A0A096NNY8_PAPAN Loading...

F-box/LRR-repeat protein 2

AlphaFold DB (A0A096NGF8), UniProt , Accession A0A096NNY8, Species PAPAN (Papio anubis, Olive baboon), Gene FBXL2, Length 423 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35	Very low	57.7	Low	231 Å²	231	126.9 Å²	126.9	100%	1.138	68%	0.683	S	S	*	*				0	127	0	-74.9	176	-161.1	0	0	108.1
2	V	35.3	Very low	60.5	Low	147 Å²	147	119.4 Å²	119.4	89%	0.891	64%	0.643	S	S	*	*			trans	-80.3	112.9	-179.9	178.9	0	0	0	0	107.2	S4	V2-S4 PolarHBondContact O-N 3.27Å
3	F	38.1	Very low	62.8	Low	177 Å²	177	118.7 Å²	118.7	78%	0.776	63%	0.63	S	S	*	*			trans	-70.2	114.7	171	-76.8	-82.6	0	0	0	108.3
4	S	42.2	Very low	65.1	Low	72 Å²	72	121.6 Å²	121.6	50%	0.503	64%	0.635	S	S	.	*			trans	-70.1	147.4	172.2	76.2	0	0	0	0	110.1	V2 N6	V2-S4 PolarHBondContact O-N 3.27Å; S4-N6 PolarHBondContact O-N 2.88Å
5	N	45.1	Very low	67.1	Low	167 Å²	167	116.9 Å²	116.9	89%	0.893	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.9	8.5	179.2	-94.7	-7.1	0	0	0	115.5
6	N	48.8	Very low	68.8	Low	127 Å²	127	113.6 Å²	113.6	68%	0.679	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.2	-11.5	-177.3	-100.5	-13.5	0	0	0	115.2	S4 E8 K13	S4-N6 PolarHBondContact O-N 2.88Å; N6-E8 PolarHBondContact O-N 3.33Å; N6-K13 PolarHBondContact O-NZ 3.45Å
7	D	57.4	Low	70.3	Confident	125 Å²	125	113.4 Å²	113.4	67%	0.668	59%	0.591	S	S	*	*			trans	-89.2	11.4	-175.1	-80.2	-26.1	0	0	0	115.6	G9	D7-G9 PolarHBondContact O-N 3.45Å
8	E	66.7	Low	71.6	Confident	112 Å²	112	115.6 Å²	115.6	52%	0.523	60%	0.598	S	S	.	*			trans	-70.3	120.5	170.2	-77	-168.9	157.1	0	0	110.4	N6 N12 K13	N6-E8 PolarHBondContact O-N 3.33Å; E8-N12 HydrophobicContact CB-CB 4.35Å; E8-K13 HydrophobicContact CB-CG 4.15Å; E8-K13 WeakPolarHBondContact O-CD 3.48Å; E8-K13 WeakPolarHBondContact O-CE 3.39Å; E8-K13 PolarHBondContact O-NZ 3.38Å
9	G	81.1	Confident	72.8	Confident	40 Å²	40	113.8 Å²	113.8	41%	0.412	59%	0.589	S	S	.	*			trans	-53.5	148.2	177.5	0	0	0	0	0	111.9	D7 I11 N12 K13	D7-G9 PolarHBondContact O-N 3.45Å; G9-I11 PolarHBondContact O-N 2.98Å; G9-N12 WeakPolarHBondContact O-CB 3.08Å; G9-N12 PolarHBondContact O-N 2.8Å; G9-K13 PolarHBondContact O-N 3.25Å
10	L	92.3	Very high	73.9	Confident	134 Å²	134	108.5 Å²	108.5	70%	0.702	56%	0.561	S	S	*	*	H	α-helix	trans	-51.1	-35	-172.8	-166.6	152.4	0	0	0	112.8	N12 K13 K14	L10-N12 PolarHBondContact O-N 2.96Å; L10-K13 PolarHBondContact O-N 3.05Å; L10-K14 HydrophobicContact CD2-CB 4.25Å; L10-K14 HydrophobicContact CD2-CG 3.66Å; L10-K14 HydrophobicContact CG-CG 4.22Å; L10-K14 WeakPolarHBondContact O-CB 3.49Å; L10-K14 WeakPolarHBondContact O-CG 3.47Å; L10-K14 PolarHBondContact O-N 2.86Å
11	I	93.1	Very high	74.7	Confident	64 Å²	64	104.6 Å²	104.6	33%	0.328	54%	0.541	S	S	.	.	H	α-helix	trans	-59	-42.5	176.6	-162.6	178.2	0	0	0	112.7	G9 K13 L15 L20 W42	G9-I11 PolarHBondContact O-N 2.98Å; I11-K13 VanDerWaalsContact C-N 3.34Å; I11-L15 HydrophobicContact CG1-CD1 4.04Å; I11-L15 WeakPolarHBondContact O-CB 3.49Å; I11-L15 PolarHBondContact O-N 3.23Å; I11-L20 HydrophobicContact CD1-CD2 4.14Å; I11-L20 HydrophobicContact CG1-CD2 3.94Å; I11-W42 HydrophobicContact CD1-CZ2 4.19Å; I11-W42 HydrophobicContact CG2-CZ2 4.04Å
12	N	90.9	Very high	77.4	Confident	37 Å²	37	101.6 Å²	101.6	20%	0.198	52%	0.517	C	S	.	.	H	α-helix	trans	-72.2	-28.6	179.1	-71.7	79.9	0	0	0	112.3	E8 G9 L10 W42	E8-N12 HydrophobicContact CB-CB 4.35Å; G9-N12 WeakPolarHBondContact O-CB 3.08Å; G9-N12 PolarHBondContact O-N 2.8Å; L10-N12 PolarHBondContact O-N 2.96Å; N12-W42 PolarHBondContact ND2-NE1 3.25Å; N12-W42 PolarHBondContact OD1-NE1 3.48Å
13	K	90.9	Very high	80.2	Confident	110 Å²	110	98 Å²	98	48%	0.478	49%	0.492	S	S	.	.	H	α-helix	trans	-81.8	-29.9	178	-68.1	-179	178.2	164.7	0	113.4	N6 E8 G9 L10 I11	N6-K13 PolarHBondContact O-NZ 3.45Å; E8-K13 HydrophobicContact CB-CG 4.15Å; E8-K13 WeakPolarHBondContact O-CD 3.48Å; E8-K13 WeakPolarHBondContact O-CE 3.39Å; E8-K13 PolarHBondContact O-NZ 3.38Å; G9-K13 PolarHBondContact O-N 3.25Å; L10-K13 PolarHBondContact O-N 3.05Å; I11-K13 VanDerWaalsContact C-N 3.34Å
14	K	94.6	Very high	82.8	Confident	160 Å²	160	89.7 Å²	89.7	70%	0.696	46%	0.456	S	S	*	.	H	α-helix	trans	-101	-28.3	-172.5	-70.3	-65	-174.2	178.8	0	114.3	L10	L10-K14 HydrophobicContact CD2-CB 4.25Å; L10-K14 HydrophobicContact CD2-CG 3.66Å; L10-K14 HydrophobicContact CG-CG 4.22Å; L10-K14 WeakPolarHBondContact O-CB 3.49Å; L10-K14 WeakPolarHBondContact O-CG 3.47Å; L10-K14 PolarHBondContact O-N 2.86Å
15	L	95.1	Very high	84.9	Confident	51 Å²	51	89.6 Å²	89.6	27%	0.267	46%	0.455	S	S	.	.	S	Bend	trans	-104.5	130	-179.3	-75.3	83.7	0	0	0	111.3	I11 L19 L20 I23	I11-L15 HydrophobicContact CG1-CD1 4.04Å; I11-L15 WeakPolarHBondContact O-CB 3.49Å; I11-L15 PolarHBondContact O-N 3.23Å; L15-L19 HydrophobicContact CB-CB 4.38Å; L15-L19 HydrophobicContact CD2-CB 4.02Å; L15-L19 HydrophobicContact CG-CB 4.49Å; L15-L20 HydrophobicContact CB-CD2 4.06Å; L15-L20 HydrophobicContact CB-CG 4Å; L15-L20 HydrophobicContact CD2-CD2 4.49Å; L15-I23 HydrophobicContact CD2-CD1 3.54Å
16	P	94.7	Very high	86.9	Confident	64 Å²	64	89.4 Å²	89.4	42%	0.416	45%	0.447	S	S	.	.			trans	-69.3	162.8	171.3	31.4	-35.7	0	0	0	111.4	E18 L19 L20	P16-E18 PolarHBondContact O-N 2.93Å; P16-E18 VanDerWaalsContact O-N 3.11Å; P16-L19 HydrophobicContact CG-CB 4.31Å; P16-L19 HydrophobicContact CG-CD1 4.12Å; P16-L19 HydrophobicContact CG-CG 3.93Å; P16-L19 PolarHBondContact O-N 3.31Å; P16-L20 PolarHBondContact O-N 3.44Å; P16-L20 VanDerWaalsContact O-N 3.14Å
17	K	93.3	Very high	88.7	Confident	109 Å²	109	86.2 Å²	86.2	47%	0.474	43%	0.429	S	S	.	.	H	α-helix	trans	-47.3	-43.6	179.8	-172.9	-175.9	179.1	-164.6	0	112.4	L19 L20 L21 L45 D48	K17-L19 PolarHBondContact O-N 3.38Å; K17-L20 PolarHBondContact O-N 3.11Å; K17-L21 HydrophobicContact CG-CD1 4.26Å; K17-L21 HydrophobicContact CG-CG 4.4Å; K17-L21 WeakPolarHBondContact O-CG 3.47Å; K17-L21 PolarHBondContact O-N 3Å; K17-L45 HydrophobicContact CD-CD2 4.44Å; K17-L45 HydrophobicContact CG-CD2 3.62Å; K17-D48 IonicContact NZ-OD2 2.95Å; K17-D48 PolarHBondContact NZ-OD2 3.06Å
18	E	93.5	Very high	89.8	Confident	153 Å²	153	84.3 Å²	84.3	72%	0.715	42%	0.419	S	S	*	.	H	α-helix	trans	-62.5	-42	-176.9	-65.2	143.4	-176.8	0	0	112.6	P16 R22	P16-E18 PolarHBondContact O-N 2.93Å; P16-E18 VanDerWaalsContact O-N 3.11Å; E18-R22 WeakPolarHBondContact O-CB 3.36Å; E18-R22 PolarHBondContact O-N 2.78Å
19	L	95.2	Very high	90.4	Very high	83 Å²	83	80.7 Å²	80.7	44%	0.435	40%	0.403	S	S	.	.	H	α-helix	trans	-72.9	-35.4	177.5	-64.8	-173.1	0	0	0	111.4	L15 P16 K17 R22 I23	L15-L19 HydrophobicContact CB-CB 4.38Å; L15-L19 HydrophobicContact CD2-CB 4.02Å; L15-L19 HydrophobicContact CG-CB 4.49Å; P16-L19 HydrophobicContact CG-CB 4.31Å; P16-L19 HydrophobicContact CG-CD1 4.12Å; P16-L19 HydrophobicContact CG-CG 3.93Å; P16-L19 PolarHBondContact O-N 3.31Å; K17-L19 PolarHBondContact O-N 3.38Å; L19-R22 WeakPolarHBondContact O-CB 3.22Å; L19-R22 PolarHBondContact O-N 3.14Å; L19-I23 WeakPolarHBondContact O-CG1 3.33Å; L19-I23 PolarHBondContact O-N 3.06Å
20	L	94.6	Very high	90.5	Very high	7 Å²	7	81.3 Å²	81.3	4%	0.037	40%	0.399	C	S	.	.	H	α-helix	trans	-64.6	-43.1	174.2	-68.8	169.4	0	0	0	112	I11 L15 P16 K17 R22 I23 F24 L45	I11-L20 HydrophobicContact CD1-CD2 4.14Å; I11-L20 HydrophobicContact CG1-CD2 3.94Å; L15-L20 HydrophobicContact CB-CD2 4.06Å; L15-L20 HydrophobicContact CB-CG 4Å; L15-L20 HydrophobicContact CD2-CD2 4.49Å; P16-L20 PolarHBondContact O-N 3.44Å; P16-L20 VanDerWaalsContact O-N 3.14Å; K17-L20 PolarHBondContact O-N 3.11Å; L20-R22 VanDerWaalsContact C-N 3.3Å; L20-R22 PolarHBondContact O-N 3.35Å; L20-I23 WeakPolarHBondContact O-CB 3.44Å; L20-I23 PolarHBondContact O-N 3.3Å; L20-F24 WeakPolarHBondContact O-CD1 3.45Å; L20-F24 PolarHBondContact O-N 3.09Å; L20-L45 HydrophobicContact CB-CD1 4.06Å; L20-L45 HydrophobicContact CB-CD2 4.32Å; L20-L45 HydrophobicContact CD1-CD1 3.73Å; L20-L45 HydrophobicContact CG-CD1 4.47Å
21	L	91.4	Very high	90.3	Very high	26 Å²	26	76.7 Å²	76.7	14%	0.136	38%	0.376	C	S	.	.	H	α-helix	trans	-63.5	-37.7	173	-72.5	-179.8	0	0	0	111.6	K17 I23 F24 S25 L45 D48 N51	K17-L21 HydrophobicContact CG-CD1 4.26Å; K17-L21 HydrophobicContact CG-CG 4.4Å; K17-L21 WeakPolarHBondContact O-CG 3.47Å; K17-L21 PolarHBondContact O-N 3Å; L21-I23 VanDerWaalsContact C-N 3.32Å; L21-I23 PolarHBondContact O-N 3.43Å; L21-F24 PolarHBondContact O-N 3.14Å; L21-S25 WeakPolarHBondContact O-CB 3.4Å; L21-S25 PolarHBondContact O-N 2.96Å; L21-L45 HydrophobicContact CD2-CD2 3.97Å; L21-L45 WeakPolarHBondContact CD2-O 3.47Å; L21-L45 HydrophobicContact CG-CD2 4.1Å; L21-D48 HydrophobicContact CD1-CB 4.48Å; L21-D48 HydrophobicContact CD2-CB 3.51Å; L21-N51 WeakPolarHBondContact CD2-ND2 3.46Å; L21-N51 PolarHBondContact O-OD1 3.31Å
22	R	90.9	Very high	90.1	Very high	168 Å²	168	73.9 Å²	73.9	63%	0.634	36%	0.362	S	S	*	.	H	α-helix	trans	-63	-39.6	174.3	-165.2	166.1	-175.2	-154.2	-0.7	111.9	E18 L19 L20 S25 F26	E18-R22 WeakPolarHBondContact O-CB 3.36Å; E18-R22 PolarHBondContact O-N 2.78Å; L19-R22 WeakPolarHBondContact O-CB 3.22Å; L19-R22 PolarHBondContact O-N 3.14Å; L20-R22 VanDerWaalsContact C-N 3.3Å; L20-R22 PolarHBondContact O-N 3.35Å; R22-S25 PolarHBondContact O-N 3.42Å; R22-S25 PolarHBondContact O-OG 3.38Å; R22-F26 HydrophobicContact CG-CE2 4.28Å; R22-F26 WeakPolarHBondContact O-CD2 3.15Å; R22-F26 WeakPolarHBondContact O-CE2 3.1Å
23	I	93.7	Very high	89.9	Confident	71 Å²	71	75 Å²	75	36%	0.364	37%	0.371	S	S	.	.	H	α-helix	trans	-61.7	-48.6	172.2	-67	166.9	0	0	0	110.1	L15 L19 L20 L21 S25 F26	L15-I23 HydrophobicContact CD2-CD1 3.54Å; L19-I23 WeakPolarHBondContact O-CG1 3.33Å; L19-I23 PolarHBondContact O-N 3.06Å; L20-I23 WeakPolarHBondContact O-CB 3.44Å; L20-I23 PolarHBondContact O-N 3.3Å; L21-I23 VanDerWaalsContact C-N 3.32Å; L21-I23 PolarHBondContact O-N 3.43Å; I23-S25 PolarHBondContact O-N 3.14Å; I23-F26 PolarHBondContact O-N 3.44Å; I23-F26 VanDerWaalsContact O-N 3.11Å
24	F	92.3	Very high	89.9	Confident	4 Å²	4	77.1 Å²	77.1	2%	0.018	38%	0.377	C	S	.	.	H	α-helix	trans	-64.1	-29.1	-178.1	-78	17.7	0	0	0	112.8	L20 L21 F26 L27 L32 C35 W42 L45 A46	L20-F24 WeakPolarHBondContact O-CD1 3.45Å; L20-F24 PolarHBondContact O-N 3.09Å; L21-F24 PolarHBondContact O-N 3.14Å; F24-F26 PolarHBondContact O-N 2.78Å; F24-F26 VanDerWaalsContact O-N 3.11Å; F24-L27 HydrophobicContact CD1-CD1 3.78Å; F24-L27 HydrophobicContact CE1-CD1 4.29Å; F24-L27 HydrophobicContact CG-CD1 4.28Å; F24-L27 WeakPolarHBondContact O-CB 3.37Å; F24-L27 PolarHBondContact O-N 3.25Å; F24-L32 HydrophobicContact CB-CD1 4.05Å; F24-L32 HydrophobicContact CG-CD1 4.46Å; F24-L32 VanDerWaalsContact O-CD1 3.28Å; F24-L32 WeakPolarHBondContact O-CD1 3.5Å; F24-C35 HydrophobicContact CE2-CB 4.29Å; F24-C35 HydrophobicContact CZ-CB 4.12Å; F24-W42 HydrophobicContact CE1-CE3 4.05Å; F24-W42 HydrophobicContact CE1-CH2 4.15Å; F24-W42 AromaticContact CE1-CZ3 3.84Å; F24-W42 HydrophobicContact CE1-CZ3 3.84Å; F24-W42 AromaticContact CZ-CD2 3.8Å; F24-W42 HydrophobicContact CZ-CD2 3.8Å; F24-W42 AromaticContact CZ-CE3 3.48Å; F24-W42 HydrophobicContact CZ-CE3 3.48Å; F24-W42 VanDerWaalsContact CZ-CE3 3.48Å; F24-W42 HydrophobicContact CZ-CG 4.36Å; F24-W42 HydrophobicContact CZ-CH2 4.36Å; F24-W42 AromaticContact CZ-CZ3 3.78Å; F24-W42 HydrophobicContact CZ-CZ3 3.78Å; F24-L45 HydrophobicContact CD2-CB 3.95Å; F24-L45 HydrophobicContact CE2-CB 3.5Å; F24-L45 HydrophobicContact CZ-CB 4.31Å; F24-A46 HydrophobicContact CD2-CB 4.17Å; F24-A46 HydrophobicContact CE2-CB 3.85Å; F24-A46 VanDerWaalsContact CE2-N 3.35Å
25	S	87	Confident	89.8	Confident	70 Å²	70	70.1 Å²	70.1	49%	0.49	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-14	175.9	78.5	0	0	0	0	114.6	L21 R22 I23 N51	L21-S25 WeakPolarHBondContact O-CB 3.4Å; L21-S25 PolarHBondContact O-N 2.96Å; R22-S25 PolarHBondContact O-N 3.42Å; R22-S25 PolarHBondContact O-OG 3.38Å; I23-S25 PolarHBondContact O-N 3.14Å; S25-N51 PolarHBondContact N-OD1 3.46Å
26	F	87.2	Confident	89.6	Confident	162 Å²	162	68.2 Å²	68.2	71%	0.711	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.4	-6.5	174	-65.1	-75.4	0	0	0	113.6	R22 I23 F24	R22-F26 HydrophobicContact CG-CE2 4.28Å; R22-F26 WeakPolarHBondContact O-CD2 3.15Å; R22-F26 WeakPolarHBondContact O-CE2 3.1Å; I23-F26 PolarHBondContact O-N 3.44Å; I23-F26 VanDerWaalsContact O-N 3.11Å; F24-F26 PolarHBondContact O-N 2.78Å; F24-F26 VanDerWaalsContact O-N 3.11Å
27	L	86	Confident	89.4	Confident	60 Å²	60	72.7 Å²	72.7	31%	0.314	36%	0.355	S	S	.	.	S	Bend	trans	-86.3	143.5	-178.2	-58.1	179.2	0	0	0	110.5	F24 T31 L32	F24-L27 HydrophobicContact CD1-CD1 3.78Å; F24-L27 HydrophobicContact CE1-CD1 4.29Å; F24-L27 HydrophobicContact CG-CD1 4.28Å; F24-L27 WeakPolarHBondContact O-CB 3.37Å; F24-L27 PolarHBondContact O-N 3.25Å; L27-T31 HydrophobicContact CB-CG2 4.25Å; L27-T31 HydrophobicContact CD1-CG2 4.19Å; L27-T31 HydrophobicContact CD2-CG2 4.06Å; L27-T31 HydrophobicContact CG-CG2 4.39Å; L27-L32 HydrophobicContact CB-CD1 3.66Å; L27-L32 HydrophobicContact CD1-CD1 4.19Å; L27-L32 HydrophobicContact CG-CD1 4.44Å
28	D	81.1	Confident	89.4	Confident	85 Å²	85	73 Å²	73	46%	0.455	36%	0.36	S	S	.	.			trans	-69.3	164.9	170.3	71.1	75.4	0	0	0	111.5	V30 T31 L32	D28-V30 VanDerWaalsContact C-N 3.3Å; D28-V30 PolarHBondContact O-N 3.22Å; D28-V30 WeakPolarHBondContact OD1-CA 3.47Å; D28-V30 VanDerWaalsContact OD1-CB 3.29Å; D28-V30 WeakPolarHBondContact OD1-CB 3.14Å; D28-V30 PolarHBondContact OD1-N 2.96Å; D28-T31 VanDerWaalsContact CG-OG1 3.3Å; D28-T31 PolarHBondContact O-N 2.84Å; D28-T31 PolarHBondContact OD1-N 2.96Å; D28-T31 PolarHBondContact OD1-OG1 2.82Å; D28-T31 WeakPolarHBondContact OD2-CB 3.41Å; D28-T31 PolarHBondContact OD2-OG1 2.94Å; D28-L32 WeakPolarHBondContact O-CB 3.4Å; D28-L32 PolarHBondContact O-N 3.26Å
29	I	79.8	Confident	89.4	Confident	36 Å²	36	68 Å²	68	19%	0.185	34%	0.342	C	S	.	.	H	α-helix	trans	-61.3	-37.9	-173.8	-29.7	163.5	0	0	0	112.1	L32 C33 W52 I55 L57	I29-L32 PolarHBondContact O-N 2.89Å; I29-C33 WeakPolarHBondContact O-CB 3.42Å; I29-C33 PolarHBondContact O-N 3.47Å; I29-C33 PolarHBondContact O-SG 2.92Å; I29-W52 HydrophobicContact CG2-CE3 4.24Å; I29-W52 HydrophobicContact CG2-CH2 3.91Å; I29-W52 HydrophobicContact CG2-CZ3 3.35Å; I29-I55 HydrophobicContact CD1-CG2 3.74Å; I29-L57 HydrophobicContact CD1-CD2 3.3Å
30	V	82.8	Confident	89.1	Confident	53 Å²	53	73 Å²	73	32%	0.321	36%	0.36	S	S	.	.	H	α-helix	trans	-69	-45.6	179.5	176.8	0	0	0	0	109.4	D28 L32 C33 R34 F60	D28-V30 VanDerWaalsContact C-N 3.3Å; D28-V30 PolarHBondContact O-N 3.22Å; D28-V30 WeakPolarHBondContact OD1-CA 3.47Å; D28-V30 VanDerWaalsContact OD1-CB 3.29Å; D28-V30 WeakPolarHBondContact OD1-CB 3.14Å; D28-V30 PolarHBondContact OD1-N 2.96Å; V30-L32 VanDerWaalsContact C-N 3.33Å; V30-L32 PolarHBondContact O-N 3.29Å; V30-C33 WeakPolarHBondContact O-CB 3.42Å; V30-C33 PolarHBondContact O-N 2.99Å; V30-R34 WeakPolarHBondContact O-CG 3.42Å; V30-R34 PolarHBondContact O-N 3.46Å; V30-F60 HydrophobicContact CG2-CE1 4.14Å; V30-F60 HydrophobicContact CG2-CE2 4.29Å; V30-F60 HydrophobicContact CG2-CZ 3.49Å; V30-F60 VanDerWaalsContact CG2-CZ 3.49Å
31	T	89.2	Confident	89	Confident	38 Å²	38	74.4 Å²	74.4	23%	0.233	37%	0.373	C	S	.	.	H	α-helix	trans	-63.1	-40.9	176.4	-58.9	0	0	0	0	110.9	L27 D28 C33 R34 C35	L27-T31 HydrophobicContact CB-CG2 4.25Å; L27-T31 HydrophobicContact CD1-CG2 4.19Å; L27-T31 HydrophobicContact CD2-CG2 4.06Å; L27-T31 HydrophobicContact CG-CG2 4.39Å; D28-T31 VanDerWaalsContact CG-OG1 3.3Å; D28-T31 PolarHBondContact O-N 2.84Å; D28-T31 PolarHBondContact OD1-N 2.96Å; D28-T31 PolarHBondContact OD1-OG1 2.82Å; D28-T31 WeakPolarHBondContact OD2-CB 3.41Å; D28-T31 PolarHBondContact OD2-OG1 2.94Å; T31-C33 VanDerWaalsContact C-N 3.35Å; T31-C33 PolarHBondContact O-N 2.95Å; T31-R34 CarbonylContact O-C 3.58Å; T31-R34 WeakPolarHBondContact O-CA 3.5Å; T31-R34 WeakPolarHBondContact O-CB 3.36Å; T31-R34 PolarHBondContact O-N 3.22Å; T31-R34 VanDerWaalsContact O-N 3.09Å; T31-C35 PolarHBondContact O-N 3.25Å; T31-C35 PolarHBondContact O-SG 2.81Å
32	L	88.9	Confident	89.1	Confident	5 Å²	5	75.3 Å²	75.3	3%	0.026	38%	0.375	C	S	.	.	H	α-helix	trans	-60.2	-43.3	174.4	-134.1	81.1	0	0	0	112.1	F24 L27 D28 I29 V30 R34 C35 A36 A46 N51 W52	F24-L32 HydrophobicContact CB-CD1 4.05Å; F24-L32 HydrophobicContact CG-CD1 4.46Å; F24-L32 VanDerWaalsContact O-CD1 3.28Å; F24-L32 WeakPolarHBondContact O-CD1 3.5Å; L27-L32 HydrophobicContact CB-CD1 3.66Å; L27-L32 HydrophobicContact CD1-CD1 4.19Å; L27-L32 HydrophobicContact CG-CD1 4.44Å; D28-L32 WeakPolarHBondContact O-CB 3.4Å; D28-L32 PolarHBondContact O-N 3.26Å; I29-L32 PolarHBondContact O-N 2.89Å; V30-L32 VanDerWaalsContact C-N 3.33Å; V30-L32 PolarHBondContact O-N 3.29Å; L32-R34 VanDerWaalsContact C-N 3.29Å; L32-R34 PolarHBondContact O-N 2.78Å; L32-C35 WeakPolarHBondContact O-CB 3.47Å; L32-C35 PolarHBondContact O-N 3.04Å; L32-A36 PolarHBondContact O-N 2.69Å; L32-A46 VanDerWaalsContact CD2-O 3.25Å; L32-A46 WeakPolarHBondContact CD2-O 3.36Å; L32-A46 HydrophobicContact CG-CB 4.41Å; L32-A46 WeakPolarHBondContact O-CB 3.29Å; L32-N51 HydrophobicContact CD2-CB 3.62Å; L32-W52 HydrophobicContact CB-CZ2 4.5Å; L32-W52 HydrophobicContact CD2-CD2 4.3Å; L32-W52 HydrophobicContact CD2-CH2 4.25Å; L32-W52 HydrophobicContact CD2-CZ2 3.61Å; L32-W52 HydrophobicContact CG-CZ2 4.5Å
33	C	85.4	Confident	89.1	Confident	59 Å²	59	70.3 Å²	70.3	40%	0.399	36%	0.361	S	S	.	.	H	α-helix	trans	-63.5	-33	174.5	-76.3	0	0	0	0	112.7	I29 V30 T31 Q37	I29-C33 WeakPolarHBondContact O-CB 3.42Å; I29-C33 PolarHBondContact O-N 3.47Å; I29-C33 PolarHBondContact O-SG 2.92Å; V30-C33 WeakPolarHBondContact O-CB 3.42Å; V30-C33 PolarHBondContact O-N 2.99Å; T31-C33 VanDerWaalsContact C-N 3.35Å; T31-C33 PolarHBondContact O-N 2.95Å; C33-Q37 PolarHBondContact O-NE2 3.22Å
34	R	92.1	Very high	88.8	Confident	156 Å²	156	72.1 Å²	72.1	59%	0.589	37%	0.37	S	S	*	.	H	α-helix	trans	-70.7	-43.4	171.9	-68	172.9	-177.8	165.6	0.6	111.2	V30 T31 L32 A36 Q37	V30-R34 WeakPolarHBondContact O-CG 3.42Å; V30-R34 PolarHBondContact O-N 3.46Å; T31-R34 CarbonylContact O-C 3.58Å; T31-R34 WeakPolarHBondContact O-CA 3.5Å; T31-R34 WeakPolarHBondContact O-CB 3.36Å; T31-R34 PolarHBondContact O-N 3.22Å; T31-R34 VanDerWaalsContact O-N 3.09Å; L32-R34 VanDerWaalsContact C-N 3.29Å; L32-R34 PolarHBondContact O-N 2.78Å; R34-A36 PolarHBondContact O-N 3.28Å; R34-Q37 WeakPolarHBondContact O-CB 3.46Å; R34-Q37 PolarHBondContact O-N 3.08Å
35	C	92.8	Very high	88.8	Confident	12 Å²	12	72.6 Å²	72.6	8%	0.081	37%	0.373	C	S	.	.	H	α-helix	trans	-56.2	-37.6	174.4	-66.9	0	0	0	0	111.8	F24 T31 L32 Q37 I38 W42 A46	F24-C35 HydrophobicContact CE2-CB 4.29Å; F24-C35 HydrophobicContact CZ-CB 4.12Å; T31-C35 PolarHBondContact O-N 3.25Å; T31-C35 PolarHBondContact O-SG 2.81Å; L32-C35 WeakPolarHBondContact O-CB 3.47Å; L32-C35 PolarHBondContact O-N 3.04Å; C35-Q37 PolarHBondContact O-N 3.48Å; C35-Q37 VanDerWaalsContact O-N 3.09Å; C35-I38 WeakPolarHBondContact O-CB 3.22Å; C35-I38 WeakPolarHBondContact O-CG1 3.46Å; C35-I38 PolarHBondContact O-N 3.23Å; C35-I38 VanDerWaalsContact O-N 3.14Å; C35-W42 HydrophobicContact CB-CE3 3.85Å; C35-W42 HydrophobicContact CB-CZ3 4.18Å; C35-W42 WeakPolarHBondContact O-CB 3.25Å; C35-A46 HydrophobicContact CB-CB 4.07Å
36	A	90.1	Very high	88.9	Confident	12 Å²	12	69.2 Å²	69.2	10%	0.099	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-16.4	177.7	0	0	0	0	0	114	L32 R34 N43 A46 L47	L32-A36 PolarHBondContact O-N 2.69Å; R34-A36 PolarHBondContact O-N 3.28Å; A36-N43 WeakPolarHBondContact O-CB 3.43Å; A36-N43 PolarHBondContact O-ND2 2.8Å; A36-A46 HydrophobicContact CB-CB 3.82Å; A36-L47 HydrophobicContact CB-CD2 4.32Å; A36-L47 HydrophobicContact CB-CG 4.37Å
37	Q	91.2	Very high	88.7	Confident	158 Å²	158	64.1 Å²	64.1	74%	0.738	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.8	-4.5	-179.2	-61.8	168.5	53.3	0	0	113.1	C33 R34 C35	C33-Q37 PolarHBondContact O-NE2 3.22Å; R34-Q37 WeakPolarHBondContact O-CB 3.46Å; R34-Q37 PolarHBondContact O-N 3.08Å; C35-Q37 PolarHBondContact O-N 3.48Å; C35-Q37 VanDerWaalsContact O-N 3.09Å
38	I	93.4	Very high	88.7	Confident	114 Å²	114	63 Å²	63	59%	0.585	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-45.2	-172.1	-58.4	-58.3	0	0	0	112.8	C35 W42	C35-I38 WeakPolarHBondContact O-CB 3.22Å; C35-I38 WeakPolarHBondContact O-CG1 3.46Å; C35-I38 PolarHBondContact O-N 3.23Å; C35-I38 VanDerWaalsContact O-N 3.14Å; I38-W42 HydrophobicContact CB-CB 4.22Å; I38-W42 HydrophobicContact CB-CD2 4.33Å; I38-W42 HydrophobicContact CB-CE3 4.15Å; I38-W42 HydrophobicContact CB-CG 4.38Å; I38-W42 HydrophobicContact CG1-CE3 4.09Å; I38-W42 HydrophobicContact CG2-CD2 4.28Å; I38-W42 HydrophobicContact CG2-CE3 4.35Å; I38-W42 HydrophobicContact CG2-CG 4.43Å
39	S	92.9	Very high	88.6	Confident	49 Å²	49	59.6 Å²	59.6	34%	0.343	31%	0.308	S	S	.	.			trans	-160.8	169.1	-179.7	70	0	0	0	0	111.1	A41 W42 N43	S39-A41 VanDerWaalsContact C-N 3.33Å; S39-A41 PolarHBondContact O-N 2.99Å; S39-W42 PolarHBondContact O-N 3.21Å; S39-W42 WeakPolarHBondContact OG-CB 3.38Å; S39-W42 VanDerWaalsContact OG-CD1 3.31Å; S39-W42 PolarHBondContact OG-N 3.09Å; S39-N43 VanDerWaalsContact O-CB 3.22Å; S39-N43 WeakPolarHBondContact O-CB 3.47Å; S39-N43 PolarHBondContact O-N 3.41Å
40	K	89.4	Confident	88.7	Confident	187 Å²	187	60.1 Å²	60.1	81%	0.813	32%	0.315	S	S	*	.	H	α-helix	trans	-60.8	-41.1	174.8	-67.3	-177.7	-179.4	178.4	0	112.4	N43 I44	K40-N43 WeakPolarHBondContact O-CB 3.45Å; K40-N43 PolarHBondContact O-N 2.81Å; K40-I44 WeakPolarHBondContact O-CG1 3.34Å; K40-I44 PolarHBondContact O-N 3.47Å; K40-I44 VanDerWaalsContact O-N 3.14Å
41	A	91.8	Very high	88.9	Confident	37 Å²	37	58.6 Å²	58.6	31%	0.306	31%	0.305	S	S	.	.	H	α-helix	trans	-66.7	-46.3	177.7	0	0	0	0	0	111.3	S39 N43 I44 L45	S39-A41 VanDerWaalsContact C-N 3.33Å; S39-A41 PolarHBondContact O-N 2.99Å; A41-N43 VanDerWaalsContact C-N 3.29Å; A41-N43 PolarHBondContact O-N 2.95Å; A41-I44 PolarHBondContact O-N 3.43Å; A41-L45 WeakPolarHBondContact O-CG 3.28Å; A41-L45 PolarHBondContact O-N 2.7Å
42	W	93.6	Very high	88.8	Confident	45 Å²	45	57.6 Å²	57.6	17%	0.17	30%	0.297	C	S	.	.	H	α-helix	trans	-66.7	-31.4	176.8	-80.6	53.1	0	0	0	112.5	I11 N12 F24 C35 I38 S39 L45 A46	I11-W42 HydrophobicContact CD1-CZ2 4.19Å; I11-W42 HydrophobicContact CG2-CZ2 4.04Å; N12-W42 PolarHBondContact ND2-NE1 3.25Å; N12-W42 PolarHBondContact OD1-NE1 3.48Å; F24-W42 HydrophobicContact CE1-CE3 4.05Å; F24-W42 HydrophobicContact CE1-CH2 4.15Å; F24-W42 AromaticContact CE1-CZ3 3.84Å; F24-W42 HydrophobicContact CE1-CZ3 3.84Å; F24-W42 AromaticContact CZ-CD2 3.8Å; F24-W42 HydrophobicContact CZ-CD2 3.8Å; F24-W42 AromaticContact CZ-CE3 3.48Å; F24-W42 HydrophobicContact CZ-CE3 3.48Å; F24-W42 VanDerWaalsContact CZ-CE3 3.48Å; F24-W42 HydrophobicContact CZ-CG 4.36Å; F24-W42 HydrophobicContact CZ-CH2 4.36Å; F24-W42 AromaticContact CZ-CZ3 3.78Å; F24-W42 HydrophobicContact CZ-CZ3 3.78Å; C35-W42 HydrophobicContact CB-CE3 3.85Å; C35-W42 HydrophobicContact CB-CZ3 4.18Å; C35-W42 WeakPolarHBondContact O-CB 3.25Å; I38-W42 HydrophobicContact CB-CB 4.22Å; I38-W42 HydrophobicContact CB-CD2 4.33Å; I38-W42 HydrophobicContact CB-CE3 4.15Å; I38-W42 HydrophobicContact CB-CG 4.38Å; I38-W42 HydrophobicContact CG1-CE3 4.09Å; I38-W42 HydrophobicContact CG2-CD2 4.28Å; I38-W42 HydrophobicContact CG2-CE3 4.35Å; I38-W42 HydrophobicContact CG2-CG 4.43Å; S39-W42 PolarHBondContact O-N 3.21Å; S39-W42 WeakPolarHBondContact OG-CB 3.38Å; S39-W42 VanDerWaalsContact OG-CD1 3.31Å; S39-W42 PolarHBondContact OG-N 3.09Å; W42-L45 PolarHBondContact O-N 3.28Å; W42-A46 WeakPolarHBondContact O-CB 3.49Å; W42-A46 PolarHBondContact O-N 2.99Å
43	N	90.5	Very high	88.7	Confident	63 Å²	63	61.1 Å²	61.1	34%	0.337	31%	0.313	S	S	.	.	H	α-helix	trans	-59.1	-53.8	171.4	-174.2	-91.6	0	0	0	110.6	A36 S39 K40 A41 L45 A46 L47	A36-N43 WeakPolarHBondContact O-CB 3.43Å; A36-N43 PolarHBondContact O-ND2 2.8Å; S39-N43 VanDerWaalsContact O-CB 3.22Å; S39-N43 WeakPolarHBondContact O-CB 3.47Å; S39-N43 PolarHBondContact O-N 3.41Å; K40-N43 WeakPolarHBondContact O-CB 3.45Å; K40-N43 PolarHBondContact O-N 2.81Å; A41-N43 VanDerWaalsContact C-N 3.29Å; A41-N43 PolarHBondContact O-N 2.95Å; N43-L45 VanDerWaalsContact C-N 3.3Å; N43-L45 PolarHBondContact O-N 3.44Å; N43-A46 PolarHBondContact O-N 3.49Å; N43-L47 WeakPolarHBondContact O-CB 3.33Å; N43-L47 WeakPolarHBondContact O-CG 3.06Å; N43-L47 PolarHBondContact O-N 3.3Å; N43-L47 WeakPolarHBondContact OD1-CD1 3.5Å
44	I	88.4	Confident	88.8	Confident	110 Å²	110	66.5 Å²	66.5	56%	0.564	33%	0.325	S	S	*	.	H	α-helix	trans	-59	-43.1	177.9	-66	168.1	0	0	0	111.2	K40 A41 L47 D48	K40-I44 WeakPolarHBondContact O-CG1 3.34Å; K40-I44 PolarHBondContact O-N 3.47Å; K40-I44 VanDerWaalsContact O-N 3.14Å; A41-I44 PolarHBondContact O-N 3.43Å; I44-L47 CarbonylContact O-C 3.6Å; I44-L47 PolarHBondContact O-N 3.11Å; I44-D48 PolarHBondContact O-N 3.11Å
45	L	90.7	Very high	88.6	Confident	13 Å²	13	59.4 Å²	59.4	7%	0.068	30%	0.299	C	S	.	.	H	α-helix	trans	-65.2	-50.6	179	-71.9	168.3	0	0	0	112.2	K17 L20 L21 F24 A41 W42 N43 L47 D48 N51	K17-L45 HydrophobicContact CD-CD2 4.44Å; K17-L45 HydrophobicContact CG-CD2 3.62Å; L20-L45 HydrophobicContact CB-CD1 4.06Å; L20-L45 HydrophobicContact CB-CD2 4.32Å; L20-L45 HydrophobicContact CD1-CD1 3.73Å; L20-L45 HydrophobicContact CG-CD1 4.47Å; L21-L45 HydrophobicContact CD2-CD2 3.97Å; L21-L45 WeakPolarHBondContact CD2-O 3.47Å; L21-L45 HydrophobicContact CG-CD2 4.1Å; F24-L45 HydrophobicContact CD2-CB 3.95Å; F24-L45 HydrophobicContact CE2-CB 3.5Å; F24-L45 HydrophobicContact CZ-CB 4.31Å; A41-L45 WeakPolarHBondContact O-CG 3.28Å; A41-L45 PolarHBondContact O-N 2.7Å; W42-L45 PolarHBondContact O-N 3.28Å; N43-L45 VanDerWaalsContact C-N 3.3Å; N43-L45 PolarHBondContact O-N 3.44Å; L45-L47 PolarHBondContact O-N 3.46Å; L45-D48 VanDerWaalsContact O-CB 3.22Å; L45-D48 WeakPolarHBondContact O-CB 3.46Å; L45-D48 PolarHBondContact O-N 3.28Å; L45-D48 VanDerWaalsContact O-N 3.08Å; L45-N51 PolarHBondContact O-ND2 2.86Å
46	A	89.6	Confident	88.2	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-62.3	-31.7	-179.5	0	0	0	0	0	111	F24 L32 C35 A36 W42 N43 W52	F24-A46 HydrophobicContact CD2-CB 4.17Å; F24-A46 HydrophobicContact CE2-CB 3.85Å; F24-A46 VanDerWaalsContact CE2-N 3.35Å; L32-A46 VanDerWaalsContact CD2-O 3.25Å; L32-A46 WeakPolarHBondContact CD2-O 3.36Å; L32-A46 HydrophobicContact CG-CB 4.41Å; L32-A46 WeakPolarHBondContact O-CB 3.29Å; C35-A46 HydrophobicContact CB-CB 4.07Å; A36-A46 HydrophobicContact CB-CB 3.82Å; W42-A46 WeakPolarHBondContact O-CB 3.49Å; W42-A46 PolarHBondContact O-N 2.99Å; N43-A46 PolarHBondContact O-N 3.49Å; A46-W52 PolarHBondContact O-NE1 2.99Å
47	L	84.1	Confident	87.8	Confident	54 Å²	54	63.2 Å²	63.2	28%	0.283	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	2.1	179.5	-66.6	-169.7	0	0	0	113.9	A36 N43 I44 L45 G49 W52 R75	A36-L47 HydrophobicContact CB-CD2 4.32Å; A36-L47 HydrophobicContact CB-CG 4.37Å; N43-L47 WeakPolarHBondContact O-CB 3.33Å; N43-L47 WeakPolarHBondContact O-CG 3.06Å; N43-L47 PolarHBondContact O-N 3.3Å; N43-L47 WeakPolarHBondContact OD1-CD1 3.5Å; I44-L47 CarbonylContact O-C 3.6Å; I44-L47 PolarHBondContact O-N 3.11Å; L45-L47 PolarHBondContact O-N 3.46Å; L47-G49 PolarHBondContact O-N 3.37Å; L47-W52 HydrophobicContact CD2-CZ2 4.17Å; L47-R75 VanDerWaalsContact CA-NH2 3.32Å; L47-R75 PolarHBondContact O-NH2 2.83Å
48	D	86.1	Confident	87.4	Confident	38 Å²	38	59.5 Å²	59.5	20%	0.203	30%	0.299	C	S	.	.			trans	-66	130	176	-169.9	-73.2	0	0	0	110.4	K17 L21 I44 L45 S50 N51	K17-D48 IonicContact NZ-OD2 2.95Å; K17-D48 PolarHBondContact NZ-OD2 3.06Å; L21-D48 HydrophobicContact CD1-CB 4.48Å; L21-D48 HydrophobicContact CD2-CB 3.51Å; I44-D48 PolarHBondContact O-N 3.11Å; L45-D48 VanDerWaalsContact O-CB 3.22Å; L45-D48 WeakPolarHBondContact O-CB 3.46Å; L45-D48 PolarHBondContact O-N 3.28Å; L45-D48 VanDerWaalsContact O-N 3.08Å; D48-S50 PolarHBondContact O-N 3.07Å; D48-S50 WeakPolarHBondContact OD1-CB 3.47Å; D48-S50 PolarHBondContact OD1-N 3.03Å; D48-S50 VanDerWaalsContact OD1-N 3.07Å; D48-S50 PolarHBondContact OD1-OG 2.99Å; D48-N51 PolarHBondContact O-N 2.71Å
49	G	77.7	Confident	86.6	Confident	13 Å²	13	60.9 Å²	60.9	13%	0.134	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-58	-23	-173.3	0	0	0	0	0	114.4	L47 N51 W52	L47-G49 PolarHBondContact O-N 3.37Å; G49-N51 VanDerWaalsContact C-N 3.26Å; G49-N51 PolarHBondContact O-N 2.87Å; G49-W52 PolarHBondContact O-N 2.6Å; G49-W52 VanDerWaalsContact O-N 3.15Å
50	S	82.8	Confident	85.7	Confident	47 Å²	47	62 Å²	62	33%	0.329	31%	0.306	S	S	.	.	G	3₁₀ helix	trans	-60.9	-33.4	174.5	59.6	0	0	0	0	113.1	D48 W52	D48-S50 PolarHBondContact O-N 3.07Å; D48-S50 WeakPolarHBondContact OD1-CB 3.47Å; D48-S50 PolarHBondContact OD1-N 3.03Å; D48-S50 VanDerWaalsContact OD1-N 3.07Å; D48-S50 PolarHBondContact OD1-OG 2.99Å; S50-W52 VanDerWaalsContact C-N 3.27Å; S50-W52 PolarHBondContact O-N 3.45Å
51	N	86	Confident	84.9	Confident	20 Å²	20	56.1 Å²	56.1	11%	0.107	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-76.2	-15.3	178.3	-62.4	-39	0	0	0	113.3	L21 S25 L32 L45 D48 G49	L21-N51 WeakPolarHBondContact CD2-ND2 3.46Å; L21-N51 PolarHBondContact O-OD1 3.31Å; S25-N51 PolarHBondContact N-OD1 3.46Å; L32-N51 HydrophobicContact CD2-CB 3.62Å; L45-N51 PolarHBondContact O-ND2 2.86Å; D48-N51 PolarHBondContact O-N 2.71Å; G49-N51 VanDerWaalsContact C-N 3.26Å; G49-N51 PolarHBondContact O-N 2.87Å
52	W	86.9	Confident	84.1	Confident	17 Å²	17	59.7 Å²	59.7	6%	0.064	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-108.6	15.5	-176.8	-55.8	86.8	0	0	0	112.5	I29 L32 A46 L47 G49 S50 R54 I55 C76 L80	I29-W52 HydrophobicContact CG2-CE3 4.24Å; I29-W52 HydrophobicContact CG2-CH2 3.91Å; I29-W52 HydrophobicContact CG2-CZ3 3.35Å; L32-W52 HydrophobicContact CB-CZ2 4.5Å; L32-W52 HydrophobicContact CD2-CD2 4.3Å; L32-W52 HydrophobicContact CD2-CH2 4.25Å; L32-W52 HydrophobicContact CD2-CZ2 3.61Å; L32-W52 HydrophobicContact CG-CZ2 4.5Å; A46-W52 PolarHBondContact O-NE1 2.99Å; L47-W52 HydrophobicContact CD2-CZ2 4.17Å; G49-W52 PolarHBondContact O-N 2.6Å; G49-W52 VanDerWaalsContact O-N 3.15Å; S50-W52 VanDerWaalsContact C-N 3.27Å; S50-W52 PolarHBondContact O-N 3.45Å; W52-R54 VanDerWaalsContact C-N 3.25Å; W52-R54 PolarHBondContact O-N 3.42Å; W52-I55 HydrophobicContact CE3-CD1 4.06Å; W52-C76 HydrophobicContact CB-CB 4.4Å; W52-L80 WeakPolarHBondContact O-CD1 3.27Å
53	Q	87.4	Confident	83.4	Confident	79 Å²	79	63.1 Å²	63.1	37%	0.369	32%	0.321	S	S	.	.	S	Bend	trans	-67.8	-28.2	178	-72.3	-174.2	0.6	0	0	112.7	R81 K82	Q53-R81 PolarHBondContact O-N 2.87Å; Q53-K82 PolarHBondContact O-N 2.84Å
54	R	88.4	Confident	82.9	Confident	172 Å²	172	60.3 Å²	60.3	65%	0.649	31%	0.306	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.4	125.3	-178	-55.1	-175.2	-171.7	138	3.6	109.1	W52 K82	W52-R54 VanDerWaalsContact C-N 3.25Å; W52-R54 PolarHBondContact O-N 3.42Å; R54-K82 WeakPolarHBondContact CA-O 3.5Å; R54-K82 HydrophobicContact CB-CB 4.3Å; R54-K82 HydrophobicContact CG-CB 4Å; R54-K82 HydrophobicContact CG-CD 4.14Å; R54-K82 HydrophobicContact CG-CG 4.02Å
55	I	86.2	Confident	82.9	Confident	8 Å²	8	61.5 Å²	61.5	4%	0.041	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	128.6	178.7	-64.9	177.3	0	0	0	107.8	I29 W52 L57 I72 L80 K82 L83 S84	I29-I55 HydrophobicContact CD1-CG2 3.74Å; W52-I55 HydrophobicContact CE3-CD1 4.06Å; I55-L57 HydrophobicContact CG2-CD2 3.92Å; I55-L57 HydrophobicContact CG2-CG 4.09Å; I55-I72 HydrophobicContact CD1-CG2 3.45Å; I55-I72 VanDerWaalsContact CD1-CG2 3.45Å; I55-I72 HydrophobicContact CG2-CD1 4.42Å; I55-L80 HydrophobicContact CB-CD1 4.27Å; I55-L80 HydrophobicContact CD1-CD1 3.74Å; I55-L80 HydrophobicContact CG1-CD1 3.85Å; I55-K82 PolarHBondContact N-O 3.12Å; I55-L83 HydrophobicContact CB-CD1 3.86Å; I55-L83 HydrophobicContact CG2-CD1 3.77Å; I55-L83 CarbonylContact O-C 3.41Å; I55-L83 WeakPolarHBondContact O-CA 3.15Å; I55-S84 PolarHBondContact O-N 3.43Å
56	D	84.6	Confident	82.7	Confident	95 Å²	95	61.5 Å²	61.5	51%	0.508	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	120	172.8	-168.3	-2.9	0	0	0	109.7	F58 S84	D56-F58 WeakPolarHBondContact OD1-CB 3.47Å; D56-F58 PolarHBondContact OD1-N 3.15Å; D56-S84 VanDerWaalsContact OD1-CB 3.24Å; D56-S84 WeakPolarHBondContact OD1-CB 3.2Å; D56-S84 PolarHBondContact OD1-OG 3.42Å
57	L	82.8	Confident	82.7	Confident	8 Å²	8	67.9 Å²	67.9	4%	0.042	34%	0.337	C	S	.	.			trans	-100.8	15.3	-178.9	-58.8	-177	0	0	0	112.8	I29 I55 N59 F60 V64 I72 S84 L85	I29-L57 HydrophobicContact CD1-CD2 3.3Å; I55-L57 HydrophobicContact CG2-CD2 3.92Å; I55-L57 HydrophobicContact CG2-CG 4.09Å; L57-N59 PolarHBondContact O-N 3.16Å; L57-N59 VanDerWaalsContact O-N 3.1Å; L57-F60 HydrophobicContact CD2-CD2 4.4Å; L57-F60 PolarHBondContact O-N 3.07Å; L57-V64 HydrophobicContact CB-CG2 3.95Å; L57-V64 HydrophobicContact CD1-CG1 3.75Å; L57-V64 HydrophobicContact CD1-CG2 3.93Å; L57-V64 HydrophobicContact CG-CG2 4.43Å; L57-I72 HydrophobicContact CD1-CD1 3.85Å; L57-I72 HydrophobicContact CD2-CD1 4.31Å; L57-S84 PolarHBondContact N-O 3.3Å; L57-S84 VanDerWaalsContact N-O 3.08Å; L57-L85 HydrophobicContact CD1-CD2 3.6Å; L57-L85 HydrophobicContact CG-CD2 4.29Å
58	F	81.3	Confident	83	Confident	81 Å²	81	68 Å²	68	36%	0.355	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-52.3	-34.8	-176.9	-176.5	-97.3	0	0	0	114.6	D56 F60 Q61 R86	D56-F58 WeakPolarHBondContact OD1-CB 3.47Å; D56-F58 PolarHBondContact OD1-N 3.15Å; F58-F60 PolarHBondContact O-N 2.88Å; F58-Q61 VanDerWaalsContact O-CG 3.24Å; F58-Q61 WeakPolarHBondContact O-CG 3.3Å; F58-Q61 PolarHBondContact O-NE2 2.84Å; F58-R86 HydrophobicContact CD2-CB 4.28Å; F58-R86 HydrophobicContact CD2-CG 4.06Å; F58-R86 HydrophobicContact CE2-CG 4.25Å
59	N	78.1	Confident	83.3	Confident	142 Å²	142	66.2 Å²	66.2	76%	0.759	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-75.9	-7.3	179.5	-67.5	-26.9	0	0	0	113.9	L57	L57-N59 PolarHBondContact O-N 3.16Å; L57-N59 VanDerWaalsContact O-N 3.1Å
60	F	74.2	Confident	84	Confident	72 Å²	72	67.1 Å²	67.1	32%	0.316	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-121.3	18.2	-173.2	-51.9	-74.3	0	0	0	112.4	V30 L57 F58 T62 D63 V64	V30-F60 HydrophobicContact CG2-CE1 4.14Å; V30-F60 HydrophobicContact CG2-CE2 4.29Å; V30-F60 HydrophobicContact CG2-CZ 3.49Å; V30-F60 VanDerWaalsContact CG2-CZ 3.49Å; L57-F60 HydrophobicContact CD2-CD2 4.4Å; L57-F60 PolarHBondContact O-N 3.07Å; F58-F60 PolarHBondContact O-N 2.88Å; F60-T62 VanDerWaalsContact C-N 3.29Å; F60-T62 PolarHBondContact O-N 3.24Å; F60-D63 PolarHBondContact O-N 3.2Å; F60-V64 HydrophobicContact CB-CG2 3.53Å; F60-V64 WeakPolarHBondContact O-CG2 3.49Å; F60-V64 PolarHBondContact O-N 3.45Å
61	Q	72.9	Confident	84.2	Confident	64 Å²	64	68.7 Å²	68.7	30%	0.299	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-40.1	-49.4	-172.7	-79.9	166.9	40	0	0	115.4	F58 R86 G87 C88	F58-Q61 VanDerWaalsContact O-CG 3.24Å; F58-Q61 WeakPolarHBondContact O-CG 3.3Å; F58-Q61 PolarHBondContact O-NE2 2.84Å; Q61-R86 WeakPolarHBondContact CG-O 3.46Å; Q61-G87 WeakPolarHBondContact CB-O 3.36Å; Q61-C88 WeakPolarHBondContact O-CA 3.47Å
62	T	73.3	Confident	84.3	Confident	113 Å²	113	68.6 Å²	68.6	69%	0.693	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-25.2	-178.6	49.4	0	0	0	0	113.5	F60	F60-T62 VanDerWaalsContact C-N 3.29Å; F60-T62 PolarHBondContact O-N 3.24Å
63	D	78.6	Confident	84.5	Confident	116 Å²	116	67.8 Å²	67.8	62%	0.62	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.4	-12.4	-170	-53.4	-18.8	0	0	0	111.9	F60 E65	F60-D63 PolarHBondContact O-N 3.2Å; D63-E65 PolarHBondContact O-N 3.24Å; D63-E65 VanDerWaalsContact O-N 3.12Å
64	V	81.5	Confident	84.6	Confident	4 Å²	4	69.5 Å²	69.5	2%	0.024	34%	0.338	C	S	.	.			trans	-81.2	95.8	179.8	176.9	0	0	0	0	109.7	L57 F60 V68 V69 C88 V91	L57-V64 HydrophobicContact CB-CG2 3.95Å; L57-V64 HydrophobicContact CD1-CG1 3.75Å; L57-V64 HydrophobicContact CD1-CG2 3.93Å; L57-V64 HydrophobicContact CG-CG2 4.43Å; F60-V64 HydrophobicContact CB-CG2 3.53Å; F60-V64 WeakPolarHBondContact O-CG2 3.49Å; F60-V64 PolarHBondContact O-N 3.45Å; V64-V68 HydrophobicContact CG1-CB 4.41Å; V64-V69 HydrophobicContact CG1-CG2 4.05Å; V64-C88 HydrophobicContact CB-CB 4.23Å; V64-C88 HydrophobicContact CG1-CB 4.2Å; V64-V91 HydrophobicContact CG1-CG2 4.04Å
65	E	87.6	Confident	84.3	Confident	135 Å²	135	66.7 Å²	66.7	63%	0.631	33%	0.328	S	S	*	.			trans	-79.5	159.3	166.6	-63	-175.2	175	0	0	111.8	D63 R67 V68	D63-E65 PolarHBondContact O-N 3.24Å; D63-E65 VanDerWaalsContact O-N 3.12Å; E65-R67 PolarHBondContact O-N 2.95Å; E65-V68 WeakPolarHBondContact O-CB 3.41Å; E65-V68 PolarHBondContact O-N 3.03Å
66	G	87.4	Confident	84.3	Confident	14 Å²	14	66.6 Å²	66.6	14%	0.144	33%	0.328	C	S	.	.	H	α-helix	trans	-52.8	-31.3	177.1	0	0	0	0	0	114	V68 V69 E70 S95	G66-V68 VanDerWaalsContact C-N 3.3Å; G66-V68 PolarHBondContact O-N 3.32Å; G66-V69 WeakPolarHBondContact O-CB 3.44Å; G66-V69 PolarHBondContact O-N 3.38Å; G66-E70 WeakPolarHBondContact O-CG 3.16Å; G66-E70 PolarHBondContact O-N 2.9Å; G66-S95 VanDerWaalsContact CA-CB 3.41Å; G66-S95 WeakPolarHBondContact CA-OG 3.37Å; G66-S95 VanDerWaalsContact O-CB 3.31Å; G66-S95 WeakPolarHBondContact O-CB 3.49Å
67	R	89.8	Confident	84.4	Confident	133 Å²	133	62.7 Å²	62.7	50%	0.502	31%	0.31	S	S	.	.	H	α-helix	trans	-63.9	-33	178.3	-174.2	54.4	174.5	-166.2	-7.5	113.3	E65 E70 N71	E65-R67 PolarHBondContact O-N 2.95Å; R67-E70 WeakPolarHBondContact CD-OE2 3.15Å; R67-E70 IonicContact CZ-OE2 3.68Å; R67-E70 IonicContact NH1-OE2 2.75Å; R67-E70 PolarHBondContact NH1-OE2 3.23Å; R67-E70 PolarHBondContact O-N 3.19Å; R67-N71 WeakPolarHBondContact O-CB 3.34Å; R67-N71 PolarHBondContact O-N 2.99Å; R67-N71 PolarHBondContact O-ND2 3.02Å
68	V	89.3	Confident	84.6	Confident	58 Å²	58	64.1 Å²	64.1	35%	0.352	33%	0.326	S	S	.	.	H	α-helix	trans	-64	-46.2	176.2	178.4	0	0	0	0	109.5	V64 E65 G66 E70 N71 I72	V64-V68 HydrophobicContact CG1-CB 4.41Å; E65-V68 WeakPolarHBondContact O-CB 3.41Å; E65-V68 PolarHBondContact O-N 3.03Å; G66-V68 VanDerWaalsContact C-N 3.3Å; G66-V68 PolarHBondContact O-N 3.32Å; V68-E70 VanDerWaalsContact C-N 3.34Å; V68-E70 PolarHBondContact O-N 2.91Å; V68-N71 PolarHBondContact O-N 3.44Å; V68-I72 HydrophobicContact CG1-CD1 3.87Å; V68-I72 VanDerWaalsContact O-CG1 3.3Å; V68-I72 WeakPolarHBondContact O-CG1 3.46Å; V68-I72 PolarHBondContact O-N 3.41Å
69	V	91.8	Very high	85	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-61.9	-42	177.5	-177.7	0	0	0	0	111.3	V64 G66 I72 S73 L85 V91 F99	V64-V69 HydrophobicContact CG1-CG2 4.05Å; G66-V69 WeakPolarHBondContact O-CB 3.44Å; G66-V69 PolarHBondContact O-N 3.38Å; V69-I72 PolarHBondContact O-N 2.65Å; V69-S73 WeakPolarHBondContact O-CB 3.31Å; V69-S73 PolarHBondContact O-N 3.07Å; V69-L85 HydrophobicContact CG1-CD1 4.2Å; V69-L85 HydrophobicContact CG2-CD1 4.06Å; V69-L85 HydrophobicContact CG2-CD2 3.92Å; V69-V91 HydrophobicContact CG2-CG1 4.33Å; V69-V91 HydrophobicContact CG2-CG2 3.71Å; V69-F99 HydrophobicContact CG1-CB 4.03Å; V69-F99 HydrophobicContact CG1-CD2 4.35Å; V69-F99 HydrophobicContact CG1-CG 4.35Å
70	E	92.6	Very high	85.7	Confident	31 Å²	31	59.5 Å²	59.5	15%	0.145	30%	0.299	C	S	.	.	H	α-helix	trans	-60.6	-46	174.8	-69.9	175.9	-164.4	0	0	112.3	G66 R67 V68 S73 K74 T98	G66-E70 WeakPolarHBondContact O-CG 3.16Å; G66-E70 PolarHBondContact O-N 2.9Å; R67-E70 WeakPolarHBondContact CD-OE2 3.15Å; R67-E70 IonicContact CZ-OE2 3.68Å; R67-E70 IonicContact NH1-OE2 2.75Å; R67-E70 PolarHBondContact NH1-OE2 3.23Å; R67-E70 PolarHBondContact O-N 3.19Å; V68-E70 VanDerWaalsContact C-N 3.34Å; V68-E70 PolarHBondContact O-N 2.91Å; E70-S73 WeakPolarHBondContact O-CB 3.39Å; E70-S73 PolarHBondContact O-N 2.84Å; E70-S73 PolarHBondContact O-OG 3.43Å; E70-K74 WeakPolarHBondContact O-CG 3.35Å; E70-K74 PolarHBondContact O-N 3.35Å; E70-T98 HydrophobicContact CB-CG2 4.3Å; E70-T98 HydrophobicContact CG-CG2 3.96Å
71	N	88.4	Confident	86.7	Confident	80 Å²	80	59.6 Å²	59.6	43%	0.428	30%	0.298	S	S	.	.	H	α-helix	trans	-64.3	-43.9	179.5	-75.4	-19.9	0	0	0	111.4	R67 V68 S73 K74 R75	R67-N71 WeakPolarHBondContact O-CB 3.34Å; R67-N71 PolarHBondContact O-N 2.99Å; R67-N71 PolarHBondContact O-ND2 3.02Å; V68-N71 PolarHBondContact O-N 3.44Å; N71-S73 VanDerWaalsContact C-N 3.26Å; N71-S73 PolarHBondContact O-N 3.21Å; N71-K74 PolarHBondContact O-N 2.97Å; N71-R75 VanDerWaalsContact O-CB 3.27Å; N71-R75 WeakPolarHBondContact O-CB 3.24Å; N71-R75 PolarHBondContact O-N 3.04Å
72	I	87.7	Confident	87.8	Confident	19 Å²	19	60.5 Å²	60.5	10%	0.097	30%	0.301	C	S	.	.	H	α-helix	trans	-56.7	-44.5	172.9	-70.8	167.9	0	0	0	109.9	I55 L57 V68 V69 K74 R75 C76 L80	I55-I72 HydrophobicContact CD1-CG2 3.45Å; I55-I72 VanDerWaalsContact CD1-CG2 3.45Å; I55-I72 HydrophobicContact CG2-CD1 4.42Å; L57-I72 HydrophobicContact CD1-CD1 3.85Å; L57-I72 HydrophobicContact CD2-CD1 4.31Å; V68-I72 HydrophobicContact CG1-CD1 3.87Å; V68-I72 VanDerWaalsContact O-CG1 3.3Å; V68-I72 WeakPolarHBondContact O-CG1 3.46Å; V68-I72 PolarHBondContact O-N 3.41Å; V69-I72 PolarHBondContact O-N 2.65Å; I72-K74 PolarHBondContact O-N 3.31Å; I72-R75 PolarHBondContact O-N 2.97Å; I72-C76 WeakPolarHBondContact O-CB 3.39Å; I72-C76 PolarHBondContact O-N 3.12Å; I72-C76 PolarHBondContact O-SG 2.82Å; I72-L80 HydrophobicContact CG2-CD2 4.25Å
73	S	91.6	Very high	88.9	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-63.3	-42	-178.5	81.3	0	0	0	0	113.1	V69 E70 N71 R75 G77 N102 C103	V69-S73 WeakPolarHBondContact O-CB 3.31Å; V69-S73 PolarHBondContact O-N 3.07Å; E70-S73 WeakPolarHBondContact O-CB 3.39Å; E70-S73 PolarHBondContact O-N 2.84Å; E70-S73 PolarHBondContact O-OG 3.43Å; N71-S73 VanDerWaalsContact C-N 3.26Å; N71-S73 PolarHBondContact O-N 3.21Å; S73-R75 VanDerWaalsContact C-N 3.32Å; S73-G77 WeakPolarHBondContact O-CA 3.35Å; S73-G77 PolarHBondContact O-N 2.97Å; S73-N102 PolarHBondContact OG-ND2 3.32Å; S73-C103 VanDerWaalsContact CA-SG 3.6Å
74	K	87.9	Confident	89.7	Confident	115 Å²	115	50.5 Å²	50.5	50%	0.5	24%	0.244	S	C	.	.	H	α-helix	trans	-68.2	-36.9	177.2	-69.2	169.7	-174.9	169.1	0	111.2	E70 N71 I72	E70-K74 WeakPolarHBondContact O-CG 3.35Å; E70-K74 PolarHBondContact O-N 3.35Å; N71-K74 PolarHBondContact O-N 2.97Å; I72-K74 PolarHBondContact O-N 3.31Å
75	R	83.9	Confident	90.3	Very high	113 Å²	113	50.3 Å²	50.3	43%	0.426	24%	0.243	S	C	.	.	H	α-helix	trans	-75.1	-46.6	-176.3	178.8	60	-166.5	93.6	4.6	112.7	L47 N71 I72 S73	L47-R75 VanDerWaalsContact CA-NH2 3.32Å; L47-R75 PolarHBondContact O-NH2 2.83Å; N71-R75 VanDerWaalsContact O-CB 3.27Å; N71-R75 WeakPolarHBondContact O-CB 3.24Å; N71-R75 PolarHBondContact O-N 3.04Å; I72-R75 PolarHBondContact O-N 2.97Å; S73-R75 VanDerWaalsContact C-N 3.32Å
76	C	85.1	Confident	90.5	Very high	6 Å²	6	49.6 Å²	49.6	4%	0.041	24%	0.235	C	C	.	.	H	α-helix	trans	-87.6	-38.9	-174.9	-50.8	0	0	0	0	111.2	W52 I72 G78 F79 L80	W52-C76 HydrophobicContact CB-CB 4.4Å; I72-C76 WeakPolarHBondContact O-CB 3.39Å; I72-C76 PolarHBondContact O-N 3.12Å; I72-C76 PolarHBondContact O-SG 2.82Å; C76-G78 PolarHBondContact O-N 3.29Å; C76-F79 PolarHBondContact O-N 2.93Å; C76-F79 VanDerWaalsContact O-N 3.07Å; C76-L80 HydrophobicContact CB-CB 3.91Å; C76-L80 HydrophobicContact CB-CD2 4.41Å
77	G	87.4	Confident	90.6	Very high	13 Å²	13	49.7 Å²	49.7	13%	0.134	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	47.1	-122.3	177.8	0	0	0	0	0	112.8	S73 F79 L80 N102	S73-G77 WeakPolarHBondContact O-CA 3.35Å; S73-G77 PolarHBondContact O-N 2.97Å; G77-F79 PolarHBondContact O-N 3.38Å; G77-F79 VanDerWaalsContact O-N 3.16Å; G77-L80 PolarHBondContact O-N 2.86Å; G77-N102 CarbonylContact C-O 3.5Å; G77-N102 WeakPolarHBondContact CA-O 3.34Å
78	G	87.3	Confident	90.6	Very high	37 Å²	37	43.4 Å²	43.4	38%	0.381	21%	0.212	S	C	.	.	G	3₁₀ helix	trans	-67.7	-9.2	-176.5	0	0	0	0	0	116.3	C76 N105	C76-G78 PolarHBondContact O-N 3.29Å; G78-N105 WeakPolarHBondContact O-CB 3.46Å; G78-N105 PolarHBondContact O-ND2 2.89Å
79	F	89.3	Confident	90.6	Very high	126 Å²	126	44.8 Å²	44.8	55%	0.553	22%	0.217	S	C	*	.	G	3₁₀ helix	trans	-87	-22.3	178.7	-68.4	-77.7	0	0	0	113.4	C76 G77 R81	C76-F79 PolarHBondContact O-N 2.93Å; C76-F79 VanDerWaalsContact O-N 3.07Å; G77-F79 PolarHBondContact O-N 3.38Å; G77-F79 VanDerWaalsContact O-N 3.16Å; F79-R81 PolarHBondContact O-N 3.05Å
80	L	92.3	Very high	90.4	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.232	C	C	.	.			trans	-71.1	120.7	-175.7	-169.8	60.8	0	0	0	110.4	W52 I55 I72 C76 G77 K82 L83 F99 N105 I106	W52-L80 WeakPolarHBondContact O-CD1 3.27Å; I55-L80 HydrophobicContact CB-CD1 4.27Å; I55-L80 HydrophobicContact CD1-CD1 3.74Å; I55-L80 HydrophobicContact CG1-CD1 3.85Å; I72-L80 HydrophobicContact CG2-CD2 4.25Å; C76-L80 HydrophobicContact CB-CB 3.91Å; C76-L80 HydrophobicContact CB-CD2 4.41Å; G77-L80 PolarHBondContact O-N 2.86Å; L80-K82 WeakPolarHBondContact CD1-O 3.24Å; L80-L83 HydrophobicContact CD2-CB 4.34Å; L80-F99 HydrophobicContact CD2-CE2 3.66Å; L80-F99 HydrophobicContact CD2-CZ 4.48Å; L80-N105 CarbonylContact O-C 3.54Å; L80-I106 HydrophobicContact CG-CD1 4.21Å
81	R	95.6	Very high	90.4	Very high	75 Å²	75	44.9 Å²	44.9	28%	0.283	23%	0.225	S	C	.	.			trans	-110.9	-32.7	-179.7	-61	-55.8	-174.1	146.8	0.6	112.4	Q53 F79 N105 I106 E107 H108	Q53-R81 PolarHBondContact O-N 2.87Å; F79-R81 PolarHBondContact O-N 3.05Å; R81-N105 WeakPolarHBondContact CD-O 3.43Å; R81-N105 PolarHBondContact NH1-O 3.34Å; R81-I106 WeakPolarHBondContact O-CD1 3.29Å; R81-E107 IonicContact CZ-OE1 3.83Å; R81-E107 IonicContact NE-OE1 2.83Å; R81-E107 IonicContact NH1-OE1 3.93Å; R81-E107 PolarHBondContact NH1-OE1 3.31Å; R81-E107 PolarHBondContact O-N 2.79Å; R81-H108 PolarHBondContact O-N 2.9Å
82	K	96.3	Very high	90.7	Very high	82 Å²	82	41.7 Å²	41.7	36%	0.357	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	128.4	179.1	-47.2	-163.2	175.8	-174.2	0	111	Q53 R54 I55 L80 H108	Q53-K82 PolarHBondContact O-N 2.84Å; R54-K82 WeakPolarHBondContact CA-O 3.5Å; R54-K82 HydrophobicContact CB-CB 4.3Å; R54-K82 HydrophobicContact CG-CB 4Å; R54-K82 HydrophobicContact CG-CD 4.14Å; R54-K82 HydrophobicContact CG-CG 4.02Å; I55-K82 PolarHBondContact N-O 3.12Å; L80-K82 WeakPolarHBondContact CD1-O 3.24Å; K82-H108 CarbonylContact C-O 3.59Å; K82-H108 VanDerWaalsContact CA-O 3.31Å; K82-H108 WeakPolarHBondContact CA-O 3.5Å; K82-H108 HydrophobicContact CB-CB 3.95Å; K82-H108 HydrophobicContact CD-CB 4.04Å; K82-H108 HydrophobicContact CG-CB 3.74Å
83	L	95.6	Very high	91.2	Very high	2 Å²	2	42.4 Å²	42.4	1%	0.01	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	128.1	173.2	178.5	64	0	0	0	109.5	I55 L80 L85 F99 I106 H108 L109 N110	I55-L83 HydrophobicContact CB-CD1 3.86Å; I55-L83 HydrophobicContact CG2-CD1 3.77Å; I55-L83 CarbonylContact O-C 3.41Å; I55-L83 WeakPolarHBondContact O-CA 3.15Å; L80-L83 HydrophobicContact CD2-CB 4.34Å; L83-L85 HydrophobicContact CD1-CD2 3.92Å; L83-L85 HydrophobicContact CD1-CG 4.39Å; L83-L85 HydrophobicContact CD2-CD1 4.01Å; L83-L85 HydrophobicContact CD2-CD2 4.06Å; L83-L85 HydrophobicContact CD2-CG 3.96Å; L83-L85 HydrophobicContact CG-CD2 4.02Å; L83-L85 HydrophobicContact CG-CG 3.94Å; L83-F99 HydrophobicContact CB-CE2 4.44Å; L83-F99 HydrophobicContact CB-CZ 4.34Å; L83-F99 HydrophobicContact CD2-CD2 3.86Å; L83-F99 HydrophobicContact CD2-CE1 4.42Å; L83-F99 HydrophobicContact CD2-CE2 3.31Å; L83-F99 HydrophobicContact CD2-CZ 3.65Å; L83-F99 HydrophobicContact CG-CE2 4.48Å; L83-I106 HydrophobicContact CB-CD1 4.07Å; L83-H108 PolarHBondContact N-O 2.76Å; L83-L109 HydrophobicContact CB-CD1 4Å; L83-L109 HydrophobicContact CD2-CD1 4.09Å; L83-L109 HydrophobicContact CG-CD1 4.25Å; L83-L109 WeakPolarHBondContact O-CA 3.18Å; L83-N110 PolarHBondContact O-N 3.31Å
84	S	95.1	Very high	91.5	Very high	18 Å²	18	46.6 Å²	46.6	13%	0.126	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	120.3	168.9	167.8	0	0	0	0	109.9	I55 D56 L57	I55-S84 PolarHBondContact O-N 3.43Å; D56-S84 VanDerWaalsContact OD1-CB 3.24Å; D56-S84 WeakPolarHBondContact OD1-CB 3.2Å; D56-S84 PolarHBondContact OD1-OG 3.42Å; L57-S84 PolarHBondContact N-O 3.3Å; L57-S84 VanDerWaalsContact N-O 3.08Å
85	L	94.5	Very high	91.9	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.223	C	C	.	.			trans	-114.7	25.3	172.8	-57.8	-178.9	0	0	0	110.4	L57 V69 L83 G87 C88 V91 L96 N110 L111 C114	L57-L85 HydrophobicContact CD1-CD2 3.6Å; L57-L85 HydrophobicContact CG-CD2 4.29Å; V69-L85 HydrophobicContact CG1-CD1 4.2Å; V69-L85 HydrophobicContact CG2-CD1 4.06Å; V69-L85 HydrophobicContact CG2-CD2 3.92Å; L83-L85 HydrophobicContact CD1-CD2 3.92Å; L83-L85 HydrophobicContact CD1-CG 4.39Å; L83-L85 HydrophobicContact CD2-CD1 4.01Å; L83-L85 HydrophobicContact CD2-CD2 4.06Å; L83-L85 HydrophobicContact CD2-CG 3.96Å; L83-L85 HydrophobicContact CG-CD2 4.02Å; L83-L85 HydrophobicContact CG-CG 3.94Å; L85-G87 PolarHBondContact O-N 3.28Å; L85-C88 HydrophobicContact CB-CB 4.13Å; L85-C88 WeakPolarHBondContact O-CB 3.22Å; L85-C88 PolarHBondContact O-N 3.1Å; L85-C88 PolarHBondContact O-SG 3.08Å; L85-C88 VanDerWaalsContact O-SG 3.34Å; L85-V91 HydrophobicContact CD1-CG1 4.09Å; L85-V91 HydrophobicContact CD1-CG2 4.44Å; L85-L96 HydrophobicContact CD1-CD2 3.89Å; L85-N110 PolarHBondContact N-O 3.25Å; L85-L111 HydrophobicContact CB-CD2 4.26Å; L85-L111 HydrophobicContact CD1-CD2 3.85Å; L85-L111 HydrophobicContact CG-CD2 4.41Å; L85-C114 PolarHBondContact O-SG 2.9Å
86	R	92.7	Very high	92.5	Very high	120 Å²	120	36.1 Å²	36.1	45%	0.453	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53	128.2	-178.9	175.9	174.3	-178.5	-165.9	1.2	110.3	F58 Q61 C88 N112	F58-R86 HydrophobicContact CD2-CB 4.28Å; F58-R86 HydrophobicContact CD2-CG 4.06Å; F58-R86 HydrophobicContact CE2-CG 4.25Å; Q61-R86 WeakPolarHBondContact CG-O 3.46Å; R86-C88 PolarHBondContact O-N 3.41Å; R86-N112 CarbonylContact C-O 3.57Å; R86-N112 VanDerWaalsContact CA-O 3.3Å; R86-N112 WeakPolarHBondContact CA-O 3.5Å; R86-N112 HydrophobicContact CB-CB 4.32Å; R86-N112 HydrophobicContact CG-CB 4Å
87	G	88.6	Confident	93.2	Very high	16 Å²	16	40.7 Å²	40.7	17%	0.165	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.2	4.2	-179.3	0	0	0	0	0	115.1	Q61 L85 I89 N112	Q61-G87 WeakPolarHBondContact CB-O 3.36Å; L85-G87 PolarHBondContact O-N 3.28Å; G87-I89 VanDerWaalsContact C-N 3.28Å; G87-I89 PolarHBondContact O-N 3.2Å; G87-N112 PolarHBondContact N-O 2.9Å
88	C	90.1	Very high	93.7	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.225	C	C	.	.			trans	-78.4	75.2	-180	-60.4	0	0	0	0	111	Q61 V64 L85 R86 G90 V91 C114	Q61-C88 WeakPolarHBondContact O-CA 3.47Å; V64-C88 HydrophobicContact CB-CB 4.23Å; V64-C88 HydrophobicContact CG1-CB 4.2Å; L85-C88 HydrophobicContact CB-CB 4.13Å; L85-C88 WeakPolarHBondContact O-CB 3.22Å; L85-C88 PolarHBondContact O-N 3.1Å; L85-C88 PolarHBondContact O-SG 3.08Å; L85-C88 VanDerWaalsContact O-SG 3.34Å; R86-C88 PolarHBondContact O-N 3.41Å; C88-G90 PolarHBondContact O-N 3.01Å; C88-V91 HydrophobicContact CB-CG2 3.8Å; C88-V91 WeakPolarHBondContact O-CB 3.31Å; C88-V91 PolarHBondContact O-N 3.44Å; C88-V91 VanDerWaalsContact O-N 3.16Å; C88-C114 PolarHBondContact O-SG 3.13Å
89	I	88.8	Confident	94.2	Very high	88 Å²	88	39.8 Å²	39.8	45%	0.451	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-19.3	-176.5	59.9	171.2	0	0	0	114	G87 V91 K116	G87-I89 VanDerWaalsContact C-N 3.28Å; G87-I89 PolarHBondContact O-N 3.2Å; I89-V91 VanDerWaalsContact C-N 3.28Å; I89-V91 PolarHBondContact O-N 3.43Å; I89-K116 WeakPolarHBondContact O-CD 3.4Å
90	G	88.2	Confident	94.6	Very high	32 Å²	32	33.8 Å²	33.8	33%	0.33	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-16.5	177.1	0	0	0	0	0	113.9	C88	C88-G90 PolarHBondContact O-N 3.01Å
91	V	92.4	Very high	94.8	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.196	C	C	.	.			trans	-83.7	128.1	-176.7	-178.9	0	0	0	0	110.2	V64 V69 L85 C88 I89 L96	V64-V91 HydrophobicContact CG1-CG2 4.04Å; V69-V91 HydrophobicContact CG2-CG1 4.33Å; V69-V91 HydrophobicContact CG2-CG2 3.71Å; L85-V91 HydrophobicContact CD1-CG1 4.09Å; L85-V91 HydrophobicContact CD1-CG2 4.44Å; C88-V91 HydrophobicContact CB-CG2 3.8Å; C88-V91 WeakPolarHBondContact O-CB 3.31Å; C88-V91 PolarHBondContact O-N 3.44Å; C88-V91 VanDerWaalsContact O-N 3.16Å; I89-V91 VanDerWaalsContact C-N 3.28Å; I89-V91 PolarHBondContact O-N 3.43Å; V91-L96 HydrophobicContact CG1-CD1 3.99Å; V91-L96 HydrophobicContact CG1-CD2 4.21Å; V91-L96 HydrophobicContact CG1-CG 3.76Å
92	G	94.9	Very high	94.9	Very high	14 Å²	14	36.4 Å²	36.4	14%	0.144	20%	0.198	C	C	.	.	B	Isolated β-bridge	trans	-128.2	-173.5	176.4	0	0	0	0	0	113.1	S94 S95 L96	G92-S94 VanDerWaalsContact C-N 3.32Å; G92-S94 PolarHBondContact O-N 2.87Å; G92-S95 PolarHBondContact N-OG 3.45Å; G92-S95 PolarHBondContact O-N 2.76Å; G92-S95 PolarHBondContact O-OG 3.39Å; G92-L96 PolarHBondContact O-N 2.8Å
93	D	97.6	Very high	94.9	Very high	33 Å²	33	32.5 Å²	32.5	18%	0.176	18%	0.181	C	C	.	.	H	α-helix	trans	-59.2	-37.2	-172.4	-62.1	-37.7	0	0	0	114.1	S95 L96 K97 I117 T118 T121	D93-S95 PolarHBondContact O-N 3.16Å; D93-L96 PolarHBondContact O-N 3.39Å; D93-K97 VanDerWaalsContact O-CB 3.23Å; D93-K97 WeakPolarHBondContact O-CB 3.43Å; D93-K97 PolarHBondContact O-N 3.27Å; D93-I117 WeakPolarHBondContact OD1-CA 3.36Å; D93-T118 PolarHBondContact OD1-N 3.17Å; D93-T118 WeakPolarHBondContact OD2-CB 3.42Å; D93-T118 WeakPolarHBondContact OD2-CG2 3.28Å; D93-T118 PolarHBondContact OD2-OG1 2.81Å; D93-T121 WeakPolarHBondContact CA-OG1 3.47Å; D93-T121 WeakPolarHBondContact OD1-CB 3.13Å; D93-T121 PolarHBondContact OD1-N 3.3Å; D93-T121 PolarHBondContact OD1-OG1 3.35Å
94	S	97.3	Very high	94.9	Very high	88 Å²	88	39.5 Å²	39.5	62%	0.615	21%	0.208	S	C	*	.	H	α-helix	trans	-61.6	-47.1	-178.5	-173.9	0	0	0	0	112.2	G92 K97 T98	G92-S94 VanDerWaalsContact C-N 3.32Å; G92-S94 PolarHBondContact O-N 2.87Å; S94-K97 PolarHBondContact O-N 3.31Å; S94-T98 PolarHBondContact O-N 3.5Å; S94-T98 VanDerWaalsContact O-N 3.14Å; S94-T98 PolarHBondContact O-OG1 3.49Å
95	S	96.3	Very high	95	Very high	6 Å²	6	40.5 Å²	40.5	4%	0.042	21%	0.212	C	C	.	.	H	α-helix	trans	-65.8	-40.9	176.9	38.6	0	0	0	0	111.9	G66 G92 D93 T98 F99	G66-S95 VanDerWaalsContact CA-CB 3.41Å; G66-S95 WeakPolarHBondContact CA-OG 3.37Å; G66-S95 VanDerWaalsContact O-CB 3.31Å; G66-S95 WeakPolarHBondContact O-CB 3.49Å; G92-S95 PolarHBondContact N-OG 3.45Å; G92-S95 PolarHBondContact O-N 2.76Å; G92-S95 PolarHBondContact O-OG 3.39Å; D93-S95 PolarHBondContact O-N 3.16Å; S95-T98 PolarHBondContact O-N 3.14Å; S95-F99 WeakPolarHBondContact O-CB 3.39Å; S95-F99 PolarHBondContact O-N 2.7Å
96	L	97.8	Very high	95.2	Very high	2 Å²	2	40.5 Å²	40.5	1%	0.01	21%	0.212	C	C	.	.	H	α-helix	trans	-72.7	-30.4	179.9	-75.6	173.1	0	0	0	113	L85 V91 G92 D93 F99 A100 L111 I117 T121	L85-L96 HydrophobicContact CD1-CD2 3.89Å; V91-L96 HydrophobicContact CG1-CD1 3.99Å; V91-L96 HydrophobicContact CG1-CD2 4.21Å; V91-L96 HydrophobicContact CG1-CG 3.76Å; G92-L96 PolarHBondContact O-N 2.8Å; D93-L96 PolarHBondContact O-N 3.39Å; L96-F99 HydrophobicContact CD2-CD1 4.18Å; L96-F99 PolarHBondContact O-N 2.91Å; L96-A100 VanDerWaalsContact O-CB 3.29Å; L96-A100 WeakPolarHBondContact O-CB 3.49Å; L96-A100 PolarHBondContact O-N 3.41Å; L96-L111 HydrophobicContact CD1-CD1 4.13Å; L96-L111 HydrophobicContact CD1-CD2 3.98Å; L96-L111 HydrophobicContact CD2-CD2 3.93Å; L96-I117 HydrophobicContact CD1-CB 4.45Å; L96-I117 HydrophobicContact CD1-CG2 3.49Å; L96-I117 VanDerWaalsContact CD1-CG2 3.49Å; L96-T121 HydrophobicContact CB-CG2 3.97Å; L96-T121 HydrophobicContact CD1-CG2 3.62Å; L96-T121 HydrophobicContact CG-CG2 4.38Å
97	K	98.4	Very high	95.5	Very high	102 Å²	102	37.8 Å²	37.8	44%	0.443	20%	0.204	S	C	.	.	H	α-helix	trans	-63.4	-49.4	170.6	-179.6	174.6	-178.1	176.5	0	111.2	D93 S94 F99 A100 Q101	D93-K97 VanDerWaalsContact O-CB 3.23Å; D93-K97 WeakPolarHBondContact O-CB 3.43Å; D93-K97 PolarHBondContact O-N 3.27Å; S94-K97 PolarHBondContact O-N 3.31Å; K97-F99 VanDerWaalsContact C-N 3.29Å; K97-F99 PolarHBondContact O-N 2.95Å; K97-A100 PolarHBondContact O-N 3.11Å; K97-Q101 VanDerWaalsContact O-CG 3.28Å; K97-Q101 WeakPolarHBondContact O-CG 3.35Å; K97-Q101 PolarHBondContact O-N 3.08Å; K97-Q101 VanDerWaalsContact O-N 3.11Å
98	T	97.8	Very high	95.9	Very high	31 Å²	31	39.1 Å²	39.1	19%	0.19	21%	0.206	C	C	.	.	H	α-helix	trans	-60.2	-43.2	175.9	-59.4	0	0	0	0	110.8	E70 S94 S95 Q101 N102	E70-T98 HydrophobicContact CB-CG2 4.3Å; E70-T98 HydrophobicContact CG-CG2 3.96Å; S94-T98 PolarHBondContact O-N 3.5Å; S94-T98 VanDerWaalsContact O-N 3.14Å; S94-T98 PolarHBondContact O-OG1 3.49Å; S95-T98 PolarHBondContact O-N 3.14Å; T98-Q101 PolarHBondContact O-N 3.04Å; T98-N102 PolarHBondContact O-N 2.91Å; T98-N102 PolarHBondContact O-ND2 2.83Å
99	F	97.8	Very high	96.3	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-58.4	-51.7	175	162.9	-94.9	0	0	0	112.6	V69 L80 L83 S95 L96 K97 Q101 N102 C103 I106 L109	V69-F99 HydrophobicContact CG1-CB 4.03Å; V69-F99 HydrophobicContact CG1-CD2 4.35Å; V69-F99 HydrophobicContact CG1-CG 4.35Å; L80-F99 HydrophobicContact CD2-CE2 3.66Å; L80-F99 HydrophobicContact CD2-CZ 4.48Å; L83-F99 HydrophobicContact CB-CE2 4.44Å; L83-F99 HydrophobicContact CB-CZ 4.34Å; L83-F99 HydrophobicContact CD2-CD2 3.86Å; L83-F99 HydrophobicContact CD2-CE1 4.42Å; L83-F99 HydrophobicContact CD2-CE2 3.31Å; L83-F99 HydrophobicContact CD2-CZ 3.65Å; L83-F99 HydrophobicContact CG-CE2 4.48Å; S95-F99 WeakPolarHBondContact O-CB 3.39Å; S95-F99 PolarHBondContact O-N 2.7Å; L96-F99 HydrophobicContact CD2-CD1 4.18Å; L96-F99 PolarHBondContact O-N 2.91Å; K97-F99 VanDerWaalsContact C-N 3.29Å; K97-F99 PolarHBondContact O-N 2.95Å; F99-Q101 VanDerWaalsContact C-N 3.26Å; F99-Q101 PolarHBondContact O-N 2.84Å; F99-N102 PolarHBondContact O-N 3.11Å; F99-N102 VanDerWaalsContact O-N 3.12Å; F99-C103 HydrophobicContact CD2-CB 4.01Å; F99-C103 HydrophobicContact CE2-CB 3.65Å; F99-C103 HydrophobicContact CZ-CB 3.94Å; F99-C103 WeakPolarHBondContact O-CB 3.37Å; F99-C103 PolarHBondContact O-N 2.81Å; F99-I106 HydrophobicContact CZ-CB 4.37Å; F99-I106 HydrophobicContact CZ-CD1 3.93Å; F99-I106 HydrophobicContact CZ-CG1 4Å; F99-L109 HydrophobicContact CE1-CD1 3.89Å; F99-L109 HydrophobicContact CE1-CD2 4.22Å; F99-L109 HydrophobicContact CZ-CD1 3.98Å
100	A	98	Very high	96.8	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-58.9	-39.6	-177.8	0	0	0	0	0	111.6	L96 K97 N102 L125 F128	L96-A100 VanDerWaalsContact O-CB 3.29Å; L96-A100 WeakPolarHBondContact O-CB 3.49Å; L96-A100 PolarHBondContact O-N 3.41Å; K97-A100 PolarHBondContact O-N 3.11Å; A100-N102 VanDerWaalsContact C-N 3.34Å; A100-N102 PolarHBondContact O-N 3.44Å; A100-L125 HydrophobicContact CB-CD2 4.26Å; A100-F128 HydrophobicContact CB-CB 4.22Å; A100-F128 HydrophobicContact CB-CD2 4.09Å; A100-F128 WeakPolarHBondContact O-CB 3.34Å
101	Q	97.7	Very high	97.2	Very high	70 Å²	70	34.4 Å²	34.4	33%	0.327	17%	0.174	S	C	.	.	H	α-helix	trans	-62.4	-38.2	178.1	-72.4	172.6	-3.5	0	0	113.4	K97 T98 F99 R104 F128	K97-Q101 VanDerWaalsContact O-CG 3.28Å; K97-Q101 WeakPolarHBondContact O-CG 3.35Å; K97-Q101 PolarHBondContact O-N 3.08Å; K97-Q101 VanDerWaalsContact O-N 3.11Å; T98-Q101 PolarHBondContact O-N 3.04Å; F99-Q101 VanDerWaalsContact C-N 3.26Å; F99-Q101 PolarHBondContact O-N 2.84Å; Q101-R104 PolarHBondContact O-NE 3.23Å; Q101-F128 HydrophobicContact CG-CD1 4.31Å; Q101-F128 HydrophobicContact CG-CD2 3.72Å; Q101-F128 HydrophobicContact CG-CE1 4.04Å; Q101-F128 HydrophobicContact CG-CE2 3.45Å; Q101-F128 VanDerWaalsContact CG-CE2 3.45Å; Q101-F128 HydrophobicContact CG-CG 4.18Å; Q101-F128 HydrophobicContact CG-CZ 3.63Å
102	N	96.6	Very high	97.4	Very high	61 Å²	61	35.9 Å²	35.9	33%	0.326	18%	0.182	S	C	.	.	H	α-helix	trans	-88.5	-34.1	-176.4	-67.2	-30.7	0	0	0	113	S73 G77 T98 F99 A100	S73-N102 PolarHBondContact OG-ND2 3.32Å; G77-N102 CarbonylContact C-O 3.5Å; G77-N102 WeakPolarHBondContact CA-O 3.34Å; T98-N102 PolarHBondContact O-N 2.91Å; T98-N102 PolarHBondContact O-ND2 2.83Å; F99-N102 PolarHBondContact O-N 3.11Å; F99-N102 VanDerWaalsContact O-N 3.12Å; A100-N102 VanDerWaalsContact C-N 3.34Å; A100-N102 PolarHBondContact O-N 3.44Å
103	C	96	Very high	97.4	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.182	C	C	.	.			trans	-105.8	53.3	-171.9	-62.1	0	0	0	0	112.5	S73 F99 N105 I106	S73-C103 VanDerWaalsContact CA-SG 3.6Å; F99-C103 HydrophobicContact CD2-CB 4.01Å; F99-C103 HydrophobicContact CE2-CB 3.65Å; F99-C103 HydrophobicContact CZ-CB 3.94Å; F99-C103 WeakPolarHBondContact O-CB 3.37Å; F99-C103 PolarHBondContact O-N 2.81Å; C103-N105 PolarHBondContact O-N 2.94Å; C103-N105 VanDerWaalsContact O-N 3.08Å; C103-I106 WeakPolarHBondContact O-CB 3.43Å; C103-I106 WeakPolarHBondContact O-CG2 3.19Å; C103-I106 PolarHBondContact O-N 3.14Å; C103-I106 VanDerWaalsContact O-N 3.11Å
104	R	97.3	Very high	97.2	Very high	149 Å²	149	34.3 Å²	34.3	56%	0.562	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-13.8	-174.6	-56.4	-175.4	-170.1	173.4	-0.1	115.1	Q101 F128	Q101-R104 PolarHBondContact O-NE 3.23Å; R104-F128 WeakPolarHBondContact CA-O 3.34Å; R104-F128 WeakPolarHBondContact CB-O 3.38Å; R104-F128 WeakPolarHBondContact CG-O 3.27Å
105	N	96.8	Very high	97	Very high	39 Å²	39	33.2 Å²	33.2	21%	0.209	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95	8.2	178.5	-70.8	-31.4	0	0	0	113.4	G78 L80 R81 C103 E107 K131	G78-N105 WeakPolarHBondContact O-CB 3.46Å; G78-N105 PolarHBondContact O-ND2 2.89Å; L80-N105 CarbonylContact O-C 3.54Å; R81-N105 WeakPolarHBondContact CD-O 3.43Å; R81-N105 PolarHBondContact NH1-O 3.34Å; C103-N105 PolarHBondContact O-N 2.94Å; C103-N105 VanDerWaalsContact O-N 3.08Å; N105-E107 PolarHBondContact O-N 3.21Å; N105-K131 PolarHBondContact OD1-NZ 2.68Å
106	I	97.9	Very high	96.9	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	19%	0.189	C	C	.	.			trans	-59.7	131.5	176.8	-166.2	73.3	0	0	0	110.5	L80 R81 L83 F99 C103 H108 L109 C129 K131 L132	L80-I106 HydrophobicContact CG-CD1 4.21Å; R81-I106 WeakPolarHBondContact O-CD1 3.29Å; L83-I106 HydrophobicContact CB-CD1 4.07Å; F99-I106 HydrophobicContact CZ-CB 4.37Å; F99-I106 HydrophobicContact CZ-CD1 3.93Å; F99-I106 HydrophobicContact CZ-CG1 4Å; C103-I106 WeakPolarHBondContact O-CB 3.43Å; C103-I106 WeakPolarHBondContact O-CG2 3.19Å; C103-I106 PolarHBondContact O-N 3.14Å; C103-I106 VanDerWaalsContact O-N 3.11Å; I106-H108 WeakPolarHBondContact CD1-O 3.3Å; I106-L109 HydrophobicContact CG1-CB 4.42Å; I106-C129 HydrophobicContact CG2-CB 3.66Å; I106-C129 VanDerWaalsContact CG2-SG 3.58Å; I106-K131 CarbonylContact O-C 3.13Å; I106-L132 PolarHBondContact O-N 3.47Å
107	E	98.5	Very high	96.8	Very high	62 Å²	62	39.1 Å²	39.1	29%	0.29	19%	0.188	S	C	.	.			trans	-113.6	-30.4	179.6	-70.8	169.3	-155.6	0	0	111.1	R81 N105 K133 H134	R81-E107 IonicContact CZ-OE1 3.83Å; R81-E107 IonicContact NE-OE1 2.83Å; R81-E107 IonicContact NH1-OE1 3.93Å; R81-E107 PolarHBondContact NH1-OE1 3.31Å; R81-E107 PolarHBondContact O-N 2.79Å; N105-E107 PolarHBondContact O-N 3.21Å; E107-K133 PolarHBondContact O-N 2.82Å; E107-H134 PolarHBondContact O-N 3.46Å
108	H	98.8	Very high	96.8	Very high	44 Å²	44	36.8 Å²	36.8	20%	0.204	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	119.7	-179	-174.7	-62.3	0	0	0	110.6	R81 K82 L83 I106 H134	R81-H108 PolarHBondContact O-N 2.9Å; K82-H108 CarbonylContact C-O 3.59Å; K82-H108 VanDerWaalsContact CA-O 3.31Å; K82-H108 WeakPolarHBondContact CA-O 3.5Å; K82-H108 HydrophobicContact CB-CB 3.95Å; K82-H108 HydrophobicContact CD-CB 4.04Å; K82-H108 HydrophobicContact CG-CB 3.74Å; L83-H108 PolarHBondContact N-O 2.76Å; I106-H108 WeakPolarHBondContact CD1-O 3.3Å; H108-H134 CarbonylContact C-O 3.46Å; H108-H134 WeakPolarHBondContact CA-O 3.13Å; H108-H134 HydrophobicContact CB-CB 4.18Å; H108-H134 AromaticContact CD2-CD2 3.57Å; H108-H134 AromaticContact CD2-CE1 3.91Å; H108-H134 AromaticContact CD2-CG 3.26Å; H108-H134 AromaticContact CD2-ND1 3.49Å; H108-H134 PolarHBondContact CD2-ND1 3.43Å; H108-H134 AromaticContact CD2-NE2 3.96Å; H108-H134 AromaticContact CE1-CE1 3.54Å; H108-H134 AromaticContact CE1-ND1 3.5Å; H108-H134 PolarHBondContact CE1-ND1 3.16Å; H108-H134 AromaticContact CG-CG 3.86Å; H108-H134 AromaticContact CG-ND1 3.85Å; H108-H134 AromaticContact ND1-ND1 3.85Å; H108-H134 AromaticContact NE2-CD2 3.52Å; H108-H134 AromaticContact NE2-CE1 3.27Å; H108-H134 PolarHBondContact NE2-CE1 3.18Å; H108-H134 VanDerWaalsContact NE2-CE1 3.27Å; H108-H134 AromaticContact NE2-CG 3.47Å; H108-H134 AromaticContact NE2-ND1 3.31Å; H108-H134 PolarHBondContact NE2-ND1 3.18Å; H108-H134 AromaticContact NE2-NE2 3.39Å; H108-H134 PolarHBondContact NE2-NE2 3.32Å
109	L	98.6	Very high	96.8	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	121.5	177.5	-172.5	63.5	0	0	0	109.4	L83 F99 I106 L111 L125 L132 H134 L135 D136	L83-L109 HydrophobicContact CB-CD1 4Å; L83-L109 HydrophobicContact CD2-CD1 4.09Å; L83-L109 HydrophobicContact CG-CD1 4.25Å; L83-L109 WeakPolarHBondContact O-CA 3.18Å; F99-L109 HydrophobicContact CE1-CD1 3.89Å; F99-L109 HydrophobicContact CE1-CD2 4.22Å; F99-L109 HydrophobicContact CZ-CD1 3.98Å; I106-L109 HydrophobicContact CG1-CB 4.42Å; L109-L111 HydrophobicContact CD1-CD2 4.07Å; L109-L111 HydrophobicContact CD2-CD1 3.87Å; L109-L111 HydrophobicContact CD2-CD2 4.23Å; L109-L111 HydrophobicContact CD2-CG 4.1Å; L109-L111 HydrophobicContact CG-CD1 4.24Å; L109-L111 HydrophobicContact CG-CD2 4Å; L109-L111 HydrophobicContact CG-CG 3.91Å; L109-L125 HydrophobicContact CD2-CD1 3.82Å; L109-L125 HydrophobicContact CD2-CD2 3.62Å; L109-L125 HydrophobicContact CD2-CG 4.38Å; L109-L132 HydrophobicContact CB-CD1 4.36Å; L109-H134 PolarHBondContact N-O 2.97Å; L109-L135 HydrophobicContact CB-CD1 4.05Å; L109-L135 HydrophobicContact CD2-CD1 4.13Å; L109-L135 HydrophobicContact CG-CD1 4.33Å; L109-L135 WeakPolarHBondContact O-CA 3.04Å; L109-D136 PolarHBondContact O-N 3.15Å
110	N	98.4	Very high	96.8	Very high	22 Å²	22	39 Å²	39	12%	0.118	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	115.7	173.4	-170.3	-34.3	0	0	0	109.7	L83 L85 N112 D136	L83-N110 PolarHBondContact O-N 3.31Å; L85-N110 PolarHBondContact N-O 3.25Å; N110-N112 WeakPolarHBondContact OD1-CB 3.43Å; N110-N112 PolarHBondContact OD1-N 3.25Å; N110-D136 HydrophobicContact CB-CB 4.24Å; N110-D136 PolarHBondContact ND2-OD2 2.85Å; N110-D136 PolarHBondContact OD1-OD2 3.45Å
111	L	97.4	Very high	96.8	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.197	C	C	.	.			trans	-116.3	19.1	179.3	-56.7	175.7	0	0	0	111.4	L85 L96 L109 G113 C114 I117 T121 D136 L137 C140	L85-L111 HydrophobicContact CB-CD2 4.26Å; L85-L111 HydrophobicContact CD1-CD2 3.85Å; L85-L111 HydrophobicContact CG-CD2 4.41Å; L96-L111 HydrophobicContact CD1-CD1 4.13Å; L96-L111 HydrophobicContact CD1-CD2 3.98Å; L96-L111 HydrophobicContact CD2-CD2 3.93Å; L109-L111 HydrophobicContact CD1-CD2 4.07Å; L109-L111 HydrophobicContact CD2-CD1 3.87Å; L109-L111 HydrophobicContact CD2-CD2 4.23Å; L109-L111 HydrophobicContact CD2-CG 4.1Å; L109-L111 HydrophobicContact CG-CD1 4.24Å; L109-L111 HydrophobicContact CG-CD2 4Å; L109-L111 HydrophobicContact CG-CG 3.91Å; L111-G113 PolarHBondContact O-N 3.48Å; L111-C114 HydrophobicContact CB-CB 4.33Å; L111-C114 VanDerWaalsContact O-CB 3.26Å; L111-C114 WeakPolarHBondContact O-CB 3.28Å; L111-C114 PolarHBondContact O-N 3.49Å; L111-I117 HydrophobicContact CB-CD1 4.12Å; L111-I117 HydrophobicContact CD1-CD1 3.87Å; L111-T121 HydrophobicContact CD1-CG2 4.18Å; L111-D136 WeakPolarHBondContact CA-O 3.29Å; L111-D136 WeakPolarHBondContact CB-O 3.26Å; L111-D136 PolarHBondContact N-O 3.29Å; L111-L137 HydrophobicContact CB-CD2 4.26Å; L111-L137 HydrophobicContact CD1-CD2 3.82Å; L111-C140 PolarHBondContact O-SG 3.16Å
112	N	96.5	Very high	96.9	Very high	31 Å²	31	35.7 Å²	35.7	17%	0.166	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.1	123.2	-178.6	176.7	-36.2	0	0	0	110.6	R86 G87 N110 C114 T138	R86-N112 CarbonylContact C-O 3.57Å; R86-N112 VanDerWaalsContact CA-O 3.3Å; R86-N112 WeakPolarHBondContact CA-O 3.5Å; R86-N112 HydrophobicContact CB-CB 4.32Å; R86-N112 HydrophobicContact CG-CB 4Å; G87-N112 PolarHBondContact N-O 2.9Å; N110-N112 WeakPolarHBondContact OD1-CB 3.43Å; N110-N112 PolarHBondContact OD1-N 3.25Å; N112-C114 VanDerWaalsContact C-N 3.26Å; N112-C114 PolarHBondContact O-N 2.8Å; N112-T138 CarbonylContact C-O 3.59Å; N112-T138 VanDerWaalsContact CA-O 3.29Å; N112-T138 WeakPolarHBondContact CA-O 3.23Å; N112-T138 WeakPolarHBondContact ND2-CB 3.5Å; N112-T138 WeakPolarHBondContact ND2-CG2 3.47Å
113	G	93.8	Very high	97	Very high	14 Å²	14	38.1 Å²	38.1	14%	0.144	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.4	7.2	179	0	0	0	0	0	115	L111 T115 T138	L111-G113 PolarHBondContact O-N 3.48Å; G113-T115 VanDerWaalsContact C-N 3.28Å; G113-T115 PolarHBondContact O-N 2.77Å; G113-T138 PolarHBondContact N-O 2.83Å
114	C	94.1	Very high	97.1	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.19	C	C	.	.			trans	-75.1	80.7	170.2	-67.4	0	0	0	0	109.9	L85 C88 L111 N112 K116 I117	L85-C114 PolarHBondContact O-SG 2.9Å; C88-C114 PolarHBondContact O-SG 3.13Å; L111-C114 HydrophobicContact CB-CB 4.33Å; L111-C114 VanDerWaalsContact O-CB 3.26Å; L111-C114 WeakPolarHBondContact O-CB 3.28Å; L111-C114 PolarHBondContact O-N 3.49Å; N112-C114 VanDerWaalsContact C-N 3.26Å; N112-C114 PolarHBondContact O-N 2.8Å; C114-K116 VanDerWaalsContact C-N 3.26Å; C114-K116 PolarHBondContact O-N 3.15Å; C114-I117 HydrophobicContact CB-CG2 3.8Å; C114-I117 WeakPolarHBondContact O-CG1 3.33Å; C114-I117 PolarHBondContact O-N 3.15Å
115	T	92.3	Very high	97.2	Very high	65 Å²	65	31.5 Å²	31.5	40%	0.399	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-13.7	-170.7	54.9	0	0	0	0	115.2	G113	G113-T115 VanDerWaalsContact C-N 3.28Å; G113-T115 PolarHBondContact O-N 2.77Å
116	K	94.4	Very high	97.2	Very high	132 Å²	132	30.6 Å²	30.6	57%	0.574	16%	0.16	S	C	*	.	B	Isolated β-bridge	trans	-89	1.1	177.9	-69.9	-173.8	-178.6	177	0	114.3	I89 C114	I89-K116 WeakPolarHBondContact O-CD 3.4Å; C114-K116 VanDerWaalsContact C-N 3.26Å; C114-K116 PolarHBondContact O-N 3.15Å
117	I	95.6	Very high	97.3	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	19%	0.193	C	C	.	.			trans	-83.8	145	177.2	78.9	176.8	0	0	0	110.3	D93 L96 L111 C114 L137 C140 S142 V143	D93-I117 WeakPolarHBondContact OD1-CA 3.36Å; L96-I117 HydrophobicContact CD1-CB 4.45Å; L96-I117 HydrophobicContact CD1-CG2 3.49Å; L96-I117 VanDerWaalsContact CD1-CG2 3.49Å; L111-I117 HydrophobicContact CB-CD1 4.12Å; L111-I117 HydrophobicContact CD1-CD1 3.87Å; C114-I117 HydrophobicContact CB-CG2 3.8Å; C114-I117 WeakPolarHBondContact O-CG1 3.33Å; C114-I117 PolarHBondContact O-N 3.15Å; I117-L137 HydrophobicContact CD1-CD2 3.82Å; I117-C140 HydrophobicContact CD1-CB 3.76Å; I117-C140 WeakPolarHBondContact CD1-SG 3.34Å; I117-C140 HydrophobicContact CG1-CB 3.91Å; I117-S142 WeakPolarHBondContact O-CB 3.38Å; I117-V143 HydrophobicContact CD1-CG2 4.42Å; I117-V143 HydrophobicContact CG1-CG2 4.31Å
118	T	97.7	Very high	97.3	Very high	52 Å²	52	38.6 Å²	38.6	32%	0.319	19%	0.189	S	C	.	.			trans	-127.2	-173.7	176.2	74.3	0	0	0	0	110.6	D93 S120 T121	D93-T118 PolarHBondContact OD1-N 3.17Å; D93-T118 WeakPolarHBondContact OD2-CB 3.42Å; D93-T118 WeakPolarHBondContact OD2-CG2 3.28Å; D93-T118 PolarHBondContact OD2-OG1 2.81Å; T118-S120 PolarHBondContact O-N 3.25Å; T118-S120 WeakPolarHBondContact OG1-CB 3.42Å; T118-S120 PolarHBondContact OG1-N 3.29Å; T118-T121 WeakPolarHBondContact O-CB 3.49Å; T118-T121 PolarHBondContact O-N 3.26Å
119	D	98.4	Very high	97.2	Very high	28 Å²	28	36.5 Å²	36.5	15%	0.15	18%	0.18	C	C	.	.	H	α-helix	trans	-53	-26.8	172.9	-58.3	-36.7	0	0	0	113.8	T121 C122 Y123 T144 S146 S147	D119-T121 VanDerWaalsContact C-N 3.27Å; D119-T121 PolarHBondContact O-N 3.08Å; D119-C122 PolarHBondContact O-N 2.94Å; D119-C122 VanDerWaalsContact O-N 3.09Å; D119-Y123 HydrophobicContact CB-CD2 4.32Å; D119-Y123 HydrophobicContact CB-CE2 3.95Å; D119-Y123 WeakPolarHBondContact O-CD2 3.23Å; D119-Y123 PolarHBondContact O-N 3.1Å; D119-T144 VanDerWaalsContact CG-OG1 3.28Å; D119-T144 PolarHBondContact OD1-N 2.91Å; D119-T144 PolarHBondContact OD1-OG1 3.03Å; D119-T144 PolarHBondContact OD2-OG1 3.04Å; D119-S146 WeakPolarHBondContact OD2-CB 3.33Å; D119-S147 VanDerWaalsContact CA-OG 3.26Å; D119-S147 WeakPolarHBondContact CA-OG 3.49Å; D119-S147 WeakPolarHBondContact OD1-CB 3.47Å; D119-S147 PolarHBondContact OD1-N 2.95Å; D119-S147 PolarHBondContact OD1-OG 2.59Å
120	S	98.6	Very high	97.2	Very high	51 Å²	51	39.7 Å²	39.7	36%	0.357	20%	0.202	S	C	.	.	H	α-helix	trans	-57.1	-38.4	175.6	-176.4	0	0	0	0	113	T118 S124	T118-S120 PolarHBondContact O-N 3.25Å; T118-S120 WeakPolarHBondContact OG1-CB 3.42Å; T118-S120 PolarHBondContact OG1-N 3.29Å; S120-S124 PolarHBondContact O-N 3.08Å; S120-S124 PolarHBondContact O-OG 3Å
121	T	98.4	Very high	97.2	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-63.8	-48.3	173.9	-74.4	0	0	0	0	110.6	D93 L96 L111 T118 D119 Y123 S124 L125	D93-T121 WeakPolarHBondContact CA-OG1 3.47Å; D93-T121 WeakPolarHBondContact OD1-CB 3.13Å; D93-T121 PolarHBondContact OD1-N 3.3Å; D93-T121 PolarHBondContact OD1-OG1 3.35Å; L96-T121 HydrophobicContact CB-CG2 3.97Å; L96-T121 HydrophobicContact CD1-CG2 3.62Å; L96-T121 HydrophobicContact CG-CG2 4.38Å; L111-T121 HydrophobicContact CD1-CG2 4.18Å; T118-T121 WeakPolarHBondContact O-CB 3.49Å; T118-T121 PolarHBondContact O-N 3.26Å; D119-T121 VanDerWaalsContact C-N 3.27Å; D119-T121 PolarHBondContact O-N 3.08Å; T121-Y123 VanDerWaalsContact C-N 3.33Å; T121-Y123 PolarHBondContact O-N 3.02Å; T121-S124 CarbonylContact O-C 3.59Å; T121-S124 WeakPolarHBondContact O-CA 3.39Å; T121-S124 WeakPolarHBondContact O-CB 3.29Å; T121-S124 PolarHBondContact O-N 3.37Å; T121-L125 HydrophobicContact CG2-CD1 4.19Å; T121-L125 HydrophobicContact CG2-CG 4.37Å; T121-L125 WeakPolarHBondContact O-CG 3.31Å; T121-L125 PolarHBondContact O-N 3.5Å
122	C	98.4	Very high	97.2	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-63.4	-37	-179.7	-66.7	0	0	0	0	112.6	D119 S124 L125 S126 S147 I151	D119-C122 PolarHBondContact O-N 2.94Å; D119-C122 VanDerWaalsContact O-N 3.09Å; C122-S124 VanDerWaalsContact C-N 3.34Å; C122-L125 PolarHBondContact O-N 3.17Å; C122-S126 WeakPolarHBondContact O-CB 3.28Å; C122-S126 PolarHBondContact O-N 3.21Å; C122-S147 WeakPolarHBondContact CB-OG 3.47Å; C122-S147 VanDerWaalsContact SG-CB 3.51Å; C122-S147 PolarHBondContact SG-OG 2.86Å; C122-I151 HydrophobicContact CB-CD1 4.25Å; C122-I151 HydrophobicContact CB-CG1 4.18Å
123	Y	98.7	Very high	97.4	Very high	112 Å²	112	46 Å²	46	44%	0.439	23%	0.226	S	C	.	.	H	α-helix	trans	-63.8	-38.7	170.7	-70	-54.3	0	0	0	112.6	D119 T121 S126 R127 S146	D119-Y123 HydrophobicContact CB-CD2 4.32Å; D119-Y123 HydrophobicContact CB-CE2 3.95Å; D119-Y123 WeakPolarHBondContact O-CD2 3.23Å; D119-Y123 PolarHBondContact O-N 3.1Å; T121-Y123 VanDerWaalsContact C-N 3.33Å; T121-Y123 PolarHBondContact O-N 3.02Å; Y123-S126 WeakPolarHBondContact O-CB 3.46Å; Y123-S126 PolarHBondContact O-N 2.84Å; Y123-R127 WeakPolarHBondContact O-CB 3.27Å; Y123-R127 PolarHBondContact O-N 2.9Å; Y123-S146 WeakPolarHBondContact OH-CB 3.24Å
124	S	98.7	Very high	97.6	Very high	9 Å²	9	47 Å²	47	6%	0.063	23%	0.228	C	C	.	.	H	α-helix	trans	-65.4	-43.8	175.3	-59.4	0	0	0	0	111.2	S120 T121 C122 R127 F128	S120-S124 PolarHBondContact O-N 3.08Å; S120-S124 PolarHBondContact O-OG 3Å; T121-S124 CarbonylContact O-C 3.59Å; T121-S124 WeakPolarHBondContact O-CA 3.39Å; T121-S124 WeakPolarHBondContact O-CB 3.29Å; T121-S124 PolarHBondContact O-N 3.37Å; C122-S124 VanDerWaalsContact C-N 3.34Å; S124-R127 PolarHBondContact O-N 2.97Å; S124-F128 WeakPolarHBondContact O-CD2 3.49Å; S124-F128 PolarHBondContact O-N 2.91Å; S124-F128 VanDerWaalsContact O-N 3.15Å
125	L	98.6	Very high	97.8	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-61.4	-46.2	174.6	-65	177.6	0	0	0	111.3	A100 L109 T121 C122 R127 F128 C129 L132 L135	A100-L125 HydrophobicContact CB-CD2 4.26Å; L109-L125 HydrophobicContact CD2-CD1 3.82Å; L109-L125 HydrophobicContact CD2-CD2 3.62Å; L109-L125 HydrophobicContact CD2-CG 4.38Å; T121-L125 HydrophobicContact CG2-CD1 4.19Å; T121-L125 HydrophobicContact CG2-CG 4.37Å; T121-L125 WeakPolarHBondContact O-CG 3.31Å; T121-L125 PolarHBondContact O-N 3.5Å; C122-L125 PolarHBondContact O-N 3.17Å; L125-R127 VanDerWaalsContact C-N 3.26Å; L125-R127 PolarHBondContact O-N 2.87Å; L125-F128 PolarHBondContact O-N 2.81Å; L125-C129 HydrophobicContact CD2-CB 4.27Å; L125-C129 WeakPolarHBondContact O-CA 3.47Å; L125-C129 VanDerWaalsContact O-CB 3.3Å; L125-C129 WeakPolarHBondContact O-CB 3.29Å; L125-C129 PolarHBondContact O-N 3.16Å; L125-L132 HydrophobicContact CD1-CD1 4.41Å; L125-L132 HydrophobicContact CD2-CD1 4.41Å; L125-L135 HydrophobicContact CD1-CD1 4.08Å; L125-L135 HydrophobicContact CD1-CD2 4.41Å
126	S	98.4	Very high	98.1	Very high	21 Å²	21	44.4 Å²	44.4	15%	0.147	21%	0.211	C	C	.	.	H	α-helix	trans	-54	-43.5	175.1	179.4	0	0	0	0	112.2	C122 Y123 G150 G154	C122-S126 WeakPolarHBondContact O-CB 3.28Å; C122-S126 PolarHBondContact O-N 3.21Å; Y123-S126 WeakPolarHBondContact O-CB 3.46Å; Y123-S126 PolarHBondContact O-N 2.84Å; S126-G150 WeakPolarHBondContact CB-O 3.34Å; S126-G150 PolarHBondContact OG-O 3.43Å; S126-G154 WeakPolarHBondContact O-CA 3.32Å; S126-G154 WeakPolarHBondContact OG-CA 3.48Å; S126-G154 PolarHBondContact OG-N 2.78Å
127	R	98.6	Very high	98.3	Very high	184 Å²	184	38.1 Å²	38.1	69%	0.694	18%	0.184	S	C	*	.	H	α-helix	trans	-72.9	-33.4	-175.7	-172.3	62.6	-178.6	94	-6.6	114.1	Y123 S124 L125	Y123-R127 WeakPolarHBondContact O-CB 3.27Å; Y123-R127 PolarHBondContact O-N 2.9Å; S124-R127 PolarHBondContact O-N 2.97Å; L125-R127 VanDerWaalsContact C-N 3.26Å; L125-R127 PolarHBondContact O-N 2.87Å
128	F	98.5	Very high	98.5	Very high	46 Å²	46	38.3 Å²	38.3	20%	0.202	19%	0.185	C	C	.	.	H	α-helix	trans	-122.2	-20.1	-166.3	-55.6	-64.6	0	0	0	115.2	A100 Q101 R104 S124 L125	A100-F128 HydrophobicContact CB-CB 4.22Å; A100-F128 HydrophobicContact CB-CD2 4.09Å; A100-F128 WeakPolarHBondContact O-CB 3.34Å; Q101-F128 HydrophobicContact CG-CD1 4.31Å; Q101-F128 HydrophobicContact CG-CD2 3.72Å; Q101-F128 HydrophobicContact CG-CE1 4.04Å; Q101-F128 HydrophobicContact CG-CE2 3.45Å; Q101-F128 VanDerWaalsContact CG-CE2 3.45Å; Q101-F128 HydrophobicContact CG-CG 4.18Å; Q101-F128 HydrophobicContact CG-CZ 3.63Å; R104-F128 WeakPolarHBondContact CA-O 3.34Å; R104-F128 WeakPolarHBondContact CB-O 3.38Å; R104-F128 WeakPolarHBondContact CG-O 3.27Å; S124-F128 WeakPolarHBondContact O-CD2 3.49Å; S124-F128 PolarHBondContact O-N 2.91Å; S124-F128 VanDerWaalsContact O-N 3.15Å; L125-F128 PolarHBondContact O-N 2.81Å
129	C	98	Very high	98.4	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	18%	0.181	C	C	.	.			trans	-116.5	51	-168.3	-58	0	0	0	0	112.7	I106 L125 K131 L132	I106-C129 HydrophobicContact CG2-CB 3.66Å; I106-C129 VanDerWaalsContact CG2-SG 3.58Å; L125-C129 HydrophobicContact CD2-CB 4.27Å; L125-C129 WeakPolarHBondContact O-CA 3.47Å; L125-C129 VanDerWaalsContact O-CB 3.3Å; L125-C129 WeakPolarHBondContact O-CB 3.29Å; L125-C129 PolarHBondContact O-N 3.16Å; C129-K131 PolarHBondContact O-N 3.19Å; C129-K131 VanDerWaalsContact O-N 3.08Å; C129-L132 HydrophobicContact CB-CD1 4.35Å; C129-L132 VanDerWaalsContact O-CB 3.27Å; C129-L132 WeakPolarHBondContact O-CB 3.41Å; C129-L132 PolarHBondContact O-N 3.03Å; C129-L132 VanDerWaalsContact O-N 3.16Å
130	S	97.7	Very high	98.3	Very high	66 Å²	66	36.2 Å²	36.2	46%	0.462	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-5.8	-176.4	60.4	0	0	0	0	115.9	G154 N157	S130-G154 WeakPolarHBondContact CA-O 3.33Å; S130-G154 WeakPolarHBondContact CB-O 3.46Å; S130-N157 PolarHBondContact O-ND2 2.8Å
131	K	98.4	Very high	98.2	Very high	96 Å²	96	37.2 Å²	37.2	42%	0.417	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.4	2.3	175	-63.7	-171.1	-176.4	172.5	0	113.4	N105 I106 C129 K133	N105-K131 PolarHBondContact OD1-NZ 2.68Å; I106-K131 CarbonylContact O-C 3.13Å; C129-K131 PolarHBondContact O-N 3.19Å; C129-K131 VanDerWaalsContact O-N 3.08Å; K131-K133 PolarHBondContact O-N 3.24Å
132	L	98.6	Very high	98.1	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.195	C	C	.	.			trans	-65.1	123.5	-177.1	-150.8	160.2	0	0	0	110	I106 L109 L125 C129 H134 L135 N157 L158	I106-L132 PolarHBondContact O-N 3.47Å; L109-L132 HydrophobicContact CB-CD1 4.36Å; L125-L132 HydrophobicContact CD1-CD1 4.41Å; L125-L132 HydrophobicContact CD2-CD1 4.41Å; C129-L132 HydrophobicContact CB-CD1 4.35Å; C129-L132 VanDerWaalsContact O-CB 3.27Å; C129-L132 WeakPolarHBondContact O-CB 3.41Å; C129-L132 PolarHBondContact O-N 3.03Å; C129-L132 VanDerWaalsContact O-N 3.16Å; L132-H134 VanDerWaalsContact CD2-O 3.28Å; L132-H134 WeakPolarHBondContact CD2-O 3.43Å; L132-L135 HydrophobicContact CD1-CD1 4.29Å; L132-L135 HydrophobicContact CD2-CB 3.61Å; L132-L135 HydrophobicContact CD2-CD1 4.45Å; L132-L135 HydrophobicContact CD2-CG 4.47Å; L132-N157 CarbonylContact O-C 3.4Å; L132-L158 HydrophobicContact CD2-CD1 3.34Å
133	K	98.8	Very high	98	Very high	89 Å²	89	39.7 Å²	39.7	39%	0.387	20%	0.195	S	C	.	.			trans	-110.7	-28.5	178.8	-69.1	-175.9	168.4	-131.9	0	112.6	E107 K131 E159 Y160	E107-K133 PolarHBondContact O-N 2.82Å; K131-K133 PolarHBondContact O-N 3.24Å; K133-E159 IonicContact NZ-OE1 3.51Å; K133-E159 PolarHBondContact NZ-OE1 2.92Å; K133-E159 CarbonylContact O-C 3.5Å; K133-E159 WeakPolarHBondContact O-CA 3.44Å; K133-E159 PolarHBondContact O-N 2.94Å; K133-Y160 PolarHBondContact O-N 3.41Å
134	H	98.9	Very high	98	Very high	37 Å²	37	36.1 Å²	36.1	17%	0.171	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	116	-179.1	-179.3	-60.3	0	0	0	110.8	E107 H108 L109 L132 Y160	E107-H134 PolarHBondContact O-N 3.46Å; H108-H134 CarbonylContact C-O 3.46Å; H108-H134 WeakPolarHBondContact CA-O 3.13Å; H108-H134 HydrophobicContact CB-CB 4.18Å; H108-H134 AromaticContact CD2-CD2 3.57Å; H108-H134 AromaticContact CD2-CE1 3.91Å; H108-H134 AromaticContact CD2-CG 3.26Å; H108-H134 AromaticContact CD2-ND1 3.49Å; H108-H134 PolarHBondContact CD2-ND1 3.43Å; H108-H134 AromaticContact CD2-NE2 3.96Å; H108-H134 AromaticContact CE1-CE1 3.54Å; H108-H134 AromaticContact CE1-ND1 3.5Å; H108-H134 PolarHBondContact CE1-ND1 3.16Å; H108-H134 AromaticContact CG-CG 3.86Å; H108-H134 AromaticContact CG-ND1 3.85Å; H108-H134 AromaticContact ND1-ND1 3.85Å; H108-H134 AromaticContact NE2-CD2 3.52Å; H108-H134 AromaticContact NE2-CE1 3.27Å; H108-H134 PolarHBondContact NE2-CE1 3.18Å; H108-H134 VanDerWaalsContact NE2-CE1 3.27Å; H108-H134 AromaticContact NE2-CG 3.47Å; H108-H134 AromaticContact NE2-ND1 3.31Å; H108-H134 PolarHBondContact NE2-ND1 3.18Å; H108-H134 AromaticContact NE2-NE2 3.39Å; H108-H134 PolarHBondContact NE2-NE2 3.32Å; L109-H134 PolarHBondContact N-O 2.97Å; L132-H134 VanDerWaalsContact CD2-O 3.28Å; L132-H134 WeakPolarHBondContact CD2-O 3.43Å; H134-Y160 WeakPolarHBondContact CA-O 3.3Å; H134-Y160 HydrophobicContact CB-CD1 4.47Å; H134-Y160 AromaticContact CD2-CD1 3.31Å; H134-Y160 WeakPolarHBondContact CD2-CD1 3.45Å; H134-Y160 AromaticContact CD2-CD2 3.86Å; H134-Y160 AromaticContact CD2-CE1 3.87Å; H134-Y160 AromaticContact CD2-CG 3.32Å; H134-Y160 AromaticContact CE1-CD1 3.39Å; H134-Y160 WeakPolarHBondContact CE1-CD1 3.4Å; H134-Y160 AromaticContact CE1-CE1 3.29Å; H134-Y160 WeakPolarHBondContact CE1-CE1 3.18Å; H134-Y160 AromaticContact CE1-CZ 4Å; H134-Y160 AromaticContact CG-CD1 3.55Å; H134-Y160 AromaticContact CG-CG 3.87Å; H134-Y160 AromaticContact ND1-CD1 3.6Å; H134-Y160 AromaticContact ND1-CE1 3.93Å; H134-Y160 AromaticContact NE2-CD1 3.23Å; H134-Y160 WeakPolarHBondContact NE2-CD1 3.45Å; H134-Y160 AromaticContact NE2-CD2 3.87Å; H134-Y160 AromaticContact NE2-CE1 3.24Å; H134-Y160 WeakPolarHBondContact NE2-CE1 3.49Å; H134-Y160 AromaticContact NE2-CE2 3.88Å; H134-Y160 AromaticContact NE2-CG 3.57Å; H134-Y160 AromaticContact NE2-CZ 3.59Å
135	L	98.9	Very high	98	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	125.3	175.2	-172	56.6	0	0	0	110.2	L109 L125 L132 L137 I151 L158 Y160 L161 N162	L109-L135 HydrophobicContact CB-CD1 4.05Å; L109-L135 HydrophobicContact CD2-CD1 4.13Å; L109-L135 HydrophobicContact CG-CD1 4.33Å; L109-L135 WeakPolarHBondContact O-CA 3.04Å; L125-L135 HydrophobicContact CD1-CD1 4.08Å; L125-L135 HydrophobicContact CD1-CD2 4.41Å; L132-L135 HydrophobicContact CD1-CD1 4.29Å; L132-L135 HydrophobicContact CD2-CB 3.61Å; L132-L135 HydrophobicContact CD2-CD1 4.45Å; L132-L135 HydrophobicContact CD2-CG 4.47Å; L135-L137 HydrophobicContact CD1-CD2 4.22Å; L135-L137 HydrophobicContact CD1-CG 4.42Å; L135-L137 HydrophobicContact CD2-CD1 3.99Å; L135-L137 HydrophobicContact CD2-CD2 4.5Å; L135-L137 HydrophobicContact CD2-CG 4.19Å; L135-L137 HydrophobicContact CG-CD1 4.3Å; L135-L137 HydrophobicContact CG-CD2 4.29Å; L135-L137 HydrophobicContact CG-CG 3.97Å; L135-I151 HydrophobicContact CD2-CD1 3.65Å; L135-I151 HydrophobicContact CD2-CG1 4.24Å; L135-L158 HydrophobicContact CB-CD1 4.03Å; L135-Y160 PolarHBondContact N-O 3.33Å; L135-L161 HydrophobicContact CB-CD1 3.82Å; L135-L161 HydrophobicContact CD2-CD1 3.99Å; L135-L161 HydrophobicContact CG-CD1 4.03Å; L135-L161 WeakPolarHBondContact O-CA 3.46Å; L135-N162 PolarHBondContact O-N 3.22Å
136	D	98.8	Very high	98	Very high	10 Å²	10	39.9 Å²	39.9	5%	0.053	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	114.3	173.1	-176.8	-4.2	0	0	0	109.4	L109 N110 L111 T138 N162	L109-D136 PolarHBondContact O-N 3.15Å; N110-D136 HydrophobicContact CB-CB 4.24Å; N110-D136 PolarHBondContact ND2-OD2 2.85Å; N110-D136 PolarHBondContact OD1-OD2 3.45Å; L111-D136 WeakPolarHBondContact CA-O 3.29Å; L111-D136 WeakPolarHBondContact CB-O 3.26Å; L111-D136 PolarHBondContact N-O 3.29Å; D136-T138 WeakPolarHBondContact OD1-CB 3.47Å; D136-T138 PolarHBondContact OD1-N 3.27Å; D136-T138 PolarHBondContact OD1-OG1 3.01Å; D136-N162 HydrophobicContact CB-CB 4.4Å
137	L	98.4	Very high	98	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.202	C	C	.	.			trans	-115	23	177.9	-61	172.9	0	0	0	111.2	L111 I117 L135 S139 C140 V143 I151 L161 N162 L163 C166	L111-L137 HydrophobicContact CB-CD2 4.26Å; L111-L137 HydrophobicContact CD1-CD2 3.82Å; I117-L137 HydrophobicContact CD1-CD2 3.82Å; L135-L137 HydrophobicContact CD1-CD2 4.22Å; L135-L137 HydrophobicContact CD1-CG 4.42Å; L135-L137 HydrophobicContact CD2-CD1 3.99Å; L135-L137 HydrophobicContact CD2-CD2 4.5Å; L135-L137 HydrophobicContact CD2-CG 4.19Å; L135-L137 HydrophobicContact CG-CD1 4.3Å; L135-L137 HydrophobicContact CG-CD2 4.29Å; L135-L137 HydrophobicContact CG-CG 3.97Å; L137-S139 PolarHBondContact O-N 3.37Å; L137-C140 HydrophobicContact CB-CB 4.22Å; L137-C140 VanDerWaalsContact O-CB 3.25Å; L137-C140 WeakPolarHBondContact O-CB 3.45Å; L137-C140 PolarHBondContact O-N 2.86Å; L137-C140 PolarHBondContact O-SG 2.95Å; L137-C140 VanDerWaalsContact O-SG 3.41Å; L137-V143 HydrophobicContact CD1-CG1 4.33Å; L137-I151 HydrophobicContact CD1-CD1 4.12Å; L137-L161 HydrophobicContact CD1-CD1 4.5Å; L137-N162 WeakPolarHBondContact CA-O 3.39Å; L137-N162 PolarHBondContact N-O 3.17Å; L137-L163 HydrophobicContact CB-CD2 4.25Å; L137-L163 HydrophobicContact CD1-CD2 3.87Å; L137-C166 PolarHBondContact O-SG 2.56Å
138	T	98.6	Very high	98	Very high	4 Å²	4	30.1 Å²	30.1	3%	0.025	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-49.5	128.9	178.8	-62.2	0	0	0	0	111	N112 G113 D136 C140 N162 S164 W165	N112-T138 CarbonylContact C-O 3.59Å; N112-T138 VanDerWaalsContact CA-O 3.29Å; N112-T138 WeakPolarHBondContact CA-O 3.23Å; N112-T138 WeakPolarHBondContact ND2-CB 3.5Å; N112-T138 WeakPolarHBondContact ND2-CG2 3.47Å; G113-T138 PolarHBondContact N-O 2.83Å; D136-T138 WeakPolarHBondContact OD1-CB 3.47Å; D136-T138 PolarHBondContact OD1-N 3.27Å; D136-T138 PolarHBondContact OD1-OG1 3.01Å; T138-C140 PolarHBondContact O-N 2.9Å; T138-N162 PolarHBondContact OG1-ND2 2.9Å; T138-N162 VanDerWaalsContact OG1-ND2 3.1Å; T138-N162 PolarHBondContact OG1-OD1 2.96Å; T138-S164 CarbonylContact C-O 3.59Å; T138-S164 WeakPolarHBondContact CA-O 3.39Å; T138-W165 HydrophobicContact CG2-CE3 3.44Å; T138-W165 VanDerWaalsContact CG2-CE3 3.44Å; T138-W165 HydrophobicContact CG2-CZ3 3.44Å; T138-W165 VanDerWaalsContact CG2-CZ3 3.44Å
139	S	97.2	Very high	98	Very high	35 Å²	35	33.3 Å²	33.3	25%	0.245	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.7	22.7	180	-53.1	0	0	0	0	115.1	L137 V141 S164	L137-S139 PolarHBondContact O-N 3.37Å; S139-V141 VanDerWaalsContact C-N 3.27Å; S139-V141 PolarHBondContact O-N 3.19Å; S139-V141 VanDerWaalsContact O-N 3.09Å; S139-S164 PolarHBondContact N-O 3.32Å
140	C	96.3	Very high	98	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.182	C	C	.	.			trans	-83.3	71	168.9	-64.4	0	0	0	0	110.4	L111 I117 L137 T138 S142 V143	L111-C140 PolarHBondContact O-SG 3.16Å; I117-C140 HydrophobicContact CD1-CB 3.76Å; I117-C140 WeakPolarHBondContact CD1-SG 3.34Å; I117-C140 HydrophobicContact CG1-CB 3.91Å; L137-C140 HydrophobicContact CB-CB 4.22Å; L137-C140 VanDerWaalsContact O-CB 3.25Å; L137-C140 WeakPolarHBondContact O-CB 3.45Å; L137-C140 PolarHBondContact O-N 2.86Å; L137-C140 PolarHBondContact O-SG 2.95Å; L137-C140 VanDerWaalsContact O-SG 3.41Å; T138-C140 PolarHBondContact O-N 2.9Å; C140-S142 PolarHBondContact O-N 2.94Å; C140-V143 HydrophobicContact CB-CG2 3.71Å; C140-V143 VanDerWaalsContact O-CB 3.27Å; C140-V143 WeakPolarHBondContact O-CB 3.45Å; C140-V143 WeakPolarHBondContact O-CG2 3.33Å; C140-V143 PolarHBondContact O-N 3.17Å
141	V	95.3	Very high	98.1	Very high	73 Å²	73	30.1 Å²	30.1	44%	0.442	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-16.3	-167.2	-61.8	0	0	0	0	116.3	S139	S139-V141 VanDerWaalsContact C-N 3.27Å; S139-V141 PolarHBondContact O-N 3.19Å; S139-V141 VanDerWaalsContact O-N 3.09Å
142	S	96.6	Very high	98.1	Very high	51 Å²	51	26.1 Å²	26.1	36%	0.357	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.2	6.8	177.7	-57.7	0	0	0	0	113.9	I117 C140	I117-S142 WeakPolarHBondContact O-CB 3.38Å; C140-S142 PolarHBondContact O-N 2.94Å
143	V	96.6	Very high	98.1	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.167	C	C	.	.			trans	-81.6	128.4	172.5	168.9	0	0	0	0	109.2	I117 L137 C140 S147 I169	I117-V143 HydrophobicContact CD1-CG2 4.42Å; I117-V143 HydrophobicContact CG1-CG2 4.31Å; L137-V143 HydrophobicContact CD1-CG1 4.33Å; C140-V143 HydrophobicContact CB-CG2 3.71Å; C140-V143 VanDerWaalsContact O-CB 3.27Å; C140-V143 WeakPolarHBondContact O-CB 3.45Å; C140-V143 WeakPolarHBondContact O-CG2 3.33Å; C140-V143 PolarHBondContact O-N 3.17Å; V143-S147 WeakPolarHBondContact CG1-OG 3.39Å; V143-I169 HydrophobicContact CG1-CD1 4.39Å
144	T	98.4	Very high	98	Very high	37 Å²	37	27.5 Å²	27.5	23%	0.227	16%	0.156	C	C	.	.			trans	-114	-179.7	-179.8	80.6	0	0	0	0	111.9	D119 S146 S147 I169	D119-T144 VanDerWaalsContact CG-OG1 3.28Å; D119-T144 PolarHBondContact OD1-N 2.91Å; D119-T144 PolarHBondContact OD1-OG1 3.03Å; D119-T144 PolarHBondContact OD2-OG1 3.04Å; T144-S146 PolarHBondContact O-N 3.19Å; T144-S146 WeakPolarHBondContact OG1-CB 3.37Å; T144-S146 PolarHBondContact OG1-N 3.35Å; T144-S146 VanDerWaalsContact OG1-N 3.12Å; T144-S146 PolarHBondContact OG1-OG 3.4Å; T144-S147 VanDerWaalsContact O-CB 3.3Å; T144-S147 WeakPolarHBondContact O-CB 3.44Å; T144-S147 PolarHBondContact O-N 3.35Å; T144-I169 WeakPolarHBondContact O-CD1 3.32Å
145	N	98.6	Very high	98	Very high	40 Å²	40	25.7 Å²	25.7	21%	0.214	15%	0.148	C	C	.	.	H	α-helix	trans	-52.2	-28	170.7	-66.6	-19.4	0	0	0	113.2	S147 L148 K149 T170 G173	N145-S147 VanDerWaalsContact C-N 3.34Å; N145-S147 PolarHBondContact O-N 3.23Å; N145-L148 WeakPolarHBondContact O-CB 3.28Å; N145-L148 PolarHBondContact O-N 3.44Å; N145-K149 PolarHBondContact O-N 2.86Å; N145-K149 VanDerWaalsContact O-N 3.08Å; N145-T170 PolarHBondContact ND2-OG1 3.25Å; N145-T170 PolarHBondContact OD1-N 2.82Å; N145-G173 WeakPolarHBondContact OD1-CA 3.28Å; N145-G173 PolarHBondContact OD1-N 2.7Å
146	S	98.6	Very high	97.9	Very high	48 Å²	48	33.3 Å²	33.3	34%	0.336	18%	0.177	S	C	.	.	H	α-helix	trans	-64.2	-38.1	177.9	-57	0	0	0	0	112.2	D119 Y123 T144 L148 K149 G150	D119-S146 WeakPolarHBondContact OD2-CB 3.33Å; Y123-S146 WeakPolarHBondContact OH-CB 3.24Å; T144-S146 PolarHBondContact O-N 3.19Å; T144-S146 WeakPolarHBondContact OG1-CB 3.37Å; T144-S146 PolarHBondContact OG1-N 3.35Å; T144-S146 VanDerWaalsContact OG1-N 3.12Å; T144-S146 PolarHBondContact OG1-OG 3.4Å; S146-L148 VanDerWaalsContact C-N 3.31Å; S146-L148 PolarHBondContact O-N 3.02Å; S146-K149 PolarHBondContact O-N 2.78Å; S146-G150 PolarHBondContact O-N 2.95Å
147	S	98.5	Very high	97.9	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-57.3	-45.7	171.9	-79.6	0	0	0	0	112	D119 C122 V143 T144 N145 K149 G150 I151	D119-S147 VanDerWaalsContact CA-OG 3.26Å; D119-S147 WeakPolarHBondContact CA-OG 3.49Å; D119-S147 WeakPolarHBondContact OD1-CB 3.47Å; D119-S147 PolarHBondContact OD1-N 2.95Å; D119-S147 PolarHBondContact OD1-OG 2.59Å; C122-S147 WeakPolarHBondContact CB-OG 3.47Å; C122-S147 VanDerWaalsContact SG-CB 3.51Å; C122-S147 PolarHBondContact SG-OG 2.86Å; V143-S147 WeakPolarHBondContact CG1-OG 3.39Å; T144-S147 VanDerWaalsContact O-CB 3.3Å; T144-S147 WeakPolarHBondContact O-CB 3.44Å; T144-S147 PolarHBondContact O-N 3.35Å; N145-S147 VanDerWaalsContact C-N 3.34Å; N145-S147 PolarHBondContact O-N 3.23Å; S147-K149 VanDerWaalsContact C-N 3.34Å; S147-K149 PolarHBondContact O-N 3.33Å; S147-G150 PolarHBondContact O-N 3.19Å; S147-I151 VanDerWaalsContact O-CG1 3.3Å; S147-I151 WeakPolarHBondContact O-CG1 3.36Å; S147-I151 PolarHBondContact O-N 3.12Å
148	L	98.8	Very high	97.9	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-65.4	-39.2	-177.6	-63.4	-167.2	0	0	0	112	N145 S146 I151 S152 L161 L163 I169 G173 I174 L177	N145-L148 WeakPolarHBondContact O-CB 3.28Å; N145-L148 PolarHBondContact O-N 3.44Å; S146-L148 VanDerWaalsContact C-N 3.31Å; S146-L148 PolarHBondContact O-N 3.02Å; L148-I151 HydrophobicContact CD2-CD1 4.42Å; L148-I151 PolarHBondContact O-N 3.41Å; L148-S152 WeakPolarHBondContact O-CB 3.48Å; L148-S152 PolarHBondContact O-N 3.1Å; L148-L161 HydrophobicContact CD2-CD2 4.39Å; L148-L163 HydrophobicContact CD1-CD1 3.92Å; L148-L163 HydrophobicContact CD2-CD1 3.69Å; L148-L163 HydrophobicContact CD2-CD2 3.8Å; L148-L163 HydrophobicContact CD2-CG 4.39Å; L148-L163 HydrophobicContact CG-CD1 4.46Å; L148-I169 HydrophobicContact CD1-CD1 3.81Å; L148-I169 HydrophobicContact CD1-CG1 4.3Å; L148-I169 HydrophobicContact CD1-CG2 3.59Å; L148-I169 HydrophobicContact CG-CD1 3.99Å; L148-G173 WeakPolarHBondContact CB-O 3.44Å; L148-G173 VanDerWaalsContact CD1-C 3.44Å; L148-G173 WeakPolarHBondContact CD1-O 3.22Å; L148-I174 HydrophobicContact CD1-CD1 4.27Å; L148-L177 HydrophobicContact CB-CB 4.17Å
149	K	98.6	Very high	97.9	Very high	113 Å²	113	40.1 Å²	40.1	49%	0.491	21%	0.211	S	C	.	.	H	α-helix	trans	-60.7	-47.3	170.4	-174.8	-178.5	177.8	-176.2	0	112	N145 S146 S147 I151 S152 E153 A176	N145-K149 PolarHBondContact O-N 2.86Å; N145-K149 VanDerWaalsContact O-N 3.08Å; S146-K149 PolarHBondContact O-N 2.78Å; S147-K149 VanDerWaalsContact C-N 3.34Å; S147-K149 PolarHBondContact O-N 3.33Å; K149-I151 PolarHBondContact O-N 3.19Å; K149-S152 PolarHBondContact O-N 3.42Å; K149-S152 PolarHBondContact O-OG 3.47Å; K149-E153 WeakPolarHBondContact CE-OE1 3.4Å; K149-E153 WeakPolarHBondContact O-CG 3.44Å; K149-E153 PolarHBondContact O-N 3.29Å; K149-A176 HydrophobicContact CB-CB 4.14Å
150	G	98.4	Very high	98	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-58.2	-48.2	176.6	0	0	0	0	0	111.9	S126 S146 S147 S152 E153 G154	S126-G150 WeakPolarHBondContact CB-O 3.34Å; S126-G150 PolarHBondContact OG-O 3.43Å; S146-G150 PolarHBondContact O-N 2.95Å; S147-G150 PolarHBondContact O-N 3.19Å; G150-S152 VanDerWaalsContact C-N 3.32Å; G150-S152 PolarHBondContact O-N 3.46Å; G150-E153 PolarHBondContact O-N 2.82Å; G150-G154 PolarHBondContact O-N 3.09Å
151	I	98.6	Very high	98.1	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-58.6	-43.2	178	-71	163.3	0	0	0	111	C122 L135 L137 S147 L148 K149 E153 G154 C155 L158 L177	C122-I151 HydrophobicContact CB-CD1 4.25Å; C122-I151 HydrophobicContact CB-CG1 4.18Å; L135-I151 HydrophobicContact CD2-CD1 3.65Å; L135-I151 HydrophobicContact CD2-CG1 4.24Å; L137-I151 HydrophobicContact CD1-CD1 4.12Å; S147-I151 VanDerWaalsContact O-CG1 3.3Å; S147-I151 WeakPolarHBondContact O-CG1 3.36Å; S147-I151 PolarHBondContact O-N 3.12Å; L148-I151 HydrophobicContact CD2-CD1 4.42Å; L148-I151 PolarHBondContact O-N 3.41Å; K149-I151 PolarHBondContact O-N 3.19Å; I151-E153 VanDerWaalsContact C-N 3.26Å; I151-E153 PolarHBondContact O-N 3.46Å; I151-G154 PolarHBondContact O-N 3.11Å; I151-C155 HydrophobicContact CG2-CB 4.04Å; I151-C155 WeakPolarHBondContact O-CA 3.28Å; I151-C155 WeakPolarHBondContact O-CB 3.34Å; I151-C155 PolarHBondContact O-N 2.97Å; I151-L158 HydrophobicContact CG2-CD2 3.96Å; I151-L177 HydrophobicContact CG2-CD1 4.01Å
152	S	98.4	Very high	98.3	Very high	12 Å²	12	38.4 Å²	38.4	8%	0.084	19%	0.193	C	C	.	.	H	α-helix	trans	-65.9	-28.9	-178.2	84.4	0	0	0	0	113.7	L148 K149 G150 R156 A176 L177	L148-S152 WeakPolarHBondContact O-CB 3.48Å; L148-S152 PolarHBondContact O-N 3.1Å; K149-S152 PolarHBondContact O-N 3.42Å; K149-S152 PolarHBondContact O-OG 3.47Å; G150-S152 VanDerWaalsContact C-N 3.32Å; G150-S152 PolarHBondContact O-N 3.46Å; S152-R156 VanDerWaalsContact O-CG 3.31Å; S152-R156 WeakPolarHBondContact O-CG 3.47Å; S152-A176 WeakPolarHBondContact CB-O 3.38Å; S152-A176 PolarHBondContact OG-O 2.82Å; S152-L177 WeakPolarHBondContact CB-O 3.33Å
153	E	98.1	Very high	98.4	Very high	102 Å²	102	36 Å²	36	48%	0.477	18%	0.176	S	C	.	.	H	α-helix	trans	-75.4	-42.4	178.2	-71	172.2	-175.3	0	0	112.4	K149 G150 I151 R156	K149-E153 WeakPolarHBondContact CE-OE1 3.4Å; K149-E153 WeakPolarHBondContact O-CG 3.44Å; K149-E153 PolarHBondContact O-N 3.29Å; G150-E153 PolarHBondContact O-N 2.82Å; I151-E153 VanDerWaalsContact C-N 3.26Å; I151-E153 PolarHBondContact O-N 3.46Å; E153-R156 PolarHBondContact O-NE 3.36Å; E153-R156 PolarHBondContact O-NH2 3Å
154	G	97.6	Very high	98.5	Very high	15 Å²	15	36.3 Å²	36.3	16%	0.155	18%	0.178	C	C	.	.	H	α-helix	trans	-106.1	-27.7	-169.7	0	0	0	0	0	116.3	S126 S130 G150 I151	S126-G154 WeakPolarHBondContact O-CA 3.32Å; S126-G154 WeakPolarHBondContact OG-CA 3.48Å; S126-G154 PolarHBondContact OG-N 2.78Å; S130-G154 WeakPolarHBondContact CA-O 3.33Å; S130-G154 WeakPolarHBondContact CB-O 3.46Å; G150-G154 PolarHBondContact O-N 3.09Å; I151-G154 PolarHBondContact O-N 3.11Å
155	C	98.1	Very high	98.5	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	19%	0.187	C	C	.	.			trans	-110.7	49.9	-174.5	-58.8	0	0	0	0	111.5	I151 N157 L158 C181	I151-C155 HydrophobicContact CG2-CB 4.04Å; I151-C155 WeakPolarHBondContact O-CA 3.28Å; I151-C155 WeakPolarHBondContact O-CB 3.34Å; I151-C155 PolarHBondContact O-N 2.97Å; C155-N157 PolarHBondContact O-N 3.08Å; C155-N157 VanDerWaalsContact O-N 3.17Å; C155-L158 WeakPolarHBondContact O-CB 3.41Å; C155-L158 PolarHBondContact O-N 3.34Å; C155-C181 PolarHBondContact O-SG 3.39Å; C155-C181 VanDerWaalsContact O-SG 3.33Å
156	R	98.1	Very high	98.4	Very high	160 Å²	160	37.9 Å²	37.9	60%	0.604	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-16.8	-173	-61.9	178.9	-166.6	-175.8	0.3	115	S152 E153 L158	S152-R156 VanDerWaalsContact O-CG 3.31Å; S152-R156 WeakPolarHBondContact O-CG 3.47Å; E153-R156 PolarHBondContact O-NE 3.36Å; E153-R156 PolarHBondContact O-NH2 3Å; R156-L158 PolarHBondContact O-N 2.81Å
157	N	97.9	Very high	98.2	Very high	102 Å²	102	38.9 Å²	38.9	55%	0.545	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	14.5	178.3	-59.4	-41	0	0	0	112.9	S130 L132 C155 E159	S130-N157 PolarHBondContact O-ND2 2.8Å; L132-N157 CarbonylContact O-C 3.4Å; C155-N157 PolarHBondContact O-N 3.08Å; C155-N157 VanDerWaalsContact O-N 3.17Å; N157-E159 PolarHBondContact O-N 2.78Å
158	L	98.7	Very high	98.1	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	20%	0.201	C	C	.	.			trans	-65.9	125.1	-178.6	-158.4	67.3	0	0	0	110.5	L132 L135 I151 C155 R156 L161 C181 G183 L184	L132-L158 HydrophobicContact CD2-CD1 3.34Å; L135-L158 HydrophobicContact CB-CD1 4.03Å; I151-L158 HydrophobicContact CG2-CD2 3.96Å; C155-L158 WeakPolarHBondContact O-CB 3.41Å; C155-L158 PolarHBondContact O-N 3.34Å; R156-L158 PolarHBondContact O-N 2.81Å; L158-L161 HydrophobicContact CD2-CB 3.83Å; L158-L161 HydrophobicContact CD2-CD1 4.09Å; L158-L161 HydrophobicContact CD2-CD2 4.35Å; L158-L161 HydrophobicContact CD2-CG 4.29Å; L158-C181 HydrophobicContact CB-CB 4.4Å; L158-G183 CarbonylContact O-C 3.57Å; L158-L184 HydrophobicContact CB-CD2 4.26Å; L158-L184 HydrophobicContact CD2-CD2 4.21Å; L158-L184 HydrophobicContact CG-CD2 4.08Å; L158-L184 PolarHBondContact O-N 3.08Å
159	E	98.8	Very high	98.1	Very high	55 Å²	55	43.7 Å²	43.7	26%	0.257	20%	0.201	S	C	.	.			trans	-105.6	-28.3	178.6	-61.8	-176.4	-145.6	0	0	111.1	K133 N157 K185 A186	K133-E159 IonicContact NZ-OE1 3.51Å; K133-E159 PolarHBondContact NZ-OE1 2.92Å; K133-E159 CarbonylContact O-C 3.5Å; K133-E159 WeakPolarHBondContact O-CA 3.44Å; K133-E159 PolarHBondContact O-N 2.94Å; N157-E159 PolarHBondContact O-N 2.78Å; E159-K185 HydrophobicContact CB-CD 4.42Å; E159-K185 WeakPolarHBondContact O-CA 3.44Å; E159-K185 PolarHBondContact O-N 3.36Å; E159-K185 IonicContact OE2-NZ 2.77Å; E159-K185 PolarHBondContact OE2-NZ 3.32Å; E159-A186 PolarHBondContact O-N 2.82Å
160	Y	98.9	Very high	98.1	Very high	56 Å²	56	39.6 Å²	39.6	22%	0.22	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	128.6	179	177	-74.5	0	0	0	110.1	K133 H134 L135 N162 A186 L188	K133-Y160 PolarHBondContact O-N 3.41Å; H134-Y160 WeakPolarHBondContact CA-O 3.3Å; H134-Y160 HydrophobicContact CB-CD1 4.47Å; H134-Y160 AromaticContact CD2-CD1 3.31Å; H134-Y160 WeakPolarHBondContact CD2-CD1 3.45Å; H134-Y160 AromaticContact CD2-CD2 3.86Å; H134-Y160 AromaticContact CD2-CE1 3.87Å; H134-Y160 AromaticContact CD2-CG 3.32Å; H134-Y160 AromaticContact CE1-CD1 3.39Å; H134-Y160 WeakPolarHBondContact CE1-CD1 3.4Å; H134-Y160 AromaticContact CE1-CE1 3.29Å; H134-Y160 WeakPolarHBondContact CE1-CE1 3.18Å; H134-Y160 AromaticContact CE1-CZ 4Å; H134-Y160 AromaticContact CG-CD1 3.55Å; H134-Y160 AromaticContact CG-CG 3.87Å; H134-Y160 AromaticContact ND1-CD1 3.6Å; H134-Y160 AromaticContact ND1-CE1 3.93Å; H134-Y160 AromaticContact NE2-CD1 3.23Å; H134-Y160 WeakPolarHBondContact NE2-CD1 3.45Å; H134-Y160 AromaticContact NE2-CD2 3.87Å; H134-Y160 AromaticContact NE2-CE1 3.24Å; H134-Y160 WeakPolarHBondContact NE2-CE1 3.49Å; H134-Y160 AromaticContact NE2-CE2 3.88Å; H134-Y160 AromaticContact NE2-CG 3.57Å; H134-Y160 AromaticContact NE2-CZ 3.59Å; L135-Y160 PolarHBondContact N-O 3.33Å; Y160-N162 HydrophobicContact CE1-CB 3.6Å; Y160-N162 PolarHBondContact OH-ND2 3.29Å; Y160-A186 WeakPolarHBondContact CA-O 3.48Å; Y160-A186 HydrophobicContact CD2-CB 3.5Å; Y160-A186 VanDerWaalsContact CD2-CB 3.5Å; Y160-A186 HydrophobicContact CE2-CB 4.17Å; Y160-A186 HydrophobicContact CG-CB 4.21Å; Y160-L188 HydrophobicContact CD2-CD2 4.14Å; Y160-L188 HydrophobicContact CE1-CD2 4.39Å; Y160-L188 HydrophobicContact CE2-CD2 3.55Å; Y160-L188 HydrophobicContact CE2-CG 4.48Å
161	L	98.9	Very high	98.1	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	130.3	168.9	-177.4	64.4	0	0	0	110.8	L135 L137 L148 L158 L163 L177 L184 A186 L187 L188	L135-L161 HydrophobicContact CB-CD1 3.82Å; L135-L161 HydrophobicContact CD2-CD1 3.99Å; L135-L161 HydrophobicContact CG-CD1 4.03Å; L135-L161 WeakPolarHBondContact O-CA 3.46Å; L137-L161 HydrophobicContact CD1-CD1 4.5Å; L148-L161 HydrophobicContact CD2-CD2 4.39Å; L158-L161 HydrophobicContact CD2-CB 3.83Å; L158-L161 HydrophobicContact CD2-CD1 4.09Å; L158-L161 HydrophobicContact CD2-CD2 4.35Å; L158-L161 HydrophobicContact CD2-CG 4.29Å; L161-L163 HydrophobicContact CD1-CD2 4.19Å; L161-L163 HydrophobicContact CD1-CG 4.44Å; L161-L163 HydrophobicContact CD2-CD1 3.83Å; L161-L163 HydrophobicContact CD2-CD2 4.21Å; L161-L163 HydrophobicContact CD2-CG 3.94Å; L161-L163 HydrophobicContact CG-CD1 4.39Å; L161-L163 HydrophobicContact CG-CD2 4.25Å; L161-L163 HydrophobicContact CG-CG 3.97Å; L161-L177 HydrophobicContact CD2-CD1 3.73Å; L161-L177 HydrophobicContact CD2-CD2 3.34Å; L161-L177 HydrophobicContact CD2-CG 4.16Å; L161-L184 HydrophobicContact CB-CD2 4.03Å; L161-A186 PolarHBondContact N-O 3.45Å; L161-L187 HydrophobicContact CB-CD1 4.14Å; L161-L187 HydrophobicContact CD2-CD1 4.2Å; L161-L187 HydrophobicContact CG-CD1 4.41Å; L161-L187 WeakPolarHBondContact O-CA 3.25Å; L161-L188 PolarHBondContact O-N 3.02Å
162	N	98.9	Very high	98.1	Very high	16 Å²	16	47 Å²	47	9%	0.086	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	120.5	171.6	-170.6	-11.1	0	0	0	111.1	L135 D136 L137 T138 Y160 S164 L188	L135-N162 PolarHBondContact O-N 3.22Å; D136-N162 HydrophobicContact CB-CB 4.4Å; L137-N162 WeakPolarHBondContact CA-O 3.39Å; L137-N162 PolarHBondContact N-O 3.17Å; T138-N162 PolarHBondContact OG1-ND2 2.9Å; T138-N162 VanDerWaalsContact OG1-ND2 3.1Å; T138-N162 PolarHBondContact OG1-OD1 2.96Å; Y160-N162 HydrophobicContact CE1-CB 3.6Å; Y160-N162 PolarHBondContact OH-ND2 3.29Å; N162-S164 WeakPolarHBondContact OD1-CB 3.4Å; N162-S164 PolarHBondContact OD1-N 3.04Å; N162-S164 PolarHBondContact OD1-OG 2.95Å; N162-L188 HydrophobicContact CB-CB 3.97Å; N162-L188 HydrophobicContact CB-CD2 4.45Å; N162-L188 HydrophobicContact CB-CG 4.34Å; N162-L188 WeakPolarHBondContact OD1-CB 3.32Å
163	L	98.7	Very high	98.1	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	22%	0.218	C	C	.	.			trans	-117.9	21.5	178.3	-60.2	171.2	0	0	0	111.3	L137 L148 L161 W165 C166 I174 L188 L189 C192	L137-L163 HydrophobicContact CB-CD2 4.25Å; L137-L163 HydrophobicContact CD1-CD2 3.87Å; L148-L163 HydrophobicContact CD1-CD1 3.92Å; L148-L163 HydrophobicContact CD2-CD1 3.69Å; L148-L163 HydrophobicContact CD2-CD2 3.8Å; L148-L163 HydrophobicContact CD2-CG 4.39Å; L148-L163 HydrophobicContact CG-CD1 4.46Å; L161-L163 HydrophobicContact CD1-CD2 4.19Å; L161-L163 HydrophobicContact CD1-CG 4.44Å; L161-L163 HydrophobicContact CD2-CD1 3.83Å; L161-L163 HydrophobicContact CD2-CD2 4.21Å; L161-L163 HydrophobicContact CD2-CG 3.94Å; L161-L163 HydrophobicContact CG-CD1 4.39Å; L161-L163 HydrophobicContact CG-CD2 4.25Å; L161-L163 HydrophobicContact CG-CG 3.97Å; L163-W165 PolarHBondContact O-N 2.85Å; L163-C166 HydrophobicContact CB-CB 4.34Å; L163-C166 VanDerWaalsContact O-CB 3.24Å; L163-C166 WeakPolarHBondContact O-CB 3.33Å; L163-C166 PolarHBondContact O-N 3.33Å; L163-I174 HydrophobicContact CD1-CD1 4.34Å; L163-L188 PolarHBondContact N-O 3Å; L163-L189 HydrophobicContact CB-CD2 4.13Å; L163-L189 HydrophobicContact CD1-CD2 3.87Å; L163-L189 HydrophobicContact CG-CD2 4.47Å; L163-C192 PolarHBondContact O-SG 3.23Å
164	S	98.7	Very high	98.2	Very high	7 Å²	7	41.6 Å²	41.6	5%	0.049	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	131.6	-175.5	-60	0	0	0	0	111.1	T138 S139 N162 C166 R190	T138-S164 CarbonylContact C-O 3.59Å; T138-S164 WeakPolarHBondContact CA-O 3.39Å; S139-S164 PolarHBondContact N-O 3.32Å; N162-S164 WeakPolarHBondContact OD1-CB 3.4Å; N162-S164 PolarHBondContact OD1-N 3.04Å; N162-S164 PolarHBondContact OD1-OG 2.95Å; S164-C166 PolarHBondContact O-N 2.81Å; S164-R190 CarbonylContact C-O 3.5Å; S164-R190 WeakPolarHBondContact CA-O 3.39Å
165	W	98.2	Very high	98.2	Very high	109 Å²	109	43.4 Å²	43.4	41%	0.413	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.8	23.5	-175.6	-51.2	-71.6	0	0	0	115.1	T138 L163 D167 R190	T138-W165 HydrophobicContact CG2-CE3 3.44Å; T138-W165 VanDerWaalsContact CG2-CE3 3.44Å; T138-W165 HydrophobicContact CG2-CZ3 3.44Å; T138-W165 VanDerWaalsContact CG2-CZ3 3.44Å; L163-W165 PolarHBondContact O-N 2.85Å; W165-D167 VanDerWaalsContact C-N 3.33Å; W165-D167 PolarHBondContact O-N 3.32Å; W165-R190 HydrophobicContact CZ2-CG 4.34Å; W165-R190 VanDerWaalsContact CZ2-CZ 3.45Å; W165-R190 VanDerWaalsContact CZ2-NE 3.26Å; W165-R190 PolarHBondContact N-O 3.26Å
166	C	97.4	Very high	98.2	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	21%	0.211	C	C	.	.			trans	-88.2	73.8	163.8	-64.2	0	0	0	0	109.3	L137 L163 S164 Q168 I169	L137-C166 PolarHBondContact O-SG 2.56Å; L163-C166 HydrophobicContact CB-CB 4.34Å; L163-C166 VanDerWaalsContact O-CB 3.24Å; L163-C166 WeakPolarHBondContact O-CB 3.33Å; L163-C166 PolarHBondContact O-N 3.33Å; S164-C166 PolarHBondContact O-N 2.81Å; C166-Q168 PolarHBondContact O-N 3.39Å; C166-Q168 VanDerWaalsContact O-N 3.15Å; C166-I169 HydrophobicContact CB-CG1 3.88Å; C166-I169 WeakPolarHBondContact O-CB 3.37Å; C166-I169 WeakPolarHBondContact O-CG1 3.21Å; C166-I169 PolarHBondContact O-N 3.29Å; C166-I169 VanDerWaalsContact O-N 3.16Å
167	D	94.8	Very high	98.3	Very high	70 Å²	70	37.1 Å²	37.1	37%	0.374	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-13.1	-167.8	-162.4	47.8	0	0	0	114.1	W165 I169 T193 Q194	W165-D167 VanDerWaalsContact C-N 3.33Å; W165-D167 PolarHBondContact O-N 3.32Å; D167-I169 PolarHBondContact O-N 3.02Å; D167-T193 WeakPolarHBondContact OD1-CB 3.27Å; D167-T193 PolarHBondContact OD1-N 3.23Å; D167-T193 PolarHBondContact OD1-OG1 2.61Å; D167-T193 PolarHBondContact OD2-OG1 3.2Å; D167-Q194 WeakPolarHBondContact O-CG 3.41Å; D167-Q194 PolarHBondContact O-NE2 3.16Å
168	Q	95.9	Very high	98.3	Very high	101 Å²	101	32.2 Å²	32.2	47%	0.472	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-6.1	174.8	-61.2	-173.7	-4.2	0	0	113.8	C166	C166-Q168 PolarHBondContact O-N 3.39Å; C166-Q168 VanDerWaalsContact O-N 3.15Å
169	I	98.3	Very high	98.3	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	18%	0.18	C	C	.	.			trans	-79.7	129.1	179.6	-60.9	-54.7	0	0	0	110.4	V143 T144 L148 C166 D167 I174 L195	V143-I169 HydrophobicContact CG1-CD1 4.39Å; T144-I169 WeakPolarHBondContact O-CD1 3.32Å; L148-I169 HydrophobicContact CD1-CD1 3.81Å; L148-I169 HydrophobicContact CD1-CG1 4.3Å; L148-I169 HydrophobicContact CD1-CG2 3.59Å; L148-I169 HydrophobicContact CG-CD1 3.99Å; C166-I169 HydrophobicContact CB-CG1 3.88Å; C166-I169 WeakPolarHBondContact O-CB 3.37Å; C166-I169 WeakPolarHBondContact O-CG1 3.21Å; C166-I169 PolarHBondContact O-N 3.29Å; C166-I169 VanDerWaalsContact O-N 3.16Å; D167-I169 PolarHBondContact O-N 3.02Å; I169-I174 HydrophobicContact CG2-CD1 3.98Å; I169-I174 HydrophobicContact CG2-CG1 4.14Å; I169-L195 HydrophobicContact CG2-CD2 4.46Å
170	T	98.6	Very high	98.3	Very high	27 Å²	27	37 Å²	37	17%	0.166	18%	0.178	C	C	.	.			trans	-116.3	178.6	176.4	74.9	0	0	0	0	111	N145 D172 G173 I174 Q194	N145-T170 PolarHBondContact ND2-OG1 3.25Å; N145-T170 PolarHBondContact OD1-N 2.82Å; T170-D172 PolarHBondContact O-N 3.27Å; T170-D172 PolarHBondContact OG1-N 3.16Å; T170-D172 PolarHBondContact OG1-OD2 3.18Å; T170-G173 PolarHBondContact O-N 3.16Å; T170-G173 VanDerWaalsContact O-N 3.15Å; T170-I174 PolarHBondContact O-N 3.15Å; T170-Q194 HydrophobicContact CG2-CB 4.42Å
171	K	98.6	Very high	98.2	Very high	63 Å²	63	34.3 Å²	34.3	27%	0.274	17%	0.168	S	C	.	.	H	α-helix	trans	-52.5	-34.4	174.5	66.9	-179.2	173.6	-162.8	0	114	G173 I174 E175 E196 E198 A199	K171-G173 VanDerWaalsContact C-N 3.35Å; K171-G173 PolarHBondContact O-N 3.21Å; K171-I174 PolarHBondContact O-N 2.85Å; K171-E175 PolarHBondContact O-N 2.61Å; K171-E196 HydrophobicContact CD-CG 4.44Å; K171-E196 WeakPolarHBondContact CD-OE1 3.43Å; K171-E196 WeakPolarHBondContact CE-OE1 3.47Å; K171-E196 IonicContact NZ-OE1 3.55Å; K171-E196 PolarHBondContact NZ-OE1 3.49Å; K171-E198 HydrophobicContact CD-CB 3.69Å; K171-E198 HydrophobicContact CD-CG 4.45Å; K171-A199 HydrophobicContact CB-CB 3.87Å
172	D	98.7	Very high	98.2	Very high	92 Å²	92	41.3 Å²	41.3	49%	0.492	19%	0.194	S	C	.	.	H	α-helix	trans	-68.4	-37.7	-177.9	-50.7	-58.5	0	0	0	111.4	T170 A176	T170-D172 PolarHBondContact O-N 3.27Å; T170-D172 PolarHBondContact OG1-N 3.16Å; T170-D172 PolarHBondContact OG1-OD2 3.18Å; D172-A176 WeakPolarHBondContact O-CB 3.3Å; D172-A176 PolarHBondContact O-N 3.3Å
173	G	98.7	Very high	98.1	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-65.7	-43.1	172.9	0	0	0	0	0	111.7	N145 L148 T170 K171 A176 L177	N145-G173 WeakPolarHBondContact OD1-CA 3.28Å; N145-G173 PolarHBondContact OD1-N 2.7Å; L148-G173 WeakPolarHBondContact CB-O 3.44Å; L148-G173 VanDerWaalsContact CD1-C 3.44Å; L148-G173 WeakPolarHBondContact CD1-O 3.22Å; T170-G173 PolarHBondContact O-N 3.16Å; T170-G173 VanDerWaalsContact O-N 3.15Å; K171-G173 VanDerWaalsContact C-N 3.35Å; K171-G173 PolarHBondContact O-N 3.21Å; G173-A176 PolarHBondContact O-N 2.91Å; G173-L177 WeakPolarHBondContact O-CB 3.05Å; G173-L177 PolarHBondContact O-N 3.32Å
174	I	98.8	Very high	98.1	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-62.5	-45.6	175.4	-63.6	-58.9	0	0	0	110.9	L148 L163 I169 T170 K171 A176 L177 V178 L189 L195 A199 I203	L148-I174 HydrophobicContact CD1-CD1 4.27Å; L163-I174 HydrophobicContact CD1-CD1 4.34Å; I169-I174 HydrophobicContact CG2-CD1 3.98Å; I169-I174 HydrophobicContact CG2-CG1 4.14Å; T170-I174 PolarHBondContact O-N 3.15Å; K171-I174 PolarHBondContact O-N 2.85Å; I174-A176 PolarHBondContact O-N 2.96Å; I174-L177 WeakPolarHBondContact O-CB 3.35Å; I174-L177 PolarHBondContact O-N 2.63Å; I174-V178 HydrophobicContact CG2-CG1 4.33Å; I174-V178 WeakPolarHBondContact O-CG2 3.47Å; I174-V178 PolarHBondContact O-N 2.97Å; I174-L189 HydrophobicContact CD1-CD1 4.35Å; I174-L189 HydrophobicContact CD1-CD2 3.75Å; I174-L195 HydrophobicContact CG1-CD2 3.72Å; I174-A199 HydrophobicContact CB-CB 4.33Å; I174-A199 HydrophobicContact CG1-CB 4.4Å; I174-A199 HydrophobicContact CG2-CB 4.3Å; I174-I203 HydrophobicContact CG2-CD1 3.97Å; I174-I203 HydrophobicContact CG2-CG1 3.65Å
175	E	98.8	Very high	98.1	Very high	53 Å²	53	46.2 Å²	46.2	25%	0.248	22%	0.223	C	C	.	.	H	α-helix	trans	-57.3	-50.3	176.7	-169.2	-166.9	170	0	0	111	K171 L177 V178 R179 H202	K171-E175 PolarHBondContact O-N 2.61Å; E175-L177 VanDerWaalsContact C-N 3.28Å; E175-L177 PolarHBondContact O-N 3.1Å; E175-V178 PolarHBondContact O-N 2.64Å; E175-R179 VanDerWaalsContact O-CB 3.29Å; E175-R179 WeakPolarHBondContact O-CB 3.17Å; E175-R179 PolarHBondContact O-N 3.4Å; E175-R179 VanDerWaalsContact O-N 3.08Å; E175-R179 IonicContact OE1-CZ 3.94Å; E175-R179 IonicContact OE1-NE 3.37Å; E175-R179 IonicContact OE1-NH2 3.49Å; E175-R179 PolarHBondContact OE1-NH2 2.82Å; E175-H202 HydrophobicContact CB-CB 4.33Å; E175-H202 HydrophobicContact CG-CB 4.42Å; E175-H202 IonicContact OE2-CE1 2.72Å
176	A	98.7	Very high	98.2	Very high	28 Å²	28	41.7 Å²	41.7	23%	0.231	21%	0.209	C	C	.	.	H	α-helix	trans	-58.5	-42.2	179	0	0	0	0	0	111.6	K149 S152 D172 G173 I174	K149-A176 HydrophobicContact CB-CB 4.14Å; S152-A176 WeakPolarHBondContact CB-O 3.38Å; S152-A176 PolarHBondContact OG-O 2.82Å; D172-A176 WeakPolarHBondContact O-CB 3.3Å; D172-A176 PolarHBondContact O-N 3.3Å; G173-A176 PolarHBondContact O-N 2.91Å; I174-A176 PolarHBondContact O-N 2.96Å
177	L	98.8	Very high	98.2	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-58.6	-62	176.4	175.2	68	0	0	0	111.7	L148 I151 S152 L161 G173 I174 E175 R179 G180 C181 L184 L187	L148-L177 HydrophobicContact CB-CB 4.17Å; I151-L177 HydrophobicContact CG2-CD1 4.01Å; S152-L177 WeakPolarHBondContact CB-O 3.33Å; L161-L177 HydrophobicContact CD2-CD1 3.73Å; L161-L177 HydrophobicContact CD2-CD2 3.34Å; L161-L177 HydrophobicContact CD2-CG 4.16Å; G173-L177 WeakPolarHBondContact O-CB 3.05Å; G173-L177 PolarHBondContact O-N 3.32Å; I174-L177 WeakPolarHBondContact O-CB 3.35Å; I174-L177 PolarHBondContact O-N 2.63Å; E175-L177 VanDerWaalsContact C-N 3.28Å; E175-L177 PolarHBondContact O-N 3.1Å; L177-R179 VanDerWaalsContact C-N 3.27Å; L177-R179 PolarHBondContact O-N 3.31Å; L177-G180 PolarHBondContact O-N 2.85Å; L177-G180 VanDerWaalsContact O-N 3.14Å; L177-C181 HydrophobicContact CD1-CB 4.23Å; L177-C181 PolarHBondContact O-N 3.02Å; L177-L184 HydrophobicContact CD2-CD1 4.25Å; L177-L184 HydrophobicContact CG-CD1 4.36Å; L177-L187 HydrophobicContact CD2-CD1 4.19Å
178	V	98.6	Very high	98.4	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-71.7	-24.3	-167.7	-59.6	0	0	0	0	112.1	I174 E175 G180 R182 H202 I203 Y206	I174-V178 HydrophobicContact CG2-CG1 4.33Å; I174-V178 WeakPolarHBondContact O-CG2 3.47Å; I174-V178 PolarHBondContact O-N 2.97Å; E175-V178 PolarHBondContact O-N 2.64Å; V178-G180 PolarHBondContact O-N 3.2Å; V178-R182 WeakPolarHBondContact O-CG 3.46Å; V178-H202 HydrophobicContact CG2-CB 4.15Å; V178-I203 HydrophobicContact CG1-CG1 4.12Å; V178-Y206 HydrophobicContact CB-CD2 4.45Å; V178-Y206 HydrophobicContact CG2-CD2 3.59Å; V178-Y206 HydrophobicContact CG2-CE2 4.41Å; V178-Y206 HydrophobicContact CG2-CG 4.2Å; V178-Y206 WeakPolarHBondContact O-CB 3.36Å
179	R	98.3	Very high	98.6	Very high	134 Å²	134	34.4 Å²	34.4	51%	0.506	17%	0.174	S	C	.	.	H	α-helix	trans	-59.7	-34.2	173.3	-170.8	-179.1	-77.7	-151.9	2.3	112.1	E175 L177 R182 Y206	E175-R179 VanDerWaalsContact O-CB 3.29Å; E175-R179 WeakPolarHBondContact O-CB 3.17Å; E175-R179 PolarHBondContact O-N 3.4Å; E175-R179 VanDerWaalsContact O-N 3.08Å; E175-R179 IonicContact OE1-CZ 3.94Å; E175-R179 IonicContact OE1-NE 3.37Å; E175-R179 IonicContact OE1-NH2 3.49Å; E175-R179 PolarHBondContact OE1-NH2 2.82Å; L177-R179 VanDerWaalsContact C-N 3.27Å; L177-R179 PolarHBondContact O-N 3.31Å; R179-R182 PolarHBondContact O-NE 3.41Å; R179-Y206 HydrophobicContact CG-CE1 4.26Å
180	G	98.1	Very high	98.6	Very high	21 Å²	21	38.6 Å²	38.6	22%	0.216	19%	0.19	C	C	.	.	H	α-helix	trans	-96.3	-43.8	177.8	0	0	0	0	0	114.4	L177 V178 R182	L177-G180 PolarHBondContact O-N 2.85Å; L177-G180 VanDerWaalsContact O-N 3.14Å; V178-G180 PolarHBondContact O-N 3.2Å; G180-R182 PolarHBondContact O-N 3.25Å
181	C	98.3	Very high	98.6	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.186	C	C	.	.			trans	-92.8	59.8	-176.7	-62.5	0	0	0	0	112.2	C155 L158 L177 G183 L184	C155-C181 PolarHBondContact O-SG 3.39Å; C155-C181 VanDerWaalsContact O-SG 3.33Å; L158-C181 HydrophobicContact CB-CB 4.4Å; L177-C181 HydrophobicContact CD1-CB 4.23Å; L177-C181 PolarHBondContact O-N 3.02Å; C181-G183 PolarHBondContact O-N 3.22Å; C181-L184 HydrophobicContact CB-CD1 3.96Å; C181-L184 HydrophobicContact CB-CG 4.03Å; C181-L184 WeakPolarHBondContact O-CG 3.36Å; C181-L184 PolarHBondContact O-N 2.53Å
182	R	98.1	Very high	98.6	Very high	147 Å²	147	34.8 Å²	34.8	56%	0.555	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-19	-175.3	-57.1	-175.1	-172.8	-171.3	-1.8	114.4	V178 R179 G180 L184	V178-R182 WeakPolarHBondContact O-CG 3.46Å; R179-R182 PolarHBondContact O-NE 3.41Å; G180-R182 PolarHBondContact O-N 3.25Å; R182-L184 VanDerWaalsContact C-N 3.28Å; R182-L184 PolarHBondContact O-N 3.09Å
183	G	97.9	Very high	98.5	Very high	34 Å²	34	33 Å²	33	35%	0.351	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	10.7	178.9	0	0	0	0	0	114.9	L158 C181 K185	L158-G183 CarbonylContact O-C 3.57Å; C181-G183 PolarHBondContact O-N 3.22Å; G183-K185 PolarHBondContact O-N 2.91Å
184	L	98.7	Very high	98.5	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.184	C	C	.	.			trans	-60.2	127.7	177.9	-81.2	170	0	0	0	110.9	L158 L161 L177 C181 R182 L210	L158-L184 HydrophobicContact CB-CD2 4.26Å; L158-L184 HydrophobicContact CD2-CD2 4.21Å; L158-L184 HydrophobicContact CG-CD2 4.08Å; L158-L184 PolarHBondContact O-N 3.08Å; L161-L184 HydrophobicContact CB-CD2 4.03Å; L177-L184 HydrophobicContact CD2-CD1 4.25Å; L177-L184 HydrophobicContact CG-CD1 4.36Å; C181-L184 HydrophobicContact CB-CD1 3.96Å; C181-L184 HydrophobicContact CB-CG 4.03Å; C181-L184 WeakPolarHBondContact O-CG 3.36Å; C181-L184 PolarHBondContact O-N 2.53Å; R182-L184 VanDerWaalsContact C-N 3.28Å; R182-L184 PolarHBondContact O-N 3.09Å; L184-L210 HydrophobicContact CB-CD1 4.48Å
185	K	98.8	Very high	98.4	Very high	91 Å²	91	36.9 Å²	36.9	40%	0.396	18%	0.184	S	C	.	.	S	Bend	trans	-106	-29.4	174.9	-61.8	178.5	-176.4	163.3	0	111.7	E159 G183 V211 S212	E159-K185 HydrophobicContact CB-CD 4.42Å; E159-K185 WeakPolarHBondContact O-CA 3.44Å; E159-K185 PolarHBondContact O-N 3.36Å; E159-K185 IonicContact OE2-NZ 2.77Å; E159-K185 PolarHBondContact OE2-NZ 3.32Å; G183-K185 PolarHBondContact O-N 2.91Å; K185-V211 HydrophobicContact CB-CG2 4.38Å; K185-V211 CarbonylContact O-C 3.31Å; K185-V211 WeakPolarHBondContact O-CA 3.48Å; K185-V211 WeakPolarHBondContact O-CB 3.29Å; K185-V211 PolarHBondContact O-N 2.99Å; K185-S212 PolarHBondContact O-N 3.16Å
186	A	98.9	Very high	98.4	Very high	14 Å²	14	37.6 Å²	37.6	12%	0.116	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	123.1	178	0	0	0	0	0	110.4	E159 Y160 L161 L188 S212	E159-A186 PolarHBondContact O-N 2.82Å; Y160-A186 WeakPolarHBondContact CA-O 3.48Å; Y160-A186 HydrophobicContact CD2-CB 3.5Å; Y160-A186 VanDerWaalsContact CD2-CB 3.5Å; Y160-A186 HydrophobicContact CE2-CB 4.17Å; Y160-A186 HydrophobicContact CG-CB 4.21Å; L161-A186 PolarHBondContact N-O 3.45Å; A186-L188 HydrophobicContact CB-CD2 4.07Å; A186-S212 WeakPolarHBondContact CA-O 3.4Å
187	L	98.9	Very high	98.4	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	115.2	176.7	-177.7	60.6	0	0	0	109.6	L161 L177 L189 I203 L210 S212 L213 N214	L161-L187 HydrophobicContact CB-CD1 4.14Å; L161-L187 HydrophobicContact CD2-CD1 4.2Å; L161-L187 HydrophobicContact CG-CD1 4.41Å; L161-L187 WeakPolarHBondContact O-CA 3.25Å; L177-L187 HydrophobicContact CD2-CD1 4.19Å; L187-L189 HydrophobicContact CD1-CD2 4.03Å; L187-L189 HydrophobicContact CD1-CG 4.31Å; L187-L189 HydrophobicContact CD2-CD1 3.88Å; L187-L189 HydrophobicContact CD2-CG 4.37Å; L187-L189 HydrophobicContact CG-CD1 3.97Å; L187-L189 HydrophobicContact CG-CD2 4.17Å; L187-L189 HydrophobicContact CG-CG 3.92Å; L187-I203 HydrophobicContact CD2-CD1 3.72Å; L187-I203 HydrophobicContact CD2-CG1 3.95Å; L187-L210 HydrophobicContact CB-CD1 3.99Å; L187-S212 PolarHBondContact N-O 3.3Å; L187-L213 HydrophobicContact CB-CD1 4.26Å; L187-L213 HydrophobicContact CD2-CD1 4.48Å; L187-L213 HydrophobicContact CG-CD1 4.44Å; L187-L213 WeakPolarHBondContact O-CA 3.43Å; L187-L213 WeakPolarHBondContact O-CD1 3.26Å; L187-N214 PolarHBondContact O-N 3.09Å
188	L	98.9	Very high	98.4	Very high	19 Å²	19	40.9 Å²	40.9	10%	0.099	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	116.1	-174.9	-57.8	-62.9	0	0	0	108.3	Y160 L161 N162 L163 A186 N214	Y160-L188 HydrophobicContact CD2-CD2 4.14Å; Y160-L188 HydrophobicContact CE1-CD2 4.39Å; Y160-L188 HydrophobicContact CE2-CD2 3.55Å; Y160-L188 HydrophobicContact CE2-CG 4.48Å; L161-L188 PolarHBondContact O-N 3.02Å; N162-L188 HydrophobicContact CB-CB 3.97Å; N162-L188 HydrophobicContact CB-CD2 4.45Å; N162-L188 HydrophobicContact CB-CG 4.34Å; N162-L188 WeakPolarHBondContact OD1-CB 3.32Å; L163-L188 PolarHBondContact N-O 3Å; A186-L188 HydrophobicContact CB-CD2 4.07Å; L188-N214 HydrophobicContact CB-CB 4.37Å; L188-N214 HydrophobicContact CD1-CB 3.43Å; L188-N214 VanDerWaalsContact CD1-CB 3.43Å
189	L	98.8	Very high	98.4	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.199	C	C	.	.			trans	-125.7	21.2	-171.6	-59.5	169.9	0	0	0	111.8	L163 I174 L187 G191 C192 L195 I203 L213 N214 L215 C218	L163-L189 HydrophobicContact CB-CD2 4.13Å; L163-L189 HydrophobicContact CD1-CD2 3.87Å; L163-L189 HydrophobicContact CG-CD2 4.47Å; I174-L189 HydrophobicContact CD1-CD1 4.35Å; I174-L189 HydrophobicContact CD1-CD2 3.75Å; L187-L189 HydrophobicContact CD1-CD2 4.03Å; L187-L189 HydrophobicContact CD1-CG 4.31Å; L187-L189 HydrophobicContact CD2-CD1 3.88Å; L187-L189 HydrophobicContact CD2-CG 4.37Å; L187-L189 HydrophobicContact CG-CD1 3.97Å; L187-L189 HydrophobicContact CG-CD2 4.17Å; L187-L189 HydrophobicContact CG-CG 3.92Å; L189-G191 PolarHBondContact O-N 3.03Å; L189-C192 WeakPolarHBondContact O-CB 3.47Å; L189-C192 PolarHBondContact O-N 2.97Å; L189-C192 VanDerWaalsContact O-N 3.08Å; L189-L195 HydrophobicContact CB-CD1 3.83Å; L189-L195 HydrophobicContact CD1-CD1 3.73Å; L189-L195 HydrophobicContact CD2-CD1 4.18Å; L189-L195 HydrophobicContact CG-CD1 4.11Å; L189-I203 HydrophobicContact CD1-CD1 3.96Å; L189-L213 HydrophobicContact CD1-CD1 4.36Å; L189-N214 CarbonylContact C-O 3.2Å; L189-N214 WeakPolarHBondContact CA-O 3.33Å; L189-N214 WeakPolarHBondContact CB-O 3.31Å; L189-N214 PolarHBondContact N-O 2.59Å; L189-L215 HydrophobicContact CB-CD2 4.18Å; L189-L215 HydrophobicContact CD1-CD2 3.83Å; L189-C218 PolarHBondContact O-SG 2.89Å
190	R	98.7	Very high	98.4	Very high	88 Å²	88	34.5 Å²	34.5	33%	0.332	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52	129	-179	167.4	176.1	-176.1	177.1	1.2	110.8	S164 W165 C192 Q216	S164-R190 CarbonylContact C-O 3.5Å; S164-R190 WeakPolarHBondContact CA-O 3.39Å; W165-R190 HydrophobicContact CZ2-CG 4.34Å; W165-R190 VanDerWaalsContact CZ2-CZ 3.45Å; W165-R190 VanDerWaalsContact CZ2-NE 3.26Å; W165-R190 PolarHBondContact N-O 3.26Å; R190-C192 PolarHBondContact O-N 3.04Å; R190-Q216 CarbonylContact C-O 3.45Å; R190-Q216 VanDerWaalsContact CA-O 3.31Å; R190-Q216 WeakPolarHBondContact CA-O 3.09Å; R190-Q216 HydrophobicContact CB-CB 4.11Å; R190-Q216 HydrophobicContact CG-CB 3.87Å; R190-Q216 HydrophobicContact CG-CG 4.18Å; R190-Q216 VanDerWaalsContact CZ-OE1 3.25Å; R190-Q216 VanDerWaalsContact NE-OE1 3.09Å
191	G	98.1	Very high	98.4	Very high	9 Å²	9	35.8 Å²	35.8	9%	0.093	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.6	14.1	175.9	0	0	0	0	0	114.5	L189 T193 Q216	L189-G191 PolarHBondContact O-N 3.03Å; G191-T193 VanDerWaalsContact C-N 3.31Å; G191-T193 PolarHBondContact O-N 2.62Å; G191-Q216 PolarHBondContact N-O 2.93Å
192	C	98.1	Very high	98.4	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.18	C	C	.	.			trans	-80.6	81.2	164.4	-66	0	0	0	0	108.7	L163 L189 R190 Q194 L195 C218	L163-C192 PolarHBondContact O-SG 3.23Å; L189-C192 WeakPolarHBondContact O-CB 3.47Å; L189-C192 PolarHBondContact O-N 2.97Å; L189-C192 VanDerWaalsContact O-N 3.08Å; R190-C192 PolarHBondContact O-N 3.04Å; C192-Q194 PolarHBondContact O-N 3.34Å; C192-L195 HydrophobicContact CB-CD1 3.61Å; C192-L195 HydrophobicContact CB-CG 3.77Å; C192-L195 WeakPolarHBondContact O-CG 3.39Å; C192-L195 PolarHBondContact O-N 3.36Å; C192-C218 PolarHBondContact O-SG 2.94Å
193	T	97.6	Very high	98.5	Very high	54 Å²	54	30.1 Å²	30.1	33%	0.331	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-12.3	-166.8	69.7	0	0	0	0	113.9	D167 G191 L195 R220	D167-T193 WeakPolarHBondContact OD1-CB 3.27Å; D167-T193 PolarHBondContact OD1-N 3.23Å; D167-T193 PolarHBondContact OD1-OG1 2.61Å; D167-T193 PolarHBondContact OD2-OG1 3.2Å; G191-T193 VanDerWaalsContact C-N 3.31Å; G191-T193 PolarHBondContact O-N 2.62Å; T193-L195 VanDerWaalsContact C-N 3.33Å; T193-R220 VanDerWaalsContact O-CD 3.28Å; T193-R220 WeakPolarHBondContact O-CD 3.44Å; T193-R220 PolarHBondContact O-NE 2.69Å; T193-R220 VanDerWaalsContact O-NE 3.17Å
194	Q	97.5	Very high	98.4	Very high	83 Å²	83	29.7 Å²	29.7	39%	0.388	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-6.5	174.8	-63.8	-159.4	80.4	0	0	114	D167 T170 C192	D167-Q194 WeakPolarHBondContact O-CG 3.41Å; D167-Q194 PolarHBondContact O-NE2 3.16Å; T170-Q194 HydrophobicContact CG2-CB 4.42Å; C192-Q194 PolarHBondContact O-N 3.34Å
195	L	98.3	Very high	98.4	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.165	C	C	.	.			trans	-77	133.4	179.4	-62.3	-176.1	0	0	0	111.9	I169 I174 L189 C192 T193 A199 R220	I169-L195 HydrophobicContact CG2-CD2 4.46Å; I174-L195 HydrophobicContact CG1-CD2 3.72Å; L189-L195 HydrophobicContact CB-CD1 3.83Å; L189-L195 HydrophobicContact CD1-CD1 3.73Å; L189-L195 HydrophobicContact CD2-CD1 4.18Å; L189-L195 HydrophobicContact CG-CD1 4.11Å; C192-L195 HydrophobicContact CB-CD1 3.61Å; C192-L195 HydrophobicContact CB-CG 3.77Å; C192-L195 WeakPolarHBondContact O-CG 3.39Å; C192-L195 PolarHBondContact O-N 3.36Å; T193-L195 VanDerWaalsContact C-N 3.33Å; L195-A199 HydrophobicContact CD2-CB 4.06Å; L195-R220 WeakPolarHBondContact O-CB 3.41Å
196	E	97.7	Very high	98.4	Very high	67 Å²	67	32 Å²	32	31%	0.313	16%	0.156	S	C	.	.			trans	-129.3	176.6	-179.9	63.3	-174.5	-171.2	0	0	110.5	K171 E198 A199 R220	K171-E196 HydrophobicContact CD-CG 4.44Å; K171-E196 WeakPolarHBondContact CD-OE1 3.43Å; K171-E196 WeakPolarHBondContact CE-OE1 3.47Å; K171-E196 IonicContact NZ-OE1 3.55Å; K171-E196 PolarHBondContact NZ-OE1 3.49Å; E196-E198 PolarHBondContact O-N 3.28Å; E196-E198 VanDerWaalsContact O-N 3.08Å; E196-A199 VanDerWaalsContact O-CB 3.3Å; E196-A199 WeakPolarHBondContact O-CB 3.46Å; E196-A199 PolarHBondContact O-N 2.86Å; E196-R220 HydrophobicContact CB-CB 4.4Å
197	D	98.7	Very high	98.4	Very high	25 Å²	25	31.4 Å²	31.4	13%	0.134	15%	0.151	C	C	.	.	H	α-helix	trans	-56.5	-30.4	-171	-65.3	-31.6	0	0	0	114.8	A199 L200 K201 I221 T222 G225	D197-A199 VanDerWaalsContact C-N 3.29Å; D197-A199 PolarHBondContact O-N 3.12Å; D197-L200 WeakPolarHBondContact O-CB 3.48Å; D197-L200 PolarHBondContact O-N 3.41Å; D197-L200 VanDerWaalsContact O-N 3.08Å; D197-K201 PolarHBondContact O-N 3.06Å; D197-I221 WeakPolarHBondContact OD1-CA 3.34Å; D197-T222 PolarHBondContact OD1-N 3.25Å; D197-T222 WeakPolarHBondContact OD2-CB 3.32Å; D197-T222 PolarHBondContact OD2-OG1 2.9Å; D197-G225 WeakPolarHBondContact OD1-CA 3.37Å; D197-G225 PolarHBondContact OD1-N 3.06Å
198	E	98.6	Very high	98.3	Very high	72 Å²	72	36 Å²	36	34%	0.336	17%	0.172	S	C	.	.	H	α-helix	trans	-61.6	-36.1	175.2	-70.7	-56.1	134.4	0	0	112.4	K171 E196 L200 K201 H202	K171-E198 HydrophobicContact CD-CB 3.69Å; K171-E198 HydrophobicContact CD-CG 4.45Å; E196-E198 PolarHBondContact O-N 3.28Å; E196-E198 VanDerWaalsContact O-N 3.08Å; E198-L200 VanDerWaalsContact C-N 3.28Å; E198-L200 PolarHBondContact O-N 3.09Å; E198-K201 PolarHBondContact O-N 3.3Å; E198-K201 IonicContact OE1-NZ 3.91Å; E198-K201 PolarHBondContact OE1-NZ 3.37Å; E198-H202 PolarHBondContact O-CD2 3.01Å; E198-H202 PolarHBondContact O-N 3.37Å
199	A	98.7	Very high	98.3	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.008	18%	0.183	C	C	.	.	H	α-helix	trans	-61.8	-40	173.7	0	0	0	0	0	111.3	K171 I174 L195 E196 D197 H202 I203	K171-A199 HydrophobicContact CB-CB 3.87Å; I174-A199 HydrophobicContact CB-CB 4.33Å; I174-A199 HydrophobicContact CG1-CB 4.4Å; I174-A199 HydrophobicContact CG2-CB 4.3Å; L195-A199 HydrophobicContact CD2-CB 4.06Å; E196-A199 VanDerWaalsContact O-CB 3.3Å; E196-A199 WeakPolarHBondContact O-CB 3.46Å; E196-A199 PolarHBondContact O-N 2.86Å; D197-A199 VanDerWaalsContact C-N 3.29Å; D197-A199 PolarHBondContact O-N 3.12Å; A199-H202 PolarHBondContact O-N 3.28Å; A199-I203 WeakPolarHBondContact O-CG1 3.49Å; A199-I203 PolarHBondContact O-N 3.33Å
200	L	98.8	Very high	98.3	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-68.2	-38.3	177.8	-61.1	-165.1	0	0	0	111.9	D197 E198 H202 I203 Q204 L215 I221 V226 I229	D197-L200 WeakPolarHBondContact O-CB 3.48Å; D197-L200 PolarHBondContact O-N 3.41Å; D197-L200 VanDerWaalsContact O-N 3.08Å; E198-L200 VanDerWaalsContact C-N 3.28Å; E198-L200 PolarHBondContact O-N 3.09Å; L200-H202 VanDerWaalsContact C-N 3.3Å; L200-H202 PolarHBondContact O-N 3.32Å; L200-I203 HydrophobicContact CD2-CD1 3.99Å; L200-I203 PolarHBondContact O-N 3.41Å; L200-Q204 PolarHBondContact O-N 2.95Å; L200-L215 HydrophobicContact CD1-CD1 3.93Å; L200-L215 HydrophobicContact CD2-CD1 3.72Å; L200-L215 HydrophobicContact CD2-CD2 3.77Å; L200-L215 HydrophobicContact CD2-CG 4.41Å; L200-I221 HydrophobicContact CD1-CB 4.12Å; L200-I221 HydrophobicContact CD1-CD1 4.36Å; L200-I221 HydrophobicContact CD1-CG2 4.01Å; L200-I221 HydrophobicContact CG-CG2 4.43Å; L200-V226 HydrophobicContact CD1-CG2 4.28Å; L200-I229 HydrophobicContact CB-CD1 4.15Å; L200-I229 HydrophobicContact CB-CG1 3.82Å; L200-I229 HydrophobicContact CD1-CG1 4.31Å; L200-I229 HydrophobicContact CD2-CD1 4.37Å; L200-I229 HydrophobicContact CD2-CG1 4.33Å; L200-I229 HydrophobicContact CG-CG1 4.37Å; L200-I229 WeakPolarHBondContact O-CD1 3.45Å
201	K	98.4	Very high	98.3	Very high	47 Å²	47	36.1 Å²	36.1	20%	0.204	18%	0.178	C	C	.	.	H	α-helix	trans	-61.6	-37.1	171.8	-70	177.9	-170.2	169.8	0	112.4	D197 E198 Q204 N205 E224 Q228	D197-K201 PolarHBondContact O-N 3.06Å; E198-K201 PolarHBondContact O-N 3.3Å; E198-K201 IonicContact OE1-NZ 3.91Å; E198-K201 PolarHBondContact OE1-NZ 3.37Å; K201-Q204 WeakPolarHBondContact O-CG 3.32Å; K201-Q204 PolarHBondContact O-NE2 2.76Å; K201-Q204 VanDerWaalsContact O-NE2 3.1Å; K201-N205 WeakPolarHBondContact O-CB 3.47Å; K201-N205 PolarHBondContact O-N 2.92Å; K201-N205 PolarHBondContact O-ND2 2.84Å; K201-N205 VanDerWaalsContact O-ND2 3.14Å; K201-E224 VanDerWaalsContact CE-OE1 3.29Å; K201-E224 WeakPolarHBondContact CE-OE1 3.49Å; K201-E224 IonicContact NZ-OE1 2.78Å; K201-Q228 HydrophobicContact CG-CB 4.27Å; K201-Q228 HydrophobicContact CG-CG 4.13Å
202	H	98.8	Very high	98.3	Very high	29 Å²	29	37.2 Å²	37.2	13%	0.134	18%	0.184	C	C	.	.	H	α-helix	trans	-66	-46.3	172.9	-62.5	-48	0	0	0	111.4	E175 V178 E198 A199 L200 Q204 N205 Y206	E175-H202 HydrophobicContact CB-CB 4.33Å; E175-H202 HydrophobicContact CG-CB 4.42Å; E175-H202 IonicContact OE2-CE1 2.72Å; V178-H202 HydrophobicContact CG2-CB 4.15Å; E198-H202 PolarHBondContact O-CD2 3.01Å; E198-H202 PolarHBondContact O-N 3.37Å; A199-H202 PolarHBondContact O-N 3.28Å; L200-H202 VanDerWaalsContact C-N 3.3Å; L200-H202 PolarHBondContact O-N 3.32Å; H202-Q204 PolarHBondContact O-N 2.98Å; H202-N205 WeakPolarHBondContact O-CB 3.24Å; H202-N205 PolarHBondContact O-N 2.76Å; H202-Y206 VanDerWaalsContact O-CD2 3.27Å; H202-Y206 WeakPolarHBondContact O-CD2 3.46Å; H202-Y206 PolarHBondContact O-N 2.99Å
203	I	98.8	Very high	98.4	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-57.1	-50.7	179.5	-67.5	162.3	0	0	0	110.8	I174 V178 L187 L189 A199 L200 N205 Y206 C207 L210 I229	I174-I203 HydrophobicContact CG2-CD1 3.97Å; I174-I203 HydrophobicContact CG2-CG1 3.65Å; V178-I203 HydrophobicContact CG1-CG1 4.12Å; L187-I203 HydrophobicContact CD2-CD1 3.72Å; L187-I203 HydrophobicContact CD2-CG1 3.95Å; L189-I203 HydrophobicContact CD1-CD1 3.96Å; A199-I203 WeakPolarHBondContact O-CG1 3.49Å; A199-I203 PolarHBondContact O-N 3.33Å; L200-I203 HydrophobicContact CD2-CD1 3.99Å; L200-I203 PolarHBondContact O-N 3.41Å; I203-N205 VanDerWaalsContact C-N 3.26Å; I203-N205 PolarHBondContact O-N 2.95Å; I203-Y206 PolarHBondContact O-N 2.77Å; I203-C207 HydrophobicContact CG2-CB 4.21Å; I203-C207 WeakPolarHBondContact O-CB 3.33Å; I203-C207 PolarHBondContact O-N 2.81Å; I203-L210 HydrophobicContact CG2-CD2 3.89Å; I203-I229 HydrophobicContact CB-CD1 3.78Å; I203-I229 HydrophobicContact CG2-CD1 3.63Å
204	Q	97.5	Very high	98.4	Very high	25 Å²	25	35.9 Å²	35.9	12%	0.117	18%	0.175	C	C	.	.	H	α-helix	trans	-64.4	-30.5	-178	73.7	75.7	31.3	0	0	113.1	L200 K201 H202 Y206 H208 Q228 I229	L200-Q204 PolarHBondContact O-N 2.95Å; K201-Q204 WeakPolarHBondContact O-CG 3.32Å; K201-Q204 PolarHBondContact O-NE2 2.76Å; K201-Q204 VanDerWaalsContact O-NE2 3.1Å; H202-Q204 PolarHBondContact O-N 2.98Å; Q204-Y206 VanDerWaalsContact C-N 3.25Å; Q204-Y206 PolarHBondContact O-N 2.87Å; Q204-H208 PolarHBondContact O-CE1 3.39Å; Q204-H208 PolarHBondContact O-ND1 3.34Å; Q204-Q228 VanDerWaalsContact CB-O 3.3Å; Q204-Q228 WeakPolarHBondContact CB-O 3.43Å; Q204-Q228 HydrophobicContact CG-CB 4.01Å; Q204-Q228 WeakPolarHBondContact CG-O 3.46Å; Q204-I229 HydrophobicContact CB-CD1 4.27Å
205	N	98.4	Very high	98.5	Very high	87 Å²	87	32 Å²	32	47%	0.465	16%	0.157	S	C	.	.	H	α-helix	trans	-67.6	-22.3	179.2	-90	-28.6	0	0	0	113.7	K201 H202 I203 H208	K201-N205 WeakPolarHBondContact O-CB 3.47Å; K201-N205 PolarHBondContact O-N 2.92Å; K201-N205 PolarHBondContact O-ND2 2.84Å; K201-N205 VanDerWaalsContact O-ND2 3.14Å; H202-N205 WeakPolarHBondContact O-CB 3.24Å; H202-N205 PolarHBondContact O-N 2.76Å; I203-N205 VanDerWaalsContact C-N 3.26Å; I203-N205 PolarHBondContact O-N 2.95Å; N205-H208 PolarHBondContact O-NE2 3.45Å
206	Y	98.6	Very high	98.5	Very high	53 Å²	53	33.3 Å²	33.3	21%	0.208	16%	0.163	C	C	.	.	H	α-helix	trans	-127.8	-27.7	-171.3	-64.7	-74.9	0	0	0	114.3	V178 R179 H202 I203 Q204	V178-Y206 HydrophobicContact CB-CD2 4.45Å; V178-Y206 HydrophobicContact CG2-CD2 3.59Å; V178-Y206 HydrophobicContact CG2-CE2 4.41Å; V178-Y206 HydrophobicContact CG2-CG 4.2Å; V178-Y206 WeakPolarHBondContact O-CB 3.36Å; R179-Y206 HydrophobicContact CG-CE1 4.26Å; H202-Y206 VanDerWaalsContact O-CD2 3.27Å; H202-Y206 WeakPolarHBondContact O-CD2 3.46Å; H202-Y206 PolarHBondContact O-N 2.99Å; I203-Y206 PolarHBondContact O-N 2.77Å; Q204-Y206 VanDerWaalsContact C-N 3.25Å; Q204-Y206 PolarHBondContact O-N 2.87Å
207	C	98	Very high	98.5	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.163	C	C	.	.			trans	-107.1	60.4	-173	-62.3	0	0	0	0	112.1	I203 E209 L210 C233	I203-C207 HydrophobicContact CG2-CB 4.21Å; I203-C207 WeakPolarHBondContact O-CB 3.33Å; I203-C207 PolarHBondContact O-N 2.81Å; C207-E209 PolarHBondContact O-N 3.27Å; C207-L210 HydrophobicContact CB-CB 4.41Å; C207-L210 VanDerWaalsContact O-CB 3.28Å; C207-L210 WeakPolarHBondContact O-CB 3.42Å; C207-L210 PolarHBondContact O-N 3.2Å; C207-C233 PolarHBondContact O-SG 2.76Å
208	H	98.3	Very high	98.5	Very high	98 Å²	98	31 Å²	31	45%	0.454	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-18.2	179.4	-52.8	-58.9	0	0	0	114	Q204 N205 L210 G232	Q204-H208 PolarHBondContact O-CE1 3.39Å; Q204-H208 PolarHBondContact O-ND1 3.34Å; N205-H208 PolarHBondContact O-NE2 3.45Å; H208-L210 VanDerWaalsContact C-N 3.29Å; H208-G232 WeakPolarHBondContact CA-O 3.49Å; H208-G232 PolarHBondContact ND1-O 3.43Å; H208-G232 VanDerWaalsContact ND1-O 3.1Å
209	E	97.8	Very high	98.3	Very high	71 Å²	71	30.1 Å²	30.1	33%	0.332	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90	9.1	179.3	-65.9	-62.5	142.8	0	0	113.1	C207 V211 R235	C207-E209 PolarHBondContact O-N 3.27Å; E209-V211 PolarHBondContact O-N 3.24Å; E209-R235 IonicContact OE1-CZ 3.52Å; E209-R235 VanDerWaalsContact OE1-CZ 3.25Å; E209-R235 IonicContact OE1-NE 3.25Å; E209-R235 PolarHBondContact OE1-NE 3.3Å; E209-R235 IonicContact OE1-NH1 2.63Å; E209-R235 IonicContact OE1-NH2 3.2Å; E209-R235 PolarHBondContact OE1-NH2 3.39Å; E209-R235 WeakPolarHBondContact OE2-CD 3.38Å; E209-R235 IonicContact OE2-CZ 2.61Å; E209-R235 IonicContact OE2-NE 3.08Å; E209-R235 PolarHBondContact OE2-NE 3.49Å; E209-R235 IonicContact OE2-NH1 3.86Å; E209-R235 PolarHBondContact OE2-NH1 3.08Å; E209-R235 IonicContact OE2-NH2 2.99Å
210	L	98.8	Very high	98.3	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.185	C	C	.	.			trans	-66.4	126.8	-178.2	-159.4	71	0	0	0	111	L184 L187 I203 C207 H208 L213 C233 R235 L236	L184-L210 HydrophobicContact CB-CD1 4.48Å; L187-L210 HydrophobicContact CB-CD1 3.99Å; I203-L210 HydrophobicContact CG2-CD2 3.89Å; C207-L210 HydrophobicContact CB-CB 4.41Å; C207-L210 VanDerWaalsContact O-CB 3.28Å; C207-L210 WeakPolarHBondContact O-CB 3.42Å; C207-L210 PolarHBondContact O-N 3.2Å; H208-L210 VanDerWaalsContact C-N 3.29Å; L210-L213 HydrophobicContact CD2-CB 3.92Å; L210-L213 HydrophobicContact CD2-CD1 4.23Å; L210-L213 HydrophobicContact CD2-CD2 4.2Å; L210-L213 HydrophobicContact CD2-CG 4.34Å; L210-C233 HydrophobicContact CB-CB 4.28Å; L210-R235 CarbonylContact O-C 3.38Å; L210-R235 VanDerWaalsContact O-C 3.31Å; L210-L236 HydrophobicContact CD2-CD2 4.48Å; L210-L236 HydrophobicContact CG-CD2 4.46Å; L210-L236 PolarHBondContact O-N 3.19Å
211	V	98.9	Very high	98.3	Very high	38 Å²	38	37.2 Å²	37.2	23%	0.23	19%	0.185	C	C	.	.			trans	-109.6	-36.3	-179.1	178.5	0	0	0	0	110.7	K185 E209 Q237 A238	K185-V211 HydrophobicContact CB-CG2 4.38Å; K185-V211 CarbonylContact O-C 3.31Å; K185-V211 WeakPolarHBondContact O-CA 3.48Å; K185-V211 WeakPolarHBondContact O-CB 3.29Å; K185-V211 PolarHBondContact O-N 2.99Å; E209-V211 PolarHBondContact O-N 3.24Å; V211-Q237 HydrophobicContact CG1-CB 3.82Å; V211-Q237 HydrophobicContact CG1-CG 3.89Å; V211-Q237 PolarHBondContact O-N 3.14Å; V211-A238 PolarHBondContact O-N 3.48Å
212	S	98.9	Very high	98.3	Very high	31 Å²	31	37.2 Å²	37.2	22%	0.217	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	129.8	179.1	179.3	0	0	0	0	111.4	K185 A186 L187 A238	K185-S212 PolarHBondContact O-N 3.16Å; A186-S212 WeakPolarHBondContact CA-O 3.4Å; L187-S212 PolarHBondContact N-O 3.3Å; S212-A238 CarbonylContact C-O 3.52Å; S212-A238 VanDerWaalsContact CA-O 3.29Å; S212-A238 WeakPolarHBondContact CA-O 3.46Å
213	L	98.9	Very high	98.3	Very high	1 Å²	1	37.2 Å²	37.2	1%	0.005	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	127.4	174.2	-178.8	59.2	0	0	0	109.4	L187 L189 L210 L215 I229 L236 A238 L239 C240	L187-L213 HydrophobicContact CB-CD1 4.26Å; L187-L213 HydrophobicContact CD2-CD1 4.48Å; L187-L213 HydrophobicContact CG-CD1 4.44Å; L187-L213 WeakPolarHBondContact O-CA 3.43Å; L187-L213 WeakPolarHBondContact O-CD1 3.26Å; L189-L213 HydrophobicContact CD1-CD1 4.36Å; L210-L213 HydrophobicContact CD2-CB 3.92Å; L210-L213 HydrophobicContact CD2-CD1 4.23Å; L210-L213 HydrophobicContact CD2-CD2 4.2Å; L210-L213 HydrophobicContact CD2-CG 4.34Å; L213-L215 HydrophobicContact CD1-CD2 4.16Å; L213-L215 HydrophobicContact CD1-CG 4.18Å; L213-L215 HydrophobicContact CD2-CD1 3.85Å; L213-L215 HydrophobicContact CD2-CG 4.24Å; L213-L215 HydrophobicContact CG-CD1 4.11Å; L213-L215 HydrophobicContact CG-CD2 4.46Å; L213-L215 HydrophobicContact CG-CG 3.95Å; L213-I229 HydrophobicContact CD2-CD1 3.97Å; L213-I229 HydrophobicContact CD2-CG1 4.23Å; L213-I229 HydrophobicContact CD2-CG2 3.83Å; L213-L236 HydrophobicContact CB-CD2 4.04Å; L213-A238 PolarHBondContact N-O 3.16Å; L213-L239 HydrophobicContact CB-CD1 3.93Å; L213-L239 HydrophobicContact CD2-CD1 4.06Å; L213-L239 HydrophobicContact CG-CD1 4.1Å; L213-L239 WeakPolarHBondContact O-CA 3.15Å; L213-C240 PolarHBondContact O-N 3.23Å
214	N	98.9	Very high	98.3	Very high	26 Å²	26	41.4 Å²	41.4	14%	0.139	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	118.3	173.5	-172.6	-40.9	0	0	0	109.7	L187 L188 L189 Q216 C240	L187-N214 PolarHBondContact O-N 3.09Å; L188-N214 HydrophobicContact CB-CB 4.37Å; L188-N214 HydrophobicContact CD1-CB 3.43Å; L188-N214 VanDerWaalsContact CD1-CB 3.43Å; L189-N214 CarbonylContact C-O 3.2Å; L189-N214 WeakPolarHBondContact CA-O 3.33Å; L189-N214 WeakPolarHBondContact CB-O 3.31Å; L189-N214 PolarHBondContact N-O 2.59Å; N214-Q216 VanDerWaalsContact OD1-CB 3.22Å; N214-Q216 WeakPolarHBondContact OD1-CB 3.39Å; N214-Q216 PolarHBondContact OD1-N 2.99Å; N214-C240 HydrophobicContact CB-CB 4.21Å
215	L	98.8	Very high	98.4	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.005	20%	0.204	C	C	.	.			trans	-120.1	22	180	-63	169.7	0	0	0	111.2	L189 L200 L213 S217 C218 I221 C240 L241 C244	L189-L215 HydrophobicContact CB-CD2 4.18Å; L189-L215 HydrophobicContact CD1-CD2 3.83Å; L200-L215 HydrophobicContact CD1-CD1 3.93Å; L200-L215 HydrophobicContact CD2-CD1 3.72Å; L200-L215 HydrophobicContact CD2-CD2 3.77Å; L200-L215 HydrophobicContact CD2-CG 4.41Å; L213-L215 HydrophobicContact CD1-CD2 4.16Å; L213-L215 HydrophobicContact CD1-CG 4.18Å; L213-L215 HydrophobicContact CD2-CD1 3.85Å; L213-L215 HydrophobicContact CD2-CG 4.24Å; L213-L215 HydrophobicContact CG-CD1 4.11Å; L213-L215 HydrophobicContact CG-CD2 4.46Å; L213-L215 HydrophobicContact CG-CG 3.95Å; L215-S217 PolarHBondContact O-N 2.95Å; L215-C218 HydrophobicContact CB-CB 4.32Å; L215-C218 VanDerWaalsContact O-CB 3.26Å; L215-C218 WeakPolarHBondContact O-CB 3.28Å; L215-C218 PolarHBondContact O-N 2.9Å; L215-I221 HydrophobicContact CB-CD1 4.07Å; L215-I221 HydrophobicContact CD1-CD1 3.89Å; L215-C240 WeakPolarHBondContact CA-O 3.31Å; L215-C240 PolarHBondContact N-O 3.06Å; L215-L241 HydrophobicContact CB-CD2 4.33Å; L215-L241 HydrophobicContact CD1-CD2 3.92Å; L215-C244 PolarHBondContact O-SG 3Å; L215-C244 VanDerWaalsContact O-SG 3.35Å
216	Q	98.8	Very high	98.4	Very high	27 Å²	27	36.1 Å²	36.1	13%	0.126	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.5	130.4	-178.7	179.2	175.7	7.4	0	0	110.8	R190 G191 N214 C218 S242	R190-Q216 CarbonylContact C-O 3.45Å; R190-Q216 VanDerWaalsContact CA-O 3.31Å; R190-Q216 WeakPolarHBondContact CA-O 3.09Å; R190-Q216 HydrophobicContact CB-CB 4.11Å; R190-Q216 HydrophobicContact CG-CB 3.87Å; R190-Q216 HydrophobicContact CG-CG 4.18Å; R190-Q216 VanDerWaalsContact CZ-OE1 3.25Å; R190-Q216 VanDerWaalsContact NE-OE1 3.09Å; G191-Q216 PolarHBondContact N-O 2.93Å; N214-Q216 VanDerWaalsContact OD1-CB 3.22Å; N214-Q216 WeakPolarHBondContact OD1-CB 3.39Å; N214-Q216 PolarHBondContact OD1-N 2.99Å; Q216-C218 PolarHBondContact O-N 2.92Å; Q216-S242 CarbonylContact C-O 3.51Å; Q216-S242 VanDerWaalsContact CA-O 3.26Å; Q216-S242 WeakPolarHBondContact CA-O 3.39Å; Q216-S242 WeakPolarHBondContact CG-O 3.49Å
217	S	98.1	Very high	98.4	Very high	43 Å²	43	34.7 Å²	34.7	30%	0.301	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.8	18.4	-178.5	-50	0	0	0	0	115.2	L215 S219 S242	L215-S217 PolarHBondContact O-N 2.95Å; S217-S219 PolarHBondContact O-N 3.29Å; S217-S219 VanDerWaalsContact O-N 3.13Å; S217-S242 PolarHBondContact N-O 3.16Å
218	C	97.9	Very high	98.4	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.188	C	C	.	.			trans	-82.8	67.6	164.5	-66.2	0	0	0	0	109.6	L189 C192 L215 Q216 R220 I221 C244	L189-C218 PolarHBondContact O-SG 2.89Å; C192-C218 PolarHBondContact O-SG 2.94Å; L215-C218 HydrophobicContact CB-CB 4.32Å; L215-C218 VanDerWaalsContact O-CB 3.26Å; L215-C218 WeakPolarHBondContact O-CB 3.28Å; L215-C218 PolarHBondContact O-N 2.9Å; Q216-C218 PolarHBondContact O-N 2.92Å; C218-R220 PolarHBondContact O-N 3.23Å; C218-R220 VanDerWaalsContact O-N 3.07Å; C218-I221 HydrophobicContact CB-CG2 4.06Å; C218-I221 VanDerWaalsContact O-CG1 3.3Å; C218-I221 WeakPolarHBondContact O-CG1 3.36Å; C218-I221 WeakPolarHBondContact O-CG2 3.34Å; C218-I221 PolarHBondContact O-N 3.07Å; C218-C244 PolarHBondContact O-SG 2.65Å; C218-C244 VanDerWaalsContact O-SG 3.37Å
219	S	95.1	Very high	98.4	Very high	55 Å²	55	32 Å²	32	39%	0.385	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-7.6	-167.4	58	0	0	0	0	115.9	S217 N246	S217-S219 PolarHBondContact O-N 3.29Å; S217-S219 VanDerWaalsContact O-N 3.13Å; S219-N246 PolarHBondContact O-ND2 3.49Å
220	R	97.9	Very high	98.5	Very high	150 Å²	150	28.6 Å²	28.6	57%	0.566	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-10.5	175.8	-59.5	175.9	-178.7	-114.5	-3.8	113.5	T193 L195 E196 C218	T193-R220 VanDerWaalsContact O-CD 3.28Å; T193-R220 WeakPolarHBondContact O-CD 3.44Å; T193-R220 PolarHBondContact O-NE 2.69Å; T193-R220 VanDerWaalsContact O-NE 3.17Å; L195-R220 WeakPolarHBondContact O-CB 3.41Å; E196-R220 HydrophobicContact CB-CB 4.4Å; C218-R220 PolarHBondContact O-N 3.23Å; C218-R220 VanDerWaalsContact O-N 3.07Å
221	I	98.3	Very high	98.4	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.176	C	C	.	.			trans	-72.7	149.1	176.6	77	-178.6	0	0	0	110.1	D197 L200 L215 C218 V226 L241 C244 L247	D197-I221 WeakPolarHBondContact OD1-CA 3.34Å; L200-I221 HydrophobicContact CD1-CB 4.12Å; L200-I221 HydrophobicContact CD1-CD1 4.36Å; L200-I221 HydrophobicContact CD1-CG2 4.01Å; L200-I221 HydrophobicContact CG-CG2 4.43Å; L215-I221 HydrophobicContact CB-CD1 4.07Å; L215-I221 HydrophobicContact CD1-CD1 3.89Å; C218-I221 HydrophobicContact CB-CG2 4.06Å; C218-I221 VanDerWaalsContact O-CG1 3.3Å; C218-I221 WeakPolarHBondContact O-CG1 3.36Å; C218-I221 WeakPolarHBondContact O-CG2 3.34Å; C218-I221 PolarHBondContact O-N 3.07Å; I221-V226 HydrophobicContact CD1-CG2 4.14Å; I221-L241 HydrophobicContact CD1-CD2 4.08Å; I221-C244 HydrophobicContact CD1-CB 3.88Å; I221-C244 WeakPolarHBondContact CD1-SG 3.32Å; I221-C244 HydrophobicContact CG1-CB 3.83Å; I221-L247 HydrophobicContact CG1-CD2 4.43Å
222	T	98.8	Very high	98.4	Very high	47 Å²	47	33.8 Å²	33.8	29%	0.288	17%	0.168	S	C	.	.			trans	-129.5	-178.5	177.4	78.8	0	0	0	0	110.3	D197 E224 G225 V226 N246 L247	D197-T222 PolarHBondContact OD1-N 3.25Å; D197-T222 WeakPolarHBondContact OD2-CB 3.32Å; D197-T222 PolarHBondContact OD2-OG1 2.9Å; T222-E224 PolarHBondContact O-N 2.76Å; T222-E224 PolarHBondContact OG1-N 2.87Å; T222-G225 PolarHBondContact O-N 2.95Å; T222-V226 PolarHBondContact O-N 2.78Å; T222-N246 HydrophobicContact CG2-CB 4.23Å; T222-L247 VanDerWaalsContact C-CD2 3.46Å
223	D	98.8	Very high	98.3	Very high	28 Å²	28	32.3 Å²	32.3	15%	0.15	16%	0.158	C	C	.	.	H	α-helix	trans	-55.4	-33.3	174.6	-64	-43.3	0	0	0	112.5	G225 V226 V227 T248 A250 S251	D223-G225 VanDerWaalsContact C-N 3.34Å; D223-G225 PolarHBondContact O-N 2.84Å; D223-V226 PolarHBondContact O-N 2.83Å; D223-V227 WeakPolarHBondContact O-CB 3.45Å; D223-V227 WeakPolarHBondContact O-CG2 3.33Å; D223-V227 PolarHBondContact O-N 2.95Å; D223-T248 PolarHBondContact OD1-N 3.37Å; D223-T248 WeakPolarHBondContact OD2-CB 3.49Å; D223-T248 WeakPolarHBondContact OD2-CG2 3.37Å; D223-T248 PolarHBondContact OD2-N 3.4Å; D223-T248 PolarHBondContact OD2-OG1 3.43Å; D223-A250 HydrophobicContact CB-CB 4.08Å; D223-S251 WeakPolarHBondContact CA-OG 3.47Å; D223-S251 WeakPolarHBondContact OD1-CB 3.48Å; D223-S251 PolarHBondContact OD1-N 3.27Å; D223-S251 PolarHBondContact OD1-OG 3.11Å
224	E	98.7	Very high	98.3	Very high	88 Å²	88	36.9 Å²	36.9	41%	0.411	18%	0.179	S	C	.	.	H	α-helix	trans	-57.3	-47.2	179.2	175.9	60.6	-161.8	0	0	111.2	K201 T222 Q228	K201-E224 VanDerWaalsContact CE-OE1 3.29Å; K201-E224 WeakPolarHBondContact CE-OE1 3.49Å; K201-E224 IonicContact NZ-OE1 2.78Å; T222-E224 PolarHBondContact O-N 2.76Å; T222-E224 PolarHBondContact OG1-N 2.87Å; E224-Q228 WeakPolarHBondContact O-CG 3.49Å; E224-Q228 PolarHBondContact O-N 2.95Å
225	G	98.7	Very high	98.3	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-70	-44	179.3	0	0	0	0	0	112.9	D197 T222 D223 Q228 I229	D197-G225 WeakPolarHBondContact OD1-CA 3.37Å; D197-G225 PolarHBondContact OD1-N 3.06Å; T222-G225 PolarHBondContact O-N 2.95Å; D223-G225 VanDerWaalsContact C-N 3.34Å; D223-G225 PolarHBondContact O-N 2.84Å; G225-Q228 PolarHBondContact O-N 3.27Å; G225-I229 PolarHBondContact O-N 3.01Å; G225-I229 VanDerWaalsContact O-N 3.09Å
226	V	98.8	Very high	98.3	Very high	2 Å²	2	41.2 Å²	41.2	1%	0.012	19%	0.193	C	C	.	.	H	α-helix	trans	-68	-40.9	-177.2	177.3	0	0	0	0	111.7	L200 I221 T222 D223 Q228 I229 C230 L241 L247	L200-V226 HydrophobicContact CD1-CG2 4.28Å; I221-V226 HydrophobicContact CD1-CG2 4.14Å; T222-V226 PolarHBondContact O-N 2.78Å; D223-V226 PolarHBondContact O-N 2.83Å; V226-Q228 VanDerWaalsContact C-N 3.26Å; V226-Q228 PolarHBondContact O-N 3.44Å; V226-I229 WeakPolarHBondContact O-CB 3.47Å; V226-I229 PolarHBondContact O-N 2.82Å; V226-C230 PolarHBondContact O-N 3.19Å; V226-C230 PolarHBondContact O-SG 3.04Å; V226-L241 HydrophobicContact CG1-CD1 4.23Å; V226-L241 HydrophobicContact CG2-CD2 4Å; V226-L247 HydrophobicContact CB-CD2 4.39Å; V226-L247 HydrophobicContact CG2-CD1 4.29Å; V226-L247 HydrophobicContact CG2-CD2 3.66Å
227	V	98.9	Very high	98.3	Very high	22 Å²	22	42.8 Å²	42.8	13%	0.133	20%	0.2	C	C	.	.	H	α-helix	trans	-58.9	-40.5	175.2	170.6	0	0	0	0	110.7	D223 C230 R231 A254	D223-V227 WeakPolarHBondContact O-CB 3.45Å; D223-V227 WeakPolarHBondContact O-CG2 3.33Å; D223-V227 PolarHBondContact O-N 2.95Å; V227-C230 WeakPolarHBondContact O-CB 2.96Å; V227-C230 PolarHBondContact O-N 3.01Å; V227-R231 WeakPolarHBondContact O-CG 3.46Å; V227-R231 PolarHBondContact O-N 3.41Å; V227-R231 VanDerWaalsContact O-N 3.09Å; V227-A254 HydrophobicContact CB-CB 4.12Å; V227-A254 HydrophobicContact CG1-CB 4.09Å; V227-A254 HydrophobicContact CG2-CB 3.75Å
228	Q	98.6	Very high	98.3	Very high	40 Å²	40	41.7 Å²	41.7	19%	0.187	19%	0.194	C	C	.	.	H	α-helix	trans	-67.8	-40.1	178.4	-63.2	-68.1	-20.3	0	0	111.6	K201 Q204 E224 G225 V226 C230 R231 G232	K201-Q228 HydrophobicContact CG-CB 4.27Å; K201-Q228 HydrophobicContact CG-CG 4.13Å; Q204-Q228 VanDerWaalsContact CB-O 3.3Å; Q204-Q228 WeakPolarHBondContact CB-O 3.43Å; Q204-Q228 HydrophobicContact CG-CB 4.01Å; Q204-Q228 WeakPolarHBondContact CG-O 3.46Å; E224-Q228 WeakPolarHBondContact O-CG 3.49Å; E224-Q228 PolarHBondContact O-N 2.95Å; G225-Q228 PolarHBondContact O-N 3.27Å; V226-Q228 VanDerWaalsContact C-N 3.26Å; V226-Q228 PolarHBondContact O-N 3.44Å; Q228-C230 VanDerWaalsContact C-N 3.33Å; Q228-C230 PolarHBondContact O-N 3.1Å; Q228-R231 PolarHBondContact O-N 2.83Å; Q228-G232 PolarHBondContact O-N 2.74Å; Q228-G232 VanDerWaalsContact O-N 3.11Å
229	I	98.7	Very high	98.3	Very high	2 Å²	2	41.8 Å²	41.8	1%	0.01	19%	0.194	C	C	.	.	H	α-helix	trans	-56.1	-48.3	171.1	-70.9	-73.3	0	0	0	111	L200 I203 Q204 L213 G225 V226 R231 G232 C233 L236	L200-I229 HydrophobicContact CB-CD1 4.15Å; L200-I229 HydrophobicContact CB-CG1 3.82Å; L200-I229 HydrophobicContact CD1-CG1 4.31Å; L200-I229 HydrophobicContact CD2-CD1 4.37Å; L200-I229 HydrophobicContact CD2-CG1 4.33Å; L200-I229 HydrophobicContact CG-CG1 4.37Å; L200-I229 WeakPolarHBondContact O-CD1 3.45Å; I203-I229 HydrophobicContact CB-CD1 3.78Å; I203-I229 HydrophobicContact CG2-CD1 3.63Å; Q204-I229 HydrophobicContact CB-CD1 4.27Å; L213-I229 HydrophobicContact CD2-CD1 3.97Å; L213-I229 HydrophobicContact CD2-CG1 4.23Å; L213-I229 HydrophobicContact CD2-CG2 3.83Å; G225-I229 PolarHBondContact O-N 3.01Å; G225-I229 VanDerWaalsContact O-N 3.09Å; V226-I229 WeakPolarHBondContact O-CB 3.47Å; V226-I229 PolarHBondContact O-N 2.82Å; I229-R231 VanDerWaalsContact C-N 3.26Å; I229-R231 PolarHBondContact O-N 3.45Å; I229-G232 PolarHBondContact O-N 2.87Å; I229-C233 HydrophobicContact CG2-CB 4.39Å; I229-C233 VanDerWaalsContact O-CB 3.27Å; I229-C233 WeakPolarHBondContact O-CB 3.22Å; I229-C233 PolarHBondContact O-N 2.99Å; I229-L236 HydrophobicContact CG2-CD1 3.63Å
230	C	98.4	Very high	98.5	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-58.7	-40.5	180	-60.9	0	0	0	0	111.4	V226 V227 Q228 G232 H234 A254 L255 N258	V226-C230 PolarHBondContact O-N 3.19Å; V226-C230 PolarHBondContact O-SG 3.04Å; V227-C230 WeakPolarHBondContact O-CB 2.96Å; V227-C230 PolarHBondContact O-N 3.01Å; Q228-C230 VanDerWaalsContact C-N 3.33Å; Q228-C230 PolarHBondContact O-N 3.1Å; C230-G232 PolarHBondContact O-N 3.32Å; C230-H234 PolarHBondContact O-ND1 3.23Å; C230-A254 HydrophobicContact CB-CB 4.01Å; C230-L255 WeakPolarHBondContact SG-CD2 3.39Å; C230-N258 HydrophobicContact CB-CB 4.11Å; C230-N258 WeakPolarHBondContact O-CB 3.31Å
231	R	97.9	Very high	98.6	Very high	141 Å²	141	32.5 Å²	32.5	53%	0.532	15%	0.152	S	C	.	.	H	α-helix	trans	-70.3	-26.3	179.5	-71.8	178.1	-178.8	-179.9	2.8	114.6	V227 Q228 I229 H234	V227-R231 WeakPolarHBondContact O-CG 3.46Å; V227-R231 PolarHBondContact O-N 3.41Å; V227-R231 VanDerWaalsContact O-N 3.09Å; Q228-R231 PolarHBondContact O-N 2.83Å; I229-R231 VanDerWaalsContact C-N 3.26Å; I229-R231 PolarHBondContact O-N 3.45Å; R231-H234 PolarHBondContact O-CE1 3.3Å; R231-H234 PolarHBondContact O-NE2 2.75Å; R231-H234 VanDerWaalsContact O-NE2 3.07Å
232	G	97.5	Very high	98.6	Very high	6 Å²	6	32.7 Å²	32.7	6%	0.062	15%	0.153	C	C	.	.	H	α-helix	trans	-102.4	-21.7	-179.6	0	0	0	0	0	114.7	H208 Q228 I229 C230	H208-G232 WeakPolarHBondContact CA-O 3.49Å; H208-G232 PolarHBondContact ND1-O 3.43Å; H208-G232 VanDerWaalsContact ND1-O 3.1Å; Q228-G232 PolarHBondContact O-N 2.74Å; Q228-G232 VanDerWaalsContact O-N 3.11Å; I229-G232 PolarHBondContact O-N 2.87Å; C230-G232 PolarHBondContact O-N 3.32Å
233	C	98.3	Very high	98.6	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.147	C	C	.	.			trans	-118.2	60.7	-170.8	-57.7	0	0	0	0	112.3	C207 L210 I229 R235 L236	C207-C233 PolarHBondContact O-SG 2.76Å; L210-C233 HydrophobicContact CB-CB 4.28Å; I229-C233 HydrophobicContact CG2-CB 4.39Å; I229-C233 VanDerWaalsContact O-CB 3.27Å; I229-C233 WeakPolarHBondContact O-CB 3.22Å; I229-C233 PolarHBondContact O-N 2.99Å; C233-R235 PolarHBondContact O-N 3.19Å; C233-L236 HydrophobicContact CB-CD1 3.82Å; C233-L236 HydrophobicContact CB-CG 3.9Å; C233-L236 WeakPolarHBondContact O-CB 3.36Å; C233-L236 WeakPolarHBondContact O-CG 3.43Å; C233-L236 PolarHBondContact O-N 3.45Å; C233-L236 VanDerWaalsContact O-N 3.14Å
234	H	98.1	Very high	98.5	Very high	97 Å²	97	29.8 Å²	29.8	45%	0.449	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-10.3	-178.3	-55.1	-57.8	0	0	0	115.4	C230 R231 N258	C230-H234 PolarHBondContact O-ND1 3.23Å; R231-H234 PolarHBondContact O-CE1 3.3Å; R231-H234 PolarHBondContact O-NE2 2.75Å; R231-H234 VanDerWaalsContact O-NE2 3.07Å; H234-N258 PolarHBondContact ND1-O 3.44Å; H234-N258 VanDerWaalsContact ND1-O 3.11Å
235	R	98.4	Very high	98.4	Very high	117 Å²	117	27.9 Å²	27.9	44%	0.442	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.4	2.7	178.2	-64.6	-169.8	-179.2	-161.4	2	113.6	E209 L210 C233 Q237	E209-R235 IonicContact OE1-CZ 3.52Å; E209-R235 VanDerWaalsContact OE1-CZ 3.25Å; E209-R235 IonicContact OE1-NE 3.25Å; E209-R235 PolarHBondContact OE1-NE 3.3Å; E209-R235 IonicContact OE1-NH1 2.63Å; E209-R235 IonicContact OE1-NH2 3.2Å; E209-R235 PolarHBondContact OE1-NH2 3.39Å; E209-R235 WeakPolarHBondContact OE2-CD 3.38Å; E209-R235 IonicContact OE2-CZ 2.61Å; E209-R235 IonicContact OE2-NE 3.08Å; E209-R235 PolarHBondContact OE2-NE 3.49Å; E209-R235 IonicContact OE2-NH1 3.86Å; E209-R235 PolarHBondContact OE2-NH1 3.08Å; E209-R235 IonicContact OE2-NH2 2.99Å; L210-R235 CarbonylContact O-C 3.38Å; L210-R235 VanDerWaalsContact O-C 3.31Å; C233-R235 PolarHBondContact O-N 3.19Å; R235-Q237 PolarHBondContact O-N 2.98Å
236	L	98.8	Very high	98.4	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.156	C	C	.	.			trans	-55.3	129.3	178.4	-85.5	170.6	0	0	0	111.4	L210 L213 I229 C233 R261 L262	L210-L236 HydrophobicContact CD2-CD2 4.48Å; L210-L236 HydrophobicContact CG-CD2 4.46Å; L210-L236 PolarHBondContact O-N 3.19Å; L213-L236 HydrophobicContact CB-CD2 4.04Å; I229-L236 HydrophobicContact CG2-CD1 3.63Å; C233-L236 HydrophobicContact CB-CD1 3.82Å; C233-L236 HydrophobicContact CB-CG 3.9Å; C233-L236 WeakPolarHBondContact O-CB 3.36Å; C233-L236 WeakPolarHBondContact O-CG 3.43Å; C233-L236 PolarHBondContact O-N 3.45Å; C233-L236 VanDerWaalsContact O-N 3.14Å; L236-R261 CarbonylContact O-C 3.38Å; L236-L262 PolarHBondContact O-N 3.12Å
237	Q	98.9	Very high	98.4	Very high	60 Å²	60	31.6 Å²	31.6	28%	0.28	16%	0.156	S	C	.	.			trans	-119.4	-34	175.1	-67.8	171.1	20.7	0	0	110.8	V211 R235 R261 Q263 I264	V211-Q237 HydrophobicContact CG1-CB 3.82Å; V211-Q237 HydrophobicContact CG1-CG 3.89Å; V211-Q237 PolarHBondContact O-N 3.14Å; R235-Q237 PolarHBondContact O-N 2.98Å; Q237-R261 HydrophobicContact CG-CB 4.26Å; Q237-R261 WeakPolarHBondContact CG-O 3.26Å; Q237-Q263 HydrophobicContact CB-CG 4.48Å; Q237-Q263 CarbonylContact O-C 3.42Å; Q237-Q263 WeakPolarHBondContact O-CA 3.48Å; Q237-Q263 WeakPolarHBondContact O-CB 3.33Å; Q237-Q263 PolarHBondContact O-N 3.02Å; Q237-I264 PolarHBondContact O-N 2.88Å
238	A	98.9	Very high	98.4	Very high	20 Å²	20	33 Å²	33	17%	0.165	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	121.3	179.1	0	0	0	0	0	111.2	V211 S212 L213 I264	V211-A238 PolarHBondContact O-N 3.48Å; S212-A238 CarbonylContact C-O 3.52Å; S212-A238 VanDerWaalsContact CA-O 3.29Å; S212-A238 WeakPolarHBondContact CA-O 3.46Å; L213-A238 PolarHBondContact N-O 3.16Å; A238-I264 WeakPolarHBondContact CA-O 3.33Å; A238-I264 HydrophobicContact CB-CB 3.98Å; A238-I264 HydrophobicContact CB-CD1 4.26Å; A238-I264 HydrophobicContact CB-CG1 4.46Å
239	L	98.9	Very high	98.4	Very high	2 Å²	2	32.6 Å²	32.6	1%	0.01	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	124.1	177.9	-177.6	60.3	0	0	0	110.2	L213 L241 L255 L262 I264 L265 E266	L213-L239 HydrophobicContact CB-CD1 3.93Å; L213-L239 HydrophobicContact CD2-CD1 4.06Å; L213-L239 HydrophobicContact CG-CD1 4.1Å; L213-L239 WeakPolarHBondContact O-CA 3.15Å; L239-L241 HydrophobicContact CD1-CD2 4.03Å; L239-L241 HydrophobicContact CD1-CG 4.23Å; L239-L241 HydrophobicContact CD2-CD1 3.81Å; L239-L241 HydrophobicContact CD2-CD2 4.45Å; L239-L241 HydrophobicContact CD2-CG 4.16Å; L239-L241 HydrophobicContact CG-CD1 4.09Å; L239-L241 HydrophobicContact CG-CD2 4.24Å; L239-L241 HydrophobicContact CG-CG 3.9Å; L239-L255 HydrophobicContact CD2-CD1 4.03Å; L239-L255 HydrophobicContact CD2-CD2 3.49Å; L239-L255 VanDerWaalsContact CD2-CD2 3.49Å; L239-L255 HydrophobicContact CD2-CG 4.32Å; L239-L262 HydrophobicContact CB-CD1 4.14Å; L239-I264 PolarHBondContact N-O 3.28Å; L239-L265 HydrophobicContact CB-CD1 4.5Å; L239-L265 WeakPolarHBondContact O-CA 3.28Å; L239-E266 PolarHBondContact O-N 3.32Å
240	C	98.9	Very high	98.4	Very high	5 Å²	5	34.7 Å²	34.7	3%	0.034	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	121.3	172.2	179.6	0	0	0	0	109.8	L213 N214 L215 E266	L213-C240 PolarHBondContact O-N 3.23Å; N214-C240 HydrophobicContact CB-CB 4.21Å; L215-C240 WeakPolarHBondContact CA-O 3.31Å; L215-C240 PolarHBondContact N-O 3.06Å; C240-E266 HydrophobicContact CB-CB 4.03Å; C240-E266 WeakPolarHBondContact CB-OE2 3.37Å; C240-E266 PolarHBondContact SG-OE2 2.89Å
241	L	98.8	Very high	98.4	Very high	6 Å²	6	34.8 Å²	34.8	3%	0.031	18%	0.182	C	C	.	.			trans	-122.5	11.3	179.6	-59.6	169.1	0	0	0	110.9	L215 I221 V226 L239 G243 C244 L247 E266	L215-L241 HydrophobicContact CB-CD2 4.33Å; L215-L241 HydrophobicContact CD1-CD2 3.92Å; I221-L241 HydrophobicContact CD1-CD2 4.08Å; V226-L241 HydrophobicContact CG1-CD1 4.23Å; V226-L241 HydrophobicContact CG2-CD2 4Å; L239-L241 HydrophobicContact CD1-CD2 4.03Å; L239-L241 HydrophobicContact CD1-CG 4.23Å; L239-L241 HydrophobicContact CD2-CD1 3.81Å; L239-L241 HydrophobicContact CD2-CD2 4.45Å; L239-L241 HydrophobicContact CD2-CG 4.16Å; L239-L241 HydrophobicContact CG-CD1 4.09Å; L239-L241 HydrophobicContact CG-CD2 4.24Å; L239-L241 HydrophobicContact CG-CG 3.9Å; L241-G243 PolarHBondContact O-N 3.12Å; L241-C244 WeakPolarHBondContact O-CB 3.24Å; L241-C244 PolarHBondContact O-N 3.3Å; L241-C244 PolarHBondContact O-SG 3.29Å; L241-C244 VanDerWaalsContact O-SG 3.37Å; L241-L247 HydrophobicContact CB-CD1 3.76Å; L241-L247 HydrophobicContact CD1-CD1 3.78Å; L241-L247 HydrophobicContact CD2-CD1 4.17Å; L241-L247 HydrophobicContact CG-CD1 4.1Å; L241-E266 PolarHBondContact N-O 3.34Å
242	S	98.8	Very high	98.5	Very high	3 Å²	3	28.3 Å²	28.3	2%	0.021	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	129	-174.9	-57.3	0	0	0	0	112	Q216 S217 E266 A268	Q216-S242 CarbonylContact C-O 3.51Å; Q216-S242 VanDerWaalsContact CA-O 3.26Å; Q216-S242 WeakPolarHBondContact CA-O 3.39Å; Q216-S242 WeakPolarHBondContact CG-O 3.49Å; S217-S242 PolarHBondContact N-O 3.16Å; S242-E266 PolarHBondContact N-O 3.04Å; S242-A268 CarbonylContact C-O 3.5Å; S242-A268 WeakPolarHBondContact CA-O 3.45Å; S242-A268 PolarHBondContact OG-N 2.84Å
243	G	98.2	Very high	98.5	Very high	15 Å²	15	30 Å²	30	16%	0.155	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.8	7	-175.6	0	0	0	0	0	114.9	L241 S245 A268	L241-G243 PolarHBondContact O-N 3.12Å; G243-S245 PolarHBondContact O-N 3.21Å; G243-A268 PolarHBondContact N-O 3.15Å
244	C	98.1	Very high	98.5	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.17	C	C	.	.			trans	-88.4	76.7	169.3	-61.2	0	0	0	0	109.5	L215 C218 I221 L241 N246 L247 C270	L215-C244 PolarHBondContact O-SG 3Å; L215-C244 VanDerWaalsContact O-SG 3.35Å; C218-C244 PolarHBondContact O-SG 2.65Å; C218-C244 VanDerWaalsContact O-SG 3.37Å; I221-C244 HydrophobicContact CD1-CB 3.88Å; I221-C244 WeakPolarHBondContact CD1-SG 3.32Å; I221-C244 HydrophobicContact CG1-CB 3.83Å; L241-C244 WeakPolarHBondContact O-CB 3.24Å; L241-C244 PolarHBondContact O-N 3.3Å; L241-C244 PolarHBondContact O-SG 3.29Å; L241-C244 VanDerWaalsContact O-SG 3.37Å; C244-N246 PolarHBondContact O-N 2.88Å; C244-N246 VanDerWaalsContact O-N 3.15Å; C244-L247 HydrophobicContact CB-CD1 3.67Å; C244-L247 HydrophobicContact CB-CG 3.93Å; C244-L247 WeakPolarHBondContact O-CG 3.33Å; C244-L247 PolarHBondContact O-N 3.49Å; C244-C270 PolarHBondContact O-SG 3.08Å
245	S	96.9	Very high	98.6	Very high	48 Å²	48	25.7 Å²	25.7	34%	0.336	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-12.8	-171	57.3	0	0	0	0	115.2	G243 L247 H272	G243-S245 PolarHBondContact O-N 3.21Å; S245-L247 VanDerWaalsContact C-N 3.3Å; S245-H272 PolarHBondContact O-CD2 3.35Å
246	N	97.8	Very high	98.6	Very high	77 Å²	77	20.2 Å²	20.2	41%	0.412	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85	-0.5	-179.8	-59.3	-34.1	0	0	0	113.7	S219 T222 C244	S219-N246 PolarHBondContact O-ND2 3.49Å; T222-N246 HydrophobicContact CG2-CB 4.23Å; C244-N246 PolarHBondContact O-N 2.88Å; C244-N246 VanDerWaalsContact O-N 3.15Å
247	L	98.6	Very high	98.6	Very high	2 Å²	2	26.1 Å²	26.1	1%	0.01	16%	0.159	C	C	.	.			trans	-81.7	141.7	-177	-60	-178.6	0	0	0	111.4	I221 T222 V226 L241 C244 S245 H272	I221-L247 HydrophobicContact CG1-CD2 4.43Å; T222-L247 VanDerWaalsContact C-CD2 3.46Å; V226-L247 HydrophobicContact CB-CD2 4.39Å; V226-L247 HydrophobicContact CG2-CD1 4.29Å; V226-L247 HydrophobicContact CG2-CD2 3.66Å; L241-L247 HydrophobicContact CB-CD1 3.76Å; L241-L247 HydrophobicContact CD1-CD1 3.78Å; L241-L247 HydrophobicContact CD2-CD1 4.17Å; L241-L247 HydrophobicContact CG-CD1 4.1Å; C244-L247 HydrophobicContact CB-CD1 3.67Å; C244-L247 HydrophobicContact CB-CG 3.93Å; C244-L247 WeakPolarHBondContact O-CG 3.33Å; C244-L247 PolarHBondContact O-N 3.49Å; S245-L247 VanDerWaalsContact C-N 3.3Å; L247-H272 WeakPolarHBondContact O-CB 3.3Å
248	T	98.8	Very high	98.6	Very high	53 Å²	53	25 Å²	25	33%	0.325	16%	0.156	S	C	.	.			trans	-123.4	-177.3	177.4	77.2	0	0	0	0	111	D223 A250 S251 H272 L273	D223-T248 PolarHBondContact OD1-N 3.37Å; D223-T248 WeakPolarHBondContact OD2-CB 3.49Å; D223-T248 WeakPolarHBondContact OD2-CG2 3.37Å; D223-T248 PolarHBondContact OD2-N 3.4Å; D223-T248 PolarHBondContact OD2-OG1 3.43Å; T248-A250 PolarHBondContact O-N 3.07Å; T248-A250 PolarHBondContact OG1-N 2.79Å; T248-S251 PolarHBondContact O-N 3.45Å; T248-H272 HydrophobicContact CG2-CB 4.3Å; T248-L273 WeakPolarHBondContact O-CD2 3.32Å
249	D	98.8	Very high	98.5	Very high	31 Å²	31	24.1 Å²	24.1	17%	0.166	15%	0.148	C	C	.	.	H	α-helix	trans	-57.4	-16.9	175.3	-67.5	-19.5	0	0	0	114	S251 L252 T253 T274 G277	D249-S251 VanDerWaalsContact C-N 3.31Å; D249-S251 PolarHBondContact O-N 2.59Å; D249-L252 PolarHBondContact O-N 3.26Å; D249-T253 WeakPolarHBondContact O-CB 3.13Å; D249-T253 PolarHBondContact O-N 3.45Å; D249-T253 PolarHBondContact O-OG1 3.44Å; D249-T274 PolarHBondContact OD1-N 2.85Å; D249-T274 PolarHBondContact OD2-OG1 3.02Å; D249-G277 VanDerWaalsContact CG-N 3.33Å; D249-G277 PolarHBondContact OD2-N 3.08Å
250	A	98.8	Very high	98.5	Very high	46 Å²	46	27.4 Å²	27.4	38%	0.38	17%	0.17	S	C	.	.	H	α-helix	trans	-60.3	-40.8	172.5	0	0	0	0	0	111.9	D223 T248 T253 A254	D223-A250 HydrophobicContact CB-CB 4.08Å; T248-A250 PolarHBondContact O-N 3.07Å; T248-A250 PolarHBondContact OG1-N 2.79Å; A250-T253 PolarHBondContact O-N 3.4Å; A250-A254 PolarHBondContact O-N 3.26Å
251	S	98.8	Very high	98.5	Very high	2 Å²	2	33.9 Å²	33.9	1%	0.014	19%	0.193	C	C	.	.	H	α-helix	trans	-65	-44.9	174.5	-73.9	0	0	0	0	112.2	D223 T248 D249 T253 A254 L255	D223-S251 WeakPolarHBondContact CA-OG 3.47Å; D223-S251 WeakPolarHBondContact OD1-CB 3.48Å; D223-S251 PolarHBondContact OD1-N 3.27Å; D223-S251 PolarHBondContact OD1-OG 3.11Å; T248-S251 PolarHBondContact O-N 3.45Å; D249-S251 VanDerWaalsContact C-N 3.31Å; D249-S251 PolarHBondContact O-N 2.59Å; S251-T253 VanDerWaalsContact C-N 3.32Å; S251-T253 PolarHBondContact O-N 2.93Å; S251-A254 PolarHBondContact O-N 3.36Å; S251-L255 WeakPolarHBondContact O-CG 3.31Å; S251-L255 PolarHBondContact O-N 3.2Å
252	L	98.8	Very high	98.5	Very high	4 Å²	4	33.6 Å²	33.6	2%	0.021	19%	0.192	C	C	.	.	H	α-helix	trans	-63.6	-39.2	177.5	-65.8	-179.1	0	0	0	112	D249 L255 G256 L265 L273 F278 L281	D249-L252 PolarHBondContact O-N 3.26Å; L252-L255 HydrophobicContact CD2-CD1 4.33Å; L252-L255 WeakPolarHBondContact O-CB 3.31Å; L252-L255 PolarHBondContact O-N 3.27Å; L252-G256 PolarHBondContact O-N 3.01Å; L252-L265 HydrophobicContact CD2-CD2 4.06Å; L252-L273 HydrophobicContact CD1-CB 4.13Å; L252-L273 HydrophobicContact CD1-CD1 4.17Å; L252-L273 HydrophobicContact CD1-CD2 3.78Å; L252-L273 HydrophobicContact CD1-CG 4.23Å; L252-L273 HydrophobicContact CD2-CD1 4.39Å; L252-L273 HydrophobicContact CG-CD1 4.45Å; L252-L273 HydrophobicContact CG-CD2 3.89Å; L252-F278 HydrophobicContact CD1-CD1 3.95Å; L252-F278 HydrophobicContact CD1-CD2 4.04Å; L252-F278 HydrophobicContact CD1-CE1 3.85Å; L252-F278 HydrophobicContact CD1-CE2 3.95Å; L252-F278 HydrophobicContact CD1-CG 4.02Å; L252-F278 HydrophobicContact CD1-CZ 3.84Å; L252-F278 HydrophobicContact CD2-CE1 4.06Å; L252-F278 HydrophobicContact CD2-CZ 4.49Å; L252-L281 HydrophobicContact CD2-CD1 4.14Å
253	T	98.8	Very high	98.5	Very high	41 Å²	41	36 Å²	36	25%	0.252	20%	0.202	S	C	.	.	H	α-helix	trans	-61.4	-46.3	174.8	-59.6	0	0	0	0	110.8	D249 A250 S251 L255 G256 L257 L280	D249-T253 WeakPolarHBondContact O-CB 3.13Å; D249-T253 PolarHBondContact O-N 3.45Å; D249-T253 PolarHBondContact O-OG1 3.44Å; A250-T253 PolarHBondContact O-N 3.4Å; S251-T253 VanDerWaalsContact C-N 3.32Å; S251-T253 PolarHBondContact O-N 2.93Å; T253-L255 VanDerWaalsContact C-N 3.34Å; T253-L255 PolarHBondContact O-N 3.48Å; T253-G256 PolarHBondContact O-N 3.14Å; T253-L257 HydrophobicContact CG2-CD1 3.96Å; T253-L257 HydrophobicContact CG2-CG 4.46Å; T253-L257 VanDerWaalsContact O-CG 3.29Å; T253-L257 WeakPolarHBondContact O-CG 3.44Å; T253-L257 PolarHBondContact O-N 3.25Å; T253-L280 HydrophobicContact CG2-CD1 4Å; T253-L280 WeakPolarHBondContact OG1-CD1 3.39Å
254	A	98.8	Very high	98.5	Very high	7 Å²	7	37.4 Å²	37.4	6%	0.058	21%	0.206	C	C	.	.	H	α-helix	trans	-64.5	-37.8	178.1	0	0	0	0	0	112.8	V227 C230 A250 S251 L257 N258	V227-A254 HydrophobicContact CB-CB 4.12Å; V227-A254 HydrophobicContact CG1-CB 4.09Å; V227-A254 HydrophobicContact CG2-CB 3.75Å; C230-A254 HydrophobicContact CB-CB 4.01Å; A250-A254 PolarHBondContact O-N 3.26Å; S251-A254 PolarHBondContact O-N 3.36Å; A254-L257 PolarHBondContact O-N 3.33Å; A254-N258 WeakPolarHBondContact O-CB 3.43Å; A254-N258 PolarHBondContact O-N 3.02Å; A254-N258 VanDerWaalsContact O-N 3.09Å; A254-N258 PolarHBondContact O-ND2 3.46Å
255	L	98.7	Very high	98.5	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-60.1	-50.7	172.6	-76.7	167.5	0	0	0	111.3	C230 L239 S251 L252 T253 L257 N258 C259 L262 L265 L281	C230-L255 WeakPolarHBondContact SG-CD2 3.39Å; L239-L255 HydrophobicContact CD2-CD1 4.03Å; L239-L255 HydrophobicContact CD2-CD2 3.49Å; L239-L255 VanDerWaalsContact CD2-CD2 3.49Å; L239-L255 HydrophobicContact CD2-CG 4.32Å; S251-L255 WeakPolarHBondContact O-CG 3.31Å; S251-L255 PolarHBondContact O-N 3.2Å; L252-L255 HydrophobicContact CD2-CD1 4.33Å; L252-L255 WeakPolarHBondContact O-CB 3.31Å; L252-L255 PolarHBondContact O-N 3.27Å; T253-L255 VanDerWaalsContact C-N 3.34Å; T253-L255 PolarHBondContact O-N 3.48Å; L255-L257 VanDerWaalsContact C-N 3.28Å; L255-L257 PolarHBondContact O-N 3.09Å; L255-N258 PolarHBondContact O-N 3.31Å; L255-C259 HydrophobicContact CD2-CB 4.31Å; L255-C259 WeakPolarHBondContact O-CB 3.43Å; L255-C259 PolarHBondContact O-N 2.84Å; L255-L262 HydrophobicContact CD2-CD2 4.29Å; L255-L265 HydrophobicContact CD1-CD1 4.06Å; L255-L281 HydrophobicContact CB-CD1 3.57Å; L255-L281 HydrophobicContact CD1-CD1 4.09Å; L255-L281 HydrophobicContact CG-CD1 4.48Å
256	G	98.4	Very high	98.6	Very high	3 Å²	3	38.3 Å²	38.3	3%	0.031	21%	0.205	C	C	.	.	H	α-helix	trans	-56.2	-43.2	177.3	0	0	0	0	0	112.2	L252 T253 N258 N284	L252-G256 PolarHBondContact O-N 3.01Å; T253-G256 PolarHBondContact O-N 3.14Å; G256-N258 PolarHBondContact O-N 3.22Å; G256-N284 WeakPolarHBondContact O-CB 3.29Å
257	L	98.6	Very high	98.7	Very high	123 Å²	123	34.7 Å²	34.7	64%	0.644	19%	0.186	S	C	*	.	H	α-helix	trans	-73.7	-26.6	-177.1	-68	174.6	0	0	0	114.6	T253 A254 L255	T253-L257 HydrophobicContact CG2-CD1 3.96Å; T253-L257 HydrophobicContact CG2-CG 4.46Å; T253-L257 VanDerWaalsContact O-CG 3.29Å; T253-L257 WeakPolarHBondContact O-CG 3.44Å; T253-L257 PolarHBondContact O-N 3.25Å; A254-L257 PolarHBondContact O-N 3.33Å; L255-L257 VanDerWaalsContact C-N 3.28Å; L255-L257 PolarHBondContact O-N 3.09Å
258	N	98.5	Very high	98.7	Very high	38 Å²	38	34.8 Å²	34.8	20%	0.203	19%	0.187	C	C	.	.	H	α-helix	trans	-125.2	-12.5	-166.7	-59.8	-86.6	0	0	0	115.3	C230 H234 A254 L255 G256 P260	C230-N258 HydrophobicContact CB-CB 4.11Å; C230-N258 WeakPolarHBondContact O-CB 3.31Å; H234-N258 PolarHBondContact ND1-O 3.44Å; H234-N258 VanDerWaalsContact ND1-O 3.11Å; A254-N258 WeakPolarHBondContact O-CB 3.43Å; A254-N258 PolarHBondContact O-N 3.02Å; A254-N258 VanDerWaalsContact O-N 3.09Å; A254-N258 PolarHBondContact O-ND2 3.46Å; L255-N258 PolarHBondContact O-N 3.31Å; G256-N258 PolarHBondContact O-N 3.22Å; N258-P260 VanDerWaalsContact C-CD 3.41Å; N258-P260 WeakPolarHBondContact O-CD 3.36Å
259	C	98.4	Very high	98.7	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.192	C	C	.	.			trans	-124.1	61.4	-173.3	-58.9	0	0	0	0	112.3	L255 R261 L262 C285	L255-C259 HydrophobicContact CD2-CB 4.31Å; L255-C259 WeakPolarHBondContact O-CB 3.43Å; L255-C259 PolarHBondContact O-N 2.84Å; C259-R261 PolarHBondContact O-N 3.44Å; C259-L262 WeakPolarHBondContact O-CB 3.43Å; C259-L262 PolarHBondContact O-N 3.16Å; C259-L262 VanDerWaalsContact O-N 3.09Å; C259-C285 PolarHBondContact O-SG 3.41Å
260	P	98	Very high	98.6	Very high	72 Å²	72	36.2 Å²	36.2	47%	0.468	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-9.8	-175.7	29.5	-37.4	0	0	0	114.2	N258	N258-P260 VanDerWaalsContact C-CD 3.41Å; N258-P260 WeakPolarHBondContact O-CD 3.36Å
261	R	98.5	Very high	98.6	Very high	140 Å²	140	35.8 Å²	35.8	53%	0.528	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.9	8.6	177.9	-62.7	-172.3	178.4	-170.5	-0.4	113.1	L236 Q237 C259 Q263	L236-R261 CarbonylContact O-C 3.38Å; Q237-R261 HydrophobicContact CG-CB 4.26Å; Q237-R261 WeakPolarHBondContact CG-O 3.26Å; C259-R261 PolarHBondContact O-N 3.44Å; R261-Q263 PolarHBondContact O-N 3.43Å
262	L	98.8	Very high	98.5	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.201	C	C	.	.			trans	-63.2	126.2	-177.9	-162.6	69.5	0	0	0	110.5	L236 L239 L255 C259 L265 L281 E287 L288	L236-L262 PolarHBondContact O-N 3.12Å; L239-L262 HydrophobicContact CB-CD1 4.14Å; L255-L262 HydrophobicContact CD2-CD2 4.29Å; C259-L262 WeakPolarHBondContact O-CB 3.43Å; C259-L262 PolarHBondContact O-N 3.16Å; C259-L262 VanDerWaalsContact O-N 3.09Å; L262-L265 HydrophobicContact CD2-CB 4.21Å; L262-L281 HydrophobicContact CD2-CD1 4.35Å; L262-E287 CarbonylContact O-C 3.51Å; L262-L288 HydrophobicContact CB-CD2 4.36Å; L262-L288 HydrophobicContact CD2-CD2 4.14Å; L262-L288 HydrophobicContact CG-CD2 4.09Å; L262-L288 PolarHBondContact O-N 3.45Å
263	Q	98.9	Very high	98.5	Very high	53 Å²	53	40.7 Å²	40.7	25%	0.248	20%	0.201	C	C	.	.			trans	-115.3	-37.7	-178.8	-68.2	178	-20.5	0	0	111.7	Q237 R261 E287 E289 K290	Q237-Q263 HydrophobicContact CB-CG 4.48Å; Q237-Q263 CarbonylContact O-C 3.42Å; Q237-Q263 WeakPolarHBondContact O-CA 3.48Å; Q237-Q263 WeakPolarHBondContact O-CB 3.33Å; Q237-Q263 PolarHBondContact O-N 3.02Å; R261-Q263 PolarHBondContact O-N 3.43Å; Q263-E287 WeakPolarHBondContact CA-O 3.12Å; Q263-E287 HydrophobicContact CG-CB 4.28Å; Q263-E287 WeakPolarHBondContact CG-O 3.45Å; Q263-E289 HydrophobicContact CB-CG 4.36Å; Q263-E289 WeakPolarHBondContact O-CA 3.22Å; Q263-E289 PolarHBondContact O-N 3.23Å; Q263-K290 PolarHBondContact O-N 3.18Å
264	I	98.9	Very high	98.5	Very high	45 Å²	45	40.6 Å²	40.6	23%	0.231	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	121.7	-177.8	-55.2	177.8	0	0	0	108.2	Q237 A238 L239 E266 K290	Q237-I264 PolarHBondContact O-N 2.88Å; A238-I264 WeakPolarHBondContact CA-O 3.33Å; A238-I264 HydrophobicContact CB-CB 3.98Å; A238-I264 HydrophobicContact CB-CD1 4.26Å; A238-I264 HydrophobicContact CB-CG1 4.46Å; L239-I264 PolarHBondContact N-O 3.28Å; I264-E266 HydrophobicContact CG2-CG 4.15Å; I264-K290 WeakPolarHBondContact CA-O 3.49Å; I264-K290 HydrophobicContact CB-CB 4.46Å; I264-K290 HydrophobicContact CD1-CD 4.28Å; I264-K290 HydrophobicContact CG1-CB 4.14Å; I264-K290 HydrophobicContact CG1-CD 4.32Å; I264-K290 HydrophobicContact CG1-CG 4.35Å; I264-K290 HydrophobicContact CG2-CB 4.19Å
265	L	98.9	Very high	98.5	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	111.9	170.9	179.6	61.9	0	0	0	109.3	L239 L252 L255 L262 F278 L281 L288 K290 M291 D292	L239-L265 HydrophobicContact CB-CD1 4.5Å; L239-L265 WeakPolarHBondContact O-CA 3.28Å; L252-L265 HydrophobicContact CD2-CD2 4.06Å; L255-L265 HydrophobicContact CD1-CD1 4.06Å; L262-L265 HydrophobicContact CD2-CB 4.21Å; L265-F278 HydrophobicContact CD2-CE1 4.47Å; L265-L281 HydrophobicContact CD2-CD1 4.06Å; L265-L281 HydrophobicContact CD2-CD2 3.76Å; L265-L288 HydrophobicContact CB-CD2 4.38Å; L265-K290 PolarHBondContact N-O 3.36Å; L265-M291 VanDerWaalsContact O-CA 3.28Å; L265-M291 WeakPolarHBondContact O-CA 3.37Å; L265-D292 PolarHBondContact O-N 2.95Å
266	E	98.9	Very high	98.5	Very high	67 Å²	67	44.2 Å²	44.2	31%	0.313	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	117	172.1	-58.8	173.8	180	0	0	107.9	L239 C240 L241 S242 I264 D292	L239-E266 PolarHBondContact O-N 3.32Å; C240-E266 HydrophobicContact CB-CB 4.03Å; C240-E266 WeakPolarHBondContact CB-OE2 3.37Å; C240-E266 PolarHBondContact SG-OE2 2.89Å; L241-E266 PolarHBondContact N-O 3.34Å; S242-E266 PolarHBondContact N-O 3.04Å; I264-E266 HydrophobicContact CG2-CG 4.15Å; E266-D292 HydrophobicContact CB-CB 4.21Å; E266-D292 HydrophobicContact CG-CB 4.12Å
267	A	98.6	Very high	98.5	Very high	2 Å²	2	44.1 Å²	44.1	2%	0.017	23%	0.225	C	C	.	.			trans	-134.3	27.7	-175.4	0	0	0	0	0	111.7	R269 C270 L273 D292 L293 C296	A267-R269 PolarHBondContact O-N 3.23Å; A267-C270 VanDerWaalsContact O-CB 3.25Å; A267-C270 WeakPolarHBondContact O-CB 3.1Å; A267-C270 PolarHBondContact O-N 3.31Å; A267-C270 PolarHBondContact O-SG 3.17Å; A267-L273 HydrophobicContact CB-CD1 3.87Å; A267-D292 CarbonylContact C-O 3.5Å; A267-D292 PolarHBondContact N-O 3.43Å; A267-L293 HydrophobicContact CB-CD2 4.5Å; A267-C296 PolarHBondContact O-SG 2.76Å
268	A	98.6	Very high	98.5	Very high	4 Å²	4	38.3 Å²	38.3	3%	0.033	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	140.4	179.2	0	0	0	0	0	111.4	S242 G243 C270 D292 E294	S242-A268 CarbonylContact C-O 3.5Å; S242-A268 WeakPolarHBondContact CA-O 3.45Å; S242-A268 PolarHBondContact OG-N 2.84Å; G243-A268 PolarHBondContact N-O 3.15Å; A268-C270 PolarHBondContact O-N 3.4Å; A268-D292 WeakPolarHBondContact CB-OD2 3.37Å; A268-D292 PolarHBondContact N-O 3.02Å; A268-E294 CarbonylContact C-O 3.6Å; A268-E294 WeakPolarHBondContact CA-O 3.47Å; A268-E294 HydrophobicContact CB-CB 3.82Å
269	R	98.3	Very high	98.6	Very high	113 Å²	113	37.7 Å²	37.7	43%	0.426	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.5	22.8	-177.9	-58.9	177.9	-79.3	-174.5	-12.9	114.6	A267 S271 E294 E295	A267-R269 PolarHBondContact O-N 3.23Å; R269-S271 PolarHBondContact O-N 3.03Å; R269-E294 PolarHBondContact N-O 3.08Å; R269-E295 HydrophobicContact CG-CB 3.97Å; R269-E295 HydrophobicContact CG-CG 4.23Å; R269-E295 WeakPolarHBondContact CG-OE2 3.46Å
270	C	98.1	Very high	98.5	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.211	C	C	.	.			trans	-93.9	77.6	165.8	-65.2	0	0	0	0	109.3	C244 A267 A268 H272 L273 C296	C244-C270 PolarHBondContact O-SG 3.08Å; A267-C270 VanDerWaalsContact O-CB 3.25Å; A267-C270 WeakPolarHBondContact O-CB 3.1Å; A267-C270 PolarHBondContact O-N 3.31Å; A267-C270 PolarHBondContact O-SG 3.17Å; A268-C270 PolarHBondContact O-N 3.4Å; C270-H272 PolarHBondContact O-N 3.32Å; C270-L273 HydrophobicContact CB-CD1 3.48Å; C270-L273 VanDerWaalsContact CB-CD1 3.48Å; C270-L273 HydrophobicContact CB-CG 3.73Å; C270-L273 WeakPolarHBondContact O-CG 3.41Å; C270-L273 PolarHBondContact O-N 2.59Å; C270-C296 PolarHBondContact O-SG 2.75Å
271	S	97.2	Very high	98.6	Very high	38 Å²	38	37.8 Å²	37.8	27%	0.266	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-10.4	-169.2	54.8	0	0	0	0	115.5	R269 L298	R269-S271 PolarHBondContact O-N 3.03Å; S271-L298 VanDerWaalsContact O-CD1 3.28Å; S271-L298 WeakPolarHBondContact O-CD1 3.41Å; S271-L298 WeakPolarHBondContact O-CG 3.36Å
272	H	98.3	Very high	98.6	Very high	105 Å²	105	31.1 Å²	31.1	49%	0.486	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94	0.7	176.9	-60.8	-52.1	0	0	0	114	S245 L247 T248 C270	S245-H272 PolarHBondContact O-CD2 3.35Å; L247-H272 WeakPolarHBondContact O-CB 3.3Å; T248-H272 HydrophobicContact CG2-CB 4.3Å; C270-H272 PolarHBondContact O-N 3.32Å
273	L	98.7	Very high	98.6	Very high	4 Å²	4	37.3 Å²	37.3	2%	0.021	19%	0.187	C	C	.	.			trans	-77.6	134.8	175.5	-58.7	-176.9	0	0	0	110.3	T248 L252 A267 C270 F278	T248-L273 WeakPolarHBondContact O-CD2 3.32Å; L252-L273 HydrophobicContact CD1-CB 4.13Å; L252-L273 HydrophobicContact CD1-CD1 4.17Å; L252-L273 HydrophobicContact CD1-CD2 3.78Å; L252-L273 HydrophobicContact CD1-CG 4.23Å; L252-L273 HydrophobicContact CD2-CD1 4.39Å; L252-L273 HydrophobicContact CG-CD1 4.45Å; L252-L273 HydrophobicContact CG-CD2 3.89Å; A267-L273 HydrophobicContact CB-CD1 3.87Å; C270-L273 HydrophobicContact CB-CD1 3.48Å; C270-L273 VanDerWaalsContact CB-CD1 3.48Å; C270-L273 HydrophobicContact CB-CG 3.73Å; C270-L273 WeakPolarHBondContact O-CG 3.41Å; C270-L273 PolarHBondContact O-N 2.59Å; L273-F278 HydrophobicContact CB-CE2 3.84Å; L273-F278 HydrophobicContact CB-CZ 4.22Å; L273-F278 HydrophobicContact CD1-CE2 4.44Å; L273-F278 HydrophobicContact CD1-CZ 3.97Å
274	T	98.8	Very high	98.5	Very high	39 Å²	39	38 Å²	38	24%	0.239	19%	0.192	C	C	.	.			trans	-127.2	173.9	-176.8	86.2	0	0	0	0	112	D249 A276 G277 F278 L298	D249-T274 PolarHBondContact OD1-N 2.85Å; D249-T274 PolarHBondContact OD2-OG1 3.02Å; T274-A276 PolarHBondContact O-N 3.02Å; T274-A276 VanDerWaalsContact O-N 3.14Å; T274-A276 PolarHBondContact OG1-N 3.32Å; T274-G277 PolarHBondContact O-N 2.95Å; T274-F278 WeakPolarHBondContact O-CD2 3.42Å; T274-F278 PolarHBondContact O-N 3.45Å; T274-L298 HydrophobicContact CG2-CB 4.19Å; T274-L298 HydrophobicContact CG2-CD1 3.96Å
275	D	98.8	Very high	98.5	Very high	26 Å²	26	35.9 Å²	35.9	14%	0.139	18%	0.181	C	C	.	.	H	α-helix	trans	-54.7	-30.3	174.6	-59.6	-56.9	0	0	0	113.2	F278 T279 T300 T303	D275-F278 PolarHBondContact O-N 3.29Å; D275-T279 VanDerWaalsContact O-CB 3.26Å; D275-T279 WeakPolarHBondContact O-CB 3.28Å; D275-T279 PolarHBondContact O-N 3.14Å; D275-T279 PolarHBondContact O-OG1 3.22Å; D275-T300 VanDerWaalsContact CG-OG1 3.27Å; D275-T300 PolarHBondContact OD1-N 2.82Å; D275-T300 PolarHBondContact OD1-OG1 3.26Å; D275-T300 WeakPolarHBondContact OD2-CB 3.45Å; D275-T300 WeakPolarHBondContact OD2-CG2 3.15Å; D275-T300 PolarHBondContact OD2-N 3.26Å; D275-T300 PolarHBondContact OD2-OG1 2.77Å; D275-T303 WeakPolarHBondContact CA-OG1 3.35Å; D275-T303 WeakPolarHBondContact OD1-CB 3.26Å; D275-T303 PolarHBondContact OD1-N 3.27Å; D275-T303 PolarHBondContact OD1-OG1 3.28Å
276	A	98.7	Very high	98.5	Very high	57 Å²	57	39.8 Å²	39.8	47%	0.471	20%	0.199	S	C	.	.	H	α-helix	trans	-64.8	-45.7	-179.6	0	0	0	0	0	111.8	T274 L280	T274-A276 PolarHBondContact O-N 3.02Å; T274-A276 VanDerWaalsContact O-N 3.14Å; T274-A276 PolarHBondContact OG1-N 3.32Å; A276-L280 PolarHBondContact O-N 3.48Å
277	G	98.7	Very high	98.5	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-64.8	-46.1	175.8	0	0	0	0	0	112.2	D249 T274 T279 L280 L281	D249-G277 VanDerWaalsContact CG-N 3.33Å; D249-G277 PolarHBondContact OD2-N 3.08Å; T274-G277 PolarHBondContact O-N 2.95Å; G277-T279 VanDerWaalsContact C-N 3.32Å; G277-T279 PolarHBondContact O-N 2.97Å; G277-L280 PolarHBondContact O-N 3.46Å; G277-L281 PolarHBondContact O-N 3.03Å
278	F	98.8	Very high	98.5	Very high	1 Å²	1	39.5 Å²	39.5	0%	0.004	20%	0.198	C	C	.	.	H	α-helix	trans	-67.1	-31.9	179.1	-73.8	-64.2	0	0	0	113.3	L252 L265 L273 T274 D275 L280 L281 A282 M291 L293 I299 T303	L252-F278 HydrophobicContact CD1-CD1 3.95Å; L252-F278 HydrophobicContact CD1-CD2 4.04Å; L252-F278 HydrophobicContact CD1-CE1 3.85Å; L252-F278 HydrophobicContact CD1-CE2 3.95Å; L252-F278 HydrophobicContact CD1-CG 4.02Å; L252-F278 HydrophobicContact CD1-CZ 3.84Å; L252-F278 HydrophobicContact CD2-CE1 4.06Å; L252-F278 HydrophobicContact CD2-CZ 4.49Å; L265-F278 HydrophobicContact CD2-CE1 4.47Å; L273-F278 HydrophobicContact CB-CE2 3.84Å; L273-F278 HydrophobicContact CB-CZ 4.22Å; L273-F278 HydrophobicContact CD1-CE2 4.44Å; L273-F278 HydrophobicContact CD1-CZ 3.97Å; T274-F278 WeakPolarHBondContact O-CD2 3.42Å; T274-F278 PolarHBondContact O-N 3.45Å; D275-F278 PolarHBondContact O-N 3.29Å; F278-L280 PolarHBondContact O-N 3.21Å; F278-L281 HydrophobicContact CD1-CD2 4.16Å; F278-L281 PolarHBondContact O-N 3.39Å; F278-A282 VanDerWaalsContact O-CB 3.23Å; F278-A282 WeakPolarHBondContact O-CB 3.36Å; F278-A282 PolarHBondContact O-N 3.26Å; F278-M291 HydrophobicContact CD1-CE 3.91Å; F278-M291 HydrophobicContact CE1-CE 3.88Å; F278-L293 HydrophobicContact CE1-CD1 4.08Å; F278-L293 HydrophobicContact CE1-CD2 3.57Å; F278-L293 HydrophobicContact CE1-CG 4.5Å; F278-L293 HydrophobicContact CE2-CD1 4.34Å; F278-L293 HydrophobicContact CE2-CD2 4.49Å; F278-L293 HydrophobicContact CZ-CD1 3.97Å; F278-L293 HydrophobicContact CZ-CD2 3.47Å; F278-L293 VanDerWaalsContact CZ-CD2 3.47Å; F278-L293 HydrophobicContact CZ-CG 4.31Å; F278-I299 HydrophobicContact CD2-CG2 3.8Å; F278-I299 HydrophobicContact CE2-CG2 3.58Å; F278-T303 HydrophobicContact CB-CG2 3.84Å; F278-T303 HydrophobicContact CD2-CG2 4.09Å; F278-T303 HydrophobicContact CG-CG2 3.94Å
279	T	98.7	Very high	98.5	Very high	25 Å²	25	41.7 Å²	41.7	15%	0.153	21%	0.208	C	C	.	.	H	α-helix	trans	-59.5	-47.1	172.8	-62.1	0	0	0	0	111.2	D275 G277 R283 Q306	D275-T279 VanDerWaalsContact O-CB 3.26Å; D275-T279 WeakPolarHBondContact O-CB 3.28Å; D275-T279 PolarHBondContact O-N 3.14Å; D275-T279 PolarHBondContact O-OG1 3.22Å; G277-T279 VanDerWaalsContact C-N 3.32Å; G277-T279 PolarHBondContact O-N 2.97Å; T279-R283 WeakPolarHBondContact O-CB 3.38Å; T279-R283 VanDerWaalsContact O-CG 3.26Å; T279-R283 WeakPolarHBondContact O-CG 3.33Å; T279-R283 PolarHBondContact O-N 2.94Å; T279-Q306 HydrophobicContact CG2-CG 3.94Å
280	L	98.3	Very high	98.5	Very high	74 Å²	74	41 Å²	41	39%	0.387	21%	0.208	S	C	.	.	H	α-helix	trans	-68.6	-39.1	178.9	-73	170	0	0	0	112.1	T253 A276 G277 F278 N284	T253-L280 HydrophobicContact CG2-CD1 4Å; T253-L280 WeakPolarHBondContact OG1-CD1 3.39Å; A276-L280 PolarHBondContact O-N 3.48Å; G277-L280 PolarHBondContact O-N 3.46Å; F278-L280 PolarHBondContact O-N 3.21Å; L280-N284 PolarHBondContact O-ND2 3.41Å
281	L	98.8	Very high	98.5	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-60.6	-55.9	174.7	-174.8	103.5	0	0	0	110.9	L252 L255 L262 L265 G277 F278 R283 N284 C285 L288 M291	L252-L281 HydrophobicContact CD2-CD1 4.14Å; L255-L281 HydrophobicContact CB-CD1 3.57Å; L255-L281 HydrophobicContact CD1-CD1 4.09Å; L255-L281 HydrophobicContact CG-CD1 4.48Å; L262-L281 HydrophobicContact CD2-CD1 4.35Å; L265-L281 HydrophobicContact CD2-CD1 4.06Å; L265-L281 HydrophobicContact CD2-CD2 3.76Å; G277-L281 PolarHBondContact O-N 3.03Å; F278-L281 HydrophobicContact CD1-CD2 4.16Å; F278-L281 PolarHBondContact O-N 3.39Å; L281-R283 VanDerWaalsContact C-N 3.29Å; L281-R283 PolarHBondContact O-N 3.05Å; L281-N284 PolarHBondContact O-N 3.15Å; L281-N284 VanDerWaalsContact O-N 3.1Å; L281-C285 WeakPolarHBondContact O-CB 3.4Å; L281-C285 PolarHBondContact O-N 2.81Å; L281-L288 HydrophobicContact CD2-CD1 3.79Å; L281-L288 HydrophobicContact CG-CD1 4.5Å; L281-M291 HydrophobicContact CD2-CE 4.1Å
282	A	98.5	Very high	98.6	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-58	-42.1	-175	0	0	0	0	0	111.7	F278 N284 C285 Q306 L307 H310	F278-A282 VanDerWaalsContact O-CB 3.23Å; F278-A282 WeakPolarHBondContact O-CB 3.36Å; F278-A282 PolarHBondContact O-N 3.26Å; A282-N284 PolarHBondContact O-N 2.93Å; A282-N284 VanDerWaalsContact O-N 3.12Å; A282-C285 PolarHBondContact O-N 3.4Å; A282-Q306 HydrophobicContact CB-CB 4.09Å; A282-L307 HydrophobicContact CB-CD2 4.03Å; A282-H310 HydrophobicContact CB-CB 4.2Å; A282-H310 WeakPolarHBondContact O-CB 3.27Å
283	R	98.4	Very high	98.6	Very high	131 Å²	131	36.2 Å²	36.2	49%	0.494	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-19.7	179.9	-78.4	177.7	-177.4	-167.5	4.5	115.1	T279 L281 H286	T279-R283 WeakPolarHBondContact O-CB 3.38Å; T279-R283 VanDerWaalsContact O-CG 3.26Å; T279-R283 WeakPolarHBondContact O-CG 3.33Å; T279-R283 PolarHBondContact O-N 2.94Å; L281-R283 VanDerWaalsContact C-N 3.29Å; L281-R283 PolarHBondContact O-N 3.05Å; R283-H286 PolarHBondContact O-CE1 2.75Å; R283-H286 PolarHBondContact O-NE2 2.81Å
284	N	98.3	Very high	98.6	Very high	67 Å²	67	39 Å²	39	36%	0.358	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-120.6	-15.4	-176.9	-61.3	-76.5	0	0	0	113.5	G256 L280 L281 A282	G256-N284 WeakPolarHBondContact O-CB 3.29Å; L280-N284 PolarHBondContact O-ND2 3.41Å; L281-N284 PolarHBondContact O-N 3.15Å; L281-N284 VanDerWaalsContact O-N 3.1Å; A282-N284 PolarHBondContact O-N 2.93Å; A282-N284 VanDerWaalsContact O-N 3.12Å
285	C	98.3	Very high	98.6	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.201	C	C	.	.			trans	-109.5	74.4	-178	-65.5	0	0	0	0	111.6	C259 L281 A282 E287 L288	C259-C285 PolarHBondContact O-SG 3.41Å; L281-C285 WeakPolarHBondContact O-CB 3.4Å; L281-C285 PolarHBondContact O-N 2.81Å; A282-C285 PolarHBondContact O-N 3.4Å; C285-E287 VanDerWaalsContact C-N 3.26Å; C285-E287 PolarHBondContact O-N 3.2Å; C285-L288 HydrophobicContact CB-CD1 3.72Å; C285-L288 HydrophobicContact CB-CG 3.93Å; C285-L288 WeakPolarHBondContact O-CD1 3.26Å; C285-L288 WeakPolarHBondContact O-CG 3.47Å
286	H	98.4	Very high	98.6	Very high	82 Å²	82	39.6 Å²	39.6	38%	0.38	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-6.9	-177.2	-52.5	-54.8	0	0	0	114.7	R283 H310	R283-H286 PolarHBondContact O-CE1 2.75Å; R283-H286 PolarHBondContact O-NE2 2.81Å; H286-H310 PolarHBondContact ND1-O 3.32Å
287	E	98.6	Very high	98.5	Very high	64 Å²	64	40.9 Å²	40.9	30%	0.299	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.7	3.8	179.9	-66.2	-64.2	138.5	0	0	113.2	L262 Q263 C285 E289 K313	L262-E287 CarbonylContact O-C 3.51Å; Q263-E287 WeakPolarHBondContact CA-O 3.12Å; Q263-E287 HydrophobicContact CG-CB 4.28Å; Q263-E287 WeakPolarHBondContact CG-O 3.45Å; C285-E287 VanDerWaalsContact C-N 3.26Å; C285-E287 PolarHBondContact O-N 3.2Å; E287-E289 WeakPolarHBondContact O-CG 3.41Å; E287-E289 PolarHBondContact O-N 3.22Å; E287-K313 IonicContact OE1-NZ 3.52Å; E287-K313 PolarHBondContact OE1-NZ 2.83Å; E287-K313 WeakPolarHBondContact OE2-CD 3.13Å; E287-K313 IonicContact OE2-NZ 3.63Å; E287-K313 PolarHBondContact OE2-NZ 3.01Å
288	L	98.8	Very high	98.5	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	21%	0.212	C	C	.	.			trans	-59.7	126	-179.4	-75.2	167.2	0	0	0	111.6	L262 L265 L281 C285 M291 C311 K313 L314	L262-L288 HydrophobicContact CB-CD2 4.36Å; L262-L288 HydrophobicContact CD2-CD2 4.14Å; L262-L288 HydrophobicContact CG-CD2 4.09Å; L262-L288 PolarHBondContact O-N 3.45Å; L265-L288 HydrophobicContact CB-CD2 4.38Å; L281-L288 HydrophobicContact CD2-CD1 3.79Å; L281-L288 HydrophobicContact CG-CD1 4.5Å; C285-L288 HydrophobicContact CB-CD1 3.72Å; C285-L288 HydrophobicContact CB-CG 3.93Å; C285-L288 WeakPolarHBondContact O-CD1 3.26Å; C285-L288 WeakPolarHBondContact O-CG 3.47Å; L288-M291 HydrophobicContact CD1-SD 3.87Å; L288-M291 HydrophobicContact CD2-CG 4.33Å; L288-C311 HydrophobicContact CB-CB 4.44Å; L288-K313 CarbonylContact O-C 3.21Å; L288-L314 WeakPolarHBondContact O-CA 3.23Å; L288-L314 PolarHBondContact O-N 3.36Å; L288-L314 VanDerWaalsContact O-N 3.09Å
289	E	98.8	Very high	98.5	Very high	50 Å²	50	44.6 Å²	44.6	23%	0.234	21%	0.212	C	C	.	.			trans	-116.5	-36.7	179.2	-58.7	-167	177.5	0	0	111.9	Q263 E287 K313 Q315 A316	Q263-E289 HydrophobicContact CB-CG 4.36Å; Q263-E289 WeakPolarHBondContact O-CA 3.22Å; Q263-E289 PolarHBondContact O-N 3.23Å; E287-E289 WeakPolarHBondContact O-CG 3.41Å; E287-E289 PolarHBondContact O-N 3.22Å; E289-K313 HydrophobicContact CG-CB 4.45Å; E289-Q315 VanDerWaalsContact CD-NE2 3.26Å; E289-Q315 WeakPolarHBondContact O-CA 3.35Å; E289-Q315 WeakPolarHBondContact O-CB 3.36Å; E289-Q315 PolarHBondContact O-N 3.22Å; E289-Q315 PolarHBondContact OE2-NE2 3.49Å; E289-A316 PolarHBondContact O-N 3.5Å
290	K	98.9	Very high	98.5	Very high	99 Å²	99	45.6 Å²	45.6	43%	0.43	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	128.7	-178.7	-56.4	-172.9	179.1	177.7	0	111.1	Q263 I264 L265 A316	Q263-K290 PolarHBondContact O-N 3.18Å; I264-K290 WeakPolarHBondContact CA-O 3.49Å; I264-K290 HydrophobicContact CB-CB 4.46Å; I264-K290 HydrophobicContact CD1-CD 4.28Å; I264-K290 HydrophobicContact CG1-CB 4.14Å; I264-K290 HydrophobicContact CG1-CD 4.32Å; I264-K290 HydrophobicContact CG1-CG 4.35Å; I264-K290 HydrophobicContact CG2-CB 4.19Å; L265-K290 PolarHBondContact N-O 3.36Å; K290-A316 WeakPolarHBondContact CA-O 3.11Å; K290-A316 HydrophobicContact CB-CB 4.42Å; K290-A316 HydrophobicContact CG-CB 4.06Å
291	M	98.9	Very high	98.5	Very high	5 Å²	5	43.1 Å²	43.1	3%	0.025	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	124.6	174.1	-69.6	-179.9	69.4	0	0	110	L265 F278 L281 L288 L293 L307 L314 A316 L317 S318	L265-M291 VanDerWaalsContact O-CA 3.28Å; L265-M291 WeakPolarHBondContact O-CA 3.37Å; F278-M291 HydrophobicContact CD1-CE 3.91Å; F278-M291 HydrophobicContact CE1-CE 3.88Å; L281-M291 HydrophobicContact CD2-CE 4.1Å; L288-M291 HydrophobicContact CD1-SD 3.87Å; L288-M291 HydrophobicContact CD2-CG 4.33Å; M291-L293 HydrophobicContact CB-CG 4.48Å; M291-L293 HydrophobicContact CE-CD1 4.07Å; M291-L293 HydrophobicContact CE-CD2 4Å; M291-L293 HydrophobicContact CE-CG 4.39Å; M291-L307 HydrophobicContact CE-CD1 4.16Å; M291-L307 HydrophobicContact CE-CD2 3.96Å; M291-L307 HydrophobicContact SD-CD1 4.03Å; M291-L307 HydrophobicContact SD-CD2 3.55Å; M291-L307 VanDerWaalsContact SD-CD2 3.55Å; M291-L307 HydrophobicContact SD-CG 4.46Å; M291-L314 HydrophobicContact CB-CD1 4.48Å; M291-L314 HydrophobicContact CG-CD1 4.17Å; M291-L314 HydrophobicContact SD-CD1 4.31Å; M291-A316 PolarHBondContact N-O 3.12Å; M291-L317 HydrophobicContact CB-CD1 3.75Å; M291-L317 CarbonylContact O-C 3.59Å; M291-L317 VanDerWaalsContact O-CA 3.32Å; M291-L317 WeakPolarHBondContact O-CA 3.39Å; M291-S318 PolarHBondContact O-N 3.49Å
292	D	98.9	Very high	98.5	Very high	36 Å²	36	45.2 Å²	45.2	19%	0.193	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	108.1	171.2	169.2	20.8	0	0	0	108.3	L265 E266 A267 A268 E294	L265-D292 PolarHBondContact O-N 2.95Å; E266-D292 HydrophobicContact CB-CB 4.21Å; E266-D292 HydrophobicContact CG-CB 4.12Å; A267-D292 CarbonylContact C-O 3.5Å; A267-D292 PolarHBondContact N-O 3.43Å; A268-D292 WeakPolarHBondContact CB-OD2 3.37Å; A268-D292 PolarHBondContact N-O 3.02Å; D292-E294 WeakPolarHBondContact OD1-CB 3.41Å; D292-E294 PolarHBondContact OD1-N 3.16Å; D292-E294 VanDerWaalsContact OD1-N 3.15Å
293	L	98.7	Very high	98.5	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	22%	0.22	C	C	.	.			trans	-114.8	23.8	-177.2	-50.5	-173.8	0	0	0	111.4	A267 F278 M291 E295 C296 I299 T303 L317 S318 L319 C322	A267-L293 HydrophobicContact CB-CD2 4.5Å; F278-L293 HydrophobicContact CE1-CD1 4.08Å; F278-L293 HydrophobicContact CE1-CD2 3.57Å; F278-L293 HydrophobicContact CE1-CG 4.5Å; F278-L293 HydrophobicContact CE2-CD1 4.34Å; F278-L293 HydrophobicContact CE2-CD2 4.49Å; F278-L293 HydrophobicContact CZ-CD1 3.97Å; F278-L293 HydrophobicContact CZ-CD2 3.47Å; F278-L293 VanDerWaalsContact CZ-CD2 3.47Å; F278-L293 HydrophobicContact CZ-CG 4.31Å; M291-L293 HydrophobicContact CB-CG 4.48Å; M291-L293 HydrophobicContact CE-CD1 4.07Å; M291-L293 HydrophobicContact CE-CD2 4Å; M291-L293 HydrophobicContact CE-CG 4.39Å; L293-E295 PolarHBondContact O-N 3.02Å; L293-C296 HydrophobicContact CB-CB 4.29Å; L293-C296 VanDerWaalsContact O-CB 3.26Å; L293-C296 WeakPolarHBondContact O-CB 3.4Å; L293-C296 PolarHBondContact O-N 3.14Å; L293-I299 HydrophobicContact CB-CD1 4.2Å; L293-I299 HydrophobicContact CD1-CD1 4.02Å; L293-T303 HydrophobicContact CD1-CG2 4.34Å; L293-L317 HydrophobicContact CD1-CD1 4.45Å; L293-S318 WeakPolarHBondContact CB-O 3.41Å; L293-S318 PolarHBondContact N-O 2.93Å; L293-L319 HydrophobicContact CB-CD2 4.43Å; L293-L319 HydrophobicContact CD1-CD2 4.15Å; L293-C322 PolarHBondContact O-SG 3.11Å
294	E	98.7	Very high	98.6	Very high	64 Å²	64	39 Å²	39	30%	0.299	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.7	134.8	179.8	175.1	-175.1	171.7	0	0	111.3	A268 R269 D292 C296 S320	A268-E294 CarbonylContact C-O 3.6Å; A268-E294 WeakPolarHBondContact CA-O 3.47Å; A268-E294 HydrophobicContact CB-CB 3.82Å; R269-E294 PolarHBondContact N-O 3.08Å; D292-E294 WeakPolarHBondContact OD1-CB 3.41Å; D292-E294 PolarHBondContact OD1-N 3.16Å; D292-E294 VanDerWaalsContact OD1-N 3.15Å; E294-C296 PolarHBondContact O-N 2.81Å; E294-S320 CarbonylContact C-O 3.51Å; E294-S320 VanDerWaalsContact CA-O 3.22Å; E294-S320 WeakPolarHBondContact CA-O 3.39Å
295	E	98.2	Very high	98.6	Very high	77 Å²	77	37.9 Å²	37.9	36%	0.36	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.8	20.7	-177.2	-65.4	-177.6	-133.6	0	0	115.2	R269 L293 I297 S320 H321	R269-E295 HydrophobicContact CG-CB 3.97Å; R269-E295 HydrophobicContact CG-CG 4.23Å; R269-E295 WeakPolarHBondContact CG-OE2 3.46Å; L293-E295 PolarHBondContact O-N 3.02Å; E295-I297 PolarHBondContact O-N 3.16Å; E295-S320 PolarHBondContact N-O 3.28Å; E295-H321 HydrophobicContact CB-CB 4.48Å; E295-H321 HydrophobicContact CG-CB 3.79Å
296	C	98.3	Very high	98.6	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.196	C	C	.	.			trans	-79.6	64	164	-71.1	0	0	0	0	110.6	A267 C270 L293 E294 L298 I299	A267-C296 PolarHBondContact O-SG 2.76Å; C270-C296 PolarHBondContact O-SG 2.75Å; L293-C296 HydrophobicContact CB-CB 4.29Å; L293-C296 VanDerWaalsContact O-CB 3.26Å; L293-C296 WeakPolarHBondContact O-CB 3.4Å; L293-C296 PolarHBondContact O-N 3.14Å; E294-C296 PolarHBondContact O-N 2.81Å; C296-L298 PolarHBondContact O-N 2.89Å; C296-I299 HydrophobicContact CB-CD1 4.4Å; C296-I299 HydrophobicContact CB-CG2 3.91Å; C296-I299 WeakPolarHBondContact O-CG1 3.45Å; C296-I299 WeakPolarHBondContact O-CG2 3.15Å; C296-I299 PolarHBondContact O-N 3.17Å
297	I	97.8	Very high	98.6	Very high	84 Å²	84	35.2 Å²	35.2	43%	0.431	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-15.2	-167.1	63.4	174.6	0	0	0	116.6	E295	E295-I297 PolarHBondContact O-N 3.16Å
298	L	98.4	Very high	98.6	Very high	78 Å²	78	32.7 Å²	32.7	41%	0.408	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-4.6	-179.4	-59.9	178.8	0	0	0	113.5	S271 T274 C296	S271-L298 VanDerWaalsContact O-CD1 3.28Å; S271-L298 WeakPolarHBondContact O-CD1 3.41Å; S271-L298 WeakPolarHBondContact O-CG 3.36Å; T274-L298 HydrophobicContact CG2-CB 4.19Å; T274-L298 HydrophobicContact CG2-CD1 3.96Å; C296-L298 PolarHBondContact O-N 2.89Å
299	I	98.3	Very high	98.6	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.192	C	C	.	.			trans	-75.7	141.8	177.3	73.9	179.3	0	0	0	110.6	F278 L293 C296 L319 C322 L324 I325	F278-I299 HydrophobicContact CD2-CG2 3.8Å; F278-I299 HydrophobicContact CE2-CG2 3.58Å; L293-I299 HydrophobicContact CB-CD1 4.2Å; L293-I299 HydrophobicContact CD1-CD1 4.02Å; C296-I299 HydrophobicContact CB-CD1 4.4Å; C296-I299 HydrophobicContact CB-CG2 3.91Å; C296-I299 WeakPolarHBondContact O-CG1 3.45Å; C296-I299 WeakPolarHBondContact O-CG2 3.15Å; C296-I299 PolarHBondContact O-N 3.17Å; I299-L319 HydrophobicContact CD1-CD2 3.73Å; I299-C322 HydrophobicContact CD1-CB 3.84Å; I299-C322 WeakPolarHBondContact CD1-SG 3.37Å; I299-C322 HydrophobicContact CG1-CB 3.78Å; I299-L324 WeakPolarHBondContact O-CB 3.32Å; I299-I325 HydrophobicContact CD1-CD1 4.48Å; I299-I325 HydrophobicContact CG1-CD1 4.17Å
300	T	98.8	Very high	98.6	Very high	46 Å²	46	37.3 Å²	37.3	28%	0.282	19%	0.191	S	C	.	.			trans	-120.8	-176.8	176.2	71.2	0	0	0	0	110.3	D275 S302 T303 L324 I325	D275-T300 VanDerWaalsContact CG-OG1 3.27Å; D275-T300 PolarHBondContact OD1-N 2.82Å; D275-T300 PolarHBondContact OD1-OG1 3.26Å; D275-T300 WeakPolarHBondContact OD2-CB 3.45Å; D275-T300 WeakPolarHBondContact OD2-CG2 3.15Å; D275-T300 PolarHBondContact OD2-N 3.26Å; D275-T300 PolarHBondContact OD2-OG1 2.77Å; T300-S302 PolarHBondContact O-N 2.96Å; T300-S302 PolarHBondContact OG1-N 3.29Å; T300-T303 PolarHBondContact O-N 3.08Å; T300-L324 HydrophobicContact CG2-CB 4.15Å; T300-L324 HydrophobicContact CG2-CD1 3.96Å; T300-I325 VanDerWaalsContact C-CD1 3.5Å; T300-I325 WeakPolarHBondContact O-CD1 3.47Å
301	D	98.8	Very high	98.5	Very high	22 Å²	22	32.6 Å²	32.6	12%	0.118	17%	0.171	C	C	.	.	H	α-helix	trans	-54.2	-24.3	173.9	-63.5	-36.4	0	0	0	112.8	T303 L304 I305 T326 G329	D301-T303 VanDerWaalsContact C-N 3.29Å; D301-T303 PolarHBondContact O-N 3.35Å; D301-L304 PolarHBondContact O-N 3.2Å; D301-I305 VanDerWaalsContact O-CG1 3.32Å; D301-I305 WeakPolarHBondContact O-CG1 3.46Å; D301-I305 PolarHBondContact O-N 3.21Å; D301-T326 PolarHBondContact OD1-N 3Å; D301-T326 WeakPolarHBondContact OD2-CB 3.5Å; D301-T326 WeakPolarHBondContact OD2-CG2 3.26Å; D301-T326 PolarHBondContact OD2-OG1 3.21Å; D301-G329 VanDerWaalsContact CG-N 3.34Å; D301-G329 WeakPolarHBondContact OD1-CA 3.34Å; D301-G329 PolarHBondContact OD1-N 3.36Å
302	S	98.8	Very high	98.5	Very high	45 Å²	45	34.7 Å²	34.7	32%	0.315	18%	0.184	S	C	.	.	H	α-helix	trans	-56.4	-40.3	174.6	-178.8	0	0	0	0	112.7	T300 I305 Q306	T300-S302 PolarHBondContact O-N 2.96Å; T300-S302 PolarHBondContact OG1-N 3.29Å; S302-I305 PolarHBondContact O-N 3.46Å; S302-Q306 WeakPolarHBondContact O-CG 3.44Å; S302-Q306 PolarHBondContact O-N 3.48Å; S302-Q306 VanDerWaalsContact O-N 3.07Å
303	T	98.8	Very high	98.4	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-59.6	-46.9	174.3	-72.8	0	0	0	0	110.9	D275 F278 L293 T300 D301 I305 Q306 L307	D275-T303 WeakPolarHBondContact CA-OG1 3.35Å; D275-T303 WeakPolarHBondContact OD1-CB 3.26Å; D275-T303 PolarHBondContact OD1-N 3.27Å; D275-T303 PolarHBondContact OD1-OG1 3.28Å; F278-T303 HydrophobicContact CB-CG2 3.84Å; F278-T303 HydrophobicContact CD2-CG2 4.09Å; F278-T303 HydrophobicContact CG-CG2 3.94Å; L293-T303 HydrophobicContact CD1-CG2 4.34Å; T300-T303 PolarHBondContact O-N 3.08Å; D301-T303 VanDerWaalsContact C-N 3.29Å; D301-T303 PolarHBondContact O-N 3.35Å; T303-I305 VanDerWaalsContact C-N 3.34Å; T303-I305 PolarHBondContact O-N 3.48Å; T303-Q306 PolarHBondContact O-N 2.64Å; T303-L307 HydrophobicContact CG2-CD1 4.04Å; T303-L307 HydrophobicContact CG2-CG 4.44Å; T303-L307 WeakPolarHBondContact O-CG 3.38Å; T303-L307 PolarHBondContact O-N 2.74Å
304	L	98.7	Very high	98.4	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-64.8	-38.1	179.6	-57.7	-172.3	0	0	0	112.2	D301 Q306 L307 S308 L317 L319 I325 I330	D301-L304 PolarHBondContact O-N 3.2Å; L304-Q306 PolarHBondContact O-N 3.17Å; L304-L307 HydrophobicContact CD2-CD1 4.46Å; L304-L307 PolarHBondContact O-N 3.4Å; L304-S308 VanDerWaalsContact O-CB 3.27Å; L304-S308 WeakPolarHBondContact O-CB 3.45Å; L304-S308 PolarHBondContact O-N 3.26Å; L304-S308 PolarHBondContact O-OG 3.08Å; L304-L317 HydrophobicContact CD2-CD2 3.82Å; L304-L319 HydrophobicContact CD1-CD1 3.86Å; L304-L319 HydrophobicContact CD2-CD1 3.6Å; L304-L319 HydrophobicContact CD2-CD2 3.92Å; L304-L319 HydrophobicContact CD2-CG 4.4Å; L304-L319 HydrophobicContact CG-CD1 4.33Å; L304-I325 HydrophobicContact CD1-CD1 3.98Å; L304-I325 HydrophobicContact CD1-CG2 3.77Å; L304-I325 HydrophobicContact CG-CD1 4.1Å; L304-I330 HydrophobicContact CD1-CD1 4.13Å
305	I	98.8	Very high	98.4	Very high	43 Å²	43	34.6 Å²	34.6	22%	0.221	18%	0.182	C	C	.	.	H	α-helix	trans	-58.7	-48.7	173.8	-66.8	166	0	0	0	110.1	D301 S302 T303 L307 S308 I309 H332	D301-I305 VanDerWaalsContact O-CG1 3.32Å; D301-I305 WeakPolarHBondContact O-CG1 3.46Å; D301-I305 PolarHBondContact O-N 3.21Å; S302-I305 PolarHBondContact O-N 3.46Å; T303-I305 VanDerWaalsContact C-N 3.34Å; T303-I305 PolarHBondContact O-N 3.48Å; I305-L307 PolarHBondContact O-N 3.15Å; I305-S308 PolarHBondContact O-N 3.01Å; I305-S308 PolarHBondContact O-OG 2.63Å; I305-I309 HydrophobicContact CG2-CD1 3.92Å; I305-I309 WeakPolarHBondContact O-CD1 3.5Å; I305-I309 WeakPolarHBondContact O-CG1 3.32Å; I305-I309 PolarHBondContact O-N 3.41Å; I305-H332 HydrophobicContact CG1-CB 4.12Å
306	Q	98.7	Very high	98.5	Very high	26 Å²	26	32 Å²	32	12%	0.121	17%	0.173	C	C	.	.	H	α-helix	trans	-66.2	-39.2	-179.9	-62.3	-56.2	-65.4	0	0	112.6	T279 A282 S302 T303 L304 I309 H310	T279-Q306 HydrophobicContact CG2-CG 3.94Å; A282-Q306 HydrophobicContact CB-CB 4.09Å; S302-Q306 WeakPolarHBondContact O-CG 3.44Å; S302-Q306 PolarHBondContact O-N 3.48Å; S302-Q306 VanDerWaalsContact O-N 3.07Å; T303-Q306 PolarHBondContact O-N 2.64Å; L304-Q306 PolarHBondContact O-N 3.17Å; Q306-I309 PolarHBondContact O-N 3.45Å; Q306-H310 WeakPolarHBondContact O-CB 3.47Å; Q306-H310 PolarHBondContact O-CD2 2.87Å; Q306-H310 PolarHBondContact O-N 3.23Å
307	L	98.5	Very high	98.5	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-63.6	-41.9	175.1	-66.6	177.1	0	0	0	111.7	A282 M291 T303 L304 I305 I309 H310 C311 L317	A282-L307 HydrophobicContact CB-CD2 4.03Å; M291-L307 HydrophobicContact CE-CD1 4.16Å; M291-L307 HydrophobicContact CE-CD2 3.96Å; M291-L307 HydrophobicContact SD-CD1 4.03Å; M291-L307 HydrophobicContact SD-CD2 3.55Å; M291-L307 VanDerWaalsContact SD-CD2 3.55Å; M291-L307 HydrophobicContact SD-CG 4.46Å; T303-L307 HydrophobicContact CG2-CD1 4.04Å; T303-L307 HydrophobicContact CG2-CG 4.44Å; T303-L307 WeakPolarHBondContact O-CG 3.38Å; T303-L307 PolarHBondContact O-N 2.74Å; L304-L307 HydrophobicContact CD2-CD1 4.46Å; L304-L307 PolarHBondContact O-N 3.4Å; I305-L307 PolarHBondContact O-N 3.15Å; L307-I309 PolarHBondContact O-N 2.83Å; L307-H310 PolarHBondContact O-N 2.83Å; L307-C311 HydrophobicContact CD2-CB 4.44Å; L307-C311 VanDerWaalsContact CD2-SG 3.6Å; L307-C311 VanDerWaalsContact O-CB 3.31Å; L307-C311 WeakPolarHBondContact O-CB 3.35Å; L307-C311 PolarHBondContact O-N 3.47Å; L307-L317 HydrophobicContact CD1-CD1 4.34Å
308	S	98.1	Very high	98.5	Very high	12 Å²	12	28.3 Å²	28.3	8%	0.084	16%	0.155	C	C	.	.	H	α-helix	trans	-59.4	-33.3	178.3	76.8	0	0	0	0	112.8	L304 I305 H332 S336	L304-S308 VanDerWaalsContact O-CB 3.27Å; L304-S308 WeakPolarHBondContact O-CB 3.45Å; L304-S308 PolarHBondContact O-N 3.26Å; L304-S308 PolarHBondContact O-OG 3.08Å; I305-S308 PolarHBondContact O-N 3.01Å; I305-S308 PolarHBondContact O-OG 2.63Å; S308-H332 WeakPolarHBondContact CB-O 3.47Å; S308-S336 WeakPolarHBondContact O-CB 3.39Å
309	I	98.3	Very high	98.5	Very high	99 Å²	99	24.6 Å²	24.6	51%	0.508	14%	0.136	S	C	.	.	H	α-helix	trans	-84.3	-46.6	-179	-63.3	164.1	0	0	0	111.1	I305 Q306 L307	I305-I309 HydrophobicContact CG2-CD1 3.92Å; I305-I309 WeakPolarHBondContact O-CD1 3.5Å; I305-I309 WeakPolarHBondContact O-CG1 3.32Å; I305-I309 PolarHBondContact O-N 3.41Å; Q306-I309 PolarHBondContact O-N 3.45Å; L307-I309 PolarHBondContact O-N 2.83Å
310	H	98.5	Very high	98.6	Very high	48 Å²	48	24.9 Å²	24.9	22%	0.222	14%	0.138	C	C	.	.	H	α-helix	trans	-105.2	-10.4	-164.1	-61.9	-68.4	0	0	0	115	A282 H286 Q306 L307 P312	A282-H310 HydrophobicContact CB-CB 4.2Å; A282-H310 WeakPolarHBondContact O-CB 3.27Å; H286-H310 PolarHBondContact ND1-O 3.32Å; Q306-H310 WeakPolarHBondContact O-CB 3.47Å; Q306-H310 PolarHBondContact O-CD2 2.87Å; Q306-H310 PolarHBondContact O-N 3.23Å; L307-H310 PolarHBondContact O-N 2.83Å; H310-P312 VanDerWaalsContact C-CD 3.42Å; H310-P312 WeakPolarHBondContact O-CD 3.49Å
311	C	98.3	Very high	98.5	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.137	C	C	.	.			trans	-116.5	71.6	-176.2	-58.1	0	0	0	0	111.7	L288 L307 K313 L314 C338	L288-C311 HydrophobicContact CB-CB 4.44Å; L307-C311 HydrophobicContact CD2-CB 4.44Å; L307-C311 VanDerWaalsContact CD2-SG 3.6Å; L307-C311 VanDerWaalsContact O-CB 3.31Å; L307-C311 WeakPolarHBondContact O-CB 3.35Å; L307-C311 PolarHBondContact O-N 3.47Å; C311-K313 PolarHBondContact O-N 2.97Å; C311-L314 HydrophobicContact CB-CB 4.46Å; C311-L314 PolarHBondContact O-N 3.36Å; C311-C338 WeakPolarHBondContact O-CB 3.48Å; C311-C338 PolarHBondContact O-SG 3.01Å; C311-C338 VanDerWaalsContact O-SG 3.4Å
312	P	97.9	Very high	98.5	Very high	48 Å²	48	24.5 Å²	24.5	31%	0.312	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-8.4	-174.5	30.4	-37.7	0	0	0	113.9	H310 T337 R342	H310-P312 VanDerWaalsContact C-CD 3.42Å; H310-P312 WeakPolarHBondContact O-CD 3.49Å; P312-T337 WeakPolarHBondContact CB-OG1 3.46Å; P312-R342 VanDerWaalsContact O-CD 3.28Å; P312-R342 WeakPolarHBondContact O-CD 3.25Å; P312-R342 PolarHBondContact O-NE 3.45Å
313	K	98.2	Very high	98.4	Very high	56 Å²	56	27.2 Å²	27.2	24%	0.243	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.6	4	-177.5	-59.2	-166.7	173.8	166.8	0	114.2	E287 L288 E289 C311 Q315	E287-K313 IonicContact OE1-NZ 3.52Å; E287-K313 PolarHBondContact OE1-NZ 2.83Å; E287-K313 WeakPolarHBondContact OE2-CD 3.13Å; E287-K313 IonicContact OE2-NZ 3.63Å; E287-K313 PolarHBondContact OE2-NZ 3.01Å; L288-K313 CarbonylContact O-C 3.21Å; E289-K313 HydrophobicContact CG-CB 4.45Å; C311-K313 PolarHBondContact O-N 2.97Å; K313-Q315 WeakPolarHBondContact O-CG 3.36Å; K313-Q315 PolarHBondContact O-N 3.34Å
314	L	98.6	Very high	98.4	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.161	C	C	.	.			trans	-61.4	130.7	-176.1	-166.2	65.6	0	0	0	111.3	L288 M291 C311 L317 L333 C338 R342	L288-L314 WeakPolarHBondContact O-CA 3.23Å; L288-L314 PolarHBondContact O-N 3.36Å; L288-L314 VanDerWaalsContact O-N 3.09Å; M291-L314 HydrophobicContact CB-CD1 4.48Å; M291-L314 HydrophobicContact CG-CD1 4.17Å; M291-L314 HydrophobicContact SD-CD1 4.31Å; C311-L314 HydrophobicContact CB-CB 4.46Å; C311-L314 PolarHBondContact O-N 3.36Å; L314-L317 HydrophobicContact CD2-CB 4.3Å; L314-L317 HydrophobicContact CD2-CD2 4.25Å; L314-L333 HydrophobicContact CD2-CD1 4.35Å; L314-C338 HydrophobicContact CB-CB 4.02Å; L314-R342 CarbonylContact O-C 3.57Å
315	Q	98.4	Very high	98.4	Very high	43 Å²	43	31.3 Å²	31.3	20%	0.201	16%	0.161	C	C	.	.			trans	-122.4	-37.6	-175.3	-65.2	172.1	39.2	0	0	112.6	E289 K313 R342 R344 V345	E289-Q315 VanDerWaalsContact CD-NE2 3.26Å; E289-Q315 WeakPolarHBondContact O-CA 3.35Å; E289-Q315 WeakPolarHBondContact O-CB 3.36Å; E289-Q315 PolarHBondContact O-N 3.22Å; E289-Q315 PolarHBondContact OE2-NE2 3.49Å; K313-Q315 WeakPolarHBondContact O-CG 3.36Å; K313-Q315 PolarHBondContact O-N 3.34Å; Q315-R342 WeakPolarHBondContact CA-O 3.33Å; Q315-R344 PolarHBondContact O-N 3.19Å; Q315-V345 PolarHBondContact O-N 3.07Å; Q315-V345 VanDerWaalsContact O-N 3.08Å
316	A	98.8	Very high	98.4	Very high	21 Å²	21	31.2 Å²	31.2	17%	0.174	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	127.8	179.1	0	0	0	0	0	110.3	E289 K290 M291 V345	E289-A316 PolarHBondContact O-N 3.5Å; K290-A316 WeakPolarHBondContact CA-O 3.11Å; K290-A316 HydrophobicContact CB-CB 4.42Å; K290-A316 HydrophobicContact CG-CB 4.06Å; M291-A316 PolarHBondContact N-O 3.12Å; A316-V345 WeakPolarHBondContact CA-O 3.16Å; A316-V345 HydrophobicContact CB-CB 3.89Å
317	L	98.9	Very high	98.4	Very high	1 Å²	1	31.2 Å²	31.2	1%	0.005	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	122.5	177.5	-178.9	62.9	0	0	0	109.4	M291 L293 L304 L307 L314 L319 L333 V345 L346 E347	M291-L317 HydrophobicContact CB-CD1 3.75Å; M291-L317 CarbonylContact O-C 3.59Å; M291-L317 VanDerWaalsContact O-CA 3.32Å; M291-L317 WeakPolarHBondContact O-CA 3.39Å; L293-L317 HydrophobicContact CD1-CD1 4.45Å; L304-L317 HydrophobicContact CD2-CD2 3.82Å; L307-L317 HydrophobicContact CD1-CD1 4.34Å; L314-L317 HydrophobicContact CD2-CB 4.3Å; L314-L317 HydrophobicContact CD2-CD2 4.25Å; L317-L319 HydrophobicContact CD1-CD2 4.06Å; L317-L319 HydrophobicContact CD1-CG 4.41Å; L317-L319 HydrophobicContact CD2-CD1 3.92Å; L317-L319 HydrophobicContact CD2-CD2 4.23Å; L317-L319 HydrophobicContact CD2-CG 4.12Å; L317-L319 HydrophobicContact CG-CD1 4.26Å; L317-L319 HydrophobicContact CG-CD2 4.1Å; L317-L319 HydrophobicContact CG-CG 3.94Å; L317-L333 HydrophobicContact CD2-CD1 4.34Å; L317-L333 HydrophobicContact CD2-CD2 4.08Å; L317-V345 PolarHBondContact N-O 3.48Å; L317-L346 HydrophobicContact CB-CD1 4.05Å; L317-L346 HydrophobicContact CD2-CD1 4.19Å; L317-L346 HydrophobicContact CG-CD1 4.27Å; L317-L346 WeakPolarHBondContact O-CA 3.29Å; L317-E347 PolarHBondContact O-N 2.84Å
318	S	98.8	Very high	98.4	Very high	6 Å²	6	34.8 Å²	34.8	4%	0.042	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	127	169	-168.4	0	0	0	0	110	M291 L293 E347	M291-S318 PolarHBondContact O-N 3.49Å; L293-S318 WeakPolarHBondContact CB-O 3.41Å; L293-S318 PolarHBondContact N-O 2.93Å; S318-E347 WeakPolarHBondContact CB-OE2 3.43Å; S318-E347 WeakPolarHBondContact OG-CB 3.3Å; S318-E347 PolarHBondContact OG-OE2 2.98Å
319	L	98.8	Very high	98.5	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.179	C	C	.	.			trans	-124	20.2	178	-57.5	168.1	0	0	0	110.1	L293 I299 L304 L317 H321 C322 I325 L346 E347 L348 C351	L293-L319 HydrophobicContact CB-CD2 4.43Å; L293-L319 HydrophobicContact CD1-CD2 4.15Å; I299-L319 HydrophobicContact CD1-CD2 3.73Å; L304-L319 HydrophobicContact CD1-CD1 3.86Å; L304-L319 HydrophobicContact CD2-CD1 3.6Å; L304-L319 HydrophobicContact CD2-CD2 3.92Å; L304-L319 HydrophobicContact CD2-CG 4.4Å; L304-L319 HydrophobicContact CG-CD1 4.33Å; L317-L319 HydrophobicContact CD1-CD2 4.06Å; L317-L319 HydrophobicContact CD1-CG 4.41Å; L317-L319 HydrophobicContact CD2-CD1 3.92Å; L317-L319 HydrophobicContact CD2-CD2 4.23Å; L317-L319 HydrophobicContact CD2-CG 4.12Å; L317-L319 HydrophobicContact CG-CD1 4.26Å; L317-L319 HydrophobicContact CG-CD2 4.1Å; L317-L319 HydrophobicContact CG-CG 3.94Å; L319-H321 PolarHBondContact O-N 3.1Å; L319-C322 HydrophobicContact CB-CB 4.26Å; L319-C322 WeakPolarHBondContact O-CB 3.48Å; L319-C322 PolarHBondContact O-N 3.28Å; L319-C322 PolarHBondContact O-SG 2.88Å; L319-I325 HydrophobicContact CD1-CG2 4.45Å; L319-L346 HydrophobicContact CD1-CD1 4.49Å; L319-E347 PolarHBondContact N-O 3.37Å; L319-L348 HydrophobicContact CB-CD2 4.12Å; L319-L348 HydrophobicContact CD1-CD2 3.71Å; L319-L348 HydrophobicContact CG-CD2 4.4Å; L319-C351 PolarHBondContact O-SG 3.46Å
320	S	98.5	Very high	98.5	Very high	6 Å²	6	29.5 Å²	29.5	4%	0.042	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	138.3	-176.6	-61.4	0	0	0	0	110.6	E294 E295 C322 D349	E294-S320 CarbonylContact C-O 3.51Å; E294-S320 VanDerWaalsContact CA-O 3.22Å; E294-S320 WeakPolarHBondContact CA-O 3.39Å; E295-S320 PolarHBondContact N-O 3.28Å; S320-C322 PolarHBondContact O-N 3.32Å; S320-C322 VanDerWaalsContact O-N 3.16Å; S320-D349 CarbonylContact C-O 3.42Å; S320-D349 WeakPolarHBondContact CA-O 3.3Å; S320-D349 PolarHBondContact OG-N 3.03Å; S320-D349 PolarHBondContact OG-OD2 2.93Å
321	H	98.4	Very high	98.5	Very high	60 Å²	60	29.8 Å²	29.8	28%	0.278	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.3	15.8	-173	-59.9	-81.5	0	0	0	116	E295 L319 E323 D349 N350	E295-H321 HydrophobicContact CB-CB 4.48Å; E295-H321 HydrophobicContact CG-CB 3.79Å; L319-H321 PolarHBondContact O-N 3.1Å; H321-E323 PolarHBondContact O-N 3.45Å; H321-D349 PolarHBondContact N-O 2.79Å; H321-N350 PolarHBondContact CE1-OD1 3.17Å; H321-N350 WeakPolarHBondContact ND1-CB 3.5Å
322	C	98.2	Very high	98.5	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.173	C	C	.	.			trans	-86.9	79.3	169.5	-58.8	0	0	0	0	109.4	L293 I299 L319 S320 L324 I325 C351	L293-C322 PolarHBondContact O-SG 3.11Å; I299-C322 HydrophobicContact CD1-CB 3.84Å; I299-C322 WeakPolarHBondContact CD1-SG 3.37Å; I299-C322 HydrophobicContact CG1-CB 3.78Å; L319-C322 HydrophobicContact CB-CB 4.26Å; L319-C322 WeakPolarHBondContact O-CB 3.48Å; L319-C322 PolarHBondContact O-N 3.28Å; L319-C322 PolarHBondContact O-SG 2.88Å; S320-C322 PolarHBondContact O-N 3.32Å; S320-C322 VanDerWaalsContact O-N 3.16Å; C322-L324 PolarHBondContact O-N 3.1Å; C322-L324 VanDerWaalsContact O-N 3.11Å; C322-I325 HydrophobicContact CB-CG1 3.71Å; C322-I325 WeakPolarHBondContact O-CB 3.36Å; C322-I325 WeakPolarHBondContact O-CG1 3.48Å; C322-I325 PolarHBondContact O-N 3.47Å; C322-I325 VanDerWaalsContact O-N 3.16Å; C322-C351 PolarHBondContact O-SG 3.28Å
323	E	97.3	Very high	98.5	Very high	103 Å²	103	30.9 Å²	30.9	48%	0.481	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-19.6	-168.6	-63.1	-175.2	178.5	0	0	114.7	H321 L353	H321-E323 PolarHBondContact O-N 3.45Å; E323-L353 WeakPolarHBondContact O-CD1 3.28Å
324	L	98.4	Very high	98.5	Very high	85 Å²	85	28.2 Å²	28.2	45%	0.445	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-2.1	-179.3	-56.1	176.5	0	0	0	113.7	I299 T300 C322	I299-L324 WeakPolarHBondContact O-CB 3.32Å; T300-L324 HydrophobicContact CG2-CB 4.15Å; T300-L324 HydrophobicContact CG2-CD1 3.96Å; C322-L324 PolarHBondContact O-N 3.1Å; C322-L324 VanDerWaalsContact O-N 3.11Å
325	I	98.6	Very high	98.4	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.169	C	C	.	.			trans	-76.3	132.2	175.4	-61.3	-57.8	0	0	0	110	I299 T300 L304 L319 C322 I330 I354	I299-I325 HydrophobicContact CD1-CD1 4.48Å; I299-I325 HydrophobicContact CG1-CD1 4.17Å; T300-I325 VanDerWaalsContact C-CD1 3.5Å; T300-I325 WeakPolarHBondContact O-CD1 3.47Å; L304-I325 HydrophobicContact CD1-CD1 3.98Å; L304-I325 HydrophobicContact CD1-CG2 3.77Å; L304-I325 HydrophobicContact CG-CD1 4.1Å; L319-I325 HydrophobicContact CD1-CG2 4.45Å; C322-I325 HydrophobicContact CB-CG1 3.71Å; C322-I325 WeakPolarHBondContact O-CB 3.36Å; C322-I325 WeakPolarHBondContact O-CG1 3.48Å; C322-I325 PolarHBondContact O-N 3.47Å; C322-I325 VanDerWaalsContact O-N 3.16Å; I325-I330 HydrophobicContact CG2-CD1 4.35Å; I325-I354 HydrophobicContact CG2-CD1 4.21Å
326	T	98.8	Very high	98.3	Very high	42 Å²	42	30.7 Å²	30.7	26%	0.258	16%	0.161	S	C	.	.	B	Isolated β-bridge	trans	-121	177.1	-179.9	83.1	0	0	0	0	111.9	D301 D328 G329 L353	D301-T326 PolarHBondContact OD1-N 3Å; D301-T326 WeakPolarHBondContact OD2-CB 3.5Å; D301-T326 WeakPolarHBondContact OD2-CG2 3.26Å; D301-T326 PolarHBondContact OD2-OG1 3.21Å; T326-D328 PolarHBondContact O-N 3.25Å; T326-D328 VanDerWaalsContact O-N 3.16Å; T326-D328 PolarHBondContact OG1-N 2.89Å; T326-G329 PolarHBondContact O-N 3.44Å; T326-L353 HydrophobicContact CG2-CB 4.17Å; T326-L353 HydrophobicContact CG2-CD1 3.83Å
327	D	98.8	Very high	98.2	Very high	25 Å²	25	33.9 Å²	33.9	13%	0.134	18%	0.179	C	C	.	.	H	α-helix	trans	-57.9	-25.1	175.2	-58.5	-32.6	0	0	0	112.8	I330 L331 T355 V357 A358	D327-I330 PolarHBondContact O-N 3.31Å; D327-L331 PolarHBondContact O-N 3Å; D327-T355 PolarHBondContact OD1-N 3.37Å; D327-T355 WeakPolarHBondContact OD2-CB 3.27Å; D327-T355 WeakPolarHBondContact OD2-CG2 3.3Å; D327-T355 PolarHBondContact OD2-OG1 3.35Å; D327-V357 HydrophobicContact CB-CB 4.39Å; D327-V357 HydrophobicContact CB-CG1 4.3Å; D327-A358 HydrophobicContact CB-CB 4.24Å; D327-A358 WeakPolarHBondContact OD1-CB 3.47Å; D327-A358 PolarHBondContact OD1-N 3.42Å
328	D	98.7	Very high	98	Very high	76 Å²	76	33.8 Å²	33.8	41%	0.406	18%	0.179	S	C	.	.	H	α-helix	trans	-66.7	-46.2	179.6	-173.8	72.5	0	0	0	112.4	T326 I330 L331 H332	T326-D328 PolarHBondContact O-N 3.25Å; T326-D328 VanDerWaalsContact O-N 3.16Å; T326-D328 PolarHBondContact OG1-N 2.89Å; D328-I330 PolarHBondContact O-N 3.5Å; D328-L331 WeakPolarHBondContact O-CB 3.42Å; D328-L331 PolarHBondContact O-N 3.44Å; D328-L331 VanDerWaalsContact O-N 3.16Å; D328-H332 PolarHBondContact O-CD2 3.25Å; D328-H332 PolarHBondContact O-N 2.86Å; D328-H332 VanDerWaalsContact O-N 3.12Å; D328-H332 IonicContact OD2-CD2 3.49Å
329	G	98.6	Very high	97.9	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-62.4	-34.9	175	0	0	0	0	0	112.2	D301 T326 H332 L333	D301-G329 VanDerWaalsContact CG-N 3.34Å; D301-G329 WeakPolarHBondContact OD1-CA 3.34Å; D301-G329 PolarHBondContact OD1-N 3.36Å; T326-G329 PolarHBondContact O-N 3.44Å; G329-H332 PolarHBondContact O-N 3.32Å; G329-L333 PolarHBondContact O-N 3.05Å
330	I	98.7	Very high	97.7	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-69.9	-37.8	175	-55.7	-54.5	0	0	0	111.9	L304 I325 D327 D328 H332 L333 S334 L346 L348 I354 A358 L362	L304-I330 HydrophobicContact CD1-CD1 4.13Å; I325-I330 HydrophobicContact CG2-CD1 4.35Å; D327-I330 PolarHBondContact O-N 3.31Å; D328-I330 PolarHBondContact O-N 3.5Å; I330-H332 VanDerWaalsContact C-N 3.31Å; I330-H332 PolarHBondContact O-N 3.21Å; I330-L333 PolarHBondContact O-N 3.31Å; I330-S334 WeakPolarHBondContact O-CB 3.33Å; I330-S334 PolarHBondContact O-N 3.28Å; I330-S334 PolarHBondContact O-OG 3.22Å; I330-L346 HydrophobicContact CD1-CD2 4.42Å; I330-L348 HydrophobicContact CD1-CD1 3.97Å; I330-L348 HydrophobicContact CD1-CD2 3.85Å; I330-L348 HydrophobicContact CG1-CD1 4.41Å; I330-I354 HydrophobicContact CD1-CD1 4.39Å; I330-I354 HydrophobicContact CG1-CD1 3.67Å; I330-A358 HydrophobicContact CB-CB 4.08Å; I330-A358 HydrophobicContact CG1-CB 4.17Å; I330-A358 HydrophobicContact CG2-CB 3.96Å; I330-L362 HydrophobicContact CG2-CD1 4.02Å; I330-L362 HydrophobicContact CG2-CD2 3.7Å; I330-L362 HydrophobicContact CG2-CG 3.6Å
331	L	98.7	Very high	97.3	Very high	53 Å²	53	44.5 Å²	44.5	28%	0.277	23%	0.227	S	C	.	.	H	α-helix	trans	-55.6	-48.7	172.3	176.3	61.3	0	0	0	110.7	D327 D328 S334 N335 H361	D327-L331 PolarHBondContact O-N 3Å; D328-L331 WeakPolarHBondContact O-CB 3.42Å; D328-L331 PolarHBondContact O-N 3.44Å; D328-L331 VanDerWaalsContact O-N 3.16Å; L331-S334 PolarHBondContact O-N 3.3Å; L331-S334 PolarHBondContact O-OG 3.18Å; L331-N335 VanDerWaalsContact CD1-ND2 3.31Å; L331-N335 WeakPolarHBondContact CD1-ND2 3.44Å; L331-N335 PolarHBondContact O-N 3.22Å; L331-N335 VanDerWaalsContact O-N 3.07Å; L331-N335 PolarHBondContact O-ND2 2.89Å; L331-H361 HydrophobicContact CD1-CB 4.43Å
332	H	98.5	Very high	97.2	Very high	71 Å²	71	46.3 Å²	46.3	33%	0.329	23%	0.231	S	C	.	.	H	α-helix	trans	-60.6	-45.6	177.1	-84.8	-82.3	0	0	0	112.7	I305 S308 D328 G329 I330 S334 N335 S336	I305-H332 HydrophobicContact CG1-CB 4.12Å; S308-H332 WeakPolarHBondContact CB-O 3.47Å; D328-H332 PolarHBondContact O-CD2 3.25Å; D328-H332 PolarHBondContact O-N 2.86Å; D328-H332 VanDerWaalsContact O-N 3.12Å; D328-H332 IonicContact OD2-CD2 3.49Å; G329-H332 PolarHBondContact O-N 3.32Å; I330-H332 VanDerWaalsContact C-N 3.31Å; I330-H332 PolarHBondContact O-N 3.21Å; H332-S334 VanDerWaalsContact C-N 3.33Å; H332-S334 PolarHBondContact O-N 3.49Å; H332-N335 PolarHBondContact O-N 3.16Å; H332-S336 PolarHBondContact O-N 3.01Å
333	L	98	Very high	97.2	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-61.3	-42.1	176.4	-167.9	72.2	0	0	0	111.4	L314 L317 G329 I330 N335 S336 G339 L343 L346	L314-L333 HydrophobicContact CD2-CD1 4.35Å; L317-L333 HydrophobicContact CD2-CD1 4.34Å; L317-L333 HydrophobicContact CD2-CD2 4.08Å; G329-L333 PolarHBondContact O-N 3.05Å; I330-L333 PolarHBondContact O-N 3.31Å; L333-N335 PolarHBondContact O-N 2.59Å; L333-S336 VanDerWaalsContact O-CB 3.31Å; L333-S336 WeakPolarHBondContact O-CB 3.27Å; L333-S336 PolarHBondContact O-N 3.42Å; L333-S336 PolarHBondContact O-OG 3.43Å; L333-G339 WeakPolarHBondContact O-CA 3.49Å; L333-L343 HydrophobicContact CD2-CD2 3.73Å; L333-L343 HydrophobicContact CG-CD2 4.11Å; L333-L346 HydrophobicContact CD2-CD1 3.94Å; L333-L346 HydrophobicContact CD2-CD2 4.19Å
334	S	97.8	Very high	97.2	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-68.1	-31.7	-178.2	77.8	0	0	0	0	114	I330 L331 H332 S336 H340 H361	I330-S334 WeakPolarHBondContact O-CB 3.33Å; I330-S334 PolarHBondContact O-N 3.28Å; I330-S334 PolarHBondContact O-OG 3.22Å; L331-S334 PolarHBondContact O-N 3.3Å; L331-S334 PolarHBondContact O-OG 3.18Å; H332-S334 VanDerWaalsContact C-N 3.33Å; H332-S334 PolarHBondContact O-N 3.49Å; S334-S336 VanDerWaalsContact C-N 3.3Å; S334-H340 PolarHBondContact O-CE1 2.88Å; S334-H361 VanDerWaalsContact CB-O 3.24Å; S334-H361 WeakPolarHBondContact CB-O 3.38Å; S334-H361 PolarHBondContact OG-O 2.85Å
335	N	97.6	Very high	97.2	Very high	88 Å²	88	44.2 Å²	44.2	47%	0.471	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	2.5	178.2	-69.9	-26.1	0	0	0	113.1	L331 H332 L333 N364	L331-N335 VanDerWaalsContact CD1-ND2 3.31Å; L331-N335 WeakPolarHBondContact CD1-ND2 3.44Å; L331-N335 PolarHBondContact O-N 3.22Å; L331-N335 VanDerWaalsContact O-N 3.07Å; L331-N335 PolarHBondContact O-ND2 2.89Å; H332-N335 PolarHBondContact O-N 3.16Å; L333-N335 PolarHBondContact O-N 2.59Å; N335-N364 PolarHBondContact OD1-ND2 3.38Å
336	S	96.4	Very high	97.2	Very high	7 Å²	7	44.2 Å²	44.2	5%	0.049	22%	0.216	C	C	.	.	S	Bend	trans	-80.6	162.1	179.9	74.9	0	0	0	0	112.3	S308 H332 L333 S334 C338 G339 H340	S308-S336 WeakPolarHBondContact O-CB 3.39Å; H332-S336 PolarHBondContact O-N 3.01Å; L333-S336 VanDerWaalsContact O-CB 3.31Å; L333-S336 WeakPolarHBondContact O-CB 3.27Å; L333-S336 PolarHBondContact O-N 3.42Å; L333-S336 PolarHBondContact O-OG 3.43Å; S334-S336 VanDerWaalsContact C-N 3.3Å; S336-C338 VanDerWaalsContact C-N 3.29Å; S336-C338 PolarHBondContact O-N 3.22Å; S336-C338 PolarHBondContact OG-SG 3.04Å; S336-G339 PolarHBondContact O-N 3.28Å; S336-G339 PolarHBondContact OG-N 2.75Å; S336-H340 PolarHBondContact O-CD2 3.27Å; S336-H340 VanDerWaalsContact O-CD2 3.23Å; S336-H340 PolarHBondContact O-N 3.16Å; S336-H340 VanDerWaalsContact O-N 3.12Å
337	T	95.2	Very high	97.2	Very high	88 Å²	88	43.9 Å²	43.9	54%	0.54	21%	0.212	S	C	.	.	H	α-helix	trans	-61	-38.8	173.6	54.7	0	0	0	0	112.1	P312	P312-T337 WeakPolarHBondContact CB-OG1 3.46Å
338	C	96.4	Very high	97.2	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-72.6	-37.5	176.5	61.4	0	0	0	0	111.8	C311 L314 S336 H340 E341 R342 L343	C311-C338 WeakPolarHBondContact O-CB 3.48Å; C311-C338 PolarHBondContact O-SG 3.01Å; C311-C338 VanDerWaalsContact O-SG 3.4Å; L314-C338 HydrophobicContact CB-CB 4.02Å; S336-C338 VanDerWaalsContact C-N 3.29Å; S336-C338 PolarHBondContact O-N 3.22Å; S336-C338 PolarHBondContact OG-SG 3.04Å; C338-H340 PolarHBondContact O-N 3.11Å; C338-E341 PolarHBondContact O-N 3.47Å; C338-R342 CarbonylContact O-C 3.6Å; C338-R342 WeakPolarHBondContact O-CA 3.35Å; C338-R342 PolarHBondContact O-N 3.05Å; C338-L343 PolarHBondContact O-N 3.24Å
339	G	96.4	Very high	97.2	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-57.6	-49.2	176.5	0	0	0	0	0	112.7	L333 S336 E341 C365	L333-G339 WeakPolarHBondContact O-CA 3.49Å; S336-G339 PolarHBondContact O-N 3.28Å; S336-G339 PolarHBondContact OG-N 2.75Å; G339-E341 PolarHBondContact O-N 3.45Å; G339-C365 WeakPolarHBondContact O-CA 3.5Å
340	H	94.8	Very high	97.1	Very high	81 Å²	81	41.5 Å²	41.5	38%	0.375	20%	0.199	S	C	.	.	H	α-helix	trans	-65.9	-35.3	-177.3	-72.9	-49.9	0	0	0	114.6	S334 S336 C338 N364	S334-H340 PolarHBondContact O-CE1 2.88Å; S336-H340 PolarHBondContact O-CD2 3.27Å; S336-H340 VanDerWaalsContact O-CD2 3.23Å; S336-H340 PolarHBondContact O-N 3.16Å; S336-H340 VanDerWaalsContact O-N 3.12Å; C338-H340 PolarHBondContact O-N 3.11Å; H340-N364 PolarHBondContact ND1-O 3.03Å
341	E	88.2	Confident	97	Very high	156 Å²	156	41.5 Å²	41.5	73%	0.729	20%	0.199	S	C	*	.	H	α-helix	trans	-121.9	-22.9	-166.6	-65.4	-173.1	173	0	0	115.4	C338 G339	C338-E341 PolarHBondContact O-N 3.47Å; G339-E341 PolarHBondContact O-N 3.45Å
342	R	96.6	Very high	96.9	Very high	97 Å²	97	42.3 Å²	42.3	37%	0.366	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-129.3	-27.1	-162.9	-60.4	-167.1	-173	-142.6	0.4	115.4	P312 L314 Q315 C338 R344	P312-R342 VanDerWaalsContact O-CD 3.28Å; P312-R342 WeakPolarHBondContact O-CD 3.25Å; P312-R342 PolarHBondContact O-NE 3.45Å; L314-R342 CarbonylContact O-C 3.57Å; Q315-R342 WeakPolarHBondContact CA-O 3.33Å; C338-R342 CarbonylContact O-C 3.6Å; C338-R342 WeakPolarHBondContact O-CA 3.35Å; C338-R342 PolarHBondContact O-N 3.05Å; R342-R344 WeakPolarHBondContact O-CG 3.26Å; R342-R344 PolarHBondContact O-N 3.39Å
343	L	98.3	Very high	96.9	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.206	C	C	.	.			trans	-66.7	120.6	-180	-171.7	68.6	0	0	0	109.5	L333 C338 G367 L368	L333-L343 HydrophobicContact CD2-CD2 3.73Å; L333-L343 HydrophobicContact CG-CD2 4.11Å; C338-L343 PolarHBondContact O-N 3.24Å; L343-G367 CarbonylContact O-C 3.55Å; L343-L368 HydrophobicContact CD2-CD1 4.29Å; L343-L368 HydrophobicContact CG-CD1 4.1Å; L343-L368 WeakPolarHBondContact O-CA 3.45Å; L343-L368 PolarHBondContact O-N 2.95Å
344	R	98.3	Very high	96.9	Very high	118 Å²	118	42.5 Å²	42.5	45%	0.445	21%	0.206	S	C	.	.			trans	-117	-33.1	-177.9	-57.3	-173.2	-166.5	-169.1	3.4	112.8	Q315 R342 E369 R370	Q315-R344 PolarHBondContact O-N 3.19Å; R342-R344 WeakPolarHBondContact O-CG 3.26Å; R342-R344 PolarHBondContact O-N 3.39Å; R344-E369 HydrophobicContact CB-CB 4.48Å; R344-E369 HydrophobicContact CB-CG 4.41Å; R344-E369 WeakPolarHBondContact O-CA 3.33Å; R344-E369 PolarHBondContact O-N 3.31Å; R344-R370 PolarHBondContact O-N 3.48Å
345	V	98.8	Very high	96.9	Very high	26 Å²	26	43.8 Å²	43.8	16%	0.158	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	124.4	-176.5	-179.1	0	0	0	0	108.9	Q315 A316 L317 E347 R370	Q315-V345 PolarHBondContact O-N 3.07Å; Q315-V345 VanDerWaalsContact O-N 3.08Å; A316-V345 WeakPolarHBondContact CA-O 3.16Å; A316-V345 HydrophobicContact CB-CB 3.89Å; L317-V345 PolarHBondContact N-O 3.48Å; V345-E347 HydrophobicContact CG1-CG 4.24Å; V345-R370 WeakPolarHBondContact CA-O 3.46Å; V345-R370 HydrophobicContact CG1-CB 4.45Å; V345-R370 HydrophobicContact CG2-CB 4.25Å
346	L	98.8	Very high	97	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	125.4	171.1	-175.1	62.9	0	0	0	108.8	L317 L319 I330 L333 L348 L362 L368 R370 L371 E372	L317-L346 HydrophobicContact CB-CD1 4.05Å; L317-L346 HydrophobicContact CD2-CD1 4.19Å; L317-L346 HydrophobicContact CG-CD1 4.27Å; L317-L346 WeakPolarHBondContact O-CA 3.29Å; L319-L346 HydrophobicContact CD1-CD1 4.49Å; I330-L346 HydrophobicContact CD1-CD2 4.42Å; L333-L346 HydrophobicContact CD2-CD1 3.94Å; L333-L346 HydrophobicContact CD2-CD2 4.19Å; L346-L348 HydrophobicContact CD1-CD2 4Å; L346-L348 HydrophobicContact CD1-CG 4.49Å; L346-L348 HydrophobicContact CD2-CD1 4.01Å; L346-L348 HydrophobicContact CD2-CD2 4.33Å; L346-L348 HydrophobicContact CD2-CG 4.24Å; L346-L348 HydrophobicContact CG-CD1 4.28Å; L346-L348 HydrophobicContact CG-CD2 4.01Å; L346-L348 HydrophobicContact CG-CG 3.96Å; L346-L362 HydrophobicContact CD2-CD1 3.93Å; L346-L362 HydrophobicContact CD2-CD2 3.77Å; L346-L368 HydrophobicContact CB-CD1 4.15Å; L346-R370 PolarHBondContact N-O 3.45Å; L346-L371 HydrophobicContact CB-CD1 3.87Å; L346-L371 HydrophobicContact CD2-CD1 4Å; L346-L371 HydrophobicContact CG-CD1 4.04Å; L346-L371 CarbonylContact O-C 3.49Å; L346-L371 VanDerWaalsContact O-CA 3.28Å; L346-L371 WeakPolarHBondContact O-CA 3.34Å; L346-E372 PolarHBondContact O-N 2.97Å
347	E	98.8	Very high	97.1	Very high	36 Å²	36	43.3 Å²	43.3	17%	0.168	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	119	178	-62.2	165.7	-163	0	0	107.7	L317 S318 L319 V345 R370 E372	L317-E347 PolarHBondContact O-N 2.84Å; S318-E347 WeakPolarHBondContact CB-OE2 3.43Å; S318-E347 WeakPolarHBondContact OG-CB 3.3Å; S318-E347 PolarHBondContact OG-OE2 2.98Å; L319-E347 PolarHBondContact N-O 3.37Å; V345-E347 HydrophobicContact CG1-CG 4.24Å; E347-R370 IonicContact OE1-CZ 3.81Å; E347-R370 IonicContact OE1-NE 3.81Å; E347-R370 IonicContact OE1-NH2 3.66Å; E347-R370 PolarHBondContact OE1-NH2 3.34Å; E347-E372 HydrophobicContact CB-CB 4.3Å; E347-E372 HydrophobicContact CG-CB 4.07Å; E347-E372 HydrophobicContact CG-CG 3.94Å
348	L	98.5	Very high	97.2	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.188	C	C	.	.			trans	-123.7	24.3	-177.1	-56	175.2	0	0	0	110.5	L319 I330 L346 N350 C351 I354 L371 E372 L373 C376	L319-L348 HydrophobicContact CB-CD2 4.12Å; L319-L348 HydrophobicContact CD1-CD2 3.71Å; L319-L348 HydrophobicContact CG-CD2 4.4Å; I330-L348 HydrophobicContact CD1-CD1 3.97Å; I330-L348 HydrophobicContact CD1-CD2 3.85Å; I330-L348 HydrophobicContact CG1-CD1 4.41Å; L346-L348 HydrophobicContact CD1-CD2 4Å; L346-L348 HydrophobicContact CD1-CG 4.49Å; L346-L348 HydrophobicContact CD2-CD1 4.01Å; L346-L348 HydrophobicContact CD2-CD2 4.33Å; L346-L348 HydrophobicContact CD2-CG 4.24Å; L346-L348 HydrophobicContact CG-CD1 4.28Å; L346-L348 HydrophobicContact CG-CD2 4.01Å; L346-L348 HydrophobicContact CG-CG 3.96Å; L348-N350 PolarHBondContact O-N 3.3Å; L348-C351 HydrophobicContact CB-CB 4.32Å; L348-C351 VanDerWaalsContact O-CB 3.26Å; L348-C351 WeakPolarHBondContact O-CB 3.44Å; L348-C351 PolarHBondContact O-N 3.08Å; L348-C351 PolarHBondContact O-SG 3.37Å; L348-I354 HydrophobicContact CD1-CD1 4.44Å; L348-I354 HydrophobicContact CD1-CG1 4.37Å; L348-I354 HydrophobicContact CD1-CG2 4.34Å; L348-L371 HydrophobicContact CD1-CD1 4.33Å; L348-E372 PolarHBondContact N-O 3.03Å; L348-L373 HydrophobicContact CB-CD2 4.12Å; L348-L373 HydrophobicContact CD1-CD2 4.04Å; L348-C376 PolarHBondContact O-SG 3.4Å
349	D	97.4	Very high	97.3	Very high	16 Å²	16	39.2 Å²	39.2	9%	0.086	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	137.2	-174.8	-52.4	-54.6	0	0	0	110	S320 H321 C351 E372 L373 Y374	S320-D349 CarbonylContact C-O 3.42Å; S320-D349 WeakPolarHBondContact CA-O 3.3Å; S320-D349 PolarHBondContact OG-N 3.03Å; S320-D349 PolarHBondContact OG-OD2 2.93Å; H321-D349 PolarHBondContact N-O 2.79Å; D349-C351 PolarHBondContact O-N 3.01Å; D349-C351 VanDerWaalsContact O-N 3.08Å; D349-E372 WeakPolarHBondContact OD1-CB 3.08Å; D349-L373 PolarHBondContact OD1-N 3.25Å; D349-L373 VanDerWaalsContact OD1-N 3.15Å; D349-Y374 CarbonylContact C-O 3.6Å; D349-Y374 VanDerWaalsContact CA-O 3.26Å; D349-Y374 WeakPolarHBondContact CA-O 3.43Å; D349-Y374 WeakPolarHBondContact OD1-CB 3.44Å; D349-Y374 WeakPolarHBondContact OD1-CD2 3.45Å; D349-Y374 PolarHBondContact OD1-N 3.22Å
350	N	97.2	Very high	97.4	Very high	35 Å²	35	43.4 Å²	43.4	19%	0.187	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.9	16.6	-177.5	-56.2	83.4	0	0	0	114.8	H321 L348 L352 Y374 D375	H321-N350 PolarHBondContact CE1-OD1 3.17Å; H321-N350 WeakPolarHBondContact ND1-CB 3.5Å; L348-N350 PolarHBondContact O-N 3.3Å; N350-L352 PolarHBondContact O-N 3.07Å; N350-L352 VanDerWaalsContact O-N 3.14Å; N350-Y374 PolarHBondContact N-O 3.11Å; N350-D375 VanDerWaalsContact ND2-CB 3.32Å; N350-D375 WeakPolarHBondContact ND2-CB 3.34Å; N350-D375 PolarHBondContact ND2-OD2 3.1Å
351	C	97.4	Very high	97.6	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	20%	0.199	C	C	.	.			trans	-78.3	91.1	163.9	-65.9	0	0	0	0	109.6	L319 C322 L348 D349 L353 I354	L319-C351 PolarHBondContact O-SG 3.46Å; C322-C351 PolarHBondContact O-SG 3.28Å; L348-C351 HydrophobicContact CB-CB 4.32Å; L348-C351 VanDerWaalsContact O-CB 3.26Å; L348-C351 WeakPolarHBondContact O-CB 3.44Å; L348-C351 PolarHBondContact O-N 3.08Å; L348-C351 PolarHBondContact O-SG 3.37Å; D349-C351 PolarHBondContact O-N 3.01Å; D349-C351 VanDerWaalsContact O-N 3.08Å; C351-L353 PolarHBondContact O-N 3.36Å; C351-L353 VanDerWaalsContact O-N 3.16Å; C351-I354 HydrophobicContact CB-CB 4.4Å; C351-I354 HydrophobicContact CB-CG1 3.55Å; C351-I354 PolarHBondContact O-N 3.13Å
352	L	96.1	Very high	98.1	Very high	69 Å²	69	34.1 Å²	34.1	36%	0.361	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-17.9	-168.3	-58.7	178.3	0	0	0	115	N350 Q378	N350-L352 PolarHBondContact O-N 3.07Å; N350-L352 VanDerWaalsContact O-N 3.14Å; L352-Q378 PolarHBondContact O-NE2 2.56Å
353	L	97.9	Very high	98	Very high	76 Å²	76	32.1 Å²	32.1	40%	0.398	16%	0.159	S	C	.	.	B	Isolated β-bridge	trans	-96.2	-1.4	-178.3	-56.6	177.8	0	0	0	113.3	E323 T326 C351	E323-L353 WeakPolarHBondContact O-CD1 3.28Å; T326-L353 HydrophobicContact CG2-CB 4.17Å; T326-L353 HydrophobicContact CG2-CD1 3.83Å; C351-L353 PolarHBondContact O-N 3.36Å; C351-L353 VanDerWaalsContact O-N 3.16Å
354	I	98.4	Very high	98	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.175	C	C	.	.			trans	-77	128.4	176.2	-66.1	-60.5	0	0	0	110.4	I325 I330 L348 C351 A358 L373 Q378 V379	I325-I354 HydrophobicContact CG2-CD1 4.21Å; I330-I354 HydrophobicContact CD1-CD1 4.39Å; I330-I354 HydrophobicContact CG1-CD1 3.67Å; L348-I354 HydrophobicContact CD1-CD1 4.44Å; L348-I354 HydrophobicContact CD1-CG1 4.37Å; L348-I354 HydrophobicContact CD1-CG2 4.34Å; C351-I354 HydrophobicContact CB-CB 4.4Å; C351-I354 HydrophobicContact CB-CG1 3.55Å; C351-I354 PolarHBondContact O-N 3.13Å; I354-A358 HydrophobicContact CD1-CB 4.31Å; I354-A358 HydrophobicContact CG2-CB 3.93Å; I354-L373 HydrophobicContact CG2-CD2 4.44Å; I354-Q378 WeakPolarHBondContact O-CB 3.46Å; I354-V379 HydrophobicContact CG2-CG2 3.99Å
355	T	98.5	Very high	97.9	Very high	27 Å²	27	29.6 Å²	29.6	17%	0.166	15%	0.154	C	C	.	.			trans	-119.9	-177.3	-178.1	84.2	0	0	0	0	112.4	D327 V357 A358 Q378	D327-T355 PolarHBondContact OD1-N 3.37Å; D327-T355 WeakPolarHBondContact OD2-CB 3.27Å; D327-T355 WeakPolarHBondContact OD2-CG2 3.3Å; D327-T355 PolarHBondContact OD2-OG1 3.35Å; T355-V357 PolarHBondContact O-N 3.18Å; T355-V357 WeakPolarHBondContact OG1-CB 3.26Å; T355-V357 PolarHBondContact OG1-N 3.27Å; T355-V357 VanDerWaalsContact OG1-N 3.08Å; T355-A358 PolarHBondContact O-N 3.17Å; T355-Q378 HydrophobicContact CG2-CB 3.98Å
356	D	98.4	Very high	97.7	Very high	22 Å²	22	37.7 Å²	37.7	12%	0.118	18%	0.182	C	C	.	.	H	α-helix	trans	-56	-24.8	170.2	-86.7	17.1	0	0	0	112.9	L359 E360 T380 G383 R386	D356-L359 WeakPolarHBondContact O-CB 3.13Å; D356-L359 PolarHBondContact O-N 3.22Å; D356-L359 VanDerWaalsContact O-N 3.16Å; D356-E360 PolarHBondContact O-N 3.49Å; D356-E360 VanDerWaalsContact O-N 3.16Å; D356-T380 VanDerWaalsContact CG-OG1 3.32Å; D356-T380 PolarHBondContact OD1-N 3.21Å; D356-T380 PolarHBondContact OD1-OG1 3.14Å; D356-T380 PolarHBondContact OD2-OG1 2.86Å; D356-G383 VanDerWaalsContact CG-CA 3.49Å; D356-G383 WeakPolarHBondContact OD2-CA 3.39Å; D356-G383 PolarHBondContact OD2-N 2.56Å; D356-G383 VanDerWaalsContact OD2-N 3.16Å; D356-R386 IonicContact OD2-CZ 3.03Å; D356-R386 IonicContact OD2-NH1 3.84Å; D356-R386 IonicContact OD2-NH2 2.69Å; D356-R386 PolarHBondContact OD2-NH2 3.28Å
357	V	98.5	Very high	97.5	Very high	63 Å²	63	38.9 Å²	38.9	38%	0.382	19%	0.194	S	C	.	.	H	α-helix	trans	-66.7	-41.2	-179.6	176.3	0	0	0	0	111.5	D327 T355 L359 E360 H361	D327-V357 HydrophobicContact CB-CB 4.39Å; D327-V357 HydrophobicContact CB-CG1 4.3Å; T355-V357 PolarHBondContact O-N 3.18Å; T355-V357 WeakPolarHBondContact OG1-CB 3.26Å; T355-V357 PolarHBondContact OG1-N 3.27Å; T355-V357 VanDerWaalsContact OG1-N 3.08Å; V357-L359 PolarHBondContact O-N 2.86Å; V357-E360 WeakPolarHBondContact O-CB 3.44Å; V357-E360 PolarHBondContact O-N 3.09Å; V357-E360 VanDerWaalsContact O-N 3.14Å; V357-H361 WeakPolarHBondContact CG1-NE2 3.5Å; V357-H361 PolarHBondContact O-CD2 3.12Å; V357-H361 PolarHBondContact O-N 3.4Å
358	A	98.6	Very high	97.5	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-57.8	-36.9	171.5	0	0	0	0	0	112.3	D327 I330 I354 T355 E360 H361 L362	D327-A358 HydrophobicContact CB-CB 4.24Å; D327-A358 WeakPolarHBondContact OD1-CB 3.47Å; D327-A358 PolarHBondContact OD1-N 3.42Å; I330-A358 HydrophobicContact CB-CB 4.08Å; I330-A358 HydrophobicContact CG1-CB 4.17Å; I330-A358 HydrophobicContact CG2-CB 3.96Å; I354-A358 HydrophobicContact CD1-CB 4.31Å; I354-A358 HydrophobicContact CG2-CB 3.93Å; T355-A358 PolarHBondContact O-N 3.17Å; A358-E360 VanDerWaalsContact C-N 3.34Å; A358-H361 WeakPolarHBondContact O-CB 3.26Å; A358-H361 PolarHBondContact O-N 2.99Å; A358-L362 VanDerWaalsContact O-CG 3.28Å; A358-L362 WeakPolarHBondContact O-CG 2.96Å; A358-L362 PolarHBondContact O-N 3.07Å
359	L	98.4	Very high	97.5	Very high	2 Å²	2	42 Å²	42	1%	0.01	21%	0.209	C	C	.	.	H	α-helix	trans	-66.7	-37.9	177.8	-55	-172.4	0	0	0	112	D356 V357 H361 L362 E363 L371 L373 V379 I384 M387	D356-L359 WeakPolarHBondContact O-CB 3.13Å; D356-L359 PolarHBondContact O-N 3.22Å; D356-L359 VanDerWaalsContact O-N 3.16Å; V357-L359 PolarHBondContact O-N 2.86Å; L359-H361 VanDerWaalsContact C-N 3.33Å; L359-L362 PolarHBondContact O-N 3.32Å; L359-E363 PolarHBondContact O-N 3.03Å; L359-L371 HydrophobicContact CD2-CD2 3.83Å; L359-L373 HydrophobicContact CD1-CD1 4.45Å; L359-L373 HydrophobicContact CD2-CD1 3.66Å; L359-L373 HydrophobicContact CD2-CD2 4.37Å; L359-V379 HydrophobicContact CD1-CG1 3.67Å; L359-I384 HydrophobicContact CD1-CG1 3.87Å; L359-M387 HydrophobicContact CB-CB 4.41Å; L359-M387 HydrophobicContact CB-SD 4.18Å; L359-M387 HydrophobicContact CD2-SD 3.99Å
360	E	98.3	Very high	97.5	Very high	87 Å²	87	45.8 Å²	45.8	41%	0.407	22%	0.222	S	C	.	.	H	α-helix	trans	-65	-38.1	174.3	-68.6	174.2	-170.9	0	0	111	D356 V357 A358 E363 R386	D356-E360 PolarHBondContact O-N 3.49Å; D356-E360 VanDerWaalsContact O-N 3.16Å; V357-E360 WeakPolarHBondContact O-CB 3.44Å; V357-E360 PolarHBondContact O-N 3.09Å; V357-E360 VanDerWaalsContact O-N 3.14Å; A358-E360 VanDerWaalsContact C-N 3.34Å; E360-E363 VanDerWaalsContact O-CB 3.32Å; E360-E363 WeakPolarHBondContact O-CB 3.4Å; E360-E363 WeakPolarHBondContact O-CG 3.37Å; E360-E363 PolarHBondContact O-N 3.03Å; E360-R386 IonicContact OE1-CZ 3.83Å; E360-R386 IonicContact OE1-NE 2.78Å; E360-R386 IonicContact OE1-NH2 2.62Å; E360-R386 PolarHBondContact OE1-NH2 3.14Å
361	H	98.4	Very high	97.6	Very high	43 Å²	43	44.1 Å²	44.1	20%	0.199	21%	0.213	C	C	.	.	H	α-helix	trans	-63.7	-44.3	172.6	-61.8	-24.7	0	0	0	112.4	L331 S334 V357 A358 L359 E363 N364	L331-H361 HydrophobicContact CD1-CB 4.43Å; S334-H361 VanDerWaalsContact CB-O 3.24Å; S334-H361 WeakPolarHBondContact CB-O 3.38Å; S334-H361 PolarHBondContact OG-O 2.85Å; V357-H361 WeakPolarHBondContact CG1-NE2 3.5Å; V357-H361 PolarHBondContact O-CD2 3.12Å; V357-H361 PolarHBondContact O-N 3.4Å; A358-H361 WeakPolarHBondContact O-CB 3.26Å; A358-H361 PolarHBondContact O-N 2.99Å; L359-H361 VanDerWaalsContact C-N 3.33Å; H361-E363 PolarHBondContact O-N 3.03Å; H361-E363 VanDerWaalsContact O-N 3.09Å; H361-N364 WeakPolarHBondContact O-CB 3.41Å; H361-N364 PolarHBondContact O-N 2.85Å; H361-N364 VanDerWaalsContact O-N 3.12Å
362	L	98.1	Very high	97.6	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-66.7	-8.1	-179.8	-69.7	172	0	0	0	114.1	I330 L346 A358 L359 N364 C365 L371 M387 L391	I330-L362 HydrophobicContact CG2-CD1 4.02Å; I330-L362 HydrophobicContact CG2-CD2 3.7Å; I330-L362 HydrophobicContact CG2-CG 3.6Å; L346-L362 HydrophobicContact CD2-CD1 3.93Å; L346-L362 HydrophobicContact CD2-CD2 3.77Å; A358-L362 VanDerWaalsContact O-CG 3.28Å; A358-L362 WeakPolarHBondContact O-CG 2.96Å; A358-L362 PolarHBondContact O-N 3.07Å; L359-L362 PolarHBondContact O-N 3.32Å; L362-N364 PolarHBondContact O-N 3.49Å; L362-C365 WeakPolarHBondContact O-CB 3.49Å; L362-C365 PolarHBondContact O-N 2.97Å; L362-L371 HydrophobicContact CD1-CD1 3.99Å; L362-L371 HydrophobicContact CD1-CD2 3.95Å; L362-M387 HydrophobicContact CB-CE 3.67Å; L362-M387 HydrophobicContact CD1-CE 4.44Å; L362-L391 WeakPolarHBondContact O-CD1 3.47Å
363	E	96.3	Very high	97.7	Very high	55 Å²	55	42.5 Å²	42.5	26%	0.257	20%	0.204	S	C	.	.	G	3₁₀ helix	trans	-59	-24	168.6	-64.9	-179.5	-177	0	0	112.5	L359 E360 H361 C365 Q390	L359-E363 PolarHBondContact O-N 3.03Å; E360-E363 VanDerWaalsContact O-CB 3.32Å; E360-E363 WeakPolarHBondContact O-CB 3.4Å; E360-E363 WeakPolarHBondContact O-CG 3.37Å; E360-E363 PolarHBondContact O-N 3.03Å; H361-E363 PolarHBondContact O-N 3.03Å; H361-E363 VanDerWaalsContact O-N 3.09Å; E363-C365 VanDerWaalsContact C-N 3.27Å; E363-C365 PolarHBondContact O-N 2.64Å; E363-Q390 HydrophobicContact CB-CG 3.99Å; E363-Q390 HydrophobicContact CG-CB 4.2Å; E363-Q390 HydrophobicContact CG-CG 3.93Å
364	N	96.3	Very high	97.6	Very high	64 Å²	64	43.4 Å²	43.4	34%	0.342	20%	0.202	S	C	.	.	G	3₁₀ helix	trans	-71.3	-20	174	-71	-24.8	0	0	0	113.5	N335 H340 H361 L362 R366	N335-N364 PolarHBondContact OD1-ND2 3.38Å; H340-N364 PolarHBondContact ND1-O 3.03Å; H361-N364 WeakPolarHBondContact O-CB 3.41Å; H361-N364 PolarHBondContact O-N 2.85Å; H361-N364 VanDerWaalsContact O-N 3.12Å; L362-N364 PolarHBondContact O-N 3.49Å; N364-R366 PolarHBondContact O-N 3.25Å; N364-R366 VanDerWaalsContact O-N 3.11Å
365	C	97.1	Very high	97.4	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	22%	0.222	C	C	.	.			trans	-85.9	74.6	-177.7	-60.1	0	0	0	0	111	G339 L362 E363 G367 L368	G339-C365 WeakPolarHBondContact O-CA 3.5Å; L362-C365 WeakPolarHBondContact O-CB 3.49Å; L362-C365 PolarHBondContact O-N 2.97Å; E363-C365 VanDerWaalsContact C-N 3.27Å; E363-C365 PolarHBondContact O-N 2.64Å; C365-G367 PolarHBondContact O-N 3.26Å; C365-G367 VanDerWaalsContact O-N 3.1Å; C365-L368 HydrophobicContact CB-CB 4.06Å; C365-L368 VanDerWaalsContact O-CB 3.28Å; C365-L368 WeakPolarHBondContact O-CB 3.45Å; C365-L368 PolarHBondContact O-N 3.49Å; C365-L368 VanDerWaalsContact O-N 3.08Å
366	R	94.6	Very high	97.2	Very high	197 Å²	197	46.2 Å²	46.2	74%	0.743	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-15.2	-173.4	-62.4	-179.2	-177.6	173.8	2	114.9	N364 H393	N364-R366 PolarHBondContact O-N 3.25Å; N364-R366 VanDerWaalsContact O-N 3.11Å; R366-H393 PolarHBondContact O-CE1 3.33Å; R366-H393 VanDerWaalsContact O-CE1 3.25Å; R366-H393 PolarHBondContact O-NE2 3.42Å; R366-H393 VanDerWaalsContact O-NE2 3.16Å
367	G	95.6	Very high	97	Very high	24 Å²	24	53.1 Å²	53.1	25%	0.247	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.6	1.1	176.4	0	0	0	0	0	114.5	L343 C365 E369	L343-G367 CarbonylContact O-C 3.55Å; C365-G367 PolarHBondContact O-N 3.26Å; C365-G367 VanDerWaalsContact O-N 3.1Å; G367-E369 PolarHBondContact O-N 2.85Å
368	L	97.9	Very high	96.9	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	25%	0.252	C	S	.	.			trans	-71	115.5	-172.3	-163.2	69.5	0	0	0	111.3	L343 L346 C365 L371 M387 H393 V394	L343-L368 HydrophobicContact CD2-CD1 4.29Å; L343-L368 HydrophobicContact CG-CD1 4.1Å; L343-L368 WeakPolarHBondContact O-CA 3.45Å; L343-L368 PolarHBondContact O-N 2.95Å; L346-L368 HydrophobicContact CB-CD1 4.15Å; C365-L368 HydrophobicContact CB-CB 4.06Å; C365-L368 VanDerWaalsContact O-CB 3.28Å; C365-L368 WeakPolarHBondContact O-CB 3.45Å; C365-L368 PolarHBondContact O-N 3.49Å; C365-L368 VanDerWaalsContact O-N 3.08Å; L368-L371 HydrophobicContact CD2-CB 4.22Å; L368-M387 HydrophobicContact CD2-CE 3.83Å; L368-H393 PolarHBondContact O-CD2 3.21Å; L368-H393 PolarHBondContact O-NE2 2.8Å; L368-H393 VanDerWaalsContact O-NE2 3.15Å; L368-V394 HydrophobicContact CB-CG2 4.31Å; L368-V394 HydrophobicContact CD2-CG2 4.12Å; L368-V394 HydrophobicContact CG-CG2 4.01Å; L368-V394 WeakPolarHBondContact O-CB 3.46Å; L368-V394 WeakPolarHBondContact O-CG2 3.5Å
369	E	97.8	Very high	96.8	Very high	103 Å²	103	55.2 Å²	55.2	48%	0.481	25%	0.254	S	S	.	.			trans	-98.6	-35.2	-177.7	-67.1	178.8	-167.8	0	0	112.2	R344 G367 K395	R344-E369 HydrophobicContact CB-CB 4.48Å; R344-E369 HydrophobicContact CB-CG 4.41Å; R344-E369 WeakPolarHBondContact O-CA 3.33Å; R344-E369 PolarHBondContact O-N 3.31Å; G367-E369 PolarHBondContact O-N 2.85Å; E369-K395 PolarHBondContact O-N 3.19Å
370	R	98.4	Very high	96.7	Very high	94 Å²	94	58 Å²	58	36%	0.355	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	128.7	-177.6	-174.4	172.5	78.9	-178.5	2.6	110.6	R344 V345 L346 E347 E372	R344-R370 PolarHBondContact O-N 3.48Å; V345-R370 WeakPolarHBondContact CA-O 3.46Å; V345-R370 HydrophobicContact CG1-CB 4.45Å; V345-R370 HydrophobicContact CG2-CB 4.25Å; L346-R370 PolarHBondContact N-O 3.45Å; E347-R370 IonicContact OE1-CZ 3.81Å; E347-R370 IonicContact OE1-NE 3.81Å; E347-R370 IonicContact OE1-NH2 3.66Å; E347-R370 PolarHBondContact OE1-NH2 3.34Å; R370-E372 WeakPolarHBondContact CD-OE1 3.46Å; R370-E372 HydrophobicContact CG-CG 4.09Å; R370-E372 IonicContact NE-OE1 3.92Å
371	L	98.5	Very high	96.5	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	122.9	172.4	-179.7	64.6	0	0	0	109.1	L346 L348 L359 L362 L368 L373 M387 V394 K395 V396 H397	L346-L371 HydrophobicContact CB-CD1 3.87Å; L346-L371 HydrophobicContact CD2-CD1 4Å; L346-L371 HydrophobicContact CG-CD1 4.04Å; L346-L371 CarbonylContact O-C 3.49Å; L346-L371 VanDerWaalsContact O-CA 3.28Å; L346-L371 WeakPolarHBondContact O-CA 3.34Å; L348-L371 HydrophobicContact CD1-CD1 4.33Å; L359-L371 HydrophobicContact CD2-CD2 3.83Å; L362-L371 HydrophobicContact CD1-CD1 3.99Å; L362-L371 HydrophobicContact CD1-CD2 3.95Å; L368-L371 HydrophobicContact CD2-CB 4.22Å; L371-L373 HydrophobicContact CD1-CD2 4.26Å; L371-L373 HydrophobicContact CD2-CD1 3.9Å; L371-L373 HydrophobicContact CD2-CD2 4.35Å; L371-L373 HydrophobicContact CD2-CG 4.22Å; L371-L373 HydrophobicContact CG-CD1 4.18Å; L371-L373 HydrophobicContact CG-CD2 4.18Å; L371-L373 HydrophobicContact CG-CG 3.98Å; L371-M387 HydrophobicContact CD2-CE 3.71Å; L371-M387 HydrophobicContact CD2-SD 3.6Å; L371-M387 VanDerWaalsContact CD2-SD 3.6Å; L371-V394 HydrophobicContact CB-CG2 4.3Å; L371-K395 PolarHBondContact N-O 3.46Å; L371-V396 HydrophobicContact CD2-CG1 4.35Å; L371-V396 CarbonylContact O-C 3.58Å; L371-V396 VanDerWaalsContact O-CA 3.29Å; L371-V396 WeakPolarHBondContact O-CA 3.36Å; L371-H397 PolarHBondContact O-N 3.15Å
372	E	98.3	Very high	96.4	Very high	32 Å²	32	59.9 Å²	59.9	15%	0.15	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	129.2	177.7	-48.7	-155.1	155.9	0	0	110.1	L346 E347 L348 D349 R370 Y374 H397	L346-E372 PolarHBondContact O-N 2.97Å; E347-E372 HydrophobicContact CB-CB 4.3Å; E347-E372 HydrophobicContact CG-CB 4.07Å; E347-E372 HydrophobicContact CG-CG 3.94Å; L348-E372 PolarHBondContact N-O 3.03Å; D349-E372 WeakPolarHBondContact OD1-CB 3.08Å; R370-E372 WeakPolarHBondContact CD-OE1 3.46Å; R370-E372 HydrophobicContact CG-CG 4.09Å; R370-E372 IonicContact NE-OE1 3.92Å; E372-Y374 HydrophobicContact CB-CD2 4.41Å; E372-H397 HydrophobicContact CG-CB 4.32Å; E372-H397 IonicContact OE1-CE1 3.82Å; E372-H397 IonicContact OE1-ND1 2.7Å; E372-H397 PolarHBondContact OE1-ND1 2.72Å
373	L	97.7	Very high	96.3	Very high	4 Å²	4	60 Å²	60	2%	0.021	29%	0.285	C	S	.	.			trans	-139.2	29.9	-171.9	-58.2	169.5	0	0	0	110.7	L348 D349 I354 L359 L371 D375 C376 V379 I384 V396 H397 A398	L348-L373 HydrophobicContact CB-CD2 4.12Å; L348-L373 HydrophobicContact CD1-CD2 4.04Å; D349-L373 PolarHBondContact OD1-N 3.25Å; D349-L373 VanDerWaalsContact OD1-N 3.15Å; I354-L373 HydrophobicContact CG2-CD2 4.44Å; L359-L373 HydrophobicContact CD1-CD1 4.45Å; L359-L373 HydrophobicContact CD2-CD1 3.66Å; L359-L373 HydrophobicContact CD2-CD2 4.37Å; L371-L373 HydrophobicContact CD1-CD2 4.26Å; L371-L373 HydrophobicContact CD2-CD1 3.9Å; L371-L373 HydrophobicContact CD2-CD2 4.35Å; L371-L373 HydrophobicContact CD2-CG 4.22Å; L371-L373 HydrophobicContact CG-CD1 4.18Å; L371-L373 HydrophobicContact CG-CD2 4.18Å; L371-L373 HydrophobicContact CG-CG 3.98Å; L373-D375 PolarHBondContact O-N 3.09Å; L373-C376 HydrophobicContact CB-CB 4.26Å; L373-C376 PolarHBondContact O-N 2.64Å; L373-V379 HydrophobicContact CD1-CG1 4.19Å; L373-I384 HydrophobicContact CD1-CD1 4.22Å; L373-I384 HydrophobicContact CD1-CG1 4.42Å; L373-V396 HydrophobicContact CD1-CG1 3.6Å; L373-V396 HydrophobicContact CG-CG1 4.39Å; L373-H397 PolarHBondContact N-O 3.14Å; L373-A398 HydrophobicContact CB-CB 4.2Å
374	Y	96	Very high	96.3	Very high	95 Å²	95	58 Å²	58	37%	0.373	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	135.2	174.7	-63.8	-71.3	0	0	0	109.3	D349 N350 E372 C376 H397	D349-Y374 CarbonylContact C-O 3.6Å; D349-Y374 VanDerWaalsContact CA-O 3.26Å; D349-Y374 WeakPolarHBondContact CA-O 3.43Å; D349-Y374 WeakPolarHBondContact OD1-CB 3.44Å; D349-Y374 WeakPolarHBondContact OD1-CD2 3.45Å; D349-Y374 PolarHBondContact OD1-N 3.22Å; N350-Y374 PolarHBondContact N-O 3.11Å; E372-Y374 HydrophobicContact CB-CD2 4.41Å; Y374-C376 PolarHBondContact O-N 3.35Å; Y374-H397 HydrophobicContact CE1-CB 4.48Å; Y374-H397 HydrophobicContact CE2-CB 3.84Å
375	D	94.1	Very high	96.3	Very high	77 Å²	77	62.5 Å²	62.5	41%	0.412	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.8	17.2	-178.2	-63.7	-32.6	0	0	0	116.9	N350 L373 Q377	N350-D375 VanDerWaalsContact ND2-CB 3.32Å; N350-D375 WeakPolarHBondContact ND2-CB 3.34Å; N350-D375 PolarHBondContact ND2-OD2 3.1Å; L373-D375 PolarHBondContact O-N 3.09Å; D375-Q377 VanDerWaalsContact C-N 3.31Å; D375-Q377 PolarHBondContact O-N 2.95Å
376	C	95.3	Very high	96.3	Very high	8 Å²	8	67.4 Å²	67.4	5%	0.054	31%	0.311	C	S	.	.			trans	-77.1	78.7	163.9	-66	0	0	0	0	110.6	L348 L373 Y374 Q378 V379	L348-C376 PolarHBondContact O-SG 3.4Å; L373-C376 HydrophobicContact CB-CB 4.26Å; L373-C376 PolarHBondContact O-N 2.64Å; Y374-C376 PolarHBondContact O-N 3.35Å; C376-Q378 PolarHBondContact O-N 3.39Å; C376-Q378 VanDerWaalsContact O-N 3.1Å; C376-V379 HydrophobicContact CB-CB 4.24Å; C376-V379 HydrophobicContact CB-CG2 3.78Å; C376-V379 WeakPolarHBondContact O-CB 3.39Å; C376-V379 PolarHBondContact O-N 3.22Å
377	Q	93.1	Very high	96.3	Very high	167 Å²	167	58 Å²	58	78%	0.78	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-20.9	-168.8	-62.5	-178.1	12.5	0	0	115	D375	D375-Q377 VanDerWaalsContact C-N 3.31Å; D375-Q377 PolarHBondContact O-N 2.95Å
378	Q	95.8	Very high	96.3	Very high	98 Å²	98	61.7 Å²	61.7	46%	0.458	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-9.7	177.5	-53.5	-169.5	38.1	0	0	113.2	L352 I354 T355 C376	L352-Q378 PolarHBondContact O-NE2 2.56Å; I354-Q378 WeakPolarHBondContact O-CB 3.46Å; T355-Q378 HydrophobicContact CG2-CB 3.98Å; C376-Q378 PolarHBondContact O-N 3.39Å; C376-Q378 VanDerWaalsContact O-N 3.1Å
379	V	96.9	Very high	96.2	Very high	9 Å²	9	65.6 Å²	65.6	6%	0.055	31%	0.314	C	S	.	.			trans	-79.1	129.2	173.1	174.1	0	0	0	0	110	I354 L359 L373 C376 I384	I354-V379 HydrophobicContact CG2-CG2 3.99Å; L359-V379 HydrophobicContact CD1-CG1 3.67Å; L373-V379 HydrophobicContact CD1-CG1 4.19Å; C376-V379 HydrophobicContact CB-CB 4.24Å; C376-V379 HydrophobicContact CB-CG2 3.78Å; C376-V379 WeakPolarHBondContact O-CB 3.39Å; C376-V379 PolarHBondContact O-N 3.22Å; V379-I384 HydrophobicContact CG1-CD1 3.91Å; V379-I384 HydrophobicContact CG1-CG1 3.73Å
380	T	96.5	Very high	96.1	Very high	61 Å²	61	66.3 Å²	66.3	37%	0.374	32%	0.318	S	S	.	.			trans	-98.4	157.3	-177.3	82.4	0	0	0	0	112.3	D356 A382 G383 I384	D356-T380 VanDerWaalsContact CG-OG1 3.32Å; D356-T380 PolarHBondContact OD1-N 3.21Å; D356-T380 PolarHBondContact OD1-OG1 3.14Å; D356-T380 PolarHBondContact OD2-OG1 2.86Å; T380-A382 PolarHBondContact O-N 3.01Å; T380-A382 PolarHBondContact OG1-N 3.03Å; T380-A382 VanDerWaalsContact OG1-N 3.16Å; T380-G383 PolarHBondContact O-N 3.42Å; T380-G383 PolarHBondContact OG1-N 3.46Å; T380-I384 PolarHBondContact O-N 3.09Å
381	R	94.9	Very high	95.9	Very high	120 Å²	120	62.3 Å²	62.3	45%	0.453	30%	0.303	S	S	.	.	H	α-helix	trans	-58.4	-26.8	168.5	-68.4	-177.3	177.4	172.2	1.7	112.3	K385 F400 A401	R381-K385 WeakPolarHBondContact O-CB 3.37Å; R381-K385 VanDerWaalsContact O-CG 3.27Å; R381-K385 WeakPolarHBondContact O-CG 3.29Å; R381-K385 PolarHBondContact O-N 3.34Å; R381-F400 HydrophobicContact CB-CE1 4.44Å; R381-F400 HydrophobicContact CB-CZ 4.37Å; R381-F400 HydrophobicContact CG-CB 4.45Å; R381-F400 HydrophobicContact CG-CD1 3.56Å; R381-F400 HydrophobicContact CG-CD2 3.8Å; R381-F400 HydrophobicContact CG-CE1 3.6Å; R381-F400 HydrophobicContact CG-CE2 3.82Å; R381-F400 HydrophobicContact CG-CG 3.65Å; R381-F400 HydrophobicContact CG-CZ 3.73Å; R381-A401 PolarHBondContact NH2-O 3.33Å
382	A	95.5	Very high	95.7	Very high	49 Å²	49	67.5 Å²	67.5	41%	0.405	34%	0.337	S	S	.	.	H	α-helix	trans	-74.3	-45.1	179.2	0	0	0	0	0	110.9	T380 K385 R386	T380-A382 PolarHBondContact O-N 3.01Å; T380-A382 PolarHBondContact OG1-N 3.03Å; T380-A382 VanDerWaalsContact OG1-N 3.16Å; A382-K385 WeakPolarHBondContact O-CB 3.35Å; A382-K385 PolarHBondContact O-N 3.3Å; A382-R386 WeakPolarHBondContact O-CG 3.37Å; A382-R386 PolarHBondContact O-N 2.84Å
383	G	96.5	Very high	95.6	Very high	2 Å²	2	70.3 Å²	70.3	2%	0.021	35%	0.35	C	S	.	.	H	α-helix	trans	-56.7	-49.7	174.7	0	0	0	0	0	112.4	D356 T380 K385 R386 M387	D356-G383 VanDerWaalsContact CG-CA 3.49Å; D356-G383 WeakPolarHBondContact OD2-CA 3.39Å; D356-G383 PolarHBondContact OD2-N 2.56Å; D356-G383 VanDerWaalsContact OD2-N 3.16Å; T380-G383 PolarHBondContact O-N 3.42Å; T380-G383 PolarHBondContact OG1-N 3.46Å; G383-K385 VanDerWaalsContact C-N 3.28Å; G383-K385 PolarHBondContact O-N 3.2Å; G383-R386 PolarHBondContact O-N 3.35Å; G383-R386 VanDerWaalsContact O-N 3.1Å; G383-M387 PolarHBondContact O-N 3.27Å
384	I	96.1	Very high	95.5	Very high	13 Å²	13	70.2 Å²	70.2	7%	0.067	35%	0.349	C	S	.	.	H	α-helix	trans	-61	-37.6	177.4	-63.3	-174.2	0	0	0	112	L359 L373 V379 T380 R388 V396 A398 F400	L359-I384 HydrophobicContact CD1-CG1 3.87Å; L373-I384 HydrophobicContact CD1-CD1 4.22Å; L373-I384 HydrophobicContact CD1-CG1 4.42Å; V379-I384 HydrophobicContact CG1-CD1 3.91Å; V379-I384 HydrophobicContact CG1-CG1 3.73Å; T380-I384 PolarHBondContact O-N 3.09Å; I384-R388 HydrophobicContact CG2-CG 4.46Å; I384-R388 WeakPolarHBondContact O-CB 3.35Å; I384-R388 WeakPolarHBondContact O-CG 3.2Å; I384-R388 PolarHBondContact O-N 3.19Å; I384-V396 HydrophobicContact CD1-CG1 3.94Å; I384-V396 HydrophobicContact CG1-CG1 4.21Å; I384-V396 HydrophobicContact CG2-CB 4.04Å; I384-V396 HydrophobicContact CG2-CG1 3.97Å; I384-V396 HydrophobicContact CG2-CG2 4.38Å; I384-A398 HydrophobicContact CD1-CB 3.67Å; I384-F400 HydrophobicContact CD1-CE2 3.61Å; I384-F400 HydrophobicContact CD1-CZ 3.5Å; I384-F400 HydrophobicContact CG1-CZ 4.35Å
385	K	95.8	Very high	95.5	Very high	159 Å²	159	72.1 Å²	72.1	69%	0.691	36%	0.359	S	S	*	.	H	α-helix	trans	-65.6	-41.8	175.1	-80.3	179.4	178.9	-173.9	0	112.2	R381 A382 G383 A389	R381-K385 WeakPolarHBondContact O-CB 3.37Å; R381-K385 VanDerWaalsContact O-CG 3.27Å; R381-K385 WeakPolarHBondContact O-CG 3.29Å; R381-K385 PolarHBondContact O-N 3.34Å; A382-K385 WeakPolarHBondContact O-CB 3.35Å; A382-K385 PolarHBondContact O-N 3.3Å; G383-K385 VanDerWaalsContact C-N 3.28Å; G383-K385 PolarHBondContact O-N 3.2Å; K385-A389 PolarHBondContact O-N 3.4Å; K385-A389 VanDerWaalsContact O-N 3.08Å
386	R	96.4	Very high	95.6	Very high	103 Å²	103	68.8 Å²	68.8	39%	0.389	34%	0.342	S	S	.	.	H	α-helix	trans	-62.2	-49.8	175.9	-69.8	-166.5	-60.2	-78.3	2.8	110.7	D356 E360 A382 G383 R388 A389 Q390	D356-R386 IonicContact OD2-CZ 3.03Å; D356-R386 IonicContact OD2-NH1 3.84Å; D356-R386 IonicContact OD2-NH2 2.69Å; D356-R386 PolarHBondContact OD2-NH2 3.28Å; E360-R386 IonicContact OE1-CZ 3.83Å; E360-R386 IonicContact OE1-NE 2.78Å; E360-R386 IonicContact OE1-NH2 2.62Å; E360-R386 PolarHBondContact OE1-NH2 3.14Å; A382-R386 WeakPolarHBondContact O-CG 3.37Å; A382-R386 PolarHBondContact O-N 2.84Å; G383-R386 PolarHBondContact O-N 3.35Å; G383-R386 VanDerWaalsContact O-N 3.1Å; R386-R388 PolarHBondContact O-N 3.29Å; R386-A389 WeakPolarHBondContact O-CB 3.29Å; R386-A389 PolarHBondContact O-N 2.95Å; R386-Q390 PolarHBondContact O-N 2.88Å; R386-Q390 VanDerWaalsContact O-N 3.13Å
387	M	95.6	Very high	95.5	Very high	1 Å²	1	71.3 Å²	71.3	1%	0.005	35%	0.353	C	S	.	.	H	α-helix	trans	-57.9	-45.4	178.3	-172.3	-175.5	-172.6	0	0	112.2	L359 L362 L368 L371 G383 A389 Q390 L391 V396	L359-M387 HydrophobicContact CB-CB 4.41Å; L359-M387 HydrophobicContact CB-SD 4.18Å; L359-M387 HydrophobicContact CD2-SD 3.99Å; L362-M387 HydrophobicContact CB-CE 3.67Å; L362-M387 HydrophobicContact CD1-CE 4.44Å; L368-M387 HydrophobicContact CD2-CE 3.83Å; L371-M387 HydrophobicContact CD2-CE 3.71Å; L371-M387 HydrophobicContact CD2-SD 3.6Å; L371-M387 VanDerWaalsContact CD2-SD 3.6Å; G383-M387 PolarHBondContact O-N 3.27Å; M387-A389 VanDerWaalsContact C-N 3.27Å; M387-A389 PolarHBondContact O-N 3.34Å; M387-Q390 PolarHBondContact O-N 3.35Å; M387-Q390 VanDerWaalsContact O-N 3.15Å; M387-L391 HydrophobicContact CE-CD1 4.11Å; M387-L391 PolarHBondContact O-N 3.23Å; M387-V396 HydrophobicContact SD-CG2 4.26Å
388	R	95.3	Very high	95.4	Very high	100 Å²	100	64.9 Å²	64.9	38%	0.377	33%	0.328	S	S	.	.	H	α-helix	trans	-66.5	-26.8	176.9	-75	177.6	177.6	-86.5	9.7	113.5	I384 R386 Q390 L391 P392 V394 V396	I384-R388 HydrophobicContact CG2-CG 4.46Å; I384-R388 WeakPolarHBondContact O-CB 3.35Å; I384-R388 WeakPolarHBondContact O-CG 3.2Å; I384-R388 PolarHBondContact O-N 3.19Å; R386-R388 PolarHBondContact O-N 3.29Å; R388-Q390 VanDerWaalsContact C-N 3.34Å; R388-L391 CarbonylContact O-C 3.58Å; R388-P392 VanDerWaalsContact O-CA 3.28Å; R388-P392 WeakPolarHBondContact O-CA 3.03Å; R388-V394 PolarHBondContact NH1-O 3.37Å; R388-V394 VanDerWaalsContact NH1-O 3.17Å; R388-V396 HydrophobicContact CG-CG2 4.17Å; R388-V396 VanDerWaalsContact NH2-N 3.16Å; R388-V396 PolarHBondContact NH2-O 2.87Å
389	A	95.6	Very high	95	Very high	82 Å²	82	67.3 Å²	67.3	68%	0.678	33%	0.334	S	S	*	.	H	α-helix	trans	-69.5	-37	173.4	0	0	0	0	0	111	K385 R386 M387	K385-A389 PolarHBondContact O-N 3.4Å; K385-A389 VanDerWaalsContact O-N 3.08Å; R386-A389 WeakPolarHBondContact O-CB 3.29Å; R386-A389 PolarHBondContact O-N 2.95Å; M387-A389 VanDerWaalsContact C-N 3.27Å; M387-A389 PolarHBondContact O-N 3.34Å
390	Q	95.6	Very high	93.9	Very high	119 Å²	119	70.3 Å²	70.3	56%	0.556	35%	0.347	S	S	*	.	H	α-helix	trans	-79.1	-40.3	178.5	-169.9	62.6	13	0	0	112.8	E363 R386 M387 R388 P392	E363-Q390 HydrophobicContact CB-CG 3.99Å; E363-Q390 HydrophobicContact CG-CB 4.2Å; E363-Q390 HydrophobicContact CG-CG 3.93Å; R386-Q390 PolarHBondContact O-N 2.88Å; R386-Q390 VanDerWaalsContact O-N 3.13Å; M387-Q390 PolarHBondContact O-N 3.35Å; M387-Q390 VanDerWaalsContact O-N 3.15Å; R388-Q390 VanDerWaalsContact C-N 3.34Å; Q390-P392 WeakPolarHBondContact O-CD 3.28Å
391	L	95.1	Very high	92.2	Very high	9 Å²	9	70.3 Å²	70.3	5%	0.047	35%	0.353	C	S	.	.			trans	-121.3	79.1	-179.7	-62.6	177.8	0	0	0	110	L362 M387 R388 H393 V394	L362-L391 WeakPolarHBondContact O-CD1 3.47Å; M387-L391 HydrophobicContact CE-CD1 4.11Å; M387-L391 PolarHBondContact O-N 3.23Å; R388-L391 CarbonylContact O-C 3.58Å; L391-H393 PolarHBondContact O-N 3.23Å; L391-H393 VanDerWaalsContact O-N 3.14Å; L391-V394 HydrophobicContact CB-CB 4.3Å; L391-V394 HydrophobicContact CB-CG1 3.92Å; L391-V394 WeakPolarHBondContact O-CG1 3.43Å; L391-V394 PolarHBondContact O-N 3.08Å
392	P	94.4	Very high	90.5	Very high	109 Å²	109	69.2 Å²	69.2	71%	0.708	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-17.4	-173	25.7	-35	0	0	0	114.4	R388 Q390	R388-P392 VanDerWaalsContact O-CA 3.28Å; R388-P392 WeakPolarHBondContact O-CA 3.03Å; Q390-P392 WeakPolarHBondContact O-CD 3.28Å
393	H	94.4	Very high	88.7	Confident	92 Å²	92	72.4 Å²	72.4	43%	0.426	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83	-18.8	179.2	62.1	-86.6	0	0	0	113.2	R366 L368 L391	R366-H393 PolarHBondContact O-CE1 3.33Å; R366-H393 VanDerWaalsContact O-CE1 3.25Å; R366-H393 PolarHBondContact O-NE2 3.42Å; R366-H393 VanDerWaalsContact O-NE2 3.16Å; L368-H393 PolarHBondContact O-CD2 3.21Å; L368-H393 PolarHBondContact O-NE2 2.8Å; L368-H393 VanDerWaalsContact O-NE2 3.15Å; L391-H393 PolarHBondContact O-N 3.23Å; L391-H393 VanDerWaalsContact O-N 3.14Å
394	V	96.3	Very high	86.7	Confident	1 Å²	1	78.3 Å²	78.3	1%	0.006	41%	0.411	C	S	.	.			trans	-73.4	131.2	-175.7	75.6	0	0	0	0	111.3	L368 L371 R388 L391 V396	L368-V394 HydrophobicContact CB-CG2 4.31Å; L368-V394 HydrophobicContact CD2-CG2 4.12Å; L368-V394 HydrophobicContact CG-CG2 4.01Å; L368-V394 WeakPolarHBondContact O-CB 3.46Å; L368-V394 WeakPolarHBondContact O-CG2 3.5Å; L371-V394 HydrophobicContact CB-CG2 4.3Å; R388-V394 PolarHBondContact NH1-O 3.37Å; R388-V394 VanDerWaalsContact NH1-O 3.17Å; L391-V394 HydrophobicContact CB-CB 4.3Å; L391-V394 HydrophobicContact CB-CG1 3.92Å; L391-V394 WeakPolarHBondContact O-CG1 3.43Å; L391-V394 PolarHBondContact O-N 3.08Å; V394-V396 HydrophobicContact CG1-CG2 3.81Å; V394-V396 HydrophobicContact CG2-CG2 4.43Å; V394-V396 PolarHBondContact O-N 2.92Å
395	K	97.1	Very high	84.5	Confident	135 Å²	135	82.7 Å²	82.7	59%	0.587	44%	0.441	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.7	99	171.1	-64.5	179.5	-175.6	173.8	0	108.8	E369 L371	E369-K395 PolarHBondContact O-N 3.19Å; L371-K395 PolarHBondContact N-O 3.46Å
396	V	95.8	Very high	82.4	Confident	8 Å²	8	80.8 Å²	80.8	5%	0.048	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	115.6	172.7	-167.7	0	0	0	0	110.3	L371 L373 I384 M387 R388 V394	L371-V396 HydrophobicContact CD2-CG1 4.35Å; L371-V396 CarbonylContact O-C 3.58Å; L371-V396 VanDerWaalsContact O-CA 3.29Å; L371-V396 WeakPolarHBondContact O-CA 3.36Å; L373-V396 HydrophobicContact CD1-CG1 3.6Å; L373-V396 HydrophobicContact CG-CG1 4.39Å; I384-V396 HydrophobicContact CD1-CG1 3.94Å; I384-V396 HydrophobicContact CG1-CG1 4.21Å; I384-V396 HydrophobicContact CG2-CB 4.04Å; I384-V396 HydrophobicContact CG2-CG1 3.97Å; I384-V396 HydrophobicContact CG2-CG2 4.38Å; M387-V396 HydrophobicContact SD-CG2 4.26Å; R388-V396 HydrophobicContact CG-CG2 4.17Å; R388-V396 VanDerWaalsContact NH2-N 3.16Å; R388-V396 PolarHBondContact NH2-O 2.87Å; V394-V396 HydrophobicContact CG1-CG2 3.81Å; V394-V396 HydrophobicContact CG2-CG2 4.43Å; V394-V396 PolarHBondContact O-N 2.92Å
397	H	93.5	Very high	80.3	Confident	61 Å²	61	82.5 Å²	82.5	28%	0.282	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	120.2	175.4	-57.1	139.4	0	0	0	109.6	L371 E372 L373 Y374	L371-H397 PolarHBondContact O-N 3.15Å; E372-H397 HydrophobicContact CG-CB 4.32Å; E372-H397 IonicContact OE1-CE1 3.82Å; E372-H397 IonicContact OE1-ND1 2.7Å; E372-H397 PolarHBondContact OE1-ND1 2.72Å; L373-H397 PolarHBondContact N-O 3.14Å; Y374-H397 HydrophobicContact CE1-CB 4.48Å; Y374-H397 HydrophobicContact CE2-CB 3.84Å
398	A	91.1	Very high	78.2	Confident	32 Å²	32	86.8 Å²	86.8	26%	0.264	50%	0.502	S	S	.	.			trans	-150.4	146.8	178	0	0	0	0	0	109.4	L373 I384 F400	L373-A398 HydrophobicContact CB-CB 4.2Å; I384-A398 HydrophobicContact CD1-CB 3.67Å; A398-F400 HydrophobicContact CB-CE2 4Å; A398-F400 HydrophobicContact CB-CZ 4.44Å
399	Y	86.2	Confident	76.3	Confident	149 Å²	149	89 Å²	89	58%	0.584	53%	0.527	S	S	*	.			trans	-95	118.1	170.8	-176	-102.5	0	0	0	109.8	A401	Y399-A401 HydrophobicContact CE1-CB 3.96Å
400	F	73.4	Confident	74	Confident	71 Å²	71	89.4 Å²	89.4	31%	0.311	53%	0.53	S	S	.	.			trans	-108.3	113.4	163.1	-64	-79.6	0	0	0	107.8	R381 I384 A398	R381-F400 HydrophobicContact CB-CE1 4.44Å; R381-F400 HydrophobicContact CB-CZ 4.37Å; R381-F400 HydrophobicContact CG-CB 4.45Å; R381-F400 HydrophobicContact CG-CD1 3.56Å; R381-F400 HydrophobicContact CG-CD2 3.8Å; R381-F400 HydrophobicContact CG-CE1 3.6Å; R381-F400 HydrophobicContact CG-CE2 3.82Å; R381-F400 HydrophobicContact CG-CG 3.65Å; R381-F400 HydrophobicContact CG-CZ 3.73Å; I384-F400 HydrophobicContact CD1-CE2 3.61Å; I384-F400 HydrophobicContact CD1-CZ 3.5Å; I384-F400 HydrophobicContact CG1-CZ 4.35Å; A398-F400 HydrophobicContact CB-CE2 4Å; A398-F400 HydrophobicContact CB-CZ 4.44Å
401	A	61.6	Low	71.6	Confident	61 Å²	61	86.8 Å²	86.8	50%	0.504	54%	0.535	S	S	.	.	P	Polyproline II helix	trans	-46.8	136.4	170.9	0	0	0	0	0	109.6	R381 Y399 V403	R381-A401 PolarHBondContact NH2-O 3.33Å; Y399-A401 HydrophobicContact CE1-CB 3.96Å; A401-V403 PolarHBondContact O-N 3.2Å
402	P	59.8	Low	69.3	Low	97 Å²	97	92.8 Å²	92.8	63%	0.63	58%	0.577	S	S	*	*	P	Polyproline II helix	trans	-53.9	141.1	170.2	-11	19.4	0	0	0	108.3	T404	P402-T404 PolarHBondContact O-N 2.79Å
403	V	57.6	Low	66.8	Low	117 Å²	117	90.3 Å²	90.3	71%	0.709	57%	0.572	S	S	*	*	P	Polyproline II helix	trans	-57.3	119.4	175.6	-166.1	0	0	0	0	106.7	A401 P405	A401-V403 PolarHBondContact O-N 3.2Å; V403-P405 WeakPolarHBondContact O-CD 3.49Å; V403-P405 VanDerWaalsContact O-N 3.11Å
404	T	53.7	Low	64.6	Low	125 Å²	125	95.6 Å²	95.6	77%	0.767	60%	0.597	S	S	*	*	P	Polyproline II helix	trans	-55.3	120.8	174.9	-27.8	0	0	0	0	106.6	P402	P402-T404 PolarHBondContact O-N 2.79Å
405	P	50.4	Low	62	Low	106 Å²	106	107.1 Å²	107.1	69%	0.688	64%	0.64	S	S	*	*	P	Polyproline II helix	trans	-56.2	138.1	179.2	6.1	-9.3	0	0	0	108.2	V403 T407	V403-P405 WeakPolarHBondContact O-CD 3.49Å; V403-P405 VanDerWaalsContact O-N 3.11Å; P405-T407 PolarHBondContact O-N 3.38Å
406	P	52.5	Low	59.4	Low	119 Å²	119	109 Å²	109	77%	0.773	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-53.8	138.4	178.3	21.2	-30.8	0	0	0	108.7	A408	P406-A408 PolarHBondContact O-N 3.3Å
407	T	52	Low	56.5	Low	138 Å²	138	113.8 Å²	113.8	85%	0.847	69%	0.688	S	S	*	*			trans	-52.1	107.5	173.4	9.5	0	0	0	0	107.8	P405 V409	P405-T407 PolarHBondContact O-N 3.38Å; T407-V409 PolarHBondContact O-N 2.59Å
408	A	51.7	Low	54.1	Low	91 Å²	91	122.6 Å²	122.6	75%	0.752	72%	0.719	S	S	*	*			trans	-59.1	112.8	173.3	0	0	0	0	0	106.7	P406 A410	P406-A408 PolarHBondContact O-N 3.3Å; A408-A410 PolarHBondContact O-N 2.57Å
409	V	54.1	Low	51.6	Low	148 Å²	148	126.3 Å²	126.3	90%	0.897	74%	0.742	S	S	*	*			trans	-68.6	81.8	168.1	-173.3	0	0	0	0	106.2	T407 G411	T407-V409 PolarHBondContact O-N 2.59Å; V409-G411 PolarHBondContact O-N 3.37Å
410	A	47	Very low	49.2	Very low	89 Å²	89	125.2 Å²	125.2	74%	0.736	75%	0.754	S	S	*	*			trans	-78.9	109.3	174.8	0	0	0	0	0	107.8	A408	A408-A410 PolarHBondContact O-N 2.57Å
411	G	46.7	Very low	47.5	Very low	64 Å²	64	128.2 Å²	128.2	66%	0.66	78%	0.778	S	S	*	*			trans	-51.8	150.8	164.8	0	0	0	0	0	111.4	V409 G413	V409-G411 PolarHBondContact O-N 3.37Å; G411-G413 PolarHBondContact O-N 3.27Å
412	S	47.2	Very low	46.3	Very low	135 Å²	135	133.5 Å²	133.5	94%	0.944	80%	0.796	S	S	*	*	S	Bend	trans	-43.4	102.7	178.7	53	0	0	0	0	112.8
413	G	41.3	Very low	45.1	Very low	57 Å²	57	140.6 Å²	140.6	59%	0.588	83%	0.828	S	S	*	*			trans	-152.5	107.9	170.9	0	0	0	0	0	108.9	G411 R415	G411-G413 PolarHBondContact O-N 3.27Å; G413-R415 PolarHBondContact O-N 2.61Å
414	Q	48.9	Very low	44.4	Very low	204 Å²	204	141.8 Å²	141.8	95%	0.953	83%	0.833	S	S	*	*			trans	-49.5	120.2	175.7	-76.4	173.1	-27.9	0	0	110.4
415	R	39.8	Very low	43.9	Very low	243 Å²	243	142.7 Å²	142.7	92%	0.917	84%	0.837	S	S	*	*			trans	-118.5	107.6	167.1	-73.3	-172.4	176.7	-166.3	-0.3	109	G413 C417	G413-R415 PolarHBondContact O-N 2.61Å; R415-C417 PolarHBondContact O-N 2.78Å
416	L	43.2	Very low	43.6	Very low	175 Å²	175	144.7 Å²	144.7	92%	0.916	85%	0.845	S	S	*	*			trans	-60	123	167.8	-80.5	134.4	0	0	0	109.7
417	C	35.8	Very low	43.1	Very low	107 Å²	107	146.2 Å²	146.2	72%	0.723	85%	0.849	S	S	*	*			trans	-79.9	125.2	172.2	-173.8	0	0	0	0	109.7	R415	R415-C417 PolarHBondContact O-N 2.78Å
418	R	43.3	Very low	42.5	Very low	247 Å²	247	146.8 Å²	146.8	93%	0.932	85%	0.85	S	S	*	*			trans	-102.4	28.6	-177.1	-109.4	-172.4	-175.9	-169.5	1.7	113.4
419	C	36.9	Very low	41.9	Very low	110 Å²	110	150.5 Å²	150.5	74%	0.743	86%	0.856	S	S	*	*			trans	-114.1	29.6	-173.4	-56.1	0	0	0	0	114.7
420	C	37.3	Very low	41	Very low	126 Å²	126	150.6 Å²	150.6	85%	0.851	85%	0.853	S	S	*	*			trans	-109.1	48.5	172	-69.6	0	0	0	0	112.9
421	V	37.6	Very low	40.6	Very low	134 Å²	134	155.4 Å²	155.4	81%	0.812	86%	0.862	S	S	*	*			trans	-144.8	94.1	163.3	-173.9	0	0	0	0	108.5
422	I	35.3	Very low	40	Very low	171 Å²	171	163 Å²	163	88%	0.877	88%	0.879	S	S	*	*			trans	-177	88	136.6	-80.4	148.3	0	0	0	103.9
423	L	33.8	Very low	39.4	Very low	247 Å²	247	165.5 Å²	165.5	100%	1.293	87%	0.873	S	S	*	*			trans	-121.2	0	150.7	-98.6	169.3	0	0	0	105.5

Retrieved 423 of 423 residues in 600.6 ms (Link to these results)

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