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Actin alpha 2, smooth muscle

Actin is a highly conserved protein that polymerizes to produce filaments that form cross-linked networks in the cytoplasm of cells. Actin exists in both monomeric (G-actin) and polymeric (F-actin) forms, both forms playing key functions, such as cell motility and contraction. In addition to their role in the cytoplasmic cytoskeleton, G- and F-actin also localize in the nucleus, and regulate gene transcription and motility and repair of damaged DNA.

AlphaFold DB , UniProt , Accession Q6DHS1, Species DANRE (Danio rerio, Zebrafish), Gene acta2, Length 377 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	M	34.2	Very low	68.4	Low	231 Å²	231	100.3 Å²	100.3	100%	1.138	54%	0.538	S	S	*	.				0	88.2	0	-69.5	170.3	178.3	0	0	104	D3	M1-D3 VanDerWaalsContact C-N 3.25Å; M1-D3 PolarHBondContact O-N 3.24Å
2	C	35.7	Very low	70.9	Confident	119 Å²	119	91.9 Å²	91.9	80%	0.804	49%	0.493	S	S	*	.			trans	-73.5	101.7	161.2	-58.3	0	0	0	0	101.8	D4	C2-D4 VanDerWaalsContact C-N 3.26Å; C2-D4 PolarHBondContact O-N 3.18Å
3	D	43.9	Very low	73.1	Confident	141 Å²	141	85.1 Å²	85.1	75%	0.754	46%	0.456	S	S	*	.			trans	-56	110.6	157.2	-68.6	-31.6	0	0	0	102.9	M1 E5	M1-D3 VanDerWaalsContact C-N 3.25Å; M1-D3 PolarHBondContact O-N 3.24Å; D3-E5 PolarHBondContact O-N 2.92Å
4	D	47.4	Very low	74.6	Confident	148 Å²	148	79.7 Å²	79.7	79%	0.791	43%	0.428	S	S	*	.			trans	-53.7	100.2	166.5	-70.5	-43.4	0	0	0	103.6	C2 E6	C2-D4 VanDerWaalsContact C-N 3.26Å; C2-D4 PolarHBondContact O-N 3.18Å; D4-E6 PolarHBondContact O-N 3.24Å
5	E	52	Low	76	Confident	187 Å²	187	75.3 Å²	75.3	87%	0.874	41%	0.408	S	S	*	.			trans	-57.8	99.1	175.5	-79.2	-175.1	160.8	0	0	104.6	D3 S7	D3-E5 PolarHBondContact O-N 2.92Å; E5-S7 PolarHBondContact O-N 3.33Å
6	E	66.7	Low	77.3	Confident	143 Å²	143	71.1 Å²	71.1	67%	0.668	39%	0.386	S	S	*	.			trans	-52.2	112.1	179.3	-88.1	-174.3	165.4	0	0	106.5	D4 T8	D4-E6 PolarHBondContact O-N 3.24Å; E6-T8 PolarHBondContact O-N 2.91Å
7	S	83.6	Confident	78.3	Confident	54 Å²	54	68 Å²	68	38%	0.378	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-63	129.2	-173.6	58	0	0	0	0	109.1	E5 A9 E102 P104	E5-S7 PolarHBondContact O-N 3.33Å; S7-A9 PolarHBondContact O-N 3.44Å; S7-E102 WeakPolarHBondContact CB-O 3.08Å; S7-E102 PolarHBondContact OG-O 3.13Å; S7-P104 WeakPolarHBondContact OG-CD 3.21Å
8	T	94.5	Very high	79.4	Confident	71 Å²	71	68.7 Å²	68.7	44%	0.436	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-61.4	125.6	-173.4	-51	0	0	0	0	110	E6 F23 A24 H103	E6-T8 PolarHBondContact O-N 2.91Å; T8-F23 HydrophobicContact CG2-CB 3.95Å; T8-F23 HydrophobicContact CG2-CD1 4.08Å; T8-A24 WeakPolarHBondContact CG2-O 3.1Å; T8-H103 PolarHBondContact O-ND1 3.31Å
9	A	97.8	Very high	80.4	Confident	9 Å²	9	65.1 Å²	65.1	7%	0.074	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-64.7	148.2	-179.2	0	0	0	0	0	112.1	S7 A24 P104 A349 W358	S7-A9 PolarHBondContact O-N 3.44Å; A9-A24 HydrophobicContact CB-CB 4.08Å; A9-A24 WeakPolarHBondContact O-CB 3.45Å; A9-A24 PolarHBondContact O-N 3.29Å; A9-P104 CarbonylContact C-O 3.56Å; A9-P104 WeakPolarHBondContact CA-O 3.43Å; A9-P104 HydrophobicContact CB-CB 4.05Å; A9-A349 HydrophobicContact CB-CB 4.18Å; A9-W358 HydrophobicContact CB-CH2 3.92Å; A9-W358 HydrophobicContact CB-CZ2 3.66Å
10	L	98.4	Very high	81.3	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	146.9	170.8	-58.3	-179.3	0	0	0	110.4	G22 F23 F92 L96 V98 H103 P104 L106	L10-G22 WeakPolarHBondContact CA-O 3.35Å; L10-F23 HydrophobicContact CD2-CD1 3.65Å; L10-F23 HydrophobicContact CD2-CD2 4.42Å; L10-F23 HydrophobicContact CD2-CE1 3.64Å; L10-F23 HydrophobicContact CD2-CE2 4.41Å; L10-F23 HydrophobicContact CD2-CG 4.09Å; L10-F23 HydrophobicContact CD2-CZ 4.06Å; L10-F92 HydrophobicContact CD1-CD1 3.71Å; L10-F92 HydrophobicContact CD1-CE1 3.82Å; L10-L96 HydrophobicContact CD1-CD1 4.22Å; L10-L96 HydrophobicContact CD2-CD1 3.97Å; L10-V98 HydrophobicContact CD1-CG2 3.84Å; L10-V98 HydrophobicContact CD2-CG2 4.48Å; L10-H103 HydrophobicContact CD1-CB 3.92Å; L10-H103 HydrophobicContact CD2-CB 4.49Å; L10-H103 HydrophobicContact CG-CB 3.72Å; L10-P104 PolarHBondContact N-O 2.97Å; L10-L106 PolarHBondContact O-N 3.13Å
11	V	98.7	Very high	82.1	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	119.3	174.2	-179.9	0	0	0	0	108.7	A21 G22 A24 L106 W342 A349	V11-A21 VanDerWaalsContact O-CA 3.32Å; V11-A21 WeakPolarHBondContact O-CA 3.38Å; V11-G22 PolarHBondContact N-O 2.88Å; V11-G22 PolarHBondContact O-N 3.41Å; V11-A24 HydrophobicContact CG2-CB 4.34Å; V11-L106 WeakPolarHBondContact CA-O 3.49Å; V11-L106 HydrophobicContact CG1-CD2 4.16Å; V11-L106 HydrophobicContact CG2-CB 4.44Å; V11-W342 HydrophobicContact CB-CZ2 4.42Å; V11-W342 HydrophobicContact CG1-CG 4.25Å; V11-W342 PolarHBondContact O-NE1 3.45Å; V11-A349 HydrophobicContact CG2-CB 4.3Å
12	C	98.5	Very high	85.2	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	101.4	179.3	-67.6	0	0	0	0	110.6	N14 K20 L106 L107 T108	C12-N14 PolarHBondContact O-N 3.11Å; C12-K20 WeakPolarHBondContact CA-O 3.41Å; C12-L106 PolarHBondContact N-O 2.96Å; C12-L107 HydrophobicContact CB-CD2 3.87Å; C12-L107 HydrophobicContact CB-CG 4.49Å; C12-T108 PolarHBondContact O-N 2.93Å; C12-T108 VanDerWaalsContact O-N 3.11Å
13	D	98.4	Very high	88.1	Confident	3 Å²	3	44.1 Å²	44.1	2%	0.016	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	105.6	172.2	172	25.3	0	0	0	110.8	G15 C19 K20 T108 Q139 V341 W342	D13-G15 PolarHBondContact O-N 2.92Å; D13-C19 WeakPolarHBondContact O-CA 3.49Å; D13-K20 HydrophobicContact CB-CB 4.16Å; D13-K20 PolarHBondContact N-O 3.36Å; D13-K20 PolarHBondContact O-N 2.98Å; D13-K20 IonicContact OD2-NZ 3.14Å; D13-K20 PolarHBondContact OD2-NZ 2.91Å; D13-T108 VanDerWaalsContact CA-OG1 3.29Å; D13-T108 WeakPolarHBondContact CA-OG1 3.21Å; D13-T108 HydrophobicContact CB-CG2 4.13Å; D13-T108 PolarHBondContact OD1-OG1 3.23Å; D13-T108 VanDerWaalsContact OD1-OG1 3.11Å; D13-Q139 PolarHBondContact OD1-NE2 3.38Å; D13-V341 HydrophobicContact CB-CG1 4.06Å; D13-V341 VanDerWaalsContact CG-CG1 3.45Å; D13-V341 WeakPolarHBondContact OD1-CG1 3.39Å; D13-W342 HydrophobicContact CB-CB 4.17Å
14	N	95.3	Very high	90.7	Very high	10 Å²	10	38 Å²	38	5%	0.053	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	80.7	-175.4	-56.8	-52.8	0	0	0	111.2	C12 I73 M84 W88 L107 T108 Q139	C12-N14 PolarHBondContact O-N 3.11Å; N14-I73 HydrophobicContact CB-CD1 4.16Å; N14-M84 HydrophobicContact CB-CE 4.21Å; N14-M84 VanDerWaalsContact OD1-CE 3.28Å; N14-M84 WeakPolarHBondContact OD1-CE 3.47Å; N14-W88 PolarHBondContact OD1-NE1 3.21Å; N14-L107 WeakPolarHBondContact ND2-CD2 3.48Å; N14-T108 PolarHBondContact N-OG1 3.31Å; N14-T108 PolarHBondContact ND2-O 2.92Å; N14-Q139 PolarHBondContact O-NE2 2.95Å
15	G	95.7	Very high	93	Very high	13 Å²	13	33.3 Å²	33.3	13%	0.134	19%	0.194	C	C	.	.			trans	-87.6	149.3	176.6	0	0	0	0	0	113.8	D13 G17 L18 S35	D13-G15 PolarHBondContact O-N 2.92Å; G15-G17 PolarHBondContact O-N 3.32Å; G15-L18 WeakPolarHBondContact CA-O 3.42Å; G15-L18 PolarHBondContact N-O 3.16Å; G15-S35 VanDerWaalsContact O-CB 3.28Å; G15-S35 WeakPolarHBondContact O-CB 3.38Å; G15-S35 PolarHBondContact O-OG 3.29Å
16	S	95.7	Very high	95.1	Very high	9 Å²	9	26.8 Å²	26.8	6%	0.063	17%	0.166	C	C	.	.	S	Bend	trans	-63.9	-26.2	178	-53.3	0	0	0	0	115	I73 G76 R185	S16-I73 VanDerWaalsContact OG-CG2 3.31Å; S16-I73 WeakPolarHBondContact OG-CG2 3.46Å; S16-G76 WeakPolarHBondContact OG-CA 3.29Å; S16-G76 PolarHBondContact OG-N 2.81Å; S16-R185 PolarHBondContact O-NH2 3.18Å
17	G	95.6	Very high	96.4	Very high	18 Å²	18	27.4 Å²	27.4	19%	0.186	17%	0.173	C	C	.	.	S	Bend	trans	-103.1	-40.4	177.2	0	0	0	0	0	113	G15 P34 S35	G15-G17 PolarHBondContact O-N 3.32Å; G17-P34 WeakPolarHBondContact O-CA 3.32Å; G17-S35 PolarHBondContact O-N 3.22Å
18	L	97	Very high	97	Very high	80 Å²	80	27.3 Å²	27.3	42%	0.419	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	134.3	-175.5	-62.5	172.4	0	0	0	110.4	G15 V32 F33 P34	G15-L18 WeakPolarHBondContact CA-O 3.42Å; G15-L18 PolarHBondContact N-O 3.16Å; L18-V32 HydrophobicContact CB-CG1 4.37Å; L18-V32 HydrophobicContact CD1-CG1 4.07Å; L18-F33 CarbonylContact C-O 3.39Å; L18-F33 WeakPolarHBondContact CA-O 3.38Å; L18-P34 HydrophobicContact CD2-CG 4.45Å
19	C	97.9	Very high	97.1	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	141.8	164.4	-172.1	0	0	0	0	108.4	D13 V32 F33 S35 I87	D13-C19 WeakPolarHBondContact O-CA 3.49Å; C19-V32 WeakPolarHBondContact O-CA 3.18Å; C19-F33 HydrophobicContact CB-CD1 4.49Å; C19-F33 HydrophobicContact CB-CD2 4.33Å; C19-F33 HydrophobicContact CB-CE1 3.95Å; C19-F33 HydrophobicContact CB-CE2 3.76Å; C19-F33 HydrophobicContact CB-CZ 3.55Å; C19-F33 PolarHBondContact N-O 2.92Å; C19-F33 PolarHBondContact O-N 3.37Å; C19-F33 VanDerWaalsContact O-N 3.08Å; C19-S35 PolarHBondContact N-OG 3.06Å; C19-I87 HydrophobicContact CB-CG2 4.25Å
20	K	98.5	Very high	97.1	Very high	21 Å²	21	31.5 Å²	31.5	9%	0.091	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	128.8	173.8	-42.6	176.8	-168	67.7	0	109.1	C12 D13 P29 A31 V32 K338 Y339 W342	C12-K20 WeakPolarHBondContact CA-O 3.41Å; D13-K20 HydrophobicContact CB-CB 4.16Å; D13-K20 PolarHBondContact N-O 3.36Å; D13-K20 PolarHBondContact O-N 2.98Å; D13-K20 IonicContact OD2-NZ 3.14Å; D13-K20 PolarHBondContact OD2-NZ 2.91Å; K20-P29 HydrophobicContact CB-CB 3.95Å; K20-P29 HydrophobicContact CB-CG 4.28Å; K20-A31 CarbonylContact C-O 3.56Å; K20-A31 VanDerWaalsContact CA-O 3.28Å; K20-A31 WeakPolarHBondContact CA-O 3.33Å; K20-V32 HydrophobicContact CB-CG2 4.34Å; K20-V32 HydrophobicContact CG-CG1 4.28Å; K20-V32 HydrophobicContact CG-CG2 4.15Å; K20-K338 VanDerWaalsContact CE-O 3.23Å; K20-K338 WeakPolarHBondContact CE-O 3.49Å; K20-Y339 HydrophobicContact CD-CD1 3.77Å; K20-Y339 HydrophobicContact CD-CE1 4.34Å; K20-W342 HydrophobicContact CB-CB 4.41Å; K20-W342 HydrophobicContact CB-CG 4.31Å; K20-W342 HydrophobicContact CD-CB 4.4Å
21	A	98.7	Very high	97.1	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	147	-176.6	0	0	0	0	0	110.7	V11 R30 A31 L96	V11-A21 VanDerWaalsContact O-CA 3.32Å; V11-A21 WeakPolarHBondContact O-CA 3.38Å; A21-R30 PolarHBondContact O-N 3.11Å; A21-A31 PolarHBondContact N-O 3.08Å; A21-A31 PolarHBondContact O-N 3.13Å; A21-L96 HydrophobicContact CB-CD1 3.96Å; A21-L96 HydrophobicContact CB-CD2 4.38Å; A21-L96 HydrophobicContact CB-CG 4.2Å
22	G	98.5	Very high	97.1	Very high	0 Å²	0	34 Å²	34	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	178.1	-173.9	178.5	0	0	0	0	0	111.8	L10 V11	L10-G22 WeakPolarHBondContact CA-O 3.35Å; V11-G22 PolarHBondContact N-O 2.88Å; V11-G22 PolarHBondContact O-N 3.41Å
23	F	98.1	Very high	97.1	Very high	20 Å²	20	34 Å²	34	9%	0.088	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	143.5	-178.4	-64.6	-101.4	0	0	0	110.4	T8 L10 D26 R30 L96 V98 H103 W342	T8-F23 HydrophobicContact CG2-CB 3.95Å; T8-F23 HydrophobicContact CG2-CD1 4.08Å; L10-F23 HydrophobicContact CD2-CD1 3.65Å; L10-F23 HydrophobicContact CD2-CD2 4.42Å; L10-F23 HydrophobicContact CD2-CE1 3.64Å; L10-F23 HydrophobicContact CD2-CE2 4.41Å; L10-F23 HydrophobicContact CD2-CG 4.09Å; L10-F23 HydrophobicContact CD2-CZ 4.06Å; F23-D26 WeakPolarHBondContact O-CB 3.34Å; F23-D26 PolarHBondContact O-N 2.85Å; F23-R30 HydrophobicContact CD2-CG 4.32Å; F23-R30 VanDerWaalsContact CE2-CZ 3.44Å; F23-L96 HydrophobicContact CE2-CD2 4.21Å; F23-V98 HydrophobicContact CE1-CG1 4.18Å; F23-V98 HydrophobicContact CZ-CG1 3.62Å; F23-H103 AromaticContact CE1-CE1 3.94Å; F23-W342 WeakPolarHBondContact O-CH2 3.16Å
24	A	97.3	Very high	97.1	Very high	12 Å²	12	34.9 Å²	34.9	10%	0.099	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	138.4	170.9	0	0	0	0	0	110.5	T8 A9 V11 A349	T8-A24 WeakPolarHBondContact CG2-O 3.1Å; A9-A24 HydrophobicContact CB-CB 4.08Å; A9-A24 WeakPolarHBondContact O-CB 3.45Å; A9-A24 PolarHBondContact O-N 3.29Å; V11-A24 HydrophobicContact CG2-CB 4.34Å; A24-A349 HydrophobicContact CB-CB 3.63Å
25	G	95.2	Very high	97.2	Very high	49 Å²	49	34.4 Å²	34.4	51%	0.505	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	90.2	-15.3	-174	0	0	0	0	0	114.8	S346	G25-S346 PolarHBondContact N-OG 3.24Å
26	D	96.6	Very high	97.3	Very high	51 Å²	51	33.9 Å²	33.9	27%	0.273	20%	0.197	S	C	.	.			trans	-73.9	146.5	170.8	-71.5	-12.5	0	0	0	110.1	F23 A28 R30 W342 S346	F23-D26 WeakPolarHBondContact O-CB 3.34Å; F23-D26 PolarHBondContact O-N 2.85Å; D26-A28 VanDerWaalsContact C-N 3.31Å; D26-A28 PolarHBondContact O-N 3.48Å; D26-R30 IonicContact OD1-NH2 3.21Å; D26-R30 IonicContact OD2-CZ 2.76Å; D26-R30 IonicContact OD2-NE 2.81Å; D26-R30 PolarHBondContact OD2-NE 3.37Å; D26-R30 IonicContact OD2-NH2 3.15Å; D26-R30 PolarHBondContact OD2-NH2 3.44Å; D26-R30 VanDerWaalsContact OD2-NH2 3.08Å; D26-W342 HydrophobicContact CB-CH2 3.89Å; D26-W342 WeakPolarHBondContact O-CH2 3.37Å; D26-W342 WeakPolarHBondContact O-CZ3 3.29Å; D26-S346 PolarHBondContact N-OG 3.38Å; D26-S346 PolarHBondContact O-OG 3.13Å
27	D	94	Very high	97.4	Very high	155 Å²	155	33.5 Å²	33.5	83%	0.829	19%	0.194	S	C	*	.	S	Bend	trans	-75.5	-16.3	-179.2	-68.1	-40.8	0	0	0	113.8
28	A	96.1	Very high	97.4	Very high	52 Å²	52	32.6 Å²	32.6	43%	0.43	19%	0.186	S	C	.	.	S	Bend	trans	-151.3	153.6	-178.1	0	0	0	0	0	110.9	D26 R30 W342	D26-A28 VanDerWaalsContact C-N 3.31Å; D26-A28 PolarHBondContact O-N 3.48Å; A28-R30 PolarHBondContact O-N 2.95Å; A28-W342 WeakPolarHBondContact O-CH2 3.48Å; A28-W342 WeakPolarHBondContact O-CZ3 3.42Å
29	P	97.9	Very high	97.3	Very high	18 Å²	18	32.7 Å²	32.7	12%	0.117	18%	0.18	C	C	.	.			trans	-61.2	138.5	175.8	25.7	-33.9	0	0	0	110.6	K20 A31 V32 Y339 W342	K20-P29 HydrophobicContact CB-CB 3.95Å; K20-P29 HydrophobicContact CB-CG 4.28Å; P29-A31 VanDerWaalsContact C-N 3.28Å; P29-V32 HydrophobicContact CB-CG2 4.09Å; P29-V32 HydrophobicContact CG-CG2 3.59Å; P29-Y339 HydrophobicContact CG-CD1 4.16Å; P29-Y339 HydrophobicContact CG-CE1 4.45Å; P29-Y339 HydrophobicContact CG-CG 4.4Å; P29-W342 HydrophobicContact CB-CD2 3.69Å; P29-W342 HydrophobicContact CB-CE3 4.16Å; P29-W342 HydrophobicContact CB-CG 3.93Å; P29-W342 HydrophobicContact CB-CZ2 4.47Å; P29-W342 HydrophobicContact CG-CD2 4.27Å; P29-W342 HydrophobicContact CG-CE3 4.39Å; P29-W342 HydrophobicContact CG-CG 4.44Å
30	R	97.8	Very high	97.1	Very high	151 Å²	151	34.7 Å²	34.7	57%	0.57	19%	0.193	S	C	*	.	S	Bend	trans	-71.4	-26.9	174.7	-66.3	-160.1	-177	174.7	5.3	112.6	A21 F23 D26 A28 L96	A21-R30 PolarHBondContact O-N 3.11Å; F23-R30 HydrophobicContact CD2-CG 4.32Å; F23-R30 VanDerWaalsContact CE2-CZ 3.44Å; D26-R30 IonicContact OD1-NH2 3.21Å; D26-R30 IonicContact OD2-CZ 2.76Å; D26-R30 IonicContact OD2-NE 2.81Å; D26-R30 PolarHBondContact OD2-NE 3.37Å; D26-R30 IonicContact OD2-NH2 3.15Å; D26-R30 PolarHBondContact OD2-NH2 3.44Å; D26-R30 VanDerWaalsContact OD2-NH2 3.08Å; A28-R30 PolarHBondContact O-N 2.95Å; R30-L96 HydrophobicContact CB-CD2 3.79Å
31	A	98.3	Very high	96.6	Very high	4 Å²	4	39.4 Å²	39.4	3%	0.033	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	137.3	-179.4	0	0	0	0	0	111.2	K20 A21 P29 F33 E95	K20-A31 CarbonylContact C-O 3.56Å; K20-A31 VanDerWaalsContact CA-O 3.28Å; K20-A31 WeakPolarHBondContact CA-O 3.33Å; A21-A31 PolarHBondContact N-O 3.08Å; A21-A31 PolarHBondContact O-N 3.13Å; P29-A31 VanDerWaalsContact C-N 3.28Å; A31-F33 HydrophobicContact CB-CD1 4.39Å; A31-E95 HydrophobicContact CB-CB 3.59Å; A31-E95 HydrophobicContact CB-CG 4.08Å
32	V	98.2	Very high	95.8	Very high	49 Å²	49	45.7 Å²	45.7	30%	0.297	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	112.9	172.9	-179.5	0	0	0	0	107.3	L18 C19 K20 P29 Y339	L18-V32 HydrophobicContact CB-CG1 4.37Å; L18-V32 HydrophobicContact CD1-CG1 4.07Å; C19-V32 WeakPolarHBondContact O-CA 3.18Å; K20-V32 HydrophobicContact CB-CG2 4.34Å; K20-V32 HydrophobicContact CG-CG1 4.28Å; K20-V32 HydrophobicContact CG-CG2 4.15Å; P29-V32 HydrophobicContact CB-CG2 4.09Å; P29-V32 HydrophobicContact CG-CG2 3.59Å; V32-Y339 HydrophobicContact CG2-CE1 4.03Å
33	F	98.2	Very high	94.6	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	156.6	-174.7	63.4	-90.6	0	0	0	111.7	L18 C19 A31 S35 V56 I87 H90 S91 E95	L18-F33 CarbonylContact C-O 3.39Å; L18-F33 WeakPolarHBondContact CA-O 3.38Å; C19-F33 HydrophobicContact CB-CD1 4.49Å; C19-F33 HydrophobicContact CB-CD2 4.33Å; C19-F33 HydrophobicContact CB-CE1 3.95Å; C19-F33 HydrophobicContact CB-CE2 3.76Å; C19-F33 HydrophobicContact CB-CZ 3.55Å; C19-F33 PolarHBondContact N-O 2.92Å; C19-F33 PolarHBondContact O-N 3.37Å; C19-F33 VanDerWaalsContact O-N 3.08Å; A31-F33 HydrophobicContact CB-CD1 4.39Å; F33-S35 PolarHBondContact O-N 2.89Å; F33-V56 HydrophobicContact CE2-CG1 4.26Å; F33-I87 HydrophobicContact CE2-CG2 4.03Å; F33-I87 HydrophobicContact CZ-CG2 4.12Å; F33-H90 AromaticContact CD2-CD2 3.91Å; F33-H90 AromaticContact CE2-CD2 3.66Å; F33-H90 AromaticContact CZ-CD2 3.84Å; F33-S91 VanDerWaalsContact CZ-OG 3.29Å; F33-S91 WeakPolarHBondContact CZ-OG 3.27Å; F33-E95 HydrophobicContact CD1-CG 3.84Å; F33-E95 HydrophobicContact CE1-CG 3.89Å
34	P	97.8	Very high	93.2	Very high	21 Å²	21	56.5 Å²	56.5	14%	0.136	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.3	132.6	178.4	-27.6	36.4	0	0	0	113.9	G17 L18 I36 G57 D58	G17-P34 WeakPolarHBondContact O-CA 3.32Å; L18-P34 HydrophobicContact CD2-CG 4.45Å; P34-I36 HydrophobicContact CB-CD1 3.85Å; P34-I36 HydrophobicContact CB-CG1 3.88Å; P34-I36 HydrophobicContact CB-CG2 4.34Å; P34-I36 PolarHBondContact O-N 3.32Å; P34-G57 WeakPolarHBondContact O-CA 3.31Å; P34-D58 WeakPolarHBondContact CD-OD1 3.49Å
35	S	97.7	Very high	91.7	Very high	0 Å²	0	59 Å²	59	0%	0	32%	0.316	C	S	.	.	S	Bend	trans	-77	63	176.5	-61.7	0	0	0	0	111.6	G15 G17 C19 F33 P72	G15-S35 VanDerWaalsContact O-CB 3.28Å; G15-S35 WeakPolarHBondContact O-CB 3.38Å; G15-S35 PolarHBondContact O-OG 3.29Å; G17-S35 PolarHBondContact O-N 3.22Å; C19-S35 PolarHBondContact N-OG 3.06Å; F33-S35 PolarHBondContact O-N 2.89Å; S35-P72 WeakPolarHBondContact O-CD 3.49Å
36	I	97.5	Very high	90.2	Very high	2 Å²	2	57 Å²	57	1%	0.01	29%	0.293	C	S	.	.			trans	-134.6	149	-173.7	67.6	-177.5	0	0	0	112.3	P34 V56 G57 A60 Q61 L69 K70 Y71	P34-I36 HydrophobicContact CB-CD1 3.85Å; P34-I36 HydrophobicContact CB-CG1 3.88Å; P34-I36 HydrophobicContact CB-CG2 4.34Å; P34-I36 PolarHBondContact O-N 3.32Å; I36-V56 WeakPolarHBondContact O-CA 3.48Å; I36-G57 PolarHBondContact O-N 2.98Å; I36-G57 VanDerWaalsContact O-N 3.15Å; I36-A60 HydrophobicContact CD1-CB 4.07Å; I36-A60 HydrophobicContact CG1-CB 4Å; I36-Q61 HydrophobicContact CD1-CB 4Å; I36-Q61 VanDerWaalsContact CD1-OE1 3.24Å; I36-L69 HydrophobicContact CD1-CD1 4.23Å; I36-K70 WeakPolarHBondContact CA-O 3.31Å; I36-Y71 HydrophobicContact CG2-CD1 3.45Å; I36-Y71 VanDerWaalsContact CG2-CD1 3.45Å; I36-Y71 HydrophobicContact CG2-CE1 3.26Å; I36-Y71 HydrophobicContact CG2-CG 4.24Å
37	V	98.2	Very high	88.5	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	125.1	170.4	-176.9	0	0	0	0	109	Y55 V56 K70 D83 K86 I87	V37-Y55 CarbonylContact C-O 3.6Å; V37-Y55 WeakPolarHBondContact CA-O 3.49Å; V37-V56 HydrophobicContact CG2-CG2 4.4Å; V37-K70 PolarHBondContact N-O 3.43Å; V37-K70 PolarHBondContact O-N 3.09Å; V37-D83 HydrophobicContact CB-CB 4.27Å; V37-D83 HydrophobicContact CG2-CB 3.79Å; V37-D83 WeakPolarHBondContact CG2-O 3.47Å; V37-K86 HydrophobicContact CG1-CD 4.06Å; V37-K86 HydrophobicContact CG2-CB 4.39Å; V37-I87 HydrophobicContact CG2-CD1 4.45Å; V37-I87 HydrophobicContact CG2-CG1 4.09Å
38	G	96.7	Very high	87.1	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	136.4	177.6	0	0	0	0	0	112.3	S54 Y55 T68	G38-S54 CarbonylContact O-C 3.58Å; G38-S54 VanDerWaalsContact O-CA 3.3Å; G38-S54 WeakPolarHBondContact O-CA 3.08Å; G38-Y55 PolarHBondContact N-O 3.44Å; G38-Y55 PolarHBondContact O-N 2.76Å; G38-T68 WeakPolarHBondContact CA-O 3.23Å
39	R	95	Very high	85.6	Confident	81 Å²	81	60.2 Å²	60.2	31%	0.306	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	142.1	173.8	-67	179.3	174.4	82	-8.8	111	R41 L67 T68 D83	R39-R41 PolarHBondContact O-N 2.79Å; R39-L67 CarbonylContact O-C 3.54Å; R39-L67 VanDerWaalsContact O-CA 3.31Å; R39-L67 WeakPolarHBondContact O-CA 3.3Å; R39-T68 PolarHBondContact N-O 3.26Å; R39-T68 PolarHBondContact O-N 3.04Å; R39-D83 IonicContact CZ-OD1 3.53Å; R39-D83 IonicContact CZ-OD2 3.06Å; R39-D83 IonicContact NH1-OD1 3.46Å; R39-D83 PolarHBondContact NH1-OD1 2.86Å; R39-D83 IonicContact NH1-OD2 3.83Å; R39-D83 PolarHBondContact NH1-OD2 2.81Å; R39-D83 IonicContact NH2-OD1 3.25Å; R39-D83 PolarHBondContact NH2-OD1 3.41Å; R39-D83 IonicContact NH2-OD2 2.74Å
40	P	92.4	Very high	84	Confident	43 Å²	43	61.7 Å²	61.7	28%	0.279	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.4	133.8	-179.7	-24.7	35.1	0	0	0	112.3	M46 Y55 L67	P40-M46 HydrophobicContact CB-SD 4.18Å; P40-M46 HydrophobicContact CG-SD 3.57Å; P40-M46 VanDerWaalsContact CG-SD 3.57Å; P40-Y55 HydrophobicContact CG-CE2 4.23Å; P40-L67 HydrophobicContact CB-CD2 4.36Å; P40-L67 HydrophobicContact CG-CD2 4.14Å
41	R	89	Confident	82.7	Confident	120 Å²	120	61 Å²	61	45%	0.453	35%	0.346	S	S	.	.	S	Bend	trans	-68.7	-36.1	179.1	-73.2	-179.8	-172.1	-173	7.6	113	R39 R64 I66 L67 T68	R39-R41 PolarHBondContact O-N 2.79Å; R41-R64 PolarHBondContact NH2-O 3.16Å; R41-I66 PolarHBondContact N-O 3.43Å; R41-L67 PolarHBondContact NE-O 3.18Å; R41-L67 PolarHBondContact NH2-O 3.4Å; R41-L67 VanDerWaalsContact NH2-O 3.11Å; R41-T68 WeakPolarHBondContact CG-OG1 3.43Å
42	H	82.2	Confident	82	Confident	132 Å²	132	65.5 Å²	65.5	61%	0.611	37%	0.365	S	S	*	.	S	Bend	trans	-135	143.5	-179.1	-45.8	-42.5	0	0	0	109.9	V45	H42-V45 HydrophobicContact CB-CG2 3.66Å; H42-V45 WeakPolarHBondContact O-CG2 3.44Å
43	Q	72.4	Confident	81.6	Confident	204 Å²	204	70.2 Å²	70.2	95%	0.953	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	139.1	172.7	-71.6	-179.3	-14.2	0	0	109.7	V45	Q43-V45 PolarHBondContact O-N 3.14Å
44	G	69.5	Low	81.4	Confident	42 Å²	42	71.7 Å²	71.7	43%	0.433	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.2	-8.4	177.7	0	0	0	0	0	116.2	M46 V47	G44-M46 PolarHBondContact O-N 3.11Å; G44-V47 VanDerWaalsContact O-CG2 3.25Å; G44-V47 WeakPolarHBondContact O-CG2 3.26Å; G44-V47 PolarHBondContact O-N 2.89Å
45	V	64.5	Low	81.3	Confident	65 Å²	65	70.8 Å²	70.8	39%	0.394	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-17.2	176.3	-178.6	0	0	0	0	112.1	H42 Q43 I66	H42-V45 HydrophobicContact CB-CG2 3.66Å; H42-V45 WeakPolarHBondContact O-CG2 3.44Å; Q43-V45 PolarHBondContact O-N 3.14Å; V45-I66 HydrophobicContact CG1-CB 4Å; V45-I66 HydrophobicContact CG1-CD1 4.36Å; V45-I66 HydrophobicContact CG1-CG2 3.91Å
46	M	64.1	Low	81.3	Confident	6 Å²	6	71.3 Å²	71.3	3%	0.03	40%	0.396	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109	19.9	-176.3	-50	-165.9	95.3	0	0	113.7	P40 G44 G48 M49 Q51 Y55 K63 I66 L67	P40-M46 HydrophobicContact CB-SD 4.18Å; P40-M46 HydrophobicContact CG-SD 3.57Å; P40-M46 VanDerWaalsContact CG-SD 3.57Å; G44-M46 PolarHBondContact O-N 3.11Å; M46-G48 PolarHBondContact O-N 2.75Å; M46-G48 VanDerWaalsContact O-N 3.08Å; M46-M49 PolarHBondContact O-N 3.15Å; M46-Q51 HydrophobicContact CB-CG 4.34Å; M46-Y55 HydrophobicContact CE-CD2 4.43Å; M46-Y55 HydrophobicContact CE-CE1 4.06Å; M46-Y55 HydrophobicContact CE-CE2 3.48Å; M46-Y55 VanDerWaalsContact CE-CE2 3.48Å; M46-Y55 WeakPolarHBondContact CE-OH 3.48Å; M46-Y55 HydrophobicContact SD-CE2 3.44Å; M46-Y55 WeakPolarHBondContact SD-CE2 3.3Å; M46-Y55 VanDerWaalsContact SD-CZ 3.58Å; M46-Y55 PolarHBondContact SD-OH 3.29Å; M46-K63 HydrophobicContact CE-CD 3.83Å; M46-I66 HydrophobicContact CE-CD1 4.05Å; M46-L67 HydrophobicContact CE-CD2 4.47Å
47	V	60.6	Low	81.3	Confident	118 Å²	118	71.2 Å²	71.2	72%	0.715	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	117.4	174	171.5	0	0	0	0	109.1	G44	G44-V47 VanDerWaalsContact O-CG2 3.25Å; G44-V47 WeakPolarHBondContact O-CG2 3.26Å; G44-V47 PolarHBondContact O-N 2.89Å
48	G	65.7	Low	81.3	Confident	83 Å²	83	75.5 Å²	75.5	86%	0.856	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	94	-11.2	-179	0	0	0	0	0	116.4	M46	M46-G48 PolarHBondContact O-N 2.75Å; M46-G48 VanDerWaalsContact O-N 3.08Å
49	M	63.2	Low	81.2	Confident	125 Å²	125	78.3 Å²	78.3	62%	0.616	43%	0.432	S	S	*	.	S	Bend	trans	-100.9	8	-176.3	-61.7	-171	87.5	0	0	114.8	M46	M46-M49 PolarHBondContact O-N 3.15Å
50	G	64.8	Low	81.2	Confident	49 Å²	49	74.5 Å²	74.5	51%	0.505	42%	0.417	S	S	.	.			trans	74.4	100.2	-169.2	0	0	0	0	0	110.3	K52 Y55	G50-K52 PolarHBondContact O-N 3.14Å; G50-Y55 PolarHBondContact O-OH 3.15Å
51	Q	70.8	Confident	81.3	Confident	138 Å²	138	74.5 Å²	74.5	65%	0.645	41%	0.413	S	S	*	.			trans	-70.1	100.6	179.3	-73.8	-178.1	-16.8	0	0	109.4	M46	M46-Q51 HydrophobicContact CB-CG 4.34Å
52	K	84.5	Confident	81.5	Confident	98 Å²	98	73.2 Å²	73.2	43%	0.426	42%	0.423	S	S	.	.			trans	-98.7	145.4	163.4	-58.9	-178.5	-173.7	171.7	0	108.6	G50 S54 Y55 E59	G50-K52 PolarHBondContact O-N 3.14Å; K52-S54 PolarHBondContact O-N 3.16Å; K52-Y55 HydrophobicContact CB-CE1 4.11Å; K52-Y55 HydrophobicContact CB-CE2 4.15Å; K52-Y55 HydrophobicContact CD-CD1 4.34Å; K52-Y55 HydrophobicContact CD-CE1 3.95Å; K52-Y55 HydrophobicContact CG-CE1 4.27Å; K52-Y55 PolarHBondContact N-OH 2.95Å; K52-E59 IonicContact NZ-OE1 2.79Å; K52-E59 IonicContact NZ-OE2 3.38Å; K52-E59 PolarHBondContact NZ-OE2 3.46Å
53	D	88.6	Confident	82	Confident	147 Å²	147	68.8 Å²	68.8	79%	0.786	40%	0.402	S	S	*	.	S	Bend	trans	-70.5	-25.4	175.8	-64.2	-31.4	0	0	0	112.3
54	S	94.4	Very high	82.9	Confident	31 Å²	31	59.8 Å²	59.8	22%	0.217	36%	0.359	C	S	.	.			trans	-149.3	152.9	178.6	57.1	0	0	0	0	112.6	G38 K52 K86	G38-S54 CarbonylContact O-C 3.58Å; G38-S54 VanDerWaalsContact O-CA 3.3Å; G38-S54 WeakPolarHBondContact O-CA 3.08Å; K52-S54 PolarHBondContact O-N 3.16Å; S54-K86 WeakPolarHBondContact OG-CD 3.36Å
55	Y	95.9	Very high	83.8	Confident	2 Å²	2	61 Å²	61	1%	0.008	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	149.1	176.5	-61.4	-88.7	0	0	0	108.3	V37 G38 P40 M46 G50 K52 E59 K63 L67	V37-Y55 CarbonylContact C-O 3.6Å; V37-Y55 WeakPolarHBondContact CA-O 3.49Å; G38-Y55 PolarHBondContact N-O 3.44Å; G38-Y55 PolarHBondContact O-N 2.76Å; P40-Y55 HydrophobicContact CG-CE2 4.23Å; M46-Y55 HydrophobicContact CE-CD2 4.43Å; M46-Y55 HydrophobicContact CE-CE1 4.06Å; M46-Y55 HydrophobicContact CE-CE2 3.48Å; M46-Y55 VanDerWaalsContact CE-CE2 3.48Å; M46-Y55 WeakPolarHBondContact CE-OH 3.48Å; M46-Y55 HydrophobicContact SD-CE2 3.44Å; M46-Y55 WeakPolarHBondContact SD-CE2 3.3Å; M46-Y55 VanDerWaalsContact SD-CZ 3.58Å; M46-Y55 PolarHBondContact SD-OH 3.29Å; G50-Y55 PolarHBondContact O-OH 3.15Å; K52-Y55 HydrophobicContact CB-CE1 4.11Å; K52-Y55 HydrophobicContact CB-CE2 4.15Å; K52-Y55 HydrophobicContact CD-CD1 4.34Å; K52-Y55 HydrophobicContact CD-CE1 3.95Å; K52-Y55 HydrophobicContact CG-CE1 4.27Å; K52-Y55 PolarHBondContact N-OH 2.95Å; Y55-E59 VanDerWaalsContact CD1-CD 3.41Å; Y55-E59 HydrophobicContact CD1-CG 3.8Å; Y55-E59 WeakPolarHBondContact CD1-OE1 3.32Å; Y55-E59 VanDerWaalsContact CE1-OE1 3.27Å; Y55-E59 WeakPolarHBondContact CE1-OE1 3.31Å; Y55-K63 HydrophobicContact CD1-CD 4.19Å; Y55-K63 HydrophobicContact CE1-CD 4.19Å; Y55-L67 HydrophobicContact CD2-CD1 3.73Å; Y55-L67 HydrophobicContact CD2-CD2 3.85Å; Y55-L67 HydrophobicContact CD2-CG 4.48Å; Y55-L67 HydrophobicContact CE2-CD2 4.18Å; Y55-L67 HydrophobicContact CG-CD1 3.9Å
56	V	97.9	Very high	85.1	Confident	12 Å²	12	60.6 Å²	60.6	7%	0.073	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	151.1	-177.2	-176.7	0	0	0	0	109.8	F33 I36 V37 E59 A60 K86 I87 H90	F33-V56 HydrophobicContact CE2-CG1 4.26Å; I36-V56 WeakPolarHBondContact O-CA 3.48Å; V37-V56 HydrophobicContact CG2-CG2 4.4Å; V56-E59 WeakPolarHBondContact O-CB 3.37Å; V56-E59 PolarHBondContact O-N 2.89Å; V56-A60 PolarHBondContact O-N 2.9Å; V56-K86 HydrophobicContact CG2-CB 4.13Å; V56-I87 HydrophobicContact CG1-CG1 3.92Å; V56-H90 HydrophobicContact CB-CB 3.95Å; V56-H90 HydrophobicContact CG1-CB 3.69Å; V56-H90 HydrophobicContact CG2-CB 4.3Å
57	G	97.5	Very high	86.4	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	62.2	-137.3	169	0	0	0	0	0	114.1	P34 I36 E59 A60 Q61	P34-G57 WeakPolarHBondContact O-CA 3.31Å; I36-G57 PolarHBondContact O-N 2.98Å; I36-G57 VanDerWaalsContact O-N 3.15Å; G57-E59 PolarHBondContact O-N 3.44Å; G57-A60 WeakPolarHBondContact O-CB 3.24Å; G57-A60 PolarHBondContact O-N 3.13Å; G57-A60 VanDerWaalsContact O-N 3.07Å; G57-Q61 PolarHBondContact O-N 3.09Å
58	D	96.9	Very high	88	Confident	90 Å²	90	58 Å²	58	48%	0.481	35%	0.351	S	S	.	.	H	α-helix	trans	-62.5	-30.2	-179.4	-66.4	-42.1	0	0	0	112.3	P34 A60 Q61 S62	P34-D58 WeakPolarHBondContact CD-OD1 3.49Å; D58-A60 VanDerWaalsContact C-N 3.34Å; D58-Q61 PolarHBondContact O-N 3.27Å; D58-S62 WeakPolarHBondContact O-CB 3.42Å; D58-S62 PolarHBondContact O-N 3.04Å; D58-S62 PolarHBondContact O-OG 3.45Å
59	E	94.9	Very high	89.4	Confident	59 Å²	59	55.4 Å²	55.4	28%	0.276	32%	0.317	S	S	.	.	H	α-helix	trans	-64.9	-40.2	174.7	-164	-176.2	178	0	0	111.3	K52 Y55 V56 G57 S62 K63	K52-E59 IonicContact NZ-OE1 2.79Å; K52-E59 IonicContact NZ-OE2 3.38Å; K52-E59 PolarHBondContact NZ-OE2 3.46Å; Y55-E59 VanDerWaalsContact CD1-CD 3.41Å; Y55-E59 HydrophobicContact CD1-CG 3.8Å; Y55-E59 WeakPolarHBondContact CD1-OE1 3.32Å; Y55-E59 VanDerWaalsContact CE1-OE1 3.27Å; Y55-E59 WeakPolarHBondContact CE1-OE1 3.31Å; V56-E59 WeakPolarHBondContact O-CB 3.37Å; V56-E59 PolarHBondContact O-N 2.89Å; G57-E59 PolarHBondContact O-N 3.44Å; E59-S62 PolarHBondContact O-OG 3.25Å; E59-S62 VanDerWaalsContact O-OG 3.05Å; E59-K63 WeakPolarHBondContact O-CG 3.44Å; E59-K63 IonicContact OE1-NZ 3.46Å; E59-K63 PolarHBondContact OE1-NZ 3.08Å
60	A	95.9	Very high	91	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-70.3	-40.9	173.7	0	0	0	0	0	111.5	I36 V56 G57 D58 K63 R64 L67 L69	I36-A60 HydrophobicContact CD1-CB 4.07Å; I36-A60 HydrophobicContact CG1-CB 4Å; V56-A60 PolarHBondContact O-N 2.9Å; G57-A60 WeakPolarHBondContact O-CB 3.24Å; G57-A60 PolarHBondContact O-N 3.13Å; G57-A60 VanDerWaalsContact O-N 3.07Å; D58-A60 VanDerWaalsContact C-N 3.34Å; A60-K63 CarbonylContact O-C 3.56Å; A60-K63 PolarHBondContact O-N 3.13Å; A60-R64 PolarHBondContact O-N 3.14Å; A60-L67 HydrophobicContact CB-CD1 4.44Å; A60-L69 HydrophobicContact CB-CD2 4Å
61	Q	94.6	Very high	92.5	Very high	43 Å²	43	55.4 Å²	55.4	20%	0.201	30%	0.299	C	S	.	.	H	α-helix	trans	-62.5	-48	-177.7	-171.8	63.3	5.5	0	0	112	I36 G57 D58 K63 R64 E209	I36-Q61 HydrophobicContact CD1-CB 4Å; I36-Q61 VanDerWaalsContact CD1-OE1 3.24Å; G57-Q61 PolarHBondContact O-N 3.09Å; D58-Q61 PolarHBondContact O-N 3.27Å; Q61-K63 PolarHBondContact O-N 3.06Å; Q61-R64 VanDerWaalsContact O-CB 3.29Å; Q61-R64 WeakPolarHBondContact O-CB 3.4Å; Q61-R64 PolarHBondContact O-N 3.36Å; Q61-R64 VanDerWaalsContact O-N 3.16Å; Q61-E209 VanDerWaalsContact NE2-CG 3.26Å; Q61-E209 PolarHBondContact NE2-OE1 2.79Å; Q61-E209 PolarHBondContact NE2-OE2 3.43Å
62	S	93.1	Very high	93.8	Very high	93 Å²	93	48.9 Å²	48.9	65%	0.65	27%	0.268	S	S	*	.	H	α-helix	trans	-61.5	-23.5	177.7	56.1	0	0	0	0	113.5	D58 E59	D58-S62 WeakPolarHBondContact O-CB 3.42Å; D58-S62 PolarHBondContact O-N 3.04Å; D58-S62 PolarHBondContact O-OG 3.45Å; E59-S62 PolarHBondContact O-OG 3.25Å; E59-S62 VanDerWaalsContact O-OG 3.05Å
63	K	92.1	Very high	94.4	Very high	40 Å²	40	44.3 Å²	44.3	17%	0.174	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104	14.6	179.9	-61.4	-175.6	-178.5	88.1	0	113.4	M46 Y55 E59 A60 Q61 G65 I66 L67	M46-K63 HydrophobicContact CE-CD 3.83Å; Y55-K63 HydrophobicContact CD1-CD 4.19Å; Y55-K63 HydrophobicContact CE1-CD 4.19Å; E59-K63 WeakPolarHBondContact O-CG 3.44Å; E59-K63 IonicContact OE1-NZ 3.46Å; E59-K63 PolarHBondContact OE1-NZ 3.08Å; A60-K63 CarbonylContact O-C 3.56Å; A60-K63 PolarHBondContact O-N 3.13Å; Q61-K63 PolarHBondContact O-N 3.06Å; K63-G65 PolarHBondContact O-N 3.04Å; K63-I66 HydrophobicContact CB-CD1 4.47Å; K63-I66 HydrophobicContact CB-CG1 4.19Å; K63-I66 VanDerWaalsContact O-CG1 3.29Å; K63-I66 WeakPolarHBondContact O-CG1 3.33Å; K63-I66 PolarHBondContact O-N 3.02Å; K63-L67 HydrophobicContact CB-CD1 3.58Å; K63-L67 HydrophobicContact CB-CG 3.81Å; K63-L67 WeakPolarHBondContact O-CG 3.35Å; K63-L67 PolarHBondContact O-N 3.36Å; K63-L67 VanDerWaalsContact O-N 3.13Å
64	R	92	Very high	94.7	Very high	15 Å²	15	42 Å²	42	6%	0.057	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-49.5	-34.4	-176.4	178.1	173.3	-69.7	-123.4	-6.4	114.8	R41 A60 Q61 I66 L67 L69 Y71 T205 E209	R41-R64 PolarHBondContact NH2-O 3.16Å; A60-R64 PolarHBondContact O-N 3.14Å; Q61-R64 VanDerWaalsContact O-CB 3.29Å; Q61-R64 WeakPolarHBondContact O-CB 3.4Å; Q61-R64 PolarHBondContact O-N 3.36Å; Q61-R64 VanDerWaalsContact O-N 3.16Å; R64-I66 VanDerWaalsContact C-N 3.27Å; R64-I66 PolarHBondContact O-N 2.8Å; R64-L67 VanDerWaalsContact O-O 3.07Å; R64-L69 HydrophobicContact CB-CD1 3.86Å; R64-L69 HydrophobicContact CG-CD1 3.63Å; R64-L69 HydrophobicContact CG-CG 4.42Å; R64-L69 VanDerWaalsContact NH2-CD1 3.34Å; R64-Y71 PolarHBondContact NH2-OH 3.36Å; R64-Y71 VanDerWaalsContact NH2-OH 3.17Å; R64-T205 WeakPolarHBondContact CD-O 3.4Å; R64-T205 PolarHBondContact NH1-O 3.49Å; R64-E209 IonicContact CZ-OE1 3.19Å; R64-E209 IonicContact NH1-OE1 2.91Å; R64-E209 PolarHBondContact NH1-OE1 2.97Å; R64-E209 IonicContact NH2-OE1 2.68Å; R64-E209 PolarHBondContact NH2-OE1 3.07Å; R64-E209 VanDerWaalsContact NH2-OE1 3.15Å
65	G	88.6	Confident	94.7	Very high	66 Å²	66	44 Å²	44	68%	0.68	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-28.9	-179.9	0	0	0	0	0	114.4	K63	K63-G65 PolarHBondContact O-N 3.04Å
66	I	90.2	Very high	94.6	Very high	58 Å²	58	44.5 Å²	44.5	30%	0.297	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113.1	-6.4	-177.6	60.3	171	0	0	0	113.3	R41 V45 M46 K63 R64	R41-I66 PolarHBondContact N-O 3.43Å; V45-I66 HydrophobicContact CG1-CB 4Å; V45-I66 HydrophobicContact CG1-CD1 4.36Å; V45-I66 HydrophobicContact CG1-CG2 3.91Å; M46-I66 HydrophobicContact CE-CD1 4.05Å; K63-I66 HydrophobicContact CB-CD1 4.47Å; K63-I66 HydrophobicContact CB-CG1 4.19Å; K63-I66 VanDerWaalsContact O-CG1 3.29Å; K63-I66 WeakPolarHBondContact O-CG1 3.33Å; K63-I66 PolarHBondContact O-N 3.02Å; R64-I66 VanDerWaalsContact C-N 3.27Å; R64-I66 PolarHBondContact O-N 2.8Å
67	L	92.8	Very high	94.5	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	149.7	179.1	-57.3	-174.7	0	0	0	111.8	R39 P40 R41 M46 Y55 A60 K63 R64 L69	R39-L67 CarbonylContact O-C 3.54Å; R39-L67 VanDerWaalsContact O-CA 3.31Å; R39-L67 WeakPolarHBondContact O-CA 3.3Å; P40-L67 HydrophobicContact CB-CD2 4.36Å; P40-L67 HydrophobicContact CG-CD2 4.14Å; R41-L67 PolarHBondContact NE-O 3.18Å; R41-L67 PolarHBondContact NH2-O 3.4Å; R41-L67 VanDerWaalsContact NH2-O 3.11Å; M46-L67 HydrophobicContact CE-CD2 4.47Å; Y55-L67 HydrophobicContact CD2-CD1 3.73Å; Y55-L67 HydrophobicContact CD2-CD2 3.85Å; Y55-L67 HydrophobicContact CD2-CG 4.48Å; Y55-L67 HydrophobicContact CE2-CD2 4.18Å; Y55-L67 HydrophobicContact CG-CD1 3.9Å; A60-L67 HydrophobicContact CB-CD1 4.44Å; K63-L67 HydrophobicContact CB-CD1 3.58Å; K63-L67 HydrophobicContact CB-CG 3.81Å; K63-L67 WeakPolarHBondContact O-CG 3.35Å; K63-L67 PolarHBondContact O-N 3.36Å; K63-L67 VanDerWaalsContact O-N 3.13Å; R64-L67 VanDerWaalsContact O-O 3.07Å; L67-L69 HydrophobicContact CB-CD2 3.93Å; L67-L69 HydrophobicContact CD1-CD2 4.42Å
68	T	93.9	Very high	94.5	Very high	68 Å²	68	45.8 Å²	45.8	42%	0.417	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	116.1	159.1	-62.1	0	0	0	0	107.4	G38 R39 R41	G38-T68 WeakPolarHBondContact CA-O 3.23Å; R39-T68 PolarHBondContact N-O 3.26Å; R39-T68 PolarHBondContact O-N 3.04Å; R41-T68 WeakPolarHBondContact CG-OG1 3.43Å
69	L	95.5	Very high	94.5	Very high	30 Å²	30	45.1 Å²	45.1	16%	0.157	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	136.8	-179.2	-56.5	-177.6	0	0	0	110.6	I36 A60 R64 L67	I36-L69 HydrophobicContact CD1-CD1 4.23Å; A60-L69 HydrophobicContact CB-CD2 4Å; R64-L69 HydrophobicContact CB-CD1 3.86Å; R64-L69 HydrophobicContact CG-CD1 3.63Å; R64-L69 HydrophobicContact CG-CG 4.42Å; R64-L69 VanDerWaalsContact NH2-CD1 3.34Å; L67-L69 HydrophobicContact CB-CD2 3.93Å; L67-L69 HydrophobicContact CD1-CD2 4.42Å
70	K	96.9	Very high	94.7	Very high	108 Å²	108	44.4 Å²	44.4	47%	0.47	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	152	173.9	-69.1	-167.8	174.3	-171.8	0	110.5	I36 V37	I36-K70 WeakPolarHBondContact CA-O 3.31Å; V37-K70 PolarHBondContact N-O 3.43Å; V37-K70 PolarHBondContact O-N 3.09Å
71	Y	96.5	Very high	94.8	Very high	66 Å²	66	46.5 Å²	46.5	26%	0.259	26%	0.256	S	S	.	.			trans	-117.3	108.7	-179.5	-58.7	-100.2	0	0	0	107.1	I36 R64 I73	I36-Y71 HydrophobicContact CG2-CD1 3.45Å; I36-Y71 VanDerWaalsContact CG2-CD1 3.45Å; I36-Y71 HydrophobicContact CG2-CE1 3.26Å; I36-Y71 HydrophobicContact CG2-CG 4.24Å; R64-Y71 PolarHBondContact NH2-OH 3.36Å; R64-Y71 VanDerWaalsContact NH2-OH 3.17Å; Y71-I73 PolarHBondContact O-N 3.19Å
72	P	97.8	Very high	95	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	27%	0.274	C	S	.	.	S	Bend	trans	-76.6	-7.6	-176.2	27.4	-31.1	0	0	0	114.1	S35 I78 T79 N80 D83 M84 I87	S35-P72 WeakPolarHBondContact O-CD 3.49Å; P72-I78 CarbonylContact O-C 3.51Å; P72-I78 WeakPolarHBondContact O-CA 3.45Å; P72-T79 PolarHBondContact O-N 3.31Å; P72-T79 PolarHBondContact O-OG1 3.33Å; P72-N80 HydrophobicContact CB-CB 4.13Å; P72-N80 WeakPolarHBondContact CB-O 3.29Å; P72-N80 PolarHBondContact O-N 2.88Å; P72-D83 HydrophobicContact CB-CB 3.78Å; P72-D83 HydrophobicContact CG-CB 4.19Å; P72-M84 HydrophobicContact CB-CB 4.44Å; P72-M84 HydrophobicContact CG-SD 4.34Å; P72-I87 HydrophobicContact CG-CD1 3.34Å; P72-I87 HydrophobicContact CG-CG1 4.46Å
73	I	97.5	Very high	95.2	Very high	2 Å²	2	45.2 Å²	45.2	1%	0.01	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	119.2	178.2	-51.3	175.4	0	0	0	108.6	N14 S16 Y71 I77 I78 M84	N14-I73 HydrophobicContact CB-CD1 4.16Å; S16-I73 VanDerWaalsContact OG-CG2 3.31Å; S16-I73 WeakPolarHBondContact OG-CG2 3.46Å; Y71-I73 PolarHBondContact O-N 3.19Å; I73-I77 CarbonylContact C-O 3.54Å; I73-I77 VanDerWaalsContact CA-O 3.31Å; I73-I77 WeakPolarHBondContact CA-O 3.39Å; I73-I78 HydrophobicContact CG1-CG1 4.03Å; I73-M84 HydrophobicContact CD1-CE 4.18Å; I73-M84 HydrophobicContact CD1-SD 3.83Å; I73-M84 HydrophobicContact CG1-SD 3.92Å
74	E	94.4	Very high	95.5	Very high	98 Å²	98	43.3 Å²	43.3	46%	0.458	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	126	178.2	-66.6	176.3	-153.9	0	0	109.2	G76 I77 T79	E74-G76 PolarHBondContact O-N 2.89Å; E74-G76 VanDerWaalsContact O-N 3.15Å; E74-I77 PolarHBondContact N-O 2.9Å; E74-I77 PolarHBondContact O-N 2.8Å; E74-T79 HydrophobicContact CB-CG2 4.01Å; E74-T79 HydrophobicContact CG-CG2 4.31Å; E74-T79 PolarHBondContact OE1-OG1 2.72Å
75	H	93.9	Very high	95.8	Very high	74 Å²	74	44.9 Å²	44.9	34%	0.343	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	46.3	44.3	-177.1	-46.5	111.3	0	0	0	113.9	I77 G160 V161 R179	H75-I77 VanDerWaalsContact C-N 3.29Å; H75-I77 PolarHBondContact O-N 2.72Å; H75-G160 WeakPolarHBondContact CA-O 3.26Å; H75-G160 PolarHBondContact CD2-O 3.34Å; H75-V161 HydrophobicContact CB-CB 4.37Å; H75-R179 PolarHBondContact O-NH2 3.25Å
76	G	93.6	Very high	96.3	Very high	13 Å²	13	44.6 Å²	44.6	13%	0.134	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.8	-1.6	-179.1	0	0	0	0	0	116.1	S16 E74	S16-G76 WeakPolarHBondContact OG-CA 3.29Å; S16-G76 PolarHBondContact OG-N 2.81Å; E74-G76 PolarHBondContact O-N 2.89Å; E74-G76 VanDerWaalsContact O-N 3.15Å
77	I	96.5	Very high	96.7	Very high	25 Å²	25	41.9 Å²	41.9	13%	0.128	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	131.3	-177.2	-56	-57.7	0	0	0	110.3	I73 E74 H75 T79 N117	I73-I77 CarbonylContact C-O 3.54Å; I73-I77 VanDerWaalsContact CA-O 3.31Å; I73-I77 WeakPolarHBondContact CA-O 3.39Å; E74-I77 PolarHBondContact N-O 2.9Å; E74-I77 PolarHBondContact O-N 2.8Å; H75-I77 VanDerWaalsContact C-N 3.29Å; H75-I77 PolarHBondContact O-N 2.72Å; I77-T79 PolarHBondContact O-N 3.1Å; I77-N117 WeakPolarHBondContact CG2-ND2 3.06Å
78	I	97.7	Very high	96.9	Very high	14 Å²	14	41.9 Å²	41.9	7%	0.072	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	119.4	171.4	-61.3	160.8	0	0	0	108.8	P72 I73 W81 M84 W88 N117 M121	P72-I78 CarbonylContact O-C 3.51Å; P72-I78 WeakPolarHBondContact O-CA 3.45Å; I73-I78 HydrophobicContact CG1-CG1 4.03Å; I78-W81 HydrophobicContact CB-CH2 4.03Å; I78-W81 HydrophobicContact CB-CZ2 4.08Å; I78-W81 HydrophobicContact CB-CZ3 4.34Å; I78-W81 HydrophobicContact CD1-CE3 4.47Å; I78-W81 HydrophobicContact CD1-CH2 3.75Å; I78-W81 HydrophobicContact CD1-CZ3 3.68Å; I78-W81 HydrophobicContact CG2-CD2 3.79Å; I78-W81 HydrophobicContact CG2-CE3 3.82Å; I78-W81 HydrophobicContact CG2-CG 4.4Å; I78-W81 HydrophobicContact CG2-CH2 4.07Å; I78-W81 HydrophobicContact CG2-CZ2 4.02Å; I78-W81 HydrophobicContact CG2-CZ3 3.99Å; I78-M84 HydrophobicContact CD1-CG 3.96Å; I78-M84 HydrophobicContact CD1-SD 4.4Å; I78-M84 HydrophobicContact CG1-CG 4.22Å; I78-M84 HydrophobicContact CG1-SD 4.26Å; I78-M84 HydrophobicContact CG2-CB 3.97Å; I78-M84 HydrophobicContact CG2-CG 4.22Å; I78-W88 HydrophobicContact CD1-CH2 4.15Å; I78-W88 HydrophobicContact CD1-CZ2 4.18Å; I78-N117 PolarHBondContact O-ND2 2.88Å; I78-N117 VanDerWaalsContact O-ND2 3.12Å; I78-M121 HydrophobicContact CD1-CG 4.18Å; I78-M121 HydrophobicContact CD1-SD 4.11Å
79	T	97	Very high	97.1	Very high	76 Å²	76	43.2 Å²	43.2	47%	0.466	21%	0.21	S	C	.	.			trans	-108.2	-17.9	178.1	57.9	0	0	0	0	112.6	P72 E74 I77	P72-T79 PolarHBondContact O-N 3.31Å; P72-T79 PolarHBondContact O-OG1 3.33Å; E74-T79 HydrophobicContact CB-CG2 4.01Å; E74-T79 HydrophobicContact CG-CG2 4.31Å; E74-T79 PolarHBondContact OE1-OG1 2.72Å; I77-T79 PolarHBondContact O-N 3.1Å
80	N	98.1	Very high	97.3	Very high	43 Å²	43	42.5 Å²	42.5	23%	0.23	21%	0.206	C	C	.	.			trans	-134.9	102.4	178.7	-176.4	-22.5	0	0	0	111.3	P72 D82 D83 M84	P72-N80 HydrophobicContact CB-CB 4.13Å; P72-N80 WeakPolarHBondContact CB-O 3.29Å; P72-N80 PolarHBondContact O-N 2.88Å; N80-D82 PolarHBondContact OD1-N 3.46Å; N80-D83 HydrophobicContact CB-CB 4.34Å; N80-D83 PolarHBondContact ND2-OD2 3.17Å; N80-D83 VanDerWaalsContact ND2-OD2 3.09Å; N80-D83 PolarHBondContact OD1-N 3.35Å; N80-D83 VanDerWaalsContact OD1-N 3.09Å; N80-M84 PolarHBondContact O-N 2.76Å
81	W	98.1	Very high	97.3	Very high	45 Å²	45	37.4 Å²	37.4	17%	0.17	18%	0.184	C	C	.	.	H	α-helix	trans	-69.8	-39.5	-177	-65.6	101	0	0	0	113.3	I78 D83 M84 E85 W88 N117 K120 M121 I124	I78-W81 HydrophobicContact CB-CH2 4.03Å; I78-W81 HydrophobicContact CB-CZ2 4.08Å; I78-W81 HydrophobicContact CB-CZ3 4.34Å; I78-W81 HydrophobicContact CD1-CE3 4.47Å; I78-W81 HydrophobicContact CD1-CH2 3.75Å; I78-W81 HydrophobicContact CD1-CZ3 3.68Å; I78-W81 HydrophobicContact CG2-CD2 3.79Å; I78-W81 HydrophobicContact CG2-CE3 3.82Å; I78-W81 HydrophobicContact CG2-CG 4.4Å; I78-W81 HydrophobicContact CG2-CH2 4.07Å; I78-W81 HydrophobicContact CG2-CZ2 4.02Å; I78-W81 HydrophobicContact CG2-CZ3 3.99Å; W81-D83 PolarHBondContact O-N 3.04Å; W81-M84 PolarHBondContact O-N 3.27Å; W81-M84 VanDerWaalsContact O-N 3.08Å; W81-E85 WeakPolarHBondContact O-CG 3.41Å; W81-E85 PolarHBondContact O-N 2.81Å; W81-W88 HydrophobicContact CE3-CH2 4.44Å; W81-W88 HydrophobicContact CZ3-CH2 4Å; W81-W88 HydrophobicContact CZ3-CZ3 4.49Å; W81-N117 HydrophobicContact CH2-CB 4.1Å; W81-N117 VanDerWaalsContact CH2-O 3.24Å; W81-N117 WeakPolarHBondContact CH2-O 3.34Å; W81-N117 HydrophobicContact CZ2-CB 3.82Å; W81-K120 HydrophobicContact CD2-CB 4.17Å; W81-K120 HydrophobicContact CD2-CG 3.39Å; W81-K120 HydrophobicContact CE3-CB 4.28Å; W81-K120 HydrophobicContact CE3-CG 3.65Å; W81-K120 HydrophobicContact CG-CG 3.86Å; W81-K120 HydrophobicContact CH2-CB 3.85Å; W81-K120 HydrophobicContact CH2-CG 4.13Å; W81-K120 HydrophobicContact CZ2-CB 3.72Å; W81-K120 HydrophobicContact CZ2-CG 3.91Å; W81-K120 HydrophobicContact CZ3-CB 4.1Å; W81-K120 HydrophobicContact CZ3-CG 3.97Å; W81-M121 HydrophobicContact CH2-CG 3.68Å; W81-M121 HydrophobicContact CZ3-CB 4.48Å; W81-M121 HydrophobicContact CZ3-CG 3.64Å; W81-I124 HydrophobicContact CB-CD1 4.37Å; W81-I124 HydrophobicContact CD2-CD1 4.26Å; W81-I124 HydrophobicContact CE3-CD1 3.49Å; W81-I124 VanDerWaalsContact CE3-CD1 3.49Å; W81-I124 HydrophobicContact CZ3-CD1 4.16Å
82	D	98	Very high	97.4	Very high	109 Å²	109	34.2 Å²	34.2	58%	0.583	17%	0.171	S	C	*	.	H	α-helix	trans	-61.5	-35	178.8	-62.4	-8.7	0	0	0	112.3	N80 K86	N80-D82 PolarHBondContact OD1-N 3.46Å; D82-K86 WeakPolarHBondContact O-CG 3.06Å; D82-K86 PolarHBondContact O-NZ 3.44Å
83	D	98.3	Very high	97.5	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-80.7	-32.2	176.1	-77.1	-8.2	0	0	0	111.5	V37 R39 P72 N80 W81 K86 I87	V37-D83 HydrophobicContact CB-CB 4.27Å; V37-D83 HydrophobicContact CG2-CB 3.79Å; V37-D83 WeakPolarHBondContact CG2-O 3.47Å; R39-D83 IonicContact CZ-OD1 3.53Å; R39-D83 IonicContact CZ-OD2 3.06Å; R39-D83 IonicContact NH1-OD1 3.46Å; R39-D83 PolarHBondContact NH1-OD1 2.86Å; R39-D83 IonicContact NH1-OD2 3.83Å; R39-D83 PolarHBondContact NH1-OD2 2.81Å; R39-D83 IonicContact NH2-OD1 3.25Å; R39-D83 PolarHBondContact NH2-OD1 3.41Å; R39-D83 IonicContact NH2-OD2 2.74Å; P72-D83 HydrophobicContact CB-CB 3.78Å; P72-D83 HydrophobicContact CG-CB 4.19Å; N80-D83 HydrophobicContact CB-CB 4.34Å; N80-D83 PolarHBondContact ND2-OD2 3.17Å; N80-D83 VanDerWaalsContact ND2-OD2 3.09Å; N80-D83 PolarHBondContact OD1-N 3.35Å; N80-D83 VanDerWaalsContact OD1-N 3.09Å; W81-D83 PolarHBondContact O-N 3.04Å; D83-K86 PolarHBondContact O-N 3.35Å; D83-K86 IonicContact OD1-NZ 2.88Å; D83-I87 PolarHBondContact O-N 2.86Å; D83-I87 VanDerWaalsContact O-N 3.16Å
84	M	98.3	Very high	97.4	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-66.4	-40.4	173	-164.1	65.6	-151.9	0	0	112.3	N14 P72 I73 I78 N80 W81 K86 I87 W88	N14-M84 HydrophobicContact CB-CE 4.21Å; N14-M84 VanDerWaalsContact OD1-CE 3.28Å; N14-M84 WeakPolarHBondContact OD1-CE 3.47Å; P72-M84 HydrophobicContact CB-CB 4.44Å; P72-M84 HydrophobicContact CG-SD 4.34Å; I73-M84 HydrophobicContact CD1-CE 4.18Å; I73-M84 HydrophobicContact CD1-SD 3.83Å; I73-M84 HydrophobicContact CG1-SD 3.92Å; I78-M84 HydrophobicContact CD1-CG 3.96Å; I78-M84 HydrophobicContact CD1-SD 4.4Å; I78-M84 HydrophobicContact CG1-CG 4.22Å; I78-M84 HydrophobicContact CG1-SD 4.26Å; I78-M84 HydrophobicContact CG2-CB 3.97Å; I78-M84 HydrophobicContact CG2-CG 4.22Å; N80-M84 PolarHBondContact O-N 2.76Å; W81-M84 PolarHBondContact O-N 3.27Å; W81-M84 VanDerWaalsContact O-N 3.08Å; M84-K86 VanDerWaalsContact C-N 3.26Å; M84-K86 PolarHBondContact O-N 3.37Å; M84-I87 HydrophobicContact CE-CB 4.34Å; M84-I87 HydrophobicContact CE-CG2 3.9Å; M84-I87 WeakPolarHBondContact O-CA 3.29Å; M84-I87 WeakPolarHBondContact O-CB 3.4Å; M84-I87 PolarHBondContact O-N 2.8Å; M84-I87 HydrophobicContact SD-CB 4.45Å; M84-I87 HydrophobicContact SD-CD1 4.37Å; M84-W88 HydrophobicContact CB-CZ3 4.43Å; M84-W88 HydrophobicContact CE-CD2 4.11Å; M84-W88 HydrophobicContact CE-CG 4.36Å; M84-W88 HydrophobicContact CE-CZ2 3.73Å; M84-W88 HydrophobicContact CG-CD2 4.04Å; M84-W88 HydrophobicContact CG-CE3 4.04Å; M84-W88 HydrophobicContact CG-CH2 3.63Å; M84-W88 HydrophobicContact CG-CZ2 3.62Å; M84-W88 HydrophobicContact CG-CZ3 3.85Å; M84-W88 PolarHBondContact O-N 2.8Å; M84-W88 HydrophobicContact SD-CZ2 4.5Å
85	E	98.3	Very high	97.6	Very high	47 Å²	47	40.9 Å²	40.9	22%	0.22	20%	0.201	C	C	.	.	H	α-helix	trans	-57.3	-39.7	173.2	-77.3	-176.6	-142.4	0	0	111.7	W81 I87 W88 H89 I124	W81-E85 WeakPolarHBondContact O-CG 3.41Å; W81-E85 PolarHBondContact O-N 2.81Å; E85-I87 VanDerWaalsContact C-N 3.34Å; E85-I87 PolarHBondContact O-N 3.09Å; E85-W88 PolarHBondContact O-N 3.16Å; E85-H89 VanDerWaalsContact O-CB 3.31Å; E85-H89 WeakPolarHBondContact O-CB 3.09Å; E85-H89 PolarHBondContact O-N 3.29Å; E85-I124 HydrophobicContact CG-CD1 3.89Å; E85-I124 HydrophobicContact CG-CG1 4.25Å; E85-I124 HydrophobicContact CG-CG2 3.67Å; E85-I124 WeakPolarHBondContact OE1-CD1 3.3Å; E85-I124 WeakPolarHBondContact OE1-CG1 3.41Å
86	K	98.3	Very high	97.8	Very high	61 Å²	61	38.1 Å²	38.1	27%	0.265	19%	0.189	S	C	.	.	H	α-helix	trans	-65.6	-36.8	174.5	-67.8	176.3	-170.1	74.2	0	112.4	V37 S54 V56 D82 D83 M84 H90	V37-K86 HydrophobicContact CG1-CD 4.06Å; V37-K86 HydrophobicContact CG2-CB 4.39Å; S54-K86 WeakPolarHBondContact OG-CD 3.36Å; V56-K86 HydrophobicContact CG2-CB 4.13Å; D82-K86 WeakPolarHBondContact O-CG 3.06Å; D82-K86 PolarHBondContact O-NZ 3.44Å; D83-K86 PolarHBondContact O-N 3.35Å; D83-K86 IonicContact OD1-NZ 2.88Å; M84-K86 VanDerWaalsContact C-N 3.26Å; M84-K86 PolarHBondContact O-N 3.37Å; K86-H90 VanDerWaalsContact O-CB 3.26Å; K86-H90 WeakPolarHBondContact O-CB 3.34Å; K86-H90 PolarHBondContact O-N 2.78Å
87	I	98.5	Very high	98	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-65.3	-44.3	175.4	-72.6	178.3	0	0	0	111.1	C19 F33 V37 V56 P72 D83 M84 E85 H90 S91	C19-I87 HydrophobicContact CB-CG2 4.25Å; F33-I87 HydrophobicContact CE2-CG2 4.03Å; F33-I87 HydrophobicContact CZ-CG2 4.12Å; V37-I87 HydrophobicContact CG2-CD1 4.45Å; V37-I87 HydrophobicContact CG2-CG1 4.09Å; V56-I87 HydrophobicContact CG1-CG1 3.92Å; P72-I87 HydrophobicContact CG-CD1 3.34Å; P72-I87 HydrophobicContact CG-CG1 4.46Å; D83-I87 PolarHBondContact O-N 2.86Å; D83-I87 VanDerWaalsContact O-N 3.16Å; M84-I87 HydrophobicContact CE-CB 4.34Å; M84-I87 HydrophobicContact CE-CG2 3.9Å; M84-I87 WeakPolarHBondContact O-CA 3.29Å; M84-I87 WeakPolarHBondContact O-CB 3.4Å; M84-I87 PolarHBondContact O-N 2.8Å; M84-I87 HydrophobicContact SD-CB 4.45Å; M84-I87 HydrophobicContact SD-CD1 4.37Å; E85-I87 VanDerWaalsContact C-N 3.34Å; E85-I87 PolarHBondContact O-N 3.09Å; I87-H90 PolarHBondContact O-N 3.04Å; I87-S91 PolarHBondContact O-N 3.13Å; I87-S91 PolarHBondContact O-OG 2.85Å
88	W	98.6	Very high	98.1	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-67.2	-43.7	176.6	-69.6	-39.3	0	0	0	112.2	N14 I78 W81 M84 E85 H90 S91 F92 L107 M121 I124 M125 F129	N14-W88 PolarHBondContact OD1-NE1 3.21Å; I78-W88 HydrophobicContact CD1-CH2 4.15Å; I78-W88 HydrophobicContact CD1-CZ2 4.18Å; W81-W88 HydrophobicContact CE3-CH2 4.44Å; W81-W88 HydrophobicContact CZ3-CH2 4Å; W81-W88 HydrophobicContact CZ3-CZ3 4.49Å; M84-W88 HydrophobicContact CB-CZ3 4.43Å; M84-W88 HydrophobicContact CE-CD2 4.11Å; M84-W88 HydrophobicContact CE-CG 4.36Å; M84-W88 HydrophobicContact CE-CZ2 3.73Å; M84-W88 HydrophobicContact CG-CD2 4.04Å; M84-W88 HydrophobicContact CG-CE3 4.04Å; M84-W88 HydrophobicContact CG-CH2 3.63Å; M84-W88 HydrophobicContact CG-CZ2 3.62Å; M84-W88 HydrophobicContact CG-CZ3 3.85Å; M84-W88 PolarHBondContact O-N 2.8Å; M84-W88 HydrophobicContact SD-CZ2 4.5Å; E85-W88 PolarHBondContact O-N 3.16Å; W88-H90 VanDerWaalsContact C-N 3.27Å; W88-H90 PolarHBondContact O-N 3.31Å; W88-S91 WeakPolarHBondContact O-CA 3.34Å; W88-S91 VanDerWaalsContact O-CB 3.31Å; W88-S91 WeakPolarHBondContact O-CB 3.43Å; W88-S91 PolarHBondContact O-N 2.95Å; W88-F92 HydrophobicContact CB-CD2 4.44Å; W88-F92 HydrophobicContact CB-CE2 3.93Å; W88-F92 WeakPolarHBondContact O-CD2 3.44Å; W88-F92 WeakPolarHBondContact O-CG 3.3Å; W88-F92 PolarHBondContact O-N 2.84Å; W88-L107 HydrophobicContact CZ2-CD2 3.93Å; W88-M121 HydrophobicContact CH2-CG 4Å; W88-M121 HydrophobicContact CZ2-CG 4.45Å; W88-I124 HydrophobicContact CE3-CG2 3.9Å; W88-I124 HydrophobicContact CZ3-CB 4.27Å; W88-I124 HydrophobicContact CZ3-CD1 4Å; W88-I124 HydrophobicContact CZ3-CG2 3.77Å; W88-M125 HydrophobicContact CB-CE 4.29Å; W88-M125 HydrophobicContact CD2-CE 3.32Å; W88-M125 HydrophobicContact CE3-CE 3.55Å; W88-M125 HydrophobicContact CG-CE 3.69Å; W88-M125 HydrophobicContact CH2-CE 4.21Å; W88-M125 HydrophobicContact CZ2-CE 4.03Å; W88-M125 HydrophobicContact CZ3-CE 3.99Å; W88-F129 HydrophobicContact CB-CE2 3.73Å; W88-F129 HydrophobicContact CB-CZ 3.68Å; W88-F129 HydrophobicContact CE3-CE2 4.06Å
89	H	98.3	Very high	98.1	Very high	96 Å²	96	47.8 Å²	47.8	44%	0.444	23%	0.226	S	C	.	.	H	α-helix	trans	-55.6	-45.3	172.7	-177.4	-64.4	0	0	0	111.2	E85 F92 Y93 F129	E85-H89 VanDerWaalsContact O-CB 3.31Å; E85-H89 WeakPolarHBondContact O-CB 3.09Å; E85-H89 PolarHBondContact O-N 3.29Å; H89-F92 PolarHBondContact O-N 2.91Å; H89-Y93 HydrophobicContact CB-CD2 4.43Å; H89-Y93 AromaticContact CD2-CD2 3.6Å; H89-Y93 AromaticContact CD2-CE2 3.71Å; H89-Y93 AromaticContact CE1-CD2 3.51Å; H89-Y93 AromaticContact CG-CD2 3.66Å; H89-Y93 AromaticContact ND1-CD2 3.62Å; H89-Y93 AromaticContact NE2-CD2 3.53Å; H89-Y93 AromaticContact NE2-CE2 3.84Å; H89-Y93 WeakPolarHBondContact O-CB 3.26Å; H89-Y93 WeakPolarHBondContact O-CD2 3.41Å; H89-Y93 PolarHBondContact O-N 3.32Å; H89-F129 HydrophobicContact CB-CE1 4.04Å; H89-F129 HydrophobicContact CB-CZ 4.21Å
90	H	98.2	Very high	98.1	Very high	16 Å²	16	44.1 Å²	44.1	7%	0.074	20%	0.204	C	C	.	.	I	π-helix	trans	-62.1	-43	175.6	-176.9	68.3	0	0	0	112.1	F33 V56 K86 I87 W88 F92 N94 E95	F33-H90 AromaticContact CD2-CD2 3.91Å; F33-H90 AromaticContact CE2-CD2 3.66Å; F33-H90 AromaticContact CZ-CD2 3.84Å; V56-H90 HydrophobicContact CB-CB 3.95Å; V56-H90 HydrophobicContact CG1-CB 3.69Å; V56-H90 HydrophobicContact CG2-CB 4.3Å; K86-H90 VanDerWaalsContact O-CB 3.26Å; K86-H90 WeakPolarHBondContact O-CB 3.34Å; K86-H90 PolarHBondContact O-N 2.78Å; I87-H90 PolarHBondContact O-N 3.04Å; W88-H90 VanDerWaalsContact C-N 3.27Å; W88-H90 PolarHBondContact O-N 3.31Å; H90-F92 PolarHBondContact O-N 3.45Å; H90-N94 WeakPolarHBondContact ND1-CB 3.28Å; H90-N94 PolarHBondContact ND1-OD1 3.22Å; H90-N94 WeakPolarHBondContact O-CA 3.5Å; H90-N94 VanDerWaalsContact O-CB 3.3Å; H90-N94 WeakPolarHBondContact O-CB 3.4Å; H90-N94 PolarHBondContact O-N 3.24Å; H90-E95 IonicContact CE1-OE1 2.74Å; H90-E95 PolarHBondContact CE1-OE1 2.81Å; H90-E95 IonicContact NE2-OE1 3.52Å; H90-E95 PolarHBondContact NE2-OE1 2.74Å; H90-E95 PolarHBondContact O-N 3.15Å
91	S	98.4	Very high	98.1	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	21%	0.214	C	C	.	.	I	π-helix	trans	-56.5	-50.6	176	-52.8	0	0	0	0	111.4	F33 I87 W88 L96	F33-S91 VanDerWaalsContact CZ-OG 3.29Å; F33-S91 WeakPolarHBondContact CZ-OG 3.27Å; I87-S91 PolarHBondContact O-N 3.13Å; I87-S91 PolarHBondContact O-OG 2.85Å; W88-S91 WeakPolarHBondContact O-CA 3.34Å; W88-S91 VanDerWaalsContact O-CB 3.31Å; W88-S91 WeakPolarHBondContact O-CB 3.43Å; W88-S91 PolarHBondContact O-N 2.95Å; S91-L96 WeakPolarHBondContact O-CB 3.49Å; S91-L96 VanDerWaalsContact O-CG 3.29Å; S91-L96 WeakPolarHBondContact O-CG 3.24Å; S91-L96 PolarHBondContact O-N 3.13Å
92	F	98.5	Very high	98	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	23%	0.233	C	C	.	.	I	π-helix	trans	-73.6	-53	-175.6	-57.1	-44.4	0	0	0	112.4	L10 W88 H89 H90 L96 R97 V98 P100 T105 M125 F129	L10-F92 HydrophobicContact CD1-CD1 3.71Å; L10-F92 HydrophobicContact CD1-CE1 3.82Å; W88-F92 HydrophobicContact CB-CD2 4.44Å; W88-F92 HydrophobicContact CB-CE2 3.93Å; W88-F92 WeakPolarHBondContact O-CD2 3.44Å; W88-F92 WeakPolarHBondContact O-CG 3.3Å; W88-F92 PolarHBondContact O-N 2.84Å; H89-F92 PolarHBondContact O-N 2.91Å; H90-F92 PolarHBondContact O-N 3.45Å; F92-L96 CarbonylContact O-C 3.55Å; F92-R97 WeakPolarHBondContact O-CA 3.18Å; F92-R97 PolarHBondContact O-N 3.21Å; F92-V98 PolarHBondContact O-N 2.97Å; F92-P100 HydrophobicContact CB-CB 4.42Å; F92-P100 HydrophobicContact CB-CG 4.33Å; F92-P100 HydrophobicContact CD1-CB 4.4Å; F92-P100 HydrophobicContact CD2-CB 3.78Å; F92-P100 HydrophobicContact CD2-CG 3.94Å; F92-P100 HydrophobicContact CE2-CB 4.08Å; F92-P100 HydrophobicContact CG-CB 3.96Å; F92-P100 HydrophobicContact CG-CG 4.26Å; F92-T105 HydrophobicContact CE1-CG2 4.29Å; F92-T105 HydrophobicContact CZ-CG2 4.12Å; F92-M125 HydrophobicContact CE2-CE 4.44Å; F92-M125 HydrophobicContact CE2-SD 4.4Å; F92-M125 HydrophobicContact CZ-CE 4.33Å; F92-M125 HydrophobicContact CZ-SD 4.25Å; F92-F129 AromaticContact CD2-CD1 3.8Å; F92-F129 HydrophobicContact CD2-CD1 3.8Å; F92-F129 AromaticContact CD2-CE1 3.92Å; F92-F129 HydrophobicContact CD2-CE1 3.92Å; F92-F129 HydrophobicContact CD2-CG 4.26Å; F92-F129 HydrophobicContact CD2-CZ 4.48Å; F92-F129 HydrophobicContact CE2-CB 4.49Å; F92-F129 AromaticContact CE2-CD1 3.94Å; F92-F129 HydrophobicContact CE2-CD1 3.94Å; F92-F129 HydrophobicContact CE2-CD2 4.15Å; F92-F129 HydrophobicContact CE2-CE1 4.18Å; F92-F129 HydrophobicContact CE2-CE2 4.39Å; F92-F129 AromaticContact CE2-CG 3.93Å; F92-F129 HydrophobicContact CE2-CG 3.93Å; F92-F129 HydrophobicContact CE2-CZ 4.4Å
93	Y	98.1	Very high	98	Very high	90 Å²	90	46 Å²	46	35%	0.353	21%	0.21	S	C	.	.	I	π-helix	trans	-91.5	-28.6	-167.5	-62.5	-73.7	0	0	0	114.3	H89 V98 P100 F129	H89-Y93 HydrophobicContact CB-CD2 4.43Å; H89-Y93 AromaticContact CD2-CD2 3.6Å; H89-Y93 AromaticContact CD2-CE2 3.71Å; H89-Y93 AromaticContact CE1-CD2 3.51Å; H89-Y93 AromaticContact CG-CD2 3.66Å; H89-Y93 AromaticContact ND1-CD2 3.62Å; H89-Y93 AromaticContact NE2-CD2 3.53Å; H89-Y93 AromaticContact NE2-CE2 3.84Å; H89-Y93 WeakPolarHBondContact O-CB 3.26Å; H89-Y93 WeakPolarHBondContact O-CD2 3.41Å; H89-Y93 PolarHBondContact O-N 3.32Å; Y93-V98 WeakPolarHBondContact CD1-O 2.86Å; Y93-P100 HydrophobicContact CE2-CG 4.25Å; Y93-P100 VanDerWaalsContact CZ-CD 3.41Å; Y93-P100 VanDerWaalsContact OH-CD 3.27Å; Y93-P100 WeakPolarHBondContact OH-CD 3.4Å; Y93-P100 WeakPolarHBondContact OH-CG 3.33Å; Y93-F129 HydrophobicContact CE2-CE1 4.45Å
94	N	97.2	Very high	98	Very high	76 Å²	76	46.9 Å²	46.9	41%	0.406	22%	0.216	S	C	.	.	I	π-helix	trans	-97.5	-49.2	-178.1	-63.8	100.2	0	0	0	112.3	H90 R97	H90-N94 WeakPolarHBondContact ND1-CB 3.28Å; H90-N94 PolarHBondContact ND1-OD1 3.22Å; H90-N94 WeakPolarHBondContact O-CA 3.5Å; H90-N94 VanDerWaalsContact O-CB 3.3Å; H90-N94 WeakPolarHBondContact O-CB 3.4Å; H90-N94 PolarHBondContact O-N 3.24Å; N94-R97 WeakPolarHBondContact O-CG 3.45Å
95	E	98.1	Very high	98	Very high	73 Å²	73	46.9 Å²	46.9	34%	0.341	22%	0.216	S	C	.	.	I	π-helix	trans	-81.3	-57.4	-174.7	-64.4	-57.9	127.1	0	0	111.4	A31 F33 H90	A31-E95 HydrophobicContact CB-CB 3.59Å; A31-E95 HydrophobicContact CB-CG 4.08Å; F33-E95 HydrophobicContact CD1-CG 3.84Å; F33-E95 HydrophobicContact CE1-CG 3.89Å; H90-E95 IonicContact CE1-OE1 2.74Å; H90-E95 PolarHBondContact CE1-OE1 2.81Å; H90-E95 IonicContact NE2-OE1 3.52Å; H90-E95 PolarHBondContact NE2-OE1 2.74Å; H90-E95 PolarHBondContact O-N 3.15Å
96	L	97.9	Very high	98	Very high	16 Å²	16	44.7 Å²	44.7	8%	0.084	21%	0.205	C	C	.	.	I	π-helix	trans	-82.2	-25.9	179.9	-61.7	-178.7	0	0	0	113.5	L10 A21 F23 R30 S91 F92 V98	L10-L96 HydrophobicContact CD1-CD1 4.22Å; L10-L96 HydrophobicContact CD2-CD1 3.97Å; A21-L96 HydrophobicContact CB-CD1 3.96Å; A21-L96 HydrophobicContact CB-CD2 4.38Å; A21-L96 HydrophobicContact CB-CG 4.2Å; F23-L96 HydrophobicContact CE2-CD2 4.21Å; R30-L96 HydrophobicContact CB-CD2 3.79Å; S91-L96 WeakPolarHBondContact O-CB 3.49Å; S91-L96 VanDerWaalsContact O-CG 3.29Å; S91-L96 WeakPolarHBondContact O-CG 3.24Å; S91-L96 PolarHBondContact O-N 3.13Å; F92-L96 CarbonylContact O-C 3.55Å; L96-V98 HydrophobicContact CB-CG2 3.92Å
97	R	98	Very high	98.1	Very high	208 Å²	208	41.8 Å²	41.8	79%	0.785	19%	0.193	S	C	*	.			trans	57.3	46	-178.9	-52.9	179.8	-175.1	178.9	2.3	113	F92 N94	F92-R97 WeakPolarHBondContact O-CA 3.18Å; F92-R97 PolarHBondContact O-N 3.21Å; N94-R97 WeakPolarHBondContact O-CG 3.45Å
98	V	97.8	Very high	98	Very high	25 Å²	25	41.9 Å²	41.9	15%	0.152	19%	0.193	C	C	.	.			trans	-124.1	160.6	178	-64.6	0	0	0	0	111.7	L10 F23 F92 Y93 L96	L10-V98 HydrophobicContact CD1-CG2 3.84Å; L10-V98 HydrophobicContact CD2-CG2 4.48Å; F23-V98 HydrophobicContact CE1-CG1 4.18Å; F23-V98 HydrophobicContact CZ-CG1 3.62Å; F92-V98 PolarHBondContact O-N 2.97Å; Y93-V98 WeakPolarHBondContact CD1-O 2.86Å; L96-V98 HydrophobicContact CB-CG2 3.92Å
99	A	97.7	Very high	97.9	Very high	22 Å²	22	42.1 Å²	42.1	18%	0.182	20%	0.195	C	C	.	.			trans	-88.6	112.7	169.7	0	0	0	0	0	108.9	E101 E102 H103	A99-E101 HydrophobicContact CB-CG 4.19Å; A99-E101 PolarHBondContact O-N 2.79Å; A99-E101 VanDerWaalsContact O-N 3.17Å; A99-E102 HydrophobicContact CB-CG 4.16Å; A99-E102 WeakPolarHBondContact O-CB 3.45Å; A99-E102 PolarHBondContact O-N 3Å; A99-H103 PolarHBondContact O-CD2 3.44Å
100	P	97.6	Very high	97.8	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-60.4	-25.3	-176.4	24.5	-33.4	0	0	0	113.6	F92 Y93 E102 H103 F129 V131	F92-P100 HydrophobicContact CB-CB 4.42Å; F92-P100 HydrophobicContact CB-CG 4.33Å; F92-P100 HydrophobicContact CD1-CB 4.4Å; F92-P100 HydrophobicContact CD2-CB 3.78Å; F92-P100 HydrophobicContact CD2-CG 3.94Å; F92-P100 HydrophobicContact CE2-CB 4.08Å; F92-P100 HydrophobicContact CG-CB 3.96Å; F92-P100 HydrophobicContact CG-CG 4.26Å; Y93-P100 HydrophobicContact CE2-CG 4.25Å; Y93-P100 VanDerWaalsContact CZ-CD 3.41Å; Y93-P100 VanDerWaalsContact OH-CD 3.27Å; Y93-P100 WeakPolarHBondContact OH-CD 3.4Å; Y93-P100 WeakPolarHBondContact OH-CG 3.33Å; P100-E102 PolarHBondContact O-N 2.78Å; P100-E102 VanDerWaalsContact O-N 3.17Å; P100-H103 PolarHBondContact O-N 2.96Å; P100-H103 VanDerWaalsContact O-N 3.11Å; P100-F129 HydrophobicContact CB-CB 4.18Å; P100-F129 HydrophobicContact CG-CB 4.06Å; P100-F129 HydrophobicContact CG-CD1 3.95Å; P100-F129 HydrophobicContact CG-CG 4.44Å; P100-V131 HydrophobicContact CB-CG1 4.17Å
101	E	97.8	Very high	97.6	Very high	95 Å²	95	37 Å²	37	44%	0.444	17%	0.171	S	C	.	.	G	3₁₀ helix	trans	-63	-15.1	173.6	60.3	-95.9	-139.2	0	0	114.3	A99 N130 P132	A99-E101 HydrophobicContact CB-CG 4.19Å; A99-E101 PolarHBondContact O-N 2.79Å; A99-E101 VanDerWaalsContact O-N 3.17Å; E101-N130 WeakPolarHBondContact CA-O 3.42Å; E101-N130 HydrophobicContact CB-CB 4.18Å; E101-P132 WeakPolarHBondContact O-CD 3.34Å
102	E	97.3	Very high	97.3	Very high	120 Å²	120	41.3 Å²	41.3	56%	0.561	19%	0.194	S	C	*	.	G	3₁₀ helix	trans	-93.5	-7.6	177	-62.5	179.7	176.8	0	0	112.5	S7 A99 P100	S7-E102 WeakPolarHBondContact CB-O 3.08Å; S7-E102 PolarHBondContact OG-O 3.13Å; A99-E102 HydrophobicContact CB-CG 4.16Å; A99-E102 WeakPolarHBondContact O-CB 3.45Å; A99-E102 PolarHBondContact O-N 3Å; P100-E102 PolarHBondContact O-N 2.78Å; P100-E102 VanDerWaalsContact O-N 3.17Å
103	H	97.6	Very high	97.1	Very high	22 Å²	22	41.9 Å²	41.9	10%	0.102	20%	0.197	C	C	.	.	S	Bend	trans	-133.8	126.4	-168.9	-61.6	-85	0	0	0	114.3	T8 L10 F23 A99 P100 T105 P132	T8-H103 PolarHBondContact O-ND1 3.31Å; L10-H103 HydrophobicContact CD1-CB 3.92Å; L10-H103 HydrophobicContact CD2-CB 4.49Å; L10-H103 HydrophobicContact CG-CB 3.72Å; F23-H103 AromaticContact CE1-CE1 3.94Å; A99-H103 PolarHBondContact O-CD2 3.44Å; P100-H103 PolarHBondContact O-N 2.96Å; P100-H103 VanDerWaalsContact O-N 3.11Å; H103-T105 PolarHBondContact O-N 2.86Å; H103-T105 PolarHBondContact O-OG1 3.31Å; H103-P132 WeakPolarHBondContact O-CD 2.98Å
104	P	97.9	Very high	97	Very high	18 Å²	18	40.5 Å²	40.5	12%	0.117	20%	0.199	C	C	.	.			trans	-53.3	139.5	163.9	-24.5	34	0	0	0	110.7	S7 A9 L10 P132 A133 W358	S7-P104 WeakPolarHBondContact OG-CD 3.21Å; A9-P104 CarbonylContact C-O 3.56Å; A9-P104 WeakPolarHBondContact CA-O 3.43Å; A9-P104 HydrophobicContact CB-CB 4.05Å; L10-P104 PolarHBondContact N-O 2.97Å; P104-P132 HydrophobicContact CG-CG 4.37Å; P104-A133 CarbonylContact C-O 3.48Å; P104-A133 VanDerWaalsContact CA-O 3.27Å; P104-A133 WeakPolarHBondContact CA-O 3.48Å; P104-A133 HydrophobicContact CB-CB 4.12Å; P104-A133 HydrophobicContact CG-CB 4.44Å; P104-W358 HydrophobicContact CB-CD2 4.37Å; P104-W358 HydrophobicContact CB-CE3 4.43Å; P104-W358 HydrophobicContact CB-CH2 4.11Å; P104-W358 HydrophobicContact CB-CZ2 4.03Å; P104-W358 HydrophobicContact CB-CZ3 4.32Å
105	T	98.5	Very high	97	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	117.9	-174.6	-63.4	0	0	0	0	112.1	F92 H103 L107 M125 A133 M134 Y135	F92-T105 HydrophobicContact CE1-CG2 4.29Å; F92-T105 HydrophobicContact CZ-CG2 4.12Å; H103-T105 PolarHBondContact O-N 2.86Å; H103-T105 PolarHBondContact O-OG1 3.31Å; T105-L107 HydrophobicContact CG2-CD1 4.32Å; T105-L107 HydrophobicContact CG2-CG 4.17Å; T105-M125 HydrophobicContact CG2-SD 4.37Å; T105-A133 PolarHBondContact N-O 2.61Å; T105-M134 WeakPolarHBondContact O-CA 3.32Å; T105-M134 VanDerWaalsContact O-CB 3.32Å; T105-M134 WeakPolarHBondContact O-CB 3.35Å; T105-Y135 PolarHBondContact O-N 3.05Å; T105-Y135 VanDerWaalsContact O-N 3.1Å
106	L	98.6	Very high	97	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	124.8	169.2	-172	151.1	0	0	0	109.7	L10 V11 C12 T108 Y135 A137 L142 L348 A349 F354 W358	L10-L106 PolarHBondContact O-N 3.13Å; V11-L106 WeakPolarHBondContact CA-O 3.49Å; V11-L106 HydrophobicContact CG1-CD2 4.16Å; V11-L106 HydrophobicContact CG2-CB 4.44Å; C12-L106 PolarHBondContact N-O 2.96Å; L106-T108 HydrophobicContact CD2-CG2 4.2Å; L106-Y135 WeakPolarHBondContact CA-O 3.49Å; L106-Y135 HydrophobicContact CD1-CD1 4.32Å; L106-A137 HydrophobicContact CD2-CB 4.4Å; L106-L142 HydrophobicContact CD2-CD1 4.04Å; L106-L348 HydrophobicContact CD1-CD2 4.16Å; L106-A349 HydrophobicContact CD1-CB 4.26Å; L106-F354 HydrophobicContact CD1-CE1 4.32Å; L106-F354 HydrophobicContact CD1-CZ 4.14Å; L106-W358 HydrophobicContact CB-CH2 3.87Å; L106-W358 HydrophobicContact CB-CZ3 4.15Å
107	L	98.5	Very high	97	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	148.8	174	-69.4	136.6	0	0	0	110.4	C12 N14 W88 T105 M125 M134 Y135 V136 A137	C12-L107 HydrophobicContact CB-CD2 3.87Å; C12-L107 HydrophobicContact CB-CG 4.49Å; N14-L107 WeakPolarHBondContact ND2-CD2 3.48Å; W88-L107 HydrophobicContact CZ2-CD2 3.93Å; T105-L107 HydrophobicContact CG2-CD1 4.32Å; T105-L107 HydrophobicContact CG2-CG 4.17Å; L107-M125 HydrophobicContact CD1-CE 3.7Å; L107-M125 HydrophobicContact CD1-CG 3.48Å; L107-M125 VanDerWaalsContact CD1-CG 3.48Å; L107-M125 HydrophobicContact CD1-SD 3.77Å; L107-M125 HydrophobicContact CD2-CE 3.62Å; L107-M125 HydrophobicContact CG-CE 4.23Å; L107-M134 HydrophobicContact CD1-CE 3.85Å; L107-Y135 PolarHBondContact N-O 3.41Å; L107-V136 CarbonylContact O-C 3.44Å; L107-V136 VanDerWaalsContact O-CA 3.31Å; L107-V136 WeakPolarHBondContact O-CA 3.37Å; L107-A137 PolarHBondContact O-N 2.84Å
108	T	97.9	Very high	97	Very high	2 Å²	2	34.7 Å²	34.7	1%	0.012	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	151	175.1	75.5	0	0	0	0	111.8	C12 D13 N14 L106 A137 Q139 L142 V341	C12-T108 PolarHBondContact O-N 2.93Å; C12-T108 VanDerWaalsContact O-N 3.11Å; D13-T108 VanDerWaalsContact CA-OG1 3.29Å; D13-T108 WeakPolarHBondContact CA-OG1 3.21Å; D13-T108 HydrophobicContact CB-CG2 4.13Å; D13-T108 PolarHBondContact OD1-OG1 3.23Å; D13-T108 VanDerWaalsContact OD1-OG1 3.11Å; N14-T108 PolarHBondContact N-OG1 3.31Å; N14-T108 PolarHBondContact ND2-O 2.92Å; L106-T108 HydrophobicContact CD2-CG2 4.2Å; T108-A137 CarbonylContact C-O 3.51Å; T108-A137 VanDerWaalsContact CA-O 3.29Å; T108-A137 WeakPolarHBondContact CA-O 3.46Å; T108-Q139 PolarHBondContact OG1-NE2 2.96Å; T108-L142 HydrophobicContact CG2-CD1 3.56Å; T108-V341 HydrophobicContact CG2-CG1 3.8Å
109	E	96.7	Very high	97	Very high	6 Å²	6	36.7 Å²	36.7	3%	0.028	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	153	169.8	66	168	-142	0	0	112.4	N113 R118 M121 V136 A137 I138 Q139 F377	E109-N113 HydrophobicContact CB-CB 4.3Å; E109-N113 HydrophobicContact CG-CB 4.4Å; E109-N113 WeakPolarHBondContact OE2-CB 3.48Å; E109-N113 PolarHBondContact OE2-ND2 2.95Å; E109-R118 IonicContact OE1-CZ 3.35Å; E109-R118 IonicContact OE1-NE 3.59Å; E109-R118 PolarHBondContact OE1-NE 2.88Å; E109-R118 IonicContact OE1-NH2 3.08Å; E109-R118 PolarHBondContact OE1-NH2 3.36Å; E109-R118 WeakPolarHBondContact OE2-CG 3.33Å; E109-R118 IonicContact OE2-NE 3.33Å; E109-R118 PolarHBondContact OE2-NE 3.15Å; E109-M121 HydrophobicContact CB-CE 4.4Å; E109-V136 HydrophobicContact CB-CG1 4.12Å; E109-V136 HydrophobicContact CG-CG1 3.76Å; E109-A137 PolarHBondContact N-O 3.37Å; E109-I138 WeakPolarHBondContact O-CA 3.44Å; E109-Q139 WeakPolarHBondContact O-CG 3.43Å; E109-Q139 PolarHBondContact O-N 3.15Å; E109-F377 VanDerWaalsContact CD-CZ 3.41Å; E109-F377 HydrophobicContact CG-CZ 4.2Å; E109-F377 WeakPolarHBondContact OE1-CE1 3.34Å; E109-F377 WeakPolarHBondContact OE1-CZ 2.95Å
110	A	95	Very high	97	Very high	2 Å²	2	38.7 Å²	38.7	2%	0.017	20%	0.198	C	C	.	.			trans	-64.8	151.9	164.6	0	0	0	0	0	110.3
111	P	94.7	Very high	97	Very high	1 Å²	1	38.9 Å²	38.9	1%	0.006	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	155.9	172.3	28.9	-37.2	0	0	0	111.4	N113 I138 H163 V165 I177	P111-N113 PolarHBondContact O-N 3.49Å; P111-I138 HydrophobicContact CB-CG2 4.18Å; P111-H163 HydrophobicContact CG-CB 3.91Å; P111-H163 VanDerWaalsContact CG-CD2 3.43Å; P111-H163 WeakPolarHBondContact CG-CD2 3.4Å; P111-H163 VanDerWaalsContact CG-CG 3.5Å; P111-V165 HydrophobicContact CB-CG2 4.18Å; P111-V165 HydrophobicContact CG-CG2 3.79Å; P111-I177 HydrophobicContact CB-CD1 3.77Å; P111-I177 HydrophobicContact CB-CG2 4.17Å; P111-I177 HydrophobicContact CG-CG2 4.22Å
112	L	92.4	Very high	97	Very high	92 Å²	92	34.3 Å²	34.3	48%	0.482	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	62	25.1	179.8	-48.2	174.9	0	0	0	114.2	I177	L112-I177 HydrophobicContact CD1-CB 4.48Å; L112-I177 HydrophobicContact CD1-CG2 4.09Å; L112-I177 HydrophobicContact CD2-CD1 4.3Å; L112-I177 HydrophobicContact CG-CG2 4.31Å
113	N	94.9	Very high	97.1	Very high	11 Å²	11	31.4 Å²	31.4	6%	0.059	16%	0.164	C	C	.	.			trans	-61.6	134.2	174.5	-166	24.6	0	0	0	111.1	E109 P111 N117 M121	E109-N113 HydrophobicContact CB-CB 4.3Å; E109-N113 HydrophobicContact CG-CB 4.4Å; E109-N113 WeakPolarHBondContact OE2-CB 3.48Å; E109-N113 PolarHBondContact OE2-ND2 2.95Å; P111-N113 PolarHBondContact O-N 3.49Å; N113-N117 WeakPolarHBondContact OD1-CB 3.18Å; N113-M121 WeakPolarHBondContact ND2-CE 3.42Å
114	P	95.9	Very high	97.1	Very high	61 Å²	61	30.4 Å²	30.4	40%	0.396	16%	0.16	S	C	.	.			trans	-56	141.7	177.7	-28.7	36.4	0	0	0	112.9	A116 N117 R118	P114-A116 VanDerWaalsContact C-N 3.26Å; P114-A116 PolarHBondContact O-N 2.99Å; P114-N117 HydrophobicContact CB-CB 4.37Å; P114-N117 WeakPolarHBondContact O-CB 3.37Å; P114-N117 PolarHBondContact O-N 3.28Å; P114-R118 PolarHBondContact O-N 3.34Å
115	K	96.6	Very high	97.2	Very high	137 Å²	137	29.5 Å²	29.5	60%	0.596	15%	0.154	S	C	*	.	H	α-helix	trans	-55.7	-41.6	177.8	-74.6	-170	174	-173.9	0	112.8	N117 R118 E119 H373	K115-N117 PolarHBondContact O-N 2.86Å; K115-R118 WeakPolarHBondContact O-CB 3.26Å; K115-R118 PolarHBondContact O-N 3.35Å; K115-R118 VanDerWaalsContact O-N 3.16Å; K115-E119 PolarHBondContact O-N 2.86Å; K115-H373 VanDerWaalsContact CB-CE1 3.48Å; K115-H373 WeakPolarHBondContact CB-CE1 3.47Å; K115-H373 PolarHBondContact O-CE1 3.11Å
116	A	97.6	Very high	97.2	Very high	64 Å²	64	29.5 Å²	29.5	53%	0.529	15%	0.154	S	C	.	.	H	α-helix	trans	-60.4	-33.7	176.8	0	0	0	0	0	112.5	P114 K120	P114-A116 VanDerWaalsContact C-N 3.26Å; P114-A116 PolarHBondContact O-N 2.99Å; A116-K120 WeakPolarHBondContact O-CB 3.35Å; A116-K120 PolarHBondContact O-N 3.17Å
117	N	97.7	Very high	97.2	Very high	23 Å²	23	34.1 Å²	34.1	12%	0.123	18%	0.176	C	C	.	.	H	α-helix	trans	-70.1	-40	176.9	-77.9	28.7	0	0	0	111.5	I77 I78 W81 N113 P114 K115 K120 M121	I77-N117 WeakPolarHBondContact CG2-ND2 3.06Å; I78-N117 PolarHBondContact O-ND2 2.88Å; I78-N117 VanDerWaalsContact O-ND2 3.12Å; W81-N117 HydrophobicContact CH2-CB 4.1Å; W81-N117 VanDerWaalsContact CH2-O 3.24Å; W81-N117 WeakPolarHBondContact CH2-O 3.34Å; W81-N117 HydrophobicContact CZ2-CB 3.82Å; N113-N117 WeakPolarHBondContact OD1-CB 3.18Å; P114-N117 HydrophobicContact CB-CB 4.37Å; P114-N117 WeakPolarHBondContact O-CB 3.37Å; P114-N117 PolarHBondContact O-N 3.28Å; K115-N117 PolarHBondContact O-N 2.86Å; N117-K120 PolarHBondContact O-N 3.2Å; N117-M121 WeakPolarHBondContact O-CG 3.26Å; N117-M121 PolarHBondContact O-N 2.96Å
118	R	97.7	Very high	97.2	Very high	28 Å²	28	37.5 Å²	37.5	11%	0.106	20%	0.196	C	C	.	.	H	α-helix	trans	-59.9	-48.2	173.6	-67.9	171.9	-178.7	164.6	-0.4	111.5	E109 P114 K115 K120 M121 T122 V372 F377	E109-R118 IonicContact OE1-CZ 3.35Å; E109-R118 IonicContact OE1-NE 3.59Å; E109-R118 PolarHBondContact OE1-NE 2.88Å; E109-R118 IonicContact OE1-NH2 3.08Å; E109-R118 PolarHBondContact OE1-NH2 3.36Å; E109-R118 WeakPolarHBondContact OE2-CG 3.33Å; E109-R118 IonicContact OE2-NE 3.33Å; E109-R118 PolarHBondContact OE2-NE 3.15Å; P114-R118 PolarHBondContact O-N 3.34Å; K115-R118 WeakPolarHBondContact O-CB 3.26Å; K115-R118 PolarHBondContact O-N 3.35Å; K115-R118 VanDerWaalsContact O-N 3.16Å; R118-K120 VanDerWaalsContact C-N 3.3Å; R118-K120 PolarHBondContact O-N 2.89Å; R118-M121 HydrophobicContact CB-CE 4.49Å; R118-M121 HydrophobicContact CG-CE 4.18Å; R118-M121 PolarHBondContact O-N 3.37Å; R118-T122 PolarHBondContact O-N 2.83Å; R118-T122 PolarHBondContact O-OG1 3.45Å; R118-T122 VanDerWaalsContact O-OG1 3.08Å; R118-V372 HydrophobicContact CB-CG1 3.77Å; R118-V372 HydrophobicContact CB-CG2 4.27Å; R118-F377 VanDerWaalsContact CD-CE2 3.48Å; R118-F377 HydrophobicContact CG-CE2 4.25Å
119	E	98.4	Very high	97.2	Very high	67 Å²	67	37.8 Å²	37.8	31%	0.313	20%	0.197	S	C	.	.	H	α-helix	trans	-58.9	-42.8	176	-71.6	173.4	-157.9	0	0	111.5	K115 T122 Q123 P369 V372 H373	K115-E119 PolarHBondContact O-N 2.86Å; E119-T122 WeakPolarHBondContact O-CB 3.41Å; E119-T122 PolarHBondContact O-N 3.1Å; E119-Q123 WeakPolarHBondContact O-CB 3.21Å; E119-Q123 PolarHBondContact O-N 3.47Å; E119-P369 HydrophobicContact CB-CB 3.74Å; E119-P369 HydrophobicContact CG-CB 4.07Å; E119-V372 HydrophobicContact CG-CG1 4.43Å; E119-H373 WeakPolarHBondContact CG-NE2 3.42Å; E119-H373 IonicContact OE1-CD2 3.67Å; E119-H373 IonicContact OE1-CE1 3.65Å; E119-H373 IonicContact OE1-NE2 2.72Å; E119-H373 PolarHBondContact OE1-NE2 2.65Å
120	K	98.3	Very high	97.3	Very high	64 Å²	64	41.7 Å²	41.7	28%	0.278	22%	0.218	S	C	.	.	H	α-helix	trans	-68.3	-38.5	179.9	-169.4	60.9	-177.4	172.3	0	112.9	W81 A116 N117 R118 T122 Q123 I124	W81-K120 HydrophobicContact CD2-CB 4.17Å; W81-K120 HydrophobicContact CD2-CG 3.39Å; W81-K120 HydrophobicContact CE3-CB 4.28Å; W81-K120 HydrophobicContact CE3-CG 3.65Å; W81-K120 HydrophobicContact CG-CG 3.86Å; W81-K120 HydrophobicContact CH2-CB 3.85Å; W81-K120 HydrophobicContact CH2-CG 4.13Å; W81-K120 HydrophobicContact CZ2-CB 3.72Å; W81-K120 HydrophobicContact CZ2-CG 3.91Å; W81-K120 HydrophobicContact CZ3-CB 4.1Å; W81-K120 HydrophobicContact CZ3-CG 3.97Å; A116-K120 WeakPolarHBondContact O-CB 3.35Å; A116-K120 PolarHBondContact O-N 3.17Å; N117-K120 PolarHBondContact O-N 3.2Å; R118-K120 VanDerWaalsContact C-N 3.3Å; R118-K120 PolarHBondContact O-N 2.89Å; K120-T122 VanDerWaalsContact C-N 3.31Å; K120-T122 PolarHBondContact O-N 3.28Å; K120-Q123 PolarHBondContact O-N 2.9Å; K120-I124 HydrophobicContact CD-CD1 4.34Å; K120-I124 HydrophobicContact CD-CG1 4.5Å; K120-I124 HydrophobicContact CG-CD1 4.03Å; K120-I124 WeakPolarHBondContact O-CD1 3.35Å; K120-I124 VanDerWaalsContact O-CG1 3.3Å; K120-I124 WeakPolarHBondContact O-CG1 2.97Å; K120-I124 PolarHBondContact O-N 3.4Å
121	M	97.7	Very high	97.4	Very high	3 Å²	3	41.6 Å²	41.6	2%	0.015	22%	0.217	C	C	.	.	H	α-helix	trans	-57.6	-47.4	169.8	-71.2	-171.6	-69.2	0	0	110.7	I78 W81 W88 E109 N113 N117 R118 I124 M125 V136	I78-M121 HydrophobicContact CD1-CG 4.18Å; I78-M121 HydrophobicContact CD1-SD 4.11Å; W81-M121 HydrophobicContact CH2-CG 3.68Å; W81-M121 HydrophobicContact CZ3-CB 4.48Å; W81-M121 HydrophobicContact CZ3-CG 3.64Å; W88-M121 HydrophobicContact CH2-CG 4Å; W88-M121 HydrophobicContact CZ2-CG 4.45Å; E109-M121 HydrophobicContact CB-CE 4.4Å; N113-M121 WeakPolarHBondContact ND2-CE 3.42Å; N117-M121 WeakPolarHBondContact O-CG 3.26Å; N117-M121 PolarHBondContact O-N 2.96Å; R118-M121 HydrophobicContact CB-CE 4.49Å; R118-M121 HydrophobicContact CG-CE 4.18Å; R118-M121 PolarHBondContact O-N 3.37Å; M121-I124 PolarHBondContact O-N 3.26Å; M121-M125 VanDerWaalsContact O-CG 3.29Å; M121-M125 WeakPolarHBondContact O-CG 3.12Å; M121-M125 PolarHBondContact O-N 3.01Å; M121-M125 VanDerWaalsContact O-N 3.08Å; M121-V136 HydrophobicContact CE-CG1 3.87Å; M121-V136 HydrophobicContact CE-CG2 4.35Å
122	T	98.2	Very high	97.6	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-61.3	-46.5	179.9	-60.8	0	0	0	0	112.3	R118 E119 K120 I124 M125 F126 M134 Y364 I371 V372	R118-T122 PolarHBondContact O-N 2.83Å; R118-T122 PolarHBondContact O-OG1 3.45Å; R118-T122 VanDerWaalsContact O-OG1 3.08Å; E119-T122 WeakPolarHBondContact O-CB 3.41Å; E119-T122 PolarHBondContact O-N 3.1Å; K120-T122 VanDerWaalsContact C-N 3.31Å; K120-T122 PolarHBondContact O-N 3.28Å; T122-I124 PolarHBondContact O-N 2.84Å; T122-M125 PolarHBondContact O-N 3.45Å; T122-F126 HydrophobicContact CG2-CD2 3.79Å; T122-F126 HydrophobicContact CG2-CE2 3.91Å; T122-F126 WeakPolarHBondContact O-CD2 3.13Å; T122-F126 PolarHBondContact O-N 3.43Å; T122-M134 VanDerWaalsContact CA-SD 3.54Å; T122-M134 HydrophobicContact CG2-SD 3.92Å; T122-Y364 HydrophobicContact CG2-CD2 3.71Å; T122-Y364 HydrophobicContact CG2-CE2 3.9Å; T122-I371 HydrophobicContact CG2-CG2 4.33Å; T122-V372 WeakPolarHBondContact OG1-CB 3.38Å
123	Q	98.4	Very high	97.8	Very high	58 Å²	58	40 Å²	40	27%	0.271	21%	0.214	S	C	.	.	H	α-helix	trans	-57.2	-51.6	176.9	-171.3	-168.9	-2.8	0	0	111.4	E119 K120 M125 F126 E127 P369	E119-Q123 WeakPolarHBondContact O-CB 3.21Å; E119-Q123 PolarHBondContact O-N 3.47Å; K120-Q123 PolarHBondContact O-N 2.9Å; Q123-M125 PolarHBondContact O-N 3.31Å; Q123-F126 PolarHBondContact O-N 3.32Å; Q123-E127 HydrophobicContact CG-CG 4.14Å; Q123-E127 WeakPolarHBondContact CG-OE2 3.39Å; Q123-E127 PolarHBondContact NE2-OE2 2.78Å; Q123-E127 VanDerWaalsContact O-CB 3.23Å; Q123-E127 WeakPolarHBondContact O-CB 3.42Å; Q123-E127 WeakPolarHBondContact O-CG 3.24Å; Q123-E127 PolarHBondContact O-N 3.13Å; Q123-P369 HydrophobicContact CB-CG 4.15Å
124	I	98.6	Very high	98	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.005	21%	0.211	C	C	.	.	H	α-helix	trans	-61.8	-44.1	-176.5	-71.1	166.4	0	0	0	111.3	W81 E85 W88 K120 M121 T122 F126 T128 F129	W81-I124 HydrophobicContact CB-CD1 4.37Å; W81-I124 HydrophobicContact CD2-CD1 4.26Å; W81-I124 HydrophobicContact CE3-CD1 3.49Å; W81-I124 VanDerWaalsContact CE3-CD1 3.49Å; W81-I124 HydrophobicContact CZ3-CD1 4.16Å; E85-I124 HydrophobicContact CG-CD1 3.89Å; E85-I124 HydrophobicContact CG-CG1 4.25Å; E85-I124 HydrophobicContact CG-CG2 3.67Å; E85-I124 WeakPolarHBondContact OE1-CD1 3.3Å; E85-I124 WeakPolarHBondContact OE1-CG1 3.41Å; W88-I124 HydrophobicContact CE3-CG2 3.9Å; W88-I124 HydrophobicContact CZ3-CB 4.27Å; W88-I124 HydrophobicContact CZ3-CD1 4Å; W88-I124 HydrophobicContact CZ3-CG2 3.77Å; K120-I124 HydrophobicContact CD-CD1 4.34Å; K120-I124 HydrophobicContact CD-CG1 4.5Å; K120-I124 HydrophobicContact CG-CD1 4.03Å; K120-I124 WeakPolarHBondContact O-CD1 3.35Å; K120-I124 VanDerWaalsContact O-CG1 3.3Å; K120-I124 WeakPolarHBondContact O-CG1 2.97Å; K120-I124 PolarHBondContact O-N 3.4Å; M121-I124 PolarHBondContact O-N 3.26Å; T122-I124 PolarHBondContact O-N 2.84Å; I124-F126 VanDerWaalsContact C-N 3.35Å; I124-F126 PolarHBondContact O-N 2.93Å; I124-T128 WeakPolarHBondContact O-CA 3.44Å; I124-T128 WeakPolarHBondContact O-CB 3.27Å; I124-T128 PolarHBondContact O-N 2.62Å; I124-F129 HydrophobicContact CG2-CD2 3.81Å; I124-F129 HydrophobicContact CG2-CE2 3.65Å; I124-F129 PolarHBondContact O-N 3.14Å; I124-F129 VanDerWaalsContact O-N 3.11Å
125	M	98.6	Very high	98.1	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-62.9	-42.6	-178.4	-72.2	-68.4	154.9	0	0	112.1	W88 F92 T105 L107 M121 T122 Q123 F129 N130 V131 M134	W88-M125 HydrophobicContact CB-CE 4.29Å; W88-M125 HydrophobicContact CD2-CE 3.32Å; W88-M125 HydrophobicContact CE3-CE 3.55Å; W88-M125 HydrophobicContact CG-CE 3.69Å; W88-M125 HydrophobicContact CH2-CE 4.21Å; W88-M125 HydrophobicContact CZ2-CE 4.03Å; W88-M125 HydrophobicContact CZ3-CE 3.99Å; F92-M125 HydrophobicContact CE2-CE 4.44Å; F92-M125 HydrophobicContact CE2-SD 4.4Å; F92-M125 HydrophobicContact CZ-CE 4.33Å; F92-M125 HydrophobicContact CZ-SD 4.25Å; T105-M125 HydrophobicContact CG2-SD 4.37Å; L107-M125 HydrophobicContact CD1-CE 3.7Å; L107-M125 HydrophobicContact CD1-CG 3.48Å; L107-M125 VanDerWaalsContact CD1-CG 3.48Å; L107-M125 HydrophobicContact CD1-SD 3.77Å; L107-M125 HydrophobicContact CD2-CE 3.62Å; L107-M125 HydrophobicContact CG-CE 4.23Å; M121-M125 VanDerWaalsContact O-CG 3.29Å; M121-M125 WeakPolarHBondContact O-CG 3.12Å; M121-M125 PolarHBondContact O-N 3.01Å; M121-M125 VanDerWaalsContact O-N 3.08Å; T122-M125 PolarHBondContact O-N 3.45Å; Q123-M125 PolarHBondContact O-N 3.31Å; M125-F129 HydrophobicContact CE-CD2 4.26Å; M125-F129 HydrophobicContact CE-CE2 4.48Å; M125-F129 CarbonylContact O-C 3.53Å; M125-F129 HydrophobicContact SD-CD2 4.12Å; M125-N130 PolarHBondContact O-N 2.98Å; M125-V131 HydrophobicContact CB-CG2 3.85Å; M125-V131 WeakPolarHBondContact O-CG2 3.28Å; M125-V131 PolarHBondContact O-N 3.44Å; M125-V131 HydrophobicContact SD-CG1 4.32Å; M125-M134 HydrophobicContact CB-CE 4.41Å; M125-M134 HydrophobicContact CB-SD 3.64Å; M125-M134 HydrophobicContact CG-CE 4.32Å; M125-M134 HydrophobicContact CG-SD 4.18Å
126	F	98.6	Very high	98.2	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-83.4	-33.1	-179.4	-76.7	-58.9	0	0	0	114.9	T122 Q123 I124 N130 V131 M134 I359 K361 Y364	T122-F126 HydrophobicContact CG2-CD2 3.79Å; T122-F126 HydrophobicContact CG2-CE2 3.91Å; T122-F126 WeakPolarHBondContact O-CD2 3.13Å; T122-F126 PolarHBondContact O-N 3.43Å; Q123-F126 PolarHBondContact O-N 3.32Å; I124-F126 VanDerWaalsContact C-N 3.35Å; I124-F126 PolarHBondContact O-N 2.93Å; F126-N130 WeakPolarHBondContact O-CA 3.36Å; F126-N130 PolarHBondContact O-OD1 2.87Å; F126-V131 HydrophobicContact CD1-CG2 4Å; F126-V131 VanDerWaalsContact CD1-O 3.23Å; F126-V131 WeakPolarHBondContact CD1-O 3.36Å; F126-V131 HydrophobicContact CE1-CG2 4.1Å; F126-V131 WeakPolarHBondContact CE1-O 3.38Å; F126-M134 HydrophobicContact CD2-CG 4.28Å; F126-M134 HydrophobicContact CD2-SD 3.91Å; F126-M134 HydrophobicContact CE1-CG 4.5Å; F126-M134 HydrophobicContact CE2-CG 3.48Å; F126-M134 VanDerWaalsContact CE2-CG 3.48Å; F126-M134 HydrophobicContact CE2-SD 3.66Å; F126-M134 HydrophobicContact CZ-CB 4.45Å; F126-M134 HydrophobicContact CZ-CG 3.64Å; F126-M134 HydrophobicContact CZ-SD 4.34Å; F126-I359 HydrophobicContact CE2-CB 4.49Å; F126-I359 HydrophobicContact CE2-CG2 3.83Å; F126-I359 HydrophobicContact CZ-CB 4.33Å; F126-I359 HydrophobicContact CZ-CG2 3.87Å; F126-I359 WeakPolarHBondContact CZ-O 3.4Å; F126-K361 HydrophobicContact CB-CD 4.23Å; F126-K361 HydrophobicContact CD1-CB 4.22Å; F126-K361 HydrophobicContact CD1-CD 3.51Å; F126-K361 HydrophobicContact CD1-CG 4.48Å; F126-K361 HydrophobicContact CE1-CB 4.04Å; F126-K361 HydrophobicContact CE1-CD 4.2Å; F126-K361 HydrophobicContact CG-CD 4.19Å; F126-K361 PolarHBondContact O-NZ 3.41Å; F126-Y364 HydrophobicContact CB-CD1 3.6Å; F126-Y364 HydrophobicContact CB-CD2 4.26Å; F126-Y364 HydrophobicContact CB-CE1 3.69Å; F126-Y364 HydrophobicContact CB-CE2 4.3Å; F126-Y364 HydrophobicContact CB-CG 3.9Å; F126-Y364 HydrophobicContact CD1-CG 4.45Å; F126-Y364 AromaticContact CD2-CD1 3.95Å; F126-Y364 HydrophobicContact CD2-CD1 3.95Å; F126-Y364 AromaticContact CD2-CD2 3.33Å; F126-Y364 HydrophobicContact CD2-CD2 3.33Å; F126-Y364 AromaticContact CD2-CE2 3.97Å; F126-Y364 HydrophobicContact CD2-CE2 3.97Å; F126-Y364 AromaticContact CD2-CG 3.3Å; F126-Y364 HydrophobicContact CD2-CG 3.3Å; F126-Y364 AromaticContact CE2-CD2 3.89Å; F126-Y364 HydrophobicContact CE2-CD2 3.89Å; F126-Y364 AromaticContact CE2-CG 3.82Å; F126-Y364 HydrophobicContact CE2-CG 3.82Å; F126-Y364 AromaticContact CG-CD1 3.83Å; F126-Y364 HydrophobicContact CG-CD1 3.83Å; F126-Y364 HydrophobicContact CG-CD2 4.06Å; F126-Y364 HydrophobicContact CG-CE1 4.37Å; F126-Y364 AromaticContact CG-CG 3.65Å; F126-Y364 HydrophobicContact CG-CG 3.65Å
127	E	98.5	Very high	98.2	Very high	97 Å²	97	28.6 Å²	28.6	45%	0.453	15%	0.146	S	C	.	.	H	α-helix	trans	-94.7	-39.7	-174.9	-64	-177.8	-177.6	0	0	112.7	Q123 Y364	Q123-E127 HydrophobicContact CG-CG 4.14Å; Q123-E127 WeakPolarHBondContact CG-OE2 3.39Å; Q123-E127 PolarHBondContact NE2-OE2 2.78Å; Q123-E127 VanDerWaalsContact O-CB 3.23Å; Q123-E127 WeakPolarHBondContact O-CB 3.42Å; Q123-E127 WeakPolarHBondContact O-CG 3.24Å; Q123-E127 PolarHBondContact O-N 3.13Å; E127-Y364 VanDerWaalsContact CD-OH 3.28Å; E127-Y364 HydrophobicContact CG-CE1 4.09Å; E127-Y364 WeakPolarHBondContact CG-OH 3.48Å; E127-Y364 PolarHBondContact OE1-OH 3.02Å
128	T	98.3	Very high	98.1	Very high	70 Å²	70	28.7 Å²	28.7	43%	0.429	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-50	-179.3	-53.9	0	0	0	0	110.9	I124	I124-T128 WeakPolarHBondContact O-CA 3.44Å; I124-T128 WeakPolarHBondContact O-CB 3.27Å; I124-T128 PolarHBondContact O-N 2.62Å
129	F	98.5	Very high	98.2	Very high	8 Å²	8	28.2 Å²	28.2	4%	0.035	15%	0.145	C	C	.	.	S	Bend	trans	-93.4	-7.5	-176.3	-65.6	-67.8	0	0	0	114.3	W88 H89 F92 Y93 P100 I124 M125 V131	W88-F129 HydrophobicContact CB-CE2 3.73Å; W88-F129 HydrophobicContact CB-CZ 3.68Å; W88-F129 HydrophobicContact CE3-CE2 4.06Å; H89-F129 HydrophobicContact CB-CE1 4.04Å; H89-F129 HydrophobicContact CB-CZ 4.21Å; F92-F129 AromaticContact CD2-CD1 3.8Å; F92-F129 HydrophobicContact CD2-CD1 3.8Å; F92-F129 AromaticContact CD2-CE1 3.92Å; F92-F129 HydrophobicContact CD2-CE1 3.92Å; F92-F129 HydrophobicContact CD2-CG 4.26Å; F92-F129 HydrophobicContact CD2-CZ 4.48Å; F92-F129 HydrophobicContact CE2-CB 4.49Å; F92-F129 AromaticContact CE2-CD1 3.94Å; F92-F129 HydrophobicContact CE2-CD1 3.94Å; F92-F129 HydrophobicContact CE2-CD2 4.15Å; F92-F129 HydrophobicContact CE2-CE1 4.18Å; F92-F129 HydrophobicContact CE2-CE2 4.39Å; F92-F129 AromaticContact CE2-CG 3.93Å; F92-F129 HydrophobicContact CE2-CG 3.93Å; F92-F129 HydrophobicContact CE2-CZ 4.4Å; Y93-F129 HydrophobicContact CE2-CE1 4.45Å; P100-F129 HydrophobicContact CB-CB 4.18Å; P100-F129 HydrophobicContact CG-CB 4.06Å; P100-F129 HydrophobicContact CG-CD1 3.95Å; P100-F129 HydrophobicContact CG-CG 4.44Å; I124-F129 HydrophobicContact CG2-CD2 3.81Å; I124-F129 HydrophobicContact CG2-CE2 3.65Å; I124-F129 PolarHBondContact O-N 3.14Å; I124-F129 VanDerWaalsContact O-N 3.11Å; M125-F129 HydrophobicContact CE-CD2 4.26Å; M125-F129 HydrophobicContact CE-CE2 4.48Å; M125-F129 CarbonylContact O-C 3.53Å; M125-F129 HydrophobicContact SD-CD2 4.12Å; F129-V131 HydrophobicContact CB-CG1 4.1Å; F129-V131 PolarHBondContact O-N 3.43Å; F129-V131 VanDerWaalsContact O-N 3.11Å
130	N	98.2	Very high	98.1	Very high	88 Å²	88	25 Å²	25	47%	0.471	13%	0.131	S	C	.	.			trans	51	33.9	178.2	-61.1	-67.5	0	0	0	114.2	E101 M125 F126	E101-N130 WeakPolarHBondContact CA-O 3.42Å; E101-N130 HydrophobicContact CB-CB 4.18Å; M125-N130 PolarHBondContact O-N 2.98Å; F126-N130 WeakPolarHBondContact O-CA 3.36Å; F126-N130 PolarHBondContact O-OD1 2.87Å
131	V	98.4	Very high	98.1	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.122	C	C	.	.			trans	-59.4	140.3	179.7	-56.3	0	0	0	0	110.1	P100 M125 F126 F129 A133 M134	P100-V131 HydrophobicContact CB-CG1 4.17Å; M125-V131 HydrophobicContact CB-CG2 3.85Å; M125-V131 WeakPolarHBondContact O-CG2 3.28Å; M125-V131 PolarHBondContact O-N 3.44Å; M125-V131 HydrophobicContact SD-CG1 4.32Å; F126-V131 HydrophobicContact CD1-CG2 4Å; F126-V131 VanDerWaalsContact CD1-O 3.23Å; F126-V131 WeakPolarHBondContact CD1-O 3.36Å; F126-V131 HydrophobicContact CE1-CG2 4.1Å; F126-V131 WeakPolarHBondContact CE1-O 3.38Å; F129-V131 HydrophobicContact CB-CG1 4.1Å; F129-V131 PolarHBondContact O-N 3.43Å; F129-V131 VanDerWaalsContact O-N 3.11Å; V131-A133 VanDerWaalsContact C-N 3.26Å; V131-A133 PolarHBondContact O-N 2.94Å; V131-M134 HydrophobicContact CG2-CB 4.06Å
132	P	97.8	Very high	98.1	Very high	48 Å²	48	22.6 Å²	22.6	31%	0.312	12%	0.121	S	C	.	.	S	Bend	trans	-69.8	-29.4	-177.8	27.4	-34.4	0	0	0	111.9	E101 H103 P104 K361	E101-P132 WeakPolarHBondContact O-CD 3.34Å; H103-P132 WeakPolarHBondContact O-CD 2.98Å; P104-P132 HydrophobicContact CG-CG 4.37Å; P132-K361 PolarHBondContact O-N 2.54Å
133	A	98	Very high	98.1	Very high	12 Å²	12	22.6 Å²	22.6	10%	0.099	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	157	176.5	0	0	0	0	0	111	P104 T105 V131 W358 I359	P104-A133 CarbonylContact C-O 3.48Å; P104-A133 VanDerWaalsContact CA-O 3.27Å; P104-A133 WeakPolarHBondContact CA-O 3.48Å; P104-A133 HydrophobicContact CB-CB 4.12Å; P104-A133 HydrophobicContact CG-CB 4.44Å; T105-A133 PolarHBondContact N-O 2.61Å; V131-A133 VanDerWaalsContact C-N 3.26Å; V131-A133 PolarHBondContact O-N 2.94Å; A133-W358 HydrophobicContact CB-CB 4.08Å; A133-W358 HydrophobicContact CB-CG 4.38Å; A133-I359 CarbonylContact C-O 3.35Å; A133-I359 WeakPolarHBondContact CA-O 3.12Å; A133-I359 WeakPolarHBondContact CB-O 3.49Å
134	M	98	Very high	98.1	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	164.2	174.8	70.8	170.2	-74	0	0	113.8	T105 L107 T122 M125 F126 V131 V136 I359	T105-M134 WeakPolarHBondContact O-CA 3.32Å; T105-M134 VanDerWaalsContact O-CB 3.32Å; T105-M134 WeakPolarHBondContact O-CB 3.35Å; L107-M134 HydrophobicContact CD1-CE 3.85Å; T122-M134 VanDerWaalsContact CA-SD 3.54Å; T122-M134 HydrophobicContact CG2-SD 3.92Å; M125-M134 HydrophobicContact CB-CE 4.41Å; M125-M134 HydrophobicContact CB-SD 3.64Å; M125-M134 HydrophobicContact CG-CE 4.32Å; M125-M134 HydrophobicContact CG-SD 4.18Å; F126-M134 HydrophobicContact CD2-CG 4.28Å; F126-M134 HydrophobicContact CD2-SD 3.91Å; F126-M134 HydrophobicContact CE1-CG 4.5Å; F126-M134 HydrophobicContact CE2-CG 3.48Å; F126-M134 VanDerWaalsContact CE2-CG 3.48Å; F126-M134 HydrophobicContact CE2-SD 3.66Å; F126-M134 HydrophobicContact CZ-CB 4.45Å; F126-M134 HydrophobicContact CZ-CG 3.64Å; F126-M134 HydrophobicContact CZ-SD 4.34Å; V131-M134 HydrophobicContact CG2-CB 4.06Å; M134-V136 HydrophobicContact CE-CG2 3.61Å; M134-I359 HydrophobicContact CG-CB 4.48Å; M134-I359 PolarHBondContact N-O 3.45Å; M134-I359 WeakPolarHBondContact O-CB 3.39Å; M134-I359 PolarHBondContact O-N 2.87Å
135	Y	98.3	Very high	98	Very high	27 Å²	27	22.7 Å²	22.7	11%	0.106	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	148.1	173.1	-167.9	-96	0	0	0	110	T105 L106 L107 A137 F354 M357 C376	T105-Y135 PolarHBondContact O-N 3.05Å; T105-Y135 VanDerWaalsContact O-N 3.1Å; L106-Y135 WeakPolarHBondContact CA-O 3.49Å; L106-Y135 HydrophobicContact CD1-CD1 4.32Å; L107-Y135 PolarHBondContact N-O 3.41Å; Y135-A137 HydrophobicContact CD1-CB 4.07Å; Y135-A137 HydrophobicContact CE1-CB 3.91Å; Y135-F354 HydrophobicContact CD1-CE2 4.09Å; Y135-F354 AromaticContact CD1-CZ 3.59Å; Y135-F354 HydrophobicContact CD1-CZ 3.59Å; Y135-F354 HydrophobicContact CD2-CE2 4.26Å; Y135-F354 AromaticContact CD2-CZ 3.9Å; Y135-F354 HydrophobicContact CD2-CZ 3.9Å; Y135-F354 HydrophobicContact CE1-CE2 4.01Å; Y135-F354 HydrophobicContact CE1-CZ 4Å; Y135-F354 HydrophobicContact CE2-CE2 4.2Å; Y135-F354 HydrophobicContact CE2-CZ 4.29Å; Y135-F354 HydrophobicContact CG-CE1 4.49Å; Y135-F354 HydrophobicContact CG-CE2 4.21Å; Y135-F354 AromaticContact CG-CZ 3.53Å; Y135-F354 HydrophobicContact CG-CZ 3.53Å; Y135-M357 HydrophobicContact CD2-CB 4.44Å; Y135-M357 WeakPolarHBondContact CD2-O 3.15Å; Y135-M357 HydrophobicContact CE2-CB 4.12Å; Y135-C376 WeakPolarHBondContact CD2-SG 3.22Å; Y135-C376 HydrophobicContact CE2-CB 4.17Å; Y135-C376 VanDerWaalsContact CE2-SG 3.52Å
136	V	98	Very high	97.9	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	125	174	-176	0	0	0	0	108.9	L107 E109 M121 M134 V372 C376 F377	L107-V136 CarbonylContact O-C 3.44Å; L107-V136 VanDerWaalsContact O-CA 3.31Å; L107-V136 WeakPolarHBondContact O-CA 3.37Å; E109-V136 HydrophobicContact CB-CG1 4.12Å; E109-V136 HydrophobicContact CG-CG1 3.76Å; M121-V136 HydrophobicContact CE-CG1 3.87Å; M121-V136 HydrophobicContact CE-CG2 4.35Å; M134-V136 HydrophobicContact CE-CG2 3.61Å; V136-V372 HydrophobicContact CB-CG2 4.37Å; V136-V372 HydrophobicContact CG2-CG2 4.08Å; V136-C376 PolarHBondContact N-SG 2.85Å; V136-C376 WeakPolarHBondContact O-CB 3.29Å; V136-F377 HydrophobicContact CB-CE2 4.31Å; V136-F377 HydrophobicContact CB-CZ 4.36Å; V136-F377 HydrophobicContact CG1-CE2 4.34Å; V136-F377 HydrophobicContact CG1-CZ 4.03Å
137	A	97.4	Very high	97.8	Very high	7 Å²	7	24.9 Å²	24.9	6%	0.058	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	148.5	-179.3	0	0	0	0	0	112.6	L106 L107 T108 E109 Y135 Q139 L142	L106-A137 HydrophobicContact CD2-CB 4.4Å; L107-A137 PolarHBondContact O-N 2.84Å; T108-A137 CarbonylContact C-O 3.51Å; T108-A137 VanDerWaalsContact CA-O 3.29Å; T108-A137 WeakPolarHBondContact CA-O 3.46Å; E109-A137 PolarHBondContact N-O 3.37Å; Y135-A137 HydrophobicContact CD1-CB 4.07Å; Y135-A137 HydrophobicContact CE1-CB 3.91Å; A137-Q139 PolarHBondContact O-N 3.07Å; A137-L142 HydrophobicContact CB-CD1 3.92Å; A137-L142 HydrophobicContact CB-CD2 3.78Å; A137-L142 HydrophobicContact CB-CG 3.9Å
138	I	97.2	Very high	97.6	Very high	24 Å²	24	23.7 Å²	23.7	12%	0.123	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	127.8	177	-57.9	177.5	0	0	0	109.5	E109 P111 A140 V141 L142 A172 F377	E109-I138 WeakPolarHBondContact O-CA 3.44Å; P111-I138 HydrophobicContact CB-CG2 4.18Å; I138-A140 VanDerWaalsContact C-N 3.28Å; I138-A140 HydrophobicContact CG2-CB 4.27Å; I138-A140 PolarHBondContact O-N 2.69Å; I138-V141 HydrophobicContact CB-CB 4.29Å; I138-V141 HydrophobicContact CB-CG2 3.94Å; I138-V141 HydrophobicContact CG2-CG2 4.32Å; I138-V141 WeakPolarHBondContact O-CB 3.34Å; I138-V141 PolarHBondContact O-N 2.66Å; I138-L142 PolarHBondContact O-N 3.17Å; I138-L142 VanDerWaalsContact O-N 3.14Å; I138-A172 HydrophobicContact CD1-CB 4.05Å; I138-F377 HydrophobicContact CD1-CD1 4.46Å; I138-F377 HydrophobicContact CD1-CE1 4.12Å; I138-F377 HydrophobicContact CG1-CE1 3.78Å
139	Q	98.2	Very high	97.5	Very high	18 Å²	18	23.5 Å²	23.5	8%	0.084	14%	0.142	C	C	.	.	H	α-helix	trans	-51.6	-43.7	-178.4	-72.2	175.6	-40	0	0	113.4	D13 N14 T108 E109 A137 L142 S143 V341	D13-Q139 PolarHBondContact OD1-NE2 3.38Å; N14-Q139 PolarHBondContact O-NE2 2.95Å; T108-Q139 PolarHBondContact OG1-NE2 2.96Å; E109-Q139 WeakPolarHBondContact O-CG 3.43Å; E109-Q139 PolarHBondContact O-N 3.15Å; A137-Q139 PolarHBondContact O-N 3.07Å; Q139-L142 PolarHBondContact O-N 3.15Å; Q139-S143 WeakPolarHBondContact O-CB 3.48Å; Q139-S143 PolarHBondContact O-N 3.17Å; Q139-S143 PolarHBondContact O-OG 3.36Å; Q139-V341 HydrophobicContact CB-CG1 3.92Å; Q139-V341 HydrophobicContact CB-CG2 3.88Å; Q139-V341 HydrophobicContact CG-CG1 3.73Å; Q139-V341 HydrophobicContact CG-CG2 4.38Å
140	A	97.8	Very high	97.4	Very high	1 Å²	1	27 Å²	27	1%	0.008	16%	0.164	C	C	.	.	H	α-helix	trans	-64.8	-39.3	177.8	0	0	0	0	0	113	I138 S143 L144 V154 V165	I138-A140 VanDerWaalsContact C-N 3.28Å; I138-A140 HydrophobicContact CG2-CB 4.27Å; I138-A140 PolarHBondContact O-N 2.69Å; A140-S143 WeakPolarHBondContact O-CB 3.28Å; A140-S143 PolarHBondContact O-N 3.16Å; A140-L144 PolarHBondContact O-N 2.65Å; A140-V154 HydrophobicContact CB-CB 4.02Å; A140-V154 HydrophobicContact CB-CG1 4.05Å; A140-V154 WeakPolarHBondContact O-CG2 3.37Å; A140-V165 HydrophobicContact CB-CB 3.53Å; A140-V165 HydrophobicContact CB-CG1 3.96Å; A140-V165 HydrophobicContact CB-CG2 3.49Å; A140-V165 VanDerWaalsContact CB-CG2 3.49Å
141	V	97.6	Very high	97.4	Very high	15 Å²	15	23.8 Å²	23.8	9%	0.091	15%	0.148	C	C	.	.	H	α-helix	trans	-63.8	-45.2	177.6	175.9	0	0	0	0	110.3	I138 S143 L144 Y145 I167 A172	I138-V141 HydrophobicContact CB-CB 4.29Å; I138-V141 HydrophobicContact CB-CG2 3.94Å; I138-V141 HydrophobicContact CG2-CG2 4.32Å; I138-V141 WeakPolarHBondContact O-CB 3.34Å; I138-V141 PolarHBondContact O-N 2.66Å; V141-S143 VanDerWaalsContact C-N 3.34Å; V141-S143 PolarHBondContact O-N 3.09Å; V141-L144 WeakPolarHBondContact O-CB 3.45Å; V141-L144 PolarHBondContact O-N 2.84Å; V141-Y145 HydrophobicContact CG1-CD2 4.41Å; V141-Y145 HydrophobicContact CG1-CE1 4.07Å; V141-Y145 HydrophobicContact CG1-CE2 3.75Å; V141-Y145 PolarHBondContact O-N 3.14Å; V141-Y145 VanDerWaalsContact O-N 3.09Å; V141-I167 HydrophobicContact CB-CD1 4.43Å; V141-I167 HydrophobicContact CG2-CD1 3.97Å; V141-I167 HydrophobicContact CG2-CG1 4.12Å; V141-A172 HydrophobicContact CG2-CB 4.02Å
142	L	98	Very high	97.4	Very high	1 Å²	1	23.8 Å²	23.8	1%	0.005	15%	0.148	C	C	.	.	H	α-helix	trans	-61.1	-43.2	174.6	-60.5	-177.6	0	0	0	111.7	L106 T108 A137 I138 Q139 L144 Y145 A146 V341 G344 L348	L106-L142 HydrophobicContact CD2-CD1 4.04Å; T108-L142 HydrophobicContact CG2-CD1 3.56Å; A137-L142 HydrophobicContact CB-CD1 3.92Å; A137-L142 HydrophobicContact CB-CD2 3.78Å; A137-L142 HydrophobicContact CB-CG 3.9Å; I138-L142 PolarHBondContact O-N 3.17Å; I138-L142 VanDerWaalsContact O-N 3.14Å; Q139-L142 PolarHBondContact O-N 3.15Å; L142-L144 PolarHBondContact O-N 3.03Å; L142-Y145 HydrophobicContact CD2-CD2 4.28Å; L142-Y145 WeakPolarHBondContact O-CA 3.26Å; L142-Y145 WeakPolarHBondContact O-CB 3.48Å; L142-Y145 PolarHBondContact O-N 3.41Å; L142-A146 PolarHBondContact O-N 3.45Å; L142-V341 WeakPolarHBondContact CB-O 3.33Å; L142-V341 HydrophobicContact CD1-CG1 4.37Å; L142-G344 VanDerWaalsContact O-CA 3.23Å; L142-G344 WeakPolarHBondContact O-CA 3.39Å; L142-L348 HydrophobicContact CD2-CB 4.29Å; L142-L348 HydrophobicContact CD2-CD2 3.63Å
143	S	98.2	Very high	97.5	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-59.2	-35.7	176.9	-60.3	0	0	0	0	112.7	Q139 A140 V141 S147 S302 V341	Q139-S143 WeakPolarHBondContact O-CB 3.48Å; Q139-S143 PolarHBondContact O-N 3.17Å; Q139-S143 PolarHBondContact O-OG 3.36Å; A140-S143 WeakPolarHBondContact O-CB 3.28Å; A140-S143 PolarHBondContact O-N 3.16Å; V141-S143 VanDerWaalsContact C-N 3.34Å; V141-S143 PolarHBondContact O-N 3.09Å; S143-S147 PolarHBondContact O-N 3.08Å; S143-S302 WeakPolarHBondContact CB-OG 3.5Å; S143-S302 WeakPolarHBondContact OG-CB 3.26Å; S143-S302 PolarHBondContact OG-OG 2.84Å; S143-V341 WeakPolarHBondContact OG-CG2 3.21Å
144	L	97.9	Very high	97.5	Very high	0 Å²	0	21 Å²	21	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-66.8	-43.1	174.3	-168.3	67.6	0	0	0	111.3	A140 V141 L142 A146 S147 R149 V154 I167 V300	A140-L144 PolarHBondContact O-N 2.65Å; V141-L144 WeakPolarHBondContact O-CB 3.45Å; V141-L144 PolarHBondContact O-N 2.84Å; L142-L144 PolarHBondContact O-N 3.03Å; L144-A146 VanDerWaalsContact C-N 3.34Å; L144-A146 PolarHBondContact O-N 3.22Å; L144-S147 WeakPolarHBondContact O-CB 3.45Å; L144-S147 PolarHBondContact O-N 3.35Å; L144-S147 PolarHBondContact O-OG 3.49Å; L144-R149 CarbonylContact C-O 3.18Å; L144-R149 HydrophobicContact CD1-CB 3.8Å; L144-R149 HydrophobicContact CG-CB 3.9Å; L144-R149 WeakPolarHBondContact CG-O 3.44Å; L144-R149 PolarHBondContact O-N 3.03Å; L144-V154 HydrophobicContact CB-CG2 3.88Å; L144-V154 HydrophobicContact CD1-CG2 4.05Å; L144-V154 HydrophobicContact CG-CG2 4.49Å; L144-I167 HydrophobicContact CB-CD1 3.99Å; L144-I167 HydrophobicContact CD2-CB 3.7Å; L144-I167 HydrophobicContact CD2-CD1 3.79Å; L144-I167 HydrophobicContact CD2-CG1 4.37Å; L144-I167 HydrophobicContact CD2-CG2 3.6Å; L144-I167 HydrophobicContact CG-CD1 4.47Å; L144-V300 HydrophobicContact CD1-CB 4.46Å; L144-V300 HydrophobicContact CD1-CG2 3.76Å
145	Y	96.4	Very high	97.6	Very high	60 Å²	60	21.2 Å²	21.2	24%	0.235	13%	0.13	C	C	.	.	H	α-helix	trans	-60.8	-40	175.9	-64.2	-16.2	0	0	0	112.5	V141 L142 S147 G148 R149 T150 L348	V141-Y145 HydrophobicContact CG1-CD2 4.41Å; V141-Y145 HydrophobicContact CG1-CE1 4.07Å; V141-Y145 HydrophobicContact CG1-CE2 3.75Å; V141-Y145 PolarHBondContact O-N 3.14Å; V141-Y145 VanDerWaalsContact O-N 3.09Å; L142-Y145 HydrophobicContact CD2-CD2 4.28Å; L142-Y145 WeakPolarHBondContact O-CA 3.26Å; L142-Y145 WeakPolarHBondContact O-CB 3.48Å; L142-Y145 PolarHBondContact O-N 3.41Å; Y145-S147 PolarHBondContact O-N 2.93Å; Y145-S147 VanDerWaalsContact O-N 3.14Å; Y145-G148 WeakPolarHBondContact O-CA 3.3Å; Y145-G148 PolarHBondContact O-N 3.34Å; Y145-R149 WeakPolarHBondContact CD1-O 3.14Å; Y145-T150 HydrophobicContact CE1-CG2 4.44Å; Y145-L348 HydrophobicContact CD2-CB 4.41Å; Y145-L348 HydrophobicContact CD2-CD1 4.34Å; Y145-L348 HydrophobicContact CD2-CD2 4.46Å; Y145-L348 HydrophobicContact CE2-CD1 4.01Å; Y145-L348 HydrophobicContact CE2-CD2 4.19Å
146	A	96.9	Very high	97.6	Very high	24 Å²	24	20.4 Å²	20.4	20%	0.198	13%	0.127	C	C	.	.	H	α-helix	trans	-58.8	-26.3	174.1	0	0	0	0	0	113	L142 L144 G148 S340 I343	L142-A146 PolarHBondContact O-N 3.45Å; L144-A146 VanDerWaalsContact C-N 3.34Å; L144-A146 PolarHBondContact O-N 3.22Å; A146-G148 VanDerWaalsContact C-N 3.31Å; A146-S340 VanDerWaalsContact CB-O 3.26Å; A146-S340 WeakPolarHBondContact CB-O 3.35Å; A146-I343 HydrophobicContact CB-CB 4.12Å; A146-I343 HydrophobicContact CB-CG2 3.9Å
147	S	95.7	Very high	97.6	Very high	23 Å²	23	20.6 Å²	20.6	16%	0.161	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-0.9	175	85.7	0	0	0	0	113.9	S143 L144 Y145 R149	S143-S147 PolarHBondContact O-N 3.08Å; L144-S147 WeakPolarHBondContact O-CB 3.45Å; L144-S147 PolarHBondContact O-N 3.35Å; L144-S147 PolarHBondContact O-OG 3.49Å; Y145-S147 PolarHBondContact O-N 2.93Å; Y145-S147 VanDerWaalsContact O-N 3.14Å; S147-R149 PolarHBondContact O-NH1 3.02Å; S147-R149 WeakPolarHBondContact OG-CD 3.42Å; S147-R149 PolarHBondContact OG-NH1 3.5Å
148	G	95.3	Very high	97.6	Very high	72 Å²	72	21.4 Å²	21.4	74%	0.742	14%	0.137	S	C	*	.	T	Hydrogen-bonded Turn	trans	72.9	33.9	-175.8	0	0	0	0	0	113.6	Y145 A146	Y145-G148 WeakPolarHBondContact O-CA 3.3Å; Y145-G148 PolarHBondContact O-N 3.34Å; A146-G148 VanDerWaalsContact C-N 3.31Å
149	R	96.6	Very high	97.6	Very high	65 Å²	65	22 Å²	22	25%	0.245	14%	0.14	C	C	.	.			trans	-129.4	152.4	-176.7	-68.1	175.2	177.9	66	16.8	111.5	L144 Y145 S147 N298 I332	L144-R149 CarbonylContact C-O 3.18Å; L144-R149 HydrophobicContact CD1-CB 3.8Å; L144-R149 HydrophobicContact CG-CB 3.9Å; L144-R149 WeakPolarHBondContact CG-O 3.44Å; L144-R149 PolarHBondContact O-N 3.03Å; Y145-R149 WeakPolarHBondContact CD1-O 3.14Å; S147-R149 PolarHBondContact O-NH1 3.02Å; S147-R149 WeakPolarHBondContact OG-CD 3.42Å; S147-R149 PolarHBondContact OG-NH1 3.5Å; R149-N298 WeakPolarHBondContact CD-OD1 3.21Å; R149-N298 PolarHBondContact NE-OD1 2.96Å; R149-I332 VanDerWaalsContact CZ-CD1 3.49Å; R149-I332 VanDerWaalsContact NE-CD1 3.3Å
150	T	95.9	Very high	97.5	Very high	81 Å²	81	21.3 Å²	21.3	50%	0.497	14%	0.138	S	C	.	.	S	Bend	trans	-116.4	-15.1	172.4	54.3	0	0	0	0	112.7	Y145 I167 E169 G170	Y145-T150 HydrophobicContact CE1-CG2 4.44Å; T150-I167 WeakPolarHBondContact O-CG2 3.22Å; T150-E169 PolarHBondContact O-N 3.47Å; T150-E169 VanDerWaalsContact O-N 3.17Å; T150-G170 PolarHBondContact O-N 3.21Å
151	T	98.2	Very high	97.5	Very high	22 Å²	22	21.7 Å²	21.7	14%	0.135	14%	0.14	C	C	.	.	S	Bend	trans	-126.9	134.2	175.9	-61.9	0	0	0	0	110	I167 Y168 E169 D294	T151-I167 WeakPolarHBondContact CA-O 3.29Å; T151-Y168 HydrophobicContact CG2-CD2 3.71Å; T151-Y168 HydrophobicContact CG2-CE2 4.3Å; T151-E169 PolarHBondContact OG1-N 3.17Å; T151-D294 HydrophobicContact CG2-CB 3.86Å
152	G	98.5	Very high	97.6	Very high	0 Å²	0	21 Å²	21	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	160.5	179	-179.5	0	0	0	0	0	111.7	I167 L295 N298	G152-I167 PolarHBondContact N-O 2.84Å; G152-I167 PolarHBondContact O-N 2.88Å; G152-L295 VanDerWaalsContact C-CD2 3.46Å; G152-L295 WeakPolarHBondContact O-CD2 3.42Å; G152-N298 CarbonylContact C-O 3.59Å; G152-N298 VanDerWaalsContact CA-O 3.31Å; G152-N298 WeakPolarHBondContact CA-O 3.27Å
153	I	98.8	Very high	97.6	Very high	1 Å²	1	21 Å²	21	1%	0.005	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	135.9	170.6	-173.2	164.8	0	0	0	109	N164 P166 T280 S283 I284 N298 N299 V300	I153-N164 HydrophobicContact CD1-CB 4.3Å; I153-P166 HydrophobicContact CD1-CB 4.36Å; I153-P166 HydrophobicContact CG1-CB 4.38Å; I153-T280 HydrophobicContact CD1-CG2 3.9Å; I153-T280 HydrophobicContact CG1-CG2 4.45Å; I153-T280 HydrophobicContact CG2-CG2 4.13Å; I153-S283 WeakPolarHBondContact CD1-OG 3.4Å; I153-I284 HydrophobicContact CD1-CD1 4.4Å; I153-I284 HydrophobicContact CD1-CG1 3.72Å; I153-I284 HydrophobicContact CG2-CD1 4.11Å; I153-I284 HydrophobicContact CG2-CG1 4.35Å; I153-N298 PolarHBondContact N-O 2.82Å; I153-N299 HydrophobicContact CG2-CB 4.14Å; I153-N299 WeakPolarHBondContact CG2-OD1 3.47Å; I153-N299 CarbonylContact O-C 3.57Å; I153-N299 WeakPolarHBondContact O-CA 3.37Å; I153-V300 PolarHBondContact O-N 2.9Å
154	V	98.8	Very high	97.6	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	122	178.9	179.6	0	0	0	0	108.9	A140 L144 D156 N164 V165 I167 V300	A140-V154 HydrophobicContact CB-CB 4.02Å; A140-V154 HydrophobicContact CB-CG1 4.05Å; A140-V154 WeakPolarHBondContact O-CG2 3.37Å; L144-V154 HydrophobicContact CB-CG2 3.88Å; L144-V154 HydrophobicContact CD1-CG2 4.05Å; L144-V154 HydrophobicContact CG-CG2 4.49Å; V154-D156 HydrophobicContact CG1-CB 4.15Å; V154-N164 CarbonylContact O-C 3.52Å; V154-N164 WeakPolarHBondContact O-CA 3.15Å; V154-V165 PolarHBondContact N-O 2.86Å; V154-V165 PolarHBondContact O-N 2.87Å; V154-I167 HydrophobicContact CG2-CD1 3.87Å; V154-V300 CarbonylContact C-O 3.59Å; V154-V300 VanDerWaalsContact CA-O 3.31Å; V154-V300 WeakPolarHBondContact CA-O 3.39Å; V154-V300 HydrophobicContact CG2-CB 4.21Å
155	L	98.8	Very high	97.6	Very high	5 Å²	5	21.1 Å²	21.1	3%	0.026	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	98.6	161.8	173.1	61.3	0	0	0	107.3	T162 H163 I276 V300 L301 S302 M315	L155-T162 HydrophobicContact CD1-CG2 3.44Å; L155-T162 VanDerWaalsContact CD1-CG2 3.44Å; L155-H163 CarbonylContact C-O 3.54Å; L155-H163 WeakPolarHBondContact CA-O 3.31Å; L155-I276 HydrophobicContact CD1-CB 4.3Å; L155-I276 HydrophobicContact CD1-CG2 4.34Å; L155-I276 HydrophobicContact CD2-CB 4.1Å; L155-I276 HydrophobicContact CD2-CD1 3.86Å; L155-I276 HydrophobicContact CD2-CG1 4.44Å; L155-V300 PolarHBondContact N-O 2.93Å; L155-L301 HydrophobicContact CB-CD2 3.95Å; L155-L301 HydrophobicContact CD2-CD2 3.91Å; L155-L301 HydrophobicContact CG-CD2 4.33Å; L155-S302 PolarHBondContact O-N 3.48Å; L155-M315 HydrophobicContact CD2-CE 3.72Å; L155-M315 HydrophobicContact CD2-SD 4.25Å
156	D	98.5	Very high	97.7	Very high	10 Å²	10	18.2 Å²	18.2	5%	0.053	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	115.8	174.8	-170.8	-4.4	0	0	0	109.3	V154 T162 H163 S302	V154-D156 HydrophobicContact CG1-CB 4.15Å; D156-T162 CarbonylContact O-C 3.52Å; D156-T162 VanDerWaalsContact O-CA 3.31Å; D156-T162 WeakPolarHBondContact O-CA 3.11Å; D156-H163 PolarHBondContact N-O 3.29Å; D156-H163 PolarHBondContact O-N 3Å; D156-S302 WeakPolarHBondContact CA-O 3.32Å
157	S	98.6	Very high	97.8	Very high	4 Å²	4	17.1 Å²	17.1	3%	0.028	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	104.9	179.2	-169.8	0	0	0	0	110.6	T162 S302 G303 G304 T305	S157-T162 WeakPolarHBondContact CB-OG1 3.08Å; S157-T162 PolarHBondContact OG-OG1 2.87Å; S157-S302 PolarHBondContact N-O 3.11Å; S157-G303 CarbonylContact O-C 3.49Å; S157-G303 WeakPolarHBondContact O-CA 3.37Å; S157-G304 PolarHBondContact O-N 3.31Å; S157-T305 WeakPolarHBondContact O-CB 3.3Å; S157-T305 PolarHBondContact O-N 2.86Å; S157-T305 VanDerWaalsContact OG-CB 3.26Å; S157-T305 WeakPolarHBondContact OG-CB 3.44Å; S157-T305 VanDerWaalsContact OG-CG2 3.28Å; S157-T305 WeakPolarHBondContact OG-CG2 3.36Å
158	G	97.6	Very high	97.9	Very high	23 Å²	23	19.6 Å²	19.6	24%	0.237	12%	0.122	C	C	.	.			trans	-92.1	-152.4	-179.1	0	0	0	0	0	113.2	V161 A183 G184 T305	G158-V161 PolarHBondContact N-O 2.78Å; G158-V161 VanDerWaalsContact N-O 3.07Å; G158-A183 WeakPolarHBondContact O-CB 3.29Å; G158-G184 PolarHBondContact O-N 3.37Å; G158-G184 VanDerWaalsContact O-N 3.15Å; G158-T305 PolarHBondContact O-OG1 3.06Å
159	D	97.2	Very high	97.9	Very high	37 Å²	37	21.8 Å²	21.8	20%	0.198	11%	0.113	C	C	.	.	S	Bend	trans	-80.4	-36.7	171.5	-175.7	61.6	0	0	0	111.9	A183 G184 R185	D159-A183 WeakPolarHBondContact O-CB 3.32Å; D159-G184 PolarHBondContact O-N 3.48Å; D159-G184 VanDerWaalsContact O-N 3.17Å; D159-R185 VanDerWaalsContact O-CB 3.26Å; D159-R185 WeakPolarHBondContact O-CB 3.26Å; D159-R185 PolarHBondContact O-N 3.3Å; D159-R185 PolarHBondContact OD1-N 3.06Å; D159-R185 IonicContact OD2-CZ 3.62Å; D159-R185 IonicContact OD2-NE 2.9Å; D159-R185 PolarHBondContact OD2-NE 3Å; D159-R185 IonicContact OD2-NH2 2.72Å; D159-R185 PolarHBondContact OD2-NH2 2.97Å
160	G	96.7	Very high	97.8	Very high	3 Å²	3	19.3 Å²	19.3	3%	0.031	11%	0.108	C	C	.	.	S	Bend	trans	-102.9	-22.3	-171.1	0	0	0	0	0	115.5	H75	H75-G160 WeakPolarHBondContact CA-O 3.26Å; H75-G160 PolarHBondContact CD2-O 3.34Å
161	V	97.6	Very high	97.7	Very high	9 Å²	9	23.9 Å²	23.9	6%	0.055	12%	0.117	C	C	.	.			trans	-160.1	153.9	-172.7	60.7	0	0	0	0	111.2	H75 G158 H163 R179 L180	H75-V161 HydrophobicContact CB-CB 4.37Å; G158-V161 PolarHBondContact N-O 2.78Å; G158-V161 VanDerWaalsContact N-O 3.07Å; V161-H163 WeakPolarHBondContact CG1-CE1 3.07Å; V161-H163 WeakPolarHBondContact CG2-CE1 3.22Å; V161-R179 HydrophobicContact CG2-CG 4.03Å; V161-L180 WeakPolarHBondContact CG2-O 3.37Å
162	T	98.5	Very high	97.6	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	134.5	173.1	-60.3	0	0	0	0	110.7	L155 D156 S157 L180 L182 I276	L155-T162 HydrophobicContact CD1-CG2 3.44Å; L155-T162 VanDerWaalsContact CD1-CG2 3.44Å; D156-T162 CarbonylContact O-C 3.52Å; D156-T162 VanDerWaalsContact O-CA 3.31Å; D156-T162 WeakPolarHBondContact O-CA 3.11Å; S157-T162 WeakPolarHBondContact CB-OG1 3.08Å; S157-T162 PolarHBondContact OG-OG1 2.87Å; T162-L180 PolarHBondContact N-O 3.44Å; T162-L180 PolarHBondContact O-N 3.44Å; T162-L182 WeakPolarHBondContact CB-O 3.41Å; T162-L182 PolarHBondContact OG1-O 3.4Å; T162-I276 HydrophobicContact CG2-CG2 3.94Å
163	H	98.2	Very high	97.6	Very high	3 Å²	3	25.3 Å²	25.3	1%	0.014	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	140.1	178.1	-60.4	103.7	0	0	0	111.6	P111 L155 D156 V161 V165 M178	P111-H163 HydrophobicContact CG-CB 3.91Å; P111-H163 VanDerWaalsContact CG-CD2 3.43Å; P111-H163 WeakPolarHBondContact CG-CD2 3.4Å; P111-H163 VanDerWaalsContact CG-CG 3.5Å; L155-H163 CarbonylContact C-O 3.54Å; L155-H163 WeakPolarHBondContact CA-O 3.31Å; D156-H163 PolarHBondContact N-O 3.29Å; D156-H163 PolarHBondContact O-N 3Å; V161-H163 WeakPolarHBondContact CG1-CE1 3.07Å; V161-H163 WeakPolarHBondContact CG2-CE1 3.22Å; H163-V165 HydrophobicContact CB-CG2 3.96Å; H163-M178 CarbonylContact C-O 3.58Å; H163-M178 WeakPolarHBondContact CA-O 3.28Å
164	N	98.6	Very high	97.5	Very high	1 Å²	1	29.4 Å²	29.4	1%	0.005	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	116.5	160.2	-71	-80.9	0	0	0	108.5	I153 V154 I177 M178 T279 T280	I153-N164 HydrophobicContact CD1-CB 4.3Å; V154-N164 CarbonylContact O-C 3.52Å; V154-N164 WeakPolarHBondContact O-CA 3.15Å; N164-I177 WeakPolarHBondContact O-CA 3.48Å; N164-M178 HydrophobicContact CB-CB 4.19Å; N164-M178 PolarHBondContact N-O 3.28Å; N164-M178 PolarHBondContact O-N 3.32Å; N164-T279 PolarHBondContact ND2-OG1 3.06Å; N164-T280 PolarHBondContact ND2-N 2.78Å; N164-T280 WeakPolarHBondContact OD1-CA 3.47Å; N164-T280 WeakPolarHBondContact OD1-CB 3.49Å; N164-T280 PolarHBondContact OD1-OG1 3.48Å
165	V	98.6	Very high	97.3	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	105.7	-176.2	-172.3	0	0	0	0	109	P111 A140 V154 H163 I167 A172 I177	P111-V165 HydrophobicContact CB-CG2 4.18Å; P111-V165 HydrophobicContact CG-CG2 3.79Å; A140-V165 HydrophobicContact CB-CB 3.53Å; A140-V165 HydrophobicContact CB-CG1 3.96Å; A140-V165 HydrophobicContact CB-CG2 3.49Å; A140-V165 VanDerWaalsContact CB-CG2 3.49Å; V154-V165 PolarHBondContact N-O 2.86Å; V154-V165 PolarHBondContact O-N 2.87Å; H163-V165 HydrophobicContact CB-CG2 3.96Å; V165-I167 HydrophobicContact CG1-CD1 4.38Å; V165-I167 HydrophobicContact CG1-CG1 4.03Å; V165-A172 HydrophobicContact CG1-CB 3.82Å; V165-I177 HydrophobicContact CG1-CD1 4.15Å; V165-I177 HydrophobicContact CG1-CG1 4.21Å; V165-I177 HydrophobicContact CG2-CG2 4.34Å
166	P	98.7	Very high	97.3	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	133	172.4	28.9	-26.3	0	0	0	109.2	I153 L173 A176 S283 L295	I153-P166 HydrophobicContact CD1-CB 4.36Å; I153-P166 HydrophobicContact CG1-CB 4.38Å; P166-L173 HydrophobicContact CB-CD1 4.31Å; P166-L173 HydrophobicContact CG-CB 4.19Å; P166-L173 PolarHBondContact O-N 2.78Å; P166-A176 HydrophobicContact CG-CB 3.53Å; P166-S283 VanDerWaalsContact CD-OG 3.28Å; P166-S283 WeakPolarHBondContact CD-OG 3.31Å; P166-S283 WeakPolarHBondContact CG-OG 3.32Å; P166-L295 HydrophobicContact CB-CD1 4.1Å; P166-L295 HydrophobicContact CB-CD2 4.35Å
167	I	98.6	Very high	97.3	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	132.6	-174	-60	155.1	0	0	0	107.7	V141 L144 T150 T151 G152 V154 V165 Y171 A172	V141-I167 HydrophobicContact CB-CD1 4.43Å; V141-I167 HydrophobicContact CG2-CD1 3.97Å; V141-I167 HydrophobicContact CG2-CG1 4.12Å; L144-I167 HydrophobicContact CB-CD1 3.99Å; L144-I167 HydrophobicContact CD2-CB 3.7Å; L144-I167 HydrophobicContact CD2-CD1 3.79Å; L144-I167 HydrophobicContact CD2-CG1 4.37Å; L144-I167 HydrophobicContact CD2-CG2 3.6Å; L144-I167 HydrophobicContact CG-CD1 4.47Å; T150-I167 WeakPolarHBondContact O-CG2 3.22Å; T151-I167 WeakPolarHBondContact CA-O 3.29Å; G152-I167 PolarHBondContact N-O 2.84Å; G152-I167 PolarHBondContact O-N 2.88Å; V154-I167 HydrophobicContact CG2-CD1 3.87Å; V165-I167 HydrophobicContact CG1-CD1 4.38Å; V165-I167 HydrophobicContact CG1-CG1 4.03Å; I167-Y171 CarbonylContact C-O 3.59Å; I167-Y171 VanDerWaalsContact CA-O 3.31Å; I167-Y171 WeakPolarHBondContact CA-O 3.49Å; I167-A172 HydrophobicContact CG1-CB 4.32Å
168	Y	97.8	Very high	97.3	Very high	76 Å²	76	36.7 Å²	36.7	30%	0.298	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	123.9	177.4	-176.9	-95.8	0	0	0	109.1	T151 G170 Y171 I291	T151-Y168 HydrophobicContact CG2-CD2 3.71Å; T151-Y168 HydrophobicContact CG2-CE2 4.3Å; Y168-G170 PolarHBondContact O-N 3.02Å; Y168-G170 VanDerWaalsContact O-N 3.13Å; Y168-Y171 PolarHBondContact N-O 3.11Å; Y168-Y171 PolarHBondContact O-N 2.95Å; Y168-I291 HydrophobicContact CD2-CB 3.95Å; Y168-I291 HydrophobicContact CD2-CD1 4.33Å; Y168-I291 HydrophobicContact CD2-CG2 3.53Å; Y168-I291 HydrophobicContact CE2-CB 4.19Å; Y168-I291 HydrophobicContact CE2-CG2 3.43Å; Y168-I291 VanDerWaalsContact CE2-CG2 3.43Å; Y168-I291 HydrophobicContact CG-CD1 4.46Å; Y168-I291 HydrophobicContact CG-CG2 4.27Å
169	E	95.5	Very high	97.2	Very high	117 Å²	117	40 Å²	40	55%	0.547	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.8	37.3	-179.7	-66.2	-179.7	-173.3	0	0	113.7	T150 T151 Y171	T150-E169 PolarHBondContact O-N 3.47Å; T150-E169 VanDerWaalsContact O-N 3.17Å; T151-E169 PolarHBondContact OG1-N 3.17Å; E169-Y171 VanDerWaalsContact C-N 3.33Å; E169-Y171 VanDerWaalsContact O-CD2 3.31Å; E169-Y171 WeakPolarHBondContact O-CD2 3.34Å
170	G	93.5	Very high	97.2	Very high	13 Å²	13	38.6 Å²	38.6	13%	0.134	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.9	-9.1	-179.6	0	0	0	0	0	114.9	T150 Y168	T150-G170 PolarHBondContact O-N 3.21Å; Y168-G170 PolarHBondContact O-N 3.02Å; Y168-G170 VanDerWaalsContact O-N 3.13Å
171	Y	94.2	Very high	97.1	Very high	178 Å²	178	41.8 Å²	41.8	70%	0.698	20%	0.201	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-98.8	121.7	-179.8	-61.2	-84.9	0	0	0	111.3	I167 Y168 E169	I167-Y171 CarbonylContact C-O 3.59Å; I167-Y171 VanDerWaalsContact CA-O 3.31Å; I167-Y171 WeakPolarHBondContact CA-O 3.49Å; Y168-Y171 PolarHBondContact N-O 3.11Å; Y168-Y171 PolarHBondContact O-N 2.95Å; E169-Y171 VanDerWaalsContact C-N 3.33Å; E169-Y171 VanDerWaalsContact O-CD2 3.31Å; E169-Y171 WeakPolarHBondContact O-CD2 3.34Å
172	A	96.9	Very high	97.1	Very high	19 Å²	19	41.4 Å²	41.4	16%	0.157	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	139.8	169.5	0	0	0	0	0	110	I138 V141 V165 I167 P174	I138-A172 HydrophobicContact CD1-CB 4.05Å; V141-A172 HydrophobicContact CG2-CB 4.02Å; V165-A172 HydrophobicContact CG1-CB 3.82Å; I167-A172 HydrophobicContact CG1-CB 4.32Å; A172-P174 WeakPolarHBondContact O-CD 3.38Å
173	L	97.4	Very high	97.1	Very high	32 Å²	32	41.4 Å²	41.4	17%	0.168	20%	0.199	C	C	.	.			trans	-96.6	96.7	-179.4	-54.5	175.4	0	0	0	110.2	P166 H175 A176 I177 C287 I291	P166-L173 HydrophobicContact CB-CD1 4.31Å; P166-L173 HydrophobicContact CG-CB 4.19Å; P166-L173 PolarHBondContact O-N 2.78Å; L173-H175 VanDerWaalsContact C-N 3.31Å; L173-H175 PolarHBondContact O-N 3.47Å; L173-A176 HydrophobicContact CB-CB 4.46Å; L173-A176 PolarHBondContact O-N 3.49Å; L173-I177 PolarHBondContact O-N 3.42Å; L173-C287 HydrophobicContact CD1-CB 4.47Å; L173-I291 HydrophobicContact CD1-CD1 3.52Å
174	P	96.2	Very high	97.1	Very high	88 Å²	88	41.3 Å²	41.3	57%	0.571	20%	0.198	S	C	*	.	G	3₁₀ helix	trans	-65.1	-32.7	-163.9	-23.2	36.9	0	0	0	113.9	A172 A176 I177	A172-P174 WeakPolarHBondContact O-CD 3.38Å; P174-A176 PolarHBondContact O-N 2.88Å; P174-I177 PolarHBondContact O-N 2.81Å
175	H	96.6	Very high	97	Very high	118 Å²	118	43.4 Å²	43.4	55%	0.546	21%	0.206	S	C	.	.	G	3₁₀ helix	trans	-67.3	-19.5	179.7	64.8	-88.3	0	0	0	113.5	L173	L173-H175 VanDerWaalsContact C-N 3.31Å; L173-H175 PolarHBondContact O-N 3.47Å
176	A	98.1	Very high	97	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-109.6	5	-176.7	0	0	0	0	0	113.1	P166 L173 P174 M178 S283 K286	P166-A176 HydrophobicContact CG-CB 3.53Å; L173-A176 HydrophobicContact CB-CB 4.46Å; L173-A176 PolarHBondContact O-N 3.49Å; P174-A176 PolarHBondContact O-N 2.88Å; A176-M178 PolarHBondContact O-N 3.33Å; A176-S283 WeakPolarHBondContact O-CB 3.49Å; A176-S283 PolarHBondContact O-OG 3.04Å; A176-K286 HydrophobicContact CB-CB 3.72Å
177	I	98.4	Very high	97	Very high	17 Å²	17	45.4 Å²	45.4	9%	0.087	22%	0.217	C	C	.	.			trans	-69.8	130.8	175	-61.3	-179.8	0	0	0	109.5	P111 L112 N164 V165 L173 P174	P111-I177 HydrophobicContact CB-CD1 3.77Å; P111-I177 HydrophobicContact CB-CG2 4.17Å; P111-I177 HydrophobicContact CG-CG2 4.22Å; L112-I177 HydrophobicContact CD1-CB 4.48Å; L112-I177 HydrophobicContact CD1-CG2 4.09Å; L112-I177 HydrophobicContact CD2-CD1 4.3Å; L112-I177 HydrophobicContact CG-CG2 4.31Å; N164-I177 WeakPolarHBondContact O-CA 3.48Å; V165-I177 HydrophobicContact CG1-CD1 4.15Å; V165-I177 HydrophobicContact CG1-CG1 4.21Å; V165-I177 HydrophobicContact CG2-CG2 4.34Å; L173-I177 PolarHBondContact O-N 3.42Å; P174-I177 PolarHBondContact O-N 2.81Å
178	M	97.9	Very high	97	Very high	37 Å²	37	45.4 Å²	45.4	18%	0.182	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	128.3	171.2	-56.2	-67	-68.3	0	0	108.7	H163 N164 A176 T279 N282 K286	H163-M178 CarbonylContact C-O 3.58Å; H163-M178 WeakPolarHBondContact CA-O 3.28Å; N164-M178 HydrophobicContact CB-CB 4.19Å; N164-M178 PolarHBondContact N-O 3.28Å; N164-M178 PolarHBondContact O-N 3.32Å; A176-M178 PolarHBondContact O-N 3.33Å; M178-T279 HydrophobicContact CE-CG2 4.34Å; M178-T279 WeakPolarHBondContact CG-O 3.39Å; M178-N282 HydrophobicContact CE-CB 4.32Å; M178-K286 HydrophobicContact SD-CD 4.2Å; M178-K286 PolarHBondContact SD-NZ 2.92Å
179	R	96.3	Very high	97	Very high	93 Å²	93	45 Å²	45	35%	0.351	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	138.8	176.8	175.1	173.4	166.4	171.1	-2.5	109.6	H75 V161 D181	H75-R179 PolarHBondContact O-NH2 3.25Å; V161-R179 HydrophobicContact CG2-CG 4.03Å; R179-D181 IonicContact CZ-OD1 3.92Å; R179-D181 VanDerWaalsContact CZ-OD1 3.27Å; R179-D181 IonicContact CZ-OD2 3.39Å; R179-D181 IonicContact NE-OD1 3Å; R179-D181 PolarHBondContact NE-OD1 2.83Å; R179-D181 IonicContact NE-OD2 3.34Å; R179-D181 IonicContact NH2-OD1 3.88Å; R179-D181 PolarHBondContact NH2-OD1 2.86Å; R179-D181 IonicContact NH2-OD2 3.15Å; R179-D181 PolarHBondContact NH2-OD2 2.97Å
180	L	96.2	Very high	97.1	Very high	6 Å²	6	40.4 Å²	40.4	3%	0.031	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	114	176.4	-172.3	72.8	0	0	0	108.5	V161 T162 L182 M271 S273 I276	V161-L180 WeakPolarHBondContact CG2-O 3.37Å; T162-L180 PolarHBondContact N-O 3.44Å; T162-L180 PolarHBondContact O-N 3.44Å; L180-L182 HydrophobicContact CD2-CB 4Å; L180-L182 HydrophobicContact CD2-CD2 4.21Å; L180-L182 HydrophobicContact CD2-CG 4.45Å; L180-L182 HydrophobicContact CG-CB 3.91Å; L180-L182 PolarHBondContact O-N 3.42Å; L180-M271 HydrophobicContact CD1-CE 3.48Å; L180-M271 VanDerWaalsContact CD1-CE 3.48Å; L180-M271 HydrophobicContact CD1-SD 4.29Å; L180-M271 HydrophobicContact CD2-CE 4.35Å; L180-M271 HydrophobicContact CG-CE 3.95Å; L180-S273 WeakPolarHBondContact CD1-OG 3.44Å; L180-I276 HydrophobicContact CD2-CG2 4.22Å
181	D	95.4	Very high	97.3	Very high	70 Å²	70	39.8 Å²	39.8	37%	0.374	19%	0.191	S	C	.	.	S	Bend	trans	-78.8	55.6	174.4	-68.1	-16	0	0	0	110	R179	R179-D181 IonicContact CZ-OD1 3.92Å; R179-D181 VanDerWaalsContact CZ-OD1 3.27Å; R179-D181 IonicContact CZ-OD2 3.39Å; R179-D181 IonicContact NE-OD1 3Å; R179-D181 PolarHBondContact NE-OD1 2.83Å; R179-D181 IonicContact NE-OD2 3.34Å; R179-D181 IonicContact NH2-OD1 3.88Å; R179-D181 PolarHBondContact NH2-OD1 2.86Å; R179-D181 IonicContact NH2-OD2 3.15Å; R179-D181 PolarHBondContact NH2-OD2 2.97Å
182	L	97.8	Very high	97.5	Very high	1 Å²	1	32.6 Å²	32.6	1%	0.005	17%	0.165	C	C	.	.			trans	-140.8	119.4	172.5	164.5	60.7	0	0	0	107.8	T162 L180 D186 L187 T262 L263 P266 I269 M271	T162-L182 WeakPolarHBondContact CB-O 3.41Å; T162-L182 PolarHBondContact OG1-O 3.4Å; L180-L182 HydrophobicContact CD2-CB 4Å; L180-L182 HydrophobicContact CD2-CD2 4.21Å; L180-L182 HydrophobicContact CD2-CG 4.45Å; L180-L182 HydrophobicContact CG-CB 3.91Å; L180-L182 PolarHBondContact O-N 3.42Å; L182-D186 WeakPolarHBondContact CA-OD2 3.31Å; L182-D186 HydrophobicContact CD1-CB 3.62Å; L182-L187 HydrophobicContact CD1-CD2 4.18Å; L182-T262 VanDerWaalsContact CD2-O 3.24Å; L182-T262 WeakPolarHBondContact CD2-O 3.07Å; L182-L263 HydrophobicContact CD2-CD2 4.5Å; L182-L263 HydrophobicContact CG-CD2 4.25Å; L182-P266 HydrophobicContact CD2-CB 4.19Å; L182-P266 HydrophobicContact CD2-CG 4.11Å; L182-I269 HydrophobicContact CD1-CD1 3.55Å; L182-I269 HydrophobicContact CD2-CD1 4.17Å; L182-I269 HydrophobicContact CG-CD1 4.38Å; L182-M271 HydrophobicContact CB-CE 3.4Å; L182-M271 VanDerWaalsContact CB-CE 3.4Å; L182-M271 HydrophobicContact CB-SD 4.38Å; L182-M271 HydrophobicContact CD2-CE 3.58Å; L182-M271 HydrophobicContact CG-CE 4.08Å
183	A	98.2	Very high	97.5	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.181	C	C	.	.	S	Bend	trans	-158.1	-160.9	-177.6	0	0	0	0	0	111.6	G158 D159 R185 D186 L187	G158-A183 WeakPolarHBondContact O-CB 3.29Å; D159-A183 WeakPolarHBondContact O-CB 3.32Å; A183-R185 PolarHBondContact O-N 3.4Å; A183-R185 VanDerWaalsContact O-N 3.09Å; A183-D186 PolarHBondContact N-OD2 3Å; A183-D186 PolarHBondContact O-N 3.35Å; A183-D186 VanDerWaalsContact O-N 3.16Å; A183-L187 WeakPolarHBondContact O-CG 3.42Å; A183-L187 PolarHBondContact O-N 2.88Å; A183-L187 VanDerWaalsContact O-N 3.08Å
184	G	98.2	Very high	97.5	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.01	17%	0.174	C	C	.	.	H	α-helix	trans	-50.4	-39.4	-172.5	0	0	0	0	0	114.5	G158 D159 L187 T188 K215 T305	G158-G184 PolarHBondContact O-N 3.37Å; G158-G184 VanDerWaalsContact O-N 3.15Å; D159-G184 PolarHBondContact O-N 3.48Å; D159-G184 VanDerWaalsContact O-N 3.17Å; G184-L187 PolarHBondContact O-N 2.71Å; G184-T188 PolarHBondContact O-N 3.47Å; G184-T188 PolarHBondContact O-OG1 3.15Å; G184-K215 PolarHBondContact O-NZ 2.96Å; G184-T305 WeakPolarHBondContact CA-OG1 3.28Å; G184-T305 PolarHBondContact N-OG1 3.19Å
185	R	97.1	Very high	97.6	Very high	45 Å²	45	31.6 Å²	31.6	17%	0.17	15%	0.146	C	C	.	.	H	α-helix	trans	-63.9	-49.3	-178.5	-169.1	169.8	-65.1	179.2	4	111.5	S16 D159 A183 L187 T188 D189 R208	S16-R185 PolarHBondContact O-NH2 3.18Å; D159-R185 VanDerWaalsContact O-CB 3.26Å; D159-R185 WeakPolarHBondContact O-CB 3.26Å; D159-R185 PolarHBondContact O-N 3.3Å; D159-R185 PolarHBondContact OD1-N 3.06Å; D159-R185 IonicContact OD2-CZ 3.62Å; D159-R185 IonicContact OD2-NE 2.9Å; D159-R185 PolarHBondContact OD2-NE 3Å; D159-R185 IonicContact OD2-NH2 2.72Å; D159-R185 PolarHBondContact OD2-NH2 2.97Å; A183-R185 PolarHBondContact O-N 3.4Å; A183-R185 VanDerWaalsContact O-N 3.09Å; R185-L187 VanDerWaalsContact C-N 3.31Å; R185-L187 PolarHBondContact O-N 3.03Å; R185-T188 WeakPolarHBondContact O-CB 3.38Å; R185-T188 PolarHBondContact O-N 3.39Å; R185-T188 VanDerWaalsContact O-N 3.14Å; R185-D189 PolarHBondContact O-N 2.64Å; R185-D189 VanDerWaalsContact O-N 3.13Å; R185-R208 PolarHBondContact O-NH2 3.36Å
186	D	98	Very high	97.7	Very high	42 Å²	42	29.1 Å²	29.1	23%	0.225	14%	0.14	C	C	.	.	H	α-helix	trans	-65.3	-37.2	179.5	-44.5	-75.2	0	0	0	111.1	L182 A183 T188 D189 Y190	L182-D186 WeakPolarHBondContact CA-OD2 3.31Å; L182-D186 HydrophobicContact CD1-CB 3.62Å; A183-D186 PolarHBondContact N-OD2 3Å; A183-D186 PolarHBondContact O-N 3.35Å; A183-D186 VanDerWaalsContact O-N 3.16Å; D186-T188 VanDerWaalsContact C-N 3.32Å; D186-T188 PolarHBondContact O-N 2.96Å; D186-D189 PolarHBondContact O-N 3.37Å; D186-Y190 WeakPolarHBondContact O-CB 3.41Å; D186-Y190 PolarHBondContact O-N 2.88Å
187	L	98.6	Very high	97.5	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-62.8	-38.4	174	-62.6	-173.6	0	0	0	112.1	L182 A183 G184 R185 L191 K215 C259 T262 L263 T305 Y308	L182-L187 HydrophobicContact CD1-CD2 4.18Å; A183-L187 WeakPolarHBondContact O-CG 3.42Å; A183-L187 PolarHBondContact O-N 2.88Å; A183-L187 VanDerWaalsContact O-N 3.08Å; G184-L187 PolarHBondContact O-N 2.71Å; R185-L187 VanDerWaalsContact C-N 3.31Å; R185-L187 PolarHBondContact O-N 3.03Å; L187-L191 WeakPolarHBondContact O-CB 3.36Å; L187-L191 PolarHBondContact O-N 3.1Å; L187-K215 HydrophobicContact CB-CD 3.86Å; L187-C259 PolarHBondContact O-SG 3.21Å; L187-T262 WeakPolarHBondContact CD2-OG1 3.29Å; L187-L263 HydrophobicContact CD1-CD1 4.08Å; L187-L263 HydrophobicContact CD1-CD2 4.2Å; L187-L263 HydrophobicContact CD1-CG 4.1Å; L187-L263 HydrophobicContact CD2-CD2 4.46Å; L187-L263 HydrophobicContact CD2-CG 4.32Å; L187-T305 HydrophobicContact CD1-CG2 3.75Å; L187-Y308 HydrophobicContact CD1-CE2 3.66Å; L187-Y308 WeakPolarHBondContact CD1-OH 3.44Å
188	T	98.3	Very high	97.3	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-63.5	-44.6	174.1	-61.6	0	0	0	0	110.6	G184 R185 D186 L191 M192 R208 V211 R212 K215	G184-T188 PolarHBondContact O-N 3.47Å; G184-T188 PolarHBondContact O-OG1 3.15Å; R185-T188 WeakPolarHBondContact O-CB 3.38Å; R185-T188 PolarHBondContact O-N 3.39Å; R185-T188 VanDerWaalsContact O-N 3.14Å; D186-T188 VanDerWaalsContact C-N 3.32Å; D186-T188 PolarHBondContact O-N 2.96Å; T188-L191 PolarHBondContact O-N 2.65Å; T188-M192 WeakPolarHBondContact O-CG 3.43Å; T188-M192 PolarHBondContact O-N 2.93Å; T188-R208 HydrophobicContact CG2-CG 3.94Å; T188-V211 HydrophobicContact CG2-CB 4.37Å; T188-V211 HydrophobicContact CG2-CG1 4.25Å; T188-R212 HydrophobicContact CG2-CB 4.03Å; T188-K215 PolarHBondContact OG1-NZ 2.81Å
189	D	97.4	Very high	97.2	Very high	69 Å²	69	38.5 Å²	38.5	37%	0.369	20%	0.196	S	C	.	.	H	α-helix	trans	-68.1	-38.6	-178.3	-63.2	-29.7	0	0	0	111.7	R185 D186 M192 K193 R208	R185-D189 PolarHBondContact O-N 2.64Å; R185-D189 VanDerWaalsContact O-N 3.13Å; D186-D189 PolarHBondContact O-N 3.37Å; D189-M192 WeakPolarHBondContact O-CB 3.36Å; D189-M192 PolarHBondContact O-N 3.07Å; D189-K193 PolarHBondContact O-N 2.88Å; D189-K193 VanDerWaalsContact O-N 3.16Å; D189-R208 VanDerWaalsContact CG-NH2 3.27Å; D189-R208 IonicContact OD1-CZ 3.48Å; D189-R208 IonicContact OD1-NE 3.19Å; D189-R208 PolarHBondContact OD1-NE 2.91Å; D189-R208 IonicContact OD1-NH2 2.89Å; D189-R208 PolarHBondContact OD1-NH2 3Å; D189-R208 IonicContact OD2-NH2 3.54Å; D189-R208 PolarHBondContact OD2-NH2 2.85Å; D189-R208 VanDerWaalsContact OD2-NH2 3.15Å
190	Y	98.2	Very high	97.2	Very high	19 Å²	19	37 Å²	37	8%	0.075	19%	0.19	C	C	.	.	H	α-helix	trans	-66	-39.1	172.3	-179.6	-121.5	0	0	0	112.1	D186 M192 K193 I194 C259 T262 I269	D186-Y190 WeakPolarHBondContact O-CB 3.41Å; D186-Y190 PolarHBondContact O-N 2.88Å; Y190-M192 VanDerWaalsContact C-N 3.31Å; Y190-M192 PolarHBondContact O-N 2.79Å; Y190-K193 HydrophobicContact CD2-CD 4.33Å; Y190-K193 WeakPolarHBondContact O-CB 3.36Å; Y190-K193 PolarHBondContact O-N 2.96Å; Y190-K193 VanDerWaalsContact O-N 3.14Å; Y190-I194 HydrophobicContact CD1-CD1 4.35Å; Y190-I194 HydrophobicContact CD2-CG2 4.14Å; Y190-I194 HydrophobicContact CE1-CD1 4.05Å; Y190-I194 HydrophobicContact CE1-CG2 4.12Å; Y190-I194 HydrophobicContact CE2-CG2 3.56Å; Y190-I194 PolarHBondContact O-N 3.28Å; Y190-C259 HydrophobicContact CD1-CB 4.49Å; Y190-T262 HydrophobicContact CD1-CG2 3.39Å; Y190-T262 HydrophobicContact CE1-CG2 3.29Å; Y190-T262 HydrophobicContact CG-CG2 4.14Å; Y190-I269 HydrophobicContact CD1-CG2 4.14Å; Y190-I269 HydrophobicContact CD2-CG2 3.47Å; Y190-I269 VanDerWaalsContact CD2-CG2 3.47Å; Y190-I269 HydrophobicContact CE2-CG2 3.97Å; Y190-I269 HydrophobicContact CG-CG2 3.55Å
191	L	98.5	Very high	97.1	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-61.6	-40.7	174.6	-174.5	59.6	0	0	0	111.3	L187 T188 K193 I194 L195 V211 I214 K215 E255 C259	L187-L191 WeakPolarHBondContact O-CB 3.36Å; L187-L191 PolarHBondContact O-N 3.1Å; T188-L191 PolarHBondContact O-N 2.65Å; L191-K193 VanDerWaalsContact C-N 3.28Å; L191-K193 PolarHBondContact O-N 3.49Å; L191-I194 HydrophobicContact CD1-CD1 3.96Å; L191-I194 HydrophobicContact CD1-CG1 3.98Å; L191-I194 WeakPolarHBondContact O-CG1 3.31Å; L191-I194 PolarHBondContact O-N 3.5Å; L191-L195 HydrophobicContact CD1-CD1 4.2Å; L191-L195 HydrophobicContact CD1-CD2 4.47Å; L191-L195 HydrophobicContact CD1-CG 4Å; L191-L195 HydrophobicContact CD2-CD1 4.44Å; L191-L195 HydrophobicContact CG-CD1 3.83Å; L191-L195 HydrophobicContact CG-CG 4.12Å; L191-L195 VanDerWaalsContact O-CB 3.31Å; L191-L195 WeakPolarHBondContact O-CB 3.46Å; L191-L195 WeakPolarHBondContact O-CG 3.29Å; L191-L195 PolarHBondContact O-N 3.17Å; L191-V211 HydrophobicContact CB-CG1 3.78Å; L191-V211 HydrophobicContact CD2-CG1 3.71Å; L191-V211 HydrophobicContact CG-CG1 3.66Å; L191-I214 HydrophobicContact CD2-CB 4.49Å; L191-I214 HydrophobicContact CD2-CG2 4.1Å; L191-K215 HydrophobicContact CD2-CB 3.6Å; L191-K215 HydrophobicContact CD2-CG 4.23Å; L191-E255 HydrophobicContact CD1-CB 3.9Å; L191-C259 HydrophobicContact CB-CB 4.34Å; L191-C259 HydrophobicContact CD1-CB 4.04Å
192	M	98.1	Very high	97.1	Very high	28 Å²	28	37.8 Å²	37.8	14%	0.138	20%	0.2	C	C	.	.	H	α-helix	trans	-56.8	-43.7	173.9	-68.4	174.3	67.4	0	0	111.4	T188 D189 Y190 T196 F202 R208 V211	T188-M192 WeakPolarHBondContact O-CG 3.43Å; T188-M192 PolarHBondContact O-N 2.93Å; D189-M192 WeakPolarHBondContact O-CB 3.36Å; D189-M192 PolarHBondContact O-N 3.07Å; Y190-M192 VanDerWaalsContact C-N 3.31Å; Y190-M192 PolarHBondContact O-N 2.79Å; M192-T196 PolarHBondContact O-N 3.24Å; M192-T196 PolarHBondContact O-OG1 2.75Å; M192-F202 HydrophobicContact CE-CB 4.2Å; M192-F202 WeakPolarHBondContact CE-O 3.44Å; M192-R208 HydrophobicContact CE-CB 4.34Å; M192-R208 HydrophobicContact SD-CB 3.93Å; M192-R208 HydrophobicContact SD-CG 3.68Å; M192-V211 HydrophobicContact CG-CB 3.83Å; M192-V211 HydrophobicContact CG-CG1 3.67Å; M192-V211 HydrophobicContact CG-CG2 3.82Å
193	K	97.4	Very high	96.9	Very high	117 Å²	117	43.1 Å²	43.1	51%	0.509	23%	0.232	S	C	.	.	H	α-helix	trans	-60.9	-52.9	177.6	-178.8	-174.2	173.3	-173.5	0	111.9	D189 Y190 L191 L195 T196 E197	D189-K193 PolarHBondContact O-N 2.88Å; D189-K193 VanDerWaalsContact O-N 3.16Å; Y190-K193 HydrophobicContact CD2-CD 4.33Å; Y190-K193 WeakPolarHBondContact O-CB 3.36Å; Y190-K193 PolarHBondContact O-N 2.96Å; Y190-K193 VanDerWaalsContact O-N 3.14Å; L191-K193 VanDerWaalsContact C-N 3.28Å; L191-K193 PolarHBondContact O-N 3.49Å; K193-L195 VanDerWaalsContact C-N 3.33Å; K193-L195 PolarHBondContact O-N 2.89Å; K193-T196 WeakPolarHBondContact O-CA 3.32Å; K193-T196 VanDerWaalsContact O-CB 3.3Å; K193-T196 WeakPolarHBondContact O-CB 3.42Å; K193-T196 PolarHBondContact O-N 3.06Å; K193-T196 VanDerWaalsContact O-N 3.08Å; K193-E197 PolarHBondContact O-N 3.42Å
194	I	97.7	Very high	96.6	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-73.9	-23.7	-176.4	65.9	-176.6	0	0	0	113	Y190 L191 T196 E197 R198 E255 R258 C259	Y190-I194 HydrophobicContact CD1-CD1 4.35Å; Y190-I194 HydrophobicContact CD2-CG2 4.14Å; Y190-I194 HydrophobicContact CE1-CD1 4.05Å; Y190-I194 HydrophobicContact CE1-CG2 4.12Å; Y190-I194 HydrophobicContact CE2-CG2 3.56Å; Y190-I194 PolarHBondContact O-N 3.28Å; L191-I194 HydrophobicContact CD1-CD1 3.96Å; L191-I194 HydrophobicContact CD1-CG1 3.98Å; L191-I194 WeakPolarHBondContact O-CG1 3.31Å; L191-I194 PolarHBondContact O-N 3.5Å; I194-T196 VanDerWaalsContact C-N 3.34Å; I194-E197 WeakPolarHBondContact O-CB 3.4Å; I194-E197 PolarHBondContact O-N 3.4Å; I194-R198 PolarHBondContact O-N 3.44Å; I194-E255 HydrophobicContact CB-CG 4.19Å; I194-E255 HydrophobicContact CD1-CB 3.68Å; I194-E255 HydrophobicContact CD1-CG 4.02Å; I194-E255 HydrophobicContact CG1-CB 3.88Å; I194-E255 HydrophobicContact CG1-CG 3.78Å; I194-R258 HydrophobicContact CD1-CB 4.18Å; I194-C259 HydrophobicContact CD1-CB 4.09Å
195	L	98.2	Very high	96.2	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-67.8	-36.4	167.1	-72.4	174.8	0	0	0	111.5	L191 K193 E197 R198 G199 Y200 F202 V211 I214 I252 E255	L191-L195 HydrophobicContact CD1-CD1 4.2Å; L191-L195 HydrophobicContact CD1-CD2 4.47Å; L191-L195 HydrophobicContact CD1-CG 4Å; L191-L195 HydrophobicContact CD2-CD1 4.44Å; L191-L195 HydrophobicContact CG-CD1 3.83Å; L191-L195 HydrophobicContact CG-CG 4.12Å; L191-L195 VanDerWaalsContact O-CB 3.31Å; L191-L195 WeakPolarHBondContact O-CB 3.46Å; L191-L195 WeakPolarHBondContact O-CG 3.29Å; L191-L195 PolarHBondContact O-N 3.17Å; K193-L195 VanDerWaalsContact C-N 3.33Å; K193-L195 PolarHBondContact O-N 2.89Å; L195-E197 VanDerWaalsContact C-N 3.35Å; L195-R198 WeakPolarHBondContact O-CB 3.39Å; L195-R198 PolarHBondContact O-N 3.15Å; L195-R198 VanDerWaalsContact O-N 3.16Å; L195-G199 PolarHBondContact O-N 3.43Å; L195-Y200 CarbonylContact C-O 3.58Å; L195-Y200 PolarHBondContact O-N 3.19Å; L195-F202 HydrophobicContact CB-CD2 4.37Å; L195-F202 HydrophobicContact CB-CE2 4.29Å; L195-F202 HydrophobicContact CD1-CD2 4.16Å; L195-F202 HydrophobicContact CD1-CE2 3.84Å; L195-V211 HydrophobicContact CD1-CG1 3.94Å; L195-V211 HydrophobicContact CD1-CG2 4.06Å; L195-I214 HydrophobicContact CD1-CD1 4.38Å; L195-I252 HydrophobicContact CD2-CD1 3.74Å; L195-I252 HydrophobicContact CD2-CG2 4.25Å; L195-E255 HydrophobicContact CD2-CB 4.47Å; L195-E255 HydrophobicContact CD2-CG 4.36Å
196	T	97.4	Very high	95.9	Very high	66 Å²	66	50.2 Å²	50.2	41%	0.405	29%	0.286	S	S	.	.	H	α-helix	trans	-65.9	-38.6	174.7	-55.6	0	0	0	0	111.1	M192 K193 I194 R198 G199 Y200	M192-T196 PolarHBondContact O-N 3.24Å; M192-T196 PolarHBondContact O-OG1 2.75Å; K193-T196 WeakPolarHBondContact O-CA 3.32Å; K193-T196 VanDerWaalsContact O-CB 3.3Å; K193-T196 WeakPolarHBondContact O-CB 3.42Å; K193-T196 PolarHBondContact O-N 3.06Å; K193-T196 VanDerWaalsContact O-N 3.08Å; I194-T196 VanDerWaalsContact C-N 3.34Å; T196-R198 PolarHBondContact O-N 3.34Å; T196-G199 WeakPolarHBondContact O-CA 3.31Å; T196-G199 PolarHBondContact O-N 3.37Å; T196-Y200 WeakPolarHBondContact CA-O 3.37Å; T196-Y200 PolarHBondContact N-O 3.02Å
197	E	95	Very high	95.8	Very high	109 Å²	109	50.9 Å²	50.9	51%	0.509	29%	0.288	S	S	.	.	H	α-helix	trans	-57.3	-34.5	172.4	-66.8	168.9	-169.7	0	0	112.2	K193 I194 L195 G199 R258	K193-E197 PolarHBondContact O-N 3.42Å; I194-E197 WeakPolarHBondContact O-CB 3.4Å; I194-E197 PolarHBondContact O-N 3.4Å; L195-E197 VanDerWaalsContact C-N 3.35Å; E197-G199 VanDerWaalsContact C-N 3.3Å; E197-R258 IonicContact OE2-CZ 3.9Å; E197-R258 IonicContact OE2-NH1 3.71Å; E197-R258 IonicContact OE2-NH2 3.11Å; E197-R258 PolarHBondContact OE2-NH2 3.17Å; E197-R258 VanDerWaalsContact OE2-NH2 3.11Å
198	R	93	Very high	95.6	Very high	82 Å²	82	52.6 Å²	52.6	31%	0.309	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-13.1	174.8	-161.5	-178.3	-176.9	99.8	2.2	113.5	I194 L195 T196 Y200 E239 T251 E255	I194-R198 PolarHBondContact O-N 3.44Å; L195-R198 WeakPolarHBondContact O-CB 3.39Å; L195-R198 PolarHBondContact O-N 3.15Å; L195-R198 VanDerWaalsContact O-N 3.16Å; T196-R198 PolarHBondContact O-N 3.34Å; R198-Y200 HydrophobicContact CB-CD2 4.47Å; R198-Y200 HydrophobicContact CG-CD2 4.48Å; R198-Y200 HydrophobicContact CG-CE2 4.33Å; R198-E239 IonicContact CZ-OE1 3.87Å; R198-E239 IonicContact NH2-OE1 3.27Å; R198-E239 PolarHBondContact NH2-OE1 2.95Å; R198-T251 WeakPolarHBondContact CD-O 3.17Å; R198-T251 PolarHBondContact NE-O 3.28Å; R198-E255 WeakPolarHBondContact CD-OE1 3.49Å; R198-E255 IonicContact CZ-OE2 2.71Å; R198-E255 IonicContact NH1-OE1 3.82Å; R198-E255 PolarHBondContact NH1-OE1 2.92Å; R198-E255 VanDerWaalsContact NH1-OE1 3.14Å; R198-E255 IonicContact NH1-OE2 3.03Å; R198-E255 PolarHBondContact NH1-OE2 2.9Å; R198-E255 VanDerWaalsContact NH1-OE2 3.15Å
199	G	96	Very high	95.5	Very high	61 Å²	61	54 Å²	54	63%	0.629	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	104.2	5.8	-178.7	0	0	0	0	0	115.2	L195 T196 E197	L195-G199 PolarHBondContact O-N 3.43Å; T196-G199 WeakPolarHBondContact O-CA 3.31Å; T196-G199 PolarHBondContact O-N 3.37Å; E197-G199 VanDerWaalsContact C-N 3.3Å
200	Y	95.8	Very high	95.4	Very high	60 Å²	60	52.2 Å²	52.2	24%	0.235	29%	0.291	C	S	.	.			trans	-101.4	101.8	174.1	-56	-54.8	0	0	0	110.5	L195 T196 R198 I250 T251	L195-Y200 CarbonylContact C-O 3.58Å; L195-Y200 PolarHBondContact O-N 3.19Å; T196-Y200 WeakPolarHBondContact CA-O 3.37Å; T196-Y200 PolarHBondContact N-O 3.02Å; R198-Y200 HydrophobicContact CB-CD2 4.47Å; R198-Y200 HydrophobicContact CG-CD2 4.48Å; R198-Y200 HydrophobicContact CG-CE2 4.33Å; Y200-I250 HydrophobicContact CD1-CB 4.33Å; Y200-I250 HydrophobicContact CD1-CG2 3.85Å; Y200-I250 HydrophobicContact CD2-CB 4.39Å; Y200-I250 HydrophobicContact CE1-CB 3.9Å; Y200-I250 HydrophobicContact CE1-CG2 3.58Å; Y200-I250 HydrophobicContact CE2-CB 3.96Å; Y200-I250 HydrophobicContact CG-CG2 4.42Å; Y200-T251 WeakPolarHBondContact CE2-O 3.2Å; Y200-T251 PolarHBondContact OH-N 3.15Å
201	S	95.1	Very high	95.5	Very high	76 Å²	76	51.3 Å²	51.3	53%	0.531	29%	0.288	S	S	.	.			trans	-91.7	121.7	-178.2	-178.2	0	0	0	0	111.3
202	F	95.5	Very high	95.4	Very high	17 Å²	17	54.8 Å²	54.8	8%	0.075	30%	0.301	C	S	.	.			trans	-118.5	117.7	173.1	-63.3	-80	0	0	0	107.6	M192 L195 E207 I210 V211 I214 L244 I250	M192-F202 HydrophobicContact CE-CB 4.2Å; M192-F202 WeakPolarHBondContact CE-O 3.44Å; L195-F202 HydrophobicContact CB-CD2 4.37Å; L195-F202 HydrophobicContact CB-CE2 4.29Å; L195-F202 HydrophobicContact CD1-CD2 4.16Å; L195-F202 HydrophobicContact CD1-CE2 3.84Å; F202-E207 HydrophobicContact CB-CB 3.93Å; F202-E207 HydrophobicContact CD1-CB 3.84Å; F202-E207 HydrophobicContact CD1-CG 4.09Å; F202-E207 HydrophobicContact CG-CB 4.37Å; F202-I210 HydrophobicContact CE1-CG2 4.41Å; F202-V211 HydrophobicContact CB-CG2 3.82Å; F202-V211 HydrophobicContact CD1-CG2 4.04Å; F202-V211 HydrophobicContact CD2-CG2 3.49Å; F202-V211 VanDerWaalsContact CD2-CG2 3.49Å; F202-V211 HydrophobicContact CE1-CG2 4.48Å; F202-V211 HydrophobicContact CE2-CG2 4.01Å; F202-V211 HydrophobicContact CG-CG2 3.5Å; F202-V211 VanDerWaalsContact CG-CG2 3.5Å; F202-V211 HydrophobicContact CZ-CG2 4.46Å; F202-I214 HydrophobicContact CZ-CD1 4.46Å; F202-L244 HydrophobicContact CE1-CD2 4.04Å; F202-L244 HydrophobicContact CZ-CD2 4.1Å; F202-I250 HydrophobicContact CZ-CD1 3.98Å
203	V	93.4	Very high	95.4	Very high	113 Å²	113	55.2 Å²	55.2	69%	0.685	30%	0.303	S	S	*	.			trans	-122.6	-27.1	-169.9	-65.3	0	0	0	0	113.2	E207	V203-E207 PolarHBondContact N-OE2 3.4Å
204	T	92.4	Very high	95.5	Very high	66 Å²	66	49.6 Å²	49.6	41%	0.405	28%	0.279	S	S	.	.	S	Bend	trans	-86.8	159.8	-177.7	69.8	0	0	0	0	111.9	A206 E207 R208	T204-A206 PolarHBondContact O-N 3.03Å; T204-E207 WeakPolarHBondContact CG2-OE2 3.49Å; T204-E207 PolarHBondContact N-OE2 3.48Å; T204-E207 PolarHBondContact O-N 3.17Å; T204-E207 WeakPolarHBondContact OG1-CB 3.41Å; T204-E207 VanDerWaalsContact OG1-CD 3.27Å; T204-E207 WeakPolarHBondContact OG1-CG 3.44Å; T204-E207 PolarHBondContact OG1-N 3.01Å; T204-E207 VanDerWaalsContact OG1-N 3.13Å; T204-E207 PolarHBondContact OG1-OE2 2.87Å; T204-R208 PolarHBondContact O-N 3.34Å
205	T	89.3	Confident	95.5	Very high	76 Å²	76	50 Å²	50	47%	0.466	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-17.6	175.6	59.9	0	0	0	0	113.5	R64	R64-T205 WeakPolarHBondContact CD-O 3.4Å; R64-T205 PolarHBondContact NH1-O 3.49Å
206	A	91.2	Very high	95.5	Very high	54 Å²	54	55.4 Å²	55.4	45%	0.446	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-44.4	172.8	0	0	0	0	0	110.5	T204 R208 E209 I210	T204-A206 PolarHBondContact O-N 3.03Å; A206-R208 PolarHBondContact O-N 2.84Å; A206-E209 WeakPolarHBondContact O-CB 3.36Å; A206-E209 PolarHBondContact O-N 2.96Å; A206-I210 PolarHBondContact O-N 3.03Å
207	E	94.8	Very high	95.6	Very high	56 Å²	56	58.7 Å²	58.7	26%	0.262	32%	0.315	S	S	.	.	H	α-helix	trans	-60.5	-34.3	173.5	-77.3	166.3	163.6	0	0	112.5	F202 V203 T204 E209 I210 V211	F202-E207 HydrophobicContact CB-CB 3.93Å; F202-E207 HydrophobicContact CD1-CB 3.84Å; F202-E207 HydrophobicContact CD1-CG 4.09Å; F202-E207 HydrophobicContact CG-CB 4.37Å; V203-E207 PolarHBondContact N-OE2 3.4Å; T204-E207 WeakPolarHBondContact CG2-OE2 3.49Å; T204-E207 PolarHBondContact N-OE2 3.48Å; T204-E207 PolarHBondContact O-N 3.17Å; T204-E207 WeakPolarHBondContact OG1-CB 3.41Å; T204-E207 VanDerWaalsContact OG1-CD 3.27Å; T204-E207 WeakPolarHBondContact OG1-CG 3.44Å; T204-E207 PolarHBondContact OG1-N 3.01Å; T204-E207 VanDerWaalsContact OG1-N 3.13Å; T204-E207 PolarHBondContact OG1-OE2 2.87Å; E207-E209 PolarHBondContact O-N 3.34Å; E207-I210 HydrophobicContact CG-CD1 4.49Å; E207-I210 WeakPolarHBondContact O-CA 3.49Å; E207-I210 VanDerWaalsContact O-CB 3.28Å; E207-I210 WeakPolarHBondContact O-CB 3.39Å; E207-I210 PolarHBondContact O-N 3.19Å; E207-V211 PolarHBondContact O-N 3.06Å
208	R	95.3	Very high	95.7	Very high	35 Å²	35	54.8 Å²	54.8	13%	0.132	30%	0.297	C	S	.	.	H	α-helix	trans	-55.1	-33.9	171.5	-176.1	175.7	-169.5	-71.5	-6.9	113.2	R185 T188 D189 M192 T204 A206 V211 R212	R185-R208 PolarHBondContact O-NH2 3.36Å; T188-R208 HydrophobicContact CG2-CG 3.94Å; D189-R208 VanDerWaalsContact CG-NH2 3.27Å; D189-R208 IonicContact OD1-CZ 3.48Å; D189-R208 IonicContact OD1-NE 3.19Å; D189-R208 PolarHBondContact OD1-NE 2.91Å; D189-R208 IonicContact OD1-NH2 2.89Å; D189-R208 PolarHBondContact OD1-NH2 3Å; D189-R208 IonicContact OD2-NH2 3.54Å; D189-R208 PolarHBondContact OD2-NH2 2.85Å; D189-R208 VanDerWaalsContact OD2-NH2 3.15Å; M192-R208 HydrophobicContact CE-CB 4.34Å; M192-R208 HydrophobicContact SD-CB 3.93Å; M192-R208 HydrophobicContact SD-CG 3.68Å; T204-R208 PolarHBondContact O-N 3.34Å; A206-R208 PolarHBondContact O-N 2.84Å; R208-V211 PolarHBondContact O-N 3.13Å; R208-R212 PolarHBondContact O-N 3.15Å
209	E	95	Very high	96	Very high	30 Å²	30	51 Å²	51	14%	0.14	28%	0.283	C	S	.	.	H	α-helix	trans	-73.3	-32	177.1	-62.2	-63.6	151.1	0	0	112.3	Q61 R64 A206 E207 V211 R212 D213	Q61-E209 VanDerWaalsContact NE2-CG 3.26Å; Q61-E209 PolarHBondContact NE2-OE1 2.79Å; Q61-E209 PolarHBondContact NE2-OE2 3.43Å; R64-E209 IonicContact CZ-OE1 3.19Å; R64-E209 IonicContact NH1-OE1 2.91Å; R64-E209 PolarHBondContact NH1-OE1 2.97Å; R64-E209 IonicContact NH2-OE1 2.68Å; R64-E209 PolarHBondContact NH2-OE1 3.07Å; R64-E209 VanDerWaalsContact NH2-OE1 3.15Å; A206-E209 WeakPolarHBondContact O-CB 3.36Å; A206-E209 PolarHBondContact O-N 2.96Å; E207-E209 PolarHBondContact O-N 3.34Å; E209-V211 VanDerWaalsContact C-N 3.31Å; E209-R212 PolarHBondContact O-N 3.11Å; E209-R212 IonicContact OE2-CZ 3.4Å; E209-R212 IonicContact OE2-NE 3.98Å; E209-R212 PolarHBondContact OE2-NE 2.86Å; E209-R212 IonicContact OE2-NH2 3.15Å; E209-D213 PolarHBondContact O-N 2.75Å
210	I	97	Very high	96.1	Very high	32 Å²	32	49.6 Å²	49.6	16%	0.164	26%	0.259	C	S	.	.	H	α-helix	trans	-62	-45.6	170.3	-54.4	173.5	0	0	0	108.8	F202 A206 E207 R212 D213 I214 Y242 L244 P245	F202-I210 HydrophobicContact CE1-CG2 4.41Å; A206-I210 PolarHBondContact O-N 3.03Å; E207-I210 HydrophobicContact CG-CD1 4.49Å; E207-I210 WeakPolarHBondContact O-CA 3.49Å; E207-I210 VanDerWaalsContact O-CB 3.28Å; E207-I210 WeakPolarHBondContact O-CB 3.39Å; E207-I210 PolarHBondContact O-N 3.19Å; I210-R212 VanDerWaalsContact C-N 3.34Å; I210-R212 PolarHBondContact O-N 3.39Å; I210-D213 PolarHBondContact O-N 3.38Å; I210-D213 VanDerWaalsContact O-N 3.14Å; I210-I214 HydrophobicContact CG2-CD1 4.12Å; I210-I214 WeakPolarHBondContact O-CG1 3.34Å; I210-I214 PolarHBondContact O-N 2.89Å; I210-Y242 HydrophobicContact CG2-CE1 3.84Å; I210-L244 HydrophobicContact CG2-CD2 3.68Å; I210-P245 HydrophobicContact CD1-CG 3.86Å; I210-P245 HydrophobicContact CG1-CG 4.16Å
211	V	98.4	Very high	96.3	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-65.2	-37.1	178	-178.6	0	0	0	0	112.1	T188 L191 M192 L195 F202 E207 R208 E209 D213 I214 K215	T188-V211 HydrophobicContact CG2-CB 4.37Å; T188-V211 HydrophobicContact CG2-CG1 4.25Å; L191-V211 HydrophobicContact CB-CG1 3.78Å; L191-V211 HydrophobicContact CD2-CG1 3.71Å; L191-V211 HydrophobicContact CG-CG1 3.66Å; M192-V211 HydrophobicContact CG-CB 3.83Å; M192-V211 HydrophobicContact CG-CG1 3.67Å; M192-V211 HydrophobicContact CG-CG2 3.82Å; L195-V211 HydrophobicContact CD1-CG1 3.94Å; L195-V211 HydrophobicContact CD1-CG2 4.06Å; F202-V211 HydrophobicContact CB-CG2 3.82Å; F202-V211 HydrophobicContact CD1-CG2 4.04Å; F202-V211 HydrophobicContact CD2-CG2 3.49Å; F202-V211 VanDerWaalsContact CD2-CG2 3.49Å; F202-V211 HydrophobicContact CE1-CG2 4.48Å; F202-V211 HydrophobicContact CE2-CG2 4.01Å; F202-V211 HydrophobicContact CG-CG2 3.5Å; F202-V211 VanDerWaalsContact CG-CG2 3.5Å; F202-V211 HydrophobicContact CZ-CG2 4.46Å; E207-V211 PolarHBondContact O-N 3.06Å; R208-V211 PolarHBondContact O-N 3.13Å; E209-V211 VanDerWaalsContact C-N 3.31Å; V211-D213 VanDerWaalsContact C-N 3.34Å; V211-D213 PolarHBondContact O-N 2.93Å; V211-I214 PolarHBondContact O-N 3.49Å; V211-K215 WeakPolarHBondContact O-CB 3.46Å; V211-K215 PolarHBondContact O-N 3.08Å
212	R	97.8	Very high	96.5	Very high	72 Å²	72	43.4 Å²	43.4	27%	0.272	22%	0.224	S	C	.	.	H	α-helix	trans	-60.1	-43.4	171.2	-172.8	-171.5	62.2	71.5	5.5	111.6	T188 R208 E209 I210 K215 E216	T188-R212 HydrophobicContact CG2-CB 4.03Å; R208-R212 PolarHBondContact O-N 3.15Å; E209-R212 PolarHBondContact O-N 3.11Å; E209-R212 IonicContact OE2-CZ 3.4Å; E209-R212 IonicContact OE2-NE 3.98Å; E209-R212 PolarHBondContact OE2-NE 2.86Å; E209-R212 IonicContact OE2-NH2 3.15Å; I210-R212 VanDerWaalsContact C-N 3.34Å; I210-R212 PolarHBondContact O-N 3.39Å; R212-K215 WeakPolarHBondContact O-CB 3.33Å; R212-K215 PolarHBondContact O-N 2.94Å; R212-E216 WeakPolarHBondContact CG-OE1 3.31Å; R212-E216 IonicContact CZ-OE1 2.63Å; R212-E216 IonicContact NH1-OE1 2.95Å; R212-E216 PolarHBondContact NH1-OE1 3.22Å; R212-E216 IonicContact NH1-OE2 3.22Å; R212-E216 PolarHBondContact NH1-OE2 2.8Å; R212-E216 WeakPolarHBondContact O-CG 3.31Å; R212-E216 PolarHBondContact O-N 2.8Å
213	D	98.1	Very high	96.6	Very high	37 Å²	37	46.9 Å²	46.9	20%	0.198	24%	0.243	C	C	.	.	H	α-helix	trans	-67.3	-41.1	178	-175.7	75.5	0	0	0	112.3	E209 I210 V211 K215 E216 K217 Y242	E209-D213 PolarHBondContact O-N 2.75Å; I210-D213 PolarHBondContact O-N 3.38Å; I210-D213 VanDerWaalsContact O-N 3.14Å; V211-D213 VanDerWaalsContact C-N 3.34Å; V211-D213 PolarHBondContact O-N 2.93Å; D213-K215 VanDerWaalsContact C-N 3.3Å; D213-K215 PolarHBondContact O-N 3.48Å; D213-E216 PolarHBondContact O-N 2.9Å; D213-K217 VanDerWaalsContact CG-NZ 3.28Å; D213-K217 WeakPolarHBondContact O-CB 3.45Å; D213-K217 WeakPolarHBondContact O-CG 3.45Å; D213-K217 PolarHBondContact O-N 2.97Å; D213-K217 WeakPolarHBondContact OD1-CE 3.48Å; D213-K217 IonicContact OD1-NZ 2.79Å; D213-K217 PolarHBondContact OD1-NZ 2.87Å; D213-K217 WeakPolarHBondContact OD2-CD 3.4Å; D213-K217 VanDerWaalsContact OD2-CE 3.31Å; D213-K217 WeakPolarHBondContact OD2-CE 3.44Å; D213-K217 IonicContact OD2-NZ 3.55Å; D213-K217 PolarHBondContact OD2-NZ 3.19Å; D213-Y242 VanDerWaalsContact OD2-CE2 3.28Å; D213-Y242 WeakPolarHBondContact OD2-CE2 3.3Å; D213-Y242 VanDerWaalsContact OD2-CZ 3.31Å; D213-Y242 PolarHBondContact OD2-OH 3.28Å
214	I	98.6	Very high	96.8	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-55.6	-48.6	171.1	-69.1	167.1	0	0	0	110.1	L191 L195 F202 I210 V211 K217 L218 Y242 I250 I252	L191-I214 HydrophobicContact CD2-CB 4.49Å; L191-I214 HydrophobicContact CD2-CG2 4.1Å; L195-I214 HydrophobicContact CD1-CD1 4.38Å; F202-I214 HydrophobicContact CZ-CD1 4.46Å; I210-I214 HydrophobicContact CG2-CD1 4.12Å; I210-I214 WeakPolarHBondContact O-CG1 3.34Å; I210-I214 PolarHBondContact O-N 2.89Å; V211-I214 PolarHBondContact O-N 3.49Å; I214-K217 PolarHBondContact O-N 2.87Å; I214-L218 HydrophobicContact CG2-CD1 4.36Å; I214-L218 WeakPolarHBondContact O-CB 3.19Å; I214-L218 PolarHBondContact O-N 3.01Å; I214-Y242 HydrophobicContact CB-CE2 4.49Å; I214-Y242 HydrophobicContact CD1-CD1 4.01Å; I214-Y242 HydrophobicContact CD1-CE1 4.14Å; I214-Y242 HydrophobicContact CD1-CG 4.33Å; I214-Y242 HydrophobicContact CG1-CD1 3.74Å; I214-Y242 HydrophobicContact CG1-CD2 3.68Å; I214-Y242 HydrophobicContact CG1-CE1 3.73Å; I214-Y242 HydrophobicContact CG1-CE2 3.65Å; I214-Y242 HydrophobicContact CG1-CG 3.71Å; I214-I250 HydrophobicContact CD1-CD1 3.99Å; I214-I252 HydrophobicContact CG2-CD1 4.35Å; I214-I252 HydrophobicContact CG2-CG1 3.99Å; I214-I252 HydrophobicContact CG2-CG2 4.46Å
215	K	98.6	Very high	97.1	Very high	7 Å²	7	42.3 Å²	42.3	3%	0.03	21%	0.212	C	C	.	.	H	α-helix	trans	-57.1	-52.6	179.3	-173.8	-169.6	73.6	-176.7	0	111.3	G184 L187 T188 L191 V211 R212 D213 K217 C219 Y308	G184-K215 PolarHBondContact O-NZ 2.96Å; L187-K215 HydrophobicContact CB-CD 3.86Å; T188-K215 PolarHBondContact OG1-NZ 2.81Å; L191-K215 HydrophobicContact CD2-CB 3.6Å; L191-K215 HydrophobicContact CD2-CG 4.23Å; V211-K215 WeakPolarHBondContact O-CB 3.46Å; V211-K215 PolarHBondContact O-N 3.08Å; R212-K215 WeakPolarHBondContact O-CB 3.33Å; R212-K215 PolarHBondContact O-N 2.94Å; D213-K215 VanDerWaalsContact C-N 3.3Å; D213-K215 PolarHBondContact O-N 3.48Å; K215-K217 VanDerWaalsContact C-N 3.33Å; K215-K217 PolarHBondContact O-N 3.35Å; K215-C219 HydrophobicContact CG-CB 4.47Å; K215-C219 WeakPolarHBondContact O-CB 3.33Å; K215-C219 PolarHBondContact O-N 3.27Å; K215-C219 VanDerWaalsContact O-N 3.15Å; K215-Y308 VanDerWaalsContact CD-OH 3.24Å; K215-Y308 WeakPolarHBondContact CD-OH 3.35Å; K215-Y308 HydrophobicContact CG-CE1 4.29Å; K215-Y308 WeakPolarHBondContact CG-OH 3.21Å
216	E	98.2	Very high	97.5	Very high	114 Å²	114	44.6 Å²	44.6	53%	0.533	22%	0.217	S	C	.	.	H	α-helix	trans	-67.2	-32.4	-176.8	-72.6	173.3	-158.9	0	0	113	R212 D213	R212-E216 WeakPolarHBondContact CG-OE1 3.31Å; R212-E216 IonicContact CZ-OE1 2.63Å; R212-E216 IonicContact NH1-OE1 2.95Å; R212-E216 PolarHBondContact NH1-OE1 3.22Å; R212-E216 IonicContact NH1-OE2 3.22Å; R212-E216 PolarHBondContact NH1-OE2 2.8Å; R212-E216 WeakPolarHBondContact O-CG 3.31Å; R212-E216 PolarHBondContact O-N 2.8Å; D213-E216 PolarHBondContact O-N 2.9Å
217	K	98.3	Very high	97.8	Very high	135 Å²	135	46.7 Å²	46.7	59%	0.587	22%	0.221	S	C	*	.	H	α-helix	trans	-85.5	-37.6	-178.9	-74	177.5	179.5	160.3	0	114.2	D213 I214 K215 Y242	D213-K217 VanDerWaalsContact CG-NZ 3.28Å; D213-K217 WeakPolarHBondContact O-CB 3.45Å; D213-K217 WeakPolarHBondContact O-CG 3.45Å; D213-K217 PolarHBondContact O-N 2.97Å; D213-K217 WeakPolarHBondContact OD1-CE 3.48Å; D213-K217 IonicContact OD1-NZ 2.79Å; D213-K217 PolarHBondContact OD1-NZ 2.87Å; D213-K217 WeakPolarHBondContact OD2-CD 3.4Å; D213-K217 VanDerWaalsContact OD2-CE 3.31Å; D213-K217 WeakPolarHBondContact OD2-CE 3.44Å; D213-K217 IonicContact OD2-NZ 3.55Å; D213-K217 PolarHBondContact OD2-NZ 3.19Å; I214-K217 PolarHBondContact O-N 2.87Å; K215-K217 VanDerWaalsContact C-N 3.33Å; K215-K217 PolarHBondContact O-N 3.35Å; K217-Y242 HydrophobicContact CD-CE2 4.27Å
218	L	98.5	Very high	98	Very high	27 Å²	27	45.8 Å²	45.8	14%	0.141	22%	0.217	C	C	.	.	H	α-helix	trans	-115.1	-24.4	-164.3	-58.3	-172.5	0	0	0	114.3	I214 K240 Y242 I252 R256	I214-L218 HydrophobicContact CG2-CD1 4.36Å; I214-L218 WeakPolarHBondContact O-CB 3.19Å; I214-L218 PolarHBondContact O-N 3.01Å; L218-K240 HydrophobicContact CD1-CB 4.2Å; L218-K240 HydrophobicContact CD2-CB 4.22Å; L218-Y242 HydrophobicContact CD1-CD2 4.03Å; L218-Y242 HydrophobicContact CD1-CG 4.43Å; L218-I252 HydrophobicContact CD1-CB 4.35Å; L218-I252 HydrophobicContact CD1-CG1 3.88Å; L218-R256 HydrophobicContact CB-CG 4.41Å; L218-R256 PolarHBondContact O-NE 3.18Å; L218-R256 PolarHBondContact O-NH2 2.92Å
219	C	98.8	Very high	98.1	Very high	3 Å²	3	46.8 Å²	46.8	2%	0.02	22%	0.224	C	C	.	.			trans	-77.3	152.7	-178.4	-68.3	0	0	0	0	112.5	K215 R256 P260 Y308	K215-C219 HydrophobicContact CG-CB 4.47Å; K215-C219 WeakPolarHBondContact O-CB 3.33Å; K215-C219 PolarHBondContact O-N 3.27Å; K215-C219 VanDerWaalsContact O-N 3.15Å; C219-R256 CarbonylContact C-O 3.16Å; C219-R256 WeakPolarHBondContact CA-O 3.49Å; C219-R256 WeakPolarHBondContact CB-O 3.46Å; C219-R256 PolarHBondContact SG-O 3Å; C219-R256 VanDerWaalsContact SG-O 3.35Å; C219-P260 HydrophobicContact CB-CG 4.4Å; C219-Y308 HydrophobicContact CB-CD1 4.1Å; C219-Y308 HydrophobicContact CB-CE1 3.58Å
220	Y	98.8	Very high	98.3	Very high	32 Å²	32	48.1 Å²	48.1	13%	0.125	24%	0.24	C	C	.	.			trans	-156.6	158.5	-179.2	65.5	-81.9	0	0	0	110	E228 R256 F257 P260	Y220-E228 PolarHBondContact OH-OE1 3.21Å; Y220-R256 HydrophobicContact CD1-CB 4.07Å; Y220-R256 HydrophobicContact CE1-CB 3.74Å; Y220-R256 PolarHBondContact N-O 3.26Å; Y220-F257 HydrophobicContact CD2-CB 4.4Å; Y220-F257 HydrophobicContact CE1-CB 4.28Å; Y220-F257 HydrophobicContact CE1-CD1 4.39Å; Y220-F257 HydrophobicContact CE2-CB 3.99Å; Y220-F257 AromaticContact CZ-CD1 3.89Å; Y220-F257 VanDerWaalsContact O-CA 3.29Å; Y220-F257 WeakPolarHBondContact O-CA 3.16Å; Y220-F257 WeakPolarHBondContact O-CB 3.23Å; Y220-F257 WeakPolarHBondContact OH-CD1 3.45Å; Y220-P260 WeakPolarHBondContact O-CG 3.21Å
221	V	98.9	Very high	98.3	Very high	4 Å²	4	48.6 Å²	48.6	2%	0.024	24%	0.244	C	C	.	.			trans	-90.7	124.1	176.4	173.1	0	0	0	0	109.1	P260 F264 Y308 P309 I311 R314	V221-P260 HydrophobicContact CG2-CB 3.89Å; V221-P260 HydrophobicContact CG2-CG 4.31Å; V221-F264 HydrophobicContact CG1-CD2 4.36Å; V221-F264 HydrophobicContact CG1-CE2 3.6Å; V221-F264 HydrophobicContact CG1-CZ 4.03Å; V221-F264 HydrophobicContact CG2-CE2 4.06Å; V221-Y308 HydrophobicContact CG2-CD2 4.41Å; V221-Y308 HydrophobicContact CG2-CG 4.36Å; V221-P309 PolarHBondContact N-O 2.91Å; V221-I311 HydrophobicContact CB-CB 4.27Å; V221-I311 HydrophobicContact CG2-CB 3.92Å; V221-I311 HydrophobicContact CG2-CG1 4.09Å; V221-R314 HydrophobicContact CG1-CB 3.49Å; V221-R314 VanDerWaalsContact CG1-CB 3.49Å; V221-R314 HydrophobicContact CG1-CG 3.7Å
222	A	98.6	Very high	98.2	Very high	1 Å²	1	49.8 Å²	49.8	1%	0.008	25%	0.254	C	S	.	.			trans	-72.9	141.7	172.4	0	0	0	0	0	110.7	D224 E228 F257 R314	A222-D224 VanDerWaalsContact C-N 3.33Å; A222-E228 HydrophobicContact CB-CB 3.72Å; A222-E228 HydrophobicContact CB-CG 3.79Å; A222-F257 HydrophobicContact CB-CB 4.23Å; A222-F257 HydrophobicContact CB-CD2 4.33Å; A222-F257 HydrophobicContact CB-CG 4.47Å; A222-R314 WeakPolarHBondContact O-CD 3.42Å; A222-R314 PolarHBondContact O-NH1 2.89Å
223	L	98.5	Very high	98.2	Very high	90 Å²	90	50.8 Å²	50.8	47%	0.471	28%	0.278	S	S	.	.	S	Bend	trans	-70.2	-33.8	174.6	-176	65.1	0	0	0	111.7	D313 R314 K317	L223-D313 HydrophobicContact CD1-CB 4.14Å; L223-R314 WeakPolarHBondContact O-CD 3.38Å; L223-K317 HydrophobicContact CD1-CB 4.09Å; L223-K317 HydrophobicContact CD1-CD 3.89Å; L223-K317 HydrophobicContact CG-CD 4.15Å; L223-K317 WeakPolarHBondContact O-CD 3.34Å; L223-K317 PolarHBondContact O-NZ 3.48Å
224	D	98.4	Very high	98.1	Very high	67 Å²	67	53.9 Å²	53.9	36%	0.358	30%	0.303	S	S	.	.	S	Bend	trans	-137.7	104.5	175.6	-166.9	-61.4	0	0	0	108.7	A222 E226 N227 E228 K317	A222-D224 VanDerWaalsContact C-N 3.33Å; D224-E226 PolarHBondContact O-N 2.66Å; D224-E226 PolarHBondContact OD1-N 2.82Å; D224-N227 HydrophobicContact CB-CB 3.99Å; D224-N227 PolarHBondContact O-N 3.16Å; D224-N227 PolarHBondContact OD1-N 3.31Å; D224-N227 VanDerWaalsContact OD1-N 3.08Å; D224-E228 WeakPolarHBondContact O-CB 3.36Å; D224-E228 PolarHBondContact O-N 3Å; D224-K317 IonicContact OD2-NZ 3.32Å; D224-K317 PolarHBondContact OD2-NZ 2.9Å; D224-K317 VanDerWaalsContact OD2-NZ 3.13Å
225	F	98.1	Very high	97.9	Very high	17 Å²	17	56.2 Å²	56.2	8%	0.075	32%	0.319	C	S	.	.	H	α-helix	trans	-61	-43.6	-172.3	178.1	-102.9	0	0	0	112.6	E228 M229 F257 R258 E261 F268	F225-E228 PolarHBondContact O-N 3.19Å; F225-M229 HydrophobicContact CD1-CG 4.26Å; F225-M229 HydrophobicContact CE1-CG 3.78Å; F225-M229 HydrophobicContact CE2-CG 4.12Å; F225-M229 HydrophobicContact CE2-SD 4.36Å; F225-M229 HydrophobicContact CZ-CG 3.7Å; F225-M229 HydrophobicContact CZ-SD 4.01Å; F225-M229 WeakPolarHBondContact O-CB 3.44Å; F225-M229 WeakPolarHBondContact O-CG 3.28Å; F225-M229 PolarHBondContact O-N 3.3Å; F225-F257 AromaticContact CD2-CD2 3.91Å; F225-F257 HydrophobicContact CD2-CD2 3.91Å; F225-F257 HydrophobicContact CD2-CE2 4.15Å; F225-F257 AromaticContact CE2-CD2 3.84Å; F225-F257 HydrophobicContact CE2-CD2 3.84Å; F225-F257 AromaticContact CE2-CE2 3.92Å; F225-F257 HydrophobicContact CE2-CE2 3.92Å; F225-R258 HydrophobicContact CE2-CG 3.97Å; F225-R258 HydrophobicContact CZ-CG 4.09Å; F225-E261 HydrophobicContact CB-CG 4.41Å; F225-E261 HydrophobicContact CD1-CG 4.36Å; F225-E261 HydrophobicContact CD2-CB 3.8Å; F225-E261 HydrophobicContact CD2-CG 3.41Å; F225-E261 VanDerWaalsContact CD2-CG 3.41Å; F225-E261 HydrophobicContact CE2-CB 3.79Å; F225-E261 HydrophobicContact CE2-CG 3.67Å; F225-E261 HydrophobicContact CG-CG 3.8Å; F225-E261 HydrophobicContact CZ-CG 4.24Å; F225-F268 AromaticContact CE1-CE2 3.82Å; F225-F268 HydrophobicContact CE1-CE2 3.82Å; F225-F268 AromaticContact CE1-CZ 3.88Å; F225-F268 HydrophobicContact CE1-CZ 3.88Å; F225-F268 HydrophobicContact CE2-CE2 4.37Å; F225-F268 AromaticContact CZ-CE2 3.69Å; F225-F268 HydrophobicContact CZ-CE2 3.69Å; F225-F268 HydrophobicContact CZ-CZ 4.19Å
226	E	97.9	Very high	97.7	Very high	124 Å²	124	59.9 Å²	59.9	58%	0.579	35%	0.345	S	S	*	.	H	α-helix	trans	-67.8	-41.6	-177.7	-62.9	-57.2	150.1	0	0	111.6	D224 M229 A230	D224-E226 PolarHBondContact O-N 2.66Å; D224-E226 PolarHBondContact OD1-N 2.82Å; E226-M229 WeakPolarHBondContact O-CB 3.35Å; E226-M229 PolarHBondContact O-N 2.91Å; E226-A230 PolarHBondContact O-N 2.85Å
227	N	97.9	Very high	97.6	Very high	98 Å²	98	58.3 Å²	58.3	52%	0.524	35%	0.347	S	S	.	.	H	α-helix	trans	-65.8	-38.8	175	-177	59	0	0	0	112.2	D224 A230 T231	D224-N227 HydrophobicContact CB-CB 3.99Å; D224-N227 PolarHBondContact O-N 3.16Å; D224-N227 PolarHBondContact OD1-N 3.31Å; D224-N227 VanDerWaalsContact OD1-N 3.08Å; N227-A230 PolarHBondContact O-N 3.25Å; N227-T231 PolarHBondContact O-N 2.96Å; N227-T231 PolarHBondContact O-OG1 3.13Å
228	E	98.2	Very high	97.5	Very high	37 Å²	37	53.1 Å²	53.1	17%	0.173	33%	0.325	C	S	.	.	H	α-helix	trans	-65.3	-39.7	175.8	-154.5	77.3	-139.6	0	0	111.1	Y220 A222 D224 F225 T231 A232 L238 F257	Y220-E228 PolarHBondContact OH-OE1 3.21Å; A222-E228 HydrophobicContact CB-CB 3.72Å; A222-E228 HydrophobicContact CB-CG 3.79Å; D224-E228 WeakPolarHBondContact O-CB 3.36Å; D224-E228 PolarHBondContact O-N 3Å; F225-E228 PolarHBondContact O-N 3.19Å; E228-T231 PolarHBondContact O-N 2.83Å; E228-A232 WeakPolarHBondContact O-CB 3.47Å; E228-A232 PolarHBondContact O-N 2.95Å; E228-L238 HydrophobicContact CG-CD1 4Å; E228-L238 VanDerWaalsContact OE1-CD1 3.24Å; E228-L238 WeakPolarHBondContact OE1-CD1 3.39Å; E228-L238 VanDerWaalsContact OE1-CD2 3.31Å; E228-L238 WeakPolarHBondContact OE1-CD2 3.38Å; E228-F257 HydrophobicContact CB-CD2 4.08Å; E228-F257 HydrophobicContact CB-CE1 4.41Å; E228-F257 HydrophobicContact CB-CE2 3.81Å; E228-F257 HydrophobicContact CB-CZ 3.98Å; E228-F257 HydrophobicContact CG-CD1 3.72Å; E228-F257 HydrophobicContact CG-CD2 3.92Å; E228-F257 HydrophobicContact CG-CE1 3.66Å; E228-F257 HydrophobicContact CG-CE2 3.88Å; E228-F257 HydrophobicContact CG-CG 3.84Å; E228-F257 HydrophobicContact CG-CZ 3.74Å
229	M	98	Very high	97.4	Very high	55 Å²	55	55.5 Å²	55.5	27%	0.271	34%	0.336	S	S	.	.	H	α-helix	trans	-60.5	-46	172.5	-79	-60	-65	0	0	112.2	F225 E226 T231 A232 A233 N254 F257 R258	F225-M229 HydrophobicContact CD1-CG 4.26Å; F225-M229 HydrophobicContact CE1-CG 3.78Å; F225-M229 HydrophobicContact CE2-CG 4.12Å; F225-M229 HydrophobicContact CE2-SD 4.36Å; F225-M229 HydrophobicContact CZ-CG 3.7Å; F225-M229 HydrophobicContact CZ-SD 4.01Å; F225-M229 WeakPolarHBondContact O-CB 3.44Å; F225-M229 WeakPolarHBondContact O-CG 3.28Å; F225-M229 PolarHBondContact O-N 3.3Å; E226-M229 WeakPolarHBondContact O-CB 3.35Å; E226-M229 PolarHBondContact O-N 2.91Å; M229-T231 VanDerWaalsContact C-N 3.31Å; M229-T231 PolarHBondContact O-N 2.78Å; M229-A232 PolarHBondContact O-N 3.12Å; M229-A233 WeakPolarHBondContact O-CB 3.37Å; M229-A233 PolarHBondContact O-N 3.09Å; M229-N254 HydrophobicContact SD-CB 4.29Å; M229-F257 HydrophobicContact CG-CE2 3.82Å; M229-F257 HydrophobicContact CG-CZ 4.29Å; M229-F257 HydrophobicContact SD-CE2 3.56Å; M229-F257 VanDerWaalsContact SD-CE2 3.56Å; M229-F257 HydrophobicContact SD-CZ 3.76Å; M229-R258 HydrophobicContact SD-CG 3.92Å
230	A	98.1	Very high	97.4	Very high	58 Å²	58	60.4 Å²	60.4	48%	0.479	36%	0.357	S	S	.	.	H	α-helix	trans	-62.5	-38.9	176.7	0	0	0	0	0	112.2	E226 N227 A233 S234	E226-A230 PolarHBondContact O-N 2.85Å; N227-A230 PolarHBondContact O-N 3.25Å; A230-A233 PolarHBondContact O-N 3.38Å; A230-S234 PolarHBondContact O-N 3.27Å; A230-S234 PolarHBondContact O-OG 3.04Å
231	T	97.8	Very high	97.3	Very high	42 Å²	42	63 Å²	63	26%	0.258	38%	0.379	S	S	.	.	H	α-helix	trans	-64.8	-46	175	-57.5	0	0	0	0	111	N227 E228 M229 A233 S234 S235 L238	N227-T231 PolarHBondContact O-N 2.96Å; N227-T231 PolarHBondContact O-OG1 3.13Å; E228-T231 PolarHBondContact O-N 2.83Å; M229-T231 VanDerWaalsContact C-N 3.31Å; M229-T231 PolarHBondContact O-N 2.78Å; T231-A233 VanDerWaalsContact C-N 3.27Å; T231-A233 PolarHBondContact O-N 3.26Å; T231-S234 PolarHBondContact O-N 3.09Å; T231-S234 PolarHBondContact O-OG 3Å; T231-S235 WeakPolarHBondContact O-CB 3.29Å; T231-S235 PolarHBondContact O-N 3.23Å; T231-L238 HydrophobicContact CG2-CD1 3.89Å; T231-L238 HydrophobicContact CG2-CG 4.18Å
232	A	96.9	Very high	97.3	Very high	26 Å²	26	64 Å²	64	22%	0.215	38%	0.383	C	S	.	.	H	α-helix	trans	-63.7	-31	177.7	0	0	0	0	0	113.3	E228 M229 L238 N254 F257	E228-A232 WeakPolarHBondContact O-CB 3.47Å; E228-A232 PolarHBondContact O-N 2.95Å; M229-A232 PolarHBondContact O-N 3.12Å; A232-L238 HydrophobicContact CB-CD1 4Å; A232-N254 HydrophobicContact CB-CB 3.88Å; A232-F257 HydrophobicContact CB-CE1 4.04Å; A232-F257 HydrophobicContact CB-CZ 3.95Å
233	A	96.6	Very high	97.3	Very high	93 Å²	93	70.5 Å²	70.5	77%	0.769	41%	0.413	S	S	*	.	H	α-helix	trans	-74.7	-25.6	177.1	0	0	0	0	0	113.3	M229 A230 T231	M229-A233 WeakPolarHBondContact O-CB 3.37Å; M229-A233 PolarHBondContact O-N 3.09Å; A230-A233 PolarHBondContact O-N 3.38Å; T231-A233 VanDerWaalsContact C-N 3.27Å; T231-A233 PolarHBondContact O-N 3.26Å
234	S	96	Very high	97.2	Very high	102 Å²	102	67 Å²	67	71%	0.713	40%	0.395	S	S	*	.	H	α-helix	trans	-105.7	-12.7	-175.9	57.9	0	0	0	0	114.2	A230 T231	A230-S234 PolarHBondContact O-N 3.27Å; A230-S234 PolarHBondContact O-OG 3.04Å; T231-S234 PolarHBondContact O-N 3.09Å; T231-S234 PolarHBondContact O-OG 3Å
235	S	94.1	Very high	97	Very high	49 Å²	49	69.1 Å²	69.1	34%	0.343	41%	0.412	S	S	.	.			trans	-147.4	141.7	-173.3	-173.2	0	0	0	0	112.3	T231 S237	T231-S235 WeakPolarHBondContact O-CB 3.29Å; T231-S235 PolarHBondContact O-N 3.23Å; S235-S237 PolarHBondContact O-N 3.06Å; S235-S237 VanDerWaalsContact OG-CB 3.29Å; S235-S237 WeakPolarHBondContact OG-CB 3.31Å; S235-S237 PolarHBondContact OG-N 3.47Å; S235-S237 VanDerWaalsContact OG-N 3.13Å; S235-S237 PolarHBondContact OG-OG 3.27Å
236	S	94.8	Very high	96.8	Very high	84 Å²	84	73.9 Å²	73.9	59%	0.587	44%	0.439	S	S	*	.	G	3₁₀ helix	trans	-83.1	3.8	168.8	57.1	0	0	0	0	113.5	L238 E239	S236-L238 PolarHBondContact O-N 2.63Å; S236-L238 VanDerWaalsContact O-N 3.11Å; S236-E239 WeakPolarHBondContact CB-OE2 3.47Å; S236-E239 VanDerWaalsContact O-CB 3.32Å; S236-E239 WeakPolarHBondContact O-CB 3.38Å; S236-E239 PolarHBondContact O-N 2.95Å
237	S	95.9	Very high	96.7	Very high	80 Å²	80	69.9 Å²	69.9	56%	0.559	43%	0.431	S	S	*	.	G	3₁₀ helix	trans	-59.7	-24.5	-177.7	56.2	0	0	0	0	114.2	S235	S235-S237 PolarHBondContact O-N 3.06Å; S235-S237 VanDerWaalsContact OG-CB 3.29Å; S235-S237 WeakPolarHBondContact OG-CB 3.31Å; S235-S237 PolarHBondContact OG-N 3.47Å; S235-S237 VanDerWaalsContact OG-N 3.13Å; S235-S237 PolarHBondContact OG-OG 3.27Å
238	L	96.5	Very high	96.6	Very high	26 Å²	26	70.2 Å²	70.2	14%	0.136	43%	0.429	C	S	.	.	G	3₁₀ helix	trans	-87.5	-7	177.6	-58.2	-178.2	0	0	0	113.2	E228 T231 A232 S236 R256 F257	E228-L238 HydrophobicContact CG-CD1 4Å; E228-L238 VanDerWaalsContact OE1-CD1 3.24Å; E228-L238 WeakPolarHBondContact OE1-CD1 3.39Å; E228-L238 VanDerWaalsContact OE1-CD2 3.31Å; E228-L238 WeakPolarHBondContact OE1-CD2 3.38Å; T231-L238 HydrophobicContact CG2-CD1 3.89Å; T231-L238 HydrophobicContact CG2-CG 4.18Å; A232-L238 HydrophobicContact CB-CD1 4Å; S236-L238 PolarHBondContact O-N 2.63Å; S236-L238 VanDerWaalsContact O-N 3.11Å; L238-R256 PolarHBondContact O-NH1 3.26Å; L238-F257 HydrophobicContact CD1-CE1 4.06Å
239	E	97.6	Very high	96.5	Very high	78 Å²	78	72.6 Å²	72.6	36%	0.364	45%	0.446	S	S	.	.			trans	-74.2	145.9	179.3	-59.9	-169.6	139.6	0	0	111.7	R198 S236 T251 I252	R198-E239 IonicContact CZ-OE1 3.87Å; R198-E239 IonicContact NH2-OE1 3.27Å; R198-E239 PolarHBondContact NH2-OE1 2.95Å; S236-E239 WeakPolarHBondContact CB-OE2 3.47Å; S236-E239 VanDerWaalsContact O-CB 3.32Å; S236-E239 WeakPolarHBondContact O-CB 3.38Å; S236-E239 PolarHBondContact O-N 2.95Å; E239-T251 HydrophobicContact CB-CG2 3.8Å; E239-T251 HydrophobicContact CG-CG2 4.2Å; E239-I252 WeakPolarHBondContact CA-O 3.35Å
240	K	98.1	Very high	96.5	Very high	105 Å²	105	70 Å²	70	46%	0.457	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	141.1	172	-69.3	-66.7	-178.8	-175	0	110.1	L218 I252 R256	L218-K240 HydrophobicContact CD1-CB 4.2Å; L218-K240 HydrophobicContact CD2-CB 4.22Å; K240-I252 PolarHBondContact N-O 3.2Å; K240-I252 PolarHBondContact O-N 2.74Å; K240-R256 VanDerWaalsContact CG-NH1 3.35Å
241	S	97.5	Very high	96.5	Very high	86 Å²	86	69.5 Å²	69.5	60%	0.601	42%	0.424	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.1	148.9	169.8	50.8	0	0	0	0	111.1	I250	S241-I250 CarbonylContact C-O 3.28Å; S241-I250 VanDerWaalsContact CA-O 3.3Å; S241-I250 WeakPolarHBondContact CA-O 3.37Å
242	Y	98.2	Very high	96.5	Very high	27 Å²	27	67.5 Å²	67.5	11%	0.106	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	132.1	171.1	-176.3	-86.7	0	0	0	108.8	I210 D213 I214 K217 L218 L244 V249 I250	I210-Y242 HydrophobicContact CG2-CE1 3.84Å; D213-Y242 VanDerWaalsContact OD2-CE2 3.28Å; D213-Y242 WeakPolarHBondContact OD2-CE2 3.3Å; D213-Y242 VanDerWaalsContact OD2-CZ 3.31Å; D213-Y242 PolarHBondContact OD2-OH 3.28Å; I214-Y242 HydrophobicContact CB-CE2 4.49Å; I214-Y242 HydrophobicContact CD1-CD1 4.01Å; I214-Y242 HydrophobicContact CD1-CE1 4.14Å; I214-Y242 HydrophobicContact CD1-CG 4.33Å; I214-Y242 HydrophobicContact CG1-CD1 3.74Å; I214-Y242 HydrophobicContact CG1-CD2 3.68Å; I214-Y242 HydrophobicContact CG1-CE1 3.73Å; I214-Y242 HydrophobicContact CG1-CE2 3.65Å; I214-Y242 HydrophobicContact CG1-CG 3.71Å; K217-Y242 HydrophobicContact CD-CE2 4.27Å; L218-Y242 HydrophobicContact CD1-CD2 4.03Å; L218-Y242 HydrophobicContact CD1-CG 4.43Å; Y242-L244 HydrophobicContact CD1-CD2 4.05Å; Y242-L244 HydrophobicContact CE1-CD2 4.05Å; Y242-V249 WeakPolarHBondContact O-CA 3.44Å; Y242-I250 HydrophobicContact CD1-CG1 4.41Å; Y242-I250 PolarHBondContact N-O 3.5Å; Y242-I250 PolarHBondContact O-N 2.71Å
243	E	98.1	Very high	96.5	Very high	136 Å²	136	66.4 Å²	66.4	64%	0.636	40%	0.403	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.4	118.4	177.2	-171.4	177.4	162.2	0	0	109.8	V249	E243-V249 HydrophobicContact CB-CG2 4.42Å; E243-V249 HydrophobicContact CG-CG2 4.35Å
244	L	96.4	Very high	96.6	Very high	18 Å²	18	63.7 Å²	63.7	9%	0.094	38%	0.376	C	S	.	.			trans	-71.9	159	175.2	-64.5	179.8	0	0	0	110.6	F202 I210 Y242 D246 G247 Q248 I250	F202-L244 HydrophobicContact CE1-CD2 4.04Å; F202-L244 HydrophobicContact CZ-CD2 4.1Å; I210-L244 HydrophobicContact CG2-CD2 3.68Å; Y242-L244 HydrophobicContact CD1-CD2 4.05Å; Y242-L244 HydrophobicContact CE1-CD2 4.05Å; L244-D246 VanDerWaalsContact CB-OD1 3.22Å; L244-D246 WeakPolarHBondContact CB-OD1 3.37Å; L244-D246 PolarHBondContact O-N 3.29Å; L244-G247 WeakPolarHBondContact O-CA 3.25Å; L244-G247 PolarHBondContact O-N 3.47Å; L244-Q248 HydrophobicContact CB-CB 4.42Å; L244-Q248 VanDerWaalsContact CB-O 3.3Å; L244-Q248 WeakPolarHBondContact CB-O 3.49Å; L244-Q248 HydrophobicContact CD1-CB 4.16Å; L244-Q248 HydrophobicContact CD1-CG 4.37Å; L244-Q248 WeakPolarHBondContact CG-O 3.44Å; L244-Q248 PolarHBondContact N-O 2.92Å; L244-I250 HydrophobicContact CD1-CG2 3.75Å; L244-I250 HydrophobicContact CD2-CD1 3.92Å; L244-I250 HydrophobicContact CD2-CG1 4.37Å; L244-I250 HydrophobicContact CG-CD1 4.34Å; L244-I250 HydrophobicContact CG-CG1 4.35Å; L244-I250 HydrophobicContact CG-CG2 4.18Å
245	P	93.7	Very high	96.7	Very high	110 Å²	110	59.2 Å²	59.2	71%	0.714	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-19.5	-179.6	-26.7	36.1	0	0	0	115.7	I210 G247	I210-P245 HydrophobicContact CD1-CG 3.86Å; I210-P245 HydrophobicContact CG1-CG 4.16Å; P245-G247 VanDerWaalsContact C-N 3.31Å
246	D	94	Very high	96.9	Very high	118 Å²	118	58.3 Å²	58.3	63%	0.631	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	2	174.8	63.4	-0.7	0	0	0	113.4	L244 Q248	L244-D246 VanDerWaalsContact CB-OD1 3.22Å; L244-D246 WeakPolarHBondContact CB-OD1 3.37Å; L244-D246 PolarHBondContact O-N 3.29Å; D246-Q248 VanDerWaalsContact C-N 3.33Å; D246-Q248 VanDerWaalsContact OD1-CB 3.26Å; D246-Q248 WeakPolarHBondContact OD1-CB 3.41Å; D246-Q248 PolarHBondContact OD1-N 3.14Å
247	G	95.6	Very high	97.1	Very high	40 Å²	40	54.3 Å²	54.3	41%	0.412	31%	0.305	S	S	.	.	S	Bend	trans	85.6	-3.4	-177.2	0	0	0	0	0	114.2	L244 P245 V249	L244-G247 WeakPolarHBondContact O-CA 3.25Å; L244-G247 PolarHBondContact O-N 3.47Å; P245-G247 VanDerWaalsContact C-N 3.31Å; G247-V249 PolarHBondContact O-N 3Å
248	Q	96	Very high	97.2	Very high	105 Å²	105	52.9 Å²	52.9	49%	0.491	29%	0.287	S	S	.	.			trans	-68.8	129.1	175.6	-179.4	179.9	-4.2	0	0	110.2	L244 D246 I250	L244-Q248 HydrophobicContact CB-CB 4.42Å; L244-Q248 VanDerWaalsContact CB-O 3.3Å; L244-Q248 WeakPolarHBondContact CB-O 3.49Å; L244-Q248 HydrophobicContact CD1-CB 4.16Å; L244-Q248 HydrophobicContact CD1-CG 4.37Å; L244-Q248 WeakPolarHBondContact CG-O 3.44Å; L244-Q248 PolarHBondContact N-O 2.92Å; D246-Q248 VanDerWaalsContact C-N 3.33Å; D246-Q248 VanDerWaalsContact OD1-CB 3.26Å; D246-Q248 WeakPolarHBondContact OD1-CB 3.41Å; D246-Q248 PolarHBondContact OD1-N 3.14Å; Q248-I250 HydrophobicContact CG-CG2 4.42Å
249	V	97.5	Very high	97.3	Very high	86 Å²	86	51.7 Å²	51.7	52%	0.521	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	123.9	174.9	-177.3	0	0	0	0	110.1	Y242 E243 G247	Y242-V249 WeakPolarHBondContact O-CA 3.44Å; E243-V249 HydrophobicContact CB-CG2 4.42Å; E243-V249 HydrophobicContact CG-CG2 4.35Å; G247-V249 PolarHBondContact O-N 3Å
250	I	97.4	Very high	97.4	Very high	1 Å²	1	48 Å²	48	1%	0.005	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	157.8	174.2	63.5	170.4	0	0	0	110.8	Y200 F202 I214 S241 Y242 L244 Q248 I252	Y200-I250 HydrophobicContact CD1-CB 4.33Å; Y200-I250 HydrophobicContact CD1-CG2 3.85Å; Y200-I250 HydrophobicContact CD2-CB 4.39Å; Y200-I250 HydrophobicContact CE1-CB 3.9Å; Y200-I250 HydrophobicContact CE1-CG2 3.58Å; Y200-I250 HydrophobicContact CE2-CB 3.96Å; Y200-I250 HydrophobicContact CG-CG2 4.42Å; F202-I250 HydrophobicContact CZ-CD1 3.98Å; I214-I250 HydrophobicContact CD1-CD1 3.99Å; S241-I250 CarbonylContact C-O 3.28Å; S241-I250 VanDerWaalsContact CA-O 3.3Å; S241-I250 WeakPolarHBondContact CA-O 3.37Å; Y242-I250 HydrophobicContact CD1-CG1 4.41Å; Y242-I250 PolarHBondContact N-O 3.5Å; Y242-I250 PolarHBondContact O-N 2.71Å; L244-I250 HydrophobicContact CD1-CG2 3.75Å; L244-I250 HydrophobicContact CD2-CD1 3.92Å; L244-I250 HydrophobicContact CD2-CG1 4.37Å; L244-I250 HydrophobicContact CG-CD1 4.34Å; L244-I250 HydrophobicContact CG-CG1 4.35Å; L244-I250 HydrophobicContact CG-CG2 4.18Å; Q248-I250 HydrophobicContact CG-CG2 4.42Å; I250-I252 HydrophobicContact CD1-CD1 3.6Å; I250-I252 HydrophobicContact CG1-CD1 3.87Å
251	T	97.7	Very high	97.4	Very high	47 Å²	47	43 Å²	43	29%	0.288	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	123	179.4	-59.3	0	0	0	0	110.4	R198 Y200 E239	R198-T251 WeakPolarHBondContact CD-O 3.17Å; R198-T251 PolarHBondContact NE-O 3.28Å; Y200-T251 WeakPolarHBondContact CE2-O 3.2Å; Y200-T251 PolarHBondContact OH-N 3.15Å; E239-T251 HydrophobicContact CB-CG2 3.8Å; E239-T251 HydrophobicContact CG-CG2 4.2Å
252	I	98.2	Very high	97.5	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	121.8	176.6	-40.6	-50.2	0	0	0	108.2	L195 I214 L218 E239 K240 I250 E255 R256	L195-I252 HydrophobicContact CD2-CD1 3.74Å; L195-I252 HydrophobicContact CD2-CG2 4.25Å; I214-I252 HydrophobicContact CG2-CD1 4.35Å; I214-I252 HydrophobicContact CG2-CG1 3.99Å; I214-I252 HydrophobicContact CG2-CG2 4.46Å; L218-I252 HydrophobicContact CD1-CB 4.35Å; L218-I252 HydrophobicContact CD1-CG1 3.88Å; E239-I252 WeakPolarHBondContact CA-O 3.35Å; K240-I252 PolarHBondContact N-O 3.2Å; K240-I252 PolarHBondContact O-N 2.74Å; I250-I252 HydrophobicContact CD1-CD1 3.6Å; I250-I252 HydrophobicContact CG1-CD1 3.87Å; I252-E255 HydrophobicContact CG2-CB 4.11Å; I252-R256 HydrophobicContact CB-CG 4.11Å; I252-R256 HydrophobicContact CG2-CG 3.61Å; I252-R256 WeakPolarHBondContact O-CD 3.33Å
253	G	97.8	Very high	97.5	Very high	3 Å²	3	37.6 Å²	37.6	3%	0.031	21%	0.208	C	C	.	.			trans	-108.5	-117	-176.8	0	0	0	0	0	112.2	E255 R256	G253-E255 VanDerWaalsContact C-OE2 3.22Å; G253-E255 VanDerWaalsContact CA-OE2 3.29Å; G253-E255 WeakPolarHBondContact CA-OE2 3.31Å; G253-E255 PolarHBondContact N-OE2 2.81Å; G253-E255 PolarHBondContact O-N 3.13Å; G253-E255 VanDerWaalsContact O-N 3.16Å; G253-R256 VanDerWaalsContact O-CB 3.31Å; G253-R256 WeakPolarHBondContact O-CB 3.46Å; G253-R256 WeakPolarHBondContact O-CG 3.42Å; G253-R256 PolarHBondContact O-N 2.78Å; G253-R256 VanDerWaalsContact O-N 3.15Å
254	N	97.7	Very high	97.5	Very high	37 Å²	37	31.3 Å²	31.3	20%	0.198	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-15.3	-176.7	66.3	32.4	0	0	0	113.8	M229 A232 R256 F257 R258	M229-N254 HydrophobicContact SD-CB 4.29Å; A232-N254 HydrophobicContact CB-CB 3.88Å; N254-R256 PolarHBondContact O-N 2.95Å; N254-R256 VanDerWaalsContact O-N 3.11Å; N254-F257 VanDerWaalsContact CA-CE1 3.49Å; N254-F257 HydrophobicContact CB-CE1 3.65Å; N254-F257 HydrophobicContact CB-CE2 4.46Å; N254-F257 HydrophobicContact CB-CZ 3.61Å; N254-F257 PolarHBondContact O-N 3.11Å; N254-F257 VanDerWaalsContact O-N 3.14Å; N254-R258 HydrophobicContact CB-CG 4.49Å; N254-R258 WeakPolarHBondContact O-CB 3.32Å; N254-R258 WeakPolarHBondContact O-CG 3.39Å; N254-R258 PolarHBondContact O-N 2.99Å; N254-R258 WeakPolarHBondContact OD1-CD 3.33Å; N254-R258 PolarHBondContact OD1-NH1 3.17Å
255	E	98.3	Very high	97.6	Very high	7 Å²	7	33.5 Å²	33.5	3%	0.033	19%	0.188	C	C	.	.	H	α-helix	trans	-57.6	-27.5	173.9	-54.7	78.6	-165.7	0	0	111.3	L191 I194 L195 R198 I252 G253 F257 C259	L191-E255 HydrophobicContact CD1-CB 3.9Å; I194-E255 HydrophobicContact CB-CG 4.19Å; I194-E255 HydrophobicContact CD1-CB 3.68Å; I194-E255 HydrophobicContact CD1-CG 4.02Å; I194-E255 HydrophobicContact CG1-CB 3.88Å; I194-E255 HydrophobicContact CG1-CG 3.78Å; L195-E255 HydrophobicContact CD2-CB 4.47Å; L195-E255 HydrophobicContact CD2-CG 4.36Å; R198-E255 WeakPolarHBondContact CD-OE1 3.49Å; R198-E255 IonicContact CZ-OE2 2.71Å; R198-E255 IonicContact NH1-OE1 3.82Å; R198-E255 PolarHBondContact NH1-OE1 2.92Å; R198-E255 VanDerWaalsContact NH1-OE1 3.14Å; R198-E255 IonicContact NH1-OE2 3.03Å; R198-E255 PolarHBondContact NH1-OE2 2.9Å; R198-E255 VanDerWaalsContact NH1-OE2 3.15Å; I252-E255 HydrophobicContact CG2-CB 4.11Å; G253-E255 VanDerWaalsContact C-OE2 3.22Å; G253-E255 VanDerWaalsContact CA-OE2 3.29Å; G253-E255 WeakPolarHBondContact CA-OE2 3.31Å; G253-E255 PolarHBondContact N-OE2 2.81Å; G253-E255 PolarHBondContact O-N 3.13Å; G253-E255 VanDerWaalsContact O-N 3.16Å; E255-F257 VanDerWaalsContact C-N 3.31Å; E255-F257 PolarHBondContact O-N 3.45Å; E255-C259 VanDerWaalsContact O-CB 3.27Å; E255-C259 WeakPolarHBondContact O-CB 3.29Å; E255-C259 PolarHBondContact O-N 2.73Å; E255-C259 VanDerWaalsContact O-N 3.13Å
256	R	98.6	Very high	97.8	Very high	31 Å²	31	28.4 Å²	28.4	12%	0.117	16%	0.155	C	C	.	.	H	α-helix	trans	-57.1	-39.8	177.1	-64.4	177.3	65.5	-139.6	-9.4	112.9	L218 C219 Y220 L238 K240 I252 G253 N254 P260	L218-R256 HydrophobicContact CB-CG 4.41Å; L218-R256 PolarHBondContact O-NE 3.18Å; L218-R256 PolarHBondContact O-NH2 2.92Å; C219-R256 CarbonylContact C-O 3.16Å; C219-R256 WeakPolarHBondContact CA-O 3.49Å; C219-R256 WeakPolarHBondContact CB-O 3.46Å; C219-R256 PolarHBondContact SG-O 3Å; C219-R256 VanDerWaalsContact SG-O 3.35Å; Y220-R256 HydrophobicContact CD1-CB 4.07Å; Y220-R256 HydrophobicContact CE1-CB 3.74Å; Y220-R256 PolarHBondContact N-O 3.26Å; L238-R256 PolarHBondContact O-NH1 3.26Å; K240-R256 VanDerWaalsContact CG-NH1 3.35Å; I252-R256 HydrophobicContact CB-CG 4.11Å; I252-R256 HydrophobicContact CG2-CG 3.61Å; I252-R256 WeakPolarHBondContact O-CD 3.33Å; G253-R256 VanDerWaalsContact O-CB 3.31Å; G253-R256 WeakPolarHBondContact O-CB 3.46Å; G253-R256 WeakPolarHBondContact O-CG 3.42Å; G253-R256 PolarHBondContact O-N 2.78Å; G253-R256 VanDerWaalsContact O-N 3.15Å; N254-R256 PolarHBondContact O-N 2.95Å; N254-R256 VanDerWaalsContact O-N 3.11Å; R256-P260 WeakPolarHBondContact O-CD 3.49Å
257	F	98.6	Very high	98	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-109.4	-23.4	180	64.3	-93.9	0	0	0	113.5	Y220 A222 F225 E228 M229 A232 L238 N254 E255 C259 P260 E261	Y220-F257 HydrophobicContact CD2-CB 4.4Å; Y220-F257 HydrophobicContact CE1-CB 4.28Å; Y220-F257 HydrophobicContact CE1-CD1 4.39Å; Y220-F257 HydrophobicContact CE2-CB 3.99Å; Y220-F257 AromaticContact CZ-CD1 3.89Å; Y220-F257 VanDerWaalsContact O-CA 3.29Å; Y220-F257 WeakPolarHBondContact O-CA 3.16Å; Y220-F257 WeakPolarHBondContact O-CB 3.23Å; Y220-F257 WeakPolarHBondContact OH-CD1 3.45Å; A222-F257 HydrophobicContact CB-CB 4.23Å; A222-F257 HydrophobicContact CB-CD2 4.33Å; A222-F257 HydrophobicContact CB-CG 4.47Å; F225-F257 AromaticContact CD2-CD2 3.91Å; F225-F257 HydrophobicContact CD2-CD2 3.91Å; F225-F257 HydrophobicContact CD2-CE2 4.15Å; F225-F257 AromaticContact CE2-CD2 3.84Å; F225-F257 HydrophobicContact CE2-CD2 3.84Å; F225-F257 AromaticContact CE2-CE2 3.92Å; F225-F257 HydrophobicContact CE2-CE2 3.92Å; E228-F257 HydrophobicContact CB-CD2 4.08Å; E228-F257 HydrophobicContact CB-CE1 4.41Å; E228-F257 HydrophobicContact CB-CE2 3.81Å; E228-F257 HydrophobicContact CB-CZ 3.98Å; E228-F257 HydrophobicContact CG-CD1 3.72Å; E228-F257 HydrophobicContact CG-CD2 3.92Å; E228-F257 HydrophobicContact CG-CE1 3.66Å; E228-F257 HydrophobicContact CG-CE2 3.88Å; E228-F257 HydrophobicContact CG-CG 3.84Å; E228-F257 HydrophobicContact CG-CZ 3.74Å; M229-F257 HydrophobicContact CG-CE2 3.82Å; M229-F257 HydrophobicContact CG-CZ 4.29Å; M229-F257 HydrophobicContact SD-CE2 3.56Å; M229-F257 VanDerWaalsContact SD-CE2 3.56Å; M229-F257 HydrophobicContact SD-CZ 3.76Å; A232-F257 HydrophobicContact CB-CE1 4.04Å; A232-F257 HydrophobicContact CB-CZ 3.95Å; L238-F257 HydrophobicContact CD1-CE1 4.06Å; N254-F257 VanDerWaalsContact CA-CE1 3.49Å; N254-F257 HydrophobicContact CB-CE1 3.65Å; N254-F257 HydrophobicContact CB-CE2 4.46Å; N254-F257 HydrophobicContact CB-CZ 3.61Å; N254-F257 PolarHBondContact O-N 3.11Å; N254-F257 VanDerWaalsContact O-N 3.14Å; E255-F257 VanDerWaalsContact C-N 3.31Å; E255-F257 PolarHBondContact O-N 3.45Å; F257-C259 VanDerWaalsContact C-N 3.33Å; F257-C259 PolarHBondContact O-N 3.42Å; F257-P260 WeakPolarHBondContact O-CD 3.2Å; F257-E261 WeakPolarHBondContact O-CB 3.5Å; F257-E261 PolarHBondContact O-N 3.14Å; F257-E261 VanDerWaalsContact O-N 3.17Å
258	R	98.5	Very high	97.9	Very high	50 Å²	50	28.4 Å²	28.4	19%	0.189	15%	0.148	C	C	.	.	H	α-helix	trans	-61.8	-38.5	170.7	-75.1	174.7	66.4	-155.4	-2.1	112.7	I194 E197 F225 M229 N254 E261	I194-R258 HydrophobicContact CD1-CB 4.18Å; E197-R258 IonicContact OE2-CZ 3.9Å; E197-R258 IonicContact OE2-NH1 3.71Å; E197-R258 IonicContact OE2-NH2 3.11Å; E197-R258 PolarHBondContact OE2-NH2 3.17Å; E197-R258 VanDerWaalsContact OE2-NH2 3.11Å; F225-R258 HydrophobicContact CE2-CG 3.97Å; F225-R258 HydrophobicContact CZ-CG 4.09Å; M229-R258 HydrophobicContact SD-CG 3.92Å; N254-R258 HydrophobicContact CB-CG 4.49Å; N254-R258 WeakPolarHBondContact O-CB 3.32Å; N254-R258 WeakPolarHBondContact O-CG 3.39Å; N254-R258 PolarHBondContact O-N 2.99Å; N254-R258 WeakPolarHBondContact OD1-CD 3.33Å; N254-R258 PolarHBondContact OD1-NH1 3.17Å; R258-E261 PolarHBondContact O-N 2.87Å
259	C	98.7	Very high	97.9	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-58.5	-61.1	179.5	170	0	0	0	0	112.3	L187 Y190 L191 I194 E255 F257 E261 T262	L187-C259 PolarHBondContact O-SG 3.21Å; Y190-C259 HydrophobicContact CD1-CB 4.49Å; L191-C259 HydrophobicContact CB-CB 4.34Å; L191-C259 HydrophobicContact CD1-CB 4.04Å; I194-C259 HydrophobicContact CD1-CB 4.09Å; E255-C259 VanDerWaalsContact O-CB 3.27Å; E255-C259 WeakPolarHBondContact O-CB 3.29Å; E255-C259 PolarHBondContact O-N 2.73Å; E255-C259 VanDerWaalsContact O-N 3.13Å; F257-C259 VanDerWaalsContact C-N 3.33Å; F257-C259 PolarHBondContact O-N 3.42Å; C259-E261 PolarHBondContact O-N 3.48Å; C259-T262 WeakPolarHBondContact O-CG2 3.45Å; C259-T262 PolarHBondContact O-N 3.39Å; C259-T262 PolarHBondContact O-OG1 2.72Å
260	P	98.7	Very high	97.8	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-70.3	-16.6	-179.8	28.8	-36.6	0	0	0	113.9	C219 Y220 V221 R256 F257 T262 L263 Y308	C219-P260 HydrophobicContact CB-CG 4.4Å; Y220-P260 WeakPolarHBondContact O-CG 3.21Å; V221-P260 HydrophobicContact CG2-CB 3.89Å; V221-P260 HydrophobicContact CG2-CG 4.31Å; R256-P260 WeakPolarHBondContact O-CD 3.49Å; F257-P260 WeakPolarHBondContact O-CD 3.2Å; P260-T262 PolarHBondContact O-N 2.97Å; P260-T262 VanDerWaalsContact O-N 3.16Å; P260-L263 WeakPolarHBondContact O-CB 3.1Å; P260-L263 PolarHBondContact O-N 3.07Å; P260-Y308 HydrophobicContact CB-CD1 4.41Å; P260-Y308 HydrophobicContact CB-CD2 3.8Å; P260-Y308 HydrophobicContact CB-CE1 4.33Å; P260-Y308 HydrophobicContact CB-CE2 3.66Å; P260-Y308 HydrophobicContact CB-CG 4.17Å
261	E	98.7	Very high	97.7	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-57.3	-28.2	173.6	-172.3	62.1	-158.8	0	0	112.2	F225 F257 R258 C259 L263 F264 Q265 F268 R314	F225-E261 HydrophobicContact CB-CG 4.41Å; F225-E261 HydrophobicContact CD1-CG 4.36Å; F225-E261 HydrophobicContact CD2-CB 3.8Å; F225-E261 HydrophobicContact CD2-CG 3.41Å; F225-E261 VanDerWaalsContact CD2-CG 3.41Å; F225-E261 HydrophobicContact CE2-CB 3.79Å; F225-E261 HydrophobicContact CE2-CG 3.67Å; F225-E261 HydrophobicContact CG-CG 3.8Å; F225-E261 HydrophobicContact CZ-CG 4.24Å; F257-E261 WeakPolarHBondContact O-CB 3.5Å; F257-E261 PolarHBondContact O-N 3.14Å; F257-E261 VanDerWaalsContact O-N 3.17Å; R258-E261 PolarHBondContact O-N 2.87Å; C259-E261 PolarHBondContact O-N 3.48Å; E261-L263 PolarHBondContact O-N 3.11Å; E261-L263 VanDerWaalsContact O-N 3.09Å; E261-F264 CarbonylContact O-C 3.58Å; E261-F264 WeakPolarHBondContact O-CA 3.43Å; E261-F264 WeakPolarHBondContact O-CB 3.44Å; E261-F264 PolarHBondContact O-N 3.21Å; E261-Q265 PolarHBondContact O-N 3.02Å; E261-F268 HydrophobicContact CB-CE2 4.45Å; E261-F268 HydrophobicContact CG-CD2 4.24Å; E261-F268 HydrophobicContact CG-CE2 3.81Å; E261-R314 IonicContact OE1-CZ 2.87Å; E261-R314 IonicContact OE1-NH1 2.96Å; E261-R314 PolarHBondContact OE1-NH1 2.91Å; E261-R314 IonicContact OE1-NH2 2.78Å; E261-R314 PolarHBondContact OE1-NH2 3.31Å; E261-R314 IonicContact OE2-CZ 3.13Å; E261-R314 IonicContact OE2-NH1 2.76Å; E261-R314 PolarHBondContact OE2-NH1 3.31Å; E261-R314 IonicContact OE2-NH2 3.89Å
262	T	98.4	Very high	97.6	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-23.9	176.3	59.8	0	0	0	0	113.4	L182 L187 Y190 C259 P260 F264 Q265 P266 F268 I269	L182-T262 VanDerWaalsContact CD2-O 3.24Å; L182-T262 WeakPolarHBondContact CD2-O 3.07Å; L187-T262 WeakPolarHBondContact CD2-OG1 3.29Å; Y190-T262 HydrophobicContact CD1-CG2 3.39Å; Y190-T262 HydrophobicContact CE1-CG2 3.29Å; Y190-T262 HydrophobicContact CG-CG2 4.14Å; C259-T262 WeakPolarHBondContact O-CG2 3.45Å; C259-T262 PolarHBondContact O-N 3.39Å; C259-T262 PolarHBondContact O-OG1 2.72Å; P260-T262 PolarHBondContact O-N 2.97Å; P260-T262 VanDerWaalsContact O-N 3.16Å; T262-F264 VanDerWaalsContact C-N 3.26Å; T262-F264 PolarHBondContact O-N 3.19Å; T262-Q265 CarbonylContact O-C 3.6Å; T262-Q265 VanDerWaalsContact O-C 3.29Å; T262-P266 VanDerWaalsContact O-CA 3.26Å; T262-P266 WeakPolarHBondContact O-CA 3.46Å; T262-P266 WeakPolarHBondContact O-CD 3.41Å; T262-P266 WeakPolarHBondContact O-CG 3.4Å; T262-P266 VanDerWaalsContact O-N 3.09Å; T262-F268 HydrophobicContact CG2-CB 3.94Å; T262-I269 HydrophobicContact CG2-CG2 3.66Å
263	L	98.7	Very high	97.5	Very high	1 Å²	1	37.4 Å²	37.4	1%	0.005	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-33.2	171	-65.2	172	0	0	0	111.8	L182 L187 P260 E261 G275 I276 T305 Y308 I311	L182-L263 HydrophobicContact CD2-CD2 4.5Å; L182-L263 HydrophobicContact CG-CD2 4.25Å; L187-L263 HydrophobicContact CD1-CD1 4.08Å; L187-L263 HydrophobicContact CD1-CD2 4.2Å; L187-L263 HydrophobicContact CD1-CG 4.1Å; L187-L263 HydrophobicContact CD2-CD2 4.46Å; L187-L263 HydrophobicContact CD2-CG 4.32Å; P260-L263 WeakPolarHBondContact O-CB 3.1Å; P260-L263 PolarHBondContact O-N 3.07Å; E261-L263 PolarHBondContact O-N 3.11Å; E261-L263 VanDerWaalsContact O-N 3.09Å; L263-G275 CarbonylContact O-C 3.29Å; L263-G275 VanDerWaalsContact O-CA 3.28Å; L263-G275 WeakPolarHBondContact O-CA 3.28Å; L263-I276 HydrophobicContact CB-CD1 3.97Å; L263-I276 HydrophobicContact CB-CG1 4.17Å; L263-I276 HydrophobicContact CB-CG2 4.23Å; L263-I276 HydrophobicContact CD1-CD1 4.48Å; L263-I276 HydrophobicContact CD2-CG2 4.46Å; L263-I276 PolarHBondContact O-N 3.46Å; L263-T305 HydrophobicContact CD1-CG2 3.78Å; L263-T305 HydrophobicContact CD2-CG2 4.1Å; L263-Y308 HydrophobicContact CD1-CD2 4.33Å; L263-Y308 HydrophobicContact CD1-CE2 4.24Å; L263-I311 HydrophobicContact CD1-CD1 4.43Å
264	F	98.7	Very high	97.5	Very high	3 Å²	3	38.5 Å²	38.5	1%	0.013	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-31.7	178.1	-64.6	-94.1	0	0	0	111.7	V221 E261 T262 G275 I276 H277 I311 R314 M315 E318	V221-F264 HydrophobicContact CG1-CD2 4.36Å; V221-F264 HydrophobicContact CG1-CE2 3.6Å; V221-F264 HydrophobicContact CG1-CZ 4.03Å; V221-F264 HydrophobicContact CG2-CE2 4.06Å; E261-F264 CarbonylContact O-C 3.58Å; E261-F264 WeakPolarHBondContact O-CA 3.43Å; E261-F264 WeakPolarHBondContact O-CB 3.44Å; E261-F264 PolarHBondContact O-N 3.21Å; T262-F264 VanDerWaalsContact C-N 3.26Å; T262-F264 PolarHBondContact O-N 3.19Å; F264-G275 WeakPolarHBondContact O-CA 3.33Å; F264-I276 HydrophobicContact CD1-CG1 4.26Å; F264-I276 HydrophobicContact CE1-CD1 4.16Å; F264-I276 HydrophobicContact CE1-CG1 4.03Å; F264-I276 HydrophobicContact CE2-CD1 3.93Å; F264-I276 HydrophobicContact CE2-CG1 4.36Å; F264-I276 HydrophobicContact CG-CG1 4.48Å; F264-I276 HydrophobicContact CZ-CD1 3.72Å; F264-I276 HydrophobicContact CZ-CG1 4.1Å; F264-H277 HydrophobicContact CD1-CB 4.27Å; F264-H277 AromaticContact CD1-CG 3.97Å; F264-H277 AromaticContact CD1-ND1 3.39Å; F264-H277 WeakPolarHBondContact CD1-ND1 3.44Å; F264-H277 HydrophobicContact CE1-CB 4.28Å; F264-H277 PolarHBondContact O-CE1 3.29Å; F264-I311 HydrophobicContact CE2-CG1 4.37Å; F264-I311 HydrophobicContact CZ-CG1 4.14Å; F264-R314 HydrophobicContact CD1-CG 3.9Å; F264-R314 HydrophobicContact CE1-CB 4.19Å; F264-R314 HydrophobicContact CE1-CG 3.38Å; F264-R314 HydrophobicContact CE2-CG 4.04Å; F264-R314 HydrophobicContact CG-CG 4.46Å; F264-R314 HydrophobicContact CZ-CB 3.91Å; F264-R314 HydrophobicContact CZ-CG 3.45Å; F264-R314 VanDerWaalsContact CZ-CG 3.45Å; F264-M315 HydrophobicContact CE1-CG 4.34Å; F264-M315 HydrophobicContact CE1-SD 3.85Å; F264-M315 HydrophobicContact CZ-CG 4.25Å; F264-M315 HydrophobicContact CZ-SD 4.18Å; F264-E318 HydrophobicContact CD1-CG 4.36Å; F264-E318 HydrophobicContact CE1-CG 4.44Å
265	Q	97.9	Very high	97.5	Very high	64 Å²	64	36.8 Å²	36.8	30%	0.299	21%	0.206	S	C	.	.			trans	-129.7	76.9	179.6	-63	-173.6	-16.8	0	0	111.3	E261 T262 S267 F268	E261-Q265 PolarHBondContact O-N 3.02Å; T262-Q265 CarbonylContact O-C 3.6Å; T262-Q265 VanDerWaalsContact O-C 3.29Å; Q265-S267 PolarHBondContact O-N 2.86Å; Q265-F268 HydrophobicContact CB-CD1 4.44Å; Q265-F268 HydrophobicContact CB-CD2 4.32Å; Q265-F268 HydrophobicContact CB-CE2 4.37Å; Q265-F268 HydrophobicContact CB-CG 4.38Å; Q265-F268 HydrophobicContact CB-CZ 4.49Å; Q265-F268 WeakPolarHBondContact O-CB 3.16Å; Q265-F268 PolarHBondContact O-N 2.92Å; Q265-F268 VanDerWaalsContact O-N 3.09Å; Q265-F268 VanDerWaalsContact OE1-CE2 3.27Å
266	P	98.4	Very high	97.5	Very high	4 Å²	4	36.5 Å²	36.5	3%	0.026	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-58.6	-21.1	-178.7	-29.4	37.6	0	0	0	115.9	L182 T262 F268 I269 M271 S273	L182-P266 HydrophobicContact CD2-CB 4.19Å; L182-P266 HydrophobicContact CD2-CG 4.11Å; T262-P266 VanDerWaalsContact O-CA 3.26Å; T262-P266 WeakPolarHBondContact O-CA 3.46Å; T262-P266 WeakPolarHBondContact O-CD 3.41Å; T262-P266 WeakPolarHBondContact O-CG 3.4Å; T262-P266 VanDerWaalsContact O-N 3.09Å; P266-F268 PolarHBondContact O-N 2.9Å; P266-F268 VanDerWaalsContact O-N 3.13Å; P266-I269 WeakPolarHBondContact O-CG1 3.4Å; P266-I269 PolarHBondContact O-N 3.08Å; P266-M271 CarbonylContact C-O 3.54Å; P266-M271 VanDerWaalsContact C-O 3.28Å; P266-M271 HydrophobicContact CB-CB 3.97Å; P266-M271 HydrophobicContact CB-CE 3.46Å; P266-M271 VanDerWaalsContact CB-CE 3.46Å; P266-M271 HydrophobicContact CB-CG 4.33Å; P266-M271 HydrophobicContact CG-CE 3.98Å; P266-M271 PolarHBondContact O-N 3Å; P266-M271 VanDerWaalsContact O-N 3.13Å; P266-S273 WeakPolarHBondContact CG-O 3.49Å
267	S	97.2	Very high	97.5	Very high	82 Å²	82	35.8 Å²	35.8	57%	0.573	20%	0.203	S	C	*	.	G	3₁₀ helix	trans	-58.2	-24.1	175.2	59.8	0	0	0	0	113.3	Q265 I269 G270 M271	Q265-S267 PolarHBondContact O-N 2.86Å; S267-I269 PolarHBondContact O-N 2.9Å; S267-G270 PolarHBondContact O-N 3.31Å; S267-M271 WeakPolarHBondContact CA-O 3.48Å; S267-M271 PolarHBondContact N-O 3.46Å
268	F	94.8	Very high	97.5	Very high	75 Å²	75	39.5 Å²	39.5	33%	0.329	22%	0.22	S	C	.	.	G	3₁₀ helix	trans	-63.2	-22.3	175.6	-76.1	2.2	0	0	0	113.8	F225 E261 T262 Q265 P266	F225-F268 AromaticContact CE1-CE2 3.82Å; F225-F268 HydrophobicContact CE1-CE2 3.82Å; F225-F268 AromaticContact CE1-CZ 3.88Å; F225-F268 HydrophobicContact CE1-CZ 3.88Å; F225-F268 HydrophobicContact CE2-CE2 4.37Å; F225-F268 AromaticContact CZ-CE2 3.69Å; F225-F268 HydrophobicContact CZ-CE2 3.69Å; F225-F268 HydrophobicContact CZ-CZ 4.19Å; E261-F268 HydrophobicContact CB-CE2 4.45Å; E261-F268 HydrophobicContact CG-CD2 4.24Å; E261-F268 HydrophobicContact CG-CE2 3.81Å; T262-F268 HydrophobicContact CG2-CB 3.94Å; Q265-F268 HydrophobicContact CB-CD1 4.44Å; Q265-F268 HydrophobicContact CB-CD2 4.32Å; Q265-F268 HydrophobicContact CB-CE2 4.37Å; Q265-F268 HydrophobicContact CB-CG 4.38Å; Q265-F268 HydrophobicContact CB-CZ 4.49Å; Q265-F268 WeakPolarHBondContact O-CB 3.16Å; Q265-F268 PolarHBondContact O-N 2.92Å; Q265-F268 VanDerWaalsContact O-N 3.09Å; Q265-F268 VanDerWaalsContact OE1-CE2 3.27Å; P266-F268 PolarHBondContact O-N 2.9Å; P266-F268 VanDerWaalsContact O-N 3.13Å
269	I	96.1	Very high	97.5	Very high	59 Å²	59	37.3 Å²	37.3	30%	0.303	21%	0.213	S	C	.	.	G	3₁₀ helix	trans	-107.1	13.3	172	58.8	168.1	0	0	0	112.5	L182 Y190 T262 P266 S267 M271	L182-I269 HydrophobicContact CD1-CD1 3.55Å; L182-I269 HydrophobicContact CD2-CD1 4.17Å; L182-I269 HydrophobicContact CG-CD1 4.38Å; Y190-I269 HydrophobicContact CD1-CG2 4.14Å; Y190-I269 HydrophobicContact CD2-CG2 3.47Å; Y190-I269 VanDerWaalsContact CD2-CG2 3.47Å; Y190-I269 HydrophobicContact CE2-CG2 3.97Å; Y190-I269 HydrophobicContact CG-CG2 3.55Å; T262-I269 HydrophobicContact CG2-CG2 3.66Å; P266-I269 WeakPolarHBondContact O-CG1 3.4Å; P266-I269 PolarHBondContact O-N 3.08Å; S267-I269 PolarHBondContact O-N 2.9Å; I269-M271 VanDerWaalsContact C-N 3.31Å; I269-M271 HydrophobicContact CD1-CB 4.5Å; I269-M271 HydrophobicContact CG1-CB 4.2Å
270	G	95.5	Very high	97.5	Very high	66 Å²	66	37.4 Å²	37.4	68%	0.68	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	76	15.8	-178.7	0	0	0	0	0	114.1	S267	S267-G270 PolarHBondContact O-N 3.31Å
271	M	95.3	Very high	97.5	Very high	48 Å²	48	40.1 Å²	40.1	24%	0.236	22%	0.224	C	C	.	.			trans	-91.4	120.8	176.5	-173.9	168.1	66.7	0	0	110.7	L180 L182 P266 S267 I269 S273	L180-M271 HydrophobicContact CD1-CE 3.48Å; L180-M271 VanDerWaalsContact CD1-CE 3.48Å; L180-M271 HydrophobicContact CD1-SD 4.29Å; L180-M271 HydrophobicContact CD2-CE 4.35Å; L180-M271 HydrophobicContact CG-CE 3.95Å; L182-M271 HydrophobicContact CB-CE 3.4Å; L182-M271 VanDerWaalsContact CB-CE 3.4Å; L182-M271 HydrophobicContact CB-SD 4.38Å; L182-M271 HydrophobicContact CD2-CE 3.58Å; L182-M271 HydrophobicContact CG-CE 4.08Å; P266-M271 CarbonylContact C-O 3.54Å; P266-M271 VanDerWaalsContact C-O 3.28Å; P266-M271 HydrophobicContact CB-CB 3.97Å; P266-M271 HydrophobicContact CB-CE 3.46Å; P266-M271 VanDerWaalsContact CB-CE 3.46Å; P266-M271 HydrophobicContact CB-CG 4.33Å; P266-M271 HydrophobicContact CG-CE 3.98Å; P266-M271 PolarHBondContact O-N 3Å; P266-M271 VanDerWaalsContact O-N 3.13Å; S267-M271 WeakPolarHBondContact CA-O 3.48Å; S267-M271 PolarHBondContact N-O 3.46Å; I269-M271 VanDerWaalsContact C-N 3.31Å; I269-M271 HydrophobicContact CD1-CB 4.5Å; I269-M271 HydrophobicContact CG1-CB 4.2Å; M271-S273 VanDerWaalsContact C-N 3.29Å; M271-S273 PolarHBondContact O-N 2.68Å
272	E	94.7	Very high	97.5	Very high	205 Å²	205	42.8 Å²	42.8	96%	0.958	24%	0.238	S	C	*	.			trans	-81.8	73	173.8	-65.4	-175	176.2	0	0	110.6
273	S	95.4	Very high	97.5	Very high	51 Å²	51	42.8 Å²	42.8	36%	0.357	24%	0.238	S	C	.	.	S	Bend	trans	-143.1	156.7	175.8	-170	0	0	0	0	110.8	L180 P266 M271	L180-S273 WeakPolarHBondContact CD1-OG 3.44Å; P266-S273 WeakPolarHBondContact CG-O 3.49Å; M271-S273 VanDerWaalsContact C-N 3.29Å; M271-S273 PolarHBondContact O-N 2.68Å
274	A	97.8	Very high	97.5	Very high	25 Å²	25	42.8 Å²	42.8	21%	0.207	24%	0.238	C	C	.	.			trans	-70.4	149.9	173.7	0	0	0	0	0	110.8	E278 T279	A274-E278 HydrophobicContact CB-CB 3.82Å; A274-T279 HydrophobicContact CB-CG2 3.97Å
275	G	98.4	Very high	97.4	Very high	1 Å²	1	44.9 Å²	44.9	1%	0.01	25%	0.249	C	C	.	.			trans	-67.2	171.3	176.8	0	0	0	0	0	113.7	L263 F264 H277 E278 T279	L263-G275 CarbonylContact O-C 3.29Å; L263-G275 VanDerWaalsContact O-CA 3.28Å; L263-G275 WeakPolarHBondContact O-CA 3.28Å; F264-G275 WeakPolarHBondContact O-CA 3.33Å; G275-H277 VanDerWaalsContact C-N 3.3Å; G275-H277 PolarHBondContact O-N 3.28Å; G275-E278 PolarHBondContact O-N 3.28Å; G275-T279 WeakPolarHBondContact O-CG2 3.08Å; G275-T279 PolarHBondContact O-N 3.17Å; G275-T279 PolarHBondContact O-OG1 2.92Å
276	I	98.6	Very high	97.4	Very high	2 Å²	2	47 Å²	47	1%	0.01	26%	0.257	C	S	.	.	H	α-helix	trans	-58.7	-40	-179.4	56.4	168.9	0	0	0	112.6	L155 T162 L180 L263 F264 T279 T280 I311 M315	L155-I276 HydrophobicContact CD1-CB 4.3Å; L155-I276 HydrophobicContact CD1-CG2 4.34Å; L155-I276 HydrophobicContact CD2-CB 4.1Å; L155-I276 HydrophobicContact CD2-CD1 3.86Å; L155-I276 HydrophobicContact CD2-CG1 4.44Å; T162-I276 HydrophobicContact CG2-CG2 3.94Å; L180-I276 HydrophobicContact CD2-CG2 4.22Å; L263-I276 HydrophobicContact CB-CD1 3.97Å; L263-I276 HydrophobicContact CB-CG1 4.17Å; L263-I276 HydrophobicContact CB-CG2 4.23Å; L263-I276 HydrophobicContact CD1-CD1 4.48Å; L263-I276 HydrophobicContact CD2-CG2 4.46Å; L263-I276 PolarHBondContact O-N 3.46Å; F264-I276 HydrophobicContact CD1-CG1 4.26Å; F264-I276 HydrophobicContact CE1-CD1 4.16Å; F264-I276 HydrophobicContact CE1-CG1 4.03Å; F264-I276 HydrophobicContact CE2-CD1 3.93Å; F264-I276 HydrophobicContact CE2-CG1 4.36Å; F264-I276 HydrophobicContact CG-CG1 4.48Å; F264-I276 HydrophobicContact CZ-CD1 3.72Å; F264-I276 HydrophobicContact CZ-CG1 4.1Å; I276-T279 VanDerWaalsContact CA-OG1 3.3Å; I276-T279 WeakPolarHBondContact CA-OG1 3.42Å; I276-T279 PolarHBondContact O-N 3.15Å; I276-T279 PolarHBondContact O-OG1 3.07Å; I276-T280 PolarHBondContact O-N 2.94Å; I276-T280 PolarHBondContact O-OG1 3.03Å; I276-I311 HydrophobicContact CD1-CD1 4.09Å; I276-I311 HydrophobicContact CD1-CG1 4.45Å; I276-M315 HydrophobicContact CD1-SD 3.84Å; I276-M315 HydrophobicContact CG1-SD 3.86Å
277	H	98.5	Very high	97.4	Very high	16 Å²	16	46.9 Å²	46.9	7%	0.074	26%	0.256	C	S	.	.	H	α-helix	trans	-64.4	-46.1	177.5	62.6	-67.4	0	0	0	112.7	F264 G275 T280 Y281 M315 E318	F264-H277 HydrophobicContact CD1-CB 4.27Å; F264-H277 AromaticContact CD1-CG 3.97Å; F264-H277 AromaticContact CD1-ND1 3.39Å; F264-H277 WeakPolarHBondContact CD1-ND1 3.44Å; F264-H277 HydrophobicContact CE1-CB 4.28Å; F264-H277 PolarHBondContact O-CE1 3.29Å; G275-H277 VanDerWaalsContact C-N 3.3Å; G275-H277 PolarHBondContact O-N 3.28Å; H277-T280 PolarHBondContact O-N 3.33Å; H277-Y281 PolarHBondContact O-N 3.12Å; H277-M315 HydrophobicContact CB-SD 3.86Å; H277-E318 HydrophobicContact CB-CB 3.62Å; H277-E318 HydrophobicContact CB-CG 4.27Å
278	E	98.4	Very high	97.4	Very high	77 Å²	77	48.5 Å²	48.5	36%	0.36	26%	0.258	S	S	.	.	H	α-helix	trans	-66.4	-41.3	175.5	-76.8	177.1	-118.4	0	0	111.8	A274 G275 Y281 N282 L322	A274-E278 HydrophobicContact CB-CB 3.82Å; G275-E278 PolarHBondContact O-N 3.28Å; E278-Y281 PolarHBondContact O-N 3.26Å; E278-N282 VanDerWaalsContact O-CB 3.27Å; E278-N282 WeakPolarHBondContact O-CB 3.48Å; E278-N282 PolarHBondContact O-N 2.91Å; E278-N282 PolarHBondContact O-ND2 3.05Å; E278-N282 VanDerWaalsContact O-ND2 3.13Å; E278-L322 HydrophobicContact CG-CD1 4.06Å
279	T	98.4	Very high	97.5	Very high	5 Å²	5	50.7 Å²	50.7	3%	0.031	27%	0.272	C	S	.	.	H	α-helix	trans	-67.4	-34.6	177.2	52.6	0	0	0	0	112.1	N164 M178 A274 G275 I276 S283	N164-T279 PolarHBondContact ND2-OG1 3.06Å; M178-T279 HydrophobicContact CE-CG2 4.34Å; M178-T279 WeakPolarHBondContact CG-O 3.39Å; A274-T279 HydrophobicContact CB-CG2 3.97Å; G275-T279 WeakPolarHBondContact O-CG2 3.08Å; G275-T279 PolarHBondContact O-N 3.17Å; G275-T279 PolarHBondContact O-OG1 2.92Å; I276-T279 VanDerWaalsContact CA-OG1 3.3Å; I276-T279 WeakPolarHBondContact CA-OG1 3.42Å; I276-T279 PolarHBondContact O-N 3.15Å; I276-T279 PolarHBondContact O-OG1 3.07Å; T279-S283 VanDerWaalsContact O-CB 3.29Å; T279-S283 WeakPolarHBondContact O-CB 3.24Å; T279-S283 PolarHBondContact O-N 3.4Å
280	T	98.7	Very high	97.5	Very high	1 Å²	1	54.6 Å²	54.6	1%	0.006	29%	0.294	C	S	.	.	H	α-helix	trans	-61.3	-50	168.7	-52.9	0	0	0	0	110.7	I153 N164 I276 H277 N282 S283 I284 N299 M315 I319	I153-T280 HydrophobicContact CD1-CG2 3.9Å; I153-T280 HydrophobicContact CG1-CG2 4.45Å; I153-T280 HydrophobicContact CG2-CG2 4.13Å; N164-T280 PolarHBondContact ND2-N 2.78Å; N164-T280 WeakPolarHBondContact OD1-CA 3.47Å; N164-T280 WeakPolarHBondContact OD1-CB 3.49Å; N164-T280 PolarHBondContact OD1-OG1 3.48Å; I276-T280 PolarHBondContact O-N 2.94Å; I276-T280 PolarHBondContact O-OG1 3.03Å; H277-T280 PolarHBondContact O-N 3.33Å; T280-N282 PolarHBondContact O-N 3.03Å; T280-S283 WeakPolarHBondContact O-CB 3.45Å; T280-S283 PolarHBondContact O-N 3.33Å; T280-I284 HydrophobicContact CG2-CD1 4.38Å; T280-I284 WeakPolarHBondContact O-CG1 3.48Å; T280-I284 PolarHBondContact O-N 3.16Å; T280-I284 VanDerWaalsContact O-N 3.1Å; T280-N299 VanDerWaalsContact CG2-OD1 3.26Å; T280-N299 WeakPolarHBondContact CG2-OD1 3.16Å; T280-M315 WeakPolarHBondContact OG1-CE 3.45Å; T280-I319 HydrophobicContact CG2-CD1 3.88Å
281	Y	98.5	Very high	97.6	Very high	58 Å²	58	52.4 Å²	52.4	23%	0.227	27%	0.266	C	S	.	.	H	α-helix	trans	-58.2	-47.7	177.3	168.4	-95.1	0	0	0	112.3	H277 E278 S283 I284 M285 Y296 L322	H277-Y281 PolarHBondContact O-N 3.12Å; E278-Y281 PolarHBondContact O-N 3.26Å; Y281-S283 VanDerWaalsContact C-N 3.31Å; Y281-S283 PolarHBondContact O-N 3.03Å; Y281-I284 PolarHBondContact O-N 2.74Å; Y281-M285 HydrophobicContact CD1-CG 4.22Å; Y281-M285 HydrophobicContact CD2-CG 4.32Å; Y281-M285 HydrophobicContact CE1-CG 3.71Å; Y281-M285 HydrophobicContact CE2-CE 3.73Å; Y281-M285 HydrophobicContact CE2-CG 3.81Å; Y281-M285 HydrophobicContact CE2-SD 4.34Å; Y281-M285 HydrophobicContact CG-CG 4.49Å; Y281-M285 VanDerWaalsContact CZ-CG 3.47Å; Y281-M285 WeakPolarHBondContact O-CG 3.41Å; Y281-M285 PolarHBondContact O-N 3.4Å; Y281-Y296 VanDerWaalsContact CD2-OH 3.26Å; Y281-Y296 WeakPolarHBondContact CD2-OH 3.31Å; Y281-Y296 WeakPolarHBondContact CE2-OH 3.48Å; Y281-L322 HydrophobicContact CD2-CB 3.7Å; Y281-L322 HydrophobicContact CE2-CB 4.13Å; Y281-L322 VanDerWaalsContact CE2-O 3.23Å; Y281-L322 WeakPolarHBondContact CE2-O 3.36Å; Y281-L322 HydrophobicContact CG-CB 3.96Å; Y281-L322 HydrophobicContact CG-CD1 4.19Å
282	N	98.5	Very high	97.7	Very high	56 Å²	56	52.7 Å²	52.7	30%	0.299	27%	0.265	S	S	.	.	H	α-helix	trans	-62.9	-37.6	179.8	-72.3	-27.7	0	0	0	111.8	M178 E278 T280 M285 K286	M178-N282 HydrophobicContact CE-CB 4.32Å; E278-N282 VanDerWaalsContact O-CB 3.27Å; E278-N282 WeakPolarHBondContact O-CB 3.48Å; E278-N282 PolarHBondContact O-N 2.91Å; E278-N282 PolarHBondContact O-ND2 3.05Å; E278-N282 VanDerWaalsContact O-ND2 3.13Å; T280-N282 PolarHBondContact O-N 3.03Å; N282-M285 PolarHBondContact O-N 3.16Å; N282-K286 WeakPolarHBondContact O-CG 3.47Å; N282-K286 PolarHBondContact O-N 3.29Å; N282-K286 VanDerWaalsContact O-N 3.07Å
283	S	98.7	Very high	97.8	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-60.8	-48.9	173.5	-178.2	0	0	0	0	111.2	I153 P166 A176 T279 T280 Y281 M285 K286 C287	I153-S283 WeakPolarHBondContact CD1-OG 3.4Å; P166-S283 VanDerWaalsContact CD-OG 3.28Å; P166-S283 WeakPolarHBondContact CD-OG 3.31Å; P166-S283 WeakPolarHBondContact CG-OG 3.32Å; A176-S283 WeakPolarHBondContact O-CB 3.49Å; A176-S283 PolarHBondContact O-OG 3.04Å; T279-S283 VanDerWaalsContact O-CB 3.29Å; T279-S283 WeakPolarHBondContact O-CB 3.24Å; T279-S283 PolarHBondContact O-N 3.4Å; T280-S283 WeakPolarHBondContact O-CB 3.45Å; T280-S283 PolarHBondContact O-N 3.33Å; Y281-S283 VanDerWaalsContact C-N 3.31Å; Y281-S283 PolarHBondContact O-N 3.03Å; S283-M285 VanDerWaalsContact C-N 3.31Å; S283-M285 PolarHBondContact O-N 3.31Å; S283-K286 WeakPolarHBondContact O-CB 3.26Å; S283-K286 PolarHBondContact O-N 2.93Å; S283-K286 VanDerWaalsContact O-N 3.15Å; S283-C287 PolarHBondContact O-N 2.82Å; S283-C287 PolarHBondContact O-SG 3.27Å; S283-C287 VanDerWaalsContact O-SG 3.39Å
284	I	98.5	Very high	97.9	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-62.6	-38.2	176.5	-61.2	171.4	0	0	0	111.4	I153 T280 Y281 K286 C287 R292 L295 Y296	I153-I284 HydrophobicContact CD1-CD1 4.4Å; I153-I284 HydrophobicContact CD1-CG1 3.72Å; I153-I284 HydrophobicContact CG2-CD1 4.11Å; I153-I284 HydrophobicContact CG2-CG1 4.35Å; T280-I284 HydrophobicContact CG2-CD1 4.38Å; T280-I284 WeakPolarHBondContact O-CG1 3.48Å; T280-I284 PolarHBondContact O-N 3.16Å; T280-I284 VanDerWaalsContact O-N 3.1Å; Y281-I284 PolarHBondContact O-N 2.74Å; I284-K286 VanDerWaalsContact C-N 3.26Å; I284-K286 PolarHBondContact O-N 3.4Å; I284-C287 WeakPolarHBondContact O-CB 3.39Å; I284-C287 PolarHBondContact O-N 3.08Å; I284-C287 VanDerWaalsContact O-N 3.1Å; I284-R292 HydrophobicContact CG2-CB 3.84Å; I284-R292 HydrophobicContact CG2-CG 3.86Å; I284-R292 PolarHBondContact O-NE 3.46Å; I284-L295 HydrophobicContact CD1-CB 4.32Å; I284-L295 HydrophobicContact CG1-CB 4.04Å; I284-L295 HydrophobicContact CG1-CD1 4.42Å; I284-L295 HydrophobicContact CG2-CB 4.21Å; I284-L295 HydrophobicContact CG2-CD1 4.31Å; I284-Y296 HydrophobicContact CB-CE1 4.35Å; I284-Y296 HydrophobicContact CD1-CD1 3.4Å; I284-Y296 HydrophobicContact CD1-CE1 3.43Å; I284-Y296 VanDerWaalsContact CD1-CE1 3.43Å; I284-Y296 HydrophobicContact CD1-CG 4.1Å; I284-Y296 HydrophobicContact CG1-CE1 4.49Å; I284-Y296 HydrophobicContact CG2-CD1 4.41Å; I284-Y296 HydrophobicContact CG2-CD2 4.04Å; I284-Y296 HydrophobicContact CG2-CE1 4.07Å; I284-Y296 HydrophobicContact CG2-CE2 3.65Å; I284-Y296 HydrophobicContact CG2-CG 4.4Å
285	M	97.7	Very high	98	Very high	48 Å²	48	49.4 Å²	49.4	24%	0.236	24%	0.24	C	C	.	.	H	α-helix	trans	-69.2	-21.2	178.2	-76.1	-66.5	137	0	0	114	Y281 N282 S283 C287 R292 Y296	Y281-M285 HydrophobicContact CD1-CG 4.22Å; Y281-M285 HydrophobicContact CD2-CG 4.32Å; Y281-M285 HydrophobicContact CE1-CG 3.71Å; Y281-M285 HydrophobicContact CE2-CE 3.73Å; Y281-M285 HydrophobicContact CE2-CG 3.81Å; Y281-M285 HydrophobicContact CE2-SD 4.34Å; Y281-M285 HydrophobicContact CG-CG 4.49Å; Y281-M285 VanDerWaalsContact CZ-CG 3.47Å; Y281-M285 WeakPolarHBondContact O-CG 3.41Å; Y281-M285 PolarHBondContact O-N 3.4Å; N282-M285 PolarHBondContact O-N 3.16Å; S283-M285 VanDerWaalsContact C-N 3.31Å; S283-M285 PolarHBondContact O-N 3.31Å; M285-C287 VanDerWaalsContact C-N 3.32Å; M285-R292 PolarHBondContact O-NH2 3.09Å; M285-R292 PolarHBondContact SD-NH1 3.05Å; M285-Y296 HydrophobicContact CE-CE2 4.16Å; M285-Y296 WeakPolarHBondContact CE-OH 3.23Å
286	K	98.3	Very high	98	Very high	108 Å²	108	49.4 Å²	49.4	47%	0.47	24%	0.239	S	C	.	.	H	α-helix	trans	-79.1	-16.2	171.3	-73.9	176.1	177.2	-175	0	113	A176 M178 N282 S283 I284	A176-K286 HydrophobicContact CB-CB 3.72Å; M178-K286 HydrophobicContact SD-CD 4.2Å; M178-K286 PolarHBondContact SD-NZ 2.92Å; N282-K286 WeakPolarHBondContact O-CG 3.47Å; N282-K286 PolarHBondContact O-N 3.29Å; N282-K286 VanDerWaalsContact O-N 3.07Å; S283-K286 WeakPolarHBondContact O-CB 3.26Å; S283-K286 PolarHBondContact O-N 2.93Å; S283-K286 VanDerWaalsContact O-N 3.15Å; I284-K286 VanDerWaalsContact C-N 3.26Å; I284-K286 PolarHBondContact O-N 3.4Å
287	C	98	Very high	97.9	Very high	2 Å²	2	50.6 Å²	50.6	1%	0.014	25%	0.249	C	C	.	.	S	Bend	trans	-81.9	159.5	176.5	-61.7	0	0	0	0	112.2	L173 S283 I284 M285 I291 R292 L295	L173-C287 HydrophobicContact CD1-CB 4.47Å; S283-C287 PolarHBondContact O-N 2.82Å; S283-C287 PolarHBondContact O-SG 3.27Å; S283-C287 VanDerWaalsContact O-SG 3.39Å; I284-C287 WeakPolarHBondContact O-CB 3.39Å; I284-C287 PolarHBondContact O-N 3.08Å; I284-C287 VanDerWaalsContact O-N 3.1Å; M285-C287 VanDerWaalsContact C-N 3.32Å; C287-I291 HydrophobicContact CB-CD1 3.91Å; C287-I291 HydrophobicContact CB-CG1 4.04Å; C287-R292 VanDerWaalsContact O-CZ 3.29Å; C287-R292 PolarHBondContact O-NE 2.93Å; C287-R292 PolarHBondContact O-NH2 3.13Å; C287-L295 HydrophobicContact CB-CD1 3.75Å; C287-L295 VanDerWaalsContact SG-CD1 3.58Å
288	D	96.8	Very high	97.9	Very high	116 Å²	116	51.3 Å²	51.3	62%	0.62	25%	0.254	S	S	*	.			trans	-59.6	143.6	175.3	-68	-41.7	0	0	0	112	D290 I291 R292	D288-D290 PolarHBondContact O-N 2.8Å; D288-D290 VanDerWaalsContact O-N 3.15Å; D288-I291 VanDerWaalsContact O-CG1 3.29Å; D288-I291 WeakPolarHBondContact O-CG1 3.39Å; D288-I291 PolarHBondContact O-N 3.42Å; D288-R292 WeakPolarHBondContact O-CG 3.32Å; D288-R292 PolarHBondContact O-N 3.02Å
289	I	96	Very high	97.9	Very high	121 Å²	121	47.9 Å²	47.9	62%	0.621	24%	0.238	S	C	*	.	H	α-helix	trans	-56.6	-35.1	-173.4	-167.4	167.6	0	0	0	112.9	I291 R292	I289-I291 VanDerWaalsContact C-N 3.29Å; I289-I291 PolarHBondContact O-N 3.08Å; I289-R292 PolarHBondContact O-N 2.86Å
290	D	96.2	Very high	97.9	Very high	140 Å²	140	47.6 Å²	47.6	75%	0.749	24%	0.236	S	C	*	.	H	α-helix	trans	-67	-29.2	-175	-65.1	-21.6	0	0	0	112.7	D288	D288-D290 PolarHBondContact O-N 2.8Å; D288-D290 VanDerWaalsContact O-N 3.15Å
291	I	97.1	Very high	97.9	Very high	21 Å²	21	47.7 Å²	47.7	11%	0.108	24%	0.236	C	C	.	.	H	α-helix	trans	-96.4	-14.4	-177.5	68.1	166.3	0	0	0	113.2	Y168 L173 C287 D288 I289 K293 D294 L295	Y168-I291 HydrophobicContact CD2-CB 3.95Å; Y168-I291 HydrophobicContact CD2-CD1 4.33Å; Y168-I291 HydrophobicContact CD2-CG2 3.53Å; Y168-I291 HydrophobicContact CE2-CB 4.19Å; Y168-I291 HydrophobicContact CE2-CG2 3.43Å; Y168-I291 VanDerWaalsContact CE2-CG2 3.43Å; Y168-I291 HydrophobicContact CG-CD1 4.46Å; Y168-I291 HydrophobicContact CG-CG2 4.27Å; L173-I291 HydrophobicContact CD1-CD1 3.52Å; C287-I291 HydrophobicContact CB-CD1 3.91Å; C287-I291 HydrophobicContact CB-CG1 4.04Å; D288-I291 VanDerWaalsContact O-CG1 3.29Å; D288-I291 WeakPolarHBondContact O-CG1 3.39Å; D288-I291 PolarHBondContact O-N 3.42Å; I289-I291 VanDerWaalsContact C-N 3.29Å; I289-I291 PolarHBondContact O-N 3.08Å; I291-K293 PolarHBondContact O-N 3.02Å; I291-D294 PolarHBondContact O-N 3.46Å; I291-L295 HydrophobicContact CD1-CD1 4.17Å; I291-L295 HydrophobicContact CG1-CD1 4.23Å; I291-L295 WeakPolarHBondContact O-CG 3.28Å; I291-L295 PolarHBondContact O-N 3.31Å; I291-L295 VanDerWaalsContact O-N 3.08Å
292	R	98	Very high	97.9	Very high	54 Å²	54	45 Å²	45	20%	0.204	23%	0.226	C	C	.	.	H	α-helix	trans	-58.4	-36.2	-175.4	-63.3	-173.6	-170.7	174.9	1.3	113	I284 M285 C287 D288 I289 D294 L295 Y296	I284-R292 HydrophobicContact CG2-CB 3.84Å; I284-R292 HydrophobicContact CG2-CG 3.86Å; I284-R292 PolarHBondContact O-NE 3.46Å; M285-R292 PolarHBondContact O-NH2 3.09Å; M285-R292 PolarHBondContact SD-NH1 3.05Å; C287-R292 VanDerWaalsContact O-CZ 3.29Å; C287-R292 PolarHBondContact O-NE 2.93Å; C287-R292 PolarHBondContact O-NH2 3.13Å; D288-R292 WeakPolarHBondContact O-CG 3.32Å; D288-R292 PolarHBondContact O-N 3.02Å; I289-R292 PolarHBondContact O-N 2.86Å; R292-D294 VanDerWaalsContact C-N 3.29Å; R292-D294 PolarHBondContact O-N 3.14Å; R292-L295 PolarHBondContact O-N 3.03Å; R292-Y296 HydrophobicContact CB-CD2 4.32Å; R292-Y296 HydrophobicContact CB-CE2 4.29Å; R292-Y296 WeakPolarHBondContact O-CB 3.31Å; R292-Y296 WeakPolarHBondContact O-CD2 3.29Å; R292-Y296 PolarHBondContact O-N 3.48Å
293	K	97.6	Very high	97.9	Very high	142 Å²	142	42.6 Å²	42.6	62%	0.617	22%	0.215	S	C	*	.	H	α-helix	trans	-57.8	-44.4	177.3	179.8	-175.2	172.2	-170.5	0	111.2	I291 A297 M327	I291-K293 PolarHBondContact O-N 3.02Å; K293-A297 WeakPolarHBondContact O-CB 3.39Å; K293-A297 PolarHBondContact O-N 2.84Å; K293-M327 HydrophobicContact CB-SD 4.21Å
294	D	97.6	Very high	97.8	Very high	70 Å²	70	44.7 Å²	44.7	37%	0.374	24%	0.236	S	C	.	.	H	α-helix	trans	-74.1	-35.5	-179.1	-64	-36	0	0	0	111.8	T151 I291 R292 A297 N298	T151-D294 HydrophobicContact CG2-CB 3.86Å; I291-D294 PolarHBondContact O-N 3.46Å; R292-D294 VanDerWaalsContact C-N 3.29Å; R292-D294 PolarHBondContact O-N 3.14Å; D294-A297 PolarHBondContact O-N 3Å; D294-N298 WeakPolarHBondContact O-CB 3.48Å; D294-N298 PolarHBondContact O-N 3.4Å; D294-N298 VanDerWaalsContact O-N 3.15Å; D294-N298 PolarHBondContact O-ND2 3.38Å
295	L	98.3	Very high	97.8	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-62.8	-47.2	172.9	-60.4	-179.7	0	0	0	111.3	G152 P166 I284 C287 I291 R292 A297 N298 N299	G152-L295 VanDerWaalsContact C-CD2 3.46Å; G152-L295 WeakPolarHBondContact O-CD2 3.42Å; P166-L295 HydrophobicContact CB-CD1 4.1Å; P166-L295 HydrophobicContact CB-CD2 4.35Å; I284-L295 HydrophobicContact CD1-CB 4.32Å; I284-L295 HydrophobicContact CG1-CB 4.04Å; I284-L295 HydrophobicContact CG1-CD1 4.42Å; I284-L295 HydrophobicContact CG2-CB 4.21Å; I284-L295 HydrophobicContact CG2-CD1 4.31Å; C287-L295 HydrophobicContact CB-CD1 3.75Å; C287-L295 VanDerWaalsContact SG-CD1 3.58Å; I291-L295 HydrophobicContact CD1-CD1 4.17Å; I291-L295 HydrophobicContact CG1-CD1 4.23Å; I291-L295 WeakPolarHBondContact O-CG 3.28Å; I291-L295 PolarHBondContact O-N 3.31Å; I291-L295 VanDerWaalsContact O-N 3.08Å; R292-L295 PolarHBondContact O-N 3.03Å; L295-A297 VanDerWaalsContact C-N 3.31Å; L295-A297 PolarHBondContact O-N 2.95Å; L295-N298 CarbonylContact O-C 3.52Å; L295-N298 PolarHBondContact O-N 2.86Å; L295-N298 VanDerWaalsContact O-N 3.13Å; L295-N299 PolarHBondContact O-ND2 3.25Å
296	Y	98.4	Very high	97.9	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-62.8	-34.9	176.1	-80.8	-51.7	0	0	0	113.4	Y281 I284 M285 R292 N298 N299 I319 A323 M327 K328 I329 K330	Y281-Y296 VanDerWaalsContact CD2-OH 3.26Å; Y281-Y296 WeakPolarHBondContact CD2-OH 3.31Å; Y281-Y296 WeakPolarHBondContact CE2-OH 3.48Å; I284-Y296 HydrophobicContact CB-CE1 4.35Å; I284-Y296 HydrophobicContact CD1-CD1 3.4Å; I284-Y296 HydrophobicContact CD1-CE1 3.43Å; I284-Y296 VanDerWaalsContact CD1-CE1 3.43Å; I284-Y296 HydrophobicContact CD1-CG 4.1Å; I284-Y296 HydrophobicContact CG1-CE1 4.49Å; I284-Y296 HydrophobicContact CG2-CD1 4.41Å; I284-Y296 HydrophobicContact CG2-CD2 4.04Å; I284-Y296 HydrophobicContact CG2-CE1 4.07Å; I284-Y296 HydrophobicContact CG2-CE2 3.65Å; I284-Y296 HydrophobicContact CG2-CG 4.4Å; M285-Y296 HydrophobicContact CE-CE2 4.16Å; M285-Y296 WeakPolarHBondContact CE-OH 3.23Å; R292-Y296 HydrophobicContact CB-CD2 4.32Å; R292-Y296 HydrophobicContact CB-CE2 4.29Å; R292-Y296 WeakPolarHBondContact O-CB 3.31Å; R292-Y296 WeakPolarHBondContact O-CD2 3.29Å; R292-Y296 PolarHBondContact O-N 3.48Å; Y296-N298 VanDerWaalsContact C-N 3.26Å; Y296-N298 PolarHBondContact O-N 2.91Å; Y296-N299 PolarHBondContact O-ND2 3.46Å; Y296-I319 HydrophobicContact CD1-CG2 4.03Å; Y296-I319 HydrophobicContact CE1-CG2 3.99Å; Y296-A323 HydrophobicContact CD1-CB 4.21Å; Y296-A323 HydrophobicContact CE1-CB 3.66Å; Y296-A323 HydrophobicContact CE2-CB 4.3Å; Y296-M327 HydrophobicContact CD2-CB 3.9Å; Y296-M327 HydrophobicContact CD2-CG 3.67Å; Y296-M327 HydrophobicContact CD2-SD 4.05Å; Y296-M327 HydrophobicContact CE2-CB 4.42Å; Y296-M327 HydrophobicContact CE2-CG 3.93Å; Y296-M327 HydrophobicContact CG-CB 4.3Å; Y296-K328 CarbonylContact C-O 3.55Å; Y296-I329 HydrophobicContact CD1-CD1 3.34Å; Y296-I329 HydrophobicContact CD2-CD1 4.44Å; Y296-I329 HydrophobicContact CE1-CD1 4.09Å; Y296-I329 HydrophobicContact CG-CD1 3.56Å; Y296-I329 WeakPolarHBondContact O-CA 3.43Å; Y296-K330 PolarHBondContact O-N 2.94Å
297	A	97.9	Very high	97.9	Very high	27 Å²	27	40.9 Å²	40.9	22%	0.223	22%	0.221	C	C	.	.	H	α-helix	trans	-77.9	-8.7	177.5	0	0	0	0	0	113.6	K293 D294 L295 K330	K293-A297 WeakPolarHBondContact O-CB 3.39Å; K293-A297 PolarHBondContact O-N 2.84Å; D294-A297 PolarHBondContact O-N 3Å; L295-A297 VanDerWaalsContact C-N 3.31Å; L295-A297 PolarHBondContact O-N 2.95Å; A297-K330 WeakPolarHBondContact O-CB 3.32Å
298	N	98.2	Very high	97.9	Very high	32 Å²	32	41.4 Å²	41.4	17%	0.171	22%	0.223	C	C	.	.			trans	-139.2	62.5	-175.6	-62.1	-66.3	0	0	0	111.8	R149 G152 I153 D294 L295 Y296 V300 I332	R149-N298 WeakPolarHBondContact CD-OD1 3.21Å; R149-N298 PolarHBondContact NE-OD1 2.96Å; G152-N298 CarbonylContact C-O 3.59Å; G152-N298 VanDerWaalsContact CA-O 3.31Å; G152-N298 WeakPolarHBondContact CA-O 3.27Å; I153-N298 PolarHBondContact N-O 2.82Å; D294-N298 WeakPolarHBondContact O-CB 3.48Å; D294-N298 PolarHBondContact O-N 3.4Å; D294-N298 VanDerWaalsContact O-N 3.15Å; D294-N298 PolarHBondContact O-ND2 3.38Å; L295-N298 CarbonylContact O-C 3.52Å; L295-N298 PolarHBondContact O-N 2.86Å; L295-N298 VanDerWaalsContact O-N 3.13Å; Y296-N298 VanDerWaalsContact C-N 3.26Å; Y296-N298 PolarHBondContact O-N 2.91Å; N298-V300 PolarHBondContact O-N 2.84Å; N298-I332 HydrophobicContact CB-CD1 4.32Å
299	N	98.6	Very high	98	Very high	4 Å²	4	39.9 Å²	39.9	2%	0.021	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	104.5	171.5	-67.9	-100.3	0	0	0	109.3	I153 T280 L295 Y296 K330 I331 I332	I153-N299 HydrophobicContact CG2-CB 4.14Å; I153-N299 WeakPolarHBondContact CG2-OD1 3.47Å; I153-N299 CarbonylContact O-C 3.57Å; I153-N299 WeakPolarHBondContact O-CA 3.37Å; T280-N299 VanDerWaalsContact CG2-OD1 3.26Å; T280-N299 WeakPolarHBondContact CG2-OD1 3.16Å; L295-N299 PolarHBondContact O-ND2 3.25Å; Y296-N299 PolarHBondContact O-ND2 3.46Å; N299-K330 PolarHBondContact N-O 3.1Å; N299-K330 VanDerWaalsContact N-O 3.11Å; N299-I331 HydrophobicContact CB-CD1 3.62Å; N299-I331 CarbonylContact O-C 3.59Å; N299-I332 PolarHBondContact O-N 2.8Å
300	V	98.8	Very high	98.1	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	126.8	-178.2	-179.7	0	0	0	0	110.1	L144 I153 V154 L155 N298 I332	L144-V300 HydrophobicContact CD1-CB 4.46Å; L144-V300 HydrophobicContact CD1-CG2 3.76Å; I153-V300 PolarHBondContact O-N 2.9Å; V154-V300 CarbonylContact C-O 3.59Å; V154-V300 VanDerWaalsContact CA-O 3.31Å; V154-V300 WeakPolarHBondContact CA-O 3.39Å; V154-V300 HydrophobicContact CG2-CB 4.21Å; L155-V300 PolarHBondContact N-O 2.93Å; N298-V300 PolarHBondContact O-N 2.84Å; V300-I332 WeakPolarHBondContact CA-O 3.16Å; V300-I332 HydrophobicContact CG2-CB 4.14Å; V300-I332 HydrophobicContact CG2-CD1 3.92Å; V300-I332 HydrophobicContact CG2-CG2 4.37Å
301	L	98.8	Very high	98.2	Very high	2 Å²	2	28.9 Å²	28.9	1%	0.01	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	131.1	172.6	-56.3	-169	0	0	0	109.9	L155 T306 I311 A312 I331 I332 A333 R337	L155-L301 HydrophobicContact CB-CD2 3.95Å; L155-L301 HydrophobicContact CD2-CD2 3.91Å; L155-L301 HydrophobicContact CG-CD2 4.33Å; L301-T306 HydrophobicContact CB-CG2 4.37Å; L301-I311 HydrophobicContact CD1-CG2 3.98Å; L301-A312 HydrophobicContact CD1-CB 4.13Å; L301-I331 HydrophobicContact CD1-CG2 3.85Å; L301-I331 HydrophobicContact CD2-CG2 4.18Å; L301-I331 HydrophobicContact CG-CG2 3.8Å; L301-I332 PolarHBondContact N-O 3.28Å; L301-A333 HydrophobicContact CB-CB 4.37Å; L301-A333 HydrophobicContact CD1-CB 3.98Å; L301-A333 HydrophobicContact CG-CB 4.34Å; L301-R337 WeakPolarHBondContact O-CB 3.31Å
302	S	98.5	Very high	98.3	Very high	1 Å²	1	29.1 Å²	29.1	1%	0.007	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	157.5	177.7	-168.1	0	0	0	0	111.6	S143 L155 D156 S157 T306	S143-S302 WeakPolarHBondContact CB-OG 3.5Å; S143-S302 WeakPolarHBondContact OG-CB 3.26Å; S143-S302 PolarHBondContact OG-OG 2.84Å; L155-S302 PolarHBondContact O-N 3.48Å; D156-S302 WeakPolarHBondContact CA-O 3.32Å; S157-S302 PolarHBondContact N-O 3.11Å; S302-T306 WeakPolarHBondContact O-CG2 3.45Å; S302-T306 PolarHBondContact O-OG1 3.36Å
303	G	97.9	Very high	98.4	Very high	7 Å²	7	31.5 Å²	31.5	7%	0.072	19%	0.19	C	C	.	.	S	Bend	trans	87.9	158.4	175.4	0	0	0	0	0	114	S157 T305 T306 R337	S157-G303 CarbonylContact O-C 3.49Å; S157-G303 WeakPolarHBondContact O-CA 3.37Å; G303-T305 VanDerWaalsContact C-N 3.34Å; G303-T305 PolarHBondContact O-N 2.76Å; G303-T306 PolarHBondContact O-N 3.35Å; G303-T306 PolarHBondContact O-OG1 2.97Å; G303-R337 PolarHBondContact N-O 2.94Å; G303-R337 VanDerWaalsContact N-O 3.11Å
304	G	97.3	Very high	98.4	Very high	43 Å²	43	25.3 Å²	25.3	44%	0.443	16%	0.163	S	C	.	.	G	3₁₀ helix	trans	-63.7	-32.8	-170.7	0	0	0	0	0	114.6	S157 T306 M307	S157-G304 PolarHBondContact O-N 3.31Å; G304-T306 PolarHBondContact O-N 3.4Å; G304-M307 WeakPolarHBondContact O-CB 3.5Å; G304-M307 VanDerWaalsContact O-CG 3.22Å; G304-M307 WeakPolarHBondContact O-CG 3.5Å; G304-M307 PolarHBondContact O-N 2.86Å
305	T	98.5	Very high	98.5	Very high	9 Å²	9	22 Å²	22	6%	0.055	15%	0.145	C	C	.	.	G	3₁₀ helix	trans	-72.4	-20.7	179.9	-66	0	0	0	0	111.8	S157 G158 G184 L187 L263 G303 M307 Y308	S157-T305 WeakPolarHBondContact O-CB 3.3Å; S157-T305 PolarHBondContact O-N 2.86Å; S157-T305 VanDerWaalsContact OG-CB 3.26Å; S157-T305 WeakPolarHBondContact OG-CB 3.44Å; S157-T305 VanDerWaalsContact OG-CG2 3.28Å; S157-T305 WeakPolarHBondContact OG-CG2 3.36Å; G158-T305 PolarHBondContact O-OG1 3.06Å; G184-T305 WeakPolarHBondContact CA-OG1 3.28Å; G184-T305 PolarHBondContact N-OG1 3.19Å; L187-T305 HydrophobicContact CD1-CG2 3.75Å; L263-T305 HydrophobicContact CD1-CG2 3.78Å; L263-T305 HydrophobicContact CD2-CG2 4.1Å; G303-T305 VanDerWaalsContact C-N 3.34Å; G303-T305 PolarHBondContact O-N 2.76Å; T305-M307 PolarHBondContact O-N 3.32Å; T305-Y308 HydrophobicContact CG2-CE2 4.15Å; T305-Y308 WeakPolarHBondContact O-CD2 3.39Å
306	T	98.7	Very high	98.5	Very high	1 Å²	1	25 Å²	25	1%	0.006	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-79.3	4.3	171	74.9	0	0	0	0	113.4	L301 S302 G303 G304 Y308 I311 R337	L301-T306 HydrophobicContact CB-CG2 4.37Å; S302-T306 WeakPolarHBondContact O-CG2 3.45Å; S302-T306 PolarHBondContact O-OG1 3.36Å; G303-T306 PolarHBondContact O-N 3.35Å; G303-T306 PolarHBondContact O-OG1 2.97Å; G304-T306 PolarHBondContact O-N 3.4Å; T306-Y308 VanDerWaalsContact C-N 3.28Å; T306-Y308 PolarHBondContact O-N 3.37Å; T306-I311 VanDerWaalsContact O-CG2 3.29Å; T306-I311 WeakPolarHBondContact O-CG2 3.32Å; T306-R337 VanDerWaalsContact O-CZ 3.27Å; T306-R337 PolarHBondContact O-NE 2.88Å; T306-R337 PolarHBondContact O-NH2 3.11Å; T306-R337 WeakPolarHBondContact OG1-CD 3.29Å; T306-R337 PolarHBondContact OG1-NE 2.83Å
307	M	98.4	Very high	98.5	Very high	66 Å²	66	28.7 Å²	28.7	33%	0.325	18%	0.175	S	C	.	.	G	3₁₀ helix	trans	-78.4	-7.4	178.5	-64.8	-63.6	-64.2	0	0	114	G304 T305 R337 K338	G304-M307 WeakPolarHBondContact O-CB 3.5Å; G304-M307 VanDerWaalsContact O-CG 3.22Å; G304-M307 WeakPolarHBondContact O-CG 3.5Å; G304-M307 PolarHBondContact O-N 2.86Å; T305-M307 PolarHBondContact O-N 3.32Å; M307-R337 HydrophobicContact SD-CG 3.48Å; M307-R337 WeakPolarHBondContact SD-CG 3.43Å; M307-K338 HydrophobicContact CE-CG 4.37Å; M307-K338 HydrophobicContact CG-CB 3.98Å; M307-K338 HydrophobicContact SD-CB 3.95Å; M307-K338 HydrophobicContact SD-CG 4.23Å
308	Y	98.6	Very high	98.5	Very high	13 Å²	13	29.2 Å²	29.2	5%	0.051	17%	0.173	C	C	.	.	S	Bend	trans	-56.3	132.1	177.9	-72	-58.7	0	0	0	112.1	L187 K215 C219 V221 P260 L263 T305 T306 G310 I311	L187-Y308 HydrophobicContact CD1-CE2 3.66Å; L187-Y308 WeakPolarHBondContact CD1-OH 3.44Å; K215-Y308 VanDerWaalsContact CD-OH 3.24Å; K215-Y308 WeakPolarHBondContact CD-OH 3.35Å; K215-Y308 HydrophobicContact CG-CE1 4.29Å; K215-Y308 WeakPolarHBondContact CG-OH 3.21Å; C219-Y308 HydrophobicContact CB-CD1 4.1Å; C219-Y308 HydrophobicContact CB-CE1 3.58Å; V221-Y308 HydrophobicContact CG2-CD2 4.41Å; V221-Y308 HydrophobicContact CG2-CG 4.36Å; P260-Y308 HydrophobicContact CB-CD1 4.41Å; P260-Y308 HydrophobicContact CB-CD2 3.8Å; P260-Y308 HydrophobicContact CB-CE1 4.33Å; P260-Y308 HydrophobicContact CB-CE2 3.66Å; P260-Y308 HydrophobicContact CB-CG 4.17Å; L263-Y308 HydrophobicContact CD1-CD2 4.33Å; L263-Y308 HydrophobicContact CD1-CE2 4.24Å; T305-Y308 HydrophobicContact CG2-CE2 4.15Å; T305-Y308 WeakPolarHBondContact O-CD2 3.39Å; T306-Y308 VanDerWaalsContact C-N 3.28Å; T306-Y308 PolarHBondContact O-N 3.37Å; Y308-G310 PolarHBondContact O-N 3.13Å; Y308-I311 WeakPolarHBondContact O-CG2 3.44Å; Y308-I311 PolarHBondContact O-N 3.44Å
309	P	98.7	Very high	98.5	Very high	84 Å²	84	27.7 Å²	27.7	55%	0.545	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.3	140.4	166.5	-22.8	33.5	0	0	0	110.6	V221 I311	V221-P309 PolarHBondContact N-O 2.91Å; P309-I311 VanDerWaalsContact C-N 3.3Å; P309-I311 PolarHBondContact O-N 3.18Å
310	G	98.6	Very high	98.5	Very high	28 Å²	28	31 Å²	31	29%	0.289	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.9	-10.7	178.3	0	0	0	0	0	116.1	Y308 A312 D313 R314	Y308-G310 PolarHBondContact O-N 3.13Å; G310-A312 VanDerWaalsContact C-N 3.32Å; G310-A312 PolarHBondContact O-N 3.2Å; G310-D313 PolarHBondContact O-N 3.15Å; G310-R314 PolarHBondContact O-N 3.08Å
311	I	98.8	Very high	98.5	Very high	3 Å²	3	34.9 Å²	34.9	2%	0.015	22%	0.218	C	C	.	.	H	α-helix	trans	-63.9	-37.4	-177	-164	174.7	0	0	0	112.6	V221 L263 F264 I276 L301 T306 Y308 P309 R314 M315	V221-I311 HydrophobicContact CB-CB 4.27Å; V221-I311 HydrophobicContact CG2-CB 3.92Å; V221-I311 HydrophobicContact CG2-CG1 4.09Å; L263-I311 HydrophobicContact CD1-CD1 4.43Å; F264-I311 HydrophobicContact CE2-CG1 4.37Å; F264-I311 HydrophobicContact CZ-CG1 4.14Å; I276-I311 HydrophobicContact CD1-CD1 4.09Å; I276-I311 HydrophobicContact CD1-CG1 4.45Å; L301-I311 HydrophobicContact CD1-CG2 3.98Å; T306-I311 VanDerWaalsContact O-CG2 3.29Å; T306-I311 WeakPolarHBondContact O-CG2 3.32Å; Y308-I311 WeakPolarHBondContact O-CG2 3.44Å; Y308-I311 PolarHBondContact O-N 3.44Å; P309-I311 VanDerWaalsContact C-N 3.3Å; P309-I311 PolarHBondContact O-N 3.18Å; I311-R314 PolarHBondContact O-N 2.99Å; I311-M315 HydrophobicContact CG1-CG 4.4Å; I311-M315 WeakPolarHBondContact O-CB 3.29Å; I311-M315 VanDerWaalsContact O-CG 3.26Å; I311-M315 WeakPolarHBondContact O-CG 3.43Å; I311-M315 PolarHBondContact O-N 3.45Å
312	A	98.7	Very high	98.4	Very high	25 Å²	25	37.9 Å²	37.9	21%	0.207	23%	0.233	C	C	.	.	H	α-helix	trans	-65.9	-42.4	178.8	0	0	0	0	0	111.5	L301 G310 M315 Q316 I331 A333	L301-A312 HydrophobicContact CD1-CB 4.13Å; G310-A312 VanDerWaalsContact C-N 3.32Å; G310-A312 PolarHBondContact O-N 3.2Å; A312-M315 PolarHBondContact O-N 3.14Å; A312-Q316 VanDerWaalsContact O-CB 3.3Å; A312-Q316 WeakPolarHBondContact O-CB 3.45Å; A312-Q316 PolarHBondContact O-N 2.84Å; A312-I331 HydrophobicContact CB-CG2 4.01Å; A312-A333 HydrophobicContact CB-CB 3.98Å
313	D	98.7	Very high	98.3	Very high	105 Å²	105	38.3 Å²	38.3	56%	0.561	24%	0.237	S	C	*	.	H	α-helix	trans	-67.8	-41.6	178.4	-57.6	-54.2	0	0	0	111.5	L223 G310 Q316 K317	L223-D313 HydrophobicContact CD1-CB 4.14Å; G310-D313 PolarHBondContact O-N 3.15Å; D313-Q316 WeakPolarHBondContact O-CB 3.31Å; D313-Q316 PolarHBondContact O-N 3.5Å; D313-K317 PolarHBondContact O-N 3.08Å
314	R	98.8	Very high	98.2	Very high	11 Å²	11	40.6 Å²	40.6	4%	0.042	25%	0.251	C	S	.	.	H	α-helix	trans	-63.1	-47.9	174.4	-175.2	64.9	176.1	-72	-9	111.2	V221 A222 L223 E261 F264 G310 I311 Q316 K317 E318	V221-R314 HydrophobicContact CG1-CB 3.49Å; V221-R314 VanDerWaalsContact CG1-CB 3.49Å; V221-R314 HydrophobicContact CG1-CG 3.7Å; A222-R314 WeakPolarHBondContact O-CD 3.42Å; A222-R314 PolarHBondContact O-NH1 2.89Å; L223-R314 WeakPolarHBondContact O-CD 3.38Å; E261-R314 IonicContact OE1-CZ 2.87Å; E261-R314 IonicContact OE1-NH1 2.96Å; E261-R314 PolarHBondContact OE1-NH1 2.91Å; E261-R314 IonicContact OE1-NH2 2.78Å; E261-R314 PolarHBondContact OE1-NH2 3.31Å; E261-R314 IonicContact OE2-CZ 3.13Å; E261-R314 IonicContact OE2-NH1 2.76Å; E261-R314 PolarHBondContact OE2-NH1 3.31Å; E261-R314 IonicContact OE2-NH2 3.89Å; F264-R314 HydrophobicContact CD1-CG 3.9Å; F264-R314 HydrophobicContact CE1-CB 4.19Å; F264-R314 HydrophobicContact CE1-CG 3.38Å; F264-R314 HydrophobicContact CE2-CG 4.04Å; F264-R314 HydrophobicContact CG-CG 4.46Å; F264-R314 HydrophobicContact CZ-CB 3.91Å; F264-R314 HydrophobicContact CZ-CG 3.45Å; F264-R314 VanDerWaalsContact CZ-CG 3.45Å; G310-R314 PolarHBondContact O-N 3.08Å; I311-R314 PolarHBondContact O-N 2.99Å; R314-Q316 VanDerWaalsContact C-N 3.29Å; R314-Q316 PolarHBondContact O-N 3.23Å; R314-K317 PolarHBondContact O-N 3.39Å; R314-E318 HydrophobicContact CG-CG 4.25Å; R314-E318 IonicContact CZ-OE1 2.75Å; R314-E318 IonicContact NE-OE1 2.88Å; R314-E318 PolarHBondContact NE-OE1 3.01Å; R314-E318 IonicContact NH2-OE1 3.67Å; R314-E318 PolarHBondContact NH2-OE1 2.81Å; R314-E318 VanDerWaalsContact O-CG 3.29Å; R314-E318 WeakPolarHBondContact O-CG 3.26Å; R314-E318 PolarHBondContact O-N 3.19Å
315	M	98.7	Very high	98	Very high	1 Å²	1	44.7 Å²	44.7	1%	0.005	27%	0.272	C	S	.	.	H	α-helix	trans	-58.1	-41.1	174.3	-76.2	-64	-72.8	0	0	112.1	L155 F264 I276 H277 T280 I311 A312 I319 I331	L155-M315 HydrophobicContact CD2-CE 3.72Å; L155-M315 HydrophobicContact CD2-SD 4.25Å; F264-M315 HydrophobicContact CE1-CG 4.34Å; F264-M315 HydrophobicContact CE1-SD 3.85Å; F264-M315 HydrophobicContact CZ-CG 4.25Å; F264-M315 HydrophobicContact CZ-SD 4.18Å; I276-M315 HydrophobicContact CD1-SD 3.84Å; I276-M315 HydrophobicContact CG1-SD 3.86Å; H277-M315 HydrophobicContact CB-SD 3.86Å; T280-M315 WeakPolarHBondContact OG1-CE 3.45Å; I311-M315 HydrophobicContact CG1-CG 4.4Å; I311-M315 WeakPolarHBondContact O-CB 3.29Å; I311-M315 VanDerWaalsContact O-CG 3.26Å; I311-M315 WeakPolarHBondContact O-CG 3.43Å; I311-M315 PolarHBondContact O-N 3.45Å; A312-M315 PolarHBondContact O-N 3.14Å; M315-I319 HydrophobicContact CE-CD1 3.51Å; M315-I319 HydrophobicContact CE-CG1 4.38Å; M315-I319 WeakPolarHBondContact O-CB 3.42Å; M315-I319 WeakPolarHBondContact O-CG1 3.49Å; M315-I319 PolarHBondContact O-N 3.45Å; M315-I331 HydrophobicContact CB-CD1 4.12Å; M315-I331 HydrophobicContact CB-CG1 4.13Å
316	Q	98.6	Very high	97.8	Very high	62 Å²	62	50 Å²	50	29%	0.29	31%	0.305	S	S	.	.	H	α-helix	trans	-61.7	-47.4	176.9	-177.3	69.3	62	0	0	111.1	A312 D313 R314 T320 I329 I331	A312-Q316 VanDerWaalsContact O-CB 3.3Å; A312-Q316 WeakPolarHBondContact O-CB 3.45Å; A312-Q316 PolarHBondContact O-N 2.84Å; D313-Q316 WeakPolarHBondContact O-CB 3.31Å; D313-Q316 PolarHBondContact O-N 3.5Å; R314-Q316 VanDerWaalsContact C-N 3.29Å; R314-Q316 PolarHBondContact O-N 3.23Å; Q316-T320 PolarHBondContact NE2-OG1 2.9Å; Q316-T320 WeakPolarHBondContact O-CB 3.29Å; Q316-T320 PolarHBondContact O-N 2.88Å; Q316-T320 VanDerWaalsContact O-N 3.13Å; Q316-T320 PolarHBondContact O-OG1 3.38Å; Q316-I329 PolarHBondContact NE2-O 2.87Å; Q316-I329 PolarHBondContact OE1-O 3.2Å; Q316-I331 HydrophobicContact CB-CG1 3.75Å
317	K	98.6	Very high	97.7	Very high	79 Å²	79	52.3 Å²	52.3	34%	0.343	32%	0.316	S	S	.	.	H	α-helix	trans	-59	-54.2	176.6	174.9	-177.2	168	-175.7	0	111.1	L223 D224 D313 R314 T320 A321	L223-K317 HydrophobicContact CD1-CB 4.09Å; L223-K317 HydrophobicContact CD1-CD 3.89Å; L223-K317 HydrophobicContact CG-CD 4.15Å; L223-K317 WeakPolarHBondContact O-CD 3.34Å; L223-K317 PolarHBondContact O-NZ 3.48Å; D224-K317 IonicContact OD2-NZ 3.32Å; D224-K317 PolarHBondContact OD2-NZ 2.9Å; D224-K317 VanDerWaalsContact OD2-NZ 3.13Å; D313-K317 PolarHBondContact O-N 3.08Å; R314-K317 PolarHBondContact O-N 3.39Å; K317-T320 PolarHBondContact O-N 3.05Å; K317-A321 PolarHBondContact O-N 3.24Å; K317-A321 VanDerWaalsContact O-N 3.09Å
318	E	98.5	Very high	97.5	Very high	37 Å²	37	57.2 Å²	57.2	17%	0.173	34%	0.336	C	S	.	.	H	α-helix	trans	-68.4	-44.7	-172	-62.5	-61.4	176.7	0	0	112.4	F264 H277 R314 T320 A321 L322	F264-E318 HydrophobicContact CD1-CG 4.36Å; F264-E318 HydrophobicContact CE1-CG 4.44Å; H277-E318 HydrophobicContact CB-CB 3.62Å; H277-E318 HydrophobicContact CB-CG 4.27Å; R314-E318 HydrophobicContact CG-CG 4.25Å; R314-E318 IonicContact CZ-OE1 2.75Å; R314-E318 IonicContact NE-OE1 2.88Å; R314-E318 PolarHBondContact NE-OE1 3.01Å; R314-E318 IonicContact NH2-OE1 3.67Å; R314-E318 PolarHBondContact NH2-OE1 2.81Å; R314-E318 VanDerWaalsContact O-CG 3.29Å; R314-E318 WeakPolarHBondContact O-CG 3.26Å; R314-E318 PolarHBondContact O-N 3.19Å; E318-T320 VanDerWaalsContact C-N 3.31Å; E318-T320 PolarHBondContact O-N 2.93Å; E318-A321 PolarHBondContact O-N 3.14Å; E318-L322 WeakPolarHBondContact O-CG 3.5Å; E318-L322 PolarHBondContact O-N 3.44Å; E318-L322 VanDerWaalsContact O-N 3.1Å
319	I	98.3	Very high	97.5	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-66.6	-35.5	177.8	-66	167.4	0	0	0	110.9	T280 Y296 M315 A321 L322 A323 I329 I331	T280-I319 HydrophobicContact CG2-CD1 3.88Å; Y296-I319 HydrophobicContact CD1-CG2 4.03Å; Y296-I319 HydrophobicContact CE1-CG2 3.99Å; M315-I319 HydrophobicContact CE-CD1 3.51Å; M315-I319 HydrophobicContact CE-CG1 4.38Å; M315-I319 WeakPolarHBondContact O-CB 3.42Å; M315-I319 WeakPolarHBondContact O-CG1 3.49Å; M315-I319 PolarHBondContact O-N 3.45Å; I319-A321 VanDerWaalsContact C-N 3.28Å; I319-A321 PolarHBondContact O-N 3.22Å; I319-L322 PolarHBondContact O-N 2.85Å; I319-A323 WeakPolarHBondContact O-CB 3.41Å; I319-A323 PolarHBondContact O-N 3.46Å; I319-I329 HydrophobicContact CB-CG2 3.99Å; I319-I329 HydrophobicContact CG2-CD1 4.06Å; I319-I329 HydrophobicContact CG2-CG1 4.11Å; I319-I329 HydrophobicContact CG2-CG2 3.6Å; I319-I331 HydrophobicContact CD1-CD1 3.89Å
320	T	98.1	Very high	97.5	Very high	74 Å²	74	58 Å²	58	45%	0.454	33%	0.331	S	S	.	.	H	α-helix	trans	-64.5	-34.3	175.7	-57.4	0	0	0	0	111.9	Q316 K317 E318	Q316-T320 PolarHBondContact NE2-OG1 2.9Å; Q316-T320 WeakPolarHBondContact O-CB 3.29Å; Q316-T320 PolarHBondContact O-N 2.88Å; Q316-T320 VanDerWaalsContact O-N 3.13Å; Q316-T320 PolarHBondContact O-OG1 3.38Å; K317-T320 PolarHBondContact O-N 3.05Å; E318-T320 VanDerWaalsContact C-N 3.31Å; E318-T320 PolarHBondContact O-N 2.93Å
321	A	98	Very high	97.5	Very high	82 Å²	82	57.7 Å²	57.7	68%	0.678	32%	0.323	S	S	*	.	H	α-helix	trans	-72.1	-33.8	176.5	0	0	0	0	0	112.9	K317 E318 I319	K317-A321 PolarHBondContact O-N 3.24Å; K317-A321 VanDerWaalsContact O-N 3.09Å; E318-A321 PolarHBondContact O-N 3.14Å; I319-A321 VanDerWaalsContact C-N 3.28Å; I319-A321 PolarHBondContact O-N 3.22Å
322	L	97.9	Very high	97.5	Very high	64 Å²	64	58.5 Å²	58.5	34%	0.335	33%	0.327	S	S	.	.	H	α-helix	trans	-83.3	-36.1	-179.9	-66.5	174.8	0	0	0	113.3	E278 Y281 E318 I319	E278-L322 HydrophobicContact CG-CD1 4.06Å; Y281-L322 HydrophobicContact CD2-CB 3.7Å; Y281-L322 HydrophobicContact CE2-CB 4.13Å; Y281-L322 VanDerWaalsContact CE2-O 3.23Å; Y281-L322 WeakPolarHBondContact CE2-O 3.36Å; Y281-L322 HydrophobicContact CG-CB 3.96Å; Y281-L322 HydrophobicContact CG-CD1 4.19Å; E318-L322 WeakPolarHBondContact O-CG 3.5Å; E318-L322 PolarHBondContact O-N 3.44Å; E318-L322 VanDerWaalsContact O-N 3.1Å; I319-L322 PolarHBondContact O-N 2.85Å
323	A	96.7	Very high	97.5	Very high	11 Å²	11	59 Å²	59	9%	0.091	33%	0.332	C	S	.	.	S	Bend	trans	-74.1	154.4	-174.8	0	0	0	0	0	112.6	Y296 I319 S325 M327 I329	Y296-A323 HydrophobicContact CD1-CB 4.21Å; Y296-A323 HydrophobicContact CE1-CB 3.66Å; Y296-A323 HydrophobicContact CE2-CB 4.3Å; I319-A323 WeakPolarHBondContact O-CB 3.41Å; I319-A323 PolarHBondContact O-N 3.46Å; A323-S325 PolarHBondContact O-N 2.94Å; A323-M327 HydrophobicContact CB-CB 4.48Å; A323-I329 HydrophobicContact CB-CD1 3.65Å; A323-I329 HydrophobicContact CB-CG1 4.22Å
324	P	94.9	Very high	97.4	Very high	55 Å²	55	54.9 Å²	54.9	36%	0.357	31%	0.31	S	S	.	.			trans	-55.9	138.7	171.8	-22.3	32.3	0	0	0	111.4	T326 M327	P324-T326 PolarHBondContact O-N 2.9Å; P324-M327 HydrophobicContact CB-CG 4.16Å; P324-M327 HydrophobicContact CG-CG 4.26Å; P324-M327 WeakPolarHBondContact O-CB 3.47Å; P324-M327 PolarHBondContact O-N 2.94Å
325	S	94.1	Very high	97.3	Very high	128 Å²	128	59.1 Å²	59.1	90%	0.895	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-16.1	-174.8	61.7	0	0	0	0	114.9	A323 M327	A323-S325 PolarHBondContact O-N 2.94Å; S325-M327 VanDerWaalsContact C-N 3.33Å
326	T	93.8	Very high	97.2	Very high	122 Å²	122	63.2 Å²	63.2	75%	0.748	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-14.4	174.5	55.8	0	0	0	0	113.3	P324	P324-T326 PolarHBondContact O-N 2.9Å
327	M	95.4	Very high	97.1	Very high	49 Å²	49	61.6 Å²	61.6	24%	0.241	35%	0.35	C	S	.	.	S	Bend	trans	-85.5	133.5	-178.1	-62.6	-60.7	179.1	0	0	110.6	K293 Y296 A323 P324 S325 I329	K293-M327 HydrophobicContact CB-SD 4.21Å; Y296-M327 HydrophobicContact CD2-CB 3.9Å; Y296-M327 HydrophobicContact CD2-CG 3.67Å; Y296-M327 HydrophobicContact CD2-SD 4.05Å; Y296-M327 HydrophobicContact CE2-CB 4.42Å; Y296-M327 HydrophobicContact CE2-CG 3.93Å; Y296-M327 HydrophobicContact CG-CB 4.3Å; A323-M327 HydrophobicContact CB-CB 4.48Å; P324-M327 HydrophobicContact CB-CG 4.16Å; P324-M327 HydrophobicContact CG-CG 4.26Å; P324-M327 WeakPolarHBondContact O-CB 3.47Å; P324-M327 PolarHBondContact O-N 2.94Å; S325-M327 VanDerWaalsContact C-N 3.33Å; M327-I329 HydrophobicContact CB-CD1 4.06Å
328	K	96.1	Very high	97.1	Very high	169 Å²	169	61.9 Å²	61.9	74%	0.735	35%	0.351	S	S	*	.			trans	-89.4	114.2	171.2	-176.7	177.3	-179.5	177.1	0	109	Y296	Y296-K328 CarbonylContact C-O 3.55Å
329	I	98.2	Very high	97	Very high	15 Å²	15	62.9 Å²	62.9	8%	0.077	35%	0.354	C	S	.	.			trans	-90.1	131.5	178.3	-49.4	-46.3	0	0	0	109.3	Y296 Q316 I319 A323 M327 I331	Y296-I329 HydrophobicContact CD1-CD1 3.34Å; Y296-I329 HydrophobicContact CD2-CD1 4.44Å; Y296-I329 HydrophobicContact CE1-CD1 4.09Å; Y296-I329 HydrophobicContact CG-CD1 3.56Å; Y296-I329 WeakPolarHBondContact O-CA 3.43Å; Q316-I329 PolarHBondContact NE2-O 2.87Å; Q316-I329 PolarHBondContact OE1-O 3.2Å; I319-I329 HydrophobicContact CB-CG2 3.99Å; I319-I329 HydrophobicContact CG2-CD1 4.06Å; I319-I329 HydrophobicContact CG2-CG1 4.11Å; I319-I329 HydrophobicContact CG2-CG2 3.6Å; A323-I329 HydrophobicContact CB-CD1 3.65Å; A323-I329 HydrophobicContact CB-CG1 4.22Å; M327-I329 HydrophobicContact CB-CD1 4.06Å; I329-I331 HydrophobicContact CG2-CD1 4.25Å
330	K	98.4	Very high	97	Very high	97 Å²	97	63 Å²	63	42%	0.422	35%	0.354	S	S	.	.			trans	-136.6	119.3	172.4	179.6	-175.7	180	-176.9	0	110.2	Y296 A297 N299 I332	Y296-K330 PolarHBondContact O-N 2.94Å; A297-K330 WeakPolarHBondContact O-CB 3.32Å; N299-K330 PolarHBondContact N-O 3.1Å; N299-K330 VanDerWaalsContact N-O 3.11Å; K330-I332 HydrophobicContact CD-CG1 4.35Å; K330-I332 HydrophobicContact CG-CG1 4.25Å
331	I	98.7	Very high	97	Very high	23 Å²	23	59.9 Å²	59.9	12%	0.118	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	132.7	169.3	-49.5	-51.4	0	0	0	109.6	N299 L301 A312 M315 Q316 I319 I329	N299-I331 HydrophobicContact CB-CD1 3.62Å; N299-I331 CarbonylContact O-C 3.59Å; L301-I331 HydrophobicContact CD1-CG2 3.85Å; L301-I331 HydrophobicContact CD2-CG2 4.18Å; L301-I331 HydrophobicContact CG-CG2 3.8Å; A312-I331 HydrophobicContact CB-CG2 4.01Å; M315-I331 HydrophobicContact CB-CD1 4.12Å; M315-I331 HydrophobicContact CB-CG1 4.13Å; Q316-I331 HydrophobicContact CB-CG1 3.75Å; I319-I331 HydrophobicContact CD1-CD1 3.89Å; I329-I331 HydrophobicContact CG2-CD1 4.25Å
332	I	98.6	Very high	97.1	Very high	20 Å²	20	56 Å²	56	10%	0.103	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	111	179.8	-60.1	155.4	0	0	0	106.6	R149 N298 N299 V300 L301 K330 P334	R149-I332 VanDerWaalsContact CZ-CD1 3.49Å; R149-I332 VanDerWaalsContact NE-CD1 3.3Å; N298-I332 HydrophobicContact CB-CD1 4.32Å; N299-I332 PolarHBondContact O-N 2.8Å; V300-I332 WeakPolarHBondContact CA-O 3.16Å; V300-I332 HydrophobicContact CG2-CB 4.14Å; V300-I332 HydrophobicContact CG2-CD1 3.92Å; V300-I332 HydrophobicContact CG2-CG2 4.37Å; L301-I332 PolarHBondContact N-O 3.28Å; K330-I332 HydrophobicContact CD-CG1 4.35Å; K330-I332 HydrophobicContact CG-CG1 4.25Å; I332-P334 HydrophobicContact CG2-CG 4.35Å; I332-P334 WeakPolarHBondContact O-CD 3.38Å
333	A	98.2	Very high	97.1	Very high	36 Å²	36	54.2 Å²	54.2	30%	0.298	29%	0.293	S	S	.	.			trans	-123.4	84	-179	0	0	0	0	0	109.6	L301 A312	L301-A333 HydrophobicContact CB-CB 4.37Å; L301-A333 HydrophobicContact CD1-CB 3.98Å; L301-A333 HydrophobicContact CG-CB 4.34Å; A312-A333 HydrophobicContact CB-CB 3.98Å
334	P	97.3	Very high	97.1	Very high	17 Å²	17	53.7 Å²	53.7	11%	0.11	29%	0.289	C	S	.	.			trans	-55.5	141.1	176.7	-22.9	33.8	0	0	0	111	I332 E336 R337	I332-P334 HydrophobicContact CG2-CG 4.35Å; I332-P334 WeakPolarHBondContact O-CD 3.38Å; P334-E336 WeakPolarHBondContact CB-OE1 3.3Å; P334-E336 PolarHBondContact O-N 2.93Å; P334-R337 HydrophobicContact CB-CB 4.26Å; P334-R337 WeakPolarHBondContact O-CB 3.48Å; P334-R337 WeakPolarHBondContact O-CD 3.33Å; P334-R337 WeakPolarHBondContact O-CG 3.38Å; P334-R337 PolarHBondContact O-N 3.04Å; P334-R337 VanDerWaalsContact O-N 3.14Å; P334-R337 PolarHBondContact O-NH1 3.47Å
335	P	96.9	Very high	97.3	Very high	101 Å²	101	51 Å²	51	66%	0.656	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-36.5	178.3	-26	34.5	0	0	0	113.4	R337	P335-R337 VanDerWaalsContact C-N 3.32Å; P335-R337 PolarHBondContact O-N 3.02Å
336	E	95.8	Very high	97.5	Very high	87 Å²	87	45.1 Å²	45.1	41%	0.407	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	12.6	-179.5	65.3	-71.7	162.4	0	0	113.7	P334 K338 Y339 I343	P334-E336 WeakPolarHBondContact CB-OE1 3.3Å; P334-E336 PolarHBondContact O-N 2.93Å; E336-K338 PolarHBondContact O-N 3.44Å; E336-Y339 WeakPolarHBondContact O-CA 3.22Å; E336-Y339 PolarHBondContact O-N 2.91Å; E336-I343 HydrophobicContact CB-CD1 4.27Å; E336-I343 HydrophobicContact CG-CD1 3.66Å
337	R	97.5	Very high	97.6	Very high	27 Å²	27	42.6 Å²	42.6	10%	0.102	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-58	-18.4	-171.9	67.4	-170.9	173	-76.7	1.8	116.8	L301 G303 T306 M307 P334 P335 Y339 S340	L301-R337 WeakPolarHBondContact O-CB 3.31Å; G303-R337 PolarHBondContact N-O 2.94Å; G303-R337 VanDerWaalsContact N-O 3.11Å; T306-R337 VanDerWaalsContact O-CZ 3.27Å; T306-R337 PolarHBondContact O-NE 2.88Å; T306-R337 PolarHBondContact O-NH2 3.11Å; T306-R337 WeakPolarHBondContact OG1-CD 3.29Å; T306-R337 PolarHBondContact OG1-NE 2.83Å; M307-R337 HydrophobicContact SD-CG 3.48Å; M307-R337 WeakPolarHBondContact SD-CG 3.43Å; P334-R337 HydrophobicContact CB-CB 4.26Å; P334-R337 WeakPolarHBondContact O-CB 3.48Å; P334-R337 WeakPolarHBondContact O-CD 3.33Å; P334-R337 WeakPolarHBondContact O-CG 3.38Å; P334-R337 PolarHBondContact O-N 3.04Å; P334-R337 VanDerWaalsContact O-N 3.14Å; P334-R337 PolarHBondContact O-NH1 3.47Å; P335-R337 VanDerWaalsContact C-N 3.32Å; P335-R337 PolarHBondContact O-N 3.02Å; R337-Y339 PolarHBondContact O-N 3.25Å; R337-S340 WeakPolarHBondContact CA-OG 3.36Å; R337-S340 PolarHBondContact O-N 2.92Å
338	K	96.9	Very high	97.6	Very high	86 Å²	86	41.3 Å²	41.3	37%	0.374	21%	0.206	S	C	.	.	G	3₁₀ helix	trans	-61	-18.9	167.5	57.8	167.3	170.6	164.3	0	113.7	K20 M307 E336	K20-K338 VanDerWaalsContact CE-O 3.23Å; K20-K338 WeakPolarHBondContact CE-O 3.49Å; M307-K338 HydrophobicContact CE-CG 4.37Å; M307-K338 HydrophobicContact CG-CB 3.98Å; M307-K338 HydrophobicContact SD-CB 3.95Å; M307-K338 HydrophobicContact SD-CG 4.23Å; E336-K338 PolarHBondContact O-N 3.44Å
339	Y	97.8	Very high	97.6	Very high	58 Å²	58	33.4 Å²	33.4	23%	0.227	17%	0.172	C	C	.	.	G	3₁₀ helix	trans	-116.2	2.4	179.9	-53.2	-44.8	0	0	0	113	K20 P29 V32 E336 R337 V341 W342 I343	K20-Y339 HydrophobicContact CD-CD1 3.77Å; K20-Y339 HydrophobicContact CD-CE1 4.34Å; P29-Y339 HydrophobicContact CG-CD1 4.16Å; P29-Y339 HydrophobicContact CG-CE1 4.45Å; P29-Y339 HydrophobicContact CG-CG 4.4Å; V32-Y339 HydrophobicContact CG2-CE1 4.03Å; E336-Y339 WeakPolarHBondContact O-CA 3.22Å; E336-Y339 PolarHBondContact O-N 2.91Å; R337-Y339 PolarHBondContact O-N 3.25Å; Y339-V341 VanDerWaalsContact C-N 3.26Å; Y339-V341 PolarHBondContact O-N 3.18Å; Y339-W342 PolarHBondContact O-N 3.37Å; Y339-I343 WeakPolarHBondContact O-CG1 3.23Å; Y339-I343 PolarHBondContact O-N 3.11Å
340	S	98.3	Very high	97.4	Very high	2 Å²	2	35.8 Å²	35.8	1%	0.014	19%	0.19	C	C	.	.	H	α-helix	trans	-54.6	-39	-174.8	-81.8	0	0	0	0	113.7	A146 R337 I343 G344	A146-S340 VanDerWaalsContact CB-O 3.26Å; A146-S340 WeakPolarHBondContact CB-O 3.35Å; R337-S340 WeakPolarHBondContact CA-OG 3.36Å; R337-S340 PolarHBondContact O-N 2.92Å; S340-I343 PolarHBondContact O-N 3.05Å; S340-G344 PolarHBondContact O-N 3.02Å
341	V	98.4	Very high	97.2	Very high	8 Å²	8	34.8 Å²	34.8	5%	0.048	19%	0.189	C	C	.	.	H	α-helix	trans	-56.4	-52.8	175	174.7	0	0	0	0	111.1	D13 T108 Q139 L142 S143 Y339 G344 G345	D13-V341 HydrophobicContact CB-CG1 4.06Å; D13-V341 VanDerWaalsContact CG-CG1 3.45Å; D13-V341 WeakPolarHBondContact OD1-CG1 3.39Å; T108-V341 HydrophobicContact CG2-CG1 3.8Å; Q139-V341 HydrophobicContact CB-CG1 3.92Å; Q139-V341 HydrophobicContact CB-CG2 3.88Å; Q139-V341 HydrophobicContact CG-CG1 3.73Å; Q139-V341 HydrophobicContact CG-CG2 4.38Å; L142-V341 WeakPolarHBondContact CB-O 3.33Å; L142-V341 HydrophobicContact CD1-CG1 4.37Å; S143-V341 WeakPolarHBondContact OG-CG2 3.21Å; Y339-V341 VanDerWaalsContact C-N 3.26Å; Y339-V341 PolarHBondContact O-N 3.18Å; V341-G344 PolarHBondContact O-N 3.41Å; V341-G345 PolarHBondContact O-N 2.73Å
342	W	98.6	Very high	96.8	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-66.9	-43.1	-178	-174.7	92	0	0	0	111.3	V11 D13 K20 F23 D26 A28 P29 Y339 G344 G345 S346	V11-W342 HydrophobicContact CB-CZ2 4.42Å; V11-W342 HydrophobicContact CG1-CG 4.25Å; V11-W342 PolarHBondContact O-NE1 3.45Å; D13-W342 HydrophobicContact CB-CB 4.17Å; K20-W342 HydrophobicContact CB-CB 4.41Å; K20-W342 HydrophobicContact CB-CG 4.31Å; K20-W342 HydrophobicContact CD-CB 4.4Å; F23-W342 WeakPolarHBondContact O-CH2 3.16Å; D26-W342 HydrophobicContact CB-CH2 3.89Å; D26-W342 WeakPolarHBondContact O-CH2 3.37Å; D26-W342 WeakPolarHBondContact O-CZ3 3.29Å; A28-W342 WeakPolarHBondContact O-CH2 3.48Å; A28-W342 WeakPolarHBondContact O-CZ3 3.42Å; P29-W342 HydrophobicContact CB-CD2 3.69Å; P29-W342 HydrophobicContact CB-CE3 4.16Å; P29-W342 HydrophobicContact CB-CG 3.93Å; P29-W342 HydrophobicContact CB-CZ2 4.47Å; P29-W342 HydrophobicContact CG-CD2 4.27Å; P29-W342 HydrophobicContact CG-CE3 4.39Å; P29-W342 HydrophobicContact CG-CG 4.44Å; Y339-W342 PolarHBondContact O-N 3.37Å; W342-G344 VanDerWaalsContact C-N 3.3Å; W342-G344 PolarHBondContact O-N 2.9Å; W342-G345 PolarHBondContact O-N 3.26Å; W342-G345 VanDerWaalsContact O-N 3.13Å; W342-S346 PolarHBondContact O-N 3.45Å
343	I	98.3	Very high	96.3	Very high	27 Å²	27	43 Å²	43	14%	0.138	25%	0.246	C	C	.	.	H	α-helix	trans	-59.6	-43.3	176.5	-66.5	168	0	0	0	110.4	A146 E336 Y339 S340 G345 S346 I347	A146-I343 HydrophobicContact CB-CB 4.12Å; A146-I343 HydrophobicContact CB-CG2 3.9Å; E336-I343 HydrophobicContact CB-CD1 4.27Å; E336-I343 HydrophobicContact CG-CD1 3.66Å; Y339-I343 WeakPolarHBondContact O-CG1 3.23Å; Y339-I343 PolarHBondContact O-N 3.11Å; S340-I343 PolarHBondContact O-N 3.05Å; I343-G345 VanDerWaalsContact C-N 3.33Å; I343-G345 PolarHBondContact O-N 3.4Å; I343-S346 WeakPolarHBondContact O-CB 3.47Å; I343-S346 PolarHBondContact O-N 2.59Å; I343-I347 HydrophobicContact CG2-CD1 3.96Å; I343-I347 WeakPolarHBondContact O-CG1 3.29Å; I343-I347 PolarHBondContact O-N 2.71Å
344	G	98	Very high	96	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-63.2	-38.3	176.2	0	0	0	0	0	113.3	L142 S340 V341 W342 L348	L142-G344 VanDerWaalsContact O-CA 3.23Å; L142-G344 WeakPolarHBondContact O-CA 3.39Å; S340-G344 PolarHBondContact O-N 3.02Å; V341-G344 PolarHBondContact O-N 3.41Å; W342-G344 VanDerWaalsContact C-N 3.3Å; W342-G344 PolarHBondContact O-N 2.9Å; G344-L348 VanDerWaalsContact O-CB 3.31Å; G344-L348 WeakPolarHBondContact O-CB 3.36Å; G344-L348 PolarHBondContact O-N 3.08Å
345	G	98	Very high	95.5	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-64.7	-42.3	171.9	0	0	0	0	0	112.5	V341 W342 I343 L348 A349	V341-G345 PolarHBondContact O-N 2.73Å; W342-G345 PolarHBondContact O-N 3.26Å; W342-G345 VanDerWaalsContact O-N 3.13Å; I343-G345 VanDerWaalsContact C-N 3.33Å; I343-G345 PolarHBondContact O-N 3.4Å; G345-L348 PolarHBondContact O-N 2.74Å; G345-A349 VanDerWaalsContact O-CB 3.26Å; G345-A349 WeakPolarHBondContact O-CB 3.46Å; G345-A349 PolarHBondContact O-N 3.28Å
346	S	98	Very high	95.1	Very high	4 Å²	4	47.6 Å²	47.6	3%	0.028	25%	0.25	C	S	.	.	H	α-helix	trans	-60.4	-47.2	176.2	-179.9	0	0	0	0	111.1	G25 D26 W342 I343 S350	G25-S346 PolarHBondContact N-OG 3.24Å; D26-S346 PolarHBondContact N-OG 3.38Å; D26-S346 PolarHBondContact O-OG 3.13Å; W342-S346 PolarHBondContact O-N 3.45Å; I343-S346 WeakPolarHBondContact O-CB 3.47Å; I343-S346 PolarHBondContact O-N 2.59Å; S346-S350 VanDerWaalsContact O-CB 3.29Å; S346-S350 WeakPolarHBondContact O-CB 3.38Å; S346-S350 PolarHBondContact O-N 2.82Å; S346-S350 VanDerWaalsContact O-N 3.14Å; S346-S350 PolarHBondContact O-OG 3.37Å
347	I	96.2	Very high	95.1	Very high	68 Å²	68	47.2 Å²	47.2	35%	0.349	25%	0.25	S	C	.	.	H	α-helix	trans	-60.1	-55.5	174.6	-67.3	165	0	0	0	110	I343 A349 S350 L351	I343-I347 HydrophobicContact CG2-CD1 3.96Å; I343-I347 WeakPolarHBondContact O-CG1 3.29Å; I343-I347 PolarHBondContact O-N 2.71Å; I347-A349 PolarHBondContact O-N 3.1Å; I347-S350 PolarHBondContact O-N 3.32Å; I347-S350 VanDerWaalsContact O-N 3.1Å; I347-S350 PolarHBondContact O-OG 3.25Å; I347-L351 WeakPolarHBondContact O-CG 3.25Å; I347-L351 PolarHBondContact O-N 2.86Å
348	L	95.9	Very high	95	Very high	22 Å²	22	46.7 Å²	46.7	12%	0.115	25%	0.248	C	C	.	.	H	α-helix	trans	-57	-48.6	-176.1	-178.4	63.6	0	0	0	112.5	L106 L142 Y145 G344 G345 S350 L351 F354	L106-L348 HydrophobicContact CD1-CD2 4.16Å; L142-L348 HydrophobicContact CD2-CB 4.29Å; L142-L348 HydrophobicContact CD2-CD2 3.63Å; Y145-L348 HydrophobicContact CD2-CB 4.41Å; Y145-L348 HydrophobicContact CD2-CD1 4.34Å; Y145-L348 HydrophobicContact CD2-CD2 4.46Å; Y145-L348 HydrophobicContact CE2-CD1 4.01Å; Y145-L348 HydrophobicContact CE2-CD2 4.19Å; G344-L348 VanDerWaalsContact O-CB 3.31Å; G344-L348 WeakPolarHBondContact O-CB 3.36Å; G344-L348 PolarHBondContact O-N 3.08Å; G345-L348 PolarHBondContact O-N 2.74Å; L348-S350 PolarHBondContact O-N 3.04Å; L348-L351 HydrophobicContact CD1-CD1 4.44Å; L348-L351 PolarHBondContact O-N 3.32Å; L348-F354 HydrophobicContact CD1-CD2 3.57Å; L348-F354 HydrophobicContact CD1-CE2 3.94Å; L348-F354 HydrophobicContact CD1-CG 4.18Å; L348-F354 HydrophobicContact CD2-CD2 4.23Å; L348-F354 HydrophobicContact CD2-CE2 3.73Å; L348-F354 HydrophobicContact CD2-CZ 4.11Å; L348-F354 HydrophobicContact CG-CD2 3.67Å; L348-F354 HydrophobicContact CG-CE2 3.65Å; L348-F354 HydrophobicContact CG-CG 4.13Å; L348-F354 HydrophobicContact CG-CZ 4.09Å; L348-F354 VanDerWaalsContact O-CB 3.24Å; L348-F354 WeakPolarHBondContact O-CB 3.18Å; L348-F354 WeakPolarHBondContact O-CG 3.47Å
349	A	96.4	Very high	95.1	Very high	3 Å²	3	42.6 Å²	42.6	3%	0.025	23%	0.23	C	C	.	.	H	α-helix	trans	-69.5	-19	-178.8	0	0	0	0	0	113.2	A9 V11 A24 L106 G345 I347 W358	A9-A349 HydrophobicContact CB-CB 4.18Å; V11-A349 HydrophobicContact CG2-CB 4.3Å; A24-A349 HydrophobicContact CB-CB 3.63Å; L106-A349 HydrophobicContact CD1-CB 4.26Å; G345-A349 VanDerWaalsContact O-CB 3.26Å; G345-A349 WeakPolarHBondContact O-CB 3.46Å; G345-A349 PolarHBondContact O-N 3.28Å; I347-A349 PolarHBondContact O-N 3.1Å; A349-W358 HydrophobicContact CB-CH2 4.31Å; A349-W358 HydrophobicContact CB-CZ2 4.08Å
350	S	94	Very high	95.1	Very high	66 Å²	66	41.7 Å²	41.7	46%	0.462	23%	0.232	S	C	.	.	H	α-helix	trans	-85.4	-11.8	176	73.5	0	0	0	0	113.9	S346 I347 L348	S346-S350 VanDerWaalsContact O-CB 3.29Å; S346-S350 WeakPolarHBondContact O-CB 3.38Å; S346-S350 PolarHBondContact O-N 2.82Å; S346-S350 VanDerWaalsContact O-N 3.14Å; S346-S350 PolarHBondContact O-OG 3.37Å; I347-S350 PolarHBondContact O-N 3.32Å; I347-S350 VanDerWaalsContact O-N 3.1Å; I347-S350 PolarHBondContact O-OG 3.25Å; L348-S350 PolarHBondContact O-N 3.04Å
351	L	92.7	Very high	95	Very high	76 Å²	76	44.4 Å²	44.4	40%	0.398	24%	0.244	S	C	.	.			trans	-74.6	126.4	179.6	-63.5	177.4	0	0	0	111.1	I347 L348 T353 F354	I347-L351 WeakPolarHBondContact O-CG 3.25Å; I347-L351 PolarHBondContact O-N 2.86Å; L348-L351 HydrophobicContact CD1-CD1 4.44Å; L348-L351 PolarHBondContact O-N 3.32Å; L351-T353 PolarHBondContact O-N 2.9Å; L351-F354 HydrophobicContact CB-CB 4.09Å; L351-F354 VanDerWaalsContact O-CB 3.25Å; L351-F354 WeakPolarHBondContact O-CB 3.27Å; L351-F354 PolarHBondContact O-N 2.8Å
352	S	90.1	Very high	95	Very high	101 Å²	101	50.1 Å²	50.1	71%	0.706	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-58.6	-32.6	175.2	57.8	0	0	0	0	113	F354 Q355	S352-F354 PolarHBondContact O-N 2.77Å; S352-Q355 WeakPolarHBondContact O-CB 3.24Å; S352-Q355 WeakPolarHBondContact O-CG 3.47Å; S352-Q355 PolarHBondContact O-N 3.26Å
353	T	89.1	Confident	95	Very high	114 Å²	114	52.9 Å²	52.9	70%	0.699	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	-67.9	-19.9	175.1	53.2	0	0	0	0	113.3	L351 Q355	L351-T353 PolarHBondContact O-N 2.9Å; T353-Q355 VanDerWaalsContact C-N 3.34Å
354	F	90.9	Very high	94.9	Very high	10 Å²	10	52 Å²	52	4%	0.044	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-79.8	-16.6	177.8	-175.4	-105.3	0	0	0	112.6	L106 Y135 L348 L351 S352 Q356 M357 W358	L106-F354 HydrophobicContact CD1-CE1 4.32Å; L106-F354 HydrophobicContact CD1-CZ 4.14Å; Y135-F354 HydrophobicContact CD1-CE2 4.09Å; Y135-F354 AromaticContact CD1-CZ 3.59Å; Y135-F354 HydrophobicContact CD1-CZ 3.59Å; Y135-F354 HydrophobicContact CD2-CE2 4.26Å; Y135-F354 AromaticContact CD2-CZ 3.9Å; Y135-F354 HydrophobicContact CD2-CZ 3.9Å; Y135-F354 HydrophobicContact CE1-CE2 4.01Å; Y135-F354 HydrophobicContact CE1-CZ 4Å; Y135-F354 HydrophobicContact CE2-CE2 4.2Å; Y135-F354 HydrophobicContact CE2-CZ 4.29Å; Y135-F354 HydrophobicContact CG-CE1 4.49Å; Y135-F354 HydrophobicContact CG-CE2 4.21Å; Y135-F354 AromaticContact CG-CZ 3.53Å; Y135-F354 HydrophobicContact CG-CZ 3.53Å; L348-F354 HydrophobicContact CD1-CD2 3.57Å; L348-F354 HydrophobicContact CD1-CE2 3.94Å; L348-F354 HydrophobicContact CD1-CG 4.18Å; L348-F354 HydrophobicContact CD2-CD2 4.23Å; L348-F354 HydrophobicContact CD2-CE2 3.73Å; L348-F354 HydrophobicContact CD2-CZ 4.11Å; L348-F354 HydrophobicContact CG-CD2 3.67Å; L348-F354 HydrophobicContact CG-CE2 3.65Å; L348-F354 HydrophobicContact CG-CG 4.13Å; L348-F354 HydrophobicContact CG-CZ 4.09Å; L348-F354 VanDerWaalsContact O-CB 3.24Å; L348-F354 WeakPolarHBondContact O-CB 3.18Å; L348-F354 WeakPolarHBondContact O-CG 3.47Å; L351-F354 HydrophobicContact CB-CB 4.09Å; L351-F354 VanDerWaalsContact O-CB 3.25Å; L351-F354 WeakPolarHBondContact O-CB 3.27Å; L351-F354 PolarHBondContact O-N 2.8Å; S352-F354 PolarHBondContact O-N 2.77Å; F354-Q356 PolarHBondContact O-N 3.21Å; F354-M357 HydrophobicContact CD2-CB 3.76Å; F354-M357 HydrophobicContact CD2-CG 3.93Å; F354-M357 HydrophobicContact CE2-CB 3.73Å; F354-M357 HydrophobicContact CE2-CG 4.28Å; F354-M357 HydrophobicContact CG-CB 4.39Å; F354-M357 HydrophobicContact CZ-CB 4.35Å; F354-M357 VanDerWaalsContact O-CB 3.29Å; F354-M357 WeakPolarHBondContact O-CB 3.39Å; F354-M357 PolarHBondContact O-N 2.8Å; F354-W358 HydrophobicContact CD1-CD2 4.5Å; F354-W358 AromaticContact CD1-CE2 3.87Å; F354-W358 HydrophobicContact CD1-CZ2 4.04Å; F354-W358 AromaticContact CD1-NE1 3.91Å; F354-W358 AromaticContact CE1-CD2 3.93Å; F354-W358 HydrophobicContact CE1-CD2 3.93Å; F354-W358 AromaticContact CE1-CE2 3.57Å; F354-W358 HydrophobicContact CE1-CE3 4.26Å; F354-W358 AromaticContact CE1-CH2 3.97Å; F354-W358 HydrophobicContact CE1-CH2 3.97Å; F354-W358 AromaticContact CE1-CZ2 3.6Å; F354-W358 HydrophobicContact CE1-CZ2 3.6Å; F354-W358 HydrophobicContact CE1-CZ3 4.28Å
355	Q	87.1	Confident	95	Very high	69 Å²	69	56.9 Å²	56.9	32%	0.322	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-28.2	-175.6	-64.3	-60.9	-4.7	0	0	113.8	S352 T353 M357	S352-Q355 WeakPolarHBondContact O-CB 3.24Å; S352-Q355 WeakPolarHBondContact O-CG 3.47Å; S352-Q355 PolarHBondContact O-N 3.26Å; T353-Q355 VanDerWaalsContact C-N 3.34Å; Q355-M357 VanDerWaalsContact C-N 3.32Å
356	Q	90.1	Very high	94.9	Very high	171 Å²	171	63.8 Å²	63.8	80%	0.799	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-12.7	178	-54	-167	14	0	0	113.8	F354 K375	F354-Q356 PolarHBondContact O-N 3.21Å; Q356-K375 PolarHBondContact O-NZ 2.92Å
357	M	94	Very high	94.9	Very high	80 Å²	80	65.2 Å²	65.2	39%	0.394	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-22.3	-177.7	-61.5	-58.2	-62.5	0	0	112.7	Y135 F354 Q355 K375	Y135-M357 HydrophobicContact CD2-CB 4.44Å; Y135-M357 WeakPolarHBondContact CD2-O 3.15Å; Y135-M357 HydrophobicContact CE2-CB 4.12Å; F354-M357 HydrophobicContact CD2-CB 3.76Å; F354-M357 HydrophobicContact CD2-CG 3.93Å; F354-M357 HydrophobicContact CE2-CB 3.73Å; F354-M357 HydrophobicContact CE2-CG 4.28Å; F354-M357 HydrophobicContact CG-CB 4.39Å; F354-M357 HydrophobicContact CZ-CB 4.35Å; F354-M357 VanDerWaalsContact O-CB 3.29Å; F354-M357 WeakPolarHBondContact O-CB 3.39Å; F354-M357 PolarHBondContact O-N 2.8Å; Q355-M357 VanDerWaalsContact C-N 3.32Å; M357-K375 WeakPolarHBondContact O-CE 3.39Å
358	W	96.7	Very high	95	Very high	15 Å²	15	63 Å²	63	6%	0.057	34%	0.342	C	S	.	.	S	Bend	trans	-53.1	141.8	174.9	-69.3	120.2	0	0	0	111.4	A9 P104 L106 A133 A349 F354 K375	A9-W358 HydrophobicContact CB-CH2 3.92Å; A9-W358 HydrophobicContact CB-CZ2 3.66Å; P104-W358 HydrophobicContact CB-CD2 4.37Å; P104-W358 HydrophobicContact CB-CE3 4.43Å; P104-W358 HydrophobicContact CB-CH2 4.11Å; P104-W358 HydrophobicContact CB-CZ2 4.03Å; P104-W358 HydrophobicContact CB-CZ3 4.32Å; L106-W358 HydrophobicContact CB-CH2 3.87Å; L106-W358 HydrophobicContact CB-CZ3 4.15Å; A133-W358 HydrophobicContact CB-CB 4.08Å; A133-W358 HydrophobicContact CB-CG 4.38Å; A349-W358 HydrophobicContact CB-CH2 4.31Å; A349-W358 HydrophobicContact CB-CZ2 4.08Å; F354-W358 HydrophobicContact CD1-CD2 4.5Å; F354-W358 AromaticContact CD1-CE2 3.87Å; F354-W358 HydrophobicContact CD1-CZ2 4.04Å; F354-W358 AromaticContact CD1-NE1 3.91Å; F354-W358 AromaticContact CE1-CD2 3.93Å; F354-W358 HydrophobicContact CE1-CD2 3.93Å; F354-W358 AromaticContact CE1-CE2 3.57Å; F354-W358 HydrophobicContact CE1-CE3 4.26Å; F354-W358 AromaticContact CE1-CH2 3.97Å; F354-W358 HydrophobicContact CE1-CH2 3.97Å; F354-W358 AromaticContact CE1-CZ2 3.6Å; F354-W358 HydrophobicContact CE1-CZ2 3.6Å; F354-W358 HydrophobicContact CE1-CZ3 4.28Å; W358-K375 WeakPolarHBondContact O-CE 3.27Å; W358-K375 PolarHBondContact O-NZ 2.89Å
359	I	98	Very high	95	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	116.4	163	-58.8	163.1	0	0	0	105.3	F126 A133 M134 E363 I371 V372 K375	F126-I359 HydrophobicContact CE2-CB 4.49Å; F126-I359 HydrophobicContact CE2-CG2 3.83Å; F126-I359 HydrophobicContact CZ-CB 4.33Å; F126-I359 HydrophobicContact CZ-CG2 3.87Å; F126-I359 WeakPolarHBondContact CZ-O 3.4Å; A133-I359 CarbonylContact C-O 3.35Å; A133-I359 WeakPolarHBondContact CA-O 3.12Å; A133-I359 WeakPolarHBondContact CB-O 3.49Å; M134-I359 HydrophobicContact CG-CB 4.48Å; M134-I359 PolarHBondContact N-O 3.45Å; M134-I359 WeakPolarHBondContact O-CB 3.39Å; M134-I359 PolarHBondContact O-N 2.87Å; I359-E363 WeakPolarHBondContact CA-OE2 3.27Å; I359-E363 HydrophobicContact CG2-CB 4.38Å; I359-I371 HydrophobicContact CD1-CG2 4.34Å; I359-I371 HydrophobicContact CG2-CG1 4Å; I359-I371 HydrophobicContact CG2-CG2 3.62Å; I359-V372 HydrophobicContact CD1-CB 4.24Å; I359-V372 HydrophobicContact CD1-CG2 4.32Å; I359-K375 HydrophobicContact CD1-CB 4.21Å; I359-K375 HydrophobicContact CG1-CB 3.72Å; I359-K375 HydrophobicContact CG1-CG 4.13Å
360	S	97.6	Very high	95.1	Very high	40 Å²	40	65.7 Å²	65.7	28%	0.28	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	158.6	175	66.9	0	0	0	0	111.5	Q362 E363 Y364	S360-Q362 PolarHBondContact O-N 3.38Å; S360-E363 PolarHBondContact N-OE2 3.4Å; S360-E363 PolarHBondContact O-N 3.32Å; S360-E363 VanDerWaalsContact O-N 3.13Å; S360-E363 WeakPolarHBondContact OG-CG 3.39Å; S360-E363 PolarHBondContact OG-N 2.84Å; S360-E363 PolarHBondContact OG-OE2 2.93Å; S360-Y364 PolarHBondContact O-N 3.17Å
361	K	97.6	Very high	95.3	Very high	58 Å²	58	63.2 Å²	63.2	25%	0.252	34%	0.343	S	S	.	.	H	α-helix	trans	-54.1	-37.9	172	-178.9	65.5	-176.3	175.3	0	112.2	F126 P132 Y364 D365	F126-K361 HydrophobicContact CB-CD 4.23Å; F126-K361 HydrophobicContact CD1-CB 4.22Å; F126-K361 HydrophobicContact CD1-CD 3.51Å; F126-K361 HydrophobicContact CD1-CG 4.48Å; F126-K361 HydrophobicContact CE1-CB 4.04Å; F126-K361 HydrophobicContact CE1-CD 4.2Å; F126-K361 HydrophobicContact CG-CD 4.19Å; F126-K361 PolarHBondContact O-NZ 3.41Å; P132-K361 PolarHBondContact O-N 2.54Å; K361-Y364 WeakPolarHBondContact O-CB 3.45Å; K361-Y364 PolarHBondContact O-N 3.17Å; K361-D365 VanDerWaalsContact CE-OD1 3.27Å; K361-D365 WeakPolarHBondContact CE-OD1 3.48Å; K361-D365 IonicContact NZ-OD1 3.44Å; K361-D365 PolarHBondContact NZ-OD1 3.13Å; K361-D365 VanDerWaalsContact O-CG 3.23Å; K361-D365 PolarHBondContact O-N 2.79Å
362	Q	97.5	Very high	95.5	Very high	129 Å²	129	59.6 Å²	59.6	60%	0.603	32%	0.324	S	S	*	.	H	α-helix	trans	-62.8	-48.4	175.8	-176	-175.1	-9.9	0	0	112.1	S360 Y364 D365 E366	S360-Q362 PolarHBondContact O-N 3.38Å; Q362-Y364 PolarHBondContact O-N 3Å; Q362-D365 PolarHBondContact O-N 3.33Å; Q362-E366 PolarHBondContact NE2-OE1 3Å; Q362-E366 WeakPolarHBondContact O-CG 3.38Å; Q362-E366 PolarHBondContact O-N 3.18Å; Q362-E366 VanDerWaalsContact O-N 3.07Å
363	E	97.8	Very high	95.8	Very high	57 Å²	57	56.7 Å²	56.7	27%	0.266	30%	0.299	S	S	.	.	H	α-helix	trans	-60.9	-36.3	177.6	-72.4	172.2	125.5	0	0	111.5	I359 S360 A367 I371 K375	I359-E363 WeakPolarHBondContact CA-OE2 3.27Å; I359-E363 HydrophobicContact CG2-CB 4.38Å; S360-E363 PolarHBondContact N-OE2 3.4Å; S360-E363 PolarHBondContact O-N 3.32Å; S360-E363 VanDerWaalsContact O-N 3.13Å; S360-E363 WeakPolarHBondContact OG-CG 3.39Å; S360-E363 PolarHBondContact OG-N 2.84Å; S360-E363 PolarHBondContact OG-OE2 2.93Å; E363-A367 WeakPolarHBondContact O-CB 3.45Å; E363-A367 PolarHBondContact O-N 2.9Å; E363-I371 HydrophobicContact CB-CG1 4.37Å; E363-K375 WeakPolarHBondContact OE1-CE 3.42Å; E363-K375 IonicContact OE1-NZ 3.99Å; E363-K375 PolarHBondContact OE1-NZ 2.77Å; E363-K375 IonicContact OE2-NZ 2.74Å; E363-K375 PolarHBondContact OE2-NZ 3Å
364	Y	98.3	Very high	96	Very high	9 Å²	9	60.4 Å²	60.4	4%	0.035	30%	0.301	C	S	.	.	H	α-helix	trans	-64.6	-48.1	173.2	173.8	-97.6	0	0	0	112.5	T122 F126 E127 S360 K361 Q362 E366 A367 G368 P369	T122-Y364 HydrophobicContact CG2-CD2 3.71Å; T122-Y364 HydrophobicContact CG2-CE2 3.9Å; F126-Y364 HydrophobicContact CB-CD1 3.6Å; F126-Y364 HydrophobicContact CB-CD2 4.26Å; F126-Y364 HydrophobicContact CB-CE1 3.69Å; F126-Y364 HydrophobicContact CB-CE2 4.3Å; F126-Y364 HydrophobicContact CB-CG 3.9Å; F126-Y364 HydrophobicContact CD1-CG 4.45Å; F126-Y364 AromaticContact CD2-CD1 3.95Å; F126-Y364 HydrophobicContact CD2-CD1 3.95Å; F126-Y364 AromaticContact CD2-CD2 3.33Å; F126-Y364 HydrophobicContact CD2-CD2 3.33Å; F126-Y364 AromaticContact CD2-CE2 3.97Å; F126-Y364 HydrophobicContact CD2-CE2 3.97Å; F126-Y364 AromaticContact CD2-CG 3.3Å; F126-Y364 HydrophobicContact CD2-CG 3.3Å; F126-Y364 AromaticContact CE2-CD2 3.89Å; F126-Y364 HydrophobicContact CE2-CD2 3.89Å; F126-Y364 AromaticContact CE2-CG 3.82Å; F126-Y364 HydrophobicContact CE2-CG 3.82Å; F126-Y364 AromaticContact CG-CD1 3.83Å; F126-Y364 HydrophobicContact CG-CD1 3.83Å; F126-Y364 HydrophobicContact CG-CD2 4.06Å; F126-Y364 HydrophobicContact CG-CE1 4.37Å; F126-Y364 AromaticContact CG-CG 3.65Å; F126-Y364 HydrophobicContact CG-CG 3.65Å; E127-Y364 VanDerWaalsContact CD-OH 3.28Å; E127-Y364 HydrophobicContact CG-CE1 4.09Å; E127-Y364 WeakPolarHBondContact CG-OH 3.48Å; E127-Y364 PolarHBondContact OE1-OH 3.02Å; S360-Y364 PolarHBondContact O-N 3.17Å; K361-Y364 WeakPolarHBondContact O-CB 3.45Å; K361-Y364 PolarHBondContact O-N 3.17Å; Q362-Y364 PolarHBondContact O-N 3Å; Y364-E366 PolarHBondContact O-N 3.04Å; Y364-A367 PolarHBondContact O-N 3.33Å; Y364-G368 WeakPolarHBondContact O-CA 3.43Å; Y364-G368 PolarHBondContact O-N 2.9Å; Y364-P369 HydrophobicContact CE2-CB 4.38Å; Y364-P369 HydrophobicContact CE2-CG 3.92Å
365	D	98.1	Very high	96.1	Very high	103 Å²	103	62.3 Å²	62.3	55%	0.551	31%	0.309	S	S	*	.	H	α-helix	trans	-63.8	-28.9	-178.6	-67.2	-22.3	0	0	0	111.6	K361 Q362	K361-D365 VanDerWaalsContact CE-OD1 3.27Å; K361-D365 WeakPolarHBondContact CE-OD1 3.48Å; K361-D365 IonicContact NZ-OD1 3.44Å; K361-D365 PolarHBondContact NZ-OD1 3.13Å; K361-D365 VanDerWaalsContact O-CG 3.23Å; K361-D365 PolarHBondContact O-N 2.79Å; Q362-D365 PolarHBondContact O-N 3.33Å
366	E	97.7	Very high	96.3	Very high	144 Å²	144	59.7 Å²	59.7	67%	0.673	30%	0.298	S	S	*	.	H	α-helix	trans	-80.2	-41.8	176.9	-70.7	176.7	-165.3	0	0	113.9	Q362 Y364	Q362-E366 PolarHBondContact NE2-OE1 3Å; Q362-E366 WeakPolarHBondContact O-CG 3.38Å; Q362-E366 PolarHBondContact O-N 3.18Å; Q362-E366 VanDerWaalsContact O-N 3.07Å; Y364-E366 PolarHBondContact O-N 3.04Å
367	A	97.3	Very high	96	Very high	34 Å²	34	56.8 Å²	56.8	28%	0.281	28%	0.283	S	S	.	.	H	α-helix	trans	-109.3	-8.7	-171.4	0	0	0	0	0	114.7	E363 Y364 S370 I371	E363-A367 WeakPolarHBondContact O-CB 3.45Å; E363-A367 PolarHBondContact O-N 2.9Å; Y364-A367 PolarHBondContact O-N 3.33Å; A367-S370 PolarHBondContact O-OG 3.11Å; A367-I371 HydrophobicContact CB-CB 4Å; A367-I371 HydrophobicContact CB-CD1 4.04Å; A367-I371 HydrophobicContact CB-CG1 4.35Å
368	G	97.7	Very high	96.1	Very high	21 Å²	21	55.7 Å²	55.7	22%	0.216	28%	0.278	C	S	.	.			trans	64.6	-167.8	-173.2	0	0	0	0	0	113.7	Y364 S370 I371	Y364-G368 WeakPolarHBondContact O-CA 3.43Å; Y364-G368 PolarHBondContact O-N 2.9Å; G368-S370 PolarHBondContact O-N 3.25Å; G368-I371 WeakPolarHBondContact O-CG2 3.45Å; G368-I371 PolarHBondContact O-N 3.42Å
369	P	97.3	Very high	96.1	Very high	36 Å²	36	57.8 Å²	57.8	23%	0.234	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-55.3	-26.7	-176.7	-28.3	34.9	0	0	0	115.5	E119 Q123 Y364 I371 V372	E119-P369 HydrophobicContact CB-CB 3.74Å; E119-P369 HydrophobicContact CG-CB 4.07Å; Q123-P369 HydrophobicContact CB-CG 4.15Å; Y364-P369 HydrophobicContact CE2-CB 4.38Å; Y364-P369 HydrophobicContact CE2-CG 3.92Å; P369-I371 PolarHBondContact O-N 2.82Å; P369-I371 VanDerWaalsContact O-N 3.14Å; P369-V372 WeakPolarHBondContact O-CG1 3.23Å; P369-V372 PolarHBondContact O-N 3.07Å
370	S	97.4	Very high	96	Very high	47 Å²	47	61 Å²	61	33%	0.329	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-65.2	-14.9	-177.8	75.3	0	0	0	0	114.4	A367 G368 V372 H373	A367-S370 PolarHBondContact O-OG 3.11Å; G368-S370 PolarHBondContact O-N 3.25Å; S370-V372 PolarHBondContact O-N 3.2Å; S370-V372 VanDerWaalsContact O-N 3.15Å; S370-H373 PolarHBondContact O-CD2 3.24Å; S370-H373 PolarHBondContact O-N 3.44Å; S370-H373 VanDerWaalsContact O-N 3.13Å
371	I	97.7	Very high	95.9	Very high	13 Å²	13	62.2 Å²	62.2	7%	0.067	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-55.7	-30.1	177.5	-170.2	56.8	0	0	0	112.8	T122 I359 E363 A367 G368 P369 H373 R374 K375	T122-I371 HydrophobicContact CG2-CG2 4.33Å; I359-I371 HydrophobicContact CD1-CG2 4.34Å; I359-I371 HydrophobicContact CG2-CG1 4Å; I359-I371 HydrophobicContact CG2-CG2 3.62Å; E363-I371 HydrophobicContact CB-CG1 4.37Å; A367-I371 HydrophobicContact CB-CB 4Å; A367-I371 HydrophobicContact CB-CD1 4.04Å; A367-I371 HydrophobicContact CB-CG1 4.35Å; G368-I371 WeakPolarHBondContact O-CG2 3.45Å; G368-I371 PolarHBondContact O-N 3.42Å; P369-I371 PolarHBondContact O-N 2.82Å; P369-I371 VanDerWaalsContact O-N 3.14Å; I371-H373 PolarHBondContact O-N 3.19Å; I371-R374 PolarHBondContact O-N 3.34Å; I371-K375 HydrophobicContact CD1-CG 4.14Å; I371-K375 HydrophobicContact CG1-CG 4.28Å; I371-K375 PolarHBondContact O-N 2.74Å
372	V	97.5	Very high	95.8	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-57.6	-33.5	178.9	71.3	0	0	0	0	112.8	R118 E119 T122 V136 I359 P369 S370 R374 C376 F377	R118-V372 HydrophobicContact CB-CG1 3.77Å; R118-V372 HydrophobicContact CB-CG2 4.27Å; E119-V372 HydrophobicContact CG-CG1 4.43Å; T122-V372 WeakPolarHBondContact OG1-CB 3.38Å; V136-V372 HydrophobicContact CB-CG2 4.37Å; V136-V372 HydrophobicContact CG2-CG2 4.08Å; I359-V372 HydrophobicContact CD1-CB 4.24Å; I359-V372 HydrophobicContact CD1-CG2 4.32Å; P369-V372 WeakPolarHBondContact O-CG1 3.23Å; P369-V372 PolarHBondContact O-N 3.07Å; S370-V372 PolarHBondContact O-N 3.2Å; S370-V372 VanDerWaalsContact O-N 3.15Å; V372-R374 VanDerWaalsContact C-N 3.25Å; V372-R374 PolarHBondContact O-N 3Å; V372-C376 HydrophobicContact CG2-CB 4.25Å; V372-C376 WeakPolarHBondContact O-CB 3.49Å; V372-C376 PolarHBondContact O-N 3.22Å; V372-C376 VanDerWaalsContact O-N 3.11Å; V372-F377 HydrophobicContact CG2-CE2 4.32Å
373	H	96.1	Very high	95.7	Very high	40 Å²	40	58.1 Å²	58.1	19%	0.185	29%	0.291	C	S	.	.	H	α-helix	trans	-75.7	-12.6	179.1	-52.6	-54.7	0	0	0	113.6	K115 E119 S370 I371	K115-H373 VanDerWaalsContact CB-CE1 3.48Å; K115-H373 WeakPolarHBondContact CB-CE1 3.47Å; K115-H373 PolarHBondContact O-CE1 3.11Å; E119-H373 WeakPolarHBondContact CG-NE2 3.42Å; E119-H373 IonicContact OE1-CD2 3.67Å; E119-H373 IonicContact OE1-CE1 3.65Å; E119-H373 IonicContact OE1-NE2 2.72Å; E119-H373 PolarHBondContact OE1-NE2 2.65Å; S370-H373 PolarHBondContact O-CD2 3.24Å; S370-H373 PolarHBondContact O-N 3.44Å; S370-H373 VanDerWaalsContact O-N 3.13Å; I371-H373 PolarHBondContact O-N 3.19Å
374	R	93.6	Very high	95.5	Very high	193 Å²	193	58.1 Å²	58.1	73%	0.728	29%	0.293	S	S	*	.	H	α-helix	trans	-98.2	-30.5	178.7	-62.8	-176.3	-175.2	171.2	3.6	112.5	I371 V372	I371-R374 PolarHBondContact O-N 3.34Å; V372-R374 VanDerWaalsContact C-N 3.25Å; V372-R374 PolarHBondContact O-N 3Å
375	K	93.2	Very high	95.3	Very high	49 Å²	49	61.9 Å²	61.9	21%	0.213	31%	0.312	C	S	.	.	H	α-helix	trans	-103.4	-27.3	-171.3	-69.5	-89.4	-70.3	-153.4	0	113.4	Q356 M357 W358 I359 E363 I371	Q356-K375 PolarHBondContact O-NZ 2.92Å; M357-K375 WeakPolarHBondContact O-CE 3.39Å; W358-K375 WeakPolarHBondContact O-CE 3.27Å; W358-K375 PolarHBondContact O-NZ 2.89Å; I359-K375 HydrophobicContact CD1-CB 4.21Å; I359-K375 HydrophobicContact CG1-CB 3.72Å; I359-K375 HydrophobicContact CG1-CG 4.13Å; E363-K375 WeakPolarHBondContact OE1-CE 3.42Å; E363-K375 IonicContact OE1-NZ 3.99Å; E363-K375 PolarHBondContact OE1-NZ 2.77Å; E363-K375 IonicContact OE2-NZ 2.74Å; E363-K375 PolarHBondContact OE2-NZ 3Å; I371-K375 HydrophobicContact CD1-CG 4.14Å; I371-K375 HydrophobicContact CG1-CG 4.28Å; I371-K375 PolarHBondContact O-N 2.74Å
376	C	91.4	Very high	95.1	Very high	15 Å²	15	58.5 Å²	58.5	10%	0.101	29%	0.292	C	S	.	.			trans	-106.4	-19.6	-174.9	-61.3	0	0	0	0	114.8	Y135 V136 V372	Y135-C376 WeakPolarHBondContact CD2-SG 3.22Å; Y135-C376 HydrophobicContact CE2-CB 4.17Å; Y135-C376 VanDerWaalsContact CE2-SG 3.52Å; V136-C376 PolarHBondContact N-SG 2.85Å; V136-C376 WeakPolarHBondContact O-CB 3.29Å; V372-C376 HydrophobicContact CG2-CB 4.25Å; V372-C376 WeakPolarHBondContact O-CB 3.49Å; V372-C376 PolarHBondContact O-N 3.22Å; V372-C376 VanDerWaalsContact O-N 3.11Å
377	F	84.2	Confident	94.9	Very high	110 Å²	110	50.7 Å²	50.7	48%	0.482	26%	0.258	S	S	.	.			trans	-141.3	0	-168.3	-60.5	-76.8	0	0	0	114.4	E109 R118 V136 I138 V372	E109-F377 VanDerWaalsContact CD-CZ 3.41Å; E109-F377 HydrophobicContact CG-CZ 4.2Å; E109-F377 WeakPolarHBondContact OE1-CE1 3.34Å; E109-F377 WeakPolarHBondContact OE1-CZ 2.95Å; R118-F377 VanDerWaalsContact CD-CE2 3.48Å; R118-F377 HydrophobicContact CG-CE2 4.25Å; V136-F377 HydrophobicContact CB-CE2 4.31Å; V136-F377 HydrophobicContact CB-CZ 4.36Å; V136-F377 HydrophobicContact CG1-CE2 4.34Å; V136-F377 HydrophobicContact CG1-CZ 4.03Å; I138-F377 HydrophobicContact CD1-CD1 4.46Å; I138-F377 HydrophobicContact CD1-CE1 4.12Å; I138-F377 HydrophobicContact CG1-CE1 3.78Å; V372-F377 HydrophobicContact CG2-CE2 4.32Å

Retrieved 377 of 377 residues in 2927.2 ms (Link to these results)

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