A0A096NVC0_PAPAN Loading...

Sperm flagellar protein 1

AlphaFold DB , UniProt , Accession A0A096NVC0, Species PAPAN (Papio anubis, Olive baboon), Gene SPEF1, Length 236 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	33.3	Very low	62.9	Low	247 Å²	247	112.4 Å²	112.4	100%	1.217	64%	0.635	S	S	*	*				0	89.2	0	-63.9	179.1	-172.4	0	0	107.5
2	A	40.4	Very low	64.5	Low	104 Å²	104	110.5 Å²	110.5	86%	0.86	62%	0.617	S	S	*	*			trans	-153.8	85	178.4	0	0	0	0	0	106.7
3	S	46.4	Very low	66	Low	105 Å²	105	102.2 Å²	102.2	73%	0.734	57%	0.571	S	S	*	*			trans	-157.7	130.4	-177.6	44.9	0	0	0	0	109.2
4	S	49.9	Very low	67.1	Low	101 Å²	101	101.6 Å²	101.6	71%	0.706	56%	0.556	S	S	*	*			trans	60.3	106	-179	60.1	0	0	0	0	116.3	D6	S4-D6 PolarHBondContact O-N 3.27Å
5	V	58.9	Low	68.1	Low	56 Å²	56	100.7 Å²	100.7	34%	0.339	55%	0.55	S	S	.	.			trans	-44.3	125.7	142.7	174.2	0	0	0	0	107	E7 A9 L102 I105	V5-E7 PolarHBondContact O-N 3.41Å; V5-A9 HydrophobicContact CG1-CB 4.38Å; V5-L102 HydrophobicContact CG2-CD2 3.61Å; V5-L102 HydrophobicContact CG2-CG 4.44Å; V5-I105 HydrophobicContact CG1-CD1 3.48Å; V5-I105 VanDerWaalsContact CG1-CD1 3.48Å
6	D	73.8	Confident	69.2	Low	114 Å²	114	95.5 Å²	95.5	61%	0.61	52%	0.519	S	S	*	.			trans	-51.8	129.9	-175.5	-61.6	-51.5	0	0	0	110.3	S4 E8 A9 L10	S4-D6 PolarHBondContact O-N 3.27Å; D6-E8 PolarHBondContact O-N 3.5Å; D6-E8 VanDerWaalsContact O-N 3.11Å; D6-A9 HydrophobicContact CB-CB 4.16Å; D6-A9 WeakPolarHBondContact O-CA 3.41Å; D6-A9 WeakPolarHBondContact O-CB 3.5Å; D6-A9 PolarHBondContact O-N 3.46Å; D6-L10 PolarHBondContact O-N 2.92Å
7	E	74.3	Confident	69.9	Low	173 Å²	173	90.1 Å²	90.1	81%	0.808	49%	0.49	S	S	*	.	H	α-helix	trans	-56.3	-30	-179.1	-165.3	170.2	-163.3	0	0	111.3	V5 L10 H11	V5-E7 PolarHBondContact O-N 3.41Å; E7-L10 WeakPolarHBondContact O-CB 3.49Å; E7-L10 PolarHBondContact O-N 3.29Å; E7-H11 WeakPolarHBondContact O-CB 3.42Å; E7-H11 PolarHBondContact O-N 3.02Å
8	E	76.9	Confident	70.3	Confident	138 Å²	138	92.3 Å²	92.3	65%	0.645	50%	0.501	S	S	*	.	H	α-helix	trans	-65.4	-47.7	170.9	-169	-174.6	168.2	0	0	112.8	D6 L10 H11 Q12	D6-E8 PolarHBondContact O-N 3.5Å; D6-E8 VanDerWaalsContact O-N 3.11Å; E8-L10 PolarHBondContact O-N 2.68Å; E8-H11 PolarHBondContact O-N 2.98Å; E8-H11 VanDerWaalsContact O-N 3.17Å; E8-Q12 WeakPolarHBondContact O-CG 3.48Å; E8-Q12 PolarHBondContact O-N 3.2Å; E8-Q12 PolarHBondContact OE1-NE2 2.94Å
9	A	78.7	Confident	70.7	Confident	32 Å²	32	94.4 Å²	94.4	26%	0.264	51%	0.512	S	S	.	.	H	α-helix	trans	-62.5	-35.7	177.5	0	0	0	0	0	111.1	V5 D6 L13	V5-A9 HydrophobicContact CG1-CB 4.38Å; D6-A9 HydrophobicContact CB-CB 4.16Å; D6-A9 WeakPolarHBondContact O-CA 3.41Å; D6-A9 WeakPolarHBondContact O-CB 3.5Å; D6-A9 PolarHBondContact O-N 3.46Å; A9-L13 WeakPolarHBondContact O-CB 3.38Å; A9-L13 PolarHBondContact O-N 3.4Å
10	L	80.1	Confident	71	Confident	51 Å²	51	90 Å²	90	27%	0.267	49%	0.488	S	S	.	.	H	α-helix	trans	-63	-53.8	172.2	-173.4	61.4	0	0	0	110.4	D6 E7 E8 Q12 L13 Y14 E101	D6-L10 PolarHBondContact O-N 2.92Å; E7-L10 WeakPolarHBondContact O-CB 3.49Å; E7-L10 PolarHBondContact O-N 3.29Å; E8-L10 PolarHBondContact O-N 2.68Å; L10-Q12 VanDerWaalsContact C-N 3.31Å; L10-Q12 PolarHBondContact O-N 3.48Å; L10-L13 WeakPolarHBondContact O-CA 3.38Å; L10-L13 VanDerWaalsContact O-CB 3.29Å; L10-L13 WeakPolarHBondContact O-CB 3.39Å; L10-L13 PolarHBondContact O-N 3.22Å; L10-Y14 HydrophobicContact CD1-CD2 4.06Å; L10-Y14 HydrophobicContact CD1-CE2 3.55Å; L10-Y14 HydrophobicContact CD2-CE2 4.17Å; L10-Y14 HydrophobicContact CG-CD2 3.94Å; L10-Y14 HydrophobicContact CG-CE2 3.59Å; L10-Y14 VanDerWaalsContact O-CD2 3.24Å; L10-Y14 WeakPolarHBondContact O-CD2 3.34Å; L10-Y14 PolarHBondContact O-N 3.11Å; L10-E101 HydrophobicContact CD1-CB 4.36Å; L10-E101 HydrophobicContact CD1-CG 3.58Å
11	H	79.4	Confident	70.8	Confident	115 Å²	115	90.3 Å²	90.3	53%	0.532	50%	0.495	S	S	.	.	H	α-helix	trans	-55	-45.1	178.1	-173.4	77.3	0	0	0	112.6	E7 E8 L13 Y14 L15	E7-H11 WeakPolarHBondContact O-CB 3.42Å; E7-H11 PolarHBondContact O-N 3.02Å; E8-H11 PolarHBondContact O-N 2.98Å; E8-H11 VanDerWaalsContact O-N 3.17Å; H11-L13 VanDerWaalsContact C-N 3.29Å; H11-L13 PolarHBondContact O-N 2.99Å; H11-Y14 WeakPolarHBondContact O-CB 3.39Å; H11-Y14 PolarHBondContact O-N 3.48Å; H11-L15 PolarHBondContact O-N 2.92Å
12	Q	82.6	Confident	72.5	Confident	90 Å²	90	80 Å²	80	42%	0.421	45%	0.445	S	S	.	.	H	α-helix	trans	-62.4	-34.9	175.6	-69.6	-176.9	19.2	0	0	112.7	E8 L10 W16 R108	E8-Q12 WeakPolarHBondContact O-CG 3.48Å; E8-Q12 PolarHBondContact O-N 3.2Å; E8-Q12 PolarHBondContact OE1-NE2 2.94Å; L10-Q12 VanDerWaalsContact C-N 3.31Å; L10-Q12 PolarHBondContact O-N 3.48Å; Q12-W16 WeakPolarHBondContact O-CB 3.39Å; Q12-W16 PolarHBondContact O-N 3.31Å; Q12-R108 PolarHBondContact O-NH1 2.92Å
13	L	83.3	Confident	73.4	Confident	3 Å²	3	79.6 Å²	79.6	2%	0.016	44%	0.435	C	S	.	.	H	α-helix	trans	-65.7	-43.9	174	-179	71.4	0	0	0	111.1	A9 L10 H11 W16 V17 L29 E101 L104 I105	A9-L13 WeakPolarHBondContact O-CB 3.38Å; A9-L13 PolarHBondContact O-N 3.4Å; L10-L13 WeakPolarHBondContact O-CA 3.38Å; L10-L13 VanDerWaalsContact O-CB 3.29Å; L10-L13 WeakPolarHBondContact O-CB 3.39Å; L10-L13 PolarHBondContact O-N 3.22Å; H11-L13 VanDerWaalsContact C-N 3.29Å; H11-L13 PolarHBondContact O-N 2.99Å; L13-W16 HydrophobicContact CD1-CE3 3.74Å; L13-W16 HydrophobicContact CD1-CZ3 4.03Å; L13-W16 PolarHBondContact O-N 2.88Å; L13-V17 WeakPolarHBondContact O-CG2 3.25Å; L13-V17 PolarHBondContact O-N 3.22Å; L13-L29 HydrophobicContact CD2-CD2 4.2Å; L13-L29 HydrophobicContact CG-CD2 4.49Å; L13-E101 HydrophobicContact CD2-CB 4.44Å; L13-E101 HydrophobicContact CD2-CG 4.42Å; L13-L104 HydrophobicContact CD1-CB 3.9Å; L13-L104 HydrophobicContact CD2-CB 3.88Å; L13-L104 HydrophobicContact CD2-CD1 4.25Å; L13-L104 HydrophobicContact CG-CB 4.49Å; L13-I105 HydrophobicContact CD2-CG1 4.21Å
14	Y	81.1	Confident	73.9	Confident	94 Å²	94	82.3 Å²	82.3	37%	0.369	43%	0.429	S	S	.	.	H	α-helix	trans	-58.1	-49.4	176.6	-84.8	-94.9	0	0	0	111.2	L10 H11 W16 V17 D18 L29	L10-Y14 HydrophobicContact CD1-CD2 4.06Å; L10-Y14 HydrophobicContact CD1-CE2 3.55Å; L10-Y14 HydrophobicContact CD2-CE2 4.17Å; L10-Y14 HydrophobicContact CG-CD2 3.94Å; L10-Y14 HydrophobicContact CG-CE2 3.59Å; L10-Y14 VanDerWaalsContact O-CD2 3.24Å; L10-Y14 WeakPolarHBondContact O-CD2 3.34Å; L10-Y14 PolarHBondContact O-N 3.11Å; H11-Y14 WeakPolarHBondContact O-CB 3.39Å; H11-Y14 PolarHBondContact O-N 3.48Å; Y14-W16 PolarHBondContact O-N 3.39Å; Y14-V17 PolarHBondContact O-N 3.04Å; Y14-D18 PolarHBondContact O-N 2.92Å; Y14-L29 HydrophobicContact CD1-CD1 3.16Å; Y14-L29 HydrophobicContact CD2-CD1 4.03Å; Y14-L29 HydrophobicContact CE1-CD1 2.93Å; Y14-L29 HydrophobicContact CE1-CG 4.34Å; Y14-L29 HydrophobicContact CE2-CD1 3.79Å; Y14-L29 HydrophobicContact CG-CD1 3.71Å
15	L	82.3	Confident	73.9	Confident	87 Å²	87	83.9 Å²	83.9	46%	0.455	44%	0.438	S	S	.	.	H	α-helix	trans	-61.2	-42.7	177.3	-67.2	176.2	0	0	0	112.3	H11 V17 D18 N19	H11-L15 PolarHBondContact O-N 2.92Å; L15-V17 VanDerWaalsContact C-N 3.33Å; L15-V17 PolarHBondContact O-N 3.19Å; L15-D18 PolarHBondContact O-N 3.43Å; L15-N19 PolarHBondContact O-N 3.4Å; L15-N19 VanDerWaalsContact O-N 3.09Å; L15-N19 PolarHBondContact O-ND2 2.96Å
16	W	85.5	Confident	73.9	Confident	18 Å²	18	83.4 Å²	83.4	7%	0.068	43%	0.431	C	S	.	.	H	α-helix	trans	-61.6	-42.8	178.1	170.7	73.3	0	0	0	112	Q12 L13 Y14 D18 N19 I20 V42 Y46 R108 L111	Q12-W16 WeakPolarHBondContact O-CB 3.39Å; Q12-W16 PolarHBondContact O-N 3.31Å; L13-W16 HydrophobicContact CD1-CE3 3.74Å; L13-W16 HydrophobicContact CD1-CZ3 4.03Å; L13-W16 PolarHBondContact O-N 2.88Å; Y14-W16 PolarHBondContact O-N 3.39Å; W16-D18 VanDerWaalsContact C-N 3.34Å; W16-N19 PolarHBondContact O-N 3.14Å; W16-I20 HydrophobicContact CD2-CD1 4.25Å; W16-I20 HydrophobicContact CH2-CD1 4.22Å; W16-I20 HydrophobicContact CZ2-CD1 3.84Å; W16-I20 WeakPolarHBondContact O-CG1 3.24Å; W16-V42 HydrophobicContact CH2-CG1 3.56Å; W16-V42 HydrophobicContact CZ2-CG1 4.07Å; W16-V42 HydrophobicContact CZ3-CG1 4.37Å; W16-Y46 AromaticContact CZ2-CE2 3.84Å; W16-Y46 HydrophobicContact CZ2-CE2 3.84Å; W16-Y46 AromaticContact NE1-CZ 3.95Å; W16-Y46 PolarHBondContact NE1-OH 3.16Å; W16-R108 HydrophobicContact CD2-CB 4.37Å; W16-R108 HydrophobicContact CD2-CG 3.87Å; W16-R108 HydrophobicContact CE3-CB 4.28Å; W16-R108 HydrophobicContact CE3-CG 4.25Å; W16-R108 HydrophobicContact CG-CG 4.31Å; W16-R108 HydrophobicContact CH2-CB 3.88Å; W16-R108 HydrophobicContact CH2-CG 4.24Å; W16-R108 HydrophobicContact CZ2-CB 3.98Å; W16-R108 HydrophobicContact CZ2-CG 3.86Å; W16-R108 HydrophobicContact CZ3-CB 4.04Å; W16-R108 HydrophobicContact CZ3-CG 4.43Å; W16-L111 HydrophobicContact CH2-CD1 4.23Å; W16-L111 HydrophobicContact CZ2-CD1 4.23Å
17	V	81	Confident	73.4	Confident	4 Å²	4	89.2 Å²	89.2	2%	0.024	44%	0.444	C	S	.	.	H	α-helix	trans	-64.8	-40	177.4	172	0	0	0	0	111.3	L13 Y14 L15 N19 I20 L22 K26 L29 F33	L13-V17 WeakPolarHBondContact O-CG2 3.25Å; L13-V17 PolarHBondContact O-N 3.22Å; Y14-V17 PolarHBondContact O-N 3.04Å; L15-V17 VanDerWaalsContact C-N 3.33Å; L15-V17 PolarHBondContact O-N 3.19Å; V17-N19 VanDerWaalsContact C-N 3.31Å; V17-N19 PolarHBondContact O-N 2.77Å; V17-I20 PolarHBondContact O-N 3.01Å; V17-L22 HydrophobicContact CG1-CD1 3.87Å; V17-L22 WeakPolarHBondContact O-CD1 3.45Å; V17-K26 HydrophobicContact CG1-CD 3.35Å; V17-L29 HydrophobicContact CG2-CD2 4.26Å; V17-F33 HydrophobicContact CG1-CE2 4.06Å; V17-F33 HydrophobicContact CG1-CZ 3.73Å; V17-F33 HydrophobicContact CG2-CZ 3.9Å
18	D	77.1	Confident	73.5	Confident	129 Å²	129	84.2 Å²	84.2	69%	0.69	42%	0.423	S	S	*	.	H	α-helix	trans	-67.3	-30.6	179.9	-160.3	47.9	0	0	0	112.8	Y14 L15 W16 I20	Y14-D18 PolarHBondContact O-N 2.92Å; L15-D18 PolarHBondContact O-N 3.43Å; W16-D18 VanDerWaalsContact C-N 3.34Å; D18-I20 PolarHBondContact O-N 2.85Å
19	N	77.9	Confident	73.6	Confident	132 Å²	132	77.9 Å²	77.9	71%	0.706	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-14.5	174.3	-78.1	-60.8	0	0	0	114	L15 W16 V17	L15-N19 PolarHBondContact O-N 3.4Å; L15-N19 VanDerWaalsContact O-N 3.09Å; L15-N19 PolarHBondContact O-ND2 2.96Å; W16-N19 PolarHBondContact O-N 3.14Å; V17-N19 VanDerWaalsContact C-N 3.31Å; V17-N19 PolarHBondContact O-N 2.77Å
20	I	77.3	Confident	73.9	Confident	6 Å²	6	77 Å²	77	3%	0.031	39%	0.386	C	S	.	.	S	Bend	trans	-88.2	127	178.4	-58.9	169.5	0	0	0	107.9	W16 V17 D18 L22 V42 F45 Y46	W16-I20 HydrophobicContact CD2-CD1 4.25Å; W16-I20 HydrophobicContact CH2-CD1 4.22Å; W16-I20 HydrophobicContact CZ2-CD1 3.84Å; W16-I20 WeakPolarHBondContact O-CG1 3.24Å; V17-I20 PolarHBondContact O-N 3.01Å; D18-I20 PolarHBondContact O-N 2.85Å; I20-L22 VanDerWaalsContact C-N 3.28Å; I20-L22 HydrophobicContact CB-CD1 4.11Å; I20-L22 HydrophobicContact CB-CG 4.11Å; I20-L22 HydrophobicContact CG2-CD1 4.36Å; I20-L22 HydrophobicContact CG2-CD2 4.04Å; I20-L22 HydrophobicContact CG2-CG 3.88Å; I20-L22 WeakPolarHBondContact O-CG 3.46Å; I20-L22 PolarHBondContact O-N 2.81Å; I20-V42 HydrophobicContact CD1-CB 4.44Å; I20-V42 HydrophobicContact CD1-CG1 3.88Å; I20-V42 HydrophobicContact CD1-CG2 4.02Å; I20-F45 HydrophobicContact CG1-CD1 4.47Å; I20-F45 HydrophobicContact CG2-CB 3.98Å; I20-F45 HydrophobicContact CG2-CD1 3.9Å; I20-F45 HydrophobicContact CG2-CD2 4.32Å; I20-F45 HydrophobicContact CG2-CE1 4.48Å; I20-F45 HydrophobicContact CG2-CG 3.81Å; I20-Y46 HydrophobicContact CD1-CE2 3.88Å; I20-Y46 HydrophobicContact CG1-CE2 4.45Å
21	P	66.8	Low	74.2	Confident	98 Å²	98	81.5 Å²	81.5	64%	0.636	40%	0.399	S	S	*	.			trans	-70.1	87	178.2	29.8	-34.6	0	0	0	109.8	F45	P21-F45 HydrophobicContact CG-CD2 3.75Å; P21-F45 HydrophobicContact CG-CE2 3.4Å; P21-F45 HydrophobicContact CG-CZ 4.22Å
22	L	68.3	Low	74.5	Confident	31 Å²	31	77.7 Å²	77.7	16%	0.162	38%	0.383	C	S	.	.			trans	-95.3	152.6	-178.8	-66.9	152.8	0	0	0	110	V17 I20 R24 K26 L38 E41 V42	V17-L22 HydrophobicContact CG1-CD1 3.87Å; V17-L22 WeakPolarHBondContact O-CD1 3.45Å; I20-L22 VanDerWaalsContact C-N 3.28Å; I20-L22 HydrophobicContact CB-CD1 4.11Å; I20-L22 HydrophobicContact CB-CG 4.11Å; I20-L22 HydrophobicContact CG2-CD1 4.36Å; I20-L22 HydrophobicContact CG2-CD2 4.04Å; I20-L22 HydrophobicContact CG2-CG 3.88Å; I20-L22 WeakPolarHBondContact O-CG 3.46Å; I20-L22 PolarHBondContact O-N 2.81Å; L22-R24 PolarHBondContact O-N 3.47Å; L22-K26 HydrophobicContact CD1-CD 3.94Å; L22-L38 HydrophobicContact CD2-CD2 4.29Å; L22-E41 HydrophobicContact CD2-CB 3.79Å; L22-V42 HydrophobicContact CD2-CG2 3.85Å
23	S	60	Low	74.8	Confident	94 Å²	94	73.4 Å²	73.4	66%	0.657	36%	0.363	S	S	*	.	S	Bend	trans	-66.8	-11.2	-171.8	-48.4	0	0	0	0	114	E41	S23-E41 WeakPolarHBondContact CB-OE2 3.45Å; S23-E41 PolarHBondContact N-OE2 3.28Å; S23-E41 PolarHBondContact OG-OE2 3.46Å
24	R	56.4	Low	75.2	Confident	162 Å²	162	73.5 Å²	73.5	61%	0.611	36%	0.363	S	S	*	.	S	Bend	trans	-144.6	141	-173.7	-54.7	-174.1	-173.9	-155	-0	111.8	L22 K26	L22-R24 PolarHBondContact O-N 3.47Å; R24-K26 PolarHBondContact O-N 2.82Å
25	P	51.3	Low	75.7	Confident	135 Å²	135	70.1 Å²	70.1	88%	0.877	35%	0.351	S	S	*	.			trans	-67.8	126.4	174.1	27.1	-32.2	0	0	0	110.3
26	K	57.9	Low	76.1	Confident	45 Å²	45	66 Å²	66	20%	0.196	33%	0.33	C	S	.	.			trans	-91.5	133	-175.5	-76.2	171.3	172.1	176.8	0	110.8	V17 L22 R24 F33 L38	V17-K26 HydrophobicContact CG1-CD 3.35Å; L22-K26 HydrophobicContact CD1-CD 3.94Å; R24-K26 PolarHBondContact O-N 2.82Å; K26-F33 HydrophobicContact CD-CE2 3.88Å; K26-F33 HydrophobicContact CD-CZ 4.34Å; K26-F33 VanDerWaalsContact NZ-CE2 3.29Å; K26-L38 HydrophobicContact CD-CD1 4.46Å; K26-L38 HydrophobicContact CG-CD1 4.4Å
27	R	64.3	Low	76.4	Confident	236 Å²	236	65.5 Å²	65.5	89%	0.891	33%	0.329	S	S	*	.	S	Bend	trans	-123.4	-22.7	174.5	-126.8	177.1	169.5	179.6	-4.6	112.3	D32	R27-D32 PolarHBondContact N-OD2 3.34Å
28	N	75.7	Confident	76.8	Confident	69 Å²	69	66 Å²	66	37%	0.369	33%	0.331	S	S	.	.			trans	-144	104.4	-179.2	-174.8	-33.4	0	0	0	110.9	S30 R31 D32	N28-S30 PolarHBondContact O-N 2.97Å; N28-S30 PolarHBondContact OD1-N 2.95Å; N28-R31 HydrophobicContact CB-CB 4.28Å; N28-R31 PolarHBondContact O-N 3.5Å; N28-R31 PolarHBondContact OD1-N 3.3Å; N28-D32 PolarHBondContact N-OD2 3.47Å; N28-D32 VanDerWaalsContact O-CB 3.26Å; N28-D32 WeakPolarHBondContact O-CB 3.41Å; N28-D32 PolarHBondContact O-N 3.12Å
29	L	79.4	Confident	77.5	Confident	4 Å²	4	59.9 Å²	59.9	2%	0.021	30%	0.299	C	S	.	.	H	α-helix	trans	-58.6	-44.9	-177	-91.8	103.5	0	0	0	112.9	L13 Y14 V17 R31 D32 F33 L104	L13-L29 HydrophobicContact CD2-CD2 4.2Å; L13-L29 HydrophobicContact CG-CD2 4.49Å; Y14-L29 HydrophobicContact CD1-CD1 3.16Å; Y14-L29 HydrophobicContact CD2-CD1 4.03Å; Y14-L29 HydrophobicContact CE1-CD1 2.93Å; Y14-L29 HydrophobicContact CE1-CG 4.34Å; Y14-L29 HydrophobicContact CE2-CD1 3.79Å; Y14-L29 HydrophobicContact CG-CD1 3.71Å; V17-L29 HydrophobicContact CG2-CD2 4.26Å; L29-R31 VanDerWaalsContact C-N 3.28Å; L29-R31 PolarHBondContact O-N 3.21Å; L29-D32 PolarHBondContact O-N 2.97Å; L29-F33 HydrophobicContact CB-CD2 4.16Å; L29-F33 HydrophobicContact CB-CE2 4.36Å; L29-F33 HydrophobicContact CD2-CD2 4.07Å; L29-F33 HydrophobicContact CD2-CE2 3.59Å; L29-F33 HydrophobicContact CD2-CZ 4.13Å; L29-F33 HydrophobicContact CG-CD2 3.99Å; L29-F33 HydrophobicContact CG-CE2 3.67Å; L29-F33 VanDerWaalsContact O-CB 3.31Å; L29-F33 WeakPolarHBondContact O-CB 3.35Å; L29-F33 VanDerWaalsContact O-CD2 3.3Å; L29-F33 WeakPolarHBondContact O-CD2 3.48Å; L29-F33 PolarHBondContact O-N 2.87Å; L29-L104 HydrophobicContact CD2-CD1 3.61Å
30	S	84.4	Confident	78.1	Confident	14 Å²	14	53.6 Å²	53.6	10%	0.098	27%	0.265	C	S	.	.	H	α-helix	trans	-60.8	-39.7	-176.6	-40.9	0	0	0	0	111.8	N28 S34 E101	N28-S30 PolarHBondContact O-N 2.97Å; N28-S30 PolarHBondContact OD1-N 2.95Å; S30-S34 WeakPolarHBondContact O-CB 3.25Å; S30-S34 PolarHBondContact O-N 3.06Å; S30-E101 PolarHBondContact OG-OE1 2.98Å
31	R	86.4	Confident	78.7	Confident	146 Å²	146	54.9 Å²	54.9	55%	0.551	27%	0.271	S	S	*	.	H	α-helix	trans	-76.2	-50.8	177.3	-172.8	-178	67.1	-165	-0.4	112.1	N28 L29 F33 S34	N28-R31 HydrophobicContact CB-CB 4.28Å; N28-R31 PolarHBondContact O-N 3.5Å; N28-R31 PolarHBondContact OD1-N 3.3Å; L29-R31 VanDerWaalsContact C-N 3.28Å; L29-R31 PolarHBondContact O-N 3.21Å; R31-F33 VanDerWaalsContact C-N 3.27Å; R31-F33 PolarHBondContact O-N 3.44Å; R31-S34 WeakPolarHBondContact O-CB 3.37Å; R31-S34 PolarHBondContact O-N 2.72Å; R31-S34 VanDerWaalsContact O-N 3.14Å; R31-S34 PolarHBondContact O-OG 3.04Å
32	D	86.1	Confident	79.8	Confident	35 Å²	35	50.2 Å²	50.2	19%	0.187	24%	0.241	C	C	.	.	H	α-helix	trans	-69.9	-27.4	-169.4	-62.2	-21.6	0	0	0	111.2	R27 N28 L29 L38	R27-D32 PolarHBondContact N-OD2 3.34Å; N28-D32 PolarHBondContact N-OD2 3.47Å; N28-D32 VanDerWaalsContact O-CB 3.26Å; N28-D32 WeakPolarHBondContact O-CB 3.41Å; N28-D32 PolarHBondContact O-N 3.12Å; L29-D32 PolarHBondContact O-N 2.97Å; D32-L38 HydrophobicContact CB-CD1 3.59Å; D32-L38 WeakPolarHBondContact O-CD1 3.3Å
33	F	89.3	Confident	80.8	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-3.1	175	-72.3	-101.2	0	0	0	114.2	V17 K26 L29 R31 D35 G36 L38 V39 V42 W69 V100 L104	V17-F33 HydrophobicContact CG1-CE2 4.06Å; V17-F33 HydrophobicContact CG1-CZ 3.73Å; V17-F33 HydrophobicContact CG2-CZ 3.9Å; K26-F33 HydrophobicContact CD-CE2 3.88Å; K26-F33 HydrophobicContact CD-CZ 4.34Å; K26-F33 VanDerWaalsContact NZ-CE2 3.29Å; L29-F33 HydrophobicContact CB-CD2 4.16Å; L29-F33 HydrophobicContact CB-CE2 4.36Å; L29-F33 HydrophobicContact CD2-CD2 4.07Å; L29-F33 HydrophobicContact CD2-CE2 3.59Å; L29-F33 HydrophobicContact CD2-CZ 4.13Å; L29-F33 HydrophobicContact CG-CD2 3.99Å; L29-F33 HydrophobicContact CG-CE2 3.67Å; L29-F33 VanDerWaalsContact O-CB 3.31Å; L29-F33 WeakPolarHBondContact O-CB 3.35Å; L29-F33 VanDerWaalsContact O-CD2 3.3Å; L29-F33 WeakPolarHBondContact O-CD2 3.48Å; L29-F33 PolarHBondContact O-N 2.87Å; R31-F33 VanDerWaalsContact C-N 3.27Å; R31-F33 PolarHBondContact O-N 3.44Å; F33-D35 PolarHBondContact O-N 3.16Å; F33-G36 PolarHBondContact O-N 3.2Å; F33-L38 HydrophobicContact CD1-CB 4.03Å; F33-L38 HydrophobicContact CE1-CB 4.25Å; F33-L38 HydrophobicContact CG-CB 4.33Å; F33-V39 HydrophobicContact CD1-CG2 3.64Å; F33-V39 HydrophobicContact CE1-CG2 4.41Å; F33-V42 HydrophobicContact CE1-CG2 4.31Å; F33-W69 WeakPolarHBondContact O-CZ2 3.37Å; F33-V100 HydrophobicContact CB-CG2 3.71Å; F33-L104 HydrophobicContact CD1-CD1 3.98Å; F33-L104 HydrophobicContact CD1-CD2 3.97Å; F33-L104 HydrophobicContact CD2-CD1 4.39Å; F33-L104 HydrophobicContact CE1-CD1 3.93Å; F33-L104 HydrophobicContact CE1-CD2 3.83Å; F33-L104 HydrophobicContact CE2-CD1 4.34Å; F33-L104 HydrophobicContact CG-CD1 4.16Å; F33-L104 HydrophobicContact CZ-CD1 4.05Å
34	S	91.6	Very high	82.2	Confident	4 Å²	4	47.6 Å²	47.6	3%	0.028	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-28.2	-174.8	65.1	0	0	0	0	114.1	S30 R31 K65 W69 I92 C95	S30-S34 WeakPolarHBondContact O-CB 3.25Å; S30-S34 PolarHBondContact O-N 3.06Å; R31-S34 WeakPolarHBondContact O-CB 3.37Å; R31-S34 PolarHBondContact O-N 2.72Å; R31-S34 VanDerWaalsContact O-N 3.14Å; R31-S34 PolarHBondContact O-OG 3.04Å; S34-K65 PolarHBondContact OG-NZ 3.32Å; S34-W69 PolarHBondContact O-NE1 3.03Å; S34-I92 VanDerWaalsContact CB-O 3.31Å; S34-I92 WeakPolarHBondContact CB-O 3.49Å; S34-C95 WeakPolarHBondContact CB-SG 3.46Å; S34-C95 PolarHBondContact OG-SG 3.35Å
35	D	91.2	Very high	83.7	Confident	23 Å²	23	44.9 Å²	44.9	12%	0.123	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-2.2	-177.6	73	-5.1	0	0	0	114.3	F33 V37 K65 N68	F33-D35 PolarHBondContact O-N 3.16Å; D35-V37 PolarHBondContact O-N 3.29Å; D35-V37 PolarHBondContact OD1-N 3.23Å; D35-K65 HydrophobicContact CB-CD 4.38Å; D35-K65 HydrophobicContact CB-CG 3.89Å; D35-N68 WeakPolarHBondContact O-CB 3.39Å; D35-N68 PolarHBondContact O-ND2 3.17Å
36	G	90.6	Very high	85.4	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	18%	0.175	C	C	.	.	S	Bend	trans	74.9	-8.2	178.3	0	0	0	0	0	115.2	F33 V39 A40	F33-G36 PolarHBondContact O-N 3.2Å; G36-V39 PolarHBondContact O-N 2.93Å; G36-A40 PolarHBondContact O-N 2.97Å
37	V	91.6	Very high	86.8	Confident	9 Å²	9	38.4 Å²	38.4	6%	0.055	17%	0.166	C	C	.	.	H	α-helix	trans	-68.7	-43.3	-177.3	-176.2	0	0	0	0	110.5	D35 V39 A40 E41 M53 P58	D35-V37 PolarHBondContact O-N 3.29Å; D35-V37 PolarHBondContact OD1-N 3.23Å; V37-V39 VanDerWaalsContact C-N 3.29Å; V37-V39 PolarHBondContact O-N 2.8Å; V37-A40 WeakPolarHBondContact O-CA 3.4Å; V37-A40 VanDerWaalsContact O-CB 3.31Å; V37-A40 WeakPolarHBondContact O-CB 3.19Å; V37-A40 PolarHBondContact O-N 3.46Å; V37-A40 VanDerWaalsContact O-N 3.09Å; V37-E41 PolarHBondContact O-N 3.4Å; V37-M53 HydrophobicContact CG1-CE 4.12Å; V37-P58 HydrophobicContact CG1-CG 4.41Å; V37-P58 HydrophobicContact CG2-CG 4.35Å
38	L	89.3	Confident	87.9	Confident	13 Å²	13	30.6 Å²	30.6	7%	0.068	15%	0.146	C	C	.	.	H	α-helix	trans	-66.4	-30.6	176.2	-78.8	176	0	0	0	113	L22 K26 D32 F33 A40 E41 V42	L22-L38 HydrophobicContact CD2-CD2 4.29Å; K26-L38 HydrophobicContact CD-CD1 4.46Å; K26-L38 HydrophobicContact CG-CD1 4.4Å; D32-L38 HydrophobicContact CB-CD1 3.59Å; D32-L38 WeakPolarHBondContact O-CD1 3.3Å; F33-L38 HydrophobicContact CD1-CB 4.03Å; F33-L38 HydrophobicContact CE1-CB 4.25Å; F33-L38 HydrophobicContact CG-CB 4.33Å; L38-A40 VanDerWaalsContact C-N 3.33Å; L38-E41 PolarHBondContact O-N 3.26Å; L38-V42 VanDerWaalsContact O-CG2 3.31Å; L38-V42 WeakPolarHBondContact O-CG2 3.23Å; L38-V42 PolarHBondContact O-N 3.4Å
39	V	91	Very high	88.4	Confident	1 Å²	1	37.2 Å²	37.2	1%	0.006	17%	0.172	C	C	.	.	H	α-helix	trans	-65.7	-41.8	171.8	-172.6	0	0	0	0	109.9	F33 G36 V37 V42 I43 W69 L72 L104 L107	F33-V39 HydrophobicContact CD1-CG2 3.64Å; F33-V39 HydrophobicContact CE1-CG2 4.41Å; G36-V39 PolarHBondContact O-N 2.93Å; V37-V39 VanDerWaalsContact C-N 3.29Å; V37-V39 PolarHBondContact O-N 2.8Å; V39-V42 PolarHBondContact O-N 3.01Å; V39-I43 HydrophobicContact CG1-CD1 4Å; V39-I43 WeakPolarHBondContact O-CG1 3.07Å; V39-I43 PolarHBondContact O-N 3.29Å; V39-W69 HydrophobicContact CG2-CH2 3.66Å; V39-W69 HydrophobicContact CG2-CZ2 3.87Å; V39-L72 HydrophobicContact CB-CD2 3.8Å; V39-L72 HydrophobicContact CG1-CD2 3.68Å; V39-L104 HydrophobicContact CG2-CD2 4.4Å; V39-L107 HydrophobicContact CG1-CD2 3.63Å
40	A	91.6	Very high	88.6	Confident	0 Å²	0	39 Å²	39	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-61.7	-43.5	176.3	0	0	0	0	0	111.6	G36 V37 L38 I43 K44 V51 M53 Y56 L72	G36-A40 PolarHBondContact O-N 2.97Å; V37-A40 WeakPolarHBondContact O-CA 3.4Å; V37-A40 VanDerWaalsContact O-CB 3.31Å; V37-A40 WeakPolarHBondContact O-CB 3.19Å; V37-A40 PolarHBondContact O-N 3.46Å; V37-A40 VanDerWaalsContact O-N 3.09Å; L38-A40 VanDerWaalsContact C-N 3.33Å; A40-I43 PolarHBondContact O-N 3.47Å; A40-K44 VanDerWaalsContact O-CB 3.31Å; A40-K44 WeakPolarHBondContact O-CB 3.31Å; A40-K44 PolarHBondContact O-N 3.4Å; A40-V51 HydrophobicContact CB-CG1 3.82Å; A40-M53 HydrophobicContact CB-SD 4.23Å; A40-Y56 HydrophobicContact CB-CD1 4.3Å; A40-Y56 HydrophobicContact CB-CD2 3.97Å; A40-Y56 HydrophobicContact CB-CE1 4.41Å; A40-Y56 HydrophobicContact CB-CE2 4.09Å; A40-Y56 HydrophobicContact CB-CG 4.07Å; A40-L72 HydrophobicContact CB-CD1 4.02Å
41	E	90.3	Very high	88.9	Confident	33 Å²	33	38.5 Å²	38.5	15%	0.154	18%	0.177	C	C	.	.	H	α-helix	trans	-59.6	-46.2	174.3	-71.7	-174.6	-148.9	0	0	112.1	L22 S23 V37 L38 I43 K44 F45 M53	L22-E41 HydrophobicContact CD2-CB 3.79Å; S23-E41 WeakPolarHBondContact CB-OE2 3.45Å; S23-E41 PolarHBondContact N-OE2 3.28Å; S23-E41 PolarHBondContact OG-OE2 3.46Å; V37-E41 PolarHBondContact O-N 3.4Å; L38-E41 PolarHBondContact O-N 3.26Å; E41-I43 VanDerWaalsContact C-N 3.33Å; E41-I43 PolarHBondContact O-N 3.37Å; E41-K44 WeakPolarHBondContact O-CB 3.3Å; E41-K44 PolarHBondContact O-N 3.2Å; E41-F45 PolarHBondContact O-N 2.89Å; E41-M53 HydrophobicContact CG-CE 3.39Å; E41-M53 HydrophobicContact CG-SD 4.24Å
42	V	89.3	Confident	89.1	Confident	0 Å²	0	37 Å²	37	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-56.7	-47.7	176.2	165.3	0	0	0	0	110.6	W16 I20 L22 F33 L38 V39 F45 Y46 L111	W16-V42 HydrophobicContact CH2-CG1 3.56Å; W16-V42 HydrophobicContact CZ2-CG1 4.07Å; W16-V42 HydrophobicContact CZ3-CG1 4.37Å; I20-V42 HydrophobicContact CD1-CB 4.44Å; I20-V42 HydrophobicContact CD1-CG1 3.88Å; I20-V42 HydrophobicContact CD1-CG2 4.02Å; L22-V42 HydrophobicContact CD2-CG2 3.85Å; F33-V42 HydrophobicContact CE1-CG2 4.31Å; L38-V42 VanDerWaalsContact O-CG2 3.31Å; L38-V42 WeakPolarHBondContact O-CG2 3.23Å; L38-V42 PolarHBondContact O-N 3.4Å; V39-V42 PolarHBondContact O-N 3.01Å; V42-F45 WeakPolarHBondContact O-CB 3.27Å; V42-F45 PolarHBondContact O-N 3.42Å; V42-Y46 HydrophobicContact CG1-CE2 4.41Å; V42-Y46 VanDerWaalsContact O-CD2 3.25Å; V42-Y46 WeakPolarHBondContact O-CD2 3.32Å; V42-L111 HydrophobicContact CG1-CD1 4.11Å
43	I	89.3	Confident	89.3	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-69.5	-36.4	-179.8	-59.9	167.2	0	0	0	111.1	V39 A40 E41 F45 Y46 F47 M50 V51 L72 V76 L77 L80 L107 L111	V39-I43 HydrophobicContact CG1-CD1 4Å; V39-I43 WeakPolarHBondContact O-CG1 3.07Å; V39-I43 PolarHBondContact O-N 3.29Å; A40-I43 PolarHBondContact O-N 3.47Å; E41-I43 VanDerWaalsContact C-N 3.33Å; E41-I43 PolarHBondContact O-N 3.37Å; I43-F45 VanDerWaalsContact C-N 3.29Å; I43-F45 PolarHBondContact O-N 3.33Å; I43-Y46 PolarHBondContact O-N 3.1Å; I43-F47 PolarHBondContact O-N 3.18Å; I43-M50 HydrophobicContact CG2-SD 4.29Å; I43-V51 HydrophobicContact CB-CG2 3.91Å; I43-V51 HydrophobicContact CG2-CG2 3.71Å; I43-L72 HydrophobicContact CD1-CD1 4.37Å; I43-V76 HydrophobicContact CB-CG1 4.3Å; I43-V76 HydrophobicContact CD1-CG1 3.69Å; I43-V76 HydrophobicContact CG2-CG1 3.63Å; I43-L77 HydrophobicContact CD1-CD2 3.83Å; I43-L80 HydrophobicContact CD1-CD1 4.36Å; I43-L80 HydrophobicContact CG2-CD1 4.29Å; I43-L107 HydrophobicContact CD1-CD1 4.32Å; I43-L107 HydrophobicContact CD1-CD2 4.34Å; I43-L107 HydrophobicContact CG1-CD2 4.47Å; I43-L111 HydrophobicContact CG1-CD1 4.39Å; I43-L111 HydrophobicContact CG1-CD2 4.28Å; I43-L111 HydrophobicContact CG2-CD2 4.26Å
44	K	89.7	Confident	89.2	Confident	71 Å²	71	44.9 Å²	44.9	31%	0.309	21%	0.212	S	C	.	.	H	α-helix	trans	-59.4	-39.7	175.9	-174.6	82.5	168.3	91.5	0	111.4	A40 E41 Y46 F47 P48 V51 M53	A40-K44 VanDerWaalsContact O-CB 3.31Å; A40-K44 WeakPolarHBondContact O-CB 3.31Å; A40-K44 PolarHBondContact O-N 3.4Å; E41-K44 WeakPolarHBondContact O-CB 3.3Å; E41-K44 PolarHBondContact O-N 3.2Å; K44-Y46 PolarHBondContact O-N 2.83Å; K44-F47 CarbonylContact O-C 3.36Å; K44-F47 PolarHBondContact O-N 3.33Å; K44-P48 WeakPolarHBondContact CE-O 3.39Å; K44-P48 PolarHBondContact NZ-O 3.32Å; K44-P48 VanDerWaalsContact O-CA 3.24Å; K44-P48 WeakPolarHBondContact O-CA 3.34Å; K44-P48 WeakPolarHBondContact O-CD 3.48Å; K44-P48 WeakPolarHBondContact O-CG 3.38Å; K44-P48 VanDerWaalsContact O-N 3.08Å; K44-V51 HydrophobicContact CB-CB 4.11Å; K44-V51 HydrophobicContact CB-CG1 4.41Å; K44-V51 HydrophobicContact CD-CB 3.83Å; K44-V51 HydrophobicContact CD-CG1 4.35Å; K44-V51 WeakPolarHBondContact CD-O 3.34Å; K44-V51 VanDerWaalsContact CE-O 3.23Å; K44-V51 WeakPolarHBondContact CE-O 3.36Å; K44-M53 HydrophobicContact CB-SD 4.42Å; K44-M53 HydrophobicContact CD-CG 4.33Å
45	F	87.5	Confident	89.1	Confident	105 Å²	105	47.6 Å²	47.6	46%	0.461	23%	0.226	S	C	.	.	H	α-helix	trans	-57.9	-46.3	177.7	177.9	-103.6	0	0	0	111.7	I20 P21 E41 V42 I43	I20-F45 HydrophobicContact CG1-CD1 4.47Å; I20-F45 HydrophobicContact CG2-CB 3.98Å; I20-F45 HydrophobicContact CG2-CD1 3.9Å; I20-F45 HydrophobicContact CG2-CD2 4.32Å; I20-F45 HydrophobicContact CG2-CE1 4.48Å; I20-F45 HydrophobicContact CG2-CG 3.81Å; P21-F45 HydrophobicContact CG-CD2 3.75Å; P21-F45 HydrophobicContact CG-CE2 3.4Å; P21-F45 HydrophobicContact CG-CZ 4.22Å; E41-F45 PolarHBondContact O-N 2.89Å; V42-F45 WeakPolarHBondContact O-CB 3.27Å; V42-F45 PolarHBondContact O-N 3.42Å; I43-F45 VanDerWaalsContact C-N 3.29Å; I43-F45 PolarHBondContact O-N 3.33Å
46	Y	86.3	Confident	89.2	Confident	40 Å²	40	47 Å²	47	16%	0.157	22%	0.223	C	C	.	.	H	α-helix	trans	-80	-34.3	178.5	-66.3	-79.4	0	0	0	113.8	W16 I20 V42 I43 K44 L111 Q115	W16-Y46 AromaticContact CZ2-CE2 3.84Å; W16-Y46 HydrophobicContact CZ2-CE2 3.84Å; W16-Y46 AromaticContact NE1-CZ 3.95Å; W16-Y46 PolarHBondContact NE1-OH 3.16Å; I20-Y46 HydrophobicContact CD1-CE2 3.88Å; I20-Y46 HydrophobicContact CG1-CE2 4.45Å; V42-Y46 HydrophobicContact CG1-CE2 4.41Å; V42-Y46 VanDerWaalsContact O-CD2 3.25Å; V42-Y46 WeakPolarHBondContact O-CD2 3.32Å; I43-Y46 PolarHBondContact O-N 3.1Å; K44-Y46 PolarHBondContact O-N 2.83Å; Y46-L111 HydrophobicContact CD2-CD1 4.05Å; Y46-L111 HydrophobicContact CE2-CD1 4.39Å; Y46-Q115 HydrophobicContact CD1-CG 3.8Å; Y46-Q115 PolarHBondContact O-NE2 3.41Å
47	F	87.6	Confident	89.2	Confident	4 Å²	4	51 Å²	51	2%	0.018	25%	0.247	C	C	.	.			trans	-136.5	78.9	-175.8	-56.4	-71.4	0	0	0	111.6	I43 K44 K49 M50 L80 L111 R114 Q115	I43-F47 PolarHBondContact O-N 3.18Å; K44-F47 CarbonylContact O-C 3.36Å; K44-F47 PolarHBondContact O-N 3.33Å; F47-K49 PolarHBondContact O-N 2.95Å; F47-M50 HydrophobicContact CB-CB 3.91Å; F47-M50 HydrophobicContact CB-CE 4.11Å; F47-M50 HydrophobicContact CD2-CE 4.4Å; F47-M50 HydrophobicContact CG-CE 4.12Å; F47-M50 WeakPolarHBondContact O-CB 3.31Å; F47-M50 PolarHBondContact O-N 2.89Å; F47-L80 HydrophobicContact CD2-CD2 4.41Å; F47-L80 HydrophobicContact CE2-CD2 4.29Å; F47-L111 HydrophobicContact CD2-CD2 3.82Å; F47-L111 HydrophobicContact CE2-CD2 3.57Å; F47-R114 HydrophobicContact CE1-CB 4.33Å; F47-R114 HydrophobicContact CE2-CB 4.21Å; F47-R114 HydrophobicContact CZ-CB 3.56Å; F47-Q115 HydrophobicContact CZ-CG 4Å
48	P	86.8	Confident	89.1	Confident	72 Å²	72	54.1 Å²	54.1	47%	0.468	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-28.9	-174.3	-28	34.2	0	0	0	114.8	K44 M50	K44-P48 WeakPolarHBondContact CE-O 3.39Å; K44-P48 PolarHBondContact NZ-O 3.32Å; K44-P48 VanDerWaalsContact O-CA 3.24Å; K44-P48 WeakPolarHBondContact O-CA 3.34Å; K44-P48 WeakPolarHBondContact O-CD 3.48Å; K44-P48 WeakPolarHBondContact O-CG 3.38Å; K44-P48 VanDerWaalsContact O-N 3.08Å; P48-M50 VanDerWaalsContact C-N 3.33Å
49	K	86.8	Confident	89	Confident	207 Å²	207	54.1 Å²	54.1	90%	0.9	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-7.5	-179.1	-59.2	-173	-179.1	-175	0	113.9	F47	F47-K49 PolarHBondContact O-N 2.95Å
50	M	84.8	Confident	88.9	Confident	43 Å²	43	61.8 Å²	61.8	21%	0.212	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92	-22.2	-175.2	-164.4	178.5	-65.1	0	0	112.9	I43 F47 P48 V76 R79 L80	I43-M50 HydrophobicContact CG2-SD 4.29Å; F47-M50 HydrophobicContact CB-CB 3.91Å; F47-M50 HydrophobicContact CB-CE 4.11Å; F47-M50 HydrophobicContact CD2-CE 4.4Å; F47-M50 HydrophobicContact CG-CE 4.12Å; F47-M50 WeakPolarHBondContact O-CB 3.31Å; F47-M50 PolarHBondContact O-N 2.89Å; P48-M50 VanDerWaalsContact C-N 3.33Å; M50-V76 HydrophobicContact CG-CG1 4.01Å; M50-V76 HydrophobicContact SD-CG1 3.92Å; M50-R79 HydrophobicContact CE-CB 4.32Å; M50-R79 HydrophobicContact SD-CB 4.05Å; M50-L80 HydrophobicContact CE-CD2 3.83Å; M50-L80 HydrophobicContact CE-CG 4.43Å; M50-L80 HydrophobicContact SD-CD1 4.34Å; M50-L80 HydrophobicContact SD-CD2 3.86Å; M50-L80 HydrophobicContact SD-CG 3.86Å
51	V	90.3	Very high	89.1	Confident	3 Å²	3	65 Å²	65	2%	0.018	33%	0.332	C	S	.	.			trans	-124.8	127.4	-172.6	-177.2	0	0	0	0	109.6	A40 I43 K44 M53 Y56 V76	A40-V51 HydrophobicContact CB-CG1 3.82Å; I43-V51 HydrophobicContact CB-CG2 3.91Å; I43-V51 HydrophobicContact CG2-CG2 3.71Å; K44-V51 HydrophobicContact CB-CB 4.11Å; K44-V51 HydrophobicContact CB-CG1 4.41Å; K44-V51 HydrophobicContact CD-CB 3.83Å; K44-V51 HydrophobicContact CD-CG1 4.35Å; K44-V51 WeakPolarHBondContact CD-O 3.34Å; K44-V51 VanDerWaalsContact CE-O 3.23Å; K44-V51 WeakPolarHBondContact CE-O 3.36Å; V51-M53 HydrophobicContact CG1-SD 3.84Å; V51-Y56 HydrophobicContact CG1-CD2 4.31Å; V51-Y56 HydrophobicContact CG1-CE2 3.76Å; V51-V76 HydrophobicContact CG2-CG1 3.79Å; V51-V76 HydrophobicContact CG2-CG2 4.04Å
52	E	89.8	Confident	89.2	Confident	114 Å²	114	66.6 Å²	66.6	53%	0.533	34%	0.341	S	S	.	.			trans	-106.1	104.2	172.8	-75.4	175.6	-166.5	0	0	108.8	H54 N55 Y56	E52-H54 PolarHBondContact O-N 3.36Å; E52-H54 IonicContact OE2-CE1 2.81Å; E52-H54 PolarHBondContact OE2-CE1 3.43Å; E52-H54 IonicContact OE2-NE2 2.96Å; E52-H54 PolarHBondContact OE2-NE2 3.13Å; E52-N55 VanDerWaalsContact CB-ND2 3.34Å; E52-N55 WeakPolarHBondContact CB-ND2 3.38Å; E52-N55 PolarHBondContact O-N 3.08Å; E52-N55 VanDerWaalsContact O-N 3.16Å; E52-N55 PolarHBondContact OE2-ND2 3.31Å; E52-Y56 VanDerWaalsContact O-CD2 3.27Å; E52-Y56 WeakPolarHBondContact O-CD2 3.5Å; E52-Y56 WeakPolarHBondContact O-CE2 3.17Å
53	M	90.1	Very high	89.4	Confident	61 Å²	61	74.1 Å²	74.1	30%	0.3	38%	0.377	S	S	.	.	G	3₁₀ helix	trans	-62.8	-24.8	-172.1	-67.4	-56	-61.2	0	0	113.7	V37 A40 E41 K44 V51 N55 Y56	V37-M53 HydrophobicContact CG1-CE 4.12Å; A40-M53 HydrophobicContact CB-SD 4.23Å; E41-M53 HydrophobicContact CG-CE 3.39Å; E41-M53 HydrophobicContact CG-SD 4.24Å; K44-M53 HydrophobicContact CB-SD 4.42Å; K44-M53 HydrophobicContact CD-CG 4.33Å; V51-M53 HydrophobicContact CG1-SD 3.84Å; M53-N55 PolarHBondContact O-N 3.06Å; M53-Y56 PolarHBondContact O-N 3.08Å; M53-Y56 VanDerWaalsContact O-N 3.11Å
54	H	88.1	Confident	89.7	Confident	139 Å²	139	77.6 Å²	77.6	64%	0.644	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	-65.3	-19	178.5	67.7	-101.6	0	0	0	113.5	E52 Y56	E52-H54 PolarHBondContact O-N 3.36Å; E52-H54 IonicContact OE2-CE1 2.81Å; E52-H54 PolarHBondContact OE2-CE1 3.43Å; E52-H54 IonicContact OE2-NE2 2.96Å; E52-H54 PolarHBondContact OE2-NE2 3.13Å; H54-Y56 VanDerWaalsContact C-N 3.29Å
55	N	89.5	Confident	90	Very high	61 Å²	61	75.1 Å²	75.1	33%	0.326	38%	0.382	S	S	.	.	G	3₁₀ helix	trans	-82.7	-5.7	177.2	-67.3	-50	0	0	0	113.2	E52 M53	E52-N55 VanDerWaalsContact CB-ND2 3.34Å; E52-N55 WeakPolarHBondContact CB-ND2 3.38Å; E52-N55 PolarHBondContact O-N 3.08Å; E52-N55 VanDerWaalsContact O-N 3.16Å; E52-N55 PolarHBondContact OE2-ND2 3.31Å; M53-N55 PolarHBondContact O-N 3.06Å
56	Y	92.4	Very high	90.3	Very high	12 Å²	12	72.2 Å²	72.2	5%	0.047	37%	0.371	C	S	.	.			trans	-120.4	109.1	-175.6	-56.7	-82	0	0	0	109.8	A40 V51 E52 M53 H54 N68 H71 L72 V76	A40-Y56 HydrophobicContact CB-CD1 4.3Å; A40-Y56 HydrophobicContact CB-CD2 3.97Å; A40-Y56 HydrophobicContact CB-CE1 4.41Å; A40-Y56 HydrophobicContact CB-CE2 4.09Å; A40-Y56 HydrophobicContact CB-CG 4.07Å; V51-Y56 HydrophobicContact CG1-CD2 4.31Å; V51-Y56 HydrophobicContact CG1-CE2 3.76Å; E52-Y56 VanDerWaalsContact O-CD2 3.27Å; E52-Y56 WeakPolarHBondContact O-CD2 3.5Å; E52-Y56 WeakPolarHBondContact O-CE2 3.17Å; M53-Y56 PolarHBondContact O-N 3.08Å; M53-Y56 VanDerWaalsContact O-N 3.11Å; H54-Y56 VanDerWaalsContact C-N 3.29Å; Y56-N68 HydrophobicContact CD1-CB 4.4Å; Y56-H71 AromaticContact CE1-CD2 3.97Å; Y56-H71 AromaticContact CZ-CD2 3.74Å; Y56-H71 PolarHBondContact OH-CD2 2.93Å; Y56-L72 HydrophobicContact CE1-CB 3.88Å; Y56-L72 HydrophobicContact CE1-CD1 3.9Å; Y56-L72 HydrophobicContact CE1-CG 4.49Å; Y56-V76 VanDerWaalsContact OH-CG2 3.32Å; Y56-V76 WeakPolarHBondContact OH-CG2 3.31Å
57	V	90.4	Very high	90.8	Very high	84 Å²	84	73.5 Å²	73.5	51%	0.509	39%	0.386	S	S	.	.			trans	-102.6	124.6	179.4	-177.6	0	0	0	0	108.8	A59 N68	V57-A59 PolarHBondContact O-N 3.32Å; V57-N68 PolarHBondContact O-ND2 3.34Å
58	P	90.5	Very high	91.1	Very high	73 Å²	73	73.4 Å²	73.4	47%	0.474	39%	0.385	S	S	.	.			trans	-56.3	129	173.6	-23.3	32.7	0	0	0	110.6	V37	V37-P58 HydrophobicContact CG1-CG 4.41Å; V37-P58 HydrophobicContact CG2-CG 4.35Å
59	A	87.8	Confident	91.5	Very high	14 Å²	14	70 Å²	70	12%	0.116	36%	0.363	C	S	.	.			trans	-149.6	142.5	-171.7	0	0	0	0	0	113.6	V57 Q64 K65	V57-A59 PolarHBondContact O-N 3.32Å; A59-Q64 HydrophobicContact CB-CB 3.57Å; A59-Q64 HydrophobicContact CB-CG 3.28Å; A59-K65 WeakPolarHBondContact O-CE 3.47Å; A59-K65 WeakPolarHBondContact O-CG 3.49Å
60	N	88.8	Confident	91.9	Very high	162 Å²	162	60.7 Å²	60.7	87%	0.866	33%	0.327	S	S	*	.			trans	-93.7	-19.7	172.8	-65.1	-29.1	0	0	0	112.5
61	S	94.1	Very high	92.4	Very high	66 Å²	66	61 Å²	61	46%	0.462	33%	0.328	S	S	.	.	S	Bend	trans	-71.1	127.2	178.3	172.9	0	0	0	0	111.4	Q63 Q64 K65	S61-Q63 PolarHBondContact O-N 3.34Å; S61-Q63 PolarHBondContact OG-N 3.09Å; S61-Q64 PolarHBondContact O-N 3.41Å; S61-Q64 VanDerWaalsContact O-N 3.08Å; S61-K65 WeakPolarHBondContact O-CG 3.43Å; S61-K65 PolarHBondContact O-N 3.3Å
62	L	93.1	Very high	92.5	Very high	67 Å²	67	60.9 Å²	60.9	35%	0.351	33%	0.327	S	S	.	.	H	α-helix	trans	-53.2	-41.4	177.9	-179.6	62.4	0	0	0	112.1	Q64 K65 L66 A93 E94	L62-Q64 PolarHBondContact O-N 3.47Å; L62-K65 PolarHBondContact O-N 3.03Å; L62-L66 HydrophobicContact CD1-CD1 4.48Å; L62-L66 HydrophobicContact CD1-CG 4.43Å; L62-L66 HydrophobicContact CG-CD1 4.24Å; L62-L66 WeakPolarHBondContact O-CB 3.47Å; L62-L66 WeakPolarHBondContact O-CG 3.34Å; L62-L66 PolarHBondContact O-N 3.31Å; L62-A93 HydrophobicContact CD1-CB 3.49Å; L62-A93 VanDerWaalsContact CD1-CB 3.49Å; L62-E94 HydrophobicContact CD1-CG 4.07Å
63	Q	94.7	Very high	92.8	Very high	159 Å²	159	56.3 Å²	56.3	74%	0.743	31%	0.306	S	S	*	.	H	α-helix	trans	-63.5	-42.1	179.8	-172.1	180	17.2	0	0	111.9	S61 L66 S67	S61-Q63 PolarHBondContact O-N 3.34Å; S61-Q63 PolarHBondContact OG-N 3.09Å; Q63-L66 PolarHBondContact O-N 3.06Å; Q63-S67 PolarHBondContact O-N 3Å
64	Q	94.9	Very high	92.9	Very high	73 Å²	73	61.9 Å²	61.9	34%	0.341	32%	0.324	S	S	.	.	H	α-helix	trans	-71.3	-38.5	178.3	-173.3	60.4	51.7	0	0	111.4	A59 S61 L62 L66 S67 N68	A59-Q64 HydrophobicContact CB-CB 3.57Å; A59-Q64 HydrophobicContact CB-CG 3.28Å; S61-Q64 PolarHBondContact O-N 3.41Å; S61-Q64 VanDerWaalsContact O-N 3.08Å; L62-Q64 PolarHBondContact O-N 3.47Å; Q64-L66 VanDerWaalsContact C-N 3.35Å; Q64-L66 PolarHBondContact O-N 3.3Å; Q64-S67 WeakPolarHBondContact O-CB 3.34Å; Q64-S67 PolarHBondContact O-N 3.37Å; Q64-N68 PolarHBondContact NE2-OD1 3.18Å; Q64-N68 VanDerWaalsContact O-CG 3.29Å; Q64-N68 PolarHBondContact O-N 2.98Å; Q64-N68 PolarHBondContact O-OD1 2.89Å
65	K	94.8	Very high	93.1	Very high	18 Å²	18	61.6 Å²	61.6	8%	0.078	32%	0.32	C	S	.	.	H	α-helix	trans	-58.2	-47.3	172.3	-66	-174.6	-178	-169.9	0	111.2	S34 D35 A59 S61 L62 S67 N68 W69 A93	S34-K65 PolarHBondContact OG-NZ 3.32Å; D35-K65 HydrophobicContact CB-CD 4.38Å; D35-K65 HydrophobicContact CB-CG 3.89Å; A59-K65 WeakPolarHBondContact O-CE 3.47Å; A59-K65 WeakPolarHBondContact O-CG 3.49Å; S61-K65 WeakPolarHBondContact O-CG 3.43Å; S61-K65 PolarHBondContact O-N 3.3Å; L62-K65 PolarHBondContact O-N 3.03Å; K65-S67 VanDerWaalsContact C-N 3.31Å; K65-S67 PolarHBondContact O-N 3.46Å; K65-N68 WeakPolarHBondContact O-CB 3.35Å; K65-N68 PolarHBondContact O-N 3.46Å; K65-W69 VanDerWaalsContact O-CD1 3.27Å; K65-W69 PolarHBondContact O-N 3.01Å; K65-A93 HydrophobicContact CB-CB 3.81Å; K65-A93 HydrophobicContact CD-CB 4.25Å; K65-A93 WeakPolarHBondContact CD-O 3.41Å; K65-A93 PolarHBondContact NZ-O 3.01Å
66	L	95.1	Very high	93.1	Very high	45 Å²	45	58.7 Å²	58.7	24%	0.236	31%	0.305	C	S	.	.	H	α-helix	trans	-61.9	-38.4	175.8	-75.8	175	0	0	0	112.3	L62 Q63 Q64 W69 G70 M89 R90 A93	L62-L66 HydrophobicContact CD1-CD1 4.48Å; L62-L66 HydrophobicContact CD1-CG 4.43Å; L62-L66 HydrophobicContact CG-CD1 4.24Å; L62-L66 WeakPolarHBondContact O-CB 3.47Å; L62-L66 WeakPolarHBondContact O-CG 3.34Å; L62-L66 PolarHBondContact O-N 3.31Å; Q63-L66 PolarHBondContact O-N 3.06Å; Q64-L66 VanDerWaalsContact C-N 3.35Å; Q64-L66 PolarHBondContact O-N 3.3Å; L66-W69 PolarHBondContact O-N 2.77Å; L66-G70 PolarHBondContact O-N 3.18Å; L66-M89 HydrophobicContact CD2-CB 4.44Å; L66-R90 HydrophobicContact CD2-CB 4.31Å; L66-A93 HydrophobicContact CD2-CB 4.22Å; L66-A93 HydrophobicContact CG-CB 4.33Å
67	S	95.4	Very high	93	Very high	66 Å²	66	58.2 Å²	58.2	46%	0.462	30%	0.303	S	S	.	.	H	α-helix	trans	-61.7	-48.3	174.4	-170.7	0	0	0	0	111.6	Q63 Q64 K65 W69 G70 H71	Q63-S67 PolarHBondContact O-N 3Å; Q64-S67 WeakPolarHBondContact O-CB 3.34Å; Q64-S67 PolarHBondContact O-N 3.37Å; K65-S67 VanDerWaalsContact C-N 3.31Å; K65-S67 PolarHBondContact O-N 3.46Å; S67-W69 PolarHBondContact O-N 2.98Å; S67-G70 PolarHBondContact O-N 3.02Å; S67-H71 WeakPolarHBondContact O-CB 3.46Å; S67-H71 PolarHBondContact O-N 3.46Å
68	N	95.6	Very high	93	Very high	2 Å²	2	61.8 Å²	61.8	1%	0.011	31%	0.312	C	S	.	.	H	α-helix	trans	-58	-49.8	176.2	-68.2	-6.2	0	0	0	111.1	D35 Y56 V57 Q64 K65 H71 L72	D35-N68 WeakPolarHBondContact O-CB 3.39Å; D35-N68 PolarHBondContact O-ND2 3.17Å; Y56-N68 HydrophobicContact CD1-CB 4.4Å; V57-N68 PolarHBondContact O-ND2 3.34Å; Q64-N68 PolarHBondContact NE2-OD1 3.18Å; Q64-N68 VanDerWaalsContact O-CG 3.29Å; Q64-N68 PolarHBondContact O-N 2.98Å; Q64-N68 PolarHBondContact O-OD1 2.89Å; K65-N68 WeakPolarHBondContact O-CB 3.35Å; K65-N68 PolarHBondContact O-N 3.46Å; N68-H71 PolarHBondContact O-N 2.87Å; N68-L72 WeakPolarHBondContact O-CB 3.31Å; N68-L72 PolarHBondContact O-N 3.31Å
69	W	95.3	Very high	92.8	Very high	0 Å²	0	66.6 Å²	66.6	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-61.8	-44.4	177.7	-87.5	105.5	0	0	0	112.6	F33 S34 V39 K65 L66 S67 H71 L72 N73 M89 I92	F33-W69 WeakPolarHBondContact O-CZ2 3.37Å; S34-W69 PolarHBondContact O-NE1 3.03Å; V39-W69 HydrophobicContact CG2-CH2 3.66Å; V39-W69 HydrophobicContact CG2-CZ2 3.87Å; K65-W69 VanDerWaalsContact O-CD1 3.27Å; K65-W69 PolarHBondContact O-N 3.01Å; L66-W69 PolarHBondContact O-N 2.77Å; S67-W69 PolarHBondContact O-N 2.98Å; W69-H71 VanDerWaalsContact C-N 3.31Å; W69-H71 PolarHBondContact O-N 2.84Å; W69-L72 HydrophobicContact CE3-CD2 4.2Å; W69-L72 HydrophobicContact CZ3-CD2 4.17Å; W69-L72 PolarHBondContact O-N 3.03Å; W69-N73 VanDerWaalsContact O-CB 3.27Å; W69-N73 WeakPolarHBondContact O-CB 3.34Å; W69-N73 PolarHBondContact O-N 3.22Å; W69-M89 HydrophobicContact CB-CB 4.27Å; W69-M89 HydrophobicContact CB-CG 4.24Å; W69-M89 HydrophobicContact CB-SD 3.87Å; W69-M89 HydrophobicContact CE3-CG 4.38Å; W69-I92 HydrophobicContact CH2-CD1 4.13Å; W69-I92 HydrophobicContact CH2-CG2 4.26Å; W69-I92 HydrophobicContact CZ2-CB 4.42Å; W69-I92 HydrophobicContact CZ2-CD1 4.32Å; W69-I92 HydrophobicContact CZ2-CG2 3.42Å; W69-I92 VanDerWaalsContact CZ2-CG2 3.42Å
70	G	94.6	Very high	92.7	Very high	13 Å²	13	66.1 Å²	66.1	13%	0.134	32%	0.316	C	S	.	.	H	α-helix	trans	-64.7	-34.1	177.4	0	0	0	0	0	112.8	L66 S67 R74	L66-G70 PolarHBondContact O-N 3.18Å; S67-G70 PolarHBondContact O-N 3.02Å; G70-R74 WeakPolarHBondContact O-CB 3.33Å; G70-R74 WeakPolarHBondContact O-CG 3.39Å; G70-R74 PolarHBondContact O-N 3.06Å; G70-R74 PolarHBondContact O-NE 3.33Å
71	H	94.2	Very high	92.6	Very high	50 Å²	50	64.4 Å²	64.4	23%	0.231	31%	0.307	C	S	.	.	H	α-helix	trans	-69.9	-47.6	172.8	-168.3	84.1	0	0	0	111.2	Y56 S67 N68 W69 N73 R74 K75	Y56-H71 AromaticContact CE1-CD2 3.97Å; Y56-H71 AromaticContact CZ-CD2 3.74Å; Y56-H71 PolarHBondContact OH-CD2 2.93Å; S67-H71 WeakPolarHBondContact O-CB 3.46Å; S67-H71 PolarHBondContact O-N 3.46Å; N68-H71 PolarHBondContact O-N 2.87Å; W69-H71 VanDerWaalsContact C-N 3.31Å; W69-H71 PolarHBondContact O-N 2.84Å; H71-N73 VanDerWaalsContact C-N 3.32Å; H71-N73 PolarHBondContact O-N 2.86Å; H71-R74 PolarHBondContact O-N 2.94Å; H71-K75 WeakPolarHBondContact O-CB 3.06Å; H71-K75 PolarHBondContact O-N 3.09Å
72	L	94.2	Very high	92.4	Very high	0 Å²	0	63 Å²	63	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-56.4	-46.6	177.3	-169.7	70.3	0	0	0	111.3	V39 A40 I43 Y56 N68 W69 V76 L77	V39-L72 HydrophobicContact CB-CD2 3.8Å; V39-L72 HydrophobicContact CG1-CD2 3.68Å; A40-L72 HydrophobicContact CB-CD1 4.02Å; I43-L72 HydrophobicContact CD1-CD1 4.37Å; Y56-L72 HydrophobicContact CE1-CB 3.88Å; Y56-L72 HydrophobicContact CE1-CD1 3.9Å; Y56-L72 HydrophobicContact CE1-CG 4.49Å; N68-L72 WeakPolarHBondContact O-CB 3.31Å; N68-L72 PolarHBondContact O-N 3.31Å; W69-L72 HydrophobicContact CE3-CD2 4.2Å; W69-L72 HydrophobicContact CZ3-CD2 4.17Å; W69-L72 PolarHBondContact O-N 3.03Å; L72-V76 HydrophobicContact CD1-CB 3.9Å; L72-V76 HydrophobicContact CD1-CG1 4.24Å; L72-V76 HydrophobicContact CD1-CG2 3.91Å; L72-V76 HydrophobicContact CG-CB 4.48Å; L72-V76 WeakPolarHBondContact O-CA 3.39Å; L72-V76 VanDerWaalsContact O-CB 3.31Å; L72-V76 WeakPolarHBondContact O-CB 3.11Å; L72-V76 PolarHBondContact O-N 3.38Å; L72-L77 HydrophobicContact CG-CG 4.32Å; L72-L77 PolarHBondContact O-N 3.02Å
73	N	94.3	Very high	92.3	Very high	18 Å²	18	64.1 Å²	64.1	10%	0.096	31%	0.306	C	S	.	.	H	α-helix	trans	-62	-48.3	-178.5	-165.4	24.1	0	0	0	111.8	W69 H71 L77 K78 S83 V84 M89	W69-N73 VanDerWaalsContact O-CB 3.27Å; W69-N73 WeakPolarHBondContact O-CB 3.34Å; W69-N73 PolarHBondContact O-N 3.22Å; H71-N73 VanDerWaalsContact C-N 3.32Å; H71-N73 PolarHBondContact O-N 2.86Å; N73-L77 HydrophobicContact CB-CD1 4.33Å; N73-K78 PolarHBondContact O-N 3.3Å; N73-K78 VanDerWaalsContact O-N 3.08Å; N73-S83 WeakPolarHBondContact OD1-CA 3.5Å; N73-V84 PolarHBondContact ND2-O 2.89Å; N73-V84 PolarHBondContact OD1-N 3.16Å; N73-M89 HydrophobicContact CB-SD 3.93Å
74	R	93.3	Very high	92.2	Very high	178 Å²	178	56.7 Å²	56.7	67%	0.672	27%	0.272	S	S	*	.	H	α-helix	trans	-72	-39.3	-177.6	-73	-179.6	-74.2	167.7	-6.6	113.6	G70 H71	G70-R74 WeakPolarHBondContact O-CB 3.33Å; G70-R74 WeakPolarHBondContact O-CG 3.39Å; G70-R74 PolarHBondContact O-N 3.06Å; G70-R74 PolarHBondContact O-NE 3.33Å; H71-R74 PolarHBondContact O-N 2.94Å
75	K	91.4	Very high	92.1	Very high	132 Å²	132	57 Å²	57	57%	0.574	28%	0.28	S	S	*	.	H	α-helix	trans	-93.9	-38.6	-172.3	-67.3	-68.4	-172.4	170.8	0	113.4	H71 R79	H71-K75 WeakPolarHBondContact O-CB 3.06Å; H71-K75 PolarHBondContact O-N 3.09Å; K75-R79 VanDerWaalsContact O-CG 3.25Å; K75-R79 WeakPolarHBondContact O-CG 3.27Å
76	V	91.3	Very high	92	Very high	1 Å²	1	61.7 Å²	61.7	1%	0.006	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.4	-57.2	-169.3	-175.1	0	0	0	0	110.8	I43 M50 V51 Y56 L72 K78 R79 L80	I43-V76 HydrophobicContact CB-CG1 4.3Å; I43-V76 HydrophobicContact CD1-CG1 3.69Å; I43-V76 HydrophobicContact CG2-CG1 3.63Å; M50-V76 HydrophobicContact CG-CG1 4.01Å; M50-V76 HydrophobicContact SD-CG1 3.92Å; V51-V76 HydrophobicContact CG2-CG1 3.79Å; V51-V76 HydrophobicContact CG2-CG2 4.04Å; Y56-V76 VanDerWaalsContact OH-CG2 3.32Å; Y56-V76 WeakPolarHBondContact OH-CG2 3.31Å; L72-V76 HydrophobicContact CD1-CB 3.9Å; L72-V76 HydrophobicContact CD1-CG1 4.24Å; L72-V76 HydrophobicContact CD1-CG2 3.91Å; L72-V76 HydrophobicContact CG-CB 4.48Å; L72-V76 WeakPolarHBondContact O-CA 3.39Å; L72-V76 VanDerWaalsContact O-CB 3.31Å; L72-V76 WeakPolarHBondContact O-CB 3.11Å; L72-V76 PolarHBondContact O-N 3.38Å; V76-K78 VanDerWaalsContact C-N 3.34Å; V76-K78 PolarHBondContact O-N 3.2Å; V76-R79 WeakPolarHBondContact O-CB 3.37Å; V76-R79 PolarHBondContact O-N 3.29Å; V76-L80 PolarHBondContact O-N 3.04Å
77	L	89.6	Confident	91.9	Very high	1 Å²	1	65.1 Å²	65.1	1%	0.005	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-64	-39.8	-174.8	-56.9	-177.5	0	0	0	111.8	I43 L72 N73 R79 L80 N81 F82 V84 L107	I43-L77 HydrophobicContact CD1-CD2 3.83Å; L72-L77 HydrophobicContact CG-CG 4.32Å; L72-L77 PolarHBondContact O-N 3.02Å; N73-L77 HydrophobicContact CB-CD1 4.33Å; L77-R79 PolarHBondContact O-N 3.48Å; L77-R79 VanDerWaalsContact O-N 3.16Å; L77-L80 CarbonylContact O-C 3.49Å; L77-L80 WeakPolarHBondContact O-CA 3.45Å; L77-L80 WeakPolarHBondContact O-CB 3.4Å; L77-L80 PolarHBondContact O-N 2.84Å; L77-N81 PolarHBondContact O-N 3.41Å; L77-F82 CarbonylContact C-O 2.96Å; L77-F82 HydrophobicContact CB-CD1 4.24Å; L77-F82 WeakPolarHBondContact CB-O 3.48Å; L77-F82 HydrophobicContact CD1-CD1 4.11Å; L77-F82 HydrophobicContact CD1-CE1 4.43Å; L77-F82 HydrophobicContact CD2-CD1 4.2Å; L77-F82 HydrophobicContact CG-CD1 4.41Å; L77-F82 PolarHBondContact O-N 3.04Å; L77-F82 VanDerWaalsContact O-N 3.08Å; L77-V84 HydrophobicContact CD1-CG2 3.68Å; L77-L107 HydrophobicContact CD2-CD1 3.85Å
78	K	89.9	Confident	91.8	Very high	159 Å²	159	64 Å²	64	69%	0.691	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-56.5	-32.7	174.4	-167.5	172.3	-176.7	175.4	0	113	N73 V76 L80 N81 F82	N73-K78 PolarHBondContact O-N 3.3Å; N73-K78 VanDerWaalsContact O-N 3.08Å; V76-K78 VanDerWaalsContact C-N 3.34Å; V76-K78 PolarHBondContact O-N 3.2Å; K78-L80 VanDerWaalsContact C-N 3.28Å; K78-L80 PolarHBondContact O-N 3.38Å; K78-N81 PolarHBondContact O-N 2.88Å; K78-F82 PolarHBondContact N-O 3.11Å
79	R	86.9	Confident	91.7	Very high	174 Å²	174	64.2 Å²	64.2	66%	0.657	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-74.5	-17.8	176.4	-64.2	-72.6	-169.4	173.3	2	113.2	M50 K75 V76 L77 R114	M50-R79 HydrophobicContact CE-CB 4.32Å; M50-R79 HydrophobicContact SD-CB 4.05Å; K75-R79 VanDerWaalsContact O-CG 3.25Å; K75-R79 WeakPolarHBondContact O-CG 3.27Å; V76-R79 WeakPolarHBondContact O-CB 3.37Å; V76-R79 PolarHBondContact O-N 3.29Å; L77-R79 PolarHBondContact O-N 3.48Å; L77-R79 VanDerWaalsContact O-N 3.16Å; R79-R114 PolarHBondContact O-NH2 2.98Å
80	L	85.8	Confident	91.6	Very high	4 Å²	4	70 Å²	70	2%	0.021	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-95.9	9	174.6	-61.6	173.8	0	0	0	112.5	I43 F47 M50 V76 L77 K78 F82 L107 L111 R114	I43-L80 HydrophobicContact CD1-CD1 4.36Å; I43-L80 HydrophobicContact CG2-CD1 4.29Å; F47-L80 HydrophobicContact CD2-CD2 4.41Å; F47-L80 HydrophobicContact CE2-CD2 4.29Å; M50-L80 HydrophobicContact CE-CD2 3.83Å; M50-L80 HydrophobicContact CE-CG 4.43Å; M50-L80 HydrophobicContact SD-CD1 4.34Å; M50-L80 HydrophobicContact SD-CD2 3.86Å; M50-L80 HydrophobicContact SD-CG 3.86Å; V76-L80 PolarHBondContact O-N 3.04Å; L77-L80 CarbonylContact O-C 3.49Å; L77-L80 WeakPolarHBondContact O-CA 3.45Å; L77-L80 WeakPolarHBondContact O-CB 3.4Å; L77-L80 PolarHBondContact O-N 2.84Å; K78-L80 VanDerWaalsContact C-N 3.28Å; K78-L80 PolarHBondContact O-N 3.38Å; L80-F82 PolarHBondContact O-N 3.29Å; L80-L107 HydrophobicContact CD1-CD1 4.06Å; L80-L111 HydrophobicContact CD1-CD2 3.76Å; L80-L111 HydrophobicContact CD2-CD2 4.27Å; L80-R114 HydrophobicContact CD2-CG 4.38Å
81	N	86.9	Confident	91.6	Very high	127 Å²	127	74.6 Å²	74.6	68%	0.679	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.8	35.6	-174.1	-61.6	83.5	0	0	0	112.2	L77 K78	L77-N81 PolarHBondContact O-N 3.41Å; K78-N81 PolarHBondContact O-N 2.88Å
82	F	89.5	Confident	91.5	Very high	36 Å²	36	72.2 Å²	72.2	16%	0.158	34%	0.343	C	S	.	.			trans	-127.8	143.4	-179.7	-171.3	-105.2	0	0	0	109.6	L77 K78 L80 V84 V103 P106	L77-F82 CarbonylContact C-O 2.96Å; L77-F82 HydrophobicContact CB-CD1 4.24Å; L77-F82 WeakPolarHBondContact CB-O 3.48Å; L77-F82 HydrophobicContact CD1-CD1 4.11Å; L77-F82 HydrophobicContact CD1-CE1 4.43Å; L77-F82 HydrophobicContact CD2-CD1 4.2Å; L77-F82 HydrophobicContact CG-CD1 4.41Å; L77-F82 PolarHBondContact O-N 3.04Å; L77-F82 VanDerWaalsContact O-N 3.08Å; K78-F82 PolarHBondContact N-O 3.11Å; L80-F82 PolarHBondContact O-N 3.29Å; F82-V84 HydrophobicContact CD1-CG2 4.17Å; F82-V84 HydrophobicContact CE1-CG2 3.49Å; F82-V84 VanDerWaalsContact CE1-CG2 3.49Å; F82-V84 HydrophobicContact CZ-CG2 4.25Å; F82-V103 HydrophobicContact CE1-CG1 3.89Å; F82-V103 HydrophobicContact CZ-CG1 4.15Å; F82-P106 HydrophobicContact CE2-CB 3.96Å; F82-P106 HydrophobicContact CE2-CG 3.95Å; F82-P106 HydrophobicContact CZ-CB 4.49Å; F82-P106 HydrophobicContact CZ-CG 4.02Å
83	S	90.9	Very high	91.5	Very high	90 Å²	90	72.4 Å²	72.4	63%	0.629	34%	0.344	S	S	*	.			trans	-143.2	132.8	-179.9	-177.4	0	0	0	0	109.3	N73	N73-S83 WeakPolarHBondContact OD1-CA 3.5Å
84	V	91.8	Very high	91.4	Very high	4 Å²	4	76.4 Å²	76.4	2%	0.024	36%	0.362	C	S	.	.			trans	-104.3	124.8	176.1	-174.5	0	0	0	0	108.6	N73 L77 F82 V88 M89 V103	N73-V84 PolarHBondContact ND2-O 2.89Å; N73-V84 PolarHBondContact OD1-N 3.16Å; L77-V84 HydrophobicContact CD1-CG2 3.68Å; F82-V84 HydrophobicContact CD1-CG2 4.17Å; F82-V84 HydrophobicContact CE1-CG2 3.49Å; F82-V84 VanDerWaalsContact CE1-CG2 3.49Å; F82-V84 HydrophobicContact CZ-CG2 4.25Å; V84-V88 HydrophobicContact CG1-CB 3.82Å; V84-V88 HydrophobicContact CG1-CG1 3.71Å; V84-M89 HydrophobicContact CB-CG 4.01Å; V84-M89 HydrophobicContact CB-SD 4.5Å; V84-M89 HydrophobicContact CG1-CG 3.59Å; V84-V103 HydrophobicContact CG1-CG2 4.19Å; V84-V103 HydrophobicContact CG2-CG1 3.8Å; V84-V103 HydrophobicContact CG2-CG2 4.39Å
85	P	93.8	Very high	91.2	Very high	78 Å²	78	70 Å²	70	51%	0.506	34%	0.344	S	S	.	.			trans	-63.1	152.1	176.2	-21.2	32.1	0	0	0	112.6	D87 V88 M89	P85-D87 VanDerWaalsContact C-N 3.27Å; P85-D87 PolarHBondContact O-N 2.93Å; P85-V88 HydrophobicContact CB-CG2 4.25Å; P85-V88 HydrophobicContact CG-CG2 4.18Å; P85-V88 PolarHBondContact O-N 2.77Å; P85-M89 PolarHBondContact O-N 2.93Å
86	D	91.5	Very high	91.1	Very high	118 Å²	118	65.3 Å²	65.3	63%	0.631	33%	0.328	S	S	*	.	H	α-helix	trans	-58.2	-37.5	-179	-67.4	-26.9	0	0	0	112.8	V88 M89 R90	D86-V88 VanDerWaalsContact C-N 3.31Å; D86-V88 PolarHBondContact O-N 3.41Å; D86-M89 HydrophobicContact CB-CE 4.3Å; D86-M89 PolarHBondContact O-N 3.37Å; D86-M89 WeakPolarHBondContact OD1-CE 3.46Å; D86-R90 PolarHBondContact O-N 2.98Å
87	D	93.3	Very high	90.7	Very high	116 Å²	116	70.6 Å²	70.6	62%	0.62	36%	0.362	S	S	*	.	H	α-helix	trans	-63.8	-37.5	177.4	-60.1	-32	0	0	0	112.4	P85 K91	P85-D87 VanDerWaalsContact C-N 3.27Å; P85-D87 PolarHBondContact O-N 2.93Å; D87-K91 WeakPolarHBondContact O-CG 3.16Å; D87-K91 PolarHBondContact O-N 3.07Å; D87-K91 VanDerWaalsContact O-N 3.15Å
88	V	93.1	Very high	90.4	Very high	42 Å²	42	72.2 Å²	72.2	26%	0.255	38%	0.379	S	S	.	.	H	α-helix	trans	-72.3	-42.5	177.2	179.4	0	0	0	0	109.6	V84 P85 D86 R90 K91 I92 V99 V103	V84-V88 HydrophobicContact CG1-CB 3.82Å; V84-V88 HydrophobicContact CG1-CG1 3.71Å; P85-V88 HydrophobicContact CB-CG2 4.25Å; P85-V88 HydrophobicContact CG-CG2 4.18Å; P85-V88 PolarHBondContact O-N 2.77Å; D86-V88 VanDerWaalsContact C-N 3.31Å; D86-V88 PolarHBondContact O-N 3.41Å; V88-R90 VanDerWaalsContact C-N 3.28Å; V88-R90 PolarHBondContact O-N 3.43Å; V88-K91 PolarHBondContact O-N 3.41Å; V88-I92 HydrophobicContact CG1-CD1 3.86Å; V88-I92 HydrophobicContact CG1-CG1 4.41Å; V88-I92 VanDerWaalsContact O-CG1 3.27Å; V88-I92 WeakPolarHBondContact O-CG1 3.45Å; V88-I92 PolarHBondContact O-N 2.95Å; V88-V99 HydrophobicContact CG1-CG1 3.88Å; V88-V103 HydrophobicContact CG1-CG2 3.8Å
89	M	93.8	Very high	90.4	Very high	7 Å²	7	65.8 Å²	65.8	3%	0.034	35%	0.353	C	S	.	.	H	α-helix	trans	-59.4	-39.4	175.4	-67.2	-169.1	-69.7	0	0	111.9	L66 W69 N73 V84 P85 D86 I92 A93	L66-M89 HydrophobicContact CD2-CB 4.44Å; W69-M89 HydrophobicContact CB-CB 4.27Å; W69-M89 HydrophobicContact CB-CG 4.24Å; W69-M89 HydrophobicContact CB-SD 3.87Å; W69-M89 HydrophobicContact CE3-CG 4.38Å; N73-M89 HydrophobicContact CB-SD 3.93Å; V84-M89 HydrophobicContact CB-CG 4.01Å; V84-M89 HydrophobicContact CB-SD 4.5Å; V84-M89 HydrophobicContact CG1-CG 3.59Å; P85-M89 PolarHBondContact O-N 2.93Å; D86-M89 HydrophobicContact CB-CE 4.3Å; D86-M89 PolarHBondContact O-N 3.37Å; D86-M89 WeakPolarHBondContact OD1-CE 3.46Å; M89-I92 PolarHBondContact O-N 3.32Å; M89-A93 WeakPolarHBondContact O-CB 3.49Å; M89-A93 PolarHBondContact O-N 2.89Å
90	R	94.6	Very high	90.5	Very high	121 Å²	121	57.5 Å²	57.5	46%	0.457	32%	0.322	S	S	.	.	H	α-helix	trans	-62.1	-50	175	-173	-177.7	-59.7	-81.9	-1.3	112.1	L66 D86 V88 I92 A93 E94	L66-R90 HydrophobicContact CD2-CB 4.31Å; D86-R90 PolarHBondContact O-N 2.98Å; V88-R90 VanDerWaalsContact C-N 3.28Å; V88-R90 PolarHBondContact O-N 3.43Å; R90-I92 VanDerWaalsContact C-N 3.29Å; R90-I92 PolarHBondContact O-N 3.04Å; R90-A93 PolarHBondContact O-N 3.04Å; R90-A93 VanDerWaalsContact O-N 3.13Å; R90-E94 WeakPolarHBondContact CG-OE1 3.48Å; R90-E94 WeakPolarHBondContact O-CG 3.22Å; R90-E94 PolarHBondContact O-N 3.05Å
91	K	93.3	Very high	90.7	Very high	110 Å²	110	58 Å²	58	48%	0.478	32%	0.324	S	S	.	.	H	α-helix	trans	-60.2	-37.9	177.7	-73	176.8	-179.6	-177.6	0	112.7	D87 V88 E94 C95 S96 V99	D87-K91 WeakPolarHBondContact O-CG 3.16Å; D87-K91 PolarHBondContact O-N 3.07Å; D87-K91 VanDerWaalsContact O-N 3.15Å; V88-K91 PolarHBondContact O-N 3.41Å; K91-E94 PolarHBondContact O-N 3.49Å; K91-C95 PolarHBondContact O-N 3.07Å; K91-S96 WeakPolarHBondContact O-CB 3.45Å; K91-S96 PolarHBondContact O-N 3.18Å; K91-S96 PolarHBondContact O-OG 3.5Å; K91-S96 VanDerWaalsContact O-OG 3.09Å; K91-V99 HydrophobicContact CB-CB 4.43Å; K91-V99 HydrophobicContact CB-CG1 3.9Å; K91-V99 HydrophobicContact CB-CG2 4.2Å
92	I	93.3	Very high	90.7	Very high	1 Å²	1	56.9 Å²	56.9	1%	0.005	32%	0.318	C	S	.	.	H	α-helix	trans	-66.5	-44.4	175	-65.7	165.8	0	0	0	110.8	S34 W69 V88 M89 R90 E94 C95 V99 V100 V103	S34-I92 VanDerWaalsContact CB-O 3.31Å; S34-I92 WeakPolarHBondContact CB-O 3.49Å; W69-I92 HydrophobicContact CH2-CD1 4.13Å; W69-I92 HydrophobicContact CH2-CG2 4.26Å; W69-I92 HydrophobicContact CZ2-CB 4.42Å; W69-I92 HydrophobicContact CZ2-CD1 4.32Å; W69-I92 HydrophobicContact CZ2-CG2 3.42Å; W69-I92 VanDerWaalsContact CZ2-CG2 3.42Å; V88-I92 HydrophobicContact CG1-CD1 3.86Å; V88-I92 HydrophobicContact CG1-CG1 4.41Å; V88-I92 VanDerWaalsContact O-CG1 3.27Å; V88-I92 WeakPolarHBondContact O-CG1 3.45Å; V88-I92 PolarHBondContact O-N 2.95Å; M89-I92 PolarHBondContact O-N 3.32Å; R90-I92 VanDerWaalsContact C-N 3.29Å; R90-I92 PolarHBondContact O-N 3.04Å; I92-E94 PolarHBondContact O-N 3.46Å; I92-C95 WeakPolarHBondContact O-CA 3.41Å; I92-C95 PolarHBondContact O-N 3.11Å; I92-V99 HydrophobicContact CD1-CG1 4.49Å; I92-V99 HydrophobicContact CG1-CB 4.32Å; I92-V99 HydrophobicContact CG1-CG1 3.77Å; I92-V100 HydrophobicContact CG1-CB 4.41Å; I92-V100 HydrophobicContact CG2-CB 4.29Å; I92-V100 HydrophobicContact CG2-CG2 4.13Å; I92-V103 HydrophobicContact CD1-CB 4.29Å; I92-V103 HydrophobicContact CD1-CG2 3.74Å
93	A	92.6	Very high	90.7	Very high	3 Å²	3	55.7 Å²	55.7	3%	0.025	31%	0.313	C	S	.	.	H	α-helix	trans	-64.7	-30.7	179.6	0	0	0	0	0	112.6	L62 K65 L66 M89 R90 C95	L62-A93 HydrophobicContact CD1-CB 3.49Å; L62-A93 VanDerWaalsContact CD1-CB 3.49Å; K65-A93 HydrophobicContact CB-CB 3.81Å; K65-A93 HydrophobicContact CD-CB 4.25Å; K65-A93 WeakPolarHBondContact CD-O 3.41Å; K65-A93 PolarHBondContact NZ-O 3.01Å; L66-A93 HydrophobicContact CD2-CB 4.22Å; L66-A93 HydrophobicContact CG-CB 4.33Å; M89-A93 WeakPolarHBondContact O-CB 3.49Å; M89-A93 PolarHBondContact O-N 2.89Å; R90-A93 PolarHBondContact O-N 3.04Å; R90-A93 VanDerWaalsContact O-N 3.13Å; A93-C95 PolarHBondContact O-N 2.94Å
94	E	93.2	Very high	90.6	Very high	102 Å²	102	51.4 Å²	51.4	48%	0.477	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-0.5	170.7	-71	167.6	-176.9	0	0	113.9	L62 R90 K91 I92 S96	L62-E94 HydrophobicContact CD1-CG 4.07Å; R90-E94 WeakPolarHBondContact CG-OE1 3.48Å; R90-E94 WeakPolarHBondContact O-CG 3.22Å; R90-E94 PolarHBondContact O-N 3.05Å; K91-E94 PolarHBondContact O-N 3.49Å; I92-E94 PolarHBondContact O-N 3.46Å; E94-S96 VanDerWaalsContact C-N 3.29Å; E94-S96 PolarHBondContact O-N 3.01Å
95	C	89.3	Confident	90.4	Very high	43 Å²	43	53.2 Å²	53.2	29%	0.291	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.6	32.9	-177.4	-49.1	0	0	0	0	113.4	S34 K91 I92 A93	S34-C95 WeakPolarHBondContact CB-SG 3.46Å; S34-C95 PolarHBondContact OG-SG 3.35Å; K91-C95 PolarHBondContact O-N 3.07Å; I92-C95 WeakPolarHBondContact O-CA 3.41Å; I92-C95 PolarHBondContact O-N 3.11Å; A93-C95 PolarHBondContact O-N 2.94Å
96	S	88.4	Confident	90.2	Very high	34 Å²	34	51.2 Å²	51.2	24%	0.238	28%	0.28	C	S	.	.			trans	-62.5	122.4	176.3	-65.2	0	0	0	0	110.3	K91 E94 V99	K91-S96 WeakPolarHBondContact O-CB 3.45Å; K91-S96 PolarHBondContact O-N 3.18Å; K91-S96 PolarHBondContact O-OG 3.5Å; K91-S96 VanDerWaalsContact O-OG 3.09Å; E94-S96 VanDerWaalsContact C-N 3.29Å; E94-S96 PolarHBondContact O-N 3.01Å; S96-V99 PolarHBondContact O-N 3.46Å
97	P	83	Confident	90.1	Very high	112 Å²	112	45.7 Å²	45.7	73%	0.727	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	142.8	-178.6	27.7	-34.2	0	0	0	110.7	V99	P97-V99 PolarHBondContact O-N 2.91Å
98	G	84.1	Confident	89.9	Confident	35 Å²	35	43.1 Å²	43.1	36%	0.361	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.4	-19.6	179.2	0	0	0	0	0	114.8	E101 L102	G98-E101 WeakPolarHBondContact CA-OE2 3.24Å; G98-E101 PolarHBondContact N-OE2 3.11Å; G98-L102 WeakPolarHBondContact O-CG 3.29Å
99	V	89.9	Confident	89.7	Confident	24 Å²	24	47.1 Å²	47.1	15%	0.145	25%	0.248	C	C	.	.	H	α-helix	trans	-78.8	-37.2	-176.4	-173.1	0	0	0	0	112	V88 K91 I92 S96 P97 E101 L102	V88-V99 HydrophobicContact CG1-CG1 3.88Å; K91-V99 HydrophobicContact CB-CB 4.43Å; K91-V99 HydrophobicContact CB-CG1 3.9Å; K91-V99 HydrophobicContact CB-CG2 4.2Å; I92-V99 HydrophobicContact CD1-CG1 4.49Å; I92-V99 HydrophobicContact CG1-CB 4.32Å; I92-V99 HydrophobicContact CG1-CG1 3.77Å; S96-V99 PolarHBondContact O-N 3.46Å; P97-V99 PolarHBondContact O-N 2.91Å; V99-E101 VanDerWaalsContact C-N 3.29Å; V99-E101 PolarHBondContact N-OE2 3.3Å; V99-E101 PolarHBondContact O-N 3.48Å; V99-L102 PolarHBondContact O-N 3.43Å
100	V	89.5	Confident	89.5	Confident	1 Å²	1	52.9 Å²	52.9	1%	0.006	27%	0.269	C	S	.	.	H	α-helix	trans	-70.3	-33.4	-179.4	71	0	0	0	0	111	F33 I92 L102 V103 L104	F33-V100 HydrophobicContact CB-CG2 3.71Å; I92-V100 HydrophobicContact CG1-CB 4.41Å; I92-V100 HydrophobicContact CG2-CB 4.29Å; I92-V100 HydrophobicContact CG2-CG2 4.13Å; V100-L102 VanDerWaalsContact C-N 3.35Å; V100-L102 PolarHBondContact O-N 3.26Å; V100-V103 PolarHBondContact O-N 3.49Å; V100-L104 HydrophobicContact CG2-CD1 3.95Å; V100-L104 HydrophobicContact CG2-CG 4.09Å; V100-L104 WeakPolarHBondContact O-CG 3.44Å; V100-L104 PolarHBondContact O-N 3.48Å
101	E	88.1	Confident	89.2	Confident	13 Å²	13	47.1 Å²	47.1	6%	0.061	25%	0.247	C	C	.	.	H	α-helix	trans	-62.3	-42.8	178	-62.8	79.9	175.4	0	0	110.6	L10 L13 S30 G98 V99 V103 L104 I105	L10-E101 HydrophobicContact CD1-CB 4.36Å; L10-E101 HydrophobicContact CD1-CG 3.58Å; L13-E101 HydrophobicContact CD2-CB 4.44Å; L13-E101 HydrophobicContact CD2-CG 4.42Å; S30-E101 PolarHBondContact OG-OE1 2.98Å; G98-E101 WeakPolarHBondContact CA-OE2 3.24Å; G98-E101 PolarHBondContact N-OE2 3.11Å; V99-E101 VanDerWaalsContact C-N 3.29Å; V99-E101 PolarHBondContact N-OE2 3.3Å; V99-E101 PolarHBondContact O-N 3.48Å; E101-V103 PolarHBondContact O-N 3.45Å; E101-V103 VanDerWaalsContact O-N 3.16Å; E101-L104 PolarHBondContact O-N 3.05Å; E101-I105 WeakPolarHBondContact O-CG1 3.46Å; E101-I105 PolarHBondContact O-N 3.2Å
102	L	87.8	Confident	88.9	Confident	105 Å²	105	45.8 Å²	45.8	55%	0.55	24%	0.243	S	C	.	.	H	α-helix	trans	-59.5	-24.6	174.2	-68.5	173.5	0	0	0	113.2	V5 G98 V99 V100 P106	V5-L102 HydrophobicContact CG2-CD2 3.61Å; V5-L102 HydrophobicContact CG2-CG 4.44Å; G98-L102 WeakPolarHBondContact O-CG 3.29Å; V99-L102 PolarHBondContact O-N 3.43Å; V100-L102 VanDerWaalsContact C-N 3.35Å; V100-L102 PolarHBondContact O-N 3.26Å; L102-P106 WeakPolarHBondContact O-CD 3.37Å; L102-P106 WeakPolarHBondContact O-CG 3.3Å
103	V	89.6	Confident	88.7	Confident	10 Å²	10	48.4 Å²	48.4	6%	0.061	26%	0.255	C	S	.	.	H	α-helix	trans	-92.3	-39.1	176.5	175.3	0	0	0	0	111.6	F82 V84 V88 I92 V100 E101 P106 L107	F82-V103 HydrophobicContact CE1-CG1 3.89Å; F82-V103 HydrophobicContact CZ-CG1 4.15Å; V84-V103 HydrophobicContact CG1-CG2 4.19Å; V84-V103 HydrophobicContact CG2-CG1 3.8Å; V84-V103 HydrophobicContact CG2-CG2 4.39Å; V88-V103 HydrophobicContact CG1-CG2 3.8Å; I92-V103 HydrophobicContact CD1-CB 4.29Å; I92-V103 HydrophobicContact CD1-CG2 3.74Å; V100-V103 PolarHBondContact O-N 3.49Å; E101-V103 PolarHBondContact O-N 3.45Å; E101-V103 VanDerWaalsContact O-N 3.16Å; V103-P106 WeakPolarHBondContact O-CD 3.43Å; V103-P106 WeakPolarHBondContact O-CG 3.31Å; V103-L107 WeakPolarHBondContact O-CB 3.27Å; V103-L107 PolarHBondContact O-N 3.21Å; V103-L107 VanDerWaalsContact O-N 3.1Å
104	L	88.6	Confident	88.3	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-71.1	-37.9	-176.3	-72	177.5	0	0	0	113.2	L13 L29 F33 V39 V100 E101 L107 R108	L13-L104 HydrophobicContact CD1-CB 3.9Å; L13-L104 HydrophobicContact CD2-CB 3.88Å; L13-L104 HydrophobicContact CD2-CD1 4.25Å; L13-L104 HydrophobicContact CG-CB 4.49Å; L29-L104 HydrophobicContact CD2-CD1 3.61Å; F33-L104 HydrophobicContact CD1-CD1 3.98Å; F33-L104 HydrophobicContact CD1-CD2 3.97Å; F33-L104 HydrophobicContact CD2-CD1 4.39Å; F33-L104 HydrophobicContact CE1-CD1 3.93Å; F33-L104 HydrophobicContact CE1-CD2 3.83Å; F33-L104 HydrophobicContact CE2-CD1 4.34Å; F33-L104 HydrophobicContact CG-CD1 4.16Å; F33-L104 HydrophobicContact CZ-CD1 4.05Å; V39-L104 HydrophobicContact CG2-CD2 4.4Å; V100-L104 HydrophobicContact CG2-CD1 3.95Å; V100-L104 HydrophobicContact CG2-CG 4.09Å; V100-L104 WeakPolarHBondContact O-CG 3.44Å; V100-L104 PolarHBondContact O-N 3.48Å; E101-L104 PolarHBondContact O-N 3.05Å; L104-L107 HydrophobicContact CD2-CD2 4.25Å; L104-L107 PolarHBondContact O-N 3.22Å; L104-R108 WeakPolarHBondContact O-CB 3.49Å; L104-R108 PolarHBondContact O-N 2.85Å
105	I	88.6	Confident	88	Confident	42 Å²	42	49.9 Å²	49.9	22%	0.215	26%	0.258	C	S	.	.	H	α-helix	trans	-58.2	-56.4	177.2	-67.7	168	0	0	0	111.6	V5 L13 E101 L107 R108 Q109	V5-I105 HydrophobicContact CG1-CD1 3.48Å; V5-I105 VanDerWaalsContact CG1-CD1 3.48Å; L13-I105 HydrophobicContact CD2-CG1 4.21Å; E101-I105 WeakPolarHBondContact O-CG1 3.46Å; E101-I105 PolarHBondContact O-N 3.2Å; I105-L107 VanDerWaalsContact C-N 3.3Å; I105-L107 PolarHBondContact O-N 3.02Å; I105-R108 WeakPolarHBondContact O-CB 3.19Å; I105-R108 PolarHBondContact O-N 3Å; I105-Q109 PolarHBondContact O-N 3.49Å
106	P	88.9	Confident	87.8	Confident	37 Å²	37	53.8 Å²	53.8	24%	0.24	27%	0.266	C	S	.	.	H	α-helix	trans	-68	-30.8	177.7	25.5	-33.5	0	0	0	112.3	F82 L102 V103 Q109 R110	F82-P106 HydrophobicContact CE2-CB 3.96Å; F82-P106 HydrophobicContact CE2-CG 3.95Å; F82-P106 HydrophobicContact CZ-CB 4.49Å; F82-P106 HydrophobicContact CZ-CG 4.02Å; L102-P106 WeakPolarHBondContact O-CD 3.37Å; L102-P106 WeakPolarHBondContact O-CG 3.3Å; V103-P106 WeakPolarHBondContact O-CD 3.43Å; V103-P106 WeakPolarHBondContact O-CG 3.31Å; P106-Q109 PolarHBondContact O-N 3.28Å; P106-R110 VanDerWaalsContact O-CG 3.3Å; P106-R110 WeakPolarHBondContact O-CG 3.04Å; P106-R110 PolarHBondContact O-N 3.44Å
107	L	89.5	Confident	87.5	Confident	1 Å²	1	59.6 Å²	59.6	1%	0.005	28%	0.283	C	S	.	.	H	α-helix	trans	-60.7	-45.3	174.4	179.8	64.4	0	0	0	111.3	V39 I43 L77 L80 V103 L104 I105 Q109 R110 L111	V39-L107 HydrophobicContact CG1-CD2 3.63Å; I43-L107 HydrophobicContact CD1-CD1 4.32Å; I43-L107 HydrophobicContact CD1-CD2 4.34Å; I43-L107 HydrophobicContact CG1-CD2 4.47Å; L77-L107 HydrophobicContact CD2-CD1 3.85Å; L80-L107 HydrophobicContact CD1-CD1 4.06Å; V103-L107 WeakPolarHBondContact O-CB 3.27Å; V103-L107 PolarHBondContact O-N 3.21Å; V103-L107 VanDerWaalsContact O-N 3.1Å; L104-L107 HydrophobicContact CD2-CD2 4.25Å; L104-L107 PolarHBondContact O-N 3.22Å; I105-L107 VanDerWaalsContact C-N 3.3Å; I105-L107 PolarHBondContact O-N 3.02Å; L107-Q109 PolarHBondContact O-N 3.37Å; L107-R110 PolarHBondContact O-N 2.99Å; L107-L111 HydrophobicContact CD1-CD1 4.45Å; L107-L111 HydrophobicContact CD1-CG 4.37Å; L107-L111 HydrophobicContact CG-CD1 4.08Å; L107-L111 HydrophobicContact CG-CG 4.43Å; L107-L111 VanDerWaalsContact O-CG 3.3Å; L107-L111 WeakPolarHBondContact O-CG 2.84Å; L107-L111 PolarHBondContact O-N 3.28Å
108	R	88.5	Confident	87.3	Confident	62 Å²	62	61.1 Å²	61.1	23%	0.234	27%	0.274	C	S	.	.	H	α-helix	trans	-55.2	-51.4	175.9	174.4	-178.5	172.5	-174.5	-3.8	111.3	Q12 W16 L104 I105 R110 L111 E112	Q12-R108 PolarHBondContact O-NH1 2.92Å; W16-R108 HydrophobicContact CD2-CB 4.37Å; W16-R108 HydrophobicContact CD2-CG 3.87Å; W16-R108 HydrophobicContact CE3-CB 4.28Å; W16-R108 HydrophobicContact CE3-CG 4.25Å; W16-R108 HydrophobicContact CG-CG 4.31Å; W16-R108 HydrophobicContact CH2-CB 3.88Å; W16-R108 HydrophobicContact CH2-CG 4.24Å; W16-R108 HydrophobicContact CZ2-CB 3.98Å; W16-R108 HydrophobicContact CZ2-CG 3.86Å; W16-R108 HydrophobicContact CZ3-CB 4.04Å; W16-R108 HydrophobicContact CZ3-CG 4.43Å; L104-R108 WeakPolarHBondContact O-CB 3.49Å; L104-R108 PolarHBondContact O-N 2.85Å; I105-R108 WeakPolarHBondContact O-CB 3.19Å; I105-R108 PolarHBondContact O-N 3Å; R108-R110 VanDerWaalsContact C-N 3.28Å; R108-R110 PolarHBondContact O-N 3.33Å; R108-L111 PolarHBondContact O-N 3.06Å; R108-L111 VanDerWaalsContact O-N 3.12Å; R108-E112 HydrophobicContact CG-CG 4.49Å; R108-E112 WeakPolarHBondContact CG-OE1 3.49Å; R108-E112 IonicContact CZ-OE1 3.32Å; R108-E112 IonicContact NE-OE1 2.99Å; R108-E112 PolarHBondContact NE-OE1 2.9Å; R108-E112 IonicContact NH2-OE1 2.77Å; R108-E112 PolarHBondContact NH2-OE1 3.49Å; R108-E112 WeakPolarHBondContact O-CG 3.44Å; R108-E112 PolarHBondContact O-N 3.42Å
109	Q	89.4	Confident	86.9	Confident	126 Å²	126	66.5 Å²	66.5	59%	0.589	29%	0.288	S	S	*	.	H	α-helix	trans	-57.7	-41.1	178.9	-66.3	178	-7.3	0	0	112	I105 P106 L107 E112 E113	I105-Q109 PolarHBondContact O-N 3.49Å; P106-Q109 PolarHBondContact O-N 3.28Å; L107-Q109 PolarHBondContact O-N 3.37Å; Q109-E112 PolarHBondContact O-N 3.27Å; Q109-E113 WeakPolarHBondContact O-CB 3.45Å; Q109-E113 PolarHBondContact O-N 3.33Å
110	R	88.9	Confident	85.9	Confident	128 Å²	128	70.7 Å²	70.7	48%	0.483	31%	0.306	S	S	.	.	H	α-helix	trans	-66.6	-38.6	177.4	-69	-66.6	-177.9	-170.1	0.4	112.7	P106 L107 R108 R114	P106-R110 VanDerWaalsContact O-CG 3.3Å; P106-R110 WeakPolarHBondContact O-CG 3.04Å; P106-R110 PolarHBondContact O-N 3.44Å; L107-R110 PolarHBondContact O-N 2.99Å; R108-R110 VanDerWaalsContact C-N 3.28Å; R108-R110 PolarHBondContact O-N 3.33Å; R110-R114 WeakPolarHBondContact O-CB 3.4Å; R110-R114 PolarHBondContact O-N 2.81Å; R110-R114 VanDerWaalsContact O-N 3.14Å
111	L	88.1	Confident	84.4	Confident	0 Å²	0	73.3 Å²	73.3	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-66.1	-45.5	176.8	-68.2	171.3	0	0	0	111.2	W16 V42 I43 Y46 F47 L80 L107 R108 R114 Q115	W16-L111 HydrophobicContact CH2-CD1 4.23Å; W16-L111 HydrophobicContact CZ2-CD1 4.23Å; V42-L111 HydrophobicContact CG1-CD1 4.11Å; I43-L111 HydrophobicContact CG1-CD1 4.39Å; I43-L111 HydrophobicContact CG1-CD2 4.28Å; I43-L111 HydrophobicContact CG2-CD2 4.26Å; Y46-L111 HydrophobicContact CD2-CD1 4.05Å; Y46-L111 HydrophobicContact CE2-CD1 4.39Å; F47-L111 HydrophobicContact CD2-CD2 3.82Å; F47-L111 HydrophobicContact CE2-CD2 3.57Å; L80-L111 HydrophobicContact CD1-CD2 3.76Å; L80-L111 HydrophobicContact CD2-CD2 4.27Å; L107-L111 HydrophobicContact CD1-CD1 4.45Å; L107-L111 HydrophobicContact CD1-CG 4.37Å; L107-L111 HydrophobicContact CG-CD1 4.08Å; L107-L111 HydrophobicContact CG-CG 4.43Å; L107-L111 VanDerWaalsContact O-CG 3.3Å; L107-L111 WeakPolarHBondContact O-CG 2.84Å; L107-L111 PolarHBondContact O-N 3.28Å; R108-L111 PolarHBondContact O-N 3.06Å; R108-L111 VanDerWaalsContact O-N 3.12Å; L111-R114 PolarHBondContact O-N 3.17Å; L111-Q115 WeakPolarHBondContact O-CB 3.45Å; L111-Q115 WeakPolarHBondContact O-CG 3.47Å; L111-Q115 PolarHBondContact O-N 3.48Å
112	E	88	Confident	82.6	Confident	83 Å²	83	78.1 Å²	78.1	39%	0.388	36%	0.363	S	S	.	.	H	α-helix	trans	-63.2	-45.5	178.7	-71.6	175.4	-174.5	0	0	112.1	R108 Q109 R114 Q115 R116	R108-E112 HydrophobicContact CG-CG 4.49Å; R108-E112 WeakPolarHBondContact CG-OE1 3.49Å; R108-E112 IonicContact CZ-OE1 3.32Å; R108-E112 IonicContact NE-OE1 2.99Å; R108-E112 PolarHBondContact NE-OE1 2.9Å; R108-E112 IonicContact NH2-OE1 2.77Å; R108-E112 PolarHBondContact NH2-OE1 3.49Å; R108-E112 WeakPolarHBondContact O-CG 3.44Å; R108-E112 PolarHBondContact O-N 3.42Å; Q109-E112 PolarHBondContact O-N 3.27Å; E112-R114 PolarHBondContact O-N 3.44Å; E112-Q115 WeakPolarHBondContact O-CB 3.42Å; E112-Q115 PolarHBondContact O-N 2.95Å; E112-R116 PolarHBondContact O-N 3Å
113	E	88.2	Confident	80.5	Confident	55 Å²	55	76.5 Å²	76.5	26%	0.257	37%	0.372	S	S	.	.	H	α-helix	trans	-63.3	-40.6	177.4	175	59	-167.9	0	0	111.8	Q109 R116 R117	Q109-E113 WeakPolarHBondContact O-CB 3.45Å; Q109-E113 PolarHBondContact O-N 3.33Å; E113-R116 PolarHBondContact O-N 3.11Å; E113-R116 IonicContact OE1-NH2 3.19Å; E113-R116 PolarHBondContact OE1-NH2 3.26Å; E113-R116 IonicContact OE2-CZ 3.41Å; E113-R116 IonicContact OE2-NE 3.02Å; E113-R116 PolarHBondContact OE2-NE 3.35Å; E113-R116 IonicContact OE2-NH2 2.92Å; E113-R116 PolarHBondContact OE2-NH2 3.04Å; E113-R117 WeakPolarHBondContact O-CG 3.41Å; E113-R117 PolarHBondContact O-N 3.45Å; E113-R117 IonicContact OE1-CZ 3.46Å; E113-R117 VanDerWaalsContact OE1-CZ 3.32Å; E113-R117 IonicContact OE1-NE 3.63Å; E113-R117 PolarHBondContact OE1-NE 3.2Å; E113-R117 IonicContact OE1-NH2 3.66Å; E113-R117 PolarHBondContact OE1-NH2 2.95Å
114	R	85.6	Confident	78.2	Confident	84 Å²	84	80.9 Å²	80.9	32%	0.317	40%	0.403	S	S	.	.	H	α-helix	trans	-66.5	-38.1	174.8	-98.4	-74.4	-172.6	100.3	7.9	112.5	F47 R79 L80 R110 L111 E112 R118	F47-R114 HydrophobicContact CE1-CB 4.33Å; F47-R114 HydrophobicContact CE2-CB 4.21Å; F47-R114 HydrophobicContact CZ-CB 3.56Å; R79-R114 PolarHBondContact O-NH2 2.98Å; L80-R114 HydrophobicContact CD2-CG 4.38Å; R110-R114 WeakPolarHBondContact O-CB 3.4Å; R110-R114 PolarHBondContact O-N 2.81Å; R110-R114 VanDerWaalsContact O-N 3.14Å; L111-R114 PolarHBondContact O-N 3.17Å; E112-R114 PolarHBondContact O-N 3.44Å; R114-R118 PolarHBondContact O-N 3.38Å; R114-R118 VanDerWaalsContact O-N 3.11Å
115	Q	85.9	Confident	76	Confident	53 Å²	53	88.6 Å²	88.6	25%	0.248	44%	0.443	C	S	.	.	H	α-helix	trans	-61.4	-46.8	173.8	-90.3	-94.7	-23.4	0	0	110.9	Y46 F47 L111 E112 R117 R118 K119	Y46-Q115 HydrophobicContact CD1-CG 3.8Å; Y46-Q115 PolarHBondContact O-NE2 3.41Å; F47-Q115 HydrophobicContact CZ-CG 4Å; L111-Q115 WeakPolarHBondContact O-CB 3.45Å; L111-Q115 WeakPolarHBondContact O-CG 3.47Å; L111-Q115 PolarHBondContact O-N 3.48Å; E112-Q115 WeakPolarHBondContact O-CB 3.42Å; E112-Q115 PolarHBondContact O-N 2.95Å; Q115-R117 PolarHBondContact O-N 3.27Å; Q115-R118 PolarHBondContact O-N 3.27Å; Q115-K119 WeakPolarHBondContact O-CG 3.42Å; Q115-K119 PolarHBondContact O-N 2.93Å
116	R	85.3	Confident	73.6	Confident	125 Å²	125	95.6 Å²	95.6	47%	0.472	48%	0.475	S	S	.	.	H	α-helix	trans	-59.7	-46.4	177.8	-168.5	-179.5	69.8	102.8	4	112.1	E112 E113 R118 K119 Q120	E112-R116 PolarHBondContact O-N 3Å; E113-R116 PolarHBondContact O-N 3.11Å; E113-R116 IonicContact OE1-NH2 3.19Å; E113-R116 PolarHBondContact OE1-NH2 3.26Å; E113-R116 IonicContact OE2-CZ 3.41Å; E113-R116 IonicContact OE2-NE 3.02Å; E113-R116 PolarHBondContact OE2-NE 3.35Å; E113-R116 IonicContact OE2-NH2 2.92Å; E113-R116 PolarHBondContact OE2-NH2 3.04Å; R116-R118 VanDerWaalsContact C-N 3.32Å; R116-R118 PolarHBondContact O-N 2.99Å; R116-K119 PolarHBondContact O-N 3.47Å; R116-Q120 WeakPolarHBondContact O-CG 3.49Å; R116-Q120 PolarHBondContact O-N 3.43Å
117	R	83.1	Confident	71	Confident	155 Å²	155	102.6 Å²	102.6	59%	0.585	51%	0.505	S	S	*	.	H	α-helix	trans	-61.3	-37.6	176.1	-71.4	-179.2	-172.9	-140.4	-1.3	113.1	E113 Q115 G121	E113-R117 WeakPolarHBondContact O-CG 3.41Å; E113-R117 PolarHBondContact O-N 3.45Å; E113-R117 IonicContact OE1-CZ 3.46Å; E113-R117 VanDerWaalsContact OE1-CZ 3.32Å; E113-R117 IonicContact OE1-NE 3.63Å; E113-R117 PolarHBondContact OE1-NE 3.2Å; E113-R117 IonicContact OE1-NH2 3.66Å; E113-R117 PolarHBondContact OE1-NH2 2.95Å; Q115-R117 PolarHBondContact O-N 3.27Å; R117-G121 PolarHBondContact O-N 2.91Å
118	R	78.7	Confident	68.5	Low	145 Å²	145	111.3 Å²	111.3	55%	0.547	55%	0.55	S	S	.	*	H	α-helix	trans	-66.6	-43.1	174.1	-83.3	-165.7	169.8	-159.1	-7.9	112.2	R114 Q115 R116 Q120 G121 T122	R114-R118 PolarHBondContact O-N 3.38Å; R114-R118 VanDerWaalsContact O-N 3.11Å; Q115-R118 PolarHBondContact O-N 3.27Å; R116-R118 VanDerWaalsContact C-N 3.32Å; R116-R118 PolarHBondContact O-N 2.99Å; R118-Q120 VanDerWaalsContact C-N 3.33Å; R118-Q120 PolarHBondContact O-N 3.34Å; R118-G121 PolarHBondContact O-N 3.31Å; R118-T122 PolarHBondContact O-N 2.92Å; R118-T122 PolarHBondContact O-OG1 3.06Å
119	K	75.9	Confident	65.8	Low	148 Å²	148	112.5 Å²	112.5	64%	0.643	57%	0.574	S	S	*	*	H	α-helix	trans	-62.2	-41.3	176.9	-69.9	-179.6	-180	-176.8	0	111.3	Q115 R116 T122 G123	Q115-K119 WeakPolarHBondContact O-CG 3.42Å; Q115-K119 PolarHBondContact O-N 2.93Å; R116-K119 PolarHBondContact O-N 3.47Å; K119-T122 PolarHBondContact O-N 3.27Å; K119-G123 PolarHBondContact O-N 3.3Å
120	Q	67.8	Low	63.6	Low	112 Å²	112	112.2 Å²	112.2	52%	0.523	58%	0.583	S	S	.	*	H	α-helix	trans	-66.1	-40	174.4	-70.9	173.8	-5.9	0	0	112.9	R116 R118 T122 G123	R116-Q120 WeakPolarHBondContact O-CG 3.49Å; R116-Q120 PolarHBondContact O-N 3.43Å; R118-Q120 VanDerWaalsContact C-N 3.33Å; R118-Q120 PolarHBondContact O-N 3.34Å; Q120-T122 VanDerWaalsContact C-N 3.33Å; Q120-T122 PolarHBondContact O-N 3.25Å; Q120-G123 PolarHBondContact O-N 3.49Å
121	G	58.1	Low	61	Low	55 Å²	55	115 Å²	115	57%	0.567	60%	0.601	S	S	*	*	H	α-helix	trans	-72.8	-20.1	177.1	0	0	0	0	0	114.9	R117 R118	R117-G121 PolarHBondContact O-N 2.91Å; R118-G121 PolarHBondContact O-N 3.31Å
122	T	49.5	Very low	58.2	Low	114 Å²	114	122.5 Å²	122.5	70%	0.699	64%	0.641	S	S	*	*	H	α-helix	trans	-90.3	-18.4	177.8	-39.9	0	0	0	0	112.1	R118 K119 Q120 S124	R118-T122 PolarHBondContact O-N 2.92Å; R118-T122 PolarHBondContact O-OG1 3.06Å; K119-T122 PolarHBondContact O-N 3.27Å; Q120-T122 VanDerWaalsContact C-N 3.33Å; Q120-T122 PolarHBondContact O-N 3.25Å; T122-S124 VanDerWaalsContact C-N 3.35Å
123	G	43.9	Very low	55.6	Low	71 Å²	71	121.6 Å²	121.6	73%	0.732	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.8	-1.8	175.6	0	0	0	0	0	115.2	K119 Q120	K119-G123 PolarHBondContact O-N 3.3Å; Q120-G123 PolarHBondContact O-N 3.49Å
124	S	42.3	Very low	53.2	Low	103 Å²	103	125.4 Å²	125.4	72%	0.72	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.1	10.9	-175.3	-168.2	0	0	0	0	114	T122	T122-S124 VanDerWaalsContact C-N 3.35Å
125	L	41.1	Very low	50.6	Low	161 Å²	161	124.6 Å²	124.6	84%	0.843	71%	0.705	S	S	*	*	S	Bend	trans	-116.9	31.9	-176.1	-150	106	0	0	0	114.3
126	Q	40	Very low	48	Very low	190 Å²	190	132.3 Å²	132.3	89%	0.888	73%	0.733	S	S	*	*	S	Bend	trans	-148	87	163.5	-160.3	151.3	40.9	0	0	109.5
127	E	34.4	Very low	45.6	Very low	183 Å²	183	133.8 Å²	133.8	86%	0.855	75%	0.747	S	S	*	*			trans	161.2	84.7	137.8	-165.6	161.8	-165.7	0	0	108.6
128	L	36.1	Very low	43.3	Very low	184 Å²	184	132.9 Å²	132.9	96%	0.963	75%	0.754	S	S	*	*			trans	-123.2	95.3	159.5	-77.4	174.5	0	0	0	106.9
129	A	31.4	Very low	41.3	Very low	88 Å²	88	132.1 Å²	132.1	73%	0.727	77%	0.765	S	S	*	*			trans	-95.4	143.3	150	0	0	0	0	0	108.1
130	P	43.9	Very low	39.2	Very low	120 Å²	120	128.7 Å²	128.7	78%	0.779	77%	0.772	S	S	*	*			trans	-103.5	135.7	-160	28.7	-13.5	0	0	0	112.3
131	Q	33.2	Very low	37.4	Very low	185 Å²	185	131.3 Å²	131.3	86%	0.864	79%	0.788	S	S	*	*			trans	-144.4	111.4	155.3	-69.4	-163.1	44.8	0	0	106.9
132	D	31	Very low	36.3	Very low	159 Å²	159	133.2 Å²	133.2	85%	0.85	79%	0.793	S	S	*	*				84	97.2	97.2	-152.8	30.1	0	0	0	108.4
133	G	32.9	Very low	35.3	Very low	64 Å²	64	135.6 Å²	135.6	66%	0.66	80%	0.796	S	S	*	*				115.8	145	80.8	0	0	0	0	0	107.5
134	S	37.7	Very low	34.5	Very low	134 Å²	134	141.3 Å²	141.3	94%	0.937	80%	0.801	S	S	*	*			trans	78.6	125.1	-179.5	-169.7	0	0	0	0	115.2
135	G	31.4	Very low	34	Very low	67 Å²	67	140.7 Å²	140.7	69%	0.691	80%	0.802	S	S	*	*			cis	152.7	110.1	16.5	0	0	0	0	0	107.2
136	Y	31.6	Very low	33.2	Very low	215 Å²	215	145.3 Å²	145.3	84%	0.843	81%	0.808	S	S	*	*			trans	-5	152.9	160.2	-137.1	-126	0	0	0	121.2
137	M	34.7	Very low	32.7	Very low	157 Å²	157	139.1 Å²	139.1	77%	0.773	80%	0.796	S	S	*	*			trans	92.9	148.5	154.1	-59.5	-132.1	-95.4	0	0	118.1
138	D	34.8	Very low	32.3	Very low	135 Å²	135	140.3 Å²	140.3	72%	0.722	80%	0.801	S	S	*	*			cis	-176.6	166.5	-7	171.1	45.6	0	0	0	107.4
139	V	35.9	Very low	32	Very low	129 Å²	129	135 Å²	135	78%	0.782	79%	0.791	S	S	*	*			trans	-52.8	156.3	-175.4	178	0	0	0	0	115.9
140	G	31.5	Very low	31.9	Very low	76 Å²	76	135.3 Å²	135.3	78%	0.784	79%	0.793	S	S	*	*			trans	173.2	95.1	156.3	0	0	0	0	0	118.1
141	L	30.9	Very low	31.3	Very low	167 Å²	167	137.9 Å²	137.9	87%	0.874	80%	0.799	S	S	*	*			trans	-76.3	142.7	160.3	-74.5	154.5	0	0	0	111.1
142	S	33.5	Very low	31.3	Very low	95 Å²	95	136.1 Å²	136.1	66%	0.664	80%	0.796	S	S	*	*				160.1	127.6	125.3	-98.5	0	0	0	0	115.8
143	Q	30.3	Very low	32	Very low	165 Å²	165	133.4 Å²	133.4	77%	0.771	79%	0.787	S	S	*	*				61.1	122.4	122.9	-65.6	-176.7	49.1	0	0	123.2
144	K	26.7	Very low	32	Very low	191 Å²	191	139 Å²	139	83%	0.83	80%	0.796	S	S	*	*				89.1	118.6	117.3	-166.6	-173.5	-162.1	179.8	0	120.1
145	A	31.3	Very low	31.7	Very low	89 Å²	89	135.5 Å²	135.5	74%	0.736	78%	0.781	S	S	*	*				174	125.6	123.4	0	0	0	0	0	108.8
146	R	25.3	Very low	31.6	Very low	258 Å²	258	141.9 Å²	141.9	97%	0.974	79%	0.793	S	S	*	*				57.5	132.2	86.3	-123.6	-175.5	-175.3	-162.3	-0.5	112.4
147	G	28.4	Very low	31.5	Very low	61 Å²	61	134.5 Å²	134.5	63%	0.629	78%	0.782	S	S	*	*			cis	-164.6	157.2	5	0	0	0	0	0	108.3
148	E	27	Very low	31.3	Very low	208 Å²	208	137 Å²	137	97%	0.972	79%	0.792	S	S	*	*				103.5	138.1	100.3	-84.8	-167.4	133.6	0	0	114.3
149	G	28.7	Very low	31.3	Very low	72 Å²	72	138.5 Å²	138.5	74%	0.742	80%	0.799	S	S	*	*			trans	116.5	79.8	169.8	0	0	0	0	0	113.8
150	A	28.8	Very low	31.1	Very low	94 Å²	94	138.8 Å²	138.8	78%	0.777	81%	0.807	S	S	*	*				67.6	110.5	79.3	0	0	0	0	0	115
151	L	31.3	Very low	31	Very low	174 Å²	174	138.4 Å²	138.4	91%	0.911	80%	0.803	S	S	*	*				162.3	107.7	120	-81.4	164.5	0	0	0	111.7
152	D	32.9	Very low	30.8	Very low	148 Å²	148	137.3 Å²	137.3	79%	0.791	80%	0.803	S	S	*	*			trans	-72.6	169.8	148.8	-109.2	-52.1	0	0	0	108.9
153	P	47.2	Very low	30.7	Very low	102 Å²	102	144.1 Å²	144.1	66%	0.662	81%	0.814	S	S	*	*			cis	-155.8	178.5	45.9	40.7	-17.3	0	0	0	119.6
154	Q	32.5	Very low	31.6	Very low	182 Å²	182	141.2 Å²	141.2	85%	0.85	81%	0.81	S	S	*	*			trans	77.7	133.4	149.6	-85.8	175	-63.8	0	0	119.3
155	G	30.5	Very low	31.9	Very low	60 Å²	60	138.2 Å²	138.2	62%	0.619	81%	0.809	S	S	*	*			cis	171.5	148.7	2.7	0	0	0	0	0	111.7
156	E	29.2	Very low	32	Very low	201 Å²	201	138.3 Å²	138.3	94%	0.939	81%	0.811	S	S	*	*			trans	48.8	134.3	139.2	-49.7	-172	131.9	0	0	119.6
157	G	29.7	Very low	33.2	Very low	61 Å²	61	131.8 Å²	131.8	63%	0.629	80%	0.801	S	S	*	*			cis	134.5	133	16.4	0	0	0	0	0	108.9
158	Q	30.9	Very low	33.5	Very low	208 Å²	208	140.8 Å²	140.8	97%	0.972	82%	0.816	S	S	*	*			trans	-173.2	142.8	148.6	-112.2	147.8	86.7	0	0	115.2
159	L	35.5	Very low	34.3	Very low	168 Å²	168	136.5 Å²	136.5	88%	0.88	81%	0.807	S	S	*	*			trans	-113.1	145.7	-178.9	-74.1	160.8	0	0	0	111
160	S	30.3	Very low	35.3	Very low	134 Å²	134	136.9 Å²	136.9	94%	0.937	80%	0.796	S	S	*	*			trans	154.6	143.1	153.2	-85	0	0	0	0	108.5
161	G	29.6	Very low	35.5	Very low	68 Å²	68	137.2 Å²	137.2	70%	0.701	80%	0.799	S	S	*	*			cis	165.3	142.6	2.4	0	0	0	0	0	108.8
162	V	28.1	Very low	36	Very low	144 Å²	144	137.3 Å²	137.3	87%	0.873	79%	0.788	S	S	*	*			trans	69.5	110.3	147.7	-168.4	0	0	0	0	123
163	R	30.2	Very low	36.5	Very low	238 Å²	238	137.4 Å²	137.4	90%	0.898	79%	0.789	S	S	*	*			trans	58.5	152.1	141.9	-98.1	-170.5	131.7	168.5	-1.9	125
164	P	48.8	Very low	36.2	Very low	105 Å²	105	141.5 Å²	141.5	68%	0.682	80%	0.799	S	S	*	*			trans	-102.7	177.6	-165.1	43.6	-37.8	0	0	0	114.7
165	P	32.9	Very low	36.8	Very low	127 Å²	127	137.1 Å²	137.1	83%	0.825	79%	0.794	S	S	*	*			trans	-139.2	143.1	136.2	35.2	-19.3	0	0	0	114.3
166	A	35.1	Very low	37.7	Very low	92 Å²	92	142.2 Å²	142.2	76%	0.76	81%	0.806	S	S	*	*			trans	-106.7	-176.5	154	0	0	0	0	0	107.7
167	P	50	Low	38.5	Very low	120 Å²	120	141.5 Å²	141.5	78%	0.779	80%	0.803	S	S	*	*			cis	-124.9	168.6	-38.9	31.4	-13.7	0	0	0	111.4
168	R	33.7	Very low	39.9	Very low	250 Å²	250	141 Å²	141	94%	0.943	80%	0.799	S	S	*	*			trans	-142.9	152	160.2	-70.9	-165.4	-159.5	178.9	7.9	111.8
169	P	44.6	Very low	41.1	Very low	119 Å²	119	135.7 Å²	135.7	77%	0.773	78%	0.777	S	S	*	*			trans	-111.9	-162.4	-144.8	45.9	-34.5	0	0	0	112.9
170	P	49.5	Very low	42.6	Very low	79 Å²	79	132.4 Å²	132.4	51%	0.513	77%	0.765	S	S	.	*				-95	125.4	-115.5	13.1	11.4	0	0	0	112.2	Y172	P170-Y172 HydrophobicContact CB-CD1 4.2Å; P170-Y172 HydrophobicContact CB-CE1 3.86Å; P170-Y172 HydrophobicContact CG-CE1 3.75Å; P170-Y172 WeakPolarHBondContact O-CE1 3.31Å; P170-Y172 VanDerWaalsContact O-CE2 3.27Å; P170-Y172 WeakPolarHBondContact O-CE2 3.33Å; P170-Y172 PolarHBondContact O-N 3.35Å; P170-Y172 PolarHBondContact O-OH 2.93Å
171	A	34	Very low	44.6	Very low	102 Å²	102	129.7 Å²	129.7	84%	0.843	75%	0.746	S	S	*	*			trans	-90.4	87.6	166.4	0	0	0	0	0	109.2
172	Y	41.3	Very low	46.7	Very low	175 Å²	175	132.3 Å²	132.3	69%	0.686	74%	0.739	S	S	*	*			trans	-54.3	136.8	155	6.8	-95.9	0	0	0	108.3	P170	P170-Y172 HydrophobicContact CB-CD1 4.2Å; P170-Y172 HydrophobicContact CB-CE1 3.86Å; P170-Y172 HydrophobicContact CG-CE1 3.75Å; P170-Y172 WeakPolarHBondContact O-CE1 3.31Å; P170-Y172 VanDerWaalsContact O-CE2 3.27Å; P170-Y172 WeakPolarHBondContact O-CE2 3.33Å; P170-Y172 PolarHBondContact O-N 3.35Å; P170-Y172 PolarHBondContact O-OH 2.93Å
173	N	43.2	Very low	49.2	Very low	151 Å²	151	129.3 Å²	129.3	81%	0.807	72%	0.721	S	S	*	*			trans	95.7	67.5	178.9	-49.6	-61.4	0	0	0	116.6
174	Q	40.6	Very low	51.7	Low	187 Å²	187	124.3 Å²	124.3	87%	0.874	71%	0.711	S	S	*	*			trans	-144.6	59.1	140.5	-155.3	144.7	75.5	0	0	110.5
175	A	46.2	Very low	53.3	Low	90 Å²	90	124.5 Å²	124.5	74%	0.744	70%	0.703	S	S	*	*			trans	-69.8	142.5	149.2	0	0	0	0	0	107.2
176	L	49	Very low	55.7	Low	167 Å²	167	121.8 Å²	121.8	87%	0.874	68%	0.68	S	S	*	*			trans	93.7	54.1	177.9	-51.2	163.2	0	0	0	116.3
177	Q	45.9	Very low	58.2	Low	186 Å²	186	119.9 Å²	119.9	87%	0.869	67%	0.665	S	S	*	*				-116.3	102.1	124.6	-86.4	-176.8	10.3	0	0	106.4	D179	Q177-D179 PolarHBondContact O-N 2.92Å
178	G	58.1	Low	60	Low	52 Å²	52	120.1 Å²	120.1	54%	0.536	66%	0.656	S	S	.	*			trans	-61.1	102.8	171.7	0	0	0	0	0	107.7	P180	G178-P180 WeakPolarHBondContact O-CD 3.48Å; G178-P180 VanDerWaalsContact O-N 3.11Å
179	D	56.6	Low	62.7	Low	96 Å²	96	114 Å²	114	51%	0.513	64%	0.636	S	S	.	*			trans	-52	116.5	161.5	-178.9	-7.6	0	0	0	106.4	Q177 S181 F182 V183	Q177-D179 PolarHBondContact O-N 2.92Å; D179-S181 PolarHBondContact O-N 2.97Å; D179-S181 WeakPolarHBondContact OD1-CB 3.35Å; D179-S181 PolarHBondContact OD1-N 3.49Å; D179-F182 HydrophobicContact CB-CB 4.08Å; D179-F182 WeakPolarHBondContact O-CB 3.33Å; D179-F182 PolarHBondContact O-N 2.86Å; D179-V183 PolarHBondContact O-N 2.97Å; D179-V183 VanDerWaalsContact O-N 3.11Å
180	P	66.8	Low	64.8	Low	98 Å²	98	114 Å²	114	64%	0.636	63%	0.626	S	S	*	*	H	α-helix	trans	-53.1	-28.3	179.4	-26.7	35.5	0	0	0	112.3	G178 L184	G178-P180 WeakPolarHBondContact O-CD 3.48Å; G178-P180 VanDerWaalsContact O-N 3.11Å; P180-L184 WeakPolarHBondContact O-CB 3.38Å; P180-L184 PolarHBondContact O-N 3.34Å
181	S	71.7	Confident	66.8	Low	78 Å²	78	117 Å²	117	55%	0.545	63%	0.633	S	S	.	*	H	α-helix	trans	-63.7	-44.9	174	-171	0	0	0	0	112.3	D179 L184 Q185	D179-S181 PolarHBondContact O-N 2.97Å; D179-S181 WeakPolarHBondContact OD1-CB 3.35Å; D179-S181 PolarHBondContact OD1-N 3.49Å; S181-L184 PolarHBondContact O-N 3.4Å; S181-Q185 WeakPolarHBondContact O-CB 3.36Å; S181-Q185 PolarHBondContact O-N 3.34Å
182	F	73.6	Confident	69.5	Low	122 Å²	122	117.8 Å²	117.8	54%	0.535	62%	0.619	S	S	.	*	H	α-helix	trans	-70.6	-38.4	-179.7	-174.5	-110.8	0	0	0	112.1	D179 Q185 I186	D179-F182 HydrophobicContact CB-CB 4.08Å; D179-F182 WeakPolarHBondContact O-CB 3.33Å; D179-F182 PolarHBondContact O-N 2.86Å; F182-Q185 PolarHBondContact O-N 2.98Å; F182-I186 HydrophobicContact CD1-CD1 3.61Å; F182-I186 HydrophobicContact CE1-CD1 3.28Å; F182-I186 HydrophobicContact CE1-CG1 4.26Å; F182-I186 HydrophobicContact CE2-CD1 4.43Å; F182-I186 HydrophobicContact CG-CD1 4.34Å; F182-I186 HydrophobicContact CZ-CD1 3.74Å; F182-I186 HydrophobicContact CZ-CG1 4.31Å; F182-I186 WeakPolarHBondContact O-CG1 3.39Å; F182-I186 PolarHBondContact O-N 3.43Å
183	V	80.7	Confident	71.9	Confident	82 Å²	82	114.1 Å²	114.1	50%	0.497	61%	0.61	S	S	.	*	H	α-helix	trans	-65	-41	175.2	178.5	0	0	0	0	111	D179 Q185 I186 A187	D179-V183 PolarHBondContact O-N 2.97Å; D179-V183 VanDerWaalsContact O-N 3.11Å; V183-Q185 VanDerWaalsContact C-N 3.33Å; V183-Q185 PolarHBondContact O-N 3.25Å; V183-I186 PolarHBondContact O-N 3.3Å; V183-A187 PolarHBondContact O-N 2.91Å; V183-A187 VanDerWaalsContact O-N 3.07Å
184	L	82.6	Confident	74.3	Confident	133 Å²	133	111.8 Å²	111.8	70%	0.696	60%	0.598	S	S	*	*	H	α-helix	trans	-60.5	-44.8	174.2	-123.6	90.2	0	0	0	111.5	P180 S181 I186 A187 E188	P180-L184 WeakPolarHBondContact O-CB 3.38Å; P180-L184 PolarHBondContact O-N 3.34Å; S181-L184 PolarHBondContact O-N 3.4Å; L184-I186 VanDerWaalsContact C-N 3.33Å; L184-I186 PolarHBondContact O-N 3.35Å; L184-A187 PolarHBondContact O-N 2.68Å; L184-E188 WeakPolarHBondContact O-CB 2.92Å; L184-E188 PolarHBondContact O-N 3.49Å
185	Q	83.3	Confident	76.7	Confident	109 Å²	109	105.2 Å²	105.2	51%	0.509	58%	0.575	S	S	.	*	H	α-helix	trans	-67	-35.3	-178	-163.5	168	44.6	0	0	112	S181 F182 V183 K189	S181-Q185 WeakPolarHBondContact O-CB 3.36Å; S181-Q185 PolarHBondContact O-N 3.34Å; F182-Q185 PolarHBondContact O-N 2.98Å; V183-Q185 VanDerWaalsContact C-N 3.33Å; V183-Q185 PolarHBondContact O-N 3.25Å; Q185-K189 WeakPolarHBondContact O-CB 3.26Å; Q185-K189 WeakPolarHBondContact O-CG 3.34Å; Q185-K189 PolarHBondContact O-N 3.45Å; Q185-K189 VanDerWaalsContact O-N 3.07Å
186	I	84.3	Confident	78.9	Confident	69 Å²	69	104.1 Å²	104.1	35%	0.354	56%	0.562	S	S	.	*	H	α-helix	trans	-64.5	-48.3	172.3	-71	164.6	0	0	0	110.7	F182 V183 L184 E188 K189 E190	F182-I186 HydrophobicContact CD1-CD1 3.61Å; F182-I186 HydrophobicContact CE1-CD1 3.28Å; F182-I186 HydrophobicContact CE1-CG1 4.26Å; F182-I186 HydrophobicContact CE2-CD1 4.43Å; F182-I186 HydrophobicContact CG-CD1 4.34Å; F182-I186 HydrophobicContact CZ-CD1 3.74Å; F182-I186 HydrophobicContact CZ-CG1 4.31Å; F182-I186 WeakPolarHBondContact O-CG1 3.39Å; F182-I186 PolarHBondContact O-N 3.43Å; V183-I186 PolarHBondContact O-N 3.3Å; L184-I186 VanDerWaalsContact C-N 3.33Å; L184-I186 PolarHBondContact O-N 3.35Å; I186-E188 VanDerWaalsContact C-N 3.32Å; I186-E188 PolarHBondContact O-N 3.29Å; I186-K189 PolarHBondContact O-N 2.89Å; I186-E190 HydrophobicContact CG2-CG 4.34Å; I186-E190 WeakPolarHBondContact O-CG 3.31Å; I186-E190 PolarHBondContact O-N 3.46Å
187	A	86.8	Confident	81	Confident	52 Å²	52	101.3 Å²	101.3	43%	0.43	55%	0.545	S	S	.	.	H	α-helix	trans	-62.6	-39.6	-179.2	0	0	0	0	0	112.2	V183 L184 E190 Q191	V183-A187 PolarHBondContact O-N 2.91Å; V183-A187 VanDerWaalsContact O-N 3.07Å; L184-A187 PolarHBondContact O-N 2.68Å; A187-E190 PolarHBondContact O-N 3.14Å; A187-Q191 WeakPolarHBondContact O-CB 3.46Å; A187-Q191 PolarHBondContact O-N 3.31Å
188	E	87.3	Confident	83.2	Confident	126 Å²	126	98.8 Å²	98.8	59%	0.589	53%	0.533	S	S	*	.	H	α-helix	trans	-62.1	-44.5	174.4	-175.9	176.5	-152.5	0	0	111.4	L184 I186 E190 Q191 E192	L184-E188 WeakPolarHBondContact O-CB 2.92Å; L184-E188 PolarHBondContact O-N 3.49Å; I186-E188 VanDerWaalsContact C-N 3.32Å; I186-E188 PolarHBondContact O-N 3.29Å; E188-E190 PolarHBondContact O-N 2.99Å; E188-Q191 PolarHBondContact O-N 2.93Å; E188-E192 PolarHBondContact O-N 3.26Å
189	K	90.4	Very high	85	Confident	122 Å²	122	100.1 Å²	100.1	53%	0.53	53%	0.53	S	S	.	.	H	α-helix	trans	-65.4	-37.4	176.6	-71.6	-70.7	175.6	-174.2	0	112.8	Q185 I186 E192 L193	Q185-K189 WeakPolarHBondContact O-CB 3.26Å; Q185-K189 WeakPolarHBondContact O-CG 3.34Å; Q185-K189 PolarHBondContact O-N 3.45Å; Q185-K189 VanDerWaalsContact O-N 3.07Å; I186-K189 PolarHBondContact O-N 2.89Å; K189-E192 IonicContact NZ-OE2 3.44Å; K189-E192 PolarHBondContact NZ-OE2 3.35Å; K189-E192 PolarHBondContact O-N 2.95Å; K189-L193 WeakPolarHBondContact O-CB 3.2Å; K189-L193 PolarHBondContact O-N 3.43Å
190	E	88.8	Confident	86.9	Confident	119 Å²	119	98.8 Å²	98.8	56%	0.556	53%	0.526	S	S	*	.	H	α-helix	trans	-65.4	-39.2	174.2	-75.2	-179.2	162.4	0	0	111.7	I186 A187 E188 L193 L194	I186-E190 HydrophobicContact CG2-CG 4.34Å; I186-E190 WeakPolarHBondContact O-CG 3.31Å; I186-E190 PolarHBondContact O-N 3.46Å; A187-E190 PolarHBondContact O-N 3.14Å; E188-E190 PolarHBondContact O-N 2.99Å; E190-L193 WeakPolarHBondContact O-CB 3.39Å; E190-L193 PolarHBondContact O-N 2.87Å; E190-L194 WeakPolarHBondContact O-CG 3.38Å; E190-L194 PolarHBondContact O-N 3.09Å
191	Q	91.4	Very high	88.3	Confident	141 Å²	141	99.7 Å²	99.7	66%	0.659	52%	0.522	S	S	*	.	H	α-helix	trans	-67	-42.7	175.9	-171.4	175	6	0	0	112.1	A187 E188 L193 L194 A195	A187-Q191 WeakPolarHBondContact O-CB 3.46Å; A187-Q191 PolarHBondContact O-N 3.31Å; E188-Q191 PolarHBondContact O-N 2.93Å; Q191-L193 VanDerWaalsContact C-N 3.29Å; Q191-L193 PolarHBondContact O-N 3.34Å; Q191-L194 PolarHBondContact O-N 2.99Å; Q191-A195 PolarHBondContact O-N 2.95Å
192	E	90.6	Very high	89.5	Confident	118 Å²	118	99.2 Å²	99.2	55%	0.551	52%	0.515	S	S	*	.	H	α-helix	trans	-61.5	-40	174.9	-171.7	176	-158.3	0	0	111.2	E188 K189 A195 S196	E188-E192 PolarHBondContact O-N 3.26Å; K189-E192 IonicContact NZ-OE2 3.44Å; K189-E192 PolarHBondContact NZ-OE2 3.35Å; K189-E192 PolarHBondContact O-N 2.95Å; E192-A195 PolarHBondContact O-N 3.36Å; E192-S196 WeakPolarHBondContact O-CB 3.36Å; E192-S196 PolarHBondContact O-N 3.13Å
193	L	92.9	Very high	90.6	Very high	98 Å²	98	97.9 Å²	97.9	51%	0.513	51%	0.513	S	S	.	.	H	α-helix	trans	-61.2	-45	175	179.9	64.2	0	0	0	111.8	K189 E190 Q191 S196 Q197	K189-L193 WeakPolarHBondContact O-CB 3.2Å; K189-L193 PolarHBondContact O-N 3.43Å; E190-L193 WeakPolarHBondContact O-CB 3.39Å; E190-L193 PolarHBondContact O-N 2.87Å; Q191-L193 VanDerWaalsContact C-N 3.29Å; Q191-L193 PolarHBondContact O-N 3.34Å; L193-S196 WeakPolarHBondContact O-CB 3.38Å; L193-S196 PolarHBondContact O-N 2.95Å; L193-Q197 WeakPolarHBondContact O-CG 3.47Å; L193-Q197 PolarHBondContact O-N 2.96Å
194	L	93.3	Very high	91.2	Very high	103 Å²	103	98.8 Å²	98.8	54%	0.539	51%	0.512	S	S	.	.	H	α-helix	trans	-63.1	-46.1	177.3	-71.8	171.7	0	0	0	111.7	E190 Q191 S196 Q197 E198	E190-L194 WeakPolarHBondContact O-CG 3.38Å; E190-L194 PolarHBondContact O-N 3.09Å; Q191-L194 PolarHBondContact O-N 2.99Å; L194-S196 VanDerWaalsContact C-N 3.28Å; L194-S196 PolarHBondContact O-N 3.44Å; L194-Q197 WeakPolarHBondContact O-CB 3.35Å; L194-Q197 PolarHBondContact O-N 3.48Å; L194-Q197 VanDerWaalsContact O-N 3.11Å; L194-E198 WeakPolarHBondContact O-CG 3.45Å; L194-E198 PolarHBondContact O-N 3.25Å
195	A	91	Very high	91.8	Very high	49 Å²	49	97.6 Å²	97.6	41%	0.405	50%	0.504	S	S	.	.	H	α-helix	trans	-61.2	-37.9	176.9	0	0	0	0	0	112.2	Q191 E192 T199	Q191-A195 PolarHBondContact O-N 2.95Å; E192-A195 PolarHBondContact O-N 3.36Å; A195-T199 PolarHBondContact O-N 3.45Å; A195-T199 PolarHBondContact O-OG1 3.05Å
196	S	91.1	Very high	92.4	Very high	67 Å²	67	98.5 Å²	98.5	47%	0.469	51%	0.506	S	S	.	.	H	α-helix	trans	-63.8	-44.2	173.3	-175	0	0	0	0	111.5	E192 L193 L194 E198 T199 V200	E192-S196 WeakPolarHBondContact O-CB 3.36Å; E192-S196 PolarHBondContact O-N 3.13Å; L193-S196 WeakPolarHBondContact O-CB 3.38Å; L193-S196 PolarHBondContact O-N 2.95Å; L194-S196 VanDerWaalsContact C-N 3.28Å; L194-S196 PolarHBondContact O-N 3.44Å; S196-E198 PolarHBondContact O-N 3.15Å; S196-T199 PolarHBondContact O-N 2.91Å; S196-V200 WeakPolarHBondContact O-CG2 3.39Å; S196-V200 PolarHBondContact O-N 3.45Å
197	Q	93.3	Very high	93	Very high	108 Å²	108	98.8 Å²	98.8	51%	0.505	51%	0.511	S	S	.	.	H	α-helix	trans	-61.4	-42.9	176.5	-73	176.9	16.3	0	0	112.6	L193 L194 T199 V200 Q201	L193-Q197 WeakPolarHBondContact O-CG 3.47Å; L193-Q197 PolarHBondContact O-N 2.96Å; L194-Q197 WeakPolarHBondContact O-CB 3.35Å; L194-Q197 PolarHBondContact O-N 3.48Å; L194-Q197 VanDerWaalsContact O-N 3.11Å; Q197-T199 VanDerWaalsContact C-N 3.35Å; Q197-T199 PolarHBondContact O-N 3.48Å; Q197-V200 PolarHBondContact O-N 3.28Å; Q197-Q201 PolarHBondContact O-N 3.27Å
198	E	93.6	Very high	93.5	Very high	132 Å²	132	104.4 Å²	104.4	62%	0.617	52%	0.521	S	S	*	.	H	α-helix	trans	-60.4	-45.1	174.8	-70.7	-178.9	162.8	0	0	111.4	L194 S196 V200 Q201 V202	L194-E198 WeakPolarHBondContact O-CG 3.45Å; L194-E198 PolarHBondContact O-N 3.25Å; S196-E198 PolarHBondContact O-N 3.15Å; E198-V200 VanDerWaalsContact C-N 3.34Å; E198-V200 PolarHBondContact O-N 3.36Å; E198-Q201 WeakPolarHBondContact O-CB 3.35Å; E198-Q201 PolarHBondContact O-N 2.91Å; E198-V202 WeakPolarHBondContact O-CG2 3.38Å; E198-V202 PolarHBondContact O-N 3.48Å
199	T	94.4	Very high	94	Very high	80 Å²	80	105.9 Å²	105.9	49%	0.491	52%	0.521	S	S	.	.	H	α-helix	trans	-60.9	-44.6	177.3	-59.3	0	0	0	0	111.2	A195 S196 Q197 Q201 V202 L203	A195-T199 PolarHBondContact O-N 3.45Å; A195-T199 PolarHBondContact O-OG1 3.05Å; S196-T199 PolarHBondContact O-N 2.91Å; Q197-T199 VanDerWaalsContact C-N 3.35Å; Q197-T199 PolarHBondContact O-N 3.48Å; T199-Q201 VanDerWaalsContact C-N 3.31Å; T199-Q201 PolarHBondContact O-N 2.98Å; T199-V202 PolarHBondContact O-N 3.08Å; T199-L203 HydrophobicContact CG2-CD1 4.19Å; T199-L203 VanDerWaalsContact O-CG 3.31Å; T199-L203 WeakPolarHBondContact O-CG 3.47Å; T199-L203 PolarHBondContact O-N 2.87Å
200	V	96.9	Very high	94.4	Very high	68 Å²	68	105.6 Å²	105.6	41%	0.412	53%	0.525	S	S	.	.	H	α-helix	trans	-60.4	-42.2	176	169.7	0	0	0	0	110.8	S196 Q197 E198 L203 Q204	S196-V200 WeakPolarHBondContact O-CG2 3.39Å; S196-V200 PolarHBondContact O-N 3.45Å; Q197-V200 PolarHBondContact O-N 3.28Å; E198-V200 VanDerWaalsContact C-N 3.34Å; E198-V200 PolarHBondContact O-N 3.36Å; V200-L203 PolarHBondContact O-N 3.15Å; V200-Q204 HydrophobicContact CG1-CG 4.35Å; V200-Q204 VanDerWaalsContact O-CG 3.31Å; V200-Q204 WeakPolarHBondContact O-CG 3.38Å; V200-Q204 PolarHBondContact O-N 3.42Å
201	Q	95.8	Very high	94.7	Very high	118 Å²	118	105.2 Å²	105.2	55%	0.551	52%	0.523	S	S	*	.	H	α-helix	trans	-63	-43.8	178.1	-165.8	-175.3	46.9	0	0	111.8	Q197 E198 T199 L203 Q204 M205	Q197-Q201 PolarHBondContact O-N 3.27Å; E198-Q201 WeakPolarHBondContact O-CB 3.35Å; E198-Q201 PolarHBondContact O-N 2.91Å; T199-Q201 VanDerWaalsContact C-N 3.31Å; T199-Q201 PolarHBondContact O-N 2.98Å; Q201-L203 VanDerWaalsContact C-N 3.33Å; Q201-L203 PolarHBondContact O-N 3.44Å; Q201-Q204 PolarHBondContact O-N 3Å; Q201-M205 HydrophobicContact CG-CE 4.5Å; Q201-M205 WeakPolarHBondContact O-CG 3.31Å; Q201-M205 PolarHBondContact O-N 3.29Å
202	V	96.8	Very high	95	Very high	67 Å²	67	102.6 Å²	102.6	41%	0.406	51%	0.511	S	S	.	.	H	α-helix	trans	-61.2	-43.6	175.2	172.5	0	0	0	0	111	E198 T199 M205 K206	E198-V202 WeakPolarHBondContact O-CG2 3.38Å; E198-V202 PolarHBondContact O-N 3.48Å; T199-V202 PolarHBondContact O-N 3.08Å; V202-M205 HydrophobicContact CG2-CE 4.34Å; V202-M205 PolarHBondContact O-N 3.03Å; V202-K206 HydrophobicContact CG1-CD 4.38Å; V202-K206 WeakPolarHBondContact O-CG 3.39Å; V202-K206 PolarHBondContact O-N 3.38Å
203	L	96.6	Very high	95.4	Very high	95 Å²	95	100.2 Å²	100.2	50%	0.497	50%	0.502	S	S	.	.	H	α-helix	trans	-63.9	-42.5	176.9	-70.6	174.4	0	0	0	111.8	T199 V200 Q201 M205 K206 V207	T199-L203 HydrophobicContact CG2-CD1 4.19Å; T199-L203 VanDerWaalsContact O-CG 3.31Å; T199-L203 WeakPolarHBondContact O-CG 3.47Å; T199-L203 PolarHBondContact O-N 2.87Å; V200-L203 PolarHBondContact O-N 3.15Å; Q201-L203 VanDerWaalsContact C-N 3.33Å; Q201-L203 PolarHBondContact O-N 3.44Å; L203-M205 VanDerWaalsContact C-N 3.32Å; L203-M205 PolarHBondContact O-N 2.84Å; L203-K206 WeakPolarHBondContact O-CB 3.37Å; L203-K206 PolarHBondContact O-N 3.01Å; L203-K206 VanDerWaalsContact O-N 3.15Å; L203-V207 WeakPolarHBondContact O-CG2 3.38Å; L203-V207 PolarHBondContact O-N 2.91Å
204	Q	94.9	Very high	95.6	Very high	100 Å²	100	100.4 Å²	100.4	47%	0.467	50%	0.503	S	S	.	.	H	α-helix	trans	-59.2	-43	175.3	-75.2	178.4	1	0	0	111.8	V200 Q201 V207 R208	V200-Q204 HydrophobicContact CG1-CG 4.35Å; V200-Q204 VanDerWaalsContact O-CG 3.31Å; V200-Q204 WeakPolarHBondContact O-CG 3.38Å; V200-Q204 PolarHBondContact O-N 3.42Å; Q201-Q204 PolarHBondContact O-N 3Å; Q204-V207 PolarHBondContact O-N 2.9Å; Q204-R208 WeakPolarHBondContact O-CG 3.36Å; Q204-R208 PolarHBondContact O-N 3.05Å
205	M	94.3	Very high	95.8	Very high	109 Å²	109	101.1 Å²	101.1	54%	0.537	50%	0.503	S	S	.	.	H	α-helix	trans	-62.4	-42.1	174.7	-71.2	-169.8	-76	0	0	112	Q201 V202 L203 R208 R209	Q201-M205 HydrophobicContact CG-CE 4.5Å; Q201-M205 WeakPolarHBondContact O-CG 3.31Å; Q201-M205 PolarHBondContact O-N 3.29Å; V202-M205 HydrophobicContact CG2-CE 4.34Å; V202-M205 PolarHBondContact O-N 3.03Å; L203-M205 VanDerWaalsContact C-N 3.32Å; L203-M205 PolarHBondContact O-N 2.84Å; M205-R208 PolarHBondContact O-N 2.95Å; M205-R209 PolarHBondContact O-N 3.27Å
206	K	96.3	Very high	96.1	Very high	128 Å²	128	103.3 Å²	103.3	56%	0.557	51%	0.507	S	S	*	.	H	α-helix	trans	-62.9	-43	176.1	-74.1	179	179.2	179.8	0	112.2	V202 L203 R209 L210	V202-K206 HydrophobicContact CG1-CD 4.38Å; V202-K206 WeakPolarHBondContact O-CG 3.39Å; V202-K206 PolarHBondContact O-N 3.38Å; L203-K206 WeakPolarHBondContact O-CB 3.37Å; L203-K206 PolarHBondContact O-N 3.01Å; L203-K206 VanDerWaalsContact O-N 3.15Å; K206-R209 PolarHBondContact O-N 3.36Å; K206-L210 WeakPolarHBondContact O-CG 3.42Å; K206-L210 PolarHBondContact O-N 3.49Å
207	V	97.5	Very high	96.4	Very high	75 Å²	75	106.9 Å²	106.9	46%	0.455	52%	0.515	S	S	.	.	H	α-helix	trans	-59.6	-50.9	176.6	170.6	0	0	0	0	110.4	L203 Q204 R209 L210 E211	L203-V207 WeakPolarHBondContact O-CG2 3.38Å; L203-V207 PolarHBondContact O-N 2.91Å; Q204-V207 PolarHBondContact O-N 2.9Å; V207-R209 VanDerWaalsContact C-N 3.27Å; V207-R209 PolarHBondContact O-N 3.45Å; V207-L210 PolarHBondContact O-N 2.99Å; V207-L210 VanDerWaalsContact O-N 3.08Å; V207-E211 HydrophobicContact CG1-CG 4.33Å; V207-E211 WeakPolarHBondContact O-CG 3.18Å; V207-E211 PolarHBondContact O-N 3.25Å
208	R	97.3	Very high	96.6	Very high	169 Å²	169	105.4 Å²	105.4	64%	0.638	51%	0.51	S	S	*	.	H	α-helix	trans	-57.3	-40.2	177.4	-69	177.4	-173.4	176.6	3.6	112.5	Q204 M205 E211 H212	Q204-R208 WeakPolarHBondContact O-CG 3.36Å; Q204-R208 PolarHBondContact O-N 3.05Å; M205-R208 PolarHBondContact O-N 2.95Å; R208-E211 PolarHBondContact O-N 3.24Å; R208-H212 WeakPolarHBondContact O-CB 3.5Å; R208-H212 PolarHBondContact O-N 3.23Å
209	R	96.8	Very high	96.8	Very high	158 Å²	158	103.6 Å²	103.6	60%	0.596	51%	0.508	S	S	*	.	H	α-helix	trans	-64.5	-42.9	176.9	-179.3	59.4	175.9	-167	0	111.9	M205 K206 V207 H212 L213	M205-R209 PolarHBondContact O-N 3.27Å; K206-R209 PolarHBondContact O-N 3.36Å; V207-R209 VanDerWaalsContact C-N 3.27Å; V207-R209 PolarHBondContact O-N 3.45Å; R209-H212 PolarHBondContact O-N 3.23Å; R209-L213 HydrophobicContact CG-CD1 4.45Å; R209-L213 WeakPolarHBondContact O-CG 3.32Å; R209-L213 PolarHBondContact O-N 3.08Å
210	L	98.1	Very high	96.9	Very high	115 Å²	115	106.5 Å²	106.5	60%	0.602	51%	0.51	S	S	*	.	H	α-helix	trans	-65.8	-42.6	177.7	-71.6	172.7	0	0	0	111.6	K206 V207 H212 L213 L214	K206-L210 WeakPolarHBondContact O-CG 3.42Å; K206-L210 PolarHBondContact O-N 3.49Å; V207-L210 PolarHBondContact O-N 2.99Å; V207-L210 VanDerWaalsContact O-N 3.08Å; L210-H212 VanDerWaalsContact C-N 3.33Å; L210-H212 PolarHBondContact O-N 3.48Å; L210-L213 PolarHBondContact O-N 3.48Å; L210-L214 WeakPolarHBondContact O-CB 3.42Å; L210-L214 PolarHBondContact O-N 3.44Å
211	E	96.9	Very high	96.9	Very high	112 Å²	112	107.9 Å²	107.9	52%	0.523	51%	0.514	S	S	.	.	H	α-helix	trans	-58.7	-45.1	175.1	-71.7	172.7	158.9	0	0	111.4	V207 R208 L213 L214 Q215	V207-E211 HydrophobicContact CG1-CG 4.33Å; V207-E211 WeakPolarHBondContact O-CG 3.18Å; V207-E211 PolarHBondContact O-N 3.25Å; R208-E211 PolarHBondContact O-N 3.24Å; E211-L213 PolarHBondContact O-N 3.24Å; E211-L214 PolarHBondContact O-N 3.43Å; E211-Q215 WeakPolarHBondContact O-CG 3.43Å; E211-Q215 PolarHBondContact O-N 3.45Å
212	H	97.3	Very high	97	Very high	85 Å²	85	107 Å²	107	39%	0.394	51%	0.51	S	S	.	.	H	α-helix	trans	-62	-43.2	176	-176.6	63	0	0	0	112.6	R208 R209 L210 L214 Q215 L216	R208-H212 WeakPolarHBondContact O-CB 3.5Å; R208-H212 PolarHBondContact O-N 3.23Å; R209-H212 PolarHBondContact O-N 3.23Å; L210-H212 VanDerWaalsContact C-N 3.33Å; L210-H212 PolarHBondContact O-N 3.48Å; H212-L214 VanDerWaalsContact C-N 3.3Å; H212-L214 PolarHBondContact O-N 3.45Å; H212-Q215 WeakPolarHBondContact O-CB 3.49Å; H212-Q215 PolarHBondContact O-N 3.01Å; H212-L216 WeakPolarHBondContact O-CG 3.49Å; H212-L216 PolarHBondContact O-N 3.49Å
213	L	98.1	Very high	97	Very high	69 Å²	69	106.1 Å²	106.1	36%	0.361	50%	0.503	S	S	.	.	H	α-helix	trans	-63.5	-37.9	176.2	-73.3	173	0	0	0	112.1	R209 L210 E211 L216 K217	R209-L213 HydrophobicContact CG-CD1 4.45Å; R209-L213 WeakPolarHBondContact O-CG 3.32Å; R209-L213 PolarHBondContact O-N 3.08Å; L210-L213 PolarHBondContact O-N 3.48Å; E211-L213 PolarHBondContact O-N 3.24Å; L213-L216 PolarHBondContact O-N 3.38Å; L213-K217 WeakPolarHBondContact O-CG 3.27Å; L213-K217 PolarHBondContact O-N 3.32Å
214	L	97.5	Very high	97	Very high	102 Å²	102	105.7 Å²	105.7	53%	0.534	50%	0.5	S	S	.	.	H	α-helix	trans	-66.5	-42.6	176.7	-171.7	141.7	0	0	0	111.1	L210 E211 H212 L216 K217 N218	L210-L214 WeakPolarHBondContact O-CB 3.42Å; L210-L214 PolarHBondContact O-N 3.44Å; E211-L214 PolarHBondContact O-N 3.43Å; H212-L214 VanDerWaalsContact C-N 3.3Å; H212-L214 PolarHBondContact O-N 3.45Å; L214-L216 PolarHBondContact O-N 3.04Å; L214-K217 PolarHBondContact O-N 3.14Å; L214-N218 WeakPolarHBondContact CD2-ND2 3.27Å; L214-N218 VanDerWaalsContact O-CG 3.31Å; L214-N218 PolarHBondContact O-N 3.22Å
215	Q	97.4	Very high	97.1	Very high	117 Å²	117	103.6 Å²	103.6	55%	0.547	50%	0.497	S	S	.	.	H	α-helix	trans	-57.7	-47.9	172.8	-73.9	174.4	-14.1	0	0	111.9	E211 H212 K217 N218 V219	E211-Q215 WeakPolarHBondContact O-CG 3.43Å; E211-Q215 PolarHBondContact O-N 3.45Å; H212-Q215 WeakPolarHBondContact O-CB 3.49Å; H212-Q215 PolarHBondContact O-N 3.01Å; Q215-K217 VanDerWaalsContact C-N 3.32Å; Q215-K217 PolarHBondContact O-N 3.45Å; Q215-N218 PolarHBondContact O-N 3.3Å; Q215-V219 WeakPolarHBondContact O-CG2 3.21Å; Q215-V219 PolarHBondContact O-N 3.03Å
216	L	97.8	Very high	97.2	Very high	95 Å²	95	105.2 Å²	105.2	50%	0.497	50%	0.497	S	S	.	.	H	α-helix	trans	-60.2	-41.5	177.5	-71.3	174.4	0	0	0	112.2	H212 L213 L214 V219 R220	H212-L216 WeakPolarHBondContact O-CG 3.49Å; H212-L216 PolarHBondContact O-N 3.49Å; L213-L216 PolarHBondContact O-N 3.38Å; L214-L216 PolarHBondContact O-N 3.04Å; L216-V219 PolarHBondContact O-N 2.87Å; L216-R220 WeakPolarHBondContact O-CB 3.35Å; L216-R220 PolarHBondContact O-N 3.03Å
217	K	97.6	Very high	97.2	Very high	143 Å²	143	106.3 Å²	106.3	62%	0.622	50%	0.498	S	S	*	.	H	α-helix	trans	-62.6	-43.1	175.4	-76.2	172.9	179.9	-77.6	0	111.5	L213 L214 Q215 R220 I221	L213-K217 WeakPolarHBondContact O-CG 3.27Å; L213-K217 PolarHBondContact O-N 3.32Å; L214-K217 PolarHBondContact O-N 3.14Å; Q215-K217 VanDerWaalsContact C-N 3.32Å; Q215-K217 PolarHBondContact O-N 3.45Å; K217-R220 PolarHBondContact O-N 3.18Å; K217-I221 VanDerWaalsContact O-CG1 3.27Å; K217-I221 WeakPolarHBondContact O-CG1 3.5Å; K217-I221 PolarHBondContact O-N 3.26Å
218	N	96.4	Very high	97.1	Very high	76 Å²	76	107.6 Å²	107.6	41%	0.406	50%	0.502	S	S	.	.	H	α-helix	trans	-62.1	-46.8	177.8	-70.1	-14.8	0	0	0	111.8	L214 Q215 R220 I221 E222	L214-N218 WeakPolarHBondContact CD2-ND2 3.27Å; L214-N218 VanDerWaalsContact O-CG 3.31Å; L214-N218 PolarHBondContact O-N 3.22Å; Q215-N218 PolarHBondContact O-N 3.3Å; N218-R220 VanDerWaalsContact C-N 3.25Å; N218-R220 PolarHBondContact O-N 2.93Å; N218-I221 PolarHBondContact O-N 3.48Å; N218-I221 VanDerWaalsContact O-N 3.14Å; N218-E222 WeakPolarHBondContact O-CG 3.4Å; N218-E222 PolarHBondContact O-N 2.99Å
219	V	97.7	Very high	96.9	Very high	94 Å²	94	104.6 Å²	104.6	57%	0.57	50%	0.495	S	S	*	.	H	α-helix	trans	-56.5	-42.7	174.9	171.7	0	0	0	0	111	Q215 L216 E222 D223	Q215-V219 WeakPolarHBondContact O-CG2 3.21Å; Q215-V219 PolarHBondContact O-N 3.03Å; L216-V219 PolarHBondContact O-N 2.87Å; V219-E222 PolarHBondContact O-N 2.92Å; V219-D223 PolarHBondContact O-N 3.44Å
220	R	97.2	Very high	96.8	Very high	141 Å²	141	102.7 Å²	102.7	53%	0.532	49%	0.493	S	S	.	.	H	α-helix	trans	-67.3	-40.3	178.5	-173.7	55.1	169.1	178.3	-6.8	112.6	L216 K217 N218 E222 D223 L224	L216-R220 WeakPolarHBondContact O-CB 3.35Å; L216-R220 PolarHBondContact O-N 3.03Å; K217-R220 PolarHBondContact O-N 3.18Å; N218-R220 VanDerWaalsContact C-N 3.25Å; N218-R220 PolarHBondContact O-N 2.93Å; R220-E222 VanDerWaalsContact C-N 3.33Å; R220-D223 IonicContact NH1-OD2 3.23Å; R220-D223 PolarHBondContact NH1-OD2 3.34Å; R220-D223 PolarHBondContact O-N 3.4Å; R220-L224 HydrophobicContact CG-CD1 4.2Å; R220-L224 WeakPolarHBondContact O-CB 3.36Å; R220-L224 VanDerWaalsContact O-CG 3.32Å; R220-L224 WeakPolarHBondContact O-CG 3.45Å; R220-L224 PolarHBondContact O-N 3.05Å
221	I	97.7	Very high	96.5	Very high	97 Å²	97	99.8 Å²	99.8	50%	0.497	49%	0.485	S	S	.	.	H	α-helix	trans	-61.2	-45.3	175.7	-71.6	164.5	0	0	0	109.7	K217 N218 L224 S225	K217-I221 VanDerWaalsContact O-CG1 3.27Å; K217-I221 WeakPolarHBondContact O-CG1 3.5Å; K217-I221 PolarHBondContact O-N 3.26Å; N218-I221 PolarHBondContact O-N 3.48Å; N218-I221 VanDerWaalsContact O-N 3.14Å; I221-L224 PolarHBondContact O-N 3.38Å; I221-S225 VanDerWaalsContact O-CB 3.26Å; I221-S225 WeakPolarHBondContact O-CB 3.26Å; I221-S225 PolarHBondContact O-N 3.04Å; I221-S225 PolarHBondContact O-OG 2.92Å
222	E	97.2	Very high	96.2	Very high	99 Å²	99	99.4 Å²	99.4	46%	0.463	48%	0.484	S	S	.	.	H	α-helix	trans	-61.2	-45.6	177.5	-72.6	-179.5	-157.6	0	0	113.2	N218 V219 R220 S225 R226	N218-E222 WeakPolarHBondContact O-CG 3.4Å; N218-E222 PolarHBondContact O-N 2.99Å; V219-E222 PolarHBondContact O-N 2.92Å; R220-E222 VanDerWaalsContact C-N 3.33Å; E222-S225 PolarHBondContact O-N 3.25Å; E222-R226 VanDerWaalsContact O-CG 3.31Å; E222-R226 WeakPolarHBondContact O-CG 3.41Å; E222-R226 PolarHBondContact O-N 3.31Å; E222-R226 IonicContact OE2-NH2 3.13Å; E222-R226 PolarHBondContact OE2-NH2 3.32Å
223	D	97.4	Very high	95.7	Very high	49 Å²	49	104.4 Å²	104.4	26%	0.262	50%	0.499	S	S	.	.	H	α-helix	trans	-59.2	-47.8	176.2	172.9	54.1	0	0	0	111.2	V219 R220 S225 R226 R227	V219-D223 PolarHBondContact O-N 3.44Å; R220-D223 IonicContact NH1-OD2 3.23Å; R220-D223 PolarHBondContact NH1-OD2 3.34Å; R220-D223 PolarHBondContact O-N 3.4Å; D223-S225 VanDerWaalsContact C-N 3.34Å; D223-S225 PolarHBondContact O-N 2.91Å; D223-R226 PolarHBondContact O-N 2.68Å; D223-R227 WeakPolarHBondContact O-CG 3.47Å; D223-R227 PolarHBondContact O-N 3.39Å; D223-R227 IonicContact OD1-CZ 3.59Å; D223-R227 IonicContact OD1-NE 2.9Å; D223-R227 PolarHBondContact OD1-NE 2.83Å; D223-R227 IonicContact OD1-NH2 3.43Å; D223-R227 PolarHBondContact OD1-NH2 3.45Å; D223-R227 IonicContact OD2-CZ 3.46Å; D223-R227 IonicContact OD2-NE 2.98Å; D223-R227 PolarHBondContact OD2-NE 2.98Å; D223-R227 IonicContact OD2-NH2 3.34Å; D223-R227 PolarHBondContact OD2-NH2 3.29Å
224	L	97	Very high	94.8	Very high	86 Å²	86	109.8 Å²	109.8	45%	0.45	52%	0.519	S	S	.	.	H	α-helix	trans	-63.6	-40.6	177.6	-69.6	175.3	0	0	0	111.9	R220 I221 R227 L228	R220-L224 HydrophobicContact CG-CD1 4.2Å; R220-L224 WeakPolarHBondContact O-CB 3.36Å; R220-L224 VanDerWaalsContact O-CG 3.32Å; R220-L224 WeakPolarHBondContact O-CG 3.45Å; R220-L224 PolarHBondContact O-N 3.05Å; I221-L224 PolarHBondContact O-N 3.38Å; L224-R227 PolarHBondContact O-N 2.91Å; L224-L228 WeakPolarHBondContact O-CB 3.39Å; L224-L228 PolarHBondContact O-N 3.46Å
225	S	96.1	Very high	93.4	Very high	56 Å²	56	113.3 Å²	113.3	39%	0.392	53%	0.533	S	S	.	.	H	α-helix	trans	-64.9	-41.2	179.4	-58.6	0	0	0	0	111.3	I221 E222 D223 L228 Q229	I221-S225 VanDerWaalsContact O-CB 3.26Å; I221-S225 WeakPolarHBondContact O-CB 3.26Å; I221-S225 PolarHBondContact O-N 3.04Å; I221-S225 PolarHBondContact O-OG 2.92Å; E222-S225 PolarHBondContact O-N 3.25Å; D223-S225 VanDerWaalsContact C-N 3.34Å; D223-S225 PolarHBondContact O-N 2.91Å; S225-L228 PolarHBondContact O-N 3.16Å; S225-Q229 WeakPolarHBondContact O-CG 3.33Å; S225-Q229 PolarHBondContact O-N 2.94Å
226	R	96.8	Very high	91.5	Very high	143 Å²	143	121 Å²	121	54%	0.54	56%	0.557	S	S	.	*	H	α-helix	trans	-62	-45.3	173.9	-73.2	176.9	-137.1	-116.2	3.2	111.6	E222 D223 L228 Q229 Q230	E222-R226 VanDerWaalsContact O-CG 3.31Å; E222-R226 WeakPolarHBondContact O-CG 3.41Å; E222-R226 PolarHBondContact O-N 3.31Å; E222-R226 IonicContact OE2-NH2 3.13Å; E222-R226 PolarHBondContact OE2-NH2 3.32Å; D223-R226 PolarHBondContact O-N 2.68Å; R226-L228 VanDerWaalsContact C-N 3.33Å; R226-L228 PolarHBondContact O-N 3.14Å; R226-Q229 PolarHBondContact O-N 3.45Å; R226-Q230 WeakPolarHBondContact O-CG 3.31Å; R226-Q230 PolarHBondContact O-N 3.16Å
227	R	95.9	Very high	91.2	Very high	151 Å²	151	122.3 Å²	122.3	57%	0.57	56%	0.56	S	S	*	*	H	α-helix	trans	-62.6	-41.1	178.1	-70.1	170.9	-171.2	-121.6	1.4	111.7	D223 L224 Q230 A231	D223-R227 WeakPolarHBondContact O-CG 3.47Å; D223-R227 PolarHBondContact O-N 3.39Å; D223-R227 IonicContact OD1-CZ 3.59Å; D223-R227 IonicContact OD1-NE 2.9Å; D223-R227 PolarHBondContact OD1-NE 2.83Å; D223-R227 IonicContact OD1-NH2 3.43Å; D223-R227 PolarHBondContact OD1-NH2 3.45Å; D223-R227 IonicContact OD2-CZ 3.46Å; D223-R227 IonicContact OD2-NE 2.98Å; D223-R227 PolarHBondContact OD2-NE 2.98Å; D223-R227 IonicContact OD2-NH2 3.34Å; D223-R227 PolarHBondContact OD2-NH2 3.29Å; L224-R227 PolarHBondContact O-N 2.91Å; R227-Q230 PolarHBondContact O-N 2.95Å; R227-A231 PolarHBondContact O-N 3.36Å
228	L	94.6	Very high	90.9	Very high	103 Å²	103	121.2 Å²	121.2	54%	0.539	56%	0.557	S	S	.	*	H	α-helix	trans	-65.6	-46.1	179.8	-158.3	146.2	0	0	0	110.9	L224 S225 R226 Q230 A231 E232	L224-L228 WeakPolarHBondContact O-CB 3.39Å; L224-L228 PolarHBondContact O-N 3.46Å; S225-L228 PolarHBondContact O-N 3.16Å; R226-L228 VanDerWaalsContact C-N 3.33Å; R226-L228 PolarHBondContact O-N 3.14Å; L228-Q230 VanDerWaalsContact C-N 3.32Å; L228-Q230 PolarHBondContact O-N 3.49Å; L228-A231 PolarHBondContact O-N 3.32Å; L228-A231 VanDerWaalsContact O-N 3.16Å; L228-E232 HydrophobicContact CD2-CG 4.2Å; L228-E232 WeakPolarHBondContact CD2-OE1 3.32Å; L228-E232 WeakPolarHBondContact O-CG 3.27Å; L228-E232 PolarHBondContact O-N 3Å
229	Q	94.4	Very high	90.6	Very high	105 Å²	105	123.7 Å²	123.7	49%	0.491	57%	0.565	S	S	.	*	H	α-helix	trans	-59.8	-39	173.4	-74.8	-178.5	-8.1	0	0	113	S225 R226 R233	S225-Q229 WeakPolarHBondContact O-CG 3.33Å; S225-Q229 PolarHBondContact O-N 2.94Å; R226-Q229 PolarHBondContact O-N 3.45Å; Q229-R233 WeakPolarHBondContact O-CB 3.44Å; Q229-R233 VanDerWaalsContact O-CG 3.27Å; Q229-R233 WeakPolarHBondContact O-CG 3.43Å; Q229-R233 PolarHBondContact O-N 3.15Å
230	Q	93.8	Very high	90.2	Very high	119 Å²	119	125.5 Å²	125.5	56%	0.556	57%	0.565	S	S	*	*	H	α-helix	trans	-66.9	-38.7	176.1	-73.8	176.1	6.7	0	0	112.2	R226 R227 L228 R233 K234	R226-Q230 WeakPolarHBondContact O-CG 3.31Å; R226-Q230 PolarHBondContact O-N 3.16Å; R227-Q230 PolarHBondContact O-N 2.95Å; L228-Q230 VanDerWaalsContact C-N 3.32Å; L228-Q230 PolarHBondContact O-N 3.49Å; Q230-R233 PolarHBondContact O-N 3.02Å; Q230-K234 WeakPolarHBondContact O-CG 3.4Å; Q230-K234 PolarHBondContact O-N 3.48Å; Q230-K234 VanDerWaalsContact O-N 3.14Å
231	A	91.9	Very high	89.7	Confident	54 Å²	54	124.5 Å²	124.5	45%	0.446	57%	0.567	S	S	.	*	H	α-helix	trans	-66.1	-43.8	176.1	0	0	0	0	0	111.6	R227 L228 R233 K234 Q235	R227-A231 PolarHBondContact O-N 3.36Å; L228-A231 PolarHBondContact O-N 3.32Å; L228-A231 VanDerWaalsContact O-N 3.16Å; A231-R233 VanDerWaalsContact C-N 3.33Å; A231-R233 PolarHBondContact O-N 3.01Å; A231-K234 PolarHBondContact O-N 3.4Å; A231-K234 VanDerWaalsContact O-N 3.16Å; A231-Q235 PolarHBondContact O-N 3.45Å; A231-Q235 VanDerWaalsContact O-N 3.15Å
232	E	90.8	Very high	89.2	Confident	104 Å²	104	126.3 Å²	126.3	49%	0.486	57%	0.572	S	S	.	*	H	α-helix	trans	-62.2	-39.4	175.7	-72.4	178.4	160.8	0	0	112.3	L228 K234 Q235 R236	L228-E232 HydrophobicContact CD2-CG 4.2Å; L228-E232 WeakPolarHBondContact CD2-OE1 3.32Å; L228-E232 WeakPolarHBondContact O-CG 3.27Å; L228-E232 PolarHBondContact O-N 3Å; E232-K234 VanDerWaalsContact C-N 3.3Å; E232-K234 PolarHBondContact O-N 3.41Å; E232-Q235 PolarHBondContact O-N 3.29Å; E232-R236 PolarHBondContact O-N 2.9Å
233	R	86.3	Confident	88.6	Confident	190 Å²	190	128.3 Å²	128.3	72%	0.717	58%	0.579	S	S	*	*	H	α-helix	trans	-67.2	-28.2	175.2	-75.7	177.3	-176.2	-172.5	2.3	113.5	Q229 Q230 A231	Q229-R233 WeakPolarHBondContact O-CB 3.44Å; Q229-R233 VanDerWaalsContact O-CG 3.27Å; Q229-R233 WeakPolarHBondContact O-CG 3.43Å; Q229-R233 PolarHBondContact O-N 3.15Å; Q230-R233 PolarHBondContact O-N 3.02Å; A231-R233 VanDerWaalsContact C-N 3.33Å; A231-R233 PolarHBondContact O-N 3.01Å
234	K	79.4	Confident	87.9	Confident	181 Å²	181	134.4 Å²	134.4	79%	0.787	60%	0.604	S	S	*	*	H	α-helix	trans	-81.1	-18	175.8	-74.9	179.2	178.4	-176	0	113.2	Q230 A231 E232	Q230-K234 WeakPolarHBondContact O-CG 3.4Å; Q230-K234 PolarHBondContact O-N 3.48Å; Q230-K234 VanDerWaalsContact O-N 3.14Å; A231-K234 PolarHBondContact O-N 3.4Å; A231-K234 VanDerWaalsContact O-N 3.16Å; E232-K234 VanDerWaalsContact C-N 3.3Å; E232-K234 PolarHBondContact O-N 3.41Å
235	Q	69.3	Low	87.2	Confident	177 Å²	177	138.4 Å²	138.4	83%	0.827	62%	0.617	S	S	*	*	H	α-helix	trans	-89.3	-10.9	176.7	-84.8	-172.6	-12.3	0	0	113.8	A231 E232	A231-Q235 PolarHBondContact O-N 3.45Å; A231-Q235 VanDerWaalsContact O-N 3.15Å; E232-Q235 PolarHBondContact O-N 3.29Å
236	R	56.9	Low	86.4	Confident	278 Å²	278	145.9 Å²	145.9	100%	1.049	64%	0.637	S	S	*	*			trans	-99	0	172.4	-68.6	-175	-179.1	-165.6	0.8	110.2	E232	E232-R236 PolarHBondContact O-N 2.9Å

Retrieved 236 of 236 residues in 312.3 ms (Link to these results)

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