A0A096MPG9_PAPAN Loading...

Leucine rich repeats and IQ motif containing 3

AlphaFold DB , UniProt , Accession A0A096MPG9, Species PAPAN (Papio anubis, Olive baboon), Gene LRRIQ3, Length 623 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	25.8	Very low	33.4	Very low	221 Å²	221	117.9 Å²	117.9	100%	1.089	62%	0.619	S	S	*	*				0	80.3	0	-70.3	-179.4	-168	0	0	107.7
2	F	20.8	Very low	33.8	Very low	214 Å²	214	111.3 Å²	111.3	94%	0.939	59%	0.59	S	S	*	*			trans	-94.7	110.8	176	-85.3	-85.5	0	0	0	107.7	G4	F2-G4 PolarHBondContact O-N 3.01Å
3	H	27.4	Very low	34.4	Very low	164 Å²	164	112.5 Å²	112.5	76%	0.759	59%	0.59	S	S	*	*			trans	-79	100.3	174.6	-68.9	-38.2	0	0	0	108.6	T5	H3-T5 VanDerWaalsContact C-N 3.29Å; H3-T5 PolarHBondContact O-N 3.21Å
4	G	28.2	Very low	34.6	Very low	41 Å²	41	115.4 Å²	115.4	42%	0.423	60%	0.599	S	S	.	*			trans	-67.4	89.7	167.6	0	0	0	0	0	109.5	F2	F2-G4 PolarHBondContact O-N 3.01Å
5	T	35.4	Very low	35.2	Very low	106 Å²	106	113.5 Å²	113.5	65%	0.65	59%	0.586	S	S	*	*			trans	-83.4	103.1	162.5	35.1	0	0	0	0	106.2	H3 T7	H3-T5 VanDerWaalsContact C-N 3.29Å; H3-T5 PolarHBondContact O-N 3.21Å; T5-T7 VanDerWaalsContact C-N 3.27Å; T5-T7 PolarHBondContact O-N 3.5Å
6	I	36.8	Very low	35.7	Very low	62 Å²	62	109.7 Å²	109.7	32%	0.318	56%	0.562	S	S	.	*			trans	-69.2	101.7	159	-61.6	-170.8	0	0	0	105	E8 Y19 F30	I6-E8 VanDerWaalsContact C-N 3.35Å; I6-Y19 HydrophobicContact CD1-CD1 4.37Å; I6-Y19 HydrophobicContact CD1-CE1 3.67Å; I6-F30 HydrophobicContact CD1-CE1 3.52Å; I6-F30 HydrophobicContact CD1-CZ 4.14Å; I6-F30 HydrophobicContact CG1-CE1 3.96Å
7	T	36.4	Very low	36.1	Very low	121 Å²	121	106.7 Å²	106.7	74%	0.742	55%	0.553	S	S	*	*			trans	-89.9	-4.9	175.3	39.8	0	0	0	0	111.7	T5	T5-T7 VanDerWaalsContact C-N 3.27Å; T5-T7 PolarHBondContact O-N 3.5Å
8	E	38.8	Very low	36.2	Very low	145 Å²	145	107.8 Å²	107.8	68%	0.678	56%	0.555	S	S	*	*	S	Bend	trans	-90.7	120.4	179.4	-66.4	-176.6	169	0	0	110	I6 L10	I6-E8 VanDerWaalsContact C-N 3.35Å; E8-L10 PolarHBondContact O-N 3.36Å
9	E	37.5	Very low	36.4	Very low	87 Å²	87	106.5 Å²	106.5	41%	0.407	54%	0.543	S	S	.	.			trans	-64.8	99.2	170.3	-71.3	-170.5	144.5	0	0	107.9	T11 K34 G192	E9-T11 HydrophobicContact CB-CG2 4.33Å; E9-T11 PolarHBondContact O-N 3.12Å; E9-K34 IonicContact OE1-NZ 3.81Å; E9-K34 PolarHBondContact OE1-NZ 3.36Å; E9-G192 WeakPolarHBondContact OE1-CA 3.33Å; E9-G192 PolarHBondContact OE1-N 2.96Å
10	L	42.7	Very low	36.7	Very low	27 Å²	27	103.7 Å²	103.7	14%	0.141	53%	0.529	C	S	.	.			trans	-63.6	109.9	171.1	-70	168.8	0	0	0	108.1	E8 E15 Y19	E8-L10 PolarHBondContact O-N 3.36Å; L10-E15 HydrophobicContact CD2-CB 3.78Å; L10-E15 WeakPolarHBondContact CD2-OE2 3.4Å; L10-Y19 HydrophobicContact CD1-CD2 4.22Å; L10-Y19 HydrophobicContact CD1-CE2 4.37Å; L10-Y19 HydrophobicContact CD2-CD2 4.06Å; L10-Y19 HydrophobicContact CD2-CE2 3.84Å
11	T	38	Very low	36.7	Very low	109 Å²	109	105.1 Å²	105.1	67%	0.669	53%	0.534	S	S	*	.			trans	-110	-3.8	-172.4	41.1	0	0	0	0	112.7	E9	E9-T11 HydrophobicContact CB-CG2 4.33Å; E9-T11 PolarHBondContact O-N 3.12Å
12	S	37.5	Very low	37.2	Very low	38 Å²	38	99.1 Å²	99.1	27%	0.266	51%	0.506	S	S	.	.			trans	-128.6	151	-179.9	80.5	0	0	0	0	114	E14 E15	S12-E14 VanDerWaalsContact C-N 3.33Å; S12-E15 VanDerWaalsContact OG-CG 3.29Å; S12-E15 WeakPolarHBondContact OG-CG 3.42Å; S12-E15 PolarHBondContact OG-N 3.45Å; S12-E15 PolarHBondContact OG-OE1 3.05Å
13	H	41.3	Very low	38.2	Very low	127 Å²	127	92.2 Å²	92.2	59%	0.588	48%	0.478	S	S	*	.	H	α-helix	trans	-72.5	-22.6	178.8	-173.1	-74.8	0	0	0	112.7	S17	H13-S17 PolarHBondContact O-N 3.02Å
14	E	37.7	Very low	38.7	Very low	154 Å²	154	95.5 Å²	95.5	72%	0.72	48%	0.484	S	S	*	.	H	α-helix	trans	-77.1	-37.1	179.3	-80.5	177	155.4	0	0	112.9	S12 W16 S17 H18	S12-E14 VanDerWaalsContact C-N 3.33Å; E14-W16 PolarHBondContact O-N 2.84Å; E14-S17 PolarHBondContact O-N 3.13Å; E14-S17 PolarHBondContact O-OG 2.87Å; E14-H18 PolarHBondContact O-N 3.27Å
15	E	43.3	Very low	39.3	Very low	86 Å²	86	101.7 Å²	101.7	40%	0.402	50%	0.502	S	S	.	.	H	α-helix	trans	-63.1	-33	172.7	-70.4	160.4	-161.1	0	0	110.8	L10 S12 H18 Y19	L10-E15 HydrophobicContact CD2-CB 3.78Å; L10-E15 WeakPolarHBondContact CD2-OE2 3.4Å; S12-E15 VanDerWaalsContact OG-CG 3.29Å; S12-E15 WeakPolarHBondContact OG-CG 3.42Å; S12-E15 PolarHBondContact OG-N 3.45Å; S12-E15 PolarHBondContact OG-OE1 3.05Å; E15-H18 PolarHBondContact O-N 3.47Å; E15-Y19 WeakPolarHBondContact O-CD2 3.32Å; E15-Y19 PolarHBondContact O-N 3.1Å
16	W	44.1	Very low	39.6	Very low	53 Å²	53	100.8 Å²	100.8	20%	0.201	49%	0.493	C	S	.	.	H	α-helix	trans	-70.6	-35.3	180	-165.2	67.5	0	0	0	113.8	E14 Y19 N20 L40 N45	E14-W16 PolarHBondContact O-N 2.84Å; W16-Y19 PolarHBondContact O-N 2.88Å; W16-N20 PolarHBondContact O-N 2.96Å; W16-L40 HydrophobicContact CD2-CD2 4.44Å; W16-L40 HydrophobicContact CE3-CD2 4.34Å; W16-L40 HydrophobicContact CH2-CD2 3.97Å; W16-L40 HydrophobicContact CZ2-CD2 4.07Å; W16-L40 HydrophobicContact CZ3-CD2 4.11Å; W16-N45 WeakPolarHBondContact CH2-ND2 3.23Å; W16-N45 HydrophobicContact CZ2-CB 4.5Å; W16-N45 WeakPolarHBondContact CZ2-ND2 3.17Å
17	S	41.4	Very low	39.9	Very low	59 Å²	59	107.7 Å²	107.7	41%	0.413	52%	0.524	S	S	.	.	H	α-helix	trans	-65	-39.4	173.6	36.4	0	0	0	0	112.3	H13 E14 N20 E21	H13-S17 PolarHBondContact O-N 3.02Å; E14-S17 PolarHBondContact O-N 3.13Å; E14-S17 PolarHBondContact O-OG 2.87Å; S17-N20 PolarHBondContact O-N 3.29Å; S17-E21 PolarHBondContact O-N 2.89Å
18	H	38.4	Very low	40.4	Very low	127 Å²	127	107.4 Å²	107.4	59%	0.588	51%	0.512	S	S	*	.	H	α-helix	trans	-69.5	-31.7	175	-95.2	-60.5	0	0	0	112.8	E14 E15 E21 N22	E14-H18 PolarHBondContact O-N 3.27Å; E15-H18 PolarHBondContact O-N 3.47Å; H18-E21 IonicContact ND1-OE2 3.97Å; H18-N22 PolarHBondContact O-ND2 3.26Å
19	Y	40.2	Very low	41.2	Very low	83 Å²	83	105.7 Å²	105.7	33%	0.325	51%	0.508	S	S	.	.	H	α-helix	trans	-71.5	-33.3	172.3	-94.2	-82.4	0	0	0	113.1	I6 L10 E15 W16 E21 N22 I23	I6-Y19 HydrophobicContact CD1-CD1 4.37Å; I6-Y19 HydrophobicContact CD1-CE1 3.67Å; L10-Y19 HydrophobicContact CD1-CD2 4.22Å; L10-Y19 HydrophobicContact CD1-CE2 4.37Å; L10-Y19 HydrophobicContact CD2-CD2 4.06Å; L10-Y19 HydrophobicContact CD2-CE2 3.84Å; E15-Y19 WeakPolarHBondContact O-CD2 3.32Å; E15-Y19 PolarHBondContact O-N 3.1Å; W16-Y19 PolarHBondContact O-N 2.88Å; Y19-E21 VanDerWaalsContact C-N 3.26Å; Y19-E21 PolarHBondContact O-N 2.98Å; Y19-N22 PolarHBondContact O-N 3.18Å; Y19-N22 VanDerWaalsContact O-N 3.15Å; Y19-I23 VanDerWaalsContact O-CG1 3.25Å; Y19-I23 WeakPolarHBondContact O-CG1 3.33Å; Y19-I23 PolarHBondContact O-N 3.41Å
20	N	42.2	Very low	42.4	Very low	49 Å²	49	103.7 Å²	103.7	26%	0.262	50%	0.498	S	S	.	.	H	α-helix	trans	-61.9	-32.2	175.3	-83.2	-14.5	0	0	0	113.2	W16 S17 N45	W16-N20 PolarHBondContact O-N 2.96Å; S17-N20 PolarHBondContact O-N 3.29Å; N20-N45 VanDerWaalsContact CG-ND2 3.34Å; N20-N45 PolarHBondContact ND2-ND2 2.87Å; N20-N45 PolarHBondContact OD1-ND2 3.46Å
21	E	35.9	Very low	43.8	Very low	135 Å²	135	104.6 Å²	104.6	63%	0.631	51%	0.505	S	S	*	.	H	α-helix	trans	-69.8	-38.7	174	-67.2	-179.3	166.6	0	0	111.5	S17 H18 Y19	S17-E21 PolarHBondContact O-N 2.89Å; H18-E21 IonicContact ND1-OE2 3.97Å; Y19-E21 VanDerWaalsContact C-N 3.26Å; Y19-E21 PolarHBondContact O-N 2.98Å
22	N	36.6	Very low	45.7	Very low	95 Å²	95	101.6 Å²	101.6	51%	0.508	48%	0.482	S	S	.	.	H	α-helix	trans	-77	-16.3	177.4	-68.6	-37.1	0	0	0	114.6	H18 Y19 R24 E25	H18-N22 PolarHBondContact O-ND2 3.26Å; Y19-N22 PolarHBondContact O-N 3.18Å; Y19-N22 VanDerWaalsContact O-N 3.15Å; N22-R24 VanDerWaalsContact C-N 3.3Å; N22-R24 PolarHBondContact O-N 2.86Å; N22-E25 PolarHBondContact O-N 3.2Å
23	I	43.5	Very low	47.7	Very low	69 Å²	69	100.3 Å²	100.3	35%	0.354	47%	0.473	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-23.6	177.7	-76.9	165.4	0	0	0	112.2	Y19 E25	Y19-I23 VanDerWaalsContact O-CG1 3.25Å; Y19-I23 WeakPolarHBondContact O-CG1 3.33Å; Y19-I23 PolarHBondContact O-N 3.41Å; I23-E25 VanDerWaalsContact C-N 3.28Å; I23-E25 PolarHBondContact O-N 2.9Å
24	R	37.3	Very low	49.4	Very low	232 Å²	232	96.2 Å²	96.2	88%	0.875	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-21.1	178.6	-67.4	-175	83.1	-164.6	5.3	113.1	N22	N22-R24 VanDerWaalsContact C-N 3.3Å; N22-R24 PolarHBondContact O-N 2.86Å
25	E	41.2	Very low	51.2	Low	172 Å²	172	90.3 Å²	90.3	80%	0.804	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.9	-25.1	-173.6	-72.1	-174.9	160.5	0	0	114.6	N22 I23	N22-E25 PolarHBondContact O-N 3.2Å; I23-E25 VanDerWaalsContact C-N 3.28Å; I23-E25 PolarHBondContact O-N 2.9Å
26	D	40.1	Very low	52.8	Low	86 Å²	86	89.7 Å²	89.7	46%	0.46	43%	0.425	S	S	.	.			trans	-118	108.7	-175.6	-82.7	-19.5	0	0	0	113.6	K28	D26-K28 HydrophobicContact CB-CD 4.09Å; D26-K28 HydrophobicContact CB-CG 4.19Å; D26-K28 PolarHBondContact O-N 3.01Å; D26-K28 WeakPolarHBondContact OD2-CE 3.5Å; D26-K28 IonicContact OD2-NZ 2.88Å; D26-K28 PolarHBondContact OD2-NZ 3.45Å
27	Q	44.7	Very low	54.2	Low	208 Å²	208	89 Å²	89	97%	0.972	43%	0.433	S	S	*	.			trans	-63.8	74.5	162.2	-106.9	-179.4	-13.9	0	0	110.4
28	K	46.5	Very low	55.8	Low	115 Å²	115	87.2 Å²	87.2	50%	0.5	42%	0.42	S	S	.	.			trans	-94.9	117.8	174	-80.6	169.3	178.1	153.1	0	110.4	D26 F30	D26-K28 HydrophobicContact CB-CD 4.09Å; D26-K28 HydrophobicContact CB-CG 4.19Å; D26-K28 PolarHBondContact O-N 3.01Å; D26-K28 WeakPolarHBondContact OD2-CE 3.5Å; D26-K28 IonicContact OD2-NZ 2.88Å; D26-K28 PolarHBondContact OD2-NZ 3.45Å; K28-F30 HydrophobicContact CB-CE2 4.44Å; K28-F30 HydrophobicContact CB-CZ 4.43Å; K28-F30 VanDerWaalsContact O-CD2 3.24Å; K28-F30 WeakPolarHBondContact O-CD2 3.43Å; K28-F30 PolarHBondContact O-N 2.97Å
29	D	55.6	Low	57.6	Low	108 Å²	108	87 Å²	87	58%	0.578	42%	0.419	S	S	*	.			trans	-67.3	85.9	176.1	-85.3	-46.6	0	0	0	111.4	V31 S51	D29-V31 PolarHBondContact O-N 3.47Å; D29-S51 VanDerWaalsContact CG-OG 3.3Å; D29-S51 WeakPolarHBondContact OD1-CB 3.48Å; D29-S51 PolarHBondContact OD1-OG 2.91Å
30	F	62.8	Low	59.4	Low	45 Å²	45	83.8 Å²	83.8	20%	0.197	41%	0.407	C	S	.	.			trans	-65.5	121.7	172.5	-64.9	-75.2	0	0	0	110.7	I6 K28 V33 S51 L52	I6-F30 HydrophobicContact CD1-CE1 3.52Å; I6-F30 HydrophobicContact CD1-CZ 4.14Å; I6-F30 HydrophobicContact CG1-CE1 3.96Å; K28-F30 HydrophobicContact CB-CE2 4.44Å; K28-F30 HydrophobicContact CB-CZ 4.43Å; K28-F30 VanDerWaalsContact O-CD2 3.24Å; K28-F30 WeakPolarHBondContact O-CD2 3.43Å; K28-F30 PolarHBondContact O-N 2.97Å; F30-V33 HydrophobicContact CB-CG2 4.05Å; F30-S51 CarbonylContact O-C 3.41Å; F30-L52 WeakPolarHBondContact O-CA 3.33Å; F30-L52 PolarHBondContact O-N 3.29Å
31	V	71.5	Confident	61.1	Low	47 Å²	47	89.3 Å²	89.3	29%	0.285	43%	0.428	S	S	.	.			trans	-96.8	-31.5	177	-179.1	0	0	0	0	111.5	D29 R53 V54 Y195	D29-V31 PolarHBondContact O-N 3.47Å; V31-R53 HydrophobicContact CG1-CB 4.1Å; V31-R53 HydrophobicContact CG1-CG 3.99Å; V31-R53 PolarHBondContact O-N 3.5Å; V31-V54 PolarHBondContact O-N 3.05Å; V31-Y195 HydrophobicContact CG1-CD2 4.14Å; V31-Y195 HydrophobicContact CG1-CE1 4.31Å; V31-Y195 HydrophobicContact CG1-CE2 3.58Å
32	F	79	Confident	62.9	Low	45 Å²	45	84.9 Å²	84.9	20%	0.197	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	131.7	-176.8	177.4	-122.8	0	0	0	110.1	K34 V54 Y195 E198	F32-K34 HydrophobicContact CE1-CB 4.35Å; F32-K34 HydrophobicContact CZ-CB 4.04Å; F32-K34 HydrophobicContact CZ-CD 4.37Å; F32-V54 WeakPolarHBondContact CA-O 3.48Å; F32-V54 HydrophobicContact CD2-CB 3.84Å; F32-V54 HydrophobicContact CD2-CG1 3.74Å; F32-V54 HydrophobicContact CE2-CB 4.4Å; F32-V54 HydrophobicContact CE2-CG1 3.78Å; F32-Y195 HydrophobicContact CB-CD2 3.85Å; F32-Y195 HydrophobicContact CB-CG 4.26Å; F32-Y195 HydrophobicContact CG-CD2 4.36Å; F32-E198 HydrophobicContact CE2-CG 3.96Å; F32-E198 HydrophobicContact CZ-CG 4.2Å
33	V	78.3	Confident	64.9	Low	11 Å²	11	80.9 Å²	80.9	7%	0.067	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	131.5	178.5	174.7	0	0	0	0	108.9	F30 F35 L46 L52 V54 V56	F30-V33 HydrophobicContact CB-CG2 4.05Å; V33-F35 HydrophobicContact CG1-CD2 3.39Å; V33-F35 HydrophobicContact CG1-CE1 4.39Å; V33-F35 HydrophobicContact CG1-CE2 3.06Å; V33-F35 HydrophobicContact CG1-CG 4.2Å; V33-F35 HydrophobicContact CG1-CZ 3.63Å; V33-L46 HydrophobicContact CG1-CD1 4.35Å; V33-L46 HydrophobicContact CG1-CD2 4.38Å; V33-L46 HydrophobicContact CG2-CD2 4.35Å; V33-L52 HydrophobicContact CB-CD1 4.15Å; V33-L52 HydrophobicContact CG2-CD1 3.59Å; V33-L52 HydrophobicContact CG2-CG 4.47Å; V33-V54 PolarHBondContact N-O 3.4Å; V33-V56 PolarHBondContact O-N 3.38Å
34	K	78.2	Confident	66.3	Low	41 Å²	41	83.2 Å²	83.2	18%	0.178	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	113.7	178.7	-176.1	-176	178.5	-174.1	0	109.6	E9 F32 V56 R190 T193	E9-K34 IonicContact OE1-NZ 3.81Å; E9-K34 PolarHBondContact OE1-NZ 3.36Å; F32-K34 HydrophobicContact CE1-CB 4.35Å; F32-K34 HydrophobicContact CZ-CB 4.04Å; F32-K34 HydrophobicContact CZ-CD 4.37Å; K34-V56 CarbonylContact C-O 3.53Å; K34-V56 WeakPolarHBondContact CA-O 3.34Å; K34-V56 HydrophobicContact CB-CB 4.48Å; K34-V56 HydrophobicContact CG-CB 4.3Å; K34-V56 HydrophobicContact CG-CG1 4.34Å; K34-R190 PolarHBondContact NZ-O 3.4Å; K34-T193 PolarHBondContact NZ-OG1 3.36Å
35	F	75.6	Confident	67.8	Low	30 Å²	30	75.1 Å²	75.1	13%	0.132	38%	0.375	C	S	.	.			trans	-129.7	105.5	177.7	-63.7	-48.6	0	0	0	108.8	V33 L38 L40 L46 V56 V57 S58 N60	V33-F35 HydrophobicContact CG1-CD2 3.39Å; V33-F35 HydrophobicContact CG1-CE1 4.39Å; V33-F35 HydrophobicContact CG1-CE2 3.06Å; V33-F35 HydrophobicContact CG1-CG 4.2Å; V33-F35 HydrophobicContact CG1-CZ 3.63Å; F35-L38 HydrophobicContact CB-CD1 4.06Å; F35-L38 HydrophobicContact CD1-CD1 3.68Å; F35-L38 HydrophobicContact CG-CD1 4.24Å; F35-L40 HydrophobicContact CB-CD1 4.01Å; F35-L40 HydrophobicContact CD2-CD1 4.25Å; F35-L40 HydrophobicContact CG-CD1 4.17Å; F35-L46 HydrophobicContact CE2-CD2 4.44Å; F35-V56 PolarHBondContact N-O 2.98Å; F35-V57 HydrophobicContact CB-CG1 4.2Å; F35-V57 HydrophobicContact CD2-CG2 4.49Å; F35-V57 CarbonylContact O-C 3.5Å; F35-V57 VanDerWaalsContact O-CA 3.26Å; F35-V57 WeakPolarHBondContact O-CA 3.46Å; F35-S58 PolarHBondContact O-N 3.49Å; F35-N60 PolarHBondContact O-ND2 3.01Å; F35-N60 VanDerWaalsContact O-ND2 3.16Å
36	N	76.7	Confident	69.2	Low	74 Å²	74	67.6 Å²	67.6	40%	0.396	34%	0.34	S	S	.	.			trans	-121.9	122.3	-178.2	-173.6	34.4	0	0	0	110.2	S58 N59	N36-S58 WeakPolarHBondContact CA-O 3.38Å; N36-S58 PolarHBondContact OD1-O 2.96Å; N36-S58 VanDerWaalsContact OD1-O 3.1Å; N36-S58 PolarHBondContact OD1-OG 3.24Å; N36-N59 PolarHBondContact OD1-ND2 3.43Å
37	G	72.1	Confident	70.8	Confident	37 Å²	37	68.5 Å²	68.5	38%	0.381	34%	0.342	S	S	.	.	S	Bend	trans	71.3	28.6	174.1	0	0	0	0	0	115.3	S58 N59	G37-S58 PolarHBondContact N-O 3.42Å; G37-N59 VanDerWaalsContact CA-O 3.28Å; G37-N59 WeakPolarHBondContact CA-O 3.32Å; G37-N59 PolarHBondContact N-O 3.24Å
38	L	75.1	Confident	71.9	Confident	23 Å²	23	63.5 Å²	63.5	12%	0.12	33%	0.329	C	S	.	.	S	Bend	trans	-96.8	9.6	-178.5	-65.8	178.1	0	0	0	113.2	F35 L40 N60	F35-L38 HydrophobicContact CB-CD1 4.06Å; F35-L38 HydrophobicContact CD1-CD1 3.68Å; F35-L38 HydrophobicContact CG-CD1 4.24Å; L38-L40 HydrophobicContact CB-CD1 4.34Å; L38-L40 HydrophobicContact CB-CG 4Å; L38-L40 PolarHBondContact O-N 3.34Å; L38-L40 VanDerWaalsContact O-N 3.09Å; L38-N60 PolarHBondContact N-OD1 3Å
39	H	76.7	Confident	73.1	Confident	123 Å²	123	58.5 Å²	58.5	57%	0.569	31%	0.309	S	S	*	.			trans	54	28.3	179.7	-57.8	-56.4	0	0	0	114.6	K41 N60 F61	H39-K41 PolarHBondContact O-N 2.9Å; H39-N60 PolarHBondContact N-OD1 3.09Å; H39-N60 VanDerWaalsContact N-OD1 3.16Å; H39-F61 HydrophobicContact CB-CD2 3.85Å; H39-F61 HydrophobicContact CB-CE2 3.85Å; H39-F61 AromaticContact CE1-CE2 3.96Å; H39-F61 AromaticContact CG-CE2 3.72Å; H39-F61 AromaticContact ND1-CD2 3.8Å; H39-F61 AromaticContact ND1-CE2 3.02Å; H39-F61 WeakPolarHBondContact ND1-CE2 3.35Å; H39-F61 AromaticContact ND1-CZ 3.64Å
40	L	77.8	Confident	74	Confident	15 Å²	15	57.9 Å²	57.9	8%	0.079	31%	0.305	C	S	.	.			trans	-64.4	134	-179	-63.7	171.9	0	0	0	111.1	W16 F35 L38 N60 F61 I62	W16-L40 HydrophobicContact CD2-CD2 4.44Å; W16-L40 HydrophobicContact CE3-CD2 4.34Å; W16-L40 HydrophobicContact CH2-CD2 3.97Å; W16-L40 HydrophobicContact CZ2-CD2 4.07Å; W16-L40 HydrophobicContact CZ3-CD2 4.11Å; F35-L40 HydrophobicContact CB-CD1 4.01Å; F35-L40 HydrophobicContact CD2-CD1 4.25Å; F35-L40 HydrophobicContact CG-CD1 4.17Å; L38-L40 HydrophobicContact CB-CD1 4.34Å; L38-L40 HydrophobicContact CB-CG 4Å; L38-L40 PolarHBondContact O-N 3.34Å; L38-L40 VanDerWaalsContact O-N 3.09Å; L40-N60 HydrophobicContact CB-CB 4.25Å; L40-N60 PolarHBondContact N-OD1 3.23Å; L40-F61 CarbonylContact O-C 3.53Å; L40-F61 WeakPolarHBondContact O-CA 3.49Å; L40-F61 PolarHBondContact O-N 3.48Å; L40-I62 PolarHBondContact O-N 2.92Å
41	K	77.1	Confident	74.7	Confident	164 Å²	164	56.6 Å²	56.6	71%	0.713	30%	0.301	S	S	*	.			trans	-96.9	-30.8	177.5	-66.2	-178.4	-179.5	176.2	0	113.3	H39	H39-K41 PolarHBondContact O-N 2.9Å
42	S	74.7	Confident	75.1	Confident	42 Å²	42	54.4 Å²	54.4	29%	0.294	29%	0.288	S	S	.	.			trans	-136	155.7	-178.7	-179.3	0	0	0	0	111.2	E44	S42-E44 VanDerWaalsContact OG-CD 3.25Å; S42-E44 VanDerWaalsContact OG-CG 3.26Å; S42-E44 WeakPolarHBondContact OG-CG 3.47Å; S42-E44 PolarHBondContact OG-N 2.92Å; S42-E44 PolarHBondContact OG-OE1 3.46Å
43	V	77.8	Confident	75.4	Confident	11 Å²	11	57.3 Å²	57.3	7%	0.067	30%	0.298	C	S	.	.			trans	-114.5	18.1	-178.7	-163	0	0	0	0	111.1	N45 L46 I62 P67 L68	V43-N45 PolarHBondContact O-N 3.3Å; V43-N45 VanDerWaalsContact O-N 3.1Å; V43-L46 HydrophobicContact CG1-CB 3.96Å; V43-L46 HydrophobicContact CG1-CD1 3.48Å; V43-L46 VanDerWaalsContact CG1-CD1 3.48Å; V43-L46 HydrophobicContact CG1-CG 3.82Å; V43-L46 PolarHBondContact O-N 2.86Å; V43-I62 HydrophobicContact CG2-CB 4.47Å; V43-I62 HydrophobicContact CG2-CD1 3.47Å; V43-I62 VanDerWaalsContact CG2-CD1 3.47Å; V43-I62 HydrophobicContact CG2-CG1 3.82Å; V43-I62 HydrophobicContact CG2-CG2 3.79Å; V43-P67 WeakPolarHBondContact O-CB 3.49Å; V43-L68 HydrophobicContact CG1-CD2 3.94Å; V43-L68 HydrophobicContact CG1-CG 4.22Å
44	E	74.5	Confident	75.7	Confident	119 Å²	119	56.8 Å²	56.8	56%	0.556	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-50	-37	-178.7	-82.1	159.1	-127.9	0	0	113.6	S42 L46 Q47 P67	S42-E44 VanDerWaalsContact OG-CD 3.25Å; S42-E44 VanDerWaalsContact OG-CG 3.26Å; S42-E44 WeakPolarHBondContact OG-CG 3.47Å; S42-E44 PolarHBondContact OG-N 2.92Å; S42-E44 PolarHBondContact OG-OE1 3.46Å; E44-L46 PolarHBondContact O-N 3.25Å; E44-L46 VanDerWaalsContact O-N 3.11Å; E44-Q47 WeakPolarHBondContact O-CB 3.27Å; E44-Q47 PolarHBondContact O-N 3.46Å; E44-P67 HydrophobicContact CG-CG 3.96Å
45	N	68.3	Low	76.1	Confident	61 Å²	61	54.9 Å²	54.9	33%	0.326	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-69.1	-14.7	-175.9	-57.2	0.5	0	0	0	113.2	W16 N20 V43	W16-N45 WeakPolarHBondContact CH2-ND2 3.23Å; W16-N45 HydrophobicContact CZ2-CB 4.5Å; W16-N45 WeakPolarHBondContact CZ2-ND2 3.17Å; N20-N45 VanDerWaalsContact CG-ND2 3.34Å; N20-N45 PolarHBondContact ND2-ND2 2.87Å; N20-N45 PolarHBondContact OD1-ND2 3.46Å; V43-N45 PolarHBondContact O-N 3.3Å; V43-N45 VanDerWaalsContact O-N 3.1Å
46	L	71.2	Confident	76.6	Confident	15 Å²	15	53.5 Å²	53.5	8%	0.079	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-89.6	-0.4	174.1	-59.4	-175.3	0	0	0	113.4	V33 F35 V43 E44 S48 C49 L52 L68	V33-L46 HydrophobicContact CG1-CD1 4.35Å; V33-L46 HydrophobicContact CG1-CD2 4.38Å; V33-L46 HydrophobicContact CG2-CD2 4.35Å; F35-L46 HydrophobicContact CE2-CD2 4.44Å; V43-L46 HydrophobicContact CG1-CB 3.96Å; V43-L46 HydrophobicContact CG1-CD1 3.48Å; V43-L46 VanDerWaalsContact CG1-CD1 3.48Å; V43-L46 HydrophobicContact CG1-CG 3.82Å; V43-L46 PolarHBondContact O-N 2.86Å; E44-L46 PolarHBondContact O-N 3.25Å; E44-L46 VanDerWaalsContact O-N 3.11Å; L46-S48 PolarHBondContact O-N 3.03Å; L46-C49 WeakPolarHBondContact O-CB 3.39Å; L46-C49 PolarHBondContact O-N 3.02Å; L46-C49 VanDerWaalsContact O-N 3.11Å; L46-L52 HydrophobicContact CD2-CD1 4.44Å; L46-L68 HydrophobicContact CB-CD2 3.89Å; L46-L68 HydrophobicContact CD1-CD2 4.07Å
47	Q	72.3	Confident	76.9	Confident	105 Å²	105	50 Å²	50	49%	0.491	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-29.1	179.9	-172.7	174.5	-1.1	0	0	113.3	E44 P67 S70	E44-Q47 WeakPolarHBondContact O-CB 3.27Å; E44-Q47 PolarHBondContact O-N 3.46Å; Q47-P67 WeakPolarHBondContact CA-O 3.47Å; Q47-P67 HydrophobicContact CB-CB 4.31Å; Q47-S70 WeakPolarHBondContact O-CB 3.37Å; Q47-S70 PolarHBondContact O-OG 2.89Å; Q47-S70 VanDerWaalsContact O-OG 3.08Å
48	S	67.6	Low	77.6	Confident	102 Å²	102	48.2 Å²	48.2	71%	0.713	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-6.6	179.4	-55.9	0	0	0	0	113.7	L46 I50	L46-S48 PolarHBondContact O-N 3.03Å; S48-I50 PolarHBondContact O-N 3.2Å
49	C	71.3	Confident	78	Confident	10 Å²	10	50.7 Å²	50.7	7%	0.068	26%	0.256	C	S	.	.			trans	-86.9	70.2	-171	-63.9	0	0	0	0	113.3	L46 S51 L52 C71	L46-C49 WeakPolarHBondContact O-CB 3.39Å; L46-C49 PolarHBondContact O-N 3.02Å; L46-C49 VanDerWaalsContact O-N 3.11Å; C49-S51 VanDerWaalsContact C-N 3.26Å; C49-S51 PolarHBondContact O-N 3.38Å; C49-L52 HydrophobicContact CB-CB 4.11Å; C49-L52 HydrophobicContact CB-CD1 4Å; C49-L52 WeakPolarHBondContact O-CB 3.25Å; C49-L52 PolarHBondContact O-N 3.45Å; C49-C71 PolarHBondContact O-SG 3.23Å
50	I	75.8	Confident	78.5	Confident	95 Å²	95	45 Å²	45	49%	0.487	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-30.3	-176.3	-57.5	166.9	0	0	0	112.6	S48 L52	S48-I50 PolarHBondContact O-N 3.2Å; I50-L52 VanDerWaalsContact C-N 3.33Å; I50-L52 PolarHBondContact O-N 2.95Å
51	S	76.2	Confident	78.8	Confident	19 Å²	19	48.3 Å²	48.3	13%	0.133	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.2	3.4	-175.7	-68.1	0	0	0	0	114.9	D29 F30 C49 R53	D29-S51 VanDerWaalsContact CG-OG 3.3Å; D29-S51 WeakPolarHBondContact OD1-CB 3.48Å; D29-S51 PolarHBondContact OD1-OG 2.91Å; F30-S51 CarbonylContact O-C 3.41Å; C49-S51 VanDerWaalsContact C-N 3.26Å; C49-S51 PolarHBondContact O-N 3.38Å; S51-R53 PolarHBondContact O-N 3.44Å
52	L	81.7	Confident	79.3	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.21	C	C	.	.			trans	-68.3	129.1	-174.3	-161	151.5	0	0	0	111.8	F30 V33 L46 C49 I50 C55 K73 L74	F30-L52 WeakPolarHBondContact O-CA 3.33Å; F30-L52 PolarHBondContact O-N 3.29Å; V33-L52 HydrophobicContact CB-CD1 4.15Å; V33-L52 HydrophobicContact CG2-CD1 3.59Å; V33-L52 HydrophobicContact CG2-CG 4.47Å; L46-L52 HydrophobicContact CD2-CD1 4.44Å; C49-L52 HydrophobicContact CB-CB 4.11Å; C49-L52 HydrophobicContact CB-CD1 4Å; C49-L52 WeakPolarHBondContact O-CB 3.25Å; C49-L52 PolarHBondContact O-N 3.45Å; I50-L52 VanDerWaalsContact C-N 3.33Å; I50-L52 PolarHBondContact O-N 2.95Å; L52-C55 HydrophobicContact CD2-CB 3.58Å; L52-K73 CarbonylContact O-C 3.18Å; L52-L74 HydrophobicContact CD2-CD2 3.31Å; L52-L74 HydrophobicContact CD2-CG 3.99Å; L52-L74 WeakPolarHBondContact O-CA 3.38Å; L52-L74 PolarHBondContact O-N 3.14Å; L52-L74 VanDerWaalsContact O-N 3.15Å
53	R	84.4	Confident	79.7	Confident	107 Å²	107	41.5 Å²	41.5	40%	0.404	21%	0.214	S	C	.	.			trans	-112.4	-36.8	-177.8	-67.3	-176	-177.4	-165.2	2.7	113.2	V31 S51 I75 K76 Y195	V31-R53 HydrophobicContact CG1-CB 4.1Å; V31-R53 HydrophobicContact CG1-CG 3.99Å; V31-R53 PolarHBondContact O-N 3.5Å; S51-R53 PolarHBondContact O-N 3.44Å; R53-I75 HydrophobicContact CB-CD1 4.36Å; R53-I75 WeakPolarHBondContact O-CB 3.33Å; R53-I75 PolarHBondContact O-N 3.05Å; R53-K76 PolarHBondContact O-N 3.11Å; R53-Y195 HydrophobicContact CB-CE2 4.2Å; R53-Y195 WeakPolarHBondContact CD-OH 3.35Å; R53-Y195 PolarHBondContact NH1-OH 2.97Å
54	V	84.1	Confident	79.9	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	118.3	-179.7	176	0	0	0	0	108.5	V31 F32 V33 V56 K76 Y195 E198 I199 I202	V31-V54 PolarHBondContact O-N 3.05Å; F32-V54 WeakPolarHBondContact CA-O 3.48Å; F32-V54 HydrophobicContact CD2-CB 3.84Å; F32-V54 HydrophobicContact CD2-CG1 3.74Å; F32-V54 HydrophobicContact CE2-CB 4.4Å; F32-V54 HydrophobicContact CE2-CG1 3.78Å; V33-V54 PolarHBondContact N-O 3.4Å; V54-V56 HydrophobicContact CG1-CG2 4.23Å; V54-K76 HydrophobicContact CG1-CB 4.3Å; V54-K76 HydrophobicContact CG1-CD 4.21Å; V54-K76 HydrophobicContact CG1-CG 4.43Å; V54-K76 HydrophobicContact CG2-CB 4.35Å; V54-Y195 HydrophobicContact CG2-CD2 4.48Å; V54-Y195 HydrophobicContact CG2-CE2 4.25Å; V54-E198 HydrophobicContact CG1-CB 4.4Å; V54-I199 HydrophobicContact CG2-CD1 3.99Å; V54-I202 HydrophobicContact CG2-CD1 3.98Å
55	C	87	Confident	80.5	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	120.7	177.1	-160.4	0	0	0	0	109	L52 V57 L74 K76 L77 D78	L52-C55 HydrophobicContact CD2-CB 3.58Å; C55-V57 WeakPolarHBondContact SG-CG2 3.39Å; C55-L74 HydrophobicContact CB-CD2 3.94Å; C55-K76 PolarHBondContact N-O 3.03Å; C55-L77 HydrophobicContact CB-CD1 3.77Å; C55-L77 WeakPolarHBondContact O-CA 3.35Å; C55-D78 PolarHBondContact O-N 3.41Å
56	V	85.6	Confident	81.2	Confident	1 Å²	1	42.2 Å²	42.2	1%	0.006	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	108.8	174.8	179.6	0	0	0	0	108.2	V33 K34 F35 V54 D78 L189	V33-V56 PolarHBondContact O-N 3.38Å; K34-V56 CarbonylContact C-O 3.53Å; K34-V56 WeakPolarHBondContact CA-O 3.34Å; K34-V56 HydrophobicContact CB-CB 4.48Å; K34-V56 HydrophobicContact CG-CB 4.3Å; K34-V56 HydrophobicContact CG-CG1 4.34Å; F35-V56 PolarHBondContact N-O 2.98Å; V54-V56 HydrophobicContact CG1-CG2 4.23Å; V56-D78 HydrophobicContact CB-CB 4.39Å; V56-D78 HydrophobicContact CG1-CB 4.18Å; V56-D78 HydrophobicContact CG2-CB 4.24Å; V56-L189 HydrophobicContact CG1-CD2 4.07Å
57	V	84.2	Confident	81.6	Confident	1 Å²	1	42.2 Å²	42.2	1%	0.006	22%	0.219	C	C	.	.			trans	-130.6	57.5	-177.6	-161.6	0	0	0	0	109.8	F35 C55 N60 I62 D78 L79 N82	F35-V57 HydrophobicContact CB-CG1 4.2Å; F35-V57 HydrophobicContact CD2-CG2 4.49Å; F35-V57 CarbonylContact O-C 3.5Å; F35-V57 VanDerWaalsContact O-CA 3.26Å; F35-V57 WeakPolarHBondContact O-CA 3.46Å; C55-V57 WeakPolarHBondContact SG-CG2 3.39Å; V57-N60 WeakPolarHBondContact CG1-ND2 3.46Å; V57-I62 HydrophobicContact CB-CD1 4.11Å; V57-I62 HydrophobicContact CG1-CD1 3.25Å; V57-D78 CarbonylContact C-O 3.55Å; V57-D78 PolarHBondContact N-O 3.49Å; V57-L79 HydrophobicContact CB-CD2 4.24Å; V57-N82 PolarHBondContact O-ND2 3.5Å
58	S	85.5	Confident	82	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.196	C	C	.	.			trans	-84.3	153	-175.5	53.8	0	0	0	0	113.3	F35 N36 G37 N60 H80	F35-S58 PolarHBondContact O-N 3.49Å; N36-S58 WeakPolarHBondContact CA-O 3.38Å; N36-S58 PolarHBondContact OD1-O 2.96Å; N36-S58 VanDerWaalsContact OD1-O 3.1Å; N36-S58 PolarHBondContact OD1-OG 3.24Å; G37-S58 PolarHBondContact N-O 3.42Å; S58-N60 PolarHBondContact O-N 3.18Å; S58-N60 PolarHBondContact O-ND2 3.44Å; S58-H80 CarbonylContact C-O 3.53Å; S58-H80 VanDerWaalsContact CA-O 3.3Å; S58-H80 WeakPolarHBondContact CA-O 3.26Å; S58-H80 WeakPolarHBondContact CB-CE1 3.42Å; S58-H80 WeakPolarHBondContact CB-ND1 3.37Å; S58-H80 WeakPolarHBondContact CB-NE2 3.37Å
59	N	84.6	Confident	82.7	Confident	74 Å²	74	36.3 Å²	36.3	40%	0.396	18%	0.18	S	C	.	.	S	Bend	trans	54	49.8	175.2	-55.5	-50	0	0	0	113.2	N36 G37 H80 G81	N36-N59 PolarHBondContact OD1-ND2 3.43Å; G37-N59 VanDerWaalsContact CA-O 3.28Å; G37-N59 WeakPolarHBondContact CA-O 3.32Å; G37-N59 PolarHBondContact N-O 3.24Å; N59-H80 PolarHBondContact N-O 3.41Å; N59-G81 CarbonylContact C-O 3.57Å; N59-G81 VanDerWaalsContact CA-O 3.24Å; N59-G81 WeakPolarHBondContact CA-O 3.41Å
60	N	86	Confident	83	Confident	3 Å²	3	37.9 Å²	37.9	2%	0.016	19%	0.191	C	C	.	.	S	Bend	trans	-120.5	-170.8	174.3	-68.1	-69.6	0	0	0	110.1	F35 L38 H39 L40 V57 S58 I62 G81 N82	F35-N60 PolarHBondContact O-ND2 3.01Å; F35-N60 VanDerWaalsContact O-ND2 3.16Å; L38-N60 PolarHBondContact N-OD1 3Å; H39-N60 PolarHBondContact N-OD1 3.09Å; H39-N60 VanDerWaalsContact N-OD1 3.16Å; L40-N60 HydrophobicContact CB-CB 4.25Å; L40-N60 PolarHBondContact N-OD1 3.23Å; V57-N60 WeakPolarHBondContact CG1-ND2 3.46Å; S58-N60 PolarHBondContact O-N 3.18Å; S58-N60 PolarHBondContact O-ND2 3.44Å; N60-I62 HydrophobicContact CB-CD1 4.14Å; N60-I62 HydrophobicContact CB-CG1 4.18Å; N60-G81 PolarHBondContact N-O 2.92Å; N60-G81 VanDerWaalsContact O-O 3.05Å; N60-N82 WeakPolarHBondContact CA-OD1 3.42Å; N60-N82 VanDerWaalsContact CB-OD1 3.27Å; N60-N82 WeakPolarHBondContact CB-OD1 3.48Å; N60-N82 PolarHBondContact N-OD1 3.34Å; N60-N82 PolarHBondContact O-OD1 3.31Å; N60-N82 VanDerWaalsContact O-OD1 3.12Å
61	F	85.7	Confident	83.3	Confident	86 Å²	86	33.4 Å²	33.4	38%	0.377	17%	0.168	S	C	.	.			trans	-113.3	36.4	179.6	-61.2	-56.8	0	0	0	111.8	H39 L40 T63 Q83	H39-F61 HydrophobicContact CB-CD2 3.85Å; H39-F61 HydrophobicContact CB-CE2 3.85Å; H39-F61 AromaticContact CE1-CE2 3.96Å; H39-F61 AromaticContact CG-CE2 3.72Å; H39-F61 AromaticContact ND1-CD2 3.8Å; H39-F61 AromaticContact ND1-CE2 3.02Å; H39-F61 WeakPolarHBondContact ND1-CE2 3.35Å; H39-F61 AromaticContact ND1-CZ 3.64Å; L40-F61 CarbonylContact O-C 3.53Å; L40-F61 WeakPolarHBondContact O-CA 3.49Å; L40-F61 PolarHBondContact O-N 3.48Å; F61-T63 PolarHBondContact O-N 2.97Å; F61-Q83 HydrophobicContact CD1-CG 4.41Å; F61-Q83 VanDerWaalsContact CD1-NE2 3.31Å
62	I	86.1	Confident	83.6	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.183	C	C	.	.			trans	-72.5	129.5	-176.3	-63.3	161.8	0	0	0	109.8	L40 V43 V57 N60 D64 I65 N82 Q83 I84	L40-I62 PolarHBondContact O-N 2.92Å; V43-I62 HydrophobicContact CG2-CB 4.47Å; V43-I62 HydrophobicContact CG2-CD1 3.47Å; V43-I62 VanDerWaalsContact CG2-CD1 3.47Å; V43-I62 HydrophobicContact CG2-CG1 3.82Å; V43-I62 HydrophobicContact CG2-CG2 3.79Å; V57-I62 HydrophobicContact CB-CD1 4.11Å; V57-I62 HydrophobicContact CG1-CD1 3.25Å; N60-I62 HydrophobicContact CB-CD1 4.14Å; N60-I62 HydrophobicContact CB-CG1 4.18Å; I62-D64 WeakPolarHBondContact CG2-O 3.28Å; I62-I65 HydrophobicContact CG2-CG2 4.16Å; I62-N82 HydrophobicContact CB-CB 4.45Å; I62-N82 PolarHBondContact N-OD1 2.81Å; I62-Q83 CarbonylContact O-C 3.33Å; I62-Q83 PolarHBondContact O-N 2.81Å; I62-Q83 VanDerWaalsContact O-N 3.14Å; I62-I84 WeakPolarHBondContact O-CG1 3.5Å; I62-I84 PolarHBondContact O-N 3.2Å
63	T	84.2	Confident	83.7	Confident	62 Å²	62	41.1 Å²	41.1	38%	0.38	20%	0.203	S	C	.	.			trans	-100.1	-37.9	173.5	53.8	0	0	0	0	112	F61	F61-T63 PolarHBondContact O-N 2.97Å
64	D	82.4	Confident	83.9	Confident	94 Å²	94	36 Å²	36	50%	0.503	18%	0.184	S	C	.	.			trans	-125.8	130.1	-169.9	-62.4	-59.3	0	0	0	112.4	I62	I62-D64 WeakPolarHBondContact CG2-O 3.28Å
65	I	85.9	Confident	84.2	Confident	2 Å²	2	37.6 Å²	37.6	1%	0.01	19%	0.191	C	C	.	.			trans	-110.2	6.1	-179.1	61.9	169.8	0	0	0	113.1	I62 P67 L68 L79 I84 L87 P88 F92 W93	I62-I65 HydrophobicContact CG2-CG2 4.16Å; I65-P67 VanDerWaalsContact C-N 3.27Å; I65-L68 HydrophobicContact CB-CD1 4.49Å; I65-L68 WeakPolarHBondContact O-CB 3.38Å; I65-L68 PolarHBondContact O-N 3.27Å; I65-L68 VanDerWaalsContact O-N 3.1Å; I65-L79 HydrophobicContact CD1-CD1 4.33Å; I65-L79 HydrophobicContact CG2-CD1 3.85Å; I65-L79 HydrophobicContact CG2-CD2 4.36Å; I65-I84 HydrophobicContact CG2-CD1 3.79Å; I65-L87 HydrophobicContact CD1-CD2 4.08Å; I65-P88 HydrophobicContact CD1-CG 4.13Å; I65-P88 HydrophobicContact CG1-CG 3.86Å; I65-F92 VanDerWaalsContact O-CE2 3.28Å; I65-F92 WeakPolarHBondContact O-CE2 3.39Å; I65-F92 WeakPolarHBondContact O-CZ 3.43Å; I65-W93 HydrophobicContact CD1-CH2 3.96Å; I65-W93 HydrophobicContact CD1-CZ2 3.72Å
66	H	83.2	Confident	84.3	Confident	110 Å²	110	37.9 Å²	37.9	51%	0.509	19%	0.193	S	C	.	.	G	3₁₀ helix	trans	-52.4	-36.4	178.2	-163.1	-58.8	0	0	0	113.9	L68 Q69	H66-L68 PolarHBondContact O-N 2.92Å; H66-L68 VanDerWaalsContact O-N 3.1Å; H66-Q69 PolarHBondContact CE1-OE1 2.89Å; H66-Q69 WeakPolarHBondContact O-CB 3.46Å; H66-Q69 PolarHBondContact O-N 2.89Å; H66-Q69 VanDerWaalsContact O-N 3.16Å
67	P	79.1	Confident	84.6	Confident	16 Å²	16	37.9 Å²	37.9	10%	0.104	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-58.8	-23.2	178	-28.4	37.5	0	0	0	115	V43 E44 Q47 I65 Q69	V43-P67 WeakPolarHBondContact O-CB 3.49Å; E44-P67 HydrophobicContact CG-CG 3.96Å; Q47-P67 WeakPolarHBondContact CA-O 3.47Å; Q47-P67 HydrophobicContact CB-CB 4.31Å; I65-P67 VanDerWaalsContact C-N 3.27Å; P67-Q69 PolarHBondContact O-N 3.34Å; P67-Q69 VanDerWaalsContact O-N 3.16Å
68	L	82.2	Confident	84.8	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-75.6	2.9	179.8	-64.8	175.4	0	0	0	114	V43 L46 I65 H66 S70 C71 L77 F92	V43-L68 HydrophobicContact CG1-CD2 3.94Å; V43-L68 HydrophobicContact CG1-CG 4.22Å; L46-L68 HydrophobicContact CB-CD2 3.89Å; L46-L68 HydrophobicContact CD1-CD2 4.07Å; I65-L68 HydrophobicContact CB-CD1 4.49Å; I65-L68 WeakPolarHBondContact O-CB 3.38Å; I65-L68 PolarHBondContact O-N 3.27Å; I65-L68 VanDerWaalsContact O-N 3.1Å; H66-L68 PolarHBondContact O-N 2.92Å; H66-L68 VanDerWaalsContact O-N 3.1Å; L68-S70 PolarHBondContact O-N 3.45Å; L68-C71 WeakPolarHBondContact O-CB 3.39Å; L68-C71 PolarHBondContact O-N 3.39Å; L68-C71 VanDerWaalsContact O-N 3.09Å; L68-L77 HydrophobicContact CD1-CD1 3.86Å; L68-L77 HydrophobicContact CD1-CD2 4.27Å; L68-F92 HydrophobicContact CB-CE2 4.25Å; L68-F92 HydrophobicContact CB-CZ 3.95Å
69	Q	81.8	Confident	85	Confident	83 Å²	83	38.2 Å²	38.2	39%	0.388	20%	0.195	S	C	.	.	G	3₁₀ helix	trans	-60	-35.1	-176.2	-169.1	175	1.8	0	0	112.7	H66 P67 C71 F92	H66-Q69 PolarHBondContact CE1-OE1 2.89Å; H66-Q69 WeakPolarHBondContact O-CB 3.46Å; H66-Q69 PolarHBondContact O-N 2.89Å; H66-Q69 VanDerWaalsContact O-N 3.16Å; P67-Q69 PolarHBondContact O-N 3.34Å; P67-Q69 VanDerWaalsContact O-N 3.16Å; Q69-C71 PolarHBondContact O-N 2.89Å; Q69-F92 VanDerWaalsContact CA-CE2 3.44Å; Q69-F92 HydrophobicContact CB-CD2 3.54Å; Q69-F92 HydrophobicContact CB-CE2 3.78Å; Q69-F92 HydrophobicContact CG-CD2 3.83Å
70	S	78	Confident	85.2	Confident	43 Å²	43	35.9 Å²	35.9	30%	0.301	18%	0.181	S	C	.	.	G	3₁₀ helix	trans	-72.3	-13.7	-179.2	-52.2	0	0	0	0	113.6	Q47 L68 I72	Q47-S70 WeakPolarHBondContact O-CB 3.37Å; Q47-S70 PolarHBondContact O-OG 2.89Å; Q47-S70 VanDerWaalsContact O-OG 3.08Å; L68-S70 PolarHBondContact O-N 3.45Å; S70-I72 VanDerWaalsContact C-N 3.29Å; S70-I72 PolarHBondContact O-N 3.38Å
71	C	82.1	Confident	85.2	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.19	C	C	.	.			trans	-83	62.9	-173.9	-64.2	0	0	0	0	112.5	C49 L68 Q69 K73 L74 L96	C49-C71 PolarHBondContact O-SG 3.23Å; L68-C71 WeakPolarHBondContact O-CB 3.39Å; L68-C71 PolarHBondContact O-N 3.39Å; L68-C71 VanDerWaalsContact O-N 3.09Å; Q69-C71 PolarHBondContact O-N 2.89Å; C71-K73 PolarHBondContact O-N 2.89Å; C71-K73 VanDerWaalsContact O-N 3.13Å; C71-L74 HydrophobicContact CB-CD1 3.37Å; C71-L74 HydrophobicContact CB-CG 3.79Å; C71-L74 WeakPolarHBondContact O-CB 3.37Å; C71-L74 PolarHBondContact O-N 3.5Å; C71-L96 WeakPolarHBondContact O-CD2 3.4Å
72	I	82.8	Confident	85.4	Confident	87 Å²	87	32.9 Å²	32.9	45%	0.446	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-26.6	-172	-58.7	164	0	0	0	112.9	S70	S70-I72 VanDerWaalsContact C-N 3.29Å; S70-I72 PolarHBondContact O-N 3.38Å
73	K	83.8	Confident	85.5	Confident	95 Å²	95	37.6 Å²	37.6	41%	0.413	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90	6.9	-175.8	-65.6	-178.6	-171.7	162.5	0	114.4	L52 C71	L52-K73 CarbonylContact O-C 3.18Å; C71-K73 PolarHBondContact O-N 2.89Å; C71-K73 VanDerWaalsContact O-N 3.13Å
74	L	87.9	Confident	85.7	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.178	C	C	.	.			trans	-58.7	134.8	179.3	-92.2	167.5	0	0	0	112.7	L52 C55 C71 L96 N98 L99	L52-L74 HydrophobicContact CD2-CD2 3.31Å; L52-L74 HydrophobicContact CD2-CG 3.99Å; L52-L74 WeakPolarHBondContact O-CA 3.38Å; L52-L74 PolarHBondContact O-N 3.14Å; L52-L74 VanDerWaalsContact O-N 3.15Å; C55-L74 HydrophobicContact CB-CD2 3.94Å; C71-L74 HydrophobicContact CB-CD1 3.37Å; C71-L74 HydrophobicContact CB-CG 3.79Å; C71-L74 WeakPolarHBondContact O-CB 3.37Å; C71-L74 PolarHBondContact O-N 3.5Å; L74-L96 HydrophobicContact CB-CD2 4.32Å; L74-L96 HydrophobicContact CD1-CD2 4.1Å; L74-N98 CarbonylContact O-C 3.59Å; L74-N98 WeakPolarHBondContact O-CB 3.45Å; L74-L99 HydrophobicContact CB-CD1 4.31Å; L74-L99 VanDerWaalsContact O-CA 3.32Å; L74-L99 WeakPolarHBondContact O-CA 3.47Å; L74-L99 PolarHBondContact O-N 3.38Å
75	I	89.3	Confident	85.8	Confident	32 Å²	32	37.3 Å²	37.3	16%	0.164	19%	0.185	C	C	.	.			trans	-115.3	-42.2	178.4	-56.5	176.9	0	0	0	110.6	R53 K100 L101 I199 I202	R53-I75 HydrophobicContact CB-CD1 4.36Å; R53-I75 WeakPolarHBondContact O-CB 3.33Å; R53-I75 PolarHBondContact O-N 3.05Å; I75-K100 HydrophobicContact CG2-CB 4.39Å; I75-K100 HydrophobicContact CG2-CD 4.15Å; I75-K100 HydrophobicContact CG2-CG 4.41Å; I75-K100 PolarHBondContact O-N 3.44Å; I75-L101 PolarHBondContact O-N 3.3Å; I75-I199 HydrophobicContact CD1-CD1 4.31Å; I75-I202 HydrophobicContact CG2-CD1 4.22Å; I75-I202 HydrophobicContact CG2-CG2 4.15Å
76	K	90.2	Very high	85.6	Confident	7 Å²	7	40.1 Å²	40.1	3%	0.03	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	130.4	177.7	171.6	-179.8	168.1	-178.3	0	109.6	R53 V54 C55 L101 E198 I202	R53-K76 PolarHBondContact O-N 3.11Å; V54-K76 HydrophobicContact CG1-CB 4.3Å; V54-K76 HydrophobicContact CG1-CD 4.21Å; V54-K76 HydrophobicContact CG1-CG 4.43Å; V54-K76 HydrophobicContact CG2-CB 4.35Å; C55-K76 PolarHBondContact N-O 3.03Å; K76-L101 WeakPolarHBondContact CA-O 3.5Å; K76-L101 HydrophobicContact CB-CB 4.41Å; K76-L101 HydrophobicContact CG-CB 4.31Å; K76-E198 IonicContact NZ-OE2 2.92Å; K76-E198 PolarHBondContact NZ-OE2 3.46Å; K76-I202 HydrophobicContact CB-CD1 3.59Å; K76-I202 HydrophobicContact CB-CG1 4.17Å; K76-I202 HydrophobicContact CD-CD1 4.02Å; K76-I202 HydrophobicContact CD-CG1 4.04Å; K76-I202 HydrophobicContact CG-CD1 4.41Å
77	L	91	Very high	85.7	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	117	173.5	179.8	59.7	0	0	0	109.1	C55 L68 L79 L99 L101 L102 Y103	C55-L77 HydrophobicContact CB-CD1 3.77Å; C55-L77 WeakPolarHBondContact O-CA 3.35Å; L68-L77 HydrophobicContact CD1-CD1 3.86Å; L68-L77 HydrophobicContact CD1-CD2 4.27Å; L77-L79 HydrophobicContact CD1-CD1 4.15Å; L77-L79 HydrophobicContact CD1-CD2 4.25Å; L77-L79 HydrophobicContact CD1-CG 3.97Å; L77-L79 HydrophobicContact CD2-CD1 3.76Å; L77-L79 HydrophobicContact CD2-CG 4.43Å; L77-L79 HydrophobicContact CG-CD1 3.81Å; L77-L79 HydrophobicContact CG-CG 3.93Å; L77-L99 HydrophobicContact CB-CD1 3.85Å; L77-L101 PolarHBondContact N-O 2.93Å; L77-L102 HydrophobicContact CB-CD1 3.93Å; L77-L102 HydrophobicContact CD2-CD1 3.83Å; L77-L102 HydrophobicContact CG-CD1 3.95Å; L77-L102 WeakPolarHBondContact O-CA 3.48Å; L77-Y103 PolarHBondContact O-N 2.83Å
78	D	89.6	Confident	85.9	Confident	8 Å²	8	35.9 Å²	35.9	4%	0.043	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	115.7	177.7	-172.2	-1.7	0	0	0	110.3	C55 V56 V57 H80 Y103	C55-D78 PolarHBondContact O-N 3.41Å; V56-D78 HydrophobicContact CB-CB 4.39Å; V56-D78 HydrophobicContact CG1-CB 4.18Å; V56-D78 HydrophobicContact CG2-CB 4.24Å; V57-D78 CarbonylContact C-O 3.55Å; V57-D78 PolarHBondContact N-O 3.49Å; D78-H80 IonicContact OD1-CE1 2.66Å; D78-H80 IonicContact OD1-CG 3.38Å; D78-H80 PolarHBondContact OD1-N 3.08Å; D78-H80 IonicContact OD1-ND1 3.74Å; D78-H80 PolarHBondContact OD1-ND1 2.96Å; D78-H80 IonicContact OD2-CE1 2.71Å; D78-H80 IonicContact OD2-ND1 3.69Å; D78-H80 PolarHBondContact OD2-ND1 2.96Å; D78-Y103 HydrophobicContact CB-CD2 3.9Å; D78-Y103 WeakPolarHBondContact OD1-CB 3.49Å
79	L	88.5	Confident	86.1	Confident	1 Å²	1	41.9 Å²	41.9	1%	0.005	22%	0.218	C	C	.	.			trans	-129.6	25.3	-176.2	-66.6	168.2	0	0	0	111.2	V57 I65 L77 N82 I84 Y103 L104 N107	V57-L79 HydrophobicContact CB-CD2 4.24Å; I65-L79 HydrophobicContact CD1-CD1 4.33Å; I65-L79 HydrophobicContact CG2-CD1 3.85Å; I65-L79 HydrophobicContact CG2-CD2 4.36Å; L77-L79 HydrophobicContact CD1-CD1 4.15Å; L77-L79 HydrophobicContact CD1-CD2 4.25Å; L77-L79 HydrophobicContact CD1-CG 3.97Å; L77-L79 HydrophobicContact CD2-CD1 3.76Å; L77-L79 HydrophobicContact CD2-CG 4.43Å; L77-L79 HydrophobicContact CG-CD1 3.81Å; L77-L79 HydrophobicContact CG-CG 3.93Å; L79-N82 VanDerWaalsContact C-ND2 3.26Å; L79-N82 PolarHBondContact O-ND2 3.42Å; L79-I84 HydrophobicContact CB-CD1 4.09Å; L79-I84 HydrophobicContact CD1-CD1 4.04Å; L79-I84 HydrophobicContact CG-CD1 4.49Å; L79-Y103 CarbonylContact C-O 3.44Å; L79-Y103 WeakPolarHBondContact CA-O 3.41Å; L79-Y103 PolarHBondContact N-O 3.09Å; L79-L104 HydrophobicContact CB-CD2 4.01Å; L79-L104 HydrophobicContact CD1-CD2 4.01Å; L79-N107 PolarHBondContact O-ND2 3.38Å
80	H	89.4	Confident	86.1	Confident	24 Å²	24	41.6 Å²	41.6	11%	0.111	22%	0.222	C	C	.	.			trans	-67.4	150.8	179.9	76	-92.3	0	0	0	112.9	S58 N59 D78 N82 H105	S58-H80 CarbonylContact C-O 3.53Å; S58-H80 VanDerWaalsContact CA-O 3.3Å; S58-H80 WeakPolarHBondContact CA-O 3.26Å; S58-H80 WeakPolarHBondContact CB-CE1 3.42Å; S58-H80 WeakPolarHBondContact CB-ND1 3.37Å; S58-H80 WeakPolarHBondContact CB-NE2 3.37Å; N59-H80 PolarHBondContact N-O 3.41Å; D78-H80 IonicContact OD1-CE1 2.66Å; D78-H80 IonicContact OD1-CG 3.38Å; D78-H80 PolarHBondContact OD1-N 3.08Å; D78-H80 IonicContact OD1-ND1 3.74Å; D78-H80 PolarHBondContact OD1-ND1 2.96Å; D78-H80 IonicContact OD2-CE1 2.71Å; D78-H80 IonicContact OD2-ND1 3.69Å; D78-H80 PolarHBondContact OD2-ND1 2.96Å; H80-N82 PolarHBondContact O-ND2 3Å; H80-H105 VanDerWaalsContact CA-O 3.3Å; H80-H105 WeakPolarHBondContact CA-O 3.2Å; H80-H105 WeakPolarHBondContact CB-CE1 3.43Å; H80-H105 WeakPolarHBondContact CB-NE2 3.45Å; H80-H105 AromaticContact CD2-NE2 3.63Å; H80-H105 AromaticContact CG-CE1 3.62Å; H80-H105 AromaticContact CG-NE2 3.38Å
81	G	85.4	Confident	86.3	Confident	20 Å²	20	47.1 Å²	47.1	21%	0.206	24%	0.241	C	C	.	.	S	Bend	trans	66.3	41.1	179.1	0	0	0	0	0	112.9	N59 N60 H105 D106	N59-G81 CarbonylContact C-O 3.57Å; N59-G81 VanDerWaalsContact CA-O 3.24Å; N59-G81 WeakPolarHBondContact CA-O 3.41Å; N60-G81 PolarHBondContact N-O 2.92Å; N60-G81 VanDerWaalsContact O-O 3.05Å; G81-H105 PolarHBondContact N-O 3.42Å; G81-D106 WeakPolarHBondContact CA-O 3.47Å; G81-D106 PolarHBondContact N-O 3.43Å
82	N	89.8	Confident	86.5	Confident	7 Å²	7	47.3 Å²	47.3	4%	0.037	24%	0.241	C	C	.	.	S	Bend	trans	-118.6	178.6	176.2	-77.6	-69.8	0	0	0	110.9	V57 N60 I62 L79 H80 I84 D106 N107	V57-N82 PolarHBondContact O-ND2 3.5Å; N60-N82 WeakPolarHBondContact CA-OD1 3.42Å; N60-N82 VanDerWaalsContact CB-OD1 3.27Å; N60-N82 WeakPolarHBondContact CB-OD1 3.48Å; N60-N82 PolarHBondContact N-OD1 3.34Å; N60-N82 PolarHBondContact O-OD1 3.31Å; N60-N82 VanDerWaalsContact O-OD1 3.12Å; I62-N82 HydrophobicContact CB-CB 4.45Å; I62-N82 PolarHBondContact N-OD1 2.81Å; L79-N82 VanDerWaalsContact C-ND2 3.26Å; L79-N82 PolarHBondContact O-ND2 3.42Å; H80-N82 PolarHBondContact O-ND2 3Å; N82-I84 HydrophobicContact CB-CD1 4.26Å; N82-I84 HydrophobicContact CB-CG1 4.07Å; N82-D106 PolarHBondContact N-O 3Å; N82-N107 WeakPolarHBondContact CA-OD1 3.43Å; N82-N107 VanDerWaalsContact CB-OD1 3.31Å; N82-N107 WeakPolarHBondContact CB-OD1 3.29Å; N82-N107 PolarHBondContact O-OD1 3Å
83	Q	88.4	Confident	86.7	Confident	99 Å²	99	43.1 Å²	43.1	46%	0.463	22%	0.22	S	C	.	.			trans	-106.4	33.7	-178	-62.4	-172.9	6.9	0	0	112.7	F61 I62 K85	F61-Q83 HydrophobicContact CD1-CG 4.41Å; F61-Q83 VanDerWaalsContact CD1-NE2 3.31Å; I62-Q83 CarbonylContact O-C 3.33Å; I62-Q83 PolarHBondContact O-N 2.81Å; I62-Q83 VanDerWaalsContact O-N 3.14Å; Q83-K85 PolarHBondContact O-N 2.95Å
84	I	88.1	Confident	86.7	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.22	C	C	.	.			trans	-73.8	122.3	-176.2	-52.8	170.3	0	0	0	109.5	I62 I65 L79 N82 S86 L87 L104 N107 G108 F109	I62-I84 WeakPolarHBondContact O-CG1 3.5Å; I62-I84 PolarHBondContact O-N 3.2Å; I65-I84 HydrophobicContact CG2-CD1 3.79Å; L79-I84 HydrophobicContact CB-CD1 4.09Å; L79-I84 HydrophobicContact CD1-CD1 4.04Å; L79-I84 HydrophobicContact CG-CD1 4.49Å; N82-I84 HydrophobicContact CB-CD1 4.26Å; N82-I84 HydrophobicContact CB-CG1 4.07Å; I84-S86 WeakPolarHBondContact CG2-O 3.18Å; I84-L87 HydrophobicContact CG2-CD2 4.28Å; I84-L104 HydrophobicContact CD1-CD2 4.36Å; I84-N107 WeakPolarHBondContact CB-OD1 3.42Å; I84-N107 WeakPolarHBondContact CG1-OD1 3.33Å; I84-N107 PolarHBondContact N-OD1 3.05Å; I84-N107 VanDerWaalsContact N-OD1 3.17Å; I84-G108 CarbonylContact O-C 3.58Å; I84-G108 WeakPolarHBondContact O-CA 3.47Å; I84-G108 PolarHBondContact O-N 3.04Å; I84-F109 HydrophobicContact CB-CE1 4.39Å; I84-F109 HydrophobicContact CB-CZ 3.91Å; I84-F109 HydrophobicContact CG2-CE1 3.78Å; I84-F109 HydrophobicContact CG2-CZ 3.59Å
85	K	84.6	Confident	86.5	Confident	149 Å²	149	42.7 Å²	42.7	65%	0.648	23%	0.233	S	C	*	.			trans	-105.7	-29.3	-179.9	-66.5	176.2	-177	172.4	0	113.1	Q83 N114	Q83-K85 PolarHBondContact O-N 2.95Å; K85-N114 PolarHBondContact O-ND2 3.1Å
86	S	83.2	Confident	86.4	Confident	62 Å²	62	41.2 Å²	41.2	43%	0.434	23%	0.226	S	C	.	.			trans	-136.9	139.7	-178.9	43.6	0	0	0	0	110.4	I84	I84-S86 WeakPolarHBondContact CG2-O 3.18Å
87	L	85	Confident	86.2	Confident	17 Å²	17	47.1 Å²	47.1	9%	0.089	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-89.4	148.9	171.1	-60.5	177.8	0	0	0	109.3	I65 I84 W93 L104 F109 L118	I65-L87 HydrophobicContact CD1-CD2 4.08Å; I84-L87 HydrophobicContact CG2-CD2 4.28Å; L87-W93 HydrophobicContact CB-CZ2 4.29Å; L87-W93 HydrophobicContact CD1-CZ2 4.33Å; L87-W93 HydrophobicContact CD2-CZ2 4.04Å; L87-W93 HydrophobicContact CG-CZ2 4.45Å; L87-L104 HydrophobicContact CD1-CD1 4.47Å; L87-L104 HydrophobicContact CD2-CD1 4.27Å; L87-F109 HydrophobicContact CD2-CE1 3.66Å; L87-F109 HydrophobicContact CD2-CZ 3.58Å; L87-F109 HydrophobicContact CG-CE1 3.74Å; L87-F109 HydrophobicContact CG-CZ 4.13Å; L87-L118 HydrophobicContact CD1-CD1 3.93Å; L87-L118 HydrophobicContact CD1-CD2 3.83Å; L87-L118 HydrophobicContact CD1-CG 3.69Å
88	P	83.8	Confident	86	Confident	20 Å²	20	50.9 Å²	50.9	13%	0.13	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-67.4	164.2	175.6	29.2	-36	0	0	0	111.8	I65 F92 W93 V117	I65-P88 HydrophobicContact CD1-CG 4.13Å; I65-P88 HydrophobicContact CG1-CG 3.86Å; P88-F92 HydrophobicContact CB-CB 4.03Å; P88-F92 HydrophobicContact CB-CD1 4.44Å; P88-F92 HydrophobicContact CB-CD2 4.21Å; P88-F92 HydrophobicContact CB-CG 4Å; P88-F92 HydrophobicContact CG-CB 4Å; P88-F92 HydrophobicContact CG-CD1 3.51Å; P88-F92 HydrophobicContact CG-CD2 3.86Å; P88-F92 HydrophobicContact CG-CE1 3.84Å; P88-F92 HydrophobicContact CG-CE2 4.16Å; P88-F92 HydrophobicContact CG-CG 3.53Å; P88-F92 HydrophobicContact CG-CZ 4.16Å; P88-W93 HydrophobicContact CG-CZ2 4.42Å; P88-W93 PolarHBondContact O-NE1 3.36Å; P88-W93 VanDerWaalsContact O-NE1 3.1Å; P88-V117 VanDerWaalsContact O-CG1 3.25Å; P88-V117 WeakPolarHBondContact O-CG1 3.41Å
89	D	84.6	Confident	86.1	Confident	125 Å²	125	50.5 Å²	50.5	67%	0.668	27%	0.27	S	S	*	.	P	Polyproline II helix	trans	-51.8	162.2	-174.4	-79.4	-11.9	0	0	0	115.6	K91 F92 V117	D89-K91 PolarHBondContact O-N 2.94Å; D89-F92 VanDerWaalsContact O-CB 3.26Å; D89-F92 WeakPolarHBondContact O-CB 3.37Å; D89-F92 PolarHBondContact O-N 3Å; D89-V117 VanDerWaalsContact C-CG1 3.45Å
90	T	82.2	Confident	86.3	Confident	77 Å²	77	54.5 Å²	54.5	47%	0.472	29%	0.287	S	S	.	.	H	α-helix	trans	-55.6	-29.9	179.6	53.2	0	0	0	0	113.5	F92 W93 S94 V117 A120	T90-F92 VanDerWaalsContact C-N 3.29Å; T90-F92 PolarHBondContact O-N 3.2Å; T90-W93 PolarHBondContact O-N 3.39Å; T90-S94 WeakPolarHBondContact O-CB 3.33Å; T90-S94 PolarHBondContact O-N 2.96Å; T90-S94 PolarHBondContact O-OG 3.48Å; T90-V117 HydrophobicContact CG2-CG1 3.72Å; T90-V117 VanDerWaalsContact N-CG1 3.27Å; T90-A120 HydrophobicContact CG2-CB 4.49Å
91	K	83.3	Confident	86.4	Confident	159 Å²	159	53.4 Å²	53.4	69%	0.691	28%	0.282	S	S	*	.	H	α-helix	trans	-63.4	-32.5	176.5	-67.7	-178.3	-178.9	174.8	0	112.9	D89 S94 G95	D89-K91 PolarHBondContact O-N 2.94Å; K91-S94 PolarHBondContact O-OG 3.38Å; K91-S94 VanDerWaalsContact O-OG 3.12Å; K91-G95 PolarHBondContact O-N 2.96Å
92	F	86.2	Confident	86.7	Confident	4 Å²	4	52.5 Å²	52.5	2%	0.018	27%	0.272	C	S	.	.	H	α-helix	trans	-65.6	-50.8	177.2	175.2	-85.1	0	0	0	110.2	I65 L68 Q69 P88 D89 T90 G95 L96	I65-F92 VanDerWaalsContact O-CE2 3.28Å; I65-F92 WeakPolarHBondContact O-CE2 3.39Å; I65-F92 WeakPolarHBondContact O-CZ 3.43Å; L68-F92 HydrophobicContact CB-CE2 4.25Å; L68-F92 HydrophobicContact CB-CZ 3.95Å; Q69-F92 VanDerWaalsContact CA-CE2 3.44Å; Q69-F92 HydrophobicContact CB-CD2 3.54Å; Q69-F92 HydrophobicContact CB-CE2 3.78Å; Q69-F92 HydrophobicContact CG-CD2 3.83Å; P88-F92 HydrophobicContact CB-CB 4.03Å; P88-F92 HydrophobicContact CB-CD1 4.44Å; P88-F92 HydrophobicContact CB-CD2 4.21Å; P88-F92 HydrophobicContact CB-CG 4Å; P88-F92 HydrophobicContact CG-CB 4Å; P88-F92 HydrophobicContact CG-CD1 3.51Å; P88-F92 HydrophobicContact CG-CD2 3.86Å; P88-F92 HydrophobicContact CG-CE1 3.84Å; P88-F92 HydrophobicContact CG-CE2 4.16Å; P88-F92 HydrophobicContact CG-CG 3.53Å; P88-F92 HydrophobicContact CG-CZ 4.16Å; D89-F92 VanDerWaalsContact O-CB 3.26Å; D89-F92 WeakPolarHBondContact O-CB 3.37Å; D89-F92 PolarHBondContact O-N 3Å; T90-F92 VanDerWaalsContact C-N 3.29Å; T90-F92 PolarHBondContact O-N 3.2Å; F92-G95 PolarHBondContact O-N 3.22Å; F92-L96 HydrophobicContact CD1-CD1 4.27Å; F92-L96 HydrophobicContact CE1-CD1 3.72Å; F92-L96 HydrophobicContact CZ-CD1 4.33Å
93	W	86	Confident	86.8	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-72.8	-31.2	-175.3	-64.8	101.3	0	0	0	113.6	I65 L87 P88 T90 G95 L96 L99 L102 L118 A120 C121	I65-W93 HydrophobicContact CD1-CH2 3.96Å; I65-W93 HydrophobicContact CD1-CZ2 3.72Å; L87-W93 HydrophobicContact CB-CZ2 4.29Å; L87-W93 HydrophobicContact CD1-CZ2 4.33Å; L87-W93 HydrophobicContact CD2-CZ2 4.04Å; L87-W93 HydrophobicContact CG-CZ2 4.45Å; P88-W93 HydrophobicContact CG-CZ2 4.42Å; P88-W93 PolarHBondContact O-NE1 3.36Å; P88-W93 VanDerWaalsContact O-NE1 3.1Å; T90-W93 PolarHBondContact O-N 3.39Å; W93-G95 PolarHBondContact O-N 3.01Å; W93-L96 HydrophobicContact CE3-CD1 3.92Å; W93-L96 HydrophobicContact CZ3-CD1 4.05Å; W93-L96 PolarHBondContact O-N 3.11Å; W93-L99 HydrophobicContact CE3-CD2 4.33Å; W93-L99 HydrophobicContact CZ3-CD2 3.93Å; W93-L102 HydrophobicContact CH2-CD1 4.4Å; W93-L102 HydrophobicContact CH2-CD2 3.91Å; W93-L102 HydrophobicContact CZ3-CD1 4.46Å; W93-L102 HydrophobicContact CZ3-CD2 3.81Å; W93-L118 HydrophobicContact CD2-CD2 3.58Å; W93-L118 HydrophobicContact CE3-CD2 3.73Å; W93-L118 HydrophobicContact CG-CD2 4.27Å; W93-L118 HydrophobicContact CH2-CD2 3.8Å; W93-L118 HydrophobicContact CZ2-CD2 3.66Å; W93-L118 HydrophobicContact CZ3-CD2 3.84Å; W93-A120 HydrophobicContact CB-CB 4.18Å; W93-C121 VanDerWaalsContact CE3-SG 3.54Å
94	S	85.2	Confident	86.9	Confident	59 Å²	59	47.6 Å²	47.6	41%	0.413	25%	0.249	S	C	.	.	H	α-helix	trans	-67.8	-24.7	173.8	67.5	0	0	0	0	113	T90 K91	T90-S94 WeakPolarHBondContact O-CB 3.33Å; T90-S94 PolarHBondContact O-N 2.96Å; T90-S94 PolarHBondContact O-OG 3.48Å; K91-S94 PolarHBondContact O-OG 3.38Å; K91-S94 VanDerWaalsContact O-OG 3.12Å
95	G	82.8	Confident	87	Confident	27 Å²	27	48.2 Å²	48.2	28%	0.278	25%	0.252	S	S	.	.	H	α-helix	trans	-69.5	-30.6	173	0	0	0	0	0	113.6	K91 F92 W93 K97	K91-G95 PolarHBondContact O-N 2.96Å; F92-G95 PolarHBondContact O-N 3.22Å; W93-G95 PolarHBondContact O-N 3.01Å; G95-K97 VanDerWaalsContact C-N 3.28Å; G95-K97 PolarHBondContact O-N 2.92Å
96	L	87.3	Confident	87.1	Confident	1 Å²	1	44.6 Å²	44.6	1%	0.005	24%	0.24	C	C	.	.			trans	-82.6	65.2	-176.8	-61.5	179.5	0	0	0	112.3	C71 L74 F92 W93 N98 L99	C71-L96 WeakPolarHBondContact O-CD2 3.4Å; L74-L96 HydrophobicContact CB-CD2 4.32Å; L74-L96 HydrophobicContact CD1-CD2 4.1Å; F92-L96 HydrophobicContact CD1-CD1 4.27Å; F92-L96 HydrophobicContact CE1-CD1 3.72Å; F92-L96 HydrophobicContact CZ-CD1 4.33Å; W93-L96 HydrophobicContact CE3-CD1 3.92Å; W93-L96 HydrophobicContact CZ3-CD1 4.05Å; W93-L96 PolarHBondContact O-N 3.11Å; L96-N98 PolarHBondContact O-N 3.46Å; L96-L99 HydrophobicContact CB-CB 4.15Å; L96-L99 HydrophobicContact CD1-CD2 4.23Å; L96-L99 PolarHBondContact O-N 2.93Å
97	K	85.9	Confident	87.4	Confident	130 Å²	130	42 Å²	42	57%	0.565	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-25.9	-173.5	-64.9	179.1	-177.4	177.2	0	114.3	G95 N123	G95-K97 VanDerWaalsContact C-N 3.28Å; G95-K97 PolarHBondContact O-N 2.92Å; K97-N123 WeakPolarHBondContact O-CB 3.45Å; K97-N123 PolarHBondContact O-ND2 3.39Å
98	N	87.9	Confident	87.5	Confident	79 Å²	79	42.7 Å²	42.7	42%	0.422	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.3	-0.8	-173.3	-69.6	-20.1	0	0	0	114.2	L74 L96 K100	L74-N98 CarbonylContact O-C 3.59Å; L74-N98 WeakPolarHBondContact O-CB 3.45Å; L96-N98 PolarHBondContact O-N 3.46Å; N98-K100 PolarHBondContact O-N 2.95Å
99	L	90.9	Very high	87.6	Confident	1 Å²	1	41.8 Å²	41.8	1%	0.005	23%	0.226	C	C	.	.			trans	-69.3	121.3	-174.6	-172	73.7	0	0	0	110.2	L74 L77 W93 L96 L102 N123 L124	L74-L99 HydrophobicContact CB-CD1 4.31Å; L74-L99 VanDerWaalsContact O-CA 3.32Å; L74-L99 WeakPolarHBondContact O-CA 3.47Å; L74-L99 PolarHBondContact O-N 3.38Å; L77-L99 HydrophobicContact CB-CD1 3.85Å; W93-L99 HydrophobicContact CE3-CD2 4.33Å; W93-L99 HydrophobicContact CZ3-CD2 3.93Å; L96-L99 HydrophobicContact CB-CB 4.15Å; L96-L99 HydrophobicContact CD1-CD2 4.23Å; L96-L99 PolarHBondContact O-N 2.93Å; L99-L102 HydrophobicContact CD2-CB 4.48Å; L99-N123 CarbonylContact O-C 3.14Å; L99-N123 VanDerWaalsContact O-O 3.06Å; L99-L124 HydrophobicContact CD2-CD1 4.38Å; L99-L124 HydrophobicContact CG-CD1 4.42Å; L99-L124 WeakPolarHBondContact O-CA 3.3Å; L99-L124 PolarHBondContact O-N 2.97Å
100	K	92.2	Very high	87.5	Confident	85 Å²	85	38.3 Å²	38.3	37%	0.37	22%	0.215	S	C	.	.			trans	-112.1	-39.4	-177.8	-69.9	179.4	-175.8	176.6	0	113	I75 N98 I125 A126	I75-K100 HydrophobicContact CG2-CB 4.39Å; I75-K100 HydrophobicContact CG2-CD 4.15Å; I75-K100 HydrophobicContact CG2-CG 4.41Å; I75-K100 PolarHBondContact O-N 3.44Å; N98-K100 PolarHBondContact O-N 2.95Å; K100-I125 HydrophobicContact CB-CD1 4.19Å; K100-I125 HydrophobicContact CD-CD1 4.07Å; K100-I125 HydrophobicContact CG-CD1 3.99Å; K100-I125 WeakPolarHBondContact O-CA 3.43Å; K100-I125 WeakPolarHBondContact O-CB 3.45Å; K100-I125 PolarHBondContact O-N 3.45Å; K100-A126 PolarHBondContact O-N 3.26Å; K100-A126 VanDerWaalsContact O-N 3.11Å
101	L	91.9	Very high	87.6	Confident	1 Å²	1	41.3 Å²	41.3	1%	0.005	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	128.6	-178.6	-56.6	-176.5	0	0	0	109.8	I75 K76 L77 A126 I202 I205	I75-L101 PolarHBondContact O-N 3.3Å; K76-L101 WeakPolarHBondContact CA-O 3.5Å; K76-L101 HydrophobicContact CB-CB 4.41Å; K76-L101 HydrophobicContact CG-CB 4.31Å; L77-L101 PolarHBondContact N-O 2.93Å; L101-A126 HydrophobicContact CD2-CB 3.59Å; L101-I202 HydrophobicContact CD1-CB 4.21Å; L101-I202 HydrophobicContact CD1-CG1 3.77Å; L101-I202 HydrophobicContact CD1-CG2 4.1Å; L101-I202 HydrophobicContact CG-CG2 4.39Å; L101-I205 HydrophobicContact CD1-CD1 4.05Å; L101-I205 HydrophobicContact CD1-CG2 4.4Å; L101-I205 HydrophobicContact CD2-CG2 4.07Å
102	L	92.4	Very high	87.5	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	122.6	176.7	-178.8	59.7	0	0	0	109.7	L77 W93 L99 L104 L118 L124 A126 L127 T128	L77-L102 HydrophobicContact CB-CD1 3.93Å; L77-L102 HydrophobicContact CD2-CD1 3.83Å; L77-L102 HydrophobicContact CG-CD1 3.95Å; L77-L102 WeakPolarHBondContact O-CA 3.48Å; W93-L102 HydrophobicContact CH2-CD1 4.4Å; W93-L102 HydrophobicContact CH2-CD2 3.91Å; W93-L102 HydrophobicContact CZ3-CD1 4.46Å; W93-L102 HydrophobicContact CZ3-CD2 3.81Å; L99-L102 HydrophobicContact CD2-CB 4.48Å; L102-L104 HydrophobicContact CD1-CD1 4.41Å; L102-L104 HydrophobicContact CD1-CD2 4.49Å; L102-L104 HydrophobicContact CD1-CG 4.18Å; L102-L104 HydrophobicContact CD2-CD1 3.76Å; L102-L104 HydrophobicContact CD2-CG 4.35Å; L102-L104 HydrophobicContact CG-CD1 3.93Å; L102-L104 HydrophobicContact CG-CG 3.96Å; L102-L118 HydrophobicContact CD2-CD1 4.27Å; L102-L118 HydrophobicContact CD2-CD2 3.89Å; L102-L124 HydrophobicContact CB-CD1 3.72Å; L102-A126 PolarHBondContact N-O 2.97Å; L102-A126 VanDerWaalsContact N-O 3.1Å; L102-L127 HydrophobicContact CB-CD1 4.06Å; L102-L127 HydrophobicContact CD2-CD1 3.94Å; L102-L127 HydrophobicContact CG-CD1 3.96Å; L102-L127 WeakPolarHBondContact O-CA 3.4Å; L102-T128 PolarHBondContact O-N 3.27Å; L102-T128 VanDerWaalsContact O-N 3.11Å
103	Y	91.7	Very high	87.1	Confident	3 Å²	3	43.8 Å²	43.8	1%	0.012	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	121	176.6	-55.6	-34.2	0	0	0	111.2	L77 D78 L79 T128 F185	L77-Y103 PolarHBondContact O-N 2.83Å; D78-Y103 HydrophobicContact CB-CD2 3.9Å; D78-Y103 WeakPolarHBondContact OD1-CB 3.49Å; L79-Y103 CarbonylContact C-O 3.44Å; L79-Y103 WeakPolarHBondContact CA-O 3.41Å; L79-Y103 PolarHBondContact N-O 3.09Å; Y103-T128 VanDerWaalsContact CA-OG1 3.23Å; Y103-T128 WeakPolarHBondContact CA-OG1 3.46Å; Y103-T128 WeakPolarHBondContact CB-OG1 3.47Å; Y103-T128 HydrophobicContact CD1-CG2 3.67Å; Y103-T128 WeakPolarHBondContact CD1-OG1 3.44Å; Y103-T128 HydrophobicContact CE1-CG2 3.95Å; Y103-F185 HydrophobicContact CE1-CB 4.3Å; Y103-F185 PolarHBondContact OH-O 3.31Å
104	L	90.1	Very high	86.7	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.246	C	C	.	.			trans	-136.8	16.5	-173.7	-71.4	175.1	0	0	0	112	L79 I84 L87 L102 N107 F109 L118 L127 T128 M129 C132	L79-L104 HydrophobicContact CB-CD2 4.01Å; L79-L104 HydrophobicContact CD1-CD2 4.01Å; I84-L104 HydrophobicContact CD1-CD2 4.36Å; L87-L104 HydrophobicContact CD1-CD1 4.47Å; L87-L104 HydrophobicContact CD2-CD1 4.27Å; L102-L104 HydrophobicContact CD1-CD1 4.41Å; L102-L104 HydrophobicContact CD1-CD2 4.49Å; L102-L104 HydrophobicContact CD1-CG 4.18Å; L102-L104 HydrophobicContact CD2-CD1 3.76Å; L102-L104 HydrophobicContact CD2-CG 4.35Å; L102-L104 HydrophobicContact CG-CD1 3.93Å; L102-L104 HydrophobicContact CG-CG 3.96Å; L104-N107 PolarHBondContact O-ND2 3.02Å; L104-F109 HydrophobicContact CB-CE2 4.08Å; L104-F109 HydrophobicContact CD1-CE2 4.43Å; L104-F109 HydrophobicContact CD1-CZ 4.46Å; L104-F109 HydrophobicContact CD2-CE2 4.29Å; L104-F109 HydrophobicContact CD2-CZ 4.27Å; L104-L118 HydrophobicContact CD1-CD1 4.45Å; L104-L127 HydrophobicContact CD1-CD1 4.23Å; L104-T128 CarbonylContact C-O 3.56Å; L104-T128 WeakPolarHBondContact CA-O 3.47Å; L104-T128 WeakPolarHBondContact CB-O 3.29Å; L104-T128 PolarHBondContact N-O 2.86Å; L104-M129 HydrophobicContact CB-CG 4.13Å; L104-C132 PolarHBondContact O-SG 3Å; L104-C132 VanDerWaalsContact O-SG 3.35Å
105	H	89	Confident	86.5	Confident	13 Å²	13	43.4 Å²	43.4	6%	0.06	23%	0.227	C	C	.	.			trans	-66.2	160.7	174.5	58.2	-84.9	0	0	0	111.2	H80 G81 N107 T128 F130	H80-H105 VanDerWaalsContact CA-O 3.3Å; H80-H105 WeakPolarHBondContact CA-O 3.2Å; H80-H105 WeakPolarHBondContact CB-CE1 3.43Å; H80-H105 WeakPolarHBondContact CB-NE2 3.45Å; H80-H105 AromaticContact CD2-NE2 3.63Å; H80-H105 AromaticContact CG-CE1 3.62Å; H80-H105 AromaticContact CG-NE2 3.38Å; G81-H105 PolarHBondContact N-O 3.42Å; H105-N107 PolarHBondContact O-N 3Å; H105-N107 PolarHBondContact O-ND2 3.19Å; H105-T128 PolarHBondContact N-O 2.89Å; H105-T128 PolarHBondContact ND1-OG1 3.27Å; H105-F130 VanDerWaalsContact CA-O 3.28Å; H105-F130 WeakPolarHBondContact CA-O 3.33Å; H105-F130 HydrophobicContact CB-CD1 3.8Å; H105-F130 HydrophobicContact CB-CD2 3.94Å; H105-F130 HydrophobicContact CB-CE1 3.66Å; H105-F130 HydrophobicContact CB-CE2 3.8Å; H105-F130 HydrophobicContact CB-CG 3.94Å; H105-F130 HydrophobicContact CB-CZ 3.65Å; H105-F130 VanDerWaalsContact CB-O 3.23Å; H105-F130 WeakPolarHBondContact CB-O 3.44Å; H105-F130 AromaticContact CD2-CE2 3.65Å; H105-F130 AromaticContact CD2-CZ 3.31Å; H105-F130 WeakPolarHBondContact CD2-CZ 3.48Å; H105-F130 AromaticContact CG-CE1 3.6Å; H105-F130 AromaticContact CG-CE2 3.84Å; H105-F130 AromaticContact CG-CZ 3.35Å; H105-F130 AromaticContact ND1-CE1 3.79Å; H105-F130 AromaticContact ND1-CZ 3.81Å; H105-F130 AromaticContact NE2-CZ 3.75Å
106	D	88.3	Confident	86.3	Confident	74 Å²	74	44.3 Å²	44.3	40%	0.396	23%	0.229	S	C	.	.	S	Bend	trans	52.4	51.5	-175.5	-65.9	-42.7	0	0	0	113.1	G81 N82 F130 D131	G81-D106 WeakPolarHBondContact CA-O 3.47Å; G81-D106 PolarHBondContact N-O 3.43Å; N82-D106 PolarHBondContact N-O 3Å; D106-F130 PolarHBondContact N-O 3.19Å; D106-D131 WeakPolarHBondContact OD1-CB 3.49Å
107	N	89.6	Confident	86.2	Confident	7 Å²	7	45.7 Å²	45.7	4%	0.037	24%	0.237	C	C	.	.	S	Bend	trans	-130.7	163.9	176.4	-84	-85.4	0	0	0	112.1	L79 N82 I84 L104 H105 F109 C132 P133	L79-N107 PolarHBondContact O-ND2 3.38Å; N82-N107 WeakPolarHBondContact CA-OD1 3.43Å; N82-N107 VanDerWaalsContact CB-OD1 3.31Å; N82-N107 WeakPolarHBondContact CB-OD1 3.29Å; N82-N107 PolarHBondContact O-OD1 3Å; I84-N107 WeakPolarHBondContact CB-OD1 3.42Å; I84-N107 WeakPolarHBondContact CG1-OD1 3.33Å; I84-N107 PolarHBondContact N-OD1 3.05Å; I84-N107 VanDerWaalsContact N-OD1 3.17Å; L104-N107 PolarHBondContact O-ND2 3.02Å; H105-N107 PolarHBondContact O-N 3Å; H105-N107 PolarHBondContact O-ND2 3.19Å; N107-F109 VanDerWaalsContact C-N 3.27Å; N107-F109 HydrophobicContact CB-CD2 3.69Å; N107-F109 HydrophobicContact CB-CE2 3.46Å; N107-F109 VanDerWaalsContact CB-CE2 3.46Å; N107-F109 HydrophobicContact CB-CZ 4.36Å; N107-F109 PolarHBondContact O-N 3.1Å; N107-F109 VanDerWaalsContact O-N 3.08Å; N107-C132 PolarHBondContact O-SG 3.45Å; N107-P133 WeakPolarHBondContact O-CD 3.36Å
108	G	86.3	Confident	86.2	Confident	31 Å²	31	39.5 Å²	39.5	32%	0.32	21%	0.21	S	C	.	.			trans	-80.5	27.3	-172.9	0	0	0	0	0	116.5	I84 A110	I84-G108 CarbonylContact O-C 3.58Å; I84-G108 WeakPolarHBondContact O-CA 3.47Å; I84-G108 PolarHBondContact O-N 3.04Å; G108-A110 PolarHBondContact O-N 3.4Å
109	F	86.4	Confident	86	Confident	1 Å²	1	38.6 Å²	38.6	0%	0.004	21%	0.21	C	C	.	.			trans	-72.2	115.3	-177.7	-60.9	-68	0	0	0	111.8	I84 L87 L104 N107 M129 C132 P133 V134	I84-F109 HydrophobicContact CB-CE1 4.39Å; I84-F109 HydrophobicContact CB-CZ 3.91Å; I84-F109 HydrophobicContact CG2-CE1 3.78Å; I84-F109 HydrophobicContact CG2-CZ 3.59Å; L87-F109 HydrophobicContact CD2-CE1 3.66Å; L87-F109 HydrophobicContact CD2-CZ 3.58Å; L87-F109 HydrophobicContact CG-CE1 3.74Å; L87-F109 HydrophobicContact CG-CZ 4.13Å; L104-F109 HydrophobicContact CB-CE2 4.08Å; L104-F109 HydrophobicContact CD1-CE2 4.43Å; L104-F109 HydrophobicContact CD1-CZ 4.46Å; L104-F109 HydrophobicContact CD2-CE2 4.29Å; L104-F109 HydrophobicContact CD2-CZ 4.27Å; N107-F109 VanDerWaalsContact C-N 3.27Å; N107-F109 HydrophobicContact CB-CD2 3.69Å; N107-F109 HydrophobicContact CB-CE2 3.46Å; N107-F109 VanDerWaalsContact CB-CE2 3.46Å; N107-F109 HydrophobicContact CB-CZ 4.36Å; N107-F109 PolarHBondContact O-N 3.1Å; N107-F109 VanDerWaalsContact O-N 3.08Å; F109-M129 HydrophobicContact CB-CE 4.41Å; F109-M129 HydrophobicContact CD2-CE 3.84Å; F109-M129 HydrophobicContact CE2-CE 4.44Å; F109-M129 HydrophobicContact CG-CE 4.21Å; F109-C132 HydrophobicContact CB-CB 4.47Å; F109-P133 WeakPolarHBondContact O-CB 3.45Å; F109-P133 VanDerWaalsContact O-CD 3.29Å; F109-P133 WeakPolarHBondContact O-CD 3.33Å; F109-V134 HydrophobicContact CB-CG2 4.24Å; F109-V134 WeakPolarHBondContact O-CG2 3.44Å; F109-V134 PolarHBondContact O-N 2.93Å
110	A	82.1	Confident	85.8	Confident	53 Å²	53	40 Å²	40	44%	0.438	22%	0.222	S	C	.	.			trans	-106.4	-25.3	179.1	0	0	0	0	0	114.7	G108 V134 K137	G108-A110 PolarHBondContact O-N 3.4Å; A110-V134 WeakPolarHBondContact O-CG2 3.4Å; A110-K137 WeakPolarHBondContact O-CE 3.34Å; A110-K137 PolarHBondContact O-NZ 3.24Å
111	K	83.5	Confident	85.5	Confident	140 Å²	140	36 Å²	36	61%	0.609	21%	0.205	S	C	*	.			trans	-114.4	129.1	-175.9	-65.6	179.8	-177.7	175.9	0	111.5	K113 N114	K111-K113 VanDerWaalsContact C-N 3.31Å; K111-K113 PolarHBondContact O-N 3.14Å; K111-N114 PolarHBondContact O-N 3Å
112	L	81.1	Confident	85.2	Confident	37 Å²	37	39 Å²	39	19%	0.194	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-60.8	-37.2	175.3	-85.7	166	0	0	0	112.8	N114 I115 C116 V134 K137 Y140 V143	L112-N114 PolarHBondContact O-N 3.39Å; L112-I115 PolarHBondContact O-N 3.5Å; L112-C116 PolarHBondContact O-N 3.45Å; L112-V134 HydrophobicContact CD2-CG1 3.64Å; L112-V134 HydrophobicContact CG-CG1 3.97Å; L112-K137 HydrophobicContact CD1-CB 4.49Å; L112-K137 HydrophobicContact CD1-CD 4.17Å; L112-K137 HydrophobicContact CG-CD 4.35Å; L112-Y140 HydrophobicContact CD2-CD2 3.78Å; L112-Y140 HydrophobicContact CD2-CE2 4.49Å; L112-V143 HydrophobicContact CD2-CG1 4.47Å
113	K	79.6	Confident	85	Confident	178 Å²	178	43.1 Å²	43.1	77%	0.774	25%	0.246	S	C	*	.	G	3₁₀ helix	trans	-54.8	-35.7	179.3	-67.4	-172.8	177.8	-176	0	112.7	K111 I115 C116	K111-K113 VanDerWaalsContact C-N 3.31Å; K111-K113 PolarHBondContact O-N 3.14Å; K113-I115 PolarHBondContact O-N 2.96Å; K113-C116 PolarHBondContact O-N 2.7Å
114	N	77.3	Confident	85	Confident	50 Å²	50	43 Å²	43	27%	0.267	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-67.1	-21.3	-179.7	-63.3	8	0	0	0	112.3	K85 K111 L112	K85-N114 PolarHBondContact O-ND2 3.1Å; K111-N114 PolarHBondContact O-N 3Å; L112-N114 PolarHBondContact O-N 3.39Å
115	I	81.2	Confident	85.1	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-24.8	-176.7	-51.8	161.5	0	0	0	111	L112 K113 V117 L118 M129 V134 L144	L112-I115 PolarHBondContact O-N 3.5Å; K113-I115 PolarHBondContact O-N 2.96Å; I115-V117 PolarHBondContact O-N 3.08Å; I115-L118 HydrophobicContact CG2-CD1 3.73Å; I115-L118 HydrophobicContact CG2-CG 4.37Å; I115-L118 VanDerWaalsContact O-CB 3.3Å; I115-L118 WeakPolarHBondContact O-CB 3.41Å; I115-L118 PolarHBondContact O-N 3.41Å; I115-M129 HydrophobicContact CD1-CE 3.4Å; I115-M129 VanDerWaalsContact CD1-CE 3.4Å; I115-M129 HydrophobicContact CD1-SD 4.15Å; I115-M129 HydrophobicContact CG1-CE 3.9Å; I115-M129 HydrophobicContact CG2-CE 4.31Å; I115-M129 HydrophobicContact CG2-SD 3.83Å; I115-V134 HydrophobicContact CD1-CB 4.19Å; I115-V134 HydrophobicContact CD1-CG1 3.62Å; I115-V134 HydrophobicContact CD1-CG2 4.14Å; I115-L144 HydrophobicContact CB-CD2 3.96Å; I115-L144 HydrophobicContact CG2-CD1 4.37Å; I115-L144 HydrophobicContact CG2-CD2 3.42Å; I115-L144 VanDerWaalsContact CG2-CD2 3.42Å
116	C	78.3	Confident	85.2	Confident	47 Å²	47	43.3 Å²	43.3	32%	0.318	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-56.1	-21.3	175.1	-63.7	0	0	0	0	112.7	L112 K113 L118 S119	L112-C116 PolarHBondContact O-N 3.45Å; K113-C116 PolarHBondContact O-N 2.7Å; C116-L118 PolarHBondContact O-N 2.91Å; C116-S119 WeakPolarHBondContact O-CB 3.21Å; C116-S119 PolarHBondContact O-N 3.28Å; C116-S119 VanDerWaalsContact O-N 3.08Å; C116-S119 PolarHBondContact O-OG 3.11Å
117	V	85.1	Confident	85.4	Confident	29 Å²	29	39.8 Å²	39.8	18%	0.176	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-60.5	-27.4	174.3	-167.6	0	0	0	0	112.4	P88 D89 T90 I115 S119 A120	P88-V117 VanDerWaalsContact O-CG1 3.25Å; P88-V117 WeakPolarHBondContact O-CG1 3.41Å; D89-V117 VanDerWaalsContact C-CG1 3.45Å; T90-V117 HydrophobicContact CG2-CG1 3.72Å; T90-V117 VanDerWaalsContact N-CG1 3.27Å; I115-V117 PolarHBondContact O-N 3.08Å; V117-S119 PolarHBondContact O-N 2.85Å; V117-A120 PolarHBondContact O-N 2.84Å
118	L	84.6	Confident	85.4	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-66.8	-14.8	174.9	-65.7	179.7	0	0	0	113.8	L87 W93 L102 L104 I115 C116 A120 C121 L127 I148	L87-L118 HydrophobicContact CD1-CD1 3.93Å; L87-L118 HydrophobicContact CD1-CD2 3.83Å; L87-L118 HydrophobicContact CD1-CG 3.69Å; W93-L118 HydrophobicContact CD2-CD2 3.58Å; W93-L118 HydrophobicContact CE3-CD2 3.73Å; W93-L118 HydrophobicContact CG-CD2 4.27Å; W93-L118 HydrophobicContact CH2-CD2 3.8Å; W93-L118 HydrophobicContact CZ2-CD2 3.66Å; W93-L118 HydrophobicContact CZ3-CD2 3.84Å; L102-L118 HydrophobicContact CD2-CD1 4.27Å; L102-L118 HydrophobicContact CD2-CD2 3.89Å; L104-L118 HydrophobicContact CD1-CD1 4.45Å; I115-L118 HydrophobicContact CG2-CD1 3.73Å; I115-L118 HydrophobicContact CG2-CG 4.37Å; I115-L118 VanDerWaalsContact O-CB 3.3Å; I115-L118 WeakPolarHBondContact O-CB 3.41Å; I115-L118 PolarHBondContact O-N 3.41Å; C116-L118 PolarHBondContact O-N 2.91Å; L118-A120 PolarHBondContact O-N 3.5Å; L118-A120 VanDerWaalsContact O-N 3.13Å; L118-C121 WeakPolarHBondContact O-CB 3.37Å; L118-C121 PolarHBondContact O-N 2.89Å; L118-C121 PolarHBondContact O-SG 3.39Å; L118-L127 HydrophobicContact CD1-CD1 4.31Å; L118-L127 HydrophobicContact CD1-CD2 4.06Å; L118-I148 HydrophobicContact CB-CD1 3.71Å; L118-I148 HydrophobicContact CB-CG1 4.24Å; L118-I148 HydrophobicContact CD1-CD1 4.25Å
119	S	84.3	Confident	85.5	Confident	61 Å²	61	38 Å²	38	43%	0.427	21%	0.211	S	C	.	.	G	3₁₀ helix	trans	-56.8	-24.6	172.6	61.7	0	0	0	0	113	C116 V117 C121 S147	C116-S119 WeakPolarHBondContact O-CB 3.21Å; C116-S119 PolarHBondContact O-N 3.28Å; C116-S119 VanDerWaalsContact O-N 3.08Å; C116-S119 PolarHBondContact O-OG 3.11Å; V117-S119 PolarHBondContact O-N 2.85Å; S119-C121 PolarHBondContact O-N 3.21Å; S119-S147 WeakPolarHBondContact CB-O 3.4Å
120	A	86.3	Confident	85.5	Confident	30 Å²	30	39.6 Å²	39.6	25%	0.248	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-73	-9.9	177.6	0	0	0	0	0	113.8	T90 W93 V117 L118 P122	T90-A120 HydrophobicContact CG2-CB 4.49Å; W93-A120 HydrophobicContact CB-CB 4.18Å; V117-A120 PolarHBondContact O-N 2.84Å; L118-A120 PolarHBondContact O-N 3.5Å; L118-A120 VanDerWaalsContact O-N 3.13Å; A120-P122 WeakPolarHBondContact O-CD 3.3Å
121	C	86.4	Confident	85.8	Confident	2 Å²	2	42.3 Å²	42.3	1%	0.014	23%	0.226	C	C	.	.			trans	-75.1	119.7	176.1	-64.1	0	0	0	0	110.6	W93 L118 S119 L124 P150	W93-C121 VanDerWaalsContact CE3-SG 3.54Å; L118-C121 WeakPolarHBondContact O-CB 3.37Å; L118-C121 PolarHBondContact O-N 2.89Å; L118-C121 PolarHBondContact O-SG 3.39Å; S119-C121 PolarHBondContact O-N 3.21Å; C121-L124 HydrophobicContact CB-CB 3.91Å; C121-P150 WeakPolarHBondContact O-CG 3.26Å
122	P	84.9	Confident	85.9	Confident	64 Å²	64	35.8 Å²	35.8	42%	0.416	20%	0.198	S	C	.	.	S	Bend	trans	-76.9	-29.9	-175.3	28.7	-34.4	0	0	0	114.1	A120 P150	A120-P122 WeakPolarHBondContact O-CD 3.3Å; P122-P150 WeakPolarHBondContact O-CB 3.29Å
123	N	89	Confident	86.2	Confident	85 Å²	85	37.2 Å²	37.2	46%	0.455	21%	0.209	S	C	.	.	S	Bend	trans	-125.7	17.6	-166.2	-74.8	-34.1	0	0	0	114.5	K97 L99 I125	K97-N123 WeakPolarHBondContact O-CB 3.45Å; K97-N123 PolarHBondContact O-ND2 3.39Å; L99-N123 CarbonylContact O-C 3.14Å; L99-N123 VanDerWaalsContact O-O 3.06Å; N123-I125 PolarHBondContact O-N 2.96Å
124	L	91.5	Very high	86.6	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	17%	0.172	C	C	.	.			trans	-69.9	120.3	-178.8	-172.6	66.5	0	0	0	110.6	L99 L102 C121 I148 P150 L151	L99-L124 HydrophobicContact CD2-CD1 4.38Å; L99-L124 HydrophobicContact CG-CD1 4.42Å; L99-L124 WeakPolarHBondContact O-CA 3.3Å; L99-L124 PolarHBondContact O-N 2.97Å; L102-L124 HydrophobicContact CB-CD1 3.72Å; C121-L124 HydrophobicContact CB-CB 3.91Å; L124-I148 HydrophobicContact CD2-CG2 4.29Å; L124-P150 CarbonylContact O-C 3.59Å; L124-L151 HydrophobicContact CD2-CD1 4.33Å; L124-L151 HydrophobicContact CG-CD1 4.23Å; L124-L151 WeakPolarHBondContact O-CA 3.34Å; L124-L151 PolarHBondContact O-N 3.47Å
125	I	91.5	Very high	87	Confident	20 Å²	20	28.4 Å²	28.4	10%	0.103	17%	0.174	C	C	.	.			trans	-100.4	-45.1	-175.2	-68.9	170.9	0	0	0	111.4	K100 N123 K152 A153 T206 I209	K100-I125 HydrophobicContact CB-CD1 4.19Å; K100-I125 HydrophobicContact CD-CD1 4.07Å; K100-I125 HydrophobicContact CG-CD1 3.99Å; K100-I125 WeakPolarHBondContact O-CA 3.43Å; K100-I125 WeakPolarHBondContact O-CB 3.45Å; K100-I125 PolarHBondContact O-N 3.45Å; N123-I125 PolarHBondContact O-N 2.96Å; I125-K152 HydrophobicContact CG2-CB 4.22Å; I125-K152 HydrophobicContact CG2-CD 4.17Å; I125-K152 PolarHBondContact O-N 2.95Å; I125-A153 PolarHBondContact O-N 3.47Å; I125-A153 VanDerWaalsContact O-N 3.14Å; I125-T206 HydrophobicContact CD1-CG2 4Å; I125-I209 HydrophobicContact CG2-CD1 4.13Å
126	A	92.1	Very high	87.3	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	140	-178.9	0	0	0	0	0	111.6	K100 L101 L102 A153 I209	K100-A126 PolarHBondContact O-N 3.26Å; K100-A126 VanDerWaalsContact O-N 3.11Å; L101-A126 HydrophobicContact CD2-CB 3.59Å; L102-A126 PolarHBondContact N-O 2.97Å; L102-A126 VanDerWaalsContact N-O 3.1Å; A126-A153 WeakPolarHBondContact CA-O 3.34Å; A126-A153 HydrophobicContact CB-CB 3.79Å; A126-I209 HydrophobicContact CB-CD1 4.07Å
127	L	92.3	Very high	87.7	Confident	0 Å²	0	38 Å²	38	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	136.2	-179	177.5	61.7	0	0	0	109.4	L102 L104 L118 M129 L144 I148 L151 A153 L154 D155	L102-L127 HydrophobicContact CB-CD1 4.06Å; L102-L127 HydrophobicContact CD2-CD1 3.94Å; L102-L127 HydrophobicContact CG-CD1 3.96Å; L102-L127 WeakPolarHBondContact O-CA 3.4Å; L104-L127 HydrophobicContact CD1-CD1 4.23Å; L118-L127 HydrophobicContact CD1-CD1 4.31Å; L118-L127 HydrophobicContact CD1-CD2 4.06Å; L127-M129 HydrophobicContact CD1-CG 4.02Å; L127-M129 HydrophobicContact CD1-SD 4.47Å; L127-M129 HydrophobicContact CD2-CG 4.23Å; L127-M129 HydrophobicContact CD2-SD 3.96Å; L127-M129 HydrophobicContact CG-CG 3.94Å; L127-M129 HydrophobicContact CG-SD 4.33Å; L127-L144 HydrophobicContact CD2-CD1 4.39Å; L127-I148 HydrophobicContact CD2-CD1 3.9Å; L127-L151 HydrophobicContact CB-CD1 3.66Å; L127-L151 HydrophobicContact CB-CD2 4.33Å; L127-A153 PolarHBondContact N-O 2.82Å; L127-A153 VanDerWaalsContact N-O 3.12Å; L127-L154 HydrophobicContact CB-CD1 4.09Å; L127-L154 HydrophobicContact CD2-CD1 4.04Å; L127-L154 HydrophobicContact CG-CD1 4.06Å; L127-L154 CarbonylContact O-C 3.48Å; L127-L154 WeakPolarHBondContact O-CA 3.18Å; L127-D155 PolarHBondContact O-N 3.34Å
128	T	90.2	Very high	87.6	Confident	0 Å²	0	47 Å²	47	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	134	170.2	63.1	0	0	0	0	110.8	L102 Y103 L104 H105 F130 F185	L102-T128 PolarHBondContact O-N 3.27Å; L102-T128 VanDerWaalsContact O-N 3.11Å; Y103-T128 VanDerWaalsContact CA-OG1 3.23Å; Y103-T128 WeakPolarHBondContact CA-OG1 3.46Å; Y103-T128 WeakPolarHBondContact CB-OG1 3.47Å; Y103-T128 HydrophobicContact CD1-CG2 3.67Å; Y103-T128 WeakPolarHBondContact CD1-OG1 3.44Å; Y103-T128 HydrophobicContact CE1-CG2 3.95Å; L104-T128 CarbonylContact C-O 3.56Å; L104-T128 WeakPolarHBondContact CA-O 3.47Å; L104-T128 WeakPolarHBondContact CB-O 3.29Å; L104-T128 PolarHBondContact N-O 2.86Å; H105-T128 PolarHBondContact N-O 2.89Å; H105-T128 PolarHBondContact ND1-OG1 3.27Å; T128-F130 HydrophobicContact CG2-CE1 4.3Å; T128-F185 HydrophobicContact CG2-CD2 4.35Å
129	M	88.4	Confident	87.6	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	27%	0.273	C	S	.	.			trans	-154.6	16.5	-172.9	-76.2	-159.5	72.7	0	0	112	L104 F109 I115 L127 C132 Y140 L144 D155	L104-M129 HydrophobicContact CB-CG 4.13Å; F109-M129 HydrophobicContact CB-CE 4.41Å; F109-M129 HydrophobicContact CD2-CE 3.84Å; F109-M129 HydrophobicContact CE2-CE 4.44Å; F109-M129 HydrophobicContact CG-CE 4.21Å; I115-M129 HydrophobicContact CD1-CE 3.4Å; I115-M129 VanDerWaalsContact CD1-CE 3.4Å; I115-M129 HydrophobicContact CD1-SD 4.15Å; I115-M129 HydrophobicContact CG1-CE 3.9Å; I115-M129 HydrophobicContact CG2-CE 4.31Å; I115-M129 HydrophobicContact CG2-SD 3.83Å; L127-M129 HydrophobicContact CD1-CG 4.02Å; L127-M129 HydrophobicContact CD1-SD 4.47Å; L127-M129 HydrophobicContact CD2-CG 4.23Å; L127-M129 HydrophobicContact CD2-SD 3.96Å; L127-M129 HydrophobicContact CG-CG 3.94Å; L127-M129 HydrophobicContact CG-SD 4.33Å; M129-C132 WeakPolarHBondContact O-CB 3.29Å; M129-C132 PolarHBondContact O-SG 3.3Å; M129-Y140 WeakPolarHBondContact CB-OH 3.32Å; M129-L144 HydrophobicContact SD-CD1 3.97Å; M129-D155 WeakPolarHBondContact CA-OD1 3.43Å; M129-D155 PolarHBondContact N-OD1 3.47Å
130	F	86.9	Confident	87.8	Confident	35 Å²	35	46.6 Å²	46.6	15%	0.154	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	158.7	170.6	63.2	-91.6	0	0	0	110.2	H105 D106 T128 C132 D155 H156	H105-F130 VanDerWaalsContact CA-O 3.28Å; H105-F130 WeakPolarHBondContact CA-O 3.33Å; H105-F130 HydrophobicContact CB-CD1 3.8Å; H105-F130 HydrophobicContact CB-CD2 3.94Å; H105-F130 HydrophobicContact CB-CE1 3.66Å; H105-F130 HydrophobicContact CB-CE2 3.8Å; H105-F130 HydrophobicContact CB-CG 3.94Å; H105-F130 HydrophobicContact CB-CZ 3.65Å; H105-F130 VanDerWaalsContact CB-O 3.23Å; H105-F130 WeakPolarHBondContact CB-O 3.44Å; H105-F130 AromaticContact CD2-CE2 3.65Å; H105-F130 AromaticContact CD2-CZ 3.31Å; H105-F130 WeakPolarHBondContact CD2-CZ 3.48Å; H105-F130 AromaticContact CG-CE1 3.6Å; H105-F130 AromaticContact CG-CE2 3.84Å; H105-F130 AromaticContact CG-CZ 3.35Å; H105-F130 AromaticContact ND1-CE1 3.79Å; H105-F130 AromaticContact ND1-CZ 3.81Å; H105-F130 AromaticContact NE2-CZ 3.75Å; D106-F130 PolarHBondContact N-O 3.19Å; T128-F130 HydrophobicContact CG2-CE1 4.3Å; F130-C132 PolarHBondContact O-N 3.2Å; F130-C132 VanDerWaalsContact O-N 3.08Å; F130-D155 HydrophobicContact CB-CB 4.38Å; F130-D155 HydrophobicContact CD1-CB 4.34Å; F130-D155 PolarHBondContact N-OD1 3.4Å; F130-D155 VanDerWaalsContact N-OD1 3.07Å; F130-H156 AromaticContact CD1-CE1 3.65Å; F130-H156 AromaticContact CD1-NE2 3.62Å; F130-H156 AromaticContact CD2-NE2 3.86Å; F130-H156 AromaticContact CE1-CE1 3.41Å; F130-H156 VanDerWaalsContact CE1-CE1 3.41Å; F130-H156 WeakPolarHBondContact CE1-CE1 3.22Å; F130-H156 AromaticContact CE1-NE2 3.81Å; F130-H156 AromaticContact CG-NE2 3.65Å; F130-H156 AromaticContact CZ-CE1 3.66Å
131	D	86.9	Confident	88	Confident	111 Å²	111	46.8 Å²	46.8	59%	0.594	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.2	21.7	-177	-59.3	-28.8	0	0	0	115.3	D106	D106-D131 WeakPolarHBondContact OD1-CB 3.49Å
132	C	87.1	Confident	88.1	Confident	3 Å²	3	49.7 Å²	49.7	2%	0.02	26%	0.263	C	S	.	.	S	Bend	trans	-97.6	147.9	166.5	-62.6	0	0	0	0	110.7	L104 N107 F109 M129 F130 V134 S135	L104-C132 PolarHBondContact O-SG 3Å; L104-C132 VanDerWaalsContact O-SG 3.35Å; N107-C132 PolarHBondContact O-SG 3.45Å; F109-C132 HydrophobicContact CB-CB 4.47Å; M129-C132 WeakPolarHBondContact O-CB 3.29Å; M129-C132 PolarHBondContact O-SG 3.3Å; F130-C132 PolarHBondContact O-N 3.2Å; F130-C132 VanDerWaalsContact O-N 3.08Å; C132-V134 PolarHBondContact O-N 3.33Å; C132-S135 VanDerWaalsContact O-CB 3.31Å; C132-S135 WeakPolarHBondContact O-CB 3.49Å; C132-S135 PolarHBondContact O-N 3.34Å; C132-S135 PolarHBondContact O-OG 3.36Å
133	P	86.3	Confident	88.2	Confident	66 Å²	66	49.2 Å²	49.2	43%	0.429	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-54.9	-27.5	176.4	-25.5	31.7	0	0	0	114.5	N107 F109 S135	N107-P133 WeakPolarHBondContact O-CD 3.36Å; F109-P133 WeakPolarHBondContact O-CB 3.45Å; F109-P133 VanDerWaalsContact O-CD 3.29Å; F109-P133 WeakPolarHBondContact O-CD 3.33Å; P133-S135 VanDerWaalsContact C-N 3.34Å
134	V	87.4	Confident	88.2	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-67.4	-30	174.4	163.4	0	0	0	0	113.3	F109 A110 L112 I115 C132 L136 K137 Y140	F109-V134 HydrophobicContact CB-CG2 4.24Å; F109-V134 WeakPolarHBondContact O-CG2 3.44Å; F109-V134 PolarHBondContact O-N 2.93Å; A110-V134 WeakPolarHBondContact O-CG2 3.4Å; L112-V134 HydrophobicContact CD2-CG1 3.64Å; L112-V134 HydrophobicContact CG-CG1 3.97Å; I115-V134 HydrophobicContact CD1-CB 4.19Å; I115-V134 HydrophobicContact CD1-CG1 3.62Å; I115-V134 HydrophobicContact CD1-CG2 4.14Å; C132-V134 PolarHBondContact O-N 3.33Å; V134-L136 PolarHBondContact O-N 2.98Å; V134-K137 WeakPolarHBondContact O-CB 3.25Å; V134-K137 PolarHBondContact O-N 3.32Å; V134-Y140 HydrophobicContact CG1-CD2 3.29Å; V134-Y140 HydrophobicContact CG1-CE2 3.48Å; V134-Y140 VanDerWaalsContact CG1-CE2 3.48Å; V134-Y140 HydrophobicContact CG1-CG 4.36Å
135	S	86.1	Confident	88.1	Confident	43 Å²	43	45.5 Å²	45.5	30%	0.301	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-62.5	-25.4	-179.8	70.1	0	0	0	0	112.7	C132 P133 K137	C132-S135 VanDerWaalsContact O-CB 3.31Å; C132-S135 WeakPolarHBondContact O-CB 3.49Å; C132-S135 PolarHBondContact O-N 3.34Å; C132-S135 PolarHBondContact O-OG 3.36Å; P133-S135 VanDerWaalsContact C-N 3.34Å; S135-K137 PolarHBondContact O-N 3.38Å
136	L	87.2	Confident	87.9	Confident	154 Å²	154	47 Å²	47	81%	0.806	25%	0.247	S	C	*	.	G	3₁₀ helix	trans	-72.1	-14.1	176.2	-62.3	173.2	0	0	0	113.5	V134	V134-L136 PolarHBondContact O-N 2.98Å
137	K	86.9	Confident	87.7	Confident	94 Å²	94	48.7 Å²	48.7	41%	0.409	26%	0.259	S	S	.	.	S	Bend	trans	-77	131.3	-178.1	-67.9	-176.1	169.8	177.3	0	111.4	A110 L112 V134 S135 G139 Y140	A110-K137 WeakPolarHBondContact O-CE 3.34Å; A110-K137 PolarHBondContact O-NZ 3.24Å; L112-K137 HydrophobicContact CD1-CB 4.49Å; L112-K137 HydrophobicContact CD1-CD 4.17Å; L112-K137 HydrophobicContact CG-CD 4.35Å; V134-K137 WeakPolarHBondContact O-CB 3.25Å; V134-K137 PolarHBondContact O-N 3.32Å; S135-K137 PolarHBondContact O-N 3.38Å; K137-G139 PolarHBondContact O-N 3.01Å; K137-Y140 WeakPolarHBondContact O-CB 3.34Å; K137-Y140 PolarHBondContact O-N 3.49Å; K137-Y140 VanDerWaalsContact O-N 3.14Å
138	K	84	Confident	87.6	Confident	219 Å²	219	48.7 Å²	48.7	95%	0.952	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	130.1	175	-169.4	177.3	-179.5	-178.1	0	110.4	Y140	K138-Y140 VanDerWaalsContact C-N 3.31Å; K138-Y140 PolarHBondContact O-N 2.96Å
139	G	84.3	Confident	87.3	Confident	40 Å²	40	58.3 Å²	58.3	41%	0.412	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.3	4.5	179.9	0	0	0	0	0	115.3	K137 R141 H142 V143	K137-G139 PolarHBondContact O-N 3.01Å; G139-R141 VanDerWaalsContact C-N 3.29Å; G139-R141 PolarHBondContact O-N 3.46Å; G139-H142 PolarHBondContact O-N 2.88Å; G139-V143 WeakPolarHBondContact O-CG2 3.24Å; G139-V143 PolarHBondContact O-N 2.99Å
140	Y	89.1	Confident	87.4	Confident	12 Å²	12	60.1 Å²	60.1	5%	0.047	31%	0.307	C	S	.	.	H	α-helix	trans	-43.6	-53.6	174.8	159.3	-106.4	0	0	0	112.8	L112 M129 V134 K137 K138 H142 V143 L144	L112-Y140 HydrophobicContact CD2-CD2 3.78Å; L112-Y140 HydrophobicContact CD2-CE2 4.49Å; M129-Y140 WeakPolarHBondContact CB-OH 3.32Å; V134-Y140 HydrophobicContact CG1-CD2 3.29Å; V134-Y140 HydrophobicContact CG1-CE2 3.48Å; V134-Y140 VanDerWaalsContact CG1-CE2 3.48Å; V134-Y140 HydrophobicContact CG1-CG 4.36Å; K137-Y140 WeakPolarHBondContact O-CB 3.34Å; K137-Y140 PolarHBondContact O-N 3.49Å; K137-Y140 VanDerWaalsContact O-N 3.14Å; K138-Y140 VanDerWaalsContact C-N 3.31Å; K138-Y140 PolarHBondContact O-N 2.96Å; Y140-H142 PolarHBondContact O-N 3.05Å; Y140-V143 PolarHBondContact O-N 2.92Å; Y140-L144 HydrophobicContact CD2-CD1 4.07Å; Y140-L144 HydrophobicContact CD2-CG 4.11Å; Y140-L144 HydrophobicContact CE1-CD1 4.22Å; Y140-L144 HydrophobicContact CE2-CD1 3.19Å; Y140-L144 HydrophobicContact CE2-CD2 4.46Å; Y140-L144 HydrophobicContact CE2-CG 3.69Å; Y140-L144 PolarHBondContact O-N 2.95Å; Y140-L144 WeakPolarHBondContact OH-CD1 3.22Å
141	R	89.1	Confident	87.6	Confident	35 Å²	35	59 Å²	59	13%	0.132	30%	0.303	C	S	.	.	H	α-helix	trans	-61	-46.9	-176.1	-160.5	176.6	162.2	77.3	10.7	112	G139 L144 V145 L154 H157 E163	G139-R141 VanDerWaalsContact C-N 3.29Å; G139-R141 PolarHBondContact O-N 3.46Å; R141-L144 PolarHBondContact O-N 3.38Å; R141-V145 WeakPolarHBondContact O-CB 3.47Å; R141-V145 WeakPolarHBondContact O-CG2 3.48Å; R141-V145 PolarHBondContact O-N 2.71Å; R141-L154 HydrophobicContact CB-CD2 4.45Å; R141-L154 HydrophobicContact CG-CD2 3.65Å; R141-L154 PolarHBondContact NH1-O 3.07Å; R141-H157 PolarHBondContact NH2-O 3.27Å; R141-E163 IonicContact CZ-OE1 3.59Å; R141-E163 IonicContact CZ-OE2 2.63Å; R141-E163 VanDerWaalsContact CZ-OE2 3.29Å; R141-E163 IonicContact NE-OE1 3.29Å; R141-E163 PolarHBondContact NE-OE1 2.9Å; R141-E163 IonicContact NE-OE2 3.3Å; R141-E163 PolarHBondContact NE-OE2 3.39Å; R141-E163 IonicContact NH2-OE1 3.84Å; R141-E163 PolarHBondContact NH2-OE1 3.33Å; R141-E163 IonicContact NH2-OE2 3.44Å; R141-E163 PolarHBondContact NH2-OE2 2.8Å
142	H	87.9	Confident	87.8	Confident	62 Å²	62	57.2 Å²	57.2	29%	0.287	29%	0.29	S	S	.	.	H	α-helix	trans	-64.9	-40.9	179.3	175.3	-92.1	0	0	0	112.5	G139 Y140 N146 E163 Q166	G139-H142 PolarHBondContact O-N 2.88Å; Y140-H142 PolarHBondContact O-N 3.05Å; H142-N146 PolarHBondContact CD2-ND2 3.43Å; H142-N146 PolarHBondContact CE1-ND2 3.3Å; H142-N146 PolarHBondContact ND1-ND2 3.06Å; H142-N146 PolarHBondContact NE2-ND2 3.36Å; H142-N146 WeakPolarHBondContact O-CB 3.49Å; H142-N146 PolarHBondContact O-N 3.47Å; H142-N146 VanDerWaalsContact O-N 3.16Å; H142-N146 PolarHBondContact O-ND2 3.35Å; H142-N146 VanDerWaalsContact O-ND2 3.09Å; H142-E163 PolarHBondContact CD2-O 3.34Å; H142-E163 VanDerWaalsContact CD2-O 3.29Å; H142-Q166 PolarHBondContact CE1-NE2 3Å; H142-Q166 VanDerWaalsContact NE2-CG 3.27Å; H142-Q166 WeakPolarHBondContact NE2-CG 3.22Å
143	V	88.1	Confident	88	Confident	54 Å²	54	57 Å²	57	33%	0.327	29%	0.289	S	S	.	.	H	α-helix	trans	-64.3	-43.7	177.4	174.2	0	0	0	0	110.9	L112 G139 Y140 S147	L112-V143 HydrophobicContact CD2-CG1 4.47Å; G139-V143 WeakPolarHBondContact O-CG2 3.24Å; G139-V143 PolarHBondContact O-N 2.99Å; Y140-V143 PolarHBondContact O-N 2.92Å; V143-S147 VanDerWaalsContact O-CB 3.3Å; V143-S147 WeakPolarHBondContact O-CB 3.49Å; V143-S147 PolarHBondContact O-N 2.98Å; V143-S147 PolarHBondContact O-OG 3.29Å
144	L	88.5	Confident	88.2	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-67.4	-46.3	179.4	-74.5	-162.3	0	0	0	113.2	I115 L127 M129 Y140 R141 N146 S147 I148 L154	I115-L144 HydrophobicContact CB-CD2 3.96Å; I115-L144 HydrophobicContact CG2-CD1 4.37Å; I115-L144 HydrophobicContact CG2-CD2 3.42Å; I115-L144 VanDerWaalsContact CG2-CD2 3.42Å; L127-L144 HydrophobicContact CD2-CD1 4.39Å; M129-L144 HydrophobicContact SD-CD1 3.97Å; Y140-L144 HydrophobicContact CD2-CD1 4.07Å; Y140-L144 HydrophobicContact CD2-CG 4.11Å; Y140-L144 HydrophobicContact CE1-CD1 4.22Å; Y140-L144 HydrophobicContact CE2-CD1 3.19Å; Y140-L144 HydrophobicContact CE2-CD2 4.46Å; Y140-L144 HydrophobicContact CE2-CG 3.69Å; Y140-L144 PolarHBondContact O-N 2.95Å; Y140-L144 WeakPolarHBondContact OH-CD1 3.22Å; R141-L144 PolarHBondContact O-N 3.38Å; L144-N146 VanDerWaalsContact C-N 3.27Å; L144-N146 PolarHBondContact O-N 3.47Å; L144-S147 PolarHBondContact O-N 3.15Å; L144-S147 VanDerWaalsContact O-N 3.13Å; L144-I148 PolarHBondContact O-N 3.34Å; L144-L154 HydrophobicContact CB-CD2 4.22Å; L144-L154 HydrophobicContact CD1-CD1 4.13Å; L144-L154 HydrophobicContact CD1-CD2 4.32Å
145	V	89.3	Confident	88.3	Confident	7 Å²	7	54.9 Å²	54.9	4%	0.042	27%	0.273	C	S	.	.	H	α-helix	trans	-58.8	-42.3	179.7	170	0	0	0	0	110.7	R141 I148 L154 I159 E163 I164	R141-V145 WeakPolarHBondContact O-CB 3.47Å; R141-V145 WeakPolarHBondContact O-CG2 3.48Å; R141-V145 PolarHBondContact O-N 2.71Å; V145-I148 CarbonylContact O-C 3.59Å; V145-L154 HydrophobicContact CG2-CD2 4.17Å; V145-I159 HydrophobicContact CG1-CD1 4.31Å; V145-I159 HydrophobicContact CG1-CG2 3.69Å; V145-I159 HydrophobicContact CG2-CD1 3.73Å; V145-I159 HydrophobicContact CG2-CG1 3.88Å; V145-I159 HydrophobicContact CG2-CG2 4.11Å; V145-E163 HydrophobicContact CG1-CB 4.4Å; V145-I164 HydrophobicContact CG1-CG1 3.68Å
146	N	88.7	Confident	88.3	Confident	51 Å²	51	55.2 Å²	55.2	27%	0.273	27%	0.27	S	S	.	.	H	α-helix	trans	-75.1	-26	178.1	-71.7	-35.4	0	0	0	113.8	H142 L144 I164	H142-N146 PolarHBondContact CD2-ND2 3.43Å; H142-N146 PolarHBondContact CE1-ND2 3.3Å; H142-N146 PolarHBondContact ND1-ND2 3.06Å; H142-N146 PolarHBondContact NE2-ND2 3.36Å; H142-N146 WeakPolarHBondContact O-CB 3.49Å; H142-N146 PolarHBondContact O-N 3.47Å; H142-N146 VanDerWaalsContact O-N 3.16Å; H142-N146 PolarHBondContact O-ND2 3.35Å; H142-N146 VanDerWaalsContact O-ND2 3.09Å; L144-N146 VanDerWaalsContact C-N 3.27Å; L144-N146 PolarHBondContact O-N 3.47Å; N146-I164 PolarHBondContact OD1-O 2.94Å
147	S	87.9	Confident	88.4	Confident	36 Å²	36	49.8 Å²	49.8	25%	0.252	24%	0.24	S	C	.	.	H	α-helix	trans	-77.8	-34.9	175.9	-58.6	0	0	0	0	112.1	S119 V143 L144	S119-S147 WeakPolarHBondContact CB-O 3.4Å; V143-S147 VanDerWaalsContact O-CB 3.3Å; V143-S147 WeakPolarHBondContact O-CB 3.49Å; V143-S147 PolarHBondContact O-N 2.98Å; V143-S147 PolarHBondContact O-OG 3.29Å; L144-S147 PolarHBondContact O-N 3.15Å; L144-S147 VanDerWaalsContact O-N 3.13Å
148	I	88.6	Confident	88.5	Confident	1 Å²	1	45.3 Å²	45.3	1%	0.005	22%	0.221	C	C	.	.			trans	-111.9	84.2	-175.5	-49.4	172.5	0	0	0	109.3	L118 L124 L127 L144 V145 P150 L151	L118-I148 HydrophobicContact CB-CD1 3.71Å; L118-I148 HydrophobicContact CB-CG1 4.24Å; L118-I148 HydrophobicContact CD1-CD1 4.25Å; L124-I148 HydrophobicContact CD2-CG2 4.29Å; L127-I148 HydrophobicContact CD2-CD1 3.9Å; L144-I148 PolarHBondContact O-N 3.34Å; V145-I148 CarbonylContact O-C 3.59Å; I148-P150 VanDerWaalsContact C-CD 3.42Å; I148-P150 HydrophobicContact CG2-CG 4.18Å; I148-L151 HydrophobicContact CB-CB 4.17Å; I148-L151 HydrophobicContact CG2-CB 3.9Å; I148-L151 WeakPolarHBondContact O-CB 3.47Å; I148-L151 PolarHBondContact O-N 3.49Å
149	W	85.2	Confident	88.8	Confident	202 Å²	202	35 Å²	35	77%	0.765	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-37.7	-177.6	-163.1	-95.9	0	0	0	116.7	L151	W149-L151 PolarHBondContact O-N 3.48Å
150	P	89.8	Confident	89	Confident	37 Å²	37	33.2 Å²	33.2	24%	0.24	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75	-9.3	-178.7	28.5	-34.1	0	0	0	113.8	C121 P122 L124 I148	C121-P150 WeakPolarHBondContact O-CG 3.26Å; P122-P150 WeakPolarHBondContact O-CB 3.29Å; L124-P150 CarbonylContact O-C 3.59Å; I148-P150 VanDerWaalsContact C-CD 3.42Å; I148-P150 HydrophobicContact CG2-CG 4.18Å
151	L	91.2	Very high	88.8	Confident	13 Å²	13	33.4 Å²	33.4	7%	0.068	16%	0.159	C	C	.	.			trans	-67.3	134.2	-173.1	-164	68.5	0	0	0	111.3	L124 L127 I148 W149 A153 L154 I159	L124-L151 HydrophobicContact CD2-CD1 4.33Å; L124-L151 HydrophobicContact CG-CD1 4.23Å; L124-L151 WeakPolarHBondContact O-CA 3.34Å; L124-L151 PolarHBondContact O-N 3.47Å; L127-L151 HydrophobicContact CB-CD1 3.66Å; L127-L151 HydrophobicContact CB-CD2 4.33Å; I148-L151 HydrophobicContact CB-CB 4.17Å; I148-L151 HydrophobicContact CG2-CB 3.9Å; I148-L151 WeakPolarHBondContact O-CB 3.47Å; I148-L151 PolarHBondContact O-N 3.49Å; W149-L151 PolarHBondContact O-N 3.48Å; L151-A153 WeakPolarHBondContact CD1-O 3.4Å; L151-L154 HydrophobicContact CD2-CB 4.17Å; L151-L154 HydrophobicContact CD2-CD1 4.23Å; L151-I159 HydrophobicContact CB-CD1 3.99Å; L151-I159 HydrophobicContact CD2-CD1 3.89Å; L151-I159 HydrophobicContact CG-CD1 3.71Å; L151-I159 WeakPolarHBondContact O-CD1 3.49Å
152	K	90.8	Very high	88.6	Confident	72 Å²	72	33.9 Å²	33.9	31%	0.313	16%	0.163	S	C	.	.			trans	-114.8	-23.7	178.7	-68.4	-176.2	180	175.7	0	113.3	I125 I159 I209 N210 L213	I125-K152 HydrophobicContact CG2-CB 4.22Å; I125-K152 HydrophobicContact CG2-CD 4.17Å; I125-K152 PolarHBondContact O-N 2.95Å; K152-I159 PolarHBondContact O-N 2.97Å; K152-I209 HydrophobicContact CB-CG2 3.71Å; K152-I209 HydrophobicContact CD-CG2 4.31Å; K152-N210 PolarHBondContact NZ-OD1 3.49Å; K152-L213 HydrophobicContact CB-CD1 3.9Å; K152-L213 HydrophobicContact CD-CD1 3.92Å; K152-L213 HydrophobicContact CG-CD1 4Å
153	A	91.3	Very high	88.4	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	134.8	-173	0	0	0	0	0	109.9	I125 A126 L127 L151 F185 I209	I125-A153 PolarHBondContact O-N 3.47Å; I125-A153 VanDerWaalsContact O-N 3.14Å; A126-A153 WeakPolarHBondContact CA-O 3.34Å; A126-A153 HydrophobicContact CB-CB 3.79Å; L127-A153 PolarHBondContact N-O 2.82Å; L127-A153 VanDerWaalsContact N-O 3.12Å; L151-A153 WeakPolarHBondContact CD1-O 3.4Å; A153-F185 HydrophobicContact CB-CD1 4.46Å; A153-F185 HydrophobicContact CB-CE1 3.55Å; A153-F185 HydrophobicContact CB-CE2 3.76Å; A153-F185 HydrophobicContact CB-CZ 3.2Å; A153-I209 HydrophobicContact CB-CD1 3.75Å; A153-I209 HydrophobicContact CB-CG1 4.11Å; A153-I209 HydrophobicContact CB-CG2 4.42Å
154	L	90.7	Very high	88.3	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	128.1	178.7	-179.6	64.6	0	0	0	109.7	L127 R141 L144 V145 L151 H156 H157 I159	L127-L154 HydrophobicContact CB-CD1 4.09Å; L127-L154 HydrophobicContact CD2-CD1 4.04Å; L127-L154 HydrophobicContact CG-CD1 4.06Å; L127-L154 CarbonylContact O-C 3.48Å; L127-L154 WeakPolarHBondContact O-CA 3.18Å; R141-L154 HydrophobicContact CB-CD2 4.45Å; R141-L154 HydrophobicContact CG-CD2 3.65Å; R141-L154 PolarHBondContact NH1-O 3.07Å; L144-L154 HydrophobicContact CB-CD2 4.22Å; L144-L154 HydrophobicContact CD1-CD1 4.13Å; L144-L154 HydrophobicContact CD1-CD2 4.32Å; V145-L154 HydrophobicContact CG2-CD2 4.17Å; L151-L154 HydrophobicContact CD2-CB 4.17Å; L151-L154 HydrophobicContact CD2-CD1 4.23Å; L154-H156 PolarHBondContact O-N 3.2Å; L154-H157 PolarHBondContact N-O 3.26Å; L154-H157 PolarHBondContact O-N 3.26Å; L154-I159 HydrophobicContact CB-CG1 4.34Å
155	D	89.2	Confident	88.1	Confident	20 Å²	20	34.9 Å²	34.9	11%	0.107	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	58	-109	-178.8	-55.7	-39.1	0	0	0	113.6	L127 M129 F130 F185	L127-D155 PolarHBondContact O-N 3.34Å; M129-D155 WeakPolarHBondContact CA-OD1 3.43Å; M129-D155 PolarHBondContact N-OD1 3.47Å; F130-D155 HydrophobicContact CB-CB 4.38Å; F130-D155 HydrophobicContact CD1-CB 4.34Å; F130-D155 PolarHBondContact N-OD1 3.4Å; F130-D155 VanDerWaalsContact N-OD1 3.07Å; D155-F185 WeakPolarHBondContact O-CD2 3.46Å; D155-F185 WeakPolarHBondContact O-CE2 3.34Å
156	H	86.4	Confident	87.5	Confident	50 Å²	50	40.6 Å²	40.6	23%	0.231	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.1	7.5	177	-55.5	-59.1	0	0	0	113	F130 L154 F182 F183	F130-H156 AromaticContact CD1-CE1 3.65Å; F130-H156 AromaticContact CD1-NE2 3.62Å; F130-H156 AromaticContact CD2-NE2 3.86Å; F130-H156 AromaticContact CE1-CE1 3.41Å; F130-H156 VanDerWaalsContact CE1-CE1 3.41Å; F130-H156 WeakPolarHBondContact CE1-CE1 3.22Å; F130-H156 AromaticContact CE1-NE2 3.81Å; F130-H156 AromaticContact CG-NE2 3.65Å; F130-H156 AromaticContact CZ-CE1 3.66Å; L154-H156 PolarHBondContact O-N 3.2Å; H156-F182 HydrophobicContact CB-CD2 4.08Å; H156-F182 HydrophobicContact CB-CE2 3.74Å; H156-F182 WeakPolarHBondContact O-CA 3.4Å; H156-F182 WeakPolarHBondContact O-CD2 3.4Å; H156-F183 CarbonylContact C-O 3.19Å; H156-F183 CarbonylContact O-C 3.39Å; H156-F183 PolarHBondContact O-N 2.74Å
157	H	89.4	Confident	87	Confident	40 Å²	40	45.3 Å²	45.3	19%	0.185	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	131.9	-173	-64.9	90.1	0	0	0	112.5	R141 L154 L181 F182	R141-H157 PolarHBondContact NH2-O 3.27Å; L154-H157 PolarHBondContact N-O 3.26Å; L154-H157 PolarHBondContact O-N 3.26Å; H157-L181 WeakPolarHBondContact CA-O 3.21Å; H157-F182 AromaticContact NE2-CD2 3.79Å
158	V	90	Very high	86.5	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	136.8	166.2	177	0	0	0	0	109.2	S160 L181 F183 F185 I212 L213	V158-S160 PolarHBondContact O-N 3.44Å; V158-L181 HydrophobicContact CB-CB 4.38Å; V158-L181 HydrophobicContact CB-CD2 4.15Å; V158-L181 HydrophobicContact CG1-CD2 4.29Å; V158-L181 PolarHBondContact N-O 2.99Å; V158-F183 HydrophobicContact CG2-CB 4.47Å; V158-F185 HydrophobicContact CG2-CZ 4.35Å; V158-I212 HydrophobicContact CB-CG2 3.98Å; V158-I212 HydrophobicContact CG1-CG2 4.09Å; V158-I212 HydrophobicContact CG2-CB 4.19Å; V158-I212 HydrophobicContact CG2-CD1 4.05Å; V158-I212 HydrophobicContact CG2-CG2 3.84Å; V158-L213 HydrophobicContact CG1-CD1 4.4Å; V158-L213 HydrophobicContact CG1-CD2 3.42Å; V158-L213 VanDerWaalsContact CG1-CD2 3.42Å; V158-L213 HydrophobicContact CG1-CG 3.53Å
159	I	90.3	Very high	85.9	Confident	4 Å²	4	56.6 Å²	56.6	2%	0.021	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-65.8	131.1	-176.4	-65.1	166	0	0	0	109.6	V145 L151 K152 L154 E163 I164 L213	V145-I159 HydrophobicContact CG1-CD1 4.31Å; V145-I159 HydrophobicContact CG1-CG2 3.69Å; V145-I159 HydrophobicContact CG2-CD1 3.73Å; V145-I159 HydrophobicContact CG2-CG1 3.88Å; V145-I159 HydrophobicContact CG2-CG2 4.11Å; L151-I159 HydrophobicContact CB-CD1 3.99Å; L151-I159 HydrophobicContact CD2-CD1 3.89Å; L151-I159 HydrophobicContact CG-CD1 3.71Å; L151-I159 WeakPolarHBondContact O-CD1 3.49Å; K152-I159 PolarHBondContact O-N 2.97Å; L154-I159 HydrophobicContact CB-CG1 4.34Å; I159-E163 HydrophobicContact CG2-CB 4.29Å; I159-I164 HydrophobicContact CG2-CD1 3.99Å; I159-I164 HydrophobicContact CG2-CG1 3.87Å; I159-L213 WeakPolarHBondContact O-CD2 3.18Å
160	S	86.6	Confident	85.6	Confident	2 Å²	2	48.1 Å²	48.1	1%	0.014	23%	0.232	C	C	.	.	P	Polyproline II helix	trans	-91.5	152.9	173.1	58.3	0	0	0	0	111.4	V158 E162 E163 A176	V158-S160 PolarHBondContact O-N 3.44Å; S160-E162 PolarHBondContact O-N 3.08Å; S160-E162 VanDerWaalsContact O-N 3.15Å; S160-E163 WeakPolarHBondContact O-CB 3.38Å; S160-E163 PolarHBondContact O-N 2.91Å; S160-E163 WeakPolarHBondContact OG-CG 3.26Å; S160-A176 VanDerWaalsContact OG-CA 3.29Å; S160-A176 WeakPolarHBondContact OG-CA 3.02Å
161	D	85	Confident	85.2	Confident	16 Å²	16	50.5 Å²	50.5	9%	0.086	25%	0.247	C	C	.	.	H	α-helix	trans	-59.5	-27.2	176.5	-62.5	-17.7	0	0	0	112.7	E163 I164 I165 L170 S217 P218 V219	D161-E163 PolarHBondContact O-N 3.2Å; D161-I164 PolarHBondContact O-N 2.9Å; D161-I165 PolarHBondContact O-N 3.38Å; D161-L170 HydrophobicContact CB-CD1 4.19Å; D161-S217 VanDerWaalsContact CG-OG 3.26Å; D161-S217 PolarHBondContact OD1-OG 3.5Å; D161-S217 WeakPolarHBondContact OD2-CA 3.26Å; D161-S217 WeakPolarHBondContact OD2-CB 3.43Å; D161-S217 PolarHBondContact OD2-OG 2.97Å; D161-P218 WeakPolarHBondContact OD2-CD 3.48Å; D161-P218 VanDerWaalsContact OD2-N 3.17Å; D161-V219 WeakPolarHBondContact OD2-CG2 3.34Å; D161-V219 PolarHBondContact OD2-N 2.75Å; D161-V219 VanDerWaalsContact OD2-N 3.12Å
162	E	85	Confident	84.6	Confident	44 Å²	44	57.5 Å²	57.5	21%	0.206	28%	0.279	C	S	.	.	H	α-helix	trans	-61.7	-28	173.4	175.4	174.2	-152.1	0	0	113.1	S160 W168 L170 K175 A176	S160-E162 PolarHBondContact O-N 3.08Å; S160-E162 VanDerWaalsContact O-N 3.15Å; E162-W168 WeakPolarHBondContact CG-O 3.14Å; E162-L170 HydrophobicContact CB-CD1 4.11Å; E162-K175 VanDerWaalsContact OE2-CA 3.31Å; E162-K175 WeakPolarHBondContact OE2-CA 3.28Å; E162-K175 WeakPolarHBondContact OE2-CG 3.42Å; E162-A176 PolarHBondContact OE2-N 3.42Å
163	E	84.6	Confident	84.1	Confident	12 Å²	12	59.4 Å²	59.4	6%	0.056	29%	0.285	C	S	.	.	H	α-helix	trans	-81.6	-23.5	179.7	-67.9	166.2	-173	0	0	112.3	R141 H142 V145 I159 S160 D161 A176	R141-E163 IonicContact CZ-OE1 3.59Å; R141-E163 IonicContact CZ-OE2 2.63Å; R141-E163 VanDerWaalsContact CZ-OE2 3.29Å; R141-E163 IonicContact NE-OE1 3.29Å; R141-E163 PolarHBondContact NE-OE1 2.9Å; R141-E163 IonicContact NE-OE2 3.3Å; R141-E163 PolarHBondContact NE-OE2 3.39Å; R141-E163 IonicContact NH2-OE1 3.84Å; R141-E163 PolarHBondContact NH2-OE1 3.33Å; R141-E163 IonicContact NH2-OE2 3.44Å; R141-E163 PolarHBondContact NH2-OE2 2.8Å; H142-E163 PolarHBondContact CD2-O 3.34Å; H142-E163 VanDerWaalsContact CD2-O 3.29Å; V145-E163 HydrophobicContact CG1-CB 4.4Å; I159-E163 HydrophobicContact CG2-CB 4.29Å; S160-E163 WeakPolarHBondContact O-CB 3.38Å; S160-E163 PolarHBondContact O-N 2.91Å; S160-E163 WeakPolarHBondContact OG-CG 3.26Å; D161-E163 PolarHBondContact O-N 3.2Å; E163-A176 HydrophobicContact CG-CB 3.86Å; E163-A176 VanDerWaalsContact OE1-CB 3.27Å; E163-A176 WeakPolarHBondContact OE1-CB 3.17Å
164	I	85.8	Confident	83.6	Confident	62 Å²	62	60.8 Å²	60.8	32%	0.318	29%	0.291	S	S	.	.	H	α-helix	trans	-87.5	-40.6	-179.3	-58.3	170.8	0	0	0	110	V145 N146 I159 D161	V145-I164 HydrophobicContact CG1-CG1 3.68Å; N146-I164 PolarHBondContact OD1-O 2.94Å; I159-I164 HydrophobicContact CG2-CD1 3.99Å; I159-I164 HydrophobicContact CG2-CG1 3.87Å; D161-I164 PolarHBondContact O-N 2.9Å
165	I	84.3	Confident	83.2	Confident	64 Å²	64	66.4 Å²	66.4	33%	0.328	32%	0.315	S	S	.	.	S	Bend	trans	-104.9	110.7	-174.4	-50.9	171.2	0	0	0	109.9	D161 N167 W168	D161-I165 PolarHBondContact O-N 3.38Å; I165-N167 PolarHBondContact O-N 3.46Å; I165-W168 HydrophobicContact CB-CB 4.13Å; I165-W168 HydrophobicContact CB-CE3 3.95Å; I165-W168 HydrophobicContact CD1-CD2 4.36Å; I165-W168 HydrophobicContact CD1-CE3 3.31Å; I165-W168 HydrophobicContact CD1-CH2 4.46Å; I165-W168 HydrophobicContact CD1-CZ3 3.37Å; I165-W168 HydrophobicContact CG1-CE3 4.21Å; I165-W168 HydrophobicContact CG2-CB 4.19Å; I165-W168 HydrophobicContact CG2-CE3 3.78Å; I165-W168 PolarHBondContact O-N 3.03Å
166	Q	77.7	Confident	82.7	Confident	127 Å²	127	67 Å²	67	59%	0.593	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	137.2	176.2	-71.9	176.8	15.7	0	0	111.2	H142 W168	H142-Q166 PolarHBondContact CE1-NE2 3Å; H142-Q166 VanDerWaalsContact NE2-CG 3.27Å; H142-Q166 WeakPolarHBondContact NE2-CG 3.22Å; Q166-W168 VanDerWaalsContact C-N 3.26Å; Q166-W168 PolarHBondContact O-N 3.44Å
167	N	76.3	Confident	82.3	Confident	149 Å²	149	67.7 Å²	67.7	80%	0.797	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.8	20.8	177.5	-51.7	-34.9	0	0	0	115.3	I165	I165-N167 PolarHBondContact O-N 3.46Å
168	W	77.7	Confident	81.9	Confident	109 Å²	109	67 Å²	67	41%	0.413	33%	0.331	S	S	.	.			trans	-91.8	109	172.1	-166.2	-41.5	0	0	0	111.3	E162 I165 Q166 L170	E162-W168 WeakPolarHBondContact CG-O 3.14Å; I165-W168 HydrophobicContact CB-CB 4.13Å; I165-W168 HydrophobicContact CB-CE3 3.95Å; I165-W168 HydrophobicContact CD1-CD2 4.36Å; I165-W168 HydrophobicContact CD1-CE3 3.31Å; I165-W168 HydrophobicContact CD1-CH2 4.46Å; I165-W168 HydrophobicContact CD1-CZ3 3.37Å; I165-W168 HydrophobicContact CG1-CE3 4.21Å; I165-W168 HydrophobicContact CG2-CB 4.19Å; I165-W168 HydrophobicContact CG2-CE3 3.78Å; I165-W168 PolarHBondContact O-N 3.03Å; Q166-W168 VanDerWaalsContact C-N 3.26Å; Q166-W168 PolarHBondContact O-N 3.44Å; W168-L170 HydrophobicContact CG-CG 4.45Å
169	H	76.3	Confident	81.2	Confident	165 Å²	165	73.6 Å²	73.6	76%	0.764	36%	0.361	S	S	*	.			trans	-88.6	110.8	173.4	-60.3	-54.7	0	0	0	111.8
170	L	79.2	Confident	80.8	Confident	25 Å²	25	79.3 Å²	79.3	13%	0.131	38%	0.382	C	S	.	.			trans	-96.6	152.2	178.7	-77.9	171.9	0	0	0	112.5	D161 E162 W168 F174 P218	D161-L170 HydrophobicContact CB-CD1 4.19Å; E162-L170 HydrophobicContact CB-CD1 4.11Å; W168-L170 HydrophobicContact CG-CG 4.45Å; L170-F174 HydrophobicContact CB-CB 4.02Å; L170-F174 HydrophobicContact CD1-CB 3.81Å; L170-F174 HydrophobicContact CD2-CB 4.46Å; L170-F174 HydrophobicContact CG-CB 4.31Å; L170-P218 HydrophobicContact CD1-CG 4.21Å; L170-P218 HydrophobicContact CD2-CG 3.86Å
171	P	80.6	Confident	80.6	Confident	86 Å²	86	79.2 Å²	79.2	56%	0.558	38%	0.382	S	S	*	.			trans	-55.7	152.7	168.7	-23	32.1	0	0	0	111.7	R173 F174 K175	P171-R173 PolarHBondContact O-N 3.49Å; P171-F174 PolarHBondContact O-N 2.91Å; P171-K175 PolarHBondContact O-N 3.45Å
172	E	79.7	Confident	80.6	Confident	160 Å²	160	83.9 Å²	83.9	75%	0.748	40%	0.401	S	S	*	.	G	3₁₀ helix	trans	-46.6	-35.9	-174.7	-169.8	177.9	-173.4	0	0	113.8	F174 K175 N178	E172-F174 VanDerWaalsContact C-N 3.26Å; E172-F174 PolarHBondContact O-N 3.2Å; E172-K175 WeakPolarHBondContact O-CB 3.37Å; E172-K175 PolarHBondContact O-N 3.19Å; E172-N178 PolarHBondContact O-ND2 3.28Å
173	R	79.5	Confident	80.5	Confident	113 Å²	113	83.1 Å²	83.1	43%	0.426	40%	0.398	S	S	.	.	G	3₁₀ helix	trans	-53.3	-37.4	175.8	178.9	178.5	172.4	-167.8	-4.6	114.3	P171 H215	P171-R173 PolarHBondContact O-N 3.49Å; R173-H215 PolarHBondContact NH2-O 2.91Å
174	F	80.7	Confident	80.2	Confident	29 Å²	29	86.2 Å²	86.2	13%	0.127	41%	0.414	C	S	.	.	G	3₁₀ helix	trans	-111.1	7.7	-172.7	-51.2	-65.5	0	0	0	113	L170 P171 E172 N216 P218 I221	L170-F174 HydrophobicContact CB-CB 4.02Å; L170-F174 HydrophobicContact CD1-CB 3.81Å; L170-F174 HydrophobicContact CD2-CB 4.46Å; L170-F174 HydrophobicContact CG-CB 4.31Å; P171-F174 PolarHBondContact O-N 2.91Å; E172-F174 VanDerWaalsContact C-N 3.26Å; E172-F174 PolarHBondContact O-N 3.2Å; F174-N216 WeakPolarHBondContact CD1-O 3.34Å; F174-P218 HydrophobicContact CB-CG 4.11Å; F174-P218 HydrophobicContact CD1-CG 3.96Å; F174-P218 HydrophobicContact CD2-CG 3.74Å; F174-P218 HydrophobicContact CE1-CG 4.18Å; F174-P218 HydrophobicContact CE2-CG 4.01Å; F174-P218 HydrophobicContact CG-CG 3.68Å; F174-P218 HydrophobicContact CZ-CG 4.2Å; F174-I221 HydrophobicContact CE1-CD1 4.12Å; F174-I221 HydrophobicContact CZ-CD1 4.28Å
175	K	83	Confident	79.5	Confident	117 Å²	117	83.3 Å²	83.3	51%	0.509	40%	0.399	S	S	.	.			trans	-63.2	146.4	179.4	-167.2	174.5	-177.4	177.5	0	111.5	E162 P171 E172 N178	E162-K175 VanDerWaalsContact OE2-CA 3.31Å; E162-K175 WeakPolarHBondContact OE2-CA 3.28Å; E162-K175 WeakPolarHBondContact OE2-CG 3.42Å; P171-K175 PolarHBondContact O-N 3.45Å; E172-K175 WeakPolarHBondContact O-CB 3.37Å; E172-K175 PolarHBondContact O-N 3.19Å; K175-N178 WeakPolarHBondContact O-CB 3.43Å
176	A	79.3	Confident	78.5	Confident	33 Å²	33	81.7 Å²	81.7	27%	0.273	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.6	144.2	172	0	0	0	0	0	112.6	S160 E162 E163 N178	S160-A176 VanDerWaalsContact OG-CA 3.29Å; S160-A176 WeakPolarHBondContact OG-CA 3.02Å; E162-A176 PolarHBondContact OE2-N 3.42Å; E163-A176 HydrophobicContact CG-CB 3.86Å; E163-A176 VanDerWaalsContact OE1-CB 3.27Å; E163-A176 WeakPolarHBondContact OE1-CB 3.17Å; A176-N178 PolarHBondContact O-N 3.35Å; A176-N178 VanDerWaalsContact O-N 3.16Å
177	C	76.4	Confident	77.8	Confident	64 Å²	64	78.6 Å²	78.6	43%	0.432	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	53	30.5	178.5	-60.3	0	0	0	0	115.9
178	N	81.1	Confident	76.7	Confident	27 Å²	27	77.4 Å²	77.4	14%	0.144	38%	0.383	C	S	.	.			trans	-77	153.6	175.3	-161.4	-8.3	0	0	0	112	E172 K175 A176 R180 L181 F182	E172-N178 PolarHBondContact O-ND2 3.28Å; K175-N178 WeakPolarHBondContact O-CB 3.43Å; A176-N178 PolarHBondContact O-N 3.35Å; A176-N178 VanDerWaalsContact O-N 3.16Å; N178-R180 PolarHBondContact O-N 3.13Å; N178-L181 WeakPolarHBondContact O-CB 3.41Å; N178-L181 PolarHBondContact O-N 2.79Å; N178-F182 PolarHBondContact O-N 3.28Å
179	H	77.1	Confident	75.7	Confident	137 Å²	137	75 Å²	75	63%	0.634	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.7	-25.8	177.5	67.9	-82.5	0	0	0	114.2	L181 F182	H179-L181 VanDerWaalsContact C-N 3.35Å; H179-F182 WeakPolarHBondContact O-CB 3.47Å
180	R	80.7	Confident	74.6	Confident	124 Å²	124	76.2 Å²	76.2	47%	0.468	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-20.5	177.9	-60.1	-172.7	175.9	-165.9	-0.1	114.1	N178 N216	N178-R180 PolarHBondContact O-N 3.13Å; R180-N216 PolarHBondContact O-ND2 3.28Å
181	L	83.7	Confident	73.4	Confident	1 Å²	1	84.5 Å²	84.5	1%	0.005	41%	0.411	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-11	175.7	-64.3	172.6	0	0	0	111.4	H157 V158 N178 H179 F183 I212 N216	H157-L181 WeakPolarHBondContact CA-O 3.21Å; V158-L181 HydrophobicContact CB-CB 4.38Å; V158-L181 HydrophobicContact CB-CD2 4.15Å; V158-L181 HydrophobicContact CG1-CD2 4.29Å; V158-L181 PolarHBondContact N-O 2.99Å; N178-L181 WeakPolarHBondContact O-CB 3.41Å; N178-L181 PolarHBondContact O-N 2.79Å; H179-L181 VanDerWaalsContact C-N 3.35Å; L181-F183 PolarHBondContact O-N 3.43Å; L181-I212 HydrophobicContact CD2-CG2 3.99Å; L181-N216 HydrophobicContact CD2-CB 3.68Å
182	F	84.4	Confident	72.2	Confident	113 Å²	113	82.7 Å²	82.7	50%	0.496	41%	0.407	S	S	.	.	B	Isolated β-bridge	trans	-62.8	122.5	175.4	-178.5	-97.7	0	0	0	110.7	H156 H157 N178 H179	H156-F182 HydrophobicContact CB-CD2 4.08Å; H156-F182 HydrophobicContact CB-CE2 3.74Å; H156-F182 WeakPolarHBondContact O-CA 3.4Å; H156-F182 WeakPolarHBondContact O-CD2 3.4Å; H157-F182 AromaticContact NE2-CD2 3.79Å; N178-F182 PolarHBondContact O-N 3.28Å; H179-F182 WeakPolarHBondContact O-CB 3.47Å
183	F	82.5	Confident	71.5	Confident	29 Å²	29	75.7 Å²	75.7	13%	0.127	38%	0.376	C	S	.	.			trans	-153.8	116.8	171.5	177.7	-136.3	0	0	0	108.3	H156 V158 L181 F185 I205 K208 I209 I212	H156-F183 CarbonylContact C-O 3.19Å; H156-F183 CarbonylContact O-C 3.39Å; H156-F183 PolarHBondContact O-N 2.74Å; V158-F183 HydrophobicContact CG2-CB 4.47Å; L181-F183 PolarHBondContact O-N 3.43Å; F183-F185 HydrophobicContact CB-CE1 4.24Å; F183-F185 HydrophobicContact CB-CZ 4.39Å; F183-F185 AromaticContact CD1-CD1 3.44Å; F183-F185 HydrophobicContact CD1-CD1 3.44Å; F183-F185 VanDerWaalsContact CD1-CD1 3.44Å; F183-F185 AromaticContact CD1-CE1 3.14Å; F183-F185 HydrophobicContact CD1-CE1 3.14Å; F183-F185 HydrophobicContact CD1-CZ 4.08Å; F183-F185 AromaticContact CE1-CD1 3.47Å; F183-F185 HydrophobicContact CE1-CD1 3.47Å; F183-F185 VanDerWaalsContact CE1-CD1 3.47Å; F183-F185 AromaticContact CE1-CE1 3.64Å; F183-F185 HydrophobicContact CE1-CE1 3.64Å; F183-F185 HydrophobicContact CG-CD1 4.3Å; F183-F185 HydrophobicContact CG-CE1 4.01Å; F183-F185 HydrophobicContact CZ-CD1 4.42Å; F183-F185 VanDerWaalsContact O-CE2 3.32Å; F183-F185 WeakPolarHBondContact O-CE2 3.46Å; F183-F185 WeakPolarHBondContact O-CZ 3.49Å; F183-F185 PolarHBondContact O-N 3.46Å; F183-I205 HydrophobicContact CE1-CG2 4.26Å; F183-I205 HydrophobicContact CZ-CG1 4.44Å; F183-K208 HydrophobicContact CD1-CB 4.44Å; F183-K208 HydrophobicContact CD1-CG 4.2Å; F183-K208 HydrophobicContact CD2-CG 4.21Å; F183-K208 HydrophobicContact CE1-CB 3.82Å; F183-K208 HydrophobicContact CE1-CG 3.92Å; F183-K208 HydrophobicContact CE2-CB 4.45Å; F183-K208 HydrophobicContact CE2-CG 3.86Å; F183-K208 HydrophobicContact CG-CG 4.42Å; F183-K208 HydrophobicContact CZ-CB 3.83Å; F183-K208 HydrophobicContact CZ-CG 3.75Å; F183-I209 HydrophobicContact CD1-CG1 4.08Å; F183-I209 HydrophobicContact CE1-CG1 4.12Å; F183-I212 HydrophobicContact CB-CD1 3.75Å; F183-I212 HydrophobicContact CD1-CD1 4.25Å; F183-I212 HydrophobicContact CG-CD1 4.05Å
184	N	79.4	Confident	71.3	Confident	76 Å²	76	73.7 Å²	73.7	41%	0.406	38%	0.376	S	S	.	.			trans	-80.3	115.8	176.2	-170.7	-0.5	0	0	0	109.8	C186	N184-C186 PolarHBondContact OD1-N 3.13Å; N184-C186 VanDerWaalsContact OD1-N 3.09Å
185	F	70.1	Confident	71.1	Confident	1 Å²	1	75.2 Å²	75.2	0%	0.004	38%	0.381	C	S	.	.			trans	-83.7	-11.9	-179.3	-45.3	-72.7	0	0	0	113.4	Y103 T128 A153 D155 V158 F183 P187 I205 I209	Y103-F185 HydrophobicContact CE1-CB 4.3Å; Y103-F185 PolarHBondContact OH-O 3.31Å; T128-F185 HydrophobicContact CG2-CD2 4.35Å; A153-F185 HydrophobicContact CB-CD1 4.46Å; A153-F185 HydrophobicContact CB-CE1 3.55Å; A153-F185 HydrophobicContact CB-CE2 3.76Å; A153-F185 HydrophobicContact CB-CZ 3.2Å; D155-F185 WeakPolarHBondContact O-CD2 3.46Å; D155-F185 WeakPolarHBondContact O-CE2 3.34Å; V158-F185 HydrophobicContact CG2-CZ 4.35Å; F183-F185 HydrophobicContact CB-CE1 4.24Å; F183-F185 HydrophobicContact CB-CZ 4.39Å; F183-F185 AromaticContact CD1-CD1 3.44Å; F183-F185 HydrophobicContact CD1-CD1 3.44Å; F183-F185 VanDerWaalsContact CD1-CD1 3.44Å; F183-F185 AromaticContact CD1-CE1 3.14Å; F183-F185 HydrophobicContact CD1-CE1 3.14Å; F183-F185 HydrophobicContact CD1-CZ 4.08Å; F183-F185 AromaticContact CE1-CD1 3.47Å; F183-F185 HydrophobicContact CE1-CD1 3.47Å; F183-F185 VanDerWaalsContact CE1-CD1 3.47Å; F183-F185 AromaticContact CE1-CE1 3.64Å; F183-F185 HydrophobicContact CE1-CE1 3.64Å; F183-F185 HydrophobicContact CG-CD1 4.3Å; F183-F185 HydrophobicContact CG-CE1 4.01Å; F183-F185 HydrophobicContact CZ-CD1 4.42Å; F183-F185 VanDerWaalsContact O-CE2 3.32Å; F183-F185 WeakPolarHBondContact O-CE2 3.46Å; F183-F185 WeakPolarHBondContact O-CZ 3.49Å; F183-F185 PolarHBondContact O-N 3.46Å; F185-P187 WeakPolarHBondContact O-CD 3.38Å; F185-I205 HydrophobicContact CD1-CG2 3.99Å; F185-I209 HydrophobicContact CD1-CD1 3.93Å; F185-I209 HydrophobicContact CD1-CG1 4.19Å; F185-I209 HydrophobicContact CE1-CD1 3.61Å; F185-I209 HydrophobicContact CE1-CG1 3.53Å; F185-I209 HydrophobicContact CZ-CG1 4.49Å
186	C	63.7	Low	70.9	Confident	31 Å²	31	76.3 Å²	76.3	21%	0.209	39%	0.388	C	S	.	.			trans	-88.8	98.2	-178.1	-58.5	0	0	0	0	109.5	N184	N184-C186 PolarHBondContact OD1-N 3.13Å; N184-C186 VanDerWaalsContact OD1-N 3.09Å
187	P	61.9	Low	71	Confident	62 Å²	62	79.1 Å²	79.1	40%	0.403	40%	0.395	S	S	.	.			trans	-65.8	141.4	166.7	29.5	-34.4	0	0	0	108.9	F185 L189	F185-P187 WeakPolarHBondContact O-CD 3.38Å; P187-L189 PolarHBondContact O-N 3.27Å; P187-L189 VanDerWaalsContact O-N 3.14Å
188	T	54.4	Low	71.2	Confident	123 Å²	123	76.3 Å²	76.3	76%	0.755	38%	0.376	S	S	*	.			trans	-56.3	119.6	164.8	49.4	0	0	0	0	108.1	R190	T188-R190 PolarHBondContact O-N 3.25Å
189	L	56.1	Low	71.3	Confident	60 Å²	60	76.5 Å²	76.5	31%	0.314	38%	0.377	S	S	.	.			trans	-52.1	105.2	175.1	-83.2	146	0	0	0	109.2	V56 P187	V56-L189 HydrophobicContact CG1-CD2 4.07Å; P187-L189 PolarHBondContact O-N 3.27Å; P187-L189 VanDerWaalsContact O-N 3.14Å
190	R	53.4	Low	71.7	Confident	190 Å²	190	74.2 Å²	74.2	72%	0.717	37%	0.369	S	S	*	.			trans	-75.5	135.4	169.5	-66.8	-175.5	177.8	-173.8	-1.7	107.6	K34 T188 G192 T193	K34-R190 PolarHBondContact NZ-O 3.4Å; T188-R190 PolarHBondContact O-N 3.25Å; R190-G192 PolarHBondContact O-N 3.17Å; R190-T193 HydrophobicContact CB-CG2 4.01Å
191	K	53	Low	72	Confident	199 Å²	199	71 Å²	71	87%	0.865	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	131.6	170.4	-65.5	-174.4	177.6	-173.5	0	107.8
192	G	57.3	Low	72.2	Confident	47 Å²	47	71.3 Å²	71.3	49%	0.485	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.1	21.4	-179.1	0	0	0	0	0	117.7	E9 R190 T194	E9-G192 WeakPolarHBondContact OE1-CA 3.33Å; E9-G192 PolarHBondContact OE1-N 2.96Å; R190-G192 PolarHBondContact O-N 3.17Å; G192-T194 PolarHBondContact O-N 3.2Å
193	T	63.8	Low	72.4	Confident	14 Å²	14	71.6 Å²	71.6	9%	0.086	37%	0.366	C	S	.	.			trans	-63.5	125.8	176.7	46.2	0	0	0	0	112.4	K34 R190 E198	K34-T193 PolarHBondContact NZ-OG1 3.36Å; R190-T193 HydrophobicContact CB-CG2 4.01Å; T193-E198 PolarHBondContact OG1-OE1 2.95Å
194	T	75.2	Confident	72.8	Confident	70 Å²	70	76.3 Å²	76.3	43%	0.429	38%	0.384	S	S	.	.			trans	-79.6	157.4	174.9	60	0	0	0	0	110.9	G192 E196 E197 E198	G192-T194 PolarHBondContact O-N 3.2Å; T194-E196 PolarHBondContact O-N 3.45Å; T194-E197 PolarHBondContact N-OE2 3.18Å; T194-E197 WeakPolarHBondContact O-CB 3.24Å; T194-E197 PolarHBondContact O-N 3.03Å; T194-E197 VanDerWaalsContact OG1-CD 3.3Å; T194-E197 VanDerWaalsContact OG1-CG 3.22Å; T194-E197 WeakPolarHBondContact OG1-CG 3.41Å; T194-E197 PolarHBondContact OG1-N 3.02Å; T194-E198 PolarHBondContact O-N 3.44Å; T194-E198 VanDerWaalsContact O-N 3.13Å
195	Y	77.6	Confident	73.2	Confident	61 Å²	61	73.1 Å²	73.1	24%	0.239	37%	0.367	C	S	.	.	H	α-helix	trans	-56.2	-38.9	175.8	164.6	-102.7	0	0	0	112.6	V31 F32 R53 V54 E198 I199	V31-Y195 HydrophobicContact CG1-CD2 4.14Å; V31-Y195 HydrophobicContact CG1-CE1 4.31Å; V31-Y195 HydrophobicContact CG1-CE2 3.58Å; F32-Y195 HydrophobicContact CB-CD2 3.85Å; F32-Y195 HydrophobicContact CB-CG 4.26Å; F32-Y195 HydrophobicContact CG-CD2 4.36Å; R53-Y195 HydrophobicContact CB-CE2 4.2Å; R53-Y195 WeakPolarHBondContact CD-OH 3.35Å; R53-Y195 PolarHBondContact NH1-OH 2.97Å; V54-Y195 HydrophobicContact CG2-CD2 4.48Å; V54-Y195 HydrophobicContact CG2-CE2 4.25Å; Y195-E198 PolarHBondContact O-N 2.79Å; Y195-I199 HydrophobicContact CD2-CG1 4.11Å; Y195-I199 HydrophobicContact CE1-CG1 4.01Å; Y195-I199 HydrophobicContact CE2-CD1 3.76Å; Y195-I199 HydrophobicContact CE2-CG1 3.57Å; Y195-I199 WeakPolarHBondContact O-CG1 2.94Å; Y195-I199 PolarHBondContact O-N 3.3Å
196	E	77.8	Confident	74.2	Confident	141 Å²	141	74.2 Å²	74.2	66%	0.659	37%	0.373	S	S	*	.	H	α-helix	trans	-65.8	-40.5	179.2	-64.5	-173.4	173.2	0	0	112	T194 E198 I199 N200	T194-E196 PolarHBondContact O-N 3.45Å; E196-E198 VanDerWaalsContact C-N 3.34Å; E196-E198 PolarHBondContact O-N 2.95Å; E196-I199 PolarHBondContact O-N 2.99Å; E196-N200 WeakPolarHBondContact O-CB 3.5Å; E196-N200 PolarHBondContact O-N 3.33Å; E196-N200 PolarHBondContact O-ND2 3.18Å
197	E	80.6	Confident	75.5	Confident	91 Å²	91	75.9 Å²	75.9	43%	0.425	39%	0.385	S	S	.	.	H	α-helix	trans	-61.2	-42	173.8	-75.1	170.2	-166.7	0	0	111.8	T194 N200 N201	T194-E197 PolarHBondContact N-OE2 3.18Å; T194-E197 WeakPolarHBondContact O-CB 3.24Å; T194-E197 PolarHBondContact O-N 3.03Å; T194-E197 VanDerWaalsContact OG1-CD 3.3Å; T194-E197 VanDerWaalsContact OG1-CG 3.22Å; T194-E197 WeakPolarHBondContact OG1-CG 3.41Å; T194-E197 PolarHBondContact OG1-N 3.02Å; E197-N200 PolarHBondContact O-N 3.31Å; E197-N201 WeakPolarHBondContact O-CB 3.47Å; E197-N201 PolarHBondContact O-N 2.87Å; E197-N201 PolarHBondContact O-ND2 2.66Å
198	E	80.9	Confident	76.8	Confident	6 Å²	6	77.1 Å²	77.1	3%	0.028	38%	0.384	C	S	.	.	H	α-helix	trans	-65.2	-41.2	176.7	-73.4	-63.7	157.6	0	0	112.5	F32 V54 K76 T193 T194 Y195 E196 N201 I202	F32-E198 HydrophobicContact CE2-CG 3.96Å; F32-E198 HydrophobicContact CZ-CG 4.2Å; V54-E198 HydrophobicContact CG1-CB 4.4Å; K76-E198 IonicContact NZ-OE2 2.92Å; K76-E198 PolarHBondContact NZ-OE2 3.46Å; T193-E198 PolarHBondContact OG1-OE1 2.95Å; T194-E198 PolarHBondContact O-N 3.44Å; T194-E198 VanDerWaalsContact O-N 3.13Å; Y195-E198 PolarHBondContact O-N 2.79Å; E196-E198 VanDerWaalsContact C-N 3.34Å; E196-E198 PolarHBondContact O-N 2.95Å; E198-N201 WeakPolarHBondContact O-CB 3.06Å; E198-N201 PolarHBondContact O-N 3.35Å; E198-I202 WeakPolarHBondContact O-CD1 3.36Å; E198-I202 VanDerWaalsContact O-CG1 3.22Å; E198-I202 WeakPolarHBondContact O-CG1 3.42Å; E198-I202 PolarHBondContact O-N 3.02Å
199	I	83.5	Confident	78.6	Confident	30 Å²	30	71.2 Å²	71.2	15%	0.154	35%	0.348	C	S	.	.	H	α-helix	trans	-64.3	-43.1	174.1	-66.9	-68.2	0	0	0	111.1	V54 I75 Y195 E196 N201 I202 Q203	V54-I199 HydrophobicContact CG2-CD1 3.99Å; I75-I199 HydrophobicContact CD1-CD1 4.31Å; Y195-I199 HydrophobicContact CD2-CG1 4.11Å; Y195-I199 HydrophobicContact CE1-CG1 4.01Å; Y195-I199 HydrophobicContact CE2-CD1 3.76Å; Y195-I199 HydrophobicContact CE2-CG1 3.57Å; Y195-I199 WeakPolarHBondContact O-CG1 2.94Å; Y195-I199 PolarHBondContact O-N 3.3Å; E196-I199 PolarHBondContact O-N 2.99Å; I199-N201 VanDerWaalsContact C-N 3.31Å; I199-N201 PolarHBondContact O-N 3.49Å; I199-I202 HydrophobicContact CD1-CD1 4.23Å; I199-I202 PolarHBondContact O-N 3.31Å; I199-Q203 WeakPolarHBondContact O-CG 3.37Å; I199-Q203 PolarHBondContact O-N 3.21Å
200	N	86.4	Confident	80.3	Confident	90 Å²	90	71.3 Å²	71.3	48%	0.481	35%	0.349	S	S	.	.	H	α-helix	trans	-63.1	-38.3	175.5	-72.4	-27.3	0	0	0	111.4	E196 E197 Q203 Y204	E196-N200 WeakPolarHBondContact O-CB 3.5Å; E196-N200 PolarHBondContact O-N 3.33Å; E196-N200 PolarHBondContact O-ND2 3.18Å; E197-N200 PolarHBondContact O-N 3.31Å; N200-Q203 PolarHBondContact O-N 3.05Å; N200-Y204 WeakPolarHBondContact O-CB 3.3Å; N200-Y204 PolarHBondContact O-N 3.02Å
201	N	86.1	Confident	82.1	Confident	56 Å²	56	64.5 Å²	64.5	30%	0.299	33%	0.334	S	S	.	.	H	α-helix	trans	-62.8	-43.8	173.6	-73.2	-26.9	0	0	0	111.5	E197 E198 I199 Q203 Y204 I205	E197-N201 WeakPolarHBondContact O-CB 3.47Å; E197-N201 PolarHBondContact O-N 2.87Å; E197-N201 PolarHBondContact O-ND2 2.66Å; E198-N201 WeakPolarHBondContact O-CB 3.06Å; E198-N201 PolarHBondContact O-N 3.35Å; I199-N201 VanDerWaalsContact C-N 3.31Å; I199-N201 PolarHBondContact O-N 3.49Å; N201-Q203 VanDerWaalsContact C-N 3.33Å; N201-Q203 PolarHBondContact O-N 3.14Å; N201-Y204 PolarHBondContact O-N 2.8Å; N201-I205 WeakPolarHBondContact O-CB 3.36Å; N201-I205 VanDerWaalsContact O-CG1 3.24Å; N201-I205 WeakPolarHBondContact O-CG1 3.38Å; N201-I205 PolarHBondContact O-N 3.06Å
202	I	87.6	Confident	83.8	Confident	7 Å²	7	56.1 Å²	56.1	4%	0.036	30%	0.298	C	S	.	.	H	α-helix	trans	-60.5	-44.1	175.7	-66.5	159	0	0	0	110.8	V54 I75 K76 L101 E198 I199 T206	V54-I202 HydrophobicContact CG2-CD1 3.98Å; I75-I202 HydrophobicContact CG2-CD1 4.22Å; I75-I202 HydrophobicContact CG2-CG2 4.15Å; K76-I202 HydrophobicContact CB-CD1 3.59Å; K76-I202 HydrophobicContact CB-CG1 4.17Å; K76-I202 HydrophobicContact CD-CD1 4.02Å; K76-I202 HydrophobicContact CD-CG1 4.04Å; K76-I202 HydrophobicContact CG-CD1 4.41Å; L101-I202 HydrophobicContact CD1-CB 4.21Å; L101-I202 HydrophobicContact CD1-CG1 3.77Å; L101-I202 HydrophobicContact CD1-CG2 4.1Å; L101-I202 HydrophobicContact CG-CG2 4.39Å; E198-I202 WeakPolarHBondContact O-CD1 3.36Å; E198-I202 VanDerWaalsContact O-CG1 3.22Å; E198-I202 WeakPolarHBondContact O-CG1 3.42Å; E198-I202 PolarHBondContact O-N 3.02Å; I199-I202 HydrophobicContact CD1-CD1 4.23Å; I199-I202 PolarHBondContact O-N 3.31Å; I202-T206 WeakPolarHBondContact O-CB 3.41Å; I202-T206 PolarHBondContact O-N 3.27Å; I202-T206 PolarHBondContact O-OG1 2.93Å
203	Q	89.2	Confident	85.2	Confident	120 Å²	120	54.8 Å²	54.8	56%	0.561	28%	0.28	S	S	*	.	H	α-helix	trans	-64.4	-44	176.5	-69.4	-177.5	18.6	0	0	111.6	I199 N200 N201 T206 S207	I199-Q203 WeakPolarHBondContact O-CG 3.37Å; I199-Q203 PolarHBondContact O-N 3.21Å; N200-Q203 PolarHBondContact O-N 3.05Å; N201-Q203 VanDerWaalsContact C-N 3.33Å; N201-Q203 PolarHBondContact O-N 3.14Å; Q203-T206 PolarHBondContact O-N 3.1Å; Q203-S207 WeakPolarHBondContact O-CB 3.47Å; Q203-S207 PolarHBondContact O-N 3.43Å; Q203-S207 PolarHBondContact O-OG 3.27Å
204	Y	90.4	Very high	86.4	Confident	127 Å²	127	55.6 Å²	55.6	50%	0.498	29%	0.288	S	S	.	.	H	α-helix	trans	-59.3	-51.3	176.5	174.6	-103.5	0	0	0	111.2	N200 N201 T206 S207 K208	N200-Y204 WeakPolarHBondContact O-CB 3.3Å; N200-Y204 PolarHBondContact O-N 3.02Å; N201-Y204 PolarHBondContact O-N 2.8Å; Y204-T206 VanDerWaalsContact C-N 3.34Å; Y204-T206 PolarHBondContact O-N 3.3Å; Y204-S207 PolarHBondContact O-N 3.16Å; Y204-S207 PolarHBondContact O-OG 2.78Å; Y204-K208 WeakPolarHBondContact O-CB 3.24Å; Y204-K208 PolarHBondContact O-N 2.87Å
205	I	89.3	Confident	86.8	Confident	10 Å²	10	57.5 Å²	57.5	5%	0.051	29%	0.291	C	S	.	.	H	α-helix	trans	-55.7	-49.5	176.8	-71.1	165.3	0	0	0	110.5	L101 F183 F185 N201 S207 K208 I209	L101-I205 HydrophobicContact CD1-CD1 4.05Å; L101-I205 HydrophobicContact CD1-CG2 4.4Å; L101-I205 HydrophobicContact CD2-CG2 4.07Å; F183-I205 HydrophobicContact CE1-CG2 4.26Å; F183-I205 HydrophobicContact CZ-CG1 4.44Å; F185-I205 HydrophobicContact CD1-CG2 3.99Å; N201-I205 WeakPolarHBondContact O-CB 3.36Å; N201-I205 VanDerWaalsContact O-CG1 3.24Å; N201-I205 WeakPolarHBondContact O-CG1 3.38Å; N201-I205 PolarHBondContact O-N 3.06Å; I205-S207 PolarHBondContact O-N 3.22Å; I205-K208 PolarHBondContact O-N 2.97Å; I205-I209 HydrophobicContact CG2-CD1 3.73Å; I205-I209 VanDerWaalsContact O-CG1 3.29Å; I205-I209 WeakPolarHBondContact O-CG1 3.44Å; I205-I209 PolarHBondContact O-N 3.16Å
206	T	90.4	Very high	87.2	Confident	24 Å²	24	55.4 Å²	55.4	15%	0.147	29%	0.285	C	S	.	.	H	α-helix	trans	-60.5	-44.3	179.2	-57.3	0	0	0	0	111.7	I125 I202 Q203 Y204 N210	I125-T206 HydrophobicContact CD1-CG2 4Å; I202-T206 WeakPolarHBondContact O-CB 3.41Å; I202-T206 PolarHBondContact O-N 3.27Å; I202-T206 PolarHBondContact O-OG1 2.93Å; Q203-T206 PolarHBondContact O-N 3.1Å; Y204-T206 VanDerWaalsContact C-N 3.34Å; Y204-T206 PolarHBondContact O-N 3.3Å; T206-N210 VanDerWaalsContact O-CG 3.27Å; T206-N210 PolarHBondContact O-N 2.96Å; T206-N210 VanDerWaalsContact O-N 3.1Å; T206-N210 PolarHBondContact O-ND2 2.71Å
207	S	90.7	Very high	87.7	Confident	66 Å²	66	48.9 Å²	48.9	46%	0.462	25%	0.254	S	S	.	.	H	α-helix	trans	-65.2	-40.3	179	76.4	0	0	0	0	112	Q203 Y204 I205 N210 A211	Q203-S207 WeakPolarHBondContact O-CB 3.47Å; Q203-S207 PolarHBondContact O-N 3.43Å; Q203-S207 PolarHBondContact O-OG 3.27Å; Y204-S207 PolarHBondContact O-N 3.16Å; Y204-S207 PolarHBondContact O-OG 2.78Å; I205-S207 PolarHBondContact O-N 3.22Å; S207-N210 PolarHBondContact O-N 3.39Å; S207-A211 WeakPolarHBondContact O-CB 3.34Å; S207-A211 PolarHBondContact O-N 3.09Å
208	K	90.1	Very high	88	Confident	87 Å²	87	45.6 Å²	45.6	38%	0.378	24%	0.241	S	C	.	.	H	α-helix	trans	-67.1	-44.8	179.9	-164.4	74.8	177.8	-168.8	0	111.4	F183 Y204 I205 N210 A211 I212	F183-K208 HydrophobicContact CD1-CB 4.44Å; F183-K208 HydrophobicContact CD1-CG 4.2Å; F183-K208 HydrophobicContact CD2-CG 4.21Å; F183-K208 HydrophobicContact CE1-CB 3.82Å; F183-K208 HydrophobicContact CE1-CG 3.92Å; F183-K208 HydrophobicContact CE2-CB 4.45Å; F183-K208 HydrophobicContact CE2-CG 3.86Å; F183-K208 HydrophobicContact CG-CG 4.42Å; F183-K208 HydrophobicContact CZ-CB 3.83Å; F183-K208 HydrophobicContact CZ-CG 3.75Å; Y204-K208 WeakPolarHBondContact O-CB 3.24Å; Y204-K208 PolarHBondContact O-N 2.87Å; I205-K208 PolarHBondContact O-N 2.97Å; K208-N210 PolarHBondContact O-N 3.37Å; K208-A211 PolarHBondContact O-N 3.32Å; K208-I212 HydrophobicContact CG-CD1 4.27Å; K208-I212 VanDerWaalsContact O-CG1 3.31Å; K208-I212 WeakPolarHBondContact O-CG1 3.27Å; K208-I212 PolarHBondContact O-N 3.45Å
209	I	91.3	Very high	88.4	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-55.8	-51.3	173.4	-71	163.2	0	0	0	110.4	I125 A126 K152 A153 F183 F185 I205 A211 I212 L213	I125-I209 HydrophobicContact CG2-CD1 4.13Å; A126-I209 HydrophobicContact CB-CD1 4.07Å; K152-I209 HydrophobicContact CB-CG2 3.71Å; K152-I209 HydrophobicContact CD-CG2 4.31Å; A153-I209 HydrophobicContact CB-CD1 3.75Å; A153-I209 HydrophobicContact CB-CG1 4.11Å; A153-I209 HydrophobicContact CB-CG2 4.42Å; F183-I209 HydrophobicContact CD1-CG1 4.08Å; F183-I209 HydrophobicContact CE1-CG1 4.12Å; F185-I209 HydrophobicContact CD1-CD1 3.93Å; F185-I209 HydrophobicContact CD1-CG1 4.19Å; F185-I209 HydrophobicContact CE1-CD1 3.61Å; F185-I209 HydrophobicContact CE1-CG1 3.53Å; F185-I209 HydrophobicContact CZ-CG1 4.49Å; I205-I209 HydrophobicContact CG2-CD1 3.73Å; I205-I209 VanDerWaalsContact O-CG1 3.29Å; I205-I209 WeakPolarHBondContact O-CG1 3.44Å; I205-I209 PolarHBondContact O-N 3.16Å; I209-A211 VanDerWaalsContact C-N 3.3Å; I209-A211 PolarHBondContact O-N 3.21Å; I209-I212 PolarHBondContact O-N 2.98Å; I209-L213 HydrophobicContact CG2-CD1 4Å; I209-L213 PolarHBondContact O-N 3Å
210	N	91.2	Very high	88.6	Confident	61 Å²	61	49.3 Å²	49.3	33%	0.326	26%	0.263	S	S	.	.	H	α-helix	trans	-63.2	-36.6	-179.2	-69.9	-36.1	0	0	0	111.9	K152 T206 S207 K208 A214	K152-N210 PolarHBondContact NZ-OD1 3.49Å; T206-N210 VanDerWaalsContact O-CG 3.27Å; T206-N210 PolarHBondContact O-N 2.96Å; T206-N210 VanDerWaalsContact O-N 3.1Å; T206-N210 PolarHBondContact O-ND2 2.71Å; S207-N210 PolarHBondContact O-N 3.39Å; K208-N210 PolarHBondContact O-N 3.37Å; N210-A214 VanDerWaalsContact O-CB 3.32Å; N210-A214 WeakPolarHBondContact O-CB 3.17Å; N210-A214 PolarHBondContact O-N 3.07Å
211	A	90.9	Very high	88.8	Confident	48 Å²	48	46.5 Å²	46.5	40%	0.397	25%	0.247	S	C	.	.	H	α-helix	trans	-64.2	-45.1	175.1	0	0	0	0	0	111.8	S207 K208 I209 A214 H215	S207-A211 WeakPolarHBondContact O-CB 3.34Å; S207-A211 PolarHBondContact O-N 3.09Å; K208-A211 PolarHBondContact O-N 3.32Å; I209-A211 VanDerWaalsContact C-N 3.3Å; I209-A211 PolarHBondContact O-N 3.21Å; A211-A214 PolarHBondContact O-N 3.5Å; A211-H215 PolarHBondContact O-CD2 3.1Å; A211-H215 PolarHBondContact O-N 3.35Å
212	I	89.2	Confident	89	Confident	23 Å²	23	47.9 Å²	47.9	12%	0.118	26%	0.257	C	S	.	.	H	α-helix	trans	-61.3	-48.2	176.9	-66.8	167.5	0	0	0	110.1	V158 L181 F183 K208 I209 A214 H215 N216	V158-I212 HydrophobicContact CB-CG2 3.98Å; V158-I212 HydrophobicContact CG1-CG2 4.09Å; V158-I212 HydrophobicContact CG2-CB 4.19Å; V158-I212 HydrophobicContact CG2-CD1 4.05Å; V158-I212 HydrophobicContact CG2-CG2 3.84Å; L181-I212 HydrophobicContact CD2-CG2 3.99Å; F183-I212 HydrophobicContact CB-CD1 3.75Å; F183-I212 HydrophobicContact CD1-CD1 4.25Å; F183-I212 HydrophobicContact CG-CD1 4.05Å; K208-I212 HydrophobicContact CG-CD1 4.27Å; K208-I212 VanDerWaalsContact O-CG1 3.31Å; K208-I212 WeakPolarHBondContact O-CG1 3.27Å; K208-I212 PolarHBondContact O-N 3.45Å; I209-I212 PolarHBondContact O-N 2.98Å; I212-A214 PolarHBondContact O-N 3.27Å; I212-H215 PolarHBondContact O-N 3Å; I212-N216 WeakPolarHBondContact CG2-ND2 3.34Å; I212-N216 WeakPolarHBondContact O-CB 3.42Å; I212-N216 PolarHBondContact O-N 2.92Å; I212-N216 PolarHBondContact O-ND2 3.18Å
213	L	88.1	Confident	89.2	Confident	19 Å²	19	50.9 Å²	50.9	10%	0.099	27%	0.272	C	S	.	.	H	α-helix	trans	-58.5	-43.3	176.8	-77.7	174.4	0	0	0	112.5	K152 V158 I159 I209 H215 N216 S217 L220	K152-L213 HydrophobicContact CB-CD1 3.9Å; K152-L213 HydrophobicContact CD-CD1 3.92Å; K152-L213 HydrophobicContact CG-CD1 4Å; V158-L213 HydrophobicContact CG1-CD1 4.4Å; V158-L213 HydrophobicContact CG1-CD2 3.42Å; V158-L213 VanDerWaalsContact CG1-CD2 3.42Å; V158-L213 HydrophobicContact CG1-CG 3.53Å; I159-L213 WeakPolarHBondContact O-CD2 3.18Å; I209-L213 HydrophobicContact CG2-CD1 4Å; I209-L213 PolarHBondContact O-N 3Å; L213-H215 PolarHBondContact O-N 3.49Å; L213-H215 VanDerWaalsContact O-N 3.11Å; L213-N216 PolarHBondContact O-N 3.32Å; L213-S217 VanDerWaalsContact O-CB 3.31Å; L213-S217 WeakPolarHBondContact O-CB 3.37Å; L213-S217 PolarHBondContact O-N 3.12Å; L213-L220 HydrophobicContact CB-CD1 3.89Å
214	A	87.4	Confident	89.3	Confident	31 Å²	31	50.6 Å²	50.6	26%	0.256	27%	0.265	S	S	.	.	H	α-helix	trans	-63.1	-20.2	-178.5	0	0	0	0	0	114.5	N210 A211 I212 R224	N210-A214 VanDerWaalsContact O-CB 3.32Å; N210-A214 WeakPolarHBondContact O-CB 3.17Å; N210-A214 PolarHBondContact O-N 3.07Å; A211-A214 PolarHBondContact O-N 3.5Å; I212-A214 PolarHBondContact O-N 3.27Å; A214-R224 PolarHBondContact O-NH1 3.27Å; A214-R224 PolarHBondContact O-NH2 3.45Å
215	H	85.1	Confident	89.4	Confident	109 Å²	109	53.5 Å²	53.5	51%	0.505	28%	0.275	S	S	.	.	H	α-helix	trans	-104.5	-20.5	178.2	-71.3	-70	0	0	0	114	R173 A211 I212 L213	R173-H215 PolarHBondContact NH2-O 2.91Å; A211-H215 PolarHBondContact O-CD2 3.1Å; A211-H215 PolarHBondContact O-N 3.35Å; I212-H215 PolarHBondContact O-N 3Å; L213-H215 PolarHBondContact O-N 3.49Å; L213-H215 VanDerWaalsContact O-N 3.11Å
216	N	85.4	Confident	89.5	Confident	18 Å²	18	57.3 Å²	57.3	10%	0.096	30%	0.295	C	S	.	.	H	α-helix	trans	-120.1	-1.9	-171.3	-61.2	-35	0	0	0	114.4	F174 R180 L181 I212 L213 P218	F174-N216 WeakPolarHBondContact CD1-O 3.34Å; R180-N216 PolarHBondContact O-ND2 3.28Å; L181-N216 HydrophobicContact CD2-CB 3.68Å; I212-N216 WeakPolarHBondContact CG2-ND2 3.34Å; I212-N216 WeakPolarHBondContact O-CB 3.42Å; I212-N216 PolarHBondContact O-N 2.92Å; I212-N216 PolarHBondContact O-ND2 3.18Å; L213-N216 PolarHBondContact O-N 3.32Å; N216-P218 WeakPolarHBondContact O-CD 3.25Å
217	S	87.3	Confident	89.6	Confident	3 Å²	3	63 Å²	63	2%	0.021	31%	0.314	C	S	.	.			trans	-98.4	110.2	168.8	166.3	0	0	0	0	110.2	D161 L213 V219 L220 I221	D161-S217 VanDerWaalsContact CG-OG 3.26Å; D161-S217 PolarHBondContact OD1-OG 3.5Å; D161-S217 WeakPolarHBondContact OD2-CA 3.26Å; D161-S217 WeakPolarHBondContact OD2-CB 3.43Å; D161-S217 PolarHBondContact OD2-OG 2.97Å; L213-S217 VanDerWaalsContact O-CB 3.31Å; L213-S217 WeakPolarHBondContact O-CB 3.37Å; L213-S217 PolarHBondContact O-N 3.12Å; S217-V219 PolarHBondContact O-N 3.39Å; S217-V219 PolarHBondContact OG-N 3.19Å; S217-L220 PolarHBondContact O-N 3.08Å; S217-L220 WeakPolarHBondContact OG-CG 3.42Å; S217-L220 PolarHBondContact OG-N 3.35Å; S217-L220 VanDerWaalsContact OG-N 3.15Å; S217-I221 WeakPolarHBondContact O-CD1 3.3Å; S217-I221 VanDerWaalsContact O-CG1 3.24Å; S217-I221 WeakPolarHBondContact O-CG1 3.32Å; S217-I221 PolarHBondContact O-N 2.81Å
218	P	88.4	Confident	89.6	Confident	22 Å²	22	60.8 Å²	60.8	14%	0.143	30%	0.302	C	S	.	.	H	α-helix	trans	-47.9	-43.2	169.1	-30.4	33.7	0	0	0	113.4	D161 L170 F174 N216 I221 V222	D161-P218 WeakPolarHBondContact OD2-CD 3.48Å; D161-P218 VanDerWaalsContact OD2-N 3.17Å; L170-P218 HydrophobicContact CD1-CG 4.21Å; L170-P218 HydrophobicContact CD2-CG 3.86Å; F174-P218 HydrophobicContact CB-CG 4.11Å; F174-P218 HydrophobicContact CD1-CG 3.96Å; F174-P218 HydrophobicContact CD2-CG 3.74Å; F174-P218 HydrophobicContact CE1-CG 4.18Å; F174-P218 HydrophobicContact CE2-CG 4.01Å; F174-P218 HydrophobicContact CG-CG 3.68Å; F174-P218 HydrophobicContact CZ-CG 4.2Å; N216-P218 WeakPolarHBondContact O-CD 3.25Å; P218-I221 PolarHBondContact O-N 3.28Å; P218-V222 WeakPolarHBondContact O-CG2 3.2Å; P218-V222 PolarHBondContact O-N 2.88Å
219	V	88.3	Confident	89.6	Confident	51 Å²	51	62.5 Å²	62.5	31%	0.309	31%	0.31	S	S	.	.	H	α-helix	trans	-62.3	-48.3	-178.7	177.8	0	0	0	0	110.5	D161 S217 I221 V222 Q223	D161-V219 WeakPolarHBondContact OD2-CG2 3.34Å; D161-V219 PolarHBondContact OD2-N 2.75Å; D161-V219 VanDerWaalsContact OD2-N 3.12Å; S217-V219 PolarHBondContact O-N 3.39Å; S217-V219 PolarHBondContact OG-N 3.19Å; V219-I221 VanDerWaalsContact C-N 3.33Å; V219-I221 PolarHBondContact O-N 2.85Å; V219-V222 PolarHBondContact O-N 3.42Å; V219-Q223 HydrophobicContact CG1-CG 4.49Å; V219-Q223 VanDerWaalsContact O-CG 3.31Å; V219-Q223 WeakPolarHBondContact O-CG 3.5Å; V219-Q223 PolarHBondContact O-N 3.36Å
220	L	87.8	Confident	89.5	Confident	64 Å²	64	66.7 Å²	66.7	34%	0.335	33%	0.332	S	S	.	.	H	α-helix	trans	-65.7	-35.1	178.3	-66.6	179.8	0	0	0	112.6	L213 S217 R224	L213-L220 HydrophobicContact CB-CD1 3.89Å; S217-L220 PolarHBondContact O-N 3.08Å; S217-L220 WeakPolarHBondContact OG-CG 3.42Å; S217-L220 PolarHBondContact OG-N 3.35Å; S217-L220 VanDerWaalsContact OG-N 3.15Å; L220-R224 VanDerWaalsContact O-CB 3.29Å; L220-R224 WeakPolarHBondContact O-CB 3.32Å; L220-R224 PolarHBondContact O-N 2.85Å
221	I	89.7	Confident	89.4	Confident	31 Å²	31	67.7 Å²	67.7	16%	0.159	34%	0.339	C	S	.	.	H	α-helix	trans	-63.2	-48.4	175.9	-67.7	163.8	0	0	0	110.3	F174 S217 P218 V219 R224 W225	F174-I221 HydrophobicContact CE1-CD1 4.12Å; F174-I221 HydrophobicContact CZ-CD1 4.28Å; S217-I221 WeakPolarHBondContact O-CD1 3.3Å; S217-I221 VanDerWaalsContact O-CG1 3.24Å; S217-I221 WeakPolarHBondContact O-CG1 3.32Å; S217-I221 PolarHBondContact O-N 2.81Å; P218-I221 PolarHBondContact O-N 3.28Å; V219-I221 VanDerWaalsContact C-N 3.33Å; V219-I221 PolarHBondContact O-N 2.85Å; I221-R224 WeakPolarHBondContact O-CB 3.42Å; I221-R224 PolarHBondContact O-N 2.93Å; I221-W225 PolarHBondContact O-N 3.31Å
222	V	90.6	Very high	89.1	Confident	84 Å²	84	72.7 Å²	72.7	51%	0.509	35%	0.348	S	S	.	.	H	α-helix	trans	-62.1	-47.3	178.3	172	0	0	0	0	110.5	P218 V219 R224 W225 I226	P218-V222 WeakPolarHBondContact O-CG2 3.2Å; P218-V222 PolarHBondContact O-N 2.88Å; V219-V222 PolarHBondContact O-N 3.42Å; V222-R224 VanDerWaalsContact C-N 3.3Å; V222-R224 PolarHBondContact O-N 3.24Å; V222-W225 WeakPolarHBondContact O-CB 3.29Å; V222-W225 PolarHBondContact O-N 2.98Å; V222-W225 VanDerWaalsContact O-N 3.11Å; V222-I226 HydrophobicContact CG1-CD1 3.82Å; V222-I226 HydrophobicContact CG1-CG1 4.44Å; V222-I226 WeakPolarHBondContact O-CG1 3.45Å; V222-I226 PolarHBondContact O-N 2.98Å
223	Q	92.1	Very high	88.6	Confident	71 Å²	71	78 Å²	78	33%	0.332	37%	0.371	S	S	.	.	H	α-helix	trans	-59.3	-40.5	176.3	-69.6	-177.9	4.1	0	0	112.3	V219 W225 I226 R227	V219-Q223 HydrophobicContact CG1-CG 4.49Å; V219-Q223 VanDerWaalsContact O-CG 3.31Å; V219-Q223 WeakPolarHBondContact O-CG 3.5Å; V219-Q223 PolarHBondContact O-N 3.36Å; Q223-W225 VanDerWaalsContact C-N 3.33Å; Q223-W225 PolarHBondContact O-N 2.78Å; Q223-I226 PolarHBondContact O-N 2.83Å; Q223-R227 WeakPolarHBondContact O-CB 3.41Å; Q223-R227 VanDerWaalsContact O-CG 3.31Å; Q223-R227 WeakPolarHBondContact O-CG 3.31Å; Q223-R227 PolarHBondContact O-N 2.72Å
224	R	92.1	Very high	88	Confident	113 Å²	113	83.2 Å²	83.2	43%	0.426	40%	0.398	S	S	.	.	H	α-helix	trans	-62.2	-40.6	175.8	179.8	173	63.2	-162.6	-9.6	111.5	A214 L220 I221 V222 G228	A214-R224 PolarHBondContact O-NH1 3.27Å; A214-R224 PolarHBondContact O-NH2 3.45Å; L220-R224 VanDerWaalsContact O-CB 3.29Å; L220-R224 WeakPolarHBondContact O-CB 3.32Å; L220-R224 PolarHBondContact O-N 2.85Å; I221-R224 WeakPolarHBondContact O-CB 3.42Å; I221-R224 PolarHBondContact O-N 2.93Å; V222-R224 VanDerWaalsContact C-N 3.3Å; V222-R224 PolarHBondContact O-N 3.24Å; R224-G228 PolarHBondContact O-N 3.27Å
225	W	91.3	Very high	87.3	Confident	188 Å²	188	85.5 Å²	85.5	71%	0.712	41%	0.406	S	S	*	.	H	α-helix	trans	-65.3	-44.3	176.7	-80.5	43.9	0	0	0	111.8	I221 V222 Q223 G228 F229	I221-W225 PolarHBondContact O-N 3.31Å; V222-W225 WeakPolarHBondContact O-CB 3.29Å; V222-W225 PolarHBondContact O-N 2.98Å; V222-W225 VanDerWaalsContact O-N 3.11Å; Q223-W225 VanDerWaalsContact C-N 3.33Å; Q223-W225 PolarHBondContact O-N 2.78Å; W225-G228 PolarHBondContact O-N 2.91Å; W225-F229 WeakPolarHBondContact O-CB 3.34Å; W225-F229 PolarHBondContact O-N 3.28Å
226	I	92.4	Very high	86.2	Confident	91 Å²	91	82.8 Å²	82.8	47%	0.467	40%	0.399	S	S	.	.	H	α-helix	trans	-62.1	-50	176.7	-66.1	167.7	0	0	0	110.7	V222 Q223 G228 F229 L230	V222-I226 HydrophobicContact CG1-CD1 3.82Å; V222-I226 HydrophobicContact CG1-CG1 4.44Å; V222-I226 WeakPolarHBondContact O-CG1 3.45Å; V222-I226 PolarHBondContact O-N 2.98Å; Q223-I226 PolarHBondContact O-N 2.83Å; I226-G228 VanDerWaalsContact C-N 3.32Å; I226-G228 PolarHBondContact O-N 3Å; I226-F229 WeakPolarHBondContact O-CB 3.32Å; I226-F229 PolarHBondContact O-N 2.76Å; I226-F229 VanDerWaalsContact O-N 3.14Å; I226-L230 HydrophobicContact CG2-CD1 4.02Å; I226-L230 HydrophobicContact CG2-CG 4.4Å; I226-L230 WeakPolarHBondContact O-CG 2.98Å; I226-L230 PolarHBondContact O-N 3.38Å
227	R	91.2	Very high	84.9	Confident	142 Å²	142	85.6 Å²	85.6	54%	0.536	42%	0.418	S	S	.	.	H	α-helix	trans	-57.5	-45.8	176.2	-71.4	177.7	-171.9	113.5	5.6	111.1	Q223 F229 L230 V231	Q223-R227 WeakPolarHBondContact O-CB 3.41Å; Q223-R227 VanDerWaalsContact O-CG 3.31Å; Q223-R227 WeakPolarHBondContact O-CG 3.31Å; Q223-R227 PolarHBondContact O-N 2.72Å; R227-F229 VanDerWaalsContact C-N 3.33Å; R227-F229 PolarHBondContact O-N 3.46Å; R227-L230 PolarHBondContact O-N 2.85Å; R227-V231 WeakPolarHBondContact O-CB 3.22Å; R227-V231 VanDerWaalsContact O-CG2 3.22Å; R227-V231 WeakPolarHBondContact O-CG2 3.24Å; R227-V231 PolarHBondContact O-N 3.48Å
228	G	91.4	Very high	83.4	Confident	21 Å²	21	89.8 Å²	89.8	22%	0.216	44%	0.443	C	S	.	.	H	α-helix	trans	-62.3	-38.1	176.7	0	0	0	0	0	113.2	R224 W225 I226 R232	R224-G228 PolarHBondContact O-N 3.27Å; W225-G228 PolarHBondContact O-N 2.91Å; I226-G228 VanDerWaalsContact C-N 3.32Å; I226-G228 PolarHBondContact O-N 3Å; G228-R232 WeakPolarHBondContact O-CB 3.23Å; G228-R232 WeakPolarHBondContact O-CG 3.28Å; G228-R232 PolarHBondContact O-N 3.35Å; G228-R232 PolarHBondContact O-NH1 3.33Å
229	F	90.2	Very high	81.8	Confident	123 Å²	123	94.9 Å²	94.9	54%	0.539	46%	0.464	S	S	.	.	H	α-helix	trans	-66.1	-47	174.9	175.2	-99.2	0	0	0	111.9	W225 I226 R227 V231 R232 K233	W225-F229 WeakPolarHBondContact O-CB 3.34Å; W225-F229 PolarHBondContact O-N 3.28Å; I226-F229 WeakPolarHBondContact O-CB 3.32Å; I226-F229 PolarHBondContact O-N 2.76Å; I226-F229 VanDerWaalsContact O-N 3.14Å; R227-F229 VanDerWaalsContact C-N 3.33Å; R227-F229 PolarHBondContact O-N 3.46Å; F229-V231 VanDerWaalsContact C-N 3.35Å; F229-V231 PolarHBondContact O-N 2.82Å; F229-R232 PolarHBondContact O-N 3.49Å; F229-K233 WeakPolarHBondContact O-CB 3.2Å; F229-K233 PolarHBondContact O-N 3.28Å
230	L	88.6	Confident	80.1	Confident	88 Å²	88	97.5 Å²	97.5	46%	0.461	48%	0.475	S	S	.	.	H	α-helix	trans	-60	-44.1	176.3	-68.9	172.9	0	0	0	111.7	I226 R227 R232 K233 N234	I226-L230 HydrophobicContact CG2-CD1 4.02Å; I226-L230 HydrophobicContact CG2-CG 4.4Å; I226-L230 WeakPolarHBondContact O-CG 2.98Å; I226-L230 PolarHBondContact O-N 3.38Å; R227-L230 PolarHBondContact O-N 2.85Å; L230-R232 PolarHBondContact O-N 3.27Å; L230-K233 PolarHBondContact O-N 3.26Å; L230-N234 PolarHBondContact O-N 3.11Å
231	V	89	Confident	78.2	Confident	81 Å²	81	101.2 Å²	101.2	49%	0.491	49%	0.491	S	S	.	.	H	α-helix	trans	-61.9	-44.1	176	170.4	0	0	0	0	111	R227 F229 N234 L235	R227-V231 WeakPolarHBondContact O-CB 3.22Å; R227-V231 VanDerWaalsContact O-CG2 3.22Å; R227-V231 WeakPolarHBondContact O-CG2 3.24Å; R227-V231 PolarHBondContact O-N 3.48Å; F229-V231 VanDerWaalsContact C-N 3.35Å; F229-V231 PolarHBondContact O-N 2.82Å; V231-N234 PolarHBondContact O-N 2.91Å; V231-L235 HydrophobicContact CG1-CD1 3.66Å; V231-L235 HydrophobicContact CG1-CG 4.4Å; V231-L235 WeakPolarHBondContact O-CB 3.37Å; V231-L235 WeakPolarHBondContact O-CG 3.23Å; V231-L235 PolarHBondContact O-N 3.15Å
232	R	84.9	Confident	76.2	Confident	153 Å²	153	106 Å²	106	58%	0.577	51%	0.51	S	S	*	.	H	α-helix	trans	-65.9	-37.3	176	-76.6	-172.6	-62.9	-87	2	112.7	G228 F229 L230 L235 S236	G228-R232 WeakPolarHBondContact O-CB 3.23Å; G228-R232 WeakPolarHBondContact O-CG 3.28Å; G228-R232 PolarHBondContact O-N 3.35Å; G228-R232 PolarHBondContact O-NH1 3.33Å; F229-R232 PolarHBondContact O-N 3.49Å; L230-R232 PolarHBondContact O-N 3.27Å; R232-L235 PolarHBondContact O-N 3.27Å; R232-S236 WeakPolarHBondContact O-CA 3.4Å; R232-S236 WeakPolarHBondContact O-CB 3.46Å; R232-S236 PolarHBondContact O-N 3.12Å
233	K	79.3	Confident	74.1	Confident	136 Å²	136	109.2 Å²	109.2	59%	0.591	52%	0.517	S	S	*	.	H	α-helix	trans	-61.3	-46.6	174.8	-172.6	179.6	178	-177.7	0	110.5	F229 L230 S236	F229-K233 WeakPolarHBondContact O-CB 3.2Å; F229-K233 PolarHBondContact O-N 3.28Å; L230-K233 PolarHBondContact O-N 3.26Å; K233-S236 WeakPolarHBondContact O-CB 3.32Å; K233-S236 PolarHBondContact O-N 3.45Å; K233-S236 PolarHBondContact O-OG 2.91Å
234	N	75.9	Confident	71.8	Confident	128 Å²	128	111.9 Å²	111.9	68%	0.684	53%	0.53	S	S	*	.	H	α-helix	trans	-67.2	-35.9	177.9	-70.2	-3.5	0	0	0	113	L230 V231 P237	L230-N234 PolarHBondContact O-N 3.11Å; V231-N234 PolarHBondContact O-N 2.91Å; N234-P237 VanDerWaalsContact O-CD 3.29Å; N234-P237 WeakPolarHBondContact O-CD 3.38Å
235	L	71.5	Confident	69.4	Low	78 Å²	78	115 Å²	115	41%	0.408	54%	0.541	S	S	.	.	H	α-helix	trans	-85.8	-8.9	177.8	-67.7	171.8	0	0	0	113.7	V231 R232 P237 V238 F239	V231-L235 HydrophobicContact CG1-CD1 3.66Å; V231-L235 HydrophobicContact CG1-CG 4.4Å; V231-L235 WeakPolarHBondContact O-CB 3.37Å; V231-L235 WeakPolarHBondContact O-CG 3.23Å; V231-L235 PolarHBondContact O-N 3.15Å; R232-L235 PolarHBondContact O-N 3.27Å; L235-P237 VanDerWaalsContact C-N 3.33Å; L235-V238 WeakPolarHBondContact O-CB 3.46Å; L235-V238 PolarHBondContact O-N 3.24Å; L235-F239 HydrophobicContact CB-CD2 4.01Å; L235-F239 HydrophobicContact CB-CE2 3.75Å; L235-F239 HydrophobicContact CD1-CE2 4.37Å; L235-F239 VanDerWaalsContact O-CD2 3.28Å; L235-F239 WeakPolarHBondContact O-CD2 3.3Å; L235-F239 PolarHBondContact O-N 3.35Å
236	S	62.3	Low	67.3	Low	53 Å²	53	110.4 Å²	110.4	37%	0.371	53%	0.528	S	S	.	.	H	α-helix	trans	-55	-35.1	-178.1	72.2	0	0	0	0	114.9	R232 K233 V238 F239 L240	R232-S236 WeakPolarHBondContact O-CA 3.4Å; R232-S236 WeakPolarHBondContact O-CB 3.46Å; R232-S236 PolarHBondContact O-N 3.12Å; K233-S236 WeakPolarHBondContact O-CB 3.32Å; K233-S236 PolarHBondContact O-N 3.45Å; K233-S236 PolarHBondContact O-OG 2.91Å; S236-V238 VanDerWaalsContact C-N 3.29Å; S236-V238 PolarHBondContact O-N 3.33Å; S236-F239 PolarHBondContact O-N 3Å; S236-L240 PolarHBondContact O-N 3.11Å; S236-L240 VanDerWaalsContact O-N 3.12Å
237	P	58.1	Low	65.4	Low	76 Å²	76	113.6 Å²	113.6	49%	0.494	54%	0.538	S	S	.	.	H	α-helix	trans	-64.6	-35	175.3	-18	32	0	0	0	112.4	N234 L235 L240 H241	N234-P237 VanDerWaalsContact O-CD 3.29Å; N234-P237 WeakPolarHBondContact O-CD 3.38Å; L235-P237 VanDerWaalsContact C-N 3.33Å; P237-L240 PolarHBondContact O-N 3.04Å; P237-H241 PolarHBondContact O-N 3.1Å
238	V	57.1	Low	63.4	Low	91 Å²	91	111.5 Å²	111.5	55%	0.552	54%	0.537	S	S	*	.	H	α-helix	trans	-70.9	-38.9	-179.4	-176.9	0	0	0	0	110.9	L235 S236 H241 K242	L235-V238 WeakPolarHBondContact O-CB 3.46Å; L235-V238 PolarHBondContact O-N 3.24Å; S236-V238 VanDerWaalsContact C-N 3.29Å; S236-V238 PolarHBondContact O-N 3.33Å; V238-H241 PolarHBondContact O-N 3.08Å; V238-K242 PolarHBondContact O-N 2.7Å; V238-K242 VanDerWaalsContact O-N 3.16Å
239	F	54.3	Low	61.5	Low	129 Å²	129	114.8 Å²	114.8	57%	0.566	55%	0.549	S	S	*	.	H	α-helix	trans	-71	-33.7	176.9	-74.6	-72.8	0	0	0	113	L235 S236 K242 K243	L235-F239 HydrophobicContact CB-CD2 4.01Å; L235-F239 HydrophobicContact CB-CE2 3.75Å; L235-F239 HydrophobicContact CD1-CE2 4.37Å; L235-F239 VanDerWaalsContact O-CD2 3.28Å; L235-F239 WeakPolarHBondContact O-CD2 3.3Å; L235-F239 PolarHBondContact O-N 3.35Å; S236-F239 PolarHBondContact O-N 3Å; F239-K242 PolarHBondContact O-N 3.24Å; F239-K243 PolarHBondContact O-N 3.44Å
240	L	51.3	Low	59.4	Low	106 Å²	106	115.8 Å²	115.8	56%	0.555	55%	0.549	S	S	*	.	H	α-helix	trans	-64.3	-42.2	173.3	-76.7	164.1	0	0	0	111.8	S236 P237 K242 K243 H244	S236-L240 PolarHBondContact O-N 3.11Å; S236-L240 VanDerWaalsContact O-N 3.12Å; P237-L240 PolarHBondContact O-N 3.04Å; L240-K242 VanDerWaalsContact C-N 3.34Å; L240-K242 PolarHBondContact O-N 3.03Å; L240-K243 PolarHBondContact O-N 3.15Å; L240-H244 PolarHBondContact O-CD2 3.16Å; L240-H244 PolarHBondContact O-N 2.83Å
241	H	47.8	Very low	57.3	Low	142 Å²	142	113.5 Å²	113.5	66%	0.657	55%	0.547	S	S	*	.	H	α-helix	trans	-63	-37.1	174.3	-95.9	53.8	0	0	0	113.1	P237 V238 R245	P237-H241 PolarHBondContact O-N 3.1Å; V238-H241 PolarHBondContact O-N 3.08Å; H241-R245 PolarHBondContact O-N 2.93Å; H241-R245 VanDerWaalsContact O-N 3.13Å
242	K	48.1	Very low	55.4	Low	132 Å²	132	116.7 Å²	116.7	57%	0.574	55%	0.551	S	S	*	*	H	α-helix	trans	-70.1	-37.6	178	-141.5	176.6	-175.1	-176.7	0	112.3	V238 F239 L240 H244 R245 E246	V238-K242 PolarHBondContact O-N 2.7Å; V238-K242 VanDerWaalsContact O-N 3.16Å; F239-K242 PolarHBondContact O-N 3.24Å; L240-K242 VanDerWaalsContact C-N 3.34Å; L240-K242 PolarHBondContact O-N 3.03Å; K242-H244 PolarHBondContact O-N 3.28Å; K242-R245 PolarHBondContact O-N 3.21Å; K242-E246 PolarHBondContact O-N 3.09Å
243	K	46.6	Very low	53.5	Low	151 Å²	151	114.4 Å²	114.4	66%	0.657	55%	0.547	S	S	*	.	H	α-helix	trans	-65.8	-35.9	176	-133.3	178.1	-175.2	-178	0	112.6	F239 L240 K247	F239-K243 PolarHBondContact O-N 3.44Å; L240-K243 PolarHBondContact O-N 3.15Å; K243-K247 PolarHBondContact O-N 2.96Å
244	H	45.1	Very low	52	Low	128 Å²	128	112.3 Å²	112.3	59%	0.593	55%	0.545	S	S	*	.	H	α-helix	trans	-67.5	-42	171.9	-87.7	-78	0	0	0	112.2	L240 K242 K247 I248	L240-H244 PolarHBondContact O-CD2 3.16Å; L240-H244 PolarHBondContact O-N 2.83Å; K242-H244 PolarHBondContact O-N 3.28Å; H244-K247 PolarHBondContact O-N 3.32Å; H244-I248 WeakPolarHBondContact O-CG1 3.47Å; H244-I248 PolarHBondContact O-N 3.49Å
245	R	39.8	Very low	50.6	Low	177 Å²	177	113.3 Å²	113.3	67%	0.668	54%	0.544	S	S	*	.	H	α-helix	trans	-63.9	-40.1	174.8	-75.7	-170.5	-179.7	-165.5	1.1	113.1	H241 K242 K247 I248 I249	H241-R245 PolarHBondContact O-N 2.93Å; H241-R245 VanDerWaalsContact O-N 3.13Å; K242-R245 PolarHBondContact O-N 3.21Å; R245-K247 VanDerWaalsContact C-N 3.32Å; R245-K247 PolarHBondContact O-N 2.67Å; R245-I248 PolarHBondContact O-N 3.17Å; R245-I249 WeakPolarHBondContact O-CD1 3.2Å; R245-I249 VanDerWaalsContact O-CG1 3.25Å; R245-I249 WeakPolarHBondContact O-CG1 3.45Å; R245-I249 PolarHBondContact O-N 3.38Å
246	E	48.5	Very low	48.9	Very low	93 Å²	93	117.9 Å²	117.9	44%	0.435	56%	0.555	S	S	.	*	H	α-helix	trans	-67.6	-27.8	176.6	-78.1	177.3	-171.7	0	0	113.8	K242 R250	K242-E246 PolarHBondContact O-N 3.09Å; E246-R250 PolarHBondContact O-N 3.49Å; E246-R250 IonicContact OE2-NH2 2.72Å
247	K	51.8	Low	48.2	Very low	157 Å²	157	120.3 Å²	120.3	68%	0.683	56%	0.563	S	S	*	*	H	α-helix	trans	-69.5	-40.5	170.3	-98.5	-174.7	174.6	-175.1	0	111.6	K243 H244 R245 G251	K243-K247 PolarHBondContact O-N 2.96Å; H244-K247 PolarHBondContact O-N 3.32Å; R245-K247 VanDerWaalsContact C-N 3.32Å; R245-K247 PolarHBondContact O-N 2.67Å; K247-G251 PolarHBondContact O-N 2.92Å
248	I	48.8	Very low	47.6	Very low	99 Å²	99	126.4 Å²	126.4	51%	0.508	58%	0.578	S	S	.	*	H	α-helix	trans	-66.1	-44.2	177.6	-65	166	0	0	0	110.3	H244 R245 G251 Y252	H244-I248 WeakPolarHBondContact O-CG1 3.47Å; H244-I248 PolarHBondContact O-N 3.49Å; R245-I248 PolarHBondContact O-N 3.17Å; I248-G251 PolarHBondContact O-N 3.21Å; I248-G251 VanDerWaalsContact O-N 3.15Å; I248-Y252 HydrophobicContact CG2-CD2 3.95Å; I248-Y252 HydrophobicContact CG2-CE2 3.63Å; I248-Y252 WeakPolarHBondContact O-CD2 3.31Å; I248-Y252 PolarHBondContact O-N 3.36Å
249	I	51.8	Low	46.9	Very low	90 Å²	90	127.4 Å²	127.4	46%	0.462	58%	0.579	S	S	.	*	H	α-helix	trans	-64.1	-42.9	180	-66.3	162.8	0	0	0	111.8	R245 G251 Y252 E253	R245-I249 WeakPolarHBondContact O-CD1 3.2Å; R245-I249 VanDerWaalsContact O-CG1 3.25Å; R245-I249 WeakPolarHBondContact O-CG1 3.45Å; R245-I249 PolarHBondContact O-N 3.38Å; I249-G251 VanDerWaalsContact C-N 3.26Å; I249-G251 PolarHBondContact O-N 2.97Å; I249-Y252 PolarHBondContact O-N 2.91Å; I249-Y252 VanDerWaalsContact O-N 3.09Å; I249-E253 HydrophobicContact CG2-CG 4.38Å; I249-E253 PolarHBondContact O-N 3.4Å
250	R	46.4	Very low	46.3	Very low	144 Å²	144	124.4 Å²	124.4	54%	0.543	57%	0.572	S	S	.	*	H	α-helix	trans	-61	-32.7	173.2	-97.7	-177.6	-74.9	-110.7	-6.1	113.6	E246 Y252 T254	E246-R250 PolarHBondContact O-N 3.49Å; E246-R250 IonicContact OE2-NH2 2.72Å; R250-Y252 VanDerWaalsContact C-N 3.33Å; R250-T254 WeakPolarHBondContact O-CG2 3.5Å; R250-T254 PolarHBondContact O-N 3Å; R250-T254 VanDerWaalsContact O-N 3.16Å; R250-T254 PolarHBondContact O-OG1 3.13Å
251	G	45.1	Very low	45.7	Very low	40 Å²	40	126.1 Å²	126.1	41%	0.412	57%	0.574	S	S	.	*	H	α-helix	trans	-68.1	-31.2	175.1	0	0	0	0	0	113.2	K247 I248 I249 T254	K247-G251 PolarHBondContact O-N 2.92Å; I248-G251 PolarHBondContact O-N 3.21Å; I248-G251 VanDerWaalsContact O-N 3.15Å; I249-G251 VanDerWaalsContact C-N 3.26Å; I249-G251 PolarHBondContact O-N 2.97Å; G251-T254 PolarHBondContact O-OG1 2.92Å
252	Y	48.3	Very low	45.2	Very low	147 Å²	147	122 Å²	122	58%	0.576	57%	0.57	S	S	*	*	H	α-helix	trans	-79.9	-44.5	173.5	-74.9	-74	0	0	0	111.6	I248 I249 R250 T254 K255 W256	I248-Y252 HydrophobicContact CG2-CD2 3.95Å; I248-Y252 HydrophobicContact CG2-CE2 3.63Å; I248-Y252 WeakPolarHBondContact O-CD2 3.31Å; I248-Y252 PolarHBondContact O-N 3.36Å; I249-Y252 PolarHBondContact O-N 2.91Å; I249-Y252 VanDerWaalsContact O-N 3.09Å; R250-Y252 VanDerWaalsContact C-N 3.33Å; Y252-T254 VanDerWaalsContact C-N 3.29Å; Y252-T254 PolarHBondContact O-N 3.45Å; Y252-K255 WeakPolarHBondContact O-CB 3.38Å; Y252-K255 PolarHBondContact O-N 2.63Å; Y252-W256 PolarHBondContact O-N 2.97Å
253	E	45.3	Very low	44.9	Very low	106 Å²	106	124.4 Å²	124.4	50%	0.495	58%	0.577	S	S	.	*	H	α-helix	trans	-57.2	-40	178.5	-74.1	173.1	169.5	0	0	112.7	I249 K255 W256 I257	I249-E253 HydrophobicContact CG2-CG 4.38Å; I249-E253 PolarHBondContact O-N 3.4Å; E253-K255 VanDerWaalsContact C-N 3.33Å; E253-K255 PolarHBondContact O-N 3.4Å; E253-W256 PolarHBondContact O-N 3.47Å; E253-I257 WeakPolarHBondContact O-CD1 3.5Å; E253-I257 WeakPolarHBondContact O-CG1 3.44Å; E253-I257 PolarHBondContact O-N 3.28Å
254	T	48.1	Very low	44.5	Very low	91 Å²	91	122.8 Å²	122.8	56%	0.558	57%	0.571	S	S	*	*	H	α-helix	trans	-65.7	-32.5	176.1	44.4	0	0	0	0	113.4	R250 G251 Y252	R250-T254 WeakPolarHBondContact O-CG2 3.5Å; R250-T254 PolarHBondContact O-N 3Å; R250-T254 VanDerWaalsContact O-N 3.16Å; R250-T254 PolarHBondContact O-OG1 3.13Å; G251-T254 PolarHBondContact O-OG1 2.92Å; Y252-T254 VanDerWaalsContact C-N 3.29Å; Y252-T254 PolarHBondContact O-N 3.45Å
255	K	46.7	Very low	44.5	Very low	150 Å²	150	122 Å²	122	65%	0.652	57%	0.571	S	S	*	*	H	α-helix	trans	-71.1	-39.9	172	-100.7	-178.8	175	-179	0	112.5	Y252 E253 Y258 I259	Y252-K255 WeakPolarHBondContact O-CB 3.38Å; Y252-K255 PolarHBondContact O-N 2.63Å; E253-K255 VanDerWaalsContact C-N 3.33Å; E253-K255 PolarHBondContact O-N 3.4Å; K255-Y258 PolarHBondContact O-N 3.39Å; K255-I259 WeakPolarHBondContact O-CG1 3.42Å; K255-I259 PolarHBondContact O-N 3.04Å
256	W	36.3	Very low	44.7	Very low	173 Å²	173	122 Å²	122	66%	0.655	58%	0.576	S	S	*	*	H	α-helix	trans	-68.7	-39	178.8	-80.4	94.7	0	0	0	112.6	Y252 E253 Y258 I259 T260	Y252-W256 PolarHBondContact O-N 2.97Å; E253-W256 PolarHBondContact O-N 3.47Å; W256-Y258 VanDerWaalsContact C-N 3.27Å; W256-Y258 PolarHBondContact O-N 3.42Å; W256-I259 PolarHBondContact O-N 3.1Å; W256-T260 PolarHBondContact O-N 3.09Å; W256-T260 VanDerWaalsContact O-N 3.17Å; W256-T260 PolarHBondContact O-OG1 3.43Å
257	I	47.2	Very low	44.3	Very low	105 Å²	105	124 Å²	124	54%	0.538	59%	0.589	S	S	.	*	H	α-helix	trans	-64.1	-31.6	177.3	-67.5	163	0	0	0	112	E253 T260 K261	E253-I257 WeakPolarHBondContact O-CD1 3.5Å; E253-I257 WeakPolarHBondContact O-CG1 3.44Å; E253-I257 PolarHBondContact O-N 3.28Å; I257-T260 PolarHBondContact O-OG1 3.19Å; I257-K261 WeakPolarHBondContact O-CB 3.41Å; I257-K261 PolarHBondContact O-N 2.84Å
258	Y	44.5	Very low	43.8	Very low	204 Å²	204	121.8 Å²	121.8	80%	0.8	58%	0.584	S	S	*	*	H	α-helix	trans	-72.5	-30.8	178.3	-144.6	-89.5	0	0	0	112.4	K255 W256	K255-Y258 PolarHBondContact O-N 3.39Å; W256-Y258 VanDerWaalsContact C-N 3.27Å; W256-Y258 PolarHBondContact O-N 3.42Å
259	I	44.2	Very low	43.4	Very low	111 Å²	111	125.7 Å²	125.7	57%	0.569	60%	0.598	S	S	*	*	H	α-helix	trans	-77.9	-36.6	179.8	-64.1	169.5	0	0	0	110.9	K255 W256	K255-I259 WeakPolarHBondContact O-CG1 3.42Å; K255-I259 PolarHBondContact O-N 3.04Å; W256-I259 PolarHBondContact O-N 3.1Å
260	T	40.5	Very low	42.9	Very low	67 Å²	67	128.3 Å²	128.3	41%	0.411	61%	0.613	S	S	.	*	H	α-helix	trans	-74.6	-33.9	179.3	54.7	0	0	0	0	112.9	W256 I257 G262 Y263 E264	W256-T260 PolarHBondContact O-N 3.09Å; W256-T260 VanDerWaalsContact O-N 3.17Å; W256-T260 PolarHBondContact O-OG1 3.43Å; I257-T260 PolarHBondContact O-OG1 3.19Å; T260-G262 VanDerWaalsContact C-N 3.28Å; T260-G262 PolarHBondContact O-N 3.3Å; T260-Y263 PolarHBondContact O-N 3Å; T260-Y263 VanDerWaalsContact O-N 3.13Å; T260-E264 PolarHBondContact O-N 3.25Å
261	K	38.2	Very low	42.6	Very low	142 Å²	142	128 Å²	128	62%	0.617	62%	0.621	S	S	*	*	H	α-helix	trans	-65.5	-28.6	-179.5	-141.9	175.6	-173.2	-176.7	0	113.7	I257 Y263	I257-K261 WeakPolarHBondContact O-CB 3.41Å; I257-K261 PolarHBondContact O-N 2.84Å; K261-Y263 VanDerWaalsContact C-N 3.33Å
262	G	37.4	Very low	42.2	Very low	54 Å²	54	133.4 Å²	133.4	56%	0.557	63%	0.634	S	S	*	*	H	α-helix	trans	-74.1	-19.4	175.3	0	0	0	0	0	114.6	T260	T260-G262 VanDerWaalsContact C-N 3.28Å; T260-G262 PolarHBondContact O-N 3.3Å
263	Y	41.7	Very low	41.4	Very low	184 Å²	184	136 Å²	136	72%	0.722	65%	0.648	S	S	*	*	H	α-helix	trans	-95	-31.6	-179.6	-96.5	-90.3	0	0	0	113	T260 K261	T260-Y263 PolarHBondContact O-N 3Å; T260-Y263 VanDerWaalsContact O-N 3.13Å; K261-Y263 VanDerWaalsContact C-N 3.33Å
264	E	39.6	Very low	40.7	Very low	117 Å²	117	140.9 Å²	140.9	55%	0.547	67%	0.668	S	S	.	*	H	α-helix	trans	-72	-31.2	-180	-71.7	-179	169.7	0	0	113.2	T260 K266 L267 L268	T260-E264 PolarHBondContact O-N 3.25Å; E264-K266 PolarHBondContact O-N 2.86Å; E264-L267 PolarHBondContact O-N 2.95Å; E264-L268 PolarHBondContact O-N 3.02Å
265	D	44	Very low	40.2	Very low	110 Å²	110	141.8 Å²	141.8	59%	0.588	68%	0.675	S	S	*	*	H	α-helix	trans	-70	-12.8	-178.9	-79.2	-16	0	0	0	114.2
266	K	44.3	Very low	39.2	Very low	178 Å²	178	143.2 Å²	143.2	77%	0.774	68%	0.684	S	S	*	*	H	α-helix	trans	-89.4	-24.8	172.7	-95.8	-180	176.4	178.6	0	113.9	E264	E264-K266 PolarHBondContact O-N 2.86Å
267	L	40.5	Very low	39	Very low	134 Å²	134	140.5 Å²	140.5	70%	0.702	69%	0.687	S	S	*	*	H	α-helix	trans	-92.4	-23.7	-177.6	-76.2	167.4	0	0	0	113.2	E264	E264-L267 PolarHBondContact O-N 2.95Å
268	L	41.2	Very low	38.2	Very low	112 Å²	112	142.8 Å²	142.8	59%	0.586	70%	0.7	S	S	*	*	S	Bend	trans	-83.5	-12.7	-176.5	-89.8	153.6	0	0	0	114.9	E264	E264-L268 PolarHBondContact O-N 3.02Å
269	K	40.8	Very low	37.8	Very low	180 Å²	180	141.3 Å²	141.3	78%	0.783	70%	0.704	S	S	*	*	S	Bend	trans	-83.1	-19	179.9	-86.2	-178.5	175.9	177.6	0	114.8
270	D	40.9	Very low	37.3	Very low	146 Å²	146	146 Å²	146	78%	0.781	72%	0.72	S	S	*	*	S	Bend	trans	-95.1	-11.3	-172.8	-70.1	-14.8	0	0	0	114.3
271	L	40.5	Very low	36.7	Very low	136 Å²	136	146.3 Å²	146.3	71%	0.712	74%	0.737	S	S	*	*	S	Bend	trans	-109.4	-12.9	-169.6	-87	154.7	0	0	0	115.9
272	F	36.4	Very low	36.5	Very low	155 Å²	155	149.5 Å²	149.5	68%	0.68	75%	0.751	S	S	*	*	S	Bend	trans	-144.8	82.3	-174.2	-68.2	-81	0	0	0	111.9
273	F	30.6	Very low	36	Very low	202 Å²	202	155.1 Å²	155.1	89%	0.886	77%	0.767	S	S	*	*			trans	-178.1	104.6	138.9	-96.8	-68.6	0	0	0	110.4
274	K	31	Very low	35.4	Very low	208 Å²	208	150.5 Å²	150.5	90%	0.904	77%	0.767	S	S	*	*			trans	-117.3	127.3	140.8	-85.1	-169.7	177.9	-177.5	0	107.3
275	P	36.8	Very low	34.9	Very low	109 Å²	109	155.8 Å²	155.8	71%	0.708	78%	0.784	S	S	*	*			trans	-93	136.4	-170.7	35.1	-29.4	0	0	0	110.3
276	E	26.1	Very low	34.1	Very low	180 Å²	180	160.4 Å²	160.4	84%	0.841	79%	0.793	S	S	*	*			trans	-146.6	109.6	159	-110.7	160.3	-145.9	0	0	111
277	T	32.3	Very low	33.2	Very low	117 Å²	117	161.4 Å²	161.4	72%	0.718	80%	0.797	S	S	*	*			trans	63.6	97.8	145.5	60.3	0	0	0	0	118.2
278	N	31.1	Very low	32.7	Very low	152 Å²	152	162.2 Å²	162.2	81%	0.813	80%	0.797	S	S	*	*				76.5	94.3	91.2	-80.5	-24.6	0	0	0	113.8
279	I	35.1	Very low	31.9	Very low	173 Å²	173	163.7 Å²	163.7	89%	0.887	81%	0.806	S	S	*	*				-153.6	118.6	127.5	-85	132.3	0	0	0	107.4
280	K	33.8	Very low	31.3	Very low	209 Å²	209	162.8 Å²	162.8	91%	0.909	81%	0.808	S	S	*	*			trans	-67.1	128.3	172.8	-84	171.9	171.8	171.2	0	109.9
281	G	27.5	Very low	30.5	Very low	74 Å²	74	165.6 Å²	165.6	76%	0.763	81%	0.809	S	S	*	*			trans	-165.4	98.5	167.4	0	0	0	0	0	111.4
282	K	34	Very low	29.9	Very low	210 Å²	210	169.4 Å²	169.4	91%	0.913	82%	0.815	S	S	*	*			trans	-47.3	127.9	-178.2	-69.7	166.7	172.2	174.4	0	113.5
283	L	28.2	Very low	29.7	Very low	171 Å²	171	166.8 Å²	166.8	90%	0.895	81%	0.814	S	S	*	*			trans	-143.6	104	146	-99.5	164.7	0	0	0	108.9	Y285	L283-Y285 PolarHBondContact O-N 3.02Å
284	A	28.6	Very low	29.4	Very low	87 Å²	87	163.5 Å²	163.5	72%	0.719	81%	0.81	S	S	*	*			trans	-72.1	119.2	179.4	0	0	0	0	0	110.4
285	Y	29.4	Very low	29.3	Very low	229 Å²	229	161 Å²	161	90%	0.898	81%	0.807	S	S	*	*			trans	-100.6	105.4	161.2	-109.5	-86.6	0	0	0	108.7	L283 K287	L283-Y285 PolarHBondContact O-N 3.02Å; Y285-K287 PolarHBondContact O-N 3.39Å
286	W	26.6	Very low	28.9	Very low	207 Å²	207	164.2 Å²	164.2	78%	0.784	82%	0.817	S	S	*	*			trans	-69.4	111.1	168.8	-86.8	33.5	0	0	0	110	H288	W286-H288 AromaticContact CE3-CE1 3.53Å; W286-H288 AromaticContact CE3-NE2 3.43Å; W286-H288 AromaticContact CZ3-CE1 3.54Å; W286-H288 AromaticContact CZ3-NE2 3.71Å
287	K	27	Very low	28.8	Very low	198 Å²	198	164.3 Å²	164.3	86%	0.861	82%	0.815	S	S	*	*			trans	-97.5	111.4	156	-84.4	-179	176.2	175.9	0	107.6	Y285 N289	Y285-K287 PolarHBondContact O-N 3.39Å; K287-N289 PolarHBondContact O-N 3.01Å
288	H	29.1	Very low	28.5	Very low	152 Å²	152	165 Å²	165	70%	0.704	82%	0.819	S	S	*	*			trans	-69.6	110.2	165.4	-77.9	-64.9	0	0	0	109.5	W286	W286-H288 AromaticContact CE3-CE1 3.53Å; W286-H288 AromaticContact CE3-NE2 3.43Å; W286-H288 AromaticContact CZ3-CE1 3.54Å; W286-H288 AromaticContact CZ3-NE2 3.71Å
289	N	24.8	Very low	28.3	Very low	143 Å²	143	163 Å²	163	77%	0.765	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-80	125.9	156.9	-85.5	-23.1	0	0	0	108.4	K287 Y291	K287-N289 PolarHBondContact O-N 3.01Å; N289-Y291 PolarHBondContact O-N 3.2Å
290	I	28.1	Very low	28	Very low	161 Å²	161	159.8 Å²	159.8	83%	0.826	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-73	116.6	166.4	-67.2	168.4	0	0	0	107.3
291	Y	24.6	Very low	27.8	Very low	204 Å²	204	157.9 Å²	157.9	80%	0.8	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-90.9	129.8	165.5	-105	-94.4	0	0	0	109.1	N289	N289-Y291 PolarHBondContact O-N 3.2Å
292	Y	26.1	Very low	27.8	Very low	216 Å²	216	163.1 Å²	163.1	85%	0.847	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-92.1	138.7	153.7	-107	-86.3	0	0	0	108.2
293	P	32.5	Very low	27.4	Very low	101 Å²	101	164.6 Å²	164.6	66%	0.656	81%	0.808	S	S	*	*			trans	-138.3	165.3	131.7	28.1	-9.2	0	0	0	109.5
294	V	25.1	Very low	27.4	Very low	132 Å²	132	165.1 Å²	165.1	80%	0.8	80%	0.803	S	S	*	*			cis	-170.4	147.5	-3.1	137.5	0	0	0	0	103.5
295	D	28.5	Very low	27.3	Very low	156 Å²	156	169 Å²	169	83%	0.834	81%	0.806	S	S	*	*			trans	-57.1	144.2	173.6	-71.7	-51.7	0	0	0	113.4
296	L	29.1	Very low	27.2	Very low	177 Å²	177	164 Å²	164	93%	0.927	80%	0.799	S	S	*	*			trans	-148.1	133.6	146.6	-109.6	155.6	0	0	0	111.1
297	K	24.6	Very low	27.1	Very low	181 Å²	181	158.7 Å²	158.7	79%	0.787	79%	0.794	S	S	*	*			trans	-73.3	156.7	-171.2	-83.6	168.5	170.5	172.8	0	113.5
298	T	25.8	Very low	27.3	Very low	131 Å²	131	154 Å²	154	80%	0.804	79%	0.786	S	S	*	*			trans	63.5	116	146.5	50.4	0	0	0	0	119.2
299	S	27	Very low	27.1	Very low	112 Å²	112	154.5 Å²	154.5	78%	0.783	79%	0.792	S	S	*	*				-172.1	130.8	97.2	55.1	0	0	0	0	111.2
300	S	28	Very low	27.2	Very low	104 Å²	104	155.5 Å²	155.5	73%	0.727	80%	0.796	S	S	*	*			trans	-49.4	133.7	159.4	45.9	0	0	0	0	111.7
301	E	28.7	Very low	27	Very low	170 Å²	170	152.8 Å²	152.8	79%	0.794	79%	0.791	S	S	*	*			trans	156.5	105.1	133.2	-87.9	172.9	-169.5	0	0	108.4
302	H	28.9	Very low	27	Very low	184 Å²	184	151.8 Å²	151.8	85%	0.852	79%	0.793	S	S	*	*				-178.9	83.2	126.9	-93.4	43.3	0	0	0	107.2
303	R	25.4	Very low	27	Very low	241 Å²	241	150.3 Å²	150.3	91%	0.909	80%	0.799	S	S	*	*			trans	-61	130	144.8	-85.9	-179.8	-177.7	173.5	1.5	106.5
304	K	27.4	Very low	26.6	Very low	181 Å²	181	155.3 Å²	155.3	79%	0.787	81%	0.81	S	S	*	*				-174.2	123.3	127.3	-99.3	165.7	-172.8	-177.2	0	110.3
305	H	26.5	Very low	27.3	Very low	168 Å²	168	154.3 Å²	154.3	78%	0.778	81%	0.806	S	S	*	*			trans	69.4	130.5	147	-70.5	-54.5	0	0	0	119.4
306	V	27	Very low	27.2	Very low	126 Å²	126	155.5 Å²	155.5	76%	0.764	80%	0.804	S	S	*	*			cis	-146.8	133.4	5.4	177.3	0	0	0	0	108.9
307	S	25.7	Very low	26.9	Very low	95 Å²	95	153.4 Å²	153.4	66%	0.664	79%	0.794	S	S	*	*			trans	-76.7	146.6	168.8	48.8	0	0	0	0	112.4
308	S	29.7	Very low	27	Very low	99 Å²	99	153.1 Å²	153.1	69%	0.692	80%	0.8	S	S	*	*			trans	22.9	142.3	139.8	63.5	0	0	0	0	119.9
309	I	26	Very low	26.8	Very low	162 Å²	162	150.1 Å²	150.1	83%	0.831	80%	0.795	S	S	*	*				-162.3	126.2	127.4	-90.9	136.4	0	0	0	109.7
310	L	26.1	Very low	26.6	Very low	165 Å²	165	152.3 Å²	152.3	86%	0.864	80%	0.795	S	S	*	*			trans	-97	133.8	154.5	-172	105.5	0	0	0	105.8
311	C	23.6	Very low	26.3	Very low	104 Å²	104	155.4 Å²	155.4	70%	0.703	80%	0.795	S	S	*	*			trans	177.4	116.8	153.6	-94.6	0	0	0	0	107.3
312	E	24.8	Very low	26.2	Very low	183 Å²	183	152 Å²	152	86%	0.855	79%	0.79	S	S	*	*				45.5	109.8	86.7	-81	-167.3	172.9	0	0	114.5
313	L	27.4	Very low	26	Very low	185 Å²	185	152.5 Å²	152.5	97%	0.969	79%	0.79	S	S	*	*			trans	-139	134.9	154	-81.2	173.5	0	0	0	110.1
314	K	23.8	Very low	26	Very low	206 Å²	206	147.1 Å²	147.1	90%	0.896	78%	0.784	S	S	*	*			trans	-89.5	175.7	-178.1	-101.8	-166.6	-176.2	-179.4	0	111.7
315	P	39.2	Very low	25.8	Very low	110 Å²	110	143.5 Å²	143.5	71%	0.714	78%	0.782	S	S	*	*			trans	-99.2	159.7	-148.4	39	-34.7	0	0	0	115.5
316	K	26	Very low	25.7	Very low	182 Å²	182	145.8 Å²	145.8	79%	0.791	78%	0.783	S	S	*	*				169.8	130.8	123.2	-94.1	178.2	177.9	-176.1	0	113.1
317	D	24.2	Very low	25.5	Very low	132 Å²	132	146.9 Å²	146.9	71%	0.706	78%	0.78	S	S	*	*			trans	49.3	110.6	141	-50.8	-29.3	0	0	0	121.1
318	L	25.4	Very low	25.5	Very low	175 Å²	175	148.8 Å²	148.8	92%	0.916	78%	0.782	S	S	*	*				174	130.4	94.2	-106.3	132.7	0	0	0	111.2
319	G	21.4	Very low	25.3	Very low	68 Å²	68	150.4 Å²	150.4	70%	0.701	78%	0.781	S	S	*	*			trans	108.4	111.1	137.5	0	0	0	0	0	119
320	M	23.9	Very low	25.4	Very low	158 Å²	158	151.3 Å²	151.3	78%	0.778	78%	0.782	S	S	*	*			trans	86.1	91.7	137.3	-81.3	-92	154.7	0	0	120.6
321	K	22.1	Very low	25.2	Very low	169 Å²	169	153.2 Å²	153.2	74%	0.735	78%	0.783	S	S	*	*				60.1	114.3	116.5	-69.8	-169	-174.2	175	0	120.6
322	S	25.2	Very low	25.2	Very low	98 Å²	98	152 Å²	152	69%	0.685	79%	0.789	S	S	*	*				43.3	129.3	128.7	64.9	0	0	0	0	120.6
323	K	25.1	Very low	25.3	Very low	196 Å²	196	151.2 Å²	151.2	85%	0.852	79%	0.785	S	S	*	*				178.8	142.8	108	-96.6	165.1	-178.3	178.1	0	113
324	T	25.3	Very low	25.1	Very low	128 Å²	128	149.3 Å²	149.3	79%	0.785	77%	0.771	S	S	*	*			trans	-51.3	148.2	159.7	36.6	0	0	0	0	114.1
325	S	23.7	Very low	25.1	Very low	105 Å²	105	145.5 Å²	145.5	73%	0.734	77%	0.77	S	S	*	*			trans	175.1	118.8	141.3	33.6	0	0	0	0	107.9
326	R	23.8	Very low	24.4	Very low	215 Å²	215	147.1 Å²	147.1	81%	0.811	77%	0.766	S	S	*	*				91.4	128.6	67.4	-89.4	-179.9	-173.4	173.8	3.2	111.9
327	H	23.9	Very low	24.3	Very low	150 Å²	150	146.8 Å²	146.8	69%	0.694	77%	0.773	S	S	*	*			trans	79.2	145.7	142.5	-68.2	-36.9	0	0	0	117.2
328	L	25.2	Very low	24.3	Very low	134 Å²	134	147.7 Å²	147.7	70%	0.702	77%	0.773	S	S	*	*			cis	-173.5	171.3	9.7	-123.3	160.4	0	0	0	109.2
329	I	26.1	Very low	24.3	Very low	134 Å²	134	147 Å²	147	69%	0.687	77%	0.768	S	S	*	*			trans	90.1	125.2	153.1	-66.2	147.4	0	0	0	115.9
330	Q	27.1	Very low	24.5	Very low	181 Å²	181	149.4 Å²	149.4	85%	0.846	77%	0.769	S	S	*	*			cis	-157.1	144.4	9.6	-131.8	160.4	9.6	0	0	111.6
331	K	22.3	Very low	24.5	Very low	204 Å²	204	149.5 Å²	149.5	89%	0.887	77%	0.773	S	S	*	*			trans	-78.4	148.9	163	-82.9	178	169.2	-176.1	0	110.5
332	G	23.4	Very low	24.8	Very low	79 Å²	79	150.5 Å²	150.5	81%	0.814	78%	0.78	S	S	*	*			trans	-135.8	122.3	153.6	0	0	0	0	0	109
333	Q	26.1	Very low	24.9	Very low	167 Å²	167	154.8 Å²	154.8	78%	0.78	79%	0.786	S	S	*	*			trans	-69.2	132.2	-176.7	-97.3	163.8	-63.5	0	0	112.8
334	E	24.1	Very low	25.1	Very low	145 Å²	145	153.4 Å²	153.4	68%	0.678	79%	0.787	S	S	*	*				75.2	117.8	94.3	-72.9	-179.3	-176.1	0	0	115.7
335	S	23.9	Very low	25.1	Very low	125 Å²	125	153.7 Å²	153.7	87%	0.874	78%	0.784	S	S	*	*			trans	-136.1	119.7	135.9	58.5	0	0	0	0	107.9
336	K	23.9	Very low	25.5	Very low	145 Å²	145	155.8 Å²	155.8	63%	0.63	79%	0.793	S	S	*	*			trans	-75.9	142.5	178.2	-64.3	173	175.5	-176.5	0	110
337	D	24.5	Very low	25.7	Very low	174 Å²	174	149.6 Å²	149.6	93%	0.93	78%	0.783	S	S	*	*			trans	-141.1	122.4	136.7	-85.2	-35.6	0	0	0	106.6
338	E	24.6	Very low	25.9	Very low	152 Å²	152	151.9 Å²	151.9	71%	0.71	79%	0.791	S	S	*	*			trans	-90.6	168.3	-175.3	-71.9	175.1	167.5	0	0	111.5
339	I	24.6	Very low	26	Very low	160 Å²	160	157.3 Å²	157.3	82%	0.821	80%	0.802	S	S	*	*			trans	99.1	117.4	160.5	-53.7	167.5	0	0	0	113.2
340	V	26.3	Very low	26.1	Very low	118 Å²	118	158.2 Å²	158.2	72%	0.715	81%	0.806	S	S	*	*			cis	-154.2	131.2	5.7	137	0	0	0	0	107.6
341	D	24.3	Very low	26.1	Very low	161 Å²	161	153.8 Å²	153.8	86%	0.861	80%	0.796	S	S	*	*			trans	-75.7	122.2	167.4	-87.2	-38	0	0	0	109.9
342	E	27.9	Very low	26.5	Very low	190 Å²	190	150.2 Å²	150.2	89%	0.888	79%	0.791	S	S	*	*			trans	-91.3	106.4	153.1	-92.7	-172.7	163.2	0	0	108.9	L344	E342-L344 PolarHBondContact O-N 2.99Å
343	K	26.2	Very low	26.7	Very low	187 Å²	187	155.1 Å²	155.1	81%	0.813	79%	0.79	S	S	*	*			trans	-44.7	126.4	167.7	-78.1	169.8	170.9	172.9	0	111.6
344	L	29.3	Very low	26.9	Very low	167 Å²	167	156.3 Å²	156.3	87%	0.874	79%	0.793	S	S	*	*			trans	-118.8	122.8	147.3	-77.8	174.5	0	0	0	109.2	E342 T346	E342-L344 PolarHBondContact O-N 2.99Å; L344-T346 PolarHBondContact O-N 3.41Å
345	D	26.4	Very low	26.9	Very low	135 Å²	135	157.5 Å²	157.5	72%	0.722	80%	0.798	S	S	*	*			trans	-51.5	117.6	-173.9	-75.6	-45.8	0	0	0	113.5	S347	D345-S347 VanDerWaalsContact C-N 3.33Å; D345-S347 PolarHBondContact O-N 3.33Å; D345-S347 VanDerWaalsContact O-N 3.11Å
346	T	30.6	Very low	26.9	Very low	149 Å²	149	157.4 Å²	157.4	91%	0.914	79%	0.794	S	S	*	*			trans	-77.4	84.9	161.4	49.9	0	0	0	0	109.2	L344	L344-T346 PolarHBondContact O-N 3.41Å
347	S	28.4	Very low	27.1	Very low	85 Å²	85	157.4 Å²	157.4	59%	0.594	80%	0.8	S	S	*	*			trans	-139.1	56.9	170	56.8	0	0	0	0	111.5	D345	D345-S347 VanDerWaalsContact C-N 3.33Å; D345-S347 PolarHBondContact O-N 3.33Å; D345-S347 VanDerWaalsContact O-N 3.11Å
348	F	28.8	Very low	27	Very low	197 Å²	197	155.1 Å²	155.1	86%	0.864	80%	0.796	S	S	*	*			trans	-120.2	100.6	165.3	-71.5	-74.4	0	0	0	111	I350	F348-I350 PolarHBondContact O-N 3.2Å
349	R	28	Very low	27.1	Very low	249 Å²	249	153.9 Å²	153.9	94%	0.94	80%	0.799	S	S	*	*			trans	-60.1	116.4	166.3	-76.5	179.4	173.2	-179.2	-1.7	108.7	S351	R349-S351 PolarHBondContact O-N 3.43Å; R349-S351 VanDerWaalsContact O-N 3.08Å
350	I	27.4	Very low	27.2	Very low	152 Å²	152	151.5 Å²	151.5	78%	0.779	80%	0.797	S	S	*	*			trans	-70.4	100.7	170.8	-61.5	169.9	0	0	0	107.5	F348 V352	F348-I350 PolarHBondContact O-N 3.2Å; I350-V352 HydrophobicContact CG2-CG2 4.28Å; I350-V352 PolarHBondContact O-N 2.9Å
351	S	27.8	Very low	27.3	Very low	89 Å²	89	153 Å²	153	62%	0.622	80%	0.799	S	S	*	*			trans	-72.5	105.9	160.9	47.4	0	0	0	0	107.6	R349 F353	R349-S351 PolarHBondContact O-N 3.43Å; R349-S351 VanDerWaalsContact O-N 3.08Å; S351-F353 PolarHBondContact O-N 2.93Å
352	V	29.1	Very low	27.6	Very low	128 Å²	128	148.3 Å²	148.3	78%	0.776	78%	0.779	S	S	*	*			trans	-65.3	86.8	169.3	178.6	0	0	0	0	107.7	I350 K354	I350-V352 HydrophobicContact CG2-CG2 4.28Å; I350-V352 PolarHBondContact O-N 2.9Å; V352-K354 PolarHBondContact O-N 3.25Å
353	F	28	Very low	28	Very low	183 Å²	183	146.4 Å²	146.4	80%	0.803	77%	0.774	S	S	*	*			trans	-79.6	109.6	163.5	-93.6	-83.9	0	0	0	108.2	S351 Q355	S351-F353 PolarHBondContact O-N 2.93Å; F353-Q355 PolarHBondContact O-N 3.13Å
354	K	29.8	Very low	28.4	Very low	192 Å²	192	145.3 Å²	145.3	84%	0.835	77%	0.769	S	S	*	*			trans	-47	127.6	167.3	-76.4	173	174.5	173.5	0	109	V352	V352-K354 PolarHBondContact O-N 3.25Å
355	Q	24.8	Very low	28.5	Very low	170 Å²	170	142 Å²	142	79%	0.794	75%	0.752	S	S	*	*			trans	-46.1	133.2	166.1	-83.4	174.6	-33.9	0	0	110	F353 I357	F353-Q355 PolarHBondContact O-N 3.13Å; Q355-I357 VanDerWaalsContact C-N 3.32Å; Q355-I357 PolarHBondContact O-N 2.97Å
356	P	25.3	Very low	28.9	Very low	122 Å²	122	140.2 Å²	140.2	79%	0.792	74%	0.742	S	S	*	*			trans	-66.5	102.9	155.7	26.7	-27.2	0	0	0	106.5	C358	P356-C358 PolarHBondContact O-N 3.17Å
357	I	26.4	Very low	28.8	Very low	145 Å²	145	136.2 Å²	136.2	74%	0.744	72%	0.724	S	S	*	*			trans	-56.1	108.7	161.9	-63.2	167.8	0	0	0	105	Q355 T359	Q355-I357 VanDerWaalsContact C-N 3.32Å; Q355-I357 PolarHBondContact O-N 2.97Å; I357-T359 PolarHBondContact O-N 3.03Å
358	C	23.5	Very low	29.2	Very low	127 Å²	127	136.9 Å²	136.9	86%	0.858	72%	0.724	S	S	*	*			trans	-55.3	107.4	164.8	-91.1	0	0	0	0	107.1	P356 S360	P356-C358 PolarHBondContact O-N 3.17Å; C358-S360 PolarHBondContact O-N 3.42Å
359	T	25.8	Very low	29.5	Very low	125 Å²	125	134.4 Å²	134.4	77%	0.767	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-54.3	129.4	170.4	33.4	0	0	0	0	108.5	I357 I361	I357-T359 PolarHBondContact O-N 3.03Å; T359-I361 PolarHBondContact O-N 3.14Å
360	S	28.1	Very low	29.7	Very low	111 Å²	111	131 Å²	131	78%	0.776	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-54.6	117.9	170.7	47.9	0	0	0	0	109.4	C358 S362	C358-S360 PolarHBondContact O-N 3.42Å; S360-S362 PolarHBondContact O-N 3.16Å
361	I	27.3	Very low	29.8	Very low	148 Å²	148	131.2 Å²	131.2	76%	0.759	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-54.4	122.5	164.1	-66.6	166.5	0	0	0	107.3	T359	T359-I361 PolarHBondContact O-N 3.14Å
362	S	31	Very low	30.1	Very low	63 Å²	63	133.6 Å²	133.6	44%	0.441	72%	0.715	S	S	.	*	P	Polyproline II helix	trans	-59.9	137.3	-178	170.2	0	0	0	0	111.1	S360 K364 D365	S360-S362 PolarHBondContact O-N 3.16Å; S362-K364 PolarHBondContact O-N 3.16Å; S362-K364 PolarHBondContact OG-N 3.1Å; S362-D365 PolarHBondContact O-N 3.1Å
363	L	35.7	Very low	30.1	Very low	150 Å²	150	136.8 Å²	136.8	79%	0.785	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.2	5	175.1	-78.5	162.2	0	0	0	114.2	I366	L363-I366 HydrophobicContact CD2-CD1 4.2Å
364	K	35.5	Very low	30.1	Very low	165 Å²	165	138.4 Å²	138.4	72%	0.717	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.3	-25.6	171.2	-73.9	-176.6	174.7	-178.5	0	113.1	S362	S362-K364 PolarHBondContact O-N 3.16Å; S362-K364 PolarHBondContact OG-N 3.1Å
365	D	30.9	Very low	29.9	Very low	96 Å²	96	136.3 Å²	136.3	51%	0.513	72%	0.717	S	S	.	*	H	α-helix	trans	-87.9	-11.5	-173.4	-57.5	-31	0	0	0	113.7	S362	S362-D365 PolarHBondContact O-N 3.1Å
366	I	34	Very low	30.1	Very low	99 Å²	99	137.9 Å²	137.9	51%	0.508	72%	0.722	S	S	.	*	H	α-helix	trans	-81.8	-19.6	175.6	-60.6	-178.6	0	0	0	111.6	L363	L363-I366 HydrophobicContact CD2-CD1 4.2Å
367	A	30.1	Very low	30.3	Very low	65 Å²	65	140.9 Å²	140.9	54%	0.537	72%	0.722	S	S	.	*	H	α-helix	trans	-73.9	-36.8	174.8	0	0	0	0	0	111.8	L369 K370	A367-L369 VanDerWaalsContact C-N 3.31Å; A367-L369 PolarHBondContact O-N 3.34Å; A367-K370 PolarHBondContact O-N 3.09Å
368	V	35.7	Very low	30.4	Very low	98 Å²	98	139.5 Å²	139.5	59%	0.594	72%	0.723	S	S	*	*	H	α-helix	trans	-72.2	-24	-178.1	-178.5	0	0	0	0	112.5
369	L	34.8	Very low	30.5	Very low	146 Å²	146	138 Å²	138	76%	0.764	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.8	-5.5	177.8	-85.6	155.7	0	0	0	114.6	A367	A367-L369 VanDerWaalsContact C-N 3.31Å; A367-L369 PolarHBondContact O-N 3.34Å
370	K	32.5	Very low	30.7	Very low	177 Å²	177	141.9 Å²	141.9	77%	0.77	72%	0.722	S	S	*	*	S	Bend	trans	-100.2	-5.5	176.9	-84.6	-172.3	175.8	-177.5	0	114.7	A367	A367-K370 PolarHBondContact O-N 3.09Å
371	E	30.9	Very low	30.7	Very low	157 Å²	157	142.3 Å²	142.3	73%	0.734	72%	0.722	S	S	*	*	S	Bend	trans	-83.2	-20.6	173.3	-78.7	-178	153.7	0	0	113.3	K373	E371-K373 PolarHBondContact O-N 3.24Å
372	N	32.2	Very low	30.9	Very low	139 Å²	139	143.7 Å²	143.7	74%	0.743	73%	0.725	S	S	*	*	S	Bend	trans	-94.9	30.2	-172	-70.7	-9.2	0	0	0	115.8
373	K	30.8	Very low	30.9	Very low	194 Å²	194	145.2 Å²	145.2	84%	0.843	73%	0.733	S	S	*	*			trans	-143.9	69.1	166.1	-69.7	-166.8	179.2	-175.5	0	110.7	E371	E371-K373 PolarHBondContact O-N 3.24Å
374	R	27.3	Very low	30.5	Very low	217 Å²	217	145.9 Å²	145.9	82%	0.819	74%	0.736	S	S	*	*			trans	-118.4	112.1	151.4	-73.1	-174.8	-179.7	178.9	1.8	105.9	F376	R374-F376 PolarHBondContact O-N 3.45Å
375	D	26	Very low	30.1	Very low	149 Å²	149	146.4 Å²	146.4	80%	0.797	74%	0.738	S	S	*	*			trans	-57	108.9	175.5	-57.7	-53.7	0	0	0	108.8	F377	D375-F377 PolarHBondContact O-N 3.24Å
376	F	28.1	Very low	29.8	Very low	203 Å²	203	145.1 Å²	145.1	89%	0.89	74%	0.741	S	S	*	*			trans	-72	108.4	163.4	-84.7	-90.3	0	0	0	106.9	R374	R374-F376 PolarHBondContact O-N 3.45Å
377	F	29.6	Very low	29.5	Very low	185 Å²	185	146.9 Å²	146.9	81%	0.811	76%	0.757	S	S	*	*			trans	-57.3	135.6	161.1	-77.4	-89.2	0	0	0	108.8	D375 A379	D375-F377 PolarHBondContact O-N 3.24Å; F377-A379 PolarHBondContact O-N 3.31Å
378	P	29.4	Very low	29.6	Very low	116 Å²	116	151.3 Å²	151.3	75%	0.753	77%	0.766	S	S	*	*			trans	-66.3	113.4	-179.8	26	-30.9	0	0	0	108.8	Y380	P378-Y380 PolarHBondContact O-N 3.15Å
379	A	26.1	Very low	29.4	Very low	95 Å²	95	152.1 Å²	152.1	79%	0.785	77%	0.773	S	S	*	*			trans	-58.9	123.9	161.7	0	0	0	0	0	107.4	F377	F377-A379 PolarHBondContact O-N 3.31Å
380	Y	29.6	Very low	29.2	Very low	207 Å²	207	154.5 Å²	154.5	81%	0.812	78%	0.778	S	S	*	*			trans	-41.9	139.3	172.7	-79.2	-101.3	0	0	0	111.3	P378 Q382	P378-Y380 PolarHBondContact O-N 3.15Å; Y380-Q382 PolarHBondContact O-N 3.21Å
381	P	28.1	Very low	28.9	Very low	120 Å²	120	154.3 Å²	154.3	78%	0.779	78%	0.779	S	S	*	*			trans	-60.7	111.6	166.7	25.4	-29.5	0	0	0	107.3
382	Q	30.7	Very low	29	Very low	176 Å²	176	154 Å²	154	82%	0.822	78%	0.781	S	S	*	*			trans	-55	130.1	161.1	-76.1	-171.8	-16.7	0	0	106.8	Y380 I384	Y380-Q382 PolarHBondContact O-N 3.21Å; Q382-I384 PolarHBondContact O-N 3.2Å; Q382-I384 VanDerWaalsContact O-N 3.08Å
383	P	30.3	Very low	28.8	Very low	95 Å²	95	153 Å²	153	62%	0.617	78%	0.78	S	S	*	*			trans	-59	121	171.1	2	2.9	0	0	0	107.6	F385	P383-F385 HydrophobicContact CB-CE2 4.4Å; P383-F385 HydrophobicContact CG-CE2 4.31Å; P383-F385 PolarHBondContact O-N 2.92Å
384	I	27.2	Very low	29	Very low	164 Å²	164	152.3 Å²	152.3	84%	0.841	78%	0.777	S	S	*	*			trans	-59	96.1	160.8	-61.3	166.5	0	0	0	105.1	Q382 A386	Q382-I384 PolarHBondContact O-N 3.2Å; Q382-I384 VanDerWaalsContact O-N 3.08Å; I384-A386 VanDerWaalsContact C-N 3.34Å; I384-A386 PolarHBondContact O-N 3.19Å; I384-A386 VanDerWaalsContact O-N 3.11Å
385	F	27.1	Very low	29.2	Very low	176 Å²	176	150.9 Å²	150.9	77%	0.772	78%	0.777	S	S	*	*			trans	-69.8	104.9	157.4	-77.4	-77.2	0	0	0	105.2	P383 T387	P383-F385 HydrophobicContact CB-CE2 4.4Å; P383-F385 HydrophobicContact CG-CE2 4.31Å; P383-F385 PolarHBondContact O-N 2.92Å; F385-T387 VanDerWaalsContact C-N 3.27Å; F385-T387 PolarHBondContact O-N 3.43Å
386	A	26.1	Very low	29.5	Very low	69 Å²	69	149.9 Å²	149.9	57%	0.57	77%	0.772	S	S	*	*			trans	-54.7	99.1	161.9	0	0	0	0	0	107.3	I384 H388	I384-A386 VanDerWaalsContact C-N 3.34Å; I384-A386 PolarHBondContact O-N 3.19Å; I384-A386 VanDerWaalsContact O-N 3.11Å; A386-H388 PolarHBondContact O-N 3.24Å
387	T	26.9	Very low	30	Very low	137 Å²	137	148 Å²	148	84%	0.84	77%	0.769	S	S	*	*			trans	-65	84.5	159.9	-10.8	0	0	0	0	105.6	F385	F385-T387 VanDerWaalsContact C-N 3.27Å; F385-T387 PolarHBondContact O-N 3.43Å
388	H	31.4	Very low	30.2	Very low	157 Å²	157	149.7 Å²	149.7	73%	0.727	77%	0.77	S	S	*	*			trans	-55.4	127.6	155.1	-72.2	-69.7	0	0	0	105.8	A386 K390	A386-H388 PolarHBondContact O-N 3.24Å; H388-K390 PolarHBondContact O-N 2.94Å; H388-K390 VanDerWaalsContact O-N 3.09Å
389	P	32.3	Very low	30.7	Very low	115 Å²	115	150.4 Å²	150.4	75%	0.747	77%	0.767	S	S	*	*			trans	-54.1	126.2	170.3	22.5	-29.8	0	0	0	106.3	Q391	P389-Q391 PolarHBondContact O-N 3.33Å
390	K	31	Very low	31.1	Very low	197 Å²	197	153.9 Å²	153.9	86%	0.857	77%	0.767	S	S	*	*			trans	-46.3	111.7	165.3	-76.5	175.6	177.1	174.4	0	106	H388 I392	H388-K390 PolarHBondContact O-N 2.94Å; H388-K390 VanDerWaalsContact O-N 3.09Å; K390-I392 VanDerWaalsContact C-N 3.28Å; K390-I392 PolarHBondContact O-N 3.13Å
391	Q	26.3	Very low	31.5	Very low	173 Å²	173	154.7 Å²	154.7	81%	0.808	77%	0.769	S	S	*	*			trans	-56.2	108.3	155.9	-92.3	-179	-12.7	0	0	104.7	P389 T393	P389-Q391 PolarHBondContact O-N 3.33Å; Q391-T393 PolarHBondContact O-N 3.27Å
392	I	32.1	Very low	32	Very low	151 Å²	151	152 Å²	152	77%	0.774	75%	0.753	S	S	*	*			trans	-65	84.9	160.3	-61.7	168.4	0	0	0	103.9	K390 K394	K390-I392 VanDerWaalsContact C-N 3.28Å; K390-I392 PolarHBondContact O-N 3.13Å; I392-K394 HydrophobicContact CG2-CG 4.46Å; I392-K394 PolarHBondContact O-N 3.26Å
393	T	28.3	Very low	32.3	Very low	118 Å²	118	149.4 Å²	149.4	72%	0.724	74%	0.742	S	S	*	*			trans	-64.4	98.9	155.7	9	0	0	0	0	104.1	Q391 K395	Q391-T393 PolarHBondContact O-N 3.27Å; T393-K395 PolarHBondContact O-N 2.95Å
394	K	34.5	Very low	32.8	Very low	178 Å²	178	153.7 Å²	153.7	77%	0.774	75%	0.751	S	S	*	*			trans	-51.8	97	156.2	-75.8	178.4	176.2	176.4	0	105.2	I392 D396	I392-K394 HydrophobicContact CG2-CG 4.46Å; I392-K394 PolarHBondContact O-N 3.26Å; K394-D396 PolarHBondContact O-N 3.48Å
395	K	33.2	Very low	33.4	Very low	188 Å²	188	153.7 Å²	153.7	82%	0.817	75%	0.747	S	S	*	*			trans	-63.7	116.2	156.3	-84.7	-173.9	173.2	-176.2	0	104.6	T393 I397	T393-K395 PolarHBondContact O-N 2.95Å; K395-I397 PolarHBondContact O-N 3.01Å
396	D	31.1	Very low	34	Very low	128 Å²	128	153.8 Å²	153.8	68%	0.684	75%	0.748	S	S	*	*			trans	-47.5	107.3	175.3	-74.5	-54.4	0	0	0	110.4	K394 R398	K394-D396 PolarHBondContact O-N 3.48Å; D396-R398 PolarHBondContact O-N 3.08Å
397	I	38.6	Very low	34.9	Very low	162 Å²	162	157.4 Å²	157.4	83%	0.831	75%	0.751	S	S	*	*			trans	-77.4	9.5	159.9	-65.5	168.2	0	0	0	109.3	K395 L399	K395-I397 PolarHBondContact O-N 3.01Å; I397-L399 PolarHBondContact O-N 3.28Å
398	R	34.8	Very low	35.7	Very low	221 Å²	221	155.1 Å²	155.1	83%	0.834	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.6	22.6	-174.4	-149.1	-174.3	176.9	-179.6	-1.1	114.6	D396	D396-R398 PolarHBondContact O-N 3.08Å
399	L	38.3	Very low	36.4	Very low	132 Å²	132	153.3 Å²	153.3	69%	0.691	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.5	1.4	178.7	-116.3	142	0	0	0	115.3	I397	I397-L399 PolarHBondContact O-N 3.28Å
400	E	34.9	Very low	36.7	Very low	168 Å²	168	157.1 Å²	157.1	79%	0.785	75%	0.754	S	S	*	*	S	Bend	trans	-99	-9.6	172.8	-88.3	-175.6	164	0	0	114.3
401	R	39.1	Very low	37.2	Very low	224 Å²	224	159.7 Å²	159.7	85%	0.845	76%	0.758	S	S	*	*	S	Bend	trans	-85.3	-27.5	175.5	-81.9	-176.9	177	166.3	-1.2	113.8	M403	R401-M403 PolarHBondContact O-N 3.06Å
402	S	37.4	Very low	37.7	Very low	64 Å²	64	156.3 Å²	156.3	45%	0.448	76%	0.76	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78.6	-13.2	-176	51.2	0	0	0	0	114.8
403	M	37.2	Very low	38.3	Very low	121 Å²	121	152.9 Å²	152.9	60%	0.596	76%	0.762	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90	-13.9	177.2	-95.9	-166.9	60.1	0	0	114.3	R401 F407	R401-M403 PolarHBondContact O-N 3.06Å; M403-F407 HydrophobicContact CE-CE2 4.41Å; M403-F407 WeakPolarHBondContact O-CD2 3.28Å
404	K	41.6	Very low	39.4	Very low	185 Å²	185	155.6 Å²	155.6	80%	0.804	77%	0.768	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.6	-20.5	178	-84.4	-175.8	175.1	179.8	0	113.7
405	E	38.6	Very low	40.3	Very low	163 Å²	163	156 Å²	156	76%	0.762	77%	0.77	S	S	*	*	S	Bend	trans	-91.5	-11.1	-177.8	-77.4	176.3	163.8	0	0	114.2
406	F	40.7	Very low	41.3	Very low	179 Å²	179	152.5 Å²	152.5	79%	0.785	76%	0.76	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.5	-8.1	-179.7	-104.2	-83.4	0	0	0	115.4
407	F	45.1	Very low	42.6	Very low	145 Å²	145	152.8 Å²	152.8	64%	0.636	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.3	2.7	-174.9	-70.5	-73	0	0	0	115.2	M403	M403-F407 HydrophobicContact CE-CE2 4.41Å; M403-F407 WeakPolarHBondContact O-CD2 3.28Å
408	A	42.4	Very low	43.6	Very low	88 Å²	88	148.7 Å²	148.7	73%	0.727	74%	0.74	S	S	*	*	S	Bend	trans	-90.3	-2.2	-174.5	0	0	0	0	0	115.1
409	T	47	Very low	44.9	Very low	120 Å²	120	145 Å²	145	74%	0.736	73%	0.73	S	S	*	*			trans	-139.4	81.6	-175.8	26.5	0	0	0	0	112
410	Q	39.6	Very low	46.1	Very low	195 Å²	195	141.5 Å²	141.5	91%	0.911	72%	0.717	S	S	*	*			trans	-160.4	128.4	137.1	-77.4	-146.3	-17.4	0	0	110.2
411	R	41.1	Very low	47.8	Very low	250 Å²	250	137.1 Å²	137.1	94%	0.943	70%	0.698	S	S	*	*			trans	-71.3	150.7	169.6	-91	175.2	171.9	167.8	-3.2	109.8
412	A	36.4	Very low	49.5	Very low	102 Å²	102	130.2 Å²	130.2	84%	0.843	68%	0.677	S	S	*	*	S	Bend	trans	98	94.5	166	0	0	0	0	0	117.4
413	G	44.1	Very low	51.3	Low	79 Å²	79	132.1 Å²	132.1	81%	0.814	68%	0.683	S	S	*	*				75.1	47.8	124.5	0	0	0	0	0	119.8
414	M	52.5	Low	53.1	Low	175 Å²	175	132 Å²	132	86%	0.862	68%	0.679	S	S	*	*			trans	-159.6	134.2	154.9	-108.8	172.2	137.8	0	0	110	L416	M414-L416 VanDerWaalsContact C-N 3.35Å; M414-L416 PolarHBondContact O-N 3.27Å
415	K	52.2	Low	55	Low	187 Å²	187	130.1 Å²	130.1	81%	0.813	67%	0.668	S	S	*	*			trans	-68.4	84.8	-177	-75.7	179.7	177.4	176.4	0	111	Q417 T418	K415-Q417 PolarHBondContact O-N 3.49Å; K415-Q417 VanDerWaalsContact O-N 3.1Å; K415-T418 PolarHBondContact O-N 3.08Å; K415-T418 PolarHBondContact O-OG1 3.21Å
416	L	54.5	Low	56.9	Low	115 Å²	115	128.7 Å²	128.7	60%	0.602	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.7	-5.8	175	-77.3	158.3	0	0	0	114.4	M414 T418	M414-L416 VanDerWaalsContact C-N 3.35Å; M414-L416 PolarHBondContact O-N 3.27Å; L416-T418 VanDerWaalsContact C-N 3.31Å; L416-T418 PolarHBondContact O-N 3.21Å
417	Q	58.4	Low	58.7	Low	133 Å²	133	122.3 Å²	122.3	62%	0.621	64%	0.636	S	S	*	*	H	α-helix	trans	-59.6	-39.9	174	-157.8	81.1	18	0	0	112	K415 F419 S420 D421	K415-Q417 PolarHBondContact O-N 3.49Å; K415-Q417 VanDerWaalsContact O-N 3.1Å; Q417-F419 VanDerWaalsContact C-N 3.35Å; Q417-F419 PolarHBondContact O-N 2.98Å; Q417-S420 PolarHBondContact O-N 2.89Å; Q417-D421 VanDerWaalsContact O-CG 3.22Å; Q417-D421 PolarHBondContact O-N 2.93Å
418	T	60.6	Low	60.4	Low	77 Å²	77	120.5 Å²	120.5	47%	0.472	63%	0.63	S	S	.	*	H	α-helix	trans	-64.4	-36.2	-175.5	46.4	0	0	0	0	112.9	K415 L416 I422	K415-T418 PolarHBondContact O-N 3.08Å; K415-T418 PolarHBondContact O-OG1 3.21Å; L416-T418 VanDerWaalsContact C-N 3.31Å; L416-T418 PolarHBondContact O-N 3.21Å; T418-I422 WeakPolarHBondContact O-CD1 3.36Å; T418-I422 WeakPolarHBondContact O-CG1 3.47Å; T418-I422 PolarHBondContact O-N 2.96Å; T418-I422 VanDerWaalsContact O-N 3.12Å
419	F	60.5	Low	62.2	Low	142 Å²	142	119.8 Å²	119.8	62%	0.623	61%	0.612	S	S	*	*	H	α-helix	trans	-73.9	-35.8	177.2	-70.9	-75.7	0	0	0	112.6	Q417 D421 I422 D423	Q417-F419 VanDerWaalsContact C-N 3.35Å; Q417-F419 PolarHBondContact O-N 2.98Å; F419-D421 VanDerWaalsContact C-N 3.32Å; F419-D421 PolarHBondContact O-N 3.23Å; F419-I422 HydrophobicContact CD1-CD1 4.49Å; F419-I422 PolarHBondContact O-N 3.46Å; F419-D423 PolarHBondContact O-N 2.91Å
420	S	64.9	Low	63.7	Low	60 Å²	60	121.4 Å²	121.4	42%	0.42	61%	0.608	S	S	.	*	H	α-helix	trans	-66.6	-34.8	174	-172	0	0	0	0	112.5	Q417 K424	Q417-S420 PolarHBondContact O-N 2.89Å; S420-K424 WeakPolarHBondContact O-CG 3.5Å; S420-K424 PolarHBondContact O-N 2.95Å
421	D	71.1	Confident	65.6	Low	75 Å²	75	119 Å²	119	40%	0.401	60%	0.595	S	S	.	*	H	α-helix	trans	-71.9	-34.9	176.5	-65.3	-29.5	0	0	0	111.7	Q417 F419 K424 Y425	Q417-D421 VanDerWaalsContact O-CG 3.22Å; Q417-D421 PolarHBondContact O-N 2.93Å; F419-D421 VanDerWaalsContact C-N 3.32Å; F419-D421 PolarHBondContact O-N 3.23Å; D421-K424 PolarHBondContact O-N 3.3Å; D421-Y425 WeakPolarHBondContact O-CB 3.46Å; D421-Y425 PolarHBondContact O-N 2.87Å
422	I	74.4	Confident	67.4	Low	79 Å²	79	112.5 Å²	112.5	41%	0.405	58%	0.575	S	S	.	*	H	α-helix	trans	-65.1	-45	172.8	-69.4	162.9	0	0	0	111.2	T418 F419 K424 Y425 Y426	T418-I422 WeakPolarHBondContact O-CD1 3.36Å; T418-I422 WeakPolarHBondContact O-CG1 3.47Å; T418-I422 PolarHBondContact O-N 2.96Å; T418-I422 VanDerWaalsContact O-N 3.12Å; F419-I422 HydrophobicContact CD1-CD1 4.49Å; F419-I422 PolarHBondContact O-N 3.46Å; I422-K424 PolarHBondContact O-N 3.35Å; I422-Y425 WeakPolarHBondContact O-CB 3.46Å; I422-Y425 PolarHBondContact O-N 3.37Å; I422-Y426 HydrophobicContact CG2-CD2 3.72Å; I422-Y426 HydrophobicContact CG2-CE2 3.51Å; I422-Y426 VanDerWaalsContact O-CD2 3.23Å; I422-Y426 WeakPolarHBondContact O-CD2 3.05Å; I422-Y426 PolarHBondContact O-N 3.24Å
423	D	73.8	Confident	69.6	Low	105 Å²	105	112.2 Å²	112.2	56%	0.561	56%	0.557	S	S	*	*	H	α-helix	trans	-65.8	-38.2	177.5	-83	-17	0	0	0	112.4	F419 Y425 Y426 A427	F419-D423 PolarHBondContact O-N 2.91Å; D423-Y425 VanDerWaalsContact C-N 3.34Å; D423-Y426 PolarHBondContact O-N 2.85Å; D423-A427 WeakPolarHBondContact O-CB 3.24Å; D423-A427 PolarHBondContact O-N 2.87Å
424	K	76	Confident	71.3	Confident	119 Å²	119	111 Å²	111	52%	0.517	54%	0.535	S	S	.	.	H	α-helix	trans	-60.2	-44.4	171.1	-84.3	178	-178.2	168.1	0	111.6	S420 D421 I422 A427 E428	S420-K424 WeakPolarHBondContact O-CG 3.5Å; S420-K424 PolarHBondContact O-N 2.95Å; D421-K424 PolarHBondContact O-N 3.3Å; I422-K424 PolarHBondContact O-N 3.35Å; K424-A427 PolarHBondContact O-N 3.3Å; K424-E428 WeakPolarHBondContact O-CB 3.31Å; K424-E428 WeakPolarHBondContact O-CG 3.45Å; K424-E428 PolarHBondContact O-N 3.06Å
425	Y	80.3	Confident	72.8	Confident	144 Å²	144	108.4 Å²	108.4	57%	0.565	52%	0.52	S	S	*	.	H	α-helix	trans	-60.4	-46.9	178.4	179	-94.8	0	0	0	112	D421 I422 D423 A427 E428 Q429	D421-Y425 WeakPolarHBondContact O-CB 3.46Å; D421-Y425 PolarHBondContact O-N 2.87Å; I422-Y425 WeakPolarHBondContact O-CB 3.46Å; I422-Y425 PolarHBondContact O-N 3.37Å; D423-Y425 VanDerWaalsContact C-N 3.34Å; Y425-A427 PolarHBondContact O-N 3.26Å; Y425-E428 PolarHBondContact O-N 3.24Å; Y425-Q429 WeakPolarHBondContact O-CB 3.49Å; Y425-Q429 PolarHBondContact O-N 3.07Å
426	Y	78.5	Confident	74.5	Confident	134 Å²	134	105.2 Å²	105.2	53%	0.525	51%	0.507	S	S	.	.	H	α-helix	trans	-66	-35.4	176.6	-78.5	-66.6	0	0	0	113.2	I422 D423 Q429 K430	I422-Y426 HydrophobicContact CG2-CD2 3.72Å; I422-Y426 HydrophobicContact CG2-CE2 3.51Å; I422-Y426 VanDerWaalsContact O-CD2 3.23Å; I422-Y426 WeakPolarHBondContact O-CD2 3.05Å; I422-Y426 PolarHBondContact O-N 3.24Å; D423-Y426 PolarHBondContact O-N 2.85Å; Y426-Q429 PolarHBondContact O-N 2.76Å; Y426-K430 PolarHBondContact O-N 3.1Å
427	A	79.4	Confident	76.1	Confident	44 Å²	44	105.6 Å²	105.6	36%	0.364	51%	0.505	S	S	.	.	H	α-helix	trans	-66.6	-38.9	174.2	0	0	0	0	0	111.9	D423 K424 Y425 K431	D423-A427 WeakPolarHBondContact O-CB 3.24Å; D423-A427 PolarHBondContact O-N 2.87Å; K424-A427 PolarHBondContact O-N 3.3Å; Y425-A427 PolarHBondContact O-N 3.26Å; A427-K431 WeakPolarHBondContact O-CB 3.46Å; A427-K431 VanDerWaalsContact O-CG 3.27Å; A427-K431 WeakPolarHBondContact O-CG 3.48Å; A427-K431 PolarHBondContact O-N 2.91Å
428	E	80.5	Confident	77.4	Confident	108 Å²	108	105.3 Å²	105.3	51%	0.505	50%	0.502	S	S	.	.	H	α-helix	trans	-66.9	-41.6	173.9	-75.6	178	-176.1	0	0	111.8	K424 Y425 K431 Q432	K424-E428 WeakPolarHBondContact O-CB 3.31Å; K424-E428 WeakPolarHBondContact O-CG 3.45Å; K424-E428 PolarHBondContact O-N 3.06Å; Y425-E428 PolarHBondContact O-N 3.24Å; E428-K431 WeakPolarHBondContact O-CB 3.32Å; E428-K431 PolarHBondContact O-N 3.14Å; E428-Q432 WeakPolarHBondContact O-CG 3.44Å; E428-Q432 PolarHBondContact O-N 2.83Å
429	Q	79.8	Confident	78.9	Confident	73 Å²	73	105.4 Å²	105.4	34%	0.341	50%	0.502	S	S	.	.	H	α-helix	trans	-61.4	-46.2	175.4	-169.6	176	-5.7	0	0	111.7	Y425 Y426 K431 Q432 E433	Y425-Q429 WeakPolarHBondContact O-CB 3.49Å; Y425-Q429 PolarHBondContact O-N 3.07Å; Y426-Q429 PolarHBondContact O-N 2.76Å; Q429-K431 VanDerWaalsContact C-N 3.33Å; Q429-K431 PolarHBondContact O-N 2.9Å; Q429-Q432 PolarHBondContact O-N 3.12Å; Q429-E433 PolarHBondContact O-N 2.84Å
430	K	78.5	Confident	80.3	Confident	153 Å²	153	106.2 Å²	106.2	67%	0.665	50%	0.501	S	S	*	.	H	α-helix	trans	-61.9	-37.5	173.9	-78.3	-178.2	177.7	176.2	0	112.7	Y426 C434	Y426-K430 PolarHBondContact O-N 3.1Å; K430-C434 VanDerWaalsContact O-CB 3.25Å; K430-C434 WeakPolarHBondContact O-CB 3.39Å; K430-C434 PolarHBondContact O-N 3.08Å
431	K	80.9	Confident	81.5	Confident	146 Å²	146	106 Å²	106	64%	0.635	50%	0.503	S	S	*	.	H	α-helix	trans	-65.4	-41	174.4	-77.4	172.5	-177.7	175.3	0	111.5	A427 E428 Q429 H435	A427-K431 WeakPolarHBondContact O-CB 3.46Å; A427-K431 VanDerWaalsContact O-CG 3.27Å; A427-K431 WeakPolarHBondContact O-CG 3.48Å; A427-K431 PolarHBondContact O-N 2.91Å; E428-K431 WeakPolarHBondContact O-CB 3.32Å; E428-K431 PolarHBondContact O-N 3.14Å; Q429-K431 VanDerWaalsContact C-N 3.33Å; Q429-K431 PolarHBondContact O-N 2.9Å; K431-H435 WeakPolarHBondContact O-CB 3.5Å; K431-H435 PolarHBondContact O-N 3.43Å
432	Q	79.1	Confident	82.4	Confident	113 Å²	113	106.3 Å²	106.3	53%	0.528	51%	0.507	S	S	.	.	H	α-helix	trans	-67.5	-41.5	177	-72.2	179.7	11.5	0	0	112.1	E428 Q429 H435 K436	E428-Q432 WeakPolarHBondContact O-CG 3.44Å; E428-Q432 PolarHBondContact O-N 2.83Å; Q429-Q432 PolarHBondContact O-N 3.12Å; Q432-H435 PolarHBondContact O-N 3.11Å; Q432-K436 WeakPolarHBondContact O-CG 3.41Å; Q432-K436 PolarHBondContact O-N 3.31Å
433	E	81.6	Confident	83.2	Confident	96 Å²	96	104.6 Å²	104.6	45%	0.449	51%	0.505	S	S	.	.	H	α-helix	trans	-63.4	-47.2	174.5	-76.7	175.6	-180	0	0	111.6	Q429 H435 K436 E437	Q429-E433 PolarHBondContact O-N 2.84Å; E433-H435 PolarHBondContact O-N 3.37Å; E433-K436 WeakPolarHBondContact O-CB 3.46Å; E433-K436 PolarHBondContact O-N 2.76Å; E433-K436 VanDerWaalsContact O-N 3.13Å; E433-E437 WeakPolarHBondContact O-CG 3.4Å; E433-E437 PolarHBondContact O-N 3.28Å
434	C	80.4	Confident	84	Confident	52 Å²	52	106.2 Å²	106.2	35%	0.351	51%	0.511	S	S	.	.	H	α-helix	trans	-59.6	-36.1	174	-176.4	0	0	0	0	112	K430 K438	K430-C434 VanDerWaalsContact O-CB 3.25Å; K430-C434 WeakPolarHBondContact O-CB 3.39Å; K430-C434 PolarHBondContact O-N 3.08Å; C434-K438 VanDerWaalsContact O-CG 3.28Å; C434-K438 WeakPolarHBondContact O-CG 3.07Å; C434-K438 PolarHBondContact O-N 3.18Å
435	H	83.1	Confident	84.6	Confident	121 Å²	121	102.9 Å²	102.9	56%	0.56	51%	0.506	S	S	*	.	H	α-helix	trans	-67.7	-45.1	174.3	-171.9	68.4	0	0	0	111.8	K431 Q432 E433 E437 K438 V439	K431-H435 WeakPolarHBondContact O-CB 3.5Å; K431-H435 PolarHBondContact O-N 3.43Å; Q432-H435 PolarHBondContact O-N 3.11Å; E433-H435 PolarHBondContact O-N 3.37Å; H435-E437 VanDerWaalsContact C-N 3.29Å; H435-E437 PolarHBondContact O-N 3.11Å; H435-K438 PolarHBondContact O-N 2.95Å; H435-V439 VanDerWaalsContact O-CG2 3.32Å; H435-V439 WeakPolarHBondContact O-CG2 3.35Å; H435-V439 PolarHBondContact O-N 3.5Å
436	K	88.2	Confident	85.1	Confident	121 Å²	121	101.6 Å²	101.6	53%	0.526	51%	0.505	S	S	.	.	H	α-helix	trans	-60.2	-37.7	175.4	-73	172.5	-177.3	175.8	0	112.1	Q432 E433 R440	Q432-K436 WeakPolarHBondContact O-CG 3.41Å; Q432-K436 PolarHBondContact O-N 3.31Å; E433-K436 WeakPolarHBondContact O-CB 3.46Å; E433-K436 PolarHBondContact O-N 2.76Å; E433-K436 VanDerWaalsContact O-N 3.13Å; K436-R440 WeakPolarHBondContact O-CB 3.36Å; K436-R440 WeakPolarHBondContact O-CG 3.5Å; K436-R440 PolarHBondContact O-N 3.39Å
437	E	87.9	Confident	85.8	Confident	123 Å²	123	98.9 Å²	98.9	58%	0.575	50%	0.502	S	S	*	.	H	α-helix	trans	-67.6	-43.8	174.2	-74.2	179.9	168.8	0	0	112.3	E433 H435 V439 R440 A441	E433-E437 WeakPolarHBondContact O-CG 3.4Å; E433-E437 PolarHBondContact O-N 3.28Å; H435-E437 VanDerWaalsContact C-N 3.29Å; H435-E437 PolarHBondContact O-N 3.11Å; E437-V439 VanDerWaalsContact C-N 3.35Å; E437-V439 PolarHBondContact O-N 3.35Å; E437-R440 PolarHBondContact O-N 3.48Å; E437-A441 WeakPolarHBondContact O-CB 3.47Å; E437-A441 PolarHBondContact O-N 3.24Å
438	K	86.6	Confident	86.3	Confident	127 Å²	127	99.2 Å²	99.2	55%	0.552	51%	0.505	S	S	*	.	H	α-helix	trans	-60.9	-43.2	174.7	-75.2	170.7	-178.3	171.9	0	111.8	C434 H435 A441 V442	C434-K438 VanDerWaalsContact O-CG 3.28Å; C434-K438 WeakPolarHBondContact O-CG 3.07Å; C434-K438 PolarHBondContact O-N 3.18Å; H435-K438 PolarHBondContact O-N 2.95Å; K438-A441 PolarHBondContact O-N 3.06Å; K438-V442 WeakPolarHBondContact O-CB 3.49Å; K438-V442 VanDerWaalsContact O-CG2 3.26Å; K438-V442 WeakPolarHBondContact O-CG2 3.12Å; K438-V442 PolarHBondContact O-N 3.36Å
439	V	90.8	Very high	86.8	Confident	78 Å²	78	103.1 Å²	103.1	47%	0.473	52%	0.515	S	S	.	.	H	α-helix	trans	-62.1	-43.9	176.2	172.1	0	0	0	0	110.7	H435 E437 V442 A443	H435-V439 VanDerWaalsContact O-CG2 3.32Å; H435-V439 WeakPolarHBondContact O-CG2 3.35Å; H435-V439 PolarHBondContact O-N 3.5Å; E437-V439 VanDerWaalsContact C-N 3.35Å; E437-V439 PolarHBondContact O-N 3.35Å; V439-V442 PolarHBondContact O-N 3.08Å; V439-A443 WeakPolarHBondContact O-CB 3.43Å; V439-A443 PolarHBondContact O-N 3.25Å
440	R	90.1	Very high	87.3	Confident	159 Å²	159	104.5 Å²	104.5	60%	0.6	52%	0.521	S	S	*	.	H	α-helix	trans	-61.4	-43.5	174.2	-80.4	-174.3	-85.8	-176.9	-2.8	112.5	K436 E437 A443 M444	K436-R440 WeakPolarHBondContact O-CB 3.36Å; K436-R440 WeakPolarHBondContact O-CG 3.5Å; K436-R440 PolarHBondContact O-N 3.39Å; E437-R440 PolarHBondContact O-N 3.48Å; R440-A443 PolarHBondContact O-N 3.08Å; R440-M444 WeakPolarHBondContact O-CG 2.95Å; R440-M444 PolarHBondContact O-N 3.36Å
441	A	89.7	Confident	87.9	Confident	55 Å²	55	105.9 Å²	105.9	46%	0.455	52%	0.522	S	S	.	.	H	α-helix	trans	-63.9	-41	177.1	0	0	0	0	0	112.2	E437 K438 M444 A445	E437-A441 WeakPolarHBondContact O-CB 3.47Å; E437-A441 PolarHBondContact O-N 3.24Å; K438-A441 PolarHBondContact O-N 3.06Å; A441-M444 PolarHBondContact O-N 3.05Å; A441-A445 WeakPolarHBondContact O-CB 3.43Å; A441-A445 PolarHBondContact O-N 3.44Å
442	V	90.6	Very high	88.4	Confident	82 Å²	82	103.2 Å²	103.2	50%	0.497	52%	0.518	S	S	.	.	H	α-helix	trans	-65.3	-42.8	175.6	171.4	0	0	0	0	111	K438 V439 A445 Q446	K438-V442 WeakPolarHBondContact O-CB 3.49Å; K438-V442 VanDerWaalsContact O-CG2 3.26Å; K438-V442 WeakPolarHBondContact O-CG2 3.12Å; K438-V442 PolarHBondContact O-N 3.36Å; V439-V442 PolarHBondContact O-N 3.08Å; V442-A445 PolarHBondContact O-N 3.36Å; V442-Q446 WeakPolarHBondContact O-CG 3.45Å; V442-Q446 PolarHBondContact O-N 3.16Å
443	A	90.9	Very high	89	Confident	44 Å²	44	106 Å²	106	36%	0.364	52%	0.524	S	S	.	.	H	α-helix	trans	-62.3	-45.1	176.2	0	0	0	0	0	111.7	V439 R440 A445 Q446 V447	V439-A443 WeakPolarHBondContact O-CB 3.43Å; V439-A443 PolarHBondContact O-N 3.25Å; R440-A443 PolarHBondContact O-N 3.08Å; A443-A445 VanDerWaalsContact C-N 3.33Å; A443-A445 PolarHBondContact O-N 3.17Å; A443-Q446 PolarHBondContact O-N 3.49Å; A443-V447 WeakPolarHBondContact O-CG2 3.48Å; A443-V447 PolarHBondContact O-N 3.23Å
444	M	91.1	Very high	89.6	Confident	139 Å²	139	105 Å²	105	69%	0.685	52%	0.524	S	S	*	.	H	α-helix	trans	-62.3	-39.7	174.8	-71.9	-156.4	-64.7	0	0	112.2	R440 A441 V447 A448	R440-M444 WeakPolarHBondContact O-CG 2.95Å; R440-M444 PolarHBondContact O-N 3.36Å; A441-M444 PolarHBondContact O-N 3.05Å; M444-V447 PolarHBondContact O-N 3.49Å; M444-A448 WeakPolarHBondContact O-CB 3.26Å; M444-A448 PolarHBondContact O-N 3Å
445	A	88.9	Confident	90.1	Very high	49 Å²	49	106.3 Å²	106.3	41%	0.405	53%	0.531	S	S	.	.	H	α-helix	trans	-65.8	-37.1	176	0	0	0	0	0	112.4	A441 V442 A443 R449	A441-A445 WeakPolarHBondContact O-CB 3.43Å; A441-A445 PolarHBondContact O-N 3.44Å; V442-A445 PolarHBondContact O-N 3.36Å; A443-A445 VanDerWaalsContact C-N 3.33Å; A443-A445 PolarHBondContact O-N 3.17Å; A445-R449 WeakPolarHBondContact O-CB 3.33Å; A445-R449 WeakPolarHBondContact O-CG 3.29Å; A445-R449 PolarHBondContact O-N 3.35Å
446	Q	90.8	Very high	90.6	Very high	116 Å²	116	104.6 Å²	104.6	54%	0.542	53%	0.528	S	S	.	.	H	α-helix	trans	-66.4	-45.1	174.3	-75.5	175.8	-12.8	0	0	111.6	V442 A443 A448 R449 E450	V442-Q446 WeakPolarHBondContact O-CG 3.45Å; V442-Q446 PolarHBondContact O-N 3.16Å; A443-Q446 PolarHBondContact O-N 3.49Å; Q446-A448 VanDerWaalsContact C-N 3.33Å; Q446-A448 PolarHBondContact O-N 3.12Å; Q446-R449 WeakPolarHBondContact O-CB 3.37Å; Q446-R449 PolarHBondContact O-N 3.5Å; Q446-E450 PolarHBondContact O-N 3.08Å
447	V	91.9	Very high	90.8	Very high	77 Å²	77	103.2 Å²	103.2	47%	0.467	53%	0.527	S	S	.	.	H	α-helix	trans	-61	-42.5	175.3	172.5	0	0	0	0	111.2	A443 M444 R449 E450 R451	A443-V447 WeakPolarHBondContact O-CG2 3.48Å; A443-V447 PolarHBondContact O-N 3.23Å; M444-V447 PolarHBondContact O-N 3.49Å; V447-R449 PolarHBondContact O-N 3.26Å; V447-E450 PolarHBondContact O-N 3.43Å; V447-R451 WeakPolarHBondContact O-CG 3.38Å; V447-R451 PolarHBondContact O-N 3Å
448	A	90.3	Very high	91	Very high	52 Å²	52	102.5 Å²	102.5	43%	0.43	52%	0.523	S	S	.	.	H	α-helix	trans	-62.6	-40.8	175.4	0	0	0	0	0	112.1	M444 Q446 R451 V452	M444-A448 WeakPolarHBondContact O-CB 3.26Å; M444-A448 PolarHBondContact O-N 3Å; Q446-A448 VanDerWaalsContact C-N 3.33Å; Q446-A448 PolarHBondContact O-N 3.12Å; A448-R451 PolarHBondContact O-N 3.39Å; A448-V452 WeakPolarHBondContact O-CG2 3.38Å; A448-V452 PolarHBondContact O-N 3.38Å; A448-V452 VanDerWaalsContact O-N 3.09Å
449	R	90.8	Very high	91.3	Very high	190 Å²	190	101.2 Å²	101.2	72%	0.717	52%	0.519	S	S	*	.	H	α-helix	trans	-62.1	-43.8	175.2	-79.2	177.2	179	-174.7	0.5	112.5	A445 Q446 V447 V452 R453	A445-R449 WeakPolarHBondContact O-CB 3.33Å; A445-R449 WeakPolarHBondContact O-CG 3.29Å; A445-R449 PolarHBondContact O-N 3.35Å; Q446-R449 WeakPolarHBondContact O-CB 3.37Å; Q446-R449 PolarHBondContact O-N 3.5Å; V447-R449 PolarHBondContact O-N 3.26Å; R449-V452 PolarHBondContact O-N 2.95Å; R449-R453 WeakPolarHBondContact O-CB 3.36Å; R449-R453 PolarHBondContact O-N 2.93Å
450	E	90.9	Very high	91.4	Very high	102 Å²	102	101.3 Å²	101.3	48%	0.477	52%	0.517	S	S	.	.	H	α-helix	trans	-66.9	-37.6	178.5	-70.6	-57	153.2	0	0	111.9	Q446 V447 V452 R453 V454	Q446-E450 PolarHBondContact O-N 3.08Å; V447-E450 PolarHBondContact O-N 3.43Å; E450-V452 VanDerWaalsContact C-N 3.35Å; E450-V452 PolarHBondContact O-N 3.42Å; E450-R453 WeakPolarHBondContact O-CB 3.28Å; E450-R453 PolarHBondContact O-N 3.21Å; E450-R453 VanDerWaalsContact O-N 3.14Å; E450-R453 IonicContact OE1-NH1 3.78Å; E450-R453 WeakPolarHBondContact OE2-CD 3.42Å; E450-R453 IonicContact OE2-NH1 3.87Å; E450-V454 WeakPolarHBondContact O-CG2 3.34Å; E450-V454 PolarHBondContact O-N 3.39Å
451	R	90.8	Very high	91.6	Very high	181 Å²	181	97.6 Å²	97.6	68%	0.683	51%	0.509	S	S	*	.	H	α-helix	trans	-59.2	-44.9	172.5	-72.4	176.9	-176.9	-169.5	0.8	112.2	V447 A448 R453 V454 T455	V447-R451 WeakPolarHBondContact O-CG 3.38Å; V447-R451 PolarHBondContact O-N 3Å; A448-R451 PolarHBondContact O-N 3.39Å; R451-R453 VanDerWaalsContact C-N 3.3Å; R451-R453 PolarHBondContact O-N 3.38Å; R451-V454 PolarHBondContact O-N 3.39Å; R451-T455 WeakPolarHBondContact O-CG2 3.38Å; R451-T455 PolarHBondContact O-N 3.22Å; R451-T455 VanDerWaalsContact O-N 3.08Å; R451-T455 PolarHBondContact O-OG1 2.92Å
452	V	91.4	Very high	91.8	Very high	90 Å²	90	101.1 Å²	101.1	55%	0.545	52%	0.516	S	S	.	.	H	α-helix	trans	-64.3	-37.4	175.7	173.6	0	0	0	0	111.1	A448 R449 E450 T455 V456	A448-V452 WeakPolarHBondContact O-CG2 3.38Å; A448-V452 PolarHBondContact O-N 3.38Å; A448-V452 VanDerWaalsContact O-N 3.09Å; R449-V452 PolarHBondContact O-N 2.95Å; E450-V452 VanDerWaalsContact C-N 3.35Å; E450-V452 PolarHBondContact O-N 3.42Å; V452-T455 WeakPolarHBondContact CA-OG1 3.22Å; V452-T455 PolarHBondContact O-N 3.39Å; V452-T455 PolarHBondContact O-OG1 3.33Å; V452-V456 HydrophobicContact CG1-CG2 4.23Å; V452-V456 WeakPolarHBondContact O-CB 3.49Å; V452-V456 WeakPolarHBondContact O-CG2 3.43Å; V452-V456 PolarHBondContact O-N 2.98Å
453	R	92.8	Very high	91.9	Very high	172 Å²	172	103.2 Å²	103.2	65%	0.649	52%	0.518	S	S	*	.	H	α-helix	trans	-65.2	-42.3	178.6	-166.5	-179.1	-176.4	-172.9	-0.3	111.9	R449 E450 R451 N457	R449-R453 WeakPolarHBondContact O-CB 3.36Å; R449-R453 PolarHBondContact O-N 2.93Å; E450-R453 WeakPolarHBondContact O-CB 3.28Å; E450-R453 PolarHBondContact O-N 3.21Å; E450-R453 VanDerWaalsContact O-N 3.14Å; E450-R453 IonicContact OE1-NH1 3.78Å; E450-R453 WeakPolarHBondContact OE2-CD 3.42Å; E450-R453 IonicContact OE2-NH1 3.87Å; R451-R453 VanDerWaalsContact C-N 3.3Å; R451-R453 PolarHBondContact O-N 3.38Å; R453-N457 WeakPolarHBondContact O-CB 3.49Å; R453-N457 PolarHBondContact O-N 2.74Å
454	V	93.2	Very high	92	Very high	76 Å²	76	106.4 Å²	106.4	46%	0.461	52%	0.524	S	S	.	.	H	α-helix	trans	-64.4	-47.8	176.6	174.4	0	0	0	0	110.7	E450 R451 V456 N457 E458	E450-V454 WeakPolarHBondContact O-CG2 3.34Å; E450-V454 PolarHBondContact O-N 3.39Å; R451-V454 PolarHBondContact O-N 3.39Å; V454-V456 PolarHBondContact O-N 2.94Å; V454-N457 PolarHBondContact O-N 3.32Å; V454-N457 VanDerWaalsContact O-N 3.11Å; V454-E458 HydrophobicContact CG1-CG 4.45Å; V454-E458 WeakPolarHBondContact O-CG 3.29Å; V454-E458 PolarHBondContact O-N 3.04Å
455	T	91.2	Very high	92.2	Very high	79 Å²	79	107.6 Å²	107.6	49%	0.485	52%	0.522	S	S	.	.	H	α-helix	trans	-64.5	-38.1	179.8	56.2	0	0	0	0	112.7	R451 V452 N457 E458 H459	R451-T455 WeakPolarHBondContact O-CG2 3.38Å; R451-T455 PolarHBondContact O-N 3.22Å; R451-T455 VanDerWaalsContact O-N 3.08Å; R451-T455 PolarHBondContact O-OG1 2.92Å; V452-T455 WeakPolarHBondContact CA-OG1 3.22Å; V452-T455 PolarHBondContact O-N 3.39Å; V452-T455 PolarHBondContact O-OG1 3.33Å; T455-N457 VanDerWaalsContact C-N 3.34Å; T455-E458 PolarHBondContact O-N 3.25Å; T455-H459 WeakPolarHBondContact O-CB 3.41Å; T455-H459 PolarHBondContact O-N 3.11Å
456	V	92.9	Very high	92.3	Very high	84 Å²	84	108 Å²	108	51%	0.509	53%	0.525	S	S	.	.	H	α-helix	trans	-62.7	-42.4	173	168.8	0	0	0	0	110.9	V452 V454 H459 L460	V452-V456 HydrophobicContact CG1-CG2 4.23Å; V452-V456 WeakPolarHBondContact O-CB 3.49Å; V452-V456 WeakPolarHBondContact O-CG2 3.43Å; V452-V456 PolarHBondContact O-N 2.98Å; V454-V456 PolarHBondContact O-N 2.94Å; V456-H459 PolarHBondContact O-N 3.19Å; V456-L460 WeakPolarHBondContact O-CB 3.36Å; V456-L460 PolarHBondContact O-N 3.18Å
457	N	92.7	Very high	92.4	Very high	93 Å²	93	106.2 Å²	106.2	50%	0.497	52%	0.522	S	S	.	.	H	α-helix	trans	-68.3	-40.2	-179.5	-161.7	38.9	0	0	0	112	R453 V454 T455 L460 N461	R453-N457 WeakPolarHBondContact O-CB 3.49Å; R453-N457 PolarHBondContact O-N 2.74Å; V454-N457 PolarHBondContact O-N 3.32Å; V454-N457 VanDerWaalsContact O-N 3.11Å; T455-N457 VanDerWaalsContact C-N 3.34Å; N457-L460 PolarHBondContact O-N 3.16Å; N457-N461 WeakPolarHBondContact O-CB 3.49Å; N457-N461 VanDerWaalsContact O-CG 3.3Å; N457-N461 PolarHBondContact O-N 3.3Å; N457-N461 PolarHBondContact O-ND2 3.25Å
458	E	92.5	Very high	92.5	Very high	107 Å²	107	108.1 Å²	108.1	50%	0.5	53%	0.526	S	S	.	.	H	α-helix	trans	-59.7	-47.6	172.6	-73.9	172.5	176.8	0	0	111.4	V454 T455 L460 N461 Q462	V454-E458 HydrophobicContact CG1-CG 4.45Å; V454-E458 WeakPolarHBondContact O-CG 3.29Å; V454-E458 PolarHBondContact O-N 3.04Å; T455-E458 PolarHBondContact O-N 3.25Å; E458-L460 VanDerWaalsContact C-N 3.3Å; E458-L460 PolarHBondContact O-N 3.23Å; E458-N461 PolarHBondContact O-N 3.4Å; E458-Q462 WeakPolarHBondContact O-CG 3.21Å; E458-Q462 PolarHBondContact O-N 2.88Å
459	H	93.3	Very high	92.6	Very high	100 Å²	100	111 Å²	111	46%	0.463	53%	0.529	S	S	.	.	H	α-helix	trans	-62.4	-39.4	177.5	-170.9	7.3	0	0	0	111.7	T455 V456 Q462 K463	T455-H459 WeakPolarHBondContact O-CB 3.41Å; T455-H459 PolarHBondContact O-N 3.11Å; V456-H459 PolarHBondContact O-N 3.19Å; H459-Q462 PolarHBondContact O-N 2.86Å; H459-K463 WeakPolarHBondContact CE1-CE 3.45Å; H459-K463 WeakPolarHBondContact NE2-CE 3.31Å; H459-K463 WeakPolarHBondContact O-CG 3.36Å; H459-K463 PolarHBondContact O-N 2.72Å
460	L	93.5	Very high	92.8	Very high	81 Å²	81	106.6 Å²	106.6	42%	0.424	52%	0.519	S	S	.	.	H	α-helix	trans	-66	-38.9	178.4	-158	149.6	0	0	0	111.4	V456 N457 E458 K463 K464	V456-L460 WeakPolarHBondContact O-CB 3.36Å; V456-L460 PolarHBondContact O-N 3.18Å; N457-L460 PolarHBondContact O-N 3.16Å; E458-L460 VanDerWaalsContact C-N 3.3Å; E458-L460 PolarHBondContact O-N 3.23Å; L460-K463 PolarHBondContact O-N 3.45Å; L460-K464 HydrophobicContact CD2-CD 4.05Å; L460-K464 VanDerWaalsContact CD2-CE 3.41Å; L460-K464 HydrophobicContact CD2-CG 4.44Å; L460-K464 WeakPolarHBondContact O-CG 3.31Å; L460-K464 PolarHBondContact O-N 3.03Å
461	N	92.8	Very high	92.9	Very high	80 Å²	80	105.9 Å²	105.9	43%	0.428	52%	0.518	S	S	.	.	H	α-helix	trans	-68.4	-41.1	174.4	-71.4	-21.2	0	0	0	112.3	N457 E458 K463 K464 Y465	N457-N461 WeakPolarHBondContact O-CB 3.49Å; N457-N461 VanDerWaalsContact O-CG 3.3Å; N457-N461 PolarHBondContact O-N 3.3Å; N457-N461 PolarHBondContact O-ND2 3.25Å; E458-N461 PolarHBondContact O-N 3.4Å; N461-K463 VanDerWaalsContact C-N 3.33Å; N461-K463 PolarHBondContact O-N 2.86Å; N461-K464 WeakPolarHBondContact O-CB 3.47Å; N461-K464 PolarHBondContact O-N 3.17Å; N461-Y465 PolarHBondContact O-N 3.3Å
462	Q	93.8	Very high	93	Very high	130 Å²	130	103.4 Å²	103.4	61%	0.607	51%	0.514	S	S	*	.	H	α-helix	trans	-60.7	-42	173.2	-72.9	174.8	-1.8	0	0	111.8	E458 H459 Y465 A466	E458-Q462 WeakPolarHBondContact O-CG 3.21Å; E458-Q462 PolarHBondContact O-N 2.88Å; H459-Q462 PolarHBondContact O-N 2.86Å; Q462-Y465 PolarHBondContact O-N 3.38Å; Q462-A466 WeakPolarHBondContact O-CB 3.39Å; Q462-A466 PolarHBondContact O-N 3.46Å
463	K	93.7	Very high	93.1	Very high	125 Å²	125	103.5 Å²	103.5	54%	0.543	51%	0.508	S	S	.	.	H	α-helix	trans	-61.4	-44.4	173.9	-77.2	-175.9	-178	178.7	0	111.7	H459 L460 N461 Y465 A466 T467	H459-K463 WeakPolarHBondContact CE1-CE 3.45Å; H459-K463 WeakPolarHBondContact NE2-CE 3.31Å; H459-K463 WeakPolarHBondContact O-CG 3.36Å; H459-K463 PolarHBondContact O-N 2.72Å; L460-K463 PolarHBondContact O-N 3.45Å; N461-K463 VanDerWaalsContact C-N 3.33Å; N461-K463 PolarHBondContact O-N 2.86Å; K463-Y465 PolarHBondContact O-N 3.21Å; K463-A466 PolarHBondContact O-N 3.02Å; K463-T467 WeakPolarHBondContact O-CG2 3.46Å; K463-T467 PolarHBondContact O-N 2.97Å; K463-T467 PolarHBondContact O-OG1 2.99Å; K463-T467 VanDerWaalsContact O-OG1 3.11Å
464	K	93.3	Very high	93.1	Very high	111 Å²	111	98.8 Å²	98.8	48%	0.483	50%	0.496	S	S	.	.	H	α-helix	trans	-58.3	-47.6	176.3	-77.2	173.7	175.7	169.6	0	111.6	L460 N461 T467 Q468	L460-K464 HydrophobicContact CD2-CD 4.05Å; L460-K464 VanDerWaalsContact CD2-CE 3.41Å; L460-K464 HydrophobicContact CD2-CG 4.44Å; L460-K464 WeakPolarHBondContact O-CG 3.31Å; L460-K464 PolarHBondContact O-N 3.03Å; N461-K464 WeakPolarHBondContact O-CB 3.47Å; N461-K464 PolarHBondContact O-N 3.17Å; K464-T467 WeakPolarHBondContact CA-OG1 3.44Å; K464-T467 PolarHBondContact O-N 3.34Å; K464-T467 PolarHBondContact O-OG1 3.13Å; K464-Q468 WeakPolarHBondContact O-CG 3.3Å; K464-Q468 PolarHBondContact O-N 3.02Å
465	Y	93.9	Very high	93.2	Very high	164 Å²	164	101.2 Å²	101.2	64%	0.643	50%	0.501	S	S	*	.	H	α-helix	trans	-61.9	-46	178.3	-176.3	-100.4	0	0	0	112	N461 Q462 K463 T467 Q468 K469	N461-Y465 PolarHBondContact O-N 3.3Å; Q462-Y465 PolarHBondContact O-N 3.38Å; K463-Y465 PolarHBondContact O-N 3.21Å; Y465-T467 VanDerWaalsContact C-N 3.33Å; Y465-T467 PolarHBondContact O-N 2.65Å; Y465-Q468 PolarHBondContact O-N 3.36Å; Y465-K469 PolarHBondContact O-N 2.87Å
466	A	92.9	Very high	93.4	Very high	57 Å²	57	103.3 Å²	103.3	47%	0.471	51%	0.505	S	S	.	.	H	α-helix	trans	-60	-41.9	176.1	0	0	0	0	0	112.1	Q462 K463 K469 L470	Q462-A466 WeakPolarHBondContact O-CB 3.39Å; Q462-A466 PolarHBondContact O-N 3.46Å; K463-A466 PolarHBondContact O-N 3.02Å; A466-K469 PolarHBondContact O-N 2.96Å; A466-L470 WeakPolarHBondContact O-CB 3.08Å; A466-L470 PolarHBondContact O-N 2.9Å; A466-L470 VanDerWaalsContact O-N 3.1Å
467	T	91.4	Very high	93.5	Very high	79 Å²	79	104.5 Å²	104.5	49%	0.485	51%	0.507	S	S	.	.	H	α-helix	trans	-65.8	-37.9	176.2	51.8	0	0	0	0	112.8	K463 K464 Y465 L470 I471	K463-T467 WeakPolarHBondContact O-CG2 3.46Å; K463-T467 PolarHBondContact O-N 2.97Å; K463-T467 PolarHBondContact O-OG1 2.99Å; K463-T467 VanDerWaalsContact O-OG1 3.11Å; K464-T467 WeakPolarHBondContact CA-OG1 3.44Å; K464-T467 PolarHBondContact O-N 3.34Å; K464-T467 PolarHBondContact O-OG1 3.13Å; Y465-T467 VanDerWaalsContact C-N 3.33Å; Y465-T467 PolarHBondContact O-N 2.65Å; T467-L470 PolarHBondContact O-N 3.29Å; T467-I471 WeakPolarHBondContact O-CD1 3.41Å; T467-I471 WeakPolarHBondContact O-CG1 3.35Å; T467-I471 PolarHBondContact O-N 3.03Å
468	Q	93.6	Very high	93.5	Very high	118 Å²	118	105.1 Å²	105.1	55%	0.551	51%	0.509	S	S	*	.	H	α-helix	trans	-65.6	-45.6	177.6	-77.3	175.1	-20.9	0	0	111.5	K464 Y465 L470 I471 E472	K464-Q468 WeakPolarHBondContact O-CG 3.3Å; K464-Q468 PolarHBondContact O-N 3.02Å; Y465-Q468 PolarHBondContact O-N 3.36Å; Q468-L470 VanDerWaalsContact C-N 3.31Å; Q468-L470 PolarHBondContact O-N 3.22Å; Q468-I471 WeakPolarHBondContact O-CB 3.17Å; Q468-I471 PolarHBondContact O-N 3.26Å; Q468-I471 VanDerWaalsContact O-N 3.14Å; Q468-E472 PolarHBondContact O-N 3.42Å
469	K	93.9	Very high	93.5	Very high	112 Å²	112	105.7 Å²	105.7	49%	0.487	51%	0.512	S	S	.	.	H	α-helix	trans	-57.4	-45.4	175.9	-169.1	-179.2	179	-172.6	0	111.7	Y465 A466 I471 E472 E473	Y465-K469 PolarHBondContact O-N 2.87Å; A466-K469 PolarHBondContact O-N 2.96Å; K469-I471 VanDerWaalsContact C-N 3.32Å; K469-I471 PolarHBondContact O-N 3.27Å; K469-E472 PolarHBondContact O-N 3.1Å; K469-E473 WeakPolarHBondContact CE-OE1 3.42Å; K469-E473 WeakPolarHBondContact O-CG 3.29Å; K469-E473 PolarHBondContact O-N 3.43Å
470	L	93.8	Very high	93.5	Very high	98 Å²	98	105 Å²	105	51%	0.513	51%	0.511	S	S	.	.	H	α-helix	trans	-66.5	-32.7	178.9	-163.1	140.9	0	0	0	112.5	A466 T467 Q468 N474	A466-L470 WeakPolarHBondContact O-CB 3.08Å; A466-L470 PolarHBondContact O-N 2.9Å; A466-L470 VanDerWaalsContact O-N 3.1Å; T467-L470 PolarHBondContact O-N 3.29Å; Q468-L470 VanDerWaalsContact C-N 3.31Å; Q468-L470 PolarHBondContact O-N 3.22Å; L470-N474 VanDerWaalsContact CD2-ND2 3.3Å; L470-N474 WeakPolarHBondContact CD2-ND2 3.42Å; L470-N474 WeakPolarHBondContact O-CB 3.49Å; L470-N474 PolarHBondContact O-N 3.12Å; L470-N474 PolarHBondContact O-ND2 3.32Å
471	I	93.1	Very high	93.5	Very high	87 Å²	87	102.6 Å²	102.6	45%	0.446	51%	0.506	S	S	.	.	H	α-helix	trans	-67.5	-40.5	173.3	-71.7	163.3	0	0	0	111.1	T467 Q468 K469 N474 K475	T467-I471 WeakPolarHBondContact O-CD1 3.41Å; T467-I471 WeakPolarHBondContact O-CG1 3.35Å; T467-I471 PolarHBondContact O-N 3.03Å; Q468-I471 WeakPolarHBondContact O-CB 3.17Å; Q468-I471 PolarHBondContact O-N 3.26Å; Q468-I471 VanDerWaalsContact O-N 3.14Å; K469-I471 VanDerWaalsContact C-N 3.32Å; K469-I471 PolarHBondContact O-N 3.27Å; I471-N474 PolarHBondContact O-N 2.89Å; I471-K475 HydrophobicContact CG2-CD 4.27Å; I471-K475 VanDerWaalsContact O-CG 3.3Å; I471-K475 WeakPolarHBondContact O-CG 3.35Å; I471-K475 PolarHBondContact O-N 3.47Å
472	E	93.6	Very high	93.5	Very high	129 Å²	129	103.3 Å²	103.3	60%	0.603	51%	0.51	S	S	*	.	H	α-helix	trans	-66.4	-46.3	178.1	-72.3	179.7	173.2	0	0	111.9	Q468 K469 N474 K475 E476	Q468-E472 PolarHBondContact O-N 3.42Å; K469-E472 PolarHBondContact O-N 3.1Å; E472-N474 VanDerWaalsContact C-N 3.31Å; E472-N474 PolarHBondContact O-N 3.4Å; E472-K475 WeakPolarHBondContact O-CB 3.38Å; E472-K475 PolarHBondContact O-N 2.94Å; E472-K475 VanDerWaalsContact O-N 3.1Å; E472-E476 PolarHBondContact O-N 3.06Å
473	E	93.8	Very high	93.5	Very high	92 Å²	92	104.7 Å²	104.7	43%	0.43	51%	0.509	S	S	.	.	H	α-helix	trans	-57	-45.2	173.9	-70.9	170.9	-175.7	0	0	111	K469 K475 E476 I477	K469-E473 WeakPolarHBondContact CE-OE1 3.42Å; K469-E473 WeakPolarHBondContact O-CG 3.29Å; K469-E473 PolarHBondContact O-N 3.43Å; E473-K475 PolarHBondContact O-N 3.44Å; E473-E476 PolarHBondContact O-N 3.19Å; E473-I477 VanDerWaalsContact O-CG1 3.29Å; E473-I477 WeakPolarHBondContact O-CG1 3.25Å; E473-I477 PolarHBondContact O-N 2.78Å
474	N	91.8	Very high	93.4	Very high	73 Å²	73	104.4 Å²	104.4	39%	0.39	51%	0.51	S	S	.	.	H	α-helix	trans	-64.1	-37.8	176.3	-76	-30.3	0	0	0	113	L470 I471 E472 E476 I477 I478	L470-N474 VanDerWaalsContact CD2-ND2 3.3Å; L470-N474 WeakPolarHBondContact CD2-ND2 3.42Å; L470-N474 WeakPolarHBondContact O-CB 3.49Å; L470-N474 PolarHBondContact O-N 3.12Å; L470-N474 PolarHBondContact O-ND2 3.32Å; I471-N474 PolarHBondContact O-N 2.89Å; E472-N474 VanDerWaalsContact C-N 3.31Å; E472-N474 PolarHBondContact O-N 3.4Å; N474-E476 VanDerWaalsContact C-N 3.32Å; N474-I477 PolarHBondContact O-N 3.49Å; N474-I478 WeakPolarHBondContact O-CB 3.35Å; N474-I478 WeakPolarHBondContact O-CD1 3.36Å; N474-I478 WeakPolarHBondContact O-CG1 3.46Å; N474-I478 PolarHBondContact O-N 2.97Å
475	K	95.8	Very high	93.3	Very high	127 Å²	127	103.6 Å²	103.6	55%	0.552	51%	0.514	S	S	*	.	H	α-helix	trans	-62.6	-41.6	175.8	-77.7	170.9	-178.9	174.4	0	111.1	I471 E472 E473 I478 Q479	I471-K475 HydrophobicContact CG2-CD 4.27Å; I471-K475 VanDerWaalsContact O-CG 3.3Å; I471-K475 WeakPolarHBondContact O-CG 3.35Å; I471-K475 PolarHBondContact O-N 3.47Å; E472-K475 WeakPolarHBondContact O-CB 3.38Å; E472-K475 PolarHBondContact O-N 2.94Å; E472-K475 VanDerWaalsContact O-N 3.1Å; E473-K475 PolarHBondContact O-N 3.44Å; K475-I478 PolarHBondContact O-N 3.36Å; K475-Q479 WeakPolarHBondContact O-CG 3.45Å; K475-Q479 PolarHBondContact O-N 3.32Å
476	E	95.5	Very high	93.1	Very high	122 Å²	122	103.8 Å²	103.8	57%	0.57	51%	0.514	S	S	*	.	H	α-helix	trans	-66.1	-44.4	178.5	-165.9	176.8	-178.5	0	0	111.4	E472 E473 N474 I478 Q479 N480	E472-E476 PolarHBondContact O-N 3.06Å; E473-E476 PolarHBondContact O-N 3.19Å; N474-E476 VanDerWaalsContact C-N 3.32Å; E476-I478 VanDerWaalsContact C-N 3.32Å; E476-I478 PolarHBondContact O-N 3.42Å; E476-Q479 PolarHBondContact O-N 2.95Å; E476-N480 WeakPolarHBondContact O-CB 3.48Å; E476-N480 PolarHBondContact O-N 3.38Å; E476-N480 PolarHBondContact O-ND2 3.28Å
477	I	94.1	Very high	93.1	Very high	109 Å²	109	106.5 Å²	106.5	56%	0.559	52%	0.517	S	S	*	.	H	α-helix	trans	-58.4	-44.6	174.4	-66.8	164.8	0	0	0	110.9	E473 N474 N480 G481	E473-I477 VanDerWaalsContact O-CG1 3.29Å; E473-I477 WeakPolarHBondContact O-CG1 3.25Å; E473-I477 PolarHBondContact O-N 2.78Å; N474-I477 PolarHBondContact O-N 3.49Å; I477-N480 PolarHBondContact O-N 2.94Å; I477-G481 PolarHBondContact O-N 3.13Å
478	I	92.9	Very high	93.1	Very high	106 Å²	106	107.2 Å²	107.2	54%	0.544	52%	0.518	S	S	.	.	H	α-helix	trans	-63.3	-44.6	177.9	-69.1	164	0	0	0	110.9	N474 K475 E476 N480 G481 L482	N474-I478 WeakPolarHBondContact O-CB 3.35Å; N474-I478 WeakPolarHBondContact O-CD1 3.36Å; N474-I478 WeakPolarHBondContact O-CG1 3.46Å; N474-I478 PolarHBondContact O-N 2.97Å; K475-I478 PolarHBondContact O-N 3.36Å; E476-I478 VanDerWaalsContact C-N 3.32Å; E476-I478 PolarHBondContact O-N 3.42Å; I478-N480 PolarHBondContact O-N 3.47Å; I478-G481 PolarHBondContact O-N 2.84Å; I478-L482 HydrophobicContact CG2-CD1 4.04Å; I478-L482 HydrophobicContact CG2-CG 4.43Å; I478-L482 WeakPolarHBondContact O-CB 3.37Å; I478-L482 VanDerWaalsContact O-CG 3.29Å; I478-L482 WeakPolarHBondContact O-CG 3.4Å; I478-L482 PolarHBondContact O-N 2.83Å
479	Q	93.3	Very high	93.1	Very high	120 Å²	120	109 Å²	109	56%	0.561	52%	0.519	S	S	*	.	H	α-helix	trans	-63.1	-42.2	178.2	-77.7	-172	-3.6	0	0	112.3	K475 E476 L482 R483	K475-Q479 WeakPolarHBondContact O-CG 3.45Å; K475-Q479 PolarHBondContact O-N 3.32Å; E476-Q479 PolarHBondContact O-N 2.95Å; Q479-L482 PolarHBondContact O-N 3.41Å; Q479-R483 WeakPolarHBondContact O-CB 3.48Å; Q479-R483 PolarHBondContact O-N 3.23Å
480	N	94	Very high	93.1	Very high	84 Å²	84	109.6 Å²	109.6	45%	0.449	52%	0.522	S	S	.	.	H	α-helix	trans	-65	-44	177.1	-71.7	-21.6	0	0	0	111.3	E476 I477 I478 L482 R483 Q484	E476-N480 WeakPolarHBondContact O-CB 3.48Å; E476-N480 PolarHBondContact O-N 3.38Å; E476-N480 PolarHBondContact O-ND2 3.28Å; I477-N480 PolarHBondContact O-N 2.94Å; I478-N480 PolarHBondContact O-N 3.47Å; N480-L482 PolarHBondContact O-N 3.37Å; N480-R483 PolarHBondContact O-N 2.98Å; N480-Q484 PolarHBondContact O-N 2.96Å
481	G	92.9	Very high	93.2	Very high	31 Å²	31	108.8 Å²	108.8	32%	0.32	52%	0.518	S	S	.	.	H	α-helix	trans	-59.6	-44.1	174.1	0	0	0	0	0	112.6	I477 I478 R483 Q484 V485	I477-G481 PolarHBondContact O-N 3.13Å; I478-G481 PolarHBondContact O-N 2.84Å; G481-R483 PolarHBondContact O-N 2.9Å; G481-Q484 PolarHBondContact O-N 3.14Å; G481-V485 VanDerWaalsContact O-CG2 3.32Å; G481-V485 WeakPolarHBondContact O-CG2 3.48Å; G481-V485 PolarHBondContact O-N 2.88Å
482	L	92.3	Very high	93.3	Very high	96 Å²	96	112.2 Å²	112.2	50%	0.503	53%	0.527	S	S	.	.	H	α-helix	trans	-60.9	-46.3	175.2	-73.7	171.3	0	0	0	111.2	I478 Q479 N480 Q484 V485 W486	I478-L482 HydrophobicContact CG2-CD1 4.04Å; I478-L482 HydrophobicContact CG2-CG 4.43Å; I478-L482 WeakPolarHBondContact O-CB 3.37Å; I478-L482 VanDerWaalsContact O-CG 3.29Å; I478-L482 WeakPolarHBondContact O-CG 3.4Å; I478-L482 PolarHBondContact O-N 2.83Å; Q479-L482 PolarHBondContact O-N 3.41Å; N480-L482 PolarHBondContact O-N 3.37Å; L482-Q484 VanDerWaalsContact C-N 3.3Å; L482-Q484 PolarHBondContact O-N 2.84Å; L482-V485 PolarHBondContact O-N 3.38Å; L482-W486 PolarHBondContact O-N 3.49Å
483	R	92.9	Very high	93.3	Very high	158 Å²	158	110 Å²	110	60%	0.596	52%	0.519	S	S	*	.	H	α-helix	trans	-59.8	-41.5	179.6	-159.8	-177.4	-63.5	-146.2	3.7	111.5	Q479 N480 G481 W486 Q487	Q479-R483 WeakPolarHBondContact O-CB 3.48Å; Q479-R483 PolarHBondContact O-N 3.23Å; N480-R483 PolarHBondContact O-N 2.98Å; G481-R483 PolarHBondContact O-N 2.9Å; R483-W486 PolarHBondContact O-N 3.37Å; R483-Q487 WeakPolarHBondContact O-CG 3.39Å; R483-Q487 PolarHBondContact O-N 3.34Å
484	Q	92.7	Very high	93.2	Very high	120 Å²	120	110.1 Å²	110.1	56%	0.561	52%	0.519	S	S	*	.	H	α-helix	trans	-65.9	-41.7	176.7	-163.2	179.8	13	0	0	112.2	N480 G481 L482 W486 Q487 N488	N480-Q484 PolarHBondContact O-N 2.96Å; G481-Q484 PolarHBondContact O-N 3.14Å; L482-Q484 VanDerWaalsContact C-N 3.3Å; L482-Q484 PolarHBondContact O-N 2.84Å; Q484-W486 VanDerWaalsContact C-N 3.32Å; Q484-W486 PolarHBondContact O-N 3.43Å; Q484-Q487 PolarHBondContact O-N 3.39Å; Q484-N488 WeakPolarHBondContact O-CB 3.24Å; Q484-N488 VanDerWaalsContact O-CG 3.25Å; Q484-N488 PolarHBondContact O-N 3.35Å; Q484-N488 PolarHBondContact O-ND2 2.93Å
485	V	90.6	Very high	93.4	Very high	94 Å²	94	112.6 Å²	112.6	57%	0.57	53%	0.527	S	S	*	.	H	α-helix	trans	-61.8	-41	174.6	171.5	0	0	0	0	111.2	G481 L482 N488 R489	G481-V485 VanDerWaalsContact O-CG2 3.32Å; G481-V485 WeakPolarHBondContact O-CG2 3.48Å; G481-V485 PolarHBondContact O-N 2.88Å; L482-V485 PolarHBondContact O-N 3.38Å; V485-N488 PolarHBondContact O-N 2.95Å; V485-R489 WeakPolarHBondContact O-CB 3.36Å; V485-R489 PolarHBondContact O-N 3.46Å
486	W	89.8	Confident	93.2	Very high	168 Å²	168	108.5 Å²	108.5	64%	0.636	52%	0.517	S	S	*	.	H	α-helix	trans	-63.5	-44.1	176	-80.2	109.2	0	0	0	112.4	L482 R483 Q484 R489 F490	L482-W486 PolarHBondContact O-N 3.49Å; R483-W486 PolarHBondContact O-N 3.37Å; Q484-W486 VanDerWaalsContact C-N 3.32Å; Q484-W486 PolarHBondContact O-N 3.43Å; W486-R489 PolarHBondContact O-N 2.91Å; W486-F490 WeakPolarHBondContact O-CB 3.45Å; W486-F490 PolarHBondContact O-N 2.88Å
487	Q	92.3	Very high	93.1	Very high	114 Å²	114	111.6 Å²	111.6	53%	0.533	52%	0.523	S	S	.	.	H	α-helix	trans	-62.3	-45.6	175.5	-74.9	176	-18.8	0	0	112	R483 Q484 R489 F490 N491	R483-Q487 WeakPolarHBondContact O-CG 3.39Å; R483-Q487 PolarHBondContact O-N 3.34Å; Q484-Q487 PolarHBondContact O-N 3.39Å; Q487-R489 VanDerWaalsContact C-N 3.3Å; Q487-R489 PolarHBondContact O-N 3.35Å; Q487-F490 PolarHBondContact O-N 3.27Å; Q487-N491 WeakPolarHBondContact O-CB 3.48Å; Q487-N491 VanDerWaalsContact O-CG 3.31Å; Q487-N491 PolarHBondContact O-N 3Å
488	N	92.4	Very high	93.1	Very high	94 Å²	94	111.7 Å²	111.7	50%	0.503	52%	0.521	S	S	.	.	H	α-helix	trans	-60.9	-41.5	177.1	-72.5	-22.1	0	0	0	111.8	Q484 V485 Y492	Q484-N488 WeakPolarHBondContact O-CB 3.24Å; Q484-N488 VanDerWaalsContact O-CG 3.25Å; Q484-N488 PolarHBondContact O-N 3.35Å; Q484-N488 PolarHBondContact O-ND2 2.93Å; V485-N488 PolarHBondContact O-N 2.95Å; N488-Y492 WeakPolarHBondContact O-CB 3.31Å; N488-Y492 PolarHBondContact O-N 2.97Å
489	R	93.4	Very high	93.1	Very high	154 Å²	154	115 Å²	115	58%	0.581	53%	0.527	S	S	*	.	H	α-helix	trans	-65.7	-40.9	176.5	-173.5	174.4	-177.8	174.2	0.5	111.7	V485 W486 Q487 Y492 L493	V485-R489 WeakPolarHBondContact O-CB 3.36Å; V485-R489 PolarHBondContact O-N 3.46Å; W486-R489 PolarHBondContact O-N 2.91Å; Q487-R489 VanDerWaalsContact C-N 3.3Å; Q487-R489 PolarHBondContact O-N 3.35Å; R489-Y492 PolarHBondContact O-N 3.11Å; R489-L493 HydrophobicContact CG-CD1 4.38Å; R489-L493 VanDerWaalsContact O-CG 3.29Å; R489-L493 WeakPolarHBondContact O-CG 3.11Å; R489-L493 PolarHBondContact O-N 3.48Å
490	F	95.1	Very high	93.1	Very high	125 Å²	125	118 Å²	118	55%	0.548	53%	0.533	S	S	.	.	H	α-helix	trans	-62.5	-51.5	176.7	-174.6	-91.2	0	0	0	111.2	W486 Q487 Y492 L493 E494	W486-F490 WeakPolarHBondContact O-CB 3.45Å; W486-F490 PolarHBondContact O-N 2.88Å; Q487-F490 PolarHBondContact O-N 3.27Å; F490-Y492 VanDerWaalsContact C-N 3.25Å; F490-Y492 PolarHBondContact O-N 2.99Å; F490-L493 WeakPolarHBondContact O-CB 3.12Å; F490-L493 PolarHBondContact O-N 3.34Å; F490-E494 PolarHBondContact O-N 2.9Å
491	N	96.1	Very high	93.1	Very high	81 Å²	81	116.8 Å²	116.8	43%	0.433	54%	0.535	S	S	.	.	H	α-helix	trans	-58.6	-37.5	177.5	-69.7	-7.9	0	0	0	112.1	Q487 K495	Q487-N491 WeakPolarHBondContact O-CB 3.48Å; Q487-N491 VanDerWaalsContact O-CG 3.31Å; Q487-N491 PolarHBondContact O-N 3Å; N491-K495 WeakPolarHBondContact O-CG 3.31Å; N491-K495 PolarHBondContact O-N 3.42Å; N491-K495 VanDerWaalsContact O-N 3.08Å
492	Y	94	Very high	93.3	Very high	159 Å²	159	121 Å²	121	62%	0.624	55%	0.549	S	S	*	.	H	α-helix	trans	-64.6	-45.4	174.5	175.3	-93.3	0	0	0	112.2	N488 R489 F490 E494 K495 A496	N488-Y492 WeakPolarHBondContact O-CB 3.31Å; N488-Y492 PolarHBondContact O-N 2.97Å; R489-Y492 PolarHBondContact O-N 3.11Å; F490-Y492 VanDerWaalsContact C-N 3.25Å; F490-Y492 PolarHBondContact O-N 2.99Å; Y492-E494 VanDerWaalsContact C-N 3.29Å; Y492-E494 PolarHBondContact O-N 2.94Å; Y492-K495 PolarHBondContact O-N 2.9Å; Y492-A496 WeakPolarHBondContact O-CB 3.32Å; Y492-A496 PolarHBondContact O-N 3.33Å
493	L	93.1	Very high	93.4	Very high	82 Å²	82	122.3 Å²	122.3	43%	0.429	55%	0.551	S	S	.	*	H	α-helix	trans	-64.1	-36.8	179	-72.5	172.9	0	0	0	111.7	R489 F490 A496 R497	R489-L493 HydrophobicContact CG-CD1 4.38Å; R489-L493 VanDerWaalsContact O-CG 3.29Å; R489-L493 WeakPolarHBondContact O-CG 3.11Å; R489-L493 PolarHBondContact O-N 3.48Å; F490-L493 WeakPolarHBondContact O-CB 3.12Å; F490-L493 PolarHBondContact O-N 3.34Å; L493-A496 PolarHBondContact O-N 3.21Å; L493-R497 WeakPolarHBondContact O-CG 3.31Å; L493-R497 PolarHBondContact O-N 3.25Å
494	E	93.5	Very high	93.5	Very high	95 Å²	95	119.2 Å²	119.2	44%	0.444	55%	0.546	S	S	.	.	H	α-helix	trans	-64.8	-51.1	176.1	-168	161.6	-141.6	0	0	111.5	F490 Y492 A496 R497 E498	F490-E494 PolarHBondContact O-N 2.9Å; Y492-E494 VanDerWaalsContact C-N 3.29Å; Y492-E494 PolarHBondContact O-N 2.94Å; E494-A496 PolarHBondContact O-N 3.43Å; E494-R497 WeakPolarHBondContact O-CA 3.44Å; E494-R497 WeakPolarHBondContact O-CB 3.4Å; E494-R497 PolarHBondContact O-N 3.34Å; E494-E498 PolarHBondContact O-N 2.83Å
495	K	94.6	Very high	93.6	Very high	125 Å²	125	120.5 Å²	120.5	54%	0.543	55%	0.55	S	S	.	.	H	α-helix	trans	-56.8	-36.2	173	-72.5	179.8	-179.8	-177.8	0	112.7	N491 Y492 R499	N491-K495 WeakPolarHBondContact O-CG 3.31Å; N491-K495 PolarHBondContact O-N 3.42Å; N491-K495 VanDerWaalsContact O-N 3.08Å; Y492-K495 PolarHBondContact O-N 2.9Å; K495-R499 VanDerWaalsContact O-CG 3.26Å; K495-R499 WeakPolarHBondContact O-CG 3.49Å; K495-R499 PolarHBondContact O-N 3.47Å; K495-R499 VanDerWaalsContact O-N 3.08Å
496	A	91.1	Very high	93.8	Very high	42 Å²	42	120.5 Å²	120.5	35%	0.347	54%	0.543	S	S	.	.	H	α-helix	trans	-68.2	-37.4	176.2	0	0	0	0	0	112.3	Y492 L493 E494 R500	Y492-A496 WeakPolarHBondContact O-CB 3.32Å; Y492-A496 PolarHBondContact O-N 3.33Å; L493-A496 PolarHBondContact O-N 3.21Å; E494-A496 PolarHBondContact O-N 3.43Å; A496-R500 PolarHBondContact O-N 2.76Å; A496-R500 VanDerWaalsContact O-N 3.12Å
497	R	93.9	Very high	94	Very high	187 Å²	187	119 Å²	119	71%	0.706	54%	0.541	S	S	*	.	H	α-helix	trans	-66.5	-44	174.3	-74.1	176.4	-177.1	176.7	1.3	111.5	L493 E494 R499 R500 A501	L493-R497 WeakPolarHBondContact O-CG 3.31Å; L493-R497 PolarHBondContact O-N 3.25Å; E494-R497 WeakPolarHBondContact O-CA 3.44Å; E494-R497 WeakPolarHBondContact O-CB 3.4Å; E494-R497 PolarHBondContact O-N 3.34Å; R497-R499 PolarHBondContact O-N 3.3Å; R497-R500 WeakPolarHBondContact O-CB 3.49Å; R497-R500 PolarHBondContact O-N 2.94Å; R497-A501 PolarHBondContact O-N 3.39Å
498	E	95	Very high	94	Very high	111 Å²	111	117 Å²	117	52%	0.519	54%	0.54	S	S	.	.	H	α-helix	trans	-58.9	-48.3	176.6	-70	174.5	167.7	0	0	111.8	E494 R500 A501 L502	E494-E498 PolarHBondContact O-N 2.83Å; E498-R500 VanDerWaalsContact C-N 3.27Å; E498-R500 PolarHBondContact O-N 3.15Å; E498-A501 WeakPolarHBondContact O-CB 3.27Å; E498-A501 PolarHBondContact O-N 2.96Å; E498-A501 VanDerWaalsContact O-N 3.1Å; E498-L502 WeakPolarHBondContact O-CG 3.29Å; E498-L502 PolarHBondContact O-N 3.01Å
499	R	93	Very high	94.2	Very high	176 Å²	176	117.9 Å²	117.9	66%	0.664	54%	0.541	S	S	*	.	H	α-helix	trans	-58.3	-40.4	175.9	-72.8	172	-176.3	179.5	0.1	112.1	K495 R497 F503	K495-R499 VanDerWaalsContact O-CG 3.26Å; K495-R499 WeakPolarHBondContact O-CG 3.49Å; K495-R499 PolarHBondContact O-N 3.47Å; K495-R499 VanDerWaalsContact O-N 3.08Å; R497-R499 PolarHBondContact O-N 3.3Å; R499-F503 WeakPolarHBondContact O-CB 3.38Å; R499-F503 PolarHBondContact O-N 3.12Å
500	R	92.3	Very high	94.2	Very high	182 Å²	182	115.1 Å²	115.1	69%	0.687	53%	0.534	S	S	*	.	H	α-helix	trans	-65.5	-41.3	176.4	-176.4	177.8	176.6	-179.3	-1.8	111.6	A496 R497 E498 F503 L504	A496-R500 PolarHBondContact O-N 2.76Å; A496-R500 VanDerWaalsContact O-N 3.12Å; R497-R500 WeakPolarHBondContact O-CB 3.49Å; R497-R500 PolarHBondContact O-N 2.94Å; E498-R500 VanDerWaalsContact C-N 3.27Å; E498-R500 PolarHBondContact O-N 3.15Å; R500-F503 PolarHBondContact O-N 3.26Å; R500-L504 HydrophobicContact CG-CD1 4.29Å; R500-L504 VanDerWaalsContact O-CG 3.3Å; R500-L504 WeakPolarHBondContact O-CG 3.43Å; R500-L504 PolarHBondContact O-N 3.25Å
501	A	95.1	Very high	94.1	Very high	59 Å²	59	111.9 Å²	111.9	49%	0.488	53%	0.53	S	S	.	.	H	α-helix	trans	-64	-45.4	177.4	0	0	0	0	0	111.6	R497 E498 F503 L504 K505	R497-A501 PolarHBondContact O-N 3.39Å; E498-A501 WeakPolarHBondContact O-CB 3.27Å; E498-A501 PolarHBondContact O-N 2.96Å; E498-A501 VanDerWaalsContact O-N 3.1Å; A501-F503 PolarHBondContact O-N 3.15Å; A501-L504 PolarHBondContact O-N 2.95Å; A501-K505 PolarHBondContact O-N 2.88Å
502	L	96	Very high	94.1	Very high	118 Å²	118	111 Å²	111	62%	0.618	53%	0.534	S	S	*	.	H	α-helix	trans	-59.5	-46.6	175.1	-71.9	171.5	0	0	0	111.7	E498 L504 K505 E506	E498-L502 WeakPolarHBondContact O-CG 3.29Å; E498-L502 PolarHBondContact O-N 3.01Å; L502-L504 VanDerWaalsContact C-N 3.33Å; L502-L504 PolarHBondContact O-N 3.2Å; L502-K505 PolarHBondContact O-N 3.36Å; L502-E506 PolarHBondContact O-N 3.14Å
503	F	95.6	Very high	94.1	Very high	125 Å²	125	108 Å²	108	55%	0.548	53%	0.526	S	S	.	.	H	α-helix	trans	-60.3	-41.3	177.2	175.4	-98.8	0	0	0	112.6	R499 R500 A501 E506 K507	R499-F503 WeakPolarHBondContact O-CB 3.38Å; R499-F503 PolarHBondContact O-N 3.12Å; R500-F503 PolarHBondContact O-N 3.26Å; A501-F503 PolarHBondContact O-N 3.15Å; F503-E506 PolarHBondContact O-N 3.03Å; F503-K507 HydrophobicContact CE1-CD 4.47Å; F503-K507 WeakPolarHBondContact O-CB 3.42Å; F503-K507 PolarHBondContact O-N 3.45Å
504	L	94.1	Very high	94.2	Very high	93 Å²	93	113 Å²	113	49%	0.487	54%	0.539	S	S	.	.	H	α-helix	trans	-65.6	-40.5	177.2	-72.8	172.6	0	0	0	111.6	R500 A501 L502 K507 S508	R500-L504 HydrophobicContact CG-CD1 4.29Å; R500-L504 VanDerWaalsContact O-CG 3.3Å; R500-L504 WeakPolarHBondContact O-CG 3.43Å; R500-L504 PolarHBondContact O-N 3.25Å; A501-L504 PolarHBondContact O-N 2.95Å; L502-L504 VanDerWaalsContact C-N 3.33Å; L502-L504 PolarHBondContact O-N 3.2Å; L504-K507 PolarHBondContact O-N 3Å; L504-S508 PolarHBondContact O-N 3.4Å; L504-S508 PolarHBondContact O-OG 3.13Å
505	K	94.9	Very high	94.3	Very high	147 Å²	147	113.4 Å²	113.4	64%	0.639	54%	0.543	S	S	*	.	H	α-helix	trans	-62.1	-48.5	175.6	-167.3	179	-178.5	-177.9	0	111.1	A501 L502 K507 S508 Q509	A501-K505 PolarHBondContact O-N 2.88Å; L502-K505 PolarHBondContact O-N 3.36Å; K505-K507 VanDerWaalsContact C-N 3.31Å; K505-K507 PolarHBondContact O-N 3.16Å; K505-S508 PolarHBondContact O-N 3.35Å; K505-S508 PolarHBondContact O-OG 2.99Å; K505-Q509 PolarHBondContact O-N 2.95Å
506	E	95.6	Very high	94.3	Very high	93 Å²	93	112.2 Å²	112.2	44%	0.435	54%	0.542	S	S	.	.	H	α-helix	trans	-60.4	-40.9	176.7	-167.4	-168.5	158.8	0	0	111.9	L502 F503 S508 Q509 K510	L502-E506 PolarHBondContact O-N 3.14Å; F503-E506 PolarHBondContact O-N 3.03Å; E506-S508 PolarHBondContact O-N 2.88Å; E506-Q509 PolarHBondContact O-N 3.25Å; E506-K510 HydrophobicContact CG-CD 4.36Å; E506-K510 WeakPolarHBondContact O-CB 3.21Å; E506-K510 WeakPolarHBondContact O-CG 3.46Å; E506-K510 PolarHBondContact O-N 3.03Å; E506-K510 VanDerWaalsContact OE1-CE 3.32Å; E506-K510 WeakPolarHBondContact OE1-CE 3.21Å; E506-K510 IonicContact OE1-NZ 3.9Å; E506-K510 PolarHBondContact OE1-NZ 3.48Å
507	K	94.1	Very high	94.5	Very high	137 Å²	137	114 Å²	114	60%	0.596	55%	0.549	S	S	*	.	H	α-helix	trans	-62.8	-42.1	176	-173.6	179.7	178.6	-175.4	0	112	F503 L504 K505 A511	F503-K507 HydrophobicContact CE1-CD 4.47Å; F503-K507 WeakPolarHBondContact O-CB 3.42Å; F503-K507 PolarHBondContact O-N 3.45Å; L504-K507 PolarHBondContact O-N 3Å; K505-K507 VanDerWaalsContact C-N 3.31Å; K505-K507 PolarHBondContact O-N 3.16Å; K507-A511 WeakPolarHBondContact O-CB 3.38Å; K507-A511 PolarHBondContact O-N 3.38Å
508	S	92.1	Very high	94.5	Very high	73 Å²	73	110.7 Å²	110.7	51%	0.51	54%	0.541	S	S	.	.	H	α-helix	trans	-65.2	-40.1	176	64.9	0	0	0	0	112.2	L504 K505 E506 A511 A512	L504-S508 PolarHBondContact O-N 3.4Å; L504-S508 PolarHBondContact O-OG 3.13Å; K505-S508 PolarHBondContact O-N 3.35Å; K505-S508 PolarHBondContact O-OG 2.99Å; E506-S508 PolarHBondContact O-N 2.88Å; S508-A511 WeakPolarHBondContact O-CB 3.03Å; S508-A511 PolarHBondContact O-N 2.97Å; S508-A512 PolarHBondContact O-N 3.36Å
509	Q	95	Very high	94.5	Very high	112 Å²	112	109.1 Å²	109.1	52%	0.523	54%	0.536	S	S	.	.	H	α-helix	trans	-63.7	-48.7	176.9	-176.1	179.3	-14.3	0	0	111.4	K505 E506 A511 A512 E513	K505-Q509 PolarHBondContact O-N 2.95Å; E506-Q509 PolarHBondContact O-N 3.25Å; Q509-A511 PolarHBondContact O-N 2.65Å; Q509-A512 WeakPolarHBondContact O-CB 3.2Å; Q509-A512 PolarHBondContact O-N 2.75Å; Q509-A512 VanDerWaalsContact O-N 3.08Å; Q509-E513 PolarHBondContact NE2-OE1 2.88Å; Q509-E513 VanDerWaalsContact NE2-OE1 3.13Å; Q509-E513 WeakPolarHBondContact O-CG 3.48Å; Q509-E513 PolarHBondContact O-N 3.07Å
510	K	93.4	Very high	94.7	Very high	96 Å²	96	105.2 Å²	105.2	42%	0.417	53%	0.528	S	S	.	.	H	α-helix	trans	-60.4	-33.5	176.1	-75.6	175.9	171.2	170.9	0	112.8	E506 R514	E506-K510 HydrophobicContact CG-CD 4.36Å; E506-K510 WeakPolarHBondContact O-CB 3.21Å; E506-K510 WeakPolarHBondContact O-CG 3.46Å; E506-K510 PolarHBondContact O-N 3.03Å; E506-K510 VanDerWaalsContact OE1-CE 3.32Å; E506-K510 WeakPolarHBondContact OE1-CE 3.21Å; E506-K510 IonicContact OE1-NZ 3.9Å; E506-K510 PolarHBondContact OE1-NZ 3.48Å; K510-R514 VanDerWaalsContact O-CG 3.24Å; K510-R514 WeakPolarHBondContact O-CG 3.3Å; K510-R514 PolarHBondContact O-N 3.18Å; K510-R514 VanDerWaalsContact O-N 3.08Å
511	A	93.8	Very high	94.8	Very high	56 Å²	56	100.6 Å²	100.6	46%	0.463	52%	0.517	S	S	.	.	H	α-helix	trans	-67.8	-42.8	174.6	0	0	0	0	0	111.6	K507 S508 Q509 R514 L515	K507-A511 WeakPolarHBondContact O-CB 3.38Å; K507-A511 PolarHBondContact O-N 3.38Å; S508-A511 WeakPolarHBondContact O-CB 3.03Å; S508-A511 PolarHBondContact O-N 2.97Å; Q509-A511 PolarHBondContact O-N 2.65Å; A511-R514 PolarHBondContact O-N 3.08Å; A511-L515 PolarHBondContact O-N 2.89Å; A511-L515 VanDerWaalsContact O-N 3.08Å
512	A	94.9	Very high	94.7	Very high	63 Å²	63	101.6 Å²	101.6	52%	0.521	51%	0.514	S	S	.	.	H	α-helix	trans	-63.2	-43.2	175.2	0	0	0	0	0	112.1	S508 Q509 R514 L515 L516	S508-A512 PolarHBondContact O-N 3.36Å; Q509-A512 WeakPolarHBondContact O-CB 3.2Å; Q509-A512 PolarHBondContact O-N 2.75Å; Q509-A512 VanDerWaalsContact O-N 3.08Å; A512-R514 PolarHBondContact O-N 3.33Å; A512-L515 PolarHBondContact O-N 3.41Å; A512-L516 PolarHBondContact O-N 3.32Å
513	E	95.3	Very high	94.7	Very high	97 Å²	97	101.9 Å²	101.9	45%	0.453	51%	0.513	S	S	.	.	H	α-helix	trans	-61	-44.2	176.1	-73.2	169.8	-171.8	0	0	112	Q509 L515 L516 V517	Q509-E513 PolarHBondContact NE2-OE1 2.88Å; Q509-E513 VanDerWaalsContact NE2-OE1 3.13Å; Q509-E513 WeakPolarHBondContact O-CG 3.48Å; Q509-E513 PolarHBondContact O-N 3.07Å; E513-L515 VanDerWaalsContact C-N 3.32Å; E513-L515 PolarHBondContact O-N 3.4Å; E513-L516 PolarHBondContact O-N 2.92Å; E513-V517 WeakPolarHBondContact O-CG2 3.45Å; E513-V517 PolarHBondContact O-N 2.98Å
514	R	94.1	Very high	94.6	Very high	187 Å²	187	104.5 Å²	104.5	71%	0.706	52%	0.519	S	S	*	.	H	α-helix	trans	-61.6	-41.2	176	-74.5	172	-172.6	-175.4	0.3	112.2	K510 A511 A512 L516 V517 Q518	K510-R514 VanDerWaalsContact O-CG 3.24Å; K510-R514 WeakPolarHBondContact O-CG 3.3Å; K510-R514 PolarHBondContact O-N 3.18Å; K510-R514 VanDerWaalsContact O-N 3.08Å; A511-R514 PolarHBondContact O-N 3.08Å; A512-R514 PolarHBondContact O-N 3.33Å; R514-L516 VanDerWaalsContact C-N 3.33Å; R514-V517 PolarHBondContact O-N 3.49Å; R514-Q518 WeakPolarHBondContact O-CB 3.43Å; R514-Q518 PolarHBondContact O-N 3.44Å
515	L	95.6	Very high	94.5	Very high	103 Å²	103	103.3 Å²	103.3	54%	0.539	52%	0.515	S	S	.	.	H	α-helix	trans	-65.1	-40.2	178	-169.7	141.6	0	0	0	111	A511 A512 E513 Q518 N519	A511-L515 PolarHBondContact O-N 2.89Å; A511-L515 VanDerWaalsContact O-N 3.08Å; A512-L515 PolarHBondContact O-N 3.41Å; E513-L515 VanDerWaalsContact C-N 3.32Å; E513-L515 PolarHBondContact O-N 3.4Å; L515-Q518 PolarHBondContact O-N 3.33Å; L515-N519 VanDerWaalsContact O-CG 3.3Å; L515-N519 PolarHBondContact O-N 3.48Å
516	L	95.8	Very high	94.5	Very high	100 Å²	100	101.6 Å²	101.6	52%	0.524	51%	0.513	S	S	.	.	H	α-helix	trans	-62.2	-47.5	173.9	-171	156.1	0	0	0	111.6	A512 E513 R514 Q518 N519 L520	A512-L516 PolarHBondContact O-N 3.32Å; E513-L516 PolarHBondContact O-N 2.92Å; R514-L516 VanDerWaalsContact C-N 3.33Å; L516-Q518 VanDerWaalsContact C-N 3.29Å; L516-Q518 PolarHBondContact O-N 3.19Å; L516-N519 PolarHBondContact O-N 2.73Å; L516-L520 HydrophobicContact CD2-CD1 3.48Å; L516-L520 VanDerWaalsContact CD2-CD1 3.48Å; L516-L520 HydrophobicContact CD2-CG 4Å; L516-L520 WeakPolarHBondContact O-CG 3.47Å; L516-L520 PolarHBondContact O-N 3Å
517	V	95.1	Very high	94.4	Very high	79 Å²	79	102.6 Å²	102.6	48%	0.479	52%	0.52	S	S	.	.	H	α-helix	trans	-60.4	-40.4	176.9	170.7	0	0	0	0	111.4	E513 R514 L520 N521	E513-V517 WeakPolarHBondContact O-CG2 3.45Å; E513-V517 PolarHBondContact O-N 2.98Å; R514-V517 PolarHBondContact O-N 3.49Å; V517-L520 PolarHBondContact O-N 3.43Å; V517-N521 WeakPolarHBondContact O-CB 3.49Å; V517-N521 VanDerWaalsContact O-CG 3.31Å; V517-N521 PolarHBondContact O-N 3.24Å; V517-N521 PolarHBondContact O-ND2 3.38Å
518	Q	93.6	Very high	94.4	Very high	117 Å²	117	98.5 Å²	98.5	55%	0.547	51%	0.507	S	S	.	.	H	α-helix	trans	-62.9	-43.5	176.6	-172.4	175.7	2.3	0	0	111.6	R514 L515 L516 N521 N522	R514-Q518 WeakPolarHBondContact O-CB 3.43Å; R514-Q518 PolarHBondContact O-N 3.44Å; L515-Q518 PolarHBondContact O-N 3.33Å; L516-Q518 VanDerWaalsContact C-N 3.29Å; L516-Q518 PolarHBondContact O-N 3.19Å; Q518-N521 PolarHBondContact O-N 2.89Å; Q518-N522 PolarHBondContact O-N 2.89Å; Q518-N522 PolarHBondContact O-ND2 3.24Å
519	N	96.1	Very high	94.4	Very high	78 Å²	78	102.8 Å²	102.8	42%	0.417	51%	0.512	S	S	.	.	H	α-helix	trans	-62.7	-47.7	176.8	-70	-12.3	0	0	0	111.7	L515 L516 N521 N522 E523	L515-N519 VanDerWaalsContact O-CG 3.3Å; L515-N519 PolarHBondContact O-N 3.48Å; L516-N519 PolarHBondContact O-N 2.73Å; N519-N521 VanDerWaalsContact C-N 3.3Å; N519-N521 PolarHBondContact O-N 2.65Å; N519-N522 WeakPolarHBondContact O-CB 3.44Å; N519-N522 PolarHBondContact O-N 3.04Å; N519-N522 VanDerWaalsContact O-N 3.13Å; N519-E523 PolarHBondContact O-N 3.34Å
520	L	96.2	Very high	94.4	Very high	94 Å²	94	98.9 Å²	98.9	49%	0.492	50%	0.501	S	S	.	.	H	α-helix	trans	-60.8	-39.5	177.1	-71.2	-179.8	0	0	0	112.4	L516 V517 E523 R524	L516-L520 HydrophobicContact CD2-CD1 3.48Å; L516-L520 VanDerWaalsContact CD2-CD1 3.48Å; L516-L520 HydrophobicContact CD2-CG 4Å; L516-L520 WeakPolarHBondContact O-CG 3.47Å; L516-L520 PolarHBondContact O-N 3Å; V517-L520 PolarHBondContact O-N 3.43Å; L520-E523 PolarHBondContact O-N 2.97Å; L520-R524 WeakPolarHBondContact O-CB 3.41Å; L520-R524 PolarHBondContact O-N 3.02Å
521	N	93.6	Very high	94.4	Very high	85 Å²	85	98.5 Å²	98.5	46%	0.455	50%	0.503	S	S	.	.	H	α-helix	trans	-64.5	-42.9	175.6	-78.4	-24.1	0	0	0	111.4	V517 Q518 N519 E523 R524 T525	V517-N521 WeakPolarHBondContact O-CB 3.49Å; V517-N521 VanDerWaalsContact O-CG 3.31Å; V517-N521 PolarHBondContact O-N 3.24Å; V517-N521 PolarHBondContact O-ND2 3.38Å; Q518-N521 PolarHBondContact O-N 2.89Å; N519-N521 VanDerWaalsContact C-N 3.3Å; N519-N521 PolarHBondContact O-N 2.65Å; N521-E523 PolarHBondContact O-N 3.29Å; N521-R524 PolarHBondContact O-N 3.09Å; N521-T525 VanDerWaalsContact O-CG2 3.25Å; N521-T525 WeakPolarHBondContact O-CG2 3.26Å; N521-T525 PolarHBondContact O-N 3.41Å; N521-T525 PolarHBondContact O-OG1 3.39Å
522	N	94.6	Very high	94.4	Very high	81 Å²	81	102.6 Å²	102.6	43%	0.433	51%	0.511	S	S	.	.	H	α-helix	trans	-60	-47	176.1	-68.3	-21.8	0	0	0	111	Q518 N519 R524 T525 L526	Q518-N522 PolarHBondContact O-N 2.89Å; Q518-N522 PolarHBondContact O-ND2 3.24Å; N519-N522 WeakPolarHBondContact O-CB 3.44Å; N519-N522 PolarHBondContact O-N 3.04Å; N519-N522 VanDerWaalsContact O-N 3.13Å; N522-R524 PolarHBondContact O-N 3.49Å; N522-T525 PolarHBondContact O-N 3.09Å; N522-T525 PolarHBondContact O-OG1 2.68Å; N522-L526 WeakPolarHBondContact O-CG 3.49Å; N522-L526 PolarHBondContact O-N 3.2Å
523	E	94.5	Very high	94.3	Very high	124 Å²	124	106.7 Å²	106.7	58%	0.579	52%	0.517	S	S	*	.	H	α-helix	trans	-60	-45.8	176	-71.4	-179.2	176.3	0	0	112.2	N519 L520 N521 T525 L526 L527	N519-E523 PolarHBondContact O-N 3.34Å; L520-E523 PolarHBondContact O-N 2.97Å; N521-E523 PolarHBondContact O-N 3.29Å; E523-T525 VanDerWaalsContact C-N 3.32Å; E523-T525 PolarHBondContact O-N 3.25Å; E523-L526 WeakPolarHBondContact O-CB 3.37Å; E523-L526 PolarHBondContact O-N 3.49Å; E523-L527 WeakPolarHBondContact O-CB 3.42Å; E523-L527 PolarHBondContact O-N 2.86Å
524	R	93.7	Very high	94.3	Very high	180 Å²	180	106.1 Å²	106.1	68%	0.679	52%	0.516	S	S	*	.	H	α-helix	trans	-60	-42.2	176.4	-174.4	177.9	177.7	-178.7	1.1	111.7	L520 N521 N522 L526 L527 T528	L520-R524 WeakPolarHBondContact O-CB 3.41Å; L520-R524 PolarHBondContact O-N 3.02Å; N521-R524 PolarHBondContact O-N 3.09Å; N522-R524 PolarHBondContact O-N 3.49Å; R524-L526 VanDerWaalsContact C-N 3.35Å; R524-L527 PolarHBondContact O-N 3.15Å; R524-T528 WeakPolarHBondContact O-CB 3.43Å; R524-T528 PolarHBondContact O-N 3.29Å; R524-T528 PolarHBondContact O-OG1 2.97Å
525	T	92.6	Very high	94.2	Very high	67 Å²	67	100.9 Å²	100.9	41%	0.411	50%	0.502	S	S	.	.	H	α-helix	trans	-65.5	-38.7	177.8	63.6	0	0	0	0	111.9	N521 N522 E523 T528 R529	N521-T525 VanDerWaalsContact O-CG2 3.25Å; N521-T525 WeakPolarHBondContact O-CG2 3.26Å; N521-T525 PolarHBondContact O-N 3.41Å; N521-T525 PolarHBondContact O-OG1 3.39Å; N522-T525 PolarHBondContact O-N 3.09Å; N522-T525 PolarHBondContact O-OG1 2.68Å; E523-T525 VanDerWaalsContact C-N 3.32Å; E523-T525 PolarHBondContact O-N 3.25Å; T525-T528 PolarHBondContact O-N 3Å; T525-R529 WeakPolarHBondContact O-CB 3.25Å; T525-R529 VanDerWaalsContact O-CG 3.26Å; T525-R529 WeakPolarHBondContact O-CG 3.46Å; T525-R529 PolarHBondContact O-N 3.32Å
526	L	94.1	Very high	94.1	Very high	112 Å²	112	104.7 Å²	104.7	59%	0.586	51%	0.51	S	S	*	.	H	α-helix	trans	-63.6	-46.9	175.1	-73.3	169.9	0	0	0	111.2	N522 E523 R524 T528 R529 G530	N522-L526 WeakPolarHBondContact O-CG 3.49Å; N522-L526 PolarHBondContact O-N 3.2Å; E523-L526 WeakPolarHBondContact O-CB 3.37Å; E523-L526 PolarHBondContact O-N 3.49Å; R524-L526 VanDerWaalsContact C-N 3.35Å; L526-T528 PolarHBondContact O-N 3.06Å; L526-R529 PolarHBondContact O-N 3.44Å; L526-G530 PolarHBondContact O-N 3.14Å
527	L	95.1	Very high	94	Very high	113 Å²	113	105.5 Å²	105.5	59%	0.592	51%	0.514	S	S	*	.	H	α-helix	trans	-61.2	-45.6	177.8	-168.1	153.8	0	0	0	111.2	E523 R524 R529 G530 L531	E523-L527 WeakPolarHBondContact O-CB 3.42Å; E523-L527 PolarHBondContact O-N 2.86Å; R524-L527 PolarHBondContact O-N 3.15Å; L527-R529 PolarHBondContact O-N 3.41Å; L527-G530 CarbonylContact O-C 2.97Å; L527-G530 WeakPolarHBondContact O-CA 3.42Å; L527-G530 PolarHBondContact O-N 2.91Å; L527-G530 VanDerWaalsContact O-N 3.07Å; L527-L531 HydrophobicContact CD2-CD1 3.53Å; L527-L531 HydrophobicContact CD2-CG 3.96Å; L527-L531 PolarHBondContact O-N 3.08Å
528	T	92.8	Very high	94	Very high	52 Å²	52	107.8 Å²	107.8	32%	0.319	52%	0.517	S	S	.	.	H	α-helix	trans	-63	-42.1	179.3	-48.7	0	0	0	0	111.3	R524 T525 L526 G530 L531 F532	R524-T528 WeakPolarHBondContact O-CB 3.43Å; R524-T528 PolarHBondContact O-N 3.29Å; R524-T528 PolarHBondContact O-OG1 2.97Å; T525-T528 PolarHBondContact O-N 3Å; L526-T528 PolarHBondContact O-N 3.06Å; T528-G530 VanDerWaalsContact C-N 3.3Å; T528-G530 PolarHBondContact O-N 3.31Å; T528-L531 PolarHBondContact O-N 3.4Å; T528-F532 HydrophobicContact CG2-CD2 3.88Å; T528-F532 HydrophobicContact CG2-CE2 3.46Å; T528-F532 VanDerWaalsContact CG2-CE2 3.46Å; T528-F532 HydrophobicContact CG2-CZ 4.28Å; T528-F532 WeakPolarHBondContact O-CD2 3.47Å; T528-F532 PolarHBondContact O-N 2.7Å
529	R	93.5	Very high	94	Very high	163 Å²	163	109.2 Å²	109.2	62%	0.615	52%	0.522	S	S	*	.	H	α-helix	trans	-61.8	-38.5	172.8	-74.3	173	-178.5	177.9	2.3	111.8	T525 L526 L527 K533	T525-R529 WeakPolarHBondContact O-CB 3.25Å; T525-R529 VanDerWaalsContact O-CG 3.26Å; T525-R529 WeakPolarHBondContact O-CG 3.46Å; T525-R529 PolarHBondContact O-N 3.32Å; L526-R529 PolarHBondContact O-N 3.44Å; L527-R529 PolarHBondContact O-N 3.41Å; R529-K533 WeakPolarHBondContact O-CG 3.45Å; R529-K533 PolarHBondContact O-N 3.29Å; R529-K533 VanDerWaalsContact O-N 3.14Å
530	G	93.4	Very high	93.8	Very high	29 Å²	29	109 Å²	109	30%	0.299	52%	0.52	S	S	.	.	H	α-helix	trans	-60.3	-49	173.1	0	0	0	0	0	112.2	L526 L527 T528 F532 K533 I534	L526-G530 PolarHBondContact O-N 3.14Å; L527-G530 CarbonylContact O-C 2.97Å; L527-G530 WeakPolarHBondContact O-CA 3.42Å; L527-G530 PolarHBondContact O-N 2.91Å; L527-G530 VanDerWaalsContact O-N 3.07Å; T528-G530 VanDerWaalsContact C-N 3.3Å; T528-G530 PolarHBondContact O-N 3.31Å; G530-F532 PolarHBondContact O-N 3.37Å; G530-K533 WeakPolarHBondContact O-CB 3.36Å; G530-K533 PolarHBondContact O-N 3.47Å; G530-I534 WeakPolarHBondContact O-CG1 3.16Å; G530-I534 PolarHBondContact O-N 3.31Å
531	L	94.8	Very high	93.7	Very high	88 Å²	88	109.3 Å²	109.3	46%	0.461	52%	0.519	S	S	.	.	H	α-helix	trans	-59.8	-46.8	177.2	-70.7	175.3	0	0	0	112.1	L527 T528 K533 I534 D535	L527-L531 HydrophobicContact CD2-CD1 3.53Å; L527-L531 HydrophobicContact CD2-CG 3.96Å; L527-L531 PolarHBondContact O-N 3.08Å; T528-L531 PolarHBondContact O-N 3.4Å; L531-K533 VanDerWaalsContact C-N 3.27Å; L531-K533 PolarHBondContact O-N 3.36Å; L531-I534 PolarHBondContact O-N 2.9Å; L531-I534 VanDerWaalsContact O-N 3.08Å; L531-D535 PolarHBondContact O-N 3.44Å
532	F	93	Very high	93.7	Very high	143 Å²	143	107.4 Å²	107.4	63%	0.627	52%	0.515	S	S	*	.	H	α-helix	trans	-60.6	-35.5	177.2	-76.9	-55.2	0	0	0	113.1	T528 G530 R536	T528-F532 HydrophobicContact CG2-CD2 3.88Å; T528-F532 HydrophobicContact CG2-CE2 3.46Å; T528-F532 VanDerWaalsContact CG2-CE2 3.46Å; T528-F532 HydrophobicContact CG2-CZ 4.28Å; T528-F532 WeakPolarHBondContact O-CD2 3.47Å; T528-F532 PolarHBondContact O-N 2.7Å; G530-F532 PolarHBondContact O-N 3.37Å; F532-R536 WeakPolarHBondContact O-CB 3.27Å; F532-R536 PolarHBondContact O-N 3.04Å
533	K	93.5	Very high	93.6	Very high	149 Å²	149	107.5 Å²	107.5	65%	0.648	52%	0.516	S	S	*	.	H	α-helix	trans	-64.7	-45.1	173.6	-73.6	176.5	-179	-175.6	0	111.1	R529 G530 L531 R536 L537	R529-K533 WeakPolarHBondContact O-CG 3.45Å; R529-K533 PolarHBondContact O-N 3.29Å; R529-K533 VanDerWaalsContact O-N 3.14Å; G530-K533 WeakPolarHBondContact O-CB 3.36Å; G530-K533 PolarHBondContact O-N 3.47Å; L531-K533 VanDerWaalsContact C-N 3.27Å; L531-K533 PolarHBondContact O-N 3.36Å; K533-R536 PolarHBondContact O-N 3.42Å; K533-L537 WeakPolarHBondContact O-CG 3.48Å; K533-L537 PolarHBondContact O-N 3.18Å
534	I	94.1	Very high	93.5	Very high	85 Å²	85	107 Å²	107	44%	0.436	52%	0.517	S	S	.	.	H	α-helix	trans	-62.4	-46.1	178.2	-66.6	167.3	0	0	0	110.6	G530 L531 R536 L537 K538	G530-I534 WeakPolarHBondContact O-CG1 3.16Å; G530-I534 PolarHBondContact O-N 3.31Å; L531-I534 PolarHBondContact O-N 2.9Å; L531-I534 VanDerWaalsContact O-N 3.08Å; I534-R536 VanDerWaalsContact C-N 3.32Å; I534-R536 PolarHBondContact O-N 3.29Å; I534-L537 WeakPolarHBondContact O-CB 3.35Å; I534-L537 PolarHBondContact O-N 3.45Å; I534-L537 VanDerWaalsContact O-N 3.15Å; I534-K538 HydrophobicContact CG2-CD 4.31Å; I534-K538 WeakPolarHBondContact O-CG 3.21Å; I534-K538 PolarHBondContact O-N 3.01Å
535	D	92.9	Very high	93.5	Very high	77 Å²	77	104.4 Å²	104.4	41%	0.412	51%	0.51	S	S	.	.	H	α-helix	trans	-63.2	-38.9	178.8	-76.8	-12.3	0	0	0	112.1	L531 L537 K538 K539	L531-D535 PolarHBondContact O-N 3.44Å; D535-L537 VanDerWaalsContact C-N 3.34Å; D535-K538 PolarHBondContact O-N 3.24Å; D535-K539 WeakPolarHBondContact O-CG 3.47Å; D535-K539 PolarHBondContact O-N 3.02Å
536	R	93.9	Very high	93.4	Very high	183 Å²	183	105.9 Å²	105.9	69%	0.691	52%	0.516	S	S	*	.	H	α-helix	trans	-62.5	-42.5	173.7	-171.9	177.9	-178.3	-175.9	-0.2	111.6	F532 K533 I534 K539 N540	F532-R536 WeakPolarHBondContact O-CB 3.27Å; F532-R536 PolarHBondContact O-N 3.04Å; K533-R536 PolarHBondContact O-N 3.42Å; I534-R536 VanDerWaalsContact C-N 3.32Å; I534-R536 PolarHBondContact O-N 3.29Å; R536-K539 PolarHBondContact O-N 3.36Å; R536-N540 PolarHBondContact O-N 3.01Å; R536-N540 PolarHBondContact O-OD1 2.97Å
537	L	93.9	Very high	93.4	Very high	116 Å²	116	106.8 Å²	106.8	61%	0.607	52%	0.515	S	S	*	.	H	α-helix	trans	-63.4	-43.6	176.3	-70.4	172.5	0	0	0	111.5	K533 I534 D535 K539 N540 E541	K533-L537 WeakPolarHBondContact O-CG 3.48Å; K533-L537 PolarHBondContact O-N 3.18Å; I534-L537 WeakPolarHBondContact O-CB 3.35Å; I534-L537 PolarHBondContact O-N 3.45Å; I534-L537 VanDerWaalsContact O-N 3.15Å; D535-L537 VanDerWaalsContact C-N 3.34Å; L537-K539 PolarHBondContact O-N 2.99Å; L537-N540 PolarHBondContact O-N 2.83Å; L537-E541 WeakPolarHBondContact O-CB 3.36Å; L537-E541 PolarHBondContact O-N 3.08Å
538	K	94.1	Very high	93.2	Very high	128 Å²	128	104 Å²	104	56%	0.557	51%	0.505	S	S	*	.	H	α-helix	trans	-60	-43	176.2	-73.6	178.4	178.4	176.8	0	112.6	I534 D535 E541 A542	I534-K538 HydrophobicContact CG2-CD 4.31Å; I534-K538 WeakPolarHBondContact O-CG 3.21Å; I534-K538 PolarHBondContact O-N 3.01Å; D535-K538 PolarHBondContact O-N 3.24Å; K538-E541 PolarHBondContact O-N 3.35Å; K538-A542 PolarHBondContact O-N 3.26Å
539	K	92.8	Very high	93.3	Very high	147 Å²	147	106.1 Å²	106.1	64%	0.639	51%	0.514	S	S	*	.	H	α-helix	trans	-62.1	-47.8	175.6	-73.6	-178.9	-178.9	-175.5	0	111.6	D535 R536 L537 E541 A542 D543	D535-K539 WeakPolarHBondContact O-CG 3.47Å; D535-K539 PolarHBondContact O-N 3.02Å; R536-K539 PolarHBondContact O-N 3.36Å; L537-K539 PolarHBondContact O-N 2.99Å; K539-E541 VanDerWaalsContact C-N 3.27Å; K539-E541 PolarHBondContact O-N 3.47Å; K539-A542 WeakPolarHBondContact O-CB 3.43Å; K539-A542 PolarHBondContact O-N 2.93Å; K539-D543 VanDerWaalsContact O-CG 3.31Å; K539-D543 PolarHBondContact O-N 3.06Å
540	N	93.1	Very high	93.3	Very high	73 Å²	73	102.4 Å²	102.4	39%	0.39	51%	0.505	S	S	.	.	H	α-helix	trans	-60.1	-39.2	177	-67.3	-12.2	0	0	0	111.9	R536 L537 D543 L544	R536-N540 PolarHBondContact O-N 3.01Å; R536-N540 PolarHBondContact O-OD1 2.97Å; L537-N540 PolarHBondContact O-N 2.83Å; N540-D543 PolarHBondContact O-N 3.38Å; N540-L544 WeakPolarHBondContact O-CB 3.39Å; N540-L544 VanDerWaalsContact O-CG 3.28Å; N540-L544 WeakPolarHBondContact O-CG 3.46Å; N540-L544 PolarHBondContact O-N 3.34Å
541	E	94.3	Very high	93.3	Very high	101 Å²	101	105.1 Å²	105.1	47%	0.472	52%	0.516	S	S	.	.	H	α-helix	trans	-65.8	-41.3	177.1	-164.8	-168.2	153.8	0	0	111.8	L537 K538 K539 L544 K545	L537-E541 WeakPolarHBondContact O-CB 3.36Å; L537-E541 PolarHBondContact O-N 3.08Å; K538-E541 PolarHBondContact O-N 3.35Å; K539-E541 VanDerWaalsContact C-N 3.27Å; K539-E541 PolarHBondContact O-N 3.47Å; E541-L544 PolarHBondContact O-N 3.02Å; E541-K545 WeakPolarHBondContact O-CG 3.5Å; E541-K545 PolarHBondContact O-N 2.95Å; E541-K545 WeakPolarHBondContact OE1-CE 3.41Å; E541-K545 IonicContact OE1-NZ 2.86Å; E541-K545 PolarHBondContact OE1-NZ 3.33Å
542	A	92.7	Very high	93.2	Very high	45 Å²	45	107.2 Å²	107.2	37%	0.372	52%	0.521	S	S	.	.	H	α-helix	trans	-61.9	-47.6	174.1	0	0	0	0	0	111.4	K538 K539 L544 K545 D546	K538-A542 PolarHBondContact O-N 3.26Å; K539-A542 WeakPolarHBondContact O-CB 3.43Å; K539-A542 PolarHBondContact O-N 2.93Å; A542-L544 VanDerWaalsContact C-N 3.26Å; A542-L544 PolarHBondContact O-N 3.27Å; A542-K545 WeakPolarHBondContact O-CB 3.4Å; A542-K545 PolarHBondContact O-N 2.92Å; A542-D546 PolarHBondContact O-N 3.11Å
543	D	92.9	Very high	93.1	Very high	82 Å²	82	106 Å²	106	44%	0.439	52%	0.517	S	S	.	.	H	α-helix	trans	-58.8	-38.3	177.5	-68	-16.2	0	0	0	112	K539 N540 K547	K539-D543 VanDerWaalsContact O-CG 3.31Å; K539-D543 PolarHBondContact O-N 3.06Å; N540-D543 PolarHBondContact O-N 3.38Å; D543-K547 WeakPolarHBondContact O-CB 3.28Å; D543-K547 VanDerWaalsContact O-CG 3.23Å; D543-K547 WeakPolarHBondContact O-CG 3.5Å; D543-K547 PolarHBondContact O-N 2.94Å
544	L	92.5	Very high	93.1	Very high	115 Å²	115	105.4 Å²	105.4	60%	0.602	52%	0.515	S	S	*	.	H	α-helix	trans	-67.7	-40.4	175.9	-74.6	172.2	0	0	0	112	N540 E541 A542 S548	N540-L544 WeakPolarHBondContact O-CB 3.39Å; N540-L544 VanDerWaalsContact O-CG 3.28Å; N540-L544 WeakPolarHBondContact O-CG 3.46Å; N540-L544 PolarHBondContact O-N 3.34Å; E541-L544 PolarHBondContact O-N 3.02Å; A542-L544 VanDerWaalsContact C-N 3.26Å; A542-L544 PolarHBondContact O-N 3.27Å; L544-S548 WeakPolarHBondContact O-CB 3.41Å; L544-S548 PolarHBondContact O-N 3.01Å
545	K	92.9	Very high	93	Very high	125 Å²	125	105.7 Å²	105.7	54%	0.543	52%	0.517	S	S	.	.	H	α-helix	trans	-63.2	-44.1	175.7	-74.5	173.9	-175.4	168	0	111.2	E541 A542 S548 L549	E541-K545 WeakPolarHBondContact O-CG 3.5Å; E541-K545 PolarHBondContact O-N 2.95Å; E541-K545 WeakPolarHBondContact OE1-CE 3.41Å; E541-K545 IonicContact OE1-NZ 2.86Å; E541-K545 PolarHBondContact OE1-NZ 3.33Å; A542-K545 WeakPolarHBondContact O-CB 3.4Å; A542-K545 PolarHBondContact O-N 2.92Å; K545-S548 WeakPolarHBondContact O-CB 3.23Å; K545-S548 PolarHBondContact O-N 3.29Å; K545-L549 PolarHBondContact O-N 3.42Å
546	D	92.1	Very high	92.9	Very high	98 Å²	98	109.5 Å²	109.5	52%	0.524	53%	0.53	S	S	.	.	H	α-helix	trans	-64.3	-46.3	178.3	-72.1	-10.1	0	0	0	111.5	A542 S548 L549 I550	A542-D546 PolarHBondContact O-N 3.11Å; D546-S548 VanDerWaalsContact C-N 3.31Å; D546-S548 PolarHBondContact O-N 3.25Å; D546-L549 PolarHBondContact O-N 3.47Å; D546-L549 VanDerWaalsContact O-N 3.13Å; D546-I550 WeakPolarHBondContact O-CG1 3.42Å; D546-I550 PolarHBondContact O-N 3.42Å
547	K	92.8	Very high	92.8	Very high	130 Å²	130	103.8 Å²	103.8	57%	0.565	52%	0.522	S	S	*	.	H	α-helix	trans	-57.9	-43.8	173.9	-74.2	172.2	-174.5	176	0	111.7	D543 L549 I550 V551	D543-K547 WeakPolarHBondContact O-CB 3.28Å; D543-K547 VanDerWaalsContact O-CG 3.23Å; D543-K547 WeakPolarHBondContact O-CG 3.5Å; D543-K547 PolarHBondContact O-N 2.94Å; K547-L549 VanDerWaalsContact C-N 3.31Å; K547-L549 PolarHBondContact O-N 2.97Å; K547-I550 PolarHBondContact O-N 3.09Å; K547-V551 VanDerWaalsContact O-CG2 3.27Å; K547-V551 WeakPolarHBondContact O-CG2 3.35Å; K547-V551 PolarHBondContact O-N 2.99Å
548	S	92.1	Very high	92.7	Very high	56 Å²	56	103.5 Å²	103.5	39%	0.392	52%	0.517	S	S	.	.	H	α-helix	trans	-60.1	-41.6	176.1	-173.9	0	0	0	0	111.9	L544 K545 D546 V551 K552	L544-S548 WeakPolarHBondContact O-CB 3.41Å; L544-S548 PolarHBondContact O-N 3.01Å; K545-S548 WeakPolarHBondContact O-CB 3.23Å; K545-S548 PolarHBondContact O-N 3.29Å; D546-S548 VanDerWaalsContact C-N 3.31Å; D546-S548 PolarHBondContact O-N 3.25Å; S548-V551 PolarHBondContact O-N 3.46Å; S548-K552 WeakPolarHBondContact O-CG 3.42Å; S548-K552 PolarHBondContact O-N 2.93Å
549	L	93.9	Very high	92.6	Very high	96 Å²	96	104.3 Å²	104.3	50%	0.503	52%	0.521	S	S	.	.	H	α-helix	trans	-67.2	-43.6	179.6	-167.9	134.1	0	0	0	111.9	K545 D546 K547 V551 K552 Q553	K545-L549 PolarHBondContact O-N 3.42Å; D546-L549 PolarHBondContact O-N 3.47Å; D546-L549 VanDerWaalsContact O-N 3.13Å; K547-L549 VanDerWaalsContact C-N 3.31Å; K547-L549 PolarHBondContact O-N 2.97Å; L549-V551 VanDerWaalsContact C-N 3.34Å; L549-V551 PolarHBondContact O-N 3.43Å; L549-K552 PolarHBondContact O-N 3.24Å; L549-Q553 HydrophobicContact CD2-CG 4.41Å; L549-Q553 WeakPolarHBondContact O-CG 3.33Å; L549-Q553 PolarHBondContact O-N 3.33Å
550	I	93.7	Very high	92.5	Very high	84 Å²	84	105.3 Å²	105.3	43%	0.431	52%	0.522	S	S	.	.	H	α-helix	trans	-59.5	-45.6	174.4	-66.8	164.9	0	0	0	110.6	D546 K547 K552 Q553 K554	D546-I550 WeakPolarHBondContact O-CG1 3.42Å; D546-I550 PolarHBondContact O-N 3.42Å; K547-I550 PolarHBondContact O-N 3.09Å; I550-K552 PolarHBondContact O-N 2.93Å; I550-Q553 PolarHBondContact O-N 3.42Å; I550-K554 PolarHBondContact O-N 3.2Å
551	V	93.2	Very high	92.3	Very high	86 Å²	86	103.5 Å²	103.5	52%	0.521	52%	0.52	S	S	.	.	H	α-helix	trans	-61.2	-44.8	177.6	171	0	0	0	0	110.8	K547 S548 L549 Q553 K554 L555	K547-V551 VanDerWaalsContact O-CG2 3.27Å; K547-V551 WeakPolarHBondContact O-CG2 3.35Å; K547-V551 PolarHBondContact O-N 2.99Å; S548-V551 PolarHBondContact O-N 3.46Å; L549-V551 VanDerWaalsContact C-N 3.34Å; L549-V551 PolarHBondContact O-N 3.43Å; V551-Q553 VanDerWaalsContact C-N 3.33Å; V551-Q553 PolarHBondContact O-N 3.13Å; V551-K554 PolarHBondContact O-N 3.38Å; V551-L555 HydrophobicContact CG1-CD1 4.13Å; V551-L555 WeakPolarHBondContact O-CG 3.38Å; V551-L555 PolarHBondContact O-N 3.4Å
552	K	92.6	Very high	92.2	Very high	133 Å²	133	105.1 Å²	105.1	58%	0.578	53%	0.526	S	S	*	.	H	α-helix	trans	-60.6	-40.5	175.9	-74.6	174.8	-177.2	177.4	0	112.2	S548 L549 I550 K556	S548-K552 WeakPolarHBondContact O-CG 3.42Å; S548-K552 PolarHBondContact O-N 2.93Å; L549-K552 PolarHBondContact O-N 3.24Å; I550-K552 PolarHBondContact O-N 2.93Å; K552-K556 WeakPolarHBondContact O-CG 3.27Å; K552-K556 PolarHBondContact O-N 2.99Å; K552-K556 VanDerWaalsContact O-N 3.09Å
553	Q	91.7	Very high	92.2	Very high	116 Å²	116	107.4 Å²	107.4	54%	0.542	53%	0.532	S	S	.	.	H	α-helix	trans	-65.1	-46.1	176.6	-74.6	178.6	-10.2	0	0	111.9	L549 I550 V551 L555 K556 A557	L549-Q553 HydrophobicContact CD2-CG 4.41Å; L549-Q553 WeakPolarHBondContact O-CG 3.33Å; L549-Q553 PolarHBondContact O-N 3.33Å; I550-Q553 PolarHBondContact O-N 3.42Å; V551-Q553 VanDerWaalsContact C-N 3.33Å; V551-Q553 PolarHBondContact O-N 3.13Å; Q553-L555 VanDerWaalsContact C-N 3.34Å; Q553-L555 PolarHBondContact O-N 3.32Å; Q553-K556 PolarHBondContact O-N 3.39Å; Q553-K556 VanDerWaalsContact O-N 3.16Å; Q553-A557 PolarHBondContact O-N 2.88Å
554	K	92	Very high	92.1	Very high	138 Å²	138	107.7 Å²	107.7	60%	0.6	53%	0.533	S	S	*	.	H	α-helix	trans	-58.5	-45.2	176	-74.3	-172	176.4	-172.9	0	111.9	I550 V551 K556 A557 E558	I550-K554 PolarHBondContact O-N 3.2Å; V551-K554 PolarHBondContact O-N 3.38Å; K554-K556 VanDerWaalsContact C-N 3.32Å; K554-K556 PolarHBondContact O-N 3.16Å; K554-A557 PolarHBondContact O-N 2.93Å; K554-E558 WeakPolarHBondContact O-CG 3.35Å; K554-E558 PolarHBondContact O-N 2.93Å
555	L	92.3	Very high	92.1	Very high	91 Å²	91	106.7 Å²	106.7	48%	0.476	53%	0.527	S	S	.	.	H	α-helix	trans	-61.4	-38.6	176.5	-72.5	173.1	0	0	0	112.6	V551 Q553 K559	V551-L555 HydrophobicContact CG1-CD1 4.13Å; V551-L555 WeakPolarHBondContact O-CG 3.38Å; V551-L555 PolarHBondContact O-N 3.4Å; Q553-L555 VanDerWaalsContact C-N 3.34Å; Q553-L555 PolarHBondContact O-N 3.32Å; L555-K559 WeakPolarHBondContact O-CG 3.47Å; L555-K559 PolarHBondContact O-N 2.94Å
556	K	91.6	Very high	92	Very high	157 Å²	157	107.4 Å²	107.4	68%	0.683	53%	0.531	S	S	*	.	H	α-helix	trans	-65.4	-44.4	174.4	-75.1	-179.6	179.5	-174.5	0	111.5	K552 Q553 K554 K559 Y560	K552-K556 WeakPolarHBondContact O-CG 3.27Å; K552-K556 PolarHBondContact O-N 2.99Å; K552-K556 VanDerWaalsContact O-N 3.09Å; Q553-K556 PolarHBondContact O-N 3.39Å; Q553-K556 VanDerWaalsContact O-N 3.16Å; K554-K556 VanDerWaalsContact C-N 3.32Å; K554-K556 PolarHBondContact O-N 3.16Å; K556-K559 PolarHBondContact O-N 3.05Å; K556-Y560 PolarHBondContact O-N 3.43Å
557	A	91.3	Very high	92.1	Very high	63 Å²	63	108 Å²	108	52%	0.521	53%	0.53	S	S	.	.	H	α-helix	trans	-62.7	-42.9	177.8	0	0	0	0	0	111.9	Q553 K554 Y560 G561	Q553-A557 PolarHBondContact O-N 2.88Å; K554-A557 PolarHBondContact O-N 2.93Å; A557-Y560 PolarHBondContact O-N 3.15Å; A557-G561 PolarHBondContact O-N 3.01Å
558	E	91.4	Very high	91.9	Very high	110 Å²	110	107.5 Å²	107.5	51%	0.514	53%	0.532	S	S	.	.	H	α-helix	trans	-62.8	-42.5	174.8	-76.9	-178.4	-169.3	0	0	112.4	K554 Y560 G561 K562	K554-E558 WeakPolarHBondContact O-CG 3.35Å; K554-E558 PolarHBondContact O-N 2.93Å; E558-Y560 VanDerWaalsContact C-N 3.34Å; E558-G561 PolarHBondContact O-N 3.5Å; E558-K562 WeakPolarHBondContact O-CB 3.5Å; E558-K562 WeakPolarHBondContact O-CG 3.34Å; E558-K562 PolarHBondContact O-N 3.39Å
559	K	92.4	Very high	92	Very high	145 Å²	145	111.3 Å²	111.3	63%	0.63	54%	0.541	S	S	*	.	H	α-helix	trans	-60.7	-44.9	174.6	-77.9	-179.6	180	-174.2	0	111.3	L555 K556 K562 N563	L555-K559 WeakPolarHBondContact O-CG 3.47Å; L555-K559 PolarHBondContact O-N 2.94Å; K556-K559 PolarHBondContact O-N 3.05Å; K559-K562 PolarHBondContact O-N 3.41Å; K559-N563 PolarHBondContact O-N 3.39Å
560	Y	90.3	Very high	91.9	Very high	168 Å²	168	112.1 Å²	112.1	66%	0.659	54%	0.54	S	S	*	.	H	α-helix	trans	-61.2	-47.3	176.4	-177.4	-97.8	0	0	0	111.6	K556 A557 E558 K562 N563 L564	K556-Y560 PolarHBondContact O-N 3.43Å; A557-Y560 PolarHBondContact O-N 3.15Å; E558-Y560 VanDerWaalsContact C-N 3.34Å; Y560-K562 PolarHBondContact O-N 2.92Å; Y560-N563 PolarHBondContact O-N 2.86Å; Y560-N563 VanDerWaalsContact O-N 3.15Å; Y560-L564 PolarHBondContact O-N 3.43Å
561	G	89.8	Confident	91.8	Very high	35 Å²	35	112 Å²	112	36%	0.361	54%	0.543	S	S	.	.	H	α-helix	trans	-59.9	-41.5	176.6	0	0	0	0	0	113.1	A557 E558 N563 L564 L565	A557-G561 PolarHBondContact O-N 3.01Å; E558-G561 PolarHBondContact O-N 3.5Å; G561-N563 PolarHBondContact O-N 3.02Å; G561-L564 PolarHBondContact O-N 3.14Å; G561-L565 WeakPolarHBondContact O-CB 3.41Å; G561-L565 PolarHBondContact O-N 2.9Å
562	K	92	Very high	91.7	Very high	134 Å²	134	116.5 Å²	116.5	58%	0.583	55%	0.551	S	S	*	*	H	α-helix	trans	-63.4	-39.7	174.5	-74.7	176	-177.7	175.5	0	112.3	E558 K559 Y560 K566	E558-K562 WeakPolarHBondContact O-CB 3.5Å; E558-K562 WeakPolarHBondContact O-CG 3.34Å; E558-K562 PolarHBondContact O-N 3.39Å; K559-K562 PolarHBondContact O-N 3.41Å; Y560-K562 PolarHBondContact O-N 2.92Å; K562-K566 WeakPolarHBondContact O-CG 3.34Å; K562-K566 PolarHBondContact O-N 3.29Å; K562-K566 VanDerWaalsContact O-N 3.14Å
563	N	93	Very high	91.5	Very high	94 Å²	94	113.4 Å²	113.4	50%	0.503	55%	0.546	S	S	.	.	H	α-helix	trans	-68	-44.3	177	-72.7	-10	0	0	0	111.6	K559 Y560 G561 L565 K566 E567	K559-N563 PolarHBondContact O-N 3.39Å; Y560-N563 PolarHBondContact O-N 2.86Å; Y560-N563 VanDerWaalsContact O-N 3.15Å; G561-N563 PolarHBondContact O-N 3.02Å; N563-L565 VanDerWaalsContact C-N 3.31Å; N563-L565 PolarHBondContact O-N 3.12Å; N563-K566 WeakPolarHBondContact O-CB 3.46Å; N563-K566 PolarHBondContact O-N 3.39Å; N563-K566 VanDerWaalsContact O-N 3.12Å; N563-E567 PolarHBondContact O-N 2.89Å
564	L	90.7	Very high	91.5	Very high	87 Å²	87	112.9 Å²	112.9	46%	0.455	54%	0.543	S	S	.	.	H	α-helix	trans	-57.7	-45.1	175.2	-169.1	79.9	0	0	0	111.1	Y560 G561 K566 E567 M568	Y560-L564 PolarHBondContact O-N 3.43Å; G561-L564 PolarHBondContact O-N 3.14Å; L564-K566 VanDerWaalsContact C-N 3.3Å; L564-K566 PolarHBondContact O-N 3.37Å; L564-E567 PolarHBondContact O-N 3.29Å; L564-M568 HydrophobicContact CG-SD 4.5Å; L564-M568 WeakPolarHBondContact O-CG 3.42Å; L564-M568 PolarHBondContact O-N 2.99Å
565	L	91.7	Very high	91.3	Very high	94 Å²	94	110.9 Å²	110.9	49%	0.492	54%	0.536	S	S	.	.	H	α-helix	trans	-61.1	-38.1	177.4	-171.7	72.9	0	0	0	112.2	G561 N563 K569	G561-L565 WeakPolarHBondContact O-CB 3.41Å; G561-L565 PolarHBondContact O-N 2.9Å; N563-L565 VanDerWaalsContact C-N 3.31Å; N563-L565 PolarHBondContact O-N 3.12Å; L565-K569 WeakPolarHBondContact O-CG 3.39Å; L565-K569 PolarHBondContact O-N 3.09Å
566	K	92.8	Very high	91.3	Very high	140 Å²	140	111.4 Å²	111.4	61%	0.609	54%	0.538	S	S	*	.	H	α-helix	trans	-63.6	-45.5	174.8	-74.9	177.1	178.5	-176.9	0	111.4	K562 N563 L564 K569 K570	K562-K566 WeakPolarHBondContact O-CG 3.34Å; K562-K566 PolarHBondContact O-N 3.29Å; K562-K566 VanDerWaalsContact O-N 3.14Å; N563-K566 WeakPolarHBondContact O-CB 3.46Å; N563-K566 PolarHBondContact O-N 3.39Å; N563-K566 VanDerWaalsContact O-N 3.12Å; L564-K566 VanDerWaalsContact C-N 3.3Å; L564-K566 PolarHBondContact O-N 3.37Å; K566-K569 PolarHBondContact O-N 2.88Å; K566-K570 PolarHBondContact O-N 3.19Å
567	E	92.2	Very high	91.3	Very high	110 Å²	110	111.4 Å²	111.4	51%	0.514	54%	0.535	S	S	.	.	H	α-helix	trans	-62.6	-44.1	176.5	-70.9	-56.1	144.5	0	0	111.6	N563 L564 K569 K570 V571	N563-E567 PolarHBondContact O-N 2.89Å; L564-E567 PolarHBondContact O-N 3.29Å; E567-K569 VanDerWaalsContact C-N 3.32Å; E567-K569 PolarHBondContact O-N 2.99Å; E567-K570 WeakPolarHBondContact O-CB 3.46Å; E567-K570 PolarHBondContact O-N 3.36Å; E567-K570 VanDerWaalsContact O-N 3.09Å; E567-V571 WeakPolarHBondContact O-CG2 3.35Å; E567-V571 PolarHBondContact O-N 2.99Å
568	M	90.6	Very high	91.3	Very high	121 Å²	121	115 Å²	115	60%	0.596	54%	0.539	S	S	*	.	H	α-helix	trans	-60.2	-41.2	175.6	-69.5	-177.2	81.9	0	0	112.3	L564 K570 V571 R572	L564-M568 HydrophobicContact CG-SD 4.5Å; L564-M568 WeakPolarHBondContact O-CG 3.42Å; L564-M568 PolarHBondContact O-N 2.99Å; M568-K570 VanDerWaalsContact C-N 3.32Å; M568-K570 PolarHBondContact O-N 3Å; M568-V571 PolarHBondContact O-N 3.44Å; M568-R572 WeakPolarHBondContact O-CB 3.44Å; M568-R572 PolarHBondContact O-N 3.18Å
569	K	92.3	Very high	91.1	Very high	136 Å²	136	116.3 Å²	116.3	59%	0.591	54%	0.539	S	S	*	.	H	α-helix	trans	-62.7	-39.8	174.6	-76.2	-179.8	179.9	-171.7	0	111.7	L565 K566 E567 R572 S573	L565-K569 WeakPolarHBondContact O-CG 3.39Å; L565-K569 PolarHBondContact O-N 3.09Å; K566-K569 PolarHBondContact O-N 2.88Å; E567-K569 VanDerWaalsContact C-N 3.32Å; E567-K569 PolarHBondContact O-N 2.99Å; K569-R572 PolarHBondContact O-N 3.15Å; K569-S573 WeakPolarHBondContact O-CB 3.47Å; K569-S573 PolarHBondContact O-N 2.94Å; K569-S573 PolarHBondContact O-OG 3.49Å
570	K	92.4	Very high	91.1	Very high	113 Å²	113	114.7 Å²	114.7	49%	0.491	53%	0.534	S	S	.	.	H	α-helix	trans	-64.3	-49.7	177.2	-171	-179.3	178	-174.3	0	111.3	K566 E567 M568 R572 S573 Q574	K566-K570 PolarHBondContact O-N 3.19Å; E567-K570 WeakPolarHBondContact O-CB 3.46Å; E567-K570 PolarHBondContact O-N 3.36Å; E567-K570 VanDerWaalsContact O-N 3.09Å; M568-K570 VanDerWaalsContact C-N 3.32Å; M568-K570 PolarHBondContact O-N 3Å; K570-R572 VanDerWaalsContact C-N 3.34Å; K570-R572 PolarHBondContact O-N 2.67Å; K570-S573 PolarHBondContact O-N 3.35Å; K570-S573 PolarHBondContact O-OG 3.49Å; K570-Q574 WeakPolarHBondContact O-CG 3.48Å; K570-Q574 PolarHBondContact O-N 3.38Å
571	V	91.3	Very high	91	Very high	80 Å²	80	109.2 Å²	109.2	49%	0.485	52%	0.519	S	S	.	.	H	α-helix	trans	-58.2	-46.9	175.7	174.3	0	0	0	0	110.8	E567 M568 S573 Q574 E575	E567-V571 WeakPolarHBondContact O-CG2 3.35Å; E567-V571 PolarHBondContact O-N 2.99Å; M568-V571 PolarHBondContact O-N 3.44Å; V571-S573 VanDerWaalsContact C-N 3.32Å; V571-S573 PolarHBondContact O-N 3.49Å; V571-Q574 WeakPolarHBondContact O-CB 3.44Å; V571-Q574 PolarHBondContact O-N 2.95Å; V571-Q574 VanDerWaalsContact O-N 3.15Å; V571-E575 PolarHBondContact O-N 2.93Å
572	R	91.3	Very high	91.1	Very high	182 Å²	182	113.5 Å²	113.5	69%	0.687	53%	0.53	S	S	*	.	H	α-helix	trans	-59.1	-41.7	177.2	-172.4	176	-177.8	168.3	1.2	112.2	M568 K569 K570 E575 I576	M568-R572 WeakPolarHBondContact O-CB 3.44Å; M568-R572 PolarHBondContact O-N 3.18Å; K569-R572 PolarHBondContact O-N 3.15Å; K570-R572 VanDerWaalsContact C-N 3.34Å; K570-R572 PolarHBondContact O-N 2.67Å; R572-E575 PolarHBondContact O-N 2.97Å; R572-I576 HydrophobicContact CG-CD1 4.07Å; R572-I576 VanDerWaalsContact O-CG1 3.26Å; R572-I576 WeakPolarHBondContact O-CG1 3.45Å; R572-I576 PolarHBondContact O-N 2.93Å
573	S	89.8	Confident	91	Very high	67 Å²	67	112.9 Å²	112.9	47%	0.469	53%	0.529	S	S	.	.	H	α-helix	trans	-65.7	-37.5	177.1	69.7	0	0	0	0	112.9	K569 K570 V571 Y577	K569-S573 WeakPolarHBondContact O-CB 3.47Å; K569-S573 PolarHBondContact O-N 2.94Å; K569-S573 PolarHBondContact O-OG 3.49Å; K570-S573 PolarHBondContact O-N 3.35Å; K570-S573 PolarHBondContact O-OG 3.49Å; V571-S573 VanDerWaalsContact C-N 3.32Å; V571-S573 PolarHBondContact O-N 3.49Å; S573-Y577 WeakPolarHBondContact O-CB 3.41Å; S573-Y577 PolarHBondContact O-N 3.43Å
574	Q	91.1	Very high	90.9	Very high	105 Å²	105	114.2 Å²	114.2	49%	0.491	53%	0.531	S	S	.	.	H	α-helix	trans	-66.6	-39.4	175.2	-71.4	176	-20	0	0	111.8	K570 V571 Y577 K578	K570-Q574 WeakPolarHBondContact O-CG 3.48Å; K570-Q574 PolarHBondContact O-N 3.38Å; V571-Q574 WeakPolarHBondContact O-CB 3.44Å; V571-Q574 PolarHBondContact O-N 2.95Å; V571-Q574 VanDerWaalsContact O-N 3.15Å; Q574-Y577 PolarHBondContact O-N 2.92Å; Q574-K578 WeakPolarHBondContact O-CG 3.42Å; Q574-K578 PolarHBondContact O-N 3.34Å
575	E	88.3	Confident	90.9	Very high	96 Å²	96	117 Å²	117	45%	0.449	54%	0.539	S	S	.	.	H	α-helix	trans	-69.1	-40.8	178.3	-161.2	178.1	162.8	0	0	111.8	V571 R572 Y577 K578 R579	V571-E575 PolarHBondContact O-N 2.93Å; R572-E575 PolarHBondContact O-N 2.97Å; E575-Y577 VanDerWaalsContact C-N 3.3Å; E575-Y577 PolarHBondContact O-N 3.45Å; E575-K578 PolarHBondContact O-N 2.98Å; E575-R579 WeakPolarHBondContact O-CG 3.32Å; E575-R579 PolarHBondContact O-N 3.29Å; E575-R579 IonicContact OE1-CZ 2.72Å; E575-R579 IonicContact OE1-NE 2.7Å; E575-R579 IonicContact OE1-NH2 2.97Å; E575-R579 PolarHBondContact OE1-NH2 2.94Å
576	I	90.6	Very high	90.8	Very high	102 Å²	102	115.9 Å²	115.9	52%	0.523	54%	0.536	S	S	.	.	H	α-helix	trans	-59.5	-43.5	171.5	-68.2	165.4	0	0	0	110.4	R572 R579 H580	R572-I576 HydrophobicContact CG-CD1 4.07Å; R572-I576 VanDerWaalsContact O-CG1 3.26Å; R572-I576 WeakPolarHBondContact O-CG1 3.45Å; R572-I576 PolarHBondContact O-N 2.93Å; I576-R579 PolarHBondContact O-N 3.24Å; I576-H580 WeakPolarHBondContact O-CB 3.43Å; I576-H580 PolarHBondContact O-N 3.3Å
577	Y	91.4	Very high	90.6	Very high	158 Å²	158	115.1 Å²	115.1	62%	0.62	54%	0.536	S	S	*	.	H	α-helix	trans	-61.9	-44.9	176.9	180	-98.4	0	0	0	112.2	S573 Q574 E575 H580 C581	S573-Y577 WeakPolarHBondContact O-CB 3.41Å; S573-Y577 PolarHBondContact O-N 3.43Å; Q574-Y577 PolarHBondContact O-N 2.92Å; E575-Y577 VanDerWaalsContact C-N 3.3Å; E575-Y577 PolarHBondContact O-N 3.45Å; Y577-H580 PolarHBondContact O-N 2.93Å; Y577-C581 VanDerWaalsContact CE1-SG 3.58Å; Y577-C581 PolarHBondContact O-N 3.41Å; Y577-C581 PolarHBondContact O-SG 3.48Å
578	K	91.3	Very high	90.5	Very high	137 Å²	137	114.4 Å²	114.4	60%	0.596	54%	0.536	S	S	*	.	H	α-helix	trans	-58.3	-49.3	175.3	-76	-178.6	178.9	-174.9	0	111.9	Q574 E575 H580 C581 E582	Q574-K578 WeakPolarHBondContact O-CG 3.42Å; Q574-K578 PolarHBondContact O-N 3.34Å; E575-K578 PolarHBondContact O-N 2.98Å; K578-H580 VanDerWaalsContact C-N 3.29Å; K578-H580 PolarHBondContact O-N 2.92Å; K578-C581 WeakPolarHBondContact O-CB 3.32Å; K578-C581 PolarHBondContact O-N 3.46Å; K578-C581 VanDerWaalsContact O-N 3.11Å; K578-E582 WeakPolarHBondContact O-CG 3.41Å; K578-E582 PolarHBondContact O-N 2.99Å
579	R	88.9	Confident	90.5	Very high	139 Å²	139	113.3 Å²	113.3	53%	0.525	53%	0.531	S	S	.	.	H	α-helix	trans	-58.4	-42.2	176.5	-70.1	-178.3	-166.6	-169.1	4.1	111.6	E575 I576 C581 E582 E583	E575-R579 WeakPolarHBondContact O-CG 3.32Å; E575-R579 PolarHBondContact O-N 3.29Å; E575-R579 IonicContact OE1-CZ 2.72Å; E575-R579 IonicContact OE1-NE 2.7Å; E575-R579 IonicContact OE1-NH2 2.97Å; E575-R579 PolarHBondContact OE1-NH2 2.94Å; I576-R579 PolarHBondContact O-N 3.24Å; R579-C581 VanDerWaalsContact C-N 3.35Å; R579-C581 PolarHBondContact O-N 2.92Å; R579-E582 WeakPolarHBondContact O-CB 3.49Å; R579-E582 PolarHBondContact O-N 3.26Å; R579-E583 WeakPolarHBondContact O-CB 3.26Å; R579-E583 WeakPolarHBondContact O-CG 3.41Å; R579-E583 PolarHBondContact O-N 3.47Å
580	H	91.9	Very high	90.3	Very high	111 Å²	111	109.7 Å²	109.7	51%	0.514	52%	0.517	S	S	.	.	H	α-helix	trans	-64.4	-38.2	176.8	-174.5	58.3	0	0	0	112.7	I576 Y577 K578 K584	I576-H580 WeakPolarHBondContact O-CB 3.43Å; I576-H580 PolarHBondContact O-N 3.3Å; Y577-H580 PolarHBondContact O-N 2.93Å; K578-H580 VanDerWaalsContact C-N 3.29Å; K578-H580 PolarHBondContact O-N 2.92Å; H580-K584 VanDerWaalsContact O-CB 3.32Å; H580-K584 WeakPolarHBondContact O-CB 3.48Å; H580-K584 PolarHBondContact O-N 3.11Å
581	C	88.6	Confident	90.1	Very high	53 Å²	53	107 Å²	107	36%	0.358	52%	0.516	S	S	.	.	H	α-helix	trans	-65	-41.5	173.2	-66	0	0	0	0	112.1	Y577 K578 R579 K584 F585	Y577-C581 VanDerWaalsContact CE1-SG 3.58Å; Y577-C581 PolarHBondContact O-N 3.41Å; Y577-C581 PolarHBondContact O-SG 3.48Å; K578-C581 WeakPolarHBondContact O-CB 3.32Å; K578-C581 PolarHBondContact O-N 3.46Å; K578-C581 VanDerWaalsContact O-N 3.11Å; R579-C581 VanDerWaalsContact C-N 3.35Å; R579-C581 PolarHBondContact O-N 2.92Å; C581-K584 PolarHBondContact O-N 3.37Å; C581-F585 WeakPolarHBondContact O-CB 3.33Å; C581-F585 PolarHBondContact O-N 3.03Å
582	E	91.4	Very high	90	Very high	125 Å²	125	110.2 Å²	110.2	58%	0.584	52%	0.524	S	S	*	.	H	α-helix	trans	-61.9	-47.7	175.1	-70.1	165.3	-172.8	0	0	111.1	K578 R579 K584 F585 V586	K578-E582 WeakPolarHBondContact O-CG 3.41Å; K578-E582 PolarHBondContact O-N 2.99Å; R579-E582 WeakPolarHBondContact O-CB 3.49Å; R579-E582 PolarHBondContact O-N 3.26Å; E582-K584 PolarHBondContact O-N 2.92Å; E582-F585 WeakPolarHBondContact O-CB 3.48Å; E582-F585 PolarHBondContact O-N 3.25Å; E582-V586 WeakPolarHBondContact O-CG2 3.41Å; E582-V586 PolarHBondContact O-N 2.86Å
583	E	89.9	Confident	89.9	Confident	121 Å²	121	106.7 Å²	106.7	57%	0.565	52%	0.515	S	S	*	.	H	α-helix	trans	-59.3	-45.4	175.5	-74.1	170.9	-178.7	0	0	111.8	R579 F585 V586 M587	R579-E583 WeakPolarHBondContact O-CB 3.26Å; R579-E583 WeakPolarHBondContact O-CG 3.41Å; R579-E583 PolarHBondContact O-N 3.47Å; E583-F585 VanDerWaalsContact C-N 3.35Å; E583-F585 PolarHBondContact O-N 3.43Å; E583-V586 PolarHBondContact O-N 3.28Å; E583-M587 WeakPolarHBondContact O-CG 3.35Å; E583-M587 PolarHBondContact O-N 3.33Å
584	K	91.3	Very high	89.8	Confident	122 Å²	122	108.9 Å²	108.9	53%	0.53	52%	0.516	S	S	.	.	H	α-helix	trans	-61.7	-43.2	177	-175.4	178.7	177.1	-177.3	0	111.6	H580 C581 E582 V586 M587 D588	H580-K584 VanDerWaalsContact O-CB 3.32Å; H580-K584 WeakPolarHBondContact O-CB 3.48Å; H580-K584 PolarHBondContact O-N 3.11Å; C581-K584 PolarHBondContact O-N 3.37Å; E582-K584 PolarHBondContact O-N 2.92Å; K584-V586 VanDerWaalsContact C-N 3.33Å; K584-V586 PolarHBondContact O-N 2.94Å; K584-M587 PolarHBondContact O-N 3.39Å; K584-D588 WeakPolarHBondContact O-CB 3.44Å; K584-D588 PolarHBondContact O-N 3.21Å
585	F	90.4	Very high	89.5	Confident	144 Å²	144	106.3 Å²	106.3	63%	0.632	51%	0.513	S	S	*	.	H	α-helix	trans	-59.6	-43.9	176.6	179.3	-95.3	0	0	0	111.8	C581 E582 E583 D588 M589	C581-F585 WeakPolarHBondContact O-CB 3.33Å; C581-F585 PolarHBondContact O-N 3.03Å; E582-F585 WeakPolarHBondContact O-CB 3.48Å; E582-F585 PolarHBondContact O-N 3.25Å; E583-F585 VanDerWaalsContact C-N 3.35Å; E583-F585 PolarHBondContact O-N 3.43Å; F585-D588 PolarHBondContact O-N 2.97Å; F585-M589 WeakPolarHBondContact O-CB 3.41Å; F585-M589 PolarHBondContact O-N 3.29Å
586	V	90.2	Very high	89.3	Confident	71 Å²	71	104.3 Å²	104.3	43%	0.43	51%	0.509	S	S	.	.	H	α-helix	trans	-62.2	-43.5	175.4	173.5	0	0	0	0	111.2	E582 E583 K584 M589 I590	E582-V586 WeakPolarHBondContact O-CG2 3.41Å; E582-V586 PolarHBondContact O-N 2.86Å; E583-V586 PolarHBondContact O-N 3.28Å; K584-V586 VanDerWaalsContact C-N 3.33Å; K584-V586 PolarHBondContact O-N 2.94Å; V586-M589 WeakPolarHBondContact O-CB 3.47Å; V586-M589 PolarHBondContact O-N 3.24Å; V586-I590 HydrophobicContact CG1-CD1 4Å; V586-I590 WeakPolarHBondContact O-CG1 3.49Å; V586-I590 PolarHBondContact O-N 2.88Å
587	M	88.4	Confident	89.2	Confident	124 Å²	124	104.6 Å²	104.6	61%	0.611	51%	0.508	S	S	*	.	H	α-helix	trans	-64.2	-41.5	177.9	-70.2	-60.9	-68.7	0	0	112.6	E583 K584 M589 I590 A591	E583-M587 WeakPolarHBondContact O-CG 3.35Å; E583-M587 PolarHBondContact O-N 3.33Å; K584-M587 PolarHBondContact O-N 3.39Å; M587-M589 VanDerWaalsContact C-N 3.32Å; M587-I590 PolarHBondContact O-N 2.88Å; M587-I590 HydrophobicContact SD-CD1 4.46Å; M587-A591 WeakPolarHBondContact O-CB 3.34Å; M587-A591 PolarHBondContact O-N 3.45Å
588	D	89.5	Confident	88.9	Confident	95 Å²	95	105.8 Å²	105.8	51%	0.508	51%	0.511	S	S	.	.	H	α-helix	trans	-64.6	-37.8	175.5	-71.5	-20.5	0	0	0	110.9	K584 F585 A591 F592	K584-D588 WeakPolarHBondContact O-CB 3.44Å; K584-D588 PolarHBondContact O-N 3.21Å; F585-D588 PolarHBondContact O-N 2.97Å; D588-A591 PolarHBondContact O-N 2.97Å; D588-F592 WeakPolarHBondContact O-CB 3.42Å; D588-F592 PolarHBondContact O-N 3.45Å
589	M	90.2	Very high	88.5	Confident	99 Å²	99	104.1 Å²	104.1	49%	0.488	51%	0.508	S	S	.	.	H	α-helix	trans	-63.5	-45.6	174.4	-169.7	-171.9	77.5	0	0	111.9	F585 V586 M587 A591 F592 E593	F585-M589 WeakPolarHBondContact O-CB 3.41Å; F585-M589 PolarHBondContact O-N 3.29Å; V586-M589 WeakPolarHBondContact O-CB 3.47Å; V586-M589 PolarHBondContact O-N 3.24Å; M587-M589 VanDerWaalsContact C-N 3.32Å; M589-A591 VanDerWaalsContact C-N 3.31Å; M589-A591 PolarHBondContact O-N 2.93Å; M589-F592 WeakPolarHBondContact O-CB 3.47Å; M589-F592 PolarHBondContact O-N 2.92Å; M589-E593 PolarHBondContact O-N 2.88Å
590	I	89.2	Confident	88.1	Confident	60 Å²	60	103.7 Å²	103.7	31%	0.308	51%	0.512	S	S	.	.	H	α-helix	trans	-62.7	-40.1	175.4	-66.7	165.9	0	0	0	110.7	V586 M587 F592 E593 K594	V586-I590 HydrophobicContact CG1-CD1 4Å; V586-I590 WeakPolarHBondContact O-CG1 3.49Å; V586-I590 PolarHBondContact O-N 2.88Å; M587-I590 PolarHBondContact O-N 2.88Å; M587-I590 HydrophobicContact SD-CD1 4.46Å; I590-F592 VanDerWaalsContact C-N 3.34Å; I590-E593 PolarHBondContact O-N 2.97Å; I590-K594 HydrophobicContact CG2-CD 4.33Å; I590-K594 WeakPolarHBondContact O-CG 3.44Å; I590-K594 PolarHBondContact O-N 2.98Å
591	A	87.4	Confident	87.6	Confident	57 Å²	57	102.8 Å²	102.8	47%	0.471	51%	0.511	S	S	.	.	H	α-helix	trans	-64.6	-39.7	176.4	0	0	0	0	0	111.9	M587 D588 M589 A595	M587-A591 WeakPolarHBondContact O-CB 3.34Å; M587-A591 PolarHBondContact O-N 3.45Å; D588-A591 PolarHBondContact O-N 2.97Å; M589-A591 VanDerWaalsContact C-N 3.31Å; M589-A591 PolarHBondContact O-N 2.93Å; A591-A595 WeakPolarHBondContact O-CB 3.45Å; A591-A595 PolarHBondContact O-N 3.37Å
592	F	89.3	Confident	87.1	Confident	146 Å²	146	102.7 Å²	102.7	64%	0.64	51%	0.514	S	S	*	.	H	α-helix	trans	-64.3	-44.7	174.1	179.8	-98.1	0	0	0	112	D588 M589 I590 A595 C596	D588-F592 WeakPolarHBondContact O-CB 3.42Å; D588-F592 PolarHBondContact O-N 3.45Å; M589-F592 WeakPolarHBondContact O-CB 3.47Å; M589-F592 PolarHBondContact O-N 2.92Å; I590-F592 VanDerWaalsContact C-N 3.34Å; F592-A595 WeakPolarHBondContact O-CB 3.34Å; F592-A595 PolarHBondContact O-N 2.92Å; F592-A595 VanDerWaalsContact O-N 3.12Å; F592-C596 PolarHBondContact O-N 3.42Å
593	E	89.1	Confident	86.5	Confident	108 Å²	108	103.3 Å²	103.3	51%	0.505	52%	0.515	S	S	.	.	H	α-helix	trans	-59.4	-48.3	175.8	-172.5	173.3	-160.7	0	0	111.3	M589 I590 A595 C596 E597	M589-E593 PolarHBondContact O-N 2.88Å; I590-E593 PolarHBondContact O-N 2.97Å; E593-A595 VanDerWaalsContact C-N 3.27Å; E593-A595 PolarHBondContact O-N 3.43Å; E593-C596 CarbonylContact O-C 3.54Å; E593-C596 WeakPolarHBondContact O-CA 3.4Å; E593-C596 WeakPolarHBondContact O-CB 3.36Å; E593-C596 PolarHBondContact O-N 3.1Å; E593-E597 PolarHBondContact O-N 2.86Å
594	K	87.7	Confident	85.9	Confident	113 Å²	113	101 Å²	101	49%	0.491	51%	0.509	S	S	.	.	H	α-helix	trans	-60.1	-33.9	173.7	-74.5	177.9	-179.7	176.8	0	113.1	I590 R598	I590-K594 HydrophobicContact CG2-CD 4.33Å; I590-K594 WeakPolarHBondContact O-CG 3.44Å; I590-K594 PolarHBondContact O-N 2.98Å; K594-R598 WeakPolarHBondContact O-CB 3.49Å; K594-R598 VanDerWaalsContact O-CG 3.23Å; K594-R598 WeakPolarHBondContact O-CG 3.47Å; K594-R598 PolarHBondContact O-N 2.93Å
595	A	85.2	Confident	85.3	Confident	51 Å²	51	101.7 Å²	101.7	42%	0.421	51%	0.512	S	S	.	.	H	α-helix	trans	-69	-38.7	174.8	0	0	0	0	0	111.5	A591 F592 E593 R598 L599	A591-A595 WeakPolarHBondContact O-CB 3.45Å; A591-A595 PolarHBondContact O-N 3.37Å; F592-A595 WeakPolarHBondContact O-CB 3.34Å; F592-A595 PolarHBondContact O-N 2.92Å; F592-A595 VanDerWaalsContact O-N 3.12Å; E593-A595 VanDerWaalsContact C-N 3.27Å; E593-A595 PolarHBondContact O-N 3.43Å; A595-R598 PolarHBondContact O-N 3.12Å; A595-L599 WeakPolarHBondContact O-CB 3.4Å; A595-L599 PolarHBondContact O-N 3.29Å
596	C	84.1	Confident	84.4	Confident	54 Å²	54	99 Å²	99	37%	0.365	51%	0.507	S	S	.	.	H	α-helix	trans	-64.3	-43.9	172.4	-73.4	0	0	0	0	112	F592 E593 L599 Q600	F592-C596 PolarHBondContact O-N 3.42Å; E593-C596 CarbonylContact O-C 3.54Å; E593-C596 WeakPolarHBondContact O-CA 3.4Å; E593-C596 WeakPolarHBondContact O-CB 3.36Å; E593-C596 PolarHBondContact O-N 3.1Å; C596-L599 WeakPolarHBondContact O-CB 3.33Å; C596-L599 PolarHBondContact O-N 3.47Å; C596-Q600 PolarHBondContact O-N 2.86Å
597	E	87.1	Confident	83.4	Confident	108 Å²	108	98 Å²	98	51%	0.505	51%	0.507	S	S	.	.	H	α-helix	trans	-58.7	-48.3	172.9	-71.6	179.7	160	0	0	111	E593 L599 Q600 D601	E593-E597 PolarHBondContact O-N 2.86Å; E597-L599 VanDerWaalsContact C-N 3.26Å; E597-L599 PolarHBondContact O-N 3.19Å; E597-Q600 CarbonylContact O-C 3.59Å; E597-Q600 WeakPolarHBondContact O-CB 3.48Å; E597-Q600 PolarHBondContact O-N 3.06Å; E597-Q600 VanDerWaalsContact O-N 3.1Å; E597-D601 PolarHBondContact O-N 3.44Å
598	R	85.7	Confident	82.6	Confident	184 Å²	184	96.3 Å²	96.3	69%	0.694	50%	0.499	S	S	*	.	H	α-helix	trans	-59	-36.9	175	-75.3	172.3	-178.5	176.3	0.7	112.7	K594 A595 A602	K594-R598 WeakPolarHBondContact O-CB 3.49Å; K594-R598 VanDerWaalsContact O-CG 3.23Å; K594-R598 WeakPolarHBondContact O-CG 3.47Å; K594-R598 PolarHBondContact O-N 2.93Å; A595-R598 PolarHBondContact O-N 3.12Å; R598-A602 WeakPolarHBondContact O-CB 3.46Å; R598-A602 PolarHBondContact O-N 3.39Å
599	L	83.4	Confident	81.4	Confident	101 Å²	101	96 Å²	96	53%	0.529	50%	0.501	S	S	.	.	H	α-helix	trans	-70.2	-37.4	176.2	-176	129.6	0	0	0	111.6	A595 C596 E597 A602 K603	A595-L599 WeakPolarHBondContact O-CB 3.4Å; A595-L599 PolarHBondContact O-N 3.29Å; C596-L599 WeakPolarHBondContact O-CB 3.33Å; C596-L599 PolarHBondContact O-N 3.47Å; E597-L599 VanDerWaalsContact C-N 3.26Å; E597-L599 PolarHBondContact O-N 3.19Å; L599-A602 PolarHBondContact O-N 3.3Å; L599-K603 HydrophobicContact CD2-CD 4.21Å; L599-K603 WeakPolarHBondContact O-CB 3.23Å; L599-K603 WeakPolarHBondContact O-CG 3.48Å; L599-K603 PolarHBondContact O-N 2.95Å
600	Q	80.3	Confident	80.1	Confident	130 Å²	130	99.2 Å²	99.2	61%	0.607	51%	0.512	S	S	*	.	H	α-helix	trans	-65.1	-45.4	170.9	-72.9	-167.2	-2.3	0	0	111.4	C596 E597 A602 K603 T604	C596-Q600 PolarHBondContact O-N 2.86Å; E597-Q600 CarbonylContact O-C 3.59Å; E597-Q600 WeakPolarHBondContact O-CB 3.48Å; E597-Q600 PolarHBondContact O-N 3.06Å; E597-Q600 VanDerWaalsContact O-N 3.1Å; Q600-A602 VanDerWaalsContact C-N 3.31Å; Q600-A602 PolarHBondContact O-N 2.88Å; Q600-K603 CarbonylContact O-C 3.58Å; Q600-K603 WeakPolarHBondContact O-CA 3.23Å; Q600-K603 WeakPolarHBondContact O-CB 3.3Å; Q600-K603 PolarHBondContact O-N 2.88Å; Q600-K603 VanDerWaalsContact O-N 3.07Å; Q600-T604 WeakPolarHBondContact O-CG2 3.43Å; Q600-T604 PolarHBondContact O-N 3.35Å; Q600-T604 PolarHBondContact O-OG1 2.84Å
601	D	81.8	Confident	78.7	Confident	92 Å²	92	101 Å²	101	49%	0.492	53%	0.525	S	S	.	.	H	α-helix	trans	-60.5	-38.3	174.4	-88.9	-1.8	0	0	0	112.5	E597 T604 K605	E597-D601 PolarHBondContact O-N 3.44Å; D601-T604 VanDerWaalsContact CA-OG1 3.31Å; D601-T604 WeakPolarHBondContact CA-OG1 3.42Å; D601-T604 PolarHBondContact O-OG1 3.07Å; D601-K605 VanDerWaalsContact O-CB 3.3Å; D601-K605 WeakPolarHBondContact O-CB 3.24Å; D601-K605 VanDerWaalsContact O-CG 3.23Å; D601-K605 WeakPolarHBondContact O-CG 3.38Å; D601-K605 PolarHBondContact O-N 2.85Å
602	A	77.6	Confident	77.3	Confident	51 Å²	51	104.2 Å²	104.2	42%	0.421	54%	0.535	S	S	.	.	H	α-helix	trans	-66.5	-41.6	173.1	0	0	0	0	0	111	R598 L599 Q600 K605 V606	R598-A602 WeakPolarHBondContact O-CB 3.46Å; R598-A602 PolarHBondContact O-N 3.39Å; L599-A602 PolarHBondContact O-N 3.3Å; Q600-A602 VanDerWaalsContact C-N 3.31Å; Q600-A602 PolarHBondContact O-N 2.88Å; A602-K605 PolarHBondContact O-N 2.9Å; A602-V606 WeakPolarHBondContact O-CB 3.39Å; A602-V606 VanDerWaalsContact O-CG2 3.24Å; A602-V606 WeakPolarHBondContact O-CG2 3.38Å; A602-V606 PolarHBondContact O-N 2.8Å
603	K	78.7	Confident	75.3	Confident	139 Å²	139	103.5 Å²	103.5	60%	0.604	54%	0.537	S	S	*	.	H	α-helix	trans	-62.6	-42.5	174.2	-78.6	178.7	176.7	-179.9	0	112.2	L599 Q600 V606 A607	L599-K603 HydrophobicContact CD2-CD 4.21Å; L599-K603 WeakPolarHBondContact O-CB 3.23Å; L599-K603 WeakPolarHBondContact O-CG 3.48Å; L599-K603 PolarHBondContact O-N 2.95Å; Q600-K603 CarbonylContact O-C 3.58Å; Q600-K603 WeakPolarHBondContact O-CA 3.23Å; Q600-K603 WeakPolarHBondContact O-CB 3.3Å; Q600-K603 PolarHBondContact O-N 2.88Å; Q600-K603 VanDerWaalsContact O-N 3.07Å; K603-V606 PolarHBondContact O-N 3.5Å; K603-A607 WeakPolarHBondContact O-CB 3.31Å; K603-A607 PolarHBondContact O-N 2.8Å
604	T	78.1	Confident	73.1	Confident	72 Å²	72	105.1 Å²	105.1	44%	0.442	55%	0.549	S	S	.	.	H	α-helix	trans	-68.2	-42	176.8	57.4	0	0	0	0	111	Q600 D601 V606 A607 I608	Q600-T604 WeakPolarHBondContact O-CG2 3.43Å; Q600-T604 PolarHBondContact O-N 3.35Å; Q600-T604 PolarHBondContact O-OG1 2.84Å; D601-T604 VanDerWaalsContact CA-OG1 3.31Å; D601-T604 WeakPolarHBondContact CA-OG1 3.42Å; D601-T604 PolarHBondContact O-OG1 3.07Å; T604-V606 PolarHBondContact O-N 3.45Å; T604-A607 CarbonylContact O-C 3.57Å; T604-A607 WeakPolarHBondContact O-CB 3.46Å; T604-A607 PolarHBondContact O-N 3.17Å; T604-A607 VanDerWaalsContact O-N 3.17Å; T604-I608 VanDerWaalsContact O-CG1 3.24Å; T604-I608 WeakPolarHBondContact O-CG1 3.41Å; T604-I608 PolarHBondContact O-N 3.36Å
605	K	78.3	Confident	70.8	Confident	137 Å²	137	109.7 Å²	109.7	60%	0.596	57%	0.569	S	S	*	*	H	α-helix	trans	-61.4	-43.2	172.6	-75.2	173.7	-175.6	175.2	0	112.3	D601 A602 A607 I608 V609	D601-K605 VanDerWaalsContact O-CB 3.3Å; D601-K605 WeakPolarHBondContact O-CB 3.24Å; D601-K605 VanDerWaalsContact O-CG 3.23Å; D601-K605 WeakPolarHBondContact O-CG 3.38Å; D601-K605 PolarHBondContact O-N 2.85Å; A602-K605 PolarHBondContact O-N 2.9Å; K605-A607 VanDerWaalsContact C-N 3.3Å; K605-A607 PolarHBondContact O-N 3.27Å; K605-I608 CarbonylContact O-C 3.17Å; K605-I608 PolarHBondContact O-N 2.92Å; K605-I608 VanDerWaalsContact O-N 3.17Å; K605-V609 WeakPolarHBondContact O-CG2 3.5Å; K605-V609 PolarHBondContact O-N 3.43Å
606	V	71.1	Confident	68.6	Low	86 Å²	86	115.5 Å²	115.5	52%	0.521	59%	0.585	S	S	.	*	H	α-helix	trans	-63	-38.4	173.7	168.5	0	0	0	0	111.1	A602 K603 T604 V609 K610	A602-V606 WeakPolarHBondContact O-CB 3.39Å; A602-V606 VanDerWaalsContact O-CG2 3.24Å; A602-V606 WeakPolarHBondContact O-CG2 3.38Å; A602-V606 PolarHBondContact O-N 2.8Å; K603-V606 PolarHBondContact O-N 3.5Å; T604-V606 PolarHBondContact O-N 3.45Å; V606-V609 PolarHBondContact O-N 2.81Å; V606-K610 WeakPolarHBondContact O-CB 3.48Å; V606-K610 WeakPolarHBondContact O-CG 3.28Å; V606-K610 PolarHBondContact O-N 3.34Å
607	A	69.8	Low	66.9	Low	51 Å²	51	119.4 Å²	119.4	42%	0.421	60%	0.601	S	S	.	*	H	α-helix	trans	-62.7	-41.7	172.4	0	0	0	0	0	111.5	K603 T604 K605 K610 T611	K603-A607 WeakPolarHBondContact O-CB 3.31Å; K603-A607 PolarHBondContact O-N 2.8Å; T604-A607 CarbonylContact O-C 3.57Å; T604-A607 WeakPolarHBondContact O-CB 3.46Å; T604-A607 PolarHBondContact O-N 3.17Å; T604-A607 VanDerWaalsContact O-N 3.17Å; K605-A607 VanDerWaalsContact C-N 3.3Å; K605-A607 PolarHBondContact O-N 3.27Å; A607-K610 WeakPolarHBondContact O-CB 3.49Å; A607-K610 PolarHBondContact O-N 3.42Å; A607-T611 WeakPolarHBondContact O-CG2 3.42Å; A607-T611 PolarHBondContact O-N 3.47Å; A607-T611 PolarHBondContact O-OG1 2.82Å
608	I	70.2	Confident	64.9	Low	89 Å²	89	118.8 Å²	118.8	46%	0.456	61%	0.606	S	S	.	*	H	α-helix	trans	-66.7	-39.8	176.4	-66.7	161.3	0	0	0	111.8	T604 K605 K610 T611 N612	T604-I608 VanDerWaalsContact O-CG1 3.24Å; T604-I608 WeakPolarHBondContact O-CG1 3.41Å; T604-I608 PolarHBondContact O-N 3.36Å; K605-I608 CarbonylContact O-C 3.17Å; K605-I608 PolarHBondContact O-N 2.92Å; K605-I608 VanDerWaalsContact O-N 3.17Å; I608-K610 VanDerWaalsContact C-N 3.33Å; I608-T611 VanDerWaalsContact CA-OG1 3.28Å; I608-T611 WeakPolarHBondContact CA-OG1 3.47Å; I608-T611 PolarHBondContact O-N 3.43Å; I608-T611 PolarHBondContact O-OG1 2.89Å; I608-N612 WeakPolarHBondContact CG2-ND2 3.24Å; I608-N612 WeakPolarHBondContact O-CB 3.38Å; I608-N612 PolarHBondContact O-N 3.17Å
609	V	66.1	Low	63.1	Low	88 Å²	88	118.5 Å²	118.5	53%	0.533	62%	0.618	S	S	.	*	H	α-helix	trans	-65.8	-37.9	174	173.6	0	0	0	0	110.7	K605 V606 T611 N612 L613	K605-V609 WeakPolarHBondContact O-CG2 3.5Å; K605-V609 PolarHBondContact O-N 3.43Å; V606-V609 PolarHBondContact O-N 2.81Å; V609-T611 VanDerWaalsContact C-N 3.28Å; V609-T611 PolarHBondContact O-N 3.01Å; V609-N612 PolarHBondContact O-N 3.17Å; V609-L613 HydrophobicContact CG1-CD1 4.07Å; V609-L613 WeakPolarHBondContact O-CB 3.37Å; V609-L613 PolarHBondContact O-N 2.85Å
610	K	61.2	Low	61.4	Low	167 Å²	167	116.3 Å²	116.3	73%	0.726	62%	0.62	S	S	*	*	H	α-helix	trans	-63.9	-30.2	171.4	-81.5	-176.9	173.3	-175.5	0	113.1	V606 A607 I608	V606-K610 WeakPolarHBondContact O-CB 3.48Å; V606-K610 WeakPolarHBondContact O-CG 3.28Å; V606-K610 PolarHBondContact O-N 3.34Å; A607-K610 WeakPolarHBondContact O-CB 3.49Å; A607-K610 PolarHBondContact O-N 3.42Å; I608-K610 VanDerWaalsContact C-N 3.33Å
611	T	60.5	Low	59.6	Low	96 Å²	96	117.4 Å²	117.4	59%	0.589	63%	0.63	S	S	*	*	H	α-helix	trans	-86.3	-22.1	177.1	55.7	0	0	0	0	114.1	A607 I608 V609	A607-T611 WeakPolarHBondContact O-CG2 3.42Å; A607-T611 PolarHBondContact O-N 3.47Å; A607-T611 PolarHBondContact O-OG1 2.82Å; I608-T611 VanDerWaalsContact CA-OG1 3.28Å; I608-T611 WeakPolarHBondContact CA-OG1 3.47Å; I608-T611 PolarHBondContact O-N 3.43Å; I608-T611 PolarHBondContact O-OG1 2.89Å; V609-T611 VanDerWaalsContact C-N 3.28Å; V609-T611 PolarHBondContact O-N 3.01Å
612	N	58.5	Low	57.5	Low	125 Å²	125	119.5 Å²	119.5	67%	0.668	64%	0.639	S	S	*	*	S	Bend	trans	-96.4	6.4	-179.9	-69.5	-11.4	0	0	0	113.8	I608 V609	I608-N612 WeakPolarHBondContact CG2-ND2 3.24Å; I608-N612 WeakPolarHBondContact O-CB 3.38Å; I608-N612 PolarHBondContact O-N 3.17Å; V609-N612 PolarHBondContact O-N 3.17Å
613	L	47.5	Very low	55.7	Low	132 Å²	132	130.2 Å²	130.2	69%	0.691	68%	0.676	S	S	*	*			trans	-97.7	26.3	175.9	-111.8	155.9	0	0	0	113.2	V609	V609-L613 HydrophobicContact CG1-CD1 4.07Å; V609-L613 WeakPolarHBondContact O-CB 3.37Å; V609-L613 PolarHBondContact O-N 2.85Å
614	D	43	Very low	54.6	Low	141 Å²	141	129.8 Å²	129.8	75%	0.754	68%	0.68	S	S	*	*			trans	-117.9	74.3	169.5	-83.9	-30.9	0	0	0	110.4
615	F	39.5	Very low	53.3	Low	210 Å²	210	132.8 Å²	132.8	92%	0.921	69%	0.692	S	S	*	*			trans	-98.1	108	147.8	-110.8	-81	0	0	0	108.2
616	K	38.1	Very low	51.9	Low	172 Å²	172	132.6 Å²	132.6	75%	0.748	70%	0.698	S	S	*	*			trans	-70.7	128.4	171.5	-94.6	-179.2	168.9	175.7	0	110.7
617	I	48.6	Very low	50.8	Low	137 Å²	137	135.3 Å²	135.3	70%	0.703	71%	0.708	S	S	*	*				76.7	132.1	125	-59.7	170.6	0	0	0	114.6
618	P	45.2	Very low	49.6	Very low	94 Å²	94	140.6 Å²	140.6	61%	0.61	73%	0.726	S	S	*	*				-150.3	-167.6	59.5	27.5	-0.5	0	0	0	115.2	G620	P618-G620 VanDerWaalsContact C-N 3.29Å; P618-G620 PolarHBondContact O-N 2.85Å
619	N	47.3	Very low	48.3	Very low	178 Å²	178	144 Å²	144	95%	0.952	74%	0.744	S	S	*	*	S	Bend	trans	-36.2	105.2	136.8	-91.1	-20.9	0	0	0	108.4
620	G	49	Very low	47	Very low	55 Å²	55	148 Å²	148	57%	0.567	76%	0.759	S	S	*	*			trans	169.2	61.1	-164.6	0	0	0	0	0	112.6	P618	P618-G620 VanDerWaalsContact C-N 3.29Å; P618-G620 PolarHBondContact O-N 2.85Å
621	L	41.8	Very low	45.9	Very low	154 Å²	154	146.5 Å²	146.5	81%	0.806	76%	0.762	S	S	*	*			trans	50	111.6	153.1	-72.8	139.6	0	0	0	121.2
622	I	38.1	Very low	44.7	Very low	136 Å²	136	150.8 Å²	150.8	70%	0.697	78%	0.776	S	S	*	*				85.5	122.5	128.5	-60.6	175.7	0	0	0	120.2
623	K	39.4	Very low	43.4	Very low	275 Å²	275	153.1 Å²	153.1	100%	1.196	79%	0.786	S	S	*	*			trans	81.9	0	156.3	-83.5	172.5	-176.7	-177.8	0	119.4

Retrieved 623 of 623 residues in 171.5 ms (Link to these results)

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