakPolarHBondContact CG-OE1 3.33Å; R191-E195 WeakPolarHBondContact O-CG 3.47Å; R191-E195 PolarHBondContact O-N 2.92Å; L192-E195 PolarHBondContact O-N 2.73Å; L192-E195 VanDerWaalsContact O-N 3.15Å; K193-E195 VanDerWaalsContact C-N 3.34Å
196	I	96.8	Very high	95.8	Very high	30 Å²	30	42.5 Å²	42.5	15%	0.154	21%	0.211	C	C	.	.	S	Bend	trans	-103.8	115.1	-175.1	-59.3	173	0	0	0	109.5	T123 I125 I148 L192 S199	T123-I196 HydrophobicContact CG2-CG2 4.39Å; I125-I196 HydrophobicContact CD1-CD1 4.11Å; I148-I196 HydrophobicContact CD1-CD1 3.37Å; L192-I196 HydrophobicContact CB-CD1 4.33Å; L192-I196 WeakPolarHBondContact O-CB 3.28Å; L192-I196 WeakPolarHBondContact O-CG1 3.21Å; L192-I196 PolarHBondContact O-N 3Å; I196-S199 VanDerWaalsContact O-CB 3.28Å; I196-S199 WeakPolarHBondContact O-CB 3.47Å; I196-S199 PolarHBondContact O-OG 3.19Å
197	P	96.7	Very high	96.1	Very high	102 Å²	102	44.4 Å²	44.4	66%	0.662	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.6	150.8	174.6	-22.8	33.3	0	0	0	112.3	S199	P197-S199 PolarHBondContact O-N 2.95Å
198	N	97.3	Very high	96.4	Very high	118 Å²	118	42.6 Å²	42.6	63%	0.631	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.5	38.4	178.4	-50.8	-36.9	0	0	0	112.9	D122 T123	D122-N198 WeakPolarHBondContact CB-O 3.26Å; T123-N198 PolarHBondContact N-O 3.45Å
199	S	97.9	Very high	96.7	Very high	11 Å²	11	42.6 Å²	42.6	8%	0.077	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	146.3	-179.6	74.5	0	0	0	0	113	T123 K193 I196 P197	T123-S199 CarbonylContact O-C 3.55Å; T123-S199 WeakPolarHBondContact O-CA 3.39Å; K193-S199 WeakPolarHBondContact CA-OG 3.26Å; K193-S199 PolarHBondContact O-OG 3.08Å; I196-S199 VanDerWaalsContact O-CB 3.28Å; I196-S199 WeakPolarHBondContact O-CB 3.47Å; I196-S199 PolarHBondContact O-OG 3.19Å; P197-S199 PolarHBondContact O-N 2.95Å
200	H	97.9	Very high	96.8	Very high	35 Å²	35	42.6 Å²	42.6	16%	0.162	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	136.1	-172.2	-53.5	-81.1	0	0	0	110.6	I117 L118 D122 T123 I125	I117-H200 PolarHBondContact O-CE1 2.9Å; I117-H200 PolarHBondContact O-NE2 3.34Å; I117-H200 VanDerWaalsContact O-NE2 3.15Å; L118-H200 VanDerWaalsContact CD1-CD2 3.47Å; L118-H200 WeakPolarHBondContact CD1-CD2 3.27Å; D122-H200 IonicContact OD2-CD2 3.11Å; D122-H200 IonicContact OD2-CE1 2.67Å; D122-H200 IonicContact OD2-NE2 3.57Å; D122-H200 PolarHBondContact OD2-NE2 3.22Å; T123-H200 PolarHBondContact O-N 3.09Å; I125-H200 PolarHBondContact N-O 2.81Å
201	V	97.3	Very high	97	Very high	20 Å²	20	41.8 Å²	41.8	12%	0.121	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	114.1	165.4	176.7	0	0	0	0	106.6	I125 A189 K193 D203	I125-V201 HydrophobicContact CB-CG2 3.98Å; I125-V201 HydrophobicContact CG2-CG2 4.23Å; I125-V201 VanDerWaalsContact O-CA 3.24Å; I125-V201 WeakPolarHBondContact O-CA 3.37Å; I125-V201 WeakPolarHBondContact O-CG2 3.16Å; A189-V201 HydrophobicContact CB-CG2 4.38Å; K193-V201 HydrophobicContact CB-CG2 3.9Å; K193-V201 HydrophobicContact CD-CB 4.03Å; K193-V201 HydrophobicContact CD-CG2 3.75Å; K193-V201 HydrophobicContact CG-CG2 4.36Å; V201-D203 VanDerWaalsContact C-N 3.29Å; V201-D203 HydrophobicContact CG1-CB 4.12Å
202	L	97.1	Very high	97.2	Very high	12 Å²	12	37.7 Å²	37.7	6%	0.063	21%	0.206	C	C	.	.			trans	-75.8	-24.8	-177.1	-63.2	-179.5	0	0	0	111.4	M108 V109 A112 I124 E126 L136 N207	M108-L202 HydrophobicContact CB-CB 4.31Å; M108-L202 HydrophobicContact CB-CD1 3.99Å; M108-L202 HydrophobicContact CE-CB 4.43Å; M108-L202 HydrophobicContact SD-CB 4.1Å; V109-L202 HydrophobicContact CG2-CD1 3.81Å; A112-L202 HydrophobicContact CB-CD2 4.02Å; I124-L202 HydrophobicContact CG2-CD1 4.13Å; I124-L202 HydrophobicContact CG2-CG 4.36Å; E126-L202 PolarHBondContact OE2-N 3.42Å; L136-L202 HydrophobicContact CD2-CD1 3.7Å; L202-N207 VanDerWaalsContact O-CB 3.25Å; L202-N207 WeakPolarHBondContact O-CB 3.43Å; L202-N207 PolarHBondContact O-ND2 3.33Å
203	D	96.4	Very high	97.4	Very high	13 Å²	13	36.6 Å²	36.6	7%	0.07	20%	0.201	C	C	.	.			trans	61.8	75.3	167.1	-164.9	-16.8	0	0	0	113.8	E126 V201 Y205 R206 N207	E126-D203 PolarHBondContact OE1-N 3.17Å; E126-D203 PolarHBondContact OE2-N 2.81Å; V201-D203 VanDerWaalsContact C-N 3.29Å; V201-D203 HydrophobicContact CG1-CB 4.12Å; D203-Y205 PolarHBondContact O-N 3.15Å; D203-Y205 WeakPolarHBondContact OD1-CB 3.24Å; D203-Y205 PolarHBondContact OD1-N 2.92Å; D203-R206 PolarHBondContact O-N 3.19Å; D203-R206 PolarHBondContact OD1-N 2.85Å; D203-R206 WeakPolarHBondContact OD2-CD 3.42Å; D203-N207 WeakPolarHBondContact O-CB 3.42Å; D203-N207 PolarHBondContact O-N 2.84Å
204	Q	97	Very high	97.6	Very high	0 Å²	0	33 Å²	33	0%	0	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-18.6	177.1	65	177.5	-39.2	0	0	115	I104 M108 E126 P127 T128 T132 N210 T239	I104-Q204 HydrophobicContact CD1-CB 4.07Å; M108-Q204 HydrophobicContact CE-CB 4.44Å; M108-Q204 HydrophobicContact SD-CB 4.36Å; E126-Q204 WeakPolarHBondContact OE1-CB 3.49Å; E126-Q204 WeakPolarHBondContact OE1-CG 3.42Å; E126-Q204 PolarHBondContact OE1-N 2.91Å; P127-Q204 PolarHBondContact O-NE2 3.15Å; T128-Q204 PolarHBondContact OG1-NE2 2.86Å; T132-Q204 HydrophobicContact CG2-CB 4.38Å; T132-Q204 PolarHBondContact OG1-OE1 3.2Å; Q204-N210 PolarHBondContact O-ND2 2.81Å; Q204-T239 HydrophobicContact CB-CG2 4.3Å; Q204-T239 HydrophobicContact CG-CG2 3.83Å
205	Y	97.1	Very high	97.8	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-23.5	-178.4	-54.1	-70.1	0	0	0	112.8	P28 P127 I186 D203 T239 Y287 F289 P291 T292 V293	P28-Y205 HydrophobicContact CB-CD2 4.15Å; P28-Y205 HydrophobicContact CB-CG 3.99Å; P127-Y205 HydrophobicContact CG-CE2 4.13Å; I186-Y205 HydrophobicContact CD1-CE2 4.29Å; I186-Y205 HydrophobicContact CG1-CE2 4.04Å; D203-Y205 PolarHBondContact O-N 3.15Å; D203-Y205 WeakPolarHBondContact OD1-CB 3.24Å; D203-Y205 PolarHBondContact OD1-N 2.92Å; Y205-T239 HydrophobicContact CD1-CG2 3.87Å; Y205-T239 HydrophobicContact CE1-CG2 3.9Å; Y205-Y287 AromaticContact CE1-CE1 3.71Å; Y205-Y287 HydrophobicContact CE1-CE1 3.71Å; Y205-Y287 HydrophobicContact CE1-CE2 4.08Å; Y205-Y287 AromaticContact CE1-CZ 3.48Å; Y205-Y287 VanDerWaalsContact CE1-CZ 3.48Å; Y205-Y287 WeakPolarHBondContact CE1-OH 3.43Å; Y205-Y287 AromaticContact CZ-CZ 3.99Å; Y205-Y287 PolarHBondContact OH-OH 2.92Å; Y205-F289 HydrophobicContact CD1-CE2 4.1Å; Y205-F289 AromaticContact CD1-CZ 3.89Å; Y205-F289 HydrophobicContact CD1-CZ 3.89Å; Y205-F289 AromaticContact CE1-CZ 3.97Å; Y205-F289 HydrophobicContact CE1-CZ 3.97Å; Y205-F289 HydrophobicContact CG-CE2 4.41Å; Y205-F289 HydrophobicContact CG-CZ 4.29Å; Y205-P291 HydrophobicContact CD1-CB 4.3Å; Y205-P291 HydrophobicContact CD1-CG 4.31Å; Y205-T292 WeakPolarHBondContact O-CB 3.46Å; Y205-T292 PolarHBondContact O-N 2.87Å; Y205-V293 WeakPolarHBondContact O-CG1 3.33Å; Y205-V293 WeakPolarHBondContact O-CG2 3.37Å; Y205-V293 PolarHBondContact O-N 3.42Å; Y205-V293 VanDerWaalsContact O-N 3.07Å
206	R	97.9	Very high	97.9	Very high	52 Å²	52	25.8 Å²	25.8	20%	0.196	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.6	-26.7	-174.9	-57.9	-177.3	58	66.9	14.3	113.7	I26 R27 D203 A208 T292	I26-R206 VanDerWaalsContact CG2-CZ 3.49Å; I26-R206 VanDerWaalsContact CG2-NE 3.31Å; R27-R206 WeakPolarHBondContact O-CD 3.48Å; R27-R206 PolarHBondContact O-NH1 2.94Å; D203-R206 PolarHBondContact O-N 3.19Å; D203-R206 PolarHBondContact OD1-N 2.85Å; D203-R206 WeakPolarHBondContact OD2-CD 3.42Å; R206-A208 PolarHBondContact O-N 2.88Å; R206-T292 PolarHBondContact NH1-OG1 3.08Å
207	N	98.4	Very high	98	Very high	42 Å²	42	26.3 Å²	26.3	23%	0.225	15%	0.149	C	C	.	.			trans	-71.8	124.5	-170.6	-166.9	-23.8	0	0	0	112	M108 L202 D203 S209 N210 P211 V293	M108-N207 HydrophobicContact CG-CB 4.43Å; M108-N207 HydrophobicContact SD-CB 4.12Å; L202-N207 VanDerWaalsContact O-CB 3.25Å; L202-N207 WeakPolarHBondContact O-CB 3.43Å; L202-N207 PolarHBondContact O-ND2 3.33Å; D203-N207 WeakPolarHBondContact O-CB 3.42Å; D203-N207 PolarHBondContact O-N 2.84Å; N207-S209 PolarHBondContact O-N 3.09Å; N207-S209 VanDerWaalsContact OD1-CB 3.27Å; N207-S209 WeakPolarHBondContact OD1-CB 3.43Å; N207-S209 PolarHBondContact OD1-N 3.32Å; N207-S209 PolarHBondContact OD1-OG 2.87Å; N207-N210 WeakPolarHBondContact O-CB 3.42Å; N207-N210 PolarHBondContact O-N 3.34Å; N207-N210 VanDerWaalsContact O-N 3.14Å; N207-P211 WeakPolarHBondContact O-CD 3.38Å; N207-V293 WeakPolarHBondContact O-CG1 3.43Å
208	A	98.6	Very high	98.1	Very high	32 Å²	32	21.5 Å²	21.5	26%	0.264	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-28.3	179.9	0	0	0	0	0	112.5	R206 N210 P211 L212	R206-A208 PolarHBondContact O-N 2.88Å; A208-N210 PolarHBondContact O-N 3.43Å; A208-N210 VanDerWaalsContact O-N 3.13Å; A208-P211 WeakPolarHBondContact O-CD 3.39Å; A208-P211 WeakPolarHBondContact O-CG 3.44Å; A208-L212 HydrophobicContact CB-CD1 3.92Å; A208-L212 VanDerWaalsContact O-CB 3.24Å; A208-L212 WeakPolarHBondContact O-CB 3.33Å; A208-L212 WeakPolarHBondContact O-CD1 3.38Å; A208-L212 WeakPolarHBondContact O-CG 3.26Å; A208-L212 PolarHBondContact O-N 3.28Å
209	S	98.8	Very high	98.1	Very high	6 Å²	6	15.9 Å²	15.9	4%	0.042	9%	0.088	C	C	.	.	H	α-helix	trans	-54.1	-30	174.7	-59.6	0	0	0	0	113.1	R107 D111 N207 A213	R107-S209 VanDerWaalsContact CG-O 3.31Å; R107-S209 WeakPolarHBondContact CG-O 3.21Å; D111-S209 WeakPolarHBondContact OD2-CB 3.47Å; D111-S209 PolarHBondContact OD2-OG 3.46Å; N207-S209 PolarHBondContact O-N 3.09Å; N207-S209 VanDerWaalsContact OD1-CB 3.27Å; N207-S209 WeakPolarHBondContact OD1-CB 3.43Å; N207-S209 PolarHBondContact OD1-N 3.32Å; N207-S209 PolarHBondContact OD1-OG 2.87Å; S209-A213 WeakPolarHBondContact O-CB 3.19Å; S209-A213 PolarHBondContact O-N 3.36Å
210	N	98.7	Very high	98.1	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-64.1	-65.8	176.6	169.3	8.6	0	0	0	112.2	I104 Q204 N207 A208 L212 A213 H214 T239 G241	I104-N210 HydrophobicContact CB-CB 4.25Å; I104-N210 HydrophobicContact CD1-CB 4.27Å; I104-N210 HydrophobicContact CG2-CB 4.28Å; I104-N210 WeakPolarHBondContact CG2-OD1 3.38Å; Q204-N210 PolarHBondContact O-ND2 2.81Å; N207-N210 WeakPolarHBondContact O-CB 3.42Å; N207-N210 PolarHBondContact O-N 3.34Å; N207-N210 VanDerWaalsContact O-N 3.14Å; A208-N210 PolarHBondContact O-N 3.43Å; A208-N210 VanDerWaalsContact O-N 3.13Å; N210-L212 VanDerWaalsContact C-N 3.26Å; N210-L212 PolarHBondContact O-N 2.88Å; N210-A213 PolarHBondContact O-N 2.89Å; N210-H214 PolarHBondContact O-CD2 3.19Å; N210-H214 VanDerWaalsContact O-CD2 3.3Å; N210-T239 PolarHBondContact ND2-OG1 2.83Å; N210-G241 WeakPolarHBondContact OD1-CA 3.47Å
211	P	98.8	Very high	98.1	Very high	14 Å²	14	16.4 Å²	16.4	9%	0.091	9%	0.089	C	C	.	.	H	α-helix	trans	-63	-31.6	176	24.2	-33.2	0	0	0	112.9	N207 A208 H214 Y215 G241 T244 G245 V293	N207-P211 WeakPolarHBondContact O-CD 3.38Å; A208-P211 WeakPolarHBondContact O-CD 3.39Å; A208-P211 WeakPolarHBondContact O-CG 3.44Å; P211-H214 PolarHBondContact O-N 3.35Å; P211-Y215 WeakPolarHBondContact O-CB 3.47Å; P211-Y215 PolarHBondContact O-N 2.84Å; P211-G241 WeakPolarHBondContact CA-O 3.28Å; P211-T244 HydrophobicContact CB-CG2 4.22Å; P211-G245 VanDerWaalsContact O-CA 3.25Å; P211-G245 WeakPolarHBondContact O-CA 3.16Å; P211-V293 HydrophobicContact CG-CB 4.12Å; P211-V293 HydrophobicContact CG-CG1 4.2Å
212	L	98.8	Very high	98.2	Very high	20 Å²	20	15.4 Å²	15.4	11%	0.105	8%	0.083	C	C	.	.	H	α-helix	trans	-65.4	-37.9	178.2	-72.1	168.9	0	0	0	112.9	H47 A208 N210 H214 Y215 D216	H47-L212 HydrophobicContact CB-CD1 3.6Å; H47-L212 HydrophobicContact CB-CD2 4.21Å; A208-L212 HydrophobicContact CB-CD1 3.92Å; A208-L212 VanDerWaalsContact O-CB 3.24Å; A208-L212 WeakPolarHBondContact O-CB 3.33Å; A208-L212 WeakPolarHBondContact O-CD1 3.38Å; A208-L212 WeakPolarHBondContact O-CG 3.26Å; A208-L212 PolarHBondContact O-N 3.28Å; N210-L212 VanDerWaalsContact C-N 3.26Å; N210-L212 PolarHBondContact O-N 2.88Å; L212-H214 PolarHBondContact O-N 3.14Å; L212-Y215 HydrophobicContact CD2-CD1 4.49Å; L212-Y215 PolarHBondContact O-N 3.38Å; L212-D216 WeakPolarHBondContact O-CB 3.39Å; L212-D216 PolarHBondContact O-N 3.48Å
213	A	98.7	Very high	98.3	Very high	3 Å²	3	15.6 Å²	15.6	3%	0.025	8%	0.084	C	C	.	.	H	α-helix	trans	-54.2	-40.6	174	0	0	0	0	0	111.2	R103 I104 R107 S209 N210 T217	R103-A213 HydrophobicContact CB-CB 4.32Å; I104-A213 HydrophobicContact CG2-CB 4.17Å; R107-A213 HydrophobicContact CB-CB 3.78Å; R107-A213 HydrophobicContact CG-CB 4.09Å; S209-A213 WeakPolarHBondContact O-CB 3.19Å; S209-A213 PolarHBondContact O-N 3.36Å; N210-A213 PolarHBondContact O-N 2.89Å; A213-T217 WeakPolarHBondContact O-CB 3.44Å; A213-T217 PolarHBondContact O-N 2.82Å; A213-T217 VanDerWaalsContact O-N 3.07Å; A213-T217 PolarHBondContact O-OG1 2.95Å
214	H	98.8	Very high	98.4	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	11%	0.107	C	C	.	.	I	π-helix	trans	-79.9	-34.8	-179.5	-62.6	-54.5	0	0	0	113.5	I104 N210 P211 L212 T218 A219 T242 V246	I104-H214 VanDerWaalsContact CG2-NE2 3.28Å; I104-H214 WeakPolarHBondContact CG2-NE2 3.46Å; N210-H214 PolarHBondContact O-CD2 3.19Å; N210-H214 VanDerWaalsContact O-CD2 3.3Å; P211-H214 PolarHBondContact O-N 3.35Å; L212-H214 PolarHBondContact O-N 3.14Å; H214-T218 PolarHBondContact ND1-OG1 3.4Å; H214-T218 PolarHBondContact O-N 3.42Å; H214-A219 WeakPolarHBondContact O-CB 3.28Å; H214-A219 PolarHBondContact O-N 2.83Å; H214-T242 WeakPolarHBondContact CD2-CA 3.44Å; H214-T242 PolarHBondContact CD2-N 3.39Å; H214-T242 PolarHBondContact CD2-OG1 2.63Å; H214-T242 PolarHBondContact NE2-OG1 3.07Å; H214-V246 HydrophobicContact CB-CG2 4.19Å
215	Y	98.6	Very high	98.4	Very high	12 Å²	12	24.2 Å²	24.2	5%	0.047	12%	0.124	C	C	.	.	I	π-helix	trans	-64.2	-47.6	174.5	177.8	-94.6	0	0	0	111.3	M42 P211 L212 G245 R248 K249 E252	M42-Y215 HydrophobicContact CE-CE1 4.22Å; M42-Y215 WeakPolarHBondContact CE-OH 3.39Å; M42-Y215 HydrophobicContact SD-CE1 4.5Å; P211-Y215 WeakPolarHBondContact O-CB 3.47Å; P211-Y215 PolarHBondContact O-N 2.84Å; L212-Y215 HydrophobicContact CD2-CD1 4.49Å; L212-Y215 PolarHBondContact O-N 3.38Å; Y215-G245 WeakPolarHBondContact CA-O 3.42Å; Y215-R248 HydrophobicContact CD2-CB 3.7Å; Y215-R248 HydrophobicContact CE2-CB 3.94Å; Y215-K249 HydrophobicContact CD2-CB 3.59Å; Y215-K249 VanDerWaalsContact CE1-CE 3.45Å; Y215-K249 HydrophobicContact CE2-CB 3.76Å; Y215-K249 HydrophobicContact CE2-CD 4.15Å; Y215-K249 HydrophobicContact CG-CB 4.31Å; Y215-K249 WeakPolarHBondContact O-CE 3.31Å; Y215-K249 PolarHBondContact OH-NZ 3.31Å; Y215-E252 WeakPolarHBondContact CE2-OE2 3.45Å; Y215-E252 VanDerWaalsContact OH-CD 3.25Å; Y215-E252 PolarHBondContact OH-OE1 2.83Å; Y215-E252 PolarHBondContact OH-OE2 2.98Å
216	D	98.3	Very high	98.5	Very high	20 Å²	20	24.3 Å²	24.3	11%	0.107	13%	0.125	C	C	.	.	I	π-helix	trans	-81.7	-27.4	-174.8	-66.4	-34.9	0	0	0	113.4	R107 L212 E220	R107-D216 IonicContact CZ-OD2 2.82Å; R107-D216 IonicContact NH1-OD2 3.08Å; R107-D216 PolarHBondContact NH1-OD2 3.42Å; R107-D216 IonicContact NH2-OD2 2.81Å; R107-D216 PolarHBondContact NH2-OD2 3Å; L212-D216 WeakPolarHBondContact O-CB 3.39Å; L212-D216 PolarHBondContact O-N 3.48Å; D216-E220 WeakPolarHBondContact O-CG 3.06Å
217	T	98.4	Very high	98.5	Very high	41 Å²	41	28.6 Å²	28.6	25%	0.252	15%	0.147	S	C	.	.	I	π-helix	trans	-118.8	-66.4	-176	73	0	0	0	0	113	R103 A213 A219 E220 E221	R103-T217 PolarHBondContact NH1-OG1 3.24Å; A213-T217 WeakPolarHBondContact O-CB 3.44Å; A213-T217 PolarHBondContact O-N 2.82Å; A213-T217 VanDerWaalsContact O-N 3.07Å; A213-T217 PolarHBondContact O-OG1 2.95Å; T217-A219 VanDerWaalsContact C-N 3.31Å; T217-A219 PolarHBondContact O-N 3.02Å; T217-E220 PolarHBondContact O-N 2.88Å; T217-E221 WeakPolarHBondContact O-CG 3.15Å; T217-E221 PolarHBondContact O-N 2.92Å
218	T	98.8	Very high	98.4	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.156	C	C	.	.	I	π-helix	trans	-56.5	-44.4	-171.2	-50.4	0	0	0	0	112.3	R103 H214 I222 V246	R103-T218 WeakPolarHBondContact CD-OG1 3.36Å; R103-T218 PolarHBondContact NE-OG1 2.97Å; H214-T218 PolarHBondContact ND1-OG1 3.4Å; H214-T218 PolarHBondContact O-N 3.42Å; T218-I222 HydrophobicContact CG2-CD1 4.2Å; T218-I222 WeakPolarHBondContact O-CD1 3.35Å; T218-I222 VanDerWaalsContact O-CG1 3.3Å; T218-I222 WeakPolarHBondContact O-CG1 3.41Å; T218-I222 PolarHBondContact O-N 3.19Å; T218-I222 VanDerWaalsContact O-N 3.07Å; T218-V246 HydrophobicContact CG2-CG2 4.11Å
219	A	98.5	Very high	98.3	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-70	-42.5	179.3	0	0	0	0	0	113.1	H214 T217 E221 I222 L223 V246 K249	H214-A219 WeakPolarHBondContact O-CB 3.28Å; H214-A219 PolarHBondContact O-N 2.83Å; T217-A219 VanDerWaalsContact C-N 3.31Å; T217-A219 PolarHBondContact O-N 3.02Å; A219-E221 VanDerWaalsContact C-N 3.32Å; A219-E221 PolarHBondContact O-N 3.18Å; A219-I222 PolarHBondContact O-N 3.26Å; A219-L223 WeakPolarHBondContact O-CB 3.34Å; A219-L223 VanDerWaalsContact O-CG 3.31Å; A219-L223 WeakPolarHBondContact O-CG 3.44Å; A219-L223 PolarHBondContact O-N 2.79Å; A219-V246 HydrophobicContact CB-CG1 4.49Å; A219-V246 HydrophobicContact CB-CG2 4.39Å; A219-K249 HydrophobicContact CB-CB 3.5Å; A219-K249 HydrophobicContact CB-CG 3.61Å
220	E	97.9	Very high	98.3	Very high	52 Å²	52	33.1 Å²	33.1	24%	0.243	17%	0.17	C	C	.	.	H	α-helix	trans	-63.9	-38.6	176.5	-66.8	-70.8	177.9	0	0	111.1	R52 D216 T217 L223 E224 K249	R52-E220 PolarHBondContact NH1-O 3.19Å; D216-E220 WeakPolarHBondContact O-CG 3.06Å; T217-E220 PolarHBondContact O-N 2.88Å; E220-L223 PolarHBondContact O-N 3.17Å; E220-E224 WeakPolarHBondContact O-CB 3.14Å; E220-E224 PolarHBondContact O-N 2.85Å; E220-K249 WeakPolarHBondContact OE1-CD 3.48Å; E220-K249 WeakPolarHBondContact OE1-CE 3.24Å; E220-K249 IonicContact OE1-NZ 3.6Å; E220-K249 PolarHBondContact OE1-NZ 3.38Å
221	E	98.6	Very high	98.2	Very high	5 Å²	5	35.4 Å²	35.4	2%	0.023	18%	0.182	C	C	.	.	H	α-helix	trans	-62	-45.6	172.4	-71	171.7	-155	0	0	111.7	H68 T69 K90 R103 T217 A219 E224 Q225	H68-E221 PolarHBondContact N-OE1 2.97Å; H68-E221 PolarHBondContact N-OE2 3.42Å; T69-E221 PolarHBondContact N-OE2 2.99Å; K90-E221 WeakPolarHBondContact CE-OE2 3.47Å; K90-E221 IonicContact NZ-OE2 3.76Å; K90-E221 PolarHBondContact NZ-OE2 3.26Å; R103-E221 IonicContact CZ-OE1 2.67Å; R103-E221 IonicContact CZ-OE2 2.79Å; R103-E221 IonicContact NH1-OE1 3.54Å; R103-E221 PolarHBondContact NH1-OE1 3.15Å; R103-E221 IonicContact NH1-OE2 3.75Å; R103-E221 IonicContact NH2-OE1 3.97Å; R103-E221 PolarHBondContact NH2-OE1 2.92Å; R103-E221 IonicContact NH2-OE2 3.92Å; R103-E221 PolarHBondContact NH2-OE2 3.36Å; T217-E221 WeakPolarHBondContact O-CG 3.15Å; T217-E221 PolarHBondContact O-N 2.92Å; A219-E221 VanDerWaalsContact C-N 3.32Å; A219-E221 PolarHBondContact O-N 3.18Å; E221-E224 PolarHBondContact O-N 3.23Å; E221-Q225 VanDerWaalsContact O-CB 3.24Å; E221-Q225 WeakPolarHBondContact O-CB 3.36Å; E221-Q225 WeakPolarHBondContact O-CG 3.24Å; E221-Q225 PolarHBondContact O-N 3.15Å; E221-Q225 PolarHBondContact O-OE1 3.49Å
222	I	98.8	Very high	98.2	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-61.9	-45.7	177	-70.3	163.5	0	0	0	110.4	K90 T218 A219 E224 Q225 C226 L230 V350 I352	K90-I222 HydrophobicContact CD-CG1 4.14Å; K90-I222 HydrophobicContact CG-CD1 4.32Å; K90-I222 HydrophobicContact CG-CG1 4.22Å; T218-I222 HydrophobicContact CG2-CD1 4.2Å; T218-I222 WeakPolarHBondContact O-CD1 3.35Å; T218-I222 VanDerWaalsContact O-CG1 3.3Å; T218-I222 WeakPolarHBondContact O-CG1 3.41Å; T218-I222 PolarHBondContact O-N 3.19Å; T218-I222 VanDerWaalsContact O-N 3.07Å; A219-I222 PolarHBondContact O-N 3.26Å; I222-E224 PolarHBondContact O-N 3.46Å; I222-Q225 PolarHBondContact O-N 3.45Å; I222-C226 WeakPolarHBondContact O-CB 3.32Å; I222-C226 PolarHBondContact O-N 3.48Å; I222-C226 PolarHBondContact O-SG 2.98Å; I222-C226 VanDerWaalsContact O-SG 3.4Å; I222-L230 HydrophobicContact CG2-CD2 3.7Å; I222-V350 HydrophobicContact CD1-CG1 4.33Å; I222-V350 HydrophobicContact CG1-CG1 4.46Å; I222-V350 HydrophobicContact CG2-CG1 4.42Å; I222-V350 HydrophobicContact CG2-CG2 4.28Å; I222-I352 HydrophobicContact CD1-CD1 3.74Å
223	L	98.4	Very high	98.3	Very high	16 Å²	16	33.9 Å²	33.9	8%	0.084	17%	0.174	C	C	.	.	H	α-helix	trans	-58.7	-46.5	178	-75.2	167.8	0	0	0	111.7	A219 E220 C226 E227 G228 K249 L250 K253 C254	A219-L223 WeakPolarHBondContact O-CB 3.34Å; A219-L223 VanDerWaalsContact O-CG 3.31Å; A219-L223 WeakPolarHBondContact O-CG 3.44Å; A219-L223 PolarHBondContact O-N 2.79Å; E220-L223 PolarHBondContact O-N 3.17Å; L223-C226 PolarHBondContact O-N 3.21Å; L223-E227 PolarHBondContact O-N 2.97Å; L223-E227 VanDerWaalsContact O-N 3.08Å; L223-G228 PolarHBondContact O-N 2.89Å; L223-K249 HydrophobicContact CD1-CG 3.96Å; L223-L250 HydrophobicContact CD1-CD2 4.06Å; L223-L250 HydrophobicContact CD2-CD2 3.55Å; L223-L250 HydrophobicContact CG-CD2 3.58Å; L223-K253 HydrophobicContact CD1-CB 3.81Å; L223-K253 HydrophobicContact CD1-CG 3.8Å; L223-K253 HydrophobicContact CD2-CB 4.1Å; L223-C254 WeakPolarHBondContact CD2-SG 3.47Å
224	E	98.1	Very high	98.3	Very high	118 Å²	118	33.8 Å²	33.8	55%	0.551	17%	0.173	S	C	*	.	H	α-helix	trans	-63.1	-49.7	177	-179.9	-180	178.5	0	0	111.7	R52 E220 E221 I222 C226 E227	R52-E224 IonicContact CZ-OE2 3.67Å; R52-E224 IonicContact NH1-OE2 2.72Å; R52-E224 PolarHBondContact NH1-OE2 2.99Å; R52-E224 IonicContact NH2-OE2 3.52Å; R52-E224 PolarHBondContact NH2-OE2 3.03Å; E220-E224 WeakPolarHBondContact O-CB 3.14Å; E220-E224 PolarHBondContact O-N 2.85Å; E221-E224 PolarHBondContact O-N 3.23Å; I222-E224 PolarHBondContact O-N 3.46Å; E224-C226 PolarHBondContact O-N 3.08Å; E224-E227 PolarHBondContact O-N 3.41Å
225	Q	98.6	Very high	98.3	Very high	75 Å²	75	34 Å²	34	35%	0.35	17%	0.174	S	C	.	.	H	α-helix	trans	-66.3	-26.6	-178.1	-69.6	170.2	-37.9	0	0	112.8	T69 L71 E221 I222	T69-Q225 PolarHBondContact O-NE2 2.79Å; L71-Q225 HydrophobicContact CB-CB 4.04Å; L71-Q225 HydrophobicContact CB-CG 4.34Å; L71-Q225 HydrophobicContact CD2-CB 3.65Å; L71-Q225 HydrophobicContact CG-CB 4.48Å; E221-Q225 VanDerWaalsContact O-CB 3.24Å; E221-Q225 WeakPolarHBondContact O-CB 3.36Å; E221-Q225 WeakPolarHBondContact O-CG 3.24Å; E221-Q225 PolarHBondContact O-N 3.15Å; E221-Q225 PolarHBondContact O-OE1 3.49Å; I222-Q225 PolarHBondContact O-N 3.45Å
226	C	98.4	Very high	98.2	Very high	2 Å²	2	34 Å²	34	1%	0.014	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.8	4	175	-68.7	0	0	0	0	113.5	L71 I222 L223 E224 G228 K229 R348	L71-C226 VanDerWaalsContact CD2-SG 3.52Å; I222-C226 WeakPolarHBondContact O-CB 3.32Å; I222-C226 PolarHBondContact O-N 3.48Å; I222-C226 PolarHBondContact O-SG 2.98Å; I222-C226 VanDerWaalsContact O-SG 3.4Å; L223-C226 PolarHBondContact O-N 3.21Å; E224-C226 PolarHBondContact O-N 3.08Å; C226-G228 PolarHBondContact O-N 2.75Å; C226-K229 WeakPolarHBondContact CB-O 3.26Å; C226-K229 PolarHBondContact O-N 3.13Å; C226-R348 PolarHBondContact O-NH1 3.39Å
227	E	97.6	Very high	98.1	Very high	142 Å²	142	33.1 Å²	33.1	66%	0.664	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.3	36.2	-175.9	-57.1	169.8	-166.4	0	0	112.7	L223 E224 K229	L223-E227 PolarHBondContact O-N 2.97Å; L223-E227 VanDerWaalsContact O-N 3.08Å; E224-E227 PolarHBondContact O-N 3.41Å; E227-K229 PolarHBondContact O-N 3.49Å
228	G	95.8	Very high	97.9	Very high	41 Å²	41	31.5 Å²	31.5	42%	0.423	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.9	2.8	-176.9	0	0	0	0	0	115.6	L223 C226 C254	L223-G228 PolarHBondContact O-N 2.89Å; C226-G228 PolarHBondContact O-N 2.75Å; G228-C254 PolarHBondContact O-SG 2.78Å; G228-C254 VanDerWaalsContact O-SG 3.34Å
229	K	96.9	Very high	97.8	Very high	122 Å²	122	31.6 Å²	31.6	53%	0.53	17%	0.166	S	C	.	.			trans	-100.1	105.6	-179.4	-61.5	171.6	-172.8	164.7	0	110.3	C226 E227 R348	C226-K229 WeakPolarHBondContact CB-O 3.26Å; C226-K229 PolarHBondContact O-N 3.13Å; E227-K229 PolarHBondContact O-N 3.49Å; K229-R348 VanDerWaalsContact O-CD 3.28Å; K229-R348 WeakPolarHBondContact O-CD 3.4Å
230	L	97.9	Very high	97.8	Very high	13 Å²	13	31.8 Å²	31.8	7%	0.068	17%	0.168	C	C	.	.			trans	-153.8	128.8	-176.2	-173.7	63.3	0	0	0	111.3	I222 M232 V233 L250 V257 V350	I222-L230 HydrophobicContact CG2-CD2 3.7Å; L230-M232 WeakPolarHBondContact CD1-O 3.33Å; L230-V233 HydrophobicContact CD1-CG2 4.27Å; L230-V233 HydrophobicContact CD2-CG2 3.47Å; L230-V233 VanDerWaalsContact CD2-CG2 3.47Å; L230-V233 HydrophobicContact CG-CG2 4.06Å; L230-L250 HydrophobicContact CD2-CD1 3.85Å; L230-L250 HydrophobicContact CD2-CD2 4.06Å; L230-V257 HydrophobicContact CD2-CG2 4.2Å; L230-V257 HydrophobicContact CG-CG2 3.99Å; L230-V350 HydrophobicContact CD1-CB 4.02Å; L230-V350 HydrophobicContact CD1-CG2 3.41Å; L230-V350 VanDerWaalsContact CD1-CG2 3.41Å
231	D	98.6	Very high	97.8	Very high	47 Å²	47	29.3 Å²	29.3	25%	0.251	16%	0.156	S	C	.	.	S	Bend	trans	-109.4	-27.5	-175.9	-58.2	-94.5	0	0	0	112.1	K258 L343 Q347 R348	D231-K258 WeakPolarHBondContact O-CB 3.28Å; D231-K258 PolarHBondContact O-N 2.67Å; D231-L343 HydrophobicContact CB-CD2 4.16Å; D231-Q347 HydrophobicContact CB-CB 4.07Å; D231-Q347 PolarHBondContact OD1-NE2 3.21Å; D231-Q347 WeakPolarHBondContact OD2-CA 3.32Å; D231-Q347 WeakPolarHBondContact OD2-CB 3.49Å; D231-R348 PolarHBondContact N-O 2.95Å; D231-R348 PolarHBondContact OD2-N 3.01Å
232	M	98.8	Very high	97.8	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	141	-179.7	-172	177.8	-68.3	0	0	112.9	L230 V234 K258 I260 M339 Q342 L343 R348 C349 V350	L230-M232 WeakPolarHBondContact CD1-O 3.33Å; M232-V234 HydrophobicContact CG-CG2 4.03Å; M232-V234 HydrophobicContact SD-CG2 4.03Å; M232-K258 CarbonylContact C-O 3.55Å; M232-K258 VanDerWaalsContact CA-O 3.26Å; M232-K258 WeakPolarHBondContact CA-O 3.38Å; M232-K258 HydrophobicContact CB-CB 4.41Å; M232-K258 HydrophobicContact CE-CB 4.34Å; M232-K258 HydrophobicContact CE-CD 4.04Å; M232-K258 HydrophobicContact CG-CB 4.27Å; M232-I260 HydrophobicContact CE-CG1 4.45Å; M232-I260 HydrophobicContact CG-CG1 3.82Å; M232-I260 HydrophobicContact SD-CG1 3.87Å; M232-M339 HydrophobicContact CE-CB 4.46Å; M232-M339 WeakPolarHBondContact CE-O 3.4Å; M232-M339 HydrophobicContact SD-CB 4.1Å; M232-Q342 HydrophobicContact CE-CG 4.14Å; M232-L343 HydrophobicContact CB-CD1 3.88Å; M232-L343 HydrophobicContact CE-CD1 3.98Å; M232-L343 HydrophobicContact CE-CD2 4.05Å; M232-L343 HydrophobicContact CE-CG 3.96Å; M232-L343 HydrophobicContact SD-CD1 4.25Å; M232-R348 PolarHBondContact N-O 3.34Å; M232-C349 HydrophobicContact CB-CB 4.14Å; M232-C349 CarbonylContact O-C 3.55Å; M232-C349 WeakPolarHBondContact O-CA 3.28Å; M232-V350 PolarHBondContact O-N 2.66Å
233	V	98.8	Very high	97.8	Very high	3 Å²	3	30 Å²	30	2%	0.018	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	135.1	165.7	179.3	0	0	0	0	110	L230 V246 L250 V257 K258 I259 I260 V350 I352	L230-V233 HydrophobicContact CD1-CG2 4.27Å; L230-V233 HydrophobicContact CD2-CG2 3.47Å; L230-V233 VanDerWaalsContact CD2-CG2 3.47Å; L230-V233 HydrophobicContact CG-CG2 4.06Å; V233-V246 HydrophobicContact CG1-CG1 4.21Å; V233-L250 HydrophobicContact CB-CD1 4.3Å; V233-L250 HydrophobicContact CG2-CD1 3.47Å; V233-L250 VanDerWaalsContact CG2-CD1 3.47Å; V233-V257 HydrophobicContact CG2-CG2 4.33Å; V233-K258 PolarHBondContact N-O 2.91Å; V233-I259 HydrophobicContact CB-CD1 4.27Å; V233-I260 PolarHBondContact O-N 2.95Å; V233-V350 CarbonylContact C-O 3.58Å; V233-V350 VanDerWaalsContact CA-O 3.29Å; V233-V350 WeakPolarHBondContact CA-O 3.42Å; V233-V350 HydrophobicContact CG2-CB 4.35Å; V233-I352 HydrophobicContact CG1-CG1 4.44Å
234	V	98.9	Very high	97.8	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	124.1	-179.9	-169.1	0	0	0	0	109.7	M232 I260 V262 A332 A335 A336 V350 I352	M232-V234 HydrophobicContact CG-CG2 4.03Å; M232-V234 HydrophobicContact SD-CG2 4.03Å; V234-I260 HydrophobicContact CB-CB 4.33Å; V234-I260 HydrophobicContact CG1-CB 4.15Å; V234-I260 HydrophobicContact CG1-CG2 4.06Å; V234-I260 HydrophobicContact CG2-CB 4Å; V234-I260 HydrophobicContact CG2-CG1 4.15Å; V234-V262 HydrophobicContact CG1-CG2 3.78Å; V234-A332 WeakPolarHBondContact CG1-O 3.48Å; V234-A335 HydrophobicContact CG1-CB 4.04Å; V234-A336 HydrophobicContact CB-CB 4.13Å; V234-A336 HydrophobicContact CG1-CB 4.17Å; V234-A336 HydrophobicContact CG2-CB 3.83Å; V234-V350 PolarHBondContact N-O 3.2Å; V234-I352 PolarHBondContact O-N 3.47Å
235	A	98.6	Very high	97.8	Very high	4 Å²	4	23.7 Å²	23.7	3%	0.033	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	140.5	179.1	0	0	0	0	0	112.5	L243 I260 V262 I352	A235-L243 HydrophobicContact CB-CD1 4.09Å; A235-I260 PolarHBondContact N-O 3.29Å; A235-I260 VanDerWaalsContact N-O 3.09Å; A235-V262 PolarHBondContact O-N 3.24Å; A235-I352 HydrophobicContact CB-CB 4.09Å; A235-I352 HydrophobicContact CB-CG1 3.81Å
236	G	97.6	Very high	97.8	Very high	14 Å²	14	20.4 Å²	20.4	14%	0.144	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	141.6	170.5	0	0	0	0	0	112.9	V262	G236-V262 CarbonylContact C-O 3.58Å; G236-V262 WeakPolarHBondContact CA-O 3.3Å
237	A	96.5	Very high	97.8	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	12%	0.115	C	C	.	.			trans	-102.8	115.8	178.8	0	0	0	0	0	111	L243 V262 L269 I285 G286 W302	A237-L243 HydrophobicContact CB-CD2 4.49Å; A237-V262 PolarHBondContact N-O 2.9Å; A237-L269 HydrophobicContact CB-CD1 3.79Å; A237-L269 WeakPolarHBondContact O-CD1 3.23Å; A237-I285 CarbonylContact O-C 3.58Å; A237-I285 WeakPolarHBondContact O-CA 3.45Å; A237-I285 WeakPolarHBondContact O-CB 3.45Å; A237-G286 PolarHBondContact O-N 2.99Å; A237-W302 HydrophobicContact CB-CH2 3.84Å; A237-W302 HydrophobicContact CB-CZ3 3.72Å
238	G	94.3	Very high	97.8	Very high	7 Å²	7	15.1 Å²	15.1	7%	0.072	9%	0.09	C	C	.	.	S	Bend	trans	-101.5	-96.5	160.6	0	0	0	0	0	109	G240 Y287	G238-G240 PolarHBondContact O-N 3.12Å; G238-Y287 WeakPolarHBondContact O-CD2 3.49Å
239	T	96.7	Very high	97.9	Very high	3 Å²	3	13.6 Å²	13.6	2%	0.018	7%	0.071	C	C	.	.	S	Bend	trans	-60.8	-23.8	169.5	60.9	0	0	0	0	112.8	Q204 Y205 N210 G241 P291 V293	Q204-T239 HydrophobicContact CB-CG2 4.3Å; Q204-T239 HydrophobicContact CG-CG2 3.83Å; Y205-T239 HydrophobicContact CD1-CG2 3.87Å; Y205-T239 HydrophobicContact CE1-CG2 3.9Å; N210-T239 PolarHBondContact ND2-OG1 2.83Å; T239-G241 VanDerWaalsContact C-N 3.29Å; T239-G241 PolarHBondContact O-N 3.29Å; T239-G241 PolarHBondContact OG1-N 3.17Å; T239-P291 VanDerWaalsContact O-CB 3.31Å; T239-P291 WeakPolarHBondContact O-CB 3.47Å; T239-P291 WeakPolarHBondContact O-CG 3.46Å; T239-V293 VanDerWaalsContact O-CG2 3.24Å; T239-V293 WeakPolarHBondContact O-CG2 3.37Å
240	G	97.2	Very high	97.9	Very high	3 Å²	3	7.8 Å²	7.8	3%	0.031	5%	0.046	C	C	.	.	S	Bend	trans	83.8	-3.2	-174.9	0	0	0	0	0	114.8	G238 T242 L243 T244	G238-G240 PolarHBondContact O-N 3.12Å; G240-T242 PolarHBondContact O-N 3.01Å; G240-L243 PolarHBondContact O-N 3.4Å; G240-T244 VanDerWaalsContact O-CB 3.3Å; G240-T244 WeakPolarHBondContact O-CB 3.24Å; G240-T244 PolarHBondContact O-N 3.45Å; G240-T244 PolarHBondContact O-OG1 3.04Å
241	G	98.4	Very high	97.8	Very high	0 Å²	0	9.3 Å²	9.3	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-62.1	-41.9	-178.7	0	0	0	0	0	113.5	N210 P211 T239 T244 G245	N210-G241 WeakPolarHBondContact OD1-CA 3.47Å; P211-G241 WeakPolarHBondContact CA-O 3.28Å; T239-G241 VanDerWaalsContact C-N 3.29Å; T239-G241 PolarHBondContact O-N 3.29Å; T239-G241 PolarHBondContact OG1-N 3.17Å; G241-T244 PolarHBondContact O-N 3.37Å; G241-G245 PolarHBondContact O-N 3.35Å
242	T	98.8	Very high	97.6	Very high	13 Å²	13	9.8 Å²	9.8	8%	0.08	5%	0.053	C	C	.	.	H	α-helix	trans	-60.5	-51.4	175.2	-50.6	0	0	0	0	111.8	I100 H214 G240 T244 V246	I100-T242 HydrophobicContact CD1-CG2 3.46Å; I100-T242 VanDerWaalsContact CD1-CG2 3.46Å; H214-T242 WeakPolarHBondContact CD2-CA 3.44Å; H214-T242 PolarHBondContact CD2-N 3.39Å; H214-T242 PolarHBondContact CD2-OG1 2.63Å; H214-T242 PolarHBondContact NE2-OG1 3.07Å; G240-T242 PolarHBondContact O-N 3.01Å; T242-T244 VanDerWaalsContact C-N 3.34Å; T242-T244 PolarHBondContact O-N 2.93Å; T242-V246 HydrophobicContact CG2-CG2 4.38Å; T242-V246 VanDerWaalsContact O-CB 3.26Å; T242-V246 WeakPolarHBondContact O-CB 3.43Å; T242-V246 VanDerWaalsContact O-CG2 3.27Å; T242-V246 WeakPolarHBondContact O-CG2 3.35Å; T242-V246 PolarHBondContact O-N 3.32Å
243	L	97.9	Very high	97.4	Very high	6 Å²	6	16 Å²	16	3%	0.031	8%	0.08	C	C	.	.	H	α-helix	trans	-60.7	-45.9	-179.8	-166.9	68.5	0	0	0	110.7	A235 A237 G240 A247 I259 L294 V299 W302	A235-L243 HydrophobicContact CB-CD1 4.09Å; A237-L243 HydrophobicContact CB-CD2 4.49Å; G240-L243 PolarHBondContact O-N 3.4Å; L243-A247 WeakPolarHBondContact O-CB 3.29Å; L243-A247 PolarHBondContact O-N 3.47Å; L243-I259 HydrophobicContact CD1-CG2 3.68Å; L243-I259 HydrophobicContact CG-CG2 4.26Å; L243-L294 HydrophobicContact CD2-CD1 4.44Å; L243-V299 HydrophobicContact CD2-CG2 3.4Å; L243-V299 HydrophobicContact CG-CG2 4.03Å; L243-W302 HydrophobicContact CD2-CH2 3.66Å; L243-W302 HydrophobicContact CD2-CZ2 4.09Å; L243-W302 HydrophobicContact CD2-CZ3 4.21Å
244	T	98.7	Very high	97.2	Very high	2 Å²	2	16.7 Å²	16.7	1%	0.012	8%	0.084	C	C	.	.	H	α-helix	trans	-64.5	-53.5	-179.6	-58.8	0	0	0	0	112.1	P211 G240 G241 T242 V246 A247 R248 V293 D295	P211-T244 HydrophobicContact CB-CG2 4.22Å; G240-T244 VanDerWaalsContact O-CB 3.3Å; G240-T244 WeakPolarHBondContact O-CB 3.24Å; G240-T244 PolarHBondContact O-N 3.45Å; G240-T244 PolarHBondContact O-OG1 3.04Å; G241-T244 PolarHBondContact O-N 3.37Å; T242-T244 VanDerWaalsContact C-N 3.34Å; T242-T244 PolarHBondContact O-N 2.93Å; T244-V246 PolarHBondContact O-N 3.45Å; T244-A247 PolarHBondContact O-N 2.94Å; T244-R248 HydrophobicContact CG2-CG 4.48Å; T244-R248 WeakPolarHBondContact O-CB 3.38Å; T244-R248 VanDerWaalsContact O-CG 3.27Å; T244-R248 WeakPolarHBondContact O-CG 3.47Å; T244-R248 PolarHBondContact O-N 3.08Å; T244-V293 WeakPolarHBondContact CB-O 3.5Å; T244-V293 PolarHBondContact OG1-O 2.84Å; T244-V293 VanDerWaalsContact OG1-O 3.08Å; T244-D295 HydrophobicContact CG2-CB 3.61Å; T244-D295 PolarHBondContact OG1-N 2.81Å
245	G	98.6	Very high	96.8	Very high	1 Å²	1	20.4 Å²	20.4	1%	0.01	11%	0.109	C	C	.	.	H	α-helix	trans	-61.8	-46.1	-178	0	0	0	0	0	112.3	P211 Y215 G241 K249	P211-G245 VanDerWaalsContact O-CA 3.25Å; P211-G245 WeakPolarHBondContact O-CA 3.16Å; Y215-G245 WeakPolarHBondContact CA-O 3.42Å; G241-G245 PolarHBondContact O-N 3.35Å; G245-K249 PolarHBondContact O-N 3.43Å
246	V	98.7	Very high	96.6	Very high	5 Å²	5	27.4 Å²	27.4	3%	0.03	15%	0.146	C	C	.	.	H	α-helix	trans	-63.7	-48.1	176.8	174.1	0	0	0	0	111.2	H214 T218 A219 V233 T242 T244 R248 K249 L250	H214-V246 HydrophobicContact CB-CG2 4.19Å; T218-V246 HydrophobicContact CG2-CG2 4.11Å; A219-V246 HydrophobicContact CB-CG1 4.49Å; A219-V246 HydrophobicContact CB-CG2 4.39Å; V233-V246 HydrophobicContact CG1-CG1 4.21Å; T242-V246 HydrophobicContact CG2-CG2 4.38Å; T242-V246 VanDerWaalsContact O-CB 3.26Å; T242-V246 WeakPolarHBondContact O-CB 3.43Å; T242-V246 VanDerWaalsContact O-CG2 3.27Å; T242-V246 WeakPolarHBondContact O-CG2 3.35Å; T242-V246 PolarHBondContact O-N 3.32Å; T244-V246 PolarHBondContact O-N 3.45Å; V246-R248 PolarHBondContact O-N 2.93Å; V246-K249 PolarHBondContact O-N 3.07Å; V246-L250 HydrophobicContact CG1-CD1 3.43Å; V246-L250 VanDerWaalsContact CG1-CD1 3.43Å; V246-L250 HydrophobicContact CG1-CG 3.96Å; V246-L250 WeakPolarHBondContact O-CB 3.44Å; V246-L250 VanDerWaalsContact O-CG 3.22Å; V246-L250 WeakPolarHBondContact O-CG 3.44Å; V246-L250 PolarHBondContact O-N 2.87Å
247	A	98.3	Very high	96.6	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-61.9	-42.6	-178.8	0	0	0	0	0	112.8	L243 T244 K249 L250 K251 I259 L298	L243-A247 WeakPolarHBondContact O-CB 3.29Å; L243-A247 PolarHBondContact O-N 3.47Å; T244-A247 PolarHBondContact O-N 2.94Å; A247-K249 PolarHBondContact O-N 3.4Å; A247-L250 PolarHBondContact O-N 2.88Å; A247-K251 VanDerWaalsContact O-CB 3.29Å; A247-K251 WeakPolarHBondContact O-CB 3.48Å; A247-K251 VanDerWaalsContact O-CG 3.32Å; A247-K251 WeakPolarHBondContact O-CG 3.22Å; A247-K251 PolarHBondContact O-N 3.27Å; A247-I259 HydrophobicContact CB-CB 4.44Å; A247-I259 HydrophobicContact CB-CD1 4.14Å; A247-I259 HydrophobicContact CB-CG1 3.87Å; A247-I259 HydrophobicContact CB-CG2 3.91Å; A247-L298 HydrophobicContact CB-CB 3.79Å; A247-L298 HydrophobicContact CB-CD1 4.09Å
248	R	98.1	Very high	96.7	Very high	34 Å²	34	30 Å²	30	13%	0.128	15%	0.153	C	C	.	.	H	α-helix	trans	-57.3	-51.6	178.4	-75.2	-175.2	175.3	-172.9	-4.5	111.6	C34 W36 Y215 T244 V246 K251 E252 D295 L298	C34-R248 PolarHBondContact SG-NH1 2.94Å; W36-R248 HydrophobicContact CD2-CB 4.49Å; W36-R248 HydrophobicContact CD2-CG 3.89Å; W36-R248 HydrophobicContact CE3-CG 3.89Å; W36-R248 HydrophobicContact CH2-CB 4.02Å; W36-R248 HydrophobicContact CH2-CG 3.63Å; W36-R248 HydrophobicContact CZ2-CB 3.58Å; W36-R248 HydrophobicContact CZ2-CG 3.6Å; W36-R248 HydrophobicContact CZ3-CG 3.78Å; Y215-R248 HydrophobicContact CD2-CB 3.7Å; Y215-R248 HydrophobicContact CE2-CB 3.94Å; T244-R248 HydrophobicContact CG2-CG 4.48Å; T244-R248 WeakPolarHBondContact O-CB 3.38Å; T244-R248 VanDerWaalsContact O-CG 3.27Å; T244-R248 WeakPolarHBondContact O-CG 3.47Å; T244-R248 PolarHBondContact O-N 3.08Å; V246-R248 PolarHBondContact O-N 2.93Å; R248-K251 PolarHBondContact O-N 3.41Å; R248-E252 WeakPolarHBondContact O-CG 3.45Å; R248-E252 PolarHBondContact O-N 3.17Å; R248-D295 IonicContact CZ-OD2 3.4Å; R248-D295 IonicContact NE-OD2 3.71Å; R248-D295 IonicContact NH2-OD2 2.7Å; R248-D295 PolarHBondContact NH2-OD2 3.19Å; R248-L298 HydrophobicContact CB-CD1 4.42Å; R248-L298 HydrophobicContact CG-CD1 3.36Å
249	K	97.7	Very high	96.9	Very high	9 Å²	9	29.8 Å²	29.8	4%	0.039	15%	0.15	C	C	.	.	H	α-helix	trans	-64.7	-46.1	179.9	-178.8	64.7	67.8	164.6	0	111.7	Y215 A219 E220 L223 G245 V246 A247 K251 E252 K253	Y215-K249 HydrophobicContact CD2-CB 3.59Å; Y215-K249 VanDerWaalsContact CE1-CE 3.45Å; Y215-K249 HydrophobicContact CE2-CB 3.76Å; Y215-K249 HydrophobicContact CE2-CD 4.15Å; Y215-K249 HydrophobicContact CG-CB 4.31Å; Y215-K249 WeakPolarHBondContact O-CE 3.31Å; Y215-K249 PolarHBondContact OH-NZ 3.31Å; A219-K249 HydrophobicContact CB-CB 3.5Å; A219-K249 HydrophobicContact CB-CG 3.61Å; E220-K249 WeakPolarHBondContact OE1-CD 3.48Å; E220-K249 WeakPolarHBondContact OE1-CE 3.24Å; E220-K249 IonicContact OE1-NZ 3.6Å; E220-K249 PolarHBondContact OE1-NZ 3.38Å; L223-K249 HydrophobicContact CD1-CG 3.96Å; G245-K249 PolarHBondContact O-N 3.43Å; V246-K249 PolarHBondContact O-N 3.07Å; A247-K249 PolarHBondContact O-N 3.4Å; K249-K251 VanDerWaalsContact C-N 3.31Å; K249-K251 PolarHBondContact O-N 3.31Å; K249-E252 WeakPolarHBondContact O-CB 3.48Å; K249-E252 PolarHBondContact O-N 3.44Å; K249-E252 VanDerWaalsContact O-N 3.17Å; K249-K253 HydrophobicContact CD-CG 4.18Å; K249-K253 PolarHBondContact O-N 3.06Å; K249-K253 VanDerWaalsContact O-N 3.09Å
250	L	97.3	Very high	97	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-67.2	-32.7	-178.5	-66.1	-177	0	0	0	111.9	L223 L230 V233 V246 A247 E252 K253 C254 V257 I259	L223-L250 HydrophobicContact CD1-CD2 4.06Å; L223-L250 HydrophobicContact CD2-CD2 3.55Å; L223-L250 HydrophobicContact CG-CD2 3.58Å; L230-L250 HydrophobicContact CD2-CD1 3.85Å; L230-L250 HydrophobicContact CD2-CD2 4.06Å; V233-L250 HydrophobicContact CB-CD1 4.3Å; V233-L250 HydrophobicContact CG2-CD1 3.47Å; V233-L250 VanDerWaalsContact CG2-CD1 3.47Å; V246-L250 HydrophobicContact CG1-CD1 3.43Å; V246-L250 VanDerWaalsContact CG1-CD1 3.43Å; V246-L250 HydrophobicContact CG1-CG 3.96Å; V246-L250 WeakPolarHBondContact O-CB 3.44Å; V246-L250 VanDerWaalsContact O-CG 3.22Å; V246-L250 WeakPolarHBondContact O-CG 3.44Å; V246-L250 PolarHBondContact O-N 2.87Å; A247-L250 PolarHBondContact O-N 2.88Å; L250-E252 VanDerWaalsContact C-N 3.3Å; L250-E252 PolarHBondContact O-N 2.87Å; L250-K253 PolarHBondContact O-N 3.25Å; L250-C254 CarbonylContact O-C 3.1Å; L250-C254 VanDerWaalsContact O-CA 3.23Å; L250-C254 WeakPolarHBondContact O-CA 3.33Å; L250-C254 WeakPolarHBondContact O-CB 3.42Å; L250-C254 PolarHBondContact O-N 2.85Å; L250-C254 VanDerWaalsContact O-O 3.04Å; L250-V257 HydrophobicContact CB-CG1 3.84Å; L250-V257 HydrophobicContact CD1-CG2 4.49Å; L250-I259 HydrophobicContact CD1-CD1 4.14Å
251	K	94.9	Very high	97.1	Very high	45 Å²	45	29.6 Å²	29.6	20%	0.196	15%	0.148	C	C	.	.	H	α-helix	trans	-67.7	-28.8	173.1	-78.4	-51.6	-159	-167.5	0	113.8	A247 R248 K249 P255 V257 H300	A247-K251 VanDerWaalsContact O-CB 3.29Å; A247-K251 WeakPolarHBondContact O-CB 3.48Å; A247-K251 VanDerWaalsContact O-CG 3.32Å; A247-K251 WeakPolarHBondContact O-CG 3.22Å; A247-K251 PolarHBondContact O-N 3.27Å; R248-K251 PolarHBondContact O-N 3.41Å; K249-K251 VanDerWaalsContact C-N 3.31Å; K249-K251 PolarHBondContact O-N 3.31Å; K251-P255 PolarHBondContact NZ-O 3.43Å; K251-P255 WeakPolarHBondContact O-CA 3.16Å; K251-V257 HydrophobicContact CD-CG1 4.37Å; K251-V257 PolarHBondContact NZ-O 2.86Å; K251-H300 WeakPolarHBondContact CE-CE1 3.42Å; K251-H300 WeakPolarHBondContact CE-NE2 3.46Å; K251-H300 PolarHBondContact NZ-CE1 2.88Å; K251-H300 PolarHBondContact NZ-NE2 3.49Å
252	E	95	Very high	97.1	Very high	57 Å²	57	29.6 Å²	29.6	27%	0.266	15%	0.148	S	C	.	.	H	α-helix	trans	-74.7	-36.6	173.9	-67.4	162.3	-172.5	0	0	112.4	W36 Y215 R248 K249 L250	W36-E252 HydrophobicContact CZ2-CG 4.37Å; W36-E252 PolarHBondContact NE1-OE1 2.84Å; Y215-E252 WeakPolarHBondContact CE2-OE2 3.45Å; Y215-E252 VanDerWaalsContact OH-CD 3.25Å; Y215-E252 PolarHBondContact OH-OE1 2.83Å; Y215-E252 PolarHBondContact OH-OE2 2.98Å; R248-E252 WeakPolarHBondContact O-CG 3.45Å; R248-E252 PolarHBondContact O-N 3.17Å; K249-E252 WeakPolarHBondContact O-CB 3.48Å; K249-E252 PolarHBondContact O-N 3.44Å; K249-E252 VanDerWaalsContact O-N 3.17Å; L250-E252 VanDerWaalsContact C-N 3.3Å; L250-E252 PolarHBondContact O-N 2.87Å
253	K	94.9	Very high	97	Very high	130 Å²	130	29 Å²	29	57%	0.565	14%	0.144	S	C	*	.	H	α-helix	trans	-101.1	-31.3	-171.7	-61.6	-64.7	-172.5	176.9	0	114.5	L223 K249 L250	L223-K253 HydrophobicContact CD1-CB 3.81Å; L223-K253 HydrophobicContact CD1-CG 3.8Å; L223-K253 HydrophobicContact CD2-CB 4.1Å; K249-K253 HydrophobicContact CD-CG 4.18Å; K249-K253 PolarHBondContact O-N 3.06Å; K249-K253 VanDerWaalsContact O-N 3.09Å; L250-K253 PolarHBondContact O-N 3.25Å
254	C	94.3	Very high	96.8	Very high	17 Å²	17	28.7 Å²	28.7	12%	0.115	14%	0.143	C	C	.	.			trans	-135.2	69.3	-177.8	-62.3	0	0	0	0	109.1	L223 G228 L250 N256 V257	L223-C254 WeakPolarHBondContact CD2-SG 3.47Å; G228-C254 PolarHBondContact O-SG 2.78Å; G228-C254 VanDerWaalsContact O-SG 3.34Å; L250-C254 CarbonylContact O-C 3.1Å; L250-C254 VanDerWaalsContact O-CA 3.23Å; L250-C254 WeakPolarHBondContact O-CA 3.33Å; L250-C254 WeakPolarHBondContact O-CB 3.42Å; L250-C254 PolarHBondContact O-N 2.85Å; L250-C254 VanDerWaalsContact O-O 3.04Å; C254-N256 PolarHBondContact O-N 2.72Å; C254-V257 HydrophobicContact CB-CB 4.26Å; C254-V257 HydrophobicContact CB-CG1 4.43Å; C254-V257 WeakPolarHBondContact O-CB 3.49Å; C254-V257 WeakPolarHBondContact O-CG1 3.37Å; C254-V257 PolarHBondContact O-N 2.74Å
255	P	91.4	Very high	96.5	Very high	78 Å²	78	32.7 Å²	32.7	51%	0.506	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-26.3	-166.2	21.2	-33.9	0	0	0	114.8	K251	K251-P255 PolarHBondContact NZ-O 3.43Å; K251-P255 WeakPolarHBondContact O-CA 3.16Å
256	N	94.3	Very high	96	Very high	152 Å²	152	33.1 Å²	33.1	81%	0.813	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86	-4.3	-179.2	-63.4	-24.3	0	0	0	114.4	C254 K258	C254-N256 PolarHBondContact O-N 2.72Å; N256-K258 PolarHBondContact O-N 2.88Å
257	V	97.6	Very high	95.6	Very high	1 Å²	1	33.2 Å²	33.2	1%	0.006	17%	0.167	C	C	.	.			trans	-60.1	133.5	178.6	68.8	0	0	0	0	111	L230 V233 L250 K251 C254 I259 H300	L230-V257 HydrophobicContact CD2-CG2 4.2Å; L230-V257 HydrophobicContact CG-CG2 3.99Å; V233-V257 HydrophobicContact CG2-CG2 4.33Å; L250-V257 HydrophobicContact CB-CG1 3.84Å; L250-V257 HydrophobicContact CD1-CG2 4.49Å; K251-V257 HydrophobicContact CD-CG1 4.37Å; K251-V257 PolarHBondContact NZ-O 2.86Å; C254-V257 HydrophobicContact CB-CB 4.26Å; C254-V257 HydrophobicContact CB-CG1 4.43Å; C254-V257 WeakPolarHBondContact O-CB 3.49Å; C254-V257 WeakPolarHBondContact O-CG1 3.37Å; C254-V257 PolarHBondContact O-N 2.74Å; V257-I259 HydrophobicContact CG1-CD1 4Å; V257-I259 HydrophobicContact CG1-CG1 4.47Å; V257-I259 HydrophobicContact CG2-CD1 4.37Å; V257-H300 PolarHBondContact O-CE1 3.34Å; V257-H300 PolarHBondContact O-NE2 3.12Å
258	K	98.5	Very high	95.2	Very high	68 Å²	68	36.8 Å²	36.8	30%	0.296	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	122.7	172.7	-64.8	178.9	-179.7	177.4	0	109.6	D231 M232 V233 N256 I260 Q342	D231-K258 WeakPolarHBondContact O-CB 3.28Å; D231-K258 PolarHBondContact O-N 2.67Å; M232-K258 CarbonylContact C-O 3.55Å; M232-K258 VanDerWaalsContact CA-O 3.26Å; M232-K258 WeakPolarHBondContact CA-O 3.38Å; M232-K258 HydrophobicContact CB-CB 4.41Å; M232-K258 HydrophobicContact CE-CB 4.34Å; M232-K258 HydrophobicContact CE-CD 4.04Å; M232-K258 HydrophobicContact CG-CB 4.27Å; V233-K258 PolarHBondContact N-O 2.91Å; N256-K258 PolarHBondContact O-N 2.88Å; K258-I260 HydrophobicContact CB-CD1 4.48Å; K258-Q342 VanDerWaalsContact NZ-CD 3.29Å
259	I	98.5	Very high	94.8	Very high	2 Å²	2	35.2 Å²	35.2	1%	0.01	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	115.2	176.5	-55.7	-60.2	0	0	0	108	V233 L243 A247 L250 V257 H300	V233-I259 HydrophobicContact CB-CD1 4.27Å; L243-I259 HydrophobicContact CD1-CG2 3.68Å; L243-I259 HydrophobicContact CG-CG2 4.26Å; A247-I259 HydrophobicContact CB-CB 4.44Å; A247-I259 HydrophobicContact CB-CD1 4.14Å; A247-I259 HydrophobicContact CB-CG1 3.87Å; A247-I259 HydrophobicContact CB-CG2 3.91Å; L250-I259 HydrophobicContact CD1-CD1 4.14Å; V257-I259 HydrophobicContact CG1-CD1 4Å; V257-I259 HydrophobicContact CG1-CG1 4.47Å; V257-I259 HydrophobicContact CG2-CD1 4.37Å; I259-H300 WeakPolarHBondContact CB-ND1 3.35Å; I259-H300 PolarHBondContact N-CE1 3.27Å; I259-H300 VanDerWaalsContact N-CE1 3.27Å; I259-H300 PolarHBondContact N-ND1 3.23Å; I259-H300 WeakPolarHBondContact O-CB 3.33Å; I259-H300 PolarHBondContact O-N 2.81Å; I259-H300 PolarHBondContact O-ND1 2.98Å
260	I	98.6	Very high	94.2	Very high	1 Å²	1	36.3 Å²	36.3	1%	0.005	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	118.8	-179.8	-51.4	-53.9	0	0	0	109.3	M232 V233 V234 A235 K258 Q301 M339	M232-I260 HydrophobicContact CE-CG1 4.45Å; M232-I260 HydrophobicContact CG-CG1 3.82Å; M232-I260 HydrophobicContact SD-CG1 3.87Å; V233-I260 PolarHBondContact O-N 2.95Å; V234-I260 HydrophobicContact CB-CB 4.33Å; V234-I260 HydrophobicContact CG1-CB 4.15Å; V234-I260 HydrophobicContact CG1-CG2 4.06Å; V234-I260 HydrophobicContact CG2-CB 4Å; V234-I260 HydrophobicContact CG2-CG1 4.15Å; A235-I260 PolarHBondContact N-O 3.29Å; A235-I260 VanDerWaalsContact N-O 3.09Å; K258-I260 HydrophobicContact CB-CD1 4.48Å; I260-Q301 WeakPolarHBondContact CA-O 3.42Å; I260-Q301 HydrophobicContact CD1-CB 4.1Å; I260-M339 HydrophobicContact CD1-CE 3.82Å; I260-M339 HydrophobicContact CG1-CB 4.42Å; I260-M339 HydrophobicContact CG1-CE 4.44Å; I260-M339 HydrophobicContact CG2-CE 3.82Å; I260-M339 HydrophobicContact CG2-CG 4.07Å
261	G	98.4	Very high	92.9	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	136.2	173.4	0	0	0	0	0	110.8	Q301 W302 Y303	G261-Q301 PolarHBondContact N-O 3.37Å; G261-Q301 VanDerWaalsContact N-O 3.08Å; G261-W302 VanDerWaalsContact C-CE3 3.49Å; G261-W302 CarbonylContact O-C 3.57Å; G261-W302 WeakPolarHBondContact O-CA 3.23Å; G261-Y303 PolarHBondContact O-N 3.44Å
262	V	98.4	Very high	91.2	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	127.2	174.4	-174.6	0	0	0	0	109.6	V234 A235 G236 A237 Y303 A305 A335	V234-V262 HydrophobicContact CG1-CG2 3.78Å; A235-V262 PolarHBondContact O-N 3.24Å; G236-V262 CarbonylContact C-O 3.58Å; G236-V262 WeakPolarHBondContact CA-O 3.3Å; A237-V262 PolarHBondContact N-O 2.9Å; V262-Y303 WeakPolarHBondContact CA-O 3.25Å; V262-Y303 HydrophobicContact CG1-CD1 4.27Å; V262-A305 HydrophobicContact CG1-CB 3.91Å; V262-A335 HydrophobicContact CB-CB 4.46Å; V262-A335 HydrophobicContact CG1-CB 4.33Å; V262-A335 HydrophobicContact CG2-CB 3.33Å
263	D	96.6	Very high	89	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	132.7	-177.5	-170.3	36.5	0	0	0	108.4	S267 V270 W302 Y303 K304 A305	D263-S267 VanDerWaalsContact OD1-CB 3.26Å; D263-S267 WeakPolarHBondContact OD1-CB 3.37Å; D263-S267 PolarHBondContact OD1-OG 3.21Å; D263-S267 VanDerWaalsContact OD1-OG 3.12Å; D263-V270 HydrophobicContact CB-CG2 4.16Å; D263-V270 PolarHBondContact OD2-N 3.49Å; D263-W302 HydrophobicContact CB-CE3 4.06Å; D263-W302 HydrophobicContact CB-CZ3 4.19Å; D263-Y303 PolarHBondContact N-O 2.97Å; D263-K304 HydrophobicContact CB-CD 4.28Å; D263-K304 CarbonylContact O-C 3.53Å; D263-K304 VanDerWaalsContact O-CA 3.23Å; D263-K304 WeakPolarHBondContact O-CA 3.4Å; D263-K304 IonicContact OD2-NZ 2.94Å; D263-K304 PolarHBondContact OD2-NZ 3.44Å; D263-A305 PolarHBondContact O-N 3.25Å
264	P	95	Very high	87	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	151.1	178.8	28.6	-35	0	0	0	111.7	G266 S267 F280 V282 I285 A305	P264-G266 PolarHBondContact O-N 3.46Å; P264-S267 WeakPolarHBondContact O-CB 3.46Å; P264-S267 PolarHBondContact O-N 2.98Å; P264-F280 HydrophobicContact CB-CD2 4.33Å; P264-F280 HydrophobicContact CB-CG 4.28Å; P264-F280 HydrophobicContact CG-CD1 4.44Å; P264-F280 HydrophobicContact CG-CD2 4.26Å; P264-F280 HydrophobicContact CG-CE1 4.24Å; P264-F280 HydrophobicContact CG-CE2 4.04Å; P264-F280 HydrophobicContact CG-CG 4.45Å; P264-F280 HydrophobicContact CG-CZ 4.03Å; P264-V282 HydrophobicContact CB-CG1 3.8Å; P264-V282 HydrophobicContact CG-CG1 4.39Å; P264-I285 HydrophobicContact CB-CD1 4.42Å; P264-I285 HydrophobicContact CG-CD1 4.36Å; P264-I285 HydrophobicContact CG-CG1 4.05Å; P264-A305 WeakPolarHBondContact CA-O 3.23Å
265	E	92.5	Very high	85.1	Confident	86 Å²	86	55 Å²	55	40%	0.402	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	135.9	164.8	-70.4	173.7	-175.7	0	0	109.8	F280 K304 A305 S306	E265-F280 WeakPolarHBondContact O-CD1 3.41Å; E265-K304 HydrophobicContact CG-CB 4.27Å; E265-A305 PolarHBondContact N-O 2.91Å; E265-S306 VanDerWaalsContact OE2-CB 3.27Å; E265-S306 WeakPolarHBondContact OE2-CB 3.33Å
266	G	87.4	Confident	83.3	Confident	10 Å²	10	59.8 Å²	59.8	10%	0.103	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	90	-10.1	-174.2	0	0	0	0	0	115.7	P264 G278	P264-G266 PolarHBondContact O-N 3.46Å; G266-G278 PolarHBondContact O-N 3.37Å
267	S	91.1	Very high	81.8	Confident	8 Å²	8	56.4 Å²	56.4	6%	0.056	28%	0.282	C	S	.	.			trans	-84.7	151.2	171.6	-179	0	0	0	0	113.7	D263 P264 L269 G286 Y287 K304	D263-S267 VanDerWaalsContact OD1-CB 3.26Å; D263-S267 WeakPolarHBondContact OD1-CB 3.37Å; D263-S267 PolarHBondContact OD1-OG 3.21Å; D263-S267 VanDerWaalsContact OD1-OG 3.12Å; P264-S267 WeakPolarHBondContact O-CB 3.46Å; P264-S267 PolarHBondContact O-N 2.98Å; S267-L269 PolarHBondContact OG-N 2.96Å; S267-G286 VanDerWaalsContact OG-CA 3.23Å; S267-G286 WeakPolarHBondContact OG-CA 3.32Å; S267-Y287 PolarHBondContact OG-N 3.03Å; S267-Y287 PolarHBondContact OG-O 2.6Å; S267-K304 PolarHBondContact O-NZ 3.34Å
268	M	88.9	Confident	80.4	Confident	75 Å²	75	58 Å²	58	37%	0.369	30%	0.299	S	S	.	.	S	Bend	trans	-95.6	3.6	177	-62.2	-166.9	-178.8	0	0	115.3	V270 H271 Y287 D288	M268-V270 PolarHBondContact O-N 2.79Å; M268-H271 PolarHBondContact O-CE1 2.69Å; M268-H271 PolarHBondContact O-ND1 2.9Å; M268-Y287 PolarHBondContact N-O 2.89Å; M268-D288 VanDerWaalsContact SD-O 3.4Å
269	L	90	Very high	79.5	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	32%	0.316	C	S	.	.	S	Bend	trans	-59.4	-37.3	178.4	-64.3	-177.8	0	0	0	111.6	A237 S267 F289 P291 L294 R296	A237-L269 HydrophobicContact CB-CD1 3.79Å; A237-L269 WeakPolarHBondContact O-CD1 3.23Å; S267-L269 PolarHBondContact OG-N 2.96Å; L269-F289 VanDerWaalsContact CD2-O 3.27Å; L269-F289 WeakPolarHBondContact CD2-O 3.45Å; L269-P291 HydrophobicContact CD2-CG 4.5Å; L269-L294 HydrophobicContact CD2-CD2 3.95Å; L269-R296 WeakPolarHBondContact O-CD 3.38Å; L269-R296 PolarHBondContact O-NH1 3.3Å
270	V	85.1	Confident	79	Confident	32 Å²	32	62.6 Å²	62.6	19%	0.194	32%	0.321	C	S	.	.	S	Bend	trans	-121.3	122.4	171.6	-170.2	0	0	0	0	108.8	D263 M268 W302 K304	D263-V270 HydrophobicContact CB-CG2 4.16Å; D263-V270 PolarHBondContact OD2-N 3.49Å; M268-V270 PolarHBondContact O-N 2.79Å; V270-W302 HydrophobicContact CB-CG 4.44Å; V270-W302 HydrophobicContact CG1-CB 4.13Å; V270-W302 HydrophobicContact CG1-CG 4.17Å; V270-W302 HydrophobicContact CG2-CB 3.88Å; V270-W302 HydrophobicContact CG2-CD2 3.16Å; V270-W302 HydrophobicContact CG2-CE3 3.34Å; V270-W302 HydrophobicContact CG2-CG 3.41Å; V270-W302 VanDerWaalsContact CG2-CG 3.41Å; V270-W302 HydrophobicContact CG2-CH2 4.31Å; V270-W302 HydrophobicContact CG2-CZ2 4.18Å; V270-W302 HydrophobicContact CG2-CZ3 3.92Å; V270-K304 WeakPolarHBondContact O-CE 3.12Å; V270-K304 PolarHBondContact O-NZ 2.96Å
271	H	69.8	Low	78.7	Confident	144 Å²	144	64.4 Å²	64.4	67%	0.667	33%	0.33	S	S	*	.			trans	-80.7	128.2	175.4	-65.5	37.2	0	0	0	108.9	M268	M268-H271 PolarHBondContact O-CE1 2.69Å; M268-H271 PolarHBondContact O-ND1 2.9Å
272	S	57.9	Low	78.5	Confident	45 Å²	45	64.4 Å²	64.4	32%	0.315	33%	0.33	S	S	.	.			trans	-126.9	138.7	161.8	58.2	0	0	0	0	108.5	E274 H275	S272-E274 PolarHBondContact O-N 2.88Å; S272-E274 VanDerWaalsContact O-N 3.11Å; S272-H275 PolarHBondContact O-N 2.97Å; S272-H275 VanDerWaalsContact OG-CB 3.32Å; S272-H275 WeakPolarHBondContact OG-CB 3.49Å
273	E	50.1	Low	78.2	Confident	213 Å²	213	64.7 Å²	64.7	100%	0.995	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-21.8	179.9	-64.5	-176.4	166.6	0	0	112.3
274	E	51.9	Low	78	Confident	168 Å²	168	65.5 Å²	65.5	79%	0.785	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.1	-13	-175.5	-65.1	178.7	173.3	0	0	114.1	S272	S272-E274 PolarHBondContact O-N 2.88Å; S272-E274 VanDerWaalsContact O-N 3.11Å
275	H	54.6	Low	78	Confident	73 Å²	73	65.8 Å²	65.8	34%	0.338	34%	0.341	S	S	.	.			trans	-124.3	103.1	-170.4	-58.5	14.2	0	0	0	110.3	S272	S272-H275 PolarHBondContact O-N 2.97Å; S272-H275 VanDerWaalsContact OG-CB 3.32Å; S272-H275 WeakPolarHBondContact OG-CB 3.49Å
276	Q	54.9	Low	78	Confident	178 Å²	178	62.1 Å²	62.1	83%	0.832	33%	0.325	S	S	*	.			trans	-71.4	152.2	174.6	-66	179.7	0.9	0	0	110.6	G278	Q276-G278 PolarHBondContact O-N 2.92Å
277	S	62.3	Low	78.1	Confident	80 Å²	80	62.9 Å²	62.9	56%	0.559	33%	0.326	S	S	*	.			trans	-51.2	130.9	170.5	-175.8	0	0	0	0	110
278	G	68.2	Low	77.9	Confident	35 Å²	35	65.3 Å²	65.3	36%	0.361	34%	0.338	S	S	.	.			trans	-152.7	157.4	-169.4	0	0	0	0	0	112.2	G266 Q276 F280	G266-G278 PolarHBondContact O-N 3.37Å; Q276-G278 PolarHBondContact O-N 2.92Å; G278-F280 WeakPolarHBondContact O-CD1 3.27Å
279	H	78.9	Confident	78	Confident	141 Å²	141	62.1 Å²	62.1	65%	0.653	32%	0.322	S	S	*	.			trans	-73.7	135.7	174.8	-175.9	-68.6	0	0	0	110.2	E281	H279-E281 IonicContact CE1-OE1 2.86Å
280	F	89.1	Confident	78.2	Confident	25 Å²	25	64.2 Å²	64.2	11%	0.11	33%	0.333	C	S	.	.			trans	-133.4	148.6	172	53.6	-95.1	0	0	0	110.9	P264 E265 G278 V282 I285 D307	P264-F280 HydrophobicContact CB-CD2 4.33Å; P264-F280 HydrophobicContact CB-CG 4.28Å; P264-F280 HydrophobicContact CG-CD1 4.44Å; P264-F280 HydrophobicContact CG-CD2 4.26Å; P264-F280 HydrophobicContact CG-CE1 4.24Å; P264-F280 HydrophobicContact CG-CE2 4.04Å; P264-F280 HydrophobicContact CG-CG 4.45Å; P264-F280 HydrophobicContact CG-CZ 4.03Å; E265-F280 WeakPolarHBondContact O-CD1 3.41Å; G278-F280 WeakPolarHBondContact O-CD1 3.27Å; F280-V282 HydrophobicContact CB-CG1 4.46Å; F280-V282 HydrophobicContact CD2-CG1 3.71Å; F280-V282 VanDerWaalsContact CD2-O 3.32Å; F280-V282 WeakPolarHBondContact CD2-O 3.41Å; F280-V282 HydrophobicContact CE2-CG1 4.4Å; F280-V282 HydrophobicContact CG-CG1 4.42Å; F280-I285 WeakPolarHBondContact CE2-O 3.28Å; F280-D307 WeakPolarHBondContact CA-OD2 3.4Å
281	E	91.1	Very high	78.8	Confident	40 Å²	40	62.8 Å²	62.8	19%	0.187	32%	0.324	C	S	.	.			trans	-86.5	-28.8	-177.3	-64.3	-67.7	161.1	0	0	112.5	H279 E283 D307 F311 W369 K373 F375	H279-E281 IonicContact CE1-OE1 2.86Å; E281-E283 PolarHBondContact O-N 2.89Å; E281-D307 WeakPolarHBondContact CB-OD2 3.26Å; E281-D307 PolarHBondContact N-OD1 3.04Å; E281-D307 PolarHBondContact N-OD2 3.29Å; E281-F311 HydrophobicContact CB-CE2 3.81Å; E281-F311 HydrophobicContact CB-CZ 3.89Å; E281-W369 HydrophobicContact CB-CH2 4.08Å; E281-W369 HydrophobicContact CB-CZ2 4.33Å; E281-W369 HydrophobicContact CG-CH2 4.37Å; E281-W369 HydrophobicContact CG-CZ2 4.37Å; E281-K373 HydrophobicContact CG-CD 4.38Å; E281-K373 WeakPolarHBondContact OE1-CE 3.23Å; E281-K373 IonicContact OE1-NZ 2.77Å; E281-K373 PolarHBondContact OE1-NZ 3.19Å; E281-K373 IonicContact OE2-NZ 3.73Å; E281-F375 HydrophobicContact CB-CE2 4.45Å; E281-F375 HydrophobicContact CG-CE2 4.19Å; E281-F375 HydrophobicContact CG-CZ 4.11Å
282	V	94.8	Very high	80.1	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	30%	0.297	C	S	.	.			trans	-58.4	135.2	177.5	64.6	0	0	0	0	111.2	P264 F280 I285 D307 T310 F311	P264-V282 HydrophobicContact CB-CG1 3.8Å; P264-V282 HydrophobicContact CG-CG1 4.39Å; F280-V282 HydrophobicContact CB-CG1 4.46Å; F280-V282 HydrophobicContact CD2-CG1 3.71Å; F280-V282 VanDerWaalsContact CD2-O 3.32Å; F280-V282 WeakPolarHBondContact CD2-O 3.41Å; F280-V282 HydrophobicContact CE2-CG1 4.4Å; F280-V282 HydrophobicContact CG-CG1 4.42Å; V282-I285 HydrophobicContact CG1-CD1 4.19Å; V282-I285 HydrophobicContact CG1-CG1 4.05Å; V282-I285 HydrophobicContact CG2-CD1 3.98Å; V282-I285 HydrophobicContact CG2-CG1 3.97Å; V282-D307 WeakPolarHBondContact CB-OD1 3.45Å; V282-D307 WeakPolarHBondContact CG1-OD1 3.33Å; V282-D307 PolarHBondContact N-OD1 2.81Å; V282-T310 HydrophobicContact CB-CG2 4.16Å; V282-T310 HydrophobicContact CG2-CG2 3.82Å; V282-F311 HydrophobicContact CB-CZ 4.27Å
283	E	92.9	Very high	82.1	Confident	6 Å²	6	55.1 Å²	55.1	3%	0.028	29%	0.286	C	S	.	.			trans	-105.3	144.8	-178.2	-59.3	-179.7	-135.5	0	0	111.8	K159 E281 Y360 K363	K159-E283 IonicContact NZ-OE2 2.89Å; K159-E283 PolarHBondContact NZ-OE2 3.07Å; E281-E283 PolarHBondContact O-N 2.89Å; E283-Y360 HydrophobicContact CB-CE1 4.09Å; E283-Y360 HydrophobicContact CG-CE1 4.34Å; E283-K363 WeakPolarHBondContact OE1-CD 3.45Å; E283-K363 WeakPolarHBondContact OE1-CE 3.46Å; E283-K363 IonicContact OE1-NZ 3.89Å; E283-K363 PolarHBondContact OE1-NZ 2.6Å
284	G	91.1	Very high	84.3	Confident	16 Å²	16	45.7 Å²	45.7	17%	0.165	24%	0.242	C	C	.	.	S	Bend	trans	91.6	-4.7	169.6	0	0	0	0	0	116.2
285	I	94.8	Very high	86.5	Confident	7 Å²	7	39.3 Å²	39.3	4%	0.036	21%	0.213	C	C	.	.	S	Bend	trans	-128.8	155.7	173	59.1	172.8	0	0	0	110.3	A237 P264 F280 V282	A237-I285 CarbonylContact O-C 3.58Å; A237-I285 WeakPolarHBondContact O-CA 3.45Å; A237-I285 WeakPolarHBondContact O-CB 3.45Å; P264-I285 HydrophobicContact CB-CD1 4.42Å; P264-I285 HydrophobicContact CG-CD1 4.36Å; P264-I285 HydrophobicContact CG-CG1 4.05Å; F280-I285 WeakPolarHBondContact CE2-O 3.28Å; V282-I285 HydrophobicContact CG1-CD1 4.19Å; V282-I285 HydrophobicContact CG1-CG1 4.05Å; V282-I285 HydrophobicContact CG2-CD1 3.98Å; V282-I285 HydrophobicContact CG2-CG1 3.97Å
286	G	92.9	Very high	88.5	Confident	8 Å²	8	41 Å²	41	8%	0.082	22%	0.216	C	C	.	.			trans	76.9	140.9	-178	0	0	0	0	0	114.7	A237 S267	A237-G286 PolarHBondContact O-N 2.99Å; S267-G286 VanDerWaalsContact OG-CA 3.23Å; S267-G286 WeakPolarHBondContact OG-CA 3.32Å
287	Y	89.6	Confident	90.3	Very high	27 Å²	27	37.2 Å²	37.2	11%	0.106	21%	0.209	C	C	.	.			trans	-141.5	164.8	171.4	-81.4	-85.3	0	0	0	111.8	Y205 G238 S267 M268 F289	Y205-Y287 AromaticContact CE1-CE1 3.71Å; Y205-Y287 HydrophobicContact CE1-CE1 3.71Å; Y205-Y287 HydrophobicContact CE1-CE2 4.08Å; Y205-Y287 AromaticContact CE1-CZ 3.48Å; Y205-Y287 VanDerWaalsContact CE1-CZ 3.48Å; Y205-Y287 WeakPolarHBondContact CE1-OH 3.43Å; Y205-Y287 AromaticContact CZ-CZ 3.99Å; Y205-Y287 PolarHBondContact OH-OH 2.92Å; G238-Y287 WeakPolarHBondContact O-CD2 3.49Å; S267-Y287 PolarHBondContact OG-N 3.03Å; S267-Y287 PolarHBondContact OG-O 2.6Å; M268-Y287 PolarHBondContact N-O 2.89Å; Y287-F289 VanDerWaalsContact C-N 3.32Å; Y287-F289 WeakPolarHBondContact CB-O 3.45Å; Y287-F289 HydrophobicContact CD1-CD1 4.26Å; Y287-F289 AromaticContact CD1-CE1 3.5Å; Y287-F289 HydrophobicContact CD1-CE1 3.5Å; Y287-F289 AromaticContact CD1-CZ 3.77Å; Y287-F289 HydrophobicContact CD1-CZ 3.77Å; Y287-F289 HydrophobicContact CE1-CE1 4.16Å; Y287-F289 HydrophobicContact CE1-CZ 4.19Å; Y287-F289 HydrophobicContact CG-CE1 4.21Å; Y287-F289 HydrophobicContact CG-CZ 4.3Å
288	D	87.4	Confident	91.8	Very high	58 Å²	58	34 Å²	34	31%	0.31	19%	0.186	S	C	.	.	S	Bend	trans	-87.2	1.5	171	60.2	-28.8	0	0	0	112.9	F179 M268	F179-D288 WeakPolarHBondContact CD1-OD2 3.43Å; F179-D288 PolarHBondContact N-OD2 3.04Å; M268-D288 VanDerWaalsContact SD-O 3.4Å
289	F	90.6	Very high	93.1	Very high	9 Å²	9	33.3 Å²	33.3	4%	0.039	18%	0.175	C	C	.	.	S	Bend	trans	-141.9	169.7	173.3	65.4	-88.7	0	0	0	110.4	P28 D29 F179 I186 Y205 L269 Y287 P291	P28-F289 HydrophobicContact CB-CD2 4.32Å; P28-F289 HydrophobicContact CB-CE2 3.63Å; P28-F289 HydrophobicContact CB-CZ 3.99Å; P28-F289 HydrophobicContact CG-CD2 3.98Å; P28-F289 HydrophobicContact CG-CE1 4.32Å; P28-F289 HydrophobicContact CG-CE2 3.61Å; P28-F289 HydrophobicContact CG-CG 4.5Å; P28-F289 HydrophobicContact CG-CZ 3.8Å; D29-F289 HydrophobicContact CB-CB 4.06Å; D29-F289 HydrophobicContact CB-CD2 3.91Å; D29-F289 HydrophobicContact CB-CG 4.34Å; F179-F289 HydrophobicContact CB-CD1 3.53Å; F179-F289 HydrophobicContact CB-CE1 3.72Å; F179-F289 HydrophobicContact CD1-CB 3.99Å; F179-F289 AromaticContact CD1-CD1 3.82Å; F179-F289 HydrophobicContact CD1-CD1 3.82Å; F179-F289 HydrophobicContact CD1-CG 4.28Å; F179-F289 HydrophobicContact CD2-CB 4.35Å; F179-F289 AromaticContact CD2-CD1 3.75Å; F179-F289 HydrophobicContact CD2-CD1 3.75Å; F179-F289 HydrophobicContact CD2-CE1 4.26Å; F179-F289 HydrophobicContact CD2-CG 4.07Å; F179-F289 HydrophobicContact CE1-CB 3.78Å; F179-F289 HydrophobicContact CE1-CD1 4.43Å; F179-F289 HydrophobicContact CE1-CG 4.46Å; F179-F289 HydrophobicContact CE2-CB 4.14Å; F179-F289 HydrophobicContact CE2-CD1 4.37Å; F179-F289 HydrophobicContact CE2-CG 4.25Å; F179-F289 HydrophobicContact CG-CB 4.25Å; F179-F289 AromaticContact CG-CD1 3.41Å; F179-F289 HydrophobicContact CG-CD1 3.41Å; F179-F289 VanDerWaalsContact CG-CD1 3.41Å; F179-F289 HydrophobicContact CG-CE1 4.04Å; F179-F289 HydrophobicContact CG-CG 4.07Å; F179-F289 HydrophobicContact CZ-CB 3.82Å; F179-F289 HydrophobicContact CZ-CG 4.41Å; I186-F289 HydrophobicContact CD1-CE1 3.85Å; I186-F289 HydrophobicContact CD1-CZ 3.99Å; Y205-F289 HydrophobicContact CD1-CE2 4.1Å; Y205-F289 AromaticContact CD1-CZ 3.89Å; Y205-F289 HydrophobicContact CD1-CZ 3.89Å; Y205-F289 AromaticContact CE1-CZ 3.97Å; Y205-F289 HydrophobicContact CE1-CZ 3.97Å; Y205-F289 HydrophobicContact CG-CE2 4.41Å; Y205-F289 HydrophobicContact CG-CZ 4.29Å; L269-F289 VanDerWaalsContact CD2-O 3.27Å; L269-F289 WeakPolarHBondContact CD2-O 3.45Å; Y287-F289 VanDerWaalsContact C-N 3.32Å; Y287-F289 WeakPolarHBondContact CB-O 3.45Å; Y287-F289 HydrophobicContact CD1-CD1 4.26Å; Y287-F289 AromaticContact CD1-CE1 3.5Å; Y287-F289 HydrophobicContact CD1-CE1 3.5Å; Y287-F289 AromaticContact CD1-CZ 3.77Å; Y287-F289 HydrophobicContact CD1-CZ 3.77Å; Y287-F289 HydrophobicContact CE1-CE1 4.16Å; Y287-F289 HydrophobicContact CE1-CZ 4.19Å; Y287-F289 HydrophobicContact CG-CE1 4.21Å; Y287-F289 HydrophobicContact CG-CZ 4.3Å; F289-P291 HydrophobicContact CD2-CG 4.31Å; F289-P291 HydrophobicContact CE2-CB 4.23Å; F289-P291 HydrophobicContact CE2-CG 3.86Å; F289-P291 WeakPolarHBondContact O-CD 3.29Å
290	I	94.9	Very high	94	Very high	44 Å²	44	30.7 Å²	30.7	23%	0.226	16%	0.163	C	C	.	.			trans	-101.4	110.1	178.4	-54.4	-179	0	0	0	108.9	D29 L294	D29-I290 VanDerWaalsContact CA-O 3.24Å; D29-I290 WeakPolarHBondContact CA-O 3.28Å; D29-I290 WeakPolarHBondContact CB-O 3.44Å; I290-L294 HydrophobicContact CG2-CD2 4.28Å
291	P	96.6	Very high	94.3	Very high	2 Å²	2	34.1 Å²	34.1	1%	0.013	18%	0.179	C	C	.	.			trans	-62.8	144.7	-178.4	-22.8	33.6	0	0	0	112.9	P28 Y205 T239 L269 F289 V293 L294	P28-P291 WeakPolarHBondContact O-CA 3.48Å; Y205-P291 HydrophobicContact CD1-CB 4.3Å; Y205-P291 HydrophobicContact CD1-CG 4.31Å; T239-P291 VanDerWaalsContact O-CB 3.31Å; T239-P291 WeakPolarHBondContact O-CB 3.47Å; T239-P291 WeakPolarHBondContact O-CG 3.46Å; L269-P291 HydrophobicContact CD2-CG 4.5Å; F289-P291 HydrophobicContact CD2-CG 4.31Å; F289-P291 HydrophobicContact CE2-CB 4.23Å; F289-P291 HydrophobicContact CE2-CG 3.86Å; F289-P291 WeakPolarHBondContact O-CD 3.29Å; P291-V293 HydrophobicContact CB-CG2 4.31Å; P291-V293 PolarHBondContact O-N 3.18Å; P291-V293 VanDerWaalsContact O-N 3.14Å; P291-L294 PolarHBondContact O-N 2.95Å
292	T	98.3	Very high	94.6	Very high	15 Å²	15	34.9 Å²	34.9	9%	0.092	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.1	-35	176.9	-62.3	0	0	0	0	113.2	P28 L30 S32 Y205 R206 L294	P28-T292 PolarHBondContact O-N 3.31Å; P28-T292 PolarHBondContact O-OG1 2.87Å; L30-T292 PolarHBondContact N-OG1 2.91Å; L30-T292 WeakPolarHBondContact O-CA 3.49Å; L30-T292 WeakPolarHBondContact O-CB 3.23Å; L30-T292 WeakPolarHBondContact O-CG2 3.37Å; L30-T292 PolarHBondContact O-OG1 3.35Å; S32-T292 WeakPolarHBondContact CB-O 3.43Å; Y205-T292 WeakPolarHBondContact O-CB 3.46Å; Y205-T292 PolarHBondContact O-N 2.87Å; R206-T292 PolarHBondContact NH1-OG1 3.08Å; T292-L294 VanDerWaalsContact C-N 3.31Å; T292-L294 PolarHBondContact O-N 3.21Å
293	V	98.3	Very high	94.7	Very high	13 Å²	13	36.6 Å²	36.6	8%	0.079	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-9.1	-178.6	-63.7	0	0	0	0	114.5	Y205 N207 P211 T239 T244 P291	Y205-V293 WeakPolarHBondContact O-CG1 3.33Å; Y205-V293 WeakPolarHBondContact O-CG2 3.37Å; Y205-V293 PolarHBondContact O-N 3.42Å; Y205-V293 VanDerWaalsContact O-N 3.07Å; N207-V293 WeakPolarHBondContact O-CG1 3.43Å; P211-V293 HydrophobicContact CG-CB 4.12Å; P211-V293 HydrophobicContact CG-CG1 4.2Å; T239-V293 VanDerWaalsContact O-CG2 3.24Å; T239-V293 WeakPolarHBondContact O-CG2 3.37Å; T244-V293 WeakPolarHBondContact CB-O 3.5Å; T244-V293 PolarHBondContact OG1-O 2.84Å; T244-V293 VanDerWaalsContact OG1-O 3.08Å; P291-V293 HydrophobicContact CB-CG2 4.31Å; P291-V293 PolarHBondContact O-N 3.18Å; P291-V293 VanDerWaalsContact O-N 3.14Å
294	L	97.9	Very high	94.8	Very high	14 Å²	14	38 Å²	38	7%	0.073	19%	0.193	C	C	.	.			trans	-86	113.1	-179.8	175.5	58.2	0	0	0	111.4	L243 L269 I290 P291 T292 R296 W302	L243-L294 HydrophobicContact CD2-CD1 4.44Å; L269-L294 HydrophobicContact CD2-CD2 3.95Å; I290-L294 HydrophobicContact CG2-CD2 4.28Å; P291-L294 PolarHBondContact O-N 2.95Å; T292-L294 VanDerWaalsContact C-N 3.31Å; T292-L294 PolarHBondContact O-N 3.21Å; L294-R296 HydrophobicContact CD1-CG 4.32Å; L294-R296 HydrophobicContact CD2-CG 3.88Å; L294-R296 HydrophobicContact CG-CG 3.78Å; L294-W302 HydrophobicContact CD1-CH2 4.33Å; L294-W302 HydrophobicContact CD2-CH2 4.48Å
295	D	97.3	Very high	95	Very high	34 Å²	34	37.3 Å²	37.3	18%	0.182	19%	0.185	C	C	.	.			trans	-98	92.6	171.9	-166.6	-19.2	0	0	0	110.8	T244 R248 S297 L298	T244-D295 HydrophobicContact CG2-CB 3.61Å; T244-D295 PolarHBondContact OG1-N 2.81Å; R248-D295 IonicContact CZ-OD2 3.4Å; R248-D295 IonicContact NE-OD2 3.71Å; R248-D295 IonicContact NH2-OD2 2.7Å; R248-D295 PolarHBondContact NH2-OD2 3.19Å; D295-S297 PolarHBondContact O-N 2.66Å; D295-S297 WeakPolarHBondContact OD1-CB 3.28Å; D295-S297 PolarHBondContact OD1-N 2.95Å; D295-S297 PolarHBondContact OD1-OG 3.41Å; D295-L298 HydrophobicContact CB-CD1 4.1Å
296	R	95.6	Very high	95.1	Very high	109 Å²	109	38.3 Å²	38.3	41%	0.411	19%	0.193	S	C	.	.	G	3₁₀ helix	trans	-69.2	-20	-177.4	-60.8	-178.3	-67.4	167.8	1.2	113.4	L269 L294 L298 V299 W302	L269-R296 WeakPolarHBondContact O-CD 3.38Å; L269-R296 PolarHBondContact O-NH1 3.3Å; L294-R296 HydrophobicContact CD1-CG 4.32Å; L294-R296 HydrophobicContact CD2-CG 3.88Å; L294-R296 HydrophobicContact CG-CG 3.78Å; R296-L298 PolarHBondContact O-N 3.48Å; R296-V299 PolarHBondContact O-N 2.85Å; R296-W302 HydrophobicContact CB-CZ2 4.5Å; R296-W302 HydrophobicContact CG-CZ2 4.13Å
297	S	94.6	Very high	95.2	Very high	98 Å²	98	39 Å²	39	69%	0.685	20%	0.195	S	C	*	.	G	3₁₀ helix	trans	-66.3	-18.7	-176.5	73.8	0	0	0	0	113.4	D295	D295-S297 PolarHBondContact O-N 2.66Å; D295-S297 WeakPolarHBondContact OD1-CB 3.28Å; D295-S297 PolarHBondContact OD1-N 2.95Å; D295-S297 PolarHBondContact OD1-OG 3.41Å
298	L	93.3	Very high	95.5	Very high	14 Å²	14	43.9 Å²	43.9	7%	0.073	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-87.9	-11.3	-179.5	-61.3	174.5	0	0	0	113.7	W36 A247 R248 D295 R296 H300	W36-L298 HydrophobicContact CH2-CD1 4.27Å; W36-L298 HydrophobicContact CH2-CD2 3.86Å; W36-L298 HydrophobicContact CZ3-CD1 4.05Å; W36-L298 HydrophobicContact CZ3-CD2 3.8Å; W36-L298 HydrophobicContact CZ3-CG 4.43Å; A247-L298 HydrophobicContact CB-CB 3.79Å; A247-L298 HydrophobicContact CB-CD1 4.09Å; R248-L298 HydrophobicContact CB-CD1 4.42Å; R248-L298 HydrophobicContact CG-CD1 3.36Å; D295-L298 HydrophobicContact CB-CD1 4.1Å; R296-L298 PolarHBondContact O-N 3.48Å; L298-H300 PolarHBondContact O-ND1 3.41Å
299	V	96.1	Very high	95.9	Very high	19 Å²	19	43 Å²	43	12%	0.115	21%	0.207	C	C	.	.			trans	-86	125.2	-177.3	-173.8	0	0	0	0	108.9	L243 R296 Q301 W302	L243-V299 HydrophobicContact CD2-CG2 3.4Å; L243-V299 HydrophobicContact CG-CG2 4.03Å; R296-V299 PolarHBondContact O-N 2.85Å; V299-Q301 WeakPolarHBondContact CG1-O 3.48Å; V299-W302 HydrophobicContact CB-CZ2 4.14Å; V299-W302 HydrophobicContact CG1-CD2 3.92Å; V299-W302 HydrophobicContact CG1-CG 4.05Å; V299-W302 HydrophobicContact CG1-CZ2 4.18Å; V299-W302 HydrophobicContact CG2-CH2 4.41Å; V299-W302 HydrophobicContact CG2-CZ2 3.65Å
300	H	96.2	Very high	96.3	Very high	87 Å²	87	42.5 Å²	42.5	40%	0.403	21%	0.205	S	C	.	.	S	Bend	trans	-78.1	-41.1	-177.8	-63.2	60.5	0	0	0	110.8	K251 V257 I259 L298	K251-H300 WeakPolarHBondContact CE-CE1 3.42Å; K251-H300 WeakPolarHBondContact CE-NE2 3.46Å; K251-H300 PolarHBondContact NZ-CE1 2.88Å; K251-H300 PolarHBondContact NZ-NE2 3.49Å; V257-H300 PolarHBondContact O-CE1 3.34Å; V257-H300 PolarHBondContact O-NE2 3.12Å; I259-H300 WeakPolarHBondContact CB-ND1 3.35Å; I259-H300 PolarHBondContact N-CE1 3.27Å; I259-H300 VanDerWaalsContact N-CE1 3.27Å; I259-H300 PolarHBondContact N-ND1 3.23Å; I259-H300 WeakPolarHBondContact O-CB 3.33Å; I259-H300 PolarHBondContact O-N 2.81Å; I259-H300 PolarHBondContact O-ND1 2.98Å; L298-H300 PolarHBondContact O-ND1 3.41Å
301	Q	96.6	Very high	96.5	Very high	97 Å²	97	40.7 Å²	40.7	45%	0.453	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	140.9	179.8	-162.3	177.1	-15.8	0	0	109.4	I260 G261 V299 M339	I260-Q301 WeakPolarHBondContact CA-O 3.42Å; I260-Q301 HydrophobicContact CD1-CB 4.1Å; G261-Q301 PolarHBondContact N-O 3.37Å; G261-Q301 VanDerWaalsContact N-O 3.08Å; V299-Q301 WeakPolarHBondContact CG1-O 3.48Å; Q301-M339 HydrophobicContact CB-CE 3.59Å; Q301-M339 HydrophobicContact CG-CE 3.45Å; Q301-M339 VanDerWaalsContact CG-CE 3.45Å; Q301-M339 VanDerWaalsContact OE1-CE 3.23Å
302	W	97.1	Very high	96.6	Very high	55 Å²	55	43.3 Å²	43.3	21%	0.208	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	145.6	173.3	-72.8	94.5	0	0	0	110.2	A237 L243 G261 D263 V270 L294 R296 V299	A237-W302 HydrophobicContact CB-CH2 3.84Å; A237-W302 HydrophobicContact CB-CZ3 3.72Å; L243-W302 HydrophobicContact CD2-CH2 3.66Å; L243-W302 HydrophobicContact CD2-CZ2 4.09Å; L243-W302 HydrophobicContact CD2-CZ3 4.21Å; G261-W302 VanDerWaalsContact C-CE3 3.49Å; G261-W302 CarbonylContact O-C 3.57Å; G261-W302 WeakPolarHBondContact O-CA 3.23Å; D263-W302 HydrophobicContact CB-CE3 4.06Å; D263-W302 HydrophobicContact CB-CZ3 4.19Å; V270-W302 HydrophobicContact CB-CG 4.44Å; V270-W302 HydrophobicContact CG1-CB 4.13Å; V270-W302 HydrophobicContact CG1-CG 4.17Å; V270-W302 HydrophobicContact CG2-CB 3.88Å; V270-W302 HydrophobicContact CG2-CD2 3.16Å; V270-W302 HydrophobicContact CG2-CE3 3.34Å; V270-W302 HydrophobicContact CG2-CG 3.41Å; V270-W302 VanDerWaalsContact CG2-CG 3.41Å; V270-W302 HydrophobicContact CG2-CH2 4.31Å; V270-W302 HydrophobicContact CG2-CZ2 4.18Å; V270-W302 HydrophobicContact CG2-CZ3 3.92Å; L294-W302 HydrophobicContact CD1-CH2 4.33Å; L294-W302 HydrophobicContact CD2-CH2 4.48Å; R296-W302 HydrophobicContact CB-CZ2 4.5Å; R296-W302 HydrophobicContact CG-CZ2 4.13Å; V299-W302 HydrophobicContact CB-CZ2 4.14Å; V299-W302 HydrophobicContact CG1-CD2 3.92Å; V299-W302 HydrophobicContact CG1-CG 4.05Å; V299-W302 HydrophobicContact CG1-CZ2 4.18Å; V299-W302 HydrophobicContact CG2-CH2 4.41Å; V299-W302 HydrophobicContact CG2-CZ2 3.65Å
303	Y	96.6	Very high	96.6	Very high	37 Å²	37	43.4 Å²	43.4	15%	0.145	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	125	175.7	-178.8	-86.4	0	0	0	109.2	G261 V262 D263 A305 E309 A335 K338 M339	G261-Y303 PolarHBondContact O-N 3.44Å; V262-Y303 WeakPolarHBondContact CA-O 3.25Å; V262-Y303 HydrophobicContact CG1-CD1 4.27Å; D263-Y303 PolarHBondContact N-O 2.97Å; Y303-A305 HydrophobicContact CD1-CB 4.26Å; Y303-A305 HydrophobicContact CE1-CB 3.99Å; Y303-E309 VanDerWaalsContact CE1-OE1 3.23Å; Y303-E309 WeakPolarHBondContact CE1-OE1 3.38Å; Y303-E309 VanDerWaalsContact OH-CD 3.24Å; Y303-E309 PolarHBondContact OH-OE1 3.07Å; Y303-E309 PolarHBondContact OH-OE2 2.84Å; Y303-A335 HydrophobicContact CD1-CB 3.4Å; Y303-A335 HydrophobicContact CD2-CB 4.37Å; Y303-A335 HydrophobicContact CE1-CB 4.07Å; Y303-A335 HydrophobicContact CG-CB 3.59Å; Y303-K338 HydrophobicContact CE2-CD 3.6Å; Y303-K338 WeakPolarHBondContact OH-CD 3.37Å; Y303-K338 WeakPolarHBondContact OH-CE 3.44Å; Y303-K338 PolarHBondContact OH-NZ 3.33Å; Y303-M339 HydrophobicContact CD2-SD 4.48Å
304	K	95.4	Very high	96.6	Very high	35 Å²	35	42.8 Å²	42.8	15%	0.152	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	121	175.1	-75.2	-70.6	-169	177.3	0	109.6	D263 E265 S267 V270	D263-K304 HydrophobicContact CB-CD 4.28Å; D263-K304 CarbonylContact O-C 3.53Å; D263-K304 VanDerWaalsContact O-CA 3.23Å; D263-K304 WeakPolarHBondContact O-CA 3.4Å; D263-K304 IonicContact OD2-NZ 2.94Å; D263-K304 PolarHBondContact OD2-NZ 3.44Å; E265-K304 HydrophobicContact CG-CB 4.27Å; S267-K304 PolarHBondContact O-NZ 3.34Å; V270-K304 WeakPolarHBondContact O-CE 3.12Å; V270-K304 PolarHBondContact O-NZ 2.96Å
305	A	95.6	Very high	96.6	Very high	1 Å²	1	45 Å²	45	1%	0.008	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	130	-177.9	0	0	0	0	0	112.2	V262 D263 P264 E265 Y303 E309	V262-A305 HydrophobicContact CG1-CB 3.91Å; D263-A305 PolarHBondContact O-N 3.25Å; P264-A305 WeakPolarHBondContact CA-O 3.23Å; E265-A305 PolarHBondContact N-O 2.91Å; Y303-A305 HydrophobicContact CD1-CB 4.26Å; Y303-A305 HydrophobicContact CE1-CB 3.99Å; A305-E309 VanDerWaalsContact CA-OE1 3.29Å; A305-E309 WeakPolarHBondContact CA-OE1 3.06Å
306	S	95.6	Very high	96.7	Very high	28 Å²	28	45.2 Å²	45.2	20%	0.196	21%	0.212	C	C	.	.			trans	-81.4	157.2	170.8	68.9	0	0	0	0	111.7	E265 R308 E309 T310	E265-S306 VanDerWaalsContact OE2-CB 3.27Å; E265-S306 WeakPolarHBondContact OE2-CB 3.33Å; S306-R308 VanDerWaalsContact C-N 3.3Å; S306-R308 PolarHBondContact O-N 2.96Å; S306-E309 PolarHBondContact N-OE1 3.13Å; S306-E309 WeakPolarHBondContact O-CG 3.1Å; S306-E309 WeakPolarHBondContact OG-CG 3.25Å; S306-E309 PolarHBondContact OG-N 2.74Å; S306-T310 WeakPolarHBondContact O-CB 3.43Å; S306-T310 PolarHBondContact O-N 3.25Å; S306-T310 PolarHBondContact O-OG1 3.48Å
307	D	96.1	Very high	96.9	Very high	23 Å²	23	40 Å²	40	12%	0.123	19%	0.192	C	C	.	.	H	α-helix	trans	-61.2	-38.9	174.5	-79.9	-32.8	0	0	0	112.1	F280 E281 V282 E309 T310 F311 F375	F280-D307 WeakPolarHBondContact CA-OD2 3.4Å; E281-D307 WeakPolarHBondContact CB-OD2 3.26Å; E281-D307 PolarHBondContact N-OD1 3.04Å; E281-D307 PolarHBondContact N-OD2 3.29Å; V282-D307 WeakPolarHBondContact CB-OD1 3.45Å; V282-D307 WeakPolarHBondContact CG1-OD1 3.33Å; V282-D307 PolarHBondContact N-OD1 2.81Å; D307-E309 PolarHBondContact O-N 3.4Å; D307-T310 WeakPolarHBondContact O-CB 3.49Å; D307-T310 PolarHBondContact O-N 3.17Å; D307-F311 HydrophobicContact CB-CD2 4.15Å; D307-F311 HydrophobicContact CB-CE2 3.78Å; D307-F311 WeakPolarHBondContact O-CD2 3.32Å; D307-F311 PolarHBondContact O-N 3.43Å; D307-F375 HydrophobicContact CB-CD1 4.49Å; D307-F375 HydrophobicContact CB-CE1 3.63Å; D307-F375 HydrophobicContact CB-CE2 4.13Å; D307-F375 HydrophobicContact CB-CZ 3.41Å; D307-F375 VanDerWaalsContact CB-CZ 3.41Å
308	R	95.7	Very high	97.1	Very high	129 Å²	129	37 Å²	37	49%	0.487	17%	0.168	S	C	.	.	H	α-helix	trans	-60.9	-49	-178.8	-174.9	174	-175.5	-177.1	2.4	111.4	S306 N312 F375 E377	S306-R308 VanDerWaalsContact C-N 3.3Å; S306-R308 PolarHBondContact O-N 2.96Å; R308-N312 WeakPolarHBondContact O-CB 3.36Å; R308-N312 PolarHBondContact O-N 3.24Å; R308-N312 PolarHBondContact O-ND2 2.66Å; R308-F375 HydrophobicContact CB-CD1 3.9Å; R308-F375 HydrophobicContact CG-CD1 4.43Å; R308-E377 IonicContact NH2-OE1 3.58Å
309	E	96.6	Very high	97.3	Very high	39 Å²	39	46.7 Å²	46.7	18%	0.182	20%	0.204	C	C	.	.	H	α-helix	trans	-71.2	-35.5	178.8	74.3	179.9	173.5	0	0	111.9	Y303 A305 S306 D307 M313 A334 K338	Y303-E309 VanDerWaalsContact CE1-OE1 3.23Å; Y303-E309 WeakPolarHBondContact CE1-OE1 3.38Å; Y303-E309 VanDerWaalsContact OH-CD 3.24Å; Y303-E309 PolarHBondContact OH-OE1 3.07Å; Y303-E309 PolarHBondContact OH-OE2 2.84Å; A305-E309 VanDerWaalsContact CA-OE1 3.29Å; A305-E309 WeakPolarHBondContact CA-OE1 3.06Å; S306-E309 PolarHBondContact N-OE1 3.13Å; S306-E309 WeakPolarHBondContact O-CG 3.1Å; S306-E309 WeakPolarHBondContact OG-CG 3.25Å; S306-E309 PolarHBondContact OG-N 2.74Å; D307-E309 PolarHBondContact O-N 3.4Å; E309-M313 VanDerWaalsContact O-CB 3.23Å; E309-M313 WeakPolarHBondContact O-CB 3.42Å; E309-M313 PolarHBondContact O-N 2.73Å; E309-A334 HydrophobicContact CG-CB 4.14Å; E309-K338 IonicContact OE2-NZ 2.7Å; E309-K338 PolarHBondContact OE2-NZ 2.98Å
310	T	98.5	Very high	97.4	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-54.8	-57.5	177	-72.2	0	0	0	0	111.4	V282 S306 D307 M313 A314 G327 G330 S331	V282-T310 HydrophobicContact CB-CG2 4.16Å; V282-T310 HydrophobicContact CG2-CG2 3.82Å; S306-T310 WeakPolarHBondContact O-CB 3.43Å; S306-T310 PolarHBondContact O-N 3.25Å; S306-T310 PolarHBondContact O-OG1 3.48Å; D307-T310 WeakPolarHBondContact O-CB 3.49Å; D307-T310 PolarHBondContact O-N 3.17Å; T310-M313 PolarHBondContact O-N 3.33Å; T310-A314 PolarHBondContact O-N 3.28Å; T310-G327 VanDerWaalsContact CG2-O 3.24Å; T310-G327 WeakPolarHBondContact CG2-O 3.14Å; T310-G330 WeakPolarHBondContact O-CA 3.47Å; T310-S331 WeakPolarHBondContact CB-OG 3.33Å; T310-S331 WeakPolarHBondContact CG2-OG 3.43Å; T310-S331 PolarHBondContact OG1-OG 3.24Å
311	F	98.6	Very high	97.5	Very high	5 Å²	5	45.1 Å²	45.1	2%	0.022	20%	0.195	C	C	.	.	H	α-helix	trans	-74	-36.5	-173.5	-63.1	-51.1	0	0	0	112.7	E281 V282 D307 M313 A314 R315 F364 W369 M370 F375	E281-F311 HydrophobicContact CB-CE2 3.81Å; E281-F311 HydrophobicContact CB-CZ 3.89Å; V282-F311 HydrophobicContact CB-CZ 4.27Å; D307-F311 HydrophobicContact CB-CD2 4.15Å; D307-F311 HydrophobicContact CB-CE2 3.78Å; D307-F311 WeakPolarHBondContact O-CD2 3.32Å; D307-F311 PolarHBondContact O-N 3.43Å; F311-M313 VanDerWaalsContact C-N 3.33Å; F311-M313 PolarHBondContact O-N 2.75Å; F311-A314 PolarHBondContact O-N 3.04Å; F311-R315 VanDerWaalsContact O-CG 3.31Å; F311-R315 WeakPolarHBondContact O-CG 3.44Å; F311-R315 PolarHBondContact O-N 2.89Å; F311-F364 HydrophobicContact CB-CB 3.94Å; F311-F364 HydrophobicContact CD1-CB 3.34Å; F311-F364 AromaticContact CD1-CD1 3.91Å; F311-F364 HydrophobicContact CD1-CD1 3.91Å; F311-F364 AromaticContact CD1-CG 3.69Å; F311-F364 HydrophobicContact CD1-CG 3.69Å; F311-F364 HydrophobicContact CE1-CB 3.97Å; F311-F364 HydrophobicContact CE1-CD1 4.16Å; F311-F364 HydrophobicContact CE1-CG 4.33Å; F311-F364 HydrophobicContact CG-CB 3.71Å; F311-F364 HydrophobicContact CG-CG 4.42Å; F311-W369 HydrophobicContact CD2-CH2 4.27Å; F311-W369 HydrophobicContact CD2-CZ3 4.1Å; F311-W369 AromaticContact CE2-CH2 3.74Å; F311-W369 HydrophobicContact CE2-CH2 3.74Å; F311-W369 HydrophobicContact CE2-CZ3 4.03Å; F311-W369 AromaticContact CZ-CH2 3.92Å; F311-W369 HydrophobicContact CZ-CH2 3.92Å; F311-W369 HydrophobicContact CZ-CZ3 4.39Å; F311-M370 HydrophobicContact CB-CE 3.64Å; F311-M370 HydrophobicContact CB-SD 3.64Å; F311-M370 HydrophobicContact CD2-SD 4.45Å; F311-M370 HydrophobicContact CG-SD 4.21Å; F311-F375 AromaticContact CD2-CD2 3.51Å; F311-F375 HydrophobicContact CD2-CD2 3.51Å; F311-F375 AromaticContact CD2-CE2 3.55Å; F311-F375 HydrophobicContact CD2-CE2 3.55Å; F311-F375 HydrophobicContact CD2-CG 4.25Å; F311-F375 HydrophobicContact CD2-CZ 4.33Å; F311-F375 AromaticContact CE2-CD2 3.98Å; F311-F375 HydrophobicContact CE2-CD2 3.98Å; F311-F375 AromaticContact CE2-CE2 3.51Å; F311-F375 HydrophobicContact CE2-CE2 3.51Å; F311-F375 HydrophobicContact CE2-CZ 4.17Å
312	N	98.1	Very high	97.6	Very high	58 Å²	58	43.2 Å²	43.2	31%	0.31	20%	0.201	S	C	.	.	H	α-helix	trans	-63.2	-41.2	174.8	-78.1	-59.5	0	0	0	111.5	R308 R315 K316 F375	R308-N312 WeakPolarHBondContact O-CB 3.36Å; R308-N312 PolarHBondContact O-N 3.24Å; R308-N312 PolarHBondContact O-ND2 2.66Å; N312-R315 PolarHBondContact O-N 3.19Å; N312-K316 WeakPolarHBondContact O-CB 3.46Å; N312-K316 PolarHBondContact O-N 2.83Å; N312-F375 PolarHBondContact ND2-O 3.44Å
313	M	98.8	Very high	97.7	Very high	16 Å²	16	41.2 Å²	41.2	8%	0.079	20%	0.195	C	C	.	.	H	α-helix	trans	-68.7	-38.9	175.8	-173.6	59.5	75.7	0	0	112.5	I77 F81 E309 T310 F311 R315 K316 L317 G330 M333 A334 V337	I77-M313 HydrophobicContact CD1-SD 4.47Å; I77-M313 HydrophobicContact CG2-SD 4.39Å; F81-M313 HydrophobicContact CE2-CE 3.93Å; F81-M313 HydrophobicContact CZ-CE 3.72Å; E309-M313 VanDerWaalsContact O-CB 3.23Å; E309-M313 WeakPolarHBondContact O-CB 3.42Å; E309-M313 PolarHBondContact O-N 2.73Å; T310-M313 PolarHBondContact O-N 3.33Å; F311-M313 VanDerWaalsContact C-N 3.33Å; F311-M313 PolarHBondContact O-N 2.75Å; M313-R315 VanDerWaalsContact C-N 3.32Å; M313-R315 PolarHBondContact O-N 2.89Å; M313-K316 WeakPolarHBondContact O-CB 3.24Å; M313-K316 PolarHBondContact O-N 3.06Å; M313-K316 VanDerWaalsContact O-N 3.13Å; M313-K316 HydrophobicContact SD-CB 4.26Å; M313-K316 HydrophobicContact SD-CD 4.14Å; M313-L317 PolarHBondContact O-N 3.1Å; M313-G330 WeakPolarHBondContact CG-O 3.42Å; M313-M333 HydrophobicContact CE-CG 4.44Å; M313-M333 HydrophobicContact CG-CB 3.62Å; M313-M333 HydrophobicContact CG-CG 3.63Å; M313-M333 HydrophobicContact SD-CB 4.3Å; M313-M333 HydrophobicContact SD-CG 3.6Å; M313-M333 VanDerWaalsContact SD-CG 3.6Å; M313-A334 HydrophobicContact CB-CB 4.16Å; M313-A334 HydrophobicContact CG-CB 4.26Å; M313-V337 HydrophobicContact CE-CG1 4.39Å; M313-V337 HydrophobicContact CE-CG2 3.87Å
314	A	98.8	Very high	97.8	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-59.1	-44.1	173.8	0	0	0	0	0	111.5	T310 F311 K316 L317 I318 F364	T310-A314 PolarHBondContact O-N 3.28Å; F311-A314 PolarHBondContact O-N 3.04Å; A314-K316 VanDerWaalsContact C-N 3.3Å; A314-K316 PolarHBondContact O-N 2.96Å; A314-L317 WeakPolarHBondContact O-CB 3.26Å; A314-L317 PolarHBondContact O-N 3.25Å; A314-I318 WeakPolarHBondContact O-CG1 3.44Å; A314-I318 PolarHBondContact O-N 2.76Å; A314-F364 HydrophobicContact CB-CD2 4.32Å; A314-F364 HydrophobicContact CB-CE2 3.85Å; A314-F364 HydrophobicContact CB-CZ 4.13Å
315	R	98.6	Very high	98	Very high	62 Å²	62	42.5 Å²	42.5	23%	0.234	21%	0.205	C	C	.	.	H	α-helix	trans	-65.7	-33	175	-67.8	-175.1	70.1	153.1	-3.4	112.8	F311 N312 M313 I318 R319 F364 D367	F311-R315 VanDerWaalsContact O-CG 3.31Å; F311-R315 WeakPolarHBondContact O-CG 3.44Å; F311-R315 PolarHBondContact O-N 2.89Å; N312-R315 PolarHBondContact O-N 3.19Å; M313-R315 VanDerWaalsContact C-N 3.32Å; M313-R315 PolarHBondContact O-N 2.89Å; R315-I318 PolarHBondContact O-N 3.4Å; R315-R319 WeakPolarHBondContact O-CB 3.38Å; R315-R319 PolarHBondContact O-N 3.02Å; R315-F364 WeakPolarHBondContact CD-O 3.04Å; R315-F364 HydrophobicContact CG-CD2 3.82Å; R315-F364 HydrophobicContact CG-CE2 4.18Å; R315-D367 IonicContact CZ-OD1 3.63Å; R315-D367 IonicContact NH1-OD1 3.8Å; R315-D367 PolarHBondContact NH1-OD1 3.17Å; R315-D367 IonicContact NH2-OD1 2.72Å; R315-D367 PolarHBondContact NH2-OD1 2.84Å
316	K	98.5	Very high	98.1	Very high	38 Å²	38	42.4 Å²	42.4	17%	0.165	21%	0.205	C	C	.	.	H	α-helix	trans	-66.2	-43.8	174.3	-160.8	176.6	-173.9	67.2	0	111.8	I77 E80 F81 N312 M313 A314 I318 R319 E320	I77-K316 HydrophobicContact CD1-CB 4.48Å; I77-K316 HydrophobicContact CD1-CG 4.15Å; I77-K316 HydrophobicContact CG1-CD 4.33Å; I77-K316 HydrophobicContact CG1-CG 4.2Å; E80-K316 WeakPolarHBondContact OE1-CE 3.21Å; E80-K316 IonicContact OE1-NZ 3.59Å; E80-K316 PolarHBondContact OE1-NZ 2.69Å; E80-K316 WeakPolarHBondContact OE2-CE 3.4Å; E80-K316 IonicContact OE2-NZ 2.81Å; E80-K316 PolarHBondContact OE2-NZ 2.95Å; F81-K316 HydrophobicContact CE2-CD 4.48Å; N312-K316 WeakPolarHBondContact O-CB 3.46Å; N312-K316 PolarHBondContact O-N 2.83Å; M313-K316 WeakPolarHBondContact O-CB 3.24Å; M313-K316 PolarHBondContact O-N 3.06Å; M313-K316 VanDerWaalsContact O-N 3.13Å; M313-K316 HydrophobicContact SD-CB 4.26Å; M313-K316 HydrophobicContact SD-CD 4.14Å; A314-K316 VanDerWaalsContact C-N 3.3Å; A314-K316 PolarHBondContact O-N 2.96Å; K316-I318 VanDerWaalsContact C-N 3.27Å; K316-I318 PolarHBondContact O-N 2.93Å; K316-R319 PolarHBondContact O-N 2.73Å; K316-E320 WeakPolarHBondContact CE-OE1 3.31Å; K316-E320 VanDerWaalsContact CE-OE2 3.23Å; K316-E320 WeakPolarHBondContact CE-OE2 3.43Å; K316-E320 VanDerWaalsContact CG-CD 3.48Å; K316-E320 HydrophobicContact CG-CG 4.25Å; K316-E320 WeakPolarHBondContact CG-OE1 3.3Å; K316-E320 IonicContact NZ-OE1 3.53Å; K316-E320 PolarHBondContact NZ-OE1 3.38Å; K316-E320 IonicContact NZ-OE2 2.6Å; K316-E320 PolarHBondContact NZ-OE2 2.81Å; K316-E320 WeakPolarHBondContact O-CB 3.31Å; K316-E320 PolarHBondContact O-N 3.29Å
317	L	98.9	Very high	98.2	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-55.2	-43.9	172.9	-75.6	164.5	0	0	0	111.9	L74 I77 M313 A314 E321 G322 L323 M333 L353	L74-L317 HydrophobicContact CD2-CD2 4.05Å; I77-L317 HydrophobicContact CD1-CD2 3.72Å; I77-L317 HydrophobicContact CD1-CG 4.07Å; M313-L317 PolarHBondContact O-N 3.1Å; A314-L317 WeakPolarHBondContact O-CB 3.26Å; A314-L317 PolarHBondContact O-N 3.25Å; L317-E321 CarbonylContact O-C 3.59Å; L317-E321 WeakPolarHBondContact O-CB 3.37Å; L317-E321 PolarHBondContact O-N 3.5Å; L317-E321 VanDerWaalsContact O-N 3.17Å; L317-G322 PolarHBondContact O-N 3.19Å; L317-L323 HydrophobicContact CD2-CD1 4.13Å; L317-L323 PolarHBondContact O-N 3.18Å; L317-M333 HydrophobicContact CD1-CB 3.85Å; L317-M333 HydrophobicContact CD1-CG 4.23Å; L317-M333 HydrophobicContact CD2-CE 3.55Å; L317-M333 HydrophobicContact CD2-CG 4.11Å; L317-M333 HydrophobicContact CG-CB 4.44Å; L317-M333 HydrophobicContact CG-CG 4.29Å; L317-L353 HydrophobicContact CD1-CD2 4.4Å
318	I	98.8	Very high	98.3	Very high	33 Å²	33	40.2 Å²	40.2	17%	0.169	19%	0.191	C	C	.	.	H	α-helix	trans	-63.8	-53.4	175.8	-65.2	166.1	0	0	0	110.6	A314 R315 K316 G322 L323 L324 V357 F364 L365	A314-I318 WeakPolarHBondContact O-CG1 3.44Å; A314-I318 PolarHBondContact O-N 2.76Å; R315-I318 PolarHBondContact O-N 3.4Å; K316-I318 VanDerWaalsContact C-N 3.27Å; K316-I318 PolarHBondContact O-N 2.93Å; I318-G322 VanDerWaalsContact O-CA 3.26Å; I318-G322 WeakPolarHBondContact O-CA 3.24Å; I318-G322 PolarHBondContact O-N 3.26Å; I318-G322 VanDerWaalsContact O-N 3.14Å; I318-L323 WeakPolarHBondContact CA-O 3.28Å; I318-L323 VanDerWaalsContact CG1-O 3.23Å; I318-L323 WeakPolarHBondContact CG1-O 3.21Å; I318-L324 HydrophobicContact CG2-CD2 3.99Å; I318-V357 HydrophobicContact CD1-CG2 4.13Å; I318-F364 HydrophobicContact CD1-CE2 3.97Å; I318-F364 HydrophobicContact CD1-CZ 4.38Å; I318-L365 HydrophobicContact CD1-CD1 4.09Å
319	R	98.4	Very high	98.5	Very high	218 Å²	218	34.1 Å²	34.1	82%	0.823	17%	0.168	S	C	*	.	H	α-helix	trans	-68.5	-38.9	-171.4	-177.4	174	-178.6	159.2	0.5	113.3	R315 K316	R315-R319 WeakPolarHBondContact O-CB 3.38Å; R315-R319 PolarHBondContact O-N 3.02Å; K316-R319 PolarHBondContact O-N 2.73Å
320	E	98.5	Very high	98.6	Very high	40 Å²	40	32.2 Å²	32.2	19%	0.187	16%	0.159	C	C	.	.	H	α-helix	trans	-101.7	-37.2	-168	-69.5	177.6	-161	0	0	112.9	K76 I77 K316	K76-E320 HydrophobicContact CB-CB 4.31Å; K76-E320 HydrophobicContact CD-CB 4.17Å; K76-E320 VanDerWaalsContact CD-O 3.29Å; K76-E320 WeakPolarHBondContact CD-O 3.23Å; K76-E320 WeakPolarHBondContact CE-O 3.44Å; K76-E320 PolarHBondContact NZ-O 2.71Å; I77-E320 HydrophobicContact CG1-CB 4.38Å; K316-E320 WeakPolarHBondContact CE-OE1 3.31Å; K316-E320 VanDerWaalsContact CE-OE2 3.23Å; K316-E320 WeakPolarHBondContact CE-OE2 3.43Å; K316-E320 VanDerWaalsContact CG-CD 3.48Å; K316-E320 HydrophobicContact CG-CG 4.25Å; K316-E320 WeakPolarHBondContact CG-OE1 3.3Å; K316-E320 IonicContact NZ-OE1 3.53Å; K316-E320 PolarHBondContact NZ-OE1 3.38Å; K316-E320 IonicContact NZ-OE2 2.6Å; K316-E320 PolarHBondContact NZ-OE2 2.81Å; K316-E320 WeakPolarHBondContact O-CB 3.31Å; K316-E320 PolarHBondContact O-N 3.29Å
321	E	98.6	Very high	98.6	Very high	34 Å²	34	32.2 Å²	32.2	16%	0.159	16%	0.159	C	C	.	.	H	α-helix	trans	-105.6	-8.4	-177.6	-54.4	-70.2	176.5	0	0	112.5	L74 N75 K76 I77 L317 L323	L74-E321 HydrophobicContact CD2-CB 4.26Å; L74-E321 HydrophobicContact CD2-CG 3.73Å; N75-E321 PolarHBondContact N-OE1 3.11Å; N75-E321 VanDerWaalsContact N-OE1 3.08Å; N75-E321 PolarHBondContact N-OE2 2.91Å; K76-E321 WeakPolarHBondContact CA-OE1 3.23Å; K76-E321 PolarHBondContact N-OE1 3.03Å; I77-E321 HydrophobicContact CD1-CG 3.76Å; I77-E321 HydrophobicContact CG1-CG 4.04Å; I77-E321 PolarHBondContact N-OE1 3.07Å; L317-E321 CarbonylContact O-C 3.59Å; L317-E321 WeakPolarHBondContact O-CB 3.37Å; L317-E321 PolarHBondContact O-N 3.5Å; L317-E321 VanDerWaalsContact O-N 3.17Å; E321-L323 HydrophobicContact CB-CD1 3.9Å; E321-L323 HydrophobicContact CB-CG 3.83Å; E321-L323 PolarHBondContact O-N 2.79Å
322	G	98.6	Very high	98.6	Very high	56 Å²	56	32 Å²	32	58%	0.577	16%	0.158	S	C	*	.			trans	70.5	18.7	-178.7	0	0	0	0	0	113.8	L317 I318	L317-G322 PolarHBondContact O-N 3.19Å; I318-G322 VanDerWaalsContact O-CA 3.26Å; I318-G322 WeakPolarHBondContact O-CA 3.24Å; I318-G322 PolarHBondContact O-N 3.26Å; I318-G322 VanDerWaalsContact O-N 3.14Å
323	L	98.8	Very high	98.6	Very high	13 Å²	13	29.2 Å²	29.2	7%	0.068	14%	0.144	C	C	.	.			trans	-91.1	107	-177	-57.5	176	0	0	0	109.7	V72 L74 A89 Y93 L317 I318 E321 C325 L353	V72-L323 HydrophobicContact CG1-CD2 4.38Å; L74-L323 HydrophobicContact CD2-CD1 3.73Å; A89-L323 HydrophobicContact CB-CD1 4Å; Y93-L323 VanDerWaalsContact OH-CD2 3.24Å; Y93-L323 WeakPolarHBondContact OH-CD2 3.34Å; L317-L323 HydrophobicContact CD2-CD1 4.13Å; L317-L323 PolarHBondContact O-N 3.18Å; I318-L323 WeakPolarHBondContact CA-O 3.28Å; I318-L323 VanDerWaalsContact CG1-O 3.23Å; I318-L323 WeakPolarHBondContact CG1-O 3.21Å; E321-L323 HydrophobicContact CB-CD1 3.9Å; E321-L323 HydrophobicContact CB-CG 3.83Å; E321-L323 PolarHBondContact O-N 2.79Å; L323-C325 PolarHBondContact O-N 3.47Å; L323-L353 HydrophobicContact CD1-CD1 3.87Å
324	L	98.8	Very high	98.6	Very high	99 Å²	99	28.6 Å²	28.6	52%	0.518	14%	0.141	S	C	.	.			trans	-78.2	58.7	-176.8	-62.4	178.5	0	0	0	112.9	I318 S356 V357	I318-L324 HydrophobicContact CG2-CD2 3.99Å; L324-S356 WeakPolarHBondContact O-CA 3.41Å; L324-V357 HydrophobicContact CB-CG1 4.04Å; L324-V357 PolarHBondContact O-N 2.96Å
325	C	98.7	Very high	98.6	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.141	C	C	.	.	B	Isolated β-bridge	trans	-98	164.2	-174.3	65	0	0	0	0	113.7	Y93 L323 S329 L353 D355	Y93-C325 HydrophobicContact CD1-CB 3.9Å; Y93-C325 HydrophobicContact CE1-CB 3.8Å; L323-C325 PolarHBondContact O-N 3.47Å; C325-S329 WeakPolarHBondContact CB-OG 3.33Å; C325-S329 VanDerWaalsContact SG-CB 3.56Å; C325-L353 HydrophobicContact CB-CB 4.45Å; C325-L353 HydrophobicContact CB-CD1 4.42Å; C325-D355 CarbonylContact C-O 3.52Å; C325-D355 VanDerWaalsContact CA-O 3.3Å; C325-D355 WeakPolarHBondContact CA-O 3.39Å
326	G	98.3	Very high	98.6	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.13	C	C	.	.			trans	-86.4	-177.3	179.4	0	0	0	0	0	115.5	S328 S329 D355 Y360	G326-S328 PolarHBondContact O-N 3.28Å; G326-S329 WeakPolarHBondContact O-CB 3.29Å; G326-S329 PolarHBondContact O-N 3.5Å; G326-S329 PolarHBondContact O-OG 3.25Å; G326-D355 WeakPolarHBondContact CA-OD1 3.48Å; G326-D355 PolarHBondContact N-O 3.36Å; G326-Y360 VanDerWaalsContact CA-CE2 3.41Å
327	G	98.1	Very high	98.6	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-58.9	-49.8	-173.4	0	0	0	0	0	114	T310 S329 G330 S331	T310-G327 VanDerWaalsContact CG2-O 3.24Å; T310-G327 WeakPolarHBondContact CG2-O 3.14Å; G327-S329 PolarHBondContact O-N 3.13Å; G327-S329 VanDerWaalsContact O-N 3.08Å; G327-G330 VanDerWaalsContact O-CA 3.31Å; G327-G330 WeakPolarHBondContact O-CA 3.37Å; G327-G330 PolarHBondContact O-N 2.96Å; G327-S331 PolarHBondContact O-N 2.68Å
328	S	98.2	Very high	98.6	Very high	5 Å²	5	28.8 Å²	28.8	4%	0.035	14%	0.143	C	C	.	.	H	α-helix	trans	-60.7	-22.7	-179.6	61.9	0	0	0	0	114.2	G326 G330 S331 A332 P354	G326-S328 PolarHBondContact O-N 3.28Å; S328-G330 VanDerWaalsContact C-N 3.33Å; S328-S331 PolarHBondContact O-N 3.11Å; S328-A332 PolarHBondContact O-N 3.48Å; S328-P354 WeakPolarHBondContact OG-CG 3.37Å
329	S	98.9	Very high	98.6	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-67.2	-36.9	171.3	-53.8	0	0	0	0	111.2	C325 G326 G327 A332 M333 L353 P354	C325-S329 WeakPolarHBondContact CB-OG 3.33Å; C325-S329 VanDerWaalsContact SG-CB 3.56Å; G326-S329 WeakPolarHBondContact O-CB 3.29Å; G326-S329 PolarHBondContact O-N 3.5Å; G326-S329 PolarHBondContact O-OG 3.25Å; G327-S329 PolarHBondContact O-N 3.13Å; G327-S329 VanDerWaalsContact O-N 3.08Å; S329-A332 PolarHBondContact O-N 3.48Å; S329-M333 WeakPolarHBondContact O-CB 3.5Å; S329-M333 PolarHBondContact O-N 2.93Å; S329-L353 WeakPolarHBondContact OG-CA 3.33Å; S329-P354 WeakPolarHBondContact OG-CD 3.41Å
330	G	98.8	Very high	98.6	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-64.3	-43.6	171.3	0	0	0	0	0	112.8	T310 M313 G327 S328 A332 M333 A334	T310-G330 WeakPolarHBondContact O-CA 3.47Å; M313-G330 WeakPolarHBondContact CG-O 3.42Å; G327-G330 VanDerWaalsContact O-CA 3.31Å; G327-G330 WeakPolarHBondContact O-CA 3.37Å; G327-G330 PolarHBondContact O-N 2.96Å; S328-G330 VanDerWaalsContact C-N 3.33Å; G330-A332 PolarHBondContact O-N 3.36Å; G330-M333 PolarHBondContact O-N 2.71Å; G330-A334 VanDerWaalsContact O-CB 3.26Å; G330-A334 WeakPolarHBondContact O-CB 3.47Å; G330-A334 PolarHBondContact O-N 3.31Å
331	S	98.8	Very high	98.6	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-59.3	-46.7	174.1	-45.2	0	0	0	0	111.5	T310 G327 S328 M333 A334 A335	T310-S331 WeakPolarHBondContact CB-OG 3.33Å; T310-S331 WeakPolarHBondContact CG2-OG 3.43Å; T310-S331 PolarHBondContact OG1-OG 3.24Å; G327-S331 PolarHBondContact O-N 2.68Å; S328-S331 PolarHBondContact O-N 3.11Å; S331-M333 VanDerWaalsContact C-N 3.35Å; S331-M333 PolarHBondContact O-N 3.42Å; S331-A334 PolarHBondContact O-N 3Å; S331-A335 PolarHBondContact O-N 2.87Å
332	A	98.8	Very high	98.5	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-60.6	-43.7	178.3	0	0	0	0	0	111.8	V234 S328 S329 G330 A336 V351	V234-A332 WeakPolarHBondContact CG1-O 3.48Å; S328-A332 PolarHBondContact O-N 3.48Å; S329-A332 PolarHBondContact O-N 3.48Å; G330-A332 PolarHBondContact O-N 3.36Å; A332-A336 WeakPolarHBondContact O-CB 3.47Å; A332-A336 PolarHBondContact O-N 3.39Å; A332-V351 HydrophobicContact CB-CG1 3.74Å
333	M	98.9	Very high	98.4	Very high	0 Å²	0	21 Å²	21	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-70.3	-38.6	177.9	-176.4	59.9	75.1	0	0	112.8	L74 I77 M87 M313 L317 S329 G330 S331 A335 A336 V337 V351	L74-M333 HydrophobicContact CD1-CE 3.18Å; L74-M333 HydrophobicContact CD1-SD 4.31Å; L74-M333 HydrophobicContact CD2-CE 3.82Å; L74-M333 HydrophobicContact CG-CE 4.12Å; I77-M333 HydrophobicContact CG2-SD 4.43Å; M87-M333 HydrophobicContact CE-SD 3.91Å; M313-M333 HydrophobicContact CE-CG 4.44Å; M313-M333 HydrophobicContact CG-CB 3.62Å; M313-M333 HydrophobicContact CG-CG 3.63Å; M313-M333 HydrophobicContact SD-CB 4.3Å; M313-M333 HydrophobicContact SD-CG 3.6Å; M313-M333 VanDerWaalsContact SD-CG 3.6Å; L317-M333 HydrophobicContact CD1-CB 3.85Å; L317-M333 HydrophobicContact CD1-CG 4.23Å; L317-M333 HydrophobicContact CD2-CE 3.55Å; L317-M333 HydrophobicContact CD2-CG 4.11Å; L317-M333 HydrophobicContact CG-CB 4.44Å; L317-M333 HydrophobicContact CG-CG 4.29Å; S329-M333 WeakPolarHBondContact O-CB 3.5Å; S329-M333 PolarHBondContact O-N 2.93Å; G330-M333 PolarHBondContact O-N 2.71Å; S331-M333 VanDerWaalsContact C-N 3.35Å; S331-M333 PolarHBondContact O-N 3.42Å; M333-A335 VanDerWaalsContact C-N 3.29Å; M333-A335 PolarHBondContact O-N 2.89Å; M333-A336 PolarHBondContact O-N 2.99Å; M333-A336 VanDerWaalsContact O-N 3.08Å; M333-A336 HydrophobicContact SD-CB 4.35Å; M333-V337 HydrophobicContact CG-CG1 4.35Å; M333-V337 PolarHBondContact O-N 2.97Å; M333-V337 HydrophobicContact SD-CG1 3.96Å; M333-V351 HydrophobicContact CE-CB 4.39Å; M333-V351 HydrophobicContact CE-CG1 4.45Å; M333-V351 HydrophobicContact CE-CG2 4.21Å; M333-V351 HydrophobicContact SD-CG2 4.38Å
334	A	98.8	Very high	98.4	Very high	3 Å²	3	27.1 Å²	27.1	3%	0.025	13%	0.129	C	C	.	.	H	α-helix	trans	-61	-40.4	177.3	0	0	0	0	0	111.2	E309 M313 G330 S331 V337 K338	E309-A334 HydrophobicContact CG-CB 4.14Å; M313-A334 HydrophobicContact CB-CB 4.16Å; M313-A334 HydrophobicContact CG-CB 4.26Å; G330-A334 VanDerWaalsContact O-CB 3.26Å; G330-A334 WeakPolarHBondContact O-CB 3.47Å; G330-A334 PolarHBondContact O-N 3.31Å; S331-A334 PolarHBondContact O-N 3Å; A334-V337 WeakPolarHBondContact O-CG2 3.32Å; A334-K338 WeakPolarHBondContact O-CG 3.5Å
335	A	98.6	Very high	98.3	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-65.2	-48.5	169.5	0	0	0	0	0	111.3	V234 V262 Y303 S331 M333 V337 K338 M339	V234-A335 HydrophobicContact CG1-CB 4.04Å; V262-A335 HydrophobicContact CB-CB 4.46Å; V262-A335 HydrophobicContact CG1-CB 4.33Å; V262-A335 HydrophobicContact CG2-CB 3.33Å; Y303-A335 HydrophobicContact CD1-CB 3.4Å; Y303-A335 HydrophobicContact CD2-CB 4.37Å; Y303-A335 HydrophobicContact CE1-CB 4.07Å; Y303-A335 HydrophobicContact CG-CB 3.59Å; S331-A335 PolarHBondContact O-N 2.87Å; M333-A335 VanDerWaalsContact C-N 3.29Å; M333-A335 PolarHBondContact O-N 2.89Å; A335-V337 PolarHBondContact O-N 3.42Å; A335-K338 PolarHBondContact O-N 3.4Å; A335-K338 VanDerWaalsContact O-N 3.09Å; A335-M339 WeakPolarHBondContact O-CB 3.46Å; A335-M339 WeakPolarHBondContact O-CG 3.48Å; A335-M339 PolarHBondContact O-N 3.41Å
336	A	98.8	Very high	98.3	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-58.2	-43.7	-174.5	0	0	0	0	0	112.9	M87 V234 A332 M333 K338 M339 A340 V351	M87-A336 HydrophobicContact CE-CB 3.6Å; V234-A336 HydrophobicContact CB-CB 4.13Å; V234-A336 HydrophobicContact CG1-CB 4.17Å; V234-A336 HydrophobicContact CG2-CB 3.83Å; A332-A336 WeakPolarHBondContact O-CB 3.47Å; A332-A336 PolarHBondContact O-N 3.39Å; M333-A336 PolarHBondContact O-N 2.99Å; M333-A336 VanDerWaalsContact O-N 3.08Å; M333-A336 HydrophobicContact SD-CB 4.35Å; A336-K338 PolarHBondContact O-N 3.18Å; A336-M339 PolarHBondContact O-N 3.47Å; A336-A340 WeakPolarHBondContact O-CB 3.32Å; A336-A340 PolarHBondContact O-N 3.09Å; A336-V351 HydrophobicContact CB-CG1 4.28Å; A336-V351 HydrophobicContact CB-CG2 3.42Å; A336-V351 VanDerWaalsContact CB-CG2 3.42Å
337	V	98.6	Very high	98.3	Very high	1 Å²	1	36 Å²	36	1%	0.006	18%	0.184	C	C	.	.	H	α-helix	trans	-67.3	-23.2	-179.8	-61.2	0	0	0	0	113.7	I77 F81 L83 M313 M333 A334 A335 Q341	I77-V337 HydrophobicContact CG2-CG1 3.81Å; F81-V337 HydrophobicContact CB-CB 4.25Å; F81-V337 HydrophobicContact CD1-CB 3.95Å; F81-V337 HydrophobicContact CD1-CG2 3.85Å; F81-V337 HydrophobicContact CD2-CB 4.24Å; F81-V337 HydrophobicContact CD2-CG1 4.08Å; F81-V337 HydrophobicContact CE1-CB 4.37Å; F81-V337 HydrophobicContact CE1-CG2 3.8Å; F81-V337 HydrophobicContact CE2-CG1 4.45Å; F81-V337 HydrophobicContact CE2-CG2 4.47Å; F81-V337 HydrophobicContact CG-CB 3.88Å; F81-V337 HydrophobicContact CG-CG1 4.2Å; F81-V337 HydrophobicContact CG-CG2 4.22Å; F81-V337 HydrophobicContact CZ-CG2 4.13Å; L83-V337 HydrophobicContact CD1-CB 4.29Å; L83-V337 HydrophobicContact CD1-CG1 4.31Å; M313-V337 HydrophobicContact CE-CG1 4.39Å; M313-V337 HydrophobicContact CE-CG2 3.87Å; M333-V337 HydrophobicContact CG-CG1 4.35Å; M333-V337 PolarHBondContact O-N 2.97Å; M333-V337 HydrophobicContact SD-CG1 3.96Å; A334-V337 WeakPolarHBondContact O-CG2 3.32Å; A335-V337 PolarHBondContact O-N 3.42Å; V337-Q341 PolarHBondContact O-NE2 3Å
338	K	98.4	Very high	98.3	Very high	102 Å²	102	38 Å²	38	44%	0.443	19%	0.192	S	C	.	.	H	α-helix	trans	-84.3	-44.7	174.3	-64.6	179.1	-171.4	-175.7	0	110.9	Y303 E309 A334 A335 A336 Q341	Y303-K338 HydrophobicContact CE2-CD 3.6Å; Y303-K338 WeakPolarHBondContact OH-CD 3.37Å; Y303-K338 WeakPolarHBondContact OH-CE 3.44Å; Y303-K338 PolarHBondContact OH-NZ 3.33Å; E309-K338 IonicContact OE2-NZ 2.7Å; E309-K338 PolarHBondContact OE2-NZ 2.98Å; A334-K338 WeakPolarHBondContact O-CG 3.5Å; A335-K338 PolarHBondContact O-N 3.4Å; A335-K338 VanDerWaalsContact O-N 3.09Å; A336-K338 PolarHBondContact O-N 3.18Å; K338-Q341 WeakPolarHBondContact O-CB 3.38Å; K338-Q341 VanDerWaalsContact O-CG 3.28Å; K338-Q341 WeakPolarHBondContact O-CG 3.23Å; K338-Q341 PolarHBondContact O-N 3.11Å
339	M	98.1	Very high	98.3	Very high	16 Å²	16	37.8 Å²	37.8	8%	0.079	19%	0.19	C	C	.	.	H	α-helix	trans	-76.4	-30.6	-173.7	-59.7	-65.3	-94.9	0	0	112.2	M232 I260 Q301 Y303 A335 A336 Q341 Q342	M232-M339 HydrophobicContact CE-CB 4.46Å; M232-M339 WeakPolarHBondContact CE-O 3.4Å; M232-M339 HydrophobicContact SD-CB 4.1Å; I260-M339 HydrophobicContact CD1-CE 3.82Å; I260-M339 HydrophobicContact CG1-CB 4.42Å; I260-M339 HydrophobicContact CG1-CE 4.44Å; I260-M339 HydrophobicContact CG2-CE 3.82Å; I260-M339 HydrophobicContact CG2-CG 4.07Å; Q301-M339 HydrophobicContact CB-CE 3.59Å; Q301-M339 HydrophobicContact CG-CE 3.45Å; Q301-M339 VanDerWaalsContact CG-CE 3.45Å; Q301-M339 VanDerWaalsContact OE1-CE 3.23Å; Y303-M339 HydrophobicContact CD2-SD 4.48Å; A335-M339 WeakPolarHBondContact O-CB 3.46Å; A335-M339 WeakPolarHBondContact O-CG 3.48Å; A335-M339 PolarHBondContact O-N 3.41Å; A336-M339 PolarHBondContact O-N 3.47Å; M339-Q341 PolarHBondContact O-N 3.47Å; M339-Q342 VanDerWaalsContact O-CG 3.22Å; M339-Q342 WeakPolarHBondContact O-CG 3.32Å; M339-Q342 PolarHBondContact O-NE2 3.33Å
340	A	98.3	Very high	98.3	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-75.7	-6.5	178.1	0	0	0	0	0	113.8	L83 A336 Q342 L343	L83-A340 HydrophobicContact CD1-CB 4.22Å; L83-A340 HydrophobicContact CD2-CB 4.14Å; A336-A340 WeakPolarHBondContact O-CB 3.32Å; A336-A340 PolarHBondContact O-N 3.09Å; A340-Q342 PolarHBondContact O-N 2.66Å; A340-L343 HydrophobicContact CB-CD1 4.23Å; A340-L343 WeakPolarHBondContact O-CB 3.29Å; A340-L343 PolarHBondContact O-N 2.93Å
341	Q	98	Very high	98.3	Very high	106 Å²	106	37.8 Å²	37.8	50%	0.495	19%	0.19	S	C	.	.	G	3₁₀ helix	trans	-58.8	-26.2	173.1	-66.2	-68.5	-23.7	0	0	112.5	F81 L83 V337 K338 M339 L343	F81-Q341 PolarHBondContact O-NE2 3.43Å; L83-Q341 VanDerWaalsContact CD2-CD 3.44Å; L83-Q341 HydrophobicContact CD2-CG 3.98Å; V337-Q341 PolarHBondContact O-NE2 3Å; K338-Q341 WeakPolarHBondContact O-CB 3.38Å; K338-Q341 VanDerWaalsContact O-CG 3.28Å; K338-Q341 WeakPolarHBondContact O-CG 3.23Å; K338-Q341 PolarHBondContact O-N 3.11Å; M339-Q341 PolarHBondContact O-N 3.47Å; Q341-L343 VanDerWaalsContact C-N 3.27Å; Q341-L343 PolarHBondContact O-N 3.3Å
342	Q	96.6	Very high	98.3	Very high	89 Å²	89	37.9 Å²	37.9	42%	0.416	19%	0.191	S	C	.	.	G	3₁₀ helix	trans	-80.3	-4.8	177.1	78.3	-169.4	-59.9	0	0	113.9	M232 K258 M339 A340	M232-Q342 HydrophobicContact CE-CG 4.14Å; K258-Q342 VanDerWaalsContact NZ-CD 3.29Å; M339-Q342 VanDerWaalsContact O-CG 3.22Å; M339-Q342 WeakPolarHBondContact O-CG 3.32Å; M339-Q342 PolarHBondContact O-NE2 3.33Å; A340-Q342 PolarHBondContact O-N 2.66Å
343	L	98.1	Very high	98.4	Very high	6 Å²	6	37.9 Å²	37.9	3%	0.031	19%	0.191	C	C	.	.	P	Polyproline II helix	trans	-94.3	144.4	-179	-60.7	-179.5	0	0	0	110.6	C85 D231 M232 A340 Q341 Q347 C349	C85-L343 HydrophobicContact CB-CB 3.62Å; C85-L343 HydrophobicContact CB-CD1 4.15Å; D231-L343 HydrophobicContact CB-CD2 4.16Å; M232-L343 HydrophobicContact CB-CD1 3.88Å; M232-L343 HydrophobicContact CE-CD1 3.98Å; M232-L343 HydrophobicContact CE-CD2 4.05Å; M232-L343 HydrophobicContact CE-CG 3.96Å; M232-L343 HydrophobicContact SD-CD1 4.25Å; A340-L343 HydrophobicContact CB-CD1 4.23Å; A340-L343 WeakPolarHBondContact O-CB 3.29Å; A340-L343 PolarHBondContact O-N 2.93Å; Q341-L343 VanDerWaalsContact C-N 3.27Å; Q341-L343 PolarHBondContact O-N 3.3Å; L343-Q347 HydrophobicContact CB-CB 4.26Å; L343-C349 HydrophobicContact CD1-CB 3.85Å
344	E	97.9	Very high	98.3	Very high	142 Å²	142	38.6 Å²	38.6	66%	0.664	20%	0.196	S	C	*	.	P	Polyproline II helix	trans	-95.9	173.8	-178.9	-59.3	-172	171	0	0	112.1	C85 Q347	C85-E344 WeakPolarHBondContact CA-O 3.46Å; E344-Q347 WeakPolarHBondContact O-CB 3.44Å; E344-Q347 PolarHBondContact O-N 2.97Å
345	E	97.8	Very high	98.3	Very high	172 Å²	172	38.5 Å²	38.5	80%	0.804	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.2	139.5	174.3	-172.7	173.4	-180	0	0	110.7	Q347	E345-Q347 VanDerWaalsContact C-N 3.27Å; E345-Q347 PolarHBondContact O-N 2.79Å
346	G	96.8	Very high	98.3	Very high	61 Å²	61	39.4 Å²	39.4	63%	0.629	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	84.1	-10.7	-176.1	0	0	0	0	0	115.1
347	Q	98.6	Very high	98.3	Very high	52 Å²	52	40.1 Å²	40.1	24%	0.243	21%	0.206	C	C	.	.			trans	-82.6	157.7	171.3	-62.3	-165.8	-76.5	0	0	111.9	C85 E86 D231 L343 E344 E345	C85-Q347 HydrophobicContact CB-CB 4.3Å; C85-Q347 WeakPolarHBondContact CB-O 3.41Å; E86-Q347 PolarHBondContact N-O 3.48Å; D231-Q347 HydrophobicContact CB-CB 4.07Å; D231-Q347 PolarHBondContact OD1-NE2 3.21Å; D231-Q347 WeakPolarHBondContact OD2-CA 3.32Å; D231-Q347 WeakPolarHBondContact OD2-CB 3.49Å; L343-Q347 HydrophobicContact CB-CB 4.26Å; E344-Q347 WeakPolarHBondContact O-CB 3.44Å; E344-Q347 PolarHBondContact O-N 2.97Å; E345-Q347 VanDerWaalsContact C-N 3.27Å; E345-Q347 PolarHBondContact O-N 2.79Å
348	R	98.7	Very high	98.3	Very high	43 Å²	43	43.9 Å²	43.9	16%	0.162	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	130.5	-175.4	-62.6	-177.4	172.6	168	-0.3	113.1	E86 F88 C226 K229 D231 M232	E86-R348 HydrophobicContact CB-CG 4.22Å; E86-R348 WeakPolarHBondContact O-CA 3.47Å; E86-R348 IonicContact OE2-CZ 4Å; E86-R348 IonicContact OE2-NE 3.93Å; E86-R348 PolarHBondContact OE2-NE 3.19Å; E86-R348 IonicContact OE2-NH2 3.18Å; F88-R348 HydrophobicContact CE2-CB 4.21Å; F88-R348 HydrophobicContact CE2-CG 3.99Å; C226-R348 PolarHBondContact O-NH1 3.39Å; K229-R348 VanDerWaalsContact O-CD 3.28Å; K229-R348 WeakPolarHBondContact O-CD 3.4Å; D231-R348 PolarHBondContact N-O 2.95Å; D231-R348 PolarHBondContact OD2-N 3.01Å; M232-R348 PolarHBondContact N-O 3.34Å
349	C	98.9	Very high	98.1	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	128.7	172.7	-180	0	0	0	0	110.9	E86 M87 F88 M232 L343	E86-C349 PolarHBondContact O-N 2.61Å; M87-C349 CarbonylContact C-O 3.58Å; M87-C349 WeakPolarHBondContact CA-O 3.4Å; M87-C349 HydrophobicContact CG-CB 4.22Å; F88-C349 PolarHBondContact N-O 3.31Å; M232-C349 HydrophobicContact CB-CB 4.14Å; M232-C349 CarbonylContact O-C 3.55Å; M232-C349 WeakPolarHBondContact O-CA 3.28Å; L343-C349 HydrophobicContact CD1-CB 3.85Å
350	V	98.9	Very high	98	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	129.6	175.1	173.1	0	0	0	0	110.1	L71 F88 K90 I222 L230 M232 V233 V234 I352	L71-V350 HydrophobicContact CD1-CG1 3.94Å; L71-V350 HydrophobicContact CD1-CG2 4.19Å; F88-V350 HydrophobicContact CB-CG2 4.26Å; F88-V350 HydrophobicContact CD2-CG2 4.5Å; F88-V350 CarbonylContact O-C 3.56Å; F88-V350 WeakPolarHBondContact O-CA 3.42Å; K90-V350 HydrophobicContact CB-CG1 4.09Å; I222-V350 HydrophobicContact CD1-CG1 4.33Å; I222-V350 HydrophobicContact CG1-CG1 4.46Å; I222-V350 HydrophobicContact CG2-CG1 4.42Å; I222-V350 HydrophobicContact CG2-CG2 4.28Å; L230-V350 HydrophobicContact CD1-CB 4.02Å; L230-V350 HydrophobicContact CD1-CG2 3.41Å; L230-V350 VanDerWaalsContact CD1-CG2 3.41Å; M232-V350 PolarHBondContact O-N 2.66Å; V233-V350 CarbonylContact C-O 3.58Å; V233-V350 VanDerWaalsContact CA-O 3.29Å; V233-V350 WeakPolarHBondContact CA-O 3.42Å; V233-V350 HydrophobicContact CG2-CB 4.35Å; V234-V350 PolarHBondContact N-O 3.2Å; V350-I352 HydrophobicContact CG1-CD1 4.41Å
351	V	98.9	Very high	97.8	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	125.8	177.8	-168.3	0	0	0	0	109.1	M87 F88 A89 K90 A332 M333 A336 L353	M87-V351 HydrophobicContact CE-CG2 3.74Å; F88-V351 PolarHBondContact O-N 3.49Å; A89-V351 CarbonylContact C-O 3.56Å; A89-V351 WeakPolarHBondContact CA-O 3.31Å; K90-V351 PolarHBondContact N-O 3.23Å; A332-V351 HydrophobicContact CB-CG1 3.74Å; M333-V351 HydrophobicContact CE-CB 4.39Å; M333-V351 HydrophobicContact CE-CG1 4.45Å; M333-V351 HydrophobicContact CE-CG2 4.21Å; M333-V351 HydrophobicContact SD-CG2 4.38Å; A336-V351 HydrophobicContact CB-CG1 4.28Å; A336-V351 HydrophobicContact CB-CG2 3.42Å; A336-V351 VanDerWaalsContact CB-CG2 3.42Å; V351-L353 HydrophobicContact CB-CD2 4.46Å; V351-L353 HydrophobicContact CG1-CD2 3.94Å
352	I	98.9	Very high	97.5	Very high	2 Å²	2	41.7 Å²	41.7	1%	0.01	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	122.5	176.7	-53.1	-58.5	0	0	0	109.6	K90 E92 I100 I222 V233 V234 A235 V350 P354	K90-I352 HydrophobicContact CB-CD1 3.75Å; K90-I352 HydrophobicContact CG-CD1 3.97Å; E92-I352 HydrophobicContact CG-CG2 4.23Å; I100-I352 HydrophobicContact CD1-CG2 3.68Å; I222-I352 HydrophobicContact CD1-CD1 3.74Å; V233-I352 HydrophobicContact CG1-CG1 4.44Å; V234-I352 PolarHBondContact O-N 3.47Å; A235-I352 HydrophobicContact CB-CB 4.09Å; A235-I352 HydrophobicContact CB-CG1 3.81Å; V350-I352 HydrophobicContact CG1-CD1 4.41Å; I352-P354 WeakPolarHBondContact O-CD 3.33Å
353	L	98.9	Very high	97.2	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	99.6	176.4	-52.5	-168	0	0	0	109.6	A89 K90 E92 Y93 L317 L323 C325 S329 V351	A89-L353 HydrophobicContact CB-CD1 3.59Å; A89-L353 HydrophobicContact CB-CG 3.95Å; K90-L353 PolarHBondContact O-N 3.17Å; E92-L353 WeakPolarHBondContact CB-O 3.48Å; E92-L353 PolarHBondContact N-O 2.76Å; E92-L353 VanDerWaalsContact N-O 3.11Å; Y93-L353 HydrophobicContact CD1-CB 4.07Å; Y93-L353 HydrophobicContact CE1-CB 3.95Å; Y93-L353 HydrophobicContact CE1-CD1 4.07Å; L317-L353 HydrophobicContact CD1-CD2 4.4Å; L323-L353 HydrophobicContact CD1-CD1 3.87Å; C325-L353 HydrophobicContact CB-CB 4.45Å; C325-L353 HydrophobicContact CB-CD1 4.42Å; S329-L353 WeakPolarHBondContact OG-CA 3.33Å; V351-L353 HydrophobicContact CB-CD2 4.46Å; V351-L353 HydrophobicContact CG1-CD2 3.94Å
354	P	98.8	Very high	97.1	Very high	16 Å²	16	38.6 Å²	38.6	10%	0.104	20%	0.204	C	C	.	.			trans	-71.9	-37.7	-159.3	-26.7	39.3	0	0	0	116.6	S99 I100 S328 S329 I352	S99-P354 CarbonylContact C-O 3.47Å; S99-P354 VanDerWaalsContact CA-O 3.28Å; S99-P354 WeakPolarHBondContact CA-O 3.07Å; I100-P354 HydrophobicContact CB-CB 4.47Å; I100-P354 HydrophobicContact CG2-CB 3.86Å; I100-P354 PolarHBondContact N-O 3.26Å; S328-P354 WeakPolarHBondContact OG-CG 3.37Å; S329-P354 WeakPolarHBondContact OG-CD 3.41Å; I352-P354 WeakPolarHBondContact O-CD 3.33Å
355	D	98.7	Very high	97	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.188	C	C	.	.	B	Isolated β-bridge	trans	-149.7	169.9	-171.4	75.4	-23.7	0	0	0	113.3	Y93 N131 C325 G326 N359 Y360	Y93-D355 WeakPolarHBondContact CB-O 3.29Å; N131-D355 WeakPolarHBondContact ND2-CB 3.36Å; N131-D355 PolarHBondContact ND2-OD2 3.42Å; C325-D355 CarbonylContact C-O 3.52Å; C325-D355 VanDerWaalsContact CA-O 3.3Å; C325-D355 WeakPolarHBondContact CA-O 3.39Å; G326-D355 WeakPolarHBondContact CA-OD1 3.48Å; G326-D355 PolarHBondContact N-O 3.36Å; D355-N359 PolarHBondContact OD2-ND2 3.41Å; D355-Y360 PolarHBondContact OD1-OH 3.42Å; D355-Y360 VanDerWaalsContact OD2-CE2 3.29Å; D355-Y360 WeakPolarHBondContact OD2-CE2 3.26Å; D355-Y360 PolarHBondContact OD2-OH 3.42Å
356	S	98.6	Very high	96.7	Very high	19 Å²	19	28.8 Å²	28.8	13%	0.133	17%	0.165	C	C	.	.	B	Isolated β-bridge	trans	-87.4	162.8	-174.2	63.9	0	0	0	0	113	G98 L324 R358 Y360	G98-S356 PolarHBondContact O-N 3.19Å; L324-S356 WeakPolarHBondContact O-CA 3.41Å; S356-R358 PolarHBondContact O-N 2.94Å; S356-R358 WeakPolarHBondContact OG-CB 3.27Å; S356-Y360 WeakPolarHBondContact O-CD2 3.25Å; S356-Y360 WeakPolarHBondContact O-CE2 3.46Å
357	V	97.9	Very high	96.1	Very high	16 Å²	16	29.9 Å²	29.9	10%	0.097	16%	0.156	C	C	.	.	G	3₁₀ helix	trans	-61.5	-20	173.8	74.6	0	0	0	0	113.5	I318 L324 N359 Y360 M361 F364 L365	I318-V357 HydrophobicContact CD1-CG2 4.13Å; L324-V357 HydrophobicContact CB-CG1 4.04Å; L324-V357 PolarHBondContact O-N 2.96Å; V357-N359 PolarHBondContact O-N 2.88Å; V357-Y360 PolarHBondContact O-N 3.38Å; V357-M361 HydrophobicContact CG1-SD 4.38Å; V357-F364 HydrophobicContact CG2-CZ 4.19Å; V357-L365 HydrophobicContact CG2-CB 4.32Å; V357-L365 HydrophobicContact CG2-CD1 3.82Å; V357-L365 HydrophobicContact CG2-CD2 3.79Å; V357-L365 HydrophobicContact CG2-CG 4.19Å
358	R	98.1	Very high	95.2	Very high	80 Å²	80	32.2 Å²	32.2	30%	0.302	17%	0.167	S	C	.	.	G	3₁₀ helix	trans	-48	-39.6	-178.7	-178.3	-168	65.9	-169.2	-10.1	112.7	G97 E158 S356 Y360 M361	G97-R358 PolarHBondContact O-NH1 3.07Å; G97-R358 PolarHBondContact O-NH2 3.35Å; E158-R358 WeakPolarHBondContact CB-O 3.44Å; S356-R358 PolarHBondContact O-N 2.94Å; S356-R358 WeakPolarHBondContact OG-CB 3.27Å; R358-Y360 PolarHBondContact O-N 3.49Å; R358-M361 WeakPolarHBondContact O-CG 3.5Å
359	N	95.3	Very high	94.6	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.164	C	C	.	.	G	3₁₀ helix	trans	-72.9	-8.9	-175.5	-65	-20.1	0	0	0	113.6	N131 S156 K159 D355 V357	N131-N359 PolarHBondContact OD1-ND2 3.48Å; S156-N359 VanDerWaalsContact CB-O 3.23Å; S156-N359 WeakPolarHBondContact CB-O 3.14Å; S156-N359 PolarHBondContact OG-O 3.44Å; K159-N359 HydrophobicContact CG-CB 4.32Å; D355-N359 PolarHBondContact OD2-ND2 3.41Å; V357-N359 PolarHBondContact O-N 2.88Å
360	Y	95.7	Very high	94.1	Very high	4 Å²	4	31.4 Å²	31.4	2%	0.016	16%	0.164	C	C	.	.	G	3₁₀ helix	trans	-134.3	20	-164.2	-47.8	-76.3	0	0	0	113.5	E283 G326 D355 S356 V357 R358 S362 K363 F364	E283-Y360 HydrophobicContact CB-CE1 4.09Å; E283-Y360 HydrophobicContact CG-CE1 4.34Å; G326-Y360 VanDerWaalsContact CA-CE2 3.41Å; D355-Y360 PolarHBondContact OD1-OH 3.42Å; D355-Y360 VanDerWaalsContact OD2-CE2 3.29Å; D355-Y360 WeakPolarHBondContact OD2-CE2 3.26Å; D355-Y360 PolarHBondContact OD2-OH 3.42Å; S356-Y360 WeakPolarHBondContact O-CD2 3.25Å; S356-Y360 WeakPolarHBondContact O-CE2 3.46Å; V357-Y360 PolarHBondContact O-N 3.38Å; R358-Y360 PolarHBondContact O-N 3.49Å; Y360-S362 VanDerWaalsContact C-N 3.28Å; Y360-S362 PolarHBondContact O-N 3.32Å; Y360-K363 PolarHBondContact O-N 3.42Å; Y360-F364 VanDerWaalsContact CB-CD1 3.48Å; Y360-F364 HydrophobicContact CD1-CD1 4.28Å; Y360-F364 HydrophobicContact CD1-CE1 4.25Å; Y360-F364 HydrophobicContact CD2-CD1 4.39Å; Y360-F364 AromaticContact CD2-CE1 3.6Å; Y360-F364 HydrophobicContact CD2-CE1 3.6Å; Y360-F364 HydrophobicContact CD2-CZ 4.47Å; Y360-F364 HydrophobicContact CE2-CE1 4.48Å; Y360-F364 AromaticContact CG-CD1 3.81Å; Y360-F364 HydrophobicContact CG-CD1 3.81Å; Y360-F364 AromaticContact CG-CE1 3.45Å; Y360-F364 HydrophobicContact CG-CE1 3.45Å; Y360-F364 VanDerWaalsContact CG-CE1 3.45Å
361	M	94	Very high	93.3	Very high	105 Å²	105	33.3 Å²	33.3	52%	0.517	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-41.4	-174.8	-63.2	-65.9	-113.3	0	0	112	E158 V357 R358 L365	E158-M361 HydrophobicContact CG-CB 4.44Å; E158-M361 PolarHBondContact OE1-N 2.62Å; V357-M361 HydrophobicContact CG1-SD 4.38Å; R358-M361 WeakPolarHBondContact O-CG 3.5Å; M361-L365 HydrophobicContact SD-CD2 3.53Å; M361-L365 VanDerWaalsContact SD-CD2 3.53Å
362	S	90.4	Very high	92.3	Very high	69 Å²	69	35.6 Å²	35.6	48%	0.483	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-0.3	176.1	62.1	0	0	0	0	114.7	E158 Y360	E158-S362 VanDerWaalsContact OE1-CB 3.25Å; E158-S362 WeakPolarHBondContact OE1-CB 3.43Å; E158-S362 PolarHBondContact OE1-N 2.83Å; E158-S362 PolarHBondContact OE1-OG 2.82Å; E158-S362 PolarHBondContact OE2-OG 2.86Å; Y360-S362 VanDerWaalsContact C-N 3.28Å; Y360-S362 PolarHBondContact O-N 3.32Å
363	K	92.3	Very high	91.5	Very high	29 Å²	29	39.4 Å²	39.4	13%	0.126	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.1	-121.1	-178.5	-64.7	-167.1	172	-169.3	0	111.2	K154 E283 Y360 L365 C366 W369	K154-K363 PolarHBondContact O-NZ 2.67Å; K154-K363 VanDerWaalsContact O-NZ 3.09Å; E283-K363 WeakPolarHBondContact OE1-CD 3.45Å; E283-K363 WeakPolarHBondContact OE1-CE 3.46Å; E283-K363 IonicContact OE1-NZ 3.89Å; E283-K363 PolarHBondContact OE1-NZ 2.6Å; Y360-K363 PolarHBondContact O-N 3.42Å; K363-L365 PolarHBondContact O-N 3.38Å; K363-C366 WeakPolarHBondContact O-CA 3.22Å; K363-C366 VanDerWaalsContact O-CB 3.26Å; K363-C366 WeakPolarHBondContact O-CB 3.5Å; K363-C366 PolarHBondContact O-N 3.04Å; K363-W369 VanDerWaalsContact C-CE3 3.43Å; K363-W369 HydrophobicContact CB-CD2 4.16Å; K363-W369 HydrophobicContact CB-CE3 4.48Å; K363-W369 HydrophobicContact CB-CZ2 4.23Å; K363-W369 HydrophobicContact CD-CZ2 4.5Å; K363-W369 HydrophobicContact CG-CZ2 4.48Å; K363-W369 WeakPolarHBondContact O-CB 3.43Å
364	F	96	Very high	90.7	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-21.4	-171.5	81.9	-99.6	0	0	0	114.5	F311 A314 R315 I318 V357 Y360 C366 W369 M370	F311-F364 HydrophobicContact CB-CB 3.94Å; F311-F364 HydrophobicContact CD1-CB 3.34Å; F311-F364 AromaticContact CD1-CD1 3.91Å; F311-F364 HydrophobicContact CD1-CD1 3.91Å; F311-F364 AromaticContact CD1-CG 3.69Å; F311-F364 HydrophobicContact CD1-CG 3.69Å; F311-F364 HydrophobicContact CE1-CB 3.97Å; F311-F364 HydrophobicContact CE1-CD1 4.16Å; F311-F364 HydrophobicContact CE1-CG 4.33Å; F311-F364 HydrophobicContact CG-CB 3.71Å; F311-F364 HydrophobicContact CG-CG 4.42Å; A314-F364 HydrophobicContact CB-CD2 4.32Å; A314-F364 HydrophobicContact CB-CE2 3.85Å; A314-F364 HydrophobicContact CB-CZ 4.13Å; R315-F364 WeakPolarHBondContact CD-O 3.04Å; R315-F364 HydrophobicContact CG-CD2 3.82Å; R315-F364 HydrophobicContact CG-CE2 4.18Å; I318-F364 HydrophobicContact CD1-CE2 3.97Å; I318-F364 HydrophobicContact CD1-CZ 4.38Å; V357-F364 HydrophobicContact CG2-CZ 4.19Å; Y360-F364 VanDerWaalsContact CB-CD1 3.48Å; Y360-F364 HydrophobicContact CD1-CD1 4.28Å; Y360-F364 HydrophobicContact CD1-CE1 4.25Å; Y360-F364 HydrophobicContact CD2-CD1 4.39Å; Y360-F364 AromaticContact CD2-CE1 3.6Å; Y360-F364 HydrophobicContact CD2-CE1 3.6Å; Y360-F364 HydrophobicContact CD2-CZ 4.47Å; Y360-F364 HydrophobicContact CE2-CE1 4.48Å; Y360-F364 AromaticContact CG-CD1 3.81Å; Y360-F364 HydrophobicContact CG-CD1 3.81Å; Y360-F364 AromaticContact CG-CE1 3.45Å; Y360-F364 HydrophobicContact CG-CE1 3.45Å; Y360-F364 VanDerWaalsContact CG-CE1 3.45Å; F364-C366 VanDerWaalsContact C-N 3.26Å; F364-W369 HydrophobicContact CB-CE3 4.35Å; F364-W369 HydrophobicContact CB-CZ3 3.95Å; F364-M370 HydrophobicContact CB-SD 3.83Å; F364-M370 VanDerWaalsContact O-CG 3.22Å; F364-M370 WeakPolarHBondContact O-CG 3.49Å
365	L	94.6	Very high	90.3	Very high	63 Å²	63	42.2 Å²	42.2	33%	0.33	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-28.9	174.2	-166.4	66.7	0	0	0	111.9	I318 V357 M361 K363	I318-L365 HydrophobicContact CD1-CD1 4.09Å; V357-L365 HydrophobicContact CG2-CB 4.32Å; V357-L365 HydrophobicContact CG2-CD1 3.82Å; V357-L365 HydrophobicContact CG2-CD2 3.79Å; V357-L365 HydrophobicContact CG2-CG 4.19Å; M361-L365 HydrophobicContact SD-CD2 3.53Å; M361-L365 VanDerWaalsContact SD-CD2 3.53Å; K363-L365 PolarHBondContact O-N 3.38Å
366	C	90.8	Very high	89.6	Confident	45 Å²	45	44.5 Å²	44.5	30%	0.304	24%	0.24	S	C	.	.	S	Bend	trans	-81.5	120.6	178	-177.8	0	0	0	0	110.8	K363 F364 Q368 W369 M370	K363-C366 WeakPolarHBondContact O-CA 3.22Å; K363-C366 VanDerWaalsContact O-CB 3.26Å; K363-C366 WeakPolarHBondContact O-CB 3.5Å; K363-C366 PolarHBondContact O-N 3.04Å; F364-C366 VanDerWaalsContact C-N 3.26Å; C366-Q368 VanDerWaalsContact C-N 3.28Å; C366-Q368 PolarHBondContact O-N 3.29Å; C366-W369 HydrophobicContact CB-CB 3.97Å; C366-W369 PolarHBondContact O-N 2.92Å; C366-M370 WeakPolarHBondContact O-CG 3.42Å; C366-M370 PolarHBondContact O-N 2.7Å
367	D	85.1	Confident	88.5	Confident	85 Å²	85	50.8 Å²	50.8	46%	0.455	27%	0.268	S	S	.	.	H	α-helix	trans	-57.2	-42.5	176	-75.2	-12.6	0	0	0	112.4	R315 W369 M370 C371	R315-D367 IonicContact CZ-OD1 3.63Å; R315-D367 IonicContact NH1-OD1 3.8Å; R315-D367 PolarHBondContact NH1-OD1 3.17Å; R315-D367 IonicContact NH2-OD1 2.72Å; R315-D367 PolarHBondContact NH2-OD1 2.84Å; D367-W369 PolarHBondContact O-N 3.4Å; D367-M370 WeakPolarHBondContact O-CB 3.35Å; D367-M370 PolarHBondContact O-N 3.37Å; D367-C371 PolarHBondContact O-N 3.01Å; D367-C371 PolarHBondContact O-SG 3.4Å; D367-C371 VanDerWaalsContact O-SG 3.41Å
368	Q	80.6	Confident	86.9	Confident	100 Å²	100	52.5 Å²	52.5	47%	0.467	28%	0.28	S	S	.	.	H	α-helix	trans	-59.7	-49.6	179.4	170.4	175.1	-9.8	0	0	110.6	C366 M370 C371 E372 K481	C366-Q368 VanDerWaalsContact C-N 3.28Å; C366-Q368 PolarHBondContact O-N 3.29Å; Q368-M370 VanDerWaalsContact C-N 3.31Å; Q368-M370 PolarHBondContact O-N 3.23Å; Q368-C371 PolarHBondContact O-N 3.49Å; Q368-E372 HydrophobicContact CG-CG 4.29Å; Q368-E372 WeakPolarHBondContact CG-OE1 3.33Å; Q368-E372 PolarHBondContact NE2-OE1 3.26Å; Q368-E372 WeakPolarHBondContact O-CB 3.46Å; Q368-E372 WeakPolarHBondContact O-CG 3.45Å; Q368-E372 PolarHBondContact O-N 3.32Å; Q368-K481 PolarHBondContact NE2-O 3.09Å
369	W	86.1	Confident	84.9	Confident	27 Å²	27	53.4 Å²	53.4	10%	0.102	30%	0.297	C	S	.	.	H	α-helix	trans	-59.7	-41.2	176.6	-175.5	93.6	0	0	0	112.2	E281 F311 K363 F364 C366 D367 C371 E372 K373 F375	E281-W369 HydrophobicContact CB-CH2 4.08Å; E281-W369 HydrophobicContact CB-CZ2 4.33Å; E281-W369 HydrophobicContact CG-CH2 4.37Å; E281-W369 HydrophobicContact CG-CZ2 4.37Å; F311-W369 HydrophobicContact CD2-CH2 4.27Å; F311-W369 HydrophobicContact CD2-CZ3 4.1Å; F311-W369 AromaticContact CE2-CH2 3.74Å; F311-W369 HydrophobicContact CE2-CH2 3.74Å; F311-W369 HydrophobicContact CE2-CZ3 4.03Å; F311-W369 AromaticContact CZ-CH2 3.92Å; F311-W369 HydrophobicContact CZ-CH2 3.92Å; F311-W369 HydrophobicContact CZ-CZ3 4.39Å; K363-W369 VanDerWaalsContact C-CE3 3.43Å; K363-W369 HydrophobicContact CB-CD2 4.16Å; K363-W369 HydrophobicContact CB-CE3 4.48Å; K363-W369 HydrophobicContact CB-CZ2 4.23Å; K363-W369 HydrophobicContact CD-CZ2 4.5Å; K363-W369 HydrophobicContact CG-CZ2 4.48Å; K363-W369 WeakPolarHBondContact O-CB 3.43Å; F364-W369 HydrophobicContact CB-CE3 4.35Å; F364-W369 HydrophobicContact CB-CZ3 3.95Å; C366-W369 HydrophobicContact CB-CB 3.97Å; C366-W369 PolarHBondContact O-N 2.92Å; D367-W369 PolarHBondContact O-N 3.4Å; W369-C371 PolarHBondContact O-N 3.34Å; W369-E372 WeakPolarHBondContact CA-OE2 3.48Å; W369-E372 PolarHBondContact O-N 2.72Å; W369-K373 HydrophobicContact CD2-CG 3.98Å; W369-K373 HydrophobicContact CE3-CG 4.22Å; W369-K373 HydrophobicContact CH2-CG 4.08Å; W369-K373 HydrophobicContact CZ2-CD 4.34Å; W369-K373 HydrophobicContact CZ2-CG 3.82Å; W369-K373 HydrophobicContact CZ3-CG 4.27Å; W369-K373 WeakPolarHBondContact O-CB 3.48Å; W369-K373 WeakPolarHBondContact O-CG 3.47Å; W369-K373 PolarHBondContact O-N 2.92Å; W369-F375 HydrophobicContact CH2-CD2 4.29Å; W369-F375 AromaticContact CH2-CE2 3.87Å; W369-F375 HydrophobicContact CH2-CE2 3.87Å; W369-F375 AromaticContact CZ3-CD2 3.88Å; W369-F375 HydrophobicContact CZ3-CD2 3.88Å; W369-F375 AromaticContact CZ3-CE2 3.94Å; W369-F375 HydrophobicContact CZ3-CE2 3.94Å
370	M	87.4	Confident	83	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-63.4	-40.4	177	-74.2	-72.1	-70.2	0	0	112.7	F311 F364 C366 D367 Q368 G374 F375 L376	F311-M370 HydrophobicContact CB-CE 3.64Å; F311-M370 HydrophobicContact CB-SD 3.64Å; F311-M370 HydrophobicContact CD2-SD 4.45Å; F311-M370 HydrophobicContact CG-SD 4.21Å; F364-M370 HydrophobicContact CB-SD 3.83Å; F364-M370 VanDerWaalsContact O-CG 3.22Å; F364-M370 WeakPolarHBondContact O-CG 3.49Å; C366-M370 WeakPolarHBondContact O-CG 3.42Å; C366-M370 PolarHBondContact O-N 2.7Å; D367-M370 WeakPolarHBondContact O-CB 3.35Å; D367-M370 PolarHBondContact O-N 3.37Å; Q368-M370 VanDerWaalsContact C-N 3.31Å; Q368-M370 PolarHBondContact O-N 3.23Å; M370-G374 PolarHBondContact O-N 3.2Å; M370-F375 HydrophobicContact CE-CB 3.62Å; M370-F375 PolarHBondContact O-N 3.46Å; M370-F375 HydrophobicContact SD-CB 4.02Å; M370-F375 HydrophobicContact SD-CD2 4.13Å; M370-L376 HydrophobicContact CB-CB 3.73Å; M370-L376 HydrophobicContact CB-CD2 4.35Å; M370-L376 HydrophobicContact CE-CB 4.49Å; M370-L376 PolarHBondContact O-N 3.41Å; M370-L376 VanDerWaalsContact O-N 3.17Å
371	C	81.8	Confident	81.1	Confident	39 Å²	39	64 Å²	64	26%	0.264	35%	0.351	S	S	.	.	H	α-helix	trans	-69.3	-43	175.8	-71.7	0	0	0	0	111.9	D367 Q368 W369 K373 G374 L376	D367-C371 PolarHBondContact O-N 3.01Å; D367-C371 PolarHBondContact O-SG 3.4Å; D367-C371 VanDerWaalsContact O-SG 3.41Å; Q368-C371 PolarHBondContact O-N 3.49Å; W369-C371 PolarHBondContact O-N 3.34Å; C371-K373 VanDerWaalsContact C-N 3.31Å; C371-K373 PolarHBondContact O-N 2.88Å; C371-G374 WeakPolarHBondContact O-CA 2.98Å; C371-G374 PolarHBondContact O-N 3.41Å; C371-L376 WeakPolarHBondContact CA-O 3.35Å; C371-L376 PolarHBondContact SG-O 3.49Å
372	E	79.1	Confident	79.5	Confident	49 Å²	49	66.2 Å²	66.2	23%	0.229	36%	0.363	C	S	.	.	H	α-helix	trans	-59.4	-40.3	177.8	-76.8	167.5	176.7	0	0	113	Q368 W369 G374 K481 T482	Q368-E372 HydrophobicContact CG-CG 4.29Å; Q368-E372 WeakPolarHBondContact CG-OE1 3.33Å; Q368-E372 PolarHBondContact NE2-OE1 3.26Å; Q368-E372 WeakPolarHBondContact O-CB 3.46Å; Q368-E372 WeakPolarHBondContact O-CG 3.45Å; Q368-E372 PolarHBondContact O-N 3.32Å; W369-E372 WeakPolarHBondContact CA-OE2 3.48Å; W369-E372 PolarHBondContact O-N 2.72Å; E372-G374 PolarHBondContact O-N 3.5Å; E372-K481 HydrophobicContact CG-CB 4.2Å; E372-K481 WeakPolarHBondContact OE1-CB 3.41Å; E372-T482 HydrophobicContact CB-CG2 3.33Å; E372-T482 HydrophobicContact CG-CG2 3.44Å; E372-T482 VanDerWaalsContact CG-CG2 3.44Å; E372-T482 WeakPolarHBondContact OE2-CG2 3.13Å
373	K	82.1	Confident	78.8	Confident	81 Å²	81	68.2 Å²	68.2	35%	0.352	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-3	174.9	-63.2	-68.1	-176.6	171.2	0	113.3	E281 W369 C371 F375	E281-K373 HydrophobicContact CG-CD 4.38Å; E281-K373 WeakPolarHBondContact OE1-CE 3.23Å; E281-K373 IonicContact OE1-NZ 2.77Å; E281-K373 PolarHBondContact OE1-NZ 3.19Å; E281-K373 IonicContact OE2-NZ 3.73Å; W369-K373 HydrophobicContact CD2-CG 3.98Å; W369-K373 HydrophobicContact CE3-CG 4.22Å; W369-K373 HydrophobicContact CH2-CG 4.08Å; W369-K373 HydrophobicContact CZ2-CD 4.34Å; W369-K373 HydrophobicContact CZ2-CG 3.82Å; W369-K373 HydrophobicContact CZ3-CG 4.27Å; W369-K373 WeakPolarHBondContact O-CB 3.48Å; W369-K373 WeakPolarHBondContact O-CG 3.47Å; W369-K373 PolarHBondContact O-N 2.92Å; C371-K373 VanDerWaalsContact C-N 3.31Å; C371-K373 PolarHBondContact O-N 2.88Å; K373-F375 VanDerWaalsContact C-N 3.32Å; K373-F375 HydrophobicContact CB-CD2 3.48Å; K373-F375 VanDerWaalsContact CB-CD2 3.48Å; K373-F375 HydrophobicContact CB-CE1 4.49Å; K373-F375 HydrophobicContact CB-CE2 3.33Å; K373-F375 HydrophobicContact CB-CG 4.15Å; K373-F375 HydrophobicContact CB-CZ 3.87Å; K373-F375 HydrophobicContact CG-CD2 4.4Å; K373-F375 HydrophobicContact CG-CE2 4Å; K373-F375 PolarHBondContact O-N 2.9Å
374	G	82.6	Confident	78.2	Confident	49 Å²	49	68.9 Å²	68.9	51%	0.505	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.9	18.1	179.6	0	0	0	0	0	114.5	M370 C371 E372	M370-G374 PolarHBondContact O-N 3.2Å; C371-G374 WeakPolarHBondContact O-CA 2.98Å; C371-G374 PolarHBondContact O-N 3.41Å; E372-G374 PolarHBondContact O-N 3.5Å
375	F	89.1	Confident	78	Confident	26 Å²	26	79 Å²	79	11%	0.114	41%	0.409	C	S	.	.	S	Bend	trans	-88	-21.5	179.6	-55.9	-38.1	0	0	0	113.4	E281 D307 R308 F311 N312 W369 M370 K373	E281-F375 HydrophobicContact CB-CE2 4.45Å; E281-F375 HydrophobicContact CG-CE2 4.19Å; E281-F375 HydrophobicContact CG-CZ 4.11Å; D307-F375 HydrophobicContact CB-CD1 4.49Å; D307-F375 HydrophobicContact CB-CE1 3.63Å; D307-F375 HydrophobicContact CB-CE2 4.13Å; D307-F375 HydrophobicContact CB-CZ 3.41Å; D307-F375 VanDerWaalsContact CB-CZ 3.41Å; R308-F375 HydrophobicContact CB-CD1 3.9Å; R308-F375 HydrophobicContact CG-CD1 4.43Å; F311-F375 AromaticContact CD2-CD2 3.51Å; F311-F375 HydrophobicContact CD2-CD2 3.51Å; F311-F375 AromaticContact CD2-CE2 3.55Å; F311-F375 HydrophobicContact CD2-CE2 3.55Å; F311-F375 HydrophobicContact CD2-CG 4.25Å; F311-F375 HydrophobicContact CD2-CZ 4.33Å; F311-F375 AromaticContact CE2-CD2 3.98Å; F311-F375 HydrophobicContact CE2-CD2 3.98Å; F311-F375 AromaticContact CE2-CE2 3.51Å; F311-F375 HydrophobicContact CE2-CE2 3.51Å; F311-F375 HydrophobicContact CE2-CZ 4.17Å; N312-F375 PolarHBondContact ND2-O 3.44Å; W369-F375 HydrophobicContact CH2-CD2 4.29Å; W369-F375 AromaticContact CH2-CE2 3.87Å; W369-F375 HydrophobicContact CH2-CE2 3.87Å; W369-F375 AromaticContact CZ3-CD2 3.88Å; W369-F375 HydrophobicContact CZ3-CD2 3.88Å; W369-F375 AromaticContact CZ3-CE2 3.94Å; W369-F375 HydrophobicContact CZ3-CE2 3.94Å; M370-F375 HydrophobicContact CE-CB 3.62Å; M370-F375 PolarHBondContact O-N 3.46Å; M370-F375 HydrophobicContact SD-CB 4.02Å; M370-F375 HydrophobicContact SD-CD2 4.13Å; K373-F375 VanDerWaalsContact C-N 3.32Å; K373-F375 HydrophobicContact CB-CD2 3.48Å; K373-F375 VanDerWaalsContact CB-CD2 3.48Å; K373-F375 HydrophobicContact CB-CE1 4.49Å; K373-F375 HydrophobicContact CB-CE2 3.33Å; K373-F375 HydrophobicContact CB-CG 4.15Å; K373-F375 HydrophobicContact CB-CZ 3.87Å; K373-F375 HydrophobicContact CG-CD2 4.4Å; K373-F375 HydrophobicContact CG-CE2 4Å; K373-F375 PolarHBondContact O-N 2.9Å
376	L	84.3	Confident	77.8	Confident	48 Å²	48	79.8 Å²	79.8	25%	0.251	41%	0.407	S	S	.	.	S	Bend	trans	-126.8	137.6	176.1	-174.4	68.4	0	0	0	110.2	M370 C371	M370-L376 HydrophobicContact CB-CB 3.73Å; M370-L376 HydrophobicContact CB-CD2 4.35Å; M370-L376 HydrophobicContact CE-CB 4.49Å; M370-L376 PolarHBondContact O-N 3.41Å; M370-L376 VanDerWaalsContact O-N 3.17Å; C371-L376 WeakPolarHBondContact CA-O 3.35Å; C371-L376 PolarHBondContact SG-O 3.49Å
377	E	75.7	Confident	77.6	Confident	151 Å²	151	78.9 Å²	78.9	71%	0.706	40%	0.398	S	S	*	.			trans	-75.4	134.8	171.3	-67.4	175.9	-166.5	0	0	109.7	R308 P379	R308-E377 IonicContact NH2-OE1 3.58Å; E377-P379 WeakPolarHBondContact O-CD 3.21Å
378	S	64.6	Low	77.7	Confident	52 Å²	52	80.7 Å²	80.7	36%	0.364	41%	0.408	S	S	.	.			trans	-63.5	115.3	-179.1	-176.2	0	0	0	0	110.2	N380	S378-N380 PolarHBondContact O-N 3.46Å
379	P	55.7	Low	78.3	Confident	99 Å²	99	79.2 Å²	79.2	64%	0.643	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-13.7	-168.8	-22	32.6	0	0	0	115.2	E377	E377-P379 WeakPolarHBondContact O-CD 3.21Å
380	N	54.5	Low	78.7	Confident	145 Å²	145	80.7 Å²	80.7	78%	0.775	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-158.4	76.9	179.2	-85	-42.1	0	0	0	109.8	S378 I382	S378-N380 PolarHBondContact O-N 3.46Å; N380-I382 PolarHBondContact O-N 2.97Å
381	E	56.6	Low	78.9	Confident	83 Å²	83	80.7 Å²	80.7	39%	0.388	41%	0.414	S	S	.	.			trans	-76.3	78.1	159.5	-85.5	-174.9	-175.1	0	0	109	K383 W387	E381-K383 HydrophobicContact CB-CG 4.06Å; E381-K383 PolarHBondContact O-N 3.29Å; E381-K383 WeakPolarHBondContact OE2-CE 3.49Å; E381-K383 IonicContact OE2-NZ 3.64Å; E381-W387 VanDerWaalsContact CD-CZ2 3.46Å; E381-W387 HydrophobicContact CG-CH2 4.28Å; E381-W387 HydrophobicContact CG-CZ2 4.38Å; E381-W387 WeakPolarHBondContact OE1-CH2 3.42Å; E381-W387 VanDerWaalsContact OE1-CZ2 3.3Å; E381-W387 WeakPolarHBondContact OE1-CZ2 3.29Å; E381-W387 WeakPolarHBondContact OE2-CZ2 3.36Å
382	I	61	Low	79.3	Confident	150 Å²	150	84.5 Å²	84.5	77%	0.769	43%	0.427	S	S	*	.			trans	-62.5	94.3	146.4	-62.3	176.3	0	0	0	104.1	N380 P384	N380-I382 PolarHBondContact O-N 2.97Å; I382-P384 WeakPolarHBondContact O-CD 3.47Å; I382-P384 VanDerWaalsContact O-N 3.1Å
383	K	74.8	Confident	80	Confident	112 Å²	112	83.6 Å²	83.6	49%	0.487	43%	0.426	S	S	.	.			trans	-64.2	110.8	174.9	-70.4	179.1	176.3	176.6	0	106.2	E381 W387	E381-K383 HydrophobicContact CB-CG 4.06Å; E381-K383 PolarHBondContact O-N 3.29Å; E381-K383 WeakPolarHBondContact OE2-CE 3.49Å; E381-K383 IonicContact OE2-NZ 3.64Å; K383-W387 HydrophobicContact CB-CB 3.76Å; K383-W387 HydrophobicContact CB-CD2 4.17Å; K383-W387 HydrophobicContact CB-CG 3.72Å; K383-W387 HydrophobicContact CD-CD2 4.42Å; K383-W387 HydrophobicContact CD-CG 4Å; K383-W387 HydrophobicContact CG-CB 4.33Å; K383-W387 HydrophobicContact CG-CD2 3.88Å; K383-W387 HydrophobicContact CG-CG 3.73Å
384	P	80.3	Confident	80.4	Confident	43 Å²	43	83.5 Å²	83.5	28%	0.279	43%	0.429	S	S	.	.			trans	-58.7	159	175.5	25.2	-33.4	0	0	0	109.3	I382 W386 W387	I382-P384 WeakPolarHBondContact O-CD 3.47Å; I382-P384 VanDerWaalsContact O-N 3.1Å; P384-W386 HydrophobicContact CB-CD2 4.24Å; P384-W386 HydrophobicContact CB-CG 4.32Å; P384-W386 HydrophobicContact CB-CZ2 4.21Å; P384-W386 HydrophobicContact CG-CD2 3.74Å; P384-W386 HydrophobicContact CG-CE3 4.23Å; P384-W386 HydrophobicContact CG-CG 4.32Å; P384-W386 HydrophobicContact CG-CH2 3.87Å; P384-W386 HydrophobicContact CG-CZ2 3.33Å; P384-W386 HydrophobicContact CG-CZ3 4.28Å; P384-W386 PolarHBondContact O-N 3.3Å; P384-W387 HydrophobicContact CG-CE3 4.19Å; P384-W387 VanDerWaalsContact O-CB 3.23Å; P384-W387 WeakPolarHBondContact O-CB 3.22Å; P384-W387 PolarHBondContact O-N 3.49Å
385	W	90.5	Very high	80.7	Confident	211 Å²	211	88.7 Å²	88.7	80%	0.799	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.4	-28	-175.5	66.2	-90.2	0	0	0	113.9	M389	W385-M389 HydrophobicContact CE3-SD 3.8Å; W385-M389 HydrophobicContact CH2-SD 4.02Å; W385-M389 HydrophobicContact CZ3-CE 4.13Å; W385-M389 HydrophobicContact CZ3-SD 3.27Å; W385-M389 WeakPolarHBondContact CZ3-SD 3.3Å
386	W	90.8	Very high	80.6	Confident	80 Å²	80	92.1 Å²	92.1	30%	0.303	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84	-8.2	-180	56.2	-105.9	0	0	0	114.9	P384 N388 M389 L473	P384-W386 HydrophobicContact CB-CD2 4.24Å; P384-W386 HydrophobicContact CB-CG 4.32Å; P384-W386 HydrophobicContact CB-CZ2 4.21Å; P384-W386 HydrophobicContact CG-CD2 3.74Å; P384-W386 HydrophobicContact CG-CE3 4.23Å; P384-W386 HydrophobicContact CG-CG 4.32Å; P384-W386 HydrophobicContact CG-CH2 3.87Å; P384-W386 HydrophobicContact CG-CZ2 3.33Å; P384-W386 HydrophobicContact CG-CZ3 4.28Å; P384-W386 PolarHBondContact O-N 3.3Å; W386-N388 VanDerWaalsContact C-N 3.26Å; W386-N388 PolarHBondContact O-N 2.86Å; W386-N388 VanDerWaalsContact O-N 3.14Å; W386-M389 HydrophobicContact CB-SD 3.83Å; W386-M389 WeakPolarHBondContact O-CB 3.36Å; W386-M389 PolarHBondContact O-N 2.89Å; W386-L473 HydrophobicContact CB-CD1 4.21Å; W386-L473 HydrophobicContact CE3-CB 3.61Å; W386-L473 HydrophobicContact CE3-CD1 4.29Å; W386-L473 HydrophobicContact CZ3-CB 3.98Å
387	W	86.6	Confident	80.4	Confident	26 Å²	26	95.1 Å²	95.1	10%	0.098	48%	0.484	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-38.4	-169.8	-171.5	-87.8	0	0	0	114	E381 K383 P384 G474	E381-W387 VanDerWaalsContact CD-CZ2 3.46Å; E381-W387 HydrophobicContact CG-CH2 4.28Å; E381-W387 HydrophobicContact CG-CZ2 4.38Å; E381-W387 WeakPolarHBondContact OE1-CH2 3.42Å; E381-W387 VanDerWaalsContact OE1-CZ2 3.3Å; E381-W387 WeakPolarHBondContact OE1-CZ2 3.29Å; E381-W387 WeakPolarHBondContact OE2-CZ2 3.36Å; K383-W387 HydrophobicContact CB-CB 3.76Å; K383-W387 HydrophobicContact CB-CD2 4.17Å; K383-W387 HydrophobicContact CB-CG 3.72Å; K383-W387 HydrophobicContact CD-CD2 4.42Å; K383-W387 HydrophobicContact CD-CG 4Å; K383-W387 HydrophobicContact CG-CB 4.33Å; K383-W387 HydrophobicContact CG-CD2 3.88Å; K383-W387 HydrophobicContact CG-CG 3.73Å; P384-W387 HydrophobicContact CG-CE3 4.19Å; P384-W387 VanDerWaalsContact O-CB 3.23Å; P384-W387 WeakPolarHBondContact O-CB 3.22Å; P384-W387 PolarHBondContact O-N 3.49Å; W387-G474 VanDerWaalsContact CD2-CA 3.46Å; W387-G474 PolarHBondContact O-N 3.07Å
388	N	87.3	Confident	80.7	Confident	124 Å²	124	92.4 Å²	92.4	66%	0.663	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.3	-1	-179.8	-66.3	-29.6	0	0	0	113.5	W386	W386-N388 VanDerWaalsContact C-N 3.26Å; W386-N388 PolarHBondContact O-N 2.86Å; W386-N388 VanDerWaalsContact O-N 3.14Å
389	M	93.6	Very high	81.6	Confident	69 Å²	69	93.7 Å²	93.7	34%	0.34	49%	0.494	S	S	.	.	S	Bend	trans	-67.3	153.1	170.9	-63	175.5	69.6	0	0	109.2	W385 W386 N472 L473	W385-M389 HydrophobicContact CE3-SD 3.8Å; W385-M389 HydrophobicContact CH2-SD 4.02Å; W385-M389 HydrophobicContact CZ3-CE 4.13Å; W385-M389 HydrophobicContact CZ3-SD 3.27Å; W385-M389 WeakPolarHBondContact CZ3-SD 3.3Å; W386-M389 HydrophobicContact CB-SD 3.83Å; W386-M389 WeakPolarHBondContact O-CB 3.36Å; W386-M389 PolarHBondContact O-N 2.89Å; M389-N472 CarbonylContact O-C 3.47Å; M389-N472 WeakPolarHBondContact O-CA 3.48Å; M389-L473 HydrophobicContact CB-CD1 3.89Å; M389-L473 HydrophobicContact CB-CG 4.23Å; M389-L473 WeakPolarHBondContact O-CG 3.35Å; M389-L473 PolarHBondContact O-N 3.25Å
390	T	94.1	Very high	83.2	Confident	58 Å²	58	91.3 Å²	91.3	36%	0.356	48%	0.476	S	S	.	.	B	Isolated β-bridge	trans	-85.9	157	179.9	55.3	0	0	0	0	111.2	H392 S393 L469 D471	T390-H392 PolarHBondContact O-N 2.76Å; T390-H392 VanDerWaalsContact O-N 3.11Å; T390-S393 WeakPolarHBondContact O-CB 3.35Å; T390-S393 PolarHBondContact O-N 3.25Å; T390-S393 PolarHBondContact O-OG 2.74Å; T390-L469 WeakPolarHBondContact CB-O 3.41Å; T390-D471 CarbonylContact C-O 3.59Å; T390-D471 VanDerWaalsContact CA-O 3.27Å; T390-D471 WeakPolarHBondContact CA-O 3.32Å
391	V	91.4	Very high	85.1	Confident	0 Å²	0	88 Å²	88	0%	0	46%	0.461	C	S	.	.	G	3₁₀ helix	trans	-53.9	-31.1	173.1	174.6	0	0	0	0	111.5	S393 L394 L396 L469 D471 L473 L476 V488	V391-S393 PolarHBondContact O-N 3.41Å; V391-S393 VanDerWaalsContact O-N 3.12Å; V391-L394 HydrophobicContact CG1-CD1 4.49Å; V391-L394 WeakPolarHBondContact O-CB 3.41Å; V391-L394 PolarHBondContact O-N 2.99Å; V391-L396 HydrophobicContact CG1-CD1 4.09Å; V391-L469 PolarHBondContact N-O 3.12Å; V391-D471 HydrophobicContact CG2-CB 4.36Å; V391-D471 WeakPolarHBondContact CG2-O 3.07Å; V391-D471 PolarHBondContact N-O 2.76Å; V391-L473 HydrophobicContact CG2-CD2 4.29Å; V391-L476 HydrophobicContact CG2-CB 4.2Å; V391-L476 HydrophobicContact CG2-CD2 4.04Å; V391-V488 HydrophobicContact CG1-CB 4.45Å; V391-V488 HydrophobicContact CG1-CG1 3.79Å; V391-V488 HydrophobicContact CG1-CG2 3.75Å
392	H	91.8	Very high	86.9	Confident	118 Å²	118	84.7 Å²	84.7	55%	0.546	45%	0.445	S	S	.	.	G	3₁₀ helix	trans	-51.6	-32.1	172.7	-169.3	75.5	0	0	0	113.9	T390 L394 H395 L469	T390-H392 PolarHBondContact O-N 2.76Å; T390-H392 VanDerWaalsContact O-N 3.11Å; H392-L394 PolarHBondContact O-N 3.26Å; H392-L394 VanDerWaalsContact O-N 3.15Å; H392-H395 PolarHBondContact O-N 2.86Å; H392-L469 HydrophobicContact CB-CB 4.47Å; H392-L469 HydrophobicContact CB-CD2 4.49Å; H392-L469 PolarHBondContact N-O 3.02Å
393	S	92.7	Very high	88.5	Confident	30 Å²	30	78.8 Å²	78.8	21%	0.21	42%	0.419	C	S	.	.	G	3₁₀ helix	trans	-68.8	-11.8	-179.3	75.8	0	0	0	0	114.3	T390 V391 H395	T390-S393 WeakPolarHBondContact O-CB 3.35Å; T390-S393 PolarHBondContact O-N 3.25Å; T390-S393 PolarHBondContact O-OG 2.74Å; V391-S393 PolarHBondContact O-N 3.41Å; V391-S393 VanDerWaalsContact O-N 3.12Å; S393-H395 PolarHBondContact O-CE1 2.94Å; S393-H395 VanDerWaalsContact O-CE1 3.32Å; S393-H395 PolarHBondContact O-N 3.37Å; S393-H395 PolarHBondContact O-ND1 3.37Å
394	L	91.1	Very high	89.4	Confident	79 Å²	79	74.6 Å²	74.6	41%	0.414	40%	0.404	S	S	.	.	G	3₁₀ helix	trans	-76.8	-9.3	175.8	-63	177.9	0	0	0	112.8	V391 H392 L396 L473 L476	V391-L394 HydrophobicContact CG1-CD1 4.49Å; V391-L394 WeakPolarHBondContact O-CB 3.41Å; V391-L394 PolarHBondContact O-N 2.99Å; H392-L394 PolarHBondContact O-N 3.26Å; H392-L394 VanDerWaalsContact O-N 3.15Å; L394-L396 HydrophobicContact CB-CD1 4.42Å; L394-L396 HydrophobicContact CB-CD2 3.73Å; L394-L396 HydrophobicContact CB-CG 3.77Å; L394-L396 HydrophobicContact CD1-CD1 4.47Å; L394-L396 HydrophobicContact CD1-CD2 4.33Å; L394-L396 PolarHBondContact O-N 2.89Å; L394-L473 HydrophobicContact CD1-CD2 3.76Å; L394-L473 HydrophobicContact CD2-CD1 4.33Å; L394-L473 HydrophobicContact CD2-CD2 4.12Å; L394-L473 HydrophobicContact CG-CD2 3.8Å; L394-L476 HydrophobicContact CD1-CD2 3.66Å
395	H	87.8	Confident	90.1	Very high	159 Å²	159	78.8 Å²	78.8	74%	0.736	42%	0.418	S	S	*	.			trans	49.6	45.5	-179.7	-55.4	86.9	0	0	0	112.2	H392 S393	H392-H395 PolarHBondContact O-N 2.86Å; S393-H395 PolarHBondContact O-CE1 2.94Å; S393-H395 VanDerWaalsContact O-CE1 3.32Å; S393-H395 PolarHBondContact O-N 3.37Å; S393-H395 PolarHBondContact O-ND1 3.37Å
396	L	87.4	Confident	90.3	Very high	97 Å²	97	70.1 Å²	70.1	51%	0.508	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-64.1	139	-175.4	-59.4	174.5	0	0	0	110.8	V391 L394 V488	V391-L396 HydrophobicContact CG1-CD1 4.09Å; L394-L396 HydrophobicContact CB-CD1 4.42Å; L394-L396 HydrophobicContact CB-CD2 3.73Å; L394-L396 HydrophobicContact CB-CG 3.77Å; L394-L396 HydrophobicContact CD1-CD1 4.47Å; L394-L396 HydrophobicContact CD1-CD2 4.33Å; L394-L396 PolarHBondContact O-N 2.89Å; L396-V488 HydrophobicContact CD1-CB 4.14Å; L396-V488 HydrophobicContact CD1-CG1 4.45Å; L396-V488 HydrophobicContact CD1-CG2 3.41Å; L396-V488 VanDerWaalsContact CD1-CG2 3.41Å
397	S	80.8	Confident	90.6	Very high	111 Å²	111	68 Å²	68	78%	0.776	38%	0.384	S	S	*	.	P	Polyproline II helix	trans	-85.3	149.6	172.7	-62.4	0	0	0	0	110.6
398	A	82.2	Confident	91	Very high	94 Å²	94	66.8 Å²	66.8	78%	0.777	38%	0.379	S	S	*	.	P	Polyproline II helix	trans	-57.6	124.4	173.7	0	0	0	0	0	109.8
399	P	83.4	Confident	91.4	Very high	79 Å²	79	66.7 Å²	66.7	51%	0.513	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-72.5	152.6	-179	30.7	-34.4	0	0	0	110.3	T401 P424	P399-T401 PolarHBondContact O-N 3.02Å; P399-P424 HydrophobicContact CB-CG 4.29Å; P399-P424 HydrophobicContact CG-CG 4.14Å
400	L	88.9	Confident	91.5	Very high	50 Å²	50	68.9 Å²	68.9	26%	0.262	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-64.1	131.6	162.5	173.8	67.1	0	0	0	109.1	F402 V414 A423 P424	L400-F402 HydrophobicContact CD2-CE1 4.26Å; L400-F402 HydrophobicContact CD2-CE2 4.21Å; L400-F402 HydrophobicContact CD2-CZ 3.68Å; L400-F402 HydrophobicContact CG-CZ 4.21Å; L400-V414 HydrophobicContact CD2-CG1 3.71Å; L400-A423 VanDerWaalsContact O-CB 3.28Å; L400-A423 WeakPolarHBondContact O-CB 3.34Å; L400-P424 WeakPolarHBondContact O-CD 3.5Å
401	T	93.2	Very high	91.6	Very high	76 Å²	76	66.1 Å²	66.1	47%	0.466	37%	0.366	S	S	.	.			trans	-116.2	157.4	175.8	60.6	0	0	0	0	111.9	P399 P424 V426	P399-T401 PolarHBondContact O-N 3.02Å; T401-P424 WeakPolarHBondContact CA-O 3.49Å; T401-P424 HydrophobicContact CG2-CB 4.39Å; T401-P424 HydrophobicContact CG2-CG 4.33Å; T401-V426 HydrophobicContact CG2-CG2 4.04Å
402	F	94.8	Very high	91.7	Very high	12 Å²	12	67 Å²	67	5%	0.053	37%	0.37	C	S	.	.	B	Isolated β-bridge	trans	-124.8	145.5	176.9	-68.3	-62.2	0	0	0	112.2	L400 L406 V411 V414 L415 A423 P424 V425 V426 V436	L400-F402 HydrophobicContact CD2-CE1 4.26Å; L400-F402 HydrophobicContact CD2-CE2 4.21Å; L400-F402 HydrophobicContact CD2-CZ 3.68Å; L400-F402 HydrophobicContact CG-CZ 4.21Å; F402-L406 HydrophobicContact CB-CD1 4.09Å; F402-L406 HydrophobicContact CD1-CD1 3.65Å; F402-L406 HydrophobicContact CG-CD1 4.3Å; F402-V411 HydrophobicContact CD1-CG2 4.18Å; F402-V411 HydrophobicContact CD2-CG1 3.92Å; F402-V411 HydrophobicContact CD2-CG2 4.3Å; F402-V411 HydrophobicContact CE1-CG2 4.43Å; F402-V411 HydrophobicContact CE2-CG1 3.66Å; F402-V411 HydrophobicContact CG-CG2 4.11Å; F402-V411 HydrophobicContact CZ-CG1 4.06Å; F402-V414 HydrophobicContact CE1-CB 3.87Å; F402-V414 HydrophobicContact CE1-CG1 3.8Å; F402-V414 HydrophobicContact CE1-CG2 4.36Å; F402-V414 HydrophobicContact CZ-CB 3.92Å; F402-V414 HydrophobicContact CZ-CG1 3.86Å; F402-L415 HydrophobicContact CE2-CD2 3.83Å; F402-L415 HydrophobicContact CE2-CG 3.94Å; F402-L415 HydrophobicContact CZ-CD2 4.19Å; F402-L415 HydrophobicContact CZ-CG 4.11Å; F402-A423 HydrophobicContact CD2-CB 3.46Å; F402-A423 VanDerWaalsContact CD2-CB 3.46Å; F402-A423 HydrophobicContact CE2-CB 3.38Å; F402-P424 PolarHBondContact N-O 3.17Å; F402-V425 HydrophobicContact CB-CG2 4.44Å; F402-V425 CarbonylContact O-C 3.46Å; F402-V425 VanDerWaalsContact O-CA 3.31Å; F402-V425 WeakPolarHBondContact O-CA 3.06Å; F402-V426 PolarHBondContact O-N 3.05Å; F402-V436 HydrophobicContact CD2-CG1 4.21Å
403	A	94.9	Very high	91.8	Very high	27 Å²	27	67.4 Å²	67.4	22%	0.223	37%	0.37	C	S	.	.			trans	-77.1	145.2	168.3	0	0	0	0	0	110.7	F405 L406	A403-F405 VanDerWaalsContact C-N 3.26Å; A403-F405 HydrophobicContact CB-CD1 3.99Å; A403-F405 HydrophobicContact CB-CE1 3.5Å; A403-F405 HydrophobicContact CB-CE2 4.35Å; A403-F405 HydrophobicContact CB-CZ 3.7Å; A403-F405 PolarHBondContact O-N 2.77Å; A403-L406 HydrophobicContact CB-CD1 4.48Å; A403-L406 HydrophobicContact CB-CG 4.31Å; A403-L406 WeakPolarHBondContact O-CB 3.47Å; A403-L406 WeakPolarHBondContact O-CG 3.28Å; A403-L406 PolarHBondContact O-N 3.1Å
404	P	94.1	Very high	91.9	Very high	24 Å²	24	67.6 Å²	67.6	16%	0.156	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-26.7	-171.5	22.4	-34.2	0	0	0	114.5	L406 V425 V426 L433 S457	P404-L406 VanDerWaalsContact C-N 3.32Å; P404-L406 PolarHBondContact O-N 3.16Å; P404-V425 HydrophobicContact CB-CG1 4.03Å; P404-V426 VanDerWaalsContact CD-O 3.25Å; P404-V426 WeakPolarHBondContact CD-O 3.43Å; P404-L433 HydrophobicContact CB-CD1 3.74Å; P404-L433 HydrophobicContact CG-CD1 3.85Å; P404-S457 WeakPolarHBondContact O-CB 3.01Å; P404-S457 PolarHBondContact O-N 3.07Å; P404-S457 PolarHBondContact O-OG 3.04Å
405	F	94.6	Very high	92	Very high	131 Å²	131	63.9 Å²	63.9	58%	0.575	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-4.2	-177.8	59.5	-99.5	0	0	0	113.9	A403	A403-F405 VanDerWaalsContact C-N 3.26Å; A403-F405 HydrophobicContact CB-CD1 3.99Å; A403-F405 HydrophobicContact CB-CE1 3.5Å; A403-F405 HydrophobicContact CB-CE2 4.35Å; A403-F405 HydrophobicContact CB-CZ 3.7Å; A403-F405 PolarHBondContact O-N 2.77Å
406	L	95.9	Very high	92.1	Very high	29 Å²	29	62.8 Å²	62.8	15%	0.152	34%	0.344	C	S	.	.	S	Bend	trans	-67.5	139.4	178.1	-68	177.7	0	0	0	110.8	F402 A403 P404 K410 V411 P455 V456	F402-L406 HydrophobicContact CB-CD1 4.09Å; F402-L406 HydrophobicContact CD1-CD1 3.65Å; F402-L406 HydrophobicContact CG-CD1 4.3Å; A403-L406 HydrophobicContact CB-CD1 4.48Å; A403-L406 HydrophobicContact CB-CG 4.31Å; A403-L406 WeakPolarHBondContact O-CB 3.47Å; A403-L406 WeakPolarHBondContact O-CG 3.28Å; A403-L406 PolarHBondContact O-N 3.1Å; P404-L406 VanDerWaalsContact C-N 3.32Å; P404-L406 PolarHBondContact O-N 3.16Å; L406-K410 HydrophobicContact CD2-CD 4.02Å; L406-V411 HydrophobicContact CB-CG2 4.06Å; L406-P455 CarbonylContact O-C 3.56Å; L406-P455 WeakPolarHBondContact O-CA 3.25Å; L406-V456 WeakPolarHBondContact O-CB 3.31Å; L406-V456 PolarHBondContact O-N 2.95Å
407	S	96.6	Very high	92.4	Very high	35 Å²	35	64.4 Å²	64.4	25%	0.245	35%	0.349	C	S	.	.	B	Isolated β-bridge	trans	-69.2	148.5	178.4	67.1	0	0	0	0	112.2	Q409 K410 V411 D454	S407-Q409 PolarHBondContact O-N 3.06Å; S407-K410 PolarHBondContact O-N 3.46Å; S407-K410 WeakPolarHBondContact OG-CB 3.46Å; S407-K410 PolarHBondContact OG-N 2.87Å; S407-V411 PolarHBondContact O-N 2.92Å; S407-D454 WeakPolarHBondContact CA-O 3.23Å
408	C	94.9	Very high	92.8	Very high	0 Å²	0	65.6 Å²	65.6	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-51.3	-41.5	174.8	-70.7	0	0	0	0	112	K410 V411 I412 I441 L452 D454	C408-K410 PolarHBondContact O-N 2.81Å; C408-V411 PolarHBondContact O-N 3.46Å; C408-I412 VanDerWaalsContact O-CG1 3.25Å; C408-I412 WeakPolarHBondContact O-CG1 3.23Å; C408-I412 PolarHBondContact O-N 2.91Å; C408-I441 HydrophobicContact CB-CG2 3.72Å; C408-L452 PolarHBondContact N-O 2.84Å; C408-D454 PolarHBondContact N-O 2.79Å; C408-D454 PolarHBondContact SG-O 3.39Å; C408-D454 VanDerWaalsContact SG-O 3.33Å
409	Q	95.9	Very high	93.1	Very high	122 Å²	122	65.4 Å²	65.4	57%	0.57	34%	0.339	S	S	*	.	H	α-helix	trans	-59.4	-44.7	176.6	-170.5	178.7	6.8	0	0	112.8	S407 K413 L452	S407-Q409 PolarHBondContact O-N 3.06Å; Q409-K413 PolarHBondContact O-N 3.38Å; Q409-L452 HydrophobicContact CB-CB 4.18Å; Q409-L452 WeakPolarHBondContact CB-O 3.37Å; Q409-L452 PolarHBondContact N-O 3.2Å
410	K	95.6	Very high	93.2	Very high	116 Å²	116	66.1 Å²	66.1	50%	0.504	33%	0.334	S	S	.	.	H	α-helix	trans	-68.5	-40.7	-178.6	-174.4	166.6	172.4	-173.9	0	110.6	L406 S407 C408 K413 V414	L406-K410 HydrophobicContact CD2-CD 4.02Å; S407-K410 PolarHBondContact O-N 3.46Å; S407-K410 WeakPolarHBondContact OG-CB 3.46Å; S407-K410 PolarHBondContact OG-N 2.87Å; C408-K410 PolarHBondContact O-N 2.81Å; K410-K413 PolarHBondContact O-N 3.39Å; K410-V414 WeakPolarHBondContact O-CG2 3.36Å; K410-V414 PolarHBondContact O-N 3.14Å
411	V	95.1	Very high	93.1	Very high	0 Å²	0	69.2 Å²	69.2	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-61.4	-48.5	175.1	173.1	0	0	0	0	111.2	F402 L406 S407 C408 K413 V414 L415 V436 I441 V456	F402-V411 HydrophobicContact CD1-CG2 4.18Å; F402-V411 HydrophobicContact CD2-CG1 3.92Å; F402-V411 HydrophobicContact CD2-CG2 4.3Å; F402-V411 HydrophobicContact CE1-CG2 4.43Å; F402-V411 HydrophobicContact CE2-CG1 3.66Å; F402-V411 HydrophobicContact CG-CG2 4.11Å; F402-V411 HydrophobicContact CZ-CG1 4.06Å; L406-V411 HydrophobicContact CB-CG2 4.06Å; S407-V411 PolarHBondContact O-N 2.92Å; C408-V411 PolarHBondContact O-N 3.46Å; V411-K413 VanDerWaalsContact C-N 3.29Å; V411-K413 PolarHBondContact O-N 3.03Å; V411-V414 PolarHBondContact O-N 2.64Å; V411-L415 HydrophobicContact CG1-CD1 3.87Å; V411-L415 HydrophobicContact CG1-CG 4.26Å; V411-L415 WeakPolarHBondContact O-CB 3.3Å; V411-L415 WeakPolarHBondContact O-CG 3.27Å; V411-L415 PolarHBondContact O-N 3.04Å; V411-V436 HydrophobicContact CG1-CG1 4.09Å; V411-I441 HydrophobicContact CB-CD1 4.24Å; V411-I441 HydrophobicContact CG1-CD1 3.58Å; V411-V456 HydrophobicContact CB-CG2 4.49Å; V411-V456 HydrophobicContact CG1-CG2 4.32Å; V411-V456 HydrophobicContact CG2-CB 4Å; V411-V456 HydrophobicContact CG2-CG1 4.22Å; V411-V456 HydrophobicContact CG2-CG2 4.05Å
412	I	94	Very high	93	Very high	18 Å²	18	70 Å²	70	9%	0.092	35%	0.349	C	S	.	.	H	α-helix	trans	-55.3	-45.9	175.9	-70.3	164	0	0	0	111.2	C408 K416 L438 I441 L442 L452	C408-I412 VanDerWaalsContact O-CG1 3.25Å; C408-I412 WeakPolarHBondContact O-CG1 3.23Å; C408-I412 PolarHBondContact O-N 2.91Å; I412-K416 HydrophobicContact CG2-CD 4.16Å; I412-K416 WeakPolarHBondContact O-CB 3.43Å; I412-K416 WeakPolarHBondContact O-CG 3.09Å; I412-K416 PolarHBondContact O-N 3.35Å; I412-L438 HydrophobicContact CB-CD1 4.25Å; I412-L438 HydrophobicContact CG1-CD1 3.97Å; I412-L438 HydrophobicContact CG2-CD1 3.88Å; I412-I441 HydrophobicContact CD1-CG2 3.69Å; I412-I441 HydrophobicContact CG1-CB 4.43Å; I412-I441 HydrophobicContact CG1-CD1 4.23Å; I412-I441 HydrophobicContact CG1-CG2 3.95Å; I412-L442 HydrophobicContact CD1-CD2 4.14Å; I412-L452 HydrophobicContact CD1-CD2 3.81Å
413	K	94.8	Very high	92.8	Very high	126 Å²	126	69.5 Å²	69.5	55%	0.548	35%	0.347	S	S	.	.	H	α-helix	trans	-61.1	-49.7	-179.1	-178.3	176.3	174.7	179.1	0	111.1	Q409 K410 V411 K416 E417	Q409-K413 PolarHBondContact O-N 3.38Å; K410-K413 PolarHBondContact O-N 3.39Å; V411-K413 VanDerWaalsContact C-N 3.29Å; V411-K413 PolarHBondContact O-N 3.03Å; K413-K416 PolarHBondContact O-N 3.3Å; K413-E417 WeakPolarHBondContact CE-OE1 3.44Å; K413-E417 HydrophobicContact CG-CG 4.41Å; K413-E417 WeakPolarHBondContact CG-OE1 3.4Å; K413-E417 IonicContact NZ-OE1 2.81Å; K413-E417 WeakPolarHBondContact O-CB 3.4Å; K413-E417 WeakPolarHBondContact O-CG 3.29Å; K413-E417 PolarHBondContact O-N 3.44Å
414	V	94.5	Very high	92.8	Very high	35 Å²	35	68.5 Å²	68.5	21%	0.212	34%	0.338	C	S	.	.	H	α-helix	trans	-65.3	-43.3	-178.8	178.2	0	0	0	0	111.3	L400 F402 K410 V411 K416 E417 K418	L400-V414 HydrophobicContact CD2-CG1 3.71Å; F402-V414 HydrophobicContact CE1-CB 3.87Å; F402-V414 HydrophobicContact CE1-CG1 3.8Å; F402-V414 HydrophobicContact CE1-CG2 4.36Å; F402-V414 HydrophobicContact CZ-CB 3.92Å; F402-V414 HydrophobicContact CZ-CG1 3.86Å; K410-V414 WeakPolarHBondContact O-CG2 3.36Å; K410-V414 PolarHBondContact O-N 3.14Å; V411-V414 PolarHBondContact O-N 2.64Å; V414-K416 PolarHBondContact O-N 2.97Å; V414-E417 PolarHBondContact O-N 2.93Å; V414-K418 HydrophobicContact CG1-CG 4.08Å; V414-K418 VanDerWaalsContact O-CB 3.3Å; V414-K418 WeakPolarHBondContact O-CB 3.5Å; V414-K418 WeakPolarHBondContact O-CG 3.3Å; V414-K418 PolarHBondContact O-N 3.48Å
415	L	92.4	Very high	92.7	Very high	0 Å²	0	67.3 Å²	67.3	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-57.3	-47.1	176.8	-77.2	179.5	0	0	0	111.5	F402 V411 A419 F420 A423 L438	F402-L415 HydrophobicContact CE2-CD2 3.83Å; F402-L415 HydrophobicContact CE2-CG 3.94Å; F402-L415 HydrophobicContact CZ-CD2 4.19Å; F402-L415 HydrophobicContact CZ-CG 4.11Å; V411-L415 HydrophobicContact CG1-CD1 3.87Å; V411-L415 HydrophobicContact CG1-CG 4.26Å; V411-L415 WeakPolarHBondContact O-CB 3.3Å; V411-L415 WeakPolarHBondContact O-CG 3.27Å; V411-L415 PolarHBondContact O-N 3.04Å; L415-A419 WeakPolarHBondContact O-CA 3.33Å; L415-A419 PolarHBondContact O-N 3.22Å; L415-F420 CarbonylContact C-O 3.49Å; L415-F420 VanDerWaalsContact CB-O 3.32Å; L415-F420 WeakPolarHBondContact CB-O 3.4Å; L415-F420 HydrophobicContact CD2-CB 3.8Å; L415-F420 PolarHBondContact O-N 2.92Å; L415-A423 HydrophobicContact CD2-CB 4.11Å; L415-L438 HydrophobicContact CD1-CB 4.45Å
416	K	91	Very high	92.6	Very high	137 Å²	137	62.6 Å²	62.6	60%	0.596	31%	0.313	S	S	*	.	H	α-helix	trans	-64.5	-46.4	176.4	-73.6	-176.6	176.3	-173.9	0	113.1	I412 K413 V414 K418 A419 L438	I412-K416 HydrophobicContact CG2-CD 4.16Å; I412-K416 WeakPolarHBondContact O-CB 3.43Å; I412-K416 WeakPolarHBondContact O-CG 3.09Å; I412-K416 PolarHBondContact O-N 3.35Å; K413-K416 PolarHBondContact O-N 3.3Å; V414-K416 PolarHBondContact O-N 2.97Å; K416-K418 VanDerWaalsContact C-N 3.29Å; K416-K418 PolarHBondContact O-N 3.33Å; K416-A419 PolarHBondContact O-N 3.14Å; K416-L438 HydrophobicContact CG-CD2 4.47Å
417	E	92.3	Very high	92.4	Very high	130 Å²	130	62.3 Å²	62.3	61%	0.607	31%	0.313	S	S	*	.	H	α-helix	trans	-64.2	-35.1	-179.3	-77.1	176.5	175	0	0	112.4	K413 V414	K413-E417 WeakPolarHBondContact CE-OE1 3.44Å; K413-E417 HydrophobicContact CG-CG 4.41Å; K413-E417 WeakPolarHBondContact CG-OE1 3.4Å; K413-E417 IonicContact NZ-OE1 2.81Å; K413-E417 WeakPolarHBondContact O-CB 3.4Å; K413-E417 WeakPolarHBondContact O-CG 3.29Å; K413-E417 PolarHBondContact O-N 3.44Å; V414-E417 PolarHBondContact O-N 2.93Å
418	K	89.8	Confident	91.9	Very high	136 Å²	136	69.1 Å²	69.1	59%	0.591	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.2	0.2	179.7	-62.2	-67	-173.2	176.7	0	113.3	V414 K416 F420	V414-K418 HydrophobicContact CG1-CG 4.08Å; V414-K418 VanDerWaalsContact O-CB 3.3Å; V414-K418 WeakPolarHBondContact O-CB 3.5Å; V414-K418 WeakPolarHBondContact O-CG 3.3Å; V414-K418 PolarHBondContact O-N 3.48Å; K416-K418 VanDerWaalsContact C-N 3.29Å; K416-K418 PolarHBondContact O-N 3.33Å; K418-F420 VanDerWaalsContact C-N 3.3Å; K418-F420 HydrophobicContact CB-CD2 3.58Å; K418-F420 HydrophobicContact CB-CE2 3.99Å; K418-F420 WeakPolarHBondContact O-CD2 3.48Å; K418-F420 WeakPolarHBondContact O-CE2 3.49Å; K418-F420 PolarHBondContact O-N 3.33Å
419	A	87.7	Confident	91.5	Very high	91 Å²	91	73.9 Å²	73.9	75%	0.752	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.8	42	-176.5	0	0	0	0	0	113.8	L415 K416	L415-A419 WeakPolarHBondContact O-CA 3.33Å; L415-A419 PolarHBondContact O-N 3.22Å; K416-A419 PolarHBondContact O-N 3.14Å
420	F	87.3	Confident	90.9	Very high	93 Å²	93	70.6 Å²	70.6	41%	0.408	37%	0.373	S	S	.	.			trans	-109	140.9	170.5	-73	-91.8	0	0	0	110.2	L415 K418	L415-F420 CarbonylContact C-O 3.49Å; L415-F420 VanDerWaalsContact CB-O 3.32Å; L415-F420 WeakPolarHBondContact CB-O 3.4Å; L415-F420 HydrophobicContact CD2-CB 3.8Å; L415-F420 PolarHBondContact O-N 2.92Å; K418-F420 VanDerWaalsContact C-N 3.3Å; K418-F420 HydrophobicContact CB-CD2 3.58Å; K418-F420 HydrophobicContact CB-CE2 3.99Å; K418-F420 WeakPolarHBondContact O-CD2 3.48Å; K418-F420 WeakPolarHBondContact O-CE2 3.49Å; K418-F420 PolarHBondContact O-N 3.33Å
421	D	85.8	Confident	90.5	Very high	116 Å²	116	71 Å²	71	62%	0.62	38%	0.376	S	S	*	.	S	Bend	trans	-93.3	-13.5	175.3	-66.7	-45.8	0	0	0	113.1	T437 L438	D421-T437 CarbonylContact O-C 3.58Å; D421-T437 VanDerWaalsContact O-CA 3.28Å; D421-T437 WeakPolarHBondContact O-CA 3.49Å; D421-T437 WeakPolarHBondContact O-CB 3.34Å; D421-L438 PolarHBondContact O-N 2.88Å
422	Q	90.2	Very high	90.2	Very high	92 Å²	92	72.7 Å²	72.7	43%	0.43	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	155.6	-173.9	67.9	-164.4	34.8	0	0	112.6	M435 V436 T437 F485	Q422-M435 HydrophobicContact CB-CE 4.33Å; Q422-M435 HydrophobicContact CG-CE 4.29Å; Q422-V436 CarbonylContact C-O 3.24Å; Q422-V436 WeakPolarHBondContact CA-O 3.42Å; Q422-T437 HydrophobicContact CB-CG2 4.03Å; Q422-F485 VanDerWaalsContact OE1-CE1 3.29Å
423	A	91.9	Very high	89.9	Confident	1 Å²	1	74.3 Å²	74.3	1%	0.008	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	148.6	175.9	0	0	0	0	0	111.6	L400 F402 L415 V436	L400-A423 VanDerWaalsContact O-CB 3.28Å; L400-A423 WeakPolarHBondContact O-CB 3.34Å; F402-A423 HydrophobicContact CD2-CB 3.46Å; F402-A423 VanDerWaalsContact CD2-CB 3.46Å; F402-A423 HydrophobicContact CE2-CB 3.38Å; L415-A423 HydrophobicContact CD2-CB 4.11Å; A423-V436 HydrophobicContact CB-CG1 4.45Å; A423-V436 PolarHBondContact N-O 3.2Å; A423-V436 PolarHBondContact O-N 2.8Å
424	P	93.6	Very high	89.7	Confident	6 Å²	6	68.3 Å²	68.3	4%	0.039	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	145.2	168.6	-10.5	28.2	0	0	0	111.2	P399 L400 T401 F402 V426 M435 L487	P399-P424 HydrophobicContact CB-CG 4.29Å; P399-P424 HydrophobicContact CG-CG 4.14Å; L400-P424 WeakPolarHBondContact O-CD 3.5Å; T401-P424 WeakPolarHBondContact CA-O 3.49Å; T401-P424 HydrophobicContact CG2-CB 4.39Å; T401-P424 HydrophobicContact CG2-CG 4.33Å; F402-P424 PolarHBondContact N-O 3.17Å; P424-V426 HydrophobicContact CB-CG2 4.38Å; P424-M435 HydrophobicContact CB-SD 3.83Å; P424-M435 HydrophobicContact CG-CE 4.46Å; P424-M435 HydrophobicContact CG-SD 3.82Å; P424-L487 HydrophobicContact CB-CD2 4.05Å; P424-L487 HydrophobicContact CG-CD2 3.66Å
425	V	93.7	Very high	89.6	Confident	0 Å²	0	67 Å²	67	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	122.4	171.2	-177.3	0	0	0	0	108.5	F402 P404 L433 G434 V436 V456 L460	F402-V425 HydrophobicContact CB-CG2 4.44Å; F402-V425 CarbonylContact O-C 3.46Å; F402-V425 VanDerWaalsContact O-CA 3.31Å; F402-V425 WeakPolarHBondContact O-CA 3.06Å; P404-V425 HydrophobicContact CB-CG1 4.03Å; V425-L433 PolarHBondContact O-N 3.43Å; V425-G434 PolarHBondContact N-O 2.88Å; V425-V436 HydrophobicContact CG2-CB 4.16Å; V425-V436 HydrophobicContact CG2-CG1 4Å; V425-V456 HydrophobicContact CG1-CG1 4.33Å; V425-V456 HydrophobicContact CG2-CG1 4.24Å; V425-L460 HydrophobicContact CB-CD2 3.64Å; V425-L460 HydrophobicContact CG1-CD2 3.99Å; V425-L460 HydrophobicContact CG2-CD2 3.46Å; V425-L460 VanDerWaalsContact CG2-CD2 3.46Å
426	V	92.5	Very high	89.6	Confident	32 Å²	32	67 Å²	67	19%	0.194	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	135.1	-171.4	-171.7	0	0	0	0	109	T401 F402 P404 P424 E431 I432	T401-V426 HydrophobicContact CG2-CG2 4.04Å; F402-V426 PolarHBondContact O-N 3.05Å; P404-V426 VanDerWaalsContact CD-O 3.25Å; P404-V426 WeakPolarHBondContact CD-O 3.43Å; P424-V426 HydrophobicContact CB-CG2 4.38Å; V426-E431 CarbonylContact C-O 3.58Å; V426-E431 WeakPolarHBondContact CA-O 3.3Å; V426-E431 WeakPolarHBondContact CG1-O 3.29Å; V426-I432 HydrophobicContact CG2-CG1 4.37Å
427	S	90.3	Very high	89.6	Confident	22 Å²	22	61.8 Å²	61.8	15%	0.154	34%	0.339	C	S	.	.			trans	-71.4	169	176.3	71.7	0	0	0	0	111.7	S429 G430 E431	S427-S429 PolarHBondContact O-N 3.12Å; S427-S429 PolarHBondContact OG-N 3.32Å; S427-S429 PolarHBondContact OG-OG 2.99Å; S427-G430 PolarHBondContact O-N 3.41Å; S427-E431 PolarHBondContact N-O 3.5Å; S427-E431 WeakPolarHBondContact OG-CB 2.91Å; S427-E431 PolarHBondContact OG-N 2.8Å; S427-E431 VanDerWaalsContact OG-N 3.07Å; S427-E431 PolarHBondContact OG-O 3.19Å
428	E	87.8	Confident	89.5	Confident	178 Å²	178	57 Å²	57	83%	0.832	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-24.1	174.9	-65.4	-177.9	177.5	0	0	112.8	G430	E428-G430 VanDerWaalsContact C-N 3.28Å
429	S	85.3	Confident	89.3	Confident	101 Å²	101	52.7 Å²	52.7	71%	0.706	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	2.5	175.5	56.8	0	0	0	0	113.9	S427 E431	S427-S429 PolarHBondContact O-N 3.12Å; S427-S429 PolarHBondContact OG-N 3.32Å; S427-S429 PolarHBondContact OG-OG 2.99Å; S429-E431 VanDerWaalsContact C-N 3.31Å
430	G	83.1	Confident	89.1	Confident	52 Å²	52	50.4 Å²	50.4	54%	0.536	29%	0.289	S	S	.	.	S	Bend	trans	83	3.4	-178.8	0	0	0	0	0	114.5	S427 E428	S427-G430 PolarHBondContact O-N 3.41Å; E428-G430 VanDerWaalsContact C-N 3.28Å
431	E	87	Confident	89.3	Confident	124 Å²	124	46 Å²	46	58%	0.579	27%	0.27	S	S	*	.			trans	-73.3	130.3	175.9	-173.9	-175.8	-173.4	0	0	110.6	V426 S427 S429 L433	V426-E431 CarbonylContact C-O 3.58Å; V426-E431 WeakPolarHBondContact CA-O 3.3Å; V426-E431 WeakPolarHBondContact CG1-O 3.29Å; S427-E431 PolarHBondContact N-O 3.5Å; S427-E431 WeakPolarHBondContact OG-CB 2.91Å; S427-E431 PolarHBondContact OG-N 2.8Å; S427-E431 VanDerWaalsContact OG-N 3.07Å; S427-E431 PolarHBondContact OG-O 3.19Å; S429-E431 VanDerWaalsContact C-N 3.31Å; E431-L433 HydrophobicContact CG-CD2 4.45Å; E431-L433 PolarHBondContact O-N 3.2Å
432	I	89.3	Confident	89.5	Confident	37 Å²	37	44.2 Å²	44.2	19%	0.19	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	111.9	176.7	-54.4	168.1	0	0	0	109	V426 F464 L487 V489	V426-I432 HydrophobicContact CG2-CG1 4.37Å; I432-F464 HydrophobicContact CB-CZ 4.48Å; I432-F464 HydrophobicContact CG2-CE2 4.27Å; I432-F464 HydrophobicContact CG2-CZ 3.99Å; I432-L487 HydrophobicContact CD1-CD1 4.47Å; I432-L487 HydrophobicContact CG2-CD1 3.73Å; I432-V489 HydrophobicContact CD1-CG1 3.8Å
433	L	88.3	Confident	89.3	Confident	52 Å²	52	42.5 Å²	42.5	27%	0.272	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	-23.7	-176.9	-59.3	177	0	0	0	112.9	P404 V425 E431 L460	P404-L433 HydrophobicContact CB-CD1 3.74Å; P404-L433 HydrophobicContact CG-CD1 3.85Å; V425-L433 PolarHBondContact O-N 3.43Å; E431-L433 HydrophobicContact CG-CD2 4.45Å; E431-L433 PolarHBondContact O-N 3.2Å; L433-L460 HydrophobicContact CB-CD1 3.93Å
434	G	90.2	Very high	89.1	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	160.8	-174.7	-179.5	0	0	0	0	0	114	V425 F461	V425-G434 PolarHBondContact N-O 2.88Å; G434-F461 WeakPolarHBondContact CA-O 3.47Å
435	M	92.3	Very high	89	Confident	7 Å²	7	44.9 Å²	44.9	3%	0.034	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	148.6	172.8	-69.9	-64.5	-67.2	0	0	110.5	Q422 P424 F461 F485 L487	Q422-M435 HydrophobicContact CB-CE 4.33Å; Q422-M435 HydrophobicContact CG-CE 4.29Å; P424-M435 HydrophobicContact CB-SD 3.83Å; P424-M435 HydrophobicContact CG-CE 4.46Å; P424-M435 HydrophobicContact CG-SD 3.82Å; M435-F461 HydrophobicContact CB-CB 4.28Å; M435-F461 PolarHBondContact N-O 3.19Å; M435-F461 WeakPolarHBondContact O-CB 3.39Å; M435-F461 PolarHBondContact O-N 2.91Å; M435-F485 HydrophobicContact CB-CD2 3.93Å; M435-F485 HydrophobicContact CB-CE2 4.14Å; M435-F485 HydrophobicContact CB-CG 4.3Å; M435-F485 HydrophobicContact CE-CD1 3.95Å; M435-F485 HydrophobicContact CE-CE1 4.33Å; M435-F485 HydrophobicContact CE-CG 4.27Å; M435-F485 HydrophobicContact CG-CB 4Å; M435-F485 HydrophobicContact CG-CD1 4.44Å; M435-F485 HydrophobicContact CG-CD2 3.9Å; M435-F485 HydrophobicContact CG-CG 3.83Å; M435-L487 HydrophobicContact CG-CD1 4.2Å; M435-L487 HydrophobicContact SD-CD1 3.91Å; M435-L487 HydrophobicContact SD-CD2 3.78Å; M435-L487 HydrophobicContact SD-CG 4.05Å
436	V	92.6	Very high	88.9	Confident	0 Å²	0	53 Å²	53	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	141.5	167.2	72.9	0	0	0	0	109.9	F402 V411 Q422 A423 V425 I441 V456 V459	F402-V436 HydrophobicContact CD2-CG1 4.21Å; V411-V436 HydrophobicContact CG1-CG1 4.09Å; Q422-V436 CarbonylContact C-O 3.24Å; Q422-V436 WeakPolarHBondContact CA-O 3.42Å; A423-V436 HydrophobicContact CB-CG1 4.45Å; A423-V436 PolarHBondContact N-O 3.2Å; A423-V436 PolarHBondContact O-N 2.8Å; V425-V436 HydrophobicContact CG2-CB 4.16Å; V425-V436 HydrophobicContact CG2-CG1 4Å; V436-I441 HydrophobicContact CG2-CD1 3.5Å; V436-I441 HydrophobicContact CG2-CG1 3.42Å; V436-I441 VanDerWaalsContact CG2-CG1 3.42Å; V436-V456 HydrophobicContact CB-CG2 4.04Å; V436-V456 HydrophobicContact CG1-CG2 4.14Å; V436-V456 HydrophobicContact CG2-CG2 3.62Å; V436-V459 HydrophobicContact CG2-CG2 4.32Å
437	T	91.1	Very high	88.6	Confident	27 Å²	27	55.8 Å²	55.8	17%	0.166	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	153.6	171.9	84.9	0	0	0	0	110.9	D421 Q422 G439 T440 I441 F485	D421-T437 CarbonylContact O-C 3.58Å; D421-T437 VanDerWaalsContact O-CA 3.28Å; D421-T437 WeakPolarHBondContact O-CA 3.49Å; D421-T437 WeakPolarHBondContact O-CB 3.34Å; Q422-T437 HydrophobicContact CB-CG2 4.03Å; T437-G439 PolarHBondContact O-N 3.17Å; T437-G439 PolarHBondContact OG1-N 3Å; T437-T440 PolarHBondContact O-N 3.46Å; T437-T440 PolarHBondContact OG1-N 3.34Å; T437-T440 PolarHBondContact OG1-OG1 2.93Å; T437-I441 WeakPolarHBondContact O-CG1 3.49Å; T437-I441 PolarHBondContact O-N 3.32Å; T437-I441 VanDerWaalsContact O-N 3.14Å; T437-F485 HydrophobicContact CG2-CE1 4.43Å; T437-F485 HydrophobicContact CG2-CE2 4.39Å; T437-F485 HydrophobicContact CG2-CZ 3.64Å
438	L	89.6	Confident	88.4	Confident	29 Å²	29	57.7 Å²	57.7	15%	0.152	35%	0.348	C	S	.	.	H	α-helix	trans	-56	-40.3	174.2	-175.8	63.4	0	0	0	111.2	I412 L415 K416 D421 L442	I412-L438 HydrophobicContact CB-CD1 4.25Å; I412-L438 HydrophobicContact CG1-CD1 3.97Å; I412-L438 HydrophobicContact CG2-CD1 3.88Å; L415-L438 HydrophobicContact CD1-CB 4.45Å; K416-L438 HydrophobicContact CG-CD2 4.47Å; D421-L438 PolarHBondContact O-N 2.88Å; L438-L442 HydrophobicContact CD1-CD1 4.07Å; L438-L442 HydrophobicContact CD1-CG 4.28Å; L438-L442 HydrophobicContact CG-CD1 3.87Å; L438-L442 HydrophobicContact CG-CG 4.45Å; L438-L442 WeakPolarHBondContact O-CB 3.35Å; L438-L442 VanDerWaalsContact O-CG 3.23Å; L438-L442 WeakPolarHBondContact O-CG 3.25Å; L438-L442 PolarHBondContact O-N 3.27Å
439	G	85.1	Confident	88.3	Confident	47 Å²	47	55.9 Å²	55.9	49%	0.485	34%	0.337	S	S	.	.	H	α-helix	trans	-62.7	-44.8	177.9	0	0	0	0	0	112.9	T437 L442 S443	T437-G439 PolarHBondContact O-N 3.17Å; T437-G439 PolarHBondContact OG1-N 3Å; G439-L442 PolarHBondContact O-N 2.88Å; G439-S443 WeakPolarHBondContact O-CB 3.28Å; G439-S443 PolarHBondContact O-N 2.77Å
440	T	84.7	Confident	88.6	Confident	43 Å²	43	51.6 Å²	51.6	26%	0.264	31%	0.307	S	S	.	.	H	α-helix	trans	-66.5	-41	-179	-16.5	0	0	0	0	111.9	T437 S444	T437-T440 PolarHBondContact O-N 3.46Å; T437-T440 PolarHBondContact OG1-N 3.34Å; T437-T440 PolarHBondContact OG1-OG1 2.93Å; T440-S444 VanDerWaalsContact O-CB 3.29Å; T440-S444 WeakPolarHBondContact O-CB 3.49Å; T440-S444 PolarHBondContact O-N 2.86Å; T440-S444 PolarHBondContact O-OG 3.35Å
441	I	90.4	Very high	89.2	Confident	0 Å²	0	56 Å²	56	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-64.5	-50.3	177	-57.3	165.5	0	0	0	109.7	C408 V411 I412 V436 T437 S443 S444 V445 V459	C408-I441 HydrophobicContact CB-CG2 3.72Å; V411-I441 HydrophobicContact CB-CD1 4.24Å; V411-I441 HydrophobicContact CG1-CD1 3.58Å; I412-I441 HydrophobicContact CD1-CG2 3.69Å; I412-I441 HydrophobicContact CG1-CB 4.43Å; I412-I441 HydrophobicContact CG1-CD1 4.23Å; I412-I441 HydrophobicContact CG1-CG2 3.95Å; V436-I441 HydrophobicContact CG2-CD1 3.5Å; V436-I441 HydrophobicContact CG2-CG1 3.42Å; V436-I441 VanDerWaalsContact CG2-CG1 3.42Å; T437-I441 WeakPolarHBondContact O-CG1 3.49Å; T437-I441 PolarHBondContact O-N 3.32Å; T437-I441 VanDerWaalsContact O-N 3.14Å; I441-S443 PolarHBondContact O-N 3.17Å; I441-S444 PolarHBondContact O-N 3.07Å; I441-V445 HydrophobicContact CG2-CG2 4.32Å; I441-V445 VanDerWaalsContact O-CG2 3.29Å; I441-V445 WeakPolarHBondContact O-CG2 3.21Å; I441-V445 PolarHBondContact O-N 2.85Å; I441-V459 HydrophobicContact CG1-CG2 4.05Å
442	L	90.1	Very high	89.5	Confident	78 Å²	78	53.8 Å²	53.8	41%	0.408	30%	0.303	S	S	.	.	H	α-helix	trans	-62.4	-44	-177.4	-71	174.5	0	0	0	112	I412 L438 G439 V445 Q446	I412-L442 HydrophobicContact CD1-CD2 4.14Å; L438-L442 HydrophobicContact CD1-CD1 4.07Å; L438-L442 HydrophobicContact CD1-CG 4.28Å; L438-L442 HydrophobicContact CG-CD1 3.87Å; L438-L442 HydrophobicContact CG-CG 4.45Å; L438-L442 WeakPolarHBondContact O-CB 3.35Å; L438-L442 VanDerWaalsContact O-CG 3.23Å; L438-L442 WeakPolarHBondContact O-CG 3.25Å; L438-L442 PolarHBondContact O-N 3.27Å; G439-L442 PolarHBondContact O-N 2.88Å; L442-V445 PolarHBondContact O-N 3.34Å; L442-Q446 VanDerWaalsContact O-CB 3.3Å; L442-Q446 WeakPolarHBondContact O-CB 3.48Å; L442-Q446 PolarHBondContact O-N 2.77Å
443	S	86.6	Confident	89.8	Confident	56 Å²	56	55.9 Å²	55.9	39%	0.392	32%	0.321	S	S	.	.	H	α-helix	trans	-60.9	-44.8	175.3	177.8	0	0	0	0	111.6	G439 I441 V445 Q446 D447	G439-S443 WeakPolarHBondContact O-CB 3.28Å; G439-S443 PolarHBondContact O-N 2.77Å; I441-S443 PolarHBondContact O-N 3.17Å; S443-V445 VanDerWaalsContact C-N 3.35Å; S443-V445 PolarHBondContact O-N 3.39Å; S443-Q446 PolarHBondContact O-N 2.86Å; S443-D447 WeakPolarHBondContact O-CB 3.5Å; S443-D447 VanDerWaalsContact O-CG 3.31Å; S443-D447 PolarHBondContact O-N 3.06Å
444	S	88	Confident	90.1	Very high	17 Å²	17	55.3 Å²	55.3	12%	0.119	32%	0.318	C	S	.	.	H	α-helix	trans	-67	-34.3	179.5	-57	0	0	0	0	113.2	T440 I441 G448 K449 V450	T440-S444 VanDerWaalsContact O-CB 3.29Å; T440-S444 WeakPolarHBondContact O-CB 3.49Å; T440-S444 PolarHBondContact O-N 2.86Å; T440-S444 PolarHBondContact O-OG 3.35Å; I441-S444 PolarHBondContact O-N 3.07Å; S444-G448 PolarHBondContact O-N 3.38Å; S444-K449 WeakPolarHBondContact O-CB 3.34Å; S444-K449 PolarHBondContact O-N 3Å; S444-V450 PolarHBondContact O-N 3.2Å
445	V	91.1	Very high	90.3	Very high	41 Å²	41	57.4 Å²	57.4	25%	0.248	33%	0.332	C	S	.	.	H	α-helix	trans	-70	-43.6	173.2	172.4	0	0	0	0	110.8	I441 L442 S443 D447 G448 V450 L452	I441-V445 HydrophobicContact CG2-CG2 4.32Å; I441-V445 VanDerWaalsContact O-CG2 3.29Å; I441-V445 WeakPolarHBondContact O-CG2 3.21Å; I441-V445 PolarHBondContact O-N 2.85Å; L442-V445 PolarHBondContact O-N 3.34Å; S443-V445 VanDerWaalsContact C-N 3.35Å; S443-V445 PolarHBondContact O-N 3.39Å; V445-D447 VanDerWaalsContact C-N 3.34Å; V445-D447 PolarHBondContact O-N 2.89Å; V445-G448 PolarHBondContact O-N 3.04Å; V445-G448 VanDerWaalsContact O-N 3.09Å; V445-V450 HydrophobicContact CG2-CG2 3.87Å; V445-L452 HydrophobicContact CG1-CD2 4.27Å; V445-L452 HydrophobicContact CG1-CG 4.22Å; V445-L452 HydrophobicContact CG2-CD2 4.04Å
446	Q	91.7	Very high	90.4	Very high	169 Å²	169	57.1 Å²	57.1	79%	0.79	33%	0.33	S	S	*	.	H	α-helix	trans	-63.4	-40.1	178.3	-178.8	176.5	-7.6	0	0	112.1	L442 S443 G448	L442-Q446 VanDerWaalsContact O-CB 3.3Å; L442-Q446 WeakPolarHBondContact O-CB 3.48Å; L442-Q446 PolarHBondContact O-N 2.77Å; S443-Q446 PolarHBondContact O-N 2.86Å; Q446-G448 PolarHBondContact O-N 3.45Å
447	D	86.3	Confident	90.4	Very high	91 Å²	91	59.6 Å²	59.6	49%	0.487	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-4.2	175.6	-73.6	-4.2	0	0	0	113	S443 V445 K449	S443-D447 WeakPolarHBondContact O-CB 3.5Å; S443-D447 VanDerWaalsContact O-CG 3.31Å; S443-D447 PolarHBondContact O-N 3.06Å; V445-D447 VanDerWaalsContact C-N 3.34Å; V445-D447 PolarHBondContact O-N 2.89Å; D447-K449 HydrophobicContact CB-CD 4.17Å; D447-K449 HydrophobicContact CB-CG 4.01Å; D447-K449 PolarHBondContact O-N 3.38Å; D447-K449 WeakPolarHBondContact OD2-CE 3.13Å; D447-K449 IonicContact OD2-NZ 3.93Å; D447-K449 PolarHBondContact OD2-NZ 2.94Å
448	G	86.9	Confident	90.3	Very high	63 Å²	63	63.7 Å²	63.7	65%	0.649	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.1	13.9	-178.2	0	0	0	0	0	114.8	S444 V445 Q446	S444-G448 PolarHBondContact O-N 3.38Å; V445-G448 PolarHBondContact O-N 3.04Å; V445-G448 VanDerWaalsContact O-N 3.09Å; Q446-G448 PolarHBondContact O-N 3.45Å
449	K	84.6	Confident	90.3	Very high	139 Å²	139	62.9 Å²	62.9	60%	0.604	36%	0.362	S	S	*	.	S	Bend	trans	-73.8	-31.5	-179.8	-64.1	175.8	-171.2	145.5	0	112.5	S444 D447	S444-K449 WeakPolarHBondContact O-CB 3.34Å; S444-K449 PolarHBondContact O-N 3Å; D447-K449 HydrophobicContact CB-CD 4.17Å; D447-K449 HydrophobicContact CB-CG 4.01Å; D447-K449 PolarHBondContact O-N 3.38Å; D447-K449 WeakPolarHBondContact OD2-CE 3.13Å; D447-K449 IonicContact OD2-NZ 3.93Å; D447-K449 PolarHBondContact OD2-NZ 2.94Å
450	V	92.4	Very high	90.5	Very high	11 Å²	11	62.3 Å²	62.3	7%	0.067	35%	0.348	C	S	.	.	S	Bend	trans	-140.1	154.7	176.5	-63.7	0	0	0	0	111.1	S444 V445 D454 M458 V459	S444-V450 PolarHBondContact O-N 3.2Å; V445-V450 HydrophobicContact CG2-CG2 3.87Å; V450-D454 HydrophobicContact CB-CB 4.4Å; V450-M458 HydrophobicContact CG1-CB 3.95Å; V450-M458 HydrophobicContact CG1-CE 4.27Å; V450-V459 HydrophobicContact CB-CG1 4.31Å; V450-V459 HydrophobicContact CG1-CG1 3.71Å; V450-V459 HydrophobicContact CG2-CG1 3.68Å
451	K	94.4	Very high	90.4	Very high	145 Å²	145	63 Å²	63	63%	0.63	35%	0.348	S	S	*	.			trans	-93.6	158.2	170.5	-59.7	175.2	-177	173.4	0	110.4	S453 D454	K451-S453 PolarHBondContact O-N 2.98Å; K451-S453 VanDerWaalsContact O-N 3.14Å; K451-D454 WeakPolarHBondContact CB-OD2 3.28Å; K451-D454 PolarHBondContact N-OD2 2.94Å; K451-D454 WeakPolarHBondContact O-CB 3.42Å; K451-D454 PolarHBondContact O-N 2.83Å
452	L	93.7	Very high	89.9	Confident	77 Å²	77	70 Å²	70	40%	0.403	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-25.5	174.7	-74	175.1	0	0	0	113.5	C408 Q409 I412 V445	C408-L452 PolarHBondContact N-O 2.84Å; Q409-L452 HydrophobicContact CB-CB 4.18Å; Q409-L452 WeakPolarHBondContact CB-O 3.37Å; Q409-L452 PolarHBondContact N-O 3.2Å; I412-L452 HydrophobicContact CD1-CD2 3.81Å; V445-L452 HydrophobicContact CG1-CD2 4.27Å; V445-L452 HydrophobicContact CG1-CG 4.22Å; V445-L452 HydrophobicContact CG2-CD2 4.04Å
453	S	95.1	Very high	89.2	Confident	82 Å²	82	70.1 Å²	70.1	57%	0.573	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-19.6	175.1	51.9	0	0	0	0	114.1	K451	K451-S453 PolarHBondContact O-N 2.98Å; K451-S453 VanDerWaalsContact O-N 3.14Å
454	D	94.8	Very high	89.1	Confident	40 Å²	40	69.2 Å²	69.2	21%	0.214	37%	0.371	C	S	.	.	S	Bend	trans	-75.5	151.6	-171.2	-63.7	-12.3	0	0	0	110.9	S407 C408 V450 K451 M458	S407-D454 WeakPolarHBondContact CA-O 3.23Å; C408-D454 PolarHBondContact N-O 2.79Å; C408-D454 PolarHBondContact SG-O 3.39Å; C408-D454 VanDerWaalsContact SG-O 3.33Å; V450-D454 HydrophobicContact CB-CB 4.4Å; K451-D454 WeakPolarHBondContact CB-OD2 3.28Å; K451-D454 PolarHBondContact N-OD2 2.94Å; K451-D454 WeakPolarHBondContact O-CB 3.42Å; K451-D454 PolarHBondContact O-N 2.83Å; D454-M458 HydrophobicContact CB-SD 4.13Å
455	P	95.9	Very high	88.8	Confident	44 Å²	44	76.1 Å²	76.1	29%	0.286	39%	0.394	S	S	.	.	B	Isolated β-bridge	trans	-66.7	145	-177.9	27.3	-34.5	0	0	0	111.9	L406 S457 M458	L406-P455 CarbonylContact O-C 3.56Å; L406-P455 WeakPolarHBondContact O-CA 3.25Å; P455-S457 PolarHBondContact O-N 3.19Å; P455-M458 HydrophobicContact CG-CG 4.15Å; P455-M458 HydrophobicContact CG-SD 4.13Å; P455-M458 PolarHBondContact O-N 3.18Å; P455-M458 VanDerWaalsContact O-N 3.16Å
456	V	93.6	Very high	88.7	Confident	0 Å²	0	79.2 Å²	79.2	0%	0	41%	0.406	C	S	.	.	G	3₁₀ helix	trans	-65.1	-20.6	-179	73.1	0	0	0	0	112.7	L406 V411 V425 V436 M458 V459	L406-V456 WeakPolarHBondContact O-CB 3.31Å; L406-V456 PolarHBondContact O-N 2.95Å; V411-V456 HydrophobicContact CB-CG2 4.49Å; V411-V456 HydrophobicContact CG1-CG2 4.32Å; V411-V456 HydrophobicContact CG2-CB 4Å; V411-V456 HydrophobicContact CG2-CG1 4.22Å; V411-V456 HydrophobicContact CG2-CG2 4.05Å; V425-V456 HydrophobicContact CG1-CG1 4.33Å; V425-V456 HydrophobicContact CG2-CG1 4.24Å; V436-V456 HydrophobicContact CB-CG2 4.04Å; V436-V456 HydrophobicContact CG1-CG2 4.14Å; V436-V456 HydrophobicContact CG2-CG2 3.62Å; V456-M458 PolarHBondContact O-N 3.31Å; V456-M458 VanDerWaalsContact O-N 3.07Å; V456-V459 HydrophobicContact CG2-CG2 4.01Å; V456-V459 VanDerWaalsContact O-CG2 3.3Å; V456-V459 WeakPolarHBondContact O-CG2 3.32Å; V456-V459 PolarHBondContact O-N 2.86Å
457	S	91.8	Very high	88.5	Confident	52 Å²	52	71.2 Å²	71.2	36%	0.364	37%	0.368	S	S	.	.	G	3₁₀ helix	trans	-57.8	-18.3	172.8	58.2	0	0	0	0	114.3	P404 P455 L460	P404-S457 WeakPolarHBondContact O-CB 3.01Å; P404-S457 PolarHBondContact O-N 3.07Å; P404-S457 PolarHBondContact O-OG 3.04Å; P455-S457 PolarHBondContact O-N 3.19Å; S457-L460 WeakPolarHBondContact O-CG 3.37Å
458	M	89.6	Confident	88.6	Confident	114 Å²	114	72.1 Å²	72.1	56%	0.562	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-81.6	-10.7	176.7	-65.3	-177.3	67.8	0	0	114.2	V450 D454 P455 V456	V450-M458 HydrophobicContact CG1-CB 3.95Å; V450-M458 HydrophobicContact CG1-CE 4.27Å; D454-M458 HydrophobicContact CB-SD 4.13Å; P455-M458 HydrophobicContact CG-CG 4.15Å; P455-M458 HydrophobicContact CG-SD 4.13Å; P455-M458 PolarHBondContact O-N 3.18Å; P455-M458 VanDerWaalsContact O-N 3.16Å; V456-M458 PolarHBondContact O-N 3.31Å; V456-M458 VanDerWaalsContact O-N 3.07Å
459	V	90	Very high	88.8	Confident	11 Å²	11	71.1 Å²	71.1	7%	0.067	35%	0.345	C	S	.	.	G	3₁₀ helix	trans	-127.4	31.6	-174.7	-68.1	0	0	0	0	112.6	V436 I441 V450 V456	V436-V459 HydrophobicContact CG2-CG2 4.32Å; I441-V459 HydrophobicContact CG1-CG2 4.05Å; V450-V459 HydrophobicContact CB-CG1 4.31Å; V450-V459 HydrophobicContact CG1-CG1 3.71Å; V450-V459 HydrophobicContact CG2-CG1 3.68Å; V456-V459 HydrophobicContact CG2-CG2 4.01Å; V456-V459 VanDerWaalsContact O-CG2 3.3Å; V456-V459 WeakPolarHBondContact O-CG2 3.32Å; V456-V459 PolarHBondContact O-N 2.86Å
460	L	88.8	Confident	89.1	Confident	36 Å²	36	69.4 Å²	69.4	19%	0.188	35%	0.346	C	S	.	.			trans	-75	138	-179.3	-59.8	179.4	0	0	0	111.8	V425 L433 S457 Q462	V425-L460 HydrophobicContact CB-CD2 3.64Å; V425-L460 HydrophobicContact CG1-CD2 3.99Å; V425-L460 HydrophobicContact CG2-CD2 3.46Å; V425-L460 VanDerWaalsContact CG2-CD2 3.46Å; L433-L460 HydrophobicContact CB-CD1 3.93Å; S457-L460 WeakPolarHBondContact O-CG 3.37Å; L460-Q462 HydrophobicContact CB-CG 4.38Å
461	F	82.1	Confident	88.8	Confident	58 Å²	58	69.6 Å²	69.6	25%	0.254	35%	0.347	S	S	.	.	B	Isolated β-bridge	trans	-90.6	108.1	163.3	-161.1	-96.1	0	0	0	108.4	G434 M435 D463 N484 F485	G434-F461 WeakPolarHBondContact CA-O 3.47Å; M435-F461 HydrophobicContact CB-CB 4.28Å; M435-F461 PolarHBondContact N-O 3.19Å; M435-F461 WeakPolarHBondContact O-CB 3.39Å; M435-F461 PolarHBondContact O-N 2.91Å; F461-D463 HydrophobicContact CD1-CB 4.21Å; F461-D463 WeakPolarHBondContact CD1-O 3.21Å; F461-D463 HydrophobicContact CE1-CB 3.62Å; F461-D463 WeakPolarHBondContact CE1-O 3.5Å; F461-D463 HydrophobicContact CZ-CB 3.97Å; F461-N484 HydrophobicContact CE1-CB 4.24Å; F461-N484 WeakPolarHBondContact CZ-ND2 3.47Å; F461-F485 AromaticContact CD1-CD2 3.61Å; F461-F485 HydrophobicContact CD1-CD2 3.61Å; F461-F485 AromaticContact CD1-CE2 3.58Å; F461-F485 HydrophobicContact CD1-CE2 3.58Å; F461-F485 AromaticContact CE1-CD2 3.95Å; F461-F485 HydrophobicContact CE1-CD2 3.95Å; F461-F485 AromaticContact CE1-CE2 3.97Å; F461-F485 HydrophobicContact CE1-CE2 3.97Å; F461-F485 HydrophobicContact CG-CE2 4.12Å
462	Q	80.7	Confident	88.5	Confident	145 Å²	145	65.6 Å²	65.6	68%	0.678	33%	0.332	S	S	*	.			trans	-92.4	-8.1	-176.3	-66.4	-176.7	-17.2	0	0	113.4	L460 F464	L460-Q462 HydrophobicContact CB-CG 4.38Å; Q462-F464 VanDerWaalsContact O-CD1 3.28Å; Q462-F464 WeakPolarHBondContact O-CD1 3.4Å; Q462-F464 PolarHBondContact O-N 2.94Å; Q462-F464 VanDerWaalsContact O-N 3.1Å
463	D	75.8	Confident	88.3	Confident	82 Å²	82	62.7 Å²	62.7	44%	0.439	32%	0.317	S	S	.	.			trans	-83.7	86.9	178.5	-169.5	37.3	0	0	0	110	F461 Q483	F461-D463 HydrophobicContact CD1-CB 4.21Å; F461-D463 WeakPolarHBondContact CD1-O 3.21Å; F461-D463 HydrophobicContact CE1-CB 3.62Å; F461-D463 WeakPolarHBondContact CE1-O 3.5Å; F461-D463 HydrophobicContact CZ-CB 3.97Å; D463-Q483 PolarHBondContact O-OE1 3.34Å; D463-Q483 PolarHBondContact OD1-NE2 3.42Å; D463-Q483 PolarHBondContact OD1-OE1 3.26Å; D463-Q483 VanDerWaalsContact OD1-OE1 3.06Å; D463-Q483 PolarHBondContact OD2-NE2 2.91Å
464	F	84	Confident	87.6	Confident	37 Å²	37	58.8 Å²	58.8	16%	0.162	29%	0.29	C	S	.	.			trans	-143.2	162.2	174.9	65.5	-89.8	0	0	0	110.4	I432 Q462 Q466 Q483 F485 L487	I432-F464 HydrophobicContact CB-CZ 4.48Å; I432-F464 HydrophobicContact CG2-CE2 4.27Å; I432-F464 HydrophobicContact CG2-CZ 3.99Å; Q462-F464 VanDerWaalsContact O-CD1 3.28Å; Q462-F464 WeakPolarHBondContact O-CD1 3.4Å; Q462-F464 PolarHBondContact O-N 2.94Å; Q462-F464 VanDerWaalsContact O-N 3.1Å; F464-Q466 HydrophobicContact CD2-CG 4.43Å; F464-Q466 HydrophobicContact CE2-CG 4.06Å; F464-Q483 VanDerWaalsContact CA-OE1 3.24Å; F464-F485 WeakPolarHBondContact CA-O 3.3Å; F464-F485 HydrophobicContact CB-CB 4.05Å; F464-L487 HydrophobicContact CB-CD1 4.38Å; F464-L487 HydrophobicContact CD1-CD1 4.46Å; F464-L487 HydrophobicContact CD2-CB 4.41Å; F464-L487 HydrophobicContact CD2-CD1 3.41Å; F464-L487 VanDerWaalsContact CD2-CD1 3.41Å; F464-L487 HydrophobicContact CD2-CG 4.33Å; F464-L487 HydrophobicContact CE2-CD1 3.66Å; F464-L487 HydrophobicContact CG-CD1 3.84Å; F464-L487 HydrophobicContact CZ-CD1 4.32Å
465	R	82.4	Confident	87	Confident	161 Å²	161	61 Å²	61	61%	0.608	30%	0.297	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.4	141.2	171	-74.9	-68.7	-168.8	166.6	0.8	110.9	I479 Q483 F485 A486 L487	R465-I479 HydrophobicContact CB-CD1 4.47Å; R465-I479 HydrophobicContact CB-CG2 3.66Å; R465-I479 HydrophobicContact CG-CG2 4.2Å; R465-Q483 HydrophobicContact CG-CG 3.89Å; R465-F485 PolarHBondContact N-O 3.18Å; R465-A486 CarbonylContact O-C 3.6Å; R465-A486 VanDerWaalsContact O-CA 3.3Å; R465-A486 WeakPolarHBondContact O-CA 3.27Å; R465-L487 PolarHBondContact O-N 3.47Å
466	Q	87.3	Confident	86.4	Confident	106 Å²	106	59.6 Å²	59.6	50%	0.495	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	139.5	171.3	-62.7	-177.9	16.3	0	0	110.1	F464 L487 V489	F464-Q466 HydrophobicContact CD2-CG 4.43Å; F464-Q466 HydrophobicContact CE2-CG 4.06Å; Q466-L487 CarbonylContact C-O 3.51Å; Q466-L487 VanDerWaalsContact CA-O 3.29Å; Q466-L487 WeakPolarHBondContact CA-O 3.5Å; Q466-V489 HydrophobicContact CB-CG1 4.43Å; Q466-V489 HydrophobicContact CB-CG2 4.14Å; Q466-V489 HydrophobicContact CG-CG1 4.24Å
467	V	88.6	Confident	86	Confident	1 Å²	1	61 Å²	61	1%	0.006	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	150.9	174.3	-62.8	0	0	0	0	109.5	L476 I479 A486 L487 V488 V489	V467-L476 HydrophobicContact CG1-CD1 4.41Å; V467-L476 HydrophobicContact CG2-CD1 4.29Å; V467-I479 HydrophobicContact CG1-CD1 3.31Å; V467-A486 HydrophobicContact CG1-CB 4.45Å; V467-A486 HydrophobicContact CG2-CB 4.42Å; V467-L487 PolarHBondContact N-O 3.15Å; V467-V488 HydrophobicContact CG2-CB 4.26Å; V467-V488 HydrophobicContact CG2-CG2 3.71Å; V467-V488 CarbonylContact O-C 3.44Å; V467-V488 VanDerWaalsContact O-CA 3.32Å; V467-V488 WeakPolarHBondContact O-CA 3.38Å; V467-V489 PolarHBondContact O-N 3.05Å
468	R	89	Confident	85.3	Confident	110 Å²	110	60.7 Å²	60.7	42%	0.415	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	155.9	176.8	-67.1	174.5	-63.2	-158.9	1.1	111.3	T470 D471 V489 D491	R468-T470 PolarHBondContact O-N 2.86Å; R468-T470 VanDerWaalsContact O-N 3.12Å; R468-D471 PolarHBondContact N-OD2 3.41Å; R468-D471 IonicContact NE-OD1 3.39Å; R468-D471 IonicContact NH2-OD1 3.83Å; R468-D471 WeakPolarHBondContact O-CB 3.4Å; R468-D471 PolarHBondContact O-N 2.89Å; R468-V489 WeakPolarHBondContact CA-O 3.5Å; R468-D491 WeakPolarHBondContact CD-OD2 3.32Å
469	L	90.1	Very high	84.7	Confident	42 Å²	42	56.5 Å²	56.5	22%	0.22	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-26.8	171.8	-74.3	171.2	0	0	0	113.1	T390 V391 H392 V488 D490	T390-L469 WeakPolarHBondContact CB-O 3.41Å; V391-L469 PolarHBondContact N-O 3.12Å; H392-L469 HydrophobicContact CB-CB 4.47Å; H392-L469 HydrophobicContact CB-CD2 4.49Å; H392-L469 PolarHBondContact N-O 3.02Å; L469-V488 HydrophobicContact CD2-CG1 3.67Å; L469-V488 HydrophobicContact CG-CG1 3.91Å; L469-D490 HydrophobicContact CD1-CB 4.15Å
470	T	90.1	Very high	84.4	Confident	103 Å²	103	60.1 Å²	60.1	63%	0.632	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-12.6	178.8	54	0	0	0	0	114.3	R468	R468-T470 PolarHBondContact O-N 2.86Å; R468-T470 VanDerWaalsContact O-N 3.12Å
471	D	86.5	Confident	83.6	Confident	16 Å²	16	63.3 Å²	63.3	9%	0.086	31%	0.305	C	S	.	.	S	Bend	trans	-66.7	152	174.6	-74.7	-36.4	0	0	0	110.2	T390 V391 R468 K475	T390-D471 CarbonylContact C-O 3.59Å; T390-D471 VanDerWaalsContact CA-O 3.27Å; T390-D471 WeakPolarHBondContact CA-O 3.32Å; V391-D471 HydrophobicContact CG2-CB 4.36Å; V391-D471 WeakPolarHBondContact CG2-O 3.07Å; V391-D471 PolarHBondContact N-O 2.76Å; R468-D471 PolarHBondContact N-OD2 3.41Å; R468-D471 IonicContact NE-OD1 3.39Å; R468-D471 IonicContact NH2-OD1 3.83Å; R468-D471 WeakPolarHBondContact O-CB 3.4Å; R468-D471 PolarHBondContact O-N 2.89Å; D471-K475 HydrophobicContact CB-CD 3.96Å; D471-K475 IonicContact OD1-NZ 3.54Å; D471-K475 PolarHBondContact OD1-NZ 3.44Å; D471-K475 IonicContact OD2-NZ 3.48Å; D471-K475 PolarHBondContact OD2-NZ 2.93Å
472	N	87.9	Confident	82.7	Confident	61 Å²	61	63.1 Å²	63.1	33%	0.326	31%	0.309	S	S	.	.	B	Isolated β-bridge	trans	-81.4	155	177.7	69	53.2	0	0	0	112.6	M389 G474 K475 L476	M389-N472 CarbonylContact O-C 3.47Å; M389-N472 WeakPolarHBondContact O-CA 3.48Å; N472-G474 PolarHBondContact O-N 2.91Å; N472-G474 WeakPolarHBondContact OD1-CA 3.37Å; N472-G474 PolarHBondContact OD1-N 3.33Å; N472-K475 WeakPolarHBondContact O-CB 3.4Å; N472-K475 PolarHBondContact O-N 3.4Å; N472-K475 VanDerWaalsContact O-N 3.17Å; N472-K475 PolarHBondContact OD1-N 3.05Å; N472-L476 PolarHBondContact O-N 2.91Å
473	L	89.4	Confident	82.5	Confident	15 Å²	15	57.2 Å²	57.2	8%	0.079	28%	0.282	C	S	.	.	H	α-helix	trans	-65.6	-24.8	179.7	-68	-174.3	0	0	0	112.7	W386 M389 V391 L394 L476 S477	W386-L473 HydrophobicContact CB-CD1 4.21Å; W386-L473 HydrophobicContact CE3-CB 3.61Å; W386-L473 HydrophobicContact CE3-CD1 4.29Å; W386-L473 HydrophobicContact CZ3-CB 3.98Å; M389-L473 HydrophobicContact CB-CD1 3.89Å; M389-L473 HydrophobicContact CB-CG 4.23Å; M389-L473 WeakPolarHBondContact O-CG 3.35Å; M389-L473 PolarHBondContact O-N 3.25Å; V391-L473 HydrophobicContact CG2-CD2 4.29Å; L394-L473 HydrophobicContact CD1-CD2 3.76Å; L394-L473 HydrophobicContact CD2-CD1 4.33Å; L394-L473 HydrophobicContact CD2-CD2 4.12Å; L394-L473 HydrophobicContact CG-CD2 3.8Å; L473-L476 HydrophobicContact CD2-CD2 4Å; L473-L476 PolarHBondContact O-N 3.41Å; L473-S477 VanDerWaalsContact O-CB 3.27Å; L473-S477 WeakPolarHBondContact O-CB 3.47Å; L473-S477 PolarHBondContact O-N 2.99Å
474	G	81.9	Confident	82.7	Confident	1 Å²	1	58.8 Å²	58.8	1%	0.01	29%	0.29	C	S	.	.	H	α-helix	trans	-59.6	-47.6	170.3	0	0	0	0	0	112.4	W387 N472 S477 C478	W387-G474 VanDerWaalsContact CD2-CA 3.46Å; W387-G474 PolarHBondContact O-N 3.07Å; N472-G474 PolarHBondContact O-N 2.91Å; N472-G474 WeakPolarHBondContact OD1-CA 3.37Å; N472-G474 PolarHBondContact OD1-N 3.33Å; G474-S477 WeakPolarHBondContact O-CB 3.33Å; G474-S477 PolarHBondContact O-N 3.33Å; G474-C478 PolarHBondContact O-N 2.92Å; G474-C478 PolarHBondContact O-SG 3.14Å; G474-C478 VanDerWaalsContact O-SG 3.32Å
475	K	80.6	Confident	82.8	Confident	85 Å²	85	58.1 Å²	58.1	37%	0.37	29%	0.287	S	S	.	.	H	α-helix	trans	-60.9	-45.2	174.7	-174.1	-170.8	178.8	-165.7	0	110.8	D471 N472 C478 I479	D471-K475 HydrophobicContact CB-CD 3.96Å; D471-K475 IonicContact OD1-NZ 3.54Å; D471-K475 PolarHBondContact OD1-NZ 3.44Å; D471-K475 IonicContact OD2-NZ 3.48Å; D471-K475 PolarHBondContact OD2-NZ 2.93Å; N472-K475 WeakPolarHBondContact O-CB 3.4Å; N472-K475 PolarHBondContact O-N 3.4Å; N472-K475 VanDerWaalsContact O-N 3.17Å; N472-K475 PolarHBondContact OD1-N 3.05Å; K475-C478 PolarHBondContact O-N 3.49Å; K475-I479 HydrophobicContact CG-CD1 4.2Å; K475-I479 WeakPolarHBondContact O-CG1 3.5Å; K475-I479 PolarHBondContact O-N 2.85Å
476	L	84.9	Confident	83.1	Confident	15 Å²	15	51.7 Å²	51.7	8%	0.079	27%	0.268	C	S	.	.	H	α-helix	trans	-60.8	-45	175.4	176.7	60	0	0	0	111.8	V391 L394 V467 N472 L473 C478 I479 L480 A486	V391-L476 HydrophobicContact CG2-CB 4.2Å; V391-L476 HydrophobicContact CG2-CD2 4.04Å; L394-L476 HydrophobicContact CD1-CD2 3.66Å; V467-L476 HydrophobicContact CG1-CD1 4.41Å; V467-L476 HydrophobicContact CG2-CD1 4.29Å; N472-L476 PolarHBondContact O-N 2.91Å; L473-L476 HydrophobicContact CD2-CD2 4Å; L473-L476 PolarHBondContact O-N 3.41Å; L476-C478 VanDerWaalsContact C-N 3.35Å; L476-C478 PolarHBondContact O-N 2.95Å; L476-I479 WeakPolarHBondContact O-CB 3.27Å; L476-I479 PolarHBondContact O-N 3.04Å; L476-I479 VanDerWaalsContact O-N 3.17Å; L476-L480 HydrophobicContact CD1-CD1 3.89Å; L476-L480 HydrophobicContact CD1-CG 3.95Å; L476-L480 HydrophobicContact CG-CD1 3.9Å; L476-L480 HydrophobicContact CG-CG 4.36Å; L476-L480 WeakPolarHBondContact O-CG 2.78Å; L476-L480 PolarHBondContact O-N 3.4Å; L476-A486 HydrophobicContact CD1-CB 3.36Å
477	S	84.5	Confident	83.2	Confident	30 Å²	30	47.5 Å²	47.5	21%	0.21	25%	0.249	C	C	.	.	H	α-helix	trans	-58.2	-46.2	176	176	0	0	0	0	111.2	L473 G474 I479 L480 K481	L473-S477 VanDerWaalsContact O-CB 3.27Å; L473-S477 WeakPolarHBondContact O-CB 3.47Å; L473-S477 PolarHBondContact O-N 2.99Å; G474-S477 WeakPolarHBondContact O-CB 3.33Å; G474-S477 PolarHBondContact O-N 3.33Å; S477-I479 VanDerWaalsContact C-N 3.32Å; S477-I479 PolarHBondContact O-N 3.03Å; S477-L480 PolarHBondContact O-N 3.27Å; S477-K481 WeakPolarHBondContact O-CG 3.14Å; S477-K481 PolarHBondContact O-N 3.11Å
478	C	76.9	Confident	83.3	Confident	46 Å²	46	49.9 Å²	49.9	31%	0.311	26%	0.264	S	S	.	.	H	α-helix	trans	-61.7	-38.3	175.8	-68.2	0	0	0	0	112.8	G474 K475 L476	G474-C478 PolarHBondContact O-N 2.92Å; G474-C478 PolarHBondContact O-SG 3.14Å; G474-C478 VanDerWaalsContact O-SG 3.32Å; K475-C478 PolarHBondContact O-N 3.49Å; L476-C478 VanDerWaalsContact C-N 3.35Å; L476-C478 PolarHBondContact O-N 2.95Å
479	I	77.6	Confident	83.2	Confident	25 Å²	25	46.4 Å²	46.4	13%	0.128	25%	0.254	C	S	.	.	H	α-helix	trans	-65.4	-48.8	175.4	-71.7	166.7	0	0	0	110.7	R465 V467 K475 L476 S477 K481 T482 Q483 A486	R465-I479 HydrophobicContact CB-CD1 4.47Å; R465-I479 HydrophobicContact CB-CG2 3.66Å; R465-I479 HydrophobicContact CG-CG2 4.2Å; V467-I479 HydrophobicContact CG1-CD1 3.31Å; K475-I479 HydrophobicContact CG-CD1 4.2Å; K475-I479 WeakPolarHBondContact O-CG1 3.5Å; K475-I479 PolarHBondContact O-N 2.85Å; L476-I479 WeakPolarHBondContact O-CB 3.27Å; L476-I479 PolarHBondContact O-N 3.04Å; L476-I479 VanDerWaalsContact O-N 3.17Å; S477-I479 VanDerWaalsContact C-N 3.32Å; S477-I479 PolarHBondContact O-N 3.03Å; I479-K481 PolarHBondContact O-N 3.12Å; I479-K481 VanDerWaalsContact O-N 3.12Å; I479-T482 PolarHBondContact O-N 2.91Å; I479-T482 PolarHBondContact O-OG1 2.94Å; I479-Q483 HydrophobicContact CG2-CB 4.13Å; I479-Q483 HydrophobicContact CG2-CG 4.29Å; I479-Q483 WeakPolarHBondContact O-CB 3.35Å; I479-Q483 PolarHBondContact O-N 3.15Å; I479-A486 HydrophobicContact CG2-CB 3.95Å
480	L	82.7	Confident	82.7	Confident	88 Å²	88	48.7 Å²	48.7	46%	0.461	27%	0.267	S	S	.	.	H	α-helix	trans	-67.4	-12.2	-177.7	-69.6	174.8	0	0	0	114	L476 S477 A486	L476-L480 HydrophobicContact CD1-CD1 3.89Å; L476-L480 HydrophobicContact CD1-CG 3.95Å; L476-L480 HydrophobicContact CG-CD1 3.9Å; L476-L480 HydrophobicContact CG-CG 4.36Å; L476-L480 WeakPolarHBondContact O-CG 2.78Å; L476-L480 PolarHBondContact O-N 3.4Å; S477-L480 PolarHBondContact O-N 3.27Å; L480-A486 HydrophobicContact CD2-CB 3.82Å; L480-A486 HydrophobicContact CG-CB 4.33Å
481	K	73	Confident	81.3	Confident	102 Å²	102	49.5 Å²	49.5	44%	0.443	27%	0.267	S	S	.	.	H	α-helix	trans	-73.5	-33.2	170.4	-71.9	176.3	-177.5	178.8	0	112.7	Q368 E372 S477 I479	Q368-K481 PolarHBondContact NE2-O 3.09Å; E372-K481 HydrophobicContact CG-CB 4.2Å; E372-K481 WeakPolarHBondContact OE1-CB 3.41Å; S477-K481 WeakPolarHBondContact O-CG 3.14Å; S477-K481 PolarHBondContact O-N 3.11Å; I479-K481 PolarHBondContact O-N 3.12Å; I479-K481 VanDerWaalsContact O-N 3.12Å
482	T	63	Low	79.7	Confident	54 Å²	54	56.1 Å²	56.1	33%	0.331	30%	0.298	S	S	.	.	H	α-helix	trans	-96.3	-31.8	177.6	34.2	0	0	0	0	114.3	E372 I479	E372-T482 HydrophobicContact CB-CG2 3.33Å; E372-T482 HydrophobicContact CG-CG2 3.44Å; E372-T482 VanDerWaalsContact CG-CG2 3.44Å; E372-T482 WeakPolarHBondContact OE2-CG2 3.13Å; I479-T482 PolarHBondContact O-N 2.91Å; I479-T482 PolarHBondContact O-OG1 2.94Å
483	Q	75.3	Confident	77.3	Confident	22 Å²	22	59 Å²	59	10%	0.103	32%	0.318	C	S	.	.			trans	-118.1	133.1	-163.8	-64.6	-76.2	-55.6	0	0	108.6	D463 F464 R465 I479 F485	D463-Q483 PolarHBondContact O-OE1 3.34Å; D463-Q483 PolarHBondContact OD1-NE2 3.42Å; D463-Q483 PolarHBondContact OD1-OE1 3.26Å; D463-Q483 VanDerWaalsContact OD1-OE1 3.06Å; D463-Q483 PolarHBondContact OD2-NE2 2.91Å; F464-Q483 VanDerWaalsContact CA-OE1 3.24Å; R465-Q483 HydrophobicContact CG-CG 3.89Å; I479-Q483 HydrophobicContact CG2-CB 4.13Å; I479-Q483 HydrophobicContact CG2-CG 4.29Å; I479-Q483 WeakPolarHBondContact O-CB 3.35Å; I479-Q483 PolarHBondContact O-N 3.15Å; Q483-F485 PolarHBondContact O-N 3.24Å
484	N	80.3	Confident	74.4	Confident	114 Å²	114	71.4 Å²	71.4	61%	0.61	38%	0.375	S	S	*	.	S	Bend	trans	-66.5	-26.8	175.8	-65	-36.2	0	0	0	111.5	F461	F461-N484 HydrophobicContact CE1-CB 4.24Å; F461-N484 WeakPolarHBondContact CZ-ND2 3.47Å
485	F	86.8	Confident	74	Confident	24 Å²	24	74.9 Å²	74.9	11%	0.105	39%	0.393	C	S	.	.			trans	-133.5	130.2	-176.5	-52.8	-67.7	0	0	0	112.2	Q422 M435 T437 F461 F464 R465 Q483	Q422-F485 VanDerWaalsContact OE1-CE1 3.29Å; M435-F485 HydrophobicContact CB-CD2 3.93Å; M435-F485 HydrophobicContact CB-CE2 4.14Å; M435-F485 HydrophobicContact CB-CG 4.3Å; M435-F485 HydrophobicContact CE-CD1 3.95Å; M435-F485 HydrophobicContact CE-CE1 4.33Å; M435-F485 HydrophobicContact CE-CG 4.27Å; M435-F485 HydrophobicContact CG-CB 4Å; M435-F485 HydrophobicContact CG-CD1 4.44Å; M435-F485 HydrophobicContact CG-CD2 3.9Å; M435-F485 HydrophobicContact CG-CG 3.83Å; T437-F485 HydrophobicContact CG2-CE1 4.43Å; T437-F485 HydrophobicContact CG2-CE2 4.39Å; T437-F485 HydrophobicContact CG2-CZ 3.64Å; F461-F485 AromaticContact CD1-CD2 3.61Å; F461-F485 HydrophobicContact CD1-CD2 3.61Å; F461-F485 AromaticContact CD1-CE2 3.58Å; F461-F485 HydrophobicContact CD1-CE2 3.58Å; F461-F485 AromaticContact CE1-CD2 3.95Å; F461-F485 HydrophobicContact CE1-CD2 3.95Å; F461-F485 AromaticContact CE1-CE2 3.97Å; F461-F485 HydrophobicContact CE1-CE2 3.97Å; F461-F485 HydrophobicContact CG-CE2 4.12Å; F464-F485 WeakPolarHBondContact CA-O 3.3Å; F464-F485 HydrophobicContact CB-CB 4.05Å; R465-F485 PolarHBondContact N-O 3.18Å; Q483-F485 PolarHBondContact O-N 3.24Å
486	A	89.3	Confident	73.7	Confident	25 Å²	25	74.4 Å²	74.4	21%	0.207	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	114	163.2	0	0	0	0	0	108.5	R465 V467 L476 I479 L480	R465-A486 CarbonylContact O-C 3.6Å; R465-A486 VanDerWaalsContact O-CA 3.3Å; R465-A486 WeakPolarHBondContact O-CA 3.27Å; V467-A486 HydrophobicContact CG1-CB 4.45Å; V467-A486 HydrophobicContact CG2-CB 4.42Å; L476-A486 HydrophobicContact CD1-CB 3.36Å; I479-A486 HydrophobicContact CG2-CB 3.95Å; L480-A486 HydrophobicContact CD2-CB 3.82Å; L480-A486 HydrophobicContact CG-CB 4.33Å
487	L	89.8	Confident	73	Confident	18 Å²	18	77.7 Å²	77.7	9%	0.094	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	116.5	179.3	-83.9	162.8	0	0	0	109.7	P424 I432 M435 F464 R465 Q466 V467 V489	P424-L487 HydrophobicContact CB-CD2 4.05Å; P424-L487 HydrophobicContact CG-CD2 3.66Å; I432-L487 HydrophobicContact CD1-CD1 4.47Å; I432-L487 HydrophobicContact CG2-CD1 3.73Å; M435-L487 HydrophobicContact CG-CD1 4.2Å; M435-L487 HydrophobicContact SD-CD1 3.91Å; M435-L487 HydrophobicContact SD-CD2 3.78Å; M435-L487 HydrophobicContact SD-CG 4.05Å; F464-L487 HydrophobicContact CB-CD1 4.38Å; F464-L487 HydrophobicContact CD1-CD1 4.46Å; F464-L487 HydrophobicContact CD2-CB 4.41Å; F464-L487 HydrophobicContact CD2-CD1 3.41Å; F464-L487 VanDerWaalsContact CD2-CD1 3.41Å; F464-L487 HydrophobicContact CD2-CG 4.33Å; F464-L487 HydrophobicContact CE2-CD1 3.66Å; F464-L487 HydrophobicContact CG-CD1 3.84Å; F464-L487 HydrophobicContact CZ-CD1 4.32Å; R465-L487 PolarHBondContact O-N 3.47Å; Q466-L487 CarbonylContact C-O 3.51Å; Q466-L487 VanDerWaalsContact CA-O 3.29Å; Q466-L487 WeakPolarHBondContact CA-O 3.5Å; V467-L487 PolarHBondContact N-O 3.15Å; L487-V489 PolarHBondContact O-N 2.89Å
488	V	89.9	Confident	72.4	Confident	52 Å²	52	80.5 Å²	80.5	32%	0.315	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	116.3	176.9	-169.8	0	0	0	0	108.8	V391 L396 V467 L469	V391-V488 HydrophobicContact CG1-CB 4.45Å; V391-V488 HydrophobicContact CG1-CG1 3.79Å; V391-V488 HydrophobicContact CG1-CG2 3.75Å; L396-V488 HydrophobicContact CD1-CB 4.14Å; L396-V488 HydrophobicContact CD1-CG1 4.45Å; L396-V488 HydrophobicContact CD1-CG2 3.41Å; L396-V488 VanDerWaalsContact CD1-CG2 3.41Å; V467-V488 HydrophobicContact CG2-CB 4.26Å; V467-V488 HydrophobicContact CG2-CG2 3.71Å; V467-V488 CarbonylContact O-C 3.44Å; V467-V488 VanDerWaalsContact O-CA 3.32Å; V467-V488 WeakPolarHBondContact O-CA 3.38Å; L469-V488 HydrophobicContact CD2-CG1 3.67Å; L469-V488 HydrophobicContact CG-CG1 3.91Å
489	V	87	Confident	72.1	Confident	36 Å²	36	82.6 Å²	82.6	22%	0.218	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	145.4	176.6	-62.4	0	0	0	0	109.1	I432 Q466 V467 R468 L487	I432-V489 HydrophobicContact CD1-CG1 3.8Å; Q466-V489 HydrophobicContact CB-CG1 4.43Å; Q466-V489 HydrophobicContact CB-CG2 4.14Å; Q466-V489 HydrophobicContact CG-CG1 4.24Å; V467-V489 PolarHBondContact O-N 3.05Å; R468-V489 WeakPolarHBondContact CA-O 3.5Å; L487-V489 PolarHBondContact O-N 2.89Å
490	D	78.4	Confident	71.7	Confident	91 Å²	91	86.5 Å²	86.5	49%	0.487	45%	0.451	S	S	.	.			trans	-107.6	145.7	174.6	-162.8	6.8	0	0	0	109.5	L469 Q492	L469-D490 HydrophobicContact CD1-CB 4.15Å; D490-Q492 PolarHBondContact O-N 3.32Å; D490-Q492 VanDerWaalsContact O-N 3.15Å
491	D	62	Low	70.9	Confident	119 Å²	119	86.4 Å²	86.4	64%	0.636	45%	0.451	S	S	*	.			trans	-78.8	14.1	178.5	-74.1	-32	0	0	0	111.8	R468 T493	R468-D491 WeakPolarHBondContact CD-OD2 3.32Å; D491-T493 VanDerWaalsContact C-N 3.33Å; D491-T493 PolarHBondContact O-N 2.88Å
492	Q	51.8	Low	70.8	Confident	156 Å²	156	85.2 Å²	85.2	73%	0.729	45%	0.451	S	S	*	.			trans	-76	87.2	172.5	-69.9	-161.1	-0.2	0	0	110.8	D490	D490-Q492 PolarHBondContact O-N 3.32Å; D490-Q492 VanDerWaalsContact O-N 3.15Å
493	T	37.9	Very low	71.4	Confident	122 Å²	122	87.8 Å²	87.8	75%	0.748	46%	0.461	S	S	*	.			trans	32.8	124.4	136.2	33	0	0	0	0	118.7	D491	D491-T493 VanDerWaalsContact C-N 3.33Å; D491-T493 PolarHBondContact O-N 2.88Å
494	Q	28.7	Very low	71.1	Confident	274 Å²	274	93.7 Å²	93.7	100%	1.28	49%	0.494	S	S	*	.			trans	33.6	0	145.8	-87.5	-176	-17.4	0	0	119

Retrieved 494 of 494 residues in 1204.8 ms (Link to these results)

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