A0A087YKU3_POEFO Loading...

RWD domain-containing protein 1

Protects DRG2 from proteolytic degradation.

AlphaFold DB , UniProt , Accession A0A087YKU3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 240 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	56.1	Low	85.6	Confident	244 Å²	244	91.3 Å²	91.3	100%	1.202	45%	0.448	S	S	*	.				0	103.5	0	-138	164.2	-163.1	0	0	102.9	D3	M1-D3 PolarHBondContact O-N 3.47Å
2	T	69.4	Low	86.2	Confident	67 Å²	67	86.3 Å²	86.3	41%	0.411	43%	0.425	S	S	.	.			trans	-64.3	125.3	175.9	-44.1	0	0	0	0	106.2	Y4 E7	T2-Y4 VanDerWaalsContact C-N 3.29Å; T2-Y4 HydrophobicContact CG2-CD1 3.96Å; T2-Y4 HydrophobicContact CG2-CE1 3.74Å; T2-Y4 PolarHBondContact O-N 2.81Å; T2-Y4 VanDerWaalsContact O-N 3.14Å; T2-E7 VanDerWaalsContact CG2-OE1 3.23Å; T2-E7 WeakPolarHBondContact CG2-OE1 3.35Å
3	D	86.5	Confident	86.8	Confident	98 Å²	98	88.6 Å²	88.6	52%	0.524	43%	0.434	S	S	.	.			trans	-88.3	79	-178.5	-146.9	-28.9	0	0	0	108	M1 V5 E6 E7	M1-D3 PolarHBondContact O-N 3.47Å; D3-V5 PolarHBondContact O-N 2.97Å; D3-V5 VanDerWaalsContact O-N 3.14Å; D3-E6 HydrophobicContact CB-CB 4.13Å; D3-E6 WeakPolarHBondContact O-CB 3.39Å; D3-E6 PolarHBondContact O-N 3.4Å; D3-E7 PolarHBondContact O-N 2.88Å
4	Y	88.1	Confident	87.4	Confident	64 Å²	64	85.7 Å²	85.7	25%	0.251	43%	0.431	S	S	.	.	H	α-helix	trans	-53.6	-34.7	-174.6	-60.9	-59.1	0	0	0	112.5	T2 E7 Q8 Y60 D62	T2-Y4 VanDerWaalsContact C-N 3.29Å; T2-Y4 HydrophobicContact CG2-CD1 3.96Å; T2-Y4 HydrophobicContact CG2-CE1 3.74Å; T2-Y4 PolarHBondContact O-N 2.81Å; T2-Y4 VanDerWaalsContact O-N 3.14Å; Y4-E7 PolarHBondContact O-N 3.07Å; Y4-Q8 WeakPolarHBondContact O-CB 3.36Å; Y4-Q8 WeakPolarHBondContact O-CG 3.32Å; Y4-Q8 PolarHBondContact O-N 3.39Å; Y4-Y60 WeakPolarHBondContact CB-O 3.33Å; Y4-Y60 WeakPolarHBondContact CD1-O 3.32Å; Y4-D62 HydrophobicContact CE1-CB 4.5Å; Y4-D62 VanDerWaalsContact CE1-OD2 3.24Å; Y4-D62 WeakPolarHBondContact CE1-OD2 3.29Å; Y4-D62 VanDerWaalsContact CZ-OD2 3.29Å; Y4-D62 PolarHBondContact OH-OD2 3.36Å
5	V	88.1	Confident	87.9	Confident	103 Å²	103	80.1 Å²	80.1	62%	0.624	40%	0.403	S	S	*	.	H	α-helix	trans	-66.7	-38.9	178.6	-179.4	0	0	0	0	111.5	D3 R9	D3-V5 PolarHBondContact O-N 2.97Å; D3-V5 VanDerWaalsContact O-N 3.14Å; V5-R9 WeakPolarHBondContact O-CB 3.45Å; V5-R9 PolarHBondContact O-N 2.68Å; V5-R9 VanDerWaalsContact O-N 3.07Å
6	E	90.8	Very high	88.2	Confident	106 Å²	106	81.7 Å²	81.7	50%	0.495	41%	0.409	S	S	.	.	H	α-helix	trans	-68.4	-42.7	177.6	-167.2	179.8	176	0	0	110.9	D3 R9 N10	D3-E6 HydrophobicContact CB-CB 4.13Å; D3-E6 WeakPolarHBondContact O-CB 3.39Å; D3-E6 PolarHBondContact O-N 3.4Å; E6-R9 PolarHBondContact O-N 2.83Å; E6-N10 WeakPolarHBondContact O-CB 3.17Å; E6-N10 PolarHBondContact O-N 3.15Å; E6-N10 PolarHBondContact O-ND2 2.87Å
7	E	90.4	Very high	88.6	Confident	67 Å²	67	82.8 Å²	82.8	31%	0.313	43%	0.426	S	S	.	.	H	α-helix	trans	-63.4	-46.6	176.6	-69	-171.4	-154.5	0	0	112.2	T2 D3 Y4 R9 N10 E11 P61 V98	T2-E7 VanDerWaalsContact CG2-OE1 3.23Å; T2-E7 WeakPolarHBondContact CG2-OE1 3.35Å; D3-E7 PolarHBondContact O-N 2.88Å; Y4-E7 PolarHBondContact O-N 3.07Å; E7-R9 VanDerWaalsContact C-N 3.31Å; E7-R9 PolarHBondContact O-N 3.05Å; E7-N10 PolarHBondContact O-N 3.3Å; E7-E11 WeakPolarHBondContact O-CB 3.33Å; E7-E11 PolarHBondContact O-N 3.26Å; E7-P61 WeakPolarHBondContact OE2-CG 3.44Å; E7-V98 HydrophobicContact CB-CG1 4.39Å
8	Q	91.6	Very high	89	Confident	23 Å²	23	82.9 Å²	82.9	11%	0.107	43%	0.426	C	S	.	.	H	α-helix	trans	-57.3	-43.1	175.6	-75.1	167.7	28.4	0	0	112	Y4 L12 Y56 V57 Y60	Y4-Q8 WeakPolarHBondContact O-CB 3.36Å; Y4-Q8 WeakPolarHBondContact O-CG 3.32Å; Y4-Q8 PolarHBondContact O-N 3.39Å; Q8-L12 WeakPolarHBondContact O-CB 3.34Å; Q8-L12 PolarHBondContact O-N 3.1Å; Q8-Y56 HydrophobicContact CB-CD2 3.83Å; Q8-Y56 HydrophobicContact CB-CE2 3.86Å; Q8-Y56 HydrophobicContact CB-CG 4.49Å; Q8-Y56 HydrophobicContact CG-CD1 4.43Å; Q8-Y56 HydrophobicContact CG-CD2 3.88Å; Q8-Y56 HydrophobicContact CG-CE2 4.21Å; Q8-Y56 HydrophobicContact CG-CG 4.03Å; Q8-V57 PolarHBondContact NE2-O 2.86Å; Q8-Y60 HydrophobicContact CG-CD1 3.67Å; Q8-Y60 HydrophobicContact CG-CE1 4.32Å; Q8-Y60 PolarHBondContact NE2-O 3.46Å; Q8-Y60 VanDerWaalsContact NE2-O 3.11Å
9	R	92	Very high	89.2	Confident	144 Å²	144	80.4 Å²	80.4	54%	0.543	41%	0.411	S	S	.	.	H	α-helix	trans	-68.2	-44	179.4	-169.1	-174.9	72.3	90.5	12.1	111.9	V5 E6 E7 L12 E13	V5-R9 WeakPolarHBondContact O-CB 3.45Å; V5-R9 PolarHBondContact O-N 2.68Å; V5-R9 VanDerWaalsContact O-N 3.07Å; E6-R9 PolarHBondContact O-N 2.83Å; E7-R9 VanDerWaalsContact C-N 3.31Å; E7-R9 PolarHBondContact O-N 3.05Å; R9-L12 PolarHBondContact O-N 3.49Å; R9-E13 PolarHBondContact O-N 2.91Å
10	N	93.4	Very high	89.3	Confident	73 Å²	73	80.8 Å²	80.8	39%	0.39	42%	0.419	S	S	.	.	H	α-helix	trans	-65.5	-39.6	178.7	-68.5	-20.9	0	0	0	111.4	E6 E7 A14	E6-N10 WeakPolarHBondContact O-CB 3.17Å; E6-N10 PolarHBondContact O-N 3.15Å; E6-N10 PolarHBondContact O-ND2 2.87Å; E7-N10 PolarHBondContact O-N 3.3Å; N10-A14 WeakPolarHBondContact O-CB 3.36Å; N10-A14 PolarHBondContact O-N 2.87Å; N10-A14 VanDerWaalsContact O-N 3.12Å
11	E	94.8	Very high	89.4	Confident	15 Å²	15	84.4 Å²	84.4	7%	0.07	44%	0.439	C	S	.	.	H	α-helix	trans	-65.5	-45.1	173.8	-177.7	175.8	-149.5	0	0	111.4	E7 E13 A14 I15 Y60 V98 M99 I100	E7-E11 WeakPolarHBondContact O-CB 3.33Å; E7-E11 PolarHBondContact O-N 3.26Å; E11-E13 VanDerWaalsContact C-N 3.32Å; E11-E13 PolarHBondContact O-N 3.42Å; E11-A14 WeakPolarHBondContact O-CB 3.37Å; E11-A14 PolarHBondContact O-N 2.92Å; E11-A14 VanDerWaalsContact O-N 3.1Å; E11-I15 HydrophobicContact CG-CG1 4.08Å; E11-I15 VanDerWaalsContact O-CG1 3.31Å; E11-I15 WeakPolarHBondContact O-CG1 3.27Å; E11-I15 PolarHBondContact O-N 2.8Å; E11-Y60 PolarHBondContact OE1-OH 3.37Å; E11-Y60 VanDerWaalsContact OE1-OH 3.1Å; E11-Y60 WeakPolarHBondContact OE2-CE1 3.43Å; E11-Y60 PolarHBondContact OE2-OH 3.3Å; E11-V98 HydrophobicContact CB-CB 4.28Å; E11-V98 HydrophobicContact CB-CG1 4Å; E11-V98 VanDerWaalsContact CD-CB 3.44Å; E11-V98 HydrophobicContact CG-CB 4.18Å; E11-V98 HydrophobicContact CG-CG1 4.41Å; E11-V98 WeakPolarHBondContact OE1-CB 3.42Å; E11-V98 WeakPolarHBondContact OE2-CB 3.4Å; E11-V98 WeakPolarHBondContact OE2-CG1 3.4Å; E11-M99 PolarHBondContact OE1-N 3.15Å; E11-I100 WeakPolarHBondContact OE1-CB 3.45Å; E11-I100 WeakPolarHBondContact OE1-CG1 3.41Å; E11-I100 PolarHBondContact OE1-N 2.97Å
12	L	93	Very high	91.1	Very high	32 Å²	32	74.8 Å²	74.8	17%	0.168	40%	0.396	C	S	.	.	H	α-helix	trans	-56.6	-46.7	178.9	-164.6	85.7	0	0	0	111.7	Q8 R9 A14 I15 E16 F23 T31 F33 Y56	Q8-L12 WeakPolarHBondContact O-CB 3.34Å; Q8-L12 PolarHBondContact O-N 3.1Å; R9-L12 PolarHBondContact O-N 3.49Å; L12-A14 VanDerWaalsContact C-N 3.33Å; L12-A14 PolarHBondContact O-N 3.31Å; L12-I15 PolarHBondContact O-N 3.28Å; L12-E16 WeakPolarHBondContact O-CB 3.31Å; L12-E16 PolarHBondContact O-N 2.88Å; L12-F23 HydrophobicContact CD1-CE2 4.23Å; L12-F23 HydrophobicContact CD1-CZ 3.76Å; L12-F23 HydrophobicContact CG-CZ 4.02Å; L12-T31 HydrophobicContact CD1-CG2 4.03Å; L12-T31 HydrophobicContact CD2-CG2 4.27Å; L12-F33 HydrophobicContact CD1-CD1 3.42Å; L12-F33 VanDerWaalsContact CD1-CD1 3.42Å; L12-F33 HydrophobicContact CD1-CE1 3.57Å; L12-F33 HydrophobicContact CD1-CG 4.13Å; L12-F33 HydrophobicContact CD1-CZ 4.38Å; L12-Y56 HydrophobicContact CD1-CE2 4.08Å
13	E	94	Very high	92.2	Very high	116 Å²	116	72.5 Å²	72.5	54%	0.542	38%	0.38	S	S	.	.	H	α-helix	trans	-62.6	-39	177	-174.9	176.1	179.6	0	0	111.8	R9 E11 S17	R9-E13 PolarHBondContact O-N 2.91Å; E11-E13 VanDerWaalsContact C-N 3.32Å; E11-E13 PolarHBondContact O-N 3.42Å; E13-S17 PolarHBondContact O-N 2.93Å; E13-S17 VanDerWaalsContact O-N 3.1Å
14	A	95.2	Very high	92.5	Very high	48 Å²	48	71.6 Å²	71.6	40%	0.397	38%	0.378	S	S	.	.	H	α-helix	trans	-65.2	-45.6	175.7	0	0	0	0	0	111.8	N10 E11 L12 S17 I18	N10-A14 WeakPolarHBondContact O-CB 3.36Å; N10-A14 PolarHBondContact O-N 2.87Å; N10-A14 VanDerWaalsContact O-N 3.12Å; E11-A14 WeakPolarHBondContact O-CB 3.37Å; E11-A14 PolarHBondContact O-N 2.92Å; E11-A14 VanDerWaalsContact O-N 3.1Å; L12-A14 VanDerWaalsContact C-N 3.33Å; L12-A14 PolarHBondContact O-N 3.31Å; A14-S17 PolarHBondContact O-N 2.81Å; A14-I18 WeakPolarHBondContact O-CD1 3.24Å; A14-I18 VanDerWaalsContact O-CG1 3.23Å; A14-I18 WeakPolarHBondContact O-CG1 3.34Å; A14-I18 PolarHBondContact O-N 3.5Å
15	I	94.7	Very high	92.8	Very high	2 Å²	2	71.5 Å²	71.5	1%	0.01	39%	0.385	C	S	.	.	H	α-helix	trans	-64.7	-42.5	178.8	-67	-61.6	0	0	0	111.3	E11 L12 S17 I18 Y19 F23 I35 I100 F101	E11-I15 HydrophobicContact CG-CG1 4.08Å; E11-I15 VanDerWaalsContact O-CG1 3.31Å; E11-I15 WeakPolarHBondContact O-CG1 3.27Å; E11-I15 PolarHBondContact O-N 2.8Å; L12-I15 PolarHBondContact O-N 3.28Å; I15-S17 PolarHBondContact O-N 2.9Å; I15-I18 PolarHBondContact O-N 3.24Å; I15-I18 VanDerWaalsContact O-N 3.13Å; I15-Y19 HydrophobicContact CD1-CE2 4.41Å; I15-Y19 HydrophobicContact CG2-CD2 4.12Å; I15-Y19 PolarHBondContact O-N 3.48Å; I15-F23 HydrophobicContact CG2-CD2 3.63Å; I15-F23 HydrophobicContact CG2-CE2 3.79Å; I15-I35 HydrophobicContact CG2-CD1 3.56Å; I15-I35 HydrophobicContact CG2-CG1 4.37Å; I15-I100 HydrophobicContact CD1-CB 4.38Å; I15-I100 HydrophobicContact CD1-CG2 4.08Å; I15-I100 HydrophobicContact CG1-CB 4.41Å; I15-I100 HydrophobicContact CG1-CG2 4.11Å; I15-F101 HydrophobicContact CD1-CB 3.8Å; I15-F101 HydrophobicContact CD1-CD2 4.43Å
16	E	93.6	Very high	92.9	Very high	105 Å²	105	70.7 Å²	70.7	49%	0.491	38%	0.376	S	S	.	.	H	α-helix	trans	-58.6	-37.9	174.3	-174.7	177.7	-167.6	0	0	111.3	L12 P20 F23	L12-E16 WeakPolarHBondContact O-CB 3.31Å; L12-E16 PolarHBondContact O-N 2.88Å; E16-P20 WeakPolarHBondContact O-CA 3.14Å; E16-F23 HydrophobicContact CB-CD1 4.05Å; E16-F23 HydrophobicContact CB-CE1 3.98Å; E16-F23 HydrophobicContact CG-CD1 4.03Å; E16-F23 HydrophobicContact CG-CE1 4.14Å
17	S	95.1	Very high	92.9	Very high	100 Å²	100	68 Å²	68	70%	0.699	37%	0.369	S	S	*	.	H	α-helix	trans	-74	-29.9	175.7	-174.3	0	0	0	0	114.1	E13 A14 I15	E13-S17 PolarHBondContact O-N 2.93Å; E13-S17 VanDerWaalsContact O-N 3.1Å; A14-S17 PolarHBondContact O-N 2.81Å; I15-S17 PolarHBondContact O-N 2.9Å
18	I	95	Very high	92.6	Very high	85 Å²	85	72.2 Å²	72.2	44%	0.436	39%	0.389	S	S	.	.	H	α-helix	trans	-78.4	-39.7	179.4	-66.4	162.5	0	0	0	110.2	A14 I15 P20 F101	A14-I18 WeakPolarHBondContact O-CD1 3.24Å; A14-I18 VanDerWaalsContact O-CG1 3.23Å; A14-I18 WeakPolarHBondContact O-CG1 3.34Å; A14-I18 PolarHBondContact O-N 3.5Å; I15-I18 PolarHBondContact O-N 3.24Å; I15-I18 VanDerWaalsContact O-N 3.13Å; I18-P20 VanDerWaalsContact O-CD 3.29Å; I18-P20 WeakPolarHBondContact O-CD 3.5Å; I18-F101 HydrophobicContact CD1-CD2 3.85Å; I18-F101 HydrophobicContact CD1-CE2 4.14Å; I18-F101 HydrophobicContact CG2-CE2 4.21Å
19	Y	93.5	Very high	92.2	Very high	35 Å²	35	79.6 Å²	79.6	14%	0.137	42%	0.423	C	S	.	.			trans	-121.3	58.6	-174.5	-55.8	-74.3	0	0	0	112.5	I15 D21 S22 F23 F101 V104	I15-Y19 HydrophobicContact CD1-CE2 4.41Å; I15-Y19 HydrophobicContact CG2-CD2 4.12Å; I15-Y19 PolarHBondContact O-N 3.48Å; Y19-D21 PolarHBondContact O-N 3.26Å; Y19-S22 PolarHBondContact O-N 3.47Å; Y19-F23 WeakPolarHBondContact O-CB 3.28Å; Y19-F23 PolarHBondContact O-N 2.91Å; Y19-F101 HydrophobicContact CE2-CD2 4.24Å; Y19-V104 HydrophobicContact CE1-CG1 4.27Å; Y19-V104 HydrophobicContact CE2-CG1 3.97Å; Y19-V104 WeakPolarHBondContact OH-CG1 3.32Å
20	P	90.9	Very high	91.7	Very high	88 Å²	88	76.7 Å²	76.7	57%	0.571	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-31.1	-173.3	26.1	-35.5	0	0	0	113.6	E16 I18	E16-P20 WeakPolarHBondContact O-CA 3.14Å; I18-P20 VanDerWaalsContact O-CD 3.29Å; I18-P20 WeakPolarHBondContact O-CD 3.5Å
21	D	91.3	Very high	91.5	Very high	158 Å²	158	74.9 Å²	74.9	85%	0.845	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.3	-16.7	-176.7	-60.7	-45.8	0	0	0	113.3	Y19	Y19-D21 PolarHBondContact O-N 3.26Å
22	S	91.4	Very high	91.5	Very high	42 Å²	42	74.8 Å²	74.8	29%	0.294	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.8	-3	-172.2	-48.9	0	0	0	0	113.7	Y19 I35 T36	Y19-S22 PolarHBondContact O-N 3.47Å; S22-I35 WeakPolarHBondContact O-CA 3.22Å; S22-T36 VanDerWaalsContact CB-O 3.25Å; S22-T36 WeakPolarHBondContact CB-O 3.41Å; S22-T36 PolarHBondContact O-N 3.41Å
23	F	93.4	Very high	91.6	Very high	18 Å²	18	73.3 Å²	73.3	8%	0.079	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	138.7	178.6	177.9	-97.1	0	0	0	111.2	L12 I15 E16 Y19 V25 F33 T34 I35	L12-F23 HydrophobicContact CD1-CE2 4.23Å; L12-F23 HydrophobicContact CD1-CZ 3.76Å; L12-F23 HydrophobicContact CG-CZ 4.02Å; I15-F23 HydrophobicContact CG2-CD2 3.63Å; I15-F23 HydrophobicContact CG2-CE2 3.79Å; E16-F23 HydrophobicContact CB-CD1 4.05Å; E16-F23 HydrophobicContact CB-CE1 3.98Å; E16-F23 HydrophobicContact CG-CD1 4.03Å; E16-F23 HydrophobicContact CG-CE1 4.14Å; Y19-F23 WeakPolarHBondContact O-CB 3.28Å; Y19-F23 PolarHBondContact O-N 2.91Å; F23-V25 HydrophobicContact CD1-CG2 4.37Å; F23-V25 HydrophobicContact CE1-CG2 3.37Å; F23-V25 HydrophobicContact CZ-CG2 3.73Å; F23-F33 AromaticContact CD2-CD2 3.96Å; F23-F33 HydrophobicContact CD2-CD2 3.96Å; F23-F33 HydrophobicContact CD2-CG 4.47Å; F23-F33 HydrophobicContact CE2-CB 3.74Å; F23-F33 HydrophobicContact CE2-CD1 4.33Å; F23-F33 AromaticContact CE2-CD2 3.34Å; F23-F33 HydrophobicContact CE2-CD2 3.34Å; F23-F33 AromaticContact CE2-CE2 3.99Å; F23-F33 HydrophobicContact CE2-CE2 3.99Å; F23-F33 AromaticContact CE2-CG 3.54Å; F23-F33 HydrophobicContact CE2-CG 3.54Å; F23-F33 HydrophobicContact CZ-CB 3.88Å; F23-F33 HydrophobicContact CZ-CD2 4.26Å; F23-F33 AromaticContact CZ-CG 4Å; F23-F33 HydrophobicContact CZ-CG 4Å; F23-T34 WeakPolarHBondContact CA-O 3.19Å; F23-I35 HydrophobicContact CD2-CD1 4.41Å; F23-I35 HydrophobicContact CD2-CG1 3.92Å
24	T	93.1	Very high	91.7	Very high	79 Å²	79	68.4 Å²	68.4	49%	0.485	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	124.2	175.2	-60.1	0	0	0	0	110.8	F33 T34	T24-F33 CarbonylContact O-C 3.6Å; T24-F33 VanDerWaalsContact O-CA 3.23Å; T24-F33 WeakPolarHBondContact O-CA 3.33Å; T24-F33 WeakPolarHBondContact O-CB 3.34Å; T24-T34 PolarHBondContact N-O 3.45Å; T24-T34 PolarHBondContact O-N 3.45Å; T24-T34 PolarHBondContact O-OG1 2.64Å
25	V	92.7	Very high	91.7	Very high	63 Å²	63	66.1 Å²	66.1	38%	0.382	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	131.2	175.1	-174.9	0	0	0	0	110.1	F23	F23-V25 HydrophobicContact CD1-CG2 4.37Å; F23-V25 HydrophobicContact CE1-CG2 3.37Å; F23-V25 HydrophobicContact CZ-CG2 3.73Å
26	L	91.3	Very high	91.7	Very high	85 Å²	85	67.6 Å²	67.6	45%	0.445	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	-42.9	177.6	-62.9	-179	0	0	0	112.4	S32 T34 K53	L26-S32 WeakPolarHBondContact CA-O 3.27Å; L26-S32 WeakPolarHBondContact CB-O 3.29Å; L26-S32 PolarHBondContact N-O 2.83Å; L26-T34 HydrophobicContact CD1-CG2 3.77Å; L26-T34 HydrophobicContact CG-CG2 4.25Å; L26-K53 HydrophobicContact CD1-CD 3.86Å; L26-K53 HydrophobicContact CD1-CG 4.02Å
27	S	90.4	Very high	91.8	Very high	50 Å²	50	62.9 Å²	62.9	35%	0.35	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	152.1	-179.7	-161.7	0	0	0	0	110.8	T31 S32	S27-T31 CarbonylContact O-C 3.54Å; S27-T31 VanDerWaalsContact O-CA 3.28Å; S27-T31 WeakPolarHBondContact O-CA 3.22Å; S27-S32 VanDerWaalsContact CB-OG 3.26Å; S27-S32 WeakPolarHBondContact CB-OG 3.37Å; S27-S32 PolarHBondContact N-O 2.85Å; S27-S32 PolarHBondContact N-OG 3.44Å; S27-S32 PolarHBondContact O-N 3.35Å
28	E	83.5	Confident	91.7	Very high	155 Å²	155	60.5 Å²	60.5	72%	0.724	34%	0.336	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.5	-24.8	177.8	-65.6	-179.9	178.3	0	0	112.2	P30 T31	E28-P30 CarbonylContact O-C 3.55Å; E28-T31 WeakPolarHBondContact O-CA 3.38Å; E28-T31 PolarHBondContact O-N 3.46Å; E28-T31 VanDerWaalsContact O-N 3.15Å; E28-T31 PolarHBondContact O-OG1 3.27Å
29	E	83.5	Confident	91.5	Very high	178 Å²	178	56.8 Å²	56.8	83%	0.832	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-139.3	103.8	-178.6	-72.4	-172.9	171.7	0	0	112.3
30	P	81.1	Confident	91.2	Very high	84 Å²	84	60 Å²	60	55%	0.545	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	cis	-65.7	147.3	-13	29.1	-33.6	0	0	0	111.3	E28 S32 T55	E28-P30 CarbonylContact O-C 3.55Å; P30-S32 PolarHBondContact O-N 3.01Å; P30-S32 VanDerWaalsContact O-N 3.1Å; P30-T55 HydrophobicContact CB-CG2 4.17Å; P30-T55 HydrophobicContact CG-CG2 4.06Å
31	T	90.6	Very high	90.5	Very high	35 Å²	35	59.4 Å²	59.4	22%	0.215	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	116.9	-178.4	-50.7	0	0	0	0	109.9	L12 S27 E28 T55 Y56	L12-T31 HydrophobicContact CD1-CG2 4.03Å; L12-T31 HydrophobicContact CD2-CG2 4.27Å; S27-T31 CarbonylContact O-C 3.54Å; S27-T31 VanDerWaalsContact O-CA 3.28Å; S27-T31 WeakPolarHBondContact O-CA 3.22Å; E28-T31 WeakPolarHBondContact O-CA 3.38Å; E28-T31 PolarHBondContact O-N 3.46Å; E28-T31 VanDerWaalsContact O-N 3.15Å; E28-T31 PolarHBondContact O-OG1 3.27Å; T31-T55 WeakPolarHBondContact O-CA 3.4Å; T31-Y56 HydrophobicContact CG2-CD2 3.87Å; T31-Y56 HydrophobicContact CG2-CE2 4.11Å; T31-Y56 PolarHBondContact O-N 3.35Å
32	S	94.1	Very high	89.3	Confident	13 Å²	13	53 Å²	53	9%	0.091	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	139.2	178.7	51.6	0	0	0	0	110.5	L26 S27 P30 F54 T55	L26-S32 WeakPolarHBondContact CA-O 3.27Å; L26-S32 WeakPolarHBondContact CB-O 3.29Å; L26-S32 PolarHBondContact N-O 2.83Å; S27-S32 VanDerWaalsContact CB-OG 3.26Å; S27-S32 WeakPolarHBondContact CB-OG 3.37Å; S27-S32 PolarHBondContact N-O 2.85Å; S27-S32 PolarHBondContact N-OG 3.44Å; S27-S32 PolarHBondContact O-N 3.35Å; P30-S32 PolarHBondContact O-N 3.01Å; P30-S32 VanDerWaalsContact O-N 3.1Å; S32-F54 WeakPolarHBondContact CA-O 3.33Å; S32-T55 WeakPolarHBondContact CB-OG1 3.16Å
33	F	94.9	Very high	88	Confident	0 Å²	0	59 Å²	59	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	161.6	-175.2	57.4	-91.6	0	0	0	110	L12 F23 T24 I35 K53 F54 Y56 I100	L12-F33 HydrophobicContact CD1-CD1 3.42Å; L12-F33 VanDerWaalsContact CD1-CD1 3.42Å; L12-F33 HydrophobicContact CD1-CE1 3.57Å; L12-F33 HydrophobicContact CD1-CG 4.13Å; L12-F33 HydrophobicContact CD1-CZ 4.38Å; F23-F33 AromaticContact CD2-CD2 3.96Å; F23-F33 HydrophobicContact CD2-CD2 3.96Å; F23-F33 HydrophobicContact CD2-CG 4.47Å; F23-F33 HydrophobicContact CE2-CB 3.74Å; F23-F33 HydrophobicContact CE2-CD1 4.33Å; F23-F33 AromaticContact CE2-CD2 3.34Å; F23-F33 HydrophobicContact CE2-CD2 3.34Å; F23-F33 AromaticContact CE2-CE2 3.99Å; F23-F33 HydrophobicContact CE2-CE2 3.99Å; F23-F33 AromaticContact CE2-CG 3.54Å; F23-F33 HydrophobicContact CE2-CG 3.54Å; F23-F33 HydrophobicContact CZ-CB 3.88Å; F23-F33 HydrophobicContact CZ-CD2 4.26Å; F23-F33 AromaticContact CZ-CG 4Å; F23-F33 HydrophobicContact CZ-CG 4Å; T24-F33 CarbonylContact O-C 3.6Å; T24-F33 VanDerWaalsContact O-CA 3.23Å; T24-F33 WeakPolarHBondContact O-CA 3.33Å; T24-F33 WeakPolarHBondContact O-CB 3.34Å; F33-I35 HydrophobicContact CD2-CD1 4.18Å; F33-I35 HydrophobicContact CD2-CG1 4Å; F33-I35 HydrophobicContact CE2-CD1 3.75Å; F33-I35 HydrophobicContact CE2-CG1 4.09Å; F33-K53 CarbonylContact O-C 3.5Å; F33-K53 WeakPolarHBondContact O-CA 3.33Å; F33-F54 HydrophobicContact CD2-CB 4.33Å; F33-F54 HydrophobicContact CD2-CD2 4.43Å; F33-F54 HydrophobicContact CE1-CB 4.18Å; F33-F54 HydrophobicContact CE2-CB 3.74Å; F33-F54 AromaticContact CE2-CD2 3.76Å; F33-F54 HydrophobicContact CE2-CD2 3.76Å; F33-F54 HydrophobicContact CE2-CG 4.13Å; F33-F54 HydrophobicContact CZ-CB 3.67Å; F33-F54 HydrophobicContact CZ-CD2 4.38Å; F33-F54 HydrophobicContact CZ-CG 4.33Å; F33-F54 PolarHBondContact N-O 3.05Å; F33-F54 PolarHBondContact O-N 3.27Å; F33-Y56 AromaticContact CE1-CE1 3.98Å; F33-Y56 HydrophobicContact CE1-CE1 3.98Å; F33-Y56 AromaticContact CE1-CE2 3.9Å; F33-Y56 HydrophobicContact CE1-CE2 3.9Å; F33-Y56 AromaticContact CE1-CZ 3.6Å; F33-Y56 HydrophobicContact CZ-CE1 4.22Å; F33-I100 HydrophobicContact CE2-CG2 3.97Å; F33-I100 HydrophobicContact CZ-CD1 4.13Å; F33-I100 HydrophobicContact CZ-CG1 4.1Å; F33-I100 HydrophobicContact CZ-CG2 4Å
34	T	95.9	Very high	86.7	Confident	13 Å²	13	63.3 Å²	63.3	8%	0.08	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	143.4	175	50	0	0	0	0	110.7	F23 T24 L26 T51 L52 K53	F23-T34 WeakPolarHBondContact CA-O 3.19Å; T24-T34 PolarHBondContact N-O 3.45Å; T24-T34 PolarHBondContact O-N 3.45Å; T24-T34 PolarHBondContact O-OG1 2.64Å; L26-T34 HydrophobicContact CD1-CG2 3.77Å; L26-T34 HydrophobicContact CG-CG2 4.25Å; T34-T51 HydrophobicContact CG2-CG2 4.24Å; T34-L52 CarbonylContact C-O 3.58Å; T34-L52 WeakPolarHBondContact CA-O 3.47Å; T34-K53 HydrophobicContact CG2-CB 3.83Å; T34-K53 HydrophobicContact CG2-CG 4.13Å
35	I	96.3	Very high	85.6	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	121.6	171.3	-59.6	174.6	0	0	0	107.4	I15 S22 F23 F33 V37 T51 L52 F54 I100 V104	I15-I35 HydrophobicContact CG2-CD1 3.56Å; I15-I35 HydrophobicContact CG2-CG1 4.37Å; S22-I35 WeakPolarHBondContact O-CA 3.22Å; F23-I35 HydrophobicContact CD2-CD1 4.41Å; F23-I35 HydrophobicContact CD2-CG1 3.92Å; F33-I35 HydrophobicContact CD2-CD1 4.18Å; F33-I35 HydrophobicContact CD2-CG1 4Å; F33-I35 HydrophobicContact CE2-CD1 3.75Å; F33-I35 HydrophobicContact CE2-CG1 4.09Å; I35-V37 HydrophobicContact CG2-CG2 4.08Å; I35-T51 WeakPolarHBondContact O-CA 3Å; I35-L52 PolarHBondContact N-O 3.45Å; I35-L52 PolarHBondContact O-N 3.26Å; I35-F54 HydrophobicContact CD1-CD2 4.3Å; I35-F54 HydrophobicContact CD1-CE2 4.26Å; I35-I100 HydrophobicContact CD1-CG2 3.85Å; I35-V104 HydrophobicContact CB-CG2 4.44Å; I35-V104 HydrophobicContact CD1-CG2 3.62Å; I35-V104 HydrophobicContact CG2-CG1 4.17Å; I35-V104 HydrophobicContact CG2-CG2 4.18Å
36	T	95.2	Very high	85	Confident	33 Å²	33	63.7 Å²	63.7	20%	0.202	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	126.4	170.3	-61.4	0	0	0	0	109.5	S22 E49 T51	S22-T36 VanDerWaalsContact CB-O 3.25Å; S22-T36 WeakPolarHBondContact CB-O 3.41Å; S22-T36 PolarHBondContact O-N 3.41Å; T36-E49 HydrophobicContact CG2-CG 3.48Å; T36-E49 VanDerWaalsContact CG2-CG 3.48Å; T36-E49 WeakPolarHBondContact CG2-OE1 3.44Å; T36-E49 WeakPolarHBondContact CG2-OE2 3.38Å; T36-T51 PolarHBondContact OG1-OG1 3.39Å; T36-T51 VanDerWaalsContact OG1-OG1 3.13Å
37	V	94.2	Very high	84.7	Confident	6 Å²	6	61.9 Å²	61.9	4%	0.036	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	119.9	178.2	-169.9	0	0	0	0	107.8	I35 E49 A50 V104 Q108 L111	I35-V37 HydrophobicContact CG2-CG2 4.08Å; V37-E49 WeakPolarHBondContact O-CA 3.45Å; V37-A50 PolarHBondContact N-O 2.95Å; V37-A50 PolarHBondContact O-N 3.1Å; V37-V104 HydrophobicContact CG2-CG1 3.81Å; V37-Q108 HydrophobicContact CG1-CB 3.59Å; V37-Q108 HydrophobicContact CG1-CG 3.91Å; V37-L111 HydrophobicContact CB-CD1 4.05Å; V37-L111 HydrophobicContact CG1-CD1 3.89Å; V37-L111 WeakPolarHBondContact O-CD1 3.3Å
38	T	92.6	Very high	84.7	Confident	51 Å²	51	59.6 Å²	59.6	31%	0.313	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	138.8	177.4	-40	0	0	0	0	108.3	T47 E49	T38-T47 HydrophobicContact CG2-CG2 4.46Å; T38-E49 HydrophobicContact CG2-CB 4.37Å; T38-E49 PolarHBondContact OG1-OE2 3.13Å
39	S	91.2	Very high	85.2	Confident	6 Å²	6	55 Å²	55	4%	0.042	32%	0.32	C	S	.	.			trans	-64.7	160.7	170.7	71.3	0	0	0	0	110.9	T47 V48 N112 V115	S39-T47 WeakPolarHBondContact OG-CA 3.49Å; S39-V48 PolarHBondContact N-O 2.85Å; S39-V48 PolarHBondContact OG-N 3.41Å; S39-V48 PolarHBondContact OG-O 3.41Å; S39-N112 VanDerWaalsContact CA-OD1 3.24Å; S39-N112 WeakPolarHBondContact CA-OD1 3.43Å; S39-N112 VanDerWaalsContact CB-OD1 3.28Å; S39-N112 WeakPolarHBondContact CB-OD1 3.41Å; S39-V115 WeakPolarHBondContact OG-CG2 3.42Å
40	D	87.4	Confident	85.7	Confident	103 Å²	103	46.6 Å²	46.6	55%	0.551	28%	0.281	S	S	*	.			trans	-59.9	146.5	164.8	-67.1	-51.4	0	0	0	109.9	G42 N112	D40-G42 PolarHBondContact O-N 3.44Å; D40-G42 VanDerWaalsContact O-N 3.14Å; D40-N112 PolarHBondContact N-OD1 3.35Å; D40-N112 PolarHBondContact OD2-ND2 3.1Å
41	A	76.8	Confident	86.4	Confident	76 Å²	76	43 Å²	43	63%	0.628	26%	0.257	S	S	*	.			trans	-64.7	115.7	176.5	0	0	0	0	0	109.2	T47	A41-T47 HydrophobicContact CB-CG2 4.07Å
42	G	65.7	Low	86.7	Confident	22 Å²	22	41.3 Å²	41.3	23%	0.227	25%	0.247	C	C	.	.			trans	-59.9	166.2	171.3	0	0	0	0	0	110.9	D40 N44 G45 E46	D40-G42 PolarHBondContact O-N 3.44Å; D40-G42 VanDerWaalsContact O-N 3.14Å; G42-N44 PolarHBondContact O-N 2.87Å; G42-G45 PolarHBondContact O-N 3.38Å; G42-E46 PolarHBondContact N-O 2.85Å; G42-E46 VanDerWaalsContact N-O 3.12Å
43	E	63.8	Low	86.7	Confident	168 Å²	168	42.9 Å²	42.9	79%	0.785	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-24.5	-179.7	-75.3	-176.4	156.7	0	0	113.9	K119	E43-K119 IonicContact OE2-NZ 3.51Å; E43-K119 PolarHBondContact OE2-NZ 3.31Å
44	N	65.5	Low	86.8	Confident	109 Å²	109	42.9 Å²	42.9	58%	0.583	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-2.3	178	-61.6	-21.1	0	0	0	113.7	G42 E46	G42-N44 PolarHBondContact O-N 2.87Å; N44-E46 VanDerWaalsContact C-N 3.28Å; N44-E46 HydrophobicContact CB-CG 4.49Å
45	G	71.5	Confident	86.7	Confident	55 Å²	55	43.3 Å²	43.3	57%	0.567	26%	0.255	S	S	*	.	S	Bend	trans	77.7	8.2	-173.4	0	0	0	0	0	114.5	G42	G42-G45 PolarHBondContact O-N 3.38Å
46	E	78.6	Confident	86.6	Confident	96 Å²	96	43.8 Å²	43.8	45%	0.449	26%	0.257	S	S	.	.			trans	-77.9	134.4	172.8	-66.2	-175.1	150.2	0	0	110.1	G42 N44	G42-E46 PolarHBondContact N-O 2.85Å; G42-E46 VanDerWaalsContact N-O 3.12Å; N44-E46 VanDerWaalsContact C-N 3.28Å; N44-E46 HydrophobicContact CB-CG 4.49Å
47	T	86.6	Confident	86.5	Confident	47 Å²	47	43.4 Å²	43.4	29%	0.288	25%	0.254	S	S	.	.			trans	-132.6	144.8	177.5	51.8	0	0	0	0	109.6	T38 S39 A41 N74	T38-T47 HydrophobicContact CG2-CG2 4.46Å; S39-T47 WeakPolarHBondContact OG-CA 3.49Å; A41-T47 HydrophobicContact CB-CG2 4.07Å; T47-N74 PolarHBondContact O-ND2 3.47Å
48	V	90.9	Very high	86.3	Confident	2 Å²	2	47.3 Å²	47.3	1%	0.012	29%	0.287	C	S	.	.			trans	-103.5	147.8	167.1	-58.1	0	0	0	0	109.4	S39 N74 L75 L111 V115 M118	S39-V48 PolarHBondContact N-O 2.85Å; S39-V48 PolarHBondContact OG-N 3.41Å; S39-V48 PolarHBondContact OG-O 3.41Å; V48-N74 HydrophobicContact CG1-CB 3.93Å; V48-N74 VanDerWaalsContact CG1-O 3.26Å; V48-N74 WeakPolarHBondContact CG1-O 3.28Å; V48-L75 HydrophobicContact CB-CD2 3.85Å; V48-L75 HydrophobicContact CB-CG 4.1Å; V48-L75 HydrophobicContact CG1-CD2 4.11Å; V48-L75 HydrophobicContact CG2-CD2 4.07Å; V48-L111 HydrophobicContact CG2-CB 3.74Å; V48-L111 HydrophobicContact CG2-CD2 3.8Å; V48-L111 HydrophobicContact CG2-CG 4.24Å; V48-V115 HydrophobicContact CB-CG2 4.22Å; V48-V115 HydrophobicContact CG1-CG2 3.77Å; V48-V115 HydrophobicContact CG2-CG2 3.62Å; V48-M118 HydrophobicContact CG1-SD 4.24Å
49	E	93.2	Very high	86.2	Confident	58 Å²	58	50.5 Å²	50.5	27%	0.271	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	139.7	-179.1	-174.1	173.3	100.5	0	0	110.8	T36 V37 T38 Q72 E73	T36-E49 HydrophobicContact CG2-CG 3.48Å; T36-E49 VanDerWaalsContact CG2-CG 3.48Å; T36-E49 WeakPolarHBondContact CG2-OE1 3.44Å; T36-E49 WeakPolarHBondContact CG2-OE2 3.38Å; V37-E49 WeakPolarHBondContact O-CA 3.45Å; T38-E49 HydrophobicContact CG2-CB 4.37Å; T38-E49 PolarHBondContact OG1-OE2 3.13Å; E49-Q72 CarbonylContact O-C 3.59Å; E49-Q72 WeakPolarHBondContact O-CA 3.45Å; E49-E73 HydrophobicContact CB-CB 4.19Å; E49-E73 PolarHBondContact N-O 3.1Å; E49-E73 VanDerWaalsContact N-O 3.09Å; E49-E73 PolarHBondContact O-N 3.29Å
50	A	94.6	Very high	86.2	Confident	1 Å²	1	50.2 Å²	50.2	1%	0.008	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	129.8	172.1	0	0	0	0	0	110.6	V37 L75 L111	V37-A50 PolarHBondContact N-O 2.95Å; V37-A50 PolarHBondContact O-N 3.1Å; A50-L75 HydrophobicContact CB-CD1 3.98Å; A50-L111 HydrophobicContact CB-CD1 4.21Å; A50-L111 HydrophobicContact CB-CD2 4.31Å
51	T	95.4	Very high	86.4	Confident	8 Å²	8	45.4 Å²	45.4	5%	0.049	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	114.5	171.4	-51.3	0	0	0	0	109.4	T34 I35 T36 Y70 S71	T34-T51 HydrophobicContact CG2-CG2 4.24Å; I35-T51 WeakPolarHBondContact O-CA 3Å; T36-T51 PolarHBondContact OG1-OG1 3.39Å; T36-T51 VanDerWaalsContact OG1-OG1 3.13Å; T51-Y70 HydrophobicContact CG2-CD1 4.37Å; T51-Y70 PolarHBondContact O-N 3.13Å; T51-S71 WeakPolarHBondContact CB-OG 3.36Å; T51-S71 PolarHBondContact N-O 3.34Å; T51-S71 PolarHBondContact OG1-OG 2.87Å
52	L	95.4	Very high	87.2	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	127.1	179.3	-65.4	168.5	0	0	0	109.7	T34 I35 F54 I69 L87 V107	T34-L52 CarbonylContact C-O 3.58Å; T34-L52 WeakPolarHBondContact CA-O 3.47Å; I35-L52 PolarHBondContact N-O 3.45Å; I35-L52 PolarHBondContact O-N 3.26Å; L52-F54 HydrophobicContact CB-CD2 4.38Å; L52-F54 HydrophobicContact CB-CE2 3.69Å; L52-F54 HydrophobicContact CB-CZ 4Å; L52-F54 HydrophobicContact CD1-CE2 4.28Å; L52-F54 HydrophobicContact CD1-CZ 4.03Å; L52-I69 HydrophobicContact CD2-CG1 4.1Å; L52-L87 HydrophobicContact CD2-CD1 4.14Å; L52-V107 HydrophobicContact CD1-CB 4.04Å; L52-V107 HydrophobicContact CD1-CG1 3.93Å; L52-V107 HydrophobicContact CD1-CG2 3.65Å
53	K	95.7	Very high	88.5	Confident	47 Å²	47	48.6 Å²	48.6	20%	0.204	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	122.2	171.1	179.1	-178.8	160.3	-146.6	0	108.9	L26 F33 T34 W67 E68	L26-K53 HydrophobicContact CD1-CD 3.86Å; L26-K53 HydrophobicContact CD1-CG 4.02Å; F33-K53 CarbonylContact O-C 3.5Å; F33-K53 WeakPolarHBondContact O-CA 3.33Å; T34-K53 HydrophobicContact CG2-CB 3.83Å; T34-K53 HydrophobicContact CG2-CG 4.13Å; K53-W67 CarbonylContact O-C 3.55Å; K53-W67 VanDerWaalsContact O-CA 3.24Å; K53-W67 WeakPolarHBondContact O-CA 3.28Å; K53-E68 HydrophobicContact CB-CB 4.43Å; K53-E68 PolarHBondContact N-O 3.28Å; K53-E68 IonicContact NZ-OE2 2.8Å; K53-E68 PolarHBondContact NZ-OE2 3.28Å; K53-E68 PolarHBondContact O-N 3.35Å
54	F	95.6	Very high	89.9	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	143.4	173.2	-64	-78.4	0	0	0	110.4	S32 F33 I35 L52 P65 L66 W67 I100 L103 V104	S32-F54 WeakPolarHBondContact CA-O 3.33Å; F33-F54 HydrophobicContact CD2-CB 4.33Å; F33-F54 HydrophobicContact CD2-CD2 4.43Å; F33-F54 HydrophobicContact CE1-CB 4.18Å; F33-F54 HydrophobicContact CE2-CB 3.74Å; F33-F54 AromaticContact CE2-CD2 3.76Å; F33-F54 HydrophobicContact CE2-CD2 3.76Å; F33-F54 HydrophobicContact CE2-CG 4.13Å; F33-F54 HydrophobicContact CZ-CB 3.67Å; F33-F54 HydrophobicContact CZ-CD2 4.38Å; F33-F54 HydrophobicContact CZ-CG 4.33Å; F33-F54 PolarHBondContact N-O 3.05Å; F33-F54 PolarHBondContact O-N 3.27Å; I35-F54 HydrophobicContact CD1-CD2 4.3Å; I35-F54 HydrophobicContact CD1-CE2 4.26Å; L52-F54 HydrophobicContact CB-CD2 4.38Å; L52-F54 HydrophobicContact CB-CE2 3.69Å; L52-F54 HydrophobicContact CB-CZ 4Å; L52-F54 HydrophobicContact CD1-CE2 4.28Å; L52-F54 HydrophobicContact CD1-CZ 4.03Å; F54-P65 HydrophobicContact CD1-CG 4.43Å; F54-L66 CarbonylContact C-O 3.6Å; F54-L66 WeakPolarHBondContact CA-O 3.35Å; F54-W67 HydrophobicContact CD1-CB 3.86Å; F54-W67 HydrophobicContact CE1-CB 3.85Å; F54-I100 HydrophobicContact CB-CD1 4.07Å; F54-I100 HydrophobicContact CD1-CD1 3.76Å; F54-I100 HydrophobicContact CD2-CD1 4.44Å; F54-I100 HydrophobicContact CD2-CG2 4.32Å; F54-I100 HydrophobicContact CE1-CD1 4.28Å; F54-I100 HydrophobicContact CE2-CG2 4.37Å; F54-I100 HydrophobicContact CG-CD1 3.84Å; F54-L103 HydrophobicContact CE1-CB 4.45Å; F54-L103 HydrophobicContact CE1-CD1 3.96Å; F54-L103 HydrophobicContact CZ-CB 4.33Å; F54-V104 HydrophobicContact CE2-CG2 3.98Å; F54-V104 HydrophobicContact CZ-CG2 4.32Å
55	T	94.9	Very high	91.2	Very high	21 Å²	21	37.8 Å²	37.8	13%	0.129	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	123.1	172.5	-53.4	0	0	0	0	108.9	P30 T31 S32 L66	P30-T55 HydrophobicContact CB-CG2 4.17Å; P30-T55 HydrophobicContact CG-CG2 4.06Å; T31-T55 WeakPolarHBondContact O-CA 3.4Å; S32-T55 WeakPolarHBondContact CB-OG1 3.16Å; T55-L66 PolarHBondContact N-O 2.83Å; T55-L66 PolarHBondContact O-N 2.94Å
56	Y	94.1	Very high	92.3	Very high	11 Å²	11	40.5 Å²	40.5	4%	0.043	22%	0.22	C	C	.	.			trans	-69.8	138.8	177.8	-68.1	-37.4	0	0	0	111.3	Q8 L12 T31 F33 Y60 I100	Q8-Y56 HydrophobicContact CB-CD2 3.83Å; Q8-Y56 HydrophobicContact CB-CE2 3.86Å; Q8-Y56 HydrophobicContact CB-CG 4.49Å; Q8-Y56 HydrophobicContact CG-CD1 4.43Å; Q8-Y56 HydrophobicContact CG-CD2 3.88Å; Q8-Y56 HydrophobicContact CG-CE2 4.21Å; Q8-Y56 HydrophobicContact CG-CG 4.03Å; L12-Y56 HydrophobicContact CD1-CE2 4.08Å; T31-Y56 HydrophobicContact CG2-CD2 3.87Å; T31-Y56 HydrophobicContact CG2-CE2 4.11Å; T31-Y56 PolarHBondContact O-N 3.35Å; F33-Y56 AromaticContact CE1-CE1 3.98Å; F33-Y56 HydrophobicContact CE1-CE1 3.98Å; F33-Y56 AromaticContact CE1-CE2 3.9Å; F33-Y56 HydrophobicContact CE1-CE2 3.9Å; F33-Y56 AromaticContact CE1-CZ 3.6Å; F33-Y56 HydrophobicContact CZ-CE1 4.22Å; Y56-Y60 AromaticContact CD1-CD1 3.9Å; Y56-Y60 HydrophobicContact CD1-CD1 3.9Å; Y56-Y60 HydrophobicContact CD1-CE1 4.04Å; Y56-Y60 HydrophobicContact CD1-CG 4.18Å; Y56-Y60 HydrophobicContact CE1-CD1 4.1Å; Y56-Y60 AromaticContact CE1-CE1 3.76Å; Y56-Y60 HydrophobicContact CE1-CE1 3.76Å; Y56-I100 HydrophobicContact CE1-CD1 4.07Å; Y56-I100 HydrophobicContact CE1-CG1 3.88Å
57	V	93.1	Very high	93	Very high	25 Å²	25	38.7 Å²	38.7	15%	0.152	21%	0.209	C	C	.	.			trans	-98.4	159.5	171.1	-63.2	0	0	0	0	109.9	Q8 E59 Y60 E63 P64 L66	Q8-V57 PolarHBondContact NE2-O 2.86Å; V57-E59 PolarHBondContact O-N 2.78Å; V57-Y60 WeakPolarHBondContact O-CB 3.3Å; V57-Y60 PolarHBondContact O-N 2.89Å; V57-Y60 VanDerWaalsContact O-N 3.16Å; V57-E63 HydrophobicContact CG2-CB 3.93Å; V57-E63 HydrophobicContact CG2-CG 4.14Å; V57-P64 WeakPolarHBondContact CG2-O 3.14Å; V57-L66 HydrophobicContact CG1-CD1 4.36Å; V57-L66 HydrophobicContact CG1-CG 3.96Å
58	A	90.5	Very high	93.3	Very high	88 Å²	88	41.7 Å²	41.7	73%	0.727	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-28.6	-175.7	0	0	0	0	0	113.3
59	E	90.8	Very high	93.4	Very high	118 Å²	118	43.8 Å²	43.8	55%	0.551	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.9	8.9	-179.2	-59.6	-168.5	147.5	0	0	112.9	V57 D62 E63	V57-E59 PolarHBondContact O-N 2.78Å; E59-D62 CarbonylContact O-C 3.49Å; E59-D62 WeakPolarHBondContact O-CA 3.49Å; E59-D62 WeakPolarHBondContact O-CB 3.27Å; E59-D62 PolarHBondContact O-N 3.14Å; E59-E63 HydrophobicContact CB-CB 3.8Å; E59-E63 PolarHBondContact O-N 3.25Å
60	Y	91.1	Very high	93.3	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	132.8	176.9	177.8	-88.1	0	0	0	111	Y4 Q8 E11 Y56 V57 E63 P65 V98 M99	Y4-Y60 WeakPolarHBondContact CB-O 3.33Å; Y4-Y60 WeakPolarHBondContact CD1-O 3.32Å; Q8-Y60 HydrophobicContact CG-CD1 3.67Å; Q8-Y60 HydrophobicContact CG-CE1 4.32Å; Q8-Y60 PolarHBondContact NE2-O 3.46Å; Q8-Y60 VanDerWaalsContact NE2-O 3.11Å; E11-Y60 PolarHBondContact OE1-OH 3.37Å; E11-Y60 VanDerWaalsContact OE1-OH 3.1Å; E11-Y60 WeakPolarHBondContact OE2-CE1 3.43Å; E11-Y60 PolarHBondContact OE2-OH 3.3Å; Y56-Y60 AromaticContact CD1-CD1 3.9Å; Y56-Y60 HydrophobicContact CD1-CD1 3.9Å; Y56-Y60 HydrophobicContact CD1-CE1 4.04Å; Y56-Y60 HydrophobicContact CD1-CG 4.18Å; Y56-Y60 HydrophobicContact CE1-CD1 4.1Å; Y56-Y60 AromaticContact CE1-CE1 3.76Å; Y56-Y60 HydrophobicContact CE1-CE1 3.76Å; V57-Y60 WeakPolarHBondContact O-CB 3.3Å; V57-Y60 PolarHBondContact O-N 2.89Å; V57-Y60 VanDerWaalsContact O-N 3.16Å; Y60-E63 WeakPolarHBondContact CA-O 3.45Å; Y60-E63 WeakPolarHBondContact CD2-O 3.28Å; Y60-P65 HydrophobicContact CD2-CB 4.04Å; Y60-P65 HydrophobicContact CD2-CG 4.2Å; Y60-P65 HydrophobicContact CE2-CB 4.16Å; Y60-P65 HydrophobicContact CE2-CG 3.92Å; Y60-V98 HydrophobicContact CE1-CG1 4.32Å; Y60-V98 WeakPolarHBondContact OH-CA 3.34Å; Y60-M99 HydrophobicContact CD2-CE 4.21Å; Y60-M99 HydrophobicContact CE2-CE 3.78Å; Y60-M99 HydrophobicContact CE2-CG 3.88Å; Y60-M99 HydrophobicContact CE2-SD 4.45Å; Y60-M99 PolarHBondContact OH-N 2.97Å
61	P	91.8	Very high	93.2	Very high	1 Å²	1	51.1 Å²	51.1	1%	0.006	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	cis	-96.3	8.8	15.4	36	-35.4	0	0	0	117.2	E7 E63 G96 M97	E7-P61 WeakPolarHBondContact OE2-CG 3.44Å; P61-E63 VanDerWaalsContact C-N 3.33Å; P61-G96 PolarHBondContact O-N 3.32Å; P61-M97 VanDerWaalsContact CB-O 3.29Å; P61-M97 WeakPolarHBondContact CB-O 3.33Å
62	D	91.8	Very high	93	Very high	78 Å²	78	54.2 Å²	54.2	42%	0.417	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-28.8	175.7	-68.6	-31.1	0	0	0	112	Y4 E59 G96	Y4-D62 HydrophobicContact CE1-CB 4.5Å; Y4-D62 VanDerWaalsContact CE1-OD2 3.24Å; Y4-D62 WeakPolarHBondContact CE1-OD2 3.29Å; Y4-D62 VanDerWaalsContact CZ-OD2 3.29Å; Y4-D62 PolarHBondContact OH-OD2 3.36Å; E59-D62 CarbonylContact O-C 3.49Å; E59-D62 WeakPolarHBondContact O-CA 3.49Å; E59-D62 WeakPolarHBondContact O-CB 3.27Å; E59-D62 PolarHBondContact O-N 3.14Å; D62-G96 WeakPolarHBondContact OD1-CA 3.49Å
63	E	92.7	Very high	92.8	Very high	88 Å²	88	59.6 Å²	59.6	41%	0.411	30%	0.304	S	S	.	.	S	Bend	trans	-109	140.8	169.1	-168.2	-179.6	-164.4	0	0	110	V57 E59 Y60 P61	V57-E63 HydrophobicContact CG2-CB 3.93Å; V57-E63 HydrophobicContact CG2-CG 4.14Å; E59-E63 HydrophobicContact CB-CB 3.8Å; E59-E63 PolarHBondContact O-N 3.25Å; Y60-E63 WeakPolarHBondContact CA-O 3.45Å; Y60-E63 WeakPolarHBondContact CD2-O 3.28Å; P61-E63 VanDerWaalsContact C-N 3.33Å
64	P	93.3	Very high	92.4	Very high	47 Å²	47	61.8 Å²	61.8	31%	0.305	32%	0.318	S	S	.	.	P	Polyproline II helix	trans	-63.9	149.1	-180	27	-35.7	0	0	0	112.2	V57 W67 A91 L95	V57-P64 WeakPolarHBondContact CG2-O 3.14Å; P64-W67 HydrophobicContact CB-CZ3 4.01Å; P64-A91 HydrophobicContact CB-CB 4.04Å; P64-L95 HydrophobicContact CB-CD2 4.38Å; P64-L95 HydrophobicContact CG-CD2 4.46Å
65	P	93.8	Very high	92	Very high	3 Å²	3	62.6 Å²	62.6	2%	0.019	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-69.2	161	175.9	31.4	-31.7	0	0	0	109.9	F54 Y60 W67 I100 L103	F54-P65 HydrophobicContact CD1-CG 4.43Å; Y60-P65 HydrophobicContact CD2-CB 4.04Å; Y60-P65 HydrophobicContact CD2-CG 4.2Å; Y60-P65 HydrophobicContact CE2-CB 4.16Å; Y60-P65 HydrophobicContact CE2-CG 3.92Å; P65-W67 HydrophobicContact CG-CE3 4.39Å; P65-W67 VanDerWaalsContact O-CZ3 3.24Å; P65-W67 WeakPolarHBondContact O-CZ3 3.3Å; P65-I100 HydrophobicContact CB-CD1 4.26Å; P65-I100 HydrophobicContact CG-CD1 3.89Å; P65-L103 HydrophobicContact CG-CD1 4.19Å
66	L	94	Very high	91.7	Very high	112 Å²	112	67 Å²	67	59%	0.586	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.1	128.2	168.6	-62.4	174	0	0	0	108.7	F54 T55 V57	F54-L66 CarbonylContact C-O 3.6Å; F54-L66 WeakPolarHBondContact CA-O 3.35Å; T55-L66 PolarHBondContact N-O 2.83Å; T55-L66 PolarHBondContact O-N 2.94Å; V57-L66 HydrophobicContact CG1-CD1 4.36Å; V57-L66 HydrophobicContact CG1-CG 3.96Å
67	W	94.3	Very high	91.4	Very high	57 Å²	57	72.2 Å²	72.2	22%	0.216	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	144.4	174.9	60.2	83.7	0	0	0	111.9	K53 F54 P64 P65 L87 K88 A91	K53-W67 CarbonylContact O-C 3.55Å; K53-W67 VanDerWaalsContact O-CA 3.24Å; K53-W67 WeakPolarHBondContact O-CA 3.28Å; F54-W67 HydrophobicContact CD1-CB 3.86Å; F54-W67 HydrophobicContact CE1-CB 3.85Å; P64-W67 HydrophobicContact CB-CZ3 4.01Å; P65-W67 HydrophobicContact CG-CE3 4.39Å; P65-W67 VanDerWaalsContact O-CZ3 3.24Å; P65-W67 WeakPolarHBondContact O-CZ3 3.3Å; W67-L87 HydrophobicContact CG-CD1 4.42Å; W67-L87 HydrophobicContact CZ2-CB 4.42Å; W67-K88 HydrophobicContact CZ2-CB 4.14Å; W67-A91 HydrophobicContact CH2-CB 3.79Å; W67-A91 HydrophobicContact CZ3-CB 3.79Å
68	E	93.3	Very high	91.2	Very high	111 Å²	111	72.9 Å²	72.9	52%	0.519	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	145.3	174.7	-61.9	177.8	141.7	0	0	109.1	K53 Y70	K53-E68 HydrophobicContact CB-CB 4.43Å; K53-E68 PolarHBondContact N-O 3.28Å; K53-E68 IonicContact NZ-OE2 2.8Å; K53-E68 PolarHBondContact NZ-OE2 3.28Å; K53-E68 PolarHBondContact O-N 3.35Å; E68-Y70 PolarHBondContact O-N 3.32Å
69	I	92.7	Very high	91.2	Very high	45 Å²	45	70.1 Å²	70.1	23%	0.231	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	111.3	171.8	-54.6	-175.3	0	0	0	107.2	L52 L80 L84	L52-I69 HydrophobicContact CD2-CG1 4.1Å; I69-L80 HydrophobicContact CD1-CB 4.13Å; I69-L80 HydrophobicContact CD1-CD1 4.34Å; I69-L80 HydrophobicContact CD1-CD2 3.5Å; I69-L80 VanDerWaalsContact CD1-CD2 3.5Å; I69-L80 HydrophobicContact CD1-CG 4.19Å; I69-L80 HydrophobicContact CG2-CD2 4.32Å; I69-L84 HydrophobicContact CD1-CD1 4.46Å; I69-L84 HydrophobicContact CD1-CD2 4.12Å; I69-L84 HydrophobicContact CD1-CG 4.09Å; I69-L84 HydrophobicContact CG1-CD2 4.23Å
70	Y	90.8	Very high	91.2	Very high	161 Å²	161	65.7 Å²	65.7	63%	0.631	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.6	-41.3	-177	-172.8	-99.1	0	0	0	111.9	T51 E68	T51-Y70 HydrophobicContact CG2-CD1 4.37Å; T51-Y70 PolarHBondContact O-N 3.13Å; E68-Y70 PolarHBondContact O-N 3.32Å
71	S	92.4	Very high	91.2	Very high	52 Å²	52	72.1 Å²	72.1	36%	0.364	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	154.1	175.1	40.1	0	0	0	0	110.8	T51	T51-S71 WeakPolarHBondContact CB-OG 3.36Å; T51-S71 PolarHBondContact N-O 3.34Å; T51-S71 PolarHBondContact OG1-OG 2.87Å
72	Q	91.7	Very high	91.3	Very high	74 Å²	74	76.3 Å²	76.3	35%	0.346	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	145.9	173.9	59.9	164.8	3.2	0	0	109.9	E49 L75 L80	E49-Q72 CarbonylContact O-C 3.59Å; E49-Q72 WeakPolarHBondContact O-CA 3.45Å; Q72-L75 HydrophobicContact CB-CB 4.35Å; Q72-L75 HydrophobicContact CB-CD1 4.16Å; Q72-L80 HydrophobicContact CB-CD2 4.34Å; Q72-L80 VanDerWaalsContact CD-CD1 3.46Å
73	E	90.6	Very high	91.4	Very high	112 Å²	112	72.6 Å²	72.6	52%	0.523	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	132.1	174	-163	178.2	158.2	0	0	109.8	E49 L75	E49-E73 HydrophobicContact CB-CB 4.19Å; E49-E73 PolarHBondContact N-O 3.1Å; E49-E73 VanDerWaalsContact N-O 3.09Å; E49-E73 PolarHBondContact O-N 3.29Å; E73-L75 PolarHBondContact O-N 3.41Å
74	N	86.7	Confident	91.4	Very high	93 Å²	93	71.6 Å²	71.6	50%	0.497	37%	0.365	S	S	.	.	S	Bend	trans	58.4	27.3	-179.5	-56	-47.9	0	0	0	115	T47 V48	T47-N74 PolarHBondContact O-ND2 3.47Å; V48-N74 HydrophobicContact CG1-CB 3.93Å; V48-N74 VanDerWaalsContact CG1-O 3.26Å; V48-N74 WeakPolarHBondContact CG1-O 3.28Å
75	L	88	Confident	91.5	Very high	18 Å²	18	73 Å²	73	9%	0.094	37%	0.373	C	S	.	.			trans	-113.8	140.6	175.9	-69.1	170	0	0	0	111.2	V48 A50 Q72 E73 D79 L80 I83 L111 I114	V48-L75 HydrophobicContact CB-CD2 3.85Å; V48-L75 HydrophobicContact CB-CG 4.1Å; V48-L75 HydrophobicContact CG1-CD2 4.11Å; V48-L75 HydrophobicContact CG2-CD2 4.07Å; A50-L75 HydrophobicContact CB-CD1 3.98Å; Q72-L75 HydrophobicContact CB-CB 4.35Å; Q72-L75 HydrophobicContact CB-CD1 4.16Å; E73-L75 PolarHBondContact O-N 3.41Å; L75-D79 HydrophobicContact CD2-CB 4.36Å; L75-L80 HydrophobicContact CD1-CD2 4.24Å; L75-I83 HydrophobicContact CD1-CD1 4.41Å; L75-L111 HydrophobicContact CD1-CD2 3.69Å; L75-L111 HydrophobicContact CD2-CD2 3.82Å; L75-L111 HydrophobicContact CG-CD2 4.34Å; L75-I114 HydrophobicContact CD2-CD1 4.02Å; L75-I114 HydrophobicContact CD2-CG2 4.02Å
76	E	88.5	Confident	91.6	Very high	112 Å²	112	74.7 Å²	74.7	52%	0.523	38%	0.381	S	S	.	.			trans	-85.2	155	172.4	-60.7	-178.8	-176	0	0	110.8	G78 D79 L80	E76-G78 PolarHBondContact O-N 3.04Å; E76-D79 PolarHBondContact N-OD2 3.34Å; E76-D79 WeakPolarHBondContact O-CB 3.39Å; E76-D79 PolarHBondContact O-N 3.47Å; E76-L80 PolarHBondContact O-N 2.89Å
77	D	88	Confident	91.6	Very high	122 Å²	122	69.4 Å²	69.4	65%	0.652	35%	0.353	S	S	*	.	H	α-helix	trans	-58.3	-33.3	178.9	-66.6	-33.5	0	0	0	112.6	D79 L80 E81	D77-D79 VanDerWaalsContact C-N 3.32Å; D77-D79 PolarHBondContact O-N 3.16Å; D77-L80 WeakPolarHBondContact O-CB 3.39Å; D77-L80 PolarHBondContact O-N 2.91Å; D77-E81 PolarHBondContact O-N 3.49Å
78	G	89.1	Confident	91.6	Very high	39 Å²	39	72.3 Å²	72.3	40%	0.402	37%	0.367	S	S	.	.	H	α-helix	trans	-67.1	-32.1	175.6	0	0	0	0	0	113.1	E76 E81 N82	E76-G78 PolarHBondContact O-N 3.04Å; G78-E81 PolarHBondContact O-N 2.97Å; G78-N82 PolarHBondContact O-N 3.39Å; G78-N82 PolarHBondContact O-ND2 3.26Å
79	D	90.3	Very high	91.7	Very high	29 Å²	29	72 Å²	72	16%	0.155	37%	0.366	C	S	.	.	H	α-helix	trans	-70.8	-36.6	176.2	-63.5	-40.4	0	0	0	111	L75 E76 D77 N82 I83 I114	L75-D79 HydrophobicContact CD2-CB 4.36Å; E76-D79 PolarHBondContact N-OD2 3.34Å; E76-D79 WeakPolarHBondContact O-CB 3.39Å; E76-D79 PolarHBondContact O-N 3.47Å; D77-D79 VanDerWaalsContact C-N 3.32Å; D77-D79 PolarHBondContact O-N 3.16Å; D79-N82 WeakPolarHBondContact O-CB 3.06Å; D79-N82 PolarHBondContact O-N 3.08Å; D79-I83 WeakPolarHBondContact O-CG1 3.37Å; D79-I83 PolarHBondContact O-N 3Å; D79-I114 HydrophobicContact CB-CD1 3.84Å; D79-I114 HydrophobicContact CB-CG1 4.41Å
80	L	90.1	Very high	91.8	Very high	26 Å²	26	71.9 Å²	71.9	14%	0.136	37%	0.365	C	S	.	.	H	α-helix	trans	-61.7	-44	173.5	-66	-175	0	0	0	112.7	I69 Q72 L75 E76 D77 N82 I83 L84	I69-L80 HydrophobicContact CD1-CB 4.13Å; I69-L80 HydrophobicContact CD1-CD1 4.34Å; I69-L80 HydrophobicContact CD1-CD2 3.5Å; I69-L80 VanDerWaalsContact CD1-CD2 3.5Å; I69-L80 HydrophobicContact CD1-CG 4.19Å; I69-L80 HydrophobicContact CG2-CD2 4.32Å; Q72-L80 HydrophobicContact CB-CD2 4.34Å; Q72-L80 VanDerWaalsContact CD-CD1 3.46Å; L75-L80 HydrophobicContact CD1-CD2 4.24Å; E76-L80 PolarHBondContact O-N 2.89Å; D77-L80 WeakPolarHBondContact O-CB 3.39Å; D77-L80 PolarHBondContact O-N 2.91Å; L80-N82 PolarHBondContact O-N 3.38Å; L80-I83 PolarHBondContact O-N 3.33Å; L80-L84 WeakPolarHBondContact O-CB 3.34Å; L80-L84 WeakPolarHBondContact O-CG 3.41Å; L80-L84 PolarHBondContact O-N 3.21Å
81	E	92.3	Very high	91.9	Very high	135 Å²	135	64.3 Å²	64.3	63%	0.631	34%	0.335	S	S	*	.	H	α-helix	trans	-60.1	-38.1	176.9	-71	-174.8	176.9	0	0	111.4	D77 G78 T85	D77-E81 PolarHBondContact O-N 3.49Å; G78-E81 PolarHBondContact O-N 2.97Å; E81-T85 WeakPolarHBondContact O-CB 3.47Å; E81-T85 PolarHBondContact O-N 3.21Å; E81-T85 PolarHBondContact O-OG1 3.14Å
82	N	92.5	Very high	92	Very high	88 Å²	88	67.5 Å²	67.5	47%	0.471	34%	0.344	S	S	.	.	H	α-helix	trans	-66	-44.6	174.7	-69.2	-42.3	0	0	0	111.8	G78 D79 L80 T85 L86	G78-N82 PolarHBondContact O-N 3.39Å; G78-N82 PolarHBondContact O-ND2 3.26Å; D79-N82 WeakPolarHBondContact O-CB 3.06Å; D79-N82 PolarHBondContact O-N 3.08Å; L80-N82 PolarHBondContact O-N 3.38Å; N82-T85 PolarHBondContact O-N 2.95Å; N82-L86 WeakPolarHBondContact O-CB 3.46Å; N82-L86 PolarHBondContact O-N 3.05Å
83	I	93.9	Very high	92.1	Very high	1 Å²	1	70.9 Å²	70.9	1%	0.005	36%	0.36	C	S	.	.	H	α-helix	trans	-62.7	-44.7	176.8	-67.8	165.6	0	0	0	110.8	L75 D79 L80 T85 L86 L87 V107 K110 L111 I114	L75-I83 HydrophobicContact CD1-CD1 4.41Å; D79-I83 WeakPolarHBondContact O-CG1 3.37Å; D79-I83 PolarHBondContact O-N 3Å; L80-I83 PolarHBondContact O-N 3.33Å; I83-T85 VanDerWaalsContact C-N 3.31Å; I83-T85 PolarHBondContact O-N 3.32Å; I83-L86 WeakPolarHBondContact O-CB 3.37Å; I83-L86 PolarHBondContact O-N 3.36Å; I83-L87 HydrophobicContact CG2-CD1 4.05Å; I83-L87 HydrophobicContact CG2-CG 4.4Å; I83-L87 WeakPolarHBondContact O-CB 3.35Å; I83-L87 WeakPolarHBondContact O-CG 3.4Å; I83-L87 PolarHBondContact O-N 2.79Å; I83-V107 HydrophobicContact CG2-CG1 4.15Å; I83-V107 HydrophobicContact CG2-CG2 3.93Å; I83-K110 HydrophobicContact CG1-CG 3.99Å; I83-L111 HydrophobicContact CD1-CD2 3.81Å; I83-I114 HydrophobicContact CD1-CD1 4.05Å; I83-I114 HydrophobicContact CG1-CD1 4.36Å
84	L	93.3	Very high	92.2	Very high	67 Å²	67	67 Å²	67	35%	0.351	34%	0.343	S	S	.	.	H	α-helix	trans	-62.9	-39.1	177.1	-72.4	172.8	0	0	0	112	I69 L80 K88	I69-L84 HydrophobicContact CD1-CD1 4.46Å; I69-L84 HydrophobicContact CD1-CD2 4.12Å; I69-L84 HydrophobicContact CD1-CG 4.09Å; I69-L84 HydrophobicContact CG1-CD2 4.23Å; L80-L84 WeakPolarHBondContact O-CB 3.34Å; L80-L84 WeakPolarHBondContact O-CG 3.41Å; L80-L84 PolarHBondContact O-N 3.21Å; L84-K88 WeakPolarHBondContact O-CB 3.43Å; L84-K88 PolarHBondContact O-N 3.27Å
85	T	95.1	Very high	92.5	Very high	77 Å²	77	66.6 Å²	66.6	47%	0.472	34%	0.34	S	S	.	.	H	α-helix	trans	-65	-43.4	175.4	-59.6	0	0	0	0	111.1	E81 N82 I83 K88 Q89	E81-T85 WeakPolarHBondContact O-CB 3.47Å; E81-T85 PolarHBondContact O-N 3.21Å; E81-T85 PolarHBondContact O-OG1 3.14Å; N82-T85 PolarHBondContact O-N 2.95Å; I83-T85 VanDerWaalsContact C-N 3.31Å; I83-T85 PolarHBondContact O-N 3.32Å; T85-K88 PolarHBondContact O-N 2.89Å; T85-Q89 WeakPolarHBondContact O-CG 3.37Å; T85-Q89 PolarHBondContact O-N 3.48Å; T85-Q89 VanDerWaalsContact O-N 3.08Å
86	L	95	Very high	92.5	Very high	38 Å²	38	67.8 Å²	67.8	20%	0.199	36%	0.357	C	S	.	.	H	α-helix	trans	-61.8	-48.4	175.9	177.1	65.5	0	0	0	111.6	N82 I83 K88 Q89 Q90 A106 K110	N82-L86 WeakPolarHBondContact O-CB 3.46Å; N82-L86 PolarHBondContact O-N 3.05Å; I83-L86 WeakPolarHBondContact O-CB 3.37Å; I83-L86 PolarHBondContact O-N 3.36Å; L86-K88 VanDerWaalsContact C-N 3.27Å; L86-K88 PolarHBondContact O-N 3.38Å; L86-Q89 PolarHBondContact O-N 2.85Å; L86-Q89 VanDerWaalsContact O-N 3.17Å; L86-Q90 HydrophobicContact CD1-CG 4.18Å; L86-Q90 HydrophobicContact CG-CG 4.44Å; L86-Q90 WeakPolarHBondContact O-CG 3.3Å; L86-Q90 PolarHBondContact O-N 2.88Å; L86-A106 HydrophobicContact CD2-CB 4.3Å; L86-A106 WeakPolarHBondContact CD2-O 3.4Å; L86-K110 HydrophobicContact CD2-CB 3.69Å; L86-K110 HydrophobicContact CD2-CD 4.32Å; L86-K110 HydrophobicContact CD2-CG 3.98Å
87	L	94.6	Very high	92.6	Very high	0 Å²	0	67.3 Å²	67.3	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-56.2	-43.6	176.9	-80.1	171.6	0	0	0	111.5	L52 W67 I83 Q90 A91 L103 V107	L52-L87 HydrophobicContact CD2-CD1 4.14Å; W67-L87 HydrophobicContact CG-CD1 4.42Å; W67-L87 HydrophobicContact CZ2-CB 4.42Å; I83-L87 HydrophobicContact CG2-CD1 4.05Å; I83-L87 HydrophobicContact CG2-CG 4.4Å; I83-L87 WeakPolarHBondContact O-CB 3.35Å; I83-L87 WeakPolarHBondContact O-CG 3.4Å; I83-L87 PolarHBondContact O-N 2.79Å; L87-Q90 PolarHBondContact O-N 2.82Å; L87-A91 VanDerWaalsContact O-CB 3.26Å; L87-A91 WeakPolarHBondContact O-CB 3.45Å; L87-A91 PolarHBondContact O-N 3.45Å; L87-L103 HydrophobicContact CD2-CB 3.7Å; L87-L103 HydrophobicContact CD2-CD2 3.71Å; L87-L103 HydrophobicContact CD2-CG 4.17Å; L87-L103 WeakPolarHBondContact O-CD2 3.41Å; L87-V107 HydrophobicContact CD1-CG2 4.11Å; L87-V107 HydrophobicContact CD2-CG2 3.54Å; L87-V107 HydrophobicContact CG-CG2 3.82Å
88	K	94.4	Very high	92.7	Very high	118 Å²	118	64.1 Å²	64.1	51%	0.513	34%	0.341	S	S	.	.	H	α-helix	trans	-62.6	-44.9	177.5	-172.5	179.2	176.9	-176.5	0	112.2	W67 L84 T85 L86 A91 E92	W67-K88 HydrophobicContact CZ2-CB 4.14Å; L84-K88 WeakPolarHBondContact O-CB 3.43Å; L84-K88 PolarHBondContact O-N 3.27Å; T85-K88 PolarHBondContact O-N 2.89Å; L86-K88 VanDerWaalsContact C-N 3.27Å; L86-K88 PolarHBondContact O-N 3.38Å; K88-A91 PolarHBondContact O-N 2.96Å; K88-E92 WeakPolarHBondContact CE-OE1 3.41Å; K88-E92 WeakPolarHBondContact O-CG 3.25Å; K88-E92 PolarHBondContact O-N 3.27Å
89	Q	95.5	Very high	93	Very high	104 Å²	104	62.2 Å²	62.2	49%	0.486	32%	0.322	S	S	.	.	H	α-helix	trans	-61.9	-47.7	177	-71.6	174.2	-10.1	0	0	111.4	T85 L86 A91 E92 E93	T85-Q89 WeakPolarHBondContact O-CG 3.37Å; T85-Q89 PolarHBondContact O-N 3.48Å; T85-Q89 VanDerWaalsContact O-N 3.08Å; L86-Q89 PolarHBondContact O-N 2.85Å; L86-Q89 VanDerWaalsContact O-N 3.17Å; Q89-A91 VanDerWaalsContact C-N 3.32Å; Q89-A91 PolarHBondContact O-N 3.47Å; Q89-E92 PolarHBondContact O-N 3.16Å; Q89-E93 WeakPolarHBondContact O-CG 3.21Å; Q89-E93 PolarHBondContact O-N 3.41Å
90	Q	94.9	Very high	93.2	Very high	44 Å²	44	60.9 Å²	60.9	21%	0.206	32%	0.315	C	S	.	.	H	α-helix	trans	-63	-38.4	178.5	-70.7	-58.8	-41.2	0	0	112	L86 L87 E93 N94 L103 A106	L86-Q90 HydrophobicContact CD1-CG 4.18Å; L86-Q90 HydrophobicContact CG-CG 4.44Å; L86-Q90 WeakPolarHBondContact O-CG 3.3Å; L86-Q90 PolarHBondContact O-N 2.88Å; L87-Q90 PolarHBondContact O-N 2.82Å; Q90-E93 PolarHBondContact O-N 2.61Å; Q90-N94 WeakPolarHBondContact O-CB 3.46Å; Q90-N94 PolarHBondContact O-N 3.25Å; Q90-N94 VanDerWaalsContact O-N 3.09Å; Q90-N94 PolarHBondContact O-ND2 3.32Å; Q90-N94 PolarHBondContact OE1-ND2 3.43Å; Q90-L103 HydrophobicContact CB-CD2 3.68Å; Q90-A106 HydrophobicContact CG-CB 3.94Å
91	A	93.5	Very high	93.4	Very high	2 Å²	2	64.1 Å²	64.1	2%	0.017	33%	0.328	C	S	.	.	H	α-helix	trans	-65.8	-41.4	176.7	0	0	0	0	0	112.2	P64 W67 L87 K88 Q89 N94 L95 M99 L103	P64-A91 HydrophobicContact CB-CB 4.04Å; W67-A91 HydrophobicContact CH2-CB 3.79Å; W67-A91 HydrophobicContact CZ3-CB 3.79Å; L87-A91 VanDerWaalsContact O-CB 3.26Å; L87-A91 WeakPolarHBondContact O-CB 3.45Å; L87-A91 PolarHBondContact O-N 3.45Å; K88-A91 PolarHBondContact O-N 2.96Å; Q89-A91 VanDerWaalsContact C-N 3.32Å; Q89-A91 PolarHBondContact O-N 3.47Å; A91-N94 PolarHBondContact O-N 3.46Å; A91-L95 WeakPolarHBondContact O-CD2 3.46Å; A91-L95 WeakPolarHBondContact O-CG 3.34Å; A91-L95 PolarHBondContact O-N 3.28Å; A91-M99 HydrophobicContact CB-SD 3.96Å; A91-L103 HydrophobicContact CB-CD2 4.25Å
92	E	93.8	Very high	93.5	Very high	118 Å²	118	59.6 Å²	59.6	55%	0.551	31%	0.31	S	S	*	.	H	α-helix	trans	-66.6	-35.1	177.5	-73.4	176.4	-171.1	0	0	112.6	K88 Q89	K88-E92 WeakPolarHBondContact CE-OE1 3.41Å; K88-E92 WeakPolarHBondContact O-CG 3.25Å; K88-E92 PolarHBondContact O-N 3.27Å; Q89-E92 PolarHBondContact O-N 3.16Å
93	E	93.5	Very high	93.6	Very high	145 Å²	145	55.4 Å²	55.4	68%	0.678	29%	0.287	S	S	*	.	H	α-helix	trans	-75.4	-29.4	178.5	-72.2	-178.3	174.2	0	0	113.4	Q89 Q90	Q89-E93 WeakPolarHBondContact O-CG 3.21Å; Q89-E93 PolarHBondContact O-N 3.41Å; Q90-E93 PolarHBondContact O-N 2.61Å
94	N	92.3	Very high	93.7	Very high	31 Å²	31	55.4 Å²	55.4	17%	0.166	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.5	17.6	-175.2	-67.8	-85.9	0	0	0	113.7	Q90 A91 M97 M99	Q90-N94 WeakPolarHBondContact O-CB 3.46Å; Q90-N94 PolarHBondContact O-N 3.25Å; Q90-N94 VanDerWaalsContact O-N 3.09Å; Q90-N94 PolarHBondContact O-ND2 3.32Å; Q90-N94 PolarHBondContact OE1-ND2 3.43Å; A91-N94 PolarHBondContact O-N 3.46Å; N94-M97 WeakPolarHBondContact O-CG 3.47Å; N94-M97 PolarHBondContact O-N 3.08Å; N94-M99 HydrophobicContact CB-CB 3.9Å
95	L	92.9	Very high	93.7	Very high	84 Å²	84	54 Å²	54	44%	0.44	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	140.3	175.3	-64.8	178.1	0	0	0	112.1	P64 A91 M99	P64-L95 HydrophobicContact CB-CD2 4.38Å; P64-L95 HydrophobicContact CG-CD2 4.46Å; A91-L95 WeakPolarHBondContact O-CD2 3.46Å; A91-L95 WeakPolarHBondContact O-CG 3.34Å; A91-L95 PolarHBondContact O-N 3.28Å; L95-M99 HydrophobicContact CD2-CE 4.14Å
96	G	88.3	Confident	93.7	Very high	44 Å²	44	50.8 Å²	50.8	45%	0.454	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.4	6.8	-179	0	0	0	0	0	114.1	P61 D62	P61-G96 PolarHBondContact O-N 3.32Å; D62-G96 WeakPolarHBondContact OD1-CA 3.49Å
97	M	90.3	Very high	93.7	Very high	101 Å²	101	49 Å²	49	50%	0.498	25%	0.253	S	S	.	.	S	Bend	trans	-146.4	154.1	168.3	64.2	-179.2	-70	0	0	111.9	P61 N94 M99	P61-M97 VanDerWaalsContact CB-O 3.29Å; P61-M97 WeakPolarHBondContact CB-O 3.33Å; N94-M97 WeakPolarHBondContact O-CG 3.47Å; N94-M97 PolarHBondContact O-N 3.08Å; M97-M99 PolarHBondContact O-N 3.27Å
98	V	91.6	Very high	93.7	Very high	55 Å²	55	51.9 Å²	51.9	33%	0.333	27%	0.267	S	S	.	.			trans	-52.7	126.7	173.5	-68.8	0	0	0	0	110.7	E7 E11 Y60	E7-V98 HydrophobicContact CB-CG1 4.39Å; E11-V98 HydrophobicContact CB-CB 4.28Å; E11-V98 HydrophobicContact CB-CG1 4Å; E11-V98 VanDerWaalsContact CD-CB 3.44Å; E11-V98 HydrophobicContact CG-CB 4.18Å; E11-V98 HydrophobicContact CG-CG1 4.41Å; E11-V98 WeakPolarHBondContact OE1-CB 3.42Å; E11-V98 WeakPolarHBondContact OE2-CB 3.4Å; E11-V98 WeakPolarHBondContact OE2-CG1 3.4Å; Y60-V98 HydrophobicContact CE1-CG1 4.32Å; Y60-V98 WeakPolarHBondContact OH-CA 3.34Å
99	M	94.4	Very high	93.7	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.27	C	S	.	.			trans	-131.3	-2.1	-165.6	67.5	179.8	102.4	0	0	114.2	E11 Y60 A91 N94 L95 M97 F101 T102 L103	E11-M99 PolarHBondContact OE1-N 3.15Å; Y60-M99 HydrophobicContact CD2-CE 4.21Å; Y60-M99 HydrophobicContact CE2-CE 3.78Å; Y60-M99 HydrophobicContact CE2-CG 3.88Å; Y60-M99 HydrophobicContact CE2-SD 4.45Å; Y60-M99 PolarHBondContact OH-N 2.97Å; A91-M99 HydrophobicContact CB-SD 3.96Å; N94-M99 HydrophobicContact CB-CB 3.9Å; L95-M99 HydrophobicContact CD2-CE 4.14Å; M97-M99 PolarHBondContact O-N 3.27Å; M99-F101 VanDerWaalsContact C-N 3.32Å; M99-F101 PolarHBondContact O-N 2.65Å; M99-T102 WeakPolarHBondContact O-CB 3.15Å; M99-T102 PolarHBondContact O-N 2.95Å; M99-T102 VanDerWaalsContact O-N 3.12Å; M99-L103 HydrophobicContact CG-CD1 4.03Å; M99-L103 HydrophobicContact CG-CG 4.39Å; M99-L103 VanDerWaalsContact O-CG 3.29Å; M99-L103 WeakPolarHBondContact O-CG 3.41Å; M99-L103 PolarHBondContact O-N 3.35Å; M99-L103 HydrophobicContact SD-CD1 4.29Å
100	I	94.8	Very high	93.6	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-59.1	-45.4	-177.6	-60.7	-63.3	0	0	0	110.6	E11 I15 F33 I35 F54 Y56 P65 T102 L103 V104	E11-I100 WeakPolarHBondContact OE1-CB 3.45Å; E11-I100 WeakPolarHBondContact OE1-CG1 3.41Å; E11-I100 PolarHBondContact OE1-N 2.97Å; I15-I100 HydrophobicContact CD1-CB 4.38Å; I15-I100 HydrophobicContact CD1-CG2 4.08Å; I15-I100 HydrophobicContact CG1-CB 4.41Å; I15-I100 HydrophobicContact CG1-CG2 4.11Å; F33-I100 HydrophobicContact CE2-CG2 3.97Å; F33-I100 HydrophobicContact CZ-CD1 4.13Å; F33-I100 HydrophobicContact CZ-CG1 4.1Å; F33-I100 HydrophobicContact CZ-CG2 4Å; I35-I100 HydrophobicContact CD1-CG2 3.85Å; F54-I100 HydrophobicContact CB-CD1 4.07Å; F54-I100 HydrophobicContact CD1-CD1 3.76Å; F54-I100 HydrophobicContact CD2-CD1 4.44Å; F54-I100 HydrophobicContact CD2-CG2 4.32Å; F54-I100 HydrophobicContact CE1-CD1 4.28Å; F54-I100 HydrophobicContact CE2-CG2 4.37Å; F54-I100 HydrophobicContact CG-CD1 3.84Å; Y56-I100 HydrophobicContact CE1-CD1 4.07Å; Y56-I100 HydrophobicContact CE1-CG1 3.88Å; P65-I100 HydrophobicContact CB-CD1 4.26Å; P65-I100 HydrophobicContact CG-CD1 3.89Å; I100-T102 VanDerWaalsContact C-N 3.32Å; I100-T102 PolarHBondContact O-N 2.87Å; I100-L103 PolarHBondContact O-N 2.91Å; I100-V104 HydrophobicContact CG2-CG2 4.27Å; I100-V104 WeakPolarHBondContact O-CB 3.29Å; I100-V104 VanDerWaalsContact O-CG2 3.25Å; I100-V104 WeakPolarHBondContact O-CG2 3.46Å; I100-V104 PolarHBondContact O-N 3.39Å
101	F	95	Very high	93.5	Very high	95 Å²	95	47.8 Å²	47.8	42%	0.417	25%	0.249	S	C	.	.	H	α-helix	trans	-60	-43	177.2	178.6	-103.1	0	0	0	112	I15 I18 Y19 M99 V104 T105	I15-F101 HydrophobicContact CD1-CB 3.8Å; I15-F101 HydrophobicContact CD1-CD2 4.43Å; I18-F101 HydrophobicContact CD1-CD2 3.85Å; I18-F101 HydrophobicContact CD1-CE2 4.14Å; I18-F101 HydrophobicContact CG2-CE2 4.21Å; Y19-F101 HydrophobicContact CE2-CD2 4.24Å; M99-F101 VanDerWaalsContact C-N 3.32Å; M99-F101 PolarHBondContact O-N 2.65Å; F101-V104 PolarHBondContact O-N 2.96Å; F101-T105 WeakPolarHBondContact CZ-OG1 3.43Å; F101-T105 WeakPolarHBondContact O-CB 3.36Å; F101-T105 PolarHBondContact O-N 3.23Å; F101-T105 PolarHBondContact O-OG1 3.32Å
102	T	94.3	Very high	93.4	Very high	40 Å²	40	49.5 Å²	49.5	25%	0.245	26%	0.258	C	S	.	.	H	α-helix	trans	-63	-45.2	178.2	-52.4	0	0	0	0	111.1	M99 I100 T105 A106	M99-T102 WeakPolarHBondContact O-CB 3.15Å; M99-T102 PolarHBondContact O-N 2.95Å; M99-T102 VanDerWaalsContact O-N 3.12Å; I100-T102 VanDerWaalsContact C-N 3.32Å; I100-T102 PolarHBondContact O-N 2.87Å; T102-T105 PolarHBondContact O-N 3.2Å; T102-A106 WeakPolarHBondContact O-CB 3.48Å; T102-A106 PolarHBondContact O-N 3.47Å
103	L	95.1	Very high	93.3	Very high	0 Å²	0	49 Å²	49	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-62	-45.9	177.4	-67.7	175.8	0	0	0	111.6	F54 P65 L87 Q90 A91 M99 I100 A106 V107	F54-L103 HydrophobicContact CE1-CB 4.45Å; F54-L103 HydrophobicContact CE1-CD1 3.96Å; F54-L103 HydrophobicContact CZ-CB 4.33Å; P65-L103 HydrophobicContact CG-CD1 4.19Å; L87-L103 HydrophobicContact CD2-CB 3.7Å; L87-L103 HydrophobicContact CD2-CD2 3.71Å; L87-L103 HydrophobicContact CD2-CG 4.17Å; L87-L103 WeakPolarHBondContact O-CD2 3.41Å; Q90-L103 HydrophobicContact CB-CD2 3.68Å; A91-L103 HydrophobicContact CB-CD2 4.25Å; M99-L103 HydrophobicContact CG-CD1 4.03Å; M99-L103 HydrophobicContact CG-CG 4.39Å; M99-L103 VanDerWaalsContact O-CG 3.29Å; M99-L103 WeakPolarHBondContact O-CG 3.41Å; M99-L103 PolarHBondContact O-N 3.35Å; M99-L103 HydrophobicContact SD-CD1 4.29Å; I100-L103 PolarHBondContact O-N 2.91Å; L103-A106 PolarHBondContact O-N 3.19Å; L103-V107 WeakPolarHBondContact O-CG2 3.37Å; L103-V107 PolarHBondContact O-N 3.05Å
104	V	94.9	Very high	93.1	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-62.4	-44.1	177.6	170.9	0	0	0	0	111	Y19 I35 V37 F54 I100 F101 V107 Q108	Y19-V104 HydrophobicContact CE1-CG1 4.27Å; Y19-V104 HydrophobicContact CE2-CG1 3.97Å; Y19-V104 WeakPolarHBondContact OH-CG1 3.32Å; I35-V104 HydrophobicContact CB-CG2 4.44Å; I35-V104 HydrophobicContact CD1-CG2 3.62Å; I35-V104 HydrophobicContact CG2-CG1 4.17Å; I35-V104 HydrophobicContact CG2-CG2 4.18Å; V37-V104 HydrophobicContact CG2-CG1 3.81Å; F54-V104 HydrophobicContact CE2-CG2 3.98Å; F54-V104 HydrophobicContact CZ-CG2 4.32Å; I100-V104 HydrophobicContact CG2-CG2 4.27Å; I100-V104 WeakPolarHBondContact O-CB 3.29Å; I100-V104 VanDerWaalsContact O-CG2 3.25Å; I100-V104 WeakPolarHBondContact O-CG2 3.46Å; I100-V104 PolarHBondContact O-N 3.39Å; F101-V104 PolarHBondContact O-N 2.96Å; V104-V107 PolarHBondContact O-N 3.04Å; V104-Q108 WeakPolarHBondContact O-CB 2.85Å; V104-Q108 PolarHBondContact O-N 2.98Å
105	T	94.3	Very high	92.9	Very high	37 Å²	37	41.8 Å²	41.8	23%	0.227	22%	0.222	C	C	.	.	H	α-helix	trans	-63.8	-44	178.2	-57.4	0	0	0	0	111.3	F101 T102 V107 Q108 E109	F101-T105 WeakPolarHBondContact CZ-OG1 3.43Å; F101-T105 WeakPolarHBondContact O-CB 3.36Å; F101-T105 PolarHBondContact O-N 3.23Å; F101-T105 PolarHBondContact O-OG1 3.32Å; T102-T105 PolarHBondContact O-N 3.2Å; T105-V107 VanDerWaalsContact C-N 3.32Å; T105-V107 PolarHBondContact O-N 3.02Å; T105-Q108 WeakPolarHBondContact O-CB 3.26Å; T105-Q108 PolarHBondContact O-N 3.48Å; T105-E109 WeakPolarHBondContact O-CG 3.32Å; T105-E109 PolarHBondContact O-N 3.41Å
106	A	95.1	Very high	92.6	Very high	11 Å²	11	42.5 Å²	42.5	9%	0.091	23%	0.226	C	C	.	.	H	α-helix	trans	-62.7	-38.7	177	0	0	0	0	0	112.2	L86 Q90 T102 L103 K110	L86-A106 HydrophobicContact CD2-CB 4.3Å; L86-A106 WeakPolarHBondContact CD2-O 3.4Å; Q90-A106 HydrophobicContact CG-CB 3.94Å; T102-A106 WeakPolarHBondContact O-CB 3.48Å; T102-A106 PolarHBondContact O-N 3.47Å; L103-A106 PolarHBondContact O-N 3.19Å; A106-K110 WeakPolarHBondContact O-CB 3.24Å; A106-K110 PolarHBondContact O-N 3.02Å
107	V	94.8	Very high	92.6	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-65.9	-44.2	173.6	175.1	0	0	0	0	110.6	L52 I83 L87 L103 V104 T105 E109 K110 L111	L52-V107 HydrophobicContact CD1-CB 4.04Å; L52-V107 HydrophobicContact CD1-CG1 3.93Å; L52-V107 HydrophobicContact CD1-CG2 3.65Å; I83-V107 HydrophobicContact CG2-CG1 4.15Å; I83-V107 HydrophobicContact CG2-CG2 3.93Å; L87-V107 HydrophobicContact CD1-CG2 4.11Å; L87-V107 HydrophobicContact CD2-CG2 3.54Å; L87-V107 HydrophobicContact CG-CG2 3.82Å; L103-V107 WeakPolarHBondContact O-CG2 3.37Å; L103-V107 PolarHBondContact O-N 3.05Å; V104-V107 PolarHBondContact O-N 3.04Å; T105-V107 VanDerWaalsContact C-N 3.32Å; T105-V107 PolarHBondContact O-N 3.02Å; V107-E109 PolarHBondContact O-N 3.42Å; V107-K110 PolarHBondContact O-N 3.39Å; V107-L111 HydrophobicContact CG1-CD1 4.07Å; V107-L111 HydrophobicContact CG1-CG 4.1Å; V107-L111 VanDerWaalsContact O-CG 3.3Å; V107-L111 WeakPolarHBondContact O-CG 3.39Å; V107-L111 PolarHBondContact O-N 3.34Å
108	Q	93.6	Very high	92.3	Very high	60 Å²	60	40.3 Å²	40.3	28%	0.28	21%	0.211	S	C	.	.	H	α-helix	trans	-57.9	-47.2	178.2	-171.1	174.4	1.8	0	0	111.9	V37 V104 T105 K110 L111 N112	V37-Q108 HydrophobicContact CG1-CB 3.59Å; V37-Q108 HydrophobicContact CG1-CG 3.91Å; V104-Q108 WeakPolarHBondContact O-CB 2.85Å; V104-Q108 PolarHBondContact O-N 2.98Å; T105-Q108 WeakPolarHBondContact O-CB 3.26Å; T105-Q108 PolarHBondContact O-N 3.48Å; Q108-K110 VanDerWaalsContact C-N 3.28Å; Q108-K110 PolarHBondContact O-N 2.88Å; Q108-L111 PolarHBondContact O-N 3.43Å; Q108-N112 PolarHBondContact O-N 3.44Å; Q108-N112 VanDerWaalsContact O-N 3.11Å
109	E	94.3	Very high	91.8	Very high	126 Å²	126	39.8 Å²	39.8	59%	0.589	21%	0.205	S	C	*	.	H	α-helix	trans	-59.2	-41.7	174.2	-70.9	-177	165.1	0	0	111.2	T105 V107 N112 E113	T105-E109 WeakPolarHBondContact O-CG 3.32Å; T105-E109 PolarHBondContact O-N 3.41Å; V107-E109 PolarHBondContact O-N 3.42Å; E109-N112 WeakPolarHBondContact O-CB 3.48Å; E109-N112 PolarHBondContact O-N 2.92Å; E109-E113 PolarHBondContact O-N 3.04Å
110	K	93.6	Very high	91.2	Very high	54 Å²	54	44 Å²	44	24%	0.235	23%	0.227	C	C	.	.	H	α-helix	trans	-67.8	-38.3	-179.7	-167.4	57.9	-179.3	174.5	0	113.2	I83 L86 A106 V107 Q108 N112 E113 I114	I83-K110 HydrophobicContact CG1-CG 3.99Å; L86-K110 HydrophobicContact CD2-CB 3.69Å; L86-K110 HydrophobicContact CD2-CD 4.32Å; L86-K110 HydrophobicContact CD2-CG 3.98Å; A106-K110 WeakPolarHBondContact O-CB 3.24Å; A106-K110 PolarHBondContact O-N 3.02Å; V107-K110 PolarHBondContact O-N 3.39Å; Q108-K110 VanDerWaalsContact C-N 3.28Å; Q108-K110 PolarHBondContact O-N 2.88Å; K110-N112 VanDerWaalsContact C-N 3.31Å; K110-E113 WeakPolarHBondContact CD-OE2 3.44Å; K110-E113 IonicContact NZ-OE2 2.64Å; K110-E113 PolarHBondContact NZ-OE2 3.45Å; K110-E113 PolarHBondContact O-N 3.04Å; K110-I114 HydrophobicContact CG-CD1 4.25Å; K110-I114 WeakPolarHBondContact O-CD1 3.48Å; K110-I114 VanDerWaalsContact O-CG1 3.29Å; K110-I114 WeakPolarHBondContact O-CG1 3.3Å; K110-I114 PolarHBondContact O-N 3.47Å
111	L	93	Very high	90.6	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-61.4	-41.7	174.4	-70.6	-179.9	0	0	0	111.1	V37 V48 A50 L75 I83 V107 Q108 I114 V115	V37-L111 HydrophobicContact CB-CD1 4.05Å; V37-L111 HydrophobicContact CG1-CD1 3.89Å; V37-L111 WeakPolarHBondContact O-CD1 3.3Å; V48-L111 HydrophobicContact CG2-CB 3.74Å; V48-L111 HydrophobicContact CG2-CD2 3.8Å; V48-L111 HydrophobicContact CG2-CG 4.24Å; A50-L111 HydrophobicContact CB-CD1 4.21Å; A50-L111 HydrophobicContact CB-CD2 4.31Å; L75-L111 HydrophobicContact CD1-CD2 3.69Å; L75-L111 HydrophobicContact CD2-CD2 3.82Å; L75-L111 HydrophobicContact CG-CD2 4.34Å; I83-L111 HydrophobicContact CD1-CD2 3.81Å; V107-L111 HydrophobicContact CG1-CD1 4.07Å; V107-L111 HydrophobicContact CG1-CG 4.1Å; V107-L111 VanDerWaalsContact O-CG 3.3Å; V107-L111 WeakPolarHBondContact O-CG 3.39Å; V107-L111 PolarHBondContact O-N 3.34Å; Q108-L111 PolarHBondContact O-N 3.43Å; L111-I114 HydrophobicContact CD2-CD1 4.49Å; L111-I114 PolarHBondContact O-N 2.95Å; L111-V115 WeakPolarHBondContact O-CG2 3.39Å; L111-V115 PolarHBondContact O-N 2.9Å; L111-V115 VanDerWaalsContact O-N 3.09Å
112	N	91.4	Very high	89.8	Confident	39 Å²	39	50.4 Å²	50.4	21%	0.209	25%	0.253	C	S	.	.	H	α-helix	trans	-61.8	-44	174.4	-73.4	-9.3	0	0	0	111.9	S39 D40 Q108 E109 K110 I114 V115 D116	S39-N112 VanDerWaalsContact CA-OD1 3.24Å; S39-N112 WeakPolarHBondContact CA-OD1 3.43Å; S39-N112 VanDerWaalsContact CB-OD1 3.28Å; S39-N112 WeakPolarHBondContact CB-OD1 3.41Å; D40-N112 PolarHBondContact N-OD1 3.35Å; D40-N112 PolarHBondContact OD2-ND2 3.1Å; Q108-N112 PolarHBondContact O-N 3.44Å; Q108-N112 VanDerWaalsContact O-N 3.11Å; E109-N112 WeakPolarHBondContact O-CB 3.48Å; E109-N112 PolarHBondContact O-N 2.92Å; K110-N112 VanDerWaalsContact C-N 3.31Å; N112-I114 VanDerWaalsContact C-N 3.29Å; N112-I114 PolarHBondContact O-N 2.98Å; N112-V115 PolarHBondContact O-N 3.01Å; N112-D116 PolarHBondContact O-N 3.17Å
113	E	91.1	Very high	89.2	Confident	108 Å²	108	53.4 Å²	53.4	51%	0.505	26%	0.264	S	S	.	.	H	α-helix	trans	-60.6	-37.2	174.9	-70.5	-175.3	171.2	0	0	113	E109 K110 D116 A117	E109-E113 PolarHBondContact O-N 3.04Å; K110-E113 WeakPolarHBondContact CD-OE2 3.44Å; K110-E113 IonicContact NZ-OE2 2.64Å; K110-E113 PolarHBondContact NZ-OE2 3.45Å; K110-E113 PolarHBondContact O-N 3.04Å; E113-D116 PolarHBondContact O-N 2.77Å; E113-A117 VanDerWaalsContact O-CB 3.32Å; E113-A117 WeakPolarHBondContact O-CB 3.33Å; E113-A117 PolarHBondContact O-N 3.47Å
114	I	90.1	Very high	88.5	Confident	8 Å²	8	60 Å²	60	4%	0.041	30%	0.295	C	S	.	.	H	α-helix	trans	-66.1	-44.5	178.7	-69.1	158	0	0	0	110.1	L75 D79 I83 K110 L111 N112 D116 A117 M118	L75-I114 HydrophobicContact CD2-CD1 4.02Å; L75-I114 HydrophobicContact CD2-CG2 4.02Å; D79-I114 HydrophobicContact CB-CD1 3.84Å; D79-I114 HydrophobicContact CB-CG1 4.41Å; I83-I114 HydrophobicContact CD1-CD1 4.05Å; I83-I114 HydrophobicContact CG1-CD1 4.36Å; K110-I114 HydrophobicContact CG-CD1 4.25Å; K110-I114 WeakPolarHBondContact O-CD1 3.48Å; K110-I114 VanDerWaalsContact O-CG1 3.29Å; K110-I114 WeakPolarHBondContact O-CG1 3.3Å; K110-I114 PolarHBondContact O-N 3.47Å; L111-I114 HydrophobicContact CD2-CD1 4.49Å; L111-I114 PolarHBondContact O-N 2.95Å; N112-I114 VanDerWaalsContact C-N 3.29Å; N112-I114 PolarHBondContact O-N 2.98Å; I114-D116 VanDerWaalsContact C-N 3.34Å; I114-D116 PolarHBondContact O-N 2.75Å; I114-A117 PolarHBondContact O-N 3.01Å; I114-M118 HydrophobicContact CG2-CG 4.38Å; I114-M118 HydrophobicContact CG2-SD 4.13Å; I114-M118 WeakPolarHBondContact O-CB 3.26Å; I114-M118 WeakPolarHBondContact O-CG 3.39Å; I114-M118 PolarHBondContact O-N 2.98Å
115	V	88.4	Confident	87.8	Confident	16 Å²	16	64.8 Å²	64.8	10%	0.097	32%	0.317	C	S	.	.	H	α-helix	trans	-58.8	-46.5	175.3	173.1	0	0	0	0	111.1	S39 V48 L111 N112 A117 M118 K119	S39-V115 WeakPolarHBondContact OG-CG2 3.42Å; V48-V115 HydrophobicContact CB-CG2 4.22Å; V48-V115 HydrophobicContact CG1-CG2 3.77Å; V48-V115 HydrophobicContact CG2-CG2 3.62Å; L111-V115 WeakPolarHBondContact O-CG2 3.39Å; L111-V115 PolarHBondContact O-N 2.9Å; L111-V115 VanDerWaalsContact O-N 3.09Å; N112-V115 PolarHBondContact O-N 3.01Å; V115-A117 VanDerWaalsContact C-N 3.33Å; V115-A117 PolarHBondContact O-N 3.48Å; V115-M118 PolarHBondContact O-N 3.48Å; V115-K119 PolarHBondContact O-N 3.25Å
116	D	87	Confident	87.3	Confident	99 Å²	99	69.4 Å²	69.4	53%	0.529	33%	0.334	S	S	.	.	H	α-helix	trans	-62.4	-41.3	178	-76	-19.1	0	0	0	111.7	N112 E113 I114 K119 N120	N112-D116 PolarHBondContact O-N 3.17Å; E113-D116 PolarHBondContact O-N 2.77Å; I114-D116 VanDerWaalsContact C-N 3.34Å; I114-D116 PolarHBondContact O-N 2.75Å; D116-K119 PolarHBondContact O-N 3.31Å; D116-N120 VanDerWaalsContact O-CG 3.26Å; D116-N120 PolarHBondContact O-N 2.97Å; D116-N120 PolarHBondContact O-ND2 3.24Å
117	A	86.7	Confident	86.7	Confident	48 Å²	48	74.4 Å²	74.4	40%	0.397	36%	0.358	S	S	.	.	H	α-helix	trans	-67.2	-39.4	177.3	0	0	0	0	0	112.6	E113 I114 V115 N120 R121	E113-A117 VanDerWaalsContact O-CB 3.32Å; E113-A117 WeakPolarHBondContact O-CB 3.33Å; E113-A117 PolarHBondContact O-N 3.47Å; I114-A117 PolarHBondContact O-N 3.01Å; V115-A117 VanDerWaalsContact C-N 3.33Å; V115-A117 PolarHBondContact O-N 3.48Å; A117-N120 PolarHBondContact O-N 3.04Å; A117-R121 WeakPolarHBondContact O-CB 3.34Å; A117-R121 PolarHBondContact O-N 3.14Å
118	M	83.7	Confident	86	Confident	50 Å²	50	80.9 Å²	80.9	25%	0.246	38%	0.383	C	S	.	.	H	α-helix	trans	-60.5	-46.9	174.6	-77.8	177.7	55.9	0	0	110.9	V48 I114 V115 R121 Q122	V48-M118 HydrophobicContact CG1-SD 4.24Å; I114-M118 HydrophobicContact CG2-CG 4.38Å; I114-M118 HydrophobicContact CG2-SD 4.13Å; I114-M118 WeakPolarHBondContact O-CB 3.26Å; I114-M118 WeakPolarHBondContact O-CG 3.39Å; I114-M118 PolarHBondContact O-N 2.98Å; V115-M118 PolarHBondContact O-N 3.48Å; M118-R121 PolarHBondContact O-N 2.96Å; M118-Q122 WeakPolarHBondContact O-CG 3.41Å; M118-Q122 PolarHBondContact O-N 3.36Å
119	K	81.6	Confident	85.5	Confident	44 Å²	44	85.2 Å²	85.2	19%	0.191	40%	0.401	C	S	.	.	H	α-helix	trans	-59.5	-49.9	177.3	-179.5	-178.8	167.1	-171.8	0	111.6	E43 V115 D116 R121 Q122 E123	E43-K119 IonicContact OE2-NZ 3.51Å; E43-K119 PolarHBondContact OE2-NZ 3.31Å; V115-K119 PolarHBondContact O-N 3.25Å; D116-K119 PolarHBondContact O-N 3.31Å; K119-R121 VanDerWaalsContact C-N 3.27Å; K119-R121 PolarHBondContact O-N 3.23Å; K119-Q122 PolarHBondContact O-N 3.2Å; K119-Q122 VanDerWaalsContact O-N 3.14Å; K119-E123 WeakPolarHBondContact CE-OE1 3.47Å; K119-E123 HydrophobicContact CG-CG 4.44Å; K119-E123 IonicContact NZ-OE1 2.61Å; K119-E123 WeakPolarHBondContact O-CG 3.42Å; K119-E123 PolarHBondContact O-N 3.35Å
120	N	82.8	Confident	84.9	Confident	89 Å²	89	84.1 Å²	84.1	48%	0.476	40%	0.396	S	S	.	.	H	α-helix	trans	-58.3	-42	179.5	-71	-25.1	0	0	0	111.6	D116 A117 E123 E124	D116-N120 VanDerWaalsContact O-CG 3.26Å; D116-N120 PolarHBondContact O-N 2.97Å; D116-N120 PolarHBondContact O-ND2 3.24Å; A117-N120 PolarHBondContact O-N 3.04Å; N120-E123 PolarHBondContact O-N 3.43Å; N120-E124 WeakPolarHBondContact O-CB 3.41Å; N120-E124 VanDerWaalsContact O-CG 3.3Å; N120-E124 WeakPolarHBondContact O-CG 3.47Å; N120-E124 PolarHBondContact O-N 2.91Å
121	R	82.3	Confident	84.3	Confident	141 Å²	141	87.5 Å²	87.5	53%	0.532	41%	0.41	S	S	.	.	H	α-helix	trans	-63.9	-43.7	177.1	-166.3	-177.6	-64.7	164.5	2.3	111.7	A117 M118 K119 E124 E125	A117-R121 WeakPolarHBondContact O-CB 3.34Å; A117-R121 PolarHBondContact O-N 3.14Å; M118-R121 PolarHBondContact O-N 2.96Å; K119-R121 VanDerWaalsContact C-N 3.27Å; K119-R121 PolarHBondContact O-N 3.23Å; R121-E124 PolarHBondContact O-N 2.84Å; R121-E125 WeakPolarHBondContact O-CG 3.14Å; R121-E125 PolarHBondContact O-N 3.23Å
122	Q	77.7	Confident	83.7	Confident	89 Å²	89	92.7 Å²	92.7	42%	0.416	44%	0.435	S	S	.	.	H	α-helix	trans	-63.2	-43.5	177	-72.8	-178.2	-0.6	0	0	112.4	M118 K119 E125 K126	M118-Q122 WeakPolarHBondContact O-CG 3.41Å; M118-Q122 PolarHBondContact O-N 3.36Å; K119-Q122 PolarHBondContact O-N 3.2Å; K119-Q122 VanDerWaalsContact O-N 3.14Å; Q122-E125 PolarHBondContact O-N 3.49Å; Q122-K126 WeakPolarHBondContact O-CB 3.37Å; Q122-K126 PolarHBondContact O-N 3.04Å
123	E	80.9	Confident	83.1	Confident	102 Å²	102	93.4 Å²	93.4	48%	0.477	45%	0.446	S	S	.	.	H	α-helix	trans	-64.2	-43.8	177.9	-73.1	-176.3	177.5	0	0	111.8	K119 N120 E125 K126 L127	K119-E123 WeakPolarHBondContact CE-OE1 3.47Å; K119-E123 HydrophobicContact CG-CG 4.44Å; K119-E123 IonicContact NZ-OE1 2.61Å; K119-E123 WeakPolarHBondContact O-CG 3.42Å; K119-E123 PolarHBondContact O-N 3.35Å; N120-E123 PolarHBondContact O-N 3.43Å; E123-E125 PolarHBondContact O-N 2.96Å; E123-K126 PolarHBondContact O-N 2.9Å; E123-L127 WeakPolarHBondContact O-CB 3.36Å; E123-L127 PolarHBondContact O-N 3.24Å
124	E	81.1	Confident	82.6	Confident	140 Å²	140	92.8 Å²	92.8	65%	0.654	44%	0.443	S	S	*	.	H	α-helix	trans	-62.5	-40.8	176.2	-76.2	-178.4	172.7	0	0	112.3	N120 R121 L127 R128	N120-E124 WeakPolarHBondContact O-CB 3.41Å; N120-E124 VanDerWaalsContact O-CG 3.3Å; N120-E124 WeakPolarHBondContact O-CG 3.47Å; N120-E124 PolarHBondContact O-N 2.91Å; R121-E124 PolarHBondContact O-N 2.84Å; E124-L127 PolarHBondContact O-N 3.23Å; E124-R128 WeakPolarHBondContact O-CB 3.46Å; E124-R128 PolarHBondContact O-N 2.92Å
125	E	81.1	Confident	82	Confident	99 Å²	99	97.2 Å²	97.2	46%	0.463	46%	0.463	S	S	.	.	H	α-helix	trans	-67.6	-39.5	176.7	-73.3	-153.9	132.6	0	0	112.7	R121 Q122 E123 R128 K129	R121-E125 WeakPolarHBondContact O-CG 3.14Å; R121-E125 PolarHBondContact O-N 3.23Å; Q122-E125 PolarHBondContact O-N 3.49Å; E123-E125 PolarHBondContact O-N 2.96Å; E125-R128 PolarHBondContact O-N 3.41Å; E125-R128 IonicContact OE1-CZ 3.68Å; E125-R128 IonicContact OE1-NH2 3.79Å; E125-R128 PolarHBondContact OE1-NH2 3.08Å; E125-K129 WeakPolarHBondContact O-CB 3.48Å; E125-K129 PolarHBondContact O-N 3.38Å
126	K	82.1	Confident	81.5	Confident	135 Å²	135	98.6 Å²	98.6	59%	0.587	48%	0.477	S	S	*	.	H	α-helix	trans	-61.6	-47.6	174.3	-173.2	-176.9	174.1	-168.4	0	110.7	Q122 E123 R128 K129 E130	Q122-K126 WeakPolarHBondContact O-CB 3.37Å; Q122-K126 PolarHBondContact O-N 3.04Å; E123-K126 PolarHBondContact O-N 2.9Å; K126-R128 VanDerWaalsContact C-N 3.34Å; K126-R128 PolarHBondContact O-N 3.32Å; K126-K129 PolarHBondContact O-N 2.96Å; K126-E130 VanDerWaalsContact CE-OE1 3.25Å; K126-E130 WeakPolarHBondContact CE-OE1 3.24Å; K126-E130 WeakPolarHBondContact O-CG 3.41Å; K126-E130 PolarHBondContact O-N 3.04Å
127	L	83.7	Confident	81	Confident	115 Å²	115	100.4 Å²	100.4	60%	0.602	48%	0.482	S	S	*	.	H	α-helix	trans	-62.5	-40.5	178	-173	68.8	0	0	0	111.9	E123 E124 E130 K131	E123-L127 WeakPolarHBondContact O-CB 3.36Å; E123-L127 PolarHBondContact O-N 3.24Å; E124-L127 PolarHBondContact O-N 3.23Å; L127-E130 PolarHBondContact O-N 3.36Å; L127-K131 WeakPolarHBondContact O-CB 3.34Å; L127-K131 PolarHBondContact O-N 3.31Å
128	R	79.6	Confident	80.4	Confident	136 Å²	136	103 Å²	103	51%	0.513	48%	0.484	S	S	.	.	H	α-helix	trans	-61	-45.1	175.6	-172.3	177.7	71.5	-144.2	-6	111.1	E124 E125 K126 K131 E132	E124-R128 WeakPolarHBondContact O-CB 3.46Å; E124-R128 PolarHBondContact O-N 2.92Å; E125-R128 PolarHBondContact O-N 3.41Å; E125-R128 IonicContact OE1-CZ 3.68Å; E125-R128 IonicContact OE1-NH2 3.79Å; E125-R128 PolarHBondContact OE1-NH2 3.08Å; K126-R128 VanDerWaalsContact C-N 3.34Å; K126-R128 PolarHBondContact O-N 3.32Å; R128-K131 PolarHBondContact O-N 2.84Å; R128-E132 WeakPolarHBondContact O-CG 3.42Å; R128-E132 PolarHBondContact O-N 3.44Å
129	K	83.1	Confident	79.8	Confident	151 Å²	151	105.7 Å²	105.7	66%	0.657	50%	0.503	S	S	*	.	H	α-helix	trans	-67.1	-39.7	179.1	-172.1	176.8	-179.9	-177.7	0	112.5	E125 K126 K131 E132 A133	E125-K129 WeakPolarHBondContact O-CB 3.48Å; E125-K129 PolarHBondContact O-N 3.38Å; K126-K129 PolarHBondContact O-N 2.96Å; K129-K131 VanDerWaalsContact C-N 3.35Å; K129-E132 PolarHBondContact O-N 3.43Å; K129-A133 WeakPolarHBondContact O-CB 3.4Å; K129-A133 PolarHBondContact O-N 3.24Å
130	E	81.9	Confident	79.2	Confident	103 Å²	103	112 Å²	112	48%	0.481	53%	0.531	S	S	.	.	H	α-helix	trans	-62.4	-42.9	174.1	-75.8	175.2	177.4	0	0	111.1	K126 L127 A133 E134	K126-E130 VanDerWaalsContact CE-OE1 3.25Å; K126-E130 WeakPolarHBondContact CE-OE1 3.24Å; K126-E130 WeakPolarHBondContact O-CG 3.41Å; K126-E130 PolarHBondContact O-N 3.04Å; L127-E130 PolarHBondContact O-N 3.36Å; E130-A133 PolarHBondContact O-N 3Å; E130-E134 WeakPolarHBondContact O-CB 3.41Å; E130-E134 PolarHBondContact O-N 3.04Å
131	K	80.2	Confident	78	Confident	125 Å²	125	116.8 Å²	116.8	54%	0.543	55%	0.547	S	S	.	.	H	α-helix	trans	-64.9	-42.8	176.5	-171.2	179.6	177.5	-174.3	0	112.8	L127 R128 K129 A133 E134 E135	L127-K131 WeakPolarHBondContact O-CB 3.34Å; L127-K131 PolarHBondContact O-N 3.31Å; R128-K131 PolarHBondContact O-N 2.84Å; K129-K131 VanDerWaalsContact C-N 3.35Å; K131-A133 VanDerWaalsContact C-N 3.3Å; K131-A133 PolarHBondContact O-N 3.24Å; K131-E134 PolarHBondContact O-N 3.45Å; K131-E135 VanDerWaalsContact CE-OE1 3.3Å; K131-E135 WeakPolarHBondContact CE-OE1 3.28Å; K131-E135 WeakPolarHBondContact O-CB 3.43Å; K131-E135 WeakPolarHBondContact O-CG 3.2Å; K131-E135 PolarHBondContact O-N 3.17Å
132	E	81	Confident	76.7	Confident	110 Å²	110	117 Å²	117	51%	0.514	55%	0.554	S	S	.	*	H	α-helix	trans	-63	-37.4	174.9	-74.4	172.8	-171	0	0	111.9	R128 K129 A136	R128-E132 WeakPolarHBondContact O-CG 3.42Å; R128-E132 PolarHBondContact O-N 3.44Å; K129-E132 PolarHBondContact O-N 3.43Å; E132-A136 WeakPolarHBondContact O-CB 3.24Å; E132-A136 PolarHBondContact O-N 3.05Å
133	A	80.1	Confident	76.2	Confident	53 Å²	53	115.4 Å²	115.4	44%	0.438	56%	0.562	S	S	.	*	H	α-helix	trans	-66.7	-44.6	174.3	0	0	0	0	0	111.6	K129 E130 K131 E135 A136 E137	K129-A133 WeakPolarHBondContact O-CB 3.4Å; K129-A133 PolarHBondContact O-N 3.24Å; E130-A133 PolarHBondContact O-N 3Å; K131-A133 VanDerWaalsContact C-N 3.3Å; K131-A133 PolarHBondContact O-N 3.24Å; A133-E135 VanDerWaalsContact C-N 3.34Å; A133-E135 PolarHBondContact O-N 3.46Å; A133-A136 PolarHBondContact O-N 3.01Å; A133-E137 WeakPolarHBondContact O-CG 3.47Å; A133-E137 PolarHBondContact O-N 3.25Å
134	E	79.3	Confident	75.6	Confident	95 Å²	95	115.3 Å²	115.3	44%	0.444	57%	0.569	S	S	.	*	H	α-helix	trans	-63.1	-40	176.6	-167.2	-166.8	164.5	0	0	111.5	E130 K131 E137 K138	E130-E134 WeakPolarHBondContact O-CB 3.41Å; E130-E134 PolarHBondContact O-N 3.04Å; K131-E134 PolarHBondContact O-N 3.45Å; E134-E137 PolarHBondContact O-N 3.09Å; E134-K138 HydrophobicContact CG-CD 4.44Å; E134-K138 WeakPolarHBondContact O-CB 3.38Å; E134-K138 VanDerWaalsContact O-CG 3.28Å; E134-K138 WeakPolarHBondContact O-CG 3.29Å; E134-K138 PolarHBondContact O-N 2.84Å; E134-K138 WeakPolarHBondContact OE1-CE 3.45Å; E134-K138 IonicContact OE1-NZ 3.98Å; E134-K138 PolarHBondContact OE1-NZ 3.43Å
135	E	77.3	Confident	75	Confident	101 Å²	101	113.9 Å²	113.9	47%	0.472	57%	0.569	S	S	.	*	H	α-helix	trans	-65.3	-41.5	174.1	-74.3	179	-169.6	0	0	111.5	K131 A133 E137 K138 V139	K131-E135 VanDerWaalsContact CE-OE1 3.3Å; K131-E135 WeakPolarHBondContact CE-OE1 3.28Å; K131-E135 WeakPolarHBondContact O-CB 3.43Å; K131-E135 WeakPolarHBondContact O-CG 3.2Å; K131-E135 PolarHBondContact O-N 3.17Å; A133-E135 VanDerWaalsContact C-N 3.34Å; A133-E135 PolarHBondContact O-N 3.46Å; E135-E137 VanDerWaalsContact C-N 3.33Å; E135-E137 PolarHBondContact O-N 2.69Å; E135-K138 PolarHBondContact O-N 2.92Å; E135-V139 VanDerWaalsContact O-CG2 3.27Å; E135-V139 WeakPolarHBondContact O-CG2 3.45Å; E135-V139 PolarHBondContact O-N 3.46Å
136	A	78.4	Confident	74.2	Confident	46 Å²	46	114 Å²	114	38%	0.38	58%	0.576	S	S	.	*	H	α-helix	trans	-64.8	-36.7	175.1	0	0	0	0	0	112.3	E132 A133 K140	E132-A136 WeakPolarHBondContact O-CB 3.24Å; E132-A136 PolarHBondContact O-N 3.05Å; A133-A136 PolarHBondContact O-N 3.01Å; A136-K140 VanDerWaalsContact O-CG 3.28Å; A136-K140 WeakPolarHBondContact O-CG 3.47Å; A136-K140 PolarHBondContact O-N 2.84Å
137	E	77.5	Confident	74	Confident	136 Å²	136	110.7 Å²	110.7	64%	0.636	57%	0.568	S	S	*	*	H	α-helix	trans	-68.1	-44.5	172.4	-75.3	-170.1	153.4	0	0	111.9	A133 E134 E135 V139 K140 F141	A133-E137 WeakPolarHBondContact O-CG 3.47Å; A133-E137 PolarHBondContact O-N 3.25Å; E134-E137 PolarHBondContact O-N 3.09Å; E135-E137 VanDerWaalsContact C-N 3.33Å; E135-E137 PolarHBondContact O-N 2.69Å; E137-V139 VanDerWaalsContact C-N 3.3Å; E137-V139 PolarHBondContact O-N 3.06Å; E137-K140 CarbonylContact O-C 3.37Å; E137-K140 PolarHBondContact O-N 3.09Å; E137-K140 VanDerWaalsContact O-N 3.14Å; E137-F141 VanDerWaalsContact O-CB 3.28Å; E137-F141 WeakPolarHBondContact O-CB 3.35Å; E137-F141 PolarHBondContact O-N 3.34Å
138	K	72.4	Confident	73.8	Confident	104 Å²	104	111.8 Å²	111.8	45%	0.452	57%	0.573	S	S	.	*	H	α-helix	trans	-59.5	-39.7	175	-77.3	172.5	-177.4	167.8	0	112.2	E134 E135 F141 Q142	E134-K138 HydrophobicContact CG-CD 4.44Å; E134-K138 WeakPolarHBondContact O-CB 3.38Å; E134-K138 VanDerWaalsContact O-CG 3.28Å; E134-K138 WeakPolarHBondContact O-CG 3.29Å; E134-K138 PolarHBondContact O-N 2.84Å; E134-K138 WeakPolarHBondContact OE1-CE 3.45Å; E134-K138 IonicContact OE1-NZ 3.98Å; E134-K138 PolarHBondContact OE1-NZ 3.43Å; E135-K138 PolarHBondContact O-N 2.92Å; K138-F141 PolarHBondContact O-N 3.34Å; K138-Q142 WeakPolarHBondContact O-CB 3.49Å; K138-Q142 VanDerWaalsContact O-CG 3.29Å; K138-Q142 WeakPolarHBondContact O-CG 3.49Å; K138-Q142 PolarHBondContact O-N 3.29Å
139	V	71.9	Confident	73.7	Confident	105 Å²	105	113 Å²	113	64%	0.636	59%	0.585	S	S	*	*	H	α-helix	trans	-68.6	-38.2	176.1	171.8	0	0	0	0	111.4	E135 E137 F141	E135-V139 VanDerWaalsContact O-CG2 3.27Å; E135-V139 WeakPolarHBondContact O-CG2 3.45Å; E135-V139 PolarHBondContact O-N 3.46Å; E137-V139 VanDerWaalsContact C-N 3.3Å; E137-V139 PolarHBondContact O-N 3.06Å; V139-F141 VanDerWaalsContact C-N 3.35Å
140	K	68.1	Low	73.6	Confident	177 Å²	177	107.4 Å²	107.4	77%	0.77	56%	0.562	S	S	*	*	H	α-helix	trans	-68.7	-33.8	174	-74.2	173.4	-176.2	177.4	0	112.5	A136 E137	A136-K140 VanDerWaalsContact O-CG 3.28Å; A136-K140 WeakPolarHBondContact O-CG 3.47Å; A136-K140 PolarHBondContact O-N 2.84Å; E137-K140 CarbonylContact O-C 3.37Å; E137-K140 PolarHBondContact O-N 3.09Å; E137-K140 VanDerWaalsContact O-N 3.14Å
141	F	57.9	Low	73.6	Confident	189 Å²	189	107.8 Å²	107.8	83%	0.829	56%	0.562	S	S	*	*	H	α-helix	trans	-80.3	-28.8	-178.7	-167.5	-98.6	0	0	0	112.8	E137 K138 V139 G143	E137-F141 VanDerWaalsContact O-CB 3.28Å; E137-F141 WeakPolarHBondContact O-CB 3.35Å; E137-F141 PolarHBondContact O-N 3.34Å; K138-F141 PolarHBondContact O-N 3.34Å; V139-F141 VanDerWaalsContact C-N 3.35Å; F141-G143 VanDerWaalsContact C-N 3.33Å; F141-G143 PolarHBondContact O-N 2.98Å
142	Q	55.8	Low	73.9	Confident	145 Å²	145	106.4 Å²	106.4	68%	0.678	56%	0.56	S	S	*	*	S	Bend	trans	-69.3	92.6	168.8	-74.1	176.3	36.8	0	0	109.2	K138	K138-Q142 WeakPolarHBondContact O-CB 3.49Å; K138-Q142 VanDerWaalsContact O-CG 3.29Å; K138-Q142 WeakPolarHBondContact O-CG 3.49Å; K138-Q142 PolarHBondContact O-N 3.29Å
143	G	66.8	Low	74.1	Confident	56 Å²	56	103.7 Å²	103.7	58%	0.577	56%	0.556	S	S	*	*			trans	-54	168.8	170	0	0	0	0	0	112.2	F141 V145	F141-G143 VanDerWaalsContact C-N 3.33Å; F141-G143 PolarHBondContact O-N 2.98Å; G143-V145 PolarHBondContact O-N 3.05Å
144	T	69	Low	74.4	Confident	100 Å²	100	106.8 Å²	106.8	61%	0.613	56%	0.556	S	S	*	*			trans	-70.3	105.8	-179	-34.2	0	0	0	0	110.1	V146 N150	T144-V146 PolarHBondContact O-N 3.27Å; T144-N150 WeakPolarHBondContact CG2-ND2 3.35Å
145	V	67.1	Low	74.8	Confident	110 Å²	110	106.5 Å²	106.5	67%	0.667	55%	0.554	S	S	*	*			trans	-54.7	134.9	173.4	-75.3	0	0	0	0	110.1	G143 T147 N150	G143-V145 PolarHBondContact O-N 3.05Å; V145-T147 VanDerWaalsContact C-N 3.26Å; V145-T147 HydrophobicContact CG2-CG2 3.93Å; V145-T147 PolarHBondContact O-N 3.4Å; V145-N150 PolarHBondContact O-ND2 3.45Å
146	V	65.1	Low	75.4	Confident	101 Å²	101	104.3 Å²	104.3	61%	0.612	55%	0.553	S	S	*	*			trans	-76.2	81.7	178.9	-173.3	0	0	0	0	108.6	T144 F151 W154	T144-V146 PolarHBondContact O-N 3.27Å; V146-F151 HydrophobicContact CG1-CB 4.1Å; V146-F151 HydrophobicContact CG1-CD2 4.37Å; V146-W154 HydrophobicContact CG1-CZ3 4.49Å; V146-W154 HydrophobicContact CG2-CH2 4.22Å; V146-W154 HydrophobicContact CG2-CZ3 3.81Å
147	T	77.1	Confident	75.9	Confident	67 Å²	67	109.8 Å²	109.8	41%	0.411	57%	0.568	S	S	.	*			trans	-81.8	159.5	169.7	64.6	0	0	0	0	110.3	V145 E149 N150 F151	V145-T147 VanDerWaalsContact C-N 3.26Å; V145-T147 HydrophobicContact CG2-CG2 3.93Å; V145-T147 PolarHBondContact O-N 3.4Å; T147-E149 PolarHBondContact O-N 3.41Å; T147-N150 PolarHBondContact O-N 2.78Å; T147-N150 VanDerWaalsContact O-N 3.14Å; T147-N150 WeakPolarHBondContact OG1-CB 3.47Å; T147-N150 PolarHBondContact OG1-N 3.09Å; T147-F151 WeakPolarHBondContact O-CB 3.42Å; T147-F151 PolarHBondContact O-N 3.47Å
148	I	79.6	Confident	76.6	Confident	138 Å²	138	109.4 Å²	109.4	71%	0.708	57%	0.565	S	S	*	*	H	α-helix	trans	-56.2	-40.3	179.7	-62.7	172.6	0	0	0	110.9	L152	I148-L152 HydrophobicContact CG2-CD1 4.04Å; I148-L152 HydrophobicContact CG2-CG 4.49Å; I148-L152 WeakPolarHBondContact O-CB 3.46Å; I148-L152 VanDerWaalsContact O-CG 3.22Å; I148-L152 WeakPolarHBondContact O-CG 3.21Å; I148-L152 PolarHBondContact O-N 3.41Å
149	E	78.6	Confident	77.3	Confident	162 Å²	162	109.3 Å²	109.3	76%	0.757	57%	0.566	S	S	*	*	H	α-helix	trans	-67.3	-42.9	178.5	-61.6	-175.8	155.1	0	0	112.1	T147 L152 A153	T147-E149 PolarHBondContact O-N 3.41Å; E149-L152 PolarHBondContact O-N 2.86Å; E149-A153 PolarHBondContact O-N 3.04Å
150	N	80	Confident	78.1	Confident	33 Å²	33	109.6 Å²	109.6	18%	0.176	56%	0.563	C	S	.	*	H	α-helix	trans	-68.3	-40.4	178.4	-165.8	36.1	0	0	0	111.4	T144 V145 T147 A153 W154	T144-N150 WeakPolarHBondContact CG2-ND2 3.35Å; V145-N150 PolarHBondContact O-ND2 3.45Å; T147-N150 PolarHBondContact O-N 2.78Å; T147-N150 VanDerWaalsContact O-N 3.14Å; T147-N150 WeakPolarHBondContact OG1-CB 3.47Å; T147-N150 PolarHBondContact OG1-N 3.09Å; N150-A153 PolarHBondContact O-N 3.04Å; N150-W154 WeakPolarHBondContact ND2-CZ2 3.21Å; N150-W154 WeakPolarHBondContact O-CB 3.36Å; N150-W154 VanDerWaalsContact O-CG 3.26Å; N150-W154 PolarHBondContact O-N 3.4Å; N150-W154 PolarHBondContact OD1-NE1 3.42Å
151	F	82.2	Confident	79.1	Confident	110 Å²	110	107.6 Å²	107.6	48%	0.482	56%	0.557	S	S	.	*	H	α-helix	trans	-62	-42.4	172.8	178.7	-100.4	0	0	0	112.2	V146 T147 W154 K155	V146-F151 HydrophobicContact CG1-CB 4.1Å; V146-F151 HydrophobicContact CG1-CD2 4.37Å; T147-F151 WeakPolarHBondContact O-CB 3.42Å; T147-F151 PolarHBondContact O-N 3.47Å; F151-W154 PolarHBondContact O-N 3.29Å; F151-K155 HydrophobicContact CE1-CD 4.14Å; F151-K155 WeakPolarHBondContact O-CB 3.4Å; F151-K155 PolarHBondContact O-N 3.06Å
152	L	86.1	Confident	80.4	Confident	97 Å²	97	101.6 Å²	101.6	51%	0.508	53%	0.532	S	S	.	.	H	α-helix	trans	-64.9	-39.5	175.8	-74.9	170.9	0	0	0	111.9	I148 E149 K155 A156	I148-L152 HydrophobicContact CG2-CD1 4.04Å; I148-L152 HydrophobicContact CG2-CG 4.49Å; I148-L152 WeakPolarHBondContact O-CB 3.46Å; I148-L152 VanDerWaalsContact O-CG 3.22Å; I148-L152 WeakPolarHBondContact O-CG 3.21Å; I148-L152 PolarHBondContact O-N 3.41Å; E149-L152 PolarHBondContact O-N 2.86Å; L152-K155 PolarHBondContact O-N 2.9Å; L152-A156 VanDerWaalsContact O-CB 3.29Å; L152-A156 WeakPolarHBondContact O-CB 3.45Å; L152-A156 PolarHBondContact O-N 3.29Å
153	A	85.6	Confident	81.8	Confident	52 Å²	52	97.4 Å²	97.4	43%	0.43	52%	0.522	S	S	.	.	H	α-helix	trans	-64.5	-42.7	174.6	0	0	0	0	0	111.9	E149 N150 A156 K157	E149-A153 PolarHBondContact O-N 3.04Å; N150-A153 PolarHBondContact O-N 3.04Å; A153-A156 PolarHBondContact O-N 3.11Å; A153-K157 PolarHBondContact O-N 2.8Å
154	W	86.3	Confident	82.5	Confident	118 Å²	118	99.4 Å²	99.4	45%	0.447	52%	0.516	S	S	.	.	H	α-helix	trans	-64.7	-44.6	174.1	-69.3	-6.2	0	0	0	112	V146 N150 F151 A156 K157 F158	V146-W154 HydrophobicContact CG1-CZ3 4.49Å; V146-W154 HydrophobicContact CG2-CH2 4.22Å; V146-W154 HydrophobicContact CG2-CZ3 3.81Å; N150-W154 WeakPolarHBondContact ND2-CZ2 3.21Å; N150-W154 WeakPolarHBondContact O-CB 3.36Å; N150-W154 VanDerWaalsContact O-CG 3.26Å; N150-W154 PolarHBondContact O-N 3.4Å; N150-W154 PolarHBondContact OD1-NE1 3.42Å; F151-W154 PolarHBondContact O-N 3.29Å; W154-A156 VanDerWaalsContact C-N 3.33Å; W154-A156 PolarHBondContact O-N 2.61Å; W154-K157 PolarHBondContact O-N 3.43Å; W154-F158 WeakPolarHBondContact O-CB 3.4Å; W154-F158 PolarHBondContact O-N 2.82Å
155	K	88.3	Confident	83	Confident	90 Å²	90	100.9 Å²	100.9	39%	0.391	51%	0.514	S	S	.	.	H	α-helix	trans	-59.8	-43	175.4	-178.5	175.5	-178.2	-73	0	111.4	F151 L152 F158 E159	F151-K155 HydrophobicContact CE1-CD 4.14Å; F151-K155 WeakPolarHBondContact O-CB 3.4Å; F151-K155 PolarHBondContact O-N 3.06Å; L152-K155 PolarHBondContact O-N 2.9Å; K155-F158 PolarHBondContact O-N 2.89Å; K155-E159 WeakPolarHBondContact CE-OE1 3.39Å; K155-E159 HydrophobicContact CG-CG 4.41Å; K155-E159 IonicContact NZ-OE1 3.05Å; K155-E159 PolarHBondContact NZ-OE1 2.85Å; K155-E159 IonicContact NZ-OE2 3.97Å; K155-E159 WeakPolarHBondContact O-CB 3.38Å; K155-E159 WeakPolarHBondContact O-CG 3.25Å; K155-E159 PolarHBondContact O-N 2.86Å
156	A	89.1	Confident	83.6	Confident	54 Å²	54	103.4 Å²	103.4	45%	0.446	51%	0.512	S	S	.	.	H	α-helix	trans	-64.1	-43.4	177.4	0	0	0	0	0	111.9	L152 A153 W154 L160	L152-A156 VanDerWaalsContact O-CB 3.29Å; L152-A156 WeakPolarHBondContact O-CB 3.45Å; L152-A156 PolarHBondContact O-N 3.29Å; A153-A156 PolarHBondContact O-N 3.11Å; W154-A156 VanDerWaalsContact C-N 3.33Å; W154-A156 PolarHBondContact O-N 2.61Å; A156-L160 VanDerWaalsContact O-CB 3.28Å; A156-L160 WeakPolarHBondContact O-CB 3.25Å; A156-L160 PolarHBondContact O-N 3.48Å
157	K	88.9	Confident	84.5	Confident	161 Å²	161	104.9 Å²	104.9	70%	0.7	51%	0.506	S	S	*	.	H	α-helix	trans	-61.4	-45.9	173.3	-81.5	-173	176.9	-178.3	0	111.8	A153 W154 L160 E161	A153-K157 PolarHBondContact O-N 2.8Å; W154-K157 PolarHBondContact O-N 3.43Å; K157-L160 WeakPolarHBondContact O-CB 3.24Å; K157-L160 PolarHBondContact O-N 2.97Å; K157-E161 WeakPolarHBondContact O-CB 3.32Å; K157-E161 PolarHBondContact O-N 2.84Å
158	F	92.3	Very high	84.6	Confident	129 Å²	129	108.7 Å²	108.7	57%	0.566	52%	0.517	S	S	*	.	H	α-helix	trans	-63.2	-43.7	179.1	179.4	-98.6	0	0	0	112.5	W154 K155 L160 E161 M162	W154-F158 WeakPolarHBondContact O-CB 3.4Å; W154-F158 PolarHBondContact O-N 2.82Å; K155-F158 PolarHBondContact O-N 2.89Å; F158-L160 VanDerWaalsContact C-N 3.3Å; F158-L160 PolarHBondContact O-N 2.91Å; F158-E161 PolarHBondContact O-N 2.9Å; F158-M162 HydrophobicContact CD1-CG 4.35Å; F158-M162 HydrophobicContact CE1-CG 3.86Å; F158-M162 HydrophobicContact CE2-CG 4.13Å; F158-M162 HydrophobicContact CZ-CG 3.74Å; F158-M162 WeakPolarHBondContact O-CB 3.43Å; F158-M162 PolarHBondContact O-N 2.87Å
159	E	88.7	Confident	84.5	Confident	102 Å²	102	107.4 Å²	107.4	48%	0.477	51%	0.506	S	S	.	.	H	α-helix	trans	-64.2	-37.3	176.3	-76.6	177.9	172.7	0	0	111.7	K155 A163	K155-E159 WeakPolarHBondContact CE-OE1 3.39Å; K155-E159 HydrophobicContact CG-CG 4.41Å; K155-E159 IonicContact NZ-OE1 3.05Å; K155-E159 PolarHBondContact NZ-OE1 2.85Å; K155-E159 IonicContact NZ-OE2 3.97Å; K155-E159 WeakPolarHBondContact O-CB 3.38Å; K155-E159 WeakPolarHBondContact O-CG 3.25Å; K155-E159 PolarHBondContact O-N 2.86Å; E159-A163 VanDerWaalsContact O-CB 3.24Å; E159-A163 WeakPolarHBondContact O-CB 3.45Å; E159-A163 PolarHBondContact O-N 3.44Å
160	L	88.3	Confident	84	Confident	110 Å²	110	105.4 Å²	105.4	58%	0.576	50%	0.497	S	S	*	.	H	α-helix	trans	-66.6	-47.4	175.6	-161.5	161.6	0	0	0	110.9	A156 K157 F158 M162 A163 E164	A156-L160 VanDerWaalsContact O-CB 3.28Å; A156-L160 WeakPolarHBondContact O-CB 3.25Å; A156-L160 PolarHBondContact O-N 3.48Å; K157-L160 WeakPolarHBondContact O-CB 3.24Å; K157-L160 PolarHBondContact O-N 2.97Å; F158-L160 VanDerWaalsContact C-N 3.3Å; F158-L160 PolarHBondContact O-N 2.91Å; L160-M162 PolarHBondContact O-N 2.81Å; L160-A163 PolarHBondContact O-N 2.8Å; L160-E164 HydrophobicContact CD2-CG 4.19Å; L160-E164 PolarHBondContact O-N 2.86Å
161	E	87.8	Confident	83.6	Confident	136 Å²	136	109.2 Å²	109.2	64%	0.636	51%	0.512	S	S	*	.	H	α-helix	trans	-62.3	-43.2	177.1	-171.9	176.8	176.8	0	0	111.8	K157 F158 A163 E164 F165	K157-E161 WeakPolarHBondContact O-CB 3.32Å; K157-E161 PolarHBondContact O-N 2.84Å; F158-E161 PolarHBondContact O-N 2.9Å; E161-A163 VanDerWaalsContact C-N 3.35Å; E161-A163 PolarHBondContact O-N 3Å; E161-E164 PolarHBondContact O-N 3.14Å; E161-F165 WeakPolarHBondContact O-CB 3.46Å; E161-F165 PolarHBondContact O-N 3.12Å
162	M	85.6	Confident	82.8	Confident	63 Å²	63	110 Å²	110	31%	0.31	52%	0.517	S	S	.	.	H	α-helix	trans	-65.9	-36.2	175.2	-84.1	-57.8	-60.2	0	0	112.8	F158 L160 R166	F158-M162 HydrophobicContact CD1-CG 4.35Å; F158-M162 HydrophobicContact CE1-CG 3.86Å; F158-M162 HydrophobicContact CE2-CG 4.13Å; F158-M162 HydrophobicContact CZ-CG 3.74Å; F158-M162 WeakPolarHBondContact O-CB 3.43Å; F158-M162 PolarHBondContact O-N 2.87Å; L160-M162 PolarHBondContact O-N 2.81Å; M162-R166 WeakPolarHBondContact O-CB 3.29Å; M162-R166 VanDerWaalsContact O-CG 3.22Å; M162-R166 WeakPolarHBondContact O-CG 3.43Å; M162-R166 PolarHBondContact O-N 2.84Å
163	A	84.8	Confident	81.8	Confident	57 Å²	57	111 Å²	111	47%	0.471	52%	0.519	S	S	.	.	H	α-helix	trans	-66.9	-40.4	174	0	0	0	0	0	111.2	E159 L160 E161 R166 R167	E159-A163 VanDerWaalsContact O-CB 3.24Å; E159-A163 WeakPolarHBondContact O-CB 3.45Å; E159-A163 PolarHBondContact O-N 3.44Å; L160-A163 PolarHBondContact O-N 2.8Å; E161-A163 VanDerWaalsContact C-N 3.35Å; E161-A163 PolarHBondContact O-N 3Å; A163-R166 PolarHBondContact O-N 2.97Å; A163-R167 VanDerWaalsContact O-CB 3.27Å; A163-R167 WeakPolarHBondContact O-CB 3.09Å; A163-R167 PolarHBondContact O-N 2.96Å
164	E	82.2	Confident	80.7	Confident	98 Å²	98	116.2 Å²	116.2	46%	0.458	54%	0.535	S	S	.	.	H	α-helix	trans	-66.5	-41.7	174.1	-74.1	-147.5	127	0	0	112.5	L160 E161 R167 K168	L160-E164 HydrophobicContact CD2-CG 4.19Å; L160-E164 PolarHBondContact O-N 2.86Å; E161-E164 PolarHBondContact O-N 3.14Å; E164-R167 PolarHBondContact O-N 3.12Å; E164-R167 IonicContact OE1-CZ 3.84Å; E164-R167 IonicContact OE1-NH2 2.92Å; E164-R167 PolarHBondContact OE1-NH2 3.35Å; E164-K168 VanDerWaalsContact O-CB 3.31Å; E164-K168 WeakPolarHBondContact O-CB 3.47Å; E164-K168 PolarHBondContact O-N 2.88Å
165	F	79.8	Confident	79.4	Confident	130 Å²	130	118.8 Å²	118.8	57%	0.57	55%	0.552	S	S	*	*	H	α-helix	trans	-60.7	-45.8	174.9	-173.1	-95.5	0	0	0	111.3	E161 K168 K169	E161-F165 WeakPolarHBondContact O-CB 3.46Å; E161-F165 PolarHBondContact O-N 3.12Å; F165-K168 PolarHBondContact O-N 3.37Å; F165-K169 WeakPolarHBondContact O-CB 3.22Å; F165-K169 PolarHBondContact O-N 2.91Å
166	R	80.6	Confident	78.1	Confident	163 Å²	163	116.8 Å²	116.8	62%	0.615	55%	0.552	S	S	*	*	H	α-helix	trans	-62.9	-42.7	174.9	-73.5	175.6	-172.4	-153.3	4	112.1	M162 A163 K168 K169 Q170	M162-R166 WeakPolarHBondContact O-CB 3.29Å; M162-R166 VanDerWaalsContact O-CG 3.22Å; M162-R166 WeakPolarHBondContact O-CG 3.43Å; M162-R166 PolarHBondContact O-N 2.84Å; A163-R166 PolarHBondContact O-N 2.97Å; R166-K168 VanDerWaalsContact C-N 3.33Å; R166-K168 PolarHBondContact O-N 2.89Å; R166-K169 PolarHBondContact O-N 2.99Å; R166-Q170 WeakPolarHBondContact O-CB 3.46Å; R166-Q170 WeakPolarHBondContact O-CG 3.26Å; R166-Q170 PolarHBondContact O-N 3.39Å
167	R	82.6	Confident	76.5	Confident	132 Å²	132	117.8 Å²	117.8	50%	0.498	57%	0.568	S	S	.	*	H	α-helix	trans	-64.1	-38.9	176.8	-170.3	-176.1	73.4	-169.3	-7.3	111.6	A163 E164 K171	A163-R167 VanDerWaalsContact O-CB 3.27Å; A163-R167 WeakPolarHBondContact O-CB 3.09Å; A163-R167 PolarHBondContact O-N 2.96Å; E164-R167 PolarHBondContact O-N 3.12Å; E164-R167 IonicContact OE1-CZ 3.84Å; E164-R167 IonicContact OE1-NH2 2.92Å; E164-R167 PolarHBondContact OE1-NH2 3.35Å; R167-K171 WeakPolarHBondContact O-CG 3.28Å; R167-K171 PolarHBondContact O-N 3.18Å; R167-K171 VanDerWaalsContact O-N 3.1Å
168	K	80.4	Confident	75.1	Confident	148 Å²	148	118.7 Å²	118.7	64%	0.643	57%	0.572	S	S	*	*	H	α-helix	trans	-68.5	-45.5	177.3	-166.4	177.1	179.6	-176	0	110.7	E164 F165 R166 Q170 K171 E172	E164-K168 VanDerWaalsContact O-CB 3.31Å; E164-K168 WeakPolarHBondContact O-CB 3.47Å; E164-K168 PolarHBondContact O-N 2.88Å; F165-K168 PolarHBondContact O-N 3.37Å; R166-K168 VanDerWaalsContact C-N 3.33Å; R166-K168 PolarHBondContact O-N 2.89Å; K168-Q170 PolarHBondContact O-N 3.42Å; K168-K171 PolarHBondContact O-N 2.89Å; K168-E172 VanDerWaalsContact O-CB 3.32Å; K168-E172 WeakPolarHBondContact O-CB 3.48Å; K168-E172 PolarHBondContact O-N 3.42Å
169	K	76.3	Confident	73.6	Confident	110 Å²	110	118.3 Å²	118.3	48%	0.478	58%	0.583	S	S	.	*	H	α-helix	trans	-59.7	-43.9	175.2	-170.9	-179.9	178.2	-174	0	112.3	F165 R166 E172 E173	F165-K169 WeakPolarHBondContact O-CB 3.22Å; F165-K169 PolarHBondContact O-N 2.91Å; R166-K169 PolarHBondContact O-N 2.99Å; K169-E172 PolarHBondContact O-N 3.31Å; K169-E173 WeakPolarHBondContact CE-OE1 3.38Å; K169-E173 IonicContact NZ-OE1 2.61Å; K169-E173 WeakPolarHBondContact O-CB 3.48Å; K169-E173 WeakPolarHBondContact O-CG 3.42Å; K169-E173 PolarHBondContact O-N 2.92Å
170	Q	68.6	Low	72.4	Confident	121 Å²	121	124.8 Å²	124.8	57%	0.565	60%	0.603	S	S	*	*	H	α-helix	trans	-63.8	-43.1	176.4	-75.9	175.2	-9.7	0	0	112.3	R166 K168 E172 E173 E174	R166-Q170 WeakPolarHBondContact O-CB 3.46Å; R166-Q170 WeakPolarHBondContact O-CG 3.26Å; R166-Q170 PolarHBondContact O-N 3.39Å; K168-Q170 PolarHBondContact O-N 3.42Å; Q170-E172 VanDerWaalsContact C-N 3.32Å; Q170-E172 PolarHBondContact O-N 3.29Å; Q170-E173 PolarHBondContact O-N 2.91Å; Q170-E174 WeakPolarHBondContact O-CB 3.37Å; Q170-E174 WeakPolarHBondContact O-CG 3.5Å; Q170-E174 PolarHBondContact O-N 2.94Å
171	K	72.3	Confident	71.1	Confident	112 Å²	112	123.5 Å²	123.5	49%	0.487	60%	0.596	S	S	.	*	H	α-helix	trans	-66.3	-34	175.6	-74.4	-179.5	177.7	-172.5	0	112.8	R167 K168 Q175	R167-K171 WeakPolarHBondContact O-CG 3.28Å; R167-K171 PolarHBondContact O-N 3.18Å; R167-K171 VanDerWaalsContact O-N 3.1Å; K168-K171 PolarHBondContact O-N 2.89Å; K171-Q175 WeakPolarHBondContact O-CB 3.23Å; K171-Q175 WeakPolarHBondContact O-CG 3.44Å; K171-Q175 PolarHBondContact O-N 2.85Å
172	E	65.5	Low	70.4	Confident	126 Å²	126	120.6 Å²	120.6	59%	0.589	59%	0.587	S	S	*	*	H	α-helix	trans	-72.7	-39	176.5	-166.8	174	171.8	0	0	111.5	K168 K169 Q170 Q175 A176	K168-E172 VanDerWaalsContact O-CB 3.32Å; K168-E172 WeakPolarHBondContact O-CB 3.48Å; K168-E172 PolarHBondContact O-N 3.42Å; K169-E172 PolarHBondContact O-N 3.31Å; Q170-E172 VanDerWaalsContact C-N 3.32Å; Q170-E172 PolarHBondContact O-N 3.29Å; E172-Q175 PolarHBondContact O-N 3.4Å; E172-A176 WeakPolarHBondContact O-CB 3.06Å; E172-A176 PolarHBondContact O-N 2.95Å
173	E	63.7	Low	69.3	Low	118 Å²	118	120.6 Å²	120.6	55%	0.551	60%	0.603	S	S	*	*	H	α-helix	trans	-66.4	-35.2	171.3	-76.3	174.8	173.6	0	0	112.3	K169 Q170	K169-E173 WeakPolarHBondContact CE-OE1 3.38Å; K169-E173 IonicContact NZ-OE1 2.61Å; K169-E173 WeakPolarHBondContact O-CB 3.48Å; K169-E173 WeakPolarHBondContact O-CG 3.42Å; K169-E173 PolarHBondContact O-N 2.92Å; Q170-E173 PolarHBondContact O-N 2.91Å
174	E	63.3	Low	68.7	Low	162 Å²	162	124.9 Å²	124.9	76%	0.757	61%	0.612	S	S	*	*	H	α-helix	trans	-73.1	-32.7	173.9	-77.8	179.8	159.9	0	0	113	Q170	Q170-E174 WeakPolarHBondContact O-CB 3.37Å; Q170-E174 WeakPolarHBondContact O-CG 3.5Å; Q170-E174 PolarHBondContact O-N 2.94Å
175	Q	59.4	Low	68.1	Low	173 Å²	173	124.6 Å²	124.6	81%	0.808	61%	0.61	S	S	*	*	H	α-helix	trans	-83.3	-32.9	177.1	-76.9	-178.4	19.6	0	0	113.2	K171 E172 G177	K171-Q175 WeakPolarHBondContact O-CB 3.23Å; K171-Q175 WeakPolarHBondContact O-CG 3.44Å; K171-Q175 PolarHBondContact O-N 2.85Å; E172-Q175 PolarHBondContact O-N 3.4Å; Q175-G177 VanDerWaalsContact C-N 3.27Å; Q175-G177 PolarHBondContact O-N 3.13Å
176	A	59.4	Low	67.5	Low	47 Å²	47	122.8 Å²	122.8	39%	0.388	61%	0.606	S	S	.	*	S	Bend	trans	-83.1	73.5	171.9	0	0	0	0	0	109	E172 K178	E172-A176 WeakPolarHBondContact O-CB 3.06Å; E172-A176 PolarHBondContact O-N 2.95Å; A176-K178 CarbonylContact O-C 3.5Å; A176-K178 PolarHBondContact O-N 3Å
177	G	56.3	Low	66.6	Low	76 Å²	76	122.2 Å²	122.2	78%	0.784	61%	0.608	S	S	*	*	S	Bend	trans	-58	13.2	-179	0	0	0	0	0	116.9	Q175	Q175-G177 VanDerWaalsContact C-N 3.27Å; Q175-G177 PolarHBondContact O-N 3.13Å
178	K	59.4	Low	65.8	Low	179 Å²	179	122.4 Å²	122.4	78%	0.778	62%	0.615	S	S	*	*	S	Bend	trans	-138.7	127.8	160.2	-65.7	-177.4	-178.7	179.6	0	108.2	A176 R180	A176-K178 CarbonylContact O-C 3.5Å; A176-K178 PolarHBondContact O-N 3Å; K178-R180 PolarHBondContact O-N 2.83Å
179	P	60.9	Low	65.1	Low	122 Å²	122	125.4 Å²	125.4	79%	0.792	62%	0.622	S	S	*	*			trans	-64.2	113.4	-178.6	26.4	-32.5	0	0	0	109.2	L181	P179-L181 PolarHBondContact O-N 2.84Å; P179-L181 VanDerWaalsContact O-N 3.15Å
180	R	62.9	Low	64.2	Low	238 Å²	238	123.9 Å²	123.9	90%	0.898	62%	0.619	S	S	*	*			trans	-66.2	109.7	160.4	-76.2	-173.6	172	-171	-2.5	106	K178 T182	K178-R180 PolarHBondContact O-N 2.83Å; R180-T182 PolarHBondContact O-N 2.92Å
181	L	62.2	Low	63.8	Low	82 Å²	82	124.8 Å²	124.8	43%	0.429	62%	0.623	S	S	.	*			trans	-54.1	134.3	175.3	-73.3	157.6	0	0	0	108.6	P179 Q185 L186	P179-L181 PolarHBondContact O-N 2.84Å; P179-L181 VanDerWaalsContact O-N 3.15Å; L181-Q185 HydrophobicContact CB-CB 4.25Å; L181-Q185 HydrophobicContact CD2-CB 3.9Å; L181-L186 HydrophobicContact CB-CD1 3.99Å; L181-L186 HydrophobicContact CD1-CD1 4.4Å
182	T	72.1	Confident	63.1	Low	75 Å²	75	124.7 Å²	124.7	46%	0.46	63%	0.628	S	S	.	*			trans	-64.3	154.9	175.1	67.2	0	0	0	0	109.4	R180 K184 Q185 L186	R180-T182 PolarHBondContact O-N 2.92Å; T182-K184 PolarHBondContact O-N 2.85Å; T182-K184 VanDerWaalsContact O-N 3.1Å; T182-Q185 WeakPolarHBondContact O-CA 3.32Å; T182-Q185 WeakPolarHBondContact O-CB 3.5Å; T182-Q185 PolarHBondContact O-N 2.84Å; T182-Q185 VanDerWaalsContact OG1-CG 3.27Å; T182-Q185 WeakPolarHBondContact OG1-CG 3.46Å; T182-Q185 PolarHBondContact OG1-N 2.57Å; T182-Q185 PolarHBondContact OG1-OE1 2.89Å; T182-L186 PolarHBondContact O-N 3.22Å
183	G	63.8	Low	62.7	Low	63 Å²	63	122.7 Å²	122.7	65%	0.649	62%	0.621	S	S	*	*	H	α-helix	trans	-52.3	-37.5	-179.3	0	0	0	0	0	113.1	L186 F187	G183-L186 PolarHBondContact O-N 3.1Å; G183-F187 PolarHBondContact O-N 3.16Å
184	K	70.6	Confident	62.3	Low	148 Å²	148	121.6 Å²	121.6	64%	0.643	62%	0.619	S	S	*	*	H	α-helix	trans	-63.1	-42.3	172.6	-175.9	175.1	176	176.9	0	113.3	T182 F187 E188	T182-K184 PolarHBondContact O-N 2.85Å; T182-K184 VanDerWaalsContact O-N 3.1Å; K184-F187 PolarHBondContact O-N 3.21Å; K184-E188 WeakPolarHBondContact CE-OE1 3.32Å; K184-E188 WeakPolarHBondContact O-CG 3.13Å; K184-E188 PolarHBondContact O-N 2.58Å; K184-E188 VanDerWaalsContact O-N 3.13Å
185	Q	69.9	Low	61.8	Low	91 Å²	91	116.5 Å²	116.5	43%	0.425	60%	0.599	S	S	.	*	H	α-helix	trans	-73.9	-26.8	179.7	-71.6	171.9	-25.1	0	0	113.4	L181 T182 R189	L181-Q185 HydrophobicContact CB-CB 4.25Å; L181-Q185 HydrophobicContact CD2-CB 3.9Å; T182-Q185 WeakPolarHBondContact O-CA 3.32Å; T182-Q185 WeakPolarHBondContact O-CB 3.5Å; T182-Q185 PolarHBondContact O-N 2.84Å; T182-Q185 VanDerWaalsContact OG1-CG 3.27Å; T182-Q185 WeakPolarHBondContact OG1-CG 3.46Å; T182-Q185 PolarHBondContact OG1-N 2.57Å; T182-Q185 PolarHBondContact OG1-OE1 2.89Å; Q185-R189 PolarHBondContact O-N 3.23Å
186	L	68.1	Low	61.7	Low	92 Å²	92	110.6 Å²	110.6	48%	0.482	58%	0.576	S	S	.	*	H	α-helix	trans	-66.3	-42.8	172.7	-143.8	102.6	0	0	0	110.2	L181 T182 G183 D190	L181-L186 HydrophobicContact CB-CD1 3.99Å; L181-L186 HydrophobicContact CD1-CD1 4.4Å; T182-L186 PolarHBondContact O-N 3.22Å; G183-L186 PolarHBondContact O-N 3.1Å; L186-D190 PolarHBondContact O-N 2.84Å
187	F	60.7	Low	61.5	Low	151 Å²	151	113.7 Å²	113.7	66%	0.662	59%	0.586	S	S	*	*	H	α-helix	trans	-67.8	-39.1	179.7	-138.5	-93.4	0	0	0	113	G183 K184	G183-F187 PolarHBondContact O-N 3.16Å; K184-F187 PolarHBondContact O-N 3.21Å
188	E	66.8	Low	61.8	Low	137 Å²	137	115.2 Å²	115.2	64%	0.64	58%	0.575	S	S	*	*	H	α-helix	trans	-76.7	-21.2	-178.9	-72.2	174	179	0	0	114.2	K184	K184-E188 WeakPolarHBondContact CE-OE1 3.32Å; K184-E188 WeakPolarHBondContact O-CG 3.13Å; K184-E188 PolarHBondContact O-N 2.58Å; K184-E188 VanDerWaalsContact O-N 3.13Å
189	R	65.1	Low	61.7	Low	210 Å²	210	113 Å²	113	79%	0.792	57%	0.568	S	S	*	*	H	α-helix	trans	-96.1	-29.3	-179.6	-92.7	177.2	85.1	112.2	-4.1	114.1	Q185	Q185-R189 PolarHBondContact O-N 3.23Å
190	D	57.4	Low	61.7	Low	79 Å²	79	114.9 Å²	114.9	42%	0.422	56%	0.564	S	S	.	*			trans	-106.5	81.4	-176.3	-150.5	-16	0	0	0	109.8	L186 N192 L193	L186-D190 PolarHBondContact O-N 2.84Å; D190-N192 PolarHBondContact O-N 3.3Å; D190-N192 VanDerWaalsContact O-N 3.13Å; D190-N192 VanDerWaalsContact OD1-CB 3.3Å; D190-N192 WeakPolarHBondContact OD1-CB 3.47Å; D190-N192 PolarHBondContact OD1-N 3.41Å; D190-L193 HydrophobicContact CB-CD1 3.98Å; D190-L193 PolarHBondContact O-N 3.5Å
191	H	59.8	Low	61.5	Low	140 Å²	140	107.7 Å²	107.7	65%	0.648	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-6.2	174.5	-156.3	-49	0	0	0	112	L193 D194	H191-L193 VanDerWaalsContact C-N 3.3Å; H191-D194 IonicContact CE1-OD2 2.69Å
192	N	57.6	Low	61.2	Low	110 Å²	110	111.2 Å²	111.2	59%	0.588	56%	0.557	S	S	*	*	H	α-helix	trans	-80.6	-11.5	177.1	-154.5	42.4	0	0	0	112.9	D190 S196	D190-N192 PolarHBondContact O-N 3.3Å; D190-N192 VanDerWaalsContact O-N 3.13Å; D190-N192 VanDerWaalsContact OD1-CB 3.3Å; D190-N192 WeakPolarHBondContact OD1-CB 3.47Å; D190-N192 PolarHBondContact OD1-N 3.41Å; N192-S196 PolarHBondContact O-N 2.81Å
193	L	56.3	Low	60.3	Low	83 Å²	83	116.4 Å²	116.4	44%	0.435	58%	0.576	S	S	.	*	H	α-helix	trans	-80.4	-24.6	173	-102.6	138.4	0	0	0	112.9	D190 H191 T195 S196	D190-L193 HydrophobicContact CB-CD1 3.98Å; D190-L193 PolarHBondContact O-N 3.5Å; H191-L193 VanDerWaalsContact C-N 3.3Å; L193-T195 VanDerWaalsContact C-N 3.33Å; L193-S196 PolarHBondContact O-OG 2.81Å
194	D	55.9	Low	59.9	Low	96 Å²	96	116.2 Å²	116.2	51%	0.513	57%	0.568	S	S	.	*	H	α-helix	trans	-72.7	-28.3	176.9	-167.6	24.3	0	0	0	111.8	H191	H191-D194 IonicContact CE1-OD2 2.69Å
195	T	52.8	Low	59	Low	55 Å²	55	112.1 Å²	112.1	34%	0.337	57%	0.569	S	S	.	*	H	α-helix	trans	-107	-9.3	-176.2	56.5	0	0	0	0	114.4	L193 D197 I198 Q199	L193-T195 VanDerWaalsContact C-N 3.33Å; T195-D197 VanDerWaalsContact C-N 3.33Å; T195-D197 PolarHBondContact O-N 3.39Å; T195-I198 PolarHBondContact O-N 3.1Å; T195-Q199 PolarHBondContact O-N 2.85Å
196	S	58.7	Low	58.2	Low	48 Å²	48	112.9 Å²	112.9	34%	0.336	58%	0.576	S	S	.	*	H	α-helix	trans	-65.2	-37.4	-179.6	57.5	0	0	0	0	112.3	N192 L193 F200	N192-S196 PolarHBondContact O-N 2.81Å; L193-S196 PolarHBondContact O-OG 2.81Å; S196-F200 VanDerWaalsContact O-CB 3.3Å; S196-F200 WeakPolarHBondContact O-CB 3.45Å; S196-F200 PolarHBondContact O-N 3.07Å; S196-F200 VanDerWaalsContact O-N 3.1Å
197	D	54.9	Low	57.5	Low	112 Å²	112	115.1 Å²	115.1	60%	0.599	59%	0.588	S	S	*	*	H	α-helix	trans	-73.3	-33.8	-179.6	-69.6	-4.4	0	0	0	111.4	T195 L201	T195-D197 VanDerWaalsContact C-N 3.33Å; T195-D197 PolarHBondContact O-N 3.39Å; D197-L201 WeakPolarHBondContact O-CB 3.31Å; D197-L201 WeakPolarHBondContact O-CD1 3.23Å; D197-L201 WeakPolarHBondContact O-CG 3.5Å; D197-L201 PolarHBondContact O-N 2.84Å; D197-L201 VanDerWaalsContact O-N 3.08Å
198	I	61.5	Low	57.3	Low	108 Å²	108	113.3 Å²	113.3	55%	0.554	59%	0.589	S	S	*	*	H	α-helix	trans	-70.2	-44.7	177	-62.3	172.4	0	0	0	111.1	T195 F200 L201 E202	T195-I198 PolarHBondContact O-N 3.1Å; I198-F200 VanDerWaalsContact C-N 3.32Å; I198-F200 PolarHBondContact O-N 2.91Å; I198-L201 PolarHBondContact O-N 2.99Å; I198-E202 WeakPolarHBondContact O-CB 3.23Å; I198-E202 PolarHBondContact O-N 3.11Å
199	Q	58.3	Low	57	Low	132 Å²	132	115 Å²	115	62%	0.617	60%	0.597	S	S	*	*	H	α-helix	trans	-66.5	-34.9	177.5	-115.5	171	15.2	0	0	112.3	T195 E203	T195-Q199 PolarHBondContact O-N 2.85Å; Q199-E203 PolarHBondContact O-N 3.15Å; Q199-E203 VanDerWaalsContact O-N 3.16Å
200	F	59.7	Low	56.5	Low	163 Å²	163	110 Å²	110	72%	0.715	59%	0.59	S	S	*	*	H	α-helix	trans	-70	-34.7	176.7	-160.1	-96.7	0	0	0	112.4	S196 I198 A204	S196-F200 VanDerWaalsContact O-CB 3.3Å; S196-F200 WeakPolarHBondContact O-CB 3.45Å; S196-F200 PolarHBondContact O-N 3.07Å; S196-F200 VanDerWaalsContact O-N 3.1Å; I198-F200 VanDerWaalsContact C-N 3.32Å; I198-F200 PolarHBondContact O-N 2.91Å; F200-A204 WeakPolarHBondContact O-CB 3.33Å; F200-A204 PolarHBondContact O-N 2.8Å
201	L	59.3	Low	56.6	Low	86 Å²	86	111 Å²	111	45%	0.45	60%	0.595	S	S	.	*	H	α-helix	trans	-74.4	-34.2	175.2	-77	164	0	0	0	113.1	D197 I198 G205 N206	D197-L201 WeakPolarHBondContact O-CB 3.31Å; D197-L201 WeakPolarHBondContact O-CD1 3.23Å; D197-L201 WeakPolarHBondContact O-CG 3.5Å; D197-L201 PolarHBondContact O-N 2.84Å; D197-L201 VanDerWaalsContact O-N 3.08Å; I198-L201 PolarHBondContact O-N 2.99Å; L201-G205 PolarHBondContact O-N 3.25Å; L201-N206 HydrophobicContact CD2-CB 4.4Å; L201-N206 PolarHBondContact O-N 3.37Å
202	E	56.6	Low	56.6	Low	157 Å²	157	112.1 Å²	112.1	73%	0.734	60%	0.6	S	S	*	*	H	α-helix	trans	-70.3	-37.8	177	-164.8	172.3	-152.7	0	0	112.2	I198 G205	I198-E202 WeakPolarHBondContact O-CB 3.23Å; I198-E202 PolarHBondContact O-N 3.11Å; E202-G205 PolarHBondContact O-N 2.95Å
203	E	51.9	Low	56.9	Low	183 Å²	183	109.7 Å²	109.7	86%	0.855	59%	0.592	S	S	*	*	H	α-helix	trans	-75.3	-25.7	176	-172	153.9	-158.4	0	0	113.2	Q199	Q199-E203 PolarHBondContact O-N 3.15Å; Q199-E203 VanDerWaalsContact O-N 3.16Å
204	A	55.5	Low	57.2	Low	59 Å²	59	112.2 Å²	112.2	49%	0.488	61%	0.605	S	S	.	*	T	Hydrogen-bonded Turn	trans	-86.8	-4.1	175.2	0	0	0	0	0	114.2	F200 N206	F200-A204 WeakPolarHBondContact O-CB 3.33Å; F200-A204 PolarHBondContact O-N 2.8Å; A204-N206 PolarHBondContact O-N 3.14Å
205	G	51.7	Low	57.3	Low	63 Å²	63	114.1 Å²	114.1	65%	0.649	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	66.4	17.2	177.4	0	0	0	0	0	115.1	L201 E202	L201-G205 PolarHBondContact O-N 3.25Å; E202-G205 PolarHBondContact O-N 2.95Å
206	N	53.9	Low	57.6	Low	107 Å²	107	118.1 Å²	118.1	57%	0.572	62%	0.624	S	S	*	*			trans	-104.7	86.6	-179.9	-83.6	-14.4	0	0	0	109.9	L201 A204 V208	L201-N206 HydrophobicContact CD2-CB 4.4Å; L201-N206 PolarHBondContact O-N 3.37Å; A204-N206 PolarHBondContact O-N 3.14Å; N206-V208 PolarHBondContact O-N 3.34Å
207	N	54.3	Low	57.3	Low	139 Å²	139	122.3 Å²	122.3	74%	0.743	64%	0.643	S	S	*	*			trans	-77.8	107.8	163.1	-165.8	-63.3	0	0	0	107.7	E209	N207-E209 PolarHBondContact O-N 3.13Å
208	V	55.3	Low	57.4	Low	112 Å²	112	122.6 Å²	122.6	68%	0.679	64%	0.643	S	S	*	*			trans	-85.4	94.5	173.9	179.4	0	0	0	0	107.2	N206 V210	N206-V208 PolarHBondContact O-N 3.34Å; V208-V210 PolarHBondContact O-N 2.89Å
209	E	59.7	Low	56.8	Low	174 Å²	174	126.1 Å²	126.1	81%	0.813	66%	0.657	S	S	*	*			trans	-70	111.9	169.4	-71.7	-179.6	163.9	0	0	108.3	N207 D211	N207-E209 PolarHBondContact O-N 3.13Å; E209-D211 PolarHBondContact O-N 3.19Å
210	V	56.3	Low	56.5	Low	105 Å²	105	126.6 Å²	126.6	64%	0.636	66%	0.664	S	S	*	*			trans	-80.6	112.8	172.8	-173.2	0	0	0	0	107.1	V208 E212 F215	V208-V210 PolarHBondContact O-N 2.89Å; V210-E212 PolarHBondContact O-N 2.91Å; V210-F215 HydrophobicContact CG1-CE2 4.31Å
211	D	59.1	Low	56	Low	100 Å²	100	124.7 Å²	124.7	54%	0.535	66%	0.661	S	S	.	*			trans	-77.7	105.1	178.1	-166.9	-19.7	0	0	0	109.6	E209 S213 L214	E209-D211 PolarHBondContact O-N 3.19Å; D211-S213 PolarHBondContact O-N 3.14Å; D211-S213 VanDerWaalsContact O-N 3.08Å; D211-S213 WeakPolarHBondContact OD1-CB 3.4Å; D211-S213 PolarHBondContact OD1-N 3.18Å; D211-S213 VanDerWaalsContact OD1-N 3.15Å; D211-S213 PolarHBondContact OD1-OG 3.43Å; D211-S213 PolarHBondContact OD2-OG 2.97Å; D211-L214 HydrophobicContact CB-CD1 4.48Å; D211-L214 PolarHBondContact O-N 3.4Å; D211-L214 VanDerWaalsContact O-N 3.16Å
212	E	59.4	Low	55.6	Low	163 Å²	163	127.2 Å²	127.2	76%	0.762	67%	0.674	S	S	*	*	G	3₁₀ helix	trans	-60.6	-14.1	179.9	-72.6	179.6	169.7	0	0	113.5	V210 L214	V210-E212 PolarHBondContact O-N 2.91Å; E212-L214 VanDerWaalsContact C-N 3.28Å; E212-L214 PolarHBondContact O-N 2.9Å
213	S	63.9	Low	55.4	Low	58 Å²	58	127 Å²	127	41%	0.406	68%	0.677	S	S	.	*	G	3₁₀ helix	trans	-70.1	-20.9	175.1	67.7	0	0	0	0	113.9	D211 F215 Q216	D211-S213 PolarHBondContact O-N 3.14Å; D211-S213 VanDerWaalsContact O-N 3.08Å; D211-S213 WeakPolarHBondContact OD1-CB 3.4Å; D211-S213 PolarHBondContact OD1-N 3.18Å; D211-S213 VanDerWaalsContact OD1-N 3.15Å; D211-S213 PolarHBondContact OD1-OG 3.43Å; D211-S213 PolarHBondContact OD2-OG 2.97Å; S213-F215 PolarHBondContact O-N 3.3Å; S213-Q216 PolarHBondContact O-N 3.1Å
214	L	62.6	Low	55.2	Low	137 Å²	137	124.4 Å²	124.4	72%	0.717	67%	0.669	S	S	*	*	G	3₁₀ helix	trans	-70.8	-12.6	178.6	-95.4	154.8	0	0	0	114.2	D211 E212	D211-L214 HydrophobicContact CB-CD1 4.48Å; D211-L214 PolarHBondContact O-N 3.4Å; D211-L214 VanDerWaalsContact O-N 3.16Å; E212-L214 VanDerWaalsContact C-N 3.28Å; E212-L214 PolarHBondContact O-N 2.9Å
215	F	57.9	Low	55.2	Low	136 Å²	136	130.9 Å²	130.9	60%	0.596	69%	0.69	S	S	*	*	G	3₁₀ helix	trans	-109.9	2.9	-178.2	-64	-84.7	0	0	0	113.5	V210 S213 D217	V210-F215 HydrophobicContact CG1-CE2 4.31Å; S213-F215 PolarHBondContact O-N 3.3Å; F215-D217 VanDerWaalsContact C-N 3.35Å
216	Q	58.6	Low	55.2	Low	139 Å²	139	135.3 Å²	135.3	65%	0.65	70%	0.698	S	S	*	*	G	3₁₀ helix	trans	-73.4	-24.8	179.6	-76.1	177	-4.7	0	0	113.2	S213 I218	S213-Q216 PolarHBondContact O-N 3.1Å; Q216-I218 VanDerWaalsContact C-N 3.29Å; Q216-I218 PolarHBondContact O-N 2.86Å
217	D	53.3	Low	55.3	Low	136 Å²	136	134.7 Å²	134.7	73%	0.727	70%	0.695	S	S	*	*	G	3₁₀ helix	trans	-80.5	-2.2	-177.9	-70.6	-19.6	0	0	0	114.2	F215	F215-D217 VanDerWaalsContact C-N 3.35Å
218	I	55.8	Low	55.5	Low	117 Å²	117	134.1 Å²	134.1	60%	0.6	70%	0.699	S	S	*	*	G	3₁₀ helix	trans	-83.7	-21.6	177	-81.6	170.8	0	0	0	112.4	Q216	Q216-I218 VanDerWaalsContact C-N 3.29Å; Q216-I218 PolarHBondContact O-N 2.86Å
219	E	50	Low	55.5	Low	183 Å²	183	135.7 Å²	135.7	86%	0.855	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.9	-14.2	177	-82.6	-174.9	166.4	0	0	113.6
220	D	51.3	Low	55.5	Low	141 Å²	141	134.9 Å²	134.9	75%	0.754	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.9	8.6	178.5	-113.9	12.5	0	0	0	112.9	D222	D220-D222 PolarHBondContact O-N 3.07Å
221	L	50.1	Low	55.5	Low	124 Å²	124	134.2 Å²	134.2	65%	0.649	69%	0.691	S	S	*	*			trans	-75.5	84.2	163.2	-85.2	160.4	0	0	0	107.8	L223	L221-L223 PolarHBondContact O-N 3.38Å
222	D	49.6	Very low	55.4	Low	138 Å²	138	133.7 Å²	133.7	74%	0.738	69%	0.693	S	S	*	*			trans	-57.6	84.5	163.2	-84	-26.9	0	0	0	108.3	D220 D224	D220-D222 PolarHBondContact O-N 3.07Å; D222-D224 PolarHBondContact O-N 3.37Å
223	L	53.1	Low	55	Low	152 Å²	152	133.1 Å²	133.1	80%	0.796	69%	0.694	S	S	*	*			trans	-71.5	84.5	161	-76.3	168.5	0	0	0	106.1	L221 E225	L221-L223 PolarHBondContact O-N 3.38Å; L223-E225 PolarHBondContact O-N 3.37Å
224	D	48.6	Very low	54.6	Low	129 Å²	129	136.2 Å²	136.2	69%	0.69	71%	0.706	S	S	*	*			trans	-58.5	100.1	169.2	-79.9	-35.3	0	0	0	108.1	D222 D226 D227	D222-D224 PolarHBondContact O-N 3.37Å; D224-D226 PolarHBondContact O-N 3.07Å; D224-D227 PolarHBondContact O-N 3.46Å
225	E	54.2	Low	54.1	Low	196 Å²	196	137.8 Å²	137.8	92%	0.916	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.3	-2.5	177.3	-80.3	-173.1	155.9	0	0	113.6	L223	L223-E225 PolarHBondContact O-N 3.37Å
226	D	51.5	Low	53.7	Low	156 Å²	156	139.1 Å²	139.1	83%	0.834	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.3	31.4	-175	-85.8	-42.9	0	0	0	113.2	D224 P228	D224-D226 PolarHBondContact O-N 3.07Å; D226-P228 WeakPolarHBondContact O-CD 3.4Å
227	D	56.8	Low	53.6	Low	93 Å²	93	136.3 Å²	136.3	50%	0.497	72%	0.721	S	S	.	*			trans	-78.8	111	166.1	-171.1	-8.8	0	0	0	110.5	D224 N229 F230	D224-D227 PolarHBondContact O-N 3.46Å; D227-N229 PolarHBondContact O-N 3.32Å; D227-N229 WeakPolarHBondContact OD1-CB 3.29Å; D227-N229 PolarHBondContact OD1-N 2.96Å; D227-F230 HydrophobicContact CB-CB 4.41Å; D227-F230 PolarHBondContact O-N 2.9Å
228	P	58	Low	53.4	Low	127 Å²	127	137.6 Å²	137.6	83%	0.825	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67	-4.2	179.4	29.6	-36.6	0	0	0	114.2	D226	D226-P228 WeakPolarHBondContact O-CD 3.4Å
229	N	56.4	Low	53	Low	146 Å²	146	141 Å²	141	78%	0.781	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.9	-0.1	173.1	-106.9	26.1	0	0	0	113.8	D227 D231	D227-N229 PolarHBondContact O-N 3.32Å; D227-N229 WeakPolarHBondContact OD1-CB 3.29Å; D227-N229 PolarHBondContact OD1-N 2.96Å; N229-D231 PolarHBondContact O-N 3.24Å; N229-D231 VanDerWaalsContact O-N 3.1Å
230	F	59.4	Low	52.6	Low	157 Å²	157	143.9 Å²	143.9	69%	0.689	76%	0.762	S	S	*	*			trans	-79.3	91.3	173.5	-171.2	-102.1	0	0	0	109.8	D227 P232	D227-F230 HydrophobicContact CB-CB 4.41Å; D227-F230 PolarHBondContact O-N 2.9Å; F230-P232 HydrophobicContact CD1-CG 4.21Å; F230-P232 HydrophobicContact CE1-CB 4.45Å; F230-P232 HydrophobicContact CE1-CG 4.01Å; F230-P232 WeakPolarHBondContact O-CD 3.42Å
231	D	56.8	Low	52.6	Low	91 Å²	91	144 Å²	144	49%	0.487	76%	0.763	S	S	.	*			trans	-91.6	109.8	167.2	-168.1	-11.1	0	0	0	109.3	N229 L233 D234	N229-D231 PolarHBondContact O-N 3.24Å; N229-D231 VanDerWaalsContact O-N 3.1Å; D231-L233 PolarHBondContact O-N 3.12Å; D231-L233 WeakPolarHBondContact OD1-CB 3.49Å; D231-L233 PolarHBondContact OD1-N 3.21Å; D231-D234 PolarHBondContact O-N 3.1Å
232	P	56	Low	52.8	Low	89 Å²	89	145.1 Å²	145.1	58%	0.578	77%	0.768	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.2	-10.7	178.7	-16.6	29.8	0	0	0	113.5	F230	F230-P232 HydrophobicContact CD1-CG 4.21Å; F230-P232 HydrophobicContact CE1-CB 4.45Å; F230-P232 HydrophobicContact CE1-CG 4.01Å; F230-P232 WeakPolarHBondContact O-CD 3.42Å
233	L	51.9	Low	52.9	Low	151 Å²	151	145.4 Å²	145.4	79%	0.791	77%	0.77	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.4	-6.7	-179.5	-62.4	173.6	0	0	0	114	D231 M235	D231-L233 PolarHBondContact O-N 3.12Å; D231-L233 WeakPolarHBondContact OD1-CB 3.49Å; D231-L233 PolarHBondContact OD1-N 3.21Å; L233-M235 VanDerWaalsContact C-N 3.31Å
234	D	54	Low	52.9	Low	122 Å²	122	145.1 Å²	145.1	65%	0.652	77%	0.769	S	S	*	*			trans	-90.5	6.8	178.3	-141.1	18.7	0	0	0	112.9	D231 D236	D231-D234 PolarHBondContact O-N 3.1Å; D234-D236 PolarHBondContact O-N 2.96Å
235	M	52.9	Low	53.2	Low	171 Å²	171	146.1 Å²	146.1	84%	0.842	77%	0.774	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.4	21.4	175.8	-85.2	-118.6	-71.1	0	0	114.1	L233	L233-M235 VanDerWaalsContact C-N 3.31Å
236	D	50.5	Low	53.1	Low	164 Å²	164	142.7 Å²	142.7	88%	0.877	76%	0.764	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.4	34.6	178.3	-108.6	-29.3	0	0	0	112.7	D234	D234-D236 PolarHBondContact O-N 2.96Å
237	S	54.6	Low	53.2	Low	80 Å²	80	141.8 Å²	141.8	56%	0.559	76%	0.759	S	S	*	*			trans	-139.6	82	162	69.1	0	0	0	0	111.8
238	D	51	Low	53	Low	162 Å²	162	145.5 Å²	145.5	87%	0.866	78%	0.779	S	S	*	*	S	Bend	trans	-160.8	133.7	132.1	-95.5	-31.5	0	0	0	110
239	E	47.1	Very low	52.6	Low	188 Å²	188	147.1 Å²	147.1	88%	0.879	78%	0.775	S	S	*	*			trans	80.4	84	166.5	-58.8	-175	142.9	0	0	119.1
240	D	40	Very low	52.2	Low	244 Å²	244	147.2 Å²	147.2	100%	1.305	78%	0.775	S	S	*	*				-170.1	0	97.8	-111	-23.1	0	0	0	112.3

Retrieved 240 of 240 residues in 621.4 ms (Link to these results)

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