A0A096NBF6_PAPAN Loading...

Meiotic nuclear division protein 1 homolog

Required for proper homologous chromosome pairing and efficient cross-over and intragenic recombination during meiosis.

AlphaFold DB , UniProt , Accession A0A096NBF6, Species PAPAN (Papio anubis, Olive baboon), Gene MND1, Length 205 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	37.8	Very low	70.7	Confident	238 Å²	238	128.9 Å²	128.9	100%	1.172	69%	0.688	S	S	*	*				0	98.8	0	-71.8	-77.1	-100.9	0	0	108.1	K3	M1-K3 PolarHBondContact O-N 3.17Å
2	S	45.4	Very low	72.6	Confident	123 Å²	123	121.3 Å²	121.3	86%	0.86	64%	0.644	S	S	*	*			trans	-66	125.7	-175.3	-148.5	0	0	0	0	109.7	K4	S2-K4 PolarHBondContact O-N 3.39Å
3	K	49.5	Very low	74.3	Confident	201 Å²	201	115.1 Å²	115.1	87%	0.874	61%	0.606	S	S	*	*			trans	-59	113.6	174.8	-78.7	-178.4	177.1	178.1	0	107.4	M1 K5	M1-K3 PolarHBondContact O-N 3.17Å; K3-K5 PolarHBondContact O-N 3.35Å
4	K	56.6	Low	75.8	Confident	209 Å²	209	112.2 Å²	112.2	91%	0.909	60%	0.596	S	S	*	*			trans	-54.1	114.9	174.8	-75.2	-176.7	177.1	179.7	0	108	S2 G6	S2-K4 PolarHBondContact O-N 3.39Å; K4-G6 PolarHBondContact O-N 3.27Å
5	K	67.8	Low	77.1	Confident	206 Å²	206	111.1 Å²	111.1	90%	0.896	58%	0.58	S	S	*	*	P	Polyproline II helix	trans	-58.8	128.4	176.1	-160.8	173.9	-179.8	-177.6	0	107.7	K3	K3-K5 PolarHBondContact O-N 3.35Å
6	G	73	Confident	78.2	Confident	67 Å²	67	104.2 Å²	104.2	69%	0.691	54%	0.544	S	S	*	.	P	Polyproline II helix	trans	-64.3	154.2	177	0	0	0	0	0	111.2	K4 S8	K4-G6 PolarHBondContact O-N 3.27Å; G6-S8 PolarHBondContact O-N 3.29Å
7	L	82.8	Confident	79.2	Confident	41 Å²	41	99.5 Å²	99.5	22%	0.215	52%	0.519	C	S	.	.	P	Polyproline II helix	trans	-63.1	132.8	175.9	-69.8	160.3	0	0	0	110.4	E11 K12 G41	L7-E11 HydrophobicContact CB-CB 4.42Å; L7-E11 HydrophobicContact CD2-CB 3.8Å; L7-K12 HydrophobicContact CB-CG 3.82Å; L7-K12 HydrophobicContact CD1-CG 4.48Å; L7-K12 WeakPolarHBondContact O-CE 3.33Å; L7-G41 WeakPolarHBondContact CD1-O 3.33Å
8	S	90.9	Very high	80	Confident	57 Å²	57	97.9 Å²	97.9	40%	0.399	51%	0.509	S	S	.	.	P	Polyproline II helix	trans	-66.9	165	167.7	64.8	0	0	0	0	111.7	G6 E10 E11 K12	G6-S8 PolarHBondContact O-N 3.29Å; S8-E10 VanDerWaalsContact C-N 3.31Å; S8-E10 PolarHBondContact O-N 2.97Å; S8-E11 WeakPolarHBondContact CB-OE2 3.47Å; S8-E11 PolarHBondContact N-OE2 3.04Å; S8-E11 PolarHBondContact O-N 3.16Å; S8-E11 WeakPolarHBondContact OG-CB 3.3Å; S8-E11 VanDerWaalsContact OG-CD 3.27Å; S8-E11 WeakPolarHBondContact OG-CG 3.3Å; S8-E11 PolarHBondContact OG-N 2.9Å; S8-E11 PolarHBondContact OG-OE2 3.29Å; S8-K12 WeakPolarHBondContact O-CG 3.46Å; S8-K12 PolarHBondContact O-N 3.39Å
9	A	88.7	Confident	80.8	Confident	73 Å²	73	92.7 Å²	92.7	60%	0.603	48%	0.482	S	S	*	.	H	α-helix	trans	-57.5	-44.6	177.8	0	0	0	0	0	111.9	K12 R13	A9-K12 WeakPolarHBondContact O-CB 3.41Å; A9-K12 PolarHBondContact O-N 3.28Å; A9-R13 WeakPolarHBondContact O-CG 3.31Å; A9-R13 PolarHBondContact O-N 2.93Å
10	E	91.8	Very high	81.5	Confident	108 Å²	108	88.1 Å²	88.1	51%	0.505	46%	0.458	S	S	.	.	H	α-helix	trans	-69.7	-37.5	-178.8	-163.8	61.6	-165.1	0	0	112.4	S8 K12 R13 T14	S8-E10 VanDerWaalsContact C-N 3.31Å; S8-E10 PolarHBondContact O-N 2.97Å; E10-K12 VanDerWaalsContact C-N 3.29Å; E10-K12 PolarHBondContact O-N 2.93Å; E10-R13 PolarHBondContact O-N 3.5Å; E10-R13 IonicContact OE1-NH1 3.6Å; E10-R13 IonicContact OE2-CZ 2.71Å; E10-R13 IonicContact OE2-NH1 2.59Å; E10-R13 PolarHBondContact OE2-NH1 3.01Å; E10-T14 PolarHBondContact O-N 2.86Å; E10-T14 PolarHBondContact O-OG1 3.2Å
11	E	93.4	Very high	82	Confident	95 Å²	95	87.8 Å²	87.8	44%	0.444	45%	0.453	S	S	.	.	H	α-helix	trans	-63.3	-36.7	173.2	-72.4	166.3	141.5	0	0	111.9	L7 S8 R15	L7-E11 HydrophobicContact CB-CB 4.42Å; L7-E11 HydrophobicContact CD2-CB 3.8Å; S8-E11 WeakPolarHBondContact CB-OE2 3.47Å; S8-E11 PolarHBondContact N-OE2 3.04Å; S8-E11 PolarHBondContact O-N 3.16Å; S8-E11 WeakPolarHBondContact OG-CB 3.3Å; S8-E11 VanDerWaalsContact OG-CD 3.27Å; S8-E11 WeakPolarHBondContact OG-CG 3.3Å; S8-E11 PolarHBondContact OG-N 2.9Å; S8-E11 PolarHBondContact OG-OE2 3.29Å; E11-R15 VanDerWaalsContact O-CB 3.3Å; E11-R15 WeakPolarHBondContact O-CB 3.28Å; E11-R15 VanDerWaalsContact O-CG 3.25Å; E11-R15 WeakPolarHBondContact O-CG 3.19Å; E11-R15 PolarHBondContact O-N 3.16Å
12	K	93.6	Very high	84.7	Confident	37 Å²	37	82 Å²	82	16%	0.161	42%	0.423	C	S	.	.	H	α-helix	trans	-65.6	-40.9	174.5	-67.2	174.3	-174.8	-172.3	0	111.4	L7 S8 A9 E10 R15 M16 I42 S46 V50	L7-K12 HydrophobicContact CB-CG 3.82Å; L7-K12 HydrophobicContact CD1-CG 4.48Å; L7-K12 WeakPolarHBondContact O-CE 3.33Å; S8-K12 WeakPolarHBondContact O-CG 3.46Å; S8-K12 PolarHBondContact O-N 3.39Å; A9-K12 WeakPolarHBondContact O-CB 3.41Å; A9-K12 PolarHBondContact O-N 3.28Å; E10-K12 VanDerWaalsContact C-N 3.29Å; E10-K12 PolarHBondContact O-N 2.93Å; K12-R15 PolarHBondContact O-N 3.4Å; K12-M16 VanDerWaalsContact O-CB 3.31Å; K12-M16 WeakPolarHBondContact O-CB 3.36Å; K12-M16 PolarHBondContact O-N 3.41Å; K12-I42 HydrophobicContact CB-CD1 4.46Å; K12-I42 HydrophobicContact CB-CG1 4.47Å; K12-I42 HydrophobicContact CD-CG2 4.39Å; K12-I42 HydrophobicContact CG-CG1 4.48Å; K12-I42 HydrophobicContact CG-CG2 4.34Å; K12-I42 WeakPolarHBondContact O-CD1 3.23Å; K12-S46 PolarHBondContact NZ-OG 3.47Å; K12-S46 VanDerWaalsContact NZ-OG 3.13Å; K12-V50 HydrophobicContact CB-CG1 4.16Å; K12-V50 HydrophobicContact CB-CG2 3.76Å; K12-V50 HydrophobicContact CD-CG2 3.99Å
13	R	95.3	Very high	86.9	Confident	41 Å²	41	79.1 Å²	79.1	16%	0.155	40%	0.401	C	S	.	.	H	α-helix	trans	-63	-49.3	177.4	-70.5	176.9	78.4	-150.1	7.4	111.6	A9 E10 R15 M16 M17 V50 S53 L54 D57	A9-R13 WeakPolarHBondContact O-CG 3.31Å; A9-R13 PolarHBondContact O-N 2.93Å; E10-R13 PolarHBondContact O-N 3.5Å; E10-R13 IonicContact OE1-NH1 3.6Å; E10-R13 IonicContact OE2-CZ 2.71Å; E10-R13 IonicContact OE2-NH1 2.59Å; E10-R13 PolarHBondContact OE2-NH1 3.01Å; R13-R15 PolarHBondContact O-N 3.17Å; R13-M16 PolarHBondContact O-N 3.22Å; R13-M17 PolarHBondContact O-N 3.16Å; R13-V50 HydrophobicContact CG-CG1 4.07Å; R13-S53 PolarHBondContact NE-OG 3.01Å; R13-S53 PolarHBondContact NH2-O 3.5Å; R13-L54 HydrophobicContact CB-CD2 4.03Å; R13-L54 HydrophobicContact CB-CG 4.44Å; R13-L54 HydrophobicContact CG-CD2 4.36Å; R13-L54 HydrophobicContact CG-CG 4.41Å; R13-D57 IonicContact CZ-OD2 3.4Å; R13-D57 IonicContact NH1-OD2 2.61Å; R13-D57 IonicContact NH2-OD2 2.74Å; R13-D57 PolarHBondContact NH2-OD2 3.16Å
14	T	94.9	Very high	88.9	Confident	75 Å²	75	75.8 Å²	75.8	46%	0.46	39%	0.386	S	S	.	.	H	α-helix	trans	-57.7	-48.8	176.1	-61.5	0	0	0	0	111.4	E10 M16 M17 E18	E10-T14 PolarHBondContact O-N 2.86Å; E10-T14 PolarHBondContact O-OG1 3.2Å; T14-M16 VanDerWaalsContact C-N 3.33Å; T14-M16 PolarHBondContact O-N 3.4Å; T14-M17 WeakPolarHBondContact O-CB 3.46Å; T14-M17 PolarHBondContact O-N 3.41Å; T14-E18 WeakPolarHBondContact O-CG 3.12Å; T14-E18 PolarHBondContact O-N 3.15Å
15	R	95.1	Very high	90.7	Very high	96 Å²	96	70.3 Å²	70.3	36%	0.362	37%	0.366	S	S	.	.	H	α-helix	trans	-65.6	-33.3	178.9	-75.9	-174.9	-174	-155.5	0	113.8	E11 K12 R13 E18 I19 K40 I42	E11-R15 VanDerWaalsContact O-CB 3.3Å; E11-R15 WeakPolarHBondContact O-CB 3.28Å; E11-R15 VanDerWaalsContact O-CG 3.25Å; E11-R15 WeakPolarHBondContact O-CG 3.19Å; E11-R15 PolarHBondContact O-N 3.16Å; K12-R15 PolarHBondContact O-N 3.4Å; R13-R15 PolarHBondContact O-N 3.17Å; R15-E18 WeakPolarHBondContact O-CB 3.25Å; R15-E18 PolarHBondContact O-N 3.24Å; R15-I19 PolarHBondContact O-N 3.13Å; R15-K40 HydrophobicContact CB-CB 4.06Å; R15-K40 HydrophobicContact CB-CG 4.45Å; R15-K40 WeakPolarHBondContact CD-O 3.47Å; R15-K40 PolarHBondContact NH1-O 2.83Å; R15-I42 HydrophobicContact CB-CD1 4.2Å
16	M	95.3	Very high	92	Very high	0 Å²	0	63.4 Å²	63.4	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-66.3	-42.4	173.3	-175.4	68.1	75.2	0	0	110.7	K12 R13 T14 E18 I19 F20 L32 A36 I42 V47 V50 L54	K12-M16 VanDerWaalsContact O-CB 3.31Å; K12-M16 WeakPolarHBondContact O-CB 3.36Å; K12-M16 PolarHBondContact O-N 3.41Å; R13-M16 PolarHBondContact O-N 3.22Å; T14-M16 VanDerWaalsContact C-N 3.33Å; T14-M16 PolarHBondContact O-N 3.4Å; M16-E18 VanDerWaalsContact C-N 3.32Å; M16-E18 PolarHBondContact O-N 3.16Å; M16-I19 WeakPolarHBondContact O-CB 3.38Å; M16-I19 PolarHBondContact O-N 3.27Å; M16-I19 HydrophobicContact SD-CD1 4.11Å; M16-F20 HydrophobicContact CG-CE2 4Å; M16-F20 VanDerWaalsContact O-CD2 3.28Å; M16-F20 WeakPolarHBondContact O-CD2 3.45Å; M16-F20 HydrophobicContact SD-CE2 4.41Å; M16-L32 HydrophobicContact SD-CD2 4.37Å; M16-A36 HydrophobicContact CE-CB 3.76Å; M16-A36 HydrophobicContact SD-CB 4.11Å; M16-I42 HydrophobicContact CB-CD1 3.99Å; M16-I42 HydrophobicContact CE-CD1 3.9Å; M16-V47 HydrophobicContact CE-CB 4.41Å; M16-V47 HydrophobicContact CE-CG1 3.85Å; M16-V50 HydrophobicContact CB-CG1 3.94Å; M16-V50 HydrophobicContact CE-CB 4.49Å; M16-V50 HydrophobicContact CE-CG1 4.22Å; M16-V50 HydrophobicContact CG-CG1 4.31Å; M16-L54 HydrophobicContact CB-CD1 3.76Å; M16-L54 HydrophobicContact CG-CD1 3.66Å
17	M	94.4	Very high	93.1	Very high	25 Å²	25	60.9 Å²	60.9	12%	0.123	31%	0.311	C	S	.	.	H	α-helix	trans	-61.8	-37.6	174.7	-75.4	-61.3	-62.3	0	0	112.9	R13 T14 I19 F20 F21 L54 M59 V60 A73	R13-M17 PolarHBondContact O-N 3.16Å; T14-M17 WeakPolarHBondContact O-CB 3.46Å; T14-M17 PolarHBondContact O-N 3.41Å; M17-I19 VanDerWaalsContact C-N 3.26Å; M17-I19 PolarHBondContact O-N 3.33Å; M17-F20 PolarHBondContact O-N 3.38Å; M17-F21 HydrophobicContact CE-CD1 4.27Å; M17-F21 HydrophobicContact CE-CE1 3.46Å; M17-F21 VanDerWaalsContact CE-CE1 3.46Å; M17-F21 HydrophobicContact CE-CE2 3.85Å; M17-F21 HydrophobicContact CE-CZ 3.22Å; M17-F21 PolarHBondContact O-N 3.06Å; M17-L54 HydrophobicContact CG-CD1 3.99Å; M17-L54 HydrophobicContact CG-CD2 3.79Å; M17-L54 HydrophobicContact SD-CD1 4.14Å; M17-L54 HydrophobicContact SD-CD2 4.08Å; M17-M59 HydrophobicContact CE-CB 4.32Å; M17-M59 HydrophobicContact SD-CB 3.99Å; M17-V60 HydrophobicContact SD-CG2 3.58Å; M17-V60 VanDerWaalsContact SD-CG2 3.58Å; M17-A73 HydrophobicContact CE-CB 4.02Å; M17-A73 HydrophobicContact SD-CB 4.49Å
18	E	94.6	Very high	93.7	Very high	70 Å²	70	61.6 Å²	61.6	33%	0.327	31%	0.314	S	S	.	.	H	α-helix	trans	-56.6	-40.2	174.6	-71.7	170.3	-168.8	0	0	112	T14 R15 M16 F20 F21 E22 K40	T14-E18 WeakPolarHBondContact O-CG 3.12Å; T14-E18 PolarHBondContact O-N 3.15Å; R15-E18 WeakPolarHBondContact O-CB 3.25Å; R15-E18 PolarHBondContact O-N 3.24Å; M16-E18 VanDerWaalsContact C-N 3.32Å; M16-E18 PolarHBondContact O-N 3.16Å; E18-F20 VanDerWaalsContact C-N 3.34Å; E18-F20 PolarHBondContact O-N 3.03Å; E18-F21 PolarHBondContact O-N 3.2Å; E18-E22 VanDerWaalsContact O-CB 3.23Å; E18-E22 WeakPolarHBondContact O-CB 3.46Å; E18-E22 VanDerWaalsContact O-CG 3.23Å; E18-E22 WeakPolarHBondContact O-CG 3.45Å; E18-E22 PolarHBondContact O-N 2.91Å; E18-K40 IonicContact OE2-NZ 2.85Å; E18-K40 PolarHBondContact OE2-NZ 3Å
19	I	94.9	Very high	93.9	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-56.6	-50.8	177.3	-61	169.6	0	0	0	109.8	R15 M16 M17 F21 T23 F27 L32 I35 A36 K40	R15-I19 PolarHBondContact O-N 3.13Å; M16-I19 WeakPolarHBondContact O-CB 3.38Å; M16-I19 PolarHBondContact O-N 3.27Å; M16-I19 HydrophobicContact SD-CD1 4.11Å; M17-I19 VanDerWaalsContact C-N 3.26Å; M17-I19 PolarHBondContact O-N 3.33Å; I19-F21 PolarHBondContact O-N 2.78Å; I19-T23 HydrophobicContact CG2-CG2 4.43Å; I19-T23 WeakPolarHBondContact O-CB 3.49Å; I19-T23 VanDerWaalsContact O-CG2 3.31Å; I19-T23 WeakPolarHBondContact O-CG2 3.24Å; I19-T23 PolarHBondContact O-N 2.85Å; I19-T23 PolarHBondContact O-OG1 2.85Å; I19-F27 HydrophobicContact CG2-CE2 4.36Å; I19-F27 HydrophobicContact CG2-CZ 4.38Å; I19-L32 HydrophobicContact CG2-CD2 4.42Å; I19-I35 HydrophobicContact CD1-CG2 4.33Å; I19-I35 HydrophobicContact CG2-CG2 3.98Å; I19-A36 HydrophobicContact CD1-CB 3.76Å; I19-K40 HydrophobicContact CD1-CB 4.43Å; I19-K40 HydrophobicContact CD1-CG 3.81Å; I19-K40 HydrophobicContact CG1-CD 4.44Å; I19-K40 HydrophobicContact CG1-CG 3.59Å
20	F	94.7	Very high	94.2	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-63.8	-40.2	-179.9	-66.8	-74.2	0	0	0	112.6	M16 M17 E18 K24 F27 L32 L51 V60 A73	M16-F20 HydrophobicContact CG-CE2 4Å; M16-F20 VanDerWaalsContact O-CD2 3.28Å; M16-F20 WeakPolarHBondContact O-CD2 3.45Å; M16-F20 HydrophobicContact SD-CE2 4.41Å; M17-F20 PolarHBondContact O-N 3.38Å; E18-F20 VanDerWaalsContact C-N 3.34Å; E18-F20 PolarHBondContact O-N 3.03Å; F20-K24 VanDerWaalsContact O-CA 3.25Å; F20-K24 WeakPolarHBondContact O-CA 3.3Å; F20-K24 PolarHBondContact O-N 2.83Å; F20-F27 AromaticContact CD1-CD2 3.81Å; F20-F27 HydrophobicContact CD1-CD2 3.81Å; F20-F27 HydrophobicContact CD1-CE2 4.09Å; F20-F27 AromaticContact CE1-CD2 3.68Å; F20-F27 HydrophobicContact CE1-CD2 3.68Å; F20-F27 HydrophobicContact CE1-CE2 4.41Å; F20-L32 HydrophobicContact CE1-CD1 4.29Å; F20-L32 HydrophobicContact CE1-CD2 4.32Å; F20-L32 HydrophobicContact CZ-CD1 3.72Å; F20-L32 HydrophobicContact CZ-CD2 4.03Å; F20-L51 HydrophobicContact CE2-CD1 4.07Å; F20-L51 HydrophobicContact CZ-CD1 3.79Å; F20-V60 HydrophobicContact CD2-CG2 3.89Å; F20-V60 HydrophobicContact CE1-CG1 4.33Å; F20-V60 HydrophobicContact CE2-CG1 4.16Å; F20-V60 HydrophobicContact CE2-CG2 3.63Å; F20-V60 HydrophobicContact CZ-CG1 3.88Å; F20-V60 HydrophobicContact CZ-CG2 4.22Å; F20-A73 HydrophobicContact CB-CB 3.78Å; F20-A73 HydrophobicContact CG-CB 4.08Å
21	F	92.8	Very high	94.3	Very high	81 Å²	81	61.9 Å²	61.9	36%	0.355	30%	0.297	S	S	.	.	H	α-helix	trans	-78	-31.2	-176.3	-72.4	-2.5	0	0	0	114.1	M17 E18 I19 K24 A73 P75	M17-F21 HydrophobicContact CE-CD1 4.27Å; M17-F21 HydrophobicContact CE-CE1 3.46Å; M17-F21 VanDerWaalsContact CE-CE1 3.46Å; M17-F21 HydrophobicContact CE-CE2 3.85Å; M17-F21 HydrophobicContact CE-CZ 3.22Å; M17-F21 PolarHBondContact O-N 3.06Å; E18-F21 PolarHBondContact O-N 3.2Å; I19-F21 PolarHBondContact O-N 2.78Å; F21-K24 WeakPolarHBondContact O-CE 3.41Å; F21-K24 VanDerWaalsContact O-CG 3.32Å; F21-K24 WeakPolarHBondContact O-CG 3.36Å; F21-A73 HydrophobicContact CD1-CB 4.36Å; F21-A73 HydrophobicContact CE1-CB 3.86Å; F21-P75 HydrophobicContact CB-CG 4.07Å; F21-P75 HydrophobicContact CD1-CG 3.86Å; F21-P75 HydrophobicContact CD2-CG 4.42Å; F21-P75 HydrophobicContact CE1-CG 4.37Å; F21-P75 HydrophobicContact CG-CG 3.88Å
22	E	93.1	Very high	94.4	Very high	117 Å²	117	57.4 Å²	57.4	55%	0.547	28%	0.276	S	S	.	.	H	α-helix	trans	-74.6	-49.7	175.5	-72	168.4	-176.8	0	0	110.7	E18 K40	E18-E22 VanDerWaalsContact O-CB 3.23Å; E18-E22 WeakPolarHBondContact O-CB 3.46Å; E18-E22 VanDerWaalsContact O-CG 3.23Å; E18-E22 WeakPolarHBondContact O-CG 3.45Å; E18-E22 PolarHBondContact O-N 2.91Å; E22-K40 VanDerWaalsContact CD-NZ 3.27Å; E22-K40 IonicContact OE1-NZ 2.91Å; E22-K40 PolarHBondContact OE1-NZ 3.24Å; E22-K40 WeakPolarHBondContact OE2-CE 3.27Å; E22-K40 IonicContact OE2-NZ 2.87Å; E22-K40 PolarHBondContact OE2-NZ 3.19Å
23	T	91.6	Very high	94.4	Very high	63 Å²	63	59.5 Å²	59.5	39%	0.387	29%	0.286	S	S	.	.	H	α-helix	trans	-77	-34.6	-176.8	60.5	0	0	0	0	112.8	I19 D25 F27	I19-T23 HydrophobicContact CG2-CG2 4.43Å; I19-T23 WeakPolarHBondContact O-CB 3.49Å; I19-T23 VanDerWaalsContact O-CG2 3.31Å; I19-T23 WeakPolarHBondContact O-CG2 3.24Å; I19-T23 PolarHBondContact O-N 2.85Å; I19-T23 PolarHBondContact O-OG1 2.85Å; T23-D25 PolarHBondContact O-N 2.87Å; T23-F27 HydrophobicContact CG2-CZ 4.04Å; T23-F27 VanDerWaalsContact OG1-CE2 3.3Å; T23-F27 WeakPolarHBondContact OG1-CE2 3.44Å; T23-F27 VanDerWaalsContact OG1-CZ 3.24Å; T23-F27 WeakPolarHBondContact OG1-CZ 3.41Å
24	K	92.3	Very high	94.4	Very high	130 Å²	130	64.8 Å²	64.8	57%	0.565	31%	0.311	S	S	*	.			trans	51.9	43.5	-174.6	-53.7	168.6	-171	164.4	0	111.1	F20 F21 F74	F20-K24 VanDerWaalsContact O-CA 3.25Å; F20-K24 WeakPolarHBondContact O-CA 3.3Å; F20-K24 PolarHBondContact O-N 2.83Å; F21-K24 WeakPolarHBondContact O-CE 3.41Å; F21-K24 VanDerWaalsContact O-CG 3.32Å; F21-K24 WeakPolarHBondContact O-CG 3.36Å; K24-F74 HydrophobicContact CB-CD1 4.23Å; K24-F74 HydrophobicContact CB-CE1 4.13Å; K24-F74 WeakPolarHBondContact O-CE1 3.31Å
25	D	93.6	Very high	94.3	Very high	94 Å²	94	63 Å²	63	50%	0.503	30%	0.298	S	S	.	.			trans	-124.6	171.7	-177.6	-154.5	-2.3	0	0	0	111.5	T23 F27	T23-D25 PolarHBondContact O-N 2.87Å; D25-F27 HydrophobicContact CB-CE1 4.47Å; D25-F27 HydrophobicContact CB-CE2 4.09Å; D25-F27 HydrophobicContact CB-CZ 3.86Å
26	V	94.9	Very high	94.2	Very high	61 Å²	61	58.4 Å²	58.4	37%	0.37	28%	0.28	S	S	.	.			trans	-105.9	129.5	179.4	-172.9	0	0	0	0	109.2	Y70 W72	V26-Y70 HydrophobicContact CG1-CD1 3.96Å; V26-Y70 HydrophobicContact CG1-CG 4.37Å; V26-W72 HydrophobicContact CB-CB 4.44Å; V26-W72 HydrophobicContact CG1-CB 4.39Å; V26-W72 HydrophobicContact CG1-CE3 4.15Å; V26-W72 HydrophobicContact CG2-CB 4.02Å
27	F	96.1	Very high	94.2	Very high	14 Å²	14	60.3 Å²	60.3	6%	0.061	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	150.2	-174.3	-59.8	-79.9	0	0	0	112.5	I19 F20 T23 D25 D31 L32 I35 Y71	I19-F27 HydrophobicContact CG2-CE2 4.36Å; I19-F27 HydrophobicContact CG2-CZ 4.38Å; F20-F27 AromaticContact CD1-CD2 3.81Å; F20-F27 HydrophobicContact CD1-CD2 3.81Å; F20-F27 HydrophobicContact CD1-CE2 4.09Å; F20-F27 AromaticContact CE1-CD2 3.68Å; F20-F27 HydrophobicContact CE1-CD2 3.68Å; F20-F27 HydrophobicContact CE1-CE2 4.41Å; T23-F27 HydrophobicContact CG2-CZ 4.04Å; T23-F27 VanDerWaalsContact OG1-CE2 3.3Å; T23-F27 WeakPolarHBondContact OG1-CE2 3.44Å; T23-F27 VanDerWaalsContact OG1-CZ 3.24Å; T23-F27 WeakPolarHBondContact OG1-CZ 3.41Å; D25-F27 HydrophobicContact CB-CE1 4.47Å; D25-F27 HydrophobicContact CB-CE2 4.09Å; D25-F27 HydrophobicContact CB-CZ 3.86Å; F27-D31 HydrophobicContact CB-CB 4.42Å; F27-D31 HydrophobicContact CD1-CB 4.14Å; F27-L32 HydrophobicContact CB-CD1 4.02Å; F27-L32 HydrophobicContact CB-CD2 3.88Å; F27-L32 HydrophobicContact CB-CG 3.67Å; F27-L32 HydrophobicContact CD1-CD2 4.43Å; F27-L32 HydrophobicContact CD2-CD2 3.99Å; F27-L32 HydrophobicContact CG-CD2 3.83Å; F27-L32 HydrophobicContact CG-CG 4.18Å; F27-I35 HydrophobicContact CD1-CD1 3.89Å; F27-I35 HydrophobicContact CE1-CD1 3.6Å; F27-Y71 PolarHBondContact N-O 2.94Å; F27-Y71 PolarHBondContact O-N 3.3Å
28	Q	96.3	Very high	94.1	Very high	57 Å²	57	67.6 Å²	67.6	27%	0.266	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	160.7	159.5	-61.6	-175	-11.3	0	0	110	K30 D31 L32 Y70	Q28-K30 PolarHBondContact O-N 3.48Å; Q28-K30 VanDerWaalsContact O-N 3.16Å; Q28-D31 WeakPolarHBondContact CB-OD2 3.31Å; Q28-D31 PolarHBondContact N-OD2 2.95Å; Q28-D31 WeakPolarHBondContact O-CB 3.32Å; Q28-D31 PolarHBondContact O-N 3.47Å; Q28-L32 PolarHBondContact O-N 2.93Å; Q28-Y70 HydrophobicContact CG-CD1 4.25Å; Q28-Y70 HydrophobicContact CG-CE1 4.08Å; Q28-Y70 PolarHBondContact NE2-OH 3.48Å
29	L	95.1	Very high	94	Very high	40 Å²	40	69.7 Å²	69.7	21%	0.209	33%	0.334	C	S	.	.	H	α-helix	trans	-52.9	-40.3	176.9	177.8	61.5	0	0	0	112.2	D31 L32 E33 K48 L51 Y71	L29-D31 PolarHBondContact O-N 2.89Å; L29-L32 PolarHBondContact O-N 3.36Å; L29-E33 HydrophobicContact CD1-CG 4.21Å; L29-E33 HydrophobicContact CG-CG 4.32Å; L29-E33 WeakPolarHBondContact O-CB 3.21Å; L29-E33 VanDerWaalsContact O-CG 3.31Å; L29-E33 WeakPolarHBondContact O-CG 3.48Å; L29-E33 PolarHBondContact O-N 2.98Å; L29-K48 HydrophobicContact CD1-CB 4.25Å; L29-K48 HydrophobicContact CD1-CG 4.35Å; L29-K48 HydrophobicContact CD2-CD 4.27Å; L29-K48 HydrophobicContact CD2-CG 4.22Å; L29-L51 HydrophobicContact CD1-CD2 3.89Å; L29-Y71 HydrophobicContact CB-CE2 4.25Å
30	K	94.3	Very high	93.8	Very high	144 Å²	144	71 Å²	71	63%	0.626	34%	0.34	S	S	*	.	H	α-helix	trans	-63.1	-28.7	179.3	-64.8	-178.4	-178.6	177.3	0	113.4	Q28	Q28-K30 PolarHBondContact O-N 3.48Å; Q28-K30 VanDerWaalsContact O-N 3.16Å
31	D	94.6	Very high	93.6	Very high	60 Å²	60	73.2 Å²	73.2	32%	0.321	36%	0.362	S	S	.	.	H	α-helix	trans	-77.5	-45.6	178.3	-54.2	-43	0	0	0	109.6	F27 Q28 L29 E33 K34 I35	F27-D31 HydrophobicContact CB-CB 4.42Å; F27-D31 HydrophobicContact CD1-CB 4.14Å; Q28-D31 WeakPolarHBondContact CB-OD2 3.31Å; Q28-D31 PolarHBondContact N-OD2 2.95Å; Q28-D31 WeakPolarHBondContact O-CB 3.32Å; Q28-D31 PolarHBondContact O-N 3.47Å; L29-D31 PolarHBondContact O-N 2.89Å; D31-E33 VanDerWaalsContact C-N 3.31Å; D31-E33 PolarHBondContact O-N 3.41Å; D31-K34 WeakPolarHBondContact O-CB 3.42Å; D31-K34 PolarHBondContact O-N 3.49Å; D31-I35 HydrophobicContact CB-CD1 4.39Å; D31-I35 WeakPolarHBondContact O-CG1 3.25Å; D31-I35 PolarHBondContact O-N 2.99Å
32	L	94.3	Very high	93.6	Very high	0 Å²	0	69.4 Å²	69.4	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-63.1	-36.2	176.7	-66.3	170.1	0	0	0	112.2	M16 I19 F20 F27 Q28 L29 K34 I35 A36 V47 L51	M16-L32 HydrophobicContact SD-CD2 4.37Å; I19-L32 HydrophobicContact CG2-CD2 4.42Å; F20-L32 HydrophobicContact CE1-CD1 4.29Å; F20-L32 HydrophobicContact CE1-CD2 4.32Å; F20-L32 HydrophobicContact CZ-CD1 3.72Å; F20-L32 HydrophobicContact CZ-CD2 4.03Å; F27-L32 HydrophobicContact CB-CD1 4.02Å; F27-L32 HydrophobicContact CB-CD2 3.88Å; F27-L32 HydrophobicContact CB-CG 3.67Å; F27-L32 HydrophobicContact CD1-CD2 4.43Å; F27-L32 HydrophobicContact CD2-CD2 3.99Å; F27-L32 HydrophobicContact CG-CD2 3.83Å; F27-L32 HydrophobicContact CG-CG 4.18Å; Q28-L32 PolarHBondContact O-N 2.93Å; L29-L32 PolarHBondContact O-N 3.36Å; L32-K34 PolarHBondContact O-N 2.76Å; L32-I35 PolarHBondContact O-N 3.09Å; L32-A36 WeakPolarHBondContact O-CB 3.37Å; L32-A36 PolarHBondContact O-N 2.6Å; L32-V47 HydrophobicContact CB-CG1 4.23Å; L32-L51 HydrophobicContact CD1-CD1 3.92Å; L32-L51 HydrophobicContact CD1-CD2 3.63Å; L32-L51 HydrophobicContact CD1-CG 4.39Å
33	E	94.9	Very high	93.5	Very high	81 Å²	81	67.5 Å²	67.5	38%	0.379	34%	0.342	S	S	.	.	H	α-helix	trans	-60.9	-21.2	173.6	-77.9	175.5	166	0	0	113.2	L29 D31 P37 V47	L29-E33 HydrophobicContact CD1-CG 4.21Å; L29-E33 HydrophobicContact CG-CG 4.32Å; L29-E33 WeakPolarHBondContact O-CB 3.21Å; L29-E33 VanDerWaalsContact O-CG 3.31Å; L29-E33 WeakPolarHBondContact O-CG 3.48Å; L29-E33 PolarHBondContact O-N 2.98Å; D31-E33 VanDerWaalsContact C-N 3.31Å; D31-E33 PolarHBondContact O-N 3.41Å; E33-P37 VanDerWaalsContact O-CD 3.3Å; E33-P37 WeakPolarHBondContact O-CD 3.35Å; E33-P37 VanDerWaalsContact O-CG 3.3Å; E33-P37 WeakPolarHBondContact O-CG 3.44Å; E33-V47 HydrophobicContact CG-CB 4.43Å; E33-V47 HydrophobicContact CG-CG1 4.09Å
34	K	94.3	Very high	93.4	Very high	152 Å²	152	67.3 Å²	67.3	66%	0.661	35%	0.346	S	S	*	.	H	α-helix	trans	-95.7	-44.4	174.8	-65.3	173.4	-176	172.8	0	112.5	D31 L32 K38	D31-K34 WeakPolarHBondContact O-CB 3.42Å; D31-K34 PolarHBondContact O-N 3.49Å; L32-K34 PolarHBondContact O-N 2.76Å; K34-K38 VanDerWaalsContact O-CB 3.28Å; K34-K38 WeakPolarHBondContact O-CB 3.35Å; K34-K38 PolarHBondContact O-N 3.34Å
35	I	93.6	Very high	93.3	Very high	37 Å²	37	69.5 Å²	69.5	19%	0.19	36%	0.361	C	S	.	.	H	α-helix	trans	-73.4	-46.7	-173.4	-62.4	165.7	0	0	0	110.5	I19 F27 D31 L32 K38 E39	I19-I35 HydrophobicContact CD1-CG2 4.33Å; I19-I35 HydrophobicContact CG2-CG2 3.98Å; F27-I35 HydrophobicContact CD1-CD1 3.89Å; F27-I35 HydrophobicContact CE1-CD1 3.6Å; D31-I35 HydrophobicContact CB-CD1 4.39Å; D31-I35 WeakPolarHBondContact O-CG1 3.25Å; D31-I35 PolarHBondContact O-N 2.99Å; L32-I35 PolarHBondContact O-N 3.09Å; I35-K38 PolarHBondContact O-N 2.88Å; I35-K38 VanDerWaalsContact O-N 3.16Å; I35-E39 HydrophobicContact CG2-CG 4.19Å; I35-E39 PolarHBondContact O-N 3.04Å
36	A	93.6	Very high	93.2	Very high	0 Å²	0	65.6 Å²	65.6	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-63.3	-40.3	-173.6	0	0	0	0	0	114.4	M16 I19 L32 K40 G41 I42 V47	M16-A36 HydrophobicContact CE-CB 3.76Å; M16-A36 HydrophobicContact SD-CB 4.11Å; I19-A36 HydrophobicContact CD1-CB 3.76Å; L32-A36 WeakPolarHBondContact O-CB 3.37Å; L32-A36 PolarHBondContact O-N 2.6Å; A36-K40 CarbonylContact O-C 3.52Å; A36-K40 PolarHBondContact O-N 3.46Å; A36-G41 PolarHBondContact O-N 3.41Å; A36-G41 VanDerWaalsContact O-N 3.15Å; A36-I42 HydrophobicContact CB-CB 4.25Å; A36-I42 HydrophobicContact CB-CD1 4.2Å; A36-I42 PolarHBondContact O-N 3.21Å; A36-I42 VanDerWaalsContact O-N 3.16Å; A36-V47 HydrophobicContact CB-CG1 4.44Å; A36-V47 HydrophobicContact CB-CG2 3.92Å
37	P	93.9	Very high	93.3	Very high	40 Å²	40	62.7 Å²	62.7	26%	0.26	32%	0.323	S	S	.	.	H	α-helix	trans	-69.9	-38.3	172.2	-20.9	34.8	0	0	0	113.4	E33 G41 I42 A44 V47	E33-P37 VanDerWaalsContact O-CD 3.3Å; E33-P37 WeakPolarHBondContact O-CD 3.35Å; E33-P37 VanDerWaalsContact O-CG 3.3Å; E33-P37 WeakPolarHBondContact O-CG 3.44Å; P37-G41 WeakPolarHBondContact O-CA 3.32Å; P37-G41 PolarHBondContact O-N 3.34Å; P37-I42 WeakPolarHBondContact CA-O 3.23Å; P37-I42 VanDerWaalsContact CB-O 3.25Å; P37-I42 WeakPolarHBondContact CB-O 3.43Å; P37-I42 WeakPolarHBondContact CG-O 3.28Å; P37-A44 HydrophobicContact CG-CB 3.97Å; P37-V47 HydrophobicContact CG-CG2 4.09Å
38	K	92.8	Very high	93.2	Very high	179 Å²	179	68.3 Å²	68.3	78%	0.778	35%	0.347	S	S	*	.	H	α-helix	trans	-72	-46.4	-174.8	-175	-177.5	176	-170.3	0	112.5	K34 I35	K34-K38 VanDerWaalsContact O-CB 3.28Å; K34-K38 WeakPolarHBondContact O-CB 3.35Å; K34-K38 PolarHBondContact O-N 3.34Å; I35-K38 PolarHBondContact O-N 2.88Å; I35-K38 VanDerWaalsContact O-N 3.16Å
39	E	92.5	Very high	93.2	Very high	114 Å²	114	72.5 Å²	72.5	53%	0.533	37%	0.367	S	S	.	.	H	α-helix	trans	-95.4	-36.5	-171.2	-64.4	-171.3	-178.7	0	0	112.7	I35	I35-E39 HydrophobicContact CG2-CG 4.19Å; I35-E39 PolarHBondContact O-N 3.04Å
40	K	91.4	Very high	93.3	Very high	28 Å²	28	71 Å²	71	12%	0.122	36%	0.36	C	S	.	.	H	α-helix	trans	-113.8	-3.2	-172.3	-60.4	-63.3	-176.5	170.7	0	113.9	R15 E18 I19 E22 A36 I42	R15-K40 HydrophobicContact CB-CB 4.06Å; R15-K40 HydrophobicContact CB-CG 4.45Å; R15-K40 WeakPolarHBondContact CD-O 3.47Å; R15-K40 PolarHBondContact NH1-O 2.83Å; E18-K40 IonicContact OE2-NZ 2.85Å; E18-K40 PolarHBondContact OE2-NZ 3Å; I19-K40 HydrophobicContact CD1-CB 4.43Å; I19-K40 HydrophobicContact CD1-CG 3.81Å; I19-K40 HydrophobicContact CG1-CD 4.44Å; I19-K40 HydrophobicContact CG1-CG 3.59Å; E22-K40 VanDerWaalsContact CD-NZ 3.27Å; E22-K40 IonicContact OE1-NZ 2.91Å; E22-K40 PolarHBondContact OE1-NZ 3.24Å; E22-K40 WeakPolarHBondContact OE2-CE 3.27Å; E22-K40 IonicContact OE2-NZ 2.87Å; E22-K40 PolarHBondContact OE2-NZ 3.19Å; A36-K40 CarbonylContact O-C 3.52Å; A36-K40 PolarHBondContact O-N 3.46Å; K40-I42 VanDerWaalsContact C-N 3.28Å; K40-I42 HydrophobicContact CB-CD1 4.47Å; K40-I42 HydrophobicContact CB-CG1 4.31Å; K40-I42 PolarHBondContact O-N 3.44Å
41	G	89.7	Confident	93.4	Very high	45 Å²	45	64.3 Å²	64.3	46%	0.464	33%	0.331	S	S	.	.			trans	70.8	19.7	176	0	0	0	0	0	114.3	L7 A36 P37	L7-G41 WeakPolarHBondContact CD1-O 3.33Å; A36-G41 PolarHBondContact O-N 3.41Å; A36-G41 VanDerWaalsContact O-N 3.15Å; P37-G41 WeakPolarHBondContact O-CA 3.32Å; P37-G41 PolarHBondContact O-N 3.34Å
42	I	92.1	Very high	93.5	Very high	1 Å²	1	65.3 Å²	65.3	1%	0.005	33%	0.333	C	S	.	.			trans	-72.3	129.5	176.1	-59.7	179.3	0	0	0	108.4	K12 R15 M16 A36 P37 K40 A44 V47	K12-I42 HydrophobicContact CB-CD1 4.46Å; K12-I42 HydrophobicContact CB-CG1 4.47Å; K12-I42 HydrophobicContact CD-CG2 4.39Å; K12-I42 HydrophobicContact CG-CG1 4.48Å; K12-I42 HydrophobicContact CG-CG2 4.34Å; K12-I42 WeakPolarHBondContact O-CD1 3.23Å; R15-I42 HydrophobicContact CB-CD1 4.2Å; M16-I42 HydrophobicContact CB-CD1 3.99Å; M16-I42 HydrophobicContact CE-CD1 3.9Å; A36-I42 HydrophobicContact CB-CB 4.25Å; A36-I42 HydrophobicContact CB-CD1 4.2Å; A36-I42 PolarHBondContact O-N 3.21Å; A36-I42 VanDerWaalsContact O-N 3.16Å; P37-I42 WeakPolarHBondContact CA-O 3.23Å; P37-I42 VanDerWaalsContact CB-O 3.25Å; P37-I42 WeakPolarHBondContact CB-O 3.43Å; P37-I42 WeakPolarHBondContact CG-O 3.28Å; K40-I42 VanDerWaalsContact C-N 3.28Å; K40-I42 HydrophobicContact CB-CD1 4.47Å; K40-I42 HydrophobicContact CB-CG1 4.31Å; K40-I42 PolarHBondContact O-N 3.44Å; I42-A44 PolarHBondContact O-N 2.87Å; I42-V47 HydrophobicContact CG2-CG2 3.96Å
43	T	91.1	Very high	93.6	Very high	78 Å²	78	67 Å²	67	48%	0.479	35%	0.345	S	S	.	.			trans	-59.5	128.9	178.5	-45.7	0	0	0	0	110.3	M45 S46 V47	T43-M45 VanDerWaalsContact C-N 3.27Å; T43-M45 PolarHBondContact O-N 2.91Å; T43-S46 WeakPolarHBondContact O-CA 3.49Å; T43-S46 PolarHBondContact O-N 3.46Å; T43-S46 PolarHBondContact O-OG 2.99Å; T43-V47 PolarHBondContact O-N 2.78Å
44	A	89.8	Confident	93.6	Very high	58 Å²	58	63.3 Å²	63.3	48%	0.479	33%	0.328	S	S	.	.	G	3₁₀ helix	trans	-51.4	-43	-175.3	0	0	0	0	0	113.3	P37 I42 S46 V47	P37-A44 HydrophobicContact CG-CB 3.97Å; I42-A44 PolarHBondContact O-N 2.87Å; A44-S46 PolarHBondContact O-N 2.85Å; A44-S46 VanDerWaalsContact O-N 3.16Å; A44-V47 PolarHBondContact O-N 3.06Å
45	M	89.8	Confident	93.7	Very high	177 Å²	177	57.6 Å²	57.6	87%	0.872	31%	0.306	S	S	*	.	G	3₁₀ helix	trans	-62.8	-22.3	178	-62.2	-167.8	-60.8	0	0	114	T43	T43-M45 VanDerWaalsContact C-N 3.27Å; T43-M45 PolarHBondContact O-N 2.91Å
46	S	93.1	Very high	93.8	Very high	11 Å²	11	61.1 Å²	61.1	8%	0.077	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-97.3	-6.6	-179.5	61.8	0	0	0	0	114.3	K12 T43 A44 K48 E49 V50	K12-S46 PolarHBondContact NZ-OG 3.47Å; K12-S46 VanDerWaalsContact NZ-OG 3.13Å; T43-S46 WeakPolarHBondContact O-CA 3.49Å; T43-S46 PolarHBondContact O-N 3.46Å; T43-S46 PolarHBondContact O-OG 2.99Å; A44-S46 PolarHBondContact O-N 2.85Å; A44-S46 VanDerWaalsContact O-N 3.16Å; S46-K48 PolarHBondContact O-N 3.17Å; S46-E49 PolarHBondContact O-N 3.22Å; S46-V50 WeakPolarHBondContact O-CB 3.31Å; S46-V50 WeakPolarHBondContact O-CG2 3.49Å; S46-V50 PolarHBondContact O-N 3.43Å
47	V	95.3	Very high	93.7	Very high	0 Å²	0	66 Å²	66	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-59	-47.1	-176.3	168	0	0	0	0	111.4	M16 L32 E33 A36 P37 I42 T43 A44 V50 L51	M16-V47 HydrophobicContact CE-CB 4.41Å; M16-V47 HydrophobicContact CE-CG1 3.85Å; L32-V47 HydrophobicContact CB-CG1 4.23Å; E33-V47 HydrophobicContact CG-CB 4.43Å; E33-V47 HydrophobicContact CG-CG1 4.09Å; A36-V47 HydrophobicContact CB-CG1 4.44Å; A36-V47 HydrophobicContact CB-CG2 3.92Å; P37-V47 HydrophobicContact CG-CG2 4.09Å; I42-V47 HydrophobicContact CG2-CG2 3.96Å; T43-V47 PolarHBondContact O-N 2.78Å; A44-V47 PolarHBondContact O-N 3.06Å; V47-V50 PolarHBondContact O-N 3.03Å; V47-L51 VanDerWaalsContact O-CB 3.31Å; V47-L51 WeakPolarHBondContact O-CB 3.25Å; V47-L51 PolarHBondContact O-N 2.97Å
48	K	95.4	Very high	93.6	Very high	132 Å²	132	66.1 Å²	66.1	57%	0.574	36%	0.36	S	S	*	.	H	α-helix	trans	-62.3	-44.9	-179.5	-174.7	-178.5	178.3	-176	0	112.5	L29 S46 L51 Q52	L29-K48 HydrophobicContact CD1-CB 4.25Å; L29-K48 HydrophobicContact CD1-CG 4.35Å; L29-K48 HydrophobicContact CD2-CD 4.27Å; L29-K48 HydrophobicContact CD2-CG 4.22Å; S46-K48 PolarHBondContact O-N 3.17Å; K48-L51 PolarHBondContact O-N 3.11Å; K48-Q52 WeakPolarHBondContact O-CB 3.3Å; K48-Q52 PolarHBondContact O-N 2.9Å
49	E	96.3	Very high	93.5	Very high	145 Å²	145	62.8 Å²	62.8	68%	0.678	35%	0.348	S	S	*	.	H	α-helix	trans	-65.1	-45.6	179.5	-175.2	-172.8	178.4	0	0	111.6	S46 L51 Q52 S53	S46-E49 PolarHBondContact O-N 3.22Å; E49-L51 PolarHBondContact O-N 3.18Å; E49-Q52 PolarHBondContact O-N 3.4Å; E49-S53 PolarHBondContact O-N 2.86Å
50	V	96.3	Very high	93.6	Very high	10 Å²	10	57.4 Å²	57.4	6%	0.061	32%	0.323	C	S	.	.	H	α-helix	trans	-62.2	-44.8	177.3	172.3	0	0	0	0	110.7	K12 R13 M16 S46 V47 S53 L54	K12-V50 HydrophobicContact CB-CG1 4.16Å; K12-V50 HydrophobicContact CB-CG2 3.76Å; K12-V50 HydrophobicContact CD-CG2 3.99Å; R13-V50 HydrophobicContact CG-CG1 4.07Å; M16-V50 HydrophobicContact CB-CG1 3.94Å; M16-V50 HydrophobicContact CE-CB 4.49Å; M16-V50 HydrophobicContact CE-CG1 4.22Å; M16-V50 HydrophobicContact CG-CG1 4.31Å; S46-V50 WeakPolarHBondContact O-CB 3.31Å; S46-V50 WeakPolarHBondContact O-CG2 3.49Å; S46-V50 PolarHBondContact O-N 3.43Å; V47-V50 PolarHBondContact O-N 3.03Å; V50-S53 PolarHBondContact O-N 2.72Å; V50-S53 PolarHBondContact O-OG 3.36Å; V50-L54 HydrophobicContact CG1-CD1 4.46Å; V50-L54 PolarHBondContact O-N 3.34Å
51	L	96.6	Very high	93.7	Very high	2 Å²	2	58.2 Å²	58.2	1%	0.01	33%	0.329	C	S	.	.	H	α-helix	trans	-60.5	-46.9	176.6	179.6	63.5	0	0	0	111.1	F20 L29 L32 V47 K48 E49 S53 L54 V55 V60 Y71	F20-L51 HydrophobicContact CE2-CD1 4.07Å; F20-L51 HydrophobicContact CZ-CD1 3.79Å; L29-L51 HydrophobicContact CD1-CD2 3.89Å; L32-L51 HydrophobicContact CD1-CD1 3.92Å; L32-L51 HydrophobicContact CD1-CD2 3.63Å; L32-L51 HydrophobicContact CD1-CG 4.39Å; V47-L51 VanDerWaalsContact O-CB 3.31Å; V47-L51 WeakPolarHBondContact O-CB 3.25Å; V47-L51 PolarHBondContact O-N 2.97Å; K48-L51 PolarHBondContact O-N 3.11Å; E49-L51 PolarHBondContact O-N 3.18Å; L51-S53 VanDerWaalsContact C-N 3.34Å; L51-S53 PolarHBondContact O-N 3.23Å; L51-L54 PolarHBondContact O-N 2.94Å; L51-L54 VanDerWaalsContact O-N 3.11Å; L51-V55 WeakPolarHBondContact O-CG2 3.39Å; L51-V55 PolarHBondContact O-N 3.06Å; L51-V60 HydrophobicContact CD1-CG1 4.04Å; L51-Y71 HydrophobicContact CD1-CD1 4.02Å; L51-Y71 HydrophobicContact CD1-CG 4.25Å; L51-Y71 HydrophobicContact CD2-CD1 3.85Å; L51-Y71 HydrophobicContact CD2-CD2 3.95Å; L51-Y71 HydrophobicContact CD2-CE1 3.86Å; L51-Y71 HydrophobicContact CD2-CE2 3.98Å; L51-Y71 HydrophobicContact CD2-CG 3.89Å; L51-Y71 HydrophobicContact CG-CD1 4.04Å; L51-Y71 HydrophobicContact CG-CE1 4.16Å; L51-Y71 HydrophobicContact CG-CG 4.43Å
52	Q	96.1	Very high	94	Very high	81 Å²	81	58.3 Å²	58.3	38%	0.379	32%	0.322	S	S	.	.	H	α-helix	trans	-60.3	-43.9	178.9	-168.5	62.1	53.6	0	0	111.4	K48 E49 L54 V55 D56	K48-Q52 WeakPolarHBondContact O-CB 3.3Å; K48-Q52 PolarHBondContact O-N 2.9Å; E49-Q52 PolarHBondContact O-N 3.4Å; Q52-L54 PolarHBondContact O-N 3.21Å; Q52-V55 PolarHBondContact O-N 3.4Å; Q52-D56 PolarHBondContact NE2-OD1 3.07Å; Q52-D56 PolarHBondContact O-N 3.45Å
53	S	96.7	Very high	94.2	Very high	36 Å²	36	63.4 Å²	63.4	25%	0.252	35%	0.346	S	S	.	.	H	α-helix	trans	-60.5	-27.2	176.5	79.4	0	0	0	0	114.1	R13 E49 V50 L51 D57	R13-S53 PolarHBondContact NE-OG 3.01Å; R13-S53 PolarHBondContact NH2-O 3.5Å; E49-S53 PolarHBondContact O-N 2.86Å; V50-S53 PolarHBondContact O-N 2.72Å; V50-S53 PolarHBondContact O-OG 3.36Å; L51-S53 VanDerWaalsContact C-N 3.34Å; L51-S53 PolarHBondContact O-N 3.23Å; S53-D57 PolarHBondContact O-N 3.31Å
54	L	95.2	Very high	94.5	Very high	4 Å²	4	67 Å²	67	2%	0.021	35%	0.351	C	S	.	.	H	α-helix	trans	-82.8	-32.6	176.8	-72.6	170.2	0	0	0	111.7	R13 M16 M17 V50 L51 Q52 G58 M59 V60	R13-L54 HydrophobicContact CB-CD2 4.03Å; R13-L54 HydrophobicContact CB-CG 4.44Å; R13-L54 HydrophobicContact CG-CD2 4.36Å; R13-L54 HydrophobicContact CG-CG 4.41Å; M16-L54 HydrophobicContact CB-CD1 3.76Å; M16-L54 HydrophobicContact CG-CD1 3.66Å; M17-L54 HydrophobicContact CG-CD1 3.99Å; M17-L54 HydrophobicContact CG-CD2 3.79Å; M17-L54 HydrophobicContact SD-CD1 4.14Å; M17-L54 HydrophobicContact SD-CD2 4.08Å; V50-L54 HydrophobicContact CG1-CD1 4.46Å; V50-L54 PolarHBondContact O-N 3.34Å; L51-L54 PolarHBondContact O-N 2.94Å; L51-L54 VanDerWaalsContact O-N 3.11Å; Q52-L54 PolarHBondContact O-N 3.21Å; L54-G58 PolarHBondContact O-N 2.81Å; L54-M59 HydrophobicContact CB-CB 4.43Å; L54-M59 HydrophobicContact CD2-CB 4.04Å; L54-M59 HydrophobicContact CD2-CG 4.41Å; L54-M59 WeakPolarHBondContact O-CB 3.43Å; L54-M59 PolarHBondContact O-N 2.71Å; L54-V60 HydrophobicContact CB-CB 4.19Å; L54-V60 HydrophobicContact CB-CG2 3.74Å; L54-V60 HydrophobicContact CD1-CG2 4.19Å; L54-V60 PolarHBondContact O-N 2.83Å; L54-V60 VanDerWaalsContact O-N 3.13Å
55	V	95.9	Very high	94.7	Very high	31 Å²	31	69.2 Å²	69.2	19%	0.188	35%	0.353	C	S	.	.	H	α-helix	trans	-69	-44.4	173.8	172.7	0	0	0	0	110.5	L51 Q52 D57 G58 V60 C62 Y71	L51-V55 WeakPolarHBondContact O-CG2 3.39Å; L51-V55 PolarHBondContact O-N 3.06Å; Q52-V55 PolarHBondContact O-N 3.4Å; V55-D57 VanDerWaalsContact C-N 3.27Å; V55-D57 PolarHBondContact O-N 3.37Å; V55-G58 WeakPolarHBondContact O-CA 3.46Å; V55-G58 PolarHBondContact O-N 3.36Å; V55-V60 WeakPolarHBondContact CA-O 3.21Å; V55-V60 HydrophobicContact CG2-CB 4Å; V55-V60 HydrophobicContact CG2-CG1 3.95Å; V55-C62 HydrophobicContact CG1-CB 3.77Å; V55-C62 HydrophobicContact CG2-CB 4.08Å; V55-Y71 HydrophobicContact CG2-CD1 3.85Å; V55-Y71 HydrophobicContact CG2-CE1 3.96Å
56	D	95.5	Very high	95	Very high	111 Å²	111	63.9 Å²	63.9	59%	0.594	34%	0.343	S	S	*	.	H	α-helix	trans	-61.6	-36.7	-179.9	-63.8	-17.3	0	0	0	111.6	Q52 G58	Q52-D56 PolarHBondContact NE2-OD1 3.07Å; Q52-D56 PolarHBondContact O-N 3.45Å; D56-G58 VanDerWaalsContact C-N 3.25Å; D56-G58 PolarHBondContact O-N 3.25Å
57	D	92.9	Very high	95	Very high	103 Å²	103	69.4 Å²	69.4	55%	0.551	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	2.5	174.8	-77.5	3	0	0	0	113.6	R13 S53 V55 M59	R13-D57 IonicContact CZ-OD2 3.4Å; R13-D57 IonicContact NH1-OD2 2.61Å; R13-D57 IonicContact NH2-OD2 2.74Å; R13-D57 PolarHBondContact NH2-OD2 3.16Å; S53-D57 PolarHBondContact O-N 3.31Å; V55-D57 VanDerWaalsContact C-N 3.27Å; V55-D57 PolarHBondContact O-N 3.37Å; D57-M59 HydrophobicContact CB-CG 4.23Å; D57-M59 PolarHBondContact O-N 2.59Å
58	G	90.2	Very high	95	Very high	43 Å²	43	71.1 Å²	71.1	44%	0.443	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.5	11.7	178.4	0	0	0	0	0	115.2	L54 V55 D56 K77	L54-G58 PolarHBondContact O-N 2.81Å; V55-G58 WeakPolarHBondContact O-CA 3.46Å; V55-G58 PolarHBondContact O-N 3.36Å; D56-G58 VanDerWaalsContact C-N 3.25Å; D56-G58 PolarHBondContact O-N 3.25Å; G58-K77 PolarHBondContact O-NZ 3.42Å
59	M	90.9	Very high	95	Very high	108 Å²	108	67.7 Å²	67.7	53%	0.532	38%	0.377	S	S	.	.	S	Bend	trans	-74.7	-34.7	178.1	-65.4	-70.7	-163.8	0	0	111.7	M17 L54 D57 A73	M17-M59 HydrophobicContact CE-CB 4.32Å; M17-M59 HydrophobicContact SD-CB 3.99Å; L54-M59 HydrophobicContact CB-CB 4.43Å; L54-M59 HydrophobicContact CD2-CB 4.04Å; L54-M59 HydrophobicContact CD2-CG 4.41Å; L54-M59 WeakPolarHBondContact O-CB 3.43Å; L54-M59 PolarHBondContact O-N 2.71Å; D57-M59 HydrophobicContact CB-CG 4.23Å; D57-M59 PolarHBondContact O-N 2.59Å; M59-A73 WeakPolarHBondContact O-CB 3.45Å
60	V	94.8	Very high	95.1	Very high	2 Å²	2	64.1 Å²	64.1	1%	0.012	36%	0.358	C	S	.	.	S	Bend	trans	-114.1	131.5	173.2	174.3	0	0	0	0	108.6	M17 F20 L51 L54 V55 Y71 A73	M17-V60 HydrophobicContact SD-CG2 3.58Å; M17-V60 VanDerWaalsContact SD-CG2 3.58Å; F20-V60 HydrophobicContact CD2-CG2 3.89Å; F20-V60 HydrophobicContact CE1-CG1 4.33Å; F20-V60 HydrophobicContact CE2-CG1 4.16Å; F20-V60 HydrophobicContact CE2-CG2 3.63Å; F20-V60 HydrophobicContact CZ-CG1 3.88Å; F20-V60 HydrophobicContact CZ-CG2 4.22Å; L51-V60 HydrophobicContact CD1-CG1 4.04Å; L54-V60 HydrophobicContact CB-CB 4.19Å; L54-V60 HydrophobicContact CB-CG2 3.74Å; L54-V60 HydrophobicContact CD1-CG2 4.19Å; L54-V60 PolarHBondContact O-N 2.83Å; L54-V60 VanDerWaalsContact O-N 3.13Å; V55-V60 WeakPolarHBondContact CA-O 3.21Å; V55-V60 HydrophobicContact CG2-CB 4Å; V55-V60 HydrophobicContact CG2-CG1 3.95Å; V60-Y71 HydrophobicContact CG1-CD1 4.34Å; V60-A73 HydrophobicContact CG2-CB 4.22Å
61	D	94.4	Very high	95.1	Very high	44 Å²	44	64.3 Å²	64.3	24%	0.235	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	144.1	170.1	-71.2	-58.7	0	0	0	110.4	Y71 W72 K77	D61-Y71 VanDerWaalsContact O-CA 3.27Å; D61-Y71 WeakPolarHBondContact O-CA 3.44Å; D61-W72 HydrophobicContact CB-CD2 3.79Å; D61-W72 HydrophobicContact CB-CE3 4.3Å; D61-W72 HydrophobicContact CB-CG 4.25Å; D61-W72 HydrophobicContact CB-CH2 4.16Å; D61-W72 HydrophobicContact CB-CZ2 3.57Å; D61-W72 HydrophobicContact CB-CZ3 4.47Å; D61-W72 PolarHBondContact N-O 3.41Å; D61-W72 PolarHBondContact O-N 3.13Å; D61-W72 VanDerWaalsContact O-N 3.09Å; D61-W72 PolarHBondContact OD2-NE1 2.99Å; D61-K77 WeakPolarHBondContact OD1-CE 3.43Å; D61-K77 IonicContact OD1-NZ 2.84Å; D61-K77 PolarHBondContact OD1-NZ 3.41Å; D61-K77 VanDerWaalsContact OD2-CD 3.24Å; D61-K77 WeakPolarHBondContact OD2-CD 3.41Å; D61-K77 WeakPolarHBondContact OD2-CE 3.32Å; D61-K77 IonicContact OD2-NZ 3.73Å; D61-K77 PolarHBondContact OD2-NZ 2.9Å
62	C	95.8	Very high	95.1	Very high	48 Å²	48	67.1 Å²	67.1	32%	0.324	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	128.1	172.5	177.5	0	0	0	0	108.1	V55 Y70 Y71	V55-C62 HydrophobicContact CG1-CB 3.77Å; V55-C62 HydrophobicContact CG2-CB 4.08Å; C62-Y70 VanDerWaalsContact CA-O 3.32Å; C62-Y70 WeakPolarHBondContact CA-O 3.41Å; C62-Y71 HydrophobicContact CB-CD1 3.78Å; C62-Y71 HydrophobicContact CB-CE1 3.72Å; C62-Y71 WeakPolarHBondContact SG-CE1 3.46Å
63	E	96.8	Very high	95	Very high	107 Å²	107	63.3 Å²	63.3	50%	0.5	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	141.6	173.3	-175.3	63.7	-108.4	0	0	110.1	I65 Y70 W72	E63-I65 HydrophobicContact CG-CG1 4.2Å; E63-Y70 PolarHBondContact N-O 3.23Å; E63-Y70 PolarHBondContact O-N 2.61Å; E63-W72 HydrophobicContact CB-CH2 3.42Å; E63-W72 VanDerWaalsContact CB-CH2 3.42Å; E63-W72 HydrophobicContact CB-CZ3 3.59Å; E63-W72 HydrophobicContact CG-CH2 4.42Å
64	R	95.9	Very high	94.7	Very high	155 Å²	155	65 Å²	65	59%	0.585	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.2	114.4	178.5	-175.1	178.6	179.3	117.3	-4	109.3	G66 N69	R64-G66 PolarHBondContact NE-O 3.34Å; R64-N69 WeakPolarHBondContact CB-OD1 3.07Å; R64-N69 WeakPolarHBondContact CG-OD1 3.24Å
65	I	95.9	Very high	94.3	Very high	103 Å²	103	68.1 Å²	68.1	53%	0.528	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	108.4	176.5	-51.8	174.4	0	0	0	107.8	E63 T67 S68 Y70	E63-I65 HydrophobicContact CG-CG1 4.2Å; I65-T67 PolarHBondContact O-N 3.34Å; I65-S68 PolarHBondContact N-O 2.93Å; I65-S68 PolarHBondContact O-N 3.46Å; I65-Y70 HydrophobicContact CB-CD2 3.81Å; I65-Y70 HydrophobicContact CB-CE2 3.7Å; I65-Y70 HydrophobicContact CD1-CD2 3.97Å; I65-Y70 HydrophobicContact CD1-CE2 4.38Å; I65-Y70 HydrophobicContact CD1-CG 4.41Å; I65-Y70 HydrophobicContact CG1-CD2 3.96Å; I65-Y70 HydrophobicContact CG1-CE2 4.33Å
66	G	95.1	Very high	94	Very high	65 Å²	65	69.4 Å²	69.4	67%	0.67	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.1	-120.5	-173.1	0	0	0	0	0	112.4	R64	R64-G66 PolarHBondContact NE-O 3.34Å
67	T	93.1	Very high	93.5	Very high	127 Å²	127	67.6 Å²	67.6	78%	0.779	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	-4.1	179.6	55.5	0	0	0	0	113.7	I65	I65-T67 PolarHBondContact O-N 3.34Å
68	S	94.4	Very high	93.1	Very high	36 Å²	36	65.6 Å²	65.6	25%	0.252	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	144.5	-170.2	-62.1	0	0	0	0	111.7	I65	I65-S68 PolarHBondContact N-O 2.93Å; I65-S68 PolarHBondContact O-N 3.46Å
69	N	96.6	Very high	93.1	Very high	61 Å²	61	67.7 Å²	67.7	33%	0.326	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	136.5	170.5	-63.4	-29.1	0	0	0	109.5	R64 Y71	R64-N69 WeakPolarHBondContact CB-OD1 3.07Å; R64-N69 WeakPolarHBondContact CG-OD1 3.24Å; N69-Y71 HydrophobicContact CB-CE2 3.81Å
70	Y	97.4	Very high	93.1	Very high	69 Å²	69	67.8 Å²	67.8	27%	0.271	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	134.6	179.1	-68.6	-94.1	0	0	0	109.2	V26 Q28 C62 E63 I65 W72	V26-Y70 HydrophobicContact CG1-CD1 3.96Å; V26-Y70 HydrophobicContact CG1-CG 4.37Å; Q28-Y70 HydrophobicContact CG-CD1 4.25Å; Q28-Y70 HydrophobicContact CG-CE1 4.08Å; Q28-Y70 PolarHBondContact NE2-OH 3.48Å; C62-Y70 VanDerWaalsContact CA-O 3.32Å; C62-Y70 WeakPolarHBondContact CA-O 3.41Å; E63-Y70 PolarHBondContact N-O 3.23Å; E63-Y70 PolarHBondContact O-N 2.61Å; I65-Y70 HydrophobicContact CB-CD2 3.81Å; I65-Y70 HydrophobicContact CB-CE2 3.7Å; I65-Y70 HydrophobicContact CD1-CD2 3.97Å; I65-Y70 HydrophobicContact CD1-CE2 4.38Å; I65-Y70 HydrophobicContact CD1-CG 4.41Å; I65-Y70 HydrophobicContact CG1-CD2 3.96Å; I65-Y70 HydrophobicContact CG1-CE2 4.33Å; Y70-W72 WeakPolarHBondContact O-CZ3 3.46Å
71	Y	97.1	Very high	92.8	Very high	15 Å²	15	70.6 Å²	70.6	6%	0.059	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	134.4	-175.4	-57.9	-89.3	0	0	0	110.3	F27 L29 L51 V55 V60 D61 C62 N69	F27-Y71 PolarHBondContact N-O 2.94Å; F27-Y71 PolarHBondContact O-N 3.3Å; L29-Y71 HydrophobicContact CB-CE2 4.25Å; L51-Y71 HydrophobicContact CD1-CD1 4.02Å; L51-Y71 HydrophobicContact CD1-CG 4.25Å; L51-Y71 HydrophobicContact CD2-CD1 3.85Å; L51-Y71 HydrophobicContact CD2-CD2 3.95Å; L51-Y71 HydrophobicContact CD2-CE1 3.86Å; L51-Y71 HydrophobicContact CD2-CE2 3.98Å; L51-Y71 HydrophobicContact CD2-CG 3.89Å; L51-Y71 HydrophobicContact CG-CD1 4.04Å; L51-Y71 HydrophobicContact CG-CE1 4.16Å; L51-Y71 HydrophobicContact CG-CG 4.43Å; V55-Y71 HydrophobicContact CG2-CD1 3.85Å; V55-Y71 HydrophobicContact CG2-CE1 3.96Å; V60-Y71 HydrophobicContact CG1-CD1 4.34Å; D61-Y71 VanDerWaalsContact O-CA 3.27Å; D61-Y71 WeakPolarHBondContact O-CA 3.44Å; C62-Y71 HydrophobicContact CB-CD1 3.78Å; C62-Y71 HydrophobicContact CB-CE1 3.72Å; C62-Y71 WeakPolarHBondContact SG-CE1 3.46Å; N69-Y71 HydrophobicContact CB-CE2 3.81Å
72	W	95.7	Very high	92.7	Very high	60 Å²	60	77.8 Å²	77.8	23%	0.227	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	157.9	176	68.1	90.3	0	0	0	111.6	V26 D61 E63 Y70 F74	V26-W72 HydrophobicContact CB-CB 4.44Å; V26-W72 HydrophobicContact CG1-CB 4.39Å; V26-W72 HydrophobicContact CG1-CE3 4.15Å; V26-W72 HydrophobicContact CG2-CB 4.02Å; D61-W72 HydrophobicContact CB-CD2 3.79Å; D61-W72 HydrophobicContact CB-CE3 4.3Å; D61-W72 HydrophobicContact CB-CG 4.25Å; D61-W72 HydrophobicContact CB-CH2 4.16Å; D61-W72 HydrophobicContact CB-CZ2 3.57Å; D61-W72 HydrophobicContact CB-CZ3 4.47Å; D61-W72 PolarHBondContact N-O 3.41Å; D61-W72 PolarHBondContact O-N 3.13Å; D61-W72 VanDerWaalsContact O-N 3.09Å; D61-W72 PolarHBondContact OD2-NE1 2.99Å; E63-W72 HydrophobicContact CB-CH2 3.42Å; E63-W72 VanDerWaalsContact CB-CH2 3.42Å; E63-W72 HydrophobicContact CB-CZ3 3.59Å; E63-W72 HydrophobicContact CG-CH2 4.42Å; Y70-W72 WeakPolarHBondContact O-CZ3 3.46Å; W72-F74 HydrophobicContact CB-CE2 4.27Å; W72-F74 AromaticContact CD1-CD2 3.55Å; W72-F74 AromaticContact CD1-CE2 3.35Å; W72-F74 AromaticContact CG-CE2 4Å; W72-F74 HydrophobicContact CG-CE2 4Å
73	A	94.1	Very high	92.7	Very high	2 Å²	2	81.7 Å²	81.7	2%	0.017	43%	0.427	C	S	.	.			trans	-148.6	128.1	167.6	0	0	0	0	0	109.5	M17 F20 F21 M59 V60	M17-A73 HydrophobicContact CE-CB 4.02Å; M17-A73 HydrophobicContact SD-CB 4.49Å; F20-A73 HydrophobicContact CB-CB 3.78Å; F20-A73 HydrophobicContact CG-CB 4.08Å; F21-A73 HydrophobicContact CD1-CB 4.36Å; F21-A73 HydrophobicContact CE1-CB 3.86Å; M59-A73 WeakPolarHBondContact O-CB 3.45Å; V60-A73 HydrophobicContact CG2-CB 4.22Å
74	F	91.5	Very high	92.7	Very high	72 Å²	72	85.7 Å²	85.7	32%	0.316	44%	0.438	S	S	.	.			trans	-112.1	136.4	178.6	-64.9	-71.3	0	0	0	110.9	K24 W72 S76 K77	K24-F74 HydrophobicContact CB-CD1 4.23Å; K24-F74 HydrophobicContact CB-CE1 4.13Å; K24-F74 WeakPolarHBondContact O-CE1 3.31Å; W72-F74 HydrophobicContact CB-CE2 4.27Å; W72-F74 AromaticContact CD1-CD2 3.55Å; W72-F74 AromaticContact CD1-CE2 3.35Å; W72-F74 AromaticContact CG-CE2 4Å; W72-F74 HydrophobicContact CG-CE2 4Å; F74-S76 PolarHBondContact O-N 3.5Å; F74-S76 VanDerWaalsContact O-N 3.07Å; F74-K77 WeakPolarHBondContact O-CB 3.35Å; F74-K77 PolarHBondContact O-N 3.06Å
75	P	87	Confident	92.7	Very high	68 Å²	68	84.3 Å²	84.3	44%	0.442	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-29.2	177.3	-26.1	33.5	0	0	0	113.7	F21 K77	F21-P75 HydrophobicContact CB-CG 4.07Å; F21-P75 HydrophobicContact CD1-CG 3.86Å; F21-P75 HydrophobicContact CD2-CG 4.42Å; F21-P75 HydrophobicContact CE1-CG 4.37Å; F21-P75 HydrophobicContact CG-CG 3.88Å; P75-K77 VanDerWaalsContact C-N 3.35Å; P75-K77 PolarHBondContact O-N 3.07Å
76	S	87.9	Confident	92.8	Very high	58 Å²	58	84 Å²	84	41%	0.406	44%	0.435	S	S	.	.	H	α-helix	trans	-75.6	-18.6	-178.3	60.4	0	0	0	0	113.9	F74 A78 L79 H80	F74-S76 PolarHBondContact O-N 3.5Å; F74-S76 VanDerWaalsContact O-N 3.07Å; S76-A78 PolarHBondContact O-N 3.06Å; S76-L79 PolarHBondContact O-N 2.87Å; S76-H80 PolarHBondContact O-CD2 3.19Å; S76-H80 PolarHBondContact O-N 2.93Å
77	K	86.3	Confident	92.9	Very high	73 Å²	73	87.1 Å²	87.1	32%	0.317	43%	0.432	S	S	.	.	H	α-helix	trans	-58.2	-49.4	-174	-177.5	-170.7	178.3	-171.7	0	112.2	G58 D61 F74 P75 L79 H80 A81	G58-K77 PolarHBondContact O-NZ 3.42Å; D61-K77 WeakPolarHBondContact OD1-CE 3.43Å; D61-K77 IonicContact OD1-NZ 2.84Å; D61-K77 PolarHBondContact OD1-NZ 3.41Å; D61-K77 VanDerWaalsContact OD2-CD 3.24Å; D61-K77 WeakPolarHBondContact OD2-CD 3.41Å; D61-K77 WeakPolarHBondContact OD2-CE 3.32Å; D61-K77 IonicContact OD2-NZ 3.73Å; D61-K77 PolarHBondContact OD2-NZ 2.9Å; F74-K77 WeakPolarHBondContact O-CB 3.35Å; F74-K77 PolarHBondContact O-N 3.06Å; P75-K77 VanDerWaalsContact C-N 3.35Å; P75-K77 PolarHBondContact O-N 3.07Å; K77-L79 VanDerWaalsContact C-N 3.27Å; K77-L79 PolarHBondContact O-N 3.24Å; K77-H80 PolarHBondContact O-N 3.35Å; K77-A81 WeakPolarHBondContact O-CB 3.32Å; K77-A81 PolarHBondContact O-N 3.41Å
78	A	85.1	Confident	93.1	Very high	61 Å²	61	84.2 Å²	84.2	50%	0.504	41%	0.414	S	S	.	.	H	α-helix	trans	-60.8	-39.2	-179.5	0	0	0	0	0	111.8	S76 R82	S76-A78 PolarHBondContact O-N 3.06Å; A78-R82 VanDerWaalsContact O-CG 3.32Å; A78-R82 WeakPolarHBondContact O-CG 3.37Å; A78-R82 PolarHBondContact O-N 2.98Å; A78-R82 VanDerWaalsContact O-N 3.11Å
79	L	89.6	Confident	93.3	Very high	88 Å²	88	86.6 Å²	86.6	46%	0.461	42%	0.423	S	S	.	.	H	α-helix	trans	-66.4	-47	176.6	178.5	147.9	0	0	0	111.4	S76 K77 R82 K83	S76-L79 PolarHBondContact O-N 2.87Å; K77-L79 VanDerWaalsContact C-N 3.27Å; K77-L79 PolarHBondContact O-N 3.24Å; L79-R82 PolarHBondContact O-N 3.41Å; L79-K83 HydrophobicContact CD2-CD 3.8Å; L79-K83 HydrophobicContact CD2-CG 4.36Å; L79-K83 WeakPolarHBondContact O-CG 3.41Å; L79-K83 PolarHBondContact O-N 3.45Å
80	H	90.9	Very high	93.4	Very high	110 Å²	110	89 Å²	89	51%	0.509	43%	0.433	S	S	.	.	H	α-helix	trans	-65.7	-39.8	179.1	-71.8	-61.8	0	0	0	112.5	S76 K77 R82 K83 R84	S76-H80 PolarHBondContact O-CD2 3.19Å; S76-H80 PolarHBondContact O-N 2.93Å; K77-H80 PolarHBondContact O-N 3.35Å; H80-R82 PolarHBondContact O-N 3.28Å; H80-K83 PolarHBondContact O-N 3.48Å; H80-R84 WeakPolarHBondContact O-CB 3.46Å; H80-R84 PolarHBondContact O-N 2.91Å
81	A	89.1	Confident	93.4	Very high	61 Å²	61	88.7 Å²	88.7	50%	0.504	44%	0.44	S	S	.	.	H	α-helix	trans	-60.3	-45.5	175.4	0	0	0	0	0	111.5	K77 K85	K77-A81 WeakPolarHBondContact O-CB 3.32Å; K77-A81 PolarHBondContact O-N 3.41Å; A81-K85 WeakPolarHBondContact O-CB 3.31Å; A81-K85 PolarHBondContact O-N 3.49Å
82	R	92.3	Very high	93.4	Very high	195 Å²	195	93.2 Å²	93.2	74%	0.736	46%	0.462	S	S	*	.	H	α-helix	trans	-64.3	-43.7	175.7	-72.8	177	-177	-177.3	2.1	112.3	A78 L79 H80 K85 L86	A78-R82 VanDerWaalsContact O-CG 3.32Å; A78-R82 WeakPolarHBondContact O-CG 3.37Å; A78-R82 PolarHBondContact O-N 2.98Å; A78-R82 VanDerWaalsContact O-N 3.11Å; L79-R82 PolarHBondContact O-N 3.41Å; H80-R82 PolarHBondContact O-N 3.28Å; R82-K85 PolarHBondContact O-N 3.37Å; R82-L86 WeakPolarHBondContact O-CB 3.46Å; R82-L86 PolarHBondContact O-N 3.06Å
83	K	95.8	Very high	93.5	Very high	130 Å²	130	96.1 Å²	96.1	57%	0.565	48%	0.481	S	S	*	.	H	α-helix	trans	-60.3	-47.8	176.5	-78.4	-172.6	175.2	-175.3	0	112.2	L79 H80 K85 L86 E87	L79-K83 HydrophobicContact CD2-CD 3.8Å; L79-K83 HydrophobicContact CD2-CG 4.36Å; L79-K83 WeakPolarHBondContact O-CG 3.41Å; L79-K83 PolarHBondContact O-N 3.45Å; H80-K83 PolarHBondContact O-N 3.48Å; K83-K85 VanDerWaalsContact C-N 3.3Å; K83-K85 PolarHBondContact O-N 3.11Å; K83-L86 WeakPolarHBondContact O-CB 3.5Å; K83-L86 PolarHBondContact O-N 3.01Å; K83-E87 PolarHBondContact O-N 3.08Å
84	R	95.8	Very high	93.7	Very high	190 Å²	190	99.7 Å²	99.7	72%	0.717	51%	0.506	S	S	*	.	H	α-helix	trans	-60.8	-41.6	176.3	-176.2	-179.4	-72.6	174.2	-3.1	111.3	H80 L86 E87 V88	H80-R84 WeakPolarHBondContact O-CB 3.46Å; H80-R84 PolarHBondContact O-N 2.91Å; R84-L86 VanDerWaalsContact C-N 3.32Å; R84-L86 PolarHBondContact O-N 3.33Å; R84-E87 PolarHBondContact O-N 2.92Å; R84-V88 VanDerWaalsContact O-CG2 3.31Å; R84-V88 WeakPolarHBondContact O-CG2 3.39Å; R84-V88 PolarHBondContact O-N 2.9Å
85	K	96.2	Very high	94	Very high	127 Å²	127	100.9 Å²	100.9	55%	0.552	51%	0.513	S	S	*	.	H	α-helix	trans	-63.6	-40.4	177.4	-174.2	60.4	177.9	179.6	0	111.7	A81 R82 K83 L89	A81-K85 WeakPolarHBondContact O-CB 3.31Å; A81-K85 PolarHBondContact O-N 3.49Å; R82-K85 PolarHBondContact O-N 3.37Å; K83-K85 VanDerWaalsContact C-N 3.3Å; K83-K85 PolarHBondContact O-N 3.11Å; K85-L89 HydrophobicContact CG-CD1 4.16Å; K85-L89 WeakPolarHBondContact O-CB 3.29Å; K85-L89 VanDerWaalsContact O-CG 3.26Å; K85-L89 WeakPolarHBondContact O-CG 3.37Å; K85-L89 PolarHBondContact O-N 2.83Å
86	L	97.4	Very high	94.6	Very high	95 Å²	95	99.5 Å²	99.5	50%	0.497	51%	0.511	S	S	.	.	H	α-helix	trans	-63.1	-48.8	176.5	-179.3	142.5	0	0	0	111.2	R82 K83 R84 V88 L89 E90	R82-L86 WeakPolarHBondContact O-CB 3.46Å; R82-L86 PolarHBondContact O-N 3.06Å; K83-L86 WeakPolarHBondContact O-CB 3.5Å; K83-L86 PolarHBondContact O-N 3.01Å; R84-L86 VanDerWaalsContact C-N 3.32Å; R84-L86 PolarHBondContact O-N 3.33Å; L86-V88 VanDerWaalsContact C-N 3.32Å; L86-V88 PolarHBondContact O-N 2.97Å; L86-L89 PolarHBondContact O-N 3.2Å; L86-L89 VanDerWaalsContact O-N 3.08Å; L86-E90 HydrophobicContact CD2-CG 4.24Å; L86-E90 VanDerWaalsContact CD2-OE1 3.28Å; L86-E90 WeakPolarHBondContact CD2-OE1 3.43Å; L86-E90 WeakPolarHBondContact CD2-OE2 3.28Å; L86-E90 HydrophobicContact CG-CG 4.49Å; L86-E90 WeakPolarHBondContact O-CG 3.26Å; L86-E90 PolarHBondContact O-N 3.45Å
87	E	97.8	Very high	95	Very high	132 Å²	132	99.9 Å²	99.9	62%	0.617	51%	0.514	S	S	*	.	H	α-helix	trans	-57.5	-43.1	177	-176.2	178.8	-169.2	0	0	112.3	K83 R84 E90 S91	K83-E87 PolarHBondContact O-N 3.08Å; R84-E87 PolarHBondContact O-N 2.92Å; E87-E90 PolarHBondContact O-N 3.03Å; E87-S91 WeakPolarHBondContact O-CB 3.33Å; E87-S91 PolarHBondContact O-N 3.34Å
88	V	97.9	Very high	95.6	Very high	65 Å²	65	103.2 Å²	103.2	39%	0.394	53%	0.53	S	S	.	.	H	α-helix	trans	-62.3	-44.4	175.1	170.2	0	0	0	0	111.4	R84 L86 S91 Q92	R84-V88 VanDerWaalsContact O-CG2 3.31Å; R84-V88 WeakPolarHBondContact O-CG2 3.39Å; R84-V88 PolarHBondContact O-N 2.9Å; L86-V88 VanDerWaalsContact C-N 3.32Å; L86-V88 PolarHBondContact O-N 2.97Å; V88-S91 PolarHBondContact O-N 3.41Å; V88-Q92 VanDerWaalsContact O-CG 3.29Å; V88-Q92 WeakPolarHBondContact O-CG 3.47Å; V88-Q92 PolarHBondContact O-N 2.95Å
89	L	97.9	Very high	96.2	Very high	87 Å²	87	106.2 Å²	106.2	46%	0.455	53%	0.532	S	S	.	.	H	α-helix	trans	-67.2	-38.5	179.4	-72.6	171.4	0	0	0	112	K85 L86 Q92 L93	K85-L89 HydrophobicContact CG-CD1 4.16Å; K85-L89 WeakPolarHBondContact O-CB 3.29Å; K85-L89 VanDerWaalsContact O-CG 3.26Å; K85-L89 WeakPolarHBondContact O-CG 3.37Å; K85-L89 PolarHBondContact O-N 2.83Å; L86-L89 PolarHBondContact O-N 3.2Å; L86-L89 VanDerWaalsContact O-N 3.08Å; L89-Q92 PolarHBondContact O-N 3.39Å; L89-L93 WeakPolarHBondContact O-CB 3.46Å; L89-L93 PolarHBondContact O-N 2.97Å
90	E	98.2	Very high	96.6	Very high	112 Å²	112	107.7 Å²	107.7	52%	0.523	54%	0.536	S	S	.	.	H	α-helix	trans	-63.9	-43.5	175.5	-74.3	177.5	158.4	0	0	111.6	L86 E87 L93 S94	L86-E90 HydrophobicContact CD2-CG 4.24Å; L86-E90 VanDerWaalsContact CD2-OE1 3.28Å; L86-E90 WeakPolarHBondContact CD2-OE1 3.43Å; L86-E90 WeakPolarHBondContact CD2-OE2 3.28Å; L86-E90 HydrophobicContact CG-CG 4.49Å; L86-E90 WeakPolarHBondContact O-CG 3.26Å; L86-E90 PolarHBondContact O-N 3.45Å; E87-E90 PolarHBondContact O-N 3.03Å; E90-L93 PolarHBondContact O-N 3.28Å; E90-S94 WeakPolarHBondContact O-CB 3.5Å; E90-S94 PolarHBondContact O-N 3.43Å
91	S	97.9	Very high	96.9	Very high	61 Å²	61	104.6 Å²	104.6	43%	0.427	53%	0.53	S	S	.	.	H	α-helix	trans	-59.8	-47.6	173.7	169.4	0	0	0	0	111.6	E87 V88 L93 S94 E95	E87-S91 WeakPolarHBondContact O-CB 3.33Å; E87-S91 PolarHBondContact O-N 3.34Å; V88-S91 PolarHBondContact O-N 3.41Å; S91-L93 VanDerWaalsContact C-N 3.34Å; S91-L93 PolarHBondContact O-N 2.92Å; S91-S94 WeakPolarHBondContact O-CB 3.4Å; S91-S94 PolarHBondContact O-N 2.88Å; S91-E95 WeakPolarHBondContact O-CG 3.28Å; S91-E95 PolarHBondContact O-N 3.35Å
92	Q	97.9	Very high	97.3	Very high	111 Å²	111	104.6 Å²	104.6	52%	0.519	53%	0.527	S	S	.	.	H	α-helix	trans	-62.1	-40.5	177.4	-73.5	176.8	-13.9	0	0	112.6	V88 L89 G96	V88-Q92 VanDerWaalsContact O-CG 3.29Å; V88-Q92 WeakPolarHBondContact O-CG 3.47Å; V88-Q92 PolarHBondContact O-N 2.95Å; L89-Q92 PolarHBondContact O-N 3.39Å; Q92-G96 PolarHBondContact O-N 3.26Å
93	L	98.1	Very high	97.5	Very high	121 Å²	121	100.5 Å²	100.5	63%	0.634	52%	0.518	S	S	*	.	H	α-helix	trans	-64.6	-43.3	177	-178.9	65.8	0	0	0	111.4	L89 E90 S91 G96 S97	L89-L93 WeakPolarHBondContact O-CB 3.46Å; L89-L93 PolarHBondContact O-N 2.97Å; E90-L93 PolarHBondContact O-N 3.28Å; S91-L93 VanDerWaalsContact C-N 3.34Å; S91-L93 PolarHBondContact O-N 2.92Å; L93-G96 PolarHBondContact O-N 2.74Å; L93-S97 VanDerWaalsContact O-CB 3.28Å; L93-S97 WeakPolarHBondContact O-CB 3.48Å; L93-S97 PolarHBondContact O-N 3.43Å; L93-S97 PolarHBondContact O-OG 3.44Å
94	S	98.1	Very high	97.6	Very high	77 Å²	77	99.8 Å²	99.8	54%	0.538	52%	0.517	S	S	.	.	H	α-helix	trans	-60.6	-50.8	176.7	-179.1	0	0	0	0	111.3	E90 S91 G96 S97 Q98	E90-S94 WeakPolarHBondContact O-CB 3.5Å; E90-S94 PolarHBondContact O-N 3.43Å; S91-S94 WeakPolarHBondContact O-CB 3.4Å; S91-S94 PolarHBondContact O-N 2.88Å; S94-G96 PolarHBondContact O-N 2.88Å; S94-S97 PolarHBondContact O-N 2.9Å; S94-Q98 PolarHBondContact O-N 2.95Å
95	E	97.9	Very high	97.6	Very high	96 Å²	96	97.8 Å²	97.8	45%	0.449	51%	0.514	S	S	.	.	H	α-helix	trans	-60.3	-44.6	177	-73.1	-176.1	-167.8	0	0	112.4	S91 S97 Q98 K99	S91-E95 WeakPolarHBondContact O-CG 3.28Å; S91-E95 PolarHBondContact O-N 3.35Å; E95-S97 VanDerWaalsContact C-N 3.34Å; E95-S97 PolarHBondContact O-N 3.39Å; E95-Q98 PolarHBondContact O-N 3.49Å; E95-K99 WeakPolarHBondContact O-CB 3.33Å; E95-K99 WeakPolarHBondContact O-CG 3.46Å; E95-K99 PolarHBondContact O-N 2.94Å
96	G	97.9	Very high	97.5	Very high	40 Å²	40	95.1 Å²	95.1	41%	0.412	51%	0.511	S	S	.	.	H	α-helix	trans	-60.7	-44	177.3	0	0	0	0	0	112	Q92 L93 S94 K99 H100	Q92-G96 PolarHBondContact O-N 3.26Å; L93-G96 PolarHBondContact O-N 2.74Å; S94-G96 PolarHBondContact O-N 2.88Å; G96-K99 PolarHBondContact O-N 3.45Å; G96-H100 WeakPolarHBondContact O-CB 3.4Å; G96-H100 PolarHBondContact O-N 3.38Å
97	S	97.8	Very high	97.2	Very high	66 Å²	66	95 Å²	95	46%	0.462	51%	0.51	S	S	.	.	H	α-helix	trans	-64.4	-42.5	178.3	-60.4	0	0	0	0	111.9	L93 S94 E95 H100 A101	L93-S97 VanDerWaalsContact O-CB 3.28Å; L93-S97 WeakPolarHBondContact O-CB 3.48Å; L93-S97 PolarHBondContact O-N 3.43Å; L93-S97 PolarHBondContact O-OG 3.44Å; S94-S97 PolarHBondContact O-N 2.9Å; E95-S97 VanDerWaalsContact C-N 3.34Å; E95-S97 PolarHBondContact O-N 3.39Å; S97-H100 PolarHBondContact O-N 2.97Å; S97-A101 WeakPolarHBondContact O-CB 3.4Å; S97-A101 PolarHBondContact O-N 2.89Å
98	Q	97.8	Very high	96.9	Very high	142 Å²	142	94 Å²	94	66%	0.664	51%	0.505	S	S	*	.	H	α-helix	trans	-64.4	-44.4	176.7	-170	-179.5	16.6	0	0	111.5	S94 E95 A101 S102	S94-Q98 PolarHBondContact O-N 2.95Å; E95-Q98 PolarHBondContact O-N 3.49Å; Q98-A101 PolarHBondContact O-N 3.4Å; Q98-S102 WeakPolarHBondContact O-CB 3.46Å; Q98-S102 PolarHBondContact O-N 3.21Å
99	K	97.9	Very high	96.5	Very high	125 Å²	125	98.6 Å²	98.6	54%	0.543	52%	0.52	S	S	.	.	H	α-helix	trans	-59.7	-47.7	175.1	-75.4	172.1	-175.7	165.9	0	111	E95 G96 A101 S102 L103	E95-K99 WeakPolarHBondContact O-CB 3.33Å; E95-K99 WeakPolarHBondContact O-CG 3.46Å; E95-K99 PolarHBondContact O-N 2.94Å; G96-K99 PolarHBondContact O-N 3.45Å; K99-A101 PolarHBondContact O-N 2.93Å; K99-S102 PolarHBondContact O-N 2.71Å; K99-S102 PolarHBondContact O-OG 3.38Å; K99-L103 WeakPolarHBondContact O-CG 3.48Å; K99-L103 PolarHBondContact O-N 2.97Å
100	H	97.6	Very high	96	Very high	118 Å²	118	96.2 Å²	96.2	55%	0.546	51%	0.513	S	S	.	.	H	α-helix	trans	-56.2	-50.7	176.7	-179.6	-87.4	0	0	0	111.9	G96 S97 S102 L103 Q104	G96-H100 WeakPolarHBondContact O-CB 3.4Å; G96-H100 PolarHBondContact O-N 3.38Å; S97-H100 PolarHBondContact O-N 2.97Å; H100-S102 VanDerWaalsContact C-N 3.3Å; H100-S102 PolarHBondContact O-N 3.11Å; H100-L103 PolarHBondContact O-N 3.05Å; H100-Q104 PolarHBondContact CE1-OE1 3.09Å; H100-Q104 WeakPolarHBondContact O-CB 3.49Å; H100-Q104 PolarHBondContact O-N 3.13Å
101	A	97.9	Very high	95.4	Very high	46 Å²	46	96.3 Å²	96.3	38%	0.38	51%	0.511	S	S	.	.	H	α-helix	trans	-60.1	-39.6	178.6	0	0	0	0	0	112.4	S97 Q98 K99 K105	S97-A101 WeakPolarHBondContact O-CB 3.4Å; S97-A101 PolarHBondContact O-N 2.89Å; Q98-A101 PolarHBondContact O-N 3.4Å; K99-A101 PolarHBondContact O-N 2.93Å; A101-K105 WeakPolarHBondContact O-CG 3.39Å; A101-K105 PolarHBondContact O-N 2.84Å; A101-K105 VanDerWaalsContact O-N 3.13Å
102	S	97.3	Very high	94.6	Very high	61 Å²	61	99.7 Å²	99.7	43%	0.427	52%	0.523	S	S	.	.	H	α-helix	trans	-66.2	-42.8	177.1	76.4	0	0	0	0	112.4	Q98 K99 H100 K105 S106	Q98-S102 WeakPolarHBondContact O-CB 3.46Å; Q98-S102 PolarHBondContact O-N 3.21Å; K99-S102 PolarHBondContact O-N 2.71Å; K99-S102 PolarHBondContact O-OG 3.38Å; H100-S102 VanDerWaalsContact C-N 3.3Å; H100-S102 PolarHBondContact O-N 3.11Å; S102-K105 PolarHBondContact O-N 3.43Å; S102-S106 PolarHBondContact O-N 3.23Å; S102-S106 PolarHBondContact O-OG 3.2Å
103	L	97.2	Very high	93.3	Very high	108 Å²	108	97.8 Å²	97.8	57%	0.565	53%	0.533	S	S	*	.	H	α-helix	trans	-66.2	-41.7	178	-73.7	171.8	0	0	0	111.2	K99 H100 K105 S106 I107	K99-L103 WeakPolarHBondContact O-CG 3.48Å; K99-L103 PolarHBondContact O-N 2.97Å; H100-L103 PolarHBondContact O-N 3.05Å; L103-K105 VanDerWaalsContact C-N 3.33Å; L103-K105 PolarHBondContact O-N 3.4Å; L103-S106 WeakPolarHBondContact O-CB 3.35Å; L103-S106 PolarHBondContact O-N 2.9Å; L103-S106 VanDerWaalsContact O-N 3.11Å; L103-I107 WeakPolarHBondContact O-CG1 3.42Å; L103-I107 PolarHBondContact O-N 3.34Å
104	Q	96.6	Very high	92.1	Very high	115 Å²	115	99.8 Å²	99.8	54%	0.537	53%	0.533	S	S	.	.	H	α-helix	trans	-62.8	-40.6	178	-166.7	168.7	-4.5	0	0	111.7	H100 S106 I107 E108	H100-Q104 PolarHBondContact CE1-OE1 3.09Å; H100-Q104 WeakPolarHBondContact O-CB 3.49Å; H100-Q104 PolarHBondContact O-N 3.13Å; Q104-S106 VanDerWaalsContact C-N 3.35Å; Q104-S106 PolarHBondContact O-N 2.98Å; Q104-I107 PolarHBondContact O-N 2.99Å; Q104-E108 PolarHBondContact O-N 3.49Å
105	K	95.6	Very high	91	Very high	149 Å²	149	99.4 Å²	99.4	65%	0.648	53%	0.529	S	S	*	.	H	α-helix	trans	-61.7	-41.2	171.7	-73.7	176.7	-178.7	-179.9	0	112.3	A101 S102 L103 E108 K109	A101-K105 WeakPolarHBondContact O-CG 3.39Å; A101-K105 PolarHBondContact O-N 2.84Å; A101-K105 VanDerWaalsContact O-N 3.13Å; S102-K105 PolarHBondContact O-N 3.43Å; L103-K105 VanDerWaalsContact C-N 3.33Å; L103-K105 PolarHBondContact O-N 3.4Å; K105-E108 PolarHBondContact O-N 3.03Å; K105-K109 WeakPolarHBondContact O-CG 3.38Å; K105-K109 PolarHBondContact O-N 3.42Å
106	S	94.3	Very high	89.7	Confident	71 Å²	71	101.6 Å²	101.6	50%	0.497	54%	0.539	S	S	.	.	H	α-helix	trans	-66.5	-39.6	177.5	-66.1	0	0	0	0	112.4	S102 L103 Q104 K109 A110	S102-S106 PolarHBondContact O-N 3.23Å; S102-S106 PolarHBondContact O-OG 3.2Å; L103-S106 WeakPolarHBondContact O-CB 3.35Å; L103-S106 PolarHBondContact O-N 2.9Å; L103-S106 VanDerWaalsContact O-N 3.11Å; Q104-S106 VanDerWaalsContact C-N 3.35Å; Q104-S106 PolarHBondContact O-N 2.98Å; S106-K109 PolarHBondContact O-N 3.37Å; S106-A110 WeakPolarHBondContact O-CB 3.37Å; S106-A110 PolarHBondContact O-N 3.48Å
107	I	92.2	Very high	89.1	Confident	93 Å²	93	102.7 Å²	102.7	48%	0.477	54%	0.538	S	S	.	.	H	α-helix	trans	-61.4	-47.1	173.9	-71.7	167.2	0	0	0	110.1	L103 Q104 K109 A110 K111	L103-I107 WeakPolarHBondContact O-CG1 3.42Å; L103-I107 PolarHBondContact O-N 3.34Å; Q104-I107 PolarHBondContact O-N 2.99Å; I107-K109 PolarHBondContact O-N 3.47Å; I107-A110 PolarHBondContact O-N 3.34Å; I107-A110 VanDerWaalsContact O-N 3.15Å; I107-K111 HydrophobicContact CG2-CD 4.11Å; I107-K111 HydrophobicContact CG2-CG 4.33Å; I107-K111 WeakPolarHBondContact O-CG 3.48Å; I107-K111 PolarHBondContact O-N 3.47Å
108	E	90.3	Very high	88.5	Confident	110 Å²	110	107.9 Å²	107.9	51%	0.514	56%	0.555	S	S	.	*	H	α-helix	trans	-62.2	-44.6	-179.5	-166.1	57.3	-149.9	0	0	111.7	Q104 K105 A110 K111 I112	Q104-E108 PolarHBondContact O-N 3.49Å; K105-E108 PolarHBondContact O-N 3.03Å; E108-A110 VanDerWaalsContact C-N 3.31Å; E108-A110 PolarHBondContact O-N 3.2Å; E108-K111 PolarHBondContact O-N 3.15Å; E108-I112 PolarHBondContact O-N 3.36Å
109	K	90	Very high	88	Confident	161 Å²	161	106.7 Å²	106.7	70%	0.7	55%	0.55	S	S	*	.	H	α-helix	trans	-58.1	-41.8	173.1	-73.7	179.5	179	-174.2	0	112.6	K105 S106 I107	K105-K109 WeakPolarHBondContact O-CG 3.38Å; K105-K109 PolarHBondContact O-N 3.42Å; S106-K109 PolarHBondContact O-N 3.37Å; I107-K109 PolarHBondContact O-N 3.47Å
110	A	87.2	Confident	87.5	Confident	37 Å²	37	105.6 Å²	105.6	31%	0.306	54%	0.542	S	S	.	.	H	α-helix	trans	-71.2	-30.6	179.6	0	0	0	0	0	113	S106 I107 E108 R114	S106-A110 WeakPolarHBondContact O-CB 3.37Å; S106-A110 PolarHBondContact O-N 3.48Å; I107-A110 PolarHBondContact O-N 3.34Å; I107-A110 VanDerWaalsContact O-N 3.15Å; E108-A110 VanDerWaalsContact C-N 3.31Å; E108-A110 PolarHBondContact O-N 3.2Å; A110-R114 WeakPolarHBondContact O-CB 3.5Å; A110-R114 WeakPolarHBondContact O-CG 3.38Å; A110-R114 PolarHBondContact O-N 2.88Å
111	K	85.7	Confident	87	Confident	114 Å²	114	103 Å²	103	50%	0.496	53%	0.534	S	S	.	.	H	α-helix	trans	-66.4	-38.1	177.7	-80.4	178.2	176.7	180	0	112.4	I107 E108 G113 R114 C115	I107-K111 HydrophobicContact CG2-CD 4.11Å; I107-K111 HydrophobicContact CG2-CG 4.33Å; I107-K111 WeakPolarHBondContact O-CG 3.48Å; I107-K111 PolarHBondContact O-N 3.47Å; E108-K111 PolarHBondContact O-N 3.15Å; K111-G113 PolarHBondContact O-N 2.94Å; K111-G113 VanDerWaalsContact O-N 3.12Å; K111-R114 CarbonylContact O-C 3.59Å; K111-R114 VanDerWaalsContact O-C 3.32Å; K111-R114 PolarHBondContact O-N 3.49Å; K111-C115 PolarHBondContact O-N 2.62Å; K111-C115 PolarHBondContact O-SG 3.42Å
112	I	80.9	Confident	86.8	Confident	132 Å²	132	108.1 Å²	108.1	68%	0.677	54%	0.544	S	S	*	.	H	α-helix	trans	-52.2	-39.4	-179.2	-64.6	167.4	0	0	0	111.9	E108	E108-I112 PolarHBondContact O-N 3.36Å
113	G	71.8	Confident	86.6	Confident	71 Å²	71	109.3 Å²	109.3	73%	0.732	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.4	-1.8	177.9	0	0	0	0	0	115.4	K111	K111-G113 PolarHBondContact O-N 2.94Å; K111-G113 VanDerWaalsContact O-N 3.12Å
114	R	72.9	Confident	86.3	Confident	164 Å²	164	106.9 Å²	106.9	62%	0.619	54%	0.541	S	S	*	.	S	Bend	trans	-132.7	31.8	-175.5	-60.3	-177.1	-172.6	134.1	2.2	111.9	A110 K111 E116 R120	A110-R114 WeakPolarHBondContact O-CB 3.5Å; A110-R114 WeakPolarHBondContact O-CG 3.38Å; A110-R114 PolarHBondContact O-N 2.88Å; K111-R114 CarbonylContact O-C 3.59Å; K111-R114 VanDerWaalsContact O-C 3.32Å; K111-R114 PolarHBondContact O-N 3.49Å; R114-E116 PolarHBondContact O-N 3.47Å; R114-R120 PolarHBondContact O-NH1 3.1Å
115	C	74.1	Confident	86.2	Confident	69 Å²	69	109 Å²	109	47%	0.466	55%	0.549	S	S	.	.			trans	-59.1	132.1	172.2	-69.1	0	0	0	0	109.2	K111 T117 R120	K111-C115 PolarHBondContact O-N 2.62Å; K111-C115 PolarHBondContact O-SG 3.42Å; C115-T117 HydrophobicContact CB-CG2 3.92Å; C115-T117 PolarHBondContact O-N 3.04Å; C115-R120 WeakPolarHBondContact O-CD 3.41Å
116	E	71.3	Confident	86.3	Confident	141 Å²	141	106.9 Å²	106.9	66%	0.659	54%	0.541	S	S	*	.			trans	-73	84.9	167.4	-71.5	-60	143	0	0	107.5	R114 R120	R114-E116 PolarHBondContact O-N 3.47Å; E116-R120 IonicContact OE1-CZ 3.93Å; E116-R120 IonicContact OE1-NH1 2.99Å; E116-R120 PolarHBondContact OE1-NH1 2.84Å; E116-R120 IonicContact OE1-NH2 2.61Å
117	T	84.1	Confident	86.4	Confident	64 Å²	64	107.7 Å²	107.7	39%	0.393	54%	0.539	S	S	.	.			trans	-94.3	155.4	172.2	60.9	0	0	0	0	110.1	C115 E119 R120 T121	C115-T117 HydrophobicContact CB-CG2 3.92Å; C115-T117 PolarHBondContact O-N 3.04Å; T117-E119 PolarHBondContact O-N 3.37Å; T117-R120 PolarHBondContact O-N 3.45Å; T117-R120 VanDerWaalsContact O-N 3.13Å; T117-R120 WeakPolarHBondContact OG1-CB 3.29Å; T117-R120 PolarHBondContact OG1-N 3.21Å; T117-R120 VanDerWaalsContact OG1-N 3.08Å; T117-T121 PolarHBondContact O-N 3.44Å; T117-T121 PolarHBondContact O-OG1 2.88Å; T117-T121 VanDerWaalsContact O-OG1 3.06Å
118	E	86.3	Confident	86.6	Confident	175 Å²	175	106.2 Å²	106.2	82%	0.818	54%	0.537	S	S	*	.	H	α-helix	trans	-57.5	-34.5	170.8	-66.3	-177.8	176	0	0	111.3	T121 R122	E118-T121 VanDerWaalsContact CA-OG1 3.31Å; E118-T121 WeakPolarHBondContact CA-OG1 3.41Å; E118-T121 PolarHBondContact O-OG1 3.38Å; E118-R122 VanDerWaalsContact O-CB 3.32Å; E118-R122 WeakPolarHBondContact O-CB 3.33Å; E118-R122 PolarHBondContact O-N 3.03Å
119	E	87.2	Confident	86.9	Confident	117 Å²	117	103.7 Å²	103.7	55%	0.547	53%	0.532	S	S	.	.	H	α-helix	trans	-63.2	-45.7	174.3	-173.4	177.9	-169.1	0	0	112.1	T117 T121 R122 L123	T117-E119 PolarHBondContact O-N 3.37Å; E119-T121 PolarHBondContact O-N 2.95Å; E119-R122 PolarHBondContact O-N 3.12Å; E119-L123 HydrophobicContact CG-CD1 4.02Å; E119-L123 HydrophobicContact CG-CG 4.44Å; E119-L123 WeakPolarHBondContact O-CB 3.32Å; E119-L123 WeakPolarHBondContact O-CG 3.47Å; E119-L123 PolarHBondContact O-N 3.33Å
120	R	86.3	Confident	87.3	Confident	101 Å²	101	100.3 Å²	100.3	38%	0.381	52%	0.521	S	S	.	.	H	α-helix	trans	-63.7	-42.6	178.6	-177.4	178.4	177.4	-144.2	-12.4	111.7	R114 C115 E116 T117 L123 A124	R114-R120 PolarHBondContact O-NH1 3.1Å; C115-R120 WeakPolarHBondContact O-CD 3.41Å; E116-R120 IonicContact OE1-CZ 3.93Å; E116-R120 IonicContact OE1-NH1 2.99Å; E116-R120 PolarHBondContact OE1-NH1 2.84Å; E116-R120 IonicContact OE1-NH2 2.61Å; T117-R120 PolarHBondContact O-N 3.45Å; T117-R120 VanDerWaalsContact O-N 3.13Å; T117-R120 WeakPolarHBondContact OG1-CB 3.29Å; T117-R120 PolarHBondContact OG1-N 3.21Å; T117-R120 VanDerWaalsContact OG1-N 3.08Å; R120-L123 PolarHBondContact O-N 2.94Å; R120-A124 VanDerWaalsContact O-CB 3.26Å; R120-A124 WeakPolarHBondContact O-CB 3.4Å; R120-A124 PolarHBondContact O-N 3.21Å
121	T	88.6	Confident	87.8	Confident	63 Å²	63	105.2 Å²	105.2	39%	0.387	53%	0.531	S	S	.	.	H	α-helix	trans	-66.8	-38.4	177	41.6	0	0	0	0	111.8	T117 E118 E119 K125	T117-T121 PolarHBondContact O-N 3.44Å; T117-T121 PolarHBondContact O-OG1 2.88Å; T117-T121 VanDerWaalsContact O-OG1 3.06Å; E118-T121 VanDerWaalsContact CA-OG1 3.31Å; E118-T121 WeakPolarHBondContact CA-OG1 3.41Å; E118-T121 PolarHBondContact O-OG1 3.38Å; E119-T121 PolarHBondContact O-N 2.95Å; T121-K125 WeakPolarHBondContact O-CG 3.28Å; T121-K125 PolarHBondContact O-N 2.99Å; T121-K125 VanDerWaalsContact O-N 3.12Å
122	R	93.4	Very high	88.3	Confident	155 Å²	155	104.2 Å²	104.2	59%	0.585	53%	0.531	S	S	*	.	H	α-helix	trans	-62.2	-51.5	172	-172.4	-176	69.7	-161.9	-2.7	111.7	E118 E119 A124 K125 E126	E118-R122 VanDerWaalsContact O-CB 3.32Å; E118-R122 WeakPolarHBondContact O-CB 3.33Å; E118-R122 PolarHBondContact O-N 3.03Å; E119-R122 PolarHBondContact O-N 3.12Å; R122-A124 VanDerWaalsContact C-N 3.31Å; R122-A124 PolarHBondContact O-N 3.02Å; R122-K125 PolarHBondContact O-N 2.99Å; R122-E126 WeakPolarHBondContact O-CB 3.49Å; R122-E126 PolarHBondContact O-N 2.84Å
123	L	92.6	Very high	89.1	Confident	85 Å²	85	102.4 Å²	102.4	45%	0.445	52%	0.52	S	S	.	.	H	α-helix	trans	-61.5	-37.6	179	-73.5	172.4	0	0	0	112.2	E119 R120 E126 L127	E119-L123 HydrophobicContact CG-CD1 4.02Å; E119-L123 HydrophobicContact CG-CG 4.44Å; E119-L123 WeakPolarHBondContact O-CB 3.32Å; E119-L123 WeakPolarHBondContact O-CG 3.47Å; E119-L123 PolarHBondContact O-N 3.33Å; R120-L123 PolarHBondContact O-N 2.94Å; L123-E126 PolarHBondContact O-N 2.89Å; L123-L127 VanDerWaalsContact O-CB 3.23Å; L123-L127 WeakPolarHBondContact O-CB 3.26Å; L123-L127 PolarHBondContact O-N 3.32Å
124	A	91.4	Very high	90.3	Very high	58 Å²	58	105.8 Å²	105.8	48%	0.479	51%	0.511	S	S	.	.	H	α-helix	trans	-64.8	-40.8	175.8	0	0	0	0	0	112.1	R120 R122 S128	R120-A124 VanDerWaalsContact O-CB 3.26Å; R120-A124 WeakPolarHBondContact O-CB 3.4Å; R120-A124 PolarHBondContact O-N 3.21Å; R122-A124 VanDerWaalsContact C-N 3.31Å; R122-A124 PolarHBondContact O-N 3.02Å; A124-S128 PolarHBondContact O-N 3.29Å; A124-S128 VanDerWaalsContact O-N 3.09Å
125	K	94.7	Very high	91.4	Very high	160 Å²	160	102.5 Å²	102.5	70%	0.696	50%	0.502	S	S	*	.	H	α-helix	trans	-65.9	-44.9	174.1	-73.4	178.1	-178.9	-179.6	0	111.6	T121 R122 S128 S129	T121-K125 WeakPolarHBondContact O-CG 3.28Å; T121-K125 PolarHBondContact O-N 2.99Å; T121-K125 VanDerWaalsContact O-N 3.12Å; R122-K125 PolarHBondContact O-N 2.99Å; K125-S128 WeakPolarHBondContact O-CB 3.32Å; K125-S128 PolarHBondContact O-N 3.48Å; K125-S129 PolarHBondContact O-N 2.93Å
126	E	96.7	Very high	92.5	Very high	103 Å²	103	105.7 Å²	105.7	48%	0.481	51%	0.51	S	S	.	.	H	α-helix	trans	-60.8	-46.1	177.3	-174.3	177.7	179.7	0	0	111.4	R122 L123 S128 S129 L130	R122-E126 WeakPolarHBondContact O-CB 3.49Å; R122-E126 PolarHBondContact O-N 2.84Å; L123-E126 PolarHBondContact O-N 2.89Å; E126-S128 VanDerWaalsContact C-N 3.29Å; E126-S128 PolarHBondContact O-N 3.43Å; E126-S129 WeakPolarHBondContact O-CB 3.26Å; E126-S129 PolarHBondContact O-N 2.84Å; E126-L130 HydrophobicContact CG-CD1 4.06Å; E126-L130 HydrophobicContact CG-CG 4.46Å; E126-L130 WeakPolarHBondContact O-CB 3.25Å; E126-L130 WeakPolarHBondContact O-CG 3.45Å; E126-L130 PolarHBondContact O-N 2.74Å
127	L	96.3	Very high	93.7	Very high	88 Å²	88	104 Å²	104	46%	0.461	51%	0.505	S	S	.	.	H	α-helix	trans	-59.2	-39.9	175.8	-177.6	67.9	0	0	0	112.1	L123 R131	L123-L127 VanDerWaalsContact O-CB 3.23Å; L123-L127 WeakPolarHBondContact O-CB 3.26Å; L123-L127 PolarHBondContact O-N 3.32Å; L127-R131 WeakPolarHBondContact O-CB 3.47Å; L127-R131 VanDerWaalsContact O-CG 3.25Å; L127-R131 WeakPolarHBondContact O-CG 3.19Å; L127-R131 PolarHBondContact O-N 2.93Å
128	S	96.8	Very high	94.2	Very high	63 Å²	63	107.1 Å²	107.1	44%	0.441	51%	0.513	S	S	.	.	H	α-helix	trans	-62.3	-50.6	174.9	-165.5	0	0	0	0	110.9	A124 K125 E126 L130 R131 D132	A124-S128 PolarHBondContact O-N 3.29Å; A124-S128 VanDerWaalsContact O-N 3.09Å; K125-S128 WeakPolarHBondContact O-CB 3.32Å; K125-S128 PolarHBondContact O-N 3.48Å; E126-S128 VanDerWaalsContact C-N 3.29Å; E126-S128 PolarHBondContact O-N 3.43Å; S128-L130 PolarHBondContact O-N 2.96Å; S128-R131 WeakPolarHBondContact O-CB 3.26Å; S128-R131 PolarHBondContact O-N 3.01Å; S128-R131 VanDerWaalsContact O-N 3.15Å; S128-D132 PolarHBondContact O-N 3.13Å
129	S	97.1	Very high	94.6	Very high	57 Å²	57	101.3 Å²	101.3	40%	0.399	50%	0.496	S	S	.	.	H	α-helix	trans	-57.9	-46.1	178.8	-177.1	0	0	0	0	112.1	K125 E126 R131 D132 Q133	K125-S129 PolarHBondContact O-N 2.93Å; E126-S129 WeakPolarHBondContact O-CB 3.26Å; E126-S129 PolarHBondContact O-N 2.84Å; S129-R131 VanDerWaalsContact C-N 3.31Å; S129-R131 PolarHBondContact O-N 3.39Å; S129-D132 PolarHBondContact O-N 3.04Å; S129-Q133 WeakPolarHBondContact O-CG 3.22Å; S129-Q133 PolarHBondContact O-N 3.34Å
130	L	97.6	Very high	94.8	Very high	89 Å²	89	100.2 Å²	100.2	47%	0.466	49%	0.49	S	S	.	.	H	α-helix	trans	-64.8	-34	178.3	-72.9	172.6	0	0	0	112.6	E126 S128 R134	E126-L130 HydrophobicContact CG-CD1 4.06Å; E126-L130 HydrophobicContact CG-CG 4.46Å; E126-L130 WeakPolarHBondContact O-CB 3.25Å; E126-L130 WeakPolarHBondContact O-CG 3.45Å; E126-L130 PolarHBondContact O-N 2.74Å; S128-L130 PolarHBondContact O-N 2.96Å; L130-R134 VanDerWaalsContact O-CB 3.28Å; L130-R134 WeakPolarHBondContact O-CB 3.41Å; L130-R134 PolarHBondContact O-N 2.61Å
131	R	97.4	Very high	95	Very high	141 Å²	141	100.3 Å²	100.3	53%	0.532	50%	0.502	S	S	.	.	H	α-helix	trans	-66.6	-42.5	174.3	-78.1	171.5	176.2	-179.2	-0.9	111.6	L127 S128 S129 R134 E135	L127-R131 WeakPolarHBondContact O-CB 3.47Å; L127-R131 VanDerWaalsContact O-CG 3.25Å; L127-R131 WeakPolarHBondContact O-CG 3.19Å; L127-R131 PolarHBondContact O-N 2.93Å; S128-R131 WeakPolarHBondContact O-CB 3.26Å; S128-R131 PolarHBondContact O-N 3.01Å; S128-R131 VanDerWaalsContact O-N 3.15Å; S129-R131 VanDerWaalsContact C-N 3.31Å; S129-R131 PolarHBondContact O-N 3.39Å; R131-R134 PolarHBondContact O-N 3.03Å; R131-E135 PolarHBondContact O-N 3.21Å
132	D	96.9	Very high	95	Very high	93 Å²	93	102.4 Å²	102.4	50%	0.497	51%	0.507	S	S	.	.	H	α-helix	trans	-65.2	-44.6	177.7	-63.2	-24.7	0	0	0	110.7	S128 S129 R134 E135 Q136	S128-D132 PolarHBondContact O-N 3.13Å; S129-D132 PolarHBondContact O-N 3.04Å; D132-R134 PolarHBondContact O-N 2.88Å; D132-E135 PolarHBondContact O-N 3.18Å; D132-Q136 WeakPolarHBondContact O-CG 2.96Å; D132-Q136 PolarHBondContact O-N 3.35Å
133	Q	97.4	Very high	94.8	Very high	94 Å²	94	102.8 Å²	102.8	44%	0.439	51%	0.513	S	S	.	.	H	α-helix	trans	-60.3	-44.8	174.6	-73.1	178.2	4.8	0	0	112.2	S129 E135 Q136 L137	S129-Q133 WeakPolarHBondContact O-CG 3.22Å; S129-Q133 PolarHBondContact O-N 3.34Å; Q133-E135 VanDerWaalsContact C-N 3.28Å; Q133-E135 PolarHBondContact O-N 2.9Å; Q133-Q136 PolarHBondContact O-N 3.32Å; Q133-L137 WeakPolarHBondContact O-CB 3.48Å; Q133-L137 WeakPolarHBondContact O-CG 3.45Å; Q133-L137 PolarHBondContact O-N 2.92Å
134	R	97.6	Very high	94.4	Very high	142 Å²	142	105.2 Å²	105.2	54%	0.536	52%	0.517	S	S	.	.	H	α-helix	trans	-58.7	-42.9	176	-178.7	-145.5	66.3	-164.8	-1.5	111	L130 R131 D132 K138	L130-R134 VanDerWaalsContact O-CB 3.28Å; L130-R134 WeakPolarHBondContact O-CB 3.41Å; L130-R134 PolarHBondContact O-N 2.61Å; R131-R134 PolarHBondContact O-N 3.03Å; D132-R134 PolarHBondContact O-N 2.88Å; R134-K138 VanDerWaalsContact O-CB 3.23Å; R134-K138 WeakPolarHBondContact O-CB 3.43Å; R134-K138 PolarHBondContact O-N 3.44Å
135	E	96.7	Very high	93.9	Very high	94 Å²	94	108.2 Å²	108.2	44%	0.439	52%	0.52	S	S	.	.	H	α-helix	trans	-66.7	-41.4	179.6	-156.2	61.8	-154.2	0	0	111.9	R131 D132 Q133 K138 A139	R131-E135 PolarHBondContact O-N 3.21Å; D132-E135 PolarHBondContact O-N 3.18Å; Q133-E135 VanDerWaalsContact C-N 3.28Å; Q133-E135 PolarHBondContact O-N 2.9Å; E135-K138 PolarHBondContact O-N 3.39Å; E135-A139 WeakPolarHBondContact O-CB 3.27Å; E135-A139 PolarHBondContact O-N 3.28Å
136	Q	96.4	Very high	92.8	Very high	136 Å²	136	106.9 Å²	106.9	64%	0.636	52%	0.52	S	S	*	.	H	α-helix	trans	-61.1	-49.8	174.8	-71.7	173.4	2.8	0	0	111.8	D132 Q133 K138 A139 E140	D132-Q136 WeakPolarHBondContact O-CG 2.96Å; D132-Q136 PolarHBondContact O-N 3.35Å; Q133-Q136 PolarHBondContact O-N 3.32Å; Q136-K138 VanDerWaalsContact C-N 3.32Å; Q136-K138 PolarHBondContact O-N 3.21Å; Q136-A139 PolarHBondContact O-N 3.44Å; Q136-E140 WeakPolarHBondContact O-CB 3.49Å; Q136-E140 PolarHBondContact O-N 2.85Å
137	L	95.6	Very high	92	Very high	105 Å²	105	106 Å²	106	55%	0.55	53%	0.525	S	S	.	.	H	α-helix	trans	-62.6	-39.8	178.5	-72.4	172.1	0	0	0	111.6	Q133 E140 V141	Q133-L137 WeakPolarHBondContact O-CB 3.48Å; Q133-L137 WeakPolarHBondContact O-CG 3.45Å; Q133-L137 PolarHBondContact O-N 2.92Å; L137-E140 PolarHBondContact O-N 3.49Å; L137-V141 WeakPolarHBondContact O-CG2 3.33Å; L137-V141 PolarHBondContact O-N 3.01Å
138	K	95.4	Very high	91.3	Very high	130 Å²	130	105.5 Å²	105.5	57%	0.565	52%	0.522	S	S	*	.	H	α-helix	trans	-63.6	-43	176	-171.3	-178.7	179	-170.3	0	111.5	R134 E135 Q136 E140 V141 E142	R134-K138 VanDerWaalsContact O-CB 3.23Å; R134-K138 WeakPolarHBondContact O-CB 3.43Å; R134-K138 PolarHBondContact O-N 3.44Å; E135-K138 PolarHBondContact O-N 3.39Å; Q136-K138 VanDerWaalsContact C-N 3.32Å; Q136-K138 PolarHBondContact O-N 3.21Å; K138-E140 VanDerWaalsContact C-N 3.28Å; K138-E140 PolarHBondContact O-N 3.11Å; K138-V141 PolarHBondContact O-N 3.31Å; K138-E142 PolarHBondContact O-N 3.33Å
139	A	94.3	Very high	90.8	Very high	54 Å²	54	107.4 Å²	107.4	45%	0.446	53%	0.533	S	S	.	.	H	α-helix	trans	-64.8	-34.4	175.1	0	0	0	0	0	112	E135 Q136 K143	E135-A139 WeakPolarHBondContact O-CB 3.27Å; E135-A139 PolarHBondContact O-N 3.28Å; Q136-A139 PolarHBondContact O-N 3.44Å; A139-K143 WeakPolarHBondContact O-CG 3.33Å; A139-K143 PolarHBondContact O-N 3.03Å
140	E	92.1	Very high	90.2	Very high	94 Å²	94	110.8 Å²	110.8	44%	0.439	54%	0.543	S	S	.	.	H	α-helix	trans	-68.3	-46.6	174.9	-174.6	169.1	-165.3	0	0	112	Q136 L137 K138 E142 K143 Y144	Q136-E140 WeakPolarHBondContact O-CB 3.49Å; Q136-E140 PolarHBondContact O-N 2.85Å; L137-E140 PolarHBondContact O-N 3.49Å; K138-E140 VanDerWaalsContact C-N 3.28Å; K138-E140 PolarHBondContact O-N 3.11Å; E140-E142 VanDerWaalsContact C-N 3.29Å; E140-E142 PolarHBondContact O-N 3.34Å; E140-K143 WeakPolarHBondContact O-CB 3.47Å; E140-K143 PolarHBondContact O-N 3.27Å; E140-K143 VanDerWaalsContact O-N 3.12Å; E140-Y144 HydrophobicContact CG-CD2 4.36Å; E140-Y144 HydrophobicContact CG-CE2 3.78Å; E140-Y144 WeakPolarHBondContact O-CD2 3.35Å
141	V	89.5	Confident	89.6	Confident	102 Å²	102	109 Å²	109	62%	0.618	54%	0.535	S	S	*	.	H	α-helix	trans	-58.8	-41.4	175.8	169.5	0	0	0	0	111.4	L137 K138 K143 Y144 K145	L137-V141 WeakPolarHBondContact O-CG2 3.33Å; L137-V141 PolarHBondContact O-N 3.01Å; K138-V141 PolarHBondContact O-N 3.31Å; V141-K143 PolarHBondContact O-N 3.07Å; V141-Y144 PolarHBondContact O-N 3.49Å; V141-K145 PolarHBondContact O-N 3.28Å
142	E	90	Very high	89.2	Confident	108 Å²	108	104.5 Å²	104.5	51%	0.505	52%	0.524	S	S	.	.	H	α-helix	trans	-61.7	-30.9	179	-163	68.7	-159	0	0	112.2	K138 E140 Y144 K145	K138-E142 PolarHBondContact O-N 3.33Å; E140-E142 VanDerWaalsContact C-N 3.29Å; E140-E142 PolarHBondContact O-N 3.34Å; E142-Y144 PolarHBondContact O-N 2.92Å; E142-K145 WeakPolarHBondContact O-CB 3.33Å; E142-K145 PolarHBondContact O-N 2.85Å; E142-K145 VanDerWaalsContact OE1-CD 3.22Å; E142-K145 WeakPolarHBondContact OE1-CD 3.34Å; E142-K145 IonicContact OE1-NZ 3.86Å; E142-K145 PolarHBondContact OE1-NZ 3.34Å
143	K	88.3	Confident	88.9	Confident	163 Å²	163	103.7 Å²	103.7	71%	0.709	52%	0.517	S	S	*	.	H	α-helix	trans	-63.4	-27.6	175	-66.5	172.3	-175.6	175.8	0	113	A139 E140 V141	A139-K143 WeakPolarHBondContact O-CG 3.33Å; A139-K143 PolarHBondContact O-N 3.03Å; E140-K143 WeakPolarHBondContact O-CB 3.47Å; E140-K143 PolarHBondContact O-N 3.27Å; E140-K143 VanDerWaalsContact O-N 3.12Å; V141-K143 PolarHBondContact O-N 3.07Å
144	Y	84.1	Confident	88.5	Confident	135 Å²	135	104.6 Å²	104.6	53%	0.529	52%	0.521	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.5	10.8	-175.4	-59.5	-67.7	0	0	0	113.2	E140 V141 E142 D146 C147	E140-Y144 HydrophobicContact CG-CD2 4.36Å; E140-Y144 HydrophobicContact CG-CE2 3.78Å; E140-Y144 WeakPolarHBondContact O-CD2 3.35Å; V141-Y144 PolarHBondContact O-N 3.49Å; E142-Y144 PolarHBondContact O-N 2.92Å; Y144-D146 VanDerWaalsContact C-N 3.27Å; Y144-D146 PolarHBondContact O-N 2.92Å; Y144-C147 WeakPolarHBondContact O-CA 3.49Å; Y144-C147 WeakPolarHBondContact O-CB 3.4Å; Y144-C147 PolarHBondContact O-N 3.4Å
145	K	81.7	Confident	88.1	Confident	121 Å²	121	102 Å²	102	53%	0.526	52%	0.517	S	S	.	.	G	3₁₀ helix	trans	-58	-38.2	-177.4	-173.8	177.3	-174.9	176.5	0	113.5	V141 E142 C147 D148	V141-K145 PolarHBondContact O-N 3.28Å; E142-K145 WeakPolarHBondContact O-CB 3.33Å; E142-K145 PolarHBondContact O-N 2.85Å; E142-K145 VanDerWaalsContact OE1-CD 3.22Å; E142-K145 WeakPolarHBondContact OE1-CD 3.34Å; E142-K145 IonicContact OE1-NZ 3.86Å; E142-K145 PolarHBondContact OE1-NZ 3.34Å; K145-C147 PolarHBondContact O-N 2.88Å; K145-D148 WeakPolarHBondContact O-CB 3.39Å; K145-D148 PolarHBondContact O-N 3.39Å
146	D	71.3	Confident	87.9	Confident	132 Å²	132	104.8 Å²	104.8	71%	0.706	52%	0.523	S	S	*	.	G	3₁₀ helix	trans	-78.9	-11.2	179.1	-58.9	-26.7	0	0	0	112.6	Y144 D148	Y144-D146 VanDerWaalsContact C-N 3.27Å; Y144-D146 PolarHBondContact O-N 2.92Å; D146-D148 VanDerWaalsContact C-N 3.32Å
147	C	80.4	Confident	87.8	Confident	86 Å²	86	103 Å²	103	58%	0.581	52%	0.515	S	S	*	.	G	3₁₀ helix	trans	-93.7	12.9	174.8	-61.8	0	0	0	0	112.4	Y144 K145	Y144-C147 WeakPolarHBondContact O-CA 3.49Å; Y144-C147 WeakPolarHBondContact O-CB 3.4Å; Y144-C147 PolarHBondContact O-N 3.4Å; K145-C147 PolarHBondContact O-N 2.88Å
148	D	81.1	Confident	87.7	Confident	76 Å²	76	100.8 Å²	100.8	41%	0.406	51%	0.512	S	S	.	.			trans	-58.5	125.6	173.6	-172.6	-35	0	0	0	109.2	K145 D146 Q150 V151 V152	K145-D148 WeakPolarHBondContact O-CB 3.39Å; K145-D148 PolarHBondContact O-N 3.39Å; D146-D148 VanDerWaalsContact C-N 3.32Å; D148-Q150 PolarHBondContact O-N 3.49Å; D148-Q150 WeakPolarHBondContact OD1-CB 3.42Å; D148-Q150 PolarHBondContact OD1-N 3.41Å; D148-V151 HydrophobicContact CB-CB 4.12Å; D148-V151 HydrophobicContact CB-CG2 3.87Å; D148-V151 PolarHBondContact O-N 3.38Å; D148-V152 WeakPolarHBondContact O-CG2 3.32Å; D148-V152 PolarHBondContact O-N 3.27Å
149	P	86.1	Confident	87.6	Confident	103 Å²	103	99.5 Å²	99.5	67%	0.669	51%	0.511	S	S	*	.	H	α-helix	trans	-49.2	-34.5	177.8	-29	35.2	0	0	0	113.9	E153	P149-E153 WeakPolarHBondContact O-CB 3.46Å; P149-E153 PolarHBondContact O-N 3.35Å
150	Q	84.6	Confident	87.6	Confident	128 Å²	128	102.5 Å²	102.5	60%	0.598	51%	0.514	S	S	*	.	H	α-helix	trans	-70	-45.5	177.7	-171.6	177.8	-19.4	0	0	111.6	D148 V152 E153 E154	D148-Q150 PolarHBondContact O-N 3.49Å; D148-Q150 WeakPolarHBondContact OD1-CB 3.42Å; D148-Q150 PolarHBondContact OD1-N 3.41Å; Q150-V152 VanDerWaalsContact C-N 3.34Å; Q150-V152 PolarHBondContact O-N 3.44Å; Q150-E153 PolarHBondContact O-N 2.93Å; Q150-E154 PolarHBondContact NE2-OE1 3.49Å; Q150-E154 WeakPolarHBondContact O-CG 3.36Å; Q150-E154 PolarHBondContact O-N 3.42Å
151	V	85.4	Confident	87.8	Confident	52 Å²	52	102.4 Å²	102.4	32%	0.315	52%	0.52	S	S	.	.	H	α-helix	trans	-62.8	-42.5	176.8	175.3	0	0	0	0	110.7	D148 E153 E154 I155	D148-V151 HydrophobicContact CB-CB 4.12Å; D148-V151 HydrophobicContact CB-CG2 3.87Å; D148-V151 PolarHBondContact O-N 3.38Å; V151-E153 VanDerWaalsContact C-N 3.34Å; V151-E153 PolarHBondContact O-N 2.87Å; V151-E154 PolarHBondContact O-N 3.44Å; V151-I155 HydrophobicContact CG1-CD1 4.09Å; V151-I155 WeakPolarHBondContact O-CG1 3.33Å; V151-I155 PolarHBondContact O-N 3.47Å
152	V	88.7	Confident	88.1	Confident	47 Å²	47	100.4 Å²	100.4	29%	0.285	51%	0.514	S	S	.	.	H	α-helix	trans	-62.4	-42.1	176.6	173.4	0	0	0	0	111.1	D148 Q150 I155 R156	D148-V152 WeakPolarHBondContact O-CG2 3.32Å; D148-V152 PolarHBondContact O-N 3.27Å; Q150-V152 VanDerWaalsContact C-N 3.34Å; Q150-V152 PolarHBondContact O-N 3.44Å; V152-I155 PolarHBondContact O-N 3.35Å; V152-R156 WeakPolarHBondContact O-CG 3.48Å; V152-R156 PolarHBondContact O-N 2.94Å
153	E	90.4	Very high	88.3	Confident	76 Å²	76	98.6 Å²	98.6	36%	0.355	50%	0.504	S	S	.	.	H	α-helix	trans	-68.7	-39.1	178.1	-170.7	55.9	-150.6	0	0	112	P149 Q150 V151 I155 R156 Q157	P149-E153 WeakPolarHBondContact O-CB 3.46Å; P149-E153 PolarHBondContact O-N 3.35Å; Q150-E153 PolarHBondContact O-N 2.93Å; V151-E153 VanDerWaalsContact C-N 3.34Å; V151-E153 PolarHBondContact O-N 2.87Å; E153-I155 VanDerWaalsContact C-N 3.34Å; E153-I155 PolarHBondContact O-N 3.14Å; E153-R156 WeakPolarHBondContact O-CB 3.48Å; E153-R156 PolarHBondContact O-N 3.42Å; E153-R156 VanDerWaalsContact O-N 3.17Å; E153-R156 WeakPolarHBondContact OE2-CD 3.44Å; E153-R156 IonicContact OE2-NH1 3.36Å; E153-R156 PolarHBondContact OE2-NH1 3.44Å; E153-Q157 WeakPolarHBondContact O-CG 3.41Å; E153-Q157 PolarHBondContact O-N 2.99Å; E153-Q157 PolarHBondContact OE1-NE2 2.89Å
154	E	89.4	Confident	88.7	Confident	112 Å²	112	95.3 Å²	95.3	52%	0.523	49%	0.491	S	S	.	.	H	α-helix	trans	-59	-44.1	172.9	-74.5	173	-167	0	0	111.6	Q150 V151 R156 Q157 A158	Q150-E154 PolarHBondContact NE2-OE1 3.49Å; Q150-E154 WeakPolarHBondContact O-CG 3.36Å; Q150-E154 PolarHBondContact O-N 3.42Å; V151-E154 PolarHBondContact O-N 3.44Å; E154-R156 PolarHBondContact O-N 3Å; E154-Q157 PolarHBondContact O-N 3.36Å; E154-A158 WeakPolarHBondContact O-CB 3.4Å; E154-A158 PolarHBondContact O-N 3.19Å
155	I	89.5	Confident	89.2	Confident	89 Å²	89	90.4 Å²	90.4	46%	0.456	48%	0.479	S	S	.	.	H	α-helix	trans	-62.3	-42.2	174.8	-68.2	167.6	0	0	0	111	V151 V152 E153 Q157 A158 N159	V151-I155 HydrophobicContact CG1-CD1 4.09Å; V151-I155 WeakPolarHBondContact O-CG1 3.33Å; V151-I155 PolarHBondContact O-N 3.47Å; V152-I155 PolarHBondContact O-N 3.35Å; E153-I155 VanDerWaalsContact C-N 3.34Å; E153-I155 PolarHBondContact O-N 3.14Å; I155-Q157 PolarHBondContact O-N 3.22Å; I155-A158 PolarHBondContact O-N 2.88Å; I155-N159 WeakPolarHBondContact O-CB 3.38Å; I155-N159 VanDerWaalsContact O-CG 3.24Å; I155-N159 PolarHBondContact O-N 3.5Å; I155-N159 PolarHBondContact O-ND2 3.42Å
156	R	92.1	Very high	89.9	Confident	152 Å²	152	86.2 Å²	86.2	57%	0.574	47%	0.467	S	S	*	.	H	α-helix	trans	-62.1	-43.7	177.3	-76	175.2	-176.9	165.3	0.9	112.2	V152 E153 E154 N159 K160	V152-R156 WeakPolarHBondContact O-CG 3.48Å; V152-R156 PolarHBondContact O-N 2.94Å; E153-R156 WeakPolarHBondContact O-CB 3.48Å; E153-R156 PolarHBondContact O-N 3.42Å; E153-R156 VanDerWaalsContact O-N 3.17Å; E153-R156 WeakPolarHBondContact OE2-CD 3.44Å; E153-R156 IonicContact OE2-NH1 3.36Å; E153-R156 PolarHBondContact OE2-NH1 3.44Å; E154-R156 PolarHBondContact O-N 3Å; R156-N159 PolarHBondContact O-N 3.43Å; R156-K160 PolarHBondContact O-N 3.29Å
157	Q	93.6	Very high	91.1	Very high	98 Å²	98	81.3 Å²	81.3	46%	0.458	44%	0.441	S	S	.	.	H	α-helix	trans	-65.5	-42.8	177.1	-65.5	-56.8	-28.4	0	0	111.3	E153 E154 I155 N159 K160 V161	E153-Q157 WeakPolarHBondContact O-CG 3.41Å; E153-Q157 PolarHBondContact O-N 2.99Å; E153-Q157 PolarHBondContact OE1-NE2 2.89Å; E154-Q157 PolarHBondContact O-N 3.36Å; I155-Q157 PolarHBondContact O-N 3.22Å; Q157-N159 VanDerWaalsContact C-N 3.34Å; Q157-N159 PolarHBondContact O-N 2.97Å; Q157-K160 WeakPolarHBondContact O-CB 3.47Å; Q157-K160 PolarHBondContact O-N 3.41Å; Q157-V161 WeakPolarHBondContact O-CG2 3.41Å; Q157-V161 PolarHBondContact O-N 3.37Å; Q157-V161 VanDerWaalsContact O-N 3.09Å
158	A	93.3	Very high	91.8	Very high	58 Å²	58	84 Å²	84	48%	0.479	44%	0.438	S	S	.	.	H	α-helix	trans	-59.7	-43.6	174.6	0	0	0	0	0	112.1	E154 I155 K160 V161 A162	E154-A158 WeakPolarHBondContact O-CB 3.4Å; E154-A158 PolarHBondContact O-N 3.19Å; I155-A158 PolarHBondContact O-N 2.88Å; A158-K160 VanDerWaalsContact C-N 3.33Å; A158-K160 PolarHBondContact O-N 2.96Å; A158-V161 PolarHBondContact O-N 2.88Å; A158-A162 WeakPolarHBondContact O-CB 3.37Å; A158-A162 PolarHBondContact O-N 3.04Å
159	N	93.8	Very high	92.5	Very high	104 Å²	104	88.5 Å²	88.5	56%	0.556	45%	0.45	S	S	*	.	H	α-helix	trans	-62	-39.4	176.1	-75.1	-15	0	0	0	112	I155 R156 Q157 A162 K163	I155-N159 WeakPolarHBondContact O-CB 3.38Å; I155-N159 VanDerWaalsContact O-CG 3.24Å; I155-N159 PolarHBondContact O-N 3.5Å; I155-N159 PolarHBondContact O-ND2 3.42Å; R156-N159 PolarHBondContact O-N 3.43Å; Q157-N159 VanDerWaalsContact C-N 3.34Å; Q157-N159 PolarHBondContact O-N 2.97Å; N159-A162 PolarHBondContact O-N 3.37Å; N159-K163 VanDerWaalsContact O-CB 3.25Å; N159-K163 WeakPolarHBondContact O-CB 3.23Å; N159-K163 PolarHBondContact O-N 3.42Å
160	K	95	Very high	92.9	Very high	116 Å²	116	84 Å²	84	50%	0.504	42%	0.42	S	S	.	.	H	α-helix	trans	-60.3	-48.4	175.1	-173.7	-176.7	177	-173.3	0	111.3	R156 Q157 A158 K163 E164	R156-K160 PolarHBondContact O-N 3.29Å; Q157-K160 WeakPolarHBondContact O-CB 3.47Å; Q157-K160 PolarHBondContact O-N 3.41Å; A158-K160 VanDerWaalsContact C-N 3.33Å; A158-K160 PolarHBondContact O-N 2.96Å; K160-K163 PolarHBondContact O-N 3.38Å; K160-E164 VanDerWaalsContact CE-OE1 3.24Å; K160-E164 WeakPolarHBondContact CE-OE1 3.41Å; K160-E164 WeakPolarHBondContact O-CG 3.23Å; K160-E164 PolarHBondContact O-N 3.43Å
161	V	95.4	Very high	93.4	Very high	93 Å²	93	81.4 Å²	81.4	56%	0.564	41%	0.411	S	S	*	.	H	α-helix	trans	-63.8	-42.9	178.2	179.1	0	0	0	0	111.3	Q157 A158 K163 E164 A165	Q157-V161 WeakPolarHBondContact O-CG2 3.41Å; Q157-V161 PolarHBondContact O-N 3.37Å; Q157-V161 VanDerWaalsContact O-N 3.09Å; A158-V161 PolarHBondContact O-N 2.88Å; V161-K163 PolarHBondContact O-N 3.01Å; V161-E164 PolarHBondContact O-N 3.25Å; V161-A165 WeakPolarHBondContact O-CB 3.4Å; V161-A165 PolarHBondContact O-N 3.4Å
162	A	95.5	Very high	93.9	Very high	59 Å²	59	82 Å²	82	49%	0.488	41%	0.412	S	S	.	.	H	α-helix	trans	-62.5	-42.2	178.3	0	0	0	0	0	111.9	A158 N159 A165 A166	A158-A162 WeakPolarHBondContact O-CB 3.37Å; A158-A162 PolarHBondContact O-N 3.04Å; N159-A162 PolarHBondContact O-N 3.37Å; A162-A165 PolarHBondContact O-N 3.4Å; A162-A166 WeakPolarHBondContact O-CB 3.34Å; A162-A166 PolarHBondContact O-N 3.05Å
163	K	95.4	Very high	94	Very high	71 Å²	71	82.4 Å²	82.4	31%	0.309	41%	0.412	S	S	.	.	H	α-helix	trans	-63.6	-47.5	176.2	-176.5	-174.7	174.1	-171.1	0	111.9	N159 K160 V161 A165 A166 N167 I204 D205	N159-K163 VanDerWaalsContact O-CB 3.25Å; N159-K163 WeakPolarHBondContact O-CB 3.23Å; N159-K163 PolarHBondContact O-N 3.42Å; K160-K163 PolarHBondContact O-N 3.38Å; V161-K163 PolarHBondContact O-N 3.01Å; K163-A165 VanDerWaalsContact C-N 3.28Å; K163-A165 PolarHBondContact O-N 3.15Å; K163-A166 PolarHBondContact O-N 2.91Å; K163-N167 WeakPolarHBondContact O-CB 3.18Å; K163-N167 PolarHBondContact O-N 2.84Å; K163-I204 WeakPolarHBondContact CE-O 3.49Å; K163-I204 HydrophobicContact CG-CB 4.38Å; K163-I204 HydrophobicContact CG-CG2 4.27Å; K163-D205 WeakPolarHBondContact CE-O 3.28Å; K163-D205 WeakPolarHBondContact CE-OXT 3.49Å; K163-D205 PolarHBondContact NZ-O 3.47Å; K163-D205 VanDerWaalsContact NZ-O 3.08Å; K163-D205 PolarHBondContact NZ-OXT 2.91Å
164	E	95.1	Very high	94.1	Very high	93 Å²	93	82 Å²	82	44%	0.435	41%	0.409	S	S	.	.	H	α-helix	trans	-60.2	-39.7	175.4	-73.3	175.7	-167.7	0	0	111.8	K160 V161 R168	K160-E164 VanDerWaalsContact CE-OE1 3.24Å; K160-E164 WeakPolarHBondContact CE-OE1 3.41Å; K160-E164 WeakPolarHBondContact O-CG 3.23Å; K160-E164 PolarHBondContact O-N 3.43Å; V161-E164 PolarHBondContact O-N 3.25Å; E164-R168 WeakPolarHBondContact O-CB 3.13Å; E164-R168 PolarHBondContact O-N 3.47Å
165	A	95.6	Very high	94.3	Very high	33 Å²	33	79.4 Å²	79.4	27%	0.273	41%	0.407	S	S	.	.	H	α-helix	trans	-67.2	-43	176.4	0	0	0	0	0	112.3	V161 A162 K163 R168 W169	V161-A165 WeakPolarHBondContact O-CB 3.4Å; V161-A165 PolarHBondContact O-N 3.4Å; A162-A165 PolarHBondContact O-N 3.4Å; K163-A165 VanDerWaalsContact C-N 3.28Å; K163-A165 PolarHBondContact O-N 3.15Å; A165-R168 PolarHBondContact O-N 2.84Å; A165-W169 PolarHBondContact O-N 3.08Å
166	A	96.1	Very high	94.3	Very high	32 Å²	32	80.4 Å²	80.4	26%	0.264	41%	0.412	S	S	.	.	H	α-helix	trans	-60.2	-49.5	176.2	0	0	0	0	0	111	A162 K163 R168 W169 T170 I204	A162-A166 WeakPolarHBondContact O-CB 3.34Å; A162-A166 PolarHBondContact O-N 3.05Å; K163-A166 PolarHBondContact O-N 2.91Å; A166-R168 VanDerWaalsContact C-N 3.29Å; A166-R168 PolarHBondContact O-N 3.48Å; A166-W169 CarbonylContact O-C 3.6Å; A166-W169 WeakPolarHBondContact O-CA 3.5Å; A166-W169 PolarHBondContact O-N 3.13Å; A166-T170 PolarHBondContact O-N 3.29Å; A166-T170 PolarHBondContact O-OG1 3.06Å; A166-I204 HydrophobicContact CB-CD1 3.85Å
167	N	95.8	Very high	94.2	Very high	30 Å²	30	74.4 Å²	74.4	16%	0.16	39%	0.391	C	S	.	.	H	α-helix	trans	-62.1	-35.7	178.4	-73.4	-11.8	0	0	0	112.4	K163 W169 T170 D171 Y203 I204	K163-N167 WeakPolarHBondContact O-CB 3.18Å; K163-N167 PolarHBondContact O-N 2.84Å; N167-W169 VanDerWaalsContact C-N 3.35Å; N167-W169 PolarHBondContact O-N 3.3Å; N167-T170 WeakPolarHBondContact O-CB 3.22Å; N167-T170 PolarHBondContact O-N 3.39Å; N167-D171 PolarHBondContact O-N 2.87Å; N167-Y203 HydrophobicContact CB-CD1 3.81Å; N167-Y203 HydrophobicContact CB-CE1 4.42Å; N167-Y203 WeakPolarHBondContact OD1-CA 3.35Å; N167-I204 PolarHBondContact ND2-O 3.08Å; N167-I204 VanDerWaalsContact ND2-O 3.09Å; N167-I204 PolarHBondContact OD1-N 3.42Å
168	R	96.1	Very high	94	Very high	142 Å²	142	72.2 Å²	72.2	54%	0.536	39%	0.386	S	S	.	.	H	α-helix	trans	-64.4	-37.5	172.4	-174.8	179.1	-62.3	122.2	5.8	112.6	E164 A165 A166 D171 N172	E164-R168 WeakPolarHBondContact O-CB 3.13Å; E164-R168 PolarHBondContact O-N 3.47Å; A165-R168 PolarHBondContact O-N 2.84Å; A166-R168 VanDerWaalsContact C-N 3.29Å; A166-R168 PolarHBondContact O-N 3.48Å; R168-D171 WeakPolarHBondContact O-CB 3.36Å; R168-D171 PolarHBondContact O-N 3.06Å; R168-N172 VanDerWaalsContact O-CG 3.26Å; R168-N172 PolarHBondContact O-N 3.12Å; R168-N172 VanDerWaalsContact O-N 3.11Å; R168-N172 PolarHBondContact O-ND2 3.22Å
169	W	95.3	Very high	94	Very high	171 Å²	171	76 Å²	76	65%	0.648	39%	0.388	S	S	*	.	H	α-helix	trans	-71.7	-35.1	174.1	-78.1	110.9	0	0	0	111.9	A165 A166 N167 D171 N172 I173	A165-W169 PolarHBondContact O-N 3.08Å; A166-W169 CarbonylContact O-C 3.6Å; A166-W169 WeakPolarHBondContact O-CA 3.5Å; A166-W169 PolarHBondContact O-N 3.13Å; N167-W169 VanDerWaalsContact C-N 3.35Å; N167-W169 PolarHBondContact O-N 3.3Å; W169-D171 VanDerWaalsContact C-N 3.35Å; W169-N172 HydrophobicContact CE3-CB 4.23Å; W169-N172 WeakPolarHBondContact O-CB 3.36Å; W169-N172 PolarHBondContact O-N 3.45Å; W169-I173 VanDerWaalsContact O-CG1 3.26Å; W169-I173 WeakPolarHBondContact O-CG1 3.49Å; W169-I173 PolarHBondContact O-N 2.89Å
170	T	94.6	Very high	93.7	Very high	7 Å²	7	71.6 Å²	71.6	4%	0.043	37%	0.366	C	S	.	.	H	α-helix	trans	-56.2	-47.8	169.2	-60.7	0	0	0	0	111	A166 N167 N172 I173 F174 F201 Y203	A166-T170 PolarHBondContact O-N 3.29Å; A166-T170 PolarHBondContact O-OG1 3.06Å; N167-T170 WeakPolarHBondContact O-CB 3.22Å; N167-T170 PolarHBondContact O-N 3.39Å; T170-N172 VanDerWaalsContact C-N 3.34Å; T170-N172 PolarHBondContact O-N 2.87Å; T170-I173 PolarHBondContact O-N 3.29Å; T170-F174 HydrophobicContact CG2-CD2 3.92Å; T170-F174 HydrophobicContact CG2-CE2 3.37Å; T170-F174 HydrophobicContact CG2-CZ 3.85Å; T170-F174 WeakPolarHBondContact O-CD2 3.48Å; T170-F174 WeakPolarHBondContact O-CG 3.39Å; T170-F174 PolarHBondContact O-N 2.96Å; T170-F201 HydrophobicContact CG2-CD1 4.49Å; T170-F201 HydrophobicContact CG2-CE1 3.74Å; T170-F201 HydrophobicContact CG2-CZ 4.17Å; T170-Y203 HydrophobicContact CG2-CD1 4.02Å; T170-Y203 HydrophobicContact CG2-CE1 4.01Å; T170-Y203 HydrophobicContact CG2-CG 4.4Å
171	D	95.1	Very high	93.4	Very high	74 Å²	74	70.5 Å²	70.5	40%	0.396	36%	0.361	S	S	.	.	H	α-helix	trans	-56.1	-47.4	173.9	-71.8	-34.2	0	0	0	112	N167 R168 W169 I173 F174 A175 Y203	N167-D171 PolarHBondContact O-N 2.87Å; R168-D171 WeakPolarHBondContact O-CB 3.36Å; R168-D171 PolarHBondContact O-N 3.06Å; W169-D171 VanDerWaalsContact C-N 3.35Å; D171-I173 VanDerWaalsContact C-N 3.33Å; D171-I173 PolarHBondContact O-N 2.77Å; D171-F174 PolarHBondContact O-N 2.94Å; D171-A175 WeakPolarHBondContact O-CB 3.31Å; D171-A175 PolarHBondContact O-N 2.71Å; D171-Y203 WeakPolarHBondContact OD1-CE1 3.45Å; D171-Y203 VanDerWaalsContact OD1-CZ 3.25Å; D171-Y203 PolarHBondContact OD1-OH 3.29Å
172	N	95.2	Very high	93.2	Very high	66 Å²	66	75.2 Å²	75.2	35%	0.353	37%	0.369	S	S	.	.	H	α-helix	trans	-62.3	-41.2	-179.7	-71.2	-18.4	0	0	0	111.7	R168 W169 T170 A175 I176	R168-N172 VanDerWaalsContact O-CG 3.26Å; R168-N172 PolarHBondContact O-N 3.12Å; R168-N172 VanDerWaalsContact O-N 3.11Å; R168-N172 PolarHBondContact O-ND2 3.22Å; W169-N172 HydrophobicContact CE3-CB 4.23Å; W169-N172 WeakPolarHBondContact O-CB 3.36Å; W169-N172 PolarHBondContact O-N 3.45Å; T170-N172 VanDerWaalsContact C-N 3.34Å; T170-N172 PolarHBondContact O-N 2.87Å; N172-A175 PolarHBondContact O-N 3.24Å; N172-I176 VanDerWaalsContact O-CG1 3.28Å; N172-I176 WeakPolarHBondContact O-CG1 3.32Å; N172-I176 PolarHBondContact O-N 2.88Å
173	I	92.4	Very high	93	Very high	55 Å²	55	79.4 Å²	79.4	28%	0.282	38%	0.376	S	S	.	.	H	α-helix	trans	-62.2	-49	176.9	-70.4	163.1	0	0	0	109.8	W169 T170 D171 A175 I176 K177 I197 F201	W169-I173 VanDerWaalsContact O-CG1 3.26Å; W169-I173 WeakPolarHBondContact O-CG1 3.49Å; W169-I173 PolarHBondContact O-N 2.89Å; T170-I173 PolarHBondContact O-N 3.29Å; D171-I173 VanDerWaalsContact C-N 3.33Å; D171-I173 PolarHBondContact O-N 2.77Å; I173-A175 VanDerWaalsContact C-N 3.33Å; I173-A175 PolarHBondContact O-N 3.39Å; I173-I176 PolarHBondContact O-N 2.91Å; I173-K177 HydrophobicContact CG2-CD 4.18Å; I173-K177 WeakPolarHBondContact O-CG 3.37Å; I173-K177 PolarHBondContact O-N 3.4Å; I173-I197 HydrophobicContact CG2-CD1 3.78Å; I173-F201 HydrophobicContact CB-CE1 4.43Å; I173-F201 HydrophobicContact CD1-CE1 4.12Å; I173-F201 HydrophobicContact CD1-CZ 3.72Å; I173-F201 HydrophobicContact CG2-CE1 4.22Å
174	F	92.4	Very high	92.6	Very high	66 Å²	66	81.6 Å²	81.6	29%	0.289	39%	0.386	S	S	.	.	H	α-helix	trans	-61.9	-39.8	177.1	-67	-32.2	0	0	0	112.6	T170 D171 K177 S178 F201 Y203	T170-F174 HydrophobicContact CG2-CD2 3.92Å; T170-F174 HydrophobicContact CG2-CE2 3.37Å; T170-F174 HydrophobicContact CG2-CZ 3.85Å; T170-F174 WeakPolarHBondContact O-CD2 3.48Å; T170-F174 WeakPolarHBondContact O-CG 3.39Å; T170-F174 PolarHBondContact O-N 2.96Å; D171-F174 PolarHBondContact O-N 2.94Å; F174-K177 PolarHBondContact O-N 2.86Å; F174-S178 WeakPolarHBondContact O-CB 3.08Å; F174-S178 PolarHBondContact O-N 2.98Å; F174-F201 AromaticContact CE1-CD1 3.89Å; F174-F201 HydrophobicContact CE1-CD1 3.89Å; F174-F201 HydrophobicContact CE1-CE1 4.24Å; F174-F201 AromaticContact CZ-CD1 3.99Å; F174-F201 HydrophobicContact CZ-CD1 3.99Å; F174-F201 HydrophobicContact CZ-CE1 4.28Å; F174-Y203 HydrophobicContact CE2-CE2 4.17Å
175	A	92.9	Very high	92.2	Very high	59 Å²	59	80.1 Å²	80.1	49%	0.488	40%	0.396	S	S	.	.	H	α-helix	trans	-62.9	-45	176.7	0	0	0	0	0	112.1	D171 N172 I173 S178 W179	D171-A175 WeakPolarHBondContact O-CB 3.31Å; D171-A175 PolarHBondContact O-N 2.71Å; N172-A175 PolarHBondContact O-N 3.24Å; I173-A175 VanDerWaalsContact C-N 3.33Å; I173-A175 PolarHBondContact O-N 3.39Å; A175-S178 PolarHBondContact O-N 3.21Å; A175-W179 WeakPolarHBondContact O-CB 3.4Å; A175-W179 PolarHBondContact O-N 3.48Å
176	I	90.4	Very high	91.7	Very high	110 Å²	110	84 Å²	84	56%	0.564	41%	0.406	S	S	*	.	H	α-helix	trans	-65.4	-44.2	177.6	-68.7	167.6	0	0	0	110.6	N172 I173 S178 W179 A180	N172-I176 VanDerWaalsContact O-CG1 3.28Å; N172-I176 WeakPolarHBondContact O-CG1 3.32Å; N172-I176 PolarHBondContact O-N 2.88Å; I173-I176 PolarHBondContact O-N 2.91Å; I176-S178 PolarHBondContact O-N 3.23Å; I176-W179 PolarHBondContact O-N 3.04Å; I176-A180 WeakPolarHBondContact O-CB 3.22Å; I176-A180 PolarHBondContact O-N 3.18Å
177	K	89.2	Confident	91.2	Very high	26 Å²	26	89.2 Å²	89.2	11%	0.113	43%	0.425	C	S	.	.	H	α-helix	trans	-55.8	-51.2	174.8	-76.7	178.4	64	170.6	0	111.3	I173 F174 W179 A180 K181 I191 D192 I197	I173-K177 HydrophobicContact CG2-CD 4.18Å; I173-K177 WeakPolarHBondContact O-CG 3.37Å; I173-K177 PolarHBondContact O-N 3.4Å; F174-K177 PolarHBondContact O-N 2.86Å; K177-W179 VanDerWaalsContact C-N 3.34Å; K177-W179 PolarHBondContact O-N 3.35Å; K177-A180 PolarHBondContact O-N 3.12Å; K177-K181 WeakPolarHBondContact O-CB 3.39Å; K177-K181 PolarHBondContact O-N 2.92Å; K177-I191 HydrophobicContact CG-CG2 4.14Å; K177-D192 WeakPolarHBondContact CD-OD1 3.47Å; K177-D192 WeakPolarHBondContact CE-OD1 3.45Å; K177-D192 IonicContact NZ-OD1 2.77Å; K177-D192 PolarHBondContact NZ-OD1 2.98Å; K177-D192 IonicContact NZ-OD2 3.7Å; K177-D192 PolarHBondContact NZ-OD2 3.19Å; K177-I197 HydrophobicContact CD-CD1 3.98Å
178	S	90.1	Very high	90.5	Very high	51 Å²	51	91.2 Å²	91.2	36%	0.357	43%	0.434	S	S	.	.	H	α-helix	trans	-61.8	-39.8	179.2	178.3	0	0	0	0	112.5	F174 A175 I176 R182	F174-S178 WeakPolarHBondContact O-CB 3.08Å; F174-S178 PolarHBondContact O-N 2.98Å; A175-S178 PolarHBondContact O-N 3.21Å; I176-S178 PolarHBondContact O-N 3.23Å; S178-R182 WeakPolarHBondContact O-CB 3.44Å; S178-R182 VanDerWaalsContact O-CG 3.32Å; S178-R182 WeakPolarHBondContact O-CG 3.47Å; S178-R182 PolarHBondContact O-N 2.95Å; S178-R182 VanDerWaalsContact O-N 3.14Å; S178-R182 PolarHBondContact O-NE 3.47Å
179	W	92.7	Very high	90	Very high	137 Å²	137	90.1 Å²	90.1	52%	0.519	44%	0.439	S	S	.	.	H	α-helix	trans	-67.9	-45.6	175.8	176.1	83.3	0	0	0	112.5	A175 I176 K177 K181 R182 K183 F184	A175-W179 WeakPolarHBondContact O-CB 3.4Å; A175-W179 PolarHBondContact O-N 3.48Å; I176-W179 PolarHBondContact O-N 3.04Å; K177-W179 VanDerWaalsContact C-N 3.34Å; K177-W179 PolarHBondContact O-N 3.35Å; W179-K181 VanDerWaalsContact C-N 3.34Å; W179-K181 PolarHBondContact O-N 3.24Å; W179-R182 PolarHBondContact O-N 3.09Å; W179-K183 HydrophobicContact CD2-CB 4.49Å; W179-K183 HydrophobicContact CZ2-CB 4.43Å; W179-K183 HydrophobicContact CZ2-CG 4.17Å; W179-K183 VanDerWaalsContact O-CB 3.32Å; W179-K183 WeakPolarHBondContact O-CB 3.33Å; W179-K183 PolarHBondContact O-N 2.89Å; W179-F184 HydrophobicContact CE3-CE2 4.36Å; W179-F184 AromaticContact CH2-CE2 3.43Å; W179-F184 HydrophobicContact CH2-CE2 3.43Å; W179-F184 VanDerWaalsContact CH2-CE2 3.43Å; W179-F184 AromaticContact CH2-CZ 3.93Å; W179-F184 HydrophobicContact CH2-CZ 3.93Å; W179-F184 HydrophobicContact CZ2-CE2 4.09Å; W179-F184 HydrophobicContact CZ2-CZ 4.45Å; W179-F184 HydrophobicContact CZ3-CD2 4.42Å; W179-F184 AromaticContact CZ3-CE2 3.59Å; W179-F184 HydrophobicContact CZ3-CE2 3.59Å; W179-F184 HydrophobicContact CZ3-CZ 4.49Å
180	A	88.3	Confident	89.6	Confident	13 Å²	13	88.7 Å²	88.7	11%	0.107	44%	0.437	C	S	.	.	H	α-helix	trans	-62	-42.2	-179.9	0	0	0	0	0	111.8	I176 K177 F184 F186 I191	I176-A180 WeakPolarHBondContact O-CB 3.22Å; I176-A180 PolarHBondContact O-N 3.18Å; K177-A180 PolarHBondContact O-N 3.12Å; A180-F184 PolarHBondContact O-N 3.27Å; A180-F186 HydrophobicContact CB-CD2 4.34Å; A180-I191 HydrophobicContact CB-CD1 4.1Å
181	K	87.8	Confident	89.2	Confident	93 Å²	93	89.3 Å²	89.3	40%	0.404	44%	0.44	S	S	.	.	H	α-helix	trans	-58.3	-50.1	172.3	-177	178.7	-171.2	174.9	0	111.7	K177 W179 G185 E188	K177-K181 WeakPolarHBondContact O-CB 3.39Å; K177-K181 PolarHBondContact O-N 2.92Å; W179-K181 VanDerWaalsContact C-N 3.34Å; W179-K181 PolarHBondContact O-N 3.24Å; K181-G185 VanDerWaalsContact O-CA 3.26Å; K181-G185 WeakPolarHBondContact O-CA 3.24Å; K181-G185 PolarHBondContact O-N 2.99Å; K181-E188 HydrophobicContact CD-CG 4Å; K181-E188 WeakPolarHBondContact CD-OE1 3.49Å; K181-E188 IonicContact NZ-OE1 2.71Å; K181-E188 PolarHBondContact NZ-OE1 3.38Å; K181-E188 IonicContact NZ-OE2 2.94Å; K181-E188 PolarHBondContact NZ-OE2 3.21Å
182	R	90.3	Very high	88.9	Confident	192 Å²	192	87.2 Å²	87.2	73%	0.725	43%	0.429	S	S	*	.	H	α-helix	trans	-68.5	-38.3	-177.8	-74.3	-173.9	-66.5	166.1	-0.9	113.7	S178 W179	S178-R182 WeakPolarHBondContact O-CB 3.44Å; S178-R182 VanDerWaalsContact O-CG 3.32Å; S178-R182 WeakPolarHBondContact O-CG 3.47Å; S178-R182 PolarHBondContact O-N 2.95Å; S178-R182 VanDerWaalsContact O-N 3.14Å; S178-R182 PolarHBondContact O-NE 3.47Å; W179-R182 PolarHBondContact O-N 3.09Å
183	K	91.4	Very high	88.6	Confident	146 Å²	146	92.4 Å²	92.4	64%	0.635	45%	0.448	S	S	*	.	H	α-helix	trans	-87.7	-37	-172.2	-168.7	69.6	-177.9	-176.2	0	113.1	W179	W179-K183 HydrophobicContact CD2-CB 4.49Å; W179-K183 HydrophobicContact CZ2-CB 4.43Å; W179-K183 HydrophobicContact CZ2-CG 4.17Å; W179-K183 VanDerWaalsContact O-CB 3.32Å; W179-K183 WeakPolarHBondContact O-CB 3.33Å; W179-K183 PolarHBondContact O-N 2.89Å
184	F	88.8	Confident	88.5	Confident	117 Å²	117	94.5 Å²	94.5	51%	0.513	46%	0.464	S	S	.	.	H	α-helix	trans	-117.2	-3.4	-173.2	-56.7	-72.6	0	0	0	114	W179 A180 F186	W179-F184 HydrophobicContact CE3-CE2 4.36Å; W179-F184 AromaticContact CH2-CE2 3.43Å; W179-F184 HydrophobicContact CH2-CE2 3.43Å; W179-F184 VanDerWaalsContact CH2-CE2 3.43Å; W179-F184 AromaticContact CH2-CZ 3.93Å; W179-F184 HydrophobicContact CH2-CZ 3.93Å; W179-F184 HydrophobicContact CZ2-CE2 4.09Å; W179-F184 HydrophobicContact CZ2-CZ 4.45Å; W179-F184 HydrophobicContact CZ3-CD2 4.42Å; W179-F184 AromaticContact CZ3-CE2 3.59Å; W179-F184 HydrophobicContact CZ3-CE2 3.59Å; W179-F184 HydrophobicContact CZ3-CZ 4.49Å; A180-F184 PolarHBondContact O-N 3.27Å; F184-F186 VanDerWaalsContact C-N 3.29Å; F184-F186 HydrophobicContact CB-CD2 4.07Å; F184-F186 HydrophobicContact CB-CE1 4.41Å; F184-F186 HydrophobicContact CB-CE2 3.97Å; F184-F186 HydrophobicContact CB-CG 4.34Å; F184-F186 HydrophobicContact CB-CZ 4.14Å; F184-F186 HydrophobicContact CD2-CE2 4.49Å; F184-F186 HydrophobicContact CG-CE2 4.42Å; F184-F186 PolarHBondContact O-N 2.49Å
185	G	84.9	Confident	88.4	Confident	62 Å²	62	98.8 Å²	98.8	64%	0.639	48%	0.482	S	S	*	.			trans	70.9	22	178.3	0	0	0	0	0	114.2	K181	K181-G185 VanDerWaalsContact O-CA 3.26Å; K181-G185 WeakPolarHBondContact O-CA 3.24Å; K181-G185 PolarHBondContact O-N 2.99Å
186	F	86.6	Confident	88.3	Confident	114 Å²	114	98.8 Å²	98.8	50%	0.5	49%	0.488	S	S	.	.			trans	-70.8	140.6	178	-68.8	-30.8	0	0	0	112.4	A180 F184 I191	A180-F186 HydrophobicContact CB-CD2 4.34Å; F184-F186 VanDerWaalsContact C-N 3.29Å; F184-F186 HydrophobicContact CB-CD2 4.07Å; F184-F186 HydrophobicContact CB-CE1 4.41Å; F184-F186 HydrophobicContact CB-CE2 3.97Å; F184-F186 HydrophobicContact CB-CG 4.34Å; F184-F186 HydrophobicContact CB-CZ 4.14Å; F184-F186 HydrophobicContact CD2-CE2 4.49Å; F184-F186 HydrophobicContact CG-CE2 4.42Å; F184-F186 PolarHBondContact O-N 2.49Å; F186-I191 HydrophobicContact CB-CD1 3.85Å; F186-I191 HydrophobicContact CB-CG1 4.1Å
187	E	85.1	Confident	88.4	Confident	142 Å²	142	95 Å²	95	66%	0.664	47%	0.469	S	S	*	.			trans	-74.6	130	171.4	-66.2	-179.3	173.7	0	0	110.7	N189 K190 I191	E187-N189 VanDerWaalsContact C-N 3.33Å; E187-N189 PolarHBondContact O-N 3Å; E187-K190 HydrophobicContact CB-CB 4.35Å; E187-K190 WeakPolarHBondContact O-CB 2.83Å; E187-K190 PolarHBondContact O-N 2.93Å; E187-I191 PolarHBondContact O-N 3.17Å
188	E	81.8	Confident	88.4	Confident	73 Å²	73	97.2 Å²	97.2	34%	0.341	49%	0.486	S	S	.	.	H	α-helix	trans	-55.6	-44.8	-179.1	-84.5	159.8	176.8	0	0	112.4	K181 K190 I191 D192	K181-E188 HydrophobicContact CD-CG 4Å; K181-E188 WeakPolarHBondContact CD-OE1 3.49Å; K181-E188 IonicContact NZ-OE1 2.71Å; K181-E188 PolarHBondContact NZ-OE1 3.38Å; K181-E188 IonicContact NZ-OE2 2.94Å; K181-E188 PolarHBondContact NZ-OE2 3.21Å; E188-K190 PolarHBondContact O-N 3.5Å; E188-K190 VanDerWaalsContact O-N 3.13Å; E188-I191 WeakPolarHBondContact O-CB 3.48Å; E188-I191 PolarHBondContact O-N 2.99Å; E188-D192 PolarHBondContact O-N 3.09Å
189	N	84.5	Confident	88.2	Confident	119 Å²	119	104.4 Å²	104.4	64%	0.636	51%	0.514	S	S	*	.	H	α-helix	trans	-58.8	-30.1	178.7	-66.8	-11.2	0	0	0	113.1	E187 K193	E187-N189 VanDerWaalsContact C-N 3.33Å; E187-N189 PolarHBondContact O-N 3Å; N189-K193 WeakPolarHBondContact O-CB 3.04Å; N189-K193 VanDerWaalsContact O-CG 3.27Å; N189-K193 WeakPolarHBondContact O-CG 3.49Å; N189-K193 PolarHBondContact O-N 3.48Å
190	K	86.3	Confident	88.1	Confident	141 Å²	141	104.6 Å²	104.6	61%	0.613	53%	0.525	S	S	*	.	H	α-helix	trans	-78.5	-38.4	177.6	-169.6	174.3	179.9	177.5	0	111	E187 E188 T194	E187-K190 HydrophobicContact CB-CB 4.35Å; E187-K190 WeakPolarHBondContact O-CB 2.83Å; E187-K190 PolarHBondContact O-N 2.93Å; E188-K190 PolarHBondContact O-N 3.5Å; E188-K190 VanDerWaalsContact O-N 3.13Å; K190-T194 VanDerWaalsContact O-CB 3.29Å; K190-T194 WeakPolarHBondContact O-CB 3.25Å; K190-T194 PolarHBondContact O-N 2.91Å; K190-T194 PolarHBondContact O-OG1 3.09Å
191	I	86.9	Confident	88.3	Confident	20 Å²	20	106.9 Å²	106.9	10%	0.103	53%	0.532	C	S	.	.	H	α-helix	trans	-61.1	-49.3	173.4	-61.3	174.1	0	0	0	109.3	K177 A180 F186 E187 E188 K193 T194 F195	K177-I191 HydrophobicContact CG-CG2 4.14Å; A180-I191 HydrophobicContact CB-CD1 4.1Å; F186-I191 HydrophobicContact CB-CD1 3.85Å; F186-I191 HydrophobicContact CB-CG1 4.1Å; E187-I191 PolarHBondContact O-N 3.17Å; E188-I191 WeakPolarHBondContact O-CB 3.48Å; E188-I191 PolarHBondContact O-N 2.99Å; I191-K193 PolarHBondContact O-N 2.91Å; I191-T194 PolarHBondContact O-N 3.26Å; I191-T194 VanDerWaalsContact O-N 3.1Å; I191-F195 HydrophobicContact CG2-CD2 3.74Å; I191-F195 HydrophobicContact CG2-CE2 4.12Å; I191-F195 WeakPolarHBondContact O-CD2 3.38Å; I191-F195 PolarHBondContact O-N 2.86Å
192	D	89.4	Confident	88.5	Confident	29 Å²	29	107.4 Å²	107.4	16%	0.155	54%	0.54	C	S	.	.	H	α-helix	trans	-62.7	-46.4	-176.5	-68	-21.5	0	0	0	112.2	K177 E188 T194 F195 G196 I197	K177-D192 WeakPolarHBondContact CD-OD1 3.47Å; K177-D192 WeakPolarHBondContact CE-OD1 3.45Å; K177-D192 IonicContact NZ-OD1 2.77Å; K177-D192 PolarHBondContact NZ-OD1 2.98Å; K177-D192 IonicContact NZ-OD2 3.7Å; K177-D192 PolarHBondContact NZ-OD2 3.19Å; E188-D192 PolarHBondContact O-N 3.09Å; D192-T194 VanDerWaalsContact C-N 3.3Å; D192-T194 PolarHBondContact O-N 3.05Å; D192-F195 PolarHBondContact O-N 2.89Å; D192-G196 CarbonylContact O-C 3.32Å; D192-G196 WeakPolarHBondContact O-CA 3.44Å; D192-G196 PolarHBondContact O-N 3.09Å; D192-I197 HydrophobicContact CB-CB 4.15Å; D192-I197 PolarHBondContact O-N 3Å
193	K	89.4	Confident	88.5	Confident	176 Å²	176	103.3 Å²	103.3	77%	0.765	53%	0.525	S	S	*	.	H	α-helix	trans	-62.7	-34.9	173.7	-73.3	178.1	-177.2	-177.7	0	113.3	N189 I191	N189-K193 WeakPolarHBondContact O-CB 3.04Å; N189-K193 VanDerWaalsContact O-CG 3.27Å; N189-K193 WeakPolarHBondContact O-CG 3.49Å; N189-K193 PolarHBondContact O-N 3.48Å; I191-K193 PolarHBondContact O-N 2.91Å
194	T	90.4	Very high	88.5	Confident	99 Å²	99	100.9 Å²	100.9	61%	0.607	52%	0.518	S	S	*	.	H	α-helix	trans	-73.9	-40.2	-177.7	-56.9	0	0	0	0	111.8	K190 I191 D192	K190-T194 VanDerWaalsContact O-CB 3.29Å; K190-T194 WeakPolarHBondContact O-CB 3.25Å; K190-T194 PolarHBondContact O-N 2.91Å; K190-T194 PolarHBondContact O-OG1 3.09Å; I191-T194 PolarHBondContact O-N 3.26Å; I191-T194 VanDerWaalsContact O-N 3.1Å; D192-T194 VanDerWaalsContact C-N 3.3Å; D192-T194 PolarHBondContact O-N 3.05Å
195	F	89.3	Confident	88	Confident	156 Å²	156	104.5 Å²	104.5	68%	0.684	54%	0.543	S	S	*	.	H	α-helix	trans	-95.8	2.3	-179.1	-66.8	-73.9	0	0	0	113.6	I191 D192 I197	I191-F195 HydrophobicContact CG2-CD2 3.74Å; I191-F195 HydrophobicContact CG2-CE2 4.12Å; I191-F195 WeakPolarHBondContact O-CD2 3.38Å; I191-F195 PolarHBondContact O-N 2.86Å; D192-F195 PolarHBondContact O-N 2.89Å; F195-I197 HydrophobicContact CB-CD1 4.31Å; F195-I197 HydrophobicContact CB-CG1 4.19Å
196	G	91.3	Very high	88.1	Confident	59 Å²	59	106.7 Å²	106.7	61%	0.608	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.3	34.8	177.8	0	0	0	0	0	113.3	D192 P198	D192-G196 CarbonylContact O-C 3.32Å; D192-G196 WeakPolarHBondContact O-CA 3.44Å; D192-G196 PolarHBondContact O-N 3.09Å; G196-P198 WeakPolarHBondContact O-CD 3.34Å
197	I	91	Very high	88.2	Confident	31 Å²	31	106.3 Å²	106.3	16%	0.159	54%	0.54	C	S	.	.			trans	-81.6	118.2	177.8	-57.2	174.4	0	0	0	108.1	I173 K177 D192 F195 F201	I173-I197 HydrophobicContact CG2-CD1 3.78Å; K177-I197 HydrophobicContact CD-CD1 3.98Å; D192-I197 HydrophobicContact CB-CB 4.15Å; D192-I197 PolarHBondContact O-N 3Å; F195-I197 HydrophobicContact CB-CD1 4.31Å; F195-I197 HydrophobicContact CB-CG1 4.19Å; I197-F201 HydrophobicContact CG2-CB 3.82Å; I197-F201 HydrophobicContact CG2-CD1 4.01Å; I197-F201 HydrophobicContact CG2-CG 3.89Å
198	P	90.9	Very high	88.4	Confident	71 Å²	71	104.3 Å²	104.3	46%	0.461	53%	0.533	S	S	.	.			trans	-62.2	155.8	177.8	-23.2	34.5	0	0	0	113.2	G196 D200 F201	G196-P198 WeakPolarHBondContact O-CD 3.34Å; P198-D200 VanDerWaalsContact C-N 3.28Å; P198-D200 WeakPolarHBondContact CB-OD1 3.41Å; P198-D200 PolarHBondContact O-N 3.36Å; P198-F201 HydrophobicContact CB-CB 4.4Å; P198-F201 WeakPolarHBondContact O-CB 3.5Å; P198-F201 PolarHBondContact O-N 2.82Å
199	E	85.3	Confident	88.8	Confident	203 Å²	203	106.1 Å²	106.1	95%	0.949	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-26.3	177.3	-68.5	-175.7	176.7	0	0	112.6	F201	E199-F201 VanDerWaalsContact C-N 3.32Å
200	D	90.6	Very high	89	Confident	140 Å²	140	105.3 Å²	105.3	75%	0.749	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.1	14.3	175.5	63.8	-28.2	0	0	0	112.8	P198 D202	P198-D200 VanDerWaalsContact C-N 3.28Å; P198-D200 WeakPolarHBondContact CB-OD1 3.41Å; P198-D200 PolarHBondContact O-N 3.36Å; D200-D202 PolarHBondContact O-N 2.54Å; D200-D202 VanDerWaalsContact O-N 3.09Å
201	F	91.6	Very high	89.2	Confident	62 Å²	62	102.9 Å²	102.9	27%	0.272	53%	0.534	S	S	.	.			trans	-67.8	108.8	178	-175.5	-98.5	0	0	0	110.9	T170 I173 F174 I197 P198 E199	T170-F201 HydrophobicContact CG2-CD1 4.49Å; T170-F201 HydrophobicContact CG2-CE1 3.74Å; T170-F201 HydrophobicContact CG2-CZ 4.17Å; I173-F201 HydrophobicContact CB-CE1 4.43Å; I173-F201 HydrophobicContact CD1-CE1 4.12Å; I173-F201 HydrophobicContact CD1-CZ 3.72Å; I173-F201 HydrophobicContact CG2-CE1 4.22Å; F174-F201 AromaticContact CE1-CD1 3.89Å; F174-F201 HydrophobicContact CE1-CD1 3.89Å; F174-F201 HydrophobicContact CE1-CE1 4.24Å; F174-F201 AromaticContact CZ-CD1 3.99Å; F174-F201 HydrophobicContact CZ-CD1 3.99Å; F174-F201 HydrophobicContact CZ-CE1 4.28Å; I197-F201 HydrophobicContact CG2-CB 3.82Å; I197-F201 HydrophobicContact CG2-CD1 4.01Å; I197-F201 HydrophobicContact CG2-CG 3.89Å; P198-F201 HydrophobicContact CB-CB 4.4Å; P198-F201 WeakPolarHBondContact O-CB 3.5Å; P198-F201 PolarHBondContact O-N 2.82Å; E199-F201 VanDerWaalsContact C-N 3.32Å
202	D	92.4	Very high	89.4	Confident	104 Å²	104	108.9 Å²	108.9	56%	0.556	56%	0.564	S	S	*	*			trans	-143.2	-178.7	-178.9	-153.8	-5.5	0	0	0	111.2	D200	D200-D202 PolarHBondContact O-N 2.54Å; D200-D202 VanDerWaalsContact O-N 3.09Å
203	Y	91.3	Very high	89.4	Confident	106 Å²	106	115 Å²	115	42%	0.416	60%	0.596	S	S	.	*			trans	-60.7	146.6	173.3	-61.9	-81.1	0	0	0	111.8	N167 T170 D171 F174	N167-Y203 HydrophobicContact CB-CD1 3.81Å; N167-Y203 HydrophobicContact CB-CE1 4.42Å; N167-Y203 WeakPolarHBondContact OD1-CA 3.35Å; T170-Y203 HydrophobicContact CG2-CD1 4.02Å; T170-Y203 HydrophobicContact CG2-CE1 4.01Å; T170-Y203 HydrophobicContact CG2-CG 4.4Å; D171-Y203 WeakPolarHBondContact OD1-CE1 3.45Å; D171-Y203 VanDerWaalsContact OD1-CZ 3.25Å; D171-Y203 PolarHBondContact OD1-OH 3.29Å; F174-Y203 HydrophobicContact CE2-CE2 4.17Å
204	I	90.3	Very high	89.4	Confident	94 Å²	94	109.9 Å²	109.9	48%	0.482	58%	0.582	S	S	.	*			trans	-84.7	131.1	172.9	-57.5	178.9	0	0	0	108.4	K163 A166 N167	K163-I204 WeakPolarHBondContact CE-O 3.49Å; K163-I204 HydrophobicContact CG-CB 4.38Å; K163-I204 HydrophobicContact CG-CG2 4.27Å; A166-I204 HydrophobicContact CB-CD1 3.85Å; N167-I204 PolarHBondContact ND2-O 3.08Å; N167-I204 VanDerWaalsContact ND2-O 3.09Å; N167-I204 PolarHBondContact OD1-N 3.42Å
205	D	78	Confident	89.3	Confident	194 Å²	194	110.9 Å²	110.9	100%	1.037	58%	0.579	S	S	*	*			trans	-83.6	0	175.8	-86.4	-21	0	0	0	115.4	K163	K163-D205 WeakPolarHBondContact CE-O 3.28Å; K163-D205 WeakPolarHBondContact CE-OXT 3.49Å; K163-D205 PolarHBondContact NZ-O 3.47Å; K163-D205 VanDerWaalsContact NZ-O 3.08Å; K163-D205 PolarHBondContact NZ-OXT 2.91Å

Retrieved 205 of 205 residues in 95 ms (Link to these results)

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