A0A077ZDL1_TRITR Loading...

HMG box domain-containing protein

AlphaFold DB , UniProt , Accession A0A077ZDL1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 262 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	50.7	Low	50.2	Low	242 Å²	242	148.9 Å²	148.9	100%	1.192	77%	0.773	S	S	*	*				0	101	0	-86	177.6	169.6	0	0	107.7	R3	M1-R3 PolarHBondContact O-N 2.76Å; M1-R3 VanDerWaalsContact O-N 3.13Å
2	L	49.4	Very low	51.4	Low	167 Å²	167	150.8 Å²	150.8	87%	0.874	77%	0.77	S	S	*	*			trans	-69.5	106.5	176.8	-81.9	134.3	0	0	0	108.3	M4	L2-M4 VanDerWaalsContact C-N 3.31Å; L2-M4 PolarHBondContact O-N 3.47Å; L2-M4 VanDerWaalsContact O-N 3.08Å
3	R	48.4	Very low	53.2	Low	231 Å²	231	151.1 Å²	151.1	87%	0.872	77%	0.767	S	S	*	*			trans	-67.4	99.4	160	-67.4	-177.1	-169.1	-179.1	3.3	105	M1 D5	M1-R3 PolarHBondContact O-N 2.76Å; M1-R3 VanDerWaalsContact O-N 3.13Å; R3-D5 VanDerWaalsContact C-N 3.29Å; R3-D5 PolarHBondContact O-N 3.47Å
4	M	53.6	Low	55.4	Low	167 Å²	167	141.1 Å²	141.1	82%	0.823	72%	0.716	S	S	*	*			trans	-67.9	103	161.6	-67.6	-128.4	177.2	0	0	104.8	L2 D6	L2-M4 VanDerWaalsContact C-N 3.31Å; L2-M4 PolarHBondContact O-N 3.47Å; L2-M4 VanDerWaalsContact O-N 3.08Å; M4-D6 PolarHBondContact O-N 3.01Å
5	D	50.9	Low	57.7	Low	141 Å²	141	136.3 Å²	136.3	75%	0.754	70%	0.698	S	S	*	*			trans	-59.8	81.8	161.7	-79.6	-48.3	0	0	0	106.7	R3 T7	R3-D5 VanDerWaalsContact C-N 3.29Å; R3-D5 PolarHBondContact O-N 3.47Å; D5-T7 PolarHBondContact O-N 2.97Å; D5-T7 PolarHBondContact O-OG1 3.23Å
6	D	50.9	Low	59.5	Low	121 Å²	121	134.9 Å²	134.9	65%	0.647	69%	0.692	S	S	*	*			trans	-66.5	88.1	167.7	-151	-8.5	0	0	0	104.7	M4 M8	M4-D6 PolarHBondContact O-N 3.01Å; D6-M8 HydrophobicContact CB-CE 4.2Å; D6-M8 PolarHBondContact O-N 3.45Å; D6-M8 VanDerWaalsContact OD2-CE 3.25Å; D6-M8 WeakPolarHBondContact OD2-CE 3.48Å
7	T	46.4	Very low	61.4	Low	122 Å²	122	133.6 Å²	133.6	75%	0.748	68%	0.682	S	S	*	*			trans	-66.8	80	177.6	-52.9	0	0	0	0	104.8	D5 A9	D5-T7 PolarHBondContact O-N 2.97Å; D5-T7 PolarHBondContact O-OG1 3.23Å; T7-A9 PolarHBondContact O-N 3.15Å
8	M	46.1	Very low	63.2	Low	138 Å²	138	129.4 Å²	129.4	68%	0.68	66%	0.659	S	S	*	*			trans	-61.5	91.6	169.3	-69.3	-69.8	165.7	0	0	104.5	D6	D6-M8 HydrophobicContact CB-CE 4.2Å; D6-M8 PolarHBondContact O-N 3.45Å; D6-M8 VanDerWaalsContact OD2-CE 3.25Å; D6-M8 WeakPolarHBondContact OD2-CE 3.48Å
9	A	47.3	Very low	64.6	Low	73 Å²	73	124.5 Å²	124.5	60%	0.603	64%	0.635	S	S	*	*			trans	-43.4	132.1	171.1	0	0	0	0	0	106.6	T7 E11	T7-A9 PolarHBondContact O-N 3.15Å; A9-E11 PolarHBondContact O-N 3.18Å
10	P	50.9	Low	66.1	Low	111 Å²	111	123.8 Å²	123.8	72%	0.721	63%	0.627	S	S	*	*			trans	-47.6	116.7	-169.2	19.8	-32.8	0	0	0	107.2	K12	P10-K12 VanDerWaalsContact C-N 3.31Å; P10-K12 PolarHBondContact O-N 3.01Å
11	E	57.4	Low	67.5	Low	125 Å²	125	121.7 Å²	121.7	58%	0.584	62%	0.615	S	S	*	*			trans	-51.8	106.3	179.1	-69.4	-159.8	111.8	0	0	105.3	A9 E13 R64	A9-E11 PolarHBondContact O-N 3.18Å; E11-E13 PolarHBondContact O-N 3.29Å; E11-R64 IonicContact OE1-CZ 2.95Å; E11-R64 IonicContact OE1-NH1 3.65Å; E11-R64 PolarHBondContact OE1-NH1 3.37Å; E11-R64 IonicContact OE1-NH2 3.18Å
12	K	65.4	Low	69.6	Low	171 Å²	171	110.2 Å²	110.2	74%	0.743	56%	0.558	S	S	*	*			trans	-67.8	86.3	178.8	-70.8	-179	179.9	-180	0	105.3	P10 I14 Q61	P10-K12 VanDerWaalsContact C-N 3.31Å; P10-K12 PolarHBondContact O-N 3.01Å; K12-I14 PolarHBondContact O-N 3.04Å; K12-Q61 PolarHBondContact O-NE2 3.48Å
13	E	74.6	Confident	71.7	Confident	155 Å²	155	109 Å²	109	72%	0.724	55%	0.546	S	S	*	.			trans	-62	109.8	171.5	-71.4	-158.9	141.9	0	0	106	E11 P15	E11-E13 PolarHBondContact O-N 3.29Å; E13-P15 WeakPolarHBondContact O-CD 3.46Å
14	I	83.5	Confident	73.9	Confident	11 Å²	11	103.2 Å²	103.2	6%	0.056	53%	0.529	C	S	.	.			trans	-64.8	126.8	176.1	-67.4	-164.6	0	0	0	106.9	K12 H18 L19 Y53 T57 L58 Q61	K12-I14 PolarHBondContact O-N 3.04Å; I14-H18 HydrophobicContact CG2-CB 3.31Å; I14-L19 HydrophobicContact CB-CD2 4.13Å; I14-L19 HydrophobicContact CB-CG 4.4Å; I14-L19 HydrophobicContact CG2-CD2 3.96Å; I14-L19 HydrophobicContact CG2-CG 4.04Å; I14-Y53 HydrophobicContact CD1-CD1 3.93Å; I14-Y53 HydrophobicContact CD1-CD2 4.46Å; I14-Y53 HydrophobicContact CD1-CE1 3.78Å; I14-Y53 HydrophobicContact CD1-CE2 4.3Å; I14-Y53 HydrophobicContact CD1-CG 4.28Å; I14-Y53 HydrophobicContact CG1-CD1 4.46Å; I14-Y53 HydrophobicContact CG1-CE1 3.82Å; I14-Y53 HydrophobicContact CG2-CE2 4.31Å; I14-T57 HydrophobicContact CD1-CG2 4.46Å; I14-L58 HydrophobicContact CD1-CD2 4.08Å; I14-Q61 HydrophobicContact CD1-CB 4.03Å; I14-Q61 HydrophobicContact CD1-CG 3.53Å; I14-Q61 HydrophobicContact CG1-CG 4.02Å
15	P	89.6	Confident	75.9	Confident	69 Å²	69	98.1 Å²	98.1	45%	0.448	50%	0.502	S	S	.	.			trans	-52.2	149.2	176.6	-27.8	34.8	0	0	0	112.2	E13 E17 H18 L19 Y53	E13-P15 WeakPolarHBondContact O-CD 3.46Å; P15-E17 PolarHBondContact O-N 3.01Å; P15-E17 VanDerWaalsContact O-N 3.15Å; P15-H18 WeakPolarHBondContact O-CB 3.32Å; P15-H18 PolarHBondContact O-N 3.02Å; P15-L19 PolarHBondContact O-N 2.9Å; P15-L19 VanDerWaalsContact O-N 3.11Å; P15-Y53 WeakPolarHBondContact CD-OH 3.42Å
16	L	87.8	Confident	78	Confident	114 Å²	114	91.8 Å²	91.8	60%	0.597	47%	0.468	S	S	*	.	H	α-helix	trans	-55.2	-37.4	-178.1	-177.9	63	0	0	0	112.5	H18 L19 K20	L16-H18 VanDerWaalsContact C-N 3.34Å; L16-H18 PolarHBondContact O-N 3.01Å; L16-L19 WeakPolarHBondContact O-CB 3.49Å; L16-L19 PolarHBondContact O-N 3.38Å; L16-K20 WeakPolarHBondContact O-CG 3.39Å; L16-K20 PolarHBondContact O-N 3.39Å
17	E	91.3	Very high	79.9	Confident	114 Å²	114	87.5 Å²	87.5	53%	0.533	45%	0.45	S	S	.	.	H	α-helix	trans	-62.4	-41.5	178.1	-62.6	-49	124.9	0	0	112.1	P15 L19 K20 E21	P15-E17 PolarHBondContact O-N 3.01Å; P15-E17 VanDerWaalsContact O-N 3.15Å; E17-L19 VanDerWaalsContact C-N 3.33Å; E17-L19 PolarHBondContact O-N 3.11Å; E17-K20 WeakPolarHBondContact O-CB 3.17Å; E17-K20 PolarHBondContact O-N 2.88Å; E17-K20 IonicContact OE1-NZ 2.76Å; E17-K20 PolarHBondContact OE1-NZ 3.02Å; E17-K20 IonicContact OE2-NZ 3.47Å; E17-K20 PolarHBondContact OE2-NZ 3.29Å; E17-E21 PolarHBondContact O-N 2.96Å
18	H	93	Very high	82.2	Confident	58 Å²	58	85 Å²	85	27%	0.269	43%	0.432	S	S	.	.	H	α-helix	trans	-68.3	-32.5	175.6	-66.5	176.1	0	0	0	111.8	I14 P15 L16 E21 L22 F50 Y53	I14-H18 HydrophobicContact CG2-CB 3.31Å; P15-H18 WeakPolarHBondContact O-CB 3.32Å; P15-H18 PolarHBondContact O-N 3.02Å; L16-H18 VanDerWaalsContact C-N 3.34Å; L16-H18 PolarHBondContact O-N 3.01Å; H18-E21 PolarHBondContact O-N 2.94Å; H18-L22 WeakPolarHBondContact O-CB 3.45Å; H18-L22 PolarHBondContact O-N 3.46Å; H18-F50 HydrophobicContact CB-CE2 3.72Å; H18-F50 HydrophobicContact CB-CZ 3.96Å; H18-F50 AromaticContact CG-CE2 3.91Å; H18-F50 WeakPolarHBondContact O-CZ 3.48Å; H18-Y53 HydrophobicContact CB-CE2 4.14Å; H18-Y53 AromaticContact CG-CE2 3.93Å; H18-Y53 AromaticContact ND1-CE2 3.28Å; H18-Y53 VanDerWaalsContact ND1-CE2 3.28Å; H18-Y53 WeakPolarHBondContact ND1-CE2 3.31Å; H18-Y53 AromaticContact ND1-CZ 3.56Å; H18-Y53 PolarHBondContact ND1-OH 3.13Å
19	L	91	Very high	84.4	Confident	36 Å²	36	78.9 Å²	78.9	19%	0.188	40%	0.402	C	S	.	.	H	α-helix	trans	-67.2	-36.8	173.1	-66.6	177.1	0	0	0	112.3	I14 P15 L16 E17 K23	I14-L19 HydrophobicContact CB-CD2 4.13Å; I14-L19 HydrophobicContact CB-CG 4.4Å; I14-L19 HydrophobicContact CG2-CD2 3.96Å; I14-L19 HydrophobicContact CG2-CG 4.04Å; P15-L19 PolarHBondContact O-N 2.9Å; P15-L19 VanDerWaalsContact O-N 3.11Å; L16-L19 WeakPolarHBondContact O-CB 3.49Å; L16-L19 PolarHBondContact O-N 3.38Å; E17-L19 VanDerWaalsContact C-N 3.33Å; E17-L19 PolarHBondContact O-N 3.11Å; L19-K23 PolarHBondContact O-N 3.44Å
20	K	93.8	Very high	86.4	Confident	110 Å²	110	80.3 Å²	80.3	48%	0.478	40%	0.395	S	S	.	.	H	α-helix	trans	-64.9	-44	172.9	-68.4	172	-176	164.3	0	110.9	L16 E17 K23 Q24	L16-K20 WeakPolarHBondContact O-CG 3.39Å; L16-K20 PolarHBondContact O-N 3.39Å; E17-K20 WeakPolarHBondContact O-CB 3.17Å; E17-K20 PolarHBondContact O-N 2.88Å; E17-K20 IonicContact OE1-NZ 2.76Å; E17-K20 PolarHBondContact OE1-NZ 3.02Å; E17-K20 IonicContact OE2-NZ 3.47Å; E17-K20 PolarHBondContact OE2-NZ 3.29Å; K20-K23 WeakPolarHBondContact O-CB 3.48Å; K20-K23 PolarHBondContact O-N 3.1Å; K20-Q24 PolarHBondContact O-N 2.93Å
21	E	95.1	Very high	88.2	Confident	80 Å²	80	81.4 Å²	81.4	37%	0.374	39%	0.39	S	S	.	.	H	α-helix	trans	-60.9	-45.4	175.5	-173.3	177	170.1	0	0	111.6	E17 H18 K23 Q24 K25 F50	E17-E21 PolarHBondContact O-N 2.96Å; H18-E21 PolarHBondContact O-N 2.94Å; E21-K23 VanDerWaalsContact C-N 3.33Å; E21-K23 PolarHBondContact O-N 3.06Å; E21-Q24 PolarHBondContact O-N 2.92Å; E21-Q24 VanDerWaalsContact O-N 3.1Å; E21-K25 HydrophobicContact CG-CD 4.49Å; E21-K25 PolarHBondContact O-N 3.49Å; E21-K25 WeakPolarHBondContact OE1-CE 3.28Å; E21-F50 HydrophobicContact CB-CE2 4.23Å; E21-F50 HydrophobicContact CB-CZ 4.3Å; E21-F50 HydrophobicContact CG-CD1 4.48Å; E21-F50 HydrophobicContact CG-CD2 4.18Å; E21-F50 HydrophobicContact CG-CE2 4.29Å; E21-F50 HydrophobicContact CG-CG 4.3Å; E21-F50 WeakPolarHBondContact OE1-CB 3.46Å; E21-F50 WeakPolarHBondContact OE1-CG 3.5Å; E21-F50 VanDerWaalsContact OE2-CD2 3.32Å; E21-F50 WeakPolarHBondContact OE2-CD2 3.35Å
22	L	94.3	Very high	89.7	Confident	1 Å²	1	81.9 Å²	81.9	1%	0.005	40%	0.396	C	S	.	.	H	α-helix	trans	-56.6	-46.3	175.3	177.1	58.7	0	0	0	111.7	H18 Q24 K25 I26 V48 F50 L58 W62	H18-L22 WeakPolarHBondContact O-CB 3.45Å; H18-L22 PolarHBondContact O-N 3.46Å; L22-Q24 VanDerWaalsContact C-N 3.31Å; L22-Q24 PolarHBondContact O-N 3.17Å; L22-K25 PolarHBondContact O-N 3.47Å; L22-I26 HydrophobicContact CD1-CD1 3.83Å; L22-I26 HydrophobicContact CD1-CG1 4.17Å; L22-I26 HydrophobicContact CG-CD1 3.96Å; L22-I26 WeakPolarHBondContact O-CB 3.34Å; L22-I26 VanDerWaalsContact O-CG1 3.29Å; L22-I26 WeakPolarHBondContact O-CG1 3.48Å; L22-I26 PolarHBondContact O-N 2.75Å; L22-V48 HydrophobicContact CD1-CB 4.44Å; L22-V48 HydrophobicContact CD1-CG2 4.01Å; L22-F50 HydrophobicContact CB-CE1 3.89Å; L22-F50 HydrophobicContact CB-CZ 4.19Å; L22-F50 HydrophobicContact CD1-CE1 4.31Å; L22-L58 HydrophobicContact CD1-CB 3.99Å; L22-L58 HydrophobicContact CD1-CD1 4.21Å; L22-L58 HydrophobicContact CD1-CD2 4.19Å; L22-L58 HydrophobicContact CD1-CG 4.35Å; L22-L58 HydrophobicContact CD2-CB 4.44Å; L22-L58 HydrophobicContact CD2-CD2 4.2Å; L22-W62 HydrophobicContact CD2-CB 4.36Å; L22-W62 HydrophobicContact CD2-CE3 4.32Å; L22-W62 HydrophobicContact CG-CE3 4.41Å
23	K	94.7	Very high	90.5	Very high	140 Å²	140	76 Å²	76	61%	0.609	37%	0.373	S	S	*	.	H	α-helix	trans	-58.6	-44.7	176.3	179.6	-167.5	170.3	-170.6	0	110.9	L19 K20 E21 I26 A27 W62	L19-K23 PolarHBondContact O-N 3.44Å; K20-K23 WeakPolarHBondContact O-CB 3.48Å; K20-K23 PolarHBondContact O-N 3.1Å; E21-K23 VanDerWaalsContact C-N 3.33Å; E21-K23 PolarHBondContact O-N 3.06Å; K23-I26 PolarHBondContact O-N 3.43Å; K23-A27 PolarHBondContact O-N 3.37Å; K23-W62 HydrophobicContact CB-CZ3 4.24Å; K23-W62 HydrophobicContact CG-CH2 4.46Å
24	Q	95.3	Very high	90.6	Very high	110 Å²	110	72.3 Å²	72.3	51%	0.514	37%	0.369	S	S	.	.	H	α-helix	trans	-63.6	-49.9	-179.6	-173.2	58.4	46.7	0	0	111.3	K20 E21 L22 I26 A27 D28	K20-Q24 PolarHBondContact O-N 2.93Å; E21-Q24 PolarHBondContact O-N 2.92Å; E21-Q24 VanDerWaalsContact O-N 3.1Å; L22-Q24 VanDerWaalsContact C-N 3.31Å; L22-Q24 PolarHBondContact O-N 3.17Å; Q24-I26 VanDerWaalsContact C-N 3.29Å; Q24-I26 PolarHBondContact O-N 3.44Å; Q24-A27 WeakPolarHBondContact O-CA 3.37Å; Q24-A27 WeakPolarHBondContact O-CB 3.43Å; Q24-A27 PolarHBondContact O-N 3.24Å; Q24-D28 PolarHBondContact NE2-OD1 3.36Å; Q24-D28 VanDerWaalsContact O-CG 3.28Å; Q24-D28 PolarHBondContact O-N 2.83Å
25	K	95.2	Very high	90.3	Very high	60 Å²	60	74.9 Å²	74.9	26%	0.261	40%	0.398	S	S	.	.	H	α-helix	trans	-59.3	-38.8	177.6	-71.7	-171.6	172.3	-133.1	0	112.7	E21 L22 A27 D28 V29 V48 T49 F50	E21-K25 HydrophobicContact CG-CD 4.49Å; E21-K25 PolarHBondContact O-N 3.49Å; E21-K25 WeakPolarHBondContact OE1-CE 3.28Å; L22-K25 PolarHBondContact O-N 3.47Å; K25-A27 VanDerWaalsContact C-N 3.34Å; K25-D28 PolarHBondContact O-N 3.44Å; K25-V29 WeakPolarHBondContact O-CG2 3.41Å; K25-V29 PolarHBondContact O-N 2.99Å; K25-V48 HydrophobicContact CB-CB 3.91Å; K25-V48 HydrophobicContact CB-CG1 4.04Å; K25-T49 PolarHBondContact NZ-O 2.69Å; K25-F50 HydrophobicContact CD-CB 4.23Å; K25-F50 HydrophobicContact CD-CD1 3.91Å; K25-F50 HydrophobicContact CD-CG 4.39Å
26	I	93.9	Very high	90	Very high	8 Å²	8	75.8 Å²	75.8	4%	0.041	41%	0.406	C	S	.	.	H	α-helix	trans	-63	-41.7	174.9	-73.3	172	0	0	0	111.2	L22 K23 Q24 F30 W40 F43 F45 V48 W62	L22-I26 HydrophobicContact CD1-CD1 3.83Å; L22-I26 HydrophobicContact CD1-CG1 4.17Å; L22-I26 HydrophobicContact CG-CD1 3.96Å; L22-I26 WeakPolarHBondContact O-CB 3.34Å; L22-I26 VanDerWaalsContact O-CG1 3.29Å; L22-I26 WeakPolarHBondContact O-CG1 3.48Å; L22-I26 PolarHBondContact O-N 2.75Å; K23-I26 PolarHBondContact O-N 3.43Å; Q24-I26 VanDerWaalsContact C-N 3.29Å; Q24-I26 PolarHBondContact O-N 3.44Å; I26-F30 VanDerWaalsContact O-CB 3.31Å; I26-F30 WeakPolarHBondContact O-CB 3.37Å; I26-F30 PolarHBondContact O-N 2.91Å; I26-W40 HydrophobicContact CG2-CH2 3.78Å; I26-W40 HydrophobicContact CG2-CZ3 3.89Å; I26-F43 HydrophobicContact CB-CZ 4.22Å; I26-F43 HydrophobicContact CG1-CE1 4.2Å; I26-F43 HydrophobicContact CG1-CZ 4.04Å; I26-F43 HydrophobicContact CG2-CE2 4.12Å; I26-F43 HydrophobicContact CG2-CZ 3.96Å; I26-F45 HydrophobicContact CD1-CE1 4.22Å; I26-F45 HydrophobicContact CD1-CZ 4.45Å; I26-V48 HydrophobicContact CG1-CB 4.42Å; I26-V48 HydrophobicContact CG1-CG1 3.99Å; I26-V48 HydrophobicContact CG1-CG2 4.37Å; I26-W62 HydrophobicContact CD1-CB 4.43Å; I26-W62 HydrophobicContact CD1-CD2 3.39Å; I26-W62 HydrophobicContact CD1-CE3 3.55Å; I26-W62 HydrophobicContact CD1-CG 3.8Å; I26-W62 HydrophobicContact CD1-CH2 4.19Å; I26-W62 HydrophobicContact CD1-CZ2 4.05Å; I26-W62 HydrophobicContact CD1-CZ3 3.94Å; I26-W62 HydrophobicContact CG2-CZ2 4.23Å
27	A	92.2	Very high	89.8	Confident	32 Å²	32	71.5 Å²	71.5	26%	0.264	38%	0.384	S	S	.	.	H	α-helix	trans	-62.3	-46.7	175.9	0	0	0	0	0	110.9	K23 Q24 K25 V29 F30 H31	K23-A27 PolarHBondContact O-N 3.37Å; Q24-A27 WeakPolarHBondContact O-CA 3.37Å; Q24-A27 WeakPolarHBondContact O-CB 3.43Å; Q24-A27 PolarHBondContact O-N 3.24Å; K25-A27 VanDerWaalsContact C-N 3.34Å; A27-V29 PolarHBondContact O-N 3.38Å; A27-F30 PolarHBondContact O-N 2.87Å; A27-F30 VanDerWaalsContact O-N 3.16Å; A27-H31 PolarHBondContact O-CD2 2.88Å; A27-H31 PolarHBondContact O-N 3.16Å
28	D	93.6	Very high	89.3	Confident	69 Å²	69	75 Å²	75	37%	0.369	40%	0.397	S	S	.	.	H	α-helix	trans	-60.5	-46.4	179.8	-59.7	-23.1	0	0	0	111.4	Q24 K25 F30 H31 N32	Q24-D28 PolarHBondContact NE2-OD1 3.36Å; Q24-D28 VanDerWaalsContact O-CG 3.28Å; Q24-D28 PolarHBondContact O-N 2.83Å; K25-D28 PolarHBondContact O-N 3.44Å; D28-F30 VanDerWaalsContact C-N 3.33Å; D28-F30 PolarHBondContact O-N 2.9Å; D28-H31 PolarHBondContact O-N 3.07Å; D28-N32 WeakPolarHBondContact O-CB 3.47Å; D28-N32 PolarHBondContact O-N 3.13Å; D28-N32 PolarHBondContact O-ND2 2.96Å; D28-N32 VanDerWaalsContact O-ND2 3.13Å
29	V	92	Very high	89	Confident	10 Å²	10	74.7 Å²	74.7	6%	0.061	40%	0.402	C	S	.	.	H	α-helix	trans	-62.7	-40	176.1	169	0	0	0	0	111.6	K25 A27 N33 I37 F43 P44 Q47 V48	K25-V29 WeakPolarHBondContact O-CG2 3.41Å; K25-V29 PolarHBondContact O-N 2.99Å; A27-V29 PolarHBondContact O-N 3.38Å; V29-N33 WeakPolarHBondContact O-CB 3.46Å; V29-N33 PolarHBondContact O-N 3.43Å; V29-N33 PolarHBondContact O-ND2 3.35Å; V29-I37 HydrophobicContact CG1-CD1 4.11Å; V29-F43 HydrophobicContact CB-CZ 3.89Å; V29-F43 HydrophobicContact CG1-CE1 4.25Å; V29-F43 HydrophobicContact CG1-CE2 3.99Å; V29-F43 HydrophobicContact CG1-CZ 3.59Å; V29-P44 HydrophobicContact CG1-CG 3.99Å; V29-Q47 HydrophobicContact CG1-CB 4.48Å; V29-Q47 HydrophobicContact CG2-CB 3.69Å; V29-V48 HydrophobicContact CB-CG1 4.2Å; V29-V48 HydrophobicContact CG2-CG1 3.64Å
30	F	89.6	Confident	88.9	Confident	102 Å²	102	78 Å²	78	45%	0.447	41%	0.412	S	S	.	.	H	α-helix	trans	-66.3	-40.9	177.8	-175.7	-102.4	0	0	0	112.2	I26 A27 D28 N33 A34	I26-F30 VanDerWaalsContact O-CB 3.31Å; I26-F30 WeakPolarHBondContact O-CB 3.37Å; I26-F30 PolarHBondContact O-N 2.91Å; A27-F30 PolarHBondContact O-N 2.87Å; A27-F30 VanDerWaalsContact O-N 3.16Å; D28-F30 VanDerWaalsContact C-N 3.33Å; D28-F30 PolarHBondContact O-N 2.9Å; F30-N33 CarbonylContact O-C 3.41Å; F30-N33 PolarHBondContact O-N 3.32Å; F30-A34 WeakPolarHBondContact O-CA 3.45Å; F30-A34 PolarHBondContact O-N 3.47Å
31	H	88.5	Confident	88.5	Confident	135 Å²	135	80 Å²	80	63%	0.625	43%	0.428	S	S	*	.	H	α-helix	trans	-66.4	-44.3	176	-74.5	-60.6	0	0	0	111.8	A27 D28 N33 A34	A27-H31 PolarHBondContact O-CD2 2.88Å; A27-H31 PolarHBondContact O-N 3.16Å; D28-H31 PolarHBondContact O-N 3.07Å; H31-N33 VanDerWaalsContact C-N 3.27Å; H31-N33 PolarHBondContact O-N 3.43Å; H31-A34 PolarHBondContact O-N 3.01Å
32	N	88.5	Confident	88.1	Confident	134 Å²	134	79.5 Å²	79.5	72%	0.717	43%	0.433	S	S	*	.	H	α-helix	trans	-67.9	-25.6	178.8	-68.4	-27.4	0	0	0	113.1	D28	D28-N32 WeakPolarHBondContact O-CB 3.47Å; D28-N32 PolarHBondContact O-N 3.13Å; D28-N32 PolarHBondContact O-ND2 2.96Å; D28-N32 VanDerWaalsContact O-ND2 3.13Å
33	N	83.5	Confident	87.9	Confident	49 Å²	49	79.6 Å²	79.6	26%	0.262	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.4	26.3	-179.6	-64.8	-88.7	0	0	0	113	V29 F30 H31 G35 S36 I37	V29-N33 WeakPolarHBondContact O-CB 3.46Å; V29-N33 PolarHBondContact O-N 3.43Å; V29-N33 PolarHBondContact O-ND2 3.35Å; F30-N33 CarbonylContact O-C 3.41Å; F30-N33 PolarHBondContact O-N 3.32Å; H31-N33 VanDerWaalsContact C-N 3.27Å; H31-N33 PolarHBondContact O-N 3.43Å; N33-G35 PolarHBondContact O-N 3.16Å; N33-G35 VanDerWaalsContact O-N 3.17Å; N33-S36 WeakPolarHBondContact O-CB 3.14Å; N33-S36 PolarHBondContact O-N 2.97Å; N33-I37 HydrophobicContact CB-CD1 3.73Å; N33-I37 HydrophobicContact CB-CG1 3.98Å
34	A	76.8	Confident	87.7	Confident	76 Å²	76	74.2 Å²	74.2	63%	0.628	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.9	123.3	-176.2	0	0	0	0	0	111.4	F30 H31	F30-A34 WeakPolarHBondContact O-CA 3.45Å; F30-A34 PolarHBondContact O-N 3.47Å; H31-A34 PolarHBondContact O-N 3.01Å
35	G	77.2	Confident	87.6	Confident	65 Å²	65	69.1 Å²	69.1	67%	0.67	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.6	-20.9	-179.4	0	0	0	0	0	116.2	N33	N33-G35 PolarHBondContact O-N 3.16Å; N33-G35 VanDerWaalsContact O-N 3.17Å
36	S	82.9	Confident	87.5	Confident	89 Å²	89	71.9 Å²	71.9	62%	0.622	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-43.3	175.3	-173.9	0	0	0	0	111.6	N33 K38	N33-S36 WeakPolarHBondContact O-CB 3.14Å; N33-S36 PolarHBondContact O-N 2.97Å; S36-K38 PolarHBondContact O-N 3.32Å
37	I	84.2	Confident	87.4	Confident	23 Å²	23	76.5 Å²	76.5	12%	0.118	42%	0.424	C	S	.	.			trans	-83.6	106.3	-177	-56.1	174.2	0	0	0	110	V29 N33 F43 P44	V29-I37 HydrophobicContact CG1-CD1 4.11Å; N33-I37 HydrophobicContact CB-CD1 3.73Å; N33-I37 HydrophobicContact CB-CG1 3.98Å; I37-F43 HydrophobicContact CD1-CD2 3.96Å; I37-F43 HydrophobicContact CD1-CE2 4.01Å; I37-F43 HydrophobicContact CG2-CD2 3.96Å; I37-P44 HydrophobicContact CD1-CG 4.38Å
38	K	80.9	Confident	87.4	Confident	188 Å²	188	75 Å²	75	82%	0.817	41%	0.411	S	S	*	.			trans	-101	-15.4	179.5	-63	178.9	-174.6	173.1	0	114	S36	S36-K38 PolarHBondContact O-N 3.32Å
39	S	86.2	Confident	87.4	Confident	52 Å²	52	74.3 Å²	74.3	36%	0.364	41%	0.41	S	S	.	.			trans	-150.2	151.4	-175.2	81.5	0	0	0	0	111.8	N41 S42 F43	S39-N41 PolarHBondContact O-N 3.5Å; S39-S42 PolarHBondContact O-N 3.18Å; S39-S42 PolarHBondContact O-OG 3.08Å; S39-S42 PolarHBondContact OG-N 2.9Å; S39-S42 PolarHBondContact OG-OG 2.97Å; S39-F43 PolarHBondContact O-N 3.35Å
40	W	87.6	Confident	87.4	Confident	105 Å²	105	74.6 Å²	74.6	40%	0.398	41%	0.41	S	S	.	.	G	3₁₀ helix	trans	-66.3	-24.4	173.9	-70	105.8	0	0	0	113.4	I26 S42 F43 W62 K66	I26-W40 HydrophobicContact CG2-CH2 3.78Å; I26-W40 HydrophobicContact CG2-CZ3 3.89Å; W40-S42 VanDerWaalsContact C-N 3.27Å; W40-S42 PolarHBondContact O-N 3.35Å; W40-F43 HydrophobicContact CE3-CB 4.21Å; W40-F43 HydrophobicContact CE3-CD2 4.08Å; W40-F43 HydrophobicContact CE3-CG 4.17Å; W40-F43 AromaticContact CZ3-CD2 3.82Å; W40-F43 HydrophobicContact CZ3-CD2 3.82Å; W40-F43 HydrophobicContact CZ3-CE2 4.13Å; W40-F43 HydrophobicContact CZ3-CG 4.21Å; W40-F43 WeakPolarHBondContact O-CB 3.41Å; W40-F43 PolarHBondContact O-N 2.95Å; W40-W62 AromaticContact CE3-NE1 3.59Å; W40-W62 AromaticContact CH2-CE2 3.89Å; W40-W62 AromaticContact CH2-CZ2 3.87Å; W40-W62 HydrophobicContact CH2-CZ2 3.87Å; W40-W62 AromaticContact CH2-NE1 3.35Å; W40-W62 VanDerWaalsContact CH2-NE1 3.35Å; W40-W62 HydrophobicContact CZ2-CZ2 4.37Å; W40-W62 AromaticContact CZ2-NE1 3.84Å; W40-W62 AromaticContact CZ3-CD1 3.97Å; W40-W62 HydrophobicContact CZ3-CZ2 4.46Å; W40-W62 AromaticContact CZ3-NE1 3.21Å; W40-K66 VanDerWaalsContact NE1-NZ 3.18Å
41	N	86	Confident	87.3	Confident	152 Å²	152	73.2 Å²	73.2	81%	0.813	42%	0.418	S	S	*	.	G	3₁₀ helix	trans	-69	-29.8	176.6	-68.1	-5.2	0	0	0	111.9	S39	S39-N41 PolarHBondContact O-N 3.5Å
42	S	86.6	Confident	87.3	Confident	69 Å²	69	74.6 Å²	74.6	48%	0.483	43%	0.43	S	S	.	.	G	3₁₀ helix	trans	-98.6	9.4	177.8	63.3	0	0	0	0	113	S39 W40	S39-S42 PolarHBondContact O-N 3.18Å; S39-S42 PolarHBondContact O-OG 3.08Å; S39-S42 PolarHBondContact OG-N 2.9Å; S39-S42 PolarHBondContact OG-OG 2.97Å; W40-S42 VanDerWaalsContact C-N 3.27Å; W40-S42 PolarHBondContact O-N 3.35Å
43	F	91.4	Very high	87.5	Confident	3 Å²	3	70.5 Å²	70.5	1%	0.013	41%	0.405	C	S	.	.			trans	-72.8	129.9	179.5	-172.4	-82.2	0	0	0	109.8	I26 V29 I37 S39 W40 F45 V48 R59	I26-F43 HydrophobicContact CB-CZ 4.22Å; I26-F43 HydrophobicContact CG1-CE1 4.2Å; I26-F43 HydrophobicContact CG1-CZ 4.04Å; I26-F43 HydrophobicContact CG2-CE2 4.12Å; I26-F43 HydrophobicContact CG2-CZ 3.96Å; V29-F43 HydrophobicContact CB-CZ 3.89Å; V29-F43 HydrophobicContact CG1-CE1 4.25Å; V29-F43 HydrophobicContact CG1-CE2 3.99Å; V29-F43 HydrophobicContact CG1-CZ 3.59Å; I37-F43 HydrophobicContact CD1-CD2 3.96Å; I37-F43 HydrophobicContact CD1-CE2 4.01Å; I37-F43 HydrophobicContact CG2-CD2 3.96Å; S39-F43 PolarHBondContact O-N 3.35Å; W40-F43 HydrophobicContact CE3-CB 4.21Å; W40-F43 HydrophobicContact CE3-CD2 4.08Å; W40-F43 HydrophobicContact CE3-CG 4.17Å; W40-F43 AromaticContact CZ3-CD2 3.82Å; W40-F43 HydrophobicContact CZ3-CD2 3.82Å; W40-F43 HydrophobicContact CZ3-CE2 4.13Å; W40-F43 HydrophobicContact CZ3-CG 4.21Å; W40-F43 WeakPolarHBondContact O-CB 3.41Å; W40-F43 PolarHBondContact O-N 2.95Å; F43-F45 HydrophobicContact CB-CD2 4.24Å; F43-F45 HydrophobicContact CB-CE2 4.06Å; F43-F45 AromaticContact CD1-CD2 3.49Å; F43-F45 HydrophobicContact CD1-CD2 3.49Å; F43-F45 VanDerWaalsContact CD1-CD2 3.49Å; F43-F45 AromaticContact CD1-CE2 3.56Å; F43-F45 HydrophobicContact CD1-CE2 3.56Å; F43-F45 HydrophobicContact CD1-CG 4.04Å; F43-F45 HydrophobicContact CD1-CZ 4.15Å; F43-F45 HydrophobicContact CE1-CD2 4.34Å; F43-F45 HydrophobicContact CE1-CE2 4.39Å; F43-F45 HydrophobicContact CG-CD2 4.29Å; F43-F45 HydrophobicContact CG-CE2 4.1Å; F43-F45 PolarHBondContact O-N 3.18Å; F43-V48 HydrophobicContact CE1-CG1 3.77Å; F43-V48 HydrophobicContact CE1-CG2 4.35Å; F43-V48 HydrophobicContact CZ-CG1 4.01Å; F43-R59 PolarHBondContact O-NH2 2.92Å
44	P	90.3	Very high	87.9	Confident	27 Å²	27	72 Å²	72	18%	0.175	42%	0.416	C	S	.	.			trans	-79.4	85.6	-178.9	32.7	-33.7	0	0	0	110.4	V29 I37 E46 Q47	V29-P44 HydrophobicContact CG1-CG 3.99Å; I37-P44 HydrophobicContact CD1-CG 4.38Å; P44-E46 VanDerWaalsContact CA-OE2 3.24Å; P44-E46 WeakPolarHBondContact CA-OE2 3.31Å; P44-E46 PolarHBondContact O-N 3.17Å; P44-Q47 HydrophobicContact CB-CG 4.21Å; P44-Q47 HydrophobicContact CG-CG 4.39Å; P44-Q47 PolarHBondContact O-N 3.1Å; P44-Q47 VanDerWaalsContact O-N 3.14Å
45	F	92.6	Very high	88.7	Confident	4 Å²	4	69.1 Å²	69.1	2%	0.018	39%	0.392	C	S	.	.	G	3₁₀ helix	trans	-66.4	-15.7	179.9	-90.8	-91.7	0	0	0	112.9	I26 F43 Q47 V48 A55 L58 R59 W62	I26-F45 HydrophobicContact CD1-CE1 4.22Å; I26-F45 HydrophobicContact CD1-CZ 4.45Å; F43-F45 HydrophobicContact CB-CD2 4.24Å; F43-F45 HydrophobicContact CB-CE2 4.06Å; F43-F45 AromaticContact CD1-CD2 3.49Å; F43-F45 HydrophobicContact CD1-CD2 3.49Å; F43-F45 VanDerWaalsContact CD1-CD2 3.49Å; F43-F45 AromaticContact CD1-CE2 3.56Å; F43-F45 HydrophobicContact CD1-CE2 3.56Å; F43-F45 HydrophobicContact CD1-CG 4.04Å; F43-F45 HydrophobicContact CD1-CZ 4.15Å; F43-F45 HydrophobicContact CE1-CD2 4.34Å; F43-F45 HydrophobicContact CE1-CE2 4.39Å; F43-F45 HydrophobicContact CG-CD2 4.29Å; F43-F45 HydrophobicContact CG-CE2 4.1Å; F43-F45 PolarHBondContact O-N 3.18Å; F45-Q47 PolarHBondContact O-N 3.05Å; F45-V48 HydrophobicContact CB-CG2 4.34Å; F45-V48 HydrophobicContact CD1-CG2 3.58Å; F45-V48 HydrophobicContact CE1-CG2 4.19Å; F45-V48 HydrophobicContact CG-CG2 4.23Å; F45-V48 VanDerWaalsContact O-CG2 3.29Å; F45-V48 WeakPolarHBondContact O-CG2 3.29Å; F45-V48 PolarHBondContact O-N 3.23Å; F45-V48 VanDerWaalsContact O-N 3.16Å; F45-A55 HydrophobicContact CB-CB 4.01Å; F45-L58 HydrophobicContact CD1-CB 4.19Å; F45-R59 HydrophobicContact CD1-CB 3.93Å; F45-R59 HydrophobicContact CD2-CB 4Å; F45-R59 HydrophobicContact CD2-CG 3.93Å; F45-R59 VanDerWaalsContact CD2-CZ 3.49Å; F45-R59 VanDerWaalsContact CE1-CA 3.47Å; F45-R59 HydrophobicContact CE1-CB 4.11Å; F45-R59 HydrophobicContact CE2-CB 4.17Å; F45-R59 HydrophobicContact CE2-CG 3.89Å; F45-R59 HydrophobicContact CG-CB 3.88Å; F45-R59 HydrophobicContact CG-CG 4.33Å; F45-R59 HydrophobicContact CZ-CB 4.23Å; F45-R59 HydrophobicContact CZ-CG 4.27Å; F45-W62 HydrophobicContact CE1-CB 4.03Å; F45-W62 HydrophobicContact CE1-CG 4.44Å; F45-W62 HydrophobicContact CZ-CB 3.97Å; F45-W62 AromaticContact CZ-CD1 3.82Å; F45-W62 HydrophobicContact CZ-CG 4.09Å
46	E	92.7	Very high	89.4	Confident	118 Å²	118	71.5 Å²	71.5	55%	0.551	39%	0.389	S	S	*	.	G	3₁₀ helix	trans	-62.6	-25.9	174	-58	72.4	-156.7	0	0	111.7	P44 T49 A55	P44-E46 VanDerWaalsContact CA-OE2 3.24Å; P44-E46 WeakPolarHBondContact CA-OE2 3.31Å; P44-E46 PolarHBondContact O-N 3.17Å; E46-T49 PolarHBondContact O-OG1 2.98Å; E46-A55 HydrophobicContact CG-CB 4.47Å
47	Q	91.9	Very high	89.8	Confident	104 Å²	104	69.8 Å²	69.8	49%	0.486	38%	0.375	S	S	.	.	G	3₁₀ helix	trans	-85.6	-11.9	178.1	-62.9	179.7	17.2	0	0	113.4	V29 P44 F45	V29-Q47 HydrophobicContact CG1-CB 4.48Å; V29-Q47 HydrophobicContact CG2-CB 3.69Å; P44-Q47 HydrophobicContact CB-CG 4.21Å; P44-Q47 HydrophobicContact CG-CG 4.39Å; P44-Q47 PolarHBondContact O-N 3.1Å; P44-Q47 VanDerWaalsContact O-N 3.14Å; F45-Q47 PolarHBondContact O-N 3.05Å
48	V	92.7	Very high	90.2	Very high	0 Å²	0	68.7 Å²	68.7	0%	0	37%	0.37	C	S	.	.	S	Bend	trans	-109.2	10.7	-178	-54.2	0	0	0	0	112.9	L22 K25 I26 V29 F43 F45 F50 L58	L22-V48 HydrophobicContact CD1-CB 4.44Å; L22-V48 HydrophobicContact CD1-CG2 4.01Å; K25-V48 HydrophobicContact CB-CB 3.91Å; K25-V48 HydrophobicContact CB-CG1 4.04Å; I26-V48 HydrophobicContact CG1-CB 4.42Å; I26-V48 HydrophobicContact CG1-CG1 3.99Å; I26-V48 HydrophobicContact CG1-CG2 4.37Å; V29-V48 HydrophobicContact CB-CG1 4.2Å; V29-V48 HydrophobicContact CG2-CG1 3.64Å; F43-V48 HydrophobicContact CE1-CG1 3.77Å; F43-V48 HydrophobicContact CE1-CG2 4.35Å; F43-V48 HydrophobicContact CZ-CG1 4.01Å; F45-V48 HydrophobicContact CB-CG2 4.34Å; F45-V48 HydrophobicContact CD1-CG2 3.58Å; F45-V48 HydrophobicContact CE1-CG2 4.19Å; F45-V48 HydrophobicContact CG-CG2 4.23Å; F45-V48 VanDerWaalsContact O-CG2 3.29Å; F45-V48 WeakPolarHBondContact O-CG2 3.29Å; F45-V48 PolarHBondContact O-N 3.23Å; F45-V48 VanDerWaalsContact O-N 3.16Å; V48-F50 WeakPolarHBondContact O-CD1 3.46Å; V48-L58 VanDerWaalsContact O-CD1 3.31Å; V48-L58 WeakPolarHBondContact O-CD1 3.38Å
49	T	93	Very high	90.7	Very high	56 Å²	56	62.5 Å²	62.5	34%	0.344	34%	0.341	S	S	.	.			trans	-67.4	146.1	176.4	54.7	0	0	0	0	111.4	K25 E46 A55 L58	K25-T49 PolarHBondContact NZ-O 2.69Å; E46-T49 PolarHBondContact O-OG1 2.98Å; T49-A55 HydrophobicContact CG2-CB 3.92Å; T49-L58 HydrophobicContact CG2-CD1 4.41Å
50	F	91.9	Very high	91	Very high	15 Å²	15	62.9 Å²	62.9	7%	0.066	34%	0.337	C	S	.	.	B	Isolated β-bridge	trans	-160.9	161.9	177.2	65	-82.7	0	0	0	109.8	H18 E21 L22 K25 V48 D52 Y53 L58	H18-F50 HydrophobicContact CB-CE2 3.72Å; H18-F50 HydrophobicContact CB-CZ 3.96Å; H18-F50 AromaticContact CG-CE2 3.91Å; H18-F50 WeakPolarHBondContact O-CZ 3.48Å; E21-F50 HydrophobicContact CB-CE2 4.23Å; E21-F50 HydrophobicContact CB-CZ 4.3Å; E21-F50 HydrophobicContact CG-CD1 4.48Å; E21-F50 HydrophobicContact CG-CD2 4.18Å; E21-F50 HydrophobicContact CG-CE2 4.29Å; E21-F50 HydrophobicContact CG-CG 4.3Å; E21-F50 WeakPolarHBondContact OE1-CB 3.46Å; E21-F50 WeakPolarHBondContact OE1-CG 3.5Å; E21-F50 VanDerWaalsContact OE2-CD2 3.32Å; E21-F50 WeakPolarHBondContact OE2-CD2 3.35Å; L22-F50 HydrophobicContact CB-CE1 3.89Å; L22-F50 HydrophobicContact CB-CZ 4.19Å; L22-F50 HydrophobicContact CD1-CE1 4.31Å; K25-F50 HydrophobicContact CD-CB 4.23Å; K25-F50 HydrophobicContact CD-CD1 3.91Å; K25-F50 HydrophobicContact CD-CG 4.39Å; V48-F50 WeakPolarHBondContact O-CD1 3.46Å; F50-D52 PolarHBondContact O-N 3.29Å; F50-Y53 HydrophobicContact CD2-CD2 4.36Å; F50-Y53 AromaticContact CE2-CD2 3.91Å; F50-Y53 HydrophobicContact CE2-CD2 3.91Å; F50-Y53 HydrophobicContact CE2-CE2 4.02Å; F50-Y53 HydrophobicContact CZ-CD2 4.07Å; F50-Y53 HydrophobicContact CZ-CE2 4.36Å; F50-Y53 PolarHBondContact O-N 3.43Å; F50-Y53 VanDerWaalsContact O-N 3.17Å; F50-L58 HydrophobicContact CD1-CD1 3.98Å; F50-L58 HydrophobicContact CE1-CD1 3.89Å; F50-L58 HydrophobicContact CE1-CD2 3.74Å; F50-L58 HydrophobicContact CE1-CG 4.49Å; F50-L58 HydrophobicContact CZ-CD2 4.08Å
51	A	88	Confident	91.1	Very high	73 Å²	73	59.4 Å²	59.4	60%	0.603	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.6	-135.5	-170.7	0	0	0	0	0	110.2	Y53	A51-Y53 HydrophobicContact CB-CD2 4.28Å; A51-Y53 HydrophobicContact CB-CE2 4.42Å
52	D	89	Confident	91.5	Very high	165 Å²	165	53.9 Å²	53.9	88%	0.882	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.2	16.6	178.8	-55.2	-44.8	0	0	0	112.9	F50	F50-D52 PolarHBondContact O-N 3.29Å
53	Y	92	Very high	91.7	Very high	48 Å²	48	57 Å²	57	19%	0.188	29%	0.294	C	S	.	.	B	Isolated β-bridge	trans	-86.5	126	-179.2	-59.5	-63.1	0	0	0	112.1	I14 P15 H18 F50 A51 T57 L58	I14-Y53 HydrophobicContact CD1-CD1 3.93Å; I14-Y53 HydrophobicContact CD1-CD2 4.46Å; I14-Y53 HydrophobicContact CD1-CE1 3.78Å; I14-Y53 HydrophobicContact CD1-CE2 4.3Å; I14-Y53 HydrophobicContact CD1-CG 4.28Å; I14-Y53 HydrophobicContact CG1-CD1 4.46Å; I14-Y53 HydrophobicContact CG1-CE1 3.82Å; I14-Y53 HydrophobicContact CG2-CE2 4.31Å; P15-Y53 WeakPolarHBondContact CD-OH 3.42Å; H18-Y53 HydrophobicContact CB-CE2 4.14Å; H18-Y53 AromaticContact CG-CE2 3.93Å; H18-Y53 AromaticContact ND1-CE2 3.28Å; H18-Y53 VanDerWaalsContact ND1-CE2 3.28Å; H18-Y53 WeakPolarHBondContact ND1-CE2 3.31Å; H18-Y53 AromaticContact ND1-CZ 3.56Å; H18-Y53 PolarHBondContact ND1-OH 3.13Å; F50-Y53 HydrophobicContact CD2-CD2 4.36Å; F50-Y53 AromaticContact CE2-CD2 3.91Å; F50-Y53 HydrophobicContact CE2-CD2 3.91Å; F50-Y53 HydrophobicContact CE2-CE2 4.02Å; F50-Y53 HydrophobicContact CZ-CD2 4.07Å; F50-Y53 HydrophobicContact CZ-CE2 4.36Å; F50-Y53 PolarHBondContact O-N 3.43Å; F50-Y53 VanDerWaalsContact O-N 3.17Å; A51-Y53 HydrophobicContact CB-CD2 4.28Å; A51-Y53 HydrophobicContact CB-CE2 4.42Å; Y53-T57 HydrophobicContact CD1-CG2 4.19Å; Y53-L58 HydrophobicContact CD2-CD2 4.11Å; Y53-L58 HydrophobicContact CG-CD2 3.99Å
54	T	92.9	Very high	91.6	Very high	80 Å²	80	61.5 Å²	61.5	49%	0.491	31%	0.311	S	S	.	.			trans	-71	155	171.6	63	0	0	0	0	111.5	D56 T57 L58	T54-D56 PolarHBondContact O-N 3.05Å; T54-T57 WeakPolarHBondContact O-CB 3.33Å; T54-T57 PolarHBondContact O-N 3.26Å; T54-T57 PolarHBondContact OG1-N 2.85Å; T54-T57 PolarHBondContact OG1-OG1 3.27Å; T54-L58 PolarHBondContact O-N 3.23Å; T54-L58 VanDerWaalsContact O-N 3.08Å
55	A	92.3	Very high	91.6	Very high	15 Å²	15	63.1 Å²	63.1	12%	0.124	32%	0.318	C	S	.	.	H	α-helix	trans	-54.6	-38.3	177.1	0	0	0	0	0	112.4	F45 E46 T49 L58 R59	F45-A55 HydrophobicContact CB-CB 4.01Å; E46-A55 HydrophobicContact CG-CB 4.47Å; T49-A55 HydrophobicContact CG2-CB 3.92Å; A55-L58 PolarHBondContact O-N 3.03Å; A55-R59 VanDerWaalsContact O-CB 3.27Å; A55-R59 WeakPolarHBondContact O-CB 3.35Å; A55-R59 PolarHBondContact O-N 3.47Å
56	D	91.7	Very high	91.4	Very high	115 Å²	115	66.8 Å²	66.8	62%	0.615	33%	0.334	S	S	*	.	H	α-helix	trans	-66.4	-40.9	177.6	-67	-39.5	0	0	0	112.5	T54 R59 E60	T54-D56 PolarHBondContact O-N 3.05Å; D56-R59 PolarHBondContact O-N 3.45Å; D56-E60 PolarHBondContact O-N 3.38Å
57	T	91.4	Very high	91.2	Very high	54 Å²	54	63.8 Å²	63.8	33%	0.331	33%	0.326	S	S	.	.	H	α-helix	trans	-62.2	-46.7	176.6	-55.3	0	0	0	0	110.3	I14 Y53 T54 R59 E60 Q61	I14-T57 HydrophobicContact CD1-CG2 4.46Å; Y53-T57 HydrophobicContact CD1-CG2 4.19Å; T54-T57 WeakPolarHBondContact O-CB 3.33Å; T54-T57 PolarHBondContact O-N 3.26Å; T54-T57 PolarHBondContact OG1-N 2.85Å; T54-T57 PolarHBondContact OG1-OG1 3.27Å; T57-R59 PolarHBondContact O-N 2.89Å; T57-E60 PolarHBondContact O-N 2.89Å; T57-Q61 HydrophobicContact CG2-CG 4.47Å; T57-Q61 WeakPolarHBondContact O-CB 3.27Å; T57-Q61 WeakPolarHBondContact O-CG 3.4Å; T57-Q61 PolarHBondContact O-N 3.49Å
58	L	92.3	Very high	91	Very high	0 Å²	0	64.5 Å²	64.5	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-67.4	-36.1	178.6	-63.7	177.9	0	0	0	112.4	I14 L22 F45 V48 T49 F50 Y53 T54 A55 Q61 W62	I14-L58 HydrophobicContact CD1-CD2 4.08Å; L22-L58 HydrophobicContact CD1-CB 3.99Å; L22-L58 HydrophobicContact CD1-CD1 4.21Å; L22-L58 HydrophobicContact CD1-CD2 4.19Å; L22-L58 HydrophobicContact CD1-CG 4.35Å; L22-L58 HydrophobicContact CD2-CB 4.44Å; L22-L58 HydrophobicContact CD2-CD2 4.2Å; F45-L58 HydrophobicContact CD1-CB 4.19Å; V48-L58 VanDerWaalsContact O-CD1 3.31Å; V48-L58 WeakPolarHBondContact O-CD1 3.38Å; T49-L58 HydrophobicContact CG2-CD1 4.41Å; F50-L58 HydrophobicContact CD1-CD1 3.98Å; F50-L58 HydrophobicContact CE1-CD1 3.89Å; F50-L58 HydrophobicContact CE1-CD2 3.74Å; F50-L58 HydrophobicContact CE1-CG 4.49Å; F50-L58 HydrophobicContact CZ-CD2 4.08Å; Y53-L58 HydrophobicContact CD2-CD2 4.11Å; Y53-L58 HydrophobicContact CG-CD2 3.99Å; T54-L58 PolarHBondContact O-N 3.23Å; T54-L58 VanDerWaalsContact O-N 3.08Å; A55-L58 PolarHBondContact O-N 3.03Å; L58-Q61 PolarHBondContact O-N 3.3Å; L58-W62 VanDerWaalsContact O-CB 3.31Å; L58-W62 WeakPolarHBondContact O-CB 3.5Å; L58-W62 PolarHBondContact O-N 2.84Å
59	R	92	Very high	90.7	Very high	57 Å²	57	66.7 Å²	66.7	22%	0.215	35%	0.346	C	S	.	.	H	α-helix	trans	-61.7	-44.9	174.6	-175.3	-172	-63.4	-85.9	2.2	111.6	F43 F45 A55 D56 T57 R63	F43-R59 PolarHBondContact O-NH2 2.92Å; F45-R59 HydrophobicContact CD1-CB 3.93Å; F45-R59 HydrophobicContact CD2-CB 4Å; F45-R59 HydrophobicContact CD2-CG 3.93Å; F45-R59 VanDerWaalsContact CD2-CZ 3.49Å; F45-R59 VanDerWaalsContact CE1-CA 3.47Å; F45-R59 HydrophobicContact CE1-CB 4.11Å; F45-R59 HydrophobicContact CE2-CB 4.17Å; F45-R59 HydrophobicContact CE2-CG 3.89Å; F45-R59 HydrophobicContact CG-CB 3.88Å; F45-R59 HydrophobicContact CG-CG 4.33Å; F45-R59 HydrophobicContact CZ-CB 4.23Å; F45-R59 HydrophobicContact CZ-CG 4.27Å; A55-R59 VanDerWaalsContact O-CB 3.27Å; A55-R59 WeakPolarHBondContact O-CB 3.35Å; A55-R59 PolarHBondContact O-N 3.47Å; D56-R59 PolarHBondContact O-N 3.45Å; T57-R59 PolarHBondContact O-N 2.89Å; R59-R63 WeakPolarHBondContact O-CB 3.29Å; R59-R63 PolarHBondContact O-N 3.05Å
60	E	91.7	Very high	90.2	Very high	61 Å²	61	68.3 Å²	68.3	29%	0.285	35%	0.349	S	S	.	.	H	α-helix	trans	-65.7	-45.1	176.9	-178.8	54.6	-147.6	0	0	111.2	D56 T57 W62 R63 R64	D56-E60 PolarHBondContact O-N 3.38Å; T57-E60 PolarHBondContact O-N 2.89Å; E60-W62 PolarHBondContact O-N 3.24Å; E60-R63 WeakPolarHBondContact O-CB 3.42Å; E60-R63 PolarHBondContact O-N 3.11Å; E60-R63 VanDerWaalsContact O-N 3.11Å; E60-R63 IonicContact OE2-CZ 3.24Å; E60-R63 IonicContact OE2-NE 2.84Å; E60-R63 IonicContact OE2-NH1 3.22Å; E60-R63 PolarHBondContact OE2-NH1 3.44Å; E60-R63 IonicContact OE2-NH2 3.95Å; E60-R64 WeakPolarHBondContact O-CG 3.37Å; E60-R64 PolarHBondContact O-N 2.85Å; E60-R64 IonicContact OE1-NE 3.58Å; E60-R64 PolarHBondContact OE1-NE 2.96Å
61	Q	90.9	Very high	89.8	Confident	31 Å²	31	76.2 Å²	76.2	15%	0.145	38%	0.379	C	S	.	.	H	α-helix	trans	-64.8	-39.8	179.8	-69	-75.7	-6.1	0	0	112	K12 I14 T57 L58 R63 R64 L65	K12-Q61 PolarHBondContact O-NE2 3.48Å; I14-Q61 HydrophobicContact CD1-CB 4.03Å; I14-Q61 HydrophobicContact CD1-CG 3.53Å; I14-Q61 HydrophobicContact CG1-CG 4.02Å; T57-Q61 HydrophobicContact CG2-CG 4.47Å; T57-Q61 WeakPolarHBondContact O-CB 3.27Å; T57-Q61 WeakPolarHBondContact O-CG 3.4Å; T57-Q61 PolarHBondContact O-N 3.49Å; L58-Q61 PolarHBondContact O-N 3.3Å; Q61-R63 VanDerWaalsContact C-N 3.35Å; Q61-R63 PolarHBondContact O-N 2.93Å; Q61-R64 PolarHBondContact O-N 3.41Å; Q61-L65 WeakPolarHBondContact O-CB 3.36Å; Q61-L65 PolarHBondContact O-N 2.98Å
62	W	93.3	Very high	89.6	Confident	37 Å²	37	80.6 Å²	80.6	14%	0.14	39%	0.386	C	S	.	.	H	α-helix	trans	-62.8	-40.6	171.7	-172.7	-116.1	0	0	0	112.4	L22 K23 I26 W40 F45 L58 E60 R64 L65 K66	L22-W62 HydrophobicContact CD2-CB 4.36Å; L22-W62 HydrophobicContact CD2-CE3 4.32Å; L22-W62 HydrophobicContact CG-CE3 4.41Å; K23-W62 HydrophobicContact CB-CZ3 4.24Å; K23-W62 HydrophobicContact CG-CH2 4.46Å; I26-W62 HydrophobicContact CD1-CB 4.43Å; I26-W62 HydrophobicContact CD1-CD2 3.39Å; I26-W62 HydrophobicContact CD1-CE3 3.55Å; I26-W62 HydrophobicContact CD1-CG 3.8Å; I26-W62 HydrophobicContact CD1-CH2 4.19Å; I26-W62 HydrophobicContact CD1-CZ2 4.05Å; I26-W62 HydrophobicContact CD1-CZ3 3.94Å; I26-W62 HydrophobicContact CG2-CZ2 4.23Å; W40-W62 AromaticContact CE3-NE1 3.59Å; W40-W62 AromaticContact CH2-CE2 3.89Å; W40-W62 AromaticContact CH2-CZ2 3.87Å; W40-W62 HydrophobicContact CH2-CZ2 3.87Å; W40-W62 AromaticContact CH2-NE1 3.35Å; W40-W62 VanDerWaalsContact CH2-NE1 3.35Å; W40-W62 HydrophobicContact CZ2-CZ2 4.37Å; W40-W62 AromaticContact CZ2-NE1 3.84Å; W40-W62 AromaticContact CZ3-CD1 3.97Å; W40-W62 HydrophobicContact CZ3-CZ2 4.46Å; W40-W62 AromaticContact CZ3-NE1 3.21Å; F45-W62 HydrophobicContact CE1-CB 4.03Å; F45-W62 HydrophobicContact CE1-CG 4.44Å; F45-W62 HydrophobicContact CZ-CB 3.97Å; F45-W62 AromaticContact CZ-CD1 3.82Å; F45-W62 HydrophobicContact CZ-CG 4.09Å; L58-W62 VanDerWaalsContact O-CB 3.31Å; L58-W62 WeakPolarHBondContact O-CB 3.5Å; L58-W62 PolarHBondContact O-N 2.84Å; E60-W62 PolarHBondContact O-N 3.24Å; W62-R64 VanDerWaalsContact C-N 3.34Å; W62-R64 PolarHBondContact O-N 2.75Å; W62-L65 HydrophobicContact CE3-CD2 3.9Å; W62-L65 HydrophobicContact CZ3-CD2 3.76Å; W62-L65 PolarHBondContact O-N 3.5Å; W62-K66 HydrophobicContact CG-CD 4.44Å; W62-K66 WeakPolarHBondContact O-CB 3.44Å; W62-K66 WeakPolarHBondContact O-CG 3.42Å; W62-K66 PolarHBondContact O-N 2.89Å
63	R	91.3	Very high	89.4	Confident	135 Å²	135	74.8 Å²	74.8	51%	0.509	36%	0.358	S	S	.	.	H	α-helix	trans	-60.6	-44.9	175.4	-168.4	-170.8	-57.8	144.1	12.2	111	R59 E60 Q61 K66 S67	R59-R63 WeakPolarHBondContact O-CB 3.29Å; R59-R63 PolarHBondContact O-N 3.05Å; E60-R63 WeakPolarHBondContact O-CB 3.42Å; E60-R63 PolarHBondContact O-N 3.11Å; E60-R63 VanDerWaalsContact O-N 3.11Å; E60-R63 IonicContact OE2-CZ 3.24Å; E60-R63 IonicContact OE2-NE 2.84Å; E60-R63 IonicContact OE2-NH1 3.22Å; E60-R63 PolarHBondContact OE2-NH1 3.44Å; E60-R63 IonicContact OE2-NH2 3.95Å; Q61-R63 VanDerWaalsContact C-N 3.35Å; Q61-R63 PolarHBondContact O-N 2.93Å; R63-K66 PolarHBondContact O-N 3.45Å; R63-S67 PolarHBondContact O-N 3.22Å; R63-S67 PolarHBondContact O-OG 2.8Å; R63-S67 VanDerWaalsContact O-OG 3.13Å
64	R	90.3	Very high	89.2	Confident	96 Å²	96	76 Å²	76	36%	0.362	37%	0.371	S	S	.	.	H	α-helix	trans	-62.6	-46.3	176.4	-68.7	175.8	-179.5	-148.4	-2.7	111.8	E11 E60 Q61 W62 K66 S67 K68	E11-R64 IonicContact OE1-CZ 2.95Å; E11-R64 IonicContact OE1-NH1 3.65Å; E11-R64 PolarHBondContact OE1-NH1 3.37Å; E11-R64 IonicContact OE1-NH2 3.18Å; E60-R64 WeakPolarHBondContact O-CG 3.37Å; E60-R64 PolarHBondContact O-N 2.85Å; E60-R64 IonicContact OE1-NE 3.58Å; E60-R64 PolarHBondContact OE1-NE 2.96Å; Q61-R64 PolarHBondContact O-N 3.41Å; W62-R64 VanDerWaalsContact C-N 3.34Å; W62-R64 PolarHBondContact O-N 2.75Å; R64-K66 VanDerWaalsContact C-N 3.34Å; R64-K66 PolarHBondContact O-N 3.08Å; R64-S67 PolarHBondContact O-N 3.07Å; R64-K68 PolarHBondContact O-N 3.41Å
65	L	89.3	Confident	88.8	Confident	61 Å²	61	79 Å²	79	32%	0.319	38%	0.382	S	S	.	.	H	α-helix	trans	-59.9	-45	178.1	-174.9	64.9	0	0	0	111.2	Q61 W62 S67 K68 A69	Q61-L65 WeakPolarHBondContact O-CB 3.36Å; Q61-L65 PolarHBondContact O-N 2.98Å; W62-L65 HydrophobicContact CE3-CD2 3.9Å; W62-L65 HydrophobicContact CZ3-CD2 3.76Å; W62-L65 PolarHBondContact O-N 3.5Å; L65-S67 PolarHBondContact O-N 3.35Å; L65-K68 PolarHBondContact O-N 3.17Å; L65-A69 WeakPolarHBondContact O-CB 3.31Å; L65-A69 PolarHBondContact O-N 3.3Å
66	K	89.7	Confident	88.7	Confident	82 Å²	82	85.8 Å²	85.8	36%	0.357	41%	0.412	S	S	.	.	H	α-helix	trans	-60.6	-43.9	175.2	-77.1	178.2	57.7	-176.9	0	112.7	W40 W62 R63 R64 K68 A69 H70	W40-K66 VanDerWaalsContact NE1-NZ 3.18Å; W62-K66 HydrophobicContact CG-CD 4.44Å; W62-K66 WeakPolarHBondContact O-CB 3.44Å; W62-K66 WeakPolarHBondContact O-CG 3.42Å; W62-K66 PolarHBondContact O-N 2.89Å; R63-K66 PolarHBondContact O-N 3.45Å; R64-K66 VanDerWaalsContact C-N 3.34Å; R64-K66 PolarHBondContact O-N 3.08Å; K66-K68 VanDerWaalsContact C-N 3.35Å; K66-A69 PolarHBondContact O-N 3.14Å; K66-H70 WeakPolarHBondContact O-CB 3.49Å; K66-H70 PolarHBondContact O-N 3.18Å
67	S	87.2	Confident	88.5	Confident	55 Å²	55	85.1 Å²	85.1	39%	0.385	41%	0.405	S	S	.	.	H	α-helix	trans	-64.7	-39.3	177	-63.5	0	0	0	0	111.9	R63 R64 L65 R71	R63-S67 PolarHBondContact O-N 3.22Å; R63-S67 PolarHBondContact O-OG 2.8Å; R63-S67 VanDerWaalsContact O-OG 3.13Å; R64-S67 PolarHBondContact O-N 3.07Å; L65-S67 PolarHBondContact O-N 3.35Å; S67-R71 WeakPolarHBondContact O-CG 3.34Å; S67-R71 PolarHBondContact O-N 3.05Å; S67-R71 VanDerWaalsContact O-N 3.13Å
68	K	87.2	Confident	88.3	Confident	119 Å²	119	85.2 Å²	85.2	52%	0.517	40%	0.403	S	S	.	.	H	α-helix	trans	-63.3	-46.8	173.3	-76.5	-178.7	178.1	-177.2	0	111.1	R64 L65 K66 H70 R71 Q72	R64-K68 PolarHBondContact O-N 3.41Å; L65-K68 PolarHBondContact O-N 3.17Å; K66-K68 VanDerWaalsContact C-N 3.35Å; K68-H70 PolarHBondContact O-N 3Å; K68-R71 VanDerWaalsContact CG-NH2 3.29Å; K68-R71 PolarHBondContact O-N 3.5Å; K68-Q72 PolarHBondContact O-N 2.83Å
69	A	86.4	Confident	88.2	Confident	46 Å²	46	91 Å²	91	38%	0.38	43%	0.432	S	S	.	.	H	α-helix	trans	-62.4	-42	178.2	0	0	0	0	0	112.2	L65 K66 R71 Q72 C73	L65-A69 WeakPolarHBondContact O-CB 3.31Å; L65-A69 PolarHBondContact O-N 3.3Å; K66-A69 PolarHBondContact O-N 3.14Å; A69-R71 VanDerWaalsContact C-N 3.32Å; A69-R71 PolarHBondContact O-N 3.48Å; A69-Q72 CarbonylContact O-C 3.48Å; A69-Q72 WeakPolarHBondContact O-CA 3.27Å; A69-Q72 WeakPolarHBondContact O-CB 3.47Å; A69-Q72 PolarHBondContact O-N 3.33Å; A69-C73 PolarHBondContact O-N 2.87Å
70	H	83.1	Confident	88.2	Confident	90 Å²	90	94.9 Å²	94.9	42%	0.417	45%	0.452	S	S	.	.	H	α-helix	trans	-64	-36.9	176.8	-174.9	44.5	0	0	0	112.3	K66 K68 Q72 C73 D78	K66-H70 WeakPolarHBondContact O-CB 3.49Å; K66-H70 PolarHBondContact O-N 3.18Å; K68-H70 PolarHBondContact O-N 3Å; H70-Q72 PolarHBondContact O-N 3.46Å; H70-C73 VanDerWaalsContact O-CB 3.27Å; H70-C73 WeakPolarHBondContact O-CB 3.49Å; H70-C73 PolarHBondContact O-N 3.26Å; H70-C73 VanDerWaalsContact O-N 3.1Å; H70-D78 IonicContact CE1-OD1 3.62Å; H70-D78 PolarHBondContact CE1-OD1 3.25Å; H70-D78 IonicContact ND1-OD1 2.99Å; H70-D78 PolarHBondContact ND1-OD1 3.46Å
71	R	82.8	Confident	88	Confident	181 Å²	181	96.6 Å²	96.6	68%	0.683	46%	0.463	S	S	*	.	H	α-helix	trans	-65.5	-18	172	-73	-172.8	-67	-105.4	8	113.8	S67 K68 A69	S67-R71 WeakPolarHBondContact O-CG 3.34Å; S67-R71 PolarHBondContact O-N 3.05Å; S67-R71 VanDerWaalsContact O-N 3.13Å; K68-R71 VanDerWaalsContact CG-NH2 3.29Å; K68-R71 PolarHBondContact O-N 3.5Å; A69-R71 VanDerWaalsContact C-N 3.32Å; A69-R71 PolarHBondContact O-N 3.48Å
72	Q	85	Confident	87.9	Confident	164 Å²	164	98.7 Å²	98.7	77%	0.766	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.3	-1.1	176	-66	179.7	-28.9	0	0	112.4	K68 A69 H70	K68-Q72 PolarHBondContact O-N 2.83Å; A69-Q72 CarbonylContact O-C 3.48Å; A69-Q72 WeakPolarHBondContact O-CA 3.27Å; A69-Q72 WeakPolarHBondContact O-CB 3.47Å; A69-Q72 PolarHBondContact O-N 3.33Å; H70-Q72 PolarHBondContact O-N 3.46Å
73	C	84.4	Confident	87.9	Confident	44 Å²	44	102.7 Å²	102.7	30%	0.297	50%	0.498	S	S	.	.	S	Bend	trans	-63.4	150.1	173.7	-77.6	0	0	0	0	110.4	A69 H70 Q77	A69-C73 PolarHBondContact O-N 2.87Å; H70-C73 VanDerWaalsContact O-CB 3.27Å; H70-C73 WeakPolarHBondContact O-CB 3.49Å; H70-C73 PolarHBondContact O-N 3.26Å; H70-C73 VanDerWaalsContact O-N 3.1Å; C73-Q77 VanDerWaalsContact CA-OE1 3.29Å; C73-Q77 HydrophobicContact CB-CB 4.1Å; C73-Q77 VanDerWaalsContact CB-OE1 3.29Å; C73-Q77 PolarHBondContact SG-OE1 3.28Å
74	T	87	Confident	87.8	Confident	74 Å²	74	98.6 Å²	98.6	45%	0.454	49%	0.493	S	S	.	.			trans	-74.5	158.5	171.2	61.5	0	0	0	0	110.1	E76 Q77 D78	T74-E76 PolarHBondContact O-N 3.13Å; T74-Q77 PolarHBondContact O-N 2.77Å; T74-Q77 VanDerWaalsContact O-N 3.08Å; T74-Q77 WeakPolarHBondContact OG1-CG 3.24Å; T74-D78 PolarHBondContact O-N 3.34Å
75	I	85.8	Confident	87.7	Confident	141 Å²	141	97.8 Å²	97.8	72%	0.723	50%	0.499	S	S	*	.	H	α-helix	trans	-53.9	-37.3	174.8	-65.2	168.6	0	0	0	111	D78 M79	I75-D78 PolarHBondContact O-N 2.83Å; I75-M79 HydrophobicContact CG2-CG 4.19Å; I75-M79 WeakPolarHBondContact O-CB 3.25Å; I75-M79 VanDerWaalsContact O-CG 3.25Å; I75-M79 WeakPolarHBondContact O-CG 3.25Å; I75-M79 PolarHBondContact O-N 3.41Å
76	E	88.9	Confident	87.5	Confident	159 Å²	159	100.2 Å²	100.2	74%	0.743	51%	0.512	S	S	*	.	H	α-helix	trans	-60.8	-44.9	177.6	-66.4	175.9	175	0	0	112.6	T74 D78 M79 E80	T74-E76 PolarHBondContact O-N 3.13Å; E76-D78 VanDerWaalsContact C-N 3.35Å; E76-D78 PolarHBondContact O-N 2.72Å; E76-M79 PolarHBondContact O-N 2.78Å; E76-E80 PolarHBondContact O-N 3.17Å
77	Q	89	Confident	87.2	Confident	100 Å²	100	100.2 Å²	100.2	47%	0.467	52%	0.515	S	S	.	.	H	α-helix	trans	-65	-39.7	178.2	-70.1	175.5	-20.5	0	0	111.7	C73 T74 E80 L81	C73-Q77 VanDerWaalsContact CA-OE1 3.29Å; C73-Q77 HydrophobicContact CB-CB 4.1Å; C73-Q77 VanDerWaalsContact CB-OE1 3.29Å; C73-Q77 PolarHBondContact SG-OE1 3.28Å; T74-Q77 PolarHBondContact O-N 2.77Å; T74-Q77 VanDerWaalsContact O-N 3.08Å; T74-Q77 WeakPolarHBondContact OG1-CG 3.24Å; Q77-E80 PolarHBondContact O-N 3.3Å; Q77-L81 WeakPolarHBondContact O-CB 3.34Å; Q77-L81 PolarHBondContact O-N 2.63Å
78	D	86.9	Confident	86.9	Confident	57 Å²	57	105.5 Å²	105.5	31%	0.305	53%	0.527	S	S	.	.	H	α-helix	trans	-66.4	-43	176.5	-79.3	-0.8	0	0	0	111.4	H70 T74 I75 E76 E80 L81 V82	H70-D78 IonicContact CE1-OD1 3.62Å; H70-D78 PolarHBondContact CE1-OD1 3.25Å; H70-D78 IonicContact ND1-OD1 2.99Å; H70-D78 PolarHBondContact ND1-OD1 3.46Å; T74-D78 PolarHBondContact O-N 3.34Å; I75-D78 PolarHBondContact O-N 2.83Å; E76-D78 VanDerWaalsContact C-N 3.35Å; E76-D78 PolarHBondContact O-N 2.72Å; D78-E80 PolarHBondContact O-N 2.74Å; D78-L81 PolarHBondContact O-N 3.36Å; D78-V82 WeakPolarHBondContact O-CB 3.47Å; D78-V82 VanDerWaalsContact O-CG2 3.29Å; D78-V82 WeakPolarHBondContact O-CG2 3.29Å; D78-V82 PolarHBondContact O-N 3.37Å
79	M	89.6	Confident	86.5	Confident	120 Å²	120	102 Å²	102	59%	0.591	52%	0.52	S	S	*	.	H	α-helix	trans	-61	-44.1	175.9	-75	-62.3	-63.1	0	0	111.7	I75 E76 L81 V82 E83	I75-M79 HydrophobicContact CG2-CG 4.19Å; I75-M79 WeakPolarHBondContact O-CB 3.25Å; I75-M79 VanDerWaalsContact O-CG 3.25Å; I75-M79 WeakPolarHBondContact O-CG 3.25Å; I75-M79 PolarHBondContact O-N 3.41Å; E76-M79 PolarHBondContact O-N 2.78Å; M79-L81 VanDerWaalsContact C-N 3.34Å; M79-L81 PolarHBondContact O-N 2.96Å; M79-V82 PolarHBondContact O-N 3.45Å; M79-E83 WeakPolarHBondContact O-CB 3.27Å; M79-E83 PolarHBondContact O-N 3.13Å
80	E	91.8	Very high	85.7	Confident	140 Å²	140	100.9 Å²	100.9	65%	0.654	51%	0.513	S	S	*	.	H	α-helix	trans	-60.8	-43.3	175.7	-172.7	-176.9	-178	0	0	111.5	E76 Q77 D78 E83 A84	E76-E80 PolarHBondContact O-N 3.17Å; Q77-E80 PolarHBondContact O-N 3.3Å; D78-E80 PolarHBondContact O-N 2.74Å; E80-E83 PolarHBondContact O-N 3.24Å; E80-A84 VanDerWaalsContact O-CB 3.27Å; E80-A84 WeakPolarHBondContact O-CB 3.45Å; E80-A84 PolarHBondContact O-N 3.32Å
81	L	87.9	Confident	84.8	Confident	96 Å²	96	104.4 Å²	104.4	50%	0.503	53%	0.528	S	S	.	.	H	α-helix	trans	-66.1	-41.2	178.3	-177.3	62	0	0	0	112.2	Q77 D78 M79 T85	Q77-L81 WeakPolarHBondContact O-CB 3.34Å; Q77-L81 PolarHBondContact O-N 2.63Å; D78-L81 PolarHBondContact O-N 3.36Å; M79-L81 VanDerWaalsContact C-N 3.34Å; M79-L81 PolarHBondContact O-N 2.96Å; L81-T85 WeakPolarHBondContact O-CB 3.36Å; L81-T85 PolarHBondContact O-N 3.05Å; L81-T85 PolarHBondContact O-OG1 3.08Å
82	V	89.8	Confident	83.7	Confident	76 Å²	76	106 Å²	106	46%	0.461	53%	0.533	S	S	.	.	H	α-helix	trans	-63.5	-47.4	175.2	169.1	0	0	0	0	109.8	D78 M79 A84 T85 L86	D78-V82 WeakPolarHBondContact O-CB 3.47Å; D78-V82 VanDerWaalsContact O-CG2 3.29Å; D78-V82 WeakPolarHBondContact O-CG2 3.29Å; D78-V82 PolarHBondContact O-N 3.37Å; M79-V82 PolarHBondContact O-N 3.45Å; V82-A84 PolarHBondContact O-N 2.95Å; V82-T85 CarbonylContact O-C 3.57Å; V82-T85 WeakPolarHBondContact O-CA 3.41Å; V82-T85 WeakPolarHBondContact O-CB 3.49Å; V82-T85 PolarHBondContact O-N 2.96Å; V82-T85 VanDerWaalsContact O-N 3.12Å; V82-L86 HydrophobicContact CG1-CD1 4Å; V82-L86 HydrophobicContact CG1-CG 4.28Å; V82-L86 WeakPolarHBondContact O-CG 3.35Å; V82-L86 PolarHBondContact O-N 2.67Å
83	E	92.2	Very high	82.3	Confident	120 Å²	120	108.5 Å²	108.5	56%	0.561	54%	0.536	S	S	*	.	H	α-helix	trans	-62.6	-43.8	178.4	-167.2	-174.8	166.4	0	0	111.3	M79 E80 T85 L86 N87	M79-E83 WeakPolarHBondContact O-CB 3.27Å; M79-E83 PolarHBondContact O-N 3.13Å; E80-E83 PolarHBondContact O-N 3.24Å; E83-T85 VanDerWaalsContact C-N 3.26Å; E83-T85 PolarHBondContact O-N 2.79Å; E83-L86 PolarHBondContact O-N 2.8Å; E83-N87 VanDerWaalsContact O-CB 3.24Å; E83-N87 WeakPolarHBondContact O-CB 3.37Å; E83-N87 VanDerWaalsContact O-CG 3.32Å; E83-N87 PolarHBondContact O-N 3.12Å; E83-N87 PolarHBondContact O-ND2 2.87Å
84	A	89.3	Confident	80.7	Confident	49 Å²	49	109.8 Å²	109.8	41%	0.405	54%	0.542	S	S	.	.	H	α-helix	trans	-59.7	-38.3	174.3	0	0	0	0	0	111.9	E80 V82 R88	E80-A84 VanDerWaalsContact O-CB 3.27Å; E80-A84 WeakPolarHBondContact O-CB 3.45Å; E80-A84 PolarHBondContact O-N 3.32Å; V82-A84 PolarHBondContact O-N 2.95Å; A84-R88 WeakPolarHBondContact O-CB 3.24Å; A84-R88 PolarHBondContact O-N 3.47Å
85	T	87.9	Confident	79.3	Confident	79 Å²	79	111.7 Å²	111.7	49%	0.485	55%	0.55	S	S	.	.	H	α-helix	trans	-68.6	-44.3	176.2	-60.7	0	0	0	0	111.7	L81 V82 E83 R88 A89	L81-T85 WeakPolarHBondContact O-CB 3.36Å; L81-T85 PolarHBondContact O-N 3.05Å; L81-T85 PolarHBondContact O-OG1 3.08Å; V82-T85 CarbonylContact O-C 3.57Å; V82-T85 WeakPolarHBondContact O-CA 3.41Å; V82-T85 WeakPolarHBondContact O-CB 3.49Å; V82-T85 PolarHBondContact O-N 2.96Å; V82-T85 VanDerWaalsContact O-N 3.12Å; E83-T85 VanDerWaalsContact C-N 3.26Å; E83-T85 PolarHBondContact O-N 2.79Å; T85-R88 PolarHBondContact O-N 3.28Å; T85-A89 WeakPolarHBondContact O-CB 3.34Å; T85-A89 PolarHBondContact O-N 2.98Å
86	L	86.2	Confident	78.2	Confident	113 Å²	113	113 Å²	113	59%	0.592	55%	0.55	S	S	*	*	H	α-helix	trans	-63.9	-42.3	174.8	-71.8	176.6	0	0	0	111.3	V82 E83 R88 A89 G90	V82-L86 HydrophobicContact CG1-CD1 4Å; V82-L86 HydrophobicContact CG1-CG 4.28Å; V82-L86 WeakPolarHBondContact O-CG 3.35Å; V82-L86 PolarHBondContact O-N 2.67Å; E83-L86 PolarHBondContact O-N 2.8Å; L86-R88 VanDerWaalsContact C-N 3.31Å; L86-R88 PolarHBondContact O-N 3.42Å; L86-A89 PolarHBondContact O-N 3.3Å; L86-G90 WeakPolarHBondContact O-CA 3.44Å; L86-G90 PolarHBondContact O-N 2.81Å
87	N	83.8	Confident	77.2	Confident	81 Å²	81	108 Å²	108	43%	0.433	53%	0.528	S	S	.	.	H	α-helix	trans	-63.4	-36.8	174.9	-80.3	-34	0	0	0	111.6	E83 K91	E83-N87 VanDerWaalsContact O-CB 3.24Å; E83-N87 WeakPolarHBondContact O-CB 3.37Å; E83-N87 VanDerWaalsContact O-CG 3.32Å; E83-N87 PolarHBondContact O-N 3.12Å; E83-N87 PolarHBondContact O-ND2 2.87Å; N87-K91 VanDerWaalsContact O-CB 3.28Å; N87-K91 WeakPolarHBondContact O-CB 3.28Å; N87-K91 WeakPolarHBondContact O-CG 3.27Å; N87-K91 PolarHBondContact O-N 3.43Å
88	R	81	Confident	76.4	Confident	166 Å²	166	104.6 Å²	104.6	63%	0.626	52%	0.515	S	S	*	.	H	α-helix	trans	-70.1	-42.8	174.5	-171.8	-177.4	-62.7	177.5	0.4	112	A84 T85 L86 R92	A84-R88 WeakPolarHBondContact O-CB 3.24Å; A84-R88 PolarHBondContact O-N 3.47Å; T85-R88 PolarHBondContact O-N 3.28Å; L86-R88 VanDerWaalsContact C-N 3.31Å; L86-R88 PolarHBondContact O-N 3.42Å; R88-R92 PolarHBondContact O-N 3.25Å
89	A	78.1	Confident	75.9	Confident	46 Å²	46	107.7 Å²	107.7	38%	0.38	54%	0.541	S	S	.	.	H	α-helix	trans	-66.6	-42.5	175.9	0	0	0	0	0	111.1	T85 L86 R92 R93	T85-A89 WeakPolarHBondContact O-CB 3.34Å; T85-A89 PolarHBondContact O-N 2.98Å; L86-A89 PolarHBondContact O-N 3.3Å; A89-R92 WeakPolarHBondContact O-CB 2.99Å; A89-R92 PolarHBondContact O-N 3.18Å; A89-R93 PolarHBondContact O-N 3.44Å
90	G	68.5	Low	75.5	Confident	23 Å²	23	106.8 Å²	106.8	24%	0.237	54%	0.539	C	S	.	.	H	α-helix	trans	-59	-51.1	174.1	0	0	0	0	0	110.8	L86 R92 R93 T94	L86-G90 WeakPolarHBondContact O-CA 3.44Å; L86-G90 PolarHBondContact O-N 2.81Å; G90-R92 PolarHBondContact O-N 3.09Å; G90-R92 VanDerWaalsContact O-N 3.07Å; G90-R93 CarbonylContact O-C 3.3Å; G90-R93 VanDerWaalsContact O-C 3.3Å; G90-R93 VanDerWaalsContact O-CA 3.28Å; G90-R93 WeakPolarHBondContact O-CA 3.43Å; G90-R93 PolarHBondContact O-N 2.65Å; G90-T94 VanDerWaalsContact C-CG2 3.46Å; G90-T94 WeakPolarHBondContact O-CB 3.28Å; G90-T94 WeakPolarHBondContact O-CG2 3.46Å; G90-T94 PolarHBondContact O-N 2.75Å; G90-T94 PolarHBondContact O-OG1 3.17Å
91	K	65.7	Low	75.1	Confident	164 Å²	164	102 Å²	102	71%	0.713	52%	0.516	S	S	*	.	H	α-helix	trans	-53.7	-32.4	175.8	-81.4	170.9	-174.6	173.9	0	113.6	N87 T94	N87-K91 VanDerWaalsContact O-CB 3.28Å; N87-K91 WeakPolarHBondContact O-CB 3.28Å; N87-K91 WeakPolarHBondContact O-CG 3.27Å; N87-K91 PolarHBondContact O-N 3.43Å; K91-T94 VanDerWaalsContact CA-OG1 3.27Å; K91-T94 WeakPolarHBondContact CA-OG1 3.19Å; K91-T94 PolarHBondContact O-OG1 3.07Å; K91-T94 VanDerWaalsContact O-OG1 3.09Å
92	R	58.6	Low	75	Confident	213 Å²	213	97.8 Å²	97.8	80%	0.804	49%	0.494	S	S	*	.	H	α-helix	trans	-75.5	-27.8	173.7	-61.7	-177.8	-162	-171.8	4.7	112.8	R88 A89 G90	R88-R92 PolarHBondContact O-N 3.25Å; A89-R92 WeakPolarHBondContact O-CB 2.99Å; A89-R92 PolarHBondContact O-N 3.18Å; G90-R92 PolarHBondContact O-N 3.09Å; G90-R92 VanDerWaalsContact O-N 3.07Å
93	R	55.5	Low	74.8	Confident	218 Å²	218	102.6 Å²	102.6	82%	0.823	51%	0.509	S	S	*	.	H	α-helix	trans	-90.6	-18.7	175.3	-63.9	-173.7	-177	-164.2	2.9	113.6	A89 G90 N95	A89-R93 PolarHBondContact O-N 3.44Å; G90-R93 CarbonylContact O-C 3.3Å; G90-R93 VanDerWaalsContact O-C 3.3Å; G90-R93 VanDerWaalsContact O-CA 3.28Å; G90-R93 WeakPolarHBondContact O-CA 3.43Å; G90-R93 PolarHBondContact O-N 2.65Å; R93-N95 PolarHBondContact O-N 3.22Å
94	T	52.1	Low	74.5	Confident	70 Å²	70	105.5 Å²	105.5	43%	0.429	52%	0.52	S	S	.	.			trans	-79.2	62.6	-173.8	62.2	0	0	0	0	111.8	G90 K91	G90-T94 VanDerWaalsContact C-CG2 3.46Å; G90-T94 WeakPolarHBondContact O-CB 3.28Å; G90-T94 WeakPolarHBondContact O-CG2 3.46Å; G90-T94 PolarHBondContact O-N 2.75Å; G90-T94 PolarHBondContact O-OG1 3.17Å; K91-T94 VanDerWaalsContact CA-OG1 3.27Å; K91-T94 WeakPolarHBondContact CA-OG1 3.19Å; K91-T94 PolarHBondContact O-OG1 3.07Å; K91-T94 VanDerWaalsContact O-OG1 3.09Å
95	N	56.6	Low	74.6	Confident	114 Å²	114	104.9 Å²	104.9	61%	0.61	51%	0.512	S	S	*	.				-69.2	117.4	126.4	-86.3	0.5	0	0	0	104.5	R93 L97	R93-N95 PolarHBondContact O-N 3.22Å; N95-L97 HydrophobicContact CB-CB 4.3Å; N95-L97 HydrophobicContact CB-CD1 3.51Å; N95-L97 HydrophobicContact CB-CG 4.47Å; N95-L97 PolarHBondContact O-N 3.22Å
96	K	63	Low	74.8	Confident	168 Å²	168	105.4 Å²	105.4	73%	0.73	51%	0.511	S	S	*	.			trans	-63	20.9	174.1	-63.6	-174.5	173.9	-170.2	0	112.5
97	L	69	Low	75.2	Confident	54 Å²	54	102 Å²	102	28%	0.283	50%	0.497	S	S	.	.	S	Bend	trans	-87.7	134.3	-178.7	-74.5	118.7	0	0	0	106.7	N95 F101 L175	N95-L97 HydrophobicContact CB-CB 4.3Å; N95-L97 HydrophobicContact CB-CD1 3.51Å; N95-L97 HydrophobicContact CB-CG 4.47Å; N95-L97 PolarHBondContact O-N 3.22Å; L97-F101 HydrophobicContact CB-CB 3.96Å; L97-F101 HydrophobicContact CB-CD1 4.46Å; L97-F101 HydrophobicContact CB-CG 4.12Å; L97-F101 HydrophobicContact CD2-CB 4.01Å; L97-F101 HydrophobicContact CD2-CD1 3.32Å; L97-F101 HydrophobicContact CD2-CD2 3.32Å; L97-F101 HydrophobicContact CD2-CE1 3.47Å; L97-F101 VanDerWaalsContact CD2-CE1 3.47Å; L97-F101 HydrophobicContact CD2-CE2 3.46Å; L97-F101 VanDerWaalsContact CD2-CE2 3.46Å; L97-F101 HydrophobicContact CD2-CG 3.23Å; L97-F101 HydrophobicContact CD2-CZ 3.52Å; L97-F101 HydrophobicContact CG-CD1 4.46Å; L97-F101 HydrophobicContact CG-CG 4.31Å; L97-L175 HydrophobicContact CD2-CD2 3.3Å; L97-L175 HydrophobicContact CG-CD2 4.01Å
98	P	71.8	Confident	75.7	Confident	30 Å²	30	98.3 Å²	98.3	20%	0.195	48%	0.478	C	S	.	.			trans	-48	150	170.4	-32.1	40.1	0	0	0	112.3	D100 F101 F164 F171	P98-D100 WeakPolarHBondContact CB-OD1 3.46Å; P98-D100 PolarHBondContact O-N 3.29Å; P98-F101 WeakPolarHBondContact O-CB 3.22Å; P98-F101 PolarHBondContact O-N 3.06Å; P98-F164 HydrophobicContact CB-CZ 3.93Å; P98-F164 HydrophobicContact CG-CZ 3.93Å; P98-F171 HydrophobicContact CG-CD1 4.03Å; P98-F171 HydrophobicContact CG-CD2 3.92Å; P98-F171 HydrophobicContact CG-CE1 3.71Å; P98-F171 HydrophobicContact CG-CE2 3.59Å; P98-F171 HydrophobicContact CG-CG 4.14Å; P98-F171 HydrophobicContact CG-CZ 3.48Å; P98-F171 VanDerWaalsContact CG-CZ 3.48Å
99	S	75.5	Confident	76.3	Confident	122 Å²	122	93.5 Å²	93.5	85%	0.853	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-23.5	-175.4	-175.6	0	0	0	0	113.2
100	D	81.4	Confident	77.1	Confident	101 Å²	101	93.5 Å²	93.5	54%	0.54	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-2.6	175.6	60.6	-24.5	0	0	0	113.1	P98 F164 H168	P98-D100 WeakPolarHBondContact CB-OD1 3.46Å; P98-D100 PolarHBondContact O-N 3.29Å; D100-F164 HydrophobicContact CB-CE2 4.49Å; D100-H168 IonicContact OD2-NE2 2.63Å
101	F	83.6	Confident	78.4	Confident	39 Å²	39	94.4 Å²	94.4	17%	0.171	46%	0.457	C	S	.	.	S	Bend	trans	-60	132.1	173.7	-175.9	-91.1	0	0	0	110.6	L97 P98 K103 V161 F164 L175	L97-F101 HydrophobicContact CB-CB 3.96Å; L97-F101 HydrophobicContact CB-CD1 4.46Å; L97-F101 HydrophobicContact CB-CG 4.12Å; L97-F101 HydrophobicContact CD2-CB 4.01Å; L97-F101 HydrophobicContact CD2-CD1 3.32Å; L97-F101 HydrophobicContact CD2-CD2 3.32Å; L97-F101 HydrophobicContact CD2-CE1 3.47Å; L97-F101 VanDerWaalsContact CD2-CE1 3.47Å; L97-F101 HydrophobicContact CD2-CE2 3.46Å; L97-F101 VanDerWaalsContact CD2-CE2 3.46Å; L97-F101 HydrophobicContact CD2-CG 3.23Å; L97-F101 HydrophobicContact CD2-CZ 3.52Å; L97-F101 HydrophobicContact CG-CD1 4.46Å; L97-F101 HydrophobicContact CG-CG 4.31Å; P98-F101 WeakPolarHBondContact O-CB 3.22Å; P98-F101 PolarHBondContact O-N 3.06Å; F101-K103 PolarHBondContact O-N 3.22Å; F101-V161 HydrophobicContact CE1-CG2 4.35Å; F101-V161 HydrophobicContact CE2-CG1 4.37Å; F101-V161 HydrophobicContact CZ-CG1 4.07Å; F101-V161 HydrophobicContact CZ-CG2 3.97Å; F101-F164 HydrophobicContact CB-CE2 4.48Å; F101-F164 HydrophobicContact CB-CZ 4.3Å; F101-F164 AromaticContact CD2-CD1 3.53Å; F101-F164 HydrophobicContact CD2-CD1 3.53Å; F101-F164 AromaticContact CD2-CE1 3.63Å; F101-F164 HydrophobicContact CD2-CE1 3.63Å; F101-F164 HydrophobicContact CD2-CG 4.08Å; F101-F164 HydrophobicContact CD2-CZ 4.23Å; F101-F164 HydrophobicContact CE2-CD1 4Å; F101-F164 HydrophobicContact CE2-CE1 4.41Å; F101-L175 HydrophobicContact CE2-CD1 4.31Å; F101-L175 HydrophobicContact CE2-CD2 4.03Å; F101-L175 HydrophobicContact CZ-CD2 4.42Å
102	P	84.9	Confident	79.8	Confident	7 Å²	7	87.1 Å²	87.1	5%	0.045	43%	0.426	C	S	.	.	P	Polyproline II helix	trans	-53.7	127.5	-177.5	-30.1	37.9	0	0	0	112.3	H157 E160 V161 F164	P102-H157 PolarHBondContact O-CE1 3.24Å; P102-H157 VanDerWaalsContact O-CE1 3.27Å; P102-E160 HydrophobicContact CB-CB 4.11Å; P102-E160 HydrophobicContact CB-CG 3.92Å; P102-E160 HydrophobicContact CG-CB 3.97Å; P102-E160 HydrophobicContact CG-CG 3.56Å; P102-V161 HydrophobicContact CB-CG2 3.91Å; P102-V161 HydrophobicContact CG-CG2 4.21Å; P102-F164 HydrophobicContact CG-CB 4.11Å
103	K	85.3	Confident	81.4	Confident	178 Å²	178	78.1 Å²	78.1	77%	0.774	39%	0.393	S	S	*	.	P	Polyproline II helix	trans	-78.4	143.7	178.4	-68	175.8	-174.2	169.2	0	110.2	F101 H157	F101-K103 PolarHBondContact O-N 3.22Å; K103-H157 PolarHBondContact O-CE1 3.26Å; K103-H157 VanDerWaalsContact O-CE1 3.26Å; K103-H157 PolarHBondContact O-ND1 2.86Å; K103-H157 VanDerWaalsContact O-ND1 3.15Å
104	K	87.3	Confident	83.2	Confident	180 Å²	180	71.4 Å²	71.4	78%	0.783	37%	0.374	S	S	*	.	P	Polyproline II helix	trans	-59.1	133.8	174.9	-66.6	179.5	179.9	-179.1	0	109.8
105	P	90.6	Very high	85.1	Confident	37 Å²	37	73.4 Å²	73.4	24%	0.24	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-65.4	153.8	177.7	28	-34.7	0	0	0	110.6	A153 L154 H157	P105-A153 HydrophobicContact CB-CB 3.68Å; P105-A153 HydrophobicContact CG-CB 4.37Å; P105-L154 HydrophobicContact CG-CD2 3.6Å; P105-L154 HydrophobicContact CG-CG 3.94Å; P105-H157 HydrophobicContact CG-CB 4.14Å
106	L	92.4	Very high	86.7	Confident	89 Å²	89	69 Å²	69	47%	0.466	35%	0.352	S	S	.	.	P	Polyproline II helix	trans	-64.6	145	176.5	-66	176.4	0	0	0	111	L111 L114	L106-L111 HydrophobicContact CB-CD2 3.92Å; L106-L111 HydrophobicContact CB-CG 4.03Å; L106-L111 HydrophobicContact CD1-CD2 4.01Å; L106-L114 HydrophobicContact CD1-CD2 4.32Å
107	S	93.9	Very high	88	Confident	43 Å²	43	63.5 Å²	63.5	30%	0.301	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-66.1	158.6	171.2	76	0	0	0	0	111.2	F109 S110 L111	S107-F109 PolarHBondContact O-N 3.34Å; S107-S110 WeakPolarHBondContact O-CB 3.29Å; S107-S110 PolarHBondContact O-N 2.66Å; S107-S110 WeakPolarHBondContact OG-CB 3.45Å; S107-S110 PolarHBondContact OG-N 3.19Å; S107-S110 PolarHBondContact OG-OG 3.16Å; S107-L111 WeakPolarHBondContact O-CG 3.34Å; S107-L111 PolarHBondContact O-N 3.21Å
108	A	94.3	Very high	89	Confident	3 Å²	3	69 Å²	69	3%	0.025	36%	0.357	C	S	.	.	H	α-helix	trans	-54.8	-40.3	175	0	0	0	0	0	112.5	L111 F112 W135 F146 L147 Q150	A108-L111 WeakPolarHBondContact O-CB 2.97Å; A108-L111 PolarHBondContact O-N 2.73Å; A108-F112 PolarHBondContact O-N 3.23Å; A108-W135 HydrophobicContact CB-CH2 3.98Å; A108-W135 HydrophobicContact CB-CZ2 4.37Å; A108-F146 HydrophobicContact CB-CB 3.87Å; A108-L147 HydrophobicContact CB-CD2 3.7Å; A108-L147 HydrophobicContact CB-CG 4.3Å; A108-Q150 HydrophobicContact CB-CB 4.3Å
109	F	94.8	Very high	89.8	Confident	65 Å²	65	74.4 Å²	74.4	29%	0.285	38%	0.377	S	S	.	.	H	α-helix	trans	-65.5	-41.8	175.5	-179.5	-120.5	0	0	0	112.4	S107 L111 F112 I113 A131 A132 W135	S107-F109 PolarHBondContact O-N 3.34Å; F109-L111 VanDerWaalsContact C-N 3.33Å; F109-L111 PolarHBondContact O-N 2.8Å; F109-F112 HydrophobicContact CD2-CD1 4.37Å; F109-F112 HydrophobicContact CE2-CD1 4.41Å; F109-F112 WeakPolarHBondContact O-CB 3.43Å; F109-F112 PolarHBondContact O-N 3.28Å; F109-F112 VanDerWaalsContact O-N 3.13Å; F109-I113 HydrophobicContact CD1-CD1 3.8Å; F109-I113 HydrophobicContact CE1-CD1 3.38Å; F109-I113 HydrophobicContact CE1-CG1 4.34Å; F109-I113 HydrophobicContact CE2-CD1 4.16Å; F109-I113 HydrophobicContact CE2-CG1 4.26Å; F109-I113 HydrophobicContact CG-CD1 4.37Å; F109-I113 HydrophobicContact CZ-CD1 3.58Å; F109-I113 HydrophobicContact CZ-CG1 4.11Å; F109-I113 PolarHBondContact O-N 2.83Å; F109-A131 HydrophobicContact CE2-CB 4.43Å; F109-A131 HydrophobicContact CZ-CB 4.39Å; F109-A132 HydrophobicContact CZ-CB 4.11Å; F109-W135 HydrophobicContact CD2-CB 3.77Å; F109-W135 AromaticContact CD2-CD2 3.85Å; F109-W135 HydrophobicContact CD2-CD2 3.85Å; F109-W135 HydrophobicContact CD2-CE3 4.33Å; F109-W135 AromaticContact CD2-CG 3.58Å; F109-W135 HydrophobicContact CD2-CG 3.58Å; F109-W135 HydrophobicContact CE2-CB 3.65Å; F109-W135 AromaticContact CE2-CG 3.98Å; F109-W135 HydrophobicContact CE2-CG 3.98Å
110	S	95	Very high	90.2	Very high	45 Å²	45	71.1 Å²	71.1	32%	0.315	36%	0.363	S	S	.	.	H	α-helix	trans	-64.1	-38.2	175.1	-57	0	0	0	0	112.1	S107 F112 I113 L114	S107-S110 WeakPolarHBondContact O-CB 3.29Å; S107-S110 PolarHBondContact O-N 2.66Å; S107-S110 WeakPolarHBondContact OG-CB 3.45Å; S107-S110 PolarHBondContact OG-N 3.19Å; S107-S110 PolarHBondContact OG-OG 3.16Å; S110-F112 VanDerWaalsContact C-N 3.29Å; S110-F112 PolarHBondContact O-N 3.47Å; S110-I113 PolarHBondContact O-N 3.28Å; S110-L114 WeakPolarHBondContact O-CB 3.39Å; S110-L114 PolarHBondContact O-N 3.03Å
111	L	95	Very high	90.2	Very high	42 Å²	42	69.5 Å²	69.5	22%	0.22	36%	0.357	C	S	.	.	H	α-helix	trans	-63.5	-36.1	172.9	-68.4	173.8	0	0	0	111.8	L106 S107 A108 F109 K115 F146 K149	L106-L111 HydrophobicContact CB-CD2 3.92Å; L106-L111 HydrophobicContact CB-CG 4.03Å; L106-L111 HydrophobicContact CD1-CD2 4.01Å; S107-L111 WeakPolarHBondContact O-CG 3.34Å; S107-L111 PolarHBondContact O-N 3.21Å; A108-L111 WeakPolarHBondContact O-CB 2.97Å; A108-L111 PolarHBondContact O-N 2.73Å; F109-L111 VanDerWaalsContact C-N 3.33Å; F109-L111 PolarHBondContact O-N 2.8Å; L111-K115 PolarHBondContact O-N 2.96Å; L111-F146 HydrophobicContact CB-CD1 3.82Å; L111-F146 HydrophobicContact CB-CE1 4.39Å; L111-K149 HydrophobicContact CD1-CB 4.09Å
112	F	94.2	Very high	90	Very high	12 Å²	12	67.7 Å²	67.7	5%	0.053	35%	0.349	C	S	.	.	H	α-helix	trans	-66.2	-49.5	175.1	174	-108.1	0	0	0	112.2	A108 F109 S110 L114 K115 L116 A131 L134 W135 L138 F146	A108-F112 PolarHBondContact O-N 3.23Å; F109-F112 HydrophobicContact CD2-CD1 4.37Å; F109-F112 HydrophobicContact CE2-CD1 4.41Å; F109-F112 WeakPolarHBondContact O-CB 3.43Å; F109-F112 PolarHBondContact O-N 3.28Å; F109-F112 VanDerWaalsContact O-N 3.13Å; S110-F112 VanDerWaalsContact C-N 3.29Å; S110-F112 PolarHBondContact O-N 3.47Å; F112-L114 VanDerWaalsContact C-N 3.28Å; F112-L114 PolarHBondContact O-N 2.92Å; F112-K115 WeakPolarHBondContact O-CB 3.35Å; F112-K115 PolarHBondContact O-N 3.31Å; F112-K115 VanDerWaalsContact O-N 3.08Å; F112-L116 HydrophobicContact CD1-CD1 4.1Å; F112-L116 HydrophobicContact CE1-CD1 3.42Å; F112-L116 VanDerWaalsContact CE1-CD1 3.42Å; F112-L116 HydrophobicContact CE1-CG 4.26Å; F112-L116 HydrophobicContact CE2-CD1 4.04Å; F112-L116 HydrophobicContact CE2-CD2 4.35Å; F112-L116 HydrophobicContact CE2-CG 4.1Å; F112-L116 HydrophobicContact CZ-CD1 3.41Å; F112-L116 VanDerWaalsContact CZ-CD1 3.41Å; F112-L116 HydrophobicContact CZ-CD2 4.36Å; F112-L116 HydrophobicContact CZ-CG 3.98Å; F112-L116 PolarHBondContact O-N 3.49Å; F112-A131 WeakPolarHBondContact CE1-O 3.48Å; F112-L134 HydrophobicContact CE1-CB 4.05Å; F112-L134 HydrophobicContact CZ-CB 3.86Å; F112-W135 HydrophobicContact CB-CE3 3.66Å; F112-W135 HydrophobicContact CB-CZ3 3.66Å; F112-W135 HydrophobicContact CD1-CB 4.11Å; F112-W135 HydrophobicContact CD1-CD2 4.47Å; F112-W135 AromaticContact CD1-CE3 3.71Å; F112-W135 HydrophobicContact CD1-CE3 3.71Å; F112-W135 HydrophobicContact CD2-CE3 4.07Å; F112-W135 HydrophobicContact CD2-CZ3 4.34Å; F112-W135 HydrophobicContact CE1-CB 3.98Å; F112-W135 HydrophobicContact CE1-CE3 4.34Å; F112-W135 AromaticContact CG-CE3 3.54Å; F112-W135 HydrophobicContact CG-CE3 3.54Å; F112-W135 AromaticContact CG-CZ3 3.96Å; F112-W135 HydrophobicContact CG-CZ3 3.96Å; F112-L138 HydrophobicContact CD2-CD2 4.03Å; F112-L138 HydrophobicContact CE2-CD1 4.25Å; F112-L138 HydrophobicContact CE2-CD2 3.89Å; F112-F146 HydrophobicContact CB-CD1 4.36Å; F112-F146 HydrophobicContact CB-CE1 4.15Å; F112-F146 HydrophobicContact CB-CE2 4.42Å; F112-F146 HydrophobicContact CB-CZ 4.17Å; F112-F146 AromaticContact CD2-CE2 3.82Å; F112-F146 HydrophobicContact CD2-CE2 3.82Å; F112-F146 AromaticContact CD2-CZ 3.78Å; F112-F146 HydrophobicContact CD2-CZ 3.78Å; F112-F146 HydrophobicContact CG-CZ 4.49Å
113	I	93.3	Very high	89.5	Confident	24 Å²	24	74.2 Å²	74.2	12%	0.123	38%	0.383	C	S	.	.	H	α-helix	trans	-55.9	-45.7	174.7	-68.7	163.2	0	0	0	110.5	F109 S110 K115 L116 S117 L122 F128 A131	F109-I113 HydrophobicContact CD1-CD1 3.8Å; F109-I113 HydrophobicContact CE1-CD1 3.38Å; F109-I113 HydrophobicContact CE1-CG1 4.34Å; F109-I113 HydrophobicContact CE2-CD1 4.16Å; F109-I113 HydrophobicContact CE2-CG1 4.26Å; F109-I113 HydrophobicContact CG-CD1 4.37Å; F109-I113 HydrophobicContact CZ-CD1 3.58Å; F109-I113 HydrophobicContact CZ-CG1 4.11Å; F109-I113 PolarHBondContact O-N 2.83Å; S110-I113 PolarHBondContact O-N 3.28Å; I113-K115 VanDerWaalsContact C-N 3.29Å; I113-K115 PolarHBondContact O-N 2.89Å; I113-L116 PolarHBondContact O-N 3.43Å; I113-S117 WeakPolarHBondContact O-CB 3.41Å; I113-S117 PolarHBondContact O-N 3.15Å; I113-L122 HydrophobicContact CG2-CD1 4.03Å; I113-F128 HydrophobicContact CD1-CD1 3.99Å; I113-F128 HydrophobicContact CD1-CE1 4.34Å; I113-F128 HydrophobicContact CG2-CE1 4.36Å; I113-A131 HydrophobicContact CD1-CB 4.45Å; I113-A131 HydrophobicContact CG1-CB 3.69Å
114	L	92.6	Very high	89.3	Confident	77 Å²	77	69.9 Å²	69.9	40%	0.403	37%	0.366	S	S	.	.	H	α-helix	trans	-59.9	-40.9	178.2	-177.2	64.1	0	0	0	111.7	L106 S110 F112 K118	L106-L114 HydrophobicContact CD1-CD2 4.32Å; S110-L114 WeakPolarHBondContact O-CB 3.39Å; S110-L114 PolarHBondContact O-N 3.03Å; F112-L114 VanDerWaalsContact C-N 3.28Å; F112-L114 PolarHBondContact O-N 2.92Å; L114-K118 WeakPolarHBondContact O-CB 3.38Å; L114-K118 WeakPolarHBondContact O-CG 3.48Å; L114-K118 PolarHBondContact O-N 3.35Å
115	K	92.3	Very high	89.1	Confident	111 Å²	111	70.9 Å²	70.9	48%	0.483	37%	0.37	S	S	.	.	H	α-helix	trans	-64.4	-43.1	177.1	-171	-176.2	-175.4	-179.5	0	111.8	L111 F112 I113 K119 F146	L111-K115 PolarHBondContact O-N 2.96Å; F112-K115 WeakPolarHBondContact O-CB 3.35Å; F112-K115 PolarHBondContact O-N 3.31Å; F112-K115 VanDerWaalsContact O-N 3.08Å; I113-K115 VanDerWaalsContact C-N 3.29Å; I113-K115 PolarHBondContact O-N 2.89Å; K115-K119 WeakPolarHBondContact O-CG 2.9Å; K115-K119 PolarHBondContact O-N 2.92Å; K115-F146 HydrophobicContact CB-CE1 4.36Å; K115-F146 HydrophobicContact CB-CZ 4.46Å; K115-F146 HydrophobicContact CD-CE1 4.09Å; K115-F146 HydrophobicContact CD-CZ 3.65Å
116	L	90.8	Very high	88.8	Confident	22 Å²	22	74.2 Å²	74.2	12%	0.115	39%	0.386	C	S	.	.	H	α-helix	trans	-68.8	-40.1	178.4	-70.6	-177.9	0	0	0	112.3	F112 I113 K119 G120 V121 L122 A131 L134	F112-L116 HydrophobicContact CD1-CD1 4.1Å; F112-L116 HydrophobicContact CE1-CD1 3.42Å; F112-L116 VanDerWaalsContact CE1-CD1 3.42Å; F112-L116 HydrophobicContact CE1-CG 4.26Å; F112-L116 HydrophobicContact CE2-CD1 4.04Å; F112-L116 HydrophobicContact CE2-CD2 4.35Å; F112-L116 HydrophobicContact CE2-CG 4.1Å; F112-L116 HydrophobicContact CZ-CD1 3.41Å; F112-L116 VanDerWaalsContact CZ-CD1 3.41Å; F112-L116 HydrophobicContact CZ-CD2 4.36Å; F112-L116 HydrophobicContact CZ-CG 3.98Å; F112-L116 PolarHBondContact O-N 3.49Å; I113-L116 PolarHBondContact O-N 3.43Å; L116-K119 WeakPolarHBondContact O-CB 3.31Å; L116-K119 PolarHBondContact O-N 3.48Å; L116-K119 VanDerWaalsContact O-N 3.13Å; L116-G120 PolarHBondContact O-N 2.83Å; L116-V121 HydrophobicContact CB-CB 4.45Å; L116-V121 HydrophobicContact CD2-CB 4.46Å; L116-V121 HydrophobicContact CD2-CG2 4.49Å; L116-V121 PolarHBondContact O-N 3.34Å; L116-V121 VanDerWaalsContact O-N 3.1Å; L116-L122 HydrophobicContact CB-CD1 3.45Å; L116-L122 VanDerWaalsContact CB-CD1 3.45Å; L116-L122 HydrophobicContact CB-CG 3.7Å; L116-L122 HydrophobicContact CD1-CD1 3.79Å; L116-L122 HydrophobicContact CD1-CG 4.15Å; L116-L122 HydrophobicContact CG-CD1 4.28Å; L116-A131 HydrophobicContact CD1-CB 4.48Å; L116-L134 HydrophobicContact CD1-CD1 3.78Å
117	S	89.2	Confident	88.6	Confident	53 Å²	53	74.3 Å²	74.3	37%	0.371	38%	0.38	S	S	.	.	H	α-helix	trans	-63.1	-42.1	175.8	179.9	0	0	0	0	111.7	I113 K119 G120	I113-S117 WeakPolarHBondContact O-CB 3.41Å; I113-S117 PolarHBondContact O-N 3.15Å; S117-K119 PolarHBondContact O-N 2.93Å; S117-G120 PolarHBondContact O-N 2.93Å
118	K	90	Very high	88.4	Confident	168 Å²	168	77.8 Å²	77.8	73%	0.73	39%	0.39	S	S	*	.	H	α-helix	trans	-62.3	-27.3	173.4	-75.9	-177.5	178.5	-167.2	0	113.8	L114 G120	L114-K118 WeakPolarHBondContact O-CB 3.38Å; L114-K118 WeakPolarHBondContact O-CG 3.48Å; L114-K118 PolarHBondContact O-N 3.35Å; K118-G120 VanDerWaalsContact C-N 3.28Å
119	K	89.1	Confident	88.2	Confident	144 Å²	144	81.2 Å²	81.2	63%	0.626	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-3.5	174.7	-72.9	-177.3	168.8	-154.7	0	113.3	K115 L116 S117 V121	K115-K119 WeakPolarHBondContact O-CG 2.9Å; K115-K119 PolarHBondContact O-N 2.92Å; L116-K119 WeakPolarHBondContact O-CB 3.31Å; L116-K119 PolarHBondContact O-N 3.48Å; L116-K119 VanDerWaalsContact O-N 3.13Å; S117-K119 PolarHBondContact O-N 2.93Å; K119-V121 VanDerWaalsContact C-N 3.25Å; K119-V121 HydrophobicContact CB-CG2 3.92Å; K119-V121 PolarHBondContact O-N 2.92Å
120	G	84.9	Confident	87.9	Confident	54 Å²	54	81 Å²	81	56%	0.557	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	77	3.9	-175.9	0	0	0	0	0	115	L116 S117 K118 L122	L116-G120 PolarHBondContact O-N 2.83Å; S117-G120 PolarHBondContact O-N 2.93Å; K118-G120 VanDerWaalsContact C-N 3.28Å; G120-L122 VanDerWaalsContact C-N 3.3Å; G120-L122 PolarHBondContact O-N 2.76Å
121	V	80.5	Confident	87.8	Confident	67 Å²	67	78.9 Å²	78.9	41%	0.406	40%	0.398	S	S	.	.	S	Bend	trans	-70.2	-30.5	-178.2	-175.3	0	0	0	0	111.4	L116 K119	L116-V121 HydrophobicContact CB-CB 4.45Å; L116-V121 HydrophobicContact CD2-CB 4.46Å; L116-V121 HydrophobicContact CD2-CG2 4.49Å; L116-V121 PolarHBondContact O-N 3.34Å; L116-V121 VanDerWaalsContact O-N 3.1Å; K119-V121 VanDerWaalsContact C-N 3.25Å; K119-V121 HydrophobicContact CB-CG2 3.92Å; K119-V121 PolarHBondContact O-N 2.92Å
122	L	79.4	Confident	87.7	Confident	1 Å²	1	78.6 Å²	78.6	1%	0.005	40%	0.402	C	S	.	.			trans	-112.9	75.6	-173.7	-71	-177.4	0	0	0	111.9	I113 L116 G120 R127 E130 A131	I113-L122 HydrophobicContact CG2-CD1 4.03Å; L116-L122 HydrophobicContact CB-CD1 3.45Å; L116-L122 VanDerWaalsContact CB-CD1 3.45Å; L116-L122 HydrophobicContact CB-CG 3.7Å; L116-L122 HydrophobicContact CD1-CD1 3.79Å; L116-L122 HydrophobicContact CD1-CG 4.15Å; L116-L122 HydrophobicContact CG-CD1 4.28Å; G120-L122 VanDerWaalsContact C-N 3.3Å; G120-L122 PolarHBondContact O-N 2.76Å; L122-R127 HydrophobicContact CB-CB 3.93Å; L122-R127 HydrophobicContact CD2-CB 3.88Å; L122-R127 VanDerWaalsContact CD2-O 3.25Å; L122-R127 WeakPolarHBondContact CD2-O 3.21Å; L122-R127 HydrophobicContact CG-CB 4.36Å; L122-E130 HydrophobicContact CD2-CB 4.39Å; L122-E130 WeakPolarHBondContact CD2-OE2 3.33Å; L122-A131 HydrophobicContact CD1-CB 3.78Å; L122-A131 HydrophobicContact CD2-CB 4.33Å
123	N	75	Confident	87.6	Confident	143 Å²	143	83.4 Å²	83.4	77%	0.765	43%	0.426	S	S	*	.			trans	-127.4	40.5	179.2	-159.7	27.7	0	0	0	114.8
124	H	81.5	Confident	87.5	Confident	88 Å²	88	85 Å²	85	41%	0.407	44%	0.435	S	S	.	.	S	Bend	trans	-144.1	174.9	179.1	59.9	-87.8	0	0	0	112.2	D126 R127 E130	H124-D126 VanDerWaalsContact C-N 3.34Å; H124-D126 PolarHBondContact CD2-N 3.36Å; H124-D126 PolarHBondContact O-N 3.46Å; H124-R127 WeakPolarHBondContact O-CB 3.38Å; H124-R127 WeakPolarHBondContact O-CG 3.48Å; H124-R127 PolarHBondContact O-N 2.86Å; H124-E130 IonicContact CE1-OE2 2.7Å; H124-E130 PolarHBondContact CE1-OE2 2.99Å; H124-E130 IonicContact NE2-OE2 3.06Å
125	K	82.1	Confident	87.6	Confident	201 Å²	201	83.7 Å²	83.7	87%	0.874	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-40.6	-172.9	-71.1	-177.1	178.7	177.4	0	113.1	R127	K125-R127 PolarHBondContact O-N 3.08Å
126	D	85.4	Confident	87.6	Confident	106 Å²	106	86.3 Å²	86.3	57%	0.567	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.5	15.8	-175.3	-57.6	-57.5	0	0	0	115.2	H124 F128 S129 E130	H124-D126 VanDerWaalsContact C-N 3.34Å; H124-D126 PolarHBondContact CD2-N 3.36Å; H124-D126 PolarHBondContact O-N 3.46Å; D126-F128 PolarHBondContact O-N 2.97Å; D126-S129 WeakPolarHBondContact O-CB 3.25Å; D126-S129 PolarHBondContact O-N 3.05Å; D126-E130 PolarHBondContact O-N 2.94Å; D126-E130 VanDerWaalsContact O-N 3.11Å
127	R	87.1	Confident	87.7	Confident	92 Å²	92	92.6 Å²	92.6	35%	0.347	47%	0.465	S	S	.	.	H	α-helix	trans	-52.7	-32	-176.5	66.2	179.8	-175.9	-177.3	-4.7	114.9	L122 H124 K125 A131	L122-R127 HydrophobicContact CB-CB 3.93Å; L122-R127 HydrophobicContact CD2-CB 3.88Å; L122-R127 VanDerWaalsContact CD2-O 3.25Å; L122-R127 WeakPolarHBondContact CD2-O 3.21Å; L122-R127 HydrophobicContact CG-CB 4.36Å; H124-R127 WeakPolarHBondContact O-CB 3.38Å; H124-R127 WeakPolarHBondContact O-CG 3.48Å; H124-R127 PolarHBondContact O-N 2.86Å; K125-R127 PolarHBondContact O-N 3.08Å; R127-A131 WeakPolarHBondContact O-CB 3.39Å; R127-A131 PolarHBondContact O-N 3.23Å
128	F	89.8	Confident	87.8	Confident	116 Å²	116	91.4 Å²	91.4	51%	0.509	45%	0.454	S	S	.	.	H	α-helix	trans	-74.1	-37.6	179.9	-67.4	-69	0	0	0	112	I113 D126 A131 A132	I113-F128 HydrophobicContact CD1-CD1 3.99Å; I113-F128 HydrophobicContact CD1-CE1 4.34Å; I113-F128 HydrophobicContact CG2-CE1 4.36Å; D126-F128 PolarHBondContact O-N 2.97Å; F128-A131 PolarHBondContact O-N 3.17Å; F128-A132 WeakPolarHBondContact O-CB 3.35Å; F128-A132 PolarHBondContact O-N 3.19Å
129	S	89.6	Confident	87.9	Confident	75 Å²	75	87.2 Å²	87.2	52%	0.524	44%	0.439	S	S	.	.	H	α-helix	trans	-67.2	-45.8	177	-57.4	0	0	0	0	110.5	D126 A132 M133	D126-S129 WeakPolarHBondContact O-CB 3.25Å; D126-S129 PolarHBondContact O-N 3.05Å; S129-A132 WeakPolarHBondContact O-CB 3.32Å; S129-A132 PolarHBondContact O-N 2.71Å; S129-M133 WeakPolarHBondContact O-CG 3.48Å; S129-M133 PolarHBondContact O-N 2.94Å
130	E	89.4	Confident	88	Confident	60 Å²	60	85.4 Å²	85.4	28%	0.28	44%	0.443	S	S	.	.	H	α-helix	trans	-61.9	-45.9	174.7	-169.2	-168.9	-167.7	0	0	111.5	L122 H124 D126 A132 M133 L134	L122-E130 HydrophobicContact CD2-CB 4.39Å; L122-E130 WeakPolarHBondContact CD2-OE2 3.33Å; H124-E130 IonicContact CE1-OE2 2.7Å; H124-E130 PolarHBondContact CE1-OE2 2.99Å; H124-E130 IonicContact NE2-OE2 3.06Å; D126-E130 PolarHBondContact O-N 2.94Å; D126-E130 VanDerWaalsContact O-N 3.11Å; E130-A132 PolarHBondContact O-N 3.1Å; E130-M133 PolarHBondContact O-N 2.73Å; E130-M133 VanDerWaalsContact O-N 3.1Å; E130-L134 HydrophobicContact CG-CD1 4.19Å; E130-L134 HydrophobicContact CG-CG 4.41Å; E130-L134 WeakPolarHBondContact O-CG 3.35Å; E130-L134 PolarHBondContact O-N 3.21Å
131	A	91.5	Very high	88.4	Confident	0 Å²	0	86.3 Å²	86.3	0%	0	45%	0.445	C	S	.	.	H	α-helix	trans	-59.6	-36.1	175.7	0	0	0	0	0	112.4	F109 F112 I113 L116 L122 R127 F128 W135	F109-A131 HydrophobicContact CE2-CB 4.43Å; F109-A131 HydrophobicContact CZ-CB 4.39Å; F112-A131 WeakPolarHBondContact CE1-O 3.48Å; I113-A131 HydrophobicContact CD1-CB 4.45Å; I113-A131 HydrophobicContact CG1-CB 3.69Å; L116-A131 HydrophobicContact CD1-CB 4.48Å; L122-A131 HydrophobicContact CD1-CB 3.78Å; L122-A131 HydrophobicContact CD2-CB 4.33Å; R127-A131 WeakPolarHBondContact O-CB 3.39Å; R127-A131 PolarHBondContact O-N 3.23Å; F128-A131 PolarHBondContact O-N 3.17Å; A131-W135 WeakPolarHBondContact O-CB 3.49Å; A131-W135 PolarHBondContact O-N 3.39Å
132	A	93.3	Very high	89	Confident	37 Å²	37	88.1 Å²	88.1	31%	0.306	45%	0.447	S	S	.	.	H	α-helix	trans	-65.8	-41.5	175.7	0	0	0	0	0	111.8	F109 F128 S129 E130 W135 K136	F109-A132 HydrophobicContact CZ-CB 4.11Å; F128-A132 WeakPolarHBondContact O-CB 3.35Å; F128-A132 PolarHBondContact O-N 3.19Å; S129-A132 WeakPolarHBondContact O-CB 3.32Å; S129-A132 PolarHBondContact O-N 2.71Å; E130-A132 PolarHBondContact O-N 3.1Å; A132-W135 PolarHBondContact O-N 3.23Å; A132-K136 WeakPolarHBondContact O-CG 3.35Å; A132-K136 PolarHBondContact O-N 3.23Å
133	M	92.5	Very high	89.6	Confident	112 Å²	112	90.5 Å²	90.5	55%	0.552	46%	0.457	S	S	*	.	H	α-helix	trans	-63.5	-50.2	174.3	-66.5	-169.1	-63.8	0	0	111.5	S129 E130 W135 K136 Q137	S129-M133 WeakPolarHBondContact O-CG 3.48Å; S129-M133 PolarHBondContact O-N 2.94Å; E130-M133 PolarHBondContact O-N 2.73Å; E130-M133 VanDerWaalsContact O-N 3.1Å; M133-W135 VanDerWaalsContact C-N 3.26Å; M133-W135 PolarHBondContact O-N 2.78Å; M133-K136 PolarHBondContact O-N 3.07Å; M133-K136 VanDerWaalsContact O-N 3.09Å; M133-Q137 PolarHBondContact O-N 3.09Å
134	L	91.6	Very high	90.5	Very high	57 Å²	57	88.8 Å²	88.8	30%	0.298	45%	0.445	S	S	.	.	H	α-helix	trans	-59.8	-37.9	176.9	-69.3	174.8	0	0	0	111.6	F112 L116 E130 Q137 L138	F112-L134 HydrophobicContact CE1-CB 4.05Å; F112-L134 HydrophobicContact CZ-CB 3.86Å; L116-L134 HydrophobicContact CD1-CD1 3.78Å; E130-L134 HydrophobicContact CG-CD1 4.19Å; E130-L134 HydrophobicContact CG-CG 4.41Å; E130-L134 WeakPolarHBondContact O-CG 3.35Å; E130-L134 PolarHBondContact O-N 3.21Å; L134-Q137 PolarHBondContact O-N 3.04Å; L134-L138 WeakPolarHBondContact O-CB 3.33Å; L134-L138 PolarHBondContact O-N 3.36Å
135	W	93.7	Very high	91.2	Very high	51 Å²	51	91.6 Å²	91.6	19%	0.193	46%	0.456	C	S	.	.	H	α-helix	trans	-64.3	-42.7	175.1	179.4	-102.6	0	0	0	111.5	A108 F109 F112 A131 A132 M133 Q137 L138 K143 F146	A108-W135 HydrophobicContact CB-CH2 3.98Å; A108-W135 HydrophobicContact CB-CZ2 4.37Å; F109-W135 HydrophobicContact CD2-CB 3.77Å; F109-W135 AromaticContact CD2-CD2 3.85Å; F109-W135 HydrophobicContact CD2-CD2 3.85Å; F109-W135 HydrophobicContact CD2-CE3 4.33Å; F109-W135 AromaticContact CD2-CG 3.58Å; F109-W135 HydrophobicContact CD2-CG 3.58Å; F109-W135 HydrophobicContact CE2-CB 3.65Å; F109-W135 AromaticContact CE2-CG 3.98Å; F109-W135 HydrophobicContact CE2-CG 3.98Å; F112-W135 HydrophobicContact CB-CE3 3.66Å; F112-W135 HydrophobicContact CB-CZ3 3.66Å; F112-W135 HydrophobicContact CD1-CB 4.11Å; F112-W135 HydrophobicContact CD1-CD2 4.47Å; F112-W135 AromaticContact CD1-CE3 3.71Å; F112-W135 HydrophobicContact CD1-CE3 3.71Å; F112-W135 HydrophobicContact CD2-CE3 4.07Å; F112-W135 HydrophobicContact CD2-CZ3 4.34Å; F112-W135 HydrophobicContact CE1-CB 3.98Å; F112-W135 HydrophobicContact CE1-CE3 4.34Å; F112-W135 AromaticContact CG-CE3 3.54Å; F112-W135 HydrophobicContact CG-CE3 3.54Å; F112-W135 AromaticContact CG-CZ3 3.96Å; F112-W135 HydrophobicContact CG-CZ3 3.96Å; A131-W135 WeakPolarHBondContact O-CB 3.49Å; A131-W135 PolarHBondContact O-N 3.39Å; A132-W135 PolarHBondContact O-N 3.23Å; M133-W135 VanDerWaalsContact C-N 3.26Å; M133-W135 PolarHBondContact O-N 2.78Å; W135-Q137 VanDerWaalsContact C-N 3.35Å; W135-Q137 PolarHBondContact O-N 3.28Å; W135-L138 HydrophobicContact CE3-CD2 3.91Å; W135-L138 HydrophobicContact CZ3-CD2 3.95Å; W135-L138 WeakPolarHBondContact O-CB 3.44Å; W135-L138 PolarHBondContact O-N 3.4Å; W135-K143 HydrophobicContact CH2-CB 4.35Å; W135-K143 HydrophobicContact CH2-CG 4.22Å; W135-K143 HydrophobicContact CZ2-CG 4.31Å; W135-K143 HydrophobicContact CZ3-CG 4.37Å; W135-K143 WeakPolarHBondContact O-CE 3.36Å; W135-K143 PolarHBondContact O-NZ 2.98Å; W135-F146 HydrophobicContact CH2-CB 4.04Å; W135-F146 HydrophobicContact CH2-CD2 4.44Å; W135-F146 HydrophobicContact CZ3-CB 4.21Å; W135-F146 AromaticContact CZ3-CD2 3.89Å; W135-F146 HydrophobicContact CZ3-CD2 3.89Å; W135-F146 HydrophobicContact CZ3-CG 4.19Å
136	K	93.3	Very high	91.8	Very high	166 Å²	166	82.9 Å²	82.9	72%	0.722	42%	0.418	S	S	*	.	H	α-helix	trans	-61.5	-43.9	176.3	-73	179.2	180	-175.6	0	111.7	A132 M133 L138 K143	A132-K136 WeakPolarHBondContact O-CG 3.35Å; A132-K136 PolarHBondContact O-N 3.23Å; M133-K136 PolarHBondContact O-N 3.07Å; M133-K136 VanDerWaalsContact O-N 3.09Å; K136-L138 VanDerWaalsContact C-N 3.3Å; K136-L138 PolarHBondContact O-N 3.22Å; K136-K143 PolarHBondContact O-NZ 3.38Å
137	Q	92.5	Very high	92.2	Very high	153 Å²	153	81.3 Å²	81.3	72%	0.715	41%	0.409	S	S	*	.	H	α-helix	trans	-77.8	-10.3	179.9	-64.4	176.6	6	0	0	114.2	M133 L134 W135 D139	M133-Q137 PolarHBondContact O-N 3.09Å; L134-Q137 PolarHBondContact O-N 3.04Å; W135-Q137 VanDerWaalsContact C-N 3.35Å; W135-Q137 PolarHBondContact O-N 3.28Å; Q137-D139 PolarHBondContact O-N 3.49Å
138	L	91.4	Very high	92.5	Very high	29 Å²	29	83.3 Å²	83.3	15%	0.152	42%	0.42	C	S	.	.	S	Bend	trans	-65.4	133.5	-177.9	-171.6	69.5	0	0	0	111.3	F112 L134 W135 K136 K142 K143 F146	F112-L138 HydrophobicContact CD2-CD2 4.03Å; F112-L138 HydrophobicContact CE2-CD1 4.25Å; F112-L138 HydrophobicContact CE2-CD2 3.89Å; L134-L138 WeakPolarHBondContact O-CB 3.33Å; L134-L138 PolarHBondContact O-N 3.36Å; W135-L138 HydrophobicContact CE3-CD2 3.91Å; W135-L138 HydrophobicContact CZ3-CD2 3.95Å; W135-L138 WeakPolarHBondContact O-CB 3.44Å; W135-L138 PolarHBondContact O-N 3.4Å; K136-L138 VanDerWaalsContact C-N 3.3Å; K136-L138 PolarHBondContact O-N 3.22Å; L138-K142 HydrophobicContact CD1-CB 3.86Å; L138-K142 HydrophobicContact CD1-CD 3.83Å; L138-K142 HydrophobicContact CD2-CB 4.11Å; L138-K142 HydrophobicContact CG-CB 3.82Å; L138-K143 HydrophobicContact CB-CG 4.02Å; L138-K143 HydrophobicContact CD2-CG 3.8Å; L138-K143 HydrophobicContact CG-CG 4.05Å; L138-K143 WeakPolarHBondContact O-CD 3.46Å; L138-K143 WeakPolarHBondContact O-CE 3.46Å; L138-K143 PolarHBondContact O-NZ 3.33Å; L138-K143 VanDerWaalsContact O-NZ 3.15Å; L138-F146 HydrophobicContact CD2-CD2 4.34Å; L138-F146 HydrophobicContact CD2-CE2 4.12Å
139	D	92.4	Very high	92.7	Very high	79 Å²	79	84.2 Å²	84.2	42%	0.422	42%	0.424	S	S	.	.			trans	-49.4	136.9	176.7	-57.9	-39.1	0	0	0	111.7	Q137 A141 K142 K143	Q137-D139 PolarHBondContact O-N 3.49Å; D139-A141 PolarHBondContact O-N 3.01Å; D139-K142 HydrophobicContact CB-CB 4.31Å; D139-K142 HydrophobicContact CB-CD 4.16Å; D139-K142 HydrophobicContact CB-CG 4.23Å; D139-K142 WeakPolarHBondContact O-CA 3.37Å; D139-K142 PolarHBondContact O-N 3.46Å; D139-K142 WeakPolarHBondContact OD2-CD 3.31Å; D139-K142 VanDerWaalsContact OD2-CE 3.24Å; D139-K142 WeakPolarHBondContact OD2-CE 3.14Å; D139-K142 IonicContact OD2-NZ 2.8Å; D139-K142 PolarHBondContact OD2-NZ 3.34Å; D139-K143 PolarHBondContact O-N 2.97Å
140	P	92.2	Very high	93	Very high	107 Å²	107	83.1 Å²	83.1	70%	0.695	41%	0.411	S	S	*	.	H	α-helix	trans	-52.1	-41.4	177.5	-27.8	34.9	0	0	0	112.9	K142 K143 E144	P140-K142 VanDerWaalsContact C-N 3.3Å; P140-K142 PolarHBondContact O-N 3.31Å; P140-K143 WeakPolarHBondContact O-CB 3.5Å; P140-K143 PolarHBondContact O-N 3.11Å; P140-E144 WeakPolarHBondContact O-CB 3.42Å; P140-E144 PolarHBondContact O-N 2.94Å
141	A	92.3	Very high	93.2	Very high	72 Å²	72	89.3 Å²	89.3	60%	0.595	43%	0.432	S	S	*	.	H	α-helix	trans	-63.7	-32.4	177.6	0	0	0	0	0	113.5	D139	D139-A141 PolarHBondContact O-N 3.01Å
142	K	92.3	Very high	93.3	Very high	106 Å²	106	94.4 Å²	94.4	46%	0.461	46%	0.458	S	S	.	.	H	α-helix	trans	-78.1	-39.5	175.4	-71.2	173.1	-174.4	151.5	0	110.9	L138 D139 P140 E144 K145 F146	L138-K142 HydrophobicContact CD1-CB 3.86Å; L138-K142 HydrophobicContact CD1-CD 3.83Å; L138-K142 HydrophobicContact CD2-CB 4.11Å; L138-K142 HydrophobicContact CG-CB 3.82Å; D139-K142 HydrophobicContact CB-CB 4.31Å; D139-K142 HydrophobicContact CB-CD 4.16Å; D139-K142 HydrophobicContact CB-CG 4.23Å; D139-K142 WeakPolarHBondContact O-CA 3.37Å; D139-K142 PolarHBondContact O-N 3.46Å; D139-K142 WeakPolarHBondContact OD2-CD 3.31Å; D139-K142 VanDerWaalsContact OD2-CE 3.24Å; D139-K142 WeakPolarHBondContact OD2-CE 3.14Å; D139-K142 IonicContact OD2-NZ 2.8Å; D139-K142 PolarHBondContact OD2-NZ 3.34Å; P140-K142 VanDerWaalsContact C-N 3.3Å; P140-K142 PolarHBondContact O-N 3.31Å; K142-E144 VanDerWaalsContact C-N 3.3Å; K142-E144 PolarHBondContact O-N 3.44Å; K142-K145 WeakPolarHBondContact O-CB 3.14Å; K142-K145 PolarHBondContact O-N 3.18Å; K142-F146 VanDerWaalsContact O-CD2 3.23Å; K142-F146 WeakPolarHBondContact O-CD2 3.38Å
143	K	93.3	Very high	93.3	Very high	50 Å²	50	94.3 Å²	94.3	22%	0.217	46%	0.458	C	S	.	.	H	α-helix	trans	-57.3	-44.6	172.4	-74.8	175.2	174.5	156.7	0	111.2	W135 K136 L138 D139 P140 K145 F146 L147	W135-K143 HydrophobicContact CH2-CB 4.35Å; W135-K143 HydrophobicContact CH2-CG 4.22Å; W135-K143 HydrophobicContact CZ2-CG 4.31Å; W135-K143 HydrophobicContact CZ3-CG 4.37Å; W135-K143 WeakPolarHBondContact O-CE 3.36Å; W135-K143 PolarHBondContact O-NZ 2.98Å; K136-K143 PolarHBondContact O-NZ 3.38Å; L138-K143 HydrophobicContact CB-CG 4.02Å; L138-K143 HydrophobicContact CD2-CG 3.8Å; L138-K143 HydrophobicContact CG-CG 4.05Å; L138-K143 WeakPolarHBondContact O-CD 3.46Å; L138-K143 WeakPolarHBondContact O-CE 3.46Å; L138-K143 PolarHBondContact O-NZ 3.33Å; L138-K143 VanDerWaalsContact O-NZ 3.15Å; D139-K143 PolarHBondContact O-N 2.97Å; P140-K143 WeakPolarHBondContact O-CB 3.5Å; P140-K143 PolarHBondContact O-N 3.11Å; K143-K145 PolarHBondContact O-N 2.95Å; K143-F146 WeakPolarHBondContact O-CB 3.03Å; K143-F146 PolarHBondContact O-N 2.94Å; K143-L147 PolarHBondContact O-N 3.02Å
144	E	94.4	Very high	93.3	Very high	107 Å²	107	93.2 Å²	93.2	50%	0.5	45%	0.453	S	S	.	.	H	α-helix	trans	-57.9	-36.3	-179.4	-174	54.1	-148.8	0	0	112.4	P140 K142 F146 L147 K148	P140-E144 WeakPolarHBondContact O-CB 3.42Å; P140-E144 PolarHBondContact O-N 2.94Å; K142-E144 VanDerWaalsContact C-N 3.3Å; K142-E144 PolarHBondContact O-N 3.44Å; E144-F146 VanDerWaalsContact C-N 3.26Å; E144-F146 PolarHBondContact O-N 3.39Å; E144-L147 PolarHBondContact O-N 2.94Å; E144-K148 WeakPolarHBondContact O-CB 3.42Å; E144-K148 PolarHBondContact O-N 3.3Å
145	K	94.5	Very high	93.3	Very high	147 Å²	147	95.6 Å²	95.6	64%	0.639	47%	0.466	S	S	*	.	H	α-helix	trans	-59.8	-35.5	174.6	-66.5	179.4	-178.1	-177.6	0	112.7	K142 K143 K149	K142-K145 WeakPolarHBondContact O-CB 3.14Å; K142-K145 PolarHBondContact O-N 3.18Å; K143-K145 PolarHBondContact O-N 2.95Å; K145-K149 VanDerWaalsContact O-CG 3.31Å; K145-K149 WeakPolarHBondContact O-CG 3.36Å; K145-K149 PolarHBondContact O-N 3.24Å
146	F	94.7	Very high	93.2	Very high	18 Å²	18	100.4 Å²	100.4	8%	0.079	49%	0.488	C	S	.	.	H	α-helix	trans	-78.7	-39.4	176.9	-65.8	-81.4	0	0	0	111.8	A108 L111 F112 K115 W135 L138 K142 K143 E144 K149 Q150	A108-F146 HydrophobicContact CB-CB 3.87Å; L111-F146 HydrophobicContact CB-CD1 3.82Å; L111-F146 HydrophobicContact CB-CE1 4.39Å; F112-F146 HydrophobicContact CB-CD1 4.36Å; F112-F146 HydrophobicContact CB-CE1 4.15Å; F112-F146 HydrophobicContact CB-CE2 4.42Å; F112-F146 HydrophobicContact CB-CZ 4.17Å; F112-F146 AromaticContact CD2-CE2 3.82Å; F112-F146 HydrophobicContact CD2-CE2 3.82Å; F112-F146 AromaticContact CD2-CZ 3.78Å; F112-F146 HydrophobicContact CD2-CZ 3.78Å; F112-F146 HydrophobicContact CG-CZ 4.49Å; K115-F146 HydrophobicContact CB-CE1 4.36Å; K115-F146 HydrophobicContact CB-CZ 4.46Å; K115-F146 HydrophobicContact CD-CE1 4.09Å; K115-F146 HydrophobicContact CD-CZ 3.65Å; W135-F146 HydrophobicContact CH2-CB 4.04Å; W135-F146 HydrophobicContact CH2-CD2 4.44Å; W135-F146 HydrophobicContact CZ3-CB 4.21Å; W135-F146 AromaticContact CZ3-CD2 3.89Å; W135-F146 HydrophobicContact CZ3-CD2 3.89Å; W135-F146 HydrophobicContact CZ3-CG 4.19Å; L138-F146 HydrophobicContact CD2-CD2 4.34Å; L138-F146 HydrophobicContact CD2-CE2 4.12Å; K142-F146 VanDerWaalsContact O-CD2 3.23Å; K142-F146 WeakPolarHBondContact O-CD2 3.38Å; K143-F146 WeakPolarHBondContact O-CB 3.03Å; K143-F146 PolarHBondContact O-N 2.94Å; E144-F146 VanDerWaalsContact C-N 3.26Å; E144-F146 PolarHBondContact O-N 3.39Å; F146-K149 PolarHBondContact O-N 3.09Å; F146-Q150 PolarHBondContact O-N 3.18Å
147	L	94.4	Very high	93.1	Very high	73 Å²	73	93.9 Å²	93.9	38%	0.382	46%	0.46	S	S	.	.	H	α-helix	trans	-62.4	-45.6	175.5	-66.2	173.3	0	0	0	111.4	A108 K143 E144 K149 Q150 R151	A108-L147 HydrophobicContact CB-CD2 3.7Å; A108-L147 HydrophobicContact CB-CG 4.3Å; K143-L147 PolarHBondContact O-N 3.02Å; E144-L147 PolarHBondContact O-N 2.94Å; L147-K149 VanDerWaalsContact C-N 3.34Å; L147-K149 PolarHBondContact O-N 2.87Å; L147-Q150 WeakPolarHBondContact O-CB 3.28Å; L147-Q150 PolarHBondContact O-N 3.45Å; L147-Q150 VanDerWaalsContact O-N 3.14Å; L147-R151 PolarHBondContact O-N 3.22Å
148	K	94.6	Very high	93	Very high	135 Å²	135	88 Å²	88	59%	0.587	44%	0.441	S	S	*	.	H	α-helix	trans	-58.7	-43.3	174.3	-173.2	173.4	-176.9	173.2	0	112.1	E144 R151 L152	E144-K148 WeakPolarHBondContact O-CB 3.42Å; E144-K148 PolarHBondContact O-N 3.3Å; K148-R151 PolarHBondContact O-N 3.41Å; K148-L152 HydrophobicContact CG-CD1 4.48Å; K148-L152 WeakPolarHBondContact O-CG 3.31Å; K148-L152 PolarHBondContact O-N 2.9Å
149	K	93.7	Very high	93	Very high	134 Å²	134	93.9 Å²	93.9	58%	0.583	47%	0.465	S	S	*	.	H	α-helix	trans	-61.8	-43.3	174.7	-78.4	-179.2	-179.5	-168.2	0	112	L111 K145 F146 L147 A153	L111-K149 HydrophobicContact CD1-CB 4.09Å; K145-K149 VanDerWaalsContact O-CG 3.31Å; K145-K149 WeakPolarHBondContact O-CG 3.36Å; K145-K149 PolarHBondContact O-N 3.24Å; F146-K149 PolarHBondContact O-N 3.09Å; L147-K149 VanDerWaalsContact C-N 3.34Å; L147-K149 PolarHBondContact O-N 2.87Å; K149-A153 VanDerWaalsContact O-CB 3.3Å; K149-A153 WeakPolarHBondContact O-CB 3.43Å; K149-A153 PolarHBondContact O-N 2.92Å
150	Q	94.6	Very high	92.9	Very high	52 Å²	52	94.6 Å²	94.6	24%	0.243	47%	0.466	C	S	.	.	H	α-helix	trans	-62.1	-45.5	175.7	-177.2	-172.2	15	0	0	111.4	A108 F146 L147 L152 A153 L154	A108-Q150 HydrophobicContact CB-CB 4.3Å; F146-Q150 PolarHBondContact O-N 3.18Å; L147-Q150 WeakPolarHBondContact O-CB 3.28Å; L147-Q150 PolarHBondContact O-N 3.45Å; L147-Q150 VanDerWaalsContact O-N 3.14Å; Q150-L152 PolarHBondContact O-N 2.95Å; Q150-A153 PolarHBondContact O-N 2.89Å; Q150-L154 HydrophobicContact CG-CD1 4.02Å; Q150-L154 HydrophobicContact CG-CG 4.47Å; Q150-L154 WeakPolarHBondContact O-CB 3.5Å; Q150-L154 WeakPolarHBondContact O-CG 3.49Å; Q150-L154 PolarHBondContact O-N 3.44Å
151	R	93.5	Very high	92.6	Very high	191 Å²	191	90.4 Å²	90.4	72%	0.721	44%	0.439	S	S	*	.	H	α-helix	trans	-59.2	-48.3	178.7	-173.3	175.9	-177.1	150.1	2	111.7	L147 K148 A153 L154 L155	L147-R151 PolarHBondContact O-N 3.22Å; K148-R151 PolarHBondContact O-N 3.41Å; R151-A153 VanDerWaalsContact C-N 3.34Å; R151-A153 PolarHBondContact O-N 3.01Å; R151-L154 PolarHBondContact O-N 3.33Å; R151-L155 WeakPolarHBondContact O-CG 3.47Å; R151-L155 PolarHBondContact O-N 3.27Å
152	L	94.1	Very high	92.4	Very high	106 Å²	106	93.3 Å²	93.3	56%	0.555	44%	0.44	S	S	*	.	H	α-helix	trans	-62.5	-40.9	176.3	-70.4	173.9	0	0	0	112.2	K148 Q150 L155 K156	K148-L152 HydrophobicContact CG-CD1 4.48Å; K148-L152 WeakPolarHBondContact O-CG 3.31Å; K148-L152 PolarHBondContact O-N 2.9Å; Q150-L152 PolarHBondContact O-N 2.95Å; L152-L155 PolarHBondContact O-N 2.98Å; L152-K156 PolarHBondContact O-N 3.25Å
153	A	93.1	Very high	92.2	Very high	36 Å²	36	98 Å²	98	30%	0.298	46%	0.455	S	S	.	.	H	α-helix	trans	-66.1	-37.4	177.3	0	0	0	0	0	112.4	P105 K149 Q150 R151 K156 H157	P105-A153 HydrophobicContact CB-CB 3.68Å; P105-A153 HydrophobicContact CG-CB 4.37Å; K149-A153 VanDerWaalsContact O-CB 3.3Å; K149-A153 WeakPolarHBondContact O-CB 3.43Å; K149-A153 PolarHBondContact O-N 2.92Å; Q150-A153 PolarHBondContact O-N 2.89Å; R151-A153 VanDerWaalsContact C-N 3.34Å; R151-A153 PolarHBondContact O-N 3.01Å; A153-K156 PolarHBondContact O-N 3.16Å; A153-H157 WeakPolarHBondContact O-CB 3.45Å; A153-H157 PolarHBondContact O-N 3.41Å
154	L	92.8	Very high	91.9	Very high	88 Å²	88	96.5 Å²	96.5	46%	0.461	45%	0.448	S	S	.	.	H	α-helix	trans	-64.3	-43.4	174.1	-77.8	167	0	0	0	111.9	P105 Q150 R151 H157 G158	P105-L154 HydrophobicContact CG-CD2 3.6Å; P105-L154 HydrophobicContact CG-CG 3.94Å; Q150-L154 HydrophobicContact CG-CD1 4.02Å; Q150-L154 HydrophobicContact CG-CG 4.47Å; Q150-L154 WeakPolarHBondContact O-CB 3.5Å; Q150-L154 WeakPolarHBondContact O-CG 3.49Å; Q150-L154 PolarHBondContact O-N 3.44Å; R151-L154 PolarHBondContact O-N 3.33Å; L154-H157 PolarHBondContact O-N 3.46Å; L154-G158 PolarHBondContact O-N 3.27Å
155	L	91.7	Very high	91.4	Very high	108 Å²	108	95.3 Å²	95.3	57%	0.565	44%	0.441	S	S	*	.	H	α-helix	trans	-61.9	-44.8	175.4	-70.1	173.4	0	0	0	111.7	R151 L152 G158 K159	R151-L155 WeakPolarHBondContact O-CG 3.47Å; R151-L155 PolarHBondContact O-N 3.27Å; L152-L155 PolarHBondContact O-N 2.98Å; L155-G158 PolarHBondContact O-N 3.15Å; L155-K159 PolarHBondContact O-N 3.23Å
156	K	92.2	Very high	91	Very high	152 Å²	152	92.2 Å²	92.2	66%	0.661	44%	0.443	S	S	*	.	H	α-helix	trans	-62.1	-45	175.8	-175.4	178.5	177.2	-179.1	0	111.4	L152 A153 G158 K159 E160	L152-K156 PolarHBondContact O-N 3.25Å; A153-K156 PolarHBondContact O-N 3.16Å; K156-G158 VanDerWaalsContact C-N 3.33Å; K156-G158 PolarHBondContact O-N 2.96Å; K156-K159 PolarHBondContact O-N 3.38Å; K156-E160 PolarHBondContact O-N 2.96Å
157	H	91	Very high	90.6	Very high	28 Å²	28	94.6 Å²	94.6	13%	0.13	47%	0.466	C	S	.	.	H	α-helix	trans	-61.9	-39.7	178.7	178.1	59.6	0	0	0	112.2	P102 K103 P105 A153 L154 K159 E160 V161	P102-H157 PolarHBondContact O-CE1 3.24Å; P102-H157 VanDerWaalsContact O-CE1 3.27Å; K103-H157 PolarHBondContact O-CE1 3.26Å; K103-H157 VanDerWaalsContact O-CE1 3.26Å; K103-H157 PolarHBondContact O-ND1 2.86Å; K103-H157 VanDerWaalsContact O-ND1 3.15Å; P105-H157 HydrophobicContact CG-CB 4.14Å; A153-H157 WeakPolarHBondContact O-CB 3.45Å; A153-H157 PolarHBondContact O-N 3.41Å; L154-H157 PolarHBondContact O-N 3.46Å; H157-K159 PolarHBondContact O-N 3.37Å; H157-E160 PolarHBondContact O-N 2.81Å; H157-V161 VanDerWaalsContact CE1-CG2 3.43Å; H157-V161 WeakPolarHBondContact CE1-CG2 3.22Å; H157-V161 WeakPolarHBondContact O-CB 3.48Å; H157-V161 VanDerWaalsContact O-CG2 3.31Å; H157-V161 WeakPolarHBondContact O-CG2 3.22Å; H157-V161 PolarHBondContact O-N 3.05Å
158	G	90	Very high	89.9	Confident	31 Å²	31	93.4 Å²	93.4	32%	0.32	46%	0.458	S	S	.	.	H	α-helix	trans	-56.1	-50.6	174.2	0	0	0	0	0	112.1	L154 L155 K156 E160 V161 E162	L154-G158 PolarHBondContact O-N 3.27Å; L155-G158 PolarHBondContact O-N 3.15Å; K156-G158 VanDerWaalsContact C-N 3.33Å; K156-G158 PolarHBondContact O-N 2.96Å; G158-E160 VanDerWaalsContact C-N 3.32Å; G158-E160 PolarHBondContact O-N 2.92Å; G158-V161 PolarHBondContact O-N 2.87Å; G158-E162 WeakPolarHBondContact O-CG 3.47Å; G158-E162 PolarHBondContact O-N 3.33Å
159	K	91.3	Very high	89	Confident	151 Å²	151	90.9 Å²	90.9	66%	0.657	46%	0.456	S	S	*	.	H	α-helix	trans	-61.1	-39.2	176.6	-64.6	-178.8	180	-171.5	0	112.6	L155 K156 H157 E162 R163	L155-K159 PolarHBondContact O-N 3.23Å; K156-K159 PolarHBondContact O-N 3.38Å; H157-K159 PolarHBondContact O-N 3.37Å; K159-E162 PolarHBondContact O-N 3.25Å; K159-R163 WeakPolarHBondContact O-CB 3.44Å; K159-R163 PolarHBondContact O-N 3.02Å
160	E	89.7	Confident	88.1	Confident	94 Å²	94	90.1 Å²	90.1	44%	0.439	45%	0.454	S	S	.	.	H	α-helix	trans	-66.6	-42.3	178.6	-156.1	-175.6	170.5	0	0	111.6	P102 K156 H157 G158 E162 R163 F164	P102-E160 HydrophobicContact CB-CB 4.11Å; P102-E160 HydrophobicContact CB-CG 3.92Å; P102-E160 HydrophobicContact CG-CB 3.97Å; P102-E160 HydrophobicContact CG-CG 3.56Å; K156-E160 PolarHBondContact O-N 2.96Å; H157-E160 PolarHBondContact O-N 2.81Å; G158-E160 VanDerWaalsContact C-N 3.32Å; G158-E160 PolarHBondContact O-N 2.92Å; E160-E162 VanDerWaalsContact C-N 3.35Å; E160-R163 PolarHBondContact O-N 3.32Å; E160-F164 WeakPolarHBondContact O-CB 3.24Å; E160-F164 PolarHBondContact O-N 3.06Å
161	V	87.2	Confident	86.8	Confident	20 Å²	20	90.7 Å²	90.7	12%	0.121	46%	0.456	C	S	.	.	H	α-helix	trans	-65	-39	175.4	169.8	0	0	0	0	111.3	F101 P102 H157 G158 F164 K165	F101-V161 HydrophobicContact CE1-CG2 4.35Å; F101-V161 HydrophobicContact CE2-CG1 4.37Å; F101-V161 HydrophobicContact CZ-CG1 4.07Å; F101-V161 HydrophobicContact CZ-CG2 3.97Å; P102-V161 HydrophobicContact CB-CG2 3.91Å; P102-V161 HydrophobicContact CG-CG2 4.21Å; H157-V161 VanDerWaalsContact CE1-CG2 3.43Å; H157-V161 WeakPolarHBondContact CE1-CG2 3.22Å; H157-V161 WeakPolarHBondContact O-CB 3.48Å; H157-V161 VanDerWaalsContact O-CG2 3.31Å; H157-V161 WeakPolarHBondContact O-CG2 3.22Å; H157-V161 PolarHBondContact O-N 3.05Å; G158-V161 PolarHBondContact O-N 2.87Å; V161-F164 PolarHBondContact O-N 2.82Å; V161-K165 HydrophobicContact CG1-CD 4.23Å; V161-K165 VanDerWaalsContact O-CG 3.28Å; V161-K165 WeakPolarHBondContact O-CG 3.32Å; V161-K165 PolarHBondContact O-N 2.89Å
162	E	87.4	Confident	85.3	Confident	132 Å²	132	83.8 Å²	83.8	62%	0.617	44%	0.435	S	S	*	.	H	α-helix	trans	-64.9	-47.1	175.1	-74.1	173.9	169.3	0	0	111.7	G158 K159 E160 F164 K165 A166	G158-E162 WeakPolarHBondContact O-CG 3.47Å; G158-E162 PolarHBondContact O-N 3.33Å; K159-E162 PolarHBondContact O-N 3.25Å; E160-E162 VanDerWaalsContact C-N 3.35Å; E162-F164 VanDerWaalsContact C-N 3.31Å; E162-F164 PolarHBondContact O-N 2.76Å; E162-K165 PolarHBondContact O-N 3.18Å; E162-A166 PolarHBondContact O-N 3Å
163	R	88.5	Confident	83.6	Confident	206 Å²	206	83.8 Å²	83.8	78%	0.777	44%	0.436	S	S	*	.	H	α-helix	trans	-58.5	-43.7	174	179.1	-179.1	-97.1	-169	-7.3	111.4	K159 E160 A166 A167	K159-R163 WeakPolarHBondContact O-CB 3.44Å; K159-R163 PolarHBondContact O-N 3.02Å; E160-R163 PolarHBondContact O-N 3.32Å; R163-A166 PolarHBondContact O-N 3.06Å; R163-A167 PolarHBondContact O-N 2.98Å
164	F	87.5	Confident	81.9	Confident	18 Å²	18	84.5 Å²	84.5	8%	0.079	44%	0.441	C	S	.	.	H	α-helix	trans	-60.4	-47.9	177	-174.8	-84.1	0	0	0	111.3	P98 D100 F101 P102 E160 V161 E162 A166 A167 H168	P98-F164 HydrophobicContact CB-CZ 3.93Å; P98-F164 HydrophobicContact CG-CZ 3.93Å; D100-F164 HydrophobicContact CB-CE2 4.49Å; F101-F164 HydrophobicContact CB-CE2 4.48Å; F101-F164 HydrophobicContact CB-CZ 4.3Å; F101-F164 AromaticContact CD2-CD1 3.53Å; F101-F164 HydrophobicContact CD2-CD1 3.53Å; F101-F164 AromaticContact CD2-CE1 3.63Å; F101-F164 HydrophobicContact CD2-CE1 3.63Å; F101-F164 HydrophobicContact CD2-CG 4.08Å; F101-F164 HydrophobicContact CD2-CZ 4.23Å; F101-F164 HydrophobicContact CE2-CD1 4Å; F101-F164 HydrophobicContact CE2-CE1 4.41Å; P102-F164 HydrophobicContact CG-CB 4.11Å; E160-F164 WeakPolarHBondContact O-CB 3.24Å; E160-F164 PolarHBondContact O-N 3.06Å; V161-F164 PolarHBondContact O-N 2.82Å; E162-F164 VanDerWaalsContact C-N 3.31Å; E162-F164 PolarHBondContact O-N 2.76Å; F164-A166 VanDerWaalsContact C-N 3.26Å; F164-A166 PolarHBondContact O-N 3.45Å; F164-A167 PolarHBondContact O-N 3.23Å; F164-A167 VanDerWaalsContact O-N 3.16Å; F164-H168 HydrophobicContact CD1-CB 4.24Å; F164-H168 AromaticContact CD2-CD2 3.7Å; F164-H168 HydrophobicContact CE1-CB 3.82Å; F164-H168 AromaticContact CE1-CD2 3.79Å; F164-H168 AromaticContact CE1-CG 3.93Å; F164-H168 AromaticContact CE2-CD2 3.38Å; F164-H168 WeakPolarHBondContact CE2-CD2 3.37Å; F164-H168 AromaticContact CE2-NE2 3.75Å; F164-H168 HydrophobicContact CZ-CB 4.18Å; F164-H168 AromaticContact CZ-CD2 3.42Å; F164-H168 VanDerWaalsContact CZ-CD2 3.42Å; F164-H168 WeakPolarHBondContact CZ-CD2 3.2Å; F164-H168 AromaticContact CZ-CG 3.78Å; F164-H168 VanDerWaalsContact O-CB 3.31Å; F164-H168 WeakPolarHBondContact O-CB 3.48Å; F164-H168 PolarHBondContact O-CD2 3.04Å; F164-H168 PolarHBondContact O-N 3.44Å
165	K	83.6	Confident	80.2	Confident	82 Å²	82	82 Å²	82	36%	0.357	43%	0.428	S	S	.	.	H	α-helix	trans	-61.3	-34.5	177.4	-74.2	171	-179.4	176	0	113.1	V161 E162 H168 T172 L175	V161-K165 HydrophobicContact CG1-CD 4.23Å; V161-K165 VanDerWaalsContact O-CG 3.28Å; V161-K165 WeakPolarHBondContact O-CG 3.32Å; V161-K165 PolarHBondContact O-N 2.89Å; E162-K165 PolarHBondContact O-N 3.18Å; K165-H168 CarbonylContact O-C 3.46Å; K165-T172 HydrophobicContact CB-CG2 4.47Å; K165-L175 HydrophobicContact CD-CD1 4.48Å; K165-L175 HydrophobicContact CG-CD1 3.88Å
166	A	85.5	Confident	78.4	Confident	82 Å²	82	83.6 Å²	83.6	68%	0.678	43%	0.431	S	S	*	.	H	α-helix	trans	-70	-36.6	176.2	0	0	0	0	0	112.2	E162 R163 F164	E162-A166 PolarHBondContact O-N 3Å; R163-A166 PolarHBondContact O-N 3.06Å; F164-A166 VanDerWaalsContact C-N 3.26Å; F164-A166 PolarHBondContact O-N 3.45Å
167	A	85.7	Confident	76.5	Confident	67 Å²	67	81.8 Å²	81.8	55%	0.554	43%	0.432	S	S	*	.	H	α-helix	trans	-76.4	-25.1	175.8	0	0	0	0	0	113.4	R163 F164 P169	R163-A167 PolarHBondContact O-N 2.98Å; F164-A167 PolarHBondContact O-N 3.23Å; F164-A167 VanDerWaalsContact O-N 3.16Å; A167-P169 VanDerWaalsContact C-CD 3.42Å; A167-P169 WeakPolarHBondContact O-CD 3.25Å
168	H	79.5	Confident	74.6	Confident	49 Å²	49	86.9 Å²	86.9	23%	0.227	45%	0.454	C	S	.	.			trans	-126.3	63.6	-172.9	-68.8	-71.3	0	0	0	112.2	D100 F164 K165 E170 F171	D100-H168 IonicContact OD2-NE2 2.63Å; F164-H168 HydrophobicContact CD1-CB 4.24Å; F164-H168 AromaticContact CD2-CD2 3.7Å; F164-H168 HydrophobicContact CE1-CB 3.82Å; F164-H168 AromaticContact CE1-CD2 3.79Å; F164-H168 AromaticContact CE1-CG 3.93Å; F164-H168 AromaticContact CE2-CD2 3.38Å; F164-H168 WeakPolarHBondContact CE2-CD2 3.37Å; F164-H168 AromaticContact CE2-NE2 3.75Å; F164-H168 HydrophobicContact CZ-CB 4.18Å; F164-H168 AromaticContact CZ-CD2 3.42Å; F164-H168 VanDerWaalsContact CZ-CD2 3.42Å; F164-H168 WeakPolarHBondContact CZ-CD2 3.2Å; F164-H168 AromaticContact CZ-CG 3.78Å; F164-H168 VanDerWaalsContact O-CB 3.31Å; F164-H168 WeakPolarHBondContact O-CB 3.48Å; F164-H168 PolarHBondContact O-CD2 3.04Å; F164-H168 PolarHBondContact O-N 3.44Å; K165-H168 CarbonylContact O-C 3.46Å; H168-E170 VanDerWaalsContact C-OE2 3.22Å; H168-E170 WeakPolarHBondContact CA-OE2 3.32Å; H168-E170 WeakPolarHBondContact CB-OE1 3.39Å; H168-E170 IonicContact CG-OE1 2.92Å; H168-E170 IonicContact ND1-OE1 3.84Å; H168-E170 PolarHBondContact ND1-OE1 2.84Å; H168-E170 PolarHBondContact O-N 3.25Å; H168-F171 HydrophobicContact CB-CD2 4.03Å; H168-F171 PolarHBondContact O-N 3.45Å
169	P	76.9	Confident	72.5	Confident	81 Å²	81	95 Å²	95	53%	0.526	48%	0.475	S	S	.	.	G	3₁₀ helix	trans	-58.6	-29.7	-178.6	24.3	-33.6	0	0	0	113	A167 F171 T172	A167-P169 VanDerWaalsContact C-CD 3.42Å; A167-P169 WeakPolarHBondContact O-CD 3.25Å; P169-F171 PolarHBondContact O-N 3.39Å; P169-T172 WeakPolarHBondContact O-CB 3.27Å; P169-T172 WeakPolarHBondContact O-CG2 3.46Å; P169-T172 PolarHBondContact O-N 2.91Å; P169-T172 VanDerWaalsContact O-N 3.1Å; P169-T172 PolarHBondContact O-OG1 3.04Å
170	E	74	Confident	70	Confident	118 Å²	118	98.3 Å²	98.3	55%	0.551	48%	0.483	S	S	*	.	G	3₁₀ helix	trans	-61.1	-27.4	179.8	69.3	-74.2	172.1	0	0	113.7	H168	H168-E170 VanDerWaalsContact C-OE2 3.22Å; H168-E170 WeakPolarHBondContact CA-OE2 3.32Å; H168-E170 WeakPolarHBondContact CB-OE1 3.39Å; H168-E170 IonicContact CG-OE1 2.92Å; H168-E170 IonicContact ND1-OE1 3.84Å; H168-E170 PolarHBondContact ND1-OE1 2.84Å; H168-E170 PolarHBondContact O-N 3.25Å
171	F	66.9	Low	67.8	Low	65 Å²	65	99.6 Å²	99.6	29%	0.285	50%	0.5	S	S	.	.	G	3₁₀ helix	trans	-90.7	-6.4	179.2	-68.9	-80.3	0	0	0	113.4	P98 H168 P169 D173 A174 L175	P98-F171 HydrophobicContact CG-CD1 4.03Å; P98-F171 HydrophobicContact CG-CD2 3.92Å; P98-F171 HydrophobicContact CG-CE1 3.71Å; P98-F171 HydrophobicContact CG-CE2 3.59Å; P98-F171 HydrophobicContact CG-CG 4.14Å; P98-F171 HydrophobicContact CG-CZ 3.48Å; P98-F171 VanDerWaalsContact CG-CZ 3.48Å; H168-F171 HydrophobicContact CB-CD2 4.03Å; H168-F171 PolarHBondContact O-N 3.45Å; P169-F171 PolarHBondContact O-N 3.39Å; F171-D173 VanDerWaalsContact C-N 3.32Å; F171-D173 PolarHBondContact O-N 3.43Å; F171-A174 PolarHBondContact O-N 3.29Å; F171-L175 VanDerWaalsContact O-CG 3.22Å; F171-L175 WeakPolarHBondContact O-CG 3.5Å; F171-L175 PolarHBondContact O-N 3.1Å
172	T	61.9	Low	65.6	Low	46 Å²	46	104.9 Å²	104.9	28%	0.282	53%	0.528	S	S	.	.	H	α-helix	trans	-60.9	-38	-172.2	58.3	0	0	0	0	113.3	K165 P169 L175 K176	K165-T172 HydrophobicContact CB-CG2 4.47Å; P169-T172 WeakPolarHBondContact O-CB 3.27Å; P169-T172 WeakPolarHBondContact O-CG2 3.46Å; P169-T172 PolarHBondContact O-N 2.91Å; P169-T172 VanDerWaalsContact O-N 3.1Å; P169-T172 PolarHBondContact O-OG1 3.04Å; T172-L175 PolarHBondContact O-N 3.19Å; T172-K176 PolarHBondContact O-N 3.5Å
173	D	59.3	Low	63.3	Low	106 Å²	106	108.3 Å²	108.3	57%	0.567	54%	0.541	S	S	*	.	H	α-helix	trans	-76.1	-36.8	177.8	-73.5	-27.6	0	0	0	112.7	F171 L175 K176 T177	F171-D173 VanDerWaalsContact C-N 3.32Å; F171-D173 PolarHBondContact O-N 3.43Å; D173-L175 PolarHBondContact O-N 3.04Å; D173-K176 PolarHBondContact O-N 2.96Å; D173-K176 IonicContact OD1-NZ 2.95Å; D173-K176 PolarHBondContact OD1-NZ 3.27Å; D173-T177 PolarHBondContact O-OG1 2.86Å
174	A	56.6	Low	60.8	Low	50 Å²	50	107.6 Å²	107.6	41%	0.413	54%	0.543	S	S	.	.	H	α-helix	trans	-62.1	-29.6	173.4	0	0	0	0	0	112.5	F171	F171-A174 PolarHBondContact O-N 3.29Å
175	L	57.3	Low	58.3	Low	35 Å²	35	113 Å²	113	18%	0.183	58%	0.578	C	S	.	*	H	α-helix	trans	-73.6	-34.7	177.7	-69.8	170.9	0	0	0	113	L97 F101 K165 F171 T172 D173	L97-L175 HydrophobicContact CD2-CD2 3.3Å; L97-L175 HydrophobicContact CG-CD2 4.01Å; F101-L175 HydrophobicContact CE2-CD1 4.31Å; F101-L175 HydrophobicContact CE2-CD2 4.03Å; F101-L175 HydrophobicContact CZ-CD2 4.42Å; K165-L175 HydrophobicContact CD-CD1 4.48Å; K165-L175 HydrophobicContact CG-CD1 3.88Å; F171-L175 VanDerWaalsContact O-CG 3.22Å; F171-L175 WeakPolarHBondContact O-CG 3.5Å; F171-L175 PolarHBondContact O-N 3.1Å; T172-L175 PolarHBondContact O-N 3.19Å; D173-L175 PolarHBondContact O-N 3.04Å
176	K	54	Low	55.8	Low	143 Å²	143	113.6 Å²	113.6	62%	0.622	60%	0.598	S	S	*	*	H	α-helix	trans	-67	-40.7	-177.5	-69.6	171.3	-165.6	156	0	111.9	T172 D173 K178 R179	T172-K176 PolarHBondContact O-N 3.5Å; D173-K176 PolarHBondContact O-N 2.96Å; D173-K176 IonicContact OD1-NZ 2.95Å; D173-K176 PolarHBondContact OD1-NZ 3.27Å; K176-K178 PolarHBondContact O-N 3.35Å; K176-K178 VanDerWaalsContact O-N 3.15Å; K176-R179 PolarHBondContact O-N 2.81Å
177	T	52.5	Low	53.4	Low	113 Å²	113	118.5 Å²	118.5	69%	0.693	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.2	-21.7	-173.3	-14.2	0	0	0	0	113.7	D173	D173-T177 PolarHBondContact O-OG1 2.86Å
178	K	50.3	Low	50.8	Low	135 Å²	135	122.3 Å²	122.3	59%	0.587	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.5	-7.3	-173.8	-71.1	-117.3	179.9	176.6	0	114.8	K176 R180	K176-K178 PolarHBondContact O-N 3.35Å; K176-K178 VanDerWaalsContact O-N 3.15Å; K178-R180 PolarHBondContact O-N 3.4Å
179	R	46.4	Very low	48.8	Very low	203 Å²	203	125.4 Å²	125.4	77%	0.766	65%	0.65	S	S	*	*			trans	-75.4	33.5	171.8	-64.7	-171	78.8	176.9	4.7	112.5	K176 P181	K176-R179 PolarHBondContact O-N 2.81Å; R179-P181 VanDerWaalsContact O-CD 3.29Å; R179-P181 WeakPolarHBondContact O-CD 3.34Å
180	R	40.1	Very low	46.6	Very low	219 Å²	219	130.7 Å²	130.7	83%	0.826	67%	0.668	S	S	*	*			trans	-55.6	118	162.8	-83	-174	162.4	-167.2	-4.5	106.5	K178 N182	K178-R180 PolarHBondContact O-N 3.4Å; R180-N182 PolarHBondContact O-N 3Å
181	P	41.8	Very low	44.8	Very low	122 Å²	122	133.3 Å²	133.3	79%	0.792	68%	0.68	S	S	*	*			trans	-61.3	111.6	-177.6	22.7	-30.5	0	0	0	107	R179 K183	R179-P181 VanDerWaalsContact O-CD 3.29Å; R179-P181 WeakPolarHBondContact O-CD 3.34Å; P181-K183 VanDerWaalsContact C-N 3.34Å; P181-K183 PolarHBondContact O-N 2.78Å
182	N	40.8	Very low	43.3	Very low	131 Å²	131	135.7 Å²	135.7	70%	0.701	70%	0.702	S	S	*	*			trans	-65.4	103.3	172.6	-157.2	15.5	0	0	0	105.3	R180 K184	R180-N182 PolarHBondContact O-N 3Å; N182-K184 PolarHBondContact O-N 3.38Å
183	K	39.6	Very low	41.7	Very low	204 Å²	204	140.4 Å²	140.4	89%	0.887	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.3	22.6	-170.8	-146.3	176.7	-175.3	-178.3	0	113.6	P181	P181-K183 VanDerWaalsContact C-N 3.34Å; P181-K183 PolarHBondContact O-N 2.78Å
184	K	37.5	Very low	40.5	Very low	190 Å²	190	140.9 Å²	140.9	83%	0.826	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.3	11.1	-170.3	-87.7	-171.2	173.9	-176.1	0	115.7	N182	N182-K184 PolarHBondContact O-N 3.38Å
185	T	33.5	Very low	39.2	Very low	132 Å²	132	143.6 Å²	143.6	81%	0.81	76%	0.759	S	S	*	*	S	Bend	trans	-116.1	13.8	176.4	27.5	0	0	0	0	115.7
186	A	31.7	Very low	38	Very low	95 Å²	95	147.9 Å²	147.9	79%	0.785	79%	0.792	S	S	*	*			trans	-102.4	38.3	-178.7	0	0	0	0	0	114.4
187	Q	35.2	Very low	37	Very low	184 Å²	184	146.3 Å²	146.3	86%	0.86	80%	0.798	S	S	*	*			trans	-149.3	66.9	172.2	-72	-164.6	3.1	0	0	111.9
188	V	31.2	Very low	36.5	Very low	148 Å²	148	146.1 Å²	146.1	90%	0.897	80%	0.802	S	S	*	*			trans	-158.5	85.9	149.3	-173	0	0	0	0	108
189	S	37.8	Very low	36	Very low	114 Å²	114	147 Å²	147	80%	0.797	81%	0.813	S	S	*	*			trans	-164.8	86.1	151.8	-161.9	0	0	0	0	108.4
190	E	30.4	Very low	35.6	Very low	192 Å²	192	145 Å²	145	90%	0.897	82%	0.818	S	S	*	*			trans	-85.1	109.5	164.9	-68.8	179	172.1	0	0	107.9
191	Q	36.6	Very low	35.6	Very low	172 Å²	172	142.5 Å²	142.5	80%	0.804	82%	0.815	S	S	*	*			trans	-140	133.9	153.1	-81.2	-75.1	-71.2	0	0	107.3
192	P	34.5	Very low	35.6	Very low	116 Å²	116	142 Å²	142	75%	0.753	81%	0.812	S	S	*	*			trans	-77.2	151.7	-175.5	19.9	-14.5	0	0	0	113.3
193	T	28	Very low	35.7	Very low	144 Å²	144	139.5 Å²	139.5	88%	0.883	80%	0.801	S	S	*	*			trans	-57.9	124.5	-178.5	53.8	0	0	0	0	113.4
194	S	34.6	Very low	36.1	Very low	117 Å²	117	134.7 Å²	134.7	82%	0.818	79%	0.785	S	S	*	*			trans	-142.9	128.7	156.5	179.2	0	0	0	0	109
195	S	29.1	Very low	36.7	Very low	107 Å²	107	132.6 Å²	132.6	75%	0.748	78%	0.782	S	S	*	*			trans	-49.9	129.4	-175.2	47.6	0	0	0	0	115.9
196	S	32.3	Very low	37.6	Very low	125 Å²	125	130.4 Å²	130.4	87%	0.874	76%	0.763	S	S	*	*				-174.1	137.5	129.9	-91.1	0	0	0	0	112.4
197	S	33.5	Very low	38.9	Very low	109 Å²	109	130.5 Å²	130.5	76%	0.762	75%	0.747	S	S	*	*			trans	-60.3	127.3	-179.2	-172.3	0	0	0	0	113.5
198	S	41.6	Very low	41	Very low	109 Å²	109	123.6 Å²	123.6	76%	0.762	72%	0.719	S	S	*	*			trans	-178	103.5	143.6	37.9	0	0	0	0	108.2	D200	S198-D200 PolarHBondContact O-N 3.19Å
199	N	39.2	Very low	43.5	Very low	153 Å²	153	116.5 Å²	116.5	82%	0.818	68%	0.676	S	S	*	*			trans	-83.1	94.8	-174	-63.2	-56.6	0	0	0	110.2
200	D	38.3	Very low	45.8	Very low	162 Å²	162	112.6 Å²	112.6	87%	0.866	65%	0.646	S	S	*	*			trans	-141.5	51.5	162.3	-80.2	-50.1	0	0	0	109.2	S198	S198-D200 PolarHBondContact O-N 3.19Å
201	E	39.8	Very low	48.5	Very low	167 Å²	167	108.2 Å²	108.2	78%	0.78	63%	0.625	S	S	*	*			trans	-83	141.4	173.2	-86.2	-72.6	124.5	0	0	110.5	V203	E201-V203 PolarHBondContact O-N 3.43Å
202	P	41.9	Very low	50.9	Low	111 Å²	111	102.1 Å²	102.1	72%	0.721	60%	0.596	S	S	*	*			trans	-65.9	97.1	-176.5	28.1	-32.7	0	0	0	109.6	D204	P202-D204 PolarHBondContact O-N 3.39Å
203	V	44.4	Very low	53.5	Low	79 Å²	79	96.9 Å²	96.9	48%	0.479	56%	0.562	S	S	.	*			trans	-45.1	109.1	-177.6	178.7	0	0	0	0	109.9	E201 L205 E207	E201-V203 PolarHBondContact O-N 3.43Å; V203-L205 PolarHBondContact O-N 2.93Å; V203-E207 HydrophobicContact CG1-CB 4.48Å
204	D	47.7	Very low	56.5	Low	103 Å²	103	91.8 Å²	91.8	55%	0.551	53%	0.528	S	S	*	.			trans	-54.6	124.9	170.4	-179.4	6.9	0	0	0	107.1	P202 H206 E207	P202-D204 PolarHBondContact O-N 3.39Å; D204-H206 PolarHBondContact O-N 3.42Å; D204-E207 HydrophobicContact CB-CG 4.28Å; D204-E207 WeakPolarHBondContact O-CA 3.45Å; D204-E207 WeakPolarHBondContact O-CB 3.44Å; D204-E207 PolarHBondContact O-N 2.97Å
205	L	49.8	Very low	59	Low	145 Å²	145	91.1 Å²	91.1	76%	0.759	52%	0.515	S	S	*	.	H	α-helix	trans	-54.7	-22.4	-171	-128.7	74.9	0	0	0	112.8	V203	V203-L205 PolarHBondContact O-N 2.93Å
206	H	51.4	Low	61.8	Low	87 Å²	87	88.2 Å²	88.2	40%	0.403	50%	0.498	S	S	.	.	H	α-helix	trans	-77.5	-33.5	174.1	-161.7	-91.1	0	0	0	113.5	D204 S208	D204-H206 PolarHBondContact O-N 3.42Å; H206-S208 VanDerWaalsContact C-N 3.34Å; H206-S208 PolarHBondContact O-N 3.43Å
207	E	60.6	Low	64.6	Low	97 Å²	97	84.6 Å²	84.6	45%	0.453	47%	0.466	S	S	.	.	H	α-helix	trans	-67	-33.5	178.3	-76.2	-171.3	136.3	0	0	112.2	V203 D204 G209 L210 Q211	V203-E207 HydrophobicContact CG1-CB 4.48Å; D204-E207 HydrophobicContact CB-CG 4.28Å; D204-E207 WeakPolarHBondContact O-CA 3.45Å; D204-E207 WeakPolarHBondContact O-CB 3.44Å; D204-E207 PolarHBondContact O-N 2.97Å; E207-G209 PolarHBondContact O-N 3.39Å; E207-L210 PolarHBondContact O-N 2.99Å; E207-Q211 WeakPolarHBondContact O-CB 3.44Å; E207-Q211 VanDerWaalsContact O-CG 3.24Å; E207-Q211 WeakPolarHBondContact O-CG 3.44Å; E207-Q211 PolarHBondContact O-N 3.28Å
208	S	77.4	Confident	67.4	Low	38 Å²	38	83.2 Å²	83.2	27%	0.266	45%	0.448	S	S	.	.	H	α-helix	trans	-58.3	-44.5	-177.7	-173.2	0	0	0	0	112.8	H206 K212	H206-S208 VanDerWaalsContact C-N 3.34Å; H206-S208 PolarHBondContact O-N 3.43Å; S208-K212 WeakPolarHBondContact O-CB 3.49Å; S208-K212 WeakPolarHBondContact O-CG 3.41Å; S208-K212 PolarHBondContact O-N 2.89Å
209	G	83.8	Confident	69.7	Low	0 Å²	0	84.2 Å²	84.2	0%	0	44%	0.44	C	S	.	.	H	α-helix	trans	-68.8	-40.3	179.2	0	0	0	0	0	113.2	E207 F213	E207-G209 PolarHBondContact O-N 3.39Å; G209-F213 WeakPolarHBondContact O-CB 3.41Å; G209-F213 PolarHBondContact O-N 3.24Å
210	L	87.6	Confident	72.2	Confident	31 Å²	31	83.4 Å²	83.4	16%	0.162	43%	0.429	C	S	.	.	H	α-helix	trans	-67.3	-43.1	177	175.1	61.9	0	0	0	111.4	E207 F213 M214 I237 F240	E207-L210 PolarHBondContact O-N 2.99Å; L210-F213 PolarHBondContact O-N 3.49Å; L210-M214 HydrophobicContact CD1-CG 4.15Å; L210-M214 HydrophobicContact CD1-SD 4.27Å; L210-M214 HydrophobicContact CG-CG 4.47Å; L210-M214 HydrophobicContact CG-SD 4.18Å; L210-M214 WeakPolarHBondContact O-CB 3.49Å; L210-M214 WeakPolarHBondContact O-CG 3.45Å; L210-M214 PolarHBondContact O-N 3.29Å; L210-I237 HydrophobicContact CD1-CG1 4.32Å; L210-I237 HydrophobicContact CD2-CG1 4.26Å; L210-F240 HydrophobicContact CB-CD1 4.24Å; L210-F240 HydrophobicContact CB-CE1 4.14Å; L210-F240 HydrophobicContact CB-CZ 4.44Å; L210-F240 HydrophobicContact CD1-CB 3.65Å; L210-F240 HydrophobicContact CD1-CD1 3.8Å; L210-F240 HydrophobicContact CD1-CD2 4.3Å; L210-F240 HydrophobicContact CD1-CG 3.65Å
211	Q	85.6	Confident	74.8	Confident	100 Å²	100	77.5 Å²	77.5	47%	0.467	40%	0.395	S	S	.	.	H	α-helix	trans	-60.8	-46.4	176.8	-74.4	175.1	2	0	0	111.2	E207 F213 M214 L215	E207-Q211 WeakPolarHBondContact O-CB 3.44Å; E207-Q211 VanDerWaalsContact O-CG 3.24Å; E207-Q211 WeakPolarHBondContact O-CG 3.44Å; E207-Q211 PolarHBondContact O-N 3.28Å; Q211-F213 PolarHBondContact O-N 3.29Å; Q211-M214 PolarHBondContact O-N 2.87Å; Q211-L215 WeakPolarHBondContact O-CB 3.21Å; Q211-L215 PolarHBondContact O-N 3.33Å
212	K	87.5	Confident	77.3	Confident	45 Å²	45	70.9 Å²	70.9	20%	0.196	37%	0.369	C	S	.	.	H	α-helix	trans	-59.1	-44.8	174.7	-71.8	170.6	-178.7	-170.7	0	112.1	S208 A216 W251 K252 C254 L256	S208-K212 WeakPolarHBondContact O-CB 3.49Å; S208-K212 WeakPolarHBondContact O-CG 3.41Å; S208-K212 PolarHBondContact O-N 2.89Å; K212-A216 WeakPolarHBondContact O-CB 3.4Å; K212-A216 PolarHBondContact O-N 2.9Å; K212-W251 HydrophobicContact CB-CE3 4.42Å; K212-W251 VanDerWaalsContact CD-O 3.22Å; K212-W251 WeakPolarHBondContact CD-O 3.32Å; K212-K252 PolarHBondContact NZ-O 3.48Å; K212-C254 WeakPolarHBondContact CD-O 3.49Å; K212-C254 WeakPolarHBondContact CE-O 3.24Å; K212-C254 PolarHBondContact NZ-O 3.24Å; K212-L256 HydrophobicContact CG-CD1 4.13Å; K212-L256 HydrophobicContact CG-CG 4.35Å
213	F	90.3	Very high	79.7	Confident	6 Å²	6	75 Å²	75	3%	0.026	37%	0.37	C	S	.	.	H	α-helix	trans	-61.2	-46	175.8	172.3	-96.2	0	0	0	112	G209 L210 Q211 A216 K217 L236 K239 F240 L243 W251	G209-F213 WeakPolarHBondContact O-CB 3.41Å; G209-F213 PolarHBondContact O-N 3.24Å; L210-F213 PolarHBondContact O-N 3.49Å; Q211-F213 PolarHBondContact O-N 3.29Å; F213-A216 PolarHBondContact O-N 3.39Å; F213-K217 HydrophobicContact CD2-CG 3.94Å; F213-K217 HydrophobicContact CE2-CG 3.72Å; F213-K217 HydrophobicContact CG-CG 4.49Å; F213-K217 HydrophobicContact CZ-CB 4.42Å; F213-K217 HydrophobicContact CZ-CG 4.06Å; F213-K217 VanDerWaalsContact O-CB 3.27Å; F213-K217 WeakPolarHBondContact O-CB 3.17Å; F213-K217 WeakPolarHBondContact O-CG 3.32Å; F213-K217 PolarHBondContact O-N 3Å; F213-L236 HydrophobicContact CE1-CB 4.18Å; F213-L236 HydrophobicContact CE1-CD2 3.87Å; F213-L236 WeakPolarHBondContact CE1-O 3.41Å; F213-L236 HydrophobicContact CZ-CD2 4.44Å; F213-K239 HydrophobicContact CE1-CB 4.46Å; F213-K239 HydrophobicContact CZ-CB 4.18Å; F213-F240 HydrophobicContact CB-CD2 3.61Å; F213-F240 HydrophobicContact CB-CE2 3.87Å; F213-F240 HydrophobicContact CD1-CB 3.9Å; F213-F240 AromaticContact CD1-CD2 3.83Å; F213-F240 HydrophobicContact CD1-CD2 3.83Å; F213-F240 HydrophobicContact CD1-CG 4.28Å; F213-F240 HydrophobicContact CD2-CD2 4.01Å; F213-F240 HydrophobicContact CE1-CB 4Å; F213-F240 HydrophobicContact CG-CB 4.46Å; F213-F240 AromaticContact CG-CD2 3.54Å; F213-F240 HydrophobicContact CG-CD2 3.54Å; F213-F240 HydrophobicContact CG-CE2 4.26Å; F213-F240 HydrophobicContact CG-CG 4.43Å; F213-L243 HydrophobicContact CD2-CD2 4.43Å; F213-L243 HydrophobicContact CE2-CD1 4.44Å; F213-L243 HydrophobicContact CE2-CD2 4.2Å; F213-W251 HydrophobicContact CB-CD2 3.97Å; F213-W251 HydrophobicContact CB-CE3 4.17Å; F213-W251 HydrophobicContact CB-CG 4.15Å; F213-W251 HydrophobicContact CD2-CD2 4.04Å; F213-W251 AromaticContact CD2-CE2 3.56Å; F213-W251 HydrophobicContact CD2-CG 4.37Å; F213-W251 AromaticContact CD2-CZ2 3.83Å; F213-W251 HydrophobicContact CD2-CZ2 3.83Å; F213-W251 AromaticContact CD2-NE1 3.57Å; F213-W251 HydrophobicContact CE2-CZ2 4.46Å
214	M	90.4	Very high	82	Confident	36 Å²	36	77.9 Å²	77.9	18%	0.177	38%	0.376	C	S	.	.	H	α-helix	trans	-61.6	-49.2	179.4	-77.3	-178.3	54.3	0	0	111.1	L210 Q211 A216 K217 Q218 K233 L236 I237	L210-M214 HydrophobicContact CD1-CG 4.15Å; L210-M214 HydrophobicContact CD1-SD 4.27Å; L210-M214 HydrophobicContact CG-CG 4.47Å; L210-M214 HydrophobicContact CG-SD 4.18Å; L210-M214 WeakPolarHBondContact O-CB 3.49Å; L210-M214 WeakPolarHBondContact O-CG 3.45Å; L210-M214 PolarHBondContact O-N 3.29Å; Q211-M214 PolarHBondContact O-N 2.87Å; M214-A216 VanDerWaalsContact C-N 3.33Å; M214-A216 PolarHBondContact O-N 3.46Å; M214-K217 PolarHBondContact O-N 3.28Å; M214-Q218 WeakPolarHBondContact O-CA 3.47Å; M214-Q218 WeakPolarHBondContact O-CB 3.41Å; M214-Q218 PolarHBondContact O-N 3.47Å; M214-K233 HydrophobicContact CE-CB 4.21Å; M214-K233 HydrophobicContact CE-CD 3.98Å; M214-K233 HydrophobicContact CE-CG 3.62Å; M214-K233 HydrophobicContact SD-CG 4.37Å; M214-L236 HydrophobicContact CB-CD1 4.34Å; M214-L236 HydrophobicContact CG-CB 4Å; M214-L236 HydrophobicContact CG-CD1 4.18Å; M214-I237 HydrophobicContact SD-CG1 4.45Å
215	L	87	Confident	84.1	Confident	104 Å²	104	76.6 Å²	76.6	55%	0.545	36%	0.364	S	S	.	.	H	α-helix	trans	-58.9	-44.6	179.2	-161.2	106.7	0	0	0	111.5	Q211 K217 Q218 L256	Q211-L215 WeakPolarHBondContact O-CB 3.21Å; Q211-L215 PolarHBondContact O-N 3.33Å; L215-K217 PolarHBondContact O-N 2.98Å; L215-Q218 WeakPolarHBondContact O-CG 3.44Å; L215-L256 HydrophobicContact CD2-CD1 3.91Å
216	A	88	Confident	86.1	Confident	46 Å²	46	76.7 Å²	76.7	38%	0.38	37%	0.366	S	S	.	.	H	α-helix	trans	-74.6	-20.1	-178.9	0	0	0	0	0	114.4	K212 F213 M214 W251 L256	K212-A216 WeakPolarHBondContact O-CB 3.4Å; K212-A216 PolarHBondContact O-N 2.9Å; F213-A216 PolarHBondContact O-N 3.39Å; M214-A216 VanDerWaalsContact C-N 3.33Å; M214-A216 PolarHBondContact O-N 3.46Å; A216-W251 HydrophobicContact CB-CH2 3.76Å; A216-W251 HydrophobicContact CB-CZ3 3.65Å; A216-L256 HydrophobicContact CB-CD2 4.48Å
217	K	90.8	Very high	87.9	Confident	48 Å²	48	74.6 Å²	74.6	21%	0.209	36%	0.357	C	S	.	.	H	α-helix	trans	-114	-12.1	-175.2	-62.3	-58	179.9	-157.9	0	114.5	F213 M214 L215 E219 K220 Y221 L236	F213-K217 HydrophobicContact CD2-CG 3.94Å; F213-K217 HydrophobicContact CE2-CG 3.72Å; F213-K217 HydrophobicContact CG-CG 4.49Å; F213-K217 HydrophobicContact CZ-CB 4.42Å; F213-K217 HydrophobicContact CZ-CG 4.06Å; F213-K217 VanDerWaalsContact O-CB 3.27Å; F213-K217 WeakPolarHBondContact O-CB 3.17Å; F213-K217 WeakPolarHBondContact O-CG 3.32Å; F213-K217 PolarHBondContact O-N 3Å; M214-K217 PolarHBondContact O-N 3.28Å; L215-K217 PolarHBondContact O-N 2.98Å; K217-E219 PolarHBondContact O-N 3.13Å; K217-K220 PolarHBondContact O-N 3Å; K217-Y221 HydrophobicContact CB-CD2 4.05Å; K217-Y221 HydrophobicContact CB-CE2 4.26Å; K217-Y221 WeakPolarHBondContact O-CB 3.21Å; K217-Y221 WeakPolarHBondContact O-CD2 3.47Å; K217-Y221 PolarHBondContact O-N 2.89Å; K217-L236 HydrophobicContact CB-CD2 3.76Å
218	Q	91.7	Very high	89.3	Confident	81 Å²	81	78.8 Å²	78.8	38%	0.379	37%	0.374	S	S	.	.	H	α-helix	trans	-57.7	-47	-175.6	63.3	-173.3	-1.4	0	0	112.8	M214 L215 Y221 A222 L232 L236	M214-Q218 WeakPolarHBondContact O-CA 3.47Å; M214-Q218 WeakPolarHBondContact O-CB 3.41Å; M214-Q218 PolarHBondContact O-N 3.47Å; L215-Q218 WeakPolarHBondContact O-CG 3.44Å; Q218-Y221 PolarHBondContact O-N 3.45Å; Q218-A222 WeakPolarHBondContact O-CB 3.48Å; Q218-A222 PolarHBondContact O-N 3.46Å; Q218-L232 HydrophobicContact CB-CD2 4.27Å; Q218-L236 HydrophobicContact CB-CD1 4.15Å
219	E	89.6	Confident	89.8	Confident	129 Å²	129	79.8 Å²	79.8	60%	0.603	39%	0.39	S	S	*	.	H	α-helix	trans	-66.6	-44.2	-178.3	-64.5	-171.4	168.2	0	0	111.8	K217 Y221 A222 R223	K217-E219 PolarHBondContact O-N 3.13Å; E219-Y221 VanDerWaalsContact C-N 3.3Å; E219-Y221 PolarHBondContact O-N 3.34Å; E219-A222 PolarHBondContact O-N 3.06Å; E219-R223 WeakPolarHBondContact O-CG 3.37Å; E219-R223 PolarHBondContact O-N 3.26Å
220	K	92.4	Very high	90.1	Very high	136 Å²	136	86 Å²	86	59%	0.591	42%	0.419	S	S	*	.	H	α-helix	trans	-59.4	-42.5	177.2	-177.6	173.9	-177.2	169	0	111.3	K217 K224	K217-K220 PolarHBondContact O-N 3Å; K220-K224 WeakPolarHBondContact O-CB 3.43Å; K220-K224 PolarHBondContact O-N 3.36Å
221	Y	93	Very high	90.2	Very high	39 Å²	39	89.4 Å²	89.4	15%	0.153	44%	0.435	C	S	.	.	H	α-helix	trans	-78.8	-34.6	-179	-86.2	-115.3	0	0	0	112.7	K217 Q218 E219 K224 Y225 L236 K239	K217-Y221 HydrophobicContact CB-CD2 4.05Å; K217-Y221 HydrophobicContact CB-CE2 4.26Å; K217-Y221 WeakPolarHBondContact O-CB 3.21Å; K217-Y221 WeakPolarHBondContact O-CD2 3.47Å; K217-Y221 PolarHBondContact O-N 2.89Å; Q218-Y221 PolarHBondContact O-N 3.45Å; E219-Y221 VanDerWaalsContact C-N 3.3Å; E219-Y221 PolarHBondContact O-N 3.34Å; Y221-K224 PolarHBondContact O-N 3.08Å; Y221-Y225 AromaticContact CD1-CD2 3.72Å; Y221-Y225 HydrophobicContact CD1-CD2 3.72Å; Y221-Y225 AromaticContact CD1-CE2 3.49Å; Y221-Y225 HydrophobicContact CD1-CE2 3.49Å; Y221-Y225 VanDerWaalsContact CD1-CE2 3.49Å; Y221-Y225 HydrophobicContact CE1-CD2 4.36Å; Y221-Y225 AromaticContact CE1-CE2 3.67Å; Y221-Y225 HydrophobicContact CE1-CE2 3.67Å; Y221-Y225 HydrophobicContact CG-CD2 4.27Å; Y221-Y225 HydrophobicContact CG-CE2 4.24Å; Y221-Y225 WeakPolarHBondContact O-CB 3.38Å; Y221-Y225 PolarHBondContact O-N 2.98Å; Y221-L236 HydrophobicContact CD1-CD2 4.03Å; Y221-L236 HydrophobicContact CD2-CD2 4.08Å; Y221-L236 HydrophobicContact CG-CD2 3.8Å; Y221-K239 HydrophobicContact CE1-CG 3.85Å
222	A	92.7	Very high	90.5	Very high	28 Å²	28	85.5 Å²	85.5	23%	0.231	42%	0.417	C	S	.	.	H	α-helix	trans	-59.2	-48.3	173.9	0	0	0	0	0	110.3	Q218 E219 N226 L227 L232	Q218-A222 WeakPolarHBondContact O-CB 3.48Å; Q218-A222 PolarHBondContact O-N 3.46Å; E219-A222 PolarHBondContact O-N 3.06Å; A222-N226 WeakPolarHBondContact O-CA 3.49Å; A222-N226 PolarHBondContact O-N 3.05Å; A222-L227 WeakPolarHBondContact CA-O 3.42Å; A222-L227 PolarHBondContact O-N 3.35Å; A222-L232 HydrophobicContact CB-CD2 3.86Å
223	R	92	Very high	90.6	Very high	198 Å²	198	88.7 Å²	88.7	75%	0.747	43%	0.431	S	S	*	.	H	α-helix	trans	-68.7	-40.9	176.6	-66.1	-178.9	-173.5	-177.2	4.7	112.6	E219	E219-R223 WeakPolarHBondContact O-CG 3.37Å; E219-R223 PolarHBondContact O-N 3.26Å
224	K	93.5	Very high	90.7	Very high	138 Å²	138	92.5 Å²	92.5	60%	0.6	45%	0.447	S	S	*	.	H	α-helix	trans	-69.3	-35.5	-177.1	-178.8	170.5	-178.3	171.4	0	113.7	K220 Y221	K220-K224 WeakPolarHBondContact O-CB 3.43Å; K220-K224 PolarHBondContact O-N 3.36Å; Y221-K224 PolarHBondContact O-N 3.08Å
225	Y	91.3	Very high	90.8	Very high	76 Å²	76	94 Å²	94	30%	0.298	45%	0.453	S	S	.	.	H	α-helix	trans	-113.8	0.6	-174.4	-64.5	-73	0	0	0	113.6	Y221 L227 K235	Y221-Y225 AromaticContact CD1-CD2 3.72Å; Y221-Y225 HydrophobicContact CD1-CD2 3.72Å; Y221-Y225 AromaticContact CD1-CE2 3.49Å; Y221-Y225 HydrophobicContact CD1-CE2 3.49Å; Y221-Y225 VanDerWaalsContact CD1-CE2 3.49Å; Y221-Y225 HydrophobicContact CE1-CD2 4.36Å; Y221-Y225 AromaticContact CE1-CE2 3.67Å; Y221-Y225 HydrophobicContact CE1-CE2 3.67Å; Y221-Y225 HydrophobicContact CG-CD2 4.27Å; Y221-Y225 HydrophobicContact CG-CE2 4.24Å; Y221-Y225 WeakPolarHBondContact O-CB 3.38Å; Y221-Y225 PolarHBondContact O-N 2.98Å; Y225-L227 HydrophobicContact CG-CD1 4.42Å; Y225-L227 PolarHBondContact O-N 2.85Å; Y225-K235 HydrophobicContact CD2-CD 4.26Å; Y225-K235 VanDerWaalsContact CE1-NZ 3.27Å; Y225-K235 HydrophobicContact CG-CD 4.33Å
226	N	91.1	Very high	91.1	Very high	148 Å²	148	89.2 Å²	89.2	79%	0.791	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.2	39.9	-171.8	-68.8	-42.2	0	0	0	112.7	A222	A222-N226 WeakPolarHBondContact O-CA 3.49Å; A222-N226 PolarHBondContact O-N 3.05Å
227	L	90.4	Very high	91.3	Very high	42 Å²	42	89.5 Å²	89.5	22%	0.22	42%	0.422	C	S	.	.			trans	-102.8	143.7	178.5	-63.7	173.7	0	0	0	110.4	A222 Y225 E231 L232 K235	A222-L227 WeakPolarHBondContact CA-O 3.42Å; A222-L227 PolarHBondContact O-N 3.35Å; Y225-L227 HydrophobicContact CG-CD1 4.42Å; Y225-L227 PolarHBondContact O-N 2.85Å; L227-E231 HydrophobicContact CD2-CB 4.12Å; L227-L232 HydrophobicContact CB-CB 3.98Å; L227-L232 HydrophobicContact CB-CD1 4.3Å; L227-K235 HydrophobicContact CD1-CB 4.26Å; L227-K235 HydrophobicContact CD1-CD 3.53Å
228	K	89.5	Confident	91.4	Very high	185 Å²	185	93.8 Å²	93.8	80%	0.804	44%	0.441	S	S	*	.			trans	-133.3	159	174.3	-66.8	-176.6	179.2	177.5	0	110.4	E230	K228-E230 PolarHBondContact O-N 2.94Å
229	G	88.1	Confident	91.4	Very high	60 Å²	60	94 Å²	94	62%	0.619	44%	0.44	S	S	*	.	H	α-helix	trans	58.6	-127.7	174	0	0	0	0	0	114.1	L232 K233	G229-L232 PolarHBondContact O-N 3.22Å; G229-K233 PolarHBondContact O-N 3.28Å
230	E	89.7	Confident	91.4	Very high	129 Å²	129	87.8 Å²	87.8	60%	0.603	41%	0.411	S	S	*	.	H	α-helix	trans	-67.6	-38	-169.6	-157.4	-175.5	141.3	0	0	113.6	K228 L232 K233 K234	K228-E230 PolarHBondContact O-N 2.94Å; E230-L232 VanDerWaalsContact C-N 3.33Å; E230-L232 PolarHBondContact O-N 2.99Å; E230-K233 WeakPolarHBondContact O-CB 3.34Å; E230-K233 PolarHBondContact O-N 3.13Å; E230-K234 WeakPolarHBondContact O-CG 3.44Å; E230-K234 PolarHBondContact O-N 3.44Å; E230-K234 WeakPolarHBondContact OE1-CE 3.41Å; E230-K234 IonicContact OE1-NZ 3.67Å; E230-K234 PolarHBondContact OE1-NZ 3.39Å
231	E	89.3	Confident	91.2	Very high	104 Å²	104	85.8 Å²	85.8	49%	0.486	41%	0.407	S	S	.	.	H	α-helix	trans	-66.9	-36.4	179.9	-66.9	-54.6	122.6	0	0	112.1	L227 K234 K235	L227-E231 HydrophobicContact CD2-CB 4.12Å; E231-K234 IonicContact OE1-NZ 3.55Å; E231-K234 PolarHBondContact OE1-NZ 3.1Å; E231-K235 WeakPolarHBondContact O-CB 2.69Å; E231-K235 PolarHBondContact O-N 2.88Å; E231-K235 VanDerWaalsContact O-N 3.09Å
232	L	92.1	Very high	91.2	Very high	17 Å²	17	91.3 Å²	91.3	9%	0.089	43%	0.434	C	S	.	.	H	α-helix	trans	-63.9	-45.4	172.1	178.6	62.4	0	0	0	110.9	Q218 A222 L227 G229 E230 K235 L236	Q218-L232 HydrophobicContact CB-CD2 4.27Å; A222-L232 HydrophobicContact CB-CD2 3.86Å; L227-L232 HydrophobicContact CB-CB 3.98Å; L227-L232 HydrophobicContact CB-CD1 4.3Å; G229-L232 PolarHBondContact O-N 3.22Å; E230-L232 VanDerWaalsContact C-N 3.33Å; E230-L232 PolarHBondContact O-N 2.99Å; L232-K235 PolarHBondContact O-N 2.98Å; L232-L236 HydrophobicContact CD1-CD1 4.26Å; L232-L236 HydrophobicContact CD1-CG 4.4Å; L232-L236 HydrophobicContact CG-CD1 4.05Å; L232-L236 WeakPolarHBondContact O-CG 3.2Å; L232-L236 PolarHBondContact O-N 3.3Å
233	K	90.8	Very high	91	Very high	113 Å²	113	91.9 Å²	91.9	49%	0.491	43%	0.433	S	S	.	.	H	α-helix	trans	-60.3	-48.9	177.8	179.3	169	-176.5	-175.9	0	111.5	M214 G229 E230 K235 L236 I237	M214-K233 HydrophobicContact CE-CB 4.21Å; M214-K233 HydrophobicContact CE-CD 3.98Å; M214-K233 HydrophobicContact CE-CG 3.62Å; M214-K233 HydrophobicContact SD-CG 4.37Å; G229-K233 PolarHBondContact O-N 3.28Å; E230-K233 WeakPolarHBondContact O-CB 3.34Å; E230-K233 PolarHBondContact O-N 3.13Å; K233-K235 VanDerWaalsContact C-N 3.27Å; K233-K235 PolarHBondContact O-N 2.86Å; K233-L236 PolarHBondContact O-N 3.48Å; K233-I237 HydrophobicContact CG-CD1 3.87Å; K233-I237 VanDerWaalsContact O-CG1 3.31Å; K233-I237 WeakPolarHBondContact O-CG1 3.32Å; K233-I237 PolarHBondContact O-N 3.18Å
234	K	92	Very high	90.8	Very high	86 Å²	86	85.2 Å²	85.2	37%	0.374	42%	0.417	S	S	.	.	H	α-helix	trans	-55.6	-42.4	175.7	-73.8	171.6	-174	157.9	0	111.6	E230 E231 K238	E230-K234 WeakPolarHBondContact O-CG 3.44Å; E230-K234 PolarHBondContact O-N 3.44Å; E230-K234 WeakPolarHBondContact OE1-CE 3.41Å; E230-K234 IonicContact OE1-NZ 3.67Å; E230-K234 PolarHBondContact OE1-NZ 3.39Å; E231-K234 IonicContact OE1-NZ 3.55Å; E231-K234 PolarHBondContact OE1-NZ 3.1Å; K234-K238 WeakPolarHBondContact O-CG 3.44Å; K234-K238 PolarHBondContact O-N 2.82Å
235	K	92.4	Very high	90.4	Very high	68 Å²	68	83.7 Å²	83.7	30%	0.296	42%	0.419	S	S	.	.	H	α-helix	trans	-69.1	-38.6	179.5	-165.7	152.5	-172.2	168.9	0	112.8	Y225 L227 E231 L232 K233 K239	Y225-K235 HydrophobicContact CD2-CD 4.26Å; Y225-K235 VanDerWaalsContact CE1-NZ 3.27Å; Y225-K235 HydrophobicContact CG-CD 4.33Å; L227-K235 HydrophobicContact CD1-CB 4.26Å; L227-K235 HydrophobicContact CD1-CD 3.53Å; E231-K235 WeakPolarHBondContact O-CB 2.69Å; E231-K235 PolarHBondContact O-N 2.88Å; E231-K235 VanDerWaalsContact O-N 3.09Å; L232-K235 PolarHBondContact O-N 2.98Å; K233-K235 VanDerWaalsContact C-N 3.27Å; K233-K235 PolarHBondContact O-N 2.86Å; K235-K239 WeakPolarHBondContact O-CB 3.3Å; K235-K239 WeakPolarHBondContact O-CG 3.42Å; K235-K239 PolarHBondContact O-N 3.32Å
236	L	93.1	Very high	90	Very high	2 Å²	2	87.6 Å²	87.6	1%	0.01	44%	0.44	C	S	.	.	H	α-helix	trans	-66.5	-43.6	176.1	-71.9	168.2	0	0	0	111.6	F213 M214 K217 Q218 Y221 L232 K233 K239 F240	F213-L236 HydrophobicContact CE1-CB 4.18Å; F213-L236 HydrophobicContact CE1-CD2 3.87Å; F213-L236 WeakPolarHBondContact CE1-O 3.41Å; F213-L236 HydrophobicContact CZ-CD2 4.44Å; M214-L236 HydrophobicContact CB-CD1 4.34Å; M214-L236 HydrophobicContact CG-CB 4Å; M214-L236 HydrophobicContact CG-CD1 4.18Å; K217-L236 HydrophobicContact CB-CD2 3.76Å; Q218-L236 HydrophobicContact CB-CD1 4.15Å; Y221-L236 HydrophobicContact CD1-CD2 4.03Å; Y221-L236 HydrophobicContact CD2-CD2 4.08Å; Y221-L236 HydrophobicContact CG-CD2 3.8Å; L232-L236 HydrophobicContact CD1-CD1 4.26Å; L232-L236 HydrophobicContact CD1-CG 4.4Å; L232-L236 HydrophobicContact CG-CD1 4.05Å; L232-L236 WeakPolarHBondContact O-CG 3.2Å; L232-L236 PolarHBondContact O-N 3.3Å; K233-L236 PolarHBondContact O-N 3.48Å; L236-K239 PolarHBondContact O-N 2.9Å; L236-K239 VanDerWaalsContact O-N 3.17Å; L236-F240 PolarHBondContact O-N 3.04Å
237	I	91.8	Very high	89.7	Confident	53 Å²	53	86.6 Å²	86.6	27%	0.272	43%	0.428	S	S	.	.	H	α-helix	trans	-58.5	-52.7	175.8	-66.2	166.7	0	0	0	110	L210 M214 K233 K239 F240 D241	L210-I237 HydrophobicContact CD1-CG1 4.32Å; L210-I237 HydrophobicContact CD2-CG1 4.26Å; M214-I237 HydrophobicContact SD-CG1 4.45Å; K233-I237 HydrophobicContact CG-CD1 3.87Å; K233-I237 VanDerWaalsContact O-CG1 3.31Å; K233-I237 WeakPolarHBondContact O-CG1 3.32Å; K233-I237 PolarHBondContact O-N 3.18Å; I237-K239 VanDerWaalsContact C-N 3.25Å; I237-K239 PolarHBondContact O-N 3.43Å; I237-F240 WeakPolarHBondContact O-CB 3.41Å; I237-F240 PolarHBondContact O-N 3.09Å; I237-F240 VanDerWaalsContact O-N 3.08Å; I237-D241 PolarHBondContact O-N 3.45Å
238	K	92.1	Very high	89.6	Confident	138 Å²	138	86 Å²	86	60%	0.6	42%	0.424	S	S	*	.	H	α-helix	trans	-53.9	-45.1	176	-75.5	-178.9	-179.7	-179.2	0	111.1	K234 D241 H242	K234-K238 WeakPolarHBondContact O-CG 3.44Å; K234-K238 PolarHBondContact O-N 2.82Å; K238-D241 PolarHBondContact O-N 3Å; K238-H242 PolarHBondContact O-N 3.38Å; K238-H242 VanDerWaalsContact O-N 3.16Å; K238-H242 PolarHBondContact O-ND1 3.46Å
239	K	91.9	Very high	89.2	Confident	84 Å²	84	81 Å²	81	37%	0.365	41%	0.406	S	S	.	.	H	α-helix	trans	-64.3	-43	179.2	-76.5	-68.6	-178.2	-171.4	0	112.5	F213 Y221 K235 L236 I237 D241 H242 L243	F213-K239 HydrophobicContact CE1-CB 4.46Å; F213-K239 HydrophobicContact CZ-CB 4.18Å; Y221-K239 HydrophobicContact CE1-CG 3.85Å; K235-K239 WeakPolarHBondContact O-CB 3.3Å; K235-K239 WeakPolarHBondContact O-CG 3.42Å; K235-K239 PolarHBondContact O-N 3.32Å; L236-K239 PolarHBondContact O-N 2.9Å; L236-K239 VanDerWaalsContact O-N 3.17Å; I237-K239 VanDerWaalsContact C-N 3.25Å; I237-K239 PolarHBondContact O-N 3.43Å; K239-D241 VanDerWaalsContact C-N 3.31Å; K239-D241 PolarHBondContact O-N 3.04Å; K239-H242 PolarHBondContact O-N 3.3Å; K239-L243 WeakPolarHBondContact O-CD1 3.48Å; K239-L243 PolarHBondContact O-N 3.23Å
240	F	90.5	Very high	89.1	Confident	0 Å²	0	83.1 Å²	83.1	0%	0	40%	0.398	C	S	.	.	H	α-helix	trans	-60.1	-41.4	176.4	-171.1	-98.8	0	0	0	112	L210 F213 L236 I237 H242 L243 Q248 W251	L210-F240 HydrophobicContact CB-CD1 4.24Å; L210-F240 HydrophobicContact CB-CE1 4.14Å; L210-F240 HydrophobicContact CB-CZ 4.44Å; L210-F240 HydrophobicContact CD1-CB 3.65Å; L210-F240 HydrophobicContact CD1-CD1 3.8Å; L210-F240 HydrophobicContact CD1-CD2 4.3Å; L210-F240 HydrophobicContact CD1-CG 3.65Å; F213-F240 HydrophobicContact CB-CD2 3.61Å; F213-F240 HydrophobicContact CB-CE2 3.87Å; F213-F240 HydrophobicContact CD1-CB 3.9Å; F213-F240 AromaticContact CD1-CD2 3.83Å; F213-F240 HydrophobicContact CD1-CD2 3.83Å; F213-F240 HydrophobicContact CD1-CG 4.28Å; F213-F240 HydrophobicContact CD2-CD2 4.01Å; F213-F240 HydrophobicContact CE1-CB 4Å; F213-F240 HydrophobicContact CG-CB 4.46Å; F213-F240 AromaticContact CG-CD2 3.54Å; F213-F240 HydrophobicContact CG-CD2 3.54Å; F213-F240 HydrophobicContact CG-CE2 4.26Å; F213-F240 HydrophobicContact CG-CG 4.43Å; L236-F240 PolarHBondContact O-N 3.04Å; I237-F240 WeakPolarHBondContact O-CB 3.41Å; I237-F240 PolarHBondContact O-N 3.09Å; I237-F240 VanDerWaalsContact O-N 3.08Å; F240-H242 VanDerWaalsContact C-N 3.26Å; F240-H242 PolarHBondContact O-N 2.84Å; F240-L243 WeakPolarHBondContact O-CB 3.23Å; F240-L243 PolarHBondContact O-N 2.98Å; F240-Q248 HydrophobicContact CD1-CG 4.38Å; F240-Q248 HydrophobicContact CE1-CB 4.31Å; F240-Q248 HydrophobicContact CE1-CG 3.95Å; F240-Q248 HydrophobicContact CE2-CB 4.48Å; F240-Q248 HydrophobicContact CE2-CG 4.3Å; F240-Q248 HydrophobicContact CZ-CB 3.93Å; F240-Q248 HydrophobicContact CZ-CG 3.92Å; F240-Q248 PolarHBondContact O-NE2 3.32Å; F240-W251 HydrophobicContact CE2-CB 3.93Å; F240-W251 HydrophobicContact CE2-CG 4.15Å
241	D	88.9	Confident	88.9	Confident	93 Å²	93	78.3 Å²	78.3	50%	0.497	38%	0.375	S	S	.	.	H	α-helix	trans	-66	-29.8	177.9	-65.9	-22.6	0	0	0	112.6	I237 K238 K239 L243	I237-D241 PolarHBondContact O-N 3.45Å; K238-D241 PolarHBondContact O-N 3Å; K239-D241 VanDerWaalsContact C-N 3.31Å; K239-D241 PolarHBondContact O-N 3.04Å; D241-L243 VanDerWaalsContact C-N 3.34Å
242	H	91.3	Very high	88.6	Confident	155 Å²	155	76.2 Å²	76.2	72%	0.718	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-4.9	174.8	-69.2	73.6	0	0	0	113.5	K238 K239 F240	K238-H242 PolarHBondContact O-N 3.38Å; K238-H242 VanDerWaalsContact O-N 3.16Å; K238-H242 PolarHBondContact O-ND1 3.46Å; K239-H242 PolarHBondContact O-N 3.3Å; F240-H242 VanDerWaalsContact C-N 3.26Å; F240-H242 PolarHBondContact O-N 2.84Å
243	L	88.8	Confident	88	Confident	41 Å²	41	81.8 Å²	81.8	22%	0.215	39%	0.394	C	S	.	.	S	Bend	trans	-70.1	147.9	171.6	-93.8	63.4	0	0	0	109.8	F213 K239 F240 D241 K247 Q248	F213-L243 HydrophobicContact CD2-CD2 4.43Å; F213-L243 HydrophobicContact CE2-CD1 4.44Å; F213-L243 HydrophobicContact CE2-CD2 4.2Å; K239-L243 WeakPolarHBondContact O-CD1 3.48Å; K239-L243 PolarHBondContact O-N 3.23Å; F240-L243 WeakPolarHBondContact O-CB 3.23Å; F240-L243 PolarHBondContact O-N 2.98Å; D241-L243 VanDerWaalsContact C-N 3.34Å; L243-K247 HydrophobicContact CB-CB 4.09Å; L243-K247 HydrophobicContact CD2-CB 3.88Å; L243-K247 HydrophobicContact CG-CB 4.08Å; L243-K247 HydrophobicContact CG-CD 4.36Å; L243-Q248 HydrophobicContact CB-CG 3.96Å; L243-Q248 PolarHBondContact O-NE2 3.5Å
244	S	88	Confident	87	Confident	58 Å²	58	77.4 Å²	77.4	41%	0.406	38%	0.377	S	S	.	.			trans	-58.9	152.9	170.1	66.6	0	0	0	0	110.8	E246 K247 Q248	S244-E246 PolarHBondContact O-N 3.35Å; S244-K247 PolarHBondContact O-N 3.14Å; S244-K247 WeakPolarHBondContact OG-CG 3.08Å; S244-K247 PolarHBondContact OG-N 2.92Å; S244-Q248 PolarHBondContact O-N 3.39Å
245	V	84.6	Confident	85.4	Confident	105 Å²	105	76.6 Å²	76.6	64%	0.636	39%	0.386	S	S	*	.	H	α-helix	trans	-54.5	-40.3	178.9	175.9	0	0	0	0	111.1	Q248 L249	V245-Q248 PolarHBondContact O-N 3.03Å; V245-L249 HydrophobicContact CG1-CD1 3.92Å; V245-L249 WeakPolarHBondContact O-CB 3.45Å; V245-L249 PolarHBondContact O-N 3.34Å
246	E	84.3	Confident	83.6	Confident	158 Å²	158	78 Å²	78	74%	0.738	40%	0.397	S	S	*	.	H	α-helix	trans	-60.3	-44.2	174.6	-68.7	175.1	-178.8	0	0	112.8	S244 L249 K250	S244-E246 PolarHBondContact O-N 3.35Å; E246-L249 WeakPolarHBondContact O-CB 3.46Å; E246-L249 PolarHBondContact O-N 3.26Å; E246-K250 PolarHBondContact O-N 2.85Å
247	K	85	Confident	81.6	Confident	128 Å²	128	82.1 Å²	82.1	56%	0.557	42%	0.422	S	S	*	.	H	α-helix	trans	-68.5	-39.2	177.5	-75.1	-179.2	177.7	173.7	0	111.5	L243 S244 L249 K250 W251	L243-K247 HydrophobicContact CB-CB 4.09Å; L243-K247 HydrophobicContact CD2-CB 3.88Å; L243-K247 HydrophobicContact CG-CB 4.08Å; L243-K247 HydrophobicContact CG-CD 4.36Å; S244-K247 PolarHBondContact O-N 3.14Å; S244-K247 WeakPolarHBondContact OG-CG 3.08Å; S244-K247 PolarHBondContact OG-N 2.92Å; K247-L249 VanDerWaalsContact C-N 3.3Å; K247-L249 PolarHBondContact O-N 2.81Å; K247-K250 WeakPolarHBondContact O-CB 3.45Å; K247-K250 PolarHBondContact O-N 3.24Å; K247-W251 PolarHBondContact O-N 3.22Å
248	Q	87.3	Confident	79.6	Confident	28 Å²	28	89 Å²	89	13%	0.131	45%	0.453	C	S	.	.	H	α-helix	trans	-62	-40	173.7	-67.9	-179.2	6.5	0	0	111.3	F240 L243 S244 V245 W251 K252	F240-Q248 HydrophobicContact CD1-CG 4.38Å; F240-Q248 HydrophobicContact CE1-CB 4.31Å; F240-Q248 HydrophobicContact CE1-CG 3.95Å; F240-Q248 HydrophobicContact CE2-CB 4.48Å; F240-Q248 HydrophobicContact CE2-CG 4.3Å; F240-Q248 HydrophobicContact CZ-CB 3.93Å; F240-Q248 HydrophobicContact CZ-CG 3.92Å; F240-Q248 PolarHBondContact O-NE2 3.32Å; L243-Q248 HydrophobicContact CB-CG 3.96Å; L243-Q248 PolarHBondContact O-NE2 3.5Å; S244-Q248 PolarHBondContact O-N 3.39Å; V245-Q248 PolarHBondContact O-N 3.03Å; Q248-W251 PolarHBondContact O-N 3.15Å; Q248-K252 WeakPolarHBondContact O-CG 3.44Å; Q248-K252 PolarHBondContact O-N 3.45Å; Q248-K252 VanDerWaalsContact O-N 3.09Å
249	L	82.1	Confident	77.5	Confident	80 Å²	80	90.2 Å²	90.2	42%	0.419	47%	0.466	S	S	.	.	H	α-helix	trans	-63.7	-41	172.5	-91.2	150.3	0	0	0	112.2	V245 E246 K247 W251 K252 N253	V245-L249 HydrophobicContact CG1-CD1 3.92Å; V245-L249 WeakPolarHBondContact O-CB 3.45Å; V245-L249 PolarHBondContact O-N 3.34Å; E246-L249 WeakPolarHBondContact O-CB 3.46Å; E246-L249 PolarHBondContact O-N 3.26Å; K247-L249 VanDerWaalsContact C-N 3.3Å; K247-L249 PolarHBondContact O-N 2.81Å; L249-W251 VanDerWaalsContact C-N 3.3Å; L249-W251 PolarHBondContact O-N 2.82Å; L249-K252 WeakPolarHBondContact O-CB 3.48Å; L249-K252 PolarHBondContact O-N 3.31Å; L249-K252 VanDerWaalsContact O-N 3.07Å; L249-N253 PolarHBondContact O-N 3.27Å
250	K	85.5	Confident	75.3	Confident	106 Å²	106	88.4 Å²	88.4	46%	0.461	47%	0.471	S	S	.	.	H	α-helix	trans	-57.5	-45.4	174.4	-168.8	171.6	-178.2	170.7	0	110.5	E246 K247 K252 N253 C254 N262	E246-K250 PolarHBondContact O-N 2.85Å; K247-K250 WeakPolarHBondContact O-CB 3.45Å; K247-K250 PolarHBondContact O-N 3.24Å; K250-K252 VanDerWaalsContact C-N 3.33Å; K250-K252 PolarHBondContact O-N 3.05Å; K250-N253 PolarHBondContact O-N 2.93Å; K250-C254 VanDerWaalsContact O-CB 3.25Å; K250-C254 WeakPolarHBondContact O-CB 3.31Å; K250-C254 PolarHBondContact O-N 3.27Å; K250-N262 WeakPolarHBondContact CE-OXT 3.43Å; K250-N262 PolarHBondContact NZ-OXT 3.45Å
251	W	85.3	Confident	72.8	Confident	28 Å²	28	92.7 Å²	92.7	11%	0.106	49%	0.493	C	S	.	.	H	α-helix	trans	-63.8	-33.9	175.1	-74.8	108.3	0	0	0	114	K212 F213 A216 F240 K247 Q248 L249 I261	K212-W251 HydrophobicContact CB-CE3 4.42Å; K212-W251 VanDerWaalsContact CD-O 3.22Å; K212-W251 WeakPolarHBondContact CD-O 3.32Å; F213-W251 HydrophobicContact CB-CD2 3.97Å; F213-W251 HydrophobicContact CB-CE3 4.17Å; F213-W251 HydrophobicContact CB-CG 4.15Å; F213-W251 HydrophobicContact CD2-CD2 4.04Å; F213-W251 AromaticContact CD2-CE2 3.56Å; F213-W251 HydrophobicContact CD2-CG 4.37Å; F213-W251 AromaticContact CD2-CZ2 3.83Å; F213-W251 HydrophobicContact CD2-CZ2 3.83Å; F213-W251 AromaticContact CD2-NE1 3.57Å; F213-W251 HydrophobicContact CE2-CZ2 4.46Å; A216-W251 HydrophobicContact CB-CH2 3.76Å; A216-W251 HydrophobicContact CB-CZ3 3.65Å; F240-W251 HydrophobicContact CE2-CB 3.93Å; F240-W251 HydrophobicContact CE2-CG 4.15Å; K247-W251 PolarHBondContact O-N 3.22Å; Q248-W251 PolarHBondContact O-N 3.15Å; L249-W251 VanDerWaalsContact C-N 3.3Å; L249-W251 PolarHBondContact O-N 2.82Å; W251-I261 HydrophobicContact CH2-CD1 3.78Å; W251-I261 HydrophobicContact CH2-CG1 4.47Å; W251-I261 HydrophobicContact CZ2-CD1 4.11Å
252	K	82	Confident	70.3	Confident	59 Å²	59	97.4 Å²	97.4	26%	0.257	52%	0.518	S	S	.	.	H	α-helix	trans	-63.2	-46.6	174.5	-69.5	169	-173.1	173.7	0	111.1	K212 Q248 L249 K250	K212-K252 PolarHBondContact NZ-O 3.48Å; Q248-K252 WeakPolarHBondContact O-CG 3.44Å; Q248-K252 PolarHBondContact O-N 3.45Å; Q248-K252 VanDerWaalsContact O-N 3.09Å; L249-K252 WeakPolarHBondContact O-CB 3.48Å; L249-K252 PolarHBondContact O-N 3.31Å; L249-K252 VanDerWaalsContact O-N 3.07Å; K250-K252 VanDerWaalsContact C-N 3.33Å; K250-K252 PolarHBondContact O-N 3.05Å
253	N	79.3	Confident	69.2	Low	134 Å²	134	94.5 Å²	94.5	72%	0.717	51%	0.508	S	S	*	.	H	α-helix	trans	-86.7	-14.3	-175.7	-65.3	-14.2	0	0	0	114.1	L249 K250 A255	L249-N253 PolarHBondContact O-N 3.27Å; K250-N253 PolarHBondContact O-N 2.93Å; N253-A255 PolarHBondContact O-N 2.88Å
254	C	71.1	Confident	68.2	Low	21 Å²	21	97.3 Å²	97.3	14%	0.142	52%	0.524	C	S	.	.			trans	-63.7	122.4	179.1	-155.3	0	0	0	0	109.3	K212 K250	K212-C254 WeakPolarHBondContact CD-O 3.49Å; K212-C254 WeakPolarHBondContact CE-O 3.24Å; K212-C254 PolarHBondContact NZ-O 3.24Å; K250-C254 VanDerWaalsContact O-CB 3.25Å; K250-C254 WeakPolarHBondContact O-CB 3.31Å; K250-C254 PolarHBondContact O-N 3.27Å
255	A	58.2	Low	67.1	Low	69 Å²	69	99.5 Å²	99.5	57%	0.57	53%	0.53	S	S	*	.			trans	-71.3	133	158.4	0	0	0	0	0	107.2	N253 T257	N253-A255 PolarHBondContact O-N 2.88Å; A255-T257 VanDerWaalsContact C-N 3.27Å; A255-T257 PolarHBondContact O-N 2.93Å
256	L	55.6	Low	66	Low	98 Å²	98	99.2 Å²	99.2	51%	0.513	52%	0.524	S	S	.	.			trans	-71.4	91.5	168.7	-76	164.4	0	0	0	106.5	K212 L215 A216	K212-L256 HydrophobicContact CG-CD1 4.13Å; K212-L256 HydrophobicContact CG-CG 4.35Å; L215-L256 HydrophobicContact CD2-CD1 3.91Å; A216-L256 HydrophobicContact CB-CD2 4.48Å
257	T	50	Low	64.9	Low	89 Å²	89	95.5 Å²	95.5	55%	0.546	51%	0.51	S	S	.	.			trans	-85.6	130.7	164.3	50.4	0	0	0	0	107.3	A255 N259 G260	A255-T257 VanDerWaalsContact C-N 3.27Å; A255-T257 PolarHBondContact O-N 2.93Å; T257-N259 PolarHBondContact O-N 3.33Å; T257-G260 PolarHBondContact O-N 2.92Å; T257-G260 PolarHBondContact OG1-O 3.18Å
258	E	49.7	Very low	63.6	Low	197 Å²	197	93.3 Å²	93.3	92%	0.921	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-17.4	-172.9	-70	-178.9	157.8	0	0	114
259	N	48.8	Very low	61.9	Low	164 Å²	164	98 Å²	98	88%	0.877	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.5	24.8	-172.9	-68.1	-18.8	0	0	0	116.1	T257	T257-N259 PolarHBondContact O-N 3.33Å
260	G	44.1	Very low	60.3	Low	45 Å²	45	99.4 Å²	99.4	46%	0.464	54%	0.543	S	S	.	.			trans	99	159.3	169.1	0	0	0	0	0	114.8	T257 N262	T257-G260 PolarHBondContact O-N 2.92Å; T257-G260 PolarHBondContact OG1-O 3.18Å; G260-N262 PolarHBondContact O-N 2.7Å
261	I	38.5	Very low	58.2	Low	91 Å²	91	98.8 Å²	98.8	47%	0.467	55%	0.55	S	S	.	.			trans	-68.5	117.3	-166.9	-55.6	163.3	0	0	0	109.7	W251	W251-I261 HydrophobicContact CH2-CD1 3.78Å; W251-I261 HydrophobicContact CH2-CG1 4.47Å; W251-I261 HydrophobicContact CZ2-CD1 4.11Å
262	N	36.2	Very low	55.8	Low	191 Å²	191	105.3 Å²	105.3	100%	1.021	59%	0.59	S	S	*	*			trans	-95.5	0	152.8	-103.4	-48.7	0	0	0	109.1	K250 G260	K250-N262 WeakPolarHBondContact CE-OXT 3.43Å; K250-N262 PolarHBondContact NZ-OXT 3.45Å; G260-N262 PolarHBondContact O-N 2.7Å

Retrieved 262 of 262 residues in 204.1 ms (Link to these results)

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