A0A077ZGS6_TRITR Loading...

Integrase catalytic domain-containing protein

AlphaFold DB , UniProt , Accession A0A077ZGS6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 224 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	46	Very low	71.2	Confident	243 Å²	243	110.2 Å²	110.2	100%	1.197	55%	0.554	S	S	*	*				0	128.4	0	-142.7	173.2	-162.9	0	0	106.2	S3	M1-S3 PolarHBondContact O-N 2.74Å
2	F	50.6	Low	72.5	Confident	138 Å²	138	113 Å²	113	61%	0.605	56%	0.564	S	S	*	*			trans	-55.1	127	-178.6	-59.9	-80.9	0	0	0	109.6	L7 I10	F2-L7 HydrophobicContact CB-CD2 3.76Å; F2-L7 HydrophobicContact CB-CG 3.9Å; F2-L7 HydrophobicContact CD2-CD2 4.29Å; F2-L7 HydrophobicContact CG-CD2 4.22Å; F2-I10 HydrophobicContact CD1-CD1 4.23Å; F2-I10 HydrophobicContact CE1-CD1 4.43Å
3	S	55.9	Low	73.9	Confident	82 Å²	82	113.3 Å²	113.3	57%	0.573	56%	0.56	S	S	*	*			trans	-63.7	152.1	174.1	58.6	0	0	0	0	109.7	M1 R5 N6 L7	M1-S3 PolarHBondContact O-N 2.74Å; S3-R5 VanDerWaalsContact C-N 3.27Å; S3-R5 PolarHBondContact O-N 3.01Å; S3-R5 VanDerWaalsContact O-N 3.16Å; S3-N6 WeakPolarHBondContact O-CB 3.46Å; S3-N6 PolarHBondContact O-N 3.03Å; S3-L7 PolarHBondContact O-N 2.82Å
4	G	65.2	Low	75.1	Confident	49 Å²	49	107.4 Å²	107.4	51%	0.505	53%	0.531	S	S	.	.	H	α-helix	trans	-50.6	-43.3	-174.6	0	0	0	0	0	113.8	N6 L7 D8	G4-N6 VanDerWaalsContact C-N 3.26Å; G4-N6 PolarHBondContact O-N 3.2Å; G4-L7 PolarHBondContact O-N 3.3Å; G4-L7 VanDerWaalsContact O-N 3.16Å; G4-D8 PolarHBondContact O-N 3.08Å
5	R	64.6	Low	76.1	Confident	212 Å²	212	105.7 Å²	105.7	80%	0.8	53%	0.534	S	S	*	.	H	α-helix	trans	-59	-33.3	177.4	-73.8	-173.7	-174.4	165.5	1.8	113.8	S3 Q9	S3-R5 VanDerWaalsContact C-N 3.27Å; S3-R5 PolarHBondContact O-N 3.01Å; S3-R5 VanDerWaalsContact O-N 3.16Å; R5-Q9 WeakPolarHBondContact O-CG 3.29Å; R5-Q9 PolarHBondContact O-N 2.92Å
6	N	79.4	Confident	77	Confident	64 Å²	64	104.6 Å²	104.6	34%	0.342	54%	0.539	S	S	.	.	H	α-helix	trans	-75.8	-33.9	-178.7	-161.5	-11.6	0	0	0	111	S3 G4 D8 Q9 I10	S3-N6 WeakPolarHBondContact O-CB 3.46Å; S3-N6 PolarHBondContact O-N 3.03Å; G4-N6 VanDerWaalsContact C-N 3.26Å; G4-N6 PolarHBondContact O-N 3.2Å; N6-D8 PolarHBondContact O-N 2.97Å; N6-Q9 PolarHBondContact O-N 3.36Å; N6-I10 WeakPolarHBondContact O-CB 3.49Å; N6-I10 WeakPolarHBondContact O-CD1 3.43Å; N6-I10 WeakPolarHBondContact O-CG1 3.28Å; N6-I10 PolarHBondContact O-N 3.48Å; N6-I10 WeakPolarHBondContact OD1-CD1 3.49Å
7	L	80.5	Confident	77.9	Confident	52 Å²	52	104.8 Å²	104.8	27%	0.272	54%	0.537	S	S	.	.	H	α-helix	trans	-66.5	-39.2	178.8	-71	175.2	0	0	0	112.7	F2 S3 G4 I10 K11 F23	F2-L7 HydrophobicContact CB-CD2 3.76Å; F2-L7 HydrophobicContact CB-CG 3.9Å; F2-L7 HydrophobicContact CD2-CD2 4.29Å; F2-L7 HydrophobicContact CG-CD2 4.22Å; S3-L7 PolarHBondContact O-N 2.82Å; G4-L7 PolarHBondContact O-N 3.3Å; G4-L7 VanDerWaalsContact O-N 3.16Å; L7-I10 PolarHBondContact O-N 2.77Å; L7-K11 WeakPolarHBondContact O-CB 3.43Å; L7-K11 VanDerWaalsContact O-CG 3.25Å; L7-K11 WeakPolarHBondContact O-CG 3.29Å; L7-K11 PolarHBondContact O-N 2.85Å; L7-F23 HydrophobicContact CD2-CZ 4.48Å
8	D	83.6	Confident	78.7	Confident	99 Å²	99	102.7 Å²	102.7	53%	0.529	55%	0.545	S	S	.	.	H	α-helix	trans	-69.6	-41.8	179.6	-63.4	-32.7	0	0	0	111	G4 N6 I10 K11 E12	G4-D8 PolarHBondContact O-N 3.08Å; N6-D8 PolarHBondContact O-N 2.97Å; D8-I10 PolarHBondContact O-N 3.33Å; D8-K11 PolarHBondContact O-N 3.06Å; D8-E12 WeakPolarHBondContact O-CB 3.5Å; D8-E12 PolarHBondContact O-N 3.44Å
9	Q	86.7	Confident	79.3	Confident	126 Å²	126	101.4 Å²	101.4	59%	0.589	54%	0.538	S	S	*	.	H	α-helix	trans	-60.5	-44.1	173.2	-70.6	176.5	-4.2	0	0	112.3	R5 N6 E12 K13	R5-Q9 WeakPolarHBondContact O-CG 3.29Å; R5-Q9 PolarHBondContact O-N 2.92Å; N6-Q9 PolarHBondContact O-N 3.36Å; Q9-E12 PolarHBondContact O-N 3.42Å; Q9-K13 VanDerWaalsContact O-CB 3.29Å; Q9-K13 WeakPolarHBondContact O-CB 3.33Å; Q9-K13 PolarHBondContact O-N 2.82Å
10	I	86.2	Confident	79.7	Confident	52 Å²	52	101.8 Å²	101.8	27%	0.267	55%	0.545	S	S	.	.	H	α-helix	trans	-62.9	-45.6	176	-69.8	164.5	0	0	0	110.2	F2 N6 L7 D8 E12 K13 L14	F2-I10 HydrophobicContact CD1-CD1 4.23Å; F2-I10 HydrophobicContact CE1-CD1 4.43Å; N6-I10 WeakPolarHBondContact O-CB 3.49Å; N6-I10 WeakPolarHBondContact O-CD1 3.43Å; N6-I10 WeakPolarHBondContact O-CG1 3.28Å; N6-I10 PolarHBondContact O-N 3.48Å; N6-I10 WeakPolarHBondContact OD1-CD1 3.49Å; L7-I10 PolarHBondContact O-N 2.77Å; D8-I10 PolarHBondContact O-N 3.33Å; I10-E12 PolarHBondContact O-N 3.42Å; I10-K13 PolarHBondContact O-N 2.96Å; I10-L14 HydrophobicContact CG2-CD1 3.65Å; I10-L14 HydrophobicContact CG2-CG 4.14Å; I10-L14 WeakPolarHBondContact O-CB 3.29Å; I10-L14 WeakPolarHBondContact O-CG 3.3Å; I10-L14 PolarHBondContact O-N 3.2Å
11	K	84.9	Confident	79.9	Confident	95 Å²	95	103.8 Å²	103.8	41%	0.413	55%	0.545	S	S	.	.	H	α-helix	trans	-62.7	-43.9	179	-77.4	172.5	-176.9	172.2	0	111.9	L7 D8 L14 S15	L7-K11 WeakPolarHBondContact O-CB 3.43Å; L7-K11 VanDerWaalsContact O-CG 3.25Å; L7-K11 WeakPolarHBondContact O-CG 3.29Å; L7-K11 PolarHBondContact O-N 2.85Å; D8-K11 PolarHBondContact O-N 3.06Å; K11-L14 PolarHBondContact O-N 3.21Å; K11-S15 VanDerWaalsContact O-CB 3.23Å; K11-S15 WeakPolarHBondContact O-CB 3.39Å; K11-S15 PolarHBondContact O-N 2.86Å; K11-S15 PolarHBondContact O-OG 2.79Å
12	E	86.8	Confident	81.6	Confident	144 Å²	144	100.7 Å²	100.7	67%	0.673	52%	0.524	S	S	*	.	H	α-helix	trans	-62.1	-46.8	178.1	-175.6	177.1	-169	0	0	110.5	D8 Q9 I10 S15 S16	D8-E12 WeakPolarHBondContact O-CB 3.5Å; D8-E12 PolarHBondContact O-N 3.44Å; Q9-E12 PolarHBondContact O-N 3.42Å; I10-E12 PolarHBondContact O-N 3.42Å; E12-S15 PolarHBondContact O-N 2.84Å; E12-S16 PolarHBondContact O-N 2.96Å
13	K	90.5	Very high	83.2	Confident	117 Å²	117	100.5 Å²	100.5	51%	0.509	52%	0.524	S	S	.	.	H	α-helix	trans	-61.1	-48.5	177.6	-177.2	56.9	180	148	0	112.1	Q9 I10 S15 S16 E17	Q9-K13 VanDerWaalsContact O-CB 3.29Å; Q9-K13 WeakPolarHBondContact O-CB 3.33Å; Q9-K13 PolarHBondContact O-N 2.82Å; I10-K13 PolarHBondContact O-N 2.96Å; K13-S15 VanDerWaalsContact C-N 3.3Å; K13-S15 PolarHBondContact O-N 2.91Å; K13-S16 PolarHBondContact O-N 3.26Å; K13-S16 PolarHBondContact O-OG 3.17Å; K13-E17 WeakPolarHBondContact CE-OE1 3.43Å; K13-E17 IonicContact NZ-OE1 2.66Å; K13-E17 PolarHBondContact NZ-OE1 3.22Å; K13-E17 PolarHBondContact O-N 3.46Å
14	L	91.1	Very high	84.5	Confident	30 Å²	30	100.9 Å²	100.9	16%	0.157	52%	0.518	C	S	.	.	H	α-helix	trans	-62.8	-37.9	176.8	-69.8	176.5	0	0	0	111.8	I10 K11 S16 E17 G18 I19 W21	I10-L14 HydrophobicContact CG2-CD1 3.65Å; I10-L14 HydrophobicContact CG2-CG 4.14Å; I10-L14 WeakPolarHBondContact O-CB 3.29Å; I10-L14 WeakPolarHBondContact O-CG 3.3Å; I10-L14 PolarHBondContact O-N 3.2Å; K11-L14 PolarHBondContact O-N 3.21Å; L14-S16 VanDerWaalsContact C-N 3.34Å; L14-S16 PolarHBondContact O-N 2.94Å; L14-E17 CarbonylContact O-C 3.52Å; L14-E17 PolarHBondContact O-N 2.89Å; L14-E17 VanDerWaalsContact O-N 3.11Å; L14-G18 PolarHBondContact O-N 3.36Å; L14-I19 CarbonylContact C-O 3.6Å; L14-I19 HydrophobicContact CB-CB 4.07Å; L14-I19 HydrophobicContact CB-CG2 4.39Å; L14-I19 HydrophobicContact CD2-CB 4.11Å; L14-I19 HydrophobicContact CD2-CD1 3.91Å; L14-I19 HydrophobicContact CD2-CG2 4.02Å; L14-I19 WeakPolarHBondContact O-CA 3.37Å; L14-I19 WeakPolarHBondContact O-CB 3.24Å; L14-I19 PolarHBondContact O-N 3.2Å; L14-W21 HydrophobicContact CD1-CB 3.96Å; L14-W21 HydrophobicContact CD1-CD2 4.13Å; L14-W21 HydrophobicContact CD1-CE3 3.52Å; L14-W21 HydrophobicContact CD1-CG 4.35Å; L14-W21 HydrophobicContact CD1-CZ3 4.33Å
15	S	89.3	Confident	85.4	Confident	82 Å²	82	100 Å²	100	57%	0.573	50%	0.503	S	S	*	.	H	α-helix	trans	-66.1	-37.1	177.7	-57.7	0	0	0	0	111.7	K11 E12 K13 E17 G18	K11-S15 VanDerWaalsContact O-CB 3.23Å; K11-S15 WeakPolarHBondContact O-CB 3.39Å; K11-S15 PolarHBondContact O-N 2.86Å; K11-S15 PolarHBondContact O-OG 2.79Å; E12-S15 PolarHBondContact O-N 2.84Å; K13-S15 VanDerWaalsContact C-N 3.3Å; K13-S15 PolarHBondContact O-N 2.91Å; S15-E17 PolarHBondContact O-N 2.67Å; S15-G18 PolarHBondContact O-N 2.9Å
16	S	91.5	Very high	86.3	Confident	88 Å²	88	96.1 Å²	96.1	62%	0.615	49%	0.494	S	S	*	.	H	α-helix	trans	-62.2	-22.9	173.4	76.9	0	0	0	0	113.4	E12 K13 L14	E12-S16 PolarHBondContact O-N 2.96Å; K13-S16 PolarHBondContact O-N 3.26Å; K13-S16 PolarHBondContact O-OG 3.17Å; L14-S16 VanDerWaalsContact C-N 3.34Å; L14-S16 PolarHBondContact O-N 2.94Å
17	E	91.8	Very high	86.4	Confident	108 Å²	108	96.1 Å²	96.1	51%	0.505	49%	0.489	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.7	5.8	177.4	-66	176.1	-170.1	0	0	112.6	K13 L14 S15 I19	K13-E17 WeakPolarHBondContact CE-OE1 3.43Å; K13-E17 IonicContact NZ-OE1 2.66Å; K13-E17 PolarHBondContact NZ-OE1 3.22Å; K13-E17 PolarHBondContact O-N 3.46Å; L14-E17 CarbonylContact O-C 3.52Å; L14-E17 PolarHBondContact O-N 2.89Å; L14-E17 VanDerWaalsContact O-N 3.11Å; S15-E17 PolarHBondContact O-N 2.67Å; E17-I19 HydrophobicContact CB-CD1 4.01Å; E17-I19 HydrophobicContact CB-CG1 4.12Å; E17-I19 PolarHBondContact O-N 2.88Å
18	G	91.6	Very high	86.6	Confident	67 Å²	67	93.7 Å²	93.7	69%	0.691	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.2	13.8	-177.1	0	0	0	0	0	114.3	L14 S15	L14-G18 PolarHBondContact O-N 3.36Å; S15-G18 PolarHBondContact O-N 2.9Å
19	I	90.7	Very high	86.4	Confident	78 Å²	78	92.3 Å²	92.3	40%	0.4	47%	0.473	S	S	.	.			trans	-90.5	117.1	-177.8	-57.7	171.3	0	0	0	110	L14 E17	L14-I19 CarbonylContact C-O 3.6Å; L14-I19 HydrophobicContact CB-CB 4.07Å; L14-I19 HydrophobicContact CB-CG2 4.39Å; L14-I19 HydrophobicContact CD2-CB 4.11Å; L14-I19 HydrophobicContact CD2-CD1 3.91Å; L14-I19 HydrophobicContact CD2-CG2 4.02Å; L14-I19 WeakPolarHBondContact O-CA 3.37Å; L14-I19 WeakPolarHBondContact O-CB 3.24Å; L14-I19 PolarHBondContact O-N 3.2Å; E17-I19 HydrophobicContact CB-CD1 4.01Å; E17-I19 HydrophobicContact CB-CG1 4.12Å; E17-I19 PolarHBondContact O-N 2.88Å
20	T	86.9	Confident	86	Confident	110 Å²	110	92.1 Å²	92.1	68%	0.675	47%	0.467	S	S	*	.			trans	-88.4	108	173.5	-57.4	0	0	0	0	111	K22	T20-K22 HydrophobicContact CG2-CG 4.23Å; T20-K22 PolarHBondContact O-N 3.42Å
21	W	83.6	Confident	85.6	Confident	144 Å²	144	92.6 Å²	92.6	55%	0.545	47%	0.473	S	S	.	.			trans	-74.8	123.5	174.1	-171.6	-87.8	0	0	0	111.8	L14 F23	L14-W21 HydrophobicContact CD1-CB 3.96Å; L14-W21 HydrophobicContact CD1-CD2 4.13Å; L14-W21 HydrophobicContact CD1-CE3 3.52Å; L14-W21 HydrophobicContact CD1-CG 4.35Å; L14-W21 HydrophobicContact CD1-CZ3 4.33Å; W21-F23 AromaticContact CD1-CD2 3.78Å; W21-F23 AromaticContact CD1-CE2 3.41Å; W21-F23 VanDerWaalsContact CD1-CE2 3.41Å; W21-F23 AromaticContact CD1-CZ 3.59Å; W21-F23 AromaticContact NE1-CD1 3.69Å; W21-F23 AromaticContact NE1-CD2 3.88Å; W21-F23 AromaticContact NE1-CE1 3.28Å; W21-F23 VanDerWaalsContact NE1-CE1 3.28Å; W21-F23 AromaticContact NE1-CE2 3.49Å; W21-F23 AromaticContact NE1-CG 3.97Å; W21-F23 AromaticContact NE1-CZ 3.17Å
22	K	82.9	Confident	85.4	Confident	177 Å²	177	88.1 Å²	88.1	77%	0.77	45%	0.454	S	S	*	.			trans	-119	124.7	177.7	-65.2	-179.2	-178	175.3	0	110.4	T20	T20-K22 HydrophobicContact CG2-CG 4.23Å; T20-K22 PolarHBondContact O-N 3.42Å
23	F	83.2	Confident	85.2	Confident	135 Å²	135	82 Å²	82	59%	0.592	43%	0.428	S	S	*	.	P	Polyproline II helix	trans	-81.6	148.6	171.7	-69.1	-81.8	0	0	0	111	L7 W21	L7-F23 HydrophobicContact CD2-CZ 4.48Å; W21-F23 AromaticContact CD1-CD2 3.78Å; W21-F23 AromaticContact CD1-CE2 3.41Å; W21-F23 VanDerWaalsContact CD1-CE2 3.41Å; W21-F23 AromaticContact CD1-CZ 3.59Å; W21-F23 AromaticContact NE1-CD1 3.69Å; W21-F23 AromaticContact NE1-CD2 3.88Å; W21-F23 AromaticContact NE1-CE1 3.28Å; W21-F23 VanDerWaalsContact NE1-CE1 3.28Å; W21-F23 AromaticContact NE1-CE2 3.49Å; W21-F23 AromaticContact NE1-CG 3.97Å; W21-F23 AromaticContact NE1-CZ 3.17Å
24	I	84	Confident	84.7	Confident	89 Å²	89	82.2 Å²	82.2	46%	0.456	43%	0.427	S	S	.	.	P	Polyproline II helix	trans	-62	148.6	164.4	61.1	172.3	0	0	0	109.3	E26 T31 W35	I24-E26 PolarHBondContact O-N 3.22Å; I24-T31 WeakPolarHBondContact CB-OG1 3.48Å; I24-T31 VanDerWaalsContact CG2-OG1 3.24Å; I24-T31 WeakPolarHBondContact CG2-OG1 3.49Å; I24-W35 HydrophobicContact CG2-CH2 4.4Å; I24-W35 HydrophobicContact CG2-CZ2 4.41Å
25	T	84.4	Confident	84.4	Confident	31 Å²	31	87.3 Å²	87.3	19%	0.19	44%	0.444	C	S	.	.	P	Polyproline II helix	trans	-59	135.5	173.6	-56.4	0	0	0	0	109.2	R27 A28 S198 T209	T25-R27 PolarHBondContact O-N 2.76Å; T25-A28 VanDerWaalsContact O-CB 3.25Å; T25-A28 WeakPolarHBondContact O-CB 3.44Å; T25-A28 PolarHBondContact O-N 3.38Å; T25-A28 VanDerWaalsContact O-N 3.13Å; T25-S198 WeakPolarHBondContact CB-OG 3.44Å; T25-S198 PolarHBondContact OG1-OG 3.44Å; T25-T209 HydrophobicContact CG2-CG2 3.83Å
26	E	82.9	Confident	84.4	Confident	130 Å²	130	88.5 Å²	88.5	61%	0.607	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.4	138.4	175.4	-66.3	-179.7	176.4	0	0	111	I24 A28 R210	I24-E26 PolarHBondContact O-N 3.22Å; E26-A28 PolarHBondContact O-N 2.83Å; E26-R210 IonicContact OE2-CZ 2.64Å; E26-R210 IonicContact OE2-NH1 2.82Å; E26-R210 PolarHBondContact OE2-NH1 3.02Å
27	R	82.5	Confident	84.2	Confident	64 Å²	64	90.7 Å²	90.7	24%	0.242	44%	0.435	C	S	.	.	T	Hydrogen-bonded Turn	trans	62.6	26.7	179	-43.7	-176.9	83.8	-177.9	27	114.2	T25 P29 W30 A171 E172	T25-R27 PolarHBondContact O-N 2.76Å; R27-P29 WeakPolarHBondContact O-CD 3.43Å; R27-W30 WeakPolarHBondContact O-CH2 3.37Å; R27-W30 WeakPolarHBondContact O-CZ3 3.26Å; R27-A171 PolarHBondContact NH1-O 2.95Å; R27-E172 IonicContact CZ-OE1 2.87Å; R27-E172 IonicContact CZ-OE2 3.19Å; R27-E172 IonicContact NH1-OE1 2.85Å; R27-E172 PolarHBondContact NH1-OE1 3.43Å; R27-E172 IonicContact NH1-OE2 3.77Å; R27-E172 PolarHBondContact NH1-OE2 3.25Å; R27-E172 IonicContact NH2-OE2 3.97Å; R27-E172 PolarHBondContact NH2-OE2 2.84Å
28	A	83.4	Confident	84.1	Confident	1 Å²	1	87.1 Å²	87.1	1%	0.008	42%	0.42	C	S	.	.			trans	-115.7	54	171	0	0	0	0	0	112.4	T25 E26 W30 T31 P211	T25-A28 VanDerWaalsContact O-CB 3.25Å; T25-A28 WeakPolarHBondContact O-CB 3.44Å; T25-A28 PolarHBondContact O-N 3.38Å; T25-A28 VanDerWaalsContact O-N 3.13Å; E26-A28 PolarHBondContact O-N 2.83Å; A28-W30 HydrophobicContact CB-CH2 4.23Å; A28-W30 HydrophobicContact CB-CZ2 3.83Å; A28-W30 PolarHBondContact O-N 3.48Å; A28-T31 HydrophobicContact CB-CG2 3.81Å; A28-T31 PolarHBondContact O-N 3.03Å; A28-T31 PolarHBondContact O-OG1 2.92Å; A28-P211 HydrophobicContact CB-CB 3.94Å; A28-P211 HydrophobicContact CB-CG 3.87Å
29	P	78.9	Confident	84.1	Confident	71 Å²	71	87.2 Å²	87.2	46%	0.461	41%	0.407	S	S	.	.	G	3₁₀ helix	trans	-56.7	-29.4	-174.9	24.3	-35.1	0	0	0	113.4	R27 T31 G32	R27-P29 WeakPolarHBondContact O-CD 3.43Å; P29-T31 PolarHBondContact O-N 2.97Å; P29-G32 PolarHBondContact O-N 3.13Å; P29-G32 VanDerWaalsContact O-N 3.16Å
30	W	78.6	Confident	84.2	Confident	121 Å²	121	91.7 Å²	91.7	46%	0.458	42%	0.419	S	S	.	.	G	3₁₀ helix	trans	-63.7	-20.3	177.9	58.9	84.7	0	0	0	114.1	R27 A28 G32 G33 P211 A213 K214	R27-W30 WeakPolarHBondContact O-CH2 3.37Å; R27-W30 WeakPolarHBondContact O-CZ3 3.26Å; A28-W30 HydrophobicContact CB-CH2 4.23Å; A28-W30 HydrophobicContact CB-CZ2 3.83Å; A28-W30 PolarHBondContact O-N 3.48Å; W30-G32 PolarHBondContact O-N 3.28Å; W30-G33 PolarHBondContact O-N 3.3Å; W30-P211 HydrophobicContact CH2-CB 4.24Å; W30-P211 HydrophobicContact CH2-CG 3.61Å; W30-P211 HydrophobicContact CZ2-CB 3.63Å; W30-P211 HydrophobicContact CZ2-CG 3.54Å; W30-A213 HydrophobicContact CH2-CB 4.04Å; W30-A213 HydrophobicContact CZ2-CB 3.64Å; W30-K214 HydrophobicContact CH2-CG 3.96Å
31	T	77.8	Confident	84.4	Confident	63 Å²	63	87 Å²	87	39%	0.387	39%	0.39	S	S	.	.	G	3₁₀ helix	trans	-63.1	-24.1	177	59.1	0	0	0	0	111.6	I24 A28 P29 W35	I24-T31 WeakPolarHBondContact CB-OG1 3.48Å; I24-T31 VanDerWaalsContact CG2-OG1 3.24Å; I24-T31 WeakPolarHBondContact CG2-OG1 3.49Å; A28-T31 HydrophobicContact CB-CG2 3.81Å; A28-T31 PolarHBondContact O-N 3.03Å; A28-T31 PolarHBondContact O-OG1 2.92Å; P29-T31 PolarHBondContact O-N 2.97Å; T31-W35 VanDerWaalsContact O-CH2 3.27Å; T31-W35 WeakPolarHBondContact O-CH2 3.47Å; T31-W35 VanDerWaalsContact O-CZ3 3.32Å; T31-W35 WeakPolarHBondContact O-CZ3 3.27Å
32	G	80.3	Confident	84.9	Confident	1 Å²	1	81.3 Å²	81.3	1%	0.01	37%	0.372	C	S	.	.	G	3₁₀ helix	trans	-98	3.4	173.4	0	0	0	0	0	116.6	P29 W30 Y34 W35 E36	P29-G32 PolarHBondContact O-N 3.13Å; P29-G32 VanDerWaalsContact O-N 3.16Å; W30-G32 PolarHBondContact O-N 3.28Å; G32-Y34 PolarHBondContact O-N 3.12Å; G32-W35 PolarHBondContact O-N 2.95Å; G32-W35 PolarHBondContact O-NE1 2.95Å; G32-E36 WeakPolarHBondContact O-CG 3.43Å; G32-E36 PolarHBondContact O-N 2.89Å
33	G	82.4	Confident	85.5	Confident	14 Å²	14	79.6 Å²	79.6	14%	0.144	36%	0.364	C	S	.	.	H	α-helix	trans	-60.6	-26.3	-171.3	0	0	0	0	0	113.8	W30 R37	W30-G33 PolarHBondContact O-N 3.3Å; G33-R37 VanDerWaalsContact O-CB 3.28Å; G33-R37 WeakPolarHBondContact O-CB 3.39Å; G33-R37 WeakPolarHBondContact O-CG 3.27Å; G33-R37 PolarHBondContact O-N 2.92Å; G33-R37 VanDerWaalsContact O-N 3.14Å; G33-R37 PolarHBondContact O-NE 2.92Å
34	Y	81.3	Confident	86	Confident	123 Å²	123	77.6 Å²	77.6	48%	0.482	36%	0.358	S	S	.	.	H	α-helix	trans	-66.1	-58.2	176.1	176.2	-99.4	0	0	0	112.3	G32 E36 R37 L38 R74	G32-Y34 PolarHBondContact O-N 3.12Å; Y34-E36 VanDerWaalsContact C-N 3.33Å; Y34-E36 PolarHBondContact O-N 3.34Å; Y34-R37 PolarHBondContact O-N 2.92Å; Y34-L38 PolarHBondContact O-N 3.22Å; Y34-R74 PolarHBondContact OH-NH2 3.06Å
35	W	85.2	Confident	86.4	Confident	137 Å²	137	73.3 Å²	73.3	52%	0.519	34%	0.336	S	S	.	.	H	α-helix	trans	-68.9	-33.2	-177.7	58.9	81.8	0	0	0	111.8	I24 T31 G32 R37 L38 V39	I24-W35 HydrophobicContact CG2-CH2 4.4Å; I24-W35 HydrophobicContact CG2-CZ2 4.41Å; T31-W35 VanDerWaalsContact O-CH2 3.27Å; T31-W35 WeakPolarHBondContact O-CH2 3.47Å; T31-W35 VanDerWaalsContact O-CZ3 3.32Å; T31-W35 WeakPolarHBondContact O-CZ3 3.27Å; G32-W35 PolarHBondContact O-N 2.95Å; G32-W35 PolarHBondContact O-NE1 2.95Å; W35-R37 VanDerWaalsContact C-N 3.35Å; W35-R37 PolarHBondContact O-N 3.01Å; W35-L38 PolarHBondContact O-N 3.13Å; W35-V39 WeakPolarHBondContact O-CB 3.32Å; W35-V39 VanDerWaalsContact O-CG2 3.24Å; W35-V39 WeakPolarHBondContact O-CG2 3.36Å; W35-V39 PolarHBondContact O-N 2.95Å
36	E	87.9	Confident	86.9	Confident	107 Å²	107	73 Å²	73	50%	0.5	33%	0.333	S	S	.	.	H	α-helix	trans	-61.7	-42.6	173.2	-72	179.1	174.2	0	0	112.1	G32 Y34 R40	G32-E36 WeakPolarHBondContact O-CG 3.43Å; G32-E36 PolarHBondContact O-N 2.89Å; Y34-E36 VanDerWaalsContact C-N 3.33Å; Y34-E36 PolarHBondContact O-N 3.34Å; E36-R40 VanDerWaalsContact O-CB 3.26Å; E36-R40 WeakPolarHBondContact O-CB 3.39Å; E36-R40 PolarHBondContact O-N 3.31Å
37	R	87.7	Confident	87.4	Confident	133 Å²	133	76.7 Å²	76.7	50%	0.502	34%	0.341	S	S	.	.	H	α-helix	trans	-65.1	-41.2	175.1	-78.6	178.4	-67.5	169.8	0.7	111.9	G33 Y34 W35 R40 S41	G33-R37 VanDerWaalsContact O-CB 3.28Å; G33-R37 WeakPolarHBondContact O-CB 3.39Å; G33-R37 WeakPolarHBondContact O-CG 3.27Å; G33-R37 PolarHBondContact O-N 2.92Å; G33-R37 VanDerWaalsContact O-N 3.14Å; G33-R37 PolarHBondContact O-NE 2.92Å; Y34-R37 PolarHBondContact O-N 2.92Å; W35-R37 VanDerWaalsContact C-N 3.35Å; W35-R37 PolarHBondContact O-N 3.01Å; R37-R40 PolarHBondContact O-N 3.16Å; R37-S41 PolarHBondContact O-N 2.95Å
38	L	89.9	Confident	88	Confident	33 Å²	33	79.8 Å²	79.8	17%	0.173	36%	0.356	C	S	.	.	H	α-helix	trans	-63.2	-48.1	176.1	-178.2	62.1	0	0	0	111.5	Y34 W35 R40 S41 V42 W141 Y145	Y34-L38 PolarHBondContact O-N 3.22Å; W35-L38 PolarHBondContact O-N 3.13Å; L38-R40 VanDerWaalsContact C-N 3.28Å; L38-R40 PolarHBondContact O-N 3.21Å; L38-S41 PolarHBondContact O-N 3.46Å; L38-S41 PolarHBondContact O-OG 2.94Å; L38-V42 WeakPolarHBondContact O-CG2 3.41Å; L38-V42 PolarHBondContact O-N 3.17Å; L38-V42 VanDerWaalsContact O-N 3.13Å; L38-W141 HydrophobicContact CD1-CZ2 3.99Å; L38-Y145 HydrophobicContact CD1-CE2 4.02Å
39	V	92	Very high	88.4	Confident	69 Å²	69	80.4 Å²	80.4	42%	0.418	36%	0.36	S	S	.	.	H	α-helix	trans	-60	-41.6	176.2	169.3	0	0	0	0	110.7	W35 K43	W35-V39 WeakPolarHBondContact O-CB 3.32Å; W35-V39 VanDerWaalsContact O-CG2 3.24Å; W35-V39 WeakPolarHBondContact O-CG2 3.36Å; W35-V39 PolarHBondContact O-N 2.95Å; V39-K43 HydrophobicContact CG1-CD 3.89Å; V39-K43 HydrophobicContact CG1-CG 4.36Å; V39-K43 WeakPolarHBondContact O-CB 3.29Å; V39-K43 WeakPolarHBondContact O-CG 3.42Å; V39-K43 PolarHBondContact O-N 3Å
40	R	92.3	Very high	89.1	Confident	172 Å²	172	78.4 Å²	78.4	65%	0.649	35%	0.345	S	S	*	.	H	α-helix	trans	-61.6	-45.6	176.5	-179.6	176.7	178.9	163.3	0.7	111.9	E36 R37 L38 V42 K43 M44	E36-R40 VanDerWaalsContact O-CB 3.26Å; E36-R40 WeakPolarHBondContact O-CB 3.39Å; E36-R40 PolarHBondContact O-N 3.31Å; R37-R40 PolarHBondContact O-N 3.16Å; L38-R40 VanDerWaalsContact C-N 3.28Å; L38-R40 PolarHBondContact O-N 3.21Å; R40-V42 PolarHBondContact O-N 3.19Å; R40-K43 PolarHBondContact O-N 3.43Å; R40-M44 HydrophobicContact CG-CG 4.27Å; R40-M44 HydrophobicContact CG-SD 3.87Å; R40-M44 WeakPolarHBondContact O-CB 3.27Å; R40-M44 VanDerWaalsContact O-CG 3.28Å; R40-M44 WeakPolarHBondContact O-CG 3.38Å; R40-M44 PolarHBondContact O-N 2.82Å
41	S	91.4	Very high	89.5	Confident	12 Å²	12	75.2 Å²	75.2	8%	0.084	35%	0.35	C	S	.	.	H	α-helix	trans	-62.6	-43.2	-179.1	71.6	0	0	0	0	111.5	R37 L38 M44 A45 W141	R37-S41 PolarHBondContact O-N 2.95Å; L38-S41 PolarHBondContact O-N 3.46Å; L38-S41 PolarHBondContact O-OG 2.94Å; S41-M44 PolarHBondContact O-N 3.27Å; S41-A45 PolarHBondContact O-N 2.97Å; S41-A45 VanDerWaalsContact O-N 3.1Å; S41-W141 PolarHBondContact OG-NE1 3.13Å; S41-W141 VanDerWaalsContact OG-NE1 3.11Å
42	V	94.2	Very high	89.8	Confident	25 Å²	25	81.4 Å²	81.4	15%	0.152	37%	0.374	C	S	.	.	H	α-helix	trans	-62	-50.1	175.9	176	0	0	0	0	111	L38 R40 M44 A45 L46 V67 V71 F137 W141	L38-V42 WeakPolarHBondContact O-CG2 3.41Å; L38-V42 PolarHBondContact O-N 3.17Å; L38-V42 VanDerWaalsContact O-N 3.13Å; R40-V42 PolarHBondContact O-N 3.19Å; V42-M44 VanDerWaalsContact C-N 3.33Å; V42-M44 PolarHBondContact O-N 3.13Å; V42-A45 PolarHBondContact O-N 3.44Å; V42-L46 HydrophobicContact CG1-CD1 3.93Å; V42-L46 HydrophobicContact CG1-CG 4.39Å; V42-L46 WeakPolarHBondContact O-CB 3.45Å; V42-L46 WeakPolarHBondContact O-CG 3.47Å; V42-L46 PolarHBondContact O-N 3.26Å; V42-V67 HydrophobicContact CG1-CG1 4.28Å; V42-V71 HydrophobicContact CG2-CG1 4.35Å; V42-V71 HydrophobicContact CG2-CG2 3.96Å; V42-F137 HydrophobicContact CG1-CE2 4.33Å; V42-F137 HydrophobicContact CG1-CZ 4.17Å; V42-W141 HydrophobicContact CG2-CZ2 4.48Å
43	K	94.4	Very high	90.3	Very high	140 Å²	140	82.5 Å²	82.5	61%	0.609	38%	0.383	S	S	*	.	H	α-helix	trans	-61.1	-39.2	179.6	-75.9	-179.1	177.4	-179.2	0	112.8	V39 R40 R47	V39-K43 HydrophobicContact CG1-CD 3.89Å; V39-K43 HydrophobicContact CG1-CG 4.36Å; V39-K43 WeakPolarHBondContact O-CB 3.29Å; V39-K43 WeakPolarHBondContact O-CG 3.42Å; V39-K43 PolarHBondContact O-N 3Å; R40-K43 PolarHBondContact O-N 3.43Å; K43-R47 WeakPolarHBondContact O-CB 3.38Å; K43-R47 PolarHBondContact O-N 3.39Å
44	M	93.7	Very high	90.6	Very high	93 Å²	93	88.4 Å²	88.4	46%	0.458	41%	0.411	S	S	.	.	H	α-helix	trans	-64.3	-47	177.6	-76.2	-177	64.9	0	0	111.3	R40 S41 V42 R47 K48	R40-M44 HydrophobicContact CG-CG 4.27Å; R40-M44 HydrophobicContact CG-SD 3.87Å; R40-M44 WeakPolarHBondContact O-CB 3.27Å; R40-M44 VanDerWaalsContact O-CG 3.28Å; R40-M44 WeakPolarHBondContact O-CG 3.38Å; R40-M44 PolarHBondContact O-N 2.82Å; S41-M44 PolarHBondContact O-N 3.27Å; V42-M44 VanDerWaalsContact C-N 3.33Å; V42-M44 PolarHBondContact O-N 3.13Å; M44-R47 PolarHBondContact O-N 2.89Å; M44-K48 WeakPolarHBondContact O-CG 3.24Å; M44-K48 PolarHBondContact O-N 3.4Å; M44-K48 VanDerWaalsContact O-N 3.16Å
45	A	93.6	Very high	91.1	Very high	0 Å²	0	84.2 Å²	84.2	0%	0	40%	0.396	C	S	.	.	H	α-helix	trans	-62.5	-46.1	176.7	0	0	0	0	0	111.8	S41 V42 R47 K48 V49 F137 W141	S41-A45 PolarHBondContact O-N 2.97Å; S41-A45 VanDerWaalsContact O-N 3.1Å; V42-A45 PolarHBondContact O-N 3.44Å; A45-R47 PolarHBondContact O-N 3.35Å; A45-K48 PolarHBondContact O-N 3.38Å; A45-V49 WeakPolarHBondContact O-CG2 3.31Å; A45-V49 PolarHBondContact O-N 2.9Å; A45-F137 HydrophobicContact CB-CD2 3.79Å; A45-F137 HydrophobicContact CB-CE2 3.52Å; A45-F137 HydrophobicContact CB-CZ 4.4Å; A45-W141 HydrophobicContact CB-CB 3.81Å; A45-W141 HydrophobicContact CB-CG 4.31Å
46	L	94.8	Very high	91.4	Very high	24 Å²	24	81.7 Å²	81.7	13%	0.126	40%	0.396	C	S	.	.	H	α-helix	trans	-56.3	-50.7	175.4	-78.8	173.2	0	0	0	111.9	V42 K48 V49 L50 L63 L64 V67 F137	V42-L46 HydrophobicContact CG1-CD1 3.93Å; V42-L46 HydrophobicContact CG1-CG 4.39Å; V42-L46 WeakPolarHBondContact O-CB 3.45Å; V42-L46 WeakPolarHBondContact O-CG 3.47Å; V42-L46 PolarHBondContact O-N 3.26Å; L46-K48 PolarHBondContact O-N 2.95Å; L46-V49 PolarHBondContact O-N 3.01Å; L46-L50 HydrophobicContact CB-CD1 4.49Å; L46-L50 HydrophobicContact CD2-CD1 4.15Å; L46-L50 VanDerWaalsContact O-CB 3.29Å; L46-L50 WeakPolarHBondContact O-CB 3.47Å; L46-L50 WeakPolarHBondContact O-CG 3.46Å; L46-L50 PolarHBondContact O-N 3.23Å; L46-L63 HydrophobicContact CD2-CD2 4Å; L46-L64 HydrophobicContact CD1-CD2 3.86Å; L46-L64 HydrophobicContact CD2-CD2 4.28Å; L46-V67 HydrophobicContact CD2-CG1 4.29Å; L46-V67 HydrophobicContact CD2-CG2 4.1Å; L46-F137 HydrophobicContact CD2-CD2 3.86Å; L46-F137 HydrophobicContact CD2-CE2 4.05Å; L46-F137 HydrophobicContact CG-CD2 4.02Å; L46-F137 HydrophobicContact CG-CE2 3.79Å
47	R	94.1	Very high	91.6	Very high	208 Å²	208	85.2 Å²	85.2	79%	0.785	41%	0.413	S	S	*	.	H	α-helix	trans	-57.9	-35.9	179.7	-177.1	176.8	179.9	178.2	1.5	112.3	K43 M44 A45 G51	K43-R47 WeakPolarHBondContact O-CB 3.38Å; K43-R47 PolarHBondContact O-N 3.39Å; M44-R47 PolarHBondContact O-N 2.89Å; A45-R47 PolarHBondContact O-N 3.35Å; R47-G51 PolarHBondContact O-N 3.31Å
48	K	93.4	Very high	91.8	Very high	128 Å²	128	82.3 Å²	82.3	56%	0.557	42%	0.417	S	S	*	.	H	α-helix	trans	-76.7	-33.7	-179.6	-69.6	-66.4	-177	-178.1	0	113	M44 A45 L46 R140	M44-K48 WeakPolarHBondContact O-CG 3.24Å; M44-K48 PolarHBondContact O-N 3.4Å; M44-K48 VanDerWaalsContact O-N 3.16Å; A45-K48 PolarHBondContact O-N 3.38Å; L46-K48 PolarHBondContact O-N 2.95Å; K48-R140 VanDerWaalsContact CB-CZ 3.5Å
49	V	92.9	Very high	91.9	Very high	14 Å²	14	81.7 Å²	81.7	9%	0.085	41%	0.413	C	S	.	.	H	α-helix	trans	-81.4	-42	179.5	171.4	0	0	0	0	111.9	A45 L46 G51 L133 H136 F137	A45-V49 WeakPolarHBondContact O-CG2 3.31Å; A45-V49 PolarHBondContact O-N 2.9Å; L46-V49 PolarHBondContact O-N 3.01Å; V49-G51 VanDerWaalsContact C-N 3.3Å; V49-G51 PolarHBondContact O-N 2.86Å; V49-L133 HydrophobicContact CG1-CB 4.23Å; V49-L133 HydrophobicContact CG1-CD2 4.04Å; V49-L133 WeakPolarHBondContact CG1-O 3.48Å; V49-H136 HydrophobicContact CG1-CB 4.19Å; V49-H136 HydrophobicContact CG2-CB 4.37Å; V49-F137 HydrophobicContact CG1-CB 4.4Å; V49-F137 HydrophobicContact CG2-CB 4.24Å
50	L	92.7	Very high	91.9	Very high	30 Å²	30	81.8 Å²	81.8	16%	0.157	41%	0.41	C	S	.	.	S	Bend	trans	-81.3	-4.7	-177.5	-63	180	0	0	0	113.9	L46 H52 A53 L55 M60 L63 L133	L46-L50 HydrophobicContact CB-CD1 4.49Å; L46-L50 HydrophobicContact CD2-CD1 4.15Å; L46-L50 VanDerWaalsContact O-CB 3.29Å; L46-L50 WeakPolarHBondContact O-CB 3.47Å; L46-L50 WeakPolarHBondContact O-CG 3.46Å; L46-L50 PolarHBondContact O-N 3.23Å; L50-H52 VanDerWaalsContact C-N 3.34Å; L50-H52 PolarHBondContact O-N 2.98Å; L50-A53 HydrophobicContact CB-CB 4.46Å; L50-A53 HydrophobicContact CD2-CB 4.16Å; L50-A53 WeakPolarHBondContact O-CB 3.38Å; L50-A53 PolarHBondContact O-N 2.87Å; L50-L55 HydrophobicContact CD2-CD1 3.7Å; L50-M60 HydrophobicContact CD1-CE 4.09Å; L50-M60 HydrophobicContact CD1-SD 3.94Å; L50-L63 HydrophobicContact CD1-CD2 4.41Å; L50-L63 HydrophobicContact CD2-CD1 3.82Å; L50-L63 HydrophobicContact CD2-CD2 4.17Å; L50-L133 HydrophobicContact CD2-CD1 4.27Å
51	G	87.5	Confident	92.1	Very high	53 Å²	53	75.6 Å²	75.6	55%	0.546	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-30.5	-59.3	-167.4	0	0	0	0	0	116.2	R47 V49	R47-G51 PolarHBondContact O-N 3.31Å; V49-G51 VanDerWaalsContact C-N 3.3Å; V49-G51 PolarHBondContact O-N 2.86Å
52	H	84.9	Confident	92.1	Very high	193 Å²	193	78.1 Å²	78.1	89%	0.894	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.2	21.7	174.7	-62.9	-72.9	0	0	0	112.9	L50	L50-H52 VanDerWaalsContact C-N 3.34Å; L50-H52 PolarHBondContact O-N 2.98Å
53	A	89.3	Confident	92.1	Very high	25 Å²	25	77 Å²	77	21%	0.207	41%	0.408	C	S	.	.			trans	-68.9	133.6	178.1	0	0	0	0	0	110.4	L50 Y129 L133	L50-A53 HydrophobicContact CB-CB 4.46Å; L50-A53 HydrophobicContact CD2-CB 4.16Å; L50-A53 WeakPolarHBondContact O-CB 3.38Å; L50-A53 PolarHBondContact O-N 2.87Å; A53-Y129 VanDerWaalsContact CA-OH 3.29Å; A53-Y129 WeakPolarHBondContact CA-OH 3.31Å; A53-Y129 WeakPolarHBondContact CB-OH 3.17Å; A53-L133 HydrophobicContact CB-CD1 4.07Å; A53-L133 HydrophobicContact CB-CD2 4.31Å
54	L	90.1	Very high	92.1	Very high	138 Å²	138	74 Å²	74	72%	0.723	40%	0.398	S	S	*	.			trans	-101.1	107.5	175.4	-62.7	176.7	0	0	0	108.4	R126	L54-R126 PolarHBondContact O-NH1 3.14Å; L54-R126 PolarHBondContact O-NH2 2.78Å
55	L	90.6	Very high	92.1	Very high	35 Å²	35	72.1 Å²	72.1	18%	0.183	40%	0.397	C	S	.	.			trans	-127.1	136.8	179.2	-63.7	169.6	0	0	0	108.3	L50 E59 M60 L63 Y129 Q130 L133	L50-L55 HydrophobicContact CD2-CD1 3.7Å; L55-E59 HydrophobicContact CB-CB 4.19Å; L55-E59 HydrophobicContact CD2-CB 3.96Å; L55-M60 HydrophobicContact CD1-CE 4.36Å; L55-M60 HydrophobicContact CD1-SD 4.39Å; L55-L63 HydrophobicContact CD1-CD1 3.85Å; L55-Y129 HydrophobicContact CD2-CD1 4.39Å; L55-Y129 HydrophobicContact CD2-CE1 4Å; L55-Q130 HydrophobicContact CD2-CG 4.27Å; L55-L133 HydrophobicContact CD1-CD1 4.08Å; L55-L133 HydrophobicContact CD2-CD1 3.97Å; L55-L133 HydrophobicContact CG-CD1 4.33Å
56	T	91.5	Very high	92	Very high	83 Å²	83	74.6 Å²	74.6	51%	0.509	41%	0.409	S	S	.	.			trans	-69.9	168.3	165.4	69	0	0	0	0	110	A58 E59 M60	T56-A58 VanDerWaalsContact C-N 3.29Å; T56-A58 PolarHBondContact O-N 2.9Å; T56-E59 WeakPolarHBondContact CG2-OE2 3.35Å; T56-E59 PolarHBondContact N-OE2 3.27Å; T56-E59 PolarHBondContact O-N 3.37Å; T56-E59 VanDerWaalsContact OG1-CG 3.24Å; T56-E59 WeakPolarHBondContact OG1-CG 3.28Å; T56-E59 PolarHBondContact OG1-N 2.9Å; T56-E59 PolarHBondContact OG1-OE2 3.29Å; T56-M60 PolarHBondContact O-N 3.44Å
57	E	92.8	Very high	92	Very high	182 Å²	182	73.6 Å²	73.6	85%	0.85	40%	0.404	S	S	*	.	H	α-helix	trans	-54.8	-45.6	176.3	-176.8	-179.1	-179.1	0	0	112.2	E59 M60 G61	E57-E59 PolarHBondContact O-N 3.1Å; E57-M60 PolarHBondContact O-N 3.43Å; E57-G61 PolarHBondContact O-N 3.2Å
58	A	91.3	Very high	92	Very high	71 Å²	71	69.5 Å²	69.5	59%	0.587	39%	0.393	S	S	*	.	H	α-helix	trans	-61.5	-43.7	178.7	0	0	0	0	0	111.7	T56 G61 T62	T56-A58 VanDerWaalsContact C-N 3.29Å; T56-A58 PolarHBondContact O-N 2.9Å; A58-G61 PolarHBondContact O-N 2.87Å; A58-T62 PolarHBondContact O-N 3.4Å; A58-T62 PolarHBondContact O-OG1 3.43Å; A58-T62 VanDerWaalsContact O-OG1 3.13Å
59	E	91.6	Very high	91.9	Very high	21 Å²	21	64.4 Å²	64.4	10%	0.098	38%	0.375	C	S	.	.	H	α-helix	trans	-70.6	-33.3	-179.9	-58.8	176.9	114.6	0	0	112.4	L55 T56 E57 L63 R126 Q130	L55-E59 HydrophobicContact CB-CB 4.19Å; L55-E59 HydrophobicContact CD2-CB 3.96Å; T56-E59 WeakPolarHBondContact CG2-OE2 3.35Å; T56-E59 PolarHBondContact N-OE2 3.27Å; T56-E59 PolarHBondContact O-N 3.37Å; T56-E59 VanDerWaalsContact OG1-CG 3.24Å; T56-E59 WeakPolarHBondContact OG1-CG 3.28Å; T56-E59 PolarHBondContact OG1-N 2.9Å; T56-E59 PolarHBondContact OG1-OE2 3.29Å; E57-E59 PolarHBondContact O-N 3.1Å; E59-L63 VanDerWaalsContact O-CB 3.27Å; E59-L63 WeakPolarHBondContact O-CB 3.2Å; E59-L63 PolarHBondContact O-N 3.02Å; E59-R126 IonicContact OE1-CZ 3.19Å; E59-R126 IonicContact OE1-NE 2.77Å; E59-R126 PolarHBondContact OE1-NE 3.31Å; E59-R126 IonicContact OE1-NH2 2.88Å; E59-R126 PolarHBondContact OE1-NH2 3.17Å; E59-R126 IonicContact OE2-CZ 3.63Å; E59-R126 IonicContact OE2-NE 3.83Å; E59-R126 IonicContact OE2-NH2 2.67Å; E59-R126 PolarHBondContact OE2-NH2 3.02Å; E59-Q130 PolarHBondContact OE1-NE2 3.18Å
60	M	93.9	Very high	91.8	Very high	71 Å²	71	65.8 Å²	65.8	35%	0.35	38%	0.38	S	S	.	.	H	α-helix	trans	-63.7	-44.7	170.5	-178.4	68.4	79.6	0	0	110.5	L50 L55 T56 E57 L63 L64	L50-M60 HydrophobicContact CD1-CE 4.09Å; L50-M60 HydrophobicContact CD1-SD 3.94Å; L55-M60 HydrophobicContact CD1-CE 4.36Å; L55-M60 HydrophobicContact CD1-SD 4.39Å; T56-M60 PolarHBondContact O-N 3.44Å; E57-M60 PolarHBondContact O-N 3.43Å; M60-L63 PolarHBondContact O-N 2.77Å; M60-L64 HydrophobicContact CG-CD1 4.03Å; M60-L64 HydrophobicContact CG-CG 4.38Å; M60-L64 WeakPolarHBondContact O-CB 3.4Å; M60-L64 VanDerWaalsContact O-CG 3.27Å; M60-L64 WeakPolarHBondContact O-CG 3.25Å; M60-L64 PolarHBondContact O-N 3.31Å; M60-L64 HydrophobicContact SD-CD1 4.37Å; M60-L64 HydrophobicContact SD-CG 4.29Å
61	G	94.6	Very high	91.7	Very high	42 Å²	42	65 Å²	65	43%	0.433	38%	0.376	S	S	.	.	H	α-helix	trans	-57.8	-48.8	175.8	0	0	0	0	0	112.3	E57 A58 L64 A65	E57-G61 PolarHBondContact O-N 3.2Å; A58-G61 PolarHBondContact O-N 2.87Å; G61-L64 PolarHBondContact O-N 2.82Å; G61-A65 PolarHBondContact O-N 2.85Å
62	T	92.4	Very high	91.9	Very high	64 Å²	64	63.7 Å²	63.7	39%	0.393	36%	0.357	S	S	.	.	H	α-helix	trans	-60.7	-47	176	-55.6	0	0	0	0	111.7	A58 L64 A65 E66	A58-T62 PolarHBondContact O-N 3.4Å; A58-T62 PolarHBondContact O-OG1 3.43Å; A58-T62 VanDerWaalsContact O-OG1 3.13Å; T62-L64 VanDerWaalsContact C-N 3.33Å; T62-L64 PolarHBondContact O-N 3.37Å; T62-A65 PolarHBondContact O-N 3.44Å; T62-E66 PolarHBondContact O-N 3.49Å
63	L	93.3	Very high	92	Very high	2 Å²	2	56.1 Å²	56.1	1%	0.01	33%	0.328	C	S	.	.	H	α-helix	trans	-60.7	-42.9	178.8	-177.8	148.3	0	0	0	111.7	L46 L50 L55 E59 M60 E66 V67 L133 V134	L46-L63 HydrophobicContact CD2-CD2 4Å; L50-L63 HydrophobicContact CD1-CD2 4.41Å; L50-L63 HydrophobicContact CD2-CD1 3.82Å; L50-L63 HydrophobicContact CD2-CD2 4.17Å; L55-L63 HydrophobicContact CD1-CD1 3.85Å; E59-L63 VanDerWaalsContact O-CB 3.27Å; E59-L63 WeakPolarHBondContact O-CB 3.2Å; E59-L63 PolarHBondContact O-N 3.02Å; M60-L63 PolarHBondContact O-N 2.77Å; L63-E66 PolarHBondContact O-N 3.34Å; L63-V67 HydrophobicContact CD2-CG2 3.98Å; L63-V67 WeakPolarHBondContact O-CB 3.43Å; L63-V67 VanDerWaalsContact O-CG2 3.24Å; L63-V67 WeakPolarHBondContact O-CG2 3.37Å; L63-V67 PolarHBondContact O-N 2.97Å; L63-L133 HydrophobicContact CD1-CB 3.67Å; L63-L133 HydrophobicContact CD1-CD1 3.81Å; L63-L133 HydrophobicContact CD1-CG 4.42Å; L63-V134 HydrophobicContact CD1-CG2 4.38Å; L63-V134 HydrophobicContact CG-CG2 3.97Å
64	L	94.9	Very high	91.9	Very high	76 Å²	76	55.9 Å²	55.9	40%	0.398	32%	0.321	S	S	.	.	H	α-helix	trans	-65.3	-39	178.3	-71.9	175.4	0	0	0	111.9	L46 M60 G61 T62 V67 E68	L46-L64 HydrophobicContact CD1-CD2 3.86Å; L46-L64 HydrophobicContact CD2-CD2 4.28Å; M60-L64 HydrophobicContact CG-CD1 4.03Å; M60-L64 HydrophobicContact CG-CG 4.38Å; M60-L64 WeakPolarHBondContact O-CB 3.4Å; M60-L64 VanDerWaalsContact O-CG 3.27Å; M60-L64 WeakPolarHBondContact O-CG 3.25Å; M60-L64 PolarHBondContact O-N 3.31Å; M60-L64 HydrophobicContact SD-CD1 4.37Å; M60-L64 HydrophobicContact SD-CG 4.29Å; G61-L64 PolarHBondContact O-N 2.82Å; T62-L64 VanDerWaalsContact C-N 3.33Å; T62-L64 PolarHBondContact O-N 3.37Å; L64-V67 PolarHBondContact O-N 3.3Å; L64-E68 WeakPolarHBondContact O-CB 3.33Å; L64-E68 PolarHBondContact O-N 2.94Å
65	A	94.1	Very high	91.7	Very high	54 Å²	54	53.2 Å²	53.2	45%	0.446	31%	0.313	S	S	.	.	H	α-helix	trans	-64.8	-41.5	175.1	0	0	0	0	0	112.1	G61 T62 E68 A69	G61-A65 PolarHBondContact O-N 2.85Å; T62-A65 PolarHBondContact O-N 3.44Å; A65-E68 PolarHBondContact O-N 3.4Å; A65-A69 WeakPolarHBondContact O-CB 3.4Å; A65-A69 PolarHBondContact O-N 2.85Å
66	E	92.5	Very high	91.4	Very high	52 Å²	52	55.1 Å²	55.1	24%	0.243	32%	0.323	C	S	.	.	H	α-helix	trans	-65.8	-40.5	174.7	-72.5	-173.5	-155.7	0	0	111.9	T62 L63 A69 K70 Q131 V134	T62-E66 PolarHBondContact O-N 3.49Å; L63-E66 PolarHBondContact O-N 3.34Å; E66-A69 PolarHBondContact O-N 2.64Å; E66-K70 WeakPolarHBondContact O-CG 3.35Å; E66-K70 PolarHBondContact O-N 3.26Å; E66-Q131 VanDerWaalsContact CD-NE2 3.35Å; E66-Q131 PolarHBondContact OE1-NE2 2.64Å; E66-Q131 PolarHBondContact OE2-NE2 2.85Å; E66-V134 HydrophobicContact CB-CG1 4.1Å; E66-V134 HydrophobicContact CB-CG2 3.95Å; E66-V134 WeakPolarHBondContact OE2-CG2 3.48Å
67	V	93	Very high	90.8	Very high	4 Å²	4	55.2 Å²	55.2	2%	0.024	32%	0.323	C	S	.	.	H	α-helix	trans	-62.5	-45.4	174.2	162.6	0	0	0	0	111.3	V42 L46 L63 L64 A69 K70 V71 F137	V42-V67 HydrophobicContact CG1-CG1 4.28Å; L46-V67 HydrophobicContact CD2-CG1 4.29Å; L46-V67 HydrophobicContact CD2-CG2 4.1Å; L63-V67 HydrophobicContact CD2-CG2 3.98Å; L63-V67 WeakPolarHBondContact O-CB 3.43Å; L63-V67 VanDerWaalsContact O-CG2 3.24Å; L63-V67 WeakPolarHBondContact O-CG2 3.37Å; L63-V67 PolarHBondContact O-N 2.97Å; L64-V67 PolarHBondContact O-N 3.3Å; V67-A69 VanDerWaalsContact C-N 3.33Å; V67-A69 PolarHBondContact O-N 3.07Å; V67-K70 PolarHBondContact O-N 3.24Å; V67-V71 HydrophobicContact CG1-CG2 4.49Å; V67-V71 VanDerWaalsContact O-CG2 3.32Å; V67-V71 WeakPolarHBondContact O-CG2 3.36Å; V67-V71 PolarHBondContact O-N 2.92Å; V67-F137 HydrophobicContact CB-CD1 4.31Å; V67-F137 HydrophobicContact CB-CE1 4.19Å; V67-F137 HydrophobicContact CG1-CD1 4.01Å; V67-F137 HydrophobicContact CG1-CD2 4.42Å; V67-F137 HydrophobicContact CG1-CE1 3.47Å; V67-F137 VanDerWaalsContact CG1-CE1 3.47Å; V67-F137 HydrophobicContact CG1-CE2 3.9Å; V67-F137 HydrophobicContact CG1-CG 4.47Å; V67-F137 HydrophobicContact CG1-CZ 3.4Å; V67-F137 VanDerWaalsContact CG1-CZ 3.4Å; V67-F137 HydrophobicContact CG2-CB 4.37Å; V67-F137 HydrophobicContact CG2-CD1 3.65Å; V67-F137 HydrophobicContact CG2-CD2 4.28Å; V67-F137 HydrophobicContact CG2-CE1 4.02Å; V67-F137 HydrophobicContact CG2-CG 3.81Å; V67-F137 HydrophobicContact CG2-CZ 4.47Å
68	E	94	Very high	90.2	Very high	122 Å²	122	52.4 Å²	52.4	57%	0.57	31%	0.308	S	S	*	.	H	α-helix	trans	-56.8	-48.6	174.5	175.9	-178.6	-179.1	0	0	110.7	L64 A65 K70 V71 N72	L64-E68 WeakPolarHBondContact O-CB 3.33Å; L64-E68 PolarHBondContact O-N 2.94Å; A65-E68 PolarHBondContact O-N 3.4Å; E68-K70 PolarHBondContact O-N 2.91Å; E68-V71 PolarHBondContact O-N 3.46Å; E68-N72 WeakPolarHBondContact CG-ND2 3.46Å; E68-N72 WeakPolarHBondContact O-CB 3.37Å; E68-N72 PolarHBondContact O-N 3.48Å; E68-N72 PolarHBondContact O-ND2 2.95Å
69	A	92.1	Very high	89.8	Confident	21 Å²	21	53.7 Å²	53.7	17%	0.174	31%	0.308	C	S	.	.	H	α-helix	trans	-57.8	-48.4	177.4	0	0	0	0	0	111.2	A65 E66 V67 V71 N72 A73 F92	A65-A69 WeakPolarHBondContact O-CB 3.4Å; A65-A69 PolarHBondContact O-N 2.85Å; E66-A69 PolarHBondContact O-N 2.64Å; V67-A69 VanDerWaalsContact C-N 3.33Å; V67-A69 PolarHBondContact O-N 3.07Å; A69-V71 PolarHBondContact O-N 2.94Å; A69-N72 CarbonylContact O-C 3.59Å; A69-N72 PolarHBondContact O-N 3.37Å; A69-N72 VanDerWaalsContact O-N 3.15Å; A69-A73 WeakPolarHBondContact O-CB 3.35Å; A69-A73 PolarHBondContact O-N 2.82Å; A69-F92 HydrophobicContact CB-CE2 4.38Å; A69-F92 HydrophobicContact CB-CZ 4Å; A69-F92 WeakPolarHBondContact O-CE2 3.42Å
70	K	90	Very high	89.3	Confident	43 Å²	43	55 Å²	55	19%	0.187	32%	0.32	C	S	.	.	H	α-helix	trans	-61	-42.5	177.9	-69.2	-70.2	178.2	-175.8	0	112.6	E66 V67 E68 N72 A73 R74 E102 V134 W138	E66-K70 WeakPolarHBondContact O-CG 3.35Å; E66-K70 PolarHBondContact O-N 3.26Å; V67-K70 PolarHBondContact O-N 3.24Å; E68-K70 PolarHBondContact O-N 2.91Å; K70-N72 VanDerWaalsContact C-N 3.31Å; K70-N72 PolarHBondContact O-N 3.43Å; K70-A73 PolarHBondContact O-N 2.95Å; K70-R74 PolarHBondContact O-N 3.33Å; K70-E102 IonicContact NZ-OE1 3.69Å; K70-E102 PolarHBondContact NZ-OE1 3.25Å; K70-E102 IonicContact NZ-OE2 3.73Å; K70-E102 PolarHBondContact NZ-OE2 3.44Å; K70-V134 HydrophobicContact CG-CG1 4.5Å; K70-W138 HydrophobicContact CB-CD2 4.22Å; K70-W138 HydrophobicContact CB-CE3 3.6Å; K70-W138 HydrophobicContact CB-CZ3 3.86Å; K70-W138 HydrophobicContact CD-CD2 4.39Å; K70-W138 HydrophobicContact CG-CE3 4.43Å; K70-W138 WeakPolarHBondContact O-CH2 3.19Å; K70-W138 WeakPolarHBondContact O-CZ3 3.25Å
71	V	91.5	Very high	88.6	Confident	12 Å²	12	61 Å²	61	7%	0.073	35%	0.347	C	S	.	.	H	α-helix	trans	-65.1	-35.9	176.6	172.9	0	0	0	0	111.7	V42 V67 E68 A69 R74 F137 W141	V42-V71 HydrophobicContact CG2-CG1 4.35Å; V42-V71 HydrophobicContact CG2-CG2 3.96Å; V67-V71 HydrophobicContact CG1-CG2 4.49Å; V67-V71 VanDerWaalsContact O-CG2 3.32Å; V67-V71 WeakPolarHBondContact O-CG2 3.36Å; V67-V71 PolarHBondContact O-N 2.92Å; E68-V71 PolarHBondContact O-N 3.46Å; A69-V71 PolarHBondContact O-N 2.94Å; V71-R74 WeakPolarHBondContact O-CB 3.28Å; V71-R74 WeakPolarHBondContact O-CD 3.46Å; V71-R74 WeakPolarHBondContact O-CG 3.04Å; V71-R74 PolarHBondContact O-NH1 3.22Å; V71-F137 HydrophobicContact CG2-CE1 4.17Å; V71-F137 HydrophobicContact CG2-CZ 4.18Å; V71-W141 HydrophobicContact CG1-CH2 4.27Å; V71-W141 HydrophobicContact CG1-CZ2 4.12Å; V71-W141 HydrophobicContact CG2-CD2 4.33Å; V71-W141 HydrophobicContact CG2-CE3 4.49Å; V71-W141 HydrophobicContact CG2-CH2 4.37Å; V71-W141 HydrophobicContact CG2-CZ2 4.17Å
72	N	91.3	Very high	88	Confident	27 Å²	27	62.8 Å²	62.8	14%	0.144	35%	0.347	C	S	.	.	H	α-helix	trans	-80.9	-18.7	177.8	-73.2	-27.6	0	0	0	113.7	E68 A69 K70 R74 P91 F92 L95	E68-N72 WeakPolarHBondContact CG-ND2 3.46Å; E68-N72 WeakPolarHBondContact O-CB 3.37Å; E68-N72 PolarHBondContact O-N 3.48Å; E68-N72 PolarHBondContact O-ND2 2.95Å; A69-N72 CarbonylContact O-C 3.59Å; A69-N72 PolarHBondContact O-N 3.37Å; A69-N72 VanDerWaalsContact O-N 3.15Å; K70-N72 VanDerWaalsContact C-N 3.31Å; K70-N72 PolarHBondContact O-N 3.43Å; N72-R74 VanDerWaalsContact C-N 3.28Å; N72-P91 HydrophobicContact CB-CB 4.22Å; N72-P91 WeakPolarHBondContact O-CB 3.44Å; N72-P91 WeakPolarHBondContact O-CD 3.48Å; N72-P91 WeakPolarHBondContact O-CG 3.31Å; N72-F92 HydrophobicContact CB-CD1 4.48Å; N72-F92 HydrophobicContact CB-CD2 3.69Å; N72-F92 HydrophobicContact CB-CE1 4.35Å; N72-F92 HydrophobicContact CB-CE2 3.59Å; N72-F92 HydrophobicContact CB-CG 4.19Å; N72-F92 HydrophobicContact CB-CZ 3.94Å; N72-F92 WeakPolarHBondContact O-CD2 3.26Å; N72-F92 PolarHBondContact O-N 2.73Å; N72-F92 VanDerWaalsContact O-N 3.14Å; N72-L95 HydrophobicContact CB-CD1 4.22Å
73	A	88	Confident	87.2	Confident	34 Å²	34	65.7 Å²	65.7	28%	0.281	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-4.5	171.7	0	0	0	0	0	112.9	A69 K70 F92	A69-A73 WeakPolarHBondContact O-CB 3.35Å; A69-A73 PolarHBondContact O-N 2.82Å; K70-A73 PolarHBondContact O-N 2.95Å; A73-F92 HydrophobicContact CB-CD2 4.09Å; A73-F92 HydrophobicContact CB-CE2 4.03Å
74	R	86.6	Confident	86.6	Confident	19 Å²	19	74.2 Å²	74.2	7%	0.072	40%	0.404	C	S	.	.	S	Bend	trans	-60.7	137.6	-179.3	82	-174.2	-178.6	-85.6	-0.7	111.6	Y34 K70 V71 N72 L76 T90 P91 W138 W141 Y145	Y34-R74 PolarHBondContact OH-NH2 3.06Å; K70-R74 PolarHBondContact O-N 3.33Å; V71-R74 WeakPolarHBondContact O-CB 3.28Å; V71-R74 WeakPolarHBondContact O-CD 3.46Å; V71-R74 WeakPolarHBondContact O-CG 3.04Å; V71-R74 PolarHBondContact O-NH1 3.22Å; N72-R74 VanDerWaalsContact C-N 3.28Å; R74-L76 HydrophobicContact CG-CD2 4.38Å; R74-T90 WeakPolarHBondContact O-CB 3.15Å; R74-P91 HydrophobicContact CG-CG 4.12Å; R74-P91 WeakPolarHBondContact O-CD 3.25Å; R74-W138 HydrophobicContact CB-CH2 4.49Å; R74-W141 HydrophobicContact CB-CH2 4.48Å; R74-Y145 PolarHBondContact NE-OH 3.48Å
75	P	85.4	Confident	85.9	Confident	83 Å²	83	72.8 Å²	72.8	54%	0.539	40%	0.397	S	S	.	.			trans	-62.8	137.2	170	-23.3	34.3	0	0	0	112.1	V88	P75-V88 HydrophobicContact CB-CB 4.15Å; P75-V88 HydrophobicContact CB-CG1 4.23Å; P75-V88 HydrophobicContact CB-CG2 4.43Å; P75-V88 HydrophobicContact CG-CG2 4.4Å
76	L	84.5	Confident	85.1	Confident	75 Å²	75	75.6 Å²	75.6	39%	0.393	41%	0.408	S	S	.	.			trans	-103.6	-49.5	172	-59.3	175.6	0	0	0	111.5	R74 L89 P91 F94	R74-L76 HydrophobicContact CG-CD2 4.38Å; L76-L89 WeakPolarHBondContact CB-O 3.44Å; L76-L89 PolarHBondContact N-O 3.38Å; L76-P91 HydrophobicContact CD1-CG 4.24Å; L76-P91 HydrophobicContact CD2-CG 4.23Å; L76-P91 HydrophobicContact CG-CG 4.36Å; L76-F94 HydrophobicContact CD1-CD2 4.38Å; L76-F94 HydrophobicContact CD1-CE2 3.91Å
77	T	79	Confident	84.6	Confident	84 Å²	84	77.7 Å²	77.7	52%	0.515	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.2	165.8	-179.8	-174.6	0	0	0	0	109.5	L89	T77-L89 HydrophobicContact CG2-CB 3.99Å; T77-L89 HydrophobicContact CG2-CD2 3.99Å; T77-L89 PolarHBondContact O-N 2.86Å
78	F	79.6	Confident	84.1	Confident	123 Å²	123	79.4 Å²	79.4	54%	0.539	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	150.4	164.7	-65	-74.3	0	0	0	110.6	N87 V88	F78-N87 WeakPolarHBondContact CA-O 3.18Å; F78-V88 HydrophobicContact CD1-CG1 4.03Å; F78-V88 HydrophobicContact CE1-CG1 3.93Å
79	V	83	Confident	83.7	Confident	98 Å²	98	75.8 Å²	75.8	59%	0.594	42%	0.415	S	S	*	.	S	Bend	trans	-79.6	-33.4	175.8	-179.4	0	0	0	0	111.1	N87 L89	V79-N87 PolarHBondContact N-O 3.45Å; V79-N87 VanDerWaalsContact N-O 3.09Å; V79-L89 HydrophobicContact CG2-CB 4.13Å
80	S	81	Confident	83.5	Confident	49 Å²	49	75 Å²	75	34%	0.343	41%	0.408	S	S	.	.			trans	-112.8	157	-177.6	-178	0	0	0	0	111.4	D82 D85	S80-D82 PolarHBondContact OG-N 2.89Å; S80-D85 WeakPolarHBondContact CB-OD2 3.24Å
81	E	79.2	Confident	83.5	Confident	198 Å²	198	73.6 Å²	73.6	93%	0.925	40%	0.404	S	S	*	.	S	Bend	trans	-85	-12.1	168.7	-62.6	-171.3	166.2	0	0	112.2	P83	E81-P83 VanDerWaalsContact O-CD 3.32Å; E81-P83 WeakPolarHBondContact O-CD 3.32Å
82	D	82.7	Confident	83.5	Confident	78 Å²	78	74.1 Å²	74.1	42%	0.417	41%	0.405	S	S	.	.			trans	-68.1	117.7	176.2	-175.7	-6	0	0	0	109.8	S80 K84 D85	S80-D82 PolarHBondContact OG-N 2.89Å; D82-K84 PolarHBondContact O-N 3.13Å; D82-K84 WeakPolarHBondContact OD1-CB 3.36Å; D82-K84 PolarHBondContact OD1-N 3.37Å; D82-D85 HydrophobicContact CB-CB 4.24Å; D82-D85 PolarHBondContact O-N 2.82Å
83	P	76	Confident	83.5	Confident	125 Å²	125	75.4 Å²	75.4	81%	0.812	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-14.2	178.1	26.5	-36.3	0	0	0	114	E81	E81-P83 VanDerWaalsContact O-CD 3.32Å; E81-P83 WeakPolarHBondContact O-CD 3.32Å
84	K	81.3	Confident	83.6	Confident	181 Å²	181	80.7 Å²	80.7	79%	0.787	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-19.3	173.7	-62.1	179.2	-178.5	177.4	0	112.9	D82 V86	D82-K84 PolarHBondContact O-N 3.13Å; D82-K84 WeakPolarHBondContact OD1-CB 3.36Å; D82-K84 PolarHBondContact OD1-N 3.37Å; K84-V86 PolarHBondContact O-N 3.37Å
85	D	79.4	Confident	83.8	Confident	47 Å²	47	85 Å²	85	25%	0.251	45%	0.451	S	S	.	.			trans	-88.5	106.2	178	-174	2.7	0	0	0	110.1	S80 D82 N87	S80-D85 WeakPolarHBondContact CB-OD2 3.24Å; D82-D85 HydrophobicContact CB-CB 4.24Å; D82-D85 PolarHBondContact O-N 2.82Å; D85-N87 VanDerWaalsContact C-N 3.29Å; D85-N87 WeakPolarHBondContact OD1-CB 3.4Å; D85-N87 PolarHBondContact OD1-N 3.11Å; D85-N87 PolarHBondContact OD1-ND2 2.88Å
86	V	76.4	Confident	84	Confident	112 Å²	112	85 Å²	85	68%	0.679	45%	0.446	S	S	*	.			trans	-90.2	10.3	-178.9	-64.4	0	0	0	0	113.1	K84 V88	K84-V86 PolarHBondContact O-N 3.37Å; V86-V88 PolarHBondContact O-N 3.15Å
87	N	82.9	Confident	84.2	Confident	96 Å²	96	84.6 Å²	84.6	51%	0.513	46%	0.459	S	S	.	.			trans	-67.3	124.1	178.4	-70.4	-43.1	0	0	0	111.4	F78 V79 D85	F78-N87 WeakPolarHBondContact CA-O 3.18Å; V79-N87 PolarHBondContact N-O 3.45Å; V79-N87 VanDerWaalsContact N-O 3.09Å; D85-N87 VanDerWaalsContact C-N 3.29Å; D85-N87 WeakPolarHBondContact OD1-CB 3.4Å; D85-N87 PolarHBondContact OD1-N 3.11Å; D85-N87 PolarHBondContact OD1-ND2 2.88Å
88	V	82.9	Confident	84.5	Confident	40 Å²	40	88.7 Å²	88.7	24%	0.242	47%	0.465	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	134.6	-178.2	-66	0	0	0	0	111.5	P75 F78 V86 T90 H93	P75-V88 HydrophobicContact CB-CB 4.15Å; P75-V88 HydrophobicContact CB-CG1 4.23Å; P75-V88 HydrophobicContact CB-CG2 4.43Å; P75-V88 HydrophobicContact CG-CG2 4.4Å; F78-V88 HydrophobicContact CD1-CG1 4.03Å; F78-V88 HydrophobicContact CE1-CG1 3.93Å; V86-V88 PolarHBondContact O-N 3.15Å; V88-T90 HydrophobicContact CG2-CG2 4.02Å; V88-H93 PolarHBondContact O-CE1 2.87Å
89	L	85.7	Confident	84.5	Confident	46 Å²	46	88.1 Å²	88.1	24%	0.241	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	128.5	167.7	-167.7	65.9	0	0	0	109.1	L76 T77 V79 H93 F94	L76-L89 WeakPolarHBondContact CB-O 3.44Å; L76-L89 PolarHBondContact N-O 3.38Å; T77-L89 HydrophobicContact CG2-CB 3.99Å; T77-L89 HydrophobicContact CG2-CD2 3.99Å; T77-L89 PolarHBondContact O-N 2.86Å; V79-L89 HydrophobicContact CG2-CB 4.13Å; L89-H93 HydrophobicContact CD1-CB 3.8Å; L89-F94 HydrophobicContact CD1-CE2 4.26Å; L89-F94 HydrophobicContact CD1-CZ 4.38Å; L89-F94 HydrophobicContact CD2-CE2 3.84Å; L89-F94 HydrophobicContact CD2-CZ 3.68Å; L89-F94 HydrophobicContact CG-CE2 3.89Å; L89-F94 HydrophobicContact CG-CZ 4.17Å
90	T	88	Confident	84.3	Confident	5 Å²	5	85.7 Å²	85.7	3%	0.031	45%	0.446	C	S	.	.			trans	-126.2	160.1	-178.7	69.3	0	0	0	0	110.5	R74 V88 F92 H93	R74-T90 WeakPolarHBondContact O-CB 3.15Å; V88-T90 HydrophobicContact CG2-CG2 4.02Å; T90-F92 PolarHBondContact O-N 3.28Å; T90-F92 VanDerWaalsContact O-N 3.17Å; T90-H93 PolarHBondContact N-ND1 3.26Å; T90-H93 WeakPolarHBondContact O-CB 3.33Å; T90-H93 PolarHBondContact O-N 3.41Å; T90-H93 PolarHBondContact OG1-CE1 3.32Å; T90-H93 PolarHBondContact OG1-ND1 3.44Å
91	P	89.6	Confident	84	Confident	14 Å²	14	90.9 Å²	90.9	9%	0.091	47%	0.465	C	S	.	.	H	α-helix	trans	-51.6	-34.4	171.8	-25.5	30.4	0	0	0	114	N72 R74 L76 H93 F94 L95	N72-P91 HydrophobicContact CB-CB 4.22Å; N72-P91 WeakPolarHBondContact O-CB 3.44Å; N72-P91 WeakPolarHBondContact O-CD 3.48Å; N72-P91 WeakPolarHBondContact O-CG 3.31Å; R74-P91 HydrophobicContact CG-CG 4.12Å; R74-P91 WeakPolarHBondContact O-CD 3.25Å; L76-P91 HydrophobicContact CD1-CG 4.24Å; L76-P91 HydrophobicContact CD2-CG 4.23Å; L76-P91 HydrophobicContact CG-CG 4.36Å; P91-H93 VanDerWaalsContact C-N 3.26Å; P91-H93 PolarHBondContact O-N 2.8Å; P91-F94 PolarHBondContact O-N 3.35Å; P91-L95 WeakPolarHBondContact O-CG 3.34Å; P91-L95 PolarHBondContact O-N 3.4Å
92	F	90.8	Very high	83.4	Confident	22 Å²	22	87.1 Å²	87.1	10%	0.096	45%	0.448	C	S	.	.	H	α-helix	trans	-58.4	-35	175.5	-86.6	-68.1	0	0	0	114	A69 N72 A73 T90 F94 L95 I96 R98 H100	A69-F92 HydrophobicContact CB-CE2 4.38Å; A69-F92 HydrophobicContact CB-CZ 4Å; A69-F92 WeakPolarHBondContact O-CE2 3.42Å; N72-F92 HydrophobicContact CB-CD1 4.48Å; N72-F92 HydrophobicContact CB-CD2 3.69Å; N72-F92 HydrophobicContact CB-CE1 4.35Å; N72-F92 HydrophobicContact CB-CE2 3.59Å; N72-F92 HydrophobicContact CB-CG 4.19Å; N72-F92 HydrophobicContact CB-CZ 3.94Å; N72-F92 WeakPolarHBondContact O-CD2 3.26Å; N72-F92 PolarHBondContact O-N 2.73Å; N72-F92 VanDerWaalsContact O-N 3.14Å; A73-F92 HydrophobicContact CB-CD2 4.09Å; A73-F92 HydrophobicContact CB-CE2 4.03Å; T90-F92 PolarHBondContact O-N 3.28Å; T90-F92 VanDerWaalsContact O-N 3.17Å; F92-F94 PolarHBondContact O-N 3.16Å; F92-L95 PolarHBondContact O-N 3.16Å; F92-L95 VanDerWaalsContact O-N 3.11Å; F92-I96 HydrophobicContact CB-CD1 4.38Å; F92-I96 HydrophobicContact CB-CG1 4.24Å; F92-I96 HydrophobicContact CD1-CD1 3.76Å; F92-I96 HydrophobicContact CD1-CG1 3.97Å; F92-I96 HydrophobicContact CD1-CG2 4.42Å; F92-I96 HydrophobicContact CE1-CD1 4.44Å; F92-I96 HydrophobicContact CG-CD1 4.43Å; F92-I96 WeakPolarHBondContact O-CG1 3.41Å; F92-I96 PolarHBondContact O-N 3.38Å; F92-R98 CarbonylContact C-O 3.57Å; F92-H100 HydrophobicContact CB-CB 4.08Å; F92-H100 HydrophobicContact CD1-CB 4.19Å; F92-H100 HydrophobicContact CD2-CB 3.17Å; F92-H100 AromaticContact CD2-CG 3.73Å; F92-H100 HydrophobicContact CE1-CB 4.38Å; F92-H100 AromaticContact CE1-ND1 3.88Å; F92-H100 HydrophobicContact CE2-CB 3.35Å; F92-H100 AromaticContact CE2-CD2 3.91Å; F92-H100 AromaticContact CE2-CG 3.3Å; F92-H100 AromaticContact CE2-ND1 3.48Å; F92-H100 WeakPolarHBondContact CE2-ND1 3.42Å; F92-H100 HydrophobicContact CG-CB 3.59Å; F92-H100 HydrophobicContact CZ-CB 3.98Å; F92-H100 AromaticContact CZ-CE1 3.91Å; F92-H100 AromaticContact CZ-CG 3.68Å; F92-H100 AromaticContact CZ-ND1 3.31Å; F92-H100 VanDerWaalsContact CZ-ND1 3.31Å; F92-H100 WeakPolarHBondContact CZ-ND1 3.38Å
93	H	90.6	Very high	82.2	Confident	54 Å²	54	91.2 Å²	91.2	25%	0.25	46%	0.462	C	S	.	.	H	α-helix	trans	-58.7	-34.1	175.4	-68.4	88.6	0	0	0	111.9	V88 L89 T90 P91 G97	V88-H93 PolarHBondContact O-CE1 2.87Å; L89-H93 HydrophobicContact CD1-CB 3.8Å; T90-H93 PolarHBondContact N-ND1 3.26Å; T90-H93 WeakPolarHBondContact O-CB 3.33Å; T90-H93 PolarHBondContact O-N 3.41Å; T90-H93 PolarHBondContact OG1-CE1 3.32Å; T90-H93 PolarHBondContact OG1-ND1 3.44Å; P91-H93 VanDerWaalsContact C-N 3.26Å; P91-H93 PolarHBondContact O-N 2.8Å; H93-G97 WeakPolarHBondContact O-CA 3.4Å; H93-G97 PolarHBondContact O-N 2.91Å
94	F	90.8	Very high	80.9	Confident	146 Å²	146	92.8 Å²	92.8	64%	0.64	46%	0.463	S	S	*	.	H	α-helix	trans	-82.3	-32.1	176.1	-61.9	-77.7	0	0	0	113.3	L76 L89 P91 F92	L76-F94 HydrophobicContact CD1-CD2 4.38Å; L76-F94 HydrophobicContact CD1-CE2 3.91Å; L89-F94 HydrophobicContact CD1-CE2 4.26Å; L89-F94 HydrophobicContact CD1-CZ 4.38Å; L89-F94 HydrophobicContact CD2-CE2 3.84Å; L89-F94 HydrophobicContact CD2-CZ 3.68Å; L89-F94 HydrophobicContact CG-CE2 3.89Å; L89-F94 HydrophobicContact CG-CZ 4.17Å; P91-F94 PolarHBondContact O-N 3.35Å; F92-F94 PolarHBondContact O-N 3.16Å
95	L	90.6	Very high	79.4	Confident	109 Å²	109	91.9 Å²	91.9	57%	0.571	46%	0.461	S	S	*	.	H	α-helix	trans	-80.8	-42.9	-176.4	-68.7	171.9	0	0	0	113.1	N72 P91 F92	N72-L95 HydrophobicContact CB-CD1 4.22Å; P91-L95 WeakPolarHBondContact O-CG 3.34Å; P91-L95 PolarHBondContact O-N 3.4Å; F92-L95 PolarHBondContact O-N 3.16Å; F92-L95 VanDerWaalsContact O-N 3.11Å
96	I	90.1	Very high	77.8	Confident	84 Å²	84	96.7 Å²	96.7	43%	0.431	48%	0.482	S	S	.	.	H	α-helix	trans	-121.6	-1.8	-173.6	63.7	168.5	0	0	0	113.3	F92 R98	F92-I96 HydrophobicContact CB-CD1 4.38Å; F92-I96 HydrophobicContact CB-CG1 4.24Å; F92-I96 HydrophobicContact CD1-CD1 3.76Å; F92-I96 HydrophobicContact CD1-CG1 3.97Å; F92-I96 HydrophobicContact CD1-CG2 4.42Å; F92-I96 HydrophobicContact CE1-CD1 4.44Å; F92-I96 HydrophobicContact CG-CD1 4.43Å; F92-I96 WeakPolarHBondContact O-CG1 3.41Å; F92-I96 PolarHBondContact O-N 3.38Å; I96-R98 VanDerWaalsContact C-N 3.26Å; I96-R98 HydrophobicContact CD1-CG 3.59Å; I96-R98 HydrophobicContact CG1-CG 3.81Å; I96-R98 WeakPolarHBondContact CG1-O 3.17Å; I96-R98 PolarHBondContact O-N 3.48Å
97	G	88.2	Confident	76.2	Confident	65 Å²	65	100.3 Å²	100.3	67%	0.67	49%	0.489	S	S	*	.	S	Bend	trans	76.2	6.8	179.8	0	0	0	0	0	115.1	H93	H93-G97 WeakPolarHBondContact O-CA 3.4Å; H93-G97 PolarHBondContact O-N 2.91Å
98	R	85.8	Confident	74.6	Confident	170 Å²	170	101.5 Å²	101.5	64%	0.642	50%	0.502	S	S	*	.	S	Bend	trans	-149.8	165.8	-178.2	63.2	179.8	179.6	-176.9	0.4	112	F92 I96	F92-R98 CarbonylContact C-O 3.57Å; I96-R98 VanDerWaalsContact C-N 3.26Å; I96-R98 HydrophobicContact CD1-CG 3.59Å; I96-R98 HydrophobicContact CG1-CG 3.81Å; I96-R98 WeakPolarHBondContact CG1-O 3.17Å; I96-R98 PolarHBondContact O-N 3.48Å
99	E	79	Confident	73.2	Confident	112 Å²	112	105.4 Å²	105.4	52%	0.523	53%	0.526	S	S	.	.			trans	-62.4	145.4	170.9	-170.9	176.4	-163.9	0	0	110.9	Q101	E99-Q101 PolarHBondContact O-N 3.5Å
100	H	80.2	Confident	71.4	Confident	47 Å²	47	113 Å²	113	22%	0.218	56%	0.56	C	S	.	*			trans	-76.2	111.9	170.6	176.2	75.5	0	0	0	110.3	F92 E102	F92-H100 HydrophobicContact CB-CB 4.08Å; F92-H100 HydrophobicContact CD1-CB 4.19Å; F92-H100 HydrophobicContact CD2-CB 3.17Å; F92-H100 AromaticContact CD2-CG 3.73Å; F92-H100 HydrophobicContact CE1-CB 4.38Å; F92-H100 AromaticContact CE1-ND1 3.88Å; F92-H100 HydrophobicContact CE2-CB 3.35Å; F92-H100 AromaticContact CE2-CD2 3.91Å; F92-H100 AromaticContact CE2-CG 3.3Å; F92-H100 AromaticContact CE2-ND1 3.48Å; F92-H100 WeakPolarHBondContact CE2-ND1 3.42Å; F92-H100 HydrophobicContact CG-CB 3.59Å; F92-H100 HydrophobicContact CZ-CB 3.98Å; F92-H100 AromaticContact CZ-CE1 3.91Å; F92-H100 AromaticContact CZ-CG 3.68Å; F92-H100 AromaticContact CZ-ND1 3.31Å; F92-H100 VanDerWaalsContact CZ-ND1 3.31Å; F92-H100 WeakPolarHBondContact CZ-ND1 3.38Å; H100-E102 PolarHBondContact O-N 3.5Å
101	Q	74.1	Confident	69.4	Low	158 Å²	158	115.5 Å²	115.5	74%	0.738	59%	0.587	S	S	*	*			trans	-80.2	111.6	164.4	-66.5	-174.1	-26.2	0	0	107.5	E99 F103	E99-Q101 PolarHBondContact O-N 3.5Å; Q101-F103 PolarHBondContact O-N 3.45Å
102	E	66.7	Low	67.5	Low	119 Å²	119	123.9 Å²	123.9	56%	0.556	63%	0.625	S	S	*	*			trans	-57.5	116.6	167.2	-171.2	159.1	-172.7	0	0	106.5	K70 H100 L104	K70-E102 IonicContact NZ-OE1 3.69Å; K70-E102 PolarHBondContact NZ-OE1 3.25Å; K70-E102 IonicContact NZ-OE2 3.73Å; K70-E102 PolarHBondContact NZ-OE2 3.44Å; H100-E102 PolarHBondContact O-N 3.5Å; E102-L104 PolarHBondContact O-N 2.95Å
103	F	57.9	Low	65.6	Low	163 Å²	163	134.9 Å²	134.9	72%	0.715	67%	0.665	S	S	*	*			trans	-59.4	104.1	-177.8	-76.9	-86.4	0	0	0	108.1	Q101 E105	Q101-F103 PolarHBondContact O-N 3.45Å; F103-E105 PolarHBondContact O-N 2.86Å
104	L	47.2	Very low	64	Low	158 Å²	158	134.6 Å²	134.6	83%	0.827	67%	0.673	S	S	*	*			trans	-55.7	129.5	166.3	-67.4	173.2	0	0	0	106.7	E102 Q106	E102-L104 PolarHBondContact O-N 2.95Å; L104-Q106 PolarHBondContact O-N 3.47Å
105	E	49.8	Very low	62.4	Low	162 Å²	162	134.5 Å²	134.5	76%	0.757	68%	0.684	S	S	*	*			trans	-28.1	101.2	-179.3	-65	-180	167	0	0	111.2	F103 K107	F103-E105 PolarHBondContact O-N 2.86Å; E105-K107 PolarHBondContact O-N 3.25Å
106	Q	45.3	Very low	61	Low	148 Å²	148	136.6 Å²	136.6	69%	0.692	69%	0.686	S	S	*	*			trans	-64	113.1	173	-73.7	-173.7	-10.5	0	0	105.9	L104	L104-Q106 PolarHBondContact O-N 3.47Å
107	K	44.2	Very low	59.8	Low	189 Å²	189	138.9 Å²	138.9	82%	0.822	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-51	130.4	167.8	-75.3	-178.1	178.9	176.7	0	106.4	E105 T109	E105-K107 PolarHBondContact O-N 3.25Å; K107-T109 PolarHBondContact O-N 2.95Å
108	P	49.7	Very low	58.9	Low	121 Å²	121	140.1 Å²	140.1	79%	0.786	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-53.6	116.7	-177.5	18.2	-28.9	0	0	0	108.6	Q110	P108-Q110 PolarHBondContact O-N 3.39Å
109	T	52.6	Low	58.5	Low	121 Å²	121	135.7 Å²	135.7	74%	0.742	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-55.7	125.4	170.9	-48.1	0	0	0	0	106.2	K107 G111	K107-T109 PolarHBondContact O-N 2.95Å; T109-G111 PolarHBondContact O-N 3.5Å
110	Q	48.7	Very low	58.5	Low	206 Å²	206	133 Å²	133	96%	0.963	68%	0.684	S	S	*	*	S	Bend	trans	-64.3	87.5	174.8	-72.6	-177	-0.7	0	0	108.3	P108	P108-Q110 PolarHBondContact O-N 3.39Å
111	G	45.1	Very low	58.6	Low	57 Å²	57	136.8 Å²	136.8	59%	0.588	70%	0.704	S	S	*	*			trans	-171.9	116	-177.9	0	0	0	0	0	108.7	T109	T109-G111 PolarHBondContact O-N 3.5Å
112	E	50.7	Low	59.1	Low	191 Å²	191	134 Å²	134	89%	0.893	69%	0.691	S	S	*	*			trans	73.5	88.6	179.4	-57.7	-179.3	168	0	0	115.7	A114	E112-A114 PolarHBondContact O-N 2.87Å
113	R	50.8	Low	59.9	Low	252 Å²	252	131.5 Å²	131.5	95%	0.951	68%	0.681	S	S	*	*			trans	-64.5	86.2	154.7	-96.7	-176.6	173.8	172.3	-1.3	108.1	T115	R113-T115 PolarHBondContact O-N 3.47Å
114	A	56.9	Low	61.2	Low	49 Å²	49	130.5 Å²	130.5	41%	0.405	67%	0.672	S	S	.	*			trans	-62.9	127.2	161.7	0	0	0	0	0	108.3	E112 Y116	E112-A114 PolarHBondContact O-N 2.87Å; A114-Y116 VanDerWaalsContact C-N 3.3Å; A114-Y116 HydrophobicContact CB-CD2 4.03Å; A114-Y116 HydrophobicContact CB-CE1 4.12Å; A114-Y116 HydrophobicContact CB-CE2 3.37Å; A114-Y116 VanDerWaalsContact CB-CZ 3.4Å; A114-Y116 WeakPolarHBondContact CB-OH 3.34Å; A114-Y116 VanDerWaalsContact O-CD2 3.29Å; A114-Y116 WeakPolarHBondContact O-CD2 3.29Å; A114-Y116 PolarHBondContact O-N 2.82Å
115	T	55.8	Low	63.2	Low	144 Å²	144	124.9 Å²	124.9	88%	0.883	65%	0.653	S	S	*	*			trans	-76.3	87.8	176.1	-58.1	0	0	0	0	107.4	R113	R113-T115 PolarHBondContact O-N 3.47Å
116	Y	62.1	Low	65.1	Low	152 Å²	152	120.7 Å²	120.7	60%	0.596	63%	0.63	S	S	*	*			trans	-80.1	138.4	172.1	-61.9	-73.1	0	0	0	109.1	A114 Q118 L123	A114-Y116 VanDerWaalsContact C-N 3.3Å; A114-Y116 HydrophobicContact CB-CD2 4.03Å; A114-Y116 HydrophobicContact CB-CE1 4.12Å; A114-Y116 HydrophobicContact CB-CE2 3.37Å; A114-Y116 VanDerWaalsContact CB-CZ 3.4Å; A114-Y116 WeakPolarHBondContact CB-OH 3.34Å; A114-Y116 VanDerWaalsContact O-CD2 3.29Å; A114-Y116 WeakPolarHBondContact O-CD2 3.29Å; A114-Y116 PolarHBondContact O-N 2.82Å; Y116-Q118 PolarHBondContact O-N 3.22Å; Y116-L123 HydrophobicContact CD2-CD1 4.2Å; Y116-L123 HydrophobicContact CG-CD1 4.36Å
117	P	64.1	Low	67.2	Low	133 Å²	133	119.2 Å²	119.2	86%	0.864	62%	0.618	S	S	*	*	S	Bend	trans	-65.1	-17.3	173.3	26.4	-33.2	0	0	0	112.2
118	Q	69.7	Low	69.4	Low	91 Å²	91	116.5 Å²	116.5	43%	0.425	61%	0.607	S	S	.	*	S	Bend	trans	-90.3	139.5	-179.9	-66.7	176.2	18.2	0	0	111.4	Y116 E122 L123	Y116-Q118 PolarHBondContact O-N 3.22Å; Q118-E122 WeakPolarHBondContact CA-OE2 3.37Å; Q118-E122 HydrophobicContact CB-CB 4.24Å; Q118-L123 HydrophobicContact CB-CD2 4.15Å; Q118-L123 HydrophobicContact CB-CG 4.03Å; Q118-L123 VanDerWaalsContact OE1-CD2 3.3Å
119	T	77.3	Confident	71.4	Confident	77 Å²	77	113.8 Å²	113.8	47%	0.472	58%	0.581	S	S	.	*			trans	-64.7	152.4	172.2	63	0	0	0	0	110.8	I121 E122 L123	T119-I121 PolarHBondContact O-N 2.88Å; T119-E122 WeakPolarHBondContact CB-OE2 3.41Å; T119-E122 PolarHBondContact N-OE2 3.48Å; T119-E122 PolarHBondContact O-N 2.63Å; T119-E122 VanDerWaalsContact OG1-CD 3.3Å; T119-E122 VanDerWaalsContact OG1-CG 3.28Å; T119-E122 WeakPolarHBondContact OG1-CG 3.17Å; T119-E122 PolarHBondContact OG1-N 3.24Å; T119-E122 PolarHBondContact OG1-OE2 3.24Å; T119-L123 PolarHBondContact O-N 3.28Å; T119-L123 VanDerWaalsContact O-N 3.08Å
120	A	80.1	Confident	73.3	Confident	56 Å²	56	109 Å²	109	46%	0.463	55%	0.551	S	S	.	*	H	α-helix	trans	-56.4	-24.8	174.6	0	0	0	0	0	112.9	R124	A120-R124 WeakPolarHBondContact O-CB 3.39Å; A120-R124 VanDerWaalsContact O-CG 3.29Å; A120-R124 WeakPolarHBondContact O-CG 3.1Å; A120-R124 PolarHBondContact O-N 3.07Å; A120-R124 PolarHBondContact O-NE 2.63Å
121	I	81.5	Confident	75.3	Confident	126 Å²	126	102 Å²	102	65%	0.646	52%	0.518	S	S	*	.	H	α-helix	trans	-70.4	-47.1	175.6	-62.6	172.7	0	0	0	110.5	T119 R124 G125	T119-I121 PolarHBondContact O-N 2.88Å; I121-R124 PolarHBondContact O-N 3.45Å; I121-G125 PolarHBondContact O-N 3Å
122	E	84.3	Confident	77.6	Confident	100 Å²	100	107.9 Å²	107.9	47%	0.467	52%	0.522	S	S	.	.	H	α-helix	trans	-63	-45.4	178.1	-71.4	163	139.3	0	0	111.7	Q118 T119 R124 G125 R126	Q118-E122 WeakPolarHBondContact CA-OE2 3.37Å; Q118-E122 HydrophobicContact CB-CB 4.24Å; T119-E122 WeakPolarHBondContact CB-OE2 3.41Å; T119-E122 PolarHBondContact N-OE2 3.48Å; T119-E122 PolarHBondContact O-N 2.63Å; T119-E122 VanDerWaalsContact OG1-CD 3.3Å; T119-E122 VanDerWaalsContact OG1-CG 3.28Å; T119-E122 WeakPolarHBondContact OG1-CG 3.17Å; T119-E122 PolarHBondContact OG1-N 3.24Å; T119-E122 PolarHBondContact OG1-OE2 3.24Å; E122-R124 PolarHBondContact O-N 3.35Å; E122-G125 CarbonylContact O-C 3.59Å; E122-G125 WeakPolarHBondContact O-CA 3.28Å; E122-G125 PolarHBondContact O-N 3.14Å; E122-R126 PolarHBondContact O-N 3.46Å
123	L	84.6	Confident	79.7	Confident	66 Å²	66	99.5 Å²	99.5	35%	0.346	48%	0.483	S	S	.	.	H	α-helix	trans	-59.6	-45.6	177.2	-70.5	172.7	0	0	0	111.8	Y116 Q118 T119 G125 R126 W127	Y116-L123 HydrophobicContact CD2-CD1 4.2Å; Y116-L123 HydrophobicContact CG-CD1 4.36Å; Q118-L123 HydrophobicContact CB-CD2 4.15Å; Q118-L123 HydrophobicContact CB-CG 4.03Å; Q118-L123 VanDerWaalsContact OE1-CD2 3.3Å; T119-L123 PolarHBondContact O-N 3.28Å; T119-L123 VanDerWaalsContact O-N 3.08Å; L123-G125 VanDerWaalsContact C-N 3.3Å; L123-G125 PolarHBondContact O-N 3.29Å; L123-R126 PolarHBondContact O-N 3.27Å; L123-W127 WeakPolarHBondContact O-CB 3.22Å; L123-W127 PolarHBondContact O-N 3.02Å
124	R	85.8	Confident	81.7	Confident	141 Å²	141	87.7 Å²	87.7	53%	0.532	44%	0.439	S	S	.	.	H	α-helix	trans	-62.6	-37.5	174	-76.6	-174.8	-65.9	-112.2	2.2	112	A120 I121 E122 K128	A120-R124 WeakPolarHBondContact O-CB 3.39Å; A120-R124 VanDerWaalsContact O-CG 3.29Å; A120-R124 WeakPolarHBondContact O-CG 3.1Å; A120-R124 PolarHBondContact O-N 3.07Å; A120-R124 PolarHBondContact O-NE 2.63Å; I121-R124 PolarHBondContact O-N 3.45Å; E122-R124 PolarHBondContact O-N 3.35Å; R124-K128 WeakPolarHBondContact O-CB 3.07Å; R124-K128 VanDerWaalsContact O-CG 3.3Å; R124-K128 WeakPolarHBondContact O-CG 3.06Å; R124-K128 PolarHBondContact O-N 3.3Å
125	G	88.7	Confident	83.4	Confident	41 Å²	41	88.2 Å²	88.2	42%	0.423	44%	0.444	S	S	.	.	H	α-helix	trans	-62.4	-46.9	175.3	0	0	0	0	0	112.3	I121 E122 L123 K128 Y129	I121-G125 PolarHBondContact O-N 3Å; E122-G125 CarbonylContact O-C 3.59Å; E122-G125 WeakPolarHBondContact O-CA 3.28Å; E122-G125 PolarHBondContact O-N 3.14Å; L123-G125 VanDerWaalsContact C-N 3.3Å; L123-G125 PolarHBondContact O-N 3.29Å; G125-K128 PolarHBondContact O-N 3.31Å; G125-Y129 WeakPolarHBondContact O-CB 3.42Å; G125-Y129 PolarHBondContact O-N 3.01Å
126	R	89.4	Confident	85.2	Confident	74 Å²	74	85.8 Å²	85.8	28%	0.279	42%	0.422	S	S	.	.	H	α-helix	trans	-63.4	-45.2	175.8	-70.1	-57.8	-60.2	169.5	-7.3	112.2	L54 E59 E122 L123 Y129 Q130	L54-R126 PolarHBondContact O-NH1 3.14Å; L54-R126 PolarHBondContact O-NH2 2.78Å; E59-R126 IonicContact OE1-CZ 3.19Å; E59-R126 IonicContact OE1-NE 2.77Å; E59-R126 PolarHBondContact OE1-NE 3.31Å; E59-R126 IonicContact OE1-NH2 2.88Å; E59-R126 PolarHBondContact OE1-NH2 3.17Å; E59-R126 IonicContact OE2-CZ 3.63Å; E59-R126 IonicContact OE2-NE 3.83Å; E59-R126 IonicContact OE2-NH2 2.67Å; E59-R126 PolarHBondContact OE2-NH2 3.02Å; E122-R126 PolarHBondContact O-N 3.46Å; L123-R126 PolarHBondContact O-N 3.27Å; R126-Y129 WeakPolarHBondContact O-CB 3.36Å; R126-Y129 PolarHBondContact O-N 3.5Å; R126-Q130 WeakPolarHBondContact O-CG 3.33Å; R126-Q130 PolarHBondContact O-N 2.85Å
127	W	89	Confident	86.8	Confident	116 Å²	116	78.6 Å²	78.6	44%	0.439	39%	0.394	S	S	.	.	H	α-helix	trans	-60.1	-48.6	175.6	176.3	80.7	0	0	0	111.8	L123 Y129 Q130 Q131	L123-W127 WeakPolarHBondContact O-CB 3.22Å; L123-W127 PolarHBondContact O-N 3.02Å; W127-Y129 PolarHBondContact O-N 2.86Å; W127-Q130 PolarHBondContact O-N 3.11Å; W127-Q130 VanDerWaalsContact O-N 3.12Å; W127-Q131 HydrophobicContact CD2-CG 3.98Å; W127-Q131 HydrophobicContact CE3-CG 4.44Å; W127-Q131 HydrophobicContact CG-CG 4.49Å; W127-Q131 HydrophobicContact CH2-CG 4.21Å; W127-Q131 HydrophobicContact CZ2-CG 3.69Å; W127-Q131 WeakPolarHBondContact O-CG 3.43Å; W127-Q131 PolarHBondContact O-N 3.19Å
128	K	90.5	Very high	88.1	Confident	133 Å²	133	75.3 Å²	75.3	58%	0.578	36%	0.364	S	S	*	.	H	α-helix	trans	-58.3	-37.4	175.1	-76.5	-178.1	-179.9	-175.4	0	112.2	R124 G125 R132	R124-K128 WeakPolarHBondContact O-CB 3.07Å; R124-K128 VanDerWaalsContact O-CG 3.3Å; R124-K128 WeakPolarHBondContact O-CG 3.06Å; R124-K128 PolarHBondContact O-N 3.3Å; G125-K128 PolarHBondContact O-N 3.31Å; K128-R132 WeakPolarHBondContact O-CB 3.48Å; K128-R132 VanDerWaalsContact O-CG 3.26Å; K128-R132 WeakPolarHBondContact O-CG 3.43Å; K128-R132 PolarHBondContact O-N 3.49Å
129	Y	92.2	Very high	89.2	Confident	64 Å²	64	78.2 Å²	78.2	25%	0.251	38%	0.375	S	S	.	.	H	α-helix	trans	-63.8	-46	175.7	175.7	-108.6	0	0	0	111.9	A53 L55 G125 R126 W127 R132 L133	A53-Y129 VanDerWaalsContact CA-OH 3.29Å; A53-Y129 WeakPolarHBondContact CA-OH 3.31Å; A53-Y129 WeakPolarHBondContact CB-OH 3.17Å; L55-Y129 HydrophobicContact CD2-CD1 4.39Å; L55-Y129 HydrophobicContact CD2-CE1 4Å; G125-Y129 WeakPolarHBondContact O-CB 3.42Å; G125-Y129 PolarHBondContact O-N 3.01Å; R126-Y129 WeakPolarHBondContact O-CB 3.36Å; R126-Y129 PolarHBondContact O-N 3.5Å; W127-Y129 PolarHBondContact O-N 2.86Å; Y129-R132 WeakPolarHBondContact O-CB 3.43Å; Y129-R132 PolarHBondContact O-N 3.42Å; Y129-L133 HydrophobicContact CD1-CD1 4.25Å; Y129-L133 HydrophobicContact CE1-CD1 3.7Å; Y129-L133 HydrophobicContact CE1-CG 4.45Å; Y129-L133 WeakPolarHBondContact O-CG 3.18Å; Y129-L133 PolarHBondContact O-N 2.82Å; Y129-L133 VanDerWaalsContact O-N 3.13Å
130	Q	91.8	Very high	90	Very high	21 Å²	21	78.6 Å²	78.6	10%	0.098	37%	0.368	C	S	.	.	H	α-helix	trans	-61.7	-47.2	176.1	-68.2	170	22.8	0	0	111.9	L55 E59 R126 W127 R132 L133 V134	L55-Q130 HydrophobicContact CD2-CG 4.27Å; E59-Q130 PolarHBondContact OE1-NE2 3.18Å; R126-Q130 WeakPolarHBondContact O-CG 3.33Å; R126-Q130 PolarHBondContact O-N 2.85Å; W127-Q130 PolarHBondContact O-N 3.11Å; W127-Q130 VanDerWaalsContact O-N 3.12Å; Q130-R132 VanDerWaalsContact C-N 3.26Å; Q130-R132 PolarHBondContact O-N 3.23Å; Q130-L133 WeakPolarHBondContact O-CA 3.16Å; Q130-L133 WeakPolarHBondContact O-CB 3.45Å; Q130-L133 PolarHBondContact O-N 3.24Å; Q130-V134 PolarHBondContact O-N 3.36Å
131	Q	91	Very high	90.6	Very high	58 Å²	58	76 Å²	76	27%	0.271	35%	0.346	S	S	.	.	H	α-helix	trans	-59.1	-37.8	177.2	-68.5	-54.4	-48.8	0	0	112.2	E66 W127 L133 V134 A135	E66-Q131 VanDerWaalsContact CD-NE2 3.35Å; E66-Q131 PolarHBondContact OE1-NE2 2.64Å; E66-Q131 PolarHBondContact OE2-NE2 2.85Å; W127-Q131 HydrophobicContact CD2-CG 3.98Å; W127-Q131 HydrophobicContact CE3-CG 4.44Å; W127-Q131 HydrophobicContact CG-CG 4.49Å; W127-Q131 HydrophobicContact CH2-CG 4.21Å; W127-Q131 HydrophobicContact CZ2-CG 3.69Å; W127-Q131 WeakPolarHBondContact O-CG 3.43Å; W127-Q131 PolarHBondContact O-N 3.19Å; Q131-L133 VanDerWaalsContact C-N 3.35Å; Q131-L133 PolarHBondContact O-N 3.11Å; Q131-V134 PolarHBondContact O-N 3.49Å; Q131-A135 VanDerWaalsContact O-CB 3.31Å; Q131-A135 WeakPolarHBondContact O-CB 3.39Å; Q131-A135 PolarHBondContact O-N 3.39Å
132	R	93	Very high	90.9	Very high	181 Å²	181	74.1 Å²	74.1	68%	0.683	34%	0.335	S	S	*	.	H	α-helix	trans	-62.6	-39.6	172.7	-77.8	173.9	58.7	-167.8	-3.2	112.6	K128 Y129 Q130 H136	K128-R132 WeakPolarHBondContact O-CB 3.48Å; K128-R132 VanDerWaalsContact O-CG 3.26Å; K128-R132 WeakPolarHBondContact O-CG 3.43Å; K128-R132 PolarHBondContact O-N 3.49Å; Y129-R132 WeakPolarHBondContact O-CB 3.43Å; Y129-R132 PolarHBondContact O-N 3.42Å; Q130-R132 VanDerWaalsContact C-N 3.26Å; Q130-R132 PolarHBondContact O-N 3.23Å; R132-H136 VanDerWaalsContact O-CB 3.27Å; R132-H136 WeakPolarHBondContact O-CB 3.04Å; R132-H136 PolarHBondContact O-N 2.63Å
133	L	94.5	Very high	91.1	Very high	14 Å²	14	73.7 Å²	73.7	7%	0.073	34%	0.339	C	S	.	.	H	α-helix	trans	-66.8	-44.5	176.7	-65.7	175.2	0	0	0	111	V49 L50 A53 L55 L63 Y129 Q130 Q131 H136 F137	V49-L133 HydrophobicContact CG1-CB 4.23Å; V49-L133 HydrophobicContact CG1-CD2 4.04Å; V49-L133 WeakPolarHBondContact CG1-O 3.48Å; L50-L133 HydrophobicContact CD2-CD1 4.27Å; A53-L133 HydrophobicContact CB-CD1 4.07Å; A53-L133 HydrophobicContact CB-CD2 4.31Å; L55-L133 HydrophobicContact CD1-CD1 4.08Å; L55-L133 HydrophobicContact CD2-CD1 3.97Å; L55-L133 HydrophobicContact CG-CD1 4.33Å; L63-L133 HydrophobicContact CD1-CB 3.67Å; L63-L133 HydrophobicContact CD1-CD1 3.81Å; L63-L133 HydrophobicContact CD1-CG 4.42Å; Y129-L133 HydrophobicContact CD1-CD1 4.25Å; Y129-L133 HydrophobicContact CE1-CD1 3.7Å; Y129-L133 HydrophobicContact CE1-CG 4.45Å; Y129-L133 WeakPolarHBondContact O-CG 3.18Å; Y129-L133 PolarHBondContact O-N 2.82Å; Y129-L133 VanDerWaalsContact O-N 3.13Å; Q130-L133 WeakPolarHBondContact O-CA 3.16Å; Q130-L133 WeakPolarHBondContact O-CB 3.45Å; Q130-L133 PolarHBondContact O-N 3.24Å; Q131-L133 VanDerWaalsContact C-N 3.35Å; Q131-L133 PolarHBondContact O-N 3.11Å; L133-H136 PolarHBondContact O-N 3.25Å; L133-F137 WeakPolarHBondContact O-CB 3.23Å; L133-F137 PolarHBondContact O-N 3.23Å
134	V	93.1	Very high	91.2	Very high	5 Å²	5	73.2 Å²	73.2	3%	0.03	34%	0.335	C	S	.	.	H	α-helix	trans	-63.7	-44.2	178.2	172.9	0	0	0	0	111.3	L63 E66 K70 Q130 Q131 H136 F137 W138	L63-V134 HydrophobicContact CD1-CG2 4.38Å; L63-V134 HydrophobicContact CG-CG2 3.97Å; E66-V134 HydrophobicContact CB-CG1 4.1Å; E66-V134 HydrophobicContact CB-CG2 3.95Å; E66-V134 WeakPolarHBondContact OE2-CG2 3.48Å; K70-V134 HydrophobicContact CG-CG1 4.5Å; Q130-V134 PolarHBondContact O-N 3.36Å; Q131-V134 PolarHBondContact O-N 3.49Å; V134-H136 VanDerWaalsContact C-N 3.35Å; V134-H136 PolarHBondContact O-N 3.37Å; V134-F137 WeakPolarHBondContact O-CB 3.39Å; V134-F137 PolarHBondContact O-N 2.94Å; V134-W138 WeakPolarHBondContact O-CB 3.23Å; V134-W138 PolarHBondContact O-N 2.8Å
135	A	92.3	Very high	91.3	Very high	60 Å²	60	67.7 Å²	67.7	50%	0.496	31%	0.314	S	S	.	.	H	α-helix	trans	-61.5	-41.6	174.4	0	0	0	0	0	112.3	Q131 W138 K139	Q131-A135 VanDerWaalsContact O-CB 3.31Å; Q131-A135 WeakPolarHBondContact O-CB 3.39Å; Q131-A135 PolarHBondContact O-N 3.39Å; A135-W138 PolarHBondContact O-N 2.71Å; A135-K139 WeakPolarHBondContact O-CB 3.24Å; A135-K139 PolarHBondContact O-N 2.66Å
136	H	94.3	Very high	90.8	Very high	92 Å²	92	70 Å²	70	43%	0.426	32%	0.316	S	S	.	.	H	α-helix	trans	-65.2	-42.1	176.2	-175.9	-161.3	0	0	0	111.6	V49 R132 L133 V134 R140	V49-H136 HydrophobicContact CG1-CB 4.19Å; V49-H136 HydrophobicContact CG2-CB 4.37Å; R132-H136 VanDerWaalsContact O-CB 3.27Å; R132-H136 WeakPolarHBondContact O-CB 3.04Å; R132-H136 PolarHBondContact O-N 2.63Å; L133-H136 PolarHBondContact O-N 3.25Å; V134-H136 VanDerWaalsContact C-N 3.35Å; V134-H136 PolarHBondContact O-N 3.37Å; H136-R140 WeakPolarHBondContact O-CB 3.38Å; H136-R140 PolarHBondContact O-N 2.92Å; H136-R140 VanDerWaalsContact O-N 3.13Å
137	F	95	Very high	90.2	Very high	1 Å²	1	71.3 Å²	71.3	0%	0.004	33%	0.333	C	S	.	.	H	α-helix	trans	-57.4	-53.1	172.5	169.5	-87.8	0	0	0	110.6	V42 A45 L46 V49 V67 V71 L133 V134 K139 R140 W141	V42-F137 HydrophobicContact CG1-CE2 4.33Å; V42-F137 HydrophobicContact CG1-CZ 4.17Å; A45-F137 HydrophobicContact CB-CD2 3.79Å; A45-F137 HydrophobicContact CB-CE2 3.52Å; A45-F137 HydrophobicContact CB-CZ 4.4Å; L46-F137 HydrophobicContact CD2-CD2 3.86Å; L46-F137 HydrophobicContact CD2-CE2 4.05Å; L46-F137 HydrophobicContact CG-CD2 4.02Å; L46-F137 HydrophobicContact CG-CE2 3.79Å; V49-F137 HydrophobicContact CG1-CB 4.4Å; V49-F137 HydrophobicContact CG2-CB 4.24Å; V67-F137 HydrophobicContact CB-CD1 4.31Å; V67-F137 HydrophobicContact CB-CE1 4.19Å; V67-F137 HydrophobicContact CG1-CD1 4.01Å; V67-F137 HydrophobicContact CG1-CD2 4.42Å; V67-F137 HydrophobicContact CG1-CE1 3.47Å; V67-F137 VanDerWaalsContact CG1-CE1 3.47Å; V67-F137 HydrophobicContact CG1-CE2 3.9Å; V67-F137 HydrophobicContact CG1-CG 4.47Å; V67-F137 HydrophobicContact CG1-CZ 3.4Å; V67-F137 VanDerWaalsContact CG1-CZ 3.4Å; V67-F137 HydrophobicContact CG2-CB 4.37Å; V67-F137 HydrophobicContact CG2-CD1 3.65Å; V67-F137 HydrophobicContact CG2-CD2 4.28Å; V67-F137 HydrophobicContact CG2-CE1 4.02Å; V67-F137 HydrophobicContact CG2-CG 3.81Å; V67-F137 HydrophobicContact CG2-CZ 4.47Å; V71-F137 HydrophobicContact CG2-CE1 4.17Å; V71-F137 HydrophobicContact CG2-CZ 4.18Å; L133-F137 WeakPolarHBondContact O-CB 3.23Å; L133-F137 PolarHBondContact O-N 3.23Å; V134-F137 WeakPolarHBondContact O-CB 3.39Å; V134-F137 PolarHBondContact O-N 2.94Å; F137-K139 PolarHBondContact O-N 3.01Å; F137-R140 PolarHBondContact O-N 3.05Å; F137-W141 HydrophobicContact CD1-CB 4.4Å; F137-W141 HydrophobicContact CE1-CB 3.9Å; F137-W141 HydrophobicContact CE1-CG 4.11Å; F137-W141 HydrophobicContact CE2-CB 4.13Å; F137-W141 HydrophobicContact CE2-CG 4.35Å; F137-W141 HydrophobicContact CZ-CB 3.75Å; F137-W141 AromaticContact CZ-CD1 3.89Å; F137-W141 HydrophobicContact CZ-CD2 4.41Å; F137-W141 AromaticContact CZ-CG 3.71Å; F137-W141 HydrophobicContact CZ-CG 3.71Å; F137-W141 VanDerWaalsContact O-CB 3.25Å; F137-W141 WeakPolarHBondContact O-CB 3.32Å; F137-W141 PolarHBondContact O-N 3.04Å
138	W	92.9	Very high	89.5	Confident	64 Å²	64	68.6 Å²	68.6	24%	0.242	33%	0.329	C	S	.	.	H	α-helix	trans	-59.8	-49.2	-175.1	-179.6	-117.3	0	0	0	111.8	K70 R74 V134 A135 R140 W141 Q142	K70-W138 HydrophobicContact CB-CD2 4.22Å; K70-W138 HydrophobicContact CB-CE3 3.6Å; K70-W138 HydrophobicContact CB-CZ3 3.86Å; K70-W138 HydrophobicContact CD-CD2 4.39Å; K70-W138 HydrophobicContact CG-CE3 4.43Å; K70-W138 WeakPolarHBondContact O-CH2 3.19Å; K70-W138 WeakPolarHBondContact O-CZ3 3.25Å; R74-W138 HydrophobicContact CB-CH2 4.49Å; V134-W138 WeakPolarHBondContact O-CB 3.23Å; V134-W138 PolarHBondContact O-N 2.8Å; A135-W138 PolarHBondContact O-N 2.71Å; W138-R140 VanDerWaalsContact C-N 3.3Å; W138-R140 PolarHBondContact O-N 3.16Å; W138-W141 AromaticContact CE3-CE3 3.9Å; W138-W141 HydrophobicContact CE3-CE3 3.9Å; W138-W141 HydrophobicContact CE3-CZ3 4.32Å; W138-W141 HydrophobicContact CH2-CE3 4.33Å; W138-W141 AromaticContact CH2-CZ3 3.98Å; W138-W141 HydrophobicContact CH2-CZ3 3.98Å; W138-W141 AromaticContact CZ3-CE3 3.5Å; W138-W141 HydrophobicContact CZ3-CE3 3.5Å; W138-W141 AromaticContact CZ3-CZ3 3.47Å; W138-W141 HydrophobicContact CZ3-CZ3 3.47Å; W138-W141 VanDerWaalsContact CZ3-CZ3 3.47Å; W138-W141 PolarHBondContact O-N 3.39Å; W138-Q142 WeakPolarHBondContact O-CB 3.35Å; W138-Q142 PolarHBondContact O-N 2.67Å
139	K	92.1	Very high	88.8	Confident	152 Å²	152	67.4 Å²	67.4	66%	0.661	33%	0.328	S	S	*	.	H	α-helix	trans	-55.2	-46.9	177.5	-177.9	175.9	-178.2	176	0	111.6	A135 F137 T143	A135-K139 WeakPolarHBondContact O-CB 3.24Å; A135-K139 PolarHBondContact O-N 2.66Å; F137-K139 PolarHBondContact O-N 3.01Å; K139-T143 PolarHBondContact O-N 3.2Å; K139-T143 PolarHBondContact O-OG1 3.03Å
140	R	93.5	Very high	87.5	Confident	85 Å²	85	68.9 Å²	68.9	32%	0.321	35%	0.348	S	S	.	.	H	α-helix	trans	-70.5	-50.3	-177.5	-173.4	173.8	-168.6	131.6	9	111.9	K48 H136 F137 W138 Q142 T143 E144	K48-R140 VanDerWaalsContact CB-CZ 3.5Å; H136-R140 WeakPolarHBondContact O-CB 3.38Å; H136-R140 PolarHBondContact O-N 2.92Å; H136-R140 VanDerWaalsContact O-N 3.13Å; F137-R140 PolarHBondContact O-N 3.05Å; W138-R140 VanDerWaalsContact C-N 3.3Å; W138-R140 PolarHBondContact O-N 3.16Å; R140-Q142 PolarHBondContact O-N 3.18Å; R140-T143 PolarHBondContact O-N 2.86Å; R140-E144 HydrophobicContact CG-CG 4.47Å; R140-E144 VanDerWaalsContact CG-OE1 3.31Å; R140-E144 WeakPolarHBondContact CG-OE1 3.41Å; R140-E144 IonicContact CZ-OE1 2.93Å; R140-E144 IonicContact NE-OE1 3.41Å; R140-E144 PolarHBondContact NE-OE1 2.78Å; R140-E144 IonicContact NH2-OE1 3.57Å; R140-E144 WeakPolarHBondContact O-CG 3.17Å; R140-E144 PolarHBondContact O-N 3.07Å
141	W	93.7	Very high	86.1	Confident	2 Å²	2	72.5 Å²	72.5	1%	0.008	37%	0.367	C	S	.	.	H	α-helix	trans	-61.1	-44	-179	-177.7	81.6	0	0	0	111.1	L38 S41 V42 A45 V71 R74 F137 W138 T143 E144 Y145	L38-W141 HydrophobicContact CD1-CZ2 3.99Å; S41-W141 PolarHBondContact OG-NE1 3.13Å; S41-W141 VanDerWaalsContact OG-NE1 3.11Å; V42-W141 HydrophobicContact CG2-CZ2 4.48Å; A45-W141 HydrophobicContact CB-CB 3.81Å; A45-W141 HydrophobicContact CB-CG 4.31Å; V71-W141 HydrophobicContact CG1-CH2 4.27Å; V71-W141 HydrophobicContact CG1-CZ2 4.12Å; V71-W141 HydrophobicContact CG2-CD2 4.33Å; V71-W141 HydrophobicContact CG2-CE3 4.49Å; V71-W141 HydrophobicContact CG2-CH2 4.37Å; V71-W141 HydrophobicContact CG2-CZ2 4.17Å; R74-W141 HydrophobicContact CB-CH2 4.48Å; F137-W141 HydrophobicContact CD1-CB 4.4Å; F137-W141 HydrophobicContact CE1-CB 3.9Å; F137-W141 HydrophobicContact CE1-CG 4.11Å; F137-W141 HydrophobicContact CE2-CB 4.13Å; F137-W141 HydrophobicContact CE2-CG 4.35Å; F137-W141 HydrophobicContact CZ-CB 3.75Å; F137-W141 AromaticContact CZ-CD1 3.89Å; F137-W141 HydrophobicContact CZ-CD2 4.41Å; F137-W141 AromaticContact CZ-CG 3.71Å; F137-W141 HydrophobicContact CZ-CG 3.71Å; F137-W141 VanDerWaalsContact O-CB 3.25Å; F137-W141 WeakPolarHBondContact O-CB 3.32Å; F137-W141 PolarHBondContact O-N 3.04Å; W138-W141 AromaticContact CE3-CE3 3.9Å; W138-W141 HydrophobicContact CE3-CE3 3.9Å; W138-W141 HydrophobicContact CE3-CZ3 4.32Å; W138-W141 HydrophobicContact CH2-CE3 4.33Å; W138-W141 AromaticContact CH2-CZ3 3.98Å; W138-W141 HydrophobicContact CH2-CZ3 3.98Å; W138-W141 AromaticContact CZ3-CE3 3.5Å; W138-W141 HydrophobicContact CZ3-CE3 3.5Å; W138-W141 AromaticContact CZ3-CZ3 3.47Å; W138-W141 HydrophobicContact CZ3-CZ3 3.47Å; W138-W141 VanDerWaalsContact CZ3-CZ3 3.47Å; W138-W141 PolarHBondContact O-N 3.39Å; W141-T143 PolarHBondContact O-N 2.99Å; W141-E144 PolarHBondContact O-N 2.78Å; W141-Y145 AromaticContact CH2-CD1 3.88Å; W141-Y145 HydrophobicContact CH2-CD1 3.88Å; W141-Y145 AromaticContact CH2-CD2 3.93Å; W141-Y145 HydrophobicContact CH2-CD2 3.93Å; W141-Y145 HydrophobicContact CH2-CE1 4.2Å; W141-Y145 HydrophobicContact CH2-CE2 4.24Å; W141-Y145 AromaticContact CH2-CG 3.73Å; W141-Y145 HydrophobicContact CH2-CG 3.73Å; W141-Y145 HydrophobicContact CZ2-CD1 4.36Å; W141-Y145 AromaticContact CZ2-CD2 3.6Å; W141-Y145 HydrophobicContact CZ2-CD2 3.6Å; W141-Y145 HydrophobicContact CZ2-CE2 4.07Å; W141-Y145 AromaticContact CZ2-CG 3.75Å; W141-Y145 HydrophobicContact CZ2-CG 3.75Å; W141-Y145 HydrophobicContact CZ3-CD1 4.25Å; W141-Y145 HydrophobicContact CZ3-CG 4.24Å; W141-Y145 WeakPolarHBondContact O-CA 3.27Å; W141-Y145 WeakPolarHBondContact O-CB 3.37Å; W141-Y145 PolarHBondContact O-N 3.2Å
142	Q	88	Confident	84.3	Confident	87 Å²	87	81.1 Å²	81.1	41%	0.407	40%	0.397	S	S	.	.	H	α-helix	trans	-58.5	-46.6	175.8	-177.3	-177.8	-9	0	0	111.7	W138 R140 Y145 I146	W138-Q142 WeakPolarHBondContact O-CB 3.35Å; W138-Q142 PolarHBondContact O-N 2.67Å; R140-Q142 PolarHBondContact O-N 3.18Å; Q142-Y145 PolarHBondContact O-N 3.33Å; Q142-I146 HydrophobicContact CG-CD1 4.09Å; Q142-I146 VanDerWaalsContact O-CG1 3.28Å; Q142-I146 WeakPolarHBondContact O-CG1 3.36Å; Q142-I146 PolarHBondContact O-N 3.31Å
143	T	87.6	Confident	82.5	Confident	91 Å²	91	81.1 Å²	81.1	56%	0.558	40%	0.402	S	S	*	.	H	α-helix	trans	-61	-46.9	178.4	-54.8	0	0	0	0	111.4	K139 R140 W141	K139-T143 PolarHBondContact O-N 3.2Å; K139-T143 PolarHBondContact O-OG1 3.03Å; R140-T143 PolarHBondContact O-N 2.86Å; W141-T143 PolarHBondContact O-N 2.99Å
144	E	87.9	Confident	80.6	Confident	55 Å²	55	90.5 Å²	90.5	26%	0.257	44%	0.442	S	S	.	.	H	α-helix	trans	-70.1	-40.4	179.7	-68	178.4	-166.5	0	0	111.4	R140 W141 T147	R140-E144 HydrophobicContact CG-CG 4.47Å; R140-E144 VanDerWaalsContact CG-OE1 3.31Å; R140-E144 WeakPolarHBondContact CG-OE1 3.41Å; R140-E144 IonicContact CZ-OE1 2.93Å; R140-E144 IonicContact NE-OE1 3.41Å; R140-E144 PolarHBondContact NE-OE1 2.78Å; R140-E144 IonicContact NH2-OE1 3.57Å; R140-E144 WeakPolarHBondContact O-CG 3.17Å; R140-E144 PolarHBondContact O-N 3.07Å; W141-E144 PolarHBondContact O-N 2.78Å; E144-T147 PolarHBondContact O-N 3.04Å; E144-T147 PolarHBondContact O-OG1 3.03Å
145	Y	86.1	Confident	78.6	Confident	25 Å²	25	102 Å²	102	10%	0.098	49%	0.485	C	S	.	.	H	α-helix	trans	-65.1	-41	-178	178	-105.7	0	0	0	112.5	L38 R74 W141 Q142 T147 T148 L149	L38-Y145 HydrophobicContact CD1-CE2 4.02Å; R74-Y145 PolarHBondContact NE-OH 3.48Å; W141-Y145 AromaticContact CH2-CD1 3.88Å; W141-Y145 HydrophobicContact CH2-CD1 3.88Å; W141-Y145 AromaticContact CH2-CD2 3.93Å; W141-Y145 HydrophobicContact CH2-CD2 3.93Å; W141-Y145 HydrophobicContact CH2-CE1 4.2Å; W141-Y145 HydrophobicContact CH2-CE2 4.24Å; W141-Y145 AromaticContact CH2-CG 3.73Å; W141-Y145 HydrophobicContact CH2-CG 3.73Å; W141-Y145 HydrophobicContact CZ2-CD1 4.36Å; W141-Y145 AromaticContact CZ2-CD2 3.6Å; W141-Y145 HydrophobicContact CZ2-CD2 3.6Å; W141-Y145 HydrophobicContact CZ2-CE2 4.07Å; W141-Y145 AromaticContact CZ2-CG 3.75Å; W141-Y145 HydrophobicContact CZ2-CG 3.75Å; W141-Y145 HydrophobicContact CZ3-CD1 4.25Å; W141-Y145 HydrophobicContact CZ3-CG 4.24Å; W141-Y145 WeakPolarHBondContact O-CA 3.27Å; W141-Y145 WeakPolarHBondContact O-CB 3.37Å; W141-Y145 PolarHBondContact O-N 3.2Å; Q142-Y145 PolarHBondContact O-N 3.33Å; Y145-T147 PolarHBondContact O-N 3.15Å; Y145-T148 WeakPolarHBondContact O-CA 3.21Å; Y145-T148 WeakPolarHBondContact O-CB 3.08Å; Y145-T148 PolarHBondContact O-N 2.86Å; Y145-T148 PolarHBondContact O-OG1 3.12Å; Y145-L149 HydrophobicContact CD1-CD1 4.34Å; Y145-L149 HydrophobicContact CD1-CG 4.47Å; Y145-L149 HydrophobicContact CE1-CD1 3.96Å; Y145-L149 HydrophobicContact CE1-CD2 3.94Å; Y145-L149 HydrophobicContact CE1-CG 4.1Å; Y145-L149 PolarHBondContact O-N 3.35Å
146	I	78.8	Confident	77	Confident	89 Å²	89	102.3 Å²	102.3	46%	0.456	50%	0.495	S	S	.	.	H	α-helix	trans	-56.3	-39.6	177.2	-72.3	165.9	0	0	0	110.8	Q142 T148 L149	Q142-I146 HydrophobicContact CG-CD1 4.09Å; Q142-I146 VanDerWaalsContact O-CG1 3.28Å; Q142-I146 WeakPolarHBondContact O-CG1 3.36Å; Q142-I146 PolarHBondContact O-N 3.31Å; I146-T148 PolarHBondContact O-N 3.04Å; I146-L149 WeakPolarHBondContact O-CB 3.49Å; I146-L149 PolarHBondContact O-N 3.05Å
147	T	77.2	Confident	75.2	Confident	102 Å²	102	101.4 Å²	101.4	63%	0.626	51%	0.51	S	S	*	.	H	α-helix	trans	-63.4	-27.1	177.1	73.6	0	0	0	0	112.7	E144 Y145 L149	E144-T147 PolarHBondContact O-N 3.04Å; E144-T147 PolarHBondContact O-OG1 3.03Å; Y145-T147 PolarHBondContact O-N 3.15Å; T147-L149 VanDerWaalsContact C-N 3.33Å
148	T	75.1	Confident	73.8	Confident	60 Å²	60	108.5 Å²	108.5	37%	0.368	55%	0.553	S	S	.	*	H	α-helix	trans	-77.8	-16.2	175.8	75.7	0	0	0	0	113.3	Y145 I146 I151	Y145-T148 WeakPolarHBondContact O-CA 3.21Å; Y145-T148 WeakPolarHBondContact O-CB 3.08Å; Y145-T148 PolarHBondContact O-N 2.86Å; Y145-T148 PolarHBondContact O-OG1 3.12Å; I146-T148 PolarHBondContact O-N 3.04Å; T148-I151 WeakPolarHBondContact O-CD1 3.49Å; T148-I151 VanDerWaalsContact O-CG1 3.23Å; T148-I151 WeakPolarHBondContact O-CG1 3.47Å
149	L	74.5	Confident	72.7	Confident	107 Å²	107	113.6 Å²	113.6	56%	0.56	58%	0.577	S	S	*	*	H	α-helix	trans	-77.5	-29.1	176	-62.2	177.7	0	0	0	111.9	Y145 I146 T147 I151	Y145-L149 HydrophobicContact CD1-CD1 4.34Å; Y145-L149 HydrophobicContact CD1-CG 4.47Å; Y145-L149 HydrophobicContact CE1-CD1 3.96Å; Y145-L149 HydrophobicContact CE1-CD2 3.94Å; Y145-L149 HydrophobicContact CE1-CG 4.1Å; Y145-L149 PolarHBondContact O-N 3.35Å; I146-L149 WeakPolarHBondContact O-CB 3.49Å; I146-L149 PolarHBondContact O-N 3.05Å; T147-L149 VanDerWaalsContact C-N 3.33Å; L149-I151 PolarHBondContact O-N 3.47Å
150	S	64.8	Low	72	Confident	96 Å²	96	111.1 Å²	111.1	67%	0.671	58%	0.577	S	S	*	*			trans	-77.4	32.3	-178.5	-54.5	0	0	0	0	114.5	R152	S150-R152 PolarHBondContact O-N 3.48Å
151	I	62.5	Low	71.5	Confident	97 Å²	97	109.7 Å²	109.7	50%	0.497	58%	0.58	S	S	.	*			trans	-68.2	109.6	178.6	-64.9	154.5	0	0	0	109.3	T148 L149 K153	T148-I151 WeakPolarHBondContact O-CD1 3.49Å; T148-I151 VanDerWaalsContact O-CG1 3.23Å; T148-I151 WeakPolarHBondContact O-CG1 3.47Å; L149-I151 PolarHBondContact O-N 3.47Å; I151-K153 PolarHBondContact O-N 3.39Å
152	R	53.2	Low	71.1	Confident	238 Å²	238	109.8 Å²	109.8	90%	0.898	58%	0.581	S	S	*	*			trans	-61.5	107.9	166.8	-67.3	-174	-177.9	-175.3	0.5	108.5	S150 K154	S150-R152 PolarHBondContact O-N 3.48Å; R152-K154 PolarHBondContact O-N 3.32Å; R152-K154 VanDerWaalsContact O-N 3.15Å
153	K	55.5	Low	71.1	Confident	181 Å²	181	111 Å²	111	79%	0.787	59%	0.588	S	S	*	*			trans	-61.3	117.5	167.7	-70.1	-177.1	-179	176.6	0	107.4	I151 W155	I151-K153 PolarHBondContact O-N 3.39Å; K153-W155 PolarHBondContact O-N 2.94Å
154	K	54.3	Low	71.3	Confident	211 Å²	211	111.2 Å²	111.2	92%	0.917	59%	0.588	S	S	*	*			trans	-71.3	112	166.1	-159.7	176	-175.5	179.9	0	105.9	R152 G156	R152-K154 PolarHBondContact O-N 3.32Å; R152-K154 VanDerWaalsContact O-N 3.15Å; K154-G156 PolarHBondContact O-N 2.86Å
155	W	51.1	Low	71.3	Confident	246 Å²	246	109.9 Å²	109.9	93%	0.932	59%	0.589	S	S	*	*			trans	-60.8	104.5	174.6	-63	93.7	0	0	0	108.3	K153	K153-W155 PolarHBondContact O-N 2.94Å
156	G	58.5	Low	71.4	Confident	68 Å²	68	109.8 Å²	109.8	70%	0.701	59%	0.591	S	S	*	*	P	Polyproline II helix	trans	-89.7	129.7	165.4	0	0	0	0	0	107.9	K154	K154-G156 PolarHBondContact O-N 2.86Å
157	G	57	Low	71.9	Confident	72 Å²	72	110.1 Å²	110.1	74%	0.742	59%	0.592	S	S	*	*	P	Polyproline II helix	trans	-56.4	148.6	171.9	0	0	0	0	0	111.4	K159	G157-K159 PolarHBondContact O-N 3.47Å
158	V	64.9	Low	72.4	Confident	151 Å²	151	105.2 Å²	105.2	92%	0.915	56%	0.563	S	S	*	*	P	Polyproline II helix	trans	-63	117.1	176.6	179.4	0	0	0	0	108.4
159	K	70.4	Confident	73.1	Confident	171 Å²	171	103.7 Å²	103.7	74%	0.743	55%	0.552	S	S	*	*	P	Polyproline II helix	trans	-86.6	143.1	171.2	-68.5	-174.7	179.2	-177.5	0	109	G157 S161	G157-K159 PolarHBondContact O-N 3.47Å; K159-S161 PolarHBondContact O-N 2.93Å
160	P	76.6	Confident	73.8	Confident	100 Å²	100	98.6 Å²	98.6	65%	0.649	53%	0.525	S	S	*	.	P	Polyproline II helix	trans	-57.9	130.8	174.7	21.7	-30.3	0	0	0	110.3	L217	P160-L217 HydrophobicContact CB-CD1 4.38Å; P160-L217 HydrophobicContact CG-CD1 4.23Å
161	S	83.9	Confident	74.9	Confident	55 Å²	55	94.4 Å²	94.4	39%	0.385	50%	0.497	S	S	.	.	P	Polyproline II helix	trans	-73.2	135.8	178	-66.3	0	0	0	0	110.2	K159	K159-S161 PolarHBondContact O-N 2.93Å
162	P	84.7	Confident	75.9	Confident	4 Å²	4	92.3 Å²	92.3	3%	0.026	48%	0.484	C	S	.	.	P	Polyproline II helix	trans	-63.6	138.7	173.8	26.1	-33.3	0	0	0	111	V185 V188 V196 V199 V212 L217	P162-V185 HydrophobicContact CB-CG2 4.19Å; P162-V188 WeakPolarHBondContact O-CG1 3.35Å; P162-V196 HydrophobicContact CG-CG1 4.48Å; P162-V199 HydrophobicContact CB-CG1 4.24Å; P162-V199 HydrophobicContact CG-CG1 3.63Å; P162-V212 HydrophobicContact CG-CG1 4.18Å; P162-V212 HydrophobicContact CG-CG2 3.82Å; P162-L217 HydrophobicContact CB-CD2 4.07Å
163	M	89.3	Confident	77	Confident	113 Å²	113	85.8 Å²	85.8	56%	0.557	46%	0.464	S	S	*	.			trans	-109.5	161.6	177.8	-62.8	-177.6	73.5	0	0	110.9	G165 D166 V185	M163-G165 PolarHBondContact O-N 3.09Å; M163-D166 PolarHBondContact N-OD2 3.1Å; M163-D166 WeakPolarHBondContact O-CB 3.48Å; M163-D166 PolarHBondContact O-N 3.01Å; M163-D166 VanDerWaalsContact O-N 3.13Å; M163-V185 VanDerWaalsContact O-CB 3.3Å; M163-V185 WeakPolarHBondContact O-CB 3.37Å; M163-V185 WeakPolarHBondContact O-CG1 3.34Å
164	V	91.6	Very high	78.3	Confident	94 Å²	94	85 Å²	85	57%	0.57	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	129	171.8	179.3	0	0	0	0	109	V188	V164-V188 HydrophobicContact CG2-CG1 4.23Å; V164-V188 HydrophobicContact CG2-CG2 4.43Å
165	G	87.9	Confident	79.7	Confident	27 Å²	27	78.3 Å²	78.3	28%	0.278	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	103.5	-25.1	-176.2	0	0	0	0	0	114.2	M163 V185	M163-G165 PolarHBondContact O-N 3.09Å; G165-V185 PolarHBondContact N-O 3.2Å
166	D	87.8	Confident	81.3	Confident	24 Å²	24	70.1 Å²	70.1	13%	0.128	42%	0.421	C	S	.	.			trans	-62.9	140.3	-178.1	-74.5	-25.4	0	0	0	111.6	M163 V185 L217 R220	M163-D166 PolarHBondContact N-OD2 3.1Å; M163-D166 WeakPolarHBondContact O-CB 3.48Å; M163-D166 PolarHBondContact O-N 3.01Å; M163-D166 VanDerWaalsContact O-N 3.13Å; D166-V185 HydrophobicContact CB-CG2 4.31Å; D166-V185 PolarHBondContact O-N 2.76Å; D166-L217 HydrophobicContact CB-CD2 3.57Å; D166-L217 WeakPolarHBondContact OD2-CD2 3.34Å; D166-R220 IonicContact OD1-NE 3.94Å; D166-R220 IonicContact OD2-NH2 3.82Å
167	I	88.4	Confident	82.3	Confident	95 Å²	95	74.7 Å²	74.7	49%	0.487	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	131.8	171.7	-52.4	178.8	0	0	0	108.4	L218	I167-L218 HydrophobicContact CB-CD1 4.46Å; I167-L218 HydrophobicContact CG2-CD1 3.79Å; I167-L218 PolarHBondContact O-N 2.82Å; I167-L218 VanDerWaalsContact O-N 3.08Å
168	V	88.7	Confident	83.6	Confident	0 Å²	0	78.9 Å²	78.9	0%	0	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	150	-173.7	-63.1	0	0	0	0	111.7	M182 G183 V185 L201 V215 H216 L217	V168-M182 CarbonylContact O-C 3.58Å; V168-M182 WeakPolarHBondContact O-CA 3.35Å; V168-G183 WeakPolarHBondContact CG2-O 3.42Å; V168-G183 PolarHBondContact N-O 3.45Å; V168-G183 PolarHBondContact O-N 2.88Å; V168-V185 HydrophobicContact CG1-CG2 3.99Å; V168-V185 HydrophobicContact CG2-CG2 4.28Å; V168-L201 HydrophobicContact CG2-CD1 3.82Å; V168-L201 HydrophobicContact CG2-CD2 3.55Å; V168-L201 HydrophobicContact CG2-CG 4.31Å; V168-V215 HydrophobicContact CB-CG1 3.31Å; V168-V215 HydrophobicContact CG1-CG1 3.43Å; V168-V215 VanDerWaalsContact CG1-CG1 3.43Å; V168-V215 HydrophobicContact CG2-CG1 3.43Å; V168-V215 VanDerWaalsContact CG2-CG1 3.43Å; V168-H216 CarbonylContact C-O 3.51Å; V168-H216 WeakPolarHBondContact CA-O 3.36Å; V168-H216 WeakPolarHBondContact CB-O 3.4Å; V168-L217 HydrophobicContact CG1-CD2 3.85Å; V168-L217 HydrophobicContact CG1-CG 4.46Å
169	L	89.4	Confident	84.5	Confident	28 Å²	28	80.1 Å²	80.1	15%	0.147	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	132.4	162.9	-70.3	169.7	0	0	0	110	W180 M182 H216 L218	L169-W180 HydrophobicContact CB-CE3 4.28Å; L169-W180 HydrophobicContact CD2-CB 4.43Å; L169-M182 HydrophobicContact CD2-CG 3.6Å; L169-H216 HydrophobicContact CB-CB 4.39Å; L169-H216 PolarHBondContact N-O 3.13Å; L169-H216 PolarHBondContact O-N 2.78Å; L169-L218 HydrophobicContact CD1-CD2 3.72Å; L169-L218 HydrophobicContact CG-CD2 3.81Å; L169-L218 HydrophobicContact CG-CG 4.26Å
170	V	88.9	Confident	85.4	Confident	0 Å²	0	74.3 Å²	74.3	0%	0	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	110.6	178.5	-175	0	0	0	0	109.4	E172 W180 A181 L201 T203 I208 R210	V170-E172 PolarHBondContact O-N 3.16Å; V170-W180 VanDerWaalsContact O-CB 3.31Å; V170-W180 WeakPolarHBondContact O-CB 3.38Å; V170-A181 PolarHBondContact N-O 2.88Å; V170-L201 HydrophobicContact CG2-CD1 3.43Å; V170-L201 VanDerWaalsContact CG2-CD1 3.43Å; V170-T203 HydrophobicContact CG2-CG2 4.49Å; V170-I208 HydrophobicContact CG1-CD1 4.03Å; V170-I208 HydrophobicContact CG2-CD1 4.33Å; V170-R210 HydrophobicContact CG1-CG 3.9Å
171	A	87.7	Confident	85.9	Confident	8 Å²	8	71.2 Å²	71.2	7%	0.066	37%	0.365	C	S	.	.			trans	-68.5	121.4	179.7	0	0	0	0	0	111.1	R27 W180 K214	R27-A171 PolarHBondContact NH1-O 2.95Å; A171-W180 HydrophobicContact CB-CD2 4.26Å; A171-W180 HydrophobicContact CB-CE3 4.11Å; A171-W180 HydrophobicContact CB-CH2 3.79Å; A171-W180 HydrophobicContact CB-CZ2 3.93Å; A171-W180 HydrophobicContact CB-CZ3 3.88Å; A171-K214 HydrophobicContact CB-CB 4.36Å; A171-K214 HydrophobicContact CB-CD 4.22Å; A171-K214 WeakPolarHBondContact CB-O 3.31Å; A171-K214 PolarHBondContact N-O 3.22Å
172	E	84.1	Confident	86.2	Confident	52 Å²	52	74.4 Å²	74.4	24%	0.243	38%	0.375	C	S	.	.			trans	-109.5	128.6	176.9	-74.1	-67.1	144.1	0	0	109.9	R27 V170 L175 W180	R27-E172 IonicContact CZ-OE1 2.87Å; R27-E172 IonicContact CZ-OE2 3.19Å; R27-E172 IonicContact NH1-OE1 2.85Å; R27-E172 PolarHBondContact NH1-OE1 3.43Å; R27-E172 IonicContact NH1-OE2 3.77Å; R27-E172 PolarHBondContact NH1-OE2 3.25Å; R27-E172 IonicContact NH2-OE2 3.97Å; R27-E172 PolarHBondContact NH2-OE2 2.84Å; V170-E172 PolarHBondContact O-N 3.16Å; E172-L175 HydrophobicContact CB-CB 4.13Å; E172-L175 HydrophobicContact CB-CD1 3.86Å; E172-L175 HydrophobicContact CB-CG 4.32Å; E172-L175 HydrophobicContact CG-CD1 4.2Å; E172-W180 PolarHBondContact O-NE1 3.05Å
173	E	76	Confident	86.4	Confident	101 Å²	101	74.4 Å²	74.4	47%	0.472	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	133.1	169.8	-68	173.4	-173.9	0	0	108.2	K214	E173-K214 IonicContact OE1-NZ 3.71Å; E173-K214 PolarHBondContact OE1-NZ 2.82Å
174	N	83.5	Confident	86.6	Confident	164 Å²	164	76.6 Å²	76.6	88%	0.877	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.8	13.8	-178.6	-41.5	-54.8	0	0	0	116.8
175	L	83.3	Confident	86.6	Confident	72 Å²	72	72.2 Å²	72.2	38%	0.377	35%	0.352	S	S	.	.	S	Bend	trans	-121.5	138.7	169.6	-71.4	175.1	0	0	0	111.4	E172 R179 W180	E172-L175 HydrophobicContact CB-CB 4.13Å; E172-L175 HydrophobicContact CB-CD1 3.86Å; E172-L175 HydrophobicContact CB-CG 4.32Å; E172-L175 HydrophobicContact CG-CD1 4.2Å; L175-R179 HydrophobicContact CB-CB 4.39Å; L175-R179 HydrophobicContact CD2-CB 4.45Å; L175-W180 PolarHBondContact O-NE1 2.93Å; L175-W180 VanDerWaalsContact O-NE1 3.12Å
176	P	84.6	Confident	86.9	Confident	73 Å²	73	74 Å²	74	47%	0.474	35%	0.352	S	S	.	.			trans	-62.2	148.6	170.1	28.6	-34.4	0	0	0	109.7	I178 R179	P176-I178 HydrophobicContact CB-CG2 4.36Å; P176-I178 HydrophobicContact CG-CG2 4.29Å; P176-I178 PolarHBondContact O-N 3.07Å; P176-R179 HydrophobicContact CG-CB 4.33Å; P176-R179 HydrophobicContact CG-CG 4.01Å; P176-R179 PolarHBondContact O-N 2.89Å
177	R	80.5	Confident	87.1	Confident	165 Å²	165	76.6 Å²	76.6	62%	0.623	36%	0.363	S	S	*	.	G	3₁₀ helix	trans	-52.3	-33.7	-174.1	-173.6	174.2	-179.5	-155	-1.7	114	R179 W180	R177-R179 PolarHBondContact O-N 3.15Å; R177-W180 HydrophobicContact CB-CD2 4.32Å; R177-W180 HydrophobicContact CB-CE3 4.45Å; R177-W180 HydrophobicContact CB-CZ2 4.41Å; R177-W180 HydrophobicContact CG-CD2 4.05Å; R177-W180 HydrophobicContact CG-CE3 3.73Å; R177-W180 HydrophobicContact CG-CH2 4.22Å; R177-W180 HydrophobicContact CG-CZ3 3.82Å; R177-W180 WeakPolarHBondContact O-CB 3.32Å; R177-W180 PolarHBondContact O-N 2.9Å; R177-W180 VanDerWaalsContact O-N 3.16Å
178	I	82.5	Confident	87.4	Confident	159 Å²	159	74.1 Å²	74.1	82%	0.815	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	-64.3	-21.6	177.8	-163.4	164.2	0	0	0	113.7	P176	P176-I178 HydrophobicContact CB-CG2 4.36Å; P176-I178 HydrophobicContact CG-CG2 4.29Å; P176-I178 PolarHBondContact O-N 3.07Å
179	R	85.7	Confident	87.5	Confident	178 Å²	178	76.9 Å²	76.9	67%	0.672	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-98.4	3.4	178.2	-65.9	-172.7	-177.4	-176.6	0.3	113.1	L175 P176 R177 A181	L175-R179 HydrophobicContact CB-CB 4.39Å; L175-R179 HydrophobicContact CD2-CB 4.45Å; P176-R179 HydrophobicContact CG-CB 4.33Å; P176-R179 HydrophobicContact CG-CG 4.01Å; P176-R179 PolarHBondContact O-N 2.89Å; R177-R179 PolarHBondContact O-N 3.15Å; R179-A181 PolarHBondContact O-N 3.08Å
180	W	89.4	Confident	87.5	Confident	48 Å²	48	79.4 Å²	79.4	18%	0.182	39%	0.385	C	S	.	.	P	Polyproline II helix	trans	-66.1	133.9	175.7	-70.7	-1.7	0	0	0	110	L169 V170 A171 E172 L175 R177 H216	L169-W180 HydrophobicContact CB-CE3 4.28Å; L169-W180 HydrophobicContact CD2-CB 4.43Å; V170-W180 VanDerWaalsContact O-CB 3.31Å; V170-W180 WeakPolarHBondContact O-CB 3.38Å; A171-W180 HydrophobicContact CB-CD2 4.26Å; A171-W180 HydrophobicContact CB-CE3 4.11Å; A171-W180 HydrophobicContact CB-CH2 3.79Å; A171-W180 HydrophobicContact CB-CZ2 3.93Å; A171-W180 HydrophobicContact CB-CZ3 3.88Å; E172-W180 PolarHBondContact O-NE1 3.05Å; L175-W180 PolarHBondContact O-NE1 2.93Å; L175-W180 VanDerWaalsContact O-NE1 3.12Å; R177-W180 HydrophobicContact CB-CD2 4.32Å; R177-W180 HydrophobicContact CB-CE3 4.45Å; R177-W180 HydrophobicContact CB-CZ2 4.41Å; R177-W180 HydrophobicContact CG-CD2 4.05Å; R177-W180 HydrophobicContact CG-CE3 3.73Å; R177-W180 HydrophobicContact CG-CH2 4.22Å; R177-W180 HydrophobicContact CG-CZ3 3.82Å; R177-W180 WeakPolarHBondContact O-CB 3.32Å; R177-W180 PolarHBondContact O-N 2.9Å; R177-W180 VanDerWaalsContact O-N 3.16Å; W180-H216 AromaticContact CH2-NE2 3.97Å; W180-H216 AromaticContact CZ3-CD2 3.48Å; W180-H216 VanDerWaalsContact CZ3-CD2 3.48Å; W180-H216 WeakPolarHBondContact CZ3-CD2 3.46Å; W180-H216 AromaticContact CZ3-NE2 3.64Å
181	A	87.1	Confident	87.2	Confident	35 Å²	35	80.4 Å²	80.4	29%	0.289	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	141.6	178.7	0	0	0	0	0	109.9	V170 R179	V170-A181 PolarHBondContact N-O 2.88Å; R179-A181 PolarHBondContact O-N 3.08Å
182	M	89.6	Confident	86.9	Confident	122 Å²	122	86.1 Å²	86.1	60%	0.601	44%	0.435	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.9	145.4	165.3	-69.2	-176.2	-66.5	0	0	109.7	V168 L169 L218	V168-M182 CarbonylContact O-C 3.58Å; V168-M182 WeakPolarHBondContact O-CA 3.35Å; L169-M182 HydrophobicContact CD2-CG 3.6Å; M182-L218 HydrophobicContact CG-CD1 4.49Å; M182-L218 HydrophobicContact SD-CD1 4.12Å
183	G	89.4	Confident	87	Confident	4 Å²	4	87.4 Å²	87.4	4%	0.041	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	155.2	172.3	0	0	0	0	0	111.5	V168 R202	V168-G183 WeakPolarHBondContact CG2-O 3.42Å; V168-G183 PolarHBondContact N-O 3.45Å; V168-G183 PolarHBondContact O-N 2.88Å; G183-R202 CarbonylContact C-O 3.55Å; G183-R202 WeakPolarHBondContact CA-O 3.32Å
184	R	92.5	Very high	87.4	Confident	160 Å²	160	85.2 Å²	85.2	60%	0.604	45%	0.448	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.8	129	171.6	-172.9	175.7	-179.1	-172.5	-3.6	109.6	F186 L201 R202	R184-F186 PolarHBondContact O-N 3.24Å; R184-L201 CarbonylContact O-C 3.58Å; R184-L201 WeakPolarHBondContact O-CA 3.34Å; R184-R202 PolarHBondContact N-O 2.94Å; R184-R202 PolarHBondContact O-N 2.89Å
185	V	91.9	Very high	87.5	Confident	1 Å²	1	82.4 Å²	82.4	1%	0.006	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	119.9	173.9	-177.8	0	0	0	0	108.5	P162 M163 G165 D166 V168 V188 V199 L201	P162-V185 HydrophobicContact CB-CG2 4.19Å; M163-V185 VanDerWaalsContact O-CB 3.3Å; M163-V185 WeakPolarHBondContact O-CB 3.37Å; M163-V185 WeakPolarHBondContact O-CG1 3.34Å; G165-V185 PolarHBondContact N-O 3.2Å; D166-V185 HydrophobicContact CB-CG2 4.31Å; D166-V185 PolarHBondContact O-N 2.76Å; V168-V185 HydrophobicContact CG1-CG2 3.99Å; V168-V185 HydrophobicContact CG2-CG2 4.28Å; V185-V188 HydrophobicContact CG1-CG1 4.02Å; V185-V199 HydrophobicContact CG1-CB 4.21Å; V185-V199 HydrophobicContact CG1-CG1 4.14Å; V185-L201 HydrophobicContact CB-CD2 4.1Å; V185-L201 HydrophobicContact CG2-CD2 3.46Å; V185-L201 VanDerWaalsContact CG2-CD2 3.46Å
186	F	93.1	Very high	87.6	Confident	64 Å²	64	80.3 Å²	80.3	28%	0.281	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	-17.2	174.4	72.1	-95.2	0	0	0	112.7	R184 R200 R202 D207	R184-F186 PolarHBondContact O-N 3.24Å; F186-R200 HydrophobicContact CD1-CB 4.21Å; F186-R200 VanDerWaalsContact CD1-O 3.32Å; F186-R200 WeakPolarHBondContact CD1-O 3.38Å; F186-R200 HydrophobicContact CD2-CB 4.49Å; F186-R200 HydrophobicContact CE1-CB 3.54Å; F186-R200 HydrophobicContact CE2-CB 3.85Å; F186-R200 HydrophobicContact CZ-CB 3.34Å; F186-R200 HydrophobicContact CZ-CG 4.3Å; F186-R200 PolarHBondContact N-O 2.66Å; F186-R202 HydrophobicContact CD1-CB 4.17Å; F186-D207 HydrophobicContact CE1-CB 4.21Å; F186-D207 HydrophobicContact CZ-CB 4.35Å
187	Q	93.6	Very high	87.8	Confident	79 Å²	79	83 Å²	83	37%	0.369	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	133.5	175.4	-171.3	176.5	12.4	0	0	110.2	L189 R200	Q187-L189 HydrophobicContact CG-CD2 4.23Å; Q187-R200 HydrophobicContact CB-CB 4.13Å; Q187-R200 HydrophobicContact CB-CG 4.36Å; Q187-R200 PolarHBondContact O-N 2.83Å
188	V	93.2	Very high	88.3	Confident	44 Å²	44	75.7 Å²	75.7	27%	0.267	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	141.5	170.8	-64.4	0	0	0	0	109.8	P162 V164 V185 P190 V196 V199	P162-V188 WeakPolarHBondContact O-CG1 3.35Å; V164-V188 HydrophobicContact CG2-CG1 4.23Å; V164-V188 HydrophobicContact CG2-CG2 4.43Å; V185-V188 HydrophobicContact CG1-CG1 4.02Å; V188-P190 WeakPolarHBondContact O-CD 3.37Å; V188-V196 HydrophobicContact CB-CG1 4.02Å; V188-V196 HydrophobicContact CB-CG2 4.16Å; V188-V196 HydrophobicContact CG1-CG1 4.29Å; V188-V199 HydrophobicContact CG1-CG1 4.24Å
189	L	91	Very high	88.7	Confident	57 Å²	57	68.1 Å²	68.1	30%	0.298	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	94.1	179.4	-56.8	175.4	0	0	0	109	Q187 R197 S198 R200 T209	Q187-L189 HydrophobicContact CG-CD2 4.23Å; L189-R197 PolarHBondContact O-N 2.99Å; L189-S198 WeakPolarHBondContact CA-O 3.45Å; L189-S198 WeakPolarHBondContact CB-O 3.18Å; L189-S198 PolarHBondContact N-O 2.87Å; L189-S198 PolarHBondContact O-N 2.86Å; L189-R200 HydrophobicContact CD1-CG 4.14Å; L189-T209 HydrophobicContact CD1-CG2 3.9Å
190	P	89.7	Confident	89.1	Confident	81 Å²	81	64.1 Å²	64.1	53%	0.526	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	151	177.7	30	-33.3	0	0	0	112	V188 L195	V188-P190 WeakPolarHBondContact O-CD 3.37Å; P190-L195 CarbonylContact C-O 3.52Å; P190-L195 WeakPolarHBondContact CA-O 3.48Å
191	G	83.7	Confident	89.3	Confident	21 Å²	21	61.9 Å²	61.9	22%	0.216	34%	0.335	C	S	.	.			trans	-75.5	179.5	166.4	0	0	0	0	0	112.3	D193 G194 L195	G191-D193 PolarHBondContact O-N 3.07Å; G191-D193 VanDerWaalsContact O-N 3.15Å; G191-G194 PolarHBondContact O-N 3.35Å; G191-L195 PolarHBondContact N-O 3.19Å
192	S	81.8	Confident	89.6	Confident	129 Å²	129	67.2 Å²	67.2	90%	0.902	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-18	173.8	55	0	0	0	0	113.9
193	D	85.3	Confident	89.6	Confident	79 Å²	79	62.2 Å²	62.2	42%	0.422	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93	4.7	176.4	58.6	-12.7	0	0	0	113.3	G191 L195 R197	G191-D193 PolarHBondContact O-N 3.07Å; G191-D193 VanDerWaalsContact O-N 3.15Å; D193-L195 PolarHBondContact O-N 3.13Å; D193-L195 PolarHBondContact OD1-N 2.73Å; D193-L195 WeakPolarHBondContact OD2-CD1 3.42Å; D193-R197 IonicContact OD1-CZ 2.71Å; D193-R197 IonicContact OD1-NE 2.66Å; D193-R197 IonicContact OD1-NH1 2.86Å; D193-R197 IonicContact OD1-NH2 3.87Å; D193-R197 PolarHBondContact OD1-NH2 2.92Å; D193-R197 IonicContact OD2-CZ 3.06Å; D193-R197 IonicContact OD2-NH2 2.67Å; D193-R197 PolarHBondContact OD2-NH2 2.96Å
194	G	83.7	Confident	89.5	Confident	55 Å²	55	67.7 Å²	67.7	57%	0.567	36%	0.362	S	S	*	.	S	Bend	trans	77.8	-6.8	-177.6	0	0	0	0	0	114.8	G191	G191-G194 PolarHBondContact O-N 3.35Å
195	L	85.4	Confident	89.2	Confident	105 Å²	105	71.5 Å²	71.5	55%	0.55	38%	0.376	S	S	.	.			trans	-76.8	133.4	178.8	-63.4	-180	0	0	0	111.1	P190 G191 D193 R197	P190-L195 CarbonylContact C-O 3.52Å; P190-L195 WeakPolarHBondContact CA-O 3.48Å; G191-L195 PolarHBondContact N-O 3.19Å; D193-L195 PolarHBondContact O-N 3.13Å; D193-L195 PolarHBondContact OD1-N 2.73Å; D193-L195 WeakPolarHBondContact OD2-CD1 3.42Å; L195-R197 PolarHBondContact O-N 2.84Å
196	V	87	Confident	89.2	Confident	28 Å²	28	73 Å²	73	17%	0.17	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	113.6	176.9	-174.8	0	0	0	0	109.5	P162 V188 S198 V199 V212	P162-V196 HydrophobicContact CG-CG1 4.48Å; V188-V196 HydrophobicContact CB-CG1 4.02Å; V188-V196 HydrophobicContact CB-CG2 4.16Å; V188-V196 HydrophobicContact CG1-CG1 4.29Å; V196-S198 WeakPolarHBondContact CG1-O 3.19Å; V196-V199 HydrophobicContact CG1-CG1 3.89Å; V196-V212 HydrophobicContact CB-CG2 4.44Å; V196-V212 HydrophobicContact CG1-CG2 3.81Å; V196-V212 WeakPolarHBondContact O-CG2 3.36Å
197	R	87	Confident	89.2	Confident	130 Å²	130	73.6 Å²	73.6	49%	0.491	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	-28.8	179.3	-67.6	-175.5	-179.4	139.7	-1	112.8	L189 D193 L195 P211 V212	L189-R197 PolarHBondContact O-N 2.99Å; D193-R197 IonicContact OD1-CZ 2.71Å; D193-R197 IonicContact OD1-NE 2.66Å; D193-R197 IonicContact OD1-NH1 2.86Å; D193-R197 IonicContact OD1-NH2 3.87Å; D193-R197 PolarHBondContact OD1-NH2 2.92Å; D193-R197 IonicContact OD2-CZ 3.06Å; D193-R197 IonicContact OD2-NH2 2.67Å; D193-R197 PolarHBondContact OD2-NH2 2.96Å; L195-R197 PolarHBondContact O-N 2.84Å; R197-P211 CarbonylContact O-C 3.48Å; R197-P211 WeakPolarHBondContact O-CA 3.3Å; R197-V212 PolarHBondContact O-N 3.15Å
198	S	91.2	Very high	89.1	Confident	11 Å²	11	71.9 Å²	71.9	8%	0.077	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	156.6	178.1	-61.5	0	0	0	0	111	T25 L189 V196 R210	T25-S198 WeakPolarHBondContact CB-OG 3.44Å; T25-S198 PolarHBondContact OG1-OG 3.44Å; L189-S198 WeakPolarHBondContact CA-O 3.45Å; L189-S198 WeakPolarHBondContact CB-O 3.18Å; L189-S198 PolarHBondContact N-O 2.87Å; L189-S198 PolarHBondContact O-N 2.86Å; V196-S198 WeakPolarHBondContact CG1-O 3.19Å; S198-R210 CarbonylContact C-O 3.39Å; S198-R210 WeakPolarHBondContact CA-O 3.38Å
199	V	92.5	Very high	89.1	Confident	0 Å²	0	71.9 Å²	71.9	0%	0	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	146.6	177	-69.9	0	0	0	0	109.7	P162 V185 V188 V196 L201 T209 R210 V212 V215	P162-V199 HydrophobicContact CB-CG1 4.24Å; P162-V199 HydrophobicContact CG-CG1 3.63Å; V185-V199 HydrophobicContact CG1-CB 4.21Å; V185-V199 HydrophobicContact CG1-CG1 4.14Å; V188-V199 HydrophobicContact CG1-CG1 4.24Å; V196-V199 HydrophobicContact CG1-CG1 3.89Å; V199-L201 HydrophobicContact CB-CD2 4.13Å; V199-L201 HydrophobicContact CG2-CD1 4.27Å; V199-L201 HydrophobicContact CG2-CD2 3.65Å; V199-L201 HydrophobicContact CG2-CG 3.95Å; V199-T209 WeakPolarHBondContact O-CA 3.32Å; V199-R210 PolarHBondContact N-O 3.25Å; V199-R210 PolarHBondContact O-N 3.35Å; V199-V212 HydrophobicContact CG1-CG2 4.3Å; V199-V215 HydrophobicContact CG2-CB 4.45Å; V199-V215 HydrophobicContact CG2-CG1 4.3Å; V199-V215 HydrophobicContact CG2-CG2 3.84Å
200	R	93.8	Very high	89.1	Confident	94 Å²	94	70.2 Å²	70.2	36%	0.355	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	129	166.3	-56	177.6	73.2	-171.1	-0.2	108.9	F186 Q187 L189 I208 T209	F186-R200 HydrophobicContact CD1-CB 4.21Å; F186-R200 VanDerWaalsContact CD1-O 3.32Å; F186-R200 WeakPolarHBondContact CD1-O 3.38Å; F186-R200 HydrophobicContact CD2-CB 4.49Å; F186-R200 HydrophobicContact CE1-CB 3.54Å; F186-R200 HydrophobicContact CE2-CB 3.85Å; F186-R200 HydrophobicContact CZ-CB 3.34Å; F186-R200 HydrophobicContact CZ-CG 4.3Å; F186-R200 PolarHBondContact N-O 2.66Å; Q187-R200 HydrophobicContact CB-CB 4.13Å; Q187-R200 HydrophobicContact CB-CG 4.36Å; Q187-R200 PolarHBondContact O-N 2.83Å; L189-R200 HydrophobicContact CD1-CG 4.14Å; R200-I208 WeakPolarHBondContact CA-O 3.43Å; R200-T209 HydrophobicContact CG-CG2 4.24Å
201	L	92.9	Very high	89.2	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	137	-171.9	-55	177.7	0	0	0	108.9	V168 V170 R184 V185 V199 T203 D207 I208 R210 V215	V168-L201 HydrophobicContact CG2-CD1 3.82Å; V168-L201 HydrophobicContact CG2-CD2 3.55Å; V168-L201 HydrophobicContact CG2-CG 4.31Å; V170-L201 HydrophobicContact CG2-CD1 3.43Å; V170-L201 VanDerWaalsContact CG2-CD1 3.43Å; R184-L201 CarbonylContact O-C 3.58Å; R184-L201 WeakPolarHBondContact O-CA 3.34Å; V185-L201 HydrophobicContact CB-CD2 4.1Å; V185-L201 HydrophobicContact CG2-CD2 3.46Å; V185-L201 VanDerWaalsContact CG2-CD2 3.46Å; V199-L201 HydrophobicContact CB-CD2 4.13Å; V199-L201 HydrophobicContact CG2-CD1 4.27Å; V199-L201 HydrophobicContact CG2-CD2 3.65Å; V199-L201 HydrophobicContact CG2-CG 3.95Å; L201-T203 HydrophobicContact CB-CG2 4.46Å; L201-D207 WeakPolarHBondContact O-CA 3.4Å; L201-I208 HydrophobicContact CB-CG1 4.12Å; L201-I208 PolarHBondContact N-O 3.06Å; L201-I208 PolarHBondContact O-N 3.31Å; L201-R210 HydrophobicContact CD1-CB 4.4Å; L201-V215 HydrophobicContact CD1-CG1 4.49Å; L201-V215 HydrophobicContact CD1-CG2 3.94Å
202	R	92.6	Very high	89.4	Confident	148 Å²	148	67.4 Å²	67.4	56%	0.558	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.6	116.9	166.3	-177.2	154.9	-67.5	162.6	2.7	108.5	G183 R184 F186 D207	G183-R202 CarbonylContact C-O 3.55Å; G183-R202 WeakPolarHBondContact CA-O 3.32Å; R184-R202 PolarHBondContact N-O 2.94Å; R184-R202 PolarHBondContact O-N 2.89Å; F186-R202 HydrophobicContact CD1-CB 4.17Å; R202-D207 WeakPolarHBondContact CG-OD1 3.49Å; R202-D207 IonicContact CZ-OD1 3.62Å; R202-D207 IonicContact CZ-OD2 2.94Å; R202-D207 IonicContact NE-OD1 3.78Å; R202-D207 PolarHBondContact NE-OD1 2.99Å; R202-D207 IonicContact NE-OD2 3.85Å; R202-D207 IonicContact NH2-OD1 2.89Å; R202-D207 IonicContact NH2-OD2 3.71Å; R202-D207 PolarHBondContact NH2-OD2 2.9Å
203	T	90.2	Very high	89.7	Confident	17 Å²	17	64.5 Å²	64.5	10%	0.104	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	170.1	176.9	71.8	0	0	0	0	110.4	V170 L201 R205 G206 I208	V170-T203 HydrophobicContact CG2-CG2 4.49Å; L201-T203 HydrophobicContact CB-CG2 4.46Å; T203-R205 PolarHBondContact O-N 3.18Å; T203-R205 VanDerWaalsContact O-N 3.13Å; T203-R205 PolarHBondContact OG1-N 2.83Å; T203-G206 PolarHBondContact N-O 2.87Å; T203-G206 PolarHBondContact O-N 3.39Å; T203-G206 VanDerWaalsContact O-N 3.1Å; T203-G206 PolarHBondContact OG1-O 2.86Å; T203-I208 HydrophobicContact CG2-CD1 3.64Å; T203-I208 HydrophobicContact CG2-CG1 3.86Å
204	S	86.9	Confident	89.7	Confident	119 Å²	119	62.3 Å²	62.3	83%	0.832	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-18.4	174.7	56	0	0	0	0	114.1
205	R	87.8	Confident	89.9	Confident	240 Å²	240	60.4 Å²	60.4	91%	0.906	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.3	0.7	178.9	-62.5	-176	178.7	-174.4	-1.3	113.5	T203	T203-R205 PolarHBondContact O-N 3.18Å; T203-R205 VanDerWaalsContact O-N 3.13Å; T203-R205 PolarHBondContact OG1-N 2.83Å
206	G	90.3	Very high	90	Very high	32 Å²	32	58.4 Å²	58.4	33%	0.33	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	120.8	-173.9	-177	0	0	0	0	0	113.4	T203	T203-G206 PolarHBondContact N-O 2.87Å; T203-G206 PolarHBondContact O-N 3.39Å; T203-G206 VanDerWaalsContact O-N 3.1Å; T203-G206 PolarHBondContact OG1-O 2.86Å
207	D	93.8	Very high	89.8	Confident	76 Å²	76	59.9 Å²	59.9	41%	0.406	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	126	-177.4	-69.1	-7	0	0	0	109.9	F186 L201 R202	F186-D207 HydrophobicContact CE1-CB 4.21Å; F186-D207 HydrophobicContact CZ-CB 4.35Å; L201-D207 WeakPolarHBondContact O-CA 3.4Å; R202-D207 WeakPolarHBondContact CG-OD1 3.49Å; R202-D207 IonicContact CZ-OD1 3.62Å; R202-D207 IonicContact CZ-OD2 2.94Å; R202-D207 IonicContact NE-OD1 3.78Å; R202-D207 PolarHBondContact NE-OD1 2.99Å; R202-D207 IonicContact NE-OD2 3.85Å; R202-D207 IonicContact NH2-OD1 2.89Å; R202-D207 IonicContact NH2-OD2 3.71Å; R202-D207 PolarHBondContact NH2-OD2 2.9Å
208	I	92.5	Very high	89.4	Confident	43 Å²	43	56.8 Å²	56.8	22%	0.221	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	154.3	-179.7	64	174.3	0	0	0	110.7	V170 R200 L201 T203 R210	V170-I208 HydrophobicContact CG1-CD1 4.03Å; V170-I208 HydrophobicContact CG2-CD1 4.33Å; R200-I208 WeakPolarHBondContact CA-O 3.43Å; L201-I208 HydrophobicContact CB-CG1 4.12Å; L201-I208 PolarHBondContact N-O 3.06Å; L201-I208 PolarHBondContact O-N 3.31Å; T203-I208 HydrophobicContact CG2-CD1 3.64Å; T203-I208 HydrophobicContact CG2-CG1 3.86Å; I208-R210 HydrophobicContact CD1-CG 4.07Å; I208-R210 HydrophobicContact CG1-CG 4.42Å
209	T	93	Very high	88.1	Confident	44 Å²	44	65.6 Å²	65.6	27%	0.27	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	130.2	172.1	-50.6	0	0	0	0	109.5	T25 L189 V199 R200	T25-T209 HydrophobicContact CG2-CG2 3.83Å; L189-T209 HydrophobicContact CD1-CG2 3.9Å; V199-T209 WeakPolarHBondContact O-CA 3.32Å; R200-T209 HydrophobicContact CG-CG2 4.24Å
210	R	91.2	Very high	86.4	Confident	23 Å²	23	73.3 Å²	73.3	9%	0.087	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	146.9	180	-68.5	-67.4	175.6	-106.2	6.1	111.4	E26 V170 S198 V199 L201 I208 V215	E26-R210 IonicContact OE2-CZ 2.64Å; E26-R210 IonicContact OE2-NH1 2.82Å; E26-R210 PolarHBondContact OE2-NH1 3.02Å; V170-R210 HydrophobicContact CG1-CG 3.9Å; S198-R210 CarbonylContact C-O 3.39Å; S198-R210 WeakPolarHBondContact CA-O 3.38Å; V199-R210 PolarHBondContact N-O 3.25Å; V199-R210 PolarHBondContact O-N 3.35Å; L201-R210 HydrophobicContact CD1-CB 4.4Å; I208-R210 HydrophobicContact CD1-CG 4.07Å; I208-R210 HydrophobicContact CG1-CG 4.42Å; R210-V215 HydrophobicContact CB-CG2 3.84Å
211	P	91	Very high	84	Confident	4 Å²	4	71.9 Å²	71.9	3%	0.026	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	149.6	172.7	31.7	-36	0	0	0	110.2	A28 W30 R197 A213 K214 V215	A28-P211 HydrophobicContact CB-CB 3.94Å; A28-P211 HydrophobicContact CB-CG 3.87Å; W30-P211 HydrophobicContact CH2-CB 4.24Å; W30-P211 HydrophobicContact CH2-CG 3.61Å; W30-P211 HydrophobicContact CZ2-CB 3.63Å; W30-P211 HydrophobicContact CZ2-CG 3.54Å; R197-P211 CarbonylContact O-C 3.48Å; R197-P211 WeakPolarHBondContact O-CA 3.3Å; P211-A213 PolarHBondContact O-N 3.21Å; P211-A213 VanDerWaalsContact O-N 3.08Å; P211-K214 HydrophobicContact CG-CB 4.07Å; P211-K214 HydrophobicContact CG-CG 3.82Å; P211-K214 PolarHBondContact O-N 3.08Å; P211-V215 WeakPolarHBondContact O-CG2 3.45Å
212	V	88.6	Confident	81.2	Confident	38 Å²	38	79.9 Å²	79.9	23%	0.23	42%	0.418	C	S	.	.	G	3₁₀ helix	trans	-56.3	-30.6	179.4	173.8	0	0	0	0	111.8	P162 V196 R197 V199 K214 V215	P162-V212 HydrophobicContact CG-CG1 4.18Å; P162-V212 HydrophobicContact CG-CG2 3.82Å; V196-V212 HydrophobicContact CB-CG2 4.44Å; V196-V212 HydrophobicContact CG1-CG2 3.81Å; V196-V212 WeakPolarHBondContact O-CG2 3.36Å; R197-V212 PolarHBondContact O-N 3.15Å; V199-V212 HydrophobicContact CG1-CG2 4.3Å; V212-K214 PolarHBondContact O-N 3.33Å; V212-K214 VanDerWaalsContact O-N 3.15Å; V212-V215 PolarHBondContact O-N 2.89Å; V212-V215 VanDerWaalsContact O-N 3.07Å; V212-V215 VanDerWaalsContact O-O 3.05Å
213	A	86.2	Confident	78.7	Confident	69 Å²	69	79.4 Å²	79.4	57%	0.57	43%	0.432	S	S	*	.	G	3₁₀ helix	trans	-64.1	-16.5	176.1	0	0	0	0	0	114.8	W30 P211	W30-A213 HydrophobicContact CH2-CB 4.04Å; W30-A213 HydrophobicContact CZ2-CB 3.64Å; P211-A213 PolarHBondContact O-N 3.21Å; P211-A213 VanDerWaalsContact O-N 3.08Å
214	K	87	Confident	75.8	Confident	33 Å²	33	89.9 Å²	89.9	14%	0.143	49%	0.486	C	S	.	.	G	3₁₀ helix	trans	-107.9	14.6	176.4	-66.5	-73.7	-170.8	174.3	0	112.1	W30 A171 E173 P211 V212	W30-K214 HydrophobicContact CH2-CG 3.96Å; A171-K214 HydrophobicContact CB-CB 4.36Å; A171-K214 HydrophobicContact CB-CD 4.22Å; A171-K214 WeakPolarHBondContact CB-O 3.31Å; A171-K214 PolarHBondContact N-O 3.22Å; E173-K214 IonicContact OE1-NZ 3.71Å; E173-K214 PolarHBondContact OE1-NZ 2.82Å; P211-K214 HydrophobicContact CG-CB 4.07Å; P211-K214 HydrophobicContact CG-CG 3.82Å; P211-K214 PolarHBondContact O-N 3.08Å; V212-K214 PolarHBondContact O-N 3.33Å; V212-K214 VanDerWaalsContact O-N 3.15Å
215	V	87.7	Confident	75.3	Confident	14 Å²	14	88.4 Å²	88.4	9%	0.085	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	129.8	-174.9	180	0	0	0	0	108.4	V168 V199 L201 R210 P211 V212	V168-V215 HydrophobicContact CB-CG1 3.31Å; V168-V215 HydrophobicContact CG1-CG1 3.43Å; V168-V215 VanDerWaalsContact CG1-CG1 3.43Å; V168-V215 HydrophobicContact CG2-CG1 3.43Å; V168-V215 VanDerWaalsContact CG2-CG1 3.43Å; V199-V215 HydrophobicContact CG2-CB 4.45Å; V199-V215 HydrophobicContact CG2-CG1 4.3Å; V199-V215 HydrophobicContact CG2-CG2 3.84Å; L201-V215 HydrophobicContact CD1-CG1 4.49Å; L201-V215 HydrophobicContact CD1-CG2 3.94Å; R210-V215 HydrophobicContact CB-CG2 3.84Å; P211-V215 WeakPolarHBondContact O-CG2 3.45Å; V212-V215 PolarHBondContact O-N 2.89Å; V212-V215 VanDerWaalsContact O-N 3.07Å; V212-V215 VanDerWaalsContact O-O 3.05Å
216	H	86.3	Confident	74.6	Confident	64 Å²	64	80.4 Å²	80.4	30%	0.296	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	118.5	-178.5	-61.7	-87	0	0	0	109.4	V168 L169 W180 L218	V168-H216 CarbonylContact C-O 3.51Å; V168-H216 WeakPolarHBondContact CA-O 3.36Å; V168-H216 WeakPolarHBondContact CB-O 3.4Å; L169-H216 HydrophobicContact CB-CB 4.39Å; L169-H216 PolarHBondContact N-O 3.13Å; L169-H216 PolarHBondContact O-N 2.78Å; W180-H216 AromaticContact CH2-NE2 3.97Å; W180-H216 AromaticContact CZ3-CD2 3.48Å; W180-H216 VanDerWaalsContact CZ3-CD2 3.48Å; W180-H216 WeakPolarHBondContact CZ3-CD2 3.46Å; W180-H216 AromaticContact CZ3-NE2 3.64Å; H216-L218 PolarHBondContact O-N 2.79Å
217	L	83.6	Confident	73.7	Confident	59 Å²	59	83.1 Å²	83.1	31%	0.309	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.1	129.7	172.9	-71.8	165.3	0	0	0	109.7	P160 P162 D166 V168	P160-L217 HydrophobicContact CB-CD1 4.38Å; P160-L217 HydrophobicContact CG-CD1 4.23Å; P162-L217 HydrophobicContact CB-CD2 4.07Å; D166-L217 HydrophobicContact CB-CD2 3.57Å; D166-L217 WeakPolarHBondContact OD2-CD2 3.34Å; V168-L217 HydrophobicContact CG1-CD2 3.85Å; V168-L217 HydrophobicContact CG1-CG 4.46Å
218	L	78	Confident	72.6	Confident	65 Å²	65	83.5 Å²	83.5	34%	0.34	46%	0.455	S	S	.	.	P	Polyproline II helix	trans	-75.5	160.6	162.4	-69.3	178.2	0	0	0	108.9	I167 L169 M182 H216 R220	I167-L218 HydrophobicContact CB-CD1 4.46Å; I167-L218 HydrophobicContact CG2-CD1 3.79Å; I167-L218 PolarHBondContact O-N 2.82Å; I167-L218 VanDerWaalsContact O-N 3.08Å; L169-L218 HydrophobicContact CD1-CD2 3.72Å; L169-L218 HydrophobicContact CG-CD2 3.81Å; L169-L218 HydrophobicContact CG-CG 4.26Å; M182-L218 HydrophobicContact CG-CD1 4.49Å; M182-L218 HydrophobicContact SD-CD1 4.12Å; H216-L218 PolarHBondContact O-N 2.79Å; L218-R220 PolarHBondContact O-N 3.3Å
219	E	64.2	Low	71.3	Confident	196 Å²	196	86.1 Å²	86.1	92%	0.916	47%	0.469	S	S	*	.	P	Polyproline II helix	trans	-52.3	128.3	176.3	-67.6	-176.1	170.6	0	0	109.4	G221	E219-G221 PolarHBondContact O-N 3.06Å; E219-G221 VanDerWaalsContact O-N 3.09Å
220	R	57.3	Low	69.9	Low	161 Å²	161	88.9 Å²	88.9	61%	0.608	48%	0.482	S	S	*	.	P	Polyproline II helix	trans	-62.5	116.7	173.2	-77.7	-176.7	170.8	176.7	-1.8	106.6	D166 L218 L222	D166-R220 IonicContact OD1-NE 3.94Å; D166-R220 IonicContact OD2-NH2 3.82Å; L218-R220 PolarHBondContact O-N 3.3Å; R220-L222 PolarHBondContact O-N 3.09Å
221	G	43.6	Very low	68.3	Low	64 Å²	64	93.6 Å²	93.6	66%	0.66	51%	0.511	S	S	*	.	P	Polyproline II helix	trans	-54.8	118.2	162.9	0	0	0	0	0	106.9	E219 T223	E219-G221 PolarHBondContact O-N 3.06Å; E219-G221 VanDerWaalsContact O-N 3.09Å; G221-T223 VanDerWaalsContact C-N 3.32Å; G221-T223 PolarHBondContact O-N 3.05Å
222	L	34.4	Very low	66.6	Low	169 Å²	169	100.5 Å²	100.5	89%	0.885	55%	0.548	S	S	*	.			trans	-54.8	101.6	168.2	-77.4	152.9	0	0	0	106.5	R220 L224	R220-L222 PolarHBondContact O-N 3.09Å; L222-L224 VanDerWaalsContact C-N 3.32Å; L222-L224 PolarHBondContact O-N 2.86Å
223	T	38.7	Very low	64.8	Low	137 Å²	137	105.7 Å²	105.7	84%	0.84	57%	0.574	S	S	*	*			trans	-67.4	100.9	160.7	40.9	0	0	0	0	105.8	G221	G221-T223 VanDerWaalsContact C-N 3.32Å; G221-T223 PolarHBondContact O-N 3.05Å
224	L	30.4	Very low	62.8	Low	237 Å²	237	109 Å²	109	100%	1.241	58%	0.575	S	S	*	*			trans	-61.1	0	154.6	-70.8	168.2	0	0	0	109.6	L222	L222-L224 VanDerWaalsContact C-N 3.32Å; L222-L224 PolarHBondContact O-N 2.86Å

Retrieved 224 of 224 residues in 85.5 ms (Link to these results)

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