A0A077ZDT0_TRITR Loading...

Ras-related protein Rab-35

AlphaFold DB , UniProt , Accession A0A077ZDT0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 188 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.9	Very low	62.2	Low	236 Å²	236	117.3 Å²	117.3	100%	1.163	62%	0.623	S	S	*	*				0	108.7	0	-70.8	172.5	-172.3	0	0	107.3	L3	M1-L3 PolarHBondContact O-N 3.1Å; M1-L3 VanDerWaalsContact O-N 3.1Å
2	S	42	Very low	64.3	Low	116 Å²	116	112.5 Å²	112.5	81%	0.811	60%	0.598	S	S	*	*			trans	-70.3	106.7	171.5	59.3	0	0	0	0	107.1	C4	S2-C4 PolarHBondContact O-N 2.86Å
3	L	47	Very low	66.1	Low	167 Å²	167	104.8 Å²	104.8	87%	0.874	56%	0.556	S	S	*	*			trans	-63.9	86.2	158.5	-68.4	167.9	0	0	0	105.2	M1 N5	M1-L3 PolarHBondContact O-N 3.1Å; M1-L3 VanDerWaalsContact O-N 3.1Å; L3-N5 PolarHBondContact O-N 2.81Å
4	C	45.9	Very low	67.7	Low	105 Å²	105	99.1 Å²	99.1	71%	0.709	52%	0.524	S	S	*	.			trans	-62.2	100.2	164.8	-163.1	0	0	0	0	103.5	S2	S2-C4 PolarHBondContact O-N 2.86Å
5	N	47	Very low	69.2	Low	132 Å²	132	92.7 Å²	92.7	71%	0.706	49%	0.49	S	S	*	.	P	Polyproline II helix	trans	-49.1	118.7	-179.5	-149.4	11.7	0	0	0	105.8	L3 R7	L3-N5 PolarHBondContact O-N 2.81Å; N5-R7 PolarHBondContact O-N 2.9Å
6	P	54.1	Low	70.5	Confident	102 Å²	102	86.9 Å²	86.9	66%	0.662	46%	0.459	S	S	*	.	P	Polyproline II helix	trans	-53.4	117.3	-176.9	17.9	-27.9	0	0	0	106.2	D8	P6-D8 PolarHBondContact O-N 2.94Å; P6-D8 VanDerWaalsContact O-N 3.1Å
7	R	66	Low	71.8	Confident	172 Å²	172	81.8 Å²	81.8	65%	0.649	43%	0.432	S	S	*	.	P	Polyproline II helix	trans	-55.5	127.1	-175.9	-68.7	-177.8	175	175.2	-1	106.6	N5 Y9 R60	N5-R7 PolarHBondContact O-N 2.9Å; R7-Y9 WeakPolarHBondContact CB-O 3.2Å; R7-Y9 PolarHBondContact O-N 3.1Å; R7-R60 PolarHBondContact O-NH1 3Å; R7-R60 PolarHBondContact O-NH2 2.89Å
8	D	83.6	Confident	72.9	Confident	109 Å²	109	77.3 Å²	77.3	58%	0.583	41%	0.408	S	S	*	.	S	Bend	trans	-65.1	-0.8	178.5	-62.3	-39.8	0	0	0	112.9	P6 R60	P6-D8 PolarHBondContact O-N 2.94Å; P6-D8 VanDerWaalsContact O-N 3.1Å; D8-R60 PolarHBondContact O-NH1 2.52Å
9	Y	85.8	Confident	74	Confident	60 Å²	60	73.2 Å²	73.2	24%	0.235	39%	0.387	C	S	.	.			trans	-151.4	154.3	-178.4	64.1	-85.5	0	0	0	109.9	R7 H11 L12 K62	R7-Y9 WeakPolarHBondContact CB-O 3.2Å; R7-Y9 PolarHBondContact O-N 3.1Å; Y9-H11 VanDerWaalsContact CD2-O 3.31Å; Y9-H11 WeakPolarHBondContact CD2-O 3.25Å; Y9-L12 HydrophobicContact CD2-CB 4.11Å; Y9-L12 HydrophobicContact CE2-CB 3.57Å; Y9-L12 HydrophobicContact CE2-CG 4.47Å; Y9-K62 HydrophobicContact CD1-CB 4.25Å; Y9-K62 HydrophobicContact CD1-CD 3.75Å; Y9-K62 VanDerWaalsContact CD1-NZ 3.26Å; Y9-K62 HydrophobicContact CD2-CB 4.24Å; Y9-K62 HydrophobicContact CE1-CD 4.08Å; Y9-K62 HydrophobicContact CG-CB 3.78Å; Y9-K62 HydrophobicContact CG-CD 4.19Å
10	D	87.8	Confident	74.9	Confident	59 Å²	59	70.8 Å²	70.8	32%	0.316	37%	0.374	S	S	.	.	S	Bend	trans	-95.8	-36	178.8	-50.7	-51.6	0	0	0	109.6	E59 R60	D10-E59 HydrophobicContact CB-CB 4.43Å; D10-E59 VanDerWaalsContact CB-OE2 3.24Å; D10-E59 WeakPolarHBondContact CB-OE2 3.28Å; D10-R60 PolarHBondContact N-O 3.11Å; D10-R60 IonicContact OD1-CZ 3.96Å; D10-R60 IonicContact OD1-NE 3.89Å; D10-R60 IonicContact OD1-NH2 3.11Å; D10-R60 PolarHBondContact OD1-NH2 3.38Å; D10-R60 VanDerWaalsContact OD1-NH2 3.11Å; D10-R60 WeakPolarHBondContact OD2-CA 3.47Å; D10-R60 VanDerWaalsContact OD2-CB 3.25Å; D10-R60 WeakPolarHBondContact OD2-CB 3.31Å; D10-R60 IonicContact OD2-CZ 3.99Å; D10-R60 PolarHBondContact OD2-N 2.84Å; D10-R60 IonicContact OD2-NE 3.21Å; D10-R60 PolarHBondContact OD2-NE 3.19Å; D10-R60 IonicContact OD2-NH2 3.82Å
11	H	87.7	Confident	75.6	Confident	32 Å²	32	69.2 Å²	69.2	15%	0.148	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	145.8	177.1	-50.9	-90	0	0	0	112.6	Y9 F13 E59 R60 K62 L174 E177	Y9-H11 VanDerWaalsContact CD2-O 3.31Å; Y9-H11 WeakPolarHBondContact CD2-O 3.25Å; H11-F13 HydrophobicContact CB-CD2 4.33Å; H11-F13 HydrophobicContact CB-CE2 3.75Å; H11-E59 IonicContact NE2-OE2 2.69Å; H11-R60 PolarHBondContact N-O 2.8Å; H11-R60 VanDerWaalsContact N-O 3.13Å; H11-K62 PolarHBondContact O-N 2.98Å; H11-L174 HydrophobicContact CB-CD2 4.38Å; H11-L174 WeakPolarHBondContact CD2-CD2 3.38Å; H11-L174 VanDerWaalsContact CE1-CD2 3.48Å; H11-L174 WeakPolarHBondContact CE1-CD2 3.47Å; H11-L174 VanDerWaalsContact CG-CD2 3.48Å; H11-L174 WeakPolarHBondContact NE2-CD2 3.32Å; H11-E177 IonicContact CE1-OE2 3.75Å; H11-E177 PolarHBondContact CE1-OE2 3.5Å; H11-E177 IonicContact ND1-OE2 3.1Å
12	L	87.1	Confident	78.1	Confident	60 Å²	60	59.1 Å²	59.1	31%	0.314	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	121.9	176.8	-179	65.4	0	0	0	109.5	Y9 K62 Q64	Y9-L12 HydrophobicContact CD2-CB 4.11Å; Y9-L12 HydrophobicContact CE2-CB 3.57Å; Y9-L12 HydrophobicContact CE2-CG 4.47Å; L12-K62 WeakPolarHBondContact CA-O 3.42Å; L12-K62 HydrophobicContact CD1-CB 3.96Å; L12-K62 HydrophobicContact CD1-CD 4.05Å; L12-K62 HydrophobicContact CD1-CG 3.89Å; L12-Q64 HydrophobicContact CD1-CG 3.79Å
13	F	88.6	Confident	80.6	Confident	12 Å²	12	53.7 Å²	53.7	5%	0.053	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	134.1	173.9	-68.3	-93.3	0	0	0	110.3	H11 V61 K62 L63 Q64 H86 Y169 C170 N173	H11-F13 HydrophobicContact CB-CD2 4.33Å; H11-F13 HydrophobicContact CB-CE2 3.75Å; F13-V61 HydrophobicContact CD2-CG1 3.43Å; F13-V61 VanDerWaalsContact CD2-CG1 3.43Å; F13-V61 HydrophobicContact CE2-CG1 3.71Å; F13-K62 PolarHBondContact N-O 3.33Å; F13-L63 HydrophobicContact CB-CD2 3.9Å; F13-Q64 PolarHBondContact O-N 3.18Å; F13-H86 HydrophobicContact CD1-CB 4.23Å; F13-Y169 HydrophobicContact CD1-CD1 4.27Å; F13-Y169 HydrophobicContact CD1-CE1 4.4Å; F13-Y169 AromaticContact CE1-CD1 3.97Å; F13-Y169 HydrophobicContact CE1-CD1 3.97Å; F13-Y169 AromaticContact CE1-CE1 4Å; F13-Y169 HydrophobicContact CE1-CE1 4Å; F13-C170 VanDerWaalsContact CD1-SG 3.58Å; F13-C170 HydrophobicContact CD2-CB 4.25Å; F13-C170 HydrophobicContact CE1-CB 4.35Å; F13-C170 HydrophobicContact CE2-CB 4.03Å; F13-C170 HydrophobicContact CG-CB 4.49Å; F13-C170 WeakPolarHBondContact CG-SG 3.41Å; F13-C170 HydrophobicContact CZ-CB 4.09Å; F13-N173 HydrophobicContact CZ-CB 4.4Å
14	K	88	Confident	82.9	Confident	26 Å²	26	46.2 Å²	46.2	11%	0.113	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	119.2	175.5	179.3	178	169.1	-171.3	0	109.4	Q64 Y81 R83 T85 H86 G87	K14-Q64 CarbonylContact C-O 3.59Å; K14-Q64 WeakPolarHBondContact CA-O 3.37Å; K14-Y81 VanDerWaalsContact CE-O 3.29Å; K14-Y81 WeakPolarHBondContact CE-O 3.24Å; K14-Y81 PolarHBondContact NZ-O 2.79Å; K14-R83 PolarHBondContact NZ-O 2.81Å; K14-T85 WeakPolarHBondContact CE-OG1 3.44Å; K14-H86 PolarHBondContact N-ND1 3.46Å; K14-H86 PolarHBondContact O-N 3.21Å; K14-G87 PolarHBondContact O-N 2.73Å
15	L	90	Very high	85.1	Confident	2 Å²	2	41.7 Å²	41.7	1%	0.01	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	139.1	175.9	-56.3	179.2	0	0	0	110.2	Q64 I65 W66 G87 C165 P167	L15-Q64 PolarHBondContact N-O 3.42Å; L15-I65 HydrophobicContact CB-CG1 4.32Å; L15-I65 HydrophobicContact CD1-CD1 4.43Å; L15-I65 HydrophobicContact CD1-CG1 4.25Å; L15-W66 PolarHBondContact O-N 3.04Å; L15-G87 VanDerWaalsContact CA-O 3.31Å; L15-G87 WeakPolarHBondContact CA-O 3.45Å; L15-C165 WeakPolarHBondContact CD1-O 3.37Å; L15-P167 VanDerWaalsContact CD1-CD 3.48Å; L15-P167 HydrophobicContact CD1-CG 3.62Å; L15-P167 HydrophobicContact CD2-CG 3.54Å; L15-P167 HydrophobicContact CG-CG 4.2Å
16	L	90.9	Very high	87.3	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	129.4	172.9	-171.5	70	0	0	0	109.2	I18 W66 T68 Y82 T85 G87 V88 I89	L16-I18 HydrophobicContact CD2-CG2 3.64Å; L16-I18 HydrophobicContact CG-CG2 3.7Å; L16-W66 HydrophobicContact CD1-CB 3.78Å; L16-T68 HydrophobicContact CD1-CG2 3.59Å; L16-T68 HydrophobicContact CG-CG2 4.38Å; L16-Y82 HydrophobicContact CD2-CD1 3.57Å; L16-Y82 HydrophobicContact CD2-CE1 3.43Å; L16-Y82 VanDerWaalsContact CD2-CE1 3.43Å; L16-Y82 HydrophobicContact CD2-CG 4.27Å; L16-T85 HydrophobicContact CB-CG2 3.85Å; L16-G87 PolarHBondContact N-O 2.77Å; L16-V88 HydrophobicContact CB-CG2 4.37Å; L16-V88 CarbonylContact O-C 3.45Å; L16-V88 WeakPolarHBondContact O-CA 3.34Å; L16-I89 PolarHBondContact O-N 2.84Å
17	I	92.1	Very high	89.1	Confident	1 Å²	1	33.4 Å²	33.4	1%	0.005	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	122	171	-49.4	-177.2	0	0	0	108.6	K25 L29 I65 W66 T68 I89 V91	I17-K25 HydrophobicContact CG2-CB 3.75Å; I17-K25 HydrophobicContact CG2-CD 4.01Å; I17-K25 HydrophobicContact CG2-CG 3.79Å; I17-L29 HydrophobicContact CD1-CB 4.35Å; I17-I65 HydrophobicContact CD1-CG2 3.5Å; I17-I65 VanDerWaalsContact CD1-CG2 3.5Å; I17-I65 HydrophobicContact CG1-CG2 3.66Å; I17-W66 PolarHBondContact N-O 3.15Å; I17-T68 PolarHBondContact O-N 3.26Å; I17-T68 PolarHBondContact O-OG1 2.89Å; I17-I89 WeakPolarHBondContact CA-O 3.47Å; I17-I89 HydrophobicContact CG1-CB 4.34Å; I17-I89 HydrophobicContact CG1-CD1 4.3Å; I17-I89 HydrophobicContact CG2-CB 4.47Å; I17-V91 HydrophobicContact CG2-CG2 3.61Å
18	I	92	Very high	90.5	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	166.4	179.4	70.6	174.4	0	0	0	111	L16 K25 I77 V88 I89 I90 V91 W106 I110	L16-I18 HydrophobicContact CD2-CG2 3.64Å; L16-I18 HydrophobicContact CG-CG2 3.7Å; I18-K25 VanDerWaalsContact C-CD 3.45Å; I18-I77 HydrophobicContact CB-CD1 4.2Å; I18-I77 HydrophobicContact CG2-CD1 3.51Å; I18-V88 HydrophobicContact CD1-CG1 3.75Å; I18-V88 HydrophobicContact CG1-CG1 3.8Å; I18-V88 HydrophobicContact CG2-CG1 4.38Å; I18-I89 PolarHBondContact N-O 3.29Å; I18-I90 HydrophobicContact CD1-CG1 4Å; I18-I90 HydrophobicContact CG1-CB 4.33Å; I18-I90 HydrophobicContact CG1-CG1 3.94Å; I18-I90 HydrophobicContact CG1-CG2 4.33Å; I18-V91 PolarHBondContact O-N 3.44Å; I18-W106 HydrophobicContact CB-CE3 4.13Å; I18-W106 HydrophobicContact CB-CZ3 4.45Å; I18-W106 HydrophobicContact CD1-CB 3.83Å; I18-W106 HydrophobicContact CD1-CD2 4.42Å; I18-W106 HydrophobicContact CD1-CE3 4.01Å; I18-W106 HydrophobicContact CD1-CG 4.42Å; I18-W106 HydrophobicContact CG1-CB 4.41Å; I18-W106 HydrophobicContact CG1-CE3 4.37Å; I18-I110 HydrophobicContact CD1-CD1 3.66Å; I18-I110 HydrophobicContact CD1-CG1 3.77Å
19	G	92.9	Very high	90.9	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	139.8	168.3	-174.2	0	0	0	0	0	111.7	K25 V91 W106	G19-K25 PolarHBondContact O-NZ 3Å; G19-V91 WeakPolarHBondContact CA-O 3.15Å; G19-W106 VanDerWaalsContact C-CE2 3.49Å; G19-W106 WeakPolarHBondContact O-CZ2 3.04Å
20	D	91.9	Very high	91.2	Very high	24 Å²	24	20 Å²	20	13%	0.128	12%	0.119	C	C	.	.			trans	-60.9	161.6	-177.4	-76.8	7.5	0	0	0	112.7	V23 K25 N102 R105 W106	D20-V23 HydrophobicContact CB-CG1 3.8Å; D20-V23 WeakPolarHBondContact O-CG2 3.48Å; D20-K25 PolarHBondContact O-NZ 2.91Å; D20-N102 WeakPolarHBondContact OD2-CB 3.18Å; D20-N102 PolarHBondContact OD2-ND2 2.81Å; D20-R105 IonicContact OD1-NH2 3.46Å; D20-R105 PolarHBondContact OD1-NH2 2.81Å; D20-W106 PolarHBondContact OD1-NE1 2.98Å
21	S	89.6	Confident	91.5	Very high	39 Å²	39	19.1 Å²	19.1	27%	0.273	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	141.6	170	-161.2	0	0	0	0	110.7	V23 Y41 G70	S21-V23 VanDerWaalsContact C-N 3.29Å; S21-V23 PolarHBondContact O-N 3.13Å; S21-Y41 PolarHBondContact OG-OH 2.85Å; S21-G70 PolarHBondContact N-O 3.01Å
22	G	90.8	Very high	91.7	Very high	24 Å²	24	17.9 Å²	17.9	25%	0.247	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	83.3	-6.7	174.2	0	0	0	0	0	116.3	G24 Y41 K125	G22-G24 PolarHBondContact O-N 3.1Å; G22-Y41 PolarHBondContact N-OH 2.88Å; G22-K125 WeakPolarHBondContact O-CE 3.42Å; G22-K125 PolarHBondContact O-NZ 2.85Å
23	V	94.3	Very high	91.7	Very high	2 Å²	2	16.4 Å²	16.4	1%	0.012	10%	0.102	C	C	.	.	S	Bend	trans	-72	-13.5	179.3	-54.8	0	0	0	0	113.9	D20 S21 K25 V91 D93 N124	D20-V23 HydrophobicContact CB-CG1 3.8Å; D20-V23 WeakPolarHBondContact O-CG2 3.48Å; S21-V23 VanDerWaalsContact C-N 3.29Å; S21-V23 PolarHBondContact O-N 3.13Å; V23-K25 HydrophobicContact CG2-CD 4.45Å; V23-K25 HydrophobicContact CG2-CG 3.69Å; V23-V91 HydrophobicContact CB-CG1 4.26Å; V23-V91 HydrophobicContact CG2-CB 3.9Å; V23-V91 HydrophobicContact CG2-CG1 3.79Å; V23-V91 WeakPolarHBondContact CG2-O 3.4Å; V23-D93 HydrophobicContact CB-CB 4.24Å; V23-D93 HydrophobicContact CG1-CB 4.18Å; V23-N124 PolarHBondContact O-ND2 3.41Å
24	G	94.2	Very high	91.8	Very high	10 Å²	10	19.4 Å²	19.4	10%	0.103	12%	0.119	C	C	.	.	S	Bend	trans	97.6	23.2	175.6	0	0	0	0	0	115.8	G22 S26 S27 L28	G22-G24 PolarHBondContact O-N 3.1Å; G24-S26 PolarHBondContact O-N 2.78Å; G24-S27 WeakPolarHBondContact O-CB 3.18Å; G24-S27 PolarHBondContact O-N 2.79Å; G24-L28 PolarHBondContact O-N 2.84Å
25	K	93.2	Very high	91.9	Very high	9 Å²	9	23.2 Å²	23.2	4%	0.039	14%	0.14	C	C	.	.	H	α-helix	trans	-49.8	-53.9	173.5	-58.5	-173.5	-62.5	-75.2	0	112.7	I17 I18 G19 D20 V23 S27 L28 L29 D67 T68 V91	I17-K25 HydrophobicContact CG2-CB 3.75Å; I17-K25 HydrophobicContact CG2-CD 4.01Å; I17-K25 HydrophobicContact CG2-CG 3.79Å; I18-K25 VanDerWaalsContact C-CD 3.45Å; G19-K25 PolarHBondContact O-NZ 3Å; D20-K25 PolarHBondContact O-NZ 2.91Å; V23-K25 HydrophobicContact CG2-CD 4.45Å; V23-K25 HydrophobicContact CG2-CG 3.69Å; K25-S27 VanDerWaalsContact C-N 3.33Å; K25-S27 PolarHBondContact O-N 3.05Å; K25-L28 WeakPolarHBondContact O-CB 3.28Å; K25-L28 PolarHBondContact O-N 2.77Å; K25-L29 PolarHBondContact O-N 3.04Å; K25-D67 WeakPolarHBondContact CB-OD1 3.48Å; K25-T68 WeakPolarHBondContact CE-O 3.44Å; K25-V91 HydrophobicContact CG-CB 4.08Å; K25-V91 HydrophobicContact CG-CG2 4.19Å
26	S	91.6	Very high	92	Very high	26 Å²	26	26.5 Å²	26.5	18%	0.182	16%	0.16	C	C	.	.	H	α-helix	trans	-66.2	-35.6	179.2	-41.9	0	0	0	0	112.2	G24 L29 L30 T44 D67	G24-S26 PolarHBondContact O-N 2.78Å; S26-L29 PolarHBondContact O-N 3.4Å; S26-L30 WeakPolarHBondContact O-CB 3.45Å; S26-L30 VanDerWaalsContact O-CG 3.28Å; S26-L30 WeakPolarHBondContact O-CG 3.42Å; S26-L30 PolarHBondContact O-N 2.86Å; S26-T44 PolarHBondContact OG-OG1 2.92Å; S26-D67 WeakPolarHBondContact CA-OD2 3.22Å; S26-D67 WeakPolarHBondContact CB-OD2 3.31Å; S26-D67 PolarHBondContact OG-OD2 3.1Å
27	S	93.7	Very high	92	Very high	34 Å²	34	29.9 Å²	29.9	24%	0.238	18%	0.175	C	C	.	.	H	α-helix	trans	-64.9	-40.5	175.2	-51.7	0	0	0	0	111.9	G24 K25 R31	G24-S27 WeakPolarHBondContact O-CB 3.18Å; G24-S27 PolarHBondContact O-N 2.79Å; K25-S27 VanDerWaalsContact C-N 3.33Å; K25-S27 PolarHBondContact O-N 3.05Å; S27-R31 VanDerWaalsContact O-CB 3.23Å; S27-R31 WeakPolarHBondContact O-CB 3.47Å; S27-R31 PolarHBondContact O-N 3.34Å
28	L	93.7	Very high	91.8	Very high	3 Å²	3	32.4 Å²	32.4	2%	0.016	19%	0.193	C	C	.	.	H	α-helix	trans	-62.9	-45.4	172.6	-74.1	170	0	0	0	110.7	G24 K25 R31 F32 V91 V122 N124 T153 A155 V161	G24-L28 PolarHBondContact O-N 2.84Å; K25-L28 WeakPolarHBondContact O-CB 3.28Å; K25-L28 PolarHBondContact O-N 2.77Å; L28-R31 PolarHBondContact O-N 3.09Å; L28-F32 VanDerWaalsContact O-CB 3.32Å; L28-F32 WeakPolarHBondContact O-CB 3.33Å; L28-F32 PolarHBondContact O-N 2.79Å; L28-V91 HydrophobicContact CD1-CG1 3.92Å; L28-V91 HydrophobicContact CD1-CG2 4.04Å; L28-V122 HydrophobicContact CD1-CG1 4.25Å; L28-N124 HydrophobicContact CD1-CB 4.3Å; L28-T153 HydrophobicContact CD2-CG2 4.46Å; L28-A155 HydrophobicContact CD2-CB 3.9Å; L28-A155 HydrophobicContact CG-CB 4.16Å; L28-V161 HydrophobicContact CD2-CG1 4.42Å; L28-V161 HydrophobicContact CD2-CG2 3.89Å
29	L	92.3	Very high	91.3	Very high	1 Å²	1	37.4 Å²	37.4	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-62	-47.4	178.7	-177.4	56.9	0	0	0	112.4	I17 K25 S26 R31 F32 A33 K50 I65 D67	I17-L29 HydrophobicContact CD1-CB 4.35Å; K25-L29 PolarHBondContact O-N 3.04Å; S26-L29 PolarHBondContact O-N 3.4Å; L29-R31 VanDerWaalsContact C-N 3.34Å; L29-R31 PolarHBondContact O-N 3.25Å; L29-F32 PolarHBondContact O-N 2.8Å; L29-A33 VanDerWaalsContact O-CB 3.27Å; L29-A33 WeakPolarHBondContact O-CB 3.44Å; L29-A33 PolarHBondContact O-N 3.49Å; L29-K50 HydrophobicContact CD1-CB 3.91Å; L29-K50 HydrophobicContact CD1-CG 4.15Å; L29-K50 HydrophobicContact CD2-CB 4.18Å; L29-K50 HydrophobicContact CD2-CG 3.84Å; L29-K50 HydrophobicContact CG-CB 4.23Å; L29-K50 HydrophobicContact CG-CG 3.91Å; L29-I65 HydrophobicContact CD1-CB 3.76Å; L29-I65 HydrophobicContact CD1-CD1 4.17Å; L29-I65 HydrophobicContact CD1-CG2 3.64Å; L29-D67 HydrophobicContact CD2-CB 3.46Å; L29-D67 VanDerWaalsContact CD2-CB 3.46Å
30	L	91.7	Very high	90.7	Very high	55 Å²	55	43.2 Å²	43.2	29%	0.288	26%	0.256	S	S	.	.	H	α-helix	trans	-63.3	-40.2	177.5	-72.5	173.1	0	0	0	111.7	S26 D34 N35 T36	S26-L30 WeakPolarHBondContact O-CB 3.45Å; S26-L30 VanDerWaalsContact O-CG 3.28Å; S26-L30 WeakPolarHBondContact O-CG 3.42Å; S26-L30 PolarHBondContact O-N 2.86Å; L30-D34 WeakPolarHBondContact O-CA 3.29Å; L30-D34 PolarHBondContact O-N 3.33Å; L30-N35 PolarHBondContact O-N 3.08Å; L30-T36 CarbonylContact C-O 3.53Å; L30-T36 PolarHBondContact O-N 2.72Å
31	R	94.1	Very high	89.5	Confident	41 Å²	41	48.5 Å²	48.5	16%	0.155	28%	0.275	C	S	.	.	H	α-helix	trans	-64.1	-43	175.1	177.2	58.3	75.8	-172.4	7.7	111.2	S27 L28 L29 N35 T36 A155 K156 N158 V161	S27-R31 VanDerWaalsContact O-CB 3.23Å; S27-R31 WeakPolarHBondContact O-CB 3.47Å; S27-R31 PolarHBondContact O-N 3.34Å; L28-R31 PolarHBondContact O-N 3.09Å; L29-R31 VanDerWaalsContact C-N 3.34Å; L29-R31 PolarHBondContact O-N 3.25Å; R31-N35 PolarHBondContact NH1-O 2.77Å; R31-N35 PolarHBondContact NH1-OD1 3.09Å; R31-N35 WeakPolarHBondContact O-CA 3.5Å; R31-N35 PolarHBondContact O-N 3.07Å; R31-N35 VanDerWaalsContact O-N 3.11Å; R31-T36 VanDerWaalsContact CA-O 3.28Å; R31-T36 WeakPolarHBondContact CA-O 3.42Å; R31-T36 PolarHBondContact N-O 2.65Å; R31-A155 PolarHBondContact NE-O 2.76Å; R31-K156 PolarHBondContact NH2-O 3.34Å; R31-K156 VanDerWaalsContact NH2-O 3.11Å; R31-N158 VanDerWaalsContact CD-OD1 3.3Å; R31-N158 WeakPolarHBondContact CD-OD1 3.35Å; R31-N158 HydrophobicContact CG-CB 4.3Å; R31-N158 WeakPolarHBondContact CG-OD1 3.31Å; R31-V161 HydrophobicContact CB-CG1 4.17Å; R31-V161 HydrophobicContact CG-CB 4.21Å; R31-V161 HydrophobicContact CG-CG1 3.88Å; R31-V161 HydrophobicContact CG-CG2 3.94Å
32	F	92.1	Very high	88.8	Confident	6 Å²	6	53.2 Å²	53.2	3%	0.026	30%	0.296	C	S	.	.	H	α-helix	trans	-69.2	-43.3	179.5	177.4	-108	0	0	0	113.5	L28 L29 R52 L63 I65 V161 E162 C165 I166	L28-F32 VanDerWaalsContact O-CB 3.32Å; L28-F32 WeakPolarHBondContact O-CB 3.33Å; L28-F32 PolarHBondContact O-N 2.79Å; L29-F32 PolarHBondContact O-N 2.8Å; F32-R52 HydrophobicContact CE1-CB 4.06Å; F32-R52 HydrophobicContact CE1-CG 4.42Å; F32-R52 PolarHBondContact O-NH1 3.32Å; F32-L63 HydrophobicContact CE1-CD1 4.35Å; F32-L63 HydrophobicContact CZ-CD1 3.94Å; F32-I65 HydrophobicContact CD1-CD1 3.52Å; F32-I65 HydrophobicContact CE1-CD1 3.4Å; F32-I65 HydrophobicContact CZ-CD1 4.42Å; F32-V161 HydrophobicContact CB-CG1 3.8Å; F32-E162 HydrophobicContact CD2-CG 4.37Å; F32-E162 HydrophobicContact CE2-CG 4.45Å; F32-C165 HydrophobicContact CB-CB 4.19Å; F32-C165 HydrophobicContact CD1-CB 3.78Å; F32-C165 HydrophobicContact CD2-CB 3.35Å; F32-C165 HydrophobicContact CE1-CB 3.92Å; F32-C165 HydrophobicContact CE2-CB 3.52Å; F32-C165 HydrophobicContact CG-CB 3.47Å; F32-C165 VanDerWaalsContact CG-CB 3.47Å; F32-C165 HydrophobicContact CZ-CB 3.78Å; F32-I166 HydrophobicContact CE2-CD1 4.14Å; F32-I166 HydrophobicContact CE2-CG1 3.71Å; F32-I166 HydrophobicContact CZ-CD1 4.47Å; F32-I166 HydrophobicContact CZ-CG1 3.82Å
33	A	88.8	Confident	87.9	Confident	30 Å²	30	54.4 Å²	54.4	25%	0.248	30%	0.299	C	S	.	.	H	α-helix	trans	-84.2	-43.5	-172.3	0	0	0	0	0	112.5	L29 K50	L29-A33 VanDerWaalsContact O-CB 3.27Å; L29-A33 WeakPolarHBondContact O-CB 3.44Å; L29-A33 PolarHBondContact O-N 3.49Å; A33-K50 HydrophobicContact CB-CB 4.09Å; A33-K50 HydrophobicContact CB-CD 4.03Å; A33-K50 HydrophobicContact CB-CG 4.01Å
34	D	88.9	Confident	86.6	Confident	75 Å²	75	55.7 Å²	55.7	40%	0.401	31%	0.307	S	S	.	.	H	α-helix	trans	-116.2	-2.4	-169.9	-53.4	-25.5	0	0	0	112.3	L30 T36 K50	L30-D34 WeakPolarHBondContact O-CA 3.29Å; L30-D34 PolarHBondContact O-N 3.33Å; D34-T36 HydrophobicContact CB-CG2 4.23Å; D34-T36 WeakPolarHBondContact O-CG2 3.23Å; D34-T36 PolarHBondContact O-N 3.23Å; D34-K50 IonicContact OD1-NZ 2.96Å; D34-K50 PolarHBondContact OD1-NZ 3.2Å; D34-K50 IonicContact OD2-NZ 3.79Å; D34-K50 PolarHBondContact OD2-NZ 2.83Å
35	N	91.8	Very high	85.2	Confident	106 Å²	106	63.1 Å²	63.1	57%	0.567	34%	0.342	S	S	*	.	S	Bend	trans	51.6	39.4	-171.6	-165.1	19.6	0	0	0	113.3	L30 R31	L30-N35 PolarHBondContact O-N 3.08Å; R31-N35 PolarHBondContact NH1-O 2.77Å; R31-N35 PolarHBondContact NH1-OD1 3.09Å; R31-N35 WeakPolarHBondContact O-CA 3.5Å; R31-N35 PolarHBondContact O-N 3.07Å; R31-N35 VanDerWaalsContact O-N 3.11Å
36	T	91.7	Very high	84	Confident	70 Å²	70	64.8 Å²	64.8	43%	0.429	36%	0.362	S	S	.	.			trans	-119.4	154	178	62.4	0	0	0	0	111.5	L30 R31 D34	L30-T36 CarbonylContact C-O 3.53Å; L30-T36 PolarHBondContact O-N 2.72Å; R31-T36 VanDerWaalsContact CA-O 3.28Å; R31-T36 WeakPolarHBondContact CA-O 3.42Å; R31-T36 PolarHBondContact N-O 2.65Å; D34-T36 HydrophobicContact CB-CG2 4.23Å; D34-T36 WeakPolarHBondContact O-CG2 3.23Å; D34-T36 PolarHBondContact O-N 3.23Å
37	F	91.4	Very high	83.1	Confident	72 Å²	72	65.8 Å²	65.8	32%	0.316	37%	0.367	S	S	.	.			trans	-139.8	132.1	170.8	175.1	-95.4	0	0	0	109.1	P39 A155 K156	F37-P39 HydrophobicContact CE1-CB 4.34Å; F37-A155 HydrophobicContact CD2-CB 4.16Å; F37-A155 HydrophobicContact CE2-CB 4.25Å; F37-K156 HydrophobicContact CD1-CB 4.35Å; F37-K156 HydrophobicContact CD1-CG 4.18Å; F37-K156 HydrophobicContact CD2-CB 4.26Å; F37-K156 HydrophobicContact CE1-CB 3.95Å; F37-K156 HydrophobicContact CE1-CD 4.47Å; F37-K156 HydrophobicContact CE1-CG 3.75Å; F37-K156 HydrophobicContact CE2-CB 3.84Å; F37-K156 HydrophobicContact CZ-CB 3.67Å; F37-K156 HydrophobicContact CZ-CG 3.97Å
38	S	87.3	Confident	82.5	Confident	54 Å²	54	67.3 Å²	67.3	38%	0.378	37%	0.373	S	S	.	.			trans	-113.8	126.9	173.6	175.6	0	0	0	0	109	N40	S38-N40 PolarHBondContact O-N 3.28Å; S38-N40 PolarHBondContact OG-N 2.97Å
39	P	81.3	Confident	82	Confident	105 Å²	105	70.5 Å²	70.5	68%	0.682	39%	0.386	S	S	*	.	S	Bend	trans	-71.7	-18.5	172.2	30.9	-34.6	0	0	0	112.1	F37 Y41	F37-P39 HydrophobicContact CE1-CB 4.34Å; P39-Y41 PolarHBondContact O-N 2.92Å; P39-Y41 VanDerWaalsContact O-N 3.13Å
40	N	79.3	Confident	81.8	Confident	122 Å²	122	73 Å²	73	65%	0.652	40%	0.397	S	S	*	.	S	Bend	trans	-72.1	109.7	177.7	-66.8	-23.5	0	0	0	109.1	S38 I42	S38-N40 PolarHBondContact O-N 3.28Å; S38-N40 PolarHBondContact OG-N 2.97Å; N40-I42 PolarHBondContact O-N 2.94Å
41	Y	67.9	Low	81.7	Confident	134 Å²	134	74.5 Å²	74.5	53%	0.525	40%	0.404	S	S	.	.			trans	-71.9	111.9	174.9	177.8	-104.6	0	0	0	110.1	S21 G22 P39 T43	S21-Y41 PolarHBondContact OG-OH 2.85Å; G22-Y41 PolarHBondContact N-OH 2.88Å; P39-Y41 PolarHBondContact O-N 2.92Å; P39-Y41 VanDerWaalsContact O-N 3.13Å; Y41-T43 WeakPolarHBondContact CE1-OG1 3.45Å
42	I	73.8	Confident	81.4	Confident	138 Å²	138	76 Å²	76	71%	0.708	41%	0.41	S	S	*	.			trans	-111.9	123.2	169.6	-57.4	174.7	0	0	0	106.9	N40 T44	N40-I42 PolarHBondContact O-N 2.94Å; I42-T44 PolarHBondContact O-N 3.43Å
43	T	72.8	Confident	81.3	Confident	50 Å²	50	79 Å²	79	31%	0.307	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-66.4	121	173.9	-54.2	0	0	0	0	109.5	Y41 I45	Y41-T43 WeakPolarHBondContact CE1-OG1 3.45Å; T43-I45 PolarHBondContact O-N 3.47Å
44	T	67	Low	81.2	Confident	29 Å²	29	78.4 Å²	78.4	18%	0.178	42%	0.422	C	S	.	.	P	Polyproline II helix	trans	-58.8	128.2	173.7	-47.9	0	0	0	0	110	S26 I42 D48 A69	S26-T44 PolarHBondContact OG-OG1 2.92Å; I42-T44 PolarHBondContact O-N 3.43Å; T44-D48 HydrophobicContact CG2-CB 4.38Å; T44-A69 WeakPolarHBondContact O-CB 3.49Å
45	I	65.7	Low	81.2	Confident	166 Å²	166	79.7 Å²	79.7	85%	0.851	43%	0.432	S	S	*	.	P	Polyproline II helix	trans	-101.2	117.6	174.3	-58.2	175.7	0	0	0	107	T43	T43-I45 PolarHBondContact O-N 3.47Å
46	G	67.6	Low	80.8	Confident	44 Å²	44	75.3 Å²	75.3	45%	0.454	41%	0.409	S	S	.	.	S	Bend	trans	81.6	-137.9	-179.8	0	0	0	0	0	113.6	A69	G46-A69 WeakPolarHBondContact O-CA 3.2Å; G46-A69 WeakPolarHBondContact O-CB 3.34Å; G46-A69 PolarHBondContact O-N 2.86Å
47	V	71.8	Confident	80.5	Confident	46 Å²	46	76.2 Å²	76.2	28%	0.279	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	123.6	179.1	179.3	0	0	0	0	107.9	W66 D67 T68 Y81	V47-W66 HydrophobicContact CG1-CB 4.46Å; V47-W66 HydrophobicContact CG1-CE3 3.82Å; V47-D67 CarbonylContact C-O 3.59Å; V47-D67 WeakPolarHBondContact CA-O 3.49Å; V47-D67 WeakPolarHBondContact CG1-O 3.26Å; V47-T68 HydrophobicContact CG2-CG2 4.4Å; V47-Y81 HydrophobicContact CB-CE1 3.96Å; V47-Y81 HydrophobicContact CG1-CD1 4.26Å; V47-Y81 HydrophobicContact CG1-CE1 3.88Å; V47-Y81 HydrophobicContact CG2-CD1 4.38Å; V47-Y81 HydrophobicContact CG2-CD2 4.44Å; V47-Y81 HydrophobicContact CG2-CE1 3.75Å; V47-Y81 HydrophobicContact CG2-CE2 3.81Å; V47-Y81 VanDerWaalsContact CG2-CZ 3.42Å; V47-Y81 WeakPolarHBondContact CG2-OH 3.27Å
48	D	81.4	Confident	80.2	Confident	67 Å²	67	75.8 Å²	75.8	36%	0.358	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	150.7	172	-163.7	8.4	0	0	0	109.5	T44 D67	T44-D48 HydrophobicContact CG2-CB 4.38Å; D48-D67 HydrophobicContact CB-CB 4.33Å; D48-D67 PolarHBondContact N-O 3.14Å; D48-D67 PolarHBondContact O-N 3.28Å
49	F	83.8	Confident	80.2	Confident	70 Å²	70	76.2 Å²	76.2	31%	0.307	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	121.4	-171.7	172.1	-102.9	0	0	0	110.3	I51 Q64 W66	F49-I51 HydrophobicContact CD1-CG1 4.36Å; F49-I51 HydrophobicContact CE1-CD1 3.53Å; F49-I51 HydrophobicContact CE1-CG1 3.4Å; F49-I51 HydrophobicContact CE2-CG1 4.26Å; F49-I51 HydrophobicContact CZ-CD1 3.56Å; F49-I51 HydrophobicContact CZ-CG1 3.34Å; F49-Q64 HydrophobicContact CE2-CB 3.8Å; F49-Q64 HydrophobicContact CE2-CG 3.86Å; F49-Q64 HydrophobicContact CZ-CB 4.29Å; F49-Q64 HydrophobicContact CZ-CG 3.84Å; F49-W66 HydrophobicContact CB-CE3 4.49Å; F49-W66 AromaticContact CD2-CD2 3.63Å; F49-W66 HydrophobicContact CD2-CD2 3.63Å; F49-W66 AromaticContact CD2-CE2 3.46Å; F49-W66 VanDerWaalsContact CD2-CE2 3.46Å; F49-W66 HydrophobicContact CD2-CE3 4.06Å; F49-W66 HydrophobicContact CD2-CG 4.04Å; F49-W66 HydrophobicContact CD2-CH2 4.21Å; F49-W66 AromaticContact CD2-CZ2 3.79Å; F49-W66 HydrophobicContact CD2-CZ2 3.79Å; F49-W66 HydrophobicContact CD2-CZ3 4.33Å; F49-W66 AromaticContact CD2-NE1 3.74Å; F49-W66 HydrophobicContact CE2-CD2 4.17Å; F49-W66 AromaticContact CE2-CE2 3.51Å; F49-W66 HydrophobicContact CE2-CH2 4.44Å; F49-W66 AromaticContact CE2-CZ2 3.69Å; F49-W66 HydrophobicContact CE2-CZ2 3.69Å; F49-W66 AromaticContact CE2-NE1 3.51Å; F49-W66 HydrophobicContact CZ-CZ2 4.48Å
50	K	88.5	Confident	80.5	Confident	53 Å²	53	75.7 Å²	75.7	23%	0.23	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	144.6	174.5	-68.8	-78.2	-168.4	161.6	0	110.3	L29 A33 D34 I65	L29-K50 HydrophobicContact CD1-CB 3.91Å; L29-K50 HydrophobicContact CD1-CG 4.15Å; L29-K50 HydrophobicContact CD2-CB 4.18Å; L29-K50 HydrophobicContact CD2-CG 3.84Å; L29-K50 HydrophobicContact CG-CB 4.23Å; L29-K50 HydrophobicContact CG-CG 3.91Å; A33-K50 HydrophobicContact CB-CB 4.09Å; A33-K50 HydrophobicContact CB-CD 4.03Å; A33-K50 HydrophobicContact CB-CG 4.01Å; D34-K50 IonicContact OD1-NZ 2.96Å; D34-K50 PolarHBondContact OD1-NZ 3.2Å; D34-K50 IonicContact OD2-NZ 3.79Å; D34-K50 PolarHBondContact OD2-NZ 2.83Å; K50-I65 PolarHBondContact N-O 2.88Å; K50-I65 PolarHBondContact O-N 3.34Å
51	I	88.4	Confident	81	Confident	86 Å²	86	69.9 Å²	69.9	44%	0.441	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	130.3	171	-58.2	-178.2	0	0	0	108.3	F49 K62 L63 Q64	F49-I51 HydrophobicContact CD1-CG1 4.36Å; F49-I51 HydrophobicContact CE1-CD1 3.53Å; F49-I51 HydrophobicContact CE1-CG1 3.4Å; F49-I51 HydrophobicContact CE2-CG1 4.26Å; F49-I51 HydrophobicContact CZ-CD1 3.56Å; F49-I51 HydrophobicContact CZ-CG1 3.34Å; I51-K62 HydrophobicContact CG2-CD 3.89Å; I51-K62 HydrophobicContact CG2-CG 3.52Å; I51-L63 VanDerWaalsContact CA-O 3.28Å; I51-L63 WeakPolarHBondContact CA-O 3.35Å; I51-Q64 HydrophobicContact CG1-CG 4.31Å
52	R	89	Confident	82	Confident	72 Å²	72	65.2 Å²	65.2	27%	0.272	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	126.3	167.4	-172.4	174.9	170.2	-170.5	-9.4	108.7	F32 I54 L63 E162	F32-R52 HydrophobicContact CE1-CB 4.06Å; F32-R52 HydrophobicContact CE1-CG 4.42Å; F32-R52 PolarHBondContact O-NH1 3.32Å; R52-I54 HydrophobicContact CG-CG2 4.08Å; R52-L63 PolarHBondContact N-O 3.26Å; R52-L63 WeakPolarHBondContact O-CB 3.08Å; R52-L63 PolarHBondContact O-N 2.72Å; R52-E162 IonicContact CZ-OE1 2.68Å; R52-E162 IonicContact NH1-OE1 3.81Å; R52-E162 PolarHBondContact NH1-OE1 2.83Å; R52-E162 IonicContact NH2-OE1 3.7Å; R52-E162 PolarHBondContact NH2-OE1 3.04Å
53	T	88.7	Confident	82.8	Confident	69 Å²	69	58.6 Å²	58.6	42%	0.423	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	125.3	169.9	-54.7	0	0	0	0	108.3	R60 V61	T53-R60 HydrophobicContact CG2-CB 4.21Å; T53-V61 CarbonylContact C-O 3.57Å; T53-V61 WeakPolarHBondContact CA-O 3.27Å
54	I	88.1	Confident	83.6	Confident	19 Å²	19	58.3 Å²	58.3	10%	0.097	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	162.5	174.7	64.2	172.7	0	0	0	109.4	R52 V56 R60 V61 L63 I166	R52-I54 HydrophobicContact CG-CG2 4.08Å; I54-V56 HydrophobicContact CD1-CG2 3.78Å; I54-V56 HydrophobicContact CG1-CG2 4.11Å; I54-R60 CarbonylContact O-C 3.58Å; I54-R60 WeakPolarHBondContact O-CA 3.42Å; I54-V61 HydrophobicContact CG1-CB 3.87Å; I54-V61 PolarHBondContact N-O 2.85Å; I54-V61 PolarHBondContact O-N 2.85Å; I54-L63 HydrophobicContact CD1-CD1 3.96Å; I54-L63 HydrophobicContact CD1-CG 4.5Å; I54-L63 HydrophobicContact CG1-CD1 4.42Å; I54-I166 HydrophobicContact CD1-CB 4.38Å; I54-I166 HydrophobicContact CD1-CD1 3.97Å; I54-I166 HydrophobicContact CD1-CG1 4Å; I54-I166 HydrophobicContact CD1-CG2 3.51Å
55	T	86.9	Confident	84.7	Confident	101 Å²	101	57 Å²	57	62%	0.62	31%	0.313	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.3	124.8	171.9	-55.7	0	0	0	0	109	E59	T55-E59 CarbonylContact C-O 3.54Å; T55-E59 VanDerWaalsContact CA-O 3.32Å; T55-E59 WeakPolarHBondContact CA-O 3.28Å
56	V	84.2	Confident	85.8	Confident	14 Å²	14	52.1 Å²	52.1	9%	0.085	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	120.3	178.5	176.1	0	0	0	0	108	I54 G58 E59 V61 L171 L174	I54-V56 HydrophobicContact CD1-CG2 3.78Å; I54-V56 HydrophobicContact CG1-CG2 4.11Å; V56-G58 PolarHBondContact O-N 3.19Å; V56-G58 VanDerWaalsContact O-N 3.09Å; V56-E59 PolarHBondContact N-O 3.49Å; V56-E59 WeakPolarHBondContact O-CB 3.4Å; V56-E59 PolarHBondContact O-N 3.5Å; V56-V61 HydrophobicContact CB-CG2 4Å; V56-V61 HydrophobicContact CG2-CG2 3.99Å; V56-L171 HydrophobicContact CB-CD2 4.31Å; V56-L171 HydrophobicContact CG1-CD2 3.29Å; V56-L171 HydrophobicContact CG2-CD2 4.02Å; V56-L174 HydrophobicContact CB-CD1 3.79Å; V56-L174 HydrophobicContact CG1-CD1 3.65Å; V56-L174 HydrophobicContact CG2-CD1 4.43Å
57	D	84.7	Confident	86.7	Confident	89 Å²	89	50 Å²	50	48%	0.476	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.2	35.3	-179.1	-57.4	-28.7	0	0	0	113.6	E59 K178	D57-E59 VanDerWaalsContact C-N 3.29Å; D57-E59 PolarHBondContact O-N 3.09Å; D57-K178 VanDerWaalsContact CB-NZ 3.27Å; D57-K178 PolarHBondContact O-NZ 3.09Å
58	G	86.4	Confident	87	Confident	64 Å²	64	48 Å²	48	66%	0.66	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	84.6	-11.2	-177.6	0	0	0	0	0	115.5	V56	V56-G58 PolarHBondContact O-N 3.19Å; V56-G58 VanDerWaalsContact O-N 3.09Å
59	E	88	Confident	86.5	Confident	63 Å²	63	45.8 Å²	45.8	29%	0.294	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	138.1	177.1	-59.4	-64.6	150.5	0	0	110.7	D10 H11 T55 V56 D57 L174	D10-E59 HydrophobicContact CB-CB 4.43Å; D10-E59 VanDerWaalsContact CB-OE2 3.24Å; D10-E59 WeakPolarHBondContact CB-OE2 3.28Å; H11-E59 IonicContact NE2-OE2 2.69Å; T55-E59 CarbonylContact C-O 3.54Å; T55-E59 VanDerWaalsContact CA-O 3.32Å; T55-E59 WeakPolarHBondContact CA-O 3.28Å; V56-E59 PolarHBondContact N-O 3.49Å; V56-E59 WeakPolarHBondContact O-CB 3.4Å; V56-E59 PolarHBondContact O-N 3.5Å; D57-E59 VanDerWaalsContact C-N 3.29Å; D57-E59 PolarHBondContact O-N 3.09Å; E59-L174 HydrophobicContact CB-CD2 4.49Å
60	R	87.3	Confident	85.3	Confident	94 Å²	94	42.7 Å²	42.7	36%	0.355	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	114.3	176.3	-62.8	169.7	-64.5	162.2	8.5	109.7	R7 D8 D10 H11 T53 I54	R7-R60 PolarHBondContact O-NH1 3Å; R7-R60 PolarHBondContact O-NH2 2.89Å; D8-R60 PolarHBondContact O-NH1 2.52Å; D10-R60 PolarHBondContact N-O 3.11Å; D10-R60 IonicContact OD1-CZ 3.96Å; D10-R60 IonicContact OD1-NE 3.89Å; D10-R60 IonicContact OD1-NH2 3.11Å; D10-R60 PolarHBondContact OD1-NH2 3.38Å; D10-R60 VanDerWaalsContact OD1-NH2 3.11Å; D10-R60 WeakPolarHBondContact OD2-CA 3.47Å; D10-R60 VanDerWaalsContact OD2-CB 3.25Å; D10-R60 WeakPolarHBondContact OD2-CB 3.31Å; D10-R60 IonicContact OD2-CZ 3.99Å; D10-R60 PolarHBondContact OD2-N 2.84Å; D10-R60 IonicContact OD2-NE 3.21Å; D10-R60 PolarHBondContact OD2-NE 3.19Å; D10-R60 IonicContact OD2-NH2 3.82Å; H11-R60 PolarHBondContact N-O 2.8Å; H11-R60 VanDerWaalsContact N-O 3.13Å; T53-R60 HydrophobicContact CG2-CB 4.21Å; I54-R60 CarbonylContact O-C 3.58Å; I54-R60 WeakPolarHBondContact O-CA 3.42Å
61	V	89	Confident	83.6	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	114.9	-179.3	-173.7	0	0	0	0	109	F13 T53 I54 V56 L63 L174	F13-V61 HydrophobicContact CD2-CG1 3.43Å; F13-V61 VanDerWaalsContact CD2-CG1 3.43Å; F13-V61 HydrophobicContact CE2-CG1 3.71Å; T53-V61 CarbonylContact C-O 3.57Å; T53-V61 WeakPolarHBondContact CA-O 3.27Å; I54-V61 HydrophobicContact CG1-CB 3.87Å; I54-V61 PolarHBondContact N-O 2.85Å; I54-V61 PolarHBondContact O-N 2.85Å; V56-V61 HydrophobicContact CB-CG2 4Å; V56-V61 HydrophobicContact CG2-CG2 3.99Å; V61-L63 HydrophobicContact CG1-CD2 3.95Å; V61-L174 HydrophobicContact CG2-CD1 3.51Å
62	K	89.4	Confident	81.7	Confident	35 Å²	35	42.3 Å²	42.3	15%	0.152	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	112.9	173.7	-172.8	172.4	-70.8	-176.5	0	109.5	Y9 H11 L12 F13 I51	Y9-K62 HydrophobicContact CD1-CB 4.25Å; Y9-K62 HydrophobicContact CD1-CD 3.75Å; Y9-K62 VanDerWaalsContact CD1-NZ 3.26Å; Y9-K62 HydrophobicContact CD2-CB 4.24Å; Y9-K62 HydrophobicContact CE1-CD 4.08Å; Y9-K62 HydrophobicContact CG-CB 3.78Å; Y9-K62 HydrophobicContact CG-CD 4.19Å; H11-K62 PolarHBondContact O-N 2.98Å; L12-K62 WeakPolarHBondContact CA-O 3.42Å; L12-K62 HydrophobicContact CD1-CB 3.96Å; L12-K62 HydrophobicContact CD1-CD 4.05Å; L12-K62 HydrophobicContact CD1-CG 3.89Å; F13-K62 PolarHBondContact N-O 3.33Å; I51-K62 HydrophobicContact CG2-CD 3.89Å; I51-K62 HydrophobicContact CG2-CG 3.52Å
63	L	89.9	Confident	79.9	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	123.3	173.9	-58	178.4	0	0	0	109.3	F13 F32 I51 R52 I54 V61 I65 I166	F13-L63 HydrophobicContact CB-CD2 3.9Å; F32-L63 HydrophobicContact CE1-CD1 4.35Å; F32-L63 HydrophobicContact CZ-CD1 3.94Å; I51-L63 VanDerWaalsContact CA-O 3.28Å; I51-L63 WeakPolarHBondContact CA-O 3.35Å; R52-L63 PolarHBondContact N-O 3.26Å; R52-L63 WeakPolarHBondContact O-CB 3.08Å; R52-L63 PolarHBondContact O-N 2.72Å; I54-L63 HydrophobicContact CD1-CD1 3.96Å; I54-L63 HydrophobicContact CD1-CG 4.5Å; I54-L63 HydrophobicContact CG1-CD1 4.42Å; V61-L63 HydrophobicContact CG1-CD2 3.95Å; L63-I65 HydrophobicContact CB-CG1 4.48Å; L63-I166 HydrophobicContact CD1-CG1 4.13Å
64	Q	89.2	Confident	78	Confident	44 Å²	44	52.3 Å²	52.3	21%	0.206	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	110.9	170	-78.1	-174.6	-14.7	0	0	108.4	L12 F13 K14 L15 F49 I51	L12-Q64 HydrophobicContact CD1-CG 3.79Å; F13-Q64 PolarHBondContact O-N 3.18Å; K14-Q64 CarbonylContact C-O 3.59Å; K14-Q64 WeakPolarHBondContact CA-O 3.37Å; L15-Q64 PolarHBondContact N-O 3.42Å; F49-Q64 HydrophobicContact CE2-CB 3.8Å; F49-Q64 HydrophobicContact CE2-CG 3.86Å; F49-Q64 HydrophobicContact CZ-CB 4.29Å; F49-Q64 HydrophobicContact CZ-CG 3.84Å; I51-Q64 HydrophobicContact CG1-CG 4.31Å
65	I	90.4	Very high	76.2	Confident	2 Å²	2	61.8 Å²	61.8	1%	0.01	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	118.9	-178.7	-50.1	-177.4	0	0	0	108.8	L15 I17 L29 F32 K50 L63 C165	L15-I65 HydrophobicContact CB-CG1 4.32Å; L15-I65 HydrophobicContact CD1-CD1 4.43Å; L15-I65 HydrophobicContact CD1-CG1 4.25Å; I17-I65 HydrophobicContact CD1-CG2 3.5Å; I17-I65 VanDerWaalsContact CD1-CG2 3.5Å; I17-I65 HydrophobicContact CG1-CG2 3.66Å; L29-I65 HydrophobicContact CD1-CB 3.76Å; L29-I65 HydrophobicContact CD1-CD1 4.17Å; L29-I65 HydrophobicContact CD1-CG2 3.64Å; F32-I65 HydrophobicContact CD1-CD1 3.52Å; F32-I65 HydrophobicContact CE1-CD1 3.4Å; F32-I65 HydrophobicContact CZ-CD1 4.42Å; K50-I65 PolarHBondContact N-O 2.88Å; K50-I65 PolarHBondContact O-N 3.34Å; L63-I65 HydrophobicContact CB-CG1 4.48Å; I65-C165 HydrophobicContact CD1-CB 4.24Å
66	W	89.2	Confident	74.8	Confident	63 Å²	63	61.5 Å²	61.5	24%	0.239	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	109.2	179.4	-63.6	77.6	0	0	0	108.4	L15 L16 I17 V47 F49 Y81	L15-W66 PolarHBondContact O-N 3.04Å; L16-W66 HydrophobicContact CD1-CB 3.78Å; I17-W66 PolarHBondContact N-O 3.15Å; V47-W66 HydrophobicContact CG1-CB 4.46Å; V47-W66 HydrophobicContact CG1-CE3 3.82Å; F49-W66 HydrophobicContact CB-CE3 4.49Å; F49-W66 AromaticContact CD2-CD2 3.63Å; F49-W66 HydrophobicContact CD2-CD2 3.63Å; F49-W66 AromaticContact CD2-CE2 3.46Å; F49-W66 VanDerWaalsContact CD2-CE2 3.46Å; F49-W66 HydrophobicContact CD2-CE3 4.06Å; F49-W66 HydrophobicContact CD2-CG 4.04Å; F49-W66 HydrophobicContact CD2-CH2 4.21Å; F49-W66 AromaticContact CD2-CZ2 3.79Å; F49-W66 HydrophobicContact CD2-CZ2 3.79Å; F49-W66 HydrophobicContact CD2-CZ3 4.33Å; F49-W66 AromaticContact CD2-NE1 3.74Å; F49-W66 HydrophobicContact CE2-CD2 4.17Å; F49-W66 AromaticContact CE2-CE2 3.51Å; F49-W66 HydrophobicContact CE2-CH2 4.44Å; F49-W66 AromaticContact CE2-CZ2 3.69Å; F49-W66 HydrophobicContact CE2-CZ2 3.69Å; F49-W66 AromaticContact CE2-NE1 3.51Å; F49-W66 HydrophobicContact CZ-CZ2 4.48Å; W66-Y81 AromaticContact CE3-CD1 3.88Å; W66-Y81 HydrophobicContact CE3-CD1 3.88Å; W66-Y81 AromaticContact CE3-CE1 3.98Å; W66-Y81 HydrophobicContact CE3-CE1 3.98Å; W66-Y81 HydrophobicContact CZ3-CD1 4.14Å; W66-Y81 AromaticContact CZ3-CE1 3.94Å; W66-Y81 HydrophobicContact CZ3-CE1 3.94Å
67	D	86.4	Confident	73.7	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	114.7	173	175.8	41.1	0	0	0	109.5	K25 S26 L29 V47 D48	K25-D67 WeakPolarHBondContact CB-OD1 3.48Å; S26-D67 WeakPolarHBondContact CA-OD2 3.22Å; S26-D67 WeakPolarHBondContact CB-OD2 3.31Å; S26-D67 PolarHBondContact OG-OD2 3.1Å; L29-D67 HydrophobicContact CD2-CB 3.46Å; L29-D67 VanDerWaalsContact CD2-CB 3.46Å; V47-D67 CarbonylContact C-O 3.59Å; V47-D67 WeakPolarHBondContact CA-O 3.49Å; V47-D67 WeakPolarHBondContact CG1-O 3.26Å; D48-D67 HydrophobicContact CB-CB 4.33Å; D48-D67 PolarHBondContact N-O 3.14Å; D48-D67 PolarHBondContact O-N 3.28Å
68	T	78.8	Confident	72.6	Confident	2 Å²	2	61.3 Å²	61.3	1%	0.012	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	138.9	-179.9	57.7	0	0	0	0	110.7	L16 I17 K25 V47 G70 I77	L16-T68 HydrophobicContact CD1-CG2 3.59Å; L16-T68 HydrophobicContact CG-CG2 4.38Å; I17-T68 PolarHBondContact O-N 3.26Å; I17-T68 PolarHBondContact O-OG1 2.89Å; K25-T68 WeakPolarHBondContact CE-O 3.44Å; V47-T68 HydrophobicContact CG2-CG2 4.4Å; T68-G70 PolarHBondContact O-N 2.92Å; T68-I77 HydrophobicContact CG2-CD1 3.96Å; T68-I77 HydrophobicContact CG2-CG1 4.23Å; T68-I77 HydrophobicContact CG2-CG2 4.17Å
69	A	70.9	Confident	71.7	Confident	21 Å²	21	61.6 Å²	61.6	17%	0.174	29%	0.286	C	S	.	.			trans	-56.9	126.5	165.2	0	0	0	0	0	108.9	T44 G46 Q71	T44-A69 WeakPolarHBondContact O-CB 3.49Å; G46-A69 WeakPolarHBondContact O-CA 3.2Å; G46-A69 WeakPolarHBondContact O-CB 3.34Å; G46-A69 PolarHBondContact O-N 2.86Å; A69-Q71 HydrophobicContact CB-CG 4.44Å; A69-Q71 PolarHBondContact O-N 3.12Å
70	G	57.4	Low	71.1	Confident	5 Å²	5	62.7 Å²	62.7	5%	0.052	30%	0.298	C	S	.	.			trans	-71.4	17.9	175.9	0	0	0	0	0	114	S21 T68 E72	S21-G70 PolarHBondContact N-O 3.01Å; T68-G70 PolarHBondContact O-N 2.92Å; G70-E72 PolarHBondContact O-N 3.16Å
71	Q	53.4	Low	70.7	Confident	45 Å²	45	61.5 Å²	61.5	21%	0.21	29%	0.294	C	S	.	.			trans	-69.1	96.7	-175	-77.6	-74.1	-6.9	0	0	110.4	A69 R73 F74	A69-Q71 HydrophobicContact CB-CG 4.44Å; A69-Q71 PolarHBondContact O-N 3.12Å; Q71-R73 PolarHBondContact O-N 2.67Å; Q71-F74 HydrophobicContact CB-CD2 4.31Å; Q71-F74 PolarHBondContact O-N 2.8Å; Q71-F74 VanDerWaalsContact O-N 3.12Å
72	E	48.7	Very low	70.3	Confident	87 Å²	87	61.6 Å²	61.6	41%	0.407	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-52.8	-12.7	165.6	68.1	-66.3	148.3	0	0	114.3	G70 R75	G70-E72 PolarHBondContact O-N 3.16Å; E72-R75 WeakPolarHBondContact O-CG 3.31Å
73	R	50.6	Low	69.9	Low	179 Å²	179	69.4 Å²	69.4	68%	0.675	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-82.8	-15.4	177.2	-70.1	-175.9	-70.3	168.2	1.8	114.1	Q71	Q71-R73 PolarHBondContact O-N 2.67Å
74	F	49.6	Very low	69.7	Low	171 Å²	171	71.9 Å²	71.9	75%	0.75	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-118.4	59.7	172.1	-59.3	-71.4	0	0	0	109.2	Q71 T76	Q71-F74 HydrophobicContact CB-CD2 4.31Å; Q71-F74 PolarHBondContact O-N 2.8Å; Q71-F74 VanDerWaalsContact O-N 3.12Å; F74-T76 CarbonylContact O-C 3.41Å; F74-T76 PolarHBondContact O-N 3.05Å
75	R	51	Low	69.6	Low	218 Å²	218	70.4 Å²	70.4	82%	0.823	34%	0.342	S	S	*	.			trans	-46.3	13.1	-164.4	-72.5	-170.7	173.5	-167.8	-1.6	119.9	E72	E72-R75 WeakPolarHBondContact O-CG 3.31Å
76	T	56.3	Low	69.5	Low	96 Å²	96	73.7 Å²	73.7	59%	0.589	36%	0.357	S	S	*	.	S	Bend	trans	-140.3	113.4	171.9	-50.2	0	0	0	0	106.5	F74 T78	F74-T76 CarbonylContact O-C 3.41Å; F74-T76 PolarHBondContact O-N 3.05Å; T76-T78 PolarHBondContact O-N 2.86Å; T76-T78 VanDerWaalsContact O-N 3.07Å
77	I	61.3	Low	69.5	Low	21 Å²	21	70.9 Å²	70.9	11%	0.108	35%	0.348	C	S	.	.			trans	-54.6	123.1	159.1	-67.7	164.4	0	0	0	104.3	I18 T68 S79 Y81 Y82 W106 E109	I18-I77 HydrophobicContact CB-CD1 4.2Å; I18-I77 HydrophobicContact CG2-CD1 3.51Å; T68-I77 HydrophobicContact CG2-CD1 3.96Å; T68-I77 HydrophobicContact CG2-CG1 4.23Å; T68-I77 HydrophobicContact CG2-CG2 4.17Å; I77-S79 PolarHBondContact O-N 2.97Å; I77-S79 VanDerWaalsContact O-N 3.08Å; I77-Y81 HydrophobicContact CG2-CD2 3.65Å; I77-Y81 HydrophobicContact CG2-CG 4.05Å; I77-Y82 HydrophobicContact CB-CE2 3.81Å; I77-Y82 HydrophobicContact CG2-CD2 4.3Å; I77-Y82 HydrophobicContact CG2-CE2 3.9Å; I77-W106 HydrophobicContact CD1-CZ3 3.89Å; I77-E109 WeakPolarHBondContact CB-OE1 3.33Å; I77-E109 PolarHBondContact N-OE1 3.33Å; I77-E109 VanDerWaalsContact N-OE1 3.16Å
78	T	61.6	Low	69.8	Low	78 Å²	78	71 Å²	71	48%	0.479	35%	0.349	S	S	.	.			trans	-51.2	127.5	-177.2	-47.1	0	0	0	0	108.2	T76 T80 Y81	T76-T78 PolarHBondContact O-N 2.86Å; T76-T78 VanDerWaalsContact O-N 3.07Å; T78-T80 WeakPolarHBondContact CG2-OG1 3Å; T78-T80 PolarHBondContact O-N 2.98Å; T78-Y81 WeakPolarHBondContact O-CD2 3.07Å; T78-Y81 PolarHBondContact O-N 2.97Å
79	S	68.5	Low	70.5	Confident	69 Å²	69	71.1 Å²	71.1	48%	0.483	35%	0.35	S	S	.	.	H	α-helix	trans	-49.6	-23.2	-178.1	55.6	0	0	0	0	113.1	I77 Y81 Y82 R83 N113	I77-S79 PolarHBondContact O-N 2.97Å; I77-S79 VanDerWaalsContact O-N 3.08Å; S79-Y81 VanDerWaalsContact C-N 3.3Å; S79-Y81 PolarHBondContact O-N 3.27Å; S79-Y82 PolarHBondContact O-N 3.48Å; S79-R83 PolarHBondContact O-N 2.85Å; S79-N113 VanDerWaalsContact CB-OD1 3.23Å; S79-N113 WeakPolarHBondContact CB-OD1 3.07Å
80	T	73.7	Confident	71.7	Confident	87 Å²	87	70.2 Å²	70.2	53%	0.534	34%	0.342	S	S	.	.	H	α-helix	trans	-50.2	-38.9	168.1	-48.6	0	0	0	0	114.7	T78 R83	T78-T80 WeakPolarHBondContact CG2-OG1 3Å; T78-T80 PolarHBondContact O-N 2.98Å; T80-R83 PolarHBondContact O-N 3.28Å
81	Y	79.7	Confident	73.5	Confident	69 Å²	69	70 Å²	70	27%	0.271	34%	0.339	S	S	.	.	H	α-helix	trans	-73.1	-31.5	-179.5	-65.8	-71.8	0	0	0	112.4	K14 V47 W66 I77 T78 S79 T85	K14-Y81 VanDerWaalsContact CE-O 3.29Å; K14-Y81 WeakPolarHBondContact CE-O 3.24Å; K14-Y81 PolarHBondContact NZ-O 2.79Å; V47-Y81 HydrophobicContact CB-CE1 3.96Å; V47-Y81 HydrophobicContact CG1-CD1 4.26Å; V47-Y81 HydrophobicContact CG1-CE1 3.88Å; V47-Y81 HydrophobicContact CG2-CD1 4.38Å; V47-Y81 HydrophobicContact CG2-CD2 4.44Å; V47-Y81 HydrophobicContact CG2-CE1 3.75Å; V47-Y81 HydrophobicContact CG2-CE2 3.81Å; V47-Y81 VanDerWaalsContact CG2-CZ 3.42Å; V47-Y81 WeakPolarHBondContact CG2-OH 3.27Å; W66-Y81 AromaticContact CE3-CD1 3.88Å; W66-Y81 HydrophobicContact CE3-CD1 3.88Å; W66-Y81 AromaticContact CE3-CE1 3.98Å; W66-Y81 HydrophobicContact CE3-CE1 3.98Å; W66-Y81 HydrophobicContact CZ3-CD1 4.14Å; W66-Y81 AromaticContact CZ3-CE1 3.94Å; W66-Y81 HydrophobicContact CZ3-CE1 3.94Å; I77-Y81 HydrophobicContact CG2-CD2 3.65Å; I77-Y81 HydrophobicContact CG2-CG 4.05Å; T78-Y81 WeakPolarHBondContact O-CD2 3.07Å; T78-Y81 PolarHBondContact O-N 2.97Å; S79-Y81 VanDerWaalsContact C-N 3.3Å; S79-Y81 PolarHBondContact O-N 3.27Å; Y81-T85 PolarHBondContact O-OG1 3.22Å; Y81-T85 VanDerWaalsContact O-OG1 3.1Å
82	Y	81.4	Confident	75.6	Confident	2 Å²	2	67.9 Å²	67.9	1%	0.008	33%	0.329	C	S	.	.	H	α-helix	trans	-70.8	-29.8	176.4	-73.9	-72.5	0	0	0	113	L16 I77 S79 G84 T85 E109 I110 N113 C114	L16-Y82 HydrophobicContact CD2-CD1 3.57Å; L16-Y82 HydrophobicContact CD2-CE1 3.43Å; L16-Y82 VanDerWaalsContact CD2-CE1 3.43Å; L16-Y82 HydrophobicContact CD2-CG 4.27Å; I77-Y82 HydrophobicContact CB-CE2 3.81Å; I77-Y82 HydrophobicContact CG2-CD2 4.3Å; I77-Y82 HydrophobicContact CG2-CE2 3.9Å; S79-Y82 PolarHBondContact O-N 3.48Å; Y82-G84 PolarHBondContact O-N 3.29Å; Y82-T85 VanDerWaalsContact O-CB 3.27Å; Y82-T85 WeakPolarHBondContact O-CB 2.92Å; Y82-T85 PolarHBondContact O-N 3.4Å; Y82-T85 VanDerWaalsContact O-N 3.09Å; Y82-T85 PolarHBondContact O-OG1 2.94Å; Y82-E109 HydrophobicContact CE2-CG 3.95Å; Y82-E109 VanDerWaalsContact OH-CD 3.28Å; Y82-E109 VanDerWaalsContact OH-CG 3.31Å; Y82-E109 WeakPolarHBondContact OH-CG 3.17Å; Y82-E109 PolarHBondContact OH-OE1 3.11Å; Y82-I110 HydrophobicContact CE1-CG1 4.09Å; Y82-N113 HydrophobicContact CD1-CB 4.14Å; Y82-N113 HydrophobicContact CD2-CB 3.58Å; Y82-N113 HydrophobicContact CE2-CB 4.26Å; Y82-N113 HydrophobicContact CG-CB 3.5Å; Y82-C114 WeakPolarHBondContact CD1-SG 3.47Å
83	R	81	Confident	78	Confident	198 Å²	198	64.3 Å²	64.3	75%	0.747	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	126	179.9	-175.4	-179.6	-73	164.5	-3	111.7	K14 S79 T80 T85	K14-R83 PolarHBondContact NZ-O 2.81Å; S79-R83 PolarHBondContact O-N 2.85Å; T80-R83 PolarHBondContact O-N 3.28Å; R83-T85 PolarHBondContact O-N 3.29Å
84	G	84.2	Confident	80.3	Confident	52 Å²	52	55.8 Å²	55.8	54%	0.536	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.3	14	177.4	0	0	0	0	0	114.4	Y82 H86	Y82-G84 PolarHBondContact O-N 3.29Å; G84-H86 PolarHBondContact O-CE1 2.89Å; G84-H86 PolarHBondContact O-ND1 2.83Å
85	T	86.9	Confident	82.6	Confident	14 Å²	14	49.3 Å²	49.3	9%	0.086	26%	0.256	C	S	.	.			trans	-72.2	128.9	172.2	-66.1	0	0	0	0	109.6	K14 L16 Y81 Y82 R83 G87 V88 V117	K14-T85 WeakPolarHBondContact CE-OG1 3.44Å; L16-T85 HydrophobicContact CB-CG2 3.85Å; Y81-T85 PolarHBondContact O-OG1 3.22Å; Y81-T85 VanDerWaalsContact O-OG1 3.1Å; Y82-T85 VanDerWaalsContact O-CB 3.27Å; Y82-T85 WeakPolarHBondContact O-CB 2.92Å; Y82-T85 PolarHBondContact O-N 3.4Å; Y82-T85 VanDerWaalsContact O-N 3.09Å; Y82-T85 PolarHBondContact O-OG1 2.94Å; R83-T85 PolarHBondContact O-N 3.29Å; T85-G87 WeakPolarHBondContact CG2-O 3.42Å; T85-V88 HydrophobicContact CG2-CG2 3.78Å; T85-V117 HydrophobicContact CG2-CG2 4.08Å
86	H	88.4	Confident	84.8	Confident	70 Å²	70	40.7 Å²	40.7	32%	0.324	23%	0.229	S	C	.	.	S	Bend	trans	-92.3	-31	-179.7	-57.6	83.4	0	0	0	111.6	F13 K14 G84 Q118 Y169	F13-H86 HydrophobicContact CD1-CB 4.23Å; K14-H86 PolarHBondContact N-ND1 3.46Å; K14-H86 PolarHBondContact O-N 3.21Å; G84-H86 PolarHBondContact O-CE1 2.89Å; G84-H86 PolarHBondContact O-ND1 2.83Å; H86-Q118 PolarHBondContact O-N 3.35Å; H86-Y169 HydrophobicContact CB-CE1 4.34Å
87	G	90.3	Very high	86.8	Confident	5 Å²	5	37.6 Å²	37.6	5%	0.052	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	147.7	177.1	0	0	0	0	0	112.4	K14 L15 L16 T85 Q118	K14-G87 PolarHBondContact O-N 2.73Å; L15-G87 VanDerWaalsContact CA-O 3.31Å; L15-G87 WeakPolarHBondContact CA-O 3.45Å; L16-G87 PolarHBondContact N-O 2.77Å; T85-G87 WeakPolarHBondContact CG2-O 3.42Å; G87-Q118 CarbonylContact C-O 3.59Å; G87-Q118 VanDerWaalsContact CA-O 3.28Å; G87-Q118 WeakPolarHBondContact CA-O 3.41Å
88	V	92	Very high	88.5	Confident	3 Å²	3	42.5 Å²	42.5	2%	0.018	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	130.8	175.7	-174.4	0	0	0	0	109.8	L16 I18 T85 I90 I110 V117 Q118 R119 I120	L16-V88 HydrophobicContact CB-CG2 4.37Å; L16-V88 CarbonylContact O-C 3.45Å; L16-V88 WeakPolarHBondContact O-CA 3.34Å; I18-V88 HydrophobicContact CD1-CG1 3.75Å; I18-V88 HydrophobicContact CG1-CG1 3.8Å; I18-V88 HydrophobicContact CG2-CG1 4.38Å; T85-V88 HydrophobicContact CG2-CG2 3.78Å; V88-I90 HydrophobicContact CB-CD1 4.49Å; V88-I90 HydrophobicContact CG1-CD1 4.16Å; V88-I90 HydrophobicContact CG1-CG1 4.21Å; V88-I110 HydrophobicContact CB-CD1 3.99Å; V88-I110 HydrophobicContact CB-CG1 4.44Å; V88-I110 HydrophobicContact CG1-CD1 3.59Å; V88-I110 HydrophobicContact CG1-CG1 4.04Å; V88-I110 HydrophobicContact CG2-CD1 4.37Å; V88-I110 HydrophobicContact CG2-CG1 4.3Å; V88-I110 HydrophobicContact CG2-CG2 4.49Å; V88-V117 HydrophobicContact CG2-CG1 4.33Å; V88-V117 HydrophobicContact CG2-CG2 3.77Å; V88-Q118 PolarHBondContact N-O 3.25Å; V88-R119 WeakPolarHBondContact O-CA 3.45Å; V88-I120 PolarHBondContact O-N 2.97Å
89	I	94	Very high	90.2	Very high	4 Å²	4	39 Å²	39	2%	0.021	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	111.4	173.9	-55	174.8	0	0	0	107.2	L16 I17 I18 V91 V122 V164	L16-I89 PolarHBondContact O-N 2.84Å; I17-I89 WeakPolarHBondContact CA-O 3.47Å; I17-I89 HydrophobicContact CG1-CB 4.34Å; I17-I89 HydrophobicContact CG1-CD1 4.3Å; I17-I89 HydrophobicContact CG2-CB 4.47Å; I18-I89 PolarHBondContact N-O 3.29Å; I89-V91 HydrophobicContact CG2-CG2 3.91Å; I89-V122 HydrophobicContact CG2-CB 4.31Å; I89-V122 HydrophobicContact CG2-CG2 3.57Å; I89-V164 VanDerWaalsContact CD1-O 3.28Å; I89-V164 WeakPolarHBondContact CD1-O 3.47Å
90	I	95.1	Very high	91.6	Very high	1 Å²	1	37.4 Å²	37.4	1%	0.005	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	112.8	177.8	-52	89.2	0	0	0	107.9	I18 V88 V103 W106 L107 I110 R119 I120 L121 V122	I18-I90 HydrophobicContact CD1-CG1 4Å; I18-I90 HydrophobicContact CG1-CB 4.33Å; I18-I90 HydrophobicContact CG1-CG1 3.94Å; I18-I90 HydrophobicContact CG1-CG2 4.33Å; V88-I90 HydrophobicContact CB-CD1 4.49Å; V88-I90 HydrophobicContact CG1-CD1 4.16Å; V88-I90 HydrophobicContact CG1-CG1 4.21Å; I90-V103 HydrophobicContact CG2-CG1 4.1Å; I90-V103 HydrophobicContact CG2-CG2 4.45Å; I90-W106 HydrophobicContact CG2-CB 3.9Å; I90-W106 HydrophobicContact CG2-CG 4.42Å; I90-L107 HydrophobicContact CD1-CD2 4.24Å; I90-L107 HydrophobicContact CG1-CD2 4.49Å; I90-I110 HydrophobicContact CD1-CD1 3.75Å; I90-I110 HydrophobicContact CG1-CD1 3.71Å; I90-R119 HydrophobicContact CD1-CB 4.17Å; I90-I120 WeakPolarHBondContact CD1-O 3.41Å; I90-I120 PolarHBondContact N-O 3.27Å; I90-L121 HydrophobicContact CB-CD1 4.31Å; I90-L121 HydrophobicContact CG2-CD1 4.31Å; I90-L121 CarbonylContact O-C 3.58Å; I90-V122 PolarHBondContact O-N 3.31Å
91	V	96.3	Very high	92.7	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.006	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	132.3	-175.2	-169.6	0	0	0	0	110.3	I17 I18 G19 V23 K25 L28 I89 V122 N124	I17-V91 HydrophobicContact CG2-CG2 3.61Å; I18-V91 PolarHBondContact O-N 3.44Å; G19-V91 WeakPolarHBondContact CA-O 3.15Å; V23-V91 HydrophobicContact CB-CG1 4.26Å; V23-V91 HydrophobicContact CG2-CB 3.9Å; V23-V91 HydrophobicContact CG2-CG1 3.79Å; V23-V91 WeakPolarHBondContact CG2-O 3.4Å; K25-V91 HydrophobicContact CG-CB 4.08Å; K25-V91 HydrophobicContact CG-CG2 4.19Å; L28-V91 HydrophobicContact CD1-CG1 3.92Å; L28-V91 HydrophobicContact CD1-CG2 4.04Å; I89-V91 HydrophobicContact CG2-CG2 3.91Å; V91-V122 WeakPolarHBondContact CA-O 3.28Å; V91-V122 HydrophobicContact CG1-CG1 4.47Å; V91-V122 HydrophobicContact CG2-CB 4.34Å; V91-N124 HydrophobicContact CG1-CB 3.8Å
92	F	97.8	Very high	93.4	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	166.2	165.2	75.1	-86.5	0	0	0	110	V94 F100 V103 L121 V122 G123 N124 V134 A139 Y150	F92-V94 HydrophobicContact CE2-CG1 4.11Å; F92-F100 HydrophobicContact CD1-CD2 4.03Å; F92-F100 HydrophobicContact CD2-CB 3.8Å; F92-F100 AromaticContact CD2-CD2 3.91Å; F92-F100 HydrophobicContact CD2-CD2 3.91Å; F92-F100 HydrophobicContact CD2-CG 4.28Å; F92-F100 AromaticContact CE1-CD2 3.86Å; F92-F100 HydrophobicContact CE1-CD2 3.86Å; F92-F100 HydrophobicContact CE1-CE2 4.24Å; F92-F100 HydrophobicContact CE2-CB 4.21Å; F92-F100 AromaticContact CE2-CD2 3.77Å; F92-F100 HydrophobicContact CE2-CD2 3.77Å; F92-F100 HydrophobicContact CE2-CG 4.29Å; F92-F100 HydrophobicContact CG-CB 4.27Å; F92-F100 HydrophobicContact CG-CD2 4.04Å; F92-F100 AromaticContact CZ-CD2 3.74Å; F92-F100 HydrophobicContact CZ-CD2 3.74Å; F92-F100 HydrophobicContact CZ-CE2 4.18Å; F92-V103 HydrophobicContact CB-CG2 3.95Å; F92-V103 HydrophobicContact CD1-CG2 4.14Å; F92-V103 HydrophobicContact CG-CG2 4.29Å; F92-L121 HydrophobicContact CD1-CD1 3.68Å; F92-L121 HydrophobicContact CD1-CG 4.21Å; F92-L121 HydrophobicContact CE1-CD1 3.91Å; F92-L121 HydrophobicContact CE1-CD2 4.22Å; F92-L121 HydrophobicContact CE1-CG 3.91Å; F92-V122 VanDerWaalsContact CD1-O 3.3Å; F92-V122 WeakPolarHBondContact CD1-O 3.18Å; F92-V122 PolarHBondContact N-O 3.04Å; F92-G123 VanDerWaalsContact CE1-CA 3.46Å; F92-G123 VanDerWaalsContact CZ-CA 3.45Å; F92-N124 PolarHBondContact O-N 2.78Å; F92-V134 HydrophobicContact CE2-CB 4.02Å; F92-V134 HydrophobicContact CE2-CG1 3.78Å; F92-V134 HydrophobicContact CE2-CG2 4.21Å; F92-V134 HydrophobicContact CZ-CG1 4.23Å; F92-A139 HydrophobicContact CZ-CB 3.88Å; F92-Y150 AromaticContact CE1-CE2 3.78Å; F92-Y150 HydrophobicContact CE1-CE2 3.78Å; F92-Y150 AromaticContact CZ-CE2 3.9Å; F92-Y150 HydrophobicContact CZ-CE2 3.9Å
93	D	98.1	Very high	94.1	Very high	12 Å²	12	36.7 Å²	36.7	6%	0.064	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	123.4	176.8	179.8	-6.1	0	0	0	109.6	V23 T95 S96 S99 K125	V23-D93 HydrophobicContact CB-CB 4.24Å; V23-D93 HydrophobicContact CG1-CB 4.18Å; D93-T95 PolarHBondContact O-N 2.74Å; D93-T95 VanDerWaalsContact O-N 3.09Å; D93-T95 PolarHBondContact OD1-N 2.83Å; D93-T95 PolarHBondContact OD1-OG1 2.99Å; D93-T95 PolarHBondContact OD2-OG1 2.72Å; D93-S96 PolarHBondContact O-N 3.24Å; D93-S99 PolarHBondContact N-OG 3.46Å; D93-S99 PolarHBondContact O-OG 3.37Å; D93-K125 WeakPolarHBondContact OD1-CD 3.31Å; D93-K125 WeakPolarHBondContact OD2-CD 3.34Å; D93-K125 VanDerWaalsContact OD2-CE 3.31Å; D93-K125 WeakPolarHBondContact OD2-CE 3.38Å; D93-K125 IonicContact OD2-NZ 2.67Å; D93-K125 PolarHBondContact OD2-NZ 2.73Å
94	V	98.7	Very high	94.8	Very high	0 Å²	0	34 Å²	34	0%	0	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-17.1	179.9	-57.4	0	0	0	0	113.3	F92 N124 K125 V133 V134	F92-V94 HydrophobicContact CE2-CG1 4.11Å; V94-N124 WeakPolarHBondContact CG1-O 3.46Å; V94-N124 WeakPolarHBondContact CG2-O 3.28Å; V94-N124 PolarHBondContact N-O 2.81Å; V94-K125 VanDerWaalsContact CG2-O 3.31Å; V94-K125 WeakPolarHBondContact CG2-O 3.32Å; V94-V133 PolarHBondContact O-N 2.86Å; V94-V134 PolarHBondContact O-N 3.33Å
95	T	98.4	Very high	95.2	Very high	35 Å²	35	36.9 Å²	36.9	22%	0.215	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.1	2.4	174.8	80.1	0	0	0	0	113	D93 E128 R131 V133	D93-T95 PolarHBondContact O-N 2.74Å; D93-T95 VanDerWaalsContact O-N 3.09Å; D93-T95 PolarHBondContact OD1-N 2.83Å; D93-T95 PolarHBondContact OD1-OG1 2.99Å; D93-T95 PolarHBondContact OD2-OG1 2.72Å; T95-E128 HydrophobicContact CG2-CB 3.63Å; T95-E128 HydrophobicContact CG2-CG 4.47Å; T95-R131 WeakPolarHBondContact CA-O 3.34Å; T95-R131 VanDerWaalsContact CB-O 3.27Å; T95-R131 WeakPolarHBondContact CB-O 3.35Å; T95-R131 HydrophobicContact CG2-CB 3.72Å; T95-V133 VanDerWaalsContact C-CG2 3.46Å; T95-V133 WeakPolarHBondContact O-CG2 3.17Å
96	S	97.9	Very high	95.5	Very high	38 Å²	38	37.1 Å²	37.1	27%	0.266	19%	0.194	S	C	.	.			trans	-127.6	104.7	179.6	176.9	0	0	0	0	111.8	D93 D98 S99 F100	D93-S96 PolarHBondContact O-N 3.24Å; S96-D98 VanDerWaalsContact C-N 3.28Å; S96-D98 PolarHBondContact O-N 3.44Å; S96-S99 WeakPolarHBondContact CB-OG 3.32Å; S96-S99 PolarHBondContact O-N 2.75Å; S96-S99 PolarHBondContact O-OG 3.3Å; S96-S99 PolarHBondContact OG-N 3.18Å; S96-F100 PolarHBondContact O-N 2.81Å
97	G	97.8	Very high	95.7	Very high	31 Å²	31	34.4 Å²	34.4	32%	0.32	18%	0.182	S	C	.	.	H	α-helix	trans	-59.7	-38.3	174.1	0	0	0	0	0	112.5	S99 F100 V101 V133	G97-S99 VanDerWaalsContact C-N 3.35Å; G97-S99 PolarHBondContact O-N 3.44Å; G97-F100 PolarHBondContact O-N 2.8Å; G97-V101 WeakPolarHBondContact O-CG2 3.43Å; G97-V101 PolarHBondContact O-N 2.91Å; G97-V133 VanDerWaalsContact N-CG2 3.32Å
98	D	97.2	Very high	95.8	Very high	124 Å²	124	39.2 Å²	39.2	66%	0.663	20%	0.203	S	C	*	.	H	α-helix	trans	-60.9	-43.6	177.6	-67.6	-24.4	0	0	0	111.8	S96 F100 V101 N102	S96-D98 VanDerWaalsContact C-N 3.28Å; S96-D98 PolarHBondContact O-N 3.44Å; D98-F100 VanDerWaalsContact C-N 3.25Å; D98-F100 PolarHBondContact O-N 2.84Å; D98-V101 PolarHBondContact O-N 2.85Å; D98-N102 WeakPolarHBondContact O-CB 3.18Å; D98-N102 VanDerWaalsContact O-CG 3.28Å; D98-N102 PolarHBondContact O-N 2.98Å; D98-N102 PolarHBondContact O-ND2 3.26Å
99	S	96.3	Very high	95.6	Very high	3 Å²	3	40 Å²	40	2%	0.021	21%	0.206	C	C	.	.	H	α-helix	trans	-62.5	-35.2	178.6	78.6	0	0	0	0	112.3	D93 S96 G97 V103	D93-S99 PolarHBondContact N-OG 3.46Å; D93-S99 PolarHBondContact O-OG 3.37Å; S96-S99 WeakPolarHBondContact CB-OG 3.32Å; S96-S99 PolarHBondContact O-N 2.75Å; S96-S99 PolarHBondContact O-OG 3.3Å; S96-S99 PolarHBondContact OG-N 3.18Å; G97-S99 VanDerWaalsContact C-N 3.35Å; G97-S99 PolarHBondContact O-N 3.44Å; S99-V103 PolarHBondContact O-N 2.81Å
100	F	98.4	Very high	95.4	Very high	36 Å²	36	39.8 Å²	39.8	16%	0.158	21%	0.205	C	C	.	.	H	α-helix	trans	-73.3	-42.8	176.1	179.9	-113.4	0	0	0	112.1	F92 S96 G97 D98 N102 V103 L121 V134 A139 F142	F92-F100 HydrophobicContact CD1-CD2 4.03Å; F92-F100 HydrophobicContact CD2-CB 3.8Å; F92-F100 AromaticContact CD2-CD2 3.91Å; F92-F100 HydrophobicContact CD2-CD2 3.91Å; F92-F100 HydrophobicContact CD2-CG 4.28Å; F92-F100 AromaticContact CE1-CD2 3.86Å; F92-F100 HydrophobicContact CE1-CD2 3.86Å; F92-F100 HydrophobicContact CE1-CE2 4.24Å; F92-F100 HydrophobicContact CE2-CB 4.21Å; F92-F100 AromaticContact CE2-CD2 3.77Å; F92-F100 HydrophobicContact CE2-CD2 3.77Å; F92-F100 HydrophobicContact CE2-CG 4.29Å; F92-F100 HydrophobicContact CG-CB 4.27Å; F92-F100 HydrophobicContact CG-CD2 4.04Å; F92-F100 AromaticContact CZ-CD2 3.74Å; F92-F100 HydrophobicContact CZ-CD2 3.74Å; F92-F100 HydrophobicContact CZ-CE2 4.18Å; S96-F100 PolarHBondContact O-N 2.81Å; G97-F100 PolarHBondContact O-N 2.8Å; D98-F100 VanDerWaalsContact C-N 3.25Å; D98-F100 PolarHBondContact O-N 2.84Å; F100-N102 PolarHBondContact O-N 2.8Å; F100-V103 HydrophobicContact CD2-CG2 4.35Å; F100-V103 VanDerWaalsContact O-CB 3.22Å; F100-V103 WeakPolarHBondContact O-CB 3.29Å; F100-V103 VanDerWaalsContact O-CG2 3.29Å; F100-V103 WeakPolarHBondContact O-CG2 3.23Å; F100-V103 PolarHBondContact O-N 3.45Å; F100-V103 VanDerWaalsContact O-N 3.08Å; F100-L121 HydrophobicContact CE2-CD2 4.49Å; F100-V134 HydrophobicContact CB-CG1 4.29Å; F100-V134 HydrophobicContact CB-CG2 3.73Å; F100-V134 HydrophobicContact CD1-CG1 3.88Å; F100-V134 HydrophobicContact CD1-CG2 4.39Å; F100-V134 HydrophobicContact CD2-CG1 4.02Å; F100-V134 HydrophobicContact CE1-CG1 4.18Å; F100-V134 HydrophobicContact CE2-CG1 4.32Å; F100-V134 HydrophobicContact CG-CG1 3.79Å; F100-V134 HydrophobicContact CG-CG2 4.13Å; F100-V134 HydrophobicContact CZ-CG1 4.39Å; F100-A139 HydrophobicContact CE2-CB 3.92Å; F100-A139 HydrophobicContact CZ-CB 4.24Å; F100-F142 HydrophobicContact CE2-CB 4.35Å; F100-F142 HydrophobicContact CE2-CD1 4.14Å; F100-F142 HydrophobicContact CE2-CG 4.31Å; F100-F142 HydrophobicContact CZ-CB 3.74Å; F100-F142 HydrophobicContact CZ-CD1 4.25Å; F100-F142 AromaticContact CZ-CG 3.95Å; F100-F142 HydrophobicContact CZ-CG 3.95Å
101	V	97	Very high	95.2	Very high	97 Å²	97	44 Å²	44	59%	0.588	23%	0.228	S	C	*	.	H	α-helix	trans	-57.4	-39.8	174	169.5	0	0	0	0	110.9	G97 D98 V103	G97-V101 WeakPolarHBondContact O-CG2 3.43Å; G97-V101 PolarHBondContact O-N 2.91Å; D98-V101 PolarHBondContact O-N 2.85Å; V101-V103 PolarHBondContact O-N 2.91Å
102	N	95.3	Very high	94.9	Very high	46 Å²	46	50 Å²	50	25%	0.246	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-12	179.4	-73	-26.6	0	0	0	114.4	D20 D98 F100 K104 R105 W106	D20-N102 WeakPolarHBondContact OD2-CB 3.18Å; D20-N102 PolarHBondContact OD2-ND2 2.81Å; D98-N102 WeakPolarHBondContact O-CB 3.18Å; D98-N102 VanDerWaalsContact O-CG 3.28Å; D98-N102 PolarHBondContact O-N 2.98Å; D98-N102 PolarHBondContact O-ND2 3.26Å; F100-N102 PolarHBondContact O-N 2.8Å; N102-K104 PolarHBondContact O-N 2.81Å; N102-R105 WeakPolarHBondContact O-CB 3.38Å; N102-R105 PolarHBondContact O-N 2.67Å; N102-W106 PolarHBondContact O-N 3.42Å
103	V	95.6	Very high	94.4	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-55.1	-37.5	175	172.4	0	0	0	0	111.8	I90 F92 S99 F100 V101 R105 W106 L107 L121 F142	I90-V103 HydrophobicContact CG2-CG1 4.1Å; I90-V103 HydrophobicContact CG2-CG2 4.45Å; F92-V103 HydrophobicContact CB-CG2 3.95Å; F92-V103 HydrophobicContact CD1-CG2 4.14Å; F92-V103 HydrophobicContact CG-CG2 4.29Å; S99-V103 PolarHBondContact O-N 2.81Å; F100-V103 HydrophobicContact CD2-CG2 4.35Å; F100-V103 VanDerWaalsContact O-CB 3.22Å; F100-V103 WeakPolarHBondContact O-CB 3.29Å; F100-V103 VanDerWaalsContact O-CG2 3.29Å; F100-V103 WeakPolarHBondContact O-CG2 3.23Å; F100-V103 PolarHBondContact O-N 3.45Å; F100-V103 VanDerWaalsContact O-N 3.08Å; V101-V103 PolarHBondContact O-N 2.91Å; V103-R105 VanDerWaalsContact C-N 3.26Å; V103-R105 PolarHBondContact O-N 3.15Å; V103-W106 WeakPolarHBondContact O-CB 3.37Å; V103-W106 PolarHBondContact O-N 3.1Å; V103-W106 VanDerWaalsContact O-N 3.09Å; V103-L107 HydrophobicContact CG1-CD1 4.16Å; V103-L107 HydrophobicContact CG1-CG 4.29Å; V103-L107 PolarHBondContact O-N 3.37Å; V103-L121 HydrophobicContact CB-CD1 4.44Å; V103-L121 HydrophobicContact CG1-CD1 3.61Å; V103-L121 HydrophobicContact CG2-CD1 3.91Å; V103-F142 HydrophobicContact CB-CE1 4.27Å; V103-F142 HydrophobicContact CB-CZ 4.44Å; V103-F142 HydrophobicContact CG1-CE1 3.48Å; V103-F142 VanDerWaalsContact CG1-CE1 3.48Å; V103-F142 HydrophobicContact CG1-CZ 3.91Å
104	K	94.9	Very high	93.8	Very high	142 Å²	142	52.7 Å²	52.7	62%	0.617	27%	0.272	S	S	*	.	H	α-helix	trans	-58.1	-38.4	177	-70.8	-179.3	179	177.8	0	112.6	N102 H108 F142	N102-K104 PolarHBondContact O-N 2.81Å; K104-H108 PolarHBondContact O-N 3.48Å; K104-F142 HydrophobicContact CD-CE2 4.28Å; K104-F142 HydrophobicContact CG-CE2 3.65Å; K104-F142 HydrophobicContact CG-CZ 3.81Å
105	R	92.5	Very high	93	Very high	112 Å²	112	61.3 Å²	61.3	42%	0.423	31%	0.312	S	S	.	.	H	α-helix	trans	-65.2	-44.3	176.1	-179.4	-174.1	66.8	-146.5	-4.2	110.6	D20 N102 V103 H108 E109	D20-R105 IonicContact OD1-NH2 3.46Å; D20-R105 PolarHBondContact OD1-NH2 2.81Å; N102-R105 WeakPolarHBondContact O-CB 3.38Å; N102-R105 PolarHBondContact O-N 2.67Å; V103-R105 VanDerWaalsContact C-N 3.26Å; V103-R105 PolarHBondContact O-N 3.15Å; R105-H108 WeakPolarHBondContact O-CB 3.32Å; R105-H108 PolarHBondContact O-N 3.23Å; R105-E109 PolarHBondContact O-N 3.18Å
106	W	92.4	Very high	92.1	Very high	19 Å²	19	67.4 Å²	67.4	7%	0.072	34%	0.343	C	S	.	.	H	α-helix	trans	-63.8	-40.1	178.5	-65.9	116.7	0	0	0	112.6	I18 G19 D20 I77 I90 N102 V103 E109 I110	I18-W106 HydrophobicContact CB-CE3 4.13Å; I18-W106 HydrophobicContact CB-CZ3 4.45Å; I18-W106 HydrophobicContact CD1-CB 3.83Å; I18-W106 HydrophobicContact CD1-CD2 4.42Å; I18-W106 HydrophobicContact CD1-CE3 4.01Å; I18-W106 HydrophobicContact CD1-CG 4.42Å; I18-W106 HydrophobicContact CG1-CB 4.41Å; I18-W106 HydrophobicContact CG1-CE3 4.37Å; G19-W106 VanDerWaalsContact C-CE2 3.49Å; G19-W106 WeakPolarHBondContact O-CZ2 3.04Å; D20-W106 PolarHBondContact OD1-NE1 2.98Å; I77-W106 HydrophobicContact CD1-CZ3 3.89Å; I90-W106 HydrophobicContact CG2-CB 3.9Å; I90-W106 HydrophobicContact CG2-CG 4.42Å; N102-W106 PolarHBondContact O-N 3.42Å; V103-W106 WeakPolarHBondContact O-CB 3.37Å; V103-W106 PolarHBondContact O-N 3.1Å; V103-W106 VanDerWaalsContact O-N 3.09Å; W106-E109 PolarHBondContact O-N 3.1Å; W106-I110 WeakPolarHBondContact O-CG1 3.29Å; W106-I110 PolarHBondContact O-N 3.28Å; W106-I110 VanDerWaalsContact O-N 3.1Å
107	L	93.4	Very high	91.6	Very high	13 Å²	13	66 Å²	66	7%	0.068	33%	0.333	C	S	.	.	H	α-helix	trans	-61.9	-44.6	173	-71.1	173.2	0	0	0	111.9	I90 V103 E109 I110 D111 F142 T146 V148	I90-L107 HydrophobicContact CD1-CD2 4.24Å; I90-L107 HydrophobicContact CG1-CD2 4.49Å; V103-L107 HydrophobicContact CG1-CD1 4.16Å; V103-L107 HydrophobicContact CG1-CG 4.29Å; V103-L107 PolarHBondContact O-N 3.37Å; L107-E109 VanDerWaalsContact C-N 3.32Å; L107-E109 PolarHBondContact O-N 3.41Å; L107-I110 HydrophobicContact CD2-CD1 4.43Å; L107-I110 WeakPolarHBondContact O-CB 3.28Å; L107-I110 PolarHBondContact O-N 2.99Å; L107-D111 PolarHBondContact O-N 3.11Å; L107-F142 HydrophobicContact CD1-CE1 3.95Å; L107-F142 HydrophobicContact CD1-CZ 3.75Å; L107-T146 HydrophobicContact CD1-CG2 3.98Å; L107-V148 HydrophobicContact CD2-CG1 4.02Å
108	H	91.8	Very high	91.1	Very high	107 Å²	107	68.8 Å²	68.8	50%	0.495	34%	0.338	S	S	.	.	H	α-helix	trans	-61.4	-39.8	176.9	-172.7	63.7	0	0	0	112.5	K104 R105 I110 D111 Q112	K104-H108 PolarHBondContact O-N 3.48Å; R105-H108 WeakPolarHBondContact O-CB 3.32Å; R105-H108 PolarHBondContact O-N 3.23Å; H108-I110 VanDerWaalsContact C-N 3.33Å; H108-I110 PolarHBondContact O-N 2.93Å; H108-D111 PolarHBondContact O-N 3.4Å; H108-Q112 PolarHBondContact NE2-NE2 3.38Å; H108-Q112 WeakPolarHBondContact O-CG 3.33Å; H108-Q112 PolarHBondContact O-N 2.92Å; H108-Q112 VanDerWaalsContact O-N 3.1Å
109	E	88.9	Confident	90.8	Very high	18 Å²	18	65.6 Å²	65.6	8%	0.084	32%	0.316	C	S	.	.	H	α-helix	trans	-63.9	-38.6	175.8	-166.7	174.1	155.2	0	0	111.8	I77 Y82 R105 W106 L107 Q112 N113	I77-E109 WeakPolarHBondContact CB-OE1 3.33Å; I77-E109 PolarHBondContact N-OE1 3.33Å; I77-E109 VanDerWaalsContact N-OE1 3.16Å; Y82-E109 HydrophobicContact CE2-CG 3.95Å; Y82-E109 VanDerWaalsContact OH-CD 3.28Å; Y82-E109 VanDerWaalsContact OH-CG 3.31Å; Y82-E109 WeakPolarHBondContact OH-CG 3.17Å; Y82-E109 PolarHBondContact OH-OE1 3.11Å; R105-E109 PolarHBondContact O-N 3.18Å; W106-E109 PolarHBondContact O-N 3.1Å; L107-E109 VanDerWaalsContact C-N 3.32Å; L107-E109 PolarHBondContact O-N 3.41Å; E109-Q112 PolarHBondContact O-N 3.13Å; E109-N113 PolarHBondContact O-N 3.31Å; E109-N113 PolarHBondContact O-ND2 3.22Å
110	I	90.1	Very high	90.8	Very high	0 Å²	0	65.8 Å²	65.8	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-61.7	-48.7	172.8	-65.2	161.1	0	0	0	110.6	I18 Y82 V88 I90 W106 L107 H108 Q112 N113 C114 V117	I18-I110 HydrophobicContact CD1-CD1 3.66Å; I18-I110 HydrophobicContact CD1-CG1 3.77Å; Y82-I110 HydrophobicContact CE1-CG1 4.09Å; V88-I110 HydrophobicContact CB-CD1 3.99Å; V88-I110 HydrophobicContact CB-CG1 4.44Å; V88-I110 HydrophobicContact CG1-CD1 3.59Å; V88-I110 HydrophobicContact CG1-CG1 4.04Å; V88-I110 HydrophobicContact CG2-CD1 4.37Å; V88-I110 HydrophobicContact CG2-CG1 4.3Å; V88-I110 HydrophobicContact CG2-CG2 4.49Å; I90-I110 HydrophobicContact CD1-CD1 3.75Å; I90-I110 HydrophobicContact CG1-CD1 3.71Å; W106-I110 WeakPolarHBondContact O-CG1 3.29Å; W106-I110 PolarHBondContact O-N 3.28Å; W106-I110 VanDerWaalsContact O-N 3.1Å; L107-I110 HydrophobicContact CD2-CD1 4.43Å; L107-I110 WeakPolarHBondContact O-CB 3.28Å; L107-I110 PolarHBondContact O-N 2.99Å; H108-I110 VanDerWaalsContact C-N 3.33Å; H108-I110 PolarHBondContact O-N 2.93Å; I110-Q112 PolarHBondContact O-N 3.43Å; I110-N113 PolarHBondContact O-N 3.27Å; I110-C114 HydrophobicContact CG2-CB 4.1Å; I110-C114 WeakPolarHBondContact O-CB 3.4Å; I110-C114 PolarHBondContact O-N 3.13Å; I110-V117 HydrophobicContact CG2-CG1 3.44Å; I110-V117 VanDerWaalsContact CG2-CG1 3.44Å
111	D	90.9	Very high	90.7	Very high	89 Å²	89	64.1 Å²	64.1	48%	0.476	31%	0.31	S	S	.	.	H	α-helix	trans	-59.4	-32	-178.9	-71.4	-34.8	0	0	0	112.6	L107 H108 R119	L107-D111 PolarHBondContact O-N 3.11Å; H108-D111 PolarHBondContact O-N 3.4Å; D111-R119 IonicContact OD1-CZ 2.65Å; D111-R119 IonicContact OD1-NH1 2.97Å; D111-R119 PolarHBondContact OD1-NH1 3.31Å; D111-R119 IonicContact OD1-NH2 2.77Å; D111-R119 PolarHBondContact OD1-NH2 2.91Å; D111-R119 IonicContact OD2-NH1 2.97Å
112	Q	89.5	Confident	90.8	Very high	129 Å²	129	59.5 Å²	59.5	60%	0.603	28%	0.282	S	S	*	.	H	α-helix	trans	-76.9	-22.5	177.3	-72.3	-178.6	-19.5	0	0	114.1	H108 E109 I110	H108-Q112 PolarHBondContact NE2-NE2 3.38Å; H108-Q112 WeakPolarHBondContact O-CG 3.33Å; H108-Q112 PolarHBondContact O-N 2.92Å; H108-Q112 VanDerWaalsContact O-N 3.1Å; E109-Q112 PolarHBondContact O-N 3.13Å; I110-Q112 PolarHBondContact O-N 3.43Å
113	N	87.3	Confident	90.9	Very high	51 Å²	51	57.3 Å²	57.3	27%	0.273	27%	0.27	S	S	.	.	H	α-helix	trans	-121	-13.4	-167.9	-69.5	-85.7	0	0	0	114.6	S79 Y82 E109 I110	S79-N113 VanDerWaalsContact CB-OD1 3.23Å; S79-N113 WeakPolarHBondContact CB-OD1 3.07Å; Y82-N113 HydrophobicContact CD1-CB 4.14Å; Y82-N113 HydrophobicContact CD2-CB 3.58Å; Y82-N113 HydrophobicContact CE2-CB 4.26Å; Y82-N113 HydrophobicContact CG-CB 3.5Å; E109-N113 PolarHBondContact O-N 3.31Å; E109-N113 PolarHBondContact O-ND2 3.22Å; I110-N113 PolarHBondContact O-N 3.27Å
114	C	85.3	Confident	91.1	Very high	17 Å²	17	57.4 Å²	57.4	12%	0.115	27%	0.271	C	S	.	.			trans	-130.2	132.6	-175.9	-64.9	0	0	0	0	112.4	Y82 I110 V117	Y82-C114 WeakPolarHBondContact CD1-SG 3.47Å; I110-C114 HydrophobicContact CG2-CB 4.1Å; I110-C114 WeakPolarHBondContact O-CB 3.4Å; I110-C114 PolarHBondContact O-N 3.13Å; C114-V117 HydrophobicContact CB-CB 3.91Å; C114-V117 HydrophobicContact CB-CG1 3.57Å
115	E	81.5	Confident	91.2	Very high	181 Å²	181	53 Å²	53	85%	0.846	25%	0.251	S	S	*	.	S	Bend	trans	-97.5	135.3	165.1	-64.8	178.3	-174	0	0	109.4	V117	E115-V117 PolarHBondContact O-N 2.84Å
116	N	79.3	Confident	91.5	Very high	162 Å²	162	48.1 Å²	48.1	87%	0.866	23%	0.234	S	C	*	.	S	Bend	trans	53.2	41.3	172.3	-61.7	-36.3	0	0	0	116.2
117	V	87.5	Confident	91.7	Very high	10 Å²	10	49.1 Å²	49.1	6%	0.061	24%	0.241	C	C	.	.			trans	-93.2	137.5	177.4	73.8	0	0	0	0	111.9	T85 V88 I110 C114 E115 R119	T85-V117 HydrophobicContact CG2-CG2 4.08Å; V88-V117 HydrophobicContact CG2-CG1 4.33Å; V88-V117 HydrophobicContact CG2-CG2 3.77Å; I110-V117 HydrophobicContact CG2-CG1 3.44Å; I110-V117 VanDerWaalsContact CG2-CG1 3.44Å; C114-V117 HydrophobicContact CB-CB 3.91Å; C114-V117 HydrophobicContact CB-CG1 3.57Å; E115-V117 PolarHBondContact O-N 2.84Å; V117-R119 HydrophobicContact CG1-CG 4.27Å
118	Q	88.5	Confident	91.9	Very high	89 Å²	89	51.1 Å²	51.1	42%	0.416	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	141.9	172.7	-68.6	-64.1	-50.1	0	0	110.9	H86 G87 V88 Y169	H86-Q118 PolarHBondContact O-N 3.35Å; G87-Q118 CarbonylContact C-O 3.59Å; G87-Q118 VanDerWaalsContact CA-O 3.28Å; G87-Q118 WeakPolarHBondContact CA-O 3.41Å; V88-Q118 PolarHBondContact N-O 3.25Å; Q118-Y169 HydrophobicContact CB-CG 4.39Å; Q118-Y169 HydrophobicContact CG-CD1 4.27Å; Q118-Y169 HydrophobicContact CG-CD2 3.35Å; Q118-Y169 HydrophobicContact CG-CE2 3.83Å; Q118-Y169 HydrophobicContact CG-CG 3.58Å
119	R	91.3	Very high	92.1	Very high	56 Å²	56	54.1 Å²	54.1	21%	0.211	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	129.5	-171.4	-56.5	169.6	-160.2	-166.5	-4.4	110	V88 I90 D111 V117 V148 Q149	V88-R119 WeakPolarHBondContact O-CA 3.45Å; I90-R119 HydrophobicContact CD1-CB 4.17Å; D111-R119 IonicContact OD1-CZ 2.65Å; D111-R119 IonicContact OD1-NH1 2.97Å; D111-R119 PolarHBondContact OD1-NH1 3.31Å; D111-R119 IonicContact OD1-NH2 2.77Å; D111-R119 PolarHBondContact OD1-NH2 2.91Å; D111-R119 IonicContact OD2-NH1 2.97Å; V117-R119 HydrophobicContact CG1-CG 4.27Å; R119-V148 HydrophobicContact CB-CB 4.23Å; R119-V148 HydrophobicContact CB-CG1 3.68Å; R119-Q149 PolarHBondContact O-N 3.27Å
120	I	94.4	Very high	92.5	Very high	7 Å²	7	62.8 Å²	62.8	4%	0.036	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	125.5	173.9	-56.6	178.5	0	0	0	108.1	V88 I90 V122 F151 P167	V88-I120 PolarHBondContact O-N 2.97Å; I90-I120 WeakPolarHBondContact CD1-O 3.41Å; I90-I120 PolarHBondContact N-O 3.27Å; I120-V122 HydrophobicContact CG2-CG2 3.9Å; I120-F151 HydrophobicContact CG2-CD2 3.53Å; I120-F151 HydrophobicContact CG2-CE2 3.95Å; I120-P167 HydrophobicContact CD1-CB 4.17Å
121	L	97.4	Very high	92.9	Very high	1 Å²	1	70.9 Å²	70.9	1%	0.005	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	130.1	168.6	-178.4	62.3	0	0	0	109.4	I90 F92 F100 V103 F142 A143 V148 Q149 Y150 F151	I90-L121 HydrophobicContact CB-CD1 4.31Å; I90-L121 HydrophobicContact CG2-CD1 4.31Å; I90-L121 CarbonylContact O-C 3.58Å; F92-L121 HydrophobicContact CD1-CD1 3.68Å; F92-L121 HydrophobicContact CD1-CG 4.21Å; F92-L121 HydrophobicContact CE1-CD1 3.91Å; F92-L121 HydrophobicContact CE1-CD2 4.22Å; F92-L121 HydrophobicContact CE1-CG 3.91Å; F100-L121 HydrophobicContact CE2-CD2 4.49Å; V103-L121 HydrophobicContact CB-CD1 4.44Å; V103-L121 HydrophobicContact CG1-CD1 3.61Å; V103-L121 HydrophobicContact CG2-CD1 3.91Å; L121-F142 HydrophobicContact CD2-CD1 3.76Å; L121-F142 HydrophobicContact CD2-CE1 4.15Å; L121-A143 HydrophobicContact CD2-CB 4.16Å; L121-V148 HydrophobicContact CB-CG2 3.86Å; L121-Q149 PolarHBondContact N-O 3.18Å; L121-Y150 HydrophobicContact CB-CD2 4.18Å; L121-Y150 HydrophobicContact CD2-CD2 3.99Å; L121-Y150 HydrophobicContact CG-CD2 3.88Å; L121-Y150 HydrophobicContact CG-CE2 4.4Å; L121-Y150 WeakPolarHBondContact O-CA 3.45Å; L121-Y150 WeakPolarHBondContact O-CD2 3.47Å; L121-F151 PolarHBondContact O-N 3.31Å
122	V	98.1	Very high	93.2	Very high	0 Å²	0	69.5 Å²	69.5	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	115.9	-177	178	0	0	0	0	110.5	L28 I89 I90 V91 F92 I120 F151 T153 V164	L28-V122 HydrophobicContact CD1-CG1 4.25Å; I89-V122 HydrophobicContact CG2-CB 4.31Å; I89-V122 HydrophobicContact CG2-CG2 3.57Å; I90-V122 PolarHBondContact O-N 3.31Å; V91-V122 WeakPolarHBondContact CA-O 3.28Å; V91-V122 HydrophobicContact CG1-CG1 4.47Å; V91-V122 HydrophobicContact CG2-CB 4.34Å; F92-V122 VanDerWaalsContact CD1-O 3.3Å; F92-V122 WeakPolarHBondContact CD1-O 3.18Å; F92-V122 PolarHBondContact N-O 3.04Å; I120-V122 HydrophobicContact CG2-CG2 3.9Å; V122-F151 CarbonylContact C-O 3.56Å; V122-F151 VanDerWaalsContact CA-O 3.3Å; V122-F151 WeakPolarHBondContact CA-O 3.32Å; V122-T153 HydrophobicContact CG1-CG2 3.59Å; V122-T153 WeakPolarHBondContact CG1-OG1 3.44Å; V122-V164 HydrophobicContact CG2-CB 4.08Å; V122-V164 HydrophobicContact CG2-CG1 3.85Å
123	G	98.6	Very high	93.7	Very high	0 Å²	0	67.6 Å²	67.6	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	98.6	167.6	0	0	0	0	0	110.2	F92 F151 E152 T153	F92-G123 VanDerWaalsContact CE1-CA 3.46Å; F92-G123 VanDerWaalsContact CZ-CA 3.45Å; G123-F151 PolarHBondContact N-O 3.23Å; G123-E152 CarbonylContact O-C 3.48Å; G123-E152 VanDerWaalsContact O-CA 3.25Å; G123-E152 WeakPolarHBondContact O-CA 3.36Å; G123-T153 PolarHBondContact O-N 3.33Å
124	N	98.5	Very high	94.2	Very high	3 Å²	3	65.6 Å²	65.6	2%	0.016	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	165.3	-179.2	-172.9	36	0	0	0	112.1	V23 L28 V91 F92 V94 C126 T153 A155	V23-N124 PolarHBondContact O-ND2 3.41Å; L28-N124 HydrophobicContact CD1-CB 4.3Å; V91-N124 HydrophobicContact CG1-CB 3.8Å; F92-N124 PolarHBondContact O-N 2.78Å; V94-N124 WeakPolarHBondContact CG1-O 3.46Å; V94-N124 WeakPolarHBondContact CG2-O 3.28Å; V94-N124 PolarHBondContact N-O 2.81Å; N124-C126 VanDerWaalsContact C-N 3.34Å; N124-T153 CarbonylContact C-O 3.6Å; N124-T153 WeakPolarHBondContact CA-O 3.47Å; N124-T153 WeakPolarHBondContact CA-OG1 3.28Å; N124-T153 PolarHBondContact OD1-O 2.8Å; N124-T153 PolarHBondContact OD1-OG1 3.08Å; N124-A155 PolarHBondContact OD1-N 3.3Å
125	K	97.8	Very high	94.8	Very high	49 Å²	49	69.3 Å²	69.3	21%	0.213	33%	0.326	C	S	.	.			trans	65.5	32.4	-176.4	-46.1	-172.4	-163.7	165.1	0	113.4	G22 D93 V94 D127 E128 T153	G22-K125 WeakPolarHBondContact O-CE 3.42Å; G22-K125 PolarHBondContact O-NZ 2.85Å; D93-K125 WeakPolarHBondContact OD1-CD 3.31Å; D93-K125 WeakPolarHBondContact OD2-CD 3.34Å; D93-K125 VanDerWaalsContact OD2-CE 3.31Å; D93-K125 WeakPolarHBondContact OD2-CE 3.38Å; D93-K125 IonicContact OD2-NZ 2.67Å; D93-K125 PolarHBondContact OD2-NZ 2.73Å; V94-K125 VanDerWaalsContact CG2-O 3.31Å; V94-K125 WeakPolarHBondContact CG2-O 3.32Å; K125-D127 WeakPolarHBondContact CA-OD1 2.91Å; K125-D127 PolarHBondContact O-N 2.85Å; K125-E128 HydrophobicContact CB-CG 4.47Å; K125-E128 PolarHBondContact O-N 3.09Å; K125-T153 PolarHBondContact N-O 3.49Å
126	C	98.1	Very high	95.5	Very high	10 Å²	10	66.1 Å²	66.1	7%	0.068	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-11	178.7	69.5	0	0	0	0	114	N124 E128 E152 T153	N124-C126 VanDerWaalsContact C-N 3.34Å; C126-E128 VanDerWaalsContact C-N 3.32Å; C126-E152 HydrophobicContact CB-CB 3.95Å; C126-T153 PolarHBondContact N-O 3.44Å; C126-T153 VanDerWaalsContact N-O 3.11Å; C126-T153 PolarHBondContact SG-O 3.26Å
127	D	97.7	Very high	96.4	Very high	40 Å²	40	61.8 Å²	61.8	21%	0.214	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-24.5	168.8	62.1	-77.4	0	0	0	113.5	K125 K129 S154 K156 E157	K125-D127 WeakPolarHBondContact CA-OD1 2.91Å; K125-D127 PolarHBondContact O-N 2.85Å; D127-K129 PolarHBondContact O-N 2.78Å; D127-S154 VanDerWaalsContact CG-OG 3.23Å; D127-S154 VanDerWaalsContact OD1-CB 3.25Å; D127-S154 WeakPolarHBondContact OD1-CB 3.3Å; D127-S154 PolarHBondContact OD1-OG 3.28Å; D127-K156 WeakPolarHBondContact OD2-CD 3.32Å; D127-K156 IonicContact OD2-NZ 3.36Å; D127-E157 HydrophobicContact CB-CG 3.59Å
128	E	96.9	Very high	96.9	Very high	55 Å²	55	64.5 Å²	64.5	26%	0.257	30%	0.304	S	S	.	.			trans	-80.1	57	177.7	-65.1	-161.4	-148.2	0	0	112.2	T95 K125 C126 E130 R131 R132	T95-E128 HydrophobicContact CG2-CB 3.63Å; T95-E128 HydrophobicContact CG2-CG 4.47Å; K125-E128 HydrophobicContact CB-CG 4.47Å; K125-E128 PolarHBondContact O-N 3.09Å; C126-E128 VanDerWaalsContact C-N 3.32Å; E128-E130 VanDerWaalsContact C-N 3.28Å; E128-E130 PolarHBondContact O-N 3.29Å; E128-R131 HydrophobicContact CB-CB 4.35Å; E128-R131 PolarHBondContact O-N 2.92Å; E128-R131 WeakPolarHBondContact OE2-CD 3.2Å; E128-R131 IonicContact OE2-CZ 2.78Å; E128-R131 IonicContact OE2-NE 3.83Å; E128-R131 IonicContact OE2-NH1 3.1Å; E128-R131 PolarHBondContact OE2-NH1 3.31Å; E128-R132 PolarHBondContact O-N 3.26Å; E128-R132 VanDerWaalsContact O-N 3.1Å
129	K	96.3	Very high	97.4	Very high	169 Å²	169	60.2 Å²	60.2	74%	0.735	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	-39.2	-173.6	-64.3	179.8	-176.8	176.7	0	114	D127 R131	D127-K129 PolarHBondContact O-N 2.78Å; K129-R131 VanDerWaalsContact C-N 3.32Å; K129-R131 PolarHBondContact O-N 2.72Å
130	E	97.6	Very high	97.7	Very high	200 Å²	200	60.9 Å²	60.9	94%	0.935	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-23.4	-178	-62.6	-178.9	177	0	0	113.4	E128	E128-E130 VanDerWaalsContact C-N 3.28Å; E128-E130 PolarHBondContact O-N 3.29Å
131	R	97.7	Very high	97.9	Very high	170 Å²	170	67.3 Å²	67.3	64%	0.642	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.8	-2.9	-179.1	-69.4	168.9	172.1	-173.6	0.4	112.9	T95 E128 K129 V133	T95-R131 WeakPolarHBondContact CA-O 3.34Å; T95-R131 VanDerWaalsContact CB-O 3.27Å; T95-R131 WeakPolarHBondContact CB-O 3.35Å; T95-R131 HydrophobicContact CG2-CB 3.72Å; E128-R131 HydrophobicContact CB-CB 4.35Å; E128-R131 PolarHBondContact O-N 2.92Å; E128-R131 WeakPolarHBondContact OE2-CD 3.2Å; E128-R131 IonicContact OE2-CZ 2.78Å; E128-R131 IonicContact OE2-NE 3.83Å; E128-R131 IonicContact OE2-NH1 3.1Å; E128-R131 PolarHBondContact OE2-NH1 3.31Å; K129-R131 VanDerWaalsContact C-N 3.32Å; K129-R131 PolarHBondContact O-N 2.72Å; R131-V133 PolarHBondContact O-N 2.9Å
132	R	98.5	Very high	98	Very high	61 Å²	61	68.1 Å²	68.1	23%	0.23	32%	0.317	C	S	.	.			trans	-56.9	127.8	177.8	176	-178.2	-72	-108.8	9	110	E128 V134 E152	E128-R132 PolarHBondContact O-N 3.26Å; E128-R132 VanDerWaalsContact O-N 3.1Å; R132-V134 WeakPolarHBondContact CD-O 3.09Å; R132-V134 VanDerWaalsContact CG-O 3.26Å; R132-V134 WeakPolarHBondContact CG-O 3.27Å; R132-V134 PolarHBondContact NH1-O 3.01Å; R132-E152 IonicContact CZ-OE1 3.53Å; R132-E152 IonicContact CZ-OE2 3.53Å; R132-E152 IonicContact NH1-OE1 2.72Å; R132-E152 PolarHBondContact NH1-OE1 3.2Å; R132-E152 IonicContact NH1-OE2 3.5Å; R132-E152 IonicContact NH2-OE1 3.58Å; R132-E152 PolarHBondContact NH2-OE1 3.22Å; R132-E152 IonicContact NH2-OE2 2.72Å; R132-E152 PolarHBondContact NH2-OE2 3.07Å
133	V	98.4	Very high	97.9	Very high	89 Å²	89	68.1 Å²	68.1	54%	0.539	32%	0.317	S	S	.	.			trans	-117.9	-22.1	172.7	-57.6	0	0	0	0	112	V94 T95 G97 R131	V94-V133 PolarHBondContact O-N 2.86Å; T95-V133 VanDerWaalsContact C-CG2 3.46Å; T95-V133 WeakPolarHBondContact O-CG2 3.17Å; G97-V133 VanDerWaalsContact N-CG2 3.32Å; R131-V133 PolarHBondContact O-N 2.9Å
134	V	98.3	Very high	97.9	Very high	9 Å²	9	73.1 Å²	73.1	6%	0.055	34%	0.344	C	S	.	.	S	Bend	trans	-96.6	112.6	174.6	-172.4	0	0	0	0	109	F92 V94 F100 R132 A139	F92-V134 HydrophobicContact CE2-CB 4.02Å; F92-V134 HydrophobicContact CE2-CG1 3.78Å; F92-V134 HydrophobicContact CE2-CG2 4.21Å; F92-V134 HydrophobicContact CZ-CG1 4.23Å; V94-V134 PolarHBondContact O-N 3.33Å; F100-V134 HydrophobicContact CB-CG1 4.29Å; F100-V134 HydrophobicContact CB-CG2 3.73Å; F100-V134 HydrophobicContact CD1-CG1 3.88Å; F100-V134 HydrophobicContact CD1-CG2 4.39Å; F100-V134 HydrophobicContact CD2-CG1 4.02Å; F100-V134 HydrophobicContact CE1-CG1 4.18Å; F100-V134 HydrophobicContact CE2-CG1 4.32Å; F100-V134 HydrophobicContact CG-CG1 3.79Å; F100-V134 HydrophobicContact CG-CG2 4.13Å; F100-V134 HydrophobicContact CZ-CG1 4.39Å; R132-V134 WeakPolarHBondContact CD-O 3.09Å; R132-V134 VanDerWaalsContact CG-O 3.26Å; R132-V134 WeakPolarHBondContact CG-O 3.27Å; R132-V134 PolarHBondContact NH1-O 3.01Å; V134-A139 HydrophobicContact CG1-CB 4.17Å
135	L	97.8	Very high	97.8	Very high	94 Å²	94	80.7 Å²	80.7	49%	0.492	38%	0.379	S	S	.	.			trans	-71.9	140.3	177.7	-58.7	-179.7	0	0	0	110.2	V137 D138 A139	L135-V137 HydrophobicContact CB-CG1 3.99Å; L135-V137 HydrophobicContact CD1-CG1 4.5Å; L135-V137 PolarHBondContact O-N 3.33Å; L135-D138 PolarHBondContact O-N 2.98Å; L135-A139 PolarHBondContact O-N 2.55Å; L135-A139 VanDerWaalsContact O-N 3.09Å
136	Q	97.7	Very high	97.6	Very high	114 Å²	114	80.6 Å²	80.6	53%	0.533	38%	0.382	S	S	.	.	H	α-helix	trans	-54.6	-38.2	177.7	-171.2	178.6	9.1	0	0	111.9	D138 Q140 Y150 E152	Q136-D138 PolarHBondContact O-N 2.93Å; Q136-Q140 VanDerWaalsContact O-CB 3.3Å; Q136-Q140 WeakPolarHBondContact O-CB 3.45Å; Q136-Q140 PolarHBondContact O-N 3.17Å; Q136-Y150 HydrophobicContact CG-CE1 3.96Å; Q136-E152 VanDerWaalsContact CB-OE1 3.31Å; Q136-E152 WeakPolarHBondContact CB-OE1 3.48Å; Q136-E152 WeakPolarHBondContact CG-OE1 3.25Å
137	V	98	Very high	97.3	Very high	72 Å²	72	87.5 Å²	87.5	44%	0.436	42%	0.419	S	S	.	.	H	α-helix	trans	-65.3	-36.7	178.8	66.2	0	0	0	0	112.8	L135 R141	L135-V137 HydrophobicContact CB-CG1 3.99Å; L135-V137 HydrophobicContact CD1-CG1 4.5Å; L135-V137 PolarHBondContact O-N 3.33Å; V137-R141 WeakPolarHBondContact O-CB 3.45Å; V137-R141 WeakPolarHBondContact O-CG 3.48Å; V137-R141 PolarHBondContact O-N 2.87Å
138	D	98	Very high	97.1	Very high	66 Å²	66	86.1 Å²	86.1	35%	0.353	41%	0.412	S	S	.	.	H	α-helix	trans	-76.4	-39.2	-179.1	-64.9	-34.3	0	0	0	110.7	L135 Q136 R141 F142	L135-D138 PolarHBondContact O-N 2.98Å; Q136-D138 PolarHBondContact O-N 2.93Å; D138-R141 PolarHBondContact O-N 2.77Å; D138-R141 IonicContact OD1-NH1 3.52Å; D138-F142 WeakPolarHBondContact O-CB 3.48Å; D138-F142 PolarHBondContact O-N 3.31Å
139	A	98.3	Very high	96.9	Very high	0 Å²	0	87.9 Å²	87.9	0%	0	42%	0.42	C	S	.	.	H	α-helix	trans	-63.3	-42.8	172	0	0	0	0	0	112.2	F92 F100 V134 L135 F142 A143 Y150	F92-A139 HydrophobicContact CZ-CB 3.88Å; F100-A139 HydrophobicContact CE2-CB 3.92Å; F100-A139 HydrophobicContact CZ-CB 4.24Å; V134-A139 HydrophobicContact CG1-CB 4.17Å; L135-A139 PolarHBondContact O-N 2.55Å; L135-A139 VanDerWaalsContact O-N 3.09Å; A139-F142 PolarHBondContact O-N 3.01Å; A139-A143 WeakPolarHBondContact O-CB 3.06Å; A139-A143 PolarHBondContact O-N 2.84Å; A139-Y150 HydrophobicContact CB-CD1 4.45Å; A139-Y150 HydrophobicContact CB-CD2 4.43Å; A139-Y150 HydrophobicContact CB-CE1 3.76Å; A139-Y150 HydrophobicContact CB-CE2 3.76Å; A139-Y150 WeakPolarHBondContact CB-OH 3.49Å
140	Q	98.4	Very high	96.9	Very high	69 Å²	69	80.6 Å²	80.6	32%	0.322	39%	0.388	S	S	.	.	H	α-helix	trans	-62.3	-47.6	175.4	-175.7	64.7	60.3	0	0	111.5	Q136 F142 A143 D144 Y150	Q136-Q140 VanDerWaalsContact O-CB 3.3Å; Q136-Q140 WeakPolarHBondContact O-CB 3.45Å; Q136-Q140 PolarHBondContact O-N 3.17Å; Q140-F142 VanDerWaalsContact C-N 3.28Å; Q140-F142 PolarHBondContact O-N 3.11Å; Q140-A143 WeakPolarHBondContact O-CB 3.49Å; Q140-A143 PolarHBondContact O-N 2.92Å; Q140-A143 VanDerWaalsContact O-N 3.08Å; Q140-D144 PolarHBondContact NE2-OD1 2.99Å; Q140-D144 PolarHBondContact O-N 3.33Å; Q140-Y150 HydrophobicContact CB-CD1 4.12Å
141	R	98.4	Very high	96.8	Very high	143 Å²	143	73.4 Å²	73.4	54%	0.54	35%	0.354	S	S	.	.	H	α-helix	trans	-57.8	-42.6	176.7	-77.4	169.6	178.8	169.4	-2	112.1	V137 D138 A143 D144 Q145	V137-R141 WeakPolarHBondContact O-CB 3.45Å; V137-R141 WeakPolarHBondContact O-CG 3.48Å; V137-R141 PolarHBondContact O-N 2.87Å; D138-R141 PolarHBondContact O-N 2.77Å; D138-R141 IonicContact OD1-NH1 3.52Å; R141-A143 VanDerWaalsContact C-N 3.33Å; R141-D144 PolarHBondContact O-N 3.03Å; R141-Q145 WeakPolarHBondContact O-CB 3.35Å; R141-Q145 VanDerWaalsContact O-CG 3.25Å; R141-Q145 WeakPolarHBondContact O-CG 3.4Å; R141-Q145 PolarHBondContact O-N 2.88Å
142	F	98.3	Very high	96.8	Very high	18 Å²	18	66.2 Å²	66.2	8%	0.079	33%	0.327	C	S	.	.	H	α-helix	trans	-63.1	-41.7	176	174	-93.5	0	0	0	111.7	F100 V103 K104 L107 L121 D138 A139 Q140 Q145 T146	F100-F142 HydrophobicContact CE2-CB 4.35Å; F100-F142 HydrophobicContact CE2-CD1 4.14Å; F100-F142 HydrophobicContact CE2-CG 4.31Å; F100-F142 HydrophobicContact CZ-CB 3.74Å; F100-F142 HydrophobicContact CZ-CD1 4.25Å; F100-F142 AromaticContact CZ-CG 3.95Å; F100-F142 HydrophobicContact CZ-CG 3.95Å; V103-F142 HydrophobicContact CB-CE1 4.27Å; V103-F142 HydrophobicContact CB-CZ 4.44Å; V103-F142 HydrophobicContact CG1-CE1 3.48Å; V103-F142 VanDerWaalsContact CG1-CE1 3.48Å; V103-F142 HydrophobicContact CG1-CZ 3.91Å; K104-F142 HydrophobicContact CD-CE2 4.28Å; K104-F142 HydrophobicContact CG-CE2 3.65Å; K104-F142 HydrophobicContact CG-CZ 3.81Å; L107-F142 HydrophobicContact CD1-CE1 3.95Å; L107-F142 HydrophobicContact CD1-CZ 3.75Å; L121-F142 HydrophobicContact CD2-CD1 3.76Å; L121-F142 HydrophobicContact CD2-CE1 4.15Å; D138-F142 WeakPolarHBondContact O-CB 3.48Å; D138-F142 PolarHBondContact O-N 3.31Å; A139-F142 PolarHBondContact O-N 3.01Å; Q140-F142 VanDerWaalsContact C-N 3.28Å; Q140-F142 PolarHBondContact O-N 3.11Å; F142-Q145 PolarHBondContact O-N 3.01Å; F142-T146 HydrophobicContact CD2-CG2 4.44Å; F142-T146 HydrophobicContact CE1-CG2 4.2Å; F142-T146 HydrophobicContact CE2-CG2 3.92Å; F142-T146 HydrophobicContact CZ-CG2 3.8Å; F142-T146 PolarHBondContact O-N 2.96Å; F142-T146 PolarHBondContact O-OG1 3Å
143	A	97.6	Very high	96.8	Very high	0 Å²	0	63.3 Å²	63.3	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-63.2	-44.4	178	0	0	0	0	0	112	L121 A139 Q140 R141 Q145 T146 N147 V148 Y150	L121-A143 HydrophobicContact CD2-CB 4.16Å; A139-A143 WeakPolarHBondContact O-CB 3.06Å; A139-A143 PolarHBondContact O-N 2.84Å; Q140-A143 WeakPolarHBondContact O-CB 3.49Å; Q140-A143 PolarHBondContact O-N 2.92Å; Q140-A143 VanDerWaalsContact O-N 3.08Å; R141-A143 VanDerWaalsContact C-N 3.33Å; A143-Q145 PolarHBondContact O-N 2.99Å; A143-T146 CarbonylContact O-C 3.5Å; A143-T146 PolarHBondContact O-N 2.76Å; A143-T146 PolarHBondContact O-OG1 2.69Å; A143-N147 PolarHBondContact O-N 3.26Å; A143-V148 CarbonylContact C-O 3.52Å; A143-V148 HydrophobicContact CB-CG2 3.89Å; A143-V148 WeakPolarHBondContact CB-O 3.21Å; A143-V148 PolarHBondContact O-N 3.46Å; A143-Y150 HydrophobicContact CB-CG 4.4Å
144	D	97.1	Very high	96.8	Very high	104 Å²	104	59 Å²	59	56%	0.556	29%	0.291	S	S	*	.	H	α-helix	trans	-61	-44.3	176	-60.6	-21.4	0	0	0	111.2	Q140 R141 T146 N147	Q140-D144 PolarHBondContact NE2-OD1 2.99Å; Q140-D144 PolarHBondContact O-N 3.33Å; R141-D144 PolarHBondContact O-N 3.03Å; D144-T146 VanDerWaalsContact C-N 3.25Å; D144-T146 PolarHBondContact O-N 2.9Å; D144-N147 PolarHBondContact O-N 3.34Å
145	Q	97	Very high	96.8	Very high	163 Å²	163	58.8 Å²	58.8	76%	0.762	29%	0.289	S	S	*	.	H	α-helix	trans	-64.1	-29.2	177.6	-75.5	174.4	-4.9	0	0	113.5	R141 F142 A143	R141-Q145 WeakPolarHBondContact O-CB 3.35Å; R141-Q145 VanDerWaalsContact O-CG 3.25Å; R141-Q145 WeakPolarHBondContact O-CG 3.4Å; R141-Q145 PolarHBondContact O-N 2.88Å; F142-Q145 PolarHBondContact O-N 3.01Å; A143-Q145 PolarHBondContact O-N 2.99Å
146	T	94.4	Very high	96.7	Very high	46 Å²	46	59.1 Å²	59.1	28%	0.282	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.3	5.2	-178.6	53.4	0	0	0	0	112.9	L107 F142 A143 D144 V148	L107-T146 HydrophobicContact CD1-CG2 3.98Å; F142-T146 HydrophobicContact CD2-CG2 4.44Å; F142-T146 HydrophobicContact CE1-CG2 4.2Å; F142-T146 HydrophobicContact CE2-CG2 3.92Å; F142-T146 HydrophobicContact CZ-CG2 3.8Å; F142-T146 PolarHBondContact O-N 2.96Å; F142-T146 PolarHBondContact O-OG1 3Å; A143-T146 CarbonylContact O-C 3.5Å; A143-T146 PolarHBondContact O-N 2.76Å; A143-T146 PolarHBondContact O-OG1 2.69Å; D144-T146 VanDerWaalsContact C-N 3.25Å; D144-T146 PolarHBondContact O-N 2.9Å; T146-V148 VanDerWaalsContact C-N 3.26Å; T146-V148 PolarHBondContact O-N 2.94Å; T146-V148 WeakPolarHBondContact OG1-CG2 3.4Å
147	N	91.5	Very high	96.7	Very high	156 Å²	156	59.2 Å²	59.2	83%	0.834	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.2	44	-178.2	-167.8	41.4	0	0	0	112.9	A143 D144	A143-N147 PolarHBondContact O-N 3.26Å; D144-N147 PolarHBondContact O-N 3.34Å
148	V	92.7	Very high	96.6	Very high	10 Å²	10	59.2 Å²	59.2	6%	0.061	29%	0.285	C	S	.	.			trans	-117.1	146.3	173.4	-56.2	0	0	0	0	109.5	L107 R119 L121 A143 T146	L107-V148 HydrophobicContact CD2-CG1 4.02Å; R119-V148 HydrophobicContact CB-CB 4.23Å; R119-V148 HydrophobicContact CB-CG1 3.68Å; L121-V148 HydrophobicContact CB-CG2 3.86Å; A143-V148 CarbonylContact C-O 3.52Å; A143-V148 HydrophobicContact CB-CG2 3.89Å; A143-V148 WeakPolarHBondContact CB-O 3.21Å; A143-V148 PolarHBondContact O-N 3.46Å; T146-V148 VanDerWaalsContact C-N 3.26Å; T146-V148 PolarHBondContact O-N 2.94Å; T146-V148 WeakPolarHBondContact OG1-CG2 3.4Å
149	Q	92.1	Very high	96.6	Very high	93 Å²	93	60 Å²	60	44%	0.435	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	145.5	174.3	-63.2	-173.4	-53.5	0	0	109.9	R119 L121 F151	R119-Q149 PolarHBondContact O-N 3.27Å; L121-Q149 PolarHBondContact N-O 3.18Å; Q149-F151 HydrophobicContact CB-CE2 3.91Å
150	Y	96.1	Very high	96.4	Very high	16 Å²	16	62.5 Å²	62.5	6%	0.063	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	135.4	178.7	178.2	-122.9	0	0	0	112.1	F92 L121 Q136 A139 Q140 A143 E152	F92-Y150 AromaticContact CE1-CE2 3.78Å; F92-Y150 HydrophobicContact CE1-CE2 3.78Å; F92-Y150 AromaticContact CZ-CE2 3.9Å; F92-Y150 HydrophobicContact CZ-CE2 3.9Å; L121-Y150 HydrophobicContact CB-CD2 4.18Å; L121-Y150 HydrophobicContact CD2-CD2 3.99Å; L121-Y150 HydrophobicContact CG-CD2 3.88Å; L121-Y150 HydrophobicContact CG-CE2 4.4Å; L121-Y150 WeakPolarHBondContact O-CA 3.45Å; L121-Y150 WeakPolarHBondContact O-CD2 3.47Å; Q136-Y150 HydrophobicContact CG-CE1 3.96Å; A139-Y150 HydrophobicContact CB-CD1 4.45Å; A139-Y150 HydrophobicContact CB-CD2 4.43Å; A139-Y150 HydrophobicContact CB-CE1 3.76Å; A139-Y150 HydrophobicContact CB-CE2 3.76Å; A139-Y150 WeakPolarHBondContact CB-OH 3.49Å; Q140-Y150 HydrophobicContact CB-CD1 4.12Å; A143-Y150 HydrophobicContact CB-CG 4.4Å; Y150-E152 HydrophobicContact CE1-CG 3.98Å; Y150-E152 HydrophobicContact CE2-CG 4.4Å; Y150-E152 WeakPolarHBondContact OH-CG 3.38Å; Y150-E152 PolarHBondContact OH-OE1 3.33Å
151	F	97	Very high	96.3	Very high	48 Å²	48	59.2 Å²	59.2	21%	0.211	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	148.9	171.1	-62	-94.1	0	0	0	110	I120 L121 V122 G123 Q149 V164 W168	I120-F151 HydrophobicContact CG2-CD2 3.53Å; I120-F151 HydrophobicContact CG2-CE2 3.95Å; L121-F151 PolarHBondContact O-N 3.31Å; V122-F151 CarbonylContact C-O 3.56Å; V122-F151 VanDerWaalsContact CA-O 3.3Å; V122-F151 WeakPolarHBondContact CA-O 3.32Å; G123-F151 PolarHBondContact N-O 3.23Å; Q149-F151 HydrophobicContact CB-CE2 3.91Å; F151-V164 HydrophobicContact CB-CG1 3.67Å; F151-V164 HydrophobicContact CD2-CG1 4.3Å; F151-V164 HydrophobicContact CG-CG1 4.01Å; F151-W168 AromaticContact CZ-NE1 3.99Å
152	E	98.2	Very high	95.9	Very high	19 Å²	19	56.7 Å²	56.7	9%	0.089	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	141.1	165.6	-70.4	-166.2	172.1	0	0	110.3	G123 C126 R132 Q136 Y150 N160	G123-E152 CarbonylContact O-C 3.48Å; G123-E152 VanDerWaalsContact O-CA 3.25Å; G123-E152 WeakPolarHBondContact O-CA 3.36Å; C126-E152 HydrophobicContact CB-CB 3.95Å; R132-E152 IonicContact CZ-OE1 3.53Å; R132-E152 IonicContact CZ-OE2 3.53Å; R132-E152 IonicContact NH1-OE1 2.72Å; R132-E152 PolarHBondContact NH1-OE1 3.2Å; R132-E152 IonicContact NH1-OE2 3.5Å; R132-E152 IonicContact NH2-OE1 3.58Å; R132-E152 PolarHBondContact NH2-OE1 3.22Å; R132-E152 IonicContact NH2-OE2 2.72Å; R132-E152 PolarHBondContact NH2-OE2 3.07Å; Q136-E152 VanDerWaalsContact CB-OE1 3.31Å; Q136-E152 WeakPolarHBondContact CB-OE1 3.48Å; Q136-E152 WeakPolarHBondContact CG-OE1 3.25Å; Y150-E152 HydrophobicContact CE1-CG 3.98Å; Y150-E152 HydrophobicContact CE2-CG 4.4Å; Y150-E152 WeakPolarHBondContact OH-CG 3.38Å; Y150-E152 PolarHBondContact OH-OE1 3.33Å; E152-N160 VanDerWaalsContact O-CB 3.3Å; E152-N160 WeakPolarHBondContact O-CB 3.5Å; E152-N160 PolarHBondContact O-ND2 2.96Å
153	T	98.3	Very high	95.5	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	30%	0.298	C	S	.	.			trans	-132.6	157.8	-178.3	56.7	0	0	0	0	111.6	L28 V122 G123 N124 K125 C126 L159 N160 V164	L28-T153 HydrophobicContact CD2-CG2 4.46Å; V122-T153 HydrophobicContact CG1-CG2 3.59Å; V122-T153 WeakPolarHBondContact CG1-OG1 3.44Å; G123-T153 PolarHBondContact O-N 3.33Å; N124-T153 CarbonylContact C-O 3.6Å; N124-T153 WeakPolarHBondContact CA-O 3.47Å; N124-T153 WeakPolarHBondContact CA-OG1 3.28Å; N124-T153 PolarHBondContact OD1-O 2.8Å; N124-T153 PolarHBondContact OD1-OG1 3.08Å; K125-T153 PolarHBondContact N-O 3.49Å; C126-T153 PolarHBondContact N-O 3.44Å; C126-T153 VanDerWaalsContact N-O 3.11Å; C126-T153 PolarHBondContact SG-O 3.26Å; T153-L159 VanDerWaalsContact CA-O 3.28Å; T153-L159 WeakPolarHBondContact CA-O 3.44Å; T153-L159 WeakPolarHBondContact CB-O 3.46Å; T153-N160 HydrophobicContact CG2-CB 3.91Å; T153-V164 HydrophobicContact CG2-CB 4.39Å; T153-V164 HydrophobicContact CG2-CG1 3.6Å; T153-V164 HydrophobicContact CG2-CG2 3.88Å
154	S	98.1	Very high	95.2	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	30%	0.298	C	S	.	.	B	Isolated β-bridge	trans	-132.7	108.4	162.8	176.3	0	0	0	0	108.8	D127 K156 E157 N158 L159	D127-S154 VanDerWaalsContact CG-OG 3.23Å; D127-S154 VanDerWaalsContact OD1-CB 3.25Å; D127-S154 WeakPolarHBondContact OD1-CB 3.3Å; D127-S154 PolarHBondContact OD1-OG 3.28Å; S154-K156 PolarHBondContact O-N 2.76Å; S154-K156 PolarHBondContact OG-N 3.29Å; S154-E157 PolarHBondContact OG-N 3.31Å; S154-N158 CarbonylContact O-C 3.54Å; S154-N158 VanDerWaalsContact O-CA 3.27Å; S154-N158 WeakPolarHBondContact O-CA 3.3Å; S154-N158 PolarHBondContact O-N 2.96Å; S154-L159 PolarHBondContact N-O 3.06Å; S154-L159 PolarHBondContact O-N 2.9Å
155	A	96.8	Very high	94.6	Very high	3 Å²	3	55.4 Å²	55.4	3%	0.025	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-32.3	170.3	0	0	0	0	0	112.1	L28 R31 F37 N124	L28-A155 HydrophobicContact CD2-CB 3.9Å; L28-A155 HydrophobicContact CG-CB 4.16Å; R31-A155 PolarHBondContact NE-O 2.76Å; F37-A155 HydrophobicContact CD2-CB 4.16Å; F37-A155 HydrophobicContact CE2-CB 4.25Å; N124-A155 PolarHBondContact OD1-N 3.3Å
156	K	96.9	Very high	94	Very high	101 Å²	101	49.2 Å²	49.2	44%	0.439	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-56.7	-179.7	-178.8	-172.4	166.6	-155.6	0	111.1	R31 F37 D127 S154 N158	R31-K156 PolarHBondContact NH2-O 3.34Å; R31-K156 VanDerWaalsContact NH2-O 3.11Å; F37-K156 HydrophobicContact CD1-CB 4.35Å; F37-K156 HydrophobicContact CD1-CG 4.18Å; F37-K156 HydrophobicContact CD2-CB 4.26Å; F37-K156 HydrophobicContact CE1-CB 3.95Å; F37-K156 HydrophobicContact CE1-CD 4.47Å; F37-K156 HydrophobicContact CE1-CG 3.75Å; F37-K156 HydrophobicContact CE2-CB 3.84Å; F37-K156 HydrophobicContact CZ-CB 3.67Å; F37-K156 HydrophobicContact CZ-CG 3.97Å; D127-K156 WeakPolarHBondContact OD2-CD 3.32Å; D127-K156 IonicContact OD2-NZ 3.36Å; S154-K156 PolarHBondContact O-N 2.76Å; S154-K156 PolarHBondContact OG-N 3.29Å; K156-N158 PolarHBondContact O-N 3.06Å
157	E	97.1	Very high	92.7	Very high	116 Å²	116	47.3 Å²	47.3	54%	0.542	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	3	-177.8	-54.7	-57.2	142.2	0	0	113	D127 S154 L159	D127-E157 HydrophobicContact CB-CG 3.59Å; S154-E157 PolarHBondContact OG-N 3.31Å; E157-L159 VanDerWaalsContact C-N 3.25Å; E157-L159 PolarHBondContact O-N 2.95Å
158	N	96.4	Very high	91.5	Very high	72 Å²	72	45.5 Å²	45.5	39%	0.385	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.3	38.6	-174.8	-167.2	38.6	0	0	0	113.4	R31 S154 K156	R31-N158 VanDerWaalsContact CD-OD1 3.3Å; R31-N158 WeakPolarHBondContact CD-OD1 3.35Å; R31-N158 HydrophobicContact CG-CB 4.3Å; R31-N158 WeakPolarHBondContact CG-OD1 3.31Å; S154-N158 CarbonylContact O-C 3.54Å; S154-N158 VanDerWaalsContact O-CA 3.27Å; S154-N158 WeakPolarHBondContact O-CA 3.3Å; S154-N158 PolarHBondContact O-N 2.96Å; K156-N158 PolarHBondContact O-N 3.06Å
159	L	97.5	Very high	90.1	Very high	84 Å²	84	48 Å²	48	44%	0.44	22%	0.223	S	C	.	.	B	Isolated β-bridge	trans	-90.5	126.3	179.5	-177.8	63.4	0	0	0	110.7	T153 S154 E157 V161	T153-L159 VanDerWaalsContact CA-O 3.28Å; T153-L159 WeakPolarHBondContact CA-O 3.44Å; T153-L159 WeakPolarHBondContact CB-O 3.46Å; S154-L159 PolarHBondContact N-O 3.06Å; S154-L159 PolarHBondContact O-N 2.9Å; E157-L159 VanDerWaalsContact C-N 3.25Å; E157-L159 PolarHBondContact O-N 2.95Å; L159-V161 PolarHBondContact O-N 2.68Å; L159-V161 VanDerWaalsContact O-N 3.13Å
160	N	95.2	Very high	88.8	Confident	52 Å²	52	43.6 Å²	43.6	28%	0.278	20%	0.202	S	C	.	.	S	Bend	trans	58.4	16.2	176.8	-63.7	-25.9	0	0	0	115.3	E152 T153 E163 V164	E152-N160 VanDerWaalsContact O-CB 3.3Å; E152-N160 WeakPolarHBondContact O-CB 3.5Å; E152-N160 PolarHBondContact O-ND2 2.96Å; T153-N160 HydrophobicContact CG2-CB 3.91Å; N160-E163 WeakPolarHBondContact CA-OE2 3.45Å; N160-V164 WeakPolarHBondContact O-CG1 3.49Å; N160-V164 WeakPolarHBondContact O-CG2 3.25Å; N160-V164 PolarHBondContact O-N 2.92Å
161	V	94.8	Very high	87.3	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-71.5	-41.1	-173.4	178.9	0	0	0	0	111.6	L28 R31 F32 L159 V164 C165	L28-V161 HydrophobicContact CD2-CG1 4.42Å; L28-V161 HydrophobicContact CD2-CG2 3.89Å; R31-V161 HydrophobicContact CB-CG1 4.17Å; R31-V161 HydrophobicContact CG-CB 4.21Å; R31-V161 HydrophobicContact CG-CG1 3.88Å; R31-V161 HydrophobicContact CG-CG2 3.94Å; F32-V161 HydrophobicContact CB-CG1 3.8Å; L159-V161 PolarHBondContact O-N 2.68Å; L159-V161 VanDerWaalsContact O-N 3.13Å; V161-V164 WeakPolarHBondContact O-CG2 3.3Å; V161-C165 WeakPolarHBondContact O-CB 3.44Å; V161-C165 PolarHBondContact O-N 3.09Å
162	E	91.9	Very high	85.9	Confident	89 Å²	89	47.1 Å²	47.1	42%	0.416	22%	0.223	S	C	.	.	H	α-helix	trans	-69.3	-37.9	176.6	-66.9	-150.7	138.6	0	0	111.3	F32 R52 V164 C165 I166	F32-E162 HydrophobicContact CD2-CG 4.37Å; F32-E162 HydrophobicContact CE2-CG 4.45Å; R52-E162 IonicContact CZ-OE1 2.68Å; R52-E162 IonicContact NH1-OE1 3.81Å; R52-E162 PolarHBondContact NH1-OE1 2.83Å; R52-E162 IonicContact NH2-OE1 3.7Å; R52-E162 PolarHBondContact NH2-OE1 3.04Å; E162-V164 VanDerWaalsContact C-N 3.34Å; E162-V164 PolarHBondContact O-N 3.46Å; E162-C165 PolarHBondContact O-N 2.85Å; E162-I166 HydrophobicContact CB-CD1 4.36Å; E162-I166 WeakPolarHBondContact O-CB 3.3Å; E162-I166 WeakPolarHBondContact O-CG1 3.42Å; E162-I166 PolarHBondContact O-N 2.72Å
163	E	89.9	Confident	84.5	Confident	93 Å²	93	48.3 Å²	48.3	44%	0.435	23%	0.23	S	C	.	.	H	α-helix	trans	-63.7	-36.9	-177.2	-66.8	82.5	167.8	0	0	112.4	N160	N160-E163 WeakPolarHBondContact CA-OE2 3.45Å
164	V	90.1	Very high	83	Confident	1 Å²	1	48.5 Å²	48.5	1%	0.006	23%	0.231	C	C	.	.	H	α-helix	trans	-82.8	-30.4	177	-59.4	0	0	0	0	112.9	I89 V122 F151 T153 N160 V161 E162	I89-V164 VanDerWaalsContact CD1-O 3.28Å; I89-V164 WeakPolarHBondContact CD1-O 3.47Å; V122-V164 HydrophobicContact CG2-CB 4.08Å; V122-V164 HydrophobicContact CG2-CG1 3.85Å; F151-V164 HydrophobicContact CB-CG1 3.67Å; F151-V164 HydrophobicContact CD2-CG1 4.3Å; F151-V164 HydrophobicContact CG-CG1 4.01Å; T153-V164 HydrophobicContact CG2-CB 4.39Å; T153-V164 HydrophobicContact CG2-CG1 3.6Å; T153-V164 HydrophobicContact CG2-CG2 3.88Å; N160-V164 WeakPolarHBondContact O-CG1 3.49Å; N160-V164 WeakPolarHBondContact O-CG2 3.25Å; N160-V164 PolarHBondContact O-N 2.92Å; V161-V164 WeakPolarHBondContact O-CG2 3.3Å; E162-V164 VanDerWaalsContact C-N 3.34Å; E162-V164 PolarHBondContact O-N 3.46Å
165	C	84.6	Confident	81.2	Confident	2 Å²	2	54.4 Å²	54.4	1%	0.014	25%	0.254	C	S	.	.	H	α-helix	trans	-91	-17.2	-176.6	-73.7	0	0	0	0	114.1	L15 F32 I65 V161 E162 P167	L15-C165 WeakPolarHBondContact CD1-O 3.37Å; F32-C165 HydrophobicContact CB-CB 4.19Å; F32-C165 HydrophobicContact CD1-CB 3.78Å; F32-C165 HydrophobicContact CD2-CB 3.35Å; F32-C165 HydrophobicContact CE1-CB 3.92Å; F32-C165 HydrophobicContact CE2-CB 3.52Å; F32-C165 HydrophobicContact CG-CB 3.47Å; F32-C165 VanDerWaalsContact CG-CB 3.47Å; F32-C165 HydrophobicContact CZ-CB 3.78Å; I65-C165 HydrophobicContact CD1-CB 4.24Å; V161-C165 WeakPolarHBondContact O-CB 3.44Å; V161-C165 PolarHBondContact O-N 3.09Å; E162-C165 PolarHBondContact O-N 2.85Å; C165-P167 WeakPolarHBondContact O-CD 3.4Å
166	I	83.9	Confident	79.5	Confident	32 Å²	32	57 Å²	57	16%	0.164	27%	0.272	C	S	.	.	S	Bend	trans	-104.3	77.5	167.3	-54.4	174.3	0	0	0	106.9	F32 I54 L63 E162 W168	F32-I166 HydrophobicContact CE2-CD1 4.14Å; F32-I166 HydrophobicContact CE2-CG1 3.71Å; F32-I166 HydrophobicContact CZ-CD1 4.47Å; F32-I166 HydrophobicContact CZ-CG1 3.82Å; I54-I166 HydrophobicContact CD1-CB 4.38Å; I54-I166 HydrophobicContact CD1-CD1 3.97Å; I54-I166 HydrophobicContact CD1-CG1 4Å; I54-I166 HydrophobicContact CD1-CG2 3.51Å; L63-I166 HydrophobicContact CD1-CG1 4.13Å; E162-I166 HydrophobicContact CB-CD1 4.36Å; E162-I166 WeakPolarHBondContact O-CB 3.3Å; E162-I166 WeakPolarHBondContact O-CG1 3.42Å; E162-I166 PolarHBondContact O-N 2.72Å; I166-W168 PolarHBondContact O-N 2.93Å
167	P	67.8	Low	77.6	Confident	7 Å²	7	57.6 Å²	57.6	5%	0.045	28%	0.276	C	S	.	.			trans	-58.4	138.3	-172.4	9.6	-18.1	0	0	0	110.5	L15 I120 C165 Y169 C170	L15-P167 VanDerWaalsContact CD1-CD 3.48Å; L15-P167 HydrophobicContact CD1-CG 3.62Å; L15-P167 HydrophobicContact CD2-CG 3.54Å; L15-P167 HydrophobicContact CG-CG 4.2Å; I120-P167 HydrophobicContact CD1-CB 4.17Å; C165-P167 WeakPolarHBondContact O-CD 3.4Å; P167-Y169 PolarHBondContact O-N 3.23Å; P167-C170 WeakPolarHBondContact O-CB 3.22Å; P167-C170 PolarHBondContact O-N 3.08Å
168	W	66	Low	75.3	Confident	117 Å²	117	57.5 Å²	57.5	44%	0.443	27%	0.274	S	S	.	.	H	α-helix	trans	-48	-30.2	170.9	-69.8	85.3	0	0	0	112.4	F151 I166 C170 L171 L172	F151-W168 AromaticContact CZ-NE1 3.99Å; I166-W168 PolarHBondContact O-N 2.93Å; W168-C170 VanDerWaalsContact C-N 3.31Å; W168-C170 PolarHBondContact O-N 2.94Å; W168-L171 HydrophobicContact CE3-CD1 4.27Å; W168-L171 CarbonylContact O-C 3.53Å; W168-L171 WeakPolarHBondContact O-CA 2.98Å; W168-L171 WeakPolarHBondContact O-CB 3.31Å; W168-L171 PolarHBondContact O-N 2.89Å; W168-L172 WeakPolarHBondContact O-CB 3.45Å; W168-L172 VanDerWaalsContact O-CG 3.29Å; W168-L172 WeakPolarHBondContact O-CG 3.29Å; W168-L172 PolarHBondContact O-N 2.98Å
169	Y	63.5	Low	72.6	Confident	64 Å²	64	60.9 Å²	60.9	25%	0.251	29%	0.291	S	S	.	.	H	α-helix	trans	-55.9	-40.6	172.9	-176	-109.4	0	0	0	114	F13 H86 Q118 P167 L171 L172 N173	F13-Y169 HydrophobicContact CD1-CD1 4.27Å; F13-Y169 HydrophobicContact CD1-CE1 4.4Å; F13-Y169 AromaticContact CE1-CD1 3.97Å; F13-Y169 HydrophobicContact CE1-CD1 3.97Å; F13-Y169 AromaticContact CE1-CE1 4Å; F13-Y169 HydrophobicContact CE1-CE1 4Å; H86-Y169 HydrophobicContact CB-CE1 4.34Å; Q118-Y169 HydrophobicContact CB-CG 4.39Å; Q118-Y169 HydrophobicContact CG-CD1 4.27Å; Q118-Y169 HydrophobicContact CG-CD2 3.35Å; Q118-Y169 HydrophobicContact CG-CE2 3.83Å; Q118-Y169 HydrophobicContact CG-CG 3.58Å; P167-Y169 PolarHBondContact O-N 3.23Å; Y169-L171 VanDerWaalsContact C-N 3.31Å; Y169-L171 PolarHBondContact O-N 2.88Å; Y169-L172 PolarHBondContact O-N 3.35Å; Y169-N173 WeakPolarHBondContact CE1-ND2 3.1Å; Y169-N173 WeakPolarHBondContact CE2-OD1 3.37Å; Y169-N173 WeakPolarHBondContact O-CB 3.31Å; Y169-N173 PolarHBondContact O-N 3.48Å; Y169-N173 PolarHBondContact OH-ND2 2.9Å
170	C	64.4	Low	69.6	Low	0 Å²	0	60.5 Å²	60.5	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-59	-47.9	173.3	-59.3	0	0	0	0	109.6	F13 P167 W168 L172 L174	F13-C170 VanDerWaalsContact CD1-SG 3.58Å; F13-C170 HydrophobicContact CD2-CB 4.25Å; F13-C170 HydrophobicContact CE1-CB 4.35Å; F13-C170 HydrophobicContact CE2-CB 4.03Å; F13-C170 HydrophobicContact CG-CB 4.49Å; F13-C170 WeakPolarHBondContact CG-SG 3.41Å; F13-C170 HydrophobicContact CZ-CB 4.09Å; P167-C170 WeakPolarHBondContact O-CB 3.22Å; P167-C170 PolarHBondContact O-N 3.08Å; W168-C170 VanDerWaalsContact C-N 3.31Å; W168-C170 PolarHBondContact O-N 2.94Å; C170-L172 PolarHBondContact O-N 3.34Å; C170-L174 WeakPolarHBondContact O-CB 3.5Å; C170-L174 VanDerWaalsContact O-CD1 3.26Å; C170-L174 WeakPolarHBondContact O-CD1 3.4Å; C170-L174 WeakPolarHBondContact O-CG 3.27Å; C170-L174 PolarHBondContact O-N 3.27Å; C170-L174 VanDerWaalsContact O-N 3.09Å
171	L	65.8	Low	66.5	Low	36 Å²	36	63.3 Å²	63.3	19%	0.188	31%	0.314	C	S	.	.	H	α-helix	trans	-63.5	-41.7	178.3	-60.5	171.2	0	0	0	112.2	V56 W168 Y169 R175	V56-L171 HydrophobicContact CB-CD2 4.31Å; V56-L171 HydrophobicContact CG1-CD2 3.29Å; V56-L171 HydrophobicContact CG2-CD2 4.02Å; W168-L171 HydrophobicContact CE3-CD1 4.27Å; W168-L171 CarbonylContact O-C 3.53Å; W168-L171 WeakPolarHBondContact O-CA 2.98Å; W168-L171 WeakPolarHBondContact O-CB 3.31Å; W168-L171 PolarHBondContact O-N 2.89Å; Y169-L171 VanDerWaalsContact C-N 3.31Å; Y169-L171 PolarHBondContact O-N 2.88Å; L171-R175 WeakPolarHBondContact O-CB 3.33Å; L171-R175 WeakPolarHBondContact O-CG 3.37Å; L171-R175 PolarHBondContact O-N 3.37Å
172	L	66.8	Low	63.7	Low	101 Å²	101	69.2 Å²	69.2	53%	0.529	35%	0.352	S	S	.	.	H	α-helix	trans	-71.1	-41.1	-177.7	-72.7	174.5	0	0	0	111.8	W168 Y169 C170 R175 S176	W168-L172 WeakPolarHBondContact O-CB 3.45Å; W168-L172 VanDerWaalsContact O-CG 3.29Å; W168-L172 WeakPolarHBondContact O-CG 3.29Å; W168-L172 PolarHBondContact O-N 2.98Å; Y169-L172 PolarHBondContact O-N 3.35Å; C170-L172 PolarHBondContact O-N 3.34Å; L172-R175 PolarHBondContact O-N 3Å; L172-S176 WeakPolarHBondContact O-CB 3.44Å; L172-S176 PolarHBondContact O-N 3.5Å
173	N	68.1	Low	60.7	Low	44 Å²	44	71.4 Å²	71.4	24%	0.235	37%	0.366	C	S	.	.	H	α-helix	trans	-67.3	-41	175.3	-82.3	0.7	0	0	0	111.6	F13 Y169 R175 S176 E177	F13-N173 HydrophobicContact CZ-CB 4.4Å; Y169-N173 WeakPolarHBondContact CE1-ND2 3.1Å; Y169-N173 WeakPolarHBondContact CE2-OD1 3.37Å; Y169-N173 WeakPolarHBondContact O-CB 3.31Å; Y169-N173 PolarHBondContact O-N 3.48Å; Y169-N173 PolarHBondContact OH-ND2 2.9Å; N173-R175 VanDerWaalsContact C-N 3.32Å; N173-R175 PolarHBondContact O-N 3.04Å; N173-S176 CarbonylContact O-C 3.53Å; N173-S176 WeakPolarHBondContact O-CB 3.25Å; N173-S176 PolarHBondContact O-N 3.39Å; N173-E177 WeakPolarHBondContact O-CG 3.45Å; N173-E177 PolarHBondContact O-N 3.04Å
174	L	66.7	Low	57.9	Low	4 Å²	4	78.9 Å²	78.9	2%	0.021	39%	0.39	C	S	.	.	H	α-helix	trans	-64.4	-39.5	175.9	-67.1	167	0	0	0	111.7	H11 V56 E59 V61 C170 K178	H11-L174 HydrophobicContact CB-CD2 4.38Å; H11-L174 WeakPolarHBondContact CD2-CD2 3.38Å; H11-L174 VanDerWaalsContact CE1-CD2 3.48Å; H11-L174 WeakPolarHBondContact CE1-CD2 3.47Å; H11-L174 VanDerWaalsContact CG-CD2 3.48Å; H11-L174 WeakPolarHBondContact NE2-CD2 3.32Å; V56-L174 HydrophobicContact CB-CD1 3.79Å; V56-L174 HydrophobicContact CG1-CD1 3.65Å; V56-L174 HydrophobicContact CG2-CD1 4.43Å; E59-L174 HydrophobicContact CB-CD2 4.49Å; V61-L174 HydrophobicContact CG2-CD1 3.51Å; C170-L174 WeakPolarHBondContact O-CB 3.5Å; C170-L174 VanDerWaalsContact O-CD1 3.26Å; C170-L174 WeakPolarHBondContact O-CD1 3.4Å; C170-L174 WeakPolarHBondContact O-CG 3.27Å; C170-L174 PolarHBondContact O-N 3.27Å; C170-L174 VanDerWaalsContact O-N 3.09Å; L174-K178 WeakPolarHBondContact O-CG 3.26Å; L174-K178 PolarHBondContact O-N 3.17Å; L174-K178 VanDerWaalsContact O-N 3.14Å
175	R	61.8	Low	55	Low	124 Å²	124	86.6 Å²	86.6	47%	0.468	42%	0.424	S	S	.	.	H	α-helix	trans	-67.1	-40.3	172.2	-73.9	173	-177.5	-168.7	2.9	111.8	L171 L172 N173 K178 L179	L171-R175 WeakPolarHBondContact O-CB 3.33Å; L171-R175 WeakPolarHBondContact O-CG 3.37Å; L171-R175 PolarHBondContact O-N 3.37Å; L172-R175 PolarHBondContact O-N 3Å; N173-R175 VanDerWaalsContact C-N 3.32Å; N173-R175 PolarHBondContact O-N 3.04Å; R175-K178 CarbonylContact O-C 3.59Å; R175-K178 PolarHBondContact O-N 3.23Å; R175-L179 VanDerWaalsContact O-CB 3.29Å; R175-L179 WeakPolarHBondContact O-CB 3.38Å; R175-L179 WeakPolarHBondContact O-CG 3.42Å; R175-L179 PolarHBondContact O-N 3.49Å
176	S	61	Low	52.4	Low	58 Å²	58	93 Å²	93	41%	0.406	47%	0.468	S	S	.	.	H	α-helix	trans	-62.4	-46.2	176.4	-177.7	0	0	0	0	110.5	L172 N173 K178 L179 T180	L172-S176 WeakPolarHBondContact O-CB 3.44Å; L172-S176 PolarHBondContact O-N 3.5Å; N173-S176 CarbonylContact O-C 3.53Å; N173-S176 WeakPolarHBondContact O-CB 3.25Å; N173-S176 PolarHBondContact O-N 3.39Å; S176-K178 VanDerWaalsContact C-N 3.27Å; S176-K178 PolarHBondContact O-N 3.29Å; S176-L179 CarbonylContact O-C 3.51Å; S176-L179 PolarHBondContact O-N 3.03Å; S176-T180 WeakPolarHBondContact O-CB 3.21Å; S176-T180 VanDerWaalsContact O-CG2 3.31Å; S176-T180 WeakPolarHBondContact O-CG2 3.42Å; S176-T180 PolarHBondContact O-N 3.18Å; S176-T180 PolarHBondContact O-OG1 2.98Å
177	E	56.6	Low	49.6	Very low	113 Å²	113	96.8 Å²	96.8	53%	0.528	49%	0.492	S	S	.	.	H	α-helix	trans	-61.4	-34.4	176.4	-74.3	-178.7	-168.5	0	0	112.3	H11 N173 T180	H11-E177 IonicContact CE1-OE2 3.75Å; H11-E177 PolarHBondContact CE1-OE2 3.5Å; H11-E177 IonicContact ND1-OE2 3.1Å; N173-E177 WeakPolarHBondContact O-CG 3.45Å; N173-E177 PolarHBondContact O-N 3.04Å; E177-T180 WeakPolarHBondContact CA-OG1 3.47Å; E177-T180 PolarHBondContact O-OG1 3.1Å
178	K	49.6	Very low	48	Very low	114 Å²	114	106.4 Å²	106.4	50%	0.496	55%	0.55	S	S	.	*	H	α-helix	trans	-77.3	-23.3	172.5	-69.4	-176.8	-178.3	-178.1	0	114.1	D57 L174 R175 S176	D57-K178 VanDerWaalsContact CB-NZ 3.27Å; D57-K178 PolarHBondContact O-NZ 3.09Å; L174-K178 WeakPolarHBondContact O-CG 3.26Å; L174-K178 PolarHBondContact O-N 3.17Å; L174-K178 VanDerWaalsContact O-N 3.14Å; R175-K178 CarbonylContact O-C 3.59Å; R175-K178 PolarHBondContact O-N 3.23Å; S176-K178 VanDerWaalsContact C-N 3.27Å; S176-K178 PolarHBondContact O-N 3.29Å
179	L	37.8	Very low	47.1	Very low	144 Å²	144	105.9 Å²	105.9	75%	0.754	56%	0.555	S	S	*	*	H	α-helix	trans	-93	-16.7	177.1	-71.1	171.2	0	0	0	112.9	R175 S176 P181	R175-L179 VanDerWaalsContact O-CB 3.29Å; R175-L179 WeakPolarHBondContact O-CB 3.38Å; R175-L179 WeakPolarHBondContact O-CG 3.42Å; R175-L179 PolarHBondContact O-N 3.49Å; S176-L179 CarbonylContact O-C 3.51Å; S176-L179 PolarHBondContact O-N 3.03Å; L179-P181 VanDerWaalsContact O-CD 3.28Å; L179-P181 WeakPolarHBondContact O-CD 3.3Å
180	T	34.5	Very low	46.3	Very low	76 Å²	76	108.1 Å²	108.1	47%	0.466	57%	0.571	S	S	.	*	S	Bend	trans	-87	108.9	170.5	53.3	0	0	0	0	108.3	S176 E177	S176-T180 WeakPolarHBondContact O-CB 3.21Å; S176-T180 VanDerWaalsContact O-CG2 3.31Å; S176-T180 WeakPolarHBondContact O-CG2 3.42Å; S176-T180 PolarHBondContact O-N 3.18Å; S176-T180 PolarHBondContact O-OG1 2.98Å; E177-T180 WeakPolarHBondContact CA-OG1 3.47Å; E177-T180 PolarHBondContact O-OG1 3.1Å
181	P	30.3	Very low	45.2	Very low	111 Å²	111	114.1 Å²	114.1	72%	0.721	60%	0.603	S	S	*	*			trans	-58.4	138.2	172.1	23.1	-30.7	0	0	0	109	L179 N183	L179-P181 VanDerWaalsContact O-CD 3.28Å; L179-P181 WeakPolarHBondContact O-CD 3.3Å; P181-N183 PolarHBondContact O-N 3.47Å
182	P	37.2	Very low	44	Very low	123 Å²	123	118.6 Å²	118.6	80%	0.799	63%	0.628	S	S	*	*	S	Bend	trans	-73.4	85.7	179.7	30.2	-32.1	0	0	0	107.6
183	N	27.9	Very low	42.6	Very low	135 Å²	135	119.8 Å²	119.8	72%	0.722	63%	0.634	S	S	*	*			trans	173.3	83.3	157.2	-88.4	-25.8	0	0	0	109.5	P181	P181-N183 PolarHBondContact O-N 3.47Å
184	R	30.8	Very low	40.9	Very low	250 Å²	250	124.8 Å²	124.8	94%	0.943	66%	0.66	S	S	*	*			trans	-136.5	96.4	146.3	-129.4	178.2	-173.7	177.3	1.1	109.8
185	F	29.8	Very low	39.1	Very low	163 Å²	163	133.4 Å²	133.4	72%	0.715	71%	0.706	S	S	*	*			trans	-44.5	132.1	157.9	-71	-104.7	0	0	0	110.3	V187	F185-V187 HydrophobicContact CB-CG2 4Å; F185-V187 HydrophobicContact CD1-CG2 4.27Å
186	C	29.9	Very low	37.3	Very low	138 Å²	138	134.2 Å²	134.2	93%	0.932	72%	0.724	S	S	*	*			trans	-101.2	107.5	135.3	-100	0	0	0	0	106.8
187	V	25.7	Very low	35.4	Very low	111 Å²	111	140.5 Å²	140.5	67%	0.673	75%	0.751	S	S	*	*			trans	-67.7	133.4	164.8	176.5	0	0	0	0	107.5	F185	F185-V187 HydrophobicContact CB-CG2 4Å; F185-V187 HydrophobicContact CD1-CG2 4.27Å
188	V	34.4	Very low	33.4	Very low	208 Å²	208	143 Å²	143	100%	1.261	77%	0.771	S	S	*	*			trans	26	0	160.9	-152.6	0	0	0	0	118.5

Retrieved 188 of 188 residues in 298.3 ms (Link to these results)

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